IDs,SMILES,scaffold_folds SC98-0239,CC(C)n(c1c2CN(Cc3cn(C)nc3C)CC1)nc2-c1ncc(C)o1,0 F3007-0159,C=CCN1C(SCc2nc(cccc3)c3[nH]2)=Nc(cccc2)c2C1=O,2 E518-0230,COc1ccc(Cn2c(C(O)=O)c(CNC3CCCC3)c3c2cccc3)cc1,0 S787-0933,O=C(CCc1ccc(CC(CC2)CCN2C(c2cscc2)=O)cc1)NC1CC1,2 F6605-0101,Cc1nc(CCC2)c2c(N2CC(CN(C(C=C3)=O)N=C3c3ccncc3)C2)n1,2 E781-0727,CC(C1)OC(C)CN1c1nc(Nc2cc(OC)ccc2)c(cnn2C)c2n1,0 Z4529729646,CCc1nc(COC([C@@H]2C[C@@H](C3)C=CC[C@@H]3C2)=O)cs1,2 Z1796037887,CC(C)NC(c1c(CC(CNc2ncnc(C)c2)CC2)n2nc1)=O,2 Z451839502,COCc(cccc1)c1NC(C(C1)c(cccc2)c2NC1=O)=O,0 5042-0222,Cc(cc1)cc2c1oc(-c1cccc(N(C(c3cccnc33)=O)C3=O)c1)n2,2 Z4619797856,Cc1cccc(C(CNC(C2(CC3)CCC3CC2)=O)N2CCOCC2)c1,2 F6802-9533,O=C(CN(CC1)CCC1Oc1nccs1)NCc1ccco1,2 Z2099861104,CC(C(CC1)N2CCCC2)N1C(Cc1cncn1Cc1ccccc1)=O,2 Z1270412039,CC(CNC(c1cnc(C)cc1)=O)(C(O)=O)O,0 Z4120245968,Cc1cc(C(NCCc2nc(-c(cc3)ccc3Cl)n[nH]2)=O)cc(F)c1,0 Z1576057897,Cc(n(C)nc1)c1C(N(CC1)CC=C1c1cc(C)ccc1)=O,0 F6475-2351,O=C(c(cc1)cnc1OCC1OCCC1)NCCc1cccs1,2 Z2489742476,Cc(nc1)cnc1C(NC(CC1C(O)=O)c2c1cccc2)=O,0 C200-2009,CCC(C)NC(CSC(N(CCCC(NC1CCCCC1)=O)C1=O)=Nc2c1sc1c2cccc1)=O,2 Z2991032502,O=C(C[C@@H]1CNCC1)NS(c1c2OCCc2cc(Cl)c1)(=O)=O,2 Z4497727189,CC(c1nc(C(F)(F)F)cs1)NC(C(CC(C1)O)N1C(Cc(cccc1)c1F)=O)=O,2 Z2057483558,CC(C(Nc(cc1)cc(Cl)c1Cl)=O)N(CC1)CC1c1nc(C)no1,2 D226-0097,Cc1nc(SCCn2c(N3CCN(C)CC3)nc(N(C)C(N3C)=O)c2C3=O)nc(C)c1,2 T159-1420,Cc1cnc(CC2CN(Cc3c(C)ncs3)CCC2)n1Cc(cc1)ccc1F,2 SA58-0871,CC1(CC1)C(N1C(CCc2noc(-c3ncccc3)n2)CCC1)=O,2 Z27723103,CC(c1ccccc1)NC(C1=Cc(cc(cc2)Br)c2OC1=O)=O,0 S721-1188,O=C([C@H](C[C@@H](C1)Oc2cnccc2)N1S(c1cnccc1)(=O)=O)NC1CC1,2 Z2763917213,CC(Cn1nnc(C(c2ccc(C(F)(F)F)cc2)=O)c1)O,2 F5919-0084,O=C(C(CC1)CCN1C(Nc1cccs1)=O)NCc(cccc1)c1Cl,2 G008-4237,CC(CN(CC1)S(c2ccc(-c3cc(C)no3)s2)(=O)=O)N1c1cc(C)ccc1,0 F0196-1319,CCc(c(OC)c1)cc(-c2n[nH]c(C)c2-c(cc2)cc3c2OCCO3)c1O,2 P074-3805,O=C(c(cc(cc1)F)c1F)NC(c1nnc(N2CCCC2)o1)c1ccccc1,0 Y031-7055,CC(CCC1)CN1C(CCn1c(C(N(C)C(N2C)=O)=O)c2nc1)=O,2 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F6562-5857,CC(C)(C)SCC(CCCC1)N1C(COC)=O,0 F6791-6565,Fc(cc1)ccc1OCCNc1ncnc(-n2nccc2)c1,2 Z4919506645,CC(C)(C)CN(c(c(C(N1CCC(CNC(c2ncccc2)=O)CC1)=O)ccc1)c1N1)C1=O,2 F6521-7278,Cn(cc1)c2c1cc(C(CNC(c(cccc1)c1Cl)=O)O)cc2,0 Z1282826921,Cc1c(CNC(NCc2cn(C)nc2)=O)sc(C)n1,0 F0208-0013,CC(C)CNC(COc1cccc2ccccc12)=O,0 F0359-0200,COc(cccc1)c1-c1csc(NC(c(sc2c3cccc2)c3Cl)=O)n1,2 F6529-4010,COC(c1cccc(CN(CC2)CCC2N(CC(N2CC(F)(F)F)=O)C2=O)c1)=O,0 Z2440301391,CC(CNC)CNC(c1cc(Nc2nnc(C)cc2)ccc1)=O,0 Z1906921735,CC(CN(C)C(C1OC(C)(C)CC1)=O)c1nnn[nH]1,2 SB95-1232,Cc1noc(C)c1CC(N(CCC1)CC1N(CCN1CCOCC1)C(C1CC1)=O)=O,2 F6667-0852,O=C(C(C1)CC1(F)F)Nc(ccc(Cl)c1)c1F,0 V014-0816,Cc1c(CN(CCN2CCOCC2)CC(COc(cc2)ccc2Cl)O)cccc1,0 8525-0265,O=C(CC1NCCc2c[nH]c3c2cccc3)N(CCc2ccccc2)C1=O,2 Z2086209764,CCc1ccc(C(CNC(c2c[nH]nc2-c(c(F)ccc2)c2F)=O)O)cc1,0 Z3268495815,CC(C)(C)c1noc(Cc2c[nH]c3nccc(Cl)c23)n1,2 G855-2066,O=C(C1CCC1)N(CCC1)c(cc2)c1cc2S(NC1CC1)(=O)=O,2 Z3482012936,Cc(ncc(NC(c1cn(C)nc1-c(cccc1)c1OC)=O)c1)c1Br,2 F2145-0056,CC(C)(Cc1ccc2)Oc1c2OCc(cc1)ccc1C(O)=O,2 Z1954689885,CC(C)(C1)OC2(COCC2)CN1C(c1c[nH]nc1-c1cc(cccc2)c2o1)=O,2 Z1603582982,CC(C)Oc(cc1)ncc1C(NC(C)(C1CC1)C(O)=O)=O,0 Z1941761984,O=C(C(C1)Oc(cc2)c1cc2Br)N(CC1)CC1NC(Nc(cc1)ccc1F)=O,2 Z1783494958,Fc1ccc(C2CN(Cc3c[nH]nc3-c3cscc3)CC2)cc1,2 F6175-0064,Cc1nccn1-c1cc(N(CC2)CCC2C(Nc(cccc2)c2C(OC)=O)=O)ncn1,0 Z2438284146,O=C(CCC1CCNCC1)Nc(cc1)cc(F)c1OC1CCCC1,2 S828-1929,O=C(c1nccnc1)N(CC(C1)(F)F)[C@@H]1c1nnc(-c2ccccc2)o1,2 Z3295095730,OC(C(N(CC1)Cc2c1[nH]nc2)=O)c1cc(F)cc(F)c1,0 F6556-5938,O=C(c1cc(Br)cnc1)N(CCC1)CCN1C1CCC1,2 Z2327437277,OC([C@@H](CCC1)CN1C(c1ncncc1)=O)=O,0 Z2701590591,Cc1csc2ncnc(NC(c3ccnn3C)c3ccnn3C)c12,2 8017-2405,COc1cc(C(C(CC=C2)C2c2cc(F)c3)Nc2c3F)cc(Br)c1OC,0 F1685-0063,CC(C)(C)OC(N(CCC1)C1C(Nc(cc1)ccc1OC)=O)=O,0 D337-1412,O=C(c1noc(-c(cc2)cc3c2OCCO3)c1)N(Cc1cc(F)ccc1)C(CC1)CS1(=O)=O,0 Y043-4176,N\1(C(c2c(\N=C1)cccc2)=O)CC(N1CC2\C=3\N(C(\C=C/C3)=O)CC(C1)C2)=O,0 Z3019547600,COc1cccc(CCNC(C2NCCOc3c2cccc3)=O)c1,0 Z812333222,CCCN(C(CC1)Cc2c1cccc2)C(c1c(C)n(-c2ncccc2)nc1)=O,2 K788-2044,COc(cc1)ccc1N1CC(CNC(Nc(ccc(OC)c2)c2OC)=O)CC1,0 F6482-3279,CN(C(C=C1)=O)N=C1C(N(C1)CC1n1nccn1)=O,2 Z2910220857,OC(CCN(CC1OCCC1)C(c1c[nH]cc1)=O)=O,0 SA72-1038,Cc1c(C(N(CC2)CCC2(CCOC)c2noc(C3CCOCC3)n2)=O)sc(C)n1,2 T427-1135,CN(CCN(C1)S(c2cc(OC)ccc2)(=O)=O)C1c(cc1)ccc1OC,2 Z729758330,Cc1c(cc(cn2)C(N3CCCCCC3)=O)c2n[nH]1,2 F6812-1643,Cc1cc(N(CC2)CCN2c2nc(-c3cnccc3)ccn2)nc(C2CC2)n1,2 Z2647939836,OC(C(N1Cc2nccnc2CC1)=O)c1cccc(C(F)(F)F)c1,2 S831-2648,CC(C)c(cc1)ccc1C(N(C[C@@H]1CO)C[C@@H]1c1ncccc1)=O,0 Z1834089345,CCC(NC(C(N(CC1)C(C)CN1c(cccc1)c1F)=O)c1ccccc1)=O,0 F6523-0350,O=C(Cc(cc1)cc2c1OCO2)N(CC1)CCN1c1cc(C(F)(F)F)ncn1,2 Z1833678601,CNC(CN(CC1)CCN1C(Nc1cnns1)=O)=O,0 C174-0780,CCCCn1c(cccc2)c2nc1CCCNC(C)=O,0 F2634-0798,O=C(c(o1)ccc1Br)N(Cc1ncccc1)c1nc(c(C(F)(F)F)ccc2)c2s1,0 E852-0963,CC(C)CCNC(C(C)(Cn(c1c2)nc2C(NCCc(cc2)ccc2Cl)=O)N(C)C1=O)=O,2 S689-0490,O=C(C(C1)CN(C(C2)CN2C(NC2CCCCC2)=O)C1=O)N1CCCC1,2 F2540-0536,Cc1cc(NC(Cn2c(cccc3)c3c(S(Cc(cccc3)c3F)(=O)=O)c2)=O)ncc1,2 F6761-7733,COc(ccc(S(N(CC1)C(C2)C1CN2c1nccc(C(F)(F)F)c1)(=O)=O)c1)c1F,2 F6553-8811,O=C(CCC1=O)N1c(cc1)ccc1S(N(C1)CC1N1CCCC1)(=O)=O,2 Z1983233097,Cc1c(C(NC(CN2CCOCC2)c2ccc(C)cc2)=O)sc(C2CC2)n1,2 Z2376842498,OC(c1ccc(CNC(CCC2CCC2)=O)s1)=O,2 F1105-0088,CN(C(c1cccc(NC(c(cc2)ccc2C(OC)=O)=O)c11)=O)C1=O,0 SA57-0408,Cc1noc(C)c1C(N(CC1)CCC1(C1)OCCC1Oc1nccnc1)=O,2 Z2393399371,CC(C)CC(CN)NC(C1=CC=CN(C)C1=O)=O,0 SC67-0651,CCCn1c(C(CN(C)C2)C22CCN(Cc3c(C)ncs3)CC2)nnc1,2 Z2297821152,COc1c(CN(CC2)C([C@H](Cc3ccccc3)O)=O)c2ccc1,0 F6355-0157,OC(CNC(c1cccc(Br)c1)=O)c1cocc1,0 Y020-9151,O=C(C1=CC(C(CC(C2)c3cccs3)=O)=C2NC1=O)NC1CCCC1,2 G743-0262,O=C(c1ccc(C(Nc2c3cccc2)NS3(=O)=O)cc1)NCCCN(CCC1)C1=O,2 S725-1805,COCC(NC(CC1CC1)(CC1)CCN1C(C1(CC1)c(cc1)ccc1OC)=O)=O,0 Z1157859739,CC(c1ccco1)(C(N1Cc2noc3c2CCCC3)=O)NC1=O,2 F6482-2209,CN(C(C=C1)=O)N=C1C(NC1CC2OCCOC2CC1)=O,2 Y031-4206,COC(CNC(C(C1)CN(CCc(cc2)ccc2F)C1=O)=O)=O,0 Z1277983144,CN(C=CC=C1NC(N2CCN(Cc(cc3)ccc3F)CCC2)=O)C1=O,2 C880-2758,O=C(CN(C1=O)N=Cc2c1n(Cc1cccc(Cl)c1)c1c2cccc1)NCCCc1ccccc1,0 F6454-2486,Cc1nccc(N2CCC(CNC(C(NCCC3=CCCCC3)=O)=O)CC2)c1,2 G421-1081,COc(cccc1)c1N(CC1)CCN1c1nc(CCN(Cc2cccc(Br)c2)C2)c2cn1,0 Z1517366834,CC(CC1)CCC1N(C1CC1)C(c1coc(S(N(C)C)(=O)=O)c1)=O,2 F2334-0051,CCOC(c(cccc1)c1NC(CN(C1=O)N=C(N(CC2)c3ccccc3)N2C1=O)=O)=O,0 F6725-0032,COc1ccnc(N(CC2)CCC2S(c2ccccc2)(=O)=O)n1,0 Z1131312589,CN(C=CC=C1C(NCCc2coc(-c(cc3)ccc3F)n2)=O)C1=O,0 Z1155566884,Cc1c(C(N(CCCC2)C2c2cc(cccc3)c3[nH]2)=O)[nH]c(CCC2)c1C2=O,2 V007-5651,Cc(cccc1)c1OCC(CN(Cc(cc1)ccc1OC)C1CC1)O,0 F6506-1587,OC(CNC(COCc1ccccc1)=O)(c1cccs1)c1cccs1,2 F6754-9284,COc1ccc(CCNc2nccc(C(F)(F)F)n2)cc1,0 Z4425070045,O=C(c(cc1)ccc1N1CCCCCC1)N(CC1)CCC1Oc(nccc1)c1F,2 E646-0016,CC(CN(CC1=O)S(C)(=O)=O)(C(NC2CCCC2)=O)N1c(cc1)ccc1Cl,2 Y040-3226,O=C(CNC(C1Oc(cccc2)c2OC1)=O)NCCc1c[nH]c2c1cccc2,2 S662-0252,COc(cc1)cc(S(N(CC2)CCC2(CC2)C2N2CCOCC2)(=O)=O)c1OC,0 SA70-0580,Cc1noc(C)c1C(N(CCC1)CC1(CCOC)c1noc(C)n1)=O,2 S069-3967,COc(cc1)ccc1S(N(CC1)CC1c1noc(C2CC2)n1)(=O)=O,2 Z2983330276,COc(cc1)ccc1-c1noc([C@]2(CNC3)[C@@H]3CCOC2)n1,0 F129-0404,Cc(cc1)cc(NC(NC(C(Oc2c3cccc2)=O)=C3NC2CCCC2)=O)c1OC,0 S570-0230,CN1C2=CCCCC2(CNC(Nc(cccc2)c2F)=O)CCC1=O,0 Z1172800035,CC(c(cc1)ccc1S(N(C)C)(=O)=O)NC(C1(CCOCC1)c1ccc(C)cc1)=O,0 Z2234946180,CCC(C1)(CN1C(NC1=CC=CN(CC(F)(F)F)C1=O)=O)O,0 F2794-0120,Cc(cc1C)cc(C)c1S(Nc(cc1)ccc1N(CCCC1)S1(=O)=O)(=O)=O,2 T502-0572,N#Cc(cc1)ccc1S(N(CC1)CCC1(C(N1CCOCC1)=O)F)(=O)=O,0 SA85-0402,OC(CN(CCc1ccccc1)C(C1)=O)CN1C(Cn1cncc1)=O,2 SC88-0424,COc(cc1)nc(OC)c1C(N(C1)CC1(C(CC1)c2nc(C3CCCC3)no2)S1(=O)=O)=O,0 F6796-3428,CC(C)(C)c(nc1cc2)cn1nc2OCC(CC1)CN1c1nc(C2CC2)ns1,2 Z649879458,O=C(CNC(C(CC1=O)CN1c(cccc1)c1Cl)=O)N1CCCCC1,2 Z1263731035,COc(cc(cc1)Cl)c1S(N(CCOC1)C1C(O)=O)(=O)=O,0 Z2055053525,CO[C@H](C[C@H]1c2nnc3n2CCC3)CN1C(c1cc(cccc2)c2o1)=O,2 F6508-0639,Cc1c(C(NCC(c2cscc2)c2ccco2)=O)c(C)nn1C,0 P328-0664,CCCN(C=Cc1c2c(C(NC(C)c3ccc(CC)cc3)=O)c(C)o1)C2=O,2 8017-2694,CCN1C(CNCc2cccc(OC)c2OCc(cc2)ccc2F)CCC1,2 F673-0224,CN(c1ncccc1N=C1N(CC2)CCN2C(Nc(cc2)cc3c2OCCO3)=O)C1=O,0 S940-0361,COc(cc1)ccc1-c1n[nH]cc1CN1CC(Cc2nc(-c3ccncc3)no2)C1,2 F6722-1089,COc(cccc1)c1N(CC1)CCN1c1nccn2nccc12,0 S466-0198,Cc1cc(N=C(CCCC2)N2C2=O)c2n1CC(N(CCC1)c2c1cccc2)=O,2 F6524-1935,O=C(c1cc(cccc2)c2s1)N(CC1)CC1c1nocn1,2 S823-2536,OC[C@@H](CN(C1)c2ncccn2)[C@H]1NC(c1cocc1)=O,0 F2879-2070,O=C(C(NCc(cc1)ccc1F)=O)NCCc(cc1)ccc1Cl,0 F2539-1161,O=C(C1c(cccc2)c2Oc2c1cccc2)NC(CC1=O)CN1c(cc1)cc2c1OCCO2,2 F6559-1461,CS(N(CC1)CCC1C(NC(CC1)CCC1(F)F)=O)(=O)=O,0 Z1497718061,CN(c(cc(cc1)C(NCc2cc(CCCC3)c3s2)=O)c1N1)C1=O,2 F6451-1641,Cc1c(C(CNC(c(s2)ccc2Cl)=O)OC)cccc1,0 F6656-4416,O=C(c1c2OCCOc2ccc1)N(CC1)CCC1N1N=C(C2CC2)C=CC1=O,2 F3406-9853,O=C(c(nc1)cn1-c1ncnc(N2CCOCC2)c1)NCc(cccc1)c1F,2 F5857-6504,OC1(CNC(COc(cccc2)c2F)=O)C=CCCC1,0 Y503-3725,CCn1ncc(NC(C(CCC2)CN2S(c2c(C)n(C)nc2)(=O)=O)=O)c1C(N1CCOCC1)=O,0 Z2348417338,CC(C=CN(C)C1=O)=C1NC([C@@H](C1)[C@H]1c1cc(C#N)ccc1)=O,0 Y044-5100,N1(C(Nc2c(C1=O)cccc2)=O)[C@H](C(Nc1cnccc1)=O)c1ccccc1,2 Z3368802208,CC(C1CCC1)c1nc(Cc2cccc(S(N)(=O)=O)c2)no1,2 V028-7365,CC(C(N(CC1)c(cc2)cc(OC)c2OC)=O)N1C(COc(cc1)ccc1Cl)=O,0 Z3347732769,CC(C)(CN(CCC1)CC1c1nc(C(O)=O)cs1)c1ccccc1,2 F6523-1865,O=C(c1cccc(C(F)(F)F)c1)NC(CC1)CCN1c1n[nH]c(C2CC2)c1,2 Z3056193771,CC(C(C)(C)CNC(c(cc1)ccc1Cl)=O)O,0 S606-1233,CCN(c1cccnc1N1[C@H](CC2)CN2C(c2cc(Br)cnc2)=O)C1=O,0 F6482-7600,CCN(C=C1C(NCc2cccnc2-c2cccs2)=O)c(nc(C)cc2)c2C1=O,2 S212-0841,Cc1c(CN(CCC2)CC2OCc2nc(C3CC3)no2)scn1,2 F6495-2813,Cc1cccn2c1nc(-c(cc1)ccc1F)c2NC(c1ncnc(N2CCOCC2)c1)=O,2 Z2439957559,CN(C1CCNCC1)C(CCc1nc(-c(cc2)ccc2OC)no1)=O,2 Z1720975807,CC(C)(CNC(c1coc(C2CCOCC2)n1)=O)c(cc1)ccc1Br,0 Z2090072458,O=C(C(CCC1)c2c1cccc2)NC(CCC1)CN1C(N1CCCC1)=O,2 F6658-4774,Cc1c(CCC(N(CC2)CCN2C(NC(N2C)=O)=CC2=O)=O)scc1,2 F0771-1094,Cc1nc(oc(C(c2ccccc2)=O)c2N)c2c(COC)c1,2 F6475-2891,CCOC(c1c(NC(c2cc(OCCOC)ncc2)=O)n(C)nc1)=O,2 7213-0156,O=C(CSc1nc(-c2c(CC3)cccc2)c3c(C(F)(F)F)n1)N1CCOCC1,2 Z995122560,OC(C(C1CC1)NC(COc(ccc(Cl)c1)c1Cl)=O)=O,0 D319-0401,Cc1c(C(Nc2c(C(NC(CC3)CS3(=O)=O)=O)c(CCC3)c3s2)=O)snn1,2 F6359-5124,Cc1cc(S(N(CC2)CCC2Oc(nccc2)c2Br)(=O)=O)c(C)cc1,0 Z1959825072,CS(c(cc1)ccc1-c1noc(Cc2cc([nH]nc3)c3cc2)n1)(=O)=O,2 D750-1404,OCCCNC(CC1(CCN(Cc2ccccc2)CC1)N(Cc1c2cccc1)C2=O)=O,0 F6812-1398,O=C1N(CC(F)(F)F)CCC1N(CC1)CCN1c1nc(-c2ncccc2)ccn1,2 F5847-0169,N#CC1(CC1)C(Nc(cc1)ccc1Oc1ccccc1)=O,0 S997-1183,Cc1nc(S(N2C[C@@H](CN(C3)S(C)(=O)=O)[C@]3(COC)CC2)(=O)=O)cn1C,0 Z3018949702,CC(C)NC([C@]1(CNC2)[C@@H]2CCOC1)=O,2 Z2362298137,OC(Cc1cccc(NC(Nc2ccnn2CC2CC2)=O)c1)=O,2 Z3059977274,CC(C1)N(C(c2cn(CC=C)nn2)=O)c(cc2)c1cc2Cl,2 F6443-8015,O=S(Cc(cccc1)c1Cl)(NCC(CCC1)N1c1ccccc1)=O,0 F5069-0084,COc1cn(-c(cc2)ccc2F)nc1C(Nc(cccc1)c1SC)=O,0 Z4511739097,CC(C(NCc1ccc(C(F)(F)F)cc1)=O)n1nnc(COc(cc2)ccc2Cl)c1,0 Z2691058351,OCC(c1ccc(C(F)(F)F)cc1)NC(c1noc2c1COCC2)=O,2 S687-0081,Cc1c(C(N(CC2)CCC22OCCC(Cc3nc(C)no3)C2)=O)sc(C)n1,2 F6481-3765,O=C(c1cc2c(-c3ccccc3)onc2cc1)N(CC1)CCSC1c1ccco1,2 Z1662534004,C(Cc1nnc(-c2cccc3ncccc23)o1)c1nc(-c2cocc2)no1,2 F5614-0442,Cn1c(cccc2)c2nc1CN(CC1)CCN1C(c1cc(cccc2)c2o1)=O,0 Z1517859252,CCC(CCO)NC(c1cc(Cl)cn1C)=O,0 Z1258734885,CCC(C)(CNC(c1cnns1)=O)O,0 D516-0316,CC(c1c2cccc1)=NN(CC(Nc(cc1)cc3c1n(C)c(CCNC(C1CC1)=O)n3)=O)C2=O,2 Z3628025362,O=C(c1cn2ncc(Br)c2cc1)N1CC(c2ccccc2)NCCC1,2 Z4921802868,CC(C)CC(N(C1)CC1(CC1)CN1C(c1cc2cccnc2s1)=O)=O,2 Z877706050,Cc(cc(cc1)NS(N2CCOCC2)(=O)=O)c1C(O)=O,0 G765-0589,COc(cc1)cc(C2)c1OCC2NC(NCCCN(CC1)CCN1c1cccc(Cl)c1)=O,0 F2318-0275,Cc1cc(C)nn1-c(cc1)nnc1N(CC1)CCN1C(c1cccc(Br)c1)=O,0 C300-0169,O=C(CCS(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O)N(CC1)CCN1c(cc1)ccc1F,2 D473-1989,CC(C)c1cc(C(Nc2cc(C)cc(C)c2)=O)nn1C(CC1)CS1(=O)=O,0 Z760096582,CC(C(NCc1cccc(C(O)=O)c1)=O)N,0 SD12-0089,Cc1noc(CC(C(NCC2)=O)N2C(COc(cc2)ccc2F)=O)n1,2 F6806-6674,O=C(C1CC1)NC(CCC1)CN1c1ncnc2c1cc[nH]2,2 Z2008127552,CCN(C(CC1)CCN1c1nnc(-c(cc2)cnc2Cl)n1C)S(C)(=O)=O,2 Z1951209604,CC(N(C[C@@H](C1)O)[C@H]1C(NCc(cc1)cc(C)c1Oc(cc1)ccc1F)=O)=O,0 F1345-0652,Cc(cc1)ccc1S(NCCCCCC(N1CCOCC1)=O)(=O)=O,2 F6439-2335,Cc1cc(C(NCCn(c(C2CC2)c2)nc2-c2ccncc2)=O)c(C)o1,2 Z31182183,Cc1c(C)sc2nc(-c3cnccc3)nc(N(CCC3)CC3C(N)=O)c12,0 F6442-1752,CC(C)CS(C(C1)CN1C(CCc1c(C)ccs1)=O)(=O)=O,2 F2874-0060,CN(C(C=C1)=O)N=C1c1cccc(NC(COc(cc2)ccc2Cl)=O)c1,2 Z2060902531,Cc1nn(C)c2nc(C3CC3)cc(C(N(C3)[C@H](CO)C[C@@H]3F)=O)c12,0 J006-2920,CCc1c(C2N(Cc(cccc3OC)c3OC)CCC2)c(C)no1,0 D340-2100,CC(C)(C)CNC(c1c(C(NC2CCCC2)=O)nc[nH]1)=O,0 S639-3457,CN(C)C[C@@H](CN(C1)S(C)(=O)=O)[C@H]1NC(c1cn(C)nc1)=O,0 F6608-2335,Fc(cn1)cnc1OC(CC1)CCN1c(nc1)ncc1Br,0 Z1686711653,CC(C(Nc1cc(C(C)=O)ccc1)=O)Nc1cn(CC2OCCC2)nc1,0 F2692-0452,CC(C)CCN(C1=O)C(SCC(Nc2c(C(F)(F)F)cccc2)=O)=Nc2c1oc1c2cccc1,2 F5324-0782,CN(CC1)CCN1c1nc(ccc(NC(C(CC2=O)CN2c2ccccc2)=O)c2)c2s1,2 F1713-0001,O=C(COc(cc1)ccc1C(CC1c2ccco2)=NN1C(c1cccs1)=O)N1CCCCC1,2 S903-1540,CN(C)C(N(CC1)CCC1c1nnc(C2)n1CCN2C(CCc1ccccc1)=O)=O,0 Z2286065747,Cc1nsc(C)c1-c1noc(CC2C(CC3)OC3C2)n1,2 F5856-0135,O=C(c1csc(-n2cccc2)n1)NCc1ccco1,2 Z1233185257,CC(CC(NC(C)c1nc(C)cs1)=O)N,0 SB21-0530,Cn(cc1)nc1C(N(C1)[C@H](Cn2nnc(C(N(CC3)c4c3cccc4)=O)c2)C[C@@H]1F)=O,2 Z1561055867,Cc1cc(NS(c2c(C)oc(C(O)=O)c2)(=O)=O)nn1CCC#N,2 Z2797271646,CCc1nn(C)c(C(NC2(CCCC2)c2noc(C)n2)=O)c1,2 F6656-3452,Cc1cc(C(N2CCC(COc3nnc(CCCC4)c4c3)CC2)=O)nn1C,2 SA73-1121,O=C(c1cscn1)N(CC1)CCC1(CC1CC1)c1noc(-c2ccncc2)n1,2 F6619-6323,C(C1)C1c1nccc(N(CC2)CCN2c2ncnc(N3CCCC3)c2)n1,2 SA49-1447,COc(ccc(Cl)c1)c1C(N(C1)CC11OCC(CC(N2CCOCC2)=O)C1)=O,0 F2679-0151,O=C(COc1c(CCNC2=O)c2ccc1)Nc1cccc(C(F)(F)F)c1,2 F5033-5879,CN(C=CC=C1C(NCC(CC2)CCN2C(c2cccnc2SC)=O)=O)C1=O,2 SB25-1049,CCN(Cc1ccncc1)C(C(CC1)CCC(N=C(c(cc2)ccc2F)N2)=C1C2=O)=O,2 F3225-0828,Cc(cc1)cc(C)c1S(N1c2nc3ccccc3nc2N(CC2OCCC2)C1)(=O)=O,2 F3165-1612,CCOc(cc1)ccc1N(C(CS(C1)(=O)=O)C1N1Cc2ccc(C=C)cc2)C1=O,0 M715-0164,O=C(c(cc1)ccc1-c(cc1)cnc1N1CCCCC1)NCCCN1CCCC1,2 Z1367270686,Cc1c(C(N(C2CC2)C(CCC2)c3c2cccc3)=O)nc(-c2cn(C)nc2)o1,2 F5526-0757,O=C(NCCOc(cc1)ccc1F)NCc(cc1)ccc1Cl,2 T502-0862,O=C(C(CC1)(CCN1S(c1cnccc1)(=O)=O)F)NC1CC1,2 F5834-3139,O=C(C1CC1)N(CC1)Cc2c1ccc(NC(c1cscc1)=O)c2,2 D635-0149,CN1CCN(Cc(c(O2)c(cc3)C(c(cc4)ccc4OC)=CC2=O)c3O)CC1,0 F6792-3336,CCc1nc(SC)nc(N(CC2)CCN2C(CCN2CC(F)(F)F)C2=O)c1,0 F6526-1543,O=S(c(cc1)cc2c1OCC2)(N(CCn(cc1)nc1-c1ccncc1)C1CCCC1)=O,2 S835-1355,CC1(CC2(CCN(Cc3c[nH]nc3-c(cc3)ccc3F)CC2)OCC1)O,0 F6573-8554,CN(CC1)CCN1C(N(CCN1c(nc2)ncc2F)CC1=O)=O,2 F6353-6570,O=C(NCC(c1ccco1)N1CCSCC1)NC1(CC(C2)C3)CC3CC2C1,2 Z4088103393,Cc(cc1)cnc1C(N(CCC1)C1c(cc1)ccc1C#C)=O,0 Z2175451294,Cc1cn(C(CC2)CN2C(Cc2cccc3ccccc23)=O)nc1,0 F184-3457,CCC1Oc2cc(S(N(CCC3)CC3C(N3CCCC3)=O)(=O)=O)c(C)cc2NC1=O,2 K263-0710,Cc(cc1)c(C)cc1NC(CSC(N(CC1OCCC1)C1=O)=Nc2c1sc1c2cccc1)=O,0 F3296-0491,CCSc(cccc1)c1NC(c1c(C)n(-c2cc(C)c(C)cc2)nn1)=O,0 F6549-3563,Cc1noc(C)c1S(N1CC(Cn2ncnc2)C1)(=O)=O,2 SA16-0761,O=C(Cc1nnc(C(CC2)CCN2C(C2CCC2)=O)o1)N1CCCC1,2 Y040-4457,O=C(COc(cc1)cc(O2)c1C(C1=Cc(cccc3)c3OC1=O)=CC2=O)c(cc1)ccc1Cl,0 Z737722872,Cc(cc(cc1)OC)c1S(Nc(cc1)cc(Cl)c1F)(=O)=O,0 S700-0796,O=C(NC1CCCCC1)N(C1)CC1c1nc(CCOCC2CC2)no1,2 Z2951554543,CC1(C)COC(CCNC(Nc2ncc(OC)s2)=O)CC1,2 Z421519542,O=C(c1cc(N(CCC2)C2=O)ccc1)Nc1cccc(NS(c2ccccc2)(=O)=O)c1,2 Z1832829148,CCN(CCCN(C1)C(C(C2)c(cccc3)c3C2=O)=O)C1=O,2 D420-2659,Cc1nc(-c2cc3ccccc3nc2N(CC2)CCN2c(cccc2)c2F)no1,0 D752-0064,Cc1noc2nc(-c3ccccc3)cc(C(NCC3(CCCCC3)N(Cc3c4cccc3)C4=O)=O)c12,2 F0541-1264,O=C(c(cccc1)c1Br)Nc1c(CSC2)c2nn1-c1cc(Cl)ccc1,0 8009-5499,CC(C(N(C1c(cc2)ccc2OC)c(cc2)ccc2Cl)=O)S1(=O)=O,2 Z3369019172,CC(c1noc(Cn2nncn2)n1)Oc(ccc(Br)c1)c1Cl,0 F6471-2653,O=C(CCc1cccc(Cl)c1)N1C2C=CCC1CC2,0 F6687-6851,Cc1cccc(OCC(CCC2)CN2C(c(cccc2)c2F)=O)n1,0 Z2961351782,CCCCC1(CC1)C(NC(C)c1ccnn1C)=O,0 F6204-2753,CS(c1ccc(CCC(NC2(CCCC2)c2cccs2)=O)cc1)(=O)=O,0 Z3185032833,CCOC(C(C1)(C2(COC2)CN1C(NCc1cn(C)nc1)=O)F)=O,2 SC56-0014,Cc1nnc(C2C(C3)(CN3C(c3cccs3)=O)CN(Cc3ccccc3)C2)o1,2 Z339571560,CN(CC(N1)=Nc(cccc2)c2C1=O)C(C(C1)CN(CCOC)C1=O)=O,0 C470-0658,CC(C)CCn1c(C(N(C)C(N2C)=O)=O)c2nc1CN(CC1)CCN1c1ccccc1,0 Y043-5065,O=C(CCC(C(N1CCc2c[nH]c3c2cccc3)=O)NC1=O)N1CCOCC1,2 F6804-4823,CN(C(CC1)CCN1c(nc1)nc(OC)c1Br)c1ncccc1,0 SC89-0222,O=C(CCc1c[nH]c2c1cccc2)N(C1)CC1(C(CN1CCCCC1)CC1)S1(=O)=O,2 F6619-2843,Cc1cc(N(C)C(CC2)CCN2C(c(cccc2)c2F)=O)ncn1,0 Z1305788720,COc1c(C2(CNC(NC(CC3)c4c3c(O)ccc4)=O)CCCC2)cccc1,2 C276-1635,COc(ccc(C(C1)CC(NC(CC2c(ccc(F)c3)c3F)=O)=C2C1=O)c1)c1OC,0 Z2607676306,CC(C)(C1)C1(C(N(CC1)CCC1n1c(N)c(C(N)=O)nc1)=O)C(O)=O,2 S700-0315,O=C(C1Oc(cccc2)c2OC1)N(C1)CC1c1nc(CCOCC2CCCC2)no1,2 SC21-0311,Cc1cnc(-c2nn(C)c(CC3)c2CN3S(c(cccc2)c2Cl)(=O)=O)n1CC1CC1,0 Z1507445756,O[C@H](CC1)CC[C@@H]1NC(N1CC(Cc2ccccc2)CC1)=O,2 Z3686849934,CCn1nc(C(NCc(cc2)cnc2-n2c(C)ncc2)=O)c2c1[C@H](C)O[C@H](C)C2,0 Z1509204908,CC(Nc1cn(-c2ccccc2)nn1)=O,0 V014-2412,CC(C)NC(NC(C)C1N(Cc(cccc2)c2F)CCc(cc2OC)c1cc2OC)=O,0 S233-1655,O=C(c1nccnc1)NC[C@](CCC1)(CC2)[C@@H]1N(CC1CCCCC1)C2=O,2 Z3416537383,Cc1cc(F)c(C(N(C2)CC2(C(CC2)C(N)=O)S2(=O)=O)=O)c(F)c1,0 Z2968098361,COCc1nc(N2Cc(cccc3)c3NCC2)ccn1,0 F6024-0936,CS(c(cc1)ccc1NC(C1(CC1)c1noc(-c2ccccc2)c1)=O)(=O)=O,2 Z2687359622,CC1(C(O)=O)N(Cc2cc(C#N)c(C)cc2)CCC1,0 C764-0216,COc(cc1)ccc1NC(CSC(N(c1cc(OC)ccc1)C1=O)=Nc2c1oc1c2cccc1)=O,0 C692-0295,Cc1cc(Cn2c(C(NC(N3C)=O)=O)c3nc2CN2CCN(Cc3ccccc3)CC2)c(C)cc1,0 F2075-1011,Cc1nc(N(CC2)CCN2C(Nc(cc2)ccc2OC)=O)nc(N2CCOCC2)c1,0 Z1721079140,CC(C)C(N(CC1)CCC1C(N(CC1)CCC1(Cc1cccc(F)c1)O)=O)=O,0 P899-0302,CC(CC1)CCN1S(c1c(C)oc(-c([nH]nc2)c2C(N(C)C)=O)c1)(=O)=O,2 F2373-0460,CC(C)C(NCC(CN1c(cc2)ccc2Cl)OC1=O)=O,0 F6520-1332,O=S(Cc(cccc1)c1Cl)(NCCc1ccc(-c2cscc2)s1)=O,2 F5854-0537,COc(ccc(Cl)c1)c1NC(N(CCc1ccccc1)Cc1ncccc1)=O,0 Z2527328734,Cc1cc(Cn2nnc(COc3ncccn3)c2)no1,2 F6619-8104,COc1cc(N2CCN(Cc(ccc(F)c3)c3F)CC2)ncn1,0 Z4884810068,Cc1c(CC(NS(c2cc(C#N)cc(Br)c2)(=O)=O)=O)sc(C)n1,0 Z2950459164,CC1(CNC(Nc2nn(C3CCCCC3)cc2C)=O)OCCCC1,2 F0020-1370,O=C(C(c1ccccc1)(c1ccccc1)N1)NC1=O,2 Z3192021938,CN(CC1)CCC1N(Cc1ccccc1)C([C@@H](C1)[C@H]1c1ncccc1)=O,2 Z401387220,O=C(CCc1c2)Nc1cc(S(N(CCC1)C1c1ccncc1)(=O)=O)c2Cl,2 F3139-2478,N#CCOc(cc1)cc(O/C2=C\c(c(Cl)ccc3)c3Cl)c1C2=O,0 Z2497424028,OCc1c(CNC(Cn2nnc3c2CCCC3)=O)cccc1,2 F6773-4873,Cc1cnc(C)c(OC2CCN(CCOc3ccccc3)CC2)n1,2 F6258-1483,O=C1N(CCNS(c2cc(CCCC3)c3cc2)(=O)=O)C=NC(C2CC2)=C1,2 Z1439447822,Cc1nc([nH]cc2)c2c(N(CC2)CC3C2N(C)CCC3)n1,2 F6512-3088,Cc1c(CN(CC2)CCN2S(c(cc(cc2)F)c2OC)(=O)=O)cno1,0 Z1995564023,Cc1c(C(N2C3(COCC3)COCC2)=O)nc(-c2cccs2)o1,2 V028-3682,CCCNC(N(CC(C)C)CC(N(CCn1c2ccc1)C2c1c(C)cccc1)=O)=O,0 F5341-0093,CC(C)OCCCNC(CCc1c(C)n(C(N2)=NC(C)=CC2=O)nc1C)=O,0 CM3034-4695,COc(cc1)cc(S(N2CC3(CCOCC3)C(COCC3CC3)C2)(=O)=O)c1OC,0 F2646-0416,CCSc(cccc1)c1C(Nc(sc(C)c1C)c1C#N)=O,0 F6519-5895,CS(c1ccc(CCC(NCC(c2ccco2)n2nccc2)=O)cc1)(=O)=O,2 F2189-0194,O=C(c1c2cccc1)N(CCCN1c(cccc3)c3OCC1=O)C2=O,2 SB57-0354,CCS(N(C1)CC(C2)(CN2C(CCCc2ccccc2)=O)C1c1nc(C)no1)(=O)=O,2 F1608-0095,CCOc(cc1)ccc1N(C(N(CC(c(cc1)ccc1F)=O)c1c2cccc1)=O)S2(=O)=O,0 SB71-0023,CN(C)C(c1nn(CCN(C2)C(c3nc4ccccc4cc3)=O)c2c1)=O,2 F6057-0201,O=C(CN(C(CC1)=O)C1=O)N1CCN(CCn2nccc2)CC1,2 F6519-4206,CC(C(NCC(c1cccs1)n1nccc1)=O)Oc1ccccc1,2 F6253-3602,CC(c(cc1)ccc1F)NC(C(CC1)CCN1S(N1CCCC1)(=O)=O)=O,0 Z3042150150,NC(CNC(c1nn(CC2(CCNCC2)OC2)c2c1)=O)c1ccccc1,0 F6675-8147,CN(Cc1cccc(C(F)(F)F)c1)C(C1)CN1c1nccnc1,0 Z2633883610,CC(C)C(Nc1c(CCCN2C(CC(CC3)CCN3OC)=O)c2ccc1)=O,0 Z1098516782,O=C(c1csc(-c2nccnc2)n1)NCC(c1ccccc1)c1ccccc1,2 F2740-0350,Cn1c(cccc2)c2c(NC(NCCSc2c[nH]c3c2cccc3)=O)c1,2 F6560-4322,CC(C)C(Cn1ncnc1)NC(c1noc(-c2cnccc2)c1)=O,2 Z2194430369,Cc(n(C)nc1)c1S(NC1(CO)CCC1)(=O)=O,0 D578-0127,Cc1cc(Nc(cc2)ccc2NS(c(cccc2)c2Cl)(=O)=O)nc(N2CCOCC2)n1,0 Z1754145897,Cc1nnc([C@@H](C[C@@H](C2)OC)N2C(Cc2coc3c2ccc(C)c3C)=O)o1,0 Z1500845808,O=C(Cc1ccccc1)N(CCC1)C1C(N(CC1)CCC1C1CCOCC1)=O,2 Y206-4178,OC(C(C1CC2CC1)C2C(N(CC1)CCN1c1cccc(Cl)c1)=O)=O,0 Z99081680,O=C(CCc1nnc(-c2ccccc2)o1)N1CCCC1,0 F2758-0712,O=C(c1nn(-c2ccccc2)nc1)NCC(c1c2cccc1)=NN(C1CCCC1)C2=O,2 Z3047952919,O=C(C(C1)CC1F)NCc(cc1)cnc1-n1c(cccc2)c2nc1,2 F5016-1361,Cc(c(NC(C(NCC(CC1)CCN1c1ncccc1)=O)=O)ccc1)c1Cl,0 Z432060204,CC(C)Oc(cc1)ccc1NC(c1cc(cccc2)c2[nH]1)=O,0 Z2506375944,CC1(C)c2nc(Cl)nc(N3CC(CNC(N)=O)CC3)c2CCC1,0 C257-0233,CC(CCc1ccccc1)N(C(C(NCCc1ccccc1)=O)c1c2cccc1)C2=O,2 F825-1604,O=C(C(CCC1)CN1S(c1ccc(-c2ccn[nH]2)o1)(=O)=O)NCCC1=CCCCC1,2 Z1972763870,CC(CNC(c([nH]c1c(cc2)F)cc1c2OC)=O)c1nncn1C,0 V011-5036,CC(C)c(cc1)ccc1OCC(c1c(CC2)scc1)N2C(CN(C1CC1)C(C1CCCC1)=O)=O,0 SB36-1004,O=C(c1cn(C[C@H](CC(C2)(F)F)N2C(c(cc(cc2)Cl)c2F)=O)nn1)N1CCCC1,0 F5493-0062,Cc1nnc(C(CCC2)CN2C(c(s2)ccc2Cl)=O)s1,2 M506-0191,Cc1ccc(C(c(cccc2)c2N2CC(Nc(ccc(Cl)c3)c3F)=O)(C2=O)O)cc1,0 D724-0267,Cc(cc(n1nc2)N(CC3)CCN3c3nc(C)cc(C)n3)nc1c2-c1ccccc1,0 Z1212853064,CN(CCCO)C1CCN(Cc(cc2)nn2-c2cccc(F)c2)CC1,0 F5833-7605,COC(c(cc1)ccc1C(Nc(cc1)cc(CCC2)c1N2C(c1ccccc1)=O)=O)=O,2 Z1645775537,Cc1c(CC(Nc(cc2)nn2-c(ccc(C#N)c2)c2Cl)=O)c(C)nc2nc(N)nn12,2 Z2568459972,Cc1cc(S(N2C(CCCC(O)=O)CCCC2)(=O)=O)c(C)s1,0 Z1881602676,CCc(ccc(S(NCc(cc1)ncc1OC)(=O)=O)c1)c1C(O)=O,0 F5882-6436,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)NCCN(C(C=C1)=O)N=C1c1ccco1,2 Z2960712307,O=C(c1c[nH]cc1Cc1ccccc1)NCC1OC2(CCCC2)CC1,2 G673-0069,CN(C)C(c(cc1)cc(N2CC(NC3CCCCCC3)=O)c1N(CCCC1)C1C2=O)=O,0 Z1919375162,Cc1c(C(Nc2cc(-c3nnnn3C3CC3)ccc2)=O)nnn1CC1CCCC1,2 SB52-0356,CN(CC(C1)(CC2)CCN2C(N2CCOCC2)=O)C1c1noc(-c2ccccc2)n1,2 S858-1260,CC(C)n1ncc(CN2C[C@](CO)(CN(C3)C(C4CC4)=O)[C@H]3CC2)c1,0 Z3831897820,CC(C(c1ccccc1)N)NC(C1(CCC1)c1ccccc1)=O,0 Z1561176114,Cc1c(C(C2CC2)NC(N(CCC2)CCS2(=O)=O)=O)cccc1,2 SB70-0728,CC(C)NC(c1nn(C[C@H](C2)NC(c3noc(Cn4ncc(C)c4)c3)=O)c2c1)=O,2 SB24-0037,Cc1nc(S(N(CC2)CCC2(CC2)C2n2nnc(C(NC)=O)c2)(=O)=O)cn1C,0 SA93-0420,CCn(cc1)nc1C(N(CCC1)CC1(CC1CC1)C(N)=O)=O,0 8017-9176,O=C1N=C(C=CC=C2)N2c(cc2)c1cc2S(N(CCC1)c2c1cccc2)(=O)=O,2 SC12-0642,Cc1noc(C)c1Cc1ccc(C(N(CCCN(CCC2)C2=O)C2CCOCC2)=O)o1,2 Z4473238421,COc1cc(CCC(C2OCC3)N3C(C3(CCC3)C3CC3)=O)c2cc1,2 S433-1153,CC(NC(c1c2)=O)=Cn1nc2C(N(CC1)CCC1NC(C1CCC1)=O)=O,2 F5600-0188,Cc(cc1)nnc1Nc(cc1)ccc1NC(Cc(cc1)ccc1OC)=O,2 S632-4586,CNC(N(CC1)CCC1C(CC1)CN1S(c(ccc(F)c1)c1F)(=O)=O)=O,0 Z2288558821,CCc1csc(S(NC(CC2CCCCC2)=O)(=O)=O)n1,2 Z4684534328,COc(scc1)c1C(N(C1)Cc2c1cnn2-c1ccccc1)=O,0 F6774-4018,Cn1ncc2c1ncnc2N(CC1)CC1Oc(nc1)ncc1OC,2 Y021-0636,CC(C)(CC1(C)c2ccccc2)N(C(Nc(cc2)ccc2F)=O)c2c1cccc2,2 F6517-4278,OC(CNC(c(cccc1)c1Br)=O)c(cc1)ccc1-c1cccs1,2 Z1588127646,CCc1cc(C(NC2CCN(Cc3ncccc3)CC2)=O)ncc1,0 Z2024432546,FC(O[C@@H]1CN(Cc2cn(cccc3F)c3n2)CC1)F,0 Z1538088384,CNC(C(CCC1)CN1C(Cn1nc(-c2ccccc2)nc1)=O)=O,2 Z2911100392,CCC(CNC(c1ncc(C)cc1C)=O)(C(O)=O)c1ccccc1,0 S692-2306,Cc1cc(C)nn1CCC(N(CCC1)CC1n1c(COC)ncc1C)=O,2 Z2592196264,CC(CCC1)CC1Nc1cccc(-c2cn(C)nn2)c1,2 F3031-0009,O=C(c1cccc2nc3ccccc3nc12)NC1CCCCC1,2 F0243-0022,OC(CSc(ccc1ccccc11)c1Br)=O,0 F6594-1671,OC(CC1)C1N1CCC(CN(C(C=C2)=O)N=C2c2ccncc2)CC1,2 F6789-0368,N#Cc1cccnc1N(C1)CC2(CO)C1CCCC2,2 F5860-3442,O=C(CN(C(c1c2cccc1)=O)C2=O)NCc1cccc(Oc(cc2)ccc2F)c1,2 F2348-0201,Cc(cc1)nc2c1oc(C(NCc(cccc1)c1Cl)=O)c2,0 Z1414442007,CC(C)COC(CC1)CN1C(NC(C1CC1)c(cc1)cc2c1OCCO2)=O,2 F6471-9281,Cc(n(-c1ccccc1)nc1)c1C(N(C1)CC1S(c1nccn1C)(=O)=O)=O,2 F6438-3041,COc1nc(CNC(c(cc2)ccc2SC)=O)nc(OC)n1,0 Z2027586051,CC1(CNC(c(cc2)nc(N3)c2NC3=O)=O)CCCC1,2 Z2273620484,N#Cc1cccnc1N(CCC1)C1C(CCC1)C1O,0 F3222-4711,CN(c1c(C(Nc2cc(OC(F)(F)F)ccc2)=O)scc1)S(c1ccccc1)(=O)=O,2 F6454-0830,O=S(Cc(cccc1)c1Cl)(NCC1CCN(CC(F)(F)F)CC1)=O,0 Z4518778551,O=C(C(Br)=C1N2CCOC1)NC2=O,0 F6478-3494,CCc(ncnc1OC(CC2)CN2C(c(cc2)cc3c2ncs3)=O)c1F,2 F5027-0659,O=C(c(s1)ccc1Cl)N1CC(c2ccc(C(F)(F)F)cc2)OCC1,0 C700-0292,CCN(CC)S(c(cc1)cc(N2CC(NC(C)c(cc3)cc4c3OCCO4)=O)c1OCC2=O)(=O)=O,2 F6675-8069,CN(C(C1)CN1c1nccnc1)c1nc(cncc2)c2s1,2 Z3027211243,Cc1nc(S(N(C)CCC(NC)=O)(=O)=O)c(-c2ccccc2)o1,0 F6619-7256,CN(C)c(cc1)nnc1N(CC1)CCN1C(c1c2cccc1)=NS2(=O)=O,2 Z1039647504,O=C(CN(CCCN1)C1=O)N(CC1)CCC1c1nc(-c2ccccc2)n[nH]1,2 L718-0142,O=C(Nc(cc1)cc(CC2)c1N2S(c1ccccc1)(=O)=O)Nc(cc(cc1)F)c1F,0 S971-1141,CC(CC1)(C1(CC1)CCN1C(c1cscn1)=O)O,2 Z4122610439,CCc1nc([C@H](COC2)[C@H]2NC(c2c(C)c(ccc(F)c3)c3[nH]2)=O)n[nH]1,2 Z1755673861,Cc1c([C@H]2OCC[C@@H]2NC(Nc(cc2)cnc2N(C)C)=O)cnn1C,2 G288-0081,CC(Cn(c1c2)c3c2cccc3)(C(NCC(NCCCN(CCC2)C2=O)=O)=O)N(C)C1=O,2 S687-2390,Cc(cc1)c(C)cc1NC(N(CC1)CCC11OCCC(Cc2nc(-c3nccnc3)no2)C1)=O,2 F6276-1321,COc1cccc2c1nc(OC(C1)CN1C(c1csc(-c3ccccc3)n1)=O)s2,2 D445-0325,Cc1cc(N(C(CC2)=O)S2(=O)=O)cc(C)c1S(NCc(cc1)ccc1OC)(=O)=O,0 Z1365982605,CC(CCC1)N1C(CSc1nnc(-c(cccc2)c2Cl)o1)=O,2 Z1603687655,CS(C1(CCCC1)C(Nc(cc1)cc(Cl)c1OCC(O)=O)=O)(=O)=O,0 F6230-0189,O=C(c(o1)ccc1Br)NCc1c(cccc2)n2nc1,2 S759-0047,CC(C)N(C[C@H]1OC)[C@@H]1C(CC1)CCN1C(c1cscc1)=O,2 F5097-1422,COCCNC(Cc(cc1)ccc1NC(c(cc1)cc2c1OCO2)=O)=O,2 Z4872929010,CCOC(c1c(C)nc(NC(NCC2CCOCC2)=O)s1)=O,2 F6658-2267,CN(C(C1)CN1c(cc1)nn2c1nnc2)S(C1CCCCC1)(=O)=O,2 F6561-1192,O=C(c1cc(cccc2)c2o1)NCc1cncc(-c2ccco2)c1,2 Z1208185091,CC(c1nc(-c2cccc(C(F)(F)F)c2)no1)Nc(cc1)cc(CC2)c1NC2=O,2 F6724-5178,Cn1ncc2c1ncnc2NCC1(CCSCC1)OC,2 Z2168075811,Cn(c1ccc2)c(N)nc1c2Br,0 Z2409434591,Cc(c(F)c1)cc(S(N(CC2)CC2c2nnc[nH]2)(=O)=O)c1F,0 Z432533998,O=C(CS(c(cccc1)c1Cl)(=O)=O)NC1CCCCCC1,0 S594-0651,O=S(c(cc(cc1)F)c1F)(N(CC1)CCC1c1noc(COCC2CC2)n1)=O,0 K263-0702,O=C(CSC(N(CC1OCCC1)C1=O)=Nc2c1sc1c2cccc1)c(cccc1)c1F,0 F6559-0498,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)N(CCC1)CC1N(C=Nc1c2cccc1)C2=O,2 F5871-1082,O=C(C1(CC(C2)C3)CC3CC2C1)NCCN(CC1)CCN1C(c1cscc1)=O,2 Z976962334,CN(Cc(ccc(OC)c1)c1OC)C(NCc1cc(-n2cncc2)ncc1)=O,0 S661-1302,CCN(C(C(C1)N2CC1(CC1)CCN1C(Nc(cc1)cc3c1OCCO3)=O)=O)C2=O,2 SD69-0354,CS(N(CC1)CCN1C(c1c(C(N[C@H](C2)c3ccccc3)=O)n2nn1)=O)(=O)=O,2 Z951394444,O=C(CNc1cc(C(NC2)=O)c2cc1)N(CCN1)CC1=O,2 F5040-0662,Cn1c(cccc2)c2c(CC(N(CC2)CCN2c(cc2)nnc2-c2ncccc2)=O)c1,2 Z3528240345,Cc(cc(n1nc2)O)nc1c2C(Nc1c(CN(CCC2)C2=O)cccc1)=O,2 Z2958877636,COCC1(CCCCC1)C(Nc1c[nH]nn1)=O,0 Z2435972267,COc1cccc(CC(N(CC2)CCN2C(C(C2)C22CCNCC2)=O)=O)c1,2 Z391953608,O=C(C(C1)ON=C1c1cccc(F)c1)NCc1ncccc1,0 S988-1238,Cc1ccc(C(N(C[C@@H]2CN(C3)C4CCOCC4)C[C@@]23c2nc(C)no2)=O)s1,2 V027-6863,COc(cc1)cc2c1OC(CNC(c1cc(C(F)(F)F)cc(F)c1)=O)C2,0 Z3645985360,CCC([C@@H](CCC1)N1C(c1cc(scc2)c2s1)=O)O,2 Z2965617562,Cn(cc1CNC(C2(CCCC2)c(cc2)ccc2OC)=O)nc1OC,0 F671-0165,CC1=Nc(cccc2)c2N(Cc(cc2)ccc2C(NCCCN(C)C2CCCCC2)=O)C1=O,2 Z466808440,CC(N(CC1)CCC1NC(C(c1ccccc1)Oc(cccc1)c1Br)=O)=O,0 Z601-0447,CC(C)(C)NC(C(CC1)=CCN1C(c1ccc(C)cc1)=O)=O,0 Z1269640991,O=C(CCc1ccccc1)NC(CCC(N1)=O)C1=O,0 F6495-5612,O=C(CNC(C(C1)CN1c1ncnc(-n2nccc2)c1)=O)OCc1ccccc1,2 1323-0021,OC(C(Cc1c2[nH]c3c1cccc3)NC2c(cccc1)c1Br)=O,0 F6571-2173,OCCOC1(CNC(Nc2cccc(C(F)(F)F)c2)=O)COCC1,0 F6452-0143,CC(CNC(c1c(C(F)(F)F)cccc1)=O)(c(cccc1)c1F)OC,0 F6795-5137,Cc1c(C)nc(C2CC2)nc1OCC(CC1)CCN1c1nc2ccnn2cc1,2 Z223-0414,O=C(Cn1ncc2c(N3CCCCC3)ncnc12)N1CCCCC1,2 F6411-0273,CC(C)(C)NC(CSc(cc1)nnc1-c(cccc1)c1Cl)=O,0 S632-4394,CNC(N(CC1)CCC1C(CC1)CN1C(c1nccn1C)=O)=O,2 G368-0060,O=C(NC1CCCC1)N(CC1)CCC1(N1)Oc(cccc2)c2C1=O,2 Z2896121039,CC(C)(C)Nc1nnc(-c2ccc[nH]2)o1,0 Z2792811592,CCC(CC)(CNC(c1c(C)ccc2c1cn[nH]2)=O)C(O)=O,0 Z3686677089,CN(C)C[C@@H](C[C@H](C1)O)N1c1cc(N(C2)CC2(COC)c2ccccc2)ncn1,2 Z1269177682,O=C1N(c2cccc(Br)c2)N=CN1,2 E614-0168,Cc1n[nH]c(C(N(CC2)CCN2c(cc2)nnc2N2CCOCC2)=O)c1,2 F6725-0001,Cc1nnc2n1ccnc2N(CC1)CCC1S(c1ccccc1)(=O)=O,2 SA85-1003,Cn1cnc(C(N(CC(CN2CCc3ccccc3)O)CC2=O)=O)c1,2 F1189-0016,CCOC(c(cc1)ccc1N(C(C1C2CC(C)=CC1)=O)C2=O)=O,0 Z3525283834,Cn1nccc1-c1n[nH]cc1CN(CCC(F)(F)F)C1CCC1,2 Z1165340022,O=C(COC1CCNCC1)N(CC1)CCN1c(cc1)ccc1Cl,2 F5854-4038,Cn1c(CN(C2CC2)C(Nc2c(C(F)(F)F)cccc2)=O)ccc1,0 V016-6971,O=C(Cn1c(C(N(CC2OCCC2)C(N2c(cc3)ccc3F)=O)=O)c2nc1)c(cc1)ccc1Cl,0 Z2357395262,CC(CCC(C1)C(O)=O)N1C(c1cc2nccnc2cc1)=O,0 Z2208126600,CCC[C@H](C(N(CC1)CC11CN(C)CC1)=O)NC(N)=O,2 Z1587610670,CC(C)(C)C(N(CC1)CCC1NC(N(CC1)CCC1c1c[nH]nc1)=O)=O,0 F782-1880,CC(C)C(Nc1nc(cc(cc2)NC(CCn3c(cccc4)c4nc3C3CCCCC3)=O)c2s1)=O,2 Z1657815215,Cc1c(C(Nc2nnc(C)n2C)=O)c(-c2ccccc2)no1,2 V001-3956,CC(C)c1nc(sc2c3CCC(C)C2)c3c(N(CC2)CCN2C(c(cc2)ccc2Br)=O)n1,0 Z2762779405,N#Cc1ccnc(N(CC2)CCC2[C@H](CC2)O[C@H]2C(O)=O)c1Cl,0 Z1554126345,CC(C)C(c(cc1)ccc1OC)NC(CN1CC2(CCC2)OCC1)=O,2 Z2971483818,OCCn(cc1)nc1NCc(c(F)c(cc1)Cl)c1Br,0 F6681-3616,C(C(C1)CN1c1c(ccs2)c2ncn1)Oc1cnccc1,2 Z3753017063,Cc1ccnc(Oc(cc2)ccc2NC([C@@H](C2)[C@H]2c2ccncc2)=O)n1,2 Z1266418894,Cn(c(C1CC1)c1)nc1C(NCCc1nc(-c2ncccc2)cs1)=O,2 Z4625942093,O[C@H](CC1)CN1c1c(ccc(Br)c2)c2cc(Cl)n1,0 D430-2327,Cc1nc(N2CCCC2)cc(Nc(cc2)ccc2NC(Nc(cc2)cc3c2OCCO3)=O)n1,2 S976-1061,O=C(C1(CC1)c1ccccc1)N(CCC1)CC1(C(N1CCOCC1)=O)F,2 F5627-0009,Cc(cc(cc1)S(NCCNc2nc(C)nc(N(C)C)c2)(=O)=O)c1OC,2 F3238-0152,CC(CC(N(CC1)CCN1S(c1c(C)cc(C)cc1C)(=O)=O)=O)n1nc(C)nc1C,0 Z8081214715,CCCc1noc(CN(C[C@@H]2c3ccnn3C)C[C@@H]2NC(COC)=O)n1,2 ZC43-0149,OC(c1cc(C(N(CC2)C(C(CC3)CCN3C(Cc3ccccc3)=O)c3c2nc[nH]3)=O)ccc1)=O,2 Z1865555439,Cc1cccc2c1CN(CC(SC1=NC(C)=C3)=NN1C3=O)CC2,2 F6806-7218,Cc1cc(Br)cnc1N(CC1)CCC1C(NC1CC1)=O,0 F6807-4734,FC(CC1)(CN1c(ncc(Cl)c1)c1Cl)F,0 F6502-7383,COc(ccc(F)c1)c1S(NCCn(c(C1CC1)c1)nc1-c1cscc1)(=O)=O,2 F6571-2647,Cc(cccc1)c1NC(NCC1(CCCC1)OCCO)=O,0 K784-8988,O=C(C(c(cccc1)c1N1Cc(cc2)ccc2Cl)=CC1=O)NCC1Oc(cccc2)c2OC1,2 Z1716545736,COC(c([nH]c1cc(Br)c2)cc1c2Cl)=O,0 F6677-2522,Cc1cn(CC(C2)CN2C(CN(C=NC(C2CC2)=C2)C2=O)=O)nc1,2 Y041-8940,CC(C)C(Nc1c2cccc1)N(CCC(Nc1nc(C)c(C)s1)=O)C2=O,2 SC04-0415,Cc1cc(C)nn1CC(N(CCC1)CC1OCCc1noc(C2CCOCC2)n1)=O,2 Z3077780954,Cn1nncc1C(C1)(CN1c1nc(C(F)(F)F)ns1)O,2 F6437-0143,Cc1nsc(C(N(CC2)CCN2c2ncccn2)=O)n1,2 L995-0623,CN(CC1Oc(cccc2)c2OC1)S(c(cc1)cc2c1onc2C(N1CCCCC1)=O)(=O)=O,2 Y031-0769,O=S(c(cc1)ccc1NS(c(cc1)ccc1F)(=O)=O)(NC1CCCCC1)=O,2 F6797-2741,O=C(C(CC1)(CN1c(cc1)nn2c1nnc2C(F)(F)F)F)Nc1cnccc1,2 Z3063570578,OC(c1nc(-c2cc(CN3CCCCC3)ccc2)no1)c1ccccc1,2 L748-0039,O=C(c(cc1)cc2c1n(CCNC(Nc(cc1)cc3c1OCCO3)=O)cn2)N1CCCC1,2 Z1278775351,CC(C)n1ncc(S(Nc(cc(cc2)C(O)=O)c2OC)(=O)=O)c1,0 F5857-5227,Cc(cc1C)cc(C)c1NC(C(NCC(C1CCCCC1)O)=O)=O,2 F6764-3244,Cc1ncc(CC(N2Cc3cc4cccnc4nc3CC2)=O)s1,2 F6524-1724,CC(N=C(N1)N(CC2)CCC2NC(c2cccn2C)=O)=CC1=O,2 D466-0046,Clc(cc1)cc2c1n(CCN(C1)C3CCCCC3)c1n2,2 Z1904056236,O=C(C1CC1)N(CC1)CCC1c1noc(C(F)F)n1,2 Z2283040262,Cn1ncc(-c2ccc(C(NCC(Cc3ccccc3)OC)=O)o2)c1,2 D577-0226,Cc1cc(Nc(cc2)ccc2NC(Nc(cc2)cc3c2OCCO3)=O)nc(N2CCOCC2)n1,2 F6475-6723,O=C(c(cc1)cnc1OC1CSCC1)Nc(cc1)cc(Cl)c1F,0 Z1421652577,O=C(CN(CCC(N1)=O)C1=O)N1c(cc(C(F)(F)F)cc2)c2OCC1,0 F6481-3511,Cn(c(C(N(CC1)CCSC1c1ccco1)=O)c1)nc1-c1ccccc1,2 Z1619266941,CC(c(cc1)ccc1S(C)=O)N(C)C(c(c1cc(C)c2)cc(O)nc1c2F)=O,2 Z4052025600,O=C(c1cn(Cc2ccccc2)nc1)N(CC1)C1c(cc1)ccc1F,2 Z1718985257,COc(cccc1NC(N(CC2)CCN2c2ncccc2F)=O)c1F,0 F6284-0138,O=C(c1c(C(F)(F)F)cccc1)NCCc1cncnc1,0 SD25-0492,Cc(n(C)nc1)c1C(N1CC2(CCCCC2)C(CCC(N2CCCC2)=O)C1)=O,2 Z1070972968,C(C1CC1)NCc1n[nH]c2c1cccc2,2 V019-4689,CC(C1=O)N(Cc(ccc(F)c2)c2F)CCN1c(cc1)cc(Cl)c1F,0 C175-0096,CCOC(c([nH]c1c2cccc1)c2NC(CCC1CCCCC1)=O)=O,2 F6252-1198,Cc1noc(-c(cc2)cnc2N(CCC2)CC2C(NCCCn2nccc2)=O)n1,2 F6190-0374,Cc(ccc(NC(C(NCCC(C1CC1)O)=O)=O)c1)c1F,0 Z4743304560,Nc1ncc(CCN(C2)C(c(cc3)ccc3Nc3ccncc3)=O)c2n1,2 F6479-4447,Cc1cc(OC(CC2)CCN2C(Nc2cccs2)=O)nc(C)n1,2 F5485-1459,CC(N=C(N1)SCc2cccc(Cl)c2)=C(CC(NCc(cccc2)c2OC)=O)C1=O,2 SC88-1770,Cn1c(C(N(C2)CC2(C(CC2)c3nc(Cc(cccc4)c4F)no3)S2(=O)=O)=O)ccc1,2 D445-0739,CC(CS(N1c(cc2)ccc2S(NCc2ccco2)(=O)=O)(=O)=O)C1=O,2 Z29273226,CC(c1c(-c2ccccc2)nc(NC(c(cc2)ccc2N(C)C)=O)s1)=O,0 F5254-0227,O=C(CCc1csc(NC(c(cc2)ccc2F)=O)n1)NCCC1=CCCCC1,2 Z3054510363,CC(C)CN1NC(CC(N(CCC2)CC2n2nccn2)=O)=CC1=O,2 F6360-9487,O=C(Cc1cscc1)N(C1)CC1Oc1cnccc1,2 F6473-1224,O=C(Cn1cccc1)N(CC1)CCC1N(CC1)Cc2c1scc2,2 F6571-5856,CC(Cc1csc2c1cccc2)NC(c1cnc(C(F)(F)F)cc1)=O,0 Z2843257541,CN(C)CCNC(Nc1nc2ccccc2cc1)=O,0 F6436-2616,Cc1noc(C)c1CC(NCC(CC1)CCN1C(c1cc(cccc2)c2o1)=O)=O,2 F6504-1184,Cc1c(CCNC(c2cocc2)=O)c(C)nn1-c1ncccc1,2 F6724-4298,OC(CNc1ncnc2cnccc12)(c1cocc1)c1cccs1,2 F6349-1366,O=C(NCc1cccs1)Nc(cc1)ccc1-c1cnc2n1CCC2,2 F6036-1416,COC(c1ccc(CN(C2)CC2c2nc(C3CC3)no2)o1)=O,2 Z1407870961,Cc1nn(C)c(OCC2)c1N2C(Cc1cc(OC)ccc1)=O,2 T505-1091,CCn1ncc(CN2C(CCn3nnc(C(N4CCOCC4)=O)c3)CCCC2)c1,0 Z1231393122,O=C(CC(c1c2cccc1)=NNC2=O)Nc1nnccc1,2 F6448-0060,COc(nccc1)c1C(Nc1cn(CC2OCCCC2)nc1)=O,2 L592-0796,O=C(CN1c(cccc2)c2SC(C(N2CCCCC2)=O)C1=O)NCCC1=CCCCC1,2 Z2065693915,Cc(n1S(c2c(C)cc(C)c(C)c2)(=O)=O)ncc1[N+]([O-])=O,0 CM2843-3274,O=C(Nc(cc(cc1)F)c1F)N(CCC1)C1c1nncn1-c1ccccc1,0 F3411-7657,CCOC(c1cc(OC)c(cc(cc2)Cl)c2n1)=O,0 Z2989458011,CCOC(C1)CC1(CC1)CN1c1nnnn1Cc(cccc1)c1Cl,2 S831-3179,COC[C@@H](CN(C1)C(c(cc2)cnc2OC)=O)[C@H]1c1ncccc1,2 F6441-7498,CNC(CS(C(CC1)CCN1C(COc(cc1)ccc1Cl)=O)(=O)=O)=O,0 Z2968283389,CN(CC1CC1)c1cccc2nncn12,2 Z3273140354,COC(c1ccc(C2(CN)CC2)cc1)=O,0 F387-0008,CC(N1Cc2noc(C3=Cc(cccc4)c4OC3=O)n2)=Nc(cccc2)c2C1=O,0 SC74-1048,COCC(N[C@@H](C[C@@H](C1)C(N(CC2)c3c2cccc3)=O)[C@@H]1c1nc(-c2ccccc2)no1)=O,0 F5831-3396,COc(ccc(Cl)c1)c1NC(N(CC1)CC1c1ccccc1)=O,0 SA43-0764,Cc1c(C(N(C2)CC2(C2)CN(C)C2c2nc(-c3ccccc3)no2)=O)sc(C)n1,2 Z2087378029,Cc(c(N(C(C1(CCCCC1)N1)=O)C1=O)c1)cc(OC)c1F,0 Z2053311025,CO[C@H](C1)CN(CC=Cc(cccc2)c2OC)[C@@H]1c1nnc2n1CCC2,0 P124-1060,CC(C)c1nc(C(N(CC(N(CC2)CCN2C2CCCCC2)=O)N=C2C)=O)c2s1,0 Z4931450514,CCN(CCCO)c1nc(-c2cccc(OC)c2)nc2ccccc12,0 Z2361618252,CC(C)(C)CCCS(N(CCC1)CC1C(O)=O)(=O)=O,0 T955-1047,COCCC(N(CCC1)CC1c1nc(CCOCC2CCOCC2)no1)=O,0 F6372-2936,O=C(Cn1nccc1)Nc1c(Cc2nc(-c3nccnc3)no2)cccc1,2 Z1718375313,O=C(CCc1c2OCOc2ccc1)NCC(N1CCCCC1)=O,2 S740-0949,CCCN(C([C@H](C[C@@H](C1)NC(c2ncc(C)nc2)=O)N1CC1)=O)S1(=O)=O,0 L111-0346,CCS(c(cc1)cc(N2Cc3nc(-c4cccc(Cl)c4)no3)c1OCC2=O)(=O)=O,0 F1903-9902,C(CNCC1)C1Oc(cc1)nnc1-c1ccccc1,2 S997-0724,CCOc(ccc(CN1C[C@@H](CN(C2)S(C)(=O)=O)[C@]2(COC)CC1)c1)c1OC,0 F832-0299,CN(CC1)CCN1C(CCc1nnc(c2c3)n1ccn2nc3-c(cc1)ccc1Cl)=O,2 G887-0699,CCc1cc2c(N(CCC3)CC3C(NC3CCCCCC3)=O)ncnc2s1,2 Z2296024621,COc(ccc(C(C(O)=O)NC(C1COCC1)=O)c1)c1Cl,0 F6680-8912,Cc1nc(CN2CC(COc3cc(C)ncc3)CCC2)co1,2 V020-6140,O=C(C1CC1)Nc(cc1)ccc1N(CCCN1Cc(cc2)cc(F)c2F)C1=O,0 Z2970219216,CN1CC(CNC(NC2(CC2)c(cc2)cc3c2OCCO3)=O)OCC1,2 F6237-1847,O=C(c1nn(-c(cc2)ccc2F)nn1)NCCc(cc1)ccc1Cl,0 Z2756452885,CCOC(C1)CC1(C1)C1NC(c(cc1)cnc1C(O)=O)=O,2 SC23-0563,CS(N(CCc1noc(C2CC2)n1)C(C1)CN1C(NCc1ccccc1)=O)(=O)=O,2 F6734-0842,O=C(NCc1ccccc1)N(C1)CC(C2)C1CN2c1ncc(C(F)(F)F)cc1,2 E958-0508,CCOc(ccc(CCNCc1cccn1-c1nnc(N(CC2)CCC2C(O)=O)s1)c1)c1OCC,2 F6471-0897,Cc1noc(C)c1S(N(C1)CC1n1nnc(-c2ccccc2)c1)(=O)=O,2 F6356-0403,Cc(c(NC(C(NCCc1cocc1)=O)=O)ccc1)c1Cl,0 G017-1793,O=C(CCC1)Nc(cc2)c1cc2S(NCCN(CCN1CCOCC1)Cc1cccs1)(=O)=O,2 F6480-0363,Cc1c(C(N(CCC2)CC2Oc2nccc(C#N)c2)=O)c(C)nn1C,2 SA70-1211,Cc1noc(C)c1CC(N(CCC1)CC1(CCOC)c1noc(C2CCOCC2)n1)=O,2 S858-0875,CC(N(C1)C[C@@](CO)(C2)[C@H]1CCN2C(c(cc1)ccc1Cl)=O)=O,0 S697-1120,Cc1cnc(-c2cnccc2)n1CC(CC1)CCN1S(c1c(C)onc1C)(=O)=O,2 Z667499526,Cc1c(CN(CC2)CCC2NC(c2ccco2)=O)cccc1,0 F6609-5456,CCc(cc1)ccc1-n1nnc(C(NCCC2=CCCCC2)=O)c1,2 F6808-5946,Cc1csc2c(N(CC3)CCC3(c3ccccc3)C#N)ncnc12,2 Z2313618589,FC(c(cc1)ccc1-n1nnnc1CN1[C@@H](COC2)[C@@H]2CCC1)(F)F,2 E157-5407,CCN(c1ccccc1)S(c1nnc(NC(CN(C(c2c3cccc2)=O)C3=O)=O)s1)(=O)=O,0 Z3680233275,CC(C)([C@H]1c2ccccc2)[C@H]1NC(N(CC1)CC1C(NC(N1)=O)=CC1=O)=O,2 Z1987746678,CC(NC(Cc(cc1)cc2c1OCO2)C(N[C@H](C1)C[C@@H]1c1c(C)cccc1)=O)=O,2 SA69-1483,CCS(N(CCC1)CC1(C)c1noc(COc2ccccc2)n1)(=O)=O,0 F6554-0488,Cn1nc(C(CC2)CCN2S(c(s2)ccc2Cl)(=O)=O)cc1,2 Z45529918,C=CCNS(c(cccc1)c1[N+]([O-])=O)(=O)=O,0 F052-0153,O=S(c1cc2ccc(NC3CCN(Cc4ccccc4)CC3)nc2cc1)(N1CCCCC1)=O,2 F6436-2501,COc1cc([nH]c(C(NCC(CC2)CCN2S(C)(=O)=O)=O)c2)c2cc1,0 F6507-8477,Cn1nnc(C(NCC(CCC2)(c3c2occ3)O)=O)c1,2 Z2511440136,Cn1ncc(CC(N(CCOC2)C2C(O)=O)=O)c1,0 Z2115581205,CNC(C(CCC1)CN1C(c1c(N)nc(C2CC2)nc1)=O)=O,2 SD57-0131,O=C([C@](C[C@@H]1CC2)(CN1C2=O)c(cccc1)c1Cl)NCCCN(CCC1)C1=O,2 Z1451985512,O=C(Nc(cc1)nn1-c(cccc1)c1Cl)N1CC(CCC2)C2C1,2 SD70-0190,CC(C)C[C@@H]1n2nncc2CN(CC(N(C)Cc2ccccc2)=O)C1=O,0 Z3587285970,C=C(C1)CON1C(C(N=C(C1CC1)N1)=CC1=O)=O,2 Z3132958961,Cc1c(C(NC2C3(CCC3)NCC2)=O)[nH]nc1C(F)(F)F,2 F6415-1002,O=C(c(cc1)ccc1OC(F)(F)F)N(Cc1cocc1)Cc1cccs1,0 S985-1059,CCNC(N(C[C@@H]1CN(Cc2ccccc2)C2)C[C@@]12C(N(C)C)=O)=O,0 Z2228665511,CCC(C)NC(CN(CC1)CCN1C(c1cccc(N2)c1NC2=O)=O)=O,0 Y020-3448,Cc1c(C(CSc2nnc3n2c(cccc2)c2[nH]3)=O)c(cccc2)c2[nH]1,2 F6795-6451,Cc1nc(CN(CC2)CCN2c2nc(C(F)(F)F)cc(C)n2)cs1,2 Z166967014,Cc1ccc(Cn(c2nc(C)c3)ncc2c3C(NC)=O)cc1,0 F5854-2700,COc(ccc(Cl)c1)c1C(N(CCc1cccs1)Cc1ccco1)=O,0 V031-1265,Cc1cc(C)c(CN(CC(COCc2ccccc2)O)CC2OCCC2)cc1,0 F1908-3287,Cc1noc(C(CC(C2)F)N2S(c(cc2)cc3c2OCC3)(=O)=O)n1,2 F0268-2663,C(C1)NCCN1C(c1ccccc1)c1ccccc1,0 Z1203330269,OC1(CNC(c2nccnc2)=O)CCCC1,2 F6573-9145,COc1ccc(CNC(NCc2cncc(-c3cocc3)c2)=O)cc1,2 G365-0301,COc(cc1)cc(CC2)c1-c1c2c(C(Nc(cc2)ccc2OC(F)(F)F)=O)n[nH]1,2 Z1260909535,CC(C)CC(NCCC(N1C(Cc(cc2)ccc2F)CCC1)=O)=O,0 SD54-0251,O=C(C(CC1)CCc2c1c(OCC1CC1)nc(-c1ccccc1)n2)N(CCN1)CC1=O,2 F6186-0463,CC(CNC(NCCc1ccccc1)=O)(CSC)O,0 Y204-7407,CC(CC1C(Nc2c(C(N)=O)c(CCCC3)c3s2)=O)=C(C)CC1C(O)=O,2 8015-3326,COc1ccc(C(CC(c(cc2)cc(O)c2O)=O)OC2=O)c2c1OC,0 F6439-1280,O=C(CSc(cc1)ccc1F)NCCn1nc(C(F)(F)F)c2c1CCCC2,2 Z1176687452,CN(CC1CCC1)CC(NCc1cccc(Cl)c1)=O,2 F3386-3596,Cc(c(Cl)ccc1)c1NS(c(c(OC)c1Cl)ccc1Cl)(=O)=O,0 F6603-9243,Cc1nc2ccnn2c(N(C)C(C2)CN2c2cc(CCC3)c3nn2)c1,2 Z193037614,NC(C(CCC1)CN1C(CCc(cc1)cc2c1OCCO2)=O)=O,0 Z1609487761,OC(c1c(CCC(N(CCOC2)C2c2ccccc2)=O)cccc1)=O,0 C597-0409,CC(C)CCNC(C(c1ccccc1)NS(c(cc1)cc(C(N2C)=O)c1N(C)C2=O)(=O)=O)=O,2 F6667-8490,Cn1nc(C(F)F)c(C(N(CC2)c3c2cccc3)=O)c1,0 F6609-5254,COc1cccc(CNC(C(CCC2)CN2S(c(cc2)ccc2Cl)(=O)=O)=O)c1,0 Z1832496504,CC(C)(CNC(C(C1)c(cccc2)c2C1=O)=O)N(CC1)Cc2c1cccc2,2 Z3434223131,CC(CC(C1)C(NC)=O)CN1C(NCc(cc1)c(C(F)(F)F)cc1F)=O,0 Z2971221588,Clc1cc(-c2nnc(N3CCOC4(CCOCC4)CC3)o2)ccc1,2 Z1883805248,Cc(cc(CN(C)S(c1cccc(Cl)c1)(=O)=O)cc1)c1F,0 S571-0361,O=C(CCc1nc(cccc2)c2s1)NCC1(CCC(N2CC3CC3)=O)C2=CCC1,2 8019-6062,COCc1nn2c(C(F)(F)F)cc(-c(cc3)ccc3OC)nc2c1-c(cc1)ccc1OC,0 S664-6451,NC(COC(CC1)C1(CC1)CCN1C(c(cc(cc1)F)c1F)=O)=O,0 F6523-3028,O=C(C1(CCOCC1)c1ccccc1)NCCN(Cc(cccc1)c1OC1)C1=O,2 Z4884810409,CC(C)(C(NS(c1cc(C#N)cc(Br)c1)(=O)=O)=O)c1csc(C)c1,0 F6775-2346,CC(C)(C)c(cc1)nnc1N1CC(COc2nccnc2)CCC1,2 Z1840410181,CCS(c(cc1)ccc1N(CC1)CCC1c1noc(-c(cccc2)c2OC)n1)(=O)=O,2 Z2950528410,Cc1c([C@H]2OCC[C@@H]2NC(Nc2c(C)nncc2)=O)c(C)nn1C,2 T854-0223F,COCCN([C@@H](CCCC1)[C@]1(CC1)C(Nc2ncccc2)=O)C1=O,2 S984-0882,Cc1cccc(OCC(N(C[C@H]2CN(C3)C(c4nccnc4)=O)C[C@]23C(N(C)C)=O)=O)c1,0 SC65-0435,CCN(CCNC([C@@H](C1)[C@@]1(C1)CN(CC(C)C)[C@@H]1C(NC)=O)=O)Cc1ccccc1,2 G802-0066,O=C(CSc1nnc2n1C=CN(c1cc(F)ccc1)C2=O)N(CC1)CCN1c(cccc1)c1F,0 F6469-2615,CN(C)S(Nc(cccc1)c1-c1cn(ccs2)c2n1)(=O)=O,0 F3207-0006,CCOc(cccc1)c1NC(C1Oc(cccc2)c2OC1C)=O,0 F6672-0583,O=C(c(ccc(F)c1)c1F)N(C(CC1)C2)C1CC2n1ncc(Br)c1,0 F6573-3392,COc1c(C2(CC2)C(NCCOCCn2cncc2)=O)cccc1,2 Z2500116059,CCc1n[nH]c(NC(c2c(C(C)C)cco2)=O)c1C,0 Z5034342698,Cc1cc(C(OC)=O)c(C(NC(SCc(c2ccccc22)ccc2Cl)=N2)=O)c2n1,2 Z2222169448,Cc1nsc(C)c1-c1noc(CC(CCC2)CS2(=O)=O)n1,2 Z1215129981,NC(c(cc(cc1)NC(N(CCSC2)C2c2ccccc2)=O)c1F)=O,0 Y044-5139,O=C(CC1(CCOCC1)n1cccc1)NCCC(c1ccco1)c(cc1)ccc1F,2 8017-8482,O=C(C1)NCC1c(cc1)ccc1S(NCCc1ccco1)(=O)=O,2 SB27-0061,Cc1c(CN(CC2)CCC2N(C2)C3(COCC3)CNC2=O)scn1,2 SC89-0435,CN1CCN(CC(CC2)C(C3)(CN3C(Cc3cccc(Cl)c3)=O)S2(=O)=O)CC1,0 SD15-0442,CN(CC(N(C)[C@@H]1[C@H]2CCN(Cc3c[nH]c(cc4)c3cc4OC)C1)=O)C2=O,2 Z2645601243,OC[C@H](CN(CC1)C(CSCc2ncccc2)=O)[C@H]1c1ccccc1,2 Z2359716617,Cn1nc(CNC(N(CC2)CCC2OC2CCC2)=O)c(Cl)c1,2 Z2644622173,CC(C)[C@@H](C(Nc1cnc2c(F)cccc2c1)=O)NC(NC(C)(C)C)=O,0 F6446-0221,O=C(c(cc1)ccc1-c1cccs1)NC(CC1)CN1c1ncccc1,2 F6284-0091,CSc(cccc1)c1C(NCCc1cncnc1)=O,0 Z2959016486,CC(CC1)(C(NC(C2)CC2(F)F)=O)Oc(c(C)c2C)c1c(C)c2O,2 F6549-5423,Cn1c(C(CC2)CCN2C(c2cc3c(-c4ccccc4)onc3cc2)=O)cnc1,2 F6414-0535,Cc1cc(C(NCC(c(cc2)cc3c2OCCO3)O)=O)c(C)o1,2 Z1754142523,Cc1nnc([C@@H](C[C@@H](C2)OC)N2C(C2CC2)=O)o1,2 Z3390908776,CC(C)c1ccc(C(CO)NC(c(cc2)ccc2C(O)=O)=O)cc1,0 Z1020745732,Nc1nonc1-c1nc2cc(Br)cnc2[nH]1,0 Y042-6046,c12c(/C(=C\C(O1)=O)/C)c(cc1c2CCC(O1)(C)C)OCC(NCC(=O)c1ccccc1)=O,2 C470-0633,CC(C)Cn1c(C(N(C)C(N2C)=O)=O)c2nc1CN(CC1)CCN1c1ccccc1,0 F6619-5997,CC(C)(C)c1ccc(N(CC2)CCN2c2nc(C)nc(N3CCCC3)c2)nn1,2 F5831-0560,O=C(C1(CCOCC1)c1ccccc1)NCCC(CCCC1)N1S(c1cccs1)(=O)=O,2 Z1563130699,CCC(C)(C)c(cc1)ccc1S(Nc1c(C)onc1)(=O)=O,0 V028-0058,CC(CN(CC1)c2ncnc(Oc(cc3)cc(F)c3F)c2)N1C(c(cccc1)c1Br)=O,0 F148-0089,CCN(c(n1nc2)c2C(NCCc2c(C)ccs2)=O)C(CCN(Cc2ccccc2)C2)=C2C1=O,2 F1249-0021,Cc(nc1)cn1S(c1c(C)c(C)cc(C)c1C)(=O)=O,0 F6484-0222,O=C(Cc(cccc1)c1Cl)NC(CC1)CCC1Oc1nccnc1,0 F6526-0189,O=C(Cc1cscc1)N1Cc2cc(C3CC3)nn2CC1,2 F2375-0255,O=C(NCC(CN1c2cccc(Cl)c2)OC1=O)Nc1ccc(C(F)(F)F)cc1,0 Z2352049393,CC(C)(C)c(cc1)ccc1S(Nc1c(C)n(C)nn1)(=O)=O,0 Z4439286489,NC1(CC1)C(CC1)CCN1C(C(CCCC1)C1n1nccc1)=O,2 F6485-1191,O=C(Cc1noc2c1cccc2)NC(CC1)CCC1Oc(nc1)ncc1F,2 Z2299085443,O=C(CCc(cc1)cc2c1[nH]cc2)N1CC(c2ccccc2)NCC1,2 SA59-1882,CC(N(CCNC(NC1CCCC1)=O)C1CCOCC1)=O,2 F6252-3957,O=C1N(Cc2noc(-c(cccc3)c3Cl)n2)C=CC=C1c1nc(C2CC2)no1,2 Z2802492163,CC(CC(N(C1)Cc2c1c(O)nc(C)n2)=O)N(CCC1)C1=O,2 Z2948113505,O=C(C1N(Cc2n[nH]c3c2COCC3)CCC1)NCC1CCCCC1,2 L299-6276,CCCc(c(-c(cc1)cc(S(N2CCOCC2)(=O)=O)c1OC)c1NC(CC2)=O)nn1C2=O,2 F5016-1835,COC(N1CCC(CNC(C(Nc(cc2)ccc2OC(F)(F)F)=O)=O)CC1)=O,0 Z3655281092,OC([C@H](C1)SC[C@H]1NC(C(CCC1)CN1C(C1CC1)=O)=O)=O,2 Z2972551086,O=C(NCc1nccc(OCC(F)F)c1)N1C[C@H](CCC2)[C@H]2C1,2 Z2957973484,CC(CNC(c1c(ccc(Cl)c2)c2ncc1)=O)c1c(C)onc1C,2 SA50-0257,Cn(c(C1)c2CN1C(C1CCOCC1)=O)nc2-c1nc(C2CC2)no1,2 Z1460613934,O=C(c1cccc2nccn12)NC1(CCCC1)c1nccs1,2 F6471-6106,COc(cc1)cc(C(NCc2cncc(-c3cscc3)c2)=O)c1Br,0 L880-0186,CCCN(C1=O)C(SCC(NC(C)CC)=O)=Nc2c1n(C)c(cc1)c2cc1OC,0 V015-8161,O=C(c(cc1)ccc1F)N(Cc1c(N2CCOCC2)onc1-c(cc1)ccc1F)C1CC1,2 C879-2351,Cc1c(CNC2CCCC2)c(C(O)=O)c(C)n1Cc1ccc(C=C)cc1,2 F3267-0019,O=C(c1cc(-c2ccncc2)nc2ccccc12)Nc1cnccc1,2 Z2643301772,Cn1c(NC(c2ccc(CN3CCN(C)CC3)cc2)=O)nnc1C1CC1,2 F6523-3052,O=C(c1cc(Br)cs1)NCCN(Cc(cccc1)c1OC1)C1=O,0 Z1901543419,Cc1c2c(OCC(N(CC3)CCC3Oc3nccnc3)=O)nn(C)c2nc(C)c1,2 F6773-2928,CSc1nccc(N(CC2)CCC2Oc2nccs2)n1,0 Z644629956,CC(C(Nc1cc(Nc2nc(C)nc3c2cnn3-c2ccccc2)ccc1)=O)n1nccc1,0 P085-1070,COc(cc1)ccc1NC(c(cc1)ccc1-c1nnc(cc2)n1cc2NC(C1CCC1)=O)=O,2 S947-0323,Cc1c(CN2C[C@](COCC3CC3)(CN(C3)c(cc4)cc(C(F)(F)F)c4C#N)[C@H]3CC2)scn1,2 Z1171532618,CC(C)n1c(C(CCC2)CN2C(CCc2ccccc2)=O)nnc1,2 V013-2454,CC(C)(C)CC(N(CC1)CCN1c(cc1)ncc1NC(c(cccc1)c1F)=O)=O,0 Z133923758,CCNC(N(CC1)CCN1S(c(cc1)cc2c1OCC2)(=O)=O)=O,0 F6512-1639,Cc(n(-c1ccccc1)nc1)c1C(NCc1nc(C2CCCCC2)cs1)=O,2 Z2852194746,CC(CN(CC1)c(c(F)c2)ncc2Cl)N1c1ccncc1,0 F5261-0246,Cn1c(C(CNS(CCc(cc2)ccc2OC)(=O)=O)N2CCOCC2)ccc1,2 F6473-6015,CC(O1)=CC(OC(C2)CN2C(c2cccs2)=O)=CC1=O,2 F6681-8888,N#Cc(nccc1)c1N1CC(COc(nc2)ncc2Br)CCC1,2 F6442-1871,CC(C)CS(C(C1)CN1C(c(o1)ccc1Br)=O)(=O)=O,0 Z1445008155,CC(C(O)=O)NC(c1cc(C(C)=O)cs1)=O,0 Z1928152790,O=C(CCOc1cccc(Cl)c1Cl)NCCC(NO1)=NC1=O,0 Z4914301086,Cc(n(C)nc1C(OC)=O)c1NC(c1nncc2ccccc12)=O,2 1630-1438,CC(NC(CCC1)=C(C2c(cc3)ccc3Br)C1=O)=C2C(OC1CCCC1)=O,2 Z1575486759,Cc1cc(C(N(CC2)CCC2c2nncn2C)=O)nn1-c(cc1)ccc1OC,2 F6435-1965,O=C(C1(CCCC1)c(cc1)ccc1Cl)N(C1)Cc2c1cncn2,2 F6752-2888,Cn(cc1)c2c1c(N(CCC1)CCN1S(C1CC1)(=O)=O)ncn2,0 Z2307780902,CC(C1)C(C)N1C(NC(C1)CN1S(c(cc1)ccc1OC)(=O)=O)=O,2 Z4506722238,Cn1nc2c(OC)cc(C(N(CCC3=NN4C)CC3=CC4=O)=O)cc2c1,2 F1905-9002,CC(C)(C)N(C(C(C(O)=O)OC1)c2ccc(C)s2)C1=O,2 Z1603188968,OC(CCN(Cc1ccccc1)C(C1COCCC1)=O)=O,2 Z1542790980,CN(Cc1nc(-c2ncccc2)no1)Cc(cc1)cc(F)c1Cl,0 F6540-9093,O=C(CN(CC1)CCC1C(F)(F)F)Nc1cnccc1,0 F3398-4225,CC(CCc1ccccc1)NC(c1cn(-c(cc2)ccc2Cl)nn1)=O,0 Z2226572368,CS(C1CCN(CC(c2ccccc2)c2ccccc2)CCC1)(=O)=O,2 Z393045638,OC(c(cc1)cnc1C(N(CCC1)C1C(NCC(F)(F)F)=O)=O)=O,0 F5854-4729,COCCN(Cc1cscc1)C(CSc(cc1)ccc1F)=O,2 F6521-9351,COC(CNC(c1cc(cccc2)c2[nH]1)=O)(C1)Cc2c1cccc2,2 F6037-0153,O=C(CSCc1ccccc1)N(C1)CC1c1nc(cccc2)c2[nH]1,2 F6755-7320,Cc1cc(N(CC2)CCN2S(C2CC2)(=O)=O)nc2cc(OC)ccc12,2 Z2732694091,CC(C)(CC1)Cc2c1[nH]c(C(O)=O)c2,0 SA96-1496,Cc(n(C)nc1)c1C(N(C1)CC1(CN(Cc1ccccc1)C1)C1C(NCC1CC1)=O)=O,0 F6554-0312,Cn1nc(C(CC2)CCN2C(OCc2ccccc2)=O)cc1,2 Z1148091218,CC(N(CC1)CCN1C(c(cc1)ccc1-c1noc(C(F)(F)F)n1)=O)=O,0 Z2973993961,CN(C)CC(CC1)(CN1c1nc(-c2ccccc2)ncc1)O,2 F6752-7897,Cc1nc2ncnn2c(N(C2)CC2C(N2CCOCC2)=O)c1,2 Z802544480,CCC(C)N(CC(O)=O)C(C1COCC1)=O,0 J500-0508,CC(C)NC(C(C1)C2(CCCC2)CN1C(Cn1c(C)ncc1)=O)=O,2 Z805502878,Cc1noc(C2CCN(CC(Nc(cc3)cc(OC)c3OC)=O)CC2)n1,0 F6562-7002,O=C(C1CC=CCC1)N(CC1)CCC1N(C(COC1)=O)C1=O,2 Z1437554549,Cc1nnnn1-c1cccc(NC(c2c(C)nc(-c3ccccc3)nc2)=O)c1,0 Z2296019514,OC(C(c(cc1)cc2c1OCC2)NC(CC1OCCC1)=O)=O,2 Z1241709941,Cn1nccc1C(CC1)CCN1C(Nc(cc1)cc(C(N)=O)c1Cl)=O,0 Z1256742325,OC(CNCc(s1)ccc1Cl)(CC1)CCS1(=O)=O,0 SC42-0538,CC(C)c1nc(CC2CC(CC3)(CCN3S(c3c(C)onc3C)(=O)=O)OCC2)no1,0 F6524-2748,COC(c(cc1)ccc1C(N(CC1)CC1c1noc(-c2ccccc2)n1)=O)=O,0 F1911-5811,COc(cc1)ccc1C1=CCN(Cc2ccccc2)CC1,2 SD31-0237,COc(cc1)nc(OC)c1C(NCCn1nc(C(NC2CC2)=O)c2c1CCOC2)=O,2 Z1055035610,Cc1nn(CC(CC2)NC(Nc3cc(NC(c4ccccc4)=O)ccc3)=O)c2n1,2 F6725-2776,Cc1nsc(N(CC2)CC2N(CCO2)C2=O)n1,2 F6799-8819,CC(C)S(N(CC1)CCN1c1nc(CCOC2)c2cc1C#N)(=O)=O,2 Z2439958131,Cc(ccc(C(N(C)C1CCNCC1)=O)c1)c1NC(c1ccccc1)=O,2 Z823488244,CC(C)(C)c(cc1)ccc1N(CC1)CCC1NCc1c(C)[nH]nc1C,0 F6445-6512,O=S(c1c(C(F)(F)F)cccc1)(N(CC1)Cc2c1ncnc2)=O,0 Z1593946798,Cc1cccc(NC(CN(c2c3cccc2)N=CC3=O)=O)c1F,0 Z2100426490,CCN(C)C(c1cccc(NC(CN(C(C)(C)C(N2)=O)C2=O)=O)c1)=O,0 Z1755591928,Cn1nc(C2COCC2)c(C(Nc(cc2)ncc2N2CCOCC2)=O)c1,2 F6473-7188,O=C(c1cc(OCc2ccccc2)ccc1)N(C(CC1)C2)C1CC2N(C(CC1)=O)C1=O,2 F6435-3308,Cc1cc(C(N(CC2)CC2(C2)Oc(cccc3)c3C2=O)=O)c(C)o1,2 F6564-5324,CC1=C(C)N=CN(CC(N(CC2)CCN2c2nnc(C3CC3)cc2)=O)C1=O,2 Z1784597395,Cc1c(C2CC2)nc(ccc(Br)c2)c2c1C(NCCN1CCOCCC1)=O,2 F6495-2630,O=C(c1ncnc(N2CCOCC2)c1)N(CC1)CCN1c1cccc(C(F)(F)F)c1,2 Z2910447290,CN(CC(N(CC1)CCC1C(O)=O)=O)C(C(CC1CCC2)CC2C1=O)=O,2 Z2982114983,COc1ccnc(N(C(C2)=O)N=C2C2CCOCC2)n1,2 F6724-1254,OC(CNc1ncnc2cnccc12)(C1CC1)c1cccs1,2 Z3063544682,CC(C1)C1C(N(CC1)C[C@H]1Oc1c(N(C)C)nccc1)=O,2 Z4872562875,COCCN(CCN(C1)C(NCc2c(CS(N3CCOCC3)(=O)=O)cccc2)=O)C1=O,2 G947-4000,CC(CCCC1)N1S(c1c(C)ccc(-c2noc(C)n2)c1)(=O)=O,0 Y205-9070,CCn1ncc(S(N(CC2)CC(C)N2c2ccc(C)cc2)(=O)=O)c1,0 Z821687122,CN(C1CC1)C(CN(CC1)CCN1c1c(ccs2)c2ncn1)=O,2 Z1767782047,CC1(CCOCC1)C(N(C1)CC1OC(F)F)=O,2 Z1273303202,CC(C)(C)NC(c1cc(-c2noc(C3CC3)n2)ccc1)=O,0 F1907-9455,Fc1ccc(CN(CC2)CCN2C2CCOCC2)cc1,2 Z2222564059,Cc1c(CNC(c(cn2)cc(Cl)c2OC2CCCCC2)=O)nc[nH]1,2 D245-0584,Cc1nc2nc(Cc(cc3)ccc3Cl)nn2c(N(CC2)CCN2c(cc2)ccc2F)c1,0 Z1436302469,Cc1noc(C)c1CC(NC1(CCC1)C(O)=O)=O,2 F6681-3494,Cc1c(C(N2CC(COc3cnccc3)C2)=O)sc(C)n1,2 F6809-1234,C=CCNC(CN(CC1)CCC1(c(cc1)ccc1Cl)O)=O,0 F6482-6628,Cc1nn(C)c(C(NCc(cc2)cnc2-c2ccco2)=O)c1,2 F6514-2442,Cc(onc1)c1C(NC(C1CCOCC1)c1cnccc1)=O,2 F6549-6455,O=C(CCC(N1CC(Cn2nncc2)C1)=O)c1ccccc1,2 Z2295993864,Cn1ncc(CCC(NC(C(O)=O)c(cc2)cc(Br)c2OC)=O)c1,0 F6259-1207,CN(C(C=C1)=O)N=C1N(CC1)CCC1C(Nc(cccc1)c1SC)=O,0 Z2718311799,CN(c1c(C(N2C)=O)n(CCC(Nc3n[nH]c(OC)c3)=O)cn1)C2=O,2 CM4435-0887,CC(C)(C)NC(c1cc(CCCCN2CC3CC3)c2s1)=O,0 Z2109181635,CON(Cc1ccccc1)C(NCC1(CCC1)c1ncccc1)=O,0 F5287-0121,O=C(CCc1ccccc1)Nc(cc1)ccc1S(N(CC1)CCN1c1nccnc1)(=O)=O,2 S064-0292,CCOc1nccnc1N(CC1)CC1NC(Cc1cnccc1)=O,0 Z3137428582,Cn(cc1CNC(C2NCCOc3c2cccc3)=O)nc1OC,0 SA95-0226,Cc1cnc(C2N(Cc3cnccc3)CCC2)n1Cc(cc1)ccc1OC,2 Z3687021062,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(c1c[nH]nc1-c(cccc1)c1F)=O,2 Z2940725805,CNC(c(cnn1CCN2C)c1S2(=O)=O)=O,0 Z1900923205,Cc1nc(N(CC2)CCC2Oc2nc3ccccc3nc2)nc(OC)c1,2 Z2278856115,CC(SC1=NC(CN(C2CC2)c2ccccc2)=C2)=NN1C2=O,2 V008-7958,CC(C)NC(N(CC1)CCN1c(cc1)cc(NC(CN(C(C)C)C(C2CCCC2)=O)=O)c1Cl)=O,2 3966-1243,CC1(C)OCCC(CCNCc(cc2)ccc2N(C)C)(Cc2ccccc2)C1,0 F6523-0554,Cc1nc(N(CC2)CCN2C(c2cc(-c(cc3)ccc3OC)n[nH]2)=O)cc(C(F)(F)F)n1,0 C488-1153,Cc1cccc2nc(-c(cc3)ccc3Cl)c(Nc(cc3)cc4c3OCCO4)n12,0 Z367282906,CNC(C(CCCC1)N1C(CCn1ncnc1)=O)=O,2 Z1270331294,CCC(C1)(CN1C(c1cc(CC)nn1C)=O)O,0 L285-1626,CCc(cc1)ccc1Nc(cc1)nnc1-c1cc(S(N2CCOCC2)(=O)=O)c(C)cc1,0 Z28944708,O=C(CCC(N1)=Nc(cccc2)c2C1=O)N(CCC1)C1c(cc1)cc2c1OCCO2,2 Z2063873793,CO[C@@H](C[C@H]1C(N2CCCC2)=O)CN1C(C(C1)CN(C2CCCC2)C1=O)=O,2 S698-0875,Cc1cnc(C2CC2)n1C(CC1)CCN1S(c1cccs1)(=O)=O,2 F6445-0736,O=C(c(cc1)ccc1Oc1nccs1)N(CC1)c2c1cccc2,2 S740-1294,Cc1nc(S(N[C@@H](C2)CN(CCS(N3CCCOC)(=O)=O)[C@@H]2C3=O)(=O)=O)cn1C,0 F2227-1140,O=C(Cn(c(-c1nnco1)c1)c2c1cccc2)OCc1ccccc1,2 F0696-3150,Cc1cc(C)nn1CCNC(C(C(N1Cc(cccc2)c2Cl)=O)=CNC1=O)=O,2 T955-0372,CNC(N(CCC1)CC1c1nc(CCOc(cc2)ccc2F)no1)=O,0 Z2881706963,CC(C)C(N(CC1)CC1c1n[nH]c(O)c1)=O,0 F3374-0578,Cc1cc(NC(c2ccco2)=O)c(cc(cc2F)F)c2n1,0 F6549-6976,O=C(c1cc(-c2ccccc2)n[nH]1)N1CC(CN(C(CC2)=O)C2=O)C1,2 Z2041545958,Cc([nH]c1ccc2)nc1c2-c1noc(C(CC2)CCN2C(c2c3cccc2)=NS3(=O)=O)n1,2 Z953545658,CN1CC(CNC(c(ccc(Cl)c2)c2Cl)=O)OCC1,0 Z2998881453,Cc1nn(C(CCN2C(c3cc4cccn4cn3)=O)C(F)(F)F)c2c1,2 Z2433890462,Cc1c(C)[nH]c2c1c(N(CC1)CCN1C1CN(Cc3ccccc3)CC1)ncn2,2 F990-0458,CSc1cc(N2N=C(c3nc(-c4ccccc4)no3)c(cccc3)c3C2=O)ccc1,0 Z3482514269,O=C(NC1)Nc2c1ccc(OCc1cnccc1)c2,2 8004-5592,O=C(C(Nc(cccc1)c1F)=O)NCc(cccc1)c1Cl,0 S069-4635,COc(cc1)ccc1S(N(CC1)CC1c1noc(-c2nccnc2)n1)(=O)=O,2 F6619-6157,Cc1nc(CN(CC2)CCN2c2cc(N3CCOCC3)nc(C)n2)no1,2 L697-1163,O=S(c1cn(Cc2noc(/C=C/c3ccccc3)n2)cn1)(N1CCOCC1)=O,2 F6562-9451,O=C(Cc(cc1)cc2c1OCO2)NCc1nccnc1-c1ccco1,2 S904-0907,CN1Cc2nnc([C@H](C[C@@H](C3)O)N3C(c(ccc(OC)n3)c3OC)=O)n2CC1,2 F6540-2944,Cn1nccc1C(CCCC1)N1C(c1ccco1)=O,2 Z1869831672,O=C(CNC(C(C1)Cc2c1cccc2)=O)Nc1cnccc1,0 F129-0219,CC(c1cccc(NC(NC(C(Oc2c3cccc2)=O)=C3NC2CCCCC2)=O)c1)=O,0 Z2755406928,COc1c(CCNC(CCc2ccc(C(F)F)cc2)=O)ccc(C(O)=O)c1,0 D754-0006,O=C(CCCC(N1)=Nc(cccc2)c2C1=O)NC[C@@H](CN(Cc1c2cccc1)C2=O)c1ccccc1,2 Z2175128020,COCc1nc(CNC(C(CC2=O)CN2c(cccc2)c2F)=O)cs1,2 Z2805700420,CC(C)CC(C(O)=O)NC(c1n[nH]c(-c(cccc2)c2O)c1)=O,0 Z1903138333,Cc(ccc(NC(c(ccc(-n1nnnc1)c1)c1Cl)=O)c1)c1N(CCN1)C1=O,2 F6360-9460,O=C(c1cc2c(-c3ccccc3)onc2cc1)N(C1)CC1Oc1cnccc1,2 Z1680778564,Oc1ccc(CCC(N(CCC2)CC2c2noc(C3CC3)n2)=O)cc1,0 Z295540804,O=C(C(CCC1)CN1C(c(cc1)ccc1Cl)=O)NCc(cc1)cnc1-n1cncc1,2 SC65-0449,CC(C)CN(C[C@](C1)(C2)[C@H]1C(NCCCc1ccccc1)=O)[C@@H]2C(NC)=O,2 Z998685860,O=C(CCn1cncc1)N(CC1)CCC1c1ccccc1,0 F6279-0209,O=C(c(cc1)ccc1OC(F)(F)F)NCc1cscc1,0 C999-0076,Cc1nn2c(C)c(CC(NCCCN(CCC3)C3=O)=O)c(C)nc2c1-c1ccccc1,2 Z1534018850,CC(C)n1nccc1C(NC1(CCOCC1)c(ccc(F)c1)c1F)=O,2 F6554-4869,CC(C)Sc1ccc(CC(N2CC(CF)C2)=O)cc1,0 S639-1963,CNC(N(C[C@@H]1CN(C)C)C[C@@H]1NC(c(cccc1)c1OC(F)(F)F)=O)=O,0 Z1474328595,C[C@@H](C(OC(C)(C)C)=O)NC(C(Cc1c[nH]c2c1cccc2)NC(N)=O)=O,0 F2366-0321,Cc1c(-c(cc2)nnc2SCc2ccc(C(F)(F)F)cc2)sc(-c2cnccc2)n1,2 F6556-4493,COC(CNC(C(Nc1cccc(N(CCC2)C2=O)c1)=O)=O)c1cc(cccc2)c2o1,2 F6547-0014,CC(C)(C)NC(CN1Cc2cc(C3CC3)nn2CC1)=O,0 F6810-0537,CCN(c(ncnc1N(CC2)CCN2c2ncncc2C)c1N1)C1=O,2 8013-1392,OC(c1cccc(NC(CS(c(ccc(C(F)(F)F)c2)c2Cl)(=O)=O)=O)c1)=O,0 Y500-5537,CCc1c(C)sc(NC(c(cnn2c(C(F)(F)F)c3)c2nc3-c2ccccc2)=O)c1C(N)=O,2 F6793-7166,O=C(Cn1c(cccc2)c2nc1)N1CCN(CC(F)(F)F)CC1,0 Z2974176280,CC(C)(C)c1nsc(N(CCC2)CCC2n2nncc2)n1,0 F3215-0117,CC(C)NC(c1c(COc2ccc(C)cc2)occ1)=O,0 S460-0807,CC(C)c1noc(-c2cn(C(CC3)CN3C(Cc(cc3)ccc3Br)=O)nn2)n1,0 E530-0118,O=C([C@@H]1[C@](c(cccc2)c2N2)(C2=O)N(CCC2)[C@H]2C1)Nc(ccc(Br)c1)c1F,2 F6612-0037,CSc1ccc(CCC(N2c3nc(N4CCOCC4)ncc3CCC2)=O)cc1,2 F6549-8596,O=C(CSC1CCCC1)N(C(CC1)C2)C1CC2Oc1cnccc1,2 F627-0817,CCNC(N(CC1)CCN1c(cc1)ccc1-c1noc(C2CCC2)n1)=O,2 G535-0427,CCc1c(C)sc2c1CCN(Cc1c(C)oc(-c(cc3)ccc3Cl)n1)C2c1ccccc1,0 F2647-0418,CCSc1cccc(C(Nc2c(C(NC)=O)c(C)c(C)s2)=O)c1,0 SB71-0729,Cc1nn(C)cc1C(N1Cc2cc(C(NC3CCCC3)=O)nn2CC1)=O,2 SB92-1310,CCc(cccc1)c1S(N(C1)CC1N(CCN1CCCCC1)S(CC)(=O)=O)(=O)=O,2 Z3711266268,COCCCNS(c(cc(N1CCCC1)nc1)c1F)(=O)=O,0 F3235-0983,CN(c1c(C(N2CCN3CCOCC3)=O)n(CCCN3Cc4ccco4)c3n1)C2=O,2 Z2970700156,CCc1c[nH]c2c1c(NC[C@@H](CCC1)N1S(C)(=O)=O)ncn2,2 F6573-4176,CSc(cccc1)c1C(NCCOCCN(C(CC1)=O)C1=O)=O,0 8019-6839,OC(CC(Cn1ncc(-c(cc2)ccc2Cl)c1N1)C1=O)=O,2 Z2210525331,CC(CN(Cc1nc(C#N)cs1)C1)Oc2c1cccc2,0 Z3043014501,O=C(NCc1nnc2n1CCOCC2)NCc(cc1)ccc1-c1ccncc1,2 SA72-0036,COCCC(CC1)(CCN1C(c(cc1)cc2c1[nH]cn2)=O)c1noc(C2CC2)n1,2 C160-0061,CC(c(cc(c(OC)c1)OC)c1N(C(c1c2c3ccccc3nc1C)=O)C2=O)=O,2 S543-0624,CS(N(C1CC1)C1CC2(CCNCC2)OCC1)(=O)=O,0 F6782-4469,C=CCSC(N1Cc2ccccc2)=NC(CCCC2)=C2C1=O,2 F6523-0359,Cc1c(C(N(CC2)CCN2c2ncnc(C(F)(F)F)c2)=O)scn1,0 F6608-1088,FC1(CC(COc2ncnc3ccccc23)C1)F,2 E146-0441,O=C(c1noc-2c1COc1c2cccc1)N(CC1)c2c1cccc2,2 8019-7687,Cc1cc(NC(c(cc2)cc3c2OCCO3)=O)cc(-c2nc(cc(cc3)Cl)c3o2)c1O,0 Z1252675890,Cc1cnc(CN(C)c2n[nH]c(-c(cc3)ccc3OC)c2)cn1,2 Z103867424,NC(C1CN(Cc2cccc(C(F)(F)F)c2)CCC1)=O,0 F6414-2218,CSc1ccc(C(CNC(c2cc(Br)cs2)=O)O)cc1,0 F5319-0128,CN(C(C=C1)=O)N=C1C(Nc(ccc(Br)c1)c1F)=O,0 Z3104239225,COc1cccc2c1CCC2(C(Nc(cc1)cnc1OC)=O)N,0 Z4114482207,Cc1c(C(O)=O)sc(C(NCCc2cc(CCOC3)c3cc2)=O)c1,2 F5596-0351,CC(C)c1nnc(C(CC2)CCN2C(C2c(cccc3)c3Oc3c2cccc3)=O)o1,2 F5485-1685,CC(c1ccccc1)SC(N1)=NC(C)=C(CC(N(CC2)CCC2C(OC)=O)=O)C1=O,2 F6250-0528,Cc1cccc(NC(NC(CCC2)CC2OC(Nc(cc2)ccc2F)=O)=O)c1,0 Z2445949234,CCCN(C)S(N(C[C@@H]1C(O)=O)C[C@@H]1c1cc(F)ccc1)(=O)=O,0 F6788-8852,CC(N(C)C1CN(CC(C=CN2C)=CC2=O)CC1)=O,2 F6245-4462,CC(C)(Cc1ccc2)Oc1c2OCC(N(CC1)CCC1C(N1C2CC2)=NN(C)C1=O)=O,2 Y501-3025,COc1cc(NS(c(cc2)ccc2NC(c2ccc(COc3cc(CCC4)c4cc3)o2)=O)(=O)=O)ncn1,2 F3263-0065,CC(Nc(cc1)ccc1OCC(COc1c(C)cccc1C)O)=O,0 SC42-0107,Cc1nc(CC2CC(CC3)(CCN3C(CN(c(cccc3)c3O3)C3=O)=O)OCC2)no1,2 F5772-2767,O=C(NCCc1ccccc1)Nc1nc(c(F)cc(F)c2)c2s1,2 Z1201753297,Cc1ccc(-c2csc(NC(C3N(C)CCC3)=O)n2)s1,2 F926-1763,CNC(N(CCC1)CC1c1cc(C(N(CC2)CCN2c2cc(OC)ccc2)=O)ccc1)=O,0 Z1766759440,Cc(cc1)c(C)cc1-c1n[nH]c(C(NCc2cccc(S(N(C)C)(=O)=O)c2)=O)c1,0 Z4403885063,Cc1ccc(CNC(c(cc(C)cc2)c2S(NC(C2CCN(C)CC2)=O)(=O)=O)=O)cc1,2 F6515-3986,O=C(c1cccc(Cl)c1)NCc1cncc(-c2cnccc2)c1,0 F6619-7841,CC(C1)OC(C)CN1C(CN(CC1)CCN1c(cc1)nnc1-n1nc(C)cc1C)=O,2 Z3687063897,N#Cc(cc1)cc(C(N[C@@H](CC(Cn2cncc2)C2)[C@H]2O)=O)c1F,0 V018-8223,CCN(CCC(NCC1CC1)=O)C(c1nn(CCCN(Cc2ccc(C)cc2)C2=O)c2c1)=O,2 F6546-0847,OC1(CN(C2)CC(C3)C2CN3C2CC2)CCCC1,2 Z2067162264,CCOC1CC(CSc2nc(ncnc3)c3[nH]2)C1,0 F6442-0026,Cc1csc(C(N(C2)CC2S(c(cc2)ccc2F)(=O)=O)=O)c1,0 F3316-0213,O=C(c1cccc(Br)c1)NCCN(CC1)CCN1c1ncccc1,2 F0577-0016,CCN(CC)c1ccc(C(C(C(CCC2)=O)=C2N2)C(C(N3)=O)=C2N=C3SC)cc1,2 Z2391955530,CN(C=CC=C1NC([C@H]2CNCCC2)=O)C1=O,2 F6482-3461,O=C(Nc1ccc(C(F)(F)F)cc1)N(C1)CC1n1nccn1,0 F6360-9331,O=C(C1(CCCC1)c(cc1)ccc1Cl)N(C1)CC1Oc1cnccc1,2 Y070-2498,O=S(c1cc(-c2cn(cccc3)c3n2)ccc1)(N1CCOCC1)=O,0 Z1312268628,CCN(C)S(N(CC1)CCC1NC(c1c(C)cccc1)=O)(=O)=O,0 Z2489740734,Cn1cnc(C(NC(CC2C(O)=O)c3c2cccc3)=O)c1,0 G944-0607,O=C1Oc(cccc2)c2C=C1c1nc(-c(cc2)cc3c2n(C2CCCC2)nn3)no1,2 F6550-6554,O=C(Cc1cccs1)N(C1)CC1Nc1ncncc1,2 P803-1268,O=C(c(cc1)cc2c1[nH]cc2)N(CCC1)CCN1c1cc(-c(cc2)ccc2Br)n[nH]1,2 F6677-0844,CC(C)c1nccn1CC(C1)CN1C(c1nccc2ccccc12)=O,2 S988-0467,CCS(N(C[C@@H]1CN(C2)C(CCn3nc(C)cc3C)=O)C[C@@]12c1nc(C)no1)(=O)=O,0 F5496-0536,Cc1nnc(C(CC2)CCN2C(C2c(cccc3)c3Oc3c2cccc3)=O)s1,2 E786-0722,Cc1noc(-c(cc2)ccc2S(N(CC2)Cc3c2cccc3)(=O)=O)c1,2 Y020-6301,O=C(CC(C(NC1C2CCCC1)=O)N2C(Nc1ccccc1)=O)Nc1ccccc1,2 F6279-0594,O=C(c1noc(C2CC2)c1)Nc(cc1)cc2c1OCCC(CCCC1)N1C2=O,2 F9995-2412,COC(c1c(C(OC)=O)snc1-c1ccccc1)=O,2 SC88-1719,CCNC(N(C1)CC1(C(CC1)c2nc(Cc(cc3)ccc3OC)no2)S1(=O)=O)=O,0 V026-1597,O=C(C1CCC1)N(CCC1)CCN1c1nc(C2CC2)nc2c1cnn2-c1ccccc1,2 Z1870246194,CC(Cc(cc1)ccc1NC(Cc1n[nH]c2c1cccc2)=O)C(O)=O,0 G932-0722,COc(cc1)cc(Nc2nc(N3CCCC3)nc3c2cnn3-c2ccccc2)c1OC,0 SA96-1343,Cn1c(C(N(C2)CC2(CN(Cc2ccccc2)C2)C2C(N2CCCC2)=O)=O)cnc1,2 F2758-0674,CN1N=C(CNS(C2CC2)(=O)=O)c(cccc2)c2C1=O,2 Z1578245480,CCNC(NC(CN1CCC(Cc2cnccc2)CC1)=O)=O,0 Z4927221814,CC(C1)(CC1(F)F)C(N1Cc(cccc2)c2OC(CC2)(CCN2C(c2cncnc2)=O)C1)=O,2 Z1450513995,Cc1c(CC(N(CCc2ccc3)c2c3F)=O)c(C)nn1C,0 M577-0122,O=C(Cc1cccn1-c(cc1)ccc1Cl)NCCCN1CCCC1,2 F6609-9400,O=C1N(C2CC2)C(SCc2nc(-c3ncccc3)no2)=Nc(cc2F)c1cc2F,2 F5527-1239,O=C(C(CCC1)CN1c(cc1)nnc1-c1ccco1)NCCc1c[nH]c2c1cccc2,2 Z3102440672,O=C(NC(CC1)Cc2c1[nH]nc2)N(CCC1)[C@@H]1C(F)F,0 Z4425706482,COc1cccc(C(N(CC2)CCC2N(Cc2ncccc2)C(c(ccnc2)c2F)=O)=O)c1,2 F6438-6463,CN(C(COC1)C1F)C(c1cc(cccc2)c2[nH]1)=O,0 F5833-8463,CN(C)S(c(cc1)ccc1C(Nc(cc1)cc(CC2)c1N(C)C2=O)=O)(=O)=O,0 SC21-0158,CCCn1c(-c2nn(C)c(CC3)c2CN3S(c2cccs2)(=O)=O)ncc1C,2 7775-0065,Cc1c(C(c(cccc2)c2N2Cc(cc3)ccc3Cl)(C2=O)O)c(cccc2)c2[nH]1,2 Z2475401888,C[C@@H](CC[C@H]1C(O)=O)N1S(c(cc(c(C)c1)F)c1F)(=O)=O,0 Z2965040541,Cn(c(-c(cc1)ccc1F)c1)nc1C(Nc1cn(C2CCC2)nc1)=O,2 Z3602204447,CCn1nnc(NC(N(C2)CC22CCCC2)=O)c1,2 J038-1997,Cc(cc1C)cc([C@H]2OCCC[C@@H]22)c1NC2c(cc(cc1)Cl)c1OC,0 F6125-0886,CC(N(C1)CC1C(Nc(cccc1)c1SC)=O)=O,0 8017-7834,OC(CC(c(cc1)ccc1OC1CCCC1)NS(Cc1ccccc1)(=O)=O)=O,2 F6258-3077,CC1=CN=CN(CCNS(Cc(cc(cc2)F)c2F)(=O)=O)C1=O,2 S696-1526,Cc1cnc(-c2ccncc2)n1CC(C1)CN1C(NCC1OCCC1)=O,2 F5260-0260,Cn1c(C(CNC(c(c(F)ccc2)c2Cl)=O)N2CCOCC2)ccc1,0 F2145-0843,CC(C)(C)OC(N1CCN(Cc2csc(N)n2)CC1)=O,0 G939-1198,CC(CC1)CCN1c(cc1)ccc1NS(c(ccc(-c1ccno1)c1)c1OC)(=O)=O,2 F6554-0938,Cn1nc(C(CCC2)CN2C(c2c3OCCOc3ccc2)=O)cc1,2 Z3289524357,Cc(cc1)c(cc(C(N2CC(c3ccccc3)=CC2)=O)[nH]2)c2c1F,0 Z2053652730,COC(CC1)(CCN1c1nccnc1)c1nc(C2CCOCC2)no1,2 E130-0623,FC(c1cccc(Nc2nc(-c(cccc3)c3OC3)c3c(-c3cccc(Cl)c3)n2)c1)(F)F,0 Z4464308322,CC(C)C(CCC1)C1NC(c1c(CCCC2)n2c(C(F)(F)F)n1)=O,2 Z3071567703,CC(C)c1nc(CCNS(C2CC(C)CC2)(=O)=O)cs1,0 SB15-1019,Cc1cn(CC(N(CCC2)CC2N(C2CCOCC2)C(COC)=O)=O)nc1,2 Z786103064,O=S(c1c[nH]c2c1cccn2)(Nc(ccc(Cl)c1)c1F)=O,0 Z1128977649,CCCC(N(CCC1)CC1C(N(CCCC1)C1C(N1CCOCC1)=O)=O)=O,2 V026-2692,CCN(CC)c1cc(COC)nc(SCc2cc(C(NCC3OCCC3)=O)ccc2)n1,0 Z2768784424,CCN1N=C(c2nnc(C3)n2CCC3C(OC)=O)c(cccc2)c2C1=O,0 Z3809346769,COCc1ccc(Cc2noc(C(CC3)CN3c(ccc(C#N)c3)c3F)n2)cc1,2 Z1234015070,CC(N=C1SC(CN2CC(Cc(cc3)ccc3F)CC2)=NN11)=CC1=O,2 F6495-5330,COc(cccc1)c1N(CC1)CCN1C(C(C1)CN1c1ncnc(-n2nccc2)c1)=O,2 E734-1435,CC(c(cc1)cc2c1OCCO2)NC(c1cc(S(N2CCOCC2)(=O)=O)cn1C)=O,2 SC16-0067,CS(N(CC1)CCC1c1noc(CC(C2)CN2C(c2ncncc2)=O)n1)(=O)=O,2 L287-1186,COc(cc1)cc(OC)c1NS(c1cc(-c2noc(C3CCC3)n2)cs1)(=O)=O,0 F6445-0190,O=C(c1cc(Oc2ncccc2)ccc1)NCCCN(CCC1)C1=O,2 F5033-3017,COc1ccc(CNC(NCC(CC2)CCN2S(C)(=O)=O)=O)cc1,0 G069-0426,CC(C)(c(cc(cc1)S(N(CC2)CCN2c(cc2)ccc2F)(=O)=O)c1N1C)C1=O,0 Z1549949111,CC(CN(Cc1ccccc1)C(C(c1cc(Cl)cc(Cl)c1)O)=O)O,0 S811-0023,O=S(Cc1ccccc1)(N(CC1)CCC1OCc1noc(C2OCCC2)n1)=O,2 Z2963167666,Cc1csc(CC(CC2)CN2C(C(C=CC2=NN3)=CN2C3=O)=O)n1,2 F6473-1851,O=C(Nc1ccc(C(F)(F)F)cc1)N(C(CC1)C2)C1CC2N(CCN1)CC1=O,2 Z2755421595,CC(C1)(CC1NC(c1cc(C(O)=O)nn1C)=O)c1ccccc1,2 K784-9844,CCC1Oc(ccc(C)c2)c2N(CC(NC(C)CCc2ccccc2)=O)C1=O,0 Z2256303965,Cc1c(CC(Nc2cccc(-n3ncc(C(O)=O)c3C)c2)=O)c(C)nn1C,2 S971-0557,COc1ccc(C2(CCCCC2)C(N(CC2)CCC2(CC2)C2O)=O)cc1,2 J039-0144,CC(c(n1C)nnc1SCC(Nc(cc(cc1)Cl)c1O)=O)N1c(cccc2)c2OCC1=O,0 L066-0093,Cn1cnc(S(N(CCC2)CC2c2nnc(C(Nc(cc3)ccc3Cl)=O)s2)(=O)=O)c1,2 Z1445457055,OC(c1cc(Cl)cc(NC(Cc2cccs2)=O)c1)=O,0 Z31725066,Cc1nc2ccccc2c(C(NCCO)=O)c1,0 F6685-8881,O=C(c1cnc(C(F)(F)F)cc1)N1CC(COc(nccc2)c2Cl)CCC1,0 Z4969863483,NCc1cccc(CCC(NC(C(Nc2c[nH]nc2)=O)c2ccccc2)=O)c1,0 F6676-2539,CN(C(CC1)CCN1S(CCc1ccccc1)(=O)=O)c1ncccc1,2 Z603-6983,O=C(C1CC1)N(CC1)CC1NC(Nc(cccc1)c1F)=O,2 F6497-0705,O=C(c(cc1)ccc1N1CCOCC1)N1CC(Cc2nc(C3CC3)no2)CCC1,2 J029-0714,COc(cc1)ccc1-n1nc(cc(cc2)NC(C3(CCCC3)c3ccccc3)=O)c2n1,2 G856-2424,CC(CC1)CCN1S(c1cccc(C(N(C)C(C)(CC2)CS2(=O)=O)=O)c1)(=O)=O,2 F6404-4549,COc1noc(C(NC2(CC(C3)C4)CC4CC3C2)=O)c1,2 F2493-3384,O=C(c1ccc(Cn2cncc2)cc1)NCc1noc(-c2ccco2)c1,2 Z2028116711,Cc1nc(C)nn1C(C1)CN1C(c(c(O)cc(Cl)c1)c1Cl)=O,0 Z2755345492,CC(CC1)(CN1C(c1cc2c(C)ccc(F)c2[nH]1)=O)C(O)=O,0 Z2646272394,CC(C1(C)C)N(C(c2c(C)cnn2C)=O)c2c1cccc2,2 SB53-0915,CN(C)C[C@@H](CN(C1)C(COc2ccccc2)=O)[C@H]1c1nnc(-c2ccccc2)o1,2 F2189-1028,CC(C)(C)OC(NC(C(N(C)C)=O)c(cccc1)c1Cl)=O,0 Z2376924658,CC(CC(C1)C(O)=O)CN1C(c(cc1)cc2c1scc2)=O,2 Z1717298855,CCn1nc(CN2CCC(CC(N)=O)CC2)c2c1cccc2,0 Z2569541240,Cc1c(C(O)=O)c(S(NCCc2c(C)ccnc2)(=O)=O)c(C)o1,0 F5889-0351,CN(CC(N(CC1)c2c1cccc2)=O)C(c1c[nH]c2c1cccc2)=O,2 N038-0206,CC(C)=CCC(C(CC1)O)(c2c1c(OC)c(cco1)c1n2)OC,0 S971-1109,Cc1noc(C)c1S(N(CC1)CCC1(CC1)C1O)(=O)=O,0 F3406-9677,CCc(cccc1)c1NC(CN1C(N2CCCCC2)=NC(C)=CC1=O)=O,0 F3406-4704,COc1cccc(NC(C(CC2)CCN2C(N(c2ccccc2)C2=O)=Nc3c2scc3)=O)c1,2 F6478-5948,O=C(c1ccco1)N(CC1)CC1Oc(nc1)ncc1Cl,2 Z4093803276,CC(NC(C=C1)=O)=C1S(NC(CC(CC1)CCN1OC)=O)(=O)=O,2 Z1517976000,CNC([C@H](Cc1c[nH]c2c1cccc2)NCc1cc(F)cc(F)c1)=O,0 Z606-0333,CC(C1)Oc(ccc(C)c2)c2N1C(c1ncccc1)=O,2 Z1643821388,Cc(cc(cc1)C(NCC(Nc2cc(Cn3cncc3)ccc2)=O)=O)c1[N+]([O-])=O,0 3993-2754,C(c1ccccc1)Oc(cc1)ccc1Oc1c(c(CCCC2)c2s2)c2ncn1,2 Z316510882,O=C(CN1N=Cc(cccc2)c2C1=O)N1C(Cc2ccccc2)CCC1,2 Y040-8577,N\1(C(c2c(\N=C1)cccc2)=O)C[C@@H]1CC[C@@H](C(N[C@H](C(=O)O)C)=O)CC1,0 F1174-0396,Cc1cc(C(CSc2nnnn2-c2ccccc2)=O)c(C)n1Cc1ccco1,2 Z4995241646,NCC(c(cccc1)c1F)NC(C(C1)Oc(c(F)c2)c1cc2F)=O,2 SD67-0186,CC(C)CN(CC(N(CCC1)C2CN1C(CCCc1c[nH]c3c1cccc3)=O)=O)C2=O,2 F6416-8623,Cc1cc(C(CCNC(C(CC2=O)CN2c(cc2)ccc2F)=O)O)c(C)o1,2 F2167-4193,CC(C)(C)OC(NC(Cn1nncc1)c1ccccc1)=O,0 D430-1038,Cc1nc(-c(s2)ccc2S(N(CC2)CCN2c2nc(C)nc(N(C)C)c2)(=O)=O)cs1,2 Z1341807752,NC(C(CCCC1)C1NC(Cn1nc(C(F)(F)F)cc1)=O)=O,0 F6524-0531,O=C(CCc1cccc(Cl)c1)NCCN(C=Cc1c2occ1)C2=O,2 Z3686044279,CN(C(C=C(N(CC1)C[C@H]1NCc1cc(C#N)c[nH]1)N1C)=O)C1=O,2 Z1971115631,CC(C)Oc(ccc(NC(N(CC1)CCC1c1ccnn1C)=O)c1)c1C(N)=O,0 Z2353313776,COc1c(C2(CNC(N(CCC3)CC3C(O)=O)=O)CC2)cccc1,0 Z3063555272,C[C@@H](C1)[C@@]1(COC)S(N1CC(C(NC)=O)OCC1)(=O)=O,0 Z198195798,NC(NCCc1cccc(Cl)c1)=O,0 8018-3869,O=C(C1OCCC1)Nc(cccc1)c1C(NC1CCCCC1)=O,2 Z45497673,CC(C)NS(c(cc1)cc(C)c1Br)(=O)=O,0 J006-1131,Cc1c(C2N(Cc3cn(C)nc3C)CCCCC2)scc1,0 F6374-5492,Cc1cc(C(N2CCC(CSCc3ccco3)CC2)=O)c(C)o1,2 S976-1355,Cc1c(CN(CCC2)CC2(C(N2CCCC2)=O)F)scc1,0 F2485-0963,Cc(cc1)ccc1S(N(CCC1)CC1C(Nc(cc1)ccc1Cl)=O)(=O)=O,2 Z3185176994,O=C(C(CC1)CCC1Cl)Nc(cc1)cc(N2)c1OC2=O,2 Z2232110776,NC(C[C@@H](c1ccccc1)NC(c(cccc1)c1-c1ncc(-c2ccccc2)o1)=O)=O,2 Y205-6846,CCC(C)c(cc1)ccc1S(N(CC1)CCN1S(c1ccc(C)cc1)(=O)=O)(=O)=O,0 Z4617281498,CCCCC(CC)C(NC(CCS(N1)(=O)=O)C1=O)=O,2 F3222-5303,Cc1cccc(N(CC2)CCN2c2nccnc2SCC(Nc(cc2)cc3c2OCO3)=O)c1C,2 Z909662992,O=C(CNc1ncnc2c1cn[nH]2)N(CC1)CCN1c1ccccc1,2 Z1426642540,O=C(Cn1nnc(-c2ccccc2)c1)N(C1CCCC1)C(CC1)CS1(=O)=O,2 F6556-0927,Cc(c(NC(C(NCC(CSC1)(c2c1cccc2)O)=O)=O)ccc1)c1Cl,0 Z4666196658,OC(C(CC1C(NCc2cnccc2)=O)=NN1c1ccccc1)=O,2 Z2335496513,CCOc(cc1)cc(F)c1NC(c1c(C(F)(F)F)n(C)nc1)=O,0 Z2957046076,COc1cc(C(NC(CC2)CN2c(c(F)ccc2)c2F)=O)ncn1,2 F6675-7347,O=C(NCc(cc1)ccc1F)NC(C1)CN1c1ncccc1,2 Z1514562220,NC(c(cc1)ccc1OCC(N(CC1)CC1C1CCOCC1)=O)=O,2 Z2185721968,CC(C(N1c2cc(Oc3ccncc3)ccc2)=O)(c(cc2)ccc2F)NC1=O,2 8013-1649,OCCN1CCN(CCC(Nc(cc2)ccc2OC(F)(F)F)=O)CC1,0 Z2066046245,Cc(cnn1C)c1S(N1CC(CC(O)=O)CC1)(=O)=O,0 F6472-7383,Cc1nn2c(CCN(C3)C(Nc4c(C(F)(F)F)cccc4)=O)c3cnc2c1,2 SB55-0572,CC(C)Cc1nc([C@@](CCC2)(C3)[C@@H]2CN3C(C2(CC2)c(cc2)ccc2OC)=O)no1,0 SD56-0401,COc1cccc(CN(CCC2)CC(C(N3c4ccccc4)=O)N2C3=O)n1,2 F6515-1648,O=C(c(s1)ccc1Cl)NCc1c(-c2ccco2)nccc1,2 C365-0043,O=C(CSC(N1)=Nc(n(-c2ccccc2)nc2)c2C1=O)N(CC1)c2c1cccc2,2 F6806-6492,O=C(CN(CCC1)CCN1S(C1CC1)(=O)=O)NCc1ccco1,2 Z1143615544,CC(C(NCC1)=O)N1C(NCc(s1)ccc1S(NC)(=O)=O)=O,0 Z31228959,CCOC(N(CC1)CCN1C(C=NN(c1ccccc1)C1=O)=C1Cl)=O,0 Z2483032769,OC(C(c1cccc(Cl)c1Cl)N(CCC1)CC1n1nncc1)=O,0 F6525-6297,Cc(n(CCNC(c1c(C(F)(F)F)cccc1)=O)nc1C)c1-c1cscc1,0 Z3071742228,Cc(occ1)c1-c1noc([C@]2(CC3)[C@@H]3CNC2)n1,2 Y203-8955,CCOc(cccc1)c1C(NC(C)C1C(CC2)CC2C1)=O,0 6466-0212,O=C(CSc1nc(-c2c(CC3)cccc2)c3c(C(F)(F)F)n1)N(CC1)CCN1C(c1cc(F)ccc1)=O,2 4072-2628,CC(C)(C1)NC(C)(C)c2c1c(C#N)c(NC(COc1c(C)cccc1)=O)s2,0 Z3799774208,Cc1nnc([C@](CC2)([C@@H]2CC2)N2C(Cc2coc3c2cc(C)c(C)c3)=O)o1,0 SD12-0332,O=C(C1Cc2nc(-c3ccncc3)no2)NCCN1S(Cc(cc1)ccc1F)(=O)=O,2 F6523-1580,Cc1cc(N(CC2)CCC2NC(c2ncccn2)=O)n[nH]1,2 F1813-0611,O=C(C1CC1)Nc(sc1c(cc2)Cl)nc1c2Cl,0 S616-0129,O=C(NC1CCCCC1)N1C[C@@H]2N(Cc3ccccc3)C[C@@H]2CC1,2 J092-0003,OC(CC(c1ccc(-c(cc2)ccc2Cl)o1)=O)(c(cc(cc1)F)c1N1)C1=O,0 Z1778570809,OC1(CN(Cc2ccccc2)CC1)c1nc(-c2cccc(Cl)c2)no1,0 Z2091910952,CC(CC1)(CCN1c(ccc(Cl)c1)c1C#N)C(N1Cc2ncnn2CC1)=O,0 F5241-0028,COc1cc(N(CC2)CCN2C(c2c(C(F)(F)F)cccc2)=O)nc(OC)n1,0 F6456-2118,O=C(C(CC1)CCN1c(cc1)nnc1-n1ncnc1)Nc(ccc(Br)c1)c1F,0 Z1718757561,Cc1nccn1Cc(c(Cl)c1)cnc1Cl,0 F6204-0877,O=C(C1Oc(cccc2)c2OC1)NC1(CCOCC1)c1cccs1,2 Z4140222345,C(C1)C1c1nc(-c2cccc(N3CCOCC3)n2)no1,0 F6279-0679,Cc1cc(CNS(Cc2ccc(C(F)(F)F)cc2)(=O)=O)c(C)o1,0 G765-0235,CN1CCN(CCCNC(NC(C2)COc3c2cccc3)=O)CC1,2 F6414-1127,OC(CNC(COc(cc1)ccc1Cl)=O)(CC1)Cc2c1cccc2,2 F6178-4877,CCOc(cccc1)c1C(NCC(CC1)CCN1c1nccnc1)=O,0 M976-0631,COc1cccc(NC(C(CC2=O)CN2c(cc2)cc(CC3)c2N3C(C2CCC2)=O)=O)c1,2 F5594-0039,Cc1cccc(NC(CN2CCN(Cc3nc(-c4ccccc4)cs3)CC2)=O)c1C,0 F6793-7267,CC(C)OCc1ccc(C(N2CCN(CC(F)(F)F)CC2)=O)o1,0 Z2067035268,CC(Cn(cc1)c2c1cccc2)C(N(CC1)CCC1C(Nc1ccncc1)=O)=O,2 F6482-8285,O=C(NCc(cc1)cnc1-c1cnccc1)NC(c1ccccc1)c1ccccc1,2 S570-0302,CN1C2=CCCCC2(CNC(C2(CC2)c(cc2)ccc2OC)=O)CCC1=O,0 J006-1409,CC(C)c1cc(C2N(Cc(cc3)cc(O)c3OC)CCC2)no1,0 F6677-1492,CCc1nccn1CC(C1)CN1c1nc(cncc2)c2s1,2 Z1070060722,NS(N(CC1)CCC1C(N(CCC1)CCC1c1ccccc1)=O)(=O)=O,2 F6507-5274,CC(CNC(C1(CC(C2)C3)CC3CC2C1)=O)(COC)OC,0 Z447628280,CC(C)N(CC1)CCC1NC(N(CC1)CC=C1c(cc1)ccc1O)=O,0 Z3433778978,OCCC(Cc1c(C2)cccc1)N2C(NCc1cnccc1)=O,0 Z3513281959,CN(Cc1nnc(N2CCOCC2)o1)C1CCOCC1,2 F6495-2657,O=C(c1ncnc(N2CCOCC2)c1)NCc1nc(cccc2)c2[nH]1,2 S615-0820,O=S(c1c[nH]cn1)(N(CC1)CC1c1nc(CCOCC2CCCC2)no1)=O,2 F6178-4635,Cc(cc1)nnc1N1CCC(CNC(C2(CC(C3)C4)CC4CC3C2)=O)CC1,2 Z2440035146,NCC(CCC1)CN1C(c1c(C(F)(F)F)n(-c(cccc2)c2F)nc1)=O,0 F6210-0196,O=C(C1c(cccc2)c2Oc2c1cccc2)NC(C1)CNC1=O,2 F6660-5310,CCCC(NCc1cn(CCc2ccccc2)nn1)=O,0 S727-1026,O=C(CCc1c[nH]c2c1cccc2)N(C1)CC1n1nnc(COCC2CC2)c1,2 F6476-2922,Cc1noc(C)c1CCC(N(CC1)CC1Oc1nccc(C(F)(F)F)c1)=O,2 Z4900394454,CN(Cc1cc(OCC(O)=O)ccc1)C(c1csc(CCN)n1)=O,0 L332-0237,O=C(NCCC(CC1)CCN1C(NC1CCCCC1)=O)NC1CCCC1,2 F6238-0135,O=C(c(cc1)nnc1-n1cncc1)NCc(cc1)ccc1Cl,2 F3407-0148,Cc1noc(-c(cnc2nc(C)ccc22)c2Nc2cc(F)c(C)cc2)n1,0 Z1250713355,OC1(CNC(c2cnns2)=O)CCCCC1,0 F2205-0164,CC(C)(Cc1ccc2)Oc1c2OCC(Nc1cccc(Cl)c1C)=O,0 Z2851923658,Cc1csc2nc(C)nc(N(C3)Cc4c3c(O)nc(C)n4)c12,0 F6190-0257,Cc(cc(cc1)F)c1S(NCCC(C1CC1)O)(=O)=O,0 Z335641732,N#Cc1cccc(OCC(N(CC2)CCC2N(c(cccc2)c2N2)C2=O)=O)c1,0 SC12-0059,O=C(CC1CCCCC1)N(CCCN(CC1)Cc2c1cccc2)C1CCOCC1,2 Z2225177984,CCC(CO)(CCC1)N1C(c1c(C2CC2)ocn1)=O,2 SC11-1186,CC(C)C(N(CCCN1CCCC1)C1CN(Cc2ccc(C)o2)CCC1)=O,2 Y040-8147,O=C(C(CCCC1)=C1c1c2)Oc1cc(OCc(ccc(F)c1)c1F)c2Cl,0 F6571-0181,CN(C)C(CNC(c(cc(cc1)OC)c1Br)=O)c1csc2c1cccc2,0 F6562-1792,O=C(C1Oc(cccc2)c2OC1)NCc1cc(N(CCC2)C2=O)cnc1,2 F2562-0473,COc(cc1)ccc1C(CSc(cc1)nn2c1nc(-c1ccccc1)c2)=O,2 F2024-1716,O=C(NCCn(cc1)c2c1cccc2)NC(CC1=O)CN1c1cccc(F)c1,0 F6411-2767,Cc1noc(C)c1CSc(c1c2)nccn1nc2-c1ccccc1,2 F0836-0057,O=C(Nc1cccc(Cl)c1)N(CC(C1)CN23)CC1C3=CC=CC2=O,0 Z3809773742,[O-][N+](c(cccc1)c1S(N1C(c2ccccc2)=NCC1)(=O)=O)=O,0 F6244-1485,O=C(NCCc1ccccc1)NCC#CCN1CCCC1,2 F6440-4156,Cn1nc(CNC(NCCOC)=O)cc1C1CC1,0 Z1361014347,O=C(c(cc1)ccc1S(C(F)F)(=O)=O)N(CC1)CCC1c1nnc[nH]1,2 SC72-0591,Cn1cnc(S(N(C2)CC22OCc3c2cnc(-c2ccccc2)n3)(=O)=O)c1,2 Z3627490413,C[C@@H](c1ccncc1)ONC(C(CCC1)c2c1[nH]nc2)=O,2 Z2445744845,NC(CCC1)CN1C(c1c[nH]nc1-c1cccc(Cl)c1)=O,0 Z4081386001,CC(C)Oc(cc(cc1)C(N)=O)c1NC(c1cc(OCc2cn(cccc3)c3n2)ccc1)=O,0 F6676-9809,C(C(C1)CN1c1nc(C2CC2)ncc1)n1cncc1,2 F6764-1581,COCc1nsc(N(CC2)CCC2c2ccc(cc(cn3)Cl)c3n2)n1,2 Z1619964313,Cc1cccc(O)c1NC(c1cc(Oc2ccccc2)ccc1)=O,0 F6089-5208,O=C(CSC1CCCC1)Nc1cc(CN(CC2)C(c3ccco3)=O)c2cc1,2 SB46-0617,CCC(C)(C)NC([C@H](C[C@H]1CN(C2)C(NCc3ccccc3)=O)C[C@@H]1NC2=O)=O,0 S724-0719,O=C(C1CCCC1)N(C1)CC1n1nnc(C(N2CCOCC2)=O)c1,2 F2504-0147,O=C(c1cccc(Cl)c1)NCC(c1ccco1)N(CC1)CCN1c1ccccc1,0 Z3838677908,O=C(c1c(CC(N2)=O)c2ccc1)N(CC1)CCN1c1cc(F)cc(F)c1,0 Z3388126895,CC(C)c1nocc1C(NC(CC1)C(C)(C)CN1C(C)=O)=O,0 S039-3679,CN(CC1)CCN1C(N1)=NC(CCN(Cc(cc(cc2)F)c2F)CC2)=C2C1=O,0 Z1159295814,CC(SC1=NC(CN(C2CCCC2)c2ccccc2)=C2)=NN1C2=O,2 Z970575266,Cc1c(C)oc(-c2cccc(NC(c3cc4cccnc4cc3)=O)c2)n1,2 F6806-6307,CC(C)(C)C(NC(CC1)CCN1c(cc1)ccc1C#N)=O,0 F6416-8540,Cc1cc(C(CCNC(c(c(F)ccc2)c2Cl)=O)O)c(C)o1,0 SB14-1106,Cc1c(COC)c(C(N(CC2)CC2N(C2CCOCC2)C(C2CC2)=O)=O)no1,2 F6760-5775,Cc1cc(C(N(CC2)CCN2c2nsc3c2cccc3)=O)ncc1F,2 SB27-0010,Cc1noc(C)c1CC(N(CC1)CCC1N(C1)C2(COCC2)CNC1=O)=O,2 F6510-3697,Cc(c(NC(c(cccc1)c1F)=O)c1)cc(N2C)c1N(C)S2(=O)=O,0 Z4368681922,Cc(cc(cc1)NC(c2nn(C)c3c2cccc3)=O)c1NC(c1c(cc(CN)cc2)n2nc1)=O,2 Z1948761378,CC(N(C[C@@H](C1)O)[C@H]1C(Nc1cccc(-c2csc(C)n2)c1)=O)=O,2 D730-0158,Cc1c(COc2ccc(C(CC(N3)=O)C4=C3N=C(c3ccccc3)NC4=O)cc2)cccc1,2 2279-5346,COc(cc(c(cccc1)c1o1)c1c1)c1NC(CCN(C(c1c2cccc1)=O)C2=O)=O,2 Z1728496961,OC(c(cc1)cc(F)c1C(N(CC1)CCC1Oc(cc1)ccc1F)=O)=O,0 J039-0417,CC(c(n1C)nnc1SCC(c(cc1)ccc1Cl)=O)N1c(cccc2)c2OCC1=O,2 Z3055651684,CC(CCN(CC1)C(c2cocn2)=O)N1C(c1cocn1)=O,2 F6482-6113,O=C(c1cc(-n2nccc2)ccc1)NCc1cc(-c2ccncc2)ncc1,2 Z1209714330,CCc1nn(CC(CC2)NC(NCc(cc3)cnc3-n3cncc3)=O)c2n1,2 F6512-1268,O=C(Cc(cccc1)c1Cl)NC1Cc2ccnn2CC1,0 Y044-5044,c1(c2c([nH]n1)c1c(CC2)cc(cc1)OC)C(N1CC2\C=3\N(C(\C=C/C3)=O)CC(C1)C2)=O,2 S980-0168,C[C@H](CO)n1c(C2CCN(Cc3c[nH]nc3-c3ccccc3)CC2)ncc1C,2 Z1147503742,OC(c1cccc(S(NCC2CCOCC2)(=O)=O)c1)=O,0 Z2254414352,CN(CC1)CCN1c(cc1)ncc1NC(c1c(CCC2)n2nc1)=O,2 SC25-1026,O=C(C1c2nnc(-c3nccnc3)n2CCC1)NC1CCC1,2 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F6561-5448,CN(C=C(C(N(CC1)CCC1S(Cc1ccccc1)(=O)=O)=O)C(OC)=C1)C1=O,2 P809-0868,O=C(Cc(cccc1)c1Br)NC(CC1)CN1c1cc(-c(cc2)ccc2F)n[nH]1,0 SB21-0998,CC(C)CC(N(C1)[C@H](Cn2nnc(C(N(C)C)=O)c2)C[C@@H]1F)=O,0 M435-1444,CC(CC1)Cc2c1c(C(O)=C(C(Nc(cc1)ccc1Br)=O)C(N1)=O)c1s2,0 Z2063870103,CC(C)c([nH]cc1)c1C(NCC1OCCC1)=O,0 S421-0001,O=C(CC(CC1)CN1C(C1CCCCC1)=O)NCc1ccccc1,2 S713-0022,Cn1c(-c2noc(C(CC3)CCN3C(NC3CCCC3)=O)n2)ccc1,2 Z1309306386,CCC(C)(C)c(cc1)ccc1S(NCc1cc(NC(C)=O)ccc1)(=O)=O,0 Z2900815555,CCC1(CCCC1)c1nc(C(C)(C)S(C)(=O)=O)no1,2 F2758-0916,CSc(cccc1)c1C(NCC(c1c2cccc1)=NN(C1CCCC1)C2=O)=O,0 Z2975106020,CC(C)(C)NC(C(CCC1)N1c1nc(ccc(F)c2)c2n1C)=O,0 Z2440212440,Cc1nc(cc(cc2)C(NCCC3CNCC3)=O)c2n1-c1ccccc1,2 Z3009782143,OC(c1c(CCC(NC(C2)Cc3c2ccc(Cl)c3)=O)cccc1)=O,2 Z1680183432,OC(CC1)(CCC1NC(Cc1cccc(OCC(F)(F)F)c1)=O)c1ccccc1,0 SB52-0656,CN(CC(C1)(CC2)CCN2C(C2CCOCC2)=O)C1c1noc(C2CCC2)n1,2 Z4235705203,CC(c1ccc(CCNC(c2cc3nccnc3cc2)=O)cc1)=O,0 F6414-3885,CC(CNS(c(cccc1)c1Br)(=O)=O)(c1cc(cccc2)c2s1)O,0 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F6359-0411,O=C(C(C=C1)=CNC1=O)N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1,0 Z2643157633,CCNC(CCCC(NCc1ccc(CNC(C)=O)cc1)=O)=O,0 F5490-0032,O=C(Cc1ccccc1)N(CCC1)CC1c1nnc(Cc(cc2)ccc2F)o1,2 F6809-7518,NC(C1N(Cc2cccc(Br)c2)CCCC1)=O,0 J031-0172,CC(C)n1c(SCC(NCc(cc2)cc3c2OC(C)C3)=O)nnc1-c(cc1)cc2c1OCCCO2,2 E864-1073,COc(cc1)cc2c1[nH]c(C1c(cc3)ccc3F)c2CCN1C(Nc(cc(cc1)Cl)c1OC)=O,0 F6448-2317,CN(CC(Nc1cn(CC2Oc(cccc3)c3OC2)nc1)=O)S(C)(=O)=O,0 S824-3385,COC[C@@H](CN(C1)C(c2cc3cccnc3cc2)=O)[C@H]1c1ccncc1,2 F6524-1135,O=C(C1OCCC1)NCCN1N=Nc(ccc(F)c2)c2C1=O,2 Z1840240232,OCCS(c1ccc(CNC(CC2)C22CCCC2)cc1)(=O)=O,2 F5624-0014,O=C(c1ncccc1)NCCOc1ncnc(N2CCOCC2)c1,2 M148-8306,Cc(cc1)ccc1-c1cn(CC(N2c(cc(C)cc3)c3OCC2)=O)nc1N(C)C,2 Z2965226097,O=C(c1cnc2[nH]cnc2c1)N(CC1)C1C1CCCC1,2 V013-3500,COc1cccc(C(Nc(cc2)cnc2N(CC2)CCN2C(C2CCCC2)=O)=O)c1,0 F5626-0057,CCNc1cc(NCCNC(C(C)(C)C)=O)nc(C)n1,0 G366-0393,CCC(N(C(C1)C(NC2CCCCCC2)=O)c2c1cccc2)=O,2 F3407-2867,CC(C)NC(CN(C(C=C1)=O)N=C1S(c(cc1)ccc1Br)(=O)=O)=O,2 SB03-0156,CS(N(CCC1)CC1N(CCNC(c1cncnc1)=O)C1CCOCC1)(=O)=O,0 Z1518536981,CC1(COCC1)NC(c(cccn1)c1OC)=O,0 F6529-2408,O=C(C1COCC1)N(CC1)CCC1N(CC(N1c2ccccc2)=O)C1=O,2 Z775005472,Cc1c(C(CC2)CCN2C(c2c(N(C)C)nccc2)=O)c(cccc2)c2[nH]1,2 Z4910860928,OCc1cccc(OCc2cn(-c(cc3)cc(CN4C(CCC(N5)=O)C5=O)c3C4=O)nn2)c1,0 Z1084395198,CN(CCN(Cc1cccc(C(N)=O)c1)C1)c2c1cccc2,2 P657-0598,Cc(cc1)c(C)cc1NS(c1ccc(-c2nnc(C3CC3)o2)o1)(=O)=O,2 Z1680005914,CC(Cc(cc1)c(C2)cc1Br)N2C(C(C=C1)=CN(c2cn(C)nc2)C1=O)=O,0 F6178-4770,Cc(cc1)nnc1N1CCC(CNC(NCCCc2ccccc2)=O)CC1,2 T408-2101,COCCNC(C(CC1)Cc2c1sc(C(N1CCCCC1)=O)c2)=O,0 C301-1195,O=C(C1Oc(cccc2)c2OC1)Nc1cccc(NC(c2ccccc2)=O)c1,2 Z1091496474,COC(CCC1)CN1C(CCN(C(CC1)=O)C1=O)=O,2 F6454-0105,O=C(c(ccc(F)c1)c1Cl)NCC(CC1)CCN1c1cnccc1,0 7888-0689,Cc1ccc(cccc2NC(c(cc3)ccc3C3=Cc(cccc4)c4OC3=O)=O)c2n1,2 C734-0625,CC(c(ccc(NC(Cn1ncc2c1-c(cccc1)c1OC2)=O)c1)c1O1)=CC1=O,2 S613-0985,O=C(C1(CC1)c1ccccc1)N(CCC1)C1c1nc(CCOCC2CCCC2)no1,2 T151-0254,Cc1cnc(CCNC(C2CC=CC2)=O)n1C1CCC1,2 P244-0503,Cc1cccc(N(C(CC(NCCN2CCOCC2)=O)c2c3cccn2)C3=O)c1,2 Y042-2517,COc(cc1)cc2c1n(CC(NC(CC1)c(cc3OC)c1cc3OC)=O)cc2,0 E646-2702,CC(C)CCNC(C(C)(CN(C1)S(c2ccccc2)(=O)=O)N(CCCOC)C1=O)=O,0 SC46-0207,O=C(Nc(cccc1)c1F)N(C1)CC2(CCCC2)C1c1nc(C2CC2)n[nH]1,2 F6510-2068,CN(c(ccc(F)c1)c1N1CCNC(Cc2cccs2)=O)S1(=O)=O,2 Z1102310171,CC(C)(C(NCc1cc(-n2cncc2)ncc1)=O)c(cc1)ccc1F,0 Z189133092,O=C(C(CC1)CCN1C(c1c(C(F)(F)F)cccc1)=O)N1CCOCC1,0 SB95-0075,O=S(c1cc(F)cc(F)c1)(N(CCN1CCCCC1)C1CNCCC1)=O,2 F6739-7894,CN(Cc1c(CCCC2)c2nn1C)Cc(cc1)cc2c1OCCO2,2 Z1444742652,OC(CC1(CCOCC1)NC(c1ccncc1)=O)=O,2 Z2964720555,Cc1c(CC(NC2(COC2)c2ccccc2)=O)sc(C2CCC2)n1,2 M454-0990,Cc(cc1)c(C)cc1-c(cc1)nn2c1nnc2CCC(NCc1ccc(C(F)(F)F)cc1)=O,0 F6560-0877,O=C(c1cc(-n2nccc2)ccc1)NC(C1CCOCC1)c1cccs1,2 V020-4247,CC(C)CN(CC(CN(Cc1cccc(F)c1)C1)C1c1cc(C(F)(F)F)ccc1)C(c(cc1)ccc1F)=O,2 F6572-0908,Fc1cnc(N(CC2)CCN2c(cccc2)c2Cl)nc1,0 E864-0480,CSc1cccc(NC(N(CCc2c3[nH]c(cc4)c2cc4Cl)C3c(cc2)ccc2F)=O)c1,0 S897-0111,CCc(cccc1)c1S(N(CC1)CCC1Oc1nc(CC)nc2c1CCOCC2)(=O)=O,0 F6529-2442,CC(C(N(CC1)CCC1N(CC(N1c2ccccc2)=O)C1=O)=O)Oc(cccc1)c1F,2 S398-2439,CCC(C)NC(N(C1)Cc2c1c(C(NCc1cnccc1)=O)nn2C)=O,2 Z3297819340,Cc1c(C(C2)OCCN2C(c(cc2)cc(O)c2Cl)=O)cccc1,0 Z4945791120,CN(C)C(c1cc(-c2cc(C(N)=O)ccc2)ccc1)=O,0 F6672-1273,CCc1cc(N(C(CC2)C3)C2CC3n2ncc(Cl)c2)ncn1,0 Z3592215206,CC1(C(CC2)CCN2C(c2ccc(-c(cccc3)c3F)o2)=O)N=N1,2 SA40-0649,CC(C)NC(C1N(C)CC(C2)(CN2C(c2ncccc2C)=O)C1)=O,2 F6517-2230,CC(C)Sc1ccc(CC(NCC(c2ccc(-c3cccs3)s2)O)=O)cc1,0 F447-0593,CC(C)CC(C)N(CC1)CCN1c1cc(C(O)=O)c(cc(cc2)NS(c(cc3)cc(F)c3F)(=O)=O)c2n1,0 F828-0518,Cc(n(-c(cc1)ccc1F)nc1C)c1S(N1CCC(Cc2ccccc2)CC1)(=O)=O,2 F6516-0734,O=C(CCc(cccc1)c1Br)NCc1ccc(-c2ccco2)o1,2 Z2212352517,CC(C)NS(Cc1c(CNc2nc(ccc(F)c3)c3n2C)cccc1)(=O)=O,0 F2548-0071,O=C(c1c(C(F)(F)F)cccc1)N(CC1)CCC1(C1)Oc(cccc2)c2C1=O,0 F6573-6994,O=C(c1cc(Br)cs1)N(CCN1c2ncccc2)CC1=O,2 K788-5680,Cc(cc1)c(C)cc1NC(N(CCCN(C)C1CCCCC1)Cc1cccn1Cc(cc1)ccc1Cl)=O,2 Z1032472874,CC(C)(C)c(nc1)ncc1NC(NCc1ccnn1C)=O,0 Z2277962601,CC(C)(C1)C(c2cnccc2)N1S(CC(CCCC1)C1(F)F)(=O)=O,2 Z2099069262,CC(CC1)(CN1C(c(cn1)ncc1OCc1ccccc1)=O)c1cccc(C(F)(F)F)c1,2 SB69-0434,CCN(CC)CCN(CC)C(c1nn(C[C@H](C2)Oc3cnccc3)c2c1)=O,0 F6497-0622,Cn1nnc(C(N2CC(Cc3nc(C4CC4)no3)CCC2)=O)c1,2 D750-0072,OC(CCCC1)(CC2)C1CN2C(CC1(CCCCC1)N(Cc1c2cccc1)C2=O)=O,2 C753-0189,Cn1c(C(O)=O)c(CNCc2ccco2)c2c1cccc2,2 F5303-0157,Cc1nn(C)cc1S(Nc1ccc(C(F)(F)F)cc1)(=O)=O,0 E213-0632,Cc1c(C(Nc(cc2)cc3c2OCCO3)=O)sc(N=C2N3CCCC2)c1C3=O,2 F0239-0783,OC(c1cc(-c(cc2)ccc2OC(F)F)nc2ccccc12)=O,0 F2516-0126,COc1cccc(C(Nc(cc2)cc3c2scc3)=O)c1OC,0 F2442-0667,Cc1nc(OC)cc(N(CC2)CCN2C(Cc2c[nH]c3c2cccc3)=O)n1,0 Z2355830193,NC1C(CN(C2)C(C(Nc(cc3F)cc(F)c3N3CCCC3)=O)=O)C2CCC1,2 SC25-1099,Cc1nn(C)c(CNC(C2c3nnc(-c4nccnc4)n3CCC2)=O)c1,2 CM3701-2108,O=C(NC(CC1)CN1c1nncc(N2CCCC2)c1)Nc1cccc(C(F)(F)F)c1,0 S926-2615,COCCc1nc(COC(CCC2)CN2C(C2CC2)=O)no1,2 S616-1592,CCn1ncc(C(N(CC[C@H]2C3)C[C@@H]2N3S(C)(=O)=O)=O)c1C,2 Z2958368262,CC[C@H]1OCC[C@@H]1C(Nc(cc1)ccc1-c1nn(C)cn1)=O,2 F5822-0018,O=C(C(CC1=O)CN1c1cccc(Br)c1)N1CCC(Cn2cncc2)CC1,2 Z1177820433,CN(CCCC1)C1C(NCc1noc(-c2ccco2)n1)=O,2 SC19-0086,CCn1nc(CN(CC2)CC2NC(C2(CC2)c2ccccc2)=O)c2c1CCOC2,2 Z1531934968,Cc(c1c2)noc1ncc2S(N[C@H](C(O)=O)c1ccccc1)(=O)=O,2 Z1529162145,Oc(cc1)ccc1C(N(CC1)CCN1C(c1cc(OCC(F)F)ncc1)=O)=O,2 Z4054755290,CN(CCC1)C1c1n[nH]c(C(N(CC2CCN)c3c2cccc3)=O)c1,2 F6245-3157,O=C(Cn1nccc1)N(CC1)CCC1c1nnc(-c2ccco2)s1,2 F5074-0616,CC(C)n1nccc1-c1nnc(NC(c2nn(C)cc2C)=O)o1,2 Y043-5582,Cn1c(cccc2)c2nc1C(CCC1)N1C(COc1c(ccn2CCOC)c2ccc1)=O,2 Z1894578324,Cc1cc(NC(c2nc(C)nc(C)c2)=O)cc(OCCO)c1,0 F6734-2871,CC(C)(C)c(cc1)nnc1N1CC(CN(C2)C(c3c(CCCC4)c4no3)=O)C2C1,2 Z2597307829,C[C@H](CN(CC1)c2nc(-c3ccncc3)nc3ccccc23)[C@H]1C(O)=O,0 Z3410095697,O=C(c1cc2cccnc2cc1)Nc1cc(C(CCCC2)=O)c2cc1,2 Z4310357848,CC(C)(C1)C(C(NCc2cc(O)ccc2)=O)N1C(OCc1ccccc1)=O,2 F6502-5696,O=C(c1cccc(Br)c1)Nc1cn2nccc2nc1,0 Z2187138571,O=C(CCNC(C1CCCCC1)=O)N(CC1)CC1n1nccc1,2 Z2091967026,CS(N1[C@@H](CNc(nccc2)c2Br)CCC1)(=O)=O,0 Z1419942489,CC(C)CC(CC1)CCN1c(nccc1)c1C(NC)=O,0 Z242040962,CC(CCC1)CN1C(c(cccc1)c1N(C)S(C)(=O)=O)=O,0 F6723-7454,O=C1N(CC(CC2C3)CN3C(N=C3N4C=CC=C3)=CC4=O)C2=CC=C1,2 F6257-4546,CC(CC1)CCN1c1cc(NC(CSc2ccncc2)=O)ncn1,2 F5857-3559,COc(cc1)cc(C(NCC(C(F)(F)F)(c2ccccc2)O)=O)c1Br,0 Z1601798123,CC(C)(CN(CC1)C(C2CC2)=O)N1S(c1c(C)ccs1)(=O)=O,0 F6709-3626,O=C(c(ccc(F)c1)c1F)N(C1)CC1Oc1ccncc1,0 F6798-4732,CCn1c(ncnc2N3CC(CN(C4)C(CCc5c(C)onc5C)=O)C4C3)c2nc1,2 S694-0279,Cc1cnc(-c2ccccc2)n1C(CC1)CN1S(c(cc1)ccc1C#N)(=O)=O,2 Z1167446024,CCNC(N(CC1)CCN1C(c1cn(Cc(cc2)ccc2OC)nc1)=O)=O,0 F5871-3444,CC(C)(Cc1ccc2)Oc1c2OCC(Nc1cc(C)ns1)=O,2 Z1531979757,CC(C(O)=O)N(C)S(c(c(Cl)c1Cl)ccc1OC)(=O)=O,0 Z963649298,CCS(N(CC1)CCN1C(Cn1ncc(C)c1)=O)(=O)=O,0 V022-1983,CC(C)CCN(CC(COC)O)CC(N(CC1)C(COc(cc2)ccc2F)c2c1scc2)=O,0 8009-0459,OC(CCC(N(CCc1ccccc1)C(CC(N1c(cc2)ccc2Cl)=O)C1=O)=O)=O,0 Z1334125079,CC(c1n[nH]cn1)NC(CC1CC1)=O,2 F6245-5837,CN(C(C(F)(F)F)=NN1CCNC(c(cc2)ccc2S(N2CCCC2)(=O)=O)=O)C1=O,2 D724-0284,Cc(cc(n1nc2)N3CCN(Cc(cc(cc4)F)c4OC)CC3)nc1c2-c1ccccc1,0 SD06-0906,CC(C)CCNC([C@@H](C[C@H](COc1ccccc1)C1)[C@H]1NC(C1CC1)=O)=O,0 F6619-8110,Cc1cc(CN(CC2)CCN2c2ncnc(OC)c2)no1,0 E646-2701,CC(C)CCNC(C(C)(CN(C1)S(c2ccccc2)(=O)=O)N(CCC2=CCCCC2)C1=O)=O,0 S064-0548,CCCOc1nccnc1N(CC1)CC1N(C)C(c1nccnc1)=O,0 Z3041152995,CC(c(cc1)ncc1Br)NC(N(CC1)CCC1(N1)OCC1=O)=O,0 S986-0156,CN(C)C[C@](CN(Cc1ccccc1)C1)(C2)[C@H]1CN2C(c1ccco1)=O,0 S591-1394,CCN(C(C1)CN1C(c1nc2ccccc2cc1)=O)C1CCOCC1,2 F5604-0027,O=C(C1CCCCC1)Nc1ccc(CN(CC2)CCN2c2ncccc2)cc1,2 F5882-2145,Cc1noc(CNC(C(CC2)CCN2C(CC(c2ccccc2)c2ccccc2)=O)=O)n1,2 F6211-0375,Cc1c(C)sc(NC(c2nn(CCCO3)c3c2)=O)n1,2 F2536-1623,O=C(CS(c1ccccc1)(=O)=O)NCc1ccccc1,0 F454-0071,CC(C)(C1)CC(N(c(cc2)cc3c2OCCO3)C(C(C#N)=C2)=O)=C2C1=O,0 8012-5502,CCOc(cc(CCNC1C2CCCCC2)c1c1)c1OCC,2 S592-0918,COCc1nc(C(CC2)CN2S(c2cccc3nsnc23)(=O)=O)no1,2 K786-4941,CC(CCC1)C(C)C1NC(C(C)(CC1)N(CCc(cc2)cc(OC)c2OC)C1=O)=O,0 Z1709963271,O=C(c1ccnn1C1CCCC1)N1CCOC2(CCOCC2)CC1,2 Z1838747761,CCn1nc(C)c(S(Nc(ccc(C)n2)c2O)(=O)=O)c1C,0 Z3687050073,O[C@@H](CC(Cn1ncc(Cl)c1)C1)[C@H]1NC(COCc1cnccc1)=O,2 SB73-0405,CC(C)C(N(CC1)C[C@]1(C[C@@H](C(NCc1nc(cccc2)c2[nH]1)=O)N1)C1=O)=O,2 SB01-1144,CCn1nc(COc2nccnc2)c(C2)c1CCN2C(c1nccc2ccccc12)=O,2 F6709-0390,CCc(cn1)cnc1OC1CCN(CCn2nccc2)CC1,2 Z4999882102,O=C(c1cc(C(N(C2)C(CCC(N3)=O)C3=O)=O)c2cc1)Nc(cc1)ccc1OC1CCNCC1,2 F0590-0320,CCOC(N(CC1)CCN1C(CS(c1cn(Cc2c(C)cccc2)c2c1cccc2)(=O)=O)=O)=O,2 F6680-3343,COc1nccc(N(CCN(C2)c(ncc(C#N)c3)c3Cl)C2=O)c1,0 Z1412163468,Cc1coc(-c2cccc(NC(c3ccnn3C)=O)c2)n1,0 F5495-0106,CC(C)NC(N(CCC1)CC1c1nnc(Cc2ccccc2)s1)=O,0 F6807-7238,COc(cccc1)c1N(CC1)CCN1c(cc1)ncc1Br,0 Z2959484444,C[C@@H](CO)N(C)C(C1=Cc(ccc(C(F)(F)F)c2)c2NC1=O)=O,0 V027-2653,O=C(c1ccc(CSc2nc(N3CCCC3)cc(C(F)(F)F)n2)cc1)NCc1ccncc1,2 M445-0134,N#Cc(cc(cc1)NC(CCN(C2=O)C(N3CCCC3)=Nc3c2scc3)=O)c1F,2 G938-1257,CC1Oc2cc(S(N(C)CC(Nc(ccc(Br)c3)c3F)=O)(=O)=O)c(C)cc2NC1=O,0 8017-2697,O=C(C(C(F)(F)F)(c(cc1)ccc1F)NC1=O)N1c1cnccc1,0 S614-0774,CCN(CC)C(N(CCCC1)C1c1nc(CCOCC2CC2)no1)=O,0 F6469-1703,Cc(n(-c1ccccc1)nc1)c1C(Nc(cccc1)c1-c1cn(cccc2)c2n1)=O,2 L077-0264,O=C(c1nnc(C(CC2)CCN2C(Nc(cccc2)c2F)=O)s1)Nc(cc1)ccc1F,0 F6813-8133,CC(C)c1c(CN2CC(C)N(Cc(ccnc3)c3F)CC2)nco1,2 Z1129787510,CC(C)n(c(C)c1)c(C)c1C(NCC(CC1)CCN1C(C)=O)=O,2 Y503-1247,CC(c(ccc(NC(CN(CC1)CCN1S(c1cn(C)nc1)(=O)=O)=O)c1)c1O1)=CC1=O,2 F6458-0059,O=C(Nc(c(F)ccc1)c1F)N(CC1)CCN1c(cc1)nnc1-n1ncnc1,2 F6573-5097,COc(cc1)cc(S(NCc2cncc(C3CC3)c2)(=O)=O)c1OC,0 8013-4418,CC(C)(CCC1)OC1(C)C#CCN(CCC1)CC1c1cnccc1,2 J500-0589,CN(C)S(N(C1)CC2(CCCC2)C1C(N1CCN(C)CC1)=O)(=O)=O,0 Z1692023069,CCc1nn(C)cc1NC(NCc1c[nH]nc1C)=O,0 Z1421564102,CC(C)N(CC1)CCC1(CNC(c1cccc(NC(c(cc2)cc3c2[nH]cn3)=O)c1)=O)O,2 G827-0009,Cc1c(CCC(NC2CCCC2)=O)c(C)nn1-c(cc1)nn2c1nnc2,2 Z1343760474,O=C(CCN1CCc2ccccc2)NC1=O,0 F6514-7054,CC(C)C(Cn1nccn1)NC(C1(CCOCC1)c1ccccc1)=O,2 F6681-3476,COc(cccc1)c1NC(N1CC(COc2cnccc2)C1)=O,0 F6559-1636,Cc1c(C(N2CCN(CCF)CC2)=O)snn1,0 F6525-7257,Cc(n(CCNC(c1cc(cccc2)c2s1)=O)nc1C)c1-c1ccco1,2 C760-0403,CC(CCC1)C(C)C1NC(c1csc2c1CCCC2)=O,0 Z2964141276,Cn1c(C(N(CC2)CCC2c(cc2)ccc2S(N)(=O)=O)=O)ccc1,0 C177-0063,Cc(cc1)ccc1Nc1c(-c(cc2)ccc2N2CCOCC2)nc2n1cccc2C,0 SA49-1045,O=C(CC1COC(C2)(CN2C(c2cc3cccnc3cc2)=O)C1)NCC1CC1,2 F5033-8016,O=C(Cc1cccc2ccccc12)NCC(CC1)CCN1C(c(cccc1)c1F)=O,2 F6510-3363,CN(c(cc(c(F)c1)NC(c(cccn2)c2SC)=O)c1N1C)S1(=O)=O,0 F6560-6364,O=C(c(cc1)cc2c1OCO2)Nc(cc1)cnc1-c1ccncc1,2 Z1869637458,Cc(cc1)cc(Br)c1C(N(CCC(O)=O)CC1CC1)=O,0 F6709-0325,CCc(cn1)cnc1OC(CC1)CCN1c1nccc(C(F)(F)F)n1,0 J025-0883,COc1cc(OC)c(C(C2)c(scc3-c(cc4)ccc4Cl)c3NC2=O)cc1,0 F5823-0869,Cc1cc(C)nn1CC1CCN(Cc2ccc(C(OC)=O)o2)CC1,2 F6807-6361,NC(C1CCN(Cc2cc3ccccc3cc2)CC1)=O,0 F5658-0161,O=C(COc1cc(C(CC2)=O)c2cc1)N(CC1)CCN1C(c1ccco1)=O,2 G340-0735,CN(Cc1ccco1)C(C(CCC1)CN1c1nc2cccnc2s1)=O,2 Z1757756591,CC1(C)Oc2c(CN(C[C@@H](C3)O)[C@H]3c3nnc(C)o3)cccc2C1,0 Z1866956573,C[C@H](c1cc(O)ccc1)NC(c1cn(Cc(cc2)ccc2OC)nc1)=O,0 F6448-0882,O=C(NCCc1ccccc1)Nc1cn(C2COCC2)nc1,2 F0308-0032,COc(cc1)cc2c1oc(-c1ccccc1)c2C(N)=O,0 F830-0521,O=C1N(Cc2nc(-c(cc3)ccc3Br)no2)C=Nc2c1nnn2-c(cc1)ccc1F,0 Z646113546,CN(C1=O)N=CC(N2CCC(Cc3cc(F)ccc3)CC2)=C1Cl,2 F5264-0412,COc(cccc1)c1N1CCN(CCNC(COc(ccc(Cl)c2)c2Cl)=O)CC1,0 SC23-0476,CS(N(CCc1noc(C2CCC2)n1)C(C1)CN1C(COc1ccccc1)=O)(=O)=O,2 S699-0520,CN(CCc1noc(C(C2)CN2C(Nc(cc2)cc3c2OCCO3)=O)n1)C(C1CC1)=O,2 E470-0176,Cc(cc1)ccc1C(C(C1=O)=O)=C1NCCCOC,0 Z3393504867,CCc(c(C)nc1ncnn11)c1N1Cc2cc(N)nn2CCC1,2 Z2790349011,C[C@H](c1c(C)cccc1)N(C)S(c1csc(C(O)=O)c1)(=O)=O,0 F6796-7750,CCn1c(ncnc2N(CC3)CCN3c3nc(CCOC4)c4cc3C#N)c2nc1,2 SA01-0696,CC(C)NC(c1c(C(CC2)CN2C(c2cocc2)=O)nc(N(C)C)nc1)=O,0 F6680-8784,Cc1nccc(OCC(CCC2)CN2C(c(ccc(Br)c2)c2F)=O)c1,0 F5607-0187,O=C(Cc(cc1)ccc1F)Nc(cc1)ccc1Nc1ncnc(-n2cncc2)c1,2 F6516-0824,O=S(c1cc(CCCC2)c2cc1)(NCc1ccc(-c2ccco2)o1)=O,2 F6811-1945,CCN(C(C=C1)=O)N=C1N(CC1)CCN1c1nc(cccc2)c2n1C,2 F0862-0136,O=C(c(cccc1)c1C1=O)N1c1ncc(Cc(cc2)ccc2Br)s1,2 F3394-0869,Cc1cc(S(Nc(cc2)ccc2C(Nc(cccc2)c2F)=O)(=O)=O)c(C)cc1,2 Z1943843940,NS(c1ccc(CCC(Nc2n[nH]c(C3COCCC3)c2)=O)cc1)(=O)=O,2 F2508-0682,O=C(c(cccc1)c1Cl)Nc(cc1)ccc1-c1nn2c(-c3ncccc3)nnc2cc1,2 F0916-2744,Cc(ccc(-c1nc(nccc2)c2o1)c1)c1NC(c(cc1)ccc1F)=O,0 Z1461931526,CN(CCC1)CCN1c1nnc(C(F)F)s1,2 SA46-0256,O=C(COc1ccccc1)N(C1)CC1(C1)OCC1N1CCOCC1,0 J007-1026,Cc1noc(C)c1C(CCC1)N1C(Nc(ccc(F)c1)c1F)=O,0 F3244-0176,O=C(CSc1nnc(-c2ccccc2)o1)c1ccc(-c(cc(cc2)Cl)c2Cl)o1,2 Z749885966,O=C(c(cc1)cc2c1[nH]c1c2CCCCC1)NC1CCN(Cc2ccncc2)CC1,2 Z3839700372,C[C@H](C[C@@H](C1)C(NC2(CCCC2)c(cc2)ccc2Cl)=O)NC1=O,0 F6482-3931,Cc(onc1)c1C(N(CC1)CCC1n1nccn1)=O,2 F5251-0188,Cc(cc1)ccc1-n1nnnc1CN(CC1)CCN1S(Cc1ccccc1)(=O)=O,2 F6472-8535,CN(C=CC=C1C(N(C2)CC2N(CC2)CCC2OC)=O)C1=O,2 J006-0926,Cc1noc(C)c1C1N(Cc2c[nH]nc2-c2cc(C)c(C)cc2)CCC1,0 Z230794378,CC(c1c(C2(CCCC2)C2)cc3OCCOc3c1)N2C(C(c1c2cccc1)=NNC2=O)=O,2 Z3847061916,CC(C)C(c(cccc1)c1F)NCC(c(cc1)ccc1F)O,0 F2269-0515,Cc(cc1)cc(N2C)c1Oc(ccc(NC(Cc1cccs1)=O)c1)c1C2=O,2 Z1451968788,CC(C(N1)=O)(c2cc(C(N(CCC3)CC3c3nc(cc(C)cc4)c4[nH]3)=O)ccc2)NC1=O,2 F5225-0229,O=C(CSc(cc1)nnc1NC(c(cccc1)c1F)=O)N(CC1)c2c1cccc2,2 F3324-0169,CC(N(C(C1)c2cn(-c3ccccc3)nc2C)N=C1c1cccs1)=O,2 F6709-4578,Cc1nccc(OC(C2)CN2C(CN(C(CC2)=O)C2=O)=O)c1,2 V012-3646,CC(CCC1)CN1S(c(cc1)cc2c1n(C1CCCC1)c(SCc1cc(OC)cc(OC)c1)n2)(=O)=O,0 F5806-0605,Cc1c(CCC(N(CC2)CCN2S(C)(=O)=O)=O)c(C)nn1C,2 Z1203866449,Cc1noc(C2CN(CCc3nc(-c4ccccc4)no3)CCC2)n1,2 Z3647778560,Cc1nnc([C@H](CCC2)N2C(C2C3(CC3)C22CC2)=O)o1,2 F6514-2781,O=C(C1c(cccc2)c2Oc2c1cccc2)N(C1)CC1OCC(F)(F)F,0 Z1478844551,Cc1nnc(-c2cccc(NC(C(C=C3)=NN(c4ccccc4)C3=O)=O)c2)n1C,0 K786-2236,CC(Nc(cc(cc1)C(NCCC2=CCCCC2)=O)c1Sc1ccc(C)cc1)=O,2 F6739-7857,CN(Cc1nc(CCC2)c2s1)Cc(cc1)cc2c1OCCO2,2 S823-5682,COCC(N[C@@H]1[C@@H](CO)CN(Cc2cccc(Cl)c2F)C1)=O,0 F6661-9101,COc1cccc(CN(CC2)Cc3c2scc3)c1,0 F6573-4652,O=C(c1cscc1)NCc1cncc(C2CC2)c1,2 F2211-0101,COc(cc1)ccc1C(Oc(cc1)c2cc1NC(c1ncccc1)=O)=CC2=O,2 Z3173937064,CN(CCn1cncc1)C(C(C1)N(c2ccccc2)N=C1C(O)=O)=O,2 V030-7750,CC(C)CC(N(CC1)C(c2ccc(C)cc2)c2c1ccc(OCc1ccc(C(NC(C)C)=O)o1)c2)=O,0 SB59-0507,Cn1c(C(C2)C(C3)(CN3C(c(cc3)cnc3OC)=O)CN2C(COC)=O)nnc1,0 Y500-7399,Cn1ncc(-c2cc(C(F)(F)F)c(c(C3CC3)nn3-c4ccccc4)c3n2)c1,0 F6480-5367,CN(C)S(c(cc1)ccc1C(N(CCC1)CC1Oc1ncncc1)=O)(=O)=O,0 S974-0533,CC(C)C[C@@H](C(N(C[C@H](C1)N(C)C)[C@@H]1C1)=O)N1C(NCc1ccccc1)=O,0 F0694-0024,O=C(c(ccc(F)c1)c1F)Nc(cc1)ccc1-c1nc2cccnc2s1,2 T501-0243,CCn1c(CC(CCC2)CN2C(NCCc2ccccc2)=O)nnc1,2 F6745-0449,Fc(cc1F)cc2c1nc(N(CC1)CCN1c1nsnc1)s2,2 Z2949141846,CN(C[C@@H](CO)O)[C@H](CC1)CC[C@@H]1O,0 Z1984068145,Cn1ncc(CC2)c1CC2C(NCc(cccn1)c1Oc1cc(OC)ccc1)=O,2 Y041-7827,N1(C(N[C@H](C1=O)CCC(N1CCC(CC(=O)OC)CC1)=O)=O)CCc1ccccc1,2 S352-0053,O=C(c1c(COC(C2)c3ccccc3)n2nn1)N(CC1)CCN1C(c1nc2ccccc2cc1)=O,2 F0266-1446,O=C(c1ccccc1)N1CCN(CCN(CC2)CCN2C(c2ccccc2)=O)CC1,2 F1967-0165,Cn(c(C(O)=O)c1)nc1-c(ccc(Cl)c1)c1Cl,0 Z15891690,CCc1nc(cccc2)c2n1CC(NC)=O,0 Z1951831918,Cc(ccnc1)c1NC(Cc(cc1)cc2c1[nH]nc2)=O,2 F5689-1388,CN(C(c1cccs1)=NN1CCNC(c(cccc2)c2SC(F)F)=O)C1=O,0 F1639-0214,CCOc(cc1)c(C)c(C)c1S(NCc1ncccc1)(=O)=O,0 Z106947756,N#CCCCCN(C(c1c2cccc1)=O)C2=O,0 L851-0353,Cc1noc(-c2nn(C)c(CC3)c2CN3C(C2CCCCC2)=O)n1,2 S594-0761,O=C(NCc(cc1)ccc1F)N(CC1)CCC1c1noc(COCC2CC2)n1,2 F6031-0153,OC(CN(CC1)CCN1C(CSCc1ccccc1)=O)c1cccs1,2 Z372958622,O=C(C1CC1)NCc1nc(-c2cnccc2)no1,0 F5127-0176,CCn(cc1)nc1C(Nc(cc1)cc2c1sc(C)n2)=O,2 Z1642413495,Cn(cc1CNc2c(ccs3)c3ncn2)nc1-c1ccccc1,2 Z3464484384,C[C@H](C(N[C@H](CO)[C@@H](c(cc1)ccc1[N+]([O-])=O)O)=O)O,0 Z3290576461,CCc(cc1)ccc1NC(N(CCc1c2[nH]cn1)C2c1cnccc1)=O,2 C237-2230,CC(C)CN(C=C(C(NC(C)c(cc1)cc2c1OCCO2)=O)c1c2n(C)c3c1cccc3)C2=O,2 F6561-6405,Cn1ncc(-c2c(CNC(C(Oc3c4cccc3)=CC4=O)=O)cccn2)c1,2 SC11-0915,O=S(c1cc(F)cc(F)c1)(N(CCCN1CCOCC1)C1CNCCC1)=O,0 SA45-0106,Cc1cc(C(N(CC2)CCC22C(C(N)=O)N(C)CCC2)=O)nn1C,2 Z1636529110,CCc1ncnc(N2CCC(CC(N(C)C)=O)CC2)c1F,0 SB94-0800,O=C(C(C1)CN(CC(CC2)CCN2S(c2cnccc2)(=O)=O)C1=O)NCC1CC1,2 F6573-9354,COc(ccc(Cl)c1)c1C(NCc1nccnc1-c1ccncc1)=O,0 SB04-0314,CN(CCN(C(CC1)CN1C(C1CC1)=O)C1CCOCC1)C(CN1CCOCC1)=O,2 Z2004916758,CC(CN(C1)C(c2csc(-c(cc3)cc4c3OCO4)n2)=O)N(C)C1=O,0 F5110-0201,O=C(c(c(F)ccc1)c1F)NCCS(N(CC1)CCN1c1ncccn1)(=O)=O,0 S976-0039,O=C(C(CCC1)(CN1C1CCN(Cc2ccccc2)CC1)F)N1CCCC1,2 Z2643636307,CC(C)Cc1nc(C(NC(Cc(cccc2)c2N2C)C2=O)=O)cs1,2 F6443-9799,O=C(CN1N=CC=CC1=O)NC(CC1)CN1c1ncc(C(F)(F)F)cc1,2 Z1665895068,CC(C)c1nnc(CNc(cc2)ncc2S(N2CCCCC2)(=O)=O)n1C,2 Z1289691173,CCc1c(C)cc(-c2nnc(CN(CCC3)CC3C(NCC(F)(F)F)=O)o2)s1,2 F6440-3888,Cn1nc(CNC(C2=CC=CN(C)C2=O)=O)cc1C1CC1,2 S985-0274,CC(C)C(N(C[C@@H]1CN(Cc2ccccc2)C2)C[C@]12C(N1CCCC1)=O)=O,0 Z1974310661,COc(cc1)cc2c1OCC(C(N[C@H](CC1)C[C@H]1C(O)=O)=O)=C2,2 Z1258593142,CC(CNC(C)c1cccc(S(N)(=O)=O)c1)CO,0 D627-0045,CCN(CCc1ccncc1)C(c1nn(C(CC2)CS2(=O)=O)c(-c2cccs2)c1)=O,2 Z2963107638,OC1CC(CC2)(CCN2C(c2cc(scc3)c3c(O)c2)=O)OCC1,2 F6764-0740,O=C(c1ncccc1F)N(CC1)Cc2c1nc1ncc(Br)cc1c2,2 F3386-4028,COc(c(S(N(CCC1)c2c1cccc2)(=O)=O)c1)cc(Cl)c1OC,0 SB75-0916,CCC(CC)C(N(C[C@@H]1C[C@H](C2)NS(CC)(=O)=O)C[C@@]12c1nc(C)no1)=O,0 Z3839487922,CCc1nnc(CC2)n1CC2NC(C1C2CCC1CC2)=O,2 F6678-8497,Cc1nc(cccc2)c2n1C(C1)CN1C(c1cnc(C(F)(F)F)cc1)=O,0 F6506-0729,COc(ccc(C(NCC(c1cscc1)(c1ccco1)O)=O)c1)c1F,0 F6619-7514,COc1ccc(CCN(CC2)CCN2c(cc2)nnc2N2CCOCC2)cc1,2 S904-1394,CC(C)C(N1Cc2nnc([C@H](C3)N(Cc4c(C)n(C)nc4)C[C@H]3O)n2CC1)=O,0 F5097-2636,O=C(Cc(cc1)ccc1NC(Nc(cccc1)c1Cl)=O)NCC(F)(F)F,0 Z2066515732,O=C(COC(F)F)N(CCC1)CC1c1nnc2n1CCCCC2,0 Z3016332985,Fc1ncnc(NC2Cc3ccnn3CC2)c1,2 F2740-0049,O=C(Nc1c[nH]c2c1cccc2)N(CC1)CCN1c(cccc1)c1F,0 F6436-2753,O=C(c(cccc1)c1F)N1CCC(CNC(N(CCN2)C2=O)=O)CC1,2 Z1508929115,OC(c1noc(-c(cccc2)c2O)c1)=O,0 Z1781463254,Cc1cc(CCC2NC(NC(c3nnc[nH]3)c3cccc(C(F)(F)F)c3)=O)c2cc1,2 F3411-1551,CSC1=NC(CC2)(CCN2C(NCc2ccccc2)=O)N=C1c(cc1)ccc1Cl,2 F2189-0117,O=C(CC(CC(NCc1ccccc1)=O)c(cc1)ccc1Br)NCc1ccccc1,2 Z284743736,O=C(Cn1nnc2c1cccc2)N(Cc1ccccc1)C1CC1,2 S868-0176,CN(C1CCN(C)CC1)C(c1ccc2n1CCCN(Cc1ccccc1)C2)=O,2 Z1445477681,CC(C)(CNC(C1=Cc(cccc2)c2OC1)=O)C(O)=O,0 P237-0359,CCN(CCC1)c2c1cc(C(NC1CC1)=O)s2,2 F6442-1544,O=S(CCOc1ccccc1)(N(C1)CC1S(C1CCCCC1)(=O)=O)=O,2 SB70-0966,COCCNC(c1nn(C[C@H](C2)NC(NCc(cc3)ccc3F)=O)c2c1)=O,2 F6481-4267,Cc1c(C(N(CC2)CCSC2c2cccs2)=O)n(cccc2)c2n1,2 Z646287054,CN(CC1CC1)c1nc2ccccc2c(C(N)=O)c1,0 F6245-0043,CC1=C(C)N=CN(CC(N(CC2)CCC2c2nnc(-c(cc3)ccc3F)o2)=O)C1=O,2 SC54-0135,Cc1nnc([C@@](CN(C2)C3CCCC3)(CC3)[C@@H]2CN3C(C2CCCCC2)=O)o1,2 F383-0145,Cc(ccc(CN(C(C1C2CCCC1)=O)C2=O)c1)c1S(NC(CCC1)c2c1cccc2)(=O)=O,2 8018-0859,COc(cc1)ccc1-c1n[nH]c(OC(C2)=O)c1C2c(cc1)cc(OC)c1OC,0 SA96-1163,CNC(C1C(C2)(CN2C(c2cnncc2)=O)CN(Cc2ccccc2)C1)=O,0 Y203-3427,CC(C1)OC(C)CN1S(c1cn(C)nc1C)(=O)=O,2 Z2965659491,Cn1cnc(CNC(C2C3(CC3)C2)=O)c1,2 Z2779245567,O=C(c1cccc2ccccc12)N(CC1)CCC1NC(N1CCOCC1)=O,2 Z1412370065,CCOc(cccc1)c1C(N(CC1)CCN1C(NC(CC1)Cc2c1cn[nH]2)=O)=O,2 F6677-1159,CCc1nccn1CC(C1)CN1C(c1c(C)oc(C)c1)=O,2 F2774-0232,Cc(ccc(NC(CN(C(C=C1)=O)N=C1c1cccc(Br)c1)=O)c1)c1F,0 Z3092006337,CCN(Cc1nc(CCC(C)C2)c2s1)C(c(cccn1)c1OC)=O,0 SB56-1068,CC(C)n1ncc(CN(C[C@@H]2c3nc(-c4ccncc4)no3)C[C@@H]2c2cnccc2)c1,2 Z1729895459,O=C(Cn1c(cccc2)c2nc1C1CC1)NOC1CCOCC1,2 Z2956775398,CC(CN(CC1)c2ccncc2)N1C(Nc1cn(C2CCC2)nc1)=O,2 F6523-3154,Cn1c(cccc2)c2c(CC(NCCN(Cc(cc(cc2)F)c2OC2)C2=O)=O)c1,2 F6184-1079,CCOc(cc1)c(C)cc1S(NCCN(CC1)CCC1c1cccs1)(=O)=O,0 F514-0169,O=C(CCn1nnc2c1ccc(S(N1CCCCC1)(=O)=O)c2)NC1CCCCCC1,2 F5967-0259,COc(ccc(F)c1)c1S(Nc(cc1)cc2c1OCCC(CCCC1)N1C2=O)(=O)=O,2 Z199964414,CCc(cc1)ccc1OCC(Nc(cc1)ccc1SCc1cnccc1)=O,0 F1601-0173,COc(ccc(Cl)c1)c1NC(c1c(N)n(Cc2cc(C(F)(F)F)ccc2)nn1)=O,0 F3348-0587,Cc1nn2c(NCC3OCCC3)cc(C)nc2c1-c(cccc1)c1Cl,0 F6562-5473,O=C(c(cc1)ccc1N1CCOCC1)NCCN(C=CC=N1)C1=O,2 Z1576277317,COC(c1cc(CN(CC2)C(C(CC3)Cc4c3[nH]nc4)=O)c2cc1)=O,0 SA05-0924,Cc1nnc(C2C(N(C)C)=O)n1CCN2C(Cc(cc1)ccc1OC)=O,0 F6802-7315,COc(cccc1)c1NC(CN1CC(C(N2CCCC2)=O)OCC1)=O,2 F5015-0099,COc(ccc(-c(nc1cc2)cn1nc2OC)c1)c1NS(c(cccc1)c1F)(=O)=O,2 Z1132261512,CC(Nc1c(C)ccc(NC(N(CC2)CCN2c2nccc(OC)c2)=O)c1)=O,0 Z4924486050,CCC(CC1)CC(C=C2C(Nc3cc(CN(CC4)CCC4O)ccc3)=O)=C1NC2=O,2 F3406-1316,COc(ccc(CCNC(c1c2nccc(-c(cccc3)c3F)n2nc1)=O)c1)c1OC,2 Z2353150506,CNC(NC1CCN(Cc2cc(cccc3)c3[nH]2)CC1)=O,2 C390-0030,O=C(c1c(C2c3cccs3)c(-c(cc3)ccc3Br)n[nH]1)N2c(cc1)ccc1Cl,2 F6473-7914,CC(O1)=CC(OC(CC2)CN2S(c(cccc2)c2Cl)(=O)=O)=CC1=O,2 F6677-3763,Brc1cn(CC(C2)CN2c2ncnc(C3CCC3)c2)nc1,2 Z3513679601,NCc1ccc(cc(cc2)C(N(CCC3)CC3C(NC3CCCCC3)=O)=O)c2c1,2 Z2964966542,O=C(Cc1ccco1)N(CCCS(C1)(=O)=O)C1c1ccccc1,0 S715-0199,Cn1c(-c2noc(C3CN(Cc4nc(-c5cccs5)no4)CC3)n2)ccc1,2 Z3307796832,CC(c(cc(cc1)F)c1N1)=N[C@@H](CC(O)=O)C1=O,0 Z1415948653,OC(CC(CCC1)N1C(c(scc1)c1Cl)=O)=O,0 F6676-2575,CN(C(CC1)CCN1S(c(cc1)cc(OC)c1OC)(=O)=O)c1ncccc1,0 F6608-2600,COc1cc(CN(CC2)CCC2Oc2nccc(C(F)(F)F)n2)cc(OC)c1,0 E135-1249,Cc1cc(NC(C(N2C)=CC(c3ccc(C)cc3)=NS2(=O)=O)=O)nn1CC(NCc1ccco1)=O,2 Z3009804863,OC(c1cn([C@@H](CCCC2)[C@@H]2NC(C2CC3(CC3)C2)=O)nn1)=O,2 Z3063655872,O=C(Cn1c(CCNC23CCOCC3)c2nc1)N(CC1)CCC1C1CCC1,2 S613-0976,O=C(COc1ccccc1)N(CCC1)C1c1nc(CCOCC2CCCC2)no1,2 F6515-0869,CSc1cccc(C(NCc2cc(-c3cccs3)ncc2)=O)c1,0 F067-0657,CC(C)CN1C(SCC(c2c(C)[nH]c3c2cccc3)=O)=Nc(cc(cc2)C(NC(C)C)=O)c2C1=O,2 F6485-0387,COc(cc1)cc2c1oc(C(NC(CC1)CCC1Oc1ncccn1)=O)c2,2 Z2878787830,CC(C)C(c1noc(CC(CCN2)C2=O)n1)Oc(cc1)ccc1Br,2 Z3173792045,Cn1c2cccc(C(N3[C@H](CC(O)=O)CCC3)=O)c2cc1,0 F6656-3467,O=C(C1(CC1)c1ccccc1)N1CCC(COc2nnc(CCCC3)c3c2)CC1,2 Z1193286698,Fc1cc2nccc(N3CCCC3)c2cc1,0 F6519-3968,Cc1cc(C)nn1C(CNS(c(cccc1)c1OC(F)(F)F)(=O)=O)c1cccs1,0 F6400-1414,O=C(c1cc(cccc2)c2o1)N1C(CN2CCOCC2)CSCCC1,2 Z4924493099,Cc1c(CCNC(c2c(C)ccc(C(N)=O)c2)=O)nc(-c2ccccc2)o1,0 Z2187993486,O=C(c1cc(-c2ncccc2)no1)NC1C2(CCCC2)CCCC1,2 Z4789005556,CC(CNC(c1cccc2cc(O)ccc12)=O)(F)F,0 Z4135990636,CCOCc1cccc(S(Nc2cnc(C(F)(F)F)c(C)c2)(=O)=O)c1,0 F6438-1816,Cc1cc(CNC(Nc(cc2)cc(Cl)c2F)=O)nc(N(C)C)n1,0 P217-1576,COc(cc1)ccc1S(N1C[C@H](CN(C2)S(c3ccccc3)(=O)=O)O[C@@H]2C1)(=O)=O,2 F6658-3190,CN1C(N(CCC2)CCN2c(cc2)nn3c2nnc3)=Nc(cccc2)c2C1=O,2 Y205-5176,CC(C)n1c(SCc(ccc(F)c2)c2Cl)nnc1-c1csc2c1CCCC2,0 S981-0362,Cn(c(CC1)c2CN1C(COc1ccccc1)=O)nc2NC(C1CC1)=O,2 SB71-0467,Cn1c(C(N2Cc3cc(C(N(CC4)Cc5c4cccc5)=O)nn3CC2)=O)ccc1,2 F6516-0231,O=C(COCc1ccccc1)NCc1ccc(-c2cccs2)o1,2 F2518-0433,CC(Nc1nnc(-c(cc2)ccc2Br)o1)=O,0 Z2143316663,Cc1nc(CC(CC2)NC(Cc3cn(C)nc3)=O)c2n1CCO,2 S395-0056,O=C(c1nc2ccccc2cc1)N(CC1)CCC1(C(N1Cc(cc2)ccc2Cl)=O)NC1=O,0 F5868-0309,Cc(cc1)ccc1Nc1cc(C)nc(N(CC2)CCN2C(COc2ncccn2)=O)n1,2 F3208-0003,O=C(NCc1ccccc1)N(CC1)CCN1c1ccccc1,0 F6523-2776,Cn1c(-c2noc(CNC(c3ncccn3)=O)n2)ccc1,2 8019-8185,NC(COc1cccc(C(C2)c(sc(C(O)=O)c3-c4ccccc4)c3NC2=O)c1)=O,0 S564-0154,Cc1nnc(CC(CC2)CCN2C(Nc(cc2)cc3c2OCCO3)=O)[nH]1,2 F6169-0551,Cc1cc(C)nn1C(C=C1)=NN(CC(NCc(cc2)cc3c2OCO3)=O)C1=O,2 Z1247528496,COc1cccc(NC(N2CC(CN3CCCC3)CC2)=O)c1,0 Y042-2701,COc1cc(CCC2NC(CCCc3nnc(cc4)n3nc4OC)=O)c2cc1OC,2 Z4400903911,CN(CCC1)CCN1S(c1cc(NC(NC(CC2)CC2c(cc2)ccc2F)=O)ccc1)(=O)=O,0 F6539-2870,CN(C)C(N1CCC(CNS(c2cc(CCCC3)c3cc2)(=O)=O)CC1)=O,2 8008-3810,NC(Oc1c(C2c3cccs3)ccc(O)c1)=C2C#N,2 F6475-3798,O=C(c1cc(OC2CCOCC2)ncc1)N(CC1)CCN1c1cccc(C(F)(F)F)c1,2 F6605-0285,Cc1cc(C)nn1C(C=C1)=NN(CC(C2)CN2c(cc2)nn3c2ncc3)C1=O,2 F5066-0022,CCCCOc(cc1)ccc1C(Nc1cc(C)nn1C)=O,0 S069-3953,Cn1cnc(S(N(CC2)CC2c2noc(C3CC3)n2)(=O)=O)c1,2 Z5016139867,CC(C)C[C@@H](C(NC)=O)NC(c1c(C)ccc(S(N(C)c(cccc2)c2OC)(=O)=O)c1)=O,0 S976-1525,O=C(C1(CN(CC2CCCCC2)CCC1)F)NCc1ccncc1,2 Z2094378441,Cc1nccc(N(CC2)CCN2C2CN(Cc3ccccc3)CC2)n1,2 F6656-0917,Cn1nc(C(F)F)c(C(N2CCOCCC2)=O)c1,2 Z1208185088,CCc1noc(C(C)Nc(cc2)cc(CC3)c2NC3=O)n1,2 G547-0350,O=C(c1c(cc(cc2)Br)c2nc(-c2cnccc2)c1)NCC1OCCC1,0 F2618-0159,O=C(c(cccc1)c1NS(c1ccccc1)(=O)=O)N(CC1)CCN1c1nc(cccc2)c2s1,2 Z3386096850,CC(c(cc1)ccc1C(N1CC(c2ccccc2)OCCC1)=O)N,0 F6787-1323,Cc1ccnc(OCC(CCC2)(C3)C2CN3c(cc2)nn3c2nnc3C(F)(F)F)n1,2 F2440-0087,CC(C)c1cc(C(Nc2ncccc2C)=O)nn1-c1nc(cccc2)c2s1,2 Z1636544265,Cc1nc(N2CCCC2)c(CNc2nc(C)ccn2)cc1,2 Z1834172379,CCOC(C1)C(C)(C)C1(CNC(c(cc(cc1)-c2ncccc2)c1Cl)=O)O,2 F6753-2786,CC(c1ccccc1)N(CCC1)CC1C(N1CCOCC1)=O,0 F6521-8148,COC(CNC(C(NCCC1=CCCCC1)=O)=O)c(s1)ccc1Cl,2 Z1784502656,CC(C)(C)c1nn(C)c(C(N(C)CC2(CO)CC2)=O)c1,0 S629-2354,Cn1c(C(N2Cc(cc(CCC(N3CCCC3)=O)cc3)c3OCC2)=O)ccc1,2 Z3071571312,CC(C)c1nc(CCNS(CCCCC(C)=O)(=O)=O)cs1,0 G431-0277,Cc1nc2nc(-c3ccco3)nn2c(NCC2CCN(Cc(cccc3)c3Cl)CC2)c1,2 Z1689565173,CCc1nsc(N(CCC2)CC2S(C)(=O)=O)n1,0 Z3290588699,CC(C)(CNC(c(cc1)nc(C(F)(F)F)c1Br)=O)O,0 Z1738256437,C[C@@H](C(O)=O)NS(c(cc(C)cc1)c1Br)(=O)=O,0 Z2232090839,CCc1nocc1CN(C)C(c(cc1)cc(N2)c1N(C)C2=O)=O,0 F6252-0742,Cc1noc(C(C2=NN3CCOc4ccccc4)=CC=CN2C3=O)n1,2 8011-2369,O=C(CN(C(c1c2cccc1)=O)S2(=O)=O)c1cc(S(N2CCOCC2)(=O)=O)ccc1,2 F9995-0322,CC(N=C1N2CCCC1)=C(CCN(CC1)CCC1c1noc(cc3)c1cc3F)C2=O,2 C094-1696,CCC(C)(C(NC1CCCC1)=O)N(C(CNC(c1ccccc1)=O)=O)c1ccccc1,2 F6617-7930,CCOC(CN(c(c(C(N1C2CC2)=O)c2)cc(N3CCCCC3)c2F)C1=O)=O,2 F3329-0227,c1csc(-c2nn(cnc3c4cnn3-c3ccccc3)c4n2)c1,2 F2795-0754,Cc(c(NC(C(NCC=C)=O)=O)ccc1)c1Cl,0 Z2997284034,OC(C1CCCCCCC1)c1nc(-c2cc(Cl)cnc2)no1,2 SC12-0036,O=S(c1cccs1)(N(CCCN(CC1)Cc2c1cccc2)C1CCOCC1)=O,2 SA43-1067,CN(CC(C1)(CN1C(c(cc(cc1)Cl)c1F)=O)C1)C1c1nc(-c2ccncc2)no1,0 F6525-2576,CCC(C(NCCn(c(C)c1)nc1-c1cnccc1)=O)c1ccccc1,2 F6474-7042,O=C(c1cc(cccc2)c2o1)N(C1)CC1N(C(CN1)=O)C1=O,2 C259-1090,CCC(N(CCc1c2)c1cc(S(N(CCC1)CC1C(N(CC1)c3c1cccc3)=O)(=O)=O)c2Br)=O,0 F6671-3112,CC(C)(C)c1cn(C(CC2CC3)CC3N2c(ncc(C(F)(F)F)c2)c2Cl)nn1,0 F6556-5124,CCOc(ccc(C(N(CCC1)CCN1C1CCSCC1)=O)c1)c1OCC,0 F3398-4483,CCN(CC)c1nc(N=C(N(C(C)C)C2=O)SCC(Nc(ccc(Cl)c3)c3F)=O)c2s1,2 Z1551797657,NC(NC(CO)C(N1CC(c(c(Cl)c2)cc(F)c2Cl)OCC1)=O)=O,0 Z1647429805,CN(C)c1nccc(CN(CC2)CCC2OCc2ccccc2)n1,2 Z2331890847,CC(CN(CC1)C(c2cn(-c3cc(F)ccc3)nc2C)=O)CS1(=O)=O,0 Z2989516943,COc(cc1)cc(Cn2nnnc2N2CCOCCC2)c1OC,0 SB42-0372,CCN(Cc1ccccc1)C(CN(C[C@@H](CN1CCOC)N2[C@@H](CC(C)C)C1=O)C2=O)=O,0 F6522-0062,O=C(c(c(F)ccc1)c1F)NCc1cc(-c2ccco2)cs1,0 Z4916288469,CC(CC(C)(C)C)CC(N1C(CNC(c2c(C3CC3)scn2)=O)CC1)=O,2 V006-2531,COCCNS(c(cc1)cc(N(CC2)CCN2S(c(cc(cc2)OC)c2OC)(=O)=O)c1OC)(=O)=O,0 Z4999841281,OC(C(c1c(CC2)cccc1)N2C(c1cc(C(N(C2)C(CCC(N3)=O)C3=O)=O)c2cc1)=O)=O,2 S682-0388,O=C([C@H]1OCCN(C2CC2)[C@@H]1c1ccccc1)NCc(cc(cc1)F)c1F,2 S963-2960,CNC([C@@H](CN(Cc1ccncc1)C1)[C@H]1NC(CCn1nccc1)=O)=O,2 Z4666910302,CC(C)(C1(CCC1)NC(c(cc1)c(C)cc1F)=O)C(O)=O,0 L324-0311,CCC(C(Nc(c(OC)c1)cc(Cl)c1OC)=O)OC(C=C1)=NN(c(cc2)ccc2F)C1=O,0 Z2644558661,O=C(CC(CCC1)NC1=O)Nc1cc(n(C(F)F)cc2)c2cc1,2 Z3016313804,O=C([C@H]1OCCC1)Nc(ccc(Br)c1)c1OC(F)F,0 F6561-0752,COCc1cn(C(CC2)CN2C(C2OCCC2)=O)nn1,2 Z1236579124,CN(C(CCC1)CN1c1nnccc1)C(NCc1cccc(F)c1)=O,2 F550-3949,CC(C1)N(C(C(C=C2)=NN(CCC(Nc(ccc(Br)c3)c3F)=O)C2=O)=O)c2c1cccc2,0 M498-0906,O=C(CN(c(cccc1)c1C(c1nc(C2CC2)no1)=C1)C1=O)NC1CCCC1,2 SA71-1201,O=C(C(C=C1)=NNC1=O)N(CCC1)CC1(CC1CC1)c1noc(-c2ncccc2)n1,2 Z4912025477,Cc1nc2ncccc2cc1CCCC(O)=O,0 Z2213176542,C[C@@H](CF)NC(c1nc(C)ns1)=O,0 F6155-0245,COc(cc1)cc2c1nc(N(C1)CC1C(N(CC1)Cc(cc3OC)c1cc3OC)=O)s2,2 F6573-8391,CCc1nc(ccc(C(N(CCN2c(nc3)ncc3F)CC2=O)=O)c2)c2s1,2 SC15-0382,Cc1cc(C(N2CCC(CN(CC(COC)C3)C3=O)CC2)=O)no1,0 Z2523774031,C(Cc1nnc2n1CCOC2)Cc1ccccc1,2 Z3077776759,Cn1nccc1C(C1)(CN1c1nc(C(F)(F)F)ns1)OC,2 8017-8431,CN(C)S(N1CCN(CC(COc2cc(CCC3)c3cc2)O)CC1)(=O)=O,2 Z1934803884,Cn1nccc1C(Nc1cc(C2COCCC2)nn1C)=O,2 F6381-0033,Cc1noc(C(CCC2)N2C(c2cc(-c3ccccc3)n[nH]2)=O)n1,2 Z3302459082,CC(CC(CC1)(F)F)N1c1nnc(COc(cc2)ccc2F)n1C,2 F6559-1612,Cc(ccc(S(NC(CC1)CCC1(F)F)(=O)=O)c1)c1Cl,0 F6514-2476,COc(ccc(C(NC(C1CCOCC1)c1cnccc1)=O)c1)c1F,2 F5833-6882,CCSc(cccc1)c1C(Nc1cc(N(CCCC2)C2=O)c(C)cc1)=O,0 F6524-1198,Cc1nnc2n1ccnc2N(CC1)CCN1C(c(cccc1)c1C(OC)=O)=O,2 Z286292384,N#Cc1cc(N(CC2)CCN2S(c(cc2)cc3c2OCCCO3)(=O)=O)ncc1,2 SB32-0160,Cc1n[nH]c([C@@H]2[C@@H](COC)CN(Cc3c(cc[nH]4)c4ccc3)C2)n1,2 T200-0048,Cc1c(C(N2Cc3cc(-c(cc4)cc(OC)c4OC)nn3CCC2)=O)scc1,2 Z2217676647,Clc1cc(CCNc2ccnc3cnccc23)ccc1,0 Z1502958987,CC(CC1)CCN1C(CC1)CCC1NC(NCc(cc1)ccc1C(N)=O)=O,2 D399-1634,COc1ccc(CN(CCC2)C2c(cc2)ccc2OC)cc1,0 S985-1066,CN(C)C([C@@](CN(Cc1ccccc1)C1)(C2)[C@@H]1CN2S(c1cnccc1)(=O)=O)=O,2 Z736102372,Cc1cc(C(NCc2cccc(F)c2)=O)nn1C,0 S693-1246,CC(C)NC(N1CC(Cn2c(-c3ccncc3)ncc2C)CCC1)=O,0 Z1440434641,OC(C1)CN1C(c1c(C(F)(F)F)n(-c(nccc2)c2Cl)nc1)=O,0 F6782-3825,OC(C(C1)CN(Cc(ccc(F)c2)c2F)C1=O)=O,0 Z2777912978,O=C(Cc1cn(cc(cc2)F)c2n1)NOCC1CC1,2 F6111-2159,N#Cc1ccc(COCC2CCN(Cc3csc(-c4ccccc4)n3)CC2)cc1,2 F0657-0187,CC(C)(C(Nc1c(C)ccc(-c2cn(cccn3)c3n2)c1)=O)Oc(cc1)ccc1Cl,0 F2487-0167,CC(C)(C(NCC1)=O)N1C(c(cc1)ccc1S(N(C)C1CC1)(=O)=O)=O,2 SB04-0468,CN(C)C(N(CC1)CC1N(CCNC(C1(CC1)c1ccccc1)=O)C1CCOCC1)=O,0 8014-1303,CC(C)(CC(N(Cc1ccco1)C1=O)=C2C1(C(F)(F)F)NC(c1cnccc1)=O)CC2=O,2 Z1269631531,CCNC(N(CC1)c2c1ccc(NS(c(cccc1)c1F)(=O)=O)c2)=O,0 F6443-8329,Cc1nnc(CNC(C(CCC2)N2c2nc(cccc3)c3o2)=O)o1,2 Z4368552251,CC(CNC(c(c(C)nc1c2)cc1ccc2OC)=O)c1n[nH]nn1,2 L310-0048,Cc1nc(CN(C(COc2c3)=O)c2cc(Cl)c3S(Nc2c(C)cccc2C)(=O)=O)no1,0 S836-3554,CNC([C@@H](C1)[C@@H](COC)CN1C(c1cc(C#N)ccc1)=O)=O,0 Z1499410130,CCN(C=C(C=C1)NC(NC(CC2CCCC2)c2ccccc2)=O)C1=O,2 F6556-3448,COc1c(CNC(C(NCC(CC2)CCN2C2COCC2)=O)=O)cccc1,2 F784-0252,CC1Oc(cccc2)c2N(CC(Nc(cc2)cc3c2n(C)c(CCc2ccccc2)n3)=O)C1=O,0 V002-2044,COc1cccc(C(CN(CC2)CCN2S(c2ccc(C(F)(F)F)cc2)(=O)=O)OCc2cccc(Cl)c2)c1,0 Z4510615427,CC(C)(C(CC1)c(cc2F)cc(F)c2F)N1C(c(cc1)ccc1C(N1CCOCC1)=O)=O,2 F6233-0429,CCOc1ccc(CC(Nc(cc2)ccc2N2N=NN(CCOC)C2=O)=O)cc1,0 Z1652367154,Cc1c(C)sc2ncnc(N(CC3)CCC3C3COCC3)c12,2 Z1603645724,OC(C1(CCSCC1)NC(Cc(cc1)cc2c1OCC2)=O)=O,2 S637-0354,O=C(c1cocc1)NC1CCn2c(C3CC3)nnc2CC1,2 F6429-0463,COc(ccc(F)c1)c1S(NCCN(C(C=C1)=O)N=C1n(cc1)c2c1cccc2)(=O)=O,2 S761-0356,COC[C@@H]1N(Cc2ccccc2)CCC[C@@H]1C(NCCN(CCC1)c2c1cccc2)=O,2 Y050-1706,CCOc(ccc(S(N(C)CC(NCC1OCCC1)=O)(=O)=O)c1)c1Cl,0 F6562-1821,O=C(C1(CCCC1)c1cccs1)NCc1cncc(N(CCC2)C2=O)c1,2 Z1608436317,COc1cccc(C(NCC(Nc2cnc(CCOC3)c3c2)=O)=O)c1,2 SB46-0235,O=C([C@H](C[C@H]1CN(C2)C(C3CCOCC3)=O)C[C@@H]1NC2=O)NCCc1cccs1,2 F6755-5374,CSc1nc(N(C(CC2)C3)C2CC3O)ccn1,0 S953-5030,NC(C(CC(C1)(CC2)CCN2C(C2CCC2)=O)N1c(cc1)cc(C(F)(F)F)c1C#N)=O,0 Z1607149893,CN(C1C2CC(C3)CC1CC3C2)C(c1ccc(C2(CC2)C#N)cc1)=O,2 Z2704576779,N#Cc(cccc1)c1OCC(CN1Cc2cncn2CC1)O,0 Z1614079200,O=C(C1Cc2cnc(-c3ccccc3)n2CC1)NCc1cnccc1,2 F6549-2618,O=C(Cc1cccs1)N(C(CC1)C2)C1CC2n1cncc1,2 T159-1291,Cc1cnc(CC(CCC2)CN2S(C)(=O)=O)n1Cc1ccccc1,0 D750-0321,O=C(CC1(CCOCC1)N(Cc1c2cccc1)C2=O)NCc1ccccc1,2 F6753-2154,Cc1noc(C)c1CN(CC1)CCC1C(N(CC1)CCC1(F)F)=O,2 Z1451096847,Cc1cccc(C(CN(Cc2ccccc2)C(c2csc(S(N)(=O)=O)c2)=O)O)c1,2 F2726-0166,CC(c1c(C)nc(NC(Cc2c(C)cc(C)cc2)=O)s1)=O,0 V027-7753,CCC(C)NC(CN(c(ccc(C)c1)c1C(N1c2ccc(C(C)C)cc2)=O)C1=O)=O,0 F5094-1014,CC(C)n(cc1)nc1C(Nc1nc(ccc(SC)c2)c2s1)=O,0 S726-0610,Cc1noc(C)c1CCC(N(CC1)CCC11OCCC(CCOC)C1)=O,0 Z1531857393,CCc(onc1C)c1NC(NCC1(CCCCC1)O)=O,0 F6156-0665,CSc(cccc1)c1C(N1CC(COc(cc2)ccc2F)C1)=O,0 V004-3962,Cc(c(CN(CC(COc1ccccc1)O)C1CC1)c1Oc2ccccc2)nn1-c1ccccc1,0 Z1462353921,NC(C1(CCCCC1)NC(c1cncc(-c(cc2)cc3c2OCC3)c1)=O)=O,0 E989-0880,CN(C)c1ccc(CNC(CCC(N2c3cc(-c4cccn4C)nn3CCC2)=O)=O)cc1,2 F6416-9138,OC(CCNC(c1cocc1)=O)c1cccc(Cl)c1,0 Z1352846979,CC(c(cc(cc1)F)c1OC)NC(NC(C1)CN(C)C1=O)=O,0 F6451-1802,Cc1c(C(CNC(N(CCN2)C2=O)=O)OC)cccc1,0 Z2065928649,O=C1NC(CC2CCC2)=Nc2c1c(CCC1)c1s2,2 Z809074910,CC(N1CC(N(CCC2)C2c2c(C)cccc2)=O)=C(C)SC1=O,0 F6658-5557,Cc1c(C)ncnc1OCC(CC1)CCN1c(ccnc1)c1Cl,2 S979-0397,CC(C)CCNC(N(C1)[C@@H](C)COc(cc2)c1cc2C(N1CCCC1)=O)=O,0 F6244-1950,COc1cccc(S(NCC#CCN2CCCCC2)(=O)=O)c1,2 F6237-1820,Cc1cccc(NC(c2nn(-c(cc3)ccc3F)nn2)=O)n1,0 F6529-2843,O=C(c1nc2ccccc2cc1)N(CC1)CCC1N(CC(N1C2CC2)=O)C1=O,2 S720-2049,Cc1ccc(C(N(C[C@H](C2)Oc3ccccc3)[C@@H]2C(N)=O)=O)s1,0 S827-5473,COCCC(N(CC(C1)(F)F)[C@@H]1c1nc(-c2cnccc2)no1)=O,0 Y020-4257,Cc(nc1nc2)nn1c(C)c2-c1ccnc(N2CCN(Cc3ccccc3)CC2)n1,2 8019-7990,CC(C)(C)C(CC1)Cc2c1c(C(CC(N1)=O)c3ccncc3)c1s2,0 Z1627698556,CC(C1)COCCN1C(c1csc(-c(cc2)cc(F)c2F)n1)=O,2 SB33-0190,Cc1c(CN(C[C@@H]2c3nc(C)n[nH]3)C[C@@H]2NC(C2CCCC2)=O)scn1,2 F5855-0777,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1)CCN1C(C(C1)C1c(cc1)ccc1F)=O,2 F6619-6149,Cc1nc(N(CC2)CCN2c2cc(C#N)ncc2)cc(N2CCOCC2)n1,0 Z1532823617,Cc(nc(cc(cc1)F)c1c1)c1C(NC1(CO)CCCC1)=O,0 Z1627798911,CN(C=C(C(N1C)=O)S(NCCC2OCCCC2)(=O)=O)C1=O,2 SC72-2132,CCCc1nc(COC2(C3)CN3C(c3cccs3)=O)c2cn1,0 V021-8202,CCS(N(CC1)CCN1c1nc(CCc2ccccc2)nc2c1c(C)c(C)s2)(=O)=O,2 F6482-6875,CN(C=CC=C1C(NCc2cc(-c3cscc3)ncc2)=O)C1=O,2 K292-1598,CC(CCCC1)C1NC(C1CCC(CN(C(c(scc2)c2N2)=O)C2=S)CC1)=O,2 G747-0242,CCN(C(C)=CC(O)=C1C(c(cc2)ccc2OCC)N2CCN(C)CC2)C1=O,0 F6559-6686,Cc1nc(C(F)(F)F)cc(N(CC2)CCC2NS(c2nccn2C)(=O)=O)n1,2 F6441-3381,CC(C)CS(C(CC1)CCN1C(CCc(cc(cc1)Br)c1OC)=O)(=O)=O,0 F5854-3056,Cn1c(CN(Cc2cccs2)S(c2cccs2)(=O)=O)ccc1,2 T482-0592,O=C(c(ccc(F)c1)c1F)Nc1cccn2nc(C3CCC3)nc12,0 Z1160991593,Cc1c(C(Nc(cc2)cc(Cl)c2-n2nccc2)=O)nnn1-c1cccc2ncccc12,2 Z3653511557,CN(C(C1CN(CC2CC2)CCC1)=O)c1ncccc1,2 Z2803268631,CCC(CC1)(CCN1C(c1cocc1C)=O)N,0 F6670-4874,O=C1N(CC2CCN(Cc3c(C(F)(F)F)cccc3)CC2)C=Nc2c1cccc2,0 V013-8050,N#Cc(cc1)ccc1NC(N(CCc1csc2nc(-c(cc3)ccc3F)cn12)Cc1ccccc1)=O,0 F6573-8624,O=C(NC1(CC(C2)C3)CC3CC2C1)N(CCN1c(nc2)ncc2F)CC1=O,2 Z1591542130,Cc(ccn1nc2)nc1c2C(Nc1c(CN(CC2)CCC2O)cccc1)=O,2 F6726-5580,CN(C(C1)CN1c(ncnc1-c(cc2)ccc2F)c1F)C(C(C=C1)=NN(C)C1=O)=O,2 F5835-0531,COc(ccc(Cl)c1)c1C(N(CC(C1)CN23)CC1C3=CC=CC2=O)=O,0 Z1220405516,Cc1cccc(C(N(CC2)CCC2Nc2nc(C)ccc2)=O)n1,2 F979-0462,O=C(C=C1)N(c(cc2)ccc2Cl)N=C1N(CC1)CCN1S(c1cccc2nsnc12)(=O)=O,2 SC72-0397,O=C(NC1CCCC1)N(C1)CC11OCc2c1cnc(C1CC1)n2,2 T505-0824,CN(C)C(c1cn(CCC(CCCC2)N2C(Nc(cc2)cc3c2OCCO3)=O)nn1)=O,2 F6363-0198,COc(nc1)ncc1NC(Cc(cc1)ccc1F)=O,0 F6438-1598,O=C(NCc1nc(N2CCCC2)ncc1)Nc(cc1)cc(C(F)(F)F)c1Cl,0 F6495-4153,Cc(cc1)cc(Br)c1NC(C(C1)CN1c1ncnc(-c2ccccc2)c1)=O,0 Z2755322197,Cn1c(C(N(CC(O)=O)C2CCCCC2)=O)cnc1,2 F2883-0470,COc1ccc(Cn2c(SCc3cccc4ccccc34)ncc2CO)cc1,2 Z1893931170,N#Cc(c(CNc(cccc1CN2)c1C2=O)c1)c2n1cccc2,2 Z2288888760,CC(C)(C)c1ccc(CC(NS(c2nc(Cl)cs2)(=O)=O)=O)cc1,0 Z735363952,O=C(CCn1ncc(Br)c1)NC1C2CC(C3)CC1CC3C2,2 Z1231345442,CC(C)(C)CC(N(CCC1)C1C(Nc1cc(C(N(C)C)=O)ncc1)=O)=O,2 Z3009807619,OC(c1cn([C@@H](CCCC2)[C@@H]2NC(C2CCC2)=O)nn1)=O,0 F6517-4655,OC(CNC(c1ccco1)=O)c(cc1)ccc1-c1cscc1,2 Z805500504,CC(c(cc1)ccc1F)N(C)C(CN(CC1)CCC1c1nc(C)no1)=O,0 Z3235495966,O=C(c1n[nH]c(-c2ccncc2)c1)NC1CC1,2 Z2936894789,CC(C)CN(CC(C1)C(N(CCC2)CC2c2nocn2)=O)C1=O,2 F6445-6560,O=C(Cc(cc1)ccc1F)NCc(cccc1)c1-c1cscc1,0 Z2044815412,Cc1n[nH]c2c1c(N1CCOCC1)ncc2,2 Z1273815160,CCS(NC(CCC1)CN1C(C(CC1)CCC1c1ccccc1)=O)(=O)=O,2 Z1803781780,C[C@H](C1)[C@@H]1C(NS(c1cn(-c2cc(C(F)(F)F)ccc2)nc1)(=O)=O)=O,2 Z2288974566,CC(C)n1ncc(S(NC(C(C2)C2(Cl)Cl)=O)(=O)=O)c1,0 Z1716319420,CCOC(C1(CNC(c2c(cc(cc3)Br)c3nc(C)c2)=O)CC1)=O,0 F0537-0396,O=C(c(cc1)cc2c1ncs2)NCc1ccccc1,0 F6573-7339,O=C(CCc(c(Cl)ccc1)c1Cl)N(CCN1c2cnccc2)CC1=O,2 Z4456356998,CC(C)C(C(Nc1cnc(CCC2)c2c1)=O)c(cc1)ccc1C#N,2 Z1559192965,Cc1c(CN2CCN(CCC3N(C)CCC3)CCC2)cccc1,2 Z3303695089,O=C(c(cc1)ccc1OC(C1)C1(F)F)N(CC1)CCC1Oc1cncc(Cl)n1,2 Z2721524547,OC(CCCS(N(C[C@H]1C2)C[C@@H]1[C@H]2c1ccccc1)(=O)=O)=O,2 Z88897779,CCc(cc1)ccc1S(N(C1)c(cccc2)c2OC1C(O)=O)(=O)=O,0 F6473-1063,O=C(c1nc2ccccc2nc1)N(CC1)CCC1N(CC1)Cc2c1scc2,2 Z1715216416,O=C(c1c[nH]nc1C1CC1)N1CCN(Cc(cc2)ccc2F)CCC1,2 Z1747367116,OC[C@H](CCC1)N1C(C(CCC1)CN1C(Cc(cc1)ccc1F)=O)=O,2 Z1375413211,CC1(CNC(Nc2nn(CCC#N)cc2)=O)CCOCC1,2 F1224-0004,CC1CN(CC(COc(cc2)ccc2Br)O)CC(C)C1,0 F2323-1258,Cc1c(CN(C=Nc2c3cnn2CCNC(C2(CCCC2)c(cc2)ccc2Cl)=O)C3=O)cccc1,2 Z1743866586,CC(C1CC1)n1ncc(Nc2ncnc3c2CCCC3)c1,2 Z3002370057,Cc1c(CN(C2)CC3(CCC3)C2N)oc(C)n1,2 D470-1722,O=S([C@@H](CS(C1)(=O)=O)[C@H]1NC1CCCCC1)(c1ccccc1)=O,2 2944-0155,O=C(C(C1(CCCC1)Cc1c2cccc1)=C2N1)NC1=S,2 Z816144010,O=C(c1c(CCCC2)c2nn1-c1ccccc1)NCc1cnccc1,2 L228-1286,O=S(c1ccc(-c2cnc(C3CCCC3)o2)s1)(NCCc1ccccc1)=O,0 F6480-4393,O=C(CN(CCO1)C1=O)N(CCC1)CC1Oc(nc1)ncc1Br,2 F3179-0190,O=S(c(cc1)cc2c1OCCO2)(NCc1ccncc1)=O,2 Z4425283499,O=C(c1csc(S(N(CC2)Cc3c2cccc3)(=O)=O)c1)Nc([nH]1)nnc1N1CCOCC1,2 F6279-0427,OC(CNC(C1CC=CCC1)=O)C1CCCCC1,2 Z2145673085,Cc1cccc(C)c1N(CC1)CCN1S(c(cc1)cc(C=C2)c1OC2=O)(=O)=O,0 F0336-0354,CCCC(Nc1ccc(Cc(cc2)ccc2NC(CCC)=O)cc1)=O,0 F6574-1957,O=C(NCC1OCCC1)NCc1nccnc1-c1cccs1,2 Z1531355408,COCC(CC1)(CCN1C(c1csc(C2CC2)n1)=O)O,0 SB75-1119,CC(C)C(N(C[C@@H]1C[C@H](C2)NC(CCn3cncc3)=O)C[C@@]12c1nc(C)no1)=O,2 Z3536568468,CC(CN(CC1)C(c2cc(cn[nH]3)c3s2)=O)C1c1ccccc1,2 Z1738977102,OC(CCN(C1CC1)S(c(cccc1F)c1F)(=O)=O)=O,0 F2816-0307,COc(cc1)ccc1SCC(Nc1cccc(Cl)c1Cl)=O,0 F6286-0369,CCCCOc(cc1)ccc1NC(NCCc1nc(C)cc(C(F)(F)F)n1)=O,0 F6524-5661,CCn1nc(C(NCc2nnc(cc3)n2nc3OCC)=O)c(Cl)c1,2 Z2439957884,CN(C1CCNCC1)C(CCNC(c1cc2ccccc2cc1)=O)=O,2 SC23-0582,CC1(CCCCC1)C(N(C1)CC1N(CCc1noc(C2CC2)n1)S(C)(=O)=O)=O,2 F6178-5749,O=C(CSc(cc1)ccc1F)NCC(CC1)CCN1c1nc(cccc2)c2o1,2 Z1785473293,Cc1nc2ccccc2c(-c2ccccc2)c1CC(NCCN1CCOCCC1)=O,2 F6561-7531,COC(c(cc1)ccc1C(NC1CN(Cc2cscc2)CC1)=O)=O,0 Z1440142247,O=C(NCc1coc2c1cccc2)N1CC2(CCCC2)OCC1,2 Z1928164666,Cc(cc1)c(C)cc1C(NCCC(NO1)=NC1=O)=O,0 Z2353109463,CC(Cn1c(N(C2)C[C@@H]3[C@H]2CCCC3)nnc1C(N1CCCC1)=O)=C,2 K284-6179,O=C(C1CCC(CN(C(c(cccc2)c2N2)=O)C2=S)CC1)N(CC1)CCN1c(cc1)ccc1F,0 Z1440537269,COc1cccc(CC(CCC2)N2C(NC(CCN2C3CCCCC3)C2=O)=O)c1,2 D205-0492,CC(C(Nc1nn2c(O)cc(-c3ccccc3)nc2n1)=O)N(C(c1c2cccc1)=O)C2=O,2 K906-4715,CC(C1)Oc(cccc2)c2N1S(c1ccc(CN(C(c2c3nccc2)=O)C3=O)cc1)(=O)=O,0 D445-0057,O=C(CC1)N(c(cc2)ccc2S(NC(CC2)CS2(=O)=O)(=O)=O)S1(=O)=O,0 Z45613435,Cc1cc(NS(c(cc(cc2)Br)c2OC)(=O)=O)c(C)cc1,0 Z2961486910,OC(CCNC(C(C(F)(F)F)F)=O)(c(cccc1)c1N1)C1=O,0 M086-1329,CCc(ccc(-c1noc(C(F)(F)F)c1)c1)c1S(N1CCC(C)CC1)(=O)=O,0 Z1927523880,CC(C)N(CC1)CCN1C(CC1)CCN1C(c1c2OCC(C)(C)c2ccc1)=O,2 Z3379044480,CN(C)CCc(cc1)ccc1C(NC(CC1)Cc2c1nccc2)=O,2 L926-0189,O=C(c1c2)N(Cc3nc(-c4cccs4)no3)N=Cn1nc2-c(cc1)ccc1Br,2 Z1374329691,CC1(CNC(c2c[nH]c(-c3ccccc3)n2)=O)CCOCC1,2 Z3327941415,NC1(CCN(Cc2ccccc2)CC1)C(N)=O,0 F6616-3206,Cc1cc(C)nn1C(N1C)=Nc(cccc2)c2C1=O,2 F6403-2882,O=C(c(cc1)ccc1-n1cccc1)NCCc1csc(-n2nccc2)n1,2 F2730-0513,COC(c(cccc1)c1C(N(CC1)CCN1c1nc(ccc(SC)c2)c2s1)=O)=O,0 Z2439125787,OC(CC1)CN1C(C1)CN1C(Nc(cccc1)c1Oc1cc(F)cc(F)c1)=O,0 F6556-8745,CSc(nccc1)c1C(NC(c1cscc1)c1cccs1)=O,0 G346-0038,CCCCN(C)C(C1CCC(CN(C(c(scc2)c2N2)=O)C2=O)CC1)=O,0 C470-0640,CC(C)Cn1c(C(N(C)C(N2C)=O)=O)c2nc1CN(CC1)CCN1c(cc1)ccc1OC,0 F6384-0763,CCc(cc1)ccc1S(N(CCN(C1)C2CC2)C1c1ccccc1)(=O)=O,2 F5496-0044,CCc1nnc(C(CC2)CCN2C(c(cc(cc2)Cl)c2OC)=O)s1,0 Z4024733153,CC(CO)Nc1cc(Br)cc(F)c1S(N)(=O)=O,0 F6812-1548,COc1cnc(N(CC2)CCN2c2nc(-c3ncccc3)ccn2)nc1,2 F6476-5968,CSc(cccc1)c1C(N(CC1)CC1Oc(ccnc1)c1Cl)=O,0 L309-0122,Cc1nc(CN2c(cc(cc3)S(Nc4cc(C)cc(C)c4)(=O)=O)c3OCC2=O)no1,0 F6554-8426,O=C(c1cc(cc(cc2)Cl)c2[nH]1)N1C(C2)CSC2C1,2 Z4208549778,CC(C)(C)[C@@H](C(N(CCOC)CC1)=O)NC1=O,2 F6561-9265,O=C(CSCc1ccccc1)NCc1cn(-c2cnccc2)nn1,2 F0561-0815,O=C(COc(ccc(Cl)c1)c1Cl)Nc1c(CS(C2)=O)c2nn1-c(cc1)ccc1F,2 F5033-1187,O=C(NCC1CCN(Cc2cscc2)CC1)NC1CC1,2 Z2961800129,Cc(c(CCNC(c1c(C2CC2)nco1)=O)ccc1)c1Br,2 Y500-5894,CC(C)c(ccc(C)c1)c1OCc1ccc(C(N(C(C)CC2)c(cc3)c2cc3F)=O)o1,0 F6199-0093,CC(C)Oc(cc1)ccc1C(N1CCN(CCn2cncc2)CC1)=O,0 Z1510345231,CC(C)(C1)OCCC1NC(NC1CCN(CC(NC)=O)CC1)=O,0 Z3651347172,CC1(C)OC(CCC2)(CN2C(C2(CC2)c2cccc(Cl)c2F)=O)NC1=O,2 F6788-7397,Cc1noc(C)c1CN(C1)CC(C2)C1CN2S(Cc1ccccc1)(=O)=O,2 F6512-1834,O=C(C1(CCOCC1)c1ccccc1)NCc1nc(C2CCCCC2)cs1,2 F2622-0050,CC(C1=NC(O)=C2C(NCc(c(F)ccc3)c3F)=O)=CC=CN1C2=O,0 F6245-3358,CC(C)(C(N(CC1)CCC1C(N1c2ccccc2)=NN(C)C1=O)=O)Oc(cc1)ccc1Cl,2 G125-0877,O=C(C(CC1)CCN1C(c1ccc(-n(cc2)c3c2cccc3)s1)=O)NC1CCCCC1,2 E612-1057,CN(Cc1ccccc1)C(C(CCS(C)(=O)=O)N(Cc1c2cccc1)C2=O)=O,0 F5088-0440,CCOc(cc1)ccc1-c(cc1)nnc1N(CC1)CCN1C(CSCc1ccccc1)=O,2 8017-0489,COc(ccc(Cl)c1)c1NC(C(C1)Nc2nc(cccc3)c3n2C1=O)=O,0 F6496-1905,CN(C)Cc1noc(cc2)c1cc2NC(c1cc(cccc2)c2[nH]1)=O,2 Z2010090116,Cn1cnc(C=C2c3nc4ccccc4c(C(O)=O)c3CN(Cc3ccccc3)C2)c1,2 Z1282600405,CCN(CC)C(CC1)CN1C(NCc(cc1)ccc1C#N)=O,0 SB49-0883,Cc1cc(C(N(CCCC23CCOCC3)C2C(N)=O)=O)no1,2 F2902-1364,O=C(Cc1noc2c1cccc2)NCCn1ncc2c1ncnc2NCc(cc1)ccc1F,2 Z910597482,CCC(Nc(cc1)ccc1NC(c1cc(-n2nc(C)cc2)ccc1)=O)=O,2 Y031-4774,O=C(C(CC1=O)CN1c(cc1)ccc1Cl)Nc(cc1)ccc1S(N1CCCCC1)(=O)=O,2 Z3216015618,CCn1ncc(S(N(CC2)CCC2C2(C)N=N2)(=O)=O)c1,2 Z3226490395,Cc(cc1)ccc1NC(c1c[nH]nc1N)=O,0 Z2351707294,O=C(CC[C@@H]1NC2CCN(CC(F)(F)F)CC2)N[C@@H]1c1ccccc1,2 2699-0156,O=C1Oc(cccc2)c2C=C1c1nc(-c2ccc(C3CCCCC3)cc2)cs1,2 SB17-0158,O=C(CCCc1c[nH]c2c1cccc2)N(CC[C@H]1NC(CC2)=O)C[C@]12C(N1CCCC1)=O,2 Z3185488674,Cc1c(CC(NCc2cccc(C(N(C)C)=O)c2)=O)ccc(O)c1,0 Z4168429775,OC(CC(C1)(C2)CC12NC(c1cc(-c2ccco2)nn1-c1ccccc1)=O)=O,2 SC72-0616,Cc1cc(C(N(C2)CC22OCc3c2cnc(-c2ccccc2)n3)=O)c(C)o1,2 P935-1615,CCn1nccc1C(N(CCCC1)C1c1nncn1CC1CC1)=O,2 Z2825353641,CC(C)CC(CC1)CCN1C(c1cc(N)ncc1)=O,0 K906-4728,CCC(C)NC(C1CCC(CNS(c(cc2)cc(CC3C)c2N3C(C2CC2)=O)(=O)=O)CC1)=O,0 F6542-0346,O=C(NC1CCOCC1)N(CC1)CC1c1cccs1,2 Z1578626951,CC(CC(N(CC1)CCC1(CN1CCOCC1)O)=O)c1ccccc1,2 SB58-0973,CN(C)CC(C1)C(C2)(CN2C(COc2ccccc2)=O)CN1C(c1ccccc1)=O,2 P223-1401,CN(CCCn1nc(C2CN(Cc(cc3)cc(F)c3F)CCC2)cc11)C1=O,2 Z2846203933,CC(c(cc1)ccc1Br)n1nnc(CN(CCCC2)C2=O)c1,2 F6787-0314,Cc1c(C)ncnc1OCC(CCC1)(C2)C1CN2c1nccnc1C#N,2 F6247-1101,Cc(cccc1)c1-c(cc1)nnc1N(CC1)CCC1NC(COC)=O,0 SB94-0880,O=C(CN1CCCCCC1)N1CCC(CN(CC(C2)C(NCC3CC3)=O)C2=O)CC1,2 Z1260330217,CC(C)C(COC)NC(C(CC1)CCN1c1ncc(C(F)(F)F)cc1)=O,0 Y030-8062,CC(C)C(Nc1cccc(C(N(CC2)CCN2c(cccc2)c2OC)=O)c1)=O,0 SB52-0307,CN(CC1(C2)CCN(Cc3cocc3)CC1)C2c1noc(-c2ccccc2)n1,2 F6557-0947,CSc1cccc(C(N(CCC2c3ccccc3)CCS2(=O)=O)=O)c1,0 G397-0153,O=C(C(CCC1)N1c1nnc(N(CCC2)C2=O)s1)NCCc1c[nH]c2c1cccc2,2 F6806-4825,Cn1ncc(-c2cncc(N3CCN(CC(Nc(cccc4)c4OC)=O)CC3)n2)c1,2 S613-0127,O=C(C(c1c2cccc1)=NNC2=O)N(CCC1)C1c1nc(CCOCc2ccccc2)no1,2 F6791-8248,C(C1)C1c1nnc(C(CC2)CCN2c(cc2)nn3c2nnc3)o1,2 F6791-7982,CN1N=C(C2CCN(CCn3nccn3)CC2)N(C2CC2)C1=O,2 F2245-1319,CSc1cccc2c1nc(N(CC1)CCN1C(Cc(s1)ccc1Cl)=O)s2,2 D392-0159,NC(COc1ccc(C(CC(N2)=O)C(C(N3)=O)=C2N=C3SCc(cc2)ccc2Cl)cc1)=O,0 V025-1299,COc(cc1)ccc1-c1n[nH]c(C2CC2)c1NC(Nc(ccc(F)c1)c1F)=O,0 Z744610684,COCCNC(c(cccc1)c1NC(c1noc2c1CCCC2)=O)=O,0 Z2167792306,Cc1nn(cc(cc2)NC(N3C(Cc(cccc4)c4Cl)CCC3)=O)c2n1,0 Z2766381882,COc(cccc1)c1C(N(CC1)CCC1[C@H](CC1)O[C@H]1C(N)=O)=O,2 F6676-1010,Cc1nccc(OCC(CC2)CCN2C(c(cccc2)c2Cl)=O)c1,0 Z2358606645,CC(CC1)(CN1c1nc(C2CC2)nc(C)c1)C(O)=O,0 Z2965376804,CC(Cn1nccc1)(C(N)=O)NC(C1CC1)=O,2 D216-0125,CC(CCNC(NC1=CNc(c(C)ccc2)c2C1=O)=O)c1ccco1,2 Z1393608697,CCC(CN(C)c1c(C2)cccc1)N2C(Nc1nn(CCOC)cc1)=O,2 Z808260210,Cc1c(CN(C)C(N(C)C(N(C)C2=O)=O)=C2C#N)cco1,0 F6754-6716,COc(c(OC)cc1ncc2)cc1c2N1CCCCC1,0 SB36-0646,CC(C)CCN(C1)[C@H](Cn2nnc(C(N3CCOCC3)=O)c2)CC1(F)F,0 D327-0056,O=C(CN(C(C=C1)=O)N=C1c(cc1)cc2c1OCCO2)N(c1ccccc1)c1ccccc1,2 Z1134160254,Cc1ccc(cccc2NC(N3CCOCC3)=O)c2n1,2 SC88-0469,Cc1nn(C)c(C(N(C2)CC2(C(CC2)c3nc(C4CCCC4)no3)S2(=O)=O)=O)c1,2 Z2827922695,Cc1c(CNc(nccc2)c2Br)[nH]nc1C,0 F6619-7604,Cc1nc(N(CC2)CCN2c(cc2)nnc2-n2nccc2)cc(C(F)(F)F)n1,2 Z2166776391,CCC(CN(C)CCC1)N1S(c1cn(C(C)C)nc1)(=O)=O,0 Z2482870147,OC(c1csc(CN(CC2)CCC2c2ccccc2)n1)=O,0 E143-0005,O=C1N(Cc2ccccc2)c2nnc(-c(cc3)ccc3Cl)n2-c2c1cccc2,0 P621-0466,CCN1c2ncccc2OC(C)(C(Nc2cc(OC)cc(OC)c2)=O)C1=O,0 F6656-3196,Fc1cnc(N2CCC(COc3nnc(C4CC4)cc3)CC2)nc1,2 Z1949732059,CC(C)(CNC(c(cc1)cc2c1nc(C)n2C)=O)c1ccccc1,2 Y500-1512,Cc1cc(C)nn1C(c1nn2c(C(F)(F)F)cc(-c3cn(C)nc3C)nc2c1)=O,0 Z2964966418,Cc1ccc(CC(N(CCCS(C2)(=O)=O)C2c2ccccc2)=O)o1,0 Z606-0716,CC(C)NC(C1(CC1)c1cccc(C(F)(F)F)c1)=O,0 Z226019404,CC(C)N(C)S(c(cc1)ccc1C(NCC1(CCC1)c1ccccc1)=O)(=O)=O,0 CM4721-2336,CC(C)Cc1noc(C(CC2)(CCN2S(c(ccc(F)c2)c2F)(=O)=O)F)n1,2 F6803-2479,COc(cn1)cnc1OC1CN(CC(Nc(cc(C(F)(F)F)cc2)c2Cl)=O)CC1,0 F2090-2340,Clc(cc1)ccc1-n1ncc2c(N3CCOCC3)nc(NCCc3cccs3)nc12,2 Z1132314712,CC(C)(C)c1nnc(NC(N(CC2)CCC2C#N)=O)s1,0 Z1101988084,CC(N(CCC1)CC1C(Nc1nc(cccc2)c2n1CCCn1cncc1)=O)=O,2 Z4662037690,CC(NCc(cc1)ccc1S(NC(CN1C[C@@H](COC)OCC1)=O)(=O)=O)=O,2 F6244-1031,CC(C)N(CC#CCNC(c1ccncc1)=O)C(C)C,0 F6472-4102,CC(C)(C(N(CC1)CCC1Oc1nc(cccc2)c2o1)=O)Oc(cc1)ccc1Cl,2 V027-1859,CCN(Cc(n1CC2OCCC2)cnc1S(Cc1ccccc1)(=O)=O)C(c1cccc(Cl)c1)=O,0 Z285041152,CC(C)c(cccc1)c1NS(c(cc1)cc(C=C2)c1OC2=O)(=O)=O,0 F0777-1488,O=S(c1ccccc1)(n1c(cccc2)c2nc1Cc1ccccc1)=O,2 E213-0646,Cc1c(C(N(CCCC2)C2c2cnccc2)=O)sc(N=C2N3CCCC2)c1C3=O,2 C470-0600,CC1CN(Cc2nc(N(C)C(N(C)C3=O)=O)c3n2CCCO)CCC1,0 F6518-2272,CC(c1ccc(CCNC(Cc(c(F)ccc2)c2Cl)=O)s1)=O,0 G803-0633,Fc1cc(-c2noc3ncnc(Nc(cc4)cc5c4OCCO5)c23)cc(F)c1,0 F1913-0952,CNC(N(CC(CN)O)c1ccc(C(F)(F)F)cc1)=O,0 F6559-3503,CCn1ncc(-c2noc(CNC(Cc(cccc3)c3Br)=O)n2)c1,0 F2261-0023,CC(C)(COc(cc(cc1)NC(CCc(cc2)ccc2OC)=O)c1N1C)C1=O,2 Z854043666,O=C(C(Cc1ccccc1)CC1)c2c1cccc2,2 E786-0492,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(CCC(Nc1cc(F)ccc1)=O)(=O)=O,0 SC72-1092,O=S(c1cc(CCC2)c2cc1)(N(C1)CC11OCc2c1cnc(C1CC1)n2)=O,2 F6523-1802,O=C(Cc(cccc1)c1Br)NC(CC1)CCN1c1n[nH]c(C2CC2)c1,0 F6395-4042,O=C(c1cc2ccccc2cc1)N1CC2(CCOCC2)OCC1,2 Z3353047596,CCCc1ccc(CC(Nc2cnns2)=O)cc1,0 F6764-3230,O=C(COc(cccc1)c1F)N1Cc2cc3cccnc3nc2CC1,2 F5860-1824,COc1cc2cccnc2c(NC(Nc(cccc2OC)c2OC)=O)c1,0 F3328-0149,O=C(CSc1nncc(-c2ccccc2)n1)N1CCOCC1,2 SC88-1721,COc1ccc(Cc2noc(C(CC3)C(C4)(CN4C4CCOCC4)S3(=O)=O)n2)cc1,2 Y044-5171,CC(C(NC(CC1)c(cc2OC)c1cc2OC)=O)N(Cc1c2cccc1)C2=O,0 F070-0485,O=C(C(CC1)CCN1c1nc2ccccc2nc1C(F)(F)F)NC(CCC1)c2c1cccc2,2 F5857-3905,CC(Cc(cc1)ccc1OC)(CNC(c(cc1)ccc1-c1ccccc1)=O)O,2 V024-2050,CC(C)C(N(CCOC)Cc(n1CC2OCCC2)cnc1S(Cc(cccc1)c1F)(=O)=O)=O,0 F6262-6365,CC1Oc(cccc2)c2OC1C(NCc(s1)c(C)n2c1nc(-c(cc1)ccc1F)c2)=O,2 Z2177836802,OCC(Cc(cc1)ccc1F)(CC1)CN1C(CCc1c[nH]cn1)=O,2 Z3053364497,Cc1c(C(N[C@@H](CO)C=C)=O)[nH]nc1C(F)(F)F,0 F5037-1051,COc(ccc(-c1nnc(cc2)n1nc2OCCNC(C1CCCCC1)=O)c1)c1OC,2 SB75-1302,CCS(N[C@H](C[C@H]1CN(C2)C(C3(CC3)c3ccccc3)=O)C[C@]12c1nc(C)no1)(=O)=O,2 Z1102963951,CC(C)C(C(NCC1CN(CCc2ccccc2)CC1)=O)N(CCC1)C1=O,2 Z2188414639,OCC1(CN(Cc([nH]c2ccc3)cc2c3F)CC1)c1ccccc1,0 Z1956912096,CC(C)(CC(O)=O)NS(c(cc1)cnc1S(C)(=O)=O)(=O)=O,0 Z1701586692,Cc1n[nH]cc1CNC(N1CC(Cc(cc2)ccc2F)CC1)=O,0 F6724-3101,Brc1cnc(N(CC2)CCC2c2cccs2)nc1,2 F5570-0945,CN(C)S(c1ccc(C(NCc(cccc2)c2OC)=O)o1)(=O)=O,0 C785-3988,CCc1cc(n(c2c3)C(CC)=NN(CC(NC(C)c(cc4)cc5c4OCCO5)=O)C2=O)c3s1,2 Z2910634404,CCC(CC)(CC(O)=O)NC(c1cn(C)nn1)=O,0 V015-9577,O=C(c1ccc(-c2ccc(C3CCCCC3)cc2)s1)NC(CC1)c2c1cccc2,2 J004-1394,CCCc1cc(C(CCC2)N2C(c2nn3c(C(F)(F)F)cc(C4CC4)nc3c2)=O)no1,2 Z1742513552,CCn1c(NC(c2ncncc2)=O)nc2c1cccc2,0 Z2966752018,C[C@@H](C(NCCC1)=O)N1C(CCCn1nccc1)=O,2 S555-0178,O=C(C1CCCCC1)N1Cc(cc(cc2)N3CCCC3)c2OCC1,2 S993-0312,O=C(NC1CCCCC1)N(CCC1C(N(Cc2ccccc2)C2)=O)CCN1C2=O,2 Z1158308302,Cc1c(C(N(CC2)CCC2NC(Nc(cc2)ccc2F)=O)=O)nnn1-c(cc1)cc(Cl)c1F,2 SC42-0420,Cc1nn(C)c(C(N(CC2)CCC22OCCC(Cc3noc(C4CCC4)n3)C2)=O)c1,0 C430-5239,Cc(cc1)c(C)cc1NCc1cccc2c1CN(CC1OCCC1)C2,2 Z2295871767,C[C@@H](c(ccc(Cl)c1)c1Cl)NC(c1c(CC(O)=O)occ1C)=O,0 Z2621451678,CCN(C(c(cnn1C(C)(C)C)c1Br)=O)c1cc(F)ccc1,0 T138-0635,COCCC(N(CC1)CCC1N(C1(CN2Cc3cnccc3)COCC1)C2=O)=O,2 S903-0178,CC(C)CC(N(CC1)CCC1c1nnc(C2)n1CCN2C(c1conc1C)=O)=O,0 F6521-8662,COc1cc(CCCC2(CNC(C(NCc(cc3)ccc3F)=O)=O)O)c2cc1,2 F6445-0241,Cc1noc(CNC(c2cc(Oc3ncccc3)ccc2)=O)n1,2 S693-2156,Cc1cnc(COC)n1CC(CCC1)CN1S(c1cnccc1)(=O)=O,2 F6676-2671,CC(N=CN1CC(N(CC2)CCC2N(C)c2ncccc2)=O)=CC1=O,2 Z2768785457,COC(C1CCn2c(-c3cccc(S(C)(=O)=O)c3)nnc2CC1)=O,0 S986-0359,CN(C)C[C@](CN(C1)C(CC2CCCC2)=O)(C2)[C@H]1CN2C(c1ccccc1)=O,2 Z3071615666,O=C(CN1[C@H](CCc2ncccc2)CCC1)NC1CC1,2 V003-4420,CC(C)CC(N(CC1)C(c(cc2)ccc2F)c2c1ccc(OCc1ccc(C(NC(C)C)=O)o1)c2)=O,0 F725-1299,O=C(c1cc(Nc2ncnc(-c3ccccc3)c2)ccc1)NC(CCC1)c2c1cccc2,0 F6485-1758,Cc1nc(OC(CC2)CCC2NC(C(C=C2)=NN(C)C2=O)=O)nc(C)c1,2 F6553-8796,Cn1ncc(S(N(C2)CC2N2CCCC2)(=O)=O)c1,2 J079-0760,Cc1cc(N2CCN(CC(c(c(C)cc(C)c3)c3O3)=CC3=O)CC2)c(C)cc1,0 Y043-6480,c1(nsc2c1cccc2)N1CCN(C(N[C@H](C(Nc2cn(nc2)C)=O)C)=O)CC1,2 F5042-0467,O=C(Cc1cccs1)N(CC1)CCN1c(cc1)nnc1-c1ccco1,2 F6286-0842,O=C(Cc(cccc1)c1Cl)NCCc1nc(C(F)(F)F)c(CCCC2)c2n1,2 F415-0634,CC(C)Oc(cc1)ccc1-c1nc(CSc(c2c3)nccn2nc3-c2c(C)ccc(C)c2)c(C)o1,0 Z2167018633,O=S(c(cc1)cc(F)c1OC(F)F)(N(CC1)CC1(CC1)Oc2c1cccc2)=O,2 F2646-0709,CCS(c(cccc1)c1C(Nc1nc(c(F)cc(F)c2)c2s1)=O)(=O)=O,0 F1174-1765,Cc1c(C)sc2ncnc(SCc3ccco3)c12,2 Z2971907323,Cc1cnc2n(CC(N(CC3)c(cc4)c3cc4OC)=O)ncc2c1,2 S937-0797,O=S(c(cccc1)c1F)(N(C1)CC1n1c(C2OCCC2)nnc1)=O,0 Z2955943091,NC([C@]1(CCC2)[C@@H]2CN(Cc2cc(C(F)(F)F)cc(O)c2)C1)=O,0 SA49-0448,O=C(CC1COC(C2)(CN2C(c2ccncc2)=O)C1)N1CCOCC1,2 F6482-3356,O=C(c(cccc1)c1Br)N(C1)CC1n1nccn1,0 F993-0493,CN(c(sc(C(NCCN(CC1)CCN1c1ccccc1)=O)c1)c1C(N1C)=O)C1=O,2 F2740-0017,OCCN(Cc1ccccc1)C(Nc1c[nH]c2c1cccc2)=O,0 F6619-6346,CS(c1c(N(CC2)CCN2c2ncnc(N3CCCC3)c2)nccc1)(=O)=O,0 Z4662008907,CC(C)C(CN(Cc1ccccc1)C1)C1C(NCC#C)=O,0 T990-2293,COCCN(CCC1N(CC2)CCN2S(c(ccc(F)c2)c2F)(=O)=O)C1=O,0 F6473-4247,O=C(Cc1noc2c1cccc2)N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O,2 F6439-0683,CCOc(ccc(S(NCCn(c1c2CCCC1)nc2-c1ccncc1)(=O)=O)c1)c1F,2 Z2113250765,CC(C(N1)=O)(c2ccc(CNC(N(C)C(CC3)CCC3(F)F)=O)cc2)NC1=O,2 F6252-4158,Cc1noc(C(C=CN23)=CC3=NN(CCc3ccccc3)C2=O)n1,2 Z806851946,CC(Nc1c(C)ccc(C(Nc2cccc(C(N3CCOCC3)=O)c2C)=O)c1)=O,2 Z1979217558,CC(N(C1)CC1NC(c1c2n(C)cnc2ccc1)=O)=O,2 F6594-2870,O=C1N(CC(CC2)CCN2c2nsnc2)N=C(CCC2)C2=C1,2 Z3015570659,NC([C@@H](CCC1)N1S(c(cc1)cc(C(O)=O)c1O)(=O)=O)=O,0 Z2956204909,CC(C)C(CNC(C(C(Br)=CN1C)=CC1=O)=O)OC,0 D510-1028,COc(cc1)ccc1N(CC(C1)c2nc(cccc3)c3n2CC(COc(cccc2)c2Cl)O)C1=O,0 Z2821086836,O=C(c1c(C(F)(F)F)n(-c(cc2)nnc2Cl)nc1)NCC1C2(CC2)CCC1,2 8014-1294,CC(C)(CC(N(Cc1ccco1)C1=O)=C2C1(C(F)(F)F)NC(c1ccc(C)cc1)=O)CC2=O,0 F6791-7170,Cc1nccn1-c1cc(N(CC2)CCN2c(cccc2)c2OC)ncn1,0 F1839-0122,Cc1cc2nc(CCNC(c3cccc4ccccc34)=O)cn2cc1,2 Z3687067098,CC(C)=CCc(cc(cc1)C(N[C@@H](CC(Cn2cncc2)C2)[C@H]2O)=O)c1F,0 Z2231549578,CC(c1cc(O)ncc1)NC(C1=CC=C(c2ccco2)NC1=O)=O,2 F6178-6992,CN(C=CC=C1C(NCC(CC2)CCN2C2CCOCC2)=O)C1=O,2 F6245-5864,Cc1cc(C(NCCN2N=C(C(F)(F)F)N(C)C2=O)=O)c(C)o1,2 Z1311060855,CC(c1n[nH]cn1)NC(C1(CCCC1)c1cc(C)ccc1)=O,2 F2788-0078,C(CSc(cc1)nnc1-c1ccncc1)N1CCCCC1,2 Y044-0547,CC(NC(NC1=O)=O)=C1S(N(CCC1)CC1C(NCCC1=CCCCC1)=O)(=O)=O,2 Z1191897063,COCC(CCC1)CN1C(c(cc(cc1)Cl)c1F)=O,0 Z2886172476,CC(C)(C)C(C(N(C)Cc1csnc1OC)=O)C(O)=O,0 F6438-3620,CN(C)c1nc(CNC(Nc(cc2)cc(Cl)c2F)=O)nc(N2CCCC2)n1,0 Z1066848066,Cn1ncc(C(Nc(cc2)cc(C(NC3CC3)=O)c2Cl)=O)c1C(F)F,0 4386-0336,COc(cccc1)c1NC(CCN(C([C@H]1[C@@H]2CC(Cl)=CC1)=O)C2=O)=O,0 Z4912578445,CC(C)(CC1)CCC1(C)NS(c1ccccc1)(=O)=O,0 Z4669071318,NC[C@](C1)(C[C@@H]1NC(C(Cc(cc1)cc(F)c1O)N)=O)c1ccccc1,0 Z2157560444,Cc(cc1)cnc1N(C)C(c(cc1)cc(NC(N2c3ccccc3)=O)c1C2=O)=O,0 S980-0150,C[C@H](CO)n1c(C(CC2)CCN2C(CC2CC2)=O)ncc1C,0 Y042-4742,O=C(C(CC1=O)CN1c(cc1)ccc1S(N1CCOCC1)(=O)=O)NC1CC1,2 Z1343762698,CN1CCC(CN(CCC(N2)=O)C2=O)CC1,2 Z2032298336,O=C(c1cc(Cc2ccccc2)n[nH]1)N(CC1)CCN1C(c1ccccc1)=O,2 SB30-0895,O=C(c1cocc1)N(CC1)CCC1N(C1(CN2)CCOCC1)C2=O,0 S233-1671,Cc1c(C(NC[C@](CCC2)(CC3)[C@@H]2N(CC2CCCCC2)C3=O)=O)sc(C)n1,2 F6439-7345,O=C(c(c(F)ccc1)c1F)NCCn1c2ccnn2cc1,0 Z1892313615,CC(C)NC(c1c(C)ccc(NC(c2c(Cc3ccccc3)n(C)nc2)=O)c1)=O,0 Z1653598991,O=C(CCCc(cc1)cc(N2)c1NC2=O)N(CCN1)C(c(cccc2)c2F)C1=O,2 F6554-0360,CC(C(N(CC1)CCC1c1nn(C)cc1)=O)Oc(ccc(Cl)c1)c1Cl,0 Z26008070,CN(Cc1cc(Cl)ccc1)S(c1cccc(Cl)c1)(=O)=O,0 F6562-8272,O=C(c(cccc1)c1Br)NCC1c(cccc2)c2OC1,0 F6677-0979,CC(C)c1nccn1CC(C1)CN1c(ncnc1)c1F,0 F5860-3005,COc1cc2cccnc2c(NC(C2=CC=CNC2=O)=O)c1,2 F6245-6949,O=C(c1cc(cccc2)c2o1)NCCN1N=C(c2cccs2)N(C2CC2)C1=O,2 S988-1271,Cc1noc([C@@](CN(C2)C3CCOCC3)(C3)[C@@H]2CN3C(c(cc2)ncc2F)=O)n1,2 Z1531800038,COCC(C(N)=O)NC(c1n[nH]c(-c(cccc2)c2Cl)c1)=O,0 F0807-0432,Cc(cc1)ccc1C(CN(Cc1ccccc1)C1=NCCS1)=O,2 F2073-0367,CC(C=CN1C2=O)=CC1=NC(C)=C2NC(COC)=O,0 F1038-0411,O=C(CCC1)C2=C1Nc1ncnn1C2c(cc1)ccc1Br,2 Z4512698945,CC(C1)NCCC1NC(C(Cc1ccccc1)NC(c1cnccc1)=O)=O,2 Z1297380341,CC(c1nc(C(C)(C)C)no1)NC(c(cc1)cnc1C(O)=O)=O,0 Z1244102365,Cn1ncc(C(CC2)CCN2C(NCCc(cc2)cc3c2OCCO3)=O)c1,2 F6443-7642,O=C(c1cc2nsnc2cc1)NCC(CCC1)N1c1ccccc1,2 Z772256156,CCc1ccc(C(Nc(cc2)ccc2-c2cnco2)=O)o1,2 F6111-1302,O=C(c(cc1)cc2c1ncs2)N1CCC(COCc(cc2)ccc2Cl)CC1,2 F6670-4886,COc(cccc1CN2CCC(CN(C=Nc3c4cccc3)C4=O)CC2)c1Cl,0 F2730-0640,CC1Oc(cccc2)c2OC1C(N(CC1)CCN1c(sc1ccc2)nc1c2S(C)(=O)=O)=O,0 Z3357226666,CC([C@H]1OCC[C@H]1C(NS(c1c(C)ccs1)(=O)=O)=O)=C,2 Z1254460033,CS(C(CCC1)CC1NC(NCC1CCCCC1)=O)(=O)=O,0 F6435-9134,COC(CSC(CC1)CN1C(C1(CCCC1)c(cc1)ccc1Cl)=O)=O,2 F6550-4503,O=C(CCc1ccc(C(F)(F)F)cc1)N(C1)CC1Nc1ncccn1,0 S858-2047,CS(N(C1)C[C@@](CO)(C2)[C@H]1CCN2C(Cc1cnccc1)=O)(=O)=O,2 P893-0354,C(C1)C1c1nnc(-c(c2ccccc22)nnc2NC2CCCCC2)o1,2 E734-2486,Cc(ccc(NS(c1ccc(CCN(C(c2c3nccc2)=O)C3=O)cc1)(=O)=O)c1)c1Cl,0 Z1544704149,CCCNC(CN(CC1)CCC1NC(C(CCC1)c2c1cn[nH]2)=O)=O,2 Z2278767156,O=S(c1c2occc2ccc1)(N(C[C@H]1F)C[C@@H]1F)=O,0 Z1623884922,OC(C(CCC1)CC1C(N(CC1)CCC1OC1CCCC1)=O)=O,2 F6262-6439,Cc1c(CNC(c2ncccn2)=O)sc2nc(-c(cc3)ccc3F)cn12,2 Y043-5144,N/1(c2c(C(/C=C1/C)=O)cc(cc2)Cl)CC(N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)=O,2 F2407-0164,COC(c(cc1)ccc1NC(Cn1c(cccc2)c2c(S(c2ccccc2)(=O)=O)c1)=O)=O,2 Z4900394349,CN(CCO)C(CC1)CCN1C([C@H](C1)C[C@H]1C(O)=O)=O,0 F5892-0168,O=C(Cc1cccs1)N(CC1OCCC1)c1nc(ccc(OC(F)(F)F)c2)c2s1,2 Z3091716136,CC(CCCC(Nc(c(O)c1)cc(C(F)(F)F)c1F)=O)=O,0 Z3687059007,CN(C)c1cc(C(N[C@@H](CC(Cn2cncc2)C2)[C@H]2O)=O)ncc1,0 F5103-0006,O=C(COc1cc2ccccc2cc1)NCc1cscc1,2 T634-0044,Cc(cccc1)c1S(N1Cc(cc(CN2CCOCC2)cc2)c2OCC1)(=O)=O,0 F6488-2275,Cn1cnc(S(N(CC2)CC2Oc2nc(OC)cnc2)(=O)=O)c1,2 Z3408774399,CC(CNS(c1nn(C)nc1)(=O)=O)(C1)Cc2c1cccc2,2 Y030-5023,CC(COC)NC(c(cccc1)c1Br)=O,0 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Z2475583572,OC(c(cc1)cc(Cl)c1S(NCCOC1CCC1)(=O)=O)=O,0 SB18-0120,CC(C)CC(N[C@@H](C[C@H]1c2nc(C)n[nH]2)CN1C(c1cn(C)cn1)=O)=O,2 Z1689336064,CCC1(CCCCC1)C(NCc1cc(C)no1)=O,0 F6443-4137,O=C(c1nn(-c2ccccc2)nc1)N(CC1)CCC1(c1c2cccc1)OC2=O,2 F6564-5310,O=C(c1cscc1)N(CC1)CCN1c1nnc(C2CC2)cc1,2 Z757130008,COc(cccc1)c1N(CC(C1)C(NC2CCN(CC3CC3)CC2)=O)C1=O,2 F6438-3275,COc1nc(N2CCCC2)nc(CNC(c2ccc(Cn3cncc3)cc2)=O)n1,2 F6275-0168,O=C(Cc1cccs1)N(CC(F)(F)F)C1CCOCC1,2 F6708-9456,CC(C)(C1)CC1(C1)CN1c1nccn2c1nnc2C,2 Z1170255976,CCC(CC)C(N(CC1)CCC1NC(c(cc1)cc2c1-n1ncnc1NS2(=O)=O)=O)=O,0 M145-0136,O=C(CSc(cc1)nnc1N(CCC1)CC1C(NC1CC1)=O)Nc1ccc(C(F)(F)F)cc1,0 F6574-1827,CC(N=CN1CC(NCc2nccnc2-c2cccs2)=O)=CC1=O,2 Z3174143170,C=CC1(CCCC1)NC(c(ccc(C(O)=O)c1)c1Cl)=O,0 S978-0641,C[C@@H](COc1c(C2)cc(CN(C3CC3)S(C)(=O)=O)cc1)N2C(Cn1cncc1)=O,2 SD07-0867,CCCS(NCc1c(COC(CC2)(CN2C(C2(CC2)c2ccccc2)=O)C2)n2nn1)(=O)=O,0 K284-7253,O=C(c1ccc(CN2C(SCc(cccc3)c3F)=Nc(cccc3)c3C2=O)cc1)NCC1OCCC1,0 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Z3588235124,C[C@](CCC1)(C(N)=O)N1C(CCC(c(cc1)cc(F)c1OC)=O)=O,0 Z2905153977,OC(c1cn(C(CCC2)CN2C(OCC2CC2)=O)nn1)=O,2 SB68-0566,O=C(C1(CC1)c1ccccc1)N[C@@H]1Cn2ncc(C(NCc3ccccc3)=O)c2C1,2 F6727-2178,CN(C(C1)CN1c1nn2c(-c3cnccc3)nnc2cc1)c1nccnc1C#N,2 SA93-0484,Cc1noc(C)c1S(N(CCC1)CC1(CC1CC1)C(N)=O)(=O)=O,2 SA57-0434,Cc1cc(OC2CC(CC3)(CCN3C(C3(CCCC3)c3ccccc3)=O)OCC2)ncc1,2 Z3132129520,CCN(C(C1NCCOc2c1cccc2)=O)c1cn(C)nc1,0 Z1868373224,OC(CN(C1)c2ncnc3c2[nH]cn3)C1O,0 S692-2060,Cc1cnc(COC)n1C(CCC1)CN1C(C1CCOCC1)=O,0 Z1389069103,O=C(c1c[nH]nc1-c(cccc1)c1F)N1CCCC1,2 F6523-0491,Cc1nc(N(CC2)CCN2C(C(Oc2c3cccc2)=CC3=O)=O)cc(C(F)(F)F)n1,2 F6523-0503,Cc1nc(C(F)(F)F)cc(N(CC2)CCN2C(c2cc(-c3cccs3)nn2C)=O)n1,2 SA41-0849,Cc1c(C(N(C2)CC22CN(C)C(COCc3ccccc3)C2)=O)scc1,0 Z1470125623,CC[C@@H](C(O)=O)NC(Cc1cccs1)=O,0 Z3000091676,CC(Cc1ccc2)CN(C(c3ncnc(OC)c3)=O)c1c2F,0 Z2482907581,CCN(CC(C)C)Cc1nc(C(O)=O)cs1,0 Z1228192646,CCN(c1c2cccc1)N=C(C(N(CC1)CCC1n1cncc1)=O)C2=O,2 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F6523-1613,Cc1cc(N(CC2)CCC2NC(c2nccnc2)=O)n[nH]1,2 8015-0150,OC(CC(c(cc1)ccc1Cl)NC(COc(cccc1)c1Cl)=O)=O,0 F6744-5946,Clc1cc2c(NC(CC3)CN3C3CCOCC3)ncnc2cc1,2 F2829-0177,CS(c1ccc(CC(Nc2cccc(Br)c2)=O)cc1)(=O)=O,0 P315-0128,Cc(cc1)ccc1N(CCC1NC(Nc2cccc(Cl)c2)=O)C1=O,0 F6608-3866,CC(C)N1CCN(CC#CCOC(CC2)CCN2c(cc2)nn3c2nnc3C)CC1,2 F5773-3969,COc1cc(CCN(C2)c3nc(ccc(S(C)(=O)=O)c4)c4s3)c2cc1,0 F6194-0295,CC(Cc1ccco1)(CNS(c1cc(CCCC2)c2cc1)(=O)=O)O,2 F6525-4364,COc(cccc1)c1C(NCCn1ncc(-c2ccccc2)c1)=O,0 F6523-4653,O=C(c1cc(-n2nccc2)ccc1)NC(CC1)CCN1c1nnc(CCCC2)c2c1,2 SC88-0496,O=C(CCc1ccccc1)N(C1)CC1(C(CC1)c2nc(C3CCCC3)no2)S1(=O)=O,0 F6436-3453,O=C(c1cc(cccc2)c2s1)NCC(CC1)CCN1C(c1cocc1)=O,2 J093-0089,O=C(c1nn2c(C(F)(F)F)cc(-c(cc3)ccc3F)nc2n1)Nc(cc1)cc2c1OCCO2,0 Z2970700424,CS(N1[C@@H](CNc(cc2)ncc2-c2ccncc2)CCC1)(=O)=O,2 6623-1394,C(CSc1nnc(c(cccc2)c2n2Cc3ccccc3)c2n1)N1CCOCC1,2 L414-1049,CC(C)Oc1ccc(CNC(C(C)SC(C=C2)=NN(c3cc(C)c(C)cc3)C2=O)=O)cc1,2 Z1607002391,Cc(cc1)nc(OC)c1C(N1CCN(CCc2ccccc2)CC1)=O,2 F6387-0093,CC(C)(C(N1CC(c2cnccc2)OCC1)=O)Oc(cc1)ccc1Cl,2 Z2982492167,CCc1c(CS(c2ncccc2F)(=O)=O)c(C)no1,0 SD03-0118,CC(C)C(N1CCC(C2)(CN(CC(NCCCN3CCC(C)CC3)=O)C2c2nc(C)no2)CC1)=O,2 Y205-7969,CCC(C)c(cc1)ccc1S(N(CC1)CCN1C(CCC(O)=O)=O)(=O)=O,0 F6353-3391,Cc(c(NC(C(NCC(c(cc1)cc2c1OCC2)N(C)C)=O)=O)ccc1)c1Cl,0 F6473-4498,O=C(C1C2CC=CC1)N(C(C1)CN1S(N1CCCC1)(=O)=O)C2=O,2 C612-0814,O=C(c1cccnc11)N(Cc2cccs2)C1Nc(ccc(Br)c1)c1F,0 Z2061567274,NC(C(CCC1)(CN1C(C1=CC(CCCC2)=C2NC1=O)=O)O)=O,2 F532-4396,O=C(Nc(cc1)ccc1-c1noc(C2CCC2)n1)N(CC1)Cc2c1cccc2,2 F6439-4585,O=C(NCCn(cc1)nc1-c1ncccc1)NC(c1ccccc1)c1ccccc1,2 F5596-0586,O=C(CSc(cc1)ccc1F)N(CC1)CCC1c1nnc(-c2ccco2)o1,2 F0266-5592,CC(CC1)CCN1C(COc(cc1)ccc1Br)=O,0 Z2863289477,CN(C=Cn1c2nnc1CN(C[C@@H]1CC3)C[C@H]1[C@H]3O)C2=O,2 F6258-1323,O=C(c1cscc1)NCCN(C=NC(C1CC1)=C1)C1=O,2 Z1754147929,Cc1nnc([C@@H](C[C@@H](C2)OC)N2C(C2=Cc(cc(cc3)Cl)c3OC2)=O)o1,0 F6192-0141,O=C(c1cccc(C(F)(F)F)c1)NCC(c1ccco1)c1ccco1,0 M330-0235,Cc1c(C(N2CCCC2)=O)sc(-c2cc(S(NCCCN3CCCC3)(=O)=O)cn2C)n1,2 Z2415381641,CC(C)(CC1c2ccccc2)CN1C(Nc(cc1)cc(C(N)=O)c1F)=O,0 F6561-1982,O=C(c1cocc1)N(C1)CC1OCC1COCC1,0 F5791-0283,Cn(c(C(NC(CCC1)c2c1cccc2)=O)c1)nc1-c1ccccc1,2 8019-5177,Cc1nn2c(-c3ccncc3)cc(-c(cccc3)c3OC)nc2c1-c1ccccc1,2 F6734-1510,O=C(CCN(C=Nc1c2cccc1)C2=O)N(C1)CC(C2)C1CN2c(cc1)ncc1F,2 F6064-3739,CNC(c1cccc(-c2noc(C(C3)CN3C(Cc(cc3)ccc3F)=O)n2)c1)=O,0 Z1324831931,Cc(cccc1)c1-n1ncc(C(NC(CCN2C3CCOCC3)C2=O)=O)c1,2 C604-0242,Cc1c(CSC(N(CCC(NCC2OCCC2)=O)C2=O)=Nc3c2sc2c3cccc2)cccc1,0 F6516-0135,O=C(c(o1)ccc1Br)NCc1ccc(-c2cccs2)o1,2 Z1238989161,CC(C)c1nccc(Oc(cc2)ccc2-n2ncnc2)n1,2 Z1081091346,O=C(CCc1nc(-c2ncccn2)no1)N1CCN(CC2CCCCC2)CC1,2 F5689-1321,CN(C(c1cccs1)=NN1CCNC(C2CC2)=O)C1=O,2 F2271-0043,CN(CCC1)c2c1cc(CCNC(Cc(cc1)ccc1F)=O)cc2,2 Z2448049111,Fc1cc(C2N(CC3CCC3)CCNC2)ccc1,2 8017-8688,OC(C(Cc1c[nH]c2c1cccc2)NS(c(cc1)cc2c1OCCO2)(=O)=O)=O,0 Y200-0401,O=C(c1c(cc(cc2)Cl)c2nc(-c2ccncc2)c1)Nc1nc(CCCC2)c2s1,2 SC42-0146,Cc1nc(CC2CC(CC3)(CCN3C(c3ccc(Cn4cncc4)o3)=O)OCC2)no1,2 F6752-3495,O=C(C1CC1)NC(CCC1)CN1c1ncnc(C2CCC2)c1,2 J005-1129,CCc1c(C(CCC2)N2S(c(cc2)cc(OC)c2OC)(=O)=O)c(C)no1,0 Z4662007658,CN(C1CCC1)C(CCN(C(c(nc[nH]1)c1N1C)=O)C1=O)=O,2 D430-2375,Cc1nc(N2CCOCC2)cc(N(CC2)CCN2C(Nc2cc(OC)cc(OC)c2)=O)n1,0 Z3103509677,CC(C)[C@H](CO)NC(NC(CCOc1c2Cl)c1ccc2Cl)=O,0 F6479-4328,CC(C)(C)OC(N(CCC1)CC1C(N(CC1)CCC1Oc1nc(C)nc(C)c1)=O)=O,2 Z2700045656,N#Cc1ncc(N(CC2)CC2c2ccncc2)nc1,0 SB29-0253,Cc1c(CN(C[C@H](C2)OCc3ccccc3)[C@@H]2c2n[nH]c(C)n2)scn1,2 F6564-2331,CS(N(CC1)CCC1C(NCCN1N=C(C2CC2)C=CC1=O)=O)(=O)=O,2 F6610-1902,C(c1cc(N2CCOCC2)ncc1)Nc1nccnc1,2 F6244-2877,COc(cc1)cc(OC)c1C(NCC#CCN(CC1)Cc2c1cccc2)=O,0 S682-0765,CCC(CC)N(CC1)CCN1C([C@H]1OCCN(C2CCCC2)[C@@H]1c1ccccc1)=O,0 F6619-7738,Cc(cc1)nn1-c(cc1)nnc1N(CC1)CCN1C1=NC=CN(C)C1=O,2 C732-0751,O=C(CN(c(ccc(S(NCc1ccccc1)(=O)=O)c1)c1O1)C1=O)NC1CCCC1,2 F5854-1096,O=C(Nc1cccs1)N(Cc1cscc1)Cc1ncccc1,2 F3290-0304,CCSc1nc(CCCC2)c2c(C(F)(F)F)c1C#N,0 F6725-2677,Cn1ncc(-c2nccc(CNc(ncc(C#N)c3)c3Cl)c2)c1,2 Z383585012,Cc1cc(C)nn1-c(cc1)ncc1NC(c1cnc(C)cc1)=O,0 Z954498840,Cc1c(NC(c2cc(OC)ccc2)=O)[nH]nc1C1CC1,0 F6609-3719,COc1cc(C(OCC(N(CC2)c3c2cccc3)=O)=O)cc(OC)c1OC,2 Z1334656173,O=C(c(nc1-c2cccs2)nn1-c1cc(F)ccc1)N(CCN1C2CC2)CC1=O,2 F6436-2111,OC(CNC(c1cc(Br)cnc1)=O)(C1CC1)c1cccs1,0 V007-1244,CC(C)(C)NC(N(C)CC(N(C(C1)c(cc2)ccc2OC)N=C1c(cccc1)c1Cl)=O)=O,0 Z1404668270,OC(CC(COCC1)N1C(c(cc1)cc2c1OCCCO2)=O)=O,2 L851-1526,Cn(c(CC1)c2CN1C(C1(CC1)c1ccccc1)=O)nc2-c1nc(Cc2ccccc2)no1,2 Y042-4332,CC(C)CCN(CC(C1)C(Nc2nc(ccc(S(C)(=O)=O)c3)c3s2)=O)C1=O,0 P315-0821,Cc1cc(N(CCC2NC(Nc(cc3)ccc3SC)=O)C2=O)cc(C)c1,0 Z1188539240,O=C(c1cc(Cl)nc(N2CCCC2)c1)Nc1cn(CC2OCCC2)nc1,2 G411-0197,O=C(c(cc1)ccc1Br)NC(C(Oc1c2cccc1)=O)=C2NC1CCCC1,2 F6200-3004,Cc1cc(C(NCC(c2cn(C)c3c2cccc3)O)=O)c(C)o1,0 F6125-0146,O=C(C(C1)CN1C(c1nccnc1)=O)NCCc1cccs1,2 Z2368637598,Cn1c(N[C@H]2[C@H](CN)CCC2)nc(N(C)C(N2)=O)c1C2=O,2 F6166-0486,COc(cc1)ccc1-c1cc(N(CC2)CCN2C(c2cc(Br)cnc2)=O)ncn1,2 F6597-0869,Cc1cccnc1OCC1CCN(CC(CC2)CCS2(=O)=O)CC1,0 F6734-0680,COCc1nsc(N(C2)CC(C3)C2CN3c(cc2)ncc2Cl)n1,0 F6744-7761,COc1nc(N(C2)CC2N(CCN2)CC2=O)nc(OC)c1,2 P936-3266,O=C(Nc(cccc1)c1F)N1CC(Cc2nncn2-c2ccccc2)CC1,2 G856-2310,O=C(NC(CC1=O)CN1c(cc1)cc2c1OCCO2)Nc1nc(cccc2)c2s1,2 F5854-0967,CS(N(CC1)CCC1C(N(Cc1cscc1)Cc1ncccc1)=O)(=O)=O,2 F6469-0128,O=C(COc1cc(C(F)(F)F)ccc1)Nc(cccc1)c1-c1cn(ccs2)c2n1,2 C712-1249,O=C(c1cc(COc2c-3cccc2)c3s1)NCCN1CCN(Cc2ccccc2)CC1,2 Z216729248,O=C(CN1N=C(CCCCC2)N2C1=O)NCc(cccc1)c1Cl,2 F6734-0720,O=C(c1nn(CCCO2)c2c1)N(C1)CC(C2)C1CN2c(cc1)ncc1Cl,2 Z1070607828,CCCNC(CN1CC(c2cccc(F)c2)OCC1)=O,0 Z3216020417,CCNC([C@@H](C1)N(Cc(cccc2)c2C(O)=O)Cc2c1cccc2)=O,0 L262-0015,COc(cc1)ccc1-c1cc(N(CC2)CCN2C(Nc(cc2)cc(OC)c2OC)=O)ncn1,0 Z2505232366,Cn(c(OC(F)F)c1)nc1-c1nc(C2(CCC2)c2ccncc2)no1,2 V005-8783,CCN(CC1)CCN1c1c(CN(CC(C)C)Cc(cccc2)c2F)c(C)nn1-c1cc(F)ccc1,0 F6734-1320,Cc1noc(C)c1CCC(N(C1)CC(C2)C1CN2c(cc1)ncc1Br)=O,2 SB75-0130,CC(C)C(N(C[C@@H]1C[C@H](C2)NC(c3nccnc3)=O)C[C@@]12c1nc(C)no1)=O,0 Z1644032571,CCC(C)n(c(C)c1)nc1NC(N(CC1)Cc2c1c(OC)ccc2)=O,0 D473-1971,COc(cc1)ccc1-c1cc(C(NC2CCCC2)=O)nn1C(CC1)CS1(=O)=O,0 F2199-0369,O=C(c1c2cccc1)N(Cc1noc(CN(C=CC=C3)C3=O)n1)C2=O,2 Z1563307572,Cc1ccc(Cc2nc(C(N(CC3)CCN3C(COC)=O)=O)cs2)cc1,0 Z1007577094,O=C(CNC(c1c[nH]nc1-c1ccccc1)=O)Nc1cnccc1,2 E680-0017,COc(cc1)ccc1N(C(c1c2cccn1)Nc(ccc(OC)c1)c1OC)C2=O,0 F5860-1588,COC(CC1)CCN1C(CC(c1ccccc1)c1ccccc1)=O,0 S956-0646,CS(N(CC1)C(COCc2ccccc2)CN1c(cc1)cc(C(F)(F)F)c1C#N)(=O)=O,0 F6803-2493,COc(cn1)cnc1OC1CN(Cc2cncs2)CC1,2 Z2640550132,CCc1nocc1CN(C)C(c(cc1)cc(N2C3CC3)c1NC2=O)=O,2 Z4489738519,OCC(CCc1ccncc1)NC(C(Cc1cc(F)c2)Oc1c2F)=O,2 F401-0021,CC(C)CCN(c(n1-c2c3scc2)nnc1SCc(cc1)ccc1N(CCC1)C1=O)C3=O,2 Z2444366252,FC(C1(CC1)c1nc(-c2cc3cccnc3cc2)no1)F,2 G491-0148,Cc1cccc(NC(C2=CC(C(CC(C3)c4ccccc4)=O)=C3NC2=O)=O)c1C,0 SC15-0536,Cc1noc(C)c1C(N1CCC(CN(CC(COC)C2)C2=O)CC1)=O,2 F6561-2243,O=S(Cc(cc(cc1)F)c1F)(N(C1)CC1OCC1COCC1)=O,0 Z999871422,Oc(nccc1)c1NC(C(c1c2cccc1)=NNC2=O)=O,0 Z1615133005,CC(CN(C)c1cc(C)nc2ccccc12)=C,0 F6786-6159,CC(C)(C)c(cc1)nnc1OCC(CC1)CN1c(ncnc1C)c1F,2 S576-0453,Cc1ccc(CNC(C(CC2)CN2C(C=NN2CCOC)=CC2=O)=O)o1,2 Y041-3205,c12c(\C(=C(/C(O1)=O)\CCC(=O)NCCCn1cncc1)\C)c(cc1c2CCC(O1)(C)C)OC,2 F6560-5172,CC(C)(C)C(NCc1cncc(-c2cn(C)nc2)c1)=O,0 F3406-8297,Cc(cccc1)c1N(C=CN(Cc1nc(-c(cc2)ccc2Br)no1)C1=O)C1=O,0 L285-1291,CC(CC1)CCN1S(c1c(C)ccc(-c(cc2)nnc2N2CCN(C)CC2)c1)(=O)=O,2 SA99-0751,NC(C(CC1CC1)(CC1)CCN1C(CC1)CCN1S(c1cccs1)(=O)=O)=O,2 Z1587499665,Cn1ncc(NS(c2cc(F)cc(Cl)c2)(=O)=O)c1C(O)=O,0 P271-0521,CCc1c(CC)nc2ncc(N(CCC3)CC3C(NC(C)c3cnccc3)=O)cc2n1,2 SC96-1033,O=C(c1nc2ccccc2cc1)N(CC1)CC2(COCC2)N(Cc2ccccc2)C1=O,2 E218-0115,CCN(CCCN(C(C)(Cn1c2cc3c1cco3)C(NC1CCCCC1)=O)C2=O)c1cc(C)ccc1,2 Z1581920836,Cc(ccc(CC(NC(CC1)CS1(=O)=O)=O)c1)c1O,0 Z1205177229,CCC(c1c(CC2)cccc1)N2c(cc1)ncc1C#N,0 C779-0212,CC(c(cc1)cc2c1OCCO2)NC(C(CCC1)CN1C(c1cc(scc2)c2n1C)=O)=O,2 V007-3515,O=S(c(cc1)cc2c1n(CC1OCCC1)c(SCc(ccc(F)c1)c1F)n2)(N1CCOCC1)=O,0 F6436-0292,Cn1cnc(S(NCC2(CCOCC2)c(cccc2)c2OC)(=O)=O)c1,2 F6239-0260,O=C(c(cc1)nnc1-n1nccc1)NCCC1=CCCCC1,2 F5226-0381,O=C(C1CC1)Nc(cc1)ccc1C(NCCNC(c(cccc1)c1Cl)=O)=O,0 D715-0627,CC(C)[C@@H](C(O)=O)NC(COc1cc(C)cc(O2)c1C(CCCC1)=C1C2=O)=O,0 F2496-2977,CC(C)S(c1ccc(CC(OCc2noc(-c(ccc(F)c3)c3F)c2)=O)cc1)(=O)=O,0 Z4008839259,CC(C(C(O)=O)O)NC(C(CCc1ccccc1)Cc1ccccc1)=O,0 F0585-0478,CCCCn1c(cccc2)c2nc1C(C)NC(c(cc1)cc(OC)c1OC)=O,0 F5261-0243,Cn1c(C(CNS(Cc(cccc2)c2Cl)(=O)=O)N2CCOCC2)ccc1,2 Z1149555208,CCn1c(C(CC2)CCN2C(Cc(cc2)ccc2-n2nccc2)=O)nnc1,2 F5096-0011,Cn1c(N2CCN(CC(N(CC3)c4c3cccc4)=O)CC2)ncc1,2 F6489-0536,O=S(Cc1cc(F)cc(F)c1)(N(CC1)CC1Oc1nnccc1)=O,2 Z2600158363,CCN(CCC1N(C)C(C2)CC2O)C1=O,2 F5834-0184,CN(CCOc(cc1)c2cc1NC(C(CC1)CCN1S(C)(=O)=O)=O)C2=O,2 F6262-1839,CCOc1cc(NC(C(c2ccccc2)c2ccccc2)=O)ncn1,2 Z2712840557,CC(C)(CC1)C1NC(c1ccc(C(F)F)o1)=O,0 S230-0905,Cc1noc([C@H](CCN(C2)C(NC3CCCCC3)=O)[C@H]2NC(COC)=O)n1,2 S570-0417,O=C(CCc1c[nH]c2c1cccc2)NCC1(CCC(N2CC3CC3)=O)C2=CCCC1,2 V004-7003,CC(C)CNC(c1csc(COc2cc(C(c(cc3)ccc3F)N(CC3)C(C4CCCC4)=O)c3cc2)n1)=O,2 CM2843-5957,CC(C)n1c(C(CCC2)N2C(c2cc(-c3c(C)ccc(C)c3)n[nH]2)=O)nnc1,2 F5033-5734,CN(C=CC=C1C(N2CCC(CNC(c(cc3OC)cc(OC)c3OC)=O)CC2)=O)C1=O,2 S979-0239,C[C@@H](COc(cc1)c(C2)cc1C(NCCOC)=O)N2C(c1c(C)nc(C)s1)=O,2 F6808-6067,N#CC1(CCN(CCn2nccn2)CC1)c1ccccc1,2 Z1863979823,CN(Cc1cccc(C(F)(F)F)c1)C(c(cn1)ncc1OCc1ccccc1)=O,0 Y502-0777,O=C1N(Cc2ccccc2)C(c(cc2)ccc2F)Nc2c1cccc2,2 S613-1136,O=C(c1cccs1)N(CCC1)C1c1nc(CCOCC2CCOCC2)no1,2 Z4879346522,Cc(ccc(C(N)=O)c1)c1NC(c1n[nH]cc1C1CCNCC1)=O,2 Z1329704710,COc1csc(-c2nc(-c3cc(OCc4cnccc4)ccc3)no2)c1,2 F6246-2891,CC(c(cc1)ccc1S(N(CCC1)CC1C(N1c2ccccc2)=NN(C)C1=O)(=O)=O)=O,2 F6475-6908,CC(C)(C)OC(NCCNC(c(cc1)cnc1OC1CSCC1)=O)=O,0 Z3815164604,CC(C)Cc1noc(-c2ccc(cccc3[N+]([O-])=O)c3n2)n1,0 Z2950567743,Cc1nccc(NC(N(CCC2)C2c(cc2)ccc2O)=O)n1,0 Z1538842566,CC(CC1)CCC1C(NC1C(CO)CCN(Cc2ccccc2)C1)=O,2 Z2953011232,CC(C(NCC1)=O)N1C(Nc1cc(Cl)cnc1)=O,0 F6560-0831,Cn(c(C(NC(C1CCOCC1)c1cccs1)=O)c1)nc1-c1cc(OC)ccc1,2 G433-0435,CN(c(c(N1C)c2)cc(NC(Nc3cccc(C(F)(F)F)c3)=O)c2Oc2ccccc2)C1=O,0 F3074-0033,CCC(Nc(ccc(Br)c1)c1C1=Nc(cccc2)c2NC1=O)=O,0 Z2156232743,CC(C)(Cc1nc(-c(cc2)ccc2Oc2ncccn2)no1)C(F)(F)F,0 SB68-0554,Cc1cn(CCC(N[C@@H]2Cn3ncc(C(NCc4ccccc4)=O)c3C2)=O)nc1,0 Z1286505753,Cc1c(C)sc(CNC(c2c[nH]nn2)=O)n1,0 F5897-0136,O=C(c1c(C(F)(F)F)cccc1)Nc1cccc2ccc(-n3cncc3)nc12,2 F6672-0869,Cc1nc(CN(C(CC2)C3)C2CC3n2ncc(Br)c2)cs1,2 Z5027822741,CN1N=C(Cn2nnc(C(CC3)CCC3=O)c2)NC1=O,2 Z1210297226,Cc1cc(-c2nnc(NC(CN(C=Nc3c4cccc3)C4=O)=O)s2)cc(C)c1,0 8013-5400,Oc(cc1)ccc1N(CC1)CCN1C(CC(N1c(cc2)ccc2Br)=O)C1=O,0 F0920-7713,Cc1c(C(C2)n3ncnc3NC2c(cc2)ccc2Cl)cccc1,0 Z2222019595,CC(C)(C)Nc(cc1)cnc1-c1noc(CC(CCC2)CS2(=O)=O)n1,0 Z3725452084,Cc1cccc(C(N[C@H](CCC2)CN2C(Cc2c(C)nccc2)=O)=O)c1F,2 Z3091747917,CCCCNC(N(C1)CC2(CCOCC2)C1N(C)C)=O,0 Z4480730202,C#Cc1ccc(C(CCC2)N2C(c2cc(Cl)cnc2)=O)cc1,0 F5598-0082,CC(C)(C)NC(N(CC1)CCC1c1nnc(-c(cc2)ccc2F)o1)=O,0 6214-0532,Cc(cc(cc1)Cl)c1OCC(N(Cc(cc1)cc(OC)c1OC)C(CC1)CS1(=O)=O)=O,0 Z2573427191,CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)CC(NCC(O)=O)=O,0 Z1899705073,CC(C)(CNC(c1cn(Cc2noc(C)n2)nn1)=O)c1cccc(Br)c1,0 Z4119272734,O=C(c1nccc(C(F)(F)F)c1)NCCc1csc(-c2ccccc2)n1,2 Z2946895702,O=C([C@H](C1)[C@@H]2[C@H]1CCCC2)NCCCc1nc(cccc2)c2[nH]1,2 Z3063545422,CCOc(cc1)cc2c1OCCC2NC(C(C1(CCC1)O)O)=O,2 S948-0113,CC(C=C(C)N1CC(N(C2)C[C@@](CO)(CC3)[C@H]2CN3c(cc2)cc(C(F)(F)F)c2C#N)=O)=NC1=O,2 T226-1062,CN(c(cc(cc1)C(NCc2ccc(C(F)(F)F)cc2)=O)c1-n1nccc11)C1=O,2 SD01-1300,CCOCCn(c1c2CN(Cc3c(C(F)(F)F)cccc3)CC1)nc2-c1cocn1,2 F6274-0534,O=C(C1(CCOCC1)c1ccccc1)OC(C1)CN1c1nc(cccc2)c2s1,2 Z2277680716,CC(C)(CC#N)CS(N(CC1)CCC1(c(cc1)ccc1Cl)F)(=O)=O,0 F6481-0347,CC(C)(C(N(CC1)CCSC1c1ccccc1)=O)OC(C)=O,0 S632-4986,CS(N(CC1)CCC1C(CC1)CN1C(Cc1ccncc1)=O)(=O)=O,2 Z3077780894,CCc1cc(C)nc(N(C2)CC2(c2cnnn2C)O)n1,0 F6573-2740,O=C(c(cccc1)c1Cl)NCCOCCn1nccc1,0 CM3891-7034,CCCN(C)CC(CC1)(CCC1(CC1)CCN1C(c1cocc1)=O)O,2 F6414-1130,OC(CNC(c1cccc(C(F)(F)F)c1)=O)(CC1)Cc2c1cccc2,0 F6522-1274,CC(C)CS(NCc1cc(-c2cocc2)cs1)(=O)=O,0 SB04-0091,CS(N(CC1)CC1N(CCNC(NCCc1ccccc1)=O)C1CCOCC1)(=O)=O,0 F6743-9910,CS(NC1CN(Cc2nc(CCC3)c3s2)CCC1)(=O)=O,2 Z818978780,COc(cc1)cc(CN(CC2)CCN2C(c2c(C3CC3)oc(-c3ccccc3)n2)=O)c1OC,2 Z741340400,COc(ccc(S(N(CC1)CCN1C(c1cc(C(F)(F)F)ccc1)=O)(=O)=O)c1)c1Cl,0 D503-0473,CC(CC1)CCN1c1cc(C)nc2c(C)c(-c(cc3)ccc3Cl)nn12,0 F6469-1133,O=C(Cc1cccs1)Nc(cccc1)c1-c1csc(-c(cccc2)c2F)n1,2 Z2755354695,OC(C1(COCC1)NC(Cc1cc(Cl)cc(Cl)c1)=O)=O,0 V010-9603,COc1cccc(Cc2nsc(N(CC3)CCN3C(c3ccccc3)c3ccccc3)n2)c1,0 Z3698974132,NC(CCC1)C1(CC1)CCN1C(C(C1)(CC1(F)F)c(cc1)ccc1Cl)=O,2 S613-1273,O=C(NC1CCCCC1)N(CCC1)C1c1nc(CCOCC2CCOCC2)no1,2 F5657-0020,N#Cc1c(COc2cc(C(CC3)=O)c3cc2)cccc1,0 S555-0070,COc1ccc(C2(CC2)C(N2Cc(cc(cc3)N4CCOCC4)c3OCC2)=O)cc1,0 Z2033326314,Cn(nc1)nc1C(NC(C1CCCC1)c(cccc1)c1F)=O,2 E750-0028,COc(cc1)ccc1NC(CC(C(N1c(cc2)ccc2OC)=O)N(C2CCCC2)C1=O)=O,0 Z2375106737,CC(NC(CC1)CN1C(N[C@H](CCC1)c2c1ccc(C)c2)=O)=O,0 F6796-3456,CC(C)(C)c(nc1cc2)cn1nc2OCC(CC1)CN1c(ncc(C#N)c1)c1Cl,2 Z2700919911,Cc1cscc1-c1noc(C(CCN2)(C3CCCC3)C2=O)n1,2 F5470-0347,COc1ccc(C2(CNC(C(Nc(cc(cc3)Cl)c3OC)=O)=O)CCCC2)cc1,0 F6216-0242,Cc1noc(CCCNC(Cc2cc(OC)ccc2)=O)c1,0 Z1560496896,CC(CCC1)(CN1C(c1ccccc1)=O)C(Nc1nc(CN2CCOCC2)ccc1)=O,2 D399-3221,O=C(Nc(cc1)ccc1Cl)N(CCC1)C1c1ccco1,0 Z2440271259,O=C(c1cncc(-c2ccccc2)c1)NCCC1CNCCC1,2 Z1555057262,CCC(C1)OCCN1C(c1noc(C)n1)=O,2 E667-1413,CC(CC(Nc1cc(N(C)C)c(C)cc1)=O)S(c(cc1OC2)c(C)cc1NC2=O)(=O)=O,0 F6788-7449,O=S(Cc1ccccc1)(N1CC(CN(C2)c3nc(C4CC4)ncc3)C2C1)=O,2 Z2479287177,Cc(nc1c(F)cccc1c1)c1C(NC1CCN(CC2COCC2)CC1)=O,2 Z2961799808,Cc1nonc1CC(NCCc1cccc(Br)c1C)=O,0 Z1037882230,Cc1cccc(NC(C(CC2)N(C(C(CC3)CCN3c3ncccn3)=O)c3c2cccc3)=O)c1,0 F042-1256,O=C(Cc1csc(NC(NC2CCCCC2)=O)n1)NCC1CCCCC1,2 Y041-1238,n1c(scc1CC(NCC1(CC(=O)O)CCCCC1)=O)c1ccc(cc1)F,0 F6436-1961,COc(ccc(C(N(CCc1cccs1)C1CC1)=O)c1)c1F,0 Z2755999589,OC(CC(c1ccncc1)NC(C1Oc(cccc2)c2OC1)=O)=O,2 Z2911448936,Cc(n(CCOC)nc1)c1C(N(CC1)C(C(O)=O)c2c1occ2)=O,0 Z2460755430,Cn1nccc1C(CC1)CCN1C(CC(CC1)CCC1C(O)=O)=O,2 Z2911507668,C[C@@H](CN(C1)C(c2cccc3c2ncs3)=O)[C@@]1(C)C(O)=O,0 Z2155282082,CC(C)(CN(C1)C(C)=O)Oc2c1cccc2,0 Z1899868011,CCn1ncc2c1N=CN(CC(N(CCC1)CC1NC(C)=O)=O)C2=O,2 SB24-0475,Cc1cc(C(N(CC2)CCC2(CC2)C2n2nnc(C(N3CCOCC3)=O)c2)=O)no1,2 Y041-0987,OC(CC1)(CCN1C(CN1N=C(CCCCC2)C2=CC1=O)=O)c(cc1)ccc1Cl,2 Z2961754196,C[C@@H](c(cc1)c(C)cc1F)NC([C@H]1[C@H](c2nccn2C)OCC1)=O,0 C430-5115,O=C(c(cccc1CN2C3CCCCC3)c1C2=O)Nc(ccc(F)c1)c1F,0 F6454-0132,CCSc(cccc1)c1C(NCC(CC1)CCN1c1cnccc1)=O,0 SB04-0139,Cc1nn(CC(N(C)CCN(C(CC2)CN2S(C)(=O)=O)C2CCOCC2)=O)cc1,0 F1757-0129,OC(CN(CC1)CCN1c1ccccc1)COc(cc1)ccc1C(c1ccccc1)=O,2 Y020-9118,CCCNC(C1=CC(C(CC(C)C2)=O)=C2NC1=O)=O,0 F2261-0197,CCN(c(ccc(NC(COc(ccc(Cl)c1)c1Cl)=O)c1)c1OCC1(C)C)C1=O,2 Z2951429507,NS(CC1N(CC(N=C2SC=CN22)=CC2=O)CCCC1)(=O)=O,0 Z2458330721,O=C(CSc1nnc2n1cccc2)N(CCCC1)C1C1CCC1,2 SC60-0334,CC(C)(CN(C(C1)C(N2c(cc3)ccc3F)=O)C2=O)CN1C(Cc1c(C)onc1C)=O,2 Z1529867917,OCC(CC1)CN1C(COc(cc1)cc2c1oc1c2CCCC1)=O,0 K284-4077,O=C(CCCN(C(c(cc(cc1)Br)c1N1)=O)C1=S)NC1CCCCCC1,2 F6610-1905,N#Cc1cccnc1NCc1cc(N2CCOCC2)ncc1,2 F5033-2036,O=C(Cc1cccs1)NCC(CC1)CCN1c1ncccc1,2 5429-0164,Cc(cc1)ccc1S(Nc1c(C(NC2CCCCC2)=O)c(CCCC2)c2s1)(=O)=O,2 SA73-0708,COCc1nc(C(CC2CC2)(CC2)CCN2C(Nc(cc2)ccc2OC)=O)no1,0 Z3402993422,COCC1(CCC1)S(N(CCC1)C1c1cnccc1)(=O)=O,2 Z2605554854,CC1(C)C(CN(C)CC(Nc(c(Cl)ccc2)c2Cl)=O)C1,0 F6562-2553,O=C(Cn1nnc2c1cccc2)NCc1cc(N(CCC2)C2=O)ncc1,2 F6750-6445,Cn1ncc(-c2cncc(N(CC3)CCN3c3nc(CCOC)ns3)n2)c1,2 F6560-8774,O=C(N(CCN1)C1=O)N(C(CC1)C2)C1CC2=C1CC1,2 Z2273357861,CC1(C)OCCC1Nc(cc1)nn2c1nnc2,0 F6374-0108,COc(ccc(CC(N1CCC(CSc2ncccc2)CC1)=O)c1)c1OC,0 F6481-3111,O=C(c1nc(cccc2)c2s1)N(CC1)CCSC1c(cc(cc1)F)c1F,2 Z875592046,CN(CCCOC)C(c1cccnc1Oc(cc1)ccc1Br)=O,0 F5040-0281,O=C(c1c(C(F)(F)F)cccc1)N(CC1)CCN1c(cc1)nnc1-c1ncccc1,0 S428-0350,Cc1noc(C)c1Cc1ccc(C(N(CC2)CC2c2nc(C3CCOCC3)no2)=O)o1,2 Z1269640275,CC(C)CCC(NC(CCC(N1)=O)C1=O)=O,0 T599-3163,CC(C(N1c(cccc2)c2N(C)CCC1)=O)c1ccccc1,0 Z3049787197,CCc(nc1)ncc1NC(Cn1nc(C(F)(F)F)c2c1CCC2)=O,2 Z1478667170,CCC(N(CC1)CC1C(Nc1cccc(C(N)=O)n1)=O)=O,2 Z2310179611,CCCc1ncc(CNC(N(CC2)CC(C)(C)CC2O)=O)o1,2 SD07-0892,CCn1nccc1C(NCc1c(COC(CC2)(CN2S(C2CC2)(=O)=O)C2)n2nn1)=O,2 F6437-0133,Cc1nsc(C(N(CC2)CCN2c2cc(C(F)(F)F)ccc2)=O)n1,0 SC10-0949,CCn1nc(C)c(CN(CC2)CC2N(CCCN2CCCC2)S(C)(=O)=O)c1C,2 F6490-0302,COc1c(CC(N(CCC2)CC2Oc2nnccc2)=O)cccc1,2 F6000-0123,O=C(CCCNC(c(c(F)ccc1)c1F)=O)Nc1cccc2cccnc12,0 Z2960185275,O=C([C@H](CC1)CC[C@@H]1Nc1nccnc1)Nc1nccc2ccccc12,2 S787-0021,NC(CCc1ccc(CC(CC2)CCN2C(C2Oc(cccc3)c3OC2)=O)cc1)=O,0 F6556-1496,O=C(NCC1(CCSCC1)N1CCOCC1)Nc(cc1)cc2c1OCO2,2 Z3213528898,CN(CC1(CN(Cc2ccccc2)CC1)O)C(CC1(CC(O)=O)CC1)=O,2 F6471-3802,O=C(CN(C=Nc1c2cccc1)C2=O)N(C1)CC1Oc1nccs1,2 Z1762709579,Cc1cc(C(N2CC(CN(C)CC(O)=O)OCC2)=O)c(C)cc1,0 8017-8112,O=C(C(C(CCC1)N1C1(c(cc(cc2)F)c2N2)C2=O)C1C1=O)N1c1cccc(Br)c1,0 Z1445387073,OC(C(CCCC1)N1C(c1cc(NC(c2nccnc2)=O)ccc1)=O)=O,2 Y200-1721,O=C(c1cc(-c(cc2)cc3c2OCCO3)nc2ccccc12)n1nccc1,2 L123-0601,CC(C)OCCCNC(c(cc1)ccc1-n1c(-c(cc2)ccc2F)cc2c1CCCCC2)=O,0 Z2300966804,CC(C)(CC(O)=O)NS(c(ccc1ccccc11)c1F)(=O)=O,0 Z3899448358,O=C(c1cc([nH]cc2)c2cc1)N(C1)CC1(C1)C1C(F)(F)F,2 SB46-0706,CCCNC(N(C[C@H](C[C@H](C1)C(NCCN(CC)c2ccccc2)=O)[C@H]1N1)CC1=O)=O,0 Z1426068992,CC(C1CCOCC1)NS(c1ccc(C(C)(C)C)cc1)(=O)=O,0 Z3074709745,CC[C@H](CO)NS(c(cc1C(F)(F)F)cnc1NCC)(=O)=O,0 G895-0872,Cc1c(C(Nc2c(C)ccc(C)c2)=O)sc2nc(C)nc(N3CCCC3)c12,2 F6356-1121,CC(Cc(cc1)cc2c1OCC2)NC(c1noc2c1CCCC2)=O,2 F6612-0073,Cc1noc(C)c1S(N1c2nc(N3CCOCC3)ncc2CCC1)(=O)=O,2 Z2445972799,CCC(CCC1C(O)=O)N1S(c1cc(C#N)ccc1)(=O)=O,0 F5788-1228,Cc1nc2ccccc2c(NC(CN(CCN2c(cccc3)c3F)C2=O)=O)c1,2 F6372-2372,O=C(c(cccc1)c1Br)Nc1c(Cc2nc(-c3cccs3)no2)cccc1,0 F6557-0461,CN(C)S(N(CCC1c2cccs2)CCS1(=O)=O)(=O)=O,0 D754-0140,O=C(Cc(cc1)cc2c1OCC2)NC[C@@H](CN(Cc1c2cccc1)C2=O)c1ccccc1,2 F2024-0161,CSc(cccc1)c1NC(NC(CC1=O)CN1c1ccccc1)=O,0 J047-0025,Cn1c(SCC(N(CC2)c3c2cccc3)=O)nnc1-c1cc(cccc2)c2o1,0 F6451-0537,Cc1ccc(C(CNC(c2ccco2)=O)OC)s1,0 S971-0542,OC(CC1)C1(CC1)CCN1C(CCCc1nc(cccc2)c2s1)=O,2 Z2965497006,Cn1ncc(-c2c(NC(CC(C3)CC3(F)F)=O)n(CCCC3)c3n2)c1,2 F6496-3925,O=C(CN(C(CC1)=O)C1=O)N1CCC(CN(C(C=C2)=O)N=C2c(cc2)ccc2F)CC1,2 Z1032700360,CCc1nc(CCNC(N(CC2)CCC2c2nccs2)=O)cs1,2 S647-0293,CC(C)N(CC1(CC2)CCN2S(c2cn(C)cn2)(=O)=O)C1c1ccccc1,2 F5788-0056,O=C(CN(CCN1c2ccccc2)C1=O)N1CCC(Cc2ccccc2)CC1,2 F6518-4520,O=C(NCc1cccs1)N(CC1)CC1c(cc1)cc2c1OCO2,2 Z2908019753,O=C(CCCN(C(NN1)=O)C1=O)N(CC1)Cc2c1ccc(Br)c2,2 Z1439278329,NC(CCc(cc1)ccc1Nc(ncnc1)c1Br)=O,0 F6519-7319,Cc1cc(C)nn1C(CNC(c(ccc(F)c1)c1Cl)=O)c1cscc1,0 Z1260588443,CC(C)n1ncc(S(Nc(cc2)cc(C(O)=O)c2Cl)(=O)=O)c1,0 Z1916077078,CC(C)C(N(CC1)CCC1NC(c1n[nH]c(cc2)c1cc2Cl)=O)=O,0 F115-0326,COCc1nc2cccnc2n1C(CC1)CCN1S(c1ccccc1)(=O)=O,0 F6482-1843,CCS(C(C1)CN1C(c1c(C)n(C)nc1C)=O)(=O)=O,0 F3407-2463,Cc(ccc(Cl)c1)c1N(CC1)CCN1C(CC(N1)=Nc(cccc2)c2S1(=O)=O)=O,0 F6786-6513,Cc1cc(C(N2CC(COc(cc3)nnc3-c3cccc(F)c3)CC2)=O)nn1C,2 S694-2200,Cc1cc(C(N(CC2)CC2n2c(COC)ncc2C)=O)c(C)n1CCOC,0 F6560-0774,O=C(c1cc2c(-c3ccccc3)onc2cc1)NC(C1CCOCC1)c1cccs1,2 L872-0154,O=C1NC(SCc2cc(C(F)(F)F)ccc2)=NC2=C1CN(Cc1ccccc1)CC2,0 Y031-4467,O=C(C(CC1)CCN1C(c1ccco1)=O)Nc1nnc(COc(cc2)ccc2Cl)s1,2 Z2973913294,Cc1cc(CNC(N2C[C@H](CC3)[C@H]3C2)=O)cc(N2CCCC2)n1,2 E793-3714,OC(C1CCC(CN(C2=O)C(SCC(NCCc(cc3)ccc3Cl)=O)=Nc3c2scc3)CC1)=O,2 F6752-2982,O=S(C1CC1)(N1CCN(CCCc2ccccc2)CCC1)=O,2 Z2899140876,CC1(C)N(Cc2nc(C(O)=O)co2)CCC1c(cc1)ccc1Cl,0 Z1623399808,O=C(NCc(cccc1)c1N1CCCCC1)N(CC1)CCC1N(CCCN1)C1=O,2 Z1983706123,CC(CNc1ncnc2c1[nH]cn2)(c(cccc1)c1Br)O,0 F5791-3575,Cn1nnc(C(Nc(cc2)cc(C3)c2-c2c3cccc2)=O)c1,2 V006-8826,CC(C)CN(CC(Cc1ccccc1)O)CC(N1)=Nc(scc2-c3c(C)ccc(C)c3)c2C1=O,0 F6471-6873,Cc1cccc(NC(NC(CC2)CN2C2CCOCC2)=O)c1,2 S217-0277,CC(C)C(N(CC1)CCC11N(C)Cc(cccc2)c2-n2c1ncc2)=O,2 F6517-4878,OC(CNC(c1cnc(C(F)(F)F)cc1)=O)c(cc1)ccc1-c1cscc1,2 Y041-5722,Cc(c1c2)coc1c(C)c(O1)c2C(C)=C(CC(NCC2CCOCC2)=O)C1=O,2 F0688-0078,Cc(cc1)ccc1S(NCC(c1cnccc1)N(CC1)CCN1c(cccc1)c1OC)(=O)=O,0 F0365-0024,O=C(COC(c(cc1)ccc1S(N1CCCCC1)(=O)=O)=O)c(cc1)ccc1Cl,2 8018-6577,C(c1csc(-c2ccccc2)n1)Oc(cc1)cc2c1oc1c2CCCC1,2 E852-0209,CC(C)Oc1ccc(CNC(c2nn(CC(C)(C(NC3CCCC3)=O)N(C)C3=O)c3c2)=O)cc1,0 Z981087856,Cc1cc(C(Nc2c(CN(CCC3)CC3C(N)=O)cccc2)=O)nn1-c1ccccc1,0 D154-0034,CCOc(cc1)cc(C(CN(CC2)CC(C)N2c2cc(C)ccc2)=C2)c1OC2=O,0 F0696-3025,CCOc(cccc1)c1NC(C(C(N1Cc(cccc2)c2Cl)=O)=CNC1=O)=O,0 S997-1241,Cc(occ1)c1C(N1C[C@@H](CN(C2)S(C)(=O)=O)[C@]2(COC)CC1)=O,0 F6525-1495,CN(C)S(NCCn(cc1)nc1-c1nccnc1)(=O)=O,0 Z2963433737,CC(C(NC1(COC1)c(cccc1)c1F)=O)c1ccc(C)o1,0 F6435-3545,COc(ccc(F)c1)c1S(N(CC1)CC1(C1)Oc(cccc2)c2C1=O)(=O)=O,0 F2743-2073,COc(ccc(Cl)c1)c1NC(C1=CC=CN(Cc2ccc(C(F)(F)F)cc2)C1=O)=O,0 F6525-0561,O=C(c(cc1)cc2c1ncs2)N1Cc2c(CCC3)c3nn2CC1,2 S352-0081,O=C(c1ccco1)N(CC1)CCN1C(c1c(COC(C2)c3ccccc3)n2nn1)=O,0 F2158-1073,OC(C1CCN(Cc2nc(cccc3)c3[nH]2)CC1)=O,0 F6525-4805,CCOC(NCCn1nc(C)c(-c2ccccc2)c1C)=O,0 F6660-2902,CCOC(c([nH]c(cc1OC)c2cc1OC)c2N)=O,0 S985-0057,CN(C[C@H]1CN(C2)C(CCc3cc(N4CCOCC4)ncc3)=O)C[C@@]12C(N1CCCC1)=O,2 F2744-1262,Cc1cccnc1NC(C(C=C1)=CN(Cc2cccc(C(F)(F)F)c2)C1=O)=O,0 F6754-9825,CC(N(CC1)CCN1c1nc(ccc(Cl)c2)c2o1)=O,0 Z271143586,CC(C)NC(c1ccc(C(O)=O)s1)=O,0 C386-0455,CC1N=C(c2ccccc2)c(cc(cc2)Cl)c2N(CC(Nc(cc2)cc(OC)c2OC)=O)C1=O,0 G804-0055,Cc(cc(cc1)NC(c2ncccc22)N(Cc(cc3)ccc3F)C2=O)c1Br,0 F6435-9448,CCc(s1)ccc1S(N(CC1)CC1SCC(OC)=O)(=O)=O,0 Z73239323,CC(CC1)CCN1C(Cn1nnc2c1cccc2)=O,0 SD12-1025,Cc1ccc(CN(CCN2Cc3ccccc3)C(Cc3nc(C)no3)C2=O)s1,2 V006-2500,CC(C(c1c(C)[nH]c(C(OC)=O)c1C)=O)N(CC1CC1)C(C1CCCC1)=O,2 Z1654923312,O=C(c1c(-c(cc2)cc3c2OCO3)[nH]nc1)N(CCC1)CC1c1nnc2n1cccc2,2 Z2174790655,NS(c1cc(C(Nc(cccc2N3)c2OCC3=O)=O)cs1)(=O)=O,2 C614-0518,Cc1cc(NC(c(cccc2)c2C2=O)N2c2nccc(C)c2)c(C)cc1,0 F6188-1028,Cc(n(C)nc1C)c1S(NCC1(CCOCC1)Sc1ccccc1)(=O)=O,2 Z2378677902,O=C(C1C2C1CCC2)Nc1ncc(C2CCNCC2)s1,2 F6200-3070,Cn1c(cccc2)c2c(C(CNC(c(c(F)ccc2)c2Cl)=O)O)c1,0 Z1509487170,Cn1c(N)nc2c1ccc(C(OC)=O)c2,0 F899-1633,O=C(C(CCC1)CN1S(c1c[nH]c(C(N2CCCCCC2)=O)c1)(=O)=O)N1CCCCCC1,2 E522-0079,CC(Cn(c1c2)c3c2ccc(OC)c3)(C(NCC2OCCC2)=O)N(Cc2cccs2)C1=O,2 F6571-2877,COc1c(C2(CC2)C(NCC2(CCSCC2)OCCO)=O)cccc1,2 Z2959105188,OCCC1(COCC1)NC(c1c(C(F)F)scc1)=O,2 Z3510605165,C[C@@H](C[C@H](CC1)N)N1C(c1ccc(NC(Nc2ccccc2)=O)s1)=O,2 F5265-0474,COc(ccc(Cl)c1)c1S(NCCN(CC1)CCN1c(cccc1)c1F)(=O)=O,0 F5860-4079,COC(C(CC(C1)C2)(CC1C1)CC12NC(c1cc(-n2nnnc2)ccc1)=O)=O,2 F6808-6048,N#CC1(CCN(CC(NCc2ccco2)=O)CC1)c1ccccc1,2 8017-3431,CC(C1)N(C(c(cc2)ccc2N(C(C2C3CCCC2)=O)C3=O)=O)c2c1cccc2,2 SC66-0065,Cc(ccc(F)c1)c1S(N(C1)CC2(CCOCC2)C1c1nncn1C)(=O)=O,0 F6550-6351,O=C(C(CC1)Oc2c1cccc2)N(C1)CC1Nc1nnccc1,2 Z219187968,Cc1ccc(CN(C)c(cc2)ncc2C#N)cc1,0 SC66-0479,O=C(NC1CCCC1)N(C1)CC2(CCOCC2)C1c1nncn1C1CC1,2 Z2312238463,CN(C)C(CC(CC1)CCN1C1CN(Cc2ccccc2)CC1)=O,2 F6554-6050,COC(C(C1)C1(CC1)CCN1C(c1cc(ccc(OC)c2)c2[nH]1)=O)=O,0 F6476-6123,Cc1c(CCC(N(CC2)CC2Oc(ccnc2)c2Cl)=O)c(C)n[nH]1,2 F3385-4546,O=C(C1Oc(cccc2)c2OC1)N(CC1)CCN1C(c1cc(cccc2)c2o1)=O,2 Z2465930852,CCn1c(C(CCC2)CN2c2cc(C(C)(C)C)nc(C(O)=O)n2)nnc1,0 F377-0539,CC(CC1)CCC1NC(C(CCC1)CN1c1ccc(cc(cc2)S(N3CCCCC3)(=O)=O)c2n1)=O,2 5593-0543,COc1ccc(CCNC(CC(N2c(cc3)ccc3Br)=O)C2=O)cc1,0 F6608-3934,CC(C)N1CCN(CC#CCOC(CC2)CCN2C(CC2)C2O)CC1,2 Z3396339411,O=C(C(C1)CN(Cc2ccco2)C1=O)NCCC(C1)c(cccc2)c2N1c1ncnc2c1cn[nH]2,2 Z1784453564,CC(C)(Cc(cc1)ccc1OC)NC(C(CC1)CCC1(C(N1)=O)NC1=O)=O,2 F6573-6999,O=C(c1cscn1)N(CCN1c2ncccc2)CC1=O,2 F6439-5415,Cc1nn(cc(cn2)NC(Cc3cc(C)ccc3)=O)c2c1,0 F3398-0261,Cc(cc1)c(C)cc1-c1ccnc(SCC(Nc2cc(OC)cc(OC)c2)=O)n1,0 F3250-0639,COC(c1cc(-c(ccc(Cl)c2)c2Cl)n[nH]1)=O,0 Z2230016365,CC(C)(c(cccc1)c1F)NC(c1cnco1)=O,0 F6510-2762,CN(c(ccc(NC(c1cnc(C(F)(F)F)cc1)=O)c1)c1N1C)S1(=O)=O,0 Z3607999563,COC(C(CC1(CCCC1)C1)N1C(c1ccnc2nccnc12)=O)=O,2 F6560-1385,Cc(n(-c1ccccc1)nc1)c1C(N(C1)CC1Oc1cc(C)nc2ncnn12)=O,2 F6608-0637,CN(C(CC1)C2)C1CC2Oc(c(F)c1)ncc1Cl,0 V013-2606,CC(C)CC(Nc(cc1)cc(CN(CC2OCCC2)C(C(C)(C)C)=O)c1N(C)C)=O,0 Z1101591957,CC(C)C(CC(N(CC1)Cc2c1scc2)=O)c1ccccc1,0 F6089-9728,O=C(NCC1OCCC1)NCC1(CCOCC1)c(cc1)ccc1F,2 V015-2121,O=C(C1(CCCC1)c(cc1)ccc1Cl)N(CC1)CCC1c1nc(-c2ccc(C(F)(F)F)cc2)no1,2 Z2987483268,O=C(Cc(cc1)ccc1NC(C1CC1)=O)Nc1noc2c1CCCC2,2 F6439-8139,O=C(Cc(cccc1)c1Cl)NCCn1c2cc(-c3ccco3)nn2cc1,2 Z2960233071,Cc1c(CNC([C@H](C2)[C@H](C(F)F)Oc3c2cccc3)=O)cnc(C)c1,0 F3314-0270,COc(cc1)cc(COCC(CN(CC2)Cc3c2cccc3)O)c1OC,0 Z452397412,Cc1ccc(CNC(c2cccc(CNC(c3cccc(CN(C(CN4)=O)C4=O)c3)=O)c2)=O)cc1,2 Z1603753730,OC(c1cccc(C(NCCCc2cccc(F)c2)=O)n1)=O,0 F6554-9031,O=C(N(CC1C2)C2CS1(=O)=O)OCc1ccccc1,2 F6513-5833,O=C(NCc1c(CCCC2)n2nc1)Nc(cccc1)c1Cl,2 Z56676466,CC(c(cc1)ccc1S(NC(Cc(cc1)ccc1Br)=O)(=O)=O)=O,0 E021-0200,CCOc1c(CN(C(C)(Cn2c3cc4c2ccs4)C(NC2CCC(C)CC2)=O)C3=O)cccc1,2 F5330-0012,O=C(CCc1csc2nc(-c3ccccc3)cn12)N(CC1)CCN1c(cccc1)c1F,2 Z133640382,Cc1cc(S(N[C@@H](CC(N)=O)C(O)=O)(=O)=O)c(C)s1,0 A0061302,CC(CCC1)C(C)C1NC(c(cc1)cc(NC(N2C3CCCCC3)=S)c1C2=O)=O,0 Z2128840442,O=C(C(N1C(CCC2)C2CC1)=O)NC1CCC2(CC2)CC1,2 SA24-0276,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1cccn1C)=O,2 F3300-0093,CC(Nc(cc1)ccc1C(CC1c(cc2)cc3c2OCO3)=NN1C(C)=O)=O,2 F6520-0952,O=C(C(Nc(cc1)cc(Cl)c1F)=O)NCCc1ccc(-c2ccco2)s1,0 F0001-2421,CC(C(O)=O)c(cc1)cc(C2)c1Sc(cccc1)c1C2=O,2 8009-2659,CCCn1c2nc(SCC(N(CCC3)c4c3cccc4)=O)nnc2c2c1cccc2,0 F5854-3813,Cn1c(CN(C2CC2)C(COc(cccc2)c2F)=O)ccc1,0 S776-0035,Cc1cnc(C2CC2)n1CCC(CC1)CCN1C(c1cocc1)=O,2 SB75-0151,CC(C)C(N(C[C@@H]1C[C@H](C2)NC(CCn3ncc(C)c3)=O)C[C@@]12c1nc(C)no1)=O,2 Z2069483115,NC(N(CCC1)CCN1C(c1cscc1Br)=O)=O,0 SC10-0356,Cc1c(C(N(CC2)CC2N(CCCN2CCOCC2)C(C2CCC2)=O)=O)ocn1,2 F2318-0479,Cc1cc(C)nn1-c(cc1)nnc1N(CC1)CCN1C(Cc1cccs1)=O,2 F6560-7584,O=C(CN1N=CC=CC1=O)NCc(cc1)cnc1-c1cocc1,2 F1016-0429,COc(cc1)cc(OC)c1NC(CSc1ncccn1)=O,0 J006-1130,Cc1nn(C)cc1CN(CCCCC1)C1c1cccs1,0 F6497-1933,Cc1cc(C(N2CC(Cc3nc(-c4cscc4)no3)CCC2)=O)c(C)o1,2 Z1961256821,OCC(CNC(C(CCC1)N1c1ccccc1)=O)C1COCC1,2 F0594-0034,CCOC(N(CC1)CCN1C(CSc1nnc(-c2c(C)cccc2)o1)=O)=O,2 Z1169854482,CCc(cccc1)c1OCc1nc(CC(NC2CCCCC2)=O)no1,0 K261-2072,CCC(C)NC(CN(c(cccc1)c1S(N1c2ccc(CC)cc2)(=O)=O)C1=O)=O,0 F3375-3059,COCc1c(-c2nnc(Cc3ccccc3)o2)nnn1-c1cccc(C(F)(F)F)c1,0 F6549-5297,CCSc(cccc1)c1C(N(CC1)CCC1c1cncn1C)=O,0 T655-0582,O=S(c(cc1)ccc1F)(N(C1)CC2(CCOCC2)C1c1nnc(-c2ccncc2)o1)=O,0 Z2952094845,CC(CNC(c1cn(-c(cc2)ccc2OC)nn1)=O)c(cccc1)c1OC,0 T955-1163,Cc(cc1)c(C)cc1NC(N(CCC1)CC1c1nc(CCOCC2CCOCC2)no1)=O,0 SC02-0383,COCCC(CC1)(CN1S(C1CC1)(=O)=O)NS(c1ccccc1)(=O)=O,2 E216-0297,CC(C1)Oc(ccc(Cl)c2)c2N1C(N(CC1)CCC1C(Nc(cc1)ccc1C(C)=O)=O)=O,0 Z3673272502,CCC(C)(C)C(N=S(C)(c1c(CN(CC2)C(c3cnc[nH]3)=O)n2nc1)=O)=O,2 Z2228165031,CCCc1noc2nc(-c3ccco3)cc(C(Nc3c(C)c(-c4ncco4)ccc3)=O)c12,2 Z1214357083,CC(CC(C1)c2ccccc2)N1C(Cc1c(C)[nH]nc1C)=O,0 Y042-7854,N1(C(Nc2c(C1=O)cccc2)=O)[C@@H](Cc1c[nH]c2c1cccc2)C(=O)O,2 T501-0468,CC(C)n1c(CC(CCC2)CN2C(C2(CC2)c(cc2)ccc2OC)=O)nnc1,2 F6178-5065,O=C(NCC(CC1)CCN1c1nccnc1)NC(c1ccccc1)c1ccccc1,2 Z2439087514,CC(C)C(C1(CNC(CC(C)(C)N)=O)CC1)O,0 F0016-1481,O=C(c1c(C(Nc2ccccc2)=O)nc[nH]1)Nc1ccccc1,2 F6608-0578,CN(CC1)CC1Oc(c(F)c1)ncc1Br,0 F6204-2708,O=C(Cc1cscc1)NC1(CCOCC1)c1cccs1,2 F6475-2828,COCCOc1nccc(C(N(CC2)CCN2S(C)(=O)=O)=O)c1,0 Y043-7591,O=C(c1cccc(NC(NC(CC2)CS2(=O)=O)=O)c1)NC1CC1,2 F5857-0608,COc1ccc(CCS(NCC(C2CC2)(c2ccco2)O)(=O)=O)cc1,2 4180-1502,Cn1c(Sc2ncnn2CC(NC2CCCCC2)=O)nc(N(C)C(N2C)=O)c1C2=O,2 E944-0271,CC1N(CCCNc2c(c(C)no3)c3ncn2)C(C)CCC1,2 G869-1222,Cc(cc1)ccc1S(Nc(cc1)ccc1Nc1nc(N2CCCC2)cc(C)n1)(=O)=O,0 F6296-1284,Cn(c(CNC(CSc(cc1)ccc1F)=O)c1)nc1-c1ncccc1,2 T159-1457,Cc1cnc(CC(CCC2)CN2C(N(C)C)=O)n1Cc(cc1)ccc1F,0 F6444-1803,Cc1noc(C)c1CCC(N(CC(C1)Oc(cccc2)c2F)C1C(OC)=O)=O,2 S049-0398,Cc1noc(C)c1S(N(CC1)CC1Oc(cc1)ccc1-c1noc(C2CC2)n1)(=O)=O,2 Z1464666225,CC(C(Nc(cc1)cc(nc2)c1n2-c1ccccc1)=O)NC(C1CCC1)=O,2 Z2242045651,OC([C@@H](C1)[C@H]1c(cccc1)c1Br)=O,0 F6520-1193,O=C(C1(CCOCC1)c1ccccc1)NCCc1ccc(-c2cscc2)s1,2 F6438-1831,Cc1cc(CNC(COc(cc2)nnc2-n2nccc2)=O)nc(N(C)C)n1,2 Z804661734,Cc1cc(N(CCC2C(N(CC3)CCN3C3CCCC3)=O)C2=O)cc(C)c1,2 F6517-0507,OC(CNC(NCc1cccc2ccccc12)=O)c1ccc(-c2ccco2)o1,2 Z2949512609,NC(C1(CCN(Cc2cnc(-c3ccccc3)o2)CC1)O)=O,0 Z1970683243,CC(N1CCC(CNC(Nc(cccc2)c2-c2csc(C)n2)=O)CC1)=O,2 F3382-7252,COc(cc1)ccc1S(Cc1nc(-c(cccc2)c2Br)no1)(=O)=O,0 Z3083106288,CC(C)c1cc(CN)cc(Br)c1,0 Z2954812517,CN(Cc1nccnc1)C(Cc1cccc(C(F)(F)F)n1)=O,2 Z2655500562,O=C(NCCOc(ccc(F)c1)c1F)N1CC(CC2CC2)C1,2 F6805-5592,CN(C(CC1)CCN1c1ncnc2c1cn[nH]2)c(nc1)ncc1Cl,2 8012-4168,Clc1c(CSc2nnc(COc3ccc(C4CCCCC4)cc3)n2-c2ccccc2)cccc1,2 J038-2735,Cc(cc1)cc([C@H]2OCC[C@H]22)c1NC2c(cc(cc1)OC)c1OC,0 L678-0303,CC(Cc1c2cccc1)(C(NCc(cccc1)c1OC)=O)N(Cc1ccc(C(F)(F)F)cc1)C2=O,0 F6445-3089,Cc1nn(cc(CCCNC(c2nn(-c3ccccc3)nc2)=O)cn2)c2c1,2 F5854-2127,COCCN(Cc1ccncc1)C(c(cccc1)c1Br)=O,0 F5788-0112,O=C(CN(CCN1c2ccccc2)C1=O)NCCC1=CCCCC1,2 J006-2726,CC(C)c1noc(C2N(Cc3c[nH]nc3-c3cccc(Br)c3)CCC2)c1,0 8018-2817,CN(C(CN1c(cccc2)c2O)=C(C(c(cc2)ccc2Br)N2)C1=O)C2=O,0 F6544-1139,Fc1cnc(N2CCC(Cn3nccc3)CC2)nc1,2 F6111-0618,COc1cc(COCC2CCN(Cc(cccc3)c3F)CC2)cc(OC)c1,0 Z1795984698,OCCN(CC1)CCN1c1ccc2c(Cl)cccc2n1,0 F2135-1301,O=C(CSc1ncnc2c1[nH]cn2)N(CCC1)c2c1cccc2,2 F6744-6607,CN(C1CCN(Cc2noc(C3CC3)c2)CC1)c1ncccc1,2 SC69-0016,Cn1c(C(C2)C3(CCCC3)CN2S(c(cc2)ccc2F)(=O)=O)nnc1,0 SA44-1174,CN(CC(C1)(CN1C(c1n[nH]c(C2CC2)c1)=O)C1)C1c1nnc(-c2ccccc2)o1,2 F6471-8245,Cn1c(S(C(C2)CN2C(c(cccc2)c2C(OC)=O)=O)(=O)=O)nnc1,0 Z3797552754,O=C([C@@H](CC(F)(F)F)N1)N(Cc2nc(-c3ccccc3)n[nH]2)C1=O,2 SB66-0053,Cc1c(CN(C[C@H]2CCC3)C[C@@H]2NC3=O)scn1,2 8017-7269,Cc1nc(N(CC2)CCN2C(CC(N2c(cc3)ccc3F)=O)C2=O)nc(C)c1,2 Z2962678001,CCOc1nc(C(N(C2)C(C)(C)CC2c2ccccc2)=O)co1,0 Z3222175070,CN(C1CCCCC1)S(c(cc1)cc(OC)c1Cl)(=O)=O,0 Z2187779935,CCC(C)(C1)CN1C(CCc1c[nH]cn1)=O,2 F5262-0460,Cn1c(C(CNC(C(Nc(cc2)cc(Cl)c2F)=O)=O)N2CCN(C)CC2)ccc1,2 8012-9526,CC(C(C(c(cc1)ccc1F)N(C1=O)c(cc2)ccc2OCC(O)=O)=C1O)=O,0 P657-0699,O=S(c1ccc(-c2nnc(C3CC3)o2)o1)(N1CCOCC1)=O,2 L438-0147,O=C(NC1CCCC1)Nc1cc2ccc(N3CCCCC3)nc2c(F)c1,2 Z407255864,Cc(cccc1)c1C(NC(CC1)CCN1C(C(C1)ON=C1c1ccccc1)=O)=O,2 F6564-9166,O=C(C(CC1)CCN1c1nnc(CCC2)c2c1)N(CC1)CCC1(F)F,2 SC08-0037,CS(N(CC1)CCC1c1noc(C(C2)CN2C(c2nc3ccccc3cc2)=O)n1)(=O)=O,2 Z1498334095,CCOc(cccc1)c1C(N1CCN(Cc2nc(C3CCCC3)no2)CC1)=O,2 F6436-3261,CC(CNS(c1cccc2cccnc12)(=O)=O)(CSC)O,0 S984-0953,CN(C)C([C@@](CN(C1)C(Cc2cnccc2)=O)(C2)[C@@H]1CN2C(c1ccccc1)=O)=O,2 F3083-0184,Cc1cccc(C(N(CC2)CCN2S(N2CCCCC2)(=O)=O)=O)c1,2 F1616-0094,C(c1ncccc1)Nc1c(c(-c2cccs2)cs2)c2ncn1,2 F6556-0680,OC(CNC(COc(ccc(Cl)c1)c1Cl)=O)(CSC1)c2c1cccc2,2 Y030-8667,CC(C)(C)c1nnc(NC(C2OCCC2)=O)s1,0 Z4916807602,[O-]C(C(c1cccc2ccccc12)N(C1)CC2(CCC2)C1O)=O,2 Z2187132487,COc1cccc(-c2n[nH]c(C(N(CC3)CC3n3nccc3)=O)c2)c1,0 F2414-0045,O=C(c(sc1c2cccc1)c2Cl)Nc1c(CCCC2)c2no1,2 F3382-4603,CC(C(NCc(cc1)ccc1F)=O)Sc1ncc(-c2cccc(Br)c2)o1,0 F6360-9276,O=C(c(c(F)ccc1)c1Cl)N(C1)CC1Oc1cnccc1,0 Z1496845921,Cc1cccc(S(NCC(COc2ccccc2)O)(=O)=O)c1,0 S511-1814,CNC(CC1CC(CC2)(CCN2S(c(cc2)cc3c2OCCO3)(=O)=O)OCC1)=O,2 F6562-5254,O=C(c1cccc(C(F)(F)F)c1)NCCN(C=CC=N1)C1=O,0 F6775-2371,Clc(cncc1)c1N1CC(COc2nccnc2)CCC1,2 F6678-8689,Cc1nc(cccc2)c2n1C(C1)CN1C(C(C1)CC1(F)F)=O,2 F6445-6252,O=C(c(cc1)ccc1-n1cccc1)N(CC1)Cc2c1ncnc2,2 F6521-9073,OC(CNS(c1cccc2cccnc12)(=O)=O)(C1)Cc2c1cccc2,2 F5834-2479,CC(N(CC1)Cc2c1ccc(NC(Nc(cccc1)c1Cl)=O)c2)=O,0 M034-4859,Cc(cc(cc1)S(N(CC2)CCN2c2ncccc2-c2nnc(C3CC3)o2)(=O)=O)c1F,2 SA67-0704,CCCNC(N1CC(CCc2noc(-c3cnccc3)n2)CC1)=O,0 Z632-3132,Cc1noc(C)c1C(CCC1)N1C(NCc1ccccc1)=O,2 G639-3408,O=C(c1n[nH]c(-c2ccncc2)c1)N(CC1)CCN1C(C1=Cc(cccc2)c2OC1=O)=O,2 F5033-7658,O=C(Nc(cc1)ccc1F)N1CCC(CNC(Oc2ccccc2)=O)CC1,2 Z1273545817,O=C(c1cn(Cc2ncccc2)nn1)Nc1cn(CC2OCCC2)nc1,2 Z1079752314,COc(ccnc1)c1NC(Cc1cccc(Cl)c1)=O,0 Z1004015012,CC(C)c(c(CNCc(cc1)ccc1O)c1)nn1-c1ccccc1,0 F6480-5462,CC(C)(C)OC(N(CCC1)CC1Oc1ncncc1)=O,0 F5831-7612,COc(cc1)ccc1NC(NCc1cscc1)=O,0 Z2616894995,CC1(C)C(C2CCN(Cc3ccccc3)CC2)N(CC(NC)=O)C1,2 T955-0768,O=C(NC1CCCCC1)N(CCC1)CC1c1nc(CCOCC2CC2)no1,2 F6287-0692,Cn1c(CCNS(Cc(cc(cc2)F)c2F)(=O)=O)nc(-c2cccs2)c1,2 F6442-6803,COC(CC1)CCN1C(CC1)CCN1S(c1c(C(F)(F)F)cccc1)(=O)=O,0 F6559-3490,CCn1ncc(-c2noc(CNC(C(C)n3nccc3)=O)n2)c1,2 F6560-2303,CCOCC(NCc1cn(-c2ccncc2)nn1)=O,0 V020-0316,O=C(Nc1cccc(Cl)c1)N(CC1OCCC1)Cc(n1Cc2ccccc2)cnc1S(Cc1ccccc1)(=O)=O,2 Z2698076653,CN(C(CN1CC(N(CCC2)C2c2cnccc2)=O)=O)C1=O,2 Z981880124,NC(c1ccc(C(N(Cc(cc2)ccc2Cl)C2CC2)=O)s1)=O,0 SB94-0298,Cc1cn(CC(N2CCC(CN(CC(C3)C(N4CCCC4)=O)C3=O)CC2)=O)nc1,2 Z2964427197,Cc1c(C(N[C@H](COC2)[C@H]2NC(c2c(C)cc(C)o2)=O)=O)oc(C)c1,2 F584-1245,Cn1nc(C(N2CCCC2)=O)c(C2)c1CCN2C(Nc(cc(cc1)F)c1F)=O,2 S382-1274,Cc1noc(C)c1CN(CC1)CC1(C(N1C)=O)N(C)C1=O,0 Z3527075650,OC(C1(CCC1)O)C(N(CC1)CCC1c1nc(cc(cc2)Cl)c2o1)=O,2 Z2062531429,Cc1noc(C(CC2)CN2C(NCc(cc2)cc(Cl)c2S(C)(=O)=O)=O)n1,2 J004-1428,CCCc1cc(C(CCC2)N2C(c2cccs2)=O)no1,0 F3385-0958,O=C1c(ccc(OCc(cccc2)c2F)c2)c2O/C1=C\c1cnccc1,2 T619-3620,CCc1noc(C2N(Cc3nc(CCOC)no3)CCCC2)n1,2 J079-1039,Cc1cc(CN2CCN(CC(c(ccc(C)c3)c3O3)=CC3=O)CC2)c(C)cc1,0 Z2956793133,Cc1n[nH]c2c1CCCN2Cc1cnc(C)o1,2 Y043-8050,N12/C(/C3CN(C(Nc4cc5c(OCCCO5)cc4)=O)CC(C1)C3)=C\C=C/C2=O,2 E731-0616,CCOc1cc(CCN(C2CC(N3c4cc(C)cc(C)c4)=O)C3=O)c2cc1OCC,2 J097-0316,CCN(c(ccc(C(Nc(cccc1)c1C(NCC(C)C)=O)=O)c1)c1-c1c2cccc1)S2(=O)=O,0 F6436-1287,CN(CCOc(cc1)c2cc1NC(c(cccc1)c1S(C(F)F)(=O)=O)=O)C2=O,0 F2831-0700,CC(C)S(c(cc1)ccc1C(Nc1c(C)ccc(C)c1)=O)(=O)=O,0 F0017-0216,COc1ccc(CC(c(cc2)ccc2SC)=O)cc1,0 Z2295857850,OC(Cc1cccc(C(N(C2CC2)C(CC2)c3c2cccc3)=O)c1)=O,2 F6488-2762,CN(C)c1cncc(OC(CC2)CN2C(N(CCN2)C2=O)=O)n1,2 SB04-0463,CN(C)C(N(CC1)CC1N(CCNC(c1cncnc1)=O)C1CCOCC1)=O,0 SC55-1587,CC(C)C(N(C1)CC1(CN(Cc1ccccc1)C1)C1c1nc(C(C)C)n[nH]1)=O,0 F6502-2493,O=C(C1(CCCC1)c(cc1)ccc1Cl)NCCn1c(C2CC2)ncc1,0 S375-3215,Cc1nc(C(C(N2Cc3cccc(Br)c3)=O)=C(CCCC3)N3C2=O)no1,0 V004-6064,Cc(cc1)cc(CN(CCCn2c3ccc2)C3c(cccc2)c2Cl)c1O,0 Z4921180242,CCOc1cccc(-c2cn(CC(N3CCC4(CCC4)CC3)=O)nn2)c1,2 Z4663227322,Oc(c1ccccc1nc1)c1C(NCC(N(CC1)CC1c1n[nH]nn1)=O)=O,2 F5236-0007,O=C(C1CCCCC1)N(CC1)CCN1c(cc1)nnc1Nc1ncccc1,2 Z2199388809,COc(cc1)c(CNC(N2CC(CS(C)(=O)=O)CC2)=O)cc1Cl,0 SC11-0795,Cc1noc(C)c1S(N(CCCN1CCCC1)C1CNCCC1)(=O)=O,2 Z1416280297,CC(C1)N(C(C(CCCC2)C2C(NCC(C2CC2)O)=O)=O)c2c1cccc2,2 Z2065704986,O=C(c1csc(-c2cnccc2)n1)Nc(cccc1)c1Cl,0 Z235585278,O=C(c1c(N2CCOCC2)nccc1)N1CCCC1,2 F3411-3133,COc(ccc1ncc23)cc1c3[nH]nc2-c1ccccc1,0 F6783-4973,CC(C(N(C1)CC(C2)C1CN2c1ncnc2c1ncn2C)=O)Oc1ccccc1,2 F6441-5082,Cc1c(C(N(C(CC2)C3)C2CC3S(c2ccccc2)(=O)=O)=O)sc(C)n1,2 SB47-0548,Cc1n[nH]c([C@@](CN(Cc2ccccc2)C2)(C3)[C@@H]2CN3C(Cc2cccs2)=O)n1,2 Z1039889148,Cc1c(C2(CC2)C(N2CCN(CC(N)=O)CC2)=O)cccc1,0 F6605-3407,Cc1cc(C)nn1-c1cc(N2CC(CN(CC(C=CN3C)=CC3=O)C3)C3C2)ncn1,2 F6685-9099,Clc(cccn1)c1OCC1CN(Cc2cnccc2)CCC1,2 F5833-6831,Cc(ccc(NC(c1ccno1)=O)c1)c1N(CCCC1)C1=O,0 S423-0364,COc1cccc(S(N(CC2)CCC2(C2)OCCC2OCc2ccccc2)(=O)=O)c1,2 Z1444489676,COc1cc(CCC(NC(Cc2c[nH]c3c2cccc3)C(O)=O)=O)cc(OC)c1,0 S971-1277,CCn1ncc(C(N(CC2)CCC2(CC2)C2(C)O)=O)c1,0 S694-0958,Cc1cnc(-c2cnccc2)n1C(CC1)CN1C(c1ncc(C)nc1)=O,2 Z1317602545,CC(C(NC1CC1)=O)N(CC1)CCN1c1ncc(-c2ccccc2)s1,2 F6480-1008,O=C(NCc1cccc2ccccc12)N(CCC1)CC1Oc1ccncc1,2 S606-1898,CN(C)S(N(CC1)C[C@@H]1N(c1ncccc1N1CC2CCCCC2)C1=O)(=O)=O,0 F3358-0051,COC(CSc1nc(-c2ccco2)cc(C(F)(F)F)c1C#N)=O,0 F6609-1340,Cc(cc1)c(C)cc1C(C=C1)=NN(CC(N(C)c2cccc(Cl)c2)=O)C1=O,0 SA01-0995,CN(C)c1ncc(C(NCCOC)=O)c(C(CC2)CN2C(c2cnccc2)=O)n1,0 C530-0335,CCN(c(cc(cc1)C(NCCc2ccc(C)cc2)=O)c1S(c1c2cccc1)(=O)=O)C2=O,2 Z1070597764,Fc1c(C2OCCN(Cc3nc(-c4cccc(Cl)c4)no3)C2)cccc1,0 Z3052640133,CC1(COC1)C(N(C)Cc1noc(C2CC2)n1)=O,2 F0570-0363,Cc1ccnc(SCCn2c(N3CCOCC3)nc(N(C)C(N3C)=O)c2C3=O)n1,0 F6604-7434,Cc1nc(n(C)nc2)c2c(N2CC(CN3N=C(C4CC4)C=CC3=O)C2)n1,2 F2638-0173,CC(N1c2cccc(NC(c(c(F)ccc3)c3Cl)=O)c2)=Nc(cccc2)c2C1=O,0 Z1868660685,CC[C@H](C)[C@@H](C(N1c(cccc2)c2F)=O)NC1=O,0 Z3509387880,CCCC(CCC1)C1C(N[C@H](Cc1c[nH]cn1)C(O)=O)=O,2 5593-1921,NC(C(CC1)(CCN1C(CC(N1c(cccc2)c2Cl)=O)C1=O)N1CCCCC1)=O,0 F6521-7345,Cn(cc1)c2c1cc(C(CNC(CSc(cc1)ccc1F)=O)O)cc2,2 F5490-1285,C(C1OCCC1)Nc(nc1)ncc1-c1c(cc[nH]2)c2ccc1,2 SB03-0061,CS(N(CCC1)CC1N(CCNC(c(cc1)cc2c1[nH]cn2)=O)C1CCOCC1)(=O)=O,2 F6363-0014,CCNc1cc(C)nc(NCCNC(c2nc(C)nc(-n3nccc3)c2)=O)n1,2 F6514-6795,O=C(NCc(cc1)ccc1Cl)NC(Cn1nccn1)c1ccccc1,2 Z2948902814,CC(C)c1nsc(CN(CC2)CC2NC(c2ccccc2)=O)n1,2 F2780-0755,CC(C1)OC(C)CN1C(C(Nc1c(CSC2)c2nn1C(C)(C)C)=O)=O,2 Z3642762763,C(C1(CC1)n1nncc1)NCc(cccc1)c1-n1nnc2c1cccc2,2 F3097-6155,Cc(cc1)cc(NC(c2cc(Br)cnc2)=O)c1OC,0 G964-0470,CC1CN(CC(CC2)CCN2C(Nc(ccc(Br)c2)c2F)=O)CC(C)C1,0 S510-1206,CS(N(CCC1)C1c1noc(CCC(NC(CC2)CS2(=O)=O)=O)n1)(=O)=O,2 Z2482847826,CCN(CC(C)(C(O)=O)O)Cc(s1)ccc1Cl,0 S204-0001,Cn1nc(C(CC2)CCN2C(c2cocc2)=O)c2c1CCOC2,2 SA91-0247,CCS(N(CC1)CCC1(c(cc(cc1)C(NC2CCOCC2)=O)c1N1C)C1=O)(=O)=O,0 G786-0396,O=C(c(cc1)cc2c1OCCO2)N(Cc1cnccc1)c1nc(c(F)cc(F)c2)c2s1,0 Y044-0632,CS(N(CC1)CCN1C(C(CC1=O)CN1c(cc1)cc2c1OCCO2)=O)(=O)=O,2 F6441-2638,O=S(C(CC1)CCN1S(c1cc(C(F)(F)F)ccc1)(=O)=O)(c1ccccc1)=O,0 F6149-0248,Cc1cc(C)nn1-c(cc1)nnc1N(CCC1)CC1C(Nc(cccc1)c1C(OC)=O)=O,2 F1374-1884,CC(C)c(cc1)ccc1OCC(Nc1nnc(-c(ccc(F)c2)c2F)o1)=O,0 Z1128178292,O=C(c(ccc(-n1nnnc1)c1)c1Cl)NCc1nccs1,2 L914-0712,Cc(cc1)cc(N2Cc3noc(C(NCCN(Cc4ccco4)C4CCCC4)=O)n3)c1OC2=O,2 Z3104814946,CC(c(cc(cc1)F)c1N(C)C)NC(NCc1c(C)ccnc1)=O,2 F6549-1290,CC(C(N(CC1)CCN1c1nsnc1)=O)Oc(cccc1)c1F,0 F6178-6175,CCOCC(NCC(CC1)CCN1S(c1cnccc1)(=O)=O)=O,0 F6559-0412,O=C(c1ccno1)N(CCC1)CC1N(C=Nc1c2cccc1)C2=O,2 G826-0660,COc1cccc(NC(c2cc(N(CC3)CCC3C(NCc(cc3)ccc3F)=O)ncc2)=O)c1,2 F5964-0251,OCC1(CNC(C(NCc(cc2)ccc2F)=O)=O)CC1,0 SC73-0139,CN(C)C(c1nn(C)c2c1COC(CC1)(CCN1C(c1cccn1C)=O)C2)=O,2 Z1994386156,CN(Cc1cc(cccc2)c2[nH]1)C(c(ccnc1)c1Oc1ccccc1)=O,0 F6573-7761,CN(C=CC=C1C(N(CCN2c3nccs3)CC2=O)=O)C1=O,2 F6521-4635,OC(CNC(NC(c1ccccc1)c1ccccc1)=O)c1csc2c1cccc2,2 F926-1626,CC(C)NC(N(CCC1)CC1c1cc(C(NC(C)c(cc2)ccc2OC)=O)ccc1)=O,0 SC67-0124,CC(C)CCN(CC1)CCC1(CN(C1)C(C)C)C1c1nncn1C,0 Z2156995886,O=C1N(Cc2nc(-c3c(cc[nH]4)c4ccc3)no2)CCOC1,2 V030-9140,CN(C1CCCCC1)C(c1ccc(-c(cc2)cc3c2OCCO3)s1)=O,2 Z4944926682,Cn1ncc(N2)c1C=C(C(Nc1cn(C3CCN(C)CC3)nc1)=O)C2=O,2 F3099-5759,CCC(CC)c1nnc(NC(c2cc(cccc3)c3o2)=O)s1,2 S985-0201,CC(C)N(C[C@H]1CN(C2)C(Cn3nccc3)=O)C[C@@]12C(N1CCCC1)=O,0 SA49-0447,O=C(CC1COC(C2)(CN2C(c2ccco2)=O)C1)N1CCOCC1,2 Z3009051424,CN(CCC(CNS(c1cc(cccc2)c2s1)(=O)=O)C1)C1=O,2 V027-8237,C=CCN(C(CC1)(CCN1C(c1cccc(F)c1)=O)NC1)C1=O,0 8020-7319,COc1cccc(-n2c(C(CC(N3)=O)c(cc4)cc(OC)c4O)c3nc2)c1,0 Z1952771685,Cc1ccnn1-c(cccc1)c1NC(CC(CCC1)CC1OC)=O,2 F6658-5766,N#Cc1ccc(CN2CCC(COc3ncnc(C4CC4)c3)CC2)cc1,2 F2268-0076,COCCN(CCC1)c2c1ccc(NC(c(cccc1)c1Br)=O)c2,0 Z2800198121,CCN(C(c(cnn1CC)c1Br)=O)c1ccncc1,0 F886-0151,O=S(c1ccc(-c2noc(C(F)(F)F)c2)o1)(Nc(cc1)cc2c1OCCO2)=O,2 Z1389387711,O=C(c1cc(cccc2)c2o1)NC(CCC1)CN1C(NC(CC1)c(cc2)c1cc2F)=O,0 S682-0820,COCC(CC1)CCN1C([C@H]1OCCN(C2CCCC2)[C@@H]1c1ccccc1)=O,2 F848-0090,O=C(CCCn1nnc2c1ccc(S(N1CCCC1)(=O)=O)c2)Nc(cc1)cc2c1OCCO2,2 F6489-2011,CN(C)c(cc1)nnc1OC(CC1)CN1C(Cc(cccc1)c1F)=O,2 F1016-0067,Cn1c(SCC(N2CCCCCC2)=O)nnc1,2 F6520-0184,COc(cc1)cc(C(NCCc2ccc(-c3cccs3)s2)=O)c1Br,0 Z2982742075,OCc(cccc1)c1-n1nnc(CN(CCN2)CC2=O)c1,0 F5939-0644,O=C(c1nn(-c2ccccc2)nc1)N(CC1)CCC1Oc1nc(c(F)ccc2)c2s1,2 G373-1417,CCN(CC)S(c(cc1)cc2c1n(C)c(CN(CC1)CCN1S(N(C)C)(=O)=O)n2)(=O)=O,0 Z2378085911,NS(c1cc(C(CCC2)NC3CNCCCC3)c2cc1)(=O)=O,2 Z2217024179,CC1(C)OCCC1Nc1ncnc2ccccc12,0 F6524-6071,Cc1c(C(NCCN(C(C)=Nc2c3ccs2)C3=O)=O)c(C)nn1C,2 Z269358764,O=C(CSc1ncnc2c1cnn2-c(cc1)ccc1F)NCC#Cc1ccccc1,2 F2504-0018,COc1cc(C(NCC(c2ccco2)N2CCOCC2)=O)cc(OC)c1OC,2 Z3357279535,Cc1cccc(C)c1CS(NC(c1cn(C2CCC2)nc1)=O)(=O)=O,2 Z1683372221,Cc1cccnc1-c1noc(-c2cc(OC)ccc2)n1,0 F5791-1330,O=C(Cn(cc1)c2c1cccc2)Nc1nc(-c2ccco2)cs1,2 F6411-2890,Cc1c(CN(c2csnc2C(N2Cc3cc(C)ccc3)=O)C2=O)nc(-c2ccccc2)o1,2 Z4322144278,CC(C)(CC1CC(O)=O)CN1C(c1n[nH]c(cc2)c1cc2Cl)=O,0 P025-0584,O=C(C1CC1)N(CC1)Cc2c1sc(S(Nc(cc1)ccc1N1CCOCC1)(=O)=O)c2,2 Z1438139487,O=S(c1ncc(C(F)(F)F)cc1)(N(CC1)CCC1Oc(cc1)ccc1F)=O,0 Z1612403306,CC[C@H](C)[C@@H](C(N1CC2c(cccc3)c3OCC2)=O)NC1=O,2 Z2482990357,Cc1c(CN(C)C(CCN2c(cccc3)c3Cl)C2=O)cc(C(O)=O)s1,0 E587-0179,O=C(Cn1c(cccc2)c2c(SCc2ccc(C(F)(F)F)cc2)c1)N1CCCC1,0 E197-0319,CC(C)(c(cc(cc1)S(N(C)CC(Nc(cc(cc2)Cl)c2OC)=O)(=O)=O)c1N1C)C1=O,2 Z1528541106,Cc(cc1)ccc1NC(C(c1ccccc1)NCC(C1)CN(Cc2ccccc2)C1=O)=O,2 Z451133156,CC(C)(C)n1ncc(C(Nc(cc2)cc(C(O)=O)c2Cl)=O)c1C,0 P223-1464,Cc1nn(C)c(CN(CCC2)CC2c2nn(CCCN(C)C3=O)c3c2)c1,2 C660-0764,Clc(cc1)ccc1-c1noc2ncnc(N(CC3)CC3c3ccccc3)c12,2 Z2982757851,COCc1cn(Cc2cc(C3CC3)no2)nn1,0 F2661-0167,CCOc(cccc1)c1NC(C(NCC(c1cccs1)N(CC1)c2c1cccc2)=O)=O,0 Z1278394452,CCc1cnc(NC(NC(C2CC2)c2nc(C)cs2)=O)s1,2 Z4088103902,Cc1cc(C(N(CCC2)C2c(cc2)ccc2C#C)=O)co1,0 Z4083732951,CCN(CC1(CCC1)O)C(Nc(cc1)cc(N(C)C(N2C)=O)c1C2=O)=O,2 Z2607685438,OC(CC1(CCOCC1)NC(c(cc1)cnc1NC1CC1)=O)=O,2 SB55-0543,CC(C)Cc1nc([C@@](CCC2)(C3)[C@@H]2CN3C(c(cc(cc2)F)c2F)=O)no1,0 L010-0009,CCC(C)NC(c(cc1)ccc1-c1ncnc(N2CCCC2)c1)=O,0 Z1241534521,CC(C)(C)c(cc1)ccc1S(N(CC1)CCC1c1ccnn1C)(=O)=O,0 Z993686968,CC(C(N1)=O)(c2cc(CNC(C(CC3=O)CN3c3ccccc3)=O)ccc2)NC1=O,0 F993-0363,CN(c(sc(C(N(CC1)CCN1c1ncccn1)=O)c1)c1C(N1C)=O)C1=O,2 S795-0225,CCOC(CCNC(N(CCCOCCN1)[C@@H](CCC2)[C@@H]2C1=O)=O)=O,2 D724-1059,CCC(C)n1nc(C)c(-c2n[nH]c(C(O)=O)c2)c1C,0 F6557-1497,O=C(c1ncccn1)N(CCC1c(cccc2)c2F)CCS1(=O)=O,2 Z1575681284,CCC(C)(COCC1)N1S(c1cc(Cl)cnc1N)(=O)=O,2 G702-6617,COc1cccc(CNc2c(CCC3)c3nc3nc(Cc(cc4)ccc4Cl)nn23)c1,0 F2976-0646,CCOc1ccc(CC(Nc2nc(-c3cccs3)cs2)=O)cc1,0 M179-4441,CC(CCCC1)N1c1cc(SCC(N(CC2)CCN2c(cc2)ccc2F)=O)ncn1,2 F6619-4095,Brc1cnc(N(CC2)CCN2c2nc(N3CCOCC3)ccn2)nc1,2 Z3066450777,NCCc(cc1)ccc1C(NC1CCN(CC(O)=O)CC1)=O,0 F5832-2484,O=C(NCC(c(cc1)ccc1F)N1CCOCC1)Nc1cccs1,2 C630-0073,Cc(cc1)c(C)cc1N(CC(C1)c2nc(cccc3)c3n2Cc2ccccc2)C1=O,0 G576-0570,CCN1CCN(CCNC(CCCN(c2cc(-c3cccn3C)nn2CC2)C2=O)=O)CC1,2 F6451-3365,COC(CNC(c(cc1)cc(F)c1OC)=O)c1ccco1,0 S993-0614,CC(C)CN(CC(N(CC1)C2CCN1C(Cc1cccs1)=O)=O)C2=O,2 Y040-1946,OC(C(c1ccccc1)Oc(cc1)cc(O2)c1-c(cccc1)c1C2=O)=O,0 F2758-0425,CN1N=C(CNC(c2cccc(Br)c2)=O)c(cccc2)c2C1=O,0 F6713-4698,Fc1c(N(CC2)CCN2c2nnc(C3CC3)cc2)ncnc1,0 Z1461795287,Cn1cnc(C(NC2(CCCC2)c(cc2)ccc2OC)=O)c1,2 L562-0148,CC(C)CNC(c1cc(-c(cc2)nnc2Oc(cccc2)c2OC)ccc1)=O,0 3002-0885,O=C(C1=Cc(cc(cc2)Br)c2OC1=O)NCC1OCCC1,2 S689-1307,O=C(C(C1)CN(C2CN(Cc3cccc(F)c3)C2)C1=O)NCc1ccccc1,0 K668-0068,O=C1N(Cc(c(F)ccc2)c2F)C=Nc2c1c(CCCC1)c1s2,2 F2740-0157,O=C(Nc1c[nH]c2c1cccc2)Nc(cccc1)c1Cl,0 Z1902806538,CC(C)(C)CCC(C(N)=O)NC(C(C)(c(cccc1)c1F)OC)=O,0 Z1295602274,O=C(c(ccnc1)c1Cl)N(CCC1)C1c1cnccc1,2 Z1589404862,CNC(c(cc1)cc(NC(N(CC2)CCN2c(cc2)ncc2F)=O)c1OC)=O,0 Y502-6899,Cn1ncc(S(N(CCC2)CC2C(Nc2cn(C)nc2C(NCc2ccco2)=O)=O)(=O)=O)c1,2 Z2960084304,CC(C1)(CC1NC(C1=Cc(ccc(C(F)(F)F)c2)c2NC1=O)=O)F,2 S895-0313,Cc1cc(C(N(CC2)CCC2(CC2)CCn3c2nnc3COC)=O)c(C)n1CCOC,2 F536-0119,Cc(cc1)c(C)cc1C(N(CC1)CCN1S(c(cc1OC2)c(C)cc1NC2=O)(=O)=O)=O,0 F6725-2745,O=C1OCCN1C(CC1)CN1c1nc(cccc2)c2s1,2 E629-1815,O=C(Cn(c(-c1cccs1)c1)c(cc2)c1cc2Cl)NC(CC1)CS1(=O)=O,2 F345-0566,CC(Cc1ccco1)NC(CC(CC1)CCN1C(NC1CCCCC1)=O)=O,2 Z3105119999,CC(C)(CNC(N[C@@H](C1)[C@H]1c1ccco1)=O)C1=CCOCC1,2 F6550-1613,O=C(Cc(cc1)ccc1Br)N(C(CC1)C2)C1CC2F,0 F6497-1157,CC(C)(C(N1CC(Cc2nc(-c3c(C)cccc3)no2)CCC1)=O)OC(C)=O,0 Z608075192,N#Cc1ccc(CNS(c2c(C(O)=O)scc2)(=O)=O)cc1,0 L409-0036,CC(C)C(C(N(CC1)c2c1cccc2)=O)NC(Nc(cc1)ccc1Br)=O,0 F6523-0449,Cn1cnc(S(N(CC2)CCN2c2ncnc(C(F)(F)F)c2)(=O)=O)c1,2 Z1870106611,CN(c(cc(cc1)C(N2C(CCC(O)=O)CCCC2)=O)c1N1)C1=O,0 Z5033002901,Cc1ccc(Cc2noc(-c3cc(CCCC4N)c4cc3)n2)cc1,0 F5600-0035,Cc(cc1)nnc1NCCNC(c1cccc(C(F)(F)F)c1)=O,0 F2814-1621,COc(cc1)ccc1S(CCCC(Nc(ccc(F)c1)c1F)=O)(=O)=O,0 Z3341691142,Cc1cc(CS(c2cnccc2)(=O)=O)nn1C,0 T158-1330,Cc1cnc(C(CC2)CN2S(c(cc(cc2)OC)c2OC)(=O)=O)n1Cc1ccccc1,0 Y043-7319,CC(C)CC(C(Nc(cc1)cc2c1OCCO2)=O)NC(NC(CC1)CS1(=O)=O)=O,0 F6231-0112,Cc(cc(cc1)OCC(NCCN(C(C=C2)=O)N=C2n2nccc2)=O)c1Cl,2 F6502-6760,Cc1cc(-c2cccs2)nn1CCNC(Cc1c(C)onc1C)=O,2 F6529-2350,O=C(c(cc1)cc2c1[nH]cc2)N(CC1)CCC1N(CC(N1c2ccccc2)=O)C1=O,2 F0294-0008,CC(C)(C)C(N1CCN(CCN(C(c2c3c4cccc3ccc2)=O)C4=O)CC1)=O,0 SB53-0059,Cc1nnc([C@@H](C2)[C@@H](CN(C)C)CN2C(NC2CCCC2)=O)o1,2 SB54-0736,COC[C@@H](CN(C1)C(C2CCOCC2)=O)[C@H]1c1nnc(-c2ccccc2)o1,2 F6412-1596,COc(cccc1)c1OCC#CCNS(c(cccc1)c1F)(=O)=O,0 M758-2849,CCN(Cc1ccncc1)C(C1)CN1C(C1(CC1)c1ccccc1)=O,0 G856-2760,OCCN1CCN(Cc(c(O2)c(cc3)C=C(c4nc(cccc5)c5s4)C2=O)c3O)CC1,0 F6480-3915,O=C(N(c1ccccc1)c1ccccc1)N(CCC1)CC1Oc(nc1)ncc1F,2 S692-0351,Cc1cnc(C2CCOCC2)n1C(CCC1)CN1C(CCC1CCCC1)=O,2 Z729659602,Cc(cc1)ccc1C(C1CCN(CC(NC2CCCC2)=O)CC1)=O,2 Z1542324266,CC1N(C)c(ccc(C(N2CCC3(CN(Cc4ccccc4)CC3)CC2)=O)c2)c2NC1=O,2 T636-1243,O=C(NCc1cccc(F)c1)NC(CC1)CN1c1ncnc2c1CCC2,2 F3386-2811,COC(c(cc(cc1)Br)c1NS(c1ccccc1)(=O)=O)=O,0 S556-0532,CC(C)NC(N(C1)CC1Oc(cc1)ccc1-c1noc(C2CC2)n1)=O,0 Z1444758664,CCC(C)(CC(O)=O)NC(C1CC=CC1)=O,0 Z363123682,CCN(CC(C1)C(Nc(cc2)cc(Cl)c2F)=O)C1=O,0 S582-0094,CN(C(CNC(CCc1c[nH]c2c1cccc2)=O)Cn1c2ccc1)C2=O,2 S831-2569,OC[C@@H](CN(C1)C(c2cccc(Cl)c2)=O)[C@H]1c1ncccc1,0 D733-0743,Cc1c(NC(CC2C(Nc(ccc(F)c3)c3F)=O)=O)n2nc1-c(cc1)ccc1F,2 Z1779511061,OC[C@H](Cc1ccccc1)NC(NC(CC1)C2N1CCCC2)=O,2 S742-0056,CO[C@H](C1)[C@@H](c2ccncc2)N1C(CC1)CCN1C(CCC1CCCC1)=O,2 SD25-0264,Cc(nc1)cnc1C(N1CC2(CCCCC2)C(CCC(NC2CC2)=O)C1)=O,2 L111-0751,O=C1N(Cc2nc(-c(cccc3)c3OCc3ccccc3)no2)c(cccc2)c2OC1,2 G581-0437,CCCCNC(CCCN(c1cc(-c2cn(C)c3c2cccc3)nn1CC1)C1=O)=O,2 Z1983521298,COc(cccc1)c1-c1nc(C(CC2)CCN2c(ccnc2)c2Br)no1,2 F5016-2478,CSc1c(CN2CCC(CNC(C(Nc3cnccc3)=O)=O)CC2)cccc1,2 S544-0361,Cc1noc(C)c1Cc1ccc(C(N2CC(CCOc(cc3)ccc3F)CC2)=O)o1,2 S836-2387,CNC([C@@H](C1)[C@@H](COC)CN1S(c1cc(CCC2)c2cc1)(=O)=O)=O,0 F6573-4151,Cc1cccc(CC(NCCOCCN(C(CC2)=O)C2=O)=O)c1,2 Z4743808626,CCc1cccnc1C(N(CCC1)C[C@H]1NC(CC1CCCCC1)=O)=O,2 C785-1722,CC(n1c2cc3c1ccs3)=NN(CC(N(CC1)CCN1c1ncccn1)=O)C2=O,2 SC65-0918,CCN(Cc1ccncc1)C([C@@H](C1)[C@@]1(C[C@H]1C(NC)=O)CN1S(c1ccccc1)(=O)=O)=O,2 F2726-0787,O=C(Cc(cc1)ccc1F)Nc1nc(-c2ncccc2)cs1,2 Z1738499289,Cc1c(C(O)=O)sc(CCNS(c(cc2)cc(C)c2OC)(=O)=O)n1,0 S049-0519,COCc1nc(-c(cc2)ccc2OC(CC2)CN2S(c2cc(OC)ccc2)(=O)=O)no1,0 Y043-7763,c1(nc2c(s1)cccc2)NC([C@@H](NC(N1CCN(c2ncccc2)CC1)=O)C)=O,2 F6525-6421,CC(C)S(c1ccc(CC(NCCn2nc(C)c(-c3cscc3)c2C)=O)cc1)(=O)=O,0 F6015-0376,Cc1ccc(C)n1CCCC(Nc(cccc1)c1SC)=O,0 SA73-0400,COCc1nc(C(CC2CC2)(CC2)CCN2C(CCc2nc(cccc3)c3s2)=O)no1,2 Z2311293716,CC(C)C[C@@H](C1)[C@H]1NC(N1Cc2cncn2CC1)=O,0 S963-2519,CNC([C@@H](CN(Cc1ccccc1)C1)[C@H]1NS(C1CC1)(=O)=O)=O,2 SB21-0235,O=C(COCc1ccccc1)N(C1)[C@H](Cn2nnc(C(N3CCCC3)=O)c2)C[C@@H]1F,2 S954-5281,CCS(N(CC1)CCC1[C@@H](CN(C1)c(cc2)cc(C(F)(F)F)c2C#N)[C@H]1C(NC1CC1)=O)(=O)=O,2 F6530-6075,Cc(nc(nc1)OC)c1-c1nc(Cc(cc2)cc(OC)c2OC)no1,2 M535-1316,O=C(C1CC1)Nc(cc1)cc(N2CCCCCC2)c1C(NC1CC1)=O,2 SB66-1035,Cn1ncc(CN(C[C@H]2CCC3)C[C@@H]2N(Cc2cccc(F)c2)C3=O)c1,2 Z3676763554,CC(c(cc1)ccc1C#N)NC(C1(C(C)(C)C1)N)=O,0 Z1271627716,Cc(cc1)ccc1C(c(cc1)cc(O2)c1N(Cc1noc(-c3cocc3)n1)C2=O)=O,2 F6464-0002,CC1=C(C)N=CN(CC(N(CCCC2)CC2c2ccccc2)=O)C1=O,2 F3406-3241,CC(CC1)CCN1c1nccnc1Oc(cc1)ccc1C(NC(CC1)c2c1cccc2)=O,2 SB66-0375,Cc1noc(C)c1S(N(C[C@H]1CCC2)C[C@@H]1N(Cc1ccc(C)cc1)C2=O)(=O)=O,2 Z2492349709,Cc1c(C(CCC2)N2c2nccs2)ccc(F)c1,0 Z1189113793,CCN(CC)S(c(cc1)ccc1S(N1CC(C)(C)CCC1)(=O)=O)(=O)=O,0 Y041-7668,CN(C)CCNC(c(cc1)cc2c1[nH]c1c2CCCCC1)=O,0 F6573-1712,Cn1ncc(-c2nccnc2CNC(c2nn(-c3ccccc3)nc2)=O)c1,2 V026-5418,CC(C)n1c(S(Cc(cc2)ccc2F)(=O)=O)ncc1CN(C1CC1)C(c1ccc(C)cc1)=O,0 8020-4412,CN(c(cc1)ccc1OC)C(C=C1N2CCc(cc3OC)c1cc3OC)=NC2=O,2 F3407-5043,CC(c1ccccc1)NC(Cc1nnc(-c2c(C)ccs2)o1)=O,2 F6804-7519,N#Cc(cc1)ccc1N(C1)CC1N1CC(CCC2)C2C1,2 S627-0397,O=C(C(C(c1cnccc1)=C1)=C(CCCC2)N2C1=O)NC1CCCCC1,2 F2988-0005,O=C(c(cc1)ccc1Cl)Nc1nnc(CCSc2ccccc2)o1,2 F0015-0083,Cc(cc1)cc(C(c2ccccc2)=O)c1NC(c1cccs1)=O,2 Z1657325527,O=C(COc(cc1)ccc1Cl)N(CC1)CCC1C1COCC1,0 F6374-5455,O=C(Cc1cccs1)N1CCC(CSCc2ccco2)CC1,2 S810-0192,Cc1nc(C(C2)C2(CC2)CCN2C(Nc2ccccc2)=O)no1,2 Z1453463420,NC(C1(CC1)NC(C1CN(CC(F)(F)F)CCC1)=O)=O,2 F6557-1432,O=C(CNC(OCc1ccccc1)=O)N(CCC1c(cccc2)c2F)CCS1(=O)=O,2 Z242934568,O=C(c1cccc(Cl)c1)N(CC1)CCN1c1nccnc1,0 Z1303118862,O=C(c(nc1-c2ccccc2)nn1-c1cccc(C(F)(F)F)c1)N1CC(CC2)OC2C1,2 6395-0010,Cc1ccc(C(C(N2CCC3CC2)=C3N2)NC2=S)cc1,0 F6471-9091,Cn1c(S(C(C2)CN2C(c2cc(cccc3OC)c3o2)=O)(=O)=O)ncc1,2 Z3091563437,O=C(CC1=CCCCC1)N1CC(CC2)(CCS2(=O)=O)OCC1,2 F3325-0115,CC(C)N(C(CC1N2CCN(Cc3ccccc3)CC2)=O)C1=O,2 F5570-1094,CCOc(cccc1)c1NC(c(o1)ccc1S(N1CCN(C)CC1)(=O)=O)=O,2 S591-0430,O=C(c1n[nH]c2c1cccc2)N(C1)CC1N(Cc1ccccc1)C1CCOCC1,2 S951-5362,N#Cc(cc1)c(C(F)(F)F)cc1N(CC1)CC(C(NC2CC2)=O)N1C(c1ccncc1)=O,2 Z1610019746,CC(C(N1C[C@H](C)O[C@H](C)C1)=O)S(C1CCOCC1)(=O)=O,2 Z1531374407,COCC(CC1)(CCN1C(CN(C=Nc1c2ccs1)C2=O)=O)O,0 Z2970968724,CC(C)c1cc(N(CC2)CCN2C(N)=O)ncn1,0 L561-0445,CC(C)CNC(c(cc1)ccc1-c(cc1)nnc1Oc(cc1)ccc1F)=O,0 F6678-8701,Cc1nc(cccc2)c2n1C(C1)CN1C(C1OCCCC1)=O,2 F6724-4372,Cc1nc2ncnn2c(NCC(c2ccco2)c2ccco2)c1,2 Z1352610536,CCC(c1cccc([N+]([O-])=O)c1)NC(Nc1cn(CC(N2CC(C)OC(C)C2)=O)nc1)=O,0 F6194-1005,CC(Cc1cscc1)(CNC(C1CCCC1)=O)O,2 P085-1159,CC(c1cccs1)NC(c(cc1)ccc1-c1nnc(cc2)n1cc2NC(C1CCC1)=O)=O,2 Z1700385608,O=C(c1cc(NC(NC(c2nnc[nH]2)c2ccccc2)=O)ccc1)Nc(cc1)ncc1Cl,2 S556-0068,C(c1cnccc1)N(C1)CC1Oc(cc1)ccc1-c1noc(C2CC2)n1,2 Z2628374265,O=C([C@@H]1[C@@H]2[C@H]1COC2)Nc1nc(-c(cccc2)c2Cl)cs1,2 F6454-1537,O=C(NCCCc1ccccc1)NCC(CC1)CCN1c(nc1)ncc1F,2 Z2523347142,Cc(cc1)nc(NC)c1C(NCCOC)=O,0 F6520-1569,O=C(c1cccs1)NCCc1ccc(-c2cocc2)s1,2 Z1728511917,CC(Nc1ccnn11)=C(CC(N(C)Cc(cc2)ccc2OCC(O)=O)=O)C1=O,0 S831-3021,CS(N(C[C@@H]1COCC2CC2)C[C@@H]1c1ncccc1)(=O)=O,2 F6451-3304,COC(CNC(c1csc(-c2ccccc2)n1)=O)c1ccco1,2 V028-2130,CC(N(CCN1CCOCC1)CC(C1)OCCN1C(Nc1ccccc1)=O)=O,2 Z1732243094,Cn1nccc1NC(N(CC1)CCN1C(c1cccc(Cl)c1)=O)=O,0 8017-4507,COc(cc(cc1C=C2C(N(CC3)CCN3C(c3ccco3)=O)=O)Br)c1OC2=O,0 F6359-0693,O=C(Nc(cc1)cc2c1OCO2)N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1,2 Z4900394372,Cc1cc(C(NC(CC(C2)CC2(F)F)C(O)=O)=O)c(CCCC2)c2n1,0 Z2952187103,O=C(NCc1cn(CCF)nc1)Nc1cscc1Br,0 F0596-0009,CCOC(N(CC1)CCN1C(CSc1ncnc2c1oc1c2cccc1)=O)=O,2 Z1669481484,Cc1nnc(-c2cccc(NC(c(cc3)nc4c3nc[nH]4)=O)c2)n1C,2 S984-0985,CCCNC(N(C[C@@H]1CN(C2)C(c3ccccc3)=O)C[C@@]12C(N(C)C)=O)=O,0 3209-1291,Cc1ccc([C@H](C[C@H](C(F)(F)F)n2nc3)Nc2c3C(N(Cc2ccccc2)Cc2ccccc2)=O)cc1,2 SC25-0994,O=C(C1c2nnc(-c3nccnc3)n2CCC1)N(CC1)CCN1C1CCCCC1,2 Z1894629796,Cc(cc1)c(C)c2c1[nH]c(C(NCc(cc1)cc(C)c1S(N)(=O)=O)=O)c2,0 F3225-1078,COc1cc(-c2nc3nc4ccccc4nc3n2CC=C)cc(OC)c1OC,0 Z746860766,CC(CNC(Nc(cc1)ccc1C(N1CCC(C)CC1)=O)=O)N(CC1)CCN1c1ccccc1,2 F6178-1678,O=C(c1ccncc1)N1CCC(CNS(c(cccc2)c2Br)(=O)=O)CC1,2 V022-6212,O=C(c1cc(scc2)c2n1Cc(cc1)ccc1Br)NCC1OCCC1,0 F6573-8690,COc(ccc(F)c1)c1S(N(CCN1c(nc2)ncc2F)CC1=O)(=O)=O,0 F184-0107,Cc(cc1)c(C)cc1NC(C(CCC1)CN1S(c(cc1OC2)c(C)cc1NC2=O)(=O)=O)=O,0 F6656-1248,CC(C(N1CCC(CN2N=C(CCCC3)C3=CC2=O)CC1)=O)Oc(cccc1)c1Cl,2 Y502-7516,Cc(n(C)nc1)c1S(N(CC1)CCN1S(c1cn(C)nc1C)(=O)=O)(=O)=O,0 G516-0173,COc(cc1)ccc1-c1nc2ccccc2c(NC2CCN(Cc3ccccc3)CC2)n1,0 Z1713705856,CC(C)C(C(O)=O)N(Cc(cc1)ccc1Cl)C(C)=O,0 F6617-9003,Cc1c(C)cc(CN(CC(CN(C(C2(CCCCCC2)N2)=O)C2=O)C2)C2=O)cc1,2 Z1978902252,CC(C)CNC(c1conc1C1CC1)=O,0 SB69-0002,CN(CC(N1CCCCCC1)=O)C(c1nn(C[C@H](C2)OC)c2c1)=O,2 F5835-0086,CCOC(N(CC1)CCC1NS(C1CC1)(=O)=O)=O,0 F5860-1586,COC(CC1)CCN1C(c1cc(Cl)cc(Cl)c1)=O,0 F2742-0142,Cc(cc1)c2sc(N(Cc3cnccc3)C(CSc(cc3)ccc3F)=O)nc2c1OC,2 Y042-4827,COc(cc1)cc(OC)c1N(CC(C1)C(Nc2nnc(C3CCC3)s2)=O)C1=O,0 F6452-2130,Cc1c(C(NCC2(C3CC(C4)CC2CC4C3)OC)=O)snn1,2 SC45-0084,O=C(C1(CC1)c1ccccc1)NCc1c(CNC(C2)=O)n2nn1,0 SB91-1228,CN(C)C(N(CCN1CCCCC1)C(CC1)CN1C(NC1CCCCC1)=O)=O,2 F6610-2092,Cn1c(NCc(cc2)cnc2N2CCOCC2)nc2c1cccc2,2 Z2482876423,COc1ccnc(N(CC2)CCN2C(C(O)=O)c2cccc(Cl)c2Cl)n1,0 F400-0231,Cc1c(Cn(c2c3cccc2)c2c3N=CN(Cc(cccc3)c3Cl)C2=O)cccc1,0 E216-0284,CC(C1)Oc(ccc(Cl)c2)c2N1C(N(CC1)CCC1C(N(CC1)CCN1c1ncccc1)=O)=O,2 G008-5397,Cc1c(-c(cc2)cc(S(N(CC3)CC3c3ccccc3)(=O)=O)c2OC)onc1C,0 F3382-0411,CCc(cccc1)c1NC(C(CC1)CCN1c(cc1)nnc1S(c1ccc(C)cc1)(=O)=O)=O,2 F6261-2134,Cc1c(CNC(Cc2cccs2)=O)sc(-c(cccc2)c2F)n1,2 SC02-0475,COCCC(CC1)(CN1C(c(cc1)cc(F)c1F)=O)NC(C1CCOCC1)=O,0 V001-2504,O=C(Nc(ccc(F)c1)c1F)N(CCC1)C1c1nc(cc(cc2)-c(ccc(F)c3)c3F)c2o1,0 S069-4456,Cc1noc(C)c1S(N(CC1)CC1c1noc(-c2ccncc2)n1)(=O)=O,2 SD03-0848,CC(C)C(N1CCC(C2)(CN(CC(N(CC3)CCS3(=O)=O)=O)C2c2nc(C)no2)CC1)=O,2 Z1281152779,CCc1nsc(N(CCC2)CCN2S(N2CCCC2)(=O)=O)n1,2 Z2482940391,CN(C(CC1)CCN1C(C(O)=O)c1c(C(F)(F)F)cccc1)S(C)(=O)=O,0 F6514-9264,O=C(CCc1cccc(Oc(cc2)ccc2F)c1)NCc1c(-c2cnccc2)nccc1,2 F6787-0808,O=C(c1cc(Br)cnc1)N1CC(COc(nc2)ncc2F)(CCC2)C2C1,2 F0344-0758,CC(Nc1ncc(Cc(cc(cc2)Cl)c2Cl)s1)=O,0 Z1849801855,CCNC(C1(CNc2nc(-c3ccncc3)nc3c2CCC3)CCC1)=O,2 8012-6826,Cc(ccc(NC(CCN1CCN(C)CC1)=O)c1)c1Br,0 F6448-1163,O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1cn(CC2CCOCC2)nc1,0 V024-1441,O=C(c1c(N2c(cc3)ccc3F)ncn1CCOc1ccccc1)N(Cc1ccccc1)C2=O,0 F6555-6437,O=C(COCc1ccccc1)N(C1)Cc2c1cccn2,2 Z2968829404,CC(NC(CC1)CCN1c1ccc(cc(cn2)Cl)c2n1)=O,0 F6458-0415,O=C(C1COCC1)N(CC1)CCN1c(cc1)nnc1-n1ncnc1,2 Z1836556177,CC(C(CC1)c2ccccc2)N1C(c(cn1)c2n1nccc2)=O,2 Z2212562535,Cc(c1c2)nn(C)c1ncc2NC(C(CCc1ccc2)c1c2O)=O,0 F5882-4088,CC(C)(Cc1ccc2)Oc1c2OCC(NCC(CC1)CS1(=O)=O)=O,2 S948-0551,CCOC[C@](CN(C1)S(c2cnccc2)(=O)=O)(CC2)[C@H]1CN2c(cc1)cc(C(F)(F)F)c1C#N,2 SA31-0951,CC1(C(NCCCc2ccccc2)=O)n2c(-c3ccccc3)nnc2COC1,2 F5854-0807,O=C(NCc1cccs1)N(Cc1ccco1)Cc1ncccc1,2 SB59-0447,CC(C)C(N(C1)CC(C2)(CN2C(C2(CC2)c2ccccc2)=O)C1c1nncn1C)=O,0 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S691-0776,Cc1cnc(CC(CC2)CN2C(NCCc2ccccc2)=O)n1CCOC,2 Z1519135722,CC(N(CCCC1)C1C(Nc1cn(CC(N(C)C)=O)nc1)=O)=O,0 E643-0441,CCC(C(NC1CCC(C)CC1)=O)n1c(SCc2ccc(C)cc2)nc2c1nccc2,2 F6681-3564,CN(C=CN=C1N2CC(COc3cnccc3)C2)C1=O,2 F6512-0660,O=C(c1c(C(F)(F)F)cccc1)Nc1cc2ccnn2cc1,0 Z2046740994,CCS(NC(CC1)CCN1C(c(cc1)cc2c1C=CCC2)=O)(=O)=O,0 Z3700033170,Cc1noc2nc(-c3ccccc3)cc(C(N[C@]3(C4)[C@@H]4[C@H](CC4)N[C@H]4C3)=O)c12,2 F5864-0038,Cc(cc1)nnc1Oc1cccc(C(NCCc(cc2)cc(OC)c2OC)=O)c1,2 Z757547616,Nc1nccnc1C(NC1CCN(Cc(cc2)cc(F)c2F)CC1)=O,0 Z4878607109,CC(C)CCNCc(s1)ccc1Cl,0 Z2297821092,COc1c(CN(CC2)C(C(C3)c4c3ccc(F)c4)=O)c2ccc1,2 F6448-1257,Cc1c(C(Nc2cn(CC3CCOCC3)nc2)=O)n(cccc2)c2n1,2 Z2973954644,Cc1cc(NC(C2)CN2c2ncncc2)nc(C2CCC2)n1,2 F6723-7566,O=C1N(CC2CN(Cc3ccc(C(F)(F)F)cc3)CC3C2)C3=CC=C1,0 Z2014367714,CC(C1)CN1C(Cn(cc1)c(cc2)c1cc2OC)=O,0 Z2884742281,CN(C1)C(CNC(c2ccc(-c3ccccc3)[nH]2)=O)CC1O,2 F6803-0162,Cc1cnc(C)c(OC(CC2)CCN2c(sc2ccc3)nc2c3S(C)(=O)=O)n1,2 E591-1013,CC(c(cc1)cc2c1OCCO2)NC(CCc1nnc(cc2)n1nc2N1CCOCC1)=O,2 V004-2887,CCN(C(CN1C(CC(C)C)C(Nc2cc(C)cc(C)c2)=O)=C(C(c2cc(Oc3ccccc3)ccc2)N2)C1=O)C2=O,2 SB52-1520,CC(C)c1nc(C(C2)N(C)CC2(CC2)CCN2C(N(C)C)=O)no1,0 Z385420850,COc(cc1)ccc1C(c1cccs1)=O,0 S691-1045,Cc1cnc(CC(CC2)CN2S(c2cccs2)(=O)=O)n1Cc1ccccc1,2 Z2256277798,CC(CCC1)c(cccc2)c2N1C(c(cc1)nc(C)c1C(O)=O)=O,2 J007-1326,CC(C)c1noc(C(CCC2)N2C(Nc(cccc2)c2OC)=O)c1,0 F6557-1942,O=C(c1nc2ccccc2nc1)N(CCC1c(cccc2)c2Cl)CCS1(=O)=O,2 Z3759773740,CCC(C)(CC1)CN1c1nnc(C(N2CCCC2)=O)n1CCC(N1CCCCC1)=O,2 F455-0327,CC(C)c1ccc(C(C(c(cc2)ccc2OC)=C2O)N(CCc(cc3)cc(OC)c3OC)C2=O)cc1,0 F5319-1784,CCN(C(C=C1)=O)N=C1C(NCCOc(cc1)nnc1-c1ccco1)=O,2 F6556-4543,COC(CNC(Nc1c(C(F)(F)F)cccc1)=O)c1cc(cccc2)c2o1,0 Z2098353484,Cc1nc(CCCC2NC(CC3(CC3)C(F)(F)F)=O)c2cn1,2 F6521-8894,OC(CNC(Cc1cccc2ccccc12)=O)(C1)Cc2c1cccc2,2 F3275-0033,CC(C)c(ccc(C)c1)c1OCC(CNCc1ccccc1)O,0 Z1934777281,CC(C)(CN(C1)C(c2csc(NC(C)=O)n2)=O)C1O,0 Z2832191576,CC(CCOC)NC1c(cccc2)c2OC2(CCOCC2)C1,2 Z991523012,Clc1nc2ccccc2c(NCc2ccncc2)n1,2 F6473-0514,Cc1cc(C(N(C2)CC2N(CC2)Cc3c2scc3)=O)no1,2 Z2915701585,Cc1c(C(NCC2(CO)NCCOC2)=O)nc(-c2cccc(C(F)(F)F)c2)o1,2 F6445-0340,O=C(c1cc(Oc2ncccc2)ccc1)N(CC1)CCN1S(C1CC1)(=O)=O,2 Y043-5192,CC(C)C(c1nc(cccc2)c2n1C)NC(C(C1)CN(Cc2ccco2)C1=O)=O,0 Z1862426990,CC1CN(Cc2csc(NC(c3cc(CNC(C)=O)ccc3)=O)n2)CCC1,0 T787-6313,CS(N(C1)CC2(CCOCC2)C1C(NCCc1ccncc1)=O)(=O)=O,0 Z1445129351,CC(C(Nc(cc1)c(C)cc1OCC(O)=O)=O)Oc(cc1)ccc1OC,0 F1827-0078,CCN(CCN(CC(N(C(C1)c2ccc(C)cc2)N=C1c1cccs1)=O)C1=O)C1=O,2 F6619-5602,FC(c1cc(Br)c(N(CC2)CCN2c2ncncc2)nc1)(F)F,0 F6727-5860,O=C(C=C1)N(C(CC2)CCN2c2nc(cncc3)c3s2)N=C1c1ccccc1,2 F6403-3019,O=C(COc(ccc(Cl)c1)c1Cl)NCCc1csc(-n2nccc2)n1,0 F6359-3501,O=C(NC(c1ccccc1)c1ccccc1)N(CC1)CCC1Oc1nnccc1,2 Z3175064764,Cc1cc(Cl)ncc1NC(N(C1)CC1(F)F)=O,0 V013-8592,CCC(Nc(cc1)cc(CN(CC2OCCC2)C(c(cc2)ccc2F)=O)c1N(C)C)=O,0 F6472-7873,Cc1cccc(NC(N(C2)CC2N(CC2)Cc3c2cccc3)=O)c1,2 F5854-0507,Cc(cccc1)c1NC(N(CCc1ccccc1)Cc1ncccc1)=O,0 F6795-5243,Cc1cc(CN2CCC(COc3c(C)c(C)nc(SC)n3)CC2)no1,2 Z1609558106,Cc1cccc(C)c1C(NCCOc(cc1)ccc1C(O)=O)=O,0 F5897-0107,O=C(c(cc1)cc2c1OCO2)Nc1cccc2ccc(-n3cncc3)nc12,2 Z1948660614,CN(Cc1cnccc1)C(C1(CCC1)S(C)(=O)=O)=O,2 G765-0268,O=C(NCCN(CC1)CCN1c(cccc1)c1F)NC(C1)COc2c1cccc2,0 F3083-0105,CCC(c(cc1)ccc1OCC(CN(CC1)CCN1c(cccc1)c1F)O)=O,0 F6363-0465,COc(nc1)ncc1NC(Nc(ccc(F)c1)c1F)=O,0 F6359-2969,CN(C)S(c(cc1)ccc1C(N(CC1)CCC1Oc1nccnc1)=O)(=O)=O,0 F6237-1593,OCCN(Cc1ccccc1)C(c1nn(-c(cc2)ccc2F)nn1)=O,0 S069-4449,Cn1cnc(S(N(CC2)CC2c2noc(-c3ccncc3)n2)(=O)=O)c1,2 F6443-9518,O=C(c(s1)ccc1Cl)NC(CC1)CN1c1ncc(C(F)(F)F)cc1,0 Z343606310,COCc1cccc(NC(c(cc2)ccc2-n2c(cccc3)c3nc2)=O)c1,0 F6791-9260,CCc1nnc(C(CC2)CCN2c2nc(ccc(F)c3)c3o2)s1,2 Z285710616,CC(C)c1nc(C)cc(N(CC2)CCN2c2nccc(C(F)(F)F)n2)n1,0 S688-0902,COCCC(CC1)(CCN1S(c1cccc2nsnc12)(=O)=O)NS(C)(=O)=O,0 F6295-1083,O=C(NCc1nn(C2CCCC2)c(-c2ccncc2)c1)NCc1cccs1,2 T854-0270,CN(C)CCN([C@@H](CCCC1)[C@]1(CC1)C(NCCc2ncccc2)=O)C1=O,2 V022-3697,OC(CN(CC1CC1)CC(N(CC1)C(COc2ccccc2)c2c1scc2)=O)c1ccccc1,2 Z3140532875,CCc([nH]c1ncc2)nc1c2C(NC(CC1)CCC1(C1)C1N)=O,2 Z4107123992,C[C@H]1O[C@@H](C)c2nn(C)c(C(N(C)CC(N3)=Nc(cccc4)c4C3=O)=O)c2C1,0 S664-0264,COC(CC1)C1(CC1)CCN1S(c(cc1)cc2c1OCCO2)(=O)=O,0 Z2960670385,CCc1noc(COCC(N2[C@@H](COC3)[C@H]3OC(C)(C)C2)=O)n1,2 Z4619797689,C[C@H](C(NCCN(C1CC1)c1ncnn2c1ccc2)=O)c1ccccc1,2 Z2199592118,NC(N1CC(CNc2ncc(-c3ccccc3)nc2)CCC1)=O,2 Z4205655011,O[C@H](CN[C@H]1C(N(CC2)CCN2C(CCN2c3ccccc3)C2=O)=O)[C@H]1O,2 Y041-4330,Cc1nc(ccc(C(N(CC2)CCN2C(CC2)CS2(=O)=O)=O)c2)c2s1,2 F6619-2935,O=S(c1ccccc1)(N(CC1)CCC1Nc1ncnc(C(F)(F)F)c1)=O,0 F6671-3340,COCc1cn(C(CC2CC3)CC3N2S(c(cc2)ccc2OC(F)(F)F)(=O)=O)nn1,0 Z2627264848,CCOc1cc(C)c(CN(CC2)CCN2c2nccnc2C)cc1,0 F3062-0288,CCOC(C(CCC1)CN1c(c(cccc1)c1n1nn2)nc1c2S(c1ccc(C)cc1)(=O)=O)=O,2 Z2297216862,CC(C)(C)c1ccc(C(CC2)CCN2C([C@H](CCC2)N2C(N)=O)=O)cc1,0 D337-0444,CC(C)c1ccc(CN(C(CC2)CS2(=O)=O)C(c2noc(-c3ccc(C)cc3)c2)=O)cc1,0 Z2225971206,CC(COc(cccc1)c1F)NC(CC1)CCC1NC(COc(cc1)ccc1Cl)=O,0 SA66-1118,Cc1nn(C)cc1C(N1CC(CCc2noc(C3CCOCC3)n2)CCC1)=O,0 F5621-0261,Cn1c(cccc2)c2nc1CN1CCN(CC(NCc2ccco2)=O)CC1,2 Z2976158984,CC(C)(COc(ccc(Nc1nccn2nnnc12)c1)c1N1C)C1=O,2 F5780-0197,CS(NCC(CC1)CCC1C(N(CC1)CCN1c1ncccn1)=O)(=O)=O,2 5785-1359,O=C(Nc(cc1)ccc1F)N(CC(C1)CN23)CC1C3=CC=CC2=O,0 P257-1163,CN(CC1)CCN1c(ncnc1)c1N(CC1)CCC1C(N1CCCCC1)=O,2 T505-0727,CN(C)C(c1cn(CCC(CCCC2)N2C(c2ccc(Cn3cncc3)o2)=O)nn1)=O,2 S431-0042,COc1ccc(CNC(N(CC2)CCC2(C2)OCCC2N2CCOCC2)=O)cc1,2 F3350-0922,COc(cc1)cc(NC(c2cnc(c(C(F)(F)F)ccc3)c3c2O)=O)c1OC,0 Z4026285114,CN(C)C(C(C1)CN1C(C(CC1=O)CN1c(cc1)cc(OC)c1OC)=O)=O,0 Z2068105822,CCC(C(O)=O)(c(cc1)ccc1Cl)NC(c1ccc[nH]1)=O,0 F6363-0466,COc(nc1)ncc1NC(Nc(cc1)cc(C(F)(F)F)c1Cl)=O,0 F6549-9485,COc1cccc(C(N(C2)CC2N2CC(CCC3)C3C2)=O)c1,2 Y044-0913,Cc1noc2nc(C3CC3)cc(C(Nc3cc(OC)cc(OC)c3)=O)c12,2 F3394-0721,O=C(CSc1nnc2n1cccc2)c(cc1)cc2c1OCCO2,2 Z1481908036,O=C(Cc1cn(cccc2)c2n1)NOCc1cnccc1,2 Z3203815467,NC(C(C1)CN1C(C1OCCc2c1cccc2)=O)=O,2 SC04-0887,Cn1c(C(N(CCC2)CC2OCCc2noc(COC)n2)=O)cnc1,2 Z3101687147,Cc1c(C(C2)OCCN2C(C(CN)C2COCC2)=O)cccc1,2 F6548-0970,COCCN(C(c(ccc(C(N(CC1)CCN1c1cccc(C(F)(F)F)c1)=O)c1)c1N1)=O)C1=O,0 F6435-0773,O=C(C1(CC(C2)C3)CC3CC2C1)N(CC1)CC1S(c1ccccc1)(=O)=O,2 F6812-2054,N#Cc(cc1)ncc1N(CC1)CCN1c1nc(-c2ccncc2)ccn1,2 Z2911846399,Cc1c(C(O)=O)oc(C(N(C)CCc(cc2)cc3c2OCO3)=O)c1,0 C096-0335,CC(CCC1)CN1C(CN(C=Nc1c2c(S(N3CCOCC3)(=O)=O)c(C)s1)C2=O)=O,0 F6089-9706,CC(N(CC1)Cc2c1ccc(NC(NCC1OCCC1)=O)c2)=O,2 F824-0002,O=C(Nc1ccccc1)N(CC1)CCN1S(c(cc1)cc(N2)c1OCC2=O)(=O)=O,0 Z432914706,CC(c(ccc(F)c1)c1F)NC(C(Cc1cc(F)ccc1)n1nnnc1C)=O,0 V006-2220,CC(C(c1c(C)[nH]c(C(OC)=O)c1C)=O)N(CC1OCCC1)C(C1CCC1)=O,2 F5893-0501,CCOc1ccc(cccc2NC(c3nccnc3)=O)c2n1,2 F2774-3994,COCCN(C(C=C1)=O)N=C1c(cc1)ccc1Cl,0 Z3417053349,CC(C)CNC(c1cccc2c1CN(C(CCC(N1)=O)C1=O)C2=O)=O,0 SB21-0919,Cc1cc(C(N(C2)[C@H](Cn3nnc(C(N)=O)c3)C[C@@H]2F)=O)c(C)n1CCCOC,0 F5669-0197,O=C(Nc1cccs1)N(CC1)CCN1c1ncnc(N2CCOCC2)c1,2 F6438-1818,Cc1cc(CNC(Nc(cc2)cc3c2OCCO3)=O)nc(N(C)C)n1,2 F6608-0745,Cc1nc(OC(CCC2)C2N(C)C)cc(C(F)(F)F)n1,2 Z2960795522,Cc1c(CCNC(c2cc(c(N(C)C)ccc3)c3s2)=O)cncc1,2 E542-2439,O=C(CCc1cn(Cc(cccc2)c2F)c2c1cccc2)NC1CCN(Cc2ccccc2)CC1,2 F0528-0234,Cc1cc(-n2c(SCC(c3ccccc3)=O)nnc2CNC(c(cc2)ccc2OC)=O)c(C)cc1,2 F6724-5208,COC1(CNc2c(cc(cc3)Cl)c3ncn2)CCSCC1,2 Z1161399116,Cc1cc(C(c(cccc2)c2C(N2CCC(CC(N3CCN(C)CC3)=O)CC2)=O)=O)c(C)cc1,2 F6802-6977,CS(NC1CN(CC(Nc(cc2)ccc2F)=O)CCC1)(=O)=O,0 Z1864221033,Cc1c(C(NC(C2)CC2(F)F)=O)nnn1-c(cc1)cc(Cl)c1F,0 Z1079166428,Cc1ncc(CN(C)Cc(cc2)ccc2C(O)=O)s1,0 F5854-4524,O=S(c(cccc1)c1Cl)(N(CCc1cccs1)C1CC1)=O,0 Z1391280702,O=C(c(cc1)nnc1N1CCCC1)NC(CC1)CN1c(c(F)ccc1)c1F,0 P277-1098,CSc(cc1)cc(C(Nc2cccn3c2nnc3C2CCC2)=O)c1Cl,2 F3407-5164,O=C(Cc1cccc(F)c1)N(CC1)CCN1c1cc(-c2ccccc2)n[nH]1,2 Z2482869630,CS(N(CCC1)CCN1C(C(O)=O)c1c(C(F)(F)F)cccc1)(=O)=O,0 Z2950150892,CCC(c1c(C2)cccc1)N2C(Nc1c(C)n(CCOC)nc1C)=O,2 F431-0083,CN(c(c(N1C)c2)cc(NC(c3cc(OC)cc(OC)c3)=O)c2SC2CCCCC2)C1=O,0 8015-2860,OC(CC(c(cc1)ccc1Cl)NC(C1CCCCC1)=O)=O,0 Z1082691194,O=C(c(cc1)cn2c1ncc2)Nc1ccncc1,0 5646-0289,O=C(Cn1c(ccc(Br)c2)c2c(C(C(F)(F)F)=O)c1)N(CC1)Cc2c1cccc2,0 F0915-2687,O=C1NC(SCc(cccc2)c2Cl)=NC=C1,0 F6748-0547,CCOc1cccc2c1nc(N(C)C(C1)CN1c1nccnc1)s2,2 SA65-1099,O=S(Cc1ccccc1)(N1CCC(CCc2noc(C3CCOCC3)n2)CC1)=O,2 F6573-7418,Cc(nc1)cnc1C(N(CCN1c2cnccc2)CC1=O)=O,2 Z1067435748,Cc(ccc(NC(c1ccnn1C)=O)c1)c1C(N)=O,0 Z1578079229,CC(C(c(cc1)ccc1F)OC)NC(Nc(cc1)ccc1N(C)C(C)=O)=O,0 Z2943357541,Cc1c(C(N[C@H](CNC2)[C@H]2O)=O)nc(C)s1,2 Z3847822207,CN(C(c1ccccc1)c(cccc1)c1Br)S(c(cc1)ccc1C(N)=O)(=O)=O,0 G551-0371,CC(C)C(c1ccc(C)n1CC1)N1C(Nc(c(OC)c1)cc(Cl)c1OC)=O,0 F6471-2061,O=C(Cc(cccc1)c1Cl)N(C(CC1)C2)C1c1c2ncnc1,2 E570-4437,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(N(CC1)CCC1C(N1CC(C)CC(C)C1)=O)(=O)=O,2 F823-0169,CC(C(Nc1c2)=O)Oc1cc(S(N(CC1)CCN1C(NC1CCCCC1)=O)(=O)=O)c2Cl,2 Z1716517415,OCCNC(c(cc1)c(C(F)(F)F)cc1Cl)=O,0 SD68-0879,Cc1noc(C)c1CCC(N1CC(C(N(Cc(cc2)ccc2F)CC2)=O)N2CCC1)=O,2 F2595-0047,CCOC(C(C1c(cccc2)c2F)=C(N)OC(C=C(C)N2Cc3ncccc3)=C1C2=O)=O,2 F1142-3590,Cc1nc(SCC(NCC2OCCC2)=O)c(c(CCC2)c2s2)c2n1,2 M459-4916,CCC(C)NC(CSc1nc(N(CC2)CCN2c2c(C)ccc(C)c2)ccn1)=O,0 M566-1001,CN(c1ccnn11)C(C(CC2)CCN2S(c2cc(F)cc(F)c2)(=O)=O)=CC1=O,2 SB91-0494,Cc1nn(C)cc1C(N(CC1)CC1N(CCN1CCOCC1)S(C)(=O)=O)=O,0 F6441-7050,Cn1c(S(C(CC2)CCN2C(CCc(cccc2)c2Br)=O)(=O)=O)nnc1,0 SB74-0179,CC(C)N(CC1)C[C@@]1(C[C@@H](C(NCCN(CC1)Cc2c1cccc2)=O)N1)C1=O,2 F0646-1583,Fc1cccc2c1nc(Nc1nc(cccc3)c3s1)s2,2 Z4909204098,CC(C)c(cc1)ccc1-n1nnc(CN(C)C(C(C2)C2C2C(C)C2)=O)c1,2 Z1445392246,C[C@H](C(O)=O)NC(C(CCN1c(cc2)ccc2F)C1=O)=O,0 Z2597403367,COC1(CCN(Cc2cccc(C(O)=O)c2Cl)CC1)c1nc(C2CC2)no1,0 Z3415238969,CC(C)CN(CC1)CCC1(C1)Oc2cn(C3CCCC3)nc2C1O,0 F6203-0751,Cc(cc(cc1)F)c1S(NCCC(CCO)c1cccs1)(=O)=O,0 Z1258738819,Cc(c1c2)noc1ncc2C(NCC1(CCCCC1)O)=O,0 Z2357907729,O=C(C1(CCCC1)C(F)(F)F)N(CC1)CC1NC(NC1CC1)=O,2 F6374-1473,Cn1c(SCC(CC2)CCN2C(NCc2cccs2)=O)ncc1,2 Z2146613197,Cn1cnc(CNCC(c(cc2)cc(F)c2Cl)O)c1,2 Z3077815337,Cn1c(C(CC2)(CCN2c2nccc(OC)n2)OC)ncc1,0 M788-4647F,CCc1noc(CN(C(CO2)=C(C(c(cc3)ccc3OCC)N3)C2=O)C3=O)n1,2 P894-0064,COc(cccc1)c1OCCNc1nnc(-c2nc(C3CC3)no2)c2ccccc12,2 Z2947385413,CC(C)c1nsc(CN(CC2)CC(C)(C)S2(=O)=O)n1,0 M338-0147,CCN1C(CNC(c2nc(-c(cc3)cc(OC4)c3N(C)C4=O)no2)=O)CCC1,2 F541-0722,CC1=Nc(cc(cc2)-c3noc(/C=C/c4cccs4)n3)c2N(C2CCCC2)C1=O,2 F6550-4371,O=C(c1ncccc1)N(C1)CC1Nc1ncccn1,2 C301-8636,Clc(cc(cc1)Nc2c(CCC3)c3nc3ncnn23)c1N1CCOCC1,2 Z1982287350,CN(C(CCN1c(cccc2)c2F)C1=O)C(C[C@H](CCCC1)[C@@H]1O)=O,2 Z2902367938,Cc1cccc(N(CC2)CCN2C([C@@H]2[C@H](CC3)N[C@H]3C2)=O)c1,2 Z1175230925,CCN(C(CCN1c2ccccc2)C1=O)C(c(cc1)nnc1N1CCCC1)=O,0 8010-6438,OC(C1NC(c(cc2)ccc2C(O)=O)SC1)=O,0 F6443-4177,O=C(c(c(F)ccc1)c1F)N(CC1)CCC1(c1c2cccc1)OC2=O,0 Z5023653589,CC(CN(C)c1ncnc2c1cc[nH]2)NC(c1c2[nH]ccc2ccc1)=O,2 V019-9973,CCN(C(CN1C(Cc2ccccc2)C(Nc2cc(C)c(C)cc2)=O)=C(C(c2cc(Oc3ccccc3)ccc2)N2)C1=O)C2=O,2 F6312-0288,O=C(C1CC=CCC1)NCCCn1c2ncccc2cc1,2 F6573-2617,O=C(c1cc(cccc2)c2o1)NCCOCCn1nccc1,2 Z382879058,CC(C)c1noc(CCC(NCC2(CCCCC2)N2CCOCC2)=O)n1,2 F6471-2740,O=C(Cc(c(F)ccc1)c1Cl)N1C2C=CCC1CC2,0 C304-2151,CCC1=Nc(cc(cc2)C(NC3CCCCCC3)=O)c2Sc(cc2)c1cc2Br,0 F6748-6212,FC(c1nccc(N2CC(COc3ncccn3)CCC2)c1)(F)F,0 Z2948096428,NC(C(CCCC1)N1C(c(ncc(C(F)(F)F)c1)c1Cl)=O)=O,0 Z319079196,Cc1nc2ncnn2c(NCC(CCC2)c3c2cccc3)c1,0 F3366-5230,O=C(Cn1c(cccc2)c2nc1CN1CCCCC1)N1CCOCC1,2 F6441-6462,CC(C)c(cc1)ccc1OCC(N(CC1)CCC1S(c(cc1)ccc1OC)(=O)=O)=O,2 Z2852093794,CCN(C=CN=C1N[C@H](CC2)CC[C@H]2O)C1=O,0 F6806-6984,O=C(C(C1)OCCN1c1ncncc1F)N1CCSCC1,0 P657-0860,CC(C)CN(CC1)CCN1S(c1ccc(-c2nnc(C3CCC3)o2)o1)(=O)=O,2 Z3044671738,NC([C@H](C1)C[C@H]1NCC(c(cc1)cc(F)c1F)O)=O,0 C785-0248,O=C(CN(C1=O)N=Cn2c1cc1c2ccs1)N1CCCCCC1,2 F6419-0080,O=C(c(cc1)cc2c1OCO2)N1CC(c2cc(Cl)cc(Cl)c2)OCC1,2 Z2368693612,NCC(CC1)(CCN1c1c2sccc2ncc1)O,0 F784-0335,O=C(C1=Cc(cccc2)c2OC1=O)Nc(cc1)cc2c1[nH]c(CCc1ccccc1)n2,2 Z2482983274,OC(c1c(CN(CC2)CCN2c2c3sccc3ncn2)cco1)=O,2 2188-1858,CSC(NC(CC1c(cc2)ccc2Cl)=O)=C1C#N,0 SC68-0089,Cn1c(C(CN(Cc(ccnc2)c2F)C2)C22CCCCC2)nnc1,2 F6573-6403,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CCC1(C1)C1(F)F,2 SC55-1165,COc1cc(F)c(CN(C2)CC2(CN(Cc2ccccc2)C2)C2c2nc(C3CC3)n[nH]2)cc1,2 F6184-0528,O=C(c(o1)ccc1Br)N(CC1)CCC1c1cscc1,2 SA59-0787,O=C(Nc(cc1)cc2c1OCCO2)N(CCN1CCCC1)C1CCOCC1,2 Z2996226016,Cc(nc1)cnc1NS(CCC1CC1)(=O)=O,2 SC11-1202,CC(C)C(N(CCCN1CCCC1)C(CCC1)CN1C(c1ccc(C)s1)=O)=O,0 SA46-0338,CN(CC1)CCN1C1COC(C2)(CN2C(Cc2cscc2)=O)C1,2 Z1675696693,C[C@H](C1)O[C@@H](C)CN1S(c(o1)ccc1Br)(=O)=O,0 Z1067431792,Cc(ccc(S(C)(=O)=O)c1)c1C(Nc(cc1)ccc1-c([nH]c1ccc2)nc1c2Cl)=O,0 F5317-0552,CN(C=C1OC)C(C(Nc2nc(ccc(Cl)c3)c3s2)=O)=CC1=O,2 F6523-0039,O=C(c1noc(-c2cnccc2)c1)NC(CC1)CCN1c1cc(C(F)(F)F)ncn1,2 F2792-0049,Cn1nnc2c1ncnc2N(CC(C1)CN23)CC1C3=CC=CC2=O,2 Z241877744,COc(c1c2[nH]c(C(N3CCCC3)=O)c1)ccc2OC,0 F6564-3804,CC(C(Nc1cc(C(OC)=O)ccc1)=O)N1N=C(C2CC2)C=CC1=O,0 Z1331807803,CCNc1nc(C(NC2CC2)=O)cs1,0 F5791-0995,Cc1nc(-c2cc(NC(C3(CCCC3)c3cccs3)=O)ccc2)cs1,2 Z3083543421,Cc1cc(COCC(N2c(cccc3)c3OCCC2)=O)no1,2 F6374-1787,COc(cc1)ccc1SCC(CC1)CCN1C(NCc1cccs1)=O,2 SD56-0802,O=C(CCc1nc(cccc2)c2[nH]1)N(CCC1)CC(C(N2C3CCCCC3)=O)N1C2=O,2 Z2465881206,Cc(cccc1)c1N(CC1)CCN1c(ccc(S(N)(=O)=O)c1)c1C(O)=O,0 V030-4267,CC(C)(C)CC(NCCc1nc(-c(cc2)ccc2Cl)no1)=O,0 V017-4851,CC(C)CN(CC(COC)O)CC(N1)=Nc(sc2c3CCCC2)c3C1=O,0 Z849297952,CC(c(cc1)ccc1Cl)N(C1CC1)C(CCCCNC(N)=O)=O,0 Z2387263396,OC(CN(CCCCC1N2CC(CN3CCCC3)CC2)C1=O)=O,2 F6237-4238,Cc(cc1)cc(CCC2)c1N2C(c1nn(-c(cc2)ccc2Br)nn1)=O,2 Z2834690439,CC(C)Oc(cc1)ccc1NC(N1c2c[nH]nc2CCC1)=O,0 F6764-1519,Cc1nc(CN(CC2)CCC2c2ccc(cc(cn3)Cl)c3n2)co1,2 Z2256352294,CC(C)C(C)(CC(O)=O)NC(c(cc1)cc(OC)c1F)=O,0 Z1241702594,Cc1noc(NC(N(CCC2)CCS2(=O)=O)=O)c1,2 F6439-0912,COc1cccc2c1oc(C(NCCn(c1c3CCCC1)nc3-c1ncccc1)=O)c2,2 Z1330663339,OC(CC1)(CN1C(NCCCn1cncc1)=O)C(F)(F)F,0 SB29-0588,CCn1ncc(CN(C[C@H](C2)OCc3cc(C)ccc3)[C@@H]2c2n[nH]c(C)n2)c1,0 F6709-4218,COc(ccc(C(N(C1)CC1Oc1cc(C(F)(F)F)ncc1)=O)c1)c1F,0 Z2899011773,CCOc1cccc(CNC(CNC2C3(CCC3)NCC2)=O)c1,0 Z3133984623,O=C(c1c2nc(CC3CC3)[nH]c2ncc1)NC1(CCC2)C2NCC1,2 Z1583412294,Cc1c(C)sc(S(Nc(cc2)nn2-c2ncccc2F)(=O)=O)c1,2 Y031-3447,CC(C1)N(C(CCS(Cc2ccccc2)(=O)=O)=O)c2c1cccc2,2 S529-0294,O=C(CN(CCCc1c2cnc(C3CC3)n1)C2=O)NCCN1CCOCC1,2 K261-2257,Cc(cc1)c(C)cc1N(C(N(Cc1cc(C(F)(F)F)ccc1)c1c2cccc1)=O)S2(=O)=O,0 F6445-6531,O=C(c1ccno1)NCc(cccc1)c1-c1cscc1,2 S932-7362,O=C(c1nccc2ccccc12)N(CC1)CC1n1nnc(COc2nccnc2)c1,2 E864-0070,O=C(NCc1ccco1)N(CCc1c2[nH]c3c1cccc3)C2c(cccc1)c1F,0 F3406-8608,CCNC(c1nc(C(N(CC2)CCN2c2cc(C)ccc2)=O)cs1)=O,0 D466-0013,CC(c1ccccc1)N1Cc2nc(cccc3)c3n2CC1,0 S512-0052,COc1ccc(CNC(N(CC2)CC2Oc2ccccc2)=O)cc1,0 F6451-2158,COC(CNC(c(ccc(F)c1)c1F)=O)c1cc(OC)ccc1,0 F6773-4760,Cc1cnc(C)c(OC(CC2)CCN2c2ccnc(SC)n2)n1,0 Z363081250,OC(c(cc1)ccc1S(N(CC1)CCC1C(Nc(cc1)ccc1F)=O)(=O)=O)=O,0 F6441-4121,COCCNC(N(CC1)CCC1S(Cc1ccco1)(=O)=O)=O,0 F0223-0048,O=C(c(cc1)ccc1S(N1CCCCC1)(=O)=O)OC/C=C/c1ccccc1,2 Z2203562448,CCS(Cc1nc(-c2cn(C)nc2C(F)(F)F)no1)(=O)=O,0 F820-2038,O=C1Oc(cc(cc2)S(N(CC3)CCN3c3ccccc3)(=O)=O)c2N1Cc1noc(C2CCC2)n1,2 SC45-0987,CC1n2nnc(CNC(C3(CC3)c3ccccc3)=O)c2CN(Cc2ccccc2)C1=O,0 S431-1291,CN(CC1)CCN1C1CC(CC2)(CCN2C(CCc2c[nH]c3c2cccc3)=O)OCC1,2 V022-9920,CCCN(CC(COC)O)CC(N(CC1)C(COc(cc2)ccc2OC)c2c1scc2)=O,0 Z1578657272,Cc1nscc1C(NCC1CN(CCc2ccccc2)CC1)=O,2 SC69-0765,O=C(CCCc1c[nH]c2c1cccc2)N(C1)CC2(CCCC2)C1c1nncn1C1CC1,2 Y044-4463,c12C(N(\C=N/c1scc2)CC(N1CC2\C=3\N(C(\C=C/C3)=O)CC(C1)C2)=O)=O,2 Z2445033264,Cc1ccc(-c2nn(C)cc2CN(CCC2)C[C@@H]2N)o1,2 SC46-0225,CC(C)S(N(C1)CC2(CCCC2)C1c1nc(C2CC2)n[nH]1)(=O)=O,0 SC66-0741,O=C(COc(cc1)ccc1F)N(C1)CC2(CCOCC2)C1c1nncn1CC1CC1,2 Y020-3062,COc1cc(CCN(C2)C(CC(N3c4cccc(Cl)c4)=O)C3=O)c2cc1OC,0 Z2983059238,Cc1cn(CC(COc(ccc(Cl)c2)c2Br)O)nn1,0 F6247-2073,CCOC(C(CCC1)CN1c(nc1)nc(NC(N2Cc(cccc3)c3F)=O)c1C2=O)=O,2 Z3215927378,CCOCCS(N(CC1)CCC1c1nc(C)c(C(O)=O)[nH]1)(=O)=O,0 C464-0809,CCC(N(CC1)c(cc2)c1cc2S(NC(C(C)C)C(Nc(cc1)ccc1OC(F)(F)F)=O)(=O)=O)=O,0 Z749927732,CC(C1CC1)NC(NCc1cc(O)ccc1)=O,0 F5283-0006,O=C(c(cc1)cc2c1OCO2)NCCN1N=CC=CC1=O,2 Z4438322360,CCN(c(cccc1)c1N1CC(Nc(cn2)cnc2Cl)=O)C1=O,2 F3244-0388,CCOc(cccc1)c1NC(c(cc1)ccc1-n1nnnc1)=O,0 Z2982762830,CCOCc1cn([C@H](C)c(cc2)c(C)cc2F)nn1,0 Z2878630068,CN(CCC1)[C@@H]1C(NC(Cc1ccccc1)C(OC)=O)=O,0 L799-0937,CN(c(ccc(S(N1CCC(CC(Nc(cc2)cc3c2OCCO3)=O)CC1)(=O)=O)c1)c1O1)C1=O,2 F6614-4667,Cn1c(cccc2)c2c(C(N2CCOCCC2)=O)c1,2 L228-0939,O=S(c1ccc(-c2cnc(C3CCC3)o2)s1)(NC1CCN(Cc2ccccc2)CC1)=O,2 F3072-0058,Cc1cc(NC(C(CC(C2)C3)(CC2C2)CC23c2ccccc2)=O)no1,2 SC15-0502,COCC(C1)CN(CC(CC2)CCN2C(Nc(cc2)ccc2Br)=O)C1=O,0 K786-3631,O=C(c(cc1)cc(N2Cc3cccc(Cl)c3)c1Sc(cccc1)c1C2=O)NC1CCCC1,2 F3371-0787,O=C(CCN1CCOCC1)N(C(C1)c2cccc(Cl)c2)N=C1c1ccco1,2 Z1522589781,Cc1nc(COc(cccc2)c2C(NCC2(CC3)CC3CC2)=O)no1,2 F5791-1033,CS(N(CC1)CCN1C(Cc1noc2c1cccc2)=O)(=O)=O,0 Z383129120,O=C(CCc1nc(-c2ncccc2)no1)NCc1cc(N2CCCC2)ncc1,2 F6539-3875,O=S(Cc(cccc1)c1Cl)(NCCCc1cc(cccc2)c2o1)=O,2 F6360-9327,O=C(Cc1cccs1)N(C1)CC1Oc1cnccc1,2 7287-0231,Cc1cc(C)nc2c1c(ncnc1N3CCN(Cc(cc4)ccc4Cl)CC3)c1s2,2 Z3544071239,C[C@H](C1)O[C@@H](C)c2c1c(C(NCc1nnc(C3CC3)n1C1CC1)=O)n[nH]2,2 Z906039022,CC(N(CC1)CCC1NC(C(c1ccccc1)Oc(cc1)ccc1Cl)=O)=O,0 P893-0069,Cc1nnc(-c(c2ccccc22)nnc2N(CC2)CCN2c2c(C)c(C)ccc2)o1,0 T202-0002,COc(ccc(-c1nn(CCCN(C2)S(c3cnccc3)(=O)=O)c2c1)c1)c1OC,0 SC89-0153,O=C(CCCc1c[nH]c2c1cccc2)N(C1)CC1(C(CN1CCCC1)CC1)S1(=O)=O,2 F3316-0142,CC(CC(Nc(cc1)ccc1C(C)=O)=O)n1nc(C)c(C)c1C,0 Y021-1070,CCOc(cc1)ccc1Nc1nc(-c2c(C)cc(C(C)CC(C)(C)N3)c3c2)ccn1,0 F6284-0450,CN(C)c(cc1)ccc1C(NCCc1cnc(-c2ccccc2)nc1)=O,0 Z1168426142,CCc1nc(cc(cc2)NC(CCN3c4ccccc4)C3=O)c2o1,0 Z2067444520,COc(ccc(Cl)c1C(O)=O)c1NS(c1cscc1)(=O)=O,0 Z1900869652,Cc1c(C(N2CCCC2)=O)nnn1Cc1noc(C)n1,0 Z2936916000,OC(c1cnc(C(CC2)CCN2C(OCCCF)=O)o1)=O,0 Z3826822189,CC(CCC(N1Cc(cccc2OC)c2OCC1)=O)c1ccccc1,2 F0882-0464,CCCCCOc(cc1)ccc1C(Nc1noc(C)c1)=O,0 SA46-2204,CN(Cc1ccccc1)C1COC(C2)(CN2C(c2cc([nH]cc3)c3cc2)=O)C1,2 D731-0778,OC(Cc(cc1)ccc1NC(C(Cc1c2cccc1)OC2=O)=O)=O,0 Z1874955135,COc1cc(NC(Nc2nn(Cc3cccc4cccnc34)cc2)=O)ncn1,0 S698-0891,Cc1cnc(C2CC2)n1C(CC1)CCN1S(c(cc1)cc2c1OCCO2)(=O)=O,2 Y206-4735,Cc(cccc1c(C(Nc2c(C(N)=O)c(CCCC3)c3s2)=O)c2)c1nc2-c1ccncc1,0 F2145-0740,CN(CC(O)=O)c1nc(ccc(OC(F)(F)F)c2)c2s1,0 F6523-0667,CC(C)(C)OC(N(CCC1)C1C(NC(CC1)CCN1c1ncnc2c1CCCC2)=O)=O,2 Z353977360,Cc1ncc(-c(cc2)ccc2NS(c2c(C)ccc(Br)c2)(=O)=O)o1,0 F6523-3905,O=C(c(cc1)cc2c1ncs2)N(CC1)CC2=C1N=C(C=CC(F)=C1)N1C2=O,2 Z2937093501,NC1(CNC(c(cc2)cc(Br)c2Cl)=O)CC1,0 F6412-1676,CC(Nc(cc1)ccc1C(NCC#CCOc1cccc(C(F)(F)F)c1)=O)=O,0 T622-0425,CC(C)CN(CC1)CCN1C1CC(CC2)(CCN2C(c2cc([nH]cc3)c3cc2)=O)OCC1,2 Z1436000667,Cc1c(CC(Nc2nc(C(F)(F)F)c[nH]2)=O)cccc1,0 F6454-0218,O=C(C1CC=CCC1)NCC(CC1)CCN1c1cnccc1,2 Z2720082429,CC1(CCCC1)C(CNC(c1c(-c(cc2)ccc2OC)ocn1)=O)=O,2 S700-0529,CCC(C)NC(N(C1)CC1c1nc(CCOCC2CCCC2)no1)=O,2 F6724-5138,Brc1cnc(NCC(CC2)CCN2C2CCSCC2)nc1,2 F2325-0227,CCc(cc1)ccc1NC(CS(c1ncc(-c(cc2)ccc2OC)n1C)(=O)=O)=O,2 Z2878282053,Cc1c(CNC([C@H]2N(C)CCC2)=O)c(C)nn1-c1c(C)cccc1,2 F6439-4197,O=C(NCCn(cc1)nc1-c1ccncc1)Nc1ccc(C(F)(F)F)cc1,2 F5857-7692,CC(CNC(CN(c(cccc1)c1O1)C1=O)=O)(c1cccs1)O,2 F6764-3362,O=S(c(cc1)ccc1-n1nccc1)(N1Cc2cc3cccnc3nc2CC1)=O,2 F6554-0285,Cn1nc(C(CC2)CCN2C(Cc(cc2)cc3c2OCO3)=O)cc1,2 E717-0300,CCCn1c(C(N(CC(NCCN(Cc2ccco2)C2CCCC2)=O)N=C2)=O)c2c2c1cccc2,2 Z997617316,CC(C)c(c1c2)noc1ncc2C(NCc(cc1)cc(Cl)c1F)=O,0 F2254-0456,Cc1cccc(NC(C(CCCC2)N2S(c2cccs2)(=O)=O)=O)n1,2 Z3016325586,CCC(C1CCCCC1)NC(c1nn(cc(CCO)cn2)c2n1)=O,2 F5532-0019,CC(C)C(N(CCC1)c2c1ccc(NC(Nc(cc1)cc3c1OCO3)=O)c2)=O,2 F6805-3726,CC(N1CC2CCN(CC(C=CN3C)=CC3=O)CC2)=Nc(cccc2)c2C1=O,2 F6514-3122,COc(ccc(F)c1)c1S(N(C1)CC1OCC(F)(F)F)(=O)=O,0 G274-0309,O=C(C(CC1)CCN1c(cc1)nnc1-c1cccs1)NCCCN(CC1)Cc2c1cccc2,2 Z3063571515,CC(C)n1nc(C)c(S(Nc(cc(cc2)O)c2F)(=O)=O)c1C,0 F6441-3331,CC(C)CS(C(CC1)CCN1C(c(cc(cc1)OC)c1Br)=O)(=O)=O,0 F0187-0005,CC(Nc1nnc(-c2c(C)c(C)cc(C)c2C)s1)=O,0 F6529-0242,CN(c(cccc1)c1N1C(CC2)CCN2C(c2cc(ccc(OC)c3)c3[nH]2)=O)S1(=O)=O,2 F5004-0081,CN(c(sc(C(N(CC1)CCN1c1cccc(Cl)c1)=O)c1)c1C(N1C)=O)C1=O,0 J006-2918,CCc1c(C2N(Cc(cccc3OCC)c3O)CCC2)c(C)no1,0 Z370312576,CCOc(cccc1)c1C(N(CCC1)C1C(NCC(c1ccccc1)O)=O)=O,0 SA73-0903,C(C1CC1)C1(CCN(Cc(cc2)cc3c2OCCO3)CC1)c1noc(-c2cnccc2)n1,2 G664-0523,Cc1ccc(C)n1-c1c(C(NCCN(C)C2CCCCC2)=O)sc2ncccc12,2 Z3501462851,CC(c1noc(CNC(C)=O)n1)Oc(ccc(Br)c1)c1Cl,0 SC88-2004,COc1ccc(Cc2noc(C(CC3)C(C4)(CN4C(c4c[nH]nc4)=O)S3(=O)=O)n2)cc1,2 SC03-0458,Cn1ncc(CN(CC2)CCC2OCCc2noc(C3CCOCC3)n2)c1,0 F6677-0757,CC(C)c1nccn1CC(C1)CN1S(c1c(C)ccc(Cl)c1)(=O)=O,0 E692-1566,CC(CC1)CCN1S(N(CCC1)CC1C(N(CC1)CCN1c1c(C)ccc(C)c1)=O)(=O)=O,0 Z1343471887,Cc(n(C(CC1)CS1(=O)=O)nc1C)c1NC(N(CC1)Cc2c1scc2)=O,2 Y200-4100,Cc1ccc(CNC(c2c(NC(COCC(O)=O)=O)sc3c2CCCC3)=O)cc1,0 F2879-5050,O=C(C(Nc(cc1)ccc1OC(F)(F)F)=O)NCc1ccco1,0 Z57822141,C(CC1)CCC1c1nc(-c2ncccc2)no1,2 F5475-0108,O=C(C1(CC1)c(cc1)ccc1F)Nc1cccc(Cl)c1Cl,0 F6744-6567,CN(C(CC1)CCN1c1cnc(cc(cc2)Cl)c2n1)c1ncccc1,2 F2960-0158,O=C(Cc(cc1)ccc1F)Nc(cc1)c2scnc2c1Cl,2 G824-0168,OC(CC(c1ccco1)=O)(c(cc(cc1)Br)c1N1)C1=O,0 F3407-0256,COc1ccc(C(CN(CC2)CCN2C2CCCCC2)O)cc1,0 F6412-2221,O=C(C(c1ccccc1)c1ccccc1)NCC#CCOc(cc1)cc2c1OCO2,2 F3375-2906,CC(C)c1c(C(NCc(cccc2)c2OC)=O)nnn1-c1ccc(C)cc1,0 Z1155219084,COc1c(C(c2ccccc2)NC(C(CSC2(CC3)c4ccccc4)N2C3=O)=O)cccc1,2 F680-0695,Cc1ccc(CN(c(cccc2)c2N=C2SCC(NCCc3c[nH]c4c3cc(C)cc4)=O)C2=O)cc1,2 Y042-3427,COc1cccc(NC(C(CC2=O)CN2c(cc2)cc3c2OCCO3)=O)c1,0 Z1217860682,CC(C)(c1nccs1)NC(c1c[nH]nn1)=O,0 SA43-0878,CN(CC(C1)(CN1C(c1cscn1)=O)C1)C1c1nc(-c2ccncc2)no1,2 F6427-0265,CC1Oc(cccc2)c2OC1C(NCCN(C(C=C1)=O)N=C1n1ncnc1)=O,2 F6656-2264,C(C1CCN(Cc2noc(C3CC3)c2)CC1)Oc1nnc(CCC2)c2c1,2 F2507-0057,O=C(CSc1nnc(cc2)n1nc2-c1ccco1)N1CCCC1,2 Z4368059434,CC(C(NS(C)(=O)=O)=O)c1cc2ncccc2cc1,0 F2493-3063,Cc1cc(C(NCc2noc(-c(cc3)cc(OC)c3OC)c2)=O)c(C)o1,0 F6793-7483,O=C(CC1)Nc(cc2)c1cc2S(N1CCN(CC(F)(F)F)CC1)(=O)=O,2 Z1523304854,CC(C)(c(cccc1)c1Br)NC(c1c(C)nc(C)o1)=O,0 Z3367295047,CC1(CNCc2cnc(N3CCN(C)CC3)nc2)COC1,2 F6439-2276,COc1cccc(NC(NCCn(c(C2CC2)c2)nc2-c2cccs2)=O)c1OC,2 F5033-3655,CCCc1c(C(NCC(CC2)CCN2C(Oc2ccccc2)=O)=O)snn1,2 F5788-2164,O=C(CN(CCN1c(cc2)cc(F)c2F)C1=O)Nc1c(C(F)(F)F)cccc1,0 SB24-0319,CN(C)C(c1cn(C(CC2)C2(CC2)CCN2C(CC2CCCCC2)=O)nn1)=O,2 Z401440106,N#Cc(c(F)ccc1)c1N(CC1)CCN1S(c(cc1)cc(C(N2)=O)c1NC2=O)(=O)=O,0 F5095-0870,O=C(C(Oc1c2cccc1)=CC2=O)N(CC1)CCN1c1nccn1-c1cccc(Cl)c1,2 Z4890206677,CC(C(Nc(ccc1n2)cc1c(C)cc2O)=O)c1cscc1,0 Z2961780840,Cc1c(C(NCc2cc(Br)cc(OC)c2)=O)n(C)nc1,0 F2238-0391,Cc(cc1)ccc1N(CCn12)c2nnc1SCC(NCc1ccco1)=O,2 C179-0029,CC(CCc1ccccc1)NC(CSc1nn2c(C)c(Cc3c(C)cccc3)c(C)nc2n1)=O,2 Z1883062764,CC(C)N(CC1CCC1)C(c1cc(-c2ccccc2)c(N2CCOCC2)s1)=O,2 K976-0283,Cc1cccc(N(CC2)CCN2C(c(cc2)cc(N3)c2NC(CSCc(cc2)ccc2Cl)C3=O)=O)c1C,0 Z2453645102,O=C(CCc1ccccc1)N(CC1)CC1NC(C1CC2(CCC2)C1)=O,2 CM3884-0983,CN(CCC1(CCN(Cc2cc(OC)cc(OC)c2)CC1)CC1)C1=O,0 F2375-0631,COc(ccc(N(CC(CNC(NCc1cccc2ccccc12)=O)O1)C1=O)c1)c1OC,2 F383-0929,CCN1C(CNS(c(cc(CN(C(C2C3CCCC2)=O)C3=O)cc2)c2OC)(=O)=O)CCC1,2 8640-0209,CC(C)(C1)OCc2c1c(C(N(Cc1ccccc1)C(N1)=O)=O)c1s2,0 SC73-1271,Cn1nc(C(N2CCCC2)=O)c2c1CC(CC1)(CCN1C1CCOCC1)OC2,2 Z1338088036,O=C(C(C1)C11CCOCC1)NCc1ccc(CN(CCC2)C2=O)cc1,2 Z4402488994,CCN(CC)S(c(cc(cc1)NS(c2cc(OC)cc(OC)c2)(=O)=O)c1Cl)(=O)=O,0 Z4917831028,CN(OC)S(c(cc1)ccc1C(Nc1ncnc(-c(cc2)ccc2OC)c1)=O)(=O)=O,0 Z4924723231,O=S(c1cc(-c2ccccc2)no1)(Nc(cc1)ccc1Cl)=O,0 F0594-2822,C(c(o1)nnc1SCc1cnccc1)c1ccccc1,2 SB75-0045,Cc1ccc(C(N[C@H](C[C@H]2CN(C3)C(COC)=O)C[C@]23c2nc(C)no2)=O)s1,2 Z2218686066,O=C(c(cn1)cc(Cl)c1OC1CCCCC1)NCc1nc(C2CC2)no1,2 F1166-0284,Cn(cc1C(Nc2nc(-c3cc(CCCC4)c4cc3)cs2)=O)nc1OC,2 Z3686679190,CN(C)C[C@@H](C[C@H](C1)O)N1c1cc(N(CC2)CCC2c2ncco2)ncn1,2 SA99-1577,CCC(CC1)(CCN1S(c(cc1)cc(C2)c1N(C)C2=O)(=O)=O)C(N)=O,0 Z1129802243,CCN(CC(N(CC1)CCN1c1c(C(N)=O)c(C)c(C)nn1)=O)c1ccccc1,0 Z3353234429,CC(C)(C)C(CCC(N(CC1)Cc2c1nc(N)nc2)=O)=O,0 SC68-0131,CCn1c(C(CN(Cc2c(C)ccs2)C2)C22CCCCC2)nnc1,2 Z2947862666,CC1OCC(C2)(CC2NC(C(NCCc(cc2)cc(F)c2OC)=O)=O)C1,0 Z1783845521,COc1ncc(Cc2noc(C(C3)(Cc4c3cccc4)O)n2)cc1,2 F184-3050,CCC1Oc2cc(S(N(CC3)CCC3C(N(CC3)c4c3cccc4)=O)(=O)=O)c(C)cc2NC1=O,0 F6573-1803,Cn1ncc(-c2nccnc2CNC(c2cc(cccc3)c3s2)=O)c1,2 F6675-7494,Cc1nc2ncnn2c(NC(C2)CN2c2ncccc2)c1,2 Z2962279467,CC(C)(C)c1nn(CCN(C2)C(CCF)=O)c2c1,0 SA24-1842,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1cc(C)n[nH]1)=O,0 SC56-0008,CCS(N(C1)CC1(CN(Cc1ccccc1)C1)C1c1nnc(C)o1)(=O)=O,2 SC72-2294,CCCc1nc(COC2(C3)CN3C(CCn3cncc3)=O)c2cn1,2 F6442-7067,O=C(c(cc1)ccc1-n1cccc1)N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F,2 Z2443289035,CC1(CC1)S(N(C)CCCN)(=O)=O,0 SB66-1157,Cc1ccc(CS(N(C[C@H]2CCC3)C[C@@H]2N(Cc2ccccc2)C3=O)(=O)=O)cc1,0 Z1530926891,CC(c(cc1)c(C)cc1NC(c1ccc(C(F)(F)F)cc1)=O)=O,0 F6675-8062,Cc1ccnc(N(C)C(C2)CN2c2nccnc2)n1,0 Z3216018533,CC(c1c(C)oc(N=CN2CCCCC3CCOCC3)c1C2=O)=O,2 Z2802224742,O=C(c1cc(cc(cc2)Cl)c2[nH]1)N1CC(Cn2nncc2)OCC1,0 Z2366048490,O=C(NC1C(C2)C(CCC3)C3C2C1)NC(COC1)c2c1cccc2,2 S593-0623,O=C(Nc(cc1)cc2c1OCCO2)N(CCC1)C1c1noc(COc(cc2)ccc2F)n1,2 SC72-1174,Cc(cc1)cc(Cl)c1NC(N(C1)CC11OCc2c1cnc(C1CC1)n2)=O,0 F3053-0542,CCOc(cccc1)c1N(CC(C1)C(Nc(cccc2)c2Cl)=O)C1=O,0 V020-4144,CC(C)CCN(CC(COc1c(C)cccc1)O)CC(N1)=Nc(sc(C)c2C)c2C1=O,2 Z2437347409,Cc1noc(CCNS(c(cc2)cc(OC)c2C(O)=O)(=O)=O)n1,0 Z1719072462,CCC(C)NC(Nc1nc(-c2c(C)ccs2)ns1)=O,2 F6057-0303,CCOC(CCC(N1CCN(CCn2nc(C)cc2C)CC1)=O)=O,0 F2816-0287,Cc(cc1)c(C)c2c1sc(NC(CSc(cc1)ccc1OC)=O)n2,0 S614-1024,O=C(C1CCCCC1)N(CCCC1)C1c1nc(CCOCC2CCOCC2)no1,2 J501-0143,Cc1c(CN2CCCCC2)c(C(N(CC2)CCC2Nc2nccnc2OC)=O)no1,2 F5834-4701,CC(C)Sc1ccc(CC(Nc2ccc(CC(NC3CC3)=O)cc2)=O)cc1,2 Z406540794,CN(C)C(c(cc1)ccc1NC(c(cc1-c2ccccc2)nn1-c1ccccc1)=O)=O,2 Z2783604943,CCC(CCC1)(CN1C(c([nH]1)cc2c1nccc2)=O)O,0 Z4660720240,Cc1cccc(C(CC(N[C@@H](CCC2)[C@H]2c2ccc(C(F)(F)F)cc2)=O)NC(N)=O)c1,2 Z1362829202,CCN(C1)Cc2c(C(O)=O)c3ccccc3nc2C1=Cc1ccc(C(OC)=O)[nH]1,2 G827-0206,Cc1c(CCC(NCCC2=CCCCC2)=O)c(C)nn1-c(cc1)nn2c1nnc2C,2 C137-2154,COc1ccc(CNS(c(cc(c(CC2)c3)N2C(C2CC2)=O)c3Br)(=O)=O)cc1,2 Z3063544840,CCNC(CCC(NCc1cc(Br)cnc1)=O)=O,0 Z2446628180,Cc(cc1)ccc1C(N(C[C@@H]1C(O)=O)C[C@@H]1c1ccccc1)=O,0 F6442-7215,O=S(c1cnccc1)(N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F)=O,2 F5854-4308,O=C(Nc(cccc1)c1F)N(Cc1cscc1)C1CC1,0 F2331-0030,CCOC(c(cccc1)c1NC(CSc1ncc(-c2ccccc2)[nH]1)=O)=O,0 F6760-2501,O=C(c1nnc(CCCC2)c2c1)NCc(cc1)ccc1Br,0 SA24-1466,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1ccncc1)=O,0 F6549-3947,Cn1nccc1C(CCCC1)N1C(C(CCC1)N1c1nc(cccc2)c2o1)=O,2 Z952980078,CC(CC(NC(Cc1ccccc1)C(N)=O)=O)c1ccc(C(F)(F)F)cc1,0 F6604-9344,O=C(c1c2OCCOc2ccc1)N1CC(CN(C(C=C2)=O)N=C2c2cnccc2)C1,2 Z3414266421,CC(C)n1nccc1C1(CCC2C1)C2C(N(C)Cc(cc1)ccc1OC)=O,0 Z3416123430,CC[C@@H](CN(CC1)CCC1c1c(CN(C)CC2)n2c(C)n1)O,0 Z3179193739,Cc1nn(C(CCC(O)=O)(CCC2=O)N2c2c-3cccc2)c3n1,0 Z1888438545,CN(CCC1(CC2)CCN2C(NCc(cccc2)c2Cl)=O)C1=O,2 Z3299509125,O=C(CCN1CCCCC1)NC[C@@H](C[C@H]1CC2)C[C@H]2N1c1nccn2nnnc12,2 F5139-0372,CS(N(CC1)CCC1C(Nc(ccc(Br)c1)c1C(c1ccccc1)=O)=O)(=O)=O,2 Z1724472232,CCCc([nH]nc1)c1C(N(CCC1)CCN1C(c(cc1)ccc1F)=O)=O,0 F6473-4372,COc1ccc(CNC(N(C2)CC2N(C(C2C3CC=CC2)=O)C3=O)=O)cc1,2 Z3001204343,CCn1nccc1C(N=S(C)(C(C)(C)C)=O)=O,0 J037-0147,CC(C(Nc1c(C)cc(C)cc1)=O)Sc1cc(C)c(cc(cc2)S(N3CCOCC3)(=O)=O)c2n1,0 F3229-0183,COc(cc(cc1)Br)c1NC(C(CC1)CC1C(O)=O)=O,0 Y204-7359,Cc1c(NS(c(cc2)ccc2N(C(c2c3cccc2)=O)C3=O)(=O)=O)onc1C,2 F6444-6731,Cc(c(S(N(C1)Cc2c1cnc(N1CCOCC1)n2)(=O)=O)ccc1)c1Cl,0 F3386-0665,CC(N(CC1)CCN1S(c(cc(cc1)OC)c1OC)(=O)=O)=O,0 F5234-0086,Cc1cccc(Nc(cc2)nnc2N(CC2)CCN2C(Nc(cc2)cc(Cl)c2F)=O)n1,0 8019-0535,Cc(ccc(N(CCC1)C1=O)c1)c1S(NC(CCO1)C1=O)(=O)=O,2 F6414-1165,CC(C)Sc1ccc(CC(NCC(CC2)(Cc3c2cccc3)O)=O)cc1,0 CM4670-0007,CCOc(cccc1)c1NC(N(CC1)CCC1(CN(C)C1)C1c1nnc(C)o1)=O,0 F6241-0363,COC(c1c(NC(C(COC2)N(Cc3ccccc3)C2=O)=O)scc1)=O,2 Z1344320492,Cc1cscc1C(N(C(CC1)C2)C1CNC2=O)=O,2 S519-1776,COc1cc(OC)c(CN([C@@H](COC2)C(Nc(cc3)cc4c3OCCO4)=O)C2=O)cc1,2 SC39-0132,Cc1noc(C)c1CC(N(CC1)CC1(c1nc(C2CCOCC2)no1)F)=O,2 Z2783015451,CC(C1)OC(C)C1NC(c1cc(NC(CCn2cncc2)=O)ccc1)=O,2 Z7991078284,N[C@@H](C1)[C@@H](C2)[C@@H]2[C@@H]1C(NCC1CC=CC1)=O,2 Z2055474513,CO[C@H](C[C@H]1COc2cnccc2)CN1C(COC1CCCCC1)=O,2 SB70-0058,CN(C)[C@@H](Cc1c2)Cn1nc2C(N(CC1)CCN1C1CCCCC1)=O,2 F6677-1399,CCc1nccn1CC(C1)CN1C(c1cccc(SC)c1)=O,0 Z2505786249,CNC(c(cc1)cc(NCc2c(C3CC3)cccc2)c1Cl)=O,2 F6245-3107,O=C(NC(c1ccccc1)c1ccccc1)N(CCC1)CC1c1nnc(-c2cscc2)o1,2 D750-1201,O=C(CC1(CCN(Cc2ccccc2)CC1)N(Cc1c2cccc1)C2=O)NCC1OCCC1,2 Z2971093241,CNC(c1cccc(CCNC(N(C2)CC2N(CCC2)C2=O)=O)c1)=O,0 F6472-4107,Cc(cc1)c(C)cc1N(CC(C1)C(N(CC2)CCC2Oc2nc(cccc3)c3o2)=O)C1=O,2 F6524-0908,CC(C)(Cc1ccc2)Oc1c2OCC(NCCN1N=Nc(cccc2)c2C1=O)=O,2 F5596-0661,O=C(c1ccccc1)c(cccc1)c1C(N(CC1)CCC1c1nnc(C2CC2)o1)=O,2 Z1426136270,CC(c(cc1)cc(C2)c1NC2=O)NC(c1cnc2n1cccc2)=O,0 S331-0102,CC(C)CCN(CC1)CCC1C1CN(Cc2cccnc2)CC1,2 Z1310413472,CN(c(cccc1)c1N(Cc1nnnn1-c(cc1)ccc1OC(F)F)CC1)C1=O,0 Z2303753205,O=C([C@H]1[C@H](CC2)O[C@H]2C1)NOCC1CC1,2 Z4252257678,Cn1nc(C2CC2)nc1CNC(c1cc(Br)cc(OC2)c1NC2=O)=O,2 F5526-0137,O=C(COc(cc1)cc2c1OCO2)NCCOc(cc1)ccc1F,0 Z1677991714,CCC(C)(CNC(Nc(cn1)c(C)c(Br)c1Cl)=O)O,0 Z2991621980,CCn1ncc2c1N=CN(CCOc(cc1)cc(Cl)c1F)C2=O,0 SB15-0829,CCn1nc(C)c(C(N(CCC2)CC2N(C2CCOCC2)S(C)(=O)=O)=O)c1,0 SA46-0169,O=C(CCc1nc(cccc2)c2s1)N(C1)CC1(C1)OCC1N1CCCC1,2 F6814-6646,CC(C1)N(Cc(cc2)cnc2OC)CCN1c1nc(cccc2)c2o1,2 V012-7650,CC(c1ccccc1)NC(CN(CC1)CCN1c1c(C)cccc1)=O,0 Z1269182939,Oc1ccc2ncc(Br)cc2c1,0 2766-0202,CC(C)Oc1ccc(C(CC(N2c(cc3)ccc3OC)=O)C2=O)cc1,2 Z2230833757,Cc1cnc(C(N(CC2)CCC2(CO)c2ccccc2)=O)c(C)c1,0 Z1284575564,CC(CNC(N(CC1)CCS1(=O)=O)=O)Oc(cc1)ccc1Cl,0 Z1591899077,OCC1(CCC1)NS(c(cc(s1)Cl)c1Cl)(=O)=O,0 F1472-0132,Cc(ccc(S(C(F)(F)F)(=O)=O)c1)c1N(C(c1c2cccc1)=O)C2=O,0 Z3411116161,CC(C)(C)OC(CN(CC1)CCC1n1nc(C)nc1N)=O,0 F6752-3763,O=C(C(C1)OCCN1c1nnc(C2CC2)cc1)N(CC1)CCC1(F)F,2 Z2754058069,OCC1(CNCC(CC2)CCS2(=O)=O)CCC1,2 F2493-0593,CC(C)c(cc1)ccc1OCC(NCc1noc(-c2cc(OC)ccc2)c1)=O,0 F6726-1688,Cc1cc(C(N(C)C2CN(Cc3noc(cc4)c3cc4Cl)C2)=O)no1,2 F6277-0228,O=C(C1CCC1)N(CC1)CCN1c1nc(c(C(F)(F)F)ccc2)c2s1,2 F3328-0111,CC(C)c1nc(C)cc(SCC(N2CCOCC2)=O)n1,2 P392-2131,CN(C)C(c1cccnc1OC(CC1)CN1S(c1cc(CCC2)c2cc1)(=O)=O)=O,2 F6672-1690,CC=C(CC1CC2)CC2N1c(nc(CCC1)c1c1)c1C#N,2 Z2069970143,CC(C)c1nn(C)cc1CNC(C(CC1)CCN1c(ccc(C#N)c1)c1F)=O,0 Z2313139085,Cc1c(CN2CC(Cc(cc3)ccc3F)C2)c(C)n[nH]1,2 F5581-3147,O=C(CSc(cc1)ccc1F)N(CCn1nccc1)c1nc(c(C(F)(F)F)ccc2)c2s1,0 Z1763969303,CCC(C#N)Sc1nnc(-c2c(C)occ2)n1CC=C,0 Z3296480261,Cn1nccc1[C@@]1(CC[C@@H]2C1)[C@@H]2C(NOC1OCCCC1)=O,2 F6481-1959,O=C(c1nc(cccc2)c2s1)N(CC1)CCSC1c(cc1)cc2c1OCO2,2 SB91-0743,O=C(CCc1ccccc1)N(CCN1CCCC1)C1CNCC1,0 Z1743969139,Cn1c(ncnc2NCc3cc(C(N)=O)co3)c2nc1,0 F6190-0391,COc1c(CNC(C(NCCC(C2CC2)O)=O)=O)cccc1,2 F6791-8283,C(C1)C1c1nnc(C(CC2)CCN2c2ccnc3ccccc23)o1,2 S694-0598,Cc1cnc(C2CCOCC2)n1C(CC1)CN1C(CCc1c(C)onc1C)=O,2 Z2370867359,Cn1nc(CNC(N(CC2)CC2C2CCCC2)=O)c(Br)c1,2 T499-0384,CCCn1c(nccc2)c2nc1C(CC1)CN1C(c1ccc(C(F)(F)F)s1)=O,2 F2496-1425,CCSc(cccc1)c1C(OCc1noc(-c2ccco2)c1)=O,0 P113-1150,O=C(c1csc(N(CC2)CCN2c(cc2)ccc2Cl)n1)NCCCN(CCC1)C1=O,2 F3083-0378,COc(cc1)ccc1NC(CN(CC1)CCN1S(N1CCCCCC1)(=O)=O)=O,2 F6672-0665,Cc1noc(C)c1S(N(C(CC1)C2)C1CC2n1ncc(Br)c1)(=O)=O,2 Z2440315422,CC(C1)NCCN1C(c(cc1)ccc1-n1nc(C)c(Br)c1C)=O,0 Z1275957021,CCN(CC)C(CC1)CN1C(c(cc(cc1)S(N(CC)CC)(=O)=O)c1Cl)=O,0 V024-4246,CCOc(cc1)ccc1N(C(c(ccc(Cl)c1)c1N1C(C)C(NC2CC2)=O)=O)C1=O,0 E786-1269,CCOC(c1c(C)n(CC(CC2)CCC2C(NCc2cnccc2)=O)c(C)c1)=O,2 F6530-0383,COC(C(C(NCc(cccc1)c1OC(F)(F)F)=O)=C1N2CCC1)=CC2=O,2 Z4619432587,CN(C)c1cccc(Cn(c2c3cc(ccc(OC)c4)c4n2)nc3N)c1,2 Y040-2361,Cc(oc(c1c2)cc(O3)c2C(C)=C(CC(NCCc2c[nH]cn2)=O)C3=O)c1-c1ccccc1,2 Z2224150251,COC(CCC1)CC1C(NS(CC=C)(=O)=O)=O,0 Z1657501303,CC1OCCC1(C)NC(c1n[nH]c(-c(cccc2)c2Cl)c1)=O,2 F6573-5555,O=C(NCc1cnc(C2CC2)cc1)NCc1cccc2ccccc12,2 F6250-0601,Cc(cc1)cc(S(NC(CCC2)CC2OC(Nc(cc2)ccc2F)=O)(=O)=O)c1OC,2 SA46-2225,CN(Cc1ccccc1)C1COC(C2)(CN2C(C2(CC2)c(cc2)ccc2OC)=O)C1,0 Z2475967710,C[C@@H](C(O)=O)N(C)S(c1cnnn1C)(=O)=O,0 Z2911212835,OC1(CC(NCC(CCC2)c3c2ccc(C(O)=O)c3)=O)CCC1,2 F6709-0358,CCc(cn1)cnc1OC(CC1)CCN1c(ncnc1)c1F,0 G539-0049,O=C(Nc1cc(C(F)(F)F)ccc1)N(CCc1c2sc3c1CCCC3)C2c1ccccc1,0 Z1335420351,O=C(c1cc(OCC2OCCC2)ccc1)N(C(CC1)C2)C1CNC2=O,2 C259-1071,CCC(N(CCc1c2)c1cc(S(N(CCC1)CC1C(NC1CCCC1)=O)(=O)=O)c2Br)=O,2 Z2839374262,Cc(ccc(C(Nc1ccccc1)=O)c1)c1NC(CN(CC(C1)C2)C1CC2O)=O,2 F6490-0959,Cc(cc1)nnc1OC(CCC1)CN1C(C(C1)CN(C2CCOCC2)C1=O)=O,2 G603-0680,O=S(c1cc(CCCC2)c2cc1)(N(CCC1)CC1c1nc(-c(cc2)ccc2Br)no1)=O,0 Z1050882518,Cc1cc(C)nn1-c(cc1)nc(C(N(CC2)CC2N2CCCC2)=O)c1Cl,2 Z2994105060,OC(C1)(CN1C(c1nnc(-c2ccns2)o1)=O)C(F)(F)F,2 S691-1010,Cc1cnc(CC(CC2)CN2C(NCc2ccccc2)=O)n1Cc1ccccc1,0 F6524-4753,COc1nccn2c1nnc2CNC(Cn(cc1)c2c1cccc2)=O,2 Z4879346736,COc1ccc(C(CNC(c2cc3nccnc3cc2)=O)CO)cc1,0 F6506-1189,OC(CNC(c1cc(Br)cnc1)=O)(c1ccco1)c1cccs1,0 Z2958030737,CC1(C(NCCc2cnc(C3CC3)nc2)=O)c(cccc2)c2OCC1,2 Y041-0986,O=C(CCC(N(CC1)CCN1c1nsc2c1cccc2)=O)NC1CCCC1,2 SB66-0141,CNC(N(C[C@H]1CCC2)C[C@@H]1N(Cc1cccc(F)c1)C2=O)=O,0 Z1500085916,OC(C1(CNC(c2n[nH]c3c2CCC3)=O)CC1)c1ccccc1,2 S947-0201,Cn1cnc(S(N2C[C@](COC)(CN(C3)c(cc4)cc(C(F)(F)F)c4C#N)[C@H]3CC2)(=O)=O)c1,0 F6363-0799,COc(ccc(Cl)c1)c1C(NCCNc1ncnc(Nc2ncccc2)c1)=O,2 F6724-1208,OC(CNc1nc(cccc2)c2o1)(C1CC1)c1cccs1,2 SC76-0564,O=C(CN(C([C@]1(COc2ccccc2)[C@H]2C1)=O)c1c2cccc1)N(CC1)CCS1(=O)=O,2 Z2763037433,Cc1cn(C2CCOCC2)nc1C(Nc(cc1)cc(OC)c1OC)=O,0 F6442-2542,O=S(Cc1ccco1)(C(C1)CN1S(Cc(cccc1)c1Cl)(=O)=O)=O,2 D076-0015,COc1cccc(CN(C(CC2)CS2(=O)=O)C(COc(cc2)ccc2Br)=O)c1,0 F3406-9952,Cc(cc1)ccc1N(CN1CC(NCc2cccs2)=O)c(nccc2)c2S1(=O)=O,2 F2898-5645,O=C(c(cc1)cc2c1OCO2)N(CC1OCCC1)c1nc(c(C(F)(F)F)ccc2)c2s1,2 F6745-0479,Clc(cc1)cc2c1oc(N(CC1)CCN1c1nsnc1)n2,2 F6729-7427,CN(C(C1)CN1c(cc1)nnc1-c(cc1)ccc1F)c(cc1)cnc1C#N,2 F6497-0400,CC(C)(Cc1ccc2)Oc1c2OCC(N1CC(Cc2nc(C3CC3)no2)CCC1)=O,2 Z1853064990,CCC(C)c1nc(C(C)NC(c2cnc3[nH]nnc3c2)=O)n[nH]1,2 V002-8881,O=S(c(cccc1)c1OC(F)(F)F)(N(CC1)CCN1c(n1ncnc1nc1)c1-c1ccccc1)=O,0 F6482-7432,CSc(nccc1)c1C(NCc1cccnc1-c1cccs1)=O,0 S724-1532,O=C(c1cn(C(C2)CN2S(c2cccc3nsnc23)(=O)=O)nn1)NCC1CC1,2 Z5015110234,CCN(C(C1=CNc(cccc2)c2C1=O)=O)c(cc1)cc(F)c1Cl,0 Z1908063479,O[C@@H](CCC1)CN1c(ncc(Cl)c1)c1Cl,0 Z4872929335,Cc1ccc(-c2nc(COC)no2)c2ncccc12,0 Z594160968,OC(CN(C1CC1)C(CSc(cccc1)c1Cl)=O)=O,2 Z3905996745,CC(C(C(O)=O)O)NC(c1cccc(F)c1)=O,0 Z1607505565,Cc(c(C)nc(SCC(Nc(cc1)cc2c1OCO2)=O)n1)c1O,0 Z1926174721,Cc(cc1)cnc1N(CCC1)CC1C(NC1CCCC1)=O,2 V031-0745,O=C(NCc(cccc1)c1F)N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Cl,0 S984-0868,CC1(CCCCC1)C(N(C[C@H]1CN(C2)C(c3nccnc3)=O)C[C@]12C(N(C)C)=O)=O,2 Z4949555379,CCC(c1c(C)onc1C)NC(C1(C2)C2C1)=O,2 S971-1212,CC(CC1)(C1(CC1)CCN1C(c1c(C)c(OC)ccc1)=O)O,0 C153-0223,CC(CC1)CCN1S(c(cc1)cc2c1oc(C(NC1C(C)CCCC1)=O)c2C)(=O)=O,2 F6178-6544,O=C(C1Oc(cccc2)c2OC1)NCC(CC1)CCN1C(c1cocc1)=O,2 Z2938337543,Cn1nnnc1N(C[C@@H]1CCC2)C[C@]12C(N)=O,2 S740-1139,O=C([C@H](C[C@@H](C1)NS(c2cnccc2)(=O)=O)N1CC1)N(C2CC2)S1(=O)=O,2 Z1650930339,CC(C)c(cccc1)c1Oc(cccc1)c1C(NCC(NC(C)C)=O)=O,0 F2507-0111,Fc1c(CSc2nnc(cc3)n2nc3-c2cccs2)cccc1,2 F2262-0252,CC(C)(COc(ccc(NC(Cc1cccs1)=O)c1)c1N1CC=C)C1=O,2 F6171-0017,O=S(CCOc1ccccc1)(N(CC1)c2c1cccc2)=O,2 F6438-1557,CS(N(CC1)CCN1c1cnnc(N2CCCC2)c1)(=O)=O,0 F5033-7908,O=C(c1cscc1)NCC(CC1)CCN1C(c(cccc1)c1F)=O,2 F6523-1169,CCn1nc(C)c(S(N(CC2)CCN2c2nccn3nc(CCCC4)c4c23)(=O)=O)c1C,2 F6439-1973,CN(C=CC=C1C(NCCn(c(C2CC2)c2)nc2-c2cccs2)=O)C1=O,2 F3411-3401,COc(c(NC(N(CC1)CCC1(NC1=O)N=C1c1cc(F)ccc1)=O)c1)cc(OC)c1Cl,0 Z2982742865,Cc(cc(cc1)Br)c1-n1nnc(CNC(NC)=O)c1,0 F6481-2686,Cc1c(C(CC2)SCCN2C(c2c(C)nccc2)=O)cccc1,0 E958-0843,C(c1cccn1-c1nnc(N(CC2)CCN2c2ccccc2)s1)NCc1cnccc1,2 S615-0298,COc1cc([nH]c(C(N(CC2)CC2c2nc(CCOCC3CC3)no2)=O)c2)c2cc1,2 J031-1576,CC(c(cc1)cc2c1OCCCO2)NC(CSc1nnc(-c(cc2)cc3c2OCCO3)n1C)=O,2 Z1627166918,CCC(C1)OCCC1C(N1C(Cc2ccccc2)CCC1)=O,2 F6395-1841,O=C(c(c(F)ccc1)c1Cl)N(C1)CC1N1CCCC1,0 Z1683884653,CCOc(nccc1)c1-c1noc(C(C2)CN(CC(C)C)C2=O)n1,0 F6764-3573,O=S(C1CC1)(N(CC1)Cc2c1nc1ncc(Br)cc1c2)=O,2 Z2643686180,CCN(C(C)=O)c(cc1)ncc1NC(C1(C)CC1)=O,0 Z2454602484,CC(C(N(C)C1)=O)N1C(C1CC(CCCC2)C2CC1)=O,2 F6477-0223,CN(C=CC=C1C(N(CC2)CCN2c2nc(-c3cscc3)cs2)=O)C1=O,2 Z2907298662,CCC1CN(CC(N(C)Cc2ncc(C)cc2)=O)C1,2 Z1591343178,Cc1c(C(N[C@@H]([C@H](C2)O)c3c2cccc3)=O)sc(C2CCCCC2)n1,2 C547-0204,CC(CCc1ccccc1)NC(COC(c(cccc1)c1N1C)=CC1=O)=O,2 Z3290443446,CCc1nc(cccc2)c2n1C(CCC1)CN1C(NCC)=O,0 Z3104814129,CC(c1nnnn1C)NC(NCc1c(C)ccnc1)=O,2 Z1864094211,C(CN(CC1)c2cccnn2)C1Nc1nccnc1,2 S471-1275,Cc1nc(N(CC2)CCC2C(NCC2OCCC2)=O)cc(C(F)(F)F)n1,2 V030-3711,Cc(cc1)cc(CN(CCc2nc(N3CCOCC3)n3)Cc2c3Oc(cc2)ccc2F)c1F,0 F2758-2907,O=C(Cc1cccs1)NCC(c1c2cccc1)=NN(CCN1CCCC1)C2=O,2 F6441-5679,CSC(CC1CC2)CC2N1C(Nc1ccc(C(F)(F)F)cc1)=O,0 Z2164667958,Cn1c(ccc(C(F)(F)F)c2)c2nc1CN1CCC(CN2CCN(C)CC2)CC1,2 Z2997886927,CN(CC(c1nc(-c2c(C(F)(F)F)ccc(F)c2)no1)NC1)C1=O,0 Z1578738097,CN(C)c1cccc(OC[C@@H](c(cc2)ccc2Cl)O)c1,0 Z651437484,CC(C)Oc(ccc(C(NC(CC1)CCN1C(c1ccncc1)=O)=O)c1)c1OC,0 Z1317776196,CC(C)(CN(C)C(c(cnn1C)c1-n1cccc1)=O)O,0 F6451-0761,Cc1ccc(C(CNC(c(cc2)ccc2-c2cscc2)=O)OC)s1,2 Y041-6168,CN(C(C(C1)C(N(CC2)Cc3c2[nH]c2c3cccc2)=O)c2ccccc2)C1=O,2 F6724-4104,COC(CNc1ncnc2cnccc12)c1ccco1,2 Z4619442527,CN(C)c1cccc(C(n(c(c2cc3c4)nc3ccc4OC)nc2N)=O)c1,0 S929-4432,CC(C)Cc1nnc(CC(CC2)CN2C(CCCc2ccccc2)=O)o1,2 F6554-0254,Cn1nc(C(CC2)CCN2C(c2cc(ccc(OC)c3)c3[nH]2)=O)cc1,2 Z907840344,CCOC(C)C(Nc1c(CCC2)c2nn1C)=O,2 V001-4491,Cc(c(CN(C1CC1)C(C1CCCC1)=O)c1Oc(cc2)ccc2Cl)nn1-c1ccccc1,2 K813-0182,O=C(CC(C1)c(cccc2)c2Cl)C2=C1Nc(cccc1)c1NC2c1cnccc1,0 F3234-0558,Cc(n1CCOCCO)c(C)n2c1nc(N(C)C(N1Cc(c(F)ccc3)c3Cl)=O)c2C1=O,0 Z241829318,CN(CC1)CCN1C(C(Nc1c2cccc1)=CC2=O)=O,2 Z1928159298,O=C(c1nn(C2CCCC2)cc1)NCCC(NO1)=NC1=O,2 SC68-0099,Cn1c(C(CN(C2)C(C3CCOCC3)=O)C22CCCCC2)nnc1,2 F6186-0315,CC(CNS(c(cc(cc1)Cl)c1OC)(=O)=O)(CSC)O,0 V019-8519,CCNC(c1cc(sc(C)c2)c2n1Cc1ccccc1)=O,0 F1280-0005,Cn1c(SCC(c(cc2)ccc2F)=O)nnc1-c1ccncc1,0 F6171-0371,COc(cc1)ccc1OCCS(N(Cc1ccccc1)c1ccccc1)(=O)=O,2 F6252-1621,COc(cccc1)c1OCCNC(c1c(-c2ccncc2)n(Cc2ccccc2)nn1)=O,2 F2075-1107,Cc1nc(N(CC2)CCN2C(COc(ccc(Cl)c2)c2Cl)=O)nc(N2CCCC2)c1,2 S956-0459,CC(C)NC(N(CC1)C(COc2cnccc2)CN1c(cc1)cc(C(F)(F)F)c1C#N)=O,2 Z1255966375,NC(C(c(cc1)ccc1Cl)NC(c1cn(-c(cccc2)c2F)nc1)=O)=O,0 F6514-2793,O=C(CCCC(N(C1)CC1OCC(F)(F)F)=O)c1ccccc1,2 M355-0088,CN(c(ccc(-c1noc(Cc2c[nH]c3c2cccc3)n1)c1)c1O1)C1=O,2 F5852-1560,CCOC(N(CC1)CCC1NC(C(NC(C)(C)C)=O)=O)=O,0 F6808-6093,Cn1ncnc1CN(CC1)CCC1(c1ccccc1)C#N,2 F2496-1154,O=C(c1cccs1)OCc1noc(-c(ccc(F)c2)c2F)c1,0 SD07-0522,CCCNC(NCc1c(COC2(CN(Cc3c(C)onc3C)CC2)C2)n2nn1)=O,2 Z4461555053,CC(N(CC(Nc1cccc(C(NC(N)=O)=O)c1)=O)c1ccccc1)=O,0 F6753-3342,N#Cc(ccnc1)c1N(CCC1)CC1C(N1CCSCC1)=O,0 F6524-5644,CCOc(cc1)nn2c1nnc2CNC(COc1c2OC(C)(C)Cc2ccc1)=O,2 F6523-0086,Cc1nc(cccc2)c2n1CCC(NC(CC1)CCN1c1cc(C(F)(F)F)ncn1)=O,2 F6497-3114,CC(C)(C(N1CCC(CC(N2c3c(C)cccc3)=NNC2=O)CC1)=O)OC(C)=O,2 F3382-3292,Cc1ccc(CNC(C(CC2)CCN2c2c3sc4ncccc4c3ncn2)=O)o1,2 Z1575796763,Cc1cc(C(N(CCC2)C2c2c3OCCOc3ccc2)=O)nn1-c(cc1)ccc1OC,0 F6514-2539,O=C(NC(C1CCOCC1)c1cnccc1)Nc(c(F)ccc1)c1F,0 SA73-0603,Cc1noc(C)c1CN(CC1)CCC1(CC1CC1)c1noc(C2CCOCC2)n1,2 F6438-3063,CCOc(cc1)ncc1C(NCc1nc(OC)nc(OC)n1)=O,0 8015-4271,COc(cc1)ccc1OCC(NC(C1)C=CS1(=O)=O)=O,2 F6443-6342,O=C(CN(C=Nc1c2cccc1)C2=O)NCC(CCC1)N1c1nc(cccc2)c2o1,2 Z2994509173,O=C(c1nnc(-c2cscn2)o1)NC[C@@]1(C2)[C@H]2CCC1,2 Z1603620697,Cc(n(-c1cc(C)ccc1)nc1)c1C(NC1(CCC1)C(O)=O)=O,0 F2482-0097,Cc(cc1)ccc1N(CCN12)C2=NN=C(C(NCC2OCCC2)=O)C1=O,2 Z1546984393,Cc(cc(C(C1)OCCN1c1ncnc2c1cc[nH]2)cc1)c1F,0 D393-0137,Cc1nc2cc(-c(cc3)cc(OC)c3OC)nn2c(N2CCN(C/C=C/c3ccccc3)CC2)c1,0 Z2991906212,CC(C)(c1nn(Cc2c(C)nc(C)s2)nn1)S(C)(=O)=O,0 F5972-0379,Cc(cc(cc1)OC)c1S(NCC(COC)(c1ccccc1)O)(=O)=O,0 F6808-6291,CN(CCC1)CCN1c1cnc(C(F)(F)F)cc1,2 F6804-8528,CC(C)(C)c(cc1)nnc1N(CC1)CCC1C(F)(F)F,0 F6541-1440,O=C(CN(CCO1)C1=O)N(CC1)Cc2c1cccc2,2 Z1443613200,COc(ccc(C(CC(O)=O)NC(CNC(c1cc(cccc2)c2[nH]1)=O)=O)c1)c1OC,2 F5826-0140,COc1cccc(NC(N(CC2)CCN2c2nc(cccc3)c3n2Cc2ccccc2)=O)c1,0 Z1151680014,O=C(c(cc1)cc2c1[nH]cc2)Nc(cc1)cc(CC2)c1N(Cc(cc1)ccc1Cl)C2=O,2 F6559-1523,Cc1c(CCC(NC(CC2)CCC2(F)F)=O)c(C)n[nH]1,2 F6556-7492,CC(Cc1cc(cccc2)c2o1)NC(c1cc(cccc2)c2[nH]1)=O,0 Z4662151241,Cn1ncc(C#N)c1-c1cccc(CO)c1,0 F6788-8067,CN(CC(C1)CN1c(c1c2)ncnc1ccc2F)S(C1CC1)(=O)=O,2 F2252-0145,COc1cccc2c1oc(-c1csc(NC(Cc(cc3)ccc3F)=O)n1)c2,2 Z372570618,Cc(ccc(C(NC)=O)c1)c1NC(c(cc1)cc2c1[nH]c1c2CCCC1)=O,2 S687-1449,COCCc1noc(CC2CC(CC3)(CCN3C(C3(CC3)c(cc3)ccc3OC)=O)OCC2)n1,0 Z1560919401,Cn1c(C(CCC2)N2C(NCCc2nnc3n2CCCCC3)=O)nnc1,2 Z4767388016,COc1cnc(C(Nc(cccc2)c2-c2nc(cccc3)c3s2)=O)c(F)c1,0 SD14-0615,CN([C@@H](CCN(CCCc1ccccc1)C1)[C@@H]1C(N(Cc1cnccc1)C1)=O)C1=O,2 Z1725116958,O=S(c1cn(CC(F)(F)F)nc1)(N1C(Cc(cccc2)c2Cl)CCC1)=O,0 Y041-7747,N1(C(N[C@H](C1=O)CCC(NCc1n(c2c(n1)cccc2)C(C)C)=O)=O)Cc1occc1,0 Z4631703529,CCc1nc(NC[C@H]2[C@H](C3)[C@@H]2CN3C(C2(CC(C3)C4)CC4CC3C2)=O)c2scc(C)c2n1,2 Z1602288520,CC(C1)OCCC1C(NC1CCN(Cc(cc2)cc(F)c2F)CC1)=O,0 Z3045797192,Cc1cnc(CCNC(N(C2)CC3(CCC3)C2N)=O)cn1,2 6133-0032,O=C(Nc1cccc(C(F)(F)F)c1)N(CC1)CCN1C(c1ccccc1)c1ccccc1,0 Z2961139238,C[C@@H]([C@@H](C(F)(F)F)OCC1)N1C(Cn1nc(C)c2cccnc12)=O,2 T500-1285,COc1ccc(CC2CC3(CCN(Cc4ccncc4)CC3)OCC2)cc1,2 Z2238372815,Cn1nc(CNC(c2cnccc2)=O)c(Br)c1,0 F6471-3951,O=S(c(cc1)ccc1OC(F)(F)F)(N(C1)CC1Oc1nccs1)=O,0 Z3416609312,CCC(C)(CO)C(N1CC(CC2)(CCS2(=Nc2ccccc2)=O)OCC1)=O,0 C884-0015,O=C(Cn1c(C(NN=C2)=O)c2c2c1cccc2)N(CC1)CCN1c1ccccc1,0 D044-0038,O=C(c1cccc(Br)c1)Nc(cc1)cc2c1n(CCN(C1)C3CCCCC3)c1n2,2 Z1979119509,Cn(cnc1ccc2)c1c2C(NCC1(CCOCC1)c(cc1)ccc1Cl)=O,2 F0643-0161,COC(c(cccc1)c1NC(CCN(c(cccc1)c1O1)C1=O)=O)=O,0 SB49-0884,NC(C(C1(CCC2)CCOCC1)N2C(c(ccnc1)c1F)=O)=O,2 Z1869771176,OC(CC1(CCCCC1)NC(c1ccnn1C1CCCC1)=O)=O,2 8017-9126,O=C(c1c2)N=C(C=CC=C3)N3c1cc(Cl)c2S(N1CCOCC1)(=O)=O,0 Z1272317771,Cc1nccc(N(CC2)CCS2(=O)=O)n1,0 F835-0736,COc(cccc1)c1-c1noc(CSC(n(c2c3)nc3-c(cc3)cc(OC)c3OC)=NNC2=O)n1,0 Y044-6429,OC(C(C1)NC(CCc2ccccc2)c2c1c(cccc1)c1[nH]2)=O,2 S835-1807,CCOc(ccc(CN(CC1)CCC1(C1)OCCC1O)c1)c1OC,0 F6608-3712,Cn1ncc2c1ncnc2N(CC1)CCC1OCC#CCN(CC1)CCN1c1ccccc1,2 Z3137433858,N[C@H](C1)[C@@H](C2)[C@H]1CC2C(NCCC(CC1)CCC1(F)F)=O,2 Y502-5822,Cc1nn(C(CC(C2CC2)N2C(c3noc(-c4cccs4)c3)=O)C(F)(F)F)c2c1,2 SA01-0960,CN(C)c(nc1)nc(C(CC2)CN2C(Cn2cncc2)=O)c1C(NCCOC)=O,2 Z1269225001,Cn(c(C(O)=O)c1)c(cc2)c1cc2Cl,0 F6436-2570,O=C(c(cc1)cc2c1ncs2)NCC(CC1)CCN1C(Oc1ccccc1)=O,2 Z2636988345,CN(CCC(C1)NC(c(nccc2)c2F)=O)C1=O,2 SC02-0468,COCCC(CC1)(CN1C(COc(cc1)ccc1OC)=O)NC(C1CCOCC1)=O,0 F1905-9016,COc1ccc(C(C(C(Nc2cnccc2)=O)OC2)N(C3CC3)C2=O)cc1,2 Z4066281960,NCC1OCC(CC(NCc2nc(c(F)c(cc3)F)c3[nH]2)=O)C1,2 Z4878375477,O=C(C1c(cc(cc2)Cl)c2NCC1)Nc1cncc2ccccc12,0 Z98651414,COc(ccc(C(CC(O)=O)NC(CCC(N1)=Nc(cccc2)c2C1=O)=O)c1)c1OC,0 Z3523698429,COc1cccc(C(CNC([C@@H]2[C@H](C3)[C@H]3CC2)=O)N2CCCC2)c1,2 SB24-0208,COCCNC(c1cn(C(CC2)C2(CC2)CCN2C(C2(CC2)c2ccccc2)=O)nn1)=O,2 SA67-0901,Cc1noc(C)c1CCC(N1CC(CCc2noc(C3CCOCC3)n2)CC1)=O,2 Z3343120484,CC(CNC(c1ncnc2c1nc[nH]2)=O)c1cc(C)ccc1,0 S963-0146,CNC([C@@H](CN(C)C1)[C@H]1NS(Cc(cccc1)c1Cl)(=O)=O)=O,2 F6813-8018,Cc1nc(C(F)(F)F)cc(N2CCN(Cc(ccnc3)c3F)CC2)n1,0 F6680-9324,Cc1cncc(N2CC(COc3ccncc3)CCC2)n1,2 Z1053374388,Cc1nn(CC(CC2)NC(CN(c(cccc3)c3C(N3)=O)C3=O)=O)c2n1,2 Z1411476052,CC(C(NCC1)=O)N1C(Nc(cc(C)cn1)c1OC)=O,0 F6675-8331,CN(C(C1)CN1c1nccnc1C#N)C(C1Oc(cccc2)c2OC1)=O,2 Z2503819177,CC(c1ccccc1)n(cc1)nc1NC(CC1CNCCC1)=O,2 F516-0379,CSc1ccc(CNC(c(cc2)ccc2Nc(cc2)nnc2-c2cc(F)ccc2)=O)cc1,2 F6463-0212,Cc(onc1)c1C(NCC1(CCOCC1)Sc1ccccc1)=O,2 Z2212802723,O=C(NCc(cc1)cnc1N1CCCCC1)N(CC1)CC11CCN(Cc2ccccc2)CC1,2 Z2365813753,OCC1(CN(CC(COc(cc2)cc(CC3)c2NC3=O)O)CC1)c1ccccc1,2 Z1325303414,NC(N(CCC1)[C@@H]1C(N1CCCN(Cc2ccccc2)CCC1)=O)=O,2 SB27-0062,O=C(C1)NCC2(COCC2)N1C1CCN(Cc2cc([nH]cc3)c3cc2)CC1,2 SA49-1446,O=C(Cc(cccc1)c1F)N(C1)CC11OCC(CC(N2CCOCC2)=O)C1,2 Z2299586640,CC(C(NC(CC1N2CCCC1)C2=O)=O)(c1ccccc1)c1ccccc1,2 SB91-0382,CS(N(CCN1CCOCC1)C(CC1)CN1C(c(cc1)cc(F)c1F)=O)(=O)=O,2 F3406-6452,Cc1cc(Sc2ncnc(N(CC3)CCC3C(NCc3cnccc3)=O)c2)c(C)cc1,2 C682-0882,COc1cccc(CN(C=C2S(c(cc3)ccc3F)(=O)=O)c(ccc(F)c3)c3C2=O)c1,0 F6515-0099,O=C(C1(CCOCC1)c1ccccc1)NCc1cccnc1-c1cscc1,2 Z1445232432,OC(c1c(CNC(c(cccc2)c2Cl)=O)c(cccc2)c2o1)=O,2 F6609-4142,Cc1ccc(C(OCC(N(CC2)CCN2c(cccc2)c2F)=O)=O)s1,0 SB40-0606,CCN1CCC(CC(NC(CN(CC(C)C)CC2(CCOCC2)N2)C2=O)=O)CC1,2 F6279-0297,O=S(c(cc1)ccc1N(CCCC1)S1(=O)=O)(N(Cc1ccco1)Cc1ncccc1)=O,2 Z2998837109,O[C@@H](CNC[C@H](C1)C[C@H]1O)c(cc1)ccc1Br,0 F6435-2131,CCOc(cccc1)c1NC(N(C1)Cc2c1cncn2)=O,0 D629-0177,CCN(C(CC1)CS1(=O)=O)C(Cc1csc(COc2ccc(C)cc2)n1)=O,0 F6619-2131,CN(C(CCC1)C1F)C(c1nc2ccccc2nc1)=O,0 D430-1126,Cc(cc1)c(C)cc1S(N(CC1)CCN1c1nc(C)nc(N2CCOCC2)c1)(=O)=O,0 E216-5297,CCC(C1)Oc(cccc2)c2N1C(Nc(cccc1)c1OC)=O,0 Z2906521133,CC(c(cc1)ccc1S(C)=O)NC(c(cc1)cc(NC(C)C2)c1NC2=O)=O,0 F6525-1362,O=C(c1cc(cccc2)c2s1)NCCn(cc1)nc1-c1nccnc1,2 F153-1292,CCc(ccc(C(C1=C2CCCC1)=NNC2=O)c1)c1S(NC(C)c1ccccc1)(=O)=O,0 L284-2506,Cc1csc(-c2cc(S(N(CC3)CCN3C(c3ccco3)=O)(=O)=O)c(C)n2C)n1,2 Z1341715514,Cc(cc(N)nc1)c1-c(cc1)cnc1OC,0 Z4685004209,O=C(C(Cc1cc(Oc2ccccc2)ccc1)NC1=O)N1c1cc(F)cnc1,2 F6514-9550,CC(C)(C)c(cc1)ccc1S(NCc1c(-c2cnccc2)nccc1)(=O)=O,0 Z1767616778,CC(N1CCN(Cc(cccc2)c2NC(Cc2cnc(C)cc2)=O)CC1)=O,2 F3394-0797,Cc1nc(cc(cc2)NS(c3c(C)ccc(C)c3)(=O)=O)c2s1,2 Z2167808266,Cc1nn(cc(cc2)NC(N3C(Cc4cc(OC)ccc4)CCC3)=O)c2n1,0 Z2265038546,CC(CN(CC1)CC1(C(F)F)O)=Cc1ccccc1,0 F1065-0244,CCOC(c(cccc1)c1NC(CC1Nc(cccc2)c2NC1=O)=O)=O,0 5339-0524,Cn1c(N2CCCCC2)nc(N(C)C(N2Cc3cccc(Br)c3)=O)c1C2=O,2 Z1401731232,CCN(C)C(c1cccc(C(NC(CCN2c(cccc3)c3OC)C2=O)=O)c1)=O,0 8014-7597,O=C(CCC1)N1c1ccc(CN(C(CC2NCCN3CCOCC3)=O)C2=O)cc1,2 F5259-0204,CN(c1nnc(-c(cc2)ccc2NC(c2ccco2)=O)s1)c(cc1)ccc1OC,2 F5854-1755,O=C(c(c(F)ccc1)c1F)N(CCc1cccs1)Cc1cnccc1,0 S399-1958,O=C(CCCN1c2ncccc2OC(c2ccccc2)C1=O)NCCc1noc(-c2ccncc2)n1,2 F6658-6080,Cc1cc(OCC(CC2)CCN2C(Cc2cn(C)c3c2cccc3)=O)ncn1,2 SA24-0317,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(Cn1ncc(C)c1)=O,0 F6253-2921,Cc1c(C(NCc2cccs2)=O)nnn1-c(cc1)cc(C)c1F,2 Z2478831530,Cc1csc(Nc(cc2)ccc2NC(C(CCC2)CS2(=O)=O)=O)n1,2 F5857-3751,OC(CNC(NCc1ccccc1)=O)(C(F)(F)F)c1ccccc1,0 Z2457039918,O=C(c1cnc[nH]1)N(CC1)CCN1c(c(F)ccc1)c1F,0 S646-0875,CC(C)CNC(N(CC1)CCC1N(CC12CCCCC2)C1c1ccncc1)=O,0 F6481-3159,CC1=C(C)N=CN(CC(N(CC2)CCSC2c(cc(cc2)F)c2F)=O)C1=O,2 SB21-1118,CN(C)C(c1cn(C[C@H](C[C@@H](C2)F)N2C(CCCc2nc(cccc3)c3s2)=O)nn1)=O,0 M675-0745,O=C(C1CCC1)NCc1csc(C(CC2)CCN2C(c(cc(cc2)F)c2F)=O)n1,2 Z1603240902,OC(C(CCCC1)N1C(Cc(cc1)cc2c1OCO2)=O)=O,0 Z1315983107,CN(C1CN(Cc2ccccc2)CCC1)C(c(cc1)ccc1S(NC1CC1)(=O)=O)=O,2 F2537-0125,CCOC(c1c(C)cc(NC(CSc2ccc(C)cc2)=O)s1)=O,0 F6250-0197,O=C(c(s1)ccc1Cl)NC(CCC1)CC1OC(Nc1ccccc1)=O,0 Z1618616803,CCC1(CCOCC1)C(NCc1c[nH]nc1C)=O,2 Z2504010794,Cc1c(C)oc(CN(CC2)CCN2S(c(cc2)cc(C)c2Cl)(=O)=O)n1,2 F6293-0058,Cn1nc(CNC(C2=CC=CN(C)C2=O)=O)cc1-c1ccco1,2 Z2447081608,CC1NCCN(Cc2coc(-c(cc3)ccc3S(C)(=O)=O)n2)C1,0 6173-0068,CC(NC(Nc1nc(-c2ccccc2)c(cc(cc2)Cl)c2n1)=N1)=C(Cc2ccccc2)C1=O,2 S649-0457,CC(C)S(N(CC1)CCC1N(C1)C2(CCCCC2)C1OCC1CC1)(=O)=O,0 S529-0302,O=C(CN(CCCc1c2cnc(C3CC3)n1)C2=O)NC1CCCCCC1,2 F822-0160,O=C(C(CCC1)N1S(c(cc1)cc(N2)c1OCC2=O)(=O)=O)Nc(cc1)cc(Cl)c1F,0 F5871-2039,Cc1noc(CNC(Cc(cccc2)c2Cl)=O)n1,0 Y205-0330,COc(cc1)ccc1S(NC(CCC1)c2c1cccc2)(=O)=O,2 Z1232708735,CC(CN(CCN1)CC1=O)CN(CCN1)CC1=O,2 F6549-7227,O=C(NCc(cc1)cc2c1OCO2)N1CC(CN(C(CC2)=O)C2=O)C1,2 S647-0302,CCn1ncc(S(N(CC2)CCC2(C2)C(c3ccccc3)N2C(C)C)(=O)=O)c1,2 F6451-2047,Cc1c(C(CNC(Nc2c(C)cccc2)=O)OC)cccc1,0 F782-1871,CC(C)C(Nc1nc(cc(cc2)NC(C(CC3)CCN3S(N3CCCC3)(=O)=O)=O)c2s1)=O,2 F575-0318,O=C(c1cccc(Nc(cc2)nnc2-c2cccc(F)c2)c1)NC1CCCCCC1,2 Z1325166723,Cc(ccc(NC(C1N(Cc(cc2)ccc2F)CCC1)=O)c1)c1C(N)=O,2 F6658-5776,Cn1c(N2CCC(COc3ncnc(C4CC4)c3)CC2)nc2c1cccc2,2 F6257-5214,Cc1cncnc1N(CC1)CCN1S(c(cc1)cc2c1OCCO2)(=O)=O,2 Z1991824399,CC=CCC(C(O)=O)NC(C(CC1)C(c2cn(C)nc2)N(C)C1=O)=O,2 SB52-0396,Cc1c(CN2CCC(C3)(CN(C)C3c3noc(-c4ccccc4)n3)CC2)scn1,2 Y020-3932,O=C(CC(C1=O)N(CC2)Cc3c2c(cc(cc2)Cl)c2[nH]3)N1c1ccccc1,0 F6506-1206,CC(C)(C(NCC(c1ccco1)(c1cccs1)O)=O)Oc(cc1)ccc1Cl,0 Z2170343360,Cc1cn(C(CC2)CN2S(c2cc(C)ccc2)(=O)=O)nc1,0 S997-1159,COc(ccc(-c1n[nH]cc1CN1C[C@@H](CN(C2)S(C)(=O)=O)[C@]2(CO)CC1)c1)c1OC,0 Z3686125012,CCOc(ccc(CN[C@@H](CC(Cn1cncc1)C1)[C@H]1O)c1)c1F,2 F6573-3376,CC(C(NCCOCCn1cncc1)=O)Oc(cc1)cc2c1OCO2,2 SB47-0943,CC(C)NC(N(C[C@@H]1CN(C2)C(c3cc(F)c(C)cc3)=O)C[C@@]12c1nc(C)n[nH]1)=O,0 F6791-8342,N#Cc1cc(Cl)c(N(CC2)CCC2c2nnc(C3CC3)o2)nc1,2 F2964-0041,CCOC(CSc1ncc(-c(cc2)ccc2OC)n1C)=O,0 F5652-0208,CC(C(NCc1cccs1)=O)N(C(C=C1)=O)N=C1c1ccc(C)cc1,2 F6412-2053,O=C(CSC1CCCC1)NCC#CCOc(cc1)cc2c1OCO2,2 F5596-0994,CN(c1c(C(N2C)=O)n(CC(N(CC3)CCC3c3nnc(-c(cc4)ccc4F)o3)=O)cn1)C2=O,2 Z1848898393,CO[C@H](CN(C1)C(CCc2ccco2)=O)[C@H]1OC,0 F6262-1153,COc1ccc(CCC(Nc2ncnc(OC)c2)=O)cc1,2 SD01-0402,COCCCn(c1c2CN(Cc(cc3)cc4c3OCCO4)CC1)nc2-c1cocn1,0 S625-0782,CC(C)C(N(C[C@@H](C1)O)[C@@H]1c1nnc2n1CCN(Cc(ccc(OC)c1)c1OC)C2)=O,0 Z4616770643,CC(c1cc(C)c(C)cc1)NC(N(CC1)CCC1c1nc(CCC2)c2s1)=O,2 Z2002906236,C(C1)CC1(CC1)C1NC(CC1)CCN1C1CCCC1,2 F6445-7607,COC(C(C(Nc(cc1)ccc1OCc1ccccc1)=O)=CN1c2ccccc2)=CC1=O,2 F5606-0120,CN1CCN(Cc(cc2)ccc2NC(NC2CCCCC2)=O)CC1,2 J093-0897,O=C(c1nn2c(C(F)(F)F)cc(-c3cccs3)nc2n1)NC1CCCCCC1,2 F6512-6026,CN(C)c1cccc(C(N(CCC2)CCN2S(c2cn(C)cn2)(=O)=O)=O)c1,0 F6456-1092,O=C(C(CC1)CCN1c1ncnc(-n(cc2)c3c2cccc3)c1)NCCc1cccs1,2 F6246-0050,Fc(cc1)ccc1-c1nnc(C2CCN(Cc3ncccc3)CC2)o1,2 F6389-1675,Cn1nc(cc(cc2)C(NCc3nc(cccc4)c4[nH]3)=O)c2c1OC,2 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Z2701722509,CC(C)(CN(CC1)C(N[C@@H](C2)[C@H]2c2cscc2)=O)C1OC,2 Y041-2280,c12OC(c3c(c1ccc(c2C)OC(C(NC[C@@H]1CC[C@@H](C(=O)O)CC1)=O)C)ccc(c3)OC)=O,0 C614-6415,O=C(CCc1nc2cccnc2n1Cc1cccs1)Nc(cc1)cc2c1OCCO2,2 F5033-2364,COC(c(cc1)ccc1C(NCC(CC1)CCN1c1ncccn1)=O)=O,0 Z3303387433,CC(CC1)(CN1C(c1cc(Br)cc2c1OCCO2)=O)NC(C(F)(F)F)=O,0 L629-0510,CC(C(CC1)CCN1S(c1cccs1)(=O)=O)C(N1CCOCC1)=O,2 F6456-1009,Cc1nsc(NC(C(CC2)CCN2c2ncnc(-n(cc3)c4c3cccc4)c2)=O)c1,2 SD56-0365,O=C(C(CN(Cc1cc([nH]cc2)c2cc1)CCC1)N1C1=O)N1c1ccccc1,2 F6810-0500,CCN(c(ncnc1N(CC2)CCN2S(C2CC2)(=O)=O)c1N1)C1=O,2 F788-0072,Cc1c(C(NCc(cc2)ccc2F)=O)oc(CC2)c1-c1c2sc(C)n1,0 F6791-8524,Cc1nnc(C(CCC2)CN2c(ncnc2-c3ccccc3)c2F)o1,2 Z3343349363,O=C(c1ncnc2c1nc[nH]2)NCC1C2(CC2)CCC1,2 SC53-0689,Cc1nc([C@@](CN(Cc2ccccc2)C2)(C3)[C@@H]2CCN3S(c2cn(C)cn2)(=O)=O)no1,2 F6276-0568,O=C(c(s1)ccc1Cl)N(C1)CC1Oc1nc(cccc2)c2s1,2 F3375-1864,Fc1c(/C=C/c(s2)nn3c2nnc3-c2cnccc2)cccc1,0 S720-0540,COCCNC([C@H](C[C@@H](C1)Oc2ccccc2)N1C(c1n[nH]cc1)=O)=O,2 Z2058952776,CN(Cc(cccc1)c1NC(N(CC[C@@H]1N2C)C[C@H]1NC2=O)=O)c1ccccc1,2 F6456-1864,O=C(C(CCC1)CN1c(cc1)nnc1-n1ncnc1)NCCC1=CCCCC1,2 F6482-6954,O=C(c(cc1)ccc1OC(F)(F)F)NCc1cc(-c2cscc2)ncc1,0 F6211-0267,Cc1nc(NC(c2nn(CCCO3)c3c2)=O)nc(C)c1,2 Z2978232258,CC([C@H]1OCC[C@H]1C(Nc1nc2cccc(Cl)c2n1C)=O)=C,2 Z933629558,Cc1nn(C)c(C(N2CC(CCC3)N3CC2)=O)c1,2 Z828806124,NC(c1cccc(C(NCC2CCN(Cc3ccccc3)CC2)=O)c1)=O,0 Y043-8673,Cc1c(CCC(N(CC2)CCC2(c(cc2)ccc2Cl)O)=O)c(C)nn2c1nnc2,2 Z1565253150,COCCN(CCN(C1)C(c2c[nH]nn2)=O)C1=O,0 F5042-0318,O=C(Cn(cc1)c2c1cccc2)N(CC1)CCN1c(cc1)nnc1-c1cccs1,2 F6190-1067,OC(CCNC(c(s1)ccc1Cl)=O)c1ccco1,2 F6174-1135,COc(cc1)ccc1-c1cc(N(CC2)CCC2C(NCc2ccco2)=O)ncn1,2 F6089-9501,O=C(c1ccc(Cn2cncc2)cc1)Nc(cc1)cc2c1OCCC(CCCC1)N1C2=O,2 F6398-0393,O=C(Cc1n[nH]c(cc2)c1cc2F)N1CCN(CCc2ccccc2)CC1,2 Z2293848669,CCCN(CCCN(C1)C(N[C@H](C)C2CC2)=O)C1=O,2 Y041-7869,N1(C(N[C@H](C1=O)CC(=O)NCCc1ncccc1)=O)CCc1c[nH]c2c1cccc2,2 F6543-0206,O=S(N1CCCC1)(N(CC1)CCC1(F)F)=O,0 F6562-8142,O=C(C1(CCCC1)c(cc1)ccc1Cl)NCC1c(cccc2)c2OC1,2 SB04-0653,CN(C)C(N(CC1)CC1N(CCN(C)CCCc1ccccc1)C1CCOCC1)=O,0 S606-0061,Cn1cnc(S(N(CC2)C[C@@H]2N(c2ncccc2N2C)C2=O)(=O)=O)c1,0 F6783-5609,O=C(Cc(ccc(F)c1)c1F)N(C1)CC(C2)C1CN2c(cc1)nn2c1nnc2,2 Z3383255042,NC(C(CC1)c2c1cccc2)C(N(CC1)CCN1c(ccc(F)c1)c1C(N)=O)=O,2 J042-0460,O=C(c(cc1)cc(CCC2)c1N2C(c(cc1)ccc1Cl)=O)N1CCCCC1,2 F6485-0351,Cc1cccc(CCC(NC(CC2)CCC2Oc2ncccn2)=O)c1,2 F6438-3550,CN(C)c1nc(CNC(CNC(OCc2ccccc2)=O)=O)nc(N(C)C)n1,2 F0695-0178,Cc(c(C)c1)cc(C)c1S(Nc1c(C)c(-c2nc(cccn3)c3s2)ccc1)(=O)=O,0 F6240-2780,COc(cccc1)c1-n1c(CN2CCN(CC(Nc(cccc3)c3Cl)=O)CC2)nnc1,2 F5016-1899,CSc(cccc1)c1NC(C(NCC(CC1)CCN1C(Oc1ccccc1)=O)=O)=O,0 Z1738279895,Cc(nncc1)c1NC(NC1(CO)CCC1)=O,2 F6237-3090,O=C(c1nn(-c2ccc(C(F)(F)F)cc2)nn1)Nc(cccc1)c1OC(F)(F)F,0 F5735-0163,CCOc(cccc1)c1NC(C(C1)c(cccc2)c2C1=O)=O,0 F6222-0527,CC(N(C)CC(Nc1cnc(N(CC2)CCN2c2ncccc2)nc1)=O)=O,0 J107-0835,COCCn(cc1)c2c1ccc(C(NC(CCC1)c3c1c(cccc1)c1[nH]3)=O)c2,2 F6562-8844,O=C(Cc1c[nH]c2c1cccc2)NCc1nccnc1-c1cscc1,2 SB55-1099,CC(C)c1nc([C@@](CCC2)(C3)[C@@H]2CN3S(Cc(cc2)ccc2Cl)(=O)=O)no1,0 S606-1140,COCCN(c1cccnc1N1[C@H]2CN(Cc3cscc3)CC2)C1=O,0 S694-0866,CCn1ncc(S(N(CC2)CC2n2c(C3CC3)ncc2C)(=O)=O)c1,2 F6725-1297,Cc1nnc2n1ccnc2N(C(CC1)C2)C1c1c2[nH]nc1,2 Z2440859012,O=C(COc1cccc2ccccc12)N(CCC1)CC1N(CCNC1)C1=O,2 Z1480742751,CC(C)(C(CCC1)N1S(c(cc1)cc(Cl)c1Cl)(=O)=O)O,0 S968-0543,Cc(nc1)cnc1C(N(CC1)CCC1(C1)C1NS(C)(=O)=O)=O,2 F6805-7984,Cc1c(ccc(N(CCN2c3cc(OC)ncc3)CC2=O)n2)c2nc(C)c1,2 T422-0916,O=C(CCC(CC1)CCN1c1ncnc(NC2CC2)c1)N(CCC1)CCN1c1ncccn1,2 F6521-9681,COC(CNC(C(NCc1cccs1)=O)=O)(C1)Cc2c1cccc2,2 Z600504850,OC(c1cc(CNC(CCn2ncnc2)=O)ccc1)=O,2 F1016-0419,COc(cc1)cc(OC)c1NC(CSCc1ccco1)=O,0 C069-0001,CC(CC(C)(C)N1)N(CCC(Nc2nc(c(C)ccc3)c3s2)=O)C1=S,2 F6436-0343,Cn1c(CN(Cc2cccs2)S(c(cc2)cc3c2OCC3)(=O)=O)ccc1,2 Z2780139921,Cn1c(NC(c2ncccc2OC)=O)nnc1C1CC1,2 Z2974837477,FC(c1cc(CNc2ncnc3c2CCC3)no1)F,0 Z1411887077,O=C(c1cncs1)N(C1)C(CCCC2)C2NC1=O,2 Z4444621856,Cc1cnc(CC(Nc2cnccc2)=O)o1,2 F5033-7700,O=C(c(s1)ccc1Cl)NCC(CC1)CCN1C(Nc(cc1)ccc1F)=O,0 Z2069917831,O=S(NCC1(CC1)C(F)(F)F)(N1CCOCC1)=O,0 Z953546330,Cn1c(cccc2)c2c(CC(N2CCC(CCN3CCOCC3)CC2)=O)c1,2 SC02-0363,COCCC1(CN(Cc(cc2)cc3c2OCC3)CC1)NS(c1ccccc1)(=O)=O,2 S352-0061,O=C(c1c(COC(C2)c3ccccc3)n2nn1)N(CC1)CCN1C(c(cc1)ccc1Cl)=O,0 Z2966823776,O[C@H](C1)C[C@H]1C(NC1C[C@H](CN(Cc2ccccc2)C2)[C@H]2CC1)=O,2 F2490-0016,C(c1ccco1)Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1,2 8019-7434,Cc1n[nH]c2c1C(c(cc(cc1)OC)c1OC)N(CCc1c[nH]c3c1cccc3)C2=O,2 Z2206117336,CC(c(cc1)ccc1C(Nc1ccccc1)=O)(F)F,0 V005-3983,COc(cc1)cc(-c2cc(C(N(CCC(NCC3CC3)=O)CC3OCCC3)=O)no2)c1OC,0 F6549-2102,CN(C=CC=C1C(N(C(CC2)C3)C2CC3n2nccc2)=O)C1=O,2 F3316-0354,COc1cc(OC)c(CNC(N(c2ccccc2)c2ccccc2)=O)cc1,2 Z1652521464,CC1OCCC1(C)NC(CCc1c(C)n(C)nc1C)=O,2 F6476-3146,O=C(Cn1nccc1)N(CC1)CC1Oc1nccc(C(F)(F)F)c1,2 Z1451067107,COc(cc1)ccc1-n(cc1)nc1C(Nc1c[nH]nc1-c1ncccc1)=O,0 Z3016310486,C=CCC(C(N(CC1)CC2(CO)N1CCOC2)=O)c1ccccc1,2 Z1167446656,CCNC(N(CC1)CCN1C(Cc1c(C)oc(-c2ccco2)n1)=O)=O,0 Z2230042997,CS(CC(CC1)CCN1C([C@@H](C1)[C@H]1C1CC1)=O)(=O)=O,0 Z4508796403,CCC1N(Cc(cc(cc2)-c3n[nH]nn3)c2F)CCOCC1,0 Z2897214564,OC([C@H]1CN(Cc2cc3nccnc3cc2)CCC1)=O,2 F6616-8120,Cn1c(C(N(CC2)CCN2C2CCCCC2)=O)cnc1,2 F6619-2938,O=C(NCc1ccccc1)N(CC1)CCC1Nc1cc(C(F)(F)F)ncn1,2 F6359-1092,O=C(Nc1cccs1)N(CC1)CCC1Oc(nccc1)c1Cl,0 Z2227119763,Cc(ccc(Cl)c1)c1C(N(CC1)Cc2c1nc[nH]2)=O,0 SA85-0675,OC(CN(CCCc1ccccc1)C1)CN(Cc2ccccc2)C1=O,2 SD48-0331,CC(C)n1nc(CCC(N(CC2)CCN2c2ncnc3ccccc23)=O)c2c1CCOC2,2 F2232-0104,COc(ccc(C(N(CC1)CCN1c(cc1)nnc1-c1cccs1)=O)c1)c1OC,0 Z1627661212,CC(C)N(CCN(C1)c2ncnc3c2cn[nH]3)C1=O,0 F5494-0124,COc(ccc(F)c1)c1S(N(CCC1)CC1c1nnc(Cc2ccccc2)s1)(=O)=O,2 Z729729224,NC(C1(CCCCC1)NC(c(cc1)ccc1N(CCC1)C1=O)=O)=O,2 F6451-0059,CN(C=CC=C1C(NCC(c(cccc2)c2OC)OC)=O)C1=O,0 Z1869296874,O=C(CC(CN(C(C(C1COCCC1)N1)=O)C1=O)C1)N1C1CC1,2 F3382-1606,O=C(CSc(c1c2)nccn1nc2-c1ccccc1)NCc(cc1)ccc1F,2 Z634950996,CC(C)(CNCc1c(C)n(-c(cc2)ccc2Br)nc1C)N(C)C,0 F5889-0055,O=C(CNC(c1c[nH]c2c1cccc2)=O)NCCC1=CCCCC1,2 F6786-6526,O=S(c1cnccc1)(N1CC(COc(cc2)nnc2-c2cc(F)ccc2)CC1)=O,2 T473-0643,CSc1cc(NC(N(CC2)CCN2c2cc3nnc(C4CC4)n3nc2)=O)ccc1,0 CM4366-4327,Cc1cnc(C2OCCC2)n1CC(CC1)CCN1C1CCOCC1,2 Z1177960745,CNC(C(CCC1)N1C(CNC(C1(CCCC1)O)=O)=O)=O,2 F6438-3508,CN(C)c1nc(CNC(C2(CCOCC2)c2ccccc2)=O)nc(N(C)C)n1,0 F6553-0943,O=C(c(o1)ccc1Br)N(CC1)CC1c(cc1)cc2c1OCC2,2 F6783-7981,Cc1nnc(cc2)n1nc2N(CC1)CCN1C(NC1=O)=NC(C2CC2)=C1F,2 Z748369004,CCC(C)NC(CCNC(NC1CCN(Cc(cc2)cc(F)c2F)CC1)=O)=O,0 Z982119262,CN(Cc(cccc1)c1Br)C(Cn1nnc(CO)c1)=O,0 Z4431591573,NCCN(CC(F)F)Cc1cccn2nccc12,0 V021-3353,CCCc1nc(n(-c2ccccc2)nc2C)c2c(N(CCC2)CCN2S(CC)(=O)=O)n1,0 F6476-5302,O=C(c1cccc(Br)c1)N(CC1)CC1Oc1ccncc1,0 F6300-0188,O=C(CC(c1ccccc1)c1ccccc1)Nc1conc1,2 Z382844784,CCC(C)NC(C(CCC1)N1C(c(ccc(OC)c1)c1OC)=O)=O,0 F6507-1263,Cc1noc(C)c1C(NCCC(C1CCOCC1)O)=O,2 Z2936915689,CCN(C)C(CNC(NC(C1(CO)CCCC1)c1ccccc1)=O)=O,0 Z2313233333,CN(C(CC1)CCC1(F)F)C(Nc1cnncc1)=O,0 K786-7464,CC(C)CCNC(CCS(Cc1ccc(C)cc1)(=O)=O)=O,0 F6524-1866,O=C(COc1ccccc1)N(CC1)CC1c1nocn1,2 Z1174622826,CC(C)n1c(C(CC2)CCN2C(c(cc2)ccc2-c2noc(C(F)(F)F)n2)=O)nnc1,0 S212-0131,Cc1nccn1CC(N(CCC1)CC1OCc1nc(C)no1)=O,2 Z2982112353,O=C(C1)N(c2nc(-c3ccccc3)cs2)N=C1C1CCOCC1,2 T955-0626,COCCC(N(CCC1)CC1c1nc(CCOCC2CC2)no1)=O,2 Z1147891629,COc1cc(N(CC2)CCN2C(c(cc2)ccc2-c2noc(C(F)(F)F)n2)=O)ncc1,2 Z1651457566,C[C@H](C(N(CC1)CCC1NC(c1c(C)occ1)=O)=O)c1ccccc1,0 F5857-3723,CSc(cccc1)c1NC(C(NCC(C(F)(F)F)(c1ccccc1)O)=O)=O,0 Z1498171062,Cc(ccnc1)c1NC(Cc1csc(cc2)c1cc2Cl)=O,0 SB13-0207,CC(C)CN([C@@H]([C@H](CC1)C(NCCc2cccs2)=O)c2cnccc2)C1=O,2 L302-0826,CC(C)C(N(CC1(C)C)c(cc2)c1cc2S(NC1CCCCC1)(=O)=O)=O,2 Z2232292557,Cc1c(CC(Nc(cc2)cnc2N(CC2)CCN2C(OC)=O)=O)cccn1,2 Z2348401847,CCc1nc(N(CC2)CC(CO)C2O)c(ccs2)c2n1,0 Z2610246283,[O-][N+](c(cccc1)c1S(N1C2CNCC1CC2)(=O)=O)=O,0 Z1745578615,O=C(Nc1nncs1)N1C(CCC2)C2CC1,2 F6403-0598,O=C(CSc(cc1)ccc1F)N(Cc1cnc2n1cccc2)C1CC1,2 F6725-2292,C(c(cc1)cnc1-c1cocc1)Nc1c2sccc2ncn1,2 Z2476791442,CC(C)(C)C(CN)NC(c(cc1)ccc1C(O)=O)=O,0 F6448-0166,O=C(CSCc1ccccc1)Nc1cn(CC2OCCCC2)nc1,2 Z1932653613,CC(CN(C=CC(C)=C1)C1=O)(C(N(CC1)CCN1c(ccc(F)c1)c1Cl)=O)O,0 F6502-9199,Cc1cc(CCNC(Nc(cccc2)c2Cl)=O)nn1C,0 G411-0130,COc(ccc(C(NC(C(Oc1c2cccc1)=O)=C2N1CCCC1)=O)c1)c1Br,0 F6803-0167,Cc1cnc(C)c(OC(CC2)CCN2c2cnc(cc(cc3)Cl)c3n2)n1,2 F6184-1254,CCOc(cccc1)c1NC(NCCN(CC1)CCC1c1cccs1)=O,0 Z1659977174,CC(C(C)NC(c1cscc1C)=O)C(O)=O,0 Y500-5832,O=C(c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2c1)N1CC(CCC2)N2CC1,2 Z243562704,Cc1c(C(NCc2cc(OC)ncc2)=O)[nH]c(C)c1C(OC)=O,2 F6709-0279,CCc(cn1)cnc1OC(CC1)CCN1C(C(C(OC)=C1)=CN(C)C1=O)=O,2 F6474-0200,CC(N1C)=CC(OC(CC2)CCN2C(CC2(CC(C3)C4)CC4CC3C2)=O)=CC1=O,2 Z2991377702,Cc1cn(C)nc1CNc(cc1)ccc1C(N1CCC(CO)CC1)=O,2 Z2394922115,CNc(cc1)ncc1NC(C1COCCC1)=O,2 SC13-0054,O=C(C1CCC1)N(Cc1cnccc1)C(CCC1)CN1C1CCC1,2 Z2636916524,Cc(oc(C(OC)=O)c1)c1C(N(C)CC1(CCOCC1)O)=O,0 V028-5748,CC(C)CC(NC(C(CC1)CCN1C(c1ccco1)=O)C(NCC(C)C)=O)=O,0 Z3216015625,Cc(n(C)nc1)c1S(NCC1(C2)N(C)CC2C1)(=O)=O,2 Y044-5156,O=C(CC(c(cc1)ccc1Cl)n1cccc1)N1Cc2nnc(C(F)(F)F)n2CC1,2 F3406-7581,CCc1noc(-c(cc2)cnc2SCC(N(CC2)CCN2c(cccc2)c2F)=O)n1,2 F6171-0127,O=S(CCOc1ccccc1)(NCCc1c[nH]c2c1cccc2)=O,2 V014-3458,CC(C)Cn1c(S(Cc2cc(OC)ccc2)(=O)=O)ncc1CN(C1CC1)S(c(cc1)ccc1OC)(=O)=O,0 S219-0175,O=C(Nc(cc1)cc2c1OCCO2)N(C(C1)c2nc(C3CC3)no2)c2c1cccc2,2 Z2504153992,CC(C)C(CNC(CC(c1ccccc1)NC(c1ccc(C)cc1)=O)=O)C(O)=O,0 F5095-0904,Cn1c(N(CC2)CCN2C(CN(C(CC2)=O)C2=O)=O)ncc1,2 Z2830904288,Cn1nc(C(Nc(cc2)c3cc2Cl)NC3=O)cn1,2 S570-0590,COCCN1C2=CCCCC2(CNC(c2cocc2)=O)CCC1=O,0 Z2434090707,Cn1ncc2c1ncnc2N(CC1)CCN1C(CCC1CNCC1)=O,2 E196-0115,CCC(C(Nc1ccc(CC)cc1)=O)SC(N1CCc2ccccc2)=Nc2nccnc2C1=O,2 Z749649386,O=C(c1n[nH]c2c1CCC2)N(CC1)Cc2c1[nH]c(cc1)c2cc1Cl,2 F5729-0785,Cc(c(C)c1)cc2c1ncn2CC(CC1)CCN1C(C(C=C1)=CNC1=O)=O,2 S812-0416,O=C(Cn1nccc1)N1C(C2CCCC2)c2nccn2CCC1,2 Z3691114774,O=C(C(CC1)NS(N2C(C3)CC3C2)(=O)=O)N1c1cc(OC(F)(F)F)ccc1,2 F1016-0683,COc1ccc(C(C2)N(C(CSc3ncccn3)=O)N=C2c2cccs2)cc1,2 Z1219942871,Cc(cc1)ccc1OC(CC1)CCN1C(CCC(N1)=Nc(cccc2)c2C1=O)=O,0 F6440-2707,O=C(c1cccs1)NCc1nn(C2CCCC2)c2c1CCCC2,2 Z4507302830,Clc1c(CN2CC(C3)C3CC2)ccc(-c2n[nH]nn2)c1,2 Z715744838,CC(C)Cc(cc1)ccc1S(N(C)CCC(O)=O)(=O)=O,0 Z1889391624,Cn1ncc(C(N[C@H](CC(N)=O)c(cc2)ccc2Cl)=O)c1Cc1ccccc1,0 Z641462344,Cn1c(Sc2cc(C(F)(F)F)nc3ncnn23)ncc1,2 F6514-6734,COC(C(C(NC(Cn1nccn1)c1ccccc1)=O)=CN1c2ccccc2)=CC1=O,2 S700-0243,CCCNC(N(C1)CC1c1nc(CCOC)no1)=O,0 Z3268511006,OC[C@H](C[C@H]1[C@@H]2CCCC1)N2C(c(cc1)cnc1-n1cncc1)=O,2 F6359-3626,Cc1noc(C)c1CCC(N(CC1)CCC1Oc1nnc(C)cc1)=O,2 Z4656798298,COc(cc1)ccc1OCC(N(C1)CC11CN(CC(N2CCC2)=O)CC1)=O,2 S994-0446,Cc1cccc(CN(CCN(CC2)C3CCN2S(c(cc2)cc(C)c2F)(=O)=O)C3=O)c1,0 3909-8368,CCN(C=Nc1c2c(C)c(C(NCC3Oc(cccc4)c4OC3)=O)s1)C2=O,2 F1895-0170,NC(N(c1cc(C(F)(F)F)ccc1)C(SCC(N(CCC1)c2c1cccc2)=O)=N1)=CC1=O,2 Z2044328794,O=C(NCc1cnc2n1CCCC2)N1CC2(COCC2)OCC1,2 F1696-0214,Cc(nc1)cn1S(c(cc1)cc(OC)c1Br)(=O)=O,0 Z2605533101,CCCN(CCC1)CC1c1n[nH]c(N2CCNCC2)c1,0 V025-9302,O=S(c1ccccc1)(N(CC1)CCN1c1nc(-c2cnccc2)nc2ccccc12)=O,0 Z3086091637,CC(C)CN(C(c1noc(-c2nn(C)cc2)c1)=O)c(cc1)ncc1F,2 Z3366440698,Cc1cc(Cc2noc(C(CCC3)N(C)C3=O)n2)cc(C)c1,2 Z1070095046,CC(C)c(cccc1)c1-n1nc(C(N(CCC2)C2c2c3OCCOc3ccc2)=O)nc1C,2 F6454-0168,O=C(c1cc(Br)cnc1)NCC(CC1)CCN1c1cnccc1,2 F6670-4878,O=C1N(CC2CCN(Cc(ccc(F)c3)c3Cl)CC2)C=Nc2c1cccc2,0 F5833-3236,CS(N(CCC1)c2c1ccc(NC(c1nccnc1)=O)c2)(=O)=O,2 Z1437783105,CC(c1cn(C)nc1)NCc(cc1)cnc1N1CC(C)OCC1,2 Z2904265369,Cc1cccc(C(O)=O)c1NC(COCC1CC1)=O,2 F6524-5912,O=C(c(cc1)ccc1-n1cccc1)NCCN(C=Nc1c2ccs1)C2=O,2 V021-3677,O=C(CN(CC1CC1)C(c1ccco1)=O)N(CCC1)CCN1c(cc1)nnc1-c(cc1)ccc1F,2 F6472-0821,Cc(onc1)c1C(NCCSC1CCOCC1)=O,2 Y021-2235,N#CC(C(c(cccc1)c1N1)(C1=O)C(C(N1)=O)=C(N2)N=C1N1CCOCC1)C2=O,2 SA17-0161,CC(C)CN([C@@H](C)[C@H](CC1)C(NCCc2nc(cccc3)c3n2C)=O)C1=O,0 F6510-0996,CN(c(cccc1)c1N1CCNC(CSc(cc2)ccc2F)=O)S1(=O)=O,2 S693-2073,Cc1cnc(COC)n1CC1CN(Cc2cccc(OC)c2)CCC1,2 SB36-0617,Cc1c(C(N(C2)[C@H](Cn3nnc(C(N4CCOCC4)=O)c3)CC2(F)F)=O)ocn1,2 F3371-0771,Oc1nc2ccccc2nc1-c(ccc(Br)c1)c1NC(c1cccs1)=O,2 Z1454927439,CN(Cc1cnccc1)C(C1=CN(Cc2ccccc2)c(cccc2)c2C1=O)=O,2 Y205-4036,CC(CC1)Cc2c1c(C(N)=O)c(NC(c(cc(cc1)Br)c1Cl)=O)s2,0 F6550-6164,O=C(c1nn(-c2ccccc2)nc1)N(C1)CC1Nc1nnccc1,2 F543-0676,O=C1N(C2CCCC2)c(ccc(-c2noc(COc(cc3)ccc3Cl)n2)c2)c2N1,2 3807-1386,CCSC(N1c2ccccc2)=Nc(sc2c3CC(C)(C)OC2)c3C1=O,0 Z2992201132,Cn1nc(C2CC2)cc1S(N(CCO)c1cc(F)ccc1)(=O)=O,0 Z2953956822,CC(c1nc(O)cc(C)n1)N(CC1)CCC1c1nc(CCC2)c2s1,2 Y205-7205,O=C(C1OCCC1)N(CC1)CCN1S(c(cc1)cc(F)c1F)(=O)=O,0 S779-0333,Cc1cnc(C2CC2)n1CC(CC1)CN1C(C1CCC1)=O,2 J106-0512,COC(CC(CC1)CCN1C(C(CC1=O)CN1c1n[nH]c2cccc(F)c12)=O)=O,2 G415-3073,Cc(nc(N1CCCC1)nc1)c1C(N(CC1)CCN1C(c1ccco1)=O)=O,2 Z4967055311,O=C(CCCC1CC1)Nc1nn(Cc2ccc(C(F)(F)F)cc2)cn1,2 F3250-0309,CC(Nc(cc1)ccc1Nc(n1nc2)cc(C)nc1c2-c(cccc1)c1Cl)=O,0 Z1274322739,O=C(C(c(ccc(Cl)c1)c1Cl)N1CCOCC1)Nc(cc1)nn1-c1ccncc1,2 S640-5428,Cc1c(COC)c(C(N(C[C@@H]2C(NC)=O)C[C@@H]2c2nc(C)no2)=O)no1,0 Z1360224032,CC(C(CC1)c2ccccc2)N1C(CC(c1c(C)cccc1)NC(N)=O)=O,0 F6546-1388,CN(C)c(cc1)nnc1C(N(C1)Cc2c1cccc2)=O,2 F5860-3925,COc1cc(CCN(C2)C(Cn3nccc3)=O)c2cc1OC,2 Z1272626665,CCC(CO)N(CC1)CCN1c1nc(-c2cnccc2)nc(C)c1,0 V024-2452,O=C(c1coc(CN(Cc2cc(C(F)(F)F)ccc2)Cc(ccc(F)c2)c2F)n1)NC1CC1,0 M109-0695,CCC(C)NC(CSC(N(CC)C1=O)=Nc2c1snc2-c1ccc(C)cc1)=O,0 SA65-0769,Cn1cnc(S(N2CCC(CCc3noc(-c(cc4)ccc4F)n3)CC2)(=O)=O)c1,2 Z369255186,Cn1c(C(CC2)CCN2S(c(cc2)ccc2C(NCC(O)=O)=O)(=O)=O)nnc1,0 Z1538083150,O=C(c1cc(C2COCC2)ccc1)Nc1cn(CC(F)F)nc1,0 F6374-1536,CCc(s1)ccc1S(N1CCC(CSc2nccn2C)CC1)(=O)=O,2 L815-0514,O=C(CNC(c1ccccc1)=O)NC(C(N(CCC1)c2c1cccc2)=O)c1ccccc1,2 Z2964825219,CCC(N(CC1)c2c1ccc(NC(COc(cc1)ccc1F)=O)c2)=O,2 Z2956744647,O=C(c1c(C2CCC2)cccc1)N(CC1)CC(CN2)N1C2=O,2 F6494-0487,COc1cc(C(Nc(ccc(Br)c2)c2F)=O)ncn1,0 Z2347362154,CN(C1CC1)C(C(C1)C1(CC1)CCN1c1ncnc2cnccc12)=O,2 Z1653023429,CN(CC1CC=CCC1)S(c1cc(Cl)cnc1N)(=O)=O,0 F807-0792,COc(cc1)cc2c1[nH]cc2CCNc(cc1)nnc1S(C1CCCCC1)(=O)=O,2 Z1960470343,O=C(C1CCOCC1)Nc1nc(-c(cccc2)c2F)co1,0 Z2721906323,CC(C1)N(Cc2cccc(O3)c2OC3(F)F)C(C)CC1C(O)=O,2 F3248-0451,COCCNc(oc(-c(cccc1)c1O1)c2C1=O)c2-c(cccc1)c1F,2 D705-0250,O=C(COc(cc1)ccc1-c1nc(-c2ccccc2)no1)Nc(cccc1)c1Cl,2 G804-1100,COc(cc1)ccc1N(C(c1ncccc11)Nc(c(OC)c2)cc(Cl)c2OC)C1=O,0 Z2963309797,Cc1c(C(N2C(CC3CC3)COCC2)=O)nc(-c(cccc2)c2F)o1,2 Z2783591776,CN(C(CCC1)C1C#N)C(Cc1cscc1Br)=O,0 F6442-0584,COc(cc1)ccc1S(C(C1)CN1C(c(cccn1)c1SC)=O)(=O)=O,0 4852-0677,CC(CC1)Cc2c1sc1ncnc(N3CCN(CCc4ccccc4)CC3)c12,2 F6178-7681,O=S(c1cnccc1)(NCC(CC1)CCN1C1CSCC1)=O,2 V010-7475,Cc(cccc1)c1OCC(CN(CCN1CCOCC1)Cc(cc1)ccc1OC)O,0 G730-0084,O=C(c(cc1)cc2c1n(CCCC1)c1n2)NC1CCCCCC1,2 F6553-0323,O=S(c(cc1)ccc1Br)(N(CC1)CC1c1cccs1)=O,2 Z2762006519,CN(C)C([C@@H](CC1)O[C@@H]1C(CC1)CCN1c1nccc(C#N)c1)=O,0 F5857-5462,CC(C)S(c1ccc(CC(NCC(CC2)(c3c2cccc3)O)=O)cc1)(=O)=O,2 F5310-0073,O=C(C1(CCCC1)c1cccs1)NCc1cnccc1,2 Z1311059375,CC(c1n[nH]cn1)NC(C1(CCC1)c(cc1)ccc1Br)=O,0 F5139-0310,CS(N(CC1)CCC1C(N(Cc1cnccc1)c1nc(cccc2)c2s1)=O)(=O)=O,2 F6476-1608,CCN(CCN(C(N(CC1)CC1Oc(nccc1)c1Br)=O)C1=O)C1=O,0 F0696-3896,O=C(c(cc1)nnc1N1CCCC1)N(CC1)CCN1c1ncccn1,2 F6514-2899,O=C(Cc(c(F)ccc1)c1Cl)N(C1)CC1OCC(F)(F)F,0 F6491-0957,N#Cc1nccnc1OC(CCC1)CN1C(C1OCCc2c1cccc2)=O,2 Z1023441046,Cc(n(C)nc1)c1C(NCCc1coc(-c2ccccc2)n1)=O,0 F3375-1928,CCc1ccc(CCC(Nc2nccs2)=O)o1,2 Z1884180643,Cn1ncc(NC(N(CCCC2)c(cc3)c2cc3OC)=O)c1C(F)F,0 S511-0164,Cn1cnc(S(N(CC2)CCC22OCCC(CC(N3CCOCC3)=O)C2)(=O)=O)c1,2 K284-4555,Cc1cc(NC(CSC(N2CC3OCCC3)=Nc(cc(cc3)C(NCC4OCCC4)=O)c3C2=O)=O)no1,2 F6521-9522,COC(CNS(C)(=O)=O)(C1)Cc2c1cccc2,0 Y041-4377,O=C(CN(C(C=C1)=O)N=C1c1ccccc1)N(CC1)CCN1C(CC1)CS1(=O)=O,2 Z1838190603,N#Cc(ccc(CN(C(C1(c(cccc2)c2OCC1)N1)=O)C1=O)c1)c1F,2 Z1744687216,Cn1c(ccc(Cl)c2)c2nc1CNC(C1(CCOCC1)c1cc(F)ccc1)=O,0 Z1696956667,CCC(Cc(cc1)ccc1NS(N1CCOCC1)(=O)=O)C(O)=O,0 SC72-0410,O=C(c1ccncc1)N(C1)CC11OCc2c1cnc(C1CCCCC1)n2,0 Y041-7657,CSc(cc1)ccc1-c1ccnc2nc(C3OCCC3)nn12,2 F6436-1866,Cn1c(CN(Cc2cccs2)C(c2cc(ccc(OC)c3)c3[nH]2)=O)ccc1,2 Z4918794428,CCN(CC)C(CC1)CN1C(NC(CN(CC)C1)c2c1cccc2)=O,2 Z1428262744,CC(N(CCCC1)C1c1nc(cccc2)c2o1)=O,2 5067-0964,CC(CC1)Cc(sc2nc(C)n3)c1c2c3Oc(cc1)cc(O2)c1C=CC2=O,0 SC53-0675,Cc1nc([C@]2(CN(Cc3ccccc3)C3)[C@@H]3CCN(Cc3cnccc3)C2)no1,2 F6753-3265,O=C(C(CCC1)CN1c1c2sccc2ncc1)N1CCSCC1,2 S555-1456,O=C(C1CC1)Nc(cc1)cc(C2)c1OCCN2C(C1Oc(cccc2)c2OC1)=O,2 F6574-0612,O=C(C1(CCCC1)c1cccs1)N(CC1)CCC1Oc1nncs1,2 Z1603525360,CC(C)NC(CC1)CCN1C(NCC(N1CCOCC1)=O)=O,2 SB75-1345,CCS(N[C@H](C[C@H]1CN(C2)C(c3c(C)nc(C)s3)=O)C[C@]12c1nc(C)no1)(=O)=O,2 Z2156234160,CC(C)(C1CC1)c1nc(-c(cc2)ccc2Oc2ncccn2)no1,2 Z1083388118,Cn1c(CCN(C2)C(c3ccc(CNC(C4CCCC4)=O)cc3)=O)c2nc1,2 Z1564081623,CC(C)(CC1)CC1NC(c1cc(-c2c(C)n(C)nc2C)n[nH]1)=O,2 G221-0970,Clc(cc1)ccc1-c1nnc(C(c2ccccc2)N(CC2)CC=C2c2ccccc2)o1,2 4464-0521,CC(C)(C1)OCc2c1c(C(NC(SCC(c(cc1)ccc1Br)=O)=N1)=O)c1s2,0 S700-0297,COCCc1noc(C(C2)CN2S(c2cccc3nsnc23)(=O)=O)n1,2 T501-1263,CCCn1nc(C)c(-c2n[nH]c(C(N3CC(Cc4nncn4CC4CC4)CCC3)=O)c2)c1C,2 F6677-3504,O=C(C1(CCOCC1)c1ccccc1)N1CC(Cn2ncc(Br)c2)C1,2 Z2997033679,O=C(c1cc(C(F)F)ncn1)N(CC1CCCCC1)c1ncccc1,2 L277-0082,Cn1c(ccc(C(N2CCCC2)=O)c2)c2nc1CN(CC1)CCN1C(Nc(cc(cc1)F)c1F)=O,0 Z2673936334,O=C(c(c(F)ccc1)c1F)N[C@@H]1[C@@H](c2cn(CC3CC3)nc2)OCC1,0 S895-1127,CC(C)c1nnc2n1CCC(CC1)(CCN1C(c1c(C)oc(C)c1)=O)CC2,2 F6560-5360,Cn1ncc(-c2cc(CNC(CCN(C=Nc3c4cccc3)C4=O)=O)cnc2)c1,2 F6482-3915,Cn(c(C(N(CC1)CCC1n1nccn1)=O)c1)nc1-c1cc(OC)ccc1,0 F6549-6884,O=C(CSCc1ccccc1)N1CC(CN(C(CC2)=O)C2=O)C1,2 Z4066528878,O=C(C1=C2N3CCCCC2)N(c2ccccc2)N=C1N=C3SCC(CC1)CNC1=O,2 F2135-1072,CCOC(C(SC1=NC(C)=C2)=C(C)N1C2=O)=O,0 Z1534798044,CC(CNC(N1CCCCCC1)=O)c1nc(-c2ccccc2)no1,2 Z2152958880,Cn1nnc(C(NS(c2cc(CCCC3)c3cc2)(=O)=O)=O)c1,2 S831-3509,Cn1c(CN(C[C@@H]2COC)C[C@@H]2c2ncccc2)ccc1,2 D635-0116,CN1CCN(Cc(c(O2)c(cc3)C=C(c(cc4)ccc4F)C2=O)c3O)CC1,0 Z5054602076,O=C(c1c(-c2ccccc2)ocn1)NCc1n[nH]c2c1CCC2,2 CM3125-2026,CCN(C(C=C1)=O)N=C1N(CCC1)CC1NC(c1cc(cc(cc2)Cl)c2[nH]1)=O,0 Z1885291323,O=C(c1coc(C2CCOCC2)n1)N(CCC1)c(cc2)c1cc2-c1ccccc1,2 SB52-0145,CC(C)c1nc(C(C2)N(C)CC2(CC2)CCN2C(c2noc(C)c2COC)=O)no1,2 G597-0760,CCC(C(Nc(cc1)ccc1Cl)=O)N(C(C)=Nc1c2c(C)no1)C2=O,0 Z2233008156,Cc1c(C(N(CCC2)C2c2nnn[nH]2)=O)sc(NC(c2ccco2)=O)c1,2 F6296-1304,Cn(c(CNS(c1cc(CCCC2)c2cc1)(=O)=O)c1)nc1-c1ncccc1,2 Z2974115674,Cc1c(C)ncnc1N(C)Cc1ncccn1,0 F6517-0217,OC(CNC(CCc(cccc1)c1Br)=O)c1ccc(-c2ccco2)o1,2 F6573-1875,Cn1ncc(-c2nccnc2CNC(c(ccnc2)c2F)=O)c1,2 F432-0482,CN(c(c(N1C)c2)cc(NS(c3cc(CCCC4)c4cc3)(=O)=O)c2Sc(cc2)ccc2F)C1=O,0 V003-4237,O=C(c(cccc1)c1Cl)Nc(cc1)cc(CN2C(CCC3)c4c3cccc4)c1OCC2=O,0 F6412-1833,CCOC(NCC#CCOc1cccc(C(F)(F)F)c1)=O,0 F6489-2010,CN(C)c(cc1)nnc1OC(CC1)CN1C(c1cocc1)=O,2 F6489-1552,COc(cc1)nnc1OC(CC1)CN1C(NC1CCCCC1)=O,2 Z2936914427,CCc1nsc(NCc2nnc(cc3)n2nc3N(C)C)n1,0 Z2058701023,Cn1ncc(S(NCCN(CCC2)CC2(C(N2CCCC2)=O)O)(=O)=O)c1,2 SC41-0192,O=C(C1CCCC1)N(CC1)CC1(c1noc(-c2ccncc2)n1)F,2 F6448-2044,O=S(c(cccc1)c1OC(F)(F)F)(Nc1cn(C2CCOCC2)nc1)=O,0 C597-0255,Cc1cccc(NC(C(Cc2ccccc2)NS(c(cc2)cc(C(N3C)=O)c2N(C)C3=O)(=O)=O)=O)n1,2 Z2739389854,OC(CC(C1)OCC11CCOCC1)=O,2 F5090-2576,Cc(cc1)c(C)cc1NC(N(CC1)CCN1c(cc1)nnc1-c1c(C)cccc1)=O,0 Z2449904422,Cc1c(C(C2)CC2N(C2CC2)C(C(C2)C22CCNCC2)=O)cccc1,2 F866-0069,O=C(c(cc1)ccc1S(N1CCCC1)(=O)=O)NCCS(N(CC1)Cc2c1cccc2)(=O)=O,2 Z1038841286,CC(C(NCCc1c(C)[nH]c2c1cccc2)=O)NC(c1cccs1)=O,0 F6258-2466,CC1=C(C)N=CN(CCNC(NCc2cccs2)=O)C1=O,2 F1113-0111,CCN(CC)S(c(c1cccc2c11)ccc1SC2=O)(=O)=O,0 F6808-7770,O=C1N(CC2CN(CC(C3)CC3(F)F)CC3C2)C3=CC=C1,2 Z1560803046,COc(cc1)ccc1OCc(n1-c2ccccc2)nnc1SCC1(CCCC1)O,2 L218-0276,CC(c(cc1)ccc1NC(CN(c(cccc1)c1N12)C2=NC(c2ccccc2)=CC1=O)=O)=O,2 L712-0487,O=C(Nc(cccc1)c1Cl)N1CCN(CCn2c(-c3ccncc3)nc3cccnc23)CC1,0 Z2288270570,Cc1csc(C(NS(C(CC2)CCC2C(F)(F)F)(=O)=O)=O)c1,0 Z1588106765,CCc1cc(C(NC2CCN(Cc3ccccc3)CC2)=O)ncc1,2 J004-1085,Cc1noc(C(CCC2)N2C(c2noc(-c(cc3)ccc3Br)c2)=O)c1,0 SA04-0234,CCOCc1cnc(C)nc1C(CCC1)CN1S(c(cc1)cc(C)c1F)(=O)=O,0 CM4377-3770,CCC(C)(C)C(N(CCC1)CC1OCc1ncc(C)n1CCOC)=O,2 Z1250616904,Cc(cc(cc1)O)c1NS(c(cc1)ccc1Oc(cccc1)c1Cl)(=O)=O,0 F2068-0629,COc(cccc1)c1N(CC1)CCN1S(CCNC(C(CC1=O)CN1c1ccccc1)=O)(=O)=O,0 F6723-0851,N#Cc1cccnc1N(CC1)CCN1c1nsc2c1cccc2,0 Z1305171875,O=C(NCCN(CC1)CCN1c(cc1)ccc1F)N1CC(CC2)OC2C1,2 Z2928213081,CC(C)(Cc1ccc2)Oc1c2S(N(CCC1)[C@]1(C)C(O)=O)(=O)=O,0 SB75-0092,CC(C)C(N(C[C@@H]1C[C@H](C2)NC(c3c(C)nc(C)s3)=O)C[C@@]12c1nc(C)no1)=O,2 F6100-0188,O=C(c1ccco1)NCC(Cc1cccc(F)c1)N(CCC1)C1=O,2 F160-0979,Cc1c(C)oc(N=CN2CC(NC(CC3)CS3(=O)=O)=O)c1C2=O,2 F3077-0941,Cc(cc1)cc(C)c1NCC(Nc1ncc(Cc(cccc2)c2F)s1)=O,0 Z2304017507,CC(C)O[C@H](C1)C[C@H]1NC(c1cc(CCCC2)c2[nH]1)=O,0 S606-1124,COCCN(c1c(N2[C@H](CC3)CN3C(c(ccc(OC)n3)c3OC)=O)nccc1)C2=O,0 Z3686744047,CC(C)N(C(C(C(CC1)C2CC2)N1C(c([nH]nc1)c1Cl)=O)=NN1)C1=O,2 F3386-3144,CCOC(N1CCN(CC(Cn2c(cccc3)c3c3c2cccc3)O)CC1)=O,0 M034-4305,CC(C)c1nnc(-c2cccnc2N(CC2)CCN2C(C2Oc(cccc3)c3OC2)=O)o1,2 F6733-1370,CC(C)c1ncnc(NCc2c(N(C)C)nccc2)c1F,2 S988-1086,CCn1ncc(C(N(C[C@H]2CN(C3)S(CC)(=O)=O)C[C@]23c2nc(C)no2)=O)c1,0 Z299653722,COc(cccc1)c1N(CC1)CCN1S(c(cc1)cc(C=C2)c1OC2=O)(=O)=O,0 Y041-6424,O=C(Cn(cc1)c2c1cccc2)NC(CCC1)c2c1c(cccc1)c1[nH]2,0 SB36-0760,COCCNC(c1cn(C[C@H](CC(C2)(F)F)N2C(NCc(cc2)ccc2F)=O)nn1)=O,2 S757-0147,CO[C@H](C1)[C@@H](c2cnccc2)N1C1CCN(Cc(cc2)ccc2C#N)CC1,0 F6562-7596,COc1cc(OC)c(CCC(NC(CC2)C22CCOCC2)=O)cc1,0 F2392-0876,O=C(c(c(F)ccc1)c1Cl)NCC(c1cscc1)N(CC1)Cc2c1cccc2,2 F6745-0545,Brc1cc(CN(CC2)CCN2c2nsnc2)ccc1,0 SB32-0747,COC[C@@H](CN(C1)S(Cc(cc2)ccc2Cl)(=O)=O)[C@H]1c1nc(C2CC2)n[nH]1,0 Z2272183490,CC(CCOCC1)N1C(c1coc(CCC2)c1C2=O)=O,2 F6240-6628,O=C(c(cc1)cc(N2)c1Nc(cccc1)c1C2=O)NC(CC1)c2c1cccc2,2 G602-0365,CC(C)c(cc1)ccc1S(N(CC1)CCC1c1nc(-c(cc2)cc(OC)c2OC(C)C)no1)(=O)=O,0 SB75-0052,Cc1noc([C@@](C[C@@H](C2)NC(c(cc3)cc(F)c3OC)=O)(C3)[C@@H]2CN3C(COC)=O)n1,0 F3406-6682,CC(C(OC)=O)N(c1c2ccc(C)c1)N=C(C(N1CCCCCC1)=O)S2(=O)=O,2 Z981822292,CCOc(cc1)ccc1C(N(CC1)CCC1NC(CNC(c1noc(-c2ccccc2)c1)=O)=O)=O,2 Z466453246,Cc1cc(C(N(CCC2)CC2C(Nc(cc2)cnc2N(CCN2)CC2=O)=O)=O)cc(C)c1,0 F6560-6042,CCOc(cc1)ncc1C(NCc1cncc(-c2ccnn2C)c1)=O,2 F0655-0286,CC(C(c1cccs1)N(CC1)CCN1c1ccccc1)NC(C(NCCc1ccccc1)=O)=O,2 SC10-0068,COc1cccc(CN(CC2)CC2N(CCCN2CCOCC2)S(C)(=O)=O)n1,2 Y050-2196,CCOc(ccc(S(N(CCC1)CC1C(NC1CC1)=O)(=O)=O)c1)c1Cl,0 F6436-2296,OC(CNC(c(cccc1)c1S(C(F)F)(=O)=O)=O)(CC1)c2c1cccc2,0 F6414-0562,OC(CNC(c(cccc1)c1Cl)=O)c(cc1)cc2c1OCCO2,0 Z1222668402,O=C(c1cc([nH]cc2)c2cc1)Nc1cc(C(NCC2)=O)c2cc1,2 F2493-1479,COc(cccc1)c1OCC(NCc1noc(-c(cccc2)c2F)c1)=O,0 Z2053307654,CO[C@H](C1)CN(Cc2cccc(OC)n2)[C@@H]1c1nnc2n1CCC2,2 F5382-0739,COc(cc1)cc(Nc2nc(CC(NCCC3=CCCCC3)=O)cs2)c1OC,2 S689-0891,O=C(C(C1)CN(C(C2)CN2C(C2CCCCC2)=O)C1=O)NCC1CC1,2 F6559-0063,Cn(cc1)c2c1C=CN(CCNC(c1cc3c(-c4ccccc4)onc3cc1)=O)C2=O,2 F6524-4895,CCOc1nccn2c1nnc2CNC(c1cc(-c(cc2)ccc2F)c[nH]1)=O,2 F3225-5885,CC(C)C(c1nc(cccc2)c2[nH]1)NC(c1cccs1)=O,0 F3412-0040,CC(C1=C(C)Nc2ncnn2C1c1cn(C)nc1C)=O,2 SC88-0633,O=C(NCc(cc1)ccc1F)N(C1)CC1(C(CC1)c2nc(-c(cc3)ccc3F)no2)S1(=O)=O,2 F6240-7681,CCOc(cccc1)c1N(CC1)CCN1c(nc(C)nc1)c1-c1nc(-c2cscc2)no1,2 M039-0036,Cc(ccc(-c1c2nc(C)cc(C)n2nc1)c1)c1S(Nc1cc(OC)cc(OC)c1)(=O)=O,0 SC96-0204,O=C(CN(c(ccc(Cl)c1)c1O1)C1=O)N(CC1)CC2(COCC2)N(CC2CC2)C1=O,2 F5865-0009,O=C(c1ncccn1)N(CC1)CCN1c1ncccn1,2 F569-0501,CCC(C(Nc(ccc(F)c1)c1F)=O)Sc1nc(-c2ccccc2)nc2c1c(CC)nn2-c1ccccc1,2 F6448-0793,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)Nc1cn(C2COCC2)nc1,2 F6747-6288,COc(cc1)cc(N=CN2CC(CC3)CCN3c3cc(C(F)(F)F)ncc3)c1C2=O,0 E591-0955,CC(CC(C)C1)CN1C(CCc1nnc(cc2)n1nc2N1CCOCC1)=O,2 Z2983690859,CC1OCC(C2)(CC2N(C(CN2)=O)C2=O)C1,2 Z406396748,C(c1noc(CSc2ncccn2)n1)c1ccccc1,2 SC76-0088,OC[C@](C1)([C@@H]1c(cccc1)c1N1CC(NCc2cscc2)=O)C1=O,2 F6002-0029,CC(c1cccc(NC(CN(C=NC=C2C)C2=O)=O)c1)=O,0 F3055-0748,O=C(c1cc2nccnc2cc1)NCc(cccc1)c1Cl,0 D073-0034,Cc(c1ccccc11)nnc1Nc(cc1)cc2c1n(CCN(CCOC)C1)c1n2,2 Z3016334380,Cn1c2cccc(NC(NCCN3CCN(C)CC3)=O)c2cc1,2 Z946417518,CCC(c1ccccc1)NC(N(C)Cc1ccccc1)=O,0 8019-8740,O=C1N(CCc2ccccc2)C(SCc2csc(C3CCCCC3)n2)=Nc2c1cccc2,2 Z750307444,Cc1cc(NC(C(CC2)CCN2C(CC2CC2)=O)=O)ncc1,2 S427-0841,O=S(Cc1ccccc1)(N1CC(Cc2noc(-c3nccnc3)n2)CCC1)=O,2 F6516-1603,CN(C=CC=C1C(NCc2ccc(-c3cocc3)o2)=O)C1=O,2 G345-0641,CN(c(cc(c(OC)c1)OC)c1C(N1Cc(cc2)ccc2C(NC2CC2)=O)=O)C1=O,2 Z1505902492,Cc(nncc1)c1C(Nc1cc(N2CCCC2)ccc1)=O,2 E787-0392,CC(c(cc1)ccc1NC(CC(c1cccs1)N(Cc1c2cccc1)C2=O)=O)=O,2 L507-0880,Cc(n(C)c(-c1nc(C)c(C(N2CCOCC2)=O)s1)c1)c1S(N(C)C1CCCCC1)(=O)=O,2 Z739588986,O=C(CNc(cc1)ccc1C(N1CCOCC1)=O)N1CCCCC1,2 Z990633924,Cn1nnnc1CN(C=Nc1c2sc(-c3ccccc3)c1)C2=O,2 Z2313218602,CC(C(F)(F)F)N(CC1)CCN1C(Nc1cnncc1)=O,0 Z1346971863,CC(C)CN(CC(F)(F)F)C(Cn1nncc1)=O,0 Z2656173577,Cc1c[nH]cc1C(NCC1(CC1)C(O)=O)=O,2 F6480-1506,COc(cc1)ncc1C(N(CCC1)CC1Oc(ccnc1)c1Cl)=O,0 E196-0170,O=C1N(CC2OCCC2)C(SCc(cc2)ccc2Cl)=Nc2nccnc12,2 K505-0414,O=C(c(cccc1)c1N=C1/C=C\c(cc2)cc(F)c2F)N1c1cc(C(F)(F)F)ccc1,0 Z1176892390,Cc(cc(c(OC)c1)OC)c1S(N1Cc2nncn2CC1)(=O)=O,0 Z2483017836,OC(C(c1cc(Cl)cc(Cl)c1)N1CCC(CN(CCCC2)C2=O)CC1)=O,0 G395-0086,CCN(CC)c(cc1)nn2c1nnc2CCC(NCC1CN(Cc2ccc(C)cc2)CC1)=O,2 F6743-6422,CN(C1CCN(Cc2ncccc2)CC1)S(C1CC1)(=O)=O,2 F6734-1501,O=C(NCC1OCCC1)N(C1)CC(C2)C1CN2c(cc1)ncc1F,2 Y042-3933,O=C(C(CC1=O)CN1c(cc1)ccc1S(N1CCCC1)(=O)=O)Nc1nccs1,2 Z3873360315,O=C(c(c(F)ccc1)c1Sc(cc1)ccc1Cl)NC(CC1)CCC1N(CCC1)C1=O,2 Z4385079142,O[C@@H](CCC1)[C@H]1N(CC1)CCN1C(CCOc(cccc1)c1Cl)=O,0 SB14-0011,O=C(C1CC1)N(CC1)CC1N(C1CCOCC1)C(c1cscn1)=O,2 C879-1400,Cc1c(CNC(CCC2)c3c2cccc3)c(C(O)=O)c(C)n1Cc1c(C)ccc(C)c1,0 F6803-2496,COc(cn1)cnc1OC1CN(Cc(cc2)cc(F)c2OC)CC1,0 Z1613075894,CNC(CNC(NC(CCN1c(cc2)cc(Cl)c2F)C1=O)=O)=O,0 Z2220031753,OC1CCN(CCc2nc(-c3cccc(Cl)c3)no2)CCC1,0 M950-0761,Cc1c(-c2nnc(C3CCC3)o2)[nH]c(C)c1S(Nc1c(C)ccc(F)c1)(=O)=O,2 E515-0576,CN(C1CCCCC1)S(N(CCC1)CC1C(N(CC1)CCN1c(cccc1)c1F)=O)(=O)=O,0 Z1747837842,CC(C(N1C(CO)CCC1)=O)N1CCC(Cc2ccccc2)CC1,2 SB75-0124,CC(C)C(N(C[C@@H]1C[C@H](C2)NC(Cc3cccc(Cl)c3)=O)C[C@@]12c1nc(C)no1)=O,0 Z2011167647,CC(C)(C(CC1)(CCN1C(N(C)C1CCOCC1)=O)O)C(O)=O,0 Z1004770088,CC(c(cccc1)c1Oc1ccccc1)NC(NCC1CCOCC1)=O,2 F5094-1471,CC(C)n(c(C)c1)nc1C(Nc1nccs1)=O,0 Z2850941571,CCc1cc2c(NC(C3CC3)c3nc(C)ccn3)nc(C)nc2s1,2 SB36-0562,O=C(Cc1cccs1)N(C1)[C@H](Cn2nnc(C(N3CCCC3)=O)c2)CC1(F)F,2 Z2295291222,CC(CCC1)(CN1C(Nc1nnc(C2CCOCC2)s1)=O)OC,2 Z2936901683,CCc(cc1)c(C)cc1NC(c1c(C(NC(C)=C2)=O)n2nn1)=O,2 F6438-3415,COc1nc(N2CCOCC2)nc(CNC(c(cccc2)c2S(C(F)F)(=O)=O)=O)n1,0 V017-8898,CCCN(CC(CN1CCOCC1)O)Cc(c(C)nn1-c2ccccc2)c1Oc1cccc(F)c1,0 C361-2434,CSc1cccc(NC(C(CC2)CCN2S(c2cccc3nsnc23)(=O)=O)=O)c1,2 F0900-5504,CCOc(c1ccccc11)ccc1S(NCc1ccco1)(=O)=O,2 F6442-1910,CC(C)CS(C(C1)CN1C(CSc1ncccn1)=O)(=O)=O,2 Z1583636372,Cc(o1)ccc1S(N1CCN(CCS(N)(=O)=O)CC1)(=O)=O,2 E228-3080,CC1N(CCCNC(CCCN(c(cc(cc2)Br)c2-n2c3ccc2)C3=O)=O)CCCC1,0 D345-0413,Cc1c(C(N(CC2)CCC2c2nc(cccc3)c3s2)=O)oc2c1cc(C)c(C)c2,0 F6696-0137,CCc1ncnc(N(CC2)CC2Oc2c(C)cncc2)c1F,0 F5524-0180,CN(CC1)CCN1C(c1nn(CC(NCCCn2cncc2)=O)c(-c2cccs2)c1)=O,2 F6677-0880,CC(C)c1nccn1CC(C1)CN1C(Cc(cccc1)c1Br)=O,0 F5832-6281,O=C(CN(C(c1c2cccc1)=O)C2=O)NCC(c1ccco1)N(CC1)Cc2c1cccc2,2 SA70-1181,COCCC(CCC1)(CN1C(C1CCOCC1)=O)c1noc(C2CCOCC2)n1,2 C630-0416,COc(cc1)cc(N(CC(C2)c3nc(cccc4)c4n3CCOc(cc3)ccc3Cl)C2=O)c1OC,0 F6443-5713,O=C(c(cc1)cc2c1[nH]cn2)NCc1cc(Oc2ncccc2)ccc1,2 F6811-1766,Cc1nnc(CN(CC2)CCN2C(C=C2)=NN(Cc3ccccc3)C2=O)o1,2 Z1718763878,CC(c(cccc1)c1Oc1ccccc1)NC(CC(O)=O)=O,0 F6658-3841,CN(C(C=C1)=O)N=C1C(N(CCC1)CCN1c(cc1)nn2c1nnc2C1CCC1)=O,2 F6473-3909,Cc(cc(cc1)F)c1S(N(C1)CC1N(C(CC1)=O)C1=O)(=O)=O,0 F2881-0336,O=C(c1ccco1)NCCOc(cc1)nnc1-c(cc1)ccc1F,2 Z2614044621,CC(C)Cc1nsc(NC[C@@H](C2)[C@@H](c3cn(C)nc3)N(CCOC)C2=O)n1,0 Z1230910054,Cc1csc(C(CC(N(CC2)CCC2c2c[nH]nc2)=O)(C(F)(F)F)O)n1,2 S649-0868,O=C(c1nc2ccccc2cc1)N(CC1)CCC1N(C1)C2(CCOCC2)C1OCC1CC1,2 F6562-2573,O=C(Cc1cccc(C(F)(F)F)c1)NCc1cc(N(CCC2)C2=O)ncc1,0 F1813-0722,Cc(cc1)c2nc(NC(c(cccc3)c3OC)=O)sc2c1Cl,0 Z1130416584,CCC(N=C(c1cc(NC(NCc2cc(CO)ccc2)=O)ccc1)N1)=CC1=O,2 J106-0261,O=C(C(CC1=O)CN1c1n[nH]c2c1cccc2)NCCCc1nnc2n1cccc2,2 D466-0405,CC(C)N1Cc2nc(cc(cc3)NC(c(cc4)ccc4-n4cccc4)=O)c3n2CC1,2 F6672-0375,Cc1cn(C(CC2CC3)CC3N2C(Cc(ccc(F)c2)c2Br)=O)nc1,0 S726-0180,N#Cc1cccc(CN(CC2)CCC22OCCC(CCO)C2)c1,0 F5822-2400,CCOC(CN1CCC(Cn2c(C)ncc2)CC1)=O,2 F6788-3916,Cc1nc(C(F)F)cc(N(CC2)CCN2c2nc(cccc3)c3s2)n1,0 F048-0069,CN(CC1)Cc2c1nc(NC(c1cc(CCCC3)c3cc1)=O)s2,2 SA96-1157,CNC(C1C(C2)(CN2S(N(C)C)(=O)=O)CN(Cc2ccccc2)C1)=O,0 P396-1535,CCCS(N(CC1)CC1Oc1nccnc1N1CCOCC1)(=O)=O,0 Z2643717789,O=C(c1cc(-c2ccco2)nn1-c1ccccc1)NC(CC12)CC2C1(F)F,2 Z505853786,Cc(cccc1)c1N(CC1)CCN1C(NC(CCCCN1)C1=O)=O,0 SB70-0065,CN(C)[C@@H](Cc1c2)Cn1nc2C(NCc(cccc1)c1OC)=O,0 SC15-0534,COCC(C1)CN(CC(CC2)CCN2S(Cc(cc2)ccc2F)(=O)=O)C1=O,2 SA01-0989,CN(C)C(N(CC1)CC1c1nc(N(C)C)ncc1C(NCCOC)=O)=O,0 F5627-0031,CCCCS(NCCNc1nc(C)nc(N2CCOCC2)c1)(=O)=O,0 Z2827965814,O=C(C[C@H]1CNCC1)NCc(cc1)cc(C(F)(F)F)c1Cl,0 F6475-6618,O=C(c(cc1)cnc1OC1CSCC1)NCCCn1cncc1,2 D753-0225,Cc1c(CC(N[C@H]2CC[C@H](CN(Cc3c4cccc3)C4=O)CC2)=O)c(C)nn1-c1ncccc1,2 D399-3168,COc1ccc(C(CCC2)N2C(Nc(ccc(Br)c2)c2F)=O)cc1,0 F5033-2596,CC(C)(C)NC(N1CCC(CNC(c2cc(N(C)C)ccc2)=O)CC1)=O,0 F6476-1763,Cn1c(cccc2)c2c(CC(N(CC2)CC2Oc(cc2)ncc2Br)=O)c1,2 F6550-6303,Cc1c(C(N(C2)CC2Nc2nnccc2)=O)scn1,2 F6524-5792,O=C(CCn1c(cccc2)c2nc1)NCc1nnc2n1ccc(C(F)(F)F)c2,2 Z2295981499,CC[C@H](CC1)CC[C@@H]1C(N(CC1)CC1(C(F)(F)F)C(O)=O)=O,0 F5075-4417,CC(N=C(C=CC=C1)N1C1=O)=C1NC(Nc(cc1)cc(Cl)c1F)=O,0 F6559-7633,Cc1nc(n(C)nc2)c2c(NCc2nnc(CC3)n2CC3C(F)(F)F)n1,2 E533-0781,CC(CCCC1)C1NC(C(C)(Cn1c2ccc1-c1ccco1)N(CCCOC)C2=O)=O,0 F3342-0280,Cc(cc1)ccc1S(NCC(Nc(cc1)cc(C2)c1-c1c2cccc1)=O)(=O)=O,2 T991-1496,O=C(c(cc(cc1)F)c1Cl)N(CCC1)CCN1C(CCN1CC2CC2)C1=O,2 Z759302890,CCc(c1c2)noc1ncc2C(N(CC1)CCN1c1ncccc1)=O,0 F6559-1621,Cc1nc(C(N2CCN(CCF)CC2)=O)cs1,0 F6560-1231,Cc1nc2ncnn2c(OC(C2)CN2C(CSc(cc2)ccc2F)=O)c1,2 V012-5643,COc(cc1)ccc1OCC1OCCN(Cc2cccc(C(F)(F)F)c2)C1,0 8440-1801,CN(C)c(cc1)ccc1NC(CC(N1c(cc2)ccc2N2CCOCC2)=O)C1=O,0 Z1738000203,Cc(c(F)c(cc1)OC)c1S(NCCC(O)=O)(=O)=O,0 F363-1428,O=C(C(CCC1)CN1c(cc1)nnc1Sc(cc1)ccc1Br)NCC1OCCC1,2 SA70-0089,COCCC(CCC1)(CN1C(CCC1CCCCC1)=O)c1noc(C2CC2)n1,2 Z2960186551,CCS(C(C1)CN1C(C1(C)c(cccc2)c2OCC1)=O)(=O)=O,2 J038-0149,Fc(cc1)cc([C@H]2OCCC[C@@H]22)c1NC2c(cc1)ccc1Br,0 F6312-0448,O=S(c1ccccc1)(NCCCn1c2ncccc2cc1)=O,2 F2849-0183,Cc1nc(SCC(N(CC(Nc(ccc(F)c2)c2F)=O)C=C2OC)=CC2=O)nc(C)c1,0 F6561-2380,O=C(CSc(cc1)ccc1F)N(CC1)CC1OCC1CC1,2 G500-0714,CN(C)c1ccc(C(CNC(COc2ccccc2)=O)N(CC2)c3c2cccc3)cc1,2 Z2412778467,C(c1ccno1)c1noc(-c2cc(CCNCC3)c3cc2)n1,2 Z4307079283,CCn1c(N)nc2c1ccc(C(NC1(C)CC1)=O)c2,0 Y500-7338,Cn1ncc(CNC(c2c(c(C3CC3)nn3C)c3nc(C3CC3)c2)=O)c1,2 E852-3394,CCN(C(C)(Cn(c1c2)nc2C(NC2CCCC2)=O)C(NC2CCCC2)=O)C1=O,0 Z445158528,OC(CN(CC1CC1)S(c(cc1)ccc1Cl)(=O)=O)=O,0 Z2952378541,CCCCC1(CC1)C(N(CCC1)CC1c1noc(C(C)C)n1)=O,2 S836-2490,CCn1ncc(S(N(C[C@@H]2COC)C[C@@H]2C(NC)=O)(=O)=O)c1,0 F6452-2605,COC1(CNC(NCc(cc2)cc(OC)c2OC)=O)C2CC(C3)CC1CC3C2,2 F6477-5187,Cc1c(C)scc1-c1csc(Nc2ncccc2C)n1,2 Z4252259608,CN(Cc1ncccn1)C(c1cc(Br)cc(OC2)c1NC2=O)=O,2 Z4130684205,N#Cc1cccc(NC(c2cccc(NC(C3c4nc(C(F)(F)F)cn4CCC3)=O)c2)=O)c1,2 F6482-6149,COCCNC(NCc1cc(-c2ccncc2)ncc1)=O,2 Z2444790154,O=C(C1NCCC1)NCC1CN(Cc2cc3ccccc3cc2)CCC1,2 S903-0317,CN(C)C(N(CC1)CCC1c1nnc(C2)n1CCN2C(NCc1cc(OC)ccc1)=O)=O,0 Z3364187518,CC(C)CN(Cc1nnn[nH]1)C([C@@H]1C[C@H](C2)[C@H]2C1)=O,2 F2458-0057,CN(CC(NCCc1ccccc1)=O)S(c1cccc2cnccc12)(=O)=O,2 F6554-8392,CC(C(N1C(C2)CSC2C1)=O)NC(OC(C)(C)C)=O,2 F3284-8030,Nc(ccc(F)c1)c1S(Nc(cc1)ccc1Br)(=O)=O,0 F589-0056,Cc1c(C(CC2)CCN2S(c2cccc(Cl)c2)(=O)=O)c(cccc2)c2n1Cc(cc1)ccc1F,0 Z2446359539,OC([C@H](CC1)C[C@H]1NC(Nc1nc(Cc2ccccc2)ncc1)=O)=O,2 Z1134688685,CCC(C)(C(N1CC(Nc(cc2)cc(CC3)c2N(C)C3=O)=O)=O)NC1=O,2 Z1324183258,Cc1cc(S(NC2(CCCC2)c2nccs2)(=O)=O)cc(F)c1,0 Z1130377647,CC(CC1)Cc2c1nc(NC(N(CC1)C[C@H]1O)=O)s2,0 Z1129210537,CCCC(c1ncccc1)NC(c1cc(COCC2)c2s1)=O,2 F5854-2294,COCCN(Cc1ccncc1)C(Nc1cc(OC)cc(OC)c1)=O,0 F6672-0216,CC(C)(C(N(C(CC1)C2)C1CC2n1ncc(C)c1)=O)Oc(cc1)ccc1Cl,0 Z1333198042,CN(C1CCCCC1)C(CNc1c(ccc(F)c2)c2ncc1)=O,2 F6525-5185,CSc(cccc1)c1C(NCCn1ncc(-c2cnccc2)c1)=O,0 F1830-0078,CNC(c1c(NC(C(c2ccccc2)c2ccccc2)=O)sc2c1CCC2)=O,2 F6495-2775,O=C(c1ncnc(N2CCOCC2)c1)NCCn1ncnc1,2 S720-2194,NC([C@H](C1)N(CC2CC2)C[C@H]1Oc1ccccc1)=O,2 F2407-0890,Cc1cccc(NC(Cn2c(cccc3)c3c(S(c(cc3)ccc3F)(=O)=O)c2)=O)n1,2 P944-0585,CCc1nncn1C(CC1)CN1C(c(cc1)cc(OCC)c1OCC)=O,2 G406-1309,O=C(CN(C(CC1)=O)c(cc2)c1cc2S(N1CCOCC1)(=O)=O)NC(CCC1)c2c1cccc2,2 F6473-8725,CC(N1C2CC2)=CC(OC(C2)CN2C(c2cc(Br)cnc2)=O)=CC1=O,2 S869-0049,O=C(C1CCCC1)NC(CC1)CN1c1nncc(N2CCOCC2)c1,2 Z3254291030,OC(CC1(CC(N2CC(c(cc3)ccc3Br)OCC2)=O)CC1)=O,2 F6479-4071,Cc1cc(OC(CC2)CCN2C(Cc2noc3c2cccc3)=O)nc(C)n1,2 F6480-3058,Cc1nc(OC(CCC2)CN2C(Cc2cccs2)=O)nc(C)c1,2 F6438-3202,CN(C)c1nc(CNC(c2cccnc2SC)=O)nc(OC)n1,0 K906-2153,COc1cc(NC(CN(c(ccc(S(NC2CCCC2)(=O)=O)c2)c2O2)C2=O)=O)cc(OC)c1,0 Z2003918732,CC(N12)=CSC2=NC=C(C(Nc(cc(cc2)-c3nc(cccc4)c4[nH]3)c2OC)=O)C1=O,2 S827-2759,Cn1c(C(N(CC(C2)(F)F)[C@@H]2c2nc(COC)no2)=O)cnc1,2 Z2360804650,O=C(NCC1CCNCC1)NCc1cccnc1OCC(F)(F)F,0 Z1978395878,Cc1nn(cc(cc2)NC(c3cc(CCC4)c4cc3)=O)c2n1,2 Z1686711787,CC(C(Nc1c(C)c(C)ccc1)=O)Nc1cn(CC2OCCC2)nc1,0 F6471-7772,O=C(c1c[nH]c2c1cccc2)N(CC1)Cc2c1onc2,2 J026-0126,CCC(C)NC(CN(C(c1c(C)cc(C)nc1N1c2ccccc2)=O)C1=O)=O,2 Z748603992,CC(c(cccc1)c1NS(C)(=O)=O)NC(c1cc(COC)ccc1)=O,0 L981-0729,O=C(CSc1nccnc1N(CC1)CCN1c1ccccc1)N(CC1)CCN1c1ccccc1,2 F6102-0238,O=C(c1nccnc1)NCC(Cc1cccc(F)c1)N(CCCC1)C1=O,2 F6802-8066,O=C(C(CCC1)CN1c1ncncc1F)N1CCSCC1,0 8017-1508,CCN(C(C1(CC(c2ccncc2)=O)O)=O)c(cc2)c1cc2Br,0 Z56666230,O=C(c1ccco1)NS(c(cc1)ccc1Br)(=O)=O,0 F6473-8918,CC(N1C2CC2)=CC(OC(C2)CN2S(c(s2)ccc2Cl)(=O)=O)=CC1=O,2 F6440-3997,Cn1nc(CNC(C(CC2)CCN2S(C)(=O)=O)=O)cc1C1CC1,2 F1109-0111,CC(NC(SC)=C(C1c(cccc2)c2OC)C#N)=C1C(OCC=C)=O,0 F6502-0466,O=S(c(cccc1)c1Br)(NCCn1c(-c2ncccc2)ncc1)=O,0 Z3416615929,CN=S(CC1)(CCC1(C1)OCCN1C(C1(CCC1)c1cc(F)ccc1)=O)=O,2 Z4635150136,CN1C(CNc2ncnc([nH]3)c2cc3Br)CCC2(CCC2)C1,2 F6215-0340,Cc1noc(CCNS(c(cc2)ccc2Br)(=O)=O)c1,2 S689-2187,O=C(C(C1)CN(C(C2)CN2C(NC2CCCCC2)=O)C1=O)NCc1ccncc1,2 Y031-4973,CCCCN(CC(C1)C(Nc2nnc(CC(C)(C)C)s2)=O)C1=O,0 F5061-0083,CC(C)(C)NC(CSc1ncnc2c1nnn2C)=O,0 SC96-0839,Cc1cn(Cc2cc(C(N(CC3)CC4(COCC4)N(CCCOC)C3=O)=O)no2)nc1,2 Z3643723681,Oc(cc(C(CCC1)CN1C(c1cncc(N(CCC2)C2=O)c1)=O)cc1)c1F,2 F6515-4624,O=C(c1cc(-n2nccc2)ccc1)NCc1cc(-c2cccs2)cnc1,2 S397-0515,CC(C)n1nc(C(NCCCN(CCC2)C2=O)=O)c2c1CCOC2,0 F6529-1373,CN(C(C(F)(F)F)=NN1C(CC2)CCN2S(Cc2noc3c2cccc3)(=O)=O)C1=O,2 F6658-4216,CCS(N1CC(CN(C2)c3ncnc(C4CC4)c3)C2C1)(=O)=O,0 Z216794604,CCN(c(cccc1)c1N1CC(Nc2nccnc2)=O)C1=O,0 Z1784596319,Cn1nnc2cc(C(NCCN3CCOCCC3)=O)cnc12,2 F6241-0316,CC(C)c(cccc1)c1NC(C(COC1)N(Cc2ccccc2)C1=O)=O,0 F5557-0131,COc(cc1)ccc1C(CSc1ncccc1-c1nc(cccc2)c2[nH]1)=O,2 F5120-0223,O=C(CN(c(cc1)ccc1F)S(c1cnccc1)(=O)=O)NCCc1ccccc1,2 F6796-9127,FC(c1csc(N(C2)CC(C3)C2CN3c2ncccc2F)n1)(F)F,2 F6381-1116,O=C(NCCCc1ccccc1)Nc(cc1)cnc1-n1cncc1,2 SC70-0409,CCCc1nc(C(C2)C3(CCC3)CN2C(c2c(C)nc(C)s2)=O)n[nH]1,2 Z1392768173,OC(CNC(c1c[nH]nc1-c(cccc1)c1Cl)=O)COc1cc(F)ccc1,2 F6473-4203,Cn(c(C(N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O)=O)c1)nc1-c1ccccc1,0 Z2974992060,CC(CNc1nc(C2CC2)nc(C)c1)(c1cccc(F)c1)O,0 F5033-7602,COc(cccc1)c1NC(N1CCC(CNC(Nc(c(F)ccc2)c2F)=O)CC1)=O,2 F6743-9807,CS(NC(CCC1)CN1c1ccc(ccc(Br)c2)c2n1)(=O)=O,0 S724-0724,COc(cc1)ncc1C(N(C1)CC1n1nnc(C(N2CCOCC2)=O)c1)=O,2 F6619-3806,Cc1nc(CN(CC2)CCN2c2nc(N3CCCC3)cc(C)n2)cs1,2 Z2910461893,C[C@@H](C(O)=O)NC(c1c(C)oc(-c2cccc(C(F)(F)F)c2)n1)=O,0 F6521-8449,COc1cc(CCCC2(CNC(C3(CC3)c(cccc3)c3OC)=O)O)c2cc1,2 F6812-1533,FC(c1nnc(CN(CC2)CCN2c2nc(-c3ncccc3)ccn2)o1)(F)F,2 F6796-7369,N#Cc1c(N(CC2)CCN2c2ncnc3c2ncn3C2CC2)nccc1,2 F6222-0270,Cc(cc1)nnc1Oc1cccc(C(Nc2cnc(N3CCOCC3)nc2)=O)c1,2 Z2482080116,OC([C@H](CCC1)[C@H]1NC(c(cc1)cnc1-c1ncccc1)=O)=O,0 8289-4289,O=C(c1cc(C2=Cc(cccc3)c3OC2=O)ccc1)Nc1cccc(-c2nc(cccc3)c3s2)c1,0 S904-1056,Cc1nn(C)cc1CN(C[C@H](C1)O)[C@@H]1c1nnc2n1CCN(C)C2,0 F5937-0036,CC(Nc(cc1)ccc1C(NCCCn1cccc1)=O)=O,0 Z1720294807,O=C(C(C=C(C1CC1)N1)=CC1=O)NC(CCc1ccccc1)C(F)(F)F,2 C200-4959,CC(C)(C)c(cc1)ccc1S(C(C(N1)=O)=CNC1=S)(=O)=O,2 F6475-3345,O=C(c(cc1)cnc1OC1CCOCC1)Nc1cccc2ncccc12,2 G325-0478,O=C(CCS(c(cc1)cc(CC2)c1N2C(C1CC1)=O)(=O)=O)N(CC1)CCN1c1ccccc1,0 C669-2592,Cc(cc1)ccc1S(Nc1nc2ccccc2nc1N(CC1)CCN1c1ccccc1)(=O)=O,0 SA93-0486,CCn1nccc1C(N(CCC1)CC1(CC1CC1)C(N)=O)=O,0 F6510-2816,CN(c(ccc(NC(OCC(F)(F)F)=O)c1)c1N1C)S1(=O)=O,0 Z812424096,CCOc1ccc(C2(CNC(c3cn(C)nc3C(C)C)=O)CCOCC2)cc1,0 Y300-3595,CC(C)c(ccc(C)c1)c1OC(C)C(N(C1)c(cccc2)c2NC1=O)=O,0 Z1443723588,CN(CC(O)=O)C(c1cc(cc(C(F)(F)F)cc2)c2n1C)=O,0 G278-0228,CC(c(cc1)cc2c1OCCO2)NC(c1ccc(N2c(cccc3)c3OCC2)s1)=O,2 SB95-0709,O=C(C1CCC1)N(CCN1CCCC1)C(CCC1)CN1C(NC1CCCC1)=O,2 F6517-1745,COc1c(C2(CC2)C(NCC(c2ccc(-c3ccco3)s2)O)=O)cccc1,2 F6808-5277,CC(C)NC(C(C)N(CC1)CCN1c1nccn2nccc12)=O,0 Z2957914498,O=C([C@H](C1)[C@H]2O[C@@H]1[C@H]1[C@@H]2C1)NOCc1cnccc1,2 Z1815956869,OC(CC(C1)(F)F)CN1c1ncnc2c1oc1c2cccc1,0 Y030-8672,O=C(C1OCCC1)Nc1nnc(Cc(cc2)ccc2Cl)s1,2 F6166-0182,O=C(Cn1c(cccc2)c2nc1)N(CC1)CCN1c1ncnc(-c2ccccc2)c1,2 F1899-2218,O=C(CSc(cc1)nnc1-n1nccc1)NCc(cccc1)c1Cl,2 Z1219219453,CCC(CCC1)N1C(Nc1cc(CC)nn1C)=O,2 F6503-3933,Cn1nc(CN(Cc2ccco2)C(c2nc(cccc3)c3s2)=O)cc1C1CC1,2 F6471-8563,Cn1c(S(C(CC2)CCN2C(c2nc3ccccc3nc2)=O)(=O)=O)ncc1,2 Z1391426960,CCc1nn(CCCC2NC(C(CCC3)c4c3cccc4)=O)c2n1,2 Z2119140684,CC(C1CN(Cc2ccccc2)CC1)NC(NC(CN(C)C)c(cc1)ccc1OC)=O,2 Z3014443957,Cc(nc(cc1)NCCc2c[nH]nn2)c1C#N,2 Z851793258,CC(C)C[C@H](C(O)=O)NC(c1cccc(Br)c1)=O,0 F6733-1317,CC(C)c1ncnc(Nc(cc2OC)cc(OC)c2OC)c1F,0 Z2225432923,CCc1ccc(C(C2)OCCN2C(c2cnnn2CC)=O)cc1,0 Z2643157632,CCNC(CCC(NCc1ccc(CNC(C)=O)cc1)=O)=O,0 Z2764021429,O[C@@H](CC1)[C@H]1n1nnc(-c2cccc(Cl)c2)c1,2 Z118744818,CCNC(c1c[nH]c(cc2)c1cc2Br)=O,0 L613-0109,CC(C)CCNC(C(CCC1)N1C(c(cc1)ccc1NC(c(cc1)ccc1Br)=O)=O)=O,2 Z2503797258,COc1cccc(C(CC2)CCN2C(C(C2)C22CNCCC2)=O)c1,2 SA44-0709,CN(CC(C1)(CN1S(Cc1ccccc1)(=O)=O)C1)C1c1nnc(-c2ccccc2)o1,0 F6559-6493,Cn1ncc2c1ncnc2NC(CC1)CCN1c1ncnc2c1CCCC2,2 Z2231657214,CN(CC(C(N(CCCN1)C(Cc2ccccc2)C1=O)=O)c1c2cccc1)C2=O,2 F6178-4320,N#Cc1cccnc1N1CCC(CNC(c(s2)ccc2Cl)=O)CC1,2 F6246-1145,CN(C(c1ncccc1)=NN1Cc2ccc(C(OC)=O)o2)C1=O,2 F6475-1771,Cc1cccc2c1nc(NC(c(cn1)cc(Cl)c1OC1COCC1)=O)s2,2 F6546-0711,O=C(c1ccncc1)N1CC(CN(C2)C3CC3)C2C1,2 SB55-0581,CC(C)Cc1nc([C@]2(CCC3)[C@@H]3CN(Cc3cnccc3)C2)no1,2 Z2615740698,CC(c(cc1)ccc1-c(cc1)ccc1F)NC(N1CC(C)(CO)C(C)C1)=O,0 Z2434050644,N#Cc1ccnc(N(CCC2)C2C2COCCC2)c1Cl,0 Z1280140754,O=C(CCN(C(C1C2C3OC1CC3)=O)C2=O)NCc(cccc1)c1-n1cncc1,2 Z2479358750,CCc1csc(S(NC([C@@H](C2)[C@H]2C2CCC2)=O)(=O)=O)n1,2 G406-1701,CC(CC1)CCN1S(c(cc1)cc(CC2)c1N(CC(Nc(cc1)cc3c1OCCO3)=O)C2=O)(=O)=O,0 F2795-0550,Cc(ccc(NC(C(NCCCN1CCOCC1)=O)=O)c1)c1F,0 E197-0259,CC(C)(c(cc(cc1)S(N(C)CC(N(CC2)CCN2c2ccccc2)=O)(=O)=O)c1N1C)C1=O,2 D330-0867,Cc1c(CC(c(cccc2)c2N2C)C2=O)oc(cc2)c1cc2F,0 F5033-3392,COC(N1CCC(CNC(Cc(cccc2)c2Cl)=O)CC1)=O,0 F6420-0983,COC1(CNC(Nc(cccc2OC)c2OC)=O)CSCC1,0 F6752-6218,O=C(C(CCC1)CN1c(ccnc1)c1Cl)N(CC1)CCC1(F)F,2 F870-1310,COc(ccc(NC(c(cc1)ccc1Nc1nc(-c2ccccc2)ncc1)=O)c1)c1Cl,0 L075-0048,O=C(CC(CC1)CCN1C(c1cc(cccc2)c2[nH]1)=O)N(CC1)CCN1c1ccccc1,0 Z1479459082,Cc1ccc(cc(cc2)C(NCC3(CO)CCCCC3)=O)c2n1,2 Z511524642,CC(Cn1nccc1)NC(N1CCN(Cc(c(F)ccc2)c2Cl)CC1)=O,0 Z2926589838,CN1C(CNC(NCC(CO)c(cc2)ccc2Cl)=O)CC1,0 F6524-5539,Cn1nc(C(NCc2nnc(cc3)n2nc3OC)=O)c2c1cccc2,2 F6791-8267,Cn1ncc2c1ncnc2N(CC1)CCC1c1nnc(C2CC2)o1,2 F5591-0114,Cc1nc(-c(cc2)cnc2N(CC2)CCN2C(Cc2cccs2)=O)no1,2 Y030-5535,CCC(CC)NC(Cc(cc1)ccc1Br)=O,0 F6472-7281,Cc1nn2c(CCN(C3)C(c4c(C)n(-c5ccccc5)nc4)=O)c3cnc2c1,2 Z1392092227,CC(CC(N1c(cc(cc2)F)c2OCC1)=O)NC(C1CCCCC1)=O,2 F3186-0026,C(CSc1nnc(-c2cccs2)o1)c1ccccc1,2 SB13-0161,CC(C)CN([C@@H]([C@H](CC1)C(NCCCN(CCC2)C2=O)=O)c2cnccc2)C1=O,2 Z3009327361,Cn1ncc(S(N(CCC2)CC22Oc(cccc3)c3C=C2)(=O)=O)c1,2 F6089-9778,CSc1c(CN2CCC(CNC(NCC3OCCC3)=O)CC2)cccc1,2 Z1144847261,CC(N(CC1)CCC1C(N1CC(c(c(Cl)c2)cc(F)c2Cl)OCC1)=O)=O,2 Z1733641134,O=C(Nc1ccnn1C(CC1)CS1(=O)=O)N1CCCC1,2 6360-0006,OC(C(CC1)CCN1c1nc(-c2ccccc2)c(cc(cc2)Br)c2n1)=O,2 Z872362442,O=C(C(c1cccc(Cl)c1)(F)F)N1CCC1,0 F6516-1753,Cn(c(C(NCc1ccc(-c2cocc2)o1)=O)c1)nc1-c(cc1)ccc1F,2 Z2125781782,CC(CN(C)C(C(Nc(cc1)cc2c1[nH]c(C)c2)=O)=O)OC,0 F6747-9533,Cc1cn(CCN(CC2)CCC2N(C)c(nc2)ncc2Cl)nc1,2 F6747-6038,Clc1cn(CC(C2)CN2c2cnc(cc(cc3)Cl)c3n2)nc1,0 F6559-1358,Cc1nc(cccc2)c2n1C(CC1)CN1C(CCc1c[nH]c2c1cccc2)=O,2 F6560-2579,O=C(C(CCC1)N1c1nc(cccc2)c2o1)NCc1cn(-c2ccncc2)nn1,2 S971-0432,CCCC(CC1)(C1(CC1)CCN1C(CCc(cc1)ccc1OC)=O)O,0 Y043-5218,O=C(c(cc1)cc2c1[nH]c1c2CCCC1)N(CC1)Cc2c1c(cccc1)c1[nH]2,2 Z4368571974,CC(C)c1c(C(N(Cc2n[nH]nn2)C2CCCC2)=O)occ1,2 SA02-1326,CCOCc1cnc(C)nc1C(CC1)CCN1C(C1(CCCC1)c1ccccc1)=O,0 F6573-0246,Cn1nccc1-c1ncc(CNC(Cn2nnc3c2cccc3)=O)cc1,2 F345-1443,Cc1ccc(CNC(CC(CC2)CCN2C(NCc2cccc(F)c2)=O)=O)cc1,2 F5854-4796,COCCN(Cc1cscc1)C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)=O,0 Z1132992059,OCc1cccc(CNC(NCC2CN(Cc3ccccc3)CCC2)=O)c1,2 8001-2833,CC(c(cc1)cc(F)c1N1CCCCC1)(C#Cc1ccccc1)O,2 S570-0028,O=C(c1c[nH]nc1-c(cc1)ccc1F)NCC1(CCC(N2)=O)C2=CCCC1,2 F6436-3457,O=C(c1cocc1)N1CCC(CNC(c(cc2)ccc2-c2cscc2)=O)CC1,2 Z1947773057,C(c1cccc(Oc2ccccc2)c1)N1C[C@H](CNC2)[C@H]2C1,2 F6286-0957,O=C(C1CC=CCC1)NCCc1nc(CCCC2)c2c(C(F)(F)F)n1,2 F6435-8673,CCOc1c(CCC(N(CC2)CC2S(c(cc2)ccc2Cl)(=O)=O)=O)cccc1,2 Z2274227011,N#Cc1cc(Br)cnc1N[C@@H](COC1)[C@H]1O,0 Z3007307236,CN(C)c1cccc(C(N[C@@H]2[C@@H](c3nccn3C)OCCC2)=O)c1,0 F6524-0930,CCn1nc(C(NCCN2N=Nc(cccc3)c3C2=O)=O)c(Cl)c1,2 G668-0449,COc(cc1)cc(C2)c1OCC2C(Nc(ccc(Br)c1)c1F)=O,0 F6808-2807,Cc1cccc(N2CCN(Cc3nnc(C4COCC4)o3)CC2)c1C,2 F6608-3783,CCN1CCN(CC#CCOC(CC2)CCN2c2c(C)c(C)nc3ncnn23)CC1,2 F383-0993,COc(ccc(CN(C(C1C2CCCC1)=O)C2=O)c1)c1S(N1CCOCC1)(=O)=O,2 Z3208223264,CC(C)CC(NC(C(C)C)C(NC(CO)c(cc(cc1)F)c1F)=O)=O,0 P315-0947,Cc(cc(cc1)N(CCC2NC(Nc3cc(F)cc(F)c3)=O)C2=O)c1F,0 SC69-0893,CCCOc(cc1)ccc1S(N(C1)CC2(CCCC2)C1c1nncn1C1CC1)(=O)=O,0 Z773755684,Cc1nn(C)c2c1c(C(NCCOC1CCCC1)=O)cc(-c1cccs1)n2,2 F6222-0230,CCCCOc(cc1)ccc1C(Nc1cnc(N2CCOCC2)nc1)=O,0 F6550-6001,Cc1cc(C(N(C2)CC2Nc2nnccc2)=O)no1,2 Z1869614605,CCOc(cccc1)c1-c1cccc(C(NC(C)(C)C(O)=O)=O)c1,0 F6523-2981,CCn1c(-c2noc(CNC(c(s3)ccc3Cl)=O)n2)ccc1,2 Y502-9166,Cc1cc(C)nn1Cc1cccc(N(C([C@H]2[C@@H]3CCCC2)=O)C3=O)c1,2 Z2002221773,O=C(c1n[nH]c(-c(cccc2)c2Cl)c1)NCC(CC1)CCC1(F)F,2 SC19-0723,CCn1nc(CN(CC2)CCC2NC(c2c(C)n(C)nc2)=O)c2c1CCOC2,2 Z1243923645,CC(C)(C)c1nnc(NC(NCC2(CCC2)O)=O)s1,2 F6512-0216,O=C(CN(C(CC1)=O)C1=O)N1Cc2ccnn2CC1,2 C776-3466,COc(cc1)ccc1N(CC1)CCN1C(C(CCC1)CN1c1nc(cccc2)c2[nH]1)=O,0 F2213-0521,Cc(cc1)ccc1N1N=C(C(N(CC2)CCN2c2cccc(C(F)(F)F)c2)=O)C(OC)=CC1=O,2 Z394654006,CCOc(cc1)c(C)cc1S(Nc1ccc(CC(O)=O)cc1)(=O)=O,0 S903-1390,CC(C)CC(N(CC1)CCC1c1nnc(C2)n1CCN2C(c1ncncc1)=O)=O,2 Z3041196927,CC(C)C(CNC(N(CC1)CCC1(N1)OCC1=O)=O)c(cc1)ccc1Cl,2 F1874-0625,CCOC(N(CC1)CCN1C(CSc1c(cnn2-c(cc3)ccc3Cl)c2ncn1)=O)=O,2 F6597-0640,Cc1cccnc1OCC(CC1)CCN1c1nccnc1,0 Z4518025482,CC(C)OC(c1c(C)ccc(S(NCC2C=CCC2)(=O)=O)c1)=O,2 SA46-1078,O=C(CCN(c(cccc1)c1O1)C1=O)N(C1)CC1(C1)OCC1N1CCCC1,2 Z2790726591,CN(Cc1nc(C(O)=O)cs1)C1(COC)CCC1,2 S545-0240,Cc1ccc(CNC(N(CCCCC2)C2c2nc(C3CC3)no2)=O)cc1,2 F6439-4695,CCCc1c(C(NCCn2nc(C(F)(F)F)cc2)=O)snn1,2 F6445-0309,O=C(c1cc(Oc2ncccc2)ccc1)N(CC1)c2c1cccc2,2 F6521-1758,CC(c1ccc(C2(CNC(c3cc(cccc4)c4s3)=O)CCCC2)s1)O,2 D757-0292,O=C([C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1)Nc1ccc(Cn2ncnc2)cc1,2 Z971955650,CC(C)Oc1c(CC(NCc2cc(-n3cncc3)ncc2)=O)cccc1,0 V008-9846,CC(C1=O)N(Cc(ccc(F)c2)c2F)CCN1c(cc(cc1)OC)c1OC,0 F6573-6361,O=C(c1cc(Br)cnc1)N(CC1)CCC1(C1)C1(F)F,0 F5263-0597,O=C(c1cccs1)NCC1(CC1)c(cc1)ccc1F,2 Z1521806578,Cc1c(C(CCC2)N2C(C(CC2)Cc3c2[nH]nc3)=O)cccc1,0 F6519-5762,Cc1noc(C)c1CCC(NCC(c1ccco1)n1nccc1)=O,2 F6245-3515,CN(C1=O)N=C(C(CC2)CCN2C(Nc2cccc(C(F)(F)F)c2)=O)N1c1ccccc1,2 Z1856597037,CN(C)c1cccc(C(CCC2)N2C(Nc2cnns2)=O)c1,0 F3371-0132,Clc(cc1)ccc1-c1nc(NCc2ncccc2)nc2ccccc12,2 D479-0268,CC(C)Cc1ccc(C(C)C(N(C2)c(cccc3)c3NC2=O)=O)cc1,0 Z2474021940,O=C(CC1C2CC(C3)CC1CC3C2)N1Cc2nnc(Cc3ccccc3)n2CC1,2 Z4126467926,Cc1cc(Cl)ncc1NC(N[C@@H](CCC1)C[C@@H]1C1CC1)=O,0 F6561-5174,CCOCC(N(CC1)CCC1S(Cc1ccccc1)(=O)=O)=O,0 Z2958789627,COc1nccc(C(NC(CC2)CCN2c(cc2)ccc2Cl)=O)n1,2 Z1861995405,CC(N(CC1)Cc2c1ccc(Cl)c2Cl)=O,0 Z2182561064,Cc(cc1)cc2c1c(CCNC(N1[C@H](CN3CCOCC3)CCC1)=O)c[nH]2,0 P807-0460,O=C(c1c[nH]c2c1cccc2)NCC(CC1)CCN1c1cc(-c(cc2)ccc2F)n[nH]1,2 E715-0475,O=C(C(CC1)CCN1c1ncnc2c1nc1n2CCCCC1)NCCCN(CC1)Cc2c1cccc2,2 Y042-3562,O=C(C(CC1=O)CN1c(cc1)ccc1Br)Nc(cc1)cc(C=C2)c1OC2=O,0 F9995-2552,COc(cc1)ccc1S(C1CCNCC1)(=O)=O,0 F5095-0938,CCn1c(N(CC2)CCN2C(c2cn(C)nc2OC)=O)ncc1,2 F2580-1804,O=C(CN(C=CN(c1cccc2ccccc12)C1=O)C1=O)Nc(ccc(Br)c1)c1F,0 SB75-0929,CCS(N[C@H](C[C@H]1CN(C2)C(c(cc(cc3)F)c3F)=O)C[C@]12c1nc(C)no1)(=O)=O,0 P930-1341,CCn1ncc(CN(CCC2)[C@@H]2c2nnc(-c3ccccc3)[nH]2)c1C,0 Z4324307459,CC(C(N(CCN(C)C)C1)=O)N1C(C(C1)(c(cc(cc2)Cl)c2NC1=O)O)=O,2 Z1137435005,CCn1nccc1NC([C@@H](CC1)NC1=O)=O,2 Z2295581561,Cc1cccc(CC(NC2(CCCC2)C(O)=O)=O)c1Cl,0 Z3216016986,CCc(cc1)ccc1S(N(CC(C1)C(O)=O)CC1N(C)C)(=O)=O,0 F6521-3782,CC(CNC(COc1c2OC(C)(C)Cc2ccc1)=O)(c1cc(cccc2)c2o1)O,2 Z2290852141,CC(C)(CCN(CC1)C(Nc(cc2)ncc2Cl)=O)S1=O,2 Z3873357918,Cc(ccc(Br)c1)c1C(N(C)CC(Nc(cc1)cc(C(N)=O)c1F)=O)=O,0 F1609-0111,CCOc(cc12)ccc2ncc(S(c(cc2)ccc2Cl)(=O)=O)c1N1CCN(C)CC1,0 C137-2176,O=C(C1CC1)N(CCc1c2)c1cc(S(N(CC1)Cc3c1cccc3)(=O)=O)c2Br,2 Z1241676495,Cc1c(CNC(CC2)CCN2c2cccc(F)c2)c(C)n[nH]1,0 V018-9997,Cc(cc1)c(C)cc1N1CCN(CC(C2)OCCN2C(Nc2ccccc2)=O)CC1,0 Z1944111756,CC(c1c(C)n(C)nc1)NC(c(nccc1)c1Br)=O,0 P435-1830,CCn1nc(C)c(-c2cc(C(N(CC3)CCC3c3nc(C(N4CCCC4)=O)c(C)o3)=O)no2)c1C,2 Z2256373766,COCC(CCC1)(CN1C(Cc(cc1)cc2c1OCO2)=O)C(O)=O,0 F5857-6353,COc(cccc1)c1NC(C(NCC1(CCCC1)O)=O)=O,0 C430-5096,Cc(cccc1)c1N(C(c1c2cccc1)Nc(cc1)cc(O3)c1C(C)=CC3=O)C2=O,2 F6539-3792,O=C(NCCCc1cc(cccc2)c2o1)N(CCN1)C1=O,2 Z237326944,Cc1c(C(N(CC2)CCC2c(cc2)ccc2O)=O)sc(C)n1,0 Z953117494,CS(Nc(cc1)cc(C(NCc2ccc(Cn3c(cccc4)c4nc3)cc2)=O)c1O)(=O)=O,0 G656-0668,CCOc(cc1)ccc1N(c(nc(-c(cc(cc1)OC)c1OC)nc1C(N)=O)c1N1C)C1=O,0 F6452-2502,COC1(CNC(C(Nc(ccc(F)c2)c2F)=O)=O)C2CC(C3)CC1CC3C2,0 Z1736558321,O=C(Nc1nnc(C(F)(F)F)cc1)N(CCC1)C1c1cccs1,2 F5857-0697,OC(CNC(C(Nc(cc1)cc(Cl)c1F)=O)=O)(C1CC1)c1ccco1,0 F6748-8232,Fc1cccnc1N1CC(COc(nccc2)c2Cl)CCC1,0 V018-6781,CCN(Cc(n1C2CC2)cnc1S(Cc1ccccc1)(=O)=O)C(c1cccs1)=O,2 F6471-3808,O=C(CNC(OCc1ccccc1)=O)N(C1)CC1Oc1nccs1,2 SB69-0513,O=C(c1nn(C[C@H](C2)Oc3ccncc3)c2c1)N(CCC1)CCN1c1ncccn1,2 F6608-2462,O=C(C1(CCOCC1)c1ccccc1)N(CC1)CCC1Oc1nccc(C(F)(F)F)n1,2 F6178-7918,O=C(NCC(CC1)CCN1C1CSCC1)Nc(cccc1)c1Cl,0 Z4954982168,Cn(cc1NC(c2noc(-c3cn(C)nn3)c2)=O)nc1-c1ncccc1,2 S762-0009,CCN([C@@H](CCCC1)[C@]1(CC1)C(NCCCN(CCC2)C2=O)=O)S1(=O)=O,2 SC88-1327,Cc1ccc(C(N(C2)CC2(C(CC2)c3nc(-c4ccncc4)no3)S2(=O)=O)=O)s1,2 Z1615359720,O=C(CCCc1c[nH]c2c1cccc2)NCC(NCC1CC1)=O,2 F5003-0637,CCn(cc1-c(n2CC)nnc2SCc2ncccc2)nc1OCC,2 F6754-5192,FC(c1ccnc(N(CC2)CC2(F)F)n1)(F)F,0 Z1419776677,CC1(CC1)C(NCc1cc(-n2cncc2)ncc1)=O,2 Z2408110888,O=C(C(C1)C11c(cccc2)c2OCC1)N(CC1)CC1c1nnc[nH]1,0 Z1796352781,CC(N(CCC1)CC1C(N[C@@H]1c2cccc(F)c2OCC1)=O)=O,2 F6412-2235,O=C(c1cccs1)NCC#CCOc(cc1)cc2c1OCO2,2 F6514-6616,O=C(c1cc(cccc2)c2[nH]1)NC(Cn1nccn1)c1ccccc1,2 Z1067802852,Cn1c(-c(cc2)ccc2NC(Cc2c[nH]c3c2cccc3)=O)nc2c1cccc2,2 Z2993250043,CNc1c(CN[C@@H]2[C@@H](c3n[nH]cc3)OCC2)cccc1,2 Z1686711436,CC(C(NCCc1c(C)cccc1)=O)Nc1cn(CC2OCCC2)nc1,2 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Z4767055600,OCC1N(CCCCNC(c2ccc(Cn3ncc(Br)c3)s2)=O)CCC1,2 Z2360971479,Cc1n[nH]cc1CNC(NCC1(C2CC(C3)CC1CC3C2)N)=O,2 S997-0331,CC(N1C[C@@H](CN(C2)C(CCCc3ccccc3)=O)[C@]2(CO)CC1)=O,0 Z993894492,CC(C(O)=O)N(C)S(c1cn(C)cn1)(=O)=O,0 F6752-3285,Cc1c(C)sc(N(CCC2)CC2NS(C2CC2)(=O)=O)n1,2 Z3654384147,CC(CC1)C(CCCC2)C2N1C(CN(C1)CC(NC(N2)=O)=C1C2=O)=O,2 SC11-1305,CC(C)C(N(CCCN1CCCC1)C(CCC1)CN1C(CCn1ncc(C)c1)=O)=O,0 Z30271283,Cc1ccc2nc(CCCC3)c3c(C(NC)=O)c2c1,0 F6240-7237,Cc1noc(-c2cncnc2NCCCN(CC2)CCN2c2c(C)ccc(Cl)c2)n1,2 F6448-2270,CCN(C=C1C(Nc2cn(CC3Oc(cccc4)c4OC3)nc2)=O)c(nc(C)cc2)c2C1=O,2 Z2898343433,OC(C1(CCC1)C(Nc(cc1cc2)cnc1c(F)c2F)=O)=O,2 Z3409578409,OCCCNC(CCS(c(cc(cc1)Cl)c1Cl)(=O)=O)=O,0 P898-0124,CCC(CC)N(CC1)CCN1S(c1ccc(-c([nH]nc2)c2C(N2CCCC2)=O)o1)(=O)=O,2 T159-1412,Cc1cnc(CC2CN(Cc(cc3)ccc3C#N)CCC2)n1Cc(cc1)ccc1F,0 Y041-3941,Cc(cc1C)cc(O2)c1C(CN(CC1)CCN1c(cc1)ccc1F)=CC2=O,0 M617-1289,CCC(c1cccs1)NC(c(cc1)cc2c1n(CCN(C1CCCCC1)C1=O)c1n2)=O,2 F6246-1562,CN(C(C(F)(F)F)=NN1Cc2cc(OC)ccc2)C1=O,0 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F6764-4090,O=C(C1COCC1)N(CC1)CCC1c1ccc(cc(cn2)Cl)c2n1,2 C137-2370,CCN(CCCNS(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O)c1ccccc1,2 F6723-0169,CN(C=NC(N(CC1)CCN1c1ncc(C(F)(F)F)cc1)=C1)C1=O,2 T622-0471,CC(C)CN(CC1)CCN1C1CC(CC2)(CCN2C(c2ccnn2C)=O)OCC1,2 F6178-5063,COc(ccc(CNC(NCC(CC1)CCN1c1nccnc1)=O)c1)c1OC,2 Z1894576474,Cc1cc(NC(CC2=C(C)N=C(c3cnccc3)NC2=O)=O)cc(OCCO)c1,0 Z1654002374,CC(C)CC(C(NCc(cc1)cc(N2)c1NC2=O)=O)NC(c1c(C)cccc1)=O,2 Z1956727348,Cc(onc1)c1NS(c1cc(Cl)c(C)c(C(O)=O)c1)(=O)=O,0 P929-0756,COCc1nn(CC2CC2)c(CC2)c1CN2C(c1cocc1)=O,2 F6524-0959,Cn(c(C(NCCN1N=Nc(cccc2)c2C1=O)=O)c1)nc1-c(cc1)ccc1F,2 Z285226704,O=C(CN1CCNCCC1)Nc1ccccc1,0 Z411377498,CC(CC1)Cc2c1nc(NC(N(CC1)CCC1O)=O)s2,2 F6713-0119,Cc(cc1)nnc1OCC(CC1)CCN1C(CN(c(cccc1)c1O1)C1=O)=O,2 F6178-4464,COc1c(C2(CC2)C(NCC(CC2)CCN2c2ncccc2C#N)=O)cccc1,2 F6609-6957,CCc(cccc1C)c1NC(CSC(N1)=NC(CCN(Cc(cccc2)c2OC)C2)=C2C1=O)=O,0 Z1907735880,CC(C)([C@@H](CC(Nc1nc(ccc(F)c2)c2[nH]1)=O)C1)[C@@H]1C(C)=O,2 Z3634604957,CC(C)(CN(C)CC1)C1NC(c1noc(C)n1)=O,2 F6789-0087,OCC(CCC1)(C2)C1CN2c1c2sccc2ncn1,2 Z3645994523,CCC([C@@H](CCC1)N1C(c1c(C)c(OC)ccc1)=O)O,0 F1549-0049,CN(CC1)CCN1S(c(cc1)ccc1N)(=O)=O,0 Z2025134501,CC(CC1)C(C)CN1c1nnc([C@@H]2[C@@H](C(C)(C)C)OCC2)n1CC1OCCC1,2 Z2996726664,CC1(C)[C@H](CCC2)[C@H]2N(Cc2c(C(O)=O)oc3c2cccc3)C1,2 F6496-2712,O=C(Cc1cccs1)Nc(cc1)cc2c1onc2CN1CCOCC1,2 Z1758762874,CN(C=CN=C1N(CCC2)CC2NC(Cc2c[nH]c(cc3)c2cc3OC)=O)C1=O,2 F6549-6880,COc1cccc(C(N2CC(CN(C(CC3)=O)C3=O)C2)=O)c1OC,0 Z2476791189,CC1(C)NCCC1NC(c1cccc(C(O)=O)c1)=O,0 Z2180672231,O=C(NCC1(CC1)c(cccc1)c1Cl)N(CC1)CC1n1ncc(Cl)c1,0 Z2362238230,Cc1c(C)oc(-c2cccc(NC(N(CC3)CCC3C(O)=O)=O)c2)n1,2 Z1198163383,COc(cc1)cc2c1[nH]nc2C(O)=O,0 G404-0818,Cn1cnc(S(N(CCC2)CC2C(Nc(ccc(F)c2)c2F)=O)(=O)=O)c1,0 F3222-0551,CCOC(c(sc1c2cccc1)c2S(N(CC1)CCN1c(cc1)ccc1C(C)=O)(=O)=O)=O,2 Z1421703153,COCc1nn(CCCC2NC(CCc(cc3)ccc3F)=O)c2n1,0 Y043-7317,CC[C@@H](C)[C@@H](C(Nc1cccc(Br)c1)=O)NC(NC(CC1)CS1(=O)=O)=O,0 SB20-1509,CCn1ncc(CN2[C@H](Cn3nnc(C(NC4CCCC4)=O)c3)CCC2)c1C,0 F6562-4523,CN(C)c1nc(CCC(C2)NS(c(cc3)cc4c3OCCO4)(=O)=O)c2cn1,2 F6484-2057,N#Cc1nccnc1OC(CC1)CCC1NC(CC1CC1)=O,2 F6497-3116,Cc(cccc1)c1N(C(CC(CC1)CCN1C(c(cc1)cc(F)c1OC)=O)=NN1)C1=O,0 SC10-0035,CS(N(CCCN1CCOCC1)C1CN(Cc2cc([nH]cc3)c3cc2)CC1)(=O)=O,2 D677-0511,CC(CC(NCc1noc(-c2ccco2)n1)=O)N(C(c1c2cccc1)=O)C2=O,2 F6561-1850,O=C(CCc(cccc1)c1Br)N(C1)CC1OCC1COCC1,2 F0851-0582,COC(c1ccc(CSC2=NCCS2)cc1)=O,2 D634-0213,Cc(c1c2)coc1c(C)c(O1)c2C(C)=C(CCC(NCC2OCCC2)=O)C1=O,2 Z1001877846,CCc1cccc2c1OCCC2NC(c1cn(Cc2ccccc2)nc1)=O,2 Z3138552053,O=C(c(cc1)ncc1-c1c[nH]nc1)N[C@]1(CCC2)[C@@H]2CNC1,2 SC19-0132,CCn1nc(CN(CC2)CC2NC(c2nn(C)cc2)=O)c2c1CCOC2,0 F6556-0697,OC(CNC(C1(CC1)c(cc1)ccc1F)=O)(CSC1)c2c1cccc2,2 SC66-0101,Cn1c(C(CN(C2)C(c3ccco3)=O)C22CCOCC2)nnc1,0 F6481-0838,Cn(c(C(N(CC1)CCSC1c(cccc1)c1Cl)=O)c1)nc1-c(cc1)ccc1F,0 Z791902276,Cc1nnc(COC(c(nc2-c3cccs3)nn2-c2cc(C(F)(F)F)ccc2)=O)n1C,2 F282-0004,Cc(sc1ncnc(NCCC2=CCCCC2)c11)c1S(N1CCCCC1)(=O)=O,2 Z3071585153,CCNc(nc(nc12)Cl)c2n(C)nc1Br,0 Z1423687990,CN(C)C(N(CC1)CCC1C(Nc1cc(-c2cccc(F)c2F)n[nH]1)=O)=O,0 S480-0058,O=C(CN(C(C(CC1)(CCS1(=O)=O)N1)=O)C1=O)Nc1cccc(Cl)c1,2 F6469-1761,O=C(CN(C(C=C1)=O)N=C1c1ccco1)Nc(cccc1)c1-c1cn(cccc2)c2n1,2 Z2761791331,Cc(cc1)c(C)cc1S(NC[C@@H](CC1)O[C@@H]1c1ncn[nH]1)(=O)=O,0 Z3548143413,C[C@H]1N(Cc2ccccc2)[C@@](CNC(c2ncccn2)=O)(CO)COC1,2 F3358-0029,CC(C)c1nc(C)cc(SCC(c(cc2)cc3c2OCO3)=O)n1,2 Z1492242632,CC(C)(C(CCC1)N1C(CCC(Cc(cccc1)c1N1)C1=O)=O)O,2 SB66-0188,O=C1N(Cc2cccc(F)c2)[C@@H](CN(C2)C3CCC3)[C@@H]2CCC1,2 F6549-4270,Cn1ncc(C(CCCC2)N2C(c2cc(cccc3OC)c3o2)=O)c1,2 F6571-0318,CN(C)C(CNS(c(cc1)cc(Cl)c1OC)(=O)=O)c1csc2c1cccc2,0 F6559-0123,Cn(cc1)c2c1C=CN(CCNS(c(cc(cc1)Cl)c1OC)(=O)=O)C2=O,2 E019-0881,CC(c1c2c(cccc3)c3s1)=NN(CCCC(N(CC1)CCN1c1cccc(Cl)c1)=O)C2=O,0 F6573-8014,CC(C)Oc(cc1)ncc1C(N(CCN1c2nccs2)CC1=O)=O,0 F6550-5112,COC(c(cccc1)c1C(N(C1)CC1Nc1nccnc1)=O)=O,0 F6556-5832,COc(cccc1)c1C(N(CCC1)CCN1C1CCC1)=O,0 Z1223902874,CC(C)(Cc1ccccc1)CNC(Nc(cc1)cc2c1[nH]nc2)=O,0 F6672-2246,Cc1c(C(N(C(CC2)C3)C2CC3=C2CCC2)=O)scn1,2 Z741002324,CC(CCC1)CN1S(NC(CC1)CCN1C(c(cccc1)c1F)=O)(=O)=O,2 F6525-4611,O=C(NCCn1ncc(-c2ccccc2)c1)NCc(cc1)ccc1Cl,2 F6670-5340,COc(cc1)cc(N=CN2CC(CC3)CCN3C(CN(c(cccc3)c3O3)C3=O)=O)c1C2=O,2 SC45-0966,Cc1noc(C)c1S(NCc1c(CN(Cc2ccccc2)C(C2)=O)n2nn1)(=O)=O,2 Z3633261617,CC(N(CC1)c2c1ccc(S(Nc1cnc3OCCc3c1)(=O)=O)c2)=O,2 F2496-1720,O=C(c(o1)ccc1Br)OCc1noc(-c(cc2)cc3c2OCCO3)c1,2 Z3495417101,Cc1c(C)sc(CN2CCC3(CCC(CC(O)=O)CC3)CC2)n1,2 F1967-1601,COc(cc1)ccc1-c1cc(N(CC2)CCC2C(O)=O)ncn1,0 F6525-1684,O=C(c1cc(cccc2)c2[nH]1)NCCn(c(C1CC1)c1)nc1-c1nccnc1,2 F6656-3726,O=C(c1noc(-c2ccccc2)c1)N1CCC(COc2nnc(CCCC3)c3c2)CC1,2 F6672-2177,COc(ccc(F)c1)c1S(N(C(CC1)C2)C1CC2=C1CCC1)(=O)=O,2 Z2851923476,Cc1c(C)nc(C)nc1N(C1)Cc2c1c(O)nc(C)n2,0 F5882-0008,CCC(NCCN(CC1)CCN1C(OC(C)(C)C)=O)=O,0 V014-6167,CC(C)CN(CC(N(CC1OCCC1)Cc1ccco1)=O)C(Cc(cc1)ccc1F)=O,0 Z165526642,Cc1nc(CSc(ncc(C(F)(F)F)c2)c2Cl)no1,0 Z1975065860,O=C(NCCN(CCC1)S1(=O)=O)N[C@H](C1)[C@@H]1c(cc1)cc(F)c1Cl,2 Z1181377994,CCC(CC)(CNC(NCC1CCN(Cc2nc(C)c(C)o2)CC1)=O)O,0 L228-0887,COc(cc1)cc(NS(c2ccc(-c3cnc(C4CCC4)o3)s2)(=O)=O)c1OC,0 F6619-8054,Cc1nc(N(CC2)CCN2c2ncnc(OC)c2)cc(C(F)(F)F)n1,0 Z2033387964,Cc1cc(N(CC2)CCN2C(c2c(COC)ncs2)=O)ncc1,0 F6760-0357,Cc1nnc(cc2)n1nc2C(N(CC1)CCN1c(cc1)cc(Cl)c1F)=O,2 7407-0688,CCCCN(C(C1(CC(c2ccc(C)s2)=O)O)=O)c(cc2)c1cc2Br,0 SC77-0937,O=C([C@H](CN(Cc(cc1)ccc1F)C1)[C@@]11OCCNC1=O)NCCn1nccc1,2 F5788-4066,O=C(CN(CCN1c(cc2)cc3c2OCCO3)C1=O)N(CC1)CCN1c(cccc1)c1F,2 Z431885668,CCN(CC)S(c(cc1)cc(NC(c([nH]2)cc(Cl)c2Br)=O)c1O)(=O)=O,0 F6502-7373,CN(C)S(NCCn(c(C1CC1)c1)nc1-c1cscc1)(=O)=O,2 F5857-3958,CC(Cc(cc1)ccc1OC)(CNS(Cc1ccccc1)(=O)=O)O,0 Z3388607062,Cc1c(C(O)=O)oc(C(N[C@@H]2c(ccc(C)c3C)c3OCC2)=O)c1,2 D068-0022,COc(cc1)cc(OC)c1NC(C1OCCc2c1cccc2)=O,2 L566-0132,CC(CCC1)(CN1C(Nc(cc1)ccc1Br)=O)C(NCc1c(C)cccc1)=O,0 K292-1707,CCC(C)N(C1=O)C(SCC(Nc(ccc(OC)c2)c2OC)=O)=Nc2c1scc2,0 F6796-0938,C(C1)C1n1c(ncnc2Nc(cc3)cc4c3OCCO4)c2nc1,2 F6555-0392,O=C(Nc1cccs1)N(C1)CC1n1nnc(C2CC2)c1,2 F3398-3772,Cc(cccc1)c1NC(CSc1nccn1-c(cc1)ccc1C(NCc(cccc1)c1F)=O)=O,2 D356-1636,O=C(C(CC1)CCN1S(Cc(cc1)ccc1Cl)(=O)=O)Nc(cc1)cc2c1OCCO2,2 Z2390730322,CCc1noc(-c2ccc(CCNC([C@H](Cc3ccccc3)N)=O)cc2)n1,2 SC73-0224,Cn1nc(C(NC2CC2)=O)c2c1CC(CC1)(CCN1C(C1CCCC1)=O)OC2,2 F6554-8481,CC(C(N1C(C2)CSC2C1)=O)Oc(cccc1)c1F,0 8017-1205,CN(c(cccc1)c1C(OC(C1)=O)=C2C1c(cc1)ccc1OCc(cccc1)c1F)C2=O,0 F6178-7664,COc1c(C2(CC2)C(NCC(CC2)CCN2C2CSCC2)=O)cccc1,2 Z2798449072,OC(CC(CCC1)CN1C(NCc1cc2ncccc2cc1)=O)=O,2 S978-0665,C[C@@H](COc1c(C2)cc(CN(C3CC3)S(C)(=O)=O)cc1)N2C(c1ccco1)=O,2 F6218-0361,Cc1cc(C)nn1-c(nc1)ncc1NC(Nc(cc1)cc(C(F)(F)F)c1Cl)=O,0 Y042-1103,O=C(C(CC1=O)CN1c1n[nH]c2c1cccc2)N(CC1)CCN1c1ccccc1,2 8019-3951,CC1Oc(ccc(S(N(CCC2)c(cc3)c2cc3Br)(=O)=O)c2)c2NC1=O,0 SC42-0114,Cc1nc(CC2CC(CC3)(CCN3C(CN(C(C)=CC(C)=N3)C3=O)=O)OCC2)no1,2 F6791-8355,Cc1nc2cnccc2c(N(CC2)CCC2c2nnc(C3CC3)o2)n1,2 F6472-0951,O=S(c(cc1)ccc1OC(F)(F)F)(NCCSC1CCOCC1)=O,0 Z1212861486,CN(CCC1)CC1N1CCN(CCc2ccccc2)CC1,2 Z2409771963,CC(C)(COC)N(CC1)CCN1c1c(cccc2F)c2ncn1,0 Z1702826767,Cc1c(C(NCC(Cc2ccccc2)Cc2ccccc2)=O)c(S(N)(=O)=O)c(C)o1,2 Z1273794644,Cc1ccc(CN(C(CC2)C(NCc3nnnn3-c3ccccc3)=O)C2=O)cc1,2 Z1397055766,CC(C)n1ncc(S(N(CCN2C)C(C)(C)C2=O)(=O)=O)c1,2 F2004-0102,C(c1ncccc1)Sc(cc1)nnc1-c1ccco1,2 G421-1329,Fc(cccc1)c1N(CC1)CCN1c1nc(CCN(Cc2cccc(F)c2F)C2)c2cn1,0 S570-0459,COc1ccc(C2(CC2)C(NCC2(CCC(N3CC4CC4)=O)C3=CCCC2)=O)cc1,0 S986-0116,Cc1cc(C(N2C[C@](CN(C)C)(CN(Cc3ccccc3)C3)[C@H]3C2)=O)no1,2 S605-0051,CN(c1cccnc1N1[C@@H](CC2)CN2S(c(cccc2)c2Cl)(=O)=O)C1=O,0 E019-0372,CC(C(Nc(cc1)cc(OC)c1OC)=O)N1N=C(C)c(sc2c3cccc2)c3C1=O,0 F6454-2294,Cc1nccc(N2CCC(CNC(CCc(cc3)ccc3S(C)(=O)=O)=O)CC2)c1,0 F6791-3957,O=S(C1CC1)(N(CC1)CCN1c1nc(C2CC2)nc2c1CCC2)=O,2 F6471-0829,COC(CC1)CN1c(cc1)ccc1C(N(C1)CC1n1nnc(-c2ccccc2)c1)=O,2 Z4135141749,CC(c1noc(-c2cnncc2)n1)Oc(ccc(Br)c1)c1Cl,2 F5626-0047,Cc1nc(N2CCOCC2)cc(NCCNC(c2cccs2)=O)n1,2 F5681-0036,Cc1c(CC(N2c3nc(cccc4)c4n3CC2)=O)c(C)nn1C(CC1)CS1(=O)=O,2 F6489-0881,Cc(cc1)nnc1OC(CC1)CN1C(Cc(cc1)cc2c1OCO2)=O,2 SB33-0515,COCC(N[C@@H](CN(C1)C(CC2CCCC2)=O)[C@H]1c1nc(-c2ccccc2)n[nH]1)=O,2 F6724-2662,CC(CNc1c(cc(cc2)Cl)c2ncn1)(c1ccco1)O,2 Z2697274840,O=C([C@@H](C1)[C@H]1c1cscc1)NCc1ccccc1,0 F6480-1480,O=C(c1nccc2ccccc12)N(CCC1)CC1Oc(ccnc1)c1Cl,2 Z1132670888,CC(C)(CNC(N1CC(CCCC2)N2CC1)=O)N1CCCCC1,0 F6725-1601,C(c1cn(-c2ccncc2)nn1)Nc1ncnc(C2CCC2)c1,2 F6559-1818,O=C(Cn1nccc1)NCc1nc(C2CCOCC2)no1,2 F6514-9160,O=C(c(ccc(F)c1)c1Cl)NCc1c(-c2cnccc2)nccc1,0 SC08-0126,CS(N(CC1)CCC1c1noc(C(C2)CN2C(CCn2cncc2)=O)n1)(=O)=O,2 Z2318371905,CC(C)c1nc(C)c(C(N2c(cccc3)c3OCC2C)=O)o1,0 Z53825220,COCCNS(c(cccc1)c1[N+]([O-])=O)(=O)=O,0 Z1286837645,Cc1cc(C(Nc(cc2)cc(N3C)c2OCC3=O)=O)c(C)n1C1CCCCC1,0 F6368-0493,O=S(c1cccc(Cl)c1)(N1CCN(CCn2c(-c3ccccc3)ncc2)CC1)=O,0 G765-0188,O=C(NCCN1CCOCC1)NC(C1)COc2c1cccc2,2 F5777-0242,COc(cccc1)c1C(Nc(cccc1)c1NC(Nc(cccc1)c1Cl)=O)=O,0 Z4450409011,Cn1c(C(NC(CCC2)CN2c(cccc2)c2Cl)=O)cc(S(N2CCCCC2)(=O)=O)c1,2 Z1431801658,COc(cc(cc1)C(N(CC2)CCC2c2c[nH]c3c2cccn3)=O)c1F,2 Z3290617889,Cc1nc(NC(C(C2)C2c(cc(cc2)OC)c2OC)=O)nc(O)c1,0 Z2234618875,CCc1nocc1CN(C=Nc1c2sc(-c3ccccc3)c1)C2=O,2 F0722-0745,OC(Cc(cccc1)c1Nc(c(Cl)ccc1)c1Cl)=O,0 Z2936894401,Cc(s1)cc(C(N[C@H](C[C@H]2O)C[C@@H]2O)=O)c1Br,0 S969-0482,CCN(C(CC1(CC2)CCN2C(Cc2c(C)onc2C)=O)C(NC2CCCC2)=O)C1=O,2 Z2465400399,O=C(c1ncc(C(F)(F)F)cc1)N(CCNC1)C1c1cccc(F)c1,0 F2024-1541,O=C(c1ccco1)N(CC1)CCN1C(NC(CC1=O)CN1c1cccc(F)c1)=O,2 F6514-3075,O=C(NC1CCOCC1)N(C1)CC1OCC(F)(F)F,2 S996-0305,CS(N(C1)C[C@]2(CO)[C@H]1CCN(Cc1cccs1)C2)(=O)=O,0 F6014-0254,O=C(C(c1ccccc1)n1cccc1)NCc(cc1)ccc1OC(F)(F)F,0 Z2699459823,CN(C[C@@H]1C(NC(C2)COc3c2cccc3)=O)C[C@@H]1c1ccccc1,2 F6439-2648,O=C(NCCn(c(C1CC1)c1)nc1-c1ccncc1)Nc(cc1)cc2c1OCO2,2 Z2142673397,Cc1nn(cc(cc2)NC(C(c(ccc(Cl)c3)c3Cl)N3CCOCC3)=O)c2n1,2 F6525-7029,Cc1cccc(CS(NCCn2ncc(-c3ccco3)c2)(=O)=O)c1,2 Z4631846184,CC1(CC1)c1cccc(C(N(CC2)CC2c2ccccc2)=O)c1,2 S940-0204,COc(cc1)ccc1S(N1CC(Cc2nc(-c3cnccc3)no2)C1)(=O)=O,2 Z196847458,COc(cccc1)c1N1CCN(Cc2ncccc2)CC1,0 Z766539890,NC(c(cc1)ccc1C(N(CCCCC1)C1c1ccncc1)=O)=O,0 F589-0393,Cc1c(C(CC2)CCN2S(c2c(C(F)(F)F)cccc2)(=O)=O)c(cccc2)c2n1Cc1cccc(Cl)c1,0 S895-0263,COCc1nnc2n1CCC(CC1)(CCN1S(c(ccc(F)c1)c1F)(=O)=O)CC2,0 M980-0110,Cc1nc(cc(cc2)N(CC(C3)C(Nc(ccc(Cl)c4)c4F)=O)C3=O)c2o1,0 F3321-0013,Cc(cc1)cnc1NC(Cc1coc2c1c1ccccc1cc2)=O,2 F6519-7585,Cc1cc(C)nn1C(CNS(CCC(F)(F)F)(=O)=O)c1cscc1,0 3578-0864,CC(C(Cc1ccc(C)cc1)C(N1c2nc3ccccc3cc2)=O)C1=O,0 Z90502118,COCCNCc1csc(-c2cccc(Br)c2)n1,0 Y503-4537,Cn1nc(C2CC2)c2c(C(F)(F)F)cc(C3CC3)nc12,2 F6549-1774,O=C(c(cccc1)c1Br)NC(CC1)CCN1c1nsnc1,0 Z1431557083,CC(C)NC(CN(CC1)CCN1C(c1cn(C)cc1)=O)=O,0 F5461-0980,CC(C)(C)c1csc(CN(CC2)CCN2C(c(o2)ccc2Br)=O)n1,2 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Z2014449126,O=C(c1csc(-c2cscc2)n1)Nc1c[nH]nc1-c(cccc1)c1F,2 F6529-2378,O=C(c(cccc1)c1SC(F)F)N(CC1)CCC1N(CC(N1c2ccccc2)=O)C1=O,0 SA50-0888,Cn(c(C1)c2CN1C(Cc1cccs1)=O)nc2-c1nc(C2CCOCC2)no1,2 F1907-2314,CC(C)(C)OC(N1CC(C(F)(F)F)OCC1)=O,0 F6515-0872,CC(C(NCc1cc(-c2cccs2)ncc1)=O)Oc(cccc1)c1F,0 SB57-1072,Cc1noc(C2C3(CNC3)CN(Cc3ccccc3)C2)n1,0 F2167-7061,COC(c1nc(ccc(Br)c2)c2[nH]1)=O,0 F6495-4141,O=C(C(C1)CN1c1ncnc(-c2ccccc2)c1)NCCc1cccs1,2 F6721-6529,COc1cc(CCN(C2)c(ncnc3)c3F)c2cc1OC,0 F6517-4649,COCC(NCC(c(cc1)ccc1-c1cscc1)O)=O,0 F6359-3093,O=C(NCc(cc1)ccc1Cl)N(CC1)CCC1Oc1nccnc1,2 Z911271254,CC(C(NCc1ccco1)=O)NC(C(CCC1)N1C(c(cccc1)c1O)=O)=O,2 G394-0041,Cc1c(C(N(CC2)CCN2c2ccccc2)=O)sc2ncnc(N3CCN(C)CC3)c12,0 F6676-2674,CN(C(CC1)CCN1C(c(ccnc1)c1F)=O)c1ncccc1,2 F6178-3413,COc(ccc(Cl)c1)c1NC(NCC(CC1)CCN1C(c1ccncc1)=O)=O,0 F5542-0048,CC(C)(COc(ccc(NC(Nc(cc(cc1)Cl)c1OC)=O)c1)c1N1C)C1=O,2 F3394-1300,CCN(CC1)CCN1c1nc(-c2cnccc2)nc2ccccc12,2 F6357-1614,CC(C)(CNC(c(cccc1OC)c1OC)=O)c1cscc1,0 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SB29-0172,Cc1c(COc2ccccc2)c(C(N(C[C@H](C2)OC)[C@@H]2c2n[nH]c(C)n2)=O)no1,2 F6573-6428,CC1=C(C)N=CN(CC(N(CC2)CCC2(C2)C2(F)F)=O)C1=O,2 F6448-0301,O=C(CN1N=CC=CC1=O)Nc1cn(CC2OCCCC2)nc1,2 F6443-1625,CC(C)(C)OC(NCCCNC(c(cc1)ccc1N(CC1)CCC1OC)=O)=O,0 Z3091706666,Cn1c(-c2ccccc2)nnc1CNC(C1CCCCCCC1)=O,2 8013-1117,CCCOc(cc1)ccc1N(C(CC1Nc(cc2)ccc2C(O)=O)=O)C1=O,0 F6574-0387,CCOc(cccc1)c1NC(NCc1nccnc1-c1cocc1)=O,0 F5860-0324,Cc1noc(C)c1CN(CC1)CCN1C(c1nc(cccc2)c2s1)=O,2 Y300-0675,CC(C)OCCCNC(Nc(cc1)ccc1Cl)=O,0 F6496-0866,CC(C(NCc1ncnc(C)c1)=O)Oc(cc1)cc2c1OCO2,2 F0182-0364,CC(c(c(-c(cc1)ccc1Cl)c1C#N)c(C)nc1SC)=O,2 D445-0414,Cc1cc(N(C(CC2)=O)S2(=O)=O)cc(C)c1S(Nc(cc1)ccc1N(C)C)(=O)=O,0 Z2144555833,CCNC(c1cc(NC(c2cn(CCF)nc2)=O)c(C)cc1)=O,0 Z1203076556,COc1cc(C(Nc2cc(-c3nnc[nH]3)ccc2)=O)cc(OC)c1,0 F1872-0954,O=C(CSc1nccn1Cc1ccco1)Nc(cc1)cc2c1OCO2,2 Z1447815806,CCc1c(CC)oc(C(NCC2(CCOCC2)N2CCCCC2)=O)c1,2 Y300-1822,O=C(COc1cccc(Cl)c1)NC1CCCC1,0 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Z3052583130,O=C(c1cn(cccn2)c2n1)N(CC1)CCC1c1ncncc1,2 F6573-6329,O=C(c1cc(OCc2ccccc2)ccc1)N(CC1)CCC1(C1)C1(F)F,2 F6279-0475,O=C(c(cc1)ccc1OC(F)(F)F)NCC(CC1)CCN1c1ncccn1,0 Z952007780,Cc1noc2nc(-c3ccccc3)cc(C(NCCCOC3CCCC3)=O)c12,2 F6512-0715,O=C(c1cc(cccc2)c2o1)Nc1cc2ccnn2cc1,2 S997-0717,Cc1ccc(CN2C[C@@H](CN(C3)S(C)(=O)=O)[C@]3(COC)CC2)o1,0 F6436-3699,OC(CNC(c(cccc1)c1S(C(F)F)(=O)=O)=O)c(cc1)cc2c1OCC2,0 F5086-1218,CC(C)n1nc(C)cc1C(Nc1nc(-c(s2)ccc2Cl)cs1)=O,2 F6573-2838,O=C(c1cnc(C(F)(F)F)cc1)NCCOCCn1nccc1,0 F5266-0370,O=C(C(NCc1cccs1)=O)NCCN(CC1)CCN1c(cc1)ccc1Cl,2 Z338096430,O=C(c(cccc1)c1OC(F)F)NCc(ccc(F)c1)c1F,0 F6773-4166,FC(c1nc(N(CC2)CCC2Oc2nc3ccnn3cc2)ncc1)(F)F,2 Z1446933107,Cc1c(CCNC(NC2(CO)CCC2)=O)cccc1,0 Y200-5002,CCC(C)(C)NC(COc(cc1)ccc1-c1nc(C(C)C)no1)=O,0 F5890-0085,O=C(CNC(C(C=C1)=CNC1=O)=O)N(CC1)c2c1cccc2,2 Z1731616505,CC(CCCC1)CN1C(Nc1cnc(C2CC2)nc1)=O,2 Z1723437103,CN(c1c(N2)ncc(-c3cc(C(N(CC4)CCC4c4nc(-c5ccccc5)n[nH]4)=O)ccc3)c1)C2=O,2 V008-9333,CCCNC(N(CC1OCCC1)CC(N(CC1)C(COc2c(C)cc(C)cc2)c2c1scc2)=O)=O,0 Z771106848,O=C(c1cc(-n2cncc2)ncc1)Nc1cn(CC2OCCC2)nc1,2 F6818-0127,FC(c(cc1)nnc1N(CC1)CCN1c1ncnc2c1ncn2C1CC1)(F)F,2 E216-0331,CC(C1)Oc(ccc(Cl)c2)c2N1C(N(CC1)CCC1C(Nc(ccc(F)c1)c1F)=O)=O,0 Z1603729597,OC(C(CNC(c1ccc(COc(cc2)ccc2F)o1)=O)Oc(cc1)ccc1F)=O,2 Z1225588282,CC(c1c(C)cc(C)c(CN2CC(CNC(C)=O)OCC2)c1C)=O,0 Z2482933283,CC1OC(C)(C)CN(CCOc(ccc(C(O)=O)c2)c2Cl)C1,0 8019-7272,COc(ccc(C(CC(N1)=O)c2c1sc1c2CCCC1)c1)c1OCc(cc1)ccc1F,2 Z757087138,COc(cc1)ccc1C(NCCNC(c(cccc1)c1NS(c(cc1)ccc1F)(=O)=O)=O)=O,0 S831-3538,COC[C@@H](CN(C1)C(CCc2nc(cccc3)c3s2)=O)[C@H]1c1ncccc1,2 Z3895300993,OCCC(C1)C(CO)CN1C(c1cc(C(F)(F)F)nn1C1CC1)=O,0 F6031-0295,OC(CN(CC1)CCN1C(c1nc2ccccc2cc1)=O)C1CC1,2 Z1569743941,CN(C)CCOc(cc1)ccc1NS(c(cc1)cc(Cl)c1F)(=O)=O,0 Z2802505509,O=C(CC(N1)=Cc(cccc2)c2C1=O)N1CCN(CCc2ccncc2)CC1,2 SD68-0008,COc(cc1)nc(OC)c1C(N1CC(C(NCC2)=O)N2CCC1)=O,0 Z1096215707,O=C(C1c(cccc2)c2OCC1)Nc1cccc2cccnc12,2 F5265-0438,O=S(c(cc1)cc2c1OCCO2)(NCCN(CC1)CCN1c(cccc1)c1F)=O,2 G008-3053,CC(Cc1c2cccc1)N2S(c1ccc(-c2noc(C(F)(F)F)c2)s1)(=O)=O,2 Z2331640558,Cc1cn(C)nc1C(NCCc1nc(-c2ccccc2)n[nH]1)=O,0 F6752-3998,O=C(C1OCCN(Cc(cc2)ccc2OC(F)(F)F)C1)N(CC1)CCC1(F)F,0 Z3292922490,O=C(c1cnc(CCC2)c2c1)N(CC1)CC=C1c1ccccc1,2 Z4644054450,CCN(CC1)C1C(NC(C1)CC1(CCC1)CN1C(c1cocc1C)=O)=O,2 F6482-7774,O=C(NCc1cccnc1-c1cccs1)NC1CCOCC1,2 Z1837719557,CCC(C)N(CC(O)=O)C(c1cncn1C)=O,0 S903-0255,CN(C)C(N(CC1)CCC1c1nnc2n1CCN(Cc1cscc1)C2)=O,2 SA57-0211,O=C(Cn1nccc1)N(CC1)CCC1(C1)OCCC1Oc1ncccn1,2 Z192932696,CC(N(CC1)c(cc2)c1cc2NC(C(c1ccccc1)NC(c1ccccc1)=O)=O)=O,2 G414-0089,Cn1ncc2c1nc(N(CC1)CCC1N1CCCCC1)nc2Nc(cc1)ccc1Cl,0 Z1763810224,OCCOC(CCC1)CN1C(NC1CCN(Cc(cc2)ccc2F)CC1)=O,0 Y500-1955,Cn1ncc(NC(c(cnn2c(C(F)(F)F)c3)c2nc3-c2ccco2)=O)c1C(N)=O,2 F6481-4186,CC(C)(C(N(CC1)CCSC1c1cccs1)=O)Oc(cc1)ccc1Cl,0 Z2443740252,CC(Nc(s1)ncc1S(NC(C1CC2(CCC2)C1)=O)(=O)=O)=O,2 Z196585828,Cc1cc(CN(CC2)CCN2C(c(cc2)cnc2OC)=O)no1,0 Y070-0154,Cc(cc1)ccc1S(c1c(N2CCOCC2)oc(-c2ccco2)n1)(=O)=O,2 J500-0462,CC(C)NC(C(C1)C2(CCCC2)CN1C(Cc1c(C)onc1C)=O)=O,2 F5103-0014,CCCCOc(cc1)ccc1C(NCc1cscc1)=O,0 F6541-1446,O=C(C(CC1)CNC1=O)N(CC1)Cc2c1cccc2,2 Z1839148749,CC(C)(C)n1nnc(C(NCc(cccc2)c2Oc2ccccc2)=O)c1,0 S808-0376,CN(C)C([C@@](CC1)(CN(Cc2c[nH]nc2-c2ccccc2)CC2)[C@@H]2N(C)S1(=O)=O)=O,2 Z2968239329,CC(NC(CCC1)CN1c(c1c2)ccnc1ccc2OC)=O,0 F6252-5841,Cc1cc(NC(c(nnn2Cc3ccccc3)c2-n2cccc2)=O)no1,2 F482-0511,COc(cc1)cc(S(N(CCC(N2CCNCC2)=O)CC2OCCC2)(=O)=O)c1OC,2 Z2020192107,Cn1c(CNC(N(CC2)c(cc3)c2cc3F)=O)ccc1,2 Z2218793905,CC(C)(c(ccc(C(NCc1cc(NC(c2ccncc2)=O)ccc1)=O)c1)c1N1)C1=O,2 8009-2493,Cn1c2nc(SCC(N(CCC3)c4c3cccc4)=O)nnc2c2c1cccc2,0 8019-3883,O=C(C1(CC1)c1ccccc1)Nc(cc1)ccc1N(CCC1)C1=O,2 Z2910723687,OC(c1cc(CCNC(CC2C(CC3)OC3C2)=O)ccc1)=O,2 SB01-0540,Cc1nn(C)cc1C(N(CC1)Cc2c1n(C)nc2COc1nccnc1)=O,2 SC88-1994,Cc1ccc(CN(C2)CC2(C(CC2)c3nc(Cc(cc4)ccc4OC)no3)S2(=O)=O)o1,2 F6252-6164,O=C1N(CC2Oc(cccc3)c3OC2)N=Cn2nc(CCCC3)c3c12,2 V019-7946,O=C(C1CCCC1)N(Cc1nccn1Cc1cccc(Cl)c1)C1CC1,2 F6723-0958,C(CN(CC1)CCN1c1nsc2c1cccc2)n1nccc1,2 Z2966007538,O=C(c1cc(NC(N2)=O)c2nc1)N1CC(Cc2cocc2)C1,2 F2580-1426,CCc(cccc1)c1NC(CN(C=CN(c1cccc2ccccc12)C1=O)C1=O)=O,0 F5854-3147,Cn1c(CN(Cc2cccs2)C(Nc2cccs2)=O)ccc1,2 F5832-4540,Cc1ccc(C(CNC(c2nc3ccccc3nc2)=O)N2CCOCC2)cc1,2 F5855-0260,CCOc(cc1)ccc1C(N(CC1)CCN1C(C(C1)C1c(cc1)ccc1F)=O)=O,0 F6658-6232,Cc1cc(OCC(CC2)CCN2S(c(cccc2)c2Br)(=O)=O)ncn1,0 P223-1682,CCN(CCCn1nc(C2CN(CCCc3ccccc3)CCC2)cc11)C1=O,0 F6471-1289,CS(N(C(CC1)C2)C1CC2NC(CN1N=CC=CC1=O)=O)(=O)=O,2 D393-0204,Cc(c(-c(cc1)cc(OC)c1OC)nn12)c2nc(C)cc1N1CCN(Cc2ccccc2)CC1,0 F6557-0290,CC(C)(C)OC(N(CCC1)CC1C(N(CCC1c2cccs2)CCS1(=O)=O)=O)=O,2 Z1647791839,Cc1ncc(CO)c(CNc(cc2)ccc2F)c1O,0 Z2207174728,OCc1cccc(C(Nc2cc(CN(CC3)CC3O)ccc2)=O)c1,2 S272-0136,CCCc(nc(N1CCSCC1)nc1)c1C(O)=O,2 S329-4600,Cn1cnc(S(N(CC2)CCC2N(C2CCOCC2)C(C2CC2)=O)(=O)=O)c1,2 L056-0238,Cc(cc1)ccc1C(N(CC1)c2c1ccc(CNC(C1CCC1)=O)c2)=O,2 Z3416122506,CC(C)(CCN(CC1)CCC1c1c(CN(C)CC2)n2c(C)n1)O,0 D202-0063,Cc1cc(OCC(NCC(c2ccco2)N2CCCC2)=O)cc(C)c1,2 Y503-3727,CCS(N(CC1)CCN1C(C(CCC1)CN1S(c1c(C)n(C)nc1)(=O)=O)=O)(=O)=O,2 Z4444731068,Cc(cc1)ccc1S(NC(c(cc1)nn1-c1cc(F)cc(OC)c1)=O)(=O)=O,0 F6436-2492,CC(C)(C)NC(N1CCC(CNS(c(cccc2)c2OC(F)(F)F)(=O)=O)CC1)=O,0 F6178-7668,O=C(c(cc1)ccc1OC(F)(F)F)NCC(CC1)CCN1C1CSCC1,0 Z1165597581,Cc1cccc(C2(CCCCC2)C(NCC(N)=O)=O)c1,0 F5079-0107,COc1cc2ccccc2cc1C(Nc1nnc(Cc2cccs2)o1)=O,2 Z1816213857,O=C(c1nccc(N(CCN2)CC2=O)c1)NC(C1OCCC1)c1ccccc1,2 M867-1123,O=C(CN(c1csnc1C(N1C2CC2)=O)C1=O)Nc(cc1)ccc1Br,0 F6658-4751,CCc1cnc(N(CC2)CCN2C(NC(N2C)=O)=CC2=O)nc1,2 F6608-1066,CN(C)C(CC1)CCC1Oc1c2sccc2ncn1,2 Z4359046093,CC(CN(CC1)C(COCc2ccccc2)=O)C1NC(Cc(cccc1)c1F)=O,2 F6274-0435,O=C(c(s1)ccc1Br)OC(C1)CN1c1nc(ccc(F)c2)c2s1,2 SA69-1368,CC(CCC1)(CN1C(c1cncnc1)=O)c1noc(C2CC2)n1,2 SC03-0293,Cc1noc(C)c1S(N(CC1)CCC1OCCc1noc(-c2ccccc2)n1)(=O)=O,2 Z1648833666,Cc(cc(cc1)F)c1-n(cc1)nc1C(Nc1c[nH]nc1-c1ncccc1)=O,0 F1907-0989,Cc1cccc(NC(CCN2CCN(C/C=C/c3ccccc3)CC2)=O)c1,2 F6556-8834,CC(C)(Cc1ccc2)Oc1c2OCC(NC(c1cscc1)c1cccs1)=O,2 F6753-3289,O=C(C(CCC1)CN1c1ncccc1F)N1CCSCC1,0 F6801-7998,CN(Cc(cc1)cc2c1OCCO2)c(cc1)ccc1S(C)(=O)=O,0 Z2376949651,CC(C(O)=O)N(CCNC(C)=O)CC(N(C(C)CC1)c2c1cccc2)=O,0 K832-4601,Cc1c(C)cc([C@@H](C2)Nc3ncnn3[C@@H]2c(c(F)ccc2)c2Cl)cc1,0 D727-0632,Cc1nc2ccccc2c(-c(s2)nn3c2nnc3-c(cccc2)c2OC)c1,0 SA52-0224,Cc1noc(C(C2)N(Cc3ccccc3)CCCN2S(c2ccccc2)(=O)=O)n1,2 G396-0121,Cc1c(CNCC2OCCC2)c(C(O)=O)c(C)n1Cc1cc(C)ccc1,0 P657-0748,O=S(c1ccc(-c2nnc(C3CCC3)o2)o1)(NC1CCCCCC1)=O,2 6013-1769,Cc(cc1)ccc1NC(N1CCN(C/C=C/c2ccccc2)CC1)=O,2 P114-1578,CC(C)n1c(nccc2)c2c(C(CC2)=CCN2C(Nc(cc2)cc3c2OCCO3)=O)c1,2 Y500-7327,Cc1nn(C)c2nc(C3CC3)cc(C(N3CCN(Cc4cn(C)nc4)CC3)=O)c12,2 Z2005155041,Cc(cc1)ccc1N1N=C(C(NC2(CC2)C(F)F)=O)NCC1=O,2 F6713-6136,N#Cc(cc1)cnc1N(CC1)CCN1c(cc1)nnc1-c1ccco1,2 SA49-0110,Cc1ccc(C(N(C2)CC22OCC(CC(NCC3CC3)=O)C2)=O)s1,2 Z1724400320,CC(C1)OCCCN1c1nc(COC)nc(OC)c1,2 Z1263720536,OC(C(CC1CC2)C2N1C(c(o1)ccc1Br)=O)=O,0 F6619-6783,Cc1nsc(N(CC2)CCN2c2nc(C)nc(-n3nccc3)c2)n1,2 F6522-0742,O=C(C1COCC1)NCc1cc(-c2cscc2)cs1,2 F6439-3649,CC(C)S(c1ccc(CC(NCCn2nc(C(F)(F)F)cc2C2CC2)=O)cc1)(=O)=O,2 SA92-0509,Cc1c(CN(CCC2)CC2(c2nc(C)no2)F)cnn1C,0 F186-1420,O=C(Cc1csc(NC(C2CC2)=O)n1)N(CC1)CCN1c1ccccc1,2 Z1671126640,COc(cc1)ccc1Oc(cc1)ncc1NC(N(CC1)CC2N1CCOC2)=O,0 Z970347046,CN(Cc(ccc(Cl)c1)c1Cl)C(c1cc2cccnc2cc1)=O,0 4109-1976,Cc(ccc(-c(c1ccccc11)nnc1N1CCOCC1)c1)c1S(N1CCCCC1)(=O)=O,2 F6783-8456,CC(C)C(N=C(NC1=O)N(CC2)CCN2C(c2cc3nccnc3cc2)=O)=C1F,2 Z645199568,CC(C)c1nc2ncnn2c(NCC(COc2cccc(F)c2)O)c1,0 Y020-3894,O=C(CC(C1=O)N(CC2)Cc3c2c(cccc2)c2[nH]3)N1c(cc1)ccc1Br,0 F6478-6089,O=C(CC1CC1)N(CC1)CC1Oc(nc1)ncc1Cl,2 F6471-3150,O=C(CCc(cccc1)c1Br)N(CC1)CC1Oc1nccs1,2 F6783-6577,CC(C)n1c(N2CC(CN(C3)C(C4CCOCC4)=O)C3C2)nc2c1cccc2,2 Z979747084,Cc1cccc(CC(Nc2n[nH]cc2)=O)c1,0 Z3042518329,CN(CC1)C2(COCC2)CN1c(ncc(Cl)c1)c1Br,0 Z1272784472,C(C1CC1)n1ncc(Nc2ccnc(-c3ccccc3)n2)c1,2 S637-2637,COCc1nnc(CC2)n1CCC2NC(CCn1nccc1)=O,2 Z2950382226,COC(C(C(N(CCC1)CC1c1ccn[nH]1)=O)=CN1)=CC1=O,2 F1122-0904,CC(c(cc1)ccc1NC(c(cc1)ccc1S(N(C)C1CCCCC1)(=O)=O)=O)=O,2 SC68-0058,Cn1c(C(CN(C2)C(Cc3cccs3)=O)C22CCCCC2)nnc1,2 F0753-0042,OC(c(cccc1)c1N(C(C1C2C3C=CC1C3)=O)C2=O)=O,2 Y040-2778,N1(C(Nc2c(C1=O)cccc2)=O)[C@H](C(NC[C@@H]1CC[C@@H](C(=O)O)CC1)=O)C,2 L610-0646,O=C(c1cc(CN(c(cccc2)c2C(N2C3CCC2)=O)C3=O)ccc1)NCc1cccc(Cl)c1,0 V023-3863,CC(C)CN(CCCn1c2ccc1)C2c1cccc(Oc2ccccc2)c1,2 P890-2367,O=C(c(cc1)ccc1Br)NC1(CCCCC1)c1nc(-c2ccncc2)no1,2 F6556-5588,O=C(CCc1ccc(C(F)(F)F)cc1)N(CCC1)CCN1C1COCC1,2 F6676-1188,Cc1nccc(OCC(CC2)CCN2C(C(C=C2)=NN(C)C2=O)=O)c1,2 F6456-0801,O=C(C(CC1)CCN1c1ncnc(-n(cc2)c3c2cccc3)c1)NCC1OCCC1,2 F6436-1233,CCCS(N(CCC1)c(cc2)c1cc2NC(c1cc(ccc(OC)c2)c2[nH]1)=O)(=O)=O,2 Z2286351020,CC1(CC=CCC1)c1nc(-c2nnc(C3CC3)[nH]2)no1,2 Z2647883844,CC(CNC(CCc1ncccn1)=O)C1CCCCC1,2 SA72-0038,COCCC(CC1)(CCN1C(c1c[nH]c2c1cccc2)=O)c1noc(C2CC2)n1,2 F6411-1642,CC(N=C(c1ccncc1)N1CC(NCc(cc2)cc3c2OCO3)=O)=CC1=O,2 8019-3799,O=C(CC(C(N1C2CCCCC2)=O)NC1=O)NCCc1c[nH]c2c1cccc2,2 T787-5579,O=C(C(CN(Cc(cc1)ccc1Br)C1)C11CCOCC1)NCc1ccncc1,2 SC44-0148,CN(C)C(COC1CC(CC2)(CCN2S(Cc(cccc2)c2Cl)(=O)=O)OCC1)=O,0 Z3042150070,CC(C)c1ccc(C(CNC(c2nn(CC3(CCNCC3)OC3)c3c2)=O)N)cc1,0 F6359-5432,Cc1cccc(OC(CC2)CCN2C(C2(CCOCC2)c2ccccc2)=O)n1,2 Z4927253493,CC(C)N(CC1)CCC1NC(Cn1nnc(-c(cc2)cnc2N)c1)=O,0 E722-3492,CC(CC1)Cc2c1c(CSC(C(NCCCN1CCCC1)=O)=C1)c1s2,2 S556-0500,O=C(c1ccccc1)N(C1)CC1Oc(cc1)ccc1-c1noc(C2CC2)n1,0 Z1116601560,CC(C)CC(c1ccccc1)NC(CN(C=C1C#N)c(ccc(Br)c2)c2C1=O)=O,2 Z2804868920,C[C@H](c1cnc(C(F)(F)F)cc1)NC(c(cnn1C)c1Br)=O,0 F3320-0435,CCOc(cccc1)c1N(CC(C1)c2nc(cccc3)c3[nH]2)C1=O,0 Z4114517187,CCCOc1cccc2c1OCC2NC(c1cc(C)c(C(O)=O)o1)=O,0 8013-0231,O=C(c1nn2c(C(F)(F)Cl)cc(-c3ccco3)nc2c1)NCCCN(CCC1)C1=O,2 Z1065672116,CC1OCCCN(CCOc2cccc(C(O)=O)c2)C1,2 F6660-1291,CC(C)(C)OC(N(CC1)CCC1c1nc(-c2cc(C)c(C)cc2)no1)=O,0 Z1665833416,Cc1cc(C(F)(F)F)nc(NC2CN(Cc3cc(OC)cc(OC)c3)CC2)n1,0 Z2994379062,OCCC(N(C1)C[C@@H]2[C@H]1CCN(Cc1ccccc1)C2)=O,0 F3366-5782,CCCCOC(N(C(C)C1)c(cccc2)c2NC1=O)=O,2 S729-0119,OCCC1(CN(Cc2ccccc2)CC1)C(Nc1ccccc1)=O,2 F6359-3585,Cc(cc1)nnc1OC(CC1)CCN1C(c1nn(-c2ccccc2)nc1)=O,2 D454-0141,Cc(cc(cc1)N2Cc3nc(cccc4)c4n3CC2)c1NC(COc(cc1)cc(C)c1Cl)=O,0 F6597-2651,Cn1ncc(S(N2CCC(COc3nc(C(F)(F)F)ccc3)CC2)(=O)=O)c1,0 Y020-8237,CC(c(cc1)ccc1NC(CC(C(NCC1)=O)N1C(CN(CC1)CCN1c1ncccc1)=O)=O)=O,2 Z3844255469,OCCC(C1CCCCC1)NC(c1nnc(CCCC2)c2c1)=O,2 Z286775678,CC(C)(C)C(N1)=NC(C)=C(C(NCC2(CCCCC2)N2CCOCC2)=O)C1=O,2 Z3058919554,Cc1c(C(N(C[C@@H]2OC)C[C@@H]2F)=O)sc(N=CN2C)c1C2=O,2 Z4582158301,CCc(cc1)ccc1N(C)c1nnc(CS(C)(=O)=O)n1Cc1ccccc1,0 F2756-3430,O=C(c1nccnc1)N(CCN1CCOCC1)c1nc(ccc(Br)c2)c2s1,2 Z1174350241,N#Cc(cc1)cc(F)c1N(CC1)CCN1C(CCCCN1CCOCC1)=O,2 Z3189757037,Oc1cccc(CCC(N2CCC(CN3CCCC3)CC2)=O)c1,2 Z1644698156,Cc1c(C(CCC2)N2C(CNC(c2cc(OC)ccc2)=O)=O)c(C)n[nH]1,0 V022-7237,COc(ccc(-c1csc(N=C(CN(CCN2CCOCC2)CC(c2ccccc2)O)N2)c1C2=O)c1)c1OC,2 F6473-9228,CC(N1C)=CC(OC(CC2)CN2C(c(cc2)ccc2-n2cccc2)=O)=CC1=O,2 F3319-0029,CC(CC1)CCC1(C(N1CC(Nc(ccc(F)c2)c2F)=O)=O)NC1=O,0 F6571-6462,CC(Cc1cscc1)(CNC(c(cc1)cc(F)c1OC)=O)O,0 Z1279024403,O=C(C(C1)C1(CC1)c2c1cccc2)NCc1cnccc1,2 F6484-0218,O=C(c1c[nH]c2c1cccc2)NC(CC1)CCC1Oc1nccnc1,2 S635-4398,COCC(CN(C1)C2CCC2)C1(CC1)CCN1C(NCc1ccccc1)=O,2 F6482-7676,Cc(onc1)c1C(NCc1cccnc1-c1cccs1)=O,2 F6573-2151,COc1cccc2c1oc(C(NCc1nccnc1-c1cnccc1)=O)c2,2 F6411-0527,O=C(CN(c(cccc1)c1N=C1c2ccccc2)C1=O)NCCC1=CCCCC1,2 F0582-0696,COCC(NCCSc1c(-c(cc2)ccc2Br)[nH]c2c1cccc2)=O,0 P038-4443,CN(C(c1cc(C(Nc(cc2)cc3c2OCCO3)=O)cnc1N1c(cc2)ccc2F)=O)C1=O,0 Z1798192817,CC(CNS(c(cc1)cc(Br)c1C(O)=O)(=O)=O)OC,0 Z2954667818,CC(C)CN1NC(CC(N(CC2)CCN2c2ncc(C)s2)=O)=CC1=O,0 F6438-2165,CN(C)c(nc(nc1)OC)c1NC(c1c(C(F)(F)F)cccc1)=O,0 F6451-2042,Cc1c(C(CNC(NC2CCCC2)=O)OC)cccc1,2 F5940-1932,O=S(c(cc1)ccc1OC(F)(F)F)(N1CCC(COCc2ccccc2)CC1)=O,0 Z1953826132,Cc(ccc(-c1cnccc1)c1)c1NC(c1cccc(-c2cc(N(C)C(N3)=O)c3nc2)c1)=O,2 F6443-7948,COCCNC(NCC(CCC1)N1c1ccccc1)=O,0 Z3077965936,OCC1(CN(CC2)c3nccc(C(F)(F)F)n3)N2CCOC1,2 F6476-5550,O=C(CSc1ccncc1)N(CC1)CC1Oc1ccncc1,2 Z4407849655,C[C@@H](CNC(c1cn(C)nc1)=O)n1nnc(-c(cc2)ncc2C(O)=O)c1,2 V002-9047,CCNC(N(CC1OCCC1)CC(N(CC1)CCN1c(cc1)nnc1-c1ccccc1)=O)=O,2 F6524-0424,O=C(c1nn(-c2ccccc2)nc1)NCCN(C=Cc1c2occ1)C2=O,2 V024-3897,CCCCCNC(c1n[nH]c(CC2)c1CN2C(Cc(cccc1)c1F)=O)=O,0 C260-2653,COc1cc(NC(CN(c(cc(c(OC)c2)OC)c2C(N2CC3OCCC3)=O)C2=O)=O)cc(OC)c1,0 SB47-0958,CC(C)NC(N(C[C@@H]1CN(C2)C3CCOCC3)C[C@@]12c1nc(C)n[nH]1)=O,2 S682-0781,CCN1CCC(CCNC([C@H]2OCCN(C3CCCC3)[C@@H]2c2ccccc2)=O)CC1,2 S664-4746,COc1cc(C(N(CC2)CCC2(CC2)C2O)=O)cc(OC)c1,0 F5857-6694,OC1(CNS(c(cc2)ccc2OC(F)(F)F)(=O)=O)C=CCCC1,0 F5103-0080,O=C(Cc1cccc2ccccc12)NCc1cscc1,2 Z1224714592,CCN(C(c1cc(C(C)(C)C)nn1C)=O)c1ccncc1,0 G786-0776,COc1cccc(NC(N(Cc2nnc3n2CCCCC3)c(cc(cc2)Cl)c2OC)=O)c1,0 C887-0309,CCC(n1c2cc3c1cco3)=NN(CC(N(CC1)CCN1C1CCCCC1)=O)C2=O,2 F6619-5604,C(CN(CC1)c2nc3ccccc3nc2)N1c1ncncc1,0 F976-0214,Cc(cc1)c(C)cc1N(C(C=C1)=O)N=C1N(CCC1)CCN1S(c(cc(cc1)OC)c1OC)(=O)=O,0 SB66-0980,COc(ccc(NC(N(C[C@H]1CCC2)C[C@@H]1N(Cc1cccc(F)c1)C2=O)=O)c1)c1OC,0 F5835-0188,O=C(CCC(Nc(cc1)ccc1-c1n[nH]cc1)=O)c(cc1)ccc1Cl,2 F6222-0372,COCC(Nc1cnc(N(CC2)CCN2c2ccccc2)nc1)=O,0 F6496-3170,Cc1c(C)c(S(Nc(cc2)cc3c2onc3CN2CCOCC2)(=O)=O)c(C)c(C)c1,2 Z3294122858,CC1C(CNC(c(cc2)cnc2C(O)=O)=O)CCNC1,0 F6473-7013,O=C(c1nccnc1)N(C(CC1)C2)C1CC2N(C(CC1)=O)C1=O,2 G801-1533,O=C(Nc1c2)Nc1cc(Br)c2S(NCCN(CC1)CCN1c(cccc1)c1F)(=O)=O,2 F6724-5077,CC(Cc(cc1)cc2c1OCC2)Nc1ncnc2c1cnn2C,2 D034-0033,COc(c(OC)c1)cc(C(C2C3C4CC2CC4)Nc(cc2)c3cc2C(O)=O)c1Br,0 SC91-0641,O=C([C@](C[C@H]1CC2)(CN1C2=O)c(cc1)ccc1F)N(CC1)CCN1c(cccc1)c1F,2 Z324860914,Cc(c1ccc2)c(C)[nH]c1c2C(Nc(cc1)ccc1NC(C1CC1)=O)=O,2 SC04-0603,CC(C)Cc1nc(CCOC(CCC2)CN2C(Cn2ncc(C)c2)=O)no1,2 F6454-1148,COc1ccc(CCC(NCC(CC2)CCN2c(nc2)ncc2F)=O)cc1,2 Z4767388675,Cc1cc(F)cc(C(Nc(cc2)ccc2-c2nc(ccnc3)c3[nH]2)=O)c1,0 F6734-1205,COc(cc1)cc(OC)c1NC(N(C1)CC(C2)C1CN2c(cc1)ncc1Br)=O,0 D750-0400,O=C(CC1(CCOCC1)N(Cc1c2cccc1)C2=O)Nc1nnc(Cc2ccccc2)s1,2 F2716-0315,CCC(N=C(N1)SCC(N2CCCC2)=O)=CC1=O,2 E612-1221,CS(CCC(C(NCCCN1CCC(Cc2ccccc2)CC1)=O)N(Cc1c2cccc1)C2=O)(=O)=O,2 F6564-3290,Cc(cccc1)c1-c1c(NC(CN2N=C(C3CC3)C=CC2=O)=O)n(cccc2)c2n1,2 F6252-5099,OC(Cn1nnc(C(Nc2c(CCc3ncccc3)cccc2)=O)c1)c(cccc1)c1F,2 Z2369990776,CN(C)S(N(C[C@@H]1c(cccc2)c2F)C[C@@H]1N)(=O)=O,0 F5788-0805,O=C(CN(CCN1c(cc2)ccc2F)C1=O)NCCCN(CCC1)C1=O,0 F2146-0599,CCOc(cc1)cc2c1nc(NCCCn1cncc1)s2,0 T499-1576,CCCn1c(nccc2)c2nc1C(CC1)CN1S(c1ccc(C(C)C)cc1)(=O)=O,0 G366-1210,CSc1ccc(CCNC(C(C2)N(C(c3ccccc3)=O)c3c2cccc3)=O)cc1,2 Z600504482,OC(c1cc(CNC(Cc2noc3c2cccc3)=O)ccc1)=O,2 S988-0417,CCS(N(C[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2)C2)C[C@@]12c1nc(C)no1)(=O)=O,0 V028-4703,O=C(c(c1ccccc11)nnc1N1CCC(Cc2ccccc2)CC1)NCCN1CCCCC1,2 F6610-5513,COc(cc1)ncc1Nc1ncnc(C2CCC2)c1,2 Z2379768120,Cc1c(C)scc1C(NCCc(cccc1)c1C(O)=O)=O,0 S997-0808,CC(C)n1ncc(CN2C[C@@H](CN(C3)S(C)(=O)=O)[C@]3(COC)CC2)c1,0 F6252-1170,Cc1noc(-c(cc2)cnc2N(CCC2)CC2C(N(CC2)c3c2cccc3)=O)n1,2 Z2169318336,Cc1cccnc1OC1CCN(Cc2ccc(CO)cc2)CC1,0 Z1954649350,CCn1ncc(-c2nn(C)cc2C(N(CCC2)CC2c2nc(N(C)C)no2)=O)c1,0 F6279-0269,COC(c(cc1)ccc1S(NCC1(CC1)c1cccs1)(=O)=O)=O,0 SA70-0691,Cc1noc(C)c1S(N(CCC1)CC1(CCOC)c1noc(C)n1)(=O)=O,2 F5149-0482,O=C(NCCCN(C(C=C1)=O)N=C1c(cc1)ccc1Cl)Nc(ccc(F)c1)c1F,2 Z1542629977,CC(C1)N(CC(F)(F)F)CCN1C(CNC(c1c(C)occ1)=O)=O,2 F2382-0431,O=C(c1cn(Cc2ccccc2)nc1OCc1ccccc1)NCc1cccs1,2 SB53-0074,Cc1nnc([C@@H](C2)[C@@H](CN(C)C)CN2S(Cc(cc2)ccc2Cl)(=O)=O)o1,2 Z1580562209,CC(N(CCC1)CC1C(Nc(cc1C)nn1-c1ccccc1)=O)=O,0 D389-0176,CN(c1c(C(N2CC(c3ccccc3)=O)=O)n(CCCN3c4cc(OC)ccc4)c3n1)C2=O,0 Z2672183308,Cc1cc(NC([C@H](CCCC2)[C@H]2N(CCC2)C2=O)=O)nnc1C,2 Z3133110204,COc1nccc(CCNC(C(CC2C3)CC2C3N)=O)c1,0 F2691-0469,COc1c(CNC(c2c(N)n(Cc(cccc3)c3Cl)nn2)=O)cccc1,0 F6503-4165,Cn1nc(CN(Cc2ccco2)S(c(cc2)cc3c2OCC3)(=O)=O)cc1C1CC1,2 Z1653436829,Cc1c(C(CC(N(CC2)CC2c2cccc(C(F)(F)F)c2)=O)NC(N)=O)cccc1,0 F5835-0224,O=C(c(cccc1)c1Cl)Nc(cc1)ccc1-c1n[nH]cc1,0 F2616-0562,COCCCNC(C(Nc1cccc(F)c1)=O)=O,0 T502-2024,COCCNC(C(CC1)(CCN1C(NC1CCCCC1)=O)F)=O,0 Z2231896356,CCN(C(c(cccc1)c1N1CC(NC2(Cc3cccc(F)c3)CCOCC2)=O)=O)C1=O,2 F6435-9155,COC(CSC(CC1)CN1C(c(cc1)ccc1-c1cscc1)=O)=O,2 Z1688679902,CC(CC1)CCN1C(Nc1nc(C)ncc1)=O,0 Z2634417127,CCC(c1cccc(NC([C@H](C(C)C)N(Cc2c3cccc2)C3=O)=O)c1)=O,0 F3238-0145,O=S(n1c(cccc2)c2nc1Cc1ccccc1)(N1CCOCC1)=O,2 Z1449551272,Cc(cc1)ccc1-n1ncc2c1N=CN(CC1CC1)C2=O,0 F0359-0217,O=C(c(sc1c2cccc1)c2Cl)Nc(cccc1)c1-c1nc(cccc2)c2[nH]1,2 G397-0417,CN(CC(NCCCN(CC1)Cc2c1cccc2)=O)c1nnc(N(CCC2)C2=O)s1,2 Z2950370266,O=C(N[C@H]1c2ncccc2CCC1)Nc1cnc(CCCC2)c2c1,2 V001-3324,CN(C(CN1Cc2ncccc2)=C(C(c2cc(OCc3ccccc3)ccc2)N2)C1=O)C2=O,2 Z2829955128,CC1(COC1)NCc1cc([nH]cc2)c2cc1,2 Z1097707939,O=C(c(cc1)cc2c1[nH]cn2)N(CCC1)C1C1CCC1,2 Z2825830353,CC(C)[C@@H](C1)NCCN1C([C@@H](CCCC1)[C@@H]1C(F)(F)F)=O,0 F6554-4292,CN(C)c(cc1)ccc1C(N1Cc(cc(cc2)F)c2OCC1)=O,0 Z1347677009,Nc(cc1)nc2c1nc(Cc1cscc1)[nH]2,2 F6521-4755,COc1cccc(OCC(NCC(CCSC)O)=O)c1,0 Z1791057606,Cc1csc2c1N=CN(Cc1nonc1C)C2=O,2 F6560-8708,O=C(c1cccc(Br)c1)N(C(CC1)C2)C1CC2=C1CC1,0 Z1390645423,O=C(Cc(c(F)ccc1)c1F)N1CC(Cn2ncnc2)CCC1,2 Z2964315433,C[C@](CN(C)C1)(C2)[C@H]1CN2C(Cn1nnc(-c2ccc(C)cc2)n1)=O,2 G274-0181,O=C(C(CC1)CCN1c(cc1)nnc1-c1cccs1)N(CC1)CCN1c1ncccn1,2 C876-0148,Cc(cc(cc1)NC(NC(C2)CN(C3CCCC3)C2=O)=O)c1Br,2 F2262-0248,CC(C)(C)C(Nc(cc1)cc(N2CC=C)c1OCC(C)(C)C2=O)=O,0 F6752-6367,Cn1c(CN(CCC2)CC2C(N(CC2)CCC2(F)F)=O)nnc1,2 Z1940373082,CC(CCC1)(CN1C(Nc1c(N2CCOCC2)nccc1)=O)OC,2 F6433-0110,O=C(COc(cc1)cc2c1OCO2)Nc1ncnc(-n(cc2)c3c2cccc3)c1,2 Z2624434676,Cc1cccc2c1CCCC2NC(N(CC1)CCC1N(CCN1)C1=O)=O,2 Z3409369234,O=C(c(o1)ccc1SC(F)(F)F)NC(c1nnn[nH]1)c1ccccc1,0 Z3695570590,C[C@@H]1[C@H](CCNC(Nc2c[nH]nn2)=O)OCC1,2 Z2654726760,NC(NC1=NC(CN2Cc3cccc(F)c3OCC2)=C2)=NN1C2=O,0 V029-2908,CCNC(N1Cc2c(N(C)C)nc(N(CC3)CCN3c(cccc3)c3F)nc2CC1)=O,0 Z1010983898,COc1ccc(CN2CCC(CCN3CCOCC3)CC2)cc1,0 Z3606539225,CC(C)(CNC(c1c(C(F)F)n(C)nc1)=O)c1coc(-c2ccccc2)n1,0 F3401-0003,CC(C)(C)OC(NCc1nc(cccc2)c2n1CC(O)=O)=O,0 SC46-0506,CC(C)c1n[nH]c(C(C2)C3(CCCC3)CN2C(c2c[nH]c3c2cccc3)=O)n1,2 Z2818809161,O=C(NCC1=CC=CNC1=O)NC1(CCC1)c1cccc(C(F)(F)F)c1,2 F6619-7967,Cc1cc(C)nn1-c(cc1)nnc1N(CC1)CCN1c(nccc1)c1S(C)(=O)=O,0 Z2960357511,CC(C)CN1NC(CC(N(C2)CC2(C(C)C)c2ccccc2)=O)=CC1=O,2 Z422343162,COc(cc1)cc2c1n(CC(N1CCCC1)=O)cc2,0 Z1575788734,Cc1cc(C(N(CC2)CC2N2CCCC2)=O)nn1-c(cc1)ccc1OC,2 Z2963937476,Cc1nnc([C@]2(CN(C3)C(c4c5OCOc5ccc4)=O)[C@@H]3COC2)o1,2 K232-1915,COc(cc1)cc(O2)c1C=C(c1csc(NC(CCC(NC3CCCC3)=O)=O)n1)C2=O,2 Z4318752948,OC(C1)(C(NCCN(C(C2)=O)c3c2cccc3)=O)c(cc(cc2)Cl)c2NC1=O,2 Z423677076,O=C(c1ccc(Cn2cncc2)cc1)Nc1cc(CN2CCCCC2)ccc1,2 P804-1178,O=C(c(cc(cc1)Cl)c1F)N(CC1)CCN1c1cc(-c2cccs2)n[nH]1,2 Z5027904340,Cc1cc(N(CC2)CCN2C(NC[C@H]2OCCOC2)=NCCc(cc2)ccc2OC)ncc1,0 F5971-0299,CC(CNC(C(Nc1cccc(C(F)(F)F)c1)=O)=O)(COC)O,0 Z1884305738,C[C@H](COCC1)N1C(NCC(N(CC1)c2c1cccc2)=O)=O,2 Z1159132733,FC(c1nc2ncnn2c(NCC2c(cccc3)c3OCC2)c1)(F)F,0 F6560-8069,Cn1ncc(-c2ncc(CNC(c3cc(-c(cc4)ccc4F)c[nH]3)=O)cc2)c1,2 Y206-9038,CCc1c(C)sc(NC(C2OCCC2)=O)c1C(NC1CC1)=O,2 F6616-7045,Cn1ncc(C(Nc2cc3cccnc3cc2)=O)c1,2 F1423-1203,CCCOc(ccc(/C=C1\Sc2nc(cccc3)c3n2C1=O)c1)c1OCC,2 F2496-3101,O=C(CSc1ccncc1)OCc1noc(-c(cccc2)c2F)c1,2 F6111-0797,COc(cc1)cc(C(N2CCC(COCc(cc3)ccc3F)CC2)=O)c1Br,0 F6247-1836,O=C(c1c(N2)nc(NC(CC3)c4c3cccc4)nc1)N(c1ccccc1)C2=O,2 4239-0860,Cc1cc(NC(CCN2CCN(C)CC2)=O)cc(C)c1,0 F6675-9231,C(C1)C1c1nccc(NC(C2)CN2c2nccnc2)n1,2 F5148-0517,Cc1cc(S(NCCCN(C(C=C2)=O)N=C2c2ccco2)(=O)=O)c(C)cc1,2 Z2132089237,CC(CC(c1ccccc1)O)NC(NCc1noc2c1CCCC2)=O,2 Z1526909530,CCc1nc(scc2)c2c(N(C)CCN(CCC2)S2(=O)=O)n1,0 Z3007587069,C[C@@H](c1cc(O)ccc1)NC(N(C[C@H]1COCC2)C[C@]12C(NC)=O)=O,2 Z2584041003,CCc(ccc(S(C)(=O)=O)c1)c1C(N(CC1)CC(CC2N)N1C2=O)=O,2 Z1900802118,CC(N[C@H](CC1CCC1)C(N(CC1)CCN1c1cc(CCC2)c2cc1)=O)=O,2 F2736-0643,CC(c(cc1)ccc1C(N(CCCN1CCOCC1)c(sc1ccc2)nc1c2Cl)=O)=O,2 V017-8284,CCNC(N(CC1CC1)CC(N(CCC1)CCN1c(cc1)nnc1-c(cc1)ccc1F)=O)=O,2 S596-1289,Cc1noc(C)c1Cc1ccc(C(N(CC2)CCC2N(C[C@@H](C2)O)[C@@H]2C(NC)=O)=O)o1,2 F6660-6477,O=C1N(Cc2nc(C3CC3)no2)C=CN(C2CC2)C1=O,2 Z1575207622,CC(C)(C)c(cc1C)cc(C)c1S(N(CC1)CCN1C(CN1N=CN(C)C1=O)=O)(=O)=O,0 Z2101746020,C[C@@H](Cc1ccccc1)C(OCC(N=C(C=C1)N2C=C1Cl)=CC2=O)=O,0 E787-0590,COc(ccc(C(CC(NCc1ccco1)=O)N(Cc1c2cccc1)C2=O)c1)c1OC,0 V009-5130,O=C(CC1CCCCC1)N(Cc1c[nH]c(cc2)c1cc2F)Cc(ccc(F)c1)c1Cl,2 SD08-0398,CC(C)C(N(CCC1)CC11OCc2c(CNC(C3CC3)=O)nnn2C1)=O,0 S593-0842,CCOCc1nc(C(CCC2)N2S(c2cccc3nsnc23)(=O)=O)no1,2 F0433-0388,COc(cccc1)c1N(CC1)CCN1C(c(cccc1)c1Cl)=O,0 Z1930020995,CC(CN(CC(C)(C)O)CC1)N1C(CCN1c(cccc2)c2OC)C1=O,0 Z3444272746,CCc1nnc(CNC(N(C[C@H](CO)C2)C[C@H]2C(C)(C)C)=O)s1,2 Z2506222370,Cc(cc(cc1)S(N(CC2)C2C(O)=O)(=O)=O)c1Cl,0 F069-1499,CC(C(NCCc1c[nH]c2c1cccc2)=O)N(c(cc(C)c(C)c1)c1N=C1C(F)(F)F)C1=O,2 S543-0261,CC(N(C1CC1)C1CC(CC2)(CCN2C(c2c[nH]nc2-c2ccccc2)=O)OCC1)=O,2 L693-0480,CCC(C)NC(NCCn1nnc2c1ccc(C(NC(C)C)=O)c2)=O,0 F6793-6820,Cn(cc1C(N2CCN(CC(F)(F)F)CC2)=O)nc1OC,0 Z1974731904,CN(C)S(c1cc(C(NCC(N[C@H](C2)C[C@@H]2c2ccccc2)=O)=O)ccc1)(=O)=O,2 F1841-0033,O=C(c(o1)ccc1Br)NCCc1cn(ccs2)c2n1,2 F6436-3118,Cn1c(cccc2)c2c(C(CNC(CCc(cc2)ccc2S(C)(=O)=O)=O)O)c1,0 F6476-4412,Cc(nccc1)c1C(N(CC1)CC1Oc1nc2ccccc2nc1)=O,0 Z46320274,CCOc(ccc(CN(C)CC(Nc(cc1)cc2c1OCCCO2)=O)c1)c1OC,2 Z2951527293,CC(C)C(c1cn(C)nc1)NC(Nc1cnnn1C)=O,0 F6560-0269,O=C(c1cc(cccc2)c2s1)N(C(CC1)C2)C1CC2Oc1ncccc1,2 Z26909214,CC(c(cccc1)c1OC)NC(c1cnccc1)=O,0 Z2958194649,CCc(ccc(Br)c1)c1C(N(C)C[C@@H](CO)O)=O,0 F6748-0367,CN(C(C1)CN1c1ncccc1)c1ccnc(SC)n1,0 Z445186202,Clc1ccc(CCNCc2n[nH]cc2)cc1,0 F2417-0391,O=C(c1ccco1)N(CC1)Cc2c1ccc(NS(Cc(cc1)ccc1Cl)(=O)=O)c2,2 Z3393494778,CCc1c[nH]c2c1c(N(CCC1)[C@@H]1c1ncn[nH]1)ncn2,2 S570-0216,Cc1cccc(NC(NCC2(CCC(N3C)=O)C3=CCCC2)=O)c1,0 S951-5329,N#Cc(cc1)c(C(F)(F)F)cc1N(CC1)CC(C(NC2CC2)=O)N1C(C1CCCC1)=O,2 SC88-0631,CC(C)Oc1ccc(CN(C2)CC2(C(CC2)c3nc(-c(cc4)ccc4F)no3)S2(=O)=O)cc1,2 F6089-9769,O=C(NCC1OCCC1)NCC(CC1)CCN1c1ncccn1,2 F6389-1680,Cn1nc(cc(cc2)C(N3c4nc(cccc5)c5n4CC3)=O)c2c1OC,2 D051-0182,Cc1ccc(CN(C(CC2)CS2(=O)=O)C(c2cccc(Cl)c2)=O)o1,0 4383-0229,CC(NC(NC1c(cc2)cc(OC)c2O)=O)=C1C(Nc(cc(cc1)OC)c1OC)=O,0 Z1527339797,Cc1ccc(cccc2S(N(CCN3)C(c4ccc(C(F)(F)F)cc4)C3=O)(=O)=O)c2n1,0 Z3299855954,O=C([C@@H](CC1)c2c1cccc2)NOC1COCC1,2 Z1700675548,O=C(c1cc(C2CCCCC2)n[nH]1)Nc1cn(C(F)F)nc1,2 F6495-9336,O=C(COc(cccc1)c1F)NCc1ncnc(-c2ccccc2)c1,2 Z2194430353,CCC(CCNS(c1c(C)n(C)nc1)(=O)=O)O,0 Z1642681347,O=C(c1ncc2OCCCc2c1)N1CC(c2ccccc2)OCCC1,2 Z2962752510,CC(C)(CC1)Cc2c1onc2C(N[C@@H]1c2ncccc2CCC1)=O,2 F6442-5769,COC(CC1)CN1C(CC1)CCN1C(CCC=C)=O,0 D345-0601,CC(C)(C)C(CC1)Cc2c1nc(NC(COc(cccc1)c1Cl)=O)s2,0 F6452-2331,COC1(CNS(C)(=O)=O)C2CC(C3)CC1CC3C2,0 Z1461080275,Cc(cc1)ncc1NC(NC(CCN1c(cccc2)c2Cl)C1=O)=O,2 SA70-0612,Cc1nc(C(CCOC)(CCC2)CN2C(c2cocc2)=O)no1,2 Z1400429507,CCC1(CCCC1)c1nc(Cc2noc(C)n2)no1,2 Z1567400879,Oc1cccc(CN(CC2CC2)Cc2cccc3c2OCCCO3)c1,2 F6609-4075,Cc1c(CNC(COC(c2cocc2)=O)=O)cccc1,2 Z4884810080,N#Cc1cc(Br)cc(S(NC(Cc2cc(C3CC3)no2)=O)(=O)=O)c1,2 F6508-0021,COc(ccc(C(NCC(c1ccco1)c1ccco1)=O)c1)c1F,0 SA68-0811,CC(C)N(CC1)CCC1N(CCNS(c1cc(F)cc(F)c1)(=O)=O)C1CCOCC1,0 F5835-0771,O=C(Cc(cc1)ccc1F)Nc1cc(-c2n[nH]cc2)ccc1,2 F6561-7047,O=C(c(cc1)ccc1-c1cccs1)NC(CC1)CN1c(cc1)nn2c1nnc2,2 F6559-0015,Cn(cc1)c2c1C=CN(CCNC(Cc1noc3c1cccc3)=O)C2=O,2 S556-0485,O=C(C1(CC1)c1ccccc1)N(C1)CC1Oc(cc1)ccc1-c1noc(C2CC2)n1,0 F5303-0225,Cc1nn(C)cc1S(NCc(c(F)ccc1)c1F)(=O)=O,0 L968-0117,Cc1ccc(c(Nc(cc2)ccc2C(N)=O)c(cn2)C(N3CCCC3)=O)c2n1,0 Z1927452009,Cc1nccc(C(NC2CC3(CCC3)OCC2)=O)c1,2 F5042-0531,O=C(c1cc(Br)cnc1)N(CC1)CCN1c(cc1)nnc1-c1ccco1,2 F6524-5728,CCOc(cc1)nn2c1nnc2CNC(NCc1cccc(F)c1)=O,2 Z2294207089,CC(CN(C1)C(NCC2(CF)CCOCC2)=O)Oc2c1cccc2,2 F5832-4917,CN(C)C(CNC(C(CC1)CCN1S(C)(=O)=O)=O)c1ccco1,2 F6571-2681,OCCOC1(CNC(Nc(cc2)cc(Cl)c2Cl)=O)CCCC1,0 Z2835591650,NC(C1(CN(Cc2cc(C(F)(F)F)cc(O)c2)CC1)O)=O,0 Z2061162168,Cc1nnc(NC(c2ncc(C)cc2OC)=O)n1C1CC1,0 Z2993212976,CNc1c(CN[C@H](C2)C[C@H]2C(N)=O)cccc1,0 F6024-1038,O=C(C1(CC1)c1noc(-c(cccc2)c2F)c1)NCc1cccs1,2 Z2845785785,NS(CCc1cn(C(CCC2)c3c2cccc3)nn1)(=O)=O,0 F3366-5820,Clc(cccc1)c1OCCCCn1c(cccc2)c2nc1,0 Z1558598203,FC(c(cc1)nnc1NC1CN(Cc2ccccc2)CC1)(F)F,2 Z2705287408,O=S(N1CCCCC1)(N(CC1)CCC1N1CCOCC1)=O,0 F6108-0073,COCCN(CC1)CCC1NC(c1cc(OC)ccc1)=O,0 G278-0240,O=C(c1ccc(N2c(cccc3)c3OCC2)s1)N(CC1)CCN1c(cc1)ccc1Cl,0 Z1571968242,Cc1n[nH]c2c1ccc(NC(C(C1)CN(C3CCCC3)C1=O)=O)c2,2 Z1251087886,COc(ccc(CC(NC1(COCC1)C(O)=O)=O)c1)c1F,0 Z2055056441,CO[C@H](C[C@H]1c2nnc3n2CCC3)CN1C(Cc(cccc1)c1OC)=O,0 8012-2131,CC(C1(CCCCC1)O1)(c2c(CC3)cccc2)N3C1=O,0 F6014-0016,O=C(C(c1ccccc1)n1cccc1)NCCOc(cc1)ccc1F,2 F6411-2899,CC(C)CN1C(SCC(N=C2N3C=CC=C2)=CC3=O)=Nc2cn(C)nc2C1=O,2 S632-4351,CNC(N(CC1)CCC1C(CC1)CN1C(C1(CC1)c(cc1)ccc1OC)=O)=O,0 Z4327142237,CC(C)(C(F)(F)F)C(NCCCn1nnc(C2(C)CC2)c1)=O,2 SA92-0226,O=S(c1cc(CCCC2)c2cc1)(N(CCC1)CC1(c1nc(-c2ccncc2)no1)F)=O,2 Y042-4016,O=C(c1cc(-c2ncccc2)nc2ccccc12)Nc(cc1)cc2c1OCCCO2,2 F6554-0038,Cn1nc(C(CC2)CCN2C(Cc2noc3c2cccc3)=O)cc1,2 F6495-4554,COc(cc1)ncc1NC(C(C1)CN1c1ncnc(-n2cncc2)c1)=O,2 Z929661862,O=C(CN(C(C1(CCCCC1)N1)=O)C1=O)NCc(cc1)cc(F)c1Br,0 S056-0424,COc1ncc(CN(CC2)CC2NC(NCc(cc2)ccc2F)=O)cc1,0 F5824-0286,COc1ccc(CCNC(C2CCN(Cc3nc(cccc4)c4[nH]3)CC2)=O)cc1,2 F6372-0723,O=C(Nc1c(Cc2nc(C3CC3)no2)cccc1)N(CCN1)C1=O,2 F6571-1716,Cc1cc(C(NCC2(COCC2)OCCO)=O)c(C)cc1,0 F6673-4925,Cc1cnc(N(C)C(CCC2)CN2c2nccc(OC)n2)nc1,0 Z1207254856,CC(C)N(CCC1NC(CN(C=Nc2c3ccs2)C3=O)=O)C1=O,2 Z739313130,FC(Oc(ccc(NCc1nc(C2CC2)no1)c1)c1Cl)F,0 S529-0318,CCN(CC1)CCN1C(CN(CCCc1c2cnc(C3CC3)n1)C2=O)=O,2 Z3138974170,NC(C1)C2(CCC2)CN1C(c1c(C(F)(F)F)cn[nH]1)=O,2 Z2642279035,CCn1ncc(CN(C(C)C)C(C(CCN2)C2=O)=O)c1,2 SC77-0895,CC(C)S(N(C[C@H]1C(NCCN(C)C2CCCCC2)=O)C[C@@]11OCCNC1=O)(=O)=O,2 F6521-5284,COC(CCSC)CNC(c1cc(C(F)(F)F)ccc1)=O,0 F6178-7909,O=C(NCCc1ccccc1)NCC(CC1)CCN1C1CSCC1,2 F1913-6002,Cn1ncc(-c(cn2)cnc2OC2CCNCC2)c1,2 F6671-3093,CC(C)(C)c1cn(C(CC2CC3)CC3N2c2ncccn2)nn1,0 F6606-4449,O=C1N(CC(CC2)CCN2c2cc(CSCC3)c3nn2)C=NC(C(F)F)=C1,2 Y030-6765,O=C(CSc1ccccc1)NC1CCCCCC1,2 F3328-0106,COC(c1ccc(CSc2nc(-c3ccco3)cc(C(F)(F)F)n2)cc1)=O,2 F2348-0300,Cc(cc1)nc2c1oc(C(Nc(cc(C(F)(F)F)cc1)c1Cl)=O)c2,0 F6793-6947,Cn1c(S(N2CCN(CC(F)(F)F)CC2)(=O)=O)ncc1,2 F6722-1753,N#Cc1cccc(N(CC2)CCN2c2cccc(C(F)(F)F)c2)n1,0 F6454-0494,O=C(NCC(CC1)CCN1c1cnccc1)Nc1cccc(Cl)c1,0 V022-4690,CC(C)CC(N(CC1)CCC1C(C(N1CCCC1)=O)NC(c1c(C)cccc1)=O)=O,2 Z2392749409,O=C(c(cc1)ccc1OCC1CCCCC1)N1CC(CC2)NC2CC1,2 F540-0118,CC(c(cc1)ccc1N(CC1)CCN1S(c1cc(C(N2CCCC2)=O)cs1)(=O)=O)=O,2 S694-0672,CC1(CCCCC1)C(N(CC1)CC1n1c(C2CC2)ncc1C)=O,2 F6279-0063,Cn(c(C(Nc(cc1)ccc1N(CCC1)S1(=O)=O)=O)c1)nc1-c(cc1)ccc1F,2 F6204-2704,O=C(c1cocc1)NC1(CCOCC1)c1cccs1,2 Z3409607964,COC(N(C[C@@H]1N(CC2)Cc3c2cccc3)C[C@@H]1O)=O,0 V022-1290,COCC(N(CC1)CCC1C(C(N1CCCCC1)=O)NC(c1cccs1)=O)=O,0 Y042-6471,s1c(NC(C2[C@](OC(C2)=O)(C)C)=O)nnc1C1CC1,2 Z2723726976,CC(CN(CC1)c2nc(cncc3)c3n2C)C1O,0 F6514-7326,CC(C)C(Cn1nccn1)NC(NCCc1ccccc1)=O,2 Z357942354,Cc(n(C)nc1C)c1S(NCc1cc(F)cc(F)c1)(=O)=O,0 Z4626152557,CC(c(cc(C(F)(F)F)cc1)c1Br)NCCCO,0 SB56-0655,CCC(CC)N(C[C@@H]1c2nc(-c3ccccc3)no2)C[C@@H]1c1cnccc1,2 SA58-1302,O=C(NCc1ccccc1)N1C(CCc2noc(-c3ccccc3)n2)CCC1,2 Z1842058257,CN(C)c1nccc(C(NC(CCCN2c3ccnn3C)C2=O)=O)c1,2 F6414-2489,COc1ccc(CNC(NCC(c(cc2)ccc2SC)O)=O)cc1,0 Z31432191,O=C(c1cc2ccccc2cc1)N1CCCCCC1,2 E958-0793,COc1cccc(NCc2cccn2-c2nnc(N(CC3)CCN3c3ccccc3)s2)c1,0 Z2300989037,N#CC1(CS(N2CC(C(O)=O)OCC2)(=O)=O)CCCCC1,2 Z2256262082,Cc1c(C)sc(C(CCC2)CN2C(Cc(cc2)ccc2C(O)=O)=O)n1,2 F6813-8184,CC(C1)N(Cc(ccnc2)c2F)CCN1c1c(C#N)nccc1,2 S728-0044,COc(cc1)ccc1N(CC1)CCN1C(C(CCO)(C1)C11CCOCC1)=O,0 S497-1209,CC(C)S(N(C1)CC1Oc(cccc1)c1-c1nc(C2CC2)no1)(=O)=O,0 Z1449355920,CCOc1ccnc(N(CCC2)CCN2C(c2cn(-c3ccccc3)nc2)=O)n1,2 Y040-1262,O=C(COc(cc(c(C1=C2CCC1)c1)OC2=O)c1Cl)N1CCCC1,0 Z1625995866,CN(C)CCNC(Nc(cc1)cc(Cc2ccccc2)c1OC(F)F)=O,0 F5854-1724,O=C(c1cccs1)N(CCc1cccs1)Cc1cnccc1,2 F5729-0094,O=C(C1(CCOCC1)c1ccccc1)N1CCC(Cn2c(cccc3)c3nc2)CC1,2 Z2897344242,CC(C)(CC(N(CC1)CCC1(C)C(O)=O)=O)C=C,0 G856-6558,O=C(CSc1nnc(cc2)n1nc2-c1cccs1)N(CC1)CCN1c1ccccc1,2 D718-1292,O=C1N(Cc(cccc2)c2Cl)C=Cc2c1cnc1nc(-c3cnccc3)nn12,2 F6445-6593,COC(c(cc1)ccc1C(NCc(cccc1)c1-c1cscc1)=O)=O,0 Z2443550997,O=C(C1CC2(CCC2)C1)NS(Cc1cnccc1)(=O)=O,2 Z1008462882,CCN1CC(CNC(c(cc2)cnc2-n2nc(C)cc2C)=O)CC1,2 Z69005964,CC(C)(C)c1nc(cc(cc2)NC(Cc3c[nH]c4c3cccc4)=O)c2[nH]1,0 F415-0630,Cc1c(CSc(c2c3)nccn2nc3-c2c(C)ccc(C)c2)nc(-c2ccc(C)cc2)o1,0 E715-0618,O=C(C(CC1)CCN1c1ncnc2c1nc1n2CCCCC1)N(CC1)CCN1c1ncccn1,2 Z1275534511,CC(C)Cn1ncc(NC(c(cc2)cnc2OCC(F)(F)F)=O)c1,0 Z2376833733,COc(cc1)cc(C2)c1OCC2C(Nc1cc(F)c(CC(O)=O)cc1)=O,0 Z3235037509,O=C1Oc(cccc2)c2N1C1CCNCC1,2 Z3142706120,O=C(c1nccnc1-c1nc(cccc2)c2s1)NC(C1)C2C1CNC2,2 F6563-0362,O=C(c1c2OCCOc2ccc1)N(CC1)CCC1Oc1cscc1,2 L294-0766,Cc(cc1)c(C)cc1N(CC(C1)c2nc(-c(cc3)ccc3NS(c3cccs3)(=O)=O)no2)C1=O,2 Z3135430122,CCS(c1c(CCNC([C@H](C2)[C@H](C3)[C@H]3[C@H]2N)=O)cccc1)(=O)=O,2 F0298-0264,O=C(c1ccco1)Nc(ccc(Br)c1)c1C(c1ccccc1)=O,2 F2984-0211,O=C(CCCS(Cc1ccccc1)(=O)=O)Nc(cc1)cc2c1OCCO2,2 F6556-0731,Cc1c(C(NCC(CSC2)(c3c2cccc3)O)=O)c(C)nn1C,0 Z1228066860,CN(CC1)CCN1C(c1cc(cc(c(OC)c2)OC)c2[nH]1)=O,0 F6523-0329,CCCc1c(C(N(CC2)CCN2c2ncnc(C(F)(F)F)c2)=O)snn1,2 Z1650047793,Cc(cc(cc1)F)c1C(NCCc(cc1)ccc1C(O)=O)=O,0 Z2785036462,Cc(cc1)cc(C(N(CCC2)CCC2C2CCC2)=O)c1S(N)(=O)=O,2 F6764-3310,FC(c1nnc(cc2)n1nc2N1Cc2cc3cccnc3nc2CC1)(F)F,2 Z1929258280,O=C(c1nccn2c1ncc2)N[C@H](C1)[C@@H]1c(cc1)ccc1F,2 F6474-3789,O=C(CN1N=CC=CC1=O)N(CC1)CCC1Oc1cccc2cccnc12,2 8139-0383,CCOc(cc1)ccc1N(C(CC1NC(CC2)CCN2c2nc(C)cc(C)n2)=O)C1=O,0 Z812524806,CCN(CC)CCN(CC1)CCC1N(c(cccc1)c1N1)C1=O,0 F6514-2240,CS(N(CC1)CCC1C(NC(C1CCOCC1)c1cnccc1)=O)(=O)=O,2 S624-0057,O=C(c1ccco1)N(CC1)CCC11NCCc2c1[nH]c1c2cccc1,2 F3385-4827,O=C(c1cc(cccc2)c2o1)NCc1noc(-c2ccccc2)n1,2 F6565-3030,O=C(c1ccco1)N(CC1)CCN1c1nnc(C(F)(F)F)cc1,0 F5681-0128,CCOc(cccc1)c1NC(Cc1c(C)n(C(CC2)CS2(=O)=O)nc1C)=O,2 Z4289716622,CCc1noc(C)c1NC(c1ccnc(C(F)(F)F)n1)=O,2 Z1644850361,CC(CCOCC1)N1C(CNC(c1cc(OC)ccc1)=O)=O,0 F6512-1825,CC(C)S(c1ccc(CC(NCc2nc(C3CCCCC3)cs2)=O)cc1)(=O)=O,0 F0909-0013,Brc(cc1)cc2c1OCCSCCOCCSCCO2,2 Z3101670711,CN(CCN(C1)C(C(CC2)(c3c2c(OC)ccc3)N)=O)C1=O,2 Z2351159581,CC(c1nn(C)cc1)Nc1cc(CN(CC(N)=O)CC2)c2cc1,2 Z1449912288,C1Cc2nc(-c3cnccc3)nc(NC(CC3)Cc4c3cn[nH]4)c2C1,2 F6454-0920,CC(c1ccccc1)NC(C(NCC1CCN(CC(F)(F)F)CC1)=O)=O,0 Z3019297568,CN(CCOc1cccc(Cl)c1)C(C1NCc2c1cncn2)=O,0 V012-6516,CCN(C(CN1CCC(NCC(C)C)=O)=C(C(c2c(C(F)(F)F)cccc2)N2)C1=O)C2=O,0 F6658-5571,Cc1c(C)ncnc1OCC1CCN(Cc2nc(cccc3)c3[nH]2)CC1,2 N113-0107,O=C(CCC[C@H]1NC[C@H]2CN(Cc3ccccc3)C[C@@H]1C2)N(CC1)CCC1N1CCCCC1,2 F6245-0984,O=C(c(cc1)ccc1-n1cccc1)N(CC1)CCC1c1nnc(-c2cscc2)o1,2 Z3989662886,Cc1c(C)nc(CNC(c2ccc(-c(cc3)ccc3F)n2C)=O)cc1,2 F6496-1571,Cc1cc(C)nn1-c(cc1)nnc1C(NCc1ncnc(C2CC2)c1)=O,2 Z2951370958,Cn(c(C1)c2CCN1C1CCCC1)nc2O,2 Z2946611575,OCC1N(CC(CCC2)(CN2C(OCc2ccccc2)=O)O)CCC1,2 Z3834170735,CCO[C@@H](CCC1)CN1c1nc(-c2cc(F)cc(F)c2)ns1,0 Z2359190244,N#Cc(cc(cc1)F)c1S(N(CC1)CCC1OC1CCC1)(=O)=O,2 8009-3080,CC(C)CCC(C)(NC1=S)NN1c1ccc(C)cc1,0 CM3470-4950,CC(C)C(c1nccn1CC1)N1C(c1c(C)n(C)c(-c2ccccc2)c1)=O,2 F6439-4821,O=S(C1CCCCC1)(NCCn1nc(C(F)(F)F)cc1)=O,2 F1878-0817,CC(C)(C)n1nc(CSC2)c2c1NC(c1nc2ccccc2nc1)=O,2 Z1900663356,CC(C)(c(cccc1)c1Br)NC(c1cn(Cc2noc(C)n2)nn1)=O,0 C768-0992,CN(CC1)CCN1c(c1cc(OC)ccc1nc1)c1C(c(cc1)ccc1OC)=O,0 F2871-0055,O=C(COc(cc1)ccc1Cl)NCCOc(cc1)nnc1-c1ccco1,2 F5230-1323,O=C(NCCCN(C(C=C1)=O)N=C1c1ccncc1)Nc1ccc(C(F)(F)F)cc1,2 F2184-0195,O=C(c1c2cccc1)N(Cc1csc(-c3ccccc3)n1)C2=O,2 S988-0481,CCn1nccc1C(N(C[C@H]1CN(C2)S(CC)(=O)=O)C[C@]12c1nc(C)no1)=O,2 F6550-7659,CN(C)c1cccc(C(N(C2)CC2N(C(C2C3C2)=O)C3=O)=O)c1,2 Z2621646770,CC(Cc(cc1)c(C)cc1F)NC(Nc1nn(CC(F)F)cc1)=O,2 M375-0025,Cc(cc1)ccc1N(CC(C1)c2nc(CCS(c3ccccc3)(=O)=O)no2)C1=O,2 F2014-0230,O=C1N(CCc2ccccc2)C(SCc2ncccc2)=NC2=C1SCC2,2 SD67-0639,O=C(CN1Cc(cc2)ccc2F)N(CCCN(C2)S(C3CC3)(=O)=O)C2C1=O,2 F6254-0008,O=C(CSC1CCCC1)Nc1nc(CCOC2)c2s1,2 F1899-2250,O=C(CSc(cc1)nnc1-n1nccc1)NCC1OCCC1,2 Z2781376787,CSC(CC1)CCN1C(c(nc1C2CC2)nn1-c(cccc1)c1Cl)=O,2 S590-0530,COc(cc1)ccc1NC(NCC1N(Cc2ccccc2)Cc2cccn2C1)=O,2 Z2952553160,CC[C@@H]1[C@@H](CN(CC2)CCC2[C@@H]2OCCC[C@H]2c2nc(C)no2)C1,2 F5831-7640,O=C(NCc1cscc1)NC(c1ccccc1)c1ccccc1,2 Z1658643079,Cc1noc(C(F)(F)F)c1C(NCC1(CO)CCC1)=O,2 SB29-0127,Cc1cc(C(N(C[C@H](C2)OC)[C@@H]2c2n[nH]c(C)n2)=O)no1,2 F6734-1460,O=C(C1(CCOCC1)c1ccccc1)N(C1)CC(C2)C1CN2c(cc1)ncc1F,2 V019-7506,Cc(cc1)ccc1S(Nc(cc1)ccc1N(CCCN1Cc2cccc(Cl)c2)C1=O)(=O)=O,0 F6414-3910,CC(C)n1nc(C)c(S(NCC(C)(c2cc(cccc3)c3s2)O)(=O)=O)c1C,2 F6809-6764,Fc(cc1)cc2c1c(C(CC1)CCN1c(c(F)c1)ncc1Cl)no2,0 L678-0211,CC(Cc1c2cccc1)(C(NCc1c(C)cccc1)=O)N(Cc1cc(C)ccc1)C2=O,0 F1757-0112,Cc1cc(N(CC2)CCN2C(N2CCOCC2)=O)cc(C)c1,0 C069-0720,CC(CC(C)(C)N1)N(CCCC(Nc2nc(cccc3)c3s2)=O)C1=S,2 Z1820641767,CC(CNC(c1cc(-c2cccs2)nc2ccccc12)=O)N(CCCC1)C1=O,2 F6482-3938,COc(cc1)ncc1C(N(CC1)CCC1n1nccn1)=O,2 Z2066033463,CCc(nc(CNS(c1cocc1)(=O)=O)cc1)c1C(O)=O,2 8015-0165,CCOc(ccc(C(CC(O)=O)NC(c1cc(Br)c(C)cc1)=O)c1)c1OC,0 G336-0251,O=S(c(cc1)cc2c1OCCO2)(N(CC1)CCN1c1nc(cccn2)c2s1)=O,2 Z1283792371,Cc1nc(CNC(N(CCC2)C2c2c(C)cccc2)=O)no1,2 F5822-2213,O=S(c1ccccc1)(N1CCC(Cn2c(-c3ccccc3)ncc2)CC1)=O,2 F3127-0279,O=C(c(cc1)ccc1N(C(C1C2CCCC1)=O)C2=O)N(CC1)CCN1c(cccc1)c1F,0 Z894923356,CC(c1cnccc1)NC(N(CC1)CCN1c(cc1)ncc1Cl)=O,0 Z3206111164,CN(C[C@H](C1)NC(c2ccc(Oc3ccccc3)o2)=O)C1=O,2 Z1744231886,CC(N12)=CSC2=NC=C(C(Nc(cc2)cc(C#N)c2Oc2ccccc2)=O)C1=O,2 SC72-0347,O=C(c(ccnc1)c1F)N(C1)CC11OCc2c1cnc(C1CC1)n2,2 F6573-7377,O=C(c1nn(-c2ccccc2)nc1)N(CCN1c2cnccc2)CC1=O,2 S579-0212,CN(Cc1cnccc1)C(CC1=C(CCCC2)C2N(C)C1=O)=O,2 F3385-6007,O=C(c1cc(cc(cc2)Cl)c2o1)NCCN1CCOCC1,2 Z3580174311,Cn1ncc2c1cc(C(Nc1cc(C(CCC3)NC3=O)ccc1)=O)c(C(F)F)n2,2 Z2483071919,OC(c1cccc(Cl)c1CN(CC1)CCC1OCC1OCCCC1)=O,0 Z1544906985,Cc(ccc(NC(CCCN1c(cccc2)c2F)C1=O)c1)c1C(N)=O,0 S979-0237,C[C@@H](COc(cc1)c(C2)cc1C(NCCOC)=O)N2C(Cn1cncc1)=O,2 F5860-0332,Cc1cc(C(N2CCN(Cc3c(C)onc3C)CC2)=O)no1,2 F6783-6717,CCn1c(N2CC(CN(C3)C(c4cn(C)nn4)=O)C3C2)nc2c1cccc2,2 Z3074709748,COCCNS(c(cc1C(F)(F)F)cnc1NCCO)(=O)=O,0 F6802-7689,COc(cccc1)c1NC(CN(CC1)CCC1C(N(CC1)CCC1(F)F)=O)=O,0 F6125-1274,CC(N(C1)CC1C(Nc(cc1)cc2c1OCO2)=O)=O,2 Z250-1322,NC(CNC(C(CCC1)CN1C(NC1=O)=Nc2c1scc2-c1ccccc1)=O)=O,0 Y040-8617,OC(CCNC([C@H]1CC[C@H](CN2NNc(cccc3)c3C2=O)CC1)=O)=O,2 F6444-6730,COc(ccc(F)c1)c1S(N(C1)Cc2c1cnc(N1CCOCC1)n2)(=O)=O,0 F6471-8568,Cn1c(S(C(CC2)CCN2C(C2Oc(cccc3)c3OC2)=O)(=O)=O)ncc1,2 F6523-0291,CC(C)(Cc1ccc2)Oc1c2OCC(N(CC1)CCN1c1cc(C(F)(F)F)ncn1)=O,2 T505-0282,CCn1ncc(S(N2C(CCn3nnc(-c4ccccc4)c3)CCCC2)(=O)=O)c1,2 F6523-0262,CC(C(NC(CC1)CCN1c1nc(C)nc(C(F)(F)F)c1)=O)Oc1cccc(Cl)c1,0 Z2203553328,CC(N(C1)CC1c1nc(-c2cn(C)nc2C(F)(F)F)no1)=O,2 F835-0482,CCc(cc1)ccc1-c(cc12)nn1C(SCc(cc1)ccc1N(CCC1)C1=O)=NNC2=O,2 F6773-4815,Cc1nc(CN(CC2)CCC2Oc2nc(C)cnc2C)co1,2 Y042-7244,c1(nc2c([nH]1)cccc2)[C@H]1N(C(c2c(c3c(nc2)cccc3)O)=O)CCC1,2 SA96-1529,CC(C)NC(C1C(C2)(CN2C(c2c[nH]nc2)=O)CN(Cc2ccccc2)C1)=O,2 Z2960060591,OC(CCC1)CCN1C(c1c(c(Br)ccc2)n2nc1)=O,2 Z2721524685,COc1cccc(C2)c1CN2S(N(CCC1)CC1C(O)=O)(=O)=O,2 F6478-4040,Cc1cc(OC(CC2)CN2C(CSC2CCCC2)=O)nc(C)n1,2 Z1198163385,COc(cc1)cc2c1c(C(O)=O)n[nH]2,0 F6619-5863,COc1nc(N2CCN(CCCc3ccccc3)CC2)ncc1,2 SB24-0358,Cc1noc(C)c1CC(N(CC1)CCC1(CC1)C1n1nnc(C(N(C)C)=O)c1)=O,2 Z4518257177,O=C(c(cc1)cc(N2)c1N(CC1CC1)C2=O)Nc1cc(CC2CC2)n[nH]1,2 F6199-0170,O=C(CCCc1ccccc1)N1CCN(CCn2cncc2)CC1,2 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F6678-9850,O=C(c1cc(Br)cnc1)N(C1)CC1n1c(cccc2)c2nc1C1CC1,2 SA67-0934,Cc1noc(C)c1C(N1CC(CCc2noc(C3CCOCC3)n2)CC1)=O,2 Z4768599446,Cc1c(C(N(CC2)CC2C2CCCC2)=O)[nH]c2c1CCCC2,2 Z1510376208,CCC1(CNC(NCCS(C)(=O)=O)=O)CCN(Cc2ccccc2)CC1,0 S932-2636,O=C(c1n[nH]c(C2CC2)c1)N(CC1)CC1n1nnc(COCC2CC2)c1,2 Z2953802609,Cc1nn(CC(N2c(cccc3)c3N(C)CC2)=O)c2ncccc12,2 Z1928984351,Cc1cc(C(Nc2cc(CN(CC(N)=O)CC3)c3cc2)=O)nn1-c1ccccc1,0 G657-0372,CCN(c(n1nc2)c2C(Nc(cc2)c(C)cc2F)=O)C(CCNC2)=C2C1=O,0 P659-2101,Cc1nc2nc(CN(CC3)CCN3c(cc3)ccc3Cl)nn2c(N2CCN(C)CC2)c1,0 Z2179934755,Cc1cc(CNc2nc3ccccc3nc2)cc(N2CCCC2)n1,2 Z1337799280,Cc(onc1-c2ccccc2)c1-c1nnc(CN2CC(CCCC3)N3CC2)o1,2 S650-8431,O=S(C1CC1)(N1CC(Cc2noc(-c3ccccc3)n2)CC1)=O,2 F1762-0541,C(c1nnc2sc(C3Oc(cccc4)c4OC3)nn12)c1ccccc1,2 Y030-7573,CC(CC(Nc1nnc(C2CCCCC2)s1)=O)c1ccccc1,0 Z2897739169,CC(C)c1c(C(N2CCC(CCC(O)=O)CC2)=O)ncs1,0 F6480-4001,O=S(Cc1ccc(C(F)(F)F)cc1)(N(CCC1)CC1Oc(nc1)ncc1F)=O,0 G857-2107,COc(ccc(S(N(CCn1c2ccc1)C2c(cc1)ccc1Br)(=O)=O)c1)c1OC,0 Z2483064818,Cc(cc1)cc(CN(C)Cc2nc(C(O)=O)co2)c1F,0 J031-2319,CC(C1)Oc2c1cc(CNC(CSc1nnc(-c(cc3)cc4c3OCCCO4)n1C1CC1)=O)cc2,2 Z2838121335,CC(C(NC(NCC=C)=O)=O)N[C@@H]1[C@@H](c(cc2)cc(F)c2F)OCC1,0 Z112468618,CC(C(Nc(ccc(F)c1)c1F)=O)Sc1nc(ccc(OC)c2)c2[nH]1,0 F2556-0125,CS(c(cccc1)c1C(Nc(cc1)ccc1-c1nc(cccc2)c2s1)=O)(=O)=O,2 F6561-7722,O=C(c1cocc1)NC1CN(Cc2cscc2)CC1,2 C066-1676,CCOc(c(OCC)c1)cc(C(C(c(cc2OC)cc(Br)c2O)N2C)C(O)=O)c1C2=O,0 F6709-0273,CCc(cn1)cnc1OC(CC1)CCN1C(c1cscn1)=O,2 F6481-4066,O=C(c1cc(-c2ccco2)n[nH]1)N(CC1)CCSC1c1cccs1,2 F6471-5654,O=C(CCc(c(F)ccc1)c1Cl)N(CC1)CCC1n1nncc1,0 F6245-3040,O=C(C1(CCCC1)c1cccs1)N(CCC1)CC1c1nnc(-c2cscc2)o1,2 Z442663478,CC(C)c1cc(C(Nc(cc2)cc(N3)c2SCC3=O)=O)c(c(C)nn2C(C)(C)C)c2n1,2 Z2897854632,CC(CN(CC1)C(C2=Cc(cc(cc3)F)c3OC2)=O)C1C(O)=O,2 F5857-7085,OC(CCNC(C(NC1CCCC1)=O)=O)c1ccccc1,2 F6679-0027,Cc1nn(C)c(C(N(C2)CC2n2c(cccc3)c3nc2C2CC2)=O)c1,2 F5854-4621,COc1ccc(CCNC(N(CCc2cccs2)C2CC2)=O)cc1,2 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S827-0489,COCCc1noc([C@H](CC(C2)(F)F)N2C(CC2=CCCCC2)=O)n1,2 F6064-0599,CC(C)Sc1ccc(CC(N(C2)CC2c2nc(-c3ncccn3)no2)=O)cc1,0 F5253-0610,Cc1cccc(N(CC2)CCN2S(CCCNC(c2cccc(Cl)c2)=O)(=O)=O)c1,2 Z1186364880,COCC(CC1)CCN1C(C(CC1)CCN1c1nccnc1)=O,0 F5832-4216,CN(C)C(CNC(C1(CCOCC1)c1ccccc1)=O)c1cccs1,0 F6752-8012,COc(cc1c(N(C2)CC2C(N2CCOCC2)=O)ncnc1c1)c1OC,2 Z2066283279,NC(CC(CCC1)CCN1S(c(cc1)cc(Cl)c1C(O)=O)(=O)=O)=O,0 F118-0494,CN(C)C(c(cc1)cc(N2CC(N(CC3)CCN3c3cccc(Cl)c3)=O)c1OCC2=O)=O,0 E511-0335,Cc1cc(N(CC2)CCN2C(CCS(c(cc2)cc(N3)c2OCC3=O)(=O)=O)=O)c(C)cc1,0 F6752-3525,O=C(C1CC1)NC(CCC1)CN1c(nccc1)c1F,0 Z1663405677,CC(C)c(c1c2)noc1ncc2C(Nc1c(C2CC2)onc1C)=O,2 Z4119278161,COc(c(C(NCCc1nc(-c2cc(Cl)ccc2)no1)=O)ccc1)c1Cl,0 Y042-2782,CCC(c(ccc(OCC(N(CC1)CCN1c(cc1)ccc1OC)=O)c1C)c1O1)=CC1=O,2 F5668-5500,CC(C)(C)c1noc(C(C2)CN(CCc3cccs3)C2=O)n1,2 SD67-0162,CC(C)CN(CC(N(CCC1)C2CN1C(c(ccc(OC)n1)c1OC)=O)=O)C2=O,2 Z2624826891,CC(CC1)CCN1C(Nc1nc(OC)ccc1)=O,0 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Z1686081009,CN(CC1)CCN1c1cccc(-c2noc(C3CC3)n2)n1,0 SD03-0144,CC(C)C(N1CCC(C2)(CN(CC(NCCCN3CCOCC3)=O)C2c2nc(C)no2)CC1)=O,2 F6680-8842,Cc1nccc(OCC(CCC2)CN2c2cc(C)nc3ncnn23)c1,2 F6523-0984,CN1N=C(CCC(C2)C(Nc(cc3)cc4c3OCCO4)=O)C2=CC1=O,2 F396-0857,COc1ccc(CN(C2=O)C(SCC(NC3CCCC3)=O)=Nc3c2sc2ncccc23)cc1,2 4483-2799,CC(CCC1C(N2c3cc(C)c(C)cc3)=O)CC1C2=O,0 Z25990055,COc(cccc1)c1N(CC(NCc1cccc(Cl)c1)=O)S(c(cc1)ccc1F)(=O)=O,0 F6750-6542,Cc1noc(CN(CC2)CCN2c2nc(-c3cn(C)nc3)cnc2)n1,2 F6503-5049,CN(C)S(N(Cc1ccco1)Cc1nn(C)c2c1CCC2)(=O)=O,2 Z992569640,O=C(c1ccccc1)N(CCC1)CC1NC(Nc1cccc(CN2N=C(C=CC=C3)N3C2=O)c1)=O,2 F6521-8608,COc1cc(CCCC2(CNS(c(cccc3)c3OC(F)(F)F)(=O)=O)O)c2cc1,2 Z2669825169,CCC(COC(C)(C)C1)N1C(c1cccc(Cl)c1Cl)=O,0 Z1175988811,CN(c(nc(cc1)C(N(CCC2)CC2C(N2CCCC2)=O)=O)c1C(N1C)=O)C1=O,2 F666-0258,CC(N(C)C(N(C)C1=O)=O)=C1N(CC1)CCC1C(Nc(cc1)cc(Cl)c1F)=O,2 Z1500965099,CC1(CCOCC1)NC(c(cc1)nn1-c(cc1)cc(Cl)c1Cl)=O,2 Z2370516085,O=S1(C(CNc2nc(C3CCCC3)ns2)CCCC1)=O,2 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F6444-6450,COc(ccc(CCC(N(C1)Cc2c1cnc(N1CCOCC1)n2)=O)c1)c1Br,0 F6808-8283,CN(C(C=C(N1C)N2CCC(CO)CC2)=O)C1=O,0 F6545-1578,O=C(c1cc(cccc2)c2[nH]1)N1CCC(CF)CC1,0 F6451-0354,COC(CNS(Cc(cc(cc1)F)c1F)(=O)=O)c(cccc1)c1OC,0 F6544-0724,CC(NC(CC1)CCN1c(cc1)ncc1Cl)=O,0 Y040-3954,CC(CC1)CC(c(ccc(OCc2cc(OC)ccc2)c2C)c2O2)=C1C2=O,0 Z2591383172,FC(c1ccc(C2(CNC3c4ccnn4CCC3)CC2)cc1)(F)F,2 F0163-0064,Cc1cccc2nc(COc(cc3)ccc3Cl)cn12,2 Z1360195730,CC(NC(CC(NCC1(CN2CCOCC2)CCCCC1)=O)c1ccc(C)cc1)=O,2 F820-0514,CCc1nc(CN(c(ccc(S(N(Cc2ccccc2)C(C)C)(=O)=O)c2)c2O2)C2=O)no1,2 Z1283555383,CC(c1cn(C)nc1)NC(N(CC1)Cc(cc2OC)c1cc2OC)=O,2 S720-1042,COc1ccc(C2(CC2)C(N(C[C@H](C2)Oc3ccccc3)[C@@H]2C(NC2CC2)=O)=O)cc1,2 Z2374351109,O=C(C1CC(C2)C2CC1)NS(c1cc(Br)cs1)(=O)=O,0 F6515-0745,O=C(c1cc(Br)cnc1)NCc1cc(-c2cccs2)ncc1,2 Z2473565254,COC(C1Oc(cc(cc2)F)c2N(Cc(nc2)cnc2Cl)C1)=O,2 SA93-0566,Cc1c(C(N(CCC2)CC2(CCOC)C(N)=O)=O)sc(C)n1,0 Z2207808548,C[C@H](CN(C)C(c1ncc(N(C)C)nc1)=O)O,0 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J079-0888,CCc(cc1)cc(C(CN2CCN(Cc3c(C)oc(-c(cc4)ccc4OCC)n3)CC2)=C2)c1OC2=O,0 SB52-0638,Cc1noc(C)c1CCC(N1CCC(C2)(CN(C)C2c2noc(C3CCC3)n2)CC1)=O,2 F6616-3170,CC(C)c1c(Cn2ncc(Br)c2)nco1,2 F946-0573,CC(Cc1c2cccc1)N2S(c(cc(cc1)C(C=C2)=NN(c3c(C)onc3C)C2=O)c1OC)(=O)=O,2 Z1783447665,CC(C)(C)CCN(C)S(c(cccc1)c1Br)(=O)=O,0 8015-4944,C(c1ccccc1)Nc1c(c(C2Oc(cccc3)c3OC2)cs2)c2ncn1,2 Z1037366728,CN(Cc1ccccc1)C(c1c(ccn2C)c2ccc1)=O,0 T977-0094,CCc(nc1C(N(CC2)CCN2c2ncccn2)=O)nc2c1OCCO2,2 F6230-0037,O=C(c(cc1)cc2c1[nH]cn2)NCc1c(cccc2)n2nc1,2 Z1982010559,Cc1cc(C(Nc(cc2)ccc2C(N2CCCC2)=O)=O)nc(NC)n1,2 Z1269764187,CC(C)c1nc(S(Nc2cc(C(F)(F)F)ccc2)(=O)=O)c[nH]1,0 Z1816022080,CC(C)c(cccc1)c1S(NC(CCCCN1)C1=O)(=O)=O,2 Z2066965281,Cc(cc(cc1)C(O)=O)c1S(N(CC1)CC11CCOCC1)(=O)=O,0 S997-0766,Cc1cnc(CN2C[C@@H](CN(C3)S(C)(=O)=O)[C@]3(COC)CC2)cc1,0 F5883-0534,CCOC(Nc1cc(-c2ccccc2)nn1CCO)=O,0 Z1725051680,COC1(CNC(c2cnns2)=O)CCCCC1,0 SC73-0191,CN(C)C(c1nn(C)c2c1COC(CC1)(CCN1C(c1nc3ccccc3cc1)=O)C2)=O,2 Z1873388651,CN(CCC(F)(F)F)C(C(O1)=Cc(cccc2)c2C1=O)=O,2 F2758-0498,CN1N=C(CNC(c2cc(cccc3)c3o2)=O)c(cccc2)c2C1=O,2 G786-0937,CC(C1)OC(C)CN1c1c(c(CCC2)c2s2)c2ncn1,2 C470-0752,CN(c1c(C(N2C)=O)n(CCc3ccccc3)c(CN3CCC(Cc4ccccc4)CC3)n1)C2=O,2 F6435-9518,Cn1cnc(S(N(CC2)CC2SCC(OC)=O)(=O)=O)c1,0 F6764-0795,Brc1cc2cc(CN(CCn3nccn3)CC3)c3nc2nc1,2 F6658-4024,Cc1cc(N2CC(CN(Cc(cc3)cc(OC)c3F)C3)C3C2)ncn1,0 Z3146331610,N[C@H](CN(C1)C(c2cnc(-c3ccncc3)s2)=O)[C@@H]1c1ccccc1,2 F3382-1564,O=C(CSc1ncc(-c(cc2)ccc2Br)o1)NCc1ccco1,2 Z1265532511,CNC(c1cccc(C(NCc2cc(OC)nc3ccccc23)=O)c1)=O,0 Z1487504120,COc(ccc(NC(N(CC1)CCC1N(CCCN1)C1=O)=O)c1)c1OC,2 SD25-0426,O=C(CCC(CN(C1)S(C2CC2)(=O)=O)C11CCCCC1)N1CCCC1,2 F5686-0538,Clc1c(CSc2ncnc(N3CCCC3)c2)cccc1,0 F6713-4696,C(C1)C1c1ccc(N(CC2)CCN2c2nc3ccccc3nc2)nn1,2 V002-6094,O=C(C(C1CCCC1)N(CC1)CCN1C(c(cccc1)c1Cl)=O)NC(CCC1)c2c1cccc2,2 Z2437520705,OC(c(cc1)ccc1S(N(CCC1)CC1OCC1CC1)(=O)=O)=O,2 Z2444595790,OC(c(cc1)cnc1N(CC1)CCN1C(C1CC1)=O)=O,0 S787-1007,N#Cc1cccc(CN2CCC(Cc3ccc(CCC(NC4CC4)=O)cc3)CC2)c1,2 F6516-0990,COCCNC(NCc1ccc(-c2ccco2)o1)=O,0 Y206-3419,CC(CC1C(Nc(cc2)cc3c2OCCO3)=O)=C(C)CC1C(O)=O,2 F2740-0696,COCCn1c(cccc2)c2c(NC(N(CC2)CCN2c2cccc(C(F)(F)F)c2)=O)c1,0 Z1537033043,N#Cc(cc(cc1)Br)c1NCC1CC1,0 Z2722677737,CC(C)(C)n1nc(C(N2CC(Cc3cccs3)C2)=O)c(Br)c1,2 F6549-5300,Cn1c(C(CC2)CCN2C(COc(cc2)ccc2Cl)=O)cnc1,2 Z2202661245,Cc1cc([C@@H](CCC2)NC(N(C[C@@H](C3)OC)[C@@H]3c3nncn3C)=O)c2cc1,2 Z1621784175,CCOc1nc(N2CCN(Cc([nH]3)nc(cc4)c3nc4OC)CC2)ncc1,0 Z2444604988,CC(C)(C1)OC(COCC(N(C)C)=O)CN1c(nccc1)c1C(O)=O,0 G673-0783,O=C(CN1c(cc(cc2)C(N3CCCCC3)=O)c2N(CCCC2)C2C1=O)NC1CCCCC1,2 F6791-8044,CN1N=C(C(CC2)CCN2c(cc2)cnc2C#N)N(C2CC2)C1=O,2 Z1796293657,CC(Nc1cccnc1NC(C1CCN(CC(F)(F)F)CC1)=O)=O,0 Z2482883545,CC(NC(CCC1)CN1C(C(O)=O)c1cscc1)=O,0 C858-1090,CCCSCCCNC(c(cc1)cc2c1nc(N1CCC(C)CC1)s2)=O,0 F5263-0628,COc(ccc(C(NCC1(CC1)c(cc1)ccc1F)=O)c1)c1OC,0 SB03-0271,Cc1noc(C)c1CC(NCCN(C1CCOCC1)C(CCC1)CN1C(C1CC1)=O)=O,2 Z4445562776,Cc1c(C)nc(-c(cc2)ccc2NC(c2cccc(CN(CC3)CCS3(=O)=O)c2)=O)[nH]1,2 F6190-0477,CCOc(cccc1)c1NC(NCCC(C1CC1)O)=O,0 Z2033617783,CC(C1)OC(C)CN1c(c1c2cccc1)nn1c2nnc1C,2 Z3717179138,O=C(c1cnc2n1CCOC2)NCC(CCC1)N1c1cccc(F)n1,2 D074-0129,CC(C)CCOc1cccc(C(c2c3[nH]nc2-c(cccc2)c2O)N(CCOC)C3=O)c1,0 F6658-5903,O=C(C(CC1)NC1=O)N1CCC(COc2ncnc(C3CCC3)c2)CC1,2 SD02-0222,CC(C)c1nnc(C(C2)N(CC(N3CCCC3)=O)CC2(CC2)CCN2C(c2c(C)onc2C)=O)o1,2 F6515-1359,O=C(CNC(OCc1ccccc1)=O)NCc1cc(-c2ccco2)ncc1,2 L262-1080,COc(ccc(F)c1)c1-c1cc(N(CC2)CCN2C(Nc2cccc(SC)c2)=O)ncn1,0 F6617-4709,NC(C1c2ccc(C(c3ccccc3)=O)n2CC1)=O,2 Z1734417336,CC(C)(C)C(NCCNC(C1(C)CCN(Cc2ccccc2)CC1)=O)=O,0 L118-0155,O=C(c(cc1)ccc1-c(s1)ccc1S(N1CCCCC1)(=O)=O)NC1CCCC1,2 Z316645972,Cn1c(C(N(CC2)CCN2C(c(cc2)ccc2OC)=O)=O)ccc1,0 Z1603735376,CC(C(NC(C(O)=O)c(cc1)cc(F)c1Cl)=O)c1c(C)n(C)nc1C,0 F6570-2611,O=C(c1noc(-c2cccs2)c1)Nc(cccc1)c1-c1cn(CCCC2)c2n1,2 F6502-0195,O=C(C1Oc(cccc2)c2OC1)NCCn1c(-c2ncccc2)ncc1,2 Y043-8509,CCN(CC1)CCN1c(cc(c1c2)N(C3CC3)C=C(C(O)=O)C1=O)c2F,2 SB06-0002,O=C(CC(CC1)C11CCNCC1)N1CCOCC1,2 F6712-3192,CC(C)(C)NC(N(CC1)CCC1c1nnc2n1nc(C1CC1)cc2)=O,2 S635-3406,COCC(CN(C1)S(c(cc2)ccc2C#N)(=O)=O)C11CCNCC1,0 Z1603757709,CC(Cc1cscc1)N(C)C(c1nc(C(O)=O)ccc1)=O,0 F6565-4715,CC1=CN=C2SCC(CC(N(CC3)CCN3c3nnc(CCC4)c4c3)=O)N2C1=O,2 Z1874834244,N#Cc1cccc(NC(c2cccc(NC(Nc3nn(Cc4ccncc4)cc3)=O)c2)=O)c1,2 SA66-0617,O=C(Nc(cc1)cc2c1OCCO2)N1CC(CCc2noc(-c3cnccc3)n2)CCC1,2 E224-0587,CC(C)c1nn(CC(C)(C(NC2CCCCCC2)=O)N(Cc(cc2)ccc2Cl)C2=O)c2c1,2 F3179-0627,Cc(c(OC)c1)cc(OC)c1S(NCc1ccncc1)(=O)=O,0 Z3016325579,CC(C)[C@@H](CO)NC(CCc1ccc(CO)cc1)=O,0 D578-0068,Cc1noc(C)c1S(Nc(cc1)ccc1Nc1nc(N2CCCC2)nc(C)c1)(=O)=O,2 Y206-3298,CC(CC1C(N(CC2)CCN2C(c2ccco2)=O)=O)=C(C)CC1C(O)=O,2 J014-1843,O=C(C(C1)Oc(ccc(Cl)c2)c2N1S(c1ccccc1)(=O)=O)N(CCC1)c2c1cccc2,2 M980-0045,Cc1nc(cc(cc2)N(CC(C3)C(NCc4ccco4)=O)C3=O)c2o1,2 Z2950577793,CC(c1ncccn1)N1Cc2nnc(Cc3cccc(F)c3)n2CC1,2 Z1596217221,CC[C@H](CO)NC(NC1CN(Cc2ccc(C(F)(F)F)cc2)CC1)=O,0 Z1612726253,O=C(C(Cc1ccccc1)N1)N(C(CCN2c(c(F)ccc3)c3F)C2=O)C1=O,2 F6619-5295,Cc1nnc2n1ccnc2N(CC1)CCN1c1cc(C)nc(N2CCOCC2)n1,2 Z1224611700,O=C(c1cc(-n2cncc2)ccc1)NCC1CCC1,0 SA24-0117,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(Cc(cc1)ccc1Cl)=O,0 S979-0338,C[C@@H](COc(cc1)c(C2)cc1C(N1CCCC1)=O)N2S(c(cc1)cc(C)c1F)(=O)=O,2 Z2940374453,CC(C)c1nsc(NCC2(CC2)n2nccc2)n1,0 S554-0806,CC(C(NCc1nnc(cc2)n1nc2-c(cc1)ccc1OC)=O)Oc(cc1)ccc1Cl,0 F6619-6765,Cc1nc(-n2nccc2)cc(N(CC2)CCN2c2nc3ccccc3c(C#N)c2)n1,2 SC15-0335,O=C(c1cnccc1)N1CCC(CN(CC(COc2ncccn2)C2)C2=O)CC1,2 F6478-1198,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CC1Oc(nc1)ncc1F,2 A0001209,COc(cc1)cc(NC(c2nn3c(C(F)(F)F)cc(-c(cc4)cc(OC)c4OC)nc3c2)=O)c1OC,0 G587-0423,CN1c(cc(cc2)C(NC3CCCC3)=O)c2N(CCCC2)C2C1=O,2 F6507-8720,OC(CNC(C(Nc1c(C(F)(F)F)cccc1)=O)=O)(CCC1)c2c1occ2,2 F3394-0255,CC(c(cc1)ccc1NS(c(cc1)ccc1-c1ccc(C)cc1)(=O)=O)=O,2 Z3672944970,CC(C)(C)C(N(CCn1nc2)Cc1c2S(C)(=NC(c1cncs1)=O)=O)=O,2 F5857-5959,CC(CNC(C(NCc1cccs1)=O)=O)(C1CC1)O,2 Z1050856880,CCOC(C1)C1C(N(CC1)CC1N1CCCC1)=O,0 SC09-0405,C[C@@H](COc(cc1)c(C2)cc1-c1ccncc1)N2C1CCC1,2 V021-4135,CC(C)C(CN(CC1)CCN1c1c(Cc2cccc(F)c2)c(C)nc(C)n1)O,0 Z1151646499,O=C(c1c(-n2nccc2)nccc1)NC(CC1)CN1C1CC1,2 V027-8377,O=C(COc(cc1)ccc1Cl)N(CCC1)CC1OCc1cc(F)cc(F)c1,2 Z280890994,CCCNC(C(CC1)CCN1C(c1cccc(F)c1)=O)=O,0 Y043-5659,COc(cc1)ccc1N(CC1)CCN1C(CCN(C=Cc(cc1OC)c(C2)cc1OC)C2=O)=O,2 Z1918911431,CC(c1ncccc1)N(C)C(N(CC1)CCS1(=O)=O)=O,0 F5686-1032,C(c1cn(cccc2)c2n1)Sc1ncnc(N2CCOCC2)c1,2 S615-0359,O=S(c(cc1)cc2c1OCCO2)(N(CC1)CC1c1nc(CCOCC2CC2)no1)=O,2 F2244-0440,Cc(cc1NC(c2cc(cccc3)c3o2)=O)nn1-c1c(cnn2-c3cccc(Cl)c3)c2ncn1,2 F6436-3516,O=C(Cc(c(F)ccc1)c1Cl)NCC1(CCCC1)c1cscc1,2 F2356-1217,Cc(cc1)cc(C)c1NC(CN(CC1)CCC1C(NCc1cccs1)=O)=O,2 G836-0243,O=C(c(cc1)cc(N=C(N2CC3OCCC3)SCc(c(F)ccc3)c3Cl)c1C2=O)NC1CCCC1,2 F0161-0377,N#Cc1c(NC(c(ccc(Br)c2)c2F)=O)sc2c1CCC2,0 F6458-0243,Cc(n(-c1ccccc1)nc1)c1C(N(CC1)CCN1c(cc1)nnc1-n1ncnc1)=O,2 F6474-0343,Cc1nn(C)c(C(N(CC2)CCC2OC(C=C(C)N2C)=CC2=O)=O)c1,2 Y503-4544,Cn1nc(C2CC2)c2c(C(F)(F)F)cc(-c(cc3)cc4c3OCCO4)nc12,2 Z2621866713,Cc1cccc(C(CNC(C2CC3(CC3)CCC2)=O)N2CCOCC2)c1,2 F6559-6803,FC(c1cc(N(CC2)CCC2Nc(nc2)ncc2Cl)ncn1)(F)F,0 Z1419980955,Cc1cccc(C2(CNC(C(CCN3)CC3=O)=O)CCCC2)c1,2 V026-3795,CCc1nc(SCc2ccc(C(N3CCOCC3)=O)o2)nc(N(CC2)CCN2c(cccc2)c2F)c1,0 Z2308694281,CC(c1cc(C2CC2)ccc1)NC(N(CCC1)C[C@H]1O)=O,0 8016-1937,CN1C(SC(CCO2)C2=O)=Nc(cccc2)c2C1=O,2 Z2027310989,CCC(C1)(CN1C(CN1c(cccc2)c2OC(C)C1=O)=O)O,2 F184-3391,CCC1Oc2cc(S(N(CCC3)CC3C(NCCC3=CCCCC3)=O)(=O)=O)c(C)cc2NC1=O,2 F2342-0218,CN(C=CC=C1C(NCCN(C(C=C2)=O)N=C2c2cccs2)=O)C1=O,2 F0396-0210,CC(C)(C)n1nc(CSC2)c2c1NC(c(cc1)ccc1N(C(CC1)=O)C1=O)=O,2 F6442-7096,O=C(Cc1noc2c1cccc2)N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F,2 Z1729865096,O=C(C(CC1)Sc2nc(ncnc3)c3[nH]2)N1C1CC1,2 Z2076876652,CC(C)C(N(C)Cc(cc1)ccc1C(NCc(c(N1CCCC1)ccc1)c1F)=O)=O,2 M034-4555,CC(C)c1nnc(-c2cccnc2N(CC2)CCN2S(c2cc(F)cc(F)c2)(=O)=O)o1,2 8019-9397,O=C(CC1c(cc2)ccc2OC2CCCC2)Nc2c1sc(Nc1ccccc1)n2,2 F6561-8825,O=C(c1cccc(Cl)c1)NCCN(C(c1c2nccc1)=O)C2=O,0 Z2897056661,Cc(cc1)cc2c1snc2C(NC(CC1)CCC1C(O)=O)=O,2 F3385-0493,Cc(nc1)nc(-c(ccc(OC)c2)c2O)c1Oc(cccc1)c1OC,0 F5772-7379,CC(C)n(cc1)nc1C(N1c2nc(cccc3)c3n2CC1)=O,2 F3407-1691,Cc1nn2c(SCC(c3ccccc3)=O)nc(cc(c(OC)c3)OC)c3c2n1,2 Z1608105821,CC(c1c[nH]c(C(N2CC(c(cccc3)c3F)=CC2)=O)c1)=O,0 Z1725356127,NC(C(C1)OCCN1c1nn2c(-c3cscc3)nnc2cc1)=O,2 F6246-4162,Cc1csc(NC(CN(CC2)CCC2C(N2C3CC3)=NN(C)C2=O)=O)n1,2 Y206-5670,CC1OC(C)CN(Cc2csc(-c3ccccc3)n2)C1,2 F6803-0217,Cc1cnc(C)c(OC2CCN(CC(NCc3ccco3)=O)CC2)n1,2 F6662-1437,O=C(CCc1ccc(C(F)(F)F)cc1)NCC(F)(F)F,0 S923-1005,CCC(N(CCCC1)C1c1nnc(CC2)n1CCN2C(Nc1c(C(F)(F)F)cccc1)=O)=O,2 F6562-0727,CCc1nc(ccc(C(N(CC2c3cn(C)nc3)Cc3c2cccc3)=O)c2)c2s1,2 F3200-0092,CC(CCC1)C1OCC(CN(CC1)CCN1c1cccc(C(F)(F)F)c1)O,2 F5857-3849,CC(Cc(cc1)ccc1OC)(CNC(c(cccc1)c1SC)=O)O,0 F6524-5764,Cc1ccc(C(NCc2nnc3n2ccc(C(F)(F)F)c3)=O)s1,2 F6525-1268,CCOC(NCCn(cc1)nc1-c1nccnc1)=O,0 V009-4261,Cn(c(Oc1cccc(F)c1)c1CN(CC(COCc2ccco2)O)CC2CC2)nc1-c1ccccc1,2 E948-0458,Cc1c(C(N(CC2)CCN2c2ccccc2)=O)c2c(N3CCOCC3)ncnc2o1,0 Z1612674175,Cn(cc1)nc1N(CCCC1N(C(C(C2)N3C4C2CCCC4)=O)C3=O)C1=O,2 F6515-4488,O=C(Cn1cccc1)NCc1cc(-c2cccs2)cnc1,2 SB04-0187,CS(N(CC1)CC1N(CCNS(Cc1ccccc1)(=O)=O)C1CCOCC1)(=O)=O,2 Z1302988093,O=C(c(ccnc1)c1Cl)N(CC1)CCN1c1ncnc2c1scc2,2 Z1895023392,CN(CCC12CCN(Cc(nc3)nn3-c3ccccc3)CC2)C1=O,2 Z2906134814,Cc(cc(cc1)NC(C(CCC2)N(C)C2=O)=O)c1OCCN1CCCC1,2 F5791-0556,O=C(c1ncccc1)NCc(cc1)ccc1OCc1ccccc1,2 F1762-0611,CC(Cc1c2cccc1)(C(Nc1ncc(Cc3c(C)cccc3)s1)=O)OC2=O,0 Y043-3548,CCC(c(c(O1)c2CN(CC3)CCN3C(CC3)CS3(=O)=O)ccc2O)=CC1=O,0 F6169-0593,Cc1cc(C)nn1C(C=C1)=NN(CC(Nc2ncccc2C)=O)C1=O,2 F6480-1514,Cc1c(C(N(CCC2)CC2Oc(ccnc2)c2Cl)=O)c(C)n[nH]1,2 D294-3281,Cc(cccc1)c1N(CC(C1)c2nnc(NC(c(cccc3)c3SCCOC)=O)s2)C1=O,0 Z384466482,CC(N(CCC1)CC1C(NCC1(CCOCC1)c1ccccc1)=O)=O,2 SD67-0268,CC(C)CN(CC(N(CCC1)C2CN1C(c1c(C)n(CCOC)c(C)c1)=O)=O)C2=O,2 SB47-0874,CC(C)NC(N(C[C@@H]1CN(Cc2ncc(C)cc2)C2)C[C@@]12c1nc(C)n[nH]1)=O,2 Z3528371286,Cc1nc(C(N2C(Cc(cccc3)c3Cl)CCC2)=O)nn1C,0 Z4480730200,C#Cc1ccc(C(CCC2)N2C(c(cc2)ncc2Cl)=O)cc1,0 F6178-7410,O=C(NCCOc1ccccc1)NCC(CC1)CCN1C1CCOCC1,2 F6524-1763,CC(N=C(N1)N(CC2)CCC2NC(c(cc2)cnc2OC2CCCC2)=O)=CC1=O,2 C607-0821,Cc1cc(N2CCN(CC(c(cc3)cc4c3NCC4)=O)CC2)c(C)cc1,0 L372-0151,O=C(C1=CC(C(CCC2)=O)=C2N(c(cc2)ccc2F)C1=O)N1CCCCC1,2 Y200-6187,OC(c1c(Cc2c(CCCC3)c3cc3c2CCCC3)cccc1)=O,2 F6600-2474,Cc1cc(N(C)C(CC2)CCN2S(N2CCCC2)(=O)=O)ncn1,2 Z2996261451,CC(C)Oc(cc1)ncc1S(Nc1noc2c1CCCC2)(=O)=O,2 Z2982742482,CNC(NCc1cn(C[C@H](c(cc2)ccc2Cl)O)nn1)=O,0 Z1869591637,O=C(c1nn(CCCO2)c2c1)N(CC1)CCC1NC(c(cc1)ccc1F)=O,2 Z1820334029,COc(cccc1)c1OCC(N(CCCC1)C1c1nc(-c2ccccc2)c[nH]1)=O,2 Z4474193547,CC(C)CC(CNC(CC(C)OC)=O)NC(C1(CCC1)C1CCC1)=O,2 F6562-7148,O=C(c1cocc1)N(CC1)CCC1N(C(COC1)=O)C1=O,2 Z2086929032,COc(cccc1)c1C(Nc1ncc(-c2cnccc2)s1)=O,2 Z30172025,O=C(C(CSC1(CC2)c(cc3)ccc3F)N1C2=O)NCc1cnccc1,0 D399-0026,O=S(Cc1ccccc1)(N(CCC1)C1c1cccs1)=O,2 V010-5672,CCN(CC)S(c(cc1)cc2c1n(CC1OCCC1)c(SCc1ccc(C(C)C(O)=O)cc1)n2)(=O)=O,0 F2093-0213,CCN(CC1)Cc2c1nc(NC(COc(ccc(Cl)c1)c1Cl)=O)s2,2 Z1447621107,O=C(c(cc(CCC(N1)=O)c1c1)c1F)N1CC(c(cc2)cc(Cl)c2F)OCC1,0 F5596-0639,O=C(c1noc(-c2ccco2)c1)N(CC1)CCC1c1nnc(C2CC2)o1,2 Z2174942154,CN1[C@@H](CN(C2)C(c3nn(CCCO4)c4c3)=O)[C@@H]2OCC1,2 Z2219316983,O=C1NCCCN(Cc2nc(-c(cc3)ccc3F)no2)C1Cc1ccccc1,2 S823-1923,OC[C@@H](CN(Cc1ccccc1)C1)[C@H]1NC(C(C=C1)=NNC1=O)=O,2 Z3910721384,C[C@](COC1)(CCC2)[C@H]1N2C(Cn1c2ncnc(N)c2nc1)=O,2 S968-0816,O=C(c1ccncc1)NC(C1)C1(CC1)CCN1C(C(c1c2cccc1)=NNC2=O)=O,2 F6452-1392,CC(CNS(c(s1)ccc1Br)(=O)=O)(c1cc(Cl)ccc1)OC,0 F6438-0755,Cc1c(C(NCc2nc(N3CCCCC3)ccn2)=O)sc(C)n1,2 Z1038934168,CC(C)(CC1)CCN1C(Cn1nnc2c1cccc2)=O,0 S975-0373,C[C@@H](C(N(CCN1CCOC)[C@@H](C2)C1=O)=O)N2C(c1c(C)n(CCCOC)c(C)c1)=O,2 Z1500291961,O=C(c1cnccc1)N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Cl,0 S696-1556,Cc1cnc(-c2ccncc2)n1CC(C1)CN1S(c1cn(C)cn1)(=O)=O,2 SB57-0377,CCS(N(C1)CC(C2)(CN2C(C2CCN(C)CC2)=O)C1c1nc(C)no1)(=O)=O,2 Z909141322,CC(C)N(C)C(C(CCC1)CN1C(CN(c(cccc1)c1N=C1)C1=O)=O)=O,0 F2320-0275,Cc1cc(C)nn1-c(cc1)nnc1Nc(cc1)ccc1NC(c(cccc1)c1Br)=O,0 F6448-0151,O=C(COc(cc1)ccc1Cl)Nc1cn(CC2OCCCC2)nc1,2 S545-0690,O=C(NC1CCCCC1)N(CCCCC1)C1c1nc(-c2ccncc2)no1,2 F6487-0473,O=S(c(cc1)cc2c1OCCO2)(NCC(C1)OCc2c1cccc2)=O,2 F6471-2245,COC(c(cccc1)c1C(N(C(CC1)C2)C1c1c2ncnc1)=O)=O,2 Z2256272626,OC(c1cn(CC(NC2(CCC2)c(cc2)ccc2Br)=O)nn1)=O,2 Z2451806066,O=C(C(C=C1Br)=CNC1=O)N(CCNC1)C1c(cccc1)c1Cl,0 V027-8870,COCCN(CCC(N(CC1)CCN1c(cccc1)c1F)=O)c1c(ccc(Cl)c2)c2nc(C2CC2)n1,0 Z1460846673,Cc(cc1)ncc1NC(Cc1cccc(Cl)c1)=O,0 8019-4110,CC(C)C(CC1(C)C)c2c1ccc(OCc1cc3nsnc3cc1)c2,2 Z3310562518,CC(C)(CN(Cc1nnc(N2CCCC2)o1)CC1)N1C(C)=O,2 Z1874038161,N#Cc1cc(NCCc2cc(Cl)cc(Cl)c2)ncn1,0 Z2965742657,Cn1ncc(CNc(cc2)ccc2C(N2C[C@H](CCC3)[C@H]3C2)=O)c1,2 Z3043528209,CC(C)(C)C(Nc(ccnc1)c1C(N1CC2(COCC2)N(C)CC1)=O)=O,2 F6502-2758,O=S(Cc(cc(cc1)F)c1F)(NCCn1c(C2CC2)ncc1)=O,2 F6678-8762,Cc1nc(cccc2)c2n1C(C1)CN1c1nc(cccc2)c2n1C,2 Z536009464,Cc1n[nH]cc1CNC(N1CCN(CCc2ccccc2)CC1)=O,2 Z1396703415,COc1cc(CN(CC2)CC2Nc(nc2)ncc2Br)cc(OC)c1,0 F6276-1636,Cn(cc1)nc1C(N(C1)CC1Oc1nc(c(OC)ccc2)c2s1)=O,2 F3394-1415,O=C(CSc1nnc2n1c(cccc1)c1cc2)c(cc1)ccc1Cl,2 Z4946453456,CCCCNS(c1cc(NC(C(Nc2cnccc2)=O)=O)ccc1)(=O)=O,2 F1822-0337,CCc1cccc2c1nc(NC(CCOc1ccccc1)=O)s2,2 Z4089406066,Cn1nc(CNC(c2c(-c(cc3)ccc3OC)ocn2)=O)c2c1CCOC2,0 Z4653433220,OC(C(CCC1(CCC1)C1)N1C(C(CC1=O)CN1c1ccccc1)=O)=O,2 F5773-0290,CC(C)NC(Nc(sc1c(cc2)Cl)nc1c2OC)=O,0 Z2770607787,CCOC1(CNc2nn3c(-c4ccncc4)nnc3cc2)CCCC1,2 Z368958060,CC(C(NC1C(C)C(C)CCC1)=O)N(C)Cc(cc1)ccc1C#N,2 F1909-1899,CC(C)(C)OC(N(C1)CC(C2)C1CN2c1c(C(F)(F)F)cccn1)=O,0 F6266-0112,COc1ccc(CCC(N2C3COCC2CC3)=O)cc1,2 F6539-3343,O=S(c(cccc1)c1Cl)(NCc(cc1)ccc1-c1cocc1)=O,0 Y030-7750,Cc(cc(cc1)NC(CCC2CCCCC2)=O)c1Br,0 Z2595679530,CCCC(C(O)=O)n(cc1)nc1NC(c1cnncc1)=O,2 F6442-4295,Cc(nc1oc(-c2ccccc2)nc1c1)c1NC(C1(CCCC1)c1cccs1)=O,2 F6514-2869,O=C(c1nn(-c2ccccc2)nc1)N(C1)CC1OCC(F)(F)F,0 Z954041132,CCOc(ccc(C(C)NC(NCc(cc1)cnc1-n1c(cccc2)c2nc1)=O)c1)c1OCC,2 D064-0364,C(c1nnc2sc(-c(cc3)cc4c3OCCO4)nn12)n1c(cccc2)c2nc1,2 F1605-0039,COc(ccc(C1=NN=C2c(cccc3)c3N(Cc3ccccc3)C=C12)c1)c1OC,2 F228-0698,Cc1c(C)oc2c1c(N(CC1)CCC1C(NC1CCCCCC1)=O)nc(C)n2,2 SB74-0174,CC(C)N(CC1)C[C@@]1(C[C@@H](C(N(CC1)Cc2c1cccc2)=O)N1)C1=O,2 Z288791658,COc1cccc(C(NCCNC(C(CC2CCC3)CC3C2=O)=O)=O)c1,2 S517-1277,CN(CC(N1CCC(Cc2nncn2CC2CC2)CC1)=O)S(c(cc1)cc(CC2)c1NC2=O)(=O)=O,2 F1673-7272,O=C(c(cc1)ccc1Br)N(Cc1ccco1)Cc1ccccc1,2 L678-0438,CCOc1cccc(CN(C(C)(Cc2c3cccc2)C(NCc2cc(OC)ccc2)=O)C3=O)c1,0 S555-1667,O=C(C1CC1)Nc(cc1)cc(C2)c1OCCN2C(NC1CCCCC1)=O,2 Z3727424287,Cc1c(C(NCCc2c[nH]nn2)=O)[nH]c(cc2)c1cc2OC,2 V022-0547,COCCN(CC(COc1ccccc1)O)CC(N1)=Nc(scc2-c(cc3)ccc3OC)c2C1=O,0 F5967-0323,O=C(NCc1cccs1)Nc(cc1)cc2c1OCCC(CCCC1)N1C2=O,2 C464-0926,CCC(N(CC1)c(cc2)c1cc2S(NC(CC(C)C)C(Nc1cc(OC)cc(OC)c1)=O)(=O)=O)=O,0 Z2910683300,Cn(c(C(N(CC1)CC1C(O)=O)=O)cc1c2)c1ncc2Br,0 Z2945517711,Cn1ncc(N(CC(CC2)C(Nc3ccccc3)=O)C2=O)c1,0 V016-4553,O=C(c(cc1)ccc1-c1cc(-c(ccc(Cl)c2)c2Cl)n[nH]1)NCCc1cccs1,2 F6612-0003,O=C(C1CC1)N1c2nc(N3CCOCC3)ncc2CCC1,2 Z4119259729,O=C(c1ccnn1-c1ccccc1)NCCn1nnc(-c2ccccc2)c1,2 Z2297370328,CC(C)(C1CCC1)NC(c1cn(cccc2)c2n1)=O,2 Z1697483552,O=C(c(cc1)cc(CC(c2ccccc2)O2)c1C2=O)N(CC1CCC2=O)c3c1c2ccc3,2 Y043-7292,CC(C)C(C(Nc(cc1)ccc1Cl)=O)NC(NC(CC1)CS1(=O)=O)=O,0 F6764-3292,C(/C=C/c1ccccc1)N1Cc2cc3cccnc3nc2CC1,2 Z2800265028,CCn1ncc(C(N(CC2)c(cccc3)c3N(C)C2=O)=O)c1Br,0 Z145203114,CC(c(cc1)cc2c1OCCO2)NC(c1cc(Cl)nc(Cl)c1)=O,0 Z975248846,CS(N1CCC(CNC(N)=O)CC1)(=O)=O,0 SA93-0314,CCC(CCC1)(CN1C(Cc1c(C)onc1C)=O)C(N)=O,0 SA66-1222,Cn1ncc(C(N2CC(CCc3noc(C4CCOCC4)n3)CCC2)=O)c1,0 Z2146832277,Cn1nnc(C(N[C@H](C2)[C@@H]2c2ccccc2)=O)c1,2 Z819970180,CN(C)C(CC(c1ccccc1)NC(NCCc1ccc(C(F)(F)F)cc1)=O)=O,0 Z2482901691,Cc1cc(CN(C)C(C(O)=O)c2c(C)cccc2)no1,0 G551-0007,CC(c1cccn1CC1)N1C(Nc1cccc(Cl)c1)=O,0 F1441-0022,CCN1CCN(CCC(Nc2c(C(OC)=O)c(C)c(C(OC)=O)s2)=O)CC1,2 D294-5319,O=C(C(C1)CN(CCc2c[nH]c(cc3)c2cc3F)C1=O)NCc(cc1)ccc1Cl,0 S591-0860,COc(cc1)ccc1S(N(C1)CC1N(C1CCOCC1)S(C)(=O)=O)(=O)=O,0 Z2228542456,CNc(cccc1)c1C(N(CC1)CCN1C(CN1CCOCC1)=O)=O,2 Z3709602865,COCC(Nc(cc1)ccc1Nc1cc(F)ncn1)=O,0 Z1159343252,Cc1c(CN(C)S(c2c(C)cc(C)cc2C)(=O)=O)scn1,0 V024-6999,O=C(c(n1CCCc2ccccc2)cc2c1scc2)NC1C(CC2)CC2C1,2 V022-8446,CCC(C(N1CCOCC1)=O)Oc1cc(C(c2ccc(C)cc2)N(CC2)C(C3CC3)=O)c2cc1,2 F6547-0020,Cc1nc(CN2Cc3cc(C4CC4)nn3CC2)cs1,2 Z983240778,O=C(c(cc1)cc(CC2)c1NC2=O)NC1CCSCC1,2 F6471-1082,CS(N(C(CC1)C2)C1CC2NC(CSc(cc1)ccc1F)=O)(=O)=O,2 Z1317839693,CCC(C(CC1)CCC1C(F)(F)F)N,0 G786-0298,O=C(c1cc(N(C(CC2)=O)C2=O)ccc1)Nc(cc1)ccc1-c1nc(cccc2)c2s1,2 F6796-3629,COCc1nsc(N2CC(COc3nnc(CCC4)c4c3)CC2)n1,2 Z1615959416,O=C(c1cc(c(F)c(cc2)F)c2[nH]1)N1CCCC1,0 F6485-1417,Cc1csc(C(NC(CC2)CCC2Oc(nc2)ncc2F)=O)c1,2 E135-0819,CC(CC1)C(CCCC2)C2N1C(C(N1C)=CC(c(cc2)cc(OC)c2OC)=NS1(=O)=O)=O,0 F6178-7849,CSc(cccc1)c1NC(C(NCC(CC1)CCN1C1CSCC1)=O)=O,0 F3318-0213,Cc(cc(cc1)Br)c1NC(C(CCCC1)C1C(O)=O)=O,0 Z2094739118,CCc1ncnc(N(CCC2)C2c2nc(C)no2)c1F,2 Z2394027342,NCCOc(cc1)ccc1NC(CCC(Cc(cccc1)c1N1)C1=O)=O,2 F5788-4001,Cc1cc(C)nn1CCNC(CN(CCN1c(cc2)cc3c2OCCO3)C1=O)=O,2 SA09-0146,CNC(c1c(CCN(CC2)S(c3cn(C)cn3)(=O)=O)n2c(-c2ccccc2)n1)=O,0 F6161-0162,Cc1cc(C(NCCN(C=NC(c2ccccc2)=C2)C2=O)=O)c(C)o1,2 F6490-0754,Cc(cc1)nnc1OC(CCC1)CN1C(Cc1cccs1)=O,2 Z991603056,COc(cc1)ccc1-c1noc(CCC(N2C(Cc3ccccc3)CCCC2)=O)n1,2 E852-3434,CCN(C(C)(Cn(c1c2)nc2C(Nc2cc(C)c(C)cc2)=O)C(NC2CCCC2)=O)C1=O,2 SB59-0667,Cn1c(C2C3(CN(CCCc4ccccc4)C3)CN(Cc3ccccc3)C2)nnc1,2 Z3572177906,O=C(C(C1CCC1)F)NCc1c(-n2c(cccc3)c3nc2)nccc1,2 SB32-0957,CCOc(ccc(CN(C[C@@H]1COC)C[C@@H]1c1nc(-c2ccccc2)n[nH]1)c1)c1OC,0 Z2220728334,CC(C)(c(ccc(C(NCc(cc1)cc(COC)c1F)=O)c1)c1N1)C1=O,0 Z1411692513,Cc1c(-c(cc2)ccc2Cl)oc(CN(CCC2)CC2N(CCN2)C2=O)n1,0 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S896-0163,CCC(CC)N(CC1)CCN1c1nc(-c(cc2)ccc2OC)nc2c1CCOCC2,0 Z1171490047,CCNS(N1CCC(Cc2ccccc2)CC1)(=O)=O,0 V006-7815,CC(C)CNC(c1cccc(CN2c(cc(cc3)C(C)=O)c3OCC2=O)c1)=O,0 Z3686874520,O[C@@H]1[C@@H](CC(NCc2nccc(OC3CCC3)c2)=O)CNC1,2 Z2308466816,CN(C)C(CCC1)CN1C(NCc(cc1)cc(F)c1OC(F)F)=O,0 Y040-2711,Cc1cc(OC(C2=C3CCCC2)=O)c3c(OCC(NCC(N(CC2)CC(CCCC3)C23O)=O)=O)c1,2 V006-5361,CN(C(c(c(F)ccc1)c1F)=O)c(cc1)ccc1-c1c(CCc2c-3cccc2)c3no1,0 Z2947940902,O=C1NCCN(Cc2cn(CCF)nc2)C1c1cccs1,0 Z1286519948,O=C(c1cnc(-c2ccccc2)nc1)N(CC1)CC11CCOCC1,2 Z1984337591,Cc(cc(C(C1CC1)NC(c1cnnn1C)=O)cc1)c1F,0 Z1445385244,CC(C(Nc1cccc(C(N(CCCC2)C2C(O)=O)=O)c1)=O)OC,0 S997-0637,CS(N(C1)C[C@]2(CO)[C@H]1CN(Cc(cc1)cc3c1[nH]cc3)CC2)(=O)=O,2 F6809-6757,Fc(cc1)cc2c1c(C(CC1)CCN1c1nc(cncc3)c3s1)no2,2 F0745-0828,O=C(CCN1CCN(Cc2ccccc2)CC1)Nc(cc1)cc2c1OCO2,2 F6481-0773,CCOC(N(CC1)CCSC1c(cccc1)c1Cl)=O,0 F1787-0070,COC(c(cc(c(OC)c1)OC)c1NC(c(cc1)cc(CC(c2ccccc2)O2)c1C2=O)=O)=O,0 F0578-0123,Clc1cc(N(CC2)CCN2c2ncnc3c2nc[nH]3)ccc1,0 C884-1577,CCC(C(NCCCN(CCC1)C1=O)=O)n1c(C(N(C)N=C2)=O)c2c2c1cccc2,0 Z3403661237,CC(CC(C1)C2CCCCC2)N1C(Nc1cc(C(NC)=O)ccc1)=O,2 F3292-0444,CN(CCc1cc2c3OCO2)C(CC(c(cc(cc2)OC)c2OC)=O)c1c3OC,2 F6435-9063,COC(CSC(CC1)CN1C(Cc(cc1)ccc1F)=O)=O,0 Z2190096543,CC(C)(C(CC1)O)N1C(Nc(cc1)nn1-c1c(C(F)(F)F)cccn1)=O,0 Z2284756552,CC1(CCC1)C(N(CC1)CCN1c1cccc(F)n1)=O,0 Z2089451092,NC([C@H](CO)NC(C(Cc1ccccc1)NC(C1(CC(C2)C3)CC3CC2C1)=O)=O)=O,0 Z2951785388,Cn1ncc(NC(N2C(COC)COCC2)=O)c1-c1ccccc1,2 S233-1713,Cc1noc(C)c1CC(NC[C@](CCC1)(CC2)[C@@H]1N(CC1CCCCC1)C2=O)=O,2 Z3290576038,OCC(CNC(Nc1cccc(C(C(F)(F)F)F)c1)=O)O,0 E002-2421,COc1noc(CCC(Nc2c(C(N(CC3)CCN3c(cccc3)c3F)=O)oc3c2cccc3)=O)c1,2 SB24-0335,CN(C)C(c1cn(C(CC2)C2(CC2)CCN2C(C2CCCCC2)=O)nn1)=O,0 SA53-1026,Cc1n[nH]c(C(CN(CCC2)C(c3ccco3)=O)N2C(c2ccncc2)=O)n1,2 SC72-0373,Cc1noc(C)c1CN(C1)CC11OCc2c1cnc(C1CC1)n2,2 Z2454079901,CCC(NC(C)C(N(CC1)CCN1c(c(F)ccc1)c1F)=O)=O,0 F6089-6502,CCOC(NCC1(CCOCC1)c(cccc1)c1OC)=O,0 F5967-0182,COc(cc1)cc(C(Nc(cc2)cc3c2OCCC(CCCC2)N2C3=O)=O)c1Br,0 Y042-5314,COc(cc1)ccc1N(CC(C1)C(N(CC2)Cc3c2[nH]c(cc2)c3cc2OC)=O)C1=O,0 F6807-5799,CN(Cc1ccccc1)Cc(ccc(C#N)c1)c1F,0 4031-1250,O=C(C(Nc(cc1)ccc1Br)=O)NCc1ccccc1,0 F6571-2823,COc1cccc2c1oc(C(NCC1(CCSCC1)OCCO)=O)c2,2 F6244-2695,COCCNC(NCC#CCN1CCOCC1)=O,0 8019-6617,O=C(CC1c(cccc2)c2OCc(cccc2)c2F)Nc2c1c(CCCC1)c1s2,2 Z2272897657,CCSc1c(C(NCCCC#N)=O)nccc1,0 S515-0564,CCc1cccc(NC(C(Cc2ccccc2)(CCCC2)NC2=O)=O)c1,2 S329-2376,CC(C)CCN(C(CC1)CCN1C(Nc1ccc(C(F)(F)F)cc1)=O)C1CCOCC1,2 SB54-1050,Cc1nccc(C(N(C[C@@H]2COC)C[C@@H]2c2nnc(-c3ccccc3)o2)=O)c1,2 Z1317608679,C(C1CC1)N(CC1)CCN1c1ncc(-c2ccccc2)s1,2 SD01-0131,COCCn(c(CC1)c2CN1C1CCN(Cc3ccccc3)CC1)nc2-c1cocn1,2 Z4924485850,Cc1ccc(C(CNC(CN2N=Nc(cccc3)c3C2=O)=O)N)cc1,2 F6619-2984,CC(Nc(cc1)ccc1S(N(CC1)CCC1N(C1CC1)c1ncncc1)(=O)=O)=O,0 F858-0161,CCCn1nnc2c1ccc(S(N(CCCC1)C1C(Nc1cc(C)cc(C)c1)=O)(=O)=O)c2,0 SD02-0361,CC(C)c1nnc(C(C2)N(CC(N(C)C)=O)CC2(CC2)CCN2C(c2ncc(C)nc2)=O)o1,2 V003-6709,[nH]1cc(c2c1ccc(NC(=O)CO[C@H]1[C@@H](CC[C@H](C1)C)C(C)C)c2)CCN(CC1CC1)CCC,2 Z2225095521,CC(C)C(Nc1nccc(C(N(C2)C(CO)CC2(F)F)=O)c1)=O,0 Z966401404,CC(C)(C)CC(N(CCC1)C1C(NCc1c(-n2cncc2)nccc1)=O)=O,2 F6488-0793,Cc1cc(C(N(CC2)CC2Oc2nccnc2C#N)=O)c(C)o1,0 Z2991013551,OC(CC(O)=O)c(cccc1)c1-c1cc(CCC(CO2)(C3)NC2=O)c3cc1,0 Z2090954120,N#Cc1nccc(N(CC2)CCN2S(c(cc2)cc(N3)c2OCC3=O)(=O)=O)c1,0 F6495-4283,O=C(C(C1)CN1c1ncnc(-n2cncc2)c1)Nc(cccc1)c1F,0 F6677-3520,O=C(C1CC=CCC1)N1CC(Cn2ncc(Br)c2)C1,2 Z4000661853,O=C([C@H](C[C@H]1CC2)C[C@H]2C1=O)NS(c1ccco1)(=O)=O,2 F2827-0106,CC(C)N(C(C)C)C(CSc1nnc(-c2cnccc2)o1)=O,2 CM3473-1468,CN1C(CC2)(CCN2S(c(cc(cc2)F)c2F)(=O)=O)c2nccn2CC1,2 F6240-2687,Fc(cc1)cc(CN2CCN(Cc3nncn3-c(cccc3)c3F)CC2)c1F,2 Z2283450094,CCC(C)OCC(N(CC1)CC1SC)=O,0 S693-1289,Cc1cnc(-c2ccncc2)n1CC(CCC1)CN1S(C)(=O)=O,0 F1775-0033,CC(c1c2cccc1)=NN(c(cc1)ccc1Br)C2=O,0 S952-0334,CC1(CC1)C(N(C1)CC(CC2)(CCN2c(cc2)cc(C(F)(F)F)c2C#N)C1C(NC1CC1)=O)=O,2 F6525-7246,Cc(n(CCNC(C1=CC=CN(C)C1=O)=O)nc1C)c1-c1ccco1,2 Y042-7419,N1(C(c2c(C1=O)nccc2)=O)CCC(N[C@H](c1nc2c([nH]1)cccc2)CC(C)C)=O,0 F5834-2188,O=C(Cc(cc1)ccc1NC(NC(c1ccccc1)c1ccccc1)=O)N1CCOCC1,2 F5860-4829,Cc1noc(C)c1CN(CC1)CCN1S(c(cccc1)c1F)(=O)=O,0 Z1501121653,CN(CC1(CCCC1)O)C(CN(C=CC(N1C)=O)C1=O)=O,2 F6616-2190,O=C1NCCN(Cc(cc2)cc(Br)c2F)C1,0 Z2100065688,CC(N1C)=CC=C(CNC(N2CC(CCC3)CC3C2)=O)C1=O,2 F6789-6429,Cc(ccc(Cl)c1)c1N(CC1)CCN1c1nc(C)nc(C(F)F)c1,0 Z398851708,OC(C(CCC1)CN1C(CC1CC1)=O)=O,0 Z2958382960,Cc1ncc(C(CC2)CCN2C(c2ccc(Cn3nncc3)o2)=O)cc1,2 F5860-0069,O=C(CSCc1ccccc1)N1CCN(CC(F)(F)F)CC1,2 Z2953013170,CC1(COCC1)NC(Nc1cc(Cl)cnc1)=O,0 F2496-3116,Cc1noc(C)c1CCC(OCc1noc(-c(cccc2)c2F)c1)=O,2 F6682-6549,N#Cc1cc(OCC(CCC2)CN2c(ncnc2)c2F)ncc1,0 Z357708654,CCc(cccc1)c1N(CC(C1)C(NCCC(NC(C)C)=O)=O)C1=O,0 L928-0168,O=C(C(CC1)CCN1c1ncnc2c1oc1c2cccc1)N(CC1)CCN1c1cccc(Cl)c1,0 F6554-8449,O=C(c1cc(Br)cs1)N1C(C2)CSC2C1,2 F6773-2799,C(CN(CC1)c2nccc3c2ccs3)C1Oc1nccs1,2 Z1664427289,Cn1ncc(-c2cccc(C(Nc3ccc(CC(O)=O)cc3)=O)c2)c1,0 Z1103034178,CC1=CC=CN(Cc2cn(-c3ccccc3)nn2)C1=O,0 V003-8022,Cc(c(CN(CC(COCc1ccco1)O)CC1CC1)c1Oc2cc(C)ccc2)nn1-c1ccccc1,2 F3406-9160,COc1ccc(CNC(c2cc(-c3ccccc3)ns2)=O)cc1,2 F1143-0895,CCOC(c(c(O)c1)nn1-c1cccc(C(F)(F)F)c1)=O,0 S687-2447,CCc1noc(CC2CC(CC3)(CCN3S(Cc3ccccc3)(=O)=O)OCC2)n1,2 Z1000416476,O=C(CNC(c(cc1)cc2c1[nH]nn2)=O)Nc1cccc2cccnc12,2 Z4521999285,CC(C)CC(NC(C1)C(C)(C)CN1c1cc(-c2cccs2)ncn1)=O,2 S975-0389,C[C@@H](C(N(CCN1CCOC)[C@@H](C2)C1=O)=O)N2S(c1cc(CCC2)c2cc1)(=O)=O,2 F6540-0463,Cc1nc(N(CC2)CCC2N(CC2)CC2O)nc(C)c1,0 E851-1338,O=C(c1c2ncc(CCCCC3)c3n2nc1)NCc1ccccc1,2 F6436-2295,COc1cc([nH]c(C(NCC(CC2)(c3c2cccc3)O)=O)c2)c2cc1,2 F3394-1301,CCOC(c1c(NC(c2cnccc2)=O)scc1-c1ccc(C)o1)=O,2 J031-0315,Cc1c(C(CSc2nnc(-c(cc3OCCCOc3c3)c3OC)n2C)=O)c(cccc2)c2[nH]1,0 Z4949494172,O=C(c1n[nH]c(-c2ccccc2)c1)NC[C@@H](C1)[C@H]1c1cnccc1,2 V017-3222,COc(cccc1)c1Oc1nc(N2CCCCC2)nc2c1CN(Cc1ncccc1)CC2,2 Z2234724786,COCC(CCC1)(C(O)=O)N1S(c(cc1)ccc1Br)(=O)=O,0 F6561-2618,CCOC(CCC(N(CC1)CC1OCC1CC1)=O)=O,2 K261-0310,CC(c(cc1)ccc1N(CC1)CCN1C(CCC(N1)=Nc(cccc2)c2S1(=O)=O)=O)=O,0 Z2227602041,CS(CC(CC1)CCN1C(c1cn(-c(cc2)ccc2Cl)nc1)=O)(=O)=O,0 F2449-0044,O=C(COc(cc1)ccc1Cl)Nc1ncnc2c1CCC2,2 F6803-2453,COc(cn1)cnc1OC(CC1)CN1c(cc1)ccc1S(C)(=O)=O,2 F6444-1666,COC(C(CC(C1)Oc(cccc2)c2F)N1C(C(Oc1c2cccc1)=CC2=O)=O)=O,2 Z4752019652,CN(C)C(C(c1ccccc1)NC(c1nn(cccn2)c2c1)=O)=O,0 P088-2773,O=C(c1cccc2c1CCN2C(Nc(cc1)ccc1F)=O)Nc(cc1)cc2c1OCCO2,2 G756-1610,CC(C=CC1=NC(COc(cc2)ccc2NC(Nc2cccc(C(F)(F)F)c2)=O)=C2)=CN1C2=O,0 F5596-1105,CCOC(N(CC1)CCN1C(CN(CC1)CCC1c1nnc(C(C)C)o1)=O)=O,2 F6415-1542,CCOc(cc1)ccc1NC(N(CCc1cccs1)Cc1cocc1)=O,0 F6512-1852,O=C(C1CC=CCC1)NCc1nc(C2CCCCC2)cs1,2 Z1318847976,CC(c1cccc(OCC(N2CC(Cc3cn(C)nc3)CC2)=O)c1)=O,2 S823-1139,Cn1c(C(N[C@@H](C2)[C@@H](CO)CN2c2ncncc2)=O)ccc1,2 Z2812836979,O=C(c1cn(C2CC2)nn1)Nc(nccc1)c1Cl,2 G373-3745,O=C(N(Cc(cc1)ccc1F)CC1)N1C(CC1)CCN1S(c1cc(F)cc(F)c1)(=O)=O,0 F6564-2348,O=C(CSC1CCCC1)NCCN1N=C(C2CC2)C=CC1=O,2 F6504-0933,Cc1c(CCNC(c2nn(-c3ccccc3)nc2)=O)c(C)nn1-c1ncccc1,2 F0913-4208,CCOC(CC(CSC(N(Cc(cc1)ccc1F)C1=O)=Nc2c1scc2)=O)=O,0 Z2086525517,O=C(C(C1COCCC1)N1)N(CC(CC2)CC2(F)F)C1=O,2 Z2761401768,Fc(c(CNC[C@@H](CC1)O[C@@H]1c1ncn[nH]1)ccc1)c1OC1CC1,2 F5321-0097,Cc(cc1)c(C)cc1NCC(CC(O)=O)c1nc(cccc2)c2[nH]1,0 F9995-0292,CCCCOc(cc1)cc(Oc2c3ccc(O)c2)c1C3=O,2 G793-0074,CCOC(c1c(C)c(CCC(NC(C)(C)C)=O)c(C)[nH]1)=O,0 Z2972728755,FC1(CCN(Cc2nccc3c2CCCC3)CC1)F,2 F6259-1003,Cc(cc1)cc(Br)c1NC(C(CCC1)CN1C(C=C1)=NN(C)C1=O)=O,0 C276-1445,COc(cc1)c(C(C2)C(C(CCC3)=O)=C3NC2=O)cc1Br,0 F6562-7628,COc1cc(C(NC(CC2)C22CCOCC2)=O)cc(OC)c1OC,0 F6604-1564,Cc1nnc(cc2)n1nc2N(C1)CC1N(C)c1c(cc(cc2)F)c2ncn1,2 Y502-6323,CCn1nc(C(N)=O)c(NC(c2noc3c2CC(C)CC3)=O)c1,0 F6559-1152,O=C(Cc(ccc(F)c1)c1F)N(CC1)CC1n1c(cccc2)c2nc1,0 SB36-0141,CNC(c1cn(C[C@H](C2)N(Cc3cc(F)cc(F)c3)CC2(F)F)nn1)=O,0 Z2953104439,CN(C)C(c(cc1)cnc1NC(NC(C1CC1)c1ncccc1)=O)=O,0 F5013-0916,COc1cccc(C(C=C2)=NN(CCCC(Nc(cccc3)c3SC)=O)C2=O)c1,0 F5822-1426,COc(ccc(NC(N1CCC(Cn2cncc2)CC1)=O)c1)c1OC,0 K610-0401,Cc(ccc(Cl)c1)c1NC(c1c(N[C@@H](C[C@@H]2C(F)(F)F)c(cc3)cc(OC)c3OC)n2nc1)=O,0 F6445-6608,O=C(CSc(cc1)ccc1F)NCc(cccc1)c1-c1cscc1,2 Z2493527022,O=C(CN(CC1)CCN1c1ncc[nH]1)N(CC1)CCN1c1ncccn1,2 Z1461839489,Cc1cccc2c1[nH]cc2CCNC(c(cnc(C)c1)c1Cl)=O,0 SB06-1179,COc(cc1)ccc1OCC(N(CC1)CCC11C(CC(N2CCOCC2)=O)CC1)=O,0 Z1429677991,Cc(cc1)ccc1Oc(cc1)ncc1NC(NCCc1ccncc1)=O,2 Z2945529515,Cn1ncc(N(CC(CC2)C(Nc(cc3)ccc3F)=O)C2=O)c1,0 Z1482166544,CCc(nc1)ncc1NC(NC(CC1)CN1c(cccc1)c1OC)=O,2 S726-1409,CCOc(cccc1)c1NC(N(CC1)CCC11OCCC(CCOc2ccncc2)C1)=O,2 F3097-3724,CC(C)(C)c(cc1)ccc1OCCCC(N1CCOCC1)=O,2 Z4949555405,CCC(C(c1ccccc1)=O)NC(C1(C2)C2C1)=O,0 S831-3196,COC[C@@H](CN(C1)C(c2cc3cccnc3cc2)=O)[C@H]1c1ncccc1,2 Z2186082560,CC(CCC1)CN1c1nccc(C(Nc2nn(CCc3ccncc3)cc2)=O)c1,2 E223-0916,CC(Cn(c1c2)nc2-c2cccs2)(C(NCc2ccc(C)cc2)=O)N(Cc(cc2)ccc2OC)C1=O,0 S649-0385,Cc1c(CN(CC2)CCC2N(C2)C3(CCCCC3)C2OCC2CC2)scn1,2 F118-0134,O=C(CN1c(cc(cc2)C(N3CCCC3)=O)c2OCC1=O)NCCCN1CCCC1,2 S606-0391,COCCN(c1c(N2[C@H](CC3)CN3C(c3nccnc3)=O)nccc1)C2=O,0 F6266-0289,CC(C)(C)c(cc1)ccc1S(N1C2COCC1CC2)(=O)=O,2 L537-1136,CC(Nc(cc1)ccc1NC(c1ccc(-c2c(-c(cc3)ccc3F)ncn2C2CCCCC2)o1)=O)=O,2 G213-0071,O=C(c1noc-2c1CCc1c2ccs1)N(CC1)CCN1c1ncccc1,2 E989-0241,Cc1nn(CCCN2C(CCC(N(CC3)CCN3c(cc3)ccc3Cl)=O)=O)c2c1,2 F6523-4471,CSc1ncccc1C(N(CC1)CCN1c1nnc(CCCC2)c2c1)=O,0 V018-0339,Cc(cc1)cc(NS(c2ccccc2)(=O)=O)c1N(CCCN1Cc(ccc(F)c2)c2F)C1=O,0 V017-2696,O=C(c1nn(CCN(Cc2ccc(C(F)(F)F)cc2)C2=O)c2c1)NCCOc1ccccc1,2 SA01-0710,CC(C)NC(c1cnc(N(C)C)nc1C(CC1)CN1C(c1c(C)ccs1)=O)=O,0 SA47-0145,CC1(COC(C2)(CN2C(c2noc(C)c2CN2CCOCC2)=O)C1)O,0 F6789-0633,Cc1c(CN(C)CCc(cc2)ccc2OC)sc(C)n1,2 G680-0452,Cc(n(C(c1cc(CCCC2)c2s1)=O)nc1C)c1S(N(CC1)Cc2c1cccc2)(=O)=O,2 F3111-1602,Cc1cc(C(CSc2nnc3scc(-c4ccc(C)cc4)n23)=O)c(C)n1CCOC,2 V023-5254,Cc1cccc(C(c2c(CC3)ccc(OCC(NCc4ncccc4)=O)c2)N3C(c2ccccc2)=O)c1,2 F6258-1209,O=C(c1cc(cccc2)c2[nH]1)NCCN(C=NC(C1CC1)=C1)C1=O,2 F6261-0737,Cc1c(CNC(Cc2cn(C)c3c2cccc3)=O)sc(-c2cccs2)n1,2 Z3016340910,CC(c1cccc(-n2nnc(C3(CCC3)S(N)(=O)=O)c2)c1)=O,0 Z2441475552,CN(C(C1)CC1N)C(c1ccc(-c(cc2)cc3c2OCCO3)s1)=O,2 F6796-3687,N#Cc1cc(COCC2)c2nc1N(CC1)CCN1c(cc1)nn2c1ncc2,2 Z1247640141,O=C(c1ccncc1)Nc1ccc(CNC(NCc(cccc2)c2OCC2CC2)=O)cc1,2 Z1219825864,CN(C=C(C(Nc1ccc(Cc2ccncc2)cc1)=O)C(N1C)=O)C1=O,2 S688-2250,COCCC1(CCN(CC2CC2)CC1)NC(C1CCC1)=O,2 F6156-0053,COC(c(cc1)ccc1C(N1CC(COc2ccccc2)C1)=O)=O,0 S893-0112,Cc1noc(C)c1S(N(CCC1)C1c1n[nH]c2c1COCC2)(=O)=O,0 Z3308023329,C(c1nnc(N2CCCC2)o1)N1CCN(Cc2ccccc2)CCC1,2 Z1348011751,O=C1NC(c2cncs2)=Nc2c1sc(-c(cc1)cc3c1OCCO3)c2,2 F3386-2891,CCCOc(ccc(Br)c1)c1S(NC(C)CC)(=O)=O,0 V008-9223,COc1ccc(CNC(c2cccnc2N(CC2)CCN2C(c2cccc(F)c2F)=O)=O)cc1,2 Z2407931866,CC(C)(COC)N(CC1)CCN1C(C(CC1)Cc2c1nnn2C)=O,2 F6223-0322,Cc(ccc(F)c1)c1S(Nc1cnc(N(CC2)CCN2c2ncccc2)nc1)(=O)=O,0 Z2330881599,CC(C(NCc(cc1)ccc1F)=O)N(C1)CC(C2)C1CCC2O,2 V017-4429,CCC(C)N(CC(N(CCc(cc1)cc(OC)c1OC)Cc1ccc(C)o1)=O)C(C1CCC1)=O,2 S904-1803,CC(C)C(N1Cc2nnc([C@H](C[C@@H](C3)O)N3C(Cc3cccc(F)c3)=O)n2CC1)=O,2 Y500-9524,O=C(CC(c1c2cccc1)OC2=O)c(cc1)cc2c1OCCO2,2 F6439-3914,CC(C(NCCn(cc1)nc1-c1ccncc1)=O)Oc1ccccc1,2 S740-0732,COCCN(C([C@H](C[C@@H](C1)NC(CCc(cccc2)c2OC)=O)N1CC1)=O)S1(=O)=O,0 Z1832372182,O=C(C(C1)c(cccc2)c2C1=O)Nc1ccccc1,0 G932-0279,Cc1cc(Nc2c(cnn3-c4ccccc4)c3nc(N3CCN(C)CC3)n2)cc(C)c1,0 Z4420810750,Cc1c(C(N(C[C@@H](C2)OC)[C@H]2C(O)=O)=O)sc2nc(C(F)(F)F)ccc12,0 Z2453633418,CC(CC1)=C(C)CC1C(N1c(cncc2)c2SCC1)=O,2 F6573-7316,Cc(cc1)c(C)cc1N(CC(C1)C(N(CCN2c3cnccc3)CC2=O)=O)C1=O,2 Y020-4370,NC(C(CC1)CCN1C(N1)=Nc(nccc2-c3ccco3)c2C1=O)=O,2 Z1272484394,Cc(cc1)nnc1Oc(cc1)ccc1Nc1ncnc(C)c1,0 Z1700225176,NC(C1(CC1)NC(Nc1nnc(-c2ccco2)s1)=O)=O,2 Z1221682076,CN1CCC(CNC(Nc(c(Oc2ccccc2)ccc2)c2F)=O)CC1,2 F3395-1940,O=C(CN1)N(C2CN(CC3Oc(cccc4)c4OC3)C2)C1=O,2 F6793-7002,O=C(CC1Oc(cccc2)c2OC1)N1CCN(CC(F)(F)F)CC1,2 SC67-0154,CC(C)N(C1)CC(CC2)(CCN2S(Cc(cc2)ccc2F)(=O)=O)C1c1nncn1C,0 F6773-4755,Cc1c(C)sc2ncnc(N(CC3)CCC3Oc3nc(C)cnc3C)c12,2 Z2144942167,O=C(CC(CCC1)NC1=O)Nc1cc(-c2cn(CCCC3)c3n2)ccc1,2 S232-1677,CN1[C@@H](CN(CC2)S(c3cccc4nsnc34)(=O)=O)[C@@H]2COCC1,2 Z3484301421,COc(c(NC(c(c(C(O)=O)ccc1)c1[N+]([O-])=O)=O)c1)cc(Cl)c1OC,0 F0745-1084,Cc(cc1)c(C)cc1C(c1c2cccc1)=NNC2=O,0 F6448-1356,O=C(Nc1cn(CC2CCOCC2)nc1)OCc1ccccc1,2 Z1190460159,CC(C)n(cc1)nc1C(N(C)Cc1cscn1)=O,2 F6472-8507,COC(CC1)CCN1C(C1)CN1C(c1ccco1)=O,2 F153-0152,COc(ccc(C(C=C1)=NNC1=O)c1)c1S(N1CCN(Cc2ccccc2)CC1)(=O)=O,0 T854-0904,CC(C)CCN([C@@H](CCCC1)[C@]1(CC1)C(NCCc2cnccc2)=O)C1=O,0 F5033-2491,O=C(NCC(CC1)CCN1c1ncccn1)Nc(cccc1)c1Cl,0 Z2353513974,CC(C)(C)c1noc(-c2cn(C3CNCCC3)nc2)n1,2 F3374-0657,CCN(C=C1C(NCc2ccco2)=O)c(ccc(OC)c2)c2C1=O,2 CM3123-0037,Cc(n(C)c(-c(cc1)ccc1F)c1)c1C(NC(CC1)CN1C(C=C1)=NNC1=O)=O,2 C741-0385,CC(CNC(CCc(n1-c2c3cccc2)nnc1N(CCc1ccccc1)C3=O)=O)c1ccccc1,2 F2392-0570,CC(C)(C)NC(NCC(c1cscc1)N1CCOCC1)=O,0 F3165-1137,CCOc(cc1)ccc1N(C(CS(C1)(=O)=O)C1N1Cc(c(F)ccc2)c2Cl)C1=O,0 F6805-5626,Cc1cnc(CN(CC2)CCC2N(C)c(nc2)ncc2Cl)c(C)c1OC,2 F6562-9027,CCCCOc(cc1)ccc1NC(NCc1nccnc1-c1cscc1)=O,0 Z1763394136,CNC(c1c[nH]nc1-c1cc(cccc2)c2o1)=O,2 F6036-2050,O=S(c1ccc(C(F)(F)F)cc1)(N(C1)CC1c1nc(Cc2ccccc2)no1)=O,2 SA96-0721,CNC(C1C(C2)(CN2C(CCn2cncc2)=O)CN(Cc2ccccc2)C1)=O,0 Z2466934069,OC(COCC(N(CC1)CC1Oc(cc1)cc(Cl)c1Cl)=O)=O,0 Z1885193776,CCn(c(C1CC1)c1)nc1NC(c1coc(C2CCOCC2)n1)=O,2 F6681-9631,O=C(Cc1cnccc1)N1CC(COc2ncccn2)CCC1,2 Z4150747031,COCC(CNC(c1c(cccc2)n2nc1C1CC1)=O)(CO)O,2 J092-0094,CCc(cc1)cc(C2(c3c[nH]c4c3cccc4)O)c1NC2=O,2 F6529-3754,O=C(c(cc1)cc2c1[nH]cc2)N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O,2 F6518-4910,Cn1ncc(S(NCCc(cc2)ccc2-c2ccnn2C)(=O)=O)c1,2 F6679-0232,C(c(cc1)cc2c1OCCO2)N(C1)CC1n1c(cccc2)c2nc1C1CC1,2 Z2353816515,CCCC(CCc1ccccc1)NC(CCN1C(C(C)C)C(O)=O)C1=O,2 Z1190621985,CC(NCc(cc1)ccc1NC(CN(c1c2cccc1)N=CC2=O)=O)=O,0 Z1428043366,Cc1c(C(Nc2cn(C)nc2-c2ncccc2)=O)sc(-c2cn(C)nc2)n1,0 Z4622577795,Cc1c(C(OC)=O)oc(S(Nc2c(C)c(OCc3cc(OC)ccc3)ccc2)(=O)=O)c1,2 Z3782295623,CCc1c(-c2csc(N3CCN(Cc4n[nH]cc4C)CC3)n2)[nH]c(C)c1C(C)=O,2 F6357-0446,C=CCNC(NCC1(CCOCC1)c1cscc1)=O,0 Z1128284985,CNC(C(c1ccccc1)NC(c(cc1)ccc1Oc(cc1)ccc1C(N)=O)=O)=O,2 Z1402511010,CN(C)C(c1nccc(NC(N(CC2)CCC2=Cc(cccc2)c2F)=O)c1)=O,0 Z1251121810,CCn(cc1)c2c1ccc(NC(N1CCOCC1)=O)c2,2 F6555-0642,CS(N(CC1)CCC1C(N(CC1)CC1n1nnc(C2CC2)c1)=O)(=O)=O,2 C200-6983,O=C(Cn(c(cc1)c2cc1F)c1c2N=CN(Cc2ccccc2)C1=O)NCC1OCCC1,0 F6524-5763,Cn1nc(C(NCc2nnc3n2ccc(C(F)(F)F)c3)=O)c2c1cccc2,2 Z1940059806,O=C(c1ccnn1-c1ccccc1)NCCc1csc(-c2ccccc2)n1,2 Z57187575,OCCNS(c(cc1)ccc1Br)(=O)=O,0 Z2483023081,CNC(CC1CCN(Cc(cc(cc2)C(O)=O)c2Cl)CC1)=O,0 F5607-0206,Cc1nc(-n2cncc2)cc(N(CC2)CCN2C(Nc(cc2)cc3c2OCCO3)=O)n1,2 F1301-0108,O=C(C1=COCCO1)Nc1cccc(-c2nc(cccc3)c3s2)c1,2 L810-1172,O=C(C1=CN(c(cc2)cc3c2OCCO3)c(cc(cc2)F)c2S1(=O)=O)N1CCOCC1,0 F6795-5816,Cc1nccn1-c(cc1)nnc1N(CC1)CCN1c(cc1)nn2c1nnc2C(F)(F)F,2 Z2376898307,OC(C(CS(CC1)(=O)=O)N1C(C(CCC1)c2c1cccc2)=O)=O,2 F6411-1921,Cc1ccnn1Cc(o1)nnc1SCC(N(CC1)CCN1c1ccccc1)=O,2 E020-0140,O=C(CN(C1=O)N=Cn2c1ccc2)NCC1OCCC1,2 F6559-1402,O=C(CSC1CCCC1)NC(CC1)CCC1(F)F,2 Z1632692213,CCC(CC1)CCC1N(C)C(C(C1=NN2)=CC=CN1C2=O)=O,2 F6435-9203,COC(CSC(CC1)CN1C(CCc(cc1)ccc1S(C)(=O)=O)=O)=O,0 SC03-0361,COc(cc1)cc2c1[nH]cc2CN(CC1)CCC1OCCc1noc(C2CCOCC2)n1,0 S978-0621,C[C@@H](COc1c(C2)cc(CN(C3CC3)S(C)(=O)=O)cc1)N2C(C1CC1)=O,2 Z1561086561,OCC(N(CC1)CCN1C(N1CCOCC1)=O)=O,0 Z2207451547,CCCCCC(N1CCC(Cc(cccc2)c2C(OC)=O)CC1)=O,0 F6785-7319,CC(C)(C)c(nc1cc2)cn1nc2OCC(CC1)CCN1C(c1cn(C)nn1)=O,2 Z1144328788,CC(c1c(CC2)cccc1)N2C(Cn1nnc2c1cccc2)=O,0 F6471-5362,O=C(NC1CCCCC1)N(CC1)CC1n1nncc1,2 E197-0228,CC(C)(c(cc(cc1)S(N(C)CC(NC2CCCCC2)=O)(=O)=O)c1N1C)C1=O,0 Y204-5248,CCC(C)(C)C(CC1)Cc2c1c(C(N)=O)c(NC(c1ccncc1)=O)s2,2 Z2992193188,CC(C)Oc(ccc(F)c1)c1S(Nc1c(C)onc1)(=O)=O,0 Y503-1246,Cn1ncc(S(N2CCN(CC(Nc3nn(Cc(c(F)ccc4)c4Cl)cc3)=O)CC2)(=O)=O)c1,2 F5689-0075,CN(C(c1ccccc1)=NN1CCNC(C2Oc(cccc3)c3OC2)=O)C1=O,2 SD07-0518,CCCNC(NCc1c(COC(CC2)(CN2C(Cc2c(C)onc2C)=O)C2)n2nn1)=O,2 D468-0921,O=C(CSC(C(CCC1)=C1N1C(CC2)CS2(=O)=O)=NC1=O)c(cc1)ccc1Br,2 Z2002330780,Cc1c(C(N2CCN(C)CCC2)=O)nnn1CCOc(cc1)ccc1F,2 F6666-1681,N#Cc1cc(CNc2cccc3ncccc23)ccc1,2 P806-1149,CC(N(CC1)CCC1C(NC(CCC1)CN1c1cc(-c(cc2)ccc2OC)n[nH]1)=O)=O,2 F1016-0291,O=C(CSC1CCCCC1)Nc(cc1)ccc1Br,0 Z2961650283,OC1(CC(CCCC2)N2C(c2cc3cccn3cn2)=O)CCCCC1,2 Z2489740483,Cc1cc(C(NC(CC2C(O)=O)c3c2cccc3)=O)ncn1,0 Z1900388332,O=C([C@H](C1)[C@@H]1c(s1)ccc1Cl)NCc1csc(CNC(c2ccccc2)=O)n1,2 F6420-0582,CC(C(NCC1(CSCC1)OC)=O)Oc1ccccc1,0 Y042-7249,c1(nc2c([nH]1)cccc2)[C@H]1N(C(Cc2cc3OCCc3cc2)=O)CCC1,2 F5832-9693,O=C(NCCc1csc2nc(-c3cc(F)ccc3)nn12)Nc1c(C(F)(F)F)cccc1,2 ZC43-0054,CC(C)C(N(CC1)C(C(CC2)CCN2C(COc2ccccc2)=O)c2c1nc[nH]2)=O,2 SB47-0646,Cc1n[nH]c([C@@](CN(C2)C(c3ccccc3)=O)(C3)[C@@H]2CN3C(c2cncnc2)=O)n1,2 Z982160278,C1Cc2nnc(-c(cc3)cc4c3OCCO4)n2CC1,2 Z1352872806,Cc1nc(C(CCC2)N2C(NC(C2)C2c2ccccc2)=O)no1,2 G017-0340,O=C(C1CCC(CNS(c(cc2)cc(CCC3)c2NC3=O)(=O)=O)CC1)NCc1cccs1,2 Z90993544,N#CCc(cc1)ccc1NC(c1cnccc1)=O,0 Z2227260403,Oc(cccc1CN2C[C@@H](c(cc3)ccc3Cl)OCC2)c1Cl,0 Z2974956488,NC(c1cc(N(CCC2)C2c2cc(Br)cnc2)ncn1)=O,0 Z1419931868,CCNC(N(CC1)CC1Nc1nc(C)nc(C)c1)=O,2 Z3590543506,Cc(c(C(Nc1cc(C(N)=O)ccc1)=O)ccc1)c1F,0 S932-7535,O=C(CCC1CCCC1)N(CC1)CC1n1nnc(COCc2ccccc2)c1,2 SB27-0012,Cc1noc(C)c1Cc1ccc(C(N(CC2)CCC2N(C2)C3(COCC3)CNC2=O)=O)o1,2 SA22-0961,CS(N(C1)CC1N(CC(C1)(F)F)[C@@H]1C(N1CCOCC1)=O)(=O)=O,2 Z852069514,OC(CCC(CCC1)CN1C(C1=CN=C2SCCN2C1=O)=O)=O,0 T955-0356,O=C(NC1CCCCC1)N(CCC1)CC1c1nc(CCOc(cc2)ccc2F)no1,2 Z3842716323,CN(CC(CC1)CS1(=O)=O)C(c1cc(C(F)(F)F)nn1C1CC1)=O,2 Z1444032143,CC(C)C(c1nc(cccc2)c2[nH]1)NC(c1cc(C(O)=O)ncc1)=O,0 F5913-0446,O=C(CN(C=NC(c1cccs1)=C1)C1=O)N(CC1)CCN1c1ncccn1,2 F6660-4161,CC(C)(C)OC(N1CCN(CC(c(cc2)cc3c2OCO3)O)CC1)=O,2 SC21-0031,CCn(c(CC1)c2CN1C(NCc1ccccc1)=O)nc2-c1ncc(C)n1CC1CC1,2 S970-0407,O=C(c1n[nH]c2c1cccc2)N(CC(C1)(F)F)[C@@H]1c1nncn1CC1CC1,2 Z2976529637,C[C@@H](C1)[C@@H](CS(N)(=O)=O)CN1c1ncncc1C,0 Z3670224907,CCC(C(C)O)NC(c1c(-c2nn(C)cc2)[nH]nc1)=O,2 C618-0846,Cc1cc(cccc2)c2n1C(Cn1ncc2c1-c(cc(C)cc1)c1OC2=O)=O,2 F6755-2256,C(C1)CC1N(CC1)CCN1c1nccc2c1ccs2,2 E941-0153,Cc1ccc(ccc2c3[nH]c(C(N(CC4)CCN4C4CCCCC4)=O)c2)c3n1,2 Y043-4169,CCn1nc(C)c(CCC(Nc2cc(C)nn2C(CC2)CS2(=O)=O)=O)c1C,0 L517-0254,O=C(C(CC1)CCN1C(Nc(ccc(F)c1)c1F)=O)NCc1csc(-c2ccccc2)n1,2 SA01-1035,CN(C)c(nc1)nc(C(CC2)CN2C(C2CCC2)=O)c1C(NCCOC)=O,0 F6739-7721,CN(Cc(cc1)cc2c1OCCO2)c1nc(C2CC2)ncc1,2 Z1148032021,CC(C)OC(CC1)CCN1C(C(CCC1)CN1C(CCOc1ccccc1)=O)=O,0 Z3277843016,CC(C)(C1)c(cc(cc2)S(NCCc3nnc[nH]3)(=O)=O)c2NC1=O,2 Z1608422663,O=C(c(cc1)ccc1Cl)Nc(cc1)cc2c1nc(-c1ncccc1)o2,2 Z2949701075,Cc1cc(Cl)ncc1NC(N(C1)CC1(C1CC1)F)=O,0 Z1449923063,Fc(ccc(CCN1CC(CN2CCCC2)CC1)c1)c1F,2 F6178-4509,COc(ccc(Cl)c1)c1NC(NCC(CC1)CCN1c1ncccc1C#N)=O,0 F6521-9343,COC(CNC(c(cccc1)c1Cl)=O)(C1)Cc2c1cccc2,0 Z4180225387,COc1cc(C(CNC(NCc2cc(CN(CCC3)CC3C(N)=O)ccc2)=O)O)cc(OC)c1,2 Z1412311383,OC(CNC(NC(CC1)Cc2c1cn[nH]2)=O)c1cscc1,2 F6436-0282,Cc(onc1)c1C(NCC1(CC1)c(cc1)ccc1F)=O,2 SB05-0005,O=C(NC1CCCCC1)N1C[C@@H]2n3c(-c(cc4)ccc4F)nnc3CCC[C@@H]2C1,2 SB70-0819,O=C(c1nn(C[C@H](C2)NC(c3n[nH]c(C4CC4)c3)=O)c2c1)NCc1ccccc1,2 Z3063545010,CC1(C(CC2)CC2C1)C(N1CCC(Cc2ccn[nH]2)CC1)=O,2 F6726-4586,COc(cc1)ccc1-c(ncnc1N2CCN(Cc3nc(CCC4)c4s3)CC2)c1F,2 F6734-0235,Cc1c(C(N(C2)CC(C3)C2CN3c2nccc(C(F)(F)F)n2)=O)c(C)nn1C,0 Z2703536802,Clc1cc(-c2nc(CN3CCN(CC4COCC4)CC3)co2)cc(Cl)c1,2 C430-5002,CCOc(cc1)ccc1N(C(c1c2cccc1)Nc1cc(OC)cc(OC)c1)C2=O,0 Z3337250068,NCC(CC1)CCN1c1cncc(OCC2CCCC2)n1,2 F6734-1416,FC(c1cccnc1N1CC(CN(C2)c(cc3)ncc3F)C2C1)(F)F,0 F6472-7116,Cc1nn2c(CCN(C3)C(c4cc(-c(cc(cc5)OC)c5OC)nn4C)=O)c3cnc2c1,2 Z2255345115,O=C(CNC([C@H](CCCC1)[C@H]1c1ccccc1)=O)Nc1cnccc1,2 SC09-0346,C[C@@H]1N(Cc2c(C)onc2C)Cc(cc(cc2)-c3cncnc3)c2OC1,2 Z2234636094,CN(c1cccc2cccnc12)S(N1CCOCC1)(=O)=O,0 F6502-9155,Cc1cc(CCNC(c2cc(cccc3)c3s2)=O)nn1C,2 G632-2075,CC(C)CC(C(N1CCN(C)CC1)=O)NS(c(cc1)cc(C=C2)c1NC2=O)(=O)=O,2 D531-0412,O=C(C(S(c1c2cccc1)(=O)=O)=C2NCC1OCCC1)Nc(ccc(F)c1)c1F,0 F6443-9797,O=C(c1ccc(Cn2cncc2)cc1)NC(CC1)CN1c1ncc(C(F)(F)F)cc1,2 SB55-0522,CC(C)Cc1nc([C@@](CCC2)(C3)[C@@H]2CN3C(NCC(C)C)=O)no1,0 Z4912609758,Cc1cc(Br)c2oc(C(N[C@H](CCCC3)[C@H]3O)=O)cc2c1,0 S649-0914,O=C(C1(CC1)c1ccccc1)N(CC1)CCC1N(C1)C2(CCOCC2)C1OCC1CC1,2 Z1473716908,CN(C1CC(CC2)NC2C1)C(CCc1ccncc1)=O,2 F6516-0869,CC(C)c1nc(S(NCc2ccc(-c3ccco3)o2)(=O)=O)cn1C,2 SB95-0726,Cc1noc(C)c1C(N(CCC1)CC1N(CCN1CCCC1)C(C1CCC1)=O)=O,2 F6517-1696,OC(CNC(C1(CCCC1)c1cccs1)=O)c1ccc(-c2ccco2)s1,2 Z2996552813,COc(cc1)cc(OC)c1-c1noc(CN(CCC2)C22CNCC2)n1,2 Z1690138751,COc1noc(C(NC(CC2)CCN2C(c2ccccc2)=O)=O)c1,2 S615-0576,CS(N(CC1)CC1c1nc(CCOCC2CCCC2)no1)(=O)=O,0 F6676-1135,Cc1nccc(OCC(CC2)CCN2S(Cc2cc(F)cc(F)c2)(=O)=O)c1,2 Z4521690937,O=C(C(N=C(C1CC1)N1)=CC1=O)N(CCC(C1)N2)C1C2=O,2 Z2936914449,CCOc1cc(N(CC2)CC3(CO)N2CCOC3)ncn1,0 F6753-2720,Cc1cnc(N(CCC2)CC2C(N2CCOCC2)=O)s1,0 Z3485389288,Cc(c1cccnc11)ccc1S(N)(=O)=O,0 F6471-1030,Cc1cccc(CC(NC(CC2CC3)CC3N2S(C)(=O)=O)=O)c1,2 Y040-5156,CS(N1CCN(CC(COc(cc2)cc(O3)c2C(CCC2)=C2C3=O)O)CC1)(=O)=O,2 F6748-6067,O=C(C(CC1)N2CC(COc(nc3)ncc3Br)CCC2)N1C1CC1,2 Z2093061330,CC(C(NC1CC1)=O)N(CC1)CCN1C(C(NC(C1)COc2c1cccc2OC)=O)=O,2 Z1081884546,CC(NC(CC(N1C(CN2CCCCC2)CCC1)=O)c(cc1)ccc1Cl)=O,2 C481-1843,O=C(C(c1ccccc1)NS(c1cccc2nsnc12)(=O)=O)NCC1Oc(cccc2)c2OC1,2 F3406-6549,CN(c1ccccc1)S(c1nn(Cc(c(F)ccc2)c2Cl)cc1C(OC)=O)(=O)=O,2 Z4910857851,Cc(c(C)c1)cc2c1ncn2Cc1cn(-c(cc2)cc(CN3C(CCC(N4)=O)C4=O)c2C3=O)nn1,2 Z1441315086,CN(CCC1)C(CC2)C1CN2C(c(cccc1)c1N1CCCCC1)=O,2 F6747-5825,CC(C)c1nccn1CC(C1)CN1c1nccc2c1ccs2,2 Z813036354,O=C(Nc1ccncc1)N(CCC1)C1c1nc(cccc2)c2[nH]1,0 Z1783824615,CCOc(cc(Cc1noc(C(C2)(Cc3c2cccc3)O)n1)cc1)c1OCC(F)(F)F,0 Z2700683560,CC1(c2nc(-c(cc3)cc(F)c3OCCOC)no2)Oc(cccc2)c2OC1,0 J031-0514,Cc(cc1OCCCOc1c1)c1C(NC1CCCCC1)=O,0 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F5831-7036,O=C(NCC1CCN(Cc2cccs2)CC1)Nc1cccs1,2 Z2434048326,N#Cc1c(N(CCC2)C2C2COCCC2)nc(C(F)(F)F)cc1,0 Z2911877062,CC(C)(C)Cc1csc(NC(Cn(cc2)nc2C(O)=O)=O)n1,0 F3366-5752,CC(CNc(cccc1)c1N1Cc(cc2)ccc2Br)C1=O,0 Z1349139984,Cc(c(C)nc1ncnn11)c1Oc(cc1)ccc1-c1ccccc1,2 Z4475764863,CC(N=C(N1)N(CCC2)CC2NC(C(CC(C2)O)N2C(Cc(cccc2)c2F)=O)=O)=CC1=O,2 Z928328440,CC(C)c1noc(CCC(NCCCC(O)=O)=O)n1,0 T409-0467,CC(CC1)CCN1C(C(CC1)Cc2c1nc(N(CC1)CCN1C(C1CCC1)=O)s2)=O,0 F6472-7488,Cc1nn2c(CCN(C3)S(CCCOc4ccccc4)(=O)=O)c3cnc2c1,2 Z647312978,OC(CC(C(CC1)CCN1C(C1CCN(CC(F)(F)F)CC1)=O)c(cc1)ccc1F)=O,0 Z2851965723,O=C1NCCNC(C2)(CN2c2ncnc3c2cc[nH]3)C1,2 SB66-1156,O=C1N(Cc2ccccc2)[C@@H](CN(C2)S(Cc(cccc3)c3Cl)(=O)=O)[C@@H]2CCC1,0 Z4667573419,CNC(c1n[nH]c(-c2ccncc2)c1)=O,0 F6619-6195,Cc1nc(CN(CC2)CCN2c2ncnc(N3CCOCC3)c2)cs1,2 Z2378679010,CC(C)CC(NC(C(C)C)C(Nc1ncc(C2CCNCC2)s1)=O)=O,2 S696-0468,CCn1nccc1C(N1CC(Cn2c(C3CCOCC3)ncc2C)C1)=O,2 C276-1330,COc(cc1)cc(C(C2)CC(NC(CC3c(cc4)cc(OC)c4O)=O)=C3C2=O)c1OC,0 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Z3071559300,CN(CC1)CCN1c1nc(CCN(C2)C(N3CCOCC3)=O)c2cn1,2 F2992-0131,CSc(cccc1)c1C(Nc(scc1)c1-c1nc(cccc2)c2s1)=O,2 Z4135141334,CC(c1noc(-c2cn(C)nn2)n1)Oc(ccc(Br)c1)c1Cl,2 Z4089407483,Cn1nc(CNC(c2c(-c(cc3)ccc3F)ocn2)=O)c2c1CCOC2,0 F6573-4221,CC(C)(C(NCCOCCN(C(CC1)=O)C1=O)=O)Oc(cc1)ccc1Cl,0 D116-0218,O=C(CN(C(c1c2cccc1)=O)C2=O)n1nc(-c2cnccc2)nc1NCc1cccs1,2 Z3772485566,CC(C)CN(CC(NC)=O)C(c1cccc(-n2c(SC)ncc2)c1)=O,0 F6438-1234,Cc1nc(CNC(c(cc(cc2)Cl)c2OC)=O)nc(N(C)C)c1,0 D470-1714,O=S([C@@H](CS(C1)(=O)=O)[C@H]1NC1CC1)(c1ccccc1)=O,0 Z4521113068,O=C([C@H](C1)[C@H]2O[C@@H]1[C@H]1[C@@H]2C1)N(C1)C[C@@H](C2)[C@H]1CCN2C(c(cc1)nc(N2)c1OC2=O)=O,2 L566-0308,CC(CCC1)(CN1C(Nc(cc1)cc(Cl)c1F)=O)C(NCc(cc1)ccc1F)=O,0 Z752682852,CC1CCN(CC(CC2)CCN2C(NCc2cc(C(NC)=O)ccc2)=O)CC1,0 Z2966300668,CC(C)(c(cc(cc1)C(NCc2c(C)nc3n2cccc3)=O)c1N1)C1=O,2 K288-0402,CN(CC1)CCN1C(c(cc1)cc(NC(N2CCC3=CCCCC3)=S)c1C2=O)=O,2 Z3989991162,Oc1cccc(NC(c2nccc(-c3cnc4[nH]ccc4c3)c2)=O)c1,0 F6724-5042,Brc1cnc(NCc2cc(-c3cocc3)cs2)nc1,2 F6448-1368,O=C(Cc(ccc(F)c1)c1F)Nc1cn(CC2CCOCC2)nc1,0 F5027-0099,O=C(COc1cc2ccccc2cc1)NCC(N1CC(c2ccccc2)OCC1)=O,2 Z4407849934,C[C@H](CN(C1)C(c2cn(C)nc2)=O)[C@H]1n1nnc(-c(cc2)ncc2C(O)=O)c1,0 F6725-1146,Cn1c(N(C2)CC2N(CC2)Cc3c2scc3)nc2c1nccc2,2 C712-1044,O=C(c1cc(COc2c-3cccc2)c3s1)Nc(cc1)ccc1Oc1ccccc1,2 Z828842020,COCCN(CCC1)CCN1C(c(cccc1)c1C(c(cc1)ccc1F)=O)=O,2 Z3206110076,Cc1c(C(C(N[C@@H](C2)CN(C)C2=O)=O)(F)F)cccc1,0 C430-0423,O=C(c1c(C2Nc3cccc(C(F)(F)F)c3)cccc1)N2c1cnccc1,0 8017-4000,CN(c(ccc(S(NC(CCC1)c2c1cccc2)(=O)=O)c1)c1N1C)C1=O,2 Z1767656190,O=C(CCc1cccc(F)c1F)N(CCC1)CCN1C(C1CC1)=O,2 F6724-4702,COc1cc(CCCC2(CNc3nc(cccc4)c4o3)O)c2cc1,2 Z647209914,O=C(CN(c(cccc1)c1N1)C1=O)Nc1c[nH]nc1,2 F1218-1265,CC(c(cc1)ccc1NC(c1cn(-c2ccccc2)nc1-c1ccc(C)cc1)=O)=O,0 F6557-0519,CCOc(ccc(S(N(CCC1c2cccs2)CCS1(=O)=O)(=O)=O)c1)c1F,2 Z3047555427,OCC1CCN(CC(NCc2c3OCOc3ccc2)=O)CC1,2 SC96-1389,COCC(N(CC1)CC2(COCC2)N(CC2CC2)C1=O)=O,0 F5971-1046,COCC(CNC(c(c(F)ccc1)c1F)=O)(c1ccccc1)O,0 L629-0561,CC(C(CC1)CCN1S(c1cccs1)(=O)=O)C(NCCN1CCOCC1)=O,2 F3244-0230,COC(c(cc1)cc(NC(C2=Cc(cccc3)c3OC2)=O)c1C(OC)=O)=O,0 Z3016339118,COCC1(Cc2nc(Cc(c3ncccc33)ccc3Cl)no2)CC1,2 F5854-4137,O=C(CSCc1ccccc1)N(Cc1cscc1)C1CC1,2 Z2806641215,CNC(NCC(C1)OCCN1C(NCC1(CCC1)c1ccccc1)=O)=O,0 Z2352632791,CC(C(O)=O)c1cccc(NC(c2cc(CCC3)c3cc2)=O)c1,0 Z1459994185,OC(CCN(C1)Cc2c1cccc2)=O,0 Z2636118291,CC(CN1CCN(C)CC1)(CC1)CCN1C(c1ncc(Cc2ccccc2)o1)=O,2 Z2801650045,O[C@H](C1)C[C@H]1C(N(CC12CCOCC2)C1c1ccccc1)=O,2 Z641420648,CC(c(cc1)ccc1-n1ncnc1)NCC(c(c(F)ccc1)c1F)O,0 Z1533545062,CC(Cc1nc(-c2ccccc2)no1)NC(c(cc1)cc(F)c1F)=O,0 F6436-1970,O=C(CCc1ccc(C(F)(F)F)cc1)N(CCc1cccs1)C1CC1,0 Z2628298262,CC(C(N(CCN1CCCC1)Cc1ccccc1)=O)n1c2ncnc(N)c2nc1,2 F5788-2073,O=C(CN(CCN1c(cc2)cc(F)c2F)C1=O)N(CC1)Cc2c1cccc2,0 F5957-0223,Cc1cc(C)nn1CCNC(NCc1cccs1)=O,0 F5033-1421,Cc1cc(CN2CCC(CNC(C3c(cccc4)c4Oc4c3cccc4)=O)CC2)c(C)o1,2 F5098-0573,O=C(c1ccco1)N(CC1)c2c1ccc(NC(c1cc3ccccc3cc1)=O)c2,2 Z1818225153,Cc1cccc(CC(CO)NC(C(Cc2ccc3)Oc2c3F)=O)c1,2 F6567-8846,CC(C(N(C1)CC(C2)C1CN2c1ncnc(C)c1)=O)n1nccc1,2 Z2201259302,Cc1c(C(CC2)CCN2C(NC(CC2)Cc3c2[nH]cn3)=O)ccc(F)c1,2 F3351-0358,O=C(CCCCCN1N=Nc(cccc2)c2C1=O)Nc1ccc(C(F)(F)F)cc1,0 Y501-1618,CCn1ncc(C(c2c(CC3)c(cc(cc4)OC)c4[nH]2)N3C(NC2CCCCC2)=O)c1,2 F5857-2347,COC(c(cc1)ccc1C(NCC(c1cccc2ccccc12)O)=O)=O,0 Z2000564385,CCOc1cccc(S(N(CC2)CCC2(C)C(O)=O)(=O)=O)c1,0 SA92-0245,O=S(Cc(cc1)ccc1F)(N(CCC1)CC1(c1nc(-c2ccncc2)no1)F)=O,2 SD69-0534,CC(C)C[C@@H](Cn1nnc(C(Nc2cccn3nc(C4CC4)nc23)=O)c11)NC1=O,2 2613-0012,OC(CC#CCN(CC1)CC1c1ccccc1)(c1ccccc1)c1ccccc1,2 Z1192848791,Cc1nn(C)cc1C(NCCc1coc(-c(cc2)ccc2OC)n1)=O,0 C779-1240,CCn(c(C(N(CC1)CCC1C(NC(C)c(cc1)cc2c1OCCO2)=O)=O)c1)c2c1scc2,0 F3394-0484,Cc1nc(CSc2nc3ccccc3c(C)c2)cs1,2 SA02-0196,Cc1c(CN2CCCC2)c(C(N(CC2)CCC2c2nc(C)ncc2COC)=O)no1,2 F6670-5140,O=C1N(CC(CC2)CCN2c2nc(cncc3)c3s2)C=Nc2c1ccc(F)c2,2 Z1317639144,CC(C)[C@@H](CO)NC(C)c1cccc(OC)c1,0 S069-4119,CCn1ncc(S(N(CC2)CC2c2noc(-c3ncccc3)n2)(=O)=O)c1,2 F312-0084,O=C1Oc(cccc2)c2C=C1S(N(CC1)Cc2c1cccc2)(=O)=O,0 V008-0334,CC(C)c(cc1)ccc1S(N1CCC(CCc2ccc(C(F)(F)F)cc2)CC1)(=O)=O,0 F5668-0786,Cc(cc1)cc(C)c1N(CC(C1)c2nc(C3CC3)no2)C1=O,0 SB32-0125,Cc1n[nH]c([C@@H](C2)[C@@H](COC)CN2C(C2(CC2)c2ccccc2)=O)n1,2 F6482-6931,COc1cccc2c1oc(C(NCc1cc(-c3cscc3)ncc1)=O)c2,2 Z2607801475,CC(C(O)=O)(c1ccccc1)NC(c1c(CCC2)n2nc1)=O,0 F6677-3828,Brc1cn(CC(C2)CN2c2nc(cncc3)c3s2)nc1,2 F6481-4359,O=C(Cc1cc(C(F)(F)F)ccc1)N(CC1)CCSC1c1cccs1,0 SC70-0888,COCCc1nc(C(C2)C3(CCC3)CN2S(Cc(cccc2)c2Cl)(=O)=O)n[nH]1,0 Z2954803898,CC(C)(C1)N(CCO)CCN1C(Nc1ccc(C(F)F)cc1)=O,0 Y041-6972,CN(C)CCCNC(c(cc1)cc2c1[nH]c1c2CCCCC1)=O,0 Z2090627889,Cc1nsc(N2CCN(Cc(cccc3)c3OC)CC2)c1C#N,2 Z2396454109,Cn1c(C(NC[C@@H](CC2)O[C@@H]2c2nc(C3CC3)n[nH]2)=O)cnc1,2 F6491-0530,COC(c(cc1)ccc1S(N(CCC1)CC1Oc1nccnc1)(=O)=O)=O,0 Y080-0467,Cc1cc(Cn2c(cccc3)c3nc2C(C2)CN(C)C2=O)c(C)cc1,2 Z2788543615,O=C1N(Cc(ccc(F)c2)c2F)C=Nc2c1cnn2C1CCNCC1,0 8009-1306,CC(C1(CCCCC1)O1)(C=C(C2(CCCCC2)O2)N(CC3)C2=O)N3C1=O,2 F6178-5767,O=C(CN(c(cccc1)c1O1)C1=O)NCC(CC1)CCN1c1nc(cccc2)c2o1,2 F6445-3319,Cc1nn(cc(CCCNS(c(cc(cc2)Cl)c2OC)(=O)=O)cn2)c2c1,0 Z2146873050,O=C(Cn(cc1)nc1NC(C1(CCCC1)c1cnccc1)=O)N1CCOCC1,2 F2382-0162,CCn(cc1C(NCCCn2cncc2)=O)nc1OCC,2 Z1941421942,CC(Nc1cccc(CNC(c(c2c3)c[nH]c2ncc3Br)=O)c1)=O,0 F6514-9119,Cc1csc(C(NCc2c(-c3cnccc3)nccc2)=O)c1,2 F5490-1254,Cc1cc(-c2cnc(NC3CCCC3)nc2)cnc1,2 F1736-0161,Cc1ccc(CCC(Nc(cc(c(OC)c2)OC)c2C(OC)=O)=O)o1,0 F6727-8530,N#Cc(nccc1)c1N(C1)CC1N(C(C=C1)=O)N=C1c1cccc(F)c1,2 F6558-0376,CC(C)(C)C(CN1)C(C(NCc2c[nH]c3c2cccc3)=O)C1=O,2 F6539-3051,CN(C)C(N1CCC(CNC(Nc2cccc(Cl)c2)=O)CC1)=O,0 F677-0187,CCN(c1ncccc1N=C1N(CCC2)CC2C(NCCCN2CCOCC2)=O)C1=O,2 8191-1226,O=C(CC(C1=O)Nc(cc2)ccc2N2CCOCC2)N1c(cc1)cc(C(F)(F)F)c1Cl,0 J037-0055,CC(C(Nc1c(C)ccc(C)c1)=O)Sc1cc(C)c(cc(cc2)S(N3CCCC3)(=O)=O)c2n1,2 S932-3280,O=C(COc1ccccc1)N(CC1)CC1n1nnc(COc2ccccc2)c1,2 Y020-6260,CN(C(CC1N(CCc2c3[nH]c4c2cccc4)C3c(cc2)ccc2Cl)=O)C1=O,0 SB18-0238,CCC(N(C[C@H](C1)NC(C2CCOCC2)=O)[C@@H]1c1nc(C)n[nH]1)=O,2 Z2011683341,CC(Nc1cc(NC2[C@H](C3)[C@H]3CCC2)ccc1)=O,2 SA87-0238,Cc1noc(C)c1Cc1ccc(C(NCC(CN2CCc3ccccc3)OCC2=O)=O)o1,2 E793-3983,Cc(cc1)cc2c1OCCN2C(CSC(N(CCc(cc1)ccc1Cl)C1=O)=Nc2c1scc2)=O,0 J004-1317,CC(C)c1cc(C(CCC2)N2C(c(c(F)ccc2)c2F)=O)no1,0 S352-0350,O=C(c1cccs1)N(CC1)CCN1C(c1c(COC(C2)c(cc3)ccc3Cl)n2nn1)=O,0 F6760-5450,Cc1cnc(C(N(CC2)CCN2S(C2CC2)(=O)=O)=O)c(F)c1,2 Z2298516569,O=C(C(CCC1)c2c1[nH]nc2)NC1(Cc2cccc(Cl)c2)CC1,2 Z2963742427,O=C(c1ccc(COc(cc2)ccc2F)o1)N[C@]1(C2)[C@@H]2CCC1,2 Z1550591974,COC([C@H](Cc1c[nH]cn1)NC(C(C(c1c2)=O)=CN(C3CC3)c1cc(Cl)c2F)=O)=O,0 SD07-0953,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(COC)=O)C2)n2nn1)=O,0 V006-2464,CCC(N(CC1CC1)C(C)C(c1c(C)[nH]c(C(OC)=O)c1C)=O)=O,0 Z1603418849,CCn1c(cccc2)c2c(C(NC2(CC(O)=O)CCOCC2)=O)c1,0 Z1946260396,O=C(NCc1ccccc1)N[C@@H]1CNCCC1,0 SB49-0761,Cc1noc(C)c1CCC(N(CCCC12CCOCC2)C1C(N1CCCC1)=O)=O,2 Z241807350,O=C(c([nH]c1ccc2)cc1c2OC(F)F)NC1CC1,0 F2493-3422,Cn(cc1C(NCc2noc(-c3ccco3)c2)=O)nc1OC,2 F2902-0586,CS(N(CC1)CCC1C(NCCn1ncc2c(N3CCCC3)ncnc12)=O)(=O)=O,2 F6713-0150,Cc(s1)ccc1S(N1CCC(COc2nnc(C)cc2)CC1)(=O)=O,2 Z1529434018,Cc1ccc(-c2nc(C(N(CC3)CCN3C3CCCCC3)=O)cs2)n1C,2 SD22-0975,COC1(CC1)C(C1)(CN1C(c1n[nH]c2c1cccc2)=O)NC(c1ccccc1)=O,2 Z2639397287,Cn(cc1)nc1C(NCC1(CNC(c2nn(C)cc2)=O)CCOCC1)=O,2 F0665-0094,Cn1c(SCc(c(F)ccc2)c2Cl)nnc1CN(c(cccc1)c1S1)C1=O,2 F5831-7506,CN(C)c1cccc(C(NCc2cscc2)=O)c1,0 SA16-0828,Cc1noc(C)c1CC(N(CC1)CCC1c1nnc(CC(N2CCCC2)=O)o1)=O,2 F6359-1102,O=C(NCc1cccs1)N(CC1)CCC1Oc(nccc1)c1Cl,0 P314-1165,Cc1cc(N(CCC2NC(c3cc(F)cc(F)c3)=O)C2=O)cc(C)c1,0 F5017-2984,Cc(c(C)c1)cc(C)c1S(NCC(CC1)CCN1C(c(cccn1)c1SC)=O)(=O)=O,0 Z2646317450,CN(CCN(CC1)C(CCC(N2)=Nc(cccc3)c3C2=O)=O)C1=O,2 F3411-8229,O=C(c(cnc(c1c2)ccc2F)c1Nc(cccc1)c1Br)N1CCOCC1,2 F0676-1162,Fc(cc1)ccc1-c1nnc(cc2)n1nc2SCc1csc(-c2ccccc2)n1,2 F3406-6427,COc(ccc(NC(C(CC1)CCN1c1ncnc(OC)c1)=O)c1)c1OC,2 F6178-5846,O=C(NCC(CC1)CCN1c1nc(cccc2)c2o1)Nc1cccs1,2 Z1254382336,CN(C)C(c1nccc(NC(NC2CCOCC2)=O)c1)=O,0 Z2302652659,O=C(c1cc(-c(cc2)cc3c2OCO3)n[nH]1)OCC(C1)CC1(F)F,0 F6043-0931,Cc(n(-c1ccccc1)nc1C)c1N(CC1)CCN1S(c1cccs1)(=O)=O,2 Z1286046716,Cn1ncc(S(NCC(NCC2(CCCCC2)O)=O)(=O)=O)c1,2 S947-0112,N#Cc(cc1)c(C(F)(F)F)cc1N(C1)C[C@@](CO)(C2)[C@H]1CCN2C(C1(CC1)c1ccccc1)=O,0 F6752-2452,CC(C)(C)C(NC1CCN(Cc2ncnn2C)CC1)=O,2 T040-0036,Cc(cc1)cc(C)c1NC(CCc1cc(N2CCCC2)ncc1)=O,0 F6562-1980,Cn(c(C(NCc1cc(N(CCC2)C2=O)cnc1)=O)c1)nc1-c1cc(OC)ccc1,2 SB20-1106,O=C(c1c[nH]cn1)N1[C@H](Cn2nnc(C(N(CC3)Cc4c3cccc4)=O)c2)CCC1,2 F6677-3314,Clc1cn(CC(C2)CN2C(c2ccccc2)c2ccccc2)nc1,2 F6441-5131,Cc1c(C(N(C(CC2)C3)C2CC3S(c2ccccc2)(=O)=O)=O)sc(-n2cccc2)n1,2 C430-0241,O=C(c1c(C2Nc(cc3)ccc3S(N3CCOCC3)(=O)=O)cccc1)N2c1ncccc1,2 Z4114624349,NCC1CC(CC(NC(C(Nc2ccccc2)=O)c2ccccc2)=O)C1,2 S697-0564,Cc1cnc(C2CC2)n1CC(CC1)CCN1C(C1COCC1)=O,2 SB95-1322,CS(N(CCN1CCOCC1)C(CCC1)CN1C(C1CCOCC1)=O)(=O)=O,2 F6805-3695,CC(N1CC(CC2)CCN2c(nccc2)c2Br)=Nc(cccc2)c2C1=O,0 Z1676521673,CN(C)c(ccnc1)c1C(Nc1ccc(Cc2ccncc2)cc1)=O,2 Z422763056,Cn1ncc(C(NCc2cc(Oc3ccccc3)ncc2)=O)c1,0 Z1270528173,Clc1cnc(CN2CCNCC2)s1,0 Z1432925752,O=C(c(cc1)ccc1OC(F)F)N(CC1)CC1Oc1ncccc1,0 SC72-1123,COc1cccc(C(N(C2)CC22OCc3c2cnc(C2CC2)n3)=O)c1,0 Z415027884,COCCNC(c(cc1)cnc1Oc1cccc(Br)c1)=O,0 SB68-0652,O=C(CCn1cncc1)N[C@@H]1Cn2ncc(C(NCc3cnccc3)=O)c2C1,2 F2666-0084,CC(c1cc(NC(Cc(cc2)ccc2Cl)=O)cc2c1N1CCC2)C1=O,2 F5833-5962,COc(ccc(NS(c1cccc2cccnc12)(=O)=O)c1)c1N(CCC1)C1=O,2 Z2760931986,CN(Cc(cc1)cc2c1OCCO2)c1ncnc2c1ncn2CC(CO)O,0 Z1401942289,COc(cccc1)c1N(CC1)CC1NC(c(cccc1)c1OCC(N)=O)=O,2 F6561-6593,Cn1ncc(-c2c(CNC(c(cc3)ccc3N(CC3)CC3OC)=O)cccn2)c1,2 S694-1377,Cc1cnc(-c2ccncc2)n1C1CN(Cc2ccccc2)CC1,2 Z367584278,NS(c1cccc(CNC(c(cc2-c3ccco3)nn2-c(cc2)ccc2Cl)=O)c1)(=O)=O,2 Z3390602624,OCC(CN(C1)C(c2ccc(CCC(O)=O)cc2)=O)C11CCOCC1,0 F1246-0019,CC(c1ccccc1)NCC(COc(cc1)ccc1-c1ccccc1)O,2 Y205-5251,CC(CC(C)C1)CN1S(c(cc1)ccc1NS(c1cccs1)(=O)=O)(=O)=O,2 Z2494729852,O=C(Nc(ccnc1)c1F)N1CCC(CCc(ccc(F)c2)c2F)CC1,2 Z2980836550,CC(CCN1)(CC1=O)C(NCc1cc(C)cs1)=O,0 F6544-0614,C(c1c[nH]c2c1cccc2)NC1Cc2ccnn2CC1,2 Z2738551097,O[C@@H](CCCC1)[C@H]1Nc1nccn2nc(C(F)(F)F)cc12,2 5593-1661,CN(CCc(cc1)cc(OC)c1OC)C(CC(N1c(cc2)ccc2Br)=O)C1=O,0 Z1748807245,CC(C)S(c(cc1)ccc1C(N(CC1)CCC1(C(F)F)O)=O)(=O)=O,0 F2548-0145,O=C(c(cccc1)c1S(C(F)F)(=O)=O)N(CC1)CCC1(C1)Oc(cccc2)c2C1=O,0 F6809-8106,FC(c1nnc2n1CCN(Cc(cccc1)c1Br)C2)(F)F,0 8019-7599,O=C1N(CCN2CCOCC2)C=Cc2c1cnc1nc(C(F)(F)F)nn12,2 Z1198537289,O=C(Cc1cc(CCC2)c2cc1)Nc(cc1)cc(CC2)c1N2C(c1cnccc1)=O,2 Z2466017640,OC(c(cc1)cnc1N(CC1)CCN1c1cc(C(F)(F)F)ncc1)=O,0 8015-4216,O=S(c(cc1)cc([C@H]2C=CC[C@H]22)c1N[C@@H]2c(cc1)ccc1F)(Nc(cccc1)c1F)=O,0 F3406-6212,CC(CCC1)CN1c(nc1)nc(N)c1C(NCc(cccc1)c1F)=O,2 F275-0206,CC(CNC(CC(C)(C)CC(N1)=Nc(cccc2)c2S1(=O)=O)=O)CSc(cc1)ccc1Cl,2 SB71-0213,Cn(cc1)nc1C(N1Cc2cc(C(N3CCOCC3)=O)nn2CC1)=O,2 Z1170796059,CN(C)CC(N(CC1)CCC1C(c(cc1)ccc1Cl)O)=O,0 Z1209423849,CC1(CCN(Cc2cc(CCC3)c3cc2)CC1)C(O)=O,2 C522-1637,Cc1c(CN(CC2)CCC2C(NC2CCCCCCC2)=O)nc(-c2cccc(Br)c2)o1,0 F5860-0184,Cc1noc(C)c1CN(CC1)CCN1C(Cc(cccc1)c1Cl)=O,0 Z1585085059,CCc1nn(C)cc1NC(c(cc1)ccc1S(C)(=O)=O)=O,0 Z850677698,Cc1n[nH]cc1CNC(C(C1)COc(cc2)c1cc2Cl)=O,0 Z2608931122,O[C@@H](CNC1)[C@@H]1NC(c(o1)ccc1Cl)=O,2 F6609-1814,Cc(cc1)ccc1C(OCC(NCc1ccco1)=O)=O,0 Z3292228529,COc(cccc1)c1-n1cnc(C(N2CCCC2)=O)c1,0 Z2911124732,OC(Cc(occ1)c1C(NC1(CC1)c(cccc1)c1Cl)=O)=O,2 F6031-0438,CS(N(CC1)CCC1C(N1CCN(CC(C2CC2)O)CC1)=O)(=O)=O,2 G856-2417,CN(C)S(c1cccc(C(N(C)C(CC2)CS2(=O)=O)=O)c1)(=O)=O,0 L310-0899,O=C(COc1c2)N(Cc3noc(C4CC4)n3)c1cc(Cl)c2S(NCC1OCCC1)(=O)=O,2 Z2027056410,O=S(c1cnccc1)(Nc1cccc2cccnc12)=O,0 F5658-0051,Cc1cccnc1NC(COc1cc(C(CC2)=O)c2cc1)=O,2 Z3799777132,CCc1nnc([C@](CC2)([C@@H]2CC2)N2C(CCc2cc(O)ccc2)=O)o1,0 Z1274723152,O=C(c1cccc(F)c1)NCCc(cc1)nn1-c(cc1)ccc1F,0 L767-0444,CCOc(cc1)ccc1NC(Nc1nc(CCN(C2)S(c(cc3)ccc3OC)(=O)=O)c2s1)=O,0 Z2307930851,Cc1c(CNC(N(CC2)C[C@H](C3CCCC3)[C@H]2O)=O)occ1,2 F6561-2506,O=C(c(ccc(Cl)c1)c1Cl)N(CC1)CC1OCC1CC1,0 SB47-0928,CC(C)NC(N(C[C@@H]1CN(C2)C(c3noc(C)c3)=O)C[C@@]12c1nc(C)n[nH]1)=O,2 8009-7983,N#Cc(c(SCC(c(cc1)cc(O)c1O)=O)nc1c2CCCC1)c2-c(cc1)ccc1OCc1ccccc1,2 F6548-0098,Cc(cccc1)c1Oc1nc2ccccc2nc1SCC(O)=O,2 Z4916289442,Oc(cc(CCCC1)c1c1)c1C(NC1(CCCC2)C2OCC1)=O,2 G602-0189,Cc(cc1)c(C)cc1S(N(CC1)CCC1c1nc(-c2cccs2)no1)(=O)=O,2 F6473-0564,O=C(c(ccc(F)c1)c1Cl)N(C1)CC1N(CC1)Cc2c1scc2,0 Z3587695585,Cc1cnc(C2)n1CCN2C(C(c1cccc(C(F)(F)F)c1)O)=O,2 F6752-6226,O=C(C(CCC1)CN1c1nc2ccccc2cc1)N(CC1)CCC1(F)F,2 F1801-0065,CN(C(C=C(NC(Cc1cccc2ccccc12)=O)N1C)=O)C1=O,2 SC40-0131,COCc1c(COC(CC2)(CCN2C(NC2CCCC2)=O)C2)n2nn1,2 Z1247219039,O[C@@H](CC1)CN1c(cc1)ncc1Br,0 F5824-0111,O=C(C1CCN(Cc2nc(cccc3)c3[nH]2)CC1)Nc1nc(ccc(Cl)c2)c2s1,2 F6441-4092,CC1=C(C)N=CN(CC(N(CC2)CCC2S(Cc2ccco2)(=O)=O)=O)C1=O,2 F6523-4230,Cc(cccc1)c1-c1noc(CCC(NC(CCC2=NN3C)CC2=CC3=O)=O)n1,2 F6451-2843,COC(CNC(c(cc1)cc(F)c1OC)=O)c(cccc1)c1Cl,0 Z3100800574,O=C([C@@]1(CCCC2)[C@H]2NCC1)NCc1c[nH]nn1,0 Z2966013874,CC(COCC1)(C2CC2)N1C(Cc1coc2c1ccc(OC)c2)=O,2 P725-0259,O=C(c1cc(Br)cnc1)N(CC1)c(cc2)c1cc2-c1csc(C2CC2)n1,2 SC02-0288,Cc1cccc(NC(NC(CCOC)(CC2)CN2S(Cc2cc(F)ccc2)(=O)=O)=O)c1,2 S940-0200,COc1ccc(C2(CC2)C(N2CC(Cc3nc(-c4cnccc4)no3)C2)=O)cc1,2 F6514-8709,COc1c(CCC(NCc2cc(-c3cnccc3)ncc2)=O)c2ccccc2cc1,2 Z1554423569,Cc1cn(-c(cccc2)c2Cl)nc1C(NC(CCCCN1)C1=O)=O,2 Z1940310726,CC(C)(C(Nc(cc1)ncc1C(N(C)C)=O)=O)OC,0 Z2357677983,CCCc1cc(NC(c(cc2)ccc2S(C2CCC2)(=O)=O)=O)n[nH]1,2 F475-0805,COc1cccc(C(Nc2c3cccc2)N(CCc(cc2)ccc2Cl)S3(=O)=O)c1,0 SA57-0305,Cc1c(C(N(CC2)CCC2(C2)OCCC2Oc2nccnc2)=O)sc(C)n1,2 Z2960953801,O[C@H](C1)C[C@@H]1NC(c1ccc(Cn2nc(C(F)(F)F)cc2)cc1)=O,2 Z437997294,CC(C)(C)CC(c(cc1)ccc1F)NC(C(CC1)NC1=O)=O,0 Z380059636,COC(c1cn(-c2ccccc2)nn1)=O,0 Z2440582194,CCCN(C1CCNCC1)C(c1cn(Cc2ccccc2)nn1)=O,0 Z2099249646,CC(N(C1)c(cccc2)c2OC1C(N(CC1CC(COC2)NC2=O)c2c1cccc2)=O)=O,2 Z4908387427,CCC(C)(c1cn(C(CC2)CN2C(c2ccc(CCC(O)=O)cc2)=O)nn1)O,0 L840-0094,CN(C1CCCCC1)S(c1cc(-c2nnc(C(N3CCCC3)=O)o2)cs1)(=O)=O,2 S947-0321,N#Cc(cc1)c(C(F)(F)F)cc1N(C1)C[C@@](COCC2CC2)(C2)[C@H]1CCN2C(C1CC1)=O,2 D430-1287,Cc1cc(S(Nc(cc2)ccc2Nc2nc(C)nc(N3CCOCC3)c2)(=O)=O)c(C)cc1,0 Z2960841690,CCS(C(C=C1C(Nc2ccc(CN(C)C3CC3)cc2)=O)=CNC1=O)(=O)=O,2 S395-0025,Cc1c(C(N(CC2)CCC2(C(N2Cc(cc3)ccc3Cl)=O)NC2=O)=O)scc1,0 SB25-0877,Cc1noc(C)c1CNC(C(CC1)CCC(N=C(c(cc2)ccc2F)N2)=C1C2=O)=O,2 Z2355784913,CCC(CC)n1nccc1C(N(C)c(cc1)cnc1Cl)=O,0 SA70-0104,Cc1c(C(N(CCC2)CC2(CCOC)c2noc(C3CC3)n2)=O)sc(C)n1,2 Z2356634090,CC(C)Cc1ccc(CCC(Nc2cn(C)nc2C(N)=O)=O)cc1,0 Z3344981784,CC(C(NC(CCc1ccccc1)c1ccccc1)=O)S(N)(=O)=O,0 F265-0058,Cc1c(C(c2ccccc2)=O)oc2c1ccc(NC(C1CCCCC1)=O)c2,0 Z2443768497,NCC(c1cc2ccccc2cc1)NS(N1C(CC2)CC2C1)(=O)=O,2 Z1133001976,OC1(CNC(NCc2cccc3ccccc23)=O)CCCC1,2 F5016-1701,O=C(COc1ccccc1)N1CCC(CNC(C(Nc(cccc2)c2Cl)=O)=O)CC1,0 L414-0837,CC(C(Nc(c(OC)c1)cc(Cl)c1OC)=O)SC(C=C1)=NN(c2cc(C)c(C)cc2)C1=O,0 V002-5121,CCCc1nc(N(CC2)CCN2C(Nc2c(C)cc(C)cc2)=O)c(c(CCC(C)C2)c2s2)c2n1,0 F6360-9158,O=C(C(CC1)NC1=O)N(C1)CC1Oc1cnccc1,2 Z2656079552,CNC(CN(CC1)CCN1C(c(cc(C(F)F)cc1)c1F)=O)=O,0 F6360-7902,Cn(c(C(N(C1)CC1Oc1cccc(C(F)(F)F)n1)=O)c1)nc1-c1cc(OC)ccc1,2 Z1603530386,OC(c1c(CNC(Cc2cscc2)=O)c(cccc2)c2o1)=O,2 F6561-3240,O=C(C(CC1)CNC1=O)N(CC1)CCC1=C1CCC1,2 F5763-0216,CC(N(C)N(C1=O)c2ccccc2)=C1NC(c(cc1)ccc1NC(c1cn(C)nc1OC)=O)=O,2 Y030-7923,CCC(CC)C(Nc1nnc(C(F)(F)F)s1)=O,0 F6747-6126,Cc(cc(C)nc1N2CCC(CN(C=Nc3c4cccc3)C4=O)CC2)c1C#N,0 F6523-3779,COc(cc1)cc(C(N(CC2)CC3=C2N=C(C=CC(Cl)=C2)N2C3=O)=O)c1Br,0 G857-2039,O=S(c1cccs1)(N(CCn1c2ccc1)C2c1ccccc1)=O,2 F2783-0308,COc(cc(cc1)NC(c2ccco2)=O)c1N(CCC1)C1=O,2 Z3116054980,CCO[C@@](C)(C1)[C@@H]1NC(N(CC1)CCC1c1cncn1C)=O,2 SA46-0610,O=C(c1ccc(Cn2cncc2)o1)N(C1)CC1(C1)OCC1N1CCCCC1,2 F6750-6415,Cn1ncc(-c2cncc(N(CC3)CCN3c3cc(C(F)(F)F)ncc3)n2)c1,0 F5823-0707,O=S(c1cccs1)(N1CCC(Cn2nccc2)CC1)=O,0 F6752-5370,O=C(C1CCN(CC2CCOCC2)CC1)NC1CC1,2 T816-1428,Cc1nc(-c2nccnc2)nc(N2C3CCCCC3)c1CC2=O,2 Z2282412062,O=C([C@H](CCCC1)[C@H]1c1ccccc1)N(C1)CC11COCC1,2 M060-0415,COc(c(OC)c1)cc2c1[nH]c1c2ncnc1SCC(Nc1cc(CCC2)c2cc1)=O,0 C191-0450,COc(c(OC)c1)cc(C(N2CCC(NCC3OCCC3)=O)=O)c1N(CC(c(cc1)ccc1Cl)=O)C2=O,2 F6549-3388,Cc1c(C(N2CC(Cn3ncnc3)C2)=O)sc(-n2cccc2)n1,2 F6436-2502,CS(N1CCC(CNC(c(cccc2)c2S(C(F)F)(=O)=O)=O)CC1)(=O)=O,0 F6240-0420,O=C(CN1CCN(Cc2cnnn2-c2ccccc2)CC1)NCc1ccccc1,2 F6734-0741,Cc1cc(CN(C2)CC(C3)C2CN3c(cc2)ncc2Cl)no1,0 J500-0217,COCCNC(C(C1)C2(CCCC2)CN1C(C1CCOCC1)=O)=O,0 C887-1175,Cc(ccc(Cl)c1)c1N(CC1)CCN1C(CCCN(C1=O)N=C(C)n2c1cc1c2cco1)=O,2 F2487-0225,O=C(c(sc1c2cccc1)c2Cl)N(C1)c(cccc2)c2NC1=O,2 Z2582328630,OCC(CO)(CC1)CN1C(c(cc1)cc2c1OCC2)=O,2 F6526-0079,O=C(c(cccc1)c1SC(F)F)N1Cc2cc(C3CC3)nn2CC1,0 F6658-5777,Cn1ncc2c1ncnc2N1CCC(COc2ncnc(C3CC3)c2)CC1,2 Z2518198827,CCC(C)NC(N)=NCCNC(c1ccccc1)=O,0 Z4194979803,CC(C)C(CNC(c1cc(C(F)(F)F)nc(C2CC2)c1)=O)C(O)=O,0 F5526-0176,O=C(c1c(C(F)(F)F)cccc1)NCCOc(cc1)ccc1F,0 L367-0072,COc(ccc(NC(c(cc1)ccc1-c1cnc(N2CCCC2)nc1)=O)c1)c1Cl,0 F146-1670,O=C(c1c(-c2ccccc2)nnc2ccccc12)Nc(cc1)cc2c1OCCO2,2 Z2862461428,C[C@H](c1ccccc1)N(CC(N)=O)Cc1cn(CC2CCC2)nn1,2 F2696-0778,CCOc(cc1)ccc1N(C=CN=C1SCC(NCc(cc2)ccc2F)=O)C1=O,2 F6374-3575,O=C(C1(CCCC1)c(cc1)ccc1Cl)N1CCC(CSC2=NCCS2)CC1,2 Z748558678,O=C(CCc1cscc1)Nc1cn(CC2OCCC2)nc1,2 F5033-1075,O=C(c1cccc2ccccc12)NCC1CCN(Cc2cscc2)CC1,2 Z1428274225,CCCC(CNC(c1cc(C(NC)=O)ccc1)=O)O,0 Z2790700457,COC(CC1)(CCN1C(C(O)=O)c1cc(OC)ccc1)C(F)(F)F,0 G281-1523,CCC(c1cccn1-c1c(C2)c(CCCC3)c3s1)N2C(Nc(cccc1)c1OCC)=O,0 F2382-0376,CCCn(cc1C(NCc(c(F)ccc2)c2F)=O)nc1OCCC,0 Z2713354921,CC(C1)OCCN1c(cc1)ccc1NC(C(CN1)c(cccc2)c2C1=O)=O,2 Z2641194627,Cc1c(CCNC(c2ccc(-c3n[nH]cc3)s2)=O)c(C)n[nH]1,2 Y042-4819,Oc(cccc1)c1NC(CN(C(c1ccccc1)Nc1c2cccc1)C2=O)=O,0 F6442-8451,O=C(c(ccc(F)c1)c1Cl)N(CC1)CCC1N(CC1)CCC1Oc1nccs1,0 P936-3560,O=S(c1ccccc1)(N1CC(Cc2nncn2Cc2ccccc2)CC1)=O,2 F6549-9225,CC(C(N(C(CC1)C2)C1CC2Oc1ccncc1)=O)Oc(cccc1)c1F,2 SB18-0269,Cc1nn(C)c(C(N(C[C@H](C2)NC(C3CCOCC3)=O)[C@@H]2c2nc(C)n[nH]2)=O)c1,0 F170-0126,CC1CCC(CC(CC2)CCN2C(Nc2c(C)ccc(Cl)c2)=O)CC1,0 F2169-0484,OC(C(CC1=O)CN1c1cccc(Br)c1)=O,0 F6525-7095,Cc(n(CCNC(c(cc1)ccc1N(C(CC1)=O)C1=O)=O)nc1C)c1-c1ccco1,2 SD68-0422,COCCN(CCN(CCC1)C2CN1C(C1(CC1)c(cc1)ccc1OC)=O)C2=O,2 Z2335012914,Cn(c1c2)c(NC(C3CCOCC3)=O)nc1cc(Cl)c2Cl,2 T158-1076,Cc1cnc(C(CC2)CN2S(c2cccc3nsnc23)(=O)=O)n1CCCOC,0 SB71-0723,Cc1nn(C)cc1CN1Cc2cc(C(NC3CCCC3)=O)nn2CC1,2 Z86473150,CC(CCCC1C)N1C(c1ccc(C)cc1)=O,0 Z1616802001,OCC(Cc1c[nH]c2c1cccc2)NC(c1cc(CCC2)c2[nH]1)=O,2 F6619-4493,CCc1ncnc(N(CC2)CCN2c2nc(NCC)ccn2)c1F,0 Z1981846539,CC(C1)OC(C)CN1c(cc1)ncc1C(Nc(cc1)ccc1NS(NC)(=O)=O)=O,0 D400-5915,CC(CCCC1)N1S(c(cc1)cc(-c2noc(C)n2)c1OC)(=O)=O,0 F6809-6028,O=C(c1ccccc1)N(CC1)CCN1c(ccnc1)c1Cl,0 Z2653277351,CCc1noc(C2(CCOCC2)NC(C2CC2)=O)n1,0 M033-0752,CC(c(cc1)ccc1N(CC1)CCN1C(c(cc1)ccc1-c1csc(C2CC2)n1)=O)=O,2 Y042-7567,c1(nc2c(n1CCOC)cccc2)[C@@H](NC(CCN\1C(c2c(\N=C1)cccc2)=O)=O)C,0 F6554-5412,O=C(c(ccc(F)c1)c1Cl)N(C1)CC1C(F)F,0 SB47-0631,Cc1noc(C)c1CN(C[C@H]1CN(C2)C(c3ccccc3)=O)C[C@]12c1nc(C)n[nH]1,2 Y041-9000,O=C(CC(C(Nc1c2cccc1)=O)NC2=O)Nc1c(cc[nH]2)c2ccc1,2 F6573-4818,O=C(c(cc1)ccc1-n1cccc1)NCc1cncc(C2CC2)c1,2 F6526-1365,O=C(c1cc(Br)cs1)N(CCn(cc1)nc1-c1ccncc1)C1CCCC1,2 F3386-2652,Cc1cccc(C)c1N(CC1)CCN1S(c(cc1)cc(OC)c1Cl)(=O)=O,0 Z2953027276,Cc1cn(C(CCC2)CN2C(c2ccnn2C2CCC2)=O)nc1,2 F6178-7799,O=C(C(NCc1ccco1)=O)NCC(CC1)CCN1C1CSCC1,2 Z3339963057,COC(c1cc(ccc(OCC2CC2)c2)c2[nH]1)=O,2 F6564-5480,COc1c(C2(CC2)C(N(CC2)CCN2c2nnc(C3CC3)cc2)=O)cccc1,2 Z3086680480,Cn(c(C(F)(F)F)c1)nc1C(N[C@]1(C2)[C@@H]2COC1)=O,2 F678-0274,Cc1ccc(CN(c(cccc2)c2N=C2N(CC3)CCN3C(Nc3c(C)c(C)ccc3)=O)C2=O)cc1,0 Z1119530378,CC(NC(N1)=O)=C(CCC(N(C)CC2CCN(C)CC2)=O)C1=O,2 F6515-1093,Cc1cc(C(NCc2cc(-c3ccco3)ncc2)=O)c(C)o1,2 F0665-0602,O=C(CSc1nnc(CN(c(cccc2)c2S2)C2=O)n1-c1cccc(Cl)c1)N1CCCC1,2 F6715-0242,Cn1c(N(CC2)CCN2c(cccc2)c2F)nc2c1cccc2,0 Y041-5047,CC(c(c(O1)c2O)ccc2O)=C(CC(N(CC2)CCN2C(C2Oc(cccc3)c3OC2)=O)=O)C1=O,2 F6516-1752,O=C(c(cc1)ccc1OC(F)(F)F)NCc1ccc(-c2cocc2)o1,0 SD01-0426,COCCCn(c(CC1)c2CN1S(c(cc(cc1)OC)c1OC)(=O)=O)nc2-c1cocn1,0 P091-0146,CC(C)CCNC(CCc(cc1)cc2c1n(C)cc2)=O,0 F3379-0788,Fc(ccc(-n1ncc2c(N3CCOCC3)ncnc12)c1)c1F,0 F6724-3588,OC(CCNc(nc1)ncc1Br)c1cocc1,0 S826-3538,Cc1nn(C)c(CN(C[C@@H]2CO)C[C@@H]2c2nc(C)no2)c1,2 F6722-5398,Cc1cc(N(CC2)CCN2c2cccc(Cl)c2Cl)ncn1,0 F5119-0534,CCn1nc(C)cc1C(Nc(ccc(F)c1)c1F)=O,0 E848-3591,CCC(C(NC1CC1)=O)n(cc1)c(cc2)c1cc2S(N1CCCCC1)(=O)=O,2 F6359-2915,COc(ccc(Cl)c1)c1C(N(CC1)CCC1Oc1nccnc1)=O,0 7627-0155,O=C(CC(C1=O)NC2CCCC2)N1c(cc1)ccc1Br,2 Z2644162494,CCC(NC(C(N(CCC12c3ccccc3)CC2C1(F)F)=O)c1ccccc1)=O,0 Z3563718688,O=C(C1CCOCC1)OCc1nnc(C2CCOCC2)o1,2 F6519-6151,O=C(NCC(c1ccco1)n1nccc1)Nc1cccs1,2 K786-6432,CC(CC(C)C1)CN1S(N(CCC1)CC1C(NCc(cc(cc1)Br)c1OC)=O)(=O)=O,2 F6444-2113,Cc1cc(C(N(CC(C2)OC)C2C(OC)=O)=O)no1,0 F6496-0876,Cc1cc(CNC(COc2cccc3ccccc23)=O)ncn1,2 Y030-3946,O=C(Cc(cc1)ccc1Cl)NCC1OCCC1,0 8006-4322,CCCOc(cc1)ccc1N(C(CC1N(CC2)CCN2S(c2ccccc2)(=O)=O)=O)C1=O,2 F6573-8652,O=C(NCC1OCCC1)N(CCN1c(nc2)ncc2F)CC1=O,2 F6791-8304,O=C1N(CC(F)(F)F)CCC1N(CC1)CCC1c1nnc(C2CC2)o1,2 S618-2002,Cc1cc(S(N(CC[C@H]2CNC(NC)=O)C[C@@H]2N(C)C)(=O)=O)c(C)cc1,0 F0599-0504,O=C(CSc1nccn1-c(cc1)ccc1Cl)NCc1ccco1,2 SA46-1480,CN(CC1)CCN1C1COC(C2)(CN2C(c2cc(OC)cc(OC)c2)=O)C1,0 Z1823626009,O=C(CN(CC1)CCN1c1c(cccc2F)c2ncn1)N1CCCC1,2 Z1753999804,CCc1nnc([C@@H](C[C@H](C2)O)N2C(c2cc(Oc3ccncc3)c(C)cc2)=O)o1,2 F6549-1115,O=C(CCc(cccc1)c1Br)N(CC1)CCN1c1nsnc1,0 Z838910386,Cc1cccc(CNc(cc(cc2)C(N)=O)c2Cl)c1C,0 G305-0572,O=C(CN(c(ccc(Cl)c1)c1O1)C1=O)N(CC1)CCN1C(c1ccco1)=O,2 F6764-4146,Cn1c(S(N(CC2)CCC2c2ccc(cc(cn3)Cl)c3n2)(=O)=O)ncc1,2 S976-1463,COCC(N(CCC1)CC1(C(NCc1ccncc1)=O)F)=O,2 F052-0573,CC(Cc1c2cccc1)N2c1ccc(cc(cc2)S(N3CCC(C)CC3)(=O)=O)c2n1,2 F6554-6115,COC(C(C1)C1(CC1)CCN1C(Cc1cscc1)=O)=O,0 F3004-0171,Cc1cccc(NC(Nc(cc2)ccc2Cl)=O)n1,0 Z1591863232,CCn1ncc(S(N(CC2)CCN2C(c(cc2)ccc2O)=O)(=O)=O)c1,0 F2167-9592,CC(C)C(Cc(c1ccc2)c2Br)C1O,0 F6559-6029,Cc1nc(n(C)nc2)c2c(N2C(C3)CSC3C2)n1,2 SA49-1438,O=C(CCCc1c[nH]c2c1cccc2)N(C1)CC11OCC(CC(N2CCOCC2)=O)C1,2 8020-2120,COc(cc1)ccc1-c1nnc2sc(-c(ccc3c4)nc3ccc4OC)nn12,0 SD69-0670,CC(C)[C@@H](Cn1nnc(C(N(CCN2CCOCC2)Cc2ccco2)=O)c11)NC1=O,2 F6496-1310,Oc(nccc1)c1C(NCc1ncnc(C2CC2)c1)=O,0 Z1276310037,O=C(c1cc(-c(cc2)ccc2Br)n[nH]1)Nc1cn(CC2CC2)nc1,2 K284-2799,O=C(c(cc1)cc(NC(N2CC3OCCC3)=S)c1C2=O)NC1CCCC1,2 V005-5813,COCCN(CC(Cc1ccccc1)O)CC(N1)=Nc(scc2-c(cc3)cc(OC)c3OC)c2C1=O,0 Z3016325159,CCC(C)(C#C)NC(c(cnn1CCN2C)c1S2(=O)=O)=O,0 F6556-7822,CC(Cc1cc(cccc2)c2o1)NC(NCCOc1ccccc1)=O,2 F6799-8677,O=S(c1ccccc1)(N1CCN(CCn2nccn2)CC1)=O,2 F6813-7825,COc1ccnc(N2CCN(Cc(ccnc3)c3F)CC2)n1,0 F6436-0258,Cn1cnc(S(NCCN(CC2)CCN2c2ccccc2)(=O)=O)c1,2 Z2033042057,COCc1c(C(N(C2)CC2OC)=O)scn1,0 8013-6538,O=C(C1CCCCC1)NC(C(F)(F)F)(C(N1C2CCCCC2)=O)NC1=O,2 F6383-0404,COCCc1noc(C(CC2)CCN2C(Cn(cc2)c3c2cccc3)=O)n1,2 F6037-0311,O=C(CCC1)N(CCS(N(C2)CC2c2nc(cccc3)c3[nH]2)(=O)=O)C1=O,2 Z953197188,CCOc(ccc(C(NCC(NCc(cc1)ccc1-n1c(cccc2)c2nc1)=O)=O)c1)c1OCC,2 F6188-1009,O=C(Cc(c(F)ccc1)c1Cl)NCC1(CCOCC1)Sc1ccccc1,0 V023-7108,CCC(C)N(CC(N(CC1)C(COc(cc2)cc(C)c2Cl)c2c1scc2)=O)C(NC(C)C)=O,0 Z1050842482,Cc(n1nc2)cc(C)nc1c2C(Nc1nc(C2CC2)c(Cc(cc2)ccc2F)s1)=O,2 G501-0375,CCOc(cc1)ccc1S(NCC(c(cc1)ccc1N(C)C)N(CC1)c2c1cccc2)(=O)=O,0 Z3071643623,COc(cc1)ccc1-c1nc(C2(CC2)NC(C(F)(F)F)=O)cs1,0 G932-0450,Clc1cc(Nc2nc(NC3CCCCCC3)nc3c2cnn3-c2ccccc2)ccc1,0 F2447-0092,Cc1nn(C)c(C(Nc2nc(-c3ncccc3)cs2)=O)c1,2 F5058-0080,Cc1nnc(-c(cc2)ccc2NC(COc(ccc(Cl)c2)c2Cl)=O)o1,2 S720-0961,O=C([C@H](C[C@@H](C1)Oc2ccccc2)N1C(C1CCCCC1)=O)NC1CC1,2 Z4329810132,O=C(c1cc(C(F)(F)F)nc2ccccc12)NC1C(C2)CC2OC1,2 Z1305281938,CS(c1ccc(CNC(N2C(CN3CCOCC3)CCCC2)=O)cc1)(=O)=O,2 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Z1628213329,Oc(cc1)cc(O)c1C(N(CCC1)CC1S(N1CCOCC1)(=O)=O)=O,2 Z3687050803,Cn1c(CC(N[C@@H](CC(Cn2ncc(Cl)c2)C2)[C@H]2O)=O)cnc1,2 F6808-7733,Cc1cc(N(CC(C2)CN34)CC2C4=CC=CC3=O)nc2ccccc12,2 Z2952912436,CC(C)NC(CN1Cc(cccc2)c2OC2(CCOCC2)C1)=O,0 Z1129468893,CN(CCC(C1)C(N(CC2)CCN2c2nccc(OC)c2)=O)C1=O,2 E699-1982,CC(C1)N(C(C2CCC2)=O)c(cc2)c1cc2S(N(C)CC(NCc1ccc(C)cc1)=O)(=O)=O,2 F6525-6986,O=C(NCCn1ncc(-c2ccco2)c1)NCc(cc1)cc2c1OCO2,2 SB54-0299,CC(C)c1nnc([C@@H](C2)[C@@H](COC)CN2C(Cc2c(C)onc2C)=O)o1,2 Z2044325650,O=C(NCc1cnc2n1CCCC2)N1CC2(CCC2)OCC1,2 F2506-0050,O=C(CSc1nnc(cc2)n1nc2-c1ccccc1)NCc(cccc1)c1Cl,2 L150-0632,O=C(c1ccc(C(F)(F)F)cc1)NC(C(Oc1c2cccc1)=O)=C2NC1CCCCC1,0 Z2966679292,C[C@H](C1)N(CC(F)(F)F)[C@@H](C)CN1C(c(cc1)nc2c1[nH]nn2)=O,2 Z437596096,COc(cc1)ccc1-c1nc(C(Nc(cc2)cc(F)c2OC)=O)cs1,0 Z2225508324,CC(CN(CC1)CCN1c1ncccc1)=Cc1c(COC)cccc1,0 Y041-1770,O=C(COc(cc1)cc(O2)c1C(CCCCC1)=C1C2=O)c(cc1)ccc1-c1ccccc1,2 F0649-0398,COc(cccc1)c1C(N(CN(CCC1)C1=O)c1cccc(C(F)(F)F)c1)=O,0 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Z666967850,COc(cc1)ccc1C(Nc(cccc1)c1C(N(CC1)CC1C(N)=O)=O)=O,2 P645-0048,Cc1cc(C(NC2CCCCC2)=O)nc2cc(-c3ncccc3)nn12,2 Z3500324342,COC(C1(COc2cc(OC3OCCCC3)ccc2)CC1)=O,2 F5882-6365,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)N(CC1)CCN1C(c1ccco1)=O,2 Y202-7168,CCc1ccc(C(NC(C)C2C(CC3)CC3C2)=O)s1,0 Z1359693684,CCc1cccc(S(N(C)C(CCC2)c3c2nc(C)s3)(=O)=O)c1,0 S947-0244,COC[C@](CN(C1)c(cc2)cc(C(F)(F)F)c2C#N)(C2)[C@H]1CCN2S(C)(=O)=O,0 T140-0830,COCCN(C(CC1)(CCN1C(c(cc1)ccc1Cl)=O)S(C1)(=O)=O)C1=O,0 Z1657982053,CC(CCC1)(CN1C(c1c(C)[nH]nc1)=O)C#N,0 Z3657573407,O=C(NC1C(CCCC2)N2CCC1)N(CC1)CCC1(CN1)NC1=O,2 F6286-0150,CCCCOc(cc1)ccc1C(NCCc1nc(C)cc(C(F)(F)F)n1)=O,0 G857-0069,O=C(CSC(C(CCCC1)=C1N1)=NC1=O)Nc(cc1)cc2c1OCCO2,2 G397-0176,CCN(CCCNC(C(CCC1)N1c1nnc(N(CCC2)C2=O)s1)=O)Cc1ccccc1,2 F6744-7834,COc1nc(N(C2)CC2N(CCN2)CC2=O)nc(OC)n1,2 F6515-0220,CC(N(CC1)CCC1C(NCc1cccnc1-c1cscc1)=O)=O,2 Z2974115044,CCc1cc(C)nc(N(C)Cc2ncccn2)n1,0 Z2389878312,OC(c1cn(C(CC2)CN2C(OCC2CC2)=O)nn1)=O,2 Z1739067796,CCCN(CC(O)=O)S(c1cc(F)cc(Cl)c1)(=O)=O,0 Z2907951152,Cn(c(C(NC(CC1)COc2c1cccc2)=O)c1)nc1-c1ccncc1,2 Z2921503987,C=C(CNC(N(CCC1)CC1S(N)(=O)=O)=O)c1ccccc1,2 F6057-0148,O=C(Cc1cccs1)N1CCN(CCn2nccc2)CC1,2 Z2701278977,CCC(c1c(C)ccc(C)c1)Nc1cc(C)nc2ncnn12,0 Z1039067824,NS(N(CC1)CCN1c1ncnc2c1cc[nH]2)(=O)=O,0 SD07-0428,O=C(C1CCOCC1)NCc1c(COC(CC2)(CN2S(Cc2ccccc2)(=O)=O)C2)n2nn1,2 F6244-0308,CN(C)CC#CCNC(NCc1cccc2ccccc12)=O,0 T622-0054,CC(C)N(CC1)CCN1C1CC(CC2)(CCN2C(COc(cc2)ccc2F)=O)OCC1,2 F0554-0094,Cc(cccc1)c1C(NCCn1c(cccc2)c2c(SCC(NCc2ccco2)=O)c1)=O,2 F6555-0112,O=C(c(cc1)ccc1S(N1CCOCC1)(=O)=O)N(C1)CC1n1nnc(C2CC2)c1,2 S592-0920,Cc1noc(C)c1S(N(CC1)CC1c1noc(COC)n1)(=O)=O,2 F6435-0645,CS(C(CC1)CN1C(NC1(CC(C2)C3)CC3CC2C1)=O)(=O)=O,2 Z4496992164,CC(C(N1)=O)(c2cccc(C(N(C3)C(C)(C)COC3c3cccc(Cl)c3)=O)c2)NC1=O,0 F6529-6778,COCCN(C(CN1C2CCN(CC(Nc(cc3)cc(Cl)c3F)=O)CC2)=O)C1=O,0 F6795-3668,CC(C)(C)c(nc1cc2)cn1nc2N1CCN(Cc2coc(C)n2)CC1,2 Z3299507039,COCc1ccc(C(N[C@H](CC2)CC[C@@H]2NC(c(cccc2)c2F)=O)=O)o1,2 6408-0656,CC(C)(C)NC(COc(c(OC)cc(CNc(cc1)cc(N2)c1NC2=O)c1)c1Cl)=O,2 F6064-1613,CC(C)(Cc1ccc2)Oc1c2OCC(N(C1)CC1c1nc(-c2cccs2)no1)=O,2 Z2482883722,CC(NC(CCC1)CN1C(C(O)=O)c(cc1)cc(Cl)c1Cl)=O,0 Z3464156151,O=C(C(C1)COc2c1ccc(F)c2)Nc1cc(-c2c[nH]nc2)ccc1,2 F6445-6161,O=C(CCc(cccc1)c1Br)N(CC1)Cc2c1ncnc2,0 F6471-2113,O=C(C1CC=CCC1)N(C(CC1)C2)C1c1c2ncnc1,2 F6471-2676,Cc(ccc(CCC(N1C2C=CCC1CC2)=O)c1)c1F,0 Y043-3265,O=C(CC(C1)c(cccc2)c2OC1=O)Nc1cc([nH]cc2)c2cc1,2 F6473-4303,COc(cccc1)c1-c1n[nH]c(C(N(C2)CC2N(C(C2C3CC=CC2)=O)C3=O)=O)c1,0 E511-0531,CCC(C)NC(CCS(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O)=O,0 F6502-9134,Cc1cc(CCNC(c2cnc(C(F)(F)F)cc2)=O)nn1C,0 SC04-0858,COCc1nc(CCOC(CCC2)CN2C(c2n[nH]cc2)=O)no1,0 Z4095167876,O[C@H]([C@@H]1C[C@H]2[C@H](CNC(C(Cc3ccccc3)(CC3)c4c3cccc4)=O)C1)[C@H]2O,2 Z1766180755,CC(CN(CC(C)(C)O)CC1)N1S(c1cc(C)c(C)s1)(=O)=O,0 P223-1448,Cc1noc(C)c1CC(N(CCC1)CC1c1nn(CCCN(C)C2=O)c2c1)=O,0 Z2713921714,O=C(c1ccc(C(F)F)o1)N(CCCN1)C(Cc2ccccc2)C1=O,0 F2070-1138,O=C(C1CC1)NCc1nnnn1-c(cc1)cc(F)c1F,2 F6573-3427,O=C(c1c2OCCOc2ccc1)NCCOCCn1cncc1,2 F2622-0016,CC(COC)NC(C(C(N(C=CC=C1C)C1=N1)=O)=C1O)=O,0 V020-2859,Cc(cc1)cc(NC(Nc2cc(OC)ccc2)=O)c1N(CCCN1Cc2cccc(OC(F)(F)F)c2)C1=O,0 F6559-0966,CCOc(nccc1)c1C(N(CC1)CCC1N(C1=O)N=Nc2c1scc2)=O,2 S049-0216,COCc1nc(-c(cc2)ccc2OC2CN(Cc3cc(OC)ccc3)CC2)no1,0 Z1372704087,O=C(NC(CCCN1c2ccccc2)C1=O)N1C2CCCC1CC2,2 T505-0957,O=C(CCC1CCCC1)N1C(CCn2nnc(C(N3CCOCC3)=O)c2)CCCC1,2 F6573-1320,CCOc(cc1)ncc1C(NCC(CCC1)N1c1ncccn1)=O,2 8538-0035,CC(C)(C1)CC(Nc2nonc2NC2c(cc3OC)cc(Br)c3O)=C2C1=O,0 F6808-0028,COc1cc(N(CC2)CCN2c(cc2)nn3c2nnc3C2CC2)ccc1,0 Z1438712775,CC(c(ccc(-n1ncnc1)c1)c1Cl)NCC(c1cc(F)ccc1)O,0 Z2760932520,CCOC(C(CCC1)CN1c1ncnc2c1ncn2CC(CO)C1COCC1)=O,0 F6616-7256,Cn1ncc(NC(c2nc(cccc3)c3s2)=O)c1,2 F5097-2848,OC(CC1)CCN1C(Cc(cc1)ccc1NC(CC(c1ccccc1)c1ccccc1)=O)=O,2 SB95-1166,O=C(C1CC1)N(CCN1CCOCC1)C(CCC1)CN1C(C1CCOCC1)=O,2 SB91-0360,COc(cc1)nc(OC)c1C(N(CC1)CC1N(CCN1CCOCC1)S(C)(=O)=O)=O,0 F2182-0042,CC(C)c1cccc2c1nc(NCc1ncccc1)s2,0 Z1335065710,COCC(N1CCC(CC(O)=O)CC1)=O,0 Z1269955495,Cc1noc(C(CC2)CCN2C(c2cc(CN3CCN(C)CC3)ccc2)=O)n1,2 Z1562831176,CCOc1ccc(CN2CCN(Cc3cncnc3)CC2)cc1,2 F1768-0128,O=C(C(c1ccccc1)c1ccccc1)N(C1)c(cccc2)c2NC1=O,2 V004-7011,CCC(C(NC(C)C)=O)Oc1cc(C(c2ccc(C)cc2)N(CC2)C(C3CCCC3)=O)c2cc1,0 F6573-2434,O=C(NCCc1ccccc1)NCc1nccnc1-c1cnccc1,2 F0308-0429,Cc1c(COc(cc2)cc3c2oc(C)c3C(OC)=O)cc(C(OC)=O)o1,2 D383-0026,CN(c1c(COCC2)n2c(-c(cc2)ccc2Br)c1C(N1C)=O)C1=O,2 F5254-0136,COc(cccc1)c1N(CC1)CCN1C(CCc1csc(NC(c2ccccc2)=O)n1)=O,2 E135-1135,CC(CCCC1C)N1C(C(N1C)=CC(c2cccs2)=NS1(=O)=O)=O,2 F3375-1270,O=C(c1cscc1)N(C1CCCCC1)c1ccccc1,2 Z2768784721,O=S(CC1)(CC1c1nnc2n1CCCCCC2)=O,2 Z2482924379,CC(C)COC(CC1)CCN1C(C(O)=O)c(cc1)cc(Cl)c1Cl,0 Z1551944561,CCOC(c1cnc2scc(C)n12)=O,0 Z2273201600,CC(COC)(CC1)CN1c1nnc(C)c(C)n1,2 F0882-0428,CN(C(c(cc1)c2cc1NC(c(cc1)cc3c1OCCO3)=O)=O)C2=O,2 Z3046746193,Cc1csc(N(CC2)CCN2C(c(cccn2)c2OCCO)=O)n1,0 F6530-0379,Cc1nc(-c2cc(NC(C(C(OC)=C3)=C(CCC4)N4C3=O)=O)ccc2)cs1,2 Z2095387030,CC(c1nncn1C)Sc1nc(cccc2)c2c2nc(C)nn12,2 Z1493168358,CCc(ccc(S(N(CC1)c(cccc2)c2N(C)C1=O)(=O)=O)c1)c1C(O)=O,0 F5490-0733,COC(c(cccc1)c1C(N(CCC1)CC1c1nnc(-c(cc2)cc3c2OCO3)o1)=O)=O,2 P117-1317,O=C(Cn1c2nc(N3CCOCC3)ccc2cc1)N(CC1)CCN1c1ncccc1,2 F6539-3088,O=C(c1ccco1)NCc(cc1)ccc1-c1cocc1,2 Z1438236240,OC(Cc1c(CNC(C2CC2)=O)cccc1)=O,0 F6446-0832,O=C(c1cc2nccnc2cc1)NC(CC1)CCN1c1nccs1,2 F6713-7248,CCc1c(C)ncnc1N1CCN(Cc2nnc(C(F)(F)F)o2)CC1,0 G346-0249,CCCNC(C1CCC(CN(C(c(scc2)c2N2CC(N3CC(C)CCC3)=O)=O)C2=O)CC1)=O,0 S625-0287,O[C@H](C1)CN(Cc2ccccc2)[C@@H]1c1nnc(C2)n1CCN2C(C1CC1)=O,2 G008-3097,COc(cc1)cc(C(CC2)CN2S(c2ccc(-c3noc(C(F)(F)F)c3)s2)(=O)=O)c1OC,0 F6541-4449,Fc(cc1)ccc1N1CCN(Cc2ccncc2)CC1,0 Z3077988270,CCc1cc(C)nc(N(C)Cc2csnc2OC)n1,0 F6676-4815,CN(C(CCC1)CN1C(C(C1)CC1(F)F)=O)c1ncccc1C(F)(F)F,2 SB91-0068,Cc(ccc(F)c1)c1S(N(CCN1CCOCC1)C1CNCC1)(=O)=O,0 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Z1438906388,CC(C)n1nccc1C(N(CCCC1)C1C(N1CCOCC1)=O)=O,2 SA58-0876,CCS(N1C(CCc2noc(-c3ncccc3)n2)CCC1)(=O)=O,2 Z2019792107,O=C(NC(CC1)C2(CCC2)NC1=O)NC1(CCCC1)c(cc1)ccc1Br,2 Z1100819671,CCCC(CCCC1)C1NC(NC1CCN(C)CC1)=O,2 F6491-1906,COc1cncc(OC(CCC2)CN2C(Cc2cccs2)=O)n1,2 F5832-8638,O=C(C(NCc(cccc1)c1Cl)=O)NCCc1csc(-c(cc2)ccc2F)n1,0 F6477-5200,Cc1ccc(-c2csc(Nc3ncccc3C)n2)s1,2 Z1197845106,CC(C)(c1noc(-c2cnc(C)cc2)n1)NC(C)=O,0 F6594-1391,Cc1nnc(cc2)n1nc2N1CCC(CN(C(C=C2)=O)N=C2c2ccncc2)CC1,2 F6445-0108,O=C(c1cc(Oc2ncccc2)ccc1)Nc(cc1)cc(Cl)c1F,0 S614-0699,CCn1nccc1C(N(CCCC1)C1c1nc(CCOCC2CC2)no1)=O,2 SB46-0221,CN(Cc1cn(-c2ccccc2)nc1)C([C@H](C[C@H]1CN(C2)C(C3CCOCC3)=O)C[C@@H]1NC2=O)=O,2 P944-0900,CCc1nncn1C(CC1)CN1S(c(cc1)ccc1C#N)(=O)=O,2 F0588-0081,CCOC(c([nH]c1c2cccc1)c2NC(c1cccs1)=O)=O,2 S988-1036,CCS(N(C[C@@H]1CN(C2)C(c(ccc(F)c3)c3F)=O)C[C@@]12c1nc(C)no1)(=O)=O,0 Z2506417163,Cc(cn1)cnc1OC1CCN(Cc(cc2)cc(Cl)c2C(O)=O)CC1,0 Z872489438,Cc1cc(N(CC2)CCN2S(c2cc3ccccc3cc2)(=O)=O)nc(-c2ccncc2)n1,2 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F6482-6325,O=C(c(cccc1)c1F)NCc(cc1)cnc1-c1ccco1,0 Z3590053389,OC1(CC1)C(Nc(cc1)cc2c1OCCNC2=O)=O,2 Z2065572464,CC(C)Oc(nccc1)c1-c1nc(C(C)(C)NC(C)=O)no1,0 S663-0039,COCC(NC(CC1)C1(CC1)CCN1C(COc(cc1)ccc1F)=O)=O,0 F6497-0629,COc1cc([nH]c(C(N2CC(Cc3nc(C4CC4)no3)CCC2)=O)c2)c2cc1,2 F6556-5954,CC(C)(C(N(CCC1)CCN1C1CCC1)=O)Oc(cc1)ccc1Cl,0 G804-0554,COc1cccc(NC(c2c3cccn2)N(Cc2ccco2)C3=O)c1,0 Z1722358929,OCC1N(Cc(cccc2)c2C(O)=O)CCCCC1,0 F1408-0285,Cc1c(C(OC)=O)sc(S(NC2(CC(C3)C4)CC4CC3C2)(=O)=O)c1C(OC)=O,2 E596-0296,COCCCN(c1nnc(CCCC(NC2CCCCCC2)=O)n1-c1c2scc1)C2=O,2 Z2466017788,Cc1cnc(C)c(N(CC2)CCN2c(cc2)ncc2C(O)=O)n1,0 F6443-6374,CCOc(cc1)ccc1NC(NCC(CCC1)N1c1nc(cccc2)c2o1)=O,2 F6438-3482,CN(C)c1nc(CNC(Nc(cc(cc2)Cl)c2OC)=O)nc(N(C)C)n1,0 Z3053323522,O=C([C@@H](C1)[C@H]1c(cc1)ccc1OC(F)F)NC1c2cncn2CC1,2 F6559-6896,FC(c1cc(N(CC2)CCN2c2c(ccs3)c3ncn2)ncn1)(F)F,2 F614-0252,CC(C(Nc1cc(C)nn1-c1c(cnn2-c3cccc(Cl)c3)c2ncn1)=O)Oc1ccccc1,0 S824-2003,OC[C@@H](CN(C1)C(c(cc2)ccc2Cl)=O)[C@H]1c1ccncc1,0 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Z1416859802,NC(c1ccc(CN(CC2)CCC22OCc3c2cccc3)cc1)=O,2 Z1150606991,COCCN(CC1)CCN1C(Nc(c(Oc1ccccc1)ccc1)c1F)=O,2 Z4917918547,CCC(c1cn(C(CC2)CCC2NC(c2c(Cc3ccccc3)n(C)nc2)=O)nn1)O,0 S232-1674,CN1[C@@H](CN(CC2)S(c3cccc4cccnc34)(=O)=O)[C@@H]2COCC1,2 S951-5336,Cc1c(C(N(CCN(C2)c(cc3)cc(C(F)(F)F)c3C#N)C2C(NC2CC2)=O)=O)sc(C)n1,2 F2265-0013,COc1cccc2c1oc(C(Nc(sc1ccc3)nc1c3Cl)=O)c2,2 S976-1216,Cc1nn(C)cc1CN(CCC1)CC1(C(NCC1CC1)=O)F,0 Z2358766602,CNC(NCC1(C2CC(C3)CC1CC3C2)N)=O,0 T147-0179,O=C(NCC1OCCC1)N(CC1)Cc2c1[nH]c(-c1ccccc1)n2,2 Z3416857270,CC1(CCC(N(CC2C3)C3C2c2c(C(N)=O)nco2)=O)CC1,2 Z1552311152,COCC(Cc1ccccc1)NC(N1CC2(CCC2)OCC1)=O,0 F6745-8153,FC(C(CC1)CCN1c1nccc2c1ccs2)(F)F,0 V017-8193,O=C(Cc1cccc(N(Cc2ccccc2)C(c2cccs2)=O)c1)NCC1CC1,2 V003-9915,CN(C(CN1CC(NC(c2ccccc2)c2ccccc2)=O)=C(C(c(cccc2)c2Cl)N2)C1=O)C2=O,2 F0647-0158,Fc(cc1)cc2c1nc(N(CC1)Cc3c1cccc3)s2,0 F3398-5401,CCOC(c(cc1)ccc1NC(COc1nc(N2CCC(C)CC2)nc(C)c1)=O)=O,0 Z2973848932,CN(CC1CC2)CC2N1c1nccn2nnnc12,2 F6518-5596,CC(C)(C)C(NCCc(cc1)ccc1-c1cn(C)nc1)=O,0 F6472-9122,COc1cccc(-c(cc2)ccc2C(N(C2)CC2N(CCN2)CC2=O)=O)c1,2 Z1395436333,CC(C)(c(cc(cc1)S(Nc2cc(-c3ccccc3)n[nH]2)(=O)=O)c1N1)C1=O,0 F6494-0989,CCOc1cc(C(Nc2ncc(C)s2)=O)ncn1,2 Z4066528938,Cc1c(C)sc(N=C(N2CC=C)SCCC(C(F)(F)F)N3CCOCC3)c1C2=O,2 F5103-0066,O=C(c(cccc1)c1Cl)NCc1cscc1,0 Z1080703382,CN(Cc1cn(C)nc1)Cc(ccc(C(O)=O)c1)c1F,0 Z1234038265,O=S(c1c[nH]cn1)(N1C(Cc(cccc2)c2Cl)CCC1)=O,0 Z1140118363,COc1c(C(NCC2CN(Cc3ccccc3)CCC2)=O)scc1,2 F6539-3780,O=C(c1cocc1)NCCCc1cc(cccc2)c2o1,0 D519-0376,CN1c(cc(cc2)NC(c3noc(-c(cc4)cc5c4OCCO5)c3)=O)c2OCC1=O,0 F6478-6142,Cc(nccc1)c1C(N(CC1)CC1Oc(nc1)ncc1Cl)=O,0 Z1609174664,CC(C)Cc1cc(C(N(CC2)CCN2c2ncccn2)=O)cc(O)n1,2 F6474-3218,COc(nccc1)c1C(N(CC1)CC1Oc1cccc2cccnc12)=O,0 L596-0167,CN(c(ccc(S(Nc(cc1)cc(F)c1F)(=O)=O)c1)c1C(N1CC(N2CCCC2)=O)=O)C1=O,0 Z1262333624,Cc1c(C(NCc2cnccc2)=O)oc(-c2ccccc2)n1,0 Z1894307606,O[C@H](C[C@H]1C(NCc(cc2)ncc2OC(F)F)=O)CN1C(OCc1ccccc1)=O,2 F6374-0055,O=C(c(cccc1)c1Cl)N1CCC(CSc2ncccc2)CC1,0 S996-0739,CC(C)N1C[C@](CO)(CN(C2)C(CCCc3ccccc3)=O)[C@H]2CC1,0 F6443-6051,CCOc(cccc1)c1C(NCC(CCC1)N1c1nc(cccc2)c2o1)=O,2 Z2844931592,CCN(CC)Cc1cn(CC(N2CCC(C)CC2)=O)nn1,2 F6474-3097,O=C(C1(CCCC1)c1cccs1)N(CC1)CC1Oc1cccc2cccnc12,2 F6171-0122,O=S(CCOc1ccccc1)(Nc1cccc(Br)c1)=O,0 F5871-2188,O=C(c1cccs1)NCCN(CC1)CCN1C(NCc(cc1)ccc1Cl)=O,2 Z1223070667,Cc1noc(CNc2cc(C(NCC3)=O)c3cc2)n1,2 Z1233366274,O=C(c1cc(Oc2nccnc2)ccc1)NCc(cc1)ccc1-n1c(cccc2)c2nc1,2 D635-0050,CC1CN(Cc(c(O)c(cc2C3=C4CCCC3)Cl)c2OC4=O)CCC1,2 Z394507260,Cc1nnnn1-c1cccc(NC(c2c(C)nc(C(F)(F)F)cc2)=O)c1,2 Y043-5763,COc1cc(CCC2NC(CC3(CCOCC3)n3cccc3)=O)c2cc1OC,2 Z2646410062,CC[C@@H](CC[C@@H]1C)CN1C(CC(CCC1)CS1(=O)=O)=O,0 F5854-2108,COCCN(Cc1ccncc1)C(c1cccc(C(F)(F)F)c1)=O,0 F6436-3927,Cc1noc(C)c1CC(NCC1(CSCC1)OC)=O,2 F6451-2279,COC(CNC(C1(CCCC1)c(cc1)ccc1Cl)=O)c1cc(OC)ccc1,0 V027-8795,CC(C)NC(Nc(cc1)cc(CN(CC2OCCC2)C(CC(C)(C)C)=O)c1N(C)C)=O,0 Z1326340913,N#Cc(cccc1)c1N(CCC1)CCN1C(NCc1nocc1)=O,0 Z1100585215,Cc1nc(-c(cccc2)c2NC(N(CC2)CC2N(C)C)=O)no1,0 8017-1305,Cn(c(COc(cc1)ccc1OC)c(C(N1CCCCC1)=O)c1c2)c1cc(Br)c2OC,2 3966-0142,OC(c(cccc1)c1N(C(C1C2CC(Cl)=CC1)=O)C2=O)=O,0 Z1359448803,Cc(cc(s1)S(Nc(cc2)cc(C(OC)=O)c2F)(=O)=O)c1Br,0 Z4662167252,CN(Cc1nnc2n1CCN(C)C2=O)S(c1cc(CCCC2)c2cc1)(=O)=O,2 F829-0789,COc1cccc(-c2nn(C=CN(Cc3nc(-c(cc4)cc(Br)c4F)no3)C3=O)c3c2)c1,0 Z2594575597,O=C([C@@H]1C[C@H](C2)[C@H]2C1)NS(Cc1cnccc1)(=O)=O,2 V003-5196,CCC(C(N(CCc(cc1)ccc1F)C1)=O)Oc(cc2)c1cc2NC(Nc1ccc(C(C)C)cc1)=O,0 F6230-0018,O=C(c1noc(-c2ccco2)c1)NCc1c(cccc2)n2nc1,2 F6679-2648,O=C(NC1CCOCC1)N(CC1)CC1Oc(ccnc1)c1Br,2 F6510-2834,CN(c(ccc(NC(CCC(F)(F)F)=O)c1)c1N1C)S1(=O)=O,0 F6521-8430,CC(C)(Cc1ccc2)Oc1c2OCC(NCC(CCC1)(c(cc2)c1cc2OC)O)=O,2 F6296-1197,Cn(c(CNC(CN(C(CC1)=O)C1=O)=O)c1)nc1-c1ccncc1,2 F0921-6522,O=C(CCN(C(c(cccc1)c1N1)=O)C1=O)NC(CCC1)c2c1cccc2,2 Y031-3621,CCOc(cc1)ccc1N(CC(C1)C(Nc2nnc(C(F)(F)F)s2)=O)C1=O,0 F6037-0529,Cc(cc1)cc2c1[nH]c(C(C1)CN1C(c(o1)ccc1Br)=O)n2,2 Z2995045706,CC(COC1COCC1)NC(C)c1coc2c(C)cccc12,2 F2394-0888,Cc(c(NC(C(NCC1(CC1)c1cccs1)=O)=O)ccc1)c1Cl,0 F6436-0264,Cc(onc1)c1C(NCCN(CC1)CCN1c(cccc1)c1OC)=O,2 Z1889076542,CC(C)(C)Cc1n[nH]c(NC(c2c(Cc3ccccc3)n(C)nc2)=O)c1,2 Z1940080954,CCc(nc1)ncc1NC(C(C1CC1)OC)=O,2 F5330-0351,COc(cc1)cc(OC)c1NC(CCc1csc2nc(-c(cc3)ccc3Cl)cn12)=O,2 Z1652147305,Cc(ccnc1N(CC2)CCN2C(Cc(cccc2)c2F)=O)c1C#N,0 F6561-2613,O=C(c1cscn1)N(CC1)CC1OCC1CC1,2 F6240-5129,Cc(cccc1)c1S(NC1(CCCCC1)c1nc(-c2nccnc2)no1)(=O)=O,2 C239-0956,Cc1cc(Nc2c(-c(cc3)ccc3N3CCOCC3)nc3sccn23)cc(C)c1,2 F5857-4943,OC(CNC(c(cccc1)c1F)=O)C1CCCCC1,0 Z1609658200,OC(c1cc(CCNC(CC(c2ccccc2)NC(c2ccccc2)=O)=O)ccc1)=O,2 S591-0259,Cc(cc1)ncc1C(N(C1)CC1N(CC1CC1)C1CCOCC1)=O,0 S759-0211,CC(C)N(C[C@H]1OC)[C@@H]1C(CC1)CCN1C(NCc1ccccc1)=O,2 Y205-8748,O=C(Nc(c1nonc11)ccc1N1CCOCC1)Nc(ccc(F)c1)c1F,2 Z3392792773,Cc1n[nH]cc1CN(C)c1ncncc1,0 Z2319314609,O=C(C(N(CC1)CCN1C1CC1)=O)N1C(CCC2)C2CC1,2 F6481-3502,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CCSC1c1ccco1,2 F3215-0100,Cc(oc(-c1cccc(C(F)(F)F)c1)c1)c1C(Nc(cccc1)c1OC)=O,0 F6619-5827,COc1ccnc(N(CC2)CCN2c2nc(C3CC3)ns2)n1,0 F2670-0260,CC(N(CCC1)c2c1ccc(NC(C(Nc(cc1)cc(Cl)c1F)=O)=O)c2)=O,2 F6541-5899,O=C(C1CCOCC1)N(CC1)CCN1c1ccccc1,0 F6604-0852,CN(C(C1)CN1c(cc1)nn2c1nnc2)c1ncnc2cnccc12,2 F6389-0438,O=C(c1nccc(-n2cccc2)c1)N(CC1)CCN1C1CCCCC1,2 F6415-0079,CN(C)c1cccc(C(N(CCOC)Cc2cocc2)=O)c1,0 F6515-0807,O=C(CN1N=CC=CC1=O)NCc1cc(-c2cccs2)ncc1,2 Z4461918580,Cc1c(cccc2)n2nc1C(Nc(cc1)cc(C)c1NC(c1cnc2n1ccc(OC)c2)=O)=O,2 S728-0101,OCCC(C1)(C11CCOCC1)C(N(CC1)CCN1c1ccccc1)=O,0 Z1696268863,Cc1nc2ncnn2c(NCC(CCC2)c(cc3)c2cc3OC)c1,0 Z4559317127,C[C@@H](CN(CC1)C([C@H]2N(C)CCCC2)=O)c2c1ccc(Cl)c2,2 F0537-0492,O=C(c(cc1)cc2c1ncs2)Nc(cccc1)c1Oc1ccccc1,2 Z2025928692,C(C1CCCC1)c(n1CC2COCC2)nnc1N(CC1)CC1N1CCCCC1,2 T787-4797,CN(C)C(C(CN(C1)C(c(cccc2)c2Br)=O)C11CCOCC1)=O,0 F6658-5627,Cc1csc(N2CCC(COc3ncnc(C)c3C)CC2)n1,0 F6619-7652,CC(C)c1c(CN(CC2)CCN2c(cc2)nnc2-n2nccc2)nco1,2 F6743-6325,CN(C(CC1)CCN1c1nc(C(F)(F)F)cs1)S(C1CC1)(=O)=O,0 F371-0253,O=C(NC1CCCCC1)N(CC1)CCC1c1nc(-c(cc2)ccc2F)no1,0 SA22-0745,O=C([C@H](CC(C1)(F)F)N1C(C1)CN1C(c1ccccc1)=O)N(CC1)c2c1cccc2,2 F6543-1052,N#Cc1cc(Cl)c(N2CCN(CCF)CC2)nc1,0 Z3051006893,Cn(c(OC)c1)nc1NC(c1nn(CC(F)(F)F)cc1)=O,0 F6574-1633,O=C(c1c(C(F)(F)F)cccc1)NCc1nccnc1-c1cccs1,0 F6212-0017,Cn1c(SCCNC(c2c3OCCCn3nc2)=O)nnc1,2 F5857-2296,N#Cc1cccc(C(NCC(c2cccc3ccccc23)O)=O)c1,0 F6791-6886,Cc1cn(-c2ncnc(NCC3CCCCC3)c2)nc1,2 F708-0453,CC(CC1)(CCN1C(Nc(cc1)cc2c1OCCO2)=O)C(NCc1ccc(C)cc1)=O,0 S824-2184,Cc1noc(C)c1S(N(C[C@@H]1COC)C[C@@H]1c1ccncc1)(=O)=O,2 S932-2599,CCn1ncc(S(N(CC2)CC2n2nnc(COCC3CC3)c2)(=O)=O)c1,2 F5855-0884,CS(N(CC1)CCC1C(N(CC1)CCN1C(C(C1)C1c1cccs1)=O)=O)(=O)=O,2 C593-1159,CCN1CCN(CCCNC(c2cc(C(Oc3c-4cc(C)cc3)=O)c4s2)=O)CC1,2 Z1560594955,CC(C)N(CC1)CCN1c1cccc(NC(C2CN(Cc3cnccc3)CCC2)=O)c1,0 CM2432-2102,CC1(CC1)C(N(C1)C[C@@](CO)(CC2)[C@H]1CN2C1CCCC1)=O,2 M739-0217,O=C(Cc(cc1)ccc1Cl)N1C(COc(cc2)ccc2C(N2CCCC2)=O)CCC1,2 F6792-3601,CCc1cc(OCC2CCN(Cc3noc(C)n3)CC2)nnc1C,2 Z2009947745,CN(CC1)CC(c2ccccc2)N1S(c(c(Cl)ccc1)c1Br)(=O)=O,0 S511-1398,Cc1noc(C)c1C(N(CC1)CCC11OCCC(CC(N(C)C)=O)C1)=O,2 F3375-3043,C(c1nnc(-c(cc2)cc3c2OCCO3)o1)c1ccccc1,2 F6089-9802,O=C(NCC(CC1)CCN1c1nc(cccc2)c2s1)NC1CCOCC1,2 Z3408986049,C[C@H](C1)O[C@@H](C)c2c1c(C(N(C)Cc(o1)ccc1Br)=O)n[nH]2,2 Z2784868200,Cc1cn(CCC(NC2CN(Cc3ccc(C)cc3)CC2)=O)nc1,0 CM2346-1477,CC(C)N1CC2(CCCCC2)C(CNC(c2ccco2)=O)C1,2 Z809371688,O=C(Cn1nnc2c1cccc2)N(CCC1)C1c1ncccc1,2 Z2918597153,Cc1noc(N=CN2Cc3cnc(C)o3)c1C2=O,2 Z1669709412,N#Cc1cc(Br)cc(S(NC(Cc2cc(COC3)c3cc2)=O)(=O)=O)c1,2 Z372557110,O=C(c1c[nH]nc1-c1ccccc1)N(CCC1)CC1c1nnc2n1cc(C(F)(F)F)cc2,2 F2726-0544,Cc1cc(C)c(CC(N(CC2)CCN2c2nc(c(F)ccc3)c3s2)=O)cc1,0 L864-1732,CCNC(C(CCC1)CN1c1nc(N=CN(CC(NCc2ccco2)=O)C2=O)c2s1)=O,2 F6556-1265,O=S(CCc1ccccc1)(NCC1(CCSCC1)N1CCOCC1)=O,2 F1899-2418,Fc1cccc(Cl)c1CSc(cc1)nnc1-n1cncc1,0 Z3173791071,Cc(cc1)nn1-c(cc1)ccc1C(N1[C@H](CC(O)=O)CCC1)=O,2 Z1739114108,CC(C)CN(CC(O)=O)S(Cc1noc2c1cccc2)(=O)=O,0 T505-1517,O=C(c1cn(CCC(CCCC2)N2C(c2nccnc2)=O)nn1)N1CCCC1,2 SB57-1450,CCS(N(C1)CC(C2)(CN2C(NCCOC)=O)C1c1nc(C)no1)(=O)=O,0 Z2065562208,CCOc(nccc1)c1-c1nc(C2(CCCCC2)NC(C)=O)no1,2 F6709-4830,Cc1nccc(OC(C2)CN2C(C(C(OC)=C2)=CN(C)C2=O)=O)c1,2 F5033-7409,Cc1cc(C(NCC(CC2)CCN2C(Nc(cccc2)c2OC)=O)=O)c(C)o1,2 E216-5136,CCC(C1)Oc(ccc(Cl)c2)c2N1C(Nc(cc(cc1)OC)c1OC)=O,0 CM4297-5046,O=C(c1nccnc1)N(C1)CC1n1c(C2OCCC2)nnc1,0 SC11-0975,Cc(ccc(NC(N(CCCN1CCOCC1)C1CNCCC1)=O)c1)c1F,2 F6541-2474,Cc1nc(N(CCN2)CC2=O)cc(C(F)(F)F)n1,0 F6685-3814,O=C(C1OCCC1)NC(C1)CN1c1c2sccc2ncn1,2 Z1437541308,CN(Cc(o1)ccc1Br)C(c(cc1)cc(N2)c1N(CC(F)(F)F)C2=O)=O,0 Z2295392725,Cc(c(NC(N(CC(N1)=O)C2(CCCCC2)C1=O)=O)cnc1)c1Cl,2 Z737190938,Cc1c(C(NC2(CCCCC2)C(N)=O)=O)sc(-c2ncccn2)n1,2 D437-0665,CC1Oc(ccc(-c2c(C)sc(NC(c3cc(OC)ccc3)=O)n2)c2)c2NC1=O,0 S812-0704,Cc1cc(C)nn1CCC(N1C(C2CCCC2)c2nccn2CCC1)=O,0 S697-0489,Cc1cnc(C2CCOCC2)n1CC(CC1)CCN1C(Nc(cc1)cc2c1OCCO2)=O,2 F6517-0494,OC(CNC(Nc(c(F)ccc1)c1F)=O)c1ccc(-c2ccco2)o1,2 Z2894026722,CC(C)c(cc1)ccc1-c1noc(CC(CNCC2)S2(=O)=O)n1,0 S892-0045,Cc(cc(cc1)S(N(CCCC2)C2c2n[nH]c3c2COCC3)(=O)=O)c1F,0 F2740-0567,CCn1c(cccc2)c2c(NC(N(CC2)c3c2cccc3)=O)c1,2 F5865-0290,Cc1nc(N2CCOCC2)cc(NCCNC(c2ncccn2)=O)n1,2 E942-0307,CC(C)CN(C=C(c1c2cccc1)NC(NCCCN(CC1)CCN1c1c(C)ccc(C)c1)=O)C2=O,0 F1967-6708,Clc(cccc1)c1-c(cc1)nnc1N1CCNCC1,0 Z2435187747,Cn1c(COc(cc2)ccc2NC(CCC2CCNCC2)=O)ncc1,0 Z1449633900,CC(c1nc(-c(cc2)ccc2OC)no1)S(c1ccccc1)(=O)=O,0 F6656-2690,Cc(cc1)nnc1OCC(CC1)CCN1c1ncnc2ncccc12,2 F6514-7917,COc(cccc1)c1S(NCCn1nccn1)(=O)=O,0 Z1260121554,O=C(CN1N=C(C=CC=C2)N2C1=O)N1CC(Cc2ccccc2)CC1,2 L507-1067,Cc(n(C)c(-c1nc(C)c(C(N2CCOCC2)=O)s1)c1)c1S(N(C)Cc1ccco1)(=O)=O,0 F6363-0371,COc(nc1)ncc1NS(c(cccc1)c1Cl)(=O)=O,0 F432-0046,Cc1noc(C)c1S(Nc(cc(c(N1C)c2)N(C)C1=O)c2Sc1ccccc1)(=O)=O,2 Z1455290512,OC([C@H](CCC1)N1C(c(cc(cc1)N(CCN2)C2=O)c1Cl)=O)=O,0 Z2223284319,CC(c1cc(O)ccc1)NC(c1nsc2c1cc(C)cc2)=O,0 Z407921500,Cc(cccc1)c1C(NC(CC1)CCN1C(c(cc1)cc2c1[nH]nn2)=O)=O,2 Z2518331992,CC(Nc1cc(OCCN=C(NC)NC)ccc1)=O,0 F1711-0051,N#Cc(cccc1)c1NC(c1ccc(-c(cc2)cc(C(F)(F)F)c2Cl)o1)=O,0 K906-2938,COc(cc1)cc(OC)c1NC(CN(c(ccc(S(N1CCCC1)(=O)=O)c1)c1O1)C1=O)=O,2 Z1743865480,CC(C1CC1)n1ncc(Nc2nn3c(-c4ccccc4)nnc3cc2)c1,0 Z1048076682,Cc1nc(-c2cccc(NC(CCOC)=O)c2)no1,0 SA73-0806,Cc1nc(C(CC2CC2)(CC2)CCN2S(Cc(cc2)ccc2F)(=O)=O)no1,0 F6806-8100,CC(C)(C)NC(C(CC1)CN1C(N(C)C(N1C)=O)=CC1=O)=O,0 Z3965268335,O=C([C@H]1O[C@@H](Cc2ccccc2)CC1)Nc(cc1)ccc1N1N=NNC1=O,2 F2629-0036,CCOc(ccc(Br)c1)c1S(Nc1cc(-c(cc2)nnc2OC)ccc1)(=O)=O,0 F424-0945,O=C(CSC(n(c1c2)nc2-c2ccco2)=NNC1=O)N(CC1)CCN1c(cc1)ccc1F,2 F2724-1613,CN(C(C=C1)=O)N=C1C(Nc(cc1)ccc1-c(cc1)nnc1N1CCCC1)=O,2 SB29-0199,Cc1noc(C)c1CCC(N(C[C@H](C1)OC)[C@@H]1c1n[nH]c(C)n1)=O,2 M375-0131,COc1ccc(C2(CC2)c2nc(CCS(c3ccccc3)(=O)=O)no2)cc1,2 Z1429047543,CCC(N(CC1)CC1NC(CC1(CCCCC1)O)=O)=O,2 Z1352818064,CC(C)[C@@H](CO)NC(NC(CC1)CCN1C(c1ccccc1)=O)=O,0 Z2359033648,CC(Cc1cc(F)ccc1)N(C)S(c(ccc(C#N)c1)c1OC)(=O)=O,0 F2145-1032,Fc1cccc2c1nc(OC1CCNCC1)s2,0 SB23-0906,Cc1nn(C)c(CN(CC2)C[C@H](CN(C3)C(C4CC4)=O)[C@]23c2nc(C)n[nH]2)c1,2 F6276-0551,Cc1c(C(N(C2)CC2Oc2nc(cccc3)c3s2)=O)n(cccc2)c2n1,2 Z953915076,Cc1c(CNC(N(CCC2)CC2c2nc(C)no2)=O)c(C)nn1Cc1ccccc1,0 SA91-0030,CN(C(C12CCN(CCCO)CC2)=O)c(cc2)c1cc2C(N1CCCCC1)=O,2 Z1275925979,Cc1c(CNC(C2N(Cc3cnccc3)CCCC2)=O)c(C)nn1C,0 E776-1290,CC(C)CCNC(c(cc1)ccc1-c1nc(CS(c2ccccc2)=O)c(C)o1)=O,2 Z2295902099,CC(C)(C1)[C@H]1C(Nc(ccc(C(O)=O)c1)c1OC)=O,0 V025-3802,CC(C)C(c(ccc(OCC(NCC1CC1)=O)c1)c1N1CC2CC2)=CC1=O,2 F2205-0296,CC(C)(Cc1ccc2)Oc1c2OCc(cc1)ccc1C(NCC1OCCC1)=O,2 Z4513430055,Cc1nc(N(CC2)CCC2Oc2cncc(Cl)n2)nc(Oc2ccccc2)c1,2 Y200-1660,O=C(CN(CC1)CCN1C(C1OCCC1)=O)Nc(cc1)ncc1Cl,2 F5871-3268,Cc1cc(NC(C(CC2)CCN2C(COc(cccc2)c2F)=O)=O)no1,2 Y020-3925,COc(cc1)cc2c1[nH]c(C1)c2CCN1C(CC(N1c(ccc(OC)c2)c2OC)=O)C1=O,0 F6497-7760,CCOc(nccc1)c1C(N(CC1)CCC1c1n[nH]c(C(Nc(cccc2)c2F)=O)c1)=O,0 SA92-0875,Cc1nn(C)c(C(N(CCC2)CC2(c2nc(C3CC3)no2)F)=O)c1,2 Z2182683687,CC(C)N1CC(CNC(N2CC(Cc(cc3)ccc3F)(CO)CC2)=O)CCC1,2 E157-2132,O=C(c(cc1)ccc1Cl)Nc(s1)nnc1S(N(CC1)CCN1c(cc1)ccc1F)(=O)=O,2 Z1634653755,CN(Cc1cc(cccc2)c2o1)C(c(cc1)cc(OC)c1O)=O,0 Z1779169992,CC(C)Oc(cc1)ccc1S(N(C)CC1(CO)CC1)(=O)=O,0 Z3063570845,CCC(C(C(O)=O)O)NC(Cc(cc1)ccc1Br)=O,0 F6245-7276,O=C(C1Oc(cccc2)c2OC1)NCCN(C1=O)N=C(C2CC2)N1c1ccccc1,2 D715-1188,c12c(/C(=C\C(O1)=O)/C)c(cc1c2CCC(O1)(C)C)OCC(NC(C(=O)O)CC)=O,0 F6414-2061,CSc1ccc(C(CNC(c2cc(cccc3)c3o2)=O)O)cc1,0 F3225-6240,O=C(CN1CCOCC1)NC(Oc(cc1)c2cc1Cl)=C(c(cc1)ccc1Cl)C2=O,2 Y040-4674,Cc(c1c2)coc1cc(O1)c2C(C)=C(CCC(N2CCN(CCc3ncccc3)CC2)=O)C1=O,2 Z1630285669,O=C(c1c(cccc2)n2nc1)NS(C1COCCC1)(=O)=O,2 Z1614720918,O=C(c1c2nc[nH]c2ncc1)N1c2cccc(Cl)c2CC1,0 F6550-4554,O=C(c(cc1)ccc1-n1cccc1)N(C1)CC1Nc1ncccn1,2 Z4875065675,Cc1ccc(C(C2)N(C(CCCC(O)=O)=O)N=C2c(cc2)cc(OC)c2OC)o1,0 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Z2204817970,N#Cc1cccc(C2)c1CCN2S(c1csc(C(O)=O)c1)(=O)=O,0 Z5021905553,Cc1ccnc(N)c1NC(C1c(cc(cc2)Cl)c2OCC1)=O,0 E557-3721,CC(C)(c(cc(cc1)S(N(CCC2)C2C(NCCc2ccc(C)cc2)=O)(=O)=O)c1N1C)C1=O,2 F3407-3224,Cc(cc1)cc(Cl)c1NC(c1cn(Cc(cc2)ccc2NC(c(cccc2)c2F)=O)cn1)=O,0 F6349-0555,Cc1cc(C(N(CC2)CCN2C(c2c(cccc3)n3nc2)=O)=O)c(C)o1,2 Z1152086551,COc(cc1)ccc1-c1cc2ncnc(NCc3cocn3)c2s1,2 Z1980914346,CC(C)(C)c(cc1)ccc1OCCNc1c2ncn([C@@H]([C@@H]3O)O[C@H](CO)[C@H]3O)c2ncn1,2 F6541-5869,NC(C1N(Cc(cc2)cc3c2OCCO3)CCC1)=O,2 Y043-2192,O=C(CN(C(C=C1)=O)N=C1c1ccco1)Nc1nnc(C2CCCCC2)s1,2 5627-0023,CC(C)C(C1)OCc2c1c(C(N(c(cc1)ccc1OC)C(SC)=N1)=O)c1s2,0 F5011-0244,CCOC(Nc1nc(CC(N(CC2)CCN2c2cccc(Cl)c2Cl)=O)cs1)=O,0 Z4561574261,Oc1ccc(cccc2C(NC3(Cc(cc4)ccc4F)CC3)=O)c2n1,2 SB75-1123,CC(C)C(N(C[C@@H]1C[C@H](C2)NC(C3CCC3)=O)C[C@@]12c1nc(C)no1)=O,0 Z2015424001,Cc1cc(C(CNC(c2c(Cc3ccccc3)n(C)nc2)=O)O)cc(C)c1,0 F6616-1865,CSc1ccc(CN(C(CC2)C3)C2CC3O)cc1,0 F5476-0071,CN(C)C(CNC(c(cc(cc1)Cl)c1OC)=O)c1cn(C)c2c1cccc2,0 F6709-4851,Cc1nccc(OC(C2)CN2C(CCc2c[nH]c3c2cccc3)=O)c1,2 F0918-7025,C(C1OCCC1)Nc1nc(SCc2ccncc2)nc2ccccc12,2 F6562-9498,O=C(C1(CC1)c(cc1)ccc1F)NCc1nccnc1-c1ccco1,2 S651-0727,CN(CC(C1)(CC2)CCN2S(c2cccs2)(=O)=O)C1C(N1CCOCC1)=O,2 Z1983344438,CNS(Cc1ccc(CNc2nc(c(F)ccc3)c3n2C)cc1)(=O)=O,0 F6774-4073,COc(cn1)cnc1OC(CC1)CN1c1c(ccs2)c2ncn1,2 Z2949300740,Cc1cc(CN(C)CC(Nc2nnccc2)=O)cc(C)c1,2 Z1938209729,CC(C)(C(NCCc1nc(C2CCCCC2)cs1)=O)N1CCOCC1,2 F2669-0083,O=C(CC1)N(CCCc2c3)c2c1cc3S(Nc(ccc(Br)c1)c1F)(=O)=O,0 F6680-0867,Cc1nnc(N(C2)CC2NC(NC2CCOCC2)=O)s1,2 F3257-0267,CC(C)OC(CCCc1nc(cc(C)cc2)c2[nH]1)=O,0 F6573-1609,Cn1ncc(-c2nccnc2CNC(c(c(F)ccc2)c2Cl)=O)c1,0 Z54512106,CC(C=CC1=NC(COC(C(Cc2ccccc2)NC(c(cc2)ccc2Cl)=O)=O)=C2)=CN1C2=O,0 Z3351418983,CC(CC1CCN(Cc2c(CCCC3)n3c(C(F)(F)F)n2)CC1)C(O)=O,2 Z3543037698,Cc1ccc(cc(cc2)C(NC3CCOCCC3)=O)c2c1,2 Z2086869706,O=C(C(CCCC1)N1C1=O)N1c(cc1OCCOc1c1)c1Cl,0 SA04-0086,CCn1nc(C)c(-c2cc(C(N(CCC3)CC3c3nc(C)ncc3CO)=O)no2)c1C,2 Z1625595211,OCC(c1ccc(C(F)(F)F)cc1)NC(C(C(c1nc(cccc2)c2s1)O)O)=O,0 Z4662217934,Cc1nccc(NCc(cc2)ccc2-c2ncc[nH]2)n1,2 F6574-0252,O=C(c1cc(Oc2ncccc2)ccc1)NCc1nccnc1-c1cocc1,2 F6743-8080,CC(C)(C)C(N(C)C(CCC1)CN1c(nc1)ncc1OC)=O,0 Y044-0687,O=C1N(C(CCc(cccc2)c2N2)C2=O)C=Nc(cc2)c1cc2Br,2 Z2018039259,Cc1c(NC(NCCC2CCC2)=O)nnn1Cc1ccc(C(F)(F)F)cc1,2 F6359-4836,COc(nccc1)c1C(N(CC1)CCC1Oc(nccc1)c1Br)=O,0 F6726-0349,O=C(C1COCC1)N(CCC1)CCN1c1nn2c(-c3cccc(F)c3)nnc2cc1,2 S431-1243,Cc1noc(C)c1CC(N(CC1)CCC1(C1)OCCC1N1CCN(C)CC1)=O,2 Z354313600,Cc1nc2nc(C(F)(F)F)nn2c(N(CC2)CCN2C2CCCC2)c1,2 SA66-0981,O=C(c1cccs1)N1CC(CCc2noc(C3CCOCC3)n2)CCC1,2 F6660-0436,Cc(nc(c1c2)N3CCSCC3)cn1nc2C(Nc(cc1)cc(F)c1OC)=O,2 SC72-0625,CCCS(N(C1)CC11OCc2c1cnc(-c1ccccc1)n2)(=O)=O,0 Z2146719828,Cc1ncc(C(CC2)CCN2C(c2cn(C)nn2)=O)cc1,2 V026-9458,O=C(c1cccc(CN(C(CC(c(cc2)ccc2F)N2)=O)C2=O)c1)NCCc1ccccc1,2 F6540-5990,O=C(c(ccnc1)c1F)N(C(CC1)C2)C1CC2F,0 F6562-2410,O=C(C1CC=CCC1)NCc1cc(N(CCC2)C2=O)ncc1,2 SA93-0980,COCCC(CCC1)(CN1C(CC1)CCN1S(Cc(cc1)ccc1F)(=O)=O)C(N)=O,0 F6474-3843,Cc1nn(C)c(C(N(CC2)CCC2Oc2cccc3cccnc23)=O)c1,2 Z1643463919,CC(Cc1n[nH]c(C)c1)NC(N1CC(Cc2ccncc2)CC1)=O,2 Z2639723354,Cc(c(Cl)cc(NC(C(CC1)CCN1C(c1cnccc1)=O)=O)c1)c1Cl,2 SC12-0617,O=C(c1n[nH]c-2c1CCc1c2cccc1)N(CCCN(CCC1)C1=O)C1CCOCC1,2 Z3462495484,C[C@](C1)(C[C@@H]1Nc1c(C#N)nccc1)O,2 Z1501233169,OCc(cc(CNC(c(cccc1)c1-c1ccc(C(F)(F)F)cc1)=O)cc1)c1F,0 F6559-6487,Cc1nc2ncnn2c(NC(CC2)CCN2c2ncnc3c2CCCC3)c1,2 F6727-8519,CS(c(cccc1)c1C(N(C1)CC1N(C(C=C1)=O)N=C1c1cc(F)ccc1)=O)(=O)=O,0 F6245-4779,CN(C1=O)N=C(C(CCC2)CN2C(C(C=C2)=NN(C)C2=O)=O)N1c1ccccc1,2 F5854-4639,COCCN(Cc1cscc1)C(c1ccco1)=O,2 7656-0899,CC(C)c1ccc(Cc2cnc(NC(C(Cc3c4cc(C)cc3)OC4=O)=O)s2)cc1,0 F6574-0036,CN(C=CC=C1C(NCc2nccnc2-c2cocc2)=O)C1=O,2 S633-0156,CN(CCC1)C1c1nc(C(C2)CN2C(CN(c(cccc2)c2O2)C2=O)=O)no1,2 Z3518505990,CN(C[C@@H]1c2cncn2C)C[C@@H]1NC([C@]1(C2)[C@@H]2[C@H](CC2)N[C@H]2C1)=O,2 V029-4909,CCc1nc(C2CC2)nc(N(CC2)CCN2C(NC(C)C)=O)c1Cc(cc1)ccc1F,0 Z1449559124,CCCNC(CSc1c(cnn2-c(cc3)ccc3Cl)c2ncn1)=O,0 F6678-8698,Cc1nc(cccc2)c2n1C(C1)CN1C(CCc1nc(-c2ccccc2)no1)=O,2 Z2389829527,CC(CC1(C2)CCNCC1)N2S(CCC1CC1)(=O)=O,2 Z804408554,Cn(c(C(N(CC1c2ccccc2)Cc2c1cccc2)=O)c1)c(N(C)C(N2C)=O)c1C2=O,2 Z4435904229,Cc1cccn2c1ncc2CC(NCc(cc1)ccc1S(C)=O)=O,2 F6677-1482,CCc1nccn1CC(C1)CN1c1nccn2nccc12,2 F3398-3598,CC(C)(C)OC(CN(C=Nc1c2scc1-c(cc1)ccc1Br)C2=O)=O,2 Z2963482472,CCC(CC)(CNC1=O)C1NC(c1cnc2n1CCOC2)=O,2 Y044-3134,O=C(CN(C1)c(cc(cc2)Cl)c2OC1=O)Nc1nnc(C2CC2)s1,2 F6359-2146,COc(cccc1)c1OCC(N(CC1)CCC1Oc(cc1)ncc1C#N)=O,0 Z1426648185,CCC(N(CC1)CC1NC(c(cc1)nn1-c(cc1)ccc1F)=O)=O,2 S969-0133,CCN(C(CC1(CC2)CCN2S(c(cccc2)c2F)(=O)=O)C(NCCOC)=O)C1=O,0 F6549-7172,O=C(CN(C=NC(C1CC1)=C1)C1=O)N1CC(CN(C(CC2)=O)C2=O)C1,2 Z1632302159,COC1(CNC(NCC2CCN(CC(c3ccccc3)O)CC2)=O)CCC1,2 F6452-0062,CC(CNC(c1cn(C)nc1OC)=O)(c(cccc1)c1F)OC,0 Z2955084775,CCn1c(CCN(CC(Nc2c(C(C)(C)C)cccc2)=O)C2)c2nc1,0 F6773-2941,COc(cc1c(N(CC2)CCC2Oc2nccs2)ncnc1c1)c1OC,2 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F1791-2456,OC(CCC(N(C(C1)c(cc2)ccc2Br)N=C1c1ccco1)=O)=O,0 SA05-0871,Cc1nnc(C2C(N3CCCC3)=O)n1CCN2C(c1ccco1)=O,2 Z3950270230,Cc1c(C)sc2ncc(C(NC3CC(CC4)SC4C3)=O)n12,2 Z1971360835,CC(C)n(cc1)nc1NC(N1CC(CO)C1)=O,0 SA68-0931,Cc1noc(C)c1CC(NCCN(C(CC1)CCN1C(C1CC1)=O)C1CCOCC1)=O,2 V021-4452,CCC(C(N(C)Cc1ccco1)=O)Oc1cc(C(c2ccccc2)N(CC2)C(CC(C)C)=O)c2cc1,0 Z442422646,CNC(c1cccc(NC(C(CCC2)CN2C(Cc(cc2)ccc2F)=O)=O)c1)=O,0 Z411110938,Cc(cc(cc1)N2CCN(C)CC2)c1NC(N(CC1)CC=C1c1c[nH]c2c1cccn2)=O,2 Z2329126501,CC(C)(C1)OCCN1C([C@@H](C1)[C@H]1c(cc1)ccc1Cl)=O,0 Z3407804903,COC(c1ccc(CNC(CC2(CC2)N)=O)o1)=O,2 Y040-5152,CC(c(ccc(OCC(CN(CC1)Cc(cc2OC)c1cc2OC)O)c1)c1O1)=C(C)C1=O,2 G508-0085,O=S(c(cc1)ccc1N(CCCC1)S1(=O)=O)(Nc(ccc(F)c1)c1F)=O,0 Z1527196727,NC(C(CCCC1)N1C(CCn(cc1)c(cc2)c1cc2Cl)=O)=O,0 F2814-1894,Cc(cc1C)cc2c1sc(N(CC1)CCN1C(CCCS(c(cc1)ccc1OC)(=O)=O)=O)n2,0 F6519-4227,O=C(c(cc1)cc2c1ncs2)NCC(c1cccs1)n1nccc1,2 K906-1602,CC(C(N(CC1)CCN1c(cc1)ccc1Cl)=O)NS(c(cc1)cc(C(N2C)=O)c1N(C)C2=O)(=O)=O,2 Z3008764056,CN(C)C([C@H](CCC1)N1S(c(cccc1C(O)=O)c1F)(=O)=O)=O,0 P349-1225,O=C(CCNc1c(-c(cc2)ccc2F)nc2n1ccnc2)NCC1OCCC1,2 Z1758849544,CN(CC(N=C(N)N1)=CC1=O)C(CC1)CN1c1nc(C#N)ccc1,0 Z2708117300,O=C(NC1CC2(CC2)C1)Nc(cccc1)c1F,2 Z2313471945,CCOCC1N(CC(Nc2cc(C)nn2-c2nc(C)cc(C)n2)=O)CCCC1,2 Z1443033616,CN(C)c(ccc(C(Nc1nnc(-c2ccncc2)s1)=O)c1)c1F,0 F6523-3239,O=C(c1cc(Br)cnc1)NCCN(Cc(cc(cc1)F)c1OC1)C1=O,0 SC97-0801,O=C(C1(CC1)c1ccccc1)N(CC1)CC1(CN(Cc1cccc(F)c1)CC1)NC1=O,2 F6747-6016,COc(cc1)cc2c1nc(N1CC(Cn3ncc(Cl)c3)C1)s2,0 F6805-3694,COc(cc1)cc(N=CN2CC3CCN(CC(Br)=C)CC3)c1C2=O,0 Z1685137197,Cn1nccc1Cc1noc(CCC2CCC2)n1,2 V020-5803,O=C(c(c(F)ccc1)c1F)N(CC1)Cc2c1nc(N1CCOCC1)nc2Oc(cc1)cc(F)c1F,0 SC96-0866,COCCCN(C1(COCC1)CN(CC1)C(c(ccc(OC)n2)c2OC)=O)C1=O,2 V027-9981,CC(CN(CC1)c2ncnc(Oc3cc(F)ccc3)c2)N1S(c1ccc(C)cc1)(=O)=O,0 Z2012557068,CS(N(CC1)CCC1N(CC(F)F)C(CN(C(c(cccc1)c1N1)=O)C1=O)=O)(=O)=O,2 Z2755585265,Cc1noc(C2(CCOCC2)NC(CCc(cc2)ccc2C(O)=O)=O)c1,2 F6416-9091,OC(CCNC(c1cc(Br)cnc1)=O)c1cc(Cl)ccc1,0 Z2505914846,CC1(C)c2nc(Cl)nc(N(CCC3)CC3S(NC)(=O)=O)c2CCC1,0 Z3341642824,Cc1conc1Cn1nnc(C2(C(F)(F)F)NCCC2)n1,2 Z2951705193,O=C1NC(CN(CCC2)CC2c2c[nH]c3c2cccn3)=Nc(cc2)c1cc2Cl,2 F6519-4537,O=C(C(NCc(cc1)ccc1F)=O)NCC(c1cccs1)n1nccc1,2 Z1418813476,COc1cc(NC(C(C=CN2)=CC2=O)=O)cc(OC)c1,0 Z2446979424,CC1N(Cc2cc(C3CCNCC3)no2)CCNC1,2 Z1952143612,CC(CNC(Cc(cc1)cc2c1[nH]nc2)=O)N1CCN(C)CC1,2 F6788-9219,CN(C(CC1)CN1c1nc(cncc2)c2s1)S(C)(=O)=O,2 E228-3021,CN(CC1)CCN1C(CCCN(c(cc(cc1)Br)c1-n1c2ccc1)C2=O)=O,2 F6806-6332,CCOc(cccc1)c1NC(CN(CC1)CCC1NC(C(C)(C)C)=O)=O,0 Z2204888616,COc1nccc(-c(cc2)cc3c2ocn3)c1,2 F2889-0325,CS(c(cc1)ccc1NC(C1(CCCC1)c(cc1)ccc1Cl)=O)(=O)=O,0 F6523-0577,Cc1nc(C(F)(F)F)cc(N(CC2)CCN2C(c2cc(cc(cc3)Cl)c3[nH]2)=O)n1,2 F6796-3374,CC(C)(C)c(nc1cc2)cn1nc2OCC1CN(Cc2nc(C)no2)CC1,2 F1470-0046,COc1ccc(C=C(C(Nc2ccccc2)=O)SC2=O)c2c1OC,0 Z3302127020,CC(C)(Cc1ccc(CN)cc1)C(O)=O,0 Z2394027488,CC(C)c1nn(C)c2c1cc(C(Nc(cc1)ccc1OCCN)=O)s2,0 Z2892181797,O=C(c(cncc1)c1Nc1ccccc1)NCC(CCCN1)C1=O,2 Z4379567920,O=C(c1ccc(-c2n[nH]nn2)o1)N1C2CCC1CC2,2 Z1170106431,COc1cc(-c2noc(C3CC3)n2)cc(Cl)c1OC,0 Y043-1528,N\1(C(c2c(\C=N1)cccc2)=O)CC(N[C@@H](C(=O)O)c1ccccc1)=O,2 F6245-0322,O=C(NC1CCCCC1)N(CC1)CCC1c1nnc(C(F)(F)F)o1,2 S582-0379,COCCN(C(CNC(Nc1cccc(F)c1)=O)Cn1c2ccc1)C2=O,0 F6523-2978,CCn1c(-c2noc(CNC(c3nn(CC)cc3Cl)=O)n2)ccc1,2 L422-0364,Cc(cc1)ccc1C(Nc(cc1)ccc1OCc1cc(C(NC2CCCCC2)=O)no1)=O,0 F6482-2418,COc(cc1)cc(OC)c1NC(NC1CC2OCCOC2CC1)=O,0 Z3202074207,O=C(C(C(C1)CC2)C12c1ncccc1)N1Cc2c(C(F)F)[nH]nc2CC1,2 F6464-0695,CC(C)NC(N(CCCC1)CC1c(cc1)ccc1Cl)=O,0 V018-5581,Cc1cccc(-c2nc(C)c(Cc3ccccc3)c(N(CC3)CCN3C(N(C)C)=O)n2)c1,0 Z3653877312,O=C(CN(Cc1nc(-c2ccc(C(F)(F)F)cc2)no1)C1)N2C1COCC2,2 Z648277960,CCCc1c(C(N2CCN(CC(NC)=O)CC2)=O)[nH]c(C)c1C(C)=O,0 F6178-5865,O=C(NCC(CC1)CCN1c1nc(cccc2)c2o1)Nc(c(F)ccc1)c1F,0 S810-0227,Cc1nc(C(C2)C2(CC2)CCN2S(c2cc(F)ccc2)(=O)=O)no1,2 Z2755341268,OC(C(Cc1cc2ccccc2cc1)CNC(C(C1C2)C1c1c2cccc1)=O)=O,2 F6560-3166,CC(C(NCc1cn(-c2cccs2)nn1)=O)Oc(cccc1)c1F,0 Z1318994532,CC(C)CNC(C1(CCCC1)NC(Cn1c(cccc2)c2c(C(N)=O)c1)=O)=O,0 F5857-1076,Cn1c(C(CNC(C(Nc(cc2)cc(Cl)c2F)=O)=O)O)ccc1,0 F3406-7261,CCC(N=C(C)N1CC(Nc2c(C)ccc(Cl)c2)=O)=CC1=O,0 F6656-3307,C(C(CC1)CCN1c1ncnc2c1CCC2)Oc1nnc(C2CC2)cc1,2 Z4107123267,C[C@H]1O[C@@H](C)c2nn(C)c(C(NCc3nnc(cc4)n3cc4Cl)=O)c2C1,2 Z2129921048,COCCN(CC1)CCN1C(NC(C(CC1)C2)C1Cc1c2cccc1)=O,2 SB55-0550,CC(C)Cc1nc([C@@](CCC2)(C3)[C@@H]2CN3C(CCn2cncc2)=O)no1,2 SC66-0398,O=C(c1nc2ccccc2cc1)N(C1)CC2(CCOCC2)C1c1nncn1C1CC1,2 Z1023883172,CC(C)(C)n1ncc(C(Nc(cc2)cc(-n3nnnc3C)c2OC)=O)c1,0 Z2060676868,CC(C)(c1nc(C)no1)NC(c1c(C)nc(C(F)(F)F)cc1)=O,0 Z1385453412,CNS(c1csc(C(N(CCCCC2)c3c2cccc3)=O)c1)(=O)=O,2 F6240-7000,O=C(Cn1cncc1)NC(CC1)CCN1c1nc2cccnc2s1,2 M952-0671,Cc([nH]c(C)c1S(N2CCCC2)(=O)=O)c1-c1nnc(C2CC2)o1,2 J031-1348,CC(c(cc1)cc2c1OCCCO2)NC(Cn1c(cccc2)c2c(C(C2CC2)=O)c1)=O,0 Z2625375585,O=C(N[C@H]1[C@H](CC2)O[C@H]2C1)Nc1nc(C2CC2)ns1,0 Z1238841722,CCc(cc1)ccc1C(NC1(CC(O)=O)CCCC1)=O,0 F6608-1252,Cc1nc(CCC2)c2c(OC2CCSCC2)n1,2 SB59-0622,Cn1c(C2C(C3)(CN3S(C)(=O)=O)CN(Cc3ccccc3)C2)nnc1,0 F5607-0011,Cc1nccn1-c1cc(NCCNC(Cc(cc2)ccc2OC)=O)nc(C)n1,2 Z3134116566,O=C([C@]1(CC2)[C@@H]2CNC1)N1Cc2c(C(F)(F)F)ncn2CC1,2 SB35-0014,Cc1n[nH]c([C@H](C2)N(Cc(cc3)cc4c3OCCO4)CC2(F)F)n1,2 Z1156044950,CCS(N(CC1)CCC1NC(NCC1(CCCC1)c1ccc(C(C)C)cc1)=O)(=O)=O,2 SB42-0200,C[C@@H](C(N(C)C[C@@H]1CN2Cc(ccc(F)c3)c3F)=O)N1C2=O,0 Z2977525709,Cc1cc(C(CC2)CCN2c(nccc2)c2C(N(C)C)=O)c(C)cc1,0 Z1277568546,Cn(cc1)nc1NC(N1CC2(CCCC2)CC1)=O,2 F6562-0057,Cc(cccc1)c1OCC(NCc1cn(-c2cscc2)nn1)=O,0 Z1952711884,CN(Cc1nocn1)C(c1cc(sc(N2CCCC2)n2)c2s1)=O,2 C753-1590,Cn1c(C(O)=O)c(CNC(CCC2)c3c2cccc3)c2c1cccc2,2 Z3687064503,Cc1c(C)cc(C2(CCOCC2)C(N[C@@H](CC(Cn2cncc2)C2)[C@H]2O)=O)cc1,0 SA92-0587,FC(CCC1)(CN1C1CCOCC1)c1nc(-c2cnccc2)no1,2 Z1014802268,CC(C)C(NCC(CCC1)CN1C(C(CC1=O)CN1c(cccc1)c1F)=O)=O,0 K292-0435,COc(cccc1)c1N(CC1)CCN1C(CSC(N(c(cc1)ccc1Br)C1=O)=Nc2c1scc2)=O,2 F6662-6660,Fc(cc1)ccc1N(CC1)CCN1C1CCSCC1,2 F6514-4066,O=C(c1csc(-c2ccccc2)n1)N(C1)CC1n1nnc(COc2ccccc2)c1,2 S606-0847,COc1ccc(C2(CC2)C(N(CC2)C[C@@H]2N(c(nccc2)c2N2)C2=O)=O)cc1,0 Z2643689587,CCN(C(C)=O)c(cc1)ncc1NC(C1CC1)=O,0 L409-0350,COc1cc(NC(NC(C(N(CC2)c3c2cccc3)=O)c2ccccc2)=O)cc(OC)c1,0 F5831-9897,Cc(cccc1)c1NC(NCC1(CC1)c1cccs1)=O,0 J030-1420,Cc(cccc1)c1Oc(cc(c1c2)Oc(cccc3)c3NC1=O)c2S(N(C)CCOC)(=O)=O,0 S722-2596,CCOC(CCNC(N1CCC(Cc2ccc(CN3CCCCC3)cc2)CC1)=O)=O,2 S984-0920,CN(C)C([C@@](CN(C1)C(c2ccccc2)=O)(C2)[C@@H]1CN2S(c(cc1)ccc1F)(=O)=O)=O,2 L949-0003,CCCNC(N(CCC1)C1c1nc(-c2ccccc2)no1)=O,0 L369-0052,Cc1cccc(-c2cnc(Nc3cccc(C(Nc(cc4)ccc4F)=O)c3)nc2)c1,0 Y044-5017,OCC(Cc1ccccc1)NC(C(CC1=O)CN1c1n[nH]c2c1cccc2)=O,0 Z1721211013,CC(C)OCC(C1)OCCN1C(c1cn2nnnc2cc1)=O,0 SA67-0155,Cc1nc(S(N2CC(CCc3noc(C)n3)CC2)(=O)=O)cn1C,2 F6513-5747,CCOc(nccc1)c1C(NCc1c(CCCC2)n2nc1)=O,2 Z1575873370,Cc1cc(C(NC2CN(CC(N)=O)CCC2)=O)nn1-c(cc1)ccc1OC,0 Z4956164472,Oc1cc(C(CC2)NC(c3nsc4c3cccc4)=O)c2cc1,2 F5607-0152,Cc1nccn1-c1cc(NCCNC(c2cccs2)=O)nc(C)n1,2 Z1550714187,OCC(N(CC1)CCN1C(c1c[nH]cc1-c(s1)ccc1Cl)=O)=O,0 F3406-4522,Cc(ccc(Cl)c1)c1N(CC1)CCN1c(nc1)nc(N)c1S(c1ccccc1)(=O)=O,0 F6805-3206,Cc1nc(cccc2)c2n1C(C1)CN1c1cnc(C(F)(F)F)cc1,2 F6677-1308,CCc1nccn1CC(C1)CN1S(c(cc1)cc2c1OCC2)(=O)=O,2 F6412-1646,O=C(CCC(NCC#CCOc1cccc(C(F)(F)F)c1)=O)c1ccccc1,0 F6561-1317,O=C(c1nn(-c2ccccc2)nc1)NCc1cncc(-c2ccco2)c1,2 F6670-6520,Cc1c(CCC(N2CCC(CN(C(C)=Nc3c4ccc(F)c3)C4=O)CC2)=O)scc1,2 J015-0296,O=C(c(cc1)ccc1NC(c(nc(cc1)-n2cnnc2)c1Br)=O)NCC1OCCC1,2 G217-0262,Cc1ccc(CNC(c(cc2)ccc2NC(N(CCCC2)c3c2cccc3)=O)=O)o1,2 F6574-0326,O=C(NCc1nccnc1-c1cocc1)OCCN1CCOCC1,2 SB15-0866,COCC(N(C1CCOCC1)C(CCC1)CN1C(c1cocc1)=O)=O,2 L228-0825,O=S(c1ccc(-c2cnc(C3CCC3)o2)s1)(NC1CCCCCC1)=O,2 F521-0434,O=C(c(nccc1)c1N1Cc2ccc(C(F)(F)F)cc2)N(Cc(cc2)ccc2Cl)C1=O,0 Z3686909138,Cc(cc1)c(C2(CC2)NC(C[C@@H](CNC2)[C@H]2O)=O)cc1Br,2 SA50-0116,CCc1noc(-c2nn(C)c(C3)c2CN3C(NC2CCCCC2)=O)n1,2 F1627-0266,Cc1ccc(Cn2c(SC)nc3c2cccc3)cc1,0 Z4592205933,Cc(cc1)ccc1-c(cc1)ccc1S(NC(C1CCCCC1)=O)(=O)=O,2 Z1620719310,O=C(Cc1cccc(F)c1)N1CC(Cc2ccccc2)C1,2 Z1123978334,Cn1nnc2c1ccc(C(N(Cc(cc1)ccc1Cl)C1CC1)=O)c2,0 SB66-0022,O=C(c1cc(Br)cnc1)N(C[C@H]1CCC2)C[C@@H]1NC2=O,0 F2545-0228,CC(C)CN(C(CC1)CS1(=O)=O)C(c1cc(C(F)(F)F)ccc1)=O,0 V027-1315,CCN(C(C)C)C(c(cccc1)c1N(CC1)CCC1NC(C1CC1)=O)=O,0 L110-1030,O=C(c(cccc1)c1N1Cc2nc(-c(cc3)cc(Br)c3F)no2)N(Cc2ccco2)C1=O,0 F6512-6814,Cn1ncc(S(N(CCC2)CCN2C(c(cc2)ccc2-n2cccc2)=O)(=O)=O)c1,2 Z2737142281,N#CC1=CC(CN(CC2)C(COc(cccc3)c3F)=O)=C2NC1=O,0 Z2519128952,Cc1cccc(C(NC(CC(O)=O)C(F)(F)F)=O)c1Cl,0 Z2361661394,CC(C)N(CC(O)=O)S(c(c(OC)c1)cc(OC)c1Br)(=O)=O,0 SB75-1274,CCS(N[C@H](C[C@H]1CN(C2)C(C3CC3)=O)C[C@]12c1nc(C)no1)(=O)=O,0 F5627-0036,CCNc1cc(NCCNS(c2cc3ccccc3cc2)(=O)=O)nc(C)n1,2 Z1739067534,CCCN(CC(O)=O)S(c1c[nH]c(C(C)C)n1)(=O)=O,0 F6178-3504,CN(C)c1cccc(C(NCC(CC2)CCN2C(c2cnccc2)=O)=O)c1,0 Z1193298383,Cc1c(C)nc(-c2ccncc2)nc1N1CC(C(OC)=O)OCC1,2 F6441-2535,O=C(Nc1ccc(C(F)(F)F)cc1)N(CC1)CCC1S(c1ccccc1)(=O)=O,0 F6404-4696,O=C(c1cc(OCc2ccccc2)no1)N(CC1)Cc2c1cccc2,2 Z3598519484,O=C(Nc1noc2c1CCCC2)N(CC1)CCC1n1ncc2c1cccc2,2 P511-0054,O=C(C=C1)N(Cc2cc(C(F)(F)F)ccc2)C=C1S(N1CCCC1)(=O)=O,2 F6448-2082,O=C(c(cc1)cc2c1ncs2)Nc1cn(CC2Oc(cccc3)c3OC2)nc1,2 G869-1353,Cc1nc(ccc(S(Nc(cc2)ccc2Nc2nc(N3CCOCC3)cc(C)n2)(=O)=O)c2)c2s1,2 F5759-0393,COc(cc1)ccc1-c1ncnc(N(CC2)c3c2cccc3)c1,2 SD61-0333,O=C(COc(cc1)ccc1F)N(C1)CC2(CCC2)C1C(NCc1ncccc1)=O,2 F2146-0584,Clc1c2nc(NCCCn3cncc3)sc2ccc1,0 Z3268495687,CC(C)(C)c1noc(-c2nn(CCCC3O)c3c2)n1,2 F6554-8420,Oc1nc2ccccc2c(C(N2C(C3)CSC3C2)=O)c1,2 F6814-2944,CC1N(Cc(ccc(F)c2)c2F)CCN(CCn2nncc2)C1,2 Z2631275856,O=C(c1nn(cccn2)c2n1)Nc(cccc1)c1OCC1CC1,2 P937-3354,O=C(Nc1ccccc1)N1CC(Cc2nnc(-c3cnccc3)[nH]2)CC1,2 S826-6350,CN(CC1)CCC1N(C[C@@H]1CO)C[C@@H]1c1nc(-c2ccncc2)no1,2 Z3633997999,CC(C)(C)C(N1CC(CN(c(ccc(Cl)c2)c2N2C)C2=O)CCC1)=O,2 Z2965039403,CC(CCN1)(C1=O)NC(c(cc1)ccc1-n1nc(C)c(Cl)c1C)=O,2 Z2362052552,CC(C)(CC1)Cc2c1nc(NC(N[C@H](CC1)CC[C@@H]1O)=O)s2,2 Z909237506,CC(C)(C)n1ncc(NC(c2c[nH]nn2)=O)c1,0 F6783-6106,CCc1nnc(cc2)n1nc2N1CC(CN(C2)c3nc(COC)ns3)C2C1,2 L694-0032,CN(c(ccc(S(N(CC1)CCN1C(C(CC1=O)CN1c1ccccc1)=O)(=O)=O)c1)c1O1)C1=O,2 Z2752917937,NC(C1)C2(CCC2)C1NC(c(c(F)cnc1)c1Br)=O,2 S640-5922,Cc1c(COC)c(C(N(C[C@@H]2C(N)=O)C[C@@H]2c2nc(COC)no2)=O)no1,0 Y205-8739,CC(CCCC1)N1S(c(cc1)ccc1NS(Cc1ccccc1)(=O)=O)(=O)=O,2 F2795-0605,CCc(cccc1)c1NC(C(NCc(cc1)ccc1F)=O)=O,0 Z4655951086,O=C1N(c2cnccc2)C(SCc2cnc(-c3ccccc3)o2)=Nc2c1cccc2,0 D216-2057,Cn(c(NC(NC(CCC1)c2c1cccc2)=O)c1)c2c1ccc(OC)c2,2 S639-0467,CN(C)C[C@@H](CN(Cc1ccccc1)C1)[C@H]1NC(NCc1ccccc1)=O,2 F6481-0810,Cn(cc1C(N(CC2)CCSC2c(cccc2)c2Cl)=O)nc1OC,0 D563-0579,COc(cc1)ccc1S(c1csc(C(C2)c3cnccc3)c1NC2=O)(=O)=O,2 F0370-0118,COc1ccc(C(C2)N(C3=O)N=C2c(cc2)ccc2-c2ccccc2)c3c1OC,2 S069-3992,O=C(Cc1cscc1)N(CC1)CC1c1noc(C2CC2)n1,2 Z825884102,O=C(Cc1ccccc1)N(CCC1)C1C(N(CC1)CCN1c1ncccc1)=O,0 F2135-1582,COC(c(cccc1)c1NC(CSc1c2c(Cl)cc(Cl)cc2ncn1)=O)=O,0 S721-0998,O=C([C@H](C[C@@H](C1)Oc2cnccc2)N1C(C1CCCC1)=O)NC1CC1,2 F2496-1383,O=C(COc(cccc1)c1F)OCc1noc(-c2ccco2)c1,2 SC72-0191,Cc1nc(COC2(C3)CN3C(C3CCC3)=O)c2cn1,2 Z932136304,Cc1c(CC(N(C)CC2CCCC2)=O)c(cccc2)c2[nH]1,2 F5889-0029,O=C(CNC(c1c[nH]c2c1cccc2)=O)N(CC1)CCN1c(cccc1)c1Cl,2 6158-0283,CCCN(C(C(CC(Nc1ccccc1)=O)S1)=O)C1=O,2 F6562-6024,CC(C)(C)SCC(CCCC1)N1C(C(CCC1)N1c1nc(cccc2)c2o1)=O,2 M566-0977,CN(c1ccnn11)C(C(CC2)CCN2S(Cc2ccccc2)(=O)=O)=CC1=O,2 F6438-3496,CN(C)c1nc(CNS(c(cc2)cc3c2OCCO3)(=O)=O)nc(N(C)C)n1,2 E646-4062,CC(CN(C1)S(c2ccccc2)(=O)=O)(C(NCc2ccc(C)cc2)=O)N(CCOC)C1=O,0 L589-2772,Cn1c(ccc(Cl)c2)c2c(CN(CC2)CCC2C(NCc(cc2)ccc2SC)=O)c1,2 F6478-3639,CCc(ncnc1OC(CC2)CN2C(c(cc2)ccc2S(N(C)C)(=O)=O)=O)c1F,0 Z2789085060,Cc1noc(NC(N(C2)C[C@@H]3[C@H]2COC3)=O)c1,2 Z1560496975,O=C(C(C1)C11CCCC1)Nc1nc(CN2CCOCC2)ccc1,2 Z1730123371,O=C(C(CCC1)CN1C(Nc(cccc1)c1F)=O)N(CCC1=NN2)CC1=CC2=O,2 Z3828741496,CC(C(C)N1CCOCC1)Nc1c2sc(N(C)C)nc2ncn1,2 F6727-8153,Cc1noc(C)c1S(N(C1)CC1N(C(C=C1)=O)N=C1c(cccc1)c1OC)(=O)=O,2 F6658-5562,Cc1c(C)ncnc1OCC(CC1)CCN1c(nc1)ncc1Cl,0 Z4121702749,O[C@H](CC1)CC[C@@H]1Nc1nc(ccc(C(NCc2ccccc2)=O)c2)c2n2c1ncc2,0 Z3289907063,O=C(CCC1)NC1c1cc(NCc2cn(-c3ccccc3)nc2)ccc1,2 F6014-0060,O=C(C(c1ccccc1)n1cccc1)NCc(cccc1)c1Cl,0 F6480-0840,O=C(c(s1)ccc1Cl)N(CCC1)CC1Oc1ccncc1,2 SB75-1349,CCS(N[C@H](C[C@H]1CN(C2)C(c3c[nH]nc3)=O)C[C@]12c1nc(C)no1)(=O)=O,0 Y600-2829,CC(CCC1)CN1c1nc(N(C)C(N(C)C2=O)=O)c2n1Cc(cc1)ccc1F,0 Z1591270084,CCc1cc(C(N(CC2)CCN2c2nc(C)ns2)=O)ncc1,0 F2784-0611,COc(ccc(NC(Cc(cc1)ccc1F)=O)c1)c1N(CCCC1)C1=O,2 P048-2574,Cc1nnc(cc2)n1cc2S(N(Cc1cc(OC)ccc1)c1cc(F)c(C)cc1)(=O)=O,0 F5023-0098,O=S(c(cccc1)c1Cl)(NCCCN1CC(c2ccccc2)OCC1)=O,2 Z3642234152,CC(C)c1cc(C(Nc(cc2)cc(CO3)c2NC3=O)=O)c(c(C)nn2C(C)(C)C)c2n1,2 F6469-2568,O=C(c(cccc1)c1OC(F)(F)F)N(CC1)CCN1c1ncnc(-n2ncnc2)c1,0 Z3091864390,CCCNC(CN(C1)[C@@H](COc2cnccc2)C[C@H]1OC)=O,0 Y042-7421,c1(nc2c([nH]1)cccc2)[C@@H](NC(=O)CCc1cc2c(OCC2)cc1)CC(C)C,0 K231-0380,COc(cc1)cc(C=C2c3nnc(Nc(cc(C(F)(F)F)cc4)c4Cl)s3)c1OC2=O,0 Z1848840990,CC(CC(NC(CCN1Cc(cc2)ccc2C#N)C1=O)=O)c1cnccc1,2 Z1391017304,CC(C)Cc1c(C(NC(CC(N2C(C)C)=O)C2=O)=O)sc(C)n1,2 F5882-5902,Cn(c(C(N(CC1)CCN1c1cc(C(F)(F)F)ccc1)=O)c1)nc1-c1cccs1,2 Z4119956642,COCCCNS(c(cc(NCCOC)nc1)c1F)(=O)=O,0 Z4368316181,O=C([C@@H](C1)[C@H]1C1CC1)NS(c1c2OCCCc2ccc1)(=O)=O,2 F6506-5216,OC(CNC(C(NCc(cc1)ccc1F)=O)=O)(C1CCOCC1)c1ccccc1,2 SA01-1215,CC(C)NC(c1c(C(CC2)CN2C(C2(CC2)c2ccccc2)=O)nc(N(C)C)nc1)=O,2 F6751-4259,Cc1nc(CN(CCN2Cc3ccccc3)CC2=O)co1,2 F6416-8565,CCSc(cccc1)c1C(NCCC(c1c(C)oc(C)c1)O)=O,0 Z3026725572,CCOC(c1c(C)sc(CCNC(C(C)C2CC2)=O)n1)=O,2 L310-0062,Cc1nc(CN(C(COc2c3)=O)c2cc(Cl)c3S(N(CC2)c3c2cccc3)(=O)=O)no1,0 S223-2345,O=C(NCC(CN(C1)S(c2cc(F)ccc2)(=O)=O)C11CCOCC1)N1CCCC1,2 Z1738654416,Cc([nH]nc1)c1S(NCC(Cc1ccccc1)C(O)=O)(=O)=O,0 F1967-2382,CC(C)Nc1nc(C(F)F)cc(-c(cc2)ccc2F)n1,0 SD62-0179,O=C(CCC(C1)C2(CCC2)CN1C(c1nccc2ccccc12)=O)N1CCCC1,2 F3202-0007,Cc1ccc(C(OCC(c(cc2)cc(OC)c2OC)=O)=O)o1,2 V003-7331,O=C(C(C1)C(CN(CC2)c(cc3)ccc3F)N2c2c1cc(C(F)(F)F)cc2)NC1CCCCC1,2 F6475-5386,Cc(ccnc1)c1NC(c1cc(OCC2CCOCC2)ncc1)=O,2 F1407-0330,CC(C)(CO)NC(CCCN(C)S(c1ccc(C)cc1)(=O)=O)=O,0 F6438-1822,Cc(c(C)c1)cc(C)c1S(NCc1nc(N(C)C)nc(C)c1)(=O)=O,0 Z2348024527,CC(C)(C1)CC1N(C)c1nnc(C)s1,2 F6529-3775,O=C(Cc(cc1)cc2c1OCO2)N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O,2 Z4549063145,Cn1c(N2CC(CNC(OCc3ccccc3)=O)CCC2)nnc1COc(cc1)ccc1Cl,2 Z1692692892,OC(CN(CC1)CCC1N1CCCCC1)C1COCC1,2 F6510-2617,CC(C)c(cc1)ccc1OCC(Nc(cc1)cc(N2C)c1N(C)S2(=O)=O)=O,0 F6802-6985,CS(NC1CN(CC(NCC2OCCC2)=O)CCC1)(=O)=O,0 Z2207443866,CC(C)c1cc(C(N(CC2)CC2(CO)c2ccccc2)=O)no1,2 S937-0254,O=S(c1cccc2nsnc12)(N(C1)CC1n1c(C2CC2)nnc1)=O,2 Z62485256,Cc(cc1NC(c(ccc([N+]([O-])=O)c2)c2Cl)=O)nn1-c1ccccc1,0 Z1416110296,O=C(c1cn(-c2cnccc2)nc1)NCC(C1CC1)NC(c1cn(-c2cnccc2)nc1)=O,2 Z7888168327,CN(CC1)CCN1C(C(O)=O)c1cc(OC)cc(OC)c1,0 Z2439956761,CN(C1CCNCC1)C(c(ccc(OC)c1)c1F)=O,0 Z1575836347,CCc1cnc(NC(c2ncccc2C(F)(F)F)=O)s1,0 Z1348065493,CC1(CCC1)C(NCc1nc(-c(cc2)ccc2Br)n[nH]1)=O,2 D754-0145,COc(cc1)nn2c1nnc2CCCC(NC[C@@H](CN(Cc1c2cccc1)C2=O)c1ccccc1)=O,2 Z1344586547,CC(CNC(c1c(cc(cc2)Br)c2nc(C)c1)=O)c1ccncc1,2 S904-1268,CC(C)C(N1Cc2nnc([C@H](C[C@@H](C3)O)N3C(c(cc3)cc(F)c3OC)=O)n2CC1)=O,0 F5773-1755,Cn(cc1C(Nc2nc(CCC3)c3s2)=O)nc1OC,2 F5343-0041,Cc(ccc(NC(C1(CCOCC1)c1ccccc1)=O)c1)c1F,2 F6662-5379,Fc(cccc1)c1N(CC1)CCN1c1ncnc(C2CC2)c1,0 Z808017310,CCC(C)NC(c(cc1)ccc1NC(C(N(CC1)CCN1c1ccccc1)=O)=O)=O,0 Z2012815667,CCS(N(CCC1)CC1C(N[C@@H](C1CC1)c1cc(C(F)(F)F)ccc1)=O)(=O)=O,2 F6418-0180,CC(C)(C(NCc1ccc(C(c2cccs2)O)s1)=O)Oc(cc1)ccc1Cl,2 F2542-0249,CCc(cccc1)c1-n1c2nc(N(C)C(N(CCC(OCC)=O)C3=O)=O)c3n2cc1C,2 Z2770989830,O=C(c1nc(C2CC2)no1)NCc(cccc1)c1OCC1CC1,2 SA50-0284,Cn(c(C1)c2CN1S(C)(=O)=O)nc2-c1nc(C2CC2)no1,2 F6471-7276,O=C(Cc1cccc2ccccc12)NCCCc1conc1,2 Z2219327758,Oc(cccc1CNCC(C2CC2)c2ccccc2)c1Cl,2 Y043-2188,O=C(CCn(cc1)c(cc2)c1cc2OCc1ccccc1)Nc1nnc(C2OCCC2)s1,2 V023-9086,O=C(c1ccc(C(F)(F)F)cc1)Nc(cc1)cnc1N1CCN(Cc(cccc2)c2F)CC1,2 F6675-6673,Cc1cc(C(NC(C2)CN2c2nccc(C(F)(F)F)c2)=O)no1,2 F6562-7686,Cc(cc1)cc(C)c1C(NC(CC1)C11CCOCC1)=O,0 SB21-1104,Cc1noc(C)c1C(N(C1)[C@H](Cn2nnc(C(N(C)C)=O)c2)C[C@@H]1F)=O,0 F1716-0175,Cc1cc(NC(Cc2c(ccc(Br)c3)c3ccc2OC)=O)ncc1,2 Y040-3462,OC(C(c1ccccc1)Oc(cc1)cc(O2)c1C=C(c(cc1)ccc1Cl)C2=O)=O,2 F6245-0146,COc1cccc(C(N(CC2)CCC2c2nnc(C(F)(F)F)o2)=O)c1OC,0 Z511524528,CC(Cn1nccc1)NC(N1CCN(Cc2cc(C)ccc2)CC1)=O,0 Z757043950,O=C(CCC1OCCC1)NC1CCN(Cc(cc2)ccc2F)CC1,2 F0919-2693,O=C(N1CCOCC1)Oc1ccc(cc(cc2)Br)c2c1,2 S700-1462,O=C(C1(CC1)c1ccccc1)N(C1)CC1c1nc(CCOCc2ccccc2)no1,2 Y043-6708,C(N1CCN(c2ccc(cc2)F)CC1)(N[C@H](C(Nc1cc(SC)ccc1)=O)C)=O,0 F6524-1174,Cc1noc(C)c1CCC(N(CC1)CCN1c1nccn2c1nnc2C)=O,2 Z2955182258,CC(C)CN1NC(CC(N(C2CC3)C3c3c2cccc3)=O)=CC1=O,2 Z4992009634,COCCCn1ncc(-c2cc(-c3ccccc3)ccc2)c1,2 Z1169880407,COc(cccc1)c1-c1noc(-c2nocc2)n1,0 Y040-6109,COc(cc1)cc(F)c1C(CC(c(cccc1)c1N1)(C1=O)O)=O,0 Z2299103875,COc(cc1)cnc1N(CC1)CCN1C(C(CC1)CCN1c1nccnc1)=O,2 Z2080030651,CN(CC1)C(Cc2ccccc2)CN1C(c1nccnc1C(N)=O)=O,2 F6477-5324,Cc(cc(cc1)OC)c1Nc1nc(CN(C(CC2)=O)C2=O)cs1,0 F2434-1350,O=C(c1ncc(-c(cc2)ccc2F)o1)NCCOc1ccccc1,2 SD07-0425,O=C(C1CCOCC1)NCc1c(COC2(CN(Cc(cccc3)c3Cl)CC2)C2)n2nn1,0 F5317-0062,CN(C=C1OCc2ccccc2)C(C(N(CC2)CCN2c2ncccc2)=O)=CC1=O,2 Z1129187862,CC1N(CCNC(c2cc(Cl)c[nH]2)=O)CCOC1,2 SA01-0968,CN(C)c1ncc(C(NCCOC)=O)c(C(CC2)CN2S(N(C)C)(=O)=O)n1,0 Z606-0750,O=C(C1(CC1)c1cccc(C(F)(F)F)c1)N1CCCCC1,0 F0532-0016,OCCOCCNc1ncnc2c1c(-c1ccccc1)cn2-c1ccccc1,0 F6524-2684,Cc1c(C(N(CC2)CC2c2noc(C(F)(F)F)n2)=O)scn1,2 F6507-8357,OC(CNC(COc(cccc1)c1F)=O)(CCC1)c2c1occ2,2 Z2954435554,CC1(CC=CC1)C(NCc1ccc(C(OC)=O)o1)=O,2 F6523-2109,Cc1c(C(N(CC2)CCC2N(C(c(cccc2)c2N2)=O)C2=O)=O)sc(C)n1,2 E567-0085,CC(CN(CC1)C(NCc2noc3c2cccc3)=O)N1c1ccc(C)cc1,0 SC04-0268,O=C(C1(CC1)c1ccccc1)N(CCC1)CC1OCCc1noc(-c2ccccc2)n1,2 F6791-8329,Cc1nn2c(N(CC3)CCC3c3nnc(C4CC4)o3)cc(C)nc2c1,2 F6553-1213,O=C(NCc(cc1)ccc1Cl)N(CC1)CC1c(cc1)cc2c1OCC2,2 F6713-6292,Cc1nn2c(N(CC3)CCN3c(cc3)nnc3-c3cccs3)cc(C)nc2c1,2 V010-2972,CC(CC1)CCN1C(C(C1CCCC1)N(CC1)CCN1C(Nc1cccc(Cl)c1)=O)=O,0 Y010-1318,Cc1ccc(CC(CC(N2c(cc3)ccc3Oc3ccccc3)=O)C2=O)cc1,0 SC58-0300,Cc1cnc(C2C(C3)(CN3S(Cc(cc3)ccc3Cl)(=O)=O)CN(C)C2)o1,0 F6515-0639,CC(C)(Cc1ccc2)Oc1c2OCC(NCc1cc(-c2cccs2)ncc1)=O,2 Z4921562972,CC(C=C1CNC(c2n[nH]c(-c3ccccc3)c2)=O)=CNC1=O,0 D578-0202,Cc1cc(Nc(cc2)ccc2NS(c2cccs2)(=O)=O)nc(NC2CCCCC2)n1,2 F6228-0318,COc1ccc(CNC(N2CCN(CCn3nccc3)CCC2)=O)cc1,2 F6430-0106,CC(C(Nc1ncnc(-n2nccc2)c1)=O)Oc(cccc1)c1F,0 Z1201005506,CC(NC(Cc(cc1)cc2c1OCCCO2)C(O)=O)=O,0 F0874-0084,CCOC(N1CCN(CC(COc(c(F)cc(Br)c2)c2F)O)CC1)=O,0 Z2783990332,O=C(c(cc1)cc2c1[nH]c(C(F)F)n2)NC1COC1,2 Z3642701385,CC1(C)OC(CCC2)(CN2S(c2csnc2)(=O)=O)NC1=O,2 F6414-0712,OC(CNC(C1(CC1)c(cc1)ccc1F)=O)c(cc1)cc2c1OCCO2,2 Z1603522808,Cc1ccc(CC(N(C)CC(N(CC2)CCC2C(O)=O)=O)=O)o1,2 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Z1270412406,CC(CNC(c1c(C)cco1)=O)(C(O)=O)O,0 Z4425232401,Cc1c(NC(c2cccc(S(N(CC3)Cc4c3cccc4)(=O)=O)c2)=O)[nH]nc1C1CCOCC1,2 Z2438040208,CC(C)(C(CC1)C2)C1(CS(NCCc1nc(C(O)=O)cs1)(=O)=O)C2=O,2 F0202-0029,O=C(c1ccco1)Nc1ncc(Cc(cc2)ccc2Cl)s1,2 S827-0592,O=C(c1nccnc1)N(CC(C1)(F)F)[C@@H]1c1nc(-c2ccccc2)no1,0 F6359-3366,O=C(C1(CCCC1)c(cc1)ccc1Cl)N(CC1)CCC1Oc1nnccc1,2 F6444-2606,COC(CC1C(OC)=O)CN1S(c(cc1)ccc1-c1cc(C(F)(F)F)ccc1)(=O)=O,0 SB57-0255,Cc1noc(C(C2)C(C3)(CN3C(NC3CCCC3)=O)CN2C(COC)=O)n1,2 F6525-6013,Cc1cc(C(NCCn2nc(C)c(-c3cccs3)c2C)=O)no1,2 Z1263704032,COc(ccc(NC(c1cn(C2CCNCC2)nn1)=O)c1)c1Br,0 F6203-0076,OCCC(CCNC(c1cc(cccc2)c2o1)=O)c1ccccc1,2 Z1724251461,CCOc1cc(N(CC2)CCC2C(N2CCCC2)=O)ncn1,2 F990-0268,COc1cc(-c2noc(C(c3c4cccc3)=NN(c(cc3)ccc3Cl)C4=O)n2)cc(OC)c1,0 Z2483023197,CNC(CC(CC1)CCN1C(C(O)=O)c1cccc(Cl)c1)=O,0 F6604-1184,Cc1nnc(cc2)n1nc2N(C1)CC1N(C)C(Cc1noc2c1cccc2)=O,2 T505-0191,C(Cn1nnc(-c2ccccc2)c1)C1N(Cc2cccnc2)CCCC1,2 J007-0134,Cc1ccc(C(CCCCC2)N2C(Nc(cc2)ccc2Cl)=O)s1,0 S233-0762,CN(C[C@](CCC1)(CC2)[C@@H]1N(C)C2=O)C(c1cocc1)=O,2 Z3832231895,O=C(C1C(c2cn(-c(cccc3)c3F)nc2)OCC1)NCc1cnccc1,2 G373-1534,Cc1c(CN2CCNCC2)nc(-c(cccc2)c2OC)o1,0 F5834-2197,Cc1cc(C(Nc2ccc(CC(N(C)C)=O)cc2)=O)no1,0 Z3019008676,O=C([C@]1(CNC2)[C@@H]2CCOC1)NC1CCCC1,2 Z1982364545,CN(C)C(C(N(CC1)CCC1N(C)CCCO)=O)c1cncn1C,0 E216-0838,O=C(C(CC1)CCN1C(N1c(cccc2)c2OCC1)=O)Nc(cccc1)c1Br,0 F3382-6035,Cc1cc(N(CC2)CCN2c(cc2)nnc2S(c2ccccc2)(=O)=O)c(C)cc1,0 G119-0761,CCCCNC(c(cc1)cc2c1n(CC)c(C)c2C)=O,0 Z2357303180,CC1C(CN)CN(CC(N(CC2)Cc3c2cccc3)=O)C(C)C1,0 F2157-1502,NCc1cn(-c(ccc(F)c2)c2Br)nn1,0 Z1607986583,CC(C)CC(C1)OCCC1NCc1c(C)nc2sc(C)cn12,0 F3407-4940,Cc1cccc(N(CC2)CCN2C(Cc2nnc(Nc3c(C)cccc3)s2)=O)c1,0 Z1082942688,CCn1c(C(CC2)CCN2C(CCC2CCCCC2)=O)nnc1,2 F084-0049,CC(CCc1ccccc1)NC(CCc(n1-c2c3scc2)nnc1N(C)C3=O)=O,2 Z1000019306,CC1CCN(CC(CCC2)CN2C(c2c(c(C)no3)c3nc(-c3ccc(C)cc3)c2)=O)CC1,2 F6439-4783,O=C(C1c(cccc2)c2Oc2c1cccc2)NCCn1nc(C(F)(F)F)cc1,2 Z1934856751,O=C(c1csc(Cc(cccc2)c2F)n1)N(C1)CN(C2CC2)C1=O,2 Z2041751405,OC(C1(CCCC1)NCc1c2OCCOc2ccc1)=O,2 Z912197810,CC(c1nnc(C)o1)OC(C1CCOCC1)=O,2 Z1262334402,CCC(C(Nc1ccc(C(C)C)cc1)=O)N(CCC1)C1=O,2 F6480-5549,Cc1c(CCC(N(CCC2)CC2Oc2ncncc2)=O)c(C)n[nH]1,2 F6764-1678,Cc1c(CN(CC2)CCC2c(ccc2c3)nc2ncc3-c2ccncc2)sc(C)n1,2 F6436-3050,CS(c1ccc(CCC(NCC(c2ccc(C(F)(F)F)cc2)O)=O)cc1)(=O)=O,0 Z1905798060,Cc1nn(C)cc1CN1CC(c2nnc(C)o2)OCC1,0 Y043-7279,O=C(c1cccc(NC(NC(CC2)CS2(=O)=O)=O)c1)Nc1nc(cccc2)c2[nH]1,2 Z736658622,CCCCN(CCO)C(C(C)n1ncc(Br)c1)=O,0 S531-0657,O=C(C(Cn1c2ccc1)N(Cc1ccccc1)C2=O)NC(CC1)CS1(=O)=O,2 Z1676433676,CCc(nnc(C)c1)c1C(N(CC1)Cc2c1[nH]c(cc1)c2cc1F)=O,2 Z2180869092,CC1(CNC(NCc2cncn2C)=O)CN(Cc2ccccc2)CC1,2 E958-0741,CC(CC1)CCN1c1nnc(-n2c(CN(CC3)CCN3c(cc3)ccc3F)ccc2)s1,2 Z744292992,O=C(C(C1)ON=C1c1cc(F)ccc1)Nc1cccnc1Cl,0 S985-1011,CCS(N(C[C@@H]1CN(Cc2ccccc2)C2)C[C@@]12C(N(C)C)=O)(=O)=O,0 SA58-0568,O=C(CN1CCOCC1)N1C(CCc2noc(C3CC3)n2)CCC1,2 8014-5172,CCC(C(Nc1noc(C)c1)=O)Sc1nc(CCCCC2)c2cc1C#N,2 6049-2336,CC(CC1)N(C(c2ccc(COc3cccc(Cl)c3)o2)=O)c(cc2)c1cc2F,0 G932-0626,CCOc(cc1)ccc1Nc1nc(N2CCN(CCO)CC2)nc2c1cnn2-c1ccccc1,0 F6796-7086,COCCn1c2ncnc(N(CC3)CCN3c3nccn4nccc34)c2nc1,2 F6822-2675,COc(ccc(CN(CC1)CCN1c1nc(c(F)cc(F)c2)c2s1)c1OC)c1OC,2 F6524-0570,O=C(NCCN(C=Cc1c2occ1)C2=O)NCC1OCCC1,2 F6436-2055,Cn1c(C(CNC(CCc2ccc(C(F)(F)F)cc2)=O)O)ccc1,2 F3395-0899,Cc1noc(C)c1S(N(CC1)CCC1N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1)(=O)=O,2 F6475-6261,Cc1cccnc1NC(c1cc(OCC2CC2)ncc1)=O,2 Y044-1751,COCc1nnc(NC(CN(C(c2ccccc2)Nc2c3cccc2)C3=O)=O)s1,0 Z1955825569,Cc1c(-c(cc2)cc(CC3)c2NC3=O)nc(NC(c2cccn3c2ncc3)=O)s1,2 F6512-2938,Cc1c(CN(CC2)CCN2C(c2cc(-n3nccc3)ccc2)=O)cno1,2 Z3827881639,NCCc1ccc(CNC(c2nnc(CCCC3)c3c2)=O)cc1,0 S555-1555,Cc1n[nH]c(C(N2Cc(cc(cc3)NC(C4CC4)=O)c3OCC2)=O)c1,0 SB57-0298,CCS(N(C1)CC(C2)(CN2C2CCCCC2)C1c1nc(C)no1)(=O)=O,2 Z4446503183,CC(C)N(CC1)CCC1NC(Cn1nnc(-c(cc2)cc3c2[nH]nc3)c1)=O,2 F6525-7233,Cc(n(CCNC(C(C=C1)=NN(C)C1=O)=O)nc1C)c1-c1ccco1,2 SB91-0319,CC(C)CNC(N(CC1)CC1N(CCN1CCCCC1)C(C1CC1)=O)=O,0 Z1934797345,Cn(c(C1CC1)c1)nc1C(Nc1cc(C2COCCC2)nn1C)=O,2 F3083-0067,CC(N(C)N(C1=O)c2ccccc2)=C1NC(N(C)c1ccccc1)=O,0 F6514-7795,O=C(c1cnc(C(F)(F)F)cc1)NCCn1nccn1,0 F6471-7781,Cc(n(-c1ccccc1)nc1)c1C(N(CC1)Cc2c1onc2)=O,2 Z2827123909,COCC1(C(N(CC2)Cc3c2cc(C(F)(F)F)cc3)=O)NCCC1,2 Z2982755430,OC1CCN(Cc2cn([C@H](CC3)c(cc4)c3cc4Cl)nn2)CC1,2 Z4924485626,Cc(cc1)nc(OC)c1C(NC1(CNC(CC(CC(N2)=O)C2=O)=O)CCOCC1)=O,2 S954-5149,NC([C@@H](CN(C1)c(cc2)cc(C(F)(F)F)c2C#N)[C@H]1C(CC1)CCN1C(CN(CCC1)C1=O)=O)=O,2 F6359-3225,O=C(c1ccccc1)c(cccc1)c1C(N(CC1)CCC1Oc1nnccc1)=O,2 Z4477315882,CC(C(N[C@H](Cc(cnn1C)c1O)C(OC)=O)=O)c1ccccc1,0 F6559-1473,Cn(c(C(NC(CC1)CCC1(F)F)=O)c1)nc1-c(cc1)ccc1F,0 Z4754712782,OC(CCC1)(CN1C(c1cncc2ccccc12)=O)c(cc1)ccc1Cl,2 F3329-0323,Clc(cccc1)c1-n1ncc2c1ncn1nc(-c3ccco3)nc12,2 F2531-0028,CCOc(cc1)ccc1-c(cc1)nnc1SCC(NCc1ccco1)=O,2 Z3402597529,CN(Cc1cccs1)S(Cc1noc(C2CC2)n1)(=O)=O,2 Z1668683401,Cc(onc1-c2ccccc2)c1-c1nnc(CN(CC2)CC3N2CCOC3)o1,2 SD67-0272,CC(C)CN(CC(N(CCC1)C2CN1C(c1ccc(Cc3c(C)onc3C)o1)=O)=O)C2=O,2 F6674-5466,CN(C=C(C(N1C)=O)N(CC2)CCC2NC(NCc(cc2)ccc2Cl)=O)C1=O,2 F6210-0189,O=C(c(o1)ccc1Br)NC(C1)CNC1=O,2 Z384068728,O=C(C(CCC1)CN1C(c(cc1)ccc1F)=O)Nc(cc1)cnc1N(CCN1)CC1=O,0 F6512-5350,Cc1nc(S(N(CCC2)CCN2C(c2cc(Br)cnc2)=O)(=O)=O)cn1C,2 F5033-0824,O=C(c1c(C(F)(F)F)cccc1)NCC1CCN(Cc2ccco2)CC1,0 Z1993870601,Cc(n(C)nc1C)c1S(N[C@@H]1CNCCC1)(=O)=O,0 F6752-7560,CC(C)(C)NC(C(CC1)CN1c1nc(C)ccc1C#N)=O,0 E632-2252,COc(ccc(NC(N1CC(CN(CC2)Cc3c2cccc3)CCC1)=O)c1)c1OC,0 F3411-5931,COC(c(cccc1)c1NC(CN(N=C(c1ccccc1)c1c2ccc(Cl)c1)S2(=O)=O)=O)=O,0 G856-6765,O=C(CSc1nnc(N2)n1C(c1ccccc1)=CC2=O)N(CC1)CCN1c1ccccc1,2 V017-2350,Fc(cc1)ccc1Oc1nc(N2CCOCC2)nc2c1CN(Cc1ncccc1)CC2,0 F5857-1073,Cn1c(C(CNC(C(NCc(cccc2)c2Cl)=O)=O)O)ccc1,2 Z1376329682,O=C(c(cccc1C(F)(F)F)c1F)NCCc1csc(-c2ccccc2)n1,0 Z3080530795,CC(C)(C)n1nccc1C(NC(Cc1ccccc1)C(N1CCCCC1)=O)=O,2 F2493-2829,O=C(c1ncccc1)NCc1noc(-c(cc2)ccc2F)c1,2 F6555-6541,O=S(c(cccc1)c1Cl)(N(C1)Cc2c1cccn2)=O,0 F5596-0747,O=C(Cc1cccs1)N(CC1)CCC1c1nnc(C2CC2)o1,2 F6725-0008,O=S(C(CC1)CCN1c1nc(C(F)(F)F)ccc1)(c1ccccc1)=O,0 Z738472958,Cc1ncc(CC(N2CCN(CC3CC3)CC2)=O)cc1,2 S384-0292,COc(cc1)cc(NC(c2c(COC(C3)c(cc4)ccc4Cl)n3nn2)=O)c1OC,2 F6451-0383,Cc1cc(NC(C(NCC(c(cccc2)c2OC)OC)=O)=O)no1,0 Z1903743776,CC(CN(C1)C(Nc2noc(-c3c(C)occ3)c2)=O)C1N1CCOCC1,2 F6559-0437,O=C(Cc1noc2c1cccc2)N(CCC1)CC1N(C=Nc1c2cccc1)C2=O,2 Z228217376,CN(CC1)CCN1c(cc1)ncc1NC(C(CCC1)CN1C(c(cc1)ccc1Cl)=O)=O,2 S893-0328,CCn1nc(C(CCC2)N2C(Nc2cccc(C(F)(F)F)c2)=O)c2c1CCOC2,2 Z3268511766,CN(C)c1nccc(C(N2CCC(Cc(cc3)cnc3N)CC2)=O)c1,2 Z2196271185,Cn1ncc(CN(CC2)CCN2C(C(c(ccc(Cl)c2)c2F)O)=O)c1,0 F6515-1841,O=C(c(ccc(Cl)c1)c1Cl)NCc1c(-c2ccco2)nccc1,0 F699-0420,O=C(C(CC1)CCN1C(C=C1)=NN(c(cc2)ccc2F)C1=O)NC1CCCCCC1,2 F6801-8011,CN(Cc1nnc(C2COCC2)o1)Cc(cc1)cc2c1OCCO2,2 F0647-0083,Brc1c2nc(N3CCOCC3)sc2ccc1,0 F6246-0113,FC(c1nnc(C2CCN(Cc(c(F)ccc3)c3Cl)CC2)o1)(F)F,0 F6482-2267,Cc(nc1)cnc1C(NC1CC2OCCOC2CC1)=O,2 C561-0772,CC(CCc1ccco1)NC(CCc1c(C)n2nc(C)c(-c(cc3)ccc3F)c2nc1C)=O,2 Z3137136345,CC(C)c1nnc(CNC(c2cc(C(CN)CCC3)c3cc2)=O)[nH]1,0 Z1497696650,Cc1ccc(CNC(c(cc2)cc(N3C)c2NC3=O)=O)s1,0 Z3105635921,O=C(C1NCc2c1cncn2)NCCc(cc1F)cc(F)c1F,2 F6212-0410,COC(C(C1)CN1C(c1c2OCCCn2nc1)=O)=O,2 F6443-7634,CCCc1c(C(NCC(CCC2)N2c2ccccc2)=O)snn1,2 D574-0152,Cc(cc1)ccc1Nc1nc(C)cc(N(CC2)CCN2C(Nc2cc(OC)cc(OC)c2)=O)n1,0 F2029-0320,O=C(c(cccc1)c1Br)NCCc1csc2nc(-c(cc3)ccc3Cl)nn12,0 F2880-1129,COc1ccc(C(CNC(c(cc(cc2)Cl)c2OC)=O)N2CCOCC2)cc1,0 F6435-1656,CS(C(CC1)CCN1S(c1cccc(Cl)c1)(=O)=O)(=O)=O,0 Z1315983015,Cc(nc1)cnc1C(N(C)C1CN(Cc2ccccc2)CCC1)=O,2 Z4767388687,O=C(c1cccn2ncnc12)Nc(cc1)cc2c1[nH]c(-c1ccco1)n2,2 K284-4765,Cc1c(CSC(N2CC(CC3)CCC3C(NCc3ccco3)=O)=Nc(cccc3)c3C2=O)cccc1,0 F6162-0239,O=C1N(CCNS(c2c(C(F)(F)F)cccc2)(=O)=O)C=NC(c(cc2)ccc2F)=C1,0 F5626-0049,Cc1nc(N2CCOCC2)cc(NCCNC(c(cc2)cc3c2OCO3)=O)n1,2 F6395-4212,CC(Nc(cc1)ccc1S(N1CC2(CCOCC2)OCC1)(=O)=O)=O,2 S892-1116,COCCn1nc(C(CCCC2)N2C(CCS(c2ccccc2)(=O)=O)=O)c2c1CCOC2,2 F5490-0706,Cn(cc1C(N(CCC2)CC2c2nnc(-c(cc3)cc4c3OCO4)o2)=O)nc1OC,2 F6390-3053,O=C(c1cc(cccc2)c2o1)N(Cc1cccs1)C1CCOCC1,2 F6524-6229,CSc(nccc1)c1C(N(CC1)CCN1C(CC1)CCS1(=O)=O)=O,0 L740-0337,O=C(CN(CCN(C1)C(Nc(cc2)ccc2Cl)=O)C1=O)N(CC1)CCN1c(cc1)ccc1F,2 F5832-8628,O=C(C(NCCC1=CCCCC1)=O)NCCc1csc(-c(cc2)ccc2F)n1,2 Z812407054,Oc1nc2ccccc2c(C(NCC2(CCOCC2)c(cc2)ccc2Cl)=O)c1,0 S613-0188,O=C(NCc1ccccc1)N(CCC1)C1c1nc(CCOCc2ccccc2)no1,2 Z1239445704,CCc1nc(C(CCCC2)N2C(c2cn(cccc3)c3c2)=O)no1,0 V012-3920,CC(C)(C)NC(N(CC1)CCN1c1nc(-c(cc2)ccc2Cl)nc2ccccc12)=O,2 F6512-1840,O=C(c(s1)ccc1Cl)NCc1nc(C2CCCCC2)cs1,2 Z1187724569,O=C(c1ccnc2ccccc12)NC(CCC1)CN1c1ncnc(N2CCOCC2)c1,2 SB75-1004,Cc1noc([C@@](C[C@@H](C2)NC(Cc3cnccc3)=O)(C3)[C@@H]2CN3S(C)(=O)=O)n1,0 Z3092238343,O=C(CC1CCOCC1)N(CC1)OCCS1(=O)=O,2 Z1685175485,Cn1ncc(cc2)c1cc2-c1noc(-c2cccc(NC(C(C3)Oc4c3cccc4)=O)c2)n1,2 Y501-4808,CCn1nc(C)c(S(NCCCn2nc(CCC3)c3c2C(F)(F)F)(=O)=O)c1,2 Z3686861168,C[C@H](C1)O[C@@H](C)c2c1c(C(N(CC1)CCC1c1c[nH]c3c1cccn3)=O)nn2C,2 SC56-0127,Cc1nnc(C2C(C3)(CN3C(c3cc(C)c(C)cc3)=O)CN(C)C2)o1,0 F6571-6172,CCN(CCN(C(NCC1(C=CCCC1)O)=O)C1=O)C1=O,2 Z2474819310,CC(CO)C(CC1)CCN1C(Nc1cn(Cc2ncccc2)nc1)=O,2 F6747-6409,CC(N1CC(CC2)CCN2c2ncnc(OC)c2)=Nc(cccc2)c2C1=O,0 F6261-4237,Cc1c(CNS(Cc2cc(C)ccc2)(=O)=O)sc(-c(cccc2)c2Cl)n1,2 SB91-0543,CN(C)S(N(CCN1CCCC1)C(CC1)CN1S(c1cc(F)ccc1)(=O)=O)(=O)=O,2 P681-0363,CN(C(C1(CC2)CN2C(NCc(cc2)ccc2OC)=O)=O)c2c1cccc2,2 G678-0728,O=S(CCNS(c(cc(cc1)F)c1F)(=O)=O)(N(CC1)CCN1c(cc1)ccc1F)=O,0 Z1987241838,OCCC(COCC1)N1C(c1c(C2CC2)occ1)=O,2 SD60-0194,Cn1c(C(N(C2)CC22OCC(CCOCc3cccc(F)c3)C2)=O)cnc1,2 SA66-1278,O=S(c1cc(CCC2)c2cc1)(N1CC(CCc2noc(-c3ccncc3)n2)CCC1)=O,2 F6543-8729,CCn1c(C)nc(S(N(C2)Cc3c2cccc3)(=O)=O)c1,2 L662-0621,O=C(c(cc1)ccc1Oc1ccnc(-c(cc2)ccc2F)n1)Nc(cc1)cc2c1OCCO2,2 S959-1031,O=C1N(CCNS(c2ccccc2)(=O)=O)CCC1N1CCOCC1,2 S808-0431,CNC([C@@](CC1)(CN(Cc(cc2)ccc2OC(F)(F)F)CC2)[C@@H]2N(C)S1(=O)=O)=O,0 Z3100379533,O=C(NCc(cc1)cc(F)c1-n1cncc1)N[C@@H]1COCC1,2 F6725-1313,FC(c1nc(N(C(CC2)C3)C2c2c3[nH]nc2)ncc1)(F)F,0 Z1612688935,Cc1nn(C)c(N(CCC2N(C(C(C3)N4C5C3CCCC5)=O)C4=O)C2=O)c1,2 Z1252398060,N#Cc1c(NCC2(CCOCC2)O)snc1Cl,0 Z1262680494,COC(c1c(C2CC2)cc(N)s1)=O,0 Z2910514762,OC(C(Cc1cc2ccccc2cc1)CNC(CCc1c[nH]cn1)=O)=O,2 8018-3202,CC1CN(Cc2cc(-c(cc3)ccc3OC)no2)CCC1,2 F5823-0006,CC(C)S(c1ccc(CC(N2CCC(Cn3nccc3)CC2)=O)cc1)(=O)=O,0 F6524-0953,CC(C)Sc1ccc(CC(NCCN2N=Nc(cccc3)c3C2=O)=O)cc1,0 E137-0047,CCOC(c1c(C)c(C(NC2CCCCCCC2)=O)c(C)[nH]1)=O,2 Z2957845675,CC1(C)OCC(C2)C12NC(Nc1ccnc2ccnn12)=O,2 Z2441053387,CC1NCCCC1NC(c1cccc(NC(NC2CC2)=O)c1)=O,2 F6556-8867,COc(ccc(C(NC(c1cscc1)c1cccs1)=O)c1)c1F,0 F6571-4275,CN(C)c1cccc(C(NCC(c2cscc2)OCCO)=O)c1,0 Z2960233831,CC(C)c(nc1)nc(C(NC[C@H](CCC2)[C@@H]2O)=O)c1Br,2 Z1984643100,Cn1ncc(C(C(F)(F)F)NC(c2cnnn2C)=O)c1,0 Z1130313727,Cc1c(CNS(c2cn(-c3ccccc3)nc2)(=O)=O)scn1,0 F6677-1411,CCc1nccn1CC(C1)CN1C(C(CCC1)c2c1cccc2)=O,2 F6562-1016,Cn1ncc(C(CN(C2)C(Nc3c(C(F)(F)F)cccc3)=O)c3c2cccc3)c1,0 F6726-0660,Cc1noc(C)c1C(N(C1)CC1N(C(C=C1)=O)N=C1c(cc1)ccc1Cl)=O,2 Z2936883714,CC(C)C(c1nc(C(C)(C)COC)no1)NC(c1ccc(C)cc1)=O,0 Z1609486476,OC1C(CNC(CCc(cccc2)c2C(O)=O)=O)CCCC1,2 L299-2420,CCc(c(-c1cc(S(N(CC2)c3c2cccc3)(=O)=O)c(C)cc1)c1NC(CC2)=O)nn1C2=O,2 F5854-4301,O=C(Nc1cccs1)N(Cc1cscc1)C1CC1,2 SB57-1338,Cc1noc(C(C2)C3(CN(Cc4ncccc4)C3)CN2C(COC)=O)n1,2 SC39-0030,FC1(CN(Cc(ccc(Br)c2)c2F)CC1)c1nc(C2CCOCC2)no1,2 S987-0505,CCOc(cccc1)c1C(N1C[C@](CO)(CN(C2)C(C(C)C)=O)[C@H]2C1)=O,0 V022-4341,O=C(COc(cc1)ccc1Cl)c(cc1)cc(N2Cc3ccc(C(Nc(cc4)ccc4F)=O)o3)c1OCC2=O,0 Z2849753517,Cc1cnc(C(NCC(CC2)OCC22CCOCC2)=O)c(C)c1,2 Z3009327084,Cn1nccc1S(N(CCC1)CC11Oc(cccc2)c2C=C1)(=O)=O,2 Z2797947222,CC(CCN1)(C(Nc2cc(NC(CN3CCCCC3)=O)c(C)cc2)=O)C1=O,2 Z1343762332,CN1CC(CN(CCC(N2)=O)C2=O)CCC1,2 S212-0927,COCCc1noc(COC(CCC2)CN2C(c2nccnc2)=O)n1,2 Z1238953654,O=C(Cn1ncc(Cl)c1)NCC(c1ccccc1)N1CCOCC1,0 Z1735151396,CC(CO)(CCC1)CN1C(NCc1nc2cccc(Cl)c2n1C)=O,2 V007-6428,CC(CN(CC1)C(CN(CCc2c3ccs2)C3c2ccc(C)cc2)=O)N1C(C(C1)C1c1ccccc1)=O,0 Z1927847136,CC(C)(CCCC1)C1C(N(C1)CC1OC(F)F)=O,2 F6200-1444,OC(Cc1ccccc1)CNC(NC1CCCCC1)=O,2 F6520-2053,COc1cccc(NC(NCCc2ccc(-c3cocc3)s2)=O)c1OC,0 SB52-1229,CN(CC1(C2)CCN(Cc3cn(C)nc3)CC1)C2c1noc(C2CCC2)n1,2 Z1943569484,CC(CNC(C1=CN(Cc2ccccc2)c(cccc2)c2C1=O)=O)(CC1)CCC1OC,2 SC69-0060,Cn1c(C(C2)C3(CCCC3)CN2C(c2c[nH]c3c2cccc3)=O)nnc1,2 F6675-8181,CN(Cc(cccc1)c1Br)C(C1)CN1c1nccnc1,0 S380-0183,CC(c1ccc(C)cc1)NC(CN(C(C1(CCCCC1)N1)=O)C1=O)=O,0 5542-0002,CC(C)(Cc(nc1SCC(Nc2cc(C)ccc2)=O)c2cc1C#N)CC2=O,0 F6441-4502,CS(C(CC1CC2)CC2N1C(c1nn(-c2ccccc2)nc1)=O)(=O)=O,2 CM4435-1646,COCCN(CCCC1)c2c1cc(C(NC(CC1)CS1(=O)=O)=O)s2,2 Z640297468,CC(C(Nc1nc(-c2c[nH]c(C(N)=O)c2)cs1)=O)Sc(cccc1)c1Cl,0 Z1672685025,Cn1ncc(C(Nc2cc(C(NCC3)=O)c3cc2)=O)c1N,0 Z2789864081,OC(c1cc(S(N(CC(F)F)CC2CCC2)(=O)=O)c[nH]1)=O,2 Z492220312,COc1ncc(CNC(N2CC(CO)CCC2)=O)cc1,0 S453-0090,O=C(CN(C(C1(CCOCC1)N1)=O)C1=O)Nc(cc(cc1)F)c1F,0 F6517-2073,C=CCCC(NCC(c1ccc(-c2cccs2)s1)O)=O,2 8014-1721,CC(C)CC(C(C1C(N2C(C)C)=O)C2=O)NC1(c(cccc1)c1N1C)C1=O,0 F5854-0641,COc(ccc(Cl)c1)c1C(N(Cc1ccco1)Cc1ncccc1)=O,0 SA01-0849,CN(C)C(c1cnc(N(C)C)nc1C(CC1)CN1C(c(cc1)cnc1OC)=O)=O,0 7591-0695,CC(C)(CC(N(C1=O)c2ccccc2)=C2C1(C(F)(F)F)Nc1nc(cccc3)c3s1)CC2=O,2 Z1550663462,COc(cc1)cc2c1[nH]nc2NC(c1cccc(NC(c(cc2)ccc2F)=O)c1)=O,2 F1905-0336,CC(N1CCC(CN(CC2)CCN2C(C)=O)CC1)=O,0 F5833-5226,Cc(cc(cc1)NC(NCc(cc2)ccc2OC)=O)c1N(CCC1)C1=O,2 S694-1440,Cc1cnc(-c2ccncc2)n1C(CC1)CN1S(c1cc(F)ccc1)(=O)=O,0 F6443-4164,Cc1noc(C)c1CC(N(CC1)CCC1(c1c2cccc1)OC2=O)=O,2 F2275-0947,C(Cn1c(cccc2)c2nc1)c1noc(/C=C/c2ccccc2)n1,2 Z845681616,CC(Nc(cc(cc1)C(NCc2cc(-n3cncc3)ncc2)=O)c1F)=O,2 Z3049345854,O[C@H](C[C@@H](C1)O)CN1C([C@@H](C1)[C@H]1c(cc1)ccc1OC(F)F)=O,0 F6562-7187,CC(C(N(CC1)CCC1N(C(COC1)=O)C1=O)=O)Oc(cc1)cc2c1OCO2,2 Z1353265859,Cc1noc(C)c1S(NC(CCC1CCC1)=O)(=O)=O,2 Z2844516863,O=C(c(cc1)cc(N=CN2)c1C2=O)N(CC12CCC2)C1c(cc1)ccc1F,2 Z3027250028,Cn1ncc(CCC2)c1N2C(c1cccc(OC(F)F)c1)=O,0 F856-0261,CC(C)n1nnc2c1ccc(S(N(CCC1)CC1C(NCc(cc1)ccc1SC)=O)(=O)=O)c2,2 Z2582203961,CC1(C)OCCC1CNS(c(cc1)c(C)cc1C(O)=O)(=O)=O,0 Z2801622376,CCc1cccc(N(C)C(CCN(C=C(C(N2)=O)C#N)C2=O)=O)c1,0 F5298-0384,Cc1cc(C(N2CCOCC2)=O)nn1CC(N(CC1)c2c1cccc2)=O,2 F6656-4432,O=C1N(C(CC2)CCN2c(nc2)ncc2Br)N=C(C2CC2)C=C1,2 S639-3450,CCn(cc1)nc1C(N[C@@H](C1)[C@@H](CN(C)C)CN1S(C)(=O)=O)=O,2 F5857-3052,CC(CNC(Cc1cccs1)=O)(c(cc1)cc2c1OCO2)O,2 E135-1127,CN(C(C(NCC1OCCC1)=O)=CC(c1cccs1)=N1)S1(=O)=O,2 Z1193464905,COC(Cc(cc1)ccc1S(N(CC1)CCC1C(Nc(cc1)ccc1F)=O)(=O)=O)=O,0 SD07-0157,CC(C)C(NCc1c(COC(CC2)(CN2C(c(cc(cc2)F)c2F)=O)C2)n2nn1)=O,0 F6471-0014,Cc1cc(C(N(CC2)CC2n2nnc(-c3ccccc3)c2)=O)no1,2 Z3077690541,Cc1nc(CN(C2)c3nc(C4CC4)nc4c3CCC4)c2c(O)n1,2 V019-8189,COCCn1c(S(Cc2ccccc2)(=O)=O)ncc1CN(CC1CC1)C(c1ccccc1)=O,0 F6441-4009,O=C(CCN(C=Nc1c2cccc1)C2=O)N(CC1)CCC1S(Cc1ccco1)(=O)=O,2 Z2613575906,C[C@H](c1cc(F)cnc1)Nc1nc(-c2cnccc2)nc2c1CCC2,2 Z4879346553,O=C(CC(CCCN1)CC1=O)Nc1nc(cccc2)c2n1C1CCCCC1,2 SB91-0024,O=C(c1cccs1)N(CCN1CCOCC1)C1CNCC1,2 SD08-0438,Cc1cc(C(N(CCC2)CC22OCc3c(CNC(C4CC4)=O)nnn3C2)=O)nn1C,2 Z2295903617,COc(cc(cc1)C(O)=O)c1NC(C1CC=CC1)=O,0 Z1356491822,COC1CCN(CCNC(c2cccnc2Sc2ccccc2)=O)CC1,2 F6617-8971,O=C1N(CCc2ccccc2)CC(CN(C(C2(CCSCC2)N2)=O)C2=O)C1,2 5614-0038,OC(CN(Cc1ccco1)S(c(cc1)ccc1F)(=O)=O)Cn1c(cccc2)c2c2c1cccc2,2 S976-1013,Cc1ccc(CN(CCC2)CC2(C(N2CCOCC2)=O)F)s1,0 Z1762709664,CN(CC(C1)OCCN1C(c(cc(C(F)(F)F)cc1)c1F)=O)CC(O)=O,0 P294-2134,Cc1nc2cccnc2n1CC(CCC1)CN1S(c1ccc(C(F)(F)F)cc1)(=O)=O,0 F6192-0490,O=C(NCC(c1ccco1)c1ccco1)Nc(cc1)cc(Cl)c1Cl,0 F6807-6916,CCOC(N(CC1)CCN1C(N=C1N2C=CC=C1)=CC2=O)=O,0 V020-1260,Cc1cc(CN(CCCN2c(cc3)ccc3NS(c(cc3)ccc3F)(=O)=O)C2=O)cc(C)c1,0 S693-1803,Cc1cnc(C2CCC2)n1CC1CN(Cc2cn(C)c3c2cccc3)CCC1,2 Z464337906,CCONC(CS(Cc(cc1)ccc1C#N)(=O)=O)=O,0 F6809-1076,Cc1csc(N(CC2)CCC2(c(cc2)ccc2Cl)O)n1,0 Z2123207257,OC(C1)C2(CC2)CN1C(c1ccnc(-c(cc2)ccc2Cl)n1)=O,2 L800-0818,CC(C)c1c(C(NCc(cccc2)c2Cl)=O)sc(N(CCC2)C2=O)n1,2 E216-5061,CC(C1)Oc(ccc(Cl)c2)c2N1C(NCCC(OC)=O)=O,0 E143-0162,COc(cc(cc1)-c(n2-c3c4cccc3)nnc2N(Cc(cccc2)c2Cl)C4=O)c1O,0 S585-1041,CCS(N(CCC1)CC1c1nnc(C2)n1CCN2S(CC)(=O)=O)(=O)=O,2 Z2897542095,OC([C@@H](CN(Cc1cc(ccc(F)c2)c2[nH]1)C1)[C@H]1c1ccccc1)=O,0 F129-0258,O=C(Nc(cc1)cc2c1OCCO2)NC(C(Oc1c2cccc1)=O)=C2NC1CCCCC1,2 SB76-0515,O=C(c1cc(Br)cnc1)N(C1)C[C@@H](CN2)[C@H]1CC2=O,2 V006-2788,O=S(c1cc(C(F)(F)F)ccc1)(N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Br)=O,0 Z1271208134,CC(C)n1ncc(S(N(C)c2cn(C)nc2)(=O)=O)c1,0 V019-1017,OC(CN(Cc1c(N2CCOCC2)onc1-c(cccc1)c1F)C1CC1)COCc1ccccc1,2 Z4280120555,O=C(c([nH]c1c2)cc1cc(F)c2F)N1CCOCC1,0 F5831-9230,CCOc(cccc1)c1NC(NCC1(CC1)c(cc1)ccc1F)=O,0 SB66-0856,CCOc1ccc(CC(N(C[C@H]2CCC3)C[C@@H]2NC3=O)=O)cc1,0 SD48-0321,CC(C)n1nc(CCC(NCCN(CC2)CCC2N2CCCCC2)=O)c2c1CCOC2,2 F6471-1202,CN(C(C=C1)=O)N=C1C(NC(CC1CC2)CC2N1S(C)(=O)=O)=O,2 Z4439096390,COC(CN)(CC1)CCS1(=O)=O,0 Z3087209217,Cn(c(C(F)(F)F)c1)nc1NC(CN(CCCCC1)C1=O)=O,2 SC88-0584,O=C(CCCc1ccccc1)N(C1)CC1(C(CC1)c2nc(-c3ccccc3)no2)S1(=O)=O,2 Z2281516640,CCC(CC)(C1)CN1C(c1csc(NCC)n1)=O,2 Z2091985004,Cc(cc1C)cc(C)c1N(CC(C1)C(N2Cc(ccc(O)c3)c3OCC2)=O)C1=O,0 F3098-3522,CCc1cccc(OCC(NC2CCCCC2)=O)c1,0 K784-0971,Cc1c(CSCC(NC2CCCCC2)=O)cccc1,2 C785-1924,CCC(n1c2cc3c1ccs3)=NN(CC(NCCN1CCN(C)CC1)=O)C2=O,2 Z2962866286,Oc1cccnc1C(N1CC(Cc(cc2)ccc2Br)C1)=O,2 Z1515798656,COc1cccc(C(CN(Cc2ccccc2)C(c(cc2)cc(CC3)c2NC3=O)=O)O)c1,0 Z1769536027,CC(C)(C(C1)CN1C(C(CCC1)N1C(c(cccc1)c1OC(F)F)=O)=O)O,0 Z2272695255,CS(C1(CCC1)C(Nc(cc1)cc(Cl)c1OCC(O)=O)=O)(=O)=O,0 F6789-0708,CN(CCc1ccncc1)c1ncnc2c1nc[nH]2,2 Z2968750047,CC(C)n1nc(C)c(CN(CCN2)C(c3cccs3)C2=O)c1C,0 SB15-0741,CS(N(C1CCOCC1)C(CCC1)CN1C(c1cc([nH]cc2)c2cc1)=O)(=O)=O,2 F3055-0615,Brc(cc1)ccc1-c1nn(Cc2c-3cccc2)c3n1,2 F6554-9295,O=S(N(CC1C2)C2CS1(=O)=O)(N1CCOCC1)=O,2 V028-9002,O=C(COc(cc1)ccc1Cl)N1CC(CN(C2CCCC2)C(c2ccco2)=O)OCC1,2 S713-3184,Cn1c(-c2noc(C(CC3)CCN3S(c3cccc4nsnc34)(=O)=O)n2)ccc1,2 F6491-0844,N#Cc1nccnc1OC(CCC1)CN1C(Cn1nccc1)=O,2 V009-8532,O=C(CCN(CCc1ccccc1)c1nc(C2CC2)nc2ccccc12)Nc1ccccc1,2 Z1836336688,CC[C@@H](CO)NS(c(n(C)nn1)c1Br)(=O)=O,0 Y041-1318,O=C(c(cccc1)c1C(O1)=Cc(cccc2)c2C1=O)N(CC1)Cc2c1cccc2,2 D578-0244,Cc(c(OC)c1)cc(C)c1S(Nc(cc1)ccc1Nc1nc(N2CCCCC2)nc(C)c1)(=O)=O,2 F6445-3060,Cc1nn(cc(CCCNC(c(cc2)cc3c2nc(C)s3)=O)cn2)c2c1,2 F6573-8635,COc(cccc1)c1NC(N(CCN1c(nc2)ncc2F)CC1=O)=O,0 F6760-2348,COc(ccc(C(F)(F)F)c1)c1NC(c1nnc(CCCC2)c2c1)=O,0 F6657-1525,Brc1c(CSC2=NCCCN2)cccc1,0 Z513022270,CC(C)Oc1c(CNC(N(CC2)CCC2c2c[nH]c3c2cccc3)=O)cccn1,2 Z1193077885,CN(C1CCN(Cc2ccccc2)CC1)C(c(cc1)cc(NC2=O)c1NC2=O)=O,2 F5490-1357,C(C1OCCC1)Nc1ncc(/C=C/c2ccccc2)cn1,2 Z1440901009,CC(C)n1nc(CC(CC2)NC(CCc([nH]3)nc4c3nccc4)=O)c2c1,2 Z5001810700,CC(CN(C1CCCCC1)S(c1c(C2CC2)cccc1)(=O)=O)O,2 F6754-6899,CC(C)c1cccc2c1nc(N(CC1)CCC1O)s2,0 Z1999583978,Cc1csc(CCNC(N(CC2)CCC22OCC2)=O)n1,2 Z2914635940,CC(C)CNC(CO)(CC1)CCN1C(c1n[nH]cc1)=O,0 Z1230247363,CC(N(C)N(C1=O)c2ccccc2)=C1NC(N(CCC1)CC1S(NC)(=O)=O)=O,0 SC19-0199,CCn1nc(CN(CCC2)CC2NC(NC(C)C)=O)c2c1CCOC2,0 F2135-1816,CCOc(cccc1)c1NC(CSc1nc(C)c(CCCC2)c2c1C#N)=O,0 P223-0876,COc(ccc(S(N(CCC1)CC1c1nn(CCCNC2=O)c2c1)(=O)=O)c1)c1OC,0 F6549-5014,Cn1ncc(C(CCC2)CN2C(C2(CC2)c(cc2)ccc2F)=O)c1,2 Z1782446569,Cc(n(-c1c(C)ccc(C)c1)nc1)c1NC(c1ncc[nH]1)c1ccccc1,2 Z1273815372,Cc(c(C)c1)cc(C2)c1OC2C(NCc1cc(-n2cncc2)ncc1)=O,2 F5882-1961,CCC(NCc1nc(COc(cc2)ccc2OC)no1)=O,0 F6748-6714,Cc1c(CN2CCC(COc(ccnc3)c3Cl)CC2)nco1,2 SC72-0466,Cc1nn(C)cc1C(N(C1)CC11OCc2c1cnc(C1CCCCC1)n2)=O,2 S984-0894,CN(C)C([C@@](CN(C1)C(c2nccnc2)=O)(C2)[C@@H]1CN2C(NCc1ccco1)=O)=O,2 SD56-0467,O=C(CN1CCCCCC1)N(CCC1)CC(C(N2c3ccccc3)=O)N1C2=O,2 S556-0476,O=C(c1ccco1)N(C1)CC1Oc(cc1)ccc1-c1noc(C2CC2)n1,2 F6795-3610,Cc1c(C)nc(cc2)n1nc2N(CC1)CCN1c1nc(C(F)(F)F)cs1,2 T505-0337,O=C(C1CCC1)N1C(CCn2nnc(COc3ccccc3)c2)CCCC1,2 F2394-0852,O=C(C(NCc1cccs1)=O)NCC1(CC1)c1cccs1,2 F5016-0154,CC(C)N1CCC(CNC(C(NCc(cccc2)c2Cl)=O)=O)CC1,0 SB27-0006,Cc1noc(C)c1CN(CC1)CCC1N(C1)C2(COCC2)CNC1=O,2 Z747321126,CC(C)(C)CCN(CC1)CCN1C(NCc(cc1)cnc1-n1cncc1)=O,2 S941-0248,COc1cccc(CCC(N2CC(Cc3nncn3C3CCCC3)C2)=O)c1,2 F2422-0218,O=C(C(CCC1)c2c1sc(NC(c(cc1)ccc1Cl)=O)n2)NCc1ncccc1,2 F6525-2930,Cn(c(CNC(c1cocc1)=O)c1)nc1-c1cnccc1,2 F6752-5281,CCc1cccc2c1nc(N(CC1)CCC1C(NC1CC1)=O)s2,0 Z2956987152,OCc1cccc(CNC([C@H](C2)[C@H](C(F)F)Oc3c2cccc3)=O)c1,0 S997-1233,COC[C@](CN(C1)S(C)(=O)=O)(CC2)[C@H]1CN2S(c(cc(cc1)F)c1OC)(=O)=O,0 F3385-5558,CC(Oc1c2ccc3c1CN(Cc1ccco1)CO3)=C(c(cc1)ccc1OC)C2=O,2 F6558-0419,CC(C)(C)C(CN1)C(C(Nc(ccc(F)c2)c2Br)=O)C1=O,0 Z1470655962,C[C@@H](C(O)=O)NC(C(C)N(C(c1c2cc(C)cc1)=O)C2=O)=O,0 Z4916902545,CC(CO)C(C([O-])=O)NC(C1SCCc2c1ccs2)=O,2 F2293-0475,CN(CC1)CCN1C(CNS(CCc(cc1)ccc1OC)(=O)=O)c1c[nH]c2c1cccc2,2 Z1482540253,CCCC(c1nnn[nH]1)NC(c1cc2c(-c(cc3)ccc3F)onc2cc1)=O,2 SB30-0097,O=C(NC1)N(C2CCN(Cc3ccncc3)CC2)C11CCOCC1,2 F6438-0300,Cc1nc(N2CCCC2)nc(C)c1NS(C)(=O)=O,0 F6734-0273,Cc1ccnc(N2CC(CN(C3)C(C(C(OC)=C4)=CN(C)C4=O)=O)C3C2)n1,2 SC99-0221,CC(C)n(c(CC1)c2CN1C(c1noc(C)c1CN1CCOCC1)=O)nc2-c1ncc[nH]1,2 D274-0115,CCOc(cc1)ccc1NC(NC(CC1)CCN1c1cc(C)nc2ncnn12)=O,0 Z2965376746,CC(Cn1nccc1)(C(N)=O)NC(C1CCCC1)=O,2 G856-9117,O=C(C1Oc(cccc2)c2OC1)N(CC1)CCN1c1nc(c(F)ccc2)c2s1,0 F2265-0935,Cc1c2nc(N(CC3OCCC3)C(c3cc(cccc4OC)c4o3)=O)sc2c(C)cc1,2 S591-1078,Fc1c(CN(C2)CC2N(CC2CC2)C2CCOCC2)cccc1,0 F2371-0284,CN(C)S(NCC(C1)CN(Cc2ccccc2)C1=O)(=O)=O,0 T955-0820,O=S(c(cc1)cc2c1OCCO2)(N(CCC1)CC1c1nc(CCOCC2CC2)no1)=O,2 Z2232078114,CN(Cc(c(F)ccc1)c1F)C(Cn1nc(C#N)nc1)=O,0 J007-0366,COc(c(NC(N(CCCCC1)C1c1cccs1)=O)c1)cc(OC)c1Cl,0 Z2443531956,CN(C)C(c(cc1)ccc1S(NC(C1CC2(CCC2)C1)=O)(=O)=O)=O,0 F6451-0629,Cc1ccc(C(CNC(c2c(C)nc3n2cccc3)=O)OC)s1,2 Z7056091905,COC(CCC1)CN1C(c1c(cc(C(CC2)CCN2C(c2ccccc2)=O)cc2)n2nc1)=O,2 D073-0301,Cn1c(ccc(NC(C2CCCCC2)=O)c2)c2nc1CCNC(c1ccco1)=O,2 F6521-3167,CC(c1ccc(CCNC(COc2c(C)cccc2)=O)s1)O,0 Z3615015203,NC(C(C1)(CC1C(F)F)NC(c1cc(-c(cc2)ccc2Cl)cnc1)=O)=O,0 Z3045390577,CC1(CNC(N(C[C@@H]2CC3)C[C@@]23N)=O)CCOCC1,2 F455-0942,OC(C(N(Cc1cnccc1)C1c(cc2)ccc2Br)=O)=C1c1ccccc1,0 E769-0730,Cn1c(-c2cccs2)c(CN(CCOC)C(NCC2OCCC2)=O)c2c1cccc2,0 Z2860071905,CC(C1(C)C)N(C([C@H](CN)OC)=O)c2c1cccc2,0 Z3047589330,CC(C)(C)C(Cn1cncc1)NC(c(c1ncccc11)ccc1F)=O,2 F5822-0908,CC(C)c1nccn1CC(CC1)CCN1C(c1cc(Br)cnc1)=O,2 Z966959562,CNC(CN1CCN(CCC(Nc2cccc(F)c2)=O)CCC1)=O,2 Z3063545635,Cc(nc(c(C(N(CC=C)C1CC1)=O)c1)Cl)c1Br,0 Z2217803342,Fc(cc1)ccc1-c1csc(N2CC(CN3CCCC3)CC2)n1,2 Z2961300629,CC(C)c1nccc(N[C@@H](CCC2)[C@@H]2C(O)=O)n1,0 Z2936907443,Oc1cccc(OC(F)(F)F)c1C(N(CCN1C2CC2)CC1=O)=O,0 Z2960079536,O=C(c1cn(C2CCC2)nc1)NCC(C1)c(cccc2)c2S1(=O)=O,2 Z3009380639,Cc1c(CNS(CC2CC2)(=O)=O)ocn1,2 Z1958616178,CCCC(N=C1SC(N[C@H](C)C(N(C2)Cc3c2cccc3)=O)=NN11)=CC1=O,2 F6471-2925,Cc(cc1)cc(S(N2C3C=CCC2CC3)(=O)=O)c1OC,0 Z1251707343,Cc(ccc(NS(CC1OCCCC1)(=O)=O)c1)c1OCC(F)F,0 F6502-5936,CC(C)(C)c(cc1)ccc1NC(Nc1cn2nccc2nc1)=O,0 L538-0012,CC(C)CCNC(c(cc1)ccc1-c1nc(Oc(cc2)ccc2OC)ccn1)=O,0 F5947-0193,CCSc(cccc1)c1C(Nc1nnc(-c2c(C)oc(C)c2)o1)=O,0 F6480-4624,O=C(Cn1c(cccc2)c2nc1)N(CCC1)CC1Oc(nc1)ncc1Cl,2 Z1330032166,O=C(C1(Cc2ccccc2)C(CC2)CC2C1)N(CC1)CCN1C(c1c(cccc2)c2n[nH]1)=O,2 Z2328487097,CCCN(CC(C1)C(Nc(cc2)cc(Cl)c2F)=O)C1=O,0 Z1893413347,CN(CCC1(CC2)CCN2C(c(cccc2)c2S(N2CCCCC2)(=O)=O)=O)C1=O,2 F3055-0831,CCn1c(ccc(NC(c2cc3nccnc3cc2)=O)c2)c2c2c1cccc2,2 Z167024556,O=C(c1cccc(Oc2cccc(C(F)(F)F)c2)c1)NCCN1CCOCC1,2 Z3018690169,CC(N(CCC1)CCN1C(C(CC1)(c2c1c(OC)ccc2)N)=O)=O,0 Z2646127924,NC(c1csc(CNC(C(C2)(C22CCCC2)C#N)=O)n1)=O,2 C256-0405,CCC(N(CCc1c2)c1cc(S(N(CC1)CCC1C(NC1CCCC1)=O)(=O)=O)c2Br)=O,2 F6792-2567,CC(C)N(CCC1N(CC2)CCN2c2c(CCC3)c3nc(SC)n2)C1=O,2 F6476-1681,COC(c(cc1)ccc1S(N(CC1)CC1Oc(nccc1)c1Br)(=O)=O)=O,0 SB30-0109,CN(CC1(CCOCC1)N1C(CC2)CCN2C(c2cnccc2)=O)C1=O,2 F3348-0826,CCCc1nc2c3c(C)cc(C)nc3nn2c(-n2nc(C)cc2C)c1,2 Z1175211448,O=C(C1(CCCC1)c1ccccc1)N(CCC1)CCS1(=O)=O,2 F2504-0045,O=C(C(NCc1cnccc1)=O)NCC(c1ccco1)N1CCOCC1,2 Z1551054609,CCC(CO)(CC1)CCN1C(c1ccc(-c2nc(cccc3)c3s2)s1)=O,0 Z1103445254,CCC(C)NC(c1cccc(CNC(N(CCC2)C2C2CC2)=O)c1)=O,0 F894-2031,CC(CC1)CCC1NC(C(CCC1)CN1S(c1c(C)sc(-c2noc(C3CCC3)n2)c1)(=O)=O)=O,0 Z3686195720,COc(cc(c(F)c1)F)c1S(N[C@@H](CC(Cn1nccc1)C1)[C@H]1O)(=O)=O,0 F6241-0118,O=C(C(COC1)N(Cc2ccccc2)C1=O)NCCCn1cncc1,2 Z2511440594,Cn1ncc(CC(N2Cc3cccc(C(O)=O)c3CC2)=O)c1,0 SB04-0392,Cc1c(COC)c(C(N(C)CCN(C(CC2)CN2C(C2CC2)=O)C2CCOCC2)=O)no1,2 F6750-6348,Cn1ncc(-c2cncc(N(CC3)CCN3c(cc3)nn4c3nnc4C(F)(F)F)n2)c1,2 D505-0631,CCc(ccc(C(C1=C2CCCC1)=NN(C)C2=O)c1)c1S(Nc(cc1)cc(OC)c1OC)(=O)=O,0 Z2157917276,CC(C(N1)=O)(c2cc(-c3noc(C(CC4)N(Cc5ccc(C)cc5)C4=O)n3)ccc2)NC1=O,2 F6395-2952,COC(c1ccc(C(CC2)CCN2C(c(s2)ccc2Cl)=O)cc1)=O,2 F5832-9500,Cc1cc(C(NCCc2csc3nc(-c4cc(F)ccc4)nn23)=O)c(C)o1,2 Z1558868378,O=C(c1cc(-c2ncn[nH]2)ccc1)NCc1cccc(NC(c2cnccc2)=O)c1,2 F6356-0848,CC(Cc1cocc1)NC(Nc1c(C)cccc1)=O,0 F6547-1132,COc1cccc2c1oc(C(NC(CCC1)C1F)=O)c2,0 L596-0180,CC(Cc1c2cccc1)N2S(c(cc1)cc(C(N2CC(N3CCCC3)=O)=O)c1N(C)C2=O)(=O)=O,2 Z1745223809,C[C@@H](CN(CC1)CCN1C(C(OC)=O)c1cccc(Cl)c1)O,0 Z2568460570,Cc(cc(C)s1)c1S(N1C(CCCC(O)=O)CCCC1)(=O)=O,0 Z1081436848,COc(cc1)cc(NS(c2cc(COC3)c3cc2)(=O)=O)c1C(O)=O,0 Z2283142119,Cc1c(C(NCC(CC2)(CS2(=O)=O)O)=O)oc2c1ccc1ccccc12,2 S663-0209,COCC(NC(CC1)C1(CC1)CCN1C(NC1CCCCC1)=O)=O,2 Y041-5236,CC[C@@H](C)[C@@H](C(NCc1cccc(F)c1)=O)N(Cc1c2cccc1)C2=O,0 G551-0318,CC(C)C(c1cccn1CC1)N1C(Nc1cccc(C(F)(F)F)c1)=O,0 Z3299532144,CCCC1(CC1)C(N[C@H](C)C(CC1)CCN1c1nc(C2CC2)nc(C)c1)=O,2 SA99-1152,COCCC(CC1)(CCN1C(C1)CN1S(c(cc1)ccc1F)(=O)=O)C(N)=O,0 Z2187838748,CC(C)(C(CC1)O)N1C(c(cc1)nnc1Oc1cccc(Cl)c1Cl)=O,0 F6556-6395,COc1cc([nH]c(C(N(CCC2)CCN2C2CSCC2)=O)c2)c2cc1,2 F6617-6867,O=C(C1(CCCCCC1)N1)N(Cc2cn(CC3CCC3)nn2)C1=O,2 Z1625180983,CC(C(C(NC(CCC1)CN1c(cccc1)c1Cl)=O)NC(C1CC1)=O)O,2 SD61-0225,O=C(C(C1)C2(CCC2)CN1C(c1ncncc1)=O)NCc1cnccc1,2 Z2911447528,Cc([nH]nc1)c1C(N(CC1)C(C(O)=O)c2c1occ2)=O,0 Z290869584,Cc(cc1)ccc1-c1cnc(-c(cccc2)c2C(NCc(s2)ccc2S(NC)(=O)=O)=O)o1,0 Z2755437107,OC(c1cn(C(CCC2)CN2C(CCc2c(C(F)(F)F)cccc2)=O)nn1)=O,2 F6496-1553,O=C(Cc1cscc1)NCc1ncnc(C2CC2)c1,2 SD24-0108,CCN(C[C@@H]1CN(C2)C(Cc(cc3)ccc3OCC)=O)C[C@@H]2NC1=O,2 Z1973800473,CCOc1cccc(CC(NC(CCCN2)C2=O)=O)n1,2 F6435-3485,Cn(c(C(N(CC1)CC1(C1)Oc(cccc2)c2C1=O)=O)c1)nc1-c(cc(cc1)OC)c1OC,2 F6609-1885,CC(c1ccc(C)cc1)NC(COC(c1cc(Br)cnc1)=O)=O,0 E632-0173,COC(c(ccc(Cl)c1)c1NC(N1CCC(CN2CCOCC2)CC1)=O)=O,2 G766-1530,O=C(CSc1nc2ccccc2nc1Cc1ccccc1)N(CCC1)c2c1cccc2,2 F6482-8276,O=C(NCc(cc1)cnc1-c1cnccc1)Nc1ccc(C(F)(F)F)cc1,0 F6730-0024,CCOc(cccc1)c1NC(c1ncnc(C2CC2)c1)=O,0 V017-8933,CCCN(CC(CN1CCOCC1)O)Cc(c(C)nn1-c2ccccc2)c1Oc1ccc(C)cc1,0 Z2965675199,CC1(C)OC(CNC(Cn2nc(cccc3)c3c2)=O)CCC1,2 Z200476170,Cc1cccc2c1N=CN(CC(N(C1CCCC1)C(CC1)CS1(=O)=O)=O)C2=O,2 SA87-0552,COCCN(CC(CNC(c(cc1)cc2c1[nH]cn2)=O)OC1)C1=O,2 C276-0993,O=C(CCC1)C(C(C2)c(cc3)ccc3-c3ccccc3)=C1NC2=O,2 F413-0492,Cc1c(CSC(N2Cc3cnccc3)=Nc(cccc3)c3C2=O)nc(-c(ccc(OC)c2)c2OC)o1,0 Z1261575230,NS(c1c(CCC2)c2cc(C(N(CC2)CCN2c2ncnc3c2scc3)=O)c1)(=O)=O,2 D470-2344,CCOc(cc1)ccc1S([C@@H](CS(C1)(=O)=O)[C@H]1NC1CCCCCC1)(=O)=O,0 S592-0239,Cc1cc(S(N(CC2)CC2c2noc(COCc3ccccc3)n2)(=O)=O)c(C)cc1,0 Z1365967240,O=C(Nc1ccncc1)N(CCCC1)C1c(cc1)ccc1F,0 F3316-0240,Cc(n(CCNS(c1cc(C)c(C)cc1)(=O)=O)nc1C)c1Cl,0 F6562-8934,O=C(COCc1ccccc1)NCc1nccnc1-c1cscc1,2 F820-1996,O=C1Oc(cc(cc2)S(Nc(cc3)ccc3Cl)(=O)=O)c2N1Cc1noc(C2CCC2)n1,0 F6374-5519,CN(C)c1cccc(C(N2CCC(CSCc3ccco3)CC2)=O)c1,0 F6713-1805,Cc1cc(C)nn1C(C=C1)=NN(C(CC2)CCN2C(c2nccc3ccccc23)=O)C1=O,2 F6681-8914,Cc1nc(CN2CC(COc(nc3)ncc3Br)CCC2)co1,0 D398-0019,O=C(c1noc(-c(cc2)ccc2Cl)c1)N(CCC1)C1c1cccs1,2 Z4119251712,CC(C)(CNC(c1cc(Cl)cnc1)=O)c1coc(-c2ccccc2)n1,2 F6472-8872,COC(CC1)CCN1C(C1)CN1C(NCc(cc1)ccc1OC)=O,2 S693-0765,CCS(N1CC(Cn2c(C3CC3)ncc2C)CCC1)(=O)=O,0 Z1349151631,C[C@H](CN(Cc1ccccc1)CC1)N1c1ncnc2c1[nH]cn2,2 Z1788008485,Cc(sc(cc1)c2cc1Cl)c2S(NCCN1CCN(C)CC1)(=O)=O,2 F6550-6735,O=C(Cc(c(F)ccc1)c1Cl)N(C1)CC1Nc1ncncc1,0 F6400-0405,CCOc(cc1)c(C)cc1S(N1C(CN(C)C)CSCCC1)(=O)=O,0 Z1686142596,CC(C1CC1)c1noc(C(CC2)CCN2C(c2cocc2)=O)n1,2 Z2701653577,CC(C1)N(C(CC2)CCN2C(C(C2C3)C2c2c3cccc2)=O)c2c1cccc2,2 F6808-2813,Cc1cccc(N2CCN(Cc3cncs3)CC2)c1C,0 D257-0694,O=C(CN(C(c1c2cccc1)=O)S2(=O)=O)Nc(cccc1)c1C(NCC1OCCC1)=O,2 F3222-2907,CCOc(cc1)ccc1-c1noc(-c2cc(-c3ccccc3)n[nH]2)n1,0 F3382-7839,O=C(c(cccc1)c1N1Cc2nc(-c(cc3)ccc3Br)no2)N(CC2OCCC2)C1=O,0 F798-0563,O=C(CSc(n1-c2c3scc2)nnc1N(CC1OCCC1)C3=O)Nc(cccc1)c1Cl,0 Z2643162766,O=C(c1cnncc1)Nc1cccc(CN(CCC2)S2(=O)=O)c1,2 F5854-4116,CC(C)(C)c(cc1)ccc1C(N(Cc1cscc1)C1CC1)=O,0 Z1140022978,Oc1nc2ccccc2c(C(NCC2(CCOCC2)c(cccc2)c2Cl)=O)c1,0 F0119-0009,Cc(cc1C)cc(C)c1OCC(CN1CCN(C)CC1)O,0 F184-0096,Cc(cc1)cc(C)c1NC(C(CCC1)CN1S(c(cc1OC2)c(C)cc1NC2=O)(=O)=O)=O,0 K288-0253,CCN(CC)C(c(cc1)cc(NC(N2CCC3=CCCCC3)=S)c1C2=O)=O,2 Z3687020636,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(C1(CCOCC1)OCc1ccccc1)=O,2 Y200-5533,O=C(CC(C1=O)N(CCC2)c3c2cccc3)N1c(cc1)ccc1Br,2 SB46-0254,CN(Cc1ccccc1)C([C@H](C[C@H]1CN(C2)C(C3CCOCC3)=O)C[C@@H]1NC2=O)=O,0 F3382-1611,COc(cccc1)c1N(CC1)CCN1C(CSc(c1c2)nccn1nc2-c1ccccc1)=O,2 F6549-3913,Cn1nccc1C(CCCC1)N1C(c(cc1)ccc1S(N1CCCC1)(=O)=O)=O,2 Z2454573120,Cc(c1c2)noc1ncc2C(NCC(CC1)CCC1F)=O,0 V024-3830,Cc1c(CN(CCc2nc(N3CCOCC3)n3)Cc2c3Oc(cccc2)c2OC)scc1,0 F6442-2732,CN(C)S(c(cc1)ccc1C(N(C1)CC1S(c(cc1)ccc1Cl)(=O)=O)=O)(=O)=O,0 F6438-1534,O=C(c1cccs1)N(CC1)CCN1c1cnnc(N2CCCC2)c1,2 Z1873103131,CCC(CC)NC(c(c(C)nn1C)c1-n1c(C)ncc1)=O,0 SC10-0101,CS(N(CCCN1CCOCC1)C(CC1)CN1C(NCCc1ccccc1)=O)(=O)=O,2 SB57-0299,CCS(N(C1)CC(C2)(CN2C(c2cccn2C)=O)C1c1nc(C)no1)(=O)=O,2 F6561-0999,COCc1cn(C(CC2)CN2C(NC2(CC(C3)C4)CC4CC3C2)=O)nn1,2 F1967-1351,OC(c(cc1)nnc1N1CCC(Cc2ccccc2)CC1)=O,0 F6756-0201,C(CC1)Cc2c1ncnc2N(CC1)CCN1c1ncnc2cnccc12,2 SA96-1477,CCn1ncc(C(N(C2)CC2(CN(Cc2ccccc2)C2)C2C(NCC2CC2)=O)=O)c1,0 Z750988104,Cc(n(CC(NC1CCN(Cc2ccccc2)CC1)=O)nc1C)c1Cl,2 SB95-1233,O=C(C1CC1)N(CCN1CCOCC1)C(CCC1)CN1C(Nc(cc(cc1)F)c1F)=O,2 F6514-3007,CC(N=CN1CC(N(C2)CC2OCC(F)(F)F)=O)=CC1=O,2 Z2067225811,CC(C)n1nnc(C2CCNCC2)c1,2 8015-2610,CC(C(C1C(c2ccccc2)=O)c(cc(cc2)Br)c2OC1=O)C(c1ccccc1)=O,2 Z1558279191,O=C(c(nc1)nn1-c1ccccc1)NC1CCN(Cc2ccccc2)CC1,2 Z1461946943,NS(c(cc1)cc(C(F)(F)F)c1NCc1nnc2n1CCCCC2)(=O)=O,2 Z3124614050,O=C(c1c(CCN2)c2ncc1)N(CC1)Cc2c1sc(Cl)c2,0 Z4228407168,CC(C)Cn1ncc2cc(C(N3CC(c4cocc4)OCC3)=O)cnc12,2 F6480-0820,O=C(c1cscc1)N(CCC1)CC1Oc1ccncc1,2 Z2001458755,CC(C)(C)c1nc(C(N(CCC2)CCC2S(C)(=O)=O)=O)cs1,0 Y030-7517,CCCC(C)C(Nc1nnc(C2CCCCC2)s1)=O,0 Z1580878702,CCCc1nn(C)c(NC(C2COCC2)=O)c1,2 F2444-0022,Cc1nc(OC)cc(Nc(cc2)ccc2NC(c(cc2OC)cc(OC)c2OC)=O)n1,0 F1656-0032,CN(c(cccc1)c1N=C1/C=C/c2cccs2)C1=O,2 F1822-0559,CCc1cccc2c1nc(NC(c(cccc1)c1F)=O)s2,0 F6524-0966,O=C(c1cocc1)NCCN1N=Nc(cccc2)c2C1=O,0 F6507-4025,Cc1cc(C(CNC(C(NCc(cc2)ccc2F)=O)=O)O)c(C)o1,0 F6524-2815,Cn1nccc1C(N(CC1)CC1c1noc(-c2ccccc2)n1)=O,2 F6506-4968,CS(N(CC1)CCC1C(NCC(C1CCOCC1)(c1ccccc1)O)=O)(=O)=O,2 Y501-9943,Cn1c(NC(c(cnn2c(C(F)(F)F)c3)c2nc3-c2ccco2)=O)nc2c1cccc2,2 L634-0186,CC(C)c1ccc(C(C)NC(c2cn(cccc3)c3c2)=O)cc1,0 V013-3185,CCC(C)N(Cc(cc(cc1)NC(c(cc2)ccc2C#N)=O)c1OC1CC)C1=O,2 F6240-1044,COc(ccc(-n1nncc1CN1CCN(Cc(c(F)ccc2)c2Cl)CC1)c1)c1F,2 L299-2549,CCc(c(-c1cc(S(N(C)c2ccc(C)cc2)(=O)=O)c(C)cc1)c1NC(CC2)=O)nn1C2=O,0 F3375-2810,Cc1c(C(NCc2ncccc2)=O)nnn1-c(cccc1)c1OC,2 F6412-1673,O=C(c(cc1)cc2c1[nH]cn2)NCC#CCOc1cccc(C(F)(F)F)c1,2 Z2616540544,CC(C)(c1nc(C2CCC2)no1)n1nccc1,2 Z2646518514,NC(c1c2nccc(C(NC(CC3)CCC3(C3)C3(F)F)=O)n2nc1)=O,2 Y300-0976,CN(c1cccc(NC(C(CCC2)CN2S(C)(=O)=O)=O)c1)S(C)(=O)=O,0 F681-0642,O=C(C(CCC1)CN1C1=Nc(cccc2)c2NC1=O)NCc1ccco1,2 F2394-0039,Cc1c(C(NCC2(CC2)c2cccs2)=O)c(-c(cccc2)c2Cl)no1,2 Z1504678741,OC(c1csc2cccc(Br)c12)=O,0 Z4911367639,O=S(c1c[nH]c2c1cccc2)(Nc(cc1)cc(Cl)c1F)=O,2 SA69-0812,CC(CCC1)(CN1S(c(ccc(F)c1)c1F)(=O)=O)c1noc(-c2ccncc2)n1,2 F6438-2943,CCc(cccc1)c1NC(NCc1nc(OC)nc(OC)n1)=O,0 F6512-0206,O=C(Cc(cccc1)c1Cl)N1Cc2ccnn2CC1,0 5593-0894,CCCOc(cc1)ccc1N(C(CC1N2CCN(C)CC2)=O)C1=O,0 Z1864630822,N#CCCn1ncc(C(NCC2N(CC3)CCN3C2)=O)c1-c1ccccc1,2 Z3652672714,CCC(C)S(C)(=NC(c1ccnn1CC(F)(F)F)=O)=O,0 F6782-7645,C=CCCN(C=CN(c(cccc1)c1Cl)C1=O)C1=O,0 Z878912730,Cc1noc(CNC(C2(CCCCC2)N)=O)c1,0 Z2504967592,CC(CNC(N1Cc2cc(ccc(Cl)c3)c3n2CC1)=O)C(O)=O,0 F6811-1643,N#Cc1nccnc1N(CC1)CCN1C(C=C1)=NN(Cc2ccccc2)C1=O,2 S985-0304,CC(C)C(N(C[C@@H]1CN(Cc2cc(C)nn2C)C2)C[C@]12C(N1CCCC1)=O)=O,2 Z1739159484,CN(C(C(O)=O)c(cc1)ccc1F)S(c(cc1)ccc1F)(=O)=O,0 F6496-3339,O=C(C1Oc(cccc2)c2OC1)N1CCC(CN(C(C=C2)=O)N=C2c2ccccc2)CC1,2 S929-4435,CC(C)Cc1nnc(CC(CC2)CN2C(CCC2CCCC2)=O)o1,2 F3395-0487,Cc1ccc(CN(CC2)CCC2N(CC2)CCN2c2nc(C(F)(F)F)ccc2)s1,0 F5033-0851,Cc1cccc(CC(NCC2CCN(Cc3ccco3)CC2)=O)c1,2 F2740-0552,CCn1c(cccc2)c2c(NC(NCc(c(F)ccc2)c2F)=O)c1,0 F9994-0425,COc(cccc1)c1N(CC1)CCN1C(CCCC1)C1NS(c1ccccc1)(=O)=O,0 F2319-0044,O=S(c(cccc1)c1Cl)(N(CC1)CCN1c(cc1)nnc1-n1nccc1)=O,2 Z1648039940,Cn1nc(-c2cccc(NC(c3nc4ccccc4cc3)=O)c2)nc1,2 D576-0265,Cc(cc1)ccc1Nc1nc(C)cc(Nc(cc2)ccc2NC(c2cccc(F)c2)=O)n1,2 F6363-0181,COc(nc1)ncc1NC(COc1ccccc1)=O,0 Z1274798079,C=CCCC(N1CC(CC(O)=O)OCC1)=O,0 S981-0367,Cn(c(CC1)c2CN1C(Cc1cc(OC)cc(OC)c1)=O)nc2NC(C1CC1)=O,2 Z3391334134,Cc1nc([nH]nc2)c2c(N2CC(Cc3cc(OC)cc(OC)c3)C2)n1,2 F362-1733,CC(CNC(C(CC1)CCN1c(cc1)nnc1Sc1cc(F)ccc1)=O)O,0 SC04-0394,O=S(C1CC1)(N(CCC1)CC1OCCc1noc(C2CCOCC2)n1)=O,2 Z3686717413,Cc(n1cc2)cc(C)nc1c2C(N(CCC1C2CC2)C1C(N1C)=NNC1=O)=O,2 Z2185533065,C[C@@H](C(O)=O)NS(c1ccc(C(F)(F)F)s1)(=O)=O,0 L763-0053,CCC(CC)C(Nc1cc(N(CCC2)C(C)=O)c2cc1)=O,0 Z2143073745,O=C(c1cc(F)ccc1)NCCc1nc(-c(cc2)ccc2Cl)n[nH]1,0 F6520-1035,COC(NCCc1ccc(-c2cscc2)s1)=O,0 SC53-0656,Cc1c(CN(CC[C@@H]2CN(Cc3ccccc3)C3)C[C@]23c2noc(C)n2)scn1,2 G786-2196,COc(cc1)ccc1-c(nc1cc2)cn1nc2SCC(Nc1nc(cccc2)c2s1)=O,0 Z3077817708,CCc1cc(C)nc(NCc2c(C)c(C)n[nH]2)n1,0 F6464-0513,CS(N(CC1)CCC1C(N(CCCC1)CC1c(cc1)ccc1Cl)=O)(=O)=O,2 G857-0417,O=C(CSC(C(CCC1)=C1N1Cc2ccco2)=NC1=O)N1CCCCC1,2 Z1157863293,CC(c1cscc1)(C(N1Cc2noc3c2CCCC3)=O)NC1=O,2 Z1893403576,CN(CCC1(CC2)CCN2C(c(cc(cc2)N(CCN3)C3=O)c2F)=O)C1=O,2 Z4631703472,CCc1nn(C)c(N(CC2)CC2C(CCC2)CN2C(C2CC3(CCC3)CCC2)=O)c1[N+]([O-])=O,2 Z2175133985,CC(CCOCC1)N1C(CNS(c1c(C)ccc(C)c1)(=O)=O)=O,0 Z2855643115,CCCCOc1cccc(NC(c2cn(C)nc2OC)=O)c1,0 Z1157926526,CC(C)N(C1CC1)C(c1c(C)n(-c(cc2)cc(Cl)c2F)nn1)=O,2 Z2456555903,CC(C)C(CC(N(CCC1)CC1C(NN1)=NC1=O)=O)O,0 F6788-7990,CN(CC(C1)CN1c1ncnc2c1nc[nH]2)S(C1CC1)(=O)=O,2 T500-2175,O=C(NCCc1ccccc1)N1CCC(CN(CC2)CCC22OCCCC2)CC1,2 SD61-0320,O=C(C(C1)C2(CCC2)CN1C(c(ccc(F)c1)c1F)=O)NCc1ncccc1,0 F0585-1137,CC(Cn1c(cccc2)c2nc1CCNC(C)=O)=C,0 F0347-2403,O=C(c1nn2c(C(F)(F)F)cc(-c3cccs3)nc2c1)N(CC1)CCN1c(cc1)ccc1F,2 F6442-0114,Cc1c(C(N(C2)CC2S(c(cc2)ccc2F)(=O)=O)=O)c(-c(cccc2)c2Cl)no1,2 F1852-0012,Cn1ncc2c1ncnc2N(CCO)Cc1ccccc1,0 F6438-3840,CCS(NCc1nc(N2CCOCC2)nc(N2CCCC2)n1)(=O)=O,2 F3374-0712,Cc(cc(c1ccc2)NC(c(cccc3)c3F)=O)nc1c2OC,0 Z2912226642,Cc1cc(C(O)=O)cc(NC(CC2COCCC2)=O)c1,2 Z1274798747,CS(c(cc1)ccc1S(N1CC(CC(O)=O)OCC1)(=O)=O)(=O)=O,0 S545-0807,COCc1noc(C(CCCCC2)N2C(Nc2ccccc2)=O)n1,2 Z2012486463,O=C(c1ccco1)NC(C1)C(CCCC2)N2C1=O,2 Z1727041204,CCN(C)C(CNC(C(CCC1)N1C(Cc1cccs1)=O)=O)=O,0 Z1255549721,CC(COC)NC(C1N(Cc2ccccc2)CCCC1)=O,0 Z1781112113,CC(C)CC(C(NCC1)=O)N1C(c1noc(C(C)(C)C)c1)=O,2 Z3351714926,CCOc1ccc(CN([C@@H](CC2)C3CC3)[C@@H]2C(O)=O)cc1,0 F6564-8924,Cc(c(NC(C(CC1)CCN1c1nnc(CCC2)c2c1)=O)ccc1)c1Cl,2 8001-1910,CC(C)(C1)CC(N(C)C(CC2c3ccccc3)=O)=C2C1=O,0 Z1927716069,C[C@H](CN(C[C@@H]1C)C(C(C2)c(cccc3)c3C2=O)=O)N1C(C(C1)c(cccc2)c2C1=O)=O,2 Z409829346,CC(C)c(cc1)ccc1NC(N(CC1)CCC1C(c1ccccc1)=O)=O,0 Z1734873436,CCC(C)(C)c1ccc(CNC(N(C2)[C@H](CO)C[C@H]2O)=O)cc1,0 F6475-5357,O=C(c1cc(OCC2CCOCC2)ncc1)Nc1cccc(OC(F)F)c1,2 Z365154492,CN(C1CCN(C)CC1)C(c(cc1)cc(N2)c1NC2=O)=O,2 Z3686628110,CC(C)NC(c1n[nH]c2c1N=CN(C)C2=O)=O,2 Z3290576799,NC(C1(CCC1)c1nc(-c(cccc2)c2F)no1)=O,0 Z1786382226,Cn1ncc(N(C=C(C=C2)C(N(CCC3)CCN3c(nccc3)c3F)=O)C2=O)c1,2 Z1547721649,O=C([C@H]1OCCC1)Nc1c(C2CC2)ncs1,2 Z2798534734,CCOc(nccc1)c1NC(NC(C)(C)C(C(F)(F)F)O)=O,0 Z1786443182,CC(Nc1nc(C(Nc2c(C)ccc(C(NCC3CC3)=O)c2)=O)cs1)=O,2 S692-0300,Cc1cnc(C2CCOCC2)n1C(CCC1)CN1C(c1cocc1)=O,2 Z1868696123,O=C(C(CC1)(c2c1cccc2)NC1=O)N1c1cccc(F)c1,2 F6372-1638,O=C(Nc1c(Cc2nc(-c3ccncc3)no2)cccc1)Nc(cccc1)c1F,2 F6619-5299,Cc1cc(N(CC2)CCN2c(ncnc2)c2F)nc(N2CCOCC2)n1,2 F6672-1762,CC=C1CC(CC2)N(Cc3ccnc4ccccc34)C2C1,2 Z2909455993,CC(C)c(cc1)cc2c1occ2C(N(CC1)CCC1C(O)=O)=O,0 Z2272819015,CCC(C)CC(C)NC(CCc(cc1)ccc1C(O)=O)=O,0 F6456-0105,O=C(C(CC1)CCN1c1ncnc(-n2ncnc2)c1)Nc(cc1)cc(C(F)(F)F)c1F,0 M331-0835,Cc1noc(/C=C/c(s2)ccc2S(N2CCOCC2)(=O)=O)c1NC(C1CC1)=O,2 Z2442964083,OC(c(cc1)ccc1C(N(CCC1)CC1C(NN1)=NC1=O)=O)=O,0 4577-0401,Cc1cccc(NS(c(cc2)ccc2NS(c(cc2)cc3c2OCCO3)(=O)=O)(=O)=O)c1,0 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F3395-1255,Cc1ccnc(C)c1C(N(CC1)CCC1N(CC1)CCN1c1cccc(C(F)(F)F)c1)=O,2 Z1171713267,Cc(cc1)ccc1S(n(cc1)cc1C(N(CC1)CCC1n1cncc1)=O)(=O)=O,2 F6743-9706,CS(NC(CCC1)CN1c1nccc2c1ccs2)(=O)=O,0 Z2439091517,NCc(cc1)ccc1C(NC1CCOCCC1)=O,0 8640-0214,CC(C)(C1)OCc2c1c(C(N(CCc1ccccc1)C(N1)=O)=O)c1s2,2 F6502-7695,CN(CC(NCCn(cc1)nc1-c1cscc1)=O)S(C)(=O)=O,0 Z2973854986,O=C(C(CC1)CN1c1nc(C2CCOCC2)ns1)Nc1c[nH]nc1,2 Z2482901377,Cc1cc(CN(C)Cc(ccc(C(O)=O)c2)c2Br)no1,0 Y206-4048,Cc(ccc(NC(C(C1CC2CC1)C2C(O)=O)=O)c1)c1F,0 Z1124273417,O=C(c1cc(ccc(F)c2)c2s1)NS(c1cccc2ncccc12)(=O)=O,2 Z917230560,CC(C)Cc1nc(C(NC(C)(CC2)CS2(=O)=O)=O)cs1,0 D265-0039,CCCCOc(cccc1)c1NC(c1c(C)nc(C)s1)=O,0 Z1262978446,C(CN(CC1)CCC1c1c[nH]c2c1cccn2)CN(CC1)CCC1c1c[nH]c2ncccc12,2 Z1954419590,COC([C@]1(CN(C2)C(c3c(-c4cccc(C(F)(F)F)c4)ocn3)=O)[C@@H]2COCC1)=O,2 Z759284874,COC(CC(CC1)CCN1C(c(cc1)ccc1F)=O)=O,0 S922-0081,CN(C)C(CN(CC1)CCN1C([C@H](C1)NC2(CCCCC2)c2c1[nH]cn2)=O)=O,2 Z422727010,CC(c1cccc(OC(F)F)c1)NC(c1cc2nccnc2cc1)=O,0 F5860-0079,O=C(CCCc1ccccc1)N1CCN(CC(F)(F)F)CC1,2 F0603-0403,Brc(cc1)ccc1-c1nnc2sc(CN(CC3)CCN3c3ccccc3)cn12,0 G938-1287,CC(C)CCNC(CN(C)S(c(cc1OC2C)c(C)cc1NC2=O)(=O)=O)=O,0 F3411-4860,O=C1NC(CC2)(CCN2S(c2cc(C(F)(F)F)ccc2)(=O)=O)N=C1c(cc1)ccc1Cl,0 F6609-4339,Cc1noc(C)c1CN(C=Nc1c2cnn1-c(cc1)ccc1Br)C2=O,2 Y203-3432,Cc1nn(C)cc1S(N(CC1)CCN1S(c(cc1)ccc1F)(=O)=O)(=O)=O,0 Z1701413568,CCC(Cc1c(C2)cccc1)N2C(NCc1nc(C)cs1)=O,2 F6425-0338,CC(C)(COC1)N1C(c(cc1)nnc1-n1ncnc1)=O,2 Z3177240575,O=C(Nc(cccc1)c1-c1noc(C2CC2)n1)N1CC(C2)C2C1,2 F5478-0037,CN(C)C(CNC(C(NCCC1=CCCCC1)=O)=O)c1cn(C)c2c1cccc2,0 F2055-0209,COc(ccc(Cl)c1)c1C(NCCc1csc(-c2cc(F)ccc2)n1)=O,0 Y300-3541,Cc(cc1)cc(C)c1OCCNC(C1CCCC1)=O,0 F5822-1058,CCOC(CCC(N1CCC(Cn2c(-c3ccccc3)ncc2)CC1)=O)=O,0 Z1552355168,CC(C)(C)c1nc(CCNC(N2CCCC2)=O)cs1,2 F5017-0176,COCCN1CCC(CNS(c(cc(cc2)OC)c2OC)(=O)=O)CC1,0 S720-0775,Cn1nc(C(N(C[C@H](C2)Oc3ccccc3)[C@@H]2C(N2CCCC2)=O)=O)c2c1cccc2,2 S951-5074,CC(C)NC(N(CCN(C1)c(cc2)cc(C(F)(F)F)c2C#N)C1C(N)=O)=O,0 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Z2669924580,Cc(cc1)cc(C(N(CC2)CC2C2CCCCC2)=O)c1F,2 F6752-7963,N#Cc1nccc(N(C2)CC2C(N2CCOCC2)=O)c1,0 Z2964458501,CCOC1CC(CC(Nc2n[nH]c(C(OCC)=O)c2C)=O)C1,2 Z1767813457,CCOc1cccc(C(N2C(C)CN(CC(C)(C)O)CC2)=O)c1,0 F6739-7819,CN(Cc(cc1)cc2c1OCCO2)c1ncnc(OC)c1,0 F6473-4262,O=C(c(o1)ccc1Br)N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O,2 F6363-0586,O=S(Cc1ccccc1)(NCCNc(cc1)nnc1-n1cccc1)=O,2 F5959-0077,Cc1nccn1CCNC(CCCc1ccccc1)=O,2 F5027-0465,O=C(CNS(c1cc(CCCC2)c2cc1)(=O)=O)N1CC(c2ccccc2)OCC1,2 F6754-7663,COc1cccc(N(CC2)CCN2c(cc2)ccc2F)n1,0 Z2482969664,COc1cccc(C(C2)OCCN2C(C(O)=O)c(cccc2)c2F)c1,0 F6520-1084,CN(C=CC=C1C(NCCc2ccc(-c3cscc3)s2)=O)C1=O,2 Z3861494563,CC(C(C)(C)C(O)=O)NCc1c[nH]nc1-c1ccc(C(F)(F)F)cc1,0 F2773-0692,CC(CN(C(C=C1)=O)N=C1c1cccs1)C(NCc(cccc1)c1OC(F)(F)F)=O,2 8412-1017,CCc1cccc(NC(CC(N2c(cc3)ccc3OCC)=O)C2=O)c1,0 F255-0609,Cc(cc1)cc2c1[nH]c(CCc(cc1)ccc1NC(CN1c(cc(cc3)Cl)c3OCC1=O)=O)n2,0 Z1192447130,Cc1nn(C)cc1C(N(CCC1)C1c(cc1)ccc1Cl)=O,0 Z2140576239,Cc1ccc2nc(C3CC3)cc(C(N(CC3CC(COC4)NC4=O)c4c3cccc4)=O)c2c1,2 F6818-0593,CSc1nc(N(CC2C(N3c4ccccc4)=O)CC2C3=O)ccn1,2 Z2078582941,CCc1ccc(C(CCC2)CN2C(c2coc(S(N(C)C)(=O)=O)c2)=O)cc1,0 Y042-2563,Cc1c(C(NC(CC2)c(cc3OC)c2cc3OC)=O)nc(-n2cccc2)s1,2 Y206-8619,CCc1noc(C)c1C(Nc1c(C(NC2CC2)=O)c(CCCC2)c2s1)=O,0 SA94-0022,CCS(N(CC1)CC1(C(NCc1ccccc1)=O)F)(=O)=O,0 Z3620900714,O=S(c(cc1)ccc1Cl)(N(C1)CC1C1CC1)=O,0 Z2638561607,O=C([C@@H]1[C@@H]2[C@H]1COC2)N(CC1)CCC1C(O1)=NNC1=O,2 F6524-1686,CC(N=C(N1)N(CC2)CCC2NC(Cc(cccc2)c2Cl)=O)=CC1=O,2 Z2945878803,Cc1noc(C2N(Cc3cnc(-c4ccccc4)o3)CCC2)c1,2 L823-0862,O=C(c1nc(-c2csc(S(N3CCCC3)(=O)=O)c2)no1)N1CCOCC1,2 V028-2425,CC(C)(C)CC(N(CC1)CCN1C(C1CCCC1)C(NCCCOC)=O)=O,0 F2300-0257,CCOC(c(oc1c2cccc1)c2NC(Cc(cc1)cc2c1OCO2)=O)=O,2 F5490-1326,CC(c(cc1)ccc1-c1cnc(NCC(F)F)nc1)=O,0 Z757371726,COc1ccnc(N(CC2)CCN2C(c2c[nH]nc2)=O)n1,2 Z3081300148,CC(C)(c1nc(C)c(C)s1)NC(c1nn(C)c(C(F)(F)F)c1)=O,0 F1909-1434,CC(C)(C)OC(N1CC(Cc2nc(-c3ncccc3)no2)C1)=O,2 Z2936885188,OCCS(c1ccc(CNC2C(CC3)CC3CC2)cc1)(=O)=O,2 Z2970307641,CCN(C)c1c(CNC(N[C@@](C2)(CCCC3)[C@H]3NC2=O)=O)cccc1,2 F6672-1596,CC=C(CC1CC2)CC2N1S(c(cc1)ccc1N(C(CC1)=O)C1=O)(=O)=O,2 Z2846192987,CCN(CC)Cc1cn(Cc(cc(cc2)F)c2C#N)nn1,0 S757-0170,CO[C@H](C1)[C@@H](c2cnccc2)N1C1CCN(Cc2cccc(OC)n2)CC1,2 S893-0360,CCS(N(CCC1)C1c1nn(CC2CCCCC2)c2c1COCC2)(=O)=O,2 F6480-1186,O=C(c1cc(-c2ccco2)n[nH]1)N(CCC1)CC1Oc(ccnc1)c1Cl,2 F0537-2479,COC(c(cc1)ccc1-c1csc(NC(C2CCCC2)=O)n1)=O,2 E135-0568,CN(C(C(Nc1c(C(N)=O)c(CCCC2)c2s1)=O)=CC(c(cc1)ccc1F)=N1)S1(=O)=O,2 F270-0656,Cc(onc12)c2C(C)=NN(CC(NCCCN(CC2)CCC2N2CCCCC2)=O)C1=O,2 V026-4401,CCc1nc(SCc2ccc(C(N3CCN(C)CC3)=O)o2)nc(N2CCCC2)c1,2 F6475-7321,O=C(c1cc(OC2CSCC2)ncc1)N(CC1)CCN1c1cccc(Cl)c1Cl,2 SC45-0345,CC1n2nnc(CNC(c(ccc(OC)n3)c3OC)=O)c2CN(C)C1=O,0 F6418-2697,OC(c1ccc(CNC(C2CC=CCC2)=O)s1)c1ccccc1,2 F223-0728,CCC(Nc1nc(ccc(CC(NCCC(C)C)=O)c2)c2s1)=O,0 F5834-4771,O=C(Cc(cc1)ccc1NC(NCc(cc1)ccc1F)=O)NC1CC1,2 Z2912873801,OC([C@@H](CC1)C[C@@H]1C(N(CC1)[C@H](c2ccccc2)c2c1cccc2)=O)=O,0 Z1295603695,O=C(c(ccnc1)c1Cl)N1Cc2nnc(C(F)(F)F)n2CC1,2 F5558-0136,Cc1cc(C)nn1-c1cc(N(CC2)CCN2C(c(cc(cc2)Cl)c2OC)=O)nc(C)n1,2 Z4760934702,O=C(C(c(cccc1)c1N1)=CC1=O)N(CCN1c2cccc(Cl)c2)CC1=O,2 SB21-1415,O=C(CC1CCCC1)N(C1)[C@H](Cn2nnc(C(N(CC3)c4c3cccc4)=O)c2)C[C@@H]1F,2 Z1201051196,OC(C1)CN(Cc2ccccc2)C1=O,0 S827-2397,Cc1noc([C@H](CC(C2)(F)F)N2S(c2c(C)cccc2)(=O)=O)n1,0 Z1311829465,CC(CN(C)C(Nc1cn(-c2ncccn2)nc1)=O)C#N,0 V001-2528,CCOc(cc1)ccc1NC(N(CCC1)C1c1nc(cc(cc2)-c(ccc(F)c3)c3F)c2o1)=O,0 Z2527301121,CN(CCO)Cc1cn(-c(cc2)ccc2Br)nn1,0 F3406-7025,CC(C)N(C(c1nscc1N1CC(NCc(cc2)ccc2Cl)=O)=O)C1=O,2 F6561-5462,COc(ccc(C(N(CC1)CCC1S(Cc1ccccc1)(=O)=O)=O)c1)c1F,0 SB01-0426,Cn1nc(COc2nccnc2)c(C2)c1CCN2C(c(cc1)cc(F)c1F)=O,2 F6497-0578,O=C(c(ccc(F)c1)c1F)N1CC(Cc2nc(C3CC3)no2)CCC1,0 Z2012862015,O=C(C(C1)Oc(cc2)c1cc2Br)NC(CC1)CN1C(Nc1ccccc1)=O,2 Z454275664,Cc1c(C(NCc2cnccc2)=O)nc(-c2ccccc2)[nH]1,2 Z1905133350,OC(CNC(c1c[nH]cc1-c(cccc1)c1F)=O)c1cccc(Cl)c1,0 F6274-0727,O=C(C1=COCCO1)OC(C1)CN1c1nc(cccc2)c2s1,2 K284-4292,O=C(CSC(N1CCCN(CC2)CCN2c2cccc(Cl)c2)=Nc(cccc2)c2C1=O)c1ccccc1,2 F6524-6144,O=C(c1ccc(C(F)(F)F)cc1)N(CC1)CCN1C(CC1)CCS1(=O)=O,0 Z2164669438,Cc(ccc(CN1CCC(CN2CCN(C)CC2)CC1)c1)c1F,2 S615-0851,CNC(N(CC1)CC1c1nc(CCOCC2CCOCC2)no1)=O,0 K284-4550,CCOc(cc1)ccc1NC(CSC(N1CC2OCCC2)=Nc(cc(cc2)C(NCC3OCCC3)=O)c2C1=O)=O,2 Y205-0019,Cc1ccc(Cn(cc2)nc2NC(C(C2CC3CC2)C3C(O)=O)=O)cc1,2 F6556-2781,OC1(CNS(CCc2ccccc2)(=O)=O)COCC1,2 Z1178144411,O=C(C(C1)=NNC1=O)N(CC1)CC1c1ccco1,2 Z1680158028,CCN(CCC1CC1)C(c(cc1)ccc1N(CCC1)CC1C(N)=O)=O,2 F6474-0316,CC(N1C)=CC(OC(CC2)CCN2C(Cc(cc2)cc3c2OCO3)=O)=CC1=O,2 F6604-9342,O=C(c1cnc(C(F)(F)F)cc1)N1CC(CN(C(C=C2)=O)N=C2c2cnccc2)C1,2 SA69-0774,CC(CCC1)(CN1S(c1cn(C)c(C)n1)(=O)=O)c1noc(-c2ccncc2)n1,2 5339-0307,Cc(cc1)c(C)cc1Oc1nc(N(C)C(N(C)C2=O)=O)c2n1Cc(c(F)ccc1)c1Cl,0 Z854800666,Cc(cc1)cnc1NC(C(CCC1)CN1C(c1csc(COC)n1)=O)=O,2 1682-2969,CC(C)C(C(Nc1cc(C(C)=O)ccc1)=O)N(C(c1c2cccc1)=O)C2=O,0 Z2327484468,OC(C(N(CC1)CCN1C(C(O)=O)=O)=O)c1ccccc1,0 Z3098266090,CCn1c(N(CC2)CCS2(=O)=O)nnc1-c1cc2ncccc2cc1,2 5847-0013,Cc1cccc(OC2=COc(cc(cc3)OCC(NC4CCCCC4)=O)c3C2=O)c1,2 F5857-3025,CC(CNC(Nc1c(C(F)(F)F)cccc1)=O)(c(cc1)ccc1-c1ccccc1)O,0 F6617-6846,O=C(C1(CCOCC1)N1)N(Cc2cn(Cc(cc3)ccc3F)nn2)C1=O,2 F5857-3709,OC(CNC(C(Nc(cc1)cc(F)c1F)=O)=O)(C(F)(F)F)c1ccccc1,0 F2494-0120,Cc(n(C(CC1)CS1(=O)=O)nc1C)c1S(N(CC1)Cc2c1cccc2)(=O)=O,2 Y041-4006,Cc(cc1C)cc(O2)c1C(CN(CC1)CCN1c(cccc1)c1F)=CC2=O,0 Z2154856350,O=C(CC(CCC1)NC1=O)Nc(ccc(Cl)c1)c1OCC(F)F,0 S698-0700,Cc1cnc(C2CC2)n1C(CC1)CCN1C(C1(CC1)c(cc1)ccc1OC)=O,2 SB57-1057,Cc1noc(C2C(C3)(CN3S(N(C)C)(=O)=O)CN(Cc3ccccc3)C2)n1,0 Z1159132722,Cc1nc2nc(C(F)(F)F)nn2c(NCC2c(cccc3)c3OCC2)c1,0 F6476-7244,Cc(onc1)c1C(N(CC1)CC1Oc1ncc(C)cc1)=O,2 SC66-0571,CCn1c(C(CN(C2)C(c3nc4ccccc4cc3)=O)C22CCOCC2)nnc1,2 F6439-3018,O=C(NCCn(c(C1CC1)c1)nc1-c1ncccc1)NCc1cccs1,2 SC73-1260,CCNC(N(CC1)CCC1(C1)OCc2c1n(C)nc2C(N1CCCC1)=O)=O,0 F3320-0929,Cc(cc1)cc2c1oc(C(CC1=O)CN1c1ccccc1)n2,0 F0111-0201,COc(cc1)ccc1C(CSc1nnc(-c(cc2)ccc2Br)o1)=O,2 F0882-0511,O=C(c(cc1)cc2c1OCCO2)Nc1cccc(-c2nc(cccc3)c3s2)c1,0 Z1730496399,FC(c1nnc(N(CC2)CCN2c2ccccc2)s1)(F)F,0 F6476-5759,O=C(c1ccno1)N(CC1)CC1Oc(ccnc1)c1Cl,2 Z2229417886,Cc1c(CNC(c(cc2Cl)cc(Cl)c2O)=O)occ1,0 Z1273502483,COc1cccc(CCNC(C(CC2)CCC2c2ccccc2)=O)c1,2 Z887143496,Cc1c(CC(NCc2cc(-n3cncc3)ncc2)=O)c(cccc2)c2[nH]1,0 Z4924723260,Cc1cc(NS(c2c3occc3ccc2)(=O)=O)cc(C)c1,0 Z2497411652,O=C(C(N=C(C1CC1)N1)=CC1=O)N1CC(c2ccco2)OCC1,2 E635-0600,CCN(CC1)Cc2c1c(C(C)NC(Nc1cc(C)c(C)cc1)=O)c(-n1cccc1)s2,0 V007-5577,O=C(CCN(CCc1ccccc1)c1nc(-c2ccco2)nc2ccccc12)NC1CC1,2 Z1021864406,O=C(c1ccc(C(F)F)cc1)Nc1ccccc1,0 L816-0800,O=C(C1CC1)Nc(nc1)cn1-c(cc1)ccc1C(Nc(cc1)cc(C(F)(F)F)c1Cl)=O,2 M563-0610,CCCC(Nc1cc(CN(C(C2)C(N(C)C)=O)C(Cc3cccs3)=O)c2cc1)=O,2 Z3305298244,O=C(c(cc1)ccc1Oc1cnccc1)N[C@H]1C[C@H](Cn2cncc2)C1,2 Z1537393739,CCC1(CCOCC1)NS(c1cn(C)nc1)(=O)=O,0 F6502-3033,Cn1nc(C2CC2)cc1N(CC1)CCN1C(c(s1)ccc1Cl)=O,2 F6438-1702,O=C(c1c(C(F)(F)F)cccc1)NCc1nc(N2CCOCC2)ncc1,0 F6515-3357,CCOc1c(CCC(N(CC2)CC2n2nccn2)=O)cccc1,0 F5759-0036,Fc(cc1)cc(F)c1Nc1ncnc(-c2ccccc2)c1,0 Z994229888,O=C(CCn1cncc1)N1C(Cc2ccccc2)CCC1,2 Z1414114739,Cc1nnc(-c2cccc(NC(C(C(C)=C3)=CNC3=O)=O)c2)o1,2 F6448-0283,O=C(c1cocc1)Nc1cn(CC2OCCCC2)nc1,2 Z1725550112,CCOc1nc(C(NC2(CCCC2)c(cc2)ccc2F)=O)co1,0 F6372-1480,O=C(c(o1)ccc1Br)Nc1c(Cc2nc(-c3ccncc3)no2)cccc1,2 Z2921048915,OC1(CCCCC1)C(N(CC1)CC1(CN1Cc2ccccc2)OCC1=O)=O,2 Z1457655139,O=C(c(cc1)cc(N(CCN2)C2=O)c1Cl)Nc1nnc(C2CC2)cc1,2 Z2669792319,CCc1cccc(C(N(CCN2)C(CC3CCCCC3)C2=O)=O)c1O,2 F6482-4030,COc(ccc(Cl)c1)c1NC(N(CC1)CCC1n1nccn1)=O,0 SA99-0236,NC(C(CC1CC1)(CC1)CCN1C(Cc1cnccc1)=O)=O,2 L453-0152,CN(CCc1noc(-c(cc2)ccc2C(NC2CCCCC2)=O)n1)C(Nc(cc1)ccc1Cl)=O,0 S571-0418,O=C(CCCc1ccccc1)NCC1(CCC(N2CC3CC3)=O)C2=CCC1,2 P271-0723,O=C(C(CC1)CCN1c1cc2nccnc2nc1)N1CCCCC1,2 Z1852519235,C[C@@H](COC(C)(C)C1)N1C(c(cccc1)c1N1CCCCC1)=O,0 Z1441730549,Cc(cc1)ccc1S(NC(c1csc(-c2ccncc2)n1)=O)(=O)=O,2 E225-0138,CCOc(cc1)ccc1-c1nn(CC(C)(C(NC2CCCCC2)=O)N(CCCOC)C2=O)c2c1,0 Z3344050934,CC(C)(CCC1)N1C(Cn1nnc(-c2nc(cccc3)c3s2)c1)=O,2 F5788-3121,CCOc(cc1)ccc1N(CCN1CC(NC(C)c2ccccc2)=O)C1=O,0 Z1431741399,O=C(Nc1ccncc1)N(CC1)CCC1=Cc(cc(cc1)Cl)c1Cl,0 Z2912141540,Cc(c1c2)nn(C)c1ncc2C(NC(CO)c1cnccc1)=O,2 F2740-0692,COCCn1c(cccc2)c2c(NC(N(CC2)Cc3c2cccc3)=O)c1,2 F6676-2789,Cc1nsc(N(CC2)CCC2N(C)c2ncccc2)n1,2 Z975266436,CC(C(NC(C)(C)C)=O)NC(NCc(cc1)cnc1-n1cncc1)=O,0 Z1846698379,CC(C)c(n(-c(cccc1)c1Cl)nc1)c1NC(N1C(C)(CO)CCC1)=O,0 SB69-0531,CN(CCCNC(c1nn(C[C@H](C2)Oc3ccncc3)c2c1)=O)c1ccccc1,2 SB14-1155,COCC(N(C(CC1)CN1S(c1cccs1)(=O)=O)C1CCOCC1)=O,2 Z237-1254,O=C(c1cc2nnc(-c(cccc3)c3Br)n2cc1)N(CC1)CCN1c1ncccc1,2 S985-0208,CC(C)C(N(C[C@@H]1CN(Cc(cccc2)c2Cl)C2)C[C@@]12C(N1CCCC1)=O)=O,0 S555-0074,O=C(C1CCCC1)N1Cc(cc(cc2)N3CCOCC3)c2OCC1,2 Y501-1950,CCn(cc1)nc1C(CC(c1c2cccc1)OC2=O)=O,2 Z646416502,CCN(CC)C(CCNc1cccc(Cl)c1C#N)=O,0 Z1542577202,NS(c(cc1)ncc1C(NC1CC=CCC1)=O)(=O)=O,0 F5095-0512,COc1cccc(-n2c(N(CC3)CCN3C(c3c(C(F)(F)F)cccc3)=O)ncc2)c1,0 F6550-7002,O=S(c1cc(CCCC2)c2cc1)(N(C1)CC1Nc1ncncc1)=O,2 Z1716039112,CC(C)C(C(Nc(n(C)c1ccc2)nc1c2Cl)=O)OC,0 Z2710673273,CC(CN(C)C(C1)=O)N1C(c1c(C)cc(C(F)F)o1)=O,0 F6502-3162,CCCCOc(cc1)ccc1NC(N(CC1)CCN1c1cc(C2CC2)nn1C)=O,0 F6774-4221,Cc1noc(CN(CC2)CC2Oc(nc2)ncc2OC)n1,2 F6451-3275,COC(CNC(c1c(C(F)(F)F)cccc1)=O)c1ccco1,0 SC19-0677,CCn1nc(CN(CC2)CCC2NS(C2CC2)(=O)=O)c2c1CCOC2,2 F6438-0857,COc(ccc(S(NCc1nc(N2CCOCC2)ccn1)(=O)=O)c1)c1Cl,0 8009-6906,C(C1C2c3ccccc3)C1(c1ccccc1)Oc1c2cccc1,2 F6559-1393,Cc1nc(cccc2)c2n1C(CC1)CN1S(c(cc1)ccc1NC(OC)=O)(=O)=O,0 Z1420203706,O=C(C1=CCCC1)N(CC1)CCN1c1c2sccc2ncn1,2 F6709-4643,Cc1nccc(OC(C2)CN2C(CCc2cccc(Cl)c2)=O)c1,0 G545-0796,Cc1ccc(CNC(Nc(cc(cc2)C(NCc(cc3)ccc3OC)=O)c2N2CCCC2)=O)cc1,0 Z2954865421,OC(CNC(CC(CC(N1)=O)C1=O)=O)c1cc(Cl)cc(Cl)c1,2 SA45-0092,Cc1noc(C)c1Cc1ccc(C(N(CC2)CCC22C(C(N)=O)N(C)CCC2)=O)o1,2 Z3341693825,CCCn1c(CS(c2cnccc2)(=O)=O)nnc1C,2 V029-2839,Cc1c(CN(CCc2nc(N3CCN(C)CC3)n3)Cc2c3Oc(cc2)ccc2F)scc1,2 F6200-3562,OC(CNC(c(ccc(F)c1)c1Cl)=O)(C1CC1)c1ccccc1,0 F6553-8800,O=S(CCC(F)(F)F)(N(C1)CC1N1CCCC1)=O,2 Z1126962506,NC(C(CC1)CCC1NC(C1(CCOCC1)c1ccccc1)=O)=O,2 F6454-2282,Cc1nccc(N2CCC(CNC(Cc(c(F)ccc3)c3Cl)=O)CC2)c1,2 F6192-0683,CC(C)(Cc1ccc2)Oc1c2OCC(NCC(c1ccco1)c1cccs1)=O,2 F6478-2442,O=C(c1c(C(F)(F)F)cccc1)N(CC1)CC1Oc1ncncc1,0 Y203-7192,O=C(c1cc(-c2cccs2)nc2ccccc12)Nc(cc1)cc2c1OCCO2,2 F5033-0940,O=C(c(cccc1)c1Cl)NCC1CCN(Cc2cccs2)CC1,0 F6562-4128,Cc(cc1)c(C)cc1N(CC(C1)C(NC(CC2)Cc3c2nc(N(C)C)nc3)=O)C1=O,2 Z2755330613,OC(c1cccc(CNC([C@@H](C2)[C@H]2c2cscc2)=O)c1)=O,0 F6489-1052,Cc(cc1)nnc1OC(CC1)CN1S(c1cnccc1)(=O)=O,2 Z3686103732,CN(C(C(C(CC1)C2CC2)N1c1nc(CCOC2)c2cn1)=NN1)C1=O,0 Z960881436,Cc1nn(C)c(N2)c1C(C)=C(CCC(N1CC(Cc3ccc(C)cc3)CCC1)=O)C2=O,2 Y205-1725,O=C(C1OCCC1)Nc(cc1)ccc1S(Nc1ncccn1)(=O)=O,2 C489-0224,CC(C)CCNC(CCN(c(cccc1)c1S1)C1=O)=O,0 Z2283396946,O=C(CCc1c(-c(cc2)ccc2F)[nH]c2c1cccc2)N[C@@H](CCCN1)C1=O,2 V013-3692,CCC(C)N(Cc(cc(cc1)NC(C2CCCC2)=O)c1N(C)C)C(NC(C)(C)C)=O,0 G221-0397,Fc1cc(Cl)c(C(c2nnc(-c3ccccc3)o2)Nc(cc2)cc3c2OCCO3)cc1,0 F6514-2444,O=C(Cc1cscc1)NC(C1CCOCC1)c1cnccc1,2 Z3214699002,Oc(cc1)ccc1C(N1CCN(CC(N(CCc2c3ccs2)C3c2ccccc2)=O)CC1)=O,0 8003-2964,O=C(C(NCC1OCCC1)=O)NCCCCc1ccccc1,2 Z2610617892,CNC(c1cccnc1NC(CC1)CCC1C(F)(F)F)=O,0 8018-6754,COc1cc(C(CCCC2)C2OC2c3cccc(NS(C)(=O)=O)c3)c2cc1OC,0 SB56-0971,C(Cc1ccccc1)CN(C[C@@H]1c2nc(-c3nccnc3)no2)C[C@@H]1c1cnccc1,2 F0655-0832,CC(C(c1cccs1)N(CC1)CCN1c(cccc1)c1OC)NS(c1ccccc1)(=O)=O,2 Z1291395621,O=C(C(C1)c2c1cccc2)NS(c1cc(C(NCC2)=O)c2cc1)(=O)=O,2 F6573-7664,O=C(CN(CC1)S(Cc(cccc2)c2Cl)(=O)=O)N1c1cnccc1,2 F6556-4231,COC(CNC(c(cc1)ccc1S(N1CCCC1)(=O)=O)=O)c1cc(cccc2)c2o1,2 Z2568441898,CCC(CC1)CCN1S(N(C)C(C)C(O)=O)(=O)=O,0 F6507-8476,OC(CNC(Cc(c(F)ccc1)c1Cl)=O)(CCC1)c2c1occ2,2 SB95-1172,Cc1c(C(N(CCC2)CC2N(CCN2CCOCC2)C(C2CC2)=O)=O)sc(C)n1,2 Z5020307856,Oc(cc1)cc(Cl)c1-c(cc1)cc(CC2)c1C2=O,0 Z4131951727,CC(C)(C)NS(c1cc(C(N(CC2)CCN2c2ncnc3c2scc3)=O)ccc1)(=O)=O,0 L056-0037,O=C(CC1CCCC1)NCc1cc(N(CC2)C(c(cc3)ccc3Cl)=O)c2cc1,2 D715-0540,OC(C(CC1)CCN1C(COc(cc1)cc(O2)c1C(CCC1)=C1C2=O)=O)=O,2 Z1891236786,Fc(ccc1nc(C2CC2)c2)cc1c2-c1nc(-c2cnc3n2ccnc3)no1,0 F6522-0187,Cc1c(C(NCc2cc(-c3ccco3)cs2)=O)c(-c(cccc2)c2Cl)no1,2 F6549-1130,O=C(CCc1ccc(C(F)(F)F)cc1)N(CC1)CCN1c1nsnc1,0 F6427-0224,COc(nccc1)c1C(NCCN(C(C=C1)=O)N=C1n1ncnc1)=O,2 F6550-1823,O=C(Nc(c(F)ccc1)c1F)N(C(CC1)C2)C1CC2F,0 Z2212419544,CC(C)(C)OC(CC1)CCN1c1nc(ccc(F)c2)c2n1C,0 F6200-0893,OC1(CNC(C(NCc(cccc2)c2Cl)=O)=O)CCOCC1,2 SD22-0215,CN(C)S(N(C1)CC1(C1(CC1)OC)NC(c1ccccc1)=O)(=O)=O,0 Z2143277993,CNS(N(CC1)CCN1c1ncnc2c1cc[nH]2)(=O)=O,0 F6753-2600,O=C(C(CCC1)CN1c1nccc(C(F)(F)F)c1)N1CCOCC1,0 F6677-1243,CCc1nccn1CC(C1)CN1C(c1c2OCCOc2ccc1)=O,2 Z2940245167,Cc1nccc(N(CCC2)C22CNCC2)c1,2 S567-0464,COCCC(N1CCC(CC2)(CCC2(CN(CC2)c3c2cccc3)O)CC1)=O,0 F2707-0060,O=C(NC(CC1=O)CN1c(cc1)cc2c1OCCO2)N(CCn1c2ccc1)C2c(cccc1)c1F,2 F6725-1138,C(C(C1)N(CC2)Cc3c2scc3)N1c1nc(cccc2)c2o1,2 Z3775167563,OC(C(c(ccc(F)c1)c1Cl)N(CC1)CC1(CC1)CCC11OCCO1)=O,2 F6561-4954,C=C(CC1CC2)CC2N1C(c1c2OCCOc2ccc1)=O,2 F6559-3718,O=C(CCc1c[nH]c2c1cccc2)NCc1nc(C(CC2)CCC2(F)F)no1,2 Z3512705424,CN(Cc1cnccc1)C(N[C@@H](C1)[C@H](C2)[C@@]12C(O)=O)=O,2 F2495-1134,CC(C)C(N=C1SCC(CC(NCCc2c[nH]c3c2cccc3)=O)N11)=CC1=O,2 F6656-2674,Cc1csc(N2CCC(COc3nnc(C)cc3)CC2)n1,2 G841-0038,Oc(cc(cc1)NC(c2cc(CCCC3)c3cc2)=O)c1-c1nc(cccc2)c2s1,2 F3296-0789,CCc1nnc(NC(CCc2ccc(-c(cc3)ccc3F)o2)=O)s1,2 Z1676909469,O=C(C1c(cc(cc2)Cl)c2OCC1)Nc(cccc1)c1NC(c1ccncc1)=O,2 S662-0009,COc(cc1)nc(OC)c1C(N(CC1)CCC1(CC1)C1N1CCOCC1)=O,2 F6562-8177,Cc1c(CCC(NCC2c(cccc3)c3OC2)=O)scc1,2 Z4524717867,CC(C)(C)OC(C1(Cc2cn(CC(CC3)CCC3C(F)(F)F)nn2)CCOCC1)=O,2 F312-0039,CC(CCC1)CN1S(C1=Cc(cc(cc2)Br)c2OC1=O)(=O)=O,0 Z1510955195,Cc1nn(C)c2c1c(C(NC1C3(CCC3)C3OCCC13)=O)cc(-c1cccs1)n2,2 F6372-0022,Cc1noc(Cc(cccc2)c2NC(c2cc(cccc3OC)c3o2)=O)n1,2 Z2262844539,Cc(ccc(NCc1c(C)cncc1)c1)c1C(N1CCOCC1)=O,2 SC40-1046,Cc1n[nH]c(C(N(CC2)CCC22OCc3c(COc4ccccc4)nnn3C2)=O)c1,0 C470-0347,CN1CCN(Cc2nc(N(C)C(N(C)C3=O)=O)c3n2Cc(cccc2)c2F)CC1,0 F3358-0121,Cc1cc(SC(C(O)=O)c2ccccc2)ncn1,0 E864-0363,Cc1cc(NC(N(CCc2c3[nH]c(cc4)c2cc4Cl)C3c(cc2)ccc2OC)=O)cc(C)c1,0 T990-1987,COCCN(CCC1N(CC2)CCN2C(c(cc2)ccc2Cl)=O)C1=O,0 S698-1585,Cc1cnc(C2CCC2)n1C(CC1)CCN1C(c1c(C)nco1)=O,2 J079-0758,Cc(cc1C)cc(O2)c1C(CN(CC1)CCN1C1CCCCC1)=CC2=O,0 6415-0260,OC(C(C1CC2CC1)C2C(Nc1ccc(Cc2ccncc2)cc1)=O)=O,2 Z341068154,CN(CCC(C1)C(NCc(c(Cl)ccc2)c2Cl)=O)C1=O,0 S248-3551,O=C(c1ccncc1)N1CC(Cc2noc(-c3ccncc3)n2)CC1,2 F6414-2179,CSc1ccc(C(CNC(C2c(cccc3)c3Oc3c2cccc3)=O)O)cc1,0 Y040-3245,O=C(CNC(C1Oc(cccc2)c2OC1)=O)N(CC1)CCN1c1cccc(Cl)c1,2 Z4561574227,CN(C1CN(Cc(cc(cc2)F)c2OC)CC1)C(C1CCC2(CC2)CC1)=O,2 SC42-0128,Cc1noc(C)c1CC(N(CC1)CCC11OCCC(Cc2noc(C)n2)C1)=O,0 SA73-0533,O=C(c1cccs1)N(CC1)CCC1(CC1CC1)c1noc(C2CCOCC2)n1,2 F6226-0053,O=C(CN(C=Nc1c2cccc1)C2=O)N(CC(C1)O2)C1C2=O,2 Z2477379247,CC(CC1)CCN1C(c1cnc(Nc2ccccc2)nc1C(F)(F)F)=O,2 D264-0530,Cc1cc(N2CCN(CCCNC(Nc(cc3)cc4c3OCCO4)=O)CC2)c(C)cc1,2 Z749616804,Cc1nccn1-c1ncc(CNC(N2CC(c3ccccc3)OCC2)=O)cc1,0 Z2959091917,CC1(C)CN(CCNC(c2cc(C(F)F)ncn2)=O)CCC1,2 F2515-0636,CC(N(Cc1cnccc1)c1nc(ccc(Br)c2)c2s1)=O,0 F6556-7657,CCN(CCN(C(NC(C)Cc1cc(cccc2)c2o1)=O)C1=O)C1=O,0 K284-6878,COc1ccc(CN2C(SCc(cc3)ccc3Cl)=Nc(ccc(N3CCOCC3)c3)c3C2=O)cc1,0 Z1453253434,Cc1nn(C)c2nc(C)c(CC(N(CCC3)CC3Nc3ccccc3)=O)c(C)c12,2 S565-0596,CCn1c(-c2nn(C)c(CC3)c2CN3C(c2ccc(Cn3nc(C)cc3C)o2)=O)nnc1,2 Z2948859640,CC(CC1)OCCN1C(Nc1cc(Oc2ccccc2)ncc1)=O,2 F6554-5379,O=C(C1(CCCC1)c(cc1)ccc1Cl)N(C1)CC1C(F)F,0 Z1971682960,Cc1c(CC(N[C@H](C2)[C@@H]2c2ccccc2)=O)c(C)n[nH]1,0 Z26909011,CC(c(cccc1)c1OC)NC(c(cc1)cc2c1ncs2)=O,0 Z1143007574,CC(C)(CN(CC1)CCN1C(c1c[nH]cc1-c(s1)ccc1Cl)=O)O,0 F6783-8651,CN(CC(C1)C(N(CC2)CCN2C(NC2=O)=NC(c3ccccc3)=C2F)=O)C1=O,2 Y207-2070,O=C(Nc1cc(CCC2)c2cc1)N(CC1)CCN1S(c1ccccc1)(=O)=O,2 L283-0267,CCCc(c(C)nc1ncnn11)c1Sc(cc1)ccc1NS(c1cc(C)c(C)cc1)(=O)=O,0 F6515-0160,O=C(CCc(cc1)cc(C(F)(F)F)c1Cl)NCc1c(-c2cscc2)nccc1,0 Z4638117201,COc(cc1[nH]nnc1c1)c1C(Nc1cc(CN)ccc1)=O,0 Z1454997349,Cn1cnc(C(N(CCC2)C2c2ccccc2)=O)c1,0 F6554-0982,Cn1nc(C(CCC2)CN2C(Cc(c(F)ccc2)c2Cl)=O)cc1,2 Y043-1115,O=C(CN(C(C=C1)=O)N=C1c(cc1)ccc1Cl)Nc1nnc(C2OCCC2)s1,0 Z442692414,CC(C)c1cc(C(Nc(cc2)cc(N3)c2OC(C)C3=O)=O)c(c(C)nn2C(C)(C)C)c2n1,2 F5871-3453,Cc1nsc(NC(C2(CCCC2)c2cccs2)=O)c1,2 F6667-8791,CC(C1)N(C(CCC(F)(F)F)=O)c2c1cccc2,0 F6521-4182,OC(CNC(c(c(F)ccc1)c1F)=O)c1csc2c1cccc2,0 F5939-1145,O=C(c1cc(cccc2)c2o1)N(CC1)CCC1Oc(sc1ccc2)nc1c2Cl,2 SA01-0829,CN(C)C(c1cnc(N(C)C)nc1C1CN(Cc(cc2)cc(F)c2F)CC1)=O,0 C656-0249,O=C(CN(C=Nc1c2nnn1Cc(cc1)ccc1Cl)C2=O)N(CC1)c2c1cccc2,2 T408-0613,O=C(C(CC1)Cc2c1sc(C(N1CCCC1)=O)c2)NCc(ccc(F)c1)c1F,0 Z1738876610,OC(C(C1)CN(CCNS(c(cc2)cc(C(F)(F)F)c2F)(=O)=O)C1=O)=O,0 S543-0803,CS(N(C1CC1)C1CC(CC2)(CCN2C(C2(CC2)c2ccccc2)=O)OCC1)(=O)=O,2 F0405-0458,CCCCCOc(cc1)ccc1NC(c(o1)ccc1Br)=O,0 F2496-1050,O=C(C1CCCC1)OCc1noc(-c(ccc(F)c2)c2F)c1,0 S428-0514,O=C(CCc1nc(cccc2)c2s1)N(CCC1)C1c1nc(C2CCOCC2)no1,2 F3382-2695,CCOc(cc12)ccc2ncc(C#N)c1Nc(cc1)cc2c1OCO2,2 S663-0264,COCC(NC(CC1)C1(CC1)CCN1S(c(cc1)cc2c1OCCO2)(=O)=O)=O,0 F6359-3866,Cc(cc1)nnc1OC(CC1)CCN1C(Nc1cccc(Cl)c1)=O,0 Z1844794463,CCN(CC)C(CC1)CN1C(CCc(cccc1)c1N1)C1=O,2 SB18-0268,Cc1nn(C)cc1C(N(C[C@H](C1)NC(C2CCOCC2)=O)[C@@H]1c1nc(C)n[nH]1)=O,2 Z1626796172,COc1cccc(C(C2)=CCN2C(c2cnc(-c3cccs3)s2)=O)c1,0 G747-0496,CC(N1Cc2cnccc2)=CC(O)=C(C(c(cc2)ccc2SC)N2CCCCC2)C1=O,2 Z1576606465,CC(c(cc1)cnc1N(CC1)CCN1C(c1ccc(C)cc1)=O)=O,0 Z2110021311,CN(C)Cc1cccc(NC(c2c(N)nc(C3CC3)nc2)=O)c1,2 Z3699383589,NC(Cc1n[nH]c2c1cccc2)C(NCc1ccc(CCCC2)c2c1F)=O,0 D072-1128,O=S(c1c(NCCN2CCOCC2)oc(-c2ccco2)n1)(c(cc1)ccc1F)=O,2 F5103-0382,O=C(Cc(cccc1)c1Cl)NCCc1cscc1,0 Z1334312584,CC(C)(CN(C)C(c1cocn1)=O)O,0 F6616-2660,O=C(c1nc2ccccc2nc1)N1CCSCC1,2 SB32-0764,Cc1nn(C)c(C(N(C[C@@H]2COC)C[C@@H]2c2nc(C3CC3)n[nH]2)=O)c1,2 Z2993169493,CNc1c(CN[C@@H](CC2)C[C@@H]2C(N)=O)cccc1,2 F6245-6822,Cc(n(-c1ccccc1)nc1)c1C(NCCN1N=C(c2cccs2)N(C2CC2)C1=O)=O,2 S757-0151,Cc1c(CN(CC2)CCC2N(C[C@H]2OC)[C@@H]2c2cnccc2)scc1,2 F2569-0735,O=S(C(CNS(c(cc1)ccc1F)(=O)=O)c1ccco1)(c(cc1)ccc1Cl)=O,0 F6471-8695,Cn1c(S(C(CC2)CCN2C(c2cc(-c(cc3)ccc3F)c[nH]2)=O)(=O)=O)ncc1,2 F870-0342,COc1cccc(NC(c(cc2)ccc2Nc2ccnc(-c(cc3)ccc3F)n2)=O)c1,0 Z1345188642,CCN(CCC(O)=O)C(c1cscc1C)=O,0 F6474-3582,O=C(CSc(cc1)ccc1F)N(CC1)CCC1Oc1cccc2cccnc12,2 F6549-7645,CC(C(N(C(CC1)C2)C1CC2n1ncnc1)=O)Oc(cccc1)c1F,0 Z2394616630,CC(CN)(CC1)CN1C(c1ccc(-c(cc2)cc(Cl)c2Cl)s1)=O,0 F2318-0236,Cc1c(C)n(-c(cc2)nnc2N(CC2)CCN2C(c(cc(cc2)Cl)c2OC)=O)nc1C,0 F2242-0207,Cc1cc(NS(c(cc2)cc3c2OCCCO3)(=O)=O)c(C)cc1,2 F5493-0309,CC(C)(Cc1ccc2)Oc1c2OCC(N(CCC1)CC1c1nnc(-c(cccc2)c2F)s1)=O,2 G516-1459,Clc(cc1)ccc1-c1nc2ccccc2c(N(CC2)CC2c2ccccc2)n1,2 F5033-2909,CS(N1CCC(CNC(Cc2cccc3ccccc23)=O)CC1)(=O)=O,0 Z1791110610,Cn1c(CNS(c(ccc(C(O)=O)c2)c2OC)(=O)=O)nnc1,0 F6734-2461,Cn1cnc(S(N2CC(CN(C3)c(cc4)nnc4-c4ccccc4)C3C2)(=O)=O)c1,2 Z2958877209,Cc1c(CC(Nc2c[nH]nn2)=O)sc(C2CCC2)n1,2 Z1868673054,CC(C)N(CC(N1c2cc(C)nn2C)=O)C1=O,0 SD08-0499,CN(C)C(NCc1c(COC(CCC2)(C3)CN2C(Cc2cscc2)=O)n3nn1)=O,0 F6363-0710,Cc1c(C(N(CC2)CCN2c2nc(C)nc(-n3cccc3)c2)=O)sc(C)n1,2 F5110-0086,O=C(COc(cccc1)c1F)NCCS(N(CC1)CCN1c1ncccc1)(=O)=O,2 H025-0507C,CC(C(C1)N(C)CCc2c1c(cc(C)cc1)c1n2CCc1ccccc1)O,2 Z1865499070,CC(C1)OCCC1C(NS(c(cc1)cnc1OC)(=O)=O)=O,2 Z1211453918,CC(C(C)(C)C)C(Nc1cc(-c2nnnn2C)ccc1)=O,0 Z2181615765,O=C(NC(CC1)Cc2c1[nH]cn2)N1CC(Cc(cc2)ccc2F)CC1,0 Z3896584175,CC(CNC(c1cc(C(F)(F)F)nn1C1CC1)=O)(C1)CS1(=O)=O,2 F6709-4930,CCc1cnc(N(C2)CC2Oc2cc(C)ncc2)nc1,0 Z363126490,CCOc(cc(cc1-c2ccccc2)C(NCCN2CCOCC2)=O)c1OC,2 Z1921106545,CN(Cc1cn(C)nc1)C(N[C@H](C1)[C@@H]1c(cc1)ccc1F)=O,0 Z3880358827,C[C@@H](c1ccnn1C)NC(C(N[C@H](C)c1cnc(C(F)(F)F)cc1)=O)=O,2 Z2212292629,Cc(cc(C)s1)c1S(N(CCC(O)=O)C1CC1)(=O)=O,0 S976-1457,O=C(C1(CN(Cc2cocc2)CCC1)F)N1CCCC1,2 Z3019714078,Cc1nnc([C@@](CCC2)(C3)[C@@H]2CN3c2nccn3nnnc23)o1,2 F6506-0197,COc1c(C2(CC2)C(NCC(c2cocc2)(c2ccco2)O)=O)cccc1,2 Z4898055061,CC(C(NC(Nc1ccccc1)=O)=O)OC(c1c(C)n(-c(cc2)cc3c2OCCO3)nn1)=O,2 V019-3058,NC(CC(c1cn(Cc(cc2)ccc2F)c2c1cccc2)c1ccc(C(F)(F)F)cc1)=O,0 Z4607551787,CC(c1cccc(C(NS(c2cnc3onc(C)c3c2)(=O)=O)=O)c1)=O,2 F6610-3311,Clc(cncc1)c1NCCCN1CCOCC1,2 Z3700495299,Cc(cc1)cc(N(C)CC2)c1N2C(CC1CCNCC1)=O,0 S380-0016,CCc(cc1)ccc1NC(CN(C(C1(CCCCC1)N1)=O)C1=O)=O,0 Z1663128032,CC(C)(C(c(cc1)cc(F)c1F)NC(Cc(cc1)cc2c1OCCO2)=O)N1CCCC1,2 V001-2038,CCOc1ccc(C2N(Cc3c(C)cccc3)CCCn3c2ccc3)cc1,0 F6481-3691,Cc1c(C(N(CC2)CCSC2c2ccco2)=O)n(cccc2)c2n1,2 Z2293325599,CCOC(C1)CN1C(Nc1c(C)nncc1)=O,0 Z2960610381,CCc1noc(COCC(N(C2)[C@@H](C)CC[C@@H]2O)=O)n1,2 F6057-0027,O=C(c1ccccc1)c(cccc1)c1C(N1CCN(CCn2nccc2)CC1)=O,2 F6359-3424,Cc1cc(C(N(CC2)CCC2Oc2nnccc2)=O)no1,2 Z1955362241,C[C@@H](CN(C1)S(c(cc2)cc(Cl)c2OC)(=O)=O)[C@H]1C(O)=O,0 Z1123228992,Cc1nc(CS(c2nccn2-c2c(C)cc(C)cc2)(=O)=O)cs1,0 F5017-2960,CSc(nccc1)c1C(N1CCC(CNS(CCc2ccccc2)(=O)=O)CC1)=O,2 V028-6266,CCN(Cc1ccccc1)CC(N=C(N1)N(CC2)CCN2C(Nc2cccc(Cl)c2)=O)=CC1=O,2 Z3499507649,Cc1cccc(NS(c2cc(C(C3)C3(F)F)ccc2)(=O)=O)c1,0 S646-0753,O=C(C1CCOCC1)N(CC1)CCC1N(CC12CCCCC2)C1c1ccncc1,2 F6639-1760,Cc1cccnc1OCC(CC1)CCN1C(c1nccc2ccccc12)=O,2 F5852-0810,Cc1nccn1CCNC(C(NCCC1=CCCCC1)=O)=O,2 C271-0244,Cn1c(cccc2)c2c(C(C(C(Nc2cccc(Cl)c2)=O)c2c3cccc2)N(C)C3=O)c1,0 C562-1183,CC(C)CC(C(Nc1cc(C)cc(C)c1)=O)NS(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,0 G894-0882,CCOc1ccc(CCN(C(C)(CC2)C(NCc3ccc(C)cc3)=O)C2=O)cc1,0 Z30380624,CCN(CC(NCc(cc1)ccc1F)=O)C(CCCc1c[nH]c2c1cccc2)=O,0 Z1888979887,Cn1ncc(C(NC(CC2)CN2c(cccc2)c2C(N)=O)=O)c1Cc1ccccc1,2 SD25-0236,O=C(CCC(CN(C1)C(Cc(cccc2)c2F)=O)C11CCCCC1)NC1CC1,2 SA22-0632,O=C(C1CC1)N(C1)CC1N(CC(C1)(F)F)[C@@H]1C(N(CC1)Cc2c1cccc2)=O,2 F6524-0976,O=C(c1cc2nccnc2cc1)NCCN1N=Nc(cccc2)c2C1=O,2 F6506-0161,OC(CNC(C1(CCOCC1)c1ccccc1)=O)(c1cocc1)c1ccco1,2 F6561-4705,C=C(CC1CC2)CC2N1C(c1noc(C2CC2)c1)=O,2 F541-0617,CC1=Nc(cc(cc2)-c3noc(C(CC4=O)CN4c4ccccc4)n3)c2N(C2CCCC2)C1=O,2 Z1198963603,CC(CC1)CCC1Oc1nccc(CNC(N(C)C)=O)c1,0 SA40-0691,CC(C)NC(C1N(C)CC(C2)(CN2C(c2nn(C)c(C)c2)=O)C1)=O,2 Z1616606265,Cc1cccnc1C(N[C@@H](CO)c1ccccc1)=O,0 F6312-0425,O=C(NCCCn1c2ncccc2cc1)NCc(cc1)ccc1Cl,2 Y080-0463,CN(CC(C1)c2nc(cccc3)c3n2CCCc2ccccc2)C1=O,2 Z1653524853,Cc1cc(C(CC2)CN2C(C(CCCC2)N2S(C)(=O)=O)=O)cc(C)c1,0 F160-1376,Cc1c(C)oc(N=CN2CCC(NCCCN(CC3)CCN3C3CCCCC3)=O)c1C2=O,2 F6573-1544,Cc1nc(S(NCC(CCC2)N2c2ncccn2)(=O)=O)cn1C,2 SB15-1100,O=C(C1CC1)N(C1CCOCC1)C(CCC1)CN1C(c1cocn1)=O,2 F6481-2411,Cc1c(C(CC2)SCCN2C(c(cccc2OC)c2OC)=O)cccc1,0 S618-2016,CNC(NC[C@H](CCN(C1)S(c2cc(C#N)ccc2)(=O)=O)[C@H]1N(C)C)=O,0 5593-0516,OCCN(CC1)CCN1C(CC(N1c(cc2)ccc2Br)=O)C1=O,0 Z4898819720,CC(C)CC(CC(C1)C(Nc2c[nH]nc2-c2nccnc2)=O)NC1=O,2 Z1744260711,O=C(c1cc(Oc2nccnc2)ccc1)N(CC1)CCC1Oc1cncc(Cl)n1,2 Z992241444,OC(c1cc(-c(cccc2)c2F)cnc1)=O,0 4905-1307,Cc(cc(cc1)OC)c1S(N(CCC1)CCN1S(c(cc1)c(C)cc1OC)(=O)=O)(=O)=O,0 F6816-4404,CCn1nc(C(F)(F)F)c(CNc2c(ccs3)c3ncn2)c1,0 F6436-2571,O=C(c1cc(Br)cnc1)NCC(CC1)CCN1C(Oc1ccccc1)=O,0 S700-1687,O=C(C1CCCC1)N(C1)CC1c1nc(CCOC2CCCC2)no1,2 F5012-0117,CCOC(N(CC1)CCN1S(CCCOc(cc1)cc2c1OCO2)(=O)=O)=O,2 F6510-4340,O=C(CN(c(cccc1)c1N1C2CC2)S1(=O)=O)Nc(ccc(F)c1)c1F,2 F2135-0643,CC(c(c1c2cccc1)cn2S(c1ccc(C)cc1)(=O)=O)=O,0 F6475-1151,O=C(c1cc(OC2COCC2)ncc1)N(Cc1ccccc1)c1ncccc1,2 F5791-2074,Cn1c(SCCNC(c2cc(-c(cc(cc3)OC)c3OC)nn2C)=O)nnc1,2 V024-4365,CC(C)NC(C(C)N(CC1)CCC1(C(C)=O)c1ccccc1)=O,0 F5788-4837,CC(C)c(cc1)ccc1N(CCN1CC(Nc(cccc2)c2SC)=O)C1=O,0 Z2956092571,OC[C@H]1[C@H](C2)[C@@H]1CN2C(Nc1c(-c2ccccc2)[nH]c2c1cccc2)=O,2 Z1863938579,CCc1c(CC)nnc(NCc2c(N3CCCC3)nc(C)cc2)n1,2 F6783-7172,Cc1cc(CN(C2)CC(C3)C2CN3c2nc(C)nc3c2CCC3)no1,2 F6475-6657,CN(C(c(cc1)cnc1OC1CSCC1)=O)c(cccc1)c1C(OC)=O,0 S812-3709,O=C(c(ccnc1)c1F)N1C(C2CCCC2)c2nccn2CCC1,2 D724-0555,Cc1nn2c(Nc3cccc(Cl)c3)c(CCC3)c3nc2c1-c1ccccc1,0 Z1168091373,CN(C)C(CN(CC1)CCC1NC(c(cc1)cc2c1OCCO2)=O)=O,2 D074-0244,Oc(cccc1)c1-c1n[nH]c2c1C(c1cc(Oc3ccccc3)ccc1)N(CCc1ccccc1)C2=O,2 Z2378725086,CC(CC1)C(CN)CN1C(c1c(C(F)(F)F)n(-c(cccc2)c2F)nc1)=O,0 F6816-2853,Cc(cc1)cc(CCC2)c1N2c(cc1)nnc1C#N,2 SA67-0873,CS(N1CC(CCc2noc(C3CCOCC3)n2)CC1)(=O)=O,0 S940-0237,O=S(c1cc(CCC2)c2cc1)(N1CC(Cc2nc(-c3cnccc3)no2)C1)=O,2 Z3212747217,C[C@H](CC[C@@H](C1)C(O)=O)N1S(c(s1)cc(C)c1Cl)(=O)=O,0 SB29-1023,Cc1nc([C@H](C[C@@H](C2)OC)N2C(COc(cc2)ccc2OC)=O)n[nH]1,2 Z1629787612,CCc1noc(C)c1C(N(C1)Cc2c1ccc(C(O)=O)c2)=O,2 E756-0754,Cc(cc1)cc2c1n(C)c(C(NCCC1=CCCCC1)=O)c2N(CCC1)C1=O,0 F2079-0078,O=C(c1c(C(F)(F)F)cccc1)Nc1nnc2SCCn12,2 Z1716047144,CC(C)(c1nc(cccc2)c2n1C)NC(C1CC1)=O,0 P435-1121,Cc1c(C(N2CCCC2)=O)nc(C(CC2)CCN2C(Nc(ccc(F)c2)c2F)=O)o1,2 Z2964254355,O=C(c(c(C1CC1)n[nH]1)c1Cl)N1C[C@H](CC2)[C@H]2C1,2 Z2006155094,CNC(N(CC1)CCC1N(CC1)c2c1cccc2)=O,0 Z4168482403,CC(c1cn(Cc2ccc(C(N3CC(c4ccccc4)OCC3)=O)o2)nn1)O,2 C301-7080,CN(c(c(N1C)c2)cc(NC(Nc3c(C(F)(F)F)cccc3)=O)c2N2CCCC2)C1=O,0 Z2960004252,C[C@@H](CF)NC(c(ccc(C1CC1)n1)c1O)=O,0 Z1883805484,Cc(cc(CN(C)S(c1cc(C#N)ccc1)(=O)=O)cc1)c1F,0 E977-0195,O=C(CCC1)Nc(cc2)c1cc2S(NCCN(CC1)CCN1c(cccc1)c1F)(=O)=O,2 Z744371858,CC(c1ncccc1)NC(N(CCC1)CCN1C(c1cscc1)=O)=O,2 V025-5517,CCc1nc(SCc2ccc(C(N3CCN(C)CC3)=O)o2)nc(N(CC2)CCN2c(cccc2)c2F)c1,2 F6469-1670,O=C(c1nn(-c2ccccc2)nc1)Nc(cccc1)c1-c1cn(cccc2)c2n1,2 F6451-0960,Cc1ccc(C(CNC(C(Nc(cc2)cc(Cl)c2F)=O)=O)OC)s1,0 F6713-1719,Cc1cc(C)nn1C(C=C1)=NN(C(CC2)CCN2S(C2CC2)(=O)=O)C1=O,2 F6808-8298,OCC1CCN(Cc2cc3ccccc3cc2)CC1,0 F6416-9036,COC(c(cc1)ccc1C(NCCC(c1cccc(Cl)c1)O)=O)=O,0 S947-0373,CN(C)C(N1C[C@](COCC2CC2)(CN(C2)c(cc3)cc(C(F)(F)F)c3C#N)[C@H]2CC1)=O,0 F3084-0049,COc1ccc(CNC2(CC(C3)C4)CC4CC3C2)cc1,2 SA72-1057,COCCC(CC1)(CCN1C(c1c[nH]cn1)=O)c1noc(C2CCOCC2)n1,2 8179-0043,COc(cccc1)c1OCCN(C(C1(c2c[nH]c3c2cccc3)O)=O)c2c1cccc2,0 Z1447611823,CC(Cc1n[nH]c(C)c1)NC(NC1C(C)C1)=O,2 Z4767055404,CC1CN(CCCNC(c2ccc(Cn3ncc(Br)c3)s2)=O)CC(C)C1,0 F447-0321,OC(c1c(cc(cc2)NS(c3cccs3)(=O)=O)c2nc(N(CC2)CCN2c(cccc2)c2F)c1)=O,0 Z1601636824,Cc1nsc(NC(CC2)CN2c(cc2)ccc2Cl)n1,0 F6565-4926,Clc1cc(Cl)c(CN(CC2)CCN2c2nnc(CCC3)c3c2)cc1,0 F6524-6034,Cc1cc(C(NCCN(C(C)=Nc2c3ccs2)C3=O)=O)c(C)o1,2 SC73-0234,Cc1cn(CC(N(CC2)CCC2(C2)OCc3c2n(C)nc3C(NC2CC2)=O)=O)nc1,2 S248-3177,CNC(N1CC(Cc2noc(-c(cc3)ccc3OC)n2)CC1)=O,0 Z1575144279,CCOC(c1cnc2sc(C)c(C)n12)=O,0 F6709-0403,CCc(cn1)cnc1OC1CCN(Cc2noc(C)n2)CC1,2 V027-2345,CC(C)c1nc(C)c(Cc2ccc(C)cc2)c(N(CC2)CCN2C(c2cccs2)=O)n1,0 Z1580802050,CCn1nc(C)c(NC(NCc2ncccc2C)=O)c1C,0 F2416-0507,O=C(COc(ccc(Cl)c1)c1Cl)Nc1cc(CN(CC2)C(c3ccco3)=O)c2cc1,2 Z1738939751,CC(C)Oc(cc1)ccc1S(N(C)CC(O)=O)(=O)=O,0 SC77-0791,Cc1ccc(CNC([C@H](CN(C2)S(C)(=O)=O)[C@@]22OCCNC2=O)=O)o1,2 D505-0155,Cc1cccc(CNS(c2c(C)ccc(C(C3=C4CCCC3)=NN(C)C4=O)c2)(=O)=O)c1,0 Z1575918404,CCc1nn(C)cc1C(NCCc1cccc(C(NC)=O)c1)=O,0 F6523-0048,O=C(c1c2OCCOc2ccc1)NC(CC1)CCN1c1cc(C(F)(F)F)ncn1,2 Z3439979179,CN(CC[C@@H]1NC(NCC(c(cccc2)c2N2)=CC2=O)=O)[C@@H]1c1ccccc1,2 F6525-7650,O=C(c1cc(cccc2)c2s1)NCCn1ncc(-c2cocc2)c1,2 Z4497009425,CC(c1noc(COCC2CC2)n1)Oc(ccc(Br)c1)c1Cl,2 Z1006410918,CCC(Nc1cccc(C(NCC2OCCN(C)C2)=O)c1)=O,0 F5298-2423,O=C(Cn(c(C1CC1)c1)nc1C(N1CCOCC1)=O)Nc(cc1)cc(Cl)c1F,2 Z2295968655,OC(c1c(CC(CC2)CCN2C(Cc2c[nH]c3c2ccc(F)c3)=O)cccc1)=O,0 SB99-0268,CCn(cc1)nc1C(N(CC1)Cc2c1n(C)nc2CCC(N1CCOCC1)=O)=O,2 Z3138578900,Cn(cc1)nc1-c1cc(C(N[C@]2(CCC3)[C@@H]3CNC2)=O)no1,2 Z1727399419,CCOc1nc(C(NC2(CCCC2)c(ccc(F)c2)c2F)=O)co1,0 C712-1082,O=C(c1cc(COc2c-3cccc2)c3s1)N1CCC(Cc2ccccc2)CC1,2 Z358284404,CCCNC(NC(CNc1cc(-c2nnnn2C)ccc1)=O)=O,0 F6517-4738,OC(CNC(c(c(F)ccc1)c1Cl)=O)c(cc1)ccc1-c1cscc1,0 Z996170974,CS(Cc1ccc(C(NC2(CCC2)c(cc2)ccc2Br)=O)o1)(=O)=O,2 F3379-0375,C(c1ncccc1)Nc1ncnc2c1cnn2Cc1ccccc1,2 Z2697279348,CC(C)CN(CC1)CCC1NCc(cc1)cc(OC2CC2)c1OC,2 Z2472863211,OC(C(CCC1)CN1C(c(cc1)cnc1-c1ncccc1)=O)=O,2 V028-7866,O=C(Nc1ccccc1)N(CCC1)CC1OCc1cccc(C(F)(F)F)c1,0 F6175-1065,Cc1cc(C)nn1-c1cc(N(CCC2)CC2C(NC(C2=O)=C(C)N(C)N2c2ccccc2)=O)ncn1,2 Z1684418664,C(C1)C(C2)OC1C2c1nc(-c(cccc2)c2-n2nccc2)no1,2 M980-0098,Cc1nc(cc(cc2)N(CC(C3)C(N(CC4)CCN4c(cc4)ccc4F)=O)C3=O)c2o1,2 L334-2583,O=C(c1ncccc1)NCCC(CC1)CCN1C(Nc(ccc(F)c1)c1F)=O,2 Z1886955558,O=C(c1coc(C2CCOCC2)n1)Nc1nc(C2CCC2)cs1,2 F0651-0105,Cc1cc(cc(CNC(CC(c2ccccc2)c2ccccc2)=O)cc2)c2[nH]1,2 F891-1526,CC(C)c1nc(-c2cc(S(N(CC3)CCC3C(N(C(C)C3)c4c3cccc4)=O)(=O)=O)c(C)s2)no1,2 Z1418947046,O=C(C(CCN1)CC1=O)Nc1cccc(C(F)(F)F)c1,0 V004-7276,Cc1ccc(C(c2c(CC3)ccc(OCc4nc(C(N(C)Cc5ccco5)=O)cs4)c2)N3C(C2CC2)=O)cc1,0 F3406-8200,CCOC(c1c(C)n(-c(cc2)ncc2C(NCc2ccco2)=O)nc1)=O,2 P621-0532,CCN1c(nccc2)c2OC(C)(C(NCc(cc2)cc(Cl)c2F)=O)C1=O,0 SB25-0905,O=C(C(CC1)CCC(N=C(c(cc2)ccc2F)N2)=C1C2=O)NCCCN(CCC1)C1=O,2 Z2707380059,CC(CN(CC1)Cc2c1c(O)ccc2)(c(cc1)ccc1S(C)(=O)=O)O,0 F6031-0255,OC(CN(CC1)CCN1C(Cn1c(cccc2)c2nc1)=O)C1CC1,2 F0596-0100,O=C(CSc1ncnc2c1oc1c2cccc1)c(cc1)ccc1Cl,2 Z2912661654,Cc1cc(CCC(N(CCC2)[C@@H]2C(O)=O)=O)no1,2 Z3595279804,Cn1nc(C(N(C2)CC2c2n[nH]cn2)=O)c(C(F)(F)F)c1Cl,2 Z2763755755,Cc(cc1)nc(N(C)C)c1NC(NC1CCN(CC(O)=O)CC1)=O,2 Z4662035221,OC1(CNc2c(ccc(Br)c3)c3cc(Cl)n2)COCC1,2 F6374-3596,O=C(C(CC1=O)CN1c(cc1)ccc1Cl)N1CCC(CSC2=NCCS2)CC1,2 Z2755421391,CC(C)(C)CC(C(F)(F)F)NC(c1c(C)ncc(C(O)=O)c1)=O,0 Z2443754467,CC(CC1)=C(C)CC1C(NS(c(c(F)c(cc1)F)c1Cl)(=O)=O)=O,0 S824-3225,CCn1ncc(C(N(C[C@@H]2COC)C[C@@H]2c2ccncc2)=O)c1,2 S428-1237,O=C(CCC(N1CCOCC1)=O)N(CC1)CC1c1nc(C2CCOCC2)no1,2 F6619-7145,Cc(cc1)nnc1N(CC1)CCN1c1nccnc1C#N,0 Z2826955525,O[C@H](C1)CN[C@H]1C(N[C@@H](CC1)c(cc2)c1cc2Cl)=O,2 SB27-0672,CC(C)CCN(CC1)CCC1N(C1)C2(COCC2)CN(Cc2ccccc2)C1=O,0 Z1455754889,O=C(c1ccccc1)c(cccc1)c1C(N1CCNCC1)=O,0 Z2238875893,CC(C)C[C@@H](C(O)=O)NC(c(ccnc1)c1Br)=O,0 F6481-0479,CN(C)S(N(CC1)CCSC1c1ccccc1)(=O)=O,0 Y207-4399,COc(ccc(S(N(CC1)CCN1S(c1cccs1)(=O)=O)(=O)=O)c1)c1OC,0 J030-0469,CN(CC1)CCN1c(cc(c1c2)Oc(cccc3)c3NC1=O)c2S(N1CCCC1)(=O)=O,0 Z33547026,Cc(cc1)ccc1-c1c(CC(N)=O)nc(-c2ccccc2)s1,0 F3230-0335,CC(c(cc1)cc(OC)c1OCC(Cn1ncnc1)O)=O,2 S615-0243,O=C(c1n[nH]c2c1cccc2)N(CC1)CC1c1nc(CCOCC2CC2)no1,0 F6184-0778,O=C(NC1(CC(C2)C3)CC3CC2C1)N(CC1)CCC1c1cccs1,2 Z1659973894,O=C(Cc1c[nH]c2cccc(Br)c12)NC1(CCOCC1)c1nocn1,0 F6454-2163,Cc1nccc(N2CCC(CNC(COc(cccc3)c3F)=O)CC2)c1,0 SB12-0064,CN(C(CCc1c2cccc1)C(NC1CCCC1)=O)C2=O,2 SA57-0334,O=C(c1cncnc1)N(CC1)CCC1(C1)OCCC1Oc1nccnc1,2 K261-2276,CCC(C)NC(CN(c(cccc1)c1S(N1c2cc(C)cc(C)c2)(=O)=O)C1=O)=O,0 Y042-2661,Cn(c(C(NC(CC1)c(cc2OC)c1cc2OC)=O)c1)c2c1c(OC)ccc2OC,0 F5835-0499,O=C(c1cc(-c2ccco2)n[nH]1)N(CC(C1)CN23)CC1C3=CC=CC2=O,2 F2605-0001,Cc(cc1)ccc1-c([nH]1)cnc1SCCNC(c1cccs1)=O,2 F6245-5053,CN(C1=O)N=C(C(CCC2)CN2C(Nc(cc(cc2)Cl)c2OC)=O)N1c1ccccc1,2 F6805-3086,CCc1nccn1CC(C1)CN1c(nc1)nc(OC)c1Br,0 Z27812711,O=C(C1=Cc(cc(cc2)Br)c2OC1=O)Nc(cccc1)c1Cl,0 Z1888412825,OC[C@@H](C(O)=O)NC(C(C1)Cc2c1cccc2)=O,0 Z1678176033,CC(CNC(N1CC2(CCC2)COCC1)=O)c(cc1)ccc1F,0 SB20-1499,COc(cc1)cc(NC(N2[C@H](Cn3nnc(C(NC4CCCC4)=O)c3)CCC2)=O)c1OC,0 F6523-0521,Cc1nc(N(CC2)CCN2C(c2nn(CCCO3)c3c2)=O)cc(C(F)(F)F)n1,2 C784-1941,CCC(C(NC(C)c(cc1)cc2c1OCCO2)=O)N(C1=O)N=C(CC)n2c1cc1c2cc(C)o1,0 F2147-6866,FC(c1nc(-c(nc2)ncc2Br)no1)(F)F,2 F3316-0195,Cc(cc1)c(C)cc1S(N(CC1)CCN1C(N1CCCC1)=O)(=O)=O,0 L165-0952,O=C(C1(CC1)c(cc1)ccc1NC(c1cccs1)=O)NC1CCCCC1,2 E234-2053,CC(C)CCNC(C(C)(Cn(c1c2)c3c2cccc3)N(CCC2=CCCCC2)C1=O)=O,2 G414-0912,Cn1ncc2c(N3CCN(C)CC3)nc(N3CCN(Cc4ccccc4)CC3)nc12,2 F6726-5635,CN(C(C1)CN1c(ncnc1-c(cc2)ccc2F)c1F)c1nccn2nccc12,2 Y042-8019,OC(C(Cc1c2[nH]c3c1cccc3)NC2c(cccc1)c1Cl)=O,0 S565-0364,Cn1c(-c2nn(C)c(CC3)c2CN3C(c2nc3ccccc3cc2)=O)nnc1,2 Z2448073031,CC1(CN)CN(CC(Nc(cc(cc2)Cl)c2Cl)=O)CC1,0 Z3091731830,CN(CCCN1CCCC1)C(C1(Cc2cnn[nH]2)CCC1)=O,2 F6515-1181,Cc1c(C(NCc2cc(-c3ccco3)ncc2)=O)c(-c(cccc2)c2Cl)no1,2 Z3027270179,C[C@H]1N(Cc2csc(NC(C)=O)n2)[C@@H](CCO)CCC1,2 Z955959230,CCOC1CCN(Cc(cc2)nn2-c2cccc(F)c2)CC1,0 F6441-3408,CC(C)CS(C(CC1)CCN1C(CCc1cc(F)c(C)cc1)=O)(=O)=O,0 Z1616670848,CC(C(NC(CC1)CCN1C(CCOC)=O)=O)c1c(C)n(CC(F)(F)F)nc1C,2 Z2826674352,CCc1c(C(NC2C3(CCC3)NCC2)=O)nnn1CC,2 F6523-3294,O=C(c1ccno1)NCCN(Cc(cc(cc1)Cl)c1OC1)C1=O,2 8011-9036,C(CN(CC1)c2ncnc3ccccc23)N1c1ncnc2ccccc12,2 Z2266837963,OC(C1CCC1)C(Nc(cc1)cc2c1[nH]c(-c1ccco1)n2)=O,2 S721-0790,O=C([C@H](C[C@@H](C1)Oc2cnccc2)N1C(c1ccco1)=O)N1CCCC1,2 F2167-4143,CC(C)(C)OC(N1CCC(Cn2nncc2)CC1)=O,2 Z4361547693,CCOc(c(CN)c1)cc2c1OC(C)C2,0 Z2011098333,CC(N(CCc1ccc2)c1c2NC(c1nc(C)cc(C)c1)=O)=O,0 F6412-1880,O=C(c1cscc1)NCC#CCOc1cc(C(F)(F)F)ccc1,2 Z2790698996,CN(CC1OCCOC1)C(C(O)=O)c1cc(OC)ccc1,2 F0619-0038,CCOC(C(C(CC(c(cc1)ccc1F)=C1)c(cc2)ccc2F)C1=O)=O,0 F6487-0764,CN(CC(C1)OCc2c1cccc2)C(c1ccco1)=O,2 F707-3181,O=C(C(CC1)CCN1c1nn2c(-c3ccccc3)nnc2cc1)N(CC1)CCN1c1ncccn1,2 Z3018686315,CNCC(CCC1)CN1C([C@H](C1)[C@H](C(F)F)Oc2c1cccc2)=O,0 Z993620156,CN(C)c1ccc(CCNC(c2cc3nccnc3cc2)=O)cc1,0 Z1870054490,CC(C)(C)c(cc1)ccc1C(NCC(N(CC1C(O)=O)Cc2c1cccc2)=O)=O,2 Z1271183097,CC(NCC(C1)OCCN1S(C1CC1)(=O)=O)=O,0 Z5054602496,O=C(c1c(-c(cc2)ccc2F)ocn1)NCc1nc(C(F)(F)F)ccn1,0 F6561-7761,CC(C(NC1CN(Cc2cscc2)CC1)=O)Oc(cc1)cc2c1OCO2,2 F2410-0629,Cc(cc1)ccc1OCC(Nc1c(C(Nc(cccc2)c2OC)=O)oc2c1nccc2)=O,2 F6448-1800,Cn1nnc(C(Nc2cn(C3CCOCC3)nc2)=O)c1,2 F6565-4589,CC(C)S(c1ccc(CC(N(CC2)CCN2c2nnc(CCC3)c3c2)=O)cc1)(=O)=O,2 SC74-0674,O=C(CC1CC1)N[C@@H](C[C@@H](C1)C(N2CCCC2)=O)[C@@H]1c1nc(-c2ccccc2)no1,2 Z2790689887,COc1cccc(C(C(O)=O)N2Cc3ncnn3CC2)c1,0 SC68-2048,CC(C)Cn1c(C(CN(C2)C(Cn3nc(C)cc3C)=O)C22CCCCC2)nnc1,0 F6475-1958,O=C(c(cn1)cc(Cl)c1OC1COCC1)N(CC1)CCC1(C1)Oc(cccc2)c2C1=O,2 SA92-0714,FC1(CN(Cc2c(cc[nH]3)c3ccc2)CCC1)c1nc(C2CC2)no1,2 Z1174014536,CC(C(NCC1(CCOCC1)C(N)=O)=O)N1CCC(Cc2ccccc2)CC1,2 F0521-0319,Cc(cccc1)c1-n1ncc2c1ncnc2NCc1ccco1,2 F1899-0864,COc(cccc1)c1-c(cc1)nnc1SCC(Nc1cc(C(F)(F)F)ccc1)=O,0 F1917-9690,FC(Oc(ccc(C1NCCCC1)c1)c1F)(F)F,0 Z4662167254,Cc(cc(cc1)F)c1S(N(C)Cc1nnc2n1CCN(C)C2=O)(=O)=O,0 F6403-3175,O=C(NCCc1csc(-n2nccc2)n1)NC(c1ccccc1)c1ccccc1,2 Y043-0960,Cc1c(C(CN(C(C=C2)=O)N=C2c(ccc(OC)c2)c2F)=O)c(cc(cc2)OC)c2n1C,0 S740-0599,CC(C)CN(C([C@H](C[C@@H](C1)NC(c2cscn2)=O)N1CC1)=O)S1(=O)=O,2 Z2086869826,CC(CC1)CC(C(N2c(cc3OCCOc3c3)c3Cl)=O)N1C2=O,0 F6514-2368,O=C(Cn1c(cccc2)c2nc1)NC(C1CCOCC1)c1cnccc1,2 SA45-0027,CN(CCCC1(CC2)CCN2C(CCc2c[nH]c3c2cccc3)=O)C1C(N)=O,0 Z1675569493,O=C(c1cc2nccnc2nc1)N(CC1)CC1c1ccccc1,2 SC70-0227,O=C(Cc1cnccc1)N(C1)CC2(CCC2)C1c1n[nH]c(C2CC2)n1,2 F5753-0272,Cc(c(C)c1)cc2c1ncn2CC(CC1)CCN1S(CCN(C(CCC1)=O)C1=O)(=O)=O,2 Z1730724910,CCc(cc1)cc(C(N[C@@H](Cc2c[nH]c3c2cccc3)C(OC)=O)=O)c1O,0 F6559-0681,O=C(C1CC=CCC1)N(CC1)CCC1N(C=Nc1c2cccn1)C2=O,2 F1882-0381,COc(cccc1)c1N(C1=O)C(SCC(NCC2OCCC2)=O)=Nc2c1[nH]c1c2cccc1,0 SA67-0075,Cc1noc(C)c1CC(N1CC(CCc2noc(C)n2)CC1)=O,2 F345-3052,CC(C(CC1)CCN1C(Nc(cc1)ccc1Cl)=O)C(Nc(cc1)ccc1OC)=O,0 S808-0371,CN(C)C([C@@](CC1)(CN(Cc2ccccc2)CC2)[C@@H]2N(C)S1(=O)=O)=O,0 D628-0051,O=C(c1cccc(Cl)c1)N(CCC1)C1c1nc(cccc2)c2s1,0 Z854098592,O=C(C1OCCNC1)Nc(cc1)cc2c1[nH]nc2,0 F6796-0716,COc(ccc(Cl)c1)c1Nc1ncnc2c1ncn2CC1OCCC1,0 V018-9403,O=C(c1nn(CCN(Cc2ccc(C(F)(F)F)cc2)C2=O)c2c1)NCc1ncccc1,2 D298-0255,O=C1n2nc(NCc(c(F)ccc3)c3Cl)nc2NC2=C1CCCC2,2 SC02-0350,Cc(occ1)c1C(N(CC1)CC1(CCOC)NS(c1ccccc1)(=O)=O)=O,2 F6516-1231,COc1c(C2(CC2)C(NCc2ccc(-c3cscc3)o2)=O)cccc1,2 Z4579754618,CC(C)(CCC1)CCC1C(NS(c1ncc(C(F)(F)F)cc1)(=O)=O)=O,2 G932-0246,CC(CCC1)CN1c1nc(Nc2ccccc2)c(cnn2-c3ccccc3)c2n1,0 F6745-8801,Cc1nsc(N(CC2)CCN2c2nc(cccc3)c3o2)n1,2 F6438-6856,CN(C(CCC1)C1F)C(c1c2OCCCn2nc1)=O,0 Z220527564,CC(C)c(c1c2)noc1ncc2C(NC(C)c(cc1)ccc1F)=O,0 Z2952356923,CCN(C(c1cn(C2CCC2)nc1)=O)c1cnccc1,2 Z88239626,O=C(C(F)F)NCc(cc1)ccc1S(N1CCCCC1)(=O)=O,0 F6400-1518,O=C(Nc1cccs1)N1C(CN2CCOCC2)CSCCC1,2 F6230-0346,O=S(c(cc1)cc2c1OCCO2)(NCc1c(cccc2)n2nc1)=O,2 Z2974628866,Cc1nn(ccnc2NCCN(Cc(cccc3)c3OC3)C3=O)c2c1,2 F2880-3312,Cc1nc2ccccc2c(NC(C(NCC(c2cccc3ccccc23)N2CCOCC2)=O)=O)c1,2 V023-4931,COc1ccc(CN(CCCn2c3ccc2)C3c(c(F)ccc2)c2F)cc1,0 F6681-3550,O=C(C1OCCCC1)N1CC(COc2cnccc2)C1,2 S662-0165,COc1cccc(CN(CC2)CCC2(CC2)C2N2CCOCC2)c1,0 SD62-0237,O=C(CCC(C1)C2(CCC2)CN1C(CN1CCOCC1)=O)N1CCCC1,2 Z3644034611,CC(c1cc(C)no1)NS(c1ccc(C(C)(C)C)cc1)(=O)=O,0 F3348-0463,Cc1cc(C)nn1-c(n1nc2C)c(CCC3)c3nc1c2-c1ccccc1,2 F5832-5086,O=C(C1Oc(cccc2)c2OC1)NCC(c1ccco1)N1CCOCC1,2 SA68-0863,O=C(C1CC1)N(CC1)CCC1N(CCNC(c1cccs1)=O)C1CCOCC1,2 F531-0530,O=C(C1(CC1)c1ccccc1)N(CC1)CCN1c(cc1)ccc1-c1noc(C2CC2)n1,2 SD60-0167,O=C(C1CCCC1)N(C1)CC11OCC(CCOCc2cccc(F)c2)C1,2 C072-0012,O=C(c1cc(Sc(cccc2)c2Cl)nc2ccccc12)NC1CCCCCC1,2 G856-7202,Cc(cc1)ccc1S(CC(NCc1ccccc1)=O)(=O)=O,0 T500-1958,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1)CCC1C(N(CC1)CCC11OCCCC1)=O,2 E616-0438,CCN(CC1)CCC1(C(C(Nc(ccc(F)c1)c1F)=O)=C1C)OC1=O,0 P291-0612,CCc(cc1)ccc1NC(N(CC1)CC1N(CCN1Cc2ccccc2)C1=O)=O,2 Z2066020547,Cc(c(C(O)=O)ccc1)c1NS(c1csc2c1cccc2)(=O)=O,0 P113-1381,CCCNC(c1csc(N(CC2)CCN2c(cccc2)c2F)n1)=O,0 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F6525-6891,CC(C(NCCn1ncc(-c2ccco2)c1)=O)Oc(ccc(Cl)c1)c1Cl,0 E234-0777,CC(CCCC1)C1NC(C(C)(Cn(c1c2)c3c2c(OC)ccc3OC)N(Cc2ccccc2)C1=O)=O,2 G802-0952,CCOc(cc1)ccc1N(C=Cn1c(SC(C)C(c2cc(C)c(C)cc2)=O)nnc11)C1=O,0 Z1453570898,CN(Cc(cc1)cc(OC)c1O)C(c1n[nH]c(-c(cc2)ccc2F)c1)=O,0 S976-1668,CCN(CC)C(N(CCC1)CC1(C(NCc1cnccc1)=O)F)=O,0 F6438-6734,FC(COC1)C1Nc1c(cc(cc2)Cl)c2ncn1,0 F5787-1755,CC(C)c1cc(SCc2c(C)cccc2)ncn1,0 G118-1182,CN(C)c1ccc(C(c2cccn2-c2c(C3)cccc2)N3C(Nc2cc(OC)ccc2)=O)cc1,0 Z1143010269,CC(C)(CN(CC1)CCN1C(c(cc1)ccc1N(CCN1)C1=O)=O)O,2 Z1345982195,O=C(C(CC1=O)CN1c(ccc(F)c1)c1F)N(CC1)CC(C(N2)=O)N1C2=O,0 S984-1314,CC(C)C(N(C[C@H]1CN(C2)C(C3CC3)=O)C[C@@]12C(N1CCCC1)=O)=O,0 S343-0222,O=C(CC(C1)c2noc(CCc3ccccc3)n2)N1c(cc1)cc(Cl)c1F,0 Z3056380286,OC[C@]1(CN(C2)C(CCCc(cc3)cc(C4)c3NC4=O)=O)[C@]2(CO)CCCC1,2 Z1986667910,CC(C)n1nc(C)c(CN2CC(c3cn(C)nc3)OCC2)c1,0 F6474-8161,COc1c(CCC(N(CC2)CC2N(C(CN2)=O)C2=O)=O)c2ccccc2cc1,2 Z2786574242,OCCC1NCCN(CCc2ccccc2)C1,0 F6709-0210,CCc(cn1)cnc1OC(CC1)CCN1S(c(cc1)cc(Cl)c1OC)(=O)=O,0 S615-0655,O=C(Nc(cccc1)c1F)N(CC1)CC1c1nc(CCOCC2CCOCC2)no1,2 F3398-3660,O=C(CSc1ncnc(N2CCCCC2)c1)NC1CCCC1,2 F6672-1564,CC=C(CC1CC2)CC2N1C(c1c(C)n(C)nc1C)=O,2 S694-1145,Cc1cnc(-c2cnccc2)n1C(CC1)CN1S(c1cc(F)ccc1)(=O)=O,0 8005-9176,OC(c(cc1)ccc1N(C(CC1N2CCCC2)=O)C1=O)=O,2 F6577-1906,Cc1nc(OC)nc(C)c1NS(Cc(cccc1)c1F)(=O)=O,0 Z2950857860,CC(CC1)N(CCNC(C(C(OC)=C2)=CNC2=O)=O)c2c1cccc2,2 Z1144977207,O=C(c(cc1)ccc1N(CCN1)C1=O)N(CC(F)F)C1CC1,2 8018-8315,CC(C)(CCC1)OC1(C)C#CCN(CC1)CCN1C(c1ccccc1)c1ccccc1,2 Z2892504754,O=C(CN(CCN1)CC1=O)Nc1n[nH]c(C2CCCCCC2)c1,2 Z4034363050,N#CC(CC1)CC1Sc1nnc(CN(CCCCC2)C2=O)n1-c1cnccc1,0 F6745-1703,COc1cc2c(N3CC(Cn4cncc4)C3)ncnc2cc1OC,2 F5063-0103,CCn1nnc2c1ncnc2N1CCN(CC(Nc2c(C)cc(C)cc2)=O)CC1,0 F6435-0826,O=C(C1(CCOCC1)c1ccccc1)N(CC1)CC1S(c1ccccc1)(=O)=O,2 F2434-1196,O=C(c1ncc(-c2ccccc2)o1)NCCc1csc(-c2ccccc2)n1,2 F6473-4467,O=C(C1C2CC=CC1)N(C(C1)CN1S(CCOc1ccccc1)(=O)=O)C2=O,2 Y040-6096,COc(cccc1)c1C(CC(c1cccc(Cl)c1N1)(C1=O)O)=O,0 Z2911130256,Cc1c(CC(N(CCc2ccc3)Cc2c3C(O)=O)=O)c(C)n[nH]1,0 Z960630558,COc1c(CN(CC2OCCC2)C(Cn2c(cccc3)c3nc2)=O)cccc1,0 SB49-1057,NC(C1N(CC2CCCCC2)CCCC11CCOCC1)=O,2 Z4872913930,CCOC(c1c(C)nc(NC(N2CC(CO)CC2)=O)s1)=O,0 S352-0025,O=C(c1cocc1)N(CC1)CCN1C(c1c(COC(C2)c3ccccc3)n2nn1)=O,2 Z289537634,O=C(CCCC(N1)=Nc(cccc2)c2C1=O)N(CC1c2ccccc2)Cc2c1cccc2,2 J500-0717,CN(C)C(C(C1)C2(CCCC2)CN1C(COc(cc1)ccc1OC)=O)=O,0 SA01-1205,CC(C)NC(c1c(C(CC2)CN2C(c2cocn2)=O)nc(N(C)C)nc1)=O,2 E667-0348,O=S(c(cc1)cc2c1[nH]c1c2CCCC1)(N(CCc1ccccc1)Cc1ccccc1)=O,2 SB21-0532,Cn1ncc(C(N(C2)[C@H](Cn3nnc(C(N(CC4)c5c4cccc5)=O)c3)C[C@@H]2F)=O)c1,2 Z3136404479,Cn1nc(C2CC2)cc1CNC([C@]1(CNC2)[C@@H]2CCOC1)=O,2 Z1345887402,CN(CC1COCC1)C(NC1CN(Cc2ccc(C(F)(F)F)cc2)CC1)=O,2 Z1191899558,Cc1nc(-c2c[nH]c(C(N3CC(COC)CCC3)=O)c2)cs1,0 F6571-2882,Cn(c(C(NCC1(CCSCC1)OCCO)=O)c1)nc1-c(cc1)ccc1F,2 F6439-7416,O=C(C(Oc1c2cccc1)=CC2=O)NCCn1c2ccnn2cc1,2 F3337-0023,CC(C)(C=C)OCC(CN(CC1)CCN1c(cccc1)c1OC)O,0 Z1764209240,CC(CO)(CCC1)N1C(NCc(cccc1)c1N1CCOCC1)=O,2 F6560-5149,CC(C)C(Cn1nncc1)NS(c(cc1)ccc1-n1nccc1)(=O)=O,2 Z398973114,OC(C1(CCCC1)NC(c1cccc2cccnc12)=O)=O,2 F2393-0688,O=S(Cc(cc1)ccc1F)(NCC(c1cscc1)N(CC1)Cc2c1cccc2)=O,2 F5257-0467,CN(c(n(Cc1ccccc1)c(C(NCC(c1ccccc1)=O)=O)c1)c1C(N1C)=O)C1=O,2 Z2351771115,CC(C)(CN(CC1)S(c(cc2)ccc2C(NCC(O)=O)=O)(=O)=O)C1OC,0 Z2963167593,Cc1csc(CC(CC2)CN2C(c2cnc3[nH]cnc3c2)=O)n1,2 F2051-0375,CCOc1cc(C(Nc2cc(N(CCC3)S(C)(=O)=O)c3cc2)=O)cc(OCC)c1OCC,0 Z382938768,CN(C(CC1)CS1(=O)=O)C(c1csc(Cc2ccccc2)n1)=O,2 SD24-0073,CCN(C[C@@H]1CN(C2)S(c3cc(F)cc(F)c3)(=O)=O)C[C@@H]2NC1=O,0 F6549-6752,COC(c(cc1)ccc1S(N1CC(Cn2nncc2)C1)(=O)=O)=O,0 Z383108278,O=C(CCNC(C1CC1)=O)N(CC1)Cc2c1scc2,2 Z1555106942,Cc1nc(C(N(CC2)CCN2c2nccc(C)c2)=O)no1,0 F6412-2445,O=S(C1CCCCC1)(NCC#CCOc(cc1)cc2c1OCO2)=O,2 Z1755971277,CCOc(cc1)ncc1NC(N(C[C@H](C1)OC)[C@H]1c1nnc(C)o1)=O,0 Z2911201410,Cc1cc(CCNC(C(CC2)(CC3)CC23C(O)=O)=O)cc(OC)c1,0 Z1637316782,Cc1cn(CC(N(C)Cc2noc(C)n2)=O)nc1,0 F6064-1089,O=S(C1CCCCC1)(N(C1)CC1c1nc(-c2cnccc2)no1)=O,2 Z1676873262,CC1(Cn2nnc(C(Nc3cccc(C(N4)=NC(C)=CC4=O)c3)=O)c2)COC1,2 Z2912783611,CC(Cc1cc(O)ccc1)NC(C(CC1)(CC2)CCC12C(O)=O)=O,0 F6487-0842,CN(CC(C1)OCc2c1cccc2)C(c1cn(C)nn1)=O,2 F6403-0590,O=C(Cc(cccc1)c1Cl)N(Cc1cnc2n1cccc2)C1CC1,0 Z1286423454,O=C(c(cc1)ccc1S(Nc1ccccc1)(=O)=O)NCCCC(F)(F)F,0 Y205-4057,Cc1cc(NS(c(cc2)ccc2NC(c2csc3c2CCCC3)=O)(=O)=O)no1,2 F2318-0068,O=C(C1OCCC1)N(CC1)CCN1c(cc1)nnc1-n1nccc1,2 F6452-0163,CC(CNC(c(cccc1)c1Br)=O)(c(cccc1)c1F)OC,0 Z2627834270,OC(CCc1cccc(NC(CC(C2)CC2(F)F)=O)c1)=O,0 SA66-1192,O=S(c1cccs1)(N1CC(CCc2noc(C3CCOCC3)n2)CCC1)=O,2 Z2418630182,COCc1cc(Nc2nc(C#N)cnc2)ccc1,0 Z1738270363,CC(C)C[C@@H](C(O)=O)NS(c(cccc1C)c1F)(=O)=O,0 J500-0481,CC(C)NC(C(C1)C2(CCCC2)CN1C(c1ccc(Cn2cncc2)o1)=O)=O,2 V002-5466,CCC(C)N(Cc(cc(cc1)NC(C2CC2)=O)c1N(C)C)C(C1CC1)=O,0 F2780-0349,O=C(C(Nc1c(CSC2)c2nn1-c1cccc(Cl)c1)=O)NCc1ncccc1,2 F6550-1796,O=C(Nc1cccs1)N(C(CC1)C2)C1CC2F,0 F6374-5503,O=C(CSc(cc1)ccc1F)N1CCC(CSCc2ccco2)CC1,2 F6514-2867,O=C(c(cccc1)c1Cl)N(C1)CC1OCC(F)(F)F,0 F6400-0303,CC(C)(C)c(cc1)ccc1NC(N1C(CN(C)C)CSCCC1)=O,2 Z2595580361,Cn1nc(C2CCOCC2)c(C(Nc2cc(CC(O)=O)ccc2)=O)c1,2 F6525-7248,Cc(n(CCNC(Cc1c(C)onc1C)=O)nc1C)c1-c1ccco1,2 Z2186454612,CCc1c(C(NCC(CN(CCC2)C2=O)O)=O)n(cc(cc2)Cl)c2n1,2 Z1631970642,O=C(c1cc(Nc2nccnc2)ccc1)NCCC1OCCCC1,2 G622-0842,O=C(C1=Cc2cccnc2N(Cc(cccc2)c2F)C1=O)N(CCc1ccccc1)Cc1ccccc1,2 F6689-3141,Cc(cc1)ccc1S(N1CCC(CN(C)c2nccnc2OC)CC1)(=O)=O,2 V026-7340,CC(C)C(C)N(Cc(cc(cc1)NC(C2CCC2)=O)c1N(C)C)C(c1cccs1)=O,0 Z2805024592,Cn1c(NC(c2nc(N3CCOCC3)ncc2)=O)nc2c1cccc2,2 E613-0884,CC(CCCC1)C1NC(COCc1noc(-c2cccs2)c1)=O,2 F6523-0592,Cc1nc(C(F)(F)F)cc(N(CC2)CCN2S(Cc(cccc2)c2F)(=O)=O)n1,0 Z600506366,OC(c1cccc(CNS(c2cccs2)(=O)=O)c1)=O,0 F6523-4253,CN1N=C(CCC(C2)NC(CN(C=Nc3c4cccc3)C4=O)=O)C2=CC1=O,2 F5854-0328,CSc(cccc1)c1C(N(CCc1ccccc1)Cc1ncccc1)=O,0 F6791-8925,CC(C)N(CCC1N(CCC2)CC2c2nnc(-c(cccc3)c3F)s2)C1=O,2 F6435-2028,CCc(s1)ccc1S(N(C1)Cc2c1cncn2)(=O)=O,2 F2792-0393,CCn1nnc2c1ncnc2Nc(cc1)cc2c1OCCO2,2 SD06-0803,COCC(N[C@@H](C[C@@H](COc1ccccc1)C1)[C@H]1C(NCCc1ncccc1)=O)=O,2 V017-9845,CC(C(N(CC1)c(cc2)ccc2-c2ccccc2)=O)N1C(Nc1ccccc1)=O,0 SB18-1091,CCC(CC)CN(C[C@H](C1)NS(C)(=O)=O)[C@@H]1c1nc(-c2ccccc2)n[nH]1,0 F3407-2221,CCOc(cccc1)c1NC(CSC(N1CC2OCCC2)=Nc2ncccc2C1=O)=O,0 J093-0694,O=C(c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2n1)NCC1OCCC1,2 G118-1949,O=C(Nc(ccc(F)c1)c1F)N(Cc(cccc1)c1-n1c2ccc1)C2c1cccc(Cl)c1,0 F6414-2205,CSc1ccc(C(CNC(C2CC=CCC2)=O)O)cc1,0 Z2580794309,CCC(N(CC1)CCC1(C(F)(F)F)OC)=O,0 Z1943968169,Cc1ccc(CC(CC2)(CCN2C(c2cc(OC3CCC3)ncc2)=O)O)cc1,2 F5889-0501,CN(CC(Nc(cc1)cc(C2)c1-c1c2cccc1)=O)C(c1c[nH]c2c1cccc2)=O,2 Z3341638903,COc1c(Cn2nnc(C3(C(F)(F)F)NCCC3)n2)cccn1,2 F1792-0085,CS(N(C(C1)c(o2)ccc2Cl)N=C1c1cccs1)(=O)=O,2 L105-0143,Cn(cc1-c2ccccc2)c(C(N2C3CC3)=O)c1N=C2SCc1cc(C(F)(F)F)ccc1,2 F6755-7304,O=S(C1CC1)(N(CC1)CCN1c1nccn2nc(C3CC3)cc12)=O,2 SB47-0726,Cc1n[nH]c([C@@](CN(C2)C(Cc3cccc(F)c3)=O)(C3)[C@@H]2CN3C(c2cnccc2)=O)n1,2 L307-1721,CCN1C(CNC(c2nc(-c(cc3)ccc3S(N3CCCCCC3)(=O)=O)no2)=O)CCC1,2 Z4873990971,CC(C1(CCC1)O)NCc(cc1)ccc1N(C)Cc1cccs1,0 V019-4541,CC(C1=O)N(Cc(ccc(F)c2)c2F)CCN1c(cccc1)c1OC,0 F6438-3662,CN(C)c1nc(CNC(Cn2cccc2)=O)nc(N2CCCC2)n1,2 Z2278426987,CC(C)(CNC(C1)=O)N1C(c(ccc(-n1nnnc1C)c1)c1F)=O,2 Z1599489325,Cc1nn(C)c(OCC2)c1N2C(COc(cc1)cc(Cl)c1F)=O,0 Z1559070769,Cc1cc(C(N(CC2)CCN2C(C2(CC2)NC(N)=O)=O)=O)c(C)o1,2 K221-3072,CCOc(c(OCC)c1)cc(C(N2CCCC(NC3C(C)CCCC3)=O)=O)c1NC2=O,2 F6564-2441,O=C(CSc(cc1)ccc1F)NCCN1N=C(C2CC2)C=CC1=O,2 F3237-0395,Cc1nccn1S(c(c(OC)c1)cc(OC)c1Br)(=O)=O,0 S590-0101,CN(C1)C(CNC(COc(cc2)ccc2F)=O)Cn2c1ccc2,2 F6561-2414,O=C(CCCC(N(CC1)CC1OCC1CC1)=O)c1ccccc1,2 Z1421517919,CN(CCc(cc1)c2cc1NC(C1(CCOCC1)C#N)=O)C2=O,0 C884-0177,CC(CCc1ccccc1)NC(Cn1c(C(NN=C2)=O)c2c2c1cccc2)=O,2 Z3018701797,NC1(CNC(c2cc(C(F)F)ncn2)=O)CCCCC1,0 8017-1990,COc1ccc(C(c2c3cccc2)(NCC2)N2C3=O)cc1,2 T502-0808,CC(C)n1c(cccc2)c2c(CN(CC2)CCC2(C(NC2CC2)=O)F)c1,2 F6445-2823,Cn1cnc(S(N(CC2)c(cc3)c2cc3-c2ccncc2)(=O)=O)c1,2 F6480-6662,Cc1nccc(OC(CCC2)CN2C(Cc2ccc(C(F)(F)F)cc2)=O)n1,0 F6218-0239,Cc1c(C)n(-c(nc2)ncc2NC(COc(cc2)ccc2Cl)=O)nc1C,0 E019-0155,CC(c1c2c(cccc3)c3s1)=NN(CC(NC(CCC1)c3c1cccc3)=O)C2=O,2 F6436-2148,OC(CNC(CCc(cccc1)c1Br)=O)c1cccc2ccccc12,0 Z3216005670,Cc1cc(C(N(CC2)CCC2(C2)C2(F)F)=O)cc([N+]([O-])=O)c1Cl,0 Z298628608,NS(Cc(cc1)ccc1NC(c1cn(Cc2ccccc2)nc1-c1cnccc1)=O)(=O)=O,2 E532-0036,CC1=C(C(Nc(cccc2)c2C(N(CC2)CCC2N2CCCCC2)=O)=O)SCCO1,2 S988-1035,CCS(N(C[C@@H]1CN(C2)C(c(cc3)cc(Cl)c3F)=O)C[C@@]12c1nc(C)no1)(=O)=O,0 S591-1389,CCN(C(C1)CN1C(Cc1c[nH]c2c1cccc2)=O)C1CCOCC1,0 SB99-0182,Cn1nc(CCC(N2CCOCC2)=O)c(C2)c1CCN2C(COc(cc1)ccc1F)=O,2 M343-1132,CC(C)N(c(ccc(S(N1CCCC1)(=O)=O)c1)c1N1CC(N(C(C)C2)c3c2cccc3)=O)C1=O,2 F6178-1194,CSc(cccc1)c1NC(C(NCC(CC1)CCN1c1nc(cccc2)c2o1)=O)=O,0 L064-0207,O=C(c1nnc(C(CCC2)CN2C(c2cccs2)=O)s1)Nc(cc1)ccc1Cl,2 F825-0864,Cc1c(-c(o2)ccc2S(N(CC2)CCN2C2CCCCC2)(=O)=O)[nH]nc1C,2 F6260-0164,COc(cc1)nn2c1nnc2C(CC1)CCN1C(c1nn(-c2ccccc2)nc1)=O,2 Z1667587221,Cc(oc(S(NC)(=O)=O)c1)c1C(N(CCc1c(cc2)Br)Cc1c2F)=O,0 F6680-3360,COc1nccc(N(CCN(C2)c3cccc(C(F)(F)F)n3)C2=O)c1,0 F6477-5328,Cc1cccnc1Nc1nc(CN(C(CC2)=O)C2=O)cs1,2 Z2984348886,CN(C)C(NCc1cn(Cc(c(Cl)ccc2)c2Cl)nn1)=O,0 C076-0207,COc(cc1)ccc1C(N(C1)C(c(cc2)ccc2F)c(cc(cc2)Br)c2NC1=O)=O,0 SD08-0429,Cc1cn(CC(N(CCC2)CC22OCc3c(CNC(C4CC4)=O)nnn3C2)=O)nc1,2 F6724-0189,Cc1ccc(C(CNc2cc(C)nc3ncnn23)N(C)C)cc1,0 F6619-5896,FC(c1nc(N(CC2)CCN2c2ncnc3c2nc[nH]3)ncc1)(F)F,0 Z1334435827,COc1cc(N(CC2)CC2NC(c(cc2)nnc2N2CCCC2)=O)cc(OC)c1,0 P930-1339,CCn1ncc(CN(CCC2)[C@@H]2c2nnc(-c3ccccc3)[nH]2)c1,0 Z2472952076,Cc1nn(Cc2ccccc2)c(NC(N(C)CCN2CCCCC2)=O)c1,2 F6495-2555,Cc1cccnc1NC(c1ncnc(N2CCOCC2)c1)=O,2 F6549-5442,Cn1c(C(CC2)CCN2C(c(o2)ccc2Br)=O)cnc1,2 D430-1170,Cc(cc1)ccc1Nc1cc(N(CC2)CCN2S(c(cc2)cc(C)c2OC)(=O)=O)nc(C)n1,0 J500-0428,CC(C)NC(C(C1)C2(CCCC2)CN1C(CCc1ccccc1)=O)=O,2 Z2203553695,CCC(C)OCc1nc(-c2cn(C)nc2C(F)(F)F)no1,0 F6563-0195,O=C(CCN(C=Nc1c2cccc1)C2=O)N(CC1)CCC1Oc1cscc1,2 Y500-1954,O=C(c(cnn1c(C(F)(F)F)c2)c1nc2-c1ccco1)NC1CCCC1,2 Z1103195712,COc(ccc(CN(CCC1)C1C1CC1)c1)c1F,0 F6359-3988,O=C(CSC1CCCC1)N(CC1)CCC1Oc1nc2ccccc2nc1,2 T655-0463,CC(C)c1nnc(C(CN(C2)C(c(cc(cc3)Cl)c3OC)=O)C22CCOCC2)o1,0 Z2718418091,O=C(C1(CC2)CC2CC1)Nc1nccc2c1[nH]cc2,2 F1716-0363,Cc(cc1)c(C)c2c1c(CC(Nc(ccc(OC)c1)c1OC)=O)co2,0 Z1136944634,Cc(c(C)nnc1N(CC2)CC2N2CCOCC2)c1C#N,2 C561-0247,CC(C)CC(C(Nc(cc1)ccc1F)=O)N(Cc1c2cccc1)C2=O,0 L881-0369,O=C(c([nH]c1c2cccc1)c2NC(c(cc1)ccc1Cl)=O)NC1CCCC1,2 F6619-6778,Cc1nc(-n2nccc2)cc(N(CC2)CCN2c2c(ccs3)c3ncn2)n1,2 SC58-0271,Cc1cnc(C2C(C3)(CN3C(NCc(cc3)ccc3F)=O)CN(C)C2)o1,2 G856-1150,O=C(CSC(N(c(cc1)ccc1F)C1=O)=Nc2c1[nH]c1c2cccc1)Nc(cc1)cc2c1OCCO2,2 G274-0342,O=C(C(CC1)CCN1c(cc1)nnc1-c1cccs1)N1CN(Cc(cc2)ccc2F)CCC1,2 3379-1870,COc(cc1)ccc1N1C(SCc(cc2)ccc2Br)=Nc(sc2c3CCC2)c3C1=O,0 F6561-7766,O=C(c1cc(-n2nccc2)ccc1)NC1CN(Cc2cscc2)CC1,2 Z1996488305,CN(CCC1)c2c1cc(CNC([C@@H](CCC1)NC1=O)=O)cc2,2 F3366-5748,CC(C1)Nc(cccc2)c2N(Cc2c(C)c(C)cc(C)c2C)C1=O,0 Z183343908,CC(C)NC(N(CC1)CCN1C(c1ccco1)=O)=O,0 Z1761210864,O=C(C1CC(CCCC2)C2CC1)N(CC1)CC1Nc(cc1)nn2c1ncc2,2 F2881-0382,COc(ccc(Cl)c1)c1C(NCCOc(cc1)nnc1-c(cc1)ccc1F)=O,0 Z1675910716,CC1(CCNCc2ccncc2)OCCO1,2 Z401386096,O=C(CCc1c2)Nc1cc(S(N(CCC1)C1c(cc1)ccc1F)(=O)=O)c2Cl,0 G678-0797,O=S(CCNS(c(cc1)cc2c1OCCO2)(=O)=O)(N(CC1)CCN1c1ccccc1)=O,0 SC72-2154,CCCc1nc(COC2(C3)CN3C(Cc3c[nH]c4c3cccc4)=O)c2cn1,0 Z1550502867,CC(C(N(CCC1)C1c1nc(-c2ccccc2)n[nH]1)=O)NC(N)=O,0 Z1616938611,CC(CN(C)C(C[C@@H](C(N1)=O)NC1=O)=O)=C,0 M976-0595,O=C(C1CC1)N(CC1)c(cc2)c1cc2N(CC(C1)C(N2CCOCC2)=O)C1=O,2 F3382-5409,Cc(cc1)c(C)cc1-c(cc1)nnc1SCc1nc(-c2c(C)cccc2)no1,0 SB30-0120,CN(CC1(CCOCC1)N1C(CC2)CCN2C(c2ccncc2)=O)C1=O,2 SD48-0566,Cc(cc1)cc2c1n(C)c1c2CCCC1NC(CCc1nn(CC2CC2)c2c1COCC2)=O,2 S740-0684,CC(C)CN(C([C@H](C[C@@H](C1)NC(COCc2ccccc2)=O)N1CC1)=O)S1(=O)=O,0 F5624-0445,O=C(c1c(C(F)(F)F)cccc1)NCCOc1ncnc(N2CCCC2)c1,0 F5882-6179,Cc1nc(cc(cc2)NC(c3cc(-c4cc(OC)ccc4)nn3C)=O)c2s1,2 Z1263876505,CC(C)[C@H](C(O)=O)NC(C(C)n1ncnc1)=O,0 Z2296018991,OC(C(c(cc1)cc2c1OCC2)NC(Cc(cc1)cc2c1OCCO2)=O)=O,2 Z1268675441,CCCC(C1)(CN1C(c1n[nH]cc1)=O)O,0 F2740-0206,COc(ccc(Cl)c1)c1NC(Nc1c[nH]c2c1cccc2)=O,0 V014-5956,CCN1C(CNC(C(C2)CN(Cc3cccc(Br)c3)C2=O)=O)CCC1,2 Y300-1036,CC(C)(CC1NC(C(CC2)CCN2S(N(C)C)(=O)=O)=O)Oc2c1ccc(C)c2,0 S948-0509,CCCS(N(C1)C[C@@](COCC)(CC2)[C@H]1CN2c(cc1)cc(C(F)(F)F)c1C#N)(=O)=O,0 SB55-0596,CC(C)Cc1nc([C@@](CCC2)(C3)[C@@H]2CN3C(c2ncc(C)nc2)=O)no1,2 8018-5804,O=C(C1)NCC1c(cc1)ccc1S(N(CC1)CCN1c1nc(-c(cc2)ccc2F)cs1)(=O)=O,2 Z3492794478,C(C1)CC2Cn3c(-c4csc(N5CCOCC5)n4)nnc3CC1C2,2 D468-0929,O=C(N(C(CC1)CS1(=O)=O)C1=C2CCC1)N=C2SCc(cc1)ccc1Cl,2 Z1529771783,Cc1c(C(N2[C@@H](CO)CCC2)=O)oc2c1ccc1ccccc12,2 E570-4704,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(N(CCC1)CC1C(NC1CCC(C)CC1)=O)(=O)=O,0 Z2299198630,O=C(C1CC1)NCc([nH]c1ccc2)nc1c2Br,0 8018-4243,COc(cc(C1OC(CCCC2)C2c2c1ccs2)cc1)c1OCc1ccccc1,2 F6448-2090,O=C(Cc1c[nH]c2c1cccc2)Nc1cn(CC2Oc(cccc3)c3OC2)nc1,2 Y042-3888,O=C(CCN(C=Nc1c2cccc1)C2=O)Nc1nnc(C2OCCC2)s1,2 G539-0046,O=C(Nc(cc(cc1)F)c1F)N(CCc1c2sc3c1CCCC3)C2c1ccccc1,0 F6562-1791,COC(c(cc1)ccc1C(NCc1cc(N(CCC2)C2=O)cnc1)=O)=O,0 Z2733281973,Cc1nsc2c1ccc(Br)c2,0 Z2311210494,CC(CCC1)(CN1C(NCC1(CCOCC1)N1CCOCC1)=O)F,2 Z1994064276,Cc(ccc(C(NC1c2cccc(F)c2CC1)=O)c1)c1C#N,0 F6806-8106,CC(C)(C)NC(C(CC1)CN1c1nc(C#N)ccn1)=O,0 Z2971715664,Cc(cc1)cc(CN(C)C(N2CCO)=Nc(cccc3)c3C2=O)c1F,0 V006-2943,CCCc1nc(n(-c2ccccc2)nc2)c2c(N2CCN(Cc3ccc(C(F)(F)F)cc3)CC2)n1,0 Z2755508063,COC(CC1)(CN1C(c([nH]c1ccc2)cc1c2F)=O)C(O)=O,0 F3374-0791,COc1cccc(NC(c(cc2)ccc2N(C(C2C3CC=CC2)=O)C3=O)=O)c1,2 F6562-8353,O=C(c1cscn1)NCC1c(cccc2)c2OC1,2 SD25-0303,Cc1cc(C)nn1CCC(N1CC2(CCCCC2)C(CCC(NC2CC2)=O)C1)=O,2 F6561-3841,Cc1cnc(NC(NC(CC2)CCC2=C)=O)s1,2 Z1373622103,CN(CC1)c(ccnc2)c2N1S(c(cc1)ccc1Cl)(=O)=O,0 Z2644814828,O=C(CCCOc1cnccc1)N(C(CC1)C2)C1CC2Oc1ccccc1,2 F6515-1342,O=C(CN1N=CC=CC1=O)NCc1cc(-c2ccco2)ncc1,2 F425-0260,COc1cccc(CN(C2=O)C(SCc3nc(-c4ncccc4)no3)=Nc3c2scc3)c1,0 Y044-3781,COc(cc1)cc(NC(CC(C(Nc2c3cccc2)=O)NC3=O)=O)c1OC,0 S904-0046,CC(C)N(C[C@H](C1)O)[C@@H]1c1nnc2n1CCN(Cc1cscc1)C2,2 F3290-0209,CC(C)(C)c(nc1SC)cc(C(F)(F)F)c1C#N,0 Z1754423900,CC(C)n1nnc(CC(C(N2Cc3cccc(Cl)c3)=O)NC2=O)c1,0 F6442-7306,Cn1cnc(S(N(CC2)CCC2N(CC2)CCC2Oc(cccc2)c2F)(=O)=O)c1,2 F3314-0061,OCCN1CCN(CC(COC2CCCC2)O)CC1,2 V015-0181,COc(cc1)cc2c1-c1n[nH]c(-c(cc3)ccc3C(N[C@H](CCC3)c4c3cccc4)=O)c1CC2,2 F159-0151,Cc1c(cc(cc2)NC(Nc(cc3)cc4c3OCCO4)=O)c2nc(N2CCOCC2)c1,2 E642-1160,O=C(c1ccc(Cn2c(SCc(cccc3)c3F)nc3c2nccc3)cc1)NC1CCCCC1,2 Z1828015912,Cc1c(C(NC2c(cccc3)c3OCC2)=O)sc(CC2CC2)n1,2 F0174-0352,CC(c1cccc(NC(c(s2)ccc2Cl)=O)c1)=O,0 F6727-8364,O=C(c1cn(cccc2)c2c1)N(C1)CC1N(C(C=C1)=O)N=C1c1cccc(F)c1,2 Z1097654052,COC(C(Cc1ccccc1)NC(c(cc1)ccc1OC1CCCC1)=O)=O,2 E522-0075,CC(Cn(c1c2)c3c2ccc(OC)c3)(C(NCC2OCCC2)=O)N(Cc2cc(OC)ccc2)C1=O,0 S808-0411,CNC([C@@](CC1)(CN(Cc(cccc2)c2Cl)CC2)[C@@H]2N(C)S1(=O)=O)=O,0 F0537-0349,COc1cccc(NC(c2cc(CCCC3)c3cc2)=O)c1,2 L369-0079,Cc1cccc(-c2cnc(Nc3cccc(C(NCc(cc4)ccc4SC)=O)c3)nc2)c1,0 F6036-1521,Cc(cc1)cc(S(N(C2)CC2c2nc(C3CC3)no2)(=O)=O)c1OC,2 V003-4003,Cc1ccc(Cc2nsc(N(CC3)CCN3C(c3ccccc3)c3ccccc3)n2)cc1,0 SA93-0296,CCC(CCC1)(CN1C(c1cscn1)=O)C(N)=O,0 Z3510029400,OCC(C1)(C2(CCC2)CN1C(C1(CCCC1)C(O)=O)=O)F,2 S694-2079,Cc1cnc(C2CCC2)n1C(CC1)CN1C(CCc1c(C)onc1C)=O,2 K784-0882,O=C(CSCc(cccc1)c1Cl)NCCc(cc1)ccc1Cl,0 F6252-4130,COC(c1ccc(CN(C=CC=C2c3nc(-c(cccc4)c4Cl)no3)C2=O)o1)=O,2 S823-5503,COCC(N[C@@H]1[C@@H](CO)CN(Cc(cccc2)c2F)C1)=O,0 J106-0393,O=C(C(CC1=O)CN1c1n[nH]c2cccc(F)c12)NCCc1c[nH]c2c1cccc2,0 Z2278621146,C[C@H](C1CC1)NS(N1CCOCC1)(=O)=O,0 Z1893403399,CN(CCC1(CC2)CCN2C(c(cccc2)c2Nc2cc(OC)ccc2)=O)C1=O,2 F6792-0447,Cn1nc(CCC2)c2c1CN(CC1)CCN1c1cc(C2CC2)nc(SC)n1,2 S696-0252,CCOC(CCNC(N1CC(Cn2c(-c3ccccc3)ncc2C)C1)=O)=O,0 F6479-6118,Cc1nccc(OC(CC2)CCN2C(COCc2ccccc2)=O)n1,2 Z1535756647,CC(CNC(c1cc(Cl)cn1C)=O)(C(F)(F)F)O,0 F2751-0102,CC(c1ccccc1)NS(CCNC(c1ccccc1)=O)(=O)=O,0 Z2228325151,CC(CC1C(NC)=O)Cc2c1[nH]nc2,0 Z3301443104,Cc(c1ncc(C(O)=O)c(O)c1cc1)c1F,0 SB24-0304,CN(C)C(c1cn(C(CC2)C2(CC2)CCN2S(c2cccs2)(=O)=O)nn1)=O,2 V030-1600,CCN1CCN(Cc2c(-c3ccccc3)nc(cc3)n2cc3-c(cccc2)c2Cl)CC1,2 T855-0415,COc(ccc(CCNC(C1(CCC(N2C3CCCC3)=O)C2=CCC1)=O)c1)c1OC,2 F6514-3925,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)N(C1)CC1n1nnc(COc2ccccc2)c1,2 G802-0665,CCC(C(Nc1c(C)ccc(C)c1)=O)Sc1nnc2n1C=CN(c1cc(C)c(C)cc1)C2=O,0 SA92-0861,O=C(Nc(cc1)cc2c1OCCO2)N(CCC1)CC1(c1nc(C2CC2)no1)F,2 Z1747819015,OCC(CCC1)N1C(CC1c(cccc2)c2OCC1)=O,0 Z4984014650,CC(c1ncnn1C)OC(c(cc1-c(cccc2)c2Cl)nn1-c1ccccc1)=O,2 F6241-0312,O=C(C(COC1)N(Cc2ccccc2)C1=O)N(CC1)CCN1c1ncccn1,2 S830-0913,O=C(c1cocc1)N(CC1)CC(COCC2CC2)C1(F)F,2 C564-0171,CCN(c(cccc1)c1C(SCC(N(CC1)CCN1C(c1ccco1)=O)=O)=C1)C1=O,2 Y021-2783,O=C(C(C(C1=O)N2)C(C(N3)=O)=C2N=C3N2CCC(Cc3ccccc3)CC2)N1c1ccccc1,2 F6057-0721,Cc1cc(C)nn1CCN(CC1)CCN1S(c1cnccc1)(=O)=O,2 D074-0352,CCOc(cc(C(c1c2[nH]nc1-c(cccc1)c1O)N(CCCO)C2=O)cc1)c1OCCC(C)C,0 F6349-0195,CCOC(c1c(cc(cc2)NC(Cc(cccc3)c3Cl)=O)n2nc1)=O,0 Z1579128193,CCc1nc(cccc2)c2n1C(CC1)CCN1C(CS(C)(=O)=O)=O,0 F2392-1751,O=C(NCC(c1cscc1)N(CC1)Cc2c1cccc2)Nc1cccs1,2 F3250-0479,Cc(c(C)nc(n1nc2)c2-c2ccccc2)c1N1CCCCC1,0 S956-0171,COCC(CN(CC1)c(cc2)cc(C(F)(F)F)c2C#N)N1S(c1cnccc1)(=O)=O,0 L935-0320,O=C(Cn(cc1-c2ccccc2)c2c1N=CN(C1CC1)C2=O)Nc(ccc(F)c1)c1F,2 F6247-0280,CCOc1cccc(CN2c(ccc(Br)c3)c3F)c1OCC2=O,0 Z1837719528,Cn1c(C(N(CC2CC2)CC(O)=O)=O)cnc1,2 F5773-1888,Cn(cc1C(Nc2cc(-c3nc(cccc4)c4[nH]3)ccc2)=O)nc1OC,2 C066-1684,CN(C(C(C(O)=O)c(cc1OC)c2cc1OC)c(cccc1)c1OC)C2=O,0 Z2021023833,Cc(c1c2sc(C(Nc3cc(C(NC(N)=O)=O)ccc3)=O)c1)nn2-c1ccccc1,0 F1830-0035,CNC(c1c(NC(c2ccco2)=O)sc2c1CCC2)=O,2 Z1937742026,CCN(CC)S(c1c(C)ccc(NC(c2c[nH]c3cccnc23)=O)c1)(=O)=O,2 8018-2017,CCN(CC1)CCN1C(C=C1N2CCc(cc3OC)c1cc3OC)=NC2=O,2 F2061-0003,O=S(c1c(C(F)(F)F)cccc1)(Nc1cc(-c(cc2)nnc2N2CCCCC2)ccc1)=O,0 Z1389183560,COc(cc1)cc2c1OCC(C(NCCCN1CCCC1)=O)=C2,2 SB27-0049,O=C(c1cscc1)N(CC1)CCC1N(C1)C2(COCC2)CNC1=O,2 F6519-7842,O=C(C1Oc(cccc2)c2OC1)NCC(c1cscc1)n1nccc1,2 Z2313948116,Cc1nn(C)cc1CC(Nc1nc(ccc(S(C)(=O)=O)c2)c2s1)=O,2 F5763-0169,Cn(cc1C(Nc(cc2)ccc2C(NCCCn2cncc2)=O)=O)nc1OC,2 Z1550004290,COc(cc1)ccc1-c1cc(C(NCc2nccc(OC)c2)=O)cnc1,2 Z1593970264,O=C(c1c(CCCC2)c2n[nH]1)N(CC1)Cc2c1n(CCc1ccccc1)cn2,2 F5228-0198,CCOC(C(CC1)CCN1C(CN(C=NC(c1ccc(C)cc1)=C1)C1=O)=O)=O,0 Z4798124827,COc1ccc(CN)c(Cl)c1OC,0 T505-1211,N#Cc(cc1)ccc1C(N1C(CCn2nnc(C(NC3CC3)=O)c2)CCCC1)=O,2 Z3135870699,CN(C(C1)=O)c2c1cc(CNC(N(CCC1)C1C1CCCC1)=O)cc2,2 F6516-0248,O=S(Cc1ccccc1)(NCc1ccc(-c2cccs2)o1)=O,2 F5857-8670,OC(CNC(NCc(cc1)ccc1Cl)=O)c1cccs1,0 C548-2844,CC(C)C(C(Nc1nc(ccc(Cl)c2)c2s1)=O)NS(c1cccc2nsnc12)(=O)=O,2 SC66-0070,Cn1c(C(CN(C2)C(c3nn(C)c4c3cccc4)=O)C22CCOCC2)nnc1,2 Z2376851663,OC1(CCCCC1)C(NCc1ccc(C(O)=O)s1)=O,0 Z1883372926,Cn1ncc(NC(N(CC23CC3)c3c2cccc3)=O)c1C(F)F,2 F3207-0019,OC(C(N1CCc2ccccc2)=Cc(cccc2)c2C1=O)=O,2 F6619-6126,Cc1cncc(N(CC2)CCN2c2cc(N3CCOCC3)nc(C)n2)n1,2 Z2610935985,Cc1c(C(O)=O)oc(S(N(CCC2)CC2n2nncc2)(=O)=O)c1,0 F6411-2715,COC(CSc(cc1)nnc1-c(cc1)cc(OC)c1OC)=O,0 F129-0265,O=C(NCc(cc1)ccc1F)NC(C(Oc1c2cccc1)=O)=C2NC1CCCCC1,2 Z646056594,COc(cc1)ccc1-c1csc2ncnc(SCC(c3ccccc3)O)c12,2 Z3815876198,Cc(c1cc(C(N(C2)C(C3)CC23C(O)=O)=O)cnc11)nn1-c1ccccc1,2 S595-0522,O=C(c1cscc1)N(CCCC1)C1c1noc(COc(cc2)ccc2F)n1,2 Z5033061106,CCCc1n[nH]c(C(NC(CCC2C)(C(O)=O)c3c2cccc3)=O)c1,0 S694-1571,Cc1cnc(C)n1C(CC1)CN1C(C1(CC1)c1ccccc1)=O,0 S585-0286,O=C(c1ncccc1)N(CCC1)CC1c1nnc(C2)n1CCN2C1CCCC1,2 F0688-0099,CS(NCC(c1cnccc1)N(CC1)CCN1c(cccc1)c1F)(=O)=O,0 SD12-0050,Cc1noc(CC(C(NCC2)=O)N2C(NCCc2ccccc2)=O)n1,2 S515-0039,O=C(C(CCCC1)NC1=O)N(CC1)Cc2c1cccc2,2 F3222-1089,CC(C=C(C)N(CC(N(CC1)CCN1c(cccc1)c1F)=O)C1=O)=C1C#N,2 F6525-2958,Cn(c(CNC(c1noc2c1CCCC2)=O)c1)nc1-c1cnccc1,2 Z2615679098,OC(CCN(C1)C(NCCc2cc(OCc3ccccc3)ccc2)=O)C1(F)F,2 Z2439118928,NCCOc(cc1)ccc1NC(c(cc1)cc(N2)c1N(C1CCCC1)C2=O)=O,2 Z2968127718,CC(C)C(NC(CC1)CCN1c1nnc(Cc2ccccc2)o1)=O,0 L295-0606,Cc1c(C(N2CCCCC2)=O)oc2c1cc(C)c(C)c2S(N1CCOCC1)(=O)=O,2 F6672-1007,Cc1c(C(N(C(CC2)C3)C2CC3n2ncc(Cl)c2)=O)snn1,2 V009-0516,CN(C)c(cc1)ccc1-c(cc1)cc2c1oc(C(CCC1)N1C(c(cccc1)c1Cl)=O)n2,0 F1142-2957,Cc(cc1)ccc1-c(c1ccccc11)nnc1Oc(cccc1)c1OC,0 Z4617191951,COC(C1)CN1C(c([nH]1)c(C(F)(F)F)nc1Br)=O,2 Z2622664566,Cc1cn(C2CCCCC2)nc1NC(NC[C@H](C1)OC[C@H]1c1ccccc1)=O,2 Z1259177035,Cn1c(N)nc(cc2)c1cc2Br,0 T502-1166,COc(cc1)cc(S(N(CC2)CCC2(C(NCC2CC2)=O)F)(=O)=O)c1OC,2 SC09-0304,C[C@@H](COc(cc1)c(C2)cc1-c1cncnc1)N2C(COc1ccccc1)=O,2 S956-5003,N#Cc(cc1)c(C(F)(F)F)cc1N(CC1)C(CO)CN1C(c(cccc1)c1Br)=O,0 F6549-3239,O=C(c(cc1)ccc1S(N1CCOCC1)(=O)=O)N1CC(Cn2ncnc2)C1,2 D396-0154,CC(C)(Cc1c2C#N)OCc1c(N1CCOCC1)nc2SCCCc1ccccc1,2 C700-1028,CC(c1nc(cccc2)c2n1C1CC(NCCC2=CCCCC2)=O)N(Cc2ccccc2)C1=O,2 F6503-2642,Cc1nn(ccn2CCNC(CCc3cccc(Cl)c3)=O)c2c1,2 F5861-0056,CC(c(cc1)ccc1N1CCN(Cc2nc(C(CC3=O)CN3c3ccccc3)no2)CC1)=O,2 F6793-6814,O=C(c(o1)ccc1Br)N1CCN(CC(F)(F)F)CC1,0 F6506-1645,OC(CNC(c1ccco1)=O)(c1cocc1)c1cccs1,2 Z4521999136,CC(C1)(C2)COC12C(N(C[C@@H]1C2)[C@@H]2CN1c(nc(nc1)Cl)c1F)=O,2 F6562-6299,CC(C)(C)SCC(CCCC1)N1S(c1cccc2nsnc12)(=O)=O,0 Z2962729993,CCO[C@@H](CC1)CN1C(c1c2ncc(Br)cn2nc1)=O,2 E977-0630,COc(ccc(NC(C(CCC1)CN1S(c(cc1)cc(CCC2)c1NC2=O)(=O)=O)=O)c1)c1OC,0 F6514-1867,CC(N1CCNC(c(cccc2)c2Br)=O)=CC(OC)=CC1=O,0 S576-0569,O=C(C(CC1)CN1C(C=NN1Cc2ccccc2)=CC1=O)N(CC1)c2c1cccc2,2 Z3210493765,CC(C)C(C(NC1c(cc2)cc(O)c2OC)=O)NC1=O,2 Z992078648,Cc1cccc(C(N2CCN(Cc3nc(cccc4)c4[nH]3)CC2)=O)c1,0 Z1366509762,CN(C(C(C1)N2CCN1C(C(CC1)CCN1C(Nc1ccccc1)=O)=O)=O)C2=O,2 Z1612208986,CC1(CCOCC1)NC(Nc(cc(C)cc1)c1-n1ncc(C)c1)=O,2 Z2965080859,OCC(CC1)N1C(c1cc(Cl)c2OCCCOc2c1)=O,2 Z1410006688,CCn1ncc(CNC(c2cccnc2Br)=O)c1,0 Z815843302,Cc1c(CC(N(CC2)c3c2cccc3)=O)nnn1-c1ccccc1,2 D257-0797,O=C(CN(C(c1c2cccc1)=O)S2(=O)=O)Nc(cc1)cc(Cl)c1N1CCOCC1,2 G381-0067,Cc(cccc1)c1NCc1cn(-c2ccc(C(O)=O)s2)c2c1cccc2,2 F6210-1056,CC(C)Sc1ccc(CC(NC(C2)CN(C3CC3)C2=O)=O)cc1,0 Z3351484466,OC(c1csc(C2CN(Cc3cscc3Cl)CCC2)n1)=O,0 Y050-1178,COc(cc1)cc(S(N(CCC2)CC2C(NC2CC2)=O)(=O)=O)c1OC,0 F6171-0148,O=S(CCOc1ccccc1)(N1CCN(CCc2ccccc2)CC1)=O,2 Z3727448998,Cc1c(C(C2)CC2N(C2CC2)C(c(cc2)ccc2-c2c[nH]nc2)=O)cccc1,2 F1741-0128,COc(ccc(C(CC1c(c(F)ccc2)c2Cl)=NN1C(c1ccco1)=O)c1)c1OC,0 S513-0547,O=C(C(CCCC1)N(Cc2ccccc2)C1=O)NCCCN(CCC1)C1=O,2 Z1393692509,CCC(CN(C)c1c(C2)cccc1)N2C(Nc1cn(CC(F)F)nc1)=O,0 Z1285007092,CC(CNC(c1ccc(C)o1)=O)(C1CC1)O,2 C276-0759,CC(C)(C1)CC(NC(CC2c(cc3OC)cc(Cl)c3O)=O)=C2C1=O,0 T404-0465,O=C(CCCc1ccccc1)N(CC1)CCN1c1nnc2n1cc(C(F)(F)F)cc2,2 Z1604881721,CC(C)(CN(CC1)C(C2CC2)=O)N1C(c1cc(C(N)=O)cs1)=O,2 M759-3025,CN(Cc1cnccc1)C(C1)CN1C(C1(CC1)c(cc1)ccc1OC)=O,0 Z1483204654,CC(C)C(N1)=NC(C)=C(C(NOCc2cnccc2)=O)C1=O,2 C562-1068,CC(C)CC(C(NCc1ncccc1)=O)NS(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,2 D011-6272,Cc1cc(N(CC(C2)c3nc(cccc4)c4n3Cc3c(C)cccc3)C2=O)cc(C)c1,0 S579-0232,CN(C(CCCC1)C1=C1CC(Nc(cc2)ccc2N2CCOCC2)=O)C1=O,0 S721-0284,CC1(CCCCC1)C(N(C[C@H](C1)Oc2cnccc2)[C@@H]1C(NC)=O)=O,2 F1478-0267,CCOc(c(C)c1)cc(C)c1S(N1CC(C)OC(C)C1)(=O)=O,0 Z1169945418,O=C(CC(C1)c2nc(Cc3ccccc3)no2)N1c(cccc1)c1F,0 F5828-0219,O=C(c1csc(-c2nccnc2)n1)NCCC1=CCCCC1,2 T500-1222,COc1ccc(CC2CC(CC3)(CCN3C(C3(CC3)c3ccccc3)=O)OCC2)cc1,0 F3040-3038,O=C(CSc1nnnn1-c1cccc2ccccc12)Nc(cccc1)c1Cl,0 F6734-0778,O=C(Cn1c(cccc2)c2nc1)N(C1)CC(C2)C1CN2c(cc1)ncc1Cl,2 Z2475681500,CC(C)OC(CCC1)CN1C(c1cc2nc(C)c(C)nc2cc1)=O,0 Z2949836362,Cc(cc1)nc(N(C)C)c1NC(N(Cc1cocc1)C1CC1)=O,0 F6733-1770,Cc1ccc(CNc(ncnc2C3CC3)c2F)cc1,0 SA46-0341,CN(CC1)CCN1C1COC(C2)(CN2C(c2nc3ccccc3cc2)=O)C1,2 SB16-0965,CCS(N1[C@@H](CCN(Cc2nc(OC)ccc2)C2)[C@@H]2COCC1)(=O)=O,2 F0336-0067,CCOC(Cc1csc(NC(c2ccc(Cc3ccccc3)cc2)=O)n1)=O,2 F5281-0597,CCC(C(Nc1cc(-c2cccs2)nn1C(N1)=NC(C)=C(C)C1=O)=O)c1ccccc1,2 F6573-1778,Cn1ncc(-c2nccnc2CNC(COc(ccc(Cl)c2)c2Cl)=O)c1,2 Y203-3916,CC(CC1C(Nc(cc2)ccc2N2CCOCC2)=O)=C(C)CC1C(O)=O,2 Z4951847500,O=C(Cc1cccc(Cl)c1)Nc1c(C(F)(F)F)ccnc1,0 V009-5961,Cc(cccc1)c1OCC(CN(Cc(cc1)cc(OC)c1OC)C1CC1)O,0 F6556-1235,Cc1noc(C)c1C(NCC1(CCSCC1)N1CCOCC1)=O,2 Z982478684,CC1CC(CC(N(CC2)CCC2c2nc(C)no2)=O)CCC1,2 Z3062829021,Cn1c([C@H](CN(C2)C(C3CCCCCC3)=O)[C@@H]2NC(COC)=O)ncc1,2 Z3905360138,N#CC1(CNC(c2cccc(-c3noc(C(F)(F)F)n3)c2)=O)CCOCC1,0 Y044-3748,O=C(C(CC1=O)CN1c1n[nH]c2c1ccc(Br)c2)NC1CCCCC1,2 F5836-0100,O=C(c1cscc1)Nc(cccc1)c1NC(c1c(C(F)(F)F)cccc1)=O,2 SD07-0957,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(c2cccs2)=O)C2)n2nn1)=O,0 F6619-7615,N#Cc1ncccc1N(CC1)CCN1c(cc1)nnc1-n1nccc1,2 S979-0325,CC(C)CC(N(C1)[C@@H](C)COc(cc2)c1cc2C(N1CCCC1)=O)=O,0 H025-0631C,O=S(c1c2ncc(CNCC3)c3n2nc1N1CCNCC1)(c1ccccc1)=O,2 SB75-0923,CCS(N[C@H](C[C@H]1CN(C2)C(CCCc3ccccc3)=O)C[C@]12c1nc(C)no1)(=O)=O,2 F6556-2615,OC1(CNC(COc(cc2)ccc2F)=O)COCC1,0 F3249-0005,CC1OC(C)CN(CC(Nc(cc2)cc3c2OCCO3)=O)C1,2 SB27-0034,Cc(cc(cc1)S(N(CC2)CCC2N(C2)C3(COCC3)CNC2=O)(=O)=O)c1F,0 Y205-5404,O=S(Cc1ccccc1)(Nc(cc1)ccc1S(N(CC1)c2c1cccc2)(=O)=O)=O,2 F2704-0347,CC(c1cccc(Nc2nc(Nc(cccc3)c3F)nc(N3CCOCC3)n2)c1)=O,0 Z2950234140,NC(NC(CN(CC12CCOCC2)C1c1ccccc1)=O)=O,2 Z2406165510,Cc1cc(S(NCC(C2CCOCC2)C(O)=O)(=O)=O)c(C)o1,2 F6619-6078,Cc1nc(N2CCOCC2)cc(N(CC2)CCN2c2nc(cccc3)c3s2)n1,2 F6608-2844,Cc1nnc2n1ccnc2N(CC1)CCC1Oc(nc1)ncc1Cl,2 Z1278811237,Cc(ccc(NS(c1nn(C)cc1)(=O)=O)c1)c1C(O)=O,0 Y044-3650,O=C(C(C1)CN(Cc2ccccc2)C1=O)Nc(cc1)cc(CO2)c1C2=O,2 M030-0079,O=S(c(cc1)cc-2c1OCc1c2onc1)(N(CC1)CCN1C1CCCCC1)=O,2 Z2394925440,CNc(cc1)ncc1NC(CN(CCC1)C1=O)=O,0 Z4921564930,CN(CC(CC1)CN1C(c1nsc2c1cccc2)=O)C(C(CCN1)C1=O)=O,2 Z1030536334,CC(Nc(cc(c(F)c1)F)c1NC(c1cc(Cl)nc(N)c1)=O)=O,0 S915-0018,CO[C@@H](C[C@H]1CN(C2)C(Nc3cccc(Cl)c3)=O)CN1C2=O,2 Z2912027001,OC(C[C@@H](c(ccc(F)c1)c1F)NC(CC1OC2(CCC2)CC1)=O)=O,2 T500-1984,O=C(C(CC1)CCN1C(NCc1ccco1)=O)N(CC1)CCC11OCCCC1,2 F6808-5840,N#CC(CC1)(CCN1c1nccc(C(F)(F)F)n1)c1ccccc1,0 F5791-2683,Cc1noc(C)c1CC(NCCN(C(C=C1)=O)N=C1c1ccco1)=O,2 Z1681671653,CN(C)S(c1c[nH]c(C(N(CC2)CCC22N(C)CCC2)=O)c1)(=O)=O,2 Z1513662330,CCC(C(O)=O)N(C)C(c(ccc(C)c1)c1Br)=O,0 Z1496845315,OC(CNS(c1ccccc1)(=O)=O)COc1ccccc1,0 SA87-0113,CC(C)CN(CC(CNC(c1noc(Cn2ncc(C)c2)c1)=O)OC1)C1=O,0 F160-0598,CCC(C(Nc(cc1)ccc1OCC)=O)N(C=Nc1c2c(C)c(C)o1)C2=O,0 F6810-9444,COc(ccc(CN(CC1)CCN1c1ncnc2c1ncn2CC1OCCC1)c1)c1F,2 F6502-2692,O=C(NCCn1c(C2CC2)ncc1)NC(c1ccccc1)c1ccccc1,2 Z3071634838,CC(C)C(C1(CNC(C)c2csnc2C)CC1)O,2 F5012-0269,O=S(CCCOc(cc1)ccc1F)(NCCc(cc1)ccc1Cl)=O,2 Z371817990,NC(c1cc(Cn2cncc2)ccc1)=O,0 SA70-0391,CCC(N(CCC1)CC1(CCOC)c1noc(C2CC2)n1)=O,0 F6681-2146,N#Cc1cc(Cl)c(N(CC2)CCN2c2ncnc3c2[nH]cc3)nc1,2 Z3102294053,CC(C=C)NC(N(CC1)CCC1[C@@H]1OCCC[C@H]1c1nc(C)no1)=O,2 Z2718645925,CC(C(NC(CC1)CN1c(cc1)nn2c1nnc2)=O)NC(COC)=O,0 Y040-5288,Cc(c1c2)coc1cc(O1)c2C(C)=C(CCC(N(CC2)Cc(cc3OC)c2cc3OC)=O)C1=O,0 K788-0531,O=C(c(cc1)cc2c1n(C1CCCCCC1)cn2)NC1CCCC1,2 Y020-9299,O=C1N(Cc2cnccc2)C=Cc(n2nc3)c1cnc2c3-c(cc1)ccc1Cl,2 Z4921676706,N#Cc1ccc(cc(cc2)C(N(CCC3)CC3C3(CC3)NC(CN(C(CN3)=O)C3=O)=O)=O)c2c1,2 Z3407224803,Cc1noc(NC(NC(C2)CN2C(C2CC2)=O)=O)c1,2 S742-0245,CO[C@H](C1)[C@@H](c2ccncc2)N1C(CC1)CCN1S(c1cccc2nsnc12)(=O)=O,2 Z2952795102,CC(C)C(C1)OCCC1(C(O)=O)n1ncc(Br)c1,0 F6413-2644,O=C(C(CC1=O)CN1c1ccccc1)NCc1ccc(C(c2ccccc2)=O)s1,2 Z1428513675,CC(C)CC(CNC(c1cc(C)c(C)cc1)=O)O,0 S963-3839,CCc(cc1)ccc1C(N(C[C@@H]1C(NC)=O)C[C@@H]1NC(C)=O)=O,0 Z2044688383,CS(c1cc(C(F)(F)F)cc(CNC(c2c(C3OCCC3)ocn2)=O)c1)(=O)=O,0 Z2770631221,CN1Cc2cc(NCc3c[nH]cc3)nn2CC1,2 F6754-9018,CS(c1c2nc(NCCc3ccccc3)sc2ccc1)(=O)=O,2 Z1499006172,Cc(cc1)cc2c1OCC2NC(c1cccc(N2)c1OC2=O)=O,2 F5448-0258,O=C(c1csc(Nc2cccc(Cl)c2)n1)N(CC1)c2c1cccc2,2 SC18-0191,CN(Cc1nc(C(CC2)CCN2S(C)(=O)=O)no1)S(c1cnccc1)(=O)=O,2 F5260-0386,Cn1c(C(CNC(c(o2)ccc2Br)=O)N2CCCCCC2)ccc1,2 F953-0870,Cc1c(-c2nnc(C(N(CC3)CCN3c3c(C)ccc(C)c3)=O)o2)oc2c1cc(C)cc2,0 S511-0278,Cc1noc(C)c1CC(N(CC1)CCC11OCCC(CC(N2CCCC2)=O)C1)=O,2 F6438-1361,CN(C)c1ccnc(CNC(Nc2cccc(Cl)c2)=O)n1,0 Z2104064007,O=C(C(CC1)CCN1C1CC1)NS(CC(F)(F)F)(=O)=O,0 Y020-6031,CC(CCCC1)C1N(C=Cc1c2cnc3ccnn13)C2=O,2 F6550-4660,CSc1cc(C(N(C2)CC2Nc2ncccn2)=O)ccc1,0 F6802-9527,COc(cccc1)c1NC(CN(CC1)CCC1Oc1nccs1)=O,0 F6480-3447,Cc1nc(OC(CCC2)CN2S(c(cc2CC3)cc(CC4)c2N3C4=O)(=O)=O)nc(C)c1,2 SA93-0650,CCCOc(cc1)ccc1S(N(CCC1)CC1(CCOC)C(N)=O)(=O)=O,0 Z1252351684,CCN(Cc(cccc1)c1Cl)c1ncnc(-n2cncc2)c1,0 SC77-1391,CC(C)S(N(C[C@H]1C(N(C)CCc2ccccc2)=O)C[C@@]11OCCNC1=O)(=O)=O,2 K284-5092,CCC(C(Nc(cccc1)c1OCC)=O)SC(N1Cc2ccco2)=Nc(cc(c(OC)c2)OC)c2C1=O,0 Z600504856,OC(c1cc(CNC(CCn2nncc2)=O)ccc1)=O,2 Z4201874649,CC(c(cc1)cc(C2)c1NC2=O)NC(c1ncc2n1cccc2)=O,2 Z1470274496,OCCC(CCC1)CN1C(c1ccc(-c(cccc2)c2Cl)o1)=O,0 Z2437348884,CC(c1nc(C)no1)NS(c(ccc(C(O)=O)c1)c1OC)(=O)=O,0 F5016-1455,O=C(C(Nc(cc1)cc(Cl)c1F)=O)NCC(CC1)CCN1c1ncccn1,0 F3095-0178,Cc(cc(cc1)OCC(N(C)C2CCCCC2)=O)c1Cl,0 F6353-3275,Cc(ccc(Cl)c1)c1S(NCC(c(cc1)cc2c1OCC2)N(C)C)(=O)=O,0 SB20-1434,Cc1c(CN2[C@H](Cn3nnc(C(NC4CCCC4)=O)c3)CCC2)scc1,2 F5833-7031,COc(ccc(NC(c1ccno1)=O)c1)c1N(CCCC1)C1=O,0 Z4229775226,COC(c(ccc1ncc2)cc1c2N1C[C@H](CC2)[C@H]2C1)=O,2 F6446-0609,CCSc(cccc1)c1C(NC(CC1)CCN1c1nccs1)=O,0 Z95869690,O=C(Cc1cscc1)N(CC1)CCC1c1nnc2n1cccc2,2 F6372-0006,Cc1noc(Cc(cccc2)c2NC(Cn(cc2)c3c2cccc3)=O)n1,2 S582-0062,CN(C(CNS(c(cc1)ccc1OC)(=O)=O)Cn1c2ccc1)C2=O,2 F6523-3947,Cc1c(C(N(CC2)CC3=C2N=C(C=CC(F)=C2)N2C3=O)=O)scn1,2 F5857-5432,OC(CNC(C1(CCOCC1)c1ccccc1)=O)(CC1)c2c1cccc2,2 8015-4051,O=C(C1CC1)NC(C(F)(F)F)(C(N1Cc2cnccc2)=O)NC1=O,2 F2135-1838,Nc1c(C(c(cc2)ccc2Cl)=O)sc2c1cccn2,0 S971-1024,COc(cc1)ccc1OCC(N(CC1)CCC1(CC1)C1O)=O,0 CM4741-3814,O=C(c1cscc1)N(CC1)CCC1OC(CCN1c2ccccc2)C1=O,2 Y043-5577,c1(n2c(nn1)cccc2)[C@@H](NC(=O)COc1c2ccn(c2ccc1)CCOC)CC(C)C,2 SB59-0159,Cn1c(C(C2)C(C3)(CN3C(NCCc3ccccc3)=O)CN2S(C)(=O)=O)nnc1,0 Z3354497556,O=C(c1cc(scc2)c2n1CC1CC1)N(C1)Cc2c1ccnc2,2 D513-3554,Cc(cc1)ccc1S(N(Cc(c(F)ccc1)c1Cl)c1nn2c(C)cc(C)nc2n1)(=O)=O,0 Z1240435453,O=C(Cc1cccc(C(F)(F)F)c1)N(CC1)CCC1c1ccn[nH]1,0 Z3512024061,CN(C1CCCCCC1)C(c1cn(CCN)nc1)=O,2 Z2914314562,OC(Cc1ncccc1)(CC1)CCN1C(COc(cccc1)c1F)=O,2 F249-0394,CN(C1=O)N=Cc2c1n(CC(NCCCN(CC1)CCN1c1ccccc1)=O)c1c2cccc1,2 Z1273260278,COCc1cc(C(N(CC2)CCC2C(c2ccccc2)=O)=O)no1,0 F6250-0397,O=C(c1c(C(F)(F)F)cccc1)NC(CCC1)CC1OC(Nc(cc1)ccc1F)=O,0 D262-1016,Cc(cc1)ccc1C(C1=C2CCCC1)=NN(CC(N=C1N3C=CC=C1)=CC3=O)C2=O,2 F6562-9382,O=C(Cc(c(F)ccc1)c1Cl)NCc1nccnc1-c1ccco1,0 F6559-0025,Cn(cc1)c2c1C=CN(CCNC(COc(cccc1)c1F)=O)C2=O,2 F1308-0049,COC(CSc1nnc(-c2cccs2)n1-c(cc1)ccc1OC)=O,2 S606-1106,COCCN(c1c(N2[C@H]3CN(CCCc4ccccc4)CC3)nccc1)C2=O,2 F6502-3178,Cn1nc(C2CC2)cc1N(CC1)CCN1S(c1ccccc1)(=O)=O,2 Z4607405937,CCCCOc(cc1)ccc1C(NC(C)(CC1)CS1=O)=O,2 Z2733348490,CCc(s1)nc(C(O)=O)c1Br,0 Z4407849681,OC(c1c(CCC(NCCCCn2nnc(-c3cncs3)c2)=O)cccc1)=O,2 S957-0007,CC1(CC1)C(N1CC(CC2)(CCN2c(cc2)cc(C(F)(F)F)c2C#N)C(CO)C1)=O,2 SA46-0170,Cc(n(C)c(-c1ccccc1)c1)c1C(N(C1)CC1(C1)OCC1N1CCCC1)=O,2 F6514-2773,O=C(C1(CCCC1)c1cccs1)N(C1)CC1OCC(F)(F)F,2 Z1250559374,O=C(C1CC1)N(CCC1)CC1C(NCc1cc(N2CC=CC2)ccc1)=O,2 Z851793380,CC(C)C[C@H](C(O)=O)NC(c1cn(C)nc1)=O,0 Z2180452625,Cn1nc(C2CC2)c(C(NCC2(CCOCC2)c(cc2)ccc2Br)=O)c1,0 Z2327485193,OC(C(N(CC1)CCN1C(c1c(cccc2)n2nc1)=O)=O)=O,0 Z4917882416,CC(C1OCCC1)C(N(C)CCCNC(c1ncc2[nH]cnc2c1)=O)=O,2 F6473-8258,Cc(nc1)cnc1C(N(CC1)CCC1OC(C=C(C)O1)=CC1=O)=O,2 F5033-3144,COC(c(cc1)ccc1C(NCC(CC1)CCN1C(COc1ccccc1)=O)=O)=O,0 Z1128764945,CC(C)(c1noc(C)n1)NC(Cn1ncc(C)c1)=O,0 Z3074702760,OCC(C1)(C2)C1CN2c(nccc1)c1S(NCC1CC1)(=O)=O,2 F6808-5911,CN(C=NC(N(CC1)CCC1(c1ccccc1)C#N)=C1)C1=O,2 Z1260432862,Cn1ncc(N(CCC2)CC2NC(Cc2c[nH]c(cc3)c2cc3OC)=O)c1,2 F6549-7526,COc(nccc1)c1C(N(C(CC1)C2)C1CC2n1ncnc1)=O,2 Z1278519517,O=C(Nc1cn(CC2CC2)nc1)N1CC(c(cc2)cc(Cl)c2Cl)OCC1,2 F6555-0535,O=S(CCC(F)(F)F)(N(C1)CC1n1nnc(C2CC2)c1)=O,0 CM4297-2670,O=C(Cc1cccc(Cl)c1)N(C1)CC1n1c(C2CCOCC2)nnc1,2 F6405-1375,COc(cc1)cc2c1nc(N(CC1)CCC1C(N(CC1)CCN1c1ncccc1)=O)s2,2 Z274767902,Cc1nc(SCC(Nc(cc2)ccc2Cl)=O)nc(O)c1CC=C,0 Z4617158692,OC(C1)(CN1C(c(cc1)cc(C(F)(F)F)c1F)=O)c1nnn[nH]1,2 Z1239337073,COc(cc1)nnc1C(NCC1N(Cc2ccccc2)CCC1)=O,2 F6518-4183,CN(C=CC=C1C(N(CC2)CC2c(cc2)cc3c2OCO3)=O)C1=O,2 F6473-8201,CC(O1)=CC(OC(CC2)CCN2C(c(cc2)ccc2-c2cccs2)=O)=CC1=O,2 S606-1398,O=C(C(C=C1)=NNC1=O)N(CC1)C[C@@H]1N(c1ncccc1N1CC2CCCCC2)C1=O,2 F6502-1266,O=C(NCCn1c(-c2nccnc2)ncc1)NC1CCCCC1,2 Z4521554134,CC(CNC(c1nccc2c1cc[nH]2)=O)N(C)Cc(cc1)ccc1Cl,0 Z1958801617,CC(C)(C1)OC2(COCC2)CN1c1nc(OC)nc(C)c1,2 F6430-0761,Cc1cc(C)nn1-c1cc(NC(CCN(C=Nc2c3cccc2)C3=O)=O)ncn1,2 Z2582083072,CC(N(CC1)CCC1NCC1C2(CCC2)CN(Cc2ccccc2)C1)=O,2 S556-0912,COCc1nc(-c(cc2)ccc2OC(C2)CN2S(c2cc(OC)ccc2)(=O)=O)no1,2 E734-1382,Cn1c(C(N2C(CCCC3)C3CCC2)=O)cc(S(N2CCOCC2)(=O)=O)c1,2 SB40-0613,CC(C)CN(CC1NC(Cc2c(C)onc2C)=O)CC2(CCOCC2)NC1=O,2 Z1560807993,OC1(CN(C=Nc(cc2)c3cc2Cl)C3=O)CCCC1,0 T408-2154,O=C(C(CC1)Cc2c1sc(C(N1CCCCCC1)=O)c2)NC1CC1,2 CM2894-3928,O=S(c(cccc1)c1F)(N1C(Cc2noc(-c3ccccc3)n2)CCC1)=O,2 V029-4632,CCCn(c(C(NCCc1ncccc1)=O)c1)c(cc2)c1cc2NC(c1ccc(C)cc1)=O,2 Z1453267043,CC(C1CC1)C(N(CCC1)CC1Nc1ccccc1)=O,2 F6524-4298,CC(NCC(N(CC1c2nocn2)CC1c1ccccc1)=O)=O,0 Z2982491403,CC(CC1)CCC1S(Cc1noc2c1COCC2)(=O)=O,2 K261-0788,COc(cc1)cc(CCNC(CC2(CC(N3)=Nc(cccc4)c4S3(=O)=O)CCCC2)=O)c1OC,0 F6564-3827,CC(C(NCCN(C(C=C1)=O)N=C1n1cncc1)=O)N1N=C(C2CC2)C=CC1=O,2 C564-0204,CCN(c(cccc1)c1C(SCC(NC(C)CCc1ccccc1)=O)=C1)C1=O,2 Y200-3915,COc(ccc(-c1cc(C(NC2CCCC2)=O)c(cc(cc2)Cl)c2n1)c1)c1OC,2 Z1119401693,CN(CC1)CCN1c1c(CNC(C2(CC2)S(c(cc2)ccc2Cl)(=O)=O)=O)cccc1,2 F5913-0493,O=C(CN(C=NC(c1cccs1)=C1)C1=O)NCc(cccc1)c1OC(F)(F)F,2 Z1733835134,CC(CC1)(CN1C(NC(c1ccco1)c1ccccc1)=O)O,2 2387-1664,O=S(c(cc1)cc2c1oc(C1CCCCC1)n2)(c(cc1)cc2c1oc(C1CCCCC1)n2)=O,2 F1872-0915,CCOC(CNC(CSc1nccn1Cc1ccco1)=O)=O,2 Y031-0408,O=S(c(cc1)ccc1NS(c(cc1)ccc1F)(=O)=O)(NCC1OCCC1)=O,2 SB49-0994,COc(cc1)cc(C(N(CCCC23CCOCC3)C2C(N)=O)=O)c1Br,2 P223-1222,Cc1nocc1C(N(CCC1)CC1c1nn(CCCN(CCOC)C2=O)c2c1)=O,0 Z4521694184,CC(NN=C1C(N(C2)CC2NC(C2CSC2)=O)=O)=CC1=O,2 Z2143275916,Cc1csc2c1c(N(CC1)CCN1S(NC)(=O)=O)nc(C)n2,0 Z4927733895,CC(C1)(C(Nc(cc2)cc3c2[nH]c(C(N)=O)c3)=O)OCCC1N,2 S823-2074,Cn1c(C(N[C@@H](C2)[C@@H](CO)CN2c2ncccn2)=O)cnc1,2 Z3027211280,O=S(c1cnc(C2OCCO2)s1)(N1C(C2)C2CCC1)=O,2 F3411-0300,CCn(cc1NC(N2c3ccc(C)cc3)=O)nc1C2=O,2 SB21-0908,NC(c1cn(C[C@H](C2)N(Cc(cc3)cc4c3OCC4)C[C@H]2F)nn1)=O,0 Z1322916856,Cc1nn2c(C)c(CCC(NCCc(cc(cc3)F)c3F)=O)c(C)nc2c1,0 F2616-0932,O=C(C(Nc(cccc1)c1Cl)=O)NCc1ccco1,0 SC74-1390,CNC([C@H](C[C@H]1c2nc(-c3ccccc3)no2)C[C@@H]1NC(C1CCC1)=O)=O,2 Z2218956177,CCc1cnc(CN(CC2)CCC2Oc(nccc2)c2F)cc1,0 Z1866832396,Cc1cc(CN(C)C(C(CC2)CCN2S(N)(=O)=O)=O)c(C)cc1,0 Z927287498,O=C(CCc1ncc(-c2ccccc2)o1)N1CCNCC1,2 F6755-0657,Cc1cc(N(CC2)CCN2c2cc(OC)ncn2)c(C)cc1,0 Z3685949143,Cc1nc(CN[C@H](CC2)CN2c2c(C)c(C)nc(C(NC)=O)n2)c[nH]1,2 CM4297-5154,Cc(nc1)cnc1C(N(C1)CC1n1c(C2OCCC2)nnc1)=O,0 Z1739144041,COCc1cccc(S(N(CC2)CCC2OCC(O)=O)(=O)=O)c1,0 F6420-0639,COC1(CNC(c(o2)ccc2Br)=O)CSCC1,2 F6559-1790,O=C(c1cc(cccc2)c2o1)NCc1nc(C2CCOCC2)no1,2 P619-0623,CCCN(c(nccc1)c1Oc(cc1)c2cc1S(NC1CCCC1)(=O)=O)C2=O,2 G239-0364,O=C(CCn1nccc1)Nc1ccc(CN2CCCCC2)cc1,0 Z2169594012,CC(C)n1nccc1NC(C(CC1)CN1c(cccc1)c1Cl)=O,2 Z3062201391,CC(N[C@H](CN(C1)C(Nc2c(C)nc(C)cc2)=O)[C@@H]1c1ccnn1C)=O,2 F5262-0200,Cn1c(C(CNC(C(NCc2cccs2)=O)=O)N2CCOCC2)ccc1,2 C047-1356,COc1ccc(C(C(C(CCC2)=O)=C2N2)C(C(N3)=O)=C2NC3=O)cc1,0 Z4480905153,CC(C)(C)CNC(CN(CC1)CCN1C(CN(C=CC=C1)C1=O)=O)=O,0 F5854-0583,O=C(CN(C(CC1)=O)C1=O)N(Cc1ccco1)Cc1ncccc1,2 Z1347499951,O=C(Nc1ccncc1)N(CC1)CCC1=Cc1ccccc1,0 Z109830432,Cc1cc(cccc2)c2n1CC(N(C1)c(cccc2)c2OC1C(NC)=O)=O,0 F6806-7241,CS(c(cc1)ccc1N(CC1)CCC1C(NC1CC1)=O)(=O)=O,2 G262-0199,CC(CC(N(CC1)CCN1c(cc1)nnc1N1CCOCC1)=O)n1nccc1,2 Z4767056386,COc(cc1)cc(CNC(Cn2nnc3c2cccc3)=O)c1F,0 F3083-0413,CC(c(cc1)cc(OC)c1OCC(CNC1CCCCCC1)O)=O,2 F854-1307,CC(C)C(c1cccs1)NC(c1cccc(NC(c2nnc(C3CC3)s2)=O)c1)=O,2 F6559-1529,CC(C(NC(CC1)CCC1(F)F)=O)Oc(cc1)cc2c1OCO2,2 F5855-0213,CSc(cccc1)c1C(N(CC1)CCN1C(C(C1)C1c(cc1)cc2c1OCO2)=O)=O,0 F429-0082,Cc(onc12)c2C(C)=NN(CCC(NCC2OCCC2)=O)C1=O,2 F6473-0151,NC(C(CC1)CCN1C(C1)CN1C(CCc(cc1)ccc1Br)=O)=O,0 Z3361400453,Cc1cn(C)nc1CNc1c(CN(CC2)CCC2O)cccc1,2 F6230-0024,O=C(c1ccc(Cn2cncc2)cc1)NCc1c(cccc2)n2nc1,2 S728-0021,Cc(cc1)ccc1NC(C(CCO)(C1)C11CCOCC1)=O,0 F6473-4202,CN(C(C=C1)=O)N=C1C(N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O)=O,2 F5826-0130,Cn1c(N(CC2)CCN2C(NCc(cc2)ccc2F)=O)nc2c1cccc2,2 S892-0762,CCn1nc(C(CCCC2)N2C(c2cscc2)=O)c2c1CCOC2,2 F1061-0319,Cc1ccc(C)n1CCN(CC1)CCN1C(c1ccco1)=O,2 SB96-0063,CC1(CCCCC1)C(N(CC1)CC1N(CCn1c(C)ncc1)S(C)(=O)=O)=O,2 F6515-2957,O=C(c1cc(-c2ccco2)n[nH]1)N(C(CC1)C2)C1CC2n1nccn1,2 V028-0735,COc(cc1)ccc1-c1ncc(C(NCC2OCCC2)=O)c(Oc(cc2)ccc2Cl)n1,2 Z1566556679,CC(C(Nc(ccc(N1CCCCC1)c1)c1C(N)=O)=O)NC(c1c(cccc2)c2n[nH]1)=O,2 F6472-7606,COc(cc1)cc(C(N(C2)CC2N(CC2)Cc3c2cccc3)=O)c1Br,0 D335-2901,Cc1nc(CCNC(COc2cc(C)cc(C)c2)=O)cs1,0 Z2963307519,Cc1c(C(N2C(CC3CC3)COCC2)=O)[nH]c(CCC2)c1C2=O,2 F6564-8396,O=C(c1cscc1)NCCN1N=C(CCC2)C2=CC1=O,2 F5095-0118,Cn1c(N(CC2)CCN2C(c(cc2)ccc2S(N2CCOCC2)(=O)=O)=O)ncc1,2 8016-5484,O=S(c(cc1)cc2c1oc1c2cccc1)(N1CC(COc2ccccc2)OCC1)=O,2 F6577-0733,COc(nc1)ncc1NS(c(cc1)ccc1Br)(=O)=O,0 F6354-0487,Cn1c(CN(C2CC2)C(CC(CC(O)=O)c2cccs2)=O)ccc1,2 F2019-0552,CN(C)CCCN(C(c1cc(C(F)(F)F)ccc1)=O)c1nc(ccc(Cl)c2)c2s1,0 F6359-3067,CC(C)(C)NC(N(CC1)CCC1Oc1nccnc1)=O,0 F6442-1058,O=C(c1ccno1)N(C1)CC1S(C1CCCCC1)(=O)=O,2 F6521-2039,CC(c1ccc(C2(CNC(Nc(cc3)cc4c3OCO4)=O)CCCC2)s1)O,2 F6439-5730,Cc1nn(cc(cn2)NC(Nc(cc3)cc(Cl)c3Cl)=O)c2c1,0 F6443-7774,O=C(c1cc(cc(cc2)F)c2s1)NCC(CCC1)N1c1ccccc1,2 Z7056091926,CN(Cc1cn(C)nn1)C(c1c(cc(C(CC2)CCN2C(c2ccccc2)=O)cc2)n2nc1)=O,2 4031-1193,C=CCNC(C(Nc1cccc(Br)c1)=O)=O,0 V017-2344,COc1cccc(Oc2nc(N3CCCC3)nc3c2CN(Cc(cccc2OC)c2O)CC3)c1,0 Z1376357202,CNC(c1ccc(CN2N=Nc(n(C)nc3)c3C2=O)cc1)=O,0 Z2439150065,Cc1cc(C)nn1-c1ccc(CC(N(CC2)CC22CNCC2)=O)cc1,2 F6681-9285,Cc(cn1)cnc1OCC(CCC1)CN1c1nccnc1C,2 K788-1457,CC(c1cnccc1)N(C1CCCCC1)C(Nc(ccc(OC)c1)c1OC)=O,2 Z285707306,Cc1cc(N(CCC2)C2c(ccc(OC)c2)c2OC)nc(C)n1,0 F3386-4027,COc(c(S(NCCCn1cncc1)(=O)=O)c1)cc(Cl)c1OC,0 F6573-0250,Cn1nccc1-c1ncc(CNC(CNC(OCc2ccccc2)=O)=O)cc1,2 F6525-2477,Cc1cc(-c2cnccc2)nn1CCNC(CSc(cc1)ccc1F)=O,2 F894-1348,CCN(CC1)CCN1C(C(CCC1)CN1S(c1c(C)sc(-c2noc(C3CC3)n2)c1)(=O)=O)=O,2 Z4126488539,Cc1nc(-c(cc2)cc(F)c2Oc2nc(C(OC)=O)cnc2)cs1,0 F6734-0691,N#Cc1cccnc1N1CC(CN(C2)c(cc3)ncc3Cl)C2C1,0 Z27799636,Cc1cccc(NC(c(c(OC)ccc2)c2OC)=O)c1C,0 Z2483422682,Cc1cc(CN(CC(O)=O)Cc2cccc(Br)c2)ncc1,0 F6482-2079,Cc(cccc1)c1OCC(NC1CC2OCCOC2CC1)=O,2 C664-0079,CC(CCCC1)C1NC(CCCN(C(c([nH]c(cc1)c2cc1OC)c2N1)=O)C1=S)=O,2 F6497-2027,O=C(Cc(ccc(F)c1)c1F)N1CC(Cc2nc(-c3cscc3)no2)CCC1,2 Z1445384780,Cc(cccc1)c1C(Nc1cccc(C(N(CCCC2)C2C(O)=O)=O)c1)=O,0 K061-0836,O=C(c(cnn1c(C(F)(F)F)c2)c1nc2-c(cc1)ccc1Br)Nc(ccc(F)c1)c1F,0 Z2641567942,CCN(Cc1c(C)cco1)C(c(cc1)cc(N2)c1N(CC)C2=O)=O,0 F6351-0361,CCn1nnc2c1ncnc2N(C1)CC1C(Nc(cccc1)c1SC)=O,0 Z1102962974,NC(c(cc1)cnc1C(NCC1CN(CCc2ccccc2)CC1)=O)=O,2 F6544-1143,Cc1nccc(N2CCC(Cn3nccc3)CC2)c1,2 Z2454597690,CC(C)n(c1nc(C2CC2)c2)ncc1c2C(N(CN1C)C(C)C1=O)=O,2 Z2184030300,CC(C)CN(c1nc(C(C)C)cc(C(N2C(C3CC3)C3(CCC3)C2)=O)c1C(N1)=O)C1=O,2 F322-0460,Cc1noc(-c2c(C)sc(C)c2S(N(CC2)CCN2c2cc(OC)ccc2)(=O)=O)c1,0 SC88-1135,O=S(c1cnccc1)(N(C1)CC1(C(CC1)c2nc(-c3ccncc3)no2)S1(=O)=O)=O,2 Z2948530226,NC(C1(CC1)NC[C@@H]([C@@H]1c2ccccc2)C1(F)F)=O,2 Z3097810015,CCn1c(N(CC2)CCN2S(c(cc2)ccc2F)(=O)=O)nnc1C(C)O,0 F537-0088,O=C(COc(cc1)ccc1Cl)N(CC1)CCN1S(c(cc1)cc(N2)c1OCC2=O)(=O)=O,0 F6492-0912,Cc1nc(CC(CC2)C(NCCCc3nc(C)no3)=O)c2[nH]1,2 F6482-1610,CCS(C(C1)CN1C(c(cc1)ccc1-c(cc1)cc(Cl)c1Cl)=O)(=O)=O,2 ZC45-0068,COCC(N(C1)CC(CC2)(CCN2C(C2CCOCC2)=O)C1c1ncco1)=O,0 Z1469759239,Cc1c(C)cc(CC(N(CCC2)CC2(C(N2)=O)NC2=O)=O)cc1,0 Z3268555296,CC(C(C1)CN1c(nc1)ncc1Br)=O,0 F6573-5106,O=S(c(cccc1)c1Br)(NCc1cncc(C2CC2)c1)=O,0 Z2845438653,CCOc(ccc(-c1cn(C(C)C(N(C)C)=O)nn1)c1)c1F,0 F184-3676,CCC1Oc2cc(S(N(CCC3)CC3C(NCCc3cccs3)=O)(=O)=O)c(C)cc2NC1=O,2 F6752-3662,O=C(C1CC1)NC1CN(Cc2ncccc2)CCC1,0 Z370278156,CN(C)C(c(cc1)cc(N2)c1NC2=O)=O,0 Y300-0679,CN(C)S(N(CC1)CCC1C(N(CC1)CCN1S(c1ccccc1)(=O)=O)=O)(=O)=O,2 F6752-5422,O=C(C1CCN(Cc(cccc2)c2Br)CC1)NC1CC1,0 F6245-5910,Cn1nnc(C(NCCN2N=C(C(F)(F)F)N(C)C2=O)=O)c1,2 Z3367736983,CN(CC1)CCC1OCC(N(C1)CC1Nc1ccccc1)=O,2 F6089-9764,Cc1cc(CN2CCC(CNC(NC3CCOCC3)=O)CC2)c(C)o1,2 F6561-6595,Cn1ncc(-c2c(CNC(c(cc3)ccc3Oc3nccs3)=O)cccn2)c1,2 V023-7215,Cc1cc(C(N(CCC(Nc2cc(C)cc(C)c2)=O)CC2OCCC2)=O)no1,2 F6816-3612,N#Cc(cc1)nnc1N(CCC1)CCN1c1cc(C(F)(F)F)ncn1,2 F6617-2968,C(CNc1nc(cccc2)c2c2nc(-c3ccncc3)nn12)CN1CCCCC1,2 F6518-2268,CC(c1ccc(CCNC(c2cocc2)=O)s1)=O,0 Z1591198548,CCc1cc(C(N2CCN(Cc3noc(C)n3)CC2)=O)ncc1,0 F6452-1018,CCC(CNC(Nc(cccc1)c1Cl)=O)(c1ccccc1)OC,0 Z2803744443,CN(C[C@@H]1N(Cc2ccccc2)CCCC1)C([C@@H](CCC1)NC1=O)=O,2 F6548-3513,CCCCN(c1c2cccc1)C(SCC(N=C1N3C=CC=C1)=CC3=O)=NS2(=O)=O,2 F6681-3576,N#Cc1nccnc1N1CC(COc2cnccc2)C1,2 Z3042541630,Cc1cc(C(N(C[C@H]2c3nccn3C)C[C@H]2N)=O)c(C)n1-c1nccs1,2 F6441-1535,Cc(cc1)c(C)cc1S(N(CCC1)CC1SC)(=O)=O,0 Z4511739321,Cc1cc(C(CC2)CCN2c(ccnc2CN3)c2C3=O)c(C)cc1,0 Z2966215452,CC(C)(C)c(cc1)ncc1NC(Cc1csc(-c2nnc[nH]2)n1)=O,2 Z3053448982,CNc(nccc1)c1C(N(C1)CC1(c(cc1)ccc1Cl)O)=O,2 Z2899615340,CN(CC(C(Nc(cc1)cc(Cl)c1F)=O)NC1)C1=O,0 P563-1005,O=C(C1=C(CCC2)N2c(ccc(F)c2)c2S1(=O)=O)NC1CCCC1,2 Z45534575,Cc1cc(S(NCc2cccc(Cl)c2)(=O)=O)c(C)cc1,0 F555-0125,O=C(CCC1)N1c(cc1)ccc1S(NC(C(Oc1c2cccc1)=O)=C2NC1CCCC1)(=O)=O,2 Z3827982843,CCNC(N(CC12COC2)CC1(CO)F)=O,0 F6554-1102,CCc(s1)ccc1S(N(CCC1)CC1c1nn(C)cc1)(=O)=O,2 F6748-0911,Cc1cccnc1OCC(CC1)CCN1c1nc(C)ccc1C#N,0 Z2392016869,CC(C(C)N)C(NC1=CC=CN(Cc(cc2)ccc2F)C1=O)=O,0 F2493-0736,COc(cc1)ccc1-c1cc(CNC(Cc2cccs2)=O)no1,2 F2372-0380,O=C(NCC(C1)CN(Cc2ccccc2)C1=O)NC1CCCCC1,2 Z1531862997,CC(C)(CC1)CCC1(C(N)=O)NC(c(cc1)nn1-c(cc1)ccc1F)=O,2 F6619-7793,Cc(cc1)nn1-c1ccc(N2CCN(Cc3c(CCC4)c4nn3C)CC2)nn1,2 F6796-8816,Cc1cccc2c1nc(N(C1)CC(C3)C1CN3c1ncccc1)s2,0 F633-1067,CCC1Oc(ccc(S(N(CC2)CCC2C(N(C)Cc2ccco2)=O)(=O)=O)c2)c2NC1=O,0 8020-3657,O=C(C(C1)C(c(cc2)cc3c2OCCO3)OC1=O)NCc(cc1)ccc1Cl,0 M976-0268,CCC(N(CC1)c(cc2)c1cc2N(CC(C1)C(N(CC2)CCN2c2ncccc2)=O)C1=O)=O,2 F6556-6414,O=C(C1COCC1)N(CCC1)CCN1C1CSCC1,2 F2073-0437,CC(C1=NC(C)=C2NC(c(cc3)cc4c3OCO4)=O)=CC=CN1C2=O,2 F6805-3753,CC(N1CC2CCN(CC(NCc3ccco3)=O)CC2)=Nc(cc(cc2)F)c2C1=O,2 Z2954990779,COc1nccc(C(N2CC(Cc(cc3)ccc3F)CC2)=O)n1,2 Z644700556,CCCc1noc(CN(CC2)CCN2C(c(cccc2)c2OCC)=O)n1,0 F6675-8509,CN(C(C1)CN1c1nccnc1C#N)C(Nc(cc(cc1)Cl)c1OC)=O,0 F6259-0387,O=C(C(CC1)CCN1c1ncnc(C2CC2)c1)NCc1cccs1,2 J029-0265,Cc(ccc(-c1nc(nccc2)c2o1)c1)c1NC(C1(CCCC1)c1ccccc1)=O,0 SB52-0082,Cc1nc(S(N2CCC(C3)(CN(C)C3c3noc(C)n3)CC2)(=O)=O)cn1C,0 Z1583784445,OC1(CNC(c(cn2)ncc2Oc2ccccc2)=O)CCCC1,2 SC45-1004,CC1n2nnc(CNS(C)(=O)=O)c2CN(Cc2ccccc2)C1=O,0 F6412-1243,COc(cccc1)c1OCC#CCNC(Cn1c(cccc2)c2nc1)=O,0 5954-1999,COc(cc1)cc(NC(c(cc2)cc(C3C4C5CC3CC5)c2NC4c2ccccc2)=O)c1OC,0 Z3992152356,Cc1cc(Nc2cn(CCF)nc2)nc(-c2ncccc2)n1,0 S896-0169,COc(cc1)ccc1-c1nc(CCOCC2)c2c(N(CC2)CCN2S(C)(=O)=O)n1,0 F6512-2914,Cc1c(CN(CC2)CCN2C(C2CC=CCC2)=O)cno1,2 Z1940124823,CC(N(CC1)C2(CCCCC2)CN1C(c1cc(c(C(F)F)nn2C)c2s1)=O)=O,2 Z1474132022,CC(C)c(cc1)ccc1C(Nc1c[nH]nc1-c1ccccc1)=O,0 Z2828103583,C[C@@H](C1CCNCC1)NC(c1cccc(Nc2nccc(C(F)(F)F)n2)c1)=O,2 F1187-0049,N#Cc1cc(CCC2)c2nc1SCC(c(cc1)ccc1Br)=O,2 Z2700243064,CC(C(N1)=O)(c(cc2)ccc2-c2noc(CC(CC3)CCC3(F)F)n2)NC1=O,2 Z1940987584,Cc1ccc(C(c2ncccc2)NC(CN(CCCCCC2)C2=O)=O)cc1,2 Z2597403410,COC1(CCN(Cc(cc2)cc(Cl)c2C(O)=O)CC1)c1nc(C2CC2)no1,0 SB95-0658,O=C(C1CCC1)N(CCN1CCCC1)C(CCC1)CN1C(C1CCOCC1)=O,2 F5772-5865,Cc(ccc(Cl)c1)c1N(CC1)CCN1c1nc(ccc(S(C)(=O)=O)c2)c2s1,0 F6670-5440,Cc(n(C)nc1C)c1S(N1CCC(CN(C=Nc2c3ccc(OC)c2)C3=O)CC1)(=O)=O,2 Z1537067586,Cc1cc2c(N(CC3)CCN3C(CN(C)C)=O)ncnc2s1,0 Z3271453671,OC([C@@H](C1)[C@H]1c1cc(Br)cc(Cl)c1)=O,0 SD12-0430,Cc1nn(C)cc1CN(CCN1)C(Cc2nc(-c3ccccc3)no2)C1=O,0 Z1535198123,CCCC(C1)OCCN1C(c1cnncc1)=O,0 Z3624518535,COC(C(C1)(C2)C1CN2C(c1cc(Cl)nc(Cl)c1)=O)=O,0 F6378-0154,O=C(C(COC1)N(Cc2cccs2)C1=O)N(CC1)c2c1cccc2,2 F1443-5287,Cc1nc(NS(c(cc2)ccc2NC(c(ccc(Cl)c2)c2Cl)=O)(=O)=O)nc(C)c1,2 C464-0841,CCC(N(CC1)c(cc2)c1cc2S(NC(C(C)C)C(NCC1Oc(cccc2)c2OC1)=O)(=O)=O)=O,2 F6037-0522,Cc(cc1)cc2c1[nH]c(C(C1)CN1C(C1(CCCC1)c(cc1)ccc1Cl)=O)n2,2 G955-0142,Cc1cn(C)c(CC(NC2CCCC2)=O)c1C(O)=O,0 Z1919420538,Cc1c(C(NC(CC2)CCN2S(C)(=O)=O)=O)nnn1CC1CCCC1,2 Z2179819323,Cc1cc(C)nc(N2CC3(CC3)CC2)c1C#N,0 V014-6317,Oc1cccc(CN2CCN(CCOC(c3ccccc3)c(cc3)cc(F)c3F)CC2)c1O,2 F6279-0290,O=C(C1CC=CCC1)N(Cc1ccco1)Cc1ncccc1,2 F6541-5961,CC(C)(C)NC(N(CC1)CCN1c1ccccc1)=O,0 8137-0511F,Cc(cc1)cc(Cl)c1NC(CC1SCCNC1=O)=O,0 F0579-0009,CCOC(N(CC1)CCN1C(CSC(N(c1ccccc1)C1=O)=NC2=C1SCC2)=O)=O,2 Z1289819540,CC1N(Cc2ccccc2)CCN(CC(Nc2noc(C)c2)=O)CC1,2 Z2984446949,COc(cccc1)c1-c1cn(CC(CC2)CCS2(=O)=O)nn1,0 Z3360543574,OC1c2cc(C(Nc3cccc(F)c3O)=O)nn2CCC1,0 Z3080855023,COc1cc(F)c(C(N(CC=C)C(CC2)CS2(=O)=O)=O)c(F)c1,0 Y207-0656,CCC(CC1)Cc2c1sc(C(NCCCn1cncc1)=O)c2,2 F2153-0009,OC(C1=CC=CN(Cc(cc2)cc(Cl)c2Cl)C1=O)=O,0 Z2172272583,Cc1cccc(C2(CC2)c2noc(Cc3c[nH]c4c3cccn4)n2)c1,2 Z2523571453,CC(C)(C1(C)C)C1(C(NC(CC1)CCNC1=O)=O)C(O)=O,2 Z1401217032,NC(c1cc(NC(CCC2CCCC2)=O)c[nH]1)=O,2 F6244-1339,O=C(COc(cc1)ccc1Cl)NCC#CCN1CCCC1,0 Z3687103873,Cc1c(CC(N[C@@H](CC(Cn2c(-c3ccccc3)ncc2)C2)[C@H]2O)=O)c(C)n[nH]1,2 F6565-3364,O=C(Cc(cc1)cc2c1OCO2)N(CC1)CCN1c1nnc(C(F)(F)F)cc1,2 F6802-8061,O=C(C(CCC1)CN1C(N=C1N2C=CC=C1)=CC2=O)N1CCSCC1,2 Z1188689464,CC(C)c1nc(cc(cc2)NC(c3cc(Oc4ccncc4)ccc3)=O)c2o1,2 V020-5944,COCC(CN(CC(N(CC1)C(COc(cccc2)c2OC)c2c1scc2)=O)C1CC1)O,0 Z2972727725,Cc1nsc(N(CC[C@@H]2N3CCOC)C[C@H]2NC3=O)n1,2 Y044-5140,COc(cc1nc2)ccc1c(O)c2C(NC(CC1)CS1(=O)=O)=O,2 Z1272495413,NC(c(cc1)cnc1N1CC(CCO)CC1)=O,0 Z1891235658,CCCc1noc2nc(C3CC3)cc(-c3nc(-c4cnc5n4ccnc5)no3)c12,0 F6464-0669,O=C(Nc1cccs1)N(CCCC1)CC1c(cc1)ccc1Cl,2 Z2370704798,CNC(C(CC1)CN1S(c(s1)ccc1Br)(=O)=O)=O,0 8016-0758,CC(C)(C1)CC(N(c(cc2)ccc2OC)C(C(C(Nc(cc2)ccc2C#N)=O)=C2)=O)=C2C1=O,0 Z1355038472,Cc(c1c2)nn(C)c1ncc2C(NC(CC1)CN1c1cccc(Cl)c1)=O,2 S592-0416,Cc(cc1)ccc1OCc1nc(C(CC2)CN2C(Cn2cncc2)=O)no1,2 Z1796183570,CCC(C)(C=C)C(N(CCC1)CC1c1noc(C2CC2)n1)=O,0 Z3313948155,OC1(CCC1)C1(CNCC(c2c3cccc2)=CNC3=O)CCC1,2 Z1269046886,O=C(c(cc1)ccc1NC(N(CC1)CC1N1CCOCC1)=O)NC1CCCC1,2 Z2909250054,CN1CCC(CC2)(CCC2NC(Cc(cc2)ncc2OC)=O)CC1,2 F6571-6153,COc(ccc(C(NCC1(C=CCCC1)O)=O)c1)c1F,0 F594-0650,CCCN(CCC(N1CCNCC1)=O)C(c1cc(NC(C)=O)ccc1)=O,0 S615-0245,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CC1c1nc(CCOCC2CC2)no1,2 F2515-4558,Cc1cc(C(N(Cc2cnccc2)c2nc(c(C(F)(F)F)ccc3)c3s2)=O)c(C)o1,2 G657-0463,CCN(c(n1nc2)c2C(N(CC2)CCN2c2c(C)ccc(Cl)c2)=O)C(CCNC2)=C2C1=O,0 F6090-0465,CCOc(cc1)nnc1C(Nc1cccc2ncccc12)=O,2 F902-0897,Cc(sc(-c1ccno1)c1)c1S(NCC1OCCC1)(=O)=O,2 F5832-0101,O=C(NCC1(CCOCC1)c1cccs1)Nc(cccc1)c1Cl,0 F6436-2627,O=C(c1cc(cccc2)c2o1)N1CCC(CNS(c2cccc3cccnc23)(=O)=O)CC1,2 Z2482908953,CCCS(NC1CCN(Cc(c(C(O)=O)ccc2)c2Cl)CC1)(=O)=O,0 Z1778911317,CC(C)(Cc(cc1)ccc1OC)Nc1ncnc2c1cnn2C,0 Z873200004,COc(cc1)cc(OC)c1C(N(CC1)CCN1S(c1cn(-c2ccccc2)nc1)(=O)=O)=O,2 Z1748049602,OC(C1)C2(CC2)CN1C(c(nc1C2CC2)nn1-c(cccc1)c1Cl)=O,2 Z2972615130,CC1(CCCC1)N(C)Cc1cc(O)ncc1,2 F6682-6665,Cc1c(CN2CC(COc3nccc(C#N)c3)CCC2)scn1,0 S978-0332,C[C@@H](COc1c(C2)cc(CN3CCN(C)CC3)cc1)N2C(Cc1cscc1)=O,2 F6374-1807,Cc(cccc1)c1NC(N1CCC(CSc(cc2)ccc2OC)CC1)=O,0 Z2960662718,O=C(c(cc1)cc(N2)c1N(CC1CC1)C2=O)N(C[C@@H]1C2)[C@@H]2CS1=O,2 M506-0387,COc1ccc(CN(C(C2(c3cccc(F)c3)O)=O)c3c2cccc3)cc1,0 F6502-2524,Cc1cc(C(NCCn2c(C3CC3)ncc2)=O)c(C)o1,2 C887-0301,CCC(n1c2cc3c1cco3)=NN(CC(N(CC1)CCC1C(N)=O)=O)C2=O,2 8019-8000,COc(ccc(C(C1)c(scc2-c(cc3)cc(OC)c3OC)c2NC1=O)c1)c1O,0 F6452-1087,CC(CNC(c1c(C)nns1)=O)(c1cccc(Cl)c1)OC,0 Z29692487,CN(C(C=C1)=O)N=C1C(NCc1cccs1)=O,0 SA58-0358,CCCNC(N1C(CCc2noc(-c3cnccc3)n2)CCC1)=O,0 Z2122664997,CC(C)c1cccc(CNC(c2c(N)nc(C3CC3)nc2)=O)c1,0 F2493-2841,O=C(c(cccc1)c1S(C(F)F)(=O)=O)NCc1noc(-c(cc2)ccc2F)c1,0 Z1272139279,CNC(c1c(N(CC2)CCC2c2nc(cccc3)c3o2)nccc1)=O,0 F6474-7276,O=C(Cc1cccc2ccccc12)N(C1)CC1N(C(CN1)=O)C1=O,2 F2303-0086,CC(C)(C(N1CCN(CCNC(c(cc2)cc3c2OCO3)=O)CC1)=O)Oc(cc1)ccc1Cl,0 Z1426011052,CC(C1CCOCC1)Nc1nc(OC)ccn1,2 Z2788251801,CC(Nc1cc(CN(CC2)C(NCc3cnccc3)=O)c2cc1)=O,0 Z2911453907,Cn1nc(C(F)(F)F)cc1C(N(CC1)CCC1c1ncc(C(O)=O)s1)=O,0 Z816942134,O=C(CNC(c1c(COc2ccccc2)cco1)=O)N(CCC1)c2c1cccc2,2 CM4377-3928,Cc1cnc(COC(CCC2)CN2C(C2CCOCC2)=O)n1CCOC,2 Z2287920128,CCC(CCC1)C1C(NS(c(c(C)ccc1)c1Cl)(=O)=O)=O,2 F1371-0306,CCCCNC(C(CC1)(C2)C(C)(C)C1(C)C2=O)=O,0 F6523-2905,CCn1c(-c2noc(CNC(c3cc(-c4cccs4)nn3C)=O)n2)ccc1,2 SB04-0191,CS(N(CC1)CC1N(CCNC(c1cccs1)=O)C1CCOCC1)(=O)=O,0 F6210-0120,O=C(c1cccc(Br)c1)NC(C1)CNC1=O,0 K906-4618,CCC(C1)Oc(ccc(C)c2)c2N1S(c(cc1)cc2c1[nH]c1c2CCCC1)(=O)=O,0 Z2960939550,C=C[C@H](CO)NC(C1(c2ccccc2)OCCC1)=O,0 F5679-0048,O=C(Cc1csc(-n2cccc2)n1)NCc1ccco1,2 Z1437782946,CC(c1c(C)nc(C)nc1)NCc(cc1)cnc1N1CC(C)OCC1,2 D315-1210,Cc(ccc(C(C=C1)=NN(CCOc(cc2)ccc2F)C1=O)c1)c1S(N1CCOCC1)(=O)=O,2 F1767-0139,CC(C)(C)C(Nc1cccc(-c2csc(C)n2)c1)=O,0 Z2928212618,C[C@](CCC1)(C(O)=O)N1S(Cc(cc(cc1)C#N)c1F)(=O)=O,0 Z2385323292,COc1c(CNC[C@@H](CC2)O[C@@H]2c2nc(C3CC3)n[nH]2)cccc1,2 Y044-2194,Cn(cc1)c(cc2)c1cc2C(Nc1cccc(N(CCCC2)S2(=O)=O)c1)=O,2 F6441-4958,O=C(CCc(c(F)ccc1)c1Cl)N(C(CC1)C2)C1CC2S(c1ccccc1)(=O)=O,2 F6521-3841,CC(CNS(C)(=O)=O)(c1cc(cccc2)c2o1)O,0 Z4317610413,O=C(C1CCNCC1)Nc1nn(Cc2ccc(C(F)(F)F)cc2)cn1,2 F1177-0082,COc(cc1)ccc1C1=CC(c2cccs2)n2ncnc2N1,2 S903-0331,CN(C)C(N(CC1)CCC1c1nnc2n1CCN(Cc1cn(C)nc1)C2)=O,2 Z1408699956,CC(CCC1C)N1C(c1c(c(C)n[nH]2)c2nc(C)c1)=O,0 Z4908742172,CC(C)c1c(CNC(CC2OCCCC2(C)C)=O)cccc1,2 F6756-2490,O=C(C(CN(C1)c(cc2)nn3c2nnc3C(F)(F)F)C1C1=O)N1c1ccccc1,2 F6442-1777,CC(C)CS(C(C1)CN1C(c1cc(cc(cc2)F)c2s1)=O)(=O)=O,0 F0594-0401,O=C(CSc1nnc(-c(cccc2)c2Cl)o1)N(CCC1)c2c1cccc2,2 C137-2401,CCN(c(cc1)ccc1F)S(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O,0 C325-0481,Cc1cc(C)nc2nc(-c(cc(cc3)Br)c3O)c(Nc3cc(C(F)(F)F)ccc3)n12,2 Z2768784626,CCC(CC)NC(c1nnc2n1CCCCCC2)=O,0 F6246-1701,COc1cc(CN(C2=O)N=C(C3CC3)N2c2ccccc2)cc(OC)c1,2 G868-1516,CC(C)c1cc(S(N(CC2)CCN2c2nc(N3CCN(C)CC3)cc(C)n2)(=O)=O)c(C)cc1,0 Z2434674169,OC(c(cc1)cc(CC2)c1N2S(CCOCC1CCC1)(=O)=O)=O,2 F2434-1474,O=C(c1ncc(-c(cc2)ccc2Cl)o1)NCCN1N=CC=CC1=O,2 F6793-7472,CCn1c(C)nc(S(N2CCN(CC(F)(F)F)CC2)(=O)=O)c1,0 F3243-0982,CC(C)c(ccc(C)c1)c1OCCn1c(cccc2)c2nc1C(C1)CN(CC=C)C1=O,0 F6481-1847,O=C(c(cccc1)c1Br)N(CC1)CCSC1c(cc1)cc2c1OCO2,0 F5606-0124,CN1CCN(Cc(cc2)ccc2NC(Nc(cc2)ccc2OC)=O)CC1,0 Z3080986610,CCN(C(c1nn(C)c(C(F)(F)F)c1)=O)c1ccncc1,0 F5854-0414,O=S(c1cccs1)(N(CCc1ccccc1)Cc1ncccc1)=O,2 Z1606879444,Cc1cc(C(Nc(cc2)ccc2OC(F)F)=O)nn1-c(cc1)ccc1F,0 Z1445066739,Cn1nccc1C(Nc1cccc(-n(cc2)nc2C(O)=O)c1)=O,2 Z1670037579,O=C(CCn1ncc(Br)c1)Nc1c(CN(C2)C3CC3)c2ccc1,0 F2831-0616,CC(C)S(c(cc1)ccc1C(Nc(cc1)cc2c1scc2)=O)(=O)=O,0 F6604-7619,N#Cc1cc(CCC2)c2nc1N1CC(CN2N=C(C3CC3)C=CC2=O)C1,2 Z2299430960,CC(CNC(c1c(CCCC2)c2ccc1)=O)(CC1)NC1=O,2 SA95-0288,CCn1ncc(CN(CCC2)C2c2ncc(C)n2Cc(cc2)ccc2OC)c1,0 7591-0401,CC(C)(CC(N(CC1OCCC1)C1=O)=C2C1(C(F)(F)F)NC(c1cccs1)=O)CC2=O,2 S954-5440,CN(C)C([C@@H](CN(C1)c(cc2)cc(C(F)(F)F)c2C#N)[C@H]1C(CC1)CCN1C1CCCC1)=O,0 Z748524416,Cc1nccc(C(Nc2cc(OCc3cnccc3)ccc2)=O)n1,2 Z1919529306,CC(CNc1ccccc1)NC(Nc1cc([nH]cc2)c2cc1)=O,2 C361-2192,CCC(N(CC1)c(cc2)c1cc2S(CCC(N(CCc1ccccc1)Cc1ccccc1)=O)(=O)=O)=O,2 Z3141932034,NC(C1)C1(C1)CC1NC(c1c(COCC2)c2ccc1)=O,2 SB14-1288,Cc1nn(C)c(CN(CC2)CC2N(C2CCOCC2)C(COC)=O)c1,2 Z3083605320,CCn1ncc(Br)c1C(N(C)c1cc(C)ncc1)=O,0 Z1632931120,Oc1cccc(C(NCCN(CC2)Cc3c2scc3)=O)c1,2 CM2894-6863,O=C(c(ccc(F)c1)c1Cl)N1C(Cc2noc(-c3nccnc3)n2)CCC1,2 F1524-0436,CC(C1)N(C(CSC(NC(CCC2)=C(C3c4ccc(C)o4)C2=O)=C3C#N)=O)c2c1cccc2,2 F821-0005,CC(c(cc1)ccc1NC(C(CCC1)CN1S(c(cc1)cc(N2)c1OCC2=O)(=O)=O)=O)=O,0 SB95-1133,O=C(C1CC1)N(CCN1CCOCC1)C1CN(Cc2nc3ccccc3cc2)CCC1,2 F6524-3946,Cc1noc(C(CN(C2)C(c3cn(C)nc3OC)=O)C2c2ccccc2)n1,0 F6471-8861,Cn1c(S(C(CC2)CCN2C(NC(c2ccccc2)c2ccccc2)=O)(=O)=O)ncc1,2 Z1583072943,CC(CNC(C)c(cc1)ccc1-c(cccc1)c1OC)SC,0 Z1818368135,Cc(cc1)cc(C)c1-n1ncc(NC(c2c(CCCC3)c3n[nH]2)=O)c1,2 8011-4312,CCOc(cc1)ccc1N(CC(C1)C(NCc2ccco2)=O)C1=O,0 F2879-4607,CC(c1ccccc1)NC(C(NCc1ccncc1)=O)=O,0 Y043-2155,O=C(CCn(cc1)c2c1ccc(Cl)c2)Nc(cc1)ccc1N(CCCC1)S1(=O)=O,2 Z1478187740,CC(C)c1ncc(-c2nc(-c3nnc[nH]3)no2)s1,2 F6809-6791,Cc1nc2cnccc2c(N(CC2)CCC2c2noc3c2ccc(F)c3)n1,2 S561-6575,Cc1nnc(C(CCCCC2)N2C(c2cnco2)=O)o1,2 F3225-1529,CCCc1nnc2n1c(cccc1)c1nc2N(C)S(c1ccccc1)(=O)=O,2 Z2412835007,CC(C)(CC1c2ccccc2)CN1C(NCc1nc(C)ccc1)=O,0 C130-0267,COc(cccc1)c1-c1cc(C(F)(F)F)nc(N(CC2)CCN2c2ccccc2)n1,0 D170-0262,O=C(C1(CCCC1)c1ccccc1)Nc(cc1)ccc1NC(c1ccco1)=O,0 8013-3853,Cc1c(CCNC(C2=Cc(cc(cc3)Br)c3OC2=O)=O)c(cc(cc2)OC(F)(F)F)c2[nH]1,2 Z4461556091,O=C(c1c(ccc(Cl)c2)c2ncc1)Nc(cc1)cc(F)c1F,0 Z86247295,Cc(cc1)c(C)cc1Oc1ncccc1C#N,0 Z809127930,CC(C(NCc1ccccc1)=O)NC(CCCc1c[nH]c2c1cccc2)=O,0 Y042-2550,CC(C)CN1N=C(CC(NC(CC2)c(cc3OC)c2cc3OC)=O)c(cccc2)c2C1=O,0 Z2315896745,Cc1cc(C(N(CCC2)c(cc3)c2cc3F)=O)nc(NC)n1,0 Z2233277864,CC(C)(COC1=O)C1NC(c1ccc(-c(cccc2)c2OC(F)(F)F)o1)=O,2 F0649-0006,Cc(cc1)c(C)cc1C(N(CN(CCC1)C1=O)c1ccccc1)=O,0 Z2763812724,OC(c1c(CNC(CCC2CCNCC2)=O)cccc1)=O,2 F6571-5711,CC(Cc1csc2c1cccc2)NC(c(cccn1)c1SC)=O,0 F6507-8742,OC(CNC(NC1CCCC1)=O)(CCC1)c2c1occ2,2 F6605-0225,Cc1cc(C)nn1C(C=C1)=NN(CC(C2)CN2c2nccc(C(F)(F)F)n2)C1=O,2 F5564-0189,Cc1nc(-n2nccc2)cc(Nc(cc2)ccc2NC(Cn2c(cccc3)c3nc2)=O)n1,2 K781-2489,O=C(CSc1nc(cccc2)c2[nH]1)NCCC1=CCCCC1,2 F5105-0166,O=S(Cc1cc(F)ccc1)(NCCc1cscc1)=O,0 F6108-0128,COCCN(CC1)CCC1NC(COc1cc(OC)ccc1)=O,0 Z3272937463,Cc1nn2c(N3CCN(CC(N4)=Nc(cc(C(F)(F)F)cc5)c5C4=O)CC3)cncc2n1,0 SA02-0086,Cc1noc(C)c1Cc1ccc(C(N(CC2)CCC2c2nc(C)ncc2CO)=O)o1,0 E766-0787,Cc1c(C(NCCN2CCOCC2)=O)oc(cc2)c1c1c2OC2(CCCC2)CC1O,2 F3222-4822,O=C(CSc1nccnc1N1CCSCC1)Nc(cc1)c(C(F)(F)F)cc1Cl,0 SA59-0771,O=C(CN(c(cccc1)c1O1)C1=O)N(CCN1CCCC1)C1CCOCC1,2 F1358-0768,CNC(c1c(NC(COc2ccccc2)=O)scc1)=O,0 4358-3196,CC(CC1)Cc2c1c(C(N)=O)c(NC(CCCOc(cc1)ccc1Cl)=O)s2,0 F6721-9920,COc1ccnc(N(CC2)CCN2c2cccc(Cl)c2)n1,0 Z3640785487,COC(CO)(C1)CN1C(c1cc2ccccc2c(O)c1)=O,2 S550-0615,Cc1noc(-c2cccn3c2nnc3CNC(Cc2c[nH]c3c2cccc3)=O)n1,2 Y044-5180,O=C(CC(C(Nc1c2cccc1)=O)NC2=O)N(CCC1)C1c1nc(cccc2)c2s1,2 Z1532824434,Cc(cc(cc1)C(NC2(CO)CCCC2)=O)c1-n1ncnc1,0 Z1039089750,O=S(c(cc1)ccc1Cl)(NC(CC1)CCN1c1ncnc2c1cc[nH]2)=O,2 V021-6273,CCC(C(NCC1OCCC1)=O)Oc1cc(C(c2ccc(C)cc2)N(CC2)C(C(C)C)=O)c2cc1,0 Z2710772810,CC(CN(C1)C(Nc2cc(F)c(C(F)(F)F)cc2)=O)N(C)C1=O,0 Z2971816478,OCC1(CCCCC1)NCc1cc(Cl)cc(O)c1,0 S836-0521,COC[C@@H](CN(C1)c2ncccn2)[C@H]1C(NCCn1cncc1)=O,2 Z3025256349,CC(CCC(F)(F)F)(C(O)=O)n1ncc(C)c1,0 Z1744492995,CCc1cc(C(Nc2nn(Cc(cc3)ccc3OC)cc2)=O)ncc1,2 Z358329968,Cc1cc(C(NCc2cc(Cn3cncc3)ccc2)=O)cc(C)c1,2 Z3555738426,CC(C)(CNc1nc2ncccc2cc1)CN(C)C,0 F6502-8897,Cc1cc(CCNC(c2cc(Br)cnc2)=O)nn1C,0 L799-2455,CC(C)NC(CC(CC1)CCN1S(c(cc1)cc(O2)c1N(C(C)C)C2=O)(=O)=O)=O,0 Z2460807697,OC(c1c(CN(CC2)C(CCC3OCCC3)=O)c2ccc1)=O,2 S632-4392,Cc1nn(C)c(C(N(CC2)CC2C(CC2)CCN2C(NC)=O)=O)c1,0 Z1022965572,CC(C)c1nc(C(NC2CCN(Cc3ccncc3)CC2)=O)cs1,2 G373-4054,O=C(Nc(ccc(F)c1)c1F)N1CCN(Cc2nc(cc(cc3)-c4ccccc4)c3o2)CC1,0 Z300100474,CNS(c(cc1)ccc1S(Nc1ccccc1)(=O)=O)(=O)=O,0 SB54-1028,COC[C@@H](CN(C1)S(c2cc(F)ccc2)(=O)=O)[C@H]1c1nnc(-c2ccccc2)o1,0 Z1419168374,CC1(CC1)C(Nc(cc1)cnc1N1CCOCC1)=O,0 Z510550238,CC(c(cc1)cc(C2)c1NC2=O)NC(c1cc(-c2ccccc2)nc2ccccc12)=O,2 Z3689332984,CC(CC1c2cc(OC)ccc2)CN1C(C(Nc1cnc2c(F)cccc2c1)=O)=O,2 F5562-0172,Cc(c(NC(N(CC1)CCN1c1ncnc(-n2nccc2)c1)=O)ccc1)c1F,0 D212-0348,CCOc(cc1)ccc1N(CC(C1)c2nc(cccc3)c3n2Cc2cnccc2)C1=O,2 Z4607590207,NS(c(cc1)cc(C(Nc2cc(C(CCCC3)=O)c3cc2)=O)c1Br)(=O)=O,2 SB04-0449,CN(C)C(N(CC1)CC1N(CCNC(c(nccc1)c1F)=O)C1CCOCC1)=O,0 F6543-4836,O=C(CN1Cc(cccc2)c2OCC1)NC1CCCC1,2 Z2827937119,Cc1c(CNC(N2CCCCCC2)=O)[nH]nc1,2 Z4201499738,C=CCONC(c1c(cnn2Cc3ccco3)c2nc(-c2cnccc2)c1)=O,0 Z2640164853,Cc1c(CNC(C(CCC2)N2C(c(cc2)ccc2OC)=O)=O)ocn1,0 Z2440015897,O=C(c1csc(-c2ccccc2)n1)NC1CC(CC2)NC2C1,2 F6562-0684,Cc(cc1)c(C)cc1N(CC(C1)C(N(CC2c3cn(C)nc3)Cc3c2cccc3)=O)C1=O,2 Z2347697634,COc(cc(c(N1CC(CC2)(CS2(=O)=O)CCC1)ccn1)c1c1)c1OC,0 E734-2481,O=C(c1c2nccc1)N(CCc(cc1)ccc1S(N(CC1)Cc3c1cccc3)(=O)=O)C2=O,2 Z2019806125,CC(CC(NS(c1ncc(C(F)(F)F)cc1)(=O)=O)=O)N(CCCC1)C1=O,2 F6374-0217,O=C(NCc1cccs1)N1CCC(CSc2ncccc2)CC1,2 F870-0963,COc1cccc(NC(c(cc2)ccc2Nc2ccnc(-c3cccc(F)c3)n2)=O)c1,0 Z1929751996,CC(C)(CN(C1)c2cc(C)nc(OC)n2)C1O,0 F3382-6492,COc1cc(N(C2C(N3c4cccc(Cl)c4)=O)N=NC2C3=O)cc(OC)c1,0 Z1629573572,CC(C)n1nc(C(CCC2)NC(Cc(cc3)ccc3OC)=O)c2c1,0 Z2460783570,Cn1ncc(C(N(CC2)CC2(C(O)=O)c2ccccc2)=O)c1C(F)F,0 T505-1136,CCS(N1C(CCn2nnc(C(N3CCOCC3)=O)c2)CCCC1)(=O)=O,0 V030-5782,O=C(Nc1ccccc1)N(CC1)Cc2c1nc(N1CCOCC1)nc2Oc(cc1)cc(F)c1F,0 SC70-0296,O=C(NC1CCCC1)N(C1)CC2(CCC2)C1c1n[nH]c(C2CC2)n1,2 Z1522179411,COc1cccc(CC(CCC2)N2C(NC(CCN2C3CC3)C2=O)=O)c1,0 Y205-7761,OC(C(CCCC1)C1C(Nc1c(C(NCc2ccccc2)=O)c(CCC2)c2s1)=O)=O,2 Z4444505131,C[C@@H](c(cccc1)c1F)NC(c1cn(-c(cc2)ccc2OC)nn1)=O,0 Z4995241831,NCC(C1)(CN1C(C(Cc1ccccc1)NC(c1ccco1)=O)=O)O,2 Z4662037685,CC(NCc(cc1)ccc1S(NC(CN(CCO)C1CC1)=O)(=O)=O)=O,2 Z1431780594,Cn(c(C(O)=O)c1)nc1-c1ccccc1,0 F6252-1439,O=C(C=C1)N(Cc2c(C(F)(F)F)cccc2)C=C1c1nc(-c2ccncc2)no1,2 Z2232112708,NC(C[C@@H](c1ccccc1)NC(c1c[nH]nc1-c(cc1)ccc1Cl)=O)=O,0 Z82655758,O=C(c(cc1)cc(OC2)c1NC2=O)N(CC1)CCC1=O,2 Z2378678823,O=C(CN(CCCCCC1)C1=O)Nc1ncc(C2CCNCC2)s1,2 L277-0472,CC(C)NC(c(cc1)cc2c1n(C)c(CN(CC1)CCN1C(Nc(cc1)ccc1F)=O)n2)=O,0 Z1764290943,Cc1cccc(NS(c(c(OC)c2)cc(OC)c2Br)(=O)=O)c1C,0 S454-0703,O=C(c(cc1)cc2c1[nH]cc2)N(CC1)CCC1n1nnc(-c2nc(C3CC3)no2)c1,2 F2672-0014,CN(CC1)CCN1C(CNC(c(cccc1)c1Cl)=O)c(cc1)ccc1OC,0 Z1526893403,Cn1cnc(C(N2CCC(CCc3ccccc3)CC2)=O)c1,2 F270-0582,Cc(onc12)c2C(C)=NN(CC(N(CC2)CCN2C(c2ccco2)=O)=O)C1=O,2 Z2297903407,COC(c1n[nH]c(CC2)c1CN2C(CCc(cc1)ccc1OC(F)(F)F)=O)=O,0 Y030-7464,CCC(C(Nc1nnc(C2CCCCC2)s1)=O)c1ccccc1,0 Z4510271923,C(Cc1n[nH]nn1)CN(CC1)CCN1c1nsc2c1cccc2,2 F5831-0456,Cn(cc1C(NCCC(CCCC2)N2S(c2cccs2)(=O)=O)=O)nc1OC,2 T505-1524,CCOCC(N1C(CCn2nnc(C(N3CCCC3)=O)c2)CCCC1)=O,2 Y042-6442,C1(N[C@H](C(Nc2c1cccc2)=O)CCC(Nc1cc2nc([nH]c2cc1)CCc1ccccc1)=O)=O,2 Z2896068649,Cc(ccc(CNC(C1(CCOCC1)C(O)=O)=O)c1)c1C#N,0 F6514-7660,O=C(c1cccc(Oc(cc2)ccc2F)c1)NCCn1nccn1,2 J005-1051,CCc1noc(C(CCC2)N2S(c(cc2)cc(Cl)c2F)(=O)=O)c1,0 F6553-0336,O=S(c(cc1)cc2c1OCCCO2)(N(CC1)CC1c1cccs1)=O,2 Z901089962,CC(C)N(C)CC(NCc(cccc1)c1-n1cncc1)=O,0 SA49-0181,Cn(cc1)nc1C(N(C1)CC11OCC(CC(NCC2CC2)=O)C1)=O,2 SC72-1280,Cc1nc(COC2(C3)CN3C(c3cc(OC)cc(OC)c3)=O)c2cn1,0 F6809-7409,NC(C(CCCC1)N1c1nc(ccc(F)c2)c2o1)=O,0 Y044-4618,O=C(CCC(C(Nc1c2cccc1)=O)NC2=O)NCc1nc(-c(cccc2)c2Cl)no1,2 SB69-0071,CO[C@@H](Cc1c2)Cn1nc2C(N(CC1)c2c1cccc2)=O,2 8010-0261,CC(c1c(C)c(c(O2)c(cc3)C(C)=CC2=O)c3o1)O,2 F118-0112,COCCCNC(CN1c(cc(cc2)C(N3CCCC3)=O)c2OCC1=O)=O,2 F6258-1461,O=C1N(CCNS(c(cccc2)c2F)(=O)=O)C=NC(C2CC2)=C1,2 F5832-3900,Cc1cccc(CS(NCC(c2ccccc2)N(C)C)(=O)=O)c1,0 5591-3219,CCC(C)(C)C(CC1)Cc2c1oc(cc1)c2cc1NS(c(cc1)ccc1OCC)(=O)=O,0 Z1144847903,Cc(cccc1)c1C(N1CC(c(c(Cl)c2)cc(F)c2Cl)OCC1)=O,0 S570-0595,Cc1c(C(NCC2(CCC(N3CCOC)=O)C3=CCCC2)=O)scc1,0 Z951282898,Cc1cccc(CSC(N2)=Nc3nc(C)cc(C(OC)=O)c3C2=O)c1,0 Z2974059068,COc1ccc(CCNC(N(CC2)CCC2=C)=O)c(Cl)c1OC,2 S990-0772,Cc1noc(C(CCN(CC2)S(C)(=O)=O)N2C(c2ccccc2)=O)n1,0 P725-0252,O=C(Cc1cscc1)N(CC1)c(cc2)c1cc2-c1csc(C2CC2)n1,2 F6726-4564,Cc1nccc(N(CC2)CCN2c(ncnc2-c(cc3)ccc3OC)c2F)n1,2 Y031-6492,CC(C)Cc1nnc(NC(C(CC2)CCN2C(N(C)C)=O)=O)s1,0 CM4232-1477,CC(C)N(CC1)CC1c1nnc(CC2)n1CCN2C(c(cc1)ccc1Cl)=O,2 Z2955169190,CC(C)(C)c1cc(CN(CC(NC2)=O)C2c2ccccc2)no1,2 S904-1063,CC(C)n1ncc(CN(C[C@H](C2)O)[C@@H]2c2nnc3n2CCN(C)C3)c1,0 F6554-8423,O=C(Cc1cc(C(F)(F)F)ccc1)N1C(C2)CSC2C1,0 F2883-0004,CC(C)CCSc1ncc(CO)n1Cc1ccc(C)cc1,0 G545-1030,O=C(c(cc1)cc(NC(NCc2ccco2)=O)c1N1CCCC1)NCc1cccc(F)c1,2 F6438-0340,Cc(c(NC(Nc1c(C)nc(N(C)C)nc1C)=O)ccc1)c1F,0 G944-0735,C(CC1)CC1n1nnc2c1ccc(-c1noc(/C=C/c3ccccc3)n1)c2,2 F6390-2728,Cc1cc(C(N(Cc2ccco2)C2CCOCC2)=O)no1,2 E781-0273,CC(CC(C)C1)CN1c1nc(n(C)nc2)c2c(Nc(cc2)cc(Cl)c2OC)n1,0 SB71-0704,Cn1c(cccc2)c2c(CN2Cc3cc(C(NC4CCCC4)=O)nn3CC2)c1,2 SC66-0290,CC(C)Cn1c(C(CN(C2)C(CN(c(cccc3)c3O3)C3=O)=O)C22CCOCC2)nnc1,2 F6194-1459,CC(Cc1cscc1)(CNC(Nc(cccc1)c1Cl)=O)O,0 S639-0601,CN(C)C[C@@H](CN(C1)c2ncncc2)[C@H]1NC(c1nn(C)c2c1cccc2)=O,0 Z1589208880,CC(NC1(CCCCC1)C(NC1C(c(cc2)ccc2Cl)OCC1)=O)=O,2 F6791-5002,CC(C)(C)c1nc(SC)nc(NCc2ncccc2)c1,2 F5791-0249,O=C(C(C=C1)=CNC1=O)NC(CCC1)c2c1cccc2,2 Y044-3739,CC(N1CCCC(Nc(cc2)cc(C(N3C4CCC3)=O)c2NC4=O)=O)=CC(O)=CC1=O,2 F5787-0922,O=C(CSc1ncnc(-c(cc2)ccc2F)c1)NCc(cc1)cc2c1OCO2,2 S915-0025,CO[C@@H](C[C@H]1CN(C2)C(c(cc3)cc(F)c3OC)=O)CN1C2=O,2 V018-9631,CC(C)CC(NC(C(CC1)CCN1C(c1cccs1)=O)C(N1CCCCC1)=O)=O,2 F5264-0357,COc(cccc1)c1N1CCN(CCNC(c2ccc(C(F)(F)F)cc2)=O)CC1,0 Z1445481299,CC(C)(CNC(c1c(C(F)(F)F)n(-c(cc2)ccc2F)nc1)=O)C(O)=O,0 F6480-3122,Cc1nc(OC(CCC2)CN2C(Cc2cc(OC)ccc2)=O)nc(C)c1,0 Z1172492751,O=C(c1ccc(-c2ccccc2)[nH]1)NCc1cnccc1,0 Z2637398425,CCON1CCC(CC(N2CC(C)C2)=O)CC1,2 F6529-0481,CN(c(cccc1)c1N1C2CCN(CC(OCc3ccccc3)=O)CC2)S1(=O)=O,2 Z2439544919,CC(c1ccccc1)n1ncc(NC(N(CC2)CCN2c2ncccn2)=O)c1,2 Y043-3654,Cc1nc(Nc2cccc(C(Nc(cc3)ccc3N(CCC3)S3(=O)=O)=O)c2)nc(C)c1,2 SA46-0461,CC1(CCCCC1)C(N(C1)CC1(C1)OCC1N(C)Cc1ccccc1)=O,2 3807-5864,CC(CC1N(C(c2cccc(Br)c2)=O)c2ccccc2)Nc2c1cccc2,2 Z2626780490,O=C(C(CC1)c(cc2)c1cc2F)N(CCCN1)CC1=O,2 F6216-0255,Cc1noc(CCCNC(C2(CCCC2)c2cccs2)=O)c1,2 F3394-1355,O=S(c1cc(C(F)(F)F)ccc1)(NCc1ncccc1)=O,0 Z2179811472,O=S(c1c(N(CCC2)CC2F)nccc1)(N1CCCCC1)=O,2 F6796-0541,COCCn1c(ncnc2NCc(cc3)ccc3Br)c2nc1,0 Z1921210291,OC(CC1CC2)CC2N1C(NCc(c(F)c1)cc(F)c1Cl)=O,0 F6223-0217,CS(Nc1cnc(N(CC2)CCN2c2ccccc2)nc1)(=O)=O,0 Z2349337160,OC1(COCC1)C(N1C[C@H](c(cc2)ccc2Cl)OCC1)=O,2 S350-0092,O=C(CN(C(CO1)=C(C(c(cc2)ccc2Cl)N2)C1=O)C2=O)Nc(cc1)cc2c1OCCO2,0 Z2232109053,NC(C[C@@H](c1ccccc1)NC(c1c[nH]cc1-c(cc1)ccc1F)=O)=O,0 S740-0730,Cc1noc(C)c1CC(N[C@@H](C1)CN(CCS(N2CCOC)(=O)=O)[C@@H]1C2=O)=O,2 F5876-0188,Cc1c(C(NCCOc2cccc3cccnc23)=O)sc(C)n1,2 F6562-7301,COc1cccc(NC(N(CC2)CCC2N(C(COC2)=O)C2=O)=O)c1,0 F6521-4029,CC(CNC(C(NCc(cccc1)c1OC)=O)=O)(c1cc(cccc2)c2o1)O,0 Z2951219878,Cc1cccc(C(CN[C@@H]2[C@@H](c3n[nH]cc3)OCC2)O)c1,2 Z2982757703,CN(C)C(NCc1cn(-c(cc(C(F)(F)F)cc2)c2Cl)nn1)=O,0 Z1583443325,O=C(c(cn1)ncc1Oc1ccccc1)NC1CCN(CC2CC2)CC1,2 F6252-1880,CCOC(c(cccc1)c1NC(c1cn(CC(c(cccc2)c2F)O)nn1)=O)=O,0 Z1821283029,Cc1c(C(NCC(CC2)CCC2C(F)(F)F)=O)snn1,0 F6807-5388,COc(cc(CCN(CCCC=C)C1)c1c1)c1OC,0 F6438-0032,Cc1nc(N(C)C)nc(C)c1NC(c(ccc(F)c1)c1Cl)=O,0 G810-0167,O=C(c1ccccc1)N(CC1)c2c1cc(CNS(c(cc1)cc(CC3)c1NC3=O)(=O)=O)cc2,2 V001-6082,CCC(Nc(cc1)cc(C(N2CCCCC2)=O)c1N(CC1)CCN1C(C1CCCC1)=O)=O,2 SA68-0922,Cc1cc(C)nn1CC(NCCN(C(CC1)CCN1C(C1CC1)=O)C1CCOCC1)=O,0 F6089-7697,O=S(c(s1)ccc1Br)(N(Cc1cscc1)C1CC1)=O,2 F6795-3532,Cc1c(C)nc(cc2)n1nc2N(CC1)CCN1c1nc(C2CC2)ncc1,2 Z1542401846,CCc1ccc([C@H](C)NC(C(C=CC2=NN3)=CN2C3=O)=O)cc1,0 Z743481348,[O-][N+](c(cc1)cc2c1oc(C(Nc1cc(-c3nnn[nH]3)ccc1)=O)c2)=O,0 Z4662013012,N#Cc(cc1)cnc1N1CCC(COc2ncc(C(F)(F)F)cc2)CC1,0 Z1780870438,CC(C1)C1C(Nc1c(C(F)(F)F)n(C)nc1)=O,0 K261-2641,COc(ccc(N(C(N(Cc(cc1)ccc1Br)c1c2cccc1)=O)S2(=O)=O)c1)c1OC,0 V001-2973,O=C(c1coc(CN(Cc2ccccc2)Cc(cccc2)c2Cl)n1)NCC1OCCC1,0 SC19-0641,CCn1nc(CN(CC2)CCC2NC(c2nccnc2)=O)c2c1CCOC2,2 SB91-1434,CN(C)S(N(CCN1CCCC1)C(CC1)CN1C(Nc(cc(cc1)F)c1F)=O)(=O)=O,0 F6529-0174,CN(c(cccc1)c1N1C(CC2)CCN2C(c(cccc2)c2C(OC)=O)=O)S1(=O)=O,2 Z1435714626,CC1N(CCC(CC2)CCN2C(NCCc(cc2)ccc2O)=O)CCCC1,2 Z1538964887,Cc1cc(C)c(C(N2CCN(Cc3nc(cccc4)c4[nH]3)CC2)=O)c(C)c1,0 Y042-7466,O=C(CC1(CCOCC1)n1cccc1)Nc(cc1)ccc1N(CCC1)S1(=O)=O,2 SC08-0086,CS(N(CC1)CCC1c1noc(C(C2)CN2C(C2(CC2)c2ccccc2)=O)n1)(=O)=O,2 Z2054582792,Cc1nnc(CN(C2)[C@H](COc3cnccc3)C[C@H]2OC)n1C1CC1,2 V024-1980,COCCN(Cc(n1CC2OCCC2)cnc1S(Cc(cccc1)c1F)(=O)=O)C(C1CCCC1)=O,0 V028-2808,CCNC(N(Cc(n1CC2OCCC2)cnc1S(Cc(cc1)ccc1F)(=O)=O)Cc1ccco1)=O,0 Z2974469662,CC(C)Cc1csc2nc(C)nc(N(C3)CC3c3n[nH]c(C)n3)c12,2 Z3408498851,Cc1n[nH]c(CC2)c1CC2C(NCC1CCCC1)=O,0 8018-4764,CN(CC1)CCC11NCCc2c1[nH]c(cc1)c2cc1OC,0 F980-0321,O=C(c(cc1)cc(Cl)c1F)N(CC1)CCN1C(C=C1)=NN(c(cc2)ccc2F)C1=O,0 F6556-5176,CS(c1ccc(CCC(N(CCC2)CCN2C2CCSCC2)=O)cc1)(=O)=O,0 C085-0880,CC(C1)OC(C)CN1S(c(cc(cc1)OC)c1OC)(=O)=O,0 F5023-0132,Cc(s1)ccc1S(NCCCN1CC(c2ccccc2)OCC1)(=O)=O,2 F6451-0024,COC(CNC(c1ncccc1)=O)c(cccc1)c1OC,0 F6798-4949,CC(N=C(NC1=O)N2CC(CN(C3)c4nc(CCOC5)c5cc4C#N)C3C2)=C1F,2 Z2445715134,Cc1cccc2c1NC1(CC3(CC3)N(Cc3ccccc3)CC1)NC2=O,0 Y200-6021,CC(CC1)Cc2c1c(C(Nc(cc1)ccc1Cl)=O)c(NC(COCC(O)=O)=O)s2,0 Z2073696666,O=C(Cc(cc1)ccc1Br)NS(c1csc2c1cccc2)(=O)=O,0 F6363-0390,O=S(c(cccc1)c1F)(Nc(cn1)cnc1Oc1ccccc1)=O,2 Z1193728526,CC(CCC1)(CN1C(Nc(cc1)cnc1N1CCOCC1)=O)c1ccccc1,2 S556-0428,O=C(C1CC1)N(C1)CC1Oc(cc1)ccc1-c1noc(C2CC2)n1,2 Z3254876945,OC1(CN(C=Nc(c2ccc3)c3F)C2=O)COCCC1,0 F6451-0236,COC(CNC(N(CCN1)C1=O)=O)c(cccc1)c1OC,0 Z2843387007,CC(C)c(cc1)ccc1-c1nc(CC(NCc2cn(C3CCC3)nn2)=O)cs1,2 S381-0103,COc(cc1)ccc1C(N(CCC1)CC1(C(N1Cc(cc2)ccc2Cl)=O)NC1=O)=O,0 4725-0402,Cc(cc1)cc(C)c1C(CC(c(cccc1)c1N1CCc2ccccc2)(C1=O)O)=O,0 Z1738126513,O[C@@H](CCNS(CC(CCC1)CN1C(OCc1ccccc1)=O)(=O)=O)C(O)=O,0 Z3141421754,Cn1ncc(-c2c(C(N(C[C@@H]3CC4)C[C@@]34N)=O)occ2)c1,2 F5531-0320,CC(N1c(cc2)ccc2F)=Nc(ccc(NS(Cc2ccccc2)(=O)=O)c2)c2C1=O,2 F2661-0156,O=C(C(Nc(cc1)cc(Cl)c1F)=O)NCC(c1cccs1)N(CC1)c2c1cccc2,0 F6430-0350,Cc(cccc1)c1-c(cc1)nnc1N(CCC1)CC1C(Nc1ncnc(-n2nccc2)c1)=O,2 F6733-0055,Fc1c(NCc2cnccc2)ncnc1-c1ccccc1,2 Y031-4732,O=C(C(CC1=O)CN1c(cc1)ccc1Cl)Nc1ncccn1,0 Y042-2520,COc1cc(CCC2NC(CN(C(C=C3)=O)N=C3c3ccco3)=O)c2cc1OC,2 F5644-0029,Cc(cc1)nnc1Oc(cc1)ccc1N(C)C(c1c(C(F)(F)F)cccc1)=O,0 SB75-1375,CCS(N[C@H](C[C@H]1CN(C2)C(NCCC(C)C)=O)C[C@]12c1nc(C)no1)(=O)=O,0 F5234-0204,Cc1cccc(Nc(cc2)nnc2N(CC2)CCN2C(Cn2c(cccc3)c3nc2)=O)n1,2 F6514-1616,CC(N1CCNC(c2ccncc2)=O)=CC(OC)=CC1=O,2 Z2185711060,Cc(c(C#N)c1)nc(N2CCN(CC(C3CC3)O)CC2)c1Cl,2 Y041-6486,O=C(COc(cc1)cc2c1occ2C(c(cc1)ccc1Cl)=O)NC(CC1)CS1(=O)=O,2 F536-0149,COc(cc1)cc(OC)c1C(N(CC1)CCN1S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O)=O,0 F6443-5172,CN(C(C=C1)=O)N=C1C(N(CCC1)CC1(c1c2cccc1)OC2=O)=O,2 Z1558702828,CN(CC1CCOCC1)C(NC1c(cccc2)c2OCCC1)=O,2 F6574-1064,COc(cccc1)c1C(NC(CC1)CCC1n1nccc1)=O,0 F5580-2932,O=C(c1c2cccc1)N(CCn1nnc(C3CC3)c1)C2=O,2 G747-0475,CCN(CC1)CCN1C(c(cc1)ccc1Cl)C(C(N(Cc1cnccc1)C(C)=C1)=O)=C1O,0 F6403-1054,O=C(NC(c1ccccc1)c1ccccc1)N(Cc1cnc2n1cccc2)c1ccccc1,2 K906-1150,CCC(N(C(C)C1)c(cc2)c1cc2S(NCc1cnccc1)(=O)=O)=O,2 SC55-1471,CN(C1)CC(C2)(CN2C(Nc(cccc2)c2Br)=O)C1c1nc(C2CC2)n[nH]1,0 Z53021838,CC(C1CC1)N(Cc1ccccc1)S(c(cc1)ccc1C(O)=O)(=O)=O,2 Z4138096917,O[C@H]([C@@H](C[C@@H]1C2)CN2C(Nc2nc(CCCC3)c3s2)=O)[C@H]1O,2 F6262-3546,CC(C)(C)NC(Nc1ncnc(OCc(cccc2)c2OC)c1)=O,2 L385-0459,Cc(cc1)ccc1C(C1)=Nc2cccnc2N(CC(Nc2cc(CCC3)c3cc2)=O)C1=O,2 Z3950972749,C[C@H]([C@H](CO)NC(c(ccc(C)c1)c1F)=O)O,0 SB36-0164,Cc1nn(C)c(C(N(C2)[C@H](Cn3nnc(C(NC)=O)c3)CC2(F)F)=O)c1,2 S431-0092,O=C(c1cscc1)N(CC1)CCC1(C1)OCCC1N1CCOCC1,2 S923-0887,CCC(N(CCCC1)C1c1nnc(CC2)n1CCN2C(c1c(C)ccs1)=O)=O,0 Z4512547831,CC(Nc(cc(c(S(N(CCC(O)=O)Cc1cc(C)ccc1)(=O)=O)c1)OC)c1Cl)=O,0 F2964-2330,COc(cc1)ccc1-c(n1Cc2ccco2)cnc1SCC(N(CC1)c2c1cccc2)=O,2 S637-3162,Cc1nnc(CC2)n1CCC2N(C)C(c1ncc(C)nc1)=O,2 F2991-0348,CCOC(N(CC1)Cc2c1nc(NC(Cc(cc1)ccc1OCC)=O)s2)=O,2 SB49-1084,Cc1noc(C)c1CCC(N(CCCC12CCOCC2)C1C(N)=O)=O,2 F6471-2796,O=C(c1cc(-c(cc2)ccc2F)n[nH]1)N1C2C=CCC1CC2,2 Z1521791565,CCS(c1ccc(CCC(N(CCNC(C2)=O)C2c2ccccc2)=O)cc1)(=O)=O,2 Z2323285572,CC(C)c1c(C(N(CCCN2)C(Cc3ccccc3)C2=O)=O)occ1,0 Z2353316264,OC(c1c(C(CC2)CCN2C(NCCc2cc(O)ccc2)=O)cccc1)=O,2 F6573-0162,Cc1noc(C)c1CCC(NCc(cc1)cnc1-c1ccnn1C)=O,2 Z2092872624,CCc(ccc(NC(C(C1)CN(C)C1=O)=O)c1)c1Cl,0 Z2456172067,O=C(c1cn(C2CCC2)nn1)N(CC1)Cc(nc2)c1n2-c1ccccc1,0 E612-1028,CC(C)CC(C(NCc1ccc(CN2CCOCC2)o1)=O)N(Cc1c2cccc1)C2=O,0 Z1444808565,Cc1c(C(Nc(c2ccccc22)ccc2OCC(O)=O)=O)scc1,2 Z2098990433,O=C(c1csc2c1CCCC2)Nc1c(CNC2=O)c2ccc1,2 Z3173790456,OC(C[C@H](CCC1)N1C(C(CC1)CCN1c1nc(cccc2)c2s1)=O)=O,2 Z2596727247,CC(CN(C1)C(c2cc(OCC(O)=O)ccc2)=O)OC1C(F)(F)F,0 F2147-0557,CC(C)(C)OC(N(CC1)CCN1c(c1ccncc11)ccc1N)=O,2 Z1324757674,CC(c(cc1)ccc1-c1cnccc1)NC(C(CC1)CCN1C(C)=O)=O,2 8019-8182,NC(COc1ccc(C(C2)c(sc(C(O)=O)c3-c4ccccc4)c3NC2=O)cc1)=O,0 SB73-0825,CS(N(CC1)C[C@]1(C[C@@H](C(NCc1ccc(C(F)(F)F)cc1)=O)N1)C1=O)(=O)=O,0 F5775-0087,O=C(Cc(cc1)ccc1F)Nc(cccc1)c1NC(c1c(C(F)(F)F)cccc1)=O,0 F5939-3522,O=S(c(cccc1)c1F)(N(CC1)CCC1Oc(sc1ccc2)nc1c2Cl)=O,0 F6240-5064,O=C(c1nccnc1)NC1(CCCCC1)c1nc(-c2nccnc2)no1,2 Z3078012719,Cc1nc(S(C)(=O)=O)nc(N2[C@@H](CCC3)[C@@H]3CC2)c1,2 Y010-1536,CC(C(C(c(cc1)cc(OC)c1O)N(C1=O)c(cc2)ncc2Br)=C1O)=O,2 P223-1237,COCCN(CCCn1nc(C2CNCCC2)cc11)C1=O,0 Z1409643590,O=C(C1CN(CC(F)(F)F)CCC1)NC(CC1)CN1c(nccc1)c1Cl,2 F2508-0419,Cc1nnc(cc2)n1nc2-c1cccc(NC(CC(c2ccccc2)c2ccccc2)=O)c1,2 F510-0106,C=CCNC(CN1c(cc(cc2)C(N3CCCC3)=O)c2SCC1=O)=O,0 F6360-9634,O=S(Cc(cc(cc1)F)c1F)(N(C1)CC1Oc1cnccc1)=O,2 Z2066018880,OC(Cc(cc1)ccc1NS(c1csc2c1cccc2)(=O)=O)=O,0 Z2172305444,CCC(C)(c1noc(-c(cc2)cnc2C#N)n1)OC,0 F6677-2390,CC(C)(C)c(cc1)ccc1S(N1CC(Cn2ncc(C)c2)C1)(=O)=O,0 F6359-0420,COc1cccc2c1oc(C(N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1)=O)c2,0 SC08-0044,CS(N(CC1)CCC1c1noc(C(C2)CN2S(c2cc(F)ccc2)(=O)=O)n1)(=O)=O,2 F6680-2527,O=C(c1cc(Br)cnc1)N(CCN1c2cc(C(F)(F)F)ncc2)CC1=O,2 Y502-9378,Cn1ncc(N(C([C@H]2[C@@H]3CCCC2)=O)C3=O)c1C(NCc1ccco1)=O,2 F6414-1033,OC(CNC(Cc1cccs1)=O)(CC1)Cc2c1cccc2,2 Y207-0910,CC(CC1)Cc2c1sc(C(Nc1nnc(C(F)(F)F)s1)=O)c2,0 F2730-0582,Cc1cc(C(Nc2nc(c(SC)ccc3)c3s2)=O)c(C)o1,0 SB73-0808,Cc(cc1)cc2c1[nH]cc2CCNC([C@H](C[C@@]1(CC2)CN2S(C)(=O)=O)NC1=O)=O,0 2389-2048,CC(C)CC(C(Nc(cccc1)c1C(N)=O)=O)N(C(c1c2cccc1)=O)C2=O,0 T990-2346,CCc(cccc1)c1S(N(CC1)CCN1C(CCN1CCOC)C1=O)(=O)=O,0 F707-3549,O=C(C(CC1)CCN1c(cc1)nn2c1nnc2)NCCN(CC1)CCN1c1cccc(Cl)c1,2 F0916-7648,Cc1nc(N(CC2)CCN2c(cccc2)c2F)c(c(CCC2)c2s2)c2n1,2 Z2439299528,O=C(Cc(cc1)nn1-c1ccccc1)N(CC1)CCC1C1CNCC1,2 SD61-0328,O=C(Cc(cc1)ccc1F)N(C1)CC2(CCC2)C1C(NCc1ncccc1)=O,2 Z3404184061,CC1CC(C)(CS(N(CC2)CCN2c(cc2)ncc2C#N)(=O)=O)C1,2 C636-1596,O=C(CC(C(N1c2ccccc2)=O)N(Cc2ccco2)C1=O)Nc(cc1)ccc1F,0 F5033-2769,CC(C)(C)NC(N1CCC(CNC(Nc2ccc(C(F)(F)F)cc2)=O)CC1)=O,0 F6491-1935,COc1ccc(CCC(N(CCC2)CC2Oc2nc(OC)cnc2)=O)cc1,0 4237-0542,Cn1c(cccc2)c2c(C#N)c1CNc(cc1)ccc1C(O)=O,2 F5857-6972,Cc(cc1)c(C)cc1N(CC(C1)C(NCCC(c2ccccc2)O)=O)C1=O,0 F3386-4915,CCN(c1cc(C)ccc1)S(c(cc(cc1)Br)c1OC)(=O)=O,0 F6558-0385,CC(C)(C)C(CN1)C(C(Nc2c(C)ccnc2)=O)C1=O,2 F6543-1497,Cn1nc(C(CC2)CCN2c(nc2)ncc2Cl)cc1,2 Z1419100037,CC(C)N(CC1)CCC1NC(Cn1nnc(C2CC2)c1)=O,2 M337-0163,Cc1nnc(-c2cc(n(CC(N(CC3)CCN3C(c3ccco3)=O)=O)cc3)c3cc2)o1,2 Z805500918,Cc1noc(C2CCN(CC(N(C)Cc(s3)ccc3Cl)=O)CC2)n1,2 SA93-0418,CCn1ncc(C(N(CCC2)CC2(CC2CC2)C(N)=O)=O)c1,2 Z3083674732,CC(Nc1cccnc1NC(c1c(C(F)F)nc(C2CC2)o1)=O)=O,2 F6438-1731,O=S(Cc1ccccc1)(NCc1nc(N2CCOCC2)ncc1)=O,2 Z1334110922,CC(CC(N(CC1)CCC1C(C)(C(N1)=O)NC1=O)=O)n1nc(C)cc1C,2 F6400-0189,CN(C)CC(CSCCC1)N1C(c(o1)ccc1Br)=O,2 F6799-8507,Cn1ncc2c1ncnc2N1Cc2nnc(C(F)(F)F)n2CC1,2 J006-1945,Cc1noc(C)c1C1N(Cc2cnccc2)CCC1,0 F6573-7679,O=C(CN(CC1)S(c2cc(C(F)(F)F)ccc2)(=O)=O)N1c1cnccc1,0 P859-1244,Cc1c(C(N2CCCCC2)=O)nc(C)n1C(CC1)CCN1S(C)(=O)=O,2 Z3009182430,Cc1cc(S(N2CCN(CCc3ccncc3)CC2)(=O)=O)c(C)o1,2 F6363-0715,Cc1nc(-n2cccc2)cc(N(CC2)CCN2C(c2cnccc2)=O)n1,2 F5792-0434,O=C(c1nc(cccc2)c2s1)N(CC1)CCN1C(SC1)=NN=C1c1ccccc1,2 G008-5396,Cc1c(-c(cc2)cc(S(N(CC3)CC3c(cc(cc3)OC)c3OC)(=O)=O)c2OC)onc1C,0 Z1098460582,CC(c(cc1)cc(C2)c1N(C)C2=O)NC(c1c(COc2ccccc2)cco1)=O,2 Z3203906954,CC1(CC1)C(NCc1cc(cncc2)c2o1)=O,0 F2749-0089,O=C(CCN(C(c1c2cccc1)=O)S2(=O)=O)NCCC1=CCCCC1,2 E632-0360,O=C(Nc(ccc(Br)c1)c1F)N1CCC(CN2CCCCCC2)CC1,2 Y205-7847,CCC(CC1)Cc2c1c(C(NC1CC1)=O)c(NC(CC(C)CC(O)=O)=O)s2,0 6948-4540,O=C(Cn1c(cccc2)c2c(C(c2ccco2)=O)c1)NCC1OCCC1,2 C201-1397,O=C(CSc(c1ccccc11)nnc1N1CCOCC1)N(CC1)Cc2c1cccc2,2 F3406-4385,Cc1cc(SCC(N(CC2)CCN2c2ccccc2)=O)nc(-c(cc2)ccc2F)n1,2 Z1563129642,Cc(onc1)c1NS(c1cccc(Cl)c1Cl)(=O)=O,0 SC46-0481,CC(C)c1n[nH]c(C(C2)C3(CCCC3)CN2C(c2n[nH]c3c2cccc3)=O)n1,2 C852-0543,O=C(c1ccc(CNC(C(C2=O)=O)=C2NC2CCCCC2)cc1)NC1CCCCCCC1,2 Z1647621215,Cc1nonc1NC(C1SCCCC1)=O,2 J500-0858,CN(C)C(C(C1)C2(CCCC2)CN1C(Nc(cc1)cc(F)c1OC)=O)=O,0 S565-1245,CCn1nc(C)c(-c2cc(C(N(CC3)Cc4c3n(C)nc4-c3nncn3C)=O)no2)c1C,2 F5570-0924,O=C(c(o1)ccc1S(N1CCCC1)(=O)=O)NCc(cccc1)c1Cl,2 Z2964095578,O[C@@H]1[C@H](CCNC(c2ncnc(N3CCOCC3)c2)=O)CCCC1,2 Z1449098396,Cc1cccc(C(CNC(c2cnc(-c3ccccc3)nc2)=O)O)c1,0 E848-0936,O=C(Cn(cc1)c(cc2)c1cc2S(N1CCCCCC1)(=O)=O)NCCC1=CCCCC1,2 C597-0763,CC1CN(CCCNC(CN(C)S(c(cc2)cc(C(N3C)=O)c2N(C)C3=O)(=O)=O)=O)CC(C)C1,2 F3406-8909,O=C(Cc1nnc(-c2cc3cccnc3cc2)o1)N(CC1)CCN1c(cccc1)c1F,2 Z1666842875,O=C(Cc1cc(COC2)c2cc1)Nc(cc1)nn1-c(nccc1)c1Cl,2 F6223-0124,O=S(c1cc2ccccc2cc1)(Nc1cnc(N2CCOCC2)nc1)=O,2 F6485-1476,O=C(c1cnc(C(F)(F)F)cc1)NC(CC1)CCC1Oc(nc1)ncc1F,0 F3382-0547,Cc(cc1)cc2c1N=C1SC(Nc(cc(cc3)Cl)c3OC)=NN1C2=O,2 S738-0339,Cc1cnc(C(C2)CN2C(C2Oc(cccc3)c3OC2)=O)n1Cc1cnccc1,2 Z2656111889,CC(C)(CC(O)=O)N(C)C(CC(c1ccccc1)NC(c1ccccc1)=O)=O,0 Z2376925942,CC(CC(C1)C(O)=O)CN1C(COCC=C)=O,0 F3237-0004,Cc1cc(S(n2cncc2)(=O)=O)c(C)c(C)c1OC,0 F6658-5519,Cc1c(C)ncnc1OCC(CC1)CCN1C(C1Oc(cccc2)c2OC1)=O,2 SD25-0252,O=C(CCC(CN(C1)C(Cc2cnccc2)=O)C11CCCCC1)NC1CC1,2 Z1348222445,OC(COc(cc1)ccc1S(Nc(cc1)cc2c1[nH]nn2)(=O)=O)=O,2 F6435-7276,CC(C)(C)S(C(CC1)CN1C(Cn1nnc2c1cccc2)=O)(=O)=O,2 V021-3665,O=C(CN(C1CC1)C(C1CC1)=O)N(CCC1)CCN1c(cc1)nnc1-c(cc1)ccc1F,0 G765-0506,COc(cc1)cc(C2)c1OCC2NC(Nc(cc1)cc2c1OCCO2)=O,0 F6807-6804,Brc1c(N(CC2)CCN2c2ccccc2)nccc1,0 Z1233145110,CC(CN(c1ccccc1)S(c1cn(-c2ccc(C)cc2)nc1)(=O)=O)O,0 F6471-2557,CSc1ncccc1C(N1C2C=CCC1CC2)=O,0 F0895-0090,Cc1cccc(N(C(c(cccc23)c2c2ccc3Cl)=O)C2=O)n1,2 F6523-3265,O=C(c1cc(OC(F)(F)F)ccc1)NCCN(Cc(cc(cc1)F)c1OC1)C1=O,0 F6522-0510,O=C(NCc1cc(-c2ccco2)cs1)Nc1c(C(F)(F)F)cccc1,0 F6475-6849,O=C(c(cc1)cnc1OC1CSCC1)NCCN(C(C=C1)=O)N=C1c1ccco1,2 F6562-1346,O=C(Cc(c(F)ccc1)c1Cl)N(CC1)CC1Oc1nsnc1,0 Z2614186866,C(C(CC1)CCN1C1CCOCC1)Nc1c2sccc2ncn1,2 F6562-1283,CCOc1c(CCC(N(CC2)CC2Oc2nsnc2)=O)cccc1,0 Y031-4723,CCc1nnc(NC(c(cccc2)c2NC(C(CC2=O)CN2c2ccc(CC)cc2)=O)=O)s1,0 Z1498276915,CC(C)(CN(C)c(s1)ncc1S(N)(=O)=O)CN1CCOCC1,2 Z1746017632,CCNC(c1cc(CNC(c(cc2)cc3c2N(C)CC3)=O)ccc1)=O,0 F6791-7715,Cc1nc(CCC2)c2c(N(CC2)CCC2N(CC(N2CC(F)(F)F)=O)C2=O)n1,2 F6549-2190,O=C(c(cc1)ccc1-c1cscc1)N(C(CC1)C2)C1CC2n1nccc1,2 F6442-2837,O=C(Cn1ncc(-c(cc2)ccc2F)c1)N(C1)CC1S(c(cc1)ccc1Cl)(=O)=O,2 Z1607210008,Cc(nc(C)nc1)c1C(N(CC1)CCN1C(Cc1ccccc1)=O)=O,0 Z3674308120,CC(N(CC1)CCC1NC(NC1C(CN)CCC1)=O)=O,2 Z1401867918,CC(C)N(CC1C)CC1NC(c1c(C)onc1-c(c(F)ccc1)c1Cl)=O,2 Z1834958609,CC(C)(C)c1ccc(CC(Nc2cnns2)=O)cc1,0 Z2910674654,OC(Cc1c(C(NC(C2CCOCC2)c2ccccc2)=O)[nH]c2c1cccc2)=O,2 Y042-7753,COCCn1c(cccc2)c2c(CCCC(O)=O)c1,0 M754-1409,CCn1ncc(S(N(CCCC2)C2c2nnc(-c3ccncc3)[nH]2)(=O)=O)c1,2 Z2371524296,CC(C)n(c(C)c1)nc1NS(c(cc(C)cc1C(O)=O)c1O)(=O)=O,0 F6562-5191,Cc1cc(C(NCCN(C=CC=N2)C2=O)=O)c(C)o1,2 SA45-0040,CN(CCCC1(CC2)CCN2C(c2cc([nH]cc3)c3cc2)=O)C1C(N)=O,2 F5857-7045,Cc(c(C)c1)cc(OC)c1S(NCCC(c1ccccc1)O)(=O)=O,0 F3398-1057,Cc1cc(Oc2cc(SCC(NCc(cc3)ccc3SC)=O)ncn2)cc(C)c1,2 Z2936914676,CCOCc1nc(N(CC2)C(C)C2N(C)C)cc(C)n1,0 SD07-0975,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(c(cc2)cc(F)c2OC)=O)C2)n2nn1)=O,0 F6472-8808,COC(CC1)CCN1C(C1)CN1C(CNC(OCc1ccccc1)=O)=O,2 Z1416523005,COc1cc(NC(Nc2cnccc2)=O)cc(F)c1,0 F727-0589,Cc(cccc1)c1-c1cc(N(CC2)CCN2S(c2c(C)cccc2)(=O)=O)ncn1,0 SA93-0431,Cc1cn(CCC(N(CCC2)CC2(CC2CC2)C(N)=O)=O)nc1,0 F6491-0390,O=C(CN(CCN1c(cccc2)c2F)C1=O)N(CCC1)CC1Oc1nccnc1,2 E130-0822,CN(c(cc1)ccc1F)c1nc(-c(cccc2)c2OC2)c2c(-c2cccc(Cl)c2)n1,0 G008-1945,Cc1c(-c2cc(S(N(CC3)CCN3c3c(C)ccc(C)c3)(=O)=O)c(C)cc2)onc1C,0 F6796-8930,N#Cc1cccnc1N1CC(CN(C2)c3c(cc(cc4)F)c4ncn3)C2C1,0 F6560-8133,Cn1ncc(-c2ncc(CNC(c(o3)ccc3Br)=O)cc2)c1,2 D429-0302,Cc1ccc(C(Cc2c3ccc(C(NC4CCCCC4)=O)c2)OC3=O)cc1,2 SC88-0416,O=C(c(cc1)ncc1F)N(C1)CC1(C(CC1)c2nc(C3CCCC3)no2)S1(=O)=O,2 SC73-0160,CN(C)C(c1nn(C)c2c1COC1(CCN(Cc3cccs3)CC1)C2)=O,0 V026-4502,CC(C(NCCOC)=O)N(c(cc(cc1)Cl)c1C(N1c(cc2)ccc2F)=O)C1=O,0 Z2086985018,COc(cccc1)c1C(Nc1ncc(-c2ncccc2)s1)=O,0 T787-5265,O=C(C(CN(C1)S(c(cc2)cc(F)c2F)(=O)=O)C11CCOCC1)NC1CCCCC1,0 SA24-0183,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1c[nH]nc1-c1ccccc1)=O,0 F6570-2551,O=C(CN(c(cccc1)c1O1)C1=O)Nc(cccc1)c1-c1cn(CCCC2)c2n1,2 F6178-4479,Cc(cccc1)c1NC(NCC(CC1)CCN1c1ncccc1C#N)=O,0 F5033-3579,O=C(c1cscc1)NCC(CC1)CCN1C(Oc1ccccc1)=O,2 Z3043984678,CC1C(CNC(NC2CCCCCCC2)=O)CCNC1,2 Z2755576235,COCCOC(CC1)CN1C(c(cc1)ccc1C(O)=O)=O,0 F6349-0567,O=C(c1c(cccc2)n2nc1)N(CC1)CCN1C(c1nc(cccc2)c2s1)=O,2 F6503-4849,CCSc(cccc1)c1C(N(Cc1ccco1)Cc1nn(C)c2c1CCC2)=O,0 Z3654773689,O=C(CC1CC1)Nc1c[nH]nc1-c1nccnc1,2 F5854-2642,O=C(CN(C(CC1)=O)C1=O)N(CCc1cccs1)Cc1ccco1,2 F6559-7550,O=C(C1OCCc2c1cccc2)NC(CC1)CCN1c1nnc(CCCC2)c2c1,2 F6451-1638,Cc1c(C(CNC(CSC2CCCC2)=O)OC)cccc1,0 Z2503695265,NC1(CC1)C(NCC1(C2)C2CCCC1)=O,2 F2784-1008,COc1c(CNC(C(Nc2cccc(N(CCCC3)C3=O)c2)=O)=O)cccc1,2 Y044-4002,O=C(c1cc(cccc2)c2[nH]1)N(CC1)Cc2c1c(cccc1)c1[nH]2,2 Z1543906272,CCc1nc(-c(cc2)ccc2C(N2CCC3(CN(Cc4ccccc4)CC3)CC2)=O)n[nH]1,2 Z2771530330,CC(C)(CN(CC1)C[C@@H]1Nc1c(c(C)cs2)c2ncn1)O,2 S592-0696,COCc1nc(C(CC2)CN2C(c2nc3ccccc3cc2)=O)no1,2 Z2361647662,OC(CNS(c1ccc(C2CC2)cc1)(=O)=O)C(O)=O,0 F6443-9542,O=C(c1nc(cccc2)c2s1)NC(CC1)CN1c1ncc(C(F)(F)F)cc1,2 Z2923517684,CCc1noc(Cn2nc(C(F)(F)F)c3c2CCCC3)n1,0 F5260-0487,CN(C)C(CNC(c1cccs1)=O)c1cccn1C,0 Z1767876195,Cc1cc2c(N(CC3)CCN3C(c(cc3)cc(CCC4)c3NC4=O)=O)ncnc2s1,2 Z3844736762,O=C(C1OCC(C2)C2C1)NOCc1cnccc1,2 SB04-0244,CN(CCN(C(CC1)CN1S(C)(=O)=O)C1CCOCC1)C(COc1ccccc1)=O,0 V029-3145,CC(C)c(cc1)ccc1NC(Nc1c(C2CC2)[nH]nc1-c1ccc(C(F)(F)F)cc1)=O,0 SC96-0162,CCCN(C1(COCC1)CN(CC1)C(CCCc2c[nH]c3c2cccc3)=O)C1=O,2 S694-0634,Cc1cnc(C2CC2)n1C(CC1)CN1C(Cc1c[nH]c2c1cccc2)=O,2 F6515-4607,O=C(Cc(ccc(F)c1)c1F)NCc1cc(-c2cccs2)cnc1,2 F5788-1631,O=C(CN(CCN1c2cccc(Cl)c2)C1=O)Nc1cccc2cccnc12,0 F656-0127,Cc(c1c2N=CN(CCC(NC(CC3)CS3(=O)=O)=O)C1=O)c(C)n2-c1ccccc1,0 F6502-0451,O=S(c(cccc1)c1OC(F)(F)F)(NCCn1c(-c2ncccc2)ncc1)=O,0 F6436-1288,CN(CCOc(cc1)c2cc1NC(Cc(c(F)ccc1)c1Cl)=O)C2=O,2 J087-0355,CCC(C)NC(c1c2cccc1)=C(C(Nc1ccc(C)cc1)=O)S2(=O)=O,2 Z2736662674,COc1cc(C(N(CC2)Cc3c2ncnc3)=O)cc(OC)c1,0 F6356-0489,COc(ccc(Cl)c1)c1NC(NCCc1cocc1)=O,0 Z4635071359,CC(C)c1nn(Cc2ccccc2)c(NC(NC(CO)c(cc(cc2)F)c2F)=O)c1,2 Z2500404455,C[C@H](C(OCc1ccccc1)=O)NC(C1(C)CCCC1)=O,2 F6597-2560,Cc1nn(C)c(C(N2CCC(COc3cccc(C(F)(F)F)n3)CC2)=O)c1,2 C094-0329,CN(C(C(Nc(cc1)ccc1OC)=O)c(cc1)ccc1OC)C(CC(C(N1)=O)NC1=O)=O,2 F6573-5348,O=C(CN(C(c1c2cccc1)=O)C2=O)NCc1cnc(C2CC2)cc1,2 S646-0902,CN(C)S(N(CC1)CCC1N(CC12CCCCC2)C1c1ccncc1)(=O)=O,0 Z219422760,NC1=Nc2nc(cc3OCCCOc3c3)c3n2C(c2c[nH]nc2-c(cc2)ccc2F)N1,2 Z1954571994,NC(CC(C1)CN1C(c1c(-c2ccccc2)scn1)=O)=O,2 F6525-4907,Cc(n(CCNC(c1cnc(C(F)(F)F)cc1)=O)nc1C)c1-c1ccccc1,2 Z2838825288,CC1C(C(N(C)OCc2ccccc2)=O)c2c[nH]nc2CC1,2 V015-1969,Cc1ccc(C(c2c(CC3)ccc(OCC(NCC4OCCC4)=O)c2)N3C(C2CCCC2)=O)cc1,2 Z3388872980,CCOc(cc(cc1)C(N(C[C@H]2C)C[C@@H]2F)=O)c1OCC(O)=O,0 SC17-0020,CS(N(CC1)CCC1c1noc(CCNCc2ccc(C(F)(F)F)cc2)n1)(=O)=O,2 F6524-1251,Cc1nnc2n1ccnc2N(CC1)CCN1C(CN(CCO1)C1=O)=O,2 F5831-6874,O=C(NCC1CCN(Cc2ccco2)CC1)NCc1cccc2ccccc12,2 Z772608670,O=C(CCn1nccc1)NC1CCN(Cc(cc2)ccc2F)CC1,2 E852-0385,CC(CC1)CCC1NC(c1nn(CC(C)(C(NC2CCCCC2)=O)N(C)C2=O)c2c1)=O,2 Z1345354077,Cc1nn(CCN(C2)C(c(c(OC)c3)cc(Cl)c3Cl)=O)c2n1,2 F6675-9603,Cc1cccnc1OCC(CC1)CCN1C(CC(CSC1=NC=C2C)N1C2=O)=O,2 Z2905777222,CC(C)N(Cc1ccco1)C(c1c(CS(CC2)(=O)=O)c2nn1C)=O,2 Z1159931709,CN1CC(CNC(Cn2nc(C(F)(F)F)cc2)=O)CC1,0 F6550-4678,O=C(c1cc(Br)cs1)N(C1)CC1Nc1ncccn1,2 G856-7618,COc(ccc(Cl)c1)c1C(NC(CC1=O)CN1c(cc1)cc(OC)c1OC)=O,0 F6524-5322,O=C(c1nn(-c2ccccc2)nc1)NCc1nnc(cc2)n1nc2N1CCCC1,2 SC40-0100,COCc1c(COC(CC2)(CCN2C(c2cncnc2)=O)C2)n2nn1,2 Y042-7646,c1(nc2c(n1C(C)C)cccc2)[C@@H](NC(=O)CCCN1C(c2c(C1=O)ccnc2)=O)C(C)C,2 Z2936913931,NC(CC(CC1)CCN1S(CC[C@@H](C1)[C@H]1C1CC1)(=O)=O)=O,2 E717-0748,O=C(CN(C1=O)N=Cc2c1[nH]c1c2cccc1)N(CC1)CC1c1ccccc1,2 Z3547303755,C[C@@H](C1)[C@H](C2)[C@@]12C(N(CC1)CCC1C(NN1)=NC1=O)=O,2 Z4452031618,CC(C)([C@@H]1C(OC)=O)[C@H]1c1csc(N)n1,0 H025-0063,OC(COCCN(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Cl)=O,0 Z1130324365,Cn1ncc(S(N(CC2)CCN2c2nccc(OC)c2)(=O)=O)c1,0 Z2850856266,COc(cc1)ccc1-c1nnc(N2CC3(CCOCC3)OCC2)o1,2 Z2610529683,Cc(cc1)nnc1N(CC1)CCN1S(c(cc1)cc(N2)c1NC2=O)(=O)=O,2 Y042-3447,O=C(C(C1)CN(Cc(cccc2)c2Cl)C1=O)Nc(cc1)cc2c1OCCO2,2 Z1165946918,CCn1c(cccc2)c2nc1C(C)Nc(nc1)ncc1Br,0 Z1738890401,COc(ccc(S(NC(CCC(O)=O)Cc1ccccc1)(=O)=O)c1)c1Cl,0 F6802-9957,CS(c(cc1)ccc1N(CC1)CCC1Oc1nc2ccnn2cc1)(=O)=O,2 F3099-5419,CC(C)=CC(Nc1nc(-c2cccc(Br)c2)cs1)=O,0 Z740086344,CC(C(N(C1)c(cccc2)c2NC1=O)=O)N1CCN(CCC(C)(C)C)CC1,2 Z3343818462,CC(NCCc1cn(Cc(cc2)cc(C)c2Cl)nn1)=O,0 SB29-0171,Cc1nc([C@H](C[C@@H](C2)OC)N2C(c2cc(-c(cccc3)c3Cl)n[nH]2)=O)n[nH]1,2 F6473-8449,CC(O1)=CC(OC(CC2)CCN2S(c(cccc2)c2Br)(=O)=O)=CC1=O,0 Z1360047388,Cn1ncc2c1ncnc2N(CC1)CCN1C(C(CC(C1)C2)(CC1C1)CC12C(F)(F)F)=O,2 F6479-3447,O=C(CC1)N(CCc2c3)c2c1cc3S(N(CC1)CCC1Oc(ccnc1)c1Cl)(=O)=O,2 Z4767055442,CC(CCNC(c1ccc(Cn2ncc(Br)c2)s1)=O)N1CCCCC1,0 F3156-0024,COC(c(cccc1)c1NC(NC1(CC(C2)C3)CC3CC2C1)=O)=O,0 Z1839925344,CC(C)(C)n1nnc(C(N(C2CC3)C3c3c2cccc3)=O)c1,2 Z129011278,Cc1noc(CN2CCC(Cc3ccccc3)CC2)c1,2 E786-2075,COc(cc1)cc(OC)c1NS(c1c(CN(C(c2c3nccc2)=O)C3=O)ccc(F)c1)(=O)=O,0 F5332-0024,O=C(COc(cccc1)c1F)NCCCS(N(CC1)Cc2c1cccc2)(=O)=O,2 Z1333274455,CCc1cccc2c1[nH]cc2CC(NC(C(C1)O)c2c1cccc2)=O,0 V015-6051,CCN(CC1)CCN1C(CN(CC(N1CC)=C2C(c3c(C(F)(F)F)cccc3)NC1=O)C2=O)=O,0 F6480-4762,CC(C)(C(N(CCC1)CC1Oc(nc1)ncc1Cl)=O)Oc(cc1)ccc1Cl,0 Z733899640,Cc1nn(C)c(C(N(CC2)CCN2c2cc(OC)ccc2)=O)c1,0 Z995631514,CS(Cc1ccc(C(N2CCC(Cc3ccccc3)CC2)=O)o1)(=O)=O,0 F5490-0594,COc(nccc1)c1C(N(CCC1)CC1c1nnc(-c(cc2)cc3c2OCO3)o1)=O,2 Y020-3904,COc(cc1)cc(OC)c1N(C(CC1N(CC2)Cc3c2c(cccc2)c2[nH]3)=O)C1=O,0 F6606-2155,N#Cc1cc(CCCC2)c2nc1N1CCC(CN(C=NC(C2CC2)=C2)C2=O)CC1,2 Z3298034316,Cc(nc(C1CC1)nc1)c1C(Nc1cc(Cn2cnnc2)ccc1)=O,2 Z2958883614,O=C(c1cnc(C2CC2)s1)Nc1c[nH]nn1,2 Z4361714899,OC(C(CCC1)CCC1NC(c1csc(C2CCCCC2)c1)=O)=O,2 SA68-0777,CC(C)N(CC1)CCC1N(CCNC(C1CCCCC1)=O)C1CCOCC1,2 Z2218922788,CC(C)C(Nc1nccc(C(NCCNC(c(cc2)ccc2F)=O)=O)c1)=O,0 F6562-2398,CC(C)Sc1ccc(CC(NCc2cc(N(CCC3)C3=O)ncc2)=O)cc1,0 Y043-5701,COc(c(OC)c1)cc(C2)c1C=CN(CCC(Nc1nnc(C3OCCC3)s1)=O)C2=O,2 Z2305153827,COc1cccc(CNC(N(CC23CCC3)C2c2ccccc2)=O)n1,2 Z3016311758,Cc1n[nH]c(C(CCCC2)N2C(Cc2ccco2)=O)c1,2 Z3644771354,C[C@H](C1)O[C@@H](C)CN1C(CC1)CCN1S(N(CC1)CCC1OC)(=O)=O,0 S693-1022,Cc1cnc(-c2cnccc2)n1CC(CCC1)CN1S(c1ccccc1)(=O)=O,2 M676-0355,CC(C)C(NCc1csc(C(CCC2)CN2C(c2cocc2)=O)n1)=O,2 H025-0658C,CNc1nn2c(CCN(C)C3)c3cnc2c1S(c1ccccc1)(=O)=O,2 Z1908021185,CC(C)(C1)C1N(C)C(c1c(C)c2ccccc2nc1O)=O,2 CM4409-3794,COc(cc1)ncc1NC(C1CCn2c(C3CCOCC3)nnc2CC1)=O,2 CM2894-4191,Cc1nn(C)c(C(N2C(Cc3noc(C4CCCC4)n3)CCC2)=O)c1,2 F6519-5916,CC(C)CS(NCC(c1ccco1)n1nccc1)(=O)=O,0 S555-1763,Cc1noc(C)c1CCC(N1Cc(cc(cc2)NC(C3CC3)=O)c2OCC1)=O,2 Y041-7039,O=C(c(cc1)cc(N(CCCC2)S2(=O)=O)c1Cl)NCCc1nnc2n1cccc2,2 Z1157885210,Cc1c(C(NCc2cccc(Cl)c2)=O)nnn1-c1cccc2cnccc12,2 F6471-7253,O=C(CSC1CCCC1)NCCCc1conc1,2 F6441-8986,COC(CC1)CN1c(cc1)ccc1C(N(CC1)CCC1S(c1ccccc1)(=O)=O)=O,2 SB32-0716,COC[C@@H](CN(C1)C(COc(cc2)ccc2F)=O)[C@H]1c1nc(C2CC2)n[nH]1,2 F6682-6634,N#Cc1cc(OCC2CN(Cc(cc3)cc4c3OCCO4)CCC2)ncc1,2 Z4247264627,CCCC(C1)CC1C(NC(CCc1c[nH]nc1C(F)(F)F)C(O)=O)=O,2 F3253-0045,O=C(CSc1ncnc2ccccc12)c(cc1)ccc1F,2 F5526-0432,COc(cc1)ccc1OCC(NCCOc1cccc(C(F)(F)F)c1)=O,0 F5834-1412,CCOC(CCC(Nc1cc(N(CC2)C(c3ccco3)=O)c2cc1)=O)=O,0 F3290-0229,CC(C)(C)c(nc1SCC(NC(C)(C)C)=O)cc(C(F)(F)F)c1C#N,0 Z373585924,COc(cc(CNC(Cn1nnc2c1cccc2)=O)cc1)c1O,0 SA92-0227,COc(cc1)cc(NC(N(CCC2)CC2(c2nc(-c3ccncc3)no2)F)=O)c1OC,0 F0696-1776,O=C(C(C(N1Cc2cccs2)=O)=CNC1=O)N(CC1)CCN1c1ccccc1,2 Z2959735677,CCOC(C1)CC1(CC1)CN1C(c1cn(-c2ncccc2)nc1)=O,2 FF01-2323,Cc1cc(C)nc(N2CCCC(O)=O)c1SCC2=O,2 Z3063077163,CC(C)(C)c1nc(C)c(C(N(C[C@H]2c3ccnn3C)C[C@H]2NC(C)=O)=O)s1,0 F396-0932,CC(C)NC(CSC(N(CC(C)c1ccccc1)C1=O)=Nc2c1sc1ncccc12)=O,2 K221-3355,CCOc(c(OCC)c1)cc(C(N2CC(CC3)CCC3C(N3CCCCCC3)=O)=O)c1NC2=O,2 5312-0044,CC(C)(C1)CC(N(c2ccc(C)cc2)C(C(C(NCCc2ccccc2)=O)=C2)=O)=C2C1=O,2 SA64-0731,Cc1nn(CC(N(CC2)CCC22OCCC(CNS(C)(=O)=O)C2)=O)cc1,0 Y040-8513,CCC(c(ccc(OC(C)C(NCC(N(CC1)CC(CCCC2)C12O)=O)=O)c1C)c1O1)=CC1=O,2 8014-1642,CC(C(N(C1)c2ccc(C)cc2)=O)Oc2c1cccc2,0 C906-0929,Cc1cc(NC(C2CCC(CNC(C(C3=O)=O)=C3N3CCCCC3)CC2)=O)cc(C)c1,2 F6510-3884,Cc(c(NC(c1cc(-n2nccc2)ccc1)=O)c1)cc(N2C)c1N(C)S2(=O)=O,2 Z2483451782,COc1cccc(CN(C[C@H]2C(O)=O)C[C@H]2c(cc2)ccc2Br)n1,0 G754-0525,O=C(CSc(n1CC2OCCC2)nc2c1N=CNC2=O)Nc(cc1)ccc1Br,0 Z744080818,Cc1nccc(CNC(NC2CCN(Cc3ccccc3)CC2)=O)n1,0 D428-0274,CC(CNc(cccc1)c1N1CCOc2c(C)cccc2C)C1=O,0 F825-1668,CN(CC1)CCN1C(C(CCC1)CN1S(c1ccc(-c2ccn[nH]2)o1)(=O)=O)=O,0 F6660-6402,O=C(CN(C=CN(C1CCCCC1)C1=O)C1=O)NCC1OCCC1,2 Z1827049172,Cc(cc(s1)S(N(CCC(O)=O)C2CC2)(=O)=O)c1Cl,0 Z1725330363,CC(C)(C)c1nnc(cc2)n1nc2NCC1(CCOCC1)c1ccccc1,0 E942-0387,CC(C)CN(C=C(c1c2cccc1)NC(NCC1CCN(CCc3cccs3)CC1)=O)C2=O,2 Y031-0025,CCC(CC)C(Nc1cccc(C(Nc2nnc(Cc3ccccc3)s2)=O)c1)=O,2 Z4161535537,C[C@H](C[C@@H](C1)C(Nc2cn(C)nc2-c2ccccc2)=O)NC1=O,2 F6416-8452,Cc1cc(C(CCNC(c2ccco2)=O)O)c(C)o1,2 D491-6712,Cc1ccc(-c2nsc(NC(c3noc(-c(cc4)cc5c4OCCO5)c3)=O)n2)s1,2 F6257-3418,O=C(c1csc(-c2ccccc2)n1)Nc1ncnc(N(CC2)CCN2c2ccccc2)c1,2 Y040-8639,OC([C@H](Cc(cc1)ccc1O)NC(CCCN(C(c(cccc1)c1N1)=O)C1=O)=O)=O,0 C470-0191,Cc1c(Cn2c(C(N(C)C(N3C)=O)=O)c3nc2CN(CC2)Cc3c2cccc3)cccc1,0 F424-0188,O=C(CSC(n(c1c2)nc2-c(cc2)ccc2F)=NNC1=O)Nc(cc1)cc2c1OCCO2,2 Z1751048067,CCC(CO)(CCC1)CN1C(Nc1noc(C(C)C)c1)=O,2 Y020-3975,Cc(cc1)cc(C)c1NC(N1)=NC(c2c(C)nc(N3CCOCC3)nc2)=CC1=O,2 S727-0293,OCc1cn(C(C2)CN2S(c2cccc3nsnc23)(=O)=O)nn1,2 P316-0656,Cc1cc(N(CCC2NS(c3cc(F)cc(F)c3)(=O)=O)C2=O)cc(C)c1,0 F536-0434,CC1Oc2cc(S(N(CC3)CCN3C(c(cc3)cc(Cl)c3F)=O)(=O)=O)c(C)cc2NC1=O,0 SC04-0328,O=S(c(cc1)ccc1F)(N(CCC1)CC1OCCc1noc(C2CCOCC2)n1)=O,2 G266-1395,CN(c(c(N1C)c2)cc(NC(Nc(cc(cc3)F)c3F)=O)c2N2CCOCC2)C1=O,0 F6495-5676,CCOC(N(CC1)CCN1C(C(C1)CN1c1ncnc(-n2nc(C)cc2C)c1)=O)=O,2 S590-0525,CCCS(NCC1N(Cc2ccccc2)Cc2cccn2C1)(=O)=O,2 F2879-3831,O=C(C(NCc1cccs1)=O)NCC1OCCC1,2 F6560-7639,CC(C(NCc(cc1)cnc1-c1cocc1)=O)n1nccc1,2 Z3063565814,CC(CCN1)(C1=O)c1nc(-c(ccc(C)c2)c2F)no1,0 Z3392889557,CC(CNc1c(c(C)no2)c2nc(C)c1)c1ncccc1,2 F6479-5912,Cc1nccc(OC(CC2)CCN2C(COc(ccc(Cl)c2)c2Cl)=O)n1,0 SB04-0032,CS(N(CC1)CC1N(CCNC(COc(cc1)ccc1F)=O)C1CCOCC1)(=O)=O,0 D473-1491,CC(CS(N1c(cc2)cc(Cl)c2C(Nc(cccc2)c2C(N)=O)=O)(=O)=O)C1=O,0 F5940-0378,CCCc1c(C(N2CCC(COCc3ccccc3)CC2)=O)snn1,2 F6480-3841,O=C(COc1cc(C(F)(F)F)ccc1)N(CCC1)CC1Oc(nc1)ncc1F,0 Y042-7150,c1(nc2c(n1C)cccc2)[C@@H](NC(=O)CCc1cc2c(OCC2)cc1)C(C)C,0 F6441-6388,Cc1csc(C(N(CC2)CCC2S(c(cc2)ccc2OC)(=O)=O)=O)c1,2 F6400-1411,O=C(c1cccs1)N1C(CN2CCOCC2)CSCCC1,2 Z1173192111,O=C(C1(CCOCC1)c(cc1)ccc1F)NC(CCN1c(cccc2)c2Cl)C1=O,0 Z2982743166,CNC(NCc1cn(C2CN(Cc3ccccc3)CC2)nn1)=O,2 SC60-0742,CC(C)(C1)CN(Cc(cc2)ccc2Cl)CC(C(N2CCOC)=O)N1C2=O,2 S591-0557,Cn1ncc(C(N(C2)CC2N(Cc2ccccc2)C2CCOCC2)=O)c1,2 SC46-0258,O=C(c1cncnc1)N(C1)CC2(CCCC2)C1c1nc(C2CC2)n[nH]1,2 Z2370655721,CCN(CCN(C1)S(c2c3OCCc3ccc2)(=O)=O)C1=O,2 F6725-0003,O=S(C(CC1)CCN1c1nc2ccccc2nc1)(c1ccccc1)=O,2 Z90656934,CS(N(CCC1)c(cc2)c1cc2C(NC1CCN(Cc2ccccc2)CC1)=O)(=O)=O,2 P297-4789,Cc(cc(cc1)S(N(CC2)CC2n2c3ncccc3nc2-c2ccco2)(=O)=O)c1F,0 Z1474296910,CC(C)c(ccc(C)c1)c1OCC(NC(CCC(N1)=O)C1=O)=O,0 SB36-0688,O=C(c1ccco1)N(C1)[C@H](Cn2nnc(C(N3CCOCC3)=O)c2)CC1(F)F,2 Z1180337822,NC(c(ccc(NC(NCC1CCN(Cc2ccccc2)CC1)=O)c1)c1F)=O,0 Z3356168063,CC(C)ONC(C1c2ncnn2CCC1)=O,0 F6389-1204,O=C(c1nccc(-n2nccc2)c1)N1c2nc(cccc3)c3n2CC1,2 E977-0061,O=C(CCC1)Nc(cc2)c1cc2S(N(CC1)CCN1C(c1ccccc1)c1ccccc1)(=O)=O,2 F6716-9519,Brc1ccc(CNc2nc(C3CC3)ncc2)cc1,0 S579-0013,O=C(CC1=C(CCCC2)C2NC1=O)NC1CCN(Cc2ccccc2)CC1,2 F5033-5958,CSc1ncccc1C(N1CCC(CNC(c2c(C(F)(F)F)cccc2)=O)CC1)=O,0 S434-0279,Cc(nc(c1c2)N3CCCC3)cn1nc2C(Nc(cc1)cc2c1OCCO2)=O,2 Z1331298513,COc(cc1)cc2c1[nH]cc2CC(NC(C(C1)O)c2c1cccc2)=O,0 F6439-4767,CC(C)Sc1ccc(CC(NCCn2nc(C(F)(F)F)cc2)=O)cc1,2 G856-6767,O=C(CSc1nnc(N2)n1C(c1ccccc1)=CC2=O)N(CC1)c2c1cccc2,2 Z1891237928,CC(C)n(c1nc(-c2ccco2)c2)ncc1c2-c1nc(-c2cnc3n2ccnc3)no1,2 4038-0109,Cc(cc1)cc(NC(CC(C2)c(cc3)ccc3OC)=CC2=O)c1O,2 Z1492126016,CC(CN(CC(O)=O)c(cccc1)c1N1Cc2ccccc2)C1=O,0 Z2699331278,O=C(C(CCN1)(C2CCCC2)C1=O)NC1CCN(CCc2ccccc2)CC1,2 F067-0395,Cc1c(C(CSC(N2CC3OCCC3)=Nc(cc(cc3)C(NC4CCCC4)=O)c3C2=O)=O)c(cccc2)c2[nH]1,0 Z2256360591,CC(C)C(NC(C(O)=O)c1cc(C)c(C)cc1)=O,0 F0597-0027,O=C1N=C2SC(SCc(cc3)cc(Cl)c3Cl)=NN2CCC1,2 Z3482425621,O=C(NC1)Nc2c1ccc(NCC1CC1)c2,2 Z1840413456,CC(C)[C@@H](C(C)(C)O)Nc1c(cc(cc2)F)c2ncn1,0 Z1147364064,Cn(cc1)nc1NC(N1CC(c(cc2)cc(Cl)c2Cl)OCC1)=O,0 Z1505749721,CC(C)(C1)[C@H]1C(NC1CCN(CC(NC)=O)CC1)=O,0 Z2911170509,COc1cc(CN(C2)C(C(CC3)(CC4)CC34C(O)=O)=O)c2cc1,2 Z1626234942,CC(C)C(CN(C)CC1)N1C(Nc1cn(-c2ncccn2)nc1)=O,0 E021-0898,CCc1cc(n(CC(C)(C(NC2CCCCCC2)=O)N(CCOC)C2=O)c2c2)c2s1,2 SB56-0818,C(c1ccncc1)N(C[C@@H]1c2nc(C3CCCC3)no2)C[C@@H]1c1cnccc1,2 F6482-5815,CCC(C(NCc1cc(-c2ccncc2)ncc1)=O)c1ccccc1,0 Z1725311377,Cc1nn(ccnc2N(CC3)CCC3c3nc(cccc4)c4[nH]3)c2c1,2 SA96-1256,CC(C)CNC(C1C(C2)(CN2C(c2coc(C)n2)=O)CN(Cc2ccccc2)C1)=O,0 SB69-0516,O=C(c1nn(C[C@H](C2)Oc3ccncc3)c2c1)N1CCOCC1,2 Z1470645036,C[C@@H](C(O)=O)NC(c1nccnc1N)=O,0 Z1382133084,CC(C(CC1)CCN1C(NCc1coc(-c2ccccc2)n1)=O)(C(N1)=O)NC1=O,2 F6522-0228,CC(C)(C(NCc1cc(-c2ccco2)cs1)=O)OC(C)=O,0 Z2352631986,CC(C(O)=O)c1cccc(NC([C@@H]2C(C)(C)C2)=O)c1,0 T505-0194,Cn1c(CN2C(CCn3nnc(-c4ccccc4)c3)CCCC2)ccc1,2 F5875-0185,O=C(C(Oc1c2cccc1)=CC2=O)NCCCOc1cccc2cccnc12,2 Z1429818318,CC(C(N1CCCCC1)=O)NC(CN(C=CC(C)=C1)C1=O)=O,2 Z1697193290,CC(N1CCC(CNC(c(c(F)ccc2)c2Sc2ccccc2)=O)CC1)=O,2 Z1870374367,OC(c1coc(C(Nc(cccc2)c2Nc2ccccc2)=O)c1)=O,2 Z2819575882,OCC(CC1)(CN1C(N[C@@H]1[C@@H](c(cc2)cc(F)c2Cl)OCC1)=O)F,2 Z3648981650,CC(CCC1)(CN1c1nc(cncc2)c2n1C)C(F)(F)F,0 F6481-2335,Cc1c(C(CC2)SCCN2C(C(C=C2)=NNC2=O)=O)cccc1,2 F5792-0440,O=C(c1nccnc1)N(CC1)CCN1C(SC1)=NN=C1c1ccccc1,2 V011-6724,O=C(Nc(cc1)ccc1Cl)N(CC1)CCN1c1nc(C2CC2)nc2c1c(CCCC1)c1s2,2 8011-2014,Cn1c2nc(SCC(N(CC3)c4c3cccc4)=O)nnc2c2c1cccc2,2 Z646603014,Fc1cccc(C(CCC2)N2c2nccs2)c1,0 F3305-0010,Clc1c(Cn2ncc3c(NCC4OCCC4)ncnc23)cccc1,2 Z2962678099,CC(C)(CC(C1)c2ccccc2)N1C(c(nc1)nn1-c1ccccc1)=O,2 F5298-0484,Cc1cc(C(N2CCOCC2)=O)nn1CC(NCCc1c[nH]c2c1cccc2)=O,2 Z2832190746,CC(C(N1CC2(CNCC2)OC(C)C1)=O)Oc1cnccc1,2 Z1422513189,CC(C)[C@@H](C(OC(C)(C)C)=O)NCc1nnnn1-c1ccc(C(F)(F)F)cc1,0 Z1289778288,CCN(CC)C1CN(Cc(ccc(F)c2)c2Cl)CC1,0 F2073-0470,CC(C1=NC(C)=C2NC(C(c3ccccc3)c3ccccc3)=O)=CC=CN1C2=O,2 SB69-0476,O=C(c1nn(C[C@H](C2)Oc3cnccc3)c2c1)NCc1cscc1,2 F6755-0603,Cc1nnc2n1ccnc2N(CC1)CCN1c1c(C)ccc(C)c1,0 L566-0452,CC(CCC1)(CN1C(NCC1OCCC1)=O)C(NCc1ccc(C)cc1)=O,2 Z1348576492,CCC(C)NC(CN(CC1)CC1N(C)Cc1ccccc1)=O,0 F6725-0331,OC(CC1)CN1C(CC1)CCN1c(ncc(C(F)(F)F)c1)c1Br,0 F6564-5747,O=S(Cc1ccc(C(F)(F)F)cc1)(N(CC1)CCN1c1nnc(C2CC2)cc1)=O,2 F6275-0075,CCOC(CCC(N(CC(F)(F)F)C1CCOCC1)=O)=O,0 F616-0549,O=C(c(cc1)ccc1N(C(C=C1)=O)N=C1Sc(cc1)ccc1Cl)NCC1OCCC1,0 F2135-0801,CCOC(C(C)Oc1cccc2c1C=CNC2=O)=O,0 Z26903748,Cc1nn(Cc2ccccc2)c(Cl)c1C(N(C)CC(Nc1cc(OC)ccc1)=O)=O,0 F5128-0506,CCn(c(C)c1)nc1C(N(CC1OCCC1)c1nc(c(C)c(cc2)Cl)c2s1)=O,2 F1827-0022,CCN(CCN(CC(Nc(cc1)ccc1F)=O)C1=O)C1=O,0 F6562-8288,O=C(c1cc(-c2cccs2)n[nH]1)NCC1c(cccc2)c2OC1,2 F6245-4083,CCN(C(C(CC1)CCN1C(CN(C=NC(C)=C1C)C1=O)=O)=NN1CCOC)C1=O,2 F6764-2048,Cc1cncc(N(CC2)CCC2c2nc3ncc(C4CC4)cc3cc2)n1,2 F6560-5410,Cn1ncc(-c2cc(CNC(CN3N=CC=CC3=O)=O)cnc2)c1,2 SB75-0162,CC(C)C(N[C@H](C[C@H]1CN(C2)C(C(C)C)=O)C[C@]12c1nc(C)no1)=O,0 Z1650776337,Cn1ncc2c1ncc(C(NCc(cccc1)c1Cl)=O)c2OC,0 Z2964860078,O=C(CNC(c1ccccc1)=O)N1[C@H](CCOC2)[C@H]2OCC1,0 F3411-1533,Cc(cc1)ccc1C(C1=CN(Cc2c(C)ccc(C)c2)c(nc(C)cc2)c2C1=O)=O,2 V004-2335,CN(C(CN1CCC(N2CCCCC2)=O)=C(C(c(cccc2)c2OC)N2)C1=O)C2=O,0 F6445-6862,Cc1c(C(NCc(cccc2)c2-c2cscc2)=O)sc(-n2cccc2)n1,2 SC66-0760,O=C(c1c[nH]c2c1cccc2)N(C1)CC2(CCOCC2)C1c1nncn1CC1CC1,2 Z809505644,O=C(c(cc1)ccc1Cl)N(CCC1)CCN1C(c(cc1)cc(N2)c1NC2=O)=O,2 E613-0414,CC(CCCC1C)N1C(COCc1noc(-c(cc2)ccc2F)c1)=O,0 F6445-6986,COc(ccc(S(NCc(cccc1)c1-c1cscc1)(=O)=O)c1)c1Cl,0 F6444-0819,Cc(nc1)cnc1C(N(CC1)CCC1N1C(COCc2ccccc2)CCC1)=O,2 F6244-2542,O=C(CSCc1ccccc1)NCC#CCN1CCOCC1,2 Z1413726217,CC(C)CC(C(O)=O)NC(CC1c(cccc2)c2NC1)=O,0 Z1440290805,CC(CS(C)(=O)=O)NC(N(CC1)CC2C1N(Cc1ccccc1)CCC2)=O,0 F6454-1258,O=C(NCC(CC1)CCN1c(nc1)ncc1F)N(CCN1)C1=O,0 F6761-7642,CS(N(CC1)CCC1C(N(CC1)C(C2)C1CN2c1nccc(C(F)(F)F)c1)=O)(=O)=O,2 Z2495176616,Cc(cc(cc1)NC(C(CCC2)CN2c2nccnc2)=O)c1Cl,0 Z1137641995,CN(c1nnc(CN(Cc(cc2)cc3c2OCO3)c2ccccc2)n1-c1c2scc1)C2=O,2 Z753160068,CN(C)C(COc1cccc(CNC(N2CCC2)=O)c1)=O,0 Z2087173589,CC(C)(C1)Oc(ccc(NC(c(nc2C)nn2-c2nnc(C(F)(F)F)[nH]2)=O)c2)c2C1=O,2 F6571-5826,CC(Cc1csc2c1cccc2)NC(c1cc(ccc(OC)c2)c2[nH]1)=O,0 S985-0122,CC(C)N(C[C@H]1CN(C2)C(c(cc3)cc(F)c3OC)=O)C[C@]12C(N1CCCC1)=O,0 F6597-0669,Cc1cccnc1OCC1CCN(Cc2cn(cccc3)c3n2)CC1,2 8755-0380,CCN(CC)CCCC(C)NC(c1c(NC(c2ccccc2)=O)sc2c1CCCC2)=O,0 Z4635112708,Cn(cc1CNc(cc2)cc(CCC3)c2NC3=O)nc1-c(cc(cc1)F)c1F,2 F1639-0138,CC(Cc1c2cccc1)N2S(c(cc1C)c(C)cc1OC)(=O)=O,0 Z2482917099,Cc1ncc(CN(C)Cc(cc2)cc(Cl)c2C(O)=O)s1,0 F5854-1058,O=S(c1cc(CCCC2)c2cc1)(N(Cc1cscc1)Cc1ncccc1)=O,2 F6529-3516,O=C(Cn(cc1)c2c1cccc2)N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O,2 Z4910857956,O=C(c(cc1)c(C2)cc1-n1nnc(Cn(cc3)c4c3cccc4)c1)N2C(CCC(N1)=O)C1=O,2 Z1172550969,O=C(CCC1OCCCC1)Nc(cc1)ncc1Br,0 Z4947189479,COc1c(CNc2nn3c(-c4ccncc4)nnc3cc2)cccc1,2 Z1840639105,CC1OCCCC1C(Nc(cc(cc1)C(C)=O)c1O)=O,0 S694-1375,Cc1cnc(-c2ccncc2)n1C1CN(Cc(cc2)cc3c2OCC3)CC1,2 F6523-0824,Cc1nc(CCCC2)c2c(N(CC2)CCC2NC(c2nn(CCCO3)c3c2)=O)n1,2 Z829043236,O=C(Cc1ccccc1)N(CCC1)C1C(N(CC1)CCC1n1nccc1)=O,2 J007-0008,Cc1ccc(C(CCCCC2)N2C(NC2CCCCC2)=O)s1,0 L279-0412,CCn1c(ccc(C(N(C)C)=O)c2)c2nc1CN(C)C(Nc(cc1)cc2c1OCCO2)=O,0 F6473-6108,CC(O1)=CC(OC(C2)CN2C(C(CC2=O)CN2c(cc2)ccc2OC)=O)=CC1=O,2 SD07-0671,CCN(CC)C(NCc1c(COC(CC2)(CN2C(C2(C)CCCCC2)=O)C2)n2nn1)=O,0 F5826-0020,COc1ccc(CCNC(N(CC2)CCN2c2nc(cccc3)c3[nH]2)=O)cc1,2 Y044-1777,OC(C(CCC1)CN1C(CN(C(C=C1)=O)N=C1c(cc1)ccc1Br)=O)=O,0 F6708-8525,FC(c1nc(N2CC(C3)(CC3c3ccccc3)C2)ncc1)(F)F,0 F2659-0063,O=C(c(o1)ccc1Br)NCC(c1ccco1)N(CC1)c2c1cccc2,2 F6549-8896,O=S(N1CCCC1)(N(C(CC1)C2)C1CC2Oc1cnccc1)=O,2 F3367-0074,Oc1c(cccc2Cl)c2ncc1C(Nc1c(C(F)(F)F)cccc1)=O,0 F6515-0763,O=C(Cn1c(cccc2)c2nc1)NCc1cc(-c2cccs2)ncc1,2 F6796-0281,Cc(cn1)c(N(CC2)CC2(C(N)=O)F)nc1SC,0 F6782-8073,CC(C)N1C(SCC#CC)=NC=C(C(OC)=O)C1=O,0 F6512-2916,CC(C)(C)OC(N1CCN(Cc2c(C)onc2)CC1)=O,0 S664-4725,OC(CC1)C1(CC1)CCN1C(Cc(cc1)ccc1OC(F)(F)F)=O,0 SD25-0309,O=C(CCC(CN(C1)C(Nc(cccc2)c2Br)=O)C11CCCCC1)NC1CC1,2 F6443-7700,O=C(c(cc1)ccc1-c1cscc1)NCC(CCC1)N1c1ccccc1,2 S695-2043,Cc1nccn1C(C1)CN1C(C1(CC1)c(cc1)ccc1OC)=O,0 Z1457665677,O=C(CCC(N(CC1)CCC1NCC1CC1)=O)c1cc(CCC2)c2cc1,2 F6801-7989,CN(Cc(cc1)cc2c1OCCO2)c1nc2ccnn2cc1,2 Z2610946740,CC(C(CC1)CCC1F)NS(Cc1cc(C(O)=O)ccc1)(=O)=O,2 Z739344692,Cc(cc1)cc(Br)c1NCc1nc(C2CC2)no1,0 F2758-0671,Cc(c(S(NCC(c1c2cccc1)=NN(C)C2=O)(=O)=O)ccc1)c1Cl,2 Z1249310378,CC(C(CO)SC)NC(NC(CC1)CN1C1CCN(C)CC1)=O,0 F6445-0601,Cc1nc2ccccc2c(NC(c(cc2)ccc2Oc2nccs2)=O)c1,2 Z3589094484,OCC1(C(CC2)CCC2C1)NC(c(cnnc1)c1O)=O,2 F537-0295,CCC1Oc(ccc(S(N(CC2)CCN2C(CNC(c2ccccc2)=O)=O)(=O)=O)c2)c2NC1=O,2 Z2755335571,CN(CCC(O)=O)C(c1ccc(C2CCOCC2)cc1)=O,0 Z1445507091,OC(CC1)(CCN1C(C(CC1=O)CN1c(cc1)ccc1Cl)=O)C(O)=O,0 F742-0088,CN(c(ccc(S(CC(N(CC1)CCN1c1cccc(Cl)c1)=O)(=O)=O)c1)c1N1C)C1=O,2 Z1701762376,CC(c1cc(OC)ccc1)N[C@@H]1c(cc(cc2)OC)c2OCC1,2 F6178-6460,O=C(c1cocc1)N1CCC(CNC(c2nccnc2)=O)CC1,2 F6443-1617,COC(CC1)CCN1c(cc1)ccc1C(NCCn1ncnc1)=O,2 Y041-7754,Cc1c(C(CN(C=Cc(cc2OC)c(C3)cc2OC)C3=O)=O)c(cccc2)c2n1C,0 Z2940924392,NC(c1cccc(C(N(CC2)Cc3c2nc[nH]3)=O)n1)=O,2 Z4089407616,Cc1nc(C(NCc2nn(C)c3c2COCC3)=O)c(-c2ccccc2)o1,0 8602-0140,CC(C)(CC(N(CC1OCCC1)C1=O)=C2C1(C(F)(F)F)NC(CCc1ccccc1)=O)CC2=O,2 S561-6566,Cc(occ1)c1C(N(CCCCC1)C1c1nnc(C)o1)=O,0 F6196-0320,O=C(C1CC1)Nc1nc(C(NCC2OCCC2)=O)co1,2 Z2706706141,CCN(CC)CC(CC1)CN1C([C@H](CCSC)NC(N)=O)=O,0 Y030-7111,CCC(C)(C)C(Nc1nnc(C(F)(F)F)s1)=O,0 F0696-0792,CN(C(C(C(NCc(cc1)ccc1F)=O)=CN1)=O)C1=O,0 P158-1241,O=C(CN(C=CC=C1S(N2CCCCCC2)(=O)=O)C1=O)N(CCC1)c2c1cccc2,2 F3398-3624,COc1c(CNC(C(CC2)CCN2c2c(cc(cc3)F)c3ncc2C#N)=O)cccc1,0 Z2643057901,CC(C)CCc1nnc(NC(c2c(C(C)C)onc2C)=O)s1,0 M785-1618,CNC(CN(C(c(oc1c2cccc1)c2N1CC(NCC2OCCC2)=O)=O)C1=O)=O,0 F6359-0646,CC(C)Sc1ccc(CC(N(CC2)CCC2Oc2ncc(C(F)(F)F)cc2)=O)cc1,0 F115-0472,CC(C)Cc1nc2cccnc2n1C(CC1)CCN1S(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,2 S380-0220,CCC(C)NC(CN(C(C1(CCC(C)CC1)N1)=O)C1=O)=O,2 Z1619676797,OCC1(CCCC1)NC(Cc1c[nH]c(cc2)c1cc2Cl)=O,2 Z1345260041,Cc1c(C(NC2CCN(Cc3cnccc3)CC2)=O)oc(C)c1,0 F6529-3999,O=C(CN(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O)Nc1cnccc1,2 Y044-3829,CC(C)(C(C1)C(Nc2nnc(C3OCCC3)s2)=O)OC1=O,2 F6675-7976,CN(C(C1)CN1c1nccnc1)C(C(C(OC)=C1)=CN(C)C1=O)=O,2 F6436-2336,CC(CNC(CCc(cccc1)c1Br)=O)(C1CC1)O,0 F6440-3231,Cn1nc(CNC(C(CC2)CCN2S(C)(=O)=O)=O)c2c1CCOC2,2 Z1522313262,Cc1cc(OCC(N(CC2)CCN2C(C(CC2)Cc3c2[nH]nc3)=O)=O)cc(C)c1,0 F2145-0465,CC(C)(C)OC(N1CCN(Cc2csc3nc(-c(cccc4)c4N)cn23)CC1)=O,2 F6529-3750,Cc1noc(C)c1CC(N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O)=O,2 F6559-1506,Cc(ccc(C(NC(CC1)CCC1(F)F)=O)c1)c1F,0 K780-0587,Cc1c(CSCC(O)=O)nc(-c(cc2)ccc2OC)o1,0 F6520-1526,O=C(NCCc1ccc(-c2cscc2)s1)Nc(c(F)ccc1)c1F,2 F6564-5210,COc(cc1)cc(C(N(CC2)CCN2c2nnc(C3CC3)cc2)=O)c1Br,0 SB94-0052,Cc(occ1)c1C(N1CCC(CN(CC(C2)C(NC3CC3)=O)C2=O)CC1)=O,2 F6471-0580,O=C(CSCc1ccccc1)N(C1)CC1n1nnc(-c2ccccc2)c1,2 L807-0114,N#CC1=CN(c2cc(CCC3)c3cc2)c(cc(cc2)F)c2S1(=O)=O,2 F6559-1509,O=C(c(cccc1)c1OC(F)(F)F)NC(CC1)CCC1(F)F,0 F6574-1166,CSc1ccc(CCC(NC(CC2)CCC2n2nccc2)=O)cc1,2 L982-0455,CC(C)CNC(c1c(C)n(C=NN(CC(Nc(cc2)cc3c2OCCO3)=O)C2=O)c2c1C)=O,2 L934-0228,O=C(Cc(cc1)ccc1F)Nc1nnc(C(CC2=O)CN2c(cc2)ccc2F)o1,0 Z1317608270,CCn1ncc(Nc2nc(C(C)(C)C)ncc2)c1,0 F6489-1944,Cc1c(C(N(CC2)CC2Oc(cc2)nnc2N(C)C)=O)sc(C)n1,2 Z1993998267,O=C(c1cc(C2CC2)no1)NCc(cc1)ccc1N(CCN1)CC1=O,2 Y043-6162,OC(CCCC1)(CC2)C1CN2C(CCCN(C(c(cccc1)c1N1)=O)C1=O)=O,2 Z1744864429,O=C(CCC1)Nc(cc2)c1cc2S(N(CC1)CCC1Nc1nccs1)(=O)=O,2 F6041-0381,COc(ccc(Cl)c1)c1NC(c(cc1)ccc1OCc1nc(C2CC2)cs1)=O,2 F6502-5920,O=C(NC1CCCCC1)Nc1cn2nccc2nc1,2 Z3406339638,C[C@H](C1)O[C@@H](C)c2c1c(C(N(CCN(C)C)Cc1ccccc1)=O)n[nH]2,0 Z2962514389,CN(C(C(N1C2CC(CC(F)(F)F)CC1CC2)=O)=CN1)C1=O,2 F6521-5067,CSCCC(CNC(C(NCc(cc1)ccc1Cl)=O)=O)O,0 Z2222473099,CC(C)C(Nc1nccc(C(NCC(C)(c(ccc(F)c2)c2F)O)=O)c1)=O,0 F9994-0339,CNCc(cccc1)c1OCc(ccc(Br)c1)c1F,0 Z756910582,CC(CN1CCOCC1)NC(c1c[nH]nn1)=O,0 V017-4746,CCC(C(NCc1ccco1)=O)Oc1cc(C(c2ccc(C)cc2)N(CC2)C(CC)=O)c2cc1,0 S613-0757,O=C(CCc1nc(cccc2)c2s1)N(CCC1)C1c1nc(CCOCC2CC2)no1,2 Y206-1450,CC(C1)OC(C)CN1S(c(cc(cc1)F)c1F)(=O)=O,0 Z1185235315,Cc1nn(C)c(OC)c1C(NCc(cc1)ccc1Cl)=O,0 Z1314164506,O=C(c1cn(cccc2)c2c1)N(CCCN1)CC1=O,2 SC15-0413,COCC(C1)CN(CC(CC2)CCN2S(c(cc2)cc(F)c2F)(=O)=O)C1=O,0 Z5027823023,O=S(c1cnc(-c2ccccc2)o1)(N[C@H]1C[C@@H](Cn2nncc2)C1)=O,2 F584-1509,Cn1nc(C(N2CCOCC2)=O)c(C2)c1CCN2C(Nc1cccc(Br)c1)=O,0 F993-0322,CN(c(sc(C(NCC1OCCC1)=O)c1)c1C(N1C)=O)C1=O,2 CM3565-1501,Cc1nn(C(CC2)CN2S(c2cccc(Cl)c2)(=O)=O)c(C2CCOCC2)n1,2 SA44-0718,CN(CC(C1)(CN1C(NC1CCCCC1)=O)C1)C1c1nnc(-c2ccccc2)o1,2 F6559-1050,CN(C=CC=C1C(N(CC2)CC2n2c(cccc3)c3nc2)=O)C1=O,2 Z810426978,Cc1cccc(C(N(CCC2)CC2C(Nc2nc(C)ccc2)=O)=O)n1,2 E137-0150,CCOC(c1c(C)c(C(NC2CCC(C)CC2)=O)c(C)[nH]1)=O,0 F6565-4960,Cc1nc2ncnn2c(N(CC2)CCN2c2cc(CCC3)c3nn2)c1,2 Z2067430423,CC(C)(C)n1ncc(NS(c2c(C)cnn2C)(=O)=O)c1,0 S616-8643,N#Cc1c(CN2C[C@@H]3N(Cc4cnccc4)C[C@@H]3CC2)cccc1,2 F5017-1911,COC(N1CCC(CNS(CCc2ccccc2)(=O)=O)CC1)=O,0 F6559-3844,Cn1nc(C(NC(CC2)CCN2C(CC2)CS2(=O)=O)=O)c2c1cccc2,2 Z909123614,O=C(C(CC1)CCN1C(c(cc1)ccc1S(Nc1ccccc1)(=O)=O)=O)NC1CCCCC1,2 Y030-4736,O=C(C(c1ccccc1)Sc1ccccc1)NCCc1ccccc1,2 SA46-1783,CC(C)S(N(C1)CC1(C1)OCC1N1CCCC1)(=O)=O,2 F6564-7740,CC(C(Nc1cc2ccccc2nc1)=O)N1N=C(CCC2)C2=CC1=O,2 F6443-5352,O=C1OC(CCC2)(CN2S(c2cnccc2)(=O)=O)c2c1cccc2,2 Z1188563315,CN(C(C(C1)c(ccc(F)c2)c2NC1=O)=O)c(cc1)ccc1SC,0 Z898992802,CN(CC(C1)C(Nc(cc2)cc(C(F)(F)F)c2F)=O)C1=O,0 M008-1663,Cc1c(C(N(CC2)CCN2c2ncccn2)=O)sc(Nc(cc2)ncc2F)n1,2 F5631-0019,Cc1nc(NCCNS(c(cc2)ccc2OC(F)(F)F)(=O)=O)nc(N(C)C)c1,0 S398-2303,Cc1cc(C(N(C2)Cc3c2c(C(N2CCCC2)=O)nn3C)=O)c(C)n1CCOC,2 Z1424539846,CCC(C(NC(CC1)CCN1C1COCC1)=O)c1ccccc1,2 Z1478844885,Cc1nnc(-c2cccc(NC(c(cc3)c(C)cc3-n3ncnc3)=O)c2)n1C,2 Z1534984725,Cc(cc1NC(CN(CC2)CCC2C(c2nccn2C)O)=O)nn1-c(cccc1)c1F,2 SB95-0094,O=C(COc1ccccc1)N(CCN1CCCCC1)C1CNCCC1,2 Z3074667775,CN(CC1)CCN1c(ncc(S(NCCOC)(=O)=O)c1)c1Cl,0 F6257-4896,CC(c(cc1)cc(OC)c1OCC(N(CC1)CCN1c1ncncc1C)=O)=O,0 Z1543257218,OC(Cc1c2cccc1)C2NC(c(cccc1)c1N1CCOCC1)=O,2 F6658-6177,Cc1cc(OCC(CC2)CCN2C(N2C)=Nc(cccc3)c3C2=O)ncn1,2 Z2001786776,COC1(CC2CC(C3)C1)CC3C2NC(c1cn(-c2ccccc2)nc1-c1cccs1)=O,2 F6764-1687,FC(c1nnc(CN(CC2)CCC2c(ccc2c3)nc2ncc3-c2ccncc2)o1)(F)F,2 T473-1487,CCCn1c(cccc2)c2c(CN(CC2)CCN2c2cc3nnc(C4CC4)n3nc2)c1,2 F6127-0137,OCC(CC(C1)NC(C2(CCCC2)c(cc2)ccc2Cl)=O)C1O,2 SC69-0116,Cn1c(C(C2)C3(CCCC3)CN2C(c2n[nH]c-3c2COc2c3cccc2)=O)nnc1,2 7706-0348,CN(c1c(C(N2)=O)n(CC(COc3ccccc3)O)c(NCc3ccco3)n1)C2=O,2 F3296-0427,Cc1coc(C)c1C(Nc(cc1)cc(Cl)c1Cl)=O,0 SB14-1199,Cn1c(C(N(CC2)CC2N(C2CCOCC2)C(COC)=O)=O)cnc1,2 F6549-3195,COC(c(cc1)ccc1C(N1CC(Cn2ncnc2)C1)=O)=O,0 F6616-7358,Cn1ncc(NCc(ccc(Br)c2)c2F)c1,0 Z1973569163,CC(C1)=CCCN1S(c(cc1)cc(Br)c1C(O)=O)(=O)=O,0 D385-0480,OCCCN(C(CC(c(cccc1)c1N1Cc2ccccc2)C1=O)=Nc1c2cccc1)C2=O,0 F6454-1267,O=C(C1COCC1)NCC(CC1)CCN1c(nc1)ncc1F,2 SC89-1054,CN1CCN(CC(CC2)C(C3)(CN3C(NC3CCCC3)=O)S2(=O)=O)CC1,2 Z995713130,CCC(C)C(N(CCC1)CC1C(NCC1(CCCCC1)N1CCOCC1)=O)=O,2 F6472-0755,Cc1c(C(NCCSC2CCOCC2)=O)sc(C)n1,2 SA50-0250,Cn(c(C1)c2CN1S(c(ccc(F)c1)c1F)(=O)=O)nc2-c1nc(C2CC2)no1,0 F5857-6665,OC1(CNS(c(cc2)cc3c2OCCO3)(=O)=O)C=CCCC1,2 8017-2998,OC(CCNC(c(cc1)cc2c1NC(C(c1ccccc1)c1ccccc1)C1C2C=CC1)=O)=O,2 F5490-0704,O=C(CSc(cc1)ccc1F)N(CCC1)CC1c1nnc(-c(cc2)cc3c2OCO3)o1,2 Z1687976830,Cc(ccc(C#N)c1)c1S(NC(Cc(cc1)c(C)cc1Br)=O)(=O)=O,0 Z1444191861,CC(C1)C1N(CC(C1)NC(c2nc(C(O)=O)ccc2)=O)C1=O,0 Z1397055905,CC(C)(C(N(C)CC1)=O)N1S(c1c(C)sc(C)c1)(=O)=O,2 F6802-9508,CS(c(cc1)ccc1N(CC1)CCC1Oc1nccs1)(=O)=O,0 Z1413671896,CC(C(c1ccccc1)N)C(NC(CCC1)CS1(=O)=O)=O,0 F1438-0069,OC(CN1CCN(Cc2ccccc2)CC1)COc(cccc1)c1Br,0 P891-0167,CC(C)c1noc(-c2c(N3CCN(Cc4c(C)ccc(C)c4)CCC3)nccc2)n1,2 F5123-0992,CCOc(cc1)cc(S(N(CC2)CCN2c(cc2)nn3c2nnc3C)(=O)=O)c1OCC,0 G663-0558,CC1Cc2cc(C(N(CC(NCc(cc(cc3)Br)c3OC)=O)C=N3)=O)c3nc2CC1,2 SB36-0609,O=C(c1cn(C[C@H](CC(C2)(F)F)N2C(c(cc(cc2)F)c2F)=O)nn1)N1CCOCC1,2 S937-0778,O=C(Nc1ccccc1)N(C1)CC1n1c(C2OCCC2)nnc1,2 F6031-1841,OC(CN(CC1)CCN1C(NCc1cccs1)=O)C1CC1,2 K784-4617,CC(CCCC1)C1NC(c1cc(-c2ccccc2)nc2ccccc12)=O,0 F6617-6765,O=C(c1cccs1)NCc1cn(-c2ccccc2)nn1,2 SB11-0507,OC(Cn1nnc(C(NC2CCCC2)=O)c1)(CC1)CCN1C(c1cnco1)=O,2 F5860-0310,Cc1noc(C)c1CN(CC1)CCN1C(C(Oc1c2cccc1)=CC2=O)=O,2 SA70-0948,COCCC(CCC1)(CN1S(c1cnccc1)(=O)=O)c1noc(-c2cnccc2)n1,2 F6412-1903,Cn1nnc(C(NCC#CCOc2cccc(C(F)(F)F)c2)=O)c1,2 Z3620156177,N=S(CC1)(CC1(C(N1)=O)NC1=O)=O,2 E627-0130,CC(C)CCN(C(C)(Cn(c1c2cccc1)c1c2-n2cccc2)C(NC2CCCC2)=O)C1=O,2 Z2755538212,OC(C(CNC(C1COCC1)=O)C1CCCCC1)=O,2 Z971130004,O=C(c1ccco1)Nc1cccc(C(N(CCN2)C(c3ccccc3)C2=O)=O)c1,2 Y031-6796,CCC(C)(C)C(Nc1cccc(C(F)(F)F)c1)=O,0 Z1033089064,OC(C(CNC(c(cc1)cc(OC2)c1NC2=O)=O)c1ccccc1)=O,2 F899-1632,O=C(C(CCC1)CN1S(c1c[nH]c(C(N2CCCCCC2)=O)c1)(=O)=O)NCc1ccco1,2 SC02-0784,Cc1c(CCC(N(CC2)CC2(CCOC)NS(C)(=O)=O)=O)c(C)n[nH]1,0 Z2228665451,CCC(C)NC(CN(CC1)CCN1C(c(cc(cc1N2)Br)c1NC2=O)=O)=O,0 SB75-0214,Cc1noc([C@@](C[C@@H](C2)NC(Cn3nccc3)=O)(C3)[C@@H]2CN3S(C)(=O)=O)n1,0 Z4066528950,CCOC(CN(C(C)(C)C)C(c1cn(Cc(ccc(Cl)c2)c2Cl)nn1)=O)=O,0 F6469-3177,O=S(c(s1)ccc1Cl)(Nc(cccc1)c1-c1cn(cccc2)c2n1)=O,2 S018-0120,COc1cc(OC)c(CNC(C(CN(C2)S(C3CC3)(=O)=O)C22CCCCC2)=O)cc1,2 F5788-1511,CC(c1cccc(NC(CN(CCN2c3cccc(Cl)c3)C2=O)=O)c1)=O,0 F5676-0050,O=C(CN(CC1)CCN1C(Nc1cccs1)=O)c1cccs1,2 F6514-4364,O=C(COc(cc1)ccc1Cl)N(C1)CC1n1nnc(CN(CCC2)C2=O)c1,2 Z1020862702,N#Cc(cc1)ccc1OCCCN(C(C=C1)=O)N=C1c(cc1)cc2c1OCCCO2,2 Z3104655695,CC(c1cc(C2CC2)ccc1)NC(NCC1=CC(C)=CNC1=O)=O,2 F5957-0230,Cc1cc(C)nn1CCNC(NCc(cc1)ccc1F)=O,2 V002-0164,CC(C)C(N(Cc(cc(cc1)NC(C2CCCC2)=O)c1N(C)C)C(C)c1ccccc1)=O,2 F3386-4961,O=S(c(cc1)ccc1Br)(Nc(cc(C(F)(F)F)cc1)c1Cl)=O,0 Z1219184110,Cc1nnnn1-c(cc(cc1)NC(NC(CO)c(cc2)ccc2F)=O)c1F,0 F5788-4728,CCOC(N(CC1)CCN1C(CN(CCN1c2ccc(C(C)C)cc2)C1=O)=O)=O,0 C304-2167,CCC1=Nc(cc(cc2)C(NCC3OCCC3)=O)c2Sc(cc2)c1cc2Br,2 Z733990274,OC(COc1cccc(NC(c2cccc3cccnc23)=O)c1)=O,0 Z3158803593,CC(C1)C(CCCC2)C2N1c1nnc(C(C=C2)=NNC2=O)n1CC1OCCC1,2 F2337-1028,CSc1nc(N2CCCC2)c(cnn2CCNC(c3cc(cccc4)c4o3)=O)c2n1,2 Z1123433704,O=C(c1c(cn[nH]2)c2ccc1)OCC1COCC1,2 SC87-0508,O=C(c1cocn1)NCC(CC1)CCC(N=C(c2ccccc2)N2)=C1C2=O,2 F6349-1385,O=C(Nc(cc1)ccc1-c1cnc2n1CCC2)Nc(cccc1)c1F,2 Z1238996180,c1cn(-c(cc2)ccc2Oc2ncnc3ccccc23)nc1,0 S691-1275,CCCn1c(CC(CC2)CN2C(NCC)=O)ncc1C,2 Z1332966659,CNC(C1(CCC1)c1nc(-c2cccc3ccccc23)no1)=O,2 F3385-4768,Cc1c(C(c(cc2)cc(OC)c2OC)=O)oc2c1ccc(NC(C1CC1)=O)c2,2 F5016-3036,CC(c1ccccc1)NC(C(NCC(CC1)CCN1S(C1CC1)(=O)=O)=O)=O,2 Z1181061963,CC(N(C)C(CC1)CCN1C(NCC(CC1)c2c1cccc2)=O)=O,2 Z196177950,CS(c(cccc1)c1N1CCN(Cc2ccccc2)CCC1)(=O)=O,2 SA47-0161,CC1(COC(C2)(CN2C(c2c(-c3cccc(C(F)(F)F)c3)ocn2)=O)C1)O,0 SB33-1001,Cc1ccc(CN(C[C@@H]2c3nc(C)n[nH]3)C[C@@H]2NC(C2CCOCC2)=O)s1,0 K786-8625,CCOc(ccc(CCNC(C(C1)CN(CCc2ccc(C)cc2)C1=O)=O)c1)c1OCC,0 F6353-5582,Cc1cc(C(NCC(c2cocc2)N2CCSCC2)=O)c(C)o1,2 Z2439959099,CN(C1CCNCC1)C(CCNC(N(CC1)Cc2c1cccc2)=O)=O,2 Z1409275282,O=C(C(CCC1)c2c1[nH]nc2)NC1CCN(Cc(cc2)ccc2F)CC1,2 Z1634672559,Cc(cc1)cc(C(Nc2nc(CC(N(C)c(cc3)cc(Cl)c3OC)=O)cs2)=O)c1O,0 SA04-1169,Cc1ncc(CO)c(C(CCC2)CN2S(c(cc2)cc(O3)c2N(C)C3=O)(=O)=O)n1,2 SC76-0075,OC[C@](C1)([C@@H]1c(cccc1)c1N1CC(NC2CCN(Cc3ccccc3)CC2)=O)C1=O,2 Z2347383324,CNC(C(C1)OCCN1c(c1c2)ccnc1cc(OC)c2OC)=O,0 F5033-5454,CSc1c(CN2CCC(CNC(C3Oc(cccc4)c4OC3)=O)CC2)cccc1,2 Z1984028314,CCc1nnnn1-c(cccc1)c1NC(C1(CC1)c1cc(Br)cnc1)=O,2 Z446394930,NC(c(cc1)cnc1N(CC1)CCN1C(NC1CC1)=O)=O,0 Z1455370293,OC([C@H](c1ccccc1)NC(c(cc1)cc2c1OCCCO2)=O)=O,2 Z2964916801,Cc1nccc(CCC(N(CC[C@@H]2CC3)[C@]23c2cnccc2)=O)n1,2 Z2296067236,CC(CC(O)=O)(c1cc(OC)ccc1)NC(C(CCC1)c2c1cccc2)=O,0 Z3416543485,CC(C)(C)CC(C)(C)C(N(C1)CC1(C(CC1)C(NC)=O)S1(=O)=O)=O,0 S727-0638,Cc1noc(C)c1CC(N(C1)CC1n1nnc(COc(cc2)ccc2F)c1)=O,2 Z2155382328,CCn1ncc(S(N(CCC2C(O)=O)CC2(F)F)(=O)=O)c1,0 V010-8743,CCc(c(CN(CC1OCCC1)C(NCC)=O)c1Oc(cc2)ccc2F)nn1-c1ccccc1,0 Z2771929680,Cn1c(N2CC(c(cc3)ccc3OC)OCC2)nc(cc2)c1cc2F,0 Z3081806706,CCc1cc(NC(c(n(CC)nc2)c2Br)=O)nc(C)n1,0 Z3645994430,CCC([C@@H](CCC1)N1C(c(cc1)ccc1C#C)=O)O,0 Z2757690476,C[C@@](CCC1)(C(O)=O)N1S(c1ccc(C(F)(F)F)cc1)(=O)=O,0 F6252-5860,Cn1c(cccc2)c2nc1CCNC(c(nnn1Cc2ccccc2)c1-n1cccc1)=O,2 D245-0010,Cc1nc2nc(-c3ccccc3)nn2c(N(CC2)CCN2c2cccc(C(F)(F)F)c2)c1,0 F532-4371,O=C(Nc(cc1)ccc1-c1noc(C2CCC2)n1)N1CCCCCC1,2 F6660-4341,COc(cc1)ccc1-c1n[nH]c(N2CCNCCC2)c1,2 G609-0190,O=C(c1cc2c(-c3ccccc3)onc2cc1)Nc(cc1)cc2c1OCCO2,2 Y206-5671,CC1OC(C)CN(CC(Nc2nc(C)c(C(N(C)C)=O)s2)=O)C1,2 F6657-1519,Fc1cccc(Cl)c1CSC1=NCCCN1,0 F5596-0830,O=C(c1nn(-c2ccccc2)nc1)N(CC1)CCC1c1nnc(-c(cc2)ccc2F)o1,2 D756-0003,O=C(CCCC(N1)=Nc(cccc2)c2C1=O)NCC[C@@H](C(Nc1c2cccc1)=O)NC2=O,2 SA46-0249,Cc(nccc1)c1C(N(C1)CC1(C1)OCC1N1CCOCC1)=O,0 Z2962762926,COc1ccc(C(C2CCC2)NC(c2cn(CCC3)c3n2)=O)cc1,2 Z2042391967,CC(Cn1ncc2c1cccc2)C(Nc(ccc(F)c1)c1F)=O,0 Z635481906,Oc1cccc(CNCCC(N2CCCCC2)=O)c1,2 SB21-1361,Cc1noc(C)c1COc(cc1)ccc1C(N(C1)[C@H](Cn2nnc(C(N)=O)c2)C[C@@H]1F)=O,2 F5581-3153,O=C(c1nccnc1)N(CCn1nccc1)c1nc(c(C(F)(F)F)ccc2)c2s1,2 F6662-1406,O=C(Cc1cccc2ccccc12)NCC(F)(F)F,0 Z994974572,OC(C1(CCCCC1)NC(Cc1cnccc1)=O)=O,0 C434-0135,CN(C(Cn1ncc2c1-c(cccc1)c1OC2=O)=O)c1cccc(C(F)(F)F)c1,2 E646-0404,CC(CN(CC1=O)S(C)(=O)=O)(C(NC2CCCCCC2)=O)N1c(cc1)ccc1Cl,0 Z1644105921,O=C(Nc1cn(CC(F)F)nc1)Nc1ncc(C2CCCCC2)s1,2 F6438-1401,CN(C)c1ccnc(CNS(Cc2ccccc2)(=O)=O)n1,2 8011-9011,CN(c1c(C(N2C)=O)n(CC(c3cc(OC)ccc3)=O)c(N3CCOCC3)n1)C2=O,0 Y207-1825,O=C(Nc1nc(CCCC2)c2s1)Nc1cc(CCC2)c2cc1,0 SC58-0183,Cc1cnc(C2C(C3)(CN3C(CCCc3ccccc3)=O)CN(C)C2)o1,2 Y042-2529,COc1cc(CCC2NC(C3(CCOCC3)c3ccccc3)=O)c2cc1OC,2 Z2182370767,OC1c(cccc2)c2OCC1NC(NC1CCN(Cc2ccncc2)CC1)=O,2 Z2512511250,CCC(C)(C)C(C)NS(c1ccc(CC(O)=O)cc1)(=O)=O,0 F6681-3355,O=C(C1c(cccc2)c2Oc2c1cccc2)N1CC(COc2cnccc2)C1,2 F363-0038,Cc(cc1)ccc1Sc(cc1)nnc1N(CCC1)CC1C(NC1CCCC1)=O,2 L498-0506,O=C(c(cc1)ccc1-c1nc(-c(cc2)ccc2F)no1)NCC1OCCC1,2 F6360-7890,COc1cc([nH]c(C(N(C2)CC2Oc2cccc(C(F)(F)F)n2)=O)c2)c2cc1,2 Z2790364968,OC(CCCS(N(CC1)CCC1c1cc(F)ccc1)(=O)=O)=O,0 F6573-2790,Cc(cc1)cc(C)c1C(NCCOCCn1nccc1)=O,0 Z2231253248,CC(C1CC1)(c1noc(C)n1)NC(C1CC1)=O,2 F3162-0095,CC(Nc(s1)nc(-c2ccccc2)c1Br)=O,0 Z3063570872,CCn1nnc(C(N(C)[C@@H](CC(C)C)C(O)=O)=O)c1,0 Z2089083927,CN(CCN1CCN(Cc2ccccc2)CC1)C(CNC(c1ncccc1O)=O)=O,2 Z1974710522,CC(Nc1nc(C(N[C@H](C2)C[C@@H]2c2ccc(C(F)(F)F)cc2)=O)cs1)=O,0 Y020-8914,CCc(nc1nc2C=CN3c4ncn[nH]4)nn1c(-c(cc1)ccc1OC)c2C3=O,0 V001-4910,CC(C1=O)N(Cc(ccc(F)c2)c2F)CCN1c(cc1)ccc1-c1ccccc1,0 T853-0581,COc(cc1)cc(CNC(C2(CCC(N3c4ccccc4)=O)C3=CCCC2)=O)c1OC,0 P658-0148F,Cc1nnc(-c2coc(S(N(CCC3)c4c3cccc4)(=O)=O)c2)o1,2 D074-0034,Oc(cccc1)c1-c1n[nH]c2c1C(c1cc(OCc3ccccc3)ccc1)N(CC1OCCC1)C2=O,2 Y041-6468,CC(Nc1cccc2c1ccn2CC(NC1CCCCCCC1)=O)=O,2 V016-3679,CC(C)CCN(CC(Cc1ccccc1)O)CC(N1)=Nc(sc2c3CCC(C)C2)c3C1=O,0 F6523-4421,O=C(COc(cccc1)c1F)N(CC1)CCN1c1nnc(CCCC2)c2c1,2 F6416-5501,Cc1csc(C(NCCC(c2cc(cccc3)c3o2)O)=O)c1,0 Z4662071734,CCOCn1nnc(C(Nc2cc(C)cc(C)c2)=O)c1N,0 F6543-4971,Fc(cc1)cc2c1OCCN(Cc1cnccc1)C2,0 F2864-0097,CCNC(C(C1)N(C(Nc(cccc2OC)c2OC)=O)c2c1cccc2)=O,0 F6524-1863,CCn1nc(C(N(CC2)CC2c2nocn2)=O)c(Cl)c1,2 Z453319864,Cc(cc1)ccc1C(Nc1cc2cccnc2cc1)=O,0 Y205-6649,COc(cc1)cc(NC(CSc2nnc(-c3ccco3)n2CC2OCCC2)=O)c1OC,2 Z1700918212,Cc(cc(cc1)NC(c2cccc(Cl)c2)=O)c1NC(N(CC1)CCN1C1CCCC1)=O,2 Y044-0425,COc1cc(CCN(C2)C(CN(C=Nc(cc3OC)c4cc3OC)C4=O)=O)c2cc1OC,2 F6515-4728,Cc(c(S(NCc1cncc(-c2cccs2)c1)(=O)=O)ccc1)c1Cl,2 Z3216020108,COC1CCC(CC(NS(c2nccc(Cl)c2)(=O)=O)=O)CC1,2 S932-7617,CC(C)n1ncc(CN(CC2)CC2n2nnc(COCc3ccccc3)c2)c1,0 Z2498104965,CC(C1CC1)n1ncc(NC(c2n[nH]c(-c3cn(C)cc3)c2)=O)c1,2 F6608-0475,FC(c(cn1)cc(Cl)c1OC1COC1)(F)F,0 F6548-3884,O=C(CC(C1=O)N=C2N1C(SCc(cccc1)c1F)=Nc1c2cccc1)NCc1cccs1,2 Z1928106290,CC(CC(N1c2c[nH]nc2CCC1)=O)(CC(N1c2c[nH]nc2CCC1)=O)c1ccccc1,2 Z1952130826,CCN(CC1)CCN1C(N[C@H](C1)C[C@@H]1c(cc1)ccc1Cl)=O,0 F5657-0074,CCOC(CCCOc1cc(C(CC2)=O)c2cc1)=O,0 Z1833660015,CC(C)(C)C(N(CC1)CCN1C(Nc1nc(OC)ncc1)=O)=O,2 S558-0901,Cc1c(CN(CC2)CC2Oc(cccc2)c2-c2nc(C3CC3)no2)scn1,2 F6562-5241,O=C(C1(CC(C2)C3)CC3CC2C1)NCCN(C=CC=N1)C1=O,2 Z2156311453,CN(C)C(c(cc1)ccc1-c1noc(-c(cccc2)c2OCC(N)=O)n1)=O,0 Z1404668349,COc(cc1)cc(C(N2C(CC(O)=O)COCC2)=O)c1O,0 Z2827922763,Cc1c(CNc(c(F)c2)ncc2Br)[nH]nc1C,0 F6672-1073,COc(cc1)cc(C(N(C(CC2)C3)C2CC3n2ncc(Cl)c2)=O)c1Br,0 F6286-0068,Cc1nc(CCNC(c(c(F)ccc2)c2F)=O)nc(C(F)(F)F)c1,0 G395-1686,O=C(CCc1nnc(cc2)n1nc2NCCCN(CCC1)C1=O)Nc(cc1)cc2c1OCCO2,2 Z2899285814,CC(C)N(C)S(N(C[C@@H]1C(O)=O)C[C@@H]1c1ccc(C)cc1)(=O)=O,0 SA69-1232,CC(CCC1)(CN1C(Nc(cc1)cc2c1OCCO2)=O)c1noc(-c(cc2)ccc2F)n1,2 S915-0045,Cn1nc(C(N(C[C@H](C2)N3C[C@H]2OC)CC3=O)=O)c2c1cccc2,2 Z1944187988,CC(CCC1)(CCN1C(c(cc1)ccc1-c1cnco1)=O)O,2 F3407-0602,Cc(cccc1)c1-c1csc(C(N2)=O)c1N=C2N(CCC1)CC1C(NCC=C)=O,0 F6464-0062,O=C(c1ncn[nH]1)N(CCCC1)CC1c1ccccc1,2 SB96-0051,Cc(occ1)c1C(N(CC1)CC1N(CCn1c(C)ncc1)S(C)(=O)=O)=O,2 G680-0482,Cc(n(C(c1cccc(S(N(C)C)(=O)=O)c1)=O)nc1C)c1S(N1CCOCC1)(=O)=O,2 S724-0936,CCn1ncc(S(N(C2)CC2n2nnc(C(N3CCOCC3)=O)c2)(=O)=O)c1,2 F6236-0055,O=S(c1cc(C(F)(F)F)ccc1)(N(CC1)CCN1c(cc1)nnc1-n1cncc1)=O,0 Z1444498674,CCC(C(O)=O)(c1ccccc1)NC(c1c(C)ncs1)=O,0 J030-0068,CC(CC1)CCN1S(c(cc1)cc2c1Oc(ccc(Cl)c1)c1NC2=O)(=O)=O,0 F6680-2779,O=C(CN(CC1)c2nc(cccc3)c3o2)N1c1cc(C(F)(F)F)ncc1,0 Z3952171733,O=C(C1CCC1)N(CC1)CC1(CC1)CCN1C(C1CCOCC1)=O,2 Z3466547235,O=C([C@@H](C1)[C@H]1c1ccnc2ccccc12)NC1CC1,2 SA66-0051,O=S(c(cc1)ccc1F)(N1CC(CCc2noc(-c3ccncc3)n2)CCC1)=O,0 Z1817618044,CC1OC(CO)CN(CC(N(C2)c(cccc3)c3NC2=O)=O)C1,2 Z1609475138,OC(c1cc(CC(N2CC(Cc3ccccc3)CC2)=O)ccc1)=O,0 Z364350016,OC(C1(CCCC1)NC(Cc1cc(Cl)c2OCCOc2c1)=O)=O,2 F6064-4473,COc(cccc1)c1-c1noc(C2CN(CC(Nc3cnccc3)=O)C2)n1,2 F377-0499,O=C(C(CCC1)CN1c1ccc(cc(cc2)S(N3CCCCC3)(=O)=O)c2n1)NC1CC1,2 F5097-0180,O=C(Cc(cc1)ccc1NC(c1cccs1)=O)N1CCOCC1,2 Z2157158987,CN(C(c1nc(-c2ccc(COC)cc2)no1)=Cc1c2cccc1)C2=O,2 Z2328129578,Oc1cccc([C@@H](C2)[C@H]2C(NCc2cnccc2)=O)c1,0 D401-0231,CSc(cc1)ccc1-c1c(Nc(cc2)ccc2C(NCc2ccco2)=O)n(ccnc2)c2n1,2 F5871-1332,CS(N1CCN(CCNC(c2c(C(F)(F)F)cccc2)=O)CC1)(=O)=O,0 Z2646590742,CCn1nccc1C(C(CC1)NC(CCc2cc(C(NC)=O)ccc2)=O)NC1=O,2 Z1835877259,CCCCc1ccc(CC(Nc2c[nH]nn2)=O)cc1,0 F6525-2625,Cc1cc(-c2cnccc2)nn1CCNC(NC1CCCCC1)=O,2 Z1245841422,O=C(C(CC1COC2)CC2C1=O)N1CCN(Cc2ccccc2)CC1,2 G411-0131,COc(ccc(Br)c1)c1C(NC(C(Oc1c2cccc1)=O)=C2N1CCCC1)=O,0 F0664-0190,Cc1c(C(Nc(cc2)ccc2-c2nc(ccc(C)c3)c3s2)=O)oc(C)n1,2 Z3687058683,Cc1c(C2(CCOCC2)C(N[C@@H](CC(Cn2cncc2)C2)[C@H]2O)=O)cccc1,0 8012-7187,Cc(cc1)cc(C2C3CCN(C)C2)c1N3C(Cn1c(C(N(C)C(N2C)=O)=O)c2nc1)=O,2 Z1420124882,C=CCN(CC1)CCC1NC(C(C=CN1)=CC1=O)=O,0 Z1739068514,CCN(CC(O)=O)S(c1c[nH]c(C(C)C)n1)(=O)=O,0 F6549-3652,O=S(c(cc1)ccc1-n1nccc1)(N1CC(Cn2ncnc2)C1)=O,2 C301-5684,COc(cc1)ccc1N(CC1)CCN1S(c(cc1)ccc1N(C(c1c2cccc1)=O)NC2=O)(=O)=O,0 Z3077781083,Cc1nc(-c2cccs2)nc(N(C2)CC2(c2cnnn2C)O)c1,2 Z3080589972,CCN(C(c1c(C(F)F)nc(C2CC2)o1)=O)c1cnccc1,2 F2148-0001,CC(C(c1cccs1)N(CC1)CCN1c(cc1)ccc1F)N,0 F6619-6164,Cc1nc(N2CCN(CC3(CCOCC3)O)CC2)cc(N2CCOCC2)n1,2 F6774-4105,COc(cn1)cnc1OC(CC1)CN1c1nccn2nc(C3CC3)cc12,2 SC69-0740,CCS(N(C1)CC2(CCCC2)C1c1nncn1C1CC1)(=O)=O,0 Z2221241971,CC(C)(C)C(NCC(CCC1)CN1C(c1c(C2CC2)ocn1)=O)=O,2 Y030-9123,CCCC(Nc(cc1)ccc1C(NCCC(C)C)=O)=O,0 L228-1212,O=S(c1ccc(-c2cnc(C3CCCC3)o2)s1)(NCCc(cc1)ccc1Cl)=O,0 SC42-0599,COCc1nc(CC2CC(CC3)(CCN3S(c3cnccc3)(=O)=O)OCC2)no1,0 4240-0457,Cc(cc1)ccc1S(N1CCN(Cc(cc2)cc(OC)c2OCc2ccccc2)CC1)(=O)=O,2 V001-2925,Cc1c(C)sc2nc(Cc3ccccc3)nc(N(CC3)CCN3C(C3CCCC3)=O)c12,2 L262-0632,Cc(cc1)ccc1-c1cc(N(CC2)CCN2C(NC2CCCCC2)=O)ncn1,0 Z4486250019,CC(C(C1)CN1C(c1c(C)onc1C)=O)NC(C(C1)C11CCCC1)=O,2 D399-3630,O=C(Nc(ccc(F)c1)c1F)N(CCC1)C1c(cc1)ccc1F,0 Z2698373795,O=C(C(C1C2)C1c1c2cccc1)Nc(cc1)cnc1Cl,0 F6125-3832,COC(c(cc1)ccc1NC(C(C1)CN1C(c1nccnc1)=O)=O)=O,0 S565-0850,Cn(c(CC1)c2CN1C(C1CC1)=O)nc2-c1nncn1CC1CC1,2 Z1067828752,Cn1nccc1S(N(CC1)C(CC(O)=O)c(cc2OC)c1cc2OC)(=O)=O,0 Y031-6429,CCC(C)(C)C(N(CC1)CCC1C(NC1CCCCCC1)=O)=O,0 Z2755519109,CC(C(O)=O)Oc(ccc(NC(c1c(C)onc1C)=O)c1)c1F,0 Z3189555453,CC(OCC1)=C1C(NCc1nc(cc(cc2)Cl)c2[nH]1)=O,0 Z4912610041,Cc1cc(C(CNC(c2csc(N3CCCCC3)n2)=O)O)cc(C)c1,0 F6561-1354,O=C(Cc1noc2c1cccc2)NCc1cncc(-c2ccco2)c1,2 G856-7584,O=C(COc(cc1)ccc1F)NC(CC1=O)CN1c(cc1)cc2c1OCCO2,2 Z1565268085,COCCN(CCN(C1)C(c2c3ncccn3nc2)=O)C1=O,2 SA92-0305,CC(C)CCNC(N(CCC1)CC1(c1nc(-c2ccncc2)no1)F)=O,0 Z883567776,O=C(CCN(CC1)CCN1C(Cc(cccc1)c1F)=O)NC1CCCC1,2 F6523-2914,CCn1c(-c2noc(CNC(c(cc3)cnc3OCC)=O)n2)ccc1,0 Z2227597985,CS(CC(CC1)CCN1C(c1cn(-c2ccccc2)nc1)=O)(=O)=O,0 SC04-0086,Cc1nc(CCOC2CN(Cc3nc(OC)ccc3)CCC2)no1,0 Z1546557696,CC(C)CN(Cc1nc(N2CCCCC2)nc(C)c1)C(c1cc(C(N)=O)c[nH]1)=O,2 Z1227939202,Cc1ccnn1-c(cc1)ccc1C(Nc1nc(C)ncc1)=O,2 E146-0527,CC(CCC1)C(C)C1N(CCCNC(c1noc-2c1COc1c2cccc1)=O)Cc1ccco1,2 S903-1343,CC(C)CC(N(CC1)CCC1c1nnc(C2)n1CCN2C(Cc1cccs1)=O)=O,0 Z2900816468,CC(C)OCCN(CC1)CCC1(CNC1)Oc2c1cccc2,0 J100-0132,O=C(C[C@H](C(Nc1c2cccc1)=O)NC2=O)N1CCN(Cc2ccccc2)CC1,2 S923-1026,CCC(N(CCCC1)C1c1nnc(CC2)n1CCN2C(c1nn(CC)cc1)=O)=O,2 F6211-0075,O=C(c1nn(CCCO2)c2c1)N(CC1)CCN1C(c1ccco1)=O,2 G504-0256,O=C(c(cc1)ccc1Br)Nc(cc1)cc(CCC2)c1N2S(c1cccs1)(=O)=O,0 Z2755418283,CC(C)(C1)OC(C)(C)C1NC(c1cc(C(O)=O)cnc1)=O,0 Z2597409316,OC(Cc1ccc(C(F)(F)F)cc1)CN(C[C@@H]1C(O)=O)C[C@@H]1c1ccccc1,0 6816-0041,CCC(CO)NC(C1=CC(C(CC(C)(C)C2)=O)=C2N(c(cc2)ccc2Cl)C1=O)=O,0 F6773-4144,FC(c1cc(N(CC2)CCC2Oc2nc3ccnn3cc2)ncc1)(F)F,0 Z753184526,CCOc1ccc(C(CCC2)N2C(NCc2cc(CN3CCOCC3)ccc2)=O)cc1,2 Z1154772840,Cc1c(C)sc(C(NCCc2cc(C(O)=O)ccc2)=O)c1,0 8525-0219,CCN(CCO1)C(CC(Nc(cc2)ccc2Cl)=O)C1=O,0 F5088-1004,COc(cc1)cc(-c(cc2)nnc2N(CC2)CCN2C(c(cccc2)c2Cl)=O)c1OC,2 F5832-1033,O=C(c1cscc1)NCC(c1ccco1)N(CC1)CCN1c(cc1)ccc1F,2 Z2799404574,OC(CNS(c1ccccc1)(=O)=O)c1cccc2ccccc12,0 Z2218823302,N#CC(CC1)CC1N(CCC1)CC1c1n[nH]c(-c2ccccc2)n1,2 Z2087134068,CC(CC1)(CCN1c(ccc(Cl)c1)c1C#N)C(NCc1cc(F)cc(F)c1)=O,2 F5971-0062,CC(CNC(C1=CC=CN(C)C1=O)=O)(COC)O,0 S582-0136,Cn1c(C(NCC(Cn2c3ccc2)N(C)C3=O)=O)ccc1,2 Z2220060053,N#Cc1c(CN(C2)Cc3c2cnn3-c2ccccc2)cccc1,2 F6525-2568,CC(C(NCCn(c(C)c1)nc1-c1cnccc1)=O)Oc(ccc(Cl)c1)c1Cl,2 F6343-0078,COCC(N1CCC(Cn2c3ncccc3cc2)CC1)=O,2 Z1630321950,CC(C)(C1)OCCC1NC(Nc(ccnc1)c1Br)=O,0 Z1827226643,Cn1nc(C(NC2(CCOCC2)C(O)=O)=O)c2c1cccc2,2 Z2007491202,Cn1c(N(CC2)CCC2c(cc2)ccc2Cl)nnc1C(c1c2cccc1)=NNC2=O,2 F2561-0029,COc(cccc1)c1NCc(n1CCCC2)nn3c1c2c(-c1ccccc1)c3,2 G122-1631,CC(C)CCNC(c1ccc(N(CC2)c3c2cccc3)s1)=O,2 Z3389952247,OC(C1(CC2(CCC2)C1)C(NCc1c[nH]nc1-c1ccccc1)=O)=O,2 F6477-5197,Cc1csc(-c2csc(NCc3ccccc3)n2)c1,2 F3225-4863,Cc(cc1)c(C)cc1S(C(c1nc2ccccc2nc1N1CCOCC1)C#N)(=O)=O,2 Z1797078745,CCC(C)(C1)OCCN1C(Nc(cc1)cnc1-n1nc(C)cc1C)=O,0 SB32-0164,Cc1n[nH]c([C@@H](C2)[C@@H](COC)CN2C(CCC2CCCCC2)=O)n1,2 Z1649800134,Cc(cc(cc1)C(N2C(CC(O)=O)COCC2)=O)c1Cl,0 F6502-3156,Cn1nc(C2CC2)cc1N(CC1)CCN1C(Nc1cccc(C(F)(F)F)c1)=O,0 Z2826015984,CC(C)n1ncc(C(N2[C@H](CNC3)[C@H]3CCC2)=O)c1Cl,2 Z2434835540,CC(C)C(C1(C2)CC=CC1)N2C(NCCc1c(cc[nH]2)c2ccc1)=O,2 Z2213354993,CCc(cc1)ccc1OC(C)C(N(CC1)CCN1C([C@@H](C1)[C@H]1C1CC1)=O)=O,2 M605-0148,CN1c2cccnc2SC(CC(NCC2CCCCC2)=O)C1=O,2 Z2617738495,O=C(c1ncc(Cc2ccccc2)o1)N1CCC(Cc2ccccc2)CC1,2 Z2897400140,CCCCc(cc1)ccc1NC(c(n(C)nc1)c1C(O)=O)=O,0 F6249-0326,COC(N(CC1)C(C(N(CC2)CCN2C(C2OCCC2)=O)=O)c2c1cccc2)=O,2 SB66-0787,COc(cc1)nc(OC)c1C(N(C[C@H]1CCC2)C[C@@H]1NC2=O)=O,0 Z1269950926,CCC(C(Nc1cc(-c2n[nH]c(C)n2)ccc1)=O)N(CCC1)C1=O,2 F6436-1004,Cc(n(C)nc1C)c1S(N(CCOC)Cc1cocc1)(=O)=O,0 F6524-0504,Cn(c(C(NCCN(C=Cc1c2occ1)C2=O)=O)c1)nc1-c1cccs1,2 Z3091717341,[O-][N+](c1cn(CCC(N(CCC(CC2)C3)C3C2O)=O)nc1)=O,2 Z3135528747,CC[C@H](c1nnc(N(C)C2CCC(CC)CC2)n1CCOC)O,2 Z1563200517,C(C1CC1)Oc1c(CN2CCC(CN3CCOCC3)CC2)cccc1,2 F6796-1589,CCn1c(ncnc2Nc(cccc3)c3OC(F)(F)F)c2nc1,0 F6523-1766,CC(C(NC(CC1)CCN1c1n[nH]c(C2CC2)c1)=O)n1nccc1,2 Y205-2385,O=C(c1c(cc(cc2)Cl)c2nc(-c2cnccc2)c1)Nc1cc(CCC2)c2cc1,2 C636-1408,CCOc(cc1)ccc1NC(CC(C(N1c(cc2)ccc2F)=O)N(CCc2c(C)ccs2)C1=O)=O,0 Z2505077226,CC(C)c1nn(Cc2ccccc2)c(NC(NCC2CCNCC2)=O)c1,2 S724-1350,O=C(C1(CC1)c1ccccc1)N(C1)CC1n1nnc(C(NCC2CC2)=O)c1,2 F1899-2163,Cc1cc(C)nn1-c(cc1)nnc1SCc1cn(cccc2)c2n1,2 F2493-0509,O=C(C(Oc1c2cccc1)=CC2=O)NCc1noc(-c(cc2)ccc2F)c1,2 Z2909748268,Cc1cc(C(N2CCC(CC(O)=O)CC2)=O)cc(O)n1,0 F5283-0112,CCN(CC)S(c(cc1)ccc1C(NCCN1N=CC=CC1=O)=O)(=O)=O,0 S624-0209,CN(CC1)C2(CCNCC2)c2c1c(cccc1)c1[nH]2,0 F6550-5128,COc(ccc(C(N(C1)CC1Nc1nccnc1)=O)c1OC)c1OC,0 F5075-4303,CC(C1=NC(C)=C2NC(Nc(cc3OC)cc(OC)c3OC)=O)=CC=CN1C2=O,0 V025-6081,CCC(C)c1nc(n(-c2ccccc2)nc2)c2c(N(CCC2)CCN2C(C2CCC2)=O)n1,2 F6178-4241,COc(ccc(CNC(NCC(CC1)CCN1c1ccncc1)=O)c1)c1OC,0 J006-1304,Cc1noc(C)c1C1N(Cc2cc(OCc3ccccc3)ccc2)CCC1,2 F2756-0254,CCc1cccc2c1nc(N(CCN1CCOCC1)C(c1ccco1)=O)s2,2 F6608-0275,FC(CC1)(CCC1Oc(nc1)ncc1Br)F,0 F6573-4491,CC(C)(C)NC(NCCOCCN(C(CC1)=O)C1=O)=O,0 M577-0670,Cc(cc1)ccc1-n1c(CC(NCCN2CCCCC2)=O)ccc1,2 Z1974045483,CCn1nc(C(F)(F)F)c(C(N2CC(Cc3cn(C)nc3)CC2)=O)c1,2 SD22-0169,COC1(CC1)C(C1)(CN1C(CCCc1c[nH]c2c1cccc2)=O)NC(c1ccccc1)=O,2 Z57718099,CS(Nc(cc1)ccc1-c1cn(cccn2)c2n1)(=O)=O,0 L507-1853,Cc(n(C)c(-c1nc(C)c(C(N2CCCCCC2)=O)s1)c1)c1S(N(C)Cc1ccco1)(=O)=O,2 Z2911839906,CC(C)(CC(NC1CC(C2)(CC2C(O)=O)OCC1)=O)C1CC1,2 F2496-0985,O=C(COc(cc1)ccc1Cl)OCc1noc(-c2cccs2)c1,2 Z637705488,CN(C)S(c(cc1)cc2c1nc(-c(cc1)cc(OC)c1OC)[nH]2)(=O)=O,0 Z3254885553,CCC(Cn(c1c2)ncc1ncc2Br)(C(F)(F)F)O,0 Z3470308117,CN(CC1)CCC1(C1(CC1)C(O)=O)O,0 Z1508542224,COc(ccc(CN(C=Nc1c2nnn1-c1ccccc1)C2=O)c1)c1Cl,0 E223-3764,CC(Cn1nc(C)cc11)(C(NCc2ccc(C)cc2)=O)N(c(cc2)cc3c2OCCO3)C1=O,2 F6300-0213,Cn(c(C(Nc1conc1)=O)c1)nc1-c(cc1)ccc1F,2 E470-1678,Cc1cc(N(CC2)CCN2S(c2c(C)cc3N(C)CCOc3c2)(=O)=O)c(C)cc1,2 D087-0550,CN(C)c(cc1)ccc1NS(C(CC1)CS1(=O)=O)(=O)=O,0 Z4561573999,NC(C(CC1)(CCN1C(NC(CCC1)c2c1nc(-c(cc1)ccc1F)s2)=O)c1ccccc1)=O,2 F6465-0012,CC(C)(Cc1ccc2)Oc1c2OCC(NCC(CN(C=CC=C1)C1=O)O)=O,2 G887-0716,CCc1cc2c(N(CCC3)CC3C(N3CCN(CC)CC3)=O)ncnc2s1,2 1935-0149,OC(c1cccc(N(C(C(C23)C4C=CC3C43CC3)=O)C2=O)c1)=O,2 F6427-0032,O=C(c(ccc(F)c1)c1F)NCCN(C(C=C1)=O)N=C1n1ncnc1,0 Z1426743623,COC(C1)CN1C(C1CSCC1)=O,2 SC68-0008,Cc(n(C)c(-c(cc1)ccc1F)c1)c1C(N(C1)CC2(CCCCC2)C1c1nncn1C)=O,2 Z3194583917,Cc1nc(SCC(Nc(cc2)ccc2OC)=O)nc(O)c1Cc1ccccc1,2 D715-0614,CC(C(NCCCC(O)=O)=O)Oc(cc1)c(C)c(O2)c1C(CCCC1)=C1C2=O,0 S984-1309,CC(C)C(N(C[C@@H]1CN(C2)C(Cc3ccc(C)cc3)=O)C[C@]12C(N1CCCC1)=O)=O,0 Z2951074636,Cc1noc(CC(CCC2)CN2C(Nc2cn(C)nc2OC)=O)n1,2 F6435-1430,CS(C(CC1)CCN1C(c1nccnc1)=O)(=O)=O,0 F997-0766,Cc(cccc1)c1S(N(Cc1cc(CN2CCOCC2)cs1)c1cc(F)ccc1)(=O)=O,0 J006-1150,Cc1ccc(C2N(Cc(cc(cc3)Cl)c3O)CCCCC2)s1,0 Z1610773064,CCNC(N(CC1)c2c1ccc(NCc1ncccc1)c2)=O,0 D007-0377,CC1N(CCN(C=Nc2c3[nH]c(cc4)c2cc4Cl)C3=O)CCCC1,0 G581-0222,CN(CCCNC(CN(c1cc(-c2cn(C)c3c2cccc3)nn1CC1)C1=O)=O)Cc1ccccc1,2 C390-0647,COc1cccc(-c2n[nH]c3c2C(c(cc(cc2)OC)c2OC)NC3=O)c1,0 L888-0391,CCn1c(SCC)nnc1-c1nn(C)c(CC2)c1CN2S(c1c(C)cccc1)(=O)=O,0 F6754-7592,CSc(nc1)nc(N(CC2)CCN2c(cccc2)c2F)c1C#N,0 F3315-0051,CCOC(c(cc1)ccc1Nc1nn2c(C)cc(C)nc2n1)=O,0 S827-2743,Cc(nc1)cnc1C(N(CC(C1)(F)F)[C@@H]1c1nc(COC)no1)=O,2 F5860-3934,O=C(Cn1nccc1)NCc(cc1)cc2c1OCO2,2 F6514-2780,O=C(C1(CCCC1)c(cc1)ccc1Cl)N(C1)CC1OCC(F)(F)F,0 Z4497727135,CCN(CCNC(C(CC(C1)O)N1C(Cc(cccc1)c1F)=O)=O)c1c(C)cccc1,2 F2356-1464,O=C(CN(CC1)CCC1C(NCc(cc1)ccc1OCc1ccccc1)=O)Nc(cc1)ccc1F,2 P316-0217,Cc(cc(cc1)S(NC(CCN2c(cc3)ccc3OC)C2=O)(=O)=O)c1F,0 F3150-8782,Cc1cccc(C)c1OCC(NCc1ccccc1)=O,0 F6471-0228,O=C(c(cc1)ccc1-n1cccc1)N(CC1)CC1n1nnc(-c2ccccc2)c1,2 SA53-0982,Cc1ccc(C(N(CCC2)CC(c3nc(C)n[nH]3)N2C(c2ccncc2)=O)=O)s1,2 Z1401210772,NC(c1cc(NC(CC2C=CCC2)=O)c[nH]1)=O,2 F6514-4138,O=C(NCc1cccs1)N(C1)CC1n1nnc(COc2ccccc2)c1,2 F345-1599,COC(c1cccc(NC(N2CCC(CC(NCc(cccc3)c3F)=O)CC2)=O)c1)=O,0 F6560-6750,O=C(NCc1cccs1)Nc(cc1)cnc1-c1ccncc1,2 F6559-1424,O=C(C1(CC(C2)C3)CC3CC2C1)NC(CC1)CCC1(F)F,0 F5893-0488,CCOc1ccc(cccc2NC(C(CC3)CCN3S(C)(=O)=O)=O)c2n1,2 S691-0817,Cc1cnc(CC(CC2)CN2S(c(cc2)cc3c2OCCO3)(=O)=O)n1CCOC,0 Z3223822559,CC(N(C)N(C1=O)c2ccccc2)=C1NS(c(c(C)c1)cc(C)c1Cl)(=O)=O,0 C137-2403,O=C(C1CC1)N(CCc1c2)c1cc(S(NCCN(CCC1)c3c1cccc3)(=O)=O)c2Br,2 Z1364048099,CCN(CCC1)CC1NC(N(CCC1)CCN1C(CCc1ccccc1)=O)=O,2 F6559-1106,O=C(C1(CCCC1)c1cccs1)N(CC1)CC1n1c(cccc2)c2nc1,2 F6733-1946,O=S(CC1)(CCN1c1ncnc(C2CC2)c1F)=O,2 S976-1215,O=C(C(CCC1)(CN1C(NCc(cc1)ccc1OC(F)(F)F)=O)F)NCC1CC1,2 F6556-0737,OC(CNC(c1cnc(C(F)(F)F)cc1)=O)(CSC1)c2c1cccc2,2 Z928220684,CC(C)(C1)OCCN1C(c1cc(OCC(O)=O)ccc1)=O,0 Z2170757824,O=C(c(cc1)ccc1NC(N(CC1)CC1n1ncc(Cl)c1)=O)NCCc1ccccc1,0 F6805-5591,CN(C(CC1)CCN1c1cnc(C(F)(F)F)cc1)c(nc1)ncc1Cl,2 F6436-1753,COc1ccc(C2(CNC(N(CCN3)C3=O)=O)CCOCC2)cc1,2 F6441-2421,O=C(CCC(N(CC1)CCC1S(c1ccccc1)(=O)=O)=O)c1ccccc1,2 Z4416748956,OC(c1cc(-n2nnc(C(C3CCOCC3)NC(c3cc(F)cnc3)=O)c2)cnc1)=O,2 Y021-2782,CCc(cc1)ccc1N(C(C(C1N2)C3=C2N=C(NCCOC)NC3=O)=O)C1=O,2 Z2056058661,CN(C[C@H]([C@H]1CCC2)N2C(CN(C(C=CN2Cc3ccccc3)=O)C2=O)=O)C1=O,2 SB70-0041,CN(C)[C@@H](Cc1c2)Cn1nc2C(NCCCN(C)Cc1ccccc1)=O,2 F6218-0065,CC(C)(C(Nc1cnc(-n2nccc2)nc1)=O)Oc(cc1)ccc1Cl,0 Z1675859816,CC(CN(C1CC1)C(c1cc2nccnc2nc1)=O)C#N,2 Z2966755105,C[C@@H](C(NCCC1)=O)N1C(c1nn(C)c(OC(F)F)c1)=O,2 Z2296004030,CC(C1CC1)C(N(C)c(cc1)ccc1OCC(O)=O)=O,0 Z426124028,CC(C)c1nc(COc(cc2)ccc2Br)cs1,0 T158-1582,CCn1ncc(S(N(CC2)CC2c2ncc(C)n2Cc(cc2)ccc2F)(=O)=O)c1,2 Z2595689257,CC(C)(C)C(NCc1c(C(O)=O)occ1)=O,0 Z1246268707,CCc1ccc(C(CCCCC2)N2C(CN(C=CC=C2C(F)(F)F)C2=O)=O)o1,0 F6563-0017,Cc1cc(C(N(CC2)CCC2Oc2cscc2)=O)no1,2 Z1652296947,C(C1COCC1)OC(CC1)CCN1c1ncnc2c1cc[nH]2,2 SC19-0618,CCn1nc(CN(CC2)CCC2NS(c2c(C)onc2C)(=O)=O)c2c1CCOC2,2 Z1172356485,CC(C)c1cc(N(CC2)CCN2C(c(cc2)cc3c2OCO3)=O)ncn1,2 F5496-0004,CCc1nnc(C(CC2)CCN2C(c2noc(C)c2)=O)s1,2 F5882-6647,COC(N1CCN(CCNC(Nc2c(C(F)(F)F)cccc2)=O)CC1)=O,0 S582-0076,CN(C(CNC(NCCc1ccccc1)=O)Cn1c2ccc1)C2=O,0 S530-0037,CN(CC1)CCC1(CN(C1)C(CCOC)=O)Oc2c1cccc2,0 S932-2948,O=C(CCCc1ccccc1)N(CC1)CC1n1nnc(COCC2CC2)c1,2 Z3056517914,CC(c1nnnn1C)NC([C@@H](C1)[C@H]1c1cnccc1)=O,2 SB04-0630,CN(C)C(N(CC1)CC1N(CCN(C)C(c1n[nH]cc1)=O)C1CCOCC1)=O,0 Z3686252404,C[C@H]1N(C)[C@@](CNS(c2c(cccc3)c3nn2C)(=O)=O)(CO)COC1,2 F726-0338,O=C(C(CCC1)CN1c1ccnc(-c(cc2)ccc2F)n1)NCCC1=CCCCC1,2 Z1277178113,CCN(CC)C(CC1)CN1C(N(CCC1)c(cc2)c1cc2S(N(CC)CC)(=O)=O)=O,0 Y207-3939,CC(CC(C)C1)CN1S(c(cc1)ccc1NS(c1c(C)ccc(C)c1)(=O)=O)(=O)=O,0 F2265-0510,CCOc1cccc2c1oc(C(Nc1nc(C)ccc1)=O)c2,2 Z1890002994,OCCNC(c(c(F)ccc1)c1Sc(cc1)ccc1Cl)=O,0 Z2959349784,Cc(ccnc1)c1N(CC1)CCN1C(c1cc2cccn2cn1)=O,2 F6374-1628,COc(cc1)ccc1SCC(CC1)CCN1C(c(cccc1)c1Br)=O,0 Z1779169332,Cc(sc(Br)c1)c1S(N(C)CC1(CO)CC1)(=O)=O,0 J500-0460,CC(C)NC(C(C1)C2(CCCC2)CN1C(c1c(C)n(CCCOC)c(C)c1)=O)=O,0 Z1699379692,OC(CC1)(CCN1S(c1cc(C(NCC2)=O)c2cc1)(=O)=O)c1ccccc1,2 SA65-1055,COc(cc1)ccc1S(N1CCC(CCc2noc(C3CC3)n2)CC1)(=O)=O,0 SB15-0094,CS(N(CCC1)CC1N(C1CCOCC1)C(c1ncncc1)=O)(=O)=O,2 Z3139812238,NC(C1)C2(CCOCC2)C1NC(c(cc1C(F)(F)F)nn1-c1ccccc1)=O,2 L950-0199,Cc(cc(cc1)S(N(CCC2)C2c2nc(-c(cc3)ccc3Cl)no2)(=O)=O)c1F,0 F0545-1365,O=C(CSc1c[nH]c2c1cccc2)N(CC1)CCN1c1ccccc1,2 T151-0413,Cc1cnc(CCNC(C2CC2)=O)n1C1CCCC1,2 Z757850116,Cc1ccc(Cn(c2nc(C)c3)ncc2c3C(Nc2cn(CC(NC)=O)nc2)=O)cc1,2 Z3016332410,COC(c1c(CN2CC(CCO)CCC2)oc(Br)c1)=O,0 Z1639302840,CC(C)n1c(C(CCC2)CN2S(c2c(C)c(F)ccc2)(=O)=O)nnc1,0 SC21-0105,CCn(cc1)nc1C(N(CC1)Cc2c1n(CC)nc2-c1ncc(C)n1CC1CC1)=O,2 F6089-4350,O=C(C1CCCC1)N(CC1)c2c1ccc(NC(c(cc1)cc3c1ncs3)=O)c2,2 V014-5559,CCC(C)C(C(N(CC1)CC(C)N1C(CCC1CCCC1)=O)=O)NC(Nc(cc1)ccc1OC)=O,2 F6612-0069,O=C(Nc1ccc(C(F)(F)F)cc1)N1c2nc(N3CCOCC3)ncc2CCC1,2 Z3687067751,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NC(c1cnc2OCCCc2c1)=O,2 Z4917830989,COc(cc1)ccc1-c1cc(NC(c2cc(-c(cccc3)c3Cl)no2)=O)ncn1,0 F6442-7155,O=C(c1cc(-c2ccco2)n[nH]1)N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F,2 F167-0093,CC(C)(c1ccccc1)c(cc1)ccc1Oc1nc2ccccc2nc1N1CCOCC1,2 SA66-0900,O=C(C1(CC1)c1ccccc1)N1CC(CCc2noc(-c3ncccc3)n2)CCC1,2 Z2196028399,O=C(c1ncnc(Nc2ccccc2)c1)N(CC1CC1)C1CCCCC1,2 Z2143170724,Cc1nsc(N2CC3(CC3)CC2)c1C#N,2 F1835-0213,Clc(ccc(CSc1nn2c(-c3ncccc3)nnc2cc1)c1)c1Cl,2 SA49-1485,O=C(CC1CCCC1)N(C1)CC11OCC(CC(N2CCOCC2)=O)C1,2 F2434-1198,Cc(cc1NC(c2ncc(-c3ccccc3)o2)=O)nn1-c1ccccc1,2 Z1391781545,CC(C)(C)n(c(C)c1)nc1C(Nc1c(C)nc(C)cc1)=O,0 F6617-6707,CCOC(C(C1c2cn(-c(cccc3)c3F)nn2)=C(C)NC(C)=C1C(OCC)=O)=O,2 F6514-2292,CS(c1ccc(CCC(NC(C2CCOCC2)c2cnccc2)=O)cc1)(=O)=O,0 F6525-7624,O=C(C1CC=CCC1)NCCn1ncc(-c2cocc2)c1,2 S776-1611,Cc1cnc(-c2ccccc2)n1CCC(CC1)CCN1C(C1(CC1)c1ccccc1)=O,2 F5581-0290,Cc1cccc(C(N(CCn2nccc2)c(sc2ccc3)nc2c3Cl)=O)c1,0 G373-1613,COc1ccc(CNC(CN(CCN(C2CCCCC2)C2=O)C2=O)=O)cc1,2 L009-0171,O=C(c1cc(-c(cc2)nnc2N2CCCCC2)ccc1)NCCC1=CCCCC1,2 F6400-0117,CN(C)CC(CSCCC1)N1C(c1cccc(Cl)c1)=O,2 F6024-0529,Cc1cccc2c1nc(NC(C1(CC1)c1noc(-c3ccco3)c1)=O)s2,2 F6689-3351,Cc1noc(C)c1CN1CCC(CN(C)c2nccnc2OC)CC1,2 D627-0047,CN(C(CC1)CS1(=O)=O)C(c1nn(C(CC2)CS2(=O)=O)c(-c2cccs2)c1)=O,2 Z3140021454,C[C@H](c(ccc(OC)c1)c1OC)NC(N(CC1)C(C)CC1(F)F)=O,0 F6521-1780,CC(c1ccc(C2(CNC(c3cnc(C(F)(F)F)cc3)=O)CCCC2)s1)O,2 Z1563139562,Cc1cc2cccnc2c(NS(c(cc2)ccc2C(NC)=O)(=O)=O)c1,0 Z2460731902,CC(C)(C(NCc(cc1)ccc1-c(cc1)cc2c1OCC2)=O)C(O)=O,0 F6178-7057,COc(cccc1)c1OCC(NCC(CC1)CCN1C1CCOCC1)=O,0 F6448-1105,CCOCC(Nc1cn(CC2CCOCC2)nc1)=O,0 F5772-6405,O=C(c(cc1)cc(nc2)c1n2-c1ccccc1)NCc1nc(cccc2)c2[nH]1,2 Z2771958430,Cn1ncc2c1ncnc2N[C@@H]1[C@@H](c(cc2)ccc2Cl)OCCC1,2 F6491-2668,Cc1cc(C)nc2nc(C(N(CCC3)CC3Oc3nccnc3N(C)C)=O)nn12,2 F184-3503,CCC1Oc2cc(S(N(CCC3)CC3C(Nc3cc(C)cc(C)c3)=O)(=O)=O)c(C)cc2NC1=O,0 D445-0147,Cc(cc(cc1)N(C(CC2)=O)S2(=O)=O)c1S(NC1CC1)(=O)=O,0 E852-1030,CC(C)CCNC(C(C)(Cn(c1c2)nc2C(NCCc2c[nH]c3c2cccc3)=O)N(C)C1=O)=O,2 S963-0237,CCOc(cc1)ccc1S(N[C@@H](CN(C)C1)[C@H]1C(NC)=O)(=O)=O,0 Z236358172,CC(C)n1nnnc1SCc1cn(cccc2C(OC)=O)c2n1,0 Z1716545734,OC(c([nH]c1cc(Br)c2)cc1c2Cl)=O,0 V010-4286,COCCN(CC(N(CC1)C(COc(cccc2)c2OC)c2c1scc2)=O)C(C1CCCC1)=O,0 7472-0047,CCOc(cc1)ccc1NC(CSc1nc2ccccc2nc1N1CC(C)OC(C)C1)=O,0 F1657-1833,NS(c(c1ccccc11)ccc1Br)(=O)=O,0 F6672-0911,Brc1cn(C2CC(CC3)N(CCn4nccn4)C3C2)nc1,2 Z1203968091,Cc1cc(CC(N(CC2)CCC2NC(c2ccccc2)=O)=O)no1,0 V025-8785,O=C(CN(C1CC1)C(Nc1cccc(Cl)c1)=O)N(CC1)C(COc2ccccc2)c2c1scc2,2 SC11-1214,CC(C)C(N(CCCN1CCCC1)C(CCC1)CN1S(c1cccs1)(=O)=O)=O,0 Z1183497962,Cc(ccc(C(NC)=O)c1)c1NC(c1nc(C2CC2)ncc1)=O,0 F6507-5783,Cn1c(C(CCNC(c2noc(-c3ccco3)c2)=O)O)ccc1,2 F6550-4638,Cc(onc1)c1C(N(C1)CC1Nc1ncccn1)=O,2 G835-0117,CC(CCC1=NN2CC(Nc3cc(OC)cc(OC)c3)=O)CC1=CC2=O,0 F6479-2873,O=S(N(CC1)CCC1Oc1ccncc1)(N1CCOCC1)=O,2 Z990454496,C(c1noc(C2CCOCC2)n1)N1CCCCC1,2 F3411-1648,Cc1noc(CN(C(c(cc2OCOc2c2)c2N2Cc3ccc(C)cc3)=O)C2=O)n1,2 F2705-0149,CC(C(C)=O)N(C(c1c(N2C)nc3oc(-c4ccccc4)cn13)=O)C2=O,2 E786-1947,O=C(c1c2nccc1)N(Cc(s1)ccc1S(N(CCC1)c3c1cccc3)(=O)=O)C2=O,2 F5791-3498,Cn1nnc(C(N(CC2)CCN2C(c2ccccc2)c2ccccc2)=O)c1,2 F9994-0346,CN(C)c1cccc(C(Nc2cc3ncnc(N4CCCCC4)c3cc2)=O)c1,2 F6250-0521,O=C(C1CC=CCC1)NC(CCC1)CC1OC(Nc(cc1)ccc1F)=O,2 Z1373424119,Fc1cccnc1NCC1(CCOCC1)c1cccc(Br)c1,0 SA65-1122,Cc1c(C(N2CCC(CCc3noc(C4CCOCC4)n3)CC2)=O)scc1,0 T636-2180,CCn(cc1)nc1C(N(CCC1)CC1Nc1ncnc2c1CCC2)=O,2 D724-0892,Cc(cc(n1nc2)N(CC3)CCN3c3ccccc3)nc1c2-c(cccc1)c1OC,0 S511-0481,Cc1c(CN(CC2)CCC22OCCC(CC(NC3CC3)=O)C2)scc1,2 F6802-6066,CN(C(CC1)CCN1c(c(C(F)(F)F)c1)ncc1Br)S(C1CC1)(=O)=O,0 SD69-0454,CC(C)C[C@@H](Cn1nnc(C(N(CC2)CCC2N2CCOCC2)=O)c11)NC1=O,2 V012-8134,CCC(C)N(Cc(cc(cc1)NC(C2CCCC2)=O)c1N(C)C)C(COC)=O,0 Z1866635207,CC1(CC(N2CC(C3)(CC3(F)F)C2)=O)CC1,2 F6452-2530,COC1(CNC(C(Nc(cc2)ccc2C(OC)=O)=O)=O)C2CC(C3)CC1CC3C2,0 S915-0084,CO[C@@H](C[C@H]1CN(C2)C(Nc(cc3)cc4c3OCCO4)=O)CN1C2=O,2 L372-0945,CN(C)c1ccc(CNC(C2=CC(C(CCC3)=O)=C3N(c3ccc(C(F)(F)F)cc3)C2=O)=O)cc1,2 V011-7216,O=C(c(ccc(F)c1)c1F)Nc(cc1)cnc1N(CC1)CCN1C(c(ccc(F)c1)c1F)=O,2 F6561-5946,Cn1ncc(-c2nccc(CNC(Cc3noc4c3cccc4)=O)c2)c1,2 F6511-9289,CC(c1cn(-c2cccc(Br)c2)nn1)O,0 F3394-0455,O=C(CSc1nc2ccccc2cc1)N1CCOCC1,2 F2987-0128,Cc1cc(C)c(CC(Nc2nnc(CSc3ccccc3)o2)=O)cc1,2 F2024-0360,Cc(cc1)ccc1N(CC(C1)NC(NCCCn2cncc2)=O)C1=O,2 F6360-9517,O=C(Nc1cccs1)N(C1)CC1Oc1cnccc1,2 Z2733278563,COC(c([nH]c1cc(Cl)c2)cc1c2F)=O,0 F6436-0115,Cc(onc1)c1C(N1CC(c2ccccc2)OCC1)=O,2 F6680-2772,O=C(CN(CC1)c2nc(C3CC3)ncc2)N1c1cc(C(F)(F)F)ncc1,2 Z1601572819,Cc1cc(S(Nc2cnc(C3CC3)nc2)(=O)=O)c(C)o1,2 J006-2723,CC(C)c1noc(C2N(Cc3c[nH]nc3-c3cccs3)CCC2)c1,2 Z1822241503,CC(C)CCc1n[nH]c(NC(c2c[nH]nn2)=O)c1,0 F6481-1015,O=C(NCc(cc1)ccc1F)N(CC1)CCSC1c(cccc1)c1Cl,2 F6725-2695,Cn1ncc(-c2nccc(CNc3nccc(C(F)(F)F)n3)c2)c1,0 F1065-0459,O=C(C1C(c2ncccc2)N(c2ccccc2)OC1C1=O)N1c1cccc(C(F)(F)F)c1,2 F0298-0257,COc1cc(C(Nc(ccc(Br)c2)c2C(c2ccccc2)=O)=O)cc(OC)c1OC,0 F6353-5874,COc(ccc(S(NCC(c1cocc1)N1CCSCC1)(=O)=O)c1)c1Cl,0 8015-9050,Cc1cc(CC(CC(O)=O)C(Nc2cc(Br)c(C)cc2)=O)cc(C)c1,0 Z2963065823,O=C(c1noc(COc(cccc2)c2F)c1)NC[C@@]1(C2)[C@H]2CCC1,2 F5027-0045,O=C(c(ccc(Cl)c1)c1Cl)N1CC(c2ccccc2)OCC1,0 F6166-0059,CCC(C(N(CC1)CCN1c1ncnc(-c2ccccc2)c1)=O)c1ccccc1,0 F6529-0012,CN(c(cccc1)c1N1C(CC2)CCN2C(Cn2c(cccc3)c3nc2)=O)S1(=O)=O,2 F6656-3953,CC(C)(C)C(C=C1)=NN(C(CC2)CCN2C(COc(ccc(C)c2)c2OC)=O)C1=O,2 F6727-8171,Cc1nc2ncnn2c(N(C2)CC2N(C(C=C2)=O)N=C2c(cccc2)c2OC)c1,2 F2477-0103,Cc(cc1)ccc1OCC(Cn1c(SC)nc(N(C)C(N2C)=O)c1C2=O)O,0 F6178-4106,O=C(Cc1cccc2ccccc12)NCC(CC1)CCN1c1ccncc1,2 J097-0575,CCC(C)NC(c(cc1C)cc(-c2c3cccc2)c1N(C)S3(=O)=O)=O,0 8017-6267,Cn1c(C(c(cc2)ccc2NS(c(cc2)cc3c2oc2c3cccc2)(=O)=O)O)ncc1,2 J005-1075,CCc1noc(C(CCC2)N2S(c2cccc(Cl)c2)(=O)=O)c1,0 F6755-2716,Cc1cccc(N(CC2)CCN2C(C(N2C)=O)=CN(C)C2=O)c1C,2 S691-1311,CCCn1c(CC(CC2)CN2S(c2cccs2)(=O)=O)ncc1C,2 V027-6679,CCNC(N(CC1)C(C)CN1c1cc(Oc(cc2)cc(F)c2F)ncn1)=O,0 Z3611508442,CCC(C(Nc1nc2cccnc2s1)=O)N(CCC1)C1=O,2 Z2276653835,O=C(C(CC1)CN1c1ccccc1)N(CCC1)CC1Oc(nccc1)c1F,2 F6439-7370,O=C(COc(cccc1)c1F)NCCn1c2ccnn2cc1,0 F2323-3104,O=C(c1nccnc1)NCCn1ncc2c1N=CN(Cc1cccc(F)c1)C2=O,2 Z1653306549,O=C(CN(CC1)CC1Oc1cc(F)ccc1)Nc1nc(CCC2)c2s1,0 G017-1495,CC(C)CC(C(Nc1cc(OC)cc(OC)c1)=O)NS(c(cc1)cc(CCC2)c1NC2=O)(=O)=O,0 F5855-0564,CN(C)c1cccc(C(N(CC2)CCN2C(C(C2)C2c(cc2)cc3c2OCO3)=O)=O)c1,0 F6000-0217,Cc1cc(C(NCCCC(Nc2cccc3cccnc23)=O)=O)c(C)o1,2 Z1420839949,CC1(CC1)C(NC(CC1)CN1c(nccc1)c1Cl)=O,2 Z3369017701,CC(c1noc(CNC(OC)=O)n1)Oc(ccc(Br)c1)c1Cl,0 F6543-1574,Cn1nc(C(CCC2)CN2C(c2ccco2)=O)cc1,2 F5854-1126,COc1cccc(NC(N(Cc2cscc2)Cc2ncccc2)=O)c1OC,0 F3222-5456,O=C(Nc1c2cccc1)N=C2NCc1cccs1,2 F5596-1099,CCOC(CNC(CN(CC1)CCC1c1nnc(C(C)C)o1)=O)=O,0 Y044-2882,O=C(C(CC1=O)CN1c(cc1)ccc1Cl)N1CCNCC1,0 F6451-0759,Cc1ccc(C(CNC(CCc(cccc2)c2Br)=O)OC)s1,0 Y042-6942,Cn1c(cccc2)c2nc1CCNC(CC1(CCCCC1)n1cccc1)=O,2 Z1603514631,OC(C(Cc1ccccc1)CNC(C1COCCC1)=O)=O,0 SB95-1103,O=S(Cc1cc(F)ccc1)(N(CCN1CCCC1)C1CNCCC1)=O,0 F6525-1359,COC(c(cc1)ccc1C(NCCn(cc1)nc1-c1nccnc1)=O)=O,0 F3411-5791,Cc(cccc1)c1C(N(CC1)CCC1(NC1=O)N=C1c1cc(OC)ccc1)=O,0 F6554-1170,Cn1nc(C(CCC2)CN2S(CCC(F)(F)F)(=O)=O)cc1,0 D064-0020,Brc(cccc1)c1-c1nnc2sc(C3Oc(cccc4)c4OC3)nn12,0 F6516-0722,Cc(onc1)c1C(NCc1ccc(-c2ccco2)o1)=O,2 F5496-0354,Cc1nnc(C(CC2)CCN2C(c(cc2)ccc2-n2cccc2)=O)s1,2 S903-0273,CN(C)C(N(CC1)CCC1c1nnc(C2)n1CCN2C(c1nn(C)c2c1cccc2)=O)=O,2 F6349-0931,O=C(c1nc(cccc2)c2s1)Nc1cc(-c2cnc3n2CCC3)ccc1,2 F5283-0225,O=C(c1cc(Br)cnc1)NCCN1N=CC=CC1=O,0 F6089-7571,CC(C)(Cc1ccc2)Oc1c2OCC(N(Cc1cccn1C)Cc1cccs1)=O,2 F5788-4089,CCC(CO)NC(CN(CCN1c(cc2)cc3c2OCCO3)C1=O)=O,2 F6178-6567,O=C(CSc(cc1)ccc1F)NCC(CC1)CCN1C(c1cocc1)=O,2 P223-0151,O=C(COc(cc1)ccc1F)N(CCC1)CC1c1nn(CCCNC2=O)c2c1,2 S692-0523,Cc1cnc(C2CCOCC2)n1C(CCC1)CN1S(c1ccccc1)(=O)=O,2 G195-0701,CC(C(c1cc(C)c(C)cc1)=O)SC1=NC=CN(c(cc2)ccc2Cl)C1=O,0 S726-0030,COc(cc1)nc(OC)c1C(N(CC1)CCC11OCCC(CCO)C1)=O,0 F6436-1006,Cc(onc1)c1C(N(CCOC)Cc1cocc1)=O,2 SB03-0413,CC(N(CCC1)CC1N(CCNC(c1cccs1)=O)C1CCOCC1)=O,0 Z1609483420,OC(c1cc(CC(NCC(N2CCCCC2)=O)=O)ccc1)=O,2 T408-2097,O=C(C(CC1)Cc2c1sc(C(N1CCCCC1)=O)c2)NCCN1CCOCC1,2 F6541-2947,N#CC1CCN(Cc(cc2)cc3c2OCCO3)CC1,0 Z1954822442,Cc(cc(C)c(OC)c1)c1NC(c1c(cccc2)n2nc1)=O,0 Z3075967311,COc(cc1)ccc1-c1cc(Nc2cn(CCN3CCOCC3)nc2)ncn1,2 F6562-4560,CN(C)c1nc(CCC(C2)NS(c3c(C(F)(F)F)cccc3)(=O)=O)c2cn1,2 SA01-0692,CC(C)NC(c1c(C2CN(Cc3ccc(C)o3)CC2)nc(N(C)C)nc1)=O,0 Z4021165334,O=C([C@H](C1)[C@H]1F)N(CC1)CCC1c([nH]c1ccc2)nc1c2F,0 Z1143655922,CC(C(NCC1)=O)N1C(NCc(s1)ccc1Br)=O,0 F6439-3310,Cc(cc(cc1)F)c1S(NCCn1nc(C2CC2)cc1C1CC1)(=O)=O,2 Z2595671669,OC(C(C1)(CC1C1)N1C(c1cccc(NC(c2cccs2)=O)c1)=O)=O,2 Z2091970019,Cc(cc1)cc(N(CC(C2)C(N3Cc(ccc(O)c4)c4OCC3)=O)C2=O)c1OC,0 F6559-0942,O=C(C1(CCCC1)c1cccs1)N(CC1)CCC1N(C1=O)N=Nc2c1scc2,2 F6400-0707,O=C(NCCc1ccccc1)N1C(CN2CCCC2)CSCCC1,2 Z875631094,O=C(CN(CCC1)C1=O)N(CC1)CCN1c(cc1)ncc1Cl,0 Z1601618798,CC(C1)OCCC1C(Nc1ncc(Cc(cc2)ccc2F)s1)=O,2 Z1686718672,CC(c1nc(-c(cc2)cc(C)c2F)no1)Nc1cn(CC(NC)=O)nc1,0 F6573-2909,O=C(CN(C=NC(C1CC1)=C1)C1=O)NCCOCCn1nccc1,2 F5865-0040,O=C(c1ncccn1)NCCC(c1ccccc1)c1ccccc1,2 Z4872561228,CC(C(CNS(c(sc1c2cccc1)c2Cl)(=O)=O)O)c1ccccc1,0 V021-5691,CCC(C)NC(C(C)N(CC1)CCN1c1cccc(Cl)c1)=O,0 F6471-3769,CN(c1c(C(N2C)=O)n(CC(N(C3)CC3Oc3nccs3)=O)cn1)C2=O,2 Z2435995843,CC(c(cc1)ccc1C(N(CC1)CCN1c(cc1)ncc1Cl)=O)N,0 F6439-0872,O=C(c1nc(cccc2)c2s1)NCCn(c1c2CCCC1)nc2-c1ncccc1,2 C884-1282,CCC(C(NC(C)c1ccccc1)=O)n1c(C(NN=C2)=O)c2c2c1cccc2,0 SA72-0979,COCCC(CC1)(CCN1S(N1CCOCC1)(=O)=O)c1noc(-c2ccncc2)n1,2 Z3077811217,Cn1ncnc1C(CC1)(CCN1c1nc(C(F)(F)F)cs1)O,2 F6472-7688,O=C(c1cc(OCc2ccccc2)ccc1)N(C1)CC1N(CC1)Cc2c1cccc2,2 F1174-3159,CC1CCN(CC(Nc2c(C(OC)=O)c(-c3ccco3)cs2)=O)CC1,2 Z1130627821,CC(N1CCC(CNC(NCc(cc(cc2)F)c2F)=O)CC1)=O,0 F6609-1844,O=C(COC(c1cc(Br)cnc1)=O)N(CC1)c2c1cccc2,2 Z1738264388,CN(C)CC(CC1)CN1C(Nc1cn(C)nc1-c1ccccc1)=O,2 SA67-0812,O=C(Cc1cscc1)N1CC(CCc2noc(C3CCOCC3)n2)CC1,2 Z333377726,CCC(N1CC(c(cc2)ccc2F)OCC1)=O,0 Z1817195210,COC(c1nc(NC(CN(C[C@@H](C2)O)C[C@H]2O)=O)ccc1)=O,0 Z3104749524,O=C(Cc1cc2cccnc2cc1)N(CC1)CCC1C1CNCC1,2 F3407-0168,CC(C)(C)c1noc(-c2cc(-n3cnc(C(NCc(cc4)ccc4Cl)=O)c3)ncc2)n1,2 Y020-0411,CCc(cc1)ccc1N(C(CC1N(CC2)CCN2c(cccc2)c2F)=O)C1=O,0 Z1682252500,COc(cc1)c(CC(O)=O)cc1S(N1CC(CN2CCCCC2)CC1)(=O)=O,2 F5822-0093,O=C(C1(CCCC1)c(cc1)ccc1Cl)N1CCC(Cn2cncc2)CC1,2 F3007-0381,O=C1N(Cc2ccco2)C(SCc2nc(cccc3)c3[nH]2)=Nc2c1c(CCC1)c1s2,2 F5782-0154,O=C(Cc1noc2c1cccc2)NCC(CC1)CCC1c1nc(cccc2)c2[nH]1,2 Z2143911024,CN(CCC1N(CC2)CCC2NC(c(ccc(Cl)c2)c2F)=O)C1=O,0 S926-7882,Cn1cnc(S(N(CCC2)CC2OCc2noc(-c3cnccc3)n2)(=O)=O)c1,2 F6752-8035,CC(C)(C)c1nccc(N(C2)CC2C(N2CCOCC2)=O)n1,0 F6573-7298,O=C(c1c(C(F)(F)F)cccc1)N(CCN1c2cnccc2)CC1=O,0 Z2932003361,Cc(n(C)nc1C)c1S(N[C@H](Cc1c2cccc1)[C@@H]2N)(=O)=O,0 G213-0140,CC(C)OCCCNC(c1noc-2c1CCc1c2ccs1)=O,2 F6446-0912,Cc(cc1)ccc1NC(NC(CC1)CCN1c1nccs1)=O,2 F217-0305,CC(c1ccccc1)NC(c1ccc(COc2c3OC(C)(C)Cc3ccc2)cc1)=O,2 F0679-0339,COc(cc1)ccc1C(CN(C=Nc1c2cnn1-c(cc1)ccc1Cl)C2=O)=O,2 Z4543895496,Nc1c2ncn(CC(NC(CCO)C(C3)CC3(F)F)=O)c2ncn1,2 Z2058260749,Cc(cc1)cc2c1c(CCNC(C(CC1)Cc3c1[nH]nn3)=O)cn2C,2 Z1132700681,CN(CCN1CCOCC1)C(NC1CCN(Cc(cc2)ccc2Cl)CC1)=O,2 F6549-6949,O=C(CCc1ccc(C(F)(F)F)cc1)N1CC(CN(C(CC2)=O)C2=O)C1,0 SB30-0025,Cc1noc(C)c1S(N(CC1)CCC1N(C1(CN2)CCOCC1)C2=O)(=O)=O,2 V009-4253,COc1cc(OC)c(CN(CCCn2c3ccc2)C3c2ccc(C(F)(F)F)cc2)cc1,0 S544-0289,O=C(C1CCC1)N1CC(CCOc(cccc2)c2F)CC1,0 Z3362353772,Cn(cc1)nc1Nc(cc1)ccc1C(NC1(CC2)CCCN2C1)=O,2 Z1529738387,Cc(cc1)ncc1OCc1cccc(C(N(CCCO)Cc(cccc2)c2OC)=O)c1,2 L390-0499,Cc(cc1)c(C)cc1-c(n1nc2)ccnc1c2C(NCCC1=CCCCC1)=O,0 F6513-4788,Cn1ncc(S(Nc2nc3ccccc3nc2Nc(cccc2)c2SC)(=O)=O)c1,0 Z1449611086,OCC#Cc1cccc(C(NCc2cccc3cccnc23)=O)c1,2 F6497-2051,CSc(nccc1)c1C(N1CC(Cc2nc(-c3cscc3)no2)CCC1)=O,0 F1483-0024,CCOc(cc1)ccc1S(Nc(cccc1)c1C(NCC1OCCC1)=O)(=O)=O,2 F6520-1189,O=C(c1cc(Br)cnc1)NCCc1ccc(-c2cscc2)s1,2 F6609-4012,CC(c1ccc(C)cc1)NC(COC(c1cscc1)=O)=O,0 Z2352633847,CC(C(O)=O)c1cccc(NC(c2c(C)sc(C)c2)=O)c1,0 F2459-0238,CC(c1c2n(-c3cccc(Cl)c3)nc1)=NN(Cc1ccc(C(OC)=O)o1)C2=O,2 Z2217707423,OC(CNc1ccnc2cnccc12)c1cccc(Cl)c1,0 Z2482830643,OC(COCCN(CC1)CCN1S(c1ccccc1)(=O)=O)=O,0 F6709-4947,Cc1nccc(OC(C2)CN2c2ncnc3cnccc23)c1,2 S700-1108,O=S(Cc(cccc1)c1F)(N(C1)CC1c1nc(CCOCC2CCOCC2)no1)=O,2 Z1748811952,CC(C)Cc1c(C(N(CC2)CCC2(C(F)F)O)=O)sc(C)n1,0 S690-2286,Cc1ccc(CNC(c2ccc(CC(CC3)CCN3C(C3CC3)=O)cc2)=O)o1,2 F2902-0992,O=C(COc(cccc1)c1F)NCCn1ncc2c(NCc3ccco3)ncnc12,2 SB20-1420,O=C(C1(CCCC1)c1ccccc1)N1[C@H](Cn2nnc(C(NC3CCCC3)=O)c2)CCC1,2 F1907-2498,CC(C)N1CCN(CCc2nc(-c(cc3)ccc3Br)no2)CC1,2 F6359-5009,O=C(CN(C(CC1)=O)C1=O)N(CC1)CCC1Oc(nccc1)c1Br,0 F6480-6514,Cc1nccc(OC(CCC2)CN2C(Cc2cccs2)=O)n1,2 Z3194583836,CC(c(sc1nc(SCC(NC2CCCCC2)=O)n2)c(C)c1c2O)=O,2 F6521-8080,COC(CNS(Cc(cc(cc1)F)c1F)(=O)=O)c(s1)ccc1Cl,0 F6754-7713,CC(C)(C)c(cc1)nnc1N(CC1)CCN1c(cccc1)c1OC,0 Z3616910562,C[C@H](CNS(Cc(cc1)cc(C)c1Br)(=O)=O)O,0 F1902-0116,COc(cc12)ccc2ncc(Br)c1O,0 Z2171140111,Cc1cc(NC(N2C(C3CC3)C3(CCC3)C2)=O)nn1-c1ccccc1,2 F6658-4741,CN(C(C=C(N1)N(CC2)CCN2C(COCc2ccccc2)=O)=O)C1=O,2 F6524-2826,CS(N(CC1)CC1c1noc(-c2ccccc2)n1)(=O)=O,0 8015-3201,O=C(C1)C(Nc2ccccc2)=CC1N1CCCCC1,2 Z3383937666,NCc(cccc1)c1-c(cc1)ccc1C(N1C(CC2OCCC2)COCC1)=O,2 Z4261517474,O=C(c(cc1)ccc1-c1c[nH]cn1)N(C1)CC1c1n[nH]c2c1CCC2,2 Z2910103307,OC(C(Cc1c(C2)cccc1)N2C(c(cc1)cnc1N1CCCC1)=O)=O,2 F2795-0458,O=C(C(Nc(cc1)cc(Cl)c1F)=O)NCc1ccncc1,0 F6192-0191,O=C(C1(CCCC1)c(cc1)ccc1Cl)NCC(c1ccco1)c1ccco1,2 E912-0249,COc(ccc(CN(C(c1c2nccc1)=O)C2=O)c1)c1S(Nc(ccc(F)c1)c1F)(=O)=O,0 F6663-4604,O=C(c1cc(Cl)cc(F)c1)N(CC1)CCC1(F)F,0 F6435-9276,COC(CSC(CC1)CN1C(c1cc(Br)cnc1)=O)=O,0 F0383-0251,N#CCCn(cc1C#N)nc1-c(cc1)ccc1Br,0 F6560-5252,Cn1ncc(-c2cc(CNC(c3noc(-c4ccccc4)c3)=O)cnc2)c1,2 E912-0247,COc(ccc(CN(C(c1c2nccc1)=O)C2=O)c1)c1S(NC1CCCC1)(=O)=O,2 F6507-5292,CC(CNC(Cc1cccc2ccccc12)=O)(COC)OC,0 SB03-0025,CS(N(CCC1)CC1N(CCNC(c1nccnc1)=O)C1CCOCC1)(=O)=O,0 F6727-5746,O=C(C=C1)N(C2CCN(Cc3noc(C4CC4)c3)CC2)N=C1c1ccccc1,2 F3230-0122,Cc(cc1)c(C)cc1S(N1CCN(CC(Nc(cc(cc2)Cl)c2OC)=O)CC1)(=O)=O,0 SC88-0874,O=C(CCc1ccccc1)N(C1)CC1(C(CC1)c2nc(-c3ccncc3)no2)S1(=O)=O,2 M212-0474,O=C(C=C1)N(CC(N=C2N3C=CC=C2)=CC3=O)C=C1c1nc(-c2cccs2)no1,2 G373-1137,CC(C)Oc1ccc(CNC(CN2c(cc(cc3)C(N4CCCC4)=O)c3OCC2=O)=O)cc1,2 Z1983612880,Cc(ccc(CNC(C(CC1)Cc2c1cnn2C)=O)c1)c1OC,2 S722-0869,O=S(c1cccc2nsnc12)(N1CCC(Cc2ccc(CN3CCOCC3)cc2)CC1)=O,2 Z2311806748,Cc(ccc(S(NC([C@H]1[C@H](CC2)O[C@H]2C1)=O)(=O)=O)c1)c1N(C)C,2 F6374-0150,O=C(C(Oc1c2cccc1)=CC2=O)N1CCC(CSc2ncccc2)CC1,2 V030-7188,CCC(C)c1nc(C)c(Cc2ccc(C)cc2)c(N(CC2)CCN2C(C2CCC2)=O)n1,0 F2086-0718,Cc1cc(NC(CN(C=C2OC)C(CN(CC3)CCN3c(cc3)ccc3F)=CC2=O)=O)c(C)cc1,2 F5791-1337,O=C(Cn(cc1)c2c1cccc2)Nc(cc1)ccc1-n1nnnc1,2 Z2738218685,OC(c1cccc(CNC(N(CCC2)C[C@@H]2C(F)(F)F)=O)c1)=O,0 F6806-8294,CN(C=NC(N(C1)CC1C(N1CCOCC1)=O)=C1)C1=O,2 F6178-7616,CS(N(CC1)CCC1C(NCC(CC1)CCN1C1CSCC1)=O)(=O)=O,2 SB94-0422,CC(C)n1ncc(CN2CCC(CN(CC(C3)C(N4CCOCC4)=O)C3=O)CC2)c1,2 Z1661993418,NCCCN(C(CC1)CCN1C(c1cocc1)=O)c1cccc(F)c1,2 S352-0098,CN(C)c1cccc(C(N(CC2)CCN2C(c2c(COC(C3)c4ccccc4)n3nn2)=O)=O)c1,0 F6494-0784,CCOc1cc(C(Nc2nc(C)ccc2)=O)ncn1,0 G346-0401,CCN(CC)C(C1CCC(CN(C(c(scc2)c2N2Cc3c(C)cccc3)=O)C2=O)CC1)=O,0 Z3686300466,N#Cc1cc(N[C@@H](CC(Cn2nccc2)C2)[C@H]2O)nc(C2CC2)n1,0 F6727-4016,O=C(Cc(cc1)ccc1F)N(CCC1)CCN1c(cc1)nn2c1nnc2C(F)(F)F,0 G856-8821,Cc(cc1)ccc1Nc(cc1)nnc1N(CC1)CCN1C(CCC1CCCC1)=O,2 Z3033014998,CCCC(C)NCc1cccn2c1ncc2,0 SB75-1015,Cc1noc([C@@](C[C@@H](C2)NC(CC3CCCC3)=O)(C3)[C@@H]2CN3S(C)(=O)=O)n1,2 F2018-1413,CN(C)CCN(C(c(cccc1)c1Br)=O)c1nc(c(Cl)ccc2)c2s1,0 E130-0676,Clc1cc(-c2nc(N(CC3)CCN3c3ncccc3)nc-3c2COc2c3cccc2)ccc1,2 Z1942040949,CC(CNC(C(C1)Oc(cc2)c1cc2Br)=O)Cn1cncc1,0 F0616-0037,CCn1c(cccc2)c2c(SCC(Nc(cc(cc2)Cl)c2OC)=O)c1,0 Z1505728419,O=C(c(cc1)cc(Br)c1Cl)NCCN1CCCC1,2 Z816872950,O=C(Cn1c(cccc2)c2nc1)N(CC1OCCC1)Cc1ccccc1,0 F6515-1302,O=C(Cc1noc2c1cccc2)NCc1cc(-c2ccco2)ncc1,2 Z1523139090,CN(C(CC1)C2)C1CC2N1CCN(CC(N2)=Nc(scc3-c4ccccc4)c3C2=O)CC1,2 Z1716672930,CC(CCC1)N1S(NCc1cn(C)nc1)(=O)=O,0 G423-0598,CCOc(cc1)ccc1N(C=Cn1c2nnc1CC(C)CC(Nc(cc1)ccc1Cl)=O)C2=O,0 Z1274798795,OC(CC(C1)OCCN1S(c(cccc1)c1Br)(=O)=O)=O,0 C301-8739,COc(cccc1)c1N(CC1)CCN1C(c1nnc(-c2ccccc2)o1)c(cc1)ccc1Br,0 F6414-1482,OC(CNC(Nc1c(C(F)(F)F)cccc1)=O)(CC1)Cc2c1cccc2,0 F2318-0471,O=C(c1nccnc1)N(CC1)CCN1c(cc1)nnc1-n1nccc1,2 Z1329891377,Cn1cc(CNC(c2cccc(Cl)c2)=O)cc1,2 F6503-9090,Cn1nnc(C(NCCc2nc(CCOC3)c3c(C(F)(F)F)n2)=O)c1,2 S555-0027,O=C(CCc1c[nH]c2c1cccc2)N1Cc(cc(cc2)N3CCOCC3)c2OCC1,2 Y041-4324,O=C(CN1N=C(CCCCC2)C2=CC1=O)N1CC(c2ccccc2)OCC1,2 Z1247075608,CN(Cc1nocc1)C(C(CCCC1)N1C(c1cccs1)=O)=O,2 F6554-4999,O=C(c(cc(s1)Cl)c1Cl)N1CC(CF)C1,0 Z1147363703,Cn(cc1)nc1NC(NCC1(CCCCC1)N1CCCCC1)=O,2 T140-0844,COCCN(C(CC1)(CCN1C(COc(cc1)ccc1Cl)=O)S(C1)(=O)=O)C1=O,2 F6516-0996,Cc(cccc1)c1NC(NCc1ccc(-c2ccco2)o1)=O,2 Z4917831092,CN(C)S(c(cc(cc1)C(Nc2ncnc(-c(cc3)ccc3OC)c2)=O)c1Cl)(=O)=O,0 F6480-5747,COc(ccc(Cl)c1)c1S(N(CCC1)CC1Oc1ncncc1)(=O)=O,0 SD68-0114,CC(C)c(cc1)ccc1S(N1CC(C(NCC2)=O)N2CCC1)(=O)=O,0 F5857-3096,CC(CNC(Cc(cccc1)c1Cl)=O)(c(cc1)cc2c1OCO2)O,2 F6561-1442,CSc1cc(C(NCc2cncc(-c3ccco3)c2)=O)ccc1,0 Z2213450419,CC(C)(C)Oc(cc1)cnc1C(NC(CCC1)CN1c1cc(C)nn1C)=O,0 Z3203846496,COc(cccc1)c1NCC(Nc1cccc(CN=S2(CCCC2)=O)c1)=O,2 F6240-6952,O=C(c1cccs1)NC(CC1)CCN1c1nc2cccnc2s1,2 Z1716872581,Cc(ccc(S(N1Cc2ncnn2CC1)(=O)=O)c1)c1Cl,0 F6543-7248,CC(C1)OC(C)CN1c(nc1)ncc1Br,0 F6573-4265,Cc(cc(CCC(NCCOCCN(C(CC1)=O)C1=O)=O)cc1)c1F,0 G856-1214,O=C(CSC(N(c1cccc(Cl)c1)C1=O)=Nc2c1[nH]c1c2cccc1)NCC1OCCC1,0 F6816-4484,CCn1nc(C(F)(F)F)c(CNc2nc(C#N)ccn2)c1,2 F0277-0051,CC(C)CCOc1cccc(OCC(Nc(cc2)ccc2OC)=O)c1,0 F6476-5766,O=C(CSC1CCCC1)N(CC1)CC1Oc(ccnc1)c1Cl,0 F6178-6497,Cn(cc1C(NCC(CC2)CCN2C(c2cocc2)=O)=O)nc1OC,2 F3406-3500,CC(C)(C)OC(N(CC1)CCC1NC(c1c(C)nc(-n2cccc2)s1)=O)=O,2 Z1885259274,Cc(n(C1CCCC1)nc1)c1NC(c1cn(CC(NC2CCCCC2)=O)nc1)=O,2 M321-0102,Cc(cccc1)c1-c1nc(-c2cc(-c3ccn[nH]3)ccc2)no1,0 F6300-0187,O=C(C1c(cccc2)c2Oc2c1cccc2)Nc1conc1,2 F6507-5858,CC(C)(C(NCCC(c1cccn1C)O)=O)Oc(cc1)ccc1Cl,2 J029-0055,Cc1ccc(C2(CCCC2)C(Nc(cc2)ccc2N2CCCC2)=O)cc1,2 Z905080442,CN(C(CNCC1CC1)=O)c(cc1)ccc1F,0 F6554-4620,COC(Nc(cc1)ccc1S(N1Cc(cc(cc2)F)c2OCC1)(=O)=O)=O,0 Z2057760898,O=C(c1cc(Cc2ccccc2)n[nH]1)N(C1)CC1(C1)CNC1=O,2 P511-1629,O=C(CN(C=C(C=C1)S(N2CCCCCC2)(=O)=O)C1=O)N(CCC1)c2c1cccc2,2 Z2950533530,Cc1noc(-c2ccccc2)c1NC(NCCC(C1)CN(C)C1=O)=O,2 F6125-0776,Cc1cc(C(N(C2)CC2C(Nc(cccc2)c2C(OC)=O)=O)=O)no1,0 Z3288548838,Cc1nc(cc(cc2)C(NCCNC(Cc3cc(F)ccc3)=O)=O)c2n1Cc1cscc1,2 F6441-4004,O=C(Cn(cc1)c2c1cccc2)N(CC1)CCC1S(Cc1ccco1)(=O)=O,2 F6496-0975,Cc1cc(CNC(c(cccc2)c2Br)=O)ncn1,0 L299-2464,CCc(c(-c1cc(S(NC2CC2)(=O)=O)c(C)cc1)c1NC(CC2)=O)nn1C2=O,2 Y043-3290,Cn1c(C(c2cccc(NC(CN(C(CC34CCCC4)=O)C3=O)=O)c2)=O)ncc1,2 S926-0952,Cc1nc(COC2CN(Cc3cn(C)c(cc4)c3cc4OC)CCC2)no1,2 Z1622877644,OCCN(C1CCCCC1)C(Nc(cc1)cc(Cl)c1F)=O,0 SD01-0070,CCCn(c(CC1)c2CN1C(c1c(C)n(CCCOC)c(C)c1)=O)nc2-c1cocn1,0 F6554-0937,Cn1nc(C(CCC2)CN2C(c(cc2)cnc2OC)=O)cc1,2 Z2126192615,Cc(ccc(NC(c1c(N)nc(C2CC2)nc1)=O)c1)c1C(N1CCOCC1)=O,0 Z1949676985,Cn1c(C(CC2)CCN2C(c([nH]c2c(cc3)F)cc2c3OC)=O)nnc1,0 F2758-2745,O=C(Cn1c(cccc2)c2nc1)NCC(c1c2cccc1)=NN(CCN1CCCC1)C2=O,2 F6748-3449,Cc(cc(C)nc1N(CC2)CC2Oc(ccnc2)c2Br)c1C#N,0 J107-0714,CC(C)c1cc(C(NC(CCC2)c3c2c(cccc2)c2[nH]3)=O)c(c(C)no2)c2n1,2 F3406-6307,CCc(cc1)ccc1Oc1cc(N(CC2)CCC2C(N(CCC2)CC2C(OCC)=O)=O)ncn1,2 Z1889687196,CN(CCC1(CC2)CCN2C(C(CCC2)N2S(c2cccs2)(=O)=O)=O)C1=O,2 Z1918956571,O=C(N(CC1)CC1N1CCCC1)N(CC1)CCS1(=O)=O,2 Z30519555,C=CCNC(C1=Cc(cc(cc2)Br)c2OC1=O)=O,0 F5787-0143,O=C(CSc1ncnc(-c2ccccc2)c1)NCc1cccs1,2 F2515-1344,O=C(c(cc1)cc2c1OCCO2)N(Cc1cnccc1)c1nc(c(F)ccc2)c2s1,0 F3083-0253,CN(C)S(N(CC1)CCN1c(cc1)ccc1F)(=O)=O,0 V016-6907,Cc(cc1)cc(C)c1C(Cn1c(C(N(CC2OCCC2)C(N2c3c(C)cccc3)=O)=O)c2nc1)=O,0 F6454-0810,O=S(c(s1)ccc1Cl)(NCC1CCN(CC(F)(F)F)CC1)=O,0 Z2983120677,C[C@H](CC(O)=O)NS(c1cc(cccc2)c2s1)(=O)=O,0 F5490-0226,CC(C)(C)Cc1nnc(C(CCC2)CN2C(c(cccc2)c2F)=O)o1,0 Z1324220331,COCC(c1ccco1)NS(c(scc1)c1Br)(=O)=O,0 F6514-3019,O=C(c1cc(-n2nccc2)ccc1)N(C1)CC1OCC(F)(F)F,0 Z4398904493,OC(c1ccc(C(N(Cc2cn(CCc3ccccc3)nn2)Cc(cc2)ccc2F)=O)o1)=O,2 Z2188071633,Cc1c(C)ncn1-c(cc1)ccc1NC(C1=CNC(C)=CC1=O)=O,2 G307-1838,O=C(Cn1cnc(S(N2CCOCC2)(=O)=O)c1)N(CC1)CC1c1ccccc1,2 F3237-0161,CCOc(cc(C)c(C)c1)c1S(NCCN1CCOCC1)(=O)=O,0 F5033-8111,O=C(c(cccc1)c1F)N1CCC(CNC(Nc(cccc2)c2Cl)=O)CC1,2 F6520-0622,COc1ccc(CCC(NCCc2ccc(-c3ccco3)s2)=O)cc1,2 Z2910906232,COc1c(CCNC(C(CC2)CCC2O)=O)ccc(C(O)=O)c1,2 G340-0906,O=C(C(CCC1)CN1c1nc(cccn2)c2s1)NCCc1c[nH]c(cc2)c1cc2Cl,2 F6619-7476,Cn1nc(CCC2)c2c1CN(CC1)CCN1c(cc1)nnc1N1CCOCC1,2 F6522-0211,O=C(c1cc(Br)cs1)NCc1cc(-c2ccco2)cs1,0 Z373306754,Clc1ccc(C(CCC2)N2c2ncnc3c2[nH]cn3)cc1,0 SB24-0174,CCN(CC)C(c1cn(C(CC2)C2(CC2)CCN2C(NC2CCCCC2)=O)nn1)=O,0 Z2595683145,NC(c1ccc(C(N(CC2)C(CCCC3)C3C2C(O)=O)=O)s1)=O,2 Z1343621319,COc(c(C(NC1CC1)=O)c1)cc(Cl)c1Cl,0 F5009-0696,CCOc(cccc1)c1NC(CCN(C=Nc1c2cnn1-c1ccccc1)C2=O)=O,2 Z2143528344,CC(C)Cn1ncc(Nc(nc2)ncc2Cl)c1C1CC1,0 Z1754146257,Cc1nnc([C@@H](C[C@@H](C2)OC)N2C(c2csc3c2CCCC3)=O)o1,0 F5260-0160,Cn1c(C(CNC(c2ccco2)=O)N(CC2)Cc3c2cccc3)ccc1,2 F6353-5579,O=C(c(cccc1)c1F)NCC(c1cocc1)N1CCSCC1,0 F6752-3610,O=C(C1CC1)NC(CCC1)CN1c1c(ccc(C(F)(F)F)c2)c2ncc1,2 Z3344367738,CNC1(CNC(c2ncnn2C)=O)CCC1,2 SB66-0890,Cc1cc(C)nn1Cc1c(C)onc1C(N(C[C@H]1CCC2)C[C@@H]1NC2=O)=O,0 Y042-3302,COc(cc1)cc(N(CC(C2)C(Nc(cc3)cc(C=C4)c3OC4=O)=O)C2=O)c1OC,0 F3412-0035,COc(c(OC)c1C(N2Cc3n[nH]cc3)=O)ccc1C2=O,2 F2173-0607,Cc1ccnc(N(C2CC2)c2c3cccn2)c1NC3=O,2 Z1615659193,CC(C)(C1)OC(C)(C)C1NC(c(cc(cc1)N(CCN2)C2=O)c1F)=O,2 F6474-7213,O=C(COc(cc1)ccc1-c1ccccc1)N(C1)CC1N(C(CN1)=O)C1=O,2 Z2961282047,O[C@@H](CCC1)[C@H]1NC(c1c(ccc(Cl)c2)c2ncc1)=O,2 S570-0204,CN1C2=CCCCC2(CNC(Cc2ccccc2)=O)CCC1=O,2 SC19-0124,CCn1nc(CN(CC2)CC2NS(Cc(cc2)ccc2Cl)(=O)=O)c2c1CCOC2,2 E734-2712,O=C(c1c2nccc1)N(Cc(cc1)ccc1S(N1CCN(Cc3ccccc3)CC1)(=O)=O)C2=O,2 Z2358757475,CCN(CC(O)=O)C(C1)CC1Nc1c(ccc(OC)c2F)c2ncn1,0 F153-1282,CCc(ccc(C(C1=C2CCCC1)=NNC2=O)c1)c1S(Nc1c(C)cccc1C)(=O)=O,0 Z1185255948,O=C(CN1N=Cn2nccc2C1=O)Nc1ccncc1,2 Z4966623274,CSc1cc(-n2nnc(-c3cc([N+]([O-])=O)ccc3)c2)ccc1,0 C547-0918,CC(c(cc1)cc2c1OCCO2)NC(CCCOC(c(cccc1)c1N1C)=CC1=O)=O,2 F2828-0551,CCSc1ccc(CC(Nc(cc2)cc3c2nc(C)s3)=O)cc1,2 F6132-0100,OCC(COCC1)N1C(c1cccc(C(F)(F)F)c1)=O,0 Z2964420345,CCc1cc(C(N[C@H](CCC2)[C@H]2Oc2c[nH]nc2)=O)no1,2 F6525-3024,Cn(c(CNC(Nc(cccc1)c1OC)=O)c1)nc1-c1cnccc1,0 F2493-3010,COc(cc1)ccc1-c1cc(CNC(C2CCC2)=O)no1,2 CM3852-0302,CN(CC1)CCC1(CN(C1)C2CCC2)Oc2c1cccc2,2 Z4970360679,O=C(c(scn1)c1Br)Nc1nc(-c2ncccc2)nc2c1ccs2,0 SD67-0519,COc1cccc(CN(CCC2)CC(C(N(Cc3ccccc3)C3)=O)N2C3=O)n1,2 Z2958877136,O=C(c1ccnn1C1CC1)Nc1c[nH]nn1,2 Y205-6836,Cc(cc1)ccc1NC(CSc1nnc(-c2cccs2)n1CC1OCCC1)=O,0 Z2722350150,CC1(C(O)=O)N(Cc2cnc(-c3ccccc3)nc2)CCC1,2 F3406-7678,Cc(cc1)ccc1-n1nnc(C(N(CC2)CCC2NC(c2cc(cccc3)c3[nH]2)=O)=O)c1,2 Z2093691357,O=C(Cc1csc(Cc2ccccc2)n1)NC(C1CCC1)C1CCC1,2 F5225-0221,O=C(c(cccc1)c1F)Nc(cc1)nnc1SCc1cnccc1,2 F6541-4340,CC(N1CCN(Cc2c[nH]c3c2cccc3)CC1)=O,2 Z3767091176,Oc1nc(C2CC2)nn1C1CCNCC1,2 F052-1043,O=S(c1cc2ccc(NCCCN(CC3)CCN3c(cccc3)c3F)nc2cc1)(N1CCCC1)=O,2 F3222-4604,CSc1cccc(NC(CSc2nccnc2N2CCSCC2)=O)c1,0 T636-1915,Cc1noc(C)c1CCC(N(CC1)CCN1c1ncnc2c1CCC2)=O,2 Z1602408947,O=C(CNC(Nc1cnc(C(F)(F)F)cc1)=O)N1CCOCC1,0 SB18-1161,CC(C)CC(N[C@@H](C[C@H]1c2nc(C)n[nH]2)CN1C(COc(cc1)ccc1F)=O)=O,0 Z2436649123,CCCC(C(Nc1cc(OCC(F)F)c(C)cc1)=O)N,0 F6724-5215,COC1(CNc2ncnc3c2scc3)CCSCC1,2 Z909421116,O=C(CNC(c1cccnc1OCC(F)(F)F)=O)N(CC1)CCN1c1ccccc1,2 Y031-4749,N#Cc(cccc1)c1NC(C(CC1=O)CN1c(cc1)ccc1Cl)=O,0 F6525-0161,Cc(n(-c1ccccc1)nc1)c1C(NCc1c(CCC2)c2nn1C)=O,2 F5966-0029,OCC1(CNC(NCCCc2ccccc2)=O)CC1,2 Z1939158905,Cc1noc2c1c(N(CC1)CCN1C(c(cc1)ccc1OC)=O)ncn2,2 S606-0907,O=C1N([C@H](CC2)CN2S(c2cccc3cccnc23)(=O)=O)c2ncccc2N1,0 F6619-4230,Cc1nc(N(CC2)CCN2c2c(C(F)(F)F)cccn2)nc(N2CCOCC2)c1,0 Z4655970823,CC(C)(c(ccc(Cl)c1)c1OC)N,0 Z2482858195,COc1cc(OC)c(C2N(Cc3nc(C(O)=O)co3)CCC2)cc1,0 F3398-5164,Cc(cc1)cc2c1[nH]c(C(NCc1cccs1)=O)c2NC(c1cc(C)ccc1)=O,2 Z1474304348,COc1cccc2c1oc(C(NC(CCC(N1)=O)C1=O)=O)c2,2 Y040-3177,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CCN1C(C1Oc(cccc2)c2OC1)=O,2 Z1697212160,Cc1noc(C2CC2)c1NC(Nc(cc1)cc2c1OCCO2)=O,2 J030-0207,CC(C1)OC(C)CN1S(c(cc(c(Oc(cccc1)c1N1)c2)C1=O)c2Cl)(=O)=O,0 F6518-2293,CC(c1ccc(CCNC(c2c(C)onc2C)=O)s1)=O,0 Z4444514941,CCOc1cccc(NC(C(NC=C2OC)=CC2=O)=O)c1,0 Y042-3692,CCC(C)N(C(c(cc1)c2cc1C(Nc1nnc(CC)s1)=O)=O)C2=O,2 S897-0595,CC(C)CC(N(CCC1)CC1Oc1nc(C2CC2)nc2c1CCOCC2)=O,0 Z1102692501,O=C(Cc1cn(-c2ccccc2)nc1)N(CCC1)C1C1CC1,2 Z395599690,O=C(c(cc1)cc(CC2)c1NC2=O)NCc(cc1)cnc1-n1cncc1,0 Z2494144341,Cc(cn1)cnc1OC1CCN(Cc(cccc2)c2Cl)CC1,0 F5966-0036,COc1ccc(CCNC(NCC2(CO)CC2)=O)cc1,2 Z1172284134,CCn1c(ncnc2N3CCN(Cc4cc(C)ccc4)CC3)c2nc1,0 F6524-5663,CCOc(cc1)nn2c1nnc2CNC(c1c(C(F)(F)F)cccc1)=O,0 F6687-6895,Cc1cccc(OCC(CCC2)CN2C(Cc(cc2)cc(OC)c2OC)=O)n1,0 Z4925598668,CN(C(c(c(F)cnc1)c1F)=O)c(cc1)ccc1-c1ccccc1,2 F1673-5846,COc1cccc(C(N(Cc2cccs2)C(CC2)CS2(=O)=O)=O)c1,0 Z2795226194,OC(C(C1CC1)N(CC1)CCN1C(COc(cc1)ccc1Cl)=O)=O,0 Z2634512115,Cn1ncc(-c(nccc2)c2C(N(CC2)CCC2n2nncc2)=O)c1,2 Z777310864,CC(C)c1n[nH]c(-c(cccc2)c2NC(COc2cc(OC)ccc2)=O)n1,0 F0916-6913,COc(ccc(CCNC(c(cc1)ccc1N1N=Nc(cccc2)c2C1=O)=O)c1)c1OC,2 F3406-5642,O=C(CSc1nc(N2CCCCC2)ccn1)Nc(cc1)c(C(F)(F)F)cc1Cl,0 SA05-0973,Cc1nnc2n1CCN(Cc1nc(OC)ccc1)C2C(N(C)C)=O,0 F5016-1379,COc(ccc(NC(C(NCC(CC1)CCN1c1ncccc1)=O)=O)c1)c1Cl,0 D715-0662,C[C@@H](C(N[C@@H](C)C(O)=O)=O)NC(COc(cc1)cc(O2)c1C(CCCC1)=C1C2=O)=O,0 Z4010103812,Cc1cc(C(N[C@@H](C2)[C@@H]2[C@H](C2)[C@H]2C(O)=O)=O)ncc1,2 Z1509689125,CCOC(c1cc2cc(Br)cn2cn1)=O,0 Z1748045055,Cc(n(C(C=C1)=NNC1=O)nc1)c1C(N(C1)CC2(CC2)C1O)=O,2 F6672-1189,O=C(Nc(cccc1)c1Cl)N(C(CC1)C2)C1CC2n1ncc(Cl)c1,0 S368-0058,CC(c(cc1)ccc1N(CC1)CCN1C(c1nn(CC(c(cc2)ccc2Cl)OC2)c2c1)=O)=O,2 Z1442122918,O=C(C(C1)C1(CCC1)c2c1cccc2)NS(c1cscc1)(=O)=O,2 F6184-0494,COC(c(cc1)ccc1C(N(CC1)CCC1c1cscc1)=O)=O,0 Z2289228265,Cc1cc(C(NS(CCC2CCCCC2)(=O)=O)=O)ns1,2 F6764-1423,OC(CN(CC1)CCC1c1nc2ncccc2cc1)COc1ccccc1,2 F6502-0565,O=C(c(cc1)cc2c1OCO2)NCCn1c(-c2cnccc2)ncc1,2 F6277-0442,COC(c(cc1)ccc1S(N(CC1)CCN1c1nc(c(C(F)(F)F)ccc2)c2s1)(=O)=O)=O,0 F6802-6940,CS(NC(CCC1)CN1c1ncncc1F)(=O)=O,0 Z3173040312,OC(C(C1)C1(C1)CC1C(N(CCC1)CC1C(Nc1ccccc1)=O)=O)=O,2 SB21-0228,Cc1cc(C(N(C2)[C@H](Cn3nnc(C(N4CCCC4)=O)c3)C[C@@H]2F)=O)nn1C,2 F5855-0636,O=C(C(C1)C1c(cc1)cc2c1OCO2)N(CC1)CCN1C(c1ccco1)=O,2 Z3634463812,CC(C)(CN(Cc1nc(-c2cccc(C(F)(F)F)c2)no1)C1)OC1C(O)=O,2 Z3063574942,CCN(CC)C(C(C)N1CCC(Cc2ccn[nH]2)CC1)=O,2 F0715-0419,COc(cc1)cc(OC)c1-c1csc(NC(Cc2cccc3ccccc23)=O)n1,2 F5596-1300,O=C(CN(CC1)CCC1c1nnc(C2CC2)o1)NCc(cc1)cc2c1OCO2,2 SA99-0426,COCCC(CC1)(CCN1C(CC1)CCN1C(Nc(cc1)cc(OC)c1OC)=O)C(N)=O,0 S957-5053,N#Cc(cc1)c(C(F)(F)F)cc1N1CC2(CCN(Cc3cscc3)CC2)C(CO)C1,2 Z640440562,Cc1c(Cc(cc2)cc3c2OCO3)sc(NC(c2c3nc(C)cc(C)n3nc2C)=O)n1,0 Z1003325710,Cc1cc(CCC2NS(c3cc(S(NC4CC4)(=O)=O)ccc3)(=O)=O)c2cc1,2 F6279-0019,CN(C)C(CNS(Cc1ccc(C(F)(F)F)cc1)(=O)=O)c1cccs1,0 Z1124139778,Fc1cc(C(C2)OCCN2c2nc(-c3ccccc3)ncc2)ccc1,2 Z1739082855,CS(CCCS(N(CCC1)C[C@H]1C(O)=O)(=O)=O)(=O)=O,0 SC88-1056,O=C(c1cscn1)N(C1)CC1(C(CC1)c2nc(-c3ccccc3)no2)S1(=O)=O,2 V010-8530,O=C(CCN(C1CC1)c1c(ccc(Cl)c2)c2nc(C2CC2)n1)NCc1cc(C(F)(F)F)ccc1,2 Z1683396887,CNC(C1(CCC1)c1nc(-c(cccc2)c2OC(F)(F)F)no1)=O,0 F6783-7116,Cc1noc(C)c1S(N1CC(CN(C2)c3nc(C)nc4c3CCC4)C2C1)(=O)=O,2 Z1078654058,COc1cccc(C(N(CC2)CC2C(O)=O)=O)c1,0 F6257-3937,CC(C=C1)=NN(CC(Nc2ncnc(N3CCN(Cc4ccccc4)CC3)c2)=O)C1=O,2 Z1419775843,CCN(Cc1cn(C)nc1)C(C(CCN1)CC1=O)=O,2 8440-1838,O=C(CC(C1=O)Nc(cc2)ccc2N2CCCCC2)N1c(cccc1)c1F,2 SB58-0969,Cc1cccc(C(N(C2)CC2(C2)C(CN(C)C)CN2C(c2ccccc2)=O)=O)n1,2 F3245-0010,CC(C)=CCSc1nnc(c(cccc2)c2[nH]2)c2n1,2 J500-0319,Cn(cc1)nc1C(N(C1)CC2(CCCC2)C1C(NCCOC)=O)=O,2 Z1433895550,Cn1nc(C2CCCCC2)cc1NC(Cc(cc1)ccc1-n1nnnc1)=O,2 Z1160322864,O=C(Nc1c(-n2ncnc2)nccc1)N(CC1)CCN1c1ncccn1,2 F0600-0374,O=C(C1=COCCO1)Nc1nc(c(F)ccc2)c2s1,0 Z4493403763,CC(C(N1CC(Nc2cc(NC(N(C)C)=O)ccc2)=O)=O)(c2cc3ccccc3cc2)NC1=O,2 Z731528518,CCCCN(C(C1(NC23CCCCC3)N(C)C2=O)=O)c2c1cccc2,2 G373-0793,O=C(NC1CCCCC1)N(CC1)CCC1n1c2ncccc2nc1CC1CCCC1,2 Z2645123643,Cc1nnnn1C(Cc(cc1)ccc1F)C(N(CC1)CC1C1CCCCC1)=O,2 Z2465873112,CC(C(CC1)CN1c1cc(N(CC2)CCC2C(O)=O)ncn1)O,0 F6359-0437,O=C(Cc1noc2c1cccc2)N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1,2 F0643-0085,O=C(CCN(c(cccc1)c1O1)C1=O)NCCC1=CCCCC1,2 F6556-5926,CC(C)c(cc1)ccc1OCC(N(CCC1)CCN1C1CCC1)=O,0 SD07-0938,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(c2ccnn2CC)=O)C2)n2nn1)=O,2 Z1580969442,O=C(C(CC1)CCN1C(Nc1ccc(C2CC2)cc1)=O)c1ccccc1,2 Z2695622400,CCC(N(C[C@@H]1C)C[C@]1(C)C(O)=O)=O,0 F5033-3529,COC(N1CCC(CNC(Nc(cccc2)c2Cl)=O)CC1)=O,0 SC42-0370,CN(C)S(N(CC1)CCC11OCCC(Cc2noc(C3CCC3)n2)C1)(=O)=O,2 Z2846572602,CC(Cc1cn(CCc2ccnn2C)nn1)(c1cccs1)O,2 SC42-0604,COCc1nc(CC2CC(CC3)(CCN3C(C3CCOCC3)=O)OCC2)no1,0 Z1625920176,Cc(ccnc1)c1C(N(CCC1)CC1S(N1CCOCC1)(=O)=O)=O,2 F6810-5336,OCC1(CCC2)C2CN(Cc(cc2)ccc2Cl)C1,0 S829-1497,COC[C@H](CC(C1)(F)F)N1C(CC1)CCN1C(CCn1cncc1)=O,2 SB75-0147,CC(C)C(N(C[C@@H]1C[C@H](C2)NC(Cn3ncc(C)c3)=O)C[C@@]12c1nc(C)no1)=O,0 Z4909204037,CC(C)CCC(N(C1)CC1(c1cn(-c2ccc(C(C)C)cc2)nn1)O)=O,2 V029-4416,O=C(CC(c1c[nH]c(cc2)c1cc2Cl)c(cc1)cc2c1OCCO2)NCc1ccco1,2 F6481-3464,O=C(CSC1CCCC1)N(CC1)CCSC1c1ccco1,2 Z1198037346,Cn1ncc(-c2nc3ccccc3cc2)c1,0 Z1169952057,CCN(CC)C(c(cc1)ccc1-c1nc(-c2ncccc2)no1)=O,0 Z1148571979,N#CCN(CC1)CCC1NC(c1cc(-c(cc2)ccc2Br)n[nH]1)=O,2 F3379-0423,COc(ccc(CCNc1c(cnn2Cc(cccc3)c3Cl)c2ncn1)c1)c1OC,2 F2726-0215,Cc1cc(C)c(CC(Nc(cc2)cc3c2scc3)=O)cc1,2 Z2407946298,Cc1ccc(C(N(CCC2)CC2n2nncc2)=O)c(Cl)c1Cl,0 Y031-2009,O=C(C(C1)CN(C2CCCCC2)C1=O)Nc(cc1)ccc1S(Nc1ncccn1)(=O)=O,2 Z1873977018,CN(C)C(c(cccc1)c1NC(c(cc1)ncc1OCC(F)(F)F)=O)=O,0 Z977234204,CCN(Cc(cc1)ccc1O)C(Cn1c(cccc2)c2nc1)=O,0 SC69-0025,Cc1c(CN(C2)CC3(CCCC3)C2c2nncn2C)scc1,2 F6789-0442,OCC1(CN(C2)c3ncnc4c3CCCC4)C2CCCC1,2 Z4877466901,CCN(C=C(c1noc(C[C@@H](CCC(OC)=O)N)n1)C(N1)=O)C1=O,2 Z1948754087,COc(cc1)c(cc(C(N2CCN(CCOc3ccccc3)CC2)=O)[nH]2)c2c1F,0 Z1240086266,CC(C)N(CC(C1)NC(CN2N=Cn3nccc3C2=O)=O)C1=O,2 F463-0090,O=C(C(CC1)CCN1c1ncnc2c1sc1c2cccn1)Nc(cc1)ccc1Cl,2 F6495-5552,COC(c(scc1)c1NC(C(C1)CN1c1ncnc(-n2nccc2)c1)=O)=O,2 Z1357333545,COCc1nc(cc(cc2)NC(CCN3c4ccccc4)C3=O)c2o1,0 F2028-0404,O=C(Cn1c(cccc2)c2c(S(Cc(cccc2)c2Cl)(=O)=O)c1)NCc1ccco1,2 Z1991715134,OC(c(nc1)cnc1C(N(CC1)CC1c1cccc(C(F)(F)F)c1)=O)=O,0 M330-0003,Cc1c(C(N2CCCC2)=O)sc(-c2cc(S(Nc(cc(cc3)F)c3F)(=O)=O)cn2C)n1,0 Z4082178965,CC(NCC(c1c(CCCC2)c2n[nH]1)(F)F)=O,0 F3386-4736,CCc1nccn1S(c(cc1)ccc1Br)(=O)=O,0 G551-0287,CC(C)C(c1cccn1CC1)N1C(Nc(cccc1)c1Br)=O,0 Z1743946106,CC(C)(C(C1)Nc2nc(-c3ccncc3)nc3ccccc23)C1O,0 Z128259640,CCCNC(CNc1cccc(Cl)c1C#N)=O,0 SA41-0753,CN1C(COc2ccncc2)CC(C2)(CN2C(Cc2cscc2)=O)C1,2 Z1934718902,CC(C1)OC2(CCOCC2)CN1C(CCc1ncc(-c(cccc2)c2Cl)o1)=O,2 F5601-0107,O=C(c1cccc(F)c1)N(CC1)CCN1c1nc(N2CCOCC2)nc(-n2cncc2)n1,2 F6724-4256,OC(CNc1nc(cccc2)c2o1)(c1cocc1)c1cccs1,2 F6464-1100,CN(CC(N(CCCC1)CC1c(cc1)ccc1OC)=O)S(C)(=O)=O,0 V012-2039,CCNC(Nc(cc1)cc(CN(C(C)C(C)C)C(C(C)(C)C)=O)c1N(C)C)=O,0 F5857-5061,OC(CNC(C(c1ccccc1)c1ccccc1)=O)C1CCCCC1,2 Z1140069616,CNC(C1(CC1)C(N(CC1)CCN1C(c1ncccc1)=O)=O)=O,0 P223-1100,Cc1c(CN(CCC2)CC2c2nn(CCCNC3=O)c3c2)scn1,2 SA67-0507,Cc1cc(C(N2CC(CCc3noc(C4CC4)n3)CC2)=O)no1,2 F2692-0300,O=C(CSC(N(Cc1cccs1)C1=O)=Nc2c1oc1c2cccc1)Nc(cccc1)c1Cl,2 Z2957804858,COc1nccc(C(N[C@@H]([C@H](C2)O)c3c2cccc3)=O)n1,0 Z1286185042,OC1(CNC(c2ccc[nH]2)=O)CCOCC1,0 F6752-4183,COc1cnc(N2CC(C(NC3CC3)=O)OCC2)nc1,2 Z1407084926,O=C1NC(CC2CC2)=NC(c2ccccc2)=C1,2 F1358-0127,COC(c1c(NC(COc(ccc(Cl)c2)c2Cl)=O)scc1)=O,0 Z1554563053,CC(C)(C)n1ncc2c1ncnc2Nc1cccc(NC(C2CC2)=O)c1,2 S976-1352,COc1cc(OC)c(CN(CCC2)CC2(C(N2CCCC2)=O)F)cc1,2 F3386-3045,COc(cc1)cc(S(n2ncnc2)(=O)=O)c1OC,0 Z1954449358,OCC(c(cccc1)c1OC(F)(F)F)NC(c1cc(COCC2)c2s1)=O,0 8017-1295,O=C(c1cccc(Br)c1)Nc(cc1)cc2c1n(CCN(Cc1ccco1)C1)c1n2,2 T159-1069,CC(C)n1c(CC(CCC2)CN2S(c(cc2)ccc2C#N)(=O)=O)ncc1C,0 SA96-1219,Cc1c(CCC(N(C2)CC2(CN(Cc2ccccc2)C2)C2C(NC)=O)=O)c(C)n[nH]1,2 F2616-0818,Cc1cccc(C)c1NC(C(NCc1ccncc1)=O)=O,0 Z2157649070,Cc1cc(C(Nc(cc(C)c(OC)c2)c2Cl)=O)nn1-c1ccccc1,0 8015-4007,CC(C)(CC(N(Cc1cnccc1)C1=O)=C2C1(C(F)(F)F)NC(C1CC1)=O)CC2=O,2 F5754-0296,Cc1nc(cccc2)c2n1CC1CCN(CC(N2)=Nc(cccc3)c3C2=O)CC1,2 Z2000617089,CC(C)(C)n1ncnc1CNC(N(CCc1c(cc2)F)Cc1c2F)=O,0 F6360-7865,CC(C)S(c1ccc(CC(N(C2)CC2Oc2nc(C(F)(F)F)ccc2)=O)cc1)(=O)=O,2 Y202-8012,CCOc(cc1)ccc1-c1nc2ccc(C)cc2c(C(NC(C)C2C(CC3)CC3C2)=O)c1,0 Z1975688036,CS(C1(CNC(c2cc(CN(C(CN3)=O)C3=O)ccc2)=O)CCC1)=O,2 SC74-0706,O=C([C@H](C[C@H]1c2nc(-c3ccccc3)no2)C[C@@H]1NC(c1cocc1)=O)N1CCCC1,2 F6525-1468,COc(ccc(CNC(NCCn(cc1)nc1-c1nccnc1)=O)c1)c1OC,2 Z2607672662,CC(C)(C)N(CCC1NC(c2cc(OCC(O)=O)ccc2)=O)C1=O,0 Z1365635145,CCCNC(NCCN(c(cccc1)c1N1)C1=O)=O,0 F6363-0668,Cc1nc(-n2cccc2)cc(NCCNC(c2nccnc2)=O)n1,2 F5098-0640,O=C(Cc1cccs1)Nc1cc(N(CC2)C(C3OCCC3)=O)c2cc1,2 Z2909249300,CN1CCC(CC2)(CCC2NC(c(cc2)cc(NC(CN3)=O)c2C3=O)=O)CC1,2 Z4045291571,O=C(c(sc1c2ccc(C(F)(F)F)c1)c2Cl)N(CCC1)CC1c1c[nH]nn1,2 F5882-6371,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)NCCC1=CCCCC1,2 F6554-6126,COC(C(C1)C1(CC1)CCN1C(c1cc(cccc2)c2s1)=O)=O,0 Z1753999661,CCc1nnc([C@@H](C[C@H](C2)O)N2C(c(cc2)cc3c2[nH]c(C)c3C)=O)o1,0 Y031-5571,CC(C)c1nnc(NC(C(CC2=O)CN2c(cc(C)cc2)c2OC)=O)s1,0 Z2069781376,Cc1c(NC(C(CC2)CCN2c(ccc(C#N)c2)c2F)=O)[nH]nc1C1CC1,2 Z2973869320,C(C1)C1c1cnc(C(C2)CN2c2nccnc2)nc1,0 Z1644059988,Cn1nc(CC(NS(c(cc(cc2)Cl)c2OCCOC)(=O)=O)=O)cc1,0 F2775-0282,Brc(cc1)ccc1-c(cc1)nnc1SCc1ccncc1,2 F5490-0493,CCSc(cccc1)c1C(N(CCC1)CC1c1nnc(-c2cccs2)o1)=O,0 F5834-4793,O=C(Cc(cc1)ccc1NC(Nc(cc1)cc(Cl)c1Cl)=O)NC1CC1,0 Z1610444291,O=C(C(CCC1)CN1C(c1ccccc1)=O)N(CCC1)C1c1ncc[nH]1,2 F6752-6352,O=C(C1CN(Cc2cnccc2)CCC1)N(CC1)CCC1(F)F,2 Z1083837008,CCCC(N(CCC1)CC1C(N1Cc(cccc2)c2N(C)CC1)=O)=O,2 C285-0083,CCCOc(cc1)cc(C(CCC2)=C3N2C(CN(CC2)CCN2c2c(C)ccc(Cl)c2)=O)c1OC3=O,0 F6753-2212,O=C(C1CCN(CCOc2ccccc2)CC1)N(CC1)CCC1(F)F,2 Z3071577347,CC(CC1COC1)NC(C)c1nc(C(F)(F)F)cs1,2 Z4662056851,O=S(c(sc1c2cccc1)c2Br)(NCc1ccncc1)=O,2 SD03-0108,CC(C)C(N1CCC(C2)(CN(CC(N(C)CCOC)=O)C2c2nc(C)no2)CC1)=O,0 Z1353310366,O=C(CC1CCCCCC1)NS(C1CCCCC1)(=O)=O,2 Z2597403390,COC1(CCN(Cc(ccc(F)c2)c2C(O)=O)CC1)c1nc(C2CC2)no1,0 S715-3005,Cn1c(-c2noc(C(CC3)CN3C(c3cocc3)=O)n2)ccc1,2 SB66-0076,Cc(occ1)c1C(N(C[C@H]1CCC2)C[C@@H]1NC2=O)=O,2 V024-1828,O=C(c1c(N2c(cc3)ccc3Cl)ncn1Cc(ccc(F)c1)c1F)N(Cc1ccco1)C2=O,0 S713-3177,Cn1c(-c2noc(C(CC3)CCN3S(c(cc(cc3)OC)c3OC)(=O)=O)n2)ccc1,0 Z286771586,CNC(C1CCN(Cc2cnccc2)CC1)=O,2 Z1701409311,CCC(Cc1c(C2)cccc1)N2C(NCc1csc(C)n1)=O,2 SB04-0495,CN(C)C(N(CC1)CC1N(CCNC(c1nccn1C)=O)C1CCOCC1)=O,0 Z410615106,CCc(cccc1)c1NC(N(CC1)CCC1NC(C1CC1)=O)=O,2 Y030-1136,Cc1ccc(CNC(c(cccc2)c2Br)=O)cc1,0 Z4249186665,CC(C(N(Cc1c(C2)cccc1)[C@@H]2C(O)=O)=O)OCC(F)(F)F,0 SC09-0168,C[C@@H](COc(cc1)c(C2)cc1-c1cccc(F)c1)N2C(Cn1ncc(C)c1)=O,2 F0696-3795,O=C(c(cc1)nnc1N1CCCC1)Nc(cc(C(F)(F)F)cc1)c1Cl,0 S836-0632,NC([C@@H](C1)[C@@H](COc2ccccc2)CN1C(c(cc1)ccc1C#N)=O)=O,2 F2407-0808,O=C(Cn1c(cccc2)c2c(S(c(cc2)ccc2F)(=O)=O)c1)NC1CC1,2 F6484-0428,O=C(NCc1cccs1)NC(CC1)CCC1Oc1nccnc1,2 F6245-1791,O=C(c1cnccc1)N(CCC1)CC1c1nnc(C(F)(F)F)o1,2 D282-0414,CC(CC1)Cc2c1c(C(N)=O)c(NC(Cc1csc(-c3ccccc3)n1)=O)s2,2 SB95-1274,CS(N(CCN1CCOCC1)C1CN(Cc(cc2)cc3c2OCCO3)CCC1)(=O)=O,2 Y205-6757,CC(C)c1cc(C(N)=O)c(NC(C(CCCC2)C2C(O)=O)=O)s1,0 Z1157096625,CC(C)(CNC(NCc1cccc2ccccc12)=O)O,0 F6606-1930,O=C1N(CC(CC2)CCN2c2c(ccs3)c3ncn2)C=NC(C2CC2)=C1,2 S529-0344,O=C(CN(CCCc1c2cnc(C3CC3)n1)C2=O)NCc(cc(cc1)F)c1F,2 F6672-2244,O=C(CN1N=CC=CC1=O)N(C(CC1)C2)C1CC2=C1CCC1,2 F6438-2281,CN(C)c(nc(nc1)Oc2ccccc2)c1NC(Nc1ccccc1)=O,0 Z1047604618,O=C(CN(c1c(CCC2)cccc1)C2=O)Nc(cc1)ccc1F,0 J030-0131,CC(C1)OC(C)CN1S(c(cc(c(Oc(ccc(C)c1)c1N1)c2)C1=O)c2Cl)(=O)=O,0 F6031-1628,CC(CN1CCN(CC(NCc(cccc2)c2Cl)=O)CC1)O,0 F2880-3189,COc(ccc(NC(C(NCC(c1cccc2ccccc12)N1CCCC1)=O)=O)c1)c1Cl,0 Z4121941413,Cn1nc(C2CCCC2)c(CNCC(CC2)(C3)OCC23C(O)=O)c1,2 F6178-4927,O=C(CSc(cc1)ccc1F)NCC(CC1)CCN1c1nccnc1,2 F5854-1104,O=C(NCc1cccs1)N(Cc1cscc1)Cc1ncccc1,2 F6529-0906,Cc1c(C(N(CC2)CCC2N2N=C(C(F)(F)F)N(C)C2=O)=O)n(cccc2)c2n1,2 Z2646821442,O=C(Cn1nnc2c1cccc2)N1CC(C2)C2CC1,2 SB55-0267,Cc1nc([C@@](CCC2)(C3)[C@@H]2CN3S(Cc2ccccc2)(=O)=O)no1,0 F6438-3510,CN(C)c1nc(CNC(C2=CC=CN(C)C2=O)=O)nc(N(C)C)n1,2 Y042-1451,C1(N[C@@H](C(Nc2c1cccc2)=O)CC(N1Cc2c(CC1)cccc2)=O)=O,0 V029-7096,CCCN(Cc(cc(cc1)NC(C2CCCC2)=O)c1N(C)C)C(NC(C)(C)C)=O,0 Z2962534309,OC(CC1)(CCN1C(C(CCC1)N1c1nccs1)=O)C1CCC1,2 F5839-0142,CCCCOc(cc1)ccc1NC(Nc(cccc1)c1NC(c1ccncc1)=O)=O,2 SC42-0054,Cc(occ1)c1C(N(CC1)CCC11OCCC(Cc2noc(C)n2)C1)=O,0 F6671-3435,COCc1cn(C(CC2CC3)CC3N2c(nc2)ncc2Cl)nn1,0 SB04-0457,CN(C)C(N(CC1)CC1N(CCNC(c1cnncc1)=O)C1CCOCC1)=O,2 Z4471358837,CC(NC(Cc1c[nH]c2c1cccc2)C(N(CC1)CCC11CN(C)CCC1)=O)=O,0 F3164-0553,Cc(n1C2CCCC2)cn2c1nc(N(C)C(N1Cc(cc3)ccc3Br)=O)c2C1=O,2 Z1978120785,CC(C)(C)CC(C)(C)NC(c(cc(N)nc1)c1Br)=O,0 Z1628175756,CC(C)(C1)C1C(NCc1nnc(C)s1)=O,0 Z2105288959,Cc1ccc(CC(NS(c2cc(Br)cs2)(=O)=O)=O)cc1,0 M770-0311,CCc1noc(CN(C=Nc2c3n(Cc4cccc(F)c4)c(cc4)c2cc4F)C3=O)n1,0 SD01-1113,O=C(C1CC1)N(CC1)Cc2c1n(CC1CC1)nc2-c1cocn1,2 F3406-1485,Cc(cc(cc1)NC(CN(CC2)CC(C(c3c(cc4)F)=O)=C2Nc3c4F)=O)c1F,0 Z2964307999,C[C@](CN(C)C1)(C2)[C@H]1CN2C(Cc(cccc1)c1S(C)(=O)=O)=O,0 F6448-0861,CC(C)(C(Nc1cn(C2COCC2)nc1)=O)OC(C)=O,0 Z1272156660,CNC(c1cccnc1N(CC1)CCC1c1nc(cc(cc2)Cl)c2s1)=O,0 F6561-5491,O=C(N(CC1)CCC1S(Cc1ccccc1)(=O)=O)OCC(F)(F)F,0 Z3508056852,C[C@]1([C@H](CC2)O[C@H]2C1)C(NCc(cc1)nc(C2CC2)c1C(O)=O)=O,2 F1183-0091,CC(C)(CC(C1=CNc(cc2)ccc2NC(C)=O)=O)CC1=O,0 Z2618687786,COc1cccc(OC(F)(F)F)c1C(N(CC1)CCN1C(C1CC1)=O)=O,0 F6523-2848,Cn1c(-c2noc(CNC(Cc(cc3)ccc3OC(F)(F)F)=O)n2)ccc1,0 Z601-5631,CC(C)NC(C(C1)CN(C2CCCCC2)C1=O)=O,0 F5596-1297,O=C(CN(CC1)CCC1c1nnc(C2CC2)o1)NCC1OCCC1,2 F6521-2050,CC(c1ccc(C2(CNC(NCc3cccc4ccccc34)=O)CCCC2)s1)O,2 V023-7959,O=C(COc(cc1)ccc1Cl)Nc(cc1)cnc1N1CCN(Cc(cc2)ccc2F)CCC1,2 F6550-5014,O=C(c1noc(C2CC2)c1)N(C1)CC1Nc1nccnc1,2 G747-0304,CCN(CC1)CCN1C(c1cccc(Cl)c1)C(C(N(CCOC)C(C)=C1)=O)=C1O,0 Z28487340,O=C(c1ccccc1)Nc1cccc2cccnc12,0 F6482-2315,O=C(c1cc(Oc2ncccc2)ccc1)NC1CC2OCCOC2CC1,2 Z3211254464,CC(C(C)NC(N1Cc2ncccc2)=O)C1=O,0 Z2475285900,CC(Cc(cc1)ccc1NS(N1CCOCCC1)(=O)=O)C(O)=O,2 Z3111912826,Cc1cc(NC(C2NCCOc3c2cccc3)=O)nn1C,0 Z1721079069,CCN(CCOC1)C1C(N(CC1)CCC1(Cc1cccc(F)c1)O)=O,2 F6209-0317,O=S(c1cc(C(F)(F)F)ccc1)(NCCCn1c(-c2ccccc2)ncc1)=O,0 D216-2035,O=C(CCC(N1CCCCCC1)=O)Nc1nnc(C(F)(F)F)s1,2 F2616-0976,Cc(cccc1)c1NC(C(NCc1ncccc1)=O)=O,0 F6724-5282,C(C(c1cscc1)n1nccc1)Nc1nc(cncc2)c2s1,2 L309-0851,COc1ccc(CNS(c(cc2)cc(N3Cc4noc(C5CC5)n4)c2OCC3=O)(=O)=O)cc1,2 Z4464308168,CC1(C)c2nc(Cl)nc(N3CC(CCC(O)=O)CCC3)c2CCC1,0 F825-1665,O=C(C(CCC1)CN1S(c1ccc(-c2ccn[nH]2)o1)(=O)=O)NC1CC1,2 F6529-3669,O=C(Cc1cccs1)N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O,2 Z2863765572,O=C1NCCCC1N1Cc(cccc2)c2OC2(CCC2)C1,2 F2356-1093,COc(cc1)cc(OC)c1NC(CN(CC1)CCC1C(N(CC1)c2c1cccc2)=O)=O,2 F6480-3457,O=C(c1ccno1)N(CCC1)CC1Oc(nc1)ncc1F,2 Z952603936,CC(N(CCC1)CC1C(NCC1CCN(Cc2cccs2)CC1)=O)=O,2 F6479-3249,O=C(c1ncccn1)N(CC1)CCC1Oc(ccnc1)c1Cl,2 Z1651762893,CC(C)N(CCS(C)(=O)=O)C(c(cc1)c(C)n2c1cnc2)=O,0 F5857-2839,CC(CNS(c(cccc1)c1Cl)(=O)=O)(c(cc1)ccc1-c1ccccc1)O,2 Z855171784,Cc1n[nH]c(C(N(CC2)CCN2C(Cc(cccc2)c2Cl)=O)=O)c1,0 Z2441529481,O=C(c1n[nH]c(cc2)c1cc2Cl)NCCCC1NCCC1,2 F6226-0482,Cc(ccc(Cl)c1)c1S(N(CC(C1)O2)C1C2=O)(=O)=O,2 Z4295796375,COc(cc1)ccc1-n1nnnc1S(Cc1cc(C(O)=O)ccc1)(=O)=O,0 Z4282858033,CC(N(C1)CC1c1nc(O)cc(O)n1)=O,2 Z2715143868,O=C(C(C1C2)C1c1c2cccc1)N(CC1)CCC1c1ncco1,2 F6171-0396,COc(cc1)ccc1OCCS(Nc(cc(C(F)(F)F)cc1)c1OC)(=O)=O,0 Z3026726229,CC(C)CCCNC(c1nn(C)c(Cl)c1C(F)(F)F)=O,0 Z1133530706,CC(N1CCC(CNC(N(CC2)CCN2c2ccccc2)=O)CC1)=O,2 Z3369866466,OC(CN1C(CC2OCCO2)=O)(C(F)(F)F)c2c1nccc2,2 Z738412078,CC(C)NC(c(cc1)ccc1NS(c1c(C)cc(C)cc1C)(=O)=O)=O,0 F6559-0901,Cn1c(cccc2)c2c(CC(N(CC2)CCC2N(C2=O)N=Nc3c2scc3)=O)c1,2 F5871-3501,Cc1nsc(NC(c2c(C(F)(F)F)cccc2)=O)c1,0 Z3091864350,COC(c1c(C2CCN(CC3CCCCC3)CC2)ocn1)=O,2 F5831-6665,COc(cccc1)c1NC(NCC1CCN(Cc2ccccc2)CC1)=O,0 Z2391955431,CN(C=CC=C1NC(C(CCC2)CC2N)=O)C1=O,2 F6374-5441,O=C(COc(cccc1)c1F)N1CCC(CSCc2ccco2)CC1,2 Z1015217884,O=C(CN(CC1)CC1NC(Nc(cc1)ccc1F)=O)N1CCOCC1,2 F6494-0684,COc1cc(C(Nc2c(-c3ccccc3)nc3n2cccc3)=O)ncn1,2 F6363-0872,CC(C)(C(NCCNc1nc(C)nc(Nc2ncccc2)c1)=O)Oc(cc1)ccc1Cl,2 SA57-0684,Cc1cccc(OC2CC(CC3)(CCN3C(C3CCOCC3)=O)OCC2)n1,2 F6616-7372,Cc(ccnc1)c1NC(c1nc(cccc2)c2s1)=O,2 S423-0375,CCn1ncc(S(N(CC2)CCC2(C2)OCCC2OCc2ccccc2)(=O)=O)c1,2 SA68-0935,CCn1ncc(C(NCCN(C(CC2)CCN2C(C2CC2)=O)C2CCOCC2)=O)c1C,2 Z2396510534,OC(c1cn(C2CN(CCc(ccc(F)c3)c3Cl)CC2)nn1)=O,2 F6231-0040,O=C(c1c(C(F)(F)F)cccc1)NCCN(C(C=C1)=O)N=C1n1nccc1,0 3336-0974,Cc(cc1)ccc1C(CC1c(cc2)cc(OC)c2OC)=NN1C(CCCC(O)=O)=O,0 Z3016339080,CN(CCC(C1)c2nc(-c(sc3c4cccc3)c4Cl)no2)C1=O,0 F6411-1325,CC(CC1)CCC1NC(CSc1ncnc2c1[nH]cc2-c1ccccc1)=O,2 Z787573268,CNC(c1cccc(CNC(c2cc(CN3CCCC3)ccc2)=O)c1)=O,2 Z1798259767,Cc1c(CN(C)c2ncnc3c2[nH]cn3)c(C)nn1-c1c(C)cccc1,2 Z2303491314,C[C@H](C1)[C@@H]1NC(c(cc1)ncc1Oc1cccc(F)c1)=O,2 F5308-0318,O=S(Cc1ccccc1)(NCCCN(CC1)CCN1c1ccccc1)=O,2 Z838265054,CN(C(C(C#N)=C(NCc(cc1)cc(F)c1F)N1C)=O)C1=O,0 Z2297442978,COc(cc1)cc(C2)c1OCCN2C(c1csc(C2CC2)n1)=O,0 Z363380892,Cc(n(C)nc1C)c1NC(C(C1)CN(CC(F)(F)F)C1=O)=O,2 P506-1831,Cc1cc(-c2nn(C=CN(Cc3noc(-c4cccs4)n3)C3=O)c3c2)c(C)cc1,2 F6296-1170,Cn(c(CNC(C1c(cccc2)c2Oc2c1cccc2)=O)c1)nc1-c1cccs1,2 3879-6102,CCSCCOC(C(C1c2cccc(Br)c2)=C(C)NC(CCC2)=C1C2=O)=O,0 Z1241723935,O=C(Nc(cc1)cc2c1OCCO2)N(CCC1)CCC1N1CCCC1,2 F6351-0237,Cn1nnc2c1ncnc2N(C1)CC1C(N(CC1)CCN1c1ncc(C(F)(F)F)cc1)=O,2 F6436-0700,Cc(n(C)nc1C)c1S(Nc(cc1)cc2c1OCCC(CCCC1)N1C2=O)(=O)=O,2 Z786052812,O=C(c1cc(CN2CCCC2)ccc1)Nc1cc(-c2nnnn2C2CC2)ccc1,2 Z2825610721,C(c1cccc2ncccc12)N(CC1)CC1Oc1ncccc1,2 F3386-3042,CCCCCOc(ccc(C(C)(C)C)c1)c1S(n1ncnc1)(=O)=O,0 F6403-0966,CC1Oc(cccc2)c2OC1C(N(Cc1cnc2n1cccc2)c1ccccc1)=O,2 G282-7227,CC(Cn1c2c(C(Nc(cc3)c(C)cc3Cl)=O)nc1)(C(NC1CCCC1)=O)N(C1CC1)C2=O,0 Z2332131156,CC(c(ccc(C(N(CC1)CCN1c1nccnc1C)=O)c1)c1O)=O,0 F6610-2077,Brc1cnc(NCc(cc2)cnc2N2CCOCC2)nc1,2 Z2238852871,CN(C)C(c1nccc(N(C[C@@H]2O)C[C@@H]2OC)c1)=O,0 Z5011956871,CC(CCN1C)(C(N([C@H](CC2)C3)[C@@H]2C[C@H]3NC(c(scc2C)c2Cl)=O)=O)C1=O,2 Z1732593895,Cc1n[nH]c(CNC(Nc2nnc(-c3cc(C)cc(C)c3)s2)=O)c1,2 F6555-0423,O=C(NCc(cc1)cc2c1OCO2)N(C1)CC1n1nnc(C2CC2)c1,2 Z1191291230,CC(C)c(cc1)ccc1-c1csc(NC(CNCC(F)(F)F)=O)n1,0 E216-1586,CC(C1)Oc(ccc(C)c2)c2N1C(N(CC1)CCC1C(NCc(cccc1)c1Br)=O)=O,0 F5860-4144,COC(C(CC(C1)C2)(CC1C1)CC12NC(c1nc(cccc2)c2s1)=O)=O,2 F856-0339,COCCn1nnc2c1ccc(S(N(CCC1)CC1C(NCCC1=CCCCC1)=O)(=O)=O)c2,2 Z4278988637,CC(C)(C)c(o1)ncc1S(NC1COC1)(=O)=O,2 V007-9954,OC(CN(Cc1c(N2CCCCC2)onc1-c1ccccc1)C1CC1)COCc1ccccc1,2 Z1101433998,Cc(nc(cc1)C(NCCC(F)(F)F)=O)c1C(O)=O,0 F1609-0534,Cc(cc1)c(C)cc1S(c(nnn1c2c3scc2)c1nc3N1CCCCC1)(=O)=O,2 F6680-3465,COc1nccc(N(CCN(Cc2cocn2)C2)C2=O)c1,2 Z3297177619,CC(C)CC1N=C(C(C)C)c(cccc2)c2NC1=O,0 Z2771161437,COC(C(Cc1c[nH]cn1)NC(CCc1cccc2ccccc12)=O)=O,0 SD56-0768,O=C(Nc(cc1)cc2c1OCCO2)N(CCC1)CC(C(N2C3CCCCC3)=O)N1C2=O,2 Z2483110602,CC(CN(CC1)CCN1c(cc(cc1)OC)c1Cl)(C(O)=O)O,0 F1403-0099,O=C(CCC1)C(C2c(cccc3)c3Cl)=C1OC(CCC1)=C2C1=O,0 8018-9269,Cc(cc(c(N1)c2)OCC1=O)c2S(N(C1)c(cccc2)c2NC1=O)(=O)=O,0 SD25-0549,O=C(Cn1cncc1)N1CC2(CCCCC2)C(CCC(N2CCOCC2)=O)C1,2 F6660-0167,Cc(n(-c(cc(C)cc1)c1OC)nn1)c1S(c(cc1)ccc1Br)(=O)=O,0 F2879-5134,O=C(C(Nc1cnccc1)=O)NCCC1=CCCCC1,2 J004-1782,CC(C)c1noc(C(CCC2)N2C(c2c(C)onc2C)=O)c1,0 Z3409692683,Cn(c1c2cccc1)c(C(OC)=O)c2NC(N1CC(CO)OCC1)=O,0 F6363-0636,O=C(c1cccc2ccccc12)NCCNc1ncnc(-n2cccc2)c1,2 F5659-5333,Cc1c(CN(CC(C2)c3noc(-c4ncccc4)n3)C2=O)cccc1,2 S725-1948,CCC(C)NC(N(CC1)CCC1(CC1CC1)NC(COC)=O)=O,0 F6435-2002,O=S(c1cnccc1)(N(C1)Cc2c1cncn2)=O,2 Z2077579370,Cn1c(C(N(CC2)c(cc3)c2cc3Cl)=O)ccc1,0 P681-0153,COc(cc1)cc(C2(CC3)CN3C(c(ccc(OC)c3)c3OC)=O)c1NC2=O,0 Z3278165768,OCc1cc(NC(Cc(s2)ccc2S(N2CCCCC2)(=O)=O)=O)cc(CO)c1,2 CM4527-0408,CCCNC(N(CC1)CCC1(C1)C(c2ccccc2)N1C(C)C)=O,0 V019-9628,COc1cccc(Cn2c(C(N(CC3CC3)C(N3c4ccccc4)=O)=O)c3nc2)c1,0 F6415-1266,CSc(nccc1)c1C(N(CCc1cccs1)Cc1cocc1)=O,2 Z3856218372,CC1(CN(C)C(C(CC2)CCN2c(cc2)ncc2C#N)=O)OCCC1,2 Z2948829092,O=C(CCCNC(c1cc(C(CCC2)=O)c2nc1)=O)NC1CC1,2 F6808-5960,N#CC(CC1)(CCN1c1nc(cc(cc2)Cl)c2o1)c1ccccc1,2 F6262-1733,CCOc1cc(NC(Cc2noc3c2cccc3)=O)ncn1,2 F1018-1679,CC(c1ccccc1)NS(c(cc(cc1)OC)c1OC)(=O)=O,0 L090-3735,CN1CCN(CCNC(c(c(N=CN2C)c3C2=O)nn3-c(cc2)ccc2F)=O)CC1,2 F6481-0327,O=C(Cc1cc(C(F)(F)F)ccc1)N(CC1)CCSC1c1ccccc1,0 F6756-2439,CN(C(C(C1)C2CN1c1c(ccc(F)c3)c3ncn1)=O)C2=O,2 Z2646074460,CC(C)(C)n(cc1C(N2CC(Cc3ccc(C)cc3)C2)=O)nc1Br,0 Z808567010,OC(CC(CCC1)N1C(C1(CC1)c(cc1)ccc1Cl)=O)=O,0 Z1227819711,Cc1nnnn1C(Cc1ccccc1)C(NCc1ccccc1)=O,0 T368-3064,CCCc1nc2cccnc2n1C(CC1)CN1S(c1ccccc1)(=O)=O,0 D399-0106,Cc1noc(C)c1S(N(CCC1)C1c(cc1)ccc1Cl)(=O)=O,0 FF01-1410,Cc1noc(C)c1S(N(CCC1)CC1C(O)=O)(=O)=O,0 F6448-0236,O=C(CN(c(cccc1)c1O1)C1=O)Nc1cn(CC2OCCCC2)nc1,2 Z3085253167,Cc(cc1)cnc1N(C)C(c1cccc(C(N2CCCCC2)=O)c1)=O,2 Z2755585309,Cc1noc(C2(CCOCC2)NC(c2cc(CC(O)=O)ccc2)=O)c1,2 Z3141922334,CCc(c(C)c1)nc(O)c1C(NC(C1)CC1(C1)C1N)=O,0 Z2998575141,CCN(C(c1nn(C)c(C(F)F)c1)=O)c1ncccc1C,0 F6573-0453,Cc(ccc(Cl)c1)c1S(NCc(cc1)cnc1-c1ccnn1C)(=O)=O,2 Z2229739608,CC(c1cc(C(N[C@H](CCC2)c3c2ccc(C)c3)=O)c(C)nc1C)=O,0 F6517-0673,OC(CNC(c1cc(Br)cnc1)=O)c1ccc(-c2cccs2)o1,2 F6015-0233,O=C(CCCn1cccc1)Nc(cc1)cc(C2)c1-c1c2cccc1,2 P935-1767,O=S(c1ccccc1)(N(CCCC1)C1c1nncn1CC1CC1)=O,2 F6446-0090,O=C(c1noc(-c2ccccc2)c1)NC(CC1)CN1c1ncccc1,2 Z3391875724,CN([C@H](CC1)CC[C@@H]1O)c1cc(OC2CCOCC2)ncn1,2 Z2996021093,CC(C)N(C1CCOCC1)C(c1coc(CCCN2)c1C2=O)=O,2 Z1159213130,O=C1n2nccc2NC(CN(CC2)CCC2c2nc(-c3ccccc3)no2)=C1,2 F892-0658,Cc(sc(-c1noc(C2CCC2)n1)c1)c1NC(Cc1c[nH]c2c1cccc2)=O,2 SB95-1216,Cc(nc1)ncc1C(N(CCC1)CC1N(CCN1CCOCC1)C(C1CC1)=O)=O,2 F6482-5320,O=C(c1noc(-c2ccccc2)c1)NCc1c(-c2ccncc2)nccc1,2 S826-3292,Cc1noc([C@@H]2[C@@H](COC)CN(Cc3c[nH]nc3-c3ccccc3)C2)n1,2 F6225-1001,Cc1c2nc(N(C)CC(NCCc3cccs3)=O)sc2c(C)cc1,0 Z4126468181,Clc1c(N2C(CC3CCC3)CCCC2)ncnc1,2 F6516-0062,O=C(c(c(F)ccc1)c1F)NCc1ccc(-c2cccs2)o1,0 Z1360025790,O=C(C(CC1)CCN1c1nn2nnnc2cc1)N(CC12CCCC2)c2c1cccc2,2 Z4021124445,CCCC(C)(C)C(N[C@@H](CCC1)CN1C(C(c1c2cccc1)=NNC2=O)=O)=O,0 F6395-4102,O=C(CN(C(c1c2cccc1)=O)C2=O)N1CC2(CCOCC2)OCC1,2 F6246-4239,CC(C1(CC(C2)C3)CC3CC2C1)NC(CN(CC1)CCC1c1nnc(C)s1)=O,2 F1696-0215,CCOc(c(Cl)c1)cc(Cl)c1S(n1cnc(C)c1)(=O)=O,0 Z852218182,CCN(CC)C(CNC(c(cc1)cc2c1[nH]c(C)c2C)=O)=O,0 F3406-8460,CCOC(CN(c1ccc(C)cc1)S(c(cc1)cn2c1nnc2)(=O)=O)=O,2 Z2451820663,O=C(C(C=C1Br)=CNC1=O)N(CCNC1)C1c1cc(Cl)ccc1,0 G804-2022,COc(cc1)ccc1NC(c(nccc1)c1C1=O)N1c1ccccc1,0 Z1743874597,O=C(c1ncncc1)N(CC1)c(cc(cc2)Cl)c2N1C1CC1,0 Z2993443036,Cn1cnc(CNc(cc2)c(CO)cc2Br)c1,0 J500-0388,CC(C)NC(C(C1)C2(CCCC2)CN1C(c1c(C)nc(C)s1)=O)=O,2 T158-1567,CCS(N(CC1)CC1c1ncc(C)n1Cc(cc1)ccc1F)(=O)=O,0 F6606-4966,O=C(c1nc2ccccc2nc1)N1CCC(CN(C=NC=C2)C2=O)CC1,2 SD61-0002,O=C(C(C1)C2(CCC2)CN1c1ncccn1)NCCCN1CCOCC1,2 E852-3596,CCN(C(C)(Cn(c1c2)nc2C(N2CCCC2)=O)C(NC2CCCC2)=O)C1=O,2 S729-0230,COc1cccc(NC(C(CCO)(CC2)CN2c2ncccn2)=O)c1,0 Z1651957867,O=C(c1cnns1)NCC(CCCC1)S1(=O)=O,2 S322-0102,O=C(CC(CN(CC1)CCC1(c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2)C1)N1c1ccccc1,2 F6805-5610,CN(C1CCN(CC(NCC2OCCC2)=O)CC1)c(nc1)ncc1Cl,2 F5596-0679,COc(nccc1)c1C(N(CC1)CCC1c1nnc(C2CC2)o1)=O,2 F2297-0591,CC(C)CCN(c(cc(cc1)NS(C)(=O)=O)c1OCC1(C)C)C1=O,0 SA44-0536,CC(C)Cc1nnc(C2N(C)CC(C3)(CN3C(c3cscc3)=O)C2)o1,2 Z2912211932,Cn1ncc(C(N2C(C(O)=O)c(cccc3)c3OCC2)=O)c1,0 F1358-0196,CCOC(c1c(NC(c(cc2)cc3c2OCCO3)=O)scc1)=O,0 F6675-8510,CN(C(C1)CN1c1nccnc1C#N)C(Nc1c(C(F)(F)F)cccc1)=O,0 Z1283552232,CC(c1cn(C)nc1)NC(N1C(Cc2ccccc2)CCC1)=O,0 SB55-0556,CC(C)Cc1nc([C@@](CCC2)(C3)[C@@H]2CN3C(CCS(c2ccccc2)(=O)=O)=O)no1,2 Z2282896402,Cc1c(CCN(C)C(c2cnnn2Cc2ccccc2)=O)cccc1,0 V019-5457,CCN(CC)CCN(CC1)CCN1c1c(CCCC2)c2nc2ncnn12,2 Z2006883034,CS(C(CC1)CN1C(NCc1nc(CCCC2)c2cc1)=O)(=O)=O,2 Z3601604390,CN(C(CC1C(N(CC2)CCC2C(C2)C2(F)F)=O)=O)c2c1cccc2,2 F6374-1488,Cn1c(SCC(CC2)CCN2C(NCCOC)=O)ncc1,0 SB14-0966,O=C(C1CC1)N(C(CC1)CN1C(c(cc(cc1)Cl)c1F)=O)C1CCOCC1,0 F0662-1271,Cc(cccc1)c1N(C(C=C(Nc(cc1)cc2c1OCCO2)N1)=O)C1=O,2 S691-0771,Cc1cnc(CC(CC2)CN2C(Nc2cc(C)c(C)cc2)=O)n1CCOC,2 Z3134736130,CN(C)c1cc(CNC(c2cc(C(CN)CCC3)c3cc2)=O)ncc1,2 SD06-0799,COCC(N[C@@H](C[C@@H](COc1ccccc1)C1)[C@H]1C(NCc1cscc1)=O)=O,2 Z814734226,Cc1cn(CC(NC2c3cccc(Cl)c3OCC2)=O)nc1,2 T502-1607,COc1ccc(C2(CC2)C(N(CC2)CCC2(C(NCc2ccncc2)=O)F)=O)cc1,2 SB74-0587,O=C([C@H](C[C@]1(CC2)CN2C(c2ccccc2)=O)NC1=O)NC1CCCC1,2 V002-2023,COc1cccc(C(CN(CC2)CCN2S(c(cc2)cc(OC)c2OC)(=O)=O)OCc2cccc(Cl)c2)c1,0 S613-0701,COCCC(N(CCC1)C1c1nc(CCOCC2CC2)no1)=O,2 F6554-8165,O=C(c(cc1)cc2c1ncs2)N1C(C2)CSC2C1,2 8179-0047,Cc1c(C(c(cccc2)c2N2C/C=C/c3ccccc3)(C2=O)O)c(cccc2)c2[nH]1,2 Z3687067864,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NC(c1coc(Cl)c1)=O,0 Z2840138167,CC(C)[C@@H]1N(C)CCN(CC(Nc(cc2)cnc2N2CCCCC2)=O)C1,0 F6481-0005,O=C(c(cc1)ccc1-n1cccc1)N(CC1)CCSC1c1ccccc1,2 Z1408055036,Cc(cc(cc1)C(O)=O)c1S(Nc1c(cn[nH]2)c2ccc1)(=O)=O,0 Z1143402673,CC(C)c1n[nH]c(C(NC2CC2)=O)c1Br,0 Z3686246748,CN(C(C1N(Cc2cc(COCC3)c3cc2)CCC1C1CC1)=NN1)C1=O,2 Z3551253792,Cc(cc(n1nc2)O)nc1c2C(NC(CC1)CN1c(cccc1)c1F)=O,2 Z2949944189,CN(C(C1)Cc2c1cccc2)C(c1cc(C(CCC2)=O)c2nc1)=O,2 E957-1981,COc(cccc1)c1N(CC1)CCN1C(c(oc1c2cccc1)c2NC(c1ccccc1)=O)=O,0 Z1864557061,O=C(NCC1c(cccc2)c2OCC1)N(CC1)CCC1c1ccncc1,2 Z1477441039,CC(C)(C)CC(N(CCC1)C1C(N1C(CC(c2cn(C)nc2)=O)CCC1)=O)=O,2 Z3085256413,O=C(C1=CNc(cccc2)c2C1=O)NC1(CCCC1)C(F)F,2 S993-0687,CC(C)CN(CC(N(CC1)C2CCN1C(c1c(C)onc1C)=O)=O)C2=O,2 F819-0401,CC(c1nc(-c(cc2)ccc2S(N2CCC(C)CC2)(=O)=O)no1)Oc1cccc(Cl)c1,2 Z2238510843,NC(CC(O)=O)(CC1)CS1(=O)=O,0 F3316-0036,CCOc(cc1)ccc1NC(C(C)Cn1nc(C)c(C)c1C)=O,0 Y043-6002,COc1cc(CCN(Cc2c(c(C(c3ccccc3)=O)co3)c3ccc2O)C2)c2cc1OC,2 Z1446827419,Cc(cc(cc1)Oc2ncccc2C#N)c1F,0 V007-6869,O=C(CCc1ccccc1)N(CCC1)C1c1nc(cc(cc2)-c3c(C(F)(F)F)cccc3)c2o1,2 Z250-1364,CC(CC1)CCC1NC(C(CCC1)CN1C(NC1=O)=Nc2c1scc2-c1ccc(C)cc1)=O,2 Z1508938788,C[C@H](c(cc1)ccc1C(O)=O)NC(C)=O,0 F3162-0068,c1coc(-c2nc(-c3ncccc3)nnc2-c2ccco2)c1,2 F6201-0480,CC(C)(C)c(cc1)ccc1NC(NCc1c(C)oc(C)c1)=O,0 Z2605759661,O=C(c1c(CNC2)c2ccc1)N(CCC1)CC1c1nc(-c2cccc(F)c2)no1,2 Z1517104155,CSCCC(c1nnc2n1cccc2)NC(C1CC(CCCC2)C2CC1)=O,2 Z1319564661,Cn(c1c2c(NC(c(cc3)cc4c3[nH]nc4)=O)n[nH]1)nc2-c1ccccc1,2 Z2445067138,CC1(CN)CN(Cc2cccc(Oc3ccccc3)c2)CC1,0 F6676-9736,O=C(CN(C=Nc1c2cccc1)C2=O)N1CC(Cn2cncc2)C1,2 F2167-1126,O=C(c1c2cccc1)N(CC(CCC1)N1c1ccccc1)C2=O,2 Z2973831467,O[C@@H](CN(C1)c2nc(C3CCC3)ncc2)[C@H]1Oc1ccccc1,2 E570-4607,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(N(CCC1)CC1C(NC1CCCC1)=O)(=O)=O,2 F6755-7402,Cc1nnc(CN(CC2)CCN2S(C2CC2)(=O)=O)n1C,2 F6670-4666,COc1c(CC(N2CCC(CN(C=Nc3c4cccc3)C4=O)CC2)=O)cccc1,0 Z2959349908,Cc(ccnc1)c1N(CC1)CCN1C(c1cc(C2CC2)nn1C)=O,2 Z1264305668,Cn(c(C1CC1)c1)nc1C(N(CC1)CCN1C(Cc(cc1)ccc1Cl)=O)=O,0 F6563-0131,O=C(CCc1cccc(Cl)c1)N(CC1)CCC1Oc1cscc1,2 SC03-0327,O=C(C1CCCCC1)N(CC1)CCC1OCCc1noc(C2CCOCC2)n1,2 Z1575484043,O=C(c1c(C(F)(F)F)cccn1)N(CC1)CCN1c1nccnc1,0 Z2330847980,Cc1nc(C2CN(CC(NCc3cc(F)cc(F)c3)=O)CC2)n[nH]1,0 D754-0184,O=C(CCCc1nc(-c2ccco2)no1)NC[C@@H](CN(Cc1c2cccc1)C2=O)c1ccccc1,2 Y041-6894,O=C(CCn(cc1)c(cc2)c1cc2Br)NC(CC1)CS1(=O)=O,0 F6561-8456,O=C(NC(c1ccccc1)c1ccccc1)N(CC1)CC1N(CCO1)C1=O,2 F6436-1158,Cc(ccc(NC(c1cc(Br)cs1)=O)c1)c1N(CCC1)C1=O,0 F6529-1096,CN(C(C(F)(F)F)=NN1C2CCN(CC(Nc(cc(cc3)Cl)c3OC)=O)CC2)C1=O,2 E569-0153,Cc(cc1)cc2c1onc2CNC(N(CC1)CCN1c1c(C)c(C)ccc1)=O,0 S826-4179,Cc1noc([C@@H]2[C@@H](COC)CN(Cc(ccc(OC)c3)c3OC)C2)n1,0 C260-3089,O=C(CN(C(c(cccc1)c1N1CC(Nc2c(C(F)(F)F)cccc2)=O)=O)C1=O)NCCc1ccccc1,2 SA49-0116,O=C(CC1COC(C2)(CN2C(CCCc2ccccc2)=O)C1)NCC1CC1,2 F6724-3504,OC(CNc1ncnc2cnccc12)c(cc1)cc2c1OCC2,2 Y042-2532,COc1cccc2c1cc(C(NC(CC1)c(cc3OC)c1cc3OC)=O)[nH]2,0 V008-3927,CCOc(cc(CN(CCCn1c2ccc1)C2c1ccc(C(F)(F)F)cc1)cc1)c1O,0 F6415-1079,CC(Nc(cc1)ccc1S(N(Cc1cocc1)Cc1cccs1)(=O)=O)=O,0 F3371-0812,O=C1Nc(cccc2)c2/C(/c(cc2)ccc2Cl)=N\c2c1cccc2,2 S590-0019,Cc1noc(C)c1C(NCC1N(C)Cc2cccn2C1)=O,2 Z1265239796,CC(NCc1cccc(CNC(C(CCC2)CN2C(C2CC2)=O)=O)c1)=O,0 Z3116130665,CCO[C@@](C)(C1)[C@@H]1NC(N1Cc2cc(C3CC3)nn2CC1)=O,2 Z352255714,CCN(CC)S(NC1CNCCC1)(=O)=O,0 Z2755497062,CC(CC(N(CC1)C(C(O)=O)c2c1occ2)=O)c1cccc(F)c1,2 F6556-5705,CC(C)C(Nc(cc1)ccc1S(N(CCC1)CCN1C1COCC1)(=O)=O)=O,0 SD61-0028,CN(C)CCN(Cc1ccccc1)C(C(C1)C2(CCC2)CN1c1ncccn1)=O,0 F6495-2035,O=C(c1ncnc(N2CCCC2)c1)NC(CC1)CS1(=O)=O,2 F3411-3207,Cc1cccc(C2=NC(CC3)(CCN3C(Nc3cccc(SC)c3)=O)NC2=O)c1,0 F0777-0801,Nc(cc1)ccc1C(OCC(c1ccccc1)=O)=O,0 F6676-2603,CN(C(CC1)CCN1S(c1c(C(F)(F)F)cccc1)(=O)=O)c1ncccc1,0 Z2466244395,CN(C)Cc1cccc(-c2cc(C(NCC3)=O)c3cc2)c1,2 Z2592421908,CN(C1CCNCCC1)S(c(cc(c(CC1)c2)NC1=O)c2Cl)(=O)=O,2 S997-0669,Cn1c(C(N2C[C@@H](CN(C3)S(C)(=O)=O)[C@]3(CO)CC2)=O)ccc1,2 G267-0799,CCn1nc(C)c(CCNC(CCc2c(C)n(-c(cc3)nnc3N3CCCC3)nc2C)=O)c1C,2 F6451-0998,Cc1ccc(C(CNC(NC2CCCC2)=O)OC)s1,2 F6724-2981,C(C1(CCOCC1)c1cscc1)Nc1nc(cccc2)c2o1,2 M004-0228,O=C(NC1CCCC1)Nc(cc1)cc2c1sc(NS(c1ccccc1)(=O)=O)n2,0 Z996608772,Cc1c(C(Nc(cc2)cc(Cl)c2Oc2ccncc2)=O)sc(-c2ncccn2)n1,2 Z2218831899,CC(C)C(Nc1nccc(C(NCCNC(c(cccc2)c2F)=O)=O)c1)=O,0 Z1549620373,COC(CC1c2nc(-c3cnccc3)c[nH]2)CN1C(c1cncn1-c(cc1)ccc1F)=O,0 V020-9095,CC(C)NC(c1csc(COc2cc(C(c3ccc(C)cc3)N(CC3)C(C4CC4)=O)c3cc2)n1)=O,2 Z1868507348,O=C(CN1)N(C(CC2)Cc3c2cccc3)C1=O,2 F6782-0613,CC(C)(C)OC(N(CC1)CCN1C(CCC(c(cc1)ccc1F)=O)=O)=O,2 F069-0691,CCC(C(Nc1cc(C(C)=O)ccc1)=O)N(c(cc(C)c(C)c1)c1N=C1C(F)(F)F)C1=O,0 S696-0253,Cc1cnc(-c2ccccc2)n1CC(C1)CN1C(NC)=O,0 F5079-0249,O=C(C1CCCCC1)Nc1nnc(Cc(s2)ccc2Cl)o1,2 S688-0411,CCNC(NC(CCOC)(CC1)CCN1C(CC1CCCC1)=O)=O,0 F5772-6406,O=C(c(cc1)cc(nc2)c1n2-c1ccccc1)NCc1nc(-c2ccccc2)no1,2 G229-0565,COc(cc1)ccc1-c1noc(C(CC2=O)CN2c(cc(cc2)OC)c2OC)n1,0 S517-0495,O=C(Nc(cc1)cc2c1OCCO2)N1CCC(Cc2nncn2CC2CC2)CC1,2 S691-0558,Cc1cnc(CC(CC2)CN2C(NCc(cc2)ccc2OC)=O)n1CC1CC1,2 F6240-5147,O=C(Cc1cc(F)ccc1)NC1(CCCCC1)c1nc(-c2cscc2)no1,2 G325-1516,CCC(N(C(C)C1)c(cc2)c1cc2S(CCC(NCCc1c(C)ccs1)=O)(=O)=O)=O,2 Z3026725058,CN(C(CC1)CCN1C(COCc1nc(cccc2)c2s1)=O)OC,2 F3411-5769,Cc1c(CSc(n2-c3c4cccc3)nnc2N(Cc(cc2)ccc2F)C4=O)cccc1,0 SB95-1147,Cc1ccc(C(N(CCC2)CC2N(CCN2CCOCC2)C(C2CC2)=O)=O)s1,2 F6252-0844,O=C(c1ccco1)NC(CC1)CN1c(cc1)nnc1-c(cccc1)c1F,2 Z1149242026,C[C@@H](c1ccccc1)NC(NCC(c1cccc(F)c1)O)=O,0 E220-0176,CC(C)OCCCNC(c1ccc(CN(CC(N2C3CCC2)=O)C3=O)cc1)=O,0 Z968661058,O=C(c1ccccc1)N1CCN(CCN(CCN2)C2=O)CC1,0 F3222-2359,CC(Nc1c(C(Nc2cc(C)c(C)cc2)=O)nnn1-c1ccc(C)cc1)=O,0 F6554-8412,O=C(c1cc(-n2nccc2)ccc1)N1C(C2)CSC2C1,2 6028-6066,COc(cccc1)c1NC(COc1ccc(C(Nc2c3cccc2)N(Cc2ccccc2)S3(=O)=O)cc1)=O,2 F2167-4129,CC(C)(C)OC(N(C(CC1)C2)C1CC2n1ncnc1)=O,2 F6608-0483,FC(c(cn1)cc(Br)c1OC1COC1)(F)F,0 S997-0625,CS(N(C1)C[C@]2(CO)[C@H]1CN(Cc(cc1)cc(F)c1F)CC2)(=O)=O,0 Z3054334859,Cc1c(C(N[C@@H](CCOC2)[C@@H]2Nc2nc(C)ncc2)=O)scn1,2 F5868-0129,Cc1ccnc(OCC(Nc(cc2)ccc2OC(F)(F)F)=O)n1,0 F6556-7744,CC(Cc1cc(cccc2)c2o1)NS(c1c(C(OC)=O)scc1)(=O)=O,2 Z2228906808,O=C(C1CC1)Nc1nccc(C(N(CC2)CCC2C2CC2)=O)c1,2 Z2874433301,Cc1c(NC(c2coc(C3CCC3)n2)=O)[nH]nn1,2 F6414-0569,OC(CNC(c1cc(cccc2)c2o1)=O)c(cc1)cc2c1OCCO2,2 Z1554845047,Cc1ccc(C2OCCCC2CNC(c2ccc(Cc3nnc[nH]3)cc2)=O)cc1,2 F6349-1285,O=C(C1Oc(cccc2)c2OC1)Nc(cc1)ccc1-c1cnc2n1CCC2,2 Z1958852661,CC(C)n1cnc(S(N(CCC2)CCC2(C)OC)(=O)=O)c1,0 F6502-6441,Cc1cc(-c2ccncc2)nn1CCNS(N(C)C)(=O)=O,0 8004-2590,O=C(CC(C1=O)N2CCN(C/C=C/c3ccccc3)CC2)N1c(cc1)ccc1Br,0 F6524-6199,Cn1c(C(N(CC2)CCN2C(CC2)CCS2(=O)=O)=O)ccc1,2 F6561-7543,O=C(CSCc1ccccc1)NC1CN(Cc2cscc2)CC1,2 Z1021435982,O=C(c1cccc2ncccc12)N1CCNCC1,0 F6802-8068,CN(C=NC(N(CCC1)CC1C(N1CCSCC1)=O)=C1)C1=O,2 M026-1532,Cc1noc(/C=C\c(cc2)ccc2S(N(C)Cc2ccco2)(=O)=O)c1NC(C1CC1)=O,2 8017-8983,Cc1cc(N(CC2)CCN2C(CC(N2c(cc3)ccc3F)=O)C2=O)nc(C)n1,2 Z1071415396,O=C(NCc1c(-n2cncc2)nccc1)N1CC(c(cccc2)c2F)OCC1,2 Z1584274519,CCCN(CC1)CC=C1c(cc1)cnc1Cl,0 SC72-1965,O=C(c(cc1)ccc1OC(F)(F)F)N(C1)CC11OCc2c1cnc(-c1ccccc1)n2,0 F6403-0487,O=C(c(cccc1)c1Br)N(Cc1cnc2n1cccc2)C1CC1,0 F6442-1789,CC(C)CS(C(C1)CN1C(Cn1ncc(-c(cc2)ccc2F)c1)=O)(=O)=O,2 Z2995347659,Cc(cc1)cnc1N(C1CCCCC1)C(c1cc(C(F)F)ncn1)=O,2 Z3048933667,CCCn1ncc(C(NC(C)c2c(C)onc2C)=O)c1C,0 Z3049748639,OCC(CC1)CCN1C(c(cc1)ccc1NC(Cc1cnccc1)=O)=O,2 SB15-1187,Cc1cn(CCC(N(CCC2)CC2N(C2CCOCC2)C(C2CC2)=O)=O)nc1,2 V030-5757,O=C(c1cocc1)N1Cc2c(N3CCCCC3)nc(N3CCCCC3)nc2CC1,2 F6782-6825,CC(C)(C)c1ccc(CN(C=NC(C)=C2)C2=O)cc1,0 F6672-1677,CC=C(CC1CC2)CC2N1C(CCc1c[nH]c2c1cccc2)=O,2 SB95-1128,Cc1ccc(CN(CCC2)CC2N(CCN2CCOCC2)C(C2CC2)=O)o1,2 F817-1977,CN(C)C(c1csc(S(N(CC2)CCC2C(N(CC2)c3c2cccc3)=O)(=O)=O)c1)=O,2 L918-2218,O=S(c1cc(CCCC2)c2cc1)(N(CC1)CCC1c1noc(-c2cc(F)ccc2)n1)=O,2 E207-1424,Cn1nc(C(N(CC2)CCN2c(cc2)ccc2Cl)=O)c(C2)c1-c(cccc1)c1S2(=O)=O,2 F6726-5281,CN(C(C1)CN1c(ncnc1-c2ccccc2)c1F)C(c1cn(C)nn1)=O,2 Z2924518794,CC(C)(C)n1ncc(-c2noc(C(C3)CC3OCc3ccccc3)n2)c1N,2 Z4917918521,Cn1ncc(C(Nc2ccc(C(CC(N3)=O)NC3=O)cc2)=O)c1Cc1ccccc1,2 F1300-0343,O=C(c1cc(C(F)(F)F)ccc1)Nc1nc(-c(cc2)cc3c2OCCO3)cs1,2 P803-1908,COc(cc1)ccc1-c1n[nH]c(N(CCC2)CCN2C(c(cc2)cc3c2[nH]cn3)=O)c1,2 Y502-7409,CS(N(CC1)CCC1C(Nc(cc1)ccc1S(Nc1nccs1)(=O)=O)=O)(=O)=O,2 Y042-7377,N1(C(c2c(C1)cccc2)=O)[C@H](C(NCc1nc2c(n1CCOC)cccc2)=O)CC(C)C,0 F0161-0323,COc(cccc1)c1-c1csc(NC(c(ccc(Br)c2)c2F)=O)n1,0 C517-5444,CN(c(ccc(S(N(CC1)C(CN(C(c2c3cccc2)=O)C3=O)c2c1cccc2)(=O)=O)c1)c1O1)C1=O,2 G501-0359,Cc1cccc(S(NCC(c(cc2)ccc2N(C)C)N(CC2)c3c2cccc3)(=O)=O)c1,0 Z57636238,Cc(cc1)cc(S(N(CC2)CCN2c(cccc2)c2OC)(=O)=O)c1OC,0 Z4767998382,CC(C)(C)n1ncc(C(N)=O)c1NC(c(cc1)ccc1Cl)=O,0 CM3125-1737,CCN(C(C=C1)=O)N=C1N(CCC1)CC1NC(CN(c(cccc1)c1O1)C1=O)=O,2 F0850-5762,CCOc(cc1)ccc1N(S(c1c2cccc1)(=O)=O)S2(=O)=O,2 SC88-2202,CCC(CC)N(C1)CC1(C(CC1)c2nc(Cc(cc3)ccc3OC)no2)S1(=O)=O,0 F976-0216,Cc(cc1)c(C)cc1N(C(C=C1)=O)N=C1N(CCC1)CCN1S(c1cccs1)(=O)=O,2 F6523-2810,CCOC(C1CCC(CNC(NCc2nc(-c3cccn3C)no2)=O)CC1)=O,2 SC85-0587,CCC(CC)C(N(C1)C[C@]2(CN(C)CC2)[C@@H]1c1nc(-c(cc2)ccc2F)no1)=O,0 Z2720957539,CC(C)c1c[nH]c(SCc2nc(Cc3ccccc3)no2)n1,2 F6090-0309,CCOc(cc1)nnc1C(Nc(cc1)cc(Cl)c1F)=O,0 F5940-2054,COCCOCC(CC1)CCN1S(CCN(C(CCC1)=O)C1=O)(=O)=O,0 F6676-1208,Cc1nccc(OCC(CC2)CCN2C(CN(C=NC(C)=C2C)C2=O)=O)c1,2 Z1264456607,CC(CCC1)(CN1C(c1ccccc1)=O)C(Nc1nn(Cc2ncccc2)cc1)=O,2 F6793-7989,O=C(c1noc(-c2ccccc2)c1)N1CC(CF)CC1,2 F6806-4760,Cn1ncc(-c2cncc(N(CC3)CCN3c(ncc(C(F)(F)F)c3)c3Cl)n2)c1,0 Z2504649861,C(c(cccc1)c1-n1nnc2c1cccc2)NC(CC1)CN1C1CC1,2 F6525-5363,O=C(c1cccc(Cl)c1)NCCn1ncc(-c2cnccc2)c1,0 Z2272729079,OC(CCc1cc(NC(CCCC2CCOCC2)=O)ccc1)=O,2 Z1259924987,O=C(C(C1)C11c(cccc2)c2OCC1)N1Cc2nncn2CC1,2 D489-0081,O=C1n2nc(-c(cc3)ccc3F)nc2NC(CN(CC2)CCN2c(cc2)ccc2F)=C1,2 F6560-1361,Cc1c(C(N(C2)CC2Oc2cc(C)nc3ncnn23)=O)sc(C)n1,2 CM3034-2334,O=S(c(cccc1)c1Cl)(N1CC2(CCOCC2)C(COc2ccccc2)C1)=O,2 Z3187714991,Cc1ncc(CC(N(C)CC2CCCC2)=O)s1,0 F6436-3955,COC(N(CC1)Cc2c1ccc(NC(c1cc(ccc(OC)c3)c3[nH]1)=O)c2)=O,2 Z2084527819,Cn1c(sc(C(N([C@H](CC2)C(N)=O)[C@H]2c2ccccc2)=O)c2)c2c2c1cccc2,2 SB70-0937,COCCNC(c1nn(C[C@H](C2)NC(CN(c(cccc3)c3O3)C3=O)=O)c2c1)=O,2 Y041-8071,O=C(CCC(C(N1Cc(cccc2)c2Cl)=O)NC1=O)NC(CC1)CS1(=O)=O,2 T853-0354,O=C(C1(CCC(N2C3CCCC3)=O)C2=CCCC1)Nc(cc1)ccc1F,0 L310-2620,CCc1nc(CN(C(COc2c3)=O)c2cc(C)c3S(N(C)c(cc2)ccc2OCC)(=O)=O)no1,0 Z2597412249,OC[C@H](CN(Cc1c(C(O)=O)scc1)CC1)[C@H]1c1ccccc1,2 F978-0483,COc(c(NC(N(CC1)CCN1C(C=C1)=NN(c2ccccc2)C1=O)=O)c1)cc(OC)c1Cl,0 Z2335171119,O=C(c1cc(Cl)c[nH]1)N(CC1)CC1(C1)Oc(cccc2)c2C1=O,0 G883-0728,CCC(C(NCc(cc1)cc(CC2)c1N2C(c1ccccc1)=O)=O)N1c(cccc2)c2OCC1=O,0 Z3063545547,CC(C)CC(c1ccccc1)NC(C(N(C)C=C1OC)=CC1=O)=O,0 SB17-0219,O=C(CCc1ccccc1)N(CC[C@H]1NC(CC2)=O)C[C@]12C(N1CCOCC1)=O,2 F6782-5979,CC(CN1N=C(C(n2cncc2)=NC=C2)N2C1=O)=C,2 Z2187835397,CC(C)(C(CC1)O)N1C(CCc1cnccc1)=O,2 F6523-4331,Cc1cccc(OCC(NC(CCC2=NN3C)CC2=CC3=O)=O)c1,2 D240-0079,CN(c(ccc(S(N(Cc1ccccc1)C(c(cc1)ccc1Cl)=O)(=O)=O)c1)c1O1)C1=O,2 Y020-0212,Cc1nc(SC(CC(N2c3ccccc3)=O)C2=O)nc(C)c1,0 SC72-0660,Cc1cc(C(N(C2)CC22OCc3c2cnc(-c2ccccc2)n3)=O)nn1C,2 F6515-4536,O=C(c1c[nH]c2c1cccc2)NCc1cc(-c2cccs2)cnc1,2 Z1275014443,NS(c1ccc(CCC(Nc2n[nH]c(C3CCOCC3)c2)=O)cc1)(=O)=O,2 Z2222879911,CN(CC(C1CC1)O)C(C(CC1)CCN1c1noc(cc2)c1cc2Cl)=O,2 F6559-1976,O=C(C1CCCC1)NCc1nc(C2CCSCC2)no1,2 F6353-6199,O=C(C(Oc1c2cccc1)=CC2=O)NCC(c1ccco1)N1CCSCC1,2 Z3715993507,CC(C1)=NOC1(CC1)CCN1C(C(N=C(C1CC1)N1)=CC1=O)=O,2 F6524-1125,O=C(c(cc1)cnc1OC1CCCC1)NCCN1N=Nc(ccc(F)c2)c2C1=O,2 F6760-2355,CC(N(C)N(C1=O)c2ccccc2)=C1NC(c1nnc(CCCC2)c2c1)=O,2 Z2358583681,Cc(cc1)cc2c1oc(N(CCC1)CC1C(O)=O)n2,0 C137-2183,CN(C1CCCCC1)S(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O,0 F1471-0100,COc(cc1)ccc1C(CC1c2cccs2)=NN1S(C)(=O)=O,0 F6015-0196,CC(c(cc1)ccc1N(CC1)CCN1C(CCCn1cccc1)=O)=O,2 Z2991641277,CC(COC)=CCn1nnc(-c2ccco2)n1,0 Z1154256012,OC(CC(CCC1)N1C(c(cc1)cc2c1[nH]cc2)=O)=O,0 F6753-3256,COc(cc1cc2)ccc1nc2N(CCC1)CC1C(N1CCSCC1)=O,2 F0473-0211,COc1cccc(OC)c1C(Nc(cc1)cc(C(c2ccccc2)=O)c1Br)=O,2 Z1207560670,CN(C)CC(CCCC1)N1C(c1cccc2ncccc12)=O,0 F6510-1920,CN(c(ccc(F)c1)c1N1CCNC(c2cc(cccc3)c3[nH]2)=O)S1(=O)=O,2 F6261-1917,Cc1c(CNC(c2ncccn2)=O)sc(-c2c(C)cccc2)n1,2 S696-1360,Cc1cnc(-c2ccncc2)n1CC(C1)CN1C(c1c(C)nc(C)s1)=O,2 F6559-0159,CCn(cc1)c2c1C=CN(CCNC(c1c(C)oc(C)c1)=O)C2=O,2 SA58-0470,Cc1c(C(N2C(CCc3noc(C4CC4)n3)CCC2)=O)scc1,0 Z2718117336,CCOC(CCC(N[C@@H](C1)[C@@H](C(F)(F)F)Oc2c1cccc2)=O)=O,0 F6675-6176,CN(C(C1)CN1c1ncccc1)C(c(cc1)ccc1S(N1CCCC1)(=O)=O)=O,2 D216-0041,CC(c1nn(-c(cc2)ccc2OC(F)(F)F)nc1NC(CC1)c2c1cccc2)=O,2 Z1343224149,Cn1ncc2c1N=C(NCC(c(cccc1)c1F)O)NC2=O,0 V014-3415,CC(C)CNC(Cc(cc1)ccc1N(Cc1ccc(C)cc1)C(c1ccco1)=O)=O,2 Z511180490,CC1CN(CCNC(N(CCC2)CCN2C(c2cccc(F)c2)=O)=O)CCC1,2 F6204-0827,CN(C=CC=C1C(NC2(CCOCC2)c2cccs2)=O)C1=O,2 E948-1273,Cc1c(C(N(CC2)CCN2c2cccc(Cl)c2)=O)c2c(N3CCOCC3)nc(C)nc2o1,0 Z849706980,O=C(c(cccc1)c1N(CCC1)C1=O)NCC1(CCOCC1)c(cc1)ccc1Cl,0 Z3091717982,CCC(CC)(CNC(C1(C)CCN(C)CC1)=O)OC,0 S976-1051,O=C(C(CCC1)(CN1C(c(cc1)cc2c1[nH]cn2)=O)F)N1CCOCC1,2 SB16-0449,CCc(cc1)ccc1S(N(CC1)C[C@@H]2[C@H]1N(Cc1cnccc1)CCOC2)(=O)=O,0 F2738-1405,O=C(c(s1)ccc1Br)N(Cc1ncccc1)c1nc(ccc(F)c2)c2s1,0 S453-0163,O=C(CN(C(C1(CCOCC1)N1)=O)C1=O)NC(CC1)c2c1cccc2,2 Z367880602,CC(C1CC1)N(C)C(C(CCC1)CN1C(c1ccc(C)cc1)=O)=O,2 Z2783378104,O=C([C@@H](CCC1)NC1=O)NC(C1CCCCC1)c(cc1)ccc1F,2 Z2760975824,CC(CCC1)(CN1c1ncnc2c1ncn2CC1(CO)CCOCC1)C(OC)=O,2 SB04-0671,CN(C)C(N(CC1)CC1N(CCN(C)C(c1cnccc1)=O)C1CCOCC1)=O,0 Z1144868023,CC(c1c(CC2)cccc1)N2C(CCc1c(C)[nH]nc1C)=O,0 F6482-2176,CS(c1ccc(CCC(NC2CC3OCCOC3CC2)=O)cc1)(=O)=O,0 F2758-3068,CN(C)S(NCC(c1c2cccc1)=NN(CCN1CCCC1)C2=O)(=O)=O,0 SA52-1144,CC(C)CN(CCCN(C1)C(C2(CC2)c2ccccc2)=O)C1c1nc(C)no1,0 F825-0509,CC(c(cc1)ccc1N(CC1)CCN1S(c1ccc(-c2ccn[nH]2)o1)(=O)=O)=O,0 8017-8145,C(CC1)CC=C1C1c2ccc(cccn3)c3c2NCC1,2 Z2203458200,CCCC(CO)(CC1)CN1C(C1(CCCC1)c1cnccc1)=O,2 SB04-0055,Cc(c(F)ccc1)c1NC(NCCN(C(CC1)CN1S(C)(=O)=O)C1CCOCC1)=O,0 D724-0207,CC(C(C#N)=C1N2c(cccc3)c3N1CC(CN1CCN(CCO)CC1)O)=CC2=O,2 V031-0571,O=C(c1ccc(CN2CCN(Cc3ccccc3)CC2)cc1)NCc1ncccc1,2 Y043-6081,COc(cc1)cc(OC)c1-c1nc(NC(CCC(C(Nc2c3cccc2)=O)NC3=O)=O)n[nH]1,2 S729-0350,CC(C)N1CCC(CCNC(C(CCO)(CC2)CN2c2ncccn2)=O)CC1,2 Z1004066264,Cc1noc(NC(NCCn2nccc2)=O)c1,2 Z3294813020,CN(C)Cc(cc1)ccc1S(N=S1(CCOCC1)=O)(=O)=O,2 S248-0709,O=C(NC1CCCC1)N1CC(Cc2noc(C3CC3)n2)CC1,2 F6064-5452,COc1c(Cc2noc(C3CN(CC(Nc(cc4)cc(Cl)c4F)=O)C3)n2)cccc1,0 F6520-1178,COc(ccc(CC(NCCc1ccc(-c2cscc2)s1)=O)c1)c1OC,2 F6554-5665,Cc(cc(cc1)S(N(C2)CC2C(F)F)(=O)=O)c1OC,0 F6712-3637,Cc1cc(N2CC(CN(C3)C(c4cccnc4SC)=O)C3C2)ncn1,2 F6479-3178,O=C(CNC(OCc1ccccc1)=O)N(CC1)CCC1Oc(ccnc1)c1Cl,2 Z4014716217,CC(CCCCN1)(C(Nc(cc(C)cc2)c2OC)=O)C1=O,2 L418-0149,CCOC(CCNC(N(CC1)c(cc2)c1cc2-c(cc1)ccc1C(N1CCOCC1)=O)=O)=O,0 SB99-0589,Cc1noc(C)c1CC(N(CC1)Cc2c1n(C)nc2CCC(N1CCCC1)=O)=O,2 E852-3201,CC(Cn(c1c2)nc2C(NCCN2CCOCC2)=O)(C(NCc2ccc(C)cc2)=O)N(C)C1=O,2 S616-1298,CS(N(C1)[C@@H]2[C@H]1CCN(Cc(c(F)ccc1)c1Cl)C2)(=O)=O,0 Z2187563082,Cc1c(C(N[C@H](C2)C[C@@H]2c(cc2)ccc2Br)=O)oc(C)n1,2 SD61-0396,Cc1n[nH]c(C(N(C2)CC3(CCC3)C2C(NCc2ncccc2)=O)=O)c1,0 Z3008670657,CC(C)c(ccc(C(O)=O)c1)c1S(N(C[C@H]1F)C[C@@H]1F)(=O)=O,0 SB94-0224,O=C(CCC1CCCC1)N1CCC(CN(CC(C2)C(N3CCCC3)=O)C2=O)CC1,2 Z1684342947,CCCOc1cccc(-c2noc(C(C3)CN(CC(C)C)C3=O)n2)c1,0 SD61-0067,COCC(CC1)CCN1C(C(C1)C2(CCC2)CN1c1ncccn1)=O,2 S649-0863,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CCC1N(C1)C2(CCOCC2)C1OCC1CC1,2 F6259-0950,CN(C(C=C1)=O)N=C1N(CCC1)CC1C(NCCN(C(C=C1)=O)N=C1c1cccs1)=O,2 SC89-0365,O=C(c1cccs1)N(C1)CC1(C(CN1CCOCC1)CC1)S1(=O)=O,2 F5343-0200,COc1ccc(C2(CCOCC2)C(Nc(cc2)cc3c2OCO3)=O)cc1,2 Z1833218418,O=C(c1c[nH]nc1C1CC1)N(CCC1)CCN1C(c(cc1)ccc1F)=O,2 L388-0126,Cc1c(CN(C=Nc2c3oc4c2cccc4)C3=O)nc(-c(cc(cc2)Br)c2OC)o1,0 Z1267769474,FC(c1nc(-c2ccncc2)nc(N(CC2)CCN2c2nccnc2)c1)(F)F,2 Z4884575266,Cn1nc(C(F)(F)F)c(CC(NS(c2cc(C#N)cc(Br)c2)(=O)=O)=O)c1,0 F6389-0471,O=C(c1nccc(-n2cccc2)c1)Nc1cc([nH]nc2)c2cc1,2 F123-0037,Cc1c(CN(CC2)CCN2S(c(cc(cc2)OC)c2OC)(=O)=O)nc(-c(cc2)ccc2OC)o1,0 4339-0125,CCOc(cc1)ccc1NC(C(C(c1ccc(C(C)C)cc1)N1)=C(C)NC1=O)=O,0 Z2088898375,Brc1ccc2n1ncnc2NC(CC1)CCN1C1CC1,2 F6678-9943,Cn1ncc(S(N(C2)CC2n2c(cccc3)c3nc2C2CC2)(=O)=O)c1,2 Z2224706192,CCn(nc1)nc1C(NC(CC1CC1)c1cc(Br)cc(F)c1)=O,0 C155-0207,CC(C)CCNC(C(C(C)C)NC(C1CCC(C)CC1)=O)=O,0 F1749-0181,C(c1cccs1)NCc1nnc(-c2ccccc2)o1,2 F0585-2629,COCC(NC(Cc1ccccc1)c1nc(cccc2)c2n1Cc(cccc1)c1F)=O,2 SC02-0031,COCCC(CC1)(CN1C(c(ccc(Cl)c1)c1OC)=O)NC(c(cc1)ccc1F)=O,0 Z2075902240,N#Cc(cc1)cc(F)c1N(CC1)CCC1C(NC(CC1)C1C1CC1)=O,2 G824-0069,OC(CC(c1cc(cccc2)c2o1)=O)(c(cc(cc1)Cl)c1N1)C1=O,0 F6529-3522,O=C(Cn1c(cccc2)c2nc1)N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O,2 F2662-0018,O=C(C1CC1)NCC(c1cccs1)N(CC1)Cc2c1cccc2,2 Z1261567244,CC(C(NCCc1c[nH]c2c1cccc2C)=O)NC(c1cccs1)=O,0 F6368-0032,O=C(c1cc(-c2ccco2)n[nH]1)N1CCN(CCn2c(-c3ccccc3)ncc2)CC1,2 S543-0759,CS(N(C1CC1)C1CC(CC2)(CCN2C(NCc2ccccc2)=O)OCC1)(=O)=O,0 Z2654577567,CNS(C(CCC1)CN1c1nccc2nccnc12)(=O)=O,2 Z2145241708,CCN(C)C(c1cccc(S(N2CCC(C)(CN3CCN(C)CC3)CC2)(=O)=O)c1)=O,0 P040-2816,CCC(C)NC(CN(C(C=C1)=O)N=C1c1nc(-c2cnccc2)no1)=O,2 Z1324220542,Cc(s1)cc(Br)c1S(NC(COC)c1ccco1)(=O)=O,0 S606-0851,O=C1N([C@H]2CN(Cc3c[nH]nc3-c(cc3)ccc3F)CC2)c2ncccc2N1,0 F2380-0611,O=C(C(CCC1)N1S(c(cc1)ccc1Cl)(=O)=O)N(CCC1)c2c1cccc2,2 Z2444713948,NCCNC(C1CN(Cc(ccc(Cl)c2)c2-n2ncnc2)CCC1)=O,2 S570-0101,O=C(COc(cc1)ccc1F)NCC1(CCC(N2)=O)C2=CCCC1,0 Z3590282828,CC(CC1(CCC1)O)NC(C(NN1)=CC1=O)=O,2 8013-3521,NC(c1nn(-c2ccccc2)nc1NC(COc(cc1)c(C2CCCCC2)cc1Cl)=O)=O,2 F6481-0800,Cc1c(C(N(CC2)CCSC2c(cccc2)c2Cl)=O)snn1,2 Z414534706,CN(CC1)CC(c2ccccc2)N1S(c(c(Cl)ccc1)c1Cl)(=O)=O,0 Z1693167651,CN(Cc1nccs1)S(c1ccnn1C)(=O)=O,0 SC72-1722,O=S(N(C1)CC11OCc2c1cnc(-c1ccccc1)n2)(N1CCOCC1)=O,2 S978-0224,C[C@@H](COc1c(C2)cc(CN3CCOCC3)cc1)N2C(Cc1cccs1)=O,2 D072-0222,CC(C1)OC(C)CN1c(oc(-c(cc1)ccc1F)n1)c1S(c(cc1)ccc1F)(=O)=O,0 Z3687056964,N#Cc1ccc(CCC(N[C@@H](CC(Cn2cncc2)C2)[C@H]2O)=O)cc1,0 Z1987474692,CC(C)(C(NCCC(NO1)=NC1=O)=O)c(cccc1)c1Br,0 F6788-7907,CN(CC(C1)CN1c1ncnc2c1CCC2)S(C)(=O)=O,2 SA91-0126,CC(C)C(N(CC1)CCC1(c(cc(cc1)C(NCc2c[nH]nc2)=O)c1N1C)C1=O)=O,0 Z1944107998,CCCC(C(O)=O)NC(c(nccc1)c1Br)=O,0 Z1310276941,Cc(nccc1)c1NC(C(CC1)CCN1c1nccnc1)=O,2 D289-0325,CC(CCc1ccccc1)NC(CN(c(ccc(Br)c1)c1-c1c2cccc1)S2(=O)=O)=O,0 Z4339405089,CC(CC(N[C@@H](C[C@H]1CC2)[C@H]2N1C(c1c(cn[nH]2)c2ccc1)=O)=O)COC,2 Z1903685264,CN(CC1)CCC1n(cc1)nc1NC(c(cc1-c2ccccc2)nn1-c1ccccc1)=O,2 SA92-0854,Cc1cc(C)nn1CC(N(CCC1)CC1(c1nc(C2CC2)no1)F)=O,2 F0533-0640,O=C(c(cc1)cc2c1OCO2)Nc(cc1)ccc1S(N(CCCC1)C1c1cnccc1)(=O)=O,2 F6469-1740,O=C(CN(C(CC1)=O)C1=O)Nc(cccc1)c1-c1cn(cccc2)c2n1,2 S835-1641,COc1cccc(-c2n[nH]cc2CN(CC2)CCC2(C2)OCCC2O)c1,0 F6252-5069,OC(Cn1nnc(C(Nc(cc2)cc(C(F)(F)F)c2Cl)=O)c1)c(cccc1)c1F,0 F550-2810,O=C(CCN(C(C=C1)=O)N=C1C(N(CC1)c2c1cccc2)=O)Nc(ccc(Br)c1)c1F,0 F5772-8534,O=C(Nc1cc(-c2nc(cccc3)c3o2)ccc1)Nc1c(C(F)(F)F)cccc1,2 K979-1093,CN(C1CCCCC1)C(C(c1c2cccc1)=NN(c1cc(OC)cc(OC)c1)C2=O)=O,2 F6178-4371,COc(cccc1)c1OCC(NCC(CC1)CCN1c1ncccc1C#N)=O,2 G707-1512,CC(C(N(C1)CC1OCc(cccc1)c1Cl)=O)Oc1ccccc1,2 F6709-4385,FC(c1nccc(OC(C2)CN2c(nccc2)c2Cl)c1)(F)F,0 F6556-7818,CC(Cc1cc(cccc2)c2o1)NC(Nc(cc1)cc2c1OCO2)=O,0 Z1365677475,CC(c(c(F)ccc1)c1Cl)NCC(c(ccc(O)c1C)c1O1)=CC1=O,0 F2773-0666,CC(CN(C(C=C1)=O)N=C1c1ccco1)C(Nc1ncccc1C)=O,2 Y040-5685,N1(C(c2c(C1)cccc2)=O)[C@H](C(Nc1cc2[nH]ccc2cc1)=O)CC(C)C,2 F2382-0730,O=C(c1cn(Cc2cc(F)ccc2)nc1OCc1cc(F)ccc1)Nc(ccc(F)c1)c1F,2 Z4773895538,CCn1nncc1C(N(C1)CC(C)(C)C1NC(C1(C2)CC2C1)=O)=O,2 F6442-2302,CC(Nc1ccc(CC(N(C2)CC2S(Cc2ccco2)(=O)=O)=O)cc1)=O,2 Z2777618394,OC(c(cc(cc1)NC(c2c(C3CCCC3)ncs2)=O)c1O)=O,2 SA93-0857,Cc1noc(C)c1S(N(CC1)CCC1N(CCC1)CC1(CCOC)C(N)=O)(=O)=O,0 F6807-4790,Cc1cnc(CN(CC2)CC2(F)F)c(C)c1OC,0 F5656-0041,COc1c(ccnc2SCc3ncccc3)c2ccc1,2 J006-1142,Cc1nn(C)cc1CN(CCC1)C1c1c(C)onc1C,2 F6708-8514,Clc(cncc1)c1N1CC(C2)(CC2c2ccccc2)C1,2 SB29-0149,Cc1nc([C@H](C[C@@H](C2)OC)N2C(CCc2c[nH]c3c2cccc3)=O)n[nH]1,2 Z902948256,CC(NCC(CCC1)CN1C(NCC(CCC1)c2c1cccc2)=O)=O,2 SA16-0846,Cc1c(COC)c(C(N(CC2)CCC2c2nnc(CC(N3CCCC3)=O)o2)=O)no1,2 F2348-0321,Cc(cc1)nc2c1oc(C(NCCSc1c[nH]c3c1cccc3)=O)c2,2 Z963637210,CCS(N(CC1)CCN1C(c1csnn1)=O)(=O)=O,0 F6529-0488,CN(c(cccc1)c1N1C2CCN(CC(Nc3cnccc3)=O)CC2)S1(=O)=O,2 F807-1564,Cc(cc1)c(C)cc1S(c(cc1)nnc1N1CCN(Cc2ccccc2)CC1)(=O)=O,2 L299-6169,CCCc(c(-c(cc1)cc(S(Nc2c(C)cc(C)cc2)(=O)=O)c1OC)c1NC(CC2)=O)nn1C2=O,0 Z2951553781,COc1cnc(NC(NC[C@@H](C2)[C@H]2C(F)(F)F)=O)s1,0 Z1971781486,Cc1nc(CNC(C2(CCC2)C(O)=O)=O)no1,0 F6529-6805,COCCN(C(CN1C2CCN(Cc3ncccc3)CC2)=O)C1=O,2 F6519-7860,O=C(CSCc1ccccc1)NCC(c1cscc1)n1nccc1,2 G121-0253,COc(cc1)cc(CNC(c2ccc(N(C3)c(cccn4)c4Oc4c3cccc4)s2)=O)c1OC,2 CM4579-6193,O=C(c1ncccc1)N(C1)[C@H](COc2cnccc2)CC1(F)F,2 Z3138955748,CCC(C=C1C(N(C2)CC3(CCC3)C2N)=O)=CNC1=O,2 SD54-0128,O=C(C(CC1)CCc2c1c(OCC1CC1)nc(-c1ccccc1)n2)NCC1CCOCC1,2 Z1445508656,CC(CSC)C(N(CC1)CCC1(C(O)=O)O)=O,0 SA73-0736,COCc1nc(C(CC2CC2)(CC2)CCN2S(Cc(cc2)ccc2Cl)(=O)=O)no1,0 F5855-0738,O=C(C(C1)C1c(cc1)ccc1F)N(CC1)CCN1C(c1c(C(F)(F)F)cccc1)=O,0 5991-0721,COc1cccc(C(C2)CC(Nc(cccc3)c3NC3c4ccc(C(F)(F)F)cc4)=C3C2=O)c1,0 D470-1808,CC(C)CN[C@@H](CS(C1)(=O)=O)[C@H]1S(c1ccc(C)cc1)(=O)=O,0 Z1994077870,CCC1N(Cc2ccccc2)CCN(Cc2nn(C)nn2)C1,2 Z316415802,CN(C=CC(C(N(CC1)CCN1c(cccc1)c1OC)=O)=C1)C1=O,0 8016-5774,CCN(C(CC1)CS1(=O)=O)S(c1ccc(C)cc1)(=O)=O,0 F0556-0444,CCOC(COc1cccc2c1CCN(Cc(cc1)ccc1Cl)C2=O)=O,0 F6476-3338,CS(N(CC1)CC1Oc1nccc(C(F)(F)F)c1)(=O)=O,0 Z5034326178,Cc1c(CSC(N2c3cnccc3)=Nc(cccc3)c3C2=O)oc(-c2ccccc2)n1,0 Z3832105153,CN(C)[C@H](CC1)CN1c1c(cnn2Cc3cccc(Cl)c3)c2ncn1,2 F6490-0866,Cc(cc1)nnc1OC(CCC1)CN1C(Cn1cccc1)=O,2 C887-0456,CCC(n1c2cc3c1cco3)=NN(CC(NC1C(C)C(C)CCC1)=O)C2=O,0 F5912-0223,O=C(CCCN(C=NC(c1ccccc1)=C1)C1=O)NCC(F)(F)F,0 Z422380548,O=C(Cc(cc1)ccc1-n1nccc1)NCC1CCCC1,2 Y031-7053,CN(c1c(C(N2C)=O)n(CCC(NCC3OCCC3)=O)cn1)C2=O,2 F5596-0369,CC(C)c1nnc(C(CC2)CCN2C(c2c[nH]c3c2cccc3)=O)o1,2 F5033-5856,Cc1cc(C(NCC(CC2)CCN2C(c2cccnc2SC)=O)=O)c(C)o1,2 Z1078659258,CS(N(CC1)CC1C(O)=O)(=O)=O,0 Y041-6075,CC(C)CN1N=C(CC(NCC2C(CCCC3)N3CCC2)=O)c(cccc2)c2C1=O,0 Z1449226829,O=C(C1CCC1)Nc(cc1)nn1-c(cccc1)c1Cl,2 F3394-0724,COc1cc(CCN(C2)C(CSc3nnc4n3cccc4)=O)c2cc1OC,2 Z1872182309,CC1(CCC1)C(NCc1nc(CO)cs1)=O,2 F6724-1159,Cc1c(C(CNc(nc2)ncc2Cl)O)scc1,0 Z3135128365,Cn1nc(C(CC2)CCN2C(C(C[C@H]2C3)C[C@@H]2[C@@H]3N)=O)cc1,2 Z1425763013,CC(C)N(CC1)CCC1NC(Cn1nnc(-c2ccccc2)c1)=O,0 Z3610159644,CCc(ccc(F)c1)c1C(NCC1OCC2(CC2)C1)=O,2 V016-5920,O=C(C1=Cc(cc(cc2)Cl)c2OC1)NCc(cc1)ccc1-c1ncc(-c(cc2)ccc2F)[nH]1,0 F6481-1388,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1)CCSC1c(cccc1)c1F,2 SC66-0039,Cn1c(C(CN(C2)C(c(cc(cc3)Cl)c3F)=O)C22CCOCC2)nnc1,0 Y300-1214,CC(COc(cc1)ccc1OC)NC(C(CC1)CCN1S(N(C)C)(=O)=O)=O,2 Z1506052835,CC1N(Cc2ccccc2)CC(CCNC(c2ccc(CNC(C)=O)cc2)=O)C1,2 F1272-0013,Cc(cc1)ccc1N(Cc1ccco1)S(c(cc1)ccc1F)(=O)=O,2 Z4439098290,CCN(C)CC(NC1(CC2)COC2(CNc2ncnc3c2c(C)n[nH]3)CC1)=O,0 Z2474642406,O=C(Nc(cc1)ccc1S(c(cc1)ccc1F)(=O)=O)N(CCC1)CC1(F)F,0 F6445-6941,O=S(Cc1cc(F)ccc1)(NCc(cccc1)c1-c1cscc1)=O,2 Z31116304,CC(Nc(cc1)ccc1Sc(ccc(C(F)(F)F)c1)c1[N+]([O-])=O)=O,0 F6436-0625,Cc(onc1)c1C(NCC(CC1)CCN1C(c1cc(cccc2)c2o1)=O)=O,2 D240-0001,CN(c(ccc(S(N(Cc1ccco1)C(c1ccncc1)=O)(=O)=O)c1)c1N1C)C1=O,2 F2407-0103,O=C(Cn1c(cccc2)c2c(S(c2ccccc2)(=O)=O)c1)NCc1cccs1,2 L110-0718,O=C(c(cccc1)c1N1Cc2nc(-c3cccs3)no2)N(CC2OCCC2)C1=O,2 Z1335064862,OC(CC(CC1)CCN1C(C1CC=CCC1)=O)=O,0 Z1247239967,OCC(CC1)CN1c1cc(C(F)(F)F)nc(-c2cnccc2)n1,0 Y041-5252,CC(c(c(O1)c2)cc(Cl)c2OCC(N(CC2)CC(CCCC3)C23O)=O)=C(C)C1=O,2 F6464-1167,Cc1c(C(N(CCCC2)CC2c(cc2)ccc2OC)=O)scn1,0 J100-0188,s1c(nnc1C1CC1)NC(C[C@@H]1NC(c2c(NC1=O)cccc2)=O)=O,2 SB32-0117,Cc1n[nH]c([C@@H](C2)[C@@H](COC)CN2S(c2cccc3cccnc23)(=O)=O)n1,2 T159-1063,CC(C)n1c(CC(CCC2)CN2S(c2cccc3nsnc23)(=O)=O)ncc1C,2 F5857-5315,Cc1cc(C(NCC(CC2)(c3c2cccc3)O)=O)no1,2 Z749516194,CC(C)(C)n1ncc(C(N(CC2)CCN2c2nc(C)cs2)=O)c1C(F)(F)F,0 F6679-2694,O=C(c1cc(-n2nccc2)ccc1)N(CC1)CC1Oc(ccnc1)c1Br,2 Z2959791227,CC1=C(C(NC(CN2CCCC2)CO)=O)c(cccc2)c2NC1=O,2 Z2701078702,Cn1nc(C(F)(F)F)c(-c2noc(C(CCN3)(C4CCCC4)C3=O)n2)c1,2 F5854-2910,Cn1c(CN(Cc2cccs2)C(c2cscc2)=O)ccc1,2 Z3475680234,O=C(CCC1)Nc(cc2)c1cc2S(NC(C1)CC1(Cl)Cl)(=O)=O,2 Z3077967086,OCC1(CN(CC2)c3ccnc(-c4nccs4)n3)N2CCOC1,2 F6442-2578,CN(C)S(N(C1)CC1S(Cc1ccco1)(=O)=O)(=O)=O,0 Z1444068002,C=CCN(CC(F)(F)F)C(c1ccc(C(O)=O)s1)=O,0 Z2278928974,CCC(C)N1CCN(CC(Nc(cccc2)c2Oc2ccccc2)=O)CC1,0 Z27644210,CC(C)NC(Cc(cc1)ccc1S(N1CCCCC1)(=O)=O)=O,0 Z1401625444,O=C(CCCC(N1)=Nc(cccc2)c2C1=O)N(CC1)CC11COCC1,2 F6471-7249,Cc1cc(C(NCCCc2conc2)=O)cc(C)c1,0 T502-1863,Cc(cc1)ncc1C(N(CC1)CCC1(C(NCCOC)=O)F)=O,0 Z2762661363,CO[C@@H](C[C@H]1CN)CN1c1cc(N2CCOCCC2)ncn1,2 G118-1023,COc(cc1)cc(NC(N(Cc(cccc2)c2-n2c3ccc2)C3c2cccs2)=O)c1OC,0 G125-0206,O=C(c1ccc(-n(cc2)c3c2cccc3)s1)NCCCN(CC1)CCN1C1CCCCC1,2 Z1864102918,CC(CCN(CC1)c2nccn3c2nnc3)S1=O,2 G514-0157,Cc(cc(cc1)F)c1S(Nc1cc(N(CCC2)S(c(cc3)ccc3F)(=O)=O)c2cc1)(=O)=O,0 F6502-1109,O=C(C1c(cccc2)c2Oc2c1cccc2)NCCn1c(-c2nccnc2)ncc1,2 F6489-2223,CN(C)c(cc1)nnc1OC(CC1)CN1S(c1cccc2cccnc12)(=O)=O,2 F6564-3046,O=C(CN1N=C(C2CC2)C=CC1=O)N(CC1)CCN1c1cccc(C(F)(F)F)c1,0 F5264-0502,CCOc(cc1)ccc1C(NCCN(CC1)CCN1c(cc1)ccc1Cl)=O,0 F6261-2496,CCc(cccc1)c1NC(NCc1c(C)nc(-c(cccc2)c2F)s1)=O,0 SC60-1034,CC(C)(CN(C(C1)C(N2CCOC)=O)C2=O)CN1C(CCc(cc1)ccc1OC)=O,0 Z300587332,CNC(CNC(c1cccc(S(N(CCN2)CC2=O)(=O)=O)c1)=O)=O,0 Z2755552901,OC(c1cccc(C(N(CC2OCCC2)Cc2cccs2)=O)n1)=O,0 Z2735467475,OC([C@@H](C1)[C@H]1C(NS(c(c(F)c(cc1)F)c1Cl)(=O)=O)=O)=O,0 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Z3501685599,OC[C@@H](C[C@@H]1C2)[C@@H]2C[C@@H]1NC(Nc1nc(-c2cnccc2)cs1)=O,2 F6102-0062,CC(NCC(Cc1cccc(F)c1)N(CCCC1)C1=O)=O,0 F6554-0864,Cn1nc(C(CCC2)CN2C(c2cc(-c(cc3)ccc3F)c[nH]2)=O)cc1,2 Z2231655999,Cc1ccc(CC(N(CCCN2)C(Cc3ccccc3)C2=O)=O)o1,2 S985-0289,CC(C)C(N(C[C@@H]1CN(Cc(cc2)ccc2OC(C)C)C2)C[C@]12C(N1CCCC1)=O)=O,0 SB33-0211,Cc1n[nH]c([C@@H](CN(C2)C(Cc3cscc3)=O)[C@H]2NC(c2ccccc2)=O)n1,2 Y043-4722,O=C(c1n[nH]c2c1CCCCC2)Nc(cc1)cc2c1OCCCO2,2 S836-3782,CNC([C@@H](C1)[C@@H](COC)CN1C(c1nc2ccccc2cc1)=O)=O,0 S988-1062,CCS(N(C[C@@H]1CN(C2)C(c3c[nH]cn3)=O)C[C@@]12c1nc(C)no1)(=O)=O,2 SC02-0308,Cc1ccc(CN(CC2)CC2(CCOC)NS(c2ccccc2)(=O)=O)o1,2 Z1344928855,CC(C1)OC(C)(C)CN1C(Cn1nncc1)=O,2 S726-1572,O=C(C1(CC1)c1ccccc1)N(CC1)CCC11OCCC(CCOc2cnccc2)C1,0 3683-0550,CCC(C)(C1)OCCC1(CC(O)=O)c(cc1)ccc1OC,0 F6749-1061,N#Cc1cc(OCC(CC2)CCN2C(CCN2CC(F)(F)F)C2=O)ncc1,2 F6031-1255,OC(CN1CCN(CC(NCC2OCCC2)=O)CC1)C1CC1,2 Z1531957847,CC(C1)Oc(cc2)c1cc2S(NCC(O)=O)(=O)=O,0 Z2372458770,COCC(C1CC1)NS(c(cc1)cc(Cl)c1C(O)=O)(=O)=O,0 Z1627797125,O=C(NCCC1OCCCC1)N1CCOCC1,2 Z2099905569,CC(C)(CCC1)CC1C(N(C[C@H]1CO)C[C@H]1c1cscc1)=O,2 F6658-4743,CC(C)Oc(cc1)ncc1C(N(CC1)CCN1C(NC(N1C)=O)=CC1=O)=O,2 F6356-1109,CC(Cc(cc1)cc2c1OCC2)NC(CCc(cc1)ccc1S(C)(=O)=O)=O,2 F6497-1660,Cc(cccc1)c1NC(N1CC(Cc2nc(-c3nccnc3)no2)CCC1)=O,2 F0019-0846,CCc(c(O)c1)cc2c1OC=C(c1ccc(C(OCC)=O)o1)C2=O,2 F6414-3760,CC(CNC(c1cn(C)nn1)=O)(c1cc(cccc2)c2s1)O,2 Z3061505198,CCCN(CC1CC1)C([C@@H](C1)[C@@H](c2nccn2C)N(CCOC)C1=O)=O,0 S698-2567,Cc1cnc(C2OCCC2)n1C(CC1)CCN1S(C)(=O)=O,0 SD25-0592,O=C(CCC(CN(C1)C(NC2CCCC2)=O)C11CCCCC1)N1CCOCC1,2 S694-1869,Cc1cnc(C2CCC2)n1C(CC1)CN1C(c1ccco1)=O,2 F6279-0503,O=C(COc1ccccc1)N1CCC(CNS(Cc2ccc(C(F)(F)F)cc2)(=O)=O)CC1,2 F6171-0124,COc(ccc(Cl)c1)c1NS(CCOc1ccccc1)(=O)=O,0 Z2642100200,CCCC(C)c1n[nH]c(NC(C2(CN(Cc3ccccc3)CC2)O)=O)c1,2 L928-0160,O=C(C(CC1)CCN1c1ncnc2c1oc1c2cccc1)N(CC1)CCN1c1ccccc1,0 Z1051821886,O=C(CN(CC1)CC1N1CCCC1)Nc(cc1)cc(Cl)c1F,2 F3408-0013,O=C(CN1CCN(CCN(C(c2c3c4cccc3ccc2)=O)C4=O)CC1)NC1CCCC1,2 Z2295233073,CCc1ccc(C2OCCN(CC3CCNCC3)C2)cc1,2 Z2760935211,CCN(Cc(cc1)cc2c1OCO2)c1ncnc2c1ncn2CC(CO)O,0 SB24-0482,Cc1c(C(N(CC2)CCC2(CC2)C2n2nnc(C(N3CCOCC3)=O)c2)=O)scc1,2 F3394-0356,Cc1nc(CSC(N2CC=C)=Nc(sc3c4CCC3)c4C2=O)cs1,2 F5679-0045,O=C(Cc1csc(-n2cccc2)n1)NCc(cc1)cc2c1OCO2,2 Z3780631162,O=C([C@@H](C[C@@H]1C2)[C@@H]2CC1(F)F)NS(c1n[nH]cc1)(=O)=O,2 M030-0118,O=S(c(cc1)cc-2c1OCc1c2onc1)(N1CCN(Cc2ccccc2)CC1)=O,2 D322-0041,O=C(C1CCCCC1)N1c2ncnn2C2(CCCCC2)[C@H]2[C@@H]1CCCC2,2 E140-0248,CCc(cc1)ccc1NC(CSC(N1)=NC(CCN(C2)C(C)c3ccccc3)=C2C1=O)=O,0 Z4905531736,FC(c1cccc2c1nc(N(CC1)CCN1c1nccs1)s2)(F)F,2 Z1720999474,CN(C(CC1)C(NCC2(CCOCC2)c2cccc(Cl)c2)=O)C1=O,0 F6680-3084,COc1nccc(N(CCN(C2)C(c(o3)ccc3Br)=O)C2=O)c1,2 F6357-0127,O=C(CSCc1ccccc1)NCC1(CCOCC1)c1cscc1,2 E591-0958,O=C(CCc1nnc(cc2)n1nc2N1CCOCC1)NCCc1c[nH]c2c1cccc2,2 F6411-3454,COc1c(CN(N=C(c(cccc2)c2F)c2c3ccc(Cl)c2)S3(=O)=O)cccc1,0 F6246-2849,CN1N=C(C(CC2)CCN2S(c2c(C(F)(F)F)cccc2)(=O)=O)N(C2CC2)C1=O,0 Z1973716227,CC(CCCC1)N1S(N[C@H](C1)[C@@H]1c(cc1)ccc1Cl)(=O)=O,2 Z3368214751,Cn1ncc(-c2noc(C(C3CC3)O)n2)c1Cl,0 Z3272937462,Cc1nn2c(N3CCN(CC(NC4=O)=Nc5c4scc5)CC3)cncc2n1,2 S696-1521,CC(C)CNC(N1CC(Cn2c(-c3ccncc3)ncc2C)C1)=O,0 Z2294359880,CC(c(cc(cc1)NC(NC(CC2)CN2c(cccc2)c2F)=O)c1F)=O,0 5408-2092,FC(c1c(CCC2)c2nc2cc(-c(cc3)ccc3Cl)nn12)(F)F,2 F6435-1542,CS(C(CC1)CCN1C(c1cc(C(F)(F)F)ccc1)=O)(=O)=O,0 Y030-7158,CC(C)Cc1nnc(NC(C2CCCCC2)=O)s1,0 Z2960654644,CCCOc1nc2ccccc2cc1C(N(C1)CC1N(CC1)C[C@@H]1O)=O,2 V027-4052,CCc1nc(C(C)C)nc(N(CC2)CCN2C(C2CC2)=O)c1Cc(c(F)ccc1)c1Cl,0 Z1325672590,CCc1cnc(CN(C)C(c2c[nH]nn2)=O)s1,0 Z2351373972,Cn(cc12)nc2ncnc1NCc(cc(C1CC1)cc1)c1F,2 SC04-0592,CC(C)Cc1nc(CCOC(CCC2)CN2S(Cc2cc(F)ccc2)(=O)=O)no1,0 8014-9449,CCCCN(C(C(C(F)(F)F)(NC(CCC1CCCCC1)=O)N1)=O)C1=O,0 7139-5684,Cc1nnc2sc(-c3cc(NC(c4ccc(-c(cc5)ccc5Br)o4)=O)c(C)cc3)nn12,2 J098-0024,CS(N(CC1)c(cccc2)c2OC1C(Nc(cccc1)c1C(NCC1OCCC1)=O)=O)(=O)=O,2 F5461-0040,Cc1csc(CN(CC2)CCN2C(c(ccc(F)c2)c2F)=O)n1,0 Z2050277846,CN(CCC1)CC1c1cccc(C(N)=O)c1,0 5184-0067,OC(CC(C1=Cc(cccc2)c2OC1=O)=O)(c(cc(cc1)Cl)c1N1)C1=O,2 F6451-3586,COC(CNC(C(Nc1c(C(F)(F)F)cccc1)=O)=O)c1ccco1,0 Z1918179471,Cc1c(C(O)=O)sc(S(Nc2cc([nH]cc3)c3cc2)(=O)=O)c1,2 S639-3721,CN(C)C[C@@H](CN(C1)c2ncccn2)[C@H]1NC(COc(cc1)ccc1Cl)=O,0 V012-3932,CC(C)CN(CCC(NC(C)c1ccccc1)=O)c1c(ccc(Cl)c2)c2nc(C2CC2)n1,0 L164-0453,CC(CC1)CCC1NC(C1(CC1)c(cc1)ccc1NS(c1cc(C)c(C)cc1)(=O)=O)=O,0 F6529-2468,O=C(Cc1cccc(C(F)(F)F)c1)N(CC1)CCC1N(CC(N1c2ccccc2)=O)C1=O,0 F6502-0583,O=C(c(c(F)ccc1)c1Cl)NCCn1c(-c2cnccc2)ncc1,0 S570-0161,COc(cc1)ncc1C(NCC1(CCC(N2)=O)C2=CCCC1)=O,0 Z993354878,CN(C)CCOc(ccc(CNC(c(ccc(Br)c1)c1F)=O)c1)c1OC,0 F1591-1574,CC(C)CN(CC(C)C)S(c(cc1)ccc1N)(=O)=O,0 F1605-0154,CCOC(C(CCC1)CN1c(c1ccccc1nc1)c1C(c1ccccc1)=O)=O,2 C880-1402,Cc1cc(Cn2c(C(N(CC(NCc3ncccc3)=O)N=C3)=O)c3c3c2cccc3)c(C)cc1,2 Z1864002077,C[C@@H](CNC(C(CCC1)CN1c1ncnc2c1ccs2)=O)Oc(cc1)ccc1Cl,2 Z2010816780,Cc1cn(-c(cc2)ccc2F)nc1C(N(C)C(CCN1c(cccc2)c2Cl)C1=O)=O,2 C785-1971,CCC(n1c2cc3c1ccs3)=NN(CC(N(CC1)CCC1C(N)=O)=O)C2=O,0 Z1942711282,CC(CC1)CC(C(N)=O)N1C(c1cc2nccnc2cc1F)=O,0 Z2094739580,Cc1c(C)sc2ncnc(N(CCC3)C3c3nc(C)no3)c12,0 G938-1084,CN(CC(N(Cc1ccco1)C1CCCC1)=O)S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O,0 F6783-0003,O=S(c1c(C(F)(F)F)cccc1)(N1CC(CN(C2)c3nccs3)C2C1)=O,2 F5787-1325,COc(ccc(C(F)(F)F)c1)c1NC(CSc1ncncc1)=O,0 F6439-5326,O=C(NCCn(cc1)nc1-c1cccs1)Nc(cccc1)c1Cl,2 Z1067559158,Cn1c(C(N(CCCC2)C2C(N2CCOCC2)=O)=O)ccc1,2 Y043-5154,Cc1c(C)sc(NC(CC(C(N2CCc3c[nH]c4c3cccc4)=O)NC2=O)=O)n1,0 Z1271634070,CC(C)C(c(cc1)cc(O2)c1N(Cc1noc(-c3ccco3)n1)C2=O)=O,0 Z1798213537,Cc(cc(c1ccc2)N(CCC3)C3C(NCc3ccco3)=O)nc1c2OC,0 SB99-0620,CCn1nc(C)c(CN(CC2)Cc3c2n(C)nc3CCC(N2CCCC2)=O)c1C,2 F6296-1150,Cn(c(CNC(c1nc(cccc2)c2s1)=O)c1)nc1-c1cccs1,2 F5981-0263,Cn(cc1C(NCC(NCc(cc2)ccc2OC(F)(F)F)=O)=O)nc1OC,2 P396-0042,CN(C)c1nccnc1OC(CC1)CN1C(CCCc1ccccc1)=O,2 Z2955436571,CC(C)Oc1c(CN(C[C@H]2COC3)C[C@@]23c2nnc(C)o2)cccc1,2 Z4078726418,CC(C)c(cc1)ccc1-c1noc(CCC(NCC(C(F)(F)F)F)=O)n1,0 Z445186652,Fc1cc(CCNCc2n[nH]cc2)ccc1,0 F6089-8644,CSc1c(CN2CCC(CNC(C3(CC3)c(cc3)ccc3F)=O)CC2)cccc1,2 F2784-0423,O=C(c1ccco1)Nc1cccc(N(CCCC2)C2=O)c1,2 Z1197839626,FC(CN(CC1)CCC1c1nc(C2CCOCC2)no1)(F)F,2 Z1756974760,Cn1nccc1[C@@H]1OCC[C@H]1CNC(C(C1CC1)C1CC1)=O,2 F1346-0079,CC(C)(C)C1=NN=C2SCC(c(cc3)ccc3F)=NN2C1=O,2 F6523-0093,O=C(NCc1ccco1)NC(CC1)CCN1c1cc(C(F)(F)F)ncn1,2 F3267-0055,CCOC(c1cnc(cc(C(F)(F)F)cc2)c2c1N(CC1)CCC1C(OC)=O)=O,0 D433-0240,Cc1cc(C)nc2nc(CN(C(C3CCCCC3)=O)c(cc3)ccc3Cl)nn12,2 Z3077988370,Cc1nc(N(C)Cc2csnc2OC)nc(C(F)(F)F)c1,0 Z1102712092,CC(CC1)CCN1c(cc1)ncc1C(Nc1cn(CCN2CCOCC2)nc1)=O,2 D614-0223,CC(Nc1nc(N(Cc2cccc(Cl)c2)C(c2cccs2)=O)nn11)=C(Cc2ccccc2)C1=O,2 Z2078511494,O=C(C1CC1)Nc1nccc(C(NCC(C(F)(F)F)N2CCOCC2)=O)c1,2 8008-3229,O=C(c1ccccc1)Nc(cc1)ccc1NC(c(cc1)cc(S(N2CCOCC2)(=O)=O)c1Br)=O,2 Z2349067391,Cn1ncc([C@H]2OCC[C@@H]2CNC(N(CCOC2)CC2C2CCC2)=O)c1,2 F6672-0642,O=C(c1cc(Br)cs1)N(C(CC1)C2)C1CC2n1ncc(Br)c1,0 8017-3426,CC(CC(C)C1)CN1C(C1=Cc2cc(Br)cc(OC)c2OC1=O)=O,2 Z2439544104,CC(c1ccccc1)n1ncc(NC(N(CC2)CCN2C(COC)=O)=O)c1,2 F3398-1631,CCc(cc1)ccc1N(C=C(c1nc(-c2cnccc2)no1)c1c2cccc1)C2=O,2 J007-0900,Cc1noc(C)c1C(CCC1)N1C(Nc1cc(OC)cc(OC)c1)=O,0 F5831-2073,CC(Cc1ccco1)NS(c(cc1C)cc(C)c1OC)(=O)=O,0 F5832-0098,O=C(NCC1(CCOCC1)c1cccs1)NCc(cc1)ccc1F,2 F6785-7974,CC(CC(C1)C2CN1c1nc(C#N)ccn1)N2c1nccc(C(F)(F)F)n1,2 F6359-0629,O=C(c1nc(cccc2)c2s1)N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1,2 C226-4067,COc(cc1)cc(CC2)c1-c1c2c(C(Nc(cc2)ccc2OC(F)(F)F)=O)no1,0 D473-1002,CC(CS(N1c(cc2)ccc2C(N(CC2)c3c2cccc3)=O)(=O)=O)C1=O,0 F6806-6840,O=C(C1OCCN(CCc(cc2)cc3c2OCC3)C1)N(CC1)CCC1(F)F,2 Z356225334,CC(C)NC(CNC(NCc1cn(Cc2ccccc2)nc1-c1ccccc1)=O)=O,0 Z2193968273,O=C(N(CC1)CC1c1nc(-c2ccnc3ccnn23)no1)OCc1ccccc1,2 Z2771961167,Cc1c(C(Nc2cn(Cc3cn(C)nc3)nc2)=O)c(C)nn1CC(F)F,2 Z2237006975,N#Cc(cc1)ncc1N1C2CCCC1CC2,2 8016-8844,CN(c(cccc1)c1C(OC(C1)=O)=C2C1c1c[nH]nc1-c1cc(O)ccc1)C2=O,2 Z45631370,O=S(c(cc1)ccc1Br)(Nc(cc1)ccc1F)=O,0 Z846968812,CN(C(C(C#N)=C(NCc1cc(Br)c2OCOc2c1)N1C)=O)C1=O,2 F3375-1366,Cc(cc1)ccc1-c1noc(/C=C/c(cc2)ccc2OC)n1,2 Z2379013891,Cc1cc(C(NC(C2CCC2)C(O)=O)=O)c(C)o1,2 Z909900332,CC(c(cccc1)c1NC(CN(CC1)CCC1NC(C1CCCCC1)=O)=O)=O,2 F396-0709,O=C(CSC(N(CC1OCCC1)C1=O)=Nc2c1sc1ncccc12)N1CCCCCC1,2 F6491-2573,Cc1noc(C)c1CC(N(CCC1)CC1Oc1nccnc1N(C)C)=O,2 Z2257169181,COc1cc(CN(CC2CCNCC2)C(C2)c3ccccc3)c2cc1,2 K788-9424,CC1N=C(c(cccc2)c2F)c(cc(cc2)Cl)c2N(Cc2c(C)oc(-c3cc(C)ccc3)n2)C1=O,0 S635-3720,CN1CC2(CCN(Cc(cc3)ccc3OC)CC2)C(COC)C1,0 Z1366547601,Cc1noc(CN(CCC2)C2C(c2ccccc2)C#N)c1,0 Z1526723414,CN(C(CC1)=O)c(cc2)c1cc2C(NC1CC1)=O,0 C884-0449,CCN1C(CNC(Cn2c(C(N(C)N=C3)=O)c3c3c2cccc3)=O)CCC1,2 Z1580223545,CC1(COCC1)NC(Nc1ncnc(COC)c1)=O,0 F6353-5785,CCN(CCN(C(NCC(c1cocc1)N1CCSCC1)=O)C1=O)C1=O,2 Z2441835391,NCC(CC1)(CCN1C(c1c(C(F)(F)F)n(-c(cccc2)c2F)nc1)=O)O,0 K781-1558,O=C(c(cc1)cc(NC(c(c(F)ccc2)c2F)=O)c1N(CC(C1)CN23)CC1C3=CC=CC2=O)Nc(cc1)cc(F)c1F,2 F6734-1309,O=C(C1OCCCC1)N(C1)CC(C2)C1CN2c(cc1)ncc1Br,2 S997-1215,COC[C@](CN(C1)S(C)(=O)=O)(CC2)[C@H]1CN2C(Cc1c[nH]c2c1cccc2)=O,2 Z1837850632,O=C(CCNCc1cn(-c2ccccc2)nc1-c(cc1)ccc1F)Nc1cnccc1,2 F1174-3160,COCCNc1nc(-c(cc2)ccc2F)nc2ccccc12,0 F6495-1867,O=C(c1ncnc(N2CCCC2)c1)Nc(cc1)cc(Cl)c1F,0 S248-3756,O=C(c1cccs1)N1CC(Cc2noc(C3CCOCC3)n2)CC1,2 Z2589837068,Cc1c(-c2ccc(CNC(CC3)CN(C)C3=O)cc2)scn1,2 F3406-0694,O=C(CSc1nccn1-c1cc(C(NCc2ccco2)=O)ccc1)Nc(cc(cc1)F)c1F,2 F6443-5584,O=C(C1c(cccc2)c2Oc2c1cccc2)NCc1cc(Oc2ncccc2)ccc1,2 G953-0384,Cc1cc(C)nn1C(N1CC(Nc2cccc(Cl)c2)=O)=NC(CCC2)=C2C1=O,2 F819-0354,CC(CC1)CCN1S(c(cc1)ccc1-c1noc(Cc(cc2)cc(OC)c2OC)n1)(=O)=O,0 F6475-3222,O=C(c(cc1)cnc1OC1CCOCC1)Nc(ccc(Br)c1)c1F,0 8018-2585,COc(cc(C(C1CCCC2)N(Cc(cc3)ccc3Cl)CCC12O)cc1)c1O,0 F5791-0773,O=C(c1ccc(Cn2cncc2)cc1)NCc(c(F)ccc1)c1F,2 F0850-2847,Cc(c1ccccc11)nnc1SCC(Nc(ccc(Cl)c1)c1Cl)=O,0 F6619-6844,Cc1nc(-n2nccc2)cc(N(CC2)CCN2C(CCCC2)C2O)n1,2 E899-0300,CCN1CCN(Cc(cc2)ccc2Nc2c(c(-c(cc3)ccc3F)no3)c3ncn2)CC1,2 S823-7669,OC[C@@H](CN(C1)C(c2ccco2)=O)[C@H]1NC(c1ccccc1)=O,2 Z1239158236,COc(cc1)nnc1C(N(CC1)CCN1C(c1cccc(F)c1)=O)=O,0 Z1904321286,O=C(C(CCC1)N1c1ccccc1)N(CCN1)CC1=O,2 S984-1327,CCOCC(N(C[C@H]1CN(C2)C(C(C)C)=O)C[C@@]12C(N1CCCC1)=O)=O,0 S956-0148,COCC(CN(CC1)c(cc2)cc(C(F)(F)F)c2C#N)N1S(c(cc1)ccc1F)(=O)=O,0 E958-0656,COc1cccc(CNCc2cccn2-c2nnc(N3CCN(Cc4ccccc4)CC3)s2)c1,2 C519-1970,CCN(C=C1C(NCC2Oc(cccc3)c3OC2)=O)c(ccc(S(N2CC(C)CC(C)C2)(=O)=O)c2)c2C1=O,0 F6473-0186,NC(C(CC1)CCN1C(C1)CN1C(c1cccc(Oc(cc2)ccc2F)c1)=O)=O,0 Z2733095325,CCc1c(-c2c(C)cccc2)nc(N)s1,0 Z1890822082,CN(CCC1c2nc(Cn3c(cccc4)c4nc3)no2)C1=O,2 Z1495765670,CC(C(C)(C)C)N(C)c1cc(F)ncn1,0 F6452-0609,CCC(CNC(COc1c(C)cccc1)=O)(c1ccccc1)OC,0 F3237-0882,Cc(c(S(Nc1cnccc1)(=O)=O)c1)cc(Br)c1OC,0 Y204-1647,CC(CCc1c2ccc(F)c1)N2S(c(cc1)ccc1F)(=O)=O,0 S655-0875,CC(C)C(N(CC(C1)(CC2)CCN2C(C(C)C)=O)C1c1nnc(C)o1)=O,0 Z1889696651,CN(CCC1(CC2)CCN2C(C(CCC2)N2C(c(cc2)ccc2Br)=O)=O)C1=O,2 F6215-0010,Cc1noc(CCNC(CCC(c2ccccc2)=O)=O)c1,2 F6795-1281,Cc1c(C(C=C2)=NN(CC(CC3)CCN3c3ncnc4c3CCCC4)C2=O)sc(C)n1,2 Z4966623254,NC(c1cccc(-c2cn(-c3cccc(C(O)=O)c3)nn2)c1)=O,0 SA58-0968,O=C(c1ncncc1)N1C(CCc2noc(-c3ncccc3)n2)CCC1,2 F6573-5383,O=C(COc(ccc(Cl)c1)c1Cl)NCc1cnc(C2CC2)cc1,2 S322-0021,CC(Cn1c(ccc(F)c2)c2c2c1CCN(C)C2)O,2 F6808-5983,N#CC(CC1)(CCN1c1cnc(C(F)(F)F)cc1)c1ccccc1,0 F0649-0726,CCOc(cccc1)c1C(N(CN(CCC1)C1=O)c1cc(Cl)c(C)cc1)=O,0 Z2216899327,CC(C)c(cccc1)c1NC(c1csc(-c2cnccc2)n1)=O,0 Z2482792381,OC(c1cccc(Cl)c1CN1Cc2ncnn2CC1)=O,0 Z2991043668,CCc(cccc1)c1-c1cc([C@H]2OCC[C@@H]2C(O)=O)cnc1,0 F6807-6367,C(C(CC1)CCN1c(cc1)nn2c1ncc2)c1ccccc1,2 M459-1667,O=C(CSc1nc(N(CC2)CCN2c2ccccc2)ccn1)N(CC1)CCN1c(cccc1)c1F,2 F6548-0756,COC(c(cc1)cc(CN2c(cc3)ccc3F)c1OCC2=O)=O,0 C699-1813,CCN1c(cc(cc2)C(NCCC3=CCCCC3)=O)c2SCC1,2 F6672-0357,Cc1cn(C(CC2CC3)CC3N2C(c2cscn2)=O)nc1,2 F6730-4716,Cc1c(C)ncnc1C(Nc(cc1)cc(C(F)(F)F)c1F)=O,0 Z1275065382,CN(Cc1ccccc1)C(CC1)CN1C(c(cc1)cc(CC(c2ccccc2)O2)c1C2=O)=O,2 Z1680189959,OC(CC1)(CCC1NC(Cc1cccc(OC(F)F)c1)=O)c1ccccc1,0 V004-8175,CCNC(N(CC(C)C)Cc1csc(COc2cc(C)c(C)cc2)n1)=O,2 F3165-0110,Cc(cc1)cc(Cl)c1NC(CN(C1C(N2c(cc3)ccc3Br)=O)N=NC1C2=O)=O,0 F6793-7628,Cn1c(ncnc2N3CCN(CC(F)(F)F)CC3)c2nc1,0 Z1455030410,CCc(cc1)ccc1C(N(CC1)CCN1C(c1cnncc1)=O)=O,2 S937-0829,CN(C)S(N(C1)CC1n1c(C2OCCC2)nnc1)(=O)=O,0 Z4313712537,C[C@](C[C@H]1C2)([C@H]2C[C@H]1NS(c1cn(C)nn1)(=O)=O)OC,2 Z1491216259,O=S(C1CC1)(NC1CCNCC1)=O,0 S069-3978,O=C(NC1CCCC1)N(CC1)CC1c1noc(C2CC2)n1,2 Z1953418555,CC(C(N1c2c[nH]nc2CCC1)=O)N(C)CC(F)(F)F,2 Z4029406519,O=C(C(CN1)c(cccc2)c2C1=O)N(CCC1)[C@@H]2[C@H]1NCC2,2 F5834-4741,O=C(Cc(cc1)ccc1NS(c1cccc2cccnc12)(=O)=O)NC1CC1,2 F3202-0592,Cc(cc(c(S(N1CCCC1)(=O)=O)c1)OC)c1Br,0 Z146917626,CC(C)(C)C(NCC(N(CCCCC1)C1c(cc1)ccc1OC)=O)=O,0 Z3061932976,Cc1c(C(F)(F)F)ccc(CN(C)Cc2nnc3n2CCOCC3)c1,0 K284-4509,O=C(CSC(N1CC(CC2)CCC2C(NCc(cccc2)c2Cl)=O)=Nc(cccc2)c2C1=O)c1ccccc1,2 F6445-3752,O=C(NCCCc1cn2ncnc2nc1)NC(c1ccccc1)c1ccccc1,2 L596-0028,CCC(C)NS(c(cc1)cc(C(N2CC(N3CCCC3)=O)=O)c1N(C)C2=O)(=O)=O,0 Z2353760911,OC(c1ccc(CNC2CC(Cc3ccccc3)CC2)cc1)=O,2 F6523-0036,Cc1noc(C)c1C(NC(CC1)CCN1c1cc(C(F)(F)F)ncn1)=O,2 F6556-4993,Cc1csc(C(N(CCC2)CCN2C2CCSCC2)=O)c1,2 Z3404526354,COC(C(C1)(C2)C1CN2C(Nc1cc(Cn2cncc2)ccc1)=O)=O,2 F6559-1121,O=C(c1cocc1)N(CC1)CC1n1c(cccc2)c2nc1,2 F6480-2919,Cc1nc(OC(CCC2)CN2C(Cc2noc3c2cccc3)=O)nc(C)c1,2 F6549-2134,COC(c(cc1)ccc1C(N(C(CC1)C2)C1CC2n1nccc1)=O)=O,0 F6411-2563,Cc1noc(C)c1CN(C=Cn(c1c2)nc2-c2cccs2)C1=O,2 Z1615557570,O=S(c1ccccc1)(Nc1cnc(CCC2)c2c1)=O,2 S902-1652,CN(C)C(N(CCCC1)C1c1nnc(C2)n1CCN2C(CCc1c[nH]c2c1cccc2)=O)=O,2 Z4519653675,Cn1ncc(-c2ccc(C(Nc3c[nH]nc3-c(cccc3)c3F)=O)o2)c1,0 Z2066121098,COc(ccnc1CS(CC2CCOCC2)=O)c1OC,2 F6670-4552,O=C1N(CC(CC2)CCN2S(CCc2ccccc2)(=O)=O)C=Nc2c1cccc2,2 F6420-0949,COC1(CNC(NC2CCCC2)=O)CSCC1,2 SB14-0962,O=C(C1CC1)N(C1CN(Cc2c(C(F)(F)F)cccc2)CC1)C1CCOCC1,2 F6395-3909,O=C(Nc1ccccc1)N1CC(Cc2ccccc2)OCC1,2 M459-5189,O=C(CSc1nc(N2CCC(Cc3ccccc3)CC2)ccn1)NCc(cc1)ccc1F,2 CM3593-1562,COCc1cn(CC(CCC2)CN2C2CCOCC2)nn1,2 K786-7514,CC(CCC1)C(C)C1NC(CN(C(C=C1)=O)N=C1c1ccc(C)cc1)=O,0 Z1131355067,CC(C(NCC1)=O)N1C(c1c(C2CC2)oc(-c2ccccc2)n1)=O,2 Z2086037431,O=C([C@@H](CCC1)NC1=O)NCCn(cc1)c(cc2)c1cc2Cl,2 S988-0680,Cc1noc(C)c1CC(N(C[C@H]1CN(C2)C(C3CC3)=O)C[C@]12c1nc(C)no1)=O,2 F6666-7700,COc1cccc(NC(Nc(cc2)ncc2F)=O)c1,0 F6512-0563,O=C(c(cc1)cc2c1ncs2)Nc1cc2ccnn2cc1,2 CM4410-2907,CC(C)Cc(c(CN(C1)C2(CCCCC2)CN(CCOC)C1=O)c1)nn1-c1ccccc1,2 SC02-0060,COCCC(CC1)(CN1C(c1cc2cccnc2cc1)=O)NC(c(cc1)ccc1F)=O,2 Z1698983662,Cc1cc(C(NC(C2)CN(Cc3c(C(F)(F)F)cccc3)C2=O)=O)c(C)n1C,2 F6492-0261,Cc1cccnc1NC(C(CC1)Cc2c1[nH]cn2)=O,2 SB58-0703,CN(C)CC1C(C2)(CN2C(c(ccnc2)c2F)=O)CN(Cc2ccccc2)C1,2 T500-1995,CCn1nccc1C(N(CC1)CCC1C(N(CC1)CCC11OCCCC1)=O)=O,2 Z979394722,O=C(c(cc1)cn2c1nnc2)Nc1cccc(OC(F)F)c1,0 Z3614637061,CC(CC1)(CN1C(c(cccc1N=CN2)c1C2=O)=O)c(cc1)ccc1Cl,2 C614-0990,CC(CNC(CCc1c(C)n2nc3nc(C)cc(C)c3c2nc1C)=O)c1ccccc1,2 Z4768599381,O=C(COC1CCC1)N(C1CC1)C(CCC1)c2c1cccc2,2 Z2296069648,O=C(CCc1ccccc1)N(CC1)CC1NC(c1c(C2CC2)ncnc1)=O,2 F6471-2247,O=C(Cc1noc2c1cccc2)N(C(CC1)C2)C1c1c2ncnc1,2 Z2414327112,C[C@H](COCC1)N1C([C@@H](C1CCC2CC1)[C@H]2C(F)(F)F)=O,0 F5017-0812,CCC(Nc(cc1)cc(C)c1S(NCC1CCN(Cc2ccco2)CC1)(=O)=O)=O,0 F6442-4512,Cc(n(-c1ccccc1)nc1)c1C(Nc1c(C)nc2oc(-c3ccccc3)nc2c1)=O,2 Z3687176835,Cn1nc(C(NC2CC(Cc3ccccc3)CC2)=O)c(N=CN2)c1C2=O,2 F6360-9578,CN(C)S(N(C1)CC1Oc1cnccc1)(=O)=O,0 F6782-7561,COc(ccc(N(C=CN(CC1CCCC1)C1=O)C1=O)c1)c1Cl,2 SA52-0603,CCC(N(CCCN(C1)S(C)(=O)=O)C1c1nc(C)no1)=O,0 Z7946497858,CC(C)C(C)(CN)NC(C(CCC1)c2c1cccc2)=O,0 V026-4380,CC(C)c(c1c2sc(C(NCCCNC(C3CCC3)=O)=O)c1)nn2-c1ccccc1,2 Z2969758147,Cc1c([C@H]2OCC[C@@H]2NC(NCCn2c(C)ncc2)=O)c(C)nn1C,2 Z1212036236,O=C(Cc1c[nH]c(cc2)c1cc2F)N1CC(c2nnn[nH]2)OCC1,2 F6608-0640,CN(C)C(COC1)C1Oc(c(F)c1)ncc1Cl,0 SB59-0468,CC(C)C(N(C1)CC(C2)(CN2S(Cc2ccc(C)cc2)(=O)=O)C1c1nncn1C)=O,2 Z1564017299,C[C@@H](CNc1cc(Br)cnc1)O,0 F6476-0694,Cc1cccc(OC(CC2)CN2C(c(cc2)ccc2Cl)=O)n1,0 Z1488589849,CC(C(Nc1cc(CCC(O)=O)ccc1)=O)n1ncnc1,0 Z1269153896,Brc(cc1)cc2c1snc2,0 SC04-0846,COCc1nc(CCOC(CCC2)CN2S(c(cccc2)c2Cl)(=O)=O)no1,0 F2268-0038,COCCN(CCC1)c2c1ccc(NC(c(cc(cc1)Cl)c1OC)=O)c2,0 T500-1889,O=C(COc(cc1)ccc1F)N(CC1)CCC1C(N(CC1)CCC11OCCCC1)=O,2 Z5025871893,OC(C[C@H](COCc1ccccc1)NC(c1cc(scc2)c2[nH]1)=O)=O,2 Z1888345369,O=C(c(cco1)c1Br)NCc1nc(cccc2)c2[nH]1,0 Z240752468,Cc1c(CCC(N2C(Cc3ccccc3)CCC2)=O)c(C)nc2nc(N)nn12,2 SB24-0010,CNC(c1cn(C(CC2)C2(CC2)CCN2S(c(cc2)cc(OC)c2OC)(=O)=O)nn1)=O,0 F6495-4120,O=C(C(C1)CN1c1ncnc(-c2ccccc2)c1)NCc1csc(-c2ccccc2)n1,2 SB56-0944,C([C@@H]([C@H](C1)c2cnccc2)c2nc(-c3nccnc3)no2)N1C1CCCCCC1,2 F6521-7557,Cn(cc1)c2c1cc(C(CNS(c(cc1)ccc1OC(F)(F)F)(=O)=O)O)cc2,0 F0737-0250,C=CCN(CC=C)S(c(cc1)ccc1C(Nc(cccc1)c1-c1nc(cccc2)c2[nH]1)=O)(=O)=O,0 Z1975423983,O=C(N[C@H](C1)[C@@H]1c1cc2ccccc2cc1)NC1CCOCCC1,2 8017-2972,CC(C(CC(c1c(C)ccc(C)c1)c1cc(Br)c2)Nc1c2C(O)=O)c1ccccc1,2 Z1488240881,O=C(CNC(c(cc1)cc(Cl)c1Cl)=O)N1C2(CCC2)COCC1,2 Z2755418022,OC(c1cncc(C(N2CC(Cc3ccccc3)OCC2)=O)c1)=O,2 SB59-0116,Cn1c(C(C2)C(C3)(CN3C(Cc3cscc3)=O)CN2S(C)(=O)=O)nnc1,2 Z4119960903,CCC(N(CCC1)C[C@H]1Nc1nc(C(C)(C)C)ncc1)=O,2 F6513-4696,CCOC(N(CC1)CCN1c1nc2ccccc2nc1NS(c1cn(C)nc1)(=O)=O)=O,2 F0687-0304,COc(cccc1)c1N(CC1)CCN1C(CNC(c(cc1)ccc1F)=O)c1cnccc1,2 F1641-0188,O=C1Sc(cccc2)c2N1CCc1ccccc1,2 T634-0032,Cn1cnc(S(N2Cc(cc(CN3CCOCC3)cc3)c3OCC2)(=O)=O)c1,2 F6722-1745,N#Cc1nccnc1N(CC1)CCN1c1cccc(C(F)(F)F)c1,0 SC04-0694,O=C(c1cnncc1)N(CCC1)CC1OCCc1noc(C2CC2)n1,2 M758-2113,COc1ccc(C2(CCCCC2)C(N(C2)CC2N(CC2CC2)Cc2ccncc2)=O)cc1,2 G550-0540,O=C(C(Nc1c2ccc(C(F)(F)F)c1)NS2(=O)=O)Nc(cc1)ccc1Cl,0 F6518-2541,CC(c1ccc(CCNC(NC2CCCCC2)=O)s1)=O,0 F6658-4745,CN(C(C=C(N1)N(CC2)CCN2C(c2cccc(SC)c2)=O)=O)C1=O,0 SC72-0101,Cc1nc(COC2(C3)CN3C(c3ncncc3)=O)c2cn1,2 Z2689790725,OC(C1)(CN1C(Cc(c(Cl)ccc1)c1Cl)=O)C(O)=O,0 F6497-1128,Cc(cccc1)c1-c1noc(CC(CCC2)CN2C(c2cc(-n3nccc3)ccc2)=O)n1,2 S952-0342,N#Cc(cc1)c(C(F)(F)F)cc1N(CC1)CCC1(CN(C1)C(C2CCC2)=O)C1C(NC1CC1)=O,2 Z1803862935,Cc1cc(S(NC(Cc(cc2)ccc2Cl)=O)(=O)=O)cc(C)c1F,0 Z951982548,Cc(cc1)cc2c1[nH]c(C(CCC1)N1C(c(cc1)cc(N=C3N4CCCCC3)c1C4=O)=O)n2,2 Z1919027193,CC(Cc1c(C2)cccc1)N2C(N(CC1)CCS1(=O)=O)=O,0 SC12-0452,O=C(Nc(cc1)cc2c1OCCO2)N(CCCN1CCOCC1)C1CCOCC1,2 S682-0402,CN(CC(N1CCCCCC1)=O)C([C@H]1OCCN(C2CC2)[C@@H]1c1ccccc1)=O,2 Z2155693156,CC(C(N1)=O)(c(cc2)ccc2-c2noc(-c(cc3)cc4c3C=CCC4)n2)NC1=O,2 F5479-0166,Cc(cc1)cc(NC(NCCCN2N=CC=CC2=O)=O)c1OC,0 Z2378787066,COc1ccc(CC(NCC2(C3CC(C4)CC2CC4C3)N)=O)cc1,0 S898-0315,CC(C)CNC([C@H](C1)NC(CC2)(CCN2C(Cc2c(C)onc2C)=O)c2c1[nH]cn2)=O,2 G804-0562,Cc(ccc(Cl)c1)c1NC(c1ncccc11)N(Cc2ccco2)C1=O,0 F6178-7113,CC(C)(C(NCC(CC1)CCN1C1CCOCC1)=O)Oc(cc1)ccc1Cl,0 Z2014714478,O=C(c(cc1)cc(CC(c2ccccc2)O2)c1C2=O)N1CC(c(cccc2)c2Cl)NCC1,2 F6549-4974,Cn1ncc(C(CCC2)CN2C(Cc2cnccc2)=O)c1,2 S987-1044,CC(C)C(N(C1)C[C@@](CO)(C2)[C@H]1CN2C(c(cc(cc1)Cl)c1OC)=O)=O,0 F6573-5055,O=S(c(cccc1)c1F)(NCc1cncc(C2CC2)c1)=O,0 F6439-4925,O=C(NCCn1nc(C(F)(F)F)cc1)Nc1cccs1,2 Y040-1263,COc1cccc(NC(COc(cc(c(C2=C3CCC2)c2)OC3=O)c2Cl)=O)c1,2 F6064-8548,Cc1nc(CN(C2)CC2c2nc(-c3ccco3)no2)cs1,2 F6753-2787,O=C(C1CN(Cc(c(F)ccc2)c2Cl)CCC1)N1CCOCC1,0 F6359-0837,O=C(c1ccccc1)c(cccc1)c1C(N(CC1)CCC1Oc(nccc1)c1Cl)=O,0 F5937-0207,O=C(c1noc(-c2ccccc2)c1)NCCCn1cccc1,2 Y500-4797,CS(c(cc1)cc2c1nc(NC(c1nn3c(C(F)(F)F)cc(-c(cc4)ccc4F)nc3c1)=O)s2)(=O)=O,2 F2496-2673,Cn(cc1C(OCc2noc(-c3cc(OC)ccc3)c2)=O)nc1OC,2 SA46-2015,CN(C(C1)=O)c(cc2)c1cc2S(N(C1)CC1(C1)OCC1N1CCCCC1)(=O)=O,2 F6507-6197,Cn1c(C(CCNC(Nc(cc2)cc(Cl)c2Cl)=O)O)ccc1,2 F6550-6085,O=C(C1(CCOCC1)c1ccccc1)N(C1)CC1Nc1nnccc1,2 F5027-0678,CSc(cccc1)c1C(N1CC(c2ccc(C(F)(F)F)cc2)OCC1)=O,0 F6619-7329,Cc1cc(CN(CC2)CCN2c(cc2)nnc2N(C)C)no1,2 F5834-3758,CCCS(N(CC1)Cc2c1ccc(NC(c1c(C)oc(C)c1)=O)c2)(=O)=O,0 Y501-3490,CC(CNC(Cn1nc(C(F)(F)F)c2c1CCC2)=O)Cn1nc(C)cc1C,2 Z2150969870,CC(C)(CN(C1)C(Nc2cncc3ccccc23)=O)Oc2c1cccc2,0 Z838124492,CC(c(cc1)ccc1OCC(F)(F)F)NC(N(C)C(N(C)C1=O)=O)=C1C#N,0 S582-0021,Cc1nn(C)c(C(NCC(Cn2c3ccc2)N(C)C3=O)=O)c1,0 G539-0111,CCc1c(C)sc(C2c3ccccc3)c1CCN2C(Nc(cccc1)c1OCC)=O,0 F6808-8410,OCC(CCC1)CN1c1nc(-c2ccccc2)cs1,2 Z845330358,NC(CN(CCC1)CCN1C(c1cc(cccc2)c2n1Cc1ccccc1)=O)=O,0 G637-1070,Cc1noc(/C=C/c(cccc2)c2F)c1S(N(CC1)CCC1C(N(C1)c(cccc2)c2NC1=O)=O)(=O)=O,0 F6773-4188,C(CC1)Cc2c1ncnc2N(CC1)CCC1Oc1nc2ccnn2cc1,2 Z2906916950,O=C(C1=CN=C(C2CC2)NC1=O)NOC1CCOCC1,2 Z2929363401,CCc1noc(C(CC2)CC2NC(N(C(C)C2)C3C2CCCC3)=O)n1,2 E612-1133,CS(CCC(C(NCCCN(CCC1)C1=O)=O)N(Cc1c2cccc1)C2=O)(=O)=O,2 F6572-0911,FC(c1ncnc(N(CC2)Cc3c2cccc3)c1)(F)F,0 D112-0183,O=S(c(cc1)ccc1OC(F)(F)F)(N(CCC1)CC1c1ccccc1)=O,2 F3237-0012,CC(C)(C)c(cc1)cc(S(n2cncc2)(=O)=O)c1OC,0 Z2790184219,CC(C1)C(C)N1S(c1cc(C(O)=O)cc(Br)c1)(=O)=O,0 Z4438425277,CN(C(C(C1)NC(Nc2ncncc2)=O)=O)c2c1cccc2,2 F6469-1694,O=C(c(cc1)cc2c1ncs2)Nc(cccc1)c1-c1cn(cccc2)c2n1,2 F6557-0232,O=C(c1nc2ccccc2nc1)N(CCC1c2cccs2)CCS1(=O)=O,2 SA58-1296,Cn1cnc(S(N2C(CCc3noc(-c4ccccc4)n3)CCC2)(=O)=O)c1,2 S689-0502,Cc1ccc(CNC(N(C2)CC2N(CC(C2)C(N3CCCC3)=O)C2=O)=O)cc1,0 Z1505913569,CC(C)(C1)[C@H]1C(NCc1nc(C)c(C)s1)=O,2 F6125-2956,CC(CCCC1)N1C(C(C1)CN1S(C1CC1)(=O)=O)=O,0 Z2952160817,Cc(c(CN1CCC(CO)(CO)CC1)ccc1)c1OC,0 Z2085849061,Cc(c1c2)nsc1ncc2C(N(CCC1)CC1NC(CCCc1ccccc1)=O)=O,2 SC10-0083,Cc1nc(C(N(CC2)CC2N(CCCN2CCOCC2)S(C)(=O)=O)=O)co1,2 Z1175674657,O=C(c1cc(OCc2ccccc2)ncc1)N(CCC1)CC1N(CCC1)C1=O,2 F2348-0264,Cc(cc1)nc2c1oc(C(Nc(cccc1)c1SC)=O)c2,0 V002-0237,COc1cccc(C(CN(CC2)CCN2S(c2cc(C(F)(F)F)ccc2)(=O)=O)OCc(cc2)ccc2C#N)c1,0 Z1739417008,Cc1cc(CN(CC2)S(c(cc3C(N4)=O)cnc3N(C)C4=O)(=O)=O)c2c(C)c1,2 Z2950911299,CN(CCN(C)CC1)CCN1C(Nc1cn(Cc2ccccc2)nn1)=O,2 Z3042242397,Cc1c([C@H]([C@@H](CNC(c(cc2)c(cco3)c3c2F)=O)C2)N(C)C2=O)cnn1C,2 F6515-4323,O=C(c(s1)ccc1Cl)NCc1cncc(-c2cccs2)c1,2 F3284-8477,Cc(cccc1)c1NC(c1ccc(CSc2ncccn2)cc1)=O,0 F6204-2752,O=C(CCc(cccc1)c1F)NC1(CCCC1)c1cccs1,0 Z1991856165,CC(C)(C(O)=O)n1ncc(NC(C(CCC2)CN2C(N2CCCC2)=O)=O)c1,2 SA49-0146,COc1cc(CC(N(C2)CC22OCC(CC(NCC3CC3)=O)C2)=O)cc(OC)c1,0 F6610-2872,COc(cc(CCN(C1)c(cc2)nn3c2ncc3)c1c1)c1OC,2 F2979-0172,O=C(CSCc1ccccc1)Nc(cc(cc1)Cl)c1Cl,0 S729-0212,COc1c(CNC(C(CCO)(CC2)CN2c2ncccn2)=O)cccc1,0 F6473-9146,CC(N1C)=CC(OC(CC2)CN2C(CCc(cc2)ccc2OCc2ccccc2)=O)=CC1=O,2 G325-0959,CC(CC(Nc(cc1)cc2c1OCCO2)=O)S(c(cc1)cc(CC2)c1N2C(C1CC1)=O)(=O)=O,2 F5957-0229,Cc1cc(C)nn1CCNC(Nc(cccc1)c1OC)=O,0 Z228785240,Cn1ncc2c1ncnc2NCC(c1ccccc1)c1ccccc1,2 Z2721330711,Cc(n1C)ncc1S(Nc1c(C(O)=O)n(C)nc1)(=O)=O,2 S649-0396,C(C1CC1)OC(C1)C2(CCCCC2)N1C1CCN(Cc2ccncc2)CC1,2 F5450-0490,CCC(C(Nc1nc(CN(CC2)Cc3c2cccc3)cs1)=O)c1ccccc1,2 F6400-1431,CSc(cccc1)c1C(N1C(CN2CCOCC2)CSCCC1)=O,0 F6804-8537,FC(C(CC1)CCN1c1nccn2nccc12)(F)F,0 S614-0586,Cc1cccc(OCCc2noc(C(CCCC3)N3S(c3c(C)cccc3)(=O)=O)n2)c1,2 F6476-1515,Cc1cc(C)nc2nc(C(N(CC3)CC3Oc(nccc3)c3Br)=O)nn12,2 F6543-0617,FC(C1)(CN1c(nc1)ncc1Br)F,0 4676-0647,OC(c1cccc(NC(CC2Nc(cccc3)c3NC2=O)=O)c1)=O,0 Z3543062879,CCCC(C(O)=O)NC(C(C1)CC11CNCC1)=O,0 F6550-1548,O=C(c(cc1)ccc1-c(cc1)ccc1F)N(C(CC1)C2)C1CC2F,2 S579-0441,COCCN(C(CCCC1)C1=C1CC(Nc(ccc(F)c2)c2F)=O)C1=O,0 F6658-2366,Cc1nnc(cc2)n1nc2N(C1)CC1N(C)C(CCc(c(Cl)ccc1)c1Cl)=O,2 F6658-5912,Cc1c(C(N2CCC(COc3ncnc(C4CCC4)c3)CC2)=O)c(C)n[nH]1,2 C612-0610,COc1ccc(CN(C(c2ncccc22)Nc(cc(cc3)Cl)c3OC)C2=O)cc1,0 K284-2866,CCC(Cc1ccccc1)N1C(SCC(c2ccccc2)=O)=Nc(cccc2)c2C1=O,2 F5225-0149,CC(Nc(cc1)nnc1SCc1cccc(Cl)c1)=O,2 Z3211138644,CC(C(C)NC(N1Cc2cc(O)ccc2)=O)C1=O,0 Z1074967004,O=C(NCCc1c[nH]c2c1cccc2)Nc(cc1)cc(Cl)c1-n1nccc1,0 Z1181492962,CNC(C(CCC1)CN1C(C(Nc1cnccc1)=O)=O)=O,0 V026-2054,O=C(c1ccc(C(F)(F)F)cc1)N(Cc(n1CC2OCCC2)cnc1S(Cc(cccc1)c1F)(=O)=O)Cc1ccco1,0 F0344-1202,COc1ccc(Cc2cnc(NC(COc(cccc3)c3Cl)=O)s2)cc1,0 8012-9929,CC(CC1)N(C(c2nn3c(C(F)(F)Cl)cc(-c4ccco4)nc3c2)=O)c(cc2)c1cc2F,2 Z1177623830,O=C(C1CC1)NC(CC1)CCN1C(C(C1)=NNC1=O)=O,2 SA59-1672,Cc1noc(C)c1Cc1ccc(C(NCCN(C2CCOCC2)C(C2CC2)=O)=O)o1,2 F6559-1670,O=C(c1cc(cccc2)c2s1)N1CCN(CCF)CC1,0 Z2497291894,CC(C)CC(CC1)CN1C(C(c1c(N2)ncn1C)=CC2=O)=O,0 Z4501152483,Cc(c(NC(c1cc(occ2)c2s1)=O)cnc1)c1Cl,2 F6473-2073,O=C(C1(CC(C2)C3)CC3CC2C1)N(C1)CC1n1nncc1,2 SB75-0042,CC(C)CNC(N[C@H](C[C@H]1CN(C2)C(COC)=O)C[C@]12c1nc(C)no1)=O,0 Z813491244,O=C(c1cocc1)N(CCC1)CCN1C(NCC(F)(F)F)=O,2 F5882-5265,O=C(c1noc(-c2ccccc2)c1)N(CC1)CCN1S(C1CC1)(=O)=O,2 SA91-0109,CC(C)C(N(CC1)CCC1(c(cc(cc1)C(O)=O)c1N1C)C1=O)=O,0 F6064-0607,O=C(C1(CCOCC1)c1ccccc1)N(C1)CC1c1nc(-c2ncccn2)no1,2 F6363-0931,CCS(N(CC1)CCN1c1ncnc(Nc2ncccc2)c1)(=O)=O,0 Z2597310438,OC(c(ccc(CN(CC1)CC11CCCCC1)c1)c1F)=O,2 Z1129923761,CC(N1CCC(CNc2nccnc2)CC1)=O,0 F5016-1754,COCCNC(C(NCC(CC1)CCN1C(OC)=O)=O)=O,0 SC09-0090,C[C@@H]1N(Cc2cn(C)nc2C)Cc(cc(cc2)-c3cccc(F)c3)c2OC1,0 Z3512555253,C[C@@H]1OCCO[C@@H]1C(N[C@H](C1)[C@H](C2)[C@@]12C(O)=O)=O,2 F6734-1502,O=C(COc(cccc1)c1Cl)N(C1)CC(C2)C1CN2c(cc1)ncc1F,0 Z1374135009,CC(C(NCc1cc(O)ccc1)=O)c1cc2ccccc2cc1,2 F6442-0111,O=C(C1c(cccc2)c2Oc2c1cccc2)N(C1)CC1S(c(cc1)ccc1F)(=O)=O,2 Z2842914569,CC1N(CC(N2CCCCC2)=O)CCc2c1scc2,2 F6446-1463,O=S(CCc1ccccc1)(NCC(CCC1)CN1c1nccs1)=O,2 F1278-0491,Cc1cccc(NC(CC(C(O)=O)NCC2OCCC2)=O)c1C,2 F0537-0595,N#Cc(cccc1)c1NC(C1Oc(cccc2)c2OC1)=O,0 F5007-0117,Cc1nn(C(CC2)CS2(=O)=O)c(NC(CC(c2ccccc2)c2ccccc2)=O)c1,2 Z1185060538,C[C@H](CC1)CC[C@@H]1NC(CN1N=Cn2nccc2C1=O)=O,2 V012-3125,CC(C)C(N(CC1)CCN1c1c(c(CCC(C)C2)c2s2)c2nc(C(C)C)n1)=O,0 Z2222140775,O=S1(CC(Cc2nc(-c(cc(cc3)OC(F)F)c3F)no2)CCC1)=O,0 F6412-6613,CC(C)(C)CC(NCC#CCOc(cccc1)c1C(N)=O)=O,0 Z2335307357,Cc1nn(CC(NCC2(CCN(Cc3ccccc3)CC2)O)=O)cc1,2 Z2795228340,CCc1noc(C(C)N(CC2)CCN2C(C2CC2)C(O)=O)n1,2 F6246-0185,CCOC(c(cccc1)c1NC(CN(CC1)CCC1c1nnc(C(F)(F)F)o1)=O)=O,0 Z1893808816,CC(C)C(C1)c(cccc2)c2N1S(c1ccc(CCNC(C(C)(C)C)=O)s1)(=O)=O,0 F1143-1189,Cc1nc(NCc2ccco2)c(cc(-c2ccccc2)s2)c2n1,2 P048-2149,COc(ccc(CN(c1cc(F)cc(F)c1)S(c(cc1)cn2c1nnc2)(=O)=O)c1)c1F,0 F6676-4769,CN(C(CCC1)CN1C(c(cccc1OC)c1OC)=O)c1c(C(F)(F)F)cccn1,2 F6523-0858,Cc1nc(CCCC2)c2c(N(CC2)CCC2NS(c(s2)ccc2Cl)(=O)=O)n1,2 E959-1818,O=C(C=C1)NN=C1c(o1)ccc1S(N(CC1)CCN1c(cccc1)c1F)(=O)=O,0 Z3631016233,O=C(c1cc2nccnc2nc1)N(CC(C1)C2)C1C2(F)F,2 F690-0067,CCC(Nc1nc(ccc(NC(NCc2cc(OC)ccc2)=O)c2)c2s1)=O,2 F6675-8577,Cc1c(CCC(N(C)C(C2)CN2c2nccnc2C#N)=O)scc1,2 Z1259043249,Cc1nsc(NC2CCN(Cc3ccccc3)CC2)n1,2 F6619-6798,Cc1nc(-n2nccc2)cc(N(CC2)CCN2c2nc(C3CC3)ncc2)n1,2 F6761-7840,O=C(c1nn(-c2ccccc2)nc1)N(CC1)C(C2)C1CN2c(cc1)ncc1F,2 Z2448358268,O=C(C1CNCC1)Nc(cc1)ccc1-c1cnc(C2CC2)o1,2 Z2119735965,CC(c1nnc(C2CCCC2)n1CC1)N1C(NCc1nc(COc2ccccc2)n[nH]1)=O,2 Y502-9500,CCn1ncc(S(N(CC2)CCN2S(c2cn(C)nc2)(=O)=O)(=O)=O)c1C,0 F2616-0456,O=C(C(Nc(ccc(F)c1)c1F)=O)NCCCn1cncc1,0 8017-8982,CCCOc(cc1)ccc1N(C(CC1N2CCC(Cc(cc3)ccc3OCC)CC2)=O)C1=O,0 P711-0303,CC(CCC1)CN1C(c(nc1)cn1-c(cc1)ncc1S(N1CC(C)CCC1)(=O)=O)=O,2 F6760-5946,Cc(nc(cc1)C(N2CCN(C/C=C/c3ccccc3)CC2)=O)c1F,2 P930-5470,CCCS(N(CCC1)[C@@H]1c1nnc(-c(cc2)ccc2F)[nH]1)(=O)=O,2 Z2234681969,CCNC(N(CC1)c2c1ccc(NS(c1cccc(Cl)c1O)(=O)=O)c2)=O,0 Z1739077271,OC([C@H](CCC1)N1S(c(cc1)cc2c1OCO2)(=O)=O)=O,0 SB42-0150,C[C@@H](C(N(C)C[C@@H]1CN2CC(NCc3ccc(C)cc3)=O)=O)N1C2=O,0 Z1021077466,NS(c(c1cccnc11)ccc1N1CCCC1)(=O)=O,0 Z2482916928,CN(Cc1cccc(C(F)(F)F)c1)Cc1ncccc1C(O)=O,0 Z966422062,CC(C)(C)CC(N(CCC1)C1C(N(C)Cc1cn(C)nc1)=O)=O,0 Z3378539445,CN(CCn(c1c2)nc2NC(CCc(cc2)ccc2O)=O)C1=O,2 C300-0335,CCN(C(CCS(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O)=O)c1cc(C)c(C)cc1,0 V027-6862,COc1cccc(Oc2cc(N(CC3)CCN3S(c3ccccc3)(=O)=O)ncn2)c1,0 F6480-0385,N#Cc1cc(OC(CCC2)CN2C(COc2cccc(C(F)(F)F)c2)=O)ncc1,2 SB24-0374,CN(C)C(c1cn(C(CC2)C2(CC2)CCN2C(c2c[nH]nc2-c2ccccc2)=O)nn1)=O,0 C884-0624,CC(C(N(CC1)CCN1C(c1ccco1)=O)=O)n1c(C(N(C)N=C2)=O)c2c2c1cccc2,2 Z2475720450,CC(N1C)=NN(Cc2nnc(-c3ccc(C)cc3)o2)C1=O,0 Z4131488611,CC(c1cc(O)ccc1)NC(c(cc1)cnc1S(C)(=O)=O)=O,0 F6156-0589,O=C(c1cccc(Br)c1)N1CC(COc(cc2)ccc2F)C1,0 F6368-0389,Cc1nc(CN2CCN(CCn3c(-c4ccccc4)ncc3)CC2)cs1,2 Z3047993262,Cn(c(O)c1)nc1C(N(CCC1)[C@@H]1C(F)(F)F)=O,0 F6514-4788,O=C1N(Cc2cn(C(C3)CN3S(CCCOc3ccccc3)(=O)=O)nn2)CCC1,2 Y044-1181,O=C(CN(C(C=C1)=O)N=C1c1ccco1)N(C(CC1)CS1(=O)=O)c1ccccc1,2 Z242300760,Cn1ncc(C(N(CCC2)C2c(cc2)ccc2F)=O)c1,0 S543-0594,CC(C)C(N(CC1)CCC1(C1)OCCC1N(C1CC1)C(NC(C)C)=O)=O,0 Z365460908,CN(CC(N1)=Nc(cccc2)c2C1=O)C(C(C1)CN(CC(F)(F)F)C1=O)=O,0 V015-2077,N#Cc(cc1)ccc1C(Nc(cc1)ccc1-c1nc(-c(cc2)cc3c2OCCO3)ccc1)=O,0 SB68-0744,COCCNC(c1c(C[C@@H](C2)NC(c(ccc(OC)c3)c3OC)=O)n2nc1)=O,0 S713-3186,Cc1noc(C)c1S(N(CC1)CCC1c1nc(-c2cccn2C)no1)(=O)=O,2 F5241-0077,COc1cc(NC(N(CC2)CCN2c2nc(OC)nc(OC)c2)=O)cc(OC)c1OC,0 E786-2150,O=C(c1c2nccc1)N(Cc(ccc(F)c1)c1S(N(CC1)Cc3c1cccc3)(=O)=O)C2=O,2 Y200-2469,CCC(C)(C)NC(c1csc2c1CCCC2)=O,0 F6357-1976,CC(C)(CNC(NCCc(cc1)ccc1OC)=O)c1cscc1,0 Z278697740,CC(C(NC1CCN(Cc(cc2)ccc2Cl)CC1)=O)NC(C(C)(C)C)=O,0 F6687-6913,Cc1cccc(OCC(CCC2)CN2C(CCC(F)(F)F)=O)n1,0 Z1409782917,O=C(C(CCC1)c2c1[nH]nc2)Nc1cn(Cc2ccncc2)nc1,2 G602-0007,O=S(c1ccccc1)(N(CC1)CCC1c1nc(-c2ccncc2)no1)=O,0 F6788-2639,CC(C)(C)c1cc(N(CC2)CCN2c2ncnc3c2cnn3C)nc(C2CC2)n1,0 Y044-3740,CN(C=Nc(cc1)c2cc1NC(CCC(C(Nc1c3cccc1)=O)NC3=O)=O)C2=O,2 Z4926124236,CC(C)Oc1nc(-c2c(C)c(C)ccc2)cnc1,0 F321-0906,O=C(C(CC1=O)CN1c1cccc(Cl)c1)Nc1cc(-c2noc(C3CCC3)n2)ccc1,2 Z1443686494,COc(cc(cc1)Br)c1C(NCCCC(O)=O)=O,0 F2148-0004,CC(C(c1cccs1)N1CCN(Cc2ccccc2)CC1)N,2 G122-1512,O=C(c1ccc(N(CCC2)c3c2cccc3)s1)N1CCC(Cc2ccccc2)CC1,2 F6541-1520,O=S(N1CCCC1)(N(CC1)Cc2c1cccc2)=O,0 F6475-2940,CC(C)NC(C(C)N(CC1)CCN1C(c1cc(OCCOC)ncc1)=O)=O,0 F6250-0475,Cc1cc(C(NC(CCC2)CC2OC(Nc(cc2)ccc2F)=O)=O)c(C)o1,2 F6571-6568,O=S(CCC(F)(F)F)(NCC1(CC1)c1cscc1)=O,0 S066-0293,O=C(c1ccncc1)N(CC1)CC1Oc1ncnc(N2CCOCC2)c1,2 F6559-2210,O=C(Cc(cc1)cc2c1OCO2)NCc1nnc(CC2)n1CC2C(F)(F)F,2 S571-0299,CN(C1=CCCC1(CNC(CCc1ccccc1)=O)CC1)C1=O,0 Z2437459216,COc(cc1)c(C(O)=O)c(OC)c1S(NC1CC=CCC1)(=O)=O,0 F6235-0177,O=C(Cn(cc1)c2c1cccc2)N(CC1)CCN1c(cc1)nnc1-n1cncc1,2 F6491-2640,CN(C)c1nccnc1OC(CCC1)CN1C(Cc1cscc1)=O,2 F6561-5801,Cn1ncc(-c2nccc(CNC(COc(cc3)ccc3F)=O)c2)c1,2 F5596-0098,O=C(C1CCCC1)N(CC1)CCC1c1nnc(-c2ccco2)o1,2 F0919-5325,CCC(C)(C(NC1CCCCC1)=O)NC(Cc1cccs1)=O,2 S858-2014,Cc1ccc(CN2C[C@](CO)(CN(C3)S(C)(=O)=O)[C@H]3CC2)o1,0 F6363-0155,COCCNC(COc(cc1)nnc1-n1nccc1)=O,0 P681-0090,COc(ccc(NC(N(CC1)CC1(c(cccc1)c1N1)C1=O)=O)c1)c1OC,0 F6616-7370,Cc(ccnc1)c1NC(c1cccnc1SC)=O,0 Z1348451323,CCn1c(ncnc2N(CC3)CCN3c(cc(cc3)F)c3F)c2nc1,0 Z1460888093,Cc(nc(cc1)N2CCOCC2)c1NC(Cc(cccc1)c1Cl)=O,0 V016-8248,O=C(C(C1)C(CN(Cc(cc2)ccc2F)CC2)N2c2c1cc(C(F)(F)F)cc2)NCCCN1CCOCC1,2 Z2017841743,COc1cc(OCCN(C2)C(NCC3(Cc(cc4)ccc4F)CC3)=O)c2cc1,2 F6563-0359,O=C(CN(C=NC(C1CC1)=C1)C1=O)N(CC1)CCC1Oc1cscc1,2 F6245-1614,CN(C(C=C1)=O)N=C1C(N(CCC1)CC1c1nnc(C(F)(F)F)o1)=O,2 F6804-8575,O=C(CN(CC1)CCC1C(F)(F)F)NCC1OCCC1,0 SA01-0879,CN(C)C(c1c(C(CC2)CN2C(CCc2ccccc2)=O)nc(N(C)C)nc1)=O,2 F6471-8324,Cn1c(S(C(C2)CN2C(c2cnc(C(F)(F)F)cc2)=O)(=O)=O)nnc1,2 K784-7166,COc1ccc(C(C(N(CCc2ccccc2)C2)=O)N(Cc(cccc3)c3Cl)C2=O)cc1,2 F1907-2362,C(c1ccccc1)N(Cc1ccccc1)C1C2C1CNC2,2 Z2971631408,CC(C)(C)c1nn(ccnc2NC[C@H](C(F)(F)F)O)c2c1,0 F2585-0317,CC(C(SCC(N(CCC1)c2c1cccc2)=O)=N1)=CNC1=O,2 F6245-0097,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CCC1c1nnc(C(F)(F)F)o1,2 Z757042764,CCC(C)C(NC1CCN(Cc(cc2)ccc2F)CC1)=O,0 L800-0824,CC(C)c1c(C(N(CC2)CCN2c(cc2)ccc2Cl)=O)sc(N(CCC2)C2=O)n1,2 V008-9417,CCC(C)c(cc1)ccc1N(C(c1cc(OCC)ccc1)=Nc1c2cccc1)C2=O,0 F6440-3938,Cn1nc(CNC(C2Oc(cccc3)c3OC2)=O)cc1C1CC1,2 F6436-2611,O=C(c1cc(cccc2)c2[nH]1)NCC(CC1)CCN1C(c1cc(cccc2)c2o1)=O,2 F0173-0126,Cc1nc(SCNC(c2ccccc2)=O)nc(C)c1,2 S759-0324,CCOCC(N(CC1)CCC1[C@H]([C@@H](C1)Oc2ccccc2)N1C(C)C)=O,0 SD56-0392,Cc(nc1)cnc1C(N(CCC1)CC(C(N2c3ccccc3)=O)N1C2=O)=O,2 Z819864894,CC(C)OCc(cc1)ccc1NC(NCc1c(-n2cncc2)nccc1)=O,0 F6713-5334,Cc1nc(CN(CC2)CCN2c2ncncc2C)cs1,0 SA95-0611,Cc1cnc(C(CCC2)N2C(NCCc2ccccc2)=O)n1Cc1cnccc1,2 F2490-0381,Cc(cc1)ccc1Nc1nc(N2CCOCC2)nc(N(CC2)CCN2c2ccccc2)n1,2 F6574-1791,O=C(Cn1nnc2c1cccc2)NCc1nccnc1-c1cccs1,2 Z2839735540,CCN(C1CN(Cc2ccccc2)CC1)C(c(cc1)cc(N=CN2)c1C2=O)=O,2 F6805-3160,Cc1nc(cccc2)c2n1C(C1)CN1c(c(F)c1)ncc1Br,0 D753-0235,O=C(C(CC1)CCN1C(C=C1)=NNC1=O)N[C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1,2 F2738-2126,COc(cc1)c2nc(N(Cc3ncccc3)C(c3ccco3)=O)sc2c1OC,0 F6286-0818,O=C(c(s1)ccc1Cl)NCCc1nc(C(F)(F)F)c(CCCC2)c2n1,2 F5277-0428,O=C(COc(cccc1)c1F)NCCCN(CC1)CCN1c1ccccc1,2 Z1391341753,CCOc(cc1)ccc1-c1nc(C)c(C(N(C)CC(C2CC2)O)=O)s1,0 S692-0605,Cc1cnc(C2CC2)n1C(CCC1)CN1C(CCOC)=O,0 Z3524181582,CC(C)(C1(C)C)C1(C(N(CC1)CCC11N(C)CNC1=O)=O)C(O)=O,2 K691-0133,CN(CC1)CCN1S(c1ccc(Cc(cc2)ccc2S(N2CCN(C)CC2)(=O)=O)cc1)(=O)=O,2 F1316-0142,Cc1nc2ccccc2nc1SCC(N1c(cccc2)c2Sc2c1cccc2)=O,2 F6799-8573,Cn1nc(CCC2)c2c1CN1Cc2nnc(C(F)(F)F)n2CC1,2 SA47-0704,CCCCC1(COC(C2)(CN2C(c2ccnn2CC)=O)C1)O,0 F5105-0126,O=S(c1cc(CCCC2)c2cc1)(NCCc1cscc1)=O,2 F6246-0568,O=C(CN(CC1)CCC1c1nnc(-c2cscc2)o1)NC1CC1,2 F2864-0052,CNC(C(C1)N(C(Nc2cccs2)=O)c2c1cccc2)=O,2 F0590-0239,O=C(CS(c1cn(Cc2cc(F)ccc2)c2c1cccc2)(=O)=O)Nc(cc1)cc2c1OCO2,2 D750-2430,Cn1c(cccc2)c2nc1CCNC(CC1(CN(Cc2c3cccc2)C3=O)CCCCC1)=O,2 SC46-0316,Cc1nn(C)cc1C(N(C1)CC2(CCCC2)C1c1nc(C2CC2)n[nH]1)=O,0 Z2034716675,CN(C(CC1NS(Cc(cc2)cc(Cl)c2F)(=O)=O)=O)C1=O,0 Z2492995852,CC[C@H](c(cccc1)c1F)N(C([C@H](C)N1)=O)C1=O,0 F6562-8498,O=S(c(cccc1)c1F)(NCC1c(cccc2)c2OC1)=O,0 Z1197785404,CCN(C(c(ccc(-c1nc(-c(cccc2)c2Cl)no1)c1)c1N1)=O)C1=O,0 F6719-4513,COc(ccc(CNc1cccc2cccnc12)c1)c1OC,0 F6435-3420,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1)CC1(C1)Oc(cccc2)c2C1=O,2 F6495-2502,CCOC(N(CC1)CCN1C(c1ncnc(N2CCOCC2)c1)=O)=O,2 F255-0458,Cn1c(cccc2)c2nc1CCc(cc1)ccc1NC(c1n[nH]c-2c1COc1c2cccc1)=O,2 Z1778961619,Clc1cc2ncc(NCCN3CCOCCC3)nc2cc1Cl,2 F6454-0815,Cc(c(C)c1)cc(C)c1S(NCC1CCN(CC(F)(F)F)CC1)(=O)=O,0 F6554-8168,O=C(c1ccccc1)c(cccc1)c1C(N1C(C2)CSC2C1)=O,2 SB92-0186,Cc(ccc(S(N(C1)CC1N(CCN1CCOCC1)S(C)(=O)=O)(=O)=O)c1)c1F,0 F6495-4179,O=C(C(C1)CN1c1ncnc(-c2ccccc2)c1)NCCn1ncnc1,2 Z2307070421,CC(CC1)CCN1C(CC1)CCC1NC(N(CCC1)C(C)C1O)=O,2 SA72-0794,COCCC(CC1)(CCN1C(C1(CC1)c1ccccc1)=O)c1noc(-c(cc2)ccc2F)n1,2 F6764-1378,C(CN(CC1)CCC1c1nc2ncccc2cc1)n1nccn1,2 F1216-0277,COc(cccc1)c1OCc1nc(cccc2)c2[nH]1,0 F5583-0014,CC(C)(C)c1csc(CN(CC2)CCN2S(c(cc2)cc3c2OCCO3)(=O)=O)n1,2 F2011-0701,Cc1c(CCNC(c(cccc2)c2Br)=O)sc(-c(cc2)cc(OC)c2OC)n1,0 F2199-0133,OC(c([nH]c(cc1)c2cc1Cl)c2-c1ccccc1)=O,0 F6571-0414,CN(C)C(CNC(C(NCc(cccc1)c1OC)=O)=O)c1csc2c1cccc2,2 Y031-1801,O=C(CS(c1ccccc1)(=O)=O)Nc(cc1)ccc1S(NCC1OCCC1)(=O)=O,2 Z2812992401,CC(c1ncnn1C)NC(N(CCc1c(cc2)C(OC)=O)Cc1c2OC)=O,0 Z1473715448,OCC(c1ccccc1)NC(CCc1ccncc1)=O,2 F3229-0013,COCCNC(c(cccc1)c1-c(cccc1)c1C(N)=O)=O,0 J100-0202,C1(N[C@H](C(Nc2c1cccc2)=O)CC(Nc1cnc(cc1)OC)=O)=O,2 Z2768785585,CN1N=C(c2nnc(CC3)n2CCC3C(OC)=O)c(cccc2)c2C1=O,2 Z141060484,CCOc(cc1)ccc1C(NCC(Nc(cc1)ccc1-n1c(cccc2)c2nc1)=O)=O,2 Z1601802255,O=S(c(cccc1)c1OC(F)(F)F)(NC1CCOCCC1)=O,0 D389-0926,CCN(C(c1c(N2C)nc3N(Cc4ccccc4)CC(C)Cn13)=O)C2=O,2 Z3071636598,COCCCN(C(CC1)c(cc2)ccc2Br)S1(=O)=O,0 SC13-0021,O=C(C1CCC1)N(Cc1cnccc1)C1CN(Cc2ccc(C(F)(F)F)cc2)CCC1,2 G857-0134,O=C(CSC(C(CCC1)=C1N1CCCN2CCOCC2)=NC1=O)N(CCC1)c2c1cccc2,2 F6556-6168,O=C(NCc(cc1)ccc1F)N(CCC1)CCN1C1CCC1,0 F0818-0062,O=S(c1cccc2cccnc12)(N(CC1)CCN1c(cc1)ccc1F)=O,2 Z1947425599,CC[C@@H](C(O)=O)NC(c(cc1)c(C)cc1Cl)=O,0 F3222-0264,Cc1n[nH]c(-c2nc(-c3cccc(Cl)c3)no2)c1,2 S531-0404,CC(C)CN(C(Cn1c2ccc1)C(NCCCN(CCC1)c3c1cccc3)=O)C2=O,0 Z3138552011,Cc1cc(C(F)(F)F)nc(C(N[C@]2(CCC3)[C@@H]3CNC2)=O)n1,2 S720-0789,O=C([C@H](C[C@@H](C1)Oc2ccccc2)N1C(c1cc2cccnc2cc1)=O)N1CCCC1,2 Z910148812,CC(C)c1noc(CN(CC2)CCN2C(NC2CC2)=O)n1,2 F6416-8004,OC(CCNC(c(cccc1)c1Cl)=O)c1cocc1,0 Z2602363638,CC(C)(CN(Cc1cccc(C(N)=O)c1)CC1)c2c1cccc2,2 F6439-4946,O=C(NCCn1nc(C(F)(F)F)cc1)Nc(cc1)cc2c1OCO2,2 Z2982760035,C(COC1COCC1)n1nnc(-c2nc(cccc3)c3s2)c1,2 Y206-4176,OC(C(C1CC2CC1)C2C(N(CC1)CCN1S(c1cccs1)(=O)=O)=O)=O,2 Z3583385905,Cc1cc(C(N2C(CO)(CO)CCC2)=O)c(C)n1-c1nocc1,0 F6561-5734,O=S(Cc1ccccc1)(C(CC1)CCN1S(CCC(F)(F)F)(=O)=O)=O,0 S651-1398,Cc1noc(C)c1CCC(N1CCC(C2)(CN(C)C2C(N2CCN(C)CC2)=O)CC1)=O,2 G212-0422,O=C(CCC(N1c(cccc2)c2N(CCC2)C2C1)=O)NCCN1CCOCC1,2 F6215-0005,Cc1noc(CCNC(c(cc2)ccc2-n2cccc2)=O)c1,2 Z3687061486,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NC(CN1CCOCC1)=O,2 F2146-0630,Clc1c2nc(NCCn3nccc3)sc2ccc1,0 S606-1145,CC(C)Oc1ccc(CN(CC2)C[C@@H]2N(c(nccc2)c2N2CCOC)C2=O)cc1,0 S932-2162,CCOCc1cn(C(CC2)CN2C(Cc2cccc(F)c2)=O)nn1,2 Z2978056703,Cc1ncc(CNc(cc2)c(CO)cc2Br)o1,2 F6507-8937,COC1(CNC(c(cccc2)c2Br)=O)CCSCC1,0 Z4866922188,CCCS(N(CCCC1)C1C(NCC(C)(CC(C)C)C(O)=O)=O)(=O)=O,0 SA46-0219,O=C(c1cccs1)N(C1)CC1(C1)OCC1N1CCOCC1,0 F6562-7480,O=C(c1cccs1)NC(CC1)C11CCOCC1,2 F6685-8660,O=C(c1cc2nccnc2cc1)N1CC(COc2c(C(F)(F)F)cccn2)CCC1,2 SC40-0121,Cc1cc(C)nn1CCC(N(CC1)CCC11OCc2c(COC)nnn2C1)=O,2 Z3701199898,CC(C)(C(N(C)C[C@@H]1NCCC1)=O)c1cccc(C(F)(F)F)c1,0 Z1763258346,OC(C1(CCOCC1)NC(c1ncc(C(F)(F)F)cc1)=O)=O,0 Y502-8141,Cc1cc(C)nn1CCCNC(c1nn2c(C(F)(F)F)cc(-c3cn(C)nc3C)nc2c1)=O,2 L310-0006,Cc1nc(CN(C(COc2c3)=O)c2cc(Cl)c3S(Nc(cc2)cc(OC)c2OC)(=O)=O)no1,0 F6753-1051,O=C(C(C1)OCCN1c(nc1)ncc1F)N1CCOCC1,0 Z3134378410,CCn(cc1Cl)nc1NC([C@]1(CNC2)[C@@H]2CCOC1)=O,0 Z1619549811,COc1c(c(CC(NC(C(C2)O)c3c2cccc3)=O)c[nH]2)c2ccc1,0 F6442-6837,Cc1cc(C(N(CC2)CCC2N(CC2)CCC2Oc(cccc2)c2F)=O)c(C)o1,2 F6681-3656,C(C(C1)CN1c1ncnc2c1nnn2-c1ccccc1)Oc1cnccc1,2 Z2850447371,CC1(CS(N(CCN2C)CC2=O)(=O)=O)CCC1,0 Z1095049546,O=C(C(CC1=O)CN1c(cccc1)c1F)Nc1nc(-c2nc3ccccc3cc2)n[nH]1,0 Z2329945805,Cc1cnc(CN(CC2)CCC2Oc2ncccc2C)cc1,0 Z2965103245,CC(N1CC(N[C@@H](COCC2)[C@H]2OC)=O)=Nc(cccc2)c2C1=O,2 Z2695622255,C[C@@H](CN(C1)C(c(ccc(C)c2)c2O)=O)[C@@]1(C)C(O)=O,0 F6562-5961,CC(C)(C)SCC(CCCC1)N1C(c1cccc(Br)c1)=O,0 Z2298845201,O[C@H]1[C@H](CNC(C(C2CC2)N2CCCC2)=O)CCC1,2 S664-4527,COc(cccc1CN(CC2)CCC2(CC2)C2O)c1OC,0 SC72-0141,Cc1nc(COC2(C3)CN3S(c(cc3)ccc3OC)(=O)=O)c2cn1,0 Z1175804287,O=C(CN(CCC1)C1=O)NCCc1nc(C2CCCCC2)cs1,2 S682-0527,CN(CCO[C@@H]1C(Nc(cc2)cc(Cl)c2OC)=O)[C@@H]1c1ccccc1,2 S613-0931,O=C(c1n[nH]c2c1cccc2)N(CCC1)C1c1nc(CCOCC2CCCC2)no1,0 F6561-6913,Cc1cc(C(NC(CC2)CN2c(cc2)nn3c2nnc3)=O)c(C)o1,2 F6497-8046,O=C(C1CCOCC1)N(CC1)CCC1c1n[nH]c(C(NCC(F)(F)F)=O)c1,2 Z1225214253,CN(C)c1cccc(C(CCC2)N2C(CN2N=Cn3nccc3C2=O)=O)c1,0 F6725-1150,C(C1)C1c1nnc(N(C2)CC2N(CC2)Cc3c2scc3)s1,2 F6726-5628,Cc1c(CN(C)C(C2)CN2c(ncnc2-c(cc3)ccc3F)c2F)cno1,2 F1260-1520,CC(N(C)C(NC1C(C(N(C=CC=C2)C2=N2)=O)=C2Cl)=O)=C1C(OC)=O,2 E570-2561,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(NCCC(N1CC(C)CC(C)C1)=O)(=O)=O,2 SB18-0176,CC(C)CC(N[C@@H](C[C@H]1c2nc(C)n[nH]2)CN1C(c1cc(Br)cnc1)=O)=O,0 Z3868523627,CSc1c(CN(CC2)C(c(cc3)ncc3F)=O)c2ccc1,0 F6561-9266,CCSc(cccc1)c1C(NCc1cn(-c2cnccc2)nn1)=O,0 Z4800257439,O=C(c1cn(-c2cnccc2)nc1)N(CCc1ccc2)Cc1c2Cl,0 F6275-0275,O=C(Nc1cccs1)N(CC(F)(F)F)C1CCOCC1,2 F6436-2045,Cn1c(C(CNC(Cc2cscc2)=O)O)ccc1,2 F6439-8391,O=C(NCCn1c2cc(-c3ccco3)nn2cc1)Nc(c(F)ccc1)c1F,2 F3406-6911,O=C(CN(CC1)CCC1c1nc(-c(cc2)ccc2F)no1)NCc(cc1)cc2c1OCO2,2 F5099-0464,CCCS(Nc1cc(N(CC2)C(C3OCCC3)=O)c2cc1)(=O)=O,2 Z3378540477,CCc(cc1)cc(O)c1C(Nc1nn(CCN(C)C2=O)c2c1)=O,2 F6471-0323,O=C(Cc1cscc1)N(CC1)CC1n1nnc(-c2ccccc2)c1,2 8011-1072,CCCCC(C)(NC1=S)NN1c1c(C)c(C)ccc1,0 Z360886738,CCOC(c1c(NC(CN2N=C(C=CC=C3)N3C2=O)=O)sc(C(N(C)C)=O)c1C)=O,0 Y040-0455,CC(c(c(O1)c2)cc(Cl)c2OCC(Nc(cc2)ccc2N2CCOCC2)=O)=CC1=O,2 F6560-7776,O=C(NCc1cccs1)NCc(cc1)cnc1-c1cocc1,2 Z756439020,CC(C)C[C@@H](C(O)=O)NC(c1ccncc1)=O,0 F6435-9431,COC(CSC(CC1)CN1S(c(cccc1)c1F)(=O)=O)=O,0 F2158-0832,CSc(cc1)cc2c1nc(NCCN1CCOCC1)s2,0 8009-8257,OC(CC1)C(CCCC2)C2N1S(c1ccccc1)(=O)=O,2 F6192-0136,O=C(CSc(cc1)ccc1F)NCC(c1ccco1)c1ccco1,2 F2135-1319,C(c1cn(cccn2)c2n1)Sc1nc(-c2ccccc2)c(-c2ccccc2)o1,2 SB47-0503,Cc1n[nH]c([C@@](CN(Cc2ccccc2)C2)(C3)[C@@H]2CN3C(NCCc2ccccc2)=O)n1,2 F2879-2903,CSc1cccc(NC(C(NCCc(cc2)ccc2Cl)=O)=O)c1,0 F6564-9360,O=C(C(CCC1)CN1c1nnc(CCC2)c2c1)NCc1cccs1,2 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Z2784162215,CC(C)c1c(C)sc(NC([C@H](CC2)CC[C@H]2N)=O)n1,0 F5033-2439,O=C(COc(ccc(Cl)c1)c1Cl)NCC(CC1)CCN1c1ncccn1,0 Z3470573344,CN(CCc1ccccc1)S(N(CC1)CC1(CO)F)(=O)=O,2 V024-3616,Cc1c(C)cc(CN(CC2)CCC2N(c(cc2)ccc2F)S(c2ccccc2)(=O)=O)cc1,0 F6521-7433,Cn(cc1)c2c1cc(C(CNC(c(cc1)cc(F)c1OC)=O)O)cc2,0 Z2770789460,OC(Cc1ccncc1)(CC1)CCN1c1nnc(-c2ncccc2)s1,2 Z2949968794,CCc(onc1C)c1NC(N(CCC1)[C@@H](CN2C)[C@H]1C2=O)=O,2 Z1001254900,Cc(c1c2)noc1ncc2NC(C1N(Cc2ccccc2)CCC1)=O,2 Z2358717843,CN(CCC(O)=O)c1nc2cccc(F)c2s1,0 F2982-0443,COc1cccc2c1nc(N(CC1)CCN1C(CS(Cc1ccccc1)(=O)=O)=O)s2,0 Z3388626256,CC1(CNC(c(cc2)ccc2OCC(O)=O)=O)OCCOC1,2 1630-1576,CC(C)OC(C(C1c(cccc2)c2Cl)=C(C)NC(CC(C)(C)C2)=C1C2=O)=O,0 SB94-0195,O=C(C(C1)CN(CC(CC2)CCN2C(c(cc(cc2)Cl)c2F)=O)C1=O)N1CCCC1,2 E852-0496,CC(CC1)CCN1C(c1nn(CC(C)(C(NC2CCCCC2)=O)N(C)C2=O)c2c1)=O,2 Z1323749273,Cc1nc(-c(cc2)ccc2S(NC(Cc(cc2)ccc2Br)=O)(=O)=O)co1,0 Z2465094578,Cc1cccc(NC(CC2)CCN2C(c2csc(CCN)n2)=O)c1,2 S428-0670,Cc1cc(C(N2CCC(Cc3nc(C4CCOCC4)no3)CC2)=O)c(C)n1CCCOC,2 Z1232172580,O=C(c(cc1)cc(F)c1N1CCOCC1)Nc1n[nH]c(C2CCCC2)c1,2 Z929425198,Cn1c(C(Nc2cc(-n(cc3)nc3C(O)=O)ccc2)=O)cc(Cl)c1,2 S720-2120,NC([C@H](C[C@@H](C1)Oc2ccccc2)N1C(CCc1nc(cccc2)c2s1)=O)=O,0 Z1155376389,Cc(nccc1)c1C(N1CCN(CC(NC2CC2)=O)CC1)=O,2 Z821517942,OCCN(CC1)CCN1C(c1c[nH]cc1-c(s1)ccc1Cl)=O,0 Z2376883477,C[C@@H](CN(C1)C(Cc2csc(-c3cnccc3)n2)=O)[C@H]1C(O)=O,0 SC09-0234,C[C@H]1N(Cc(cc2)cc3c2OCCO3)Cc(cc(cc2)-c3cncnc3)c2OC1,2 F6356-0555,CC(Cc1cocc1)NC(c(cccc1)c1OC)=O,0 V030-3798,CC1(CNC(CC(c2cn(Cc3ccc(C)cc3)c3c2cccc3)c2ccc(C)cc2)=O)OCCC1,2 Z2527312787,CN(C)CCn1nnc(C2(CCCCC2)O)c1,0 Y204-2512,O=C(C1C(CC2)CC2C1)Nc(cc1)ccc1NC(C1C(CC2)CC2C1)=O,2 F6562-4099,CN(C)c1nc(CCC(C2)NC(CSCc3ccccc3)=O)c2cn1,2 S051-0051,Cc1noc(C)c1S(N(C1)CC1Oc1cc(-c2nc(C)no2)ccc1)(=O)=O,2 Z730273124,Cc1n[nH]c(C(Nc2ccc(CC#N)cc2)=O)c1,0 S990-0504,CC(C)n1ncc(CN(CCC2c3nc(C)no3)CCN2S(C)(=O)=O)c1,2 Z1193709425,Cc1cc(C)nn1-c(cc1)ncc1NC(N1CC(COC)CCC1)=O,0 Z1278918258,Cn1c(-c(cc2)ccc2Oc2nccnc2)nc2c1ccc(Cl)c2,0 F6676-2758,CN(C(CC1)CCN1c(cc1)nn2c1nnc2)c1ncccc1,2 Z814719146,O=C(CN1N=C(C=CC=C2)N2C1=O)N1CCC(COc2ccccc2)CC1,2 F6685-8683,CN(C=C(C(N1CC(COc2c(C(F)(F)F)cccn2)CCC1)=O)C(OC)=C1)C1=O,2 F6506-4963,OC(CNC(c1cc(Br)cnc1)=O)(C1CCOCC1)c1ccccc1,2 F0651-0543,Cc1cc(cc(CNC(Nc2cc(C)ccc2)=O)cc2)c2n1C,0 F6502-2913,Cn1nc(C2CC2)cc1N(CC1)CCN1C(c(c(F)ccc1)c1Cl)=O,0 Y205-6085,CC(C(Nc1c(C(N)=O)c(CCC(C)C2)c2s1)=O)Oc(ccc(F)c1)c1F,0 Z1507103445,CCc1c(-c2csc(-c3ccn[nH]3)n2)[nH]c(C)c1C(C)=O,2 Z4421005652,NC(c(cccc1)c1Oc(cc1)ccc1NC(NC(C(CO)C1CC1)C1CC1)=O)=O,2 Z1441381422,CC(C(N(C)Cc1cccc(F)c1)=O)N(CC1)CC2C1N(C)CCC2,2 Z1874991737,CC1(CNC(Nc2nccc(C(F)(F)F)c2)=O)COCC1,0 Z111791394,Cc1cccc(C)c1NC(CCCC(O)=O)=O,0 Z2959592280,CN(C[C@H]([C@H]1CCC2)N2C(c2ccc(Cn3nncc3)o2)=O)C1=O,2 Z2174606641,CC1(C)c(cc(cc2)C(NS(C3CCC3)(=O)=O)=O)c2OC1,2 Z2277651296,CC(C)(C1)OC2(COCC2)CN1S(c1cc(C)cs1)(=O)=O,0 M954-2391F,CCn(c(C)c1-c2nc(C3CC3)no2)c(C)c1S(NC(C)c1ncccc1)(=O)=O,2 Z1570177494,CC(C1)OCCC1NCc1c(C)nc2sc(C)nn12,0 F6608-2506,O=C(NC1CCOCC1)N(CC1)CCC1Oc1nccc(C(F)(F)F)n1,2 Z1144425034,Cc1c(NC(Cn2nc(C(F)(F)F)cc2)=O)n(C)nc1C,0 Z1129124712,Cc1nn(C)c(C(NCc2c(N(CC3)CCC3C(N)=O)nccc2)=O)c1,2 F6541-4281,CC(N1CCN(Cc2cn(cccc3)c3n2)CC1)=O,2 Z1680041781,CSCc(cccc1)c1NC(c1cncnc1)=O,0 Y020-0410,O=C(CC(C1=O)N(CC2)CCN2c(cccc2)c2F)N1c(cc1)ccc1Oc1ccccc1,2 Z1199209159,COC(C(C1)C1(CC1)CCN1C(c1ncccc1)=O)=O,2 K292-1908,CCC(C(Nc1ccc(CC)cc1)=O)SC(N(C1CC1)C1=O)=Nc2c1scc2,2 F6573-4522,O=C(NCCOCCN(C(CC1)=O)C1=O)Nc(c(F)ccc1)c1F,0 F6249-0347,COC(N(CC1)C(C(Nc2cccc3ncccc23)=O)c2c1cccc2)=O,2 Y043-6765,C(N1CCN(c2ccc(cc2)Cl)CC1)(N[C@H](C(NC1CC1)=O)C)=O,2 Z4921678515,Cc1cc(-c2cn(C(CCC3)CN3C(c3cccc(N(CCCN4)C4=O)c3)=O)nn2)cnc1,2 SB29-0516,Cc1c(C(N(C[C@H](C2)OCc3cc(C)ccc3)[C@@H]2c2n[nH]c(C)n2)=O)ocn1,2 Z1411460988,CC(C)C(NCC1(C)SCCC1)=O,0 Z1573376359,OCCc(cc1)ccc1NCc1c[nH]nc1-c1cc(cccc2)c2o1,2 G346-0339,CC(C)NC(C1CCC(CN(C(c(scc2)c2N2Cc3ccc(C)cc3)=O)C2=O)CC1)=O,0 F2416-0703,O=C(C1CC1)N(CC1)Cc2c1ccc(NC(c(ccc(F)c1)c1Cl)=O)c2,0 SB59-0651,Cn1c(C2C(C3)(CN3C(NCc3ccccc3)=O)CN(Cc3ccccc3)C2)nnc1,2 C470-0176,CC1CN(Cc2nc(N(C)C(N(C)C3=O)=O)c3n2Cc2c(C)cccc2)CC(C)C1,0 G749-0192,Cc1cc(C)nc(N(C2CC2)C(SCC(Nc(cc2)cc(OC)c2OC)=O)=N2)c1C2=O,0 SB46-0321,CCn1nccc1C(N(C[C@H](C[C@H](C1)C(NC2CCCC2)=O)[C@H]1N1)CC1=O)=O,2 F5831-9320,CC(C)Sc1ccc(CC(NCC2(CCOCC2)c2ccccc2)=O)cc1,0 Z2331619133,C[C@](C1)([C@H]1c1ccccc1)C(NOC1COCC1)=O,2 F6472-0891,O=S(c1cnccc1)(NCCSC1CCOCC1)=O,2 L309-0031,Cc1nc(CN2c(cc(cc3)S(Nc(cc4)ccc4Cl)(=O)=O)c3OCC2=O)no1,0 Z1870103887,COc1ncnc(OC)c1C(N1CC(CCC(O)=O)CCC1)=O,0 Z1182585961,CNC(C1(CC1)C(NC(CCN1CC(F)(F)F)C1=O)=O)=O,2 F6472-0522,Cc1cc(C(NCCSC2CCOCC2)=O)c(C)o1,0 Z3685949531,Cc1c(N(CC2)C[C@@H]2NCc2ncccc2)nc(C(NC)=O)nc1C,2 Z3577853758,CC(Cc(cc1)cc(Cl)c1F)(CCC1)N1C(c(nc1)cn2c1nnc2)=O,2 Z1281127757,CC(C1)Oc(cc2)c1cc2S(NCc1nc(C)c(C)s1)(=O)=O,0 Z1185749355,Cc1cn(C(CC2)CCN2C(CCC(N(CC2)N=C2c2ccccc2)=O)=O)nc1,0 F6454-1204,CS(N(CC1)CCC1C(NCC(CC1)CCN1c(nc1)ncc1F)=O)(=O)=O,2 F6812-6741,COc1ncc(CN(CC2)CCN2c2nc(C#N)ccn2)cc1,0 F6788-1239,CCc1c(C)nc(C2CC2)nc1N1CCN(Cc2c(C)onc2)CC1,2 SC11-0518,CCn1ncc(CN(CCC2)CC2N(CCCN2CCOCC2)C(C2CC2)=O)c1C,0 F6573-6536,Cc1cnc(NC(N(CC2)CCC2(C2)C2(F)F)=O)s1,2 Z4989108233,Cc1c(cccc2S(NC(Cc(cc3)ccc3Cl)=O)(=O)=O)c2ncc1,0 F1187-0052,Nc1c(C(c2ccccc2)=O)sc2nc(CCC3)c3cc12,2 J087-0479,Cc1nc(ccc(NC(c2c3cccc2)=C(C(Nc(cc2)ccc2F)=O)S3(=O)=O)c2)c2[nH]1,2 F6481-4408,O=C(N(CC1)CCSC1c1cccs1)OC1CCOCC1,2 F6475-3467,Cc(cc1)ccc1N(CC(C1)NC(c(cc2)cnc2OC2CCOCC2)=O)C1=O,2 Z1143669466,CC(c1c(C)nc(C)s1)N(C)C(NCc1nccs1)=O,0 Z1277984106,CN(C=CC=C1NC(N(CCCCC2)C2c(cc2)ccc2OC)=O)C1=O,0 Z1684176939,Cc1cccc(-c2noc(-c(ccc(OC)c3)c3F)n2)n1,0 Z4144008526,CC(c1ccc(C(F)(F)F)s1)NC(c1cn(CC(O)=O)nn1)=O,0 F5287-0016,O=S(Cc1ccccc1)(N(CC1)CCN1c1nccnc1)=O,2 F6200-3466,C=CCCC(NCC(C1CC1)(c1ccccc1)O)=O,0 SA52-0146,CC(C)CN(CCCN(C1)S(c(cc(cc2)OC)c2OC)(=O)=O)C1c1nc(C)no1,0 F6515-0824,O=C(CNC(OCc1ccccc1)=O)NCc1cc(-c2cccs2)ncc1,2 Z1997051191,O=C([C@@H](CCC1)NC1=O)N[C@H](CCC1)c(cc2)c1cc2F,0 Z1252859812,CCN(C=C(C=C1)NC(NC(CCCO)c2ccccc2)=O)C1=O,2 Z2482074539,CCc([nH]nc1)c1C(N[C@@H](CC1)Cc2c1nc(N)s2)=O,2 F6523-4543,O=C(c1cc(cc(cc2)Cl)c2[nH]1)N(CC1)CCN1c1nnc(CCCC2)c2c1,2 Z728857802,CCN(CCC(O)=O)C(c1cccn1C)=O,0 C785-2652,CC(n1c2cc3c1ccs3)=NN(CCCC(NC1CCCC1)=O)C2=O,2 F6464-1117,COc1ccc(C(CCCC2)CN2C(Cn2ncnc2)=O)cc1,2 C918-0139,CC(CCc1ccccc1)NC(c1cc(CS(c2c-3ccc(Cl)c2)(=O)=O)c3s1)=O,2 F6209-0110,O=C(c1noc(-c2ccco2)c1)NCCCn1c(-c2ccccc2)ncc1,2 Z750859592,CS(c(cc1)cc(C(Nc(cc2)ccc2-c2nc(cccc3)c3[nH]2)=O)c1F)(=O)=O,0 F2495-1725,COc(cccc1)c1N(CC1)CCN1C(CC(CSC1=NC2=C3CCC2)N1C3=O)=O,2 F6547-0208,C(c1cccnc1)N1Cc2c(CCC3)c3nn2CC1,2 Z90513687,CCNCc1cc(OC)c2OCOc2c1,0 Z2349414027,CC(CCC1)(CN1C(NCc1nnc(C2CC2)s1)=O)OC,0 Z3290577096,Cc1cc(CNCc2cccc(C3OCCO3)c2)cc(C)c1,2 F0526-1983,CCOC(c1c(NC(C2CC2)=O)sc(Cc(cc2)cc3c2OCO3)c1C)=O,2 Z2968992652,Cc(cc1)cn2c1nc(-c(cc1)ccc1F)c2CN(CC1)CC1NC(N)=O,2 Z1039077740,Cc1cccc(NC(C(CCC2)CN2c2ncnc3c2cc[nH]3)=O)n1,2 Y040-4408,C\1(=C(\c2c(OC1=O)cc1c(c2)c(co1)C)/C)/CC(N[C@@H](C(=O)O)Cc1c[nH]c2c1cccc2)=O,2 Y040-8172,O=C1Oc2cc(OCc(cccc3)c3F)cc(OCc(cccc3)c3F)c2-c2c1cccc2,2 F6556-1935,Cn(cc1)c2c1cc(CCNC(C(Nc(cccc1)c1SC)=O)=O)cc2,0 F6513-1609,Cc1cc(C)nn1-c1ccc(CCC(NCCSc2nncn2C)=O)cc1,2 Z2957408743,CC(C)C(CNC(c(nc(C(C)C)nc1)c1Br)=O)O,0 F6481-4602,O=S(CCC(F)(F)F)(N(CC1)CCSC1c1cccs1)=O,0 F2047-0172,Cc(cc(cc1)S(C(CNC(c(o2)ccc2Br)=O)c2cccs2)(=O)=O)c1F,2 L367-0075,O=C(c(cc1)ccc1-c1cnc(N2CCCC2)nc1)NCc(cc1)ccc1Br,0 Z2256268581,CN(Cc(cc1)ccc1C(O)=O)C(CC(C1)CC1c1ccccc1)=O,2 S629-2665,O=C(CCc(cc1)cc(C2)c1OCCN2C(c1ccco1)=O)N1CCOCC1,2 Z2474211683,Cc1c(NC(C(CC2)Cc3c2cccc3)=O)scn1,2 V023-2089,O=C(Cc(cc1)ccc1N(Cc1ccccc1)C(c1cccc(F)c1)=O)NCC1CC1,2 F5831-9021,CCNC(NCCN(CC1)CCN1c(cccc1)c1F)=O,0 Z2951394125,CC(C)Cc(nc1)ncc1NC(N(CC1)CCC1(C1CCC1)O)=O,2 F1501-0254,Cc(c(C)c1)cc2c1ncn2Cc(cccc1)c1F,0 Z1660098232,CC(CC1c2cc(OC)ccc2)CN1C(c1c(N)nc(C)nc1)=O,0 SA66-0256,O=C(C1(CC1)c1ccccc1)N1CC(CCc2noc(-c3ccncc3)n2)CCC1,2 Z3698946603,CC(C)c1ccc(C(CO)NC([C@@](C2)(C3)[C@@H]2[C@H]3N)=O)cc1,2 F6477-0594,COc(ccc(F)c1)c1S(N(CC1)CCN1c1nc(-c2cscc2)cs1)(=O)=O,2 F6658-5818,C(C(CC1)CCN1c1nncs1)Oc1ncnc(C2CC2)c1,2 F6774-4231,COc(cn1)cnc1OC1CN(Cc2cccc(C(F)(F)F)c2)CC1,0 Z4986168127,Cc(cc1)ccc1C(N[C@@H]1[C@@H]2[C@H]1CN(CCC1CCCC1)C2)=O,2 Z2996036424,CC(C)n1cnc(S(N[C@H](Cc2c3cccc2)[C@@H]3N)(=O)=O)c1,0 8009-9010,COc(cc1)ccc1N(C(CC1N(CC2)CCC2O)=O)C1=O,0 F6525-6859,COc1cc([nH]c(C(NCCn2ncc(-c3ccco3)c2)=O)c2)c2cc1,2 SB20-0075,O=C(c1cn(C[C@H](CCC2)N2C(c2ncccn2)=O)nn1)NC1CCCC1,2 8018-6076,Cc1cc(S(N(CC2)Cc(cc3OC)c2cc3OC)(=O)=O)cc(C(C)=C2)c1NC2=O,0 D578-0176,Cc1cc(Nc(cc2)ccc2NS(c(cc2)ccc2OC)(=O)=O)nc(NC2CCCCC2)n1,0 F6791-9584,CN(CC1OCCOC1)Cc1c(CCCC2)c2nn1C,2 Z2256366380,CCCCC(N(CSC1)C1C(NCC(C(O)=O)c(cc1)ccc1F)=O)=O,2 F5860-3756,COc1cc(CCN(C2)C(CN3N=Nc(cccc4)c4C3=O)=O)c2cc1,2 F6240-2237,CCOC(N(CC1)CCN1C(c1cn(CC(c2ccccc2)O)nn1)=O)=O,2 Z1250389019,O=C(C(C1)Oc(cc2)c1cc2F)N(CC1n2nccc2)Cc2c1cccc2,0 Z4509022102,O=C(c(cc1)ccc1-c1cccc(Cl)c1)N(CC1)CCN1c1ncccn1,2 Z2933130941,Cc1c(CNS(c2c(C)cc(C)cc2C)(=O)=O)ocn1,0 F6788-1651,Cc1c(C)nc(C)nc1N(CC1)CCN1c1nccc(C#N)n1,0 F6782-7264,Fc(cc1)ccc1-c(o1)nnc1SCC1COCCC1,2 Z2437509117,CC(CNS(N(CC1)CCC1C(O)=O)(=O)=O)(c1cscc1)O,0 Z2275459149,CC(CC1)CN1S(Nc1ccc(C(CC(N2)=O)CC2=O)cc1)(=O)=O,0 F5002-0602,Cc1noc(C(Nc(ccc(C)c2)c2C(c2ccccc2)=O)=O)c1,0 Z3687066749,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NC(c1ccc(C2(COC2)O)cc1)=O,2 Z4873545616,C(C1)C1(C1CCNCC1)c1ccccc1,2 SA69-1310,CC(CCC1)(CN1S(c(cccc1)c1F)(=O)=O)c1noc(C2CC2)n1,0 Z3325427061,CC(C)(C1OCCCC1)NC(c1cc(C(O)=O)cnc1)=O,0 Z2966299857,Cc1c(CNC([C@@H]2[C@@H](c3cnccc3)OCC2)=O)n(cccc2)c2n1,2 F6037-0210,O=C(CN(c(cccc1)c1O1)C1=O)N(C1)CC1c1nc(cccc2)c2[nH]1,2 Z1330147380,CC(C)(C1)NCCN1C(c1cn(Cc(cccc2)c2Cl)nc1)=O,0 F6792-0841,CSc1nc(C2CCOCC2)cc(N2CCN(Cc3csc(C4CC4)n3)CC2)n1,2 F3411-6865,CC(C)CCN(c(n1-c2c3cccc2)nnc1SCC(Nc(cc(cc1)Cl)c1OC)=O)C3=O,0 F3116-0043,Cc1cccc(CNC(CSc2nc3ccccc3nc2C)=O)c1,2 Z2156234683,CCC(C)CCc1nc(-c(cc2)ccc2Oc2ncccn2)no1,0 Z808701956,[O-][N+](c(cc1)ccc1S(N(CCC1)CC1C(N(CCC1)c2c1cccc2)=O)(=O)=O)=O,0 F6454-1108,O=C(c1cc(cccc2)c2[nH]1)NCC(CC1)CCN1c(nc1)ncc1F,2 SB24-0359,Cc1noc(C)c1CN(CC1)CCC1(CC1)C1n1nnc(C(N(C)C)=O)c1,0 F6549-5439,Cc(nc1)cnc1C(N(CC1)CCC1c1cncn1C)=O,2 F3366-5202,CC(N(CCC1)C1c1nc(cccc2)c2n1CCCOc1c(C)cccc1C)=O,2 F3406-3248,CC(CC1)CCN1c1nccnc1Oc(cc1)ccc1C(N(CC1)CCN1C(c1ccco1)=O)=O,2 F6514-4104,O=C(C1(CC1)c(cc1)ccc1F)N(C1)CC1n1nnc(COc2ccccc2)c1,2 Z1994131957,Cc1nccnc1N(CC1)CCN1c(nccc1)c1C(NC)=O,0 Z3138953612,Cn(c(O)c1)nc1C(N(C1)CC2(CCC2)C1N)=O,2 Y031-0368,CC(C)(C)CC(C)(C)NC(c(cc1)ccc1OC)=O,0 S984-0827,CC(C)CC(N(C[C@H]1CN(C2)C(c3nccnc3)=O)C[C@]12C(N(C)C)=O)=O,2 Z1011681964,O=C(NCC1CC1)Nc(cc1OCCOc1c1)c1Sc1ccccc1,2 F1300-0135,CCOC(c(cc1)cc2c1nc(NC(c1cc(C(F)(F)F)ccc1)=O)s2)=O,0 Y500-0297,COc(cc1)ccc1C(CSc1nc(-c(cc2)ccc2F)c(CCCC2)c2c1C#N)=O,2 F6726-5651,CN(CC(C=CN1C)=CC1=O)C(C1)CN1c(ncnc1-c(cc2)ccc2F)c1F,2 Z224135352,CN(CC(O)=O)C(C(CC1=O)CN1c(cccc1)c1F)=O,0 SC19-0579,CCn(cc1)nc1C(N1CCN(Cc2nn(CC)c3c2COCC3)CC1)=O,2 SA66-0353,O=S(Cc1ccccc1)(N1CC(CCc2noc(-c3cnccc3)n2)CCC1)=O,2 V025-9557,CC(c1ccccc1)N(Cc(cc(cc1)NC(C2CCC2)=O)c1N(C)C)C(COC)=O,2 F6518-4330,O=C(c1noc(C2CC2)c1)N(CC1)CC1c(cc1)cc2c1OCO2,2 F6475-2301,O=C(c(cc1)cnc1OCC1OCCC1)N1CCN(Cc(cc2)cc3c2OCO3)CC1,2 Z1874540094,CC(C)c1cc(C(N(CC2)CCC2(c(cccc2)c2Cl)O)=O)nn1C,0 F6257-2571,O=C(Nc(ccc(F)c1)c1F)Nc1ncnc(N2CCCCC2)c1,0 Z1359970252,O=C(c(cc1)ccc1-c1nc(C2CC2)no1)N1CCCC1,0 S582-0141,CN(C(CNC(c1cc(-c(cc2)ccc2F)n[nH]1)=O)Cn1c2ccc1)C2=O,0 Y501-2180,CC(C)c1ccc(C(C)NC(c2c(c(-c3ccccc3)no3)c3nc(-c3ccco3)c2)=O)cc1,2 F6619-5509,CCNc1nc(N(CC2)CCN2c2ncnc3ccccc23)ccn1,0 Z1726260909,CC(C(N1CC2(CCCC2)COCC1)=O)n1nnc(-c2ccccc2)n1,2 F6562-0315,COc1c(C2(CC2)C(NCc2cn(-c3cscc3)nn2)=O)cccc1,2 F256-0030,CCOc(cccc1)c1NC(N(C)CCc1noc(C2CCCCC2)n1)=O,0 F6439-4185,O=C(NCCn(cc1)nc1-c1ccncc1)NCc(cc1)ccc1Cl,2 F0375-0323,CCOC(c1csc(NC(c2cc(-c3ccccc3)nc3ccccc23)=O)n1)=O,2 F2874-0212,CN(C(C=C1)=O)N=C1c(cc1)ccc1NC(C1c(cccc2)c2Oc2c1cccc2)=O,2 F3172-0001,O=C(CN1CCOCC1)N(C(C1)c2ccco2)N=C1c1cccs1,2 S976-0400,Cc1nn(C)c(C(N(CCC2)CC2(C(NCC2CC2)=O)F)=O)c1,2 T500-1856,Cc1cc(C(N(CC2)CCC2C(N(CC2)CCC22OCCCC2)=O)=O)no1,2 Y044-5043,N\1(C(Cc2c(\C=C1)cc(c(c2)OC)OC)=O)CC(N[C@@H](Cc1ccccc1)CO)=O,2 Z3686323442,O[C@@H](CC(Cn1cncc1)C1)[C@H]1Nc1ccnc2ncccc12,2 Z4086665537,O=C(c1nccc(N(CCN2)CC2=O)c1)NC1(COCCC1)c1ccccc1,2 Z3068704426,CCOC(c1cc2ccccc2nc1NC(COC)=O)=O,0 F6502-3172,CCN(CCN(C(N(CC1)CCN1c1cc(C2CC2)nn1C)=O)C1=O)C1=O,2 Z2464861199,O=C(C(C1)C11CCNCC1)Nc(cc1)cc(Cl)c1C(Nc1cnccc1)=O,2 Z1447524390,OCC1(CCC1)NCc1cccc(O)c1,0 Z2393252451,Cc(cc1)ccc1-c1cnc(-c(cccc2)c2C(N(C)C2CNCC2)=O)o1,2 Z2078815221,Cc1n[nH]cc1C(CC1)CCN1C(C1=CN(Cc2ccccc2)c(cccc2)c2C1=O)=O,2 Z4137047530,CC(CN(C(Cc(cc1)ccc1F)=NO1)C1=O)=C,0 Z3204194013,O=C(c1c2OCCc2ccc1)NCCc1n[nH]cc1,2 D277-0299,CC(c1nc(cccc2)c2n1Cc1c(C)ccc(C)c1)N1CCOCC1,0 Z2091752223,O[C@@H]1[C@@H](CC(N(CCC2)CCC2(C(F)(F)F)O)=O)CCCC1,2 F6560-4700,CC(C)C(Cn1nncc1)NC(c(cc(cc1)OC)c1Br)=O,0 Z2353379755,OC(C(C1)OCCN1C(NC(CC1)CCc2c1cccc2)=O)=O,2 Z1583346589,CC(C1=NC=C2C(Nc3ccc(CN(C)C)cc3)=O)=CC=CN1C2=O,0 Z1260585427,CCn1nc(C)c(S(N(C)c(c(F)ccc2)c2F)(=O)=O)c1C,0 F6679-2736,Brc(cncc1)c1OC(CC1)CN1c1nccnc1,2 F6191-0480,CC(C)(C)c(cc1)ccc1NC(NCCN(CC1)CCC1O)=O,0 F6753-2210,O=C(C1CCN(Cc(cccc2)c2Br)CC1)N(CC1)CCC1(F)F,0 Z2524830390,O=C(c(cc1)cc2c1C=CCC2)N1C(CC2)C(CN(Cc3ccccc3)C3)C3C2C1,2 F6734-0656,Cn1c(cccc2)c2c(C(N(C2)CC(C3)C2CN3c(cc2)ncc2Cl)=O)c1,2 Z1407805168,Cn1ncc2c1N=CN(CC1(CCC1)O)C2=O,2 Z1575468882,O=C(C(CC1=O)CN1c(c(F)ccc1)c1F)NCc(cc1)cnc1-n1cncc1,0 F6286-0479,O=C(c1nc(cccc2)c2s1)NCCc1nc(C(F)(F)F)cc(C2CC2)n1,2 G945-0749,O=C1N(Cc2nc(-c(cc3)cc4c3n(C3CCCC3)cn4)no2)c(cccc2)c2OC1,2 8013-1072,O=C(COc1cccc2cccnc12)N(c1c(CC2)cccc1)c1c2cccc1,2 Z1117857292,Cc(cc1)cc2c1n(C)c(-c1nccnc1N)n2,0 Z2909737176,Cc1cc(CCC(N2CCC(CC(O)=O)CC2)=O)no1,2 Z1875144531,CC(C1)(CN1C(C(c1ccccc1)c1ccccc1)=O)O,2 Z2442874121,CC(CC1)=C(C)CC1C(NS(c1c(C)cccc1)(=O)=O)=O,0 Z1417731449,CC(c1ccccc1)n(cc1)nc1NC(c(cc1)cc(N2)c1NC2=O)=O,2 F6463-0148,Cc(onc1)c1C(NCc(cccc1)c1-c1cscc1)=O,2 F6443-6345,O=C(Cn1nnc2c1cccc2)NCC(CCC1)N1c1nc(cccc2)c2o1,2 Z3357608355,CC(C(NS(NC(C)(C)C)(=O)=O)=O)n1nc(C(F)(F)F)cc1,0 F5855-0865,CN(C)S(c(cc1)ccc1C(N(CC1)CCN1C(C(C1)C1c1cccs1)=O)=O)(=O)=O,0 F1174-0393,Cc1cc(C(CSc2c(c(C)c(C)s3)c3ncn2)=O)c(C)n1Cc1ccco1,2 F6438-1253,Cc1nc(CNC(c(cc2)ccc2Oc2ncccn2)=O)nc(N(C)C)c1,2 F6790-0260,Cc1ccnc(N(CCN2)CC2=O)c1Br,0 F6471-0680,Cn1nc(cc(cc2)C(N(C3)CC3n3nnc(-c4ccccc4)c3)=O)c2c1OC,2 S511-1520,CN(C)C(CC1CC(CC2)(CCN2S(c2cccc3cccnc23)(=O)=O)OCC1)=O,0 Z1333941598,Cc1cc(C(Nc2n[nH]c(C3CCOCC3)c2)=O)c(cnn2C)c2n1,2 F1907-2579,CC(C)(C)OC(N(CC1C(O)=O)CC1c1ccccc1)=O,0 F6452-1288,CC(CNS(C)(=O)=O)(c1cccc(Cl)c1)OC,0 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Z1637991354,CC(CNC(Nc(cc1)nn1-c1cccc(F)c1C#N)=O)(COC)O,0 SC42-0589,COCc1nc(CC2CC(CC3)(CCN3C(c3nccnc3)=O)OCC2)no1,0 Z1991855305,CC(C(Nc1cn(C(C)(C)C(O)=O)nc1)=O)n1nccc1,2 F2865-1384,O=C(C(Oc1c2cccc1)=CC2=O)N(CC1)CCN1c1ncnc2c1nnn2Cc1ccccc1,2 Z3080959189,O=C(c1nc2ccccc2nn1)N1C(CN(CCC2)C2=O)CCCC1,2 V028-7933,CCC(C)CN(CC(N(Cc1ccc(C)s1)Cc(cc1)ccc1F)=O)C(C1CCC1)=O,0 F6752-3253,N#Cc1cc2ccccc2nc1N(CCC1)CC1NS(C1CC1)(=O)=O,2 Z2719625606,CC(C1CC1)n(c(C)c1)nc1C(N(CC1)CCC1(C)N1CCOCC1)=O,2 F6041-0013,Cc1csc(COc(cc2)ccc2C(N2c3nc(cccc4)c4n3CC2)=O)n1,2 SC11-0862,O=C(c1cccs1)N(CCCN1CCOCC1)C1CNCCC1,2 F6415-0384,COCCN(Cc1cocc1)C(Nc1cccc(C(F)(F)F)c1)=O,0 Z1996930403,O=C([C@@H](CCC1)NC1=O)NC(C1)CN(C(C2)C2c2ccccc2)C1=O,2 F6490-0388,O=C(CN(CCN1c2ccccc2)C1=O)N(CCC1)CC1Oc1nnccc1,2 Z4421152909,CCS(c1ccc(C(C)NC(CCc2c(C)n3nc(cccc4)c4c3nc2C)=O)cc1)(=O)=O,2 Z2067568109,CC(c1cccc(NS(c2c(C)cnn2C)(=O)=O)c1)(F)F,0 F6524-5832,Cc1nc(C(NCc2nnc3n2cccc3C(F)(F)F)=O)cs1,2 F2135-0713,O=C(c1nnc(-c2ccccc2)o1)NCc(cccc1)c1Cl,2 M410-0666,Cc(sc(-c1nnc(C2CC2)o1)c1)c1NC(c1cc([nH]cc2)c2cc1)=O,2 F6252-0862,O=C(C1(CC1)c1ccccc1)NC(CC1)CN1c(cc1)nnc1-c(cccc1)c1F,2 Y043-3389,O=C(C(CC1=O)CN1c1n[nH]c2c1cccc2)NCCc1nnc2n1cccc2,2 G284-1300,Cc1c(c(-n2cccc2)nn2CCCC(Nc(cc3)cc4c3OCCO4)=O)c2nc(C)c1,2 4477-0143,CC1(C)Nc(ccc(OC(COc2ccccc2)=O)c2)c2C(C)=C1,2 S606-2085,COCCN(c1cccnc1N1[C@H](CC2)CN2C(c(ccc(F)c2)c2F)=O)C1=O,0 C470-0208,CN(c1c(C(N2C)=O)n(Cc(cc3)ccc3Cl)c(CN3CCN(Cc4ccccc4)CC3)n1)C2=O,0 Z27791372,Cc1cccc(NC(Oc2ccccc2)=O)c1,0 F6478-0773,CCOC(N(CC1)CC1Oc1nc(C)cc(C)n1)=O,0 6154-0057,COc(cc1)ccc1-c1cc(cccc2)c2n1CC(Cn1c(cccc2)c2nc1Cc1ccccc1)O,2 S974-2383,C[C@@H]1N(Cc(cccc2)c2C#N)C[C@H](C[C@@H](C2)N(C)C)N2C1=O,0 Z3388784984,CC[C@@H](CC(O)=O)NC(c1cn(-c(cc2)ccc2Cl)nc1C)=O,0 Z1929871257,CCc(n(-c1c(C)cccc1)nc1)c1NCc1noc(C)n1,2 Z2068103642,CCC(C(O)=O)(c(cc1)ccc1Cl)NC(CC1CCOCC1)=O,0 Z1283790657,Cc1nc(CNC(N2C(Cc3ccccc3)CCC2)=O)no1,2 SD07-0963,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(c(cc2)cnc2OC)=O)C2)n2nn1)=O,2 SC77-0938,Cc1noc(C)c1CNC([C@H](CN(Cc(cc1)ccc1F)C1)[C@@]11OCCNC1=O)=O,2 D454-0618,COc(cc(cc1)N2Cc3nc(cc(cc4)Cl)c4n3CC2)c1NC(C1CCCCC1)=O,0 F5072-7300,O=C(Cc(c(F)ccc1)c1Cl)Nc1cc(-c(cc2)nn3c2nnc3)ccc1,2 F6764-3967,O=C(CN(CCC1)C1=O)N(CC1)CCC1c1nc2ncccc2cc1,2 Z802555428,Cc1n[nH]cc1CNC(C1COCC1)=O,0 SC74-1206,CN(C)C([C@H](C[C@H]1c2nc(-c3ccccc3)no2)C[C@@H]1NC(COc1ccccc1)=O)=O,2 F5476-0661,CN(C)C(CNC(NCc(cc1)ccc1OC)=O)c1cn(C)c2c1cccc2,2 F6464-0197,O=C(Cc1cnccc1)N(CCCC1)CC1c(cc1)ccc1F,2 Z3660423031,CCC(CC)(CNC(N(C1)CC(NC(N2)=O)=C1C2=O)=O)c(cc1)ccc1Cl,0 Z4658051209,Cn(cc1)nc1C(NC1C(CN(C2)C(C(C3)C33CCC3)=O)C2CCC1)=O,2 V008-0301,COc(cccc1)c1N1CCN(CCC(c(cccc2)c2F)Oc(ccc(F)c2)c2Cl)CC1,0 7407-0855,Cc1ccc(C(CC(c(cc(cc2)Br)c2N2CCc3ccccc3)(C2=O)O)=O)o1,2 F6525-1306,COc(cc1)cc(C(NCCn(cc2)nc2-c2nccnc2)=O)c1Br,0 F1113-0003,O=C(c1c2c3ccc1)Sc2ccc3Br,0 Z2632550560,CN(CC1)CCC1N(Cc1ccccc1)C(C(CO)c1ccccc1)=O,2 F6792-1050,CSc1nc(N(CC2)CCN2c2ncncc2F)cc(C(F)F)n1,0 F6774-4072,COc(cn1)cnc1OC(CC1)CN1c1ccnc2ccccc12,2 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F5831-8514,O=C(NCCN(CC1)CCN1c(cc1)ccc1F)Nc(cc1)cc2c1OCO2,2 Z2256285113,COc1c(CCNC(C2CCC2)=O)ccc(C(O)=O)c1,0 K261-1180,CC(c(cc1)ccc1N(C(N(CC(c(cc1)ccc1Cl)=O)c1c2cccc1)=O)S2(=O)=O)=O,0 F3095-4476,Cc1cc(C)c(C(Nc(cccc2)c2C(OC)=O)=O)c(C)c1,0 F5033-7099,COc1cccc(NC(NCC(CC2)CCN2S(C2CC2)(=O)=O)=O)c1OC,2 L107-0444,O=C(CN(C=CC=C1c2nc(-c(cc3)ccc3Br)no2)C1=O)N(CCC1)c2c1cccc2,2 F6565-1171,Cc(cc1)cc(OC)c1OCC(NCCN1N=C(C(F)(F)F)C=CC1=O)=O,0 L690-1151,Cc1noc(CN(C=Nc2c3n(CC(NCc4ccco4)=O)c(cc4)c2cc4OC)C3=O)n1,0 F9995-2628,COc1ccc(C(c2nc(cccc3)c3s2)O)cc1,2 C660-0754,CN(CC1)CCN1c1cccc(Nc2c(c(-c(cc3)ccc3Cl)no3)c3ncn2)c1,2 F2758-3018,O=C(NCC(c1c2cccc1)=NN(CCN1CCCC1)C2=O)Nc1cccs1,2 F6482-2404,COCCNC(NC1CC2OCCOC2CC1)=O,2 Z4255284653,CCC(C)C(N(CCC1)CC1c1nc(CCCC#C)no1)=O,0 Z2877726607,CN(CCC1)C1c1n[nH]c(C(N)=O)c1,2 F6485-1507,O=C(c1c2OCCOc2ccc1)NC(CC1)CCC1Oc(nc1)ncc1F,2 P664-0044,CCC(C(N(CC1)CCN1c1nc2nncn2c(C)c1)=O)c1ccccc1,0 F6192-0185,CCOc1c(C(NCC(c2ccco2)c2ccco2)=O)c2ccccc2cc1,2 L053-0123,Cn1c(N(CC2)CCN2C(Nc(c(OC)c2)cc(Cl)c2OC)=O)nc2c1cccc2,0 D078-0174,Clc1c(Cn2c(cccc3)c3nc2C2OCCC2)cccc1,0 F6656-1288,O=C(c(ccc(Cl)c1)c1Cl)N1CC(CN2N=C(C3CC3)C=CC2=O)C1,2 F6167-0062,O=S(c(cc1)ccc1OC(F)(F)F)(N(CC1)CCN1c1ncnc(-c2ccccc2)c1)=O,0 V029-7644,N#Cc1ccc(Cn2c(C(N(C3CC3)C(N3c(cc4)ccc4F)=O)=O)c3nc2)cc1,0 Z1698602513,CN(CC(OC)=O)C(CCC(c(cc1)cc(CC2)c1NC2=O)=O)=O,0 Z2976158695,CC(C)(COc(ccc(Nc1ncnc2c1cn[nH]2)c1)c1N1C)C1=O,2 S248-3824,Cc1cc(C(F)(F)F)nn1CC(N1CC(Cc2noc(C3CCOCC3)n2)CC1)=O,2 Z1433789963,CN(C)C(c(cc1)cc(NC(N(CC2)CC2Oc2ncccc2)=O)c1OC)=O,0 Z3063547013,CN(C)[C@@H](CCC1)[C@H]1NS(Cc1ccccc1)(=O)=O,2 Z1687449547,Cc1c(C(CC2)CCN2c(ccnc2)c2C(N)=O)c(cccc2)c2[nH]1,2 S932-4258,Cn1c(C(N(CC2)CC2n2nnc(COc3nccnc3)c2)=O)ccc1,2 F6171-0165,Cc1nc(-c2cccc(NS(CCOc3ccccc3)(=O)=O)c2)cs1,2 F0111-0135,NC1=[N+](CC(c2ccccc2)=O)Cc2c1cccc2,2 F6685-8742,CN(C(C=C(N1)N2CC(COc3c(C(F)(F)F)cccn3)CCC2)=O)C1=O,0 Z1197798735,c1cc(-c2nc(-c3ccncc3)no2)cc(Nc2ncccn2)c1,2 F2971-0108,O=C(c1cccs1)N(CCCn1cncc1)c(sc1ccc2)nc1c2Cl,0 Z394504822,Cc1nnnn1-c1cccc(NC(c(cccc2)c2OCC(N(C)C)=O)=O)c1,0 F516-0016,Cc1cccc(-c(cc2)nnc2Nc(cc2)ccc2C(NC2CCCC2)=O)c1,2 8015-4014,CC(C)(CC(N(Cc1ccco1)C1=O)=C2C1(C(F)(F)F)NC(c(cc1)ccc1F)=O)CC2=O,0 Z1410236521,O=C(Nc(cc1)cc2c1nc(Cc1ccccc1)o2)N1CCSCC1,2 Z4526301157,CN(Cc([nH]1)nc(C(N2C)=O)c1N(C)C2=O)CC(N1)=CC=CC1=O,2 F3308-1227,CCN(CC1)CCN1C(CN)c(cc1)ccc1OC,0 F6178-7189,Cc(cc(cc1)F)c1S(NCC(CC1)CCN1C1CCOCC1)(=O)=O,0 V019-7671,O=C(c1ccco1)N(CCN1CCOCC1)Cc(n1CC2OCCC2)cnc1S(Cc1ccccc1)(=O)=O,2 Y020-6508,O=C(CC(C(NC1C2CCCC1)=O)N2C(NC1CCCCC1)=O)N(CC1)CCN1c1ccccc1,2 8015-6489,O=C(C(c1c2cccc1)=NNC2=O)NCC1C(CC2)CC2C1,2 Z3687017046,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(c1cc(NC2CCC2)ncc1)=O,2 E589-0948,CCC1Sc(ccc(S(CCC(NC2CCC(C)CC2)=O)(=O)=O)c2)c2NC1=O,0 G514-0182,O=S(c1cccs1)(N(CCC1)c2c1ccc(NS(c1cccc(Cl)c1)(=O)=O)c2)=O,2 F6400-1251,CN(C(C=C1)=O)N=C1C(N1C(CN2CCOCC2)CSCCC1)=O,2 Z3999225801,NC(C(c1ccccc1)NCC(COc(cc1)cc(CC2)c1NC2=O)O)=O,2 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Z1987220074,O[C@H](CC1)CC[C@@H]1NC(c1cc2ccncc2nc1)=O,0 F6478-0376,O=C(N(CC1)CC1Oc1ncccn1)OC1CCOCC1,2 L367-0037,O=C(c(cc1)ccc1-c1cnc(N2CCCC2)nc1)Nc1cccc(Cl)c1,0 Z2376963208,CC(CC(C1)C(O)=O)CN1C(NCCNc1nccc(C(F)(F)F)n1)=O,2 Z4617323933,Nc1nc(cc(cc2)C(N(CC3)CC3(C(F)(F)F)O)=O)c2o1,0 S722-2455,COc1ccc(C2(CC2)C(N2CCC(Cc3ccc(CN4CCCCC4)cc3)CC2)=O)cc1,0 Z2504079851,OC(C1(CCCC1)NC(Cc1c(C(F)(F)F)ccnc1)=O)=O,0 S423-0875,OC1CC(CC2)(CCN2C(c2nccc3ccccc23)=O)OCC1,0 SD07-0899,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(c2cccn2C)=O)C2)n2nn1)=O,2 Z1408710264,CCOc(c(C(N1C(C)CCC1C)=O)ccc1)c1F,0 F6111-2138,N#Cc1ccc(COCC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)cc1,0 SC66-0727,Cc1ccc(C(N(C2)CC3(CCOCC3)C2c2nncn2CC2CC2)=O)s1,2 Z338289492,O=C(CN1N=C(CCCCC2)N2C1=O)Nc1ccnn1Cc1ccccc1,0 F6681-8863,Cc1nnc(cc2)n1nc2N1CC(COc(nc2)ncc2Br)CCC1,2 D389-0692,CN(c1c(C(N2CCN3CCOCC3)=O)n(CCCN3c(cc4)ccc4Br)c3n1)C2=O,0 F6514-7797,O=C(Cc1cccc(C(F)(F)F)c1)NCCn1nccn1,0 F6525-6828,O=C(c(s1)ccc1Cl)NCCn1ncc(-c2ccco2)c1,2 F6782-7226,CC(C)(C)OC(NCc1cn(CC2CCC2)nn1)=O,2 Z4873473268,COc1cccc(-n(cc2)nc2-c2nc(-c3n[nH]c4c3cccc4)no2)c1,0 SA49-1444,O=C(Cc1c[nH]c2c1cccc2)N(C1)CC11OCC(CC(N2CCOCC2)=O)C1,2 F6540-5437,Cc1csc(N(C2)CC2N2CC(CCC3)C3C2)n1,2 F6747-5903,CC(C)c1nccn1CC(C1)CN1c(c(C#N)c1C)nc(C)c1Cl,0 SC76-0541,Cc1nn(C)c(CNC(CN(C([C@]2(COc3ccccc3)[C@H]3C2)=O)c2c3cccc2)=O)c1,0 SD07-0891,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(NC2CCCC2)=O)C2)n2nn1)=O,2 Z3082409508,Cc(n(C)nc1C(Nc2c(N(C)C)ncnc2)=O)c1Br,2 F6540-9063,O=C(CN1N=CC=CC1=O)N(CC1)CCC1C(F)(F)F,2 Z2360803941,O=C(NCC1CCNCC1)NCc(cc1)cnc1OCC(F)(F)F,0 F6796-0963,Clc(cccc1)c1Nc1ncnc2c1ncn2C1CC1,2 Z2847131086,CC(c(cccc1)c1OCc1cn(CCC(F)(F)F)nn1)O,2 F2806-0065,O=C(c1cc(CCCC2)c2cc1)Nc(cc1)cc2c1ncs2,2 F5448-0348,O=C(c1csc(Nc(cc2)ccc2OC(F)F)n1)NCC1OCCC1,2 F6359-3479,O=C(Nc(cc1)cc2c1OCO2)N(CC1)CCC1Oc1nnccc1,2 SD62-0084,O=C(CCC(C1)C2(CCC2)CN1C(c1ncncc1)=O)N1CCOCC1,2 C429-0484,CC(c(ccc(NC(c1c2cccc1)N(Cc(cccc1)c1Cl)C2=O)c1)c1O1)=CC1=O,2 Z2527329575,Cn1ncc(Cn2nnc(CCN3CCCCC3)c2)c1,2 F6492-0386,Cc(ccnc1)c1NC(C(CC1)Cc2c1[nH]cn2)=O,0 Z1210099279,CC(C)N(C)S(c1ccc(CNC(c2c(C3OCCC3)ocn2)=O)cc1)(=O)=O,0 Z1128316900,CCc1c(C)cc(C(NCc2nc(C)no2)=O)s1,0 Z1270092246,Cc1nccc(N(CC2)CCN2C(c2ccccc2)=O)n1,0 Z2221563120,Cc1nccc(CCC(Nc2n[nH]c3c2c(-c2ccccc2)nn3C)=O)n1,2 Z4310357461,CN(CC1)CCN1S(c1cc(NC(NC(CCO)c(cccc2)c2F)=O)ccc1)(=O)=O,0 Z5027823033,Cc1noc(C)c1S(NC([C@H](C[C@@H](C1)C2)C[C@H]1C[C@H]2O)=O)(=O)=O,2 Z393237746,CN(C(C1(CC1)c1cccc(Br)c1)=O)c1nccs1,0 L866-1129,CS(c(cc1)ccc1NC(CN(c(cccc1)c1N=C1CCC(NC2CC2)=O)C1=O)=O)(=O)=O,2 Y205-7567,CC(C(Nc(scc1)c1C(N1CCOCC1)=O)=O)Oc(ccc(F)c1)c1Cl,2 F6660-0569,Clc1ccc(CNc2ncnc3c2oc2c3cccc2)cc1,2 C759-0205,O=C(CC1Oc(cccc2)c2NC1=O)NCCCN(CC1)CCN1C1CCCCC1,2 Z2310924465,COC(CC1)CCC1NC(NC(C1CC1)C1CCC1)=O,2 F6127-0009,OCC(CC(C1)NC(c(cc2)ccc2-n2cccc2)=O)C1O,2 Z1505901585,CC(C)(C1)[C@H]1C(NCc1c(C)nc(C)s1)=O,0 F3145-3790,CCc(cc1)ccc1OCC(NCCC1=CCCCC1)=O,0 Z2770576404,OCC(CNc1nn2c(-c3ccncc3)nnc2cc1)C1CC1,2 Z1716742643,Cc(cc(cc1)Br)c1S(NCCc1nnc[nH]1)(=O)=O,0 V030-7236,CCC(C)c1nc(C)c(Cc2ccc(C)cc2)c(N(CC2)CCN2C(CC)=O)n1,0 F6363-0138,O=C(COc(cc1)nnc1-n1nccc1)N(CC1)CCN1c(cc1)nnc1N1CCCCC1,2 Z2077032497,Cc1nc(Cn2nnc(C(NCc3cc(Oc4cc5ccccc5cc4)ccc3)=O)c2)no1,2 F6489-0017,O=C(c1cc(cccc2)c2[nH]1)N(CC1)CC1Oc1nnccc1,2 E912-0374,Cc(cc1)ccc1N(C)S(c(cc(CN(C(c1c2nccc1)=O)C2=O)cc1)c1OC)(=O)=O,0 3089-1033,O=C1N(Cc2ccccc2)C(/C=C/c2cn(Cc3ccccc3)c3c2cccc3)=Nc2c1cccc2,2 Z1278429659,CC(C)Cn1ncc(NC(N2CC(CN3CCC(C)CC3)CCC2)=O)c1,0 Z1526782394,CCc1nc(NCc2ccncc2)c(ccs2)c2n1,0 F6497-0898,O=S(N1CCOCC1)(N1CC(Cc2nc(C3CC3)no2)CCC1)=O,2 F5672-0027,CS(N(CC1)CCC1C(N1CCN(CC(c2cccs2)=O)CC1)=O)(=O)=O,2 F3386-4628,Cc(c(C)c(cc1)S(Nc(cc2)ccc2Br)(=O)=O)c1OC,0 Z2997190121,CC(c1noc(-c(cc2)cc(C(F)F)c2F)n1)NC(N)=O,0 F6673-9388,CN(C1CCN(Cc2nnc(C(F)(F)F)o2)CC1)c(nc1)ncc1Cl,2 F2716-0735,CC(C)NC(CSC(N1)=NC(C)=C(C)C1=O)=O,0 F354-0073,CC(C)CCNC(CN(c(cccc1)c1N=C1C)C1=O)=O,0 S607-0282,Cn1c(C(N(CCC2)C[C@H]2N(c(nccc2)c2N2CC3CC3)C2=O)=O)ccc1,2 F2684-0100,O=C(NC1=C2CCCC1)N=C2SCc(cc1)cc(Cl)c1Cl,2 F6796-9048,Cc1cc(CN(C2)CC(C3)C2CN3c(nccc2)c2F)no1,0 D454-0348,COc(cc1)ccc1OCC(Nc(ccc(N1Cc2nc(cccc3)c3n2CC1)c1)c1Cl)=O,0 F3385-6188,CC(Oc(cc(cc1)OC)c1C1=O)=C1Oc(cc1)ccc1C(Nc1cnccc1)=O,2 F0585-2705,CCCCCn1c(cccc2)c2nc1C(Cc1ccccc1)NC(C)=O,2 F6480-6767,Cc1nccc(OC(CCC2)CN2C(NCCc(cc2)ccc2OC)=O)n1,2 L429-0847,CCc(cc1)ccc1-c1noc2c1N=CN(CCC(NC(C)Cc1ccco1)=O)C2=O,2 S531-0403,CC(C)CN(C(Cn1c2ccc1)C(NCCN(C)C1CCCCC1)=O)C2=O,2 G107-0127,COc1cccc(CN(C(C(C(O)=O)c2c3cccc2)c(cccc2OC)c2O)C3=O)c1,2 F6786-6381,N#Cc1nccnc1N1CC(COc(cc2)nnc2-c2ccccc2)CC1,2 Z1103748644,CC(C)NC(CCC1)CN1C(c1cc(S(C)(=O)=O)c(C)cc1)=O,0 Z454269168,CN(C1CCCCC1)C(c1cc(Cn2cncc2)ccc1)=O,2 F6752-2286,CC(C)(C)C(NC(CC1)CCN1c1ccnc2ccccc12)=O,0 F6543-4993,Fc(cc1)cc2c1OCCN(CC1COCC1)C2,2 S515-0692,O=C(C(Cc1cnccc1)(CCCC1)NC1=O)NCCc1ccccc1,2 Z2218975250,OC(CCC1)CCN1S(c1cn(CC(F)F)nc1)(=O)=O,0 Z1038635574,CCn1nc(C)c(C(N(CC2)CCC2C(c(cccc2)c2N2)C2=O)=O)c1C,2 SA93-0534,COCCC(CCC1)(CN1C(CCCc1c[nH]c2c1cccc2)=O)C(N)=O,0 F6543-1612,Cc1cc(N(CCC2)CC2c2nn(C)cc2)nc(C)n1,2 Z454249998,Cn(c1c2cccc1)c(C(NCCCN(CCC1)C1=O)=O)c2Cl,2 F5836-0129,O=C(c1cc(cccc2)c2o1)Nc(cccc1)c1NC(c1cccs1)=O,2 F1874-0827,COc(ccc(CCNC(CSc1c(cnn2-c3cccc(Cl)c3)c2ncn1)=O)c1)c1OC,2 Z2969206271,CO[C@@H](CCOC1)[C@H]1NC(NCc1cc(cccc2)c2s1)=O,2 L299-3704,CCc(c(-c(cc1)cc(S(Nc(cc2)cc(F)c2F)(=O)=O)c1OC)c1NC(CC2)=O)nn1C2=O,0 SB57-1090,Cc1noc(C2C(C3)(CN3C(NCCc3ccccc3)=O)CN(Cc3ccccc3)C2)n1,2 F6436-3478,O=C(CCc(cccc1)c1Br)NCCc1cocc1,0 F6435-8596,COc1cccc2c1oc(C(N(CC1)CC1S(c(cc1)ccc1Cl)(=O)=O)=O)c2,2 F6811-2006,CCN(C(C=C1)=O)N=C1N(CC1)CCN1C(N1C)=Nc(cccc2)c2C1=O,2 C271-0250,Cn1c(cccc2)c2c(C(C(C(Nc(cc2)cc(Cl)c2F)=O)c2c3cccc2)N(C)C3=O)c1,0 Y031-3785,CC(c1ccccc1)NC(C(CC1=O)CN1c1c(C)cccc1)=O,0 F6753-1986,Cc1nc2ccccc2nc1N(CC1)CCC1C(N(CC1)CCC1(F)F)=O,0 E228-3091,CN(CCNC(CCCN(c(cc(cc1)Br)c1-n1c2ccc1)C2=O)=O)C1CCCCC1,2 Y043-5573,COCCn1c2cccc(OCC(N(CC3)Cc(c4ccc5)c3[nH]c4c5Br)=O)c2cc1,2 C887-0313,CCC(n1c2cc3c1cco3)=NN(CC(N(CC1)Cc3c1cccc3)=O)C2=O,2 Z4365037678,CC(c(cc1)ccc1S(NC)(=O)=O)Nc1nn2c(-c3ncccc3)nnc2cc1,2 V027-9391,Cc(cc(cc1)Oc2ncnc(N(CC3)CCN3C(Nc(cc3)ccc3OC)=O)c2)c1Cl,0 K848-0415,CC(C)CCOc1ccc(C(C)(C(CN2CCOCC2)c2ccccc2)O)cc1,0 M179-4778,COc(cc1)ccc1N(CC1)CCN1c1cc(SCC(Nc(ccc(OC)c2)c2OC)=O)ncn1,0 Z3138319545,NC(C1)C2(CCC2)C1NC(Cc1cccc(C(F)(F)F)n1)=O,0 F0413-0001,CC(C(O)=O)NC(C(c1ccccc1)c1ccccc1)=O,0 F6792-5052,CCc1ncnc(N2CC(CN(Cc3nnc(C(F)(F)F)o3)C3)C3C2)c1F,2 Z1481899276,CC(C(NOCc1ccc(C(F)(F)F)cc1)=O)N(C(CC1)=O)C1=O,2 Z1587962688,CN(CC1)CCC1C(CC1)CN1C(NCCc1nccnc1)=O,2 Z1030005846,NC(c(ccc(NC(C(CCC1)CN1C(Cc1ccccc1)=O)=O)c1)c1F)=O,0 F2145-0411,FC(c1nc(cccc2)c2n1CC1CCNCC1)(F)F,0 Z1609504645,CC(C)(C)OCCC(C(O)=O)NC(c(cc(cc1)-c2ccccc2)c1Cl)=O,0 S700-1324,Cc1cccc(OCCc2noc(C(C3)CN3C(NCC3OCCC3)=O)n2)c1,2 F6473-6247,CC(O1)=CC(OC(C2)CN2C(Cc2noc3c2cccc3)=O)=CC1=O,2 F5833-1551,Cn1c(C(CNC(Nc(cc2)cc(Cl)c2Cl)=O)N2CCOCC2)ccc1,2 F6125-3756,O=C(C(C1)CN1C(c1nccnc1)=O)NCC1OCCC1,2 F6244-3179,CN(Cc1ccccc1)CC#CCNC(CNC(c1ccccc1)=O)=O,2 Z1140548961,CCOc(cccc1)c1NC(CN(CC1)CCN1c(cc1)nn2c1nnc2)=O,0 Z1524018485,NC(c1n[nH]c(NC(CC(c2c3cccc2)=NNC3=O)=O)c1)=O,2 F5854-0850,O=C(c1cccs1)N(Cc1cscc1)Cc1ncccc1,2 F2879-6747,COc(ccc(CCNC(C(NC1CC1)=O)=O)c1)c1OC,0 S947-0337,N#Cc(cc1)c(C(F)(F)F)cc1N(C1)C[C@@](COCC2CC2)(C2)[C@H]1CCN2C1CCOCC1,2 F5875-0091,O=C(c(cc1)cc2c1OCO2)NCCCOc1cccc2cccnc12,2 Z1894171584,CCCC(COC)(CCC1)N1C(c1cc(S(N)(=O)=O)c(C)o1)=O,0 Z2765299827,OC([C@H](CC1)N[C@H]1C(NCc(cc1)cc2c1NCCC2)=O)=O,2 F5938-0279,Cc1cc(cccc2)c2n1CCCNC(Cc1noc2c1cccc2)=O,2 Z2763053721,CCc1cc(S(N(C)CCC(O)=O)(=O)=O)c(C)cc1OC,0 SC42-0215,CCOCC(N(CC1)CCC11OCCC(Cc2noc(C3CC3)n2)C1)=O,0 G786-0950,CC(CC1)Cc2c1sc1ncnc(Nc(cc3)ccc3N(C)C)c12,0 Z2482876401,COc1ccnc(N2CCN(Cc(cc(cc3)C(O)=O)c3Cl)CC2)n1,0 C300-0332,CCN(C(CCS(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O)=O)c(cc1)ccc1F,0 G805-0730,CCC(CCCC1)N1S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O,0 F6560-0569,O=S(c(cccc1)c1OC(F)(F)F)(N(C(CC1)C2)C1CC2Oc1ncccc1)=O,2 F6556-0656,OC(CNC(c(cccc1)c1Br)=O)(CSC1)c2c1cccc2,0 S968-0290,CC(C)C(NC(C1)C1(CC1)CCN1C(c1noc(Cn2ncc(C)c2)c1)=O)=O,2 F6753-2640,COc1nc(N(CCC2)CC2C(N2CCOCC2)=O)nc(OC)c1,0 Y503-2428,CCn1ncc(S(N(CCC2)CC2C(O)=O)(=O)=O)c1C,0 SB52-0599,CN(CC(C1)(CC2)CCN2C(CC2CC2)=O)C1c1noc(C2CCC2)n1,2 F6438-2055,COc(nc(nc1)OC)c1NC(COc(ccc(Cl)c1)c1Cl)=O,0 V018-9969,CC(CN(Cc(c(C)nn1-c2ccccc2)c1Oc(cccc1)c1F)C1CC1)O,0 Z1262651069,NC(c1n[nH]c(cc2)c1cc2Cl)=O,0 F6478-1663,O=S(C1CC1)(N(CC1)CC1Oc(nc1)ncc1F)=O,2 Z2410444104,CC(C)[C@@H](C(N1CCC(Cc2nc(cccc3)c3[nH]2)CC1)=O)N(C)C,2 Z1359884018,Brc1ccc(-c2noc(CCC3COCC3)n2)o1,2 Z1938381975,CNc(cc1)ncc1C(N[C@H]1CC[C@H](CO)CC1)=O,0 SC88-1519,O=C(c(cc1)cc(F)c1F)N(C1)CC1(C(CC1)c2nc(-c3ncccc3)no2)S1(=O)=O,2 S531-0725,Cc1ccc(CNC(C(Cn2c3ccc2)N(Cc2cnccc2)C3=O)=O)o1,2 Z1852536912,CC(C)C(NC(Cc1c[nH]c2c1cccc2)C(NC(CCC1)CC1c1ccccc1)=O)=O,2 F5017-0791,O=S(c1cc(CCCC2)c2cc1)(NCC1CCN(Cc2ccco2)CC1)=O,2 F6561-5921,Cn1ncc(-c2nccc(CNC(Cc(cc3)ccc3Br)=O)c2)c1,2 Z2439961273,CN(C1CCNCC1)C(c(cc(cc1)-c2ccccc2)c1Cl)=O,2 P804-1096,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CCN1c1cc(-c2cccs2)n[nH]1,2 SB36-0792,CC(C)C(N(C1)[C@H](Cn2nnc(C(NCCOC)=O)c2)CC1(F)F)=O,0 F6284-0108,O=C(C1Oc(cccc2)c2OC1)NCCc1cncnc1,2 Z3655223784,Cc(c(C(NCC(CC1)(C2)OCC12C(O)=O)=O)c1Cl)nn1-c1ccccc1,2 F6495-4391,CC(c1ccccc1)NC(C(C1)CN1c1ncnc(-n2cncc2)c1)=O,2 F2564-0180,O=C(CSc(cc1)nnc1-c(cc1)ccc1-n1nccc1)N(CCC1)c2c1cccc2,2 V007-1118,CC(c1ccccc1)NC(CCN(Cc1ccccc1)c1nc(-c2ccco2)nc2ccccc12)=O,2 F5835-0303,COC(c(cc1)ccc1C(Nc1cc(-c2n[nH]cc2)ccc1)=O)=O,0 Z991508248,COCCC(C(O)=O)NC(CSc(cc(cc1)Cl)c1Cl)=O,0 Z2187849027,CC(C)C(CNC(c1cc(Br)cc(C(O)=O)c1)=O)OC,0 3966-0199,COc(cc1)ccc1NC(CN(C(C1C2CC(Cl)=CC1)=O)C2=O)=O,0 F6679-2721,Cc1nnc2n1ccnc2N(CC1)CC1Oc(ccnc1)c1Br,2 SB04-0276,CN(CCN(C(CC1)CN1C(C1CC1)=O)C1CCOCC1)C(c(ccc(F)c1)c1F)=O,2 K781-5439,O=C(CSc1nnc(c(cc(cc2)S(N3CCCCC3)(=O)=O)c2[nH]2)c2n1)Nc(cc1)cc2c1OCCO2,2 Z2976432403,Cc1ccnc(N(CC2)CCC2c(cc2)ccc2S(N)(=O)=O)n1,0 3664-0044,CC(C)(C1)CC(N(C(CC2c3ccccc3)=O)c(cc3)ccc3OC)=C2C1=O,0 F6556-9059,COc1cccc(NC(NC(c2cscc2)c2cccs2)=O)c1OC,0 F6550-3344,N#Cc(cc1)ccc1S(N(CC1)CCC1=C1CC1)(=O)=O,2 Z2290369794,CC(C)(c1nnc2n1CCCC2)NC(Nc(cccc1)c1-c1ccccc1)=O,2 Z2851965659,Cc1c(C)nc(-c2ccncc2)nc1N(C1)CC1(C1)NCCNC1=O,2 Z1207232918,COc(cccc1)c1-c1cc(C(NCC2N(Cc3ccccc3)CCC2)=O)no1,2 SC45-0715,CC(C)C1n2nnc(CNC(C3(C)CCCCC3)=O)c2CNC1=O,2 F2879-0214,O=C(C(NC1CCCC1)=O)NCCCN(CCC1)C1=O,2 SC23-0495,Cc(cc1)c(C)cc1NC(N(C1)CC1N(CCc1noc(C2CCC2)n1)S(C)(=O)=O)=O,2 F6515-0653,O=C(CCCC(NCc1cc(-c2cccs2)ncc1)=O)c1ccccc1,2 Z4104734268,COc(cccc1)c1-c1cccc2c1oc(C(NC1CCOCC1)=O)c2,2 Y041-0868,Cc1noc2nc(C)cc(C(NCCCOC)=O)c12,0 F0415-0058,C(CSCCc1nc(cccc2)c2s1)c1nc(cccc2)c2s1,2 E786-0493,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(CCC(Nc(cc1)ccc1F)=O)(=O)=O,0 Z1023740240,Cc(ccc(Cl)c1)c1N1CC(CNC(Cc2c[nH]c(cc3)c2cc3OC)=O)CC1,2 K221-3160,CC(CCC1)C(C)C1NC(C1CCC(CN(C(c(cccc2)c2N2)=O)C2=O)CC1)=O,2 Z2771045210,CCC(CC)(CC1)CN1C(c1nc(C)no1)=O,2 SB75-0222,CCn1nccc1C(N[C@H](C[C@H]1CN(C2)S(C)(=O)=O)C[C@]12c1nc(C)no1)=O,0 F6186-0102,CC(CNC(c1cccc2ccccc12)=O)(CSC)O,0 Z253-0495,Cc1c(C(Nc(c(OC)c2)cc(Cl)c2OC)=O)c(N=CN(C2CC2)C2=O)c2s1,2 S614-0768,O=C(NC1CCCCC1)N(CCCC1)C1c1nc(CCOCC2CC2)no1,2 Z1269173725,OC(c1cc(c(F)c(cc2)Cl)c2[nH]1)=O,0 Z1238976441,O=C(c(cc1)nnc1N(CCC1)CCN1c1nnccc1)Nc1ccccc1,2 G217-0068,CCCNC(c(cc1)ccc1NC(N(CCCC1)c2c1cccc2)=O)=O,2 F6667-1819,Cc1c(C(Nc(cc2)cc(OC)c2F)=O)c(C)nn1C,0 F6478-2226,Cc(s1)ccc1S(N(CC1)CC1Oc(nc1)ncc1Br)(=O)=O,2 Z3992152014,OCC(CNC(c1c(cccc2)c2ns1)=O)c(cc1)ccc1F,0 Z1506277117,Brc1cc(Cc2noc(CN3CC(CC4)(c5c4cccc5)OCC3)n2)ccc1,0 Y042-4763,O=C(C(C1)CN(Cc2ccco2)C1=O)Nc1nnc(COc2ccccc2)s1,2 L697-1147,O=S(c1cn(Cc2noc(-c3cccc(Br)c3)n2)cn1)(N1CCOCC1)=O,0 F5854-0554,O=C(c1cccs1)N(Cc1ccco1)Cc1ncccc1,2 Z3137439756,Cn1cnc(CNC(c2cc(C(CN)CCC3)c3cc2)=O)c1,2 F0674-0076,O=C(CSc1ncnc2ccccc12)NCC1OCCC1,2 Z2300961036,CN(CC(O)=O)S(c(c(OC)c1)cc(Cl)c1OC)(=O)=O,0 F6036-0301,O=C(c1cc(Br)cnc1)N(C1)CC1c1nc(-c2ncccc2)no1,2 Y041-8163,Cn1c(cccc2)c2nc1C(CCC1)N1C(c1c(CCC2)c2n[nH]1)=O,2 Z4950571186,O=C(c1csc(-c(c(F)ccc2)c2F)n1)Nc1n[nH]cc1C1CC1,0 Z3133108198,N[C@H](C1)[C@@H](C2)[C@H]1CC2C(N1Cc2c(C(F)(F)F)cccc2CC1)=O,0 F6517-3937,OC(CNS(c1cc(C(F)(F)F)ccc1)(=O)=O)c(cc1)ccc1-c1ccco1,0 Z3301016785,CCOCC(N(CCC1)CC1(C(O)=O)O)=O,0 Z2003441333,CCc1c(CN2CC(c3nnc(C)o3)OCC2)ccc(OC)c1,0 E823-0130,O=C(CCc1nc(CN(CC2)CCN2S(c2cccs2)(=O)=O)no1)N1CCOCC1,2 F5599-0238,CCOCC(Nc1nn(C)c(N2)c1C(C)CC2=O)=O,2 SD06-0819,COCC(N[C@@H](C[C@@H](COc1ccccc1)C1)[C@H]1C(NCc1ccco1)=O)=O,2 Z2916718147,O=C(NCCc1cc2ccccc2nc1)NC1CC1,2 F6520-1639,O=C(Cc(cccc1)c1Cl)NCCc1ccc(-c2cocc2)s1,2 F6526-0176,Cn(c(C(N1Cc2cc(C3CC3)nn2CC1)=O)c1)nc1-c1ccccc1,2 SA01-0818,CN(C)C(c1cnc(N(C)C)nc1C(CC1)CN1C(c1cccs1)=O)=O,0 Z2094738566,Cc1noc(C(CCC2)N2c2nc(C)nc3c2CCCC3)n1,2 S606-1415,O=C(Cc1cnccc1)N(CC1)C[C@@H]1N(c(nccc1)c1N1CC2CCCCC2)C1=O,2 SB52-1450,CC(C)c1nc(C(C2)N(C)CC2(CC2)CCN2C(c2nccnc2)=O)no1,2 S431-0516,CN(Cc1ccccc1)C1CC(CC2)(CCN2S(c(cc2)ccc2F)(=O)=O)OCC1,2 G423-0140,O=C(CCCc1nnc2n1C=CN(c(cc1)ccc1Cl)C2=O)NCCc1c[nH]c2c1cccc2,0 F6094-0683,O=C(CN1N=CC=CC1=O)NCCOc(cc1)nnc1-c1ncccc1,2 Y042-2984,COc1c(CN(C(C(CC(O)=O)N2)=O)C2=O)cccc1,0 D445-0715,CC(CS(N1c(cc2)ccc2S(NC2CC2)(=O)=O)(=O)=O)C1=O,0 Z1730480675,Cc1noc(NC(NCCc2cncn2C)=O)c1,2 Z2795227715,OC(C(C1CC1)N1CCN(CC(N2CCCCCC2)=O)CC1)=O,2 F5033-0951,O=C(Cc1cccc2ccccc12)NCC1CCN(Cc2cccs2)CC1,2 S591-0274,Cn1nc(C(N(C2)CC2N(CC2CC2)C2CCOCC2)=O)c2c1cccc2,0 F6560-0256,O=C(Cn1nnc2c1cccc2)N(C(CC1)C2)C1CC2Oc1ncccc1,2 Z2156994976,FC(C1(CCCC1)c1nc(-c2c(cc[nH]3)c3ccc2)no1)F,0 F6497-7892,O=C(c1cc(C(CC2)CCN2C(c2nc3ccccc3cc2)=O)n[nH]1)NCC(F)(F)F,2 S577-0229,O=C(C1CCC1)N(C[C@H](C1)Oc2ccccc2)[C@H]1C(N1CCOCC1)=O,2 P223-0956,CN(CCCn1nc(C(CCC2)CN2S(c(cc2)ccc2OC)(=O)=O)cc11)C1=O,0 SD56-0784,CC(C)N1CCC(CC(N(CCC2)CC(C(N3C4CCCCC4)=O)N2C3=O)=O)CC1,2 Z2643615323,Cn1nc(C(F)(F)F)cc1C(NCc1c(N2CCCC2)nccc1)=O,2 E456-0711,CC(C)CN(C(C(C(N1CCCC1)=O)c1c2cccc1)c1cccs1)C2=O,2 F6783-6359,Cn1c(N(C2)CC(C3)C2CN3c(nccc2)c2F)nc2c1cccc2,2 S649-0364,Cc1ccc(CN(CC2)CCC2N(C2)C3(CCCCC3)C2OCC2CC2)o1,2 F3098-7306,CC(C)c(cccc1)c1NC(CCCOc(cccc1)c1OC)=O,0 D389-0938,CC1CN(Cc2ccccc2)c2nc(N(C)C(N(CCN3CCCCC3)C3=O)=O)c3n2C1,2 Y041-6825,Cc(nc1nc2)nn1c(C=CN1CC(NCC3CCOCC3)=O)c2C1=O,2 Z281015852,CNC(COc(cc1)ccc1Oc1ncccc1)=O,0 Z1751249661,CC(C)c1ccc(Cn2nccc2NC(N(C)C(C)CCSC)=O)cc1,0 F5621-0394,COC(c1ccc(CN2CCN(Cc3nc(cccc4)c4n3Cc3ccccc3)CC2)o1)=O,2 F2834-0188,O=C(c1c2cccc1)N(CCS(N(CC1)CCN1c(cccc1)c1F)(=O)=O)C2=O,2 Z3000414677,O=C(c1c(C(F)(F)F)n(-c(cc2)nnc2Cl)nc1)NCC1(C2)C2CCCC1,2 Z4099422954,O=C(C1OCCCO1)Nc1c(C2CC2)ncs1,2 F3411-3005,CC(C)(C)OC(N(CC1)CCC1(N1)N=C(c2cccs2)C1=O)=O,2 F6444-0588,O=C(Cc(cccc1)c1Cl)N(CC1)CCC1N1C(COCc2ccccc2)CCC1,0 Z1071348406,Cc1cc(NC(N2CC(c(cc3)cc(Cl)c3Cl)OCC2)=O)no1,0 Z2991905833,CC(C)(c1nn(Cc2cnc(C)s2)nn1)S(C)(=O)=O,0 F5496-0202,COc(cccc1)c1-c1nnc(C(CC2)CCN2C(C2CC2)=O)s1,2 Z1531182955,CC(C)(C(NCC(C(OC)=O)Oc(cc1)ccc1F)=O)c1ccccc1,0 SB21-1139,O=C(c1cn(C[C@H](C[C@@H](C2)F)N2C(c(cc2)cc(F)c2F)=O)nn1)N1CCCC1,0 F6108-0214,COCCN(CC1)CCC1NC(c(s1)ccc1Cl)=O,0 F6523-3362,O=C(c(o1)ccc1Br)NCCN(Cc(cc(cc1)Cl)c1OC1)C1=O,2 F6515-0826,O=C(c1cc(Oc2ncccc2)ccc1)NCc1cc(-c2cccs2)ncc1,2 F6816-2899,N#Cc(cc1)nnc1N(CC1)CCN1C(C1CC1)=O,2 SB03-0180,CN(CCN(C1CCOCC1)C(CCC1)CN1S(C)(=O)=O)C(c1ccco1)=O,2 F854-0775,CCCNC(c1cccc(NC(c2nnc(CC(C)C)s2)=O)c1)=O,0 Z3026726227,Cn1nc(C(N2C3C(CO)CC2CC3)=O)c(C(F)(F)F)c1Cl,2 Z95497207,O=C(C1=Cc(cccc2)c2OC1)NCc1ccccc1,0 F0920-2315,COC(c1c(C(OC(COc2ccccc2)C2)=O)n2cn1)=O,2 Z2847062056,Cc1cc(C(Cn2nnc(CN3CCOCC3)c2)O)cc(C)c1,0 F6523-3762,O=C1N(C=CC=C2)C2=NC(CC2)=C1CN2S(N1CCOCC1)(=O)=O,2 Z4158195294,FC(c1nnc(cc2)n1nc2N1[C@@H](COc2ccccc2)CCC1)F,0 Z1744542703,CC(C)c1cc(C(CC2)NC(c3cc(S(N)(=O)=O)c(CCC4)c4c3)=O)c2cc1,2 SA41-0198,Cc1noc(C)c1COc(cc1)ccc1C(N(C1)CC11CN(C)C(COC)C1)=O,2 Z2667692204,CC(CC1)C(CO)CN1C(C(c1c2cccc1)=CNC2=O)=O,2 Z1324461149,O=C(C(C1)C11CCCC1)Nc1nn(Cc2ncccc2)cc1,2 S893-0015,O=S(Cc1ccccc1)(N(CCC1)C1c1n[nH]c2c1COCC2)=O,2 F6676-0578,Cc1c(C)ncnc1N1CCC(COc2cccc(C(F)(F)F)n2)CC1,0 Z2975221150,Cc1ccnc(N(C)CC(c2cnccc2)O)n1,0 D300-0002,CN(c(ccc(COc1ccc(CNC2CCCCC2)cc1)c1)c1N1C)C1=O,2 F6515-4573,O=C(c1cc(OC(F)(F)F)ccc1)NCc1cc(-c2cccs2)cnc1,0 V001-6492,CCN(C(CN1CCC(N2CCN(CCOC)CC2)=O)=C(C(c(ccc(Cl)c2)c2Cl)N2)C1=O)C2=O,0 F6374-0154,Cc1cc(C(N2CCC(CSc3ncccc3)CC2)=O)c(C)o1,2 F6125-1846,CCOC(CNC(C(C1)CN1C(COc(cccc1)c1F)=O)=O)=O,0 K786-1201,CCN(C(c1c(C)c(cc(cc2)S(N3CCCCCC3)(=O)=O)c2o1)=O)c1ccccc1,2 F6554-5651,CC(C)(C)NC(CCC(N(C1)CC1C(F)F)=O)=O,0 F6125-3824,CSc(cccc1)c1NC(C(C1)CN1C(c1nccnc1)=O)=O,0 Z295540162,Cc(cc(cc1)Cl)c1OCC(NCc(cc1)cnc1-n1cncc1)=O,0 Z3216005736,Nc1nc(C(C(N(CC2)C[C@@H]2F)=O)(F)F)cs1,2 S651-0552,CN(CC(C1)(CC2)CCN2C(c2nc3ccccc3cc2)=O)C1C(N1CCOCC1)=O,2 F3139-0716,COc(ccc(-c1cc(-c(cc(cc2)F)c2O)n[nH]1)c1)c1OC,0 SD67-0220,CC(C)CN(CC(N(CCC1)C2CN1C(c1ncc(C)nc1)=O)=O)C2=O,2 Z1688438325,CCOC(CC1NC(c2cc(-c(cc3)ccc3Br)n[nH]2)=O)C1OC,2 F6802-9525,O=C(CN(CC1)CCC1Oc1nccs1)Nc(cccc1)c1F,0 F6783-8165,Cc1cc(C(N(CC2)CCN2C(NC2=O)=NC(C3CC3)=C2F)=O)nn1C,2 F2204-0575,Cn(cc1C(NCCc2c[nH]c3c2cccc3)=O)c(C(N2Cc3ccccc3)=O)c1NC2=O,2 SB95-1369,CS(N(CCN1CCOCC1)C(CCC1)CN1C(NCc(cc1)ccc1F)=O)(=O)=O,2 Z2640146088,OC(C(N(C1)Cc2c1cn[nH]2)=O)c1cccc(C(F)(F)F)c1,0 S616-2195,COc(ccc(CN(CC[C@H]1C2)C[C@@H]1N2S(C)(=O)=O)c1)c1OC,0 F6761-7719,COCc1nsc(N(CC2)C(C3)C2CN3c2nccc(C(F)(F)F)c2)n1,2 F5788-0796,O=C(CN(CCN1c(cc2)ccc2F)C1=O)NCc1cccs1,2 F6451-1857,CC(c1cccc(S(NCC(c2c(C)cccc2)OC)(=O)=O)c1)=O,0 F6660-3199,CCOC(c(c(C)n[nH]1)c1S(N1CCCC1)(=O)=O)=O,0 F2490-0057,C(C1)c(cccc2)c2N1c1nc(N2CCOCC2)nc(N2CCOCC2)n1,2 Z4909204335,CC(C)c(cc1)ccc1-c1nc(C(N(C2)C3(CCC3)CC2N)=O)cs1,2 Z1262413669,CNC(c(cc1)nnc1NCC(c(cccc1)c1Cl)N1CCOCC1)=O,0 CM3542-2908,CN1CCN(CC(CC2)OC2(CC2)CCN2S(c2ccccc2)(=O)=O)CC1,0 SA49-0145,COc1c(CCC(N(C2)CC22OCC(CC(NCC3CC3)=O)C2)=O)cccc1,0 SD01-0287,Cn1ncc(CN(CC2)Cc3c2n(CC2CC2)nc3-c2cocn2)c1,0 G939-1717,Cc1noc(-c(cc2)cc(C)c2S(N(CCC2)c3c2cccc3)(=O)=O)c1,0 Z1529012232,O=C(CCc1ccccc1)N(CCC1)CCN1C(CCn(cc1)c(cc2)c1cc2Cl)=O,2 SD07-0161,CC(C)C(NCc1c(COC(CC2)(CN2C(c2ccc(C)s2)=O)C2)n2nn1)=O,0 F6436-3379,CC(CNC(CCc(cccc1)c1F)=O)(c1ccco1)O,0 Z3016340258,CN(CCN(C1)C(C2NCc3n[nH]cc23)=O)c2c1cccc2,2 F2517-0570,CCOc(ccc(-c1nnc(NC(C2CC2)=O)o1)c1)c1OCC,0 F6203-0564,OCCC(CCNC(c1cccc(Cl)c1)=O)c1cccs1,0 F5323-0127,Cn1nc(CCC2)c2c1NC(CCCSc(cc1)ccc1OC)=O,2 Y020-0423,COc1cccc(N(C(CC2N(CC3)CCN3c3cc(OC)ccc3)=O)C2=O)c1,0 Z2882520137,CN(CC1)Cc2c1[nH]c(cc1)c2cc1C(Nc1c[nH]nc1C1CC1)=O,2 Z1420984728,CCN(Cc1cccc(C(N)=O)c1)C(c(nc1C)nn1-c1c(C(C)C)cccc1)=O,0 F0630-1631,CC(C(N1C(SCc(cccc2)c2F)=NCC1)=O)Oc1ccccc1,0 8640-0257,CC(C)(C1)OCc2c1c(C(NC(c1cnccc1)N1)=O)c1s2,2 F6480-2362,CC(N(CC1)CCC1C(N(CCC1)CC1Oc1ncccn1)=O)=O,2 Z1333156741,Cn1c(C(CCC2)CN2c(nc2)ncc2Cl)nnc1,2 F6679-0262,CC(Nc1ccc(CN(C2)CC2n2c(cccc3)c3nc2C2CC2)cc1)=O,2 Z1583754757,CC(C)Oc(cc1)ccc1S(N1c2ncnn2CCC1)(=O)=O,0 F541-0725,CC1=Nc(cc(cc2)-c3noc(COc(cc4)ccc4F)n3)c2N(C2CCCC2)C1=O,0 V006-4088,O=C(c1csc(CN(CCC(c2ccccc2)c2ccccc2)Cc(cccc2)c2F)n1)NC1CC1,0 F3375-1300,Cc1cccc(NC(Cn2nnc(-c3ccccc3)n2)=O)c1,2 G346-0348,CC(C)NC(C1CCC(CN(C(c(scc2)c2N2Cc(cc3)ccc3C#N)=O)C2=O)CC1)=O,0 F1016-0301,Cn1c(SCC(Nc(cc2)ccc2Br)=O)nnc1,0 Z4916288521,CC(C)CC(CCO)CNC(c(cc(CCCC1)c1c1)c1O)=O,0 F6672-0014,O=C(C(C1)CC1(F)F)N(C(CC1)C2)C1CC2n1nccc1,2 F5485-0975,CC(N=C(N1)SCc2ccccc2)=C(CC(N(CC2)CCN2c2ncccn2)=O)C1=O,2 D337-1102,CC(C1)Oc(cc2)c1cc2-c1cc(C(Nc2c(C(NC)=O)c(CCCC3)c3s2)=O)no1,2 F2004-0142,O=C(CSc(cc1)nnc1-c1ccco1)Nc(ccc(F)c1)c1F,0 F2372-0468,COc1ccc(CCNC(NCC(C2)CN(Cc(cc3)ccc3F)C2=O)=O)cc1,2 SA54-0843,Cc1nnc(C(CN(CCC2)C(c3cocc3)=O)N2C(c2ccccc2)=O)o1,2 C301-7848,CCN(c(c(N1CC)c2)cc(NC(c(cc(cc3)Br)c3OC)=O)c2N2CCCC2)C1=O,0 F5688-0062,O=C(NCCN1N=C(c2ccccc2)N(C2CC2)C1=O)Nc(cccc1)c1Cl,2 F6773-2936,Cc1csc2c(N(CC3)CCC3Oc3nccs3)ncnc12,2 F5854-0917,COc1ccc(CCC(N(Cc2cscc2)Cc2ncccc2)=O)cc1,2 F6671-3012,CC(C)(C)c1cn(C(CC2CC3)CC3N2C(Nc(ccc(OC)c2)c2OC)=O)nn1,0 Z2911099816,CCC(CNC(c1cc(C)cs1)=O)(C(O)=O)c1ccccc1,0 Z2285635330,CC(c(cc1)ncc1Oc1ccccc1)NCC(Cc1ccccc1)CO,2 S696-1523,Cc1cnc(-c2ccncc2)n1CC(C1)CN1C(NC)=O,0 F6510-1185,CN(c(cccc1)c1N1CCNC(NCc(cc2)ccc2Cl)=O)S1(=O)=O,2 Z2635749685,CCc1c(C)ccc(NC(C(CCC2)CN2S(N)(=O)=O)=O)c1,0 F6184-1288,O=C(NCCOc1ccccc1)N(CC1)CCC1c1cscc1,2 8640-0255,CC(C)(C1)OCc2c1c(C(NC(c(cc1)ccc1Br)N1)=O)c1s2,0 F6515-0188,O=C(c1cc(-c2ccccc2)n[nH]1)NCc1cccnc1-c1cscc1,2 M350-0751,COc(cc1)ccc1-c1nnc(COc(cc2)ccc2NC(C2=Cc(cccc3)c3OC2=O)=O)o1,0 Z2960705164,CCc(ccc(Br)c1)c1C(NC1(COCC1)C(N)=O)=O,0 Y050-3184,Cc(cc(cc1)S(N(C)C)(=O)=O)c1OCC(NCC1OCCC1)=O,2 F6554-0851,Cc1noc(C)c1CC(N(CCC1)CC1c1nn(C)cc1)=O,2 F6517-0161,OC(CNC(C1(CCOCC1)c1ccccc1)=O)c1ccc(-c2ccco2)o1,2 T501-0404,CC(C)n1c(CC(CCC2)CN2C(NC2CCCC2)=O)nnc1,2 Z3641516217,O=S(c1nccc2ccccc12)(N(CC1)CC11CCOCC1)=O,2 8014-1320,O=C(CCC1CCCCC1)NC(C(F)(F)F)(C(N1C2CCCCC2)=O)NC1=O,2 Z1518725488,CN(CC1)CCC1C(CC1)CN1C(Nc(cc1)ccc1C(NCCc1ccccc1)=O)=O,2 F6089-9822,OC(CNC(NC1CCOCC1)=O)(C1CC1)c1ccccc1,2 F425-0162,O=C1N(c(cc2)ccc2F)C(SCc2nc(-c3ccncc3)no2)=Nc2c1scc2,2 S632-4104,CC(N(CC1)CCC1C(CC1)CN1C(NCc1cc(OC)ccc1)=O)=O,0 L292-0152,Cc(cc1)ccc1S(NC(CC1)CCN1C(Nc(cc1)cc2c1OCCO2)=O)(=O)=O,2 SA55-3933,O=C(CCCc1c[nH]c2c1cccc2)NCCc1nn(CC2CC2)c2c1COCC2,2 Z2479113452,O=C([C@@H](C1)[C@H]1C1CCC1)NS(c1c2OCCc2cc(Cl)c1)(=O)=O,2 Z933994134,Cc1noc(C(CCC2)CN2C(NCc2cn(Cc3ccccc3)nc2)=O)n1,0 F3406-6865,COc(ccc(Cl)c1)c1NC(CN(CC1)CCC1c1nc(-c(cc2)ccc2F)no1)=O,0 P307-0887,CC(c(cc1)cc(OC)c1OC)NC(c(nc1cc2)cn1nc2Cl)=O,0 G856-8827,Cc(cc1)ccc1Nc(cc1)nnc1N(CC1)CCN1C(c1cc(C)c(C)cc1)=O,2 S652-0616,CN(C1)C(CN2CCOCC2)CC1(CC1)CCN1C(c1cccn1C)=O,2 SC04-0521,CC(C)Cc1nc(CCOC(CCC2)CN2C(Cn2cncc2)=O)no1,0 Z1738448695,Cc1c(C(CC(O)=O)NS(c2cnc3n2CCC3)(=O)=O)cccc1,2 S691-0270,Cc1cnc(CC(CC2)CN2S(c2cc(OC)ccc2)(=O)=O)n1C1CC1,2 F6464-0638,COc(ccc(C(N(CCCC1)CC1c(cc1)ccc1Cl)=O)c1)c1F,0 F3406-3466,N#CC1=CN=C(c(cc2)ccc2F)N(CC(N(CC2)CCN2c2ccccc2)=O)C1=O,2 C498-0002,CN(c(cc(cc1)Cl)c1-c1c2cc(C(Nc3nc(ccc(OC)c4)c4s3)=O)s1)C2=O,2 F6658-5849,O=C(c(ccnc1)c1F)N1CCC(COc2ncnc(C3CC3)c2)CC1,2 F6507-8230,Cc(cccc1)c1NC(NCC(CCC1)(c2c1scc2)O)=O,2 F6359-2791,O=C(c(cc1)ccc1-n1cccc1)N(CC1)CCC1Oc1nccnc1,2 Z2690350751,COC(C1Cc2nnc(C3CC3)n2CC1)=O,2 Z2179558713,Cc(cc(C)c(NC(C1C(C2)C=CC2C1)=O)c1)c1C(O)=O,0 P130-0212,O=C(NC1CCCCC1)Nc1cc(-c2nccnc2N2CCCCC2)ccc1,2 F6554-1888,O=C(COc(cc1)ccc1Cl)N1C(C2)COC2C1,2 F6666-5584,Fc1cccc(F)c1CNc(cc1)ccc1-c1ccn[nH]1,2 F6617-8393,O=C(Cn1nnc(-c2ccccc2)c1)NCC(F)(F)F,0 S968-0596,CCn1nccc1C(N(CC1)CCC1(C1)C1NS(C)(=O)=O)=O,0 D025-0047,OC(C(CN1CCOCC1)c1ccccc1)(c1ccccc1)c(cc1)ccc1Br,0 Z27212095,O=C(c1cc(-c2ccccc2)nc2ccccc12)NC1C(CC2)CCN2C1,2 Z2214292697,CC(C)CCc(cc1)ccc1NC(CCc1cncs1)=O,0 Z423926540,O=C(c1nc2ccccc2cc1)N(CC1)Cc2c1n(-c1ccccc1)nc2,2 F6485-2172,Cc1nc(OC(CC2)CCC2NC(NCCOC)=O)nc(C)c1,0 F6683-1388,Cc1c(CN2CCC(COc(ccnc3)c3Cl)CC2)cno1,2 F6513-4823,Cc(c(Nc1nc2ccccc2nc1NS(c1cn(C)nc1)(=O)=O)ccc1)c1Cl,0 D012-0388,OC(CCC1)CN1C(Nc(cc1)cc(C(F)(F)F)c1Cl)=O,0 Z1677706631,Cc(c(NC(N(CC1)CCN1c1nc(C)ncc1)=O)ccc1)c1F,0 Z1551508877,OCCC(COCC1)N1C(Cc1c[nH]c(cc2)c1cc2F)=O,2 F1043-0611,CCc1cc(c(SCC(c(s2)ccc2Cl)=O)ncn2)c2s1,2 F5854-3046,Cc1c(C(N(Cc2cccn2C)Cc2cccs2)=O)c(-c(cccc2)c2Cl)no1,2 T473-0978F,Cn1c(ccc(OC)c2)c2c(CN(CC2)CCN2c2cc3nncn3nc2)c1,0 SC73-0530,Cn1nc(C(NCC2CC2)=O)c2c1CC1(CCN(Cc3cocc3)CC1)OC2,2 M923-2880,O=C(Nc1cc(-c(cc2)nnc2N2CCCCC2)ccc1)Nc(ccc(F)c1)c1F,0 F3337-0039,CC(C)(C=C)OCC(CN1CCN(Cc(cc2)cc3c2OCO3)CC1)O,0 F6680-3322,CC1=C(C)N=C2SCC(CC(N(CCN3c4cc(OC)ncc4)CC3=O)=O)N2C1=O,2 S988-1085,CCn1nc(C)c(C(N(C[C@H]2CN(C3)S(CC)(=O)=O)C[C@]23c2nc(C)no2)=O)c1,0 SA71-0693,O=C(c1n[nH]c2c1cccc2)N(CCC1)CC1(CC1CC1)c1noc(C2CCOCC2)n1,2 F6444-6664,O=C(NC1CCCCC1)N(C1)Cc2c1cnc(N1CCOCC1)n2,2 F6481-1012,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CCSC1c(cccc1)c1Cl,0 Z1269813437,Cc1nnc(-c2cccc(C(N3CCCC3)=O)c2)o1,0 F6676-1386,Cc1nccc(OCC2CCN(Cc3nnc4n3CCC4)CC2)c1,2 Z4225443940,Cn1ncc2c1ncnc2N(CC1)CCN1C(NCCC1C(CC2)OC2C1)=O,2 S692-0440,Cc1cnc(C2CCOCC2)n1C1CN(Cc2ccc(C)s2)CCC1,2 F6195-3307,CCOC(Nc1nc(CCN(C2)C(C3CC=CCC3)=O)c2s1)=O,2 F2370-1236,COCC(NCC(C1)CN(Cc(cc2)ccc2F)C1=O)=O,0 Y044-2878,O=C(C(CC1=O)CN1c(cccc1)c1F)N1CCNCC1,0 F6125-1079,O=C(C(C1)CN1C(c1c[nH]c2c1cccc2)=O)NCCC1=CCCCC1,2 L942-0226,CCC(C)NC(CCN(c(n1-c2c3cccc2)nnc1SCC(N(CC)CC)=O)C3=O)=O,0 Z3062560836,Cn1nccc1[C@H](CN(Cc1nc(-c2ccco2)no1)C1)[C@@H]1NC(COC)=O,2 Z1424433236,O=C(C1CC1)Nc1ccc(Cc2nnn[nH]2)cc1,2 Z1006057612,CC(C(N(CC1)CCN1c(cc1)ncc1Cl)=O)N1CCN(C)CC1,2 F6658-3164,Cn1nc(cc(cc2)C(N(CCC3)CCN3c(cc3)nn4c3nnc4)=O)c2c1OC,2 F6349-0591,O=C(C1(CCCC1)c1cccs1)N(CC1)CCN1C(c1c(cccc2)n2nc1)=O,2 Z1646780542,Cc1ncc(C(CC2)CCN2C(Nc(cc2)cnc2-n2nccn2)=O)cc1,2 Z4767998356,Cc1nn(C)c(NC(c(cc2)ccc2Cl)=O)c1C(N)=O,0 Z3091842174,O[C@@H](CCNC(CC(CC1)CCC1c1ccccc1)=O)C(O)=O,0 Z1955267756,Cc1cc(Br)cc(S(Nc(cc2)cc3c2[nH]c(C(NC)=O)c3)(=O)=O)c1,0 Z1724486732,NC(C(c(cccc1)c1F)NC(c1cnc(Cc(cccc2)c2F)s1)=O)=O,0 F6808-5981,N#CC(CC1)(CCN1c(ncc(C(F)(F)F)c1)c1F)c1ccccc1,0 Z2879493653,CC(CC1)CCC1N(CC(C1)c2nc(-c3nccc(OC)c3)no2)C1=O,0 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Z3687067626,COC1(COC1)c1cccc(C(N[C@@H](CC(Cn2cncc2)C2)[C@H]2O)=O)c1,2 K405-3489,Cc(ccc(Cl)c1)c1-n1ncc2c(N(CCC3)c4c3cccc4)ncnc12,2 S979-0328,C[C@@H](COc(cc1)c(C2)cc1C(N1CCCC1)=O)N2C(C1CCC1)=O,2 Z1157905162,Cn(cc1C(NCCC(c(cccc2)c2N2)C2=O)=O)nc1-c(cccc1)c1Cl,2 F6702-2107,C(C(CC1)CCN1c1c(ccs2)c2ncn1)Oc1nccnc1,2 Z2357277991,CCC(NC(COC1)c2c1cccc2)=O,0 Z2958463535,CC(CO)(CC1)CCN1C(C(C(Br)=CN1C)=CC1=O)=O,2 F6286-0881,O=C(c1noc(-c2ccccc2)c1)NCCc1nc(CCCC2)c2c(C(F)(F)F)n1,2 F2024-2114,O=C(NCc(cc1)cc2c1OCO2)NC(CC1=O)CN1c(cc1)ccc1Cl,2 F6478-1631,CN(C)S(N(CC1)CC1Oc(nc1)ncc1F)(=O)=O,0 SD68-0146,O=C1NCCN(CCC2)C1CN2S(Cc(cc1)ccc1Cl)(=O)=O,0 F6799-8696,O=S(c1ccccc1)(N(CC1)CCN1c1nc(C2CC2)ns1)=O,2 F6801-7970,CN(Cc(cc1)cc2c1OCCO2)c1c(C#N)nccc1,2 Z2911480366,OC(C(CC1)C(CCC2)C2N1C(C1c(cccc2)c2SCC1)=O)=O,2 S614-1097,Cn1nccc1C(N(CCCC1)C1c1nc(CCOCC2CCOCC2)no1)=O,0 Z2188496139,CC(C1CC1)(c1nc(-c2cccc(N(CCC3)C3=O)c2)no1)OC,0 Z2973783106,Cc1cc(cc(CNC(N2C[C@H](CN(C)C3)[C@H]3C2)=O)cc2)c2[nH]1,2 Z1575468873,CC(C)n1ncc(C(NCc(cc2)cnc2-n2cncc2)=O)c1C,0 S614-0779,Cc1ccc(CNC(N(CCCC2)C2c2nc(CCOCC3CC3)no2)=O)cc1,2 F3283-0301,CCOC(C1=C(C)Nc2ncnn2C1/C(/C)=C/c1ccccc1)=O,2 S986-0204,Cc1nn(C)cc1C(N1C[C@](CN(C)C)(CN(Cc2ccccc2)C2)[C@H]2C1)=O,0 F6752-7465,CC(C)(C)NC(C(CC1)CN1c1c(cc(cc2)Cl)c2ncn1)=O,0 G349-1659,COc(ccc(-c1noc(NCCN(CC2)CCN2c2cccc(C(F)(F)F)c2)n1)c1)c1OC,2 E679-0482,CN(C=C(c1c2cccc1)NC(NCCCN(CC1)CCN1c(cc1)ccc1F)=O)C2=O,0 SA93-0541,COCCC1(CN(Cc2cc([nH]cc3)c3cc2)CCC1)C(N)=O,2 F6791-8288,C(C1)C1c1nnc(C(CC2)CCN2c2c3sccc3ncn2)o1,2 F6687-7042,Cc1cccc(OCC(CCC2)CN2C(c(cc2)ccc2N(C(CC2)=O)C2=O)=O)n1,2 Z1974506066,CCOc1ccc([C@H](C2)[C@@H]2NC(c(c(C)nn2C)c2-n2ncc(C)c2)=O)cc1,2 F6553-7025,Cn(cc1C(N(CC2)Cc3c2sc(Cl)c3)=O)nc1OC,0 Z3469051270,C[C@]1([C@H](CC2)O[C@H]2C1)C(NCC(Nc1nccs1)=O)=O,2 Y200-5756,CC(C)C(Nc1nnc(CC2CCCC2)s1)=O,2 S954-0407,CCC(C)(C)C(N(C[C@@H]1C(CC2)CCN2c(cc2)cc(C(F)(F)F)c2C#N)C[C@@H]1C(N(C)C)=O)=O,2 Z2294506504,Cc1c(CNC(C(C2)CN2C(C2CCCCC2)=O)=O)scn1,2 S592-0527,O=C(C1CCC1)N(CC1)CC1c1noc(COc(cc2)ccc2F)n1,2 F1128-0171,Cc(cc1)ccc1C(C(C(c1cccs1)N(CCN(C)C)C1=O)=C1O)=O,2 Y042-6657,C/1(=C/N(C(c2c1cccc2)=O)C)\C(N[C@H](c1nc2c([nH]1)cccc2)C(C)C)=O,0 Z4042925145,O=C(CCc1ccccc1)N[C@@H](CCC(N1)=O)C1=O,0 SD07-0414,O=C(C1CCOCC1)NCc1c(COC2(CN(Cc(ccnc3)c3F)CC2)C2)n2nn1,2 F2444-0050,Cc1nc(OC)cc(Nc(cc2)ccc2NC(Cc(cc2)ccc2OC)=O)n1,2 F6790-0057,FC(c1cc(F)c(N2CCOCC2)nc1)(F)F,0 Z1239623397,CC(c(c(CC1)ccc2)c2F)N1C(CN(C(C(C)(c1cc2ccccc2cc1)N1)=O)C1=O)=O,0 Z2949031509,CN1[C@@H](CN(CC2)CCN2c2cncc3ncnn23)CCC1,2 F5496-1685,Cc1nnc(C2CCN(CC(Nc(cccc3)c3F)=O)CC2)s1,0 8020-1614,COCCCN(C(c1c2[nH]nc1-c1ccco1)c(cc1)ccc1Cl)C2=O,2 Z3333847277,NC(c(cc1)ccc1Cl)c(cccc1F)c1F,0 S903-1673,CC(C)S(N(CC1)CCC1c1nnc(C2)n1CCN2C(Cc1cscc1)=O)(=O)=O,0 F0447-0463,CC(CC(C)C1)CN1S(c(cc1)ccc1C(Nc1c(C)c(C)ccc1)=O)(=O)=O,0 Z2960205792,Oc(nc(C1CC1)cc1)c1C(N[C@@H]1C[C@@H](c2ncccc2)OCC1)=O,2 Z3351735076,CCOc1ccc(CN([C@@H]2[C@H](C3)OCC2)C3C(O)=O)cc1,0 F6523-0656,Cn1nnc(C(NC(CC2)CCN2c2ncnc3c2CCCC3)=O)c1,2 F0774-0026,O=S(c(cc1)ccc1Br)(n1c(cccc2)c2nc1)=O,0 Z2212586351,O=C(C1C(CC2)CCC2C1)Nc(cc1)cnc1Cl,2 Z3590543396,Cc1nn(cc(cc2)NC(c(cc(cc3)OC)c3OC(F)(F)F)=O)c2n1,2 F6812-1598,N#Cc1c(N(CC2)CCN2c2nc(-c3cnccc3)ccn2)nccc1,0 F6557-0992,O=C(C(C1)CN(C2CCOCC2)C1=O)N(CCC1c2ccccc2)CCS1(=O)=O,2 Z1197737559,CC(c1nc(-c2cc(Br)cs2)no1)n1nc(C)cc1C,0 Z2851099882,CC(CCCC1)CN1c1nnc(-c(cc2)ccc2OC)o1,2 F5857-3126,CC(CNC(CSc(cc1)ccc1F)=O)(c(cc1)cc2c1OCO2)O,2 F5882-0190,COC(N1CCN(CCNC(C2c(cccc3)c3Oc3c2cccc3)=O)CC1)=O,0 SB25-0869,O=C(C(CC1)CCC(N=C(c(cc2)ccc2F)N2)=C1C2=O)N(CC1)CCC1N1CCCC1,2 Y040-3552,CCC1N(Cc(c(O)c2C)cc(C(C)=C3C)c2OC3=O)CCCC1,0 F6445-1605,O=C(c1nc2ccccc2cc1)NC(CC1)CN1c1nccs1,2 F6186-1363,CC(CCSC)(CNC(C(NCCC1=CCCCC1)=O)=O)O,0 F6610-7181,FC(c1cc(N(CC2)Cc3c2scc3)ncn1)(F)F,0 F6571-0335,CN(C)C(CNS(c(cc1)ccc1C(OC)=O)(=O)=O)c1csc2c1cccc2,0 Z2368529290,Clc(c1ncc2)cccc1c2N(CC1)CC11CNCC1,2 S985-0017,CN(C[C@H]1CN(C2)C(Cc3cccs3)=O)C[C@]12C(N1CCCC1)=O,2 F6808-0956,Cc1cc(N(CC2)CCN2c(cncc2)c2C#N)c(C)cc1,0 Z1012876480,CC(N(C)C(CC1)CCN1C(NCCc1cccc2ccccc12)=O)=O,0 Z1272328532,CC(c1cccc(OC)c1)N(CC1)CCN1c1nc(C)ncc1,0 Z1623392120,O=C(NCc(cccc1)c1N1CCCCC1)N1C(CC2)CC2C1,2 F6125-3658,CC(C)(C)c1noc(NC(C(C2)CN2C(c2nccnc2)=O)=O)c1,2 F5852-1911,Cc1nccn1CCNC(C(Nc(cc(cc1)Cl)c1OC)=O)=O,0 Z3687328006,C[C@H](C1)O[C@@H](C)c2c1c(C(NCc(cc1)ccc1-n1c(C)ncc1)=O)nn2C,2 Z2896128787,COC1(CCOCC1)c1nnc(NC2CCCC2)o1,2 Y031-0603,CCCC(C)c1nnc(NC(CN(C(c2c3cccc2)=O)C3=O)=O)s1,0 M049-0425,CCCN(c(cccc1)c1N=C1c(cc2)ccc2C(NCCCN2CCCCCC2)=O)C1=O,2 Z955547516,CC(c(cccc1)c1NS(C)(=O)=O)NC(c1cc(COC2)c2cc1)=O,0 F0596-0036,O=C(CSc1ncnc2c1oc1c2cccc1)NCc1ccco1,2 Z1159312773,CCN(CC1)CCN1C(CC1CCN(CC(NCC2CCC2)=O)CC1)=O,0 Z2475868533,COc(ccc(F)c1)c1S(NC(C1COCC1)C(O)=O)(=O)=O,0 SB21-1085,Cc1cc(C(N(C2)[C@H](Cn3nnc(C(N(C)C)=O)c3)C[C@@H]2F)=O)c(C)n1CCOC,0 C514-0327,CC(c(cc1)ccc1NC(C(CC1)CCN1S(c1c(/C=C/c2ccco2)onc1C)(=O)=O)=O)=O,2 F0910-0558,CCOc(cc1)ccc1NC(c(c(OC)c(cc1)Cl)c1Cl)=O,0 F6497-1519,Cn(c(C(N1CC(Cc2nc(-c3nccnc3)no2)CCC1)=O)c1)nc1-c(cc1)ccc1F,2 Z2598943177,O=C(CN(CCC1)C1C1CC1)Nc(cc1)cnc1Cl,2 Z2768785119,CCC(C)c1nnc(CC2)n1CCS2(=O)=O,0 F6724-0104,C(C(c1cccs1)N1CCOCC1)Nc1ncnc2cnccc12,2 F6089-6085,O=C(C(Nc1cnccc1)=O)NCC1(CC1)c(cc1)ccc1F,2 F6523-0495,Cc1nc(N(CC2)CCN2C(c2cn(C)nc2OC)=O)cc(C(F)(F)F)n1,0 F1626-0097,Clc(cc1)ccc1OCCSCc1nc(cccc2)c2[nH]1,2 F6458-0306,Cn(cc1C(N(CC2)CCN2c(cc2)nnc2-n2ncnc2)=O)nc1OC,2 Z3139886795,CC(NC(C1)CN1C(NCc1cccc(OC(F)(F)F)c1)=O)=O,0 F6559-1085,COC(c(cccc1)c1C(N(CC1)CC1n1c(cccc2)c2nc1)=O)=O,0 F6573-6515,CC(C)(C)OC(N1CCC(CC(N(CC2)CCC2(C2)C2(F)F)=O)CC1)=O,2 F1915-2657,Cc(ccc(CN(C1)c(cccc2)c2NC1=O)c1)c1Br,2 Z1265532087,CC(NCc1cc(OC)nc2ccccc12)=O,0 S584-0344,COc(cc1)ccc1NC(N1CCn2c(C3CC3)nnc2CC1)=O,2 F3406-6300,CC(C)(C)OC(N(CC1)CCN1C(C(CC1)CCN1c1ncnc(Oc2ccccc2)c1)=O)=O,2 Z2095015698,CC(C)(c1c(C)onc1C)NC(Cc1ccc(C)cc1)=O,0 F6471-0524,O=C(Cc1cccs1)N(C1)CC1n1nnc(-c2ccccc2)c1,2 S830-0492,O=C(c1ncccn1)N(CC1)CC(COCC2CC2)C1(F)F,2 S848-0079,CN(C(C=C1)=O)N=C1N(CC1)CCC1NS(c1cccc2nsnc12)(=O)=O,2 Z1563532532,CC(CN(C1)C(Nc2nc(C)cs2)=O)C1O,0 SD02-0345,CC(C)c1nnc(C(C2)N(CC(N(C)C)=O)CC22CCN(Cc(cc3)cc4c3OCCO4)CC2)o1,2 F6226-0421,COc1ccc(CCNC(N(CC(C2)O3)C2C3=O)=O)cc1,2 Z3686198692,Cc1cc(S(N[C@@H](CC(Cn2nccc2)C2)[C@H]2O)(=O)=O)c(C)o1,0 Y031-3602,CCOc(cc1)ccc1N(CC(C1)C(N(CCC2)c3c2cccc3)=O)C1=O,0 Z2217894631,CC(C)C(Nc1nccc(C(NCCNC(c(cc2)ccc2Cl)=O)=O)c1)=O,0 Z4767120069,Oc1cccc(-c(cc2CC3)cnc2NC3=O)c1,0 Z1863836503,CCc1nc(NCc2cc(N3CC(C)OCC3)ncc2)nnc1CC,2 SB70-1104,COCCNC(c1nn(C[C@H](C2)NC(c3cscn3)=O)c2c1)=O,2 Z1612541790,CC(C)(C)[C@@H](C(N1CC2(C)COC2)=O)NC1=O,2 F6184-0946,O=C(C1(CCOCC1)c1ccccc1)NCCN(CC1)CCC1c1cccs1,2 Z1591129310,CCc(cccc1CC2)c1N2C(c1cc(O)nc(C(C)C)c1)=O,0 F6372-0845,O=C(Cn1c(cccc2)c2nc1)Nc1c(Cc2nc(-c3cnccc3)no2)cccc1,2 Z2233726312,Cc(c1ccc2)c(C)[nH]c1c2C(Nc(cc1)ccc1N=S(C)(C)=O)=O,2 Z2768785003,Cc(cc1)ccc1OCc1nnc(CC2)n1CCS2(=O)=O,0 F6357-0781,COc(ccc(S(NCC1(CCCC1)c1cscc1)(=O)=O)c1)c1F,2 Z1277178579,CCN(CC)C(CC1)CN1C(N(CCC1)c(cc2)c1cc2S(N1CCCC1)(=O)=O)=O,2 F6562-7790,O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)NC(CC1)C11CCOCC1,0 Z3111927127,Cc1cc(NC(C(CC2)(c3c2c(OC)ccc3)N)=O)nn1C,0 F6548-4850,O=C1N(Cc2cc(Cl)ccc2)Cc(cc(cc2)Br)c2OC1,0 F3088-1539,Cc(cc1)ccc1OCc1ccc(C(Nc2c(C)cc(C)cc2)=O)o1,0 F5658-0120,O=C(COc1cc(C(CC2)=O)c2cc1)NCc(c(F)ccc1)c1F,2 G325-0850,CC(CC(Nc1cc(OC)cc(OC)c1)=O)S(c(cc1)cc(CC2)c1N2C(C1CC1)=O)(=O)=O,0 Z2073453224,CC(N(CCCC1)C1C(NCc1c(C)ocn1)=O)=O,2 Z1726621293,CC(Cn1nccc1)NC(N(CC1)Cc(cccc2)c2S1(=O)=O)=O,2 F0590-0010,O=C(CS(c1c[nH]c2c1cccc2)(=O)=O)N(CC1)c2c1cccc2,2 F6549-3446,O=C(c1nccc2ccccc12)N1CC(Cn2ncnc2)C1,2 F0473-0357,COC(c(cc1)ccc1C(Nc1nc(-c2c(CC3)cccc2)c3s1)=O)=O,2 F6442-0918,COc(cc1)ccc1S(C(C1)CN1C(NCc(cc1)cc(OC)c1OC)=O)(=O)=O,2 F6791-5033,CC(C)(C)c1cc(N(CC2)CCN2S(C)(=O)=O)nc(SC)n1,0 Z1686401101,C(C1c2nc(C3OCC(CCCC4)N4C3)no2)C1c1cccc2ccccc12,2 8015-7490,CN(C(CC1)CS1(=O)=O)c1nc(-c(cc2)ccc2Br)cs1,2 F6412-1505,COc(cccc1)c1OCC#CCNC(c(cc1)ccc1OC(F)(F)F)=O,0 F6430-0580,Cc1cc(C)nn1-c1cc(NC(c(cccc2)c2Cl)=O)ncn1,2 Z4619797900,O=C(NCC(c1c[nH]c2c1cccc2)c1ccccc1)N1CC2(CC2)CC1,2 Y300-3890,O=C(c1ccc(CN2CCOCC2)cc1)NCCSC1CCCC1,2 S891-0345,O[C@@H](CC1)[C@H](C2)[C@@H]1CN2C(COCc1ccccc1)=O,2 F6448-0862,O=C(C1COCC1)Nc1cn(C2COCC2)nc1,2 Z2467437709,Fc(cc1)ccc1-c1nc(Cn2nnc(C3CCNCC3)c2)co1,2 F6796-0333,COCCn1c(ncnc2N(CC3)CCN3c(cccc3)c3OC)c2nc1,0 Z2578096342,COC(CC1)CCN1S(N(CC1)CCC1N1CCCCC1)(=O)=O,0 Z4076880072,CC(C)([C@@H](CC1)C(N(C)C)=O)[C@@]1(C)C(N[C@@H](CN(C)C1)[C@H]1c1cncn1C)=O,2 S858-5880,Cc1cn(Cc2cc(C(N3C[C@](CO)(CN(C4)S(C)(=O)=O)[C@H]4CC3)=O)no2)nc1,2 Z2180539465,CCOc1ccc(C2(CNC(c3cn(C)nc3C3CC3)=O)CCOCC2)cc1,0 C464-1047,CCC(N(CC1)c(cc2)c1cc2S(NC(CC(C)C)C(Nc1nc(ccc(C)c2)c2s1)=O)(=O)=O)=O,0 F5882-5290,Cn(c(C(N(CC1)CCN1S(C1CC1)(=O)=O)=O)c1)nc1-c(cc1)ccc1F,2 E557-3888,CC(C)(c(cc(cc1)S(NCC(CC2)CCC2C(N2CCCCC2)=O)(=O)=O)c1N1C)C1=O,2 J025-1414,COc1cc(OC)c(C(C2)c(scc3-c(cc4)ccc4F)c3NC2=O)cc1,0 L995-0398,O=C(c1noc(cc2)c1cc2S(Nc1nc(ccc(Cl)c2)c2s1)(=O)=O)N1CCCCC1,2 Z4684534262,Cc(c(C(N1CC(c2ccccc2)=CC1)=O)cnc1)c1C(O)=O,0 F6678-9857,COc1c(C2(CC2)C(N(C2)CC2n2c(cccc3)c3nc2C2CC2)=O)cccc1,2 F6792-0374,Cc1nc(CN(CC2)CCN2c2cc(C3CC3)nc(SC)n2)no1,2 Z1172238801,CC(C)c1cc(N(CC2)CCN2c2ccccc2)ncn1,0 F6677-3232,CC(C)c1nccc(N2CC(Cn3ncc(Cl)c3)C2)n1,0 Z5055993802,CS(NC(CCC1)CN1S(C1(CCC1)C#N)(=O)=O)(=O)=O,2 Z94842275,COc1cc(OC)c(C(CCC2)N2c2ncccn2)cc1,0 SB70-0870,Cn1c(C(N[C@@H](Cc2c3)Cn2nc3C(NCc2ccccc2)=O)=O)cnc1,2 8017-7839,OC(CC(c(cc1)ccc1OC1CCCC1)N(C(c1c2cccc1)=O)C2=O)=O,2 F6438-1249,Cc1nc(CNC(c2cnccc2)=O)nc(N(C)C)c1,2 Z5021905573,Cc(cc(N)nc1)c1NC(C1c(cc(cc2)Cl)c2OCC1)=O,0 Z3409369405,CN(C(CC1)=O)c(cc2)c1cc2NC(COc(cc1)cc(F)c1F)=O,2 SC68-1505,Cn1c(C(CN(C2)S(c3cnccc3)(=O)=O)C22CCCCC2)nnc1,0 Z3217436957,CC(C)(C(O)=O)Oc(cc1OCCc1c1)c1-c1cc(C#C)ccc1,0 8015-2378,COc(cc(c(cccc1)c1o1)c1c1)c1NS(c(cc1)ccc1N(CCC1)C1=O)(=O)=O,2 S682-0215,COc1cccc(NC([C@H]2OCCN(C3CC3)[C@@H]2c2ccccc2)=O)c1,0 D470-2118,Cc(cc(cc1)S([C@@H](CS(C2)(=O)=O)[C@H]2NCCc(cc2)ccc2F)(=O)=O)c1F,0 Z1603367179,CCC(C(O)=O)(c1ccccc1)NC(Cc(cc1)cc2c1OCO2)=O,0 F2370-0114,O=C(CCCc1ccccc1)NCC(CC1=O)CN1c1ccccc1,2 F6516-1609,O=C(c(cccc1)c1Cl)NCc1ccc(-c2cocc2)o1,0 Z4250899830,CN(CC(CCCC1)C1O)Cc1c(C(O)=O)sc2c1c(F)ccc2,2 F6454-2278,Cc1nccc(N2CCC(CNC(c3cocc3)=O)CC2)c1,0 F6783-5646,O=S(Cc(cc(cc1)F)c1F)(N1CC(CN(C2)c(cc3)nn4c3nnc4)C2C1)=O,2 Z1815636482,CC(c1nnnn1C)NCC1(CCCCC1)c1cc(C)ccc1,0 Z2735460017,Cc1cc(C(NS(CC2CCC2)(=O)=O)=O)cc(C(O)=O)c1,2 F6488-1605,COc1nccnc1OC(CC1)CN1C(NCc(cc1)cc2c1OCO2)=O,2 F6610-2910,CN(C=NC(N(CC1)Cc(cc2OC)c1cc2OC)=C1)C1=O,2 Z2504193931,OC(CN(C1CCC1)C(Cc1cccc(Cl)c1)=O)=O,0 F6389-1377,O=C(c1nccc(-n2nccc2)c1)N(CC1)CCN1c1ncccn1,2 Z166869884,Cc(cc(c(OC)c1)NC(CCN(C=Nc2c3c(CCCC4)c4s2)C3=O)=O)c1Cl,2 F6474-3715,O=C(c1cc(cccc2)c2[nH]1)N(CC1)CCC1Oc1cccc2cccnc12,2 F6184-0876,O=C(Cc(cccc1)c1Cl)NCCN(CC1)CCC1c1cccs1,2 Z2934001601,CC(C)NC(c(nc1)c2n1-c(cccc1)c1OC2)=O,0 V018-7569,CC(C)CCN(CC(N1C)=C2C(c3cc(OC)ccc3)NC1=O)C2=O,0 Z2178307668,CCCOc(cc(cc1)OC)c1C(Nc1nn(C)c(C2CC2)c1)=O,0 Z1443624926,COc1cccc(Nc(cccc2)c2C(N(CCC2)CC2C(O)=O)=O)c1,0 F6444-1675,COC(C(CC(C1)Oc(cccc2)c2F)N1C(C1(CCCC1)c1cccs1)=O)=O,2 SD14-0606,CN([C@@H](CCN(Cc1c[nH]nc1-c1ccccc1)C1)[C@@H]1C(N(Cc1cnccc1)C1)=O)C1=O,2 Z2415050588,CC(C)n1ncnc1NC(c1cccnc1F)=O,0 F6235-0095,O=C(CC(c1ccccc1)c1ccccc1)N(CC1)CCN1c(cc1)nnc1-n1cncc1,2 F6554-0292,Cn1nc(C(CC2)CCN2C(c(cccc2)c2S(C(F)F)(=O)=O)=O)cc1,0 F6252-1641,COc(ccc(Cl)c1)c1NC(c1c(-c2ccncc2)n(Cc(cccc2)c2F)nn1)=O,0 F6565-4836,O=C(CN(C=NC(c(cc1)ccc1F)=C1)C1=O)N(CC1)CCN1c1nnc(CCC2)c2c1,2 Z1521584996,Cc(sc(N=C(c1nc(F)ccc1)N1)c2C1=O)c2-c(cc1)ccc1F,0 F3374-0847,CC(c1cccc(Nc2c(cc(cc3)F)c3ncc2)c1)=O,0 F5882-3959,O=C(C1(CCCC1)c1cccs1)Nc1cc([nH]nc2)c2cc1,2 Z1170101492,FC(c1nn(Cc2nc(-c3cc(Br)cs3)no2)cc1)(F)F,0 Z2648709973,O=C(c(cc1)cc(NC(CN2)=O)c1C2=O)NCC1CCN(CC2CC2)CC1,2 F3406-7523,CCc(cccc1)c1NC(CSc1nccc(-c2nc(C3CC3)no2)c1)=O,2 J004-1106,Cc1noc(C(CCC2)N2C(c2cc(-c3ccccc3)no2)=O)c1,2 Z1438578869,CC(c(cc(cc1)Cl)c1OC)NCc1noc(C)c1,0 F6142-0203,Cc(cc(cc1)Nc2nc(N)cc(C)n2)c1Br,0 F6218-0168,Cc1cc(C)nn1-c(nc1)ncc1NC(c1nccnc1)=O,2 G291-0175,N#Cc1c(N2CCOCC2)ncnc1NCCCN(CC1)CCN1c(cc1)ccc1F,2 F6808-5310,CC(C)NC(C(C)N(CC1)CCN1C(N=C1N2C=CC=C1)=CC2=O)=O,0 F6680-8910,Cc1noc(CN2CC(COc3cc(C)ncc3)CCC2)c1,2 Z1902627492,Cc1c(C(Nc2cc(C(N3CCOCC3)=O)c(C)cc2)=O)nco1,2 F6793-6921,CC(C)c1noc(CN2CCN(CC(F)(F)F)CC2)n1,0 Z4655554050,Nc1cccc(CNC(c2noc(-c(cc(cc3)F)c3F)c2)=O)n1,0 Z1902630374,CC(C)c(nc(C)nc1)c1C(Nc1cc(C(N2CCOCC2)=O)c(C)cc1)=O,0 F6488-2764,CN(C)c1cncc(OC(CC2)CN2S(C)(=O)=O)n1,0 Y031-4783,O=C(C(CC1=O)CN1c(cc1)ccc1Cl)Nc(cc1)ccc1S(NCC1OCCC1)(=O)=O,0 Z975784038,CC(C(O)=O)N1CCN(Cc2nc(cccc3)c3s2)CC1,0 F6560-0726,CCc1nc(ccc(C(NC(C2CCOCC2)c2cccs2)=O)c2)c2s1,2 P636-0703,CCCN1N=CC(N(CC2)CCC2C(NCCCN(CCC2)c3c2cccc3)=O)=CC1=O,2 Z431771058,CCCC(N=C(c1cc(OC)ccc1)N1)=CC1=O,0 F6512-0522,COC(c(cc1)cc(S(N2Cc3ccnn3CC2)(=O)=O)c1OC)=O,0 Z1158336378,Cc(ccc(-n1ncc(C(NCC(CC2)CN2C2CC2)=O)c1C1CC1)c1)c1Cl,0 Z1335732860,O=C(C1CCCC1)Nc1cccc(CNC(N(CCN2C3CC3)CC2=O)=O)c1,2 F6443-6870,Cn(c(C(NCC(CCC1)N1c1nccs1)=O)c1)nc1-c1cc(OC)ccc1,2 F6512-9137,Cc1c(CNC(c(cccc2)c2OC(F)(F)F)=O)cno1,0 S985-0016,CN(C[C@H]1CN(C2)C(c3cc(cccc4)c4[nH]3)=O)C[C@]12C(N1CCCC1)=O,0 F6452-0289,CC(CNS(c(s1)ccc1Cl)(=O)=O)(c(cccc1)c1F)OC,0 Z425332236,OC(c1cccc(C(N(CC2)CCN2c2nccs2)=O)c1)=O,0 F6556-5716,CC(C)c1nc(S(N(CCC2)CCN2C2COCC2)(=O)=O)cn1C,2 Z1471669377,Cc(n(-c1ccccc1)nc1)c1NC(C(c1ccccc1)n1c(cccc2)c2nc1)=O,2 S585-0484,O=C(CCc1ccccc1)N(CCC1)CC1c1nnc(C2)n1CCN2C(C1CC1)=O,2 5607-0168,COc(cc1)c(CN(CC2)CCC2N(CC2)CCN2c(cccc2)c2OC)cc1Br,0 SD01-0453,COCCCn(c(CC1)c2CN1S(C1CC1)(=O)=O)nc2-c1cocn1,0 Z4783322368,Cc1c(C(N2CCCC2)=O)nnn1Cc1nnc(C)o1,2 F5791-2075,Cn(c(C(N1c2nc(cccc3)c3n2CC1)=O)c1)nc1-c(cc(cc1)OC)c1OC,2 Z3392621364,CCC(C)c1nc(C)cc(N(CC2)CC2(C(N)=O)c2ccccc2)n1,2 Z2522496202,CCOC1CN(Cc2cc(CNCC3)c3s2)CCC1,0 F1096-0120,C=CCNc1c(C#N)nc(-c(cccc2)c2Cl)o1,0 Z1360293750,CC(CNC(c1c(cc(cc2)Br)c2nc(C2CC2)c1C)=O)COC,0 F6808-5491,CC(C)NC(C(C)N1CCN(CCC(F)(F)F)CC1)=O,0 F6209-0049,N#Cc1cccc(C(NCCCn2c(-c3ccccc3)ncc2)=O)c1,0 Z1566746471,C(c1n[nH]c2c1cccc2)N1C(CCC2)C2CCC1,2 F6517-1700,OC(CNC(c(cccc1)c1Br)=O)c1ccc(-c2ccco2)s1,0 Z2000132674,CCNC(N(CC1)CC1NC(c(cncc1)c1Oc1ccccc1)=O)=O,2 F6774-4047,COc(cn1)cnc1OC(CC1)CN1c(nc1)ncc1F,0 SA73-0627,C(C1CC1)C1(CCN(Cc2cnccc2)CC1)c1noc(C2CCOCC2)n1,2 Y043-6212,COc1cc(CC(C(N)=O)N(C2)C(CC(c(cc3)ccc3Cl)n3cccc3)=O)c2cc1OC,2 SC96-0275,Cc1cc(C(N(CC2)CC3(COCC3)N(CC3CC3)C2=O)=O)c(C)o1,0 F6443-8234,COc(ccc(NC(C(CCC1)N1c1nc(cccc2)c2o1)=O)c1)c1Cl,0 F6512-6551,CC(C)(C)OC(N(CCC1)CCN1S(c1c[nH]cn1)(=O)=O)=O,0 F6192-0151,COc1cccc2c1oc(C(NCC(c1ccco1)c1ccco1)=O)c2,2 F6481-2632,Cc1c(C(CC2)SCCN2C(c2nccc3ccccc23)=O)cccc1,2 Z3687021440,CN(C)c1c(ccc(C(N[C@@H](CC(Cn2nccc2)C2)[C@H]2O)=O)c2)c2ncn1,2 SC02-0411,Cc1noc(C)c1CC(N(CC1)CC1(CCOC)NS(c1ccccc1)(=O)=O)=O,2 F6454-2579,Cc1nccc(N2CCC(CNC(Nc(cccc3OC)c3OC)=O)CC2)c1,0 K832-3034,CCOc(ccc([C@H](C1)n2ncnc2N[C@H]1c1cccs1)c1)c1OC,2 Z2443787209,O=C(C(CC1)CC1=O)NS(c1cc(C(CCC2)=O)c2cc1)(=O)=O,2 K786-8023,COCCNC(CN(C(C=C1)=O)N=C1c(cc1)ccc1Cl)=O,0 F6403-0532,O=C(COc(cccc1)c1F)N(Cc1cnc2n1cccc2)C1CC1,2 Z3799773055,Cc1nnc([C@](CC2)([C@@H]2CC2)N2C(c(cccc2)c2F)=O)o1,0 Z2234647403,Cc(ccc(S(Nc(c(O)ccc1)c1Cl)(=O)=O)c1)c1C(O)=O,0 F5097-2615,COCCNC(Nc1ccc(CC(NCC(F)(F)F)=O)cc1)=O,0 Z2309646514,CC(C)(CNC(N(CCN1)CC1=O)=O)C1CCC1,2 F6372-1615,O=C(c1cc(cccc2)c2s1)Nc1c(Cc2nc(-c3ccncc3)no2)cccc1,2 Z5021346316,CN(C(CC1)=O)c(cc2)c1cc2NC(c(c1cnccc1cc1)c1F)=O,2 F6609-1853,O=C(COC(c1cc(Br)cnc1)=O)Nc(cc(cc1)F)c1F,0 Z2691756265,N#Cc(cc1)cc(F)c1N(CC1)CCC1C(N1Cc2ccnn2CC1)=O,2 Z2700689509,CN1CC(CNc2c(CCC3)c3nc(-c3cnccc3)n2)CCCC1,2 F6549-7217,O=C(NCc1cccs1)N1CC(CN(C(CC2)=O)C2=O)C1,2 F5040-0236,COc1cccc(C(N(CC2)CCN2c(cc2)nnc2-c2ncccc2)=O)c1OC,0 Z743799518,CCc(ncnc1)c1C(NC(CC1)CCN1C1CC1)=O,2 D753-0167,O=C(Cc(cc1)cc2c1OCC2)N[C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1,2 Z3063545676,Cc(cc1)cc(CC2C(NC(CCOC)CO)=O)c1S2(=O)=O,0 F6454-0595,O=C(c1cc(cccc2)c2o1)NCC1CCN(CC(F)(F)F)CC1,0 S625-0490,Cc(cc(CN1Cc2nnc([C@H](C3)N(C)C[C@@H]3O)n2CC1)cc1)c1OC,0 Z1130439103,O=C(C1CC1)N(CC1)CCC1NC(NCc(cc(cc1)F)c1F)=O,0 Z1785775720,Cc(cc12)ccc2ncnc1N(CC1)CCC1C1OCCC1,2 F6562-5236,O=C(C1Oc(cccc2)c2OC1)NCCN(C=CC=N1)C1=O,2 C561-0921,CC(c(cc1)cc2c1OCCO2)NC(CCc(c(C)nc1c2)c(C)n1nc2-c(cc1)ccc1Cl)=O,2 Z1738416463,OC(C(CC(F)F)NS(c1cccs1)(=O)=O)=O,0 F6562-2354,CSc(cccc1)c1C(NCc1cc(N(CCC2)C2=O)ncc1)=O,0 F6512-7292,Cn1ncc(S(N(CCC2)CCN2S(N2CCOCC2)(=O)=O)(=O)=O)c1,2 F6456-1228,O=C(C(CCC1)CN1c1ncnc(-n(cc2)c3c2cccc3)c1)NCc1cnccc1,2 F3411-4831,Cc1cc(CN2N=C(C(N(C=C3)c(cc4)cc(Cl)c4OC)=O)N3C2=O)c(C)cc1,0 Z2474901019,NC([C@H](CC1)C[C@H]1NC(c1cnc(Nc2ccccc2)nc1C(F)(F)F)=O)=O,2 Z4126468546,O=C(N[C@@H](CCC1)C[C@@H]1C1CC1)Nc(cc1)cnc1Br,0 Z1213200577,CC(CC(C1)c2ccccc2)N1C(NCCN1CCOCC1)=O,2 D107-1053,CC1Cc2c(NC(COc3cc(C)cc(C)c3)=O)onc2CC1,0 Z2439179215,CC(C)[C@@H](C1)NCCN1C(c(ccc(C)c1)c1Br)=O,0 Z2437372362,CC(CNS(N(CC1)CCC1C(O)=O)(=O)=O)c(c(Cl)ccc1)c1Cl,0 F2874-0063,CN(C(C=C1)=O)N=C1c1cc(NC(CC(c2ccccc2)c2ccccc2)=O)ccc1,2 F6523-4434,O=C(c1nc(cccc2)c2s1)N(CC1)CCN1c1nnc(CCCC2)c2c1,2 F6521-8211,COC(CNC(Nc1cccs1)=O)c(s1)ccc1Cl,2 Z1172222221,Cc1n[nH]cc1CNc1nc(C2CC2)nc(C)c1,2 F6443-4229,O=C(CN1N=CC=CC1=O)N(CC1)CCC1(c1c2cccc1)OC2=O,2 F5614-0065,CS(N(CC1)CCC1C(N1CCN(Cc2nc(cccc3)c3[nH]2)CC1)=O)(=O)=O,2 Z2569822539,C[C@@H]([C@H](C1)N(C(CN2C)=O)C2=O)c2c1cccc2,0 Z45633610,Cc(cc1)ccc1NS(c(cc1)ccc1Br)(=O)=O,0 F1081-0026,O=C(CN(C(c1c2c3cccc2ccc1)=O)C3=O)Nc(cc1)cc2c1OCO2,2 F6448-0197,CCOC(Nc1cn(CC2OCCCC2)nc1)=O,0 Z2887610382,Cc1cn(C)nc1CNc1nc(C)cc(C)n1,2 Z2951526830,Cn1nncc1NC(NCc1cn(CCF)nc1)=O,0 Z3216000905,OCC1(CC(N2CCC(Cc3nc(cccc4)c4[nH]3)CC2)=O)CCC1,2 P681-0168,COc(cc1)cc(C2(CC3)CN3C(Cc(cc3)cc(Cl)c3OC)=O)c1NC2=O,0 F0585-0636,CC(c1nc(cccc2)c2n1Cc(cccc1)c1F)NC(c(cccc1)c1OC)=O,2 Z2094723101,CC(C(c1cccc(Cl)c1)O)Nc1nc(C)nc(-c2ncccc2)c1,0 F6571-4352,OCCOC(CNC(c(cccc1)c1Br)=O)c1cscc1,0 SB59-0421,CC(C)C(N(C1)CC2(CN(Cc3ccc(C)s3)C2)C1c1nncn1C)=O,0 Z2444592989,NC(NC(CC1)CCN1c(cc1)ncc1C(O)=O)=O,0 Z2205494212,COCc1cc(NC(Cc2cccs2)=O)cc(C(O)=O)c1,0 F3222-2917,CC(C=C(C)N(CC(Nc(cc1)c(C(F)(F)F)cc1Cl)=O)C1=O)=C1C#N,0 F0913-1725,O=C(CSc1ncccc1)Nc(cc1)cc2c1OCO2,2 T622-0428,CC(C)CN(CC1)CCN1C1CC(CC2)(CCN2C(c2cscc2)=O)OCC1,2 Z86405324,Cc1cccc(C)c1NC(CN(CC1)CCN1c1nc(cccc2)c2s1)=O,0 SC89-0136,O=C(c1cc(-c2cccc(Cl)c2)n[nH]1)N(C1)CC1(C(CN1CCCC1)CC1)S1(=O)=O,0 Z2482959766,CCn1ncc(C2CCN(Cc(cc3)cc(Cl)c3C(O)=O)CC2)c1,0 Z2085929312,O=C(Cc1ccccc1)N(CCC1)CC1C(N(CC12CCC2)Cc2c1cccc2)=O,2 Z2439817812,CNCC(CCC1)CN1C(c1c[nH]nc1-c(cc1)ccc1OC)=O,0 F6356-1102,CC(Cc(cc1)cc2c1OCC2)NC(c(cc1)cc(F)c1OC)=O,0 S689-0317,O=C(C(C1)CN(C(C2)CN2C(c2cc(cccc3)c3[nH]2)=O)C1=O)N1CCCC1,0 F6573-1568,Cc1cc(C(NCc2nccnc2-c2cn(C)nc2)=O)c(C)o1,2 Z4093802489,CON1CCC(CC(NS(c2csc(-c3ccccc3)n2)(=O)=O)=O)CC1,2 F6481-4056,O=C(c1ccc(Cn2cncc2)cc1)N(CC1)CCSC1c1cccs1,2 F6560-5802,Cn1nccc1-c1cc(CNC(Cc(cccc2)c2Cl)=O)cnc1,2 F6381-3627,O=C(CCN(C=CC(N1)=O)C1=O)N(CCCC1)CC1c1ccccc1,2 Z1291278585,O=C(c(cc1)ccc1OC1CCC1)NS(N(CC1)c2c1cccc2)(=O)=O,2 Z2218067651,CCc1cc2c(N3C[C@@H](C)OCC3)ncnc2s1,0 F6448-2373,O=C(Cc1cccc(C(F)(F)F)c1)Nc1cn(CC2Oc(cccc3)c3OC2)nc1,2 SB66-0008,Cc1noc(C)c1CC(N(C[C@H]1CCC2)C[C@@H]1NC2=O)=O,2 F6564-2903,CCOC(N(CC1)CCN1C(CN1N=C(C2CC2)C=CC1=O)=O)=O,2 SA44-1042,CN(CC(C1)(CN1C(c(ccc(Cl)c1)c1OC)=O)C1)C1c1nnc(-c2ccccc2)o1,0 Y044-4948,O=C(CC(c(cc1)ccc1Cl)n1cccc1)NCc1nnc2n1cccc2,2 Z3614869689,C[C@H](C1)O[C@@H](C)c2c1c(C(N1c(ccc(OC)c3)c3OCC1)=O)n[nH]2,2 Z1578040942,CC(c1ncc(C)o1)N(CCC1)CC1c1n[nH]c(C(F)(F)F)c1,2 3381-0815,CCn1c(ccc(CN2CCN(Cc(ccc(OC)c3)c3OC)CC2)c2)c2c2c1cccc2,0 F6656-2403,Cc(n(-c1ccccc1)nc1)c1C(N1CCC(COc2nnc(CCC3)c3c2)CC1)=O,2 F6473-6007,CC(O1)=CC(OC(C2)CN2C(c2ccco2)=O)=CC1=O,2 Z86416911,CCOc(cccc1)c1C(Nc1nncs1)=O,0 Z2802145876,O=C(CCC(N(CCC1)CCC1n1nncc1)=O)N(CC1)N=C1c1ccccc1,2 P681-0169,COc(cc1)cc(C2(CC3)CN3C(Cc(ccc(OC)c3)c3Cl)=O)c1NC2=O,0 Z1176351640,CC(c1cccc(S(N)(=O)=O)c1)N(C)CCN1CCOCC1,2 T854-1049,CC(C)CCN([C@@H](CCCC1)[C@]1(CC1)C(NCc2cnccc2)=O)C1=O,2 F6672-1740,CC=C1CC(CC2)N(Cc3cn(cccc4)c4n3)C2C1,2 Z319930266,CC(C(Nc(cccc1)c1Br)=O)Nc(cc1)cc(N2)c1NC2=O,0 Z196118984,C(c1ccncc1)Nc1c2sccc2ncn1,2 F2870-0374,CCOc(cc1)ccc1-c(cc1)nnc1OCCNS(c1c(C)ccc(C)c1)(=O)=O,2 F6471-8869,CCOc(cccc1)c1NC(N(CC1)CCC1S(c1nccn1C)(=O)=O)=O,2 F5490-1273,Nc1cccc(-c2cnc(NCC3OCCC3)nc2)n1,0 F5679-0003,O=C(Cc1csc(-n2cccc2)n1)NCCc1c[nH]c2c1cccc2,2 SD07-0578,CCCNC(NCc1c(COC(CC2)(CN2C(C2CCC2)=O)C2)n2nn1)=O,0 K284-4741,Cc1ccc(CSC(N2CC(CC3)CCC3C(NCC3OCCC3)=O)=Nc(cccc3)c3C2=O)cc1,0 F946-0186,CCN(Cc1ccccc1)S(c1c(C)ccc(C(C=C2)=NN(c3c(C)onc3C)C2=O)c1)(=O)=O,0 Z1991757821,CNC(C1(CC1)C(Nc(cc1)cc2c1oc(C(O)=O)c2)=O)=O,2 F5857-2305,OC(CNC(COc1ccccc1)=O)c1cccc2ccccc12,0 S824-3472,COC[C@@H](CN(C1)C(COc2ccccc2)=O)[C@H]1c1ccncc1,2 D232-0211,O=C(COc(cc1)ccc1Cl)NCC(c1ccco1)N1CCOCC1,0 S981-0407,Cc1c(COC)c(C(N(CC2)Cc3c2n(C)nc3NC(C2CC2)=O)=O)no1,2 Z1878966291,CC1NCCCC1NC(c(cc1)cc(C(N2CCc3ccccc3)=O)c1C2=O)=O,2 SB18-1011,Cc1n[nH]c([C@H](C[C@@H](C2)NC(c3ccccc3)=O)N2C(c2cnc(C)cc2)=O)n1,2 Z4905893891,C[C@@H](c1cccc(C(F)(F)F)c1)Nc1nc(C)nc2c1cn[nH]2,0 F6608-1799,Fc(cc1)cnc1OCC(C1)CC11CCOCC1,2 Z90655193,Cc(cc1)c(C)cc1SCC(NC1CCN(C)CC1)=O,0 F6524-5566,COc(cc1)nn2c1nnc2CNC(c1c2OCCOc2ccc1)=O,2 Z2213344135,Cc1c(C(NCCNC(c(c(F)ccc2)c2F)=O)=O)nc(C)o1,2 Z1633440654,CCOc(cccc1)c1C(NCC(N(C1)CC11CCCCC1)=O)=O,2 F2083-0289,COc(ccc(C(NCc1c(-c(cc2)ccc2Cl)nc2SCCn12)=O)c1)c1OC,2 SB04-0282,CN(CCN(C(CC1)CN1C(C1CC1)=O)C1CCOCC1)C(Cc(cc1)ccc1F)=O,2 F6359-5001,CS(N(CC1)CCC1C(N(CC1)CCC1Oc(nccc1)c1Br)=O)(=O)=O,2 F2756-1996,Cc(cc1)c2nc(N(CCN3CCOCC3)C(CN(C(CC3)=O)C3=O)=O)sc2c1Cl,2 Z3487066165,CC(C)c1ccc(CNC(C2C(C)(C)NCC2)=O)cc1,0 F6448-2278,Cn(cc1C(Nc2cn(CC3Oc(cccc4)c4OC3)nc2)=O)nc1OC,2 F2197-2361,CN(CC1CCNCC1)c1ncc(C(F)(F)F)cc1,2 S429-1601,CC(CC1)(CCN1S(c(cc1)ccc1OC)(=O)=O)c1noc(C2CCOCC2)n1,0 Z2803047238,CC(C)C(C1(C2)CCCCCC1)N2C(CC1SC(N)=NC1=O)=O,2 F6435-5475,CSC(CC1)CN1C(c(cc1)ccc1OC(F)(F)F)=O,0 SC72-0174,Cc1nc(COC2(C3)CN3C(CCCc3nc(cccc4)c4s3)=O)c2cn1,2 F6678-8097,CC(C)COc(cc1)ncc1C(N(C1)CC1n1c(cccc2)c2nc1)=O,0 8013-3631,OC(c1ccc(C2NCc(cccc3)c3-n3c2ccc3)cc1)=O,0 V030-2888,O=C(CC(C1CCCCC1)c1c[nH]c(cc2)c1cc2Cl)NCCc1ncccc1,2 Z992931080,COCCC(N1CCC(CCC(O)=O)CC1)=O,0 Z2083493546,O=C(C(c1ccccc1)N(CC1)CCN1C(C(CCC1=O)n2c1ccc2)=O)NCc1ccccc1,2 SD02-0359,CC(C)c1nnc(C(C2)N(CC(N(C)C)=O)CC2(CC2)CCN2C(CC2CCCCC2)=O)o1,0 F160-1231,Cc1c(C)oc(N=CN2CCC(NC(CCC3)c4c3cccc4)=O)c1C2=O,2 Z2096211251,CC(C(NC(CC(F)F)C(O)=O)=O)Oc(ccc(Cl)c1)c1Cl,0 F5017-1887,COC(N1CCC(CNS(C)(=O)=O)CC1)=O,0 M785-1688,CC(C)NC(CN(C(c(oc1c2cccc1)c2N1CC(NCC2OCCC2)=O)=O)C1=O)=O,0 F6512-0957,O=S(Cc1ccccc1)(Nc1cc2ccnn2cc1)=O,2 F6523-2721,Cn1c(-c2noc(CNC(CSCc3ccccc3)=O)n2)ccc1,2 F6616-3111,OC(CC1)CCC1NCc(cccc1)c1Br,0 Z2906044775,CN(C(c1coc(CCCN2)c1C2=O)=O)c(cc(cc1)Cl)c1OC,2 CM4286-5499,Cc(cc1)cc(C)c1S(N(CC1)CC1(CC1)CN1c1cnccc1)(=O)=O,0 Z3179193781,COc(cc1)ccc1-c1cc(-c2nn(cnc3c4cccc3)c4n2)n[nH]1,0 G275-1767,O=S(c1ccc(-c2cc(C(F)(F)F)n[nH]2)s1)(N1CCC(Cc2ccccc2)CC1)=O,2 E225-0169,CC(Cn(c1c2)nc2-c(cc2)cc(OC)c2OC)(C(NC2CCCCC2)=O)N(CCOC)C1=O,0 D752-0050,O=C(CN(C(C=C1)=O)N=C1c(cccc1)c1Cl)NCC1(CCCCC1)N(Cc1c2cccc1)C2=O,2 F6246-2514,O=S(c1c(C(F)(F)F)cccc1)(N(CCC1)CC1c1nnc(-c(cccc2)c2F)s1)=O,2 F6606-5310,O=C1N(CC2CCN(Cc3cc(F)cc(F)c3)CC2)C=NC=C1,0 Z647280600,CCc(cc1)ccc1C(N1CCN(CC(Nc2cc(C)nn2-c(cccc2)c2F)=O)CC1)=O,2 F5854-2918,Cc1cc(C(N(Cc2cccn2C)Cc2cccs2)=O)c(C)o1,2 D494-0439,C(CC1)CC1Nc1cc(-c2ccccc2)nc2nc(-c3cnccc3)nn12,2 F6722-1805,Cc1nc(n(C)nc2)c2c(N(CC2)CCN2c2cccc(C(F)(F)F)c2)n1,0 Z28082318,CC(C(N1CC(Nc2cc(-c3nnn[nH]3)ccc2)=O)=O)(c2cc3ccccc3cc2)NC1=O,2 F6523-0751,O=S(C1CC1)(NC(CC1)CCN1c1ncnc2c1CCCC2)=O,2 F6608-0933,C(C1)CC1c1cc(OC2CCSCC2)ncn1,2 P789-0584,Cc(cc1)ccc1N1CCN(CC(c(cc2)cc(OC)c2OC)O)CC1,0 Y040-6226,Cc(cc1)cc(C2(CC(c(ccc(F)c3)c3OC)=O)O)c1NC2=O,0 Z1870155624,Cc1c(C(N(CC2)C(CC(O)=O)c(cc3OC)c2cc3OC)=O)oc2c1cccc2C,0 J006-2851,CCc1c(C2N(Cc(cc3)cc(CN4CCOCC4)c3OC)CCC2)c(C)no1,0 Z2227120768,CC(C)OCC(N(CC1)Cc2c1nc[nH]2)=O,0 C273-0481,Cc1cccn2c1nc(-c(cc1)ccc1SC)c2Nc(cc1)cc2c1OCCO2,0 F6228-0737,Cc1cc(C)nn1CCN(CCC1)CCN1S(C)(=O)=O,2 Z2912213332,CCn1nc(C(N2C(C(O)=O)c(cccc3)c3OCC2)=O)c(C)n1,2 Z1436454679,OCC(C1)OCCN1c(nccc1)c1C(O)=O,0 F6223-0039,CN(C)c(nc1)ncc1NS(Cc1ccccc1)(=O)=O,0 Z353960986,COCCOc(cc1)ccc1S(Nc(cc1)cc(Cl)c1F)(=O)=O,0 F6476-2903,Cc1nc(C(N(CC2)CC2Oc2nccc(C(F)(F)F)c2)=O)cs1,2 F0303-0109,O=C(c1c2c3cccc2ccc1)N(C(CC1)CS1(=O)=O)C3=O,2 F6678-8120,O=C(Cc(ccc(F)c1)c1Br)N(C1)CC1n1c(cccc2)c2nc1,0 SC02-0156,Cc1c(COC)c(C(N(CC2)CC2(CCOC)NC(c(cc2)ccc2F)=O)=O)no1,2 Z2820097022,CC(C)n1nccc1[C@H]1OCC[C@@H]1NC(C(CCC1)N1C(c1ccccc1)=O)=O,2 L694-0293,CCN(c(ccc(S(N(CC1)CCN1C(c1cc(cc(cc2)Cl)c2[nH]1)=O)(=O)=O)c1)c1O1)C1=O,2 Y031-5007,CC(C)N(CC(C1)C(Nc(cc2)cc3c2OCCO3)=O)C1=O,2 F6713-1430,CC(C)(C)C(C=C1)=NN(C(CC2)CCN2c2nc3ccccc3cc2C#N)C1=O,2 Z3052454910,CC1(COC1)C(N1CC(CO)(COC)CC1)=O,0 SC55-1584,CC(C)c1n[nH]c(C2C(C3)(CN3S(C)(=O)=O)CN(Cc3ccccc3)C2)n1,0 S576-0580,Cc1ccc(CNC(C(CC2)CN2C(C=NN2Cc3ccccc3)=CC2=O)=O)o1,2 Z2003996557,O=C(c1ccc(C2CCC2)cc1)N1CC(c2ccncc2)NCC1,2 F670-0109,CC1=Nc(cccc2)c2N(CCC(NCCC2=CCCCC2)=O)C1=O,0 F6374-0269,O=S(c(s1)ccc1Cl)(N1CCC(CSc2ncccc2)CC1)=O,2 F5017-2865,CN(C=CC=C1C(N2CCC(CNS(c(cccc3)c3Cl)(=O)=O)CC2)=O)C1=O,0 F6481-4000,Cc1c(C)c(S(N(CC2)CCSC2c2ccco2)(=O)=O)c(C)c(C)c1,0 SB18-0111,CC(C)CC(N[C@@H](C[C@H]1c2nc(C)n[nH]2)CN1C(c1cscc1)=O)=O,0 F6516-1086,CN(C=CC=C1C(NCc2ccc(-c3cscc3)o2)=O)C1=O,2 F5854-2963,Cn1c(CN(Cc2cccs2)C(Cc(cccc2)c2Cl)=O)ccc1,0 Z2958386670,Cn1c(C2CCC2)nnc1CNC(c1cc(C2CC2)nn1C)=O,2 F6293-0191,Cn1nc(CNC(c(cc(cc2)OC)c2Br)=O)cc1-c1ccco1,0 F6811-1328,Cn(cc1)c2c1c(N(CC1)CCN1C(C=C1)=NN(C)C1=O)ncn2,2 Z2438069273,OC(c1ccc(CS(N(CC2)C[C@@H]3[C@H]2OCC3)(=O)=O)cc1)=O,2 Z1014640598,O=C(C1CN(Cc2cccc(F)c2)CCC1)NCC1OCC(CCC2)N2C1,2 F5095-0633,O=C(c(cc1)cc2c1OCO2)N(CC1)CCN1c1nccn1-c(cccc1)c1F,2 Z1915974605,COc1ccc(C(CNC(c2c[nH]nc2[N+]([O-])=O)=O)c2c[nH]c3c2cccc3)cc1,2 F6448-1777,O=C(c1cscc1)Nc1cn(C2CCOCC2)nc1,2 Z3827715090,O=C(c1cc(occ2)c2s1)N[C@H](CC1)CC[C@@H]1Oc1ccccc1,2 F6522-0273,O=S(c(cccc1)c1Cl)(NCc1cc(-c2ccco2)cs1)=O,2 S637-3127,Cc1nnc(CC2)n1CCC2N(C)C(Cc1cscc1)=O,2 F6681-3332,O=C(c1nc(cccc2)c2s1)N1CC(COc2cnccc2)C1,2 SC04-0709,COc1ccc(C2(CC2)C(N(CCC2)CC2OCCc2noc(C3CC3)n2)=O)cc1,2 Z2915605247,Cc(cc1)nc(Sc2ccccc2)c1C(N(C)C(C1)CS1(=O)=O)=O,2 F6503-5356,Cn1nc(CN(C2CCCC2)C(c2cc3nsnc3cc2)=O)c2c1CCC2,2 Z4917918475,Cc1nc([C@@H](CO)NC(c2c(Cc3ccccc3)n(C)nc2)=O)n[nH]1,2 F6497-0827,COc(ccc(F)c1)c1S(N1CC(Cc2nc(C3CC3)no2)CCC1)(=O)=O,0 F6516-1712,O=C(C1(CCOCC1)c1ccccc1)NCc1ccc(-c2cocc2)o1,2 D473-1764,CC(C)(CS(N1c2cc(C(N(CCC3)c4c3cccc4)=O)ccc2)(=O)=O)C1=O,2 Z1846698667,CC(C)c(n(-c(cccc1)c1Cl)nc1)c1NC(N(CC1)CCC1c1nncn1C)=O,2 F6482-7662,O=C(c1cocc1)NCc1cccnc1-c1cccs1,2 7775-0016,OC(c1c[nH]c2c1cccc2)(c(cccc1)c1N1CCc2ccccc2)C1=O,0 F6125-3711,CCOC(N(CC1)CCN1C(C(C1)CN1C(c1nccnc1)=O)=O)=O,2 V020-5014,O=S(c(cc1)ccc1F)(N1CCN(Cc2noc(-c(cc3)ccc3Cl)n2)CC1)=O,2 F5225-0625,O=C(c1ccco1)Nc(cc1)nnc1SCc(cccc1)c1Cl,2 Z4279874641,CCN(CC)C(Cc1csnc1)=O,0 F6755-7343,COCCc1nsc(N(CC2)CCN2S(C2CC2)(=O)=O)n1,2 F6550-6238,O=C(COc(ccc(Cl)c1)c1Cl)N(C1)CC1Nc1nnccc1,0 F6442-6869,Cc(cccc1)c1OCC(N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F)=O,2 Z2781711338,CC(C)([C@@H]([C@@H]1CCC2)N2C(C(C=CC2=NN3)=CN2C3=O)=O)[C@H]1O,2 F6541-6007,COc1nccc(C(N(C(CC2)C3)C2CC3=C)=O)c1,2 F5788-1115,O=C(CN(CCN1c(cccc2)c2F)C1=O)NCCCn1cncc1,2 Z3050966279,CC(C)(Cc(cc1)ccc1O)C(N1Cc2ncnn2CC1)=O,2 SC13-0573,Cc1nccc(C(N(CCC2)CC2N(Cc2cnccc2)S(C)(=O)=O)=O)c1,2 Z463927498,CC(C)(C)c(cc1)cc(NC(c2cc(Cn3cncc3)ccc2)=O)c1O,2 Z3044132448,CC(CC(C)C1)CN1C(c1csc2nccn12)=O,2 F6561-1409,O=C(CNC(OCc1ccccc1)=O)NCc1cncc(-c2ccco2)c1,2 Z1155437168,CC(C)c1ccc(C2(CCCC2)C(NCCN(CC2)CCS2(=O)=O)=O)cc1,0 8640-0228,CCCSC(NC1=O)=Nc2c1sc1c2COC(C)(CC)C1,2 F6089-8619,CSc1c(CN2CCC(CNC(C3(CCOCC3)c3ccccc3)=O)CC2)cccc1,2 F536-0104,CC(C(N(CC1)CCN1S(c(cc1OC2)c(C)cc1NC2=O)(=O)=O)=O)Oc1cccc(Cl)c1,0 Z1328555506,COc(cc(c(OC)c1)Cl)c1NS(c(cc1)cc(OC)c1Br)(=O)=O,0 Z2440078416,NC(CC1)CCC1NC(C(CCC1)N1C(c(cc1)cc2c1OCO2)=O)=O,2 F6549-3945,Cn1nccc1C(CCCC1)N1C(C(C(OC)=C1)=CN(C)C1=O)=O,2 F3072-0060,O=C(C(CC(C1)C2)(CC1C1)CC12c1ccccc1)N1CCCC1,2 Z2922697884,OC([C@H](C1)[C@H](C2)[C@H]2[C@H]1NC(Cc1ccco1)=O)=O,2 Z4521681907,CC(C1)C1C(N(C1)CC1N(C)C(c1nn(CCCN2)c2n1)=O)=O,2 F6802-9532,O=C(CN(CC1)CCC1Oc1nccs1)NCc1ccccc1,2 Z2086995975,CC(C)Oc(cccc1)c1C(Nc1ncc(-c2ncccc2)s1)=O,0 Y041-2327,Cc1cc(OC(C(CC(N[C@@H](Cc2c[nH]c3c2cccc3)C(O)=O)=O)=C2C)=O)c2c(O)c1,0 V018-1523,CC(C)C(C)NC(C(C(CC1)CCN1C(C1CCCC1)=O)NC(c1cccs1)=O)=O,0 L694-0102,CN(c(ccc(S(N(CC1)CCN1C(c1cc(Br)cnc1)=O)(=O)=O)c1)c1O1)C1=O,2 F543-0323,CC(C)N(c(ccc(-c1noc(C(CC2=O)CN2c2ccccc2)n1)c1)c1N1)C1=O,0 Y204-3929,CCC(CC1)Cc2c1c(C(N)=O)c(NC(C1CCC1)=O)s2,0 L815-0587,O=C(Cc1c[nH]c2c1cccc2)NC(C(N(CCC1)c2c1cccc2)=O)c1ccccc1,2 Z1978948312,CC(c1ncccc1)NC(C[C@H](CCCC1)[C@@H]1O)=O,0 F6713-5982,CCc1cnc(N(CC2)CCN2c2ccc(-c3cnccc3)nn2)nc1,2 G702-1749,Cc(ccc(F)c1)c1Nc1c(CCCC2)c2nc2nc(-c3ccco3)nn12,0 Z2007563522,OC(Cc1cc(C(F)(F)F)ccc1)C(Nc1nc(-c(cc2)cc(CC3)c2NC3=O)cs1)=O,2 F6619-6589,C(CN(CC1)c2ncnc(-n3nccc3)c2)N1c1nc(cccc2)c2s1,2 F6812-1352,Cc1noc(CN(CC2)CCN2c2nc(-c3ncccc3)ccn2)n1,2 Z3057294856,CC(C)C(C(C1)(CC2)CCS2(=O)=O)N1C(C)=O,2 F6523-0852,Cc1cc(C)nn1CCC(NC(CC1)CCN1c1nc(C)nc2c1CCCC2)=O,2 SB96-0010,Cc1nccn1CCN(C(CC1)CN1C(c(ccnc1)c1F)=O)S(C)(=O)=O,2 Z1436156457,COCC(C(O)=O)NS(c1cc(CCC2)c2cc1)(=O)=O,0 Z1411762316,CC(C)COC(C)c1noc(CN2c(cccc3)c3N(C)CCC2C)n1,0 Z2103940145,O=C(C(CC1)CCN1C1CC1)NS(CC1CCCCC1)(=O)=O,2 8008-6336,O=C(COc1ccc(C2CCCCC2)cc1)NCCOc1ccccc1,0 T505-2680,O=C(c1cn(CCC(CCCC2)N2C(c2cccs2)=O)nn1)NCC1CC1,0 Z2843393029,COc1cc(NC(NC(CC2COCC2)c2ccccc2)=O)cnc1,2 CM4573-1789,FC1(CN(Cc2c[nH]nc2-c2ccccc2)[C@H](CN2CCOCC2)C1)F,0 Z1232239907,O=C(c1c(C2CC2)n(-c2ccccc2)nc1)N(CC1)CCC1c1c[nH]nc1,2 F6514-8784,O=C(Cc(c(F)ccc1)c1Cl)NCc1cc(-c2cnccc2)ncc1,2 Z1428412146,CC(C)(C)c1ccc(C(CNC(C2(CCOCC2)c2ccccc2)=O)O)cc1,0 F6556-3023,COc1cccc(NC(NCC2(COCC2)O)=O)c1OC,0 V025-0432,CCc(c(CN(Cc1ccc(CC)cc1)C1CC1)c1N2CCN(C)CC2)nn1-c1cc(C)ccc1,0 S968-0782,O=C(CC1CC1)N(CC1)CCC1(C1)C1NC(c1ccncc1)=O,2 S428-1160,CN(CC(N(CCC1)CC1c1nc(C2CCOCC2)no1)=O)S(c1cccs1)(=O)=O,2 F6481-3193,O=C(c(cccc1)c1S(C(F)F)(=O)=O)N(CC1)CCSC1c(cc(cc1)F)c1F,0 Z1461482302,CC(C)(CC1NC(C(C=C2)=NN(c3ccccc3)C2=O)=O)c2c1cccc2,0 V016-5017,CN(C(CN1Cc2ccco2)=C(C(c2cc(OCc3ccccc3)ccc2)N2)C1=O)C2=O,2 Z1713758426,CC(C(O)=O)N(Cc(cccc1)c1Cl)C(C)=O,0 Z1655397260,CS(CCCNC(c1nccnc1Sc1ccccc1)=O)(=O)=O,0 T842-2418,COCCn1c(cncc2)c2nc1C(CC1)CN1S(c1cccs1)(=O)=O,2 F6541-1614,C(c1nnc2n1CCC2)N(CC1)Cc2c1scc2,2 F6523-4654,O=C(c1cnc(C(F)(F)F)cc1)NC(CC1)CCN1c1nnc(CCCC2)c2c1,2 F6276-1520,Cc1cc(C(N(C2)CC2Oc2nc(c(OC)ccc3)c3s2)=O)c(C)o1,2 F6561-1739,Cc1cc(C(N(C2)CC2OCC2COCC2)=O)no1,2 C618-0899,Cc(cc1)cc(-c2c3cnn2CC(NCCN(C)C2CCCCC2)=O)c1OC3=O,2 Z4145119396,NCC(N(CC1)CCN1C(c1cc(-c(cccc2)c2F)cnc1)=O)=O,0 F6743-9769,CS(NC(CCC1)CN1c1nc(C(F)(F)F)cs1)(=O)=O,0 Z1698187260,Cc1cc(Br)cc(C(NS(C2COCCC2)(=O)=O)=O)c1,0 Z2182687459,OCc1cccc(CNC(NC(Cc2cc(F)c3)COc2c3F)=O)c1,0 Z1638942757,CCCn1ncc(C(NCc2cc(CN(CCC3)CC3C(N)=O)ccc2)=O)c1,0 F6812-1821,Cn(cn1)c2c1ncnc2N(CC1)CCN1c1nc(-c2cnccc2)ccn1,2 M759-2496,CS(N(Cc1cnccc1)C(C1)CN1C(c1c[nH]c2c1cccc2)=O)(=O)=O,2 F6381-6477,COc(cc1)ccc1-c1c[nH]c(CNC(c(cc2)cc3c2OCO3)=O)n1,2 S727-1291,CCn1ncc(C(N(C2)CC2n2nnc(COCC3CC3)c2)=O)c1C,0 F6560-5356,Cn1ncc(-c2cc(CNC(Cn(cc3)c4c3cccc4)=O)cnc2)c1,2 Z1441369255,CC(c(cccc1)c1OC)NC(CN1CC2(CCCC2)OCC1)=O,0 F6660-0458,Cc(nc(c1c2)N(C)Cc3ccccc3)cn1nc2C(Nc(ccc(F)c1)c1F)=O,2 F6529-1240,CN(C(C(F)(F)F)=NN1C(CC2)CCN2C(Nc2c(C(F)(F)F)cccc2)=O)C1=O,2 L302-1462,CCOc(ccc(CNS(c(cc1)cc(C(C)(C)C2)c1N2C(C1CC1)=O)(=O)=O)c1)c1OC,0 Z1510402802,CC(C)(CNC(NC1CC(C)(C)OCC1)=O)c1cccs1,0 F6259-1287,CN(C(C=C1)=O)N=C1N(CC1)CCC1C(NCCc(cc1)ccc1Cl)=O,2 F6497-8004,O=C(CSc(cc1)ccc1F)N(CC1)CCC1c1n[nH]c(C(NCC(F)(F)F)=O)c1,2 G869-1249,Cc1nc(ccc(S(Nc(cc2)ccc2Nc2nc(N3CCCC3)cc(C)n2)(=O)=O)c2)c2s1,2 Z2913000055,OC(C1(CCCC1)C(N(CCC1)CCN1c(cccc1)c1F)=O)=O,0 P074-3814,O=C(c1cccc(Br)c1)NC(c1nnc(N2CCCC2)o1)c1ccccc1,0 F455-0944,COc(cc1)ccc1C(C(c(cc1)ccc1Br)N(Cc1cnccc1)C1=O)=C1O,0 Z239872012,O=C(c1nc2ccccc2cc1)N1CCNCC1,0 F9995-0192,COc1c(C(c(cc2)cc(Cl)c2F)O)cc(cc(cc2)Br)c2n1,2 SD67-0209,CC(C)CN(CC(N(CCC1)C2CN1C(c1cscc1)=O)=O)C2=O,2 SB23-0742,Cc1ccc(CN(C[C@H]2CN(CC3)C(COC)=O)C[C@@]23c2nc(C)n[nH]2)o1,2 C470-0399,CN(c1c(C(N2C)=O)n(Cc3cccc(Cl)c3)c(CN3CCN(Cc4ccccc4)CC3)n1)C2=O,0 F1345-0004,CN(C)S(c(cc1)cc(C2)c1-c(cc1)c2cc1S(N(C)C)(=O)=O)(=O)=O,0 Z1303173959,CN(C(CC1)CC2)C1CN2C(c1cc2cccnc2cc1)=O,2 Z4426446577,O=C(NCC1CCCC1)NS(c1cccc(Cl)c1)(=O)=O,0 F6764-0754,O=C(c1cc2nccnc2cc1)N(CC1)Cc2c1nc1ncc(Br)cc1c2,2 F2736-0887,O=C(CS(c1ccccc1)(=O)=O)N(CCCN1CCOCC1)c1nc(c(F)ccc2)c2s1,2 Z1041172428,CC(C)(CC(Nc1ccncc1)=O)CC(O)=O,0 F0666-0607,O=C(c(o1)ccc1Br)Nc1c(C(Nc(cccc2)c2F)=O)oc2c1cccc2,2 F6782-4104,COc(cc1)ccc1N(C=CN(C1=NN2CC3CC3)C2=O)C1=O,2 SD14-0040,CN(CC(N[C@@H]1[C@H]2CN(Cc(cc3)cc4c3OCCO4)CC1)=O)C2=O,2 Z2755450621,CC(C1)OC(C)C1C(NC(C(O)=O)c(cccc1)c1Br)=O,0 Z3138958227,COCc1cccc(CC(N(C2)CC3(CCC3)C2N)=O)c1,0 Z54747712,O=C(CN1CCOCC1)N(CCC1)c2c1cccc2,2 F6436-3954,COC(N(CC1)Cc2c1ccc(NC(c1csc(-c3ccccc3)n1)=O)c2)=O,2 L629-0606,CCCN1CCN(CCCNC(C(C)C(CC2)CCN2S(c2cccs2)(=O)=O)=O)CC1,2 Z1269640181,O=C(c(cccc1)c1Br)NC(CCC(N1)=O)C1=O,0 Z2987483503,O=C(Cc(c(F)ccc1)c1F)Nc1noc2c1CCCC2,0 Z1739068081,CCCN(CC(O)=O)S(c1cc(S(N(C)C)(=O)=O)ccc1)(=O)=O,0 Z3495164062,CCOCc1cccc(S(Nc2nc(C(C)(F)F)ccc2)(=O)=O)c1,0 F3257-0104,C(/C=C/c1ccccc1)n1c(cccc2)c2nc1CN1CCOCC1,2 F6562-9286,CC(C)Sc1ccc(CC(NCc2nccnc2-c2ccco2)=O)cc1,0 Z4136002342,Cc1cc(F)ncc1Cn1c(-c2ncccc2)ncc1,0 T630-0249,COc1cc(CN(CC2)CCC2c2nnc(C3CC3)[nH]2)cc(OC)c1,2 F6619-6100,Cc1nc(N2CCOCC2)cc(N(CC2)CCN2C(c2c3cccc2)=NS3(=O)=O)n1,2 D754-0148,COc1noc(CCC(NC[C@@H](CN(Cc2c3cccc2)C3=O)c2ccccc2)=O)c1,2 F6514-6691,O=C(COc(ccc(Cl)c1)c1Cl)NC(Cn1nccn1)c1ccccc1,2 F6764-3251,CC(C)OCc1ccc(C(N2Cc3cc4cccnc4nc3CC2)=O)o1,2 F831-0098,O=C(CSc1nnc(c2c3)n1ccn2nc3-c1ccccc1)N1CCCC1,0 F6443-1683,COC(CC1)CCN1c(cc1)ccc1C(N(CC1)CCN1C(c1ccco1)=O)=O,2 V009-2529,CCC(CN(CC1CC1)Cc(c(C)nn1-c2cccc(Cl)c2)c1Oc1ccccc1)O,0 Z1729725846,CN(C)c(cc1)cc(S(N(C2)c(cccc3F)c3NC2=O)(=O)=O)c1Br,0 Z2265625335,CC(CN(Cc(c(C)nn1Cc2ccccc2)c1Cl)C1)NC1=O,2 Z2443482925,CC(CC1)=C(C)CC1C(NS(c(c(C)ccc1)c1Cl)(=O)=O)=O,0 Z2376884984,C[C@@H](CN(C1)C(c2cn(-c3c(C)cccc3)nc2)=O)[C@H]1C(O)=O,0 Z1793633687,CC(C)(CCC1)CN1C(NC[C@H](CC1)CC[C@@H]1C(O)=O)=O,0 F6178-7385,O=C(NCC(CC1)CCN1C1CCOCC1)Nc1cccs1,2 Z3214699004,Oc(cccc1)c1C(N1CCN(CC(N(CCc2c3ccs2)C3c2ccccc2)=O)CC1)=O,0 F6796-3370,CC(C)(C)c(nc1cc2)cn1nc2OCC1CN(Cc2c(C)onc2C)CC1,2 F6812-1895,O=S(c1c2cccc1)(N=C2N(CC1)CCN1c1nc(-c2ccncc2)ccn1)=O,2 F3066-0010,COc(cc1)ccc1-c(o1)nc(S(c2ccccc2)(=O)=O)c1S(C)(=O)=O,0 Z1250710213,OC1(CNC(c2cnns2)=O)CCC1,2 Z1375861070,CS(NCc1ccc(C(N(CC2)CCC2C(c(cccc2)c2N2)C2=O)=O)o1)(=O)=O,0 Z805869392,NC(c1csc(C(N(CC2)CCN2C(C2OCCC2)=O)=O)c1)=O,0 3209-0791,O=C(c1c(N[C@@H](C[C@@H]2C(F)(F)F)c3cccs3)n2nc1)N1CCOCC1,2 F2871-0081,Cc1c(C(NCCOc(cc2)nnc2-c2ccco2)=O)sc(-c2ccccc2)n1,2 Z432476980,CC1N(Cc2ccc(CNC(NCCCO)=O)cc2)CCCC1,0 S640-0191,Cc1cc(C(N(C[C@@H]2C(N)=O)C[C@@H]2c2nc(C)no2)=O)c(C)n1CCOC,2 Z1323956038,CC(CC(C)(C)c1ccccc1)NC(c(nc1C)nn1-c1nnc(C(F)(F)F)[nH]1)=O,2 V013-6200,C(C1)C1c1nc(N2CCCCC2)c(c(CCCCC2)c2s2)c2n1,2 Z3686696659,Cc1nnc(C(CC2)CCN2c2ncnc(N(C3)[C@@H](CN(C)C)C[C@H]3O)c2)o1,2 Z2018007683,Cc([nH]c1ccc2)nc1c2C(NCc1ccccc1)=O,0 Z966271352,O=C(C(CC1)CCN1c1nn2nnnc2cc1)Nc1cccc(C(N(CC2)c3c2cccc3)=O)c1,2 F2539-0319,CCOc1ccc(CC(NC(CC2=O)CN2c2cc(C)c(C)cc2)=O)cc1,2 Z2963979625,CC(C(NCc1c(-c(cc2)ccc2F)nc2n1cc(C)cc2)=O)OC,0 E786-0580,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(CCC(Nc1nc(ccc(C)c2)c2s1)=O)(=O)=O,2 Z1635892570,Cc1nscc1C(NCC1CN(Cc2ccccc2)CCC1)=O,2 F6184-0220,O=C(C1(CC1)c(cc1)ccc1F)N(CC1)CCC1c1cccs1,2 Z1067097486,Cc(cc1NC(c(c(Cl)c2)cc(F)c2Cl)=O)nn1-c1nc(C)cc(C)n1,0 F6241-0366,O=C(C(COC1)N(Cc2ccccc2)C1=O)NCc(cccc1)c1OC(F)(F)F,0 F6773-4724,Cc1cnc(C)c(OC(CC2)CCN2c2nc(cncc3)c3s2)n1,2 F6443-7277,O=C(C(c1ccccc1)c1ccccc1)NCC(CCC1)N1c1ncccc1,2 S974-0524,CC(C)C[C@@H](C(N(C[C@H](C1)N(C)C)[C@@H]1C1)=O)N1C(Cc(cccc1)c1F)=O,0 Z1241788271,CN(CCC1NC(NC2CCN(Cc(cc3)cc(F)c3F)CC2)=O)C1=O,2 Z2954244844,CC(C)C(c(cccc1)c1Cl)N(C)C(C(C(OC)=C1)=CNC1=O)=O,0 F6523-4058,CCSc(cccc1)c1C(NC(CCC1=NN2)CC1=CC2=O)=O,0 Z2213386329,O=C(NCC1(Cc(cc2)ccc2F)CC1)N(CC1)Cc2c1n(-c1ccccc1)nn2,2 F6562-8480,O=C(NCC1c(cccc2)c2OC1)NC1CCOCC1,2 Z2466249193,CCNS(c(cc1)ccc1-c1c(C)onc1C)(=O)=O,0 F2184-0341,Nc(cc1)cnc1-c1cnc(N2C(CC3)CC3C2)nc1,2 S726-1985,O=C(NCc1ccccc1)N(CC1)CCC11OCCC(CCOCc2ccccc2)C1,2 F6481-0936,O=C(c(cc1)ccc1N1CCOCC1)N(CC1)CCSC1c(cccc1)c1Cl,0 Z1182422130,CC(c1nc(cc(cc2)Cl)c2[nH]1)NC(c(cc1)ccc1Cl)=O,0 F6472-0776,O=C(Cc1cccc2ccccc12)NCCSC1CCOCC1,2 Z2305154369,COc1cccc(CNC(N2CCC(Cc3cccc(F)c3F)CC2)=O)n1,2 Z3352598954,CCN(C(CC1)=O)c(cc2)c1cc2NC(c1c(CCCC2)c2cnc1)=O,2 S555-1600,O=C(CN(CCC1)C1=O)N1Cc(cc(cc2)NC(C3CC3)=O)c2OCC1,2 Z4444512735,O=C1ON=C(Cc(cc2)ccc2F)N1Cc1nn(C2CCCCC2)cc1,2 F6561-7631,O=C(c1nn(-c2ccccc2)nc1)NC1CN(Cc2cscc2)CC1,2 F6713-4831,FC(c(cc1)nnc1N(CC1)CCN1c(cc1)nn2c1ncc2)(F)F,2 S576-0910,COCCN1N=CC(N(CC2)CC2C(Nc(cc2)cc3c2oc(-c2ccccc2)n3)=O)=CC1=O,0 F6561-7690,O=C(c1cc2nccnc2cc1)NC1CN(Cc2cscc2)CC1,2 F797-0627,COc(c(OC)c1)cc2c1[nH]c1c2N=CN(CCC(NCc2ccc(C(F)(F)F)cc2)=O)C1=O,0 Z2680273081,COC(CC1)(CN1S(c1cccc(Cl)c1)(=O)=O)C(O)=O,0 S720-0109,O=C([C@H](C[C@@H](C1)Oc2ccccc2)N1C(C(c1c2cccc1)=NNC2=O)=O)N1CCOCC1,2 Z1829649671,O=C(C1(CC1)c(cccc1)c1Br)N(CC1)CC1n1ncnc1,0 Z1732245573,Cc1c(CN(CC2)CCN2C(Nc2ccnn2C)=O)cccc1,2 Z4884575400,Cn1ncc(C(C(NS(c2cc(C#N)cc(Br)c2)(=O)=O)=O)N)c1,0 G394-0755,CCCN(CC1)CCN1c1c(c(C)c(C(N2CCCC2)=O)s2)c2ncn1,2 F6666-5460,FC(F)(F)Sc(cc1)ccc1NCc1ccco1,0 S940-0224,O=C(Nc1cccc(C(F)(F)F)c1)N1CC(Cc2nc(-c3cnccc3)no2)C1,2 SC19-0663,CCn1nc(CN(CC2)CCC2NC(CC2CCCCC2)=O)c2c1CCOC2,2 Z3015837915,OCC1(CO)N(CC(Nc2cc(CCC3)c3cc2)=O)CCC1,2 Z1798778816,CC(Cc1cc(OC)ccc1)NC(N1C(CO)C(C)CC1)=O,0 8008-4093,O=C(CSc(cc1)ccc1Cl)NCc(cc1)ccc1Cl,2 F6809-1230,OC1(CCN(CC(NCC2OCCC2)=O)CC1)c(cc1)ccc1Cl,2 F0843-0009,O=C(c1c2cccc1)N(CCSc1nnc(C3Oc(cccc4)c4OC3)n1-c1ccccc1)C2=O,2 S808-0409,CN(C)C([C@@](CC1)(CN(Cc2cccs2)CC2)[C@@H]2N(C)S1(=O)=O)=O,0 P073-0952,Cc1cccc(CN(c2c(N3CCNC(C4COCC4)=O)nccc2)C3=O)c1,2 Z1037790962,Cc1noc(C(CC2)CCN2C(C2(CC2)c2c(C)cccc2)=O)n1,2 Z1526667673,CCC(C)(CN)C(Nc(cc1)cc2c1[nH]nc2)=O,0 F6448-0243,O=C(c1ncccc1)Nc1cn(CC2OCCCC2)nc1,2 F6514-6813,O=C(NCc1cccs1)NC(Cn1nccn1)c1ccccc1,2 SA01-0715,CC(C)NC(c1cnc(N(C)C)nc1C1CN(Cc2cc(F)cc(F)c2)CC1)=O,0 F2775-0049,CCN(CC)CCSc(cc1)nnc1-c(cc1)ccc1Cl,0 F6805-3651,O=C1N(CC2CCN(Cc3noc(C4CCOCC4)n3)CC2)C=Nc2c1ccc(F)c2,2 Z4009103145,Cn1c([C@@H](CN(C2)C([C@@H]3C[C@H](C4)[C@H]4C3)=O)[C@H]2C(O)=O)cnc1,2 J500-0237,COCCNC(C(C1)C2(CCCC2)CN1C(c1cscn1)=O)=O,2 F6573-8265,O=C(Cc1cccs1)N(CCN1c(nc2)ncc2F)CC1=O,2 Z1169940726,O=C(c1cnccc1)N(CC1)CCC1c1nc(-c(c(Cl)ccc2)c2Cl)no1,2 Z1981006941,CCN(C(c1nn(CCCO2)c2c1)=O)c1c(C)nccc1,0 F455-0133,COc(cc1)ccc1C(C(c1cccc(Br)c1)N(Cc(cccc1)c1OC)C1=O)=C1O,0 F0832-0200,CC(C)N(C(CSc1nc(O)cc(C)n1)=O)c1ccccc1,0 Z3102852025,O=C(NCc(nc1)ncc1Br)NC(C1)C11CCCCC1,2 Y041-5012,N1(C(c2c(C1)cccc2)=O)[C@H](C(NC1Cc2c(C1)cccc2)=O)CC(C)C,2 F3351-0301,O=C(CCCCCN(C=Nc1c2cccc1)C2=O)Nc(cc1)cc2c1OCCO2,2 D115-0077,CCn1c(cccc2)c2c(C(CC(N2c(cc3)ccc3Br)=O)C2=O)c1,0 4676-0705,OC(c(cccc1)c1SC(CC(N1c(cc2)ccc2N2CCCCC2)=O)C1=O)=O,2 F5541-0043,CC(C)(COc(cc(cc1)NC(NC(c2ccccc2)c2ccccc2)=O)c1N1C)C1=O,2 V005-6466,O=S(c1cccc(Cl)c1)(N(CC1)CCN1c1nc(-c(cc2)ccc2N2CCOCC2)ccn1)=O,2 Z850899646,CC(C)CC(Nc1cccc(CNC(N2CCN(CC(N3C(C)CCCC3)=O)CC2)=O)c1)=O,0 F5940-0532,O=C(c1nc(cccc2)c2s1)N1CCC(COCc2ccccc2)CC1,2 F3411-6922,CCCN(C(N1c2c3ccc(Cl)c2)=NN(CC(c2c(C)[nH]c4c2cccc4)=O)C1=O)C3=O,2 8010-0635,CCN(CC)C(CN(C(C1(CC(c(cc2)ccc2Br)=O)O)=O)c2c1cccc2)=O,0 F3222-2340,Cc1cc(C)nc2c1c(N=CN(CC(NCc(cccc1)c1Cl)=O)C1=O)c1s2,0 F5591-0578,CC(C)c1nc(-c(cc2)cnc2N(CC2)CCN2C(c2c(C)onc2C)=O)no1,2 Z4906042020,CC(NCc(cc1)ccc1C(OCc1cc(Cl)c(C)cc1)=O)=O,0 F828-0917,Cc(n(-c(cc1)ccc1Cl)nc1C)c1S(N(CC1)CCN1c1ncccc1)(=O)=O,2 F6514-2802,O=C(CNS(c1cc(F)ccc1)(=O)=O)N(C1)CC1OCC(F)(F)F,0 Z2273277460,CCS(c1ccc(CN(CCC2)C2c2cnccc2)cc1)(=O)=O,0 F6496-4010,Cc1c(C(N2CCC(CN(C(C=C3)=O)N=C3c(cc3)ccc3F)CC2)=O)c(C)nn1C,2 F6416-8098,OC(CCNC(c(cccc1)c1Br)=O)c1cocc1,0 F6443-5866,COc(cc1)cc(OC)c1NC(NCc1cc(Oc2ncccc2)ccc1)=O,2 SB36-0671,O=C(Cn1nccc1)N(C1)[C@H](Cn2nnc(C(N3CCOCC3)=O)c2)CC1(F)F,2 K288-0488,O=C(c(cc1)cc(NC(N2CCC3=CCCCC3)=S)c1C2=O)NC1CCCCCC1,2 V011-6562,CC(C)CNC(c1ccc(CN(CC2)CCN2c2ccc(C)cc2)o1)=O,0 G756-0903,CCC(C(Nc(cccc1)c1OCC(N=C1N2C=CC(C)=C1)=CC2=O)=O)Oc1ccccc1,2 Z2932003266,Cn1ncc(Cl)c1S(N[C@H](Cc1c2cccc1)[C@@H]2N)(=O)=O,0 SD01-0438,COCCCn(c1c2CN(Cc(cc3)cc4c3OCC4)CC1)nc2-c1cocn1,2 F6523-0807,CC(NC(CCSC)C(NC(CC1)CCN1c1nc(C)nc2c1CCCC2)=O)=O,0 F6502-0194,Cc1cc(C(NCCn2c(-c3ncccc3)ncc2)=O)c(C)o1,2 Z2912359027,OC(c1coc(C(NCC(c2ccccc2)N2CCOCC2)=O)c1)=O,0 S926-7636,O=S(Cc1ccccc1)(N(CCC1)CC1OCc1noc(C2CCOCC2)n1)=O,2 6325-0277,O=C(Cn1c2nc(-c3ccccc3)nn2c2c1cccc2)c(cc1)ccc1Br,2 Z2755594536,C[C@@H](CN(C1)C(c2cc(cc(cc3)Br)c3[nH]2)=O)[C@@]1(C)C(O)=O,0 F0715-0253,CCc(cccc1)c1NC(c(cc(s1)Cl)c1Cl)=O,0 F6192-1084,CSc(nccc1)c1C(NCC(c1cscc1)c1ccco1)=O,2 SA65-1035,COc(ccc(F)c1)c1S(N1CCC(CCc2noc(C3CC3)n2)CC1)(=O)=O,0 SC69-0081,Cn1c(C(C2)C3(CCCC3)CN2C(CC2CC2)=O)nnc1,2 F6383-0718,COCCc1noc(C(CC2)CCN2C(NCCCc2ccccc2)=O)n1,2 S296-4432,Cc1cc(C)c(CN(C[C@H]2C(N3CCCN(CCC4)C4=O)=O)C[C@@H]2C3=O)cc1,0 Z1870338736,OC(CCC(Cc1ccccc1)NC(C(C1)C1c1cccc(F)c1)=O)=O,0 S699-0507,CN(CCc1noc(C(C2)CN2C(NC2CCCCC2)=O)n1)C(C1CC1)=O,2 M023-0199,Cc1c(C(N2CCCC2)=O)sc(-c2csc(S(N3CCOCC3)(=O)=O)c2)n1,2 Z4126467763,O=C(N[C@@H](CCC1)C[C@@H]1C1CC1)Nc1cnc(C(F)(F)F)cc1,0 F6442-8603,Cc1ccc(cccc2C(N(CC3)CCC3N(CC3)CCC3Oc3nccs3)=O)c2n1,2 Z2279207199,CCS(N(CCC1)CCc2c1cccc2)(=O)=O,0 8012-9930,O=C(c1nn2c(C(F)(F)Cl)cc(-c3cccs3)nc2c1)NCCCN1CCOCC1,2 8014-2325,CC(CC1NCc(cccc2)c2-n2c1ccc2)c1ccccc1,2 Z244501512,O=C(C1CC1)N(CC1)CCC1C(Nc(cc1)ncc1Cl)=O,0 F6553-0370,Cc1cccc(NC(N(CC2)CC2c2cccs2)=O)c1,2 F5857-0618,OC(CNS(c1cc(C(F)(F)F)ccc1)(=O)=O)(C1CC1)c1ccco1,2 F6795-5818,Cc1nccn1-c(cc1)nnc1N(CC1)CCN1c1nccc(C(F)(F)F)n1,2 Z2232701507,Cn1nccc1C(N1CCC(CO)CCC1)=O,0 F6559-6631,Cn1ncc(-c2noc(CNc3c(cc(cc4)F)c4ncn3)n2)c1,2 G501-0162,Cc(s1)ccc1S(NCC(c(cc1)ccc1N(C)C)N1CCOCC1)(=O)=O,0 F5868-0038,COc(ccc(CCNC(COc1ncccn1)=O)c1)c1OC,0 Z3687016864,Cc1n[nH]c(cc2)c1cc2C(N[C@@H](CC(Cn1nccc1)C1)[C@H]1O)=O,0 Z3602392633,CO[C@@H]1C[C@H](CNC(c2cc(-c(cc3)ccc3Br)n[nH]2)=O)OCC1,2 Z1198499504,O=C(C1CCCC1)OCc1nc(-c2ccncc2)no1,2 F6363-0042,Cc1nc(-n2nccc2)cc(OCC(Nc(cc(C(F)(F)F)cc2)c2Cl)=O)n1,0 F6517-2018,CC(C)NC(NCC(c1ccc(-c2ccco2)s1)O)=O,0 F6469-0507,CCn1nc(C)c(S(Nc(cccc2)c2-c2cn(CCS3)c3n2)(=O)=O)c1C,2 E216-0400,CC(C1)Oc(ccc(Cl)c2)c2N1C(N(CC1)CCC1C(NCCC1=CCCCC1)=O)=O,0 F6562-8676,O=C(c(ccc(F)c1)c1Cl)NCc1nccnc1-c1cscc1,0 Z3143706585,O=C(C1NCC11CCCC1)NCCN(C=CC(N1)=O)C1=O,2 F6503-4081,CCOc(cccc1)c1NC(N(Cc1nn(C)c(C2CC2)c1)Cc1ccco1)=O,2 F6791-9525,CN(CC1OCCOC1)c1ncnc(C2CCC2)c1,2 SA47-0189,CC1(COC(C2)(CN2C(c2c(C)n(CCOC)c(-c3ccc(C)cc3)c2)=O)C1)O,0 Z91935154,Fc(cccc1)c1-c(n1Cc2ccccc2)nnc1SCc1nnnn1-c1ccccc1,2 S664-0130,Cc1cc(C(N(CC2)CCC2(CC2)C2OC)=O)nn1C,2 F3406-7202,CC1=C(C)N=CN(CC(Nc(ccc(Br)c2)c2F)=O)C1=O,0 T158-0769,CC(C)n1c(C(CC2)CN2C(Nc2ccccc2)=O)ncc1C,0 Z1643004603,FC(c1nn(C(CCC2)CN2c2nccn3c2nnc3)cc1)(F)F,2 Z1434393405,Cc(cc1NC(c(cc2)cc(Cl)c2Br)=O)nn1-c1nnc(C)cc1,0 Z1843654779,CC(C)(CS(NC(C(C1CCOCC1)(F)F)=O)(=O)=O)C#N,0 F6496-3967,O=C(c1cscc1)N1CCC(CN(C(C=C2)=O)N=C2c(cc2)ccc2F)CC1,2 Z2901006463,CC(CCN(C1)c2nccc(Cl)c2)C1O,0 Z3642783652,CC(C1)(C2)OC3(CCC3)C12NC(c1cc(Cc2ncccc2)ccc1)=O,2 Z2923360769,O=S(c(occ1)c1Br)(NC1(CCC2)C2NCC1)=O,2 Z1174802405,CC(C)(C)C(NCC(N(CC1)CCC1c1nncn1C1CC1)=O)=O,0 Z981088484,NC(C1CN(Cc(cccc2)c2NC(c(cc2)nn2-c2ccccc2)=O)CCC1)=O,0 F2758-3065,O=C1N(CCN2CCCC2)N=C(CNS(c2cnccc2)(=O)=O)c2c1cccc2,2 F6278-0024,COCc1nn(C(CC(Nc(cccc2)c2C(OC)=O)=O)C(N2)=O)c2c1-c1ccccc1,0 Z2569343558,OC1(CN(C=Nc(c2ccc3)c3Cl)C2=O)COCCC1,0 SA23-1201,CN(C)C[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1nnccc1)=O,2 Y205-5582,Cc1c(NS(c(cc2)ccc2NC(C(C2CC3CC2)C3C(O)=O)=O)(=O)=O)onc1C,2 F1813-0725,COc(cc1)c2nc(NC(c(cccc3)c3OC)=O)sc2c1OC,0 F6482-6478,CC(Nc1ccc(CC(NCc(cc2)cnc2-c2ccco2)=O)cc1)=O,2 Z1538646874,CC(C)OCCN(CC1)CCN1C(Nc1cnc(C(F)(F)F)cc1)=O,0 F6520-1688,COc1cccc2c1oc(C(NCCc1ccc(-c3cocc3)s1)=O)c2,2 F6244-2780,O=C(CSC1CCCC1)NCC#CCN(CC1)Cc2c1cccc2,2 F6673-4634,Cc1cnc(N(C)C(CCC2)CN2C(c2cc(cccc3OC)c3o2)=O)nc1,2 Z3290575412,C[C@@H](CS(NC1CCCC1)(=O)=O)NC(OCc1ccccc1)=O,2 SA46-1169,O=C(CN(c(ccc(Cl)c1)c1O1)C1=O)N(C1)CC1(C1)OCC1N1CCCC1,2 SA68-0805,CC(C)N(CC1)CCC1N(CCNS(c1c(C)ccc(F)c1)(=O)=O)C1CCOCC1,0 F6525-0167,Cn1nnc(C(NCc2c(CCC3)c3nn2C)=O)c1,2 Z1103607251,CCCN(CCC)C(c1cccc(C(N(CC2)Cc3c2ccc(O)c3)=O)c1)=O,0 F6517-4764,CCSc(cccc1)c1C(NCC(c(cc1)ccc1-c1cscc1)O)=O,0 F6111-1307,Cc1noc(C)c1CCC(N1CCC(COCc(cc2)ccc2Cl)CC1)=O,2 F6374-3562,COc(ccc(CC(N1CCC(CSC2=NCCS2)CC1)=O)c1)c1OC,0 S296-0788,Cc1cc(C)c(CN(C[C@H]2C(N3CCOC)=O)C[C@@H]2C3=O)cc1,0 C519-0392,CN(C=C1C(NCC2Oc(cccc3)c3OC2)=O)c(ccc(S(N2CCCCC2)(=O)=O)c2)c2C1=O,0 SC98-1051,CCOCCn(c(CC1)c2CN1S(Cc1ccc(C)cc1)(=O)=O)nc2-c1ncc(C)o1,0 Z1997311415,O=C(NCCc(cc1)cc2c1[nH]cc2)N1C(CN(CCC2)C2=O)CCCC1,2 E957-2108,O=C(COc1ccccc1)Nc1c(C(N(CC2)CCN2c(cc2)ccc2F)=O)oc2c1cccc2,0 P223-1093,COc(cc1)nc(OC)c1C(N(CCC1)CC1c1nn(CCCNC2=O)c2c1)=O,2 Z3622878288,CC1(C)OC(CCC2)(CN2S(c2c(C(F)F)cccc2)(=O)=O)NC1=O,2 Z1602658464,Cc(n(CC(NCC(N1CCOCC1)=O)=O)nc1C)c1Cl,0 Z4238068066,CN[C@@H](CCC1)[C@@]1(c1ccccc1)O,0 Z1889649269,CC(COC)n(cc1)nc1NC(NC(CCC1)CN1c1cc(C)nn1C)=O,2 SC72-0620,CCOc(ccc(CN(C1)CC11OCc2c1cnc(-c1ccccc1)n2)c1)c1OC,0 F5260-0366,Cn1c(C(CNC(Cc(cc2)ccc2F)=O)N2CCCCCC2)ccc1,2 F5687-0038,CCS(NCCN1N=C(c2ccccc2)N(C2CC2)C1=O)(=O)=O,2 F1008-0212,COc(cc1)cc(F)c1C(CSC(N1CC=C)=Nc(cccc2)c2C1=O)=O,2 Z4497430986,CCC(C(C)C)(C(N)=O)NC(C1=CN=C(C2CCC2)NC1=O)=O,2 F6276-1537,Cn(cc1C(N(C2)CC2Oc2nc(c(OC)ccc3)c3s2)=O)nc1OC,2 SA93-0979,Cc1ccc(CS(N(CC2)CCC2N(CCC2)CC2(CCOC)C(N)=O)(=O)=O)cc1,0 Z1518097785,CC(Cc(cccc1)c1F)NC(N(CC1)CC1c1nccn1C)=O,0 V021-2236,O=C(C(C1)CN(Cc(cc2)ccc2OC(F)(F)F)C1=O)NCCOc1ccccc1,0 F6806-7027,O=C(CN1CC(C(N2CCSCC2)=O)OCC1)Nc(cc1)cc2c1OCCO2,2 S968-0307,CC(C)C(NC(C1)C1(CC1)CCN1C(c1noc(C)c1COC)=O)=O,2 Z4282359822,CC(C(c(cc1)ccc1Br)O)NC([C@H](C[C@H](C1)O)N1C(C)=O)=O,0 F6411-1051,CCOC(c(cc1)ccc1NC(CN(C=CN(Cc(cc1)ccc1Cl)C1=O)C1=O)=O)=O,0 D337-1334,O=C(c1noc(-c(cc2)cc3c2OCCO3)c1)Nc(cc1)ccc1S(N1CCOCC1)(=O)=O,2 F6783-7145,Cc1nc(CCC2)c2c(N(C2)CC(C3)C2CN3c(nc2)ncc2Cl)n1,2 Z1197685914,CC(c1nc(-c2cscc2)no1)NC(C(C)(C)C)=O,2 SC46-0482,CC(C)c1n[nH]c(C(C2)C3(CCCC3)CN2C(c2nccnc2)=O)n1,2 F6802-7671,N#Cc1ccnc(N(CC2)CCC2C(N(CC2)CCC2(F)F)=O)n1,0 Z2800416085,C=C(C1)C1C(NCCC(N1)=NNC1=O)=O,2 Z951822874,CC(C)(C)c1nc(C)c(C(NC(CN2CCOCC2)c2ccc(C)cc2)=O)s1,0 F1639-0339,Cc(cc(c(S(N1CCN(Cc2ccccc2)CC1)(=O)=O)c1)OC)c1Cl,0 F6724-5125,Cc1nccc(N2CCC(CNc3nc(cncc4)c4s3)CC2)c1,2 P425-0503,COc1cccc(NC(c2cn(CCCC3)c3n2)=O)c1,0 Z2951526057,CCc(cc1)cc(CC2)c1N2C(Nc1cnnn1C)=O,2 F6563-0075,O=C(C1(CC(C2)C3)CC3CC2C1)N(CC1)CCC1Oc1cscc1,2 V015-6118,O=C(c1cccs1)N(Cc(n1C2CC2)cnc1S(Cc1cc(C(F)(F)F)ccc1)(=O)=O)C1CC1,2 S957-5357,COCC(CN(C1)c(cc2)cc(C(F)(F)F)c2C#N)C1(CC1)CCN1C(Nc(cc1)ccc1F)=O,0 F5831-1576,O=C(C1(CCCC1)c1cccs1)NCC(c1cccs1)S(c(cc1)ccc1F)(=O)=O,2 F6495-4070,Cc1nc(cc(cc2)NC(C(C3)CN3c3ncnc(-c4ccccc4)c3)=O)c2s1,2 Z4425706472,O=C(c1c2[nH]ccc2cc(F)c1)N(CC1)CC1(CC1)CN1C(c1c2occc2cc(F)c1)=O,2 F3395-0289,O=C(C1Oc(cccc2)c2OC1)N(CC1)CCC1N(CC1)CCN1c1cccc(C(F)(F)F)c1,2 Z1587659466,CC(c1n[nH]cn1)NC(N1CCOCC1)=O,0 F6443-7923,COc1cc([nH]c(C(NCC(CCC2)N2c2ccccc2)=O)c2)c2cc1,2 Z4025387449,CC(C(C)(C)CN(C)C)Nc1c(C)c(Cl)nc(-c2ncccn2)n1,0 F6608-3891,CC(C)N1CCN(CC#CCOC(CC2)CCN2c2nc(C)ns2)CC1,2 F6110-1875,CC1N(CC(CC2)CCN2C(c2nccnc2)=O)CCN(C)C1,2 Z1286325238,CC(CNC(c1ccc[nH]1)=O)(C1CC1)O,2 V010-1270,CC(C)CN(CCC(N(CC1)CCN1c(cccc1)c1F)=O)c1nc(C2CC2)nc2ccccc12,0 S606-0058,Cc(cc1)ncc1C(N(CC1)C[C@@H]1N(c(nccc1)c1N1C)C1=O)=O,0 T634-0791,Cc1noc(C)c1S(N1Cc(cc(CN2CCCCC2)cc2)c2OCC1)(=O)=O,2 S985-1097,CC(C)NC(N(C[C@@H]1CN(Cc2ccccc2)C2)C[C@@]12C(N(C)C)=O)=O,0 SC72-0646,Cc1cc(C(N(C2)CC22OCc3c2cnc(-c2ccccc2)n3)=O)c(C)n1CCOC,2 F2391-0672,O=C(c(ccc(F)c1)c1F)Nc1cc(CN(CC2)S(c3cccs3)(=O)=O)c2cc1,2 Z764465588,CN(CCC1)CC1NCc(cc(cc1)OC)c1OC,2 Z1535270920,OC(CC1)(CCN1C(c1cn(Cc2ccccc2)nc1-c1ccccc1)=O)C(F)(F)F,0 F6438-2476,CN(C)c(nc(N(C)C)nc1)c1NC(Nc(cc1)cc2c1OCO2)=O,2 F6353-6243,O=C(COc(ccc(Cl)c1)c1Cl)NCC(c1ccco1)N1CCSCC1,2 F6561-3575,C=C(CC1)CCC1NC(CCc1cccc(Cl)c1)=O,0 Z1449760265,O=C(C1NCCC1)N(CC1)c2c1cccc2,2 F6521-9003,CCN(CCN(C(NCC(C1)(Cc2c1cccc2)O)=O)C1=O)C1=O,2 F6476-1411,COc(cccc1)c1-c1n[nH]c(C(N(CC2)CC2Oc(nccc2)c2Br)=O)c1,2 Z1455199250,CC(C)(CCC(O)=O)NC(CN(C=C(C(N1)=O)Br)C1=O)=O,0 SB76-0502,O=C(NCCc1ccccc1)N(C1)C[C@@H](CN2)[C@H]1CC2=O,2 G406-0170,Cc(cc1)cc2c1nc(NC(CN(C(CC1)=O)c(cc3)c1cc3S(N1CCCC1)(=O)=O)=O)s2,2 F6192-0349,O=C(C(NCc1ccccc1)=O)NCC(c1ccco1)c1ccco1,2 Z1765554895,CC(C1)N(CC(C)(C)O)CCN1c1nc(C2CC2)nc(C)c1,0 F1872-0272,COc(cccc1)c1-n1c(SCC(Nc2nc(cccc3)c3s2)=O)ncc1,2 F6541-0776,OC1CN(Cc(o2)ccc2Br)CCC1,0 Z1573247776,Clc(ccc(CNc1cc(-c2nnc[nH]2)ccc1)c1)c1Cl,0 Z1473029918,C(C1)C1c1noc(C2CCNCC2)n1,2 D399-2902,COc(cc1)cc(OC)c1NC(N(CCC1)C1c(cc1)ccc1Cl)=O,0 Z1332845646,CC(CN(CC1)c2cc(C)c(C)cc2)N1S(c(cc1)cc(C(N2)=O)c1NC2=O)(=O)=O,0 Z1473577007,Cc(c(F)c1)cc(S(NC(C2OCCCC2)=O)(=O)=O)c1F,0 Z2960330650,Cn1ncc(C2)c1CCCN2C(c1c(C2CC2)oc(C2CC2)c1)=O,2 F5912-0942,CCOc(cc1)ccc1C(N=CN1CCCC(Nc2cccc(SC)c2)=O)=CC1=O,0 Z2796344463,CN(Cc(cc1)ccc1C(NC1CC1)=O)C([C@H]1N(C)CCCC1)=O,2 Z2832187013,CCC(C(N(CCC1)CC1O)=O)c1c(C)nc(SCC)s1,0 S858-2030,Cc1c(C(N2C[C@](CO)(CN(C3)S(C)(=O)=O)[C@H]3CC2)=O)occ1,2 Z1268498591,Cc1nn(C)c(CNCC2(CCCC2)O)c1,2 F8890-6533,O=C(CN1N=C(C(N(Cc2cc(F)ccc2)CC2)=O)N2C1=O)Nc(cccc1)c1F,2 Z1991703438,CN(CCc(cccc1)c1OC)C(c(nc1)cnc1C(O)=O)=O,0 F6521-5652,COC(CCSC)CNC(Nc(cc1)cc2c1OCO2)=O,0 F6796-6754,Cc1nc2ncnn2c(N(CC2)CCN2C(N2)=NC(C(F)F)=CC2=O)c1,2 F2005-0153,C(c1ncccc1)Sc(cc1)nnc1-c1ccncc1,2 F6806-8087,CC(C)(C)NC(C(CC1)CN1c(c(F)c1)ncc1Br)=O,0 Z991508776,Cc1c(CCC(NC(CCOC)C(O)=O)=O)c(C)nn1C,0 F6210-0215,O=C(Cc(cc1)ccc1-c1ccccc1)NC(C1)CNC1=O,2 Z2092770322,CC(C)CC(C(NCC1)=O)N1c1nc(C(F)(F)F)ns1,0 F541-0686,CC(c1nc(-c(cc2)cc(N=C3C)c2N(C2CCCC2)C3=O)no1)Oc1ccccc1,0 Z961746360,CC(C)CC(N(CC1)CCC1NC(c1c2nc[nH]c2cc(F)c1)=O)=O,2 D399-3150,Cc1cccc(NC(N(CCC2)C2c(cc2)ccc2OC)=O)c1C,0 S808-0302,Cc1ccc(CN(CC[C@H]2N(C)S(CC3)(=O)=O)C[C@]23C(N(C)C)=O)o1,0 F2260-0102,CCOc1cc(C(Nc2nnc(C3OCCC3)o2)=O)cc(OCC)c1OCC,0 F6764-0802,O=S1(CC(CN(CC2)Cc3c2nc2ncc(Br)cc2c3)CC1)=O,2 F8890-2782,CCOC(N(CCC1=NN2CC(Nc3c(C(F)(F)F)cccc3)=O)CC1=CC2=O)=O,2 Z754169536,CC(C)(C)NC(CCN(CCC1)S1(=O)=O)=O,0 V023-6081,CC(C)C(NC(CC1)CCN1c(cccc1)c1C(N(CC1)CCN1C1CCCC1)=O)=O,2 F3395-0976,O=S(c1cnccc1)(N(CC1)CCC1N(CC1)CCN1c1cc(C(F)(F)F)ccc1)=O,2 K284-1909,O=C(CSC(N1CC2OCCC2)=Nc(cccc2)c2C1=O)Nc(cccc1)c1Cl,0 F6724-2974,Cn1c(ncnc2NCC3(CCOCC3)c3cscc3)c2nc1,2 F5491-0029,CCCS(N(CCC1)CC1c1nnc(Cc(cc2)ccc2F)o1)(=O)=O,2 Z2140572468,CC(CC1)Cc2c1[nH]c(cc1)c2cc1C(N(CC1CC(COC2)NC2=O)c2c1cccc2)=O,2 F6571-2156,OCCOC1(CNC(Nc(cccc2)c2Cl)=O)COCC1,0 S956-0141,COCC(CN(CC1)c(cc2)cc(C(F)(F)F)c2C#N)N1C(c1cocc1)=O,0 F2784-0416,CCOc1cc(C(Nc2cccc(N(CCCC3)C3=O)c2)=O)cc(OCC)c1OCC,0 F2775-1290,COc1cc(-c(cc2)nnc2SCC(N(CCC2)c3c2cccc3)=O)cc(OC)c1OC,2 F6359-2937,O=C(COc(cc1)ccc1Cl)N(CC1)CCC1Oc1nccnc1,2 S629-2627,O=C(CCc(cc1)cc(C2)c1OCCN2C(COc(cc1)ccc1F)=O)N1CCOCC1,2 F6803-2487,COc(cn1)cnc1OC1CN(Cc2nnc(C3COCC3)o2)CC1,2 S694-0691,Cc1cnc(C2CC2)n1C(CC1)CN1C(CN(c(cccc1)c1O1)C1=O)=O,2 Z3018854520,CNC(CC1)CCN1C(C(C1)ON=C1c(ccc(Cl)c1)c1Cl)=O,0 M563-0631,CCCC(Nc1cc(CN(C(C2)C(N(C)C)=O)C(c3c(C)cc(C)cc3)=O)c2cc1)=O,0 F2518-0171,CCCCOc(cc1)ccc1C(Nc1nnc(-c2c(C)cc(C)cc2)o1)=O,0 Z27752853,COCc1c(C(N2CCCC2)=O)oc2c1cccc2,0 Z2309751872,O=C(NCC(CCC1)C1(F)F)N(CCN1)C(c2ccccc2)C1=O,2 Z1564163836,O=C(CCCC(N1)=Nc(cccc2)c2C1=O)N(CC1)Cc(cc2)c1cc2F,0 F210-0042,Cn(c(C(N(CCC1)c2c1cccc2)=O)c1)c(-c(cccc2)c2O2)c1C2=O,2 F6464-1144,COc1ccc(C(CCCC2)CN2C(c2cn(cccc3)c3c2)=O)cc1,2 F6438-6850,CN(C(COC1)C1O)c(ncc(C(F)(F)F)c1)c1Cl,0 Z3390833530,OC(C(C1)(C2)CC12NC(c1cc(NC2CCC2)ncc1)=O)=O,2 F6516-1637,CSc(cccc1)c1C(NCc1ccc(-c2cocc2)o1)=O,0 F1600-0014,CCOC(c1c(C)n(C)c(cc2)c1cc2OCC(CN1CCCCCC1)O)=O,2 Z4421156727,CC(C)Cn1ncc(C(N2CCC(CNCc3ncc(C)nc3)CC2)=O)c1C,2 V019-8956,COCCn1c(S(Cc2ccccc2)(=O)=O)ncc1CN(CC1OCCC1)C(C1CCCC1)=O,0 C798-0527,CC(CC(C)C1)CN1C(c1c(C)c(c2c(cc3)OC4(CCCCC4)CC2O)c3o1)=O,2 F6559-1093,O=C(C1Oc(cccc2)c2OC1)N(CC1)CC1n1c(cccc2)c2nc1,2 Z3638368687,C=C1C(CN(C(CCN2Cc3cccs3)=O)C2=O)C1,2 Z5335933734,CS(c1ccc2c(NC(C3(C4)c(cc(cc5)Cl)c5OC4C3)=O)cncc2c1)(=O)=O,0 F6660-0394,Cc(nc(c1c2)N3CCCC3)cn1nc2C(N(CC1)CCN1C(c1ccco1)=O)=O,2 Z4136867648,O=C(c1nc(N2CCCC2)ncc1Cl)NC(CCCN1c(cc2)ccc2Br)C1=O,0 Z2580677610,NC([C@@H](CCC1)N1C(N(CC1)CCS1(=O)=O)=O)=O,2 Z2581744269,Cc1ccc(C(N(C)[C@H](C2)C[C@H]2C(O)=O)=O)o1,0 SB73-0223,CC(C)CCNC([C@H](C[C@@]12CN(Cc3ccccc3)CC2)NC1=O)=O,0 Z2839255720,Cc1n[nH]c2c1ccc(NC(CC(CCN1C)C1=O)=O)c2,2 T501-0384,CC(C)n1c(CC(CCC2)CN2S(c2c(C)onc2C)(=O)=O)nnc1,0 Z1444115611,OC(c1cccc(C(NCCCc2nc(CCCC3)c3s2)=O)n1)=O,0 F6359-1190,COC(c(scc1)c1S(N(CC1)CCC1Oc(nccc1)c1Cl)(=O)=O)=O,2 F6472-8193,CC(Nc(cc1)ccc1C(N(CC1)CC1N(CC1)Cc2c1cccc2)=O)=O,0 8020-1881,CCCCS(CCN(c(cccc1)c1N1)C1=S)(=O)=O,2 7101-0223,Cc(oc(-c(cccc1)c1Cl)c1)c1-c(s1)nn2c1nnc2Cc1ccccc1,2 Z4335394954,C[C@H](CC(Nc1c(C(N)=O)n(C)nc1)=O)c1ccc(C(F)(F)F)cc1,0 Z4444621886,Cc(ccnc1)c1NC(c1cccc(NC(Nc2cnccc2)=O)c1)=O,2 J500-0836,Cc1noc(C)c1S(N(C1)CC2(CCCC2)C1C(N(C)C)=O)(=O)=O,2 Z1985919040,CC(CC(CC1)c2ccccc2)N1C(Cc1c[nH]c2c1cccn2)=O,2 Z2335243398,CCC(C(C(C)C)O)NC(c(cc1)ncc1Oc(cc1)ccc1OC)=O,2 C203-0268,O=C(Cc(cc1)ccc1N(C(c(scc1)c1N1)=O)C1=O)Nc(cc1)ccc1-c1ccccc1,2 S582-0461,Cc(cc1)ccc1OCC(NCC(Cn1c2ccc1)N(CCOC)C2=O)=O,2 F6787-1310,Cc([nH]nc1C)c1S(N1CC(COc2nc(C)ccn2)(CCC2)C2C1)(=O)=O,0 Z1562646733,CC(C)NC(CN(C)Cc1cc2cccnc2cc1)=O,0 Z2773814538,O=S1(CC(Cc2nc(C3(CCC3)c(cc3)ccc3F)no2)C1)=O,2 V002-1737,COc(ccc(C1N(Cc(cc2)ccc2Cl)CCCn2c1ccc2)c1)c1OC,0 F6783-6742,CCn1c(N2CC(CN(C3)C(C(CC4)CCN4S(C)(=O)=O)=O)C3C2)nc2c1cccc2,2 F6658-3131,Clc1cnc(N(CCC2)CCN2c(cc2)nn3c2nnc3)nc1,0 F5882-6915,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CCN1S(C1CC1)(=O)=O,2 Z1274515005,NC(CS(c(cc1)ccc1C(N1CC(Cc2ccccc2)CC1)=O)(=O)=O)=O,0 Z2227557019,Cc(c(-c1ncco1)ccc1)c1NC(c1cn(C)nc1)=O,0 F6296-1221,Cn(c(CNC(C1(CCCC1)c1cccs1)=O)c1)nc1-c1ccncc1,2 V030-0197,CC(C)C(C(N(CC1)CC(C)N1C(CC(C)CC(C)(C)C)=O)=O)N,0 Z365385418,Cc1nc(-c2ccc(CC(Nc3c(C)c(C)cc(S(N)(=O)=O)c3)=O)cc2)cs1,2 Z983230676,Cc1cc(C)nc2nc(C(NCC(CC3)CN3c(cccc3)c3OC)=O)nn12,0 F6064-8360,Cc1c(C(N(C2)CC2c2nc(-c3ccco3)no2)=O)sc(C)n1,2 S460-0847,O=C(c1cocc1)N(CC1)CC1n1nnc(-c2nc(C3CC3)no2)c1,2 Z3390053581,COc1nsc(CNC(C2(CC2)C(O)=O)=O)c1Br,0 Y031-4743,CC(C1)OC(C)CN1C(C(CC1=O)CN1c(cc1)ccc1Cl)=O,0 S971-0566,CC(C)COc(ccc(CN(CC1)CCC1(CC1)C1O)c1)c1OC,0 Z1272494353,CC(C1)N(C)CCC1Nc1ccnc(-c2ccccc2)n1,2 S693-0407,Cc1cnc(C2CCOCC2)n1CC1CN(Cc(ccc(F)c2)c2F)CCC1,2 F6559-0665,Cc1cc(C(N(CC2)CCC2N(C=Nc2c3cccn2)C3=O)=O)no1,2 L679-0472,CC(C)CCNC(N1CCN(Cc(n2-c3cc(C)cc(C)c3)nc3c2nccc3)CC1)=O,0 F6252-5923,O=C(C=C1)N(Cc(ccc(F)c2)c2Cl)N=C1c1nc(C2CC2)no1,2 SD07-0942,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(Cc(cc2)ccc2Cl)=O)C2)n2nn1)=O,0 Z1685103257,Cc1cc(-c2noc(Cc3c[nH]c4c3cccn4)n2)nc(C)c1,0 F6540-9177,O=S(C1CC1)(N(CC1)CCC1C(F)(F)F)=O,0 F6482-7239,O=C(NCc1cc(-c2cscc2)ncc1)NC1CCOCC1,2 F6125-2268,O=C(C(C1)CN1C(c(cc1)cc2c1OCO2)=O)NCc1ncccc1,2 CM3576-2815,Cc1c(CN2CC(Cn3nnc(COCC4CC4)c3)CC2)scc1,0 Z3685944515,CC(c1nccnc1C)N[C@H](CC1)CN1c1c(C)c(C)nc(C(NC)=O)n1,0 F6474-0093,CC(N1C)=CC(OC(CC2)CCN2C(CN(c(cccc2)c2O2)C2=O)=O)=CC1=O,2 F1016-0639,CCOC(CSCC(N(C(C1)c(cc2)ccc2F)N=C1c1cccs1)=O)=O,0 F6506-0694,CC(C)(Cc1ccc2)Oc1c2OCC(NCC(c1cscc1)(c1ccco1)O)=O,2 Z2376925904,CC(CC(C1)C(O)=O)CN1C(c1cn(-c2ccccc2)nn1)=O,0 F6244-2587,CCSc(cccc1)c1C(NCC#CCN1CCOCC1)=O,0 SC91-0427,COc1cccc([C@@](C[C@H]2CC3)(CN2C3=O)C(NCCc(cc2)cc(OC)c2OC)=O)c1,0 G125-0925,O=C(C(CC1)CCN1C(c1ccc(-n(cc2)c3c2cccc3)s1)=O)N(CC1)CCN1c1ccccc1,2 L228-1249,O=S(c1ccc(-c2cnc(C3CCCC3)o2)s1)(NCCCc1ccccc1)=O,2 Z1303254153,CC(C)C(CNC(C1N(Cc2ccccc2)CCC1)=O)OC,0 S751-0594,Cc1cnc(C2CCOCC2)n1CCNC(C1(CC1)c1ccccc1)=O,2 F5950-0948,O=C(Cc1csc(Nc(cc2)ncc2Cl)n1)N(CC1)CCN1c1ncc(C(F)(F)F)cc1,2 F6594-1376,N#Cc1nccnc1N1CCC(CN(C(C=C2)=O)N=C2c2ccncc2)CC1,2 S900-0031,CCN(CCN(C)C)C([C@H](C1)NC2(CCCC2)c2c1[nH]cn2)=O,0 F6442-5782,COC(CC1)CN1C(CC1)CCN1C(c1cccs1)=O,2 Z1617178828,Cc1noc(CCC(N(CCC2)CCC2c(cc2)ccc2F)=O)n1,0 Z4905893890,C[C@H](c1cccc(C(F)(F)F)c1)Nc1nc(C)nc2c1cn[nH]2,0 Z1588316968,Cc1c(C(NCCc(cc2)cc(OC)c2F)=O)sc(N=CN2C)c1C2=O,2 Z1254391946,CS(Nc(cc1)ccc1NC(N1CCC(CC(N2CCCC2)=O)CC1)=O)(=O)=O,0 F6192-1056,O=C(c(cccc1)c1Cl)NCC(c1cscc1)c1ccco1,0 Z1428046015,Cn(cc1NC(c2csc(-c3cocc3)n2)=O)nc1-c1ncccc1,2 F5854-1031,O=S(c(s1)ccc1Cl)(N(Cc1cscc1)Cc1ncccc1)=O,2 M030-0163,O=C(c1ccco1)N(CC1)CCN1S(c(cc1)cc-2c1OCc1c2onc1)(=O)=O,2 F6448-1254,O=C(CSc(cc1)ccc1F)Nc1cn(CC2CCOCC2)nc1,2 F6178-4042,O=C(c(c(F)ccc1)c1F)NCC(CC1)CCN1c1ccncc1,0 F6510-4271,CN(c(cccc1)c1N1Cc2cc(C(F)(F)F)ccc2)S1(=O)=O,0 Z1325635836,CCc1n[nH]c(C(N(CC2)CCN2C2CCOCC2)=O)c1,2 F6789-0638,CN(CCc(cc1)ccc1OC)c1nc2ccnn2cc1,2 S254-0012,O=C([C@H](C[C@@H](C1)F)N1C(NC1CCCCC1)=O)N(CC1)Cc2c1cccc2,2 Z2959224282,O=C(c1cccc2c1nc(C(F)F)[nH]2)N(C1)CC1C1COCC1,2 F2880-0216,CN(C)C(CNC(c1cccc(Br)c1)=O)c1cccs1,0 F2239-0025,C(c1cnccc1)Sc(n1CC2)nnc1N2c1ccccc1,2 S595-0456,CCn1ncc(S(N(CCCC2)C2c2noc(COc3ccc(C)cc3)n2)(=O)=O)c1,2 J038-2831,Cc(cc1)cc([C@H]2OCC[C@H]22)c1NC2c(cccc1OC)c1OC1CCCC1,2 Z2199970353,CN(c(c(C(N1)=O)c2)ncc2C(N(CC2CC(COC3)NC3=O)c3c2cccc3)=O)C1=O,2 SD31-0158,O=C(c1c[nH]c2c1cccc2)NCCn1nc(C(N2CCOCC2)=O)c2c1CCOC2,2 Z31725536,OCCNC(c1n[nH]c2c1cccc2)=O,0 S976-1731,O=C(C(CCC1)(CN1S(c1cc(CCC2)c2cc1)(=O)=O)F)NCc1cnccc1,2 Z1983856747,COc1cc(S(N(CC2c3ccccc3)Cc3c2cccc3)(=O)=O)cnc1,0 Y203-3913,OC(C(CCCC1)C1C(Nc(cc1)ccc1N1CCOCC1)=O)=O,2 F6514-8665,O=C(C1(CCCC1)c(cc1)ccc1Cl)NCc1cc(-c2cnccc2)ncc1,2 Z4405188922,CCc(cc1)cc(S(Nc(cc(cc2)Cl)c2Cl)(=O)=O)c1OC,0 F6451-3514,COC(CNC(C(NCc1ccco1)=O)=O)c1ccco1,2 S629-2613,N#Cc(cc1)ccc1C(N1Cc(cc(CCC(N2CCOCC2)=O)cc2)c2OCC1)=O,2 E852-2422,CC(Cn(c1c2)nc2C(NCCCN2CCCC2)=O)(C(NCc(cc2)ccc2F)=O)N(C)C1=O,2 F3098-0011,Cc(cc(c(OC)c1)NC(C2Oc(cccc3)c3OC2)=O)c1Cl,0 Z1753996753,CCc1nnc([C@@H](C[C@H](C2)O)N2C(c2cc3cc(C)ccc3nc2C)=O)o1,0 Z1316002183,CN(Cc1nc(C(F)(F)F)cs1)C(c1cc(N(CCN2)C2=O)ccc1)=O,2 F819-0479,O=C(CC(C1)c2nc(-c(cc3)ccc3S(N3CCOCC3)(=O)=O)no2)N1c1ccccc1,0 F6254-0206,O=C(Cc(cccc1)c1Cl)Nc1nc(CCOC2)c2s1,2 Z3686106121,CN(C(C(C(CC1)C2CC2)N1c1nc(CCCC2)c2cn1)=NN1)C1=O,2 Z4445563085,O=C(c(cc1)ccc1-c1nc(C2CC2)n[nH]1)Nc1cccc(CS(C2CCOCC2)=O)c1,2 Z2581744120,CN([C@H](C1)C[C@H]1C(O)=O)C(C1CC=CC1)=O,0 F6156-0627,O=C(COc(cccc1)c1F)N1CC(COc(cc2)ccc2F)C1,2 S858-1570,COCC(N(C1)C[C@]2(CO)[C@H]1CCN(Cc(cc1)cc3c1OCC3)C2)=O,0 Z1894882544,COc(cc1)cc2c1c(NC(c1cc(Nc3nccnc3)ccc1)=O)n[nH]2,2 C660-0408,O=C(CN(C=Nc1c2nc3n1CCCCC3)C2=O)NCCCN1CCOCC1,2 G786-0693,O=C(Nc1cccc(Cl)c1)N(Cc1nnc2n1CCCCC2)c(cccc1)c1F,0 SC40-0164,Cc1noc(C)c1C(N(CC1)CCC11OCc2c(COC)nnn2C1)=O,2 Z968612368,CN(C)c(cc1)ncc1C(N(CC1)CCC1c1ncc[nH]1)=O,0 S779-0170,Cc1cnc(-c2ccccc2)n1CC1CN(Cc(ccc(F)c2)c2F)CC1,0 F5016-1786,COC(N1CCC(CNC(C(NCc(cc2)ccc2F)=O)=O)CC1)=O,0 F6240-4928,O=C(c1cccs1)NC1(CCCCC1)c1nc(-c2ccccc2)no1,2 Z3606652331,CC(C)(C)OC1C(C)(C)C(CNC([C@@H]2[C@@H](c3cn(C)nc3)OCC2)=O)C1,2 SA87-0212,COCCN(CC(CNC(Nc(cc1)cc2c1OCCO2)=O)OC1)C1=O,0 F6555-6189,O=C(Cc(cccc1)c1Cl)N(C1)Cc2c1cccn2,0 Z2756075904,O=S(c(cc(cc1)Cl)c1Cl)(N(CC1)CC1c1n[nH]nn1)=O,0 F6497-1032,Cc(cccc1)c1-c1noc(CC(CCC2)CN2C(COc(cccc2)c2F)=O)n1,2 Z2850052210,OCc1cc(N(CCC2)CC2c2nc(cccc3)c3[nH]2)ncc1,0 Z1069484790,CC1Oc(ccc(C(C(CC2)CCN2C(c2cc(O)nc3ccccc23)=O)=O)c2)c2NC1=O,2 S728-0023,OCCC(C1)(C11CCOCC1)C(NCc1cnccc1)=O,2 F6274-0528,O=C(c1noc(-c2ccco2)c1)OC(C1)CN1c1nc(cccc2)c2s1,2 F6488-1483,COc1nccnc1OC(CC1)CN1C(Cc1cnccc1)=O,2 F727-0746,COc1cccc(-c2cc(N(CC3)CCN3S(c(cc(cc3)Cl)c3OC)(=O)=O)ncn2)c1,0 Z1237078878,CC(c(cc1)cc(F)c1F)S(c1nnc2n1CCCCC2)(=O)=O,0 Z982270882,CS(c(cc1)ccc1SCCCN(c(cccc1)c1N1)C1=O)(=O)=O,0 F6502-1214,O=C(c1cn(cccc2)c2c1)NCCn1c(-c2nccnc2)ncc1,2 Z1324408730,O=C(C(C1)C11CCCC1)NCc(cc1)cnc1OC1CCCC1,2 F6568-3353,COc1c(CNc2ncnc(-n3ncnc3)c2)cccc1,0 V030-3845,O=C(CC(c1cn(Cc2ccccc2)c2c1cccc2)c1ccc(C(F)(F)F)cc1)N1CCCC1,2 Z1455212454,OC(C(C1)OCCN1C(CCNS(c1ccccc1)(=O)=O)=O)=O,2 Z1958575981,CC(N1CC(CNc2ncnc(C)c2)CCC1)=O,2 F796-0617,CCC(C)NC(CN(C=Nc1c2[nH]c(cc3OC)c1cc3OC)C2=O)=O,0 Z3798246492,NC(CC1C2)C2CC1NC(c1nccnc1-c1nc(cccc2)c2s1)=O,2 E715-0318,CN(C(C(CCC1)CN1c1ncnc2c1nc1n2CCCCC1)=O)c1ccccc1,0 Z1728948157,Cc1cccc(N(CC2)C(CCc3c(C)n4nccc4nc3C)=O)c1N2C1CC1,2 J014-1844,O=C(C(C1)Oc(ccc(Cl)c2)c2N1S(c1ccccc1)(=O)=O)N(CC1)c2c1cccc2,2 Z2437197902,CCOCc1c(CNS(N(CCC2)C2C(O)=O)(=O)=O)cccc1,0 F6438-2453,CN(C)c(nc(N(C)C)nc1)c1NC(c(cc1)cc2c1OCO2)=O,0 H025-0396C,Cc(cc1)ccc1S(n1c(ccc(C)c2)c2c(C2)c1CCN2C1CCNCC1)(=O)=O,2 F6796-9401,CN(CC(CC1)CCN1c(cc1)cnc1C#N)c(ncnc1C2CC2)c1F,2 Z2951652312,Cc1cc(CN(CCC2)CCN2C(c2ccnn2C2CCC2)=O)no1,2 F6555-6609,O=S(c(cc1)cc2c1OCC2)(N(C1)Cc2c1cccn2)=O,2 C614-0356,COc(cc1)cc(NC(c(cccc2)c2C2=O)N2c(cc2)ccc2Cl)c1OC,0 Y044-5051,CC(C)n1nc(C)c(-c2cc(C(NC[C@@H]3[C@H](CCCC4)N4CCC3)=O)n[nH]2)c1C,2 E975-0436,Cc1cccc(NC(Cn(cc2S(N3CCCC3)(=O)=O)cc2S(N2CCCC2)(=O)=O)=O)n1,2 Z4988559640,CN(Cc(ccc1c2)cc1ccc2OC)C(C1(C2)C2C1)=O,2 Z2256255204,CC(c1c(C)sc(C)c1)NC(Cc(cc1)ccc1C(O)=O)=O,0 Y041-8008,N1(C(N[C@H](C1=O)CC(N1Cc2c(CC1)cccc2)=O)=O)Cc1ccc(cc1)OC,0 F6806-6235,O=C(CN(CC1)CCC1NS(C1CC1)(=O)=O)N1CCOCC1,2 F5033-0218,CC(C)(C)C(NCC1CCN(CCOC)CC1)=O,0 Z2199858399,Cc1c(CNC(N(C)C(N(C)C2=O)=O)=C2C#N)occ1,0 Z1560062820,O[C@H](Cc1c2cccc1)[C@H]2NC(c1cc(-c2ncn[nH]2)ccc1)=O,0 F6186-1246,CC(CCSC)(CNS(c(cc1)cc(C)c1F)(=O)=O)O,0 Z3346216974,Cc1c(C)nc(-c2ccncc2)nc1N1CC(CC(O)=O)CC1,0 Z760190664,O=C(C(N(CC1)Cc2c1scc2)=O)Nc1cnccc1,2 S895-0318,COCc1nnc2n1CCC(CC1)(CCN1C(NCCc1ccccc1)=O)CC2,0 Z1274034006,CCOc(c(C(N(C1)CC1Oc1ccccc1)=O)ccc1)c1F,2 Z3243950717,CC(C)(C)C(Nc(cc1)cc2c1OCCNC2=O)=O,0 Z3839700690,O=C(CCNC(c1c(CC(C2)(F)F)n2nc1)=O)Nc1cnccc1,2 F6561-0858,COCc1cn(C(CC2)CN2C(C(CCC2)N2c2nc(cccc3)c3o2)=O)nn1,2 Z1270951589,CC(C)n1ncc(S(N2C(Cc(cccc3)c3Cl)CCC2)(=O)=O)c1,0 V026-8950,CC(C)CCNC(c1ccc(CN2c(cccc3)c3OCC2=O)o1)=O,0 F5871-2163,COC(c(cc1)ccc1C(NCCN(CC1)CCN1S(C)(=O)=O)=O)=O,0 F234-0117,O=C(c1cccn1-c1cnccc1)NCCC1=CCCCC1,2 6214-0920,CC(C)c1ccc(CN(C(CC2)CS2(=O)=O)C(c2c(C)c(ccc(C)c3)c3o2)=O)cc1,0 S693-0252,Cc1cnc(-c2ccccc2)n1CC(CCC1)CN1S(c1c(C)onc1C)(=O)=O,2 Z3669169493,C[C@H]([C@@H]1C)C1C(N(CCC1)CCN1c(nccc1)c1F)=O,2 Z1836151872,Oc1cc(C(NCCC2OCCCC2)=O)c(C(F)(F)F)cc1,2 F3225-2794,C=CCNC(c1c(N)n(CCc(cc2)ccc2F)c2nc3ccccc3nc12)=O,2 F0392-0064,O=C(COc(cccc1)c1F)Nc(cc(C(F)(F)F)cc1)c1Cl,0 Z1315176893,Oc1ncc(CNC(C2N(Cc3ccccc3)CCCC2)=O)cc1,2 Z4617308190,CN(CCC1)C1(CC1)CCN1C(CSc1ncnc2c1[nH]cn2)=O,2 SB56-1147,CC(C)NC(N(C[C@@H]1c2nc(C3CCCC3)no2)C[C@@H]1c1cnccc1)=O,0 S616-1249,CS(N(C1)[C@@H]2[C@H]1CCN(Cc(cccc1)c1C#N)C2)(=O)=O,0 D718-0831,O=C1N(C2CCCC2)C=Cc2c1cnc1nc(-c(cc3)ccc3Cl)nn12,2 Z2755718467,CN(CCC[C@@H]1CNC(c2ccc(C(O)=O)s2)=O)[C@@H]1c1ccccc1,2 5067-0933,C1Oc(ccc(Nc2c(cc(-c3ccccc3)s3)c3ncn2)c2)c2OC1,2 Z1928666697,C[C@H]1O[C@@H](C)CN(CCN(C)C(c2c[nH]nn2)=O)C1,0 F733-0380,COc(ccc(Cl)c1)c1NC(c(cc1)ccc1Nc1ncnc(-c(cc2)ccc2F)c1)=O,0 K906-0656,CCC(N(CCc1c2)c1cc(S(N(CC1)CCC1C(Nc(cc1)ccc1Cl)=O)(=O)=O)c2Br)=O,2 D146-0087,Cc(c1c2)coc1c(C)c(O1)c2C(C)=C(CCC(NCc(cc2)cc(OC)c2OC)=O)C1=O,2 Z192681404,CC(C)NC(c(cc1)cc(C(NN2)=O)c1C2=O)=O,2 F6506-4927,OC(CNC(CSCc1ccccc1)=O)(C1CCOCC1)c1ccccc1,2 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Z2351324992,OC(C(C1)C1(CC1)CCN1S(c1c[nH]c2c1cccn2)(=O)=O)=O,2 E545-0732,COc1ccc(CN(C(c(oc2c3cccc2)c3N2Cc3cccc(C(F)(F)F)c3)=O)C2=O)cc1,0 F6546-1387,CN(C)c(cc1)nnc1C(N(CC1)CCC1(F)F)=O,2 Z2109439560,Cc(nncc1)c1NC(N1C(CC(F)F)COCC1)=O,0 K284-3528,O=C(CCCN1C(SCC(NCC2OCCC2)=O)=Nc(cccc2)c2C1=O)NCCc1ccccc1,2 F6512-1087,CN(C(C=C1)=O)N=C1C(NC1Cc2ccnn2CC1)=O,2 Z1669924904,Cc1cc(C)nn1-c(cc1)nc(C(NC(C2)CNC2=O)=O)c1Cl,0 D750-0189,O=C(CC1(CCCCC1)N(Cc1c2cccc1)C2=O)NCCc1nc(cccc2)c2[nH]1,0 SC68-0192,CCn1c(C(CN(C2)C(c3noc(-c4c(C)n(CC)nc4C)c3)=O)C22CCCCC2)nnc1,2 Z1275017714,CCc(cccc1)c1N(CC(C1)C(Nc2n[nH]c(C3CCOCC3)c2)=O)C1=O,2 F5017-2726,O=C(c1cc(cccc2)c2o1)N1CCC(CNS(c2ccc(C(F)(F)F)cc2)(=O)=O)CC1,0 Z2958327068,CC(C)C1(COC1)C(N1CC(c2noc(C(C)C)n2)OCC1)=O,2 F5033-0733,Cc1cc(C(NCC2CCN(Cc3ncccc3)CC2)=O)cc(C)c1,2 F6475-2775,COCCOc1nccc(C(Nc2nocc2)=O)c1,2 F5127-0575,CCn(cc1)nc1C(Nc(cc1)cc2c1OCO2)=O,2 F3354-0199,COc1cc(CCN(CC(COCC2C(CC3)CC3C2)O)C2)c2cc1OC,2 SA46-1310,CN(Cc1ccccc1)C1COC(C2)(CN2C(c2n[nH]cc2)=O)C1,0 Z2960455305,O=C(c1c(ccc(Cl)c2)c2ncc1)N(CCC1)CC1n1nncc1,2 Z2879519405,Cc1cccc(C(CNC(c2csc(N3CCCCC3)n2)=O)O)c1,0 D489-0132,O=C1n2nc(-c3cccs3)nc2NC(CN(CC2)Cc3c2cccc3)=C1,2 F6807-6954,CCOC(N(CC1)CCN1c(nc(nc1)SC)c1Br)=O,0 F6349-1169,COc(cccc1)c1C(Nc(cc1)ccc1-c1cnc2n1CCC2)=O,0 G856-0822,O=C(CSC(N(c1ccccc1)C1=O)=Nc2c1[nH]c1c2cccc1)Nc1c(C(F)(F)F)cccc1,0 Z2256402615,OC([C@H](CCC1)[C@H]1NC(CC1C=CCC1)=O)=O,2 Z1684354116,CC(N1c(cc2)ccc2-c2noc(-c3cc(F)cnc3)n2)=CNC1=O,0 F6666-9830,O=C(c1c2OCCOc2ccc1)Nc1cccc(F)c1F,0 Z3141977539,CN(C)c1c(CN(CC2)C([C@]3(CNC4)[C@@H]4CCOC3)=O)c2ccn1,2 S812-0484,COCC(N1C(C2CCCC2)c2nccn2CCC1)=O,0 F6125-2165,CC(N(C1)CC1C(N(CC1)CCN1c(cc1)cc(Cl)c1Cl)=O)=O,0 C066-3596,O=C(Cn1ncc2c1-c(cccc1)c1OC2)NCCCN(Cc1ccco1)C1CCCC1,0 Z739706308,COC(c(cc1)ccc1C(N(CCC1)CCN1c(cc1)ccc1OC)=O)=O,0 F6597-2732,Cc1nc(CN2CCC(COc3cccc(C(F)(F)F)n3)CC2)co1,0 Z3549194774,O=C(C(C1)COC11CCNCC1)N(CCC1)CCN1C(c1cccc(F)c1)=O,2 Z1627990865,CC(C1COCCC1)NC(CN(C(C)=C(C)S1)C1=O)=O,2 Z1445177621,CC(C)(C)c1nn(C)c(C(NCCCCC(O)=O)=O)c1,0 V005-2954,O=C(c1csc(COc(cccc2)c2F)n1)NC(CC1)CCC1NC(NC1CCCCC1)=O,2 F2880-3046,CN(C)C(CNC(C(Nc1cccc(SC)c1)=O)=O)c1cccc2ccccc12,0 Z1443746118,Cc1cc(C(NC(CC(O)=O)c2cccs2)=O)n[nH]1,0 8018-7088,CC(C)(C1)OCCC1(c1cc(-c(cc2)ccc2OC)no1)O,2 Z3532995054,C[C@H](C(Nc1c(C)ccnc1)=O)OC,0 Y042-6917,O=C(C(C1)CN(Cc2ccccc2)C1=O)NCCc1nc(cccc2)c2[nH]1,2 Z1636423505,NS(c1cc(C(N(CC(c2cccc(Cl)c2)O)Cc2ccccc2)=O)co1)(=O)=O,2 F5882-2946,CCOc(cccc1)c1NC(N1CCN(CCNC(c(cc2)cc3c2OCO3)=O)CC1)=O,2 Z3771637880,Cc1c(NC(c2cc(Br)c(C)cc2)=O)nnn1-c(cc1)ccc1F,0 Z2805430161,C(CNc1ncnc(C2CC2)c1)c1n[nH]cc1,2 Y503-4034,CCN(CC)CCNC(C(CCC1)CN1S(c1c(C)n(C)nc1)(=O)=O)=O,0 Z1893831288,Cc(cc(CNC(c(cc1)cc(C)c1S(N)(=O)=O)=O)cc1)c1S(N)(=O)=O,0 Z2183429137,CC(CNC(N1Cc(cccc2)c2OC(C)(C)C1)=O)C#N,0 S988-1219,CCn1nc(C)c(CN(C[C@H]2CN(C3)C(c4ccccc4)=O)C[C@]23c2nc(C)no2)c1C,0 Y205-4050,O=C(c1cc(CCCC2)c2s1)Nc(cc1)ccc1S(Nc1nccs1)(=O)=O,2 F6713-5335,Cc1noc(C)c1CN(CC1)CCN1c1ncncc1C,0 F6783-7264,CCOc(cc1)ncc1C(N(C1)CC(C2)C1CN2c1nc(C)nc2c1CCC2)=O,2 Z162038048,CCN(CC(Nc(cc1)cc2c1OCCCO2)=O)Cc(cc1)cc2c1OCCO2,2 S988-1128,Cc1noc([C@@](CN(C2)C(c3cn(C)cn3)=O)(C3)[C@@H]2CN3C(c2ccccc2)=O)n1,2 F6439-1251,O=C(c(c(F)ccc1)c1Cl)NCCn1nc(C(F)(F)F)c2c1CCCC2,0 F6774-4253,COc(cn1)cnc1OC1CN(Cc2nnc(C(F)(F)F)o2)CC1,2 Z335472632,CN(C=C(CNc1cccc(Cl)c1)C(N1C)=O)C1=O,0 F5286-0281,CCOC(C(CCC1)CN1C(C(OC=C1OCc(cc2)ccc2F)=CC1=O)=O)=O,2 Y041-4351,Cc(c(O1)c(cc2)C(C)=C(C)C1=O)c2OCC(N(CC1)CCN1C(CC1)CS1(=O)=O)=O,2 Z2142970193,CC(C)(CNC(CN(C=CC(C(F)(F)F)=C1)C1=O)=O)N1CCOCC1,2 F6608-1606,FC(c1cc(OCC2COCCC2)ncc1)(F)F,0 V011-5541,CCCC(C)c1nc(n(-c2ccccc2)nc2)c2c(N(CCC2)CCN2C(NCC)=O)n1,0 S699-0884,CN(CCc1noc(C(C2)CN2C(C2CC2)=O)n1)C(C1CCOCC1)=O,2 F6436-0600,COC(N1CCC(CNC(CSC2CCCC2)=O)CC1)=O,0 F6471-1383,CS(N(C(CC1)C2)C1CC2NC(Nc1c(C(F)(F)F)cccc1)=O)(=O)=O,0 6344-0025,Brc(cc1)cc([C@H]2OCC[C@H]22)c1N[C@@H]2c1cccs1,2 Z2975645691,COc(cccc1)c1NC(C(CCC1)CN1c1nccc(CO)c1)=O,2 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F084-0020,CC(c1ccccc1)NC(CCc(n1-c2c3scc2)nnc1N(C)C3=O)=O,2 F6560-4092,CC(C)C(Cn1ncnc1)NC(C1(CC(C2)C3)CC3CC2C1)=O,2 Z1559191412,O=C(c1cc(F)cc2cccnc12)NC(CCC1)CN1c1ncnc(N2CCOCC2)c1,2 M331-0390,CCC(Nc1c(/C=C/c(s2)ccc2S(N(CC2)CCN2c2ccccc2)(=O)=O)onc1C)=O,2 F6515-1382,O=C(c(cc1)ccc1Oc1nccs1)NCc1cc(-c2ccco2)ncc1,2 Z2936894804,CCC(C(N(CC1)CCC1c1ncccn1)=O)Oc1c(C)cccc1,2 F6474-3459,O=S(c1c[nH]cn1)(N(CC1)CC1Oc1cccc2cccnc12)=O,2 J005-0090,Cc1noc(C)c1C(CCC1)N1S(c(cc1)cc2c1OCCO2)(=O)=O,2 V017-2683,CCC(C)N(Cc(c(C)nn1-c2cc(F)ccc2)c1N1CCN(CC)CC1)C(Nc1cccc(Cl)c1)=O,0 Z4461708699,CC(C)C(C(N1C(CN(C)C(C(C=CN2C)=CC2=O)=O)CC1)=O)c1ccccc1,2 F6242-0991,Cc(cccc1)c1C(Nc(cc1)ccc1-n1nnc(C(N2CCCC2)=O)n1)=O,2 F6687-6916,Cc1cccc(OCC(CCC2)CN2C(CCc(cc2)ccc2S(C)(=O)=O)=O)n1,2 SB59-0556,Cn1c(C(C2)C(C3)(CN3C(NCCc3ccccc3)=O)CN2C(COC)=O)nnc1,0 G535-0404,CCc1c(C)sc2c1CCN(Cc1c(C)oc(-c(ccc(OC)c3)c3OC)n1)C2c1ccccc1,0 F6472-0864,O=C(NCCSC1CCOCC1)Nc(cccc1)c1Cl,0 Z2966754304,C[C@@H](C(NCCC1)=O)N1C(c1c(C)[nH]c(-c2cc(OC)ccc2)n1)=O,2 V030-4901,CC(CN(CC1)c2ncnc(Oc(cc3)ccc3OC)c2)N1C(c1ccco1)=O,0 F6512-6863,Cn1ncc(S(N(CCC2)CCN2C(C2CCCC2)=O)(=O)=O)c1,2 Z2790701659,COCc1nc(CCN(Cc2cc(C(O)=O)cs2)C2)c2cn1,0 SB55-0992,O=S(C1CC1)(N(C[C@@H]1CCC2)C[C@@]12c1noc(-c2ccccc2)n1)=O,2 Z2285255546,CC(C(N(CC(C)N1)CC1=O)=O)c1ccc(C)o1,2 Z2984190201,FC(c1nnc(cc2)n1nc2NC[C@@]1(CCC2)[C@H]2NCC1)F,2 F2724-2494,O=C(CN(C=Nc1c2cccc1)C2=O)Nc1cc(-c(cc2)nnc2N2CCOCC2)ccc1,2 E787-1020,Cc1ccc(C(CC(N(CC2)Cc3c2cccc3)=O)N(Cc2c3cccc2)C3=O)cc1,2 P804-0896,O=C(c(cc1)cc2c1[nH]cc2)N(CC1)CCN1c1cc(-c(cc2)ccc2Cl)n[nH]1,2 Z1580120209,CC(C)(C)n1ncc(NC(NCC(CC2)CCN2C(C)=O)=O)c1,2 F6549-5523,Cn1c(C(CC2)CCN2C(c2noc(-c3cnccc3)c2)=O)cnc1,2 F6753-0953,O=C(C1OCCN(Cc(cc2)ccc2Cl)C1)N1CCCC1,0 F0365-0020,O=S(c1cccc2cccnc12)(N1CCOCC1)=O,0 F2812-0535,O=C(CCCSc1ccccc1)Nc1nccs1,0 Z2756075891,Cc(cc1)cc(Cl)c1S(N(CC1)CC1c1n[nH]nn1)(=O)=O,0 Z3615667556,CCC(CCC1C)CN1C(c1cn(Cc2ncccc2)nn1)=O,2 F5033-2357,CCCc1c(C(NCC(CC2)CCN2c2ncccn2)=O)snn1,2 Z1939213091,Cc1ccc(C(CNC(c(c2c3)c[nH]c2ncc3Br)=O)N2CCOCC2)o1,2 Z3484301381,CCN(CC)S(c(c(Cl)c1)cc(C)c1Br)(=O)=O,0 F5822-1436,O=C(NCc1ccccc1)N1CCC(Cn2cncc2)CC1,2 F5828-0066,COc1c(CCNC(c2csc(-c3nccnc3)n2)=O)cccc1,2 E135-0558,CN(C(C(N(CC1)CCN1C(c1ccco1)=O)=O)=CC(c(cc1)ccc1F)=N1)S1(=O)=O,0 Z2612161761,CCOc1nc(C)nc(Nc2c(C)n(C)nc2)c1,0 Z1084968972,OC(CNC(NCc1cccc2ccccc12)=O)C1CCCCC1,2 F5010-0360,CCCOc(cc1)nnc1N(CC1)CCN1C(c(c(F)ccc1)c1Cl)=O,0 F5835-0538,O=C(Cc(cc1)ccc1F)N(CC(C1)CN23)CC1C3=CC=CC2=O,2 F6574-0700,O=C(Cn(cc1)c2c1cccc2)N(CC1)CCC1Oc1nncs1,2 SA87-1056,O=C(c1ccc(Cn2cncc2)o1)NCC(CN1CCc2ccccc2)OCC1=O,2 Z2997794731,CC(C)(CN)C(CC1)CCN1C(Nc1c(CCO2)c2ccc1)=O,2 F1913-1528,CCOC(c1csc(C(C2)CN2C(OC(C)(C)C)=O)n1)=O,2 S396-0300,CN1N=CC(N2CC(CC(Nc(cc3)cc(F)c3F)=O)CCC2)=CC1=O,2 8019-4556,O=C(c(cc1)ccc1F)N(CC1)CCC1C1CCNCC1,2 Y041-7131,Cc1nc(N(CCC2)CC2C(NCC2CCOCC2)=O)nc(C)c1,0 F6679-2653,Cc1c(C(N(CC2)CC2Oc(ccnc2)c2Br)=O)sc(C)n1,2 F6541-1543,O=C(c(ccnc1)c1F)N(CC1)Cc2c1scc2,0 8005-2266,O=C1OC(c(cccc2)c2Oc(cccc2)c2C(O2)=Nc(cccc3)c3C2=O)=Nc2c1cccc2,2 F6549-2873,O=C(c1cnc(C(F)(F)F)cc1)N(C(CC1)C2)C1CC2n1cncc1,2 F6775-2347,Cn1ncc2c1ncnc2N1CC(COc2nccnc2)CCC1,2 F2337-1005,COc1ccc(CC(NCCn(c2n3)ncc2c(N2CCCC2)nc3SC)=O)cc1,2 Z1280184665,CC(C)c1n[nH]c(NC(Cc(cc2)nn2-c(cc2)ccc2F)=O)c1,0 F6554-2318,O=S(c(cccc1)c1Br)(N1C(C2)COC2C1)=O,0 F6442-4296,Cc(nc1oc(-c2ccccc2)nc1c1)c1NC(C1(CCOCC1)c1ccccc1)=O,2 8011-0533,O=C(c(cc1)cc(S(N2CCOCC2)(=O)=O)c1F)Nc1nnc(-c2ccccc2)o1,2 Z1952654440,O=C(CC1OCCO1)N(CCOC1)C1c1nocn1,2 F5882-6456,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)NCCCN1N=CC=CC1=O,2 Z295736936,O=C(C1CCCC1)Nc1cc2n[nH]cc2cc1,2 F6471-3881,COc1cccc(NC(N(C2)CC2Oc2nccs2)=O)c1OC,2 S431-0024,O=C(CCc1nc(cccc2)c2s1)N(CC1)CCC1(C1)OCCC1N1CCOCC1,2 C122-0272,O=C(c(cc1)cc(N2Cc(cc3)ccc3Cl)c1SCC2=O)NC(CCC1)c2c1cccc2,2 Z2300971522,OC(C(CN(CC1)S(c(scc2)c2Cl)(=O)=O)C1(F)F)=O,0 Z3174538803,CC1(C)[C@@H](C2)[C@H]1C[C@H]2NC(Nc1cc(C)no1)=O,2 Z1874080196,CC1(C)OCCN(CCNc2c(cccc3F)c3ncn2)C1,0 F6464-1124,CC(C)(C)OC(N(CCC1)CC1C(N(CCCC1)CC1c(cc1)ccc1OC)=O)=O,2 F6818-0631,Cc1nc(CCC2)c2c(N(CC2)CCN2c2nc(cccc3)c3n2C)n1,2 F6573-7813,O=C(c1c(C(F)(F)F)cccc1)N(CCN1c2nccs2)CC1=O,2 Z1537394112,CCC1(CCOCC1)NS(c1c(C)sc(C)c1)(=O)=O,0 Z3353766356,Cn1nccc1[C@@]1(CC[C@@H]2C1)[C@@H]2C(N(CC1)CCC1C(NN1)=NC1=O)=O,2 S721-0820,CCn(cc1)nc1C(N(C[C@H](C1)Oc2cnccc2)[C@@H]1C(N1CCCC1)=O)=O,2 Z3466397401,CC(CC(N(CC1C)CC1(F)F)=O)CC(O)=O,0 Z1798082973,O=C(C1(CC1)S(c(cc1)ccc1Cl)(=O)=O)NC(CCCN1C2CCCCC2)C1=O,2 Z2760952616,CN(Cc1cc(cccc2)c2o1)c1ncnc2c1ncn2CC(CO)O,0 F6446-1102,CCOc(cccc1)c1C(NCC(CCC1)CN1c1nccs1)=O,0 Z3887768745,CN1CCC(CC2)(CN2C(Nc2cc(C3(CCC3)C(OC)=O)ccc2)=O)CC1,2 Z2482912277,OC(c1c(CN2C(CCCC3)C3OCC2)oc(-c2ccccc2)n1)=O,2 Z2578381910,OC(CC1)CCN1S(c1c[nH]nc1Cl)(=O)=O,0 FF01-3878,O=C(c1c2cccc1)N(CC1NCCc3c1cccc3)C2=O,2 Y042-6475,s1c(NC(C2[C@](OC(C2)=O)(C)C)=O)nnc1C1CCC1,2 Z436638796,O=C(C1CCC1)Nc1cccc(CNC(NCC(CCC2)c3c2cccc3)=O)c1,2 F2080-0124,O=C(C1(CCCC1)c(cc1)ccc1Cl)Nc1nnc2SCCCn12,2 F6724-4567,OC(CNc(nc1)ncc1F)c1csc2c1cccc2,2 Z1021070192,CC(Nc1cccc(CNC(c(cc2)cc3c2[nH]nc3)=O)c1)=O,0 Z1143345971,CC(CNC(C1(c(cccc2)c2OCC1)N(C)C)=O)N1CCC(C)CC1,0 G587-0241,O=C(c(cc1)cc(N2)c1N(CCCC1)C1C2=O)NCCCN1CCCCCC1,2 Z2440875008,NCC(CNC(CCCc(cc1)cc(N2)c1NC2=O)=O)(F)F,0 F6806-7029,O=C(CN1CC(C(N2CCSCC2)=O)OCC1)NCc1ccccc1,2 Z1444782405,OC(Cc(cccc1)c1NC(C(C=C1)=NN(Cc2ccccc2)C1=O)=O)=O,0 Z1545210777,CCC(CO)(CC1)CCN1C(Nc1cc(F)cc(F)c1)=O,0 SB11-0671,CNC(c1cn(CC(CC2)(CCN2C(C2(CC2)c2ccccc2)=O)O)nn1)=O,2 V006-2636,COc1cccc(C(CN(CC2)CCN2C(NC(C2)C2c2ccccc2)=O)OCc2cccc(Cl)c2)c1,0 F6795-3608,Cc1c(C)nc(cc2)n1nc2N(CC1)CCN1c1ncnc2c1n(C)cn2,2 Z2067201295,CC(C)C(Nc1cc(NC(c2cc(NC(C3CC3)=O)ncc2)=O)c(C)cc1)=O,0 Z2669772262,CCCC(N(CC1)CCC1(C(F)(F)F)OC)=O,0 F184-1235,O=C(C(CC1)CCN1S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O)N(CC1)c2c1cccc2,0 Z1956929439,OC(C(CC1CCC1)NS(CC1OCCCC1)(=O)=O)=O,2 Z2055631213,OC([C@H](CN(C1)C(c2cn(-c3ccccc3)nc2)=O)[C@@H]1C(F)(F)F)=O,0 S018-0021,O=C(C(CN(C1)S(C2CC2)(=O)=O)C11CCCCC1)Nc(cc1)cc2c1OCCO2,2 Y042-4914,COc1ccc(C(Nc2c3cccc2)N(CCC(Nc(cccc2)c2O)=O)C3=O)cc1,2 T502-0776,Cc1c(CN(CC2)CCC2(C(NC2CC2)=O)F)scc1,2 Z3405715770,Cc1c(C)oc(NC(N([C@H](CC2)C3)[C@@H]2C[C@H]3O)=O)n1,2 F6708-9951,Cc(cn1)cnc1OC(CC1)CCN1c(ncc(Cl)c1)c1Cl,0 D330-2523,Cc1c(CC(c(cccc2)c2N2c3ccccc3)C2=O)oc(cc2)c1cc2F,2 F1883-1215,CCOC(Nc1c(C(Nc(cc(cc2)OC)c2OC)=O)oc2c1cccc2)=O,0 F6481-2496,Cc1c(C(N(CC2)CCSC2c2c(C)cccc2)=O)c(-c(cccc2)c2Cl)no1,2 SC70-0494,CCCc1nc(C(C2)C3(CCC3)CN2S(c2c(C)onc2C)(=O)=O)n[nH]1,2 S582-0376,COCCN(C(CNC(NCc(cc1)ccc1F)=O)Cn1c2ccc1)C2=O,0 Z4552696923,Cc(n1nc2)ccnc1c2C(Nc(cc1)cc(OCc2nc3ccccc3cc2)c1OC)=O,0 Z2358381425,O=C(c1ccc(-c2ccccc2)o1)NC1CN(CC(F)F)CC1,2 F6523-0629,O=C(c1cc(-c2ccco2)n[nH]1)NC(CC1)CCN1c1ncnc2c1CCCC2,2 F6783-7252,Cc1nc(CCC2)c2c(N2CC(CN(C3)C(Cn4ncnc4)=O)C3C2)n1,2 F6506-2325,OC(CNC(COc(ccc(Cl)c1)c1Cl)=O)(c1cscc1)c1cccs1,2 F6438-3463,CN(C)c1nc(CNC(c(cccc2)c2Cl)=O)nc(N(C)C)n1,0 Z3344691550,O=C(NCCc1c[nH]nn1)Nc1c(N2CCCC2)nccc1,2 8012-4827,COC(C(F)(F)F)(C(Nc1c(-c2ccccc2)nc2n1cccc2)=O)F,0 F2185-0141,CSCCC(c1nc(Cc2ccccc2)no1)N,0 Z2782860813,CCC(C(NS(c1cc(Br)cs1)(=O)=O)=O)NC(C)=O,0 Z4924723223,O=S(c1cc(C(C2)C2(F)F)ccc1)(Nc1ccccc1)=O,0 F6359-0740,O=S(c1cccs1)(N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1)=O,0 Z1334126223,CC(c1n[nH]cn1)NC(c(cccc1)c1N(CCC1)C1=O)=O,2 Z3040554006,Cc1cccc(CNC(N(CC2)CCC2(N2C)OCC2=O)=O)n1,0 SA93-0477,Cc1cc(C)nn1CCC(N(CCC1)CC1(CC1CC1)C(N)=O)=O,0 Z1577326666,CCC(C)(COCC1)N1C(c(cc1)cc(N2C)c1NC2=O)=O,2 Z3509109861,Cn(c(NC(C(C1)C1(CC1)c2c1cccc2)=O)c1)nc1C(O)=O,2 F6752-3607,COc(cc1)c2nc(N(CCC3)CC3NC(C3CC3)=O)sc2c1Cl,0 Z3345151096,Cn1c([C@@H](CN(C2)C(CCc3c(cc4)F)c3c4F)[C@H]2NC(C2CC2)=O)ncc1,2 S855-0701,O=C(C1CC1)NCC(CN(C1)S(c2cccc3nsnc23)(=O)=O)C11CCCCC1,2 F6365-0057,CC(C)CCNC(c1coc(NC(C2CCC2)=O)n1)=O,2 Z45516686,CC(C)(C)NS(c(cc1)ccc1Br)(=O)=O,0 F6436-2100,Cc1c(C(CNC(CCc2ccc(C(F)(F)F)cc2)=O)O)scc1,0 F6200-2378,OC(CNC(C(NCc(cccc1)c1Cl)=O)=O)c1ccc(C(F)(F)F)cc1,0 Z1716894645,O=C(CC1)Nc(cc2)c1cc2S(N1CC2(CC2)CCC1)(=O)=O,2 G786-0299,O=C(c(cc1)cc2c1OCCO2)Nc(cc1)ccc1-c1nc(cccc2)c2s1,2 P327-0431,CCN(C=Cc1c2c(C(NC(C)c(cc3)ccc3OCC)=O)c(C)s1)C2=O,2 Z3081086218,CCc(cncc1)c1NC(c(n(CC)nc1)c1Br)=O,0 Z2755353419,OC(COc(ccc(NC([C@]1(CCC2)[C@@H]2OCC1)=O)c1)c1Cl)=O,2 S836-4957,Cc1cc(C(F)(F)F)nn1CC(N(C[C@@H]1COC)C[C@@H]1C(N)=O)=O,0 F6127-0158,COc1ccc(CCC(NC(CC2CO)CC2O)=O)cc1,2 F6530-0110,COC(C(C(NCCc1cnccc1)=O)=C1N2CCC1)=CC2=O,2 Z3706961676,COc1cc(CCN(CC(N(CC2)CCC22OCC=C2)=O)C2)c2cc1OC,2 Z2277391682,CC1(CNC(Cn2nc(C)cc2)=O)CN(Cc2ccccc2)CC1,2 Z3002318677,COC1(CC(N(C2)CC3(CCC3)C2N)=O)CCC1,2 F6178-3174,Cc1cc(C(NCC(CC2)CCN2C(c2ccncc2)=O)=O)no1,2 M333-0284,Cc1n[nH]c(-c2cc(S(NCC3CCN(Cc4c(C)ccc(C)c4)CC3)(=O)=O)c(C)s2)c1,0 F2812-1651,Cc1cc(NC(CCCSc(cc2)ccc2OC)=O)no1,2 S903-1700,CC(C)S(N(CC1)CCC1c1nnc(C2)n1CCN2C(Cn1nc(C)cc1)=O)(=O)=O,0 Z2907286004,O=C(C1=CN=C(C2CC2)NC1=O)NOCC1COCC1,2 Z2991907956,CC(C)(c1nn(Cc(cc2)cc(OC)c2Cl)nn1)S(C)(=O)=O,0 F6713-1780,Cc1cc(C)nn1C(C=C1)=NN(C(CC2)CCN2C(Nc(c(F)ccc2)c2F)=O)C1=O,2 F6443-8404,N#CC(CC1)(CCN1C(C(CCC1)N1c1nc(cccc2)c2o1)=O)c1ccccc1,2 Z1345947327,CCC(c1nnc2n1CCCCC2)NC(N(CCC1)C1c1nc(cccc2)c2[nH]1)=O,2 F6523-3903,COc(cc1)cc(-c2n[nH]c(C(N(CC3)CC4=C3N=C(C=CC(F)=C3)N3C4=O)=O)c2)c1OC,2 Z1268726767,CCc1nc(C(CCC2)N2C(CCc2cccc(F)c2F)=O)no1,2 3487-1259,O=C1OC(c(cccc2)c2Cl)=Nc2c1c(CCCCC1)c1s2,2 Z3091768303,NC(CC(CC1)CN1S(CC1C2CC(C3)CC1CC3C2)(=O)=O)=O,2 Z1454410756,COc1c(C(c2ccco2)NC(c2ncc(C(F)(F)F)cc2)=O)cccc1,0 S855-0704,O=C(C1CC1)NCC(CN(C1)S(c2cc(CCC3)c3cc2)(=O)=O)C11CCCCC1,2 F6788-8139,CN(C(CCC1)CN1c(nc1)ncc1Cl)S(C)(=O)=O,0 F6507-1347,CCOc(ccc(C)c1)c1S(NCCC(C1CCOCC1)O)(=O)=O,0 V027-8833,O=C(CCN(C1CC1)c1nc(-c2cccs2)nc2ccccc12)N1CCOCC1,2 Z1454772005,Cc1cc(S(NC2CC3(CCOCC3)OCC2)(=O)=O)cc(F)c1,2 F6571-2752,OCCOC1(CNC(c(s2)ccc2Cl)=O)CCSCC1,0 F6559-6888,O=S(c1c2cccc1)(N=C2N(CC1)CCN1c1ncnc(C(F)(F)F)c1)=O,0 SB59-0533,Cn1c(C(C2)C3(CN(Cc(cc4)cc(F)c4F)C3)CN2C(COC)=O)nnc1,0 F5759-0041,COc(cc1)cc(OC)c1Nc1ncnc(-c2ccccc2)c1,0 F6506-4893,Cc1noc(C)c1CCC(NCC(C1CCOCC1)(c1ccccc1)O)=O,2 F6089-9813,Cc1cc(CNC(NCC2OCCC2)=O)c(C)o1,0 F2024-2103,O=C(NCC1OCCC1)NC(CC1=O)CN1c(cc1)ccc1Cl,2 G298-0352,Cc1cc(N(C=Cn2c3nnc2CCC(NCCC2=CCCCC2)=O)C3=O)cc(C)c1,2 L693-0072,CC(C)CCNC(NCCn1nnc2c1ccc(C(N1CCCC1)=O)c2)=O,0 T636-2323,COc1ccc(CC(N(CC2)CC2Nc2ncnc3c2CCC3)=O)cc1,0 F6190-2021,Cc1csc(C(NCCC(c2cccc3ccccc23)O)=O)c1,2 F6677-0370,Cc1nccn1CC(C1)CN1c1nc2ccccc2nc1C,0 F3395-0892,Cn1cnc(S(N(CC2)CCC2N(CC2)CCC2Oc2ncc(C(F)(F)F)cc2)(=O)=O)c1,2 Z3558973469,N#Cc1cc(CN(CC2)CCC2Nc2ncnn3c2ccc3)ccc1,0 Z4988559853,CC(C)C(c1cccs1)NC(C1(C2)C2C1)=O,0 F5611-0300,C/C(/c(cc(c(C)c(C)o1)c1c1)c1OC)=C\C(NC1=NCCS1)=O,2 SB92-1160,Cc1cc(C(N(C2)CC2N(CCN2CCCCC2)S(C)(=O)=O)=O)nn1C,2 Z3621221784,CN(CCOC1CC1)S(c1ncc(C(F)(F)F)cc1)(=O)=O,2 F537-0330,CCC1Oc(ccc(S(N(CC2)CCN2C(CNC(c2cccs2)=O)=O)(=O)=O)c2)c2NC1=O,2 Z2897037492,C[C@H](C(O)=O)NC(c1nsc2c1cc(C)cc2)=O,0 S836-3607,CNC([C@@H](C1)[C@@H](COC)CN1C(c(cccc1)c1C(O)=O)=O)=O,0 F6448-1517,O=S(Cc1ccc(C(F)(F)F)cc1)(Nc1cn(CC2CCOCC2)nc1)=O,2 F6522-1190,O=C(c1cc(Br)cnc1)NCc1cc(-c2cocc2)cs1,2 F2318-0437,O=C(c1c[nH]c2c1cccc2)N(CC1)CCN1c(cc1)nnc1-n1nccc1,2 G274-0087,O=C(C(CC1)CCN1c(cc1)nnc1-c1cccs1)N(CC1)CCN1C1CCCCC1,2 Z2223882065,Cn1nc(CNC(c(cn2)cc(Cl)c2OC2CCCCC2)=O)nc1,2 Z2295185370,CC(C)(C)n1ncc(CN2CCN(Cc(cc3)ccc3C(O)=O)CC2)c1,2 F6619-6172,Cc1cc(CN(CC2)CCN2c2cc(N3CCOCC3)nc(C)n2)no1,2 F6792-3694,CCc1cc(OCC(CC2)CCN2c2cc(C#N)ncc2)nnc1C,2 F6517-1257,OC(CNC(C1COCC1)=O)c1ccc(-c2cscc2)o1,2 Z2067574605,CCc(cc(cc1)O)c1NS(c1csc2c1cccc2)(=O)=O,0 Z370487106,CC(C)n1nccc1NC(C(C1)CN(CC(F)(F)F)C1=O)=O,0 F5382-0506,O=C(Cc1csc(Nc(cc2)ccc2F)n1)NCC1OCCC1,2 8014-2011,O=C(c1c2cccc1)N(CCc1ccccc1)C2NCCc1ccccc1,2 F6573-4886,COc1cc([nH]c(C(NCc2cncc(C3CC3)c2)=O)c2)c2cc1,2 Z4255817975,CC(Cc1nc(CC(C2)C2(F)F)no1)COC,2 Z1232556074,CCc1ccc(C(COCC2)N2C(c([nH]c2cc(Br)c3)cc2c3F)=O)o1,0 Z3831668139,CCOCC(N(CC1)CCN1c1ncnc2c1nnn2Cc1ccccc1)=O,0 Z2959329135,Cn1nccc1C(CCCC1)N1C(c(cc1)c(cco2)c2c1F)=O,2 Z1893315246,Cc1cc(S(N)(=O)=O)cc(C(NCC(CC2)CCN2C2CC2)=O)c1C,2 F6568-0192,O=C(c1noc(-c2ccccc2)c1)N(C1)CC(C2)C1CN2c1ncccn1,2 Z2843714774,CC1(COC1)NC(Nc1csc(C)c1)=O,2 F5033-7410,Cc1csc(C(NCC(CC2)CCN2C(Nc(cccc2)c2OC)=O)=O)c1,0 F6471-3608,COc(cc1)ccc1N(CC(C1)C(N(C2)CC2Oc2nccs2)=O)C1=O,2 F2018-1733,CN(C)CCN(C(c1cc(CCCC2)c2cc1)=O)c1nc(cc2OCCOc2c2)c2s1,2 SD67-0479,O=C(CN1Cc2ccccc2)N(CCCN(Cc2c(C(F)(F)F)cccc2)C2)C2C1=O,0 Z1654315622,O=C(C(CC1)CS1(=O)=O)NOC1COCC1,2 M031-0107,CC(C)CCNC(c1ccc(Cn2ncnc2)cc1)=O,0 F3382-7922,Cc(cc1)c(C)cc1NC(NC1=NC=CN(c(cc2)ccc2Br)C1=O)=O,0 F5792-0620,COc(ccc(Cl)c1)c1C(N(CC1)CCN1C(SC1)=NN=C1c1cccs1)=O,2 F2850-0203,COC1=CN(CC(NCc(cc2)cc3c2OCO3)=O)C(CSc(cc2)ccc2F)=CC1=O,2 F6414-0135,COc(ccc(Cl)c1)c1C(NCC(c(cc1)cc2c1OCC2)O)=O,0 F6672-2410,CC(C)c1nccc(N(C(CC2)C3)C2CC3=C2CC2)n1,2 F6359-0618,CC1Oc(cccc2)c2OC1C(N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1)=O,0 F6481-4399,CSc(nccc1)c1C(N(CC1)CCSC1c1cccs1)=O,0 Z4452898412,CC(c1ccccc1)NC(NS(c1cc(C#N)ccc1)(=O)=O)=O,0 Z1999702279,CC(C)(C)n1ncnc1CNC(NC1c2cccc(Cl)c2CC1)=O,0 Z4635071372,CN(CC(Nc(cccc1)c1SC)=O)C(c(cnn1Cc2ccccc2)c1Br)=O,0 F2833-0191,O=C(c1ccno1)Nc(cccc1)c1Oc1ccccc1,2 G765-0389,COc(cc1)ccc1N(CC1)CCN1C(NC(C1)COc(cc2)c1cc2OC)=O,0 Z1532003312,CC(C)[C@H](C(O)=O)NS(c(cc1)cc(N2C)c1N(C)C2=O)(=O)=O,0 SC98-0183,CCn(c(CC1)c2CN1S(c(cc(cc1)F)c1OC)(=O)=O)nc2-c1ncc(C)o1,0 F1711-0174,Cc(occ1)c1-c1nnc2sc(-c3c(C)oc(-c(cc4)ccc4Cl)c3)nn12,2 Z4761671447,Cc(ccc(-c1ccccc1)c1)c1C(NCc1cnccc1)=O,0 Z2034716847,Cc1cc(S(NC(CC(N2C)=O)C2=O)(=O)=O)cc(C)c1OC,0 D750-2496,O=C(CC1(CN(Cc2c3cccc2)C3=O)CCCCC1)Nc1n[nH]cc1,2 F6539-3518,O=C(C(Nc(cc1)ccc1OC(F)(F)F)=O)NCc(cc1)ccc1-c1cocc1,0 F5831-9401,O=C(NCC1(CCOCC1)c1ccccc1)Nc(cccc1)c1Cl,0 F2357-0221,CC(c(cc1)ccc1C(Nc1nc(-c(ccc(F)c2)c2F)cs1)=O)=O,0 F6658-6064,O=S(C1CC1)(N1CCC(COc2ncnc(C3CCC3)c2)CC1)=O,2 F0840-0015,COc1cccc(OCC(CN2CCC(CN(C(c3c4c5cccc4ccc3)=O)C5=O)CC2)O)c1,2 Y021-1902,O=C(C12NCCc3c1[nH]c(cc1)c3cc1Cl)Nc(cc1)c2cc1Br,0 F6561-7478,O=C(c1nccnc1)NC1CN(Cc2cscc2)CC1,2 SB04-0699,Cc1cn(CC(N(C)CCN(C(CC2)CN2C(N(C)C)=O)C2CCOCC2)=O)nc1,0 S428-0634,Cc(nc1)cnc1C(N(CCC1)C1c1nc(C2CCOCC2)no1)=O,0 Z1217455495,Cc1nc(CCCC2NC(CCC(N3)=Nc(n(C)nc4)c4C3=O)=O)c2cn1,2 F6494-1312,O=C(c1ncnc(OCc2ccccc2)c1)NC(CCC1)c2c1cccc2,2 F6481-4417,O=C(COc1cc(C(F)(F)F)ccc1)N(CC1)CCSC1c1cccs1,0 Z3027219336,CC(COC)(CC1)CCN1c1nnc(Cc2ccncc2)n1C,2 F6481-4296,O=C(c(s1)ccc1Cl)N(CC1)CCSC1c1cccs1,2 Z4924562414,O=C(Nc1cncc2ccccc12)N1Cc(cc(cc2)Cl)c2OCC1,0 E823-0630,O=C(CCc1nc(CN(CC2)CCN2C(c2noc(-c3cccs3)c2)=O)no1)N1CCOCC1,2 F6485-1196,Cc1noc(C)c1CCC(NC(CC1)CCC1Oc(nc1)ncc1F)=O,2 Z2226556903,CCn1nncc1C(N(CC1)CCN1c(cc1)cc(OC)c1F)=O,0 F6656-2436,Cc(cc1)nnc1OCC(CC1)CCN1C(c1nccc2ccccc12)=O,2 Z2610026775,Cc1nn(C)c(CNc(ccc(Cl)c2)c2C(N2CCCC2)=O)c1,0 Z3303020056,CC(C)c1cccc(C(C)NCCC(O)=O)c1,0 SC15-0003,O=C(CCC1CCCCC1)N1CCC(CN(CC(COc2nccnc2)C2)C2=O)CC1,2 G274-0253,CCCC(C)N(CC1)CCN1C(C(CC1)CCN1c(cc1)nnc1-c1cccs1)=O,2 Z2504153524,CCOC(Cc1cccc(NS(c2cc(C(CC3)=O)c3cc2)(=O)=O)c1)=O,2 F6549-7593,O=C(CN1N=CC=CC1=O)N(C(CC1)C2)C1CC2n1ncnc1,2 Z2964154214,O=C(c1ncc2n1cccc2F)N1CCC(CN(CCN2)C2=O)CC1,2 Z2974629319,Cc1ccnc(NCCN(Cc(cccc2)c2OC2)C2=O)n1,2 Z1103662336,O=C(c(ccc(F)c1)c1F)Nc1cc(C2CC2)n[nH]1,0 F6512-0482,CCOc(ccc(S(N1Cc2ccnn2CC1)(=O)=O)c1)c1F,0 Z1427110938,COC(c(ccc(NC(C(C1)=NOC1c1ccccc1)=O)c1)c1F)=O,0 F5837-0071,O=C(C1(CCCC1)c1cccs1)Nc(cccc1)c1NC(c1ccco1)=O,2 S639-1354,CN(C)C[C@@H](CN(Cc1ncccc1)C1)[C@H]1NC(c1cn(C)nc1)=O,0 Z2955030415,CC[C@@H]1N(CCN(CCC2)S2(=O)=O)CCCNC1=O,2 G503-0098,O=C(c1ccco1)N(CCC1)c(cc2)c1cc2NS(c(cc1)cc2c1OCCO2)(=O)=O,2 F2982-0191,O=C(CS(Cc1ccccc1)(=O)=O)N(CC1)Cc2c1cccc2,2 F6608-0575,Fc1cc(Br)cnc1OC1CSCC1,0 SC39-0056,Cc1c(C(N(CC2)CC2(c2nc(C3CCOCC3)no2)F)=O)sc(C)n1,2 F3319-0365,CC(CCCC1)C1(C(N1CC(NCc2cccs2)=O)=O)NC1=O,2 Z2396458117,Cc1c(C(NC[C@@H](CC2)O[C@@H]2c2nc(C3CC3)n[nH]2)=O)n(C)nc1,2 Z4910861555,O=C(c(cc1)c(C2)cc1-n1nnc(COc(cc3)ccc3Cl)c1)N2C(CCC(N1)=O)C1=O,0 G851-1173,O=C(Cn1nc(C(N2CCCC2)=O)c2c1cccc2)NC1CCCCC1,2 Z991508782,COCCC(C(O)=O)NC(COc(cc(cc1)Cl)c1Cl)=O,0 Z2838851635,CC(C)(C(N(CCC1)CC1c1nnn[nH]1)=O)c1ccc(C(F)(F)F)cc1,2 Z2952038588,Cc1cc(CO)cc(C)c1CNC(Nc1nc(C2CC2)ccc1)=O,0 F0594-0758,O=C(CSc1nnc(C2Oc(cccc3)c3OC2)o1)N1CCCCC1,2 Z3692620945,CC1N(Cc(cc2)ccc2-c2cccc(C(N)=O)n2)CCC1,2 Z1762728046,C[C@@H](C1)NCCN1S(c(cc1)cc(F)c1OC)(=O)=O,0 F5833-1304,CN(C)C(CNC(NCc(cc1)ccc1Cl)=O)c1cccn1C,2 F6473-7172,O=C(CCc(cc1)cc(Cl)c1F)N(C(CC1)C2)C1CC2N(C(CC1)=O)C1=O,0 Z2953975258,O=C(Cn1nnnc1-c1ccccc1)N1C(Cn2ncnc2)CCC1,2 Z2975255202,C(C1)C1c1cc(N(CC2)CCN2c2cnncc2)ncn1,2 Z1409904982,Cc1cc(C(CC2)NC(c3cn4nnnc4cc3)=O)c2cc1,2 F2042-0431,CCCS(N(CCC1)c(cc2)c1cc2NC(c1ccco1)=O)(=O)=O,2 F6785-6526,Cc(nc1cc2)cn1nc2OCC(CC1)CCN1S(N1CCOCC1)(=O)=O,2 Z1618127059,CCCC(C)c1n[nH]c(NS(c2c(CC)oc(C(OC)=O)c2)(=O)=O)c1,2 Z3143960140,Cc1ccnn1-c(cc1)ccc1C(N(C1CC1)C1CNCCC1)=O,2 Z1232062416,COc1cccc(C2(CCCC2)C(NC(C2)CN(CCN3CCOCC3)C2=O)=O)c1,2 F6561-5470,O=C(c1cc(-n2nccc2)ccc1)N(CC1)CCC1S(Cc1ccccc1)(=O)=O,2 F1909-1778,Cc1c(C)nc(C2CC2)nc1OCC1CCNCC1,2 S570-0047,CC(C)CNC(NCC1(CCC(N2)=O)C2=CCCC1)=O,0 L501-1705,CCNC(C(CCC1)CN1S(c1cc(-c2noc(C3CCCC3)n2)cs1)(=O)=O)=O,2 Z1970007326,C[C@@H](C(O)=O)NS(c1ccc(C#N)s1)(=O)=O,0 V005-8336,Cc1cn2c(NC3CCCCC3)c(-c3ccc(C(F)(F)F)cc3)nc2cc1,0 F6104-0240,Cc1cc(C(NCC(Cc2cccc(F)c2)N(CCN2)C2=O)=O)no1,2 Z3687013598,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(Cc1cc(CCOC2)c2cc1)=O,2 Z2436166350,O=C(c1cn(CC2NCCC2)nn1)N(CC1)c2c1ccc(F)c2,0 F6089-4200,O=C(c1cc(Cl)cc(Cl)c1)NCC(CC1)CCN1C1CCCC1,0 Z4925598659,CCC(C(NCC1=C(CC)C(CC)=NNC1=O)=O)c(cc1)ccc1Br,2 F1855-0062,Cc(cc1)c(C)cc1C(CSc1nc(-c2ccccc2)ccn1)=O,0 Z1241242662,CC(C)C(N(CCC1)CCN1C(C)C(Nc1cc(C(C)=O)ccc1)=O)=O,0 F500-0075,COc(cc1)ccc1NC(c1nnc(COCC(NCC2OCCC2)=O)s1)=O,2 SB73-0442,CC(C)C(N(CC1)C[C@]1(C[C@@H](C(NCCc1c[nH]c(cc2)c1cc2OC)=O)N1)C1=O)=O,0 Z3615008851,CC(C1)(C2)OC(C)(C)C12NC(c1cc(Cn2nncc2)ccc1)=O,2 F2481-1617,Cc1cccnc1NC(CC(CSC1=Nc2c3cnn2-c(cc2)ccc2F)N1C3=O)=O,2 Y503-1210,Cn1ncc(S(N(CC2)CCN2C(C(CC2)CCN2S(C)(=O)=O)=O)(=O)=O)c1,0 SC16-0057,CN(C)S(N1CC(Cc2nc(C(CC3)CCN3S(C)(=O)=O)no2)C1)(=O)=O,0 SB95-0676,O=C(C1CCC1)N(CCN1CCCC1)C(CCC1)CN1C(c1cscn1)=O,2 F6808-5255,CC(C)NC(C(C)N(CC1)CCN1c1nc(C)nc(C)c1)=O,0 F6133-0246,CC(N(CC1)CCC1C(N1C(CN(C)C)COCC1)=O)=O,0 F6516-1160,O=C(Cc1cccc2ccccc12)NCc1ccc(-c2cscc2)o1,2 SB99-0539,Cn1nc(CCC(N2CCCC2)=O)c(C2)c1CCN2C(c1cocn1)=O,2 V029-0462,CC1N(Cc2cc(-c(cc3)ccc3Cl)cnc2)CCCC1,2 SB29-0196,Cc1cc(C)nn1CC(N(C[C@H](C1)OC)[C@@H]1c1n[nH]c(C)n1)=O,2 M652-0664,CCc1ccc(C(C)NC(CN(c2c(-n3c4nnc3C)nccc2)C4=O)=O)cc1,0 Z2448129283,CCN(Cc(cc1)ccc1Cl)C(C(C)N)=O,0 S988-0620,Cc1ccc(C(N(C[C@@H]2CN(C3)C(C4CC4)=O)C[C@@]23c2nc(C)no2)=O)s1,2 F5831-9098,Cc1c(C(NCC2(CC2)c(cc2)ccc2F)=O)snn1,2 Z2297674841,NC([C@@H](CCC1)N1C(C(CCN1c(cc(cc2)Cl)c2Cl)C1=O)=O)=O,2 Z2178701137,NC(N(CC1)CC1(CC1)Oc2c1cccc2)=O,0 Z2298355850,CN(C(C1)C2(CCC2)C1OC)C(CS(C1CC1)(=O)=O)=O,2 F6734-1542,O=C(c(cc1)cc2c1ncs2)N(C1)CC(C2)C1CN2c(cc1)ncc1F,2 Z4919835388,CCc1c(C(O)=O)n(cc(cc2)Br)c2n1,0 Y044-3828,O=C(c1n[nH]c2c1CCC2)Nc(cc1)cc(C(N2C3CCC2)=O)c1NC3=O,2 S924-0235,O=C(CC1)NC1(CC1)CCN1S(c(ccc(F)c1)c1F)(=O)=O,2 F6617-2393,CC(CCCC1)N1C(c1cn(C2CCCC2)nn1)=O,2 F3406-4347,Cc1cccc(C)c1NC(COc1cc(C)nc(-c2ccc(C(F)(F)F)cc2)n1)=O,0 Z3083872114,Cc1c(-c2nsc(NC([C@@H](C3)[C@H]3c3ccncc3)=O)n2)scc1,2 Z2505228474,O=S(Cc1nc(C2(CCC2)c2ccncc2)no1)(c(cc1)ccc1Cl)=O,2 Z318-0356,Cc1n[nH]c(NC(C2Oc(cccc3)c3OC2)=O)c1-c(cc1)cc(OC)c1OC,2 Z2186403251,CN(C(CCCN1c2ccccc2)C1=O)C(NCCc1c[nH]nc1)=O,2 Z4052028721,Cc1csc(C(NC[C@](CCC2)(C3)[C@H]2CN3c2nn3nnnc3cc2)=O)c1,0 Z1289278289,CCOC1CCN(Cc(cc2)nn2-c(cc2)ccc2F)CC1,0 F5939-0201,O=C(C1Oc(cccc2)c2OC1)N(CC1)CCC1Oc1nc(cccc2)c2s1,2 Z2872933993,O=C(CN1N=C(CCCC2)N2C1=O)Nc1cnncc1,2 Z4617248764,COc(cc1)ccc1NC(C(N(CC1)C[C@H]1O)=O)c1ccccc1,2 Z2963900118,Cc1c(C(O)=O)nc(CCNS(c2cn(C)nc2)(=O)=O)s1,0 C069-0335,CC(CC(C)(C)N1)N(CC(N(CC2)CCN2c2cccc(Cl)c2)=O)C1=S,2 Z2950085819,O=C(NC[C@@H](C1)[C@H]1C(F)(F)F)Nc1nn(-c2ccccc2)nc1,2 Z2518232777,CC(C)NC(N)=NCCNC(c(cc1)ccc1O)=O,0 Z445457184,CC(Cc1ccco1)NS(c1c(C)oc(C)c1C(O)=O)(=O)=O,0 F6571-5975,CC(Cc1csc2c1cccc2)NS(c1c(C)n(C)nc1C)(=O)=O,2 3448-6755,CCC(CC)(NC1=S)NN1c1c(C)c(C)ccc1,0 C794-1313,CC(CC1)CCC1NC(C(C)(Cc1c2cccc1)N(CCc1ccccc1)C2=O)=O,2 F950-0115,Cc(c1c2sc(-c3noc(CN4c(cc(cc5)Cl)c5OCC4=O)n3)c1)nn2-c1ccccc1,2 F6441-2710,O=C(c1nccnc1)N(CC1)CCC1S(c(cc1)ccc1F)(=O)=O,2 SA24-0186,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(CCc1nc(cccc2)c2s1)=O,2 F5882-0447,CC(C)(C)OC(N1CCN(CCNC(c2cn(C)nc2OC)=O)CC1)=O,0 S904-1273,CC(C)C(N1Cc2nnc([C@H](C[C@@H](C3)O)N3C(Cc3cscc3)=O)n2CC1)=O,2 F6507-8802,CC(C)(C)CC(NCC1(CCSCC1)OC)=O,0 E017-0027,CN(CC1)CCN1C(C(CC1)CCN1c1nnc(N(CCC2)C2=O)s1)=O,2 Z809636920,CC(c(cc1)ccc1N1CCN(C)CC1)NC(c1cc(C)no1)=O,0 Z1696868531,CC(C)(c1cn(-c2cc(C)ccc2)nn1)O,0 F1138-0139,O=C(CN1CCOCC1)N(C(C1)c2ccco2)N=C1c(cc1)ccc1Cl,2 Z2875641614,O=C(c1nccc2c1cco2)N[C@H](C1)[C@@H]2[C@H]1CCCC2,2 F6508-0013,Cc(onc1)c1C(NCC(c1ccco1)c1ccco1)=O,2 G856-8994,CCOc(cc1)cc2c1nc(N(CC1)CCN1C(C1CC1)=O)s2,0 F6356-0544,CC(Cc1cocc1)NC(c1cc(C#N)ccc1)=O,0 F5529-0470,O=S(c1cccc(Cl)c1)(NCCOc(cc1)cc2c1OCO2)=O,0 J004-1845,CCc1c(C(CCC2)N2C(c(cnn2c(C(F)(F)F)c3)c2nc3-c2ccco2)=O)c(C)no1,0 F2017-0486,CC(CC1)CCN1C(Cn1c(cccc2)c2c(S(CC(N2CCCC2)=O)(=O)=O)c1)=O,2 F6209-0146,O=C(c(o1)ccc1Br)NCCCn1c(-c2ccccc2)ncc1,2 Z2967737041,CC(C)NS(Cc1c(CNc2nccn3nccc23)cccc1)(=O)=O,0 F1775-0012,Cc1nc(SCC(OC)=O)nc(N2CCOCC2)c1,0 Z1239877065,O=C(c(cc(cc1)N(CCN2)C2=O)c1F)NCc(cc1)cnc1-n1cncc1,2 F6436-2941,O=C(Cc(c(F)ccc1)c1Cl)NCC(CC1)CCN1C(c1cnccc1)=O,2 Z1738317430,Cc(nncc1)c1NC(N(CC1)CCC1c(cc1)ccc1Cl)=O,0 S212-0058,Cc1noc(COC(CCC2)CN2C(Cc2cscc2)=O)n1,2 SA49-0247,Cc1cccnc1C(N(C1)CC11OCC(CC(NCc2ccncc2)=O)C1)=O,0 F6161-0156,CC(C(NCCN(C=NC(c1ccccc1)=C1)C1=O)=O)Oc(cccc1)c1Cl,0 SB75-0102,CC(C)C(N(C[C@@H]1C[C@H](C2)NC(c3cocc3)=O)C[C@@]12c1nc(C)no1)=O,0 F5447-0124,COC(c1c(c(-c2cccs2)nn2C(CC3)CS3(=O)=O)c2nc(C2CC2)c1)=O,2 V018-1886,Cc1cc(OCC(c(cc2)cc(N3CC(N(C)Cc4ccccc4)=O)c2OCC3=O)=O)cc(C)c1,2 F2024-0752,Cc1cc(cc(CNC(NC(CC2=O)CN2c2cc(C)c(C)cc2)=O)cc2)c2[nH]1,2 F1174-2991,Cc1cc(C(CSc2c(c(CCCC3)c3s3)c3ncn2)=O)c(C)n1CCOC,2 F6713-6797,Cc1nn(ccnc2N(CC3)CCN3c(cc3)nn4c3nnc4C(F)(F)F)c2c1,2 V023-3044,CC(C)CN(C(c1c(N2c3c(C)cc(C)cc3)ncn1C(C)c1ccccc1)=O)C2=O,0 Z1269313104,OC(CC(CC1)CN1c1nc(C2CC2)ns1)=O,2 F2197-4564,CN(C1CNCCC1)c(nc1)ncc1Br,0 F5910-0499,CC(N(C)CC(N(CC1)CCN1c1nc(Nc2ccc(C)cc2)nc(C)c1)=O)=O,2 F6561-6242,Cn1ncc(-c2nccc(CNS(c3cc(CCCC4)c4cc3)(=O)=O)c2)c1,2 T787-6301,O=C(C(CN(C1)C(C2CCCCC2)=O)C11CCOCC1)NCCc1ccncc1,2 F3406-4390,Cc1cc(SCC(NCc(cc2)ccc2Cl)=O)nc(-c(cc2)ccc2F)n1,2 F2662-0169,O=C(C(NCC(c1cccs1)N(CC1)Cc2c1cccc2)=O)NCCc1c[nH]c2c1cccc2,2 D173-0032,OC(Cc1ccccc1)(C(CN1CCOCC1)c1ccccc1)c(cc1)ccc1O,0 C259-1208,CCC(N(CCc1c2)c1cc(S(N(CCC1)CC1C(NCC1Oc(cccc3)c3OC1)=O)(=O)=O)c2Br)=O,2 F6665-9640,O=C(Cc1cccc(C(F)(F)F)c1)Nc1nocc1,0 F6357-1532,CC(C)(CNC(c1c(C)oc(C)c1)=O)c1cscc1,0 F6814-3160,CC(C1)N(Cc2cc(F)cc(F)c2)CCN1c1ncnc2c1nc[nH]2,0 Z437485678,CCc1ccc(C(CNC(NCC(CN(CC2)Cc3c2cccc3)O)=O)N(C)C)cc1,0 Z1947425518,Cc(cc(cc1)Cl)c1C(Nc1cc(CC(O)=O)ccc1)=O,0 Z1526792190,CCc1nc(N(Cc2c(C3)cccc2)[C@@H]3C(N)=O)c(ccs2)c2n1,2 F6472-8204,O=C(CSc1ccncc1)N(CC1)CC1N(CC1)Cc2c1cccc2,2 F6438-3190,CN(C)c1nc(CNC(COCc2ccccc2)=O)nc(OC)n1,2 F6390-3492,O=C(Nc(cc1)cc(Cl)c1Cl)N(CCc1cccs1)C1CCOCC1,2 F1301-0237,O=C(C1=COCCO1)Nc(cccc1)c1-c1nc(cccc2)c2[nH]1,2 Z2615863654,C[C@](C1)([C@@H]1Nc1c(cc(cc2)F)c2ncn1)OC,2 F6559-1104,CC(C)Sc1ccc(CC(N(CC2)CC2n2c(cccc3)c3nc2)=O)cc1,0 Z2139055085,OC(C1)(CN1C(c1cn(-c2cccc(C(F)(F)F)c2)nn1)=O)c1ccccc1,2 F6571-5838,CC(Cc1csc2c1cccc2)NC(CCc(cccc1)c1F)=O,0 Z3294795363,O=C(c1n[nH]c2c1CCCN2)NCC1CC1,2 F5584-0005,O=C(NC1CCCCC1)N1CCN(Cc2nc(-c3ccccc3)cs2)CC1,2 F6287-0571,Cc1c(C(NCCc2nc(-c3cccs3)cn2C)=O)c(-c(cccc2)c2Cl)no1,2 F5791-2149,COc1cccc(-c2cc(C(NCC(F)(F)F)=O)n[nH]2)c1,0 M033-0715,O=C(c(cc1)ccc1-c1csc(C2CC2)n1)N(CC1)CCN1C1CCCCC1,2 F5854-4324,CCOc(cccc1)c1NC(N(Cc1cscc1)C1CC1)=O,0 F6161-0248,CCSc(cccc1)c1C(NCCN(C=NC(c1ccccc1)=C1)C1=O)=O,0 F6608-2489,COc(ccc(S(N(CC1)CCC1Oc1nc(C(F)(F)F)ccn1)(=O)=O)c1)c1OC,0 T482-0573,O=C(C1CCC1)Nc1cccn2nc(C3CCC3)nc12,2 F6485-1967,Cc1nc(OC(CC2)CCC2NC(c2ccncc2)=O)nc(C)c1,2 Z1583585144,CC(N1CCC(CNS(c2cc(C)c(C)s2)(=O)=O)CC1)=O,0 SC66-0390,Cc1c(CN(C2)CC3(CCOCC3)C2c2nncn2C2CC2)scn1,2 M785-1396,CC(C)NC(CN(C(c(oc1c2cccc1)c2N1CC(N2C(C)CCCC2)=O)=O)C1=O)=O,2 F6561-7735,O=C(Cc1cnccc1)NC1CN(Cc2cscc2)CC1,2 SC72-1671,COc1ccc(C2(CC2)C(N(C2)CC22OCc3c2cnc(-c2ccccc2)n3)=O)cc1,0 Z1612312903,CCC(C)n(c(C)c1)nc1NC(NC1(C)CCOCC1)=O,2 Z4917830905,CC(C)(C)C(Nc(cc1)cc(C(Nc2ncnc(-c(cc3)ccc3OC)c2)=O)c1F)=O,0 S512-0946,O=C(Cc1cscc1)N(CC1)CC1OCC1CC1,2 SC69-0818,O=C(CC1CCCC1)N(C1)CC2(CCCC2)C1c1nncn1C1CC1,2 F6360-9161,CC(C)(Cc1ccc2)Oc1c2OCC(N(C1)CC1Oc1cnccc1)=O,2 P201-0599,O=C1N(Cc2nc(C3CC3)no2)C=Cc2c1n(CC1CC1)cc2,2 Z316450632,O=C(CC(F)(F)F)Nc1cc(-c2nnc3n2CCCCC3)ccc1,0 L115-0074,Cc(cccc1)c1-c1csc2c1N=CN(Cc(cc1)ccc1N(CCC1)C1=O)C2=O,2 F6244-1661,O=C(CCC1CCCCC1)NCC#CCN1CCCCC1,2 Z3725162350,CC1N(Cc(cccc2)c2Cl)CCCC1NC(c1cnccc1)=O,2 V019-4469,C=CCNC(NC(CC1)CCN1c(cccc1)c1C(N1CCOCC1)=O)=O,0 Z2274843201,CC(CN(CCO)CC1)N1c(nc1)ncc1Br,0 SA69-0968,CC(CCC1)(CN1C(Cc1cccs1)=O)c1noc(COC)n1,2 S988-0432,CCS(N(C[C@@H]1CN(Cc2cnccc2)C2)C[C@@]12c1nc(C)no1)(=O)=O,2 Z2961175159,O[C@@H](CC[C@@H]1CC2)[C@H]1N2C(c1ccc(Cn2nncc2)o1)=O,2 S694-0375,Cc1cnc(C2CCOCC2)n1C(CC1)CN1C(c1c(C)nc(C)s1)=O,2 F6507-5196,CC(CNC(c(cc1)ccc1F)=O)(COC)OC,0 F6805-9066,N#Cc(cc1)ccc1N1CCC(COc(ccnc2)c2Cl)CC1,0 F6573-6929,O=C(CN1N=CC=CC1=O)N(CCN1c2ncccc2)CC1=O,2 S826-4935,CCn1nc(C)c(CN(C[C@@H]2CO)C[C@@H]2c2nc(COC)no2)c1,0 F6520-5592,Cn1ncc(-c2ccc(CCNC(C(Nc(cc3)cc(Cl)c3F)=O)=O)s2)c1,2 S652-0539,CN(C1)C(CN2CCOCC2)CC1(CC1)CCN1C(c1cocc1)=O,2 SA49-1429,O=C(CC1COC(C2)(CN2C(C2CC2)=O)C1)N1CCOCC1,2 Z2789830031,CC(C)C(C(C)C)NS(c1cc(CC(O)=O)ccc1)(=O)=O,0 Z2950242137,CC(c1csnn1)NCc1nc(CC(C)(C)CC2(C)C)c2s1,2 F6802-7262,Cc1cc(Br)cnc1N1CC(C(N2CCCC2)=O)OCC1,0 S974-0446,C[C@@H](C(N(C[C@H](C1)N(C)C)[C@@H]1C1)=O)N1C(c1cc2cccnc2cc1)=O,2 F6476-0289,O=C(Cn1ncnc1)N(CC1)CC1Oc1ncccc1,2 CM3884-1175,CN(CCC1(CCN(Cc(cc2)cc(O)c2OC)CC1)CC1)C1=O,0 Z2932303478,CC(C)n(c(C)c1)c(C)c1C(N(CCOC1)C1c1ccc(COC)o1)=O,2 F5126-0445,O=C(c1cc(F)ccc1)Nc(cc1)nnc1SCCN1CCOCC1,2 F2203-0106,O=C(CN1N=C2N=CC=CN2C1=O)c1ccccc1,2 SD56-0764,Cc1cc(C(N(CCC2)CC(C(N3C4CCCCC4)=O)N2C3=O)=O)c(C)n1CCCOC,2 Z2912229097,CCCCC(C)C(NCc1nnc2n1cc(C)cc2)=O,0 Z1456162640,Cc(ccc(C(O)=O)c1)c1-c1ccccc1,0 F2773-0670,CC(CN(C(C=C1)=O)N=C1c1ccco1)C(NC(C1=O)=C(C)N(C)N1c1ccccc1)=O,2 Z2001428616,O=C(c(cc1)cc(N=C2N3CCCCC2)c1C3=O)N(C(CC1)C2)C1C=C2c1ccccc1,2 Z4452898429,CC(C1CCCCC1)NC(NS(c1cnccc1)(=O)=O)=O,2 SD08-0537,CN(C)C(NCc1c(COC(CCC2)(C3)CN2C(Cc(cc2)ccc2Cl)=O)n3nn1)=O,2 L164-0609,O=C(C1(CC1)c(cc1)ccc1NS(c(cc1)ccc1F)(=O)=O)NC1CC1,0 SC87-0610,O=C(c(cc1)cc2c1[nH]cn2)NCC(CC1)CCC(N=C(c(cc2)ccc2F)N2)=C1C2=O,0 Z1658277103,O=C(c(cc1)cnc1-n1ncnc1)N(CCN1)C(c(cccc2)c2F)C1=O,0 F5823-0090,O=C(CCc1ccccc1)N1CCC(Cn2nccc2)CC1,2 S985-0153,CC(C)N(C[C@H]1CN(C2)C(COc3ccccc3)=O)C[C@@]12C(N1CCCC1)=O,0 M109-0198,CCCN(C1=O)C(SCC(Nc(cc2)cc3c2OCCO3)=O)=Nc2c1snc2-c1ccccc1,2 Z3686113879,Cc1c(CN[C@@H](CC(Cn2ncc(Cl)c2)C2)[C@H]2O)n(COC)nc1,0 F581-0306,COc(cc1)cc(C2)c1OCC2NS(c(cc(cc1)OC)c1OC)(=O)=O,0 Z2982732825,CC(N(C)Cc1cn(-c(cc2)c(C(F)(F)F)cc2Cl)nn1)=O,0 Z2435709859,NC(C1CCOCC1)C(N(CCC1)CCN1C(c(cc1)ccc1Cl)=O)=O,2 Z2168799337,COc(cc1)ccc1NC(c1c[nH]nc1-c1ncccc1)=O,0 Z4461544751,O[C@@H](CN(C1)C([C@@H]2[C@@H]3[C@H]2COC3)=O)[C@H]1NC(Cc1c[nH]c2c1ccnc2)=O,2 Z2802006579,CC(C(N[C@@H](C)c1nccnc1)=O)n1nc(C(F)(F)F)cc1,0 Y020-3943,O=C1NC(N(CC2)c3c2cccc3)=Nc2c1c(-c1ccncc1)ccn2,2 Z3547656556,Cc(ccc(-c1ccnn1C)c1)c1NC(c(nc(C1CC1)nc1)c1Cl)=O,2 E851-0782,CC(CCc1ccccc1)NC(c1c2ncc(CC(C)CC3)c3n2nc1)=O,2 SC73-0106,CN(C)C(c1nn(C)c2c1COC(CC1)(CCN1C(NC1CCCC1)=O)C2)=O,2 F710-0332,CC(CC1)(CCN1S(c(cc1)ccc1C(C)=O)(=O)=O)C(NCc1ccc(C)cc1)=O,0 F5033-3649,O=C(COc(cccc1)c1F)NCC(CC1)CCN1C(Oc1ccccc1)=O,0 F6755-2433,Cc1nc(NCc2nccnc2)c(c(CCCC2)c2s2)c2n1,2 S903-1352,CC(C)CC(N(CC1)CCC1c1nnc(C2)n1CCN2C(c1nccc2ccccc12)=O)=O,0 Z2143439654,Cn1c(cncc2)c2nc1CNC(Cc1noc2c1cccc2)=O,2 M952-0651,Cc([nH]c(C)c1S(NC2CCCC2)(=O)=O)c1-c1nnc(C2CC2)o1,2 Y080-1733,O=C(CC(C1)c2nc(cccc3)c3[nH]2)N1C1CCCC1,2 F353-0208,CC1=Nc(cc(cc2)C(NCCc(cc3)ccc3SC)=O)c2N(C)C1=O,2 F6516-0140,COc1cccc2c1oc(C(NCc1ccc(-c3cccs3)o1)=O)c2,2 F5596-0407,CC(C)c1nnc(C(CC2)CCN2C(c2cc(-c(cc3)ccc3F)nn2C)=O)o1,0 S049-0413,O=C(NC1CCCC1)N(CC1)CC1Oc(cc1)ccc1-c1noc(C2CC2)n1,2 SB70-0018,CN(C)[C@@H](Cc1c2)Cn1nc2C(N(Cc1cccs1)C1CCCC1)=O,2 Z5030079704,Cc1nc(O)cc(COC(c(cc2)cc(NC(N3c4ccccc4)=O)c2C3=O)=O)n1,2 4676-0660,OC(c1cccnc1SC(CC(N1c(cc2)ccc2N2CCOCC2)=O)C1=O)=O,2 Z1186106179,CC(c1ccccc1)NC(NC(CCN1c(cccc2)c2F)C1=O)=O,0 F6482-6608,O=C(Cc1cscc1)NCc(cc1)cnc1-c1ccco1,2 Z2996673174,CN1C(CCN2Cc3cccc(C(O)=O)c3OCC2)CCC1,2 F6540-9079,O=C(CN(CC1)CCC1C(F)(F)F)N1CCCC1,2 F6253-1995,Cc1cc(-c2nn(C=NN(CC(N(CC3)CCN3c3ncccc3)=O)C3=O)c3c2)c(C)cc1,2 F6441-0182,CC(C)CS(C(CCC1)CN1C(C(C)(C)Oc(cc1)ccc1Cl)=O)(=O)=O,0 Z1437249971,Cc1c(C(NCCNS(c2ccc(C)cc2)(=O)=O)=O)[nH]c2c1cc(C)cc2,0 G786-1812,Cc1cc(NC(CSc2nc(C3CCCCC3)nc(N(C)C(N3C)=O)c2C3=O)=O)no1,2 M569-0103,Cc(cccc1)c1S(N(CC1)Cc2c1nc(-c(cc1)ccc1Cl)nc2)(=O)=O,0 V023-2129,CC(C)CN(CC(C1)OCCN1C(NCC=C)=O)C(c1ccc(C)cc1)=O,0 F2370-1328,O=C(Cc1cccs1)NCC(C1)CN(Cc(cc2)ccc2F)C1=O,2 F0696-4709,Cc1cc(C)nn1CCNC(c(cc1)nnc1N1CCOCC1)=O,2 F0916-6865,O=C(CCN1N=Nc(cccc2)c2C1=O)N(CC1)CCN1c1ncccc1,2 F6519-4182,Cn(cc1C(NCC(c2cccs2)n2nccc2)=O)nc1OC,2 F5615-0325,O=C(Cn(cc1)c2c1cccc2)N1CCN(Cc2csc(-c3ccccc3)n2)CC1,2 F823-0196,CC(C(Nc1c2)=O)Oc1cc(S(N(CC1)CCN1C(Nc(cc1)ccc1OC)=O)(=O)=O)c2Cl,0 S693-1518,Cc1cnc(C)n1CC(CCC1)CN1C(NC1CCCCC1)=O,2 Z927332352,O=C(COc1ccccc1)N(CC1)CCC1C(N1CCNCCC1)=O,2 F6734-1472,O=C(c1noc(C2CC2)c1)N(C1)CC(C2)C1CN2c(cc1)ncc1F,2 V004-4753,CCN(C(CN1C(Cc2ccccc2)C(NCCN2CCOCC2)=O)=C(C(c2c(C(F)(F)F)cccc2)N2)C1=O)C2=O,2 F6479-3260,O=C(C(C1)OCc2c1cccc2)N(CC1)CCC1Oc(ccnc1)c1Cl,2 Z4916884703,[O-]C(C(c(ccc(F)c1)c1Cl)N(CC1)CC1(Cc(cc1)ccc1Cl)O)=O,0 F6442-6585,COC(CC1)CCN1C(CC1)CCN1C(c(ccc(OC)c1OC)c1OC)=O,0 Z3844105482,Cc(cc1)cc(NC(C(CC2)CCN2C(N=CN2)=CC2=O)=O)c1Cl,0 Z3775591806,C[C@H](C(NCCCC(NCCC(O)=O)=O)=O)Oc(cc1)ccc1O,0 F6713-7233,CCc1c(C)ncnc1N(CC1)CCN1c1ncnc2c1[nH]c(C)c2,2 S544-0428,O=C(COc(cc1)ccc1F)N1CC(CCOc(cc2)ccc2F)CC1,0 F6442-1412,O=C(Nc(cc1)ccc1F)N(C1)CC1S(C1CCCCC1)(=O)=O,0 F6111-1957,N#Cc1ccc(COCC(CC2)CCN2C(c2cc(cccc3)c3o2)=O)cc1,2 F6583-6060,CCOc(nc1C)nc(C)c1NC(C(C=C1)=NN(C)C1=O)=O,2 F3088-1794,Cc(oc(-c(cccc1)c1Cl)c1)c1C(Nc1nccs1)=O,2 Z4767388688,O=C(c1cscc1Cl)Nc(cc1)cc2c1[nH]c(-c1cnccc1)n2,2 Z1787176404,CC(C)Oc1cccc(CN(C)C(c2nccc(N3CCOCC3)c2)=O)c1,2 Z362521266,CNC(c1cc(S(N(CCC2)c3c2cccc3)(=O)=O)cn1C)=O,0 J007-1386,CC(C)c1noc(C(CCC2)N2C(Nc(cc2)cc3c2OCCO3)=O)c1,2 F6755-7241,CN(C=CN=C1N(CC2)CCN2S(C2CC2)(=O)=O)C1=O,2 S830-2164,OCC(CN(CC1)C(c(cc2)ccc2OC(F)(F)F)=O)C1(F)F,0 F2077-0545,Cc1nc(Nc(cc2)ccc2NC(c(o2)ccc2Br)=O)nc(N2CCCC2)c1,2 Z1449746538,O=C(C1NCCCC1)Nc1ccccc1,0 F2704-0002,Cc(c(Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1)ccc1)c1Cl,0 F6473-4386,O=C(C1C2CC=CC1)N(C(C1)CN1S(C1CC1)(=O)=O)C2=O,2 S762-1011,O=C([C@@](CCCC1)(CC2)[C@H]1N(Cc1ccccc1)S2(=O)=O)NC1CCC1,2 Y041-8886,O=C(C(CCC1=O)(N2)N1c(cccc1)c1C2=O)Nc1cccc(Br)c1,0 F3406-3995,COC(c(cc1)ccc1NC(Cn(cc1-c2ccccc2)nc1N1CCSCC1)=O)=O,2 F6764-1538,Clc1cc2ccc(C3CCN(CCN4CCOCC4)CC3)nc2nc1,2 Z1526716088,O=C(c1cnco1)NCc(cc1)ccc1Cl,0 F6791-7253,Cc1nccn1-c1cc(N(CC2)CCN2c2c(C)c(C)ccc2)ncn1,0 Z1335066873,COc1ccc(Cc2noc(CC3CC(CC4)NC4C3)n2)cc1,2 F6515-0218,Cc1noc(C)c1CC(NCc1cccnc1-c1cscc1)=O,2 F6476-1812,CCOC(CCC(N(CC1)CC1Oc(cc1)ncc1Br)=O)=O,0 SC58-0148,CCS(N(C1)CC1(CN(C)C1)C1c1ncc(C)o1)(=O)=O,0 F6672-1654,CC=C(CC1CC2)CC2N1C(c1cc(F)cnc1)=O,2 F6525-6090,Cc(n(CCNC(Cc(ccc(F)c1)c1F)=O)nc1C)c1-c1cccs1,2 V025-3823,CC(C)C(c(ccc(OCC(N1CCN(CCN(C)C)CC1)=O)c1)c1N1CC2CC2)=CC1=O,2 F6442-0098,O=C(CN(c(cccc1)c1O1)C1=O)N(C1)CC1S(c(cc1)ccc1F)(=O)=O,2 S497-1205,CCCS(N(C1)CC1Oc(cccc1)c1-c1nc(C2CC2)no1)(=O)=O,0 F6799-8870,CC(C)S(N(CC1)CCN1c1nc(C#N)ccn1)(=O)=O,0 F6726-4623,CN(C=NC(N(CC1)CCN1c(ncnc1-c(cc2)ccc2OC)c1F)=C1)C1=O,2 Z3216016716,O=C(c1c2scc1)N(CC1CCOCC1)C=C2Cl,0 Z1739157364,CC(CCC1)(CN1S(c(cc(cc1)F)c1Cl)(=O)=O)C(O)=O,0 Z2108961646,CS(N(CCC1)CCN1C(Cn1ncc(Cl)c1)=O)(=O)=O,0 Z1767799940,O=C(C1COCCC1)N(C1)CC1OC(F)F,0 S932-7390,O=C(c1ccc(Cn2cncc2)o1)N(CC1)CC1n1nnc(COc2nccnc2)c1,2 F6445-0102,O=C(c1cc(Oc2ncccc2)ccc1)Nc1nc(C2CC2)cs1,2 F5095-0229,CCn1c(N(CC2)CCN2C(COc(ccc(Cl)c2)c2Cl)=O)ncc1,0 C137-1433,CCC(N(CCc1c2)c1cc(S(N(CC1)CCN1c(cc1)ccc1OC)(=O)=O)c2Br)=O,0 C429-0451,COc(cc1)ccc1NC(c1c2cccc1)N(Cc(cccc1)c1Cl)C2=O,0 Z4497430638,OCC(C1)(C2)OC3(CCC3)C12NC(C1=CN=C(C2CCC2)NC1=O)=O,2 F6681-3603,N#Cc1cc(N2CC(COc3cnccc3)C2)nc2ccccc12,2 S787-1017,O=C(CCc1ccc(CC2CCN(CC3CC3)CC2)cc1)NC1CC1,2 K284-2602,O=C1N(C=CC=C2)C2=NC(CSC(N2Cc3ccccc3)=Nc(ccc(N3CCOCC3)c3)c3C2=O)=C1,2 F6446-0803,O=C(Cn1c(cccc2)c2nc1)NC(CC1)CCN1c1nccs1,2 8012-9846,Cc1ccc(CC(CC(N2Cc3ccco3)=O)C2=O)cc1,2 D715-0219,OC(C(c1ccccc1)Oc(cc1)cc(O2)c1C(CCC1)=C1C2=O)=O,0 Z2408031186,C[C@@H](CC1)C[C@H](C)N1C(c(cn1)ncc1OCc1ccccc1)=O,2 Y041-6303,CS(N(CC1)CCN1C(c1n[nH]c(-c(cc2)cc3c2OCC3)c1)=O)(=O)=O,2 Z985016746,CN1CC(CNC(Cc(cc2)ccc2C#N)=O)OCC1,2 F6514-1779,CC(Nc1ccc(CC(NCCN(C(C)=CC(OC)=C2)C2=O)=O)cc1)=O,2 Z3538220931,CC(CN(C)C(c1c(N)n(-c(cc2)ccc2F)nc1)=O)O,0 F6178-4132,O=C(c(cccc1)c1Br)NCC(CC1)CCN1c1ccncc1,0 Y020-8693,O=C(CSc1nnc2n1c(cccc1)c1[nH]2)Nc1nc(-c(cc2)ccc2Cl)cs1,2 Z1563605469,CC(C)Cn1ncc(C(NC(CC2)CN2c(cccc2)c2C(N)=O)=O)c1C1CC1,0 Z1438061783,CN(C1CCCC1)S(NCCCSc1ccccc1)(=O)=O,2 F5911-0192,Cc1cc(Nc(cc2)ccc2NC(COC)=O)nc(NC2CCCCC2)n1,2 F6529-3718,O=C(CN(C(CC1)=O)C1=O)N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O,2 Z3522401504,Oc1cccc(C(CCC2)CN2C(CC(CNCC2)S2(=O)=O)=O)c1F,2 F5806-0168,Cc1c(CCC(Nc(cc2)cc(C3)c2-c2c3cccc2)=O)c(C)n[nH]1,2 SA96-1065,CC(C)CNC(C1C(C2)(CN2C(c2cn(C)cn2)=O)CN(Cc2ccccc2)C1)=O,0 P804-1206,O=C(c1cc2cccnc2cc1)N(CC1)CCN1c1cc(-c2cccs2)n[nH]1,2 C712-1061,CN(C1CCCCC1)C(c1cc(COc2c-3cccc2)c3s1)=O,2 F0405-2686,Cc(c(NC(CCOc1ccccc1)=O)ccc1)c1Cl,0 F2659-0071,COc(ccc(S(NCC(c1ccco1)N(CC1)c2c1cccc2)(=O)=O)c1)c1OC,2 F1515-0148,O=S(c1ccccc1)(NC(CCCC1)C1n1nnc(-c2ccccc2)c1)=O,2 SB25-1016,CN(CC(N1CCN(C)CC1)=O)C(C(CC1)CCC(N=C(c2ccccc2)N2)=C1C2=O)=O,2 Z2155015220,CCc(n(-c1c(C)cccc1)nc1)c1NCc1cnnn1-c1ccccc1,2 F924-0225,O=C(Nc(cc(cc1)F)c1F)N(CC1)Cc2c1n1nc(-c(cc3)ccc3Cl)nc1s2,0 L998-1870,O=C(C1CCC1)Nc1cccc(N(CC(C2)C(Nc3ccc(C(F)(F)F)cc3)=O)C2=O)c1,0 Z2203565471,CCOCc1nc(-c2cn(C)nc2C(F)(F)F)no1,0 Z3102054438,CC(C)c(cc1)ccc1N(C)C([C@@](CNC1)(C2)[C@@H]1CS2(=O)=O)=O,2 F2375-0293,O=C(NCC(CN1c(cc2)cc(Cl)c2Cl)OC1=O)Nc(c(F)ccc1)c1F,0 Z1175487212,CNC(C(CCC1)CN1C(Cc(cc1)ccc1-n1nnnc1)=O)=O,2 S056-0446,COc1ncc(CN(CC2)CC2NS(C2CC2)(=O)=O)cc1,0 S895-1028,COCCc1nnc2n1CCC(CC1)(CCN1C(c1ncccn1)=O)CC2,2 Z425636076,OC(c(c(Br)c1)nn1-c1ccccc1)=O,0 F6257-1770,CCC(C(Nc1ncnc(N2CCOCC2)c1)=O)c1ccccc1,0 SC70-0398,CCCc1nc(C(C2)C3(CCC3)CN2C(c2cc([nH]cc3)c3cc2)=O)n[nH]1,2 D356-2524,O=C(C(CCC1)CN1S(c1cccs1)(=O)=O)Nc(cc1)c(C(F)(F)F)cc1Cl,0 Z1537226917,CC(Nc(cc1)c(C)cc1NC(c1c(C)n(-c2ccncc2)nc1)=O)=O,2 Z3482756291,CC(C)(C)OC(CC(CCC(N1)=O)C1=O)=O,0 F6685-8894,Cc1noc(C)c1S(N1CC(COc(nccc2)c2Cl)CCC1)(=O)=O,2 Z2273234233,FC(c1nc(CNc2ncnc3c2ncn3C2CC2)ccc1)(F)F,0 F6747-5989,Clc1cn(CC(C2)CN2c2nccn3nc(C4CC4)cc23)nc1,2 Z1519698150,O=C(c1cnncc1)Nc1ccc(Cc2ccncc2)cc1,2 Z1285927692,CC(C)Cn1ncc(NC(C(c2ccccc2)N(CC2)CCC2O)=O)c1,0 F6743-7917,CN(C1CN(Cc(c(F)ccc2)c2Cl)CCC1)S(C1CC1)(=O)=O,0 G868-1528,Cc1nc(ccc(S(N(CC2)CCN2c2nc(N3CCN(C)CC3)cc(C)n2)(=O)=O)c2)c2s1,2 F6154-0281,O=C(c1ccco1)Nc1nc(C(N(CC2)Cc3c2cccc3)=O)co1,2 F6496-0942,Cc1cc(CNC(C2(CCOCC2)c2ccccc2)=O)ncn1,2 SA93-0483,Cc1cn(Cc2cc(C(N(CCC3)CC3(CC3CC3)C(N)=O)=O)no2)nc1,2 J025-1146,OC(c1ccc(C(C2)c(scc3-c(cccc4)c4F)c3NC2=O)cc1)=O,0 J024-0045,CC(C)(C1)CC(Nc(cccc2)c2N(CC(NC2CCCC2)=O)C2c3ccco3)=C2C1=O,2 Z135577348,Cc1noc(C(NCc2cccc(CNC(c3cc(C)no3)=O)c2)=O)c1,2 Z3491087885,CC(C)OC(C(N1Cc2nnc(Cc3cccc(F)c3F)n2CC1)=O)c1ccccc1,2 Z4662174835,CNc(cc1)ccc1NC(C(NC=C1OC)=CC1=O)=O,0 Z4783340693,O=C(c(cc12)cnc1c(F)ccc2F)NC1COC1,0 F6604-8670,O=C1N(CC(C2)CN2c(cc2)nn3c2nnc3)N=C(CCCC2)C2=C1,2 F6708-8339,O=C(c(cc1)ccc1S(N1CCCC1)(=O)=O)N1CC(C2)(CC2c2ccccc2)C1,2 Z3685946817,Cc1c(C)nc(C(N)=O)nc1N(CC1)C[C@@H]1NCc1cc(F)cc(OC)c1,0 Z3216005295,CC(C)C(CNC(c1n[nH]c(N=CN2)c1C2=O)=O)c1ccccc1,2 SC58-0150,Cc1cc(C(N(C2)CC2(CN(C)C2)C2c2ncc(C)o2)=O)no1,2 SC16-0063,CS(N(CC1)CCC1c1noc(CC(C2)CN2C(COc2ccccc2)=O)n1)(=O)=O,2 G505-0037,O=S(c(cccc1)c1Cl)(Nc(cc1)cc(CCC2)c1N2S(c1ccccc1)(=O)=O)=O,0 D491-4233,CC1Oc(ccc(NC(c2noc(-c(cc3)cc4c3OCCO4)c2)=O)c2)c2NC1=O,0 C301-4055,O=C1Oc(cccc2)c2C(N(CC2)CCN2c2cccc(C(F)(F)F)c2)=C1CN1CCCC1,2 Z2347330156,CCCC(C1)OCCN1c1nc(CCCC2)c2cn1,2 Z3610623806,CC(N(C1)[C@@H](COC2)[C@@H]2C1(CC1)CCN1C(C1(Cc(cc2)ccc2O)CC1)=O)=O,2 Z1725731379,CC1(COCC1)NS(c1cn(CC(F)(F)F)nc1)(=O)=O,0 SB57-0217,Cc1noc(C(C2)C(C3)(CN3C(C3CCCC3)=O)CN2C(COC)=O)n1,2 Z2232892528,CC(C)C(C1)OCCCN1C(c1c[nH]nn1)=O,2 Z1682672785,C(c1ccno1)c1noc(-c2ccc(CSc3ccccc3)cc2)n1,2 F2459-2037,CC(C)(C)n1ncc(C(C)=NN2CC(NCc3ccco3)=O)c1C2=O,2 F6442-0755,Cc1noc(C)c1CCC(N(C1)CC1S(c(cc1)ccc1OC)(=O)=O)=O,2 F6773-4246,CSc(nc1)nc(N(CC2)CCC2Oc2nc3ccnn3cc2)c1C#N,0 F6521-7397,Cn(cc1)c2c1cc(C(CNC(COc(ccc(Cl)c1)c1Cl)=O)O)cc2,2 Z1419815739,CC(C(NC1CCN(Cc2ccccc2)CC1)=O)NC(CCC1)C2C1OCC2,2 F6679-2654,O=C(CSC1CCCC1)N(CC1)CC1Oc(ccnc1)c1Br,0 F5062-0120,Cc1c(C(N(CC2)CCN2c2ncnc3c2nnn3C)=O)c(-c(cccc2)c2Cl)no1,2 F5882-0998,O=C(c(ccc(Cl)c1)c1Cl)NCC(CC1)CS1(=O)=O,0 F6795-3267,Cc(nc1cc2)cn1nc2N(CC1)CCN1c1nc(COC)ns1,2 P316-0218,Cc1cc(S(NC(CCN2c(cc3)ccc3OC)C2=O)(=O)=O)c(C)cc1,0 F5001-1539,COC(C(CC1)CCN1C(Cc1noc(-c(cccc2)c2F)c1)=O)=O,2 F6540-1126,CS(c1c(N(CCC2)CC2=C)nccc1)(=O)=O,2 F6445-6634,COc(cc1)cc(C(NCc(cccc2)c2-c2cscc2)=O)c1Br,0 F6782-6309,Cc(ccc(N(C=CN(CC1OCCC1)C1=O)C1=O)c1)c1F,0 Z1359487598,Cc1nc([nH]cc2)c2c(Sc2nnc(-c(cccc3)c3OC)n2C)n1,2 F2382-0398,O=C(c1cn(Cc2ccccc2)nc1OCc1ccccc1)N(CC1)CCN1c1ccccc1,2 Z2347015949,CN(C)C(c(cc1)nnc1N1CCN(CC(N(C)C2CCCCC2)=O)CC1)=O,2 Z3638665220,Cc1nsc(N=CN2Cc3cc(C(F)(F)F)cs3)c1C2=O,0 E542-1181,O=C(CCc1cn(Cc(cccc2)c2Cl)c2c1cccc2)N(CC1)c2c1cccc2,2 Z1419074516,CC1(CC1)C(NCCc1cccc(Cl)c1)=O,0 F6670-4883,CSc1ccc(CN2CCC(CN(C=Nc3c4cccc3)C4=O)CC2)cc1,0 Z1444139329,OC(c1ccc(C(N(CC2CCOCC2)Cc2ccccc2)=O)s1)=O,2 SD31-0219,Cc1noc(C)c1C(NCCn1nc(C(N2CCOCC2)=O)c2c1CCOC2)=O,2 V018-6507,CC(CN(CC1)CCN1c1nc(C)nc(C)c1Cc1c(C)cccc1)O,0 Z2689320945,NC(c(cc1)ccc1S(N[C@@H](CCCCC1)[C@@H]1C(O)=O)(=O)=O)=O,0 G500-0748,CC(C)CC(NCC(c(cc1)ccc1N(C)C)N(CC1)c2c1cccc2)=O,0 Z2763541522,CN(C)CCc(cc1)ccc1-c1cccc(C2)c1NC2=O,0 S926-7833,O=C(Nc(cc1)cc2c1OCCO2)N(CCC1)CC1OCc1noc(-c2ccncc2)n1,2 Z1739116790,CN(C(C(O)=O)c1ccccc1)S(c(cccc1)c1Cl)(=O)=O,0 SB49-0804,Cn1c(C(N(CCCC23CCOCC3)C2C(N)=O)=O)ccc1,2 Y041-4792,CC(C1)Oc(cc2)c1cc2-c1nc2ccccc2c(C(O)=O)c1,2 SD25-0424,O=C(CCC(CN(C1)C(c2ncccn2)=O)C11CCCCC1)N1CCCC1,2 Z7881505782,Cc1c(CCC(N(C2)Cc3c2cccc3)=O)c(C)n[nH]1,0 Z2958428205,CCN(CC(F)F)C(c1cnnn1-c1cccc(Cl)c1Cl)=O,0 F6513-2036,Cc1cc(C)nn1-c1ccc(CCC(N(CC2)CCC2(c2ccccc2)C#N)=O)cc1,2 Z1070443492,Cc1cc(C(NC(CC2)CCN2c(ncc(C(N)=O)c2)c2Cl)=O)c(C)o1,0 F6747-5334,Cc1cn(CC(C2)CN2c2cc(C)nc(SC)n2)nc1,0 F6439-4415,CC(C)S(c1ccc(CC(NCCn(cc2)nc2-c2ncccc2)=O)cc1)(=O)=O,0 F6525-6273,Cc(n(CCNS(c(cccc1)c1OC(F)(F)F)(=O)=O)nc1C)c1-c1cccs1,0 F6709-0345,CCc(cn1)cnc1OC(CC1)CCN1c1nc(cncc2)c2s1,2 F2145-0102,Cc1nccn1CCNc1nc(ccc(Cl)c2)c2s1,2 SB40-0623,CC(C)CN(CC1NC(c2noc(C)c2COC)=O)CC2(CCOCC2)NC1=O,2 F0630-1107,Cc1cc(CSC2=NCCN2C(C2CC2)=O)c(C)cc1,0 F5581-1951,CC(C)c1cccc2c1nc(N(CCn1nc(C)cc1C)C(c1cc(C)no1)=O)s2,2 Z1365995468,CC(c(cccc1)c1Br)NC(NCC1(CCCC1)C(OC)=O)=O,0 F2199-0441,CC(C)n1nccc1NC(CN(C(c1c2cccc1)=O)C2=O)=O,2 SC02-0635,Cc1c(CN(CC2)CC2(CCOC)NS(C)(=O)=O)scc1,0 Z2001457359,CS(C(CCC1)CCN1C(c1cc(cccc2)c2[nH]1)=O)(=O)=O,0 Z1306251177,CC(CC1)CC(c2ccco2)N1C(NCCc(cc1)ccc1O)=O,2 F6456-0287,Cc(cc1NC(C(CC2)CCN2c2ncnc(-n3ncnc3)c2)=O)nn1-c1ccccc1,2 Z2644813448,O=C(CCc1ccncc1)N(C(CC1)C2)C1CC2Oc1ccccc1,2 F6436-3878,O=C(c1cc(cccc2)c2[nH]1)N(Cc1cocc1)Cc1cccs1,2 SB96-0092,Cc1nccn1CCN(C(CC1)CN1C(CCc1ccccc1)=O)S(C)(=O)=O,2 F6561-5476,Cc1c(C(N(CC2)CCC2S(Cc2ccccc2)(=O)=O)=O)c(C)nn1C,2 SB16-0958,CCS(N1[C@@H](CCN(Cc(cc2)cc3c2OCCO3)C2)[C@@H]2COCC1)(=O)=O,2 F3227-1633,O=C(c(cccc1)c1Cl)Nc(cc1)cc(Oc2c3cccc2)c1C3=O,0 F6403-1719,Cc1cc(C)nn1-c1nc(CCNC(c2c(C)oc(C)c2)=O)cs1,2 E640-0148,O=C(c1ccc(CN(CC(N2C3CCCC2)=O)C3=O)cc1)NCCC1=CCCCC1,2 SC96-0134,CCCN(C1(COCC1)CN(CC1)S(Cc(cc2)ccc2F)(=O)=O)C1=O,2 SA71-0794,Cc1cn(CC(N(CCC2)CC2(CC2CC2)c2noc(C3CCOCC3)n2)=O)nc1,0 Z4650652713,CC(C(CC1)(CN1C(c(cc1)cc2c1oc(N)n2)=O)O)NC(C)=O,0 Z1686740911,CCCn1ncc(NC(C)c2nc(-c3cc(F)c(C)cc3)no2)c1,0 J109-0745,O=C(CCc(cc1)cc2c1OCC2)Nc(cc1)cc(C(N2[C@H]3CCC2)=O)c1NC3=O,2 SD01-0401,COCCCn(c(CC1)c2CN1C(CCS(c1ccccc1)(=O)=O)=O)nc2-c1cocn1,2 F707-2013,CC(C)CC(C)NC(C(CC1)CCN1c1nn2c(-c(cc3)ccc3Cl)nnc2cc1)=O,0 Z250-0013,O=C1NC(N2CCN(Cc3ccccc3)CC2)=Nc2c1scc2-c1ccccc1,0 Z4658970133,NCC1(CC1)c1cc2ccccc2cc1,2 Z2635279997,CC#CCNC(c(cc1)cc(N2C3CC3)c1NC2=O)=O,0 F6789-0108,CC(C)c1nccc(N2CC(CO)(CCC3)C3C2)n1,2 8013-1790,OC(C(Cc1ccccc1)(C(C1C(N2Cc3ccccc3)=O)C2=O)NC1c(cc(cc1)Br)c1O)=O,2 Z979898860,Cc1cnc(CN(C=Nc2c3sc(-c4ccccc4)c2)C3=O)cn1,2 Z2390177458,Cc(cc1)ccc1-n1nnc(C(N2C3CNCCC2CC3)=O)c1,2 SC03-0680,C(COC1CCN(Cc2cc([nH]cc3)c3cc2)CC1)c1noc(C2CC2)n1,2 4106-0048,OC(Cn1c(cccc2)c2c2c1cccc2)CN(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Cl,2 S689-0380,O=C(CN(c(cccc1)c1O1)C1=O)N(C1)CC1N(CC(C1)C(N2CCCC2)=O)C1=O,2 F6561-7633,O=C(c1cc(cccc2)c2[nH]1)NC1CN(Cc2cscc2)CC1,2 F6359-3179,O=S(c(s1)ccc1Br)(N(CC1)CCC1Oc1nccnc1)=O,2 SD07-0974,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(c2ccc(C)s2)=O)C2)n2nn1)=O,0 D731-0396,Cc1c(-c(s2)nn3c2nnc3Cc2ccccc2)nnn1-c(cc1)ccc1Cl,2 F6548-3257,COC(c(cc1)cc(NC(N2CCCCCC(N(CC3)Cc4c3cccc4)=O)=O)c1C2=O)=O,2 SC04-0688,O=C(c(cc1)cc2c1[nH]cn2)N(CCC1)CC1OCCc1noc(C2CC2)n1,2 F6571-4213,CC(C)(C)C(NCC(c1cscc1)OCCO)=O,0 Z2946373378,Cn1ncc([C@H]2OCC[C@@H]2C(NOCc2ccccc2)=O)c1,2 F6788-9271,CN(C(CC1)CN1c(nc1)ncc1F)S(C1CC1)(=O)=O,2 Z1488343064,NC(C1(CCC1)NC(c1cc(-c(cc2)ccc2Cl)cnc1)=O)=O,0 Z3215989124,CCCCn1nc(C)c(C(N(CCC2)[C@@H]2c2n[nH]c(C)n2)=O)c1,2 F6783-6277,CCc1nnc(cc2)n1nc2N1CC(CN(Cc2c(C)nc(C)s2)C2)C2C1,2 Z1753998512,CCc1nnc([C@@H](C[C@H](C2)O)N2C(c2c(C)nc(CC(C)C)s2)=O)o1,0 SA87-1085,CN(c(ccc(S(NCC(CN1CCc2ccccc2)OCC1=O)(=O)=O)c1)c1O1)C1=O,2 G395-0629,CN(CC1)CCN1c(cc1)nn2c1nnc2CCC(N(CC1)CCN1c(cc1)ccc1F)=O,2 G397-1613,CCN(CC1)CCN1C(C(CC1)CCN1c1nnc(N(CCCC2)C2=O)s1)=O,2 Z1667523996,CCN(CCN(C1)C(c2cc(-n3nnnc3)ccc2)=O)C1=O,0 Z1212084072,Cc1c(C)oc(CN2CCC(CNC(c3cc(-n4ncnc4)ccc3)=O)CC2)n1,2 S613-0920,O=C(c1cccs1)N(CCC1)C1c1nc(CCOCC2CCCC2)no1,2 Z1276653253,CC(C)n1ncc(S(Nc2ccnn2C)(=O)=O)c1,2 Z2222285083,Cn(cc1-c2nc(CC3CCCC3)no2)nc1-c1cnccc1,2 Z4622705983,CC(C)c1c(C(N2CC(C3)(CC3NC(C3(C4)CC4C3)=O)CC2)=O)occ1,2 Z1981281875,Cc(onc1N)c1S(N(CC1)CCN1C(CN(C)C)=O)(=O)=O,0 Z1555371499,CC(c1cccc(F)c1F)NC(N(CC1)CCC1N(CCCN1)C1=O)=O,2 C713-0128,Fc(cc1)ccc1-c1nnc(cc2)n1nc2N(CC1)CCN1C(c1ccccc1)c1ccccc1,2 Z1872492201,Cc1cccn2c1nc(COc(cccc1)c1C(N(CCC1CO)CC1O)=O)c2,2 Z1508234938,CC(N(CC1)c2c1ccc(S(N[C@H](CC1)CC[C@@H]1O)(=O)=O)c2)=O,2 Z2965774802,O=C(C1(CC1)c1ncccc1)N(C[C@H]1CC2)C[C@@H]1S2(=O)=O,2 F6471-9308,Cn1c(S(C(C2)CN2C(CNC(OCc2ccccc2)=O)=O)(=O)=O)ncc1,2 F6194-0163,CC(Cc1ccco1)(CNC(c(cccc1)c1Br)=O)O,0 SA73-0160,Cc1cc(C(N(CC2)CCC2(CC2CC2)c2noc(C)n2)=O)c(C)n1CCCOC,2 F2795-0245,O=C(C(Nc(cc1)cc2c1OCO2)=O)NCCC1=CCCCC1,2 F6442-0180,Cc1c(CCC(N(C2)CC2S(c(cc2)ccc2F)(=O)=O)=O)scc1,2 Z87528693,Cc(ccc(NC(CC(c1c2cccc1)=NN(C)C2=O)=O)c1)c1Cl,0 Z1185271222,Cc1nn(C)c(OC)c1C(N1CCN(Cc(cc2)ccc2F)CCC1)=O,0 Z3299502884,CC(C1)CC1C(N(CCC1)CC1N(C)C(CCCS(C)(=O)=O)=O)=O,0 F6415-1150,O=C(Nc(cc1)cc2c1OCO2)N(Cc1cocc1)Cc1cccs1,2 Z1336796852,CN(CC1)CC(c2ccccc2)N1C(c(cc1)ccc1C(c1c[nH]cc1)=O)=O,2 S827-2544,COCc1noc([C@H](CC(C2)(F)F)N2C(c(cc2)ccc2C#N)=O)n1,0 F6553-0452,Cn(cc1C(N(CC2)CC2c2cscc2)=O)nc1OC,2 Z4144022353,CC(C)(CN(C1)C(c(c(C)c2)cc(C(O)=O)c2OC)=O)C1OC,0 S615-0224,O=S(Cc(cccc1)c1F)(N(CC1)CC1c1nc(CCOc(cc2)ccc2F)no1)=O,0 Z2911335719,CC(C1)(CN1C(c1c(NC)snc1C)=O)C(O)=O,2 Z1333340440,O=C(CN(CCCC1)C1=O)NCCc1nc(-c2ccncc2)cs1,2 F6548-4515,COCCNc1nc(SCC(Nc2cc(C(F)(F)F)ccc2)=O)nc2ccccc12,0 F5831-6930,CN(C)c1cccc(C(NCC2CCN(Cc3cccs3)CC2)=O)c1,0 F118-0041,O=C(CN1c(cc(cc2)C(N3CCCC3)=O)c2OCC1=O)NCc1ccco1,2 S593-0833,CCOCc1nc(C(CCC2)N2S(c2cn(C)cn2)(=O)=O)no1,2 F6658-5587,Cc1c(C)ncnc1OCC(CC1)CCN1c1nnc(C2CC2)s1,2 F6440-4415,CC(C)S(c1ccc(CC(NCc2nn(C3CCCC3)c(C3CC3)c2)=O)cc1)(=O)=O,0 8018-1583,O=C(C(NCCC1=CCCCC1)=O)c(n(cccc1)c1c1)c1-c1ccccc1,2 F5652-1135,CC(C)(C(Nc1ncccc1C)=O)N(C(C=C1)=O)N=C1c1ccccc1,2 Z115589496,Cc(n(C)nc1C)c1S(N[C@@H](Cc1ccccc1)C(O)=O)(=O)=O,0 Z3063545404,CCC1(CNC(c([nH]nc2)c2Cl)=O)CCC1,2 E146-1105,Cn1nc(C(Nc2nc(cccc3)c3s2)=O)c2c1-c(cccc1)c1OC2,2 Z2209895045,CC(C)(C1)C(c2cnccc2)N1C(c1cc(C(NC2CC2)=O)ccc1)=O,2 S582-0485,COCCN(C(CNC(c1ccco1)=O)Cn1c2ccc1)C2=O,2 Z1432066630,NS(C(CC1)CN1C(c1nn(C2CCCC2)cc1)=O)(=O)=O,2 F6436-2476,CC(C)(C)NC(N1CCC(CNC(c2cc(Br)cs2)=O)CC1)=O,0 Z1510404336,CC(C)(C1)OCCC1NC(NCc1c(C)c(cccc2)c2o1)=O,2 Z4767056044,CC(C)(C(Nc1n[nH]c2c1cccc2)=O)c1ccc(C(F)(F)F)cc1,0 F5597-0212,O=S(c(cccc1)c1F)(N(CC1)CCC1c1nnc(C2CC2)o1)=O,2 D699-0104,Cc1cc(C)nn1-c1nnc(c(cccc2)c2n2CC(Nc(cc3)cc4c3OCCO4)=O)c2n1,2 F6674-6476,CCN(C=C(C(N1CC)=O)N(CCC2)CC2NC(Nc2cc(OC)ccc2)=O)C1=O,2 Z1875146100,CC(C1)(CN1C(COc1cccc(C(NC)=O)c1)=O)O,0 S836-1272,COC[C@@H](CN(C1)c2nccnc2)[C@H]1C(NC1CCC1)=O,2 F5939-2550,CSc1ccc(CC(N(CC2)CCC2Oc2nc(c(F)cc(F)c3)c3s2)=O)cc1,2 Z1185437030,Cc1c(C2(CC2)C(N(C2)CC2n2ncnc2)=O)cccc1,0 L712-0188,Cc1nc2cccnc2n1CCN(CC1)CCN1C(Nc1c(C)c(C)ccc1)=O,0 F6435-1626,CC(C)CS(N(CC1)CCC1S(C)(=O)=O)(=O)=O,0 Z1268419457,CC[C@H](C(O)=O)NC(c(cc1)ccc1C#N)=O,0 F3318-0469,Cc(cc1)nn1S(c(cc1C)c(C)cc1OC)(=O)=O,0 G765-0238,O=C(NCCCN(CC1)CCN1c1cccc(Cl)c1)NC(C1)COc2c1cccc2,0 Z2966479934,Cn(nc1)nc1C(N(C(Cc1ccccc1)CC1)c2c1cccc2)=O,2 SB32-0127,Cc1n[nH]c([C@@H](C2)[C@@H](COC)CN2S(Cc(cc2)ccc2Cl)(=O)=O)n1,0 L077-0837,CSc1cccc(NC(N(CC2)CCC2c2nnc(C(Nc(cccc3)c3F)=O)s2)=O)c1,0 Z2371886757,CC(CC(N)=O)NC(C1)CC11CCCCC1,2 Z4136005442,CCC(CC#N)NC(C1=CC=C(c2cccc(Cl)c2)NC1=O)=O,2 F6494-0408,COc(cc1)cc(NC(c2ncnc(OC)c2)=O)c1OC,0 F6782-8091,CC(C)N1C(SCc(ccc(F)c2)c2F)=NC=C(C(OC)=O)C1=O,0 F5871-1948,Cc1noc(CNC(c(cc2)ccc2C(OC)=O)=O)n1,0 F6713-4907,Clc1c(N(CC2)CCN2c(cc2)nn3c2nnc3)nccc1,0 S350-0023,COc(cccc1)c1N(CC1)CCN1C(CN(C(CO1)=C(C(c(cc2)ccc2Cl)N2)C1=O)C2=O)=O,0 F6050-0131,CC(N=C1SC=C(CCNC(c2c(C(F)(F)F)cccc2)=O)N11)=CC1=O,0 F6479-4057,Cc1nc(C(N(CC2)CCC2Oc2nc(C)nc(C)c2)=O)cs1,2 Z1365737119,FC(CNc1nc(-c2cccs2)nc2ccccc12)F,2 C700-1764,CC(C)CNC(NCc1cccn1Cc1cccc(F)c1)=O,0 F1441-0519,O=S(c1cc(C(F)(F)F)ccc1)(N1CCN(Cc(cc2)cc3c2OCO3)CC1)=O,0 F6510-3302,CC(C)(C)OC(N(CCC1)C1C(Nc(c(F)c1)cc(N2C)c1N(C)S2(=O)=O)=O)=O,2 F3398-5060,Cc1cc(OCC(NCc(cccc2)c2Cl)=O)nc(N2CCCC2)n1,0 Z2276916650,O=C(c1c(CCCC2)c2ccc1)N(CCC1)CC1N(CCC1)S1(=O)=O,2 F6524-6236,CSc1cccc(C(N(CC2)CCN2C(CC2)CCS2(=O)=O)=O)c1,0 F6472-8869,CCOc(cccc1)c1NC(N(C1)CC1N(CC1)CCC1OC)=O,0 D294-1025,Cc1cc(N(CC(C2)c3nnc(NC(c4cc(OC)cc(OC)c4)=O)s3)C2=O)cc(C)c1,0 F5123-0134,O=C(Nc(cc(cc1)Cl)c1Cl)N(CC1)CCN1c(cc1)nn2c1nnc2,0 F6520-0530,O=C(c1ccno1)NCCc1ccc(-c2ccco2)s1,2 Z886961594,CC(C(NC(C)(C)C)=O)NC(c1cnccc1)=O,0 F6808-5799,Cc1nc2ccccc2nc1N(CC1)CCC1(c1ccccc1)C#N,0 Y032-4663,CN(C)C(N(CC1)CCC1C(Nc(cc1)ccc1S(N1CCCCC1)(=O)=O)=O)=O,0 S700-0864,CCn1ncc(S(N(C2)CC2c2nc(CCOCC3CC3)no2)(=O)=O)c1,2 F6515-0153,Cc1c(CCC(NCc2c(-c3cscc3)nccc2)=O)scc1,2 Z1615792291,CCc1c(C)ccc(NC(C(C=C2)=CN(CCOC)C2=O)=O)c1,0 V005-1298,O=C(C1CCCC1)Nc1c(C2CC2)[nH]nc1-c(cc1)ccc1Cl,2 Z1738666822,CCn1c(S(Nc(cc(CCC(O)=O)cc2)c2OC)(=O)=O)cnc1,0 Z2226023321,CCC(C1)(CN1C(CNC(c(c(F)ccc1)c1Cl)=O)=O)O,0 Z2290406345,Cc(cc1)cc(NC(N2CC3(COCC3)CCC2)=O)c1F,2 F6788-9506,CN(C(CC1)CN1c1nccn2nc(C3CC3)cc12)S(Cc1ccccc1)(=O)=O,2 Z642479034,CC(C)(C)n(c(C1CC1)c1)nc1C(NC(CC1)CCC1C(F)(F)F)=O,0 Z4921676945,Oc1cc(C(N(C2)C(CNC(c3cnccc3)=O)CC22CCOCC2)=O)cc2c1ccs2,2 F6521-7721,Cn(cc1)c2c1cc(C(CNC(NCc(cc1)ccc1Cl)=O)O)cc2,0 Z2792092707,Cc1cccc(NS(c(onc2C3CC3)c2Cl)(=O)=O)c1,0 M179-3007,O=C(CSc1ncnc(N(CC2)CCN2c(cccc2)c2F)c1)Nc(cc(cc1)F)c1Cl,0 Z295710268,CC(C)(C)c1ccc(Cn2nccc2NC(CN2N=C(CCCCC3)N3C2=O)=O)cc1,0 G786-0676,COc1cccc(N(Cc2nnc3n2CCCCC3)C(Nc(cccc2)c2Cl)=O)c1,0 Z4898405210,CC(c(cc1)ccc1NC(N)=O)NC(Nc(c1c2CCC1)nn2-c(cc1)ccc1F)=O,0 F5860-0365,COc1c(CCNC(Cn(cc2)c3c2cccc3)=O)cccc1,2 Z2997345336,COc1nscc1-c1noc(C(C2CCCCCCC2)O)n1,0 C255-0274,CCOc(ccc(CN(C(C)(CC1)C(NCCc(cc2)cc(OC)c2OC)=O)C1=O)c1)c1OC,0 F782-1306,O=C(c1n[nH]c-2c1CCc1c2cccc1)Nc(cc1)cc2c1sc(NC(c1ccccc1)=O)n2,2 F2609-1965,O=C(CCOc1ccccc1)N(CC1)CCN1c1nc(c(F)ccc2)c2s1,2 SA43-0872,Cc1c(C(N(C2)CC2(C2)CN(C)C2c2nc(-c3ccncc3)no2)=O)sc(C)n1,2 F6514-1989,CCOc(cccc1)c1NC(NCCN(C(C)=CC(OC)=C1)C1=O)=O,0 F3308-0238,Oc1ccc(CN(CC2)Cc3c2cccc3)c2cccnc12,2 4582-0084,Cc(cc1c(C)n2)c(C)cc1nc2SC(CC(N1c2cc(OC)ccc2)=O)C1=O,0 Z1863841736,CN(C=C(C(N(Cc1cccc(F)c1)C1CC1)=O)c1c2cccc1)C2=O,2 F5782-0406,Cn1c(cccc2)c2nc1C1CCC(CNC(COc(cc2)ccc2F)=O)CC1,2 Z1551070461,CC(C1)ON=C1NC(c1cncc(-c(cc2)cc3c2OCC3)c1)=O,2 S397-0239,COc(cc1)cc(OC)c1NC(c1nn(CC2CC2)c2c1COCC2)=O,2 Z3068704431,CCOC(c1cc2ccccc2nc1NC([C@H]1OCCC1)=O)=O,0 Z1724831823,Cc1cc(C)nn1-c(ccc(NC(C1(CCCC1)F)=O)c1)c1F,2 F6439-4964,O=C(NCCn1nc(C(F)(F)F)cc1)Nc(cc1)cc(Cl)c1Cl,0 Z2488969803,CC(C)C(C(NCC1(COC)CC1)=O)N,0 Z3077869656,Cc1c(C)nc(CNc(nc2)ncc2Br)[nH]1,0 F6143-0369,CCOC(C(CCC1)CN1c1nc(N2CCCC2)c2nn[nH]c2n1)=O,2 J007-0140,Cc1cc(C(CCC2)N2C(Nc(cc2)ccc2Cl)=O)no1,0 S932-1428,CCn(cc1)nc1C(N(CC1)CC1n1nnc(COC)c1)=O,0 SB98-0001,CN(C([C@@]1([C@H]2CNC1)C(N1CCOCC1)=O)=O)c1c2cccc1,2 Z1250579829,O=C(Cc1nocc1)N(CC1)CCN1c1ncccc1,0 D074-0167,COCCCN(C(c1c2[nH]nc1-c(cccc1)c1O)c(cc1OC)cc(Br)c1O)C2=O,0 F6656-3869,CC(C)(C)C(C=C1)=NN(C2CCN(CCc3ccccc3)CC2)C1=O,2 Z2467429468,OC(C(CC1CC1)CNC(c(cc1)cc2c1scc2)=O)=O,2 Z1170554232,OC(CN(CC1)CCN1C(c1csc(-c2ccccc2)n1)=O)c1ccccc1,2 Z1499169152,CC(C)C(c1nc(-c2nnc[nH]2)no1)NC(Nc(cccc1)c1Oc1ccccc1)=O,2 Z1454879586,CN(CCCC(O)=O)C(c(ccc(-c(ccc(OC)c1)c1F)c1)c1F)=O,0 E612-1183,CS(CCC(C(Nc(cc1)ccc1OC(F)(F)F)=O)N(Cc1c2cccc1)C2=O)(=O)=O,0 Z1143326713,CC(C1)N(Cc(occ2)c2C(Nc2ccncc2)=O)c2c1cccc2,2 Z2127040341,CCN(C(CCN1)C1=O)C(c(cc1)cc(N2)c1OC2=O)=O,2 E864-0054,O=C(Nc(cc1)cc2c1OCCO2)N(CCc1c2[nH]c3c1cccc3)C2c(cccc1)c1F,0 F6559-3439,CCn1ncc(-c2noc(CNC(C(C)Oc3ccccc3)=O)n2)c1,2 F6672-2389,Brc1cnc(N(C(CC2)C3)C2CC3=C2CC2)nc1,2 F6573-6222,O=C(c1cc(cccc2)c2o1)N(CC1)CCC1(C1)C1(F)F,0 G498-0025,O=S(c1cc(CCCC2)c2cc1)(Nc1cccc(N(CCC2)S2(=O)=O)c1)=O,0 F6436-1851,O=C(CCc(cccc1)c1Br)N(CCc1cccs1)Cc1ccco1,2 F6559-0460,O=C(c1cccs1)N(CCC1)CC1N(C=Nc1c2cccc1)C2=O,2 Z2762951275,CCO[C@H](C[C@H]1CN(C2)C(NC3CC3)=O)CN1c1c2cccn1,2 F6556-1926,Cn(cc1)c2c1cc(CCNC(C(Nc(cc1)cc3c1OCO3)=O)=O)cc2,2 Z1264064326,CC(CCCC1)N1C(C(CCC1)CN1C(c1ccncc1)=O)=O,2 Z2963415514,CC(C)CC(CN(C)CC1)N1C(c1coc(-c2ncccc2)n1)=O,2 F2090-1816,Fc(cc1)ccc1-n1ncc2c(N3CCOCC3)nc(NCc3ccco3)nc12,2 Z2645517295,Cc(nc1)nc(N)c1C(N(CCC1)C1c(cc1)cc(F)c1OC)=O,0 F6667-1293,O=C(C(C1)CC1(F)F)Nc(cccc1)c1Br,0 Z2524830338,CC(CN(C(C1(CCCC1)N1)=O)C1=O)(C(N1C(CC2)C(CN(Cc3ccccc3)C3)C3C2C1)=O)O,2 G663-1206,CC1Cc2cc(C(N(CC(N3c(cc(C)cc4)c4OCC3)=O)C=N3)=O)c3nc2CC1,2 F6363-0062,Cc1nc(-n2nccc2)cc(OCC(Nc(cc(cc2)F)c2F)=O)n1,0 D442-0077,CCC(C)(C1)OCCC1(CCNCc(cc1)ccc1N(C)C)c1ccc(C)cc1,0 Z1557221818,CCc1cccnc1C(N(CC1)CCC1(C(N1C)=O)NC1=O)=O,2 G346-0089,CC(C)CCNC(C1CCC(CN(C(c(scc2)c2N2Cc3cc(C)ccc3)=O)C2=O)CC1)=O,0 F5103-0390,O=C(CSCc1ccccc1)NCCc1cscc1,2 Z1432622836,CC(C)c(cc1)ccc1N(C)Cc(n1-c2c3scc2)nnc1N(C)C3=O,2 F1909-1879,Cc1cccc(N(CC2)CCN2C(CCCN2)C2=O)c1C,2 V023-5667,O=C(c1c(N2c3cccc(Cl)c3)ncn1Cc(cccc1)c1F)N(CCc1ccccc1)C2=O,0 Z3490363475,NC(c1ccc(CNc2c(cc[nH]3)c3nc(Cl)n2)cc1)=O,0 Z1659649943,Cn1nnc(CNC(C(C2)=NNC2=O)=O)c1,2 F6363-0183,COc(nc1)ncc1NC(CCc1ccccc1)=O,2 F5857-6551,COc1cccc2c1oc(C(NCC1(C=CCCC1)O)=O)c2,2 S632-1372,OC[C@@H](CNC1)[C@H]1C1CCN(Cc2cccc(F)c2)CC1,0 F5354-1648,CCOC(CNC(c1c(C)n(C2CCCC2)nc1C(F)(F)F)=O)=O,0 Z2966015396,CC(COCC1)(C2CC2)N1C(c1cc(-c2c(C)n(C)nc2C)n[nH]1)=O,2 Z1369209940,COc1cccc(C(NCCc2coc(-c3ccccc3)n2)=O)n1,0 Z3870375035,Cc1c(NCC2(CO)N(C)CCOC2)nc(-c2ncccc2)nc1Cl,2 D754-0207,O=C(c(cc(cc1)-n2cnnc2)c1Cl)NC[C@@H](CN(Cc1c2cccc1)C2=O)c1ccccc1,2 F6517-5132,OC(CNC(NCc(cc1)ccc1F)=O)c(cc1)ccc1-c1cscc1,2 SC39-0145,COCCNC(N(CC1)CC1(c1nc(C2CCOCC2)no1)F)=O,2 F6252-7783,Cc(c(NC(c1c(-c(cc2)ccc2F)nn[nH]1)=O)ccc1)c1Cl,0 Y040-1021,CC(C(c1ccccc1)=O)Oc(cc1)c(C)c(O2)c1C(c1ccccc1)=CC2=O,0 Z1548599622,CC(c1noc(-c(cc2)ccc2Cl)n1)NC(c1ncccc1O)=O,2 Z2976532249,C[C@@H](C1)[C@@H](CS(N)(=O)=O)CN1c(ncnc1)c1Cl,0 Z3370994796,Cn1nnc(C(CCC2)CN2C(c([nH]c(cc2)c3cc2Cl)c3Cl)=O)c1,2 SC76-0550,COCCN(Cc1cccs1)C(CN(C([C@]1(COc2ccccc2)[C@H]2C1)=O)c1c2cccc1)=O,2 F6791-8066,CN1N=C(C(CC2)CCN2c(sc2c(cc3)Cl)nc2c3OC)N(C2CC2)C1=O,2 F0624-0034,O=C(c(c(F)ccc1)c1Cl)OCN1N=Nc(cccc2)c2C1=O,0 F6349-0374,CC(C)(Cc1ccc2)Oc1c2OCC(N(CC1)CCN1C(c1c(cccc2)n2nc1)=O)=O,2 SC72-0360,Cc1cccc(OCC(N(C2)CC22OCc3c2cnc(C2CC2)n3)=O)c1,0 F0825-0043,Cc1noc(C)c1CSc1c(c(CCCC2)c2s2)c2ncn1,2 Z2904839422,CN(C(CC1)c2c1cccc2)C(CCCN(C(NN1)=O)C1=O)=O,2 SB57-1453,CCS(N(C1)CC(C2)(CN2S(N2CCOCC2)(=O)=O)C1c1nc(C)no1)(=O)=O,2 S700-0673,COc1ccc(C2(CC2)C(N(C2)CC2c2nc(CCOCC3CC3)no2)=O)cc1,2 F0018-0127,COc1c(-c2csc(N)n2)c2ccccc2cc1,2 S428-0446,O=C(C1(CC1)c1ccccc1)N(CC1)CC1c1nc(C2CCOCC2)no1,2 SB36-0552,O=C(C1CC1)N(C1)[C@H](Cn2nnc(C(N3CCCC3)=O)c2)CC1(F)F,2 F6443-6066,Cc1c(C(NCC(CCC2)N2c2nc(cccc3)c3o2)=O)n(cccc2)c2n1,2 F2902-0353,O=C(c1ccco1)NCCn1ncc2c(N(CC3)CCN3c3ncccn3)ncnc12,2 Z2454679695,Cc1c(C(N2CCCC2)=O)c(cc(cc2)OC)c2n1C,0 SA24-2128,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1c(C)occ1)=O,2 F5831-7068,O=C(NCC1CCN(Cc2cccs2)CC1)NCc1cccc2ccccc12,2 F6808-6087,N#CC1(CCN(CC(CC2)CCS2(=O)=O)CC1)c1ccccc1,2 Z1939482474,Cc1cnc(NC(C(C2CC2)OC)=O)s1,2 Z1332825883,CC(c(cc(cc1)F)c1N(CC1)CCC1O)NC(CC1=C(C)Nc2ccnn2C1=O)=O,2 Y041-4941,CC(C)CCNC(C(CC1)=NN(C(CC2)CS2(=O)=O)C1=O)=O,2 SD07-0700,CC(C)S(NCc1c(COC(CC2)(CN2C(COc2cc(C)ccc2)=O)C2)n2nn1)(=O)=O,0 F6573-8371,COc1cc(OC)c(CCC(N(CCN2c(nc3)ncc3F)CC2=O)=O)cc1,0 Z1498311546,CCC(C)OCC(N(CCCC1)CC1SCC)=O,0 Z1455347257,CN(CC1)CCC1C(N(CCC1)CC1Nc1ccccc1)=O,2 Z2008644556,C[C@@H](CN(CC1)c2nnc(-c(cc3)cnc3Cl)n2C)N1S(C)(=O)=O,2 D483-1481,CC(C=CN12)=CC2=NC(C)=C(Cc(n2C)nnc2SCC(Nc(cc(cc2)F)c2F)=O)C1=O,2 F5788-2511,CCOC(c(cc1)ccc1NC(CN(CCN1c(cc2)ccc2OC)C1=O)=O)=O,0 F6521-7372,Cn(cc1)c2c1cc(C(CNC(c(cccc1)c1Br)=O)O)cc2,0 Z648361168,Cc1c(C(N(C)Cc(o2)ccc2Br)=O)oc(CCC2)c1C2=O,2 Z3363305223,CC(C)N(C)CC(Nc1nscc1)=O,0 F6555-6380,CC1=C(C)N=CN(CC(N(C2)Cc3c2cccn3)=O)C1=O,2 Z1161553889,OC(CNCc1c[nH]nc1-c1ccccc1)(CCC1)c2c1cccc2,0 J005-1063,CCc1noc(C(CCC2)N2S(c(cc2)cc(Cl)c2OC)(=O)=O)c1,0 J031-1710,O=C(CSc1nnc(-c(cc2)cc3c2OCCCO3)n1C1CC1)N1CCOCC1,2 F6753-2665,O=C(C(CCC1)CN1c1cc(C(F)(F)F)ncc1)N1CCOCC1,0 F6529-0668,Cc(cc(cc1)F)c1S(N(CC1)CCC1N(c(cccc1)c1N1C)S1(=O)=O)(=O)=O,2 Z2969552765,Cc1cc(C)c(CNC(N2CC(c3ccnn3C)OCC2)=O)c(C)c1,2 SD01-0113,COCCn(c(CC1)c2CN1C(C1CC1)=O)nc2-c1cocn1,2 F6553-0557,O=C(c1csc(-c2ccccc2)n1)N(CC1)CC1c1cscc1,2 F5577-0010,CN(C=C(C(O)=O)C(c1c2)=O)c1cc(N1CCCCC1)c2F,2 Z2080044540,Cc1c(C(N2CC(Cc3ccccc3)N(C)CC2)=O)c(C(F)(F)F)n[nH]1,2 Z1030255956,Nc1cc(C(Nc2cn(CC3OCCC3)nc2)=O)cc(Cl)n1,2 Z364350224,OC(C1(CCCC1)NC(c1noc(-c2ccccc2)c1)=O)=O,0 D072-1600,O=S(c1c(NC2CC2)oc(-c(cc2)ccc2Cl)n1)(c(cc1)ccc1F)=O,2 Z3409654878,CC(C)c1nc(C(C)(C)C)cc(N2Cc3nnc(CCO)n3CC2)n1,0 D490-0339,CC(CCCC1)N1c(nc(nc1-c(cc2)ccc2Cl)SC)c1C#N,0 F1105-0063,CN(C(c1cccc(NC(C2CCCCC2)=O)c11)=O)C1=O,2 F400-0720,CC(CN(C=Nc1c2n(Cc3cc(C)ccc3)c3c1cc(C)cc3)C2=O)c1ccccc1,0 F5033-3332,Cc1csc(C(NCC(CC2)CCN2C(OC)=O)=O)c1,0 G243-0889,Cc1c(C(N2CCOCC2)=O)c(S(N(CC2)CCN2C2CCCCC2)(=O)=O)c(C)n1C,2 F6473-2042,O=C(c1cc(cccc2)c2o1)N(C1)CC1n1nncc1,2 Z1815805403,CCC(CC)(CCC1)CCN1C(Nc1cn(C)nc1)=O,0 Z466407876,O=C(c(cc1)cnc1Oc(cc1)ccc1Br)NCC1CCC1,2 V010-6289,COc1cccc(-c2n[nH]c(-c(cc3)ccc3C(N[C@H](CCC3)c4c3cccc4)=O)c2)c1,2 F2775-2239,CSc(cccc1)c1NC(CN(C(C=C1)=O)N=C1c1ccncc1)=O,0 Z2026355202,Cc1nsc(N=CN2Cc3ncccc3C)c1C2=O,0 Z3687118717,C[C@H]1N(C)[C@@](CNC(c(cc2)cc(CCN3)c2C3=O)=O)(CO)COC1,2 Z2779204695,CC(C)(C)CN(C)C(c1cccc(C(NCc2nc(C(F)F)no2)=O)c1)=O,0 F6515-1095,O=C(Cc1cccs1)NCc1cc(-c2ccco2)ncc1,2 Z1528851174,CC(CNC(NC(CC1)CCN1C(c1ccccc1)=O)=O)(c(cc1)ccc1F)O,0 F6561-7707,O=C(CN1N=CC=CC1=O)NC1CN(Cc2cscc2)CC1,2 Z988942660,N#Cc1cccc(CS(NC(c2ncc(C(F)(F)F)cc2)=O)(=O)=O)c1,0 F5854-3866,Cn1c(CN(C2CC2)C(C2(CCCC2)c2cccs2)=O)ccc1,2 T202-0011,COc(ccc(-c1nn(CCCN(C2)S(c(cccc3)c3Cl)(=O)=O)c2c1)c1)c1OC,0 T655-0646,O=C(Nc(cc(cc1)F)c1F)N(C1)CC2(CCOCC2)C1c1nnc(-c2ccncc2)o1,0 F6680-2528,O=C(C1(CCOCC1)c1ccccc1)N(CCN1c2cc(C(F)(F)F)ncc2)CC1=O,2 F5831-0809,Cc1cc(C(NCC(c2cccs2)S(c(cc2)ccc2Cl)(=O)=O)=O)c(C)o1,2 Z2452793508,Cc1cc(CCNC(c2c(C(CN)CCC3)n3nc2)=O)cc(C)c1O,2 Z1846688662,CCNS(C(CC1)CN1C(Nc1c(C(C)C)n(-c(cccc2)c2Cl)nc1)=O)(=O)=O,0 Z1347230602,CCNC(c(cccc1C)c1OC(C)C(N(CC1)CCN1C(C)=O)=O)=O,0 F6445-1391,O=C(C1(CCCC1)c(cc1)ccc1Cl)NC(CC1)CN1c1nccs1,2 F6676-2701,CC1=CN=C2SCC(CC(N(CC3)CCC3N(C)c3ncccc3)=O)N2C1=O,2 F5031-0227,Cc1c(C(/C(/O2)=C/c(cc3)cc(OC)c3OC)=O)c2c(CN(Cc2cnccc2)CO2)c2c1,2 C786-0285,O=C(CN(C(c1c2)=O)N=Cn1c1c2cccc1)N(CC1)CCN1C(c1ccco1)=O,0 7287-0205,Cc(cc1)ccc1S(Nc1cc(C(CC(c(cccc2)c2N2)(C2=O)O)=O)ccc1)(=O)=O,2 Z3091703796,CC(C)(CCC1)C1(CO)NC(CCn1ncc([N+]([O-])=O)c1)=O,0 Z2962533819,OC(CC1)(CCN1C(c1c(-c2ccccc2)[nH]nn1)=O)C1CCC1,2 Z3019157992,CC(C)c1ccc(C(C)NC([C@@]23OCC[C@@H]2CNC3)=O)cc1,2 SB52-0169,CC(C)c1nc(C(C2)N(C)CC2(CC2)CCN2S(C2CC2)(=O)=O)no1,2 Z4461556117,O=C(Nc1cc(Cl)cc(Cl)c1)N1C(CCC2)C2CCC1,2 C361-0998,Cc1cc(NS(c(cc2)cc(CC3)c2N3C(C2CCC2)=O)(=O)=O)cc(C)c1,0 Z2440525408,CNCC(CCC1)N1C(c1cc(sc(Nc2ccccc2)n2)c2s1)=O,0 F6724-5279,C(C(c1cscc1)n1nccc1)Nc1c2sccc2ncn1,2 Z2922712536,Cc1noc(C(N[C@@H](C2)[C@@H](C3)[C@@H]3[C@@H]2C(O)=O)=O)c1,2 F6543-0227,O=C(c1cc(Br)cnc1)N(CC1)CC1(F)F,0 F6751-4162,Cc1nsc(N(CCN2Cc3ccccc3)CC2=O)n1,0 Y031-5014,CCCN(CCC)S(c(cc1)ccc1N(CC(C1)C(Nc2cnccc2)=O)C1=O)(=O)=O,0 SB04-0614,CN(C)C(N(CC1)CC1N(CCN(C)C(Nc(cccc1)c1F)=O)C1CCOCC1)=O,0 F5517-0003,O=C(c1ccc(Cn2c(cccc3)c3nc2)o1)NCc1cnccc1,2 V029-0633,COCCn1c(S(Cc(cc2)ccc2F)(=O)=O)ncc1CN(C1CC1)C(C1CCCC1)=O,0 3238-0228,CN(c1c(C(N2C)=O)n(Cc(cccc3)c3Br)c(N3CCN(Cc4ccccc4)CC3)n1)C2=O,0 Z2188302513,CC(C)(C)C(N(CCC1)CC1C(Nc1nc(-c2cc(OC)cc(OC)c2)ccc1)=O)=O,2 Z1696868510,CC(C)(c1cn(-c(cc2)ccc2OC)nn1)O,0 J006-2865,CCc1c(C2N(Cc3c[nH]nc3-c3ccccc3)CCC2)c(C)no1,0 SA46-1433,CN(Cc1ccccc1)C1COC(C2)(CN2C(CCCc2nc(cccc3)c3s2)=O)C1,2 Z1238559823,COCC(CC1)CN1C(CCC(O)=O)=O,0 Z2879624267,CC(C)(Cc1nc(CCc(c(F)ccc2)c2Cl)no1)O,2 F5964-0101,OCC1(CNC(c2cccc3ccccc23)=O)CC1,0 SA41-0043,CCn1c(cccc2)c2c(CN(C2)CC22CN(C)C(CO)C2)c1,2 S985-0047,CN(C[C@H]1CN(C2)C(COc3ccccc3)=O)C[C@@]12C(N1CCCC1)=O,0 F6743-6372,Cc1c(ccc(N(CC2)CCC2N(C)S(C2CC2)(=O)=O)n2)c2nc(C)c1,2 F6481-3144,O=C(c(s1)ccc1Cl)N(CC1)CCSC1c(cc(cc1)F)c1F,0 Y501-3467,CCn1ncc(-c2csc(NC(Cn3nc(C(F)(F)F)c4c3CCC4)=O)n2)c1,0 Z1220021355,CS(Cc1nc(cccc2)c2n1CC(N(CCOC1)C1c1ccco1)=O)(=O)=O,0 Z2351297251,Cc1nn(C)cc1S(N[C@H](CCc1ccccc1)C(O)=O)(=O)=O,0 Z2378763037,O=C(Cc(cc1)ccc1-c1ccccc1)N(CC1)CC11NCCC1,2 F3406-9826,O=C(c(nc1)cn1-c1ncnc(N2CCCCC2)c1)Nc(cc1)ccc1F,2 Z3344492014,CC(C)(C)c1nnc(C(NCc2cnc3n2CCC3)=O)o1,2 F6549-7814,O=S(c(cc1)cc2c1OCCO2)(N(C(CC1)C2)C1CC2n1ncnc1)=O,2 F6745-8161,FC(C(CC1)CCN1c1ncnc2ccccc12)(F)F,0 F6724-3531,OC(CCNc(nc1)ncc1Cl)c1cscc1,0 F3386-3627,CCOc(ccc(Br)c1)c1S(Nc1c(C(C)C)cccc1)(=O)=O,0 Z511109746,COCCOc1cccc(CNC(c(ccc(Br)c2)c2F)=O)c1,0 Z3140494650,Cc1ccc(-c2nn(C)cc2C(NC(CC2)CCC2(C2)C2N)=O)o1,2 Z3686722593,CN(C(C(C(CC1)C2CC2)N1C(CCc1c[nH]cn1)=O)=NN1)C1=O,2 F3398-0448,O=C1N(C2CC2)C(SCc2nc(-c3ccc(C(F)(F)F)cc3)no2)=Nc2c1cc1OCOc1c2,2 Z1577137658,CC(CC(N1CCC(Cc2cnccc2)CC1)=O)n1nc(C)cc1C,2 Z3649459342,Cc1nccc(N2C3(CC3)[C@@H](CCC3)[C@@H]3C2)n1,2 G017-1154,CC(C)C(C(Nc1cc(SC)ccc1)=O)NS(c(cc1)cc(CCC2)c1NC2=O)(=O)=O,0 V021-7309,CN(C)c1c(CN(CC2)C(Nc3ccccc3)=O)c2nc(N(CC2)CCN2c(cccc2)c2F)n1,0 F6438-6429,CN(C(CCC1)C1F)C(c(o1)ccc1Br)=O,0 Z3596489221,C=C(C1)CC1NC(Nc1nc(C2CC2)ns1)=O,2 T955-1168,CNC(N(CCC1)CC1c1nc(CCOCC2CCOCC2)no1)=O,0 F6507-5864,Cn1c(C(CCNC(C2c(cccc3)c3Oc3c2cccc3)=O)O)ccc1,2 F6514-7383,CC(C)C(Cn1nccn1)NS(Cc1cc(F)ccc1)(=O)=O,2 Z2968897749,CC(c1cccc(N(CC2)CCN2C(Cc2c(C)cccc2)=O)n1)O,0 Z2626922957,Cc1c(CC(N(CC2)CC2N2CCCC2)=O)cncc1,2 SA63-1216,O=C(C1CC1)NCCC1CC(CC2)(CCN2C(C2CCOCC2)=O)OCC1,2 L228-0494,COc(cc1)cc(NS(c2ccc(-c3cnc(C4CC4)o3)s2)(=O)=O)c1OC,0 M014-0039,CN(c(cc(cc1)C(NC2CCCCCC2)=O)c1Oc1c2cccc1)C2=O,2 Z1232176718,CN(c(ccc(C(Nc1n[nH]c(C2CCCCCC2)c1)=O)c1)c1N1)C1=O,2 F6515-2899,O=C(Cc(c(F)ccc1)c1Cl)N(C(CC1)C2)C1CC2n1nccn1,0 G375-1853,O=C(CN(c(sc1c2CCC1)c2C(c(cc1)ccc1F)=NC1)C1=O)Nc(cc1)ccc1F,0 Z917207094,Cc1c(C(Nc(cc2)ccc2-c2nc(ccc(C)c3)c3s2)=O)nco1,0 Z430144388,CC(C)(C)c1nc(Cn2c(cccc3)c3nc2)no1,0 F6796-7740,CCn1c(ncnc2N3CCN(Cc4noc(C5CC5)c4)CC3)c2nc1,2 D245-0139,Cc1nc2nc(-c(cc3)ccc3Cl)nn2c(N(CC2)CCN2c(cc2)ccc2F)c1,0 Z1075018550,CC(c1c(C2(CCCC2)C2)cc3OCCOc3c1)N2C(Nc1cc(C(N)=O)c(C)cc1)=O,0 S591-0356,Cc1noc(C)c1S(N(C1)CC1N(CC1CC1)C1CCOCC1)(=O)=O,2 F6478-3692,CCc1ncnc(OC(CC2)CN2C(CN(c(cccc2)c2O2)C2=O)=O)c1F,2 S903-0770,CC(C)S(N(CC1)CCC1c1nnc(C2)n1CCN2C(Cc1cnccc1)=O)(=O)=O,2 F2795-0789,Cc(c(NC(C(NCc(cccc1)c1OC)=O)=O)ccc1)c1Cl,0 F6677-0702,CC(C)c1nccn1CC(C1)CN1C(Cc(c(F)ccc1)c1Cl)=O,0 Z1436548321,Oc1cccc(S(N(CC2)CCN2c2ncccc2)(=O)=O)c1,0 F6201-0325,Cc1cc(CNS(c(cccc2)c2Br)(=O)=O)c(C)o1,0 Z2185916905,CC(CC1)CCN1C(CNC(c1nn(C(C)(C)C)cn1)=O)c1ccccc1,2 F6619-5671,CC(C1)OC(C)CN1C(CN(CC1)CCN1c1nc(C)ccn1)=O,0 Z2911049730,CCn1nccc1C(NC(C(O)=O)c(cc1)cc(F)c1OC)=O,0 D580-0635,CCn1c(SCC(N2)=Nc(cccc3)c3C2=O)nnc1CN(c(cc1)ccc1F)S(C)(=O)=O,0 Z1836626443,CCCC(C(O)=O)NC(c(scc1C)c1Cl)=O,0 F5254-0166,O=C(CCc1csc(NC(c2ccccc2)=O)n1)N(CC1)CCN1c1ncccn1,2 F5854-0831,O=C(NCc1cccc2ccccc12)N(Cc1ccco1)Cc1ncccc1,2 T828-1749,CCN(CC)c1nc(CCC(C2)C(N(C)c3cc(C)c(C)cc3)=O)c2cn1,0 SB75-0270,Cc1noc([C@@](C[C@@H](C2)NC(c3nc4ccccc4cc3)=O)(C3)[C@@H]2CN3S(C)(=O)=O)n1,2 Z2959016528,O=C(c1cc2nccnc2c(Br)c1)NC(C1)CC1(F)F,2 F6752-3753,O=C(C(C1)OCCN1c1nccc2c1cco2)N(CC1)CCC1(F)F,2 V004-3336,CCCN(CCC#N)C(CN(CC(N1C)=C2C(c(cccc3)c3Cl)NC1=O)C2=O)=O,0 F6557-1428,CC(C)(C)OC(N(CCC1)C1C(N(CCC1c(cccc2)c2F)CCS1(=O)=O)=O)=O,2 F5001-1091,CC(CC1)N(C(Cc2noc(-c(cc3)cc(OC)c3OC)c2)=O)c(cc2)c1cc2F,2 F6734-0825,CC(N(CC1)c(cc2)c1cc2S(N1CC(CN(C2)c(cc3)ncc3Cl)C2C1)(=O)=O)=O,2 F6523-2724,Cc1c(C(NCc2nc(-c3cccn3C)no2)=O)c(-c(cccc2)c2Cl)no1,2 K788-6890,CC1N=C(c(cccc2)c2F)c(cc(cc2)Cl)c2N(CC(Nc2cc(SC)ccc2)=O)C1=O,0 Z2178192610,CC(C)C(CO)(CC1)CN1C(c(cc1)nnc1Oc1cccc(Cl)c1Cl)=O,0 S343-0238,O=C(CC(C1)c2noc(Cc(cc3)ccc3F)n2)N1c(cc1)cc(Cl)c1F,0 Z1583404144,CCc1nnc(cc2)n1nc2N(CCC1)CC1c1n[nH]c(C(N)=O)c1,2 Z1587219085,CNC(c1cccnc1N(CC1)CCC1c1ncc(-c(cc2)cc(F)c2F)[nH]1)=O,2 Z1278198225,CN(C)CCn(cc1)nc1NC(NCC1CCN(Cc2ccccc2)CC1)=O,0 F6681-8917,Cc1c(CN2CC(COc(nc3)ncc3Br)CCC2)sc(C)n1,2 Z2936883719,CC(C)C(c1nc(-c2cocn2)no1)NC(c1ccc(C)cc1)=O,2 F6089-9807,OC1(CNC(NCC2OCCC2)=O)CCOCC1,2 F627-0274,COc(cc1)cc(NC(N(CC2)CCN2c(cc2)ccc2-c2noc(C3CCC3)n2)=O)c1OC,0 F1540-0048,CCn1c(SC(F)F)nnc1COc1cccc2cccnc12,2 F5832-8527,O=C(CSCc1ccccc1)NCCc1csc(-c(cc2)ccc2F)n1,2 Z4444505201,O=C(C(C1)ON=C1C1CC1)NCC(CCC1)c2c1cccc2,2 F5319-0021,CCOC(N(CC1)CCN1C(C(C=C1)=NN(C)C1=O)=O)=O,0 Z1337736784,Fc1cc(C(CC2)N3CCOCC3)c2cc1,0 Z3056191676,CC(C(C)(C)CNC(COc(cc1)ccc1Oc1ncccc1)=O)O,0 F6436-0039,O=C(CCCC1)N1c(cc1)ccc1NS(CCOc1ccccc1)(=O)=O,2 Z1192890425,CN(C)c(c(C(N(CC1)CCS1=O)=O)c1)ncc1Br,2 F6743-7979,CC(C)(C)C(N(C)C(CCC1)CN1c1nc(C)cc(C)n1)=O,0 F3238-0147,O=S(N(CC1)CCN1c(cccc1)c1F)(N1CCOCC1)=O,0 F6571-0067,CN(C)C(CNC(c(s1)ccc1Cl)=O)c1csc2c1cccc2,2 F2792-0331,CCn1nnc2c1ncnc2NCCn(cc1)c2c1cccc2,2 F6473-4240,O=C(Cc(c(F)ccc1)c1Cl)N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O,0 Y020-4144,Cc(nc1nc2C=CN3Cc4cnccc4)nn1c(-c1cccc(Cl)c1)c2C3=O,2 F6125-2327,CSc(cccc1)c1NC(C(C1)CN1C(c(cc1)cc2c1OCO2)=O)=O,0 Z2053652475,COC(CC1)(CCN1c1ncnc2c1cc[nH]2)c1nc(C2CCOCC2)no1,2 Z4660501526,Cc1nn(C(CCN2C(c3cccn4nncc34)=O)C(F)(F)F)c2c1,2 S662-0248,O=S(c1cccs1)(N(CC1)CCC1(CC1)C1N1CCOCC1)=O,2 Z4990792284,Cc(ccc(O)c1)c1NC(Cn(cc1)c(cc2)c1cc2Br)=O,0 Z3990384364,Cc1nn(C)c(C(NCC(O)=O)=O)c1,0 Z1738024183,OC(c1ccc(CCNS(CC2OCCCC2)(=O)=O)cc1)=O,0 S613-0936,O=C(c1nccnc1)N(CCC1)C1c1nc(CCOCC2CCCC2)no1,2 Z3071577553,CC(NC1CN(Cc(c(Cl)nc2c3)cc2ccc3F)CC1)=O,2 SB33-0089,Cc1n[nH]c([C@@H](CN(C2)C3CCCCC3)[C@H]2NC(C2CCOCC2)=O)n1,2 F6677-6737,Cc(cc1)cc(C)c1S(N(C1)CC1(C1)C1(F)F)(=O)=O,0 Z2203734682,CC(C)(C)c1nn(C)cc1C(NC1(CCCC1)c1noc(C)n1)=O,2 Z4884574702,N[C@H](C(NS(c1cc(-n2nnnc2)ccc1)(=O)=O)=O)c1ccccc1,0 Z1190550346,CN(C)CCN(Cc1cccc(Cl)c1)C(C(CC1)CCN1c1nccnc1)=O,2 F6560-8413,Cn1ncc(-c2ncc(CNS(c3cccc4ccccc34)(=O)=O)cc2)c1,2 S988-1051,CCS(N(C[C@@H]1CN(C2)C(c3c(C)nc(C)s3)=O)C[C@@]12c1nc(C)no1)(=O)=O,2 F3293-0203,O=S(c1ccc(C2CCCCC2)cc1)(NCc1ncccc1)=O,2 E734-1898,Cc1cc(NC(CN2c(cc(cc3)S(NC4CCCC4)(=O)=O)c3OCC2=O)=O)cc(C)c1,0 Z1038092838,CCn1nc(C)c(C(NC(C)c2ncccc2)=O)c1C,0 Z785392466,CC(C)(C)NC(CN(CC1)CCC1C(c(cc1)ccc1Cl)=O)=O,0 Z1262055772,CC(CN(C1)C(Cc(cc2)ccc2C#N)=O)OC1c(cc1)ccc1F,0 Z1426873887,O=C(Cn1nnc(-c2ccccc2)c1)N1CC(CN2CCCCC2)CC1,2 CM3576-2828,Cc1ccc(CN2CC(Cn3nnc(COCC4CC4)c3)CC2)s1,0 V028-1926,CC(C)CNC(CCC(N(CCn1c2ccc1)C2c1cc(OC)ccc1)=O)=O,0 F6722-1864,Cn1c(CN(CC2)CCN2c2cccc(C(F)(F)F)c2)nnc1,0 J030-0910,Cc(cc1)cc(NC(c2c3)=O)c1Oc2cc(N1CCN(C)CC1)c3S(N1CCCC1)(=O)=O,0 Z3289068468,O=C(c1nc2ccccc2nc1)Nc(cc1)cc2c1nc(C(F)(F)F)o2,2 F5526-0102,O=C(c1ccccc1)c(cccc1)c1C(NCCOc1ccccc1)=O,2 S232-1671,CN1[C@@H](CN(CC2)S(c(cc(cc3)OC)c3OC)(=O)=O)[C@@H]2COCC1,2 F5528-2302,O=C(C(CC1)CCN1c(cc1)nnc1-c(cc1)ccc1F)NCCN1N=CC=CC1=O,2 Z1343761033,CN(CC1)CCC1N(CCC(N1)=O)C1=O,2 Z3759788398,CC(C)(C1)NCC1(c(cccc1)c1N1)OC1=O,0 S582-0010,Cn1nccc1C(NCC(Cn1c2ccc1)N(C)C2=O)=O,0 F5824-0283,O=C(C1CCN(Cc2nc(cccc3)c3[nH]2)CC1)NCc1ccco1,2 F6262-2613,O=S(c(cccc1)c1Cl)(Nc1ncnc(OCc2ccccc2)c1)=O,2 S699-1005,Cc1noc(C)c1CN(C1)CC1c1nc(CCN(C)C(C2CCOCC2)=O)no1,2 8018-6683,CC(C)(Cc1ccc2)Oc1c2OCC(c(cc1)cc(N2C)c1N(C)C2=O)=O,2 Z3243687885,COC(c1ccc(CCCN)cc1)=O,0 Z1455115899,CC(C)(C)c1c(C(NCCCC(O)=O)=O)scn1,0 C604-0243,O=C(CCN(C1=O)C(SCc2ncccc2)=Nc2c1sc1c2cccc1)NCC1OCCC1,2 F0696-0862,CN(C(C(C(N(CC1)CCN1c(cc1)cc(Cl)c1F)=O)=CN1)=O)C1=O,2 F891-1678,Cc(sc(-c1noc(C2CCC2)n1)c1)c1S(N(CC1)CCC1C(NC1CC1)=O)(=O)=O,2 F6442-2388,Cc1c(C(N(C2)CC2S(Cc2ccco2)(=O)=O)=O)sc(C)n1,2 Z1052745266,Cc1nc(S(N2C(Cc(cccc3)c3Cl)CCC2)(=O)=O)cn1C,0 Z4212843791,N[C@H](C[C@@H]([C@H]1O)C(N(CC2)CC2c(cccc2)c2Br)=O)[C@@H]1O,2 Z2951279789,COc(cc1)cc(CC2)c1N2C(c(cc1)cnc1OC(F)F)=O,0 Z2909779204,CC(C)N(C)C(C(C1)(C2)CC12C(O)=O)=O,0 Z2965121495,CN(C(CC1)Cc2c1cccc2)C(c1c(-c2ccco2)[nH]nc1)=O,2 F6259-1389,CN(C(C=C1)=O)N=C1N(CC1)CCC1C(N(CC1)CCN1S(C1CC1)(=O)=O)=O,2 F6608-4007,CC(N1CCN(CC#CCOC(CC2)CCN2c2nc(cccc3)c3s2)CC1)=O,2 F5324-0048,CN(CC1)CCN1c1nc(ccc(NC(COc(cc2)ccc2Cl)=O)c2)c2s1,2 Z1554266075,O=C(Cn1nnc(Cc(cccc2)c2Br)n1)NCC1CC1,2 SD07-0914,CCn1nccc1C(NCc1c(COC2(CN(Cc3cn(C(C)C)nc3)CC2)C2)n2nn1)=O,2 G811-0035,O=C(c(cc1)ccc1Br)N(CCc1c2[nH]c3c1cccc3)C2c1ccccc1,0 F6504-1348,Cc1c(CCNS(c2cc(CCCC3)c3cc2)(=O)=O)c(C)nn1-c1ncccc1,2 F6773-2835,N#Cc1cccc(N(CC2)CCC2Oc2nccs2)n1,0 Z1985969725,CC(C)(Cc1nc(cccc2)c2[nH]1)C(N1CCCC1)=O,0 F6438-6469,CN(C(COC1)C1F)C(c(s1)ccc1Cl)=O,0 T040-0448,O=C(CCc1cc(N2CCOCC2)ncc1)NCc1cnccc1,2 F3225-5949,O=C(Cc1ccccc1)NC(Oc1c2cccc1)=C(c(cc1)cc3c1OCO3)C2=O,2 F437-0204,Cn1c(cccc2)c2c(CN(CC2)CCN2C(Nc(cc(cc2)OC)c2OC)=O)c1,2 Y200-5015,Cc1cc(C(Nc(c2nonc22)ccc2N2CCOCC2)=O)c(C)o1,2 F6805-5241,Cc1cnc(N(C)C(CCC2)CN2c(nccc2)c2Br)nc1,0 F6619-7107,Cc1ccc(N2CCN(C/C=C/c3ccccc3)CC2)nn1,2 F6525-3115,Cn(c(CNS(c(cc1)cc2c1OCC2)(=O)=O)c1)nc1-c1cnccc1,2 Z1158074685,CC(Cc(cc1)ccc1F)C(Nc1cc(C2CC2)nn1-c1ncccn1)=O,2 F0537-0539,O=C(C1Oc(cccc2)c2OC1)Nc(cc(C(F)(F)F)cc1)c1Cl,0 F0682-0320,CCOC(C(C)Sc1ncnc2c1nnn2Cc(cc1)ccc1F)=O,2 Z2293550655,CC(C)C(C(C)(C)C1)N1C(Nc(cc1)ncc1S(NC)(=O)=O)=O,0 Y020-4057,Cc(nc(N1CCN(C)CC1)nc1)c1C(N=C(N1)N(CC2)CCN2c2ccccc2)=CC1=O,0 SA24-0258,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1cscc1)=O,2 F6559-1075,Cc(cccc1)c1OCC(N(CC1)CC1n1c(cccc2)c2nc1)=O,2 D715-2567,CC(C(O)=O)Oc(cc1)cc(O2)c1C=C(c(cc1)ccc1OC)C2=O,0 Z2105338151,O=C(c(cc1)cc(CCC2)c1NC2=O)NS(c(c(OC(F)(F)F)ccc1)c1F)(=O)=O,0 F6809-2474,Cc(cccc1)c1N1CCN(Cc(ccc(C#N)c2)c2F)CC1,0 E958-0678,COc(cccc1)c1NCc1cccn1-c1nnc(N2CCN(Cc3ccccc3)CC2)s1,0 Z2292863542,O=C(Nc1cc(Br)cnc1)N(C1)CC11CCOCC1,2 V007-4698,O=C(C1CC1)N(CCC1)CCN1c(ccc(NC(C1CCC1)=O)c1)c1C(N1CCCCC1)=O,2 SC11-1009,O=C(NCc(cc1)ccc1OC(F)(F)F)N(CCCN1CCOCC1)C1CNCCC1,2 F1607-0651,O=C1N(Cc2ccccc2)c2nnc(-c3cc(Br)cs3)n2-c2c1cccc2,2 F6764-1642,O=C(C1CC1)N(CC1)CCC1c(ccc1c2)nc1ncc2-c1ccncc1,2 F3406-6774,CCOc1c(CNC(c(cn2)cnc2OC)=O)cccc1,0 F6739-7752,Cc1c(C)ncnc1N(C)Cc(cc1)cc2c1OCCO2,0 Z2959968584,OC[C@H]1[C@H](C2)[C@@H]1CN2C(c1c2occc2cc(F)c1)=O,2 Z4188807652,O=C(NC1(CCC1)c1cc(C(F)(F)F)ccc1)Nc1nnc(C2CCOCC2)s1,0 Y021-1351,COc(cccc1)c1NC(N1)=NC(NC(C2C(N3c4ccccc4)=O)C3=O)=C2C1=O,2 F425-0167,COc(cc1)cc(OC)c1-c1noc(CSC(N(c(cc2)ccc2F)C2=O)=Nc3c2scc3)n1,0 S632-6243,CS(N(CC1)CCC1C(CC1)CN1C(c1n[nH]c(C2CC2)c1)=O)(=O)=O,2 Z1686417095,O=S(Cc1nc(-c(cccn2)c2OCC(F)F)no1)(C1CCCC1)=O,2 Z1559453551,CC(CCN(C1)C(CCN2c(scc3)c3C#N)C2=O)C1n1cncc1,2 Z1866126076,COCCN(CC1)CCC1NC(c(ncc(F)c1)c1F)=O,2 G118-0704,CC(C)C(c1cccn1-c1c(C2)cccc1)N2C(Nc(cc(C)cc1)c1OC)=O,0 F6726-4556,COc(cc1)ccc1-c(ncnc1N2CCN(Cc3csc(C4CC4)n3)CC2)c1F,2 F6178-2605,Cc(cc(cc1)OC)c1S(NCC(CC1)CCN1c1nc(cccc2)c2o1)(=O)=O,0 F6125-2208,CCOC(N(CC1)CCN1C(C(C1)CN1C(c(cc1)cc2c1OCO2)=O)=O)=O,2 F6799-8484,FC(c1nnc(C2)n1CCN2c(nc1)ncc1F)(F)F,2 Z2226660347,Cc1nocc1CN(CCC1)CC1c1n[nH]c(-c2ccccc2)n1,2 Z1670805546,CCC(C)(C)OCc(cccc1)c1NC(c1cnc2[nH]nnc2c1)=O,0 Z2784675966,COc(c(C(N[C@@H](CCC1)[C@H]1O)=O)c1)cc(Cl)c1Cl,0 Y207-0401,CC(CC1)Cc2c1c(C(N)=O)c(NC(CSc1nncn1C)=O)s2,2 Z2981801064,O=C1NC=CC=C1c1csc(C2CC3(CC3)C2)n1,2 Z2959143025,O=C(CC(CCC1)C1(F)F)Nc1nc(ccc(F)c2)c2[nH]1,2 F3375-1258,COc(ccc(Cl)c1)c1NC(c1cocc1)=O,0 F6594-2360,O=C(C=C1)N(CC2CCN(Cc(cc(cc3)F)c3F)CC2)N=C1n1nccc1,2 S421-0984,CN(Cc1ccccc1)C(CC(CC1)CN1C(CCCc1ccccc1)=O)=O,2 Y600-3563,NC(C1(CCN(CC(NC(C2)Cc3c2cccc3)=O)CC1)N1CCCCC1)=O,2 Z1875141135,CC(C)(C(N(C1)CC1(C)O)=O)c(cc1)cc(OC)c1OC,0 F6743-9864,CS(NC(CCC1)CN1c1ncc(cc(cc2)Br)c2n1)(=O)=O,2 Y200-4445,O=S(c(c1nonc11)ccc1N1CCCC1)(N1CCCC1)=O,2 Z3818173868,CC(C)COC(c(nc1)c2n1-c(cccc1)c1OC2)=O,0 F6529-1744,CN(C(CN1C(CC2)CCN2C(c(cc(s2)Cl)c2Cl)=O)=O)C1=O,0 F6554-9182,CCOC(CCNC(N(CC1C2)C2CS1(=O)=O)=O)=O,2 S986-0188,Cc1cn(Cc2cc(C(N3C[C@](CN(C)C)(CN(Cc4ccccc4)C4)[C@H]4C3)=O)no2)nc1,2 Y500-7463,CCCn(c1nc(-c2c(C)n(C)nc2)c2)nc(C)c1c2C(N(CC1)c2ccnn2C1C(F)(F)F)=O,2 Z2790353566,COc(ccc(C(O)=O)c1)c1S(N(C1)C[C@@H]2[C@H]1CC=CC2)(=O)=O,2 F6786-6206,CC(C)(C)c(cc1)nnc1OCC(CC1)CN1C(c1nc2ccccc2nc1)=O,2 Z1224475463,CC(CCC1)(C(O)=O)N1C(c1cnccc1)=O,0 F6178-6918,O=C(c1cocc1)N1CCC(CNC(NC2(CC(C3)C4)CC4CC3C2)=O)CC1,2 F0657-0200,CCC(C(Nc1c(C)ccc(-c2cn(cccn3)c3n2)c1)=O)c1ccccc1,2 Z1172269364,Cc1nc(-c2cnccc2)cc(N(C)CC2Oc(cccc3)c3OC2)n1,2 Z1653137034,O=S(c1cc(F)cc(Cl)c1)(N(CC1)CC1Oc1cc(F)ccc1)=O,0 S936-0128,Cc1noc(C)c1S(N1CCC(CCc2nc(C3CCOCC3)no2)CC1)(=O)=O,2 F6472-0609,Cc1c(C(NCCSC2CCOCC2)=O)c(-c(cccc2)c2Cl)no1,2 Z1217707458,Cc1ccc(CCNC(c2cc3nccnc3cc2)=O)cc1,0 F2616-0755,Cc1cccc(NC(C(NCCN2CCOCC2)=O)=O)c1C,0 F6787-0885,CCS(N1CC(COc(nc2)ncc2F)(CCC2)C2C1)(=O)=O,2 SA22-0546,O=C(C1CC1)N(C1)CC1N(CC(C1)(F)F)[C@@H]1C(NCc(cc1)ccc1Cl)=O,0 Z2164530161,COCc1ccc(CN(CCC2)C2c2cnccc2)o1,0 CM2348-6109,O=C(NCC(CN(Cc1cnccc1)C1)C11CCOCC1)N1CCCC1,2 Z825901508,CN(Cc1ccco1)C(C(CCC1)N1C(Cc1ccccc1)=O)=O,2 Z1952379321,Oc1cc(C(N(CC2)CC(C(N3)=O)N2C3=O)=O)c(C(F)(F)F)cc1,2 F6617-6627,O=C(c1cn(C(c2ccccc2)c2ccccc2)nn1)NC1CCOCC1,2 F5033-3623,O=C(CN(C(CC1)=O)C1=O)NCC(CC1)CCN1C(Oc1ccccc1)=O,2 Z5054602141,O=C(c1c(-c(cc2)ccc2F)ocn1)NCc1noc2c1COCC2,0 SB73-0587,O=C([C@H](C[C@@]1(CC2)CN2C(c2ccccc2)=O)NC1=O)NCc1ccco1,2 J023-0024,CSC(N1)=NC(NC(CC2C(Nc(cc(C(F)(F)F)cc3)c3Cl)=O)=O)=C2C1=O,0 Z3077777164,Cn1nccc1C(C1)(CN1c1nc(C2CCOCC2)ns1)OC,2 Z2352633986,CC(C(O)=O)c1cccc(NC(c2cc(C)c(C)s2)=O)c1,0 Z2522495870,COC1CCN(Cc2cc(CNCC3)c3s2)CC1,0 6466-0726,O=C(CSc1nc(C(F)(F)F)cc(-c2cccs2)n1)Nc(cc1)ccc1C(N1CCOCC1)=O,2 F5857-6503,CSc1ncccc1C(NCC1(C=CCCC1)O)=O,0 Y041-8351,O=C(CC1(CN(C=Nc2c3cccc2)C3=O)CCCCC1)NCc1ccco1,2 Z2709844565,Cc1cc(NC(N2CCC(CCOC)CC2)=O)nn1CCC#N,2 Z1560803563,Cc1cc(NC(c2ccc(C(F)(F)F)cc2)=O)nn1CC(NC)=O,0 S787-1058,O=C(CCc1ccc(CC(CC2)CCN2C(NCC2OCCC2)=O)cc1)NC1CC1,2 S948-5238,COC[C@](CN(C1)c(cc2)cc(C(F)(F)F)c2C#N)(CC2)[C@H]1CN2S(C)(=O)=O,0 F6679-2808,Brc(cncc1)c1OC(CC1)CN1c1ncnc2cnccc12,2 F6477-3386,O=C(c(o1)ccc1Br)NC(CC1)CCN1c1nc(-c2cnccc2)cs1,2 Z4905893866,C[C@@H](c1cccc(C(F)(F)F)c1F)Nc1nc(C)nc2c1cn[nH]2,0 F5854-1773,CSc(cccc1)c1C(N(CCc1cccs1)Cc1cnccc1)=O,0 C887-0562,CCC(n1c2cc3c1cco3)=NN(CC(NCCCN(CC1)CCN1c1c(C)ccc(C)c1)=O)C2=O,2 F6412-1591,COc(cccc1)c1OCC#CCNS(c1cccc2cccnc12)(=O)=O,2 F6481-4021,CC(C)n1cnc(S(N(CC2)CCSC2c2ccco2)(=O)=O)c1,2 Y020-9478,Cc1nc2nc(SC)nn2c(C=CN2c3nc(C(F)(F)F)n[nH]3)c1C2=O,2 F6515-0624,O=C(c1c(C(F)(F)F)cccc1)NCc1cc(-c2cccs2)ncc1,0 SB04-0527,CN(C)C(N(CC1)CC1N(CCNC(NCc1ccccc1)=O)C1CCOCC1)=O,0 Z1610025357,C[C@H](C1)O[C@@H](C)CN1C(c(s1)c(C)n2c1ncc2)=O,0 F6791-8881,Cc1noc(CN(CCC2)CC2c2nnc(-c(cccc3)c3F)s2)c1,2 F6514-3050,O=C(NCc(cc1)ccc1Cl)N(C1)CC1OCC(F)(F)F,0 Z1875076093,CC(C)c(n(-c1cc(C)ccc1)nc1)c1NC(N(C1)CC1S(N1CCOCC1)(=O)=O)=O,2 J098-1332,COc1ccc(CNC(C(CC2)Oc(ccc(Cl)c3)c3N2S(C)(=O)=O)=O)cc1,0 Z28853814,O=C(C(CCC1=O)=NN1c1ccccc1)NOCc1ccccc1,0 S579-0650,CN(CCNC(CC1=C(CCCC2)C2N(Cc2ccccc2)C1=O)=O)C1CCCCC1,0 Z3344041505,CN(C)c1cccc(Cn2nnc(CN(C=CC=C3)C3=O)c2)n1,2 F6478-1777,C=CCCC(N(CC1)CC1Oc(nc1)ncc1Br)=O,0 SC91-0811,Cc1cccc([C@@](C[C@H]2CC3)(CN2C3=O)C(NCCN(CC2)CCN2c2ccccc2)=O)c1,2 F6125-2889,CS(N(C1)CC1C(NCCOc1ccccc1)=O)(=O)=O,0 M410-0145,Cc(sc(-c1nnc(C)o1)c1)c1NC(C1(CC1)c(cc1)ccc1OC)=O,2 SB59-0618,CC(C)C(N(C1)CC1(CN(Cc1ccccc1)C1)C1c1nncn1C)=O,0 SA52-1174,CC(C)CN(CCCN(C1)C(CCn2ncc(C)c2)=O)C1c1nc(C)no1,2 E213-0633,CCC(C)NC(c1c(C)c(C(N(CCCC2)C2=N2)=O)c2s1)=O,2 Z2440216120,Cc(n(Cc1ccccc1)nc1)c1C(NCCC1CNCC1)=O,2 8016-6938,O=C(C(C1)n2ncnc2NC1=O)Nc(cc1)cc(Cl)c1F,0 F0568-0125,CCOC(C(C)(C)SC(N1)=Nc(n(-c(cc2)ccc2Cl)nc2)c2C1=O)=O,0 Z1024657604,COCc1ccc(CNC(CN2CCC(CCN3CCOCC3)CC2)=O)cc1,0 F6353-5650,O=C(c(cc1)cc2c1ncs2)NCC(c1cocc1)N1CCSCC1,2 Z1689197129,CCC(C1CCC(C)CC1)C(N(CC1)CCN1C(c1ccccc1)=O)=O,2 SA92-0503,Cc1noc(C(CCC2)(CN2C(c2cn(C)nc2)=O)F)n1,0 Z1514135944,Cc(cc12)ccc2ncnc1NCc1cccc(N(C)C)n1,0 SB36-1237,CNC(c1cn(C[C@H](CC(C2)(F)F)N2C(CCN(c(cccc2)c2O2)C2=O)=O)nn1)=O,0 P207-9145,Cc(c(C)c1)cc(C(C2)c(cc(cc3)Br)c3F)c1NC2=O,0 L839-1708,O=S(c1cc(-c2nnc(C3CC3)o2)cs1)(NCc(cc1)ccc1F)=O,2 S727-0598,O=S(c1cnccc1)(N(C1)CC1n1nnc(COc(cc2)ccc2F)c1)=O,2 F6089-9862,O=C(NC1CCOCC1)N(CCc1cccs1)Cc1cocc1,2 SD67-0585,O=C(CN1Cc(cc2)ccc2F)N(CCCN(C2)S(c(cc3)ccc3F)(=O)=O)C2C1=O,0 SB39-0426,CCS(N(CC1NC(Cc(cccc2)c2F)=O)CC2(CCCC2)NC1=O)(=O)=O,0 Z1798796883,CC(CC1)C(CO)N1C(NC(CCC1)CN1c1cc(OC)ccc1)=O,0 Z3597531347,OCC(C1)C2(COC2)CN1C(C1CC1)=O,2 Z2214343934,N#Cc1cscc1C(Nc1cc(Oc2ccnc3ccccc23)ccc1)=O,0 Z2881713502,CC(C)(C(N(CC1)CC1c1n[nH]c(O)c1)=O)NC(C(F)(F)F)=O,0 F6557-0897,O=C(Cc1cscc1)N(CCC1c2ccccc2)CCS1(=O)=O,2 Z1899678318,N#Cc(cc1)cc(F)c1N(CC1)CCN1C(C(CC1)CCN1C1CC1)=O,2 F6111-2203,N#Cc1ccc(COCC(CC2)CCN2C(NC(c2ccccc2)c2ccccc2)=O)cc1,2 Y502-1348,O=C(c1ccc(COc2cc(CCC3)c3cc2)o1)Nc1nn(Cc2ccccc2)cn1,0 F5857-0060,Cc1ccc(C(CNC(c2cccnc2SC)=O)O)o1,0 Z4655548400,O=C(c1cnc2sccn12)NCC(CC1)CN1c(cc1)cc(F)c1F,2 3333-4665,CC(C)c(ccc(C)c1)c1OCC(CN(CC1)CCN1c(cc1)ccc1F)O,0 SA49-1054,COc1cc(C(N(C2)CC22OCC(CC(NCC3CC3)=O)C2)=O)cc(OC)c1,0 Z166729332,Cc1cc(NC(NCCc(cccc2)c2F)=O)no1,0 Z1518797328,CC(C)C[C@@H](C(NC)=O)NC(CC(c(cc1)ccc1Cl)NC(C)=O)=O,0 SA67-0334,Cc1cn(CC(N2CC(CCc3noc(C)n3)CC2)=O)nc1,2 Z3334072535,COc(cc1)cc2c1[nH]c1c2CCCC1N,0 Z3085930031,CCc1cc(NC(c2cccc(Br)c2OC)=O)nn1C,0 Z1239673469,O=C(C1CC1)N(CC1)CCC1c([nH]c1ccc2)nc1c2F,0 F1757-0371,CC(Nc(cc1)ccc1OC(N1CCOCC1)=O)=O,2 F6789-0520,Cn(cn1)c2c1ncnc2N(C1)CC2(CO)C1CCCC2,2 Z425750188,[O-][N+](c(cc1)ccc1S(NCCO)(=O)=O)=O,0 F6353-7604,O=C(NCC(c1cscc1)N1CCC1)NC1(CC(C2)C3)CC3CC2C1,2 SC12-0972,CN1CCN(CCCN(C2CCOCC2)S(c2cccc3cccnc23)(=O)=O)CC1,2 C852-0473,CC(CC1)CCN1C(C(C1=O)=O)=C1NCc(cc1)ccc1C(NCc1ccccc1)=O,2 F5834-4832,CSc(cccc1)c1C(Nc1ccc(CC(NCc2cccs2)=O)cc1)=O,0 F2493-3165,O=C(C1(CCCC1)c1cccs1)NCc1noc(-c2cccs2)c1,2 F5490-1322,COc1cccnc1-c1cnc(NCC(F)F)nc1,0 F1009-0423,O=C(COc1ccccc1)Nc1nc(-c(cccc2)c2SC2)c2s1,2 Z3009206674,Cc1cccc(Cl)c1S(NCCc1conc1)(=O)=O,0 F6496-3800,O=C(c(cc1)cc2c1OCO2)N1CCC(CN(C(C=C2)=O)N=C2c(cc2)ccc2F)CC1,2 F352-1013,COc(cc1)cc(NC2(CC3)CCN3C(C3CCCCC3)=O)c1-n1c2ccc1,2 Z1518010873,Cc1nc(cccc2)c2n1CC(CCC1)N1C(c(cc1)ncc1C(N)=O)=O,0 F6441-5272,CN(C)S(N(C(CC1)C2)C1CC2S(c1ccccc1)(=O)=O)(=O)=O,0 Z1900693292,NC(C(CC1)(CN1c1ncnc2c1[nH]cn2)O)=O,0 Z1451250379,CC(C)(c(cc(cc1)C(Nc(cc2)ccc2-c2c[nH]cn2)=O)c1N1)C1=O,2 F6802-7668,N#Cc(cc1)ncc1N(CC1)CCC1C(N(CC1)CCC1(F)F)=O,0 S990-0426,Cc1noc(C(CCN(CC2)C(C3CCC3)=O)N2S(C)(=O)=O)n1,2 F6457-0595,CSc(cccc1)c1NS(Cc1noc2c1cccc2)(=O)=O,0 F6521-3747,CC(CNC(CN(c(cccc1)c1O1)C1=O)=O)(c1cc(cccc2)c2o1)O,2 Z4542800871,CCC(C)(C)NC(c(sc1cnc2)cc1c2Cl)=O,2 Y500-5429,Cc1cc(NC(c(cnn2c(C(F)(F)F)c3)c2nc3-c(cc2)ccc2Br)=O)no1,2 Z2377502724,NCCCCn1nnc(C(NCCCC2CCCC2)=O)c1,0 Z372086422,Cc1cc(C(NCc2nncn2C)=O)c(C)o1,0 F6676-1209,Cc1nccc(OCC(CC2)CCN2C(c2cc3nccnc3cc2)=O)c1,2 F6188-0983,O=C(c1noc(C2CC2)c1)NCC1(CCOCC1)Sc1ccccc1,2 F6524-4272,O=C(Cc1cccs1)N(CC1c2nocn2)CC1c1ccccc1,2 Z2078920834,COc1c(c(CC(Nc(c(F)c2)cc(F)c2N2CCOCC2)=O)c[nH]2)c2ccc1,2 Z1306957416,CC(CO)C(C)NC(NC(CCC1)CN1c(cccc1)c1Cl)=O,0 F6722-1824,FC(c1cc(N(CC2)CCN2c2ncnc3cnccc23)ccc1)(F)F,0 F5001-1888,O=C(Cc1noc(-c2cc(cccc3)c3o2)c1)NCCC1=CCCCC1,2 F6559-1987,O=C(c1c(C(F)(F)F)cccc1)NCc1nc(C2CCSCC2)no1,0 F2899-0104,O=C(C1=COCCO1)N(Cc1ccco1)c1nc(cccc2)c2s1,2 SA41-0854,CN1C(COCc2ccccc2)CC(C2)(CN2C(c2nccnc2)=O)C1,2 Z2643215917,O=C(c1cc(-c(cc2)ccc2Br)n[nH]1)NC1(C2)CC2C1,2 F2234-0207,CCCN(CC1)CCC1(C(N1CC(NCc2ccco2)=O)=O)NC1=O,2 Z2353292590,CCOc1c(CNC(NCCCC(O)=O)=O)cccn1,0 F2072-0071,CCOc(cc1)ccc1-n1nnnc1CNC(NC(C)(C)C)=O,0 F6727-4044,CC(C)Oc(cc1)ncc1C(N(CCC1)CCN1c(cc1)nn2c1nnc2C(F)(F)F)=O,0 Y043-8655,CN(C1(CCCCC1)C(N1CC(NCCc2c[nH]c(cc3)c2cc3Cl)=O)=O)C1=O,2 F6090-0268,CCOc(cc1)nnc1C(N(C(C)C1)c2c1cccc2)=O,2 V012-6023,CC(C)C(N(CC1)CCN1c(cc1)ncc1NC(c(ccc(F)c1)c1F)=O)=O,0 F184-1285,CN(CC1)CCN1C(C(CC1)CCN1S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O)=O,2 Z1168161163,Cc1cc(SCc2ccccc2)nc(-c2ncccc2)n1,2 Z3042255745,COCc1cccc(CNC([C@H](C2)N[C@@H]3[C@H]2OCC3)=O)c1,0 L302-0931,CC(C)C(N(CC1(C)C)c(cc2)c1cc2S(NC(CCC1)c2c1cccc2)(=O)=O)=O,2 F6747-5362,Cc1cn(CC(C2)CN2c2ncc(C(C)=CC(N3C4CCCC4)=O)c3n2)nc1,2 E223-0143,CC(Cn(c1c2)nc2-c2cccs2)(C(NC2CCCCC2)=O)N(c(ccc(F)c2)c2F)C1=O,2 SB36-1344,Cc1noc(C)c1Cc1ccc(C(N(C2)[C@H](Cn3nnc(C(NC)=O)c3)CC2(F)F)=O)o1,0 Z2997022969,CCC(C)Oc1nccc(-c2noc(C3(CCC4)CN4CCC3)n2)c1,2 SA71-0864,Cc1nc(C(CC2CC2)(CCC2)CN2S(c2cc(F)ccc2)(=O)=O)no1,2 Z1531968576,OC(c1ccc(CNS(Cc2nocc2)(=O)=O)cc1)=O,2 F6789-0766,CN(CCc1ccncc1)c1ncnc2c1CCCC2,2 Z2615083009,Cc1noc(NC(N(CC2)C[C@H](C3)[C@@]23O)=O)c1,2 SD67-0575,O=C(CN1Cc2ccccc2)N(CCCN(C2)C3CCCC3)C2C1=O,2 S974-2454,C[C@@H]1N(Cc2cc(C)nn2C)C[C@H](C[C@@H](C2)N(C)C)N2C1=O,2 Z2362468244,Cc1nn(C)c(CNCC(c(cccc2)c2F)O)c1,0 F5772-0800,CC(C)n(cc1)nc1C(NCc(cc1)ccc1OCc1ccccc1)=O,2 Z2957936872,Cc1cscc1NC(Cn1nc(C(F)(F)F)c2c1CCOC2)=O,2 F5141-0162,CNC(c1c(NC(C(CCCC2)N2S(C)(=O)=O)=O)scc1)=O,0 F6438-0812,O=C(c1ccco1)NCc1nc(N2CCOCC2)ccn1,2 V012-2470,CCC(C)c1nc(N(CC2)CCN2C(NC2CCCCC2)=O)c(c(CCC(C)C2)c2s2)c2n1,2 Z1530165636,Cc1ccc(cccc2S(N(C)CC(C3CC3)O)(=O)=O)c2n1,2 Z1421651222,O=C(CCN(C(C1(CCCC1)N1)=O)C1=O)N1c(cc(C(F)(F)F)cc2)c2OCC1,0 Z1738965331,OC(C(CC1C2CCCC1)N2S(Cc(cccc1)c1Cl)(=O)=O)=O,2 F5788-4403,COc(cc1)cc(N(CCN2CC(N(CC3)CCN3C(c3ccco3)=O)=O)C2=O)c1OC,2 Z961714394,Cc1n[nH]cc1CNC(C1(CC1)c1cc(C)cc(C)c1)=O,2 Z3595585973,Cn1nccc1[C@@H]1[C@@H](CNC(C(N=C(C2CC2)N2)=CC2=O)=O)C1,2 F6559-3643,COc1cc([nH]c(C(NCc2nc(C(CC3)CCC3(F)F)no2)=O)c2)c2cc1,2 Z1348785458,CC(c1ncc(C)s1)NC(c1c[nH]nn1)=O,0 SC60-1032,CC(C)(CN(C(C1)C(N2CCOC)=O)C2=O)CN1C(c1cc(OC)ccc1)=O,0 Z2181689101,O=C(C1COCCC1)NCC1CN(Cc2ccccc2)CCCC1,2 F6472-8711,COC(CC1)CCN1C(C1)CN1C(COc1cc2ccccc2cc1)=O,2 D432-0390,CC(C)N(C(C1CC(N2C)=Nc(cccc3)c3C2=O)=O)c(cc2)c1cc2Br,2 Z757354314,CC(N(CC1)C(CC(N(C)Cc2cc(O)ccc2)=O)c2c1cccc2)=O,0 Z3071608310,CO[C@@H](CCC1)[C@H]1NC(N(CC1)CC1N(CCC1)S1(=O)=O)=O,2 F5022-0048,O=C(c1ccco1)NCCN1CC(c2ccccc2)OCC1,2 T636-2369,O=C(c1nccc2ccccc12)N(CC1)CC1Nc1ncnc2c1CCC2,2 S988-1234,Cc1noc([C@@](CN(C2)C3CCOCC3)(C3)[C@@H]2CN3C(C2CCC2)=O)n1,2 Z2441152710,Cn1ncc(-c2nc(C(N(CCNC3)C3c(cccc3)c3OC)=O)cs2)c1,0 F6089-9147,CN(C(C=C1)=O)N=C1C(Nc1ccc(CC(NCC(F)(F)F)=O)cc1)=O,0 S997-1721,CC(N(C1)C[C@@](COC)(CC2)[C@H]1CN2C(NCCOC)=O)=O,0 Z740987934,CC(NC(NC1c2cc(OC3CCCC3)ccc2)=O)=C1C(Nc(cc(cc1)OC)c1OC)=O,2 C614-0546,O=C(c1c(C2Nc(cc3)cc4c3OCCO4)cccc1)N2c(cc1)ccc1Cl,2 Z1368588122,C[C@@H](c(ccc(F)c1)c1F)NC(c(cccc1)c1OC(F)F)=O,0 Z2209455795,CC(C)c1nc(C)c(C(NCC(c2ccccc2)N2CCC(C)CC2)=O)o1,2 S565-0605,CCn1c(-c2nn(C)c(CC3)c2CN3C(c2ccc(Cc3c(C)[nH]nc3C)o2)=O)nnc1,2 L503-0544,CC1(C)c(cc(cc2)S(Nc(cc3)cc4c3OCCO4)(=O)=O)c2N(CC(N2CCCC2)=O)C1,2 E867-1070,CCc1cccc(NC(Cc(cc2)ccc2NC(N2c3cccnc3SCC2)=O)=O)c1,2 P936-2511,CCn1ncc(S(N2CC(Cc3nncn3C)CC2)(=O)=O)c1,0 F6497-7375,O=C(c1cc(C(CC2)CCN2C(c(cccc2)c2F)=O)n[nH]1)NCc1ccco1,2 Z1560503758,CC(C)CC(N(CC1)CCC1NC(Nc1cc(C)ncc1)=O)=O,2 Z1270855856,CCn1nc(C)c(S(N2CC(c3ccccc3)OCC2)(=O)=O)c1C,0 Y050-0084,CN(CC(NCC1OCCC1)=O)S(c(cc1)cc(Cl)c1OC)(=O)=O,0 S698-0370,Cc1cnc(C2CCOCC2)n1C(CC1)CCN1C(c(cc1)cc2c1[nH]cc2)=O,2 SC77-1067,CS(N(C[C@H]1C(NCCOCc2ccccc2)=O)C[C@@]11OCCNC1=O)(=O)=O,2 Y042-5450,CC(C)CC(C(N(CC1)Cc2c1[nH]c1c2cccc1)=O)N(Cc1c2cccc1)C2=O,2 F6516-1761,O=C(Cc1cscc1)NCc1ccc(-c2cocc2)o1,2 Z2020158750,CC1(CCC1)C(NS(c1cnc2n1CCC2)(=O)=O)=O,2 SB03-0214,O=C(C1CC1)N(CCC1)CC1N(CCNC(c1nc2ccccc2cc1)=O)C1CCOCC1,2 F6816-2784,N#Cc(cc1)nnc1NC(c1ccccc1)c1ccccc1,2 F2593-0711,COc1cccc(NC(N(C2=NCCC2)c2cccc(F)c2)=O)c1,0 F5096-0044,Cn1c(N2CCN(CC(Nc(cc3)ccc3C(OC)=O)=O)CC2)ncc1,0 Z852068030,Cc(cc1)cc(C(N2CC(CCC(O)=O)CCC2)=O)c1O,0 Z1449826552,CC(c(cccc1)c1OCC1)N1c1nc(-c2cnccc2)nc2c1CCC2,2 S357-0910,CSc(cc1)ccc1NC(C(CC1)CCN1C(c1c(COC(C2)c(cc3)ccc3F)n2cn1)=O)=O,0 C255-0868,CCOc(ccc(CCN(C(C)(CC1)C(NCCC(C)C)=O)C1=O)c1)c1OCC,0 F052-0818,COc(c(Nc(ccc1c2)nc1ccc2S(N1CCCC1)(=O)=O)c1)cc(OC)c1Cl,2 Z3302370182,CCC(C)C(N1)=NC(CC2CC2)=CC1=O,2 F0911-1657,O=C(CSc1ncccc1)c(cc1)cc2c1OCO2,2 Z423418976,Cn1c(C(c(cc2)ccc2OC)NC(CC2OCCC2)=O)ncc1,2 S812-3230,CC(C)C(c1nccn1CCC1)N1C(c(cc1)ccc1C#N)=O,2 F6752-2450,CC(C)(C)C(NC1CCN(Cc(cc2)ccc2OC(F)(F)F)CC1)=O,0 S039-3969,CCn1c(cccc2)c2c(CN(CC2)CCC(N=C(N3)N4CCN(C)CC4)=C2C3=O)c1C,0 K784-6025,Cc1c(CN2c(cc(cc3)C(NC4CCCC4)=O)c3SCC2=O)cccc1,2 F548-2243,O=C(c(cc1)nnc1NCCN(CC1)CCN1c(cccc1)c1F)N(CC1)c2c1cccc2,2 F3406-7201,CC1=C(C)N=CN(CC(Nc(cc2)cc(Cl)c2Cl)=O)C1=O,0 F6471-0740,O=C(Cc(c(F)ccc1)c1Cl)N(C1)CC1n1nnc(-c2ccccc2)c1,0 Z3357786718,CC1(C)OC(CS(NC(C2CC3(CCC3)C2)=O)(=O)=O)COC1,2 F6789-0379,OCC1(CN(C2)c3nccc(C(F)(F)F)n3)C2CCCC1,0 SB91-0052,O=C(c1nccc2ccccc12)N(CCN1CCOCC1)C1CNCC1,2 Z1908847722,CCCc1n[nH]c(C(NCC(c2cc(Cl)cc(F)c2)O)=O)c1,0 V002-8284,CC(C)CNC(C(C)N(c(cccc1)c1C(N1c2cccc(Cl)c2)=O)C1=O)=O,0 Z822271784,Cc1c(C)nc(cc(cc2)C(N(CC3)CCN3C(c(cc3)cc4c3[nH]cn4)=O)=O)c2n1,2 Z2353336904,CC(C)C(Cc(cccc1)c1OC)NC(N(CC1)CC1(C)C(O)=O)=O,0 Z1677738990,CCc1nc(CN(CC2)CCN2C(Nc(ccnc2)c2F)=O)cs1,2 Z729001422,O=C(c1cnns1)NCC1(CCCCC1)N1CCCCC1,2 G786-1822,Cc(cccc1)c1-c1nc(N(C)C(N(C)C2=O)=O)c2c(SCC(NCC2OCCC2)=O)n1,2 F6175-0778,Cc1nc(-c2cc(NC(C(CCC3)CN3c3ncnc(-n4nccc4)c3)=O)ccc2)cs1,2 F6608-0840,N#Cc(cn1)cc(Cl)c1OCC(C1)CC1(F)F,2 F6494-1414,O=C(c1ncnc(OCc2ccccc2)c1)Nc(cc1)ccc1OC(F)(F)F,0 SC02-0533,COCCC(CC1)(CN1C(COc1ccccc1)=O)NC(C1CCOCC1)=O,0 Z1742692774,Cc1nc(C(F)(F)F)nc(C(Nc2cc(CN(CCC3)C3=O)ccc2)=O)c1,2 F6796-4085,CC(C)(C)c(nc1cc2)cn1nc2N1CCN(Cc2nnc(C)o2)CCC1,2 F1478-0299,CN(C)S(c(cc1)ccc1Oc(cc1)ccc1S(N(C)C)(=O)=O)(=O)=O,0 Z3709602599,COc(cc1)ccc1-c1cc(Nc2cn(CC3OCCC3)nc2)ncn1,2 F6480-4443,COc(ccc(NC(N(CCC1)CC1Oc(nc1)ncc1Br)=O)c1)c1OC,0 Z666184550,CCOC(c1c(NC(CN(C(CN2c3ccccc3)=O)C2=O)=O)sc(C(N(C)C)=O)c1C)=O,2 Z57839516,Cc1cc(NS(c(cc2)cc(C)c2OC)(=O)=O)cc(C)c1,0 Z2466360812,COc(cc1)ccc1N(CCNC1)C1=O,0 F6284-0504,O=C(CSc(cc1)ccc1F)NCCc1cnc(-c2ccccc2)nc1,2 F3406-4911,Cc(cc1C)cc2c1N(C)C(CCN(C1)C(Nc(cc3)cc(OC)c3OC)=O)=C1C2=O,2 F6514-6738,O=C(C(CCC1)N1c1nc(cccc2)c2o1)NC(Cn1nccn1)c1ccccc1,2 Z2457038029,O=C([C@@H](CCC1)NC1=O)N(CC1)CCN1c(c(F)ccc1)c1F,0 Z2091580754,Oc(cccc1)c1C(N(CC1)CC11CN(Cc2ccccc2)CC1)=O,0 F6442-2047,CC(C)CS(C(C1)CN1S(c(s1)ccc1Br)(=O)=O)(=O)=O,0 Z2118468231,Nc(nc(C1CC1)nc1)c1C(N1CC(Cc(cc2)cc(F)c2F)C1)=O,2 Z2801667579,CCc1nn(C)c(C(N(CCOc2c3F)c2ccc3F)=O)c1,2 Z2936916979,COC(NC1c(cccc2)c2OC2(CCNCC2)C1)=O,0 SB91-0954,O=C(CCc1nc(cccc2)c2s1)N(CCN1CCCCC1)C1CNCC1,2 F6730-0131,O=C(c1ncnc(C2CC2)c1)N(CC1)CCN1c1ncc(C(F)(F)F)cc1,2 G291-0154,COc(cc1)ccc1N1CCN(CCNc(ncnc2N3CCOCC3)c2C#N)CC1,2 Z1430608013,O=C(c(cc1)ccc1S(Nc1nccs1)(=O)=O)N(CC1CCC1)Cc1ccccc1,2 Z2295936750,CC(C)n(cc1)nc1C(N(Cc1ccccc1)C(C)C(O)=O)=O,0 Z2884805702,CC(C)CCCN(Cc1ccc(C)o1)C(C(CC1)CCC1(C(N1)=O)NC1=O)=O,2 J006-1999,Cc1noc(C)c1C1N(Cc2cc(OC)cc(OC)c2)CCC1,0 V015-8755,O=C(Nc1cc(N(CCCN2Cc3cc(F)ccc3)C2=O)ccc1)Nc1cccc(Cl)c1,0 Z1765713286,CC(C)(C)C(CCC1)CCC1NC(N(CC1)CC1c1nccn1C)=O,2 Z4452150710,Cc(c1c2sc(C(Nc3cc(C(NC(N)=O)=O)ccc3)=O)c1)nn2-c(cc1)ccc1Cl,0 Z1998350031,CC(CCC1)CN1C(NC(C1)CN1S(c(cc1)ccc1OC)(=O)=O)=O,2 F6257-3362,Cc(cc(cc1)OCC(Nc2ncnc(N(CC3)CCN3c3ccccc3)c2)=O)c1Cl,0 Z2951241510,CN(C)C(c1cc(CN(CC2)CC2n2nnc(C3CC3)c2)ccc1)=O,0 Z1277671741,Cn1c(-c2cccc(NC(NCC(CCC3)CC3O)=O)c2)ncc1,2 F6506-1728,OC(CNC(c(c(F)ccc1)c1Cl)=O)(c1cocc1)c1cccs1,0 Z4932303734,O[C@@H](CN(C1)c2ncnc3ccccc23)[C@H]1Oc1ccccc1,2 F5239-0030,O=C(c(cc1)ccc1F)N(CC1)CCN1c(cc1)nnc1Nc1ccncc1,2 F387-0073,CC(N1Cc2noc(C3CCCCC3)n2)=Nc(cccc2)c2C1=O,2 F6807-7240,COc(cccc1)c1N(CC1)CCN1c1nc(cccc2)c2[nH]1,0 F6090-0451,CCOc(cc1)nnc1C(N(CC1)CCN1S(C)(=O)=O)=O,2 Y041-7887,N1(C(N[C@H](C1=O)CC(NCc1occc1)=O)=O)CCc1c[nH]c2c1cccc2,2 Z1470841436,Cc1nc(-c(cc2)ccc2NC(CCC2CNCC2)=O)cs1,2 F6673-9292,CN(C(CC1)CCN1c1nncs1)c(nc1)ncc1Cl,2 S827-0231,Cc1cc(C(N(CC(C2)(F)F)[C@@H]2c2nc(COC)no2)=O)c(C)o1,2 F0013-1110,CCOC(N(C1)C(c2ccccc2)c(cc(cc2)Br)c2NC1=O)=O,0 Z2175309592,COc1cc(C2(CC2)CN(C2)C(CNC(c(cccc3)c3OC)=O)=O)c2cc1,2 Z2351793021,OC(c1cc(S(NCCC(C2)CC2(F)F)(=O)=O)c[nH]1)=O,2 Z1835888429,CC(C(NCC1)=O)N1c1c(ccs2)c2nc(Cl)n1,0 Z1171487820,CC(C)N(C(C)C)S(c(cc1)ccc1Br)(=O)=O,0 F6748-9531,Cc1cccc(OCC(CCC2)CN2c(nc2)ncc2Br)n1,0 Z2715718097,Cc1ccnn1CC(NCC1C2(CCC2)CN(Cc2ccccc2)C1)=O,2 Z2827922582,Cc1c(CNc2ncc(C)cn2)[nH]nc1C,0 F6656-2179,N#Cc1ccc(CN2CCC(COc3nnc(CCC4)c4c3)CC2)cc1,2 Z3292490691,O=C(CCn1c2ncccc2cc1)NC1CCCC1,2 F6562-5282,Cn(c(C(NCCN(C=CC=N1)C1=O)=O)c1)nc1-c(cc1)ccc1F,2 Z3071584881,NS(c1nccc(N(CCC2)CC2c2ccccc2)c1)(=O)=O,2 F6547-0021,Cc1noc(C)c1CN1Cc2cc(C3CC3)nn2CC1,2 Z1562902418,COc1ccc(CN(CC2)CCC2NC(C2CC2)=O)c2ccccc12,2 F216-0008,Cn(cc1C(NCC2OCCC2)=O)c(C(N2c3ccccc3)=O)c1NC2=O,2 D754-0193,O=C(CCN(C=Nc1c2cccc1)C2=O)NC[C@@H](CN(Cc1c2cccc1)C2=O)c1ccccc1,2 SA50-0577,Cn(c(C1)c2CN1C(c(cc(cc1)F)c1F)=O)nc2-c1nc(COC)no1,2 Z1144846645,O=C(Cc1ccccc1)N1CC(c(c(Cl)c2)cc(F)c2Cl)OCC1,0 F3083-0243,O=C(N(CC1)CCN1S(N1CCOCC1)(=O)=O)N1CCCCCC1,2 S892-0551,CC(C)CCNC(N(CCCC1)C1c1nn(Cc2ccccc2)c2c1COCC2)=O,0 3158-0626,CCOc(cc1)ccc1-n1nc(cc(cc2)NC(c(cc3)cc4c3OCCO4)=O)c2n1,0 F3250-0600,CCOC(C(C(n1nc2C)=O)=CNc1c2-c1ccccc1)=O,2 F6439-5190,O=C(C1CC=CCC1)NCCn(cc1)nc1-c1cccs1,2 F3222-2725,O=S(c(cc1)ccc1Cl)(N(CC1)CCC1c1nc(-c2cc(C(F)(F)F)ccc2)no1)=O,0 Z1176762952,Fc1c(CC2CCN(Cc3ncccc3)CC2)cccc1,0 Y020-0476,O=C(CC(C1=O)N(CC2)Cc3c2cccc3)N1c(cc1)ccc1Cl,0 Z1459900399,CN(CC(O)=O)Cc(cccc1)c1Cl,0 F6727-3727,COc1c(CC(N(CCC2)CCN2c2nn3c(-c4ccncc4)nnc3cc2)=O)cccc1,2 F5857-0169,Cc1ccc(C(CNS(c(cccc2)c2F)(=O)=O)O)o1,0 F3407-1693,Cc1nn2c(SCc(cccc3)c3Cl)nc(cc(c(OC)c3)OC)c3c2n1,2 F6186-0388,CCOc(cc1)ccc1NC(C(NCC(C)(CSC)O)=O)=O,0 F6573-1645,CC(C)Sc1ccc(CC(NCc2nccnc2-c2cn(C)nc2)=O)cc1,2 Z2444893865,CC(C)(C)c(cc1)ccc1OCC(CN[C@H](CCCC1)[C@@H]1O)O,0 F2496-2325,O=C(CSc1ncccn1)OCc1noc(-c2ccccc2)c1,2 F6553-6984,O=C(c1ccno1)N(CC1)Cc2c1sc(Cl)c2,2 Z4605071658,COc(ccc(F)c1)c1C(NC(C1)C2(CCC2)CCN1C(CC(CCN1)C1=O)=O)=O,2 E540-0178,CCOC(CC1NCCc(cc2OCC)c1cc2OCC)=O,0 F6415-0386,COCCN(Cc1cocc1)C(Nc(cc1)cc(Cl)c1Cl)=O,0 Z1278693538,OCCn1ncc(NS(c(ccc(C(O)=O)c2)c2F)(=O)=O)c1,0 F1143-4499,CCOC(c1c(N)scc1-c1ccc(C)o1)=O,0 F6444-0760,O=C(c1nn(-c2ccccc2)nc1)N(CC1)CCC1N1C(COCc2ccccc2)CCC1,2 F2518-0401,Cc1cc(-c2nnc(NC(C3Oc(cccc4)c4OC3)=O)o2)c(C)cc1,2 Z366876380,NC(c(cc(cc1)NC([C@H](Cc2ccccc2)NS(c(cccc2)c2F)(=O)=O)=O)c1F)=O,0 F3162-0031,Cc1c(C(Cn2c(C(N(C)C(N3C)=O)=O)c3nc2)=O)c(cccc2)c2n1C,2 F6560-2894,Cc1cc(C(NCc2cn(-c3cccs3)nn2)=O)c(C)o1,2 Z2848238277,Cc1coc(C(NC2CC(CC(O)=O)C2)=O)c1,0 Z1552843157,CC(N(CC1)C2(CCCCC2)CN1C(c1c(C)nccc1)=O)=O,2 SB95-1299,Cc1c(CN(CCC2)CC2N(CCN2CCOCC2)S(C)(=O)=O)scn1,2 F6215-0059,Cc1noc(CCNC(c2cc(Br)cnc2)=O)c1,0 S614-1154,O=C(NC1CCCCC1)N(CCCC1)C1c1nc(CCOCC2CCOCC2)no1,2 F2696-0708,COc(cccc1)c1N(C=CN=C1SCC(Nc(cc2)ccc2Br)=O)C1=O,0 Z1643862640,Cc(ccc(C(N(C)C)=O)c1)c1NC(c(cc(c(N1)c2)OCC1=O)c2Br)=O,0 F5854-0946,O=C(c(ccc(Cl)c1)c1Cl)N(Cc1cscc1)Cc1ncccc1,0 Z2628790780,OCC1(CCN(Cc2cc(CCCC3)c3cc2)CC1)O,2 Z2347134670,CNC(NC(CC1)CCN1C(NCc(cccc1)c1OCC(F)(F)F)=O)=O,0 Z3063545548,CC1CN(CCNC(C(N(C)C=C2OC)=CC2=O)=O)CCC1,2 Z1602276288,CC(C1)OCCC1C(N(CC1)CCN1c1nc2ccccc2cc1)=O,0 F6658-5789,Cn1ncc(S(N2CCC(COc3ncnc(C4CC4)c3)CC2)(=O)=O)c1,2 E017-1782,CC1CN(CCCNC(CN(C)c2nnc(N(CCC3)C3=O)s2)=O)CC(C)C1,2 Z3071630079,CC(C)(C)c1ccc(CNCC(C(N2)=O)=CN(CCOC)C2=O)cc1,0 C548-3450,O=C(C1CCC(CNS(c2cccc3nsnc23)(=O)=O)CC1)Nc(cccc1)c1Br,0 Z1974310796,OC([C@@H](CC1)C[C@@H]1NC(C1OCCCC1)=O)=O,2 Z2940374381,Cc1nccc(NCC2(CC2)n2nccc2)n1,0 Z1352655760,O=C(Nc1cccnc1Sc1ccccc1)N(CC1)CC11CCOCC1,2 Z1818777854,CC(C1)OC(CO)CN1C(c1cc(-c(cc2)cc3c2OCCO3)nc2ccccc12)=O,2 L228-0871,Cc(ccc(Cl)c1)c1N(CC1)CCN1S(c1ccc(-c2cnc(C3CCC3)o2)s1)(=O)=O,0 F6561-2672,O=C(NC(CC1)CS1(=O)=O)N(CC1)CC1OCC1CC1,2 V021-5590,CC(C(NCC=C)=O)Oc1cc(C(c2ccccc2)N(Cc(cccc2)c2F)CC2)c2cc1,2 SB42-0285,CC(C)C[C@@H](C(N(C)C[C@@H]1CN2Cc(cc3)ccc3Cl)=O)N1C2=O,0 Z1833660131,CN(CC1CCCC1)C(Nc1nc(OC)ncc1)=O,2 F3406-6325,O=C(C(CC1)CCN1c1ncnc(Oc2ccccc2)c1)NCCC1=CCCCC1,2 F5831-8718,CCOC(NCCN(CC1)CCN1c(cc1)ccc1Cl)=O,0 F6559-3617,CCSc(cccc1)c1C(NCc1nc(C(CC2)CCC2(F)F)no1)=O,0 Z2733455990,COc(cccc1)c1-c1nnc2n1CCCC2,0 SD56-0714,O=C(Cc1ccncc1)N(CCC1)CC(C(N2C3CCCCC3)=O)N1C2=O,2 Z1137652833,CC(CC(C)C1)CN1S(c(cc1)cc(C)c1F)(=O)=O,0 SA04-1417,CCOCc1cnc(C)nc1C(CCC1)CN1S(c1cccc2cccnc12)(=O)=O,2 Y041-4535,CC1N(CC(c(cc(c(C)c2)O)c2O2)=CC2=O)CCCC1,0 F2407-0079,O=C(Cn1c(cccc2)c2c(S(c2ccccc2)(=O)=O)c1)NCCN1CCOCC1,2 F5833-5284,COc(cc(cc1)NC(c2cccnc2SC)=O)c1N(CCC1)C1=O,2 F6475-2763,COCCOc1nccc(C(Nc2ncccn2)=O)c1,2 S651-0983,CN(CC(C1)(CC2)CCN2S(c(cc2)ccc2F)(=O)=O)C1C(N1CCCC1)=O,0 Z1342150100,Cc(c(OC)cc(C(N(CCC1)CC1c1nnc[nH]1)=O)c1)c1OC,2 Z1430202361,Cc1cccc(C(N(C)c2nc(OC)ccn2)=O)c1,2 SC18-0210,CN(Cc1nc(C(CC2)CCN2S(C)(=O)=O)no1)C(c1cc2cccnc2cc1)=O,2 F6795-0001,Cc1cccc2c1nc(N(CC1)CCN1c1nc(cccc3)c3o1)s2,2 Z3343035137,O=C(Cn1nnc(-c2cc3cccnc3cc2)c1)N1CCCC1,2 S720-0742,O=C(C1CC1)N(C[C@H](C1)Oc2ccccc2)[C@@H]1C(N1CCCC1)=O,2 Z4916289384,O=C(C(C(c1c2)=O)=CN(C3CC3)c1cc(Cl)c2F)NC1(CCOCC1)C(F)F,2 Z4135141747,CC(c1noc(C(C=CN2)=CC2=O)n1)Oc(ccc(Br)c1)c1Cl,2 4112-0938,Cc1cc(C(CSc2c(c(CCC3)c3s3)c3nc(C)n2)=O)c(C)n1-c1cc(C(F)(F)F)ccc1,2 F6548-0703,Cc1c(C(Nc(cc2)ccc2Cl)=O)sc(NCc2ccccc2)n1,2 Z3140094172,CN(Cc1nn(C)cc1)C(c1cc(C(CN)CCC2)c2cc1)=O,2 F6512-8991,Cc1c(CNC(CSCc2ccccc2)=O)cno1,2 Z2996203751,CC(C)(C)c1c(C)c(NS(c2ccnn2C2CCC2)(=O)=O)no1,2 F2491-0070,COc(cc1)cc(NC(c2n[nH]c3c2cccc3)=O)c1OC,0 F6169-0177,CC(N(C)N(C1=O)c2ccccc2)=C1NC(CN(C(C=C1)=O)N=C1n1nccc1)=O,2 Z5003680144,Cc1ccc(c(-c2nc(-c(cc3)ccc3O)no2)ccn2)c2c1,2 Z1609476110,OC(c1ccc(C(N(C2CC2)C(CCC2)c3c2cccc3)=O)o1)=O,2 Z1732250720,Cn1nccc1NC(N1CCC(Cc2cnccc2)CC1)=O,2 S635-5447,Cc1c(CN(CC2)CCC22C(COC)CN(C)C2)c(C)n[nH]1,2 Z3870416386,OCc1nnc(cc2)n1nc2N1[C@H](COc(cc2)ccc2F)CCC1,0 Z982467612,CC(CCCC1)N1c1nccc(C(N(C)CC2CC2)=O)c1,2 S836-7059,Cn1c(C(N(C[C@@H]2COc3ccncc3)C[C@@H]2C(N)=O)=O)ccc1,2 F5947-0085,Cc1cc(-c2nnc(NC(CC3CCCC3)=O)o2)c(C)o1,2 Z1907940846,O=C(C(C1)C11CCOCC1)NCc1cccc(OCC(F)(F)F)n1,2 Z997750248,Cc(c1c2)nn(C)c1ncc2S(Nc1cccnc1Cl)(=O)=O,0 F6473-8822,CC(N1C2CC2)=CC(OC(C2)CN2C(Cc2cnccc2)=O)=CC1=O,2 Z2504083593,CC(C)n1nc(C)c(C(N[C@@H](C)C(O)=O)=O)c1,0 F5791-0620,O=C(c1noc(-c2ccccc2)c1)NCC(F)(F)F,0 F6502-5783,O=C(c(ccc(F)c1)c1Cl)Nc1cn2nccc2nc1,0 V018-6562,CCc1c(Cc2ccc(C)cc2)c(N2CCN(CC(C)O)CC2)nc(C)n1,0 F6111-1642,COC(c1ccc(CN2CCC(COCc(cc3)ccc3Cl)CC2)cc1)=O,0 G935-3927,Cc(n(CC(N(CC1)c2c1cccc2)=O)nc1C)c1S(N(CCC1)CC1C(NC1CC1)=O)(=O)=O,2 SB33-0065,CCC(CC)N(C[C@@H]1c2nc(C)n[nH]2)C[C@@H]1NC(C1CCOCC1)=O,0 Z4497009513,Cc(cc1C)cc(F)c1S(Nc(cc1)nn1-c(nccc1)c1Cl)(=O)=O,0 E975-1362,CC(c1cccc(NS(c(cc2)cc3c2[nH]c2c3CCCCC2)(=O)=O)c1)=O,0 S591-0047,CC(C)CN(C(C1)CN1C(CCc1c[nH]c2c1cccc2)=O)C1CCOCC1,0 Z1331297419,CCCc1nc(C)c(C(NC(C(C2)O)c3c2cccc3)=O)s1,0 Z3087209720,CC(C(Nc1nn(C)c(C(F)(F)F)c1)=O)NC(C)=O,0 C999-1180,Cc(cc1)ccc1N(C(c1ncccc11)Nc2cccc(SC)c2)C1=O,0 S724-2130,CN(CCOC)C(c1cn(C(C2)CN2S(c(cc2)cc3c2OCCO3)(=O)=O)nn1)=O,2 F6514-4061,CN(C=C(C(N(C1)CC1n1nnc(COc2ccccc2)c1)=O)C(c1cccs1)=C1)C1=O,2 SB07-0387,CC(CCCC1)(c2noc(-c(cc3)ccc3F)n2)N1C(N(C)C)=O,0 Z27561201,CCc(cccc1)c1NC(CNC(c1cc(CCC2)c2s1)=O)=O,0 Z3437558929,C[C@H](C1)O[C@@H](C)c2c1c(C(NCc(cc1)cnc1-n1c(C)ncc1)=O)n[nH]2,0 F9995-0324,CC(N(CC1)CCC1c1noc(cc2)c1cc2F)=O,0 F6472-7564,O=C(c(ccc(F)c1)c1Cl)N(C1)CC1N(CC1)Cc2c1cccc2,0 F6482-7127,O=C(c1cocc1)NCc1cc(-c2cscc2)ncc1,2 S721-0538,COCCNC([C@H](C[C@@H](C1)Oc2cnccc2)N1C(CCC1CCCC1)=O)=O,2 F6789-0987,Cc1c(C)nc(cc2)n1nc2C(NCC1OCCC1)=O,2 F6625-0230,O=C(c(s1)ccc1Br)N1CCC(CN2N=C(CCCC3)C3=CC2=O)CC1,2 Z1941065571,O=C(c(cccc1)c1-n1nncc1)N[C@H](C1)[C@@H]1c(cc1)cc(F)c1Br,2 F6514-4084,CC(C(N(C1)CC1n1nnc(COc2ccccc2)c1)=O)Oc(cc1)cc2c1OCO2,2 SB53-0247,CCn1nc(C)c(CN(C[C@@H]2CNC(c3ccccc3)=O)C[C@@H]2c2nnc(C)o2)c1,2 8011-0002,Cc(cc1)cc(C)c1NC(CSC(NC(CC1c2ccccc2)=O)=C1C#N)=O,0 F6478-6291,O=S(C1CCCCC1)(N(CC1)CC1Oc(nc1)ncc1Cl)=O,2 Z1261236781,O=C(c1cnc(-c2ccncc2)s1)NCC1(CCOCC1)N1CCCCC1,2 V016-3737,COCCN(CC(c1ccccc1)O)CC(N1)=Nc(sc2c3CCCC2)c3C1=O,0 F6436-3593,O=C(CCc(cccc1)c1Br)N(CC1)CCC1c1cscc1,2 F6286-0499,O=C(CSCc1ccccc1)NCCc1nc(C(F)(F)F)cc(C2CC2)n1,2 F6549-7173,CC(C)(C)OC(N1CCC(CC(N2CC(CN(C(CC3)=O)C3=O)C2)=O)CC1)=O,2 Z1172701264,Cc(ccc(NC(c1c(cccc2)n2nc1)=O)c1C)c1OC,0 F5860-2691,CC(C(NCCOc(cc1)ccc1F)=O)N1N=Nc(cccc2)c2C1=O,2 S615-0603,O=C(c1nc2ccccc2cc1)N(CC1)CC1c1nc(CCOCC2CCOCC2)no1,2 F6573-4303,O=C(c(cc1)ccc1-n1cccc1)NCCOCCN(C(CC1)=O)C1=O,2 Z644095096,CCc1nc2ncnn2c(NCC(CCC2)c3c2cccc3)c1,0 Z4745379740,O=C1Oc(cc(cc2)NS(c3cc(C(F)(F)F)ccc3)(=O)=O)c2N1,0 SA50-0695,Cn(c(C1)c2CN1S(c(cc1)cc(OC)c1OC)(=O)=O)nc2-c1nc(CCOC)no1,0 F3382-4606,CCc(cccc1)c1NC(C(C)Sc1ncc(-c2cccc(Br)c2)o1)=O,0 Z815404178,Cc1cc(C)nc2nc(C(NCC(CC3)CN3c(cc3)ccc3F)=O)nn12,0 Z1098509979,Cc(cc(cc1)NS(c2cn(-c3ccccc3)nc2)(=O)=O)c1C(O)=O,0 F6573-1703,Cn1ncc(-c2nccnc2CNC(C(C=C2)=NN(C)C2=O)=O)c1,2 F454-0170,N#CC1=CC(C(CC(C2)c3ccccc3)=O)=C2N(c(cc2)cc3c2OCCO3)C1=O,2 Z1429459357,Cc(c(F)c1)cc(F)c1S(NCC1CCOCC1)(=O)=O,0 Z1090159196,O=C(CSC(N1c(cc2)ccc2OC(F)F)=Nc(cccc2)c2C1=O)NC1CCOCC1,2 F6573-0065,Cc1c(C(NCc(cc2)cnc2-c2ccnn2C)=O)n(cccc2)c2n1,2 P657-0850,O=S(c1ccc(-c2nnc(C3CCC3)o2)o1)(N(CC1)CCN1c(cc1)ccc1F)=O,2 Z4002210756,O=C(C1C2(CCCC2)NCC1)NCC(c1cccc(F)c1)N1CCOCC1,2 Z1278426780,CC(C)Cn1ncc(NC(N(CC2)CCN2c2nccc(OC)c2)=O)c1,0 S986-0364,CN(C)C[C@](CN(C1)C(c2ccccc2)=O)(C2)[C@H]1CN2C(c1ncncc1)=O,2 Z1431633149,Cc1cccc(NCC2CC2)c1C(N)=O,0 S831-0801,O=C(c1c[nH]nc1)N(C[C@@H]1COCC2CC2)C[C@@H]1c1ncccc1,0 Z1482818823,CC(C(CCC1)CN1C(c1nccc(Oc2cccc(Br)c2)c1)=O)O,0 Z1679979775,CCC(CC(F)(F)F)NS(c1cc(Cl)c2OC(C)Cc2c1)(=O)=O,0 F6739-7742,CN(Cc(cc1)cc2c1OCCO2)c(nc1)ncc1F,0 C869-0100,O=C(C(C1)CN(C2CCCC2)C1=O)N(CC1)CCC1(c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2,2 G336-0332,N#Cc1cccc(S(N(CC2)CCN2c2nc(cccn3)c3s2)(=O)=O)c1,0 CM4667-7688,CCOCC(CC1)OC1(CC1)CCN1S(c1cc(F)cc(F)c1)(=O)=O,0 F6557-1130,COc(ccc(S(N(CCC1c2ccccc2)CCS1(=O)=O)(=O)=O)c1)c1Cl,0 4333-1721,CCCC(C(c1ccccc1)NC(C1C)c2ccccc2)C1(CCC)O,2 F5857-0449,Cc1c(C(NCC(C2CC2)(c2ccco2)O)=O)n(cccc2)c2n1,2 Z1939930121,Cn1ncc(N(CC2)CC2NC(c2cc(c(C(F)F)nn3C)c3s2)=O)c1,2 SC15-0246,O=C1N(CC(CC2)CCN2S(Cc2ccccc2)(=O)=O)CC(COc2ncccn2)C1,2 Z2219061984,Cn1ncc(CNc(cc2)ccc2-c2cn(cccc3)c3n2)c1Cl,0 F5095-0187,CCCCOc(cc1)ccc1C(N(CC1)CCN1c1nccn1CC)=O,0 F3083-0388,O=S(NCc1ccccc1)(N1CCCCCC1)=O,2 Z445158494,Cc(cc(cc1)Cl)c1S(N(CC1CC1)CC(O)=O)(=O)=O,0 SB91-0600,CN(C)S(N(CCN1CCCC1)C(CC1)CN1C(NCc(cc1)ccc1F)=O)(=O)=O,0 S565-1469,CN(CC(N(CC1)Cc2c1n(C)nc2-c1nncn1CC1CC1)=O)S(c1c[nH]cn1)(=O)=O,2 Z2485385657,OCC(CCF)NC(c1cn(Cc2ccccc2)c2c1cccc2)=O,0 S968-0721,Cc1nc(S(N(CC2)CCC2(C2)C2NC(c2ccncc2)=O)(=O)=O)cn1C,2 Z1668683796,CNc(ccc(S(NC)(=O)=O)c1)c1NC(c1cccc2nccnc12)=O,2 Z1852169867,Cc1noc(C(CC(C2)OC)N2C(CCc2nccs2)=O)n1,2 F6497-0170,Cc1c(C(N2CC(Cc3nc(-c(cccc4)c4F)no3)CCC2)=O)n(cccc2)c2n1,2 SC70-0399,CCCc1nc(C(C2)C3(CCC3)CN2S(c2cc(F)c(C)cc2)(=O)=O)n[nH]1,0 F6496-1407,COc1c(CC(NCc2ncnc(C3CC3)c2)=O)cccc1,0 SA49-0197,CC1(CC1)C(N(C1)CC11OCC(CC(NCc2ccncc2)=O)C1)=O,2 Z3328076566,NS(c(cc1)ccc1C(NCCCNC1CC1)=O)(=O)=O,2 Z3396769565,Cc1cc(SCc2ccncc2)nc(-c2ncccc2)n1,2 D492-0111,O=C(c1noc(-c(cc2)cc3c2OCCO3)c1)Nc1ccnn1Cc1ccco1,2 F3385-4113,CC1OC(C)CN(CCOc(cc2)cc(OC=C3c(cc4)ccc4Cl)c2C3=O)C1,2 Z3053727525,OCC1CCN(CC(NC(C2CCCCC2)c2nc(cccc3)c3[nH]2)=O)CC1,2 V023-6754,CN(C)c(cc1)c(CN(CC2OCCC2)S(c2cccc(Cl)c2)(=O)=O)cc1NC(C1CCC1)=O,0 Z2913893788,OC[C@@H](CC[C@@H]1CO)N1C(Cc1cscc1Br)=O,0 S614-0638,O=C(C1CCOCC1)N(CCCC1)C1c1nc(CCOCC2CC2)no1,2 Z243210032,O=C(c(cc1)cnc1-n1ncnc1)N1CCC(Cc2ccccc2)CC1,2 SA49-1333,COc(ccc(Cl)c1)c1C(N(C1)CC11OCC(CC(NCc2ccncc2)=O)C1)=O,0 F6036-1306,O=C(c(cc1)cc2c1[nH]cc2)N(C1)CC1c1nc(C2CC2)no1,2 Z1241734063,CCC(N=C(c1cccc(NC(NCC(C)c2cccc(C(F)(F)F)c2)=O)c1)N1)=CC1=O,2 SB59-0639,Cn1c(C2C(C3)(CN3C(COCc3ccccc3)=O)CN(Cc3ccccc3)C2)nnc1,2 Z1250092156,OC(CC(CCC1)N1C(C1CC=CC1)=O)=O,2 SA44-0730,CN(CC(C1)(CN1C(c(cc(cc1)F)c1F)=O)C1)C1c1nnc(-c2ccccc2)o1,0 Z380059634,CCOC(c1cn(-c2ccccc2)nn1)=O,0 F5871-4102,CC(C)NC(N1CCN(CCNC(c2cccs2)=O)CC1)=O,2 F6472-7306,Cc1nn2c(CCN(C3)C(CN(C=NC(C)=C4C)C4=O)=O)c3cnc2c1,2 Z2254708424,CC(C)(C)C(CCCC(N(CC1)Cc2c1nc(C)nc2)=O)=O,0 S429-1613,CC(C)c(cc1)ccc1S(N(CC1)CCC1(C)c1noc(C2CCOCC2)n1)(=O)=O,0 Z3992203341,O=C(c1cnc(-c2ncccc2)nc1)N=C1SC=CN1Cc(cccc1)c1F,2 S651-0632,CN(CC(C1)(CC2)CCN2C(C(c2c3cccc2)=NNC3=O)=O)C1C(N1CCOCC1)=O,2 SC96-1449,Cc1noc(C)c1CC(N(CC1)CC2(COCC2)N(CC2CC2)C1=O)=O,2 Z4954982181,Cn1ncc(-c2ccc(C(Nc3c[nH]nc3-c3ncccc3)=O)o2)c1,2 Z2595686069,OC(C(c(cccc1)c1Br)NC(C1COCC1)=O)=O,0 4964-2359,CCn1c(ccc(CN(CC2)CCN2S(c2ccccc2)(=O)=O)c2)c2c2c1cccc2,2 F3349-0065,CC(C)Cc1nnc(NC(c2nc3ccccc3cc2)=O)s1,2 SC08-0123,CCn1nc(C)c(CN(C2)CC2c2nc(C(CC3)CCN3S(C)(=O)=O)no2)c1,2 Z4783484190,CC(C1)C1C(NC(CC1)CCN1C(c1c[nH]nc1C1CCCCC1)=O)=O,2 Z3686714408,O=C(Cc1cc(CCOC2)c2cc1)N(CCC1C2CC2)C1C(N1)=NNC1=O,2 Y501-2650,CCn1nc(C)c(CN(CC2)CCN2C(c2cc(CCCC3)c3s2)=O)c1C,2 Z2273499113,Cc1cncc(N2[C@H](COc3ccccc3)CCC2)n1,0 D750-0319,O=C(CC1(CCOCC1)N(Cc1c2cccc1)C2=O)NCCCN1CCOCC1,2 F6806-6447,O=S(C1CC1)(N(CCC1)CCN1c(ncc(Cl)c1)c1Cl)=O,0 Y200-5719,Cc(cc1)ccc1-c1cc(C(NCCC2=CCCCC2)=O)c(cc(cc2)Br)c2n1,2 Y043-6499,O=C(CNC(N(CC1)CCN1c1ncccn1)=O)Nc1nc(CCC2)c2s1,2 F6296-1208,Cn(c(CNC(c(cccc1)c1SC)=O)c1)nc1-c1ccncc1,0 SB20-1505,CCn1c(cccc2)c2c(CN2[C@H](Cn3nnc(C(NC4CCCC4)=O)c3)CCC2)c1,0 Z1949840212,CC(CC1)CCC1OCC(Nc(cc1)ccc1-n1ncc2c1N=CNC2=O)=O,2 S970-0417,Cc(cc1)ncc1C(N(CC(C1)(F)F)[C@@H]1c1nncn1CC1CC1)=O,2 M952-1607,Cc(n(C)c(C)c1S(Nc2cccc(Cl)c2)(=O)=O)c1-c1nnc(C2CC2)o1,0 Z1500965315,CC1(CCOCC1)NC(c1cn(-c(cc2)ccc2Cl)nc1C)=O,0 F6482-2314,COc1cc([nH]c(C(NC2CC3OCCOC3CC2)=O)c2)c2cc1,2 F2382-0089,Cn(cc1C(Nc(cc2)cc(Cl)c2F)=O)nc1OC,0 F5096-0596,COCCNC(CN(CC1)CCN1c1nccn1-c1cccc(Cl)c1)=O,0 F6709-4783,Cc1nccc(OC(C2)CN2C(c2cc(-c3ccccc3)n[nH]2)=O)c1,2 F6414-0007,CCOC(NCC(c(cc1)cc2c1OCC2)O)=O,0 Z1851634821,O=C([C@H](C1)[C@@]11c(cccc2)c2OCC1)NCCCC(NN1)=NC1=O,2 5486-0193,O=C(CCN(C(c1c2cccc1)=O)C2=O)Nc1c(C(NCC2OCCC2)=O)c(CCCC2)c2s1,2 F6372-0279,CCCCOc(cc1)ccc1NC(Nc1c(Cc2nc(C)no2)cccc1)=O,0 F6438-0619,Cc(cc1)cc(Cl)c1NC(NCc1nc(N2CCCC2)ccn1)=O,0 L285-1067,Cc(ccc(-c(cc1)nnc1N(C)Cc1ccco1)c1)c1S(N1CCCCC1)(=O)=O,2 G801-1466,Cc1cc(N(CC2)CCN2S(c(cc(c(N2)c3)NC2=O)c3Br)(=O)=O)c(C)cc1,0 P898-0434,CN(C)C(c1c(-c(o2)ccc2S(N(CC2)CCN2c(cccc2)c2F)(=O)=O)[nH]nc1)=O,0 Z1537045169,O=C(C(C1)COc(cc2)c1cc2F)Nc1ccccc1,0 F6574-1237,O=C(c1cccc(Cl)c1)NC(CC1)CCC1n1nccc1,0 3558-0100,CC(C1)OC(C)CN1S(c(cc1)ccc1NC(c1ccco1)=O)(=O)=O,2 SD56-0040,COCCN(C(C(C1)N2CCCN1C(c(cc(cc1)Cl)c1OC)=O)=O)C2=O,0 Z1385917362,CCOC(C1)C(C)(C)C1N(C)C(c(cc1)cnc1NC(C)C)=O,0 F6482-2181,O=C(CCc(cc1)cc(Cl)c1F)NC1CC2OCCOC2CC1,0 Z2878652355,CN(CCC1)C1c1n[nH]c(C(N2CC(c(cccc3)c3Cl)OCC2)=O)c1,2 Z2080291475,CCS(c1ccc(C(C)NC(C2(CCC2)c(ccc(F)c2)c2F)=O)cc1)(=O)=O,2 J006-1726,CC(C)c1cc(C2N(Cc(cc3)ccc3OC(C)C)CCC2)no1,0 F6515-0618,O=C(CSc(cc1)ccc1F)NCc1cc(-c2cccs2)ncc1,2 M012-0753,Cc(cc1)cc(C)c1S(N1Cc(cc(COCc2ccccc2)cc2)c2OCC1)(=O)=O,0 Z1264074618,CC(C)CC(Nc(ccc(C(Nc1ncc(C)s1)=O)c1)c1F)=O,0 Y043-1846,N1(\N=C(/C=C\C1=O)\c1ccc(cc1)Cl)CC(N[C@@H](C(=O)O)c1ccccc1)=O,0 G938-0814,CCC(C)NC(CN(C)S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O)=O,0 F1647-0008,Cc1n[nH]c(NC(C2)=O)c1C2c1cccc2ccccc12,2 Z253687674,CC(c1cnccc1)NC(c(c(OC)ccc1)c1OC)=O,0 F6524-1821,O=C(Cn(cc1)c2c1cccc2)N(CC1)CC1c1nocn1,2 F6436-3258,CC(CNC(CCc1ccc(C(F)(F)F)cc1)=O)(CSC)O,0 F5834-4046,O=C(c1ncccc1)Nc(cc1)cc(CC2)c1NC2=O,2 F6441-3860,O=C(C1CC=CCC1)N(CC1)CCC1S(Cc1ccco1)(=O)=O,2 F5491-0073,CCCCS(N(CCC1)CC1c1nnc(-c(cc2)cc3c2OCO3)o1)(=O)=O,2 F2393-0599,COc1ccc(CCS(NCC(c2cscc2)N2CCCCCC2)(=O)=O)cc1,2 F5937-0026,CN(C(C=C1)=O)N=C1C(NCCCn1cccc1)=O,2 SD60-0033,COCCC1COC(C2)(CN2C(c2nc3ccccc3cc2)=O)C1,2 F6381-3584,O=C(c1cc(-n2nnnc2)ccc1)N(CCCC1)CC1c1ccccc1,2 Z3899402152,Oc1nc(C2CC2)nn1C(CC1)CCN1C([C@H]1[C@H](CC2)O[C@H]2C1)=O,2 Z2225902634,Cc(cc1)ccc1OCCNC(CC1)CCC1NC(COc(cc1)ccc1Cl)=O,0 2786-4505,CC(NC(CC1c(cccc2)c2Br)=O)=C1C(OC)=O,0 Z2638298255,O=C([C@@H]1C[C@H](C2)[C@H]2C1)N(CCC1)CC1C(O1)=NNC1=O,2 F6523-3971,O=C(c(o1)ccc1Br)N(CC1)CC2=C1N=C(C=CC(F)=C1)N1C2=O,2 Z3603150315,CC(C)N(C(CNC(c(cc1)cc(N=CN2)c1C2=O)=O)=O)c1c(C)cccc1C,2 SC44-0085,CN(C)C(COC1CC(CC2)(CCN2C(c2ncccn2)=O)OCC1)=O,2 F6609-0196,O=C(c1cc(CCCC2)c2s1)N1CCN(Cc(cc2)cc3c2OCO3)CC1,2 F6791-8403,Cc1nnc(C(CCC2)CN2c(cc2)nn3c2nnc3C(F)(F)F)o1,2 F6478-0819,Cc1nc(OC(CC2)CN2C(c2ncccc2)=O)nc(C)c1,2 F6177-0230,O=C1NC(C2CC2)=Nc2c1cnn2-c(cc1)ccc1F,2 SC04-0298,O=S(Cc1cc(F)ccc1)(N(CCC1)CC1OCCc1noc(-c2ccccc2)n1)=O,0 Z1104732279,CC(Nc1cccc(NC(N(CCC2)C2C2CC2)=O)c1)=O,0 6948-5120,Cn1c(SCc2nc(-c(cc3)ccc3Br)no2)nnc1C1CCCCC1,2 F6442-0311,O=C(c1c[nH]c2c1cccc2)N(C1)CC1S(c(cc1)ccc1F)(=O)=O,2 6944-0107,CC(C)(C(C1N2CCCCC2)O)Oc(cc2)c1c(O1)c2C=CC1=O,2 S826-1451,Cc1cc(C(N(C[C@@H]2CO)C[C@@H]2c2nc(C3CC3)no2)=O)c(C)o1,2 Z1996564797,O=C([C@@H](CCC1)NC1=O)NCC1(CCC1)c(cc1)ccc1Cl,2 SD12-0335,Cc1noc(C)c1CC(N(CCN1)C(Cc2nc(-c3ccncc3)no2)C1=O)=O,2 Z1884524160,O=C(NCc1nnccc1)NC(Cc1ccccc1)c1cccs1,2 Z1728448524,CCC(Nc1cccc(C(NCc2nc(N3CCOCC3)ccc2)=O)c1)=O,0 Z359870058,Cc(cc1)ccc1-c1nnc(CSC(N2c3cnccc3)=Nc(cccc3)c3C2=O)o1,2 Z2054292933,Cc1cccc2nc(CN(C[C@@H](C3)OC)[C@@H]3c3nnc4n3CCC4)cn12,0 Z1679968703,Cc1c(C(NC)=O)c(C)nn1CC(F)F,0 F6514-4099,Cc1c(C(N(C2)CC2n2nnc(COc3ccccc3)c2)=O)c(C)nn1C,0 Z2270816305,Cc(cc1)c(CCC2)c2c1C(NC(CCC(N1)=O)C1=O)=O,2 SA01-0961,Cc(nccc1)c1C(N(CC1)CC1c1nc(N(C)C)ncc1C(NCCOC)=O)=O,0 Z1144950910,Cn1nccc1C(NCC1CCN(Cc(cccc2)c2Cl)CC1)=O,0 Y043-8068,OC(CC(c1ncccc1)=O)(c(cc(cc1)F)c1N1)C1=O,0 F6559-7982,O=C(c1c(C(F)(F)F)cccc1)NCCN1N=Nc(cccc2)c2C1=O,0 Z1875461130,OC(CC1)(CCN1C(CC1Oc(cccc2)c2NC1=O)=O)c1c(C(F)(F)F)cccc1,0 Z2669780677,CC(NC(CC1)CN1C(c(c(OC)c1)cc(Cl)c1-n1nnnc1)=O)=O,0 Z1241143852,O=C1NC(CN(CC2)CC=C2c2c[nH]c3c2cccn3)=Nc(cc2)c1cc2Cl,2 SA22-0548,COc1ccc(CNC([C@H](CC(C2)(F)F)N2C(C2)CN2C(C2CC2)=O)=O)cc1,0 SA90-0155,CN(C)C(CC(C1)OC(CC2)(CCN2C(c2ccccc2)=O)c2c1cccc2)=O,2 F2227-0622,CC(C)c1nnc(-c2cc(cccc3)c3n2Cc2ncccc2)o1,2 F6374-0115,O=C(C(c1ccccc1)c1ccccc1)N1CCC(CSc2ncccc2)CC1,2 SC72-2198,CCCc1nc(COC2(C3)CN3C(c3cscn3)=O)c2cn1,0 F6523-0925,CN1N=C(CCC(C2)C(Nc3cccc4cccnc34)=O)C2=CC1=O,2 S694-1569,Cc1cnc(C)n1C(CC1)CN1C(C1(CC1)c(cc1)ccc1OC)=O,0 F6415-1158,O=C(NC1(CC(C2)C3)CC3CC2C1)N(Cc1cocc1)Cc1cccs1,2 Z1414605276,CNC(CN(Cc1cnc2n1cccc2)Cc1cccc(C(F)(F)F)c1)=O,0 F6464-0537,CC(C)S(c1ccc(CC(N(CCCC2)CC2c(cc2)ccc2Cl)=O)cc1)(=O)=O,0 F976-0484,Cc(cc1)ccc1N(C(C=C1)=O)N=C1N(CCC1)CCN1S(c1cccc(Cl)c1C)(=O)=O,0 C273-0446,Cc1cn2c(Nc(cc3)cc4c3OCCO4)c(-c(cc3)cc(OC)c3O)nc2cc1,0 V013-9468,CCNC(NC(C)C1N(Cc(cc2)ccc2F)CCc(cc2OC)c1cc2OC)=O,0 F2672-0091,CN(CC1)CCN1C(CNC(c1cc(C(F)(F)F)ccc1)=O)c(cc1)ccc1F,0 F6573-6310,O=C(CCc(cc1)cc(Cl)c1Cl)N(CC1)CCC1(C1)C1(F)F,0 Z1269813402,Cc1ncc(C(N2CCCC2)=O)n1-c1ccccc1,2 Z1496189397,Cc(ccc(Cl)c1)c1S(NCC1(CCC1)C(O)=O)(=O)=O,0 Z316453378,CN(C=CC(C(N(CC1)CCN1c1cc(OC)ccc1)=O)=C1)C1=O,0 A0062795,C=CCN(C(c(ccc(C(O)=O)c1)c1N1)=O)C1=S,0 SA70-1158,Cc1nn(C)cc1CN(CCC1)CC1(CCOC)c1noc(C2CCOCC2)n1,2 F6125-2092,O=C(COc(cccc1)c1F)N(C1)CC1C(Nc1cccc2ncccc12)=O,2 Z2460789478,OC(c1cn(C(CCC2)CN2C(c(cc2)cc3c2OCCO3)=O)nn1)=O,2 Z3103173956,CN(C)CCn(cc1)nc1NC(C1NCCOc2c1cccc2)=O,0 S555-1499,O=C(C1CC1)Nc(cc1)cc(C2)c1OCCN2C(c1nccnc1)=O,2 F6403-1376,CCCc1c(C(N(CC)Cc2cnc3n2cccc3)=O)snn1,2 F5323-0748,Cn1nc(CCC2)c2c1NC(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)=O,0 F6791-8010,CN1N=C(C(CC2)CCN2c2ncnc3c2CCC3)N(C2CC2)C1=O,2 F3328-0042,COc(cc1c(SCC(N2CCOCC2)=O)ncnc1c1)c1OC,2 E734-2804,CCC(C1)Oc(ccc(Cl)c2)c2N1S(c1ccc(CN(C(c2c3nccc2)=O)C3=O)cc1)(=O)=O,0 SD07-0460,Cc1cc(C(N(CC2)CC22OCc3c(CNC(C4CCOCC4)=O)nnn3C2)=O)no1,2 V018-7767,O=C(c1ccc(CN(CC2)CCN2c2cccc(Cl)c2)cc1)NCc1ncccc1,0 F6560-4905,CC(C)C(Cn1nncc1)NC(C1(CC1)c(cc1)ccc1F)=O,2 Z1306259224,Cn1c(CNC(NCc2cc(-n3cncc3)ncc2)=O)ccc1,2 F424-0582,COc(ccc(-c(cc12)nn1C(SCC(NCC1OCCC1)=O)=NNC2=O)c1)c1OC,2 Z2296224186,O=C(CC(CC1)CNC1=O)Nc1c[nH]nc1-c1ccccc1,2 F6481-2863,CCC(Nc(cc1)cc(C)c1S(N(CC1)CCSC1c1c(C)cccc1)(=O)=O)=O,0 Z3132959801,O=C(c1nc(CNCC2)c2cc1)NC1C2(CCC2)NCC1,2 K784-7175,COc1ccc(C(C(N(C2)C3CCCCC3)=O)N(CCC3=CCCCC3)C2=O)cc1,2 F6480-0587,O=C(CNC(c1ccccc1)=O)N(CCC1)CC1Oc1ccncc1,2 Z2599225652,CCN(CCC1N(CC2)CCN2C(c2c(C)c(cccc3)c3s2)=O)C1=O,2 M331-0761,Cc1noc(/C=C/c(s2)ccc2S(Nc2cc(SC)ccc2)(=O)=O)c1NC(C1CC1)=O,0 Z828696962,CC(C)(C)n1ncc(C(NCc2c(C)onc2C)=O)c1C(F)(F)F,0 SC19-0649,CCn1nc(CN(CC2)CCC2NS(c(cc2)cc(F)c2F)(=O)=O)c2c1CCOC2,0 F6502-5873,O=C(c1cnc(C(F)(F)F)cc1)Nc1cn2nccc2nc1,2 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Z2982757496,CN(C)C(NCc1cn(-c2cccc(Cl)c2F)nn1)=O,0 F5252-0125,O=C(Nc(cccc1)c1Cl)N1CCN(Cc2nnnn2-c(cc2)ccc2F)CC1,0 F6560-8760,O=C(Cc1cnccc1)N(C(CC1)C2)C1CC2=C1CC1,2 C464-0773,CCC(N(CC1)c(cc2)c1cc2S(NC(C(C)C)C(NCc1cccs1)=O)(=O)=O)=O,0 Z2637394436,CC(C)(OC1)OCC1(CO)NC(c1cnc(-c(c(F)ccc2)c2F)s1)=O,2 D491-7543,CC(CC1)CCN1C(CNC(COc(cc1)ccc1Br)=O)c1ccc(C)o1,2 F2879-2874,CSc1cc(NC(C(NC2CCCC2)=O)=O)ccc1,0 Z1518525093,CC(C)c1cc(C(NC2(C)COCC2)=O)nn1-c1ccccc1,0 F6619-2163,CN(C(COC1)C1F)C(c(ncc(F)c1)c1F)=O,0 Z2440527587,Cc1c(C(N2C(CNC)CCC2)=O)nnn1-c(cc1)ccc1OC(F)F,0 Z2873474649,CC1(C)COC(CC(N[C@H]2COCC2)=O)C1,2 Z2947157679,CC(c1ncccn1)N(CC1)CCN1S(Cc1nocc1)(=O)=O,2 S836-3459,Cc(c(OC)ccc1)c1C(N(C[C@@H]1COC)C[C@@H]1C(NC)=O)=O,0 F5596-0637,O=C(Cn1c(cccc2)c2nc1)N(CC1)CCC1c1nnc(C2CC2)o1,2 Z1874318802,NS(c(cc1F)cc(Br)c1N(CC1O)CC1O)(=O)=O,0 F019-6038,CC(C(c1cn(C)c2c1cccc2)N1Cc2ccc(C)o2)=C(C)C1=O,2 F6789-7878,O=S(c1c2cccc1)(N=C2N(C1)CC(C2)C1CN2c1ncccc1F)=O,2 Z2960122603,CCN(C)C([C@H](C(C)C)NC(c1cn2ncc(Br)c2cc1)=O)=O,0 Z2569338051,Cc1cccc2c1N=CN(CC1(COCCC1)O)C2=O,0 Z4026171448,COc(c(F)c1sc(N(CC2)Cc3c2c(CC(N)=O)ccc3)nc1c1)c1F,0 Z763020080,CC(C(Nc1ncc(C)cc1)=O)NC(C1CCCCC1)=O,2 Z871866506,CN1C(CNC(c(cc2)ccc2F)=O)CCCC1,0 Z2068636714,CCc1cc(-c2nc(C(CC3)(CCC3c3ccccc3)OC)no2)n[nH]1,2 P316-0562,Cc(cc1)c(C)cc1N(CCC1NS(Cc(cc2)ccc2Cl)(=O)=O)C1=O,0 K284-4757,N#Cc1c(CSC(N2CC(CC3)CCC3C(NCC3OCCC3)=O)=Nc(cccc3)c3C2=O)cccc1,0 F6416-9408,OC(CCNC(NC1CCCC1)=O)c1cccc(Cl)c1,2 8019-7021,O=C(CN1N=Cc(cccc2)c2C1=O)Nc1cccc(S(N2CCOCC2)(=O)=O)c1,2 F0453-0500,CC(C)(C)n1nc(CSC2)c2c1NC(c(c(F)ccc1)c1Cl)=O,0 Z1097083021,Cc1c(CC(NC(CO)c2ccccc2)=O)cccc1,0 F5628-0027,Cc1nc(N2CCOCC2)cc(NCCNC(Nc(ccc(F)c2)c2F)=O)n1,0 F6445-2376,O=C(c(s1)ccc1Cl)N(CC1)c(cc2)c1cc2-c1ccncc1,2 Z2443033848,NCC(CC1)CN1S(c(cc1)cc2c1OCO2)(=O)=O,0 S615-0525,COc1ccc(C2(CC2)C(N(CC2)CC2c2nc(CCOCC3CCCC3)no2)=O)cc1,2 Z1142566577,CC(C)(C)CC(N(CSC1)C1C(N(CC1)CCN1C(c1cc(OC)c(C)cc1)=O)=O)=O,2 Y020-9360,COCc(c(-c(cc1)ccc1Cl)c1nc2)nn1c(C=CN1CCN3CCOCC3)c2C1=O,0 Z814065176,CC1CCC(CNC(NCc2cc(NC(COC)=O)ccc2)=O)CC1,0 F6539-3638,O=C(c(cccc1)c1Cl)NCCCc1cc(cccc2)c2o1,0 SA93-0616,Cc1cc(NC(N(CCC2)CC2(CCOC)C(N)=O)=O)c(C)cc1,0 Z1336991443,CCOc1cccnc1C(NC(CCC1)CN1c1cc(OC)ccc1)=O,0 SB95-0684,O=C(C1CCC1)N(CCN1CCCC1)C(CCC1)CN1C(c1ncncc1)=O,2 Z809758222,NC(c1cccc(C(N(CC2)CCC2Oc2ccccc2)=O)c1)=O,0 Z2962716683,Cn(c(C(N1CC(CS(N)(=O)=O)CC1)=O)c1)c2c1cccc2,0 Z2005630817,Cn1c(C(CCC2)N2C(c(cc2)cnc2NCC2CC2)=O)nnc1,2 F6415-0808,Cc1cc(C(N(Cc2cocc2)Cc2cccs2)=O)no1,2 F6443-6061,O=C(Cc(cccc1)c1Cl)NCC(CCC1)N1c1nc(cccc2)c2o1,2 Y042-7014,Cn1c(cccc2)c2nc1CNC(c(cc1)cc(N(CCCC2)S2(=O)=O)c1Cl)=O,0 S640-3282,Cc(nc1)cnc1C(N(C[C@@H]1C(NC)=O)C[C@@H]1c1nc(COC)no1)=O,2 Z2174917168,C[C@@H](C(N(CCC1)CC(C2)N1c1c2cccc1)=O)c1ccccc1,2 F5230-1461,O=C(c1nn(-c2ccccc2)nc1)NCCN(C(C=C1)=O)N=C1c1cnccc1,2 Z1233499779,O=C(C(C1)CNC1=O)N1CC(Cc(cc2)ccc2F)CC1,0 F6495-4414,CS(N(CC1)CCN1C(C(C1)CN1c1ncnc(-n2cncc2)c1)=O)(=O)=O,2 S827-4012,CCc1noc([C@H](CC(C2)(F)F)N2C(COc(cc2)ccc2F)=O)n1,0 Z1778698292,Cc1cc(C(OC)=O)c(C(NC(SCc2cc(F)cc(F)c2)=N2)=O)c2n1,0 Z1625180943,OC(C(c1nc(cccc2)c2s1)O)C(N1CC(Cc2ccccc2)CC1)=O,2 SB66-0804,COc1cccc(C(N(C[C@H]2CCC3)C[C@@H]2NC3=O)=O)c1OC,2 Z1918589724,CSC1(CNc2nnc(C(F)(F)F)s2)CC1,2 SC68-1665,O=C(c1n[nH]cc1)N(C1)CC2(CCCCC2)C1c1nncn1CC1CC1,0 Z2443829875,CC(CC1)=C(C)CC1C(NS(c1cccc(Br)c1)(=O)=O)=O,0 S993-0630,CC(C)CN(CC(N(CC1)C2CCN1S(c1cn(C)cn1)(=O)=O)=O)C2=O,2 Y041-9001,COc(cc1)cc2c1[nH]cc2CCNC(CC(C(Nc1c2cccc1)=O)NC2=O)=O,2 D398-0026,O=C(c1noc(C2CC2)c1)N(CCC1)C1c1cccs1,2 Z1682257366,CCCN(C)CC(CC1)CN1S(c(cc1)cc(F)c1C(O)=O)(=O)=O,0 F6559-1470,O=C(c1cc2nsnc2cc1)NC(CC1)CCC1(F)F,2 Z3668952886,O=C(C1=CC=CN(C2CCC2)C1=O)NCCCC1OCCCC1,2 Z3337924890,COc1cccc(-c2cn(CCCN3CCOCCC3)nn2)n1,2 F2982-0552,CS(c(cccc1)c1NC(CS(Cc1ccccc1)(=O)=O)=O)(=O)=O,0 F6521-9780,COC(CNC(Nc(c(F)ccc1)c1F)=O)(C1)Cc2c1cccc2,0 SB04-0101,Cc1c(COC)c(C(NCCN(C(CC2)CN2S(C)(=O)=O)C2CCOCC2)=O)no1,0 F6089-9026,O=C(C(NCC(CC1)CCN1C(Nc(cc1)ccc1F)=O)=O)NCC1OCCC1,2 Z1314005984,O=C(c1cc(-c2nocn2)ccc1)N1c2cccc(F)c2C2(CCCC2)C1,2 F6543-5314,O=C(c1cc(Br)cs1)N1CC(CF)C1,0 F5230-1120,CN(C)S(NCCCN(C(C=C1)=O)N=C1c1ccncc1)(=O)=O,2 F3375-1261,O=C(c1cocc1)Nc(cc1)ccc1Nc1ccccc1,2 S812-0433,CS(N1C(C2CCCC2)c2nccn2CCC1)(=O)=O,0 Z2044754604,COc1cccc(OC(C(O)=O)=C2)c1C2=O,0 F6237-1961,O=C(c1nn(-c(cc2)ccc2Cl)nn1)NCCOc(cc1)ccc1F,2 Z1271158521,CC(C)n1ncc(S(N(C)c2cnccc2)(=O)=O)c1,0 Z1940714832,CNS(c(cc1)cnc1NC(N1C[C@H](CN(Cc2ccccc2)C2)[C@H]2C1)=O)(=O)=O,2 F2277-0050,CC(C)CS(Nc(cc1)cc2c1OCCN(C)C2=O)(=O)=O,0 Z856470084,CC(C1)OC(C)(C)CN1C(CCN(C(CC1)=O)C1=O)=O,2 Z3655639443,OC(c1ccc(CC(N2[C@@H](C3)[C@@H](C4)[C@@H]4[C@@H]3C2)=O)cc1)=O,2 Z3798029872,Cc1nnc([C@](CC2)([C@@H]2CC2)N2C(NC2CC2)=O)o1,2 F6257-4664,CC(CC1)CCN1c1cc(NC(Nc(cccc2OC)c2OC)=O)ncn1,0 Z2309596342,Cn1nc(CNC(N[C@H](C2)C[C@H]2O)=O)c(Br)c1,2 Y031-4013,CC(C)c(cc1)ccc1NC(C(C1)CN(C(C)(C)C)C1=O)=O,0 Z1065736208,OC(c1cccc(CNC(N2CCN(CC(F)(F)F)CC2)=O)c1)=O,0 S018-0088,COc(ccc(NC(C(CN(C1)S(C2CC2)(=O)=O)C11CCCCC1)=O)c1)c1OC,2 Z3216004975,O=C(Cc(nc1n2cccc1)c2Br)N(CC1)C[C@@H]1F,2 Z118337494,O=C(C(CC1)CCN1C(c1cccc2ccccc12)=O)NCc(cc1)cc2c1OCO2,2 Z2482792363,OC(C(c1cccc(Cl)c1Cl)N1Cc2ncnn2CC1)=O,0 D718-0988,CC(CC1)CCN1C(N1)=Nc2nccc(-c(cc3)ccc3Br)c2C1=O,2 Z4227698797,Cc1nc(C(NCc(cc2)cc(C)c2O)=O)co1,0 7282-5239,C(c1ccccc1)Nc1c2ncn(C3OCCCC3)c2ncn1,2 Z1730233118,Cc(c(CN[C@H](CCCC1)[C@@H]1O)c1)nn1-c1ccccc1,2 Z2839637784,CC1(Cc(cc2)cc(F)c2F)N(CC(N2)=NC(CCOC3)=C3C2=O)CCC1,2 Z1331720705,O=C(CC(c1ccccc1)NC(c(cccc1)c1Cl)=O)NCC(N1)=NNC1=O,2 F6658-6247,Cc1cc(OCC(CC2)CCN2C(Cc(cccc2)c2Br)=O)ncn1,0 F3222-0559,Cc(cc(c(OC)c1)NS(c2c(C(OC)=O)sc3cccc(F)c23)(=O)=O)c1Cl,0 F6031-1801,OC(CN1CCN(Cc2ncccc2)CC1)c1cccs1,2 S694-0765,Cc1cnc(C2CC2)n1C1CN(Cc2cc(C)ccc2)CC1,0 F6617-4266,CC(C)(C(CC1)C(Nc2ccccc2)=O)C1(C)C(O)=O,0 J500-0317,Cn1c(C(N(C2)CC3(CCCC3)C2C(NCCOC)=O)=O)ncc1,2 D399-3218,O=C(Nc1cccc(Cl)c1)N(CCC1)C1c1ccco1,0 D074-0135,CCOc(cc(C(c1c2[nH]nc1-c(cccc1)c1O)N(CCOC)C2=O)cc1)c1OCCC(C)C,0 Z2911870540,OC(C1(CCCC1)C(Nc1cn(-c(cccc2)c2F)nc1)=O)=O,2 Z2335293474,CC(CC(C)(C)C1)N1C(c1cccnc1OCC(F)F)=O,0 F6125-2768,Cc(cc(cc1)NC(C(C2)CN2S(C)(=O)=O)=O)c1Br,0 Z973036582,O=C(CCc1c2)Nc1cc(F)c2S(N(CCN1)C(c2ccccc2)C1=O)(=O)=O,2 F6813-8153,CC(C1)N(Cc(ccnc2)c2F)CCN1c1nc(C2CC2)ns1,2 Z1797883011,CC(C)(C1)OC2(CCCC2)CN1C(CNC(CCC1CCCC1)=O)=O,2 Z2936914478,CCN(CC1)CCN1C(C1)CN1c(nccc1C)c1[N+]([O-])=O,2 Z1270415328,OCC(CNC(OCc1ccccc1)=O)O,0 Z1951509345,Cc1ccc(C(CNC(c2c(C)nc(cc3)n2cc3Br)=O)N2CCCC2)o1,0 Z2770830033,Cc1c(C)sc2ncnc(N(CC3)CC3C(NC(N3)=O)=CC3=O)c12,2 SC72-1592,O=C(C1CCC1)N(C1)CC11OCc2c1cnc(-c1ccccc1)n2,2 F6443-4266,O=C(Nc1ccc(C(F)(F)F)cc1)N(CC1)CCC1(c1c2cccc1)OC2=O,0 J038-0455,CCOc1cccc(C([C@H]2[C@@H]3OCCC2)Nc(cc2)c3cc2Br)c1OC,0 T990-4015,O=C1N(Cc2ncccc2)CCC1N(CC1)CCN1S(c1cccc(Cl)c1)(=O)=O,0 V027-2095,CCC(C)N(Cc(cc(cc1)NC(CC(C)C)=O)c1N(C)C)C(NC(C)(C)C)=O,0 F5889-0113,CSc(cccc1)c1NC(CNC(c1c[nH]c2c1cccc2)=O)=O,0 Z1412315355,OC(CNC(NC(CC1)Cc2c1cn[nH]2)=O)c(cccc1)c1F,2 F6514-6750,CC(N=C1N2C=CC=C1C(NC(Cn1nccn1)c1ccccc1)=O)=CC2=O,2 Z3557846687,CC(C)[C@@H](CO)Nc1nc2ncccc2cc1,0 F1836-0194,Cc1cccn2c1nc(CNC(CCCc1ccccc1)=O)c2,2 Z2021220594,O=C([C@@H](CCC1)NC1=O)Nc(cc1)cnc1OC(F)F,2 F6454-1376,O=S(c(cccc1)c1Br)(NCC(CC1)CCN1c(nc1)ncc1F)=O,0 Z1991862116,CC(C)(C(O)=O)n1ncc(NC(c2cc(cccc3)c3o2)=O)c1,2 Z64563622,Cc(ccc(-c1nc(N(C)CCO)c(ccs2)c2n1)c1)c1[N+]([O-])=O,0 G366-1119,O=C(C(C1)N(C(c2ccccc2)=O)c2c1cccc2)NCCN1CCOCC1,2 Z1764352298,O=C(c1ccc(-c(cccc2)c2OC(F)(F)F)o1)N1CCSCC1,2 G678-0322,CN(C)S(c(cc1)ccc1C(NCCS(N(CC1)CCN1c(cc1)ccc1F)(=O)=O)=O)(=O)=O,0 F6412-6663,NC(c(cccc1)c1OCC#CCNC(c(cccc1)c1Br)=O)=O,0 SB24-0468,O=C(C1CCCC1)N(CC1)CCC1(CC1)C1n1nnc(C(N2CCOCC2)=O)c1,2 F3225-4905,CC(CC1)CCN1c1nc2ccccc2nc1C(C#N)S(c1cccs1)(=O)=O,2 F6574-0538,Cc1cc(C(N(CC2)CCC2Oc2nncs2)=O)c(C)o1,2 Z3293217859,CCNC(N(CCC1)CC1(C(O)=O)O)=O,0 SD07-0565,CCCNC(NCc1c(COC(CC2)(CN2C(CCCc2ccccc2)=O)C2)n2nn1)=O,0 Y043-5150,Cn1c(ccc(NC(CCC(C(N2CCc3ccccc3)=O)NC2=O)=O)c2)c2nc1,2 Z3216017438,Nc1nnc(CNC(Nc(cccc2)c2N2CCCCC2)=O)o1,2 Z921286684,CCN(Cc(ccc(OC)c1)c1OC)c1nc(C)nc2c1cnn2C,0 Z780205252,O=C(CN(c(cccc1)c1N1)C1=O)N(CC1)CCC1N1CCCC1,2 Z791020500,O=C(COC(CCCc1c[nH]c2c1cccc2)=O)NCc1cc(F)cc(F)c1,2 F6469-1681,O=C(c1noc(-c2ccco2)c1)Nc(cccc1)c1-c1cn(cccc2)c2n1,2 Z2977247470,O=C(c1c(COCC2)n2c(-c2ccccc2)n1)N(CC1)CC1C1CC1,2 SD12-0980,Cc1noc(CC(C(N(Cc2ccccc2)CC2)=O)N2S(c(cccc2)c2F)(=O)=O)n1,2 Z1457728805,Cn1nnc2c1ccc(COC(c1cc(-c3ccncc3)nc3ccccc13)=O)c2,2 S615-0560,O=C(Nc(cc1)cc2c1OCCO2)N(CC1)CC1c1nc(CCOCC2CCCC2)no1,2 F6791-9574,CN(CC1OCCOC1)c1c(cc(cc2)F)c2ncn1,2 F6506-0168,COc(ccc(C(NCC(c1cocc1)(c1ccco1)O)=O)c1OC)c1OC,0 Z2595611776,CC1(C)OCC(C2)C12C(Nc1cccc(-n2ncc(C(O)=O)c2C)c1)=O,2 F6473-6065,Cc1c(C(N(C2)CC2OC(C=C(C)O2)=CC2=O)=O)n(cccc2)c2n1,2 Z1699087392,OCc1nc(N2CCN(CC3CCCCC3)CC2)ncc1,2 S613-1131,O=C(c1cocc1)N(CCC1)C1c1nc(CCOCC2CCOCC2)no1,2 F6681-3314,O=C(CN(C(CC1)=O)C1=O)N1CC(COc2cnccc2)C1,2 F6480-3078,Cc1nc(OC(CCC2)CN2C(c(cccc2)c2C(OC)=O)=O)nc(C)c1,0 F5871-0133,O=C(c1cscc1)NCCN(CC1)CCN1C(c(cccc1)c1Cl)=O,0 Z2996174242,O=S(c1ccnn1CC1CCC1)(Nc1nc(C2CC2)ccc1)=O,2 F2652-1544,CCc1cccc2c1nc(N(Cc1ncccc1)C(c1cccc(S(CC)(=O)=O)c1)=O)s2,0 Z1629086228,O=C(C(CCN1)CC1=O)Nc1ccc(cccc2Cl)c2n1,2 F6502-7470,COc1cccc2c1oc(C(NCCn(cc1)nc1-c1cscc1)=O)c2,2 SB18-0159,CCn1ncc(C(N(C[C@H](C2)NC(CC(C)C)=O)[C@@H]2c2nc(C)n[nH]2)=O)c1C,2 F6522-1507,O=C(NCc1cc(-c2cocc2)cs1)NC1CCCC1,2 D149-0022,Cc1cc(COC)c(c(NC(c(cc2)ccc2Br)NC2=O)c2s2)c2n1,0 F6436-3602,Cn1ncc(S(N(CC2)CCC2c2cscc2)(=O)=O)c1,2 F6752-7652,CC(C)(C)NC(C1CN(Cc2ccc(C(F)(F)F)cc2)CC1)=O,0 F5123-0480,O=C(Nc(cccc1)c1F)N(CC1)CCN1c1nn2c(-c3ccco3)nnc2cc1,2 Y042-6698,COc1ccc(cc(cn2)NC(C(C3)CN(Cc(cc4)cc(OC)c4OC)C3=O)=O)c2c1,2 Y042-3003,OC(CCC(C(N1CCc2cccc(F)c2)=O)NC1=O)=O,0 F6287-0186,O=C(C1(CCCC1)c(cc1)ccc1Cl)NCCc1nc(-c2cccs2)c[nH]1,2 F6438-2536,CN(C)c(nc(N1CCCC1)nc1)c1NC(Cc(cc1)ccc1F)=O,0 Z2974577435,COc1ccnc(NCC(CC2)CCC2S(C)(=O)=O)n1,0 Z4915721927,CN(C1CCCC1)c1nccc(C(N(Cc2c(C3)cccc2)C3C(O)=O)=O)c1,2 F6482-2584,O=C(Cc1cccs1)N(CCCC1)C1C(F)(F)F,0 Z3144156423,CCN(C=C(CNC(C(CNC1)C11CCCCC1)=O)C(N1)=O)C1=O,2 F6363-0189,Cc1cc(C(Nc(cn2)cnc2OC)=O)c(C)cc1,0 Z2769895646,C(C1)C1c1nn(ccnc2N(CCC3)CC33COCCC3)c2c1,2 Z1449265814,O=C(Cc1cccs1)N(CCC1)C1C(NC1CC2(CCCCC2)OCC1)=O,2 F6702-2049,Fc1cc2c(N3CCC(COc4nccnc4)CC3)ncnc2cc1,2 F6550-6211,Cc(nc1)cnc1C(N(C1)CC1Nc1nnccc1)=O,2 Z2232708814,Cn1ncc(C(N2CCC(CO)CCC2)=O)c1,0 Z2879595817,CC(c1c(C)onc1C)c1nc(C2OCC(C)N(Cc3ccccc3)C2)no1,0 Z1304995559,CN(CCC1N(C)CCCC1)C(NCc1cc(-n2nccc2)ncc1)=O,2 Z1796665618,Cc1cc(OCc2noc(CN3N=Nc(n(C)nc4)c4C3=O)n2)cc(C)c1,2 Z1906777424,O=C(C(F)F)N1CCN(CCc(cc2)cc(Cl)c2Cl)CC1,0 F3411-7496,Cc(cc1)c(C)cc1N1N=C(c2nc(-c3ncccc3)no2)c(cccc2)c2C1=O,2 F6439-7122,O=S(Cc1ccccc1)(NCCn1c(-c2ncccn2)ncc1)=O,2 SA45-0009,CN(CCCC1(CC2)CCN2C(c(ccc(OC)n2)c2OC)=O)C1C(N)=O,2 Z1682302901,Cc(c(S(N(C)C1(CCCC1)C(N)=O)(=O)=O)cc(C(O)=O)c1)c1Cl,0 CM2944-3362,Cc1noc(C)c1C(N(CCC1)CC1OCc1noc(C2CCOCC2)n1)=O,2 F6245-0328,O=C(Nc(cc1)cc(Cl)c1Cl)N(CC1)CCC1c1nnc(C(F)(F)F)o1,2 F6807-7283,COc1nc(N(CC2)CCN2C(c2ccco2)=O)nc(OC)c1,0 S694-0454,Cc1cnc(C2CCOCC2)n1C1CN(Cc(cc2)cc(C)c2OC)CC1,0 Z2775996312,Cn1nc(CNS(CCc(cccc2)c2F)(=O)=O)c(C(F)F)c1,0 Y043-3545,CC(c(c(O1)c2CN(CC3)CCN3C(CC3)CS3(=O)=O)ccc2O)=C(C)C1=O,0 S570-0512,COCCN1C2=CCCCC2(CNC(CCc2nc(cccc3)c3s2)=O)CCC1=O,2 F6221-0160,Cc1c(C(Nc2cnc(-n3c(C)ncc3)nc2)=O)c(-c(cccc2)c2Cl)no1,2 Z1450324677,CC(C)(CC1)CCC1C(NCCS(c(cc1)ccc1F)(=O)=O)=O,2 C463-0399,CC(C)CCNC(CSC(c(ccc(Cl)c1)c1N1C)=CC1=O)=O,0 F2724-2276,Cc1noc(C)c1CCC(Nc1cc(-c(cc2)nnc2N2CCCC2)ccc1)=O,2 SC54-0428,CCCNC(N(C[C@H]1CN(CC2)C(c3cn(C)nc3C)=O)C[C@]12c1nnc(C)o1)=O,2 F2902-0250,O=C(c(c(F)ccc1)c1Cl)NCCn1ncc2c(N(CC3)CCN3c3ccccc3)ncnc12,2 F6560-8017,CC(C)(C(NCc(cc1)cnc1-c1cn(C)nc1)=O)Oc(cc1)ccc1Cl,2 F6252-1196,Cc1noc(-c(cc2)cnc2N(CCC2)CC2C(Nc(cc2)cc(F)c2OC)=O)n1,2 F2147-9904,O=C1OC2(CCNCC2)c(cccc2)c2N1,2 F5857-0770,Cn1c(C(CNC(C2CCCCC2)=O)O)ccc1,2 V004-5167,COc(cc1)c(C(F)(F)F)cc1C(N(CCn1c2ccc1)C2c1cccs1)=O,0 Z2648326852,CC(C)n1nc(C)c(C(NC(C)(C(OC(C)(C)C)=O)c2ccccc2)=O)c1,0 Z1851621464,NC(c1ccc(CC(NC2(CCC2)c2cccc(C(F)(F)F)c2)=O)cc1)=O,2 S726-0102,COc1ccc(C2(CC2)C(N(CC2)CCC22OCCC(CCO)C2)=O)cc1,0 Z3076537507,Cc1cc(COCC(N(C2)c(cccc3)c3OC2C(NC)=O)=O)no1,0 C535-0224,Cc1nn2c(N(CC3)CCN3c(cc3)ccc3OC)cc(C)nc2c1-c1ccccc1,0 Z1673102168,CN(CC1)CCN1C(c1ccc(CNC(N(CC2)CC3N2CCOC3)=O)cc1)=O,2 Z1928224081,CC(Nc1ncc(CNC(C2OCC2)=O)cc1)=O,2 F1102-0015,CC(C)Sc1nc(N)c(c(C)c(C)s2)c2n1,0 Z401874674,Oc1cccc(CNC(CC2)CCN2C(C2CC2)=O)c1,2 F383-0120,Cc(ccc(CN(C(C1C2CCCC1)=O)C2=O)c1)c1S(N1CCN(Cc2ccccc2)CC1)(=O)=O,2 F6549-5138,Cn1ncc(C(CCC2)CN2S(c(cccc2)c2Cl)(=O)=O)c1,0 Z3173455135,OCC(Cc1ccccc1)(CCC1)CN1C(C1(CC=CC1)C(O)=O)=O,2 F5857-0768,Cn1c(C(CNC(c2cccs2)=O)O)ccc1,0 Z117069428,O=C(CNS(c1cc(C(F)(F)F)ccc1)(=O)=O)N1CCC1,0 Z608775564,Cc([nH]nc1C)c1S(N1CC(c2ccccc2)OCC1)(=O)=O,0 F6796-0502,Cc(ccc(Cl)c1)c1N(CC1)CCN1c1ncnc2c1ncn2CCOC,0 Z3495633389,NC(CCC1)c(cc2)c1cc2-c1nc(-c2ncccn2)no1,0 F5250-0152,CC(C)(Cc1ccc2)Oc1c2OCC(N1CCN(Cc2nnnn2-c2ccccc2)CC1)=O,2 Z1762691189,CN(CC(O)=O)C(CCC1)CCN1C(C(C1)c2c1cccc2)=O,2 Z2231651078,CCN(CC)Cc1ccc(C(N(CCCN2)C(Cc3ccccc3)C2=O)=O)o1,0 F2784-0044,O=C(c(ccc(Cl)c1)c1Cl)Nc(cc1)ccc1N(CCCC1)C1=O,0 J097-0332,CCN(c(ccc(C(Nc1cc(C(C)=O)ccc1)=O)c1)c1-c1c2cccc1)S2(=O)=O,0 F6502-9280,CCOc(ccc(S(NCCc1nn(C)c(C)c1)(=O)=O)c1)c1F,0 Z1987153980,CC(c1cc(O)ccc1)N(C)C(c1cnnn1C)=O,0 F6755-7447,N#Cc1cc(F)c(CN(CC2)CCN2S(C2CC2)(=O)=O)cc1,0 F5854-4036,Cn1c(CN(C2CC2)C(NCc2cccc3ccccc23)=O)ccc1,2 F6523-0311,O=C(CSCc1ccccc1)N(CC1)CCN1c1ncnc(C(F)(F)F)c1,2 Z1217929517,Cc1cc(N(CC2)CCN2C(c(cc2)ccc2F)=O)nc(C2CC2)n1,2 Z757796890,O=C(c1c[nH]nn1)N(CCC1)C1c1cccc(Br)c1,0 Z2973429691,Cc1n[nH]c(CNC(N[C@H](C2)[C@@H]2c2cc3ccccc3cc2)=O)n1,2 Z3711312928,OC(C(N1)=Cc2cc(Br)cn2C1=O)=O,2 Y042-6400,O=C(C(CC1=O)CN1c1n[nH]c2c1cccc2)Nc1nc(cccc2)c2s1,2 F2135-1565,O=C(CSc1ncccc1)NCc(cc1)cc2c1OCO2,2 Y044-5172,COc1cc(CCC2NC(CCC(N3)=Nc(cccc4)c4C3=O)=O)c2cc1OC,2 Z2720638416,CC(C)(C)C(C(OC)=O)Sc1nnc(N(C)C)s1,0 Z2912214543,OC(C(c(cccc1)c1OCC1)N1C(c1cn(C2CC2)nc1)=O)=O,2 Z367282904,CNC(C(CCCC1)N1C(Cc1cccc2cccnc12)=O)=O,0 Z2569695908,CN(Cc(cc1)cc2c1oc(C(O)=O)c2)C1(COC)CC1,2 F6349-0396,Cc1noc(C)c1CCC(N(CC1)CCN1C(c1c(cccc2)n2nc1)=O)=O,2 S606-1171,CCN(c1cccnc1N1[C@H](CC2)CN2C(c2cscc2)=O)C1=O,2 F6562-6951,O=C(Cc(cccc1)c1Cl)N(CC1)CCC1N(C(COC1)=O)C1=O,0 Z3581195758,OC1(CC1)C(NCCc1cc2ccccc2nc1)=O,0 F3394-0250,CC(c(cc1)ccc1NS(c(cc1)ccc1Oc1c(C)cccc1)(=O)=O)=O,0 Z2627832687,CC1OCCCC1C(N(CCC1)CC1C(C)(C)C(O)=O)=O,2 F2879-1097,O=C(C(Nc(cc1)ncc1Cl)=O)NCc1ccco1,2 F6435-3462,COc(cc1)cc(C(N(CC2)CC2(C2)Oc(cccc3)c3C2=O)=O)c1Br,0 F6516-1066,Cc1cc(C(NCc2ccc(-c3cscc3)o2)=O)c(C)o1,2 Z4480730196,C#Cc1ccc(C(CCC2)N2C(c(nccc2)c2Cl)=O)cc1,0 Z1892829702,Cn1ncc(C(Nc(cccc23)c2OCCC3O)=O)c1Cc1ccccc1,2 Z117310804,CC(C)NC(CN(CC1)CCN1C(C(CC1)CS1(=O)=O)=O)=O,2 G015-0237,O=C(c1cccn1-c1nnc(N2CCCC2)s1)N(CC1)CCN1c(cc1)ccc1Cl,2 6049-1905,CCN(CC)c1ccc(C2Nc(cccc3)c3NC(CC(C3)c4ccco4)=C2C3=O)cc1,2 G008-5100,CC(C)c(ccc(-c1cc(C)no1)c1)c1S(Nc(cc1)cc2c1OCCO2)(=O)=O,0 SB95-1260,O=C(Cn1nccc1)N(CCC1)CC1N(CCN1CCOCC1)C(C1CC1)=O,2 4130-5221,O=C(c1cc(-c2ccccc2)nc2ccccc12)N(CC1)c2c1cccc2,0 L383-0462,O=C(CSc(cc1)nnc1N(CC1)CCN1c1cccc(Cl)c1)N(CC1)Cc2c1cccc2,2 F6502-1287,O=C(NCCn1c(-c2nccnc2)ncc1)NCc(cc1)ccc1Cl,2 F6514-2618,O=S(Cc1ccccc1)(NC(C1CCOCC1)c1cnccc1)=O,2 Z1368595041,CCC(Nc1cccc(C(N2C3CCCC2CC3)=O)c1)=O,0 F5016-3048,O=C(C(NCC(CC1)CCN1S(C1CC1)(=O)=O)=O)NCCC1=CCCCC1,2 Z1251623575,O=C(c1cc(Cn2cncc2)ccc1)Nc1cc(N2CCCCCC2)ccc1,2 F6619-5119,Clc1cc(Cl)c(CN(CC2)CCN2c2nc(N3CCOCC3)ncc2)cc1,0 Y020-8853,O=C(CC(C(N1C2CCCC2)=O)n2c1nc1c2cccc1)Nc(cccc1)c1F,2 SB24-0065,CC(C)NC(N(CC1)CCC1(CC1)C1n1nnc(C(NC)=O)c1)=O,0 Z748827746,CN(CCCCc1ccccc1)C(c1cc(Cl)c[nH]1)=O,2 Y031-0595,CC(C(NC(C)(C)CC(C)(C)C)=O)Oc1ccccc1,0 Z4945791119,CN(C)C(c1cccc(-c2cccc(C(F)(F)F)c2)c1)=O,0 Z1081897940,CC(C1)C1NC(c1cc(-c2cccs2)nc2ccccc12)=O,2 D470-2290,CCOc(cc1)ccc1S([C@@H](CS(C1)(=O)=O)[C@H]1NCc(cc1)ccc1OC)(=O)=O,0 Z3358004274,CC(C)(CCN1C(C(CC2)C2c(cc2)ccc2F)=O)S1(=O)=O,2 SD69-0540,CCC(C)(C)NC(c1c(C(N[C@H](C2)C(C)C)=O)n2nn1)=O,2 F6758-4605,O=C(CN(CC1C(N2c3ccccc3)=O)CC1C2=O)N(CC1)CCN1c1ccccc1,2 S545-0229,O=C(NC1CCCCC1)N(CCCCC1)C1c1nc(C2CC2)no1,2 S615-0676,CN(C)S(N(CC1)CC1c1nc(CCOCC2CCOCC2)no1)(=O)=O,0 4716-0103,O=C(CSc1nc(cccc2)c2n1-c1ccccc1)N(CC1)CCN1c1nc(cccc2)c2s1,2 Z1372290340,CCN(CCC1CC2)CC2N1C(NC(CC1)CCN1C(c1cocc1)=O)=O,2 F5831-9210,Cc(cccc1)c1NC(NCC1(CC1)c(cc1)ccc1F)=O,0 Z2257317109,Cc1cc(C(N[C@H](Cc2ccccc2)C(O)=O)=O)cc(C)c1OC,0 Z981383154,Cc1cccc(N(CC(C2)C(Nc3cn(Cc4ccncc4)nc3)=O)C2=O)c1C,0 V023-0160,CC(C)CN(CC(C)O)CC(N(CC1)C(COc2ccc(C)cc2)c2c1scc2)=O,0 SC11-0531,CCn1nc(C)c(CN(CCC2)CC2N(CCCN2CCOCC2)C(C2CC2)=O)c1C,0 F5226-0438,O=C(C1CC1)Nc(cc1)ccc1C(NCCNC(c(ccc(F)c1)c1F)=O)=O,0 Z1802409704,CC1(CNC(Nc2cn(-c3c(C)cc(C)cc3)nc2)=O)COCC1,0 Z2964387772,O=C(c(cc1)nc2c1OCCO2)N(CC1)CC1C(F)(F)F,2 V026-9012,CCN(C(C)=C(C(c(cc1)ccc1NC(Cc1ccccc1)=O)N1)C(OC(C)C)=O)C1=S,0 Y042-5567,O=C(c1cc(ccc(Cl)c2)c2s1)Nc(cc1)ccc1N(CCC1)S1(=O)=O,2 Z2149134240,CC(CCC1CC1)NC(C1)COc(cc2)c1cc2F,2 F2274-0585,Cc(c(C)c1)cc2c1ncn2Cc1noc(COC)n1,0 F6752-7916,O=C(C(C1)CN1c1nccn2nccc12)N1CCOCC1,2 Z2380441240,Cc1ncc(CN(C)Cc2c(C(O)=O)scc2)s1,0 Z3497791428,CCOc1ccc(CN([C@@H]2[C@H](C3)O[C@H](C)C2)[C@@H]3C(O)=O)cc1,0 F6514-8777,O=C(Cn(cc1)c2c1cccc2)NCc1cc(-c2cnccc2)ncc1,2 F6609-4539,COCCN(C1=O)C(SCc2cc(OC)ccc2)=Nc2c1scc2,0 F1836-0174,Cc1cccn2c1nc(CNC(c(c(F)ccc1)c1Cl)=O)c2,0 SB52-0101,CC(C)c1nc(C(C2)N(C)CC2(CC2)CCN2C(N2CCOCC2)=O)no1,2 Z4873171776,Cc(cc(cc1)NC(CC2(CCC2)C([O-])=O)=O)c1C(N)=O,0 F6748-8269,Cc1cnc(N2CC(COc(nccc3)c3Cl)CCC2)s1,0 S593-0250,COc1cccc(S(N(CCC2)C2c2noc(COCc3ccccc3)n2)(=O)=O)c1,0 SC03-0779,Cc1noc(C)c1S(N(CC1)CCC1OCCc1noc(C2CC2)n1)(=O)=O,2 D051-0015,Cc1c(CN(C(CC2)CS2(=O)=O)C(COc(cc2)ccc2Br)=O)scc1,0 S692-2275,CCn1ncc(C(N(CCC2)CC2n2c(COC)ncc2C)=O)c1,0 F6451-0102,CCCc1c(C(NCC(c(cccc2)c2OC)OC)=O)snn1,0 Z2992086624,CN(c(cc1)ccc1C(N)=O)S(c1ccnn1CC1CCC1)(=O)=O,0 F6438-3197,CN(C)c1nc(CNC(Cc2noc3c2cccc3)=O)nc(OC)n1,2 S721-1005,O=C(CCC1CCCC1)N(C[C@H](C1)Oc2cnccc2)[C@@H]1C(NC1CC1)=O,2 S812-0538,CCn(cc1)nc1C(N1C(C2CCCC2)c2nccn2CCC1)=O,2 Z973036558,COc(c1ncccc11)ccc1S(N(CCN1)C(c2ccccc2)C1=O)(=O)=O,0 V011-3610,Cc1noc(C)c1S(N(CCC1)CCN1c(n1ncnc1nc1)c1-c(cc1)ccc1OC)(=O)=O,2 Z2482974234,OC(C(c1cccc(Cl)c1)N(CCC1)CC1n1ncnc1)=O,0 Y020-3599,COc(ccc(CCN(C=Cc1nc2ncnn2c(-c2ccccc2)c11)C1=O)c1)c1OC,0 F6747-5426,COCc1nsc(N2CC(Cn3ncc(Br)c3)C2)n1,0 Z1081916346,O=C(c(cc1)ccc1S(C(F)(F)F)(=O)=O)N(CCC1)CC1c1ncc[nH]1,0 F6752-3502,O=C(C1CC1)NC(CCC1)CN1c1nc2ccccc2nc1,2 F6443-5480,CC(C)(C)C(NCc1cc(Oc2ncccc2)ccc1)=O,0 F6360-9418,O=C(Cn1nccc1)N(C1)CC1Oc1cnccc1,2 D473-2146,COc(cc1)ccc1-c1cc(C(NC2CC2)=O)nn1C(CC1)CS1(=O)=O,0 F2829-0427,CS(c1ccc(CC(N(CC2)CCN2c2nc(c(F)ccc3)c3s2)=O)cc1)(=O)=O,0 F6745-8780,Clc1cnc(N(CC2)CCN2c2nc(cccc3)c3o2)nc1,2 Z1643424340,CC(C)(C)CCN1Cc2nc(C)cn2CC1,0 Z1868701598,O=C(C(Cc1ccncc1)NC1=O)N1c(cc1)ccc1-c1ccccc1,2 Z4662079506,CC(CC(C)C1)CN1S(c(cc1)nc(C)c1C(O)=O)(=O)=O,0 F6560-5707,Cn1ncc(-c2cc(CNS(c3c(C(F)(F)F)cccc3)(=O)=O)cnc2)c1,0 Y502-7186,Cn1ncc(S(N(CCC2)CC2C(Nc2cn(Cc(ccc(F)c3)c3Cl)nc2)=O)(=O)=O)c1,2 F6473-6253,CC(O1)=CC(OC(C2)CN2C(CSC2CCCC2)=O)=CC1=O,2 G933-0068,CC(c1ccccc1)NC(C1=Nc(cccc2)c2N(C)C1=O)=O,2 F0599-0221,CCOC(c(cc1)ccc1NC(CSc1nccn1-c1cc(OC)ccc1)=O)=O,0 F5834-3891,CCCS(N(CC1)Cc2c1ccc(NC(Nc(cc(cc1)Cl)c1OC)=O)c2)(=O)=O,0 CM4297-7495,O=C(c(cccc1)c1OC(F)(F)F)N(C1)CC1n1c(-c2cnccc2)nnc1,0 Z1334196262,CN(C(c1cc(occ2)c2s1)=O)c1c[nH]nc1,2 F9994-8280,OC(CN(CCN1)C1=O)Cn1c(ccc(F)c2)c2c2c1ccc(F)c2,2 Z1449626644,CCc1c(-c2csc(C(CCC3)CN3C(C)=O)n2)[nH]c(C)c1C(C)=O,2 SA85-0228,CC(C)CN(CC(CN(C1)S(c(cc2)ccc2F)(=O)=O)O)C1=O,2 Y502-6516,CCn1nc(C(C)NC(C(CCC2)CN2S(c2cn(C)nc2)(=O)=O)=O)cc1,0 F6438-7212,CN(C(CCC1)C1F)C(c1nccc2ccccc12)=O,2 F6412-1420,COc(cccc1)c1OCC#CCNC(c1cc(cccc2)c2o1)=O,2 Z2936883563,CN(CC(C1)c2nc(-c(sc3c4cccc3)c4Cl)no2)C1=O,2 F3406-7206,CC1=C(C)N=CN(CC(Nc(cc2)c(C(F)(F)F)cc2Cl)=O)C1=O,0 F5627-0006,Cc1nc(N(C)C)cc(NCCNS(C)(=O)=O)n1,0 S699-0913,CN(CCc1noc(C(C2)CN2C(CCC2CCCC2)=O)n1)C(C1CCOCC1)=O,2 G411-0181,O=C(COc(cc1)ccc1Cl)NC(C(Oc1c2cccc1)=O)=C2NC1CCCC1,2 Z1055221258,O=C(NCC(c(cc1)ccc1F)N1CCOCC1)N(CC1)CC1N1CCCC1,2 SB94-0882,O=C(CCn1nccc1)N1CCC(CN(CC(C2)C(NCC3CC3)=O)C2=O)CC1,2 F3382-4626,CC(C)(C)S(c(cc1)nnc1NCc(cc1)ccc1Cl)(=O)=O,2 Z1733843121,CC(CC1)(CN1C(NC(CCCc1ccccc1)c1ccccc1)=O)O,2 Z1148762840,CCc1c(C(N(CC2)CC2(C(F)(F)F)C(O)=O)=O)scc1,0 G639-1720,O=C(C(CCC1)CN1C(c1n[nH]c(-c2ccncc2)c1)=O)N(CC1)CCN1c(cc1)ccc1F,2 F0624-0020,COc1cccc(C(OCN2N=Nc(cccc3)c3C2=O)=O)c1OC,0 F3395-1020,O=S(N(CC1)CCC1N(CC1)CCN1c1ncc(C(F)(F)F)cc1)(N1CCOCC1)=O,2 F2455-0616,CN(c1nccc(Nc(cc(cc2)Cl)c2OC)c1C(N1C)=O)C1=O,0 SD31-0129,O=C(c1nn(CCNC(NC2CCCCC2)=O)c2c1COCC2)N1CCOCC1,2 F6482-7679,O=C(c1cnc(C(F)(F)F)cc1)NCc1cccnc1-c1cccs1,0 Z648582342,CC(C(Nc(cccc1)c1C(C)=O)=O)N1CCC(CC(N2CCCC2)=O)CC1,2 F5833-7242,Cc1cc(C(Nc2cc(N(CCC3)C(COC)=O)c3cc2)=O)c(C)o1,2 SA58-1245,O=C(CN(c(cccc1)c1O1)C1=O)N1C(CCc2noc(-c3ccccc3)n2)CCC1,2 Z2913357739,Cc(n1C)nnc1N(CC1)CCN1C(Cc1nnc(-c2ccccc2)o1)=O,2 F455-0068,CCc1ccc(C(C(c2ccccc2)=C2O)N(Cc(cccc3)c3Cl)C2=O)cc1,0 D505-1228,CCN(C(C1=C2CCCC1)=O)N=C2c(cc1)cc(S(Nc(cc2)cc(OC)c2OC)(=O)=O)c1OC,0 D473-0933,CC(CS(N1c(cc2)ccc2C(NCCC2=CCCCC2)=O)(=O)=O)C1=O,0 G786-0416,O=C(c(cc1)cc2c1OCCO2)N(CC1)CCN1c1nc(c(F)ccc2)c2s1,0 Z1610644108,Cc1cc(NC([C@H](CCC2)N2C(N)=O)=O)nn1-c1cc(C)cc(C)c1,0 G857-2053,O=S(c(cc1)ccc1F)(N(CCn1c2ccc1)C2c(cccc1)c1F)=O,0 V022-1319,CC(C)n1c(C(N(CC2CC2)C(N2c3ccccc3)=O)=O)c2nc1,2 F1274-0216,CC(C)(C1)CC(NC(N(Cc2ccccc2)C(N2)=O)=C(C3c4cccs4)C2=O)=C3C1=O,2 F6523-0269,Cc(c(S(NC(CC1)CCN1c1nc(C)nc(C(F)(F)F)c1)(=O)=O)ccc1)c1Cl,0 V023-9624,Cc(ccc(S(Nc(cc1)cnc1N1CCN(Cc(cc2)ccc2N(C)C)CC1)(=O)=O)c1)c1Cl,2 5144-0081,CCC(C)C(C(O)=O)Nc1c(c(CCC2)c2s2)c2ncn1,0 S988-0493,CCS(N(C[C@@H]1CN(C2)C(Cn3nc(C)cc3)=O)C[C@@]12c1nc(C)no1)(=O)=O,0 D351-0063,CC1N(CC(Nc2nc(-c(cc3)ccc3Cl)nn22)=CC2=O)CCCC1,2 F0196-0128,CCc(c(O)c1)cc2c1OC(C)=C(c(cc1)cc3c1OCO3)C2=O,2 F5860-4150,COC(C(CC(C1)C2)(CC1C1)CC12NC(c1nccnc1)=O)=O,2 F6617-2083,CC(C)(c1cn(Cc2cccc3ccccc23)nn1)O,2 F6284-0552,CC(C)(C(NCCc1cnc(-c2ccccc2)nc1)=O)Oc(cc1)ccc1Cl,0 SC04-0548,CC(C)Cc1nc(CCOC(CCC2)CN2C(c2cncnc2)=O)no1,2 F6435-2768,COc(cccc1)c1S(N1C(CS(c2ccccc2)(=O)=O)CCC1)(=O)=O,0 Z1482067904,O=C(Cc(ccc(F)c1)c1F)NS(c1cc(-c2nnco2)ccc1)(=O)=O,0 F6430-0883,Cc1cc(C)nn1-c1cc(NC(Cn2nnc3c2cccc3)=O)ncn1,2 Z3593956526,Cc(occ1)c1-c1cc(NC(N(C)C2CCN(C)CC2)=O)no1,2 Z1522902328,CN(CC1NC(c2c(-c3ccccc3)ocn2)=O)Cc2c1cccc2,2 D356-2476,CCN(CC1)CCN1C(C(CCC1)CN1S(c1cccs1)(=O)=O)=O,2 Z2394920551,CC(C)(C)c(c(C(Nc(cc1)cnc1NC)=O)c1)nn1-c1ccccc1,0 Z1185127999,CC(C)C(N(CC1)CCC1C(NC1(CCOCC1)c1ccccc1)=O)=O,2 F6411-5033,CCOc1c(CNC(C(CC2)CCN2S(N2CCCC2)(=O)=O)=O)cccc1,0 Z1261549121,Cc1c(cc(cn2)C(N3CC(Cc4ccccc4)CC3)=O)c2n[nH]1,2 T842-0100,Cn1c(cncc2)c2nc1C(CC1)CN1C(c1nccc2ccccc12)=O,2 F6792-4217,Cc(c(C)nc1ncnn11)c1N1CCC(COc(nc(C)nc2C)c2F)CC1,2 F6512-2046,O=S(C1CC1)(NCc1nc(C2CCCCC2)cs1)=O,2 Z600506078,CC(Nc(cc1)ccc1C(NCc1cccc(C(O)=O)c1)=O)=O,0 S512-0099,O=C(c1nc2ccccc2cc1)N(CC1)CC1Oc1ccccc1,0 Z3362781280,Cc1ccc([C@@H](CNCc2nn(C)cc2Br)O)cc1,0 S692-1283,Cc1cnc(-c2ccncc2)n1C1CN(Cc2c(C)ncs2)CCC1,2 E852-4410,CCCN(C(C)(Cn(c1c2)nc2C(NCCc(cc2)ccc2SC)=O)C(NC2CCCC2)=O)C1=O,0 Z1911295569,CCCN(C)CC(CC1)CN1S(c(cc12)cnc1onc2-c1ccccc1)(=O)=O,0 F3085-0057,O=C(COc(cc1)ccc1Cl)Nc(cccc1)c1C1=Nc(cccc2)c2NC1=O,2 6214-0558,CC(C)c1ccc(CN(C(CC2)CS2(=O)=O)C(COc(cc2)ccc2Br)=O)cc1,0 E941-0318,Cc1ccc(ccc2c3[nH]c(C(NCCCN(CC4)CCC4N4CCCCC4)=O)c2)c3n1,2 F6471-3733,Cc1noc(C)c1CC(N(C1)CC1Oc1nccs1)=O,2 Z4910022845,Cc1coc(-c2c(C)ccc(NC(c3ccc(F)s3)=O)c2)n1,0 Z1561134091,[O-][N+](c(cc1)cc2c1[nH]cc2C(N(CCc1ccc2)Cc1c2F)=O)=O,0 F6550-1819,COc(ccc(CNC(N(C(CC1)C2)C1CC2F)=O)c1)c1OC,0 F6496-1447,O=C(CN(C=Nc1c2cccc1)C2=O)NCc1ncnc(C2CC2)c1,2 SA87-0974,COCCN(CC(CNC(CCN(c(cccc1)c1O1)C1=O)=O)OC1)C1=O,2 F5854-0320,CCOc(cc1)ccc1C(N(CCc1ccccc1)Cc1ncccc1)=O,0 1574-1735,CC(C)(C1)n2c(-c3nc4ccccc4cc3)nnc2-c2c1cccc2,2 Z1197107236,CCC(N(CCCC1)C1C(NS(c1cccs1)(=O)=O)=O)=O,2 Z2213658924,CS(CC(CCC1)CN1C([C@@H](C1)[C@H]1C1CC1)=O)(=O)=O,0 F6564-4330,COc(cc1)ncc1NC(C(CCC1)CN1c1nnc(C2CC2)cc1)=O,2 C274-8410,O=C(C(CCC1)CN1S(c1cccc2nonc12)(=O)=O)N(CC1)Cc2c1cccc2,2 Z644706498,C(c1nnnn1-c1ccccc1)N(CC1)CCC1N1CCCCC1,2 S233-1772,COCCN([C@H](CCC1)[C@]1(CNC(COc(cc1)ccc1F)=O)CC1)C1=O,2 Z2159810266,C[C@@H](c1nc(-c2cc(C(F)F)ccc2)no1)Oc(cc1)cnc1Cl,0 Y020-0192,Cc1ccnc(SC(CC(N2c(cc3)ccc3F)=O)C2=O)n1,0 H025-0346C,CN(CC1)Cc2c1n(CCc1cnccc1)c1c2cc(C(F)(F)F)cc1,2 8010-7275,CC(C(C(c(cccc1)c1Cl)N(Cc1ccco1)C1=O)=C1O)=O,0 S556-0921,O=C(c1cocc1)N(C1)CC1Oc(cc1)ccc1-c1noc(C2CCOCC2)n1,2 G501-0369,CN(C)c1ccc(C(CNS(c(cc(cc2)OC)c2OC)(=O)=O)N(CC2)c3c2cccc3)cc1,0 Z4448320798,CC(CCCC1)C1(C)NC([C@@H](C[C@@H]1O)[C@H](CN)C[C@H]1O)=O,2 D492-0029,COc1ccc(Cn2nccc2NC(c2noc(-c(cc3)cc4c3OCCO4)c2)=O)cc1,2 Z1715384344,CC(CNC(CCNS(c1cnccc1)(=O)=O)=O)(C(O)=O)O,0 Z1603385133,Nc1nccnc1C(NC(CC1)(C(O)=O)c2c1cccc2)=O,0 Z3032568284,Cn1nnc(CNC(C(C2)(C3)CC23C(O)=O)=O)c1C(F)F,2 SC69-0889,O=S(Cc(cc1)ccc1Cl)(N(C1)CC2(CCCC2)C1c1nncn1C1CC1)=O,2 F6807-7007,CCOC(N1CCN(Cc2csc(-c3ccccc3)n2)CC1)=O,0 Z1183697499,O=C(C(C1)ON=C1c(cc(cc1)F)c1F)NCc1cc(-n2cncc2)ncc1,2 Z3792483598,O=C(c(ccc(F)c1)c1Cl)N[C@@H]1CN(Cc2ncccc2)CCC1,0 F6571-5836,CC(Cc1csc2c1cccc2)NC(N(CCN1)C1=O)=O,2 Z1174686118,CC(C)n1c(C(CCC2)CN2C(c(cc2)cnc2C(N)=O)=O)nnc1,0 F6262-1771,CCOc1cc(NC(C(C=C2)=NN(Cc3cccc(F)c3)C2=O)=O)ncn1,2 Z2497994571,CC(C)n1nc(C)c(C(NS(C2[C@@H](CC3)C[C@@H]3C2)(=O)=O)=O)c1,2 F537-0003,O=C(Cc(cccc1)c1Br)N(CC1)CCN1S(c(cc1)cc(N2)c1OCC2=O)(=O)=O,0 F6374-0189,O=C(c(s1)ccc1Cl)N1CCC(CSc2ncccc2)CC1,2 SD60-0009,COCCC1COC(C2)(CN2C(Cc2cc(OC)ccc2)=O)C1,0 Z1748815994,OC(CC1)(CCN1C(c(cccc1)c1-n1nccc1)=O)C(F)F,0 F6481-0041,O=C(c1ccccc1)c(cccc1)c1C(N(CC1)CCSC1c1ccccc1)=O,2 Z1416549669,CCCC(C)c1n[nH]c(NS(c2cc(C(OC)=O)ccc2)(=O)=O)c1,0 Z3016340878,CCS(NCc1cn(-c2c(C)cccc2C)nn1)(=O)=O,0 F6231-0423,Cc1cc(C)nn1C(C=C1)=NN(CCNC(Cc2noc3c2cccc3)=O)C1=O,2 Z2945536701,Cn1ncc(N(CC(CC2)C(Nc3cccc(Cl)c3)=O)C2=O)c1,0 Z844454904,Cc1ccc(CN(C)C(C2NCCc3c2cccc3)=O)cc1,2 F5007-0046,Cc1nn(C(CC2)CS2(=O)=O)c(NC(c(cc2OC)cc(OC)c2OC)=O)c1,2 SC46-0274,Cc1cc(C)nn1CCC(N(C1)CC2(CCCC2)C1c1nc(C2CC2)n[nH]1)=O,2 Z1835890994,Clc1nc(NCc2cocc2)c(ccs2)c2n1,2 J006-0886,CCOc(cc1)ccc1-c1n[nH]cc1CN(CCC1)C1c1noc(C)c1,0 F6764-1573,Clc1cc2ccc(C(CC3)CCN3c3nc(C4CC4)ncc3)nc2nc1,2 J107-0304,O=C(c1ncccc1)NC(CCC1)c2c1c(cccc1)c1[nH]2,2 Z3774488161,OC(C(C1)CN(Cc2noc(-c(cccc3)c3Cl)c2)C1=O)=O,2 F3386-2945,CCOc(cc(C)cc1)c1S(NCC=C)(=O)=O,0 Z1529216053,CCCC1OCCN(CC(N2)=Nc(sc3c4CCC3)c4C2=O)C1,2 F6521-4187,OC(CNC(c1cc(cccc2)c2o1)=O)c1csc2c1cccc2,0 Z1124736270,CC(c1nc(-c(cc2)ccc2OC)no1)O,0 3384-8076,Cc1cc2nc(-c3ccccc3)c(NC(C3=Cc(cc(cc4)Br)c4OC3=O)=O)n2cc1,0 F6517-4147,OC(CNC(c1cccs1)=O)c(cc1)ccc1-c1cccs1,2 F2964-3397,CNC(CSc1ncc(-c(cc2)ccc2OC)n1-c1cc(C(F)(F)F)ccc1)=O,0 F6515-2071,O=S(c1cc(C(F)(F)F)ccc1)(NCc1c(-c2ccco2)nccc1)=O,0 F6125-2094,Cc1nc(-c2cc(NC(C(C3)CN3C(COc(cccc3)c3F)=O)=O)ccc2)cs1,2 F5033-1470,Cc1cc(CN2CCC(CNC(Nc(cccc3)c3Cl)=O)CC2)c(C)o1,2 F3398-2080,O=C(CN1N=C(c2cc(-c(cc3)ccc3F)nn2C=C2)N2C1=O)Nc1c(C(F)(F)F)cccc1,2 Z2996673199,COC1(CCN2Cc3cccc(C(O)=O)c3OCC2)CCC1,0 F6471-1175,CS(N(C(CC1)C2)C1CC2NC(CCc(cc1)cc(C(F)(F)F)c1Cl)=O)(=O)=O,0 S693-1185,Cc1cnc(-c2ccncc2)n1CC1CN(Cc2ccc(C)o2)CCC1,2 F5618-0055,COc(cc1)ccc1OCC(c(cc1OC)c(CC2)cc1OC)N2C(c1cnccc1)=O,2 D398-0137,O=C(Cn1nc(C(F)(F)F)c2c1CCCC2)N(CCC1)C1c(cc1)ccc1Cl,2 F535-0040,Cc1c(C(N2CCCC2)=O)c(S(NCCC(NC2CCCCC2)=O)(=O)=O)c(C)[nH]1,2 Z1014376926,O=C(C1CCCCCC1)Nc(cc1)cc(N2)c1NC2=O,2 M339-1348,O=C(C1Oc(cccc2)c2OC1)Nc1cccc(OCc2nnc(-c(cc3)ccc3Cl)o2)c1,0 Z2627968410,COc1ccc([C@@H](C2)[C@H]2C(N2Cc3nncn3CC2)=O)cc1,2 Z1263171552,Cc1c(C(C2)CC2N(Cc(cc2)ccc2C(N)=O)C2CC2)cccc1,2 F6724-5267,Clc1cnc(NCC(c2cscc2)n2nccc2)nc1,2 SC23-0524,CCc1ccc(CN(C2)CC2N(CCc2noc(C3CCC3)n2)S(C)(=O)=O)cc1,2 SB42-1146,CC(C)C[C@@H](C(N(CCOC)C[C@@H]1CN2CC(NCc3ccncc3)=O)=O)N1C2=O,0 V020-7472,Fc(cc1)cc(F)c1Oc1nc(N2CCCCC2)nc2c1CN(Cc1ccco1)CC2,0 E612-0823,CC(C)C(C(NCC1CCN(Cc2c(C)ccc(C)c2)CC1)=O)N(Cc1c2cccc1)C2=O,0 Z2256354319,CCc(cc1)ccc1C(NC(C)(CC(O)=O)C(C)C)=O,0 F6432-0220,Cn(c(C(Nc1ncnc(-n2ncnc2)c1)=O)c1)nc1-c1ccccc1,2 F6515-0578,O=C(c(s1)ccc1Cl)NCc1cc(-c2cccs2)ncc1,2 G855-2104,O=C(C1CCC1)N(CCC1)c(cc2)c1cc2S(N(CC1)CCN1c(cccc1)c1F)(=O)=O,0 F6807-5382,COc1cc(CCN(CC(CN2)OCC2=O)C2)c2cc1OC,2 7591-0890,CC(C)CN(C(CC(C)(C)C1)=C(C2(C(F)(F)F)NC(C3CCCCC3)=O)C1=O)C2=O,2 S724-0401,O=C(C1CCCC1)N(C1)CC1n1nnc(C(N2CCCC2)=O)c1,2 F6561-1186,CN(C=CC=C1C(NCc2cncc(-c3ccco3)c2)=O)C1=O,2 Z1603513950,OC(C(Cc1ccccc1)CNC(c1cc2cccnc2cc1)=O)=O,2 F383-0027,Cc(ccc(CN(C(C1C2CCCC1)=O)C2=O)c1)c1S(N(C)Cc1ccccc1)(=O)=O,2 Z3043664271,CC(c(cc1)ccc1C(N1CCN(C)C2(CCOCC2)CC1)=O)=O,0 Z1616674532,CC(C(NC(C(C1)O)c2c1cccc2)=O)c1c(C)n(CC(F)(F)F)nc1C,0 F3398-3609,O=C1N(C=CC=C2)C2=NC(CN(C=Nc2c3scc2-c(cc2)ccc2Br)C3=O)=C1,2 8010-8404,CN(C)c1ccc(C(c2c3)NCCc2cc(OC)c3OC)cc1,0 SB11-0498,OC(Cn1nnc(C(NC2CCCC2)=O)c1)(CC1)CCN1C(c1cscn1)=O,2 F5857-6735,OC1(CNC(C(NCCC2=CCCCC2)=O)=O)C=CCCC1,2 Z1743496224,O=C(c1ncncc1)NC(C1CCCC1)c(cccc1)c1F,2 Z2911745044,Cn1nc(C2CC2)c(C(N(CC2)Cc(cc3)c2cc3C(O)=O)=O)c1,2 Z1870058502,CC1(C)C2OCCC2C1NC(C(C1)C(c2c(C)n(C)nc2)N(C)C1=O)=O,2 F6411-1213,Cc(cc1)cc2c1OCCN2C(CSc1nccnc1-n1nccc1)=O,2 Z815438746,NS(c1cn(-c(cc2)ccc2F)nc1)(=O)=O,0 F2380-0030,Cc(cc1)ccc1S(N(CCC1)C1C(N1CCOCC1)=O)(=O)=O,2 F6561-7966,Cc1c(C)c(S(NC2CN(Cc3cscc3)CC2)(=O)=O)c(C)c(C)c1,2 F6482-4009,COCCNC(N(CC1)CCC1n1nccn1)=O,2 Z2683114799,CCNc(ncc(S(N(CC1)CC11COCC1)(=O)=O)c1)c1Cl,2 Y020-3995,Cc(nc(N1CCCCC1)nc1)c1C(N=C(N1)N(CC2)CCC2C(N)=O)=CC1=O,2 Z2012010128,Cc1nn(C)c(-n2nccc2)c1C(NC(CC1)COc2c1cccc2)=O,2 F6471-9016,Cn1c(S(C(C2)CN2C(c2cscc2)=O)(=O)=O)ncc1,2 F6438-3708,CCOc(cccc1)c1NC(NCc1nc(N2CCCCC2)nc(N(C)C)n1)=O,0 E958-0424,O=C(C(CCC1)CN1c1nnc(-n2cccc2)s1)NCCCN(CC1)CCN1C1CCCCC1,2 Z1328985202,O=C1N(Cc2noc(-c3ccccc3)c2)C=Nc2cccc(F)c12,0 Z2958586847,O=C(c1c2occc2cc(F)c1)NCc1nnc(C2CC2)o1,2 F6556-4275,CCN(CCN(C(NCC(c1cc(cccc2)c2o1)OC)=O)C1=O)C1=O,0 Y010-1300,Cc1cccc(CC(CC(N2c3ncccc3)=O)C2=O)c1,2 Z3025359883,N#Cc1nccc(N[C@@H]2[C@H](CCO)CCCC2)c1,2 Z4156906706,CC(C)c1noc(CCNC(N(CCC2)[C@@H]3[C@H]2N(C)CC3)=O)n1,2 Z2714492174,CCc(cccc1)c1C(N(CC1)CCC1N1CCOCCC1)=O,2 SA49-0288,CCn(cc1)nc1C(N(C1)CC11OCC(CC(NCc2ccncc2)=O)C1)=O,2 S639-3635,CN(C)C[C@@H](CN(C1)c2ncccn2)[C@H]1NC(c1cc(C#N)ccc1)=O,0 Z3802059595,Cc1nnc(-c2cccc(NC(CC3)CCC3(c3ccncc3)C#N)c2)n1C,2 F6522-0204,O=C(c1cocc1)NCc1cc(-c2ccco2)cs1,2 8016-5744,O=C(CSC(N1c2ccccc2)=Nc(scc2-c(cc3)ccc3F)c2C1=O)NCC1OCCC1,2 F6573-6311,COc1cc(OC)c(CCC(N(CC2)CCC2(C2)C2(F)F)=O)cc1,0 Z2846172569,CCS(NCCn1nnc([C@@H](c2ccccc2)O)c1)(=O)=O,0 Z2573451320,CCCC(C(O)=O)NCC(NCCc1ccc(C(C)(C)C)cc1)=O,0 Z2618676689,CN(C)C(C(CC1)CCN1C(c1cc(C2CCCC2)ccc1)=O)=O,2 Z4661326786,C(c1noc(C2CCCC2)c1)Nc1c(ccs2)c2nc(-c2ncccc2)n1,2 Z2614239833,Cc1nc(CCCC2)c2c(N2CC(Cn3nncc3)CC2)n1,2 Z2433941297,O=C(CC1NCCC1)Nc1nc(-c2cc(CCC3)c3cc2)cs1,2 S903-1488,CN(C)C(N(CC1)CCC1c1nnc(C2)n1CCN2C(c1nccc2ccccc12)=O)=O,0 Z1953451464,CS(C1(CCC1)C(NCc1ncccc1O)=O)(=O)=O,0 Y043-7745,c1(sc(nn1)C)NC([C@@H](NC(N1CCN(c2ccc(cc2)Cl)CC1)=O)C)=O,0 Z1184504537,OC(CNC(Nc1cc(Oc2ccncc2)ccc1)=O)c(cc1)ccc1F,0 V026-8813,O=C(c1cccs1)N(CC1)CCN1c1nc(C2CC2)nc2c1cnn2-c1ccccc1,2 F6559-7655,O=C(NC1CCOCC1)N(CC1)CC1n1c(cccc2)c2nc1,2 F6476-6327,O=S(N(CC1)CC1Oc(ccnc1)c1Cl)(N1CCOCC1)=O,2 Z2959359576,COc1nccc(C(N(CCC2)Cc3c2c2cccc(F)c2[nH]3)=O)n1,2 SA85-0299,CC(C)CN(CC(CN(C1)C(c2noc(Cn3ncc(C)c3)c2)=O)O)C1=O,2 Z1555077589,CC(c(c(CC1)ccc2)c2F)N1C(Nc(cccn1)c1OCC(F)F)=O,0 Z2593978894,CC(C)c(cccc1)c1-n1nc(C(N(CCCC2)C2C2CNCCC2)=O)nc1C,2 Z2394215985,CC(COC)C(N(Cc1cscc1)C(C1)C11CCNCC1)=O,0 Z3687013611,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(Cc1cc(C(F)(F)F)co1)=O,0 SB36-0542,O=C(c1cn(C[C@H](C2)N(Cc3c[nH]nc3-c3ccccc3)CC2(F)F)nn1)N1CCCC1,2 V021-0906,CCCNC(CN(CC1)CCN1c(cc1)ccc1Cl)=O,0 SB39-0417,CCS(N(CC1NC(c(cc2)cc(F)c2OC)=O)CC2(CCCC2)NC1=O)(=O)=O,2 V019-3281,CN(C)c1c(CN(CC2)C(c(ccc(F)c3)c3F)=O)c2nc(N(CC2)CCN2c(cc2)ccc2F)n1,0 Z2755373998,CC(CN(C1CC1)C(c1c(C)nc(C2COCC2)s1)=O)C(O)=O,2 Y031-7288,CC(C)(C)C(N(CCC1)CC1C(NC1CCCCCC1)=O)=O,2 F0326-0493,COC(C(SCC1)=C1NC(c(cc1)cc(OC)c1OC)=O)=O,2 F6448-1881,O=C(CCC(F)(F)F)Nc1cn(C2CCOCC2)nc1,0 F3259-0498,CN(c1c(C(N2C)=O)n(CN3CCN(CCO)CC3)cn1)C2=O,2 Z1767395343,Cc(n(C)nc1)c1C(NCC1CCN(CC(F)(F)F)CC1)=O,0 Z2906555765,CCn1c(NC(c2cc(C3CC3)nn2CC)=O)nc2c1ccc(C#N)c2,0 F5795-1992,CC(C1)OC(C)CN1S(c1c(C)oc(C(Nc2c(C)n(C)nc2C)=O)c1)(=O)=O,2 S554-0053,CC(C(NCc1nnc(cc2)n1nc2-c1ccccc1)=O)c1ccccc1,2 G845-0109,CC(C1)N(C(CS(c2cccc3nsnc23)(=O)=O)=O)c2c1cccc2,2 E002-1115,CCC(c1ccc(C)n1CC1)N1C(Nc(c(OC)c1)cc(Cl)c1OC)=O,0 F6469-0864,Cc1nc(-c(cccc2)c2NC(COc(cc2)cc3c2OCO3)=O)cs1,2 G869-0692,Cc1nc(Nc(cc2)ccc2NC(C2CCCC2)=O)nc(N2CCOCC2)c1,2 F6549-5060,CC(C)(C)OC(N1CCC(CC(N(CCC2)CC2c2cn(C)nc2)=O)CC1)=O,2 F6389-0460,O=C(c1nccc(-n2cccc2)c1)NCCc1ccncc1,2 Z1119782417,O=C1NC(CN(CCC2)CC2c2ccn[nH]2)=Nc2c1cnn2-c1ccccc1,2 T505-0520,CC(C)NC(N1C(CCn2nnc(COc3ccccc3)c2)CCCC1)=O,0 F2468-0170,CSCc1csc(NC(c2cccc3ccccc23)=O)n1,2 SA69-0269,CC(CCC1)(CN1C(NC1CCCC1)=O)c1noc(C2CCOCC2)n1,2 S892-0373,Cn1nc(C2N(Cc3cc(F)cc(F)c3)CCCC2)c2c1CCOC2,2 F2605-0174,Cc1cccc(CC(NCCSc2ncc(-c3ccccc3)[nH]2)=O)c1,2 Z4429216416,Cn1c(c(C(N)=O)cnc2)c2nc1C(F)(F)F,0 F6476-4406,O=C(N(CC1)CC1Oc1nc2ccccc2nc1)OC1CCOCC1,2 Z1133531929,CC(C)(C1)C(c2ccccc2)N1C(NCC(CC1)CCN1C(C)=O)=O,2 F6502-2365,COc(cc1)cc(C(NCCn2c(C3CC3)ncc2)=O)c1Br,0 Z1514310016,CCNC(N(CC1)CCN1C(c1nc(OC(C)C)ccc1)=O)=O,0 F6554-6236,COC(C(C1)C1(CC1)CCN1C(NCc(cc1)ccc1Cl)=O)=O,0 Z3465306262,CC(N1)=Cn2nnc(C(NCCc(cccc3)c3Cl)=O)c2C1=O,2 Z1974458313,CS(c1ccc(CC(N2Cc(cccc3F)c3OCC2)=O)cc1)=O,0 SC74-1441,CNC([C@H](C[C@H]1c2nc(-c3ccccc3)no2)C[C@@H]1NS(C1CC1)(=O)=O)=O,2 F5302-0177,Cc1nn(C)cc1C(Nc(cc(cc1)Cl)c1Cl)=O,0 Z4909204104,CC(C)c(cc1)ccc1-n1nnc(C(C2)CN2C([C@@H](C2)C2(F)F)=O)c1,2 F6452-0427,CC(CNC(C(NCc(cccc1)c1OC)=O)=O)(c(cccc1)c1F)OC,0 F2792-0117,Cn1nnc2c1ncnc2NCCc1cccc(OC)c1,2 Z4158195334,Cc1nccc(N2[C@@H](COc3ccccc3)CCC2)n1,0 S664-0038,COC(CC1)C1(CC1)CCN1C(c1nccc2ccccc12)=O,2 SC91-0387,COc1cccc([C@@](C[C@H]2CC3)(CN2C3=O)C(NCCc2ccccc2)=O)c1,0 D727-0185,Cc1nc(cccc2)c2n1Cc1nnc2sc(CCN(C(c3c4cccc3)=O)C4=O)nn12,2 F6685-9087,CN(C=NC(N1CC(COc(nccc2)c2Cl)CCC1)=C1)C1=O,0 4428-0441,CC(NC(NC1c2cn(-c3ccccc3)nc2-c(cc2)ccc2Cl)=O)=C1C(OCC=C)=O,0 F0688-0085,O=S(c1cccs1)(NCC(c1cnccc1)N(CC1)CCN1c(cc1)ccc1F)=O,2 3966-1288,CC(C)(C1)OCCC1C(CCN(C(c1c2cccc1)=O)C2=O)c1ccccc1,0 F2323-0123,Cc1c(C(NCCn2ncc3c2N=CN(Cc2ccccc2)C3=O)=O)c(-c(cccc2)c2Cl)no1,2 F6525-2931,Cn(c(CNC(c(cc1)ccc1C(OC)=O)=O)c1)nc1-c1cnccc1,0 Z1409421003,Cn1c(CNC(c2cc(-c(cc3)ccc3Cl)cnc2)=O)nnc1,2 Z2951849549,CC1c2n[nH]cc2CN(CC(Nc(cc(C)cc2)c2OC)=O)C1,0 F6246-3389,Cc(c(S(NCCN(C1=O)N=C(C2CC2)N1c1ccccc1)(=O)=O)ccc1)c1Cl,2 C583-0022,CCOc(cc1)cc2c1nc(NC(C(CC(C)C)NS(c(cc1)cc3c1nc(C)s3)(=O)=O)=O)s2,0 Z748562638,O=C(C(CC1=O)CN1c(cccc1)c1Cl)Nc1cn(CC2OCCC2)nc1,0 T502-0573,CCn1ncc(S(N(CC2)CCC2(C(N2CCOCC2)=O)F)(=O)=O)c1,2 F6525-0552,CN(C(C=C1)=O)N=C1C(N1Cc2c(CCC3)c3nn2CC1)=O,2 D337-1166,CC(C1)Oc(cc2)c1cc2-c1cc(C(Nc2c(C(Nc3cc(C)ccc3)=O)oc3c2cccc3)=O)no1,2 Z2094234375,CC(CC1c2ccccc2)CN1C(c(cc1)cnc1S(N)(=O)=O)=O,0 F5772-8660,COc(cc1)cc(-c2csc(NC(NCC=C)=O)n2)c1OC,0 F6608-0272,CC(C)(C)N(C1)CC1Oc(nc1)ncc1Br,2 SA04-1483,CCOCc1cnc(C)nc1C(CCC1)CN1S(c1cc(CCC2)c2cc1)(=O)=O,2 SD07-0600,CCN(CC)C(NCc1c(COC2(CN(Cc3ccccc3)CC2)C2)n2nn1)=O,0 Z3132343285,CCn1nnc(CNC([C@@]2(CCCC3)[C@H]3NCC2)=O)c1,0 D430-2279,Cc1cc(NC(N(CC2)CCN2c2nc(C)nc(N3CCN(C)CC3)c2)=O)c(C)cc1,0 F5869-0002,O=C(c1cc(Oc2ncccn2)ccc1)NCCCn1cncc1,2 Z2111602428,Cc(sc(N=C(c(cc1)ncc1F)N1)c2C1=O)c2-c(cc1)ccc1F,0 F2727-0879,O=C(C(CC1)CCN1S(c(s1)ccc1Cl)(=O)=O)Nc1cccc(Cl)c1Cl,0 Z838468654,CC(C)(C)C(N(CCC1)CC1C(NCc1cnc(C)s1)=O)=O,2 Z2740560620,Cc1nc(C)nc(N(CC2)CC2(CN(C)C)O)c1Br,0 F6495-9451,O=C(c1noc(-c2ccco2)c1)NCc1ncnc(-c2ccccc2)c1,2 Z1401946547,CC(C)N(CC1C)CC1NC(c1cc(ccc(Br)c2)c2[nH]1)=O,0 F6561-3835,CCN(CCN(C(NC(CC1)CCC1=C)=O)C1=O)C1=O,2 SC09-0038,CCn1ncc(CN(C2)[C@@H](C)COc(cc3)c2cc3-c(cc2)ccc2F)c1,0 F1142-0709,C(C1)Cc2c1c1c(Nc(cc3)cc4c3OCCO4)ncnc1s2,2 F2562-0213,CCOC(c(cc1)ccc1NC(CSc(cc1)nn2c1nc(-c1ccccc1)c2)=O)=O,0 Z4216085141,O=C1N(Cc(cccc2)c2NS(c2cnc(C3CC3)o2)(=O)=O)CCC1,2 F6672-1527,CC=C(CC1CC2)CC2N1C(C1=CC=CN(C)C1=O)=O,2 F2482-0037,O=C(C1=NN=C(N(CC2)c3ccccc3)N2C1=O)NCc(cccc1)c1Cl,2 Z2951392827,CC(C)(C1)N(CC(Nc(cc2)ccc2Cl)=O)CCNC1=O,0 3786-0693,Cc1ccc(C(C2C3C=CC2)Nc2c3ccc(C(O)=O)c2C)cc1,0 S605-0005,CN(c1c(N2[C@@H](CC3)CN3C(c3cocc3)=O)nccc1)C2=O,0 S948-0260,COC[C@](CN(C1)C(NC2CCCC2)=O)(CC2)[C@H]1CN2c(cc1)cc(C(F)(F)F)c1C#N,0 Z1682548937,CC(C)Oc(ccc(-c1noc(C2CC2)n1)c1)c1OC,0 F6671-3471,Cc1nc(CN(C(CC2)C3)C2CC3n2nnc(COC)c2)no1,2 F6524-0989,O=C(c(cccc1)c1OC(F)(F)F)NCCN1N=Nc(cccc2)c2C1=O,0 Z1239923178,O=C(c1cc(Nc2nccnc2)ccc1)Nc1cccc(OC(F)F)c1,0 F6670-4510,O=C(C1(CCOCC1)c1ccccc1)N1CCC(CN(C=Nc2c3cccc2)C3=O)CC1,2 F6521-8864,OC(CNC(c(c(F)ccc1)c1Cl)=O)(C1)Cc2c1cccc2,0 V016-3754,O=C(Cc(cc1)ccc1N(Cc1cccc(F)c1)C(C1CC1)=O)NCC1CC1,2 F5632-0018,Cc1nc(NCCNC(Nc(c(OC)c2)cc(Cl)c2OC)=O)nc(N2CCCCC2)c1,2 F6680-0684,CC(C(NC(C1)CN1c1nnc(C)s1)=O)Oc1ccccc1,2 M422-0373,CC(C)C(Nc1c(C(NCC2OCCC2)=O)snc1-c1ncccc1)=O,2 F6573-0258,Cn1nccc1-c1ncc(CNC(c2cc(cccc3)c3s2)=O)cc1,2 Z1687040821,CC1(CO)CCN(Cc2csc(Nc3ccccc3)n2)CC1,0 F3244-0168,Brc(cc1)ccc1-c1ccc(-c2nnc(-c3ccco3)o2)o1,2 F6188-0657,O=C(c(cccc1)c1Br)NCC1(CCOCC1)Sc1ccccc1,0 D146-0230,Cc(c1c2)c(C)oc1c(C)c(O1)c2C(C)=C(CC(NCc2ccc(C)cc2)=O)C1=O,0 S951-5326,N#Cc(cc1)c(C(F)(F)F)cc1N(CC1)CC(C(NC2CC2)=O)N1C(c1cscc1)=O,2 F6502-0201,CS(N(CC1)CCC1C(NCCn1c(-c2ncccc2)ncc1)=O)(=O)=O,2 F6514-3065,O=C(NCCCc1ccccc1)N(C1)CC1OCC(F)(F)F,2 Z1643363932,CC(COc1c(C2)cccc1)N2C(C)=O,0 SA73-1022,CCn1nc(C)c(CN(CC2)CCC2(CC2CC2)c2noc(C3CCOCC3)n2)c1,0 Z1873358937,Cn1c(C(N(CCC2)C2c2cccc(F)c2)=O)cnc1,0 F6761-7681,FC(c1cc(N2CC3N(Cc4nnc5n4CCC5)CCC3C2)ncc1)(F)F,2 Z1529058058,COCC1(CCN(CCCC(c(cc2)ccc2F)c(cc2)ccc2F)CC1)O,0 Z4881506382,C[C@@H](c1cc(-c2n[nH]nn2)ccc1)NC(c1c(Cc2ccccc2)n(C)nc1)=O,0 F6043-0793,Cc(n(-c1ccccc1)nc1C)c1N(CC1)CCN1C(Nc1c(C(F)(F)F)cccc1)=O,2 Z2170050918,CCCC(CO)(CC1)CN1S(c(cc12)cnc1onc2-c1ccccc1)(=O)=O,0 F6658-4663,CN(C(C=C(N1)N(CC2)CCN2C(N=C2N3C=CC=C2)=CC3=O)=O)C1=O,2 F1411-0278,O=C(CSc1nc(-c2ccccc2)nc2c1CCCC2)N1CCCCC1,2 Y042-3431,Oc(cc1)ccc1NC(C(CC1=O)CN1c(cc1)cc2c1OCCO2)=O,0 Z2905337908,CC(C)[C@H](c1nc(-c2nccn2C)no1)N(Cc1c2cccc1)C2=O,2 F6507-8976,COC1(CNC(c(cc2)ccc2S(N2CCCC2)(=O)=O)=O)CCSCC1,2 Z2913210355,OCC1(CC=CC1)C(c1ccccc1)NC(C(N1)=CC=C(C(F)(F)F)C1=O)=O,2 Z1127276137,Cc1cc(C(N(CCC2)CC2C(NCc2c(-n3c(cccc4)c4nc3)nccc2)=O)=O)cc(C)c1,2 F6495-4584,CC(C=C1)=NN(CCNC(C(C2)CN2c2ncnc(-n3cncc3)c2)=O)C1=O,2 Z1550263398,CC(C)(C(CCC1)N1C(CCc1nc(cccc2)c2o1)=O)O,2 F6484-0021,CN(C=CC=C1C(NC(CC2)CCC2Oc2nccnc2)=O)C1=O,2 Z2911407265,OC(C(C(C1)CN1C(C(C1)C1(CCC1)c2c1cccc2)=O)F)=O,2 F990-0324,O=C1N(c(cc2)ccc2F)N=C(c2nc(-c3ccccc3)no2)c2c1cccc2,0 SB14-1034,O=C(C1CC1)N(C(CC1)CN1C(C1(CC1)c1ccccc1)=O)C1CCOCC1,2 Z2955541434,CC(Cc1c(C)n(C)nc1C)NC(c1c2OCCc2ccc1)=O,2 F6808-5486,CC(C)NC(C(C)N1CCN(Cc2cncs2)CC1)=O,0 Z1396789342,Oc1cccc(CNC(C2CCCC2)c(cccc2)c2F)c1,2 F6360-9339,O=C(c1cccs1)N(C1)CC1Oc1cnccc1,2 F5529-0132,O=S(c(s1)ccc1Cl)(NCCOc(cc1)ccc1F)=O,0 F6734-0674,O=S(c(cc1)cc2c1OCC2)(N1CC(CN(C2)c(cc3)ncc3Cl)C2C1)=O,2 F6442-6856,O=C(CN(C(CC1)=O)C1=O)N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F,2 F6775-2576,Fc1cccc(Cl)c1CN1CC(COc2nccnc2)CCC1,0 F6178-8440,N#Cc1nccnc1N1CCC(CNC(Nc(c(F)ccc2)c2F)=O)CC1,0 SC15-0051,O=C(c1cc2cccnc2cc1)N1CCC(CN(CC(COc2nccnc2)C2)C2=O)CC1,2 F6672-1463,C=C(CC1CC2)CC2N1c1c(ccs2)c2ncn1,2 F6529-2835,COc(cc1)cc(C(N(CC2)CCC2N(CC(N2C3CC3)=O)C2=O)=O)c1Br,0 4383-0172,CC(NC(NC1c(cc2)ccc2Cl)=O)=C1C(Nc(ccc(OC)c1)c1OC)=O,0 Z2957809976,O=C(Nc(cc1)nnc1-c(cccc1)c1F)N1CC(CC(F)F)C1,2 F6787-1086,Cc(cn1)cnc1OCC(CCC1)(C2)C1CN2c1ncnc2c1nc[nH]2,2 Z3687016527,Cc1cccc(COCC(N[C@@H](CC(Cn2nccc2)C2)[C@H]2O)=O)c1,0 G748-0079,NC(c1c(NC(c2n[nH]c-3c2CCc2c3cccc2)=O)sc(Nc2ccccc2)n1)=O,2 F6519-8246,O=C(NCC(c1cscc1)n1nccc1)NCc1cccc2ccccc12,2 F6436-2688,O=C(c1cc(cccc2)c2s1)NCC(CC1)CCN1S(C1CC1)(=O)=O,2 S551-0461,CC(C)c1noc(-c2cc3nnc(CNC(c4nc5ccccc5cc4)=O)n3cc2)n1,2 F6791-9173,CCc1nnc(C(CC2)CCN2c(nc2)ncc2F)s1,0 J015-0412,O=C(COc(ccc(Cl)c1)c1-n1cnnc1)NC1CCCCCC1,2 F6512-0913,O=C(NC(c1ccccc1)c1ccccc1)Nc1cc2ccnn2cc1,2 F6436-3497,CC(Cc1cocc1)NC(c1cc(Br)cs1)=O,2 S954-0281,N#Cc(cc1)c(C(F)(F)F)cc1N(CC1)CCC1[C@@H](CN(C1)C(C2CCC2)=O)[C@H]1C(NC1CC1)=O,2 F6445-6993,O=S(c(cccc1)c1Br)(NCc(cccc1)c1-c1cscc1)=O,0 F6709-0223,CCc(cn1)cnc1OC(CC1)CCN1S(c(cc1)ccc1-n1nccc1)(=O)=O,2 Z4950571190,Oc(cc1)ccc1-c1nc(C(Nc2n[nH]cc2C2CC2)=O)cs1,0 F6452-1180,CC(CNC(CSc(cc1)ccc1F)=O)(c1cccc(Cl)c1)OC,0 F1472-0155,CC(Nc(cc1)ccc1NC(c1cnccc1)=O)=O,0 S576-0447,COCCN1N=CC(N(CC2)CC2C(Nc(cc(cc2)OC)c2OC)=O)=CC1=O,0 F6368-0330,O=C(CN1CCN(CCn2c(-c3ccccc3)ncc2)CC1)Nc1nccs1,2 Y040-8144,CC(C(O)=O)Oc(cc1)cc(O2)c1-c(ccc(OC)c1)c1C2=O,0 F6660-0309,Cc(cc1)cc2c1NC(CCN(Cc1ccccc1)C1)=C1C2=O,2 F6562-4220,CN(C)c1nc(CCC(C2)NC(Cn3c(cccc4)c4nc3)=O)c2cn1,2 F6562-8218,Cn1c(cccc2)c2c(CC(NCC2c(cccc3)c3OC2)=O)c1,2 F6440-3254,CN(C)S(c(cc1)ccc1C(NCc1nn(C)c2c1COCC2)=O)(=O)=O,0 S640-2841,COCc1noc([C@@H](CN(C2)C(c3cc(cccc4)c4[nH]3)=O)[C@H]2C(N)=O)n1,2 F6503-5477,Cn1nc(CN(C2CCCC2)C(Nc(cccc2OC)c2OC)=O)c2c1CCC2,2 F6562-7898,COc(cccc1)c1NC(NC(CC1)C11CCOCC1)=O,0 F6523-3932,O=C(Cn1nccc1)N(CC1)CC2=C1N=C(C=CC(F)=C1)N1C2=O,2 M676-1615,O=C(C1CC1)NCc1csc(C(CCC2)CN2S(c(cc2)cc(F)c2F)(=O)=O)n1,0 G856-9100,O=C(c1nc(cccc2)c2s1)N(CC1)CCN1c1nc(c(F)ccc2)c2s1,0 Z3016314016,Cc1nonc1CC(Nc1cccc(C(C(F)(F)F)O)c1)=O,2 Y031-3688,CC(C1)N(C(C(CC2=O)CN2c2c(C)c(C)ccc2)=O)c2c1cccc2,0 Z1738584229,Cc(ccc(Br)c1)c1S(NC1CCN(CC(O)=O)CC1)(=O)=O,0 V011-9603,COc(ccc(-c(cnc1ncnn11)c1N1CCN(C/C=C/c2ccccc2)CC1)c1)c1OC,2 Z2362304821,CCc(n(-c1c(C)cccc1)nc1)c1NC(NCC(C)(C(O)=O)O)=O,0 Z2175451878,Cc1cn(C(CC2)CN2C(c2cccn2C)=O)nc1,2 Z2605589881,CC(CN(Cc(n1-c2c3scc2)nnc1N(C)C3=O)C1)OC1(C)C(F)F,2 F6799-8774,CC(C)S(N1CCN(Cc2nc(C)no2)CC1)(=O)=O,0 G008-2059,Cc1c(-c2cc(S(NCCN(CC3)CCN3c(cccc3)c3F)(=O)=O)c(C)cc2)onc1C,2 Z2801974172,Cc(cc1)cc(C(N2CCN(CC(CO)(F)F)CC2)=O)c1F,0 G373-1861,Cc1c(CN(CC2)CCN2S(c(cc2)cc3c2OCCO3)(=O)=O)nc(-c2ccccc2)o1,0 F5016-0280,O=C(C(NCC(CC1)CCN1C1CCCC1)=O)NCCN1CCOCC1,2 F6200-1989,C=CCCC(NCC(c1ccc(C(F)(F)F)cc1)O)=O,0 G366-0972,O=C(C(C1)N(C(c2ccccc2)=O)c2c1cccc2)N(CC1)CCN1C(c1ccco1)=O,2 Z2172082203,CCc(n(C)cc1)c1C(NCC(c1ccc(C)o1)N1CCCC1)=O,2 Z3138954970,CCn1ncc(CC(N(C2)CC3(CCC3)C2N)=O)c1,2 Z1762713942,CC(N(CC(C1)OCCN1C(c1ccco1)=O)CC(O)=O)=O,0 S720-2312,Cc1noc(C)c1CC(N(C[C@H](C1)Oc2ccccc2)[C@@H]1C(N)=O)=O,2 F6525-2878,Cn(c(CNC(c(cc(cc1)OC)c1Br)=O)c1)nc1-c1cnccc1,0 Z3646568251,CC(C)C(c(cc1)c(CC2)cc1OC)N2C(c1nn(CCC2)c2c1)=O,2 Z1451956275,OC(CNC(c1csc(NC2CC2)n1)=O)(C(F)(F)F)c(cc1)ccc1Cl,2 Z3091768204,CCC(N(CCC1)CCN1S(C1C(C)CCC1)(=O)=O)=O,2 F6529-1189,CN(C(C(F)(F)F)=NN1C2CCN(CC(Nc3cnccc3)=O)CC2)C1=O,2 Z3697254853,Cc1cc(Cl)ncc1NC([C@H](C1)NCC11OCCO1)=O,0 Z738238238,Cc(cc1)ccc1Oc(cc1)ncc1NS(c(cc1)cc(CCC2)c1NC2=O)(=O)=O,2 Z1413724042,CC(C(C)OC1C)C1C(N(CC1CC(O)=O)c2c1cccc2)=O,2 F6436-3654,COCCN(Cc1cocc1)C(Cc1cscc1)=O,2 F6200-3569,OC(CNC(C1Oc(cccc2)c2OC1)=O)(C1CC1)c1ccccc1,2 SD03-0955,CC(C)C(N1CCC(C2)(CN(CC(NCCC3=CCCCC3)=O)C2c2nc(C)no2)CC1)=O,2 F5479-0257,Cc1cc(C(NCCCN2N=CC=CC2=O)=O)c(C)o1,2 S988-0151,Cc1noc([C@@](CN(C2)C3CCOCC3)(C3)[C@@H]2CN3C(COc2ccccc2)=O)n1,2 V020-1175,Cc1c(Cc2ccccc2)c(N2CCN(CC(CN3CCOCC3)O)CC2)nc(C)n1,2 F6799-8518,Cc1nnc(N2Cc3nnc(C(F)(F)F)n3CC2)s1,2 L558-0505,CN(c(nc(-c(cc1)ccc1Cl)nc1)c1C(N1CC(NCC2OCCC2)=O)=O)C1=O,2 S976-0543,Cn1cnc(S(N(CCC2)CC2(C(NCCOC)=O)F)(=O)=O)c1,0 Z1601843281,CC(C1)OCCC1C(Nc1cn(-c(cccc2)c2Cl)nc1)=O,0 F6619-5929,OC1(CN(CC2)CCN2c2nccc(C(F)(F)F)n2)CCOCC1,0 Z4965093039,Cc(cc1)cc(OC)c1NC(CC(Cc1ccccc1)C([O-])=O)=O,0 Z98502171,Cn1c(SCc2cscn2)ncc1-c1ccccc1,2 F6476-2879,O=C(c1ccno1)N(CC1)CC1Oc1nccc(C(F)(F)F)c1,2 Z3717179542,O=C(c1c(NCCC2)n2nc1)NC(CCCCC1)C1c(cc1)ccc1Cl,2 Z1082396832,CCN(CC)C(c(cccc1)c1N1CCN(C)CC1)=O,0 S724-0571,O=C(c1cn(C(C2)CN2C(Nc(cc2)cc3c2OCCO3)=O)nn1)N1CCCC1,2 F2947-0642,CN(C=C(C=C1NC(c2cc(cccc3)c3o2)=O)C(N2CCCC2)=O)C1=O,2 F1059-0002,Oc(cccc1)c1-c1csc(-c2ccccc2)n1,0 Z3009452831,OC([C@]1(CN(C2)C([C@H](C3)[C@H]4O[C@@H]3[C@H]3[C@@H]4C3)=O)[C@@H]2CCCC1)=O,2 F5791-2270,O=C(c1n[nH]c(-c2cccs2)c1)N(CC1)CCN1c1ncccc1,2 Z3338946555,CC(C1C)c(cccc2)c2N1S(c1c[nH]nc1Cl)(=O)=O,0 F6442-1725,CC(C)CS(C(C1)CN1C(CCNS(c1c(C)c(C)cc(C)c1C)(=O)=O)=O)(=O)=O,0 F6666-5242,Cc(cc(cc1)OC)c1NC(N1CCOCC1)=O,0 S646-0724,O=C(C1CC1)N(CC1)CCC1N(CC12CCCCC2)C1c1ccncc1,2 F6726-4525,COc(cc1)ccc1-c1ncnc(N(CC2)CCN2C(C2CC=CC2)=O)c1F,2 F6503-5003,Cn1nc(CN(Cc2ccco2)C(Nc(cc2)cc3c2OCO3)=O)c2c1CCC2,2 Z3600723131,Cc(cc1)ccc1-c1c(C(NCc2n[nH]c3c2COCC3)=O)nco1,0 SA92-0122,CC(C)CCNC(N(CCC1)CC1(c1nc(-c2ccccc2)no1)F)=O,0 SB77-0947,CN(C)C([C@H](C[C@@H](C1)OC(CC2)CCN2S(C)(=O)=O)N1C(c(cc1)ncc1F)=O)=O,2 D340-1935,CC(C)CNC(c1c(C(NC2CCCCC2)=O)nc[nH]1)=O,0 F0918-3695,O=C(NCc1ccco1)N1c(cccc2)c2Sc2c1cccc2,2 Z2909737050,Cc1cnc(C(N2CCC(CC(O)=O)CC2)=O)c(C)c1,0 F6359-5008,O=C(CSc(cc1)ccc1F)N(CC1)CCC1Oc(nccc1)c1Br,2 Z2701196394,COC(c(cc1)cnc1N1Cc2c(C(F)(F)F)cccc2CC1)=O,0 P221-1362,O=S(c1cc(CCC2)c2cc1)(N1Cc2cc(-c3cnccc3)nn2CCC1)=O,2 F5119-0545,CCn1nc(C)cc1C(Nc(cc1)ccc1C(OCC)=O)=O,0 C066-2047,O=C(c1cc(C(Oc2c-3cccc2)=O)c3s1)NC1CCN(Cc2ccccc2)CC1,2 Z2967655546,CN(CC(NC1CC1)=O)c(c1c2)ccnc1ccc2OC,2 F6240-2396,COc1c(C(Cn2nnc(C(NCc3c(C(F)(F)F)cccc3)=O)c2)O)cccc1,0 3396-0037,O=C(CSc1nnc(c(cccc2)c2[nH]2)c2n1)N(CCC1)c2c1cccc2,0 Z2993719041,CC(C)CNC(c(ccc(NC(c1cnc(cnn2C)c2c1)=O)c1)c1Cl)=O,2 F2199-0283,CC(C)(C)OC(N(CC1)CCC1Oc1nc(cc(cc2)OC)c2s1)=O,0 SC04-0379,O=C(c1cocn1)N(CCC1)CC1OCCc1noc(C2CCOCC2)n1,2 Z2482977317,CC(c1c(C)nc(C)s1)N(C)Cc1c(C(O)=O)scc1,0 F5033-2896,COc1cccc(C(NCC(CC2)CCN2S(C)(=O)=O)=O)c1OC,0 Z1514296728,CC(C)Oc1cccc(C(NCC(c2ccc(C)o2)N2CCCC2)=O)n1,0 SB24-0524,CC(C)CNC(c1cn(C(CC2)C2(CC2)CCN2C(NC2CCCCC2)=O)nn1)=O,0 Z3644986379,Cc1nc([nH]cc2)c2c(C(OCC2OCC3(CCC3)C2)=O)n1,2 SC10-1138,CC(C)C(N(CCCN1CCCC1)C(CC1)CN1C(c1ccc(C)s1)=O)=O,2 T500-1960,O=C(C1CCN(Cc2c[nH]nc2-c2cccs2)CC1)N(CC1)CCC11OCCCC1,2 L367-0073,COc(ccc(Cl)c1)c1NC(c(cc1)ccc1-c1cnc(N2CCCC2)nc1)=O,0 C365-0276,CC(c1ccccc1)SC(N1)=Nc(n(-c2cc(C)c(C)cc2)nc2)c2C1=O,0 M023-0460,CCC(C)(C)NS(c1cc(-c2nc(C)c(C(N3CCCCC3)=O)s2)cs1)(=O)=O,2 SC66-0826,CC(C)CCNC(N(C1)CC2(CCOCC2)C1c1nncn1CC1CC1)=O,0 Z4512897824,O=C(C(c1cnccc1)NC1=O)N1c1cccc(Cl)c1,2 S625-6066,CN(C[C@@H](C1)O)[C@@H]1c1nnc(C2)n1CCN2C(COc(cc1)ccc1OC)=O,2 F6525-5331,O=C(CSCc1ccccc1)NCCn1ncc(-c2cnccc2)c1,2 Z3524378759,CC(C)C(C1)CN(C(c2n[nH]c(C(O)=O)c2)=O)c(cc2)c1cc2F,2 SA96-1001,CC(C)CNC(C1C(C2)(CN2C(NCCc2ccccc2)=O)CN(Cc2ccccc2)C1)=O,2 E977-0659,O=C(C(CCC1)CN1S(c(cc1)cc(CCC2)c1NC2=O)(=O)=O)NCCc(cc1)ccc1Cl,2 F6573-4440,O=C(NCCOCCN(C(CC1)=O)C1=O)OCC1OCCCC1,2 Z3501798867,Cc1cccc2c1n(C)cc2CCNC(N1CCCC1)=O,2 P666-1231,CC(n1c2cc(S(N(CC3)CCN3c(cc3)ccc3F)(=O)=O)c1)=NNC2=O,0 Z1939448315,COC(c1c(c(Br)c[nH]2)c2ncn1)=O,0 F3097-0931,COC(c(cc(cc1)Br)c1NC(c(cc1)cc(OC)c1OC)=O)=O,0 L799-0892,CN(c(ccc(S(N1CCC(CC(NC2CC2)=O)CC1)(=O)=O)c1)c1O1)C1=O,2 Z1443286915,Cn(c(C(NC(C1)CN(C2CCCCC2)C1=O)=O)c1)c2c1cccc2,0 F5831-1919,CCSc(cccc1)c1C(NC(C)Cc1ccco1)=O,0 Z4079209921,O=C(C1[C@@H](CC2)[C@@H]2C1)NS(c(cc1)ncc1F)(=O)=O,2 Y300-3666,O=C(C1CCCC1)NCc(cc1)ccc1N1CCCCC1,2 Z1139200790,C(CN(CC1)c2nc(-c3ccccc3)ncc2)C1Nc1cccnn1,2 F6216-0221,Cc1noc(CCCNC(c(ccc(F)c2)c2Cl)=O)c1,0 6064-0015,O=C(COc(cc1)ccc1S(NC1CCCCC1)(=O)=O)NCC1OCCC1,2 Z1408449488,Cc(c1c2)nn(C)c1ncc2NC(NCc(ccc(C)c1)c1OC)=O,0 F1908-3254,Cc1noc(C(CC(C2)F)N2C(c(o2)ccc2Br)=O)n1,2 F6539-3225,O=C(c(cccc1)c1Br)NCc(cc1)ccc1-c1cocc1,0 Z1563803731,NC(CC1CCN(Cc2c3OCCCOc3ccc2)CC1)=O,2 F2416-0066,CCOC(Nc1cc(CN(CC2)C(C)=O)c2cc1)=O,0 F6359-5010,Cn(cc1C(N(CC2)CCC2Oc(nccc2)c2Br)=O)nc1OC,2 2613-0039,CC(C)N(Cc1ccccc1)CC#CCC(C1CCCC1)(c1ccccc1)O,0 SD68-0368,COCCN(CCN(CCC1)C2CN1C(Cc(cc1)ccc1F)=O)C2=O,0 F6658-6042,O=C(c1cc(Br)cnc1)N1CCC(COc2ncnc(C3CCC3)c2)CC1,2 Z2219236040,Cn1nc(CNCC(c(cc2)cc(F)c2Cl)O)cn1,2 Z203974170,O=C(Cn1cncc1)N(CCC1)C1c1nc(cccc2)c2s1,2 Z2595725308,OC(c1cn(C(CC2)CCN2C(c2ccc(C3CCC3)cc2)=O)nn1)=O,2 F2880-3547,O=S(c(cc1)cc2c1OCCO2)(NCC(c1cccs1)N1CCOCC1)=O,2 F6557-1135,O=S(c(cccc1)c1Br)(N(CCC1c2ccccc2)CCS1(=O)=O)=O,0 K788-1318,CC(CC1)CCN1S(c(ccc1nc(-c2cnccc2)c2)cc1c2C(NC1CCCC1)=O)(=O)=O,2 S988-1023,CCS(N(C[C@@H]1CN(C2)C(c(cc3)cc4c3[nH]cn4)=O)C[C@@]12c1nc(C)no1)(=O)=O,2 F6478-2005,O=C(c(cc1)ccc1OC(F)(F)F)N(CC1)CC1Oc(nc1)ncc1Br,0 S694-1144,Cc1cnc(-c2cnccc2)n1C(CC1)CN1S(c1cccs1)(=O)=O,2 D473-0182,O=S(C(CNS(c(cc1)cc2c1OCCO2)(=O)=O)c1cnccc1)(c1ccccc1)=O,2 SD22-0163,Cc1ccc(CN(C2)CC2(C2(CC2)OC)NC(c2ccccc2)=O)s1,2 Z3464484385,O=C1N(CC2OCCC2)C(SCc2cc(Cl)cc3ccccc23)=NN1,0 SD24-0027,CCN(C[C@@H]1CN(C2)C(COc(cc3)ccc3OC)=O)C[C@@H]2NC1=O,2 G008-5370,Cc1c(-c(cc2)cc(S(Nc(cc3)cc4c3OCCO4)(=O)=O)c2OC)onc1C,0 F6514-4464,O=C(c(cc1)ccc1-c1cccs1)N(C1)CC1n1nnc(CN(CCC2)C2=O)c1,2 K953-0265,CCC(Cc1ccccc1)NC(C(O1)=C(c2ccccc2)c(cccc2)c2C1=O)=O,2 SB36-1144,Cc1cn(CCC(N(C2)[C@H](Cn3nnc(C(N4CCOCC4)=O)c3)CC2(F)F)=O)nc1,2 Z240216058,Cc1c(CC(N2CCCCCCC2)=O)nc(-c2cccs2)o1,2 Z1225002009,CCC(NCC(Nc(cc(cc1)C(NC)=O)c1OC)=O)=O,0 F6554-4568,Cc(c(S(N1Cc(cc(cc2)F)c2OCC1)(=O)=O)ccc1)c1Cl,0 P757-0992,O=C(c1nc2ccnn2c(C2CC2)c1)Nc(cc1)ccc1N1CCOCC1,2 Z4996117810,CC1(C(NCC2CN(CC(NC)=O)CC2)=O)OCCc2c1cccc2,2 Z85971672,CC(CC(O)=O)NC(COc(ccc(Cl)c1)c1Cl)=O,0 G550-0053,COc(ccc(Cl)c1)c1NC(C(Nc1c2cccc1)NS2(=O)=O)=O,0 F6184-0857,CN(C)c(cc1)ccc1C(NCCN(CC1)CCC1c1cccs1)=O,0 F6472-7725,O=C(c1cc(Br)cnc1)N(C1)CC1N(CC1)Cc2c1cccc2,2 Z3521042318,COC(CN(CC1)CC1c(cc1)cnc1F)=O,0 F6420-0527,COC1(CNC(CC2CCCC2)=O)CSCC1,2 G702-6635,Clc1ccc(Cc2nn3c(N4CCC(Cc5ccccc5)CC4)c(CCC4)c4nc3n2)cc1,2 M060-0105,O=C(CSc1ncnc2c1[nH]c1c2cccc1)N(CC1)Cc2c1cccc2,2 Z2371370496,CC(C)(C(CC1)c2ccccc2)N1C(NC1=C(C)C=CN(C)C1=O)=O,0 F6764-3283,C(c1nnc(C2CC2)o1)N1Cc2cc3cccnc3nc2CC1,2 F556-0103,CC(Nc1cccc(C(N(CC2)CCN2C(c2nsc3c2cccc3)=O)=O)c1)=O,0 Z2848286173,CC(C)(CCNCC1)N1C(c1cc(C)co1)=O,2 Z3622879247,CC1(C)OC(CCC2)(CN2S(c(cc(s2)Cl)c2Cl)(=O)=O)NC1=O,2 F6525-2703,Cc1cc(-c2cnccc2)nn1CCNS(c1cc(CCCC2)c2cc1)(=O)=O,2 Z1187117850,CC1OC(C)CN(Cc2ccc(CNC(N3CCC(COC)CC3)=O)cc2)C1,2 SA63-0859,Cc1nn(C)c(C(N(CC2)CCC22OCCC(CCNS(C)(=O)=O)C2)=O)c1,0 F6359-1032,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1)CCC1Oc(nccc1)c1Cl,2 S512-0592,Cc1ccc(CNC(N(CC2)CC2OCc2ccccc2)=O)cc1,2 F210-0037,Cn(c(C(N(CC1)CCN1c1cccc(Cl)c1)=O)c1)c(-c(cccc2)c2O2)c1C2=O,0 F472-0820,CCC(C)NC(c(cc1)cc(-n2c(SCC(Nc(cc3)ccc3C(C)=O)=O)nnc2N2C)c1C2=O)=O,0 S688-1022,CC(C)C(N(CC1)CCC1(CCOC)NC(C1CC1)=O)=O,0 F850-0522,O=C(CC1N(Cc2ccccc2)c(ccc(F)c2)c2OC1)NCCC1=CCCCC1,0 Z237505834,Cc1nc(C(N2CCC(Cc3ccccc3)CC2)=O)nn1-c1nnc[nH]1,2 F2147-0008,CCOC(c1c(C)[nH]cc1-c(cc(cc1)OC)c1OC)=O,0 Z3687120737,COc(cc1)c(CC2(CC2)C(N(C[C@@H]2CC(N)=O)C[C@@H]2O)=O)cc1F,0 Z1319800361,CC(CCN(Cc1ccccc1)CC1)N1C(c(cc1)ccc1NC(N)=O)=O,0 F6276-2324,CS(N(C1)CC1Oc1nc(cccc2)c2s1)(=O)=O,0 Z595220420,Cc(cc(cc1)N2CCOCC2)c1NC(N1C(CCc2ccccc2)CCC1)=O,2 Z2963398175,Cc1cc(C(NC(CO)c2c(C(F)(F)F)cccc2)=O)cc(O)n1,0 E699-1977,CC(C1)N(C(C2CCC2)=O)c(cc2)c1cc2S(N(C)CC(N(CC1)c2c1cccc2)=O)(=O)=O,2 F0582-0002,O=C(Cc1ccccc1)NCCSc1c[nH]c2c1cccc2,0 P130-0135,COc(cc1)ccc1NC(Nc1cc(-c2nccnc2N2CCCC2)ccc1)=O,2 F6681-3373,O=C(C1COCC1)N1CC(COc2cnccc2)C1,2 J015-0465,O=C(COc(ccc(Cl)c1)c1-n1cnnc1)NC1CCCCC1,0 S984-1749,CC(C)N(C[C@H]1CN(C2)S(Cc(cc3)ccc3F)(=O)=O)C[C@]12C(N1CCCC1)=O,0 Z2983466774,O=C(CN(c(cccc1)c1C(N1)=O)C1=O)N1CC2(CC2)C1,2 F6480-2901,Cc1nc(OC(CCC2)CN2C(C2=CC=CN(C)C2=O)=O)nc(C)c1,2 Z1431493610,Cn(cc1)cc1C(N(CC1)CCN1c1ncccn1)=O,2 SB16-0382,Cc1noc(C)c1CN(CC1)C[C@@H]2[C@H]1N(Cc1ccccc1)CCOC2,2 Z1315947476,Cn1ncc(N(CC2)CCN2C(Cc(cc2)cc3c2OCO3)=O)c1,2 F870-0996,COc(cc1)ccc1NC(c(cc1)ccc1Nc1ccnc(-c2cccc(F)c2)n1)=O,0 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F807-0816,Cc(ccc(Cl)c1)c1N(CC1)CCN1c(cc1)nnc1S(C1CCCCC1)(=O)=O,2 F6000-0005,O=C(CCCNC(c(cc1)ccc1-n1cccc1)=O)Nc1cccc2cccnc12,2 S951-5173,CCC(CC)C(N(CCN(C1)c(cc2)cc(C(F)(F)F)c2C#N)C1C(NC)=O)=O,0 F6712-3645,Cc1cc(N2CC(CN(C3)C(C(C4)CC4(F)F)=O)C3C2)ncn1,2 F6178-4190,COc1c(C2(CC2)C(NCC(CC2)CCN2c2ccncc2)=O)cccc1,0 Z1174006434,CC(C)c1nc(cc(cc2)NC(c(cc3)ccc3Oc(cc3)ncc3C#N)=O)c2o1,2 Z2964004161,CC(C)(CNC(c(cc1)nc(N2)c1OC2=O)=O)C1CCOCC1,2 Z1148797339,NS(c1cnc(NC2CCC2)s1)(=O)=O,2 Y205-6027,CC(CC1)Cc2c1c(-c(n1C)nnc1SCC(N)=O)cs2,2 F6676-1290,Cc1nccc(OCC(CC2)CCN2c2nc(C)cc(C)n2)c1,0 F6556-6088,O=S(c(cc1)cc2c1OCCO2)(N(CCC1)CCN1C1CCC1)=O,2 D212-0394,CN(C)CCCn1c(cccc2)c2nc1C(CC1=O)CN1c(cc1)ccc1Br,0 F6472-7066,Cc1nn2c(CCN(C3)C(c4nc(cccc5)c5s4)=O)c3cnc2c1,2 Z2766250483,Cc(cc1)c(C)nc1C(NC[C@@H](CC1)O[C@@H]1c1ncn[nH]1)=O,0 F6811-1693,O=C(C=C1)N(Cc2ccccc2)N=C1N(CC1)CCN1c1ccnc2ccccc12,2 Z1440385525,Cc1cccnc1CNC(CC1)CCN1c(cc1)ccc1OC,0 Z2692070187,CCC(N(CCN1)c2c1ncc(C)c2)=O,0 Z2845495923,CC(C(NCc(cc1)ccc1F)=O)n1nnc(C(C)Oc2ccc(CO)cc2)c1,0 F6482-3395,COc1c(CC(N(C2)CC2n2nccn2)=O)cccc1,0 F6561-4847,C=C(CC1CC2)CC2N1C(CN(C=Nc1c2cccc1)C2=O)=O,2 Z2974623230,C[C@H](c1cccc2ccccc12)NC(NC[C@@H]1[C@@H](C=C)OCC1)=O,2 F1264-5526,CC(Nc1ncnn1C1c(cccc2)c2F)=C1C(Nc(cccc1)c1OC)=O,2 F5854-1782,O=C(c(ccc(F)c1)c1Cl)N(CCc1cccs1)Cc1cnccc1,0 Z1784504209,Cc(cc1)nc2c1oc(C(N(C)CC1(CO)CC1)=O)c2,2 Z2410016122,Cc1nc(C)nn1C(C1)CN1C(Cc(cccc1C)c1Cl)=O,0 Z1840335195,CC(C)(C(CCC1)N1c1ncc(C(F)(F)F)s1)O,0 Z2625386093,O=C(Nc1nc(C2CC2)ns1)N(CC1)CC1(C1)CNC1=O,2 F6435-7090,CC(C)(C)S(C(CC1)CN1C(CCc(cc1)cc(Br)c1OC)=O)(=O)=O,0 Z1869205051,CCC(C)(C(N1CCc2c[nH]c3cccc(C)c23)=O)NC1=O,0 F6452-0559,CCC(CNC(c1cccc(F)c1)=O)(c1ccccc1)OC,0 F6550-6145,O=C(c1cc(cc(cc2)F)c2s1)N(C1)CC1Nc1nnccc1,2 Z4120059336,CCC(c1cn(Cc(cc2)ccc2C(N2CCN(Cc3ccccc3)CCC2)=O)nn1)O,2 Z2968258587,CC(CN(CC1)C(NCC(N2CCCCC2)=O)=O)N1c1ccccc1,0 F2517-1623,CCn1nc(C)cc1C(Nc1nnc(COc2ccccc2)o1)=O,2 F5042-0490,O=C(c1nn(-c2ccccc2)nc1)N(CC1)CCN1c(cc1)nnc1-c1ccco1,2 Z3711729217,CC1(C)C(CNC(C(CC2)CCN2c(cc2)ncc2C#N)=O)OC1,2 F3007-0332,Cc1cc2c(Nc3cc(F)ccc3)ncnc2s1,2 F6481-4049,O=C(c1cc(cccc2)c2[nH]1)N(CC1)CCSC1c1cccs1,2 F2382-0064,Cn(cc1C(Nc2cccc(Br)c2)=O)nc1OC,0 S428-0186,Cc1noc(C)c1Cc1ccc(C(N(CCC2)CC2c2nc(C3CCOCC3)no2)=O)o1,2 Z1376324775,Cn1nccc1C(NCCc1csc(-c2ccccc2)n1)=O,2 SC76-0622,CCN(Cc1cn(C)nc1C)C(CN(C([C@]1(COc(cc2)ccc2F)[C@H]2C1)=O)c1c2cccc1)=O,0 F6539-3089,O=C(c1ccno1)NCc(cc1)ccc1-c1cocc1,2 Y501-2426,Cc1nn(C(CCN2C(c3c(c(C)nn4C)c4nc(-c4ccco4)c3)=O)C(F)(F)F)c2c1,2 Z809244602,Cc1ccc(C(N(CC2)CCC2NC(NC2CCCCC2)=O)=O)n1C,2 Z3991697675,O=C(c1cc(Nc2nccnc2)ccc1)Nc(cc1)ccc1OCCF,0 F2972-0760,Cc1c2nc(N(CCCn3cncc3)C(c3ccco3)=O)sc2cc(Cl)c1,0 F6506-1811,OC(CNC(C1(CCCC1)c(cc1)ccc1Cl)=O)(c1cocc1)c1cccs1,2 Z829609038,O=C(c(cccc1)c1-n1nccc1)NC(CC1)CN1C1CC1,2 SB46-0156,O=C([C@H](C[C@H]1CN(C2)C(c3ccccc3)=O)C[C@@H]1NC2=O)NCc(cccc1)c1Cl,2 SC40-1031,CCn1ncc(C(N(CC2)CCC22OCc3c(COc4ccccc4)nnn3C2)=O)c1,2 S904-0973,CN1Cc2nnc([C@H](C3)N(Cc(ccnc4)c4F)C[C@H]3O)n2CC1,2 Z4658050897,Cc1c(C)nc(C)nc1N(CC1)CC1(CC1)CCN1C(C1(CO)CC1)=O,2 F2880-1134,COc1ccc(C(CNC(c2cccc(C(F)(F)F)c2)=O)N2CCOCC2)cc1,0 F6743-9957,Cc1cc(CN(CCC2)CC2NS(C)(=O)=O)no1,0 SD08-0522,CN(C)C(NCc1c(COC(CCC2)(C3)CN2C(COC)=O)n3nn1)=O,0 SD02-0307,CC(C)c1nnc(C(C2)N(CC(N(C)C)=O)CC22CCN(Cc3cccs3)CC2)o1,0 Z2982733180,CN(C)S(CCc1cn(-c2cccc3cnccc23)nn1)(=O)=O,2 F6555-1064,Cn1ncc(S(N(CC2)CC2n2nnc(C3CC3)c2)(=O)=O)c1,2 F6753-3376,CC(C)c1nsc(N(CCC2)CC2C(N2CCSCC2)=O)n1,2 F5855-0766,O=C(C(C1)C1c(cc1)ccc1F)N(CC1)CCN1C(C1Oc(cccc2)c2OC1)=O,2 F824-0157,CC1Oc(ccc(S(N(CC2)CCN2C(NCc2ccco2)=O)(=O)=O)c2)c2NC1=O,2 Z1468303098,OCC(CC1)CCN1C(c(cccc1)c1Oc1cccc(Br)c1)=O,2 F0914-1493,Oc(cccc1)c1-c1nn(cnc2c3c(-c4ccccc4)c(-c4ccccc4)o2)c3n1,2 F3098-7316,COc(cccc1)c1OCCCC(Nc1cc(Cl)cc(Cl)c1)=O,0 D516-0146,Cn1c(ccc(NC(COc(cc2)ccc2Cl)=O)c2)c2nc1CCNC(C1CCCC1)=O,2 Z4738978943,N#Cc(cc1)ccc1N(CC1)CCN1C(c1c(cn[nH]2)c2ccc1)=O,0 F0660-2463,CSc1cc(N(CC(C2)c3nc(cccc4)c4n3Cc3ccccc3)C2=O)ccc1,0 F2158-0600,O=C(Cc1ccncc1)c(cc1)ccc1OCc1nc2ccccc2cc1,2 SC12-0816,O=S(c1cc(CCCC2)c2cc1)(N(CCCN1CCCC1)C1CCOCC1)=O,2 F6786-5673,Cc(cc1)nnc1OCC(CC1)CN1c1nc(C2CC2)nc(C)c1,2 Z4658051298,O=C(Cn1nnnc1)N(CC1)C(CCCCC2)C12NC(c1cocn1)=O,2 D757-0002,O=C([C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1)Nc1nc(CCC2)c2s1,2 Z1103024014,O=C(CN1CCCC1)N(CC1)CCN1c1nccc(C(F)(F)F)n1,2 Z1498510343,CC(C)N(C1CCC1)S(c1cc(Cl)cnc1N)(=O)=O,2 Z2169097861,CC(C)c1c(C(NCc(cc2)ccc2N(CCC2)C2=O)=O)ncs1,2 F0594-1686,Cc(cccc1)c1-c(o1)nnc1SCc1ccc(C(F)(F)F)cc1,0 SA57-0058,O=C(CCCc1c[nH]c2c1cccc2)N(CC1)CCC1(C1)OCCC1Oc1ncccn1,2 S722-2098,CN1CCC(Cc2ccc(CN(CC3CC3)C(C3CC3)=O)cc2)CC1,2 F5868-0083,Cc1ccnc(OCC(NCCCn2cncc2)=O)n1,2 Z2112138020,CC(C1)OC(C)(C)CN1C(c(cccc1)c1OC1CC1)=O,2 Z1444271002,CCN(CCC(O)=O)C(c1cccc(F)c1Cl)=O,0 Z599606564,CC(c(cc1)cc(F)c1F)NS(N(CCC1)CC1C(O)=O)(=O)=O,0 V030-9555,CN(C(c1cc(C#N)ccc1)=O)c(cc1)ccc1-c1c(CCc2c-3cccc2)c3no1,0 SB03-0124,CN(CCN(C1CCOCC1)C(CCC1)CN1S(C)(=O)=O)C(c1ncccn1)=O,2 Z1327500424,CCN(CC(c1ccc(C)cc1)O)Cc1ncc(-c2cccc(F)c2)o1,2 F6562-1897,COc(nccc1)c1C(NCc1cc(N(CCC2)C2=O)cnc1)=O,2 F6241-0278,Cc1cc(NC(C(COC2)N(Cc3ccccc3)C2=O)=O)no1,2 Z373023076,O=C(c(cc1)cnc1-n1c(cccc2)c2nc1)N1CCCC1,2 F6502-2478,O=C(CSCc1ccccc1)NCCn1c(C2CC2)ncc1,2 Y041-6546,CCn1c(ccc(NC(CCN(C=Nc2c3cccc2)C3=O)=O)c2)c2c2c1cccc2,2 F6713-6145,Cc1nnc(cc2)n1nc2N(CC1)CCN1c(cc1)nnc1-c1ccco1,2 S740-0265,COCCCN(C([C@H](C[C@@H](C1)NC(COc(cc2)ccc2F)=O)N1CC1)=O)S1(=O)=O,0 F5857-3519,COc1cccc2c1oc(C(NCC(C(F)(F)F)(c1ccccc1)O)=O)c2,0 Z4480905700,O=C(Cc(cc1)ccc1F)N[C@@H]1[C@@H](C2)[C@H]1CN2C(COCC1CC1)=O,2 Z1212931096,CC(CC1)CC(CCC2)C1N2S(c1cc(N(CC2)C(C)=O)c2cc1)(=O)=O,2 D345-0892,Cc1c(C(NCC(c(cc2)ccc2Cl)N2CCN(C)CC2)=O)oc2c1cc(C)cc2,0 F6031-2042,CCS(N1CCN(CC(C2CC2)O)CC1)(=O)=O,0 F5072-4235,COc1cc(NC(N(CC2)CCN2c(cc2)nnc2-c2ccco2)=O)cc(OC)c1,0 Z2855653875,CN(CN(C1)C(c2cn(C)nc2OC)=O)C1=O,0 SC10-0032,Cc1c(CN(CC2)CC2N(CCCN2CCOCC2)S(C)(=O)=O)scn1,2 Z237494930,CN(c(c(C(N1)=O)c2)ncc2C(N(CC2)c3c2cccc3)=O)C1=O,2 Z4619797889,O=C(NC(C1)C1C1CCCC1)N(CCCCC1)C1c1ccncc1,2 F6539-2085,CN(C)S(N1CCC(CNC(c2cccs2)=O)CC1)(=O)=O,0 V003-4249,CCC(C(N(C1)C(C)c2ccccc2)=O)Oc(cc2)c1cc2NC(Nc1ccc(C(C)C)cc1)=O,0 S831-0156,Cc1nccc(C(N(C[C@@H]2COC)C[C@@H]2c2ncccc2)=O)c1,0 F1852-0212,Cn1ncc2c1ncnc2NCc(ccc(Cl)c1)c1Cl,0 Z2017559595,COc1nccc(NC(NC(C(N)=O)c(cc2)ccc2F)=O)n1,0 Z1359490461,Cc1ccnc(N2CCN(CC(N(C)C)=O)CCC2)c1[N+]([O-])=O,0 F6727-2163,CC(C)N(C(C=C1)=O)N=C1C(N(C)C(C1)CN1c1nn2c(-c3cnccc3)nnc2cc1)=O,2 Z4457796275,Cc1nc(C(Nc(cc2)cc(Cl)c2N2CCCCC2)=O)nn1-c1nnc(C(F)(F)F)[nH]1,2 Z968963536,O=C(CCc1nc(-c2nnc[nH]2)no1)N(CCC1)C1c1cnccc1,2 S421-0443,O=C(CC(CC1)CN1C(c1cccc(F)c1)=O)NC1CC1,2 F6064-8452,COc(ccc(Cl)c1)c1NC(CN(C1)CC1c1nc(-c2ccco2)no1)=O,2 Z3687018135,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(c1c(C2CC2)nco1)=O,2 Z1444738674,OC(CC1(CCOCC1)NC(c(ccc(-c(cc1)ccc1F)c1)c1F)=O)=O,2 F0545-1384,O=C(CSc1c[nH]c2c1cccc2)Nc(cc1)cc2c1OCCO2,2 Z3060601999,CC(Nc1nccc(C(N2[C@@H](COC3)[C@@H]3C3(CCC3)C2)=O)c1)=O,2 F6562-9152,O=S(c1c(C(F)(F)F)cccc1)(NCc1nccnc1-c1cscc1)=O,2 Z4966623273,[O-][N+](c1cc(-c2cn(-c(cc3)cc4c3OCO4)nn2)ccc1)=O,2 Y205-7889,COc(cccc1)c1NC(c1c(NC(C(CCCC2)C2C(O)=O)=O)sc2c1CCC2)=O,0 D216-2039,O=C(CCC(N1CCCCCCC1)=O)Nc1nnc(C(F)(F)F)s1,2 F5772-5877,O=C(NCc1cccs1)N(CC1)CCC1c1nc(cccc2)c2[nH]1,2 Z2975220924,CCc1nc(N(C)CC(c2cnccc2)O)c(ccs2)c2n1,0 F0920-1834,CCc(c(O)c1)cc2c1OC=C(c1nc(cccc3)c3[nH]1)C2=O,0 F0326-0229,Cc1cccc(-c2nnc(NC(c(cccc3)c3Br)=O)s2)c1,0 Z2965107871,Cc(n(C)nc1C)c1-c1n[nH]c(C(N[C@@H](COCC2)[C@H]2OC)=O)c1,2 F5857-0818,Cn1c(C(CNC(c2cccnc2SC)=O)O)ccc1,0 Z2143321003,CCC(CC)(C(NC(CC1)Cc2c1n(CCO)c(C)n2)=O)c1ccccc1,2 Z1272562780,CCn1nc(C)c(NC(N2)=Nc(n(-c3ccccc3)nc3)c3C2=O)c1C,0 V022-0829,CCC(N(CCCOC)CC(N(CC1)C(COc(cc2)ccc2Cl)c2c1scc2)=O)=O,0 Z2953573204,O=C(NC(C(F)F)c1cccc(Cl)c1)N[C@H]1[C@H](C2CC2)OCC1,2 Z2480503747,O=S(Cc(cc1)ccc1Cl)(N(C1)CC1OC(F)F)=O,0 F5074-0433,CC(C)n1nccc1-c1nnc(NC(c(ccc(Cl)c2)c2Cl)=O)o1,0 F6064-4063,Cc(c(S(N(C1)CC1c1nc(-c2cc(C(NC)=O)ccc2)no1)(=O)=O)ccc1)c1Cl,2 SC02-0025,COCCC(CC1)(CN1C(c(cc1)cc(Cl)c1F)=O)NC(c(cc1)ccc1F)=O,0 F3152-3052,O=C(CCC(OCCc1ccccc1)=O)Nc1nccs1,2 F6475-3712,Cc(cc1)cc2c1nc(-c(cc1)ccc1NC(c1cc(OC3CCOCC3)ncc1)=O)s2,2 Z2331211399,O=C(c1csc(C2CCCCC2)n1)N1C2(CCC2)CC1,2 Z3046636618,NCC(CC1)CCN1C(N[C@H](Cc1c2cccc1)[C@@H]2N)=O,0 Z961209924,CC(c1cccc2ccccc12)N(CC1)CCC1C(NCC#C)=O,0 Z3537724208,C[C@]1([C@H](CC2)O[C@H]2C1)C(NCCC(N1)=NNC1=O)=O,2 Z1319011399,O=C(c1cnc2n(Cc3cnccc3)ncc2c1)NCCCc(ccc(Cl)c1)c1Cl,2 Z1154773666,CCn1c(C)nc(S(NCCc2cc(C(O)=O)ccc2)(=O)=O)c1,0 F6539-3496,Cc(c(NC(C(NCc(cc1)ccc1-c1cocc1)=O)=O)ccc1)c1Cl,0 S625-0034,CN(C[C@@H](C1)O)[C@@H]1c1nnc(C2)n1CCN2C(c1c(cc[nH]2)c2ccc1)=O,2 Z3344733078,Cc1nccn1-c1ccc(CNC(N2CCCC2)=O)cc1,0 Z2963396964,OCC(c1c(C(F)(F)F)cccc1)NC(c1n[nH]c2c1CCC2)=O,0 T158-0811,CC(C)n1c(C(CC2)CN2S(c(cc(cc2)OC)c2OC)(=O)=O)ncc1C,0 Z2319504672,Cc1nc(NC(C(CCc2ccc3)c2c3OC)=O)nc(OC)c1,2 F6523-3059,O=C(CSc1c[nH]c2c1cccc2)NCCN(Cc(cccc1)c1OC1)C1=O,2 Z2846172636,CCS(NCCn1nnc(C(c2ccccc2)O)c1)(=O)=O,0 F6560-0376,O=C(Nc1cccc2cccnc12)N(C(CC1)C2)C1CC2Oc1ncccc1,2 P048-1476,O=S(c(cc1)cn2c1nnc2)(N(Cc(cc1)ccc1F)c(cc1)cc2c1OCCO2)=O,0 L422-0443,O=C(c1noc(COc(cc2)ccc2NC(c(cccc2)c2F)=O)c1)NC1CCCCC1,0 F6359-1862,Cc1noc(C)c1CC(N(CC1)CCC1Oc1ncccc1C#N)=O,2 Z2766251217,O=C(c(nccc1)c1F)NC[C@@H](CC1)O[C@@H]1c1ncn[nH]1,0 F6677-2708,Cc1cn(CC2CN(Cc(cccc3)c3F)C2)nc1,0 F5954-0043,C(CNc1nnnc2c1cnn2-c1ccccc1)c1cccs1,2 S664-4962,N#Cc1c(CN(CC2)CCC2(CC2)C2O)cccc1,0 K212-0045,O=C(c1cccc(F)c1C1=O)N1c(cc1)cc2c1oc(-c1ccccc1)n2,2 F2147-0166,CCOC(C(Cc1ccccc1)(C1)CNc2c1cccc2)=O,2 S722-0661,O=C(c(cc1)cc2c1[nH]cc2)N1CCC(Cc2ccc(CN3CCOCC3)cc2)CC1,2 F6481-3774,O=C(c1noc(-c2cnccc2)c1)N(CC1)CCSC1c1ccco1,2 Z4658051149,CC(C)C1(CC1)C(NCC(C1)OC2(CCC2)CN1c1nc(C)ncc1)=O,2 Z2951526451,CCCC(c1ccccc1)NC(CN1CC(CN(CC2)CC2O)CCC1)=O,2 V015-0999,CCC(C)NC(c(cc(cc1)NC(Nc(cc2)cc(Cl)c2F)=O)c1N1CCCC1)=O,2 E882-1424,CNS(c1cn(CC(Nc2c(CCCC3)c3ccc2)=O)cc1S(NC)(=O)=O)(=O)=O,2 Y031-7265,CCCCNC(C(CCC1)CN1C(C(C)(C)C)=O)=O,0 Z246837288,CC(N(CC1)CCN1C(c1ncc(C(F)(F)F)cc1)=O)=O,0 Z382925082,NS(c1ccc(CCNC(C2OCCOC2)=O)cc1)(=O)=O,2 Z3338566988,CC(CC1)c(ccc(S(Nc2conc2C)(=O)=O)c2)c2N1C(C)=O,2 SC42-0072,Cc1nc(CC2CC(CC3)(CCN3C(c3cocn3)=O)OCC2)no1,2 F6446-1311,Cc1noc(C)c1CC(NCC(CCC1)CN1c1nccs1)=O,2 T408-0500,CCCn1nc(C)c(CNC(C(CC2)Cc3c2sc(C(N2CCOCC2)=O)c3)=O)c1,2 SB75-1515,Cc1noc([C@]2(C[C@@H](C3)NS(C)(=O)=O)[C@@H]3CN(Cc3ccccc3)C2)n1,0 F6753-2617,COc(cc12)ccc1nccc2N(CCC1)CC1C(N1CCOCC1)=O,0 F6679-1958,CC(C)(C(N(CC1)CC1Oc(ccnc1)c1F)=O)Oc(cc1)ccc1Cl,0 K784-2916,CCc1c(CC)nc(cc(cc2)C(NC3C(C)CCCC3)=O)c2n1,2 Z2331581956,CCc1c(C)ccc(NC(c2c(C)cnn2C)=O)c1,0 Z1978442705,Cc1cc(C)nn1Cc1cccc(C(N[C@@H](C2)[C@H]2c2cnccc2)=O)c1,2 Z4884575342,N#Cc1cc(Br)cc(S(NC(Cn2nc(C(F)F)cc2)=O)(=O)=O)c1,0 Z2912030127,OCc1cccc(C(N[C@@H](CC2)Cc3c2ncs3)=O)c1,0 Z3543947637,O=C(C(CCC1)c2c1[nH]cn2)N(CC1)CC1c1cccc(C(F)(F)F)c1,2 3879-6114,CC(C)COC(C(C1c2cccs2)=C(C)NC(CCC2)=C1C2=O)=O,0 Z2252681035,O=C(c1c(CCC2)n2nc1)N(CC1)CC=C1c1ccccc1,2 D753-0124,CC(C)N1N=C(CC(N[C@H]2CC[C@H](CN(Cc3c4cccc3)C4=O)CC2)=O)c(cccc2)c2C1=O,2 SC68-1711,O=C(c1c[nH]nc1-c(cc1)ccc1F)N(C1)CC2(CCCCC2)C1c1nncn1CC1CC1,2 Z1070061218,Cc1noc(CCC(N(CCC2)CCC2c2ccccc2)=O)n1,0 Z1975306118,CC[C@H](C1)[C@@H]1NC(NCc(nccc1)c1S(C)(=O)=O)=O,2 SB71-0602,CC(C)NC(c1nn(CCN(C2)S(c3cc(CCC4)c4cc3)(=O)=O)c2c1)=O,2 G741-0312,O=C(CN(C(C1)=O)c(cccc2)c2N1C(NCc1ccccc1)=O)NCCN1CCCCC1,2 D264-0720,Cc1ccc(CN2CC(CNC(Nc(ccc(OC)c3)c3OC)=O)CC2)cc1,0 Z1276779044,CN(CC1)CCC1(CNC(Nc1cccc(F)c1)=O)N1CCCCC1,2 F6556-8858,O=C(c1cocc1)NC(c1cscc1)c1cccs1,2 F6660-0067,Cc1cc(C)nn1CCc(nc1-c(cccc2)c2N2Cc(cccc3)c3Cl)nn1C2=O,0 F6415-0354,COCCN(Cc1cocc1)C(Nc(cccc1)c1F)=O,0 Z3294796843,Cn1nc(C2CC2)cc1S(N(CCC1)[C@@H]1C(F)(F)F)(=O)=O,2 J106-0302,O=C(C(CC1=O)CN1c1n[nH]c2c1cccc2)NCCn(cc1)c2c1ccc(Cl)c2,2 D076-0240,O=C(COc(cccc1)c1Cl)N(Cc(cccc1)c1F)C(CC1)CS1(=O)=O,0 Z968885116,NS(c1cn(CC(NCC(c2ccccc2)c2ccccc2)=O)nc1)(=O)=O,2 Z126982264,O=C1NN=CC(NCc2ccccc2)=C1Cl,0 F6524-6672,CCOc(cc1)ncc1-c1noc(CNC(c2cnc(C(F)(F)F)cc2)=O)n1,0 F6257-6737,O=C(NCCOc1ccccc1)N(CC1)CCN1c1ncnc(C2CC2)c1,2 F6360-9208,O=C(c1cc(Br)cnc1)N(C1)CC1Oc1cnccc1,0 Y043-5520,Cc(c1c2)coc1c(C)c(O1)c2C(C)=C(CC(Nc(cc2)ccc2OCCN(C)C)=O)C1=O,0 F6247-0711,O=C(c1c(-c2ncccc2)n(-c(cccc2)c2F)nn1)Nc1cc(OC(F)(F)F)ccc1,0 F6604-0793,CN(C(C1)CN1c(cc1)nn2c1nnc2)c1ncnc2c1CCC2,2 F6487-0219,O=C(C1Oc(cccc2)c2OC1)NCC(C1)OCc2c1cccc2,2 F6476-3260,Cc(nccc1)c1C(N(CC1)CC1Oc1nccc(C(F)(F)F)c1)=O,0 Z3560301148,C[C@H]1N[C@@](CNc2nc(-c3ccccc3)ncc2)(CO)COC1,2 Z223-0110,O=C(Cn1ncc2c(N3CCCC3)ncnc12)Nc(cc1)cc2c1OCCO2,2 Z1445489963,OC(C(CC1)CCN1C(c(cc1)ccc1NC(CC1C=CCC1)=O)=O)=O,2 Z952641134,Cc1c(C(NC2CN(CC(F)(F)F)CC2)=O)sc(N=C2N3CCCCC2)c1C3=O,2 Z647301550,COc(ccc(CNC(c1cc(CC#N)ccc1)=O)c1)c1C(O)=O,0 Z814126204,CN(Cc1cc2ccccc2cc1)C(NCCNC(c(cc1)ccc1F)=O)=O,2 Z745091474,Cc(cccc1)c1C(NC(CC1)CCN1C(NCc1nc(C)ncc1)=O)=O,2 F6524-0512,O=C(Cc(cc1)cc2c1OCO2)NCCN(C=Cc1c2occ1)C2=O,2 SA24-0093,CCn1nc(C)c(-c2cc(C(N(C3)CC3N(C3)[C@H](CO)CC3(F)F)=O)no2)c1C,0 F1790-0051,O=S(c1c(NCC2OCCC2)oc(-c2ccco2)n1)(c(cc1)ccc1Br)=O,0 D163-0032,CC(C)C(C(CN1CCOCC1)c(cc1)ccc1Cl)(c(cc1)ccc1OC)O,0 S248-3821,COc1ccc(C2(CC2)C(N2CC(Cc3noc(C4CCOCC4)n3)CC2)=O)cc1,0 F2616-0927,O=C(C(Nc(cccc1)c1Cl)=O)NCCCn1cncc1,0 Z1474146073,O=C(CCc1ccccc1)N(CC1)CCC1C(NC(CCC(N1)=O)C1=O)=O,2 F6572-1776,O=C(c1cc(F)cnc1)NC(C1)CN(C2CC2)C1=O,2 L310-0262,CCOc(cc1)ccc1N(C)S(c(cc(c(N1Cc2noc(C)n2)c2)OCC1=O)c2Cl)(=O)=O,0 Z1302663683,O=C(c1cccc2cnccc12)NCC1(CCOCC1)c(cc1)ccc1Cl,2 Z2440215510,O=C(c1c(C2CC2)n(-c2ccccc2)nc1)NCCC1CNCC1,2 F2599-0122,Cn1c(SCC(c(cc2)ccc2Cl)=O)nc(C(N2C)=O)c1N(C)C2=O,2 F6783-0092,N#Cc1ccnc(N2CC(CN(C3)c4nccs4)C3C2)n1,2 Z4438322369,O=C(CN(C=Nc(c1c2)cc(F)c2Cl)C1=O)Nc1nccnc1,0 F2227-0165,Cc1nnc(-c2cc(cccc3)c3n2Cc(c(F)ccc2)c2Cl)o1,0 SA85-1111,CC(C)CN(CC(CN(C1)C(c(cc2)ccc2N(CCCC2)S2(=O)=O)=O)O)C1=O,2 S606-0268,O=C(CCC1CCCC1)N(CC1)C[C@@H]1N(c(nccc1)c1N1CC2CC2)C1=O,2 Z3134116588,N[C@@H](C1)[C@@H](C2)[C@@H]2[C@@H]1C(N1Cc2c(C(F)(F)F)ncn2CC1)=O,2 Z1934714413,CC(C1)OC2(CCOCC2)CN1C(c(cc1)ccc1-n1nc(C)c(Br)c1C)=O,2 SA57-1225,O=C(CCC1CCCC1)N(CC1)CCC1(C1)OCCC1Oc1ncccn1,2 Z1987429852,OCC(CCN(C1)C(CCNS(c2cccs2)(=O)=O)=O)C1O,2 Z3173914289,OC([C@@H](CC1)C[C@@H]1C(N(CC1CC1)Cc(cc1)cc2c1OCO2)=O)=O,2 F5316-0025,O=C(C(c1ccccc1)c1ccccc1)NCCCS(N(CC1)CCN1c1ncccn1)(=O)=O,2 Z3584457246,CCC(Nc1ncc(C2(COC2)O)s1)=O,2 F6446-0395,COc1cccc(NC(NC(CC2)CN2c2ncccc2)=O)c1OC,0 Z1966526800,CC(CC1)=C(C)CN1C(NCc1cc(Cl)c2OCCOc2c1)=O,0 F6515-2574,O=S(c(cccc1)c1Cl)(N1C(Cn2nccn2)CCC1)=O,0 L388-0131,Cc1c(CN(C=Nc2c3oc4c2cccc4)C3=O)nc(-c2ccccc2)o1,0 G826-0367,CCOc(cc1)ccc1NC(C(CC1)CCN1c1nccc(C(N2CCCC2)=O)c1)=O,0 C799-0755,O=C(C(CC1)CCN1c1nc2cccnc2s1)NCCCN(CC1OCCC1)Cc1cccs1,2 Z1021187528,OC(CNC(c1ccco1)=O)(C(F)(F)F)c1ccccc1,0 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D454-0085,O=C(COc(cccc1)c1Cl)Nc1cc(N2Cc3nc(cccc4)c4n3CC2)ccc1,0 G394-0059,Cc1c(C(NCCN2CCOCC2)=O)sc2ncnc(N3CCN(C)CC3)c12,2 J098-1319,CS(N(CC1)c(cc(cc2)Cl)c2OC1C(NCCSc1ccccc1)=O)(=O)=O,0 F6507-9164,CC(C)(C)NC(C(NCC1(CCSCC1)OC)=O)=O,0 Z2597404198,CCCC1(CO)CN(Cc2c(C(O)=O)scc2)CC1,2 F6764-3278,C(c1noc(C2CC2)c1)N1Cc2cc3cccnc3nc2CC1,2 F5582-0114,Cc(cc1)ccc1C(N=CN1CC(c(cc2)cc3c2OCO3)=O)=CC1=O,2 S576-0499,COCCN1N=CC(N(CC2)CC2C(Nc(cc2)ccc2N2CCOCC2)=O)=CC1=O,0 Z363643224,O=C(c1cn(-c2ccccc2)nn1)NCc(cc1)cnc1-n1cncc1,2 F6573-2831,O=C(Cc(cc1)cc2c1OCO2)NCCOCCn1nccc1,2 Z3044721338,CC(CNCC1(CCC1)O)(c1cccc(F)c1)O,0 M867-1159,Cc(cc1)cc(Cl)c1NC(CN(c1csnc1C(N1C2CC2)=O)C1=O)=O,0 Z2012485921,O=C(c1cccnc1Sc(cc1)ccc1Br)NC(C1)C(CCCC2)N2C1=O,2 Z2715426525,Cc(cc1)c(C(F)(F)F)cc1C(Nc1nnc(C2CC2)n1C)=O,2 E852-3344,CC(Cn(c1c2)nc2C(NCc(cc2)ccc2SC)=O)(C(NCc2ccc(C)cc2)=O)N(C)C1=O,0 Z2442948973,Cc(sc(cc1)c2cc1Cl)c2S(N(C)C1CCNCC1)(=O)=O,2 Y040-2779,CC(C(N(Cc1c(C2)cccc1)C2C(O)=O)=O)N(C(c(cccc1)c1N1)=O)C1=O,0 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Z1548887165,O[C@@H](C(NCC(N1CCCC1)=O)=O)c1ccccc1,0 S649-0869,O=C(c1nccc2ccccc12)N(CC1)CCC1N(C1)C2(CCOCC2)C1OCC1CC1,2 S976-1135,O=C(C1(CN(Cc2cc(F)cc(F)c2)CCC1)F)NCC1CC1,2 Z4967877331,COc(cc(c(F)c1)F)c1SCCCN(c(cccc1)c1N1)C1=O,0 S924-0019,Cc1noc(C)c1CN(C(CC1)(CC2)CCN2C(Nc2cccc(Cl)c2)=O)C1=O,2 Z1155437159,Cc(ccc(C1(CCCC1)C(NCCN(CC1)CCS1(=O)=O)=O)c1)c1OC,0 5782-4261,CC(CC1C(N2c(cccc3)c3OCC(c(cc3)ccc3Br)=O)=O)=CCC1C2=O,2 Z2916643618,O=C(C1=CN=C(C2CC2)NC1=O)N(CC1)CCOC1C(F)(F)F,2 F6492-0133,O=C(C(CC1)Cc2c1[nH]cn2)NCc1cccs1,2 Z825947770,COc1ccc(C2(CCOCC2)C(NCc2c(N3CCOCC3)nccc2)=O)cc1,0 F5822-0545,Cc1nccn1CC(CC1)CCN1C(CSCc1ccccc1)=O,2 F6512-1461,CCN(CCN(C(NC1Cc2ccnn2CC1)=O)C1=O)C1=O,2 F6178-2010,CS(NCC(CC1)CCN1c1ncccc1C#N)(=O)=O,0 Z2413465953,Brc1c(C2(CC2)c2noc(C3NCCC3)n2)cccc1,2 SD25-0248,O=C(CCC(CN(C1)S(c2cnccc2)(=O)=O)C11CCCCC1)NC1CC1,2 F5526-0097,CCOc1c(C(NCCOc2ccccc2)=O)c2ccccc2cc1,2 F2743-0935,CC(C1)N(C(C2=CC=CN(Cc(cccc3)c3Cl)C2=O)=O)c2c1cccc2,2 F6471-3742,CCN(C=C1C(N(C2)CC2Oc2nccs2)=O)c(nc(C)cc2)c2C1=O,2 F3386-2394,CCOc(c(C)c1)cc(S(N(C)C)(=O)=O)c1OCC,0 C130-0313,COc1cccc(-c2cc(C(F)(F)F)nc(N3CCN(Cc4ccccc4)CC3)n2)c1,0 Z3686187537,CCN(CC)C(N[C@H](CC1)CN1C(NC(N1C)=O)=CC1=O)=O,0 Z1272290797,O=C1NC(Nc2cn(Cc3ccncc3)nc2)=Nc2c1cnn2-c1ccccc1,2 F5854-4916,COCCN(Cc1cscc1)C(NCc(cc1)ccc1Cl)=O,0 Z2094346320,CCC[C@@H](C(N)=O)NC(c1cnc[nH]1)=O,0 F616-0508,O=C(c(cc1)ccc1N(C(C=C1)=O)N=C1Sc(cc1)ccc1Cl)NC1CCCC1,0 F2609-2191,O=C(CSc1ccccc1)N(CC1)CCN1c1nc(c(F)cc(F)c2)c2s1,0 S457-0892,O=C(c1ccc[nH]1)N(CCC1)CC1n1nnc(-c2nc(C3CC3)no2)c1,2 F6369-0469,Cc1noc(C)c1CCC(OC(C1)CN1c1nc(c(C(F)(F)F)ccc2)c2s1)=O,2 S970-0469,Cc1noc(C)c1Cc1ccc(C(N(CC(C2)(F)F)[C@@H]2c2nncn2CC2CC2)=O)o1,2 F6573-8762,O=C(c1ccco1)NCc1cncc(-c2cocc2)c1,2 Y043-5302,N\1(C(c2c(\N=C1)cccc2)=O)[C@H](C(=O)NCCc1n(c2c(n1)cccc2)C(C)C)C,2 F6739-7759,CN(Cc(cc1)cc2c1OCCO2)c(n1C)nc2c1nccc2,2 Z2184886830,OCC(C1CCCC1)NC(Cc1c2OCCc2cc(Cl)c1)=O,2 F6680-2593,O=C(CN(CC1)S(c2cccc(Cl)c2)(=O)=O)N1c1cc(C(F)(F)F)ncc1,0 Z4119259685,Cc(cc1)cc(F)c1C(NCCn1nnc(-c2ccccc2)c1)=O,0 Z2437342885,Clc1cnc(CN(CC2)C[C@H]2Oc2ccccc2)cc1,0 Z3860991034,CC1(COCC1)N(C)C(c1cccnc1Cl)=O,0 SC40-0048,COCc1c(COC(CC2)(CCN2C(c2nc3ccccc3cc2)=O)C2)n2nn1,2 F2458-0034,CN(CC(Nc(cc1)cc(OC)c1OC)=O)S(c1cccc2cnccc12)(=O)=O,0 V008-8402,COc(cc1)ccc1NC(N(CC1)CCN1c1c(ccc(Cl)c2)c2nc(-c(cc2)ccc2F)n1)=O,0 Z1829169409,CC(c1ncnn1C)NC(N1CCC(Cc2cccc(F)c2)CC1)=O,2 Z3290588681,CC(C)(C1)CC1(C(Nc1cn(Cc2ccccc2)nc1)=O)O,2 F6495-4567,O=C(C(C1)CN1c1ncnc(-n2cncc2)c1)NCCc1csc(-c(cc2)ccc2F)n1,2 F6573-4249,O=C(CCc(c(Cl)ccc1)c1Cl)NCCOCCN(C(CC1)=O)C1=O,0 F6436-1601,O=C(C1CC1)N(CC1)Cc2c1ccc(NC(c(cccc1)c1S(C(F)F)(=O)=O)=O)c2,0 Z1269132375,OC(c1cnc(cc(cc2)Br)c2c1)=O,0 Z2707913179,CC(CC1)(CCC1(F)F)C(N(CC1)CC1Oc1ncccc1)=O,2 F6425-0194,O=C(c(cc1)nnc1-n1ncnc1)N(Cc1ccccc1)c1ncccc1,2 F3226-1733,CN(C)CCN(C(C(C(c1cc(cccc2)c2o1)=O)=C1O)c2cccc(Cl)c2)C1=O,2 F6442-2403,CN(c1c(C(N2C)=O)n(CC(N(C3)CC3S(Cc3ccco3)(=O)=O)=O)cn1)C2=O,2 F2514-0596,O=C1N(Cc2cc(C(F)(F)F)ccc2)C=Nc2c1cnn2Cc(cccc1)c1F,2 F6155-0850,Cc1c(C)sc(NC(C(C2)CN2c2nc(c(C(F)(F)F)ccc3)c3s2)=O)n1,2 F2189-0998,Cc(cc1)ccc1S(N(CC(O)=O)Cc1ccccc1)(=O)=O,0 P913-0333,O=C(C1)N(Cc2ccccc2)CC1c1noc(-c2ccccc2)n1,0 8012-3645,CCC(CC1)Cc2c1c(C(N(c1ccccc1)C(SCc(cc1)ccc1OC)=N1)=O)c1s2,0 F6414-1389,COc1c(CNC(C(NCC(CC2)(Cc3c2cccc3)O)=O)=O)cccc1,2 F6672-1724,CC=C(CC1CC2)CC2N1c1c(C)c(C)nc2ncnn12,2 Z2004573046,CN(c1c(N2)ncc(-c3cc(C(N(C(CC4)C5)C4C=C5c4ccccc4)=O)ccc3)c1)C2=O,2 F6258-0206,CC(N=CN1CCNC(C(CC2=O)CN2c2cccc(Br)c2)=O)=CC1=O,2 Z2658000896,CSCc(cc1)ccc1NC(c1cnc2n1CCCCC2)=O,2 Z1310917624,CC(C(N1C2(CCC2)CC1)=O)S(C)(=O)=O,0 Z2916152188,CN(CC1CC2)CC2N1C(c1cc(C(N2C3CN(C)CC2CC3)=O)n[nH]1)=O,2 Z1802526229,CC(C)Oc1ccc(C(C)NC(N(C2)CC2NC(C)=O)=O)cc1,0 SD06-0402,O=C([C@@H](C[C@H](COc1cnccc1)C1)[C@H]1NC(C1CCOCC1)=O)NC1CCCC1,2 Z1689157757,COC1(CCCC1)c1noc(Cn2nnc3c2cccc3)n1,2 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T501-1261,O=C(CCCc1nc(cccc2)c2s1)N1CC(Cc2nncn2CC2CC2)CCC1,2 Z1272133912,CC(CNc1cc(Br)cnc1)O,0 Z1404668554,CCOc(cc1)ccc1S(N1C(CC(O)=O)COCC1)(=O)=O,0 F6521-4094,CC(CNC(NCc(cc1)ccc1F)=O)(c1cc(cccc2)c2o1)O,0 S896-0674,CCCC(C)C(NC(CC1)CCN1c1nc(C2CCCC2)nc2c1CCOCC2)=O,0 Z2955885810,CC(C)([C@@H]([C@@H]1CCC2)N2C(Nc(cc2)ccc2-c2nocc2)=O)[C@H]1O,2 L680-0015,Cc1cc(S(N2CCN(Cc(n3-c(cc4)ccc4OC)nc4c3nccc4)CC2)(=O)=O)c(C)cc1,0 S897-0100,CCc1nc(CCOCC2)c2c(OC(CC2)CCN2C(NCCc2ccccc2)=O)n1,2 M100-0403,CN(C(C=C1)=O)N=C1c1csc(S(N(CC2)Cc3c2cccc3)(=O)=O)c1,2 F6412-1660,O=C(c1ccc(Cn2cncc2)cc1)NCC#CCOc1cccc(C(F)(F)F)c1,2 F2553-0130,CSc(cccc1)c1C(Nc1cc(-c2nc(cccc3)c3[nH]2)ccc1)=O,0 Z3709771061,CN(Cc1ccccc1)C1(CNC(N(C)C(N(C)C2=O)=O)=C2C#N)CCCCC1,2 SA63-0615,CN(C)CCC1CC(CC2)(CCN2C(CCC2CCCC2)=O)OCC1,0 Z1846054517,CCc1cccnc1NC(c1cn(C(C)(C)C)nn1)=O,0 H025-0464B,CN(CC1)CCN1S(c(cc1)cc2c1[nH]c1c2CN(C)CC1)(=O)=O,2 Z1455671160,NCCNC(c1cc(cccc2)c2o1)=O,0 Z1785643430,OC(c1c(C(CC2)CCN2C(c(cc2)ccc2Cl)=O)cccc1)=O,0 Z2256305128,CN(C(Cc1ccccc1)C(O)=O)C(CCc1cccs1)=O,0 Z1000942566,CC(C(N1)=O)(c2cccc(CNC(CCC(N(C3)c(cccc4)c4NC3=O)=O)=O)c2)NC1=O,2 E629-0196,O=C(Cn(c(-c1cccs1)c1)c2c1cccc2)NCCCN(CC1)CCC1N1CCCCC1,2 Z3051938686,CC(C)(C)c1cccc(C(Nc2nn(CCCC3)c3c2)=O)n1,0 M333-0397,Cc1c(-c2cc(S(N(CC3)CCN3C3CCCCC3)(=O)=O)c(C)s2)[nH]nc1C,0 Z785210610,O=S(c1c[nH]c2c1cccn2)(N(CC1)CCN1c1nc(-c2ccccc2)nc2ccccc12)=O,2 F0780-0242,COc(cccc1)c1NC(CSc(ccc(Cl)c1)c1Cl)=O,0 Z1256483761,CC(NCCNC(CCC(N(CC1)CCN1C(c1c(C)c(cccc2)c2s1)=O)=O)=O)=O,0 F312-0183,O=C1Oc(ccc(Br)c2)c2C=C1S(N1CCC(Cc2ccccc2)CC1)(=O)=O,2 L598-0856,CC(CCCC1)N1S(c(cc(cc1)-c2csc(C)n2)c1OC)(=O)=O,2 S898-0337,CC(C)CNC([C@H](C1)NC(CC2)(CCN2C(CCn2ncc(C)c2)=O)c2c1[nH]cn2)=O,2 Z1383887420,C(c1ccccc1)N(CC1)CCN1c1ncnc2c1CCCCC2,2 SC19-0700,CCn1nc(CN(CC2)CCC2NC(Nc(cc2)cc3c2OCCO3)=O)c2c1CCOC2,2 F0017-1156,CCN(CC)CC(Nc1c(C)cc(C(C)(C)C)cc1C)=O,0 Z2118598538,O=C(c1cn(CCF)nc1)N(CCC1)CC1NC(c1cc2ccccc2cc1)=O,2 Z2216973917,CCc1nc(CN(C)Cc2ccc(C(O)=O)s2)cs1,0 F6724-0089,C(C(c1cccs1)N1CCOCC1)Nc1nc(cncc2)c2s1,2 F6760-2870,COc1cccc(CCNC(c2nnc(CCOC3)c3c2)=O)c1,2 G673-0036,CC(c(cc1)ccc1NC(CN1c(cc(cc2)C(N(C)C)=O)c2N(CCCC2)C2C1=O)=O)=O,2 Y205-9938,CC(CN(CC1)S(c(cc2)cc(F)c2F)(=O)=O)N1c1ccc(C)cc1,0 Z2256425355,Cc(nc(-c1ccccc1)nc1)c1C(N[C@@H](CCC1)[C@@H]1C(O)=O)=O,0 F6178-5676,CN(C=CC=C1C(NCC(CC2)CCN2c2nc(cccc3)c3o2)=O)C1=O,2 Z2344592955,CC(c1nc(C)n[nH]1)Sc1nc(cccc2)c2c2nc(C)nn12,2 F6472-7057,Cc1nn2c(CCN(C3)C(c4cccnc4SC)=O)c3cnc2c1,0 SA73-0591,O=C(c1ncncc1)N(CC1)CCC1(CC1CC1)c1noc(C2CCOCC2)n1,2 Z2350619069,CN(Cc1noc(C2CC2)n1)C(C1(CCCCC1)O)=O,2 Y502-7184,CCn1nc(C)c(C(C)NC(C(CCC2)CN2S(c2cn(C)nc2)(=O)=O)=O)c1,0 V010-9829,CC(C)(C)OCC(CN(CC1OCCC1)Cc1ccc(C)cc1)O,0 F6755-0901,Cc1cc(CN(CC2)CCN2c(cc2)cc(Cl)c2Cl)no1,2 Z1954814672,CC(CC1)(CN1C(c1c(C)oc(-c(cc2)cc(Cl)c2Cl)n1)=O)C(N)=O,2 SD15-0472,CN(CC(N(C)[C@@H]1[C@H]2CCN(Cc3cocc3)C1)=O)C2=O,2 F6564-5739,O=S(C1CCCCC1)(N(CC1)CCN1c1nnc(C2CC2)cc1)=O,2 C060-0059,CC(CCC1)CN1C(CCCNC(CN(C=Nc1c2c(C)c(C)s1)C2=O)=O)=O,2 F6809-2328,CCc1cnc(N(CC2)CCN2c2c(C)cccc2)nc1,0 F2758-0710,O=C(c1ccno1)NCC(c1c2cccc1)=NN(C1CCCC1)C2=O,2 F6560-8275,Cn1ncc(-c2ncc(CNC(c3c4OCCOc4ccc3)=O)cc2)c1,2 F6514-6819,O=C(NC(Cn1nccn1)c1ccccc1)Nc(c(F)ccc1)c1F,2 Z734929386,O=C(c1cncc2ccccc12)NCCc1ccco1,0 Z2294547432,CC(CC(NC)=O)NC(N1CCC(Cc(cccc2)c2C(OC)=O)CC1)=O,0 Z2027521483,COC(Cc(occ1)c1C(Nc1nc(CCCCCC2)c2s1)=O)=O,2 D718-0032,O=C(C(C1)Nc2ncnn2C1=O)Nc(cc1)cc(Cl)c1F,0 SB70-0930,COCCNC(c1nn(C[C@H](C2)NC(c3cc([nH]cc4)c4cc3)=O)c2c1)=O,0 F6559-0507,Cn1c(C(N(CCC2)CC2N(C=Nc2c3cccc2)C3=O)=O)ccc1,2 F6221-0085,O=C(c1ccncc1)Nc1cnc(-n2cncc2)nc1,2 F5103-0023,O=C(C1(CC(C2)C3)CC3CC2C1)NCc1cscc1,2 Z1617011247,Cc1c(C(NCc(cccc2)c2N2CCCCC2)=O)c(-c(cccc2)c2Cl)no1,2 F6472-0554,CC(C(NCCSC1CCOCC1)=O)Oc1ccccc1,0 S511-0722,O=C(CCCc1c[nH]c2c1cccc2)N(CC1)CCC11OCCC(CC(N2CCOCC2)=O)C1,2 F6678-8466,Cc1nc(cccc2)c2n1C(C1)CN1C(c(cc1)ccc1S(N(C)C)(=O)=O)=O,0 Z1670029082,O=C(CCn1ncc(Cl)c1)Nc1c(CN(C2)C3CC3)c2ccc1,0 Z4158194300,C([C@@H](CCC1)N1c1ncncc1)Oc1ccccc1,0 SA93-0963,COCCC(CCC1)(CN1C(CC1)CCN1C(Nc(cc(cc1)F)c1F)=O)C(N)=O,0 Z4327152664,CC(CNC(CCC1CCC1)=O)n1nnc(-c2ccncc2)c1,2 Z1269157473,NCCc1csc(cc2)c1cc2Br,0 E711-0338,O=C(c1c(CCCCC2)n2c(-c(cc2)ccc2Cl)n1)N(CC1)CC1c1ccccc1,2 F6605-0216,Cc1cc(C)nn1C(C=C1)=NN(CC(C2)CN2c(ccnc2)c2Cl)C1=O,2 L805-0042,O=C(c(cc1)ccc1N(C(C=C1)=O)N=C1N1CCCC1)NC1CCCC1,2 Z1890660002,CCCc(cc1)ccc1N(CC(C1)c2nc(CC(NCc(cc3)ccc3OC)=O)no2)C1=O,2 F5327-0055,COc(ccc(C(NCC1(CCOCC1)c1ccccc1)=O)c1OC)c1OC,0 F6608-0360,FC(c1ccnc(OC2CSCC2)n1)(F)F,0 F2257-0291,O=C(c(cccc1)c1Br)Nc(cc1)cc(C2)c1NC2=O,0 L553-1798,CC(CC(C)C1)CN1c1c(c(C)no2)c2nc(CCC(NCCCN(CCC2)C2=O)=O)n1,2 Z1903462354,O=C(Nc(cc1)cnc1Oc1cccc(F)c1F)N(CC1)CC2N1CCOC2,0 Z3989662907,CC(CN(C1)C(C2(CC2)c2cc(C)ccc2)=O)C1NC(Cc1nonc1C)=O,2 Y042-2795,O=C(CNC(C1Oc(cccc2)c2OC1)=O)Nc1nc(cccc2)c2[nH]1,2 F6559-0131,Cn(cc1)c2c1C=CN(CCNS(c(cc1)ccc1-n1nccc1)(=O)=O)C2=O,2 F6573-6363,O=C(c(cc1)ccc1-n1cccc1)N(CC1)CCC1(C1)C1(F)F,2 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Z1320204558,Cn1ncc(CC2CN(CC(Nc(cc3)cnc3N3CCCCC3)=O)CC2)c1,2 F6549-8696,O=C(c1cc(Br)cs1)N(C(CC1)C2)C1CC2Oc1cnccc1,2 Z223317374,Cc1nc(cc(cc2)NC(CCC3CCCC3)=O)c2[nH]1,2 F6488-2582,CC(C)(C)OC(N(CC1)CC1Oc1nc(N(C)C)cnc1)=O,0 SB47-0636,CCC(CC)N(C[C@H]1CN(C2)C(c3ccccc3)=O)C[C@]12c1nc(C)n[nH]1,0 F6414-3907,CC(CNS(c(cccc1)c1OC(F)(F)F)(=O)=O)(c1cc(cccc2)c2s1)O,0 Z4462152219,OC(CCNC(C1(CCCC1)c1cccc(C(F)(F)F)c1)=O)(c(cccc1)c1N1)C1=O,2 F6573-7416,Cc1c(C(N(CCN2c3cnccc3)CC2=O)=O)sc(C)n1,2 F2365-0795,CCNC(c1csc(NC(c(cccc2)c2OCC)=O)n1)=O,0 E717-0304,CCCn1c(C(N(CC(NCCCN(Cc2ccco2)C(C)CC)=O)N=C2)=O)c2c2c1cccc2,2 Z2357395871,CC(C(N(C1)C(C)CCC1C(O)=O)=O)Oc(ccc(Cl)c1)c1Cl,0 Z2963398380,OCC(c1c(C(F)(F)F)cccc1)NC(C1(CCOCC1)O)=O,0 F6814-3343,CC(C1)N(Cc2cc(F)cc(F)c2)CCN1c1ncnc2c1cn[nH]2,0 Z3602884781,Cc(cc(cc1)OCc2ccncc2)c1NC(C(CCC1)N(C)C1=O)=O,2 SA53-0566,CC(C)C(N(CCCN(C1)C(c2ncc(C)nc2)=O)C1c1nc(C)n[nH]1)=O,2 F6395-0099,CC(C)Oc(cc1)ccc1C(N(CC1)CC1c1ncccc1)=O,0 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F6438-3645,CN(C)c1nc(CNC(CSc(cc2)ccc2F)=O)nc(N2CCCC2)n1,2 Z1729726493,CCN(CC)C(c(cc1)ccc1S(N(C1)c(cccc2F)c2NC1=O)(=O)=O)=O,0 F2004-0278,C(c1cn(cccc2)c2n1)Sc(cc1)nnc1-c1ccco1,2 Z2982784062,OCC1N(Cc2cn(-c3cc(Cl)cc(F)c3)nn2)CCC1,0 Z2936883578,Cn1ncc(Cc2nc(C3(CCC3)C(F)(F)F)no2)c1,2 F6089-9888,CC(CNC(NC1CCOCC1)=O)(c1cc(cccc2)c2s1)O,2 Z3358912210,Cc1cccc(CONC(C2c3ncnn3CCC2)=O)n1,2 M330-0741,Cc1c(C(N2CCOCC2)=O)sc(-c2cc(S(NC3CC3)(=O)=O)cn2C)n1,0 F5852-0834,O=C(C(NCCC1=CCCCC1)=O)NCCCN(CCC1)C1=O,2 S981-0532,Cn(c(CC1)c2CN1C(C1CCC1)=O)nc2NC(c1ccccc1)=O,2 S397-0268,CN(CC1)CCN1C(CN(CC1)CCN1C(c1nn(CC2CC2)c2c1COCC2)=O)=O,2 Z4089482121,Cc1cc(C(NS(c(cc(cc2)Cl)c2OCCOC)(=O)=O)=O)nc(C)n1,2 Z1470554730,Cc1c(Cc2nn(Cc3nnc(-c4cccc(F)c4)o3)nn2)cccc1,0 F2545-0422,CC(CC1)(CS1(=O)=O)N(C)C(c(cc1OC)cc(OC)c1OC)=O,0 F616-0665,Cc(cc1)ccc1SC(C=C1)=NN(c(cc2)ccc2C(NC2CCCC2)=O)C1=O,0 Z1151763205,O=C(CNC(NCc(cc1)ccc1Cl)=O)N(CCC1)CC1N1CCCC1,2 SD12-0348,COc1cc(OC)c(CN(CCN2)C(Cc3nc(-c4ccncc4)no3)C2=O)cc1,0 D398-0500,COc1ccc(C(CCC2)N2C(c(cnn2c(C(F)(F)F)c3)c2nc3-c2cccs2)=O)cc1,0 SD07-0155,CC(C)C(NCc1c(COC(CC2)(CN2C(C2CCC2)=O)C2)n2nn1)=O,0 Z2473124687,C(c1nn(CCC2)c2c1)N(CC1)CCC1c1nc(-c2ccccc2)n[nH]1,2 F6546-1865,O=C1N(Cc2ncccc2)N=C(CCSC2)C2=C1,2 F5791-1991,O=C(c1n[nH]c(-c2ccco2)c1)NCc(c(F)ccc1)c1F,2 T828-0350,CN(CCCNC(C(CC1)Cc2c1nc(N1CCCC1)nc2)=O)c1ccccc1,2 F2227-0069,Cc1nnc(-c2cc(cccc3)c3n2CC(NCc(cc2)cc3c2OCO3)=O)o1,2 Z2968038815,Cc1nc(CCC(C2)NC(N(CCCCCN3)CCC3=O)=O)c2cn1,2 Y041-7453,O=C(CN(C(CC12CCCC2)=O)C1=O)NCCc1nc(-c(cc2)ccc2Cl)cs1,2 F6471-5247,O=C(Cc1noc2c1cccc2)N(CC1)CC1n1nncc1,2 SC72-1360,CCn(cc1)nc1C(N(C1)CC11OCc2c1cnc(C)n2)=O,2 Z2860202990,OC(C1CCCCC1)C(Nc1cnc(N2CCNCC2)nc1)=O,2 F0577-0290,CCOC(C(C1c2cc(F)ccc2)=C(C)NC(N=C(N2)SC)=C1C2=O)=O,2 S690-2104,CCCN(CC1CC1)C(c1ccc(CC(CC2)CCN2C(NCC)=O)cc1)=O,2 F6249-0133,COC(N(CC1)C(C(NCc2cccs2)=O)c2c1cccc2)=O,2 Z3379656990,FC(c1cc(Cl)c(N2C(CN3CCCC3)CCC2)nc1)(F)F,2 F6573-6761,O=C(c1nc(cccc2)c2s1)N(CCN1c2ncccc2)CC1=O,2 F6702-2088,C(C(CC1)CCN1c(cc1)nn2c1nnc2)Oc1nccnc1,2 Z1251358037,CCC(Cc(cc1)cc2c1OCO2)O,0 F6571-6543,COc(ccc(C(NCC1(CC1)c1cscc1)=O)c1)c1F,0 Z31603016,Cc(nc1)cnc1C(N(CCN1)CC1=O)=O,0 L679-0195,COc(cc1)cc(NC(N2CCN(Cc3nc4cccnc4n3-c(cc3)ccc3F)CC2)=O)c1OC,0 F6564-3757,CC(C(N(CC1)CCN1S(C1CC1)(=O)=O)=O)N1N=C(C2CC2)C=CC1=O,2 Z2760933561,CN(Cc(cc1)cc2c1OCO2)c1ncnc2c1ncn2CC(CO)O,0 F5854-4892,COCCN(Cc1cscc1)C(NC1CCCCC1)=O,2 Z2275042850,CC(C)C(N(CC1)CCN1S(CCC1CCCC1)(=O)=O)=O,0 F536-0436,CC1Oc2cc(S(N(CC3)CCN3C(c3ccnn3C)=O)(=O)=O)c(C)cc2NC1=O,2 F6497-0656,O=C(Cc(cc1)cc2c1OCO2)N1CC(Cc2nc(C3CC3)no2)CCC1,2 SC08-0048,CC(C)S(N(C1)CC1c1nc(C(CC2)CCN2S(C)(=O)=O)no1)(=O)=O,0 C660-0509,Fc(cc1)ccc1N(CC1)CCN1c1ncnc2c1nc1n2CCCC1,0 Z2982749971,CN(C)S(CCc1cn(-c(cc2)cc3c2nc[nH]3)nn1)(=O)=O,2 F6724-0467,Brc1cnc(NCC(c2cscc2)N2CCOCC2)nc1,2 Z1132015989,CCNC(CN(CC1)CCC1c(cc1)cc(F)c1F)=O,0 F6573-9276,CC(C)(C)C(NCc1nccnc1-c1ccncc1)=O,0 C561-0450,CCCN(C(c(cc1)c2cc1C(Nc(ccc(OC)c1)c1OC)=O)Nc(ccc(OC)c1)c1OC)C2=O,0 F6734-1352,O=C(c1c[nH]nc1)N(C1)CC(C2)C1CN2c(cc1)ncc1Br,0 Z2044060381,O=C(C(CC1)c(cccc2)c2S1(=O)=O)NC1(CCCC1)c1cccc(Cl)c1,0 Z4093802308,Cc1cccc(Cl)c1S(NC(CC(CC1)CCN1OC)=O)(=O)=O,0 SB74-0416,CCc1ccc(CNC([C@H](C[C@]2(CC3)CN3C(C(C)C)=O)NC2=O)=O)cc1,0 SA46-1229,Cc1cn(CC(N(C2)CC2(C2)OCC2N2CCCC2)=O)nc1,2 V009-2086,O=C(C(C1)C(CN(CC2)c3ncccn3)N2c2c1cc(C(F)(F)F)cc2)NCCCN1CCOCC1,2 Z2973695445,Cc1cc(N2CCN(CC(CCC3)S3(=O)=O)CC2)ncn1,0 Z1784497603,CC(C)c1nnc(cc2)n1cc2NC(C1Cc2cncn2CC1)=O,0 Z358295862,N#Cc(cc1)ccc1NC(CN1CCN(Cc2nc(-c3ccccc3)no2)CC1)=O,2 SC68-0187,CCn1c(C(CN(C2)C3CCCCC3)C22CCCCC2)nnc1,2 Z1494108414,Cc(cc1)nc(C)c1NC(N(C)Cc1cn(C)nc1C(F)(F)F)=O,0 T158-0242,Cc1cnc(C(CC2)CN2C(NCCc2ccccc2)=O)n1CCOC,0 Z1952194661,Cn1c(CCC(Nc2n[nH]c3c2c(-c2ccccc2)nn3C)=O)cnc1,2 F5871-2030,Cc1noc(CNC(C(CC2=O)CN2c2ccc(C)cc2)=O)n1,2 F6448-0037,O=C(c(cc1)cc2c1[nH]cn2)Nc1cn(CC2OCCCC2)nc1,2 SB70-0768,CC(C)NC(c1nn(C[C@H](C2)NC(c3c[nH]c4c3cccc4)=O)c2c1)=O,2 8019-8795,COc(ccc(C(c(c1c2)nccc1cc(OC)c2OC)NC(C1CCCC1)=O)c1)c1OC,2 F6188-0536,Cc1csc(C(NCC2(CCOCC2)Sc2ccccc2)=O)c1,2 Z1441552953,Cc1cccc(N2CCN(CCOC)CC2)n1,0 Y041-8048,N1(C(N[C@H](C1=O)CCC(N1CCN(CC1)C/C=C/c1ccccc1)=O)=O)Cc1ccccc1,2 F2644-0439,CN(c1c(C(N2C)=O)[nH]c(CN3CCC(Cc4ccccc4)CC3)n1)C2=O,0 Z2910688122,COCCn1nnc(C(N(CC2C(O)=O)Cc3c2cccc3)=O)c1,0 Z1541754256,CC(CC(CC1)C(N(C)CC(Nc2ccc(C)cc2)=O)=O)C1=O,2 K292-0795,COc(cc1)ccc1N(C1=O)C(SCC(NC2CCCCC2)=O)=Nc2c1scc2,2 F2783-0631,CC(C)CC(Nc(cc1)cc(N(CCC2)C2=O)c1OC)=O,0 Z2433681917,CC(CCC1)(CN1c1nc(-c2cc(F)cc(F)c2)ns1)O,0 Z1172551128,Cc(cc1)cnc1NC(CCC1OCCCC1)=O,0 Z3393234122,COc(cc1)cc2c1nc(N(CC1)Cc3c1c(CC(N)=O)ccc3)s2,0 F6521-4074,CC(C)NC(NCC(C)(c1cc(cccc2)c2o1)O)=O,0 L895-0253,O=C(C(CCC1)CN1c1nccnc1Sc1ccccc1)N(CC1)CCN1c1ccccc1,0 S976-1201,CCn1c(ccc(OC)c2)c2c(CN(CCC2)CC2(C(NCC2CC2)=O)F)c1,2 SA92-0833,Cn1c(CN(CCC2)CC2(c2nc(C3CC3)no2)F)ccc1,2 SA58-0397,CC(C)CCNC(N1C(CCc2noc(-c3cnccc3)n2)CCC1)=O,0 F6479-4264,Cc1cc(OC(CC2)CCN2C(CSc(cc2)ccc2F)=O)nc(C)n1,2 F6356-0821,CC(Cc1cocc1)NS(c(cccc1)c1Br)(=O)=O,0 E683-0326,Cc(c1c2)cc(Nc3cccc(Cl)c3)nc1ccc2NC(C1OCCC1)=O,2 T159-1056,CC(C)n1c(CC(CCC2)CN2S(c(cc(cc2)OC)c2OC)(=O)=O)ncc1C,0 E019-0898,CC(c1c2c(cccc3)c3s1)=NN(CCCC(N1CCC(Cc3ccccc3)CC1)=O)C2=O,2 F6257-3456,O=C(c1cc(Br)cnc1)Nc1ncnc(N(CC2)CCN2c2ccccc2)c1,2 F6472-7418,Cc1nn2c(CCN(C3)S(c(s4)ccc4Cl)(=O)=O)c3cnc2c1,2 K783-5051,CC(C)(C=C(C)N1c2c(C)cc(C)cc2)NC1=S,2 J105-0029,CC(CC1)CCN1C(C(C1(CCCC1)N1CCOC)c(cccc2)c2C1=O)=O,2 Z1444275974,CCN(CCC(O)=O)C(C(C)NC(C1CCCC1)=O)=O,0 F0907-6875,Brc1ccc(CSc2nnc[nH]2)cc1,0 SB16-0329,C(c(cc1)cc2c1OCC2)N(CC1)C[C@@H]2[C@H]1N(Cc1ccccc1)CCOC2,2 SD07-0826,CCCS(NCc1c(COC2(CN(Cc(cccc3)c3Cl)CC2)C2)n2nn1)(=O)=O,0 Z603-1954,O=C(C1CCC1)N(CC1)CC1NC(C1CCCC1)=O,2 K917-1103,CN(c(cc1)ccc1Br)S(c(cc1)cc2c1NC=C(C(NC1CCCC1)=O)C2=O)(=O)=O,0 Z1772538503,O=C(C1CC1)N(CCC1)CCN1C(Nc1cc(Oc(cccc2)c2Cl)ncc1)=O,2 F6814-6696,CC(C1)N(Cc(cc2)cnc2OC)CCN1c1nc(C2CC2)nc(C)c1,2 S614-0815,O=S(c1cccc2nsnc12)(N(CCCC1)C1c1nc(CCOCC2CC2)no1)=O,2 Z1550237485,O=C(c(cc1)cn2c1ncc2)Nc(ccnc1)c1F,0 Z2444597850,OC(c(cc1)cnc1N(CC1)CCC1C(NCc1cnccc1)=O)=O,2 Z857681680,Cc1noc(CNC(C2CCCC2)=O)c1,2 C115-0482,CN(C(C(C(NCc1ccco1)=O)c(cc1OC)c2cc1OC)c(cc1)ccc1OC)C2=O,2 F6521-4016,CC(CNC(C(NCCC1=CCCCC1)=O)=O)(c1cc(cccc2)c2o1)O,0 C648-0807,CN(c(ccc(S(N(CC1)CCC1C(N(CC1)CCN1C(c1ccco1)=O)=O)(=O)=O)c1)c1O1)C1=O,2 Z1171591060,O=C(C1CC1)N(CC1)Cc2c1[nH]nc2C(F)(F)F,0 Z2046964683,CC(C(N(CCC1)C1C1OCCC1)=O)c1c(C)[nH]nc1C,2 F6604-8484,O=C1N(CC(C2)CN2c(ncnc2)c2F)N=C(CCC2)C2=C1,2 F0696-3867,O=C(c(cc1)nnc1N1CCCC1)N(CC1)CCN1c(cc1)cc(Cl)c1F,2 Z1273108367,CC(C)(C)C(Nc1nc(CC(Nc2cccc(Cl)c2)=O)cs1)=O,0 F5017-2716,COc1ccc(CCS(NCC(CC2)CCN2C(c2cc(cccc3)c3o2)=O)(=O)=O)cc1,2 Z1658647871,OCC1(CNC(c2c[nH]c(-c3ccccc3)n2)=O)CCC1,2 Z3889367533,O=C(C(CCC1)CN1C(c(cc1C=C2)cc(F)c1NC2=O)=O)N1C(CC2)CC2C1,2 F259-0113,CC(C(Nc(cc1)cc2c1nc(NC(c1ccccc1)=O)s2)=O)N1c(cccc2)c2OCC1=O,0 F5017-0818,COc(ccc(Cl)c1)c1S(NCC1CCN(Cc2ccco2)CC1)(=O)=O,0 SC72-0184,Cc1nc(COC2(C3)CN3C(c3nn(C)c4c3cccc4)=O)c2cn1,2 Z1686711764,CC(C(NCC(F)(F)F)=O)Nc1cn(CC2OCCC2)nc1,2 F6685-8774,Cc1nc(CN2CC(COc3c(C(F)(F)F)cccn3)CCC2)co1,0 Z1739070667,CN(CCC(O)=O)S(c(c(OC)ccc1)c1OC)(=O)=O,0 Z2805439958,OC(C(C1)C2(CC2)CN1C(C1CC1)=O)=O,2 F6507-5343,CC(CNC(COc(ccc(Cl)c1)c1Cl)=O)(COC)OC,0 Z1838203455,CCC(C(Nc1cc(F)cc(F)c1)=O)C(OC)=O,0 Z45545173,CCCNS(c(cccc1)c1[N+]([O-])=O)(=O)=O,0 Z2359147017,CCN(C1CC(C)(C)C1)S(C1CC1)(=O)=O,2 F6560-7448,COc(cc1)cc(C(NCc(cc2)cnc2-c2cocc2)=O)c1Br,0 F6353-5876,O=S(c1ccc(C(F)(F)F)cc1)(NCC(c1cocc1)N1CCSCC1)=O,0 F6548-0613,Cc(cc1)ccc1-c1noc(-c(cccc2CN3C4CCCC4)c2C3=O)n1,2 F6724-3106,Cc1nc2ncnn2c(N(CC2)CCC2c2cccs2)c1,2 G663-1052,CC1Cc2cc(C(N(CC(Nc(cc3)ccc3C(C)=O)=O)C=N3)=O)c3nc2CC1,2 Z445201488,Cc1cc(C(NCCc(cc2)ccc2C(O)=O)=O)c(C)s1,0 F6559-1310,Cc1noc(C)c1C(N(CC1)CC1n1c(cccc2)c2nc1C)=O,2 Z4278251996,CC(C)(C)c(o1)ncc1S(N[C@@H](C1)CS[C@@H]1C(OC)=O)(=O)=O,0 F6514-6980,CC(C)C(Cn1nccn1)NC(Cc1cccs1)=O,2 Z1675125790,CNc1nnc(CC(NC2CN(Cc3ccccc3)CCC2)=O)s1,2 F6513-1902,Cc1cc(C)nn1-c1ccc(CCC(N(CC2)CCN2c2ncccn2)=O)cc1,2 F6353-5599,O=C(COc1ccccc1)NCC(c1cocc1)N1CCSCC1,2 Z1603667560,OC(C(c(cccc1)c1F)NC(C1=CN=C2SC(Cc3ccccc3)=CN2C1=O)=O)=O,2 Z2806306342,O[C@@H](CC[C@@H]1CC2)[C@H]1N2C(NCC(c(cc1)ccc1F)N1CCOCC1)=O,0 Z2755771494,Cc(occ1)c1-c(o1)nnc1SC(C1CCCC1)C#N,0 F6438-0471,CCc(cccc1)c1NC(Nc(c(C)n1)c(C)nc1OCC)=O,0 Z2098465774,O=C(c(cc1)cc2c1ncn2-c(cc1)ccc1Cl)N(CC1)CCC1N(CCCC1)C1=O,2 F6573-7849,O=C(CCc(cccc1)c1Br)N(CCN1c2nccs2)CC1=O,2 Z2621212831,CC(C)C(C1CC1)NC(Nc1nn(CCC#N)cc1)=O,2 Z2772054750,CC(c1c(C2)cccc1)N2C(C1(CC2(CC2)C1)C#N)=O,2 T482-1881,Cc1noc(C)c1S(Nc1cccn2nc(C3CC3)nc12)(=O)=O,2 F6670-6080,CC(N1CC(CC2)CCN2c2nccs2)=Nc(cccc2)c2C1=O,2 F6609-5333,CCOC(N(CC1)CCC1NC(c1c(-c2ccncc2)n(-c2cc(OC)ccc2)nn1)=O)=O,2 F2245-0849,O=C(Cc(s1)ccc1Cl)Nc(ccc(F)c1)c1F,0 Z1954376985,CCN(CCCC1)C1C(N[C@@H]1[C@@H]2[C@H]1COC2)=O,2 F6610-2069,N#Cc1nccnc1NCc(cc1)cnc1N1CCOCC1,2 SB04-0523,CN(C)C(N(CC1)CC1N(CCNC(COc(cc1)ccc1F)=O)C1CCOCC1)=O,0 Z1626769073,O=C(c1cnc(-c2cccs2)s1)N1CC(c2ccccc2)=CC1,0 F6813-8197,CC1N(Cc(ccnc2)c2F)CCN(Cc2c(C)nc(C)s2)C1,2 Z2960776249,CCc1noc(COCC(N(CC2)CC(C)(C)c3c2cccc3)=O)n1,2 Z2715977174,Fc1cnc(CNc(cc2)ccc2-c2cn(CCCC3)c3n2)cc1,2 Z1651782526,O=C(c1c(C2CC2)nccc1)Nc(cc1)nn1-c(nccc1)c1Cl,2 Z2352635283,Cc(c(C)c1)cc(C(N[C@H](C2)C[C@H]2C(O)=O)=O)c1Cl,0 Z2319315314,Cc(cn1)cc2c1OCCN2C(c(n(C)nc1)c1Br)=O,0 Y042-4824,O=C(C(CC1=O)CN1c(cc1)ccc1Br)Nc1nnc(C2CCC2)s1,0 Z1410282689,CCCC(c1nnn[nH]1)NC(c1cn(Cc(cc2)ccc2OC)nc1)=O,2 Z594979726,CC(N1)=CC=C(C(N(CC2)CCC2NC(c2ccccc2)=O)=O)C1=O,2 SA44-0567,CC(C)Cc1nnc(C2N(C)CC(C3)(CN3C(Cc3cc(OC)cc(OC)c3)=O)C2)o1,2 Y021-1041,CC1c2cc(-c3ccnc(N4CCOCC4)n3)c(C)cc2NC(C)(C)C1,2 SD62-0300,O=C(CCC(C1)C2(CCC2)CN1C(CCc1nc(cccc2)c2[nH]1)=O)N1CCCC1,2 F2496-1541,O=C(C(CC1=O)CN1c1ccccc1)OCc1noc(-c2cc(cccc3)c3o2)c1,2 Y043-2151,Cn(cc1)c(cc2)c1cc2C(Nc(cc1)ccc1N(CCCC1)S1(=O)=O)=O,2 Z1609740094,OC(CCC(CCCC1)N1C(CC(c1ccccc1)NC(c(cccc1)c1Cl)=O)=O)=O,2 Z2973747370,Cc1c[nH]c(CNc2nc(CCOC)ns2)n1,0 Z3009007376,Cn1nc(C2CCCC2)c(S(N(C2)CC22COCC2)(=O)=O)c1,2 Z1453142248,CN(C)c1ncnc(OC)c1NC(NC1CCN(C)CC1)=O,2 F6436-1754,COc1ccc(C2(CNC(CCc(cccc3)c3F)=O)CCOCC2)cc1,0 Z2220030673,Cn1c(-c(cc2)ccc2Cl)nnc1CN(CCC1)CCC1O,2 F6367-0965,COc(cc1)cc2c1sc(N(C1)CC1C(Nc(ccc(Br)c1)c1F)=O)n2,0 Z3389756977,OC([C@H](CC1)CC[C@@H]1NC(c1cc(-c(cccc2)c2F)n[nH]1)=O)=O,0 E646-2786,CC(C)CCNC(C(C)(CN(C1)S(c2ccc(C)cc2)(=O)=O)N(CCc2cccs2)C1=O)=O,0 G314-0045,CC(C)CCNC(CCc1c(C)c2nncn2nc1C)=O,0 Z1269151511,Clc(cc1[nH]ncc1c1)c1Br,0 F5831-5082,O=C(Nc1cccs1)N1CC(c2ccccc2)OCC1,2 F6788-7391,O=S(Cc1ccccc1)(N1CC(CN(C2)c3ncnc4c3nc[nH]4)C2C1)=O,2 E216-5229,CCC(C1)Oc(ccc(C)c2)c2N1C(Nc1c(C)ccc(Cl)c1)=O,0 F6469-3181,O=S(c1c(C(F)(F)F)cccc1)(Nc(cccc1)c1-c1cn(cccc2)c2n1)=O,0 F6539-3132,O=C(c(cccc1)c1Cl)NCc(cc1)ccc1-c1cocc1,0 F6753-3381,Cc(cc(C)nc1N(CCC2)CC2C(N2CCSCC2)=O)c1C#N,0 S694-1839,Cc1cnc(C2CCC2)n1C(CC1)CN1C(c1cscc1)=O,2 Z1247549647,CC(CC(C)C1)CC1NC(NCc1c(-n2cncc2)nccc1)=O,2 J006-2284,CCOc(ccc(CN(CCC1)C1c1noc(C(C)C)c1)c1)c1OC,0 F2199-0467,O=C(c1c2cccc1)N(Cc1nc(Cc3ccccc3)no1)C2=O,2 Z3077804047,Cc1nn2c(NCCc3n[nH]cc3)cc(C)nc2n1,2 SC25-1063,Cc1c(CNC(C2c3nnc(-c4nccnc4)n3CCC2)=O)c(C)n[nH]1,0 F6573-3282,O=C(Cc(c(F)ccc1)c1Cl)NCCOCCn1cncc1,0 Z3388126771,CC(CN(C)C(c(c(C)nn1C)c1OC)=O)NC(CC1CCOCC1)=O,2 SA67-0094,Cc1noc(C)c1CCC(N1CC(CCc2noc(C)n2)CC1)=O,2 Z2784067066,N[C@@H](C[C@@H]1C2)C[C@]12C(NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)=O,2 Z1315889259,CC(CC(NC(C)c(cc1)ccc1-c1ccncc1)=O)NC(C1CCCCC1)=O,2 E515-0801,CN(C1CCCCC1)S(N(CCC1)CC1C(NCc1cccc(Br)c1)=O)(=O)=O,0 SD02-1665,CC(C)c1nnc(C(C2)N(CC(N3CCCCC3)=O)CC22CCN(Cc3ccc(C)o3)CC2)o1,2 SC89-0400,CN1CCN(CC(CC2)C(C3)(CN3C(c3ccccc3)=O)S2(=O)=O)CC1,0 F6805-3665,Cc1nc2cnccc2c(N2CCC(CN(C=Nc3c4ccc(OC)c3)C4=O)CC2)n1,2 F6445-6249,O=C(c1cc(Br)cnc1)N(CC1)Cc2c1ncnc2,0 F6616-3173,O=C1N(CCn2ncc(Br)c2)CCC1,2 Z5020307975,Oc(cc1)ccc1-c(cc1)cc(CCCC2)c1C2=O,2 Z3357804927,Cc(cc1)cc(S(NC(CC2CC2)=O)(=O)=O)c1OC,2 F924-0061,COc(cc1)ccc1-c1nn(c(CCN(C2)C(NCCc3ccccc3)=O)c2s2)c2n1,2 S732-0178,O=C1NCCCCCCN(CC2CCCCC2)[C@@H]2[C@H]1CCC2,2 F894-1670,CCCNC(C(CCC1)CN1S(c1c(C)sc(-c2noc(C3CCC3)n2)c1)(=O)=O)=O,2 F6617-6763,O=C1N(Cc2ccccc2)CCC1n1nnc(-c2ccccc2)c1,2 Z4018743335,O=C([C@H]([C@H]1[C@@H]2C1)NC2=O)NOCCN(CCC1)C1=O,2 L264-0605,O=C(C1CCCCC1)Nc1nc(cc(cc2)NS(c(cc3)cc(Cl)c3F)(=O)=O)c2s1,2 F2332-0385,CCOC(C(C(NC(c(cccc1)c1Cl)=O)=C1)=NN(c(cc2)ccc2F)C1=O)=O,2 F6480-3738,O=C(c1cocc1)N(CCC1)CC1Oc(nc1)ncc1F,2 E667-1310,CC(CC(N(CC1)CCN1c1c(C)ccc(C)c1)=O)S(c(cc1OC2)c(C)cc1NC2=O)(=O)=O,0 Z1187922856,CCNC(c(cc1)cnc1N(CC1)CCN1c1c(ccs2)c2ncn1)=O,0 Z1204214419,CC(C)(C)c1noc(CCC(N(C)C(CC2)Cc3c2cccc3)=O)n1,2 F6064-0596,O=C(Cn1c(cccc2)c2nc1)N(C1)CC1c1nc(-c2ncccn2)no1,2 F6257-5300,Cc1cccc(CS(N(CC2)CCN2c2ncncc2C)(=O)=O)c1,0 Z2370677731,CS(CC(CCC1)CN1S(c1c2OCCc2ccc1)(=O)=O)(=O)=O,0 5353-0789,OC(CC(c(cc1)cc2c1OCCO2)=O)(c(cccc1)c1N1CCc2ccccc2)C1=O,2 P315-0736,Cc1cc(N(CCC2NC(Nc(cc(cc3)OC)c3OC)=O)C2=O)cc(C)c1,0 P114-0768,Cn1c(nccc2)c2c(C(CC2)=CCN2C(Nc(ccc(F)c2)c2F)=O)c1,0 G856-0969,CCC(C)SC(N(c1cc(C)cc(C)c1)C1=O)=Nc2c1[nH]c1c2cccc1,0 SB91-0439,Cc1nc(C(N(CC2)CC2N(CCN2CCOCC2)S(C)(=O)=O)=O)co1,2 F5857-2580,COc1cccc(CNC(C(NCC(c2cccc3ccccc23)O)=O)=O)c1,0 P006-0656,CCN1C(CNc2c(C)nnc(-c3cc(C)ccc3)n2)CCC1,2 F6573-4782,O=C(c1cccc(Oc(cc2)ccc2F)c1)NCc1cncc(C2CC2)c1,2 Z2991906102,CC(C)(c1nn(Cc2nc(OC)ccc2)nn1)S(C)(=O)=O,0 F3334-3637,O=C(c(cccc1)c1Br)Nc1nonc1-c(cc1)ccc1Cl,0 Z2881707024,Oc1cc(C(CC2)CN2C(C2CC2)=O)n[nH]1,2 Z3495737856,Cc1cnc(-c2noc(-c3cc(CCCC4N)c4cc3)n2)nc1,0 F6676-2717,Cc(c(C(N(CC1)CCC1N(C)c1ncccc1)=O)ccc1)c1Br,0 F5939-2843,Cc1ccc(C)c2c1nc(OC(CC1)CCN1C(c(cc1)ccc1S(C)(=O)=O)=O)s2,0 F6245-1720,O=C(COc(cc1)ccc1Cl)N(CCC1)CC1c1nnc(C(F)(F)F)o1,2 Z1682188284,OC(c(cc1)cc(F)c1S(N(CC1)CCN1C(C1CCCCC1)=O)(=O)=O)=O,2 F6804-4818,CN(C(CC1)CCN1c1cc(CCCC2)c2nn1)c1ncccc1,2 SB14-1264,COCC(N(C(CC1)CN1C(c1ccc(Cn2cncc2)o1)=O)C1CCOCC1)=O,2 Z1818852758,CCN(CCCN(C1)C(CCc2c(C)n3nc(N)nc3nc2C)=O)C1=O,2 Z1333341034,O=C(Cc(cc1)ccc1NC(C1CC1)=O)NCCc1nc(-c2ccncc2)cs1,2 F6561-7465,O=C(C1CC1)NC1CN(Cc2cscc2)CC1,2 Z1550538189,OC(Cc1cccc(F)c1)(CC1)CN1C(C(CC1)Cc2c1[nH]nc2C(F)(F)F)=O,2 F6550-4828,O=S(Cc1cccc(Cl)c1)(N(C1)CC1Nc1ncccn1)=O,2 Z2434503705,CC(C1)OCC1Nc(c(F)cc(S(N)(=O)=O)c1)c1Br,2 Z3547449715,O=C(c1c(COC2)c2ccc1)Nc(cc1)cc(CC2)c1N(CC(F)F)C2=O,2 Z2766883039,COc1ccnc(N(CC2)CCN2C(Cc2nnc(-c3ccccc3)o2)=O)n1,2 SC04-0591,CC(C)Cc1nc(CCOC(CCC2)CN2C(Nc(cc2)cc(Cl)c2F)=O)no1,0 SB18-1207,CC(C)CC(N[C@@H](C[C@H]1c2nc(C)n[nH]2)CN1C(c1cc(Br)c(C)cc1)=O)=O,0 Z2996706887,OC(c1cccc(Cl)c1CN1C(CC2OCCC2)COCC1)=O,2 8640-0175,CC(C)(C1)OCc2c1c(C(N(c(cc1)ccc1Cl)C(N1CC(N)=O)=O)=O)c1s2,0 K786-3863,CC(CC1)CCC1NC(C(C)(CC1)N(CCc2ccc(C)cc2)C1=O)=O,0 S828-3349,Cc1nnc([C@H](CC(C2)(F)F)N2C(c(cc(cc2)Cl)c2OC)=O)o1,0 V024-7642,CC(C)CCN(C(c1c(N2c(cc3)ccc3Cl)ncn1C(C)c1ccccc1)=O)C2=O,0 F6658-5635,Cc1cc(ncnc2N3CCC(COc4ncnc(C)c4C)CC3)c2[nH]1,2 S511-0377,Cc1c(C(N(CC2)CCC22OCCC(CC(N3CCCC3)=O)C2)=O)sc(C)n1,2 F1907-9254,CN(CCN1C2CCN(CC(C(F)(F)F)O)CC2)C1=O,2 F5825-0180,Cn1c(N(CC2)CCN2S(c2cc(CCCC3)c3cc2)(=O)=O)nc2c1cccc2,2 SA55-3972,CCC(C(NCCc1nn(C)c2c1COCC2)=O)N1c(cccc2)c2OCC1=O,0 V022-1935,CC(C)CN(CC(C)O)CC(N(CC1)C(COc(cccc2)c2OC)c2c1scc2)=O,0 Z4301849360,CC(C(N(C)C(CC(N)=O)C(F)(F)F)=O)N(C(c(c1c2)cc(Cl)c2Cl)=O)C1=O,0 Z7727153947,CCn1ncc(CN(C)Cc(cc2)cc(Cl)c2C(O)=O)c1,0 F6782-0711,O=C(C(SCC1CCC1)=NC=C1)N1c1ccccc1,2 Z1480719248,Cn1c(cccc2)c2c(C(NC2(CCOCC2)C(O)=O)=O)c1,0 F3385-2770,Oc(cc(cc1)OCc(cccc2)c2F)c1-c1ncncc1-c1ccccc1,2 F5475-0072,CSc(cccc1)c1NC(C1(CC1)c(cc1)ccc1F)=O,0 F323-0146,CC(CC1)CCC1NC(CN(C(C1(C)C)=O)c(cc2)c1cc2S(N1CCCC1)(=O)=O)=O,2 Z1558078964,Cc(cc1OC)cc(C(N2CCC(CCCN(C)C)CC2)=O)c1O,0 F5855-0291,CC(C)(C(N(CC1)CCN1C(C(C1)C1c(cc1)ccc1F)=O)=O)Oc(cc1)ccc1Cl,2 F3222-5514,CCc1nc2ccccc2c(OCC(Nc2cccc(SC)c2)=O)n1,0 E511-3070,O=C(C(CCC1)CN1S(c(cc1)cc2c1[nH]c(-c1ccccc1)n2)(=O)=O)NC1CCCCCC1,2 Z2775364644,CN(Cc1ncccn1)C(CC1)CN1C(c1nn(cccn2)c2c1)=O,2 F6540-3173,Cn1ncc(C(CCC2)CN2C(C2CCOCC2)=O)c1,2 L866-2490,CC(C)CNC(CCC1=Nc(cccc2)c2N(CC(NC(C)CCc2ccccc2)=O)C1=O)=O,2 F6203-1018,OCCC(CCNC(C1CCCCC1)=O)c1cscc1,2 Z1444206866,CC(CN(Cc1ccccc1)C(Cc1c[nH]c2c1ccc(Cl)c2)=O)C(O)=O,0 Z1161444162,CNC(c1ccc(CN(CC2)CCC2c2cc(OC)ccc2)cc1)=O,0 Z1603252834,Cc1c(C(N2CCC(CC(O)=O)CC2)=O)nco1,0 F2597-0124,CCCS(NCCc1csc(-c2cc(C)ccc2)n1)(=O)=O,0 Z2368668109,CCCc1nc2ncnn2c(N2CC(C)(C)NCC2)c1,0 Z2178701284,CC(C)NC(N(CC1)CC1(CC1)Oc2c1cccc2)=O,0 Z4890201518,N[C@@H](CCO)C(NCC(c1c[nH]c2c1cccc2)c(cccc1)c1Cl)=O,0 Z1732587899,CC(c1nc(-c(cc2)ccc2Cl)no1)N1CC2(CCCC2)COCC1,2 Z1525126580,NS(c1cc(C(N(CC(F)F)C2CC2)=O)co1)(=O)=O,2 Z1212110713,Cc1c(CN(CC2)CCN2C(c(cc2)cc(N3)c2N(C)C3=O)=O)c(C)nn1C,2 Z994989756,CC(CNC(c1ccc(C)n1C)=O)C(O)=O,0 Z4917831080,COc(cc1)ccc1-c1cc(NC(c2ccc(CCNS(C)(=O)=O)cc2)=O)ncn1,0 Z1319799954,CC(CCN(Cc1ccccc1)CC1)N1C(c(cc1)ccc1S(C)(=O)=O)=O,0 SA46-1646,O=C(c(cc1)ncc1F)N(C1)CC1(C1)OCC1N1CCCCC1,2 F6390-2744,CCCc1c(C(N(Cc2ccco2)C2CCOCC2)=O)snn1,2 Z1684906140,C(Cc1nc(-c(cc2)ccc2OC2CCOCC2)no1)c1cccs1,2 F6477-3231,COCC(NC(CC1)CCN1c1nc(-c2cnccc2)cs1)=O,2 F6559-7443,Cc1nnc2n1ccnc2N(CC1)CCN1C(c(cc1)nnc1N(C)C)=O,2 Z915789042,CC(C)(C(N(CC1)CCN1C(c1ccnn1C)=O)=O)c1ccccc1,0 T159-0163,Cc1cnc(CC2CN(Cc3ccc(C(F)(F)F)cc3)CCC2)n1CCOC,0 Y041-4312,Cc(c(O1)c(cc2)C(CCC3)=C3C1=O)c2OCC(N(C)C(CC1)CS1(=O)=O)=O,2 Z3686930874,CCCCc(cc1)nc(C)c1NC(N(C[C@@H]1CC(NC)=O)C[C@@H]1O)=O,0 F3156-0007,O=C(C(Cc1ccccc1)NC(C1(CC(C2)C3)CC3CC2C1)=O)Nc1ccccc1,2 F2397-0179,CCOCC(NC1=C(C)N=C2SC=C(C)N2C1=O)=O,0 F5596-0792,O=C(CN(C(CC1)=O)C1=O)N(CC1)CCC1c1nnc(C2CC2)o1,2 F6573-2677,O=C(C1(CCCC1)c(cc1)ccc1Cl)NCCOCCn1nccc1,2 V008-1367,CCN(C(C)C)C(c(cccc1)c1N(CC1)CCC1NC(C)=O)=O,0 Z4327153147,CC(c1cn(-c2ccc(CNC(C3(C)CC(C)C3)=O)cc2)nn1)O,2 F6178-4112,O=C(c1c(C(F)(F)F)cccc1)NCC(CC1)CCN1c1ccncc1,0 T159-0037,Cc1cnc(CC(CCC2)CN2C(C2CCC2)=O)n1CCOC,2 Z1743828423,Cc1ccnc(C(CC2)CCN2C(C(CC=C)c2ccccc2)=O)n1,0 E146-0459,O=C(c1noc-2c1COc1c2cccc1)NCCc1c[nH]c2c1cccc2,2 F1143-1840,Cc1cccc(C)c1NC(CSc1nc2ccccc2c(C)c1)=O,0 Z1193476665,Cc(ccc(S(N1CCCCC1)(=O)=O)c1)c1S(N1Cc2nncn2CC1)(=O)=O,2 F6523-4009,O=C(c1c(C(F)(F)F)cccc1)N(CC1)CC2=C1N=C(C=CC(F)=C1)N1C2=O,0 F6606-1326,CC1=C(C)N=CN(CC(CC2)CCN2C(Cc2c[nH]c3c2cccc3)=O)C1=O,2 F5753-0226,CC(c(cc1)ccc1S(N1CCC(Cn2c(cccc3)c3nc2C(F)(F)F)CC1)(=O)=O)=O,0 Z2642398991,O=C(C(CCC1)N1c1nccs1)N(C1)[C@@H]2[C@H]1CCCC2,2 SB04-0613,CN(C)C(N(CC1)CC1N(CCN(C)C(c(cc1)cc(F)c1F)=O)C1CCOCC1)=O,0 F6445-1580,O=C(c(o1)ccc1Br)NC(CC1)CN1c1nccs1,2 F6512-0783,Cc1noc(C)c1CC(Nc1cc2ccnn2cc1)=O,2 F6562-9546,O=C(c1c2OCCOc2ccc1)NCc1nccnc1-c1ccco1,2 F5328-0278,COc1c(C2(CNS(c(s3)ccc3Cl)(=O)=O)CCOCC2)cccc1,0 Z2215813136,CCCC(C)C(NCCNC(Nc(cc1)ccc1Oc(cccc1)c1C(N)=O)=O)=O,0 Z445158426,OC(CN(CC1CC1)S(c1cccc(Cl)c1)(=O)=O)=O,0 T599-3697,Cc1c(C(N(CCC2)c(cccc3)c3N2C(C2CC2)=O)=O)scc1,2 F6727-8260,COc(cccc1)c1C(C=C1)=NN(C(C2)CN2C(C2OCCCC2)=O)C1=O,2 S993-0822,Cc1cccc(CN(CC(N(CC2)C3CCN2S(c2cn(C)cn2)(=O)=O)=O)C3=O)c1,0 Z1950061059,Cn1nnc(CNC(N(CC2)CCC2c2cccc(Cl)c2)=O)n1,0 Z3369136171,Oc1cccnc1C(NCCc1nc(CCOC2)c2s1)=O,0 Z1183871486,NS(C(CC1)CN1C(Cc1cc(CCC2)c2cc1)=O)(=O)=O,0 Z2483759557,CC(CC1)(CN1C(c1c(C)c2c(N)nc(C)nc2s1)=O)c1cc(F)ccc1,2 C188-0438,CCC(C(Nc1c(-c(cc2)ccc2F)nc2n1ccc(C)c2)=O)c1ccccc1,0 F6190-2085,OC(CCNC(c(ccc(F)c1)c1Cl)=O)c1cccc2ccccc12,0 SB57-1487,Cc1ccc(CC(N(C2)CC2(CN(C2)S(C)(=O)=O)C2c2nc(C3CC3)no2)=O)cc1,2 Y205-0964,CC(CCC1)CN1C(C(C)(C)Oc(ccc(Br)c1)c1Cl)=O,0 F6445-6590,Cc1c(C(NCc(cccc2)c2-c2cscc2)=O)n(cccc2)c2n1,2 F6797-2822,Cc1nn2c(N(CC3)CC3(C(Nc3cnccc3)=O)F)cc(C)nc2c1,2 F5854-0913,COC(c(cc1)ccc1C(N(Cc1cscc1)Cc1ncccc1)=O)=O,0 Z1525088388,NS(c1cc(C(N(CCC2)CC2c2ccn[nH]2)=O)co1)(=O)=O,0 D038-0208,CCc(cc1)cc2c1occ2CC(N(CC1)CCN1C(c1ccccc1)c1ccccc1)=O,2 Z66581616,Cc1cc(-n2nnnc2SCc2ncc(-c3ccccc3)o2)cc(C)c1,2 F6523-1554,Cc1cc(N(CC2)CCC2NC(c2cc(-n3nccc3)ccc2)=O)n[nH]1,2 Z1869671206,CCC(C)(C(O)=O)NC(c1cc(-c(cccc2)c2OCC)ccc1)=O,0 F5854-1964,CC(C)C(Nc(cc1)ccc1S(N(CCc1cccs1)Cc1cnccc1)(=O)=O)=O,2 S836-0498,Cc1noc(C)c1CCNC([C@@H](C1)[C@@H](COC)CN1c1ncccn1)=O,2 F6451-1692,Cc1c(C(CNC(c(ccc(OC)c2)c2OC)=O)OC)cccc1,0 F2537-1557,O=C(CSc(cc1)ccc1F)Nc(cccc1)c1Oc1ccccc1,2 F6606-1639,CC1=C(C)N=CN(CC2CCN(CC3COCCC3)CC2)C1=O,2 Z2444609448,CC(CCN(C1)c2nc(-c3ncccc3)nc3c2CCC3)C1C(O)=O,0 SD15-0414,CN(CC(N(C)[C@@H]1[C@H]2CCN(Cc3nc(OC)ccc3)C1)=O)C2=O,0 Z1683489954,Cc(ccc(F)c1)c1-c1noc(Cn2nnc(-c3ccccc3)n2)n1,0 Z3063570246,CCCS(Nc1c(C(F)(F)F)n(C)nc1Cl)(=O)=O,0 S940-0134,O=C(NC1CCCCC1)N1CC(Cc2nc(-c3cnccc3)no2)C1,2 Z1442888778,O=C(Cc(cc1)ccc1Cl)NC(CCC1)c2c1cn[nH]2,2 Z2437745372,OC(CC1(CCOCC1)NS(c1cn(-c2ccccc2)nc1)(=O)=O)=O,0 F393-0063,CCC1Oc(ccc(Cl)c2)c2N(CC(Nc(cc2)cc(C(N3C)=O)c2N2C3=NCC2)=O)C1=O,2 Z1991809891,CC(CC1c2cccc(F)c2)CN1C(CCc(cccc1)c1C(O)=O)=O,0 F5004-0082,CN(c(sc(C(NCC1Oc(cccc2)c2OC1)=O)c1)c1C(N1C)=O)C1=O,2 F6525-7239,Cc(n(CCNC(c1nn(-c2ccccc2)nc1)=O)nc1C)c1-c1ccco1,2 F6489-0820,Cc(cc1)nnc1OC(CC1)CN1C(c1cscc1)=O,2 S713-0196,Cn1c(-c2noc(C3CCN(Cc4noc(C5CCCCC5)n4)CC3)n2)ccc1,2 Z1269821793,CN(CC1)c(ccc(C(NC2CCN(Cc3ccccc3)CC2)=O)c2)c2NC1=O,2 Z1229368303,OCC(CCC1)N1C(NCC1N(Cc2ccccc2)CCC1)=O,2 F6523-0430,O=C(Cc1cscc1)N(CC1)CCN1c1ncnc(C(F)(F)F)c1,2 F6574-1330,O=C(C1CCOCC1)NC(CC1)CCC1n1nccc1,2 Z2218212159,Cc1c(N(CCC2)CCC2O)nc(ccc(OC)c2)c2n1,2 F6713-1982,Cc1cc(C)nn1C(C=C1)=NN(C2CCN(Cc3csc(-c4ccccc4)n3)CC2)C1=O,2 Z4491585593,O=C(c1nn(-c2ccccc2)nn1)NCCC(c1ccccc1)N1CCCC1,2 J101-0249,Cc1cc(C)nn1-c(cc1)ccc1NC(CC[C@H](C(Nc1c2cccc1)=O)NC2=O)=O,2 F6675-7457,N#Cc1cc(Cl)c(NC(C2)CN2c2ncccc2)nc1,0 Y020-8160,O=C(CC(C(NCC1)=O)N1C(CN(CC1)CCN1c1cccc(C(F)(F)F)c1)=O)Nc1ccccc1,0 SC42-0069,Cc1nc(CC2CC(CC3)(CCN3C(C(C=C3)=NNC3=O)=O)OCC2)no1,2 S831-2663,CCn(cc1)nc1C(N(C[C@@H]1CO)C[C@@H]1c1ncccc1)=O,2 Z2778629199,OC(C(N1CCC(Cc(cc(cc2)F)c2F)CC1)=O)c1c[nH]cn1,2 F6435-5632,CSC(CC1)CN1C(c(c(F)ccc1)c1F)=O,0 Z1197802801,Cc1noc(-c2cc(CCC3)c3cc2)n1,0 S812-3705,Cc1noc(C(N2C(C3CCCC3)c3nccn3CCC2)=O)c1,2 Z1738375848,CC(c(cc1)ccc1S(NC(C1COCC1)C(O)=O)(=O)=O)=O,0 Z2409566508,Cc1cccc2c1occ2C(N(CCC(O)=O)CC1OCCC1)=O,2 F2902-0515,CC(C)(Cc1ccc2)Oc1c2OCC(NCCn1ncc2c(N3CCCCCC3)ncnc12)=O,2 Z1534615770,Cc1c(C)sc(N=C(CN(C(C2)C(N)=O)C3C2CCCC3)N2)c1C2=O,2 F6481-4151,O=C(c(cccc1)c1Br)N(CC1)CCSC1c1cccs1,0 F6722-1059,COc(cccc1)c1N(CC1)CCN1c(cc1)ncc1Cl,0 F3324-0293,O=C(c1cccs1)N(C(C1)c2cc3nccnc3cc2)N=C1c1ccco1,2 F5526-0549,CCOc(cc1)ccc1OCCNC(Cc1cccc2ccccc12)=O,2 F5857-0438,CSc(cccc1)c1C(NCC(C1CC1)(c1ccco1)O)=O,0 L110-1036,Cc1ccc(CN(C(c(cccc2)c2N2Cc3nc(-c4cccs4)no3)=O)C2=O)cc1,2 Z4783039807,CCc1cc([nH]c(C(NC(C2)CN2C(C)C)=O)c2)c2cc1,2 T787-5023,CN(C)C(C(CN(C1)C(Nc(ccc(OC)c2)c2OC)=O)C11CCOCC1)=O,0 6013-1746,O=C(Nc(cc1)ccc1F)N(CC1)CCN1c1ncccc1,0 Z2761795358,Cc1cccc(Cl)c1S(NC[C@@H](CC1)O[C@@H]1c1ncn[nH]1)(=O)=O,0 Z4873983975,COc(cc1)ccc1-n1nc(CCc2ccccc2)nc1CC1COCC1,2 Z839884718,OC(C1(CSCC1)NC(Cc1cc(C(F)(F)F)ccc1)=O)=O,0 SC23-0638,CS(N(CCc1noc(C2CC2)n1)C(C1)CN1S(N1CCOCC1)(=O)=O)(=O)=O,2 D563-0144,Cc(cc1)ccc1S(c1csc(C(C2)c(cc3)cc(OC)c3O)c1NC2=O)(=O)=O,0 Z3701656187,O=C(NC[C@@H]1[C@H](CC2)O[C@H]2C1)Nc1c[nH]nn1,2 Z1416551711,Cn1c(Cl)ncc1S(Nc1cc(C(F)(F)F)ccc1)(=O)=O,0 F6524-3948,Cc1noc(C(CN(C2)C(c3nc4ccccc4nc3)=O)C2c2ccccc2)n1,2 Z1330148469,CC(C)(C1)NCCN1C(Cc1c(C)oc(-c2cscc2)n1)=O,2 F6797-2760,Cn1ncc2c1ncnc2N(CC1)CC1(C(Nc1cnccc1)=O)F,2 F6573-0195,Cn1nccc1-c1ncc(CNC(c2cc3c(-c4ccccc4)onc3cc2)=O)cc1,2 Z3133984285,N[C@@H](C1)[C@@H](C2)[C@@H]2[C@@H]1C(Nc(cc1cc2)cnc1c(F)c2F)=O,2 T158-0555,CCCn1c(C(CC2)CN2S(c2cn(CC)nc2)(=O)=O)ncc1C,0 S576-0541,O=C(C(CC1)CN1C(C=NN1Cc2ccccc2)=CC1=O)NCCCN(CCC1)C1=O,2 Z4474193527,CCC(CNC(C1(CC1)C(C)C)=O)NC(c(cccc1)c1N(C)C(C)=O)=O,2 F6675-9227,C(C1)CC1c1cc(NC(C2)CN2c2nccnc2)ncn1,2 Z2827922592,Cc1c(CNc(nc2)ncc2F)[nH]nc1C,0 F5498-0010,CCc1nnc(C(CC2)CCN2C(NC(C)C)=O)s1,0 V017-1591,Cc1ccc(CN(CCc(cc2)cc(OC)c2OC)C(CN(C2CC2)C(C2CC2)=O)=O)o1,2 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F6619-5672,Cc1ccnc(N2CCN(CC(N(CC3)CCN3c(cc3)ccc3Cl)=O)CC2)n1,0 F6560-5409,Cn1ncc(-c2cc(CNC(COc(ccc(Cl)c3)c3Cl)=O)cnc2)c1,2 S724-1296,COc(cc1)cc(OC)c1C(N(C1)CC1n1nnc(C(NCC2CC2)=O)c1)=O,0 V026-6878,CCc1nc(SCc2ccc(C(NCC3OCCC3)=O)o2)nc(N(C)Cc2ccccc2)c1,2 Z1242153094,COc(cccc1)c1-c1n[nH]c(NC(c2cc(Nc3nccnc3)ccc2)=O)c1,2 F6359-0675,O=C(C1CC=CCC1)N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1,0 Y501-4679,O=C(c1nn2c(C(F)(F)F)cc(C3CC3)nc2c1)N1CCOCC1,2 SB14-1025,O=C(C1CC1)N(C(CC1)CN1C(c1ncncc1)=O)C1CCOCC1,2 F3406-3838,COC(c(cc1)cc(N=C(N2CSCC2)N2c3ccccc3)c1C2=O)=O,2 Z2974115081,CN(Cc1ncccn1)c(cc1)ncc1S(C)(=O)=O,0 C361-1449,CCC(N(C(C)C1)c(cc2)c1cc2S(CCC(Nc(cc(cc1)F)c1F)=O)(=O)=O)=O,0 P645-0670,Cc1cc(C(NC2CCCCC2)=O)nc2cc(-c3cccs3)nn12,2 Z283888390,OC(c(cc1)ncc1C(Nc(cc1)ccc1-c1nc(cccc2)c2[nH]1)=O)=O,2 V002-2754,CC(CN(CC1)c2cc(Oc3cccc(Cl)c3)ncn2)N1C(CSc1ccccc1)=O,2 Y502-8579,Cn1ncc(CNC(c(n(C)nc2)c2NC(C(CC2)CCN2S(C)(=O)=O)=O)=O)c1,2 F6489-1993,Cc1csc(C(N(CC2)CC2Oc(cc2)nnc2N(C)C)=O)c1,2 SA24-0184,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1c[nH]nc1-c(cc1)ccc1OC)=O,0 S248-3220,O=C(c1cocc1)N1CC(Cc2noc(-c(cc3)ccc3F)n2)CC1,2 F6806-8093,CC(C)(C)NC(C(CC1)CN1c(ncnc1)c1F)=O,0 F2340-0043,O=C(c(c(F)ccc1)c1Cl)NCCN(C(C=C1)=O)N=C1c1ccco1,0 F6810-9459,FC(Oc1ccc(CN(CC2)CCN2c2ncnc3c2ncn3C2CC2)cc1)(F)F,2 F6549-2871,O=C(Cc1cnccc1)N(C(CC1)C2)C1CC2n1cncc1,2 Z854727352,CC(C)Oc(cc1)nc(C(NC)=O)c1Cl,0 F2493-1600,O=C(COc(ccc(Cl)c1)c1Cl)NCc1noc(-c2ccco2)c1,2 F5831-7054,O=C(NCC1CCN(Cc2cccs2)CC1)Nc(cccc1)c1Cl,0 F980-1075,CC(C)c(cc1)ccc1N(C(C=C1)=O)N=C1N(CC1)CCN1C(c1c(C)ccs1)=O,2 Z3216017149,CC(C)n1ncc(S(N(C)c2cc3cccnc3cc2)(=O)=O)c1,2 SD56-0688,O=C(C(C1)N2CCCN1S(c1cccs1)(=O)=O)N(C1CCCCC1)C2=O,2 F6525-7976,O=C(c(ccc(F)c1)c1Cl)N(CCn1nc(C(F)(F)F)cc1)C1CCCC1,0 Z3051347526,CC(CNC(c([nH]c1cc(Cl)c2)cc1c2OC)=O)c1nncn1C,0 E216-5166,CCC(C1)Oc(ccc(Cl)c2)c2N1C(Nc(cc(cc1)F)c1F)=O,0 Z1525878755,Cc1c(C)sc(CN(CCC2)C2c2cnccc2)n1,0 Z1264375472,Cn1nc(CCC2)c2c1NC(C(CC1)CCN1C(c1ccccc1)=O)=O,2 F6709-5146,NC(c1nccc(OC(C2)CN2C(C2(CC2)c(cc2)ccc2F)=O)c1)=O,2 SA65-1095,Clc1c(CN2CCC(CCc3noc(C4CCOCC4)n3)CC2)cccc1,0 F6448-0108,COc1cc(C(Nc2cn(CC3OCCCC3)nc2)=O)cc(OC)c1,0 F6474-8745,COC(c(cccc1)c1C(N(CC1)CCC1N(C(CN1)=O)C1=O)=O)=O,0 Z1888746361,O=S(CCc(cc1)cc2c1OCC2)(N(CC1CC1)Cc(cc1)ccc1F)=O,2 Z3211043667,CN(C)c1cccc(CN(C(CCN2)=O)C2=O)n1,0 F0594-2813,O=C(CSc1nnc(Cc2ccccc2)o1)NCC1OCCC1,2 S924-0534,CCC(C)C(N(CC1)CCC1(CC1)N(Cc2c(C)onc2C)C1=O)=O,2 F6190-2040,COc(cccc1)c1C(NCCC(c1cccc2ccccc12)O)=O,0 F6416-8635,Cc1cc(C(CCNC(c2c(C)onc2-c(cccc2)c2Cl)=O)O)c(C)o1,2 F6257-1848,O=C(COc1cccc(Cl)c1)Nc1ncnc(N2CCOCC2)c1,2 F6200-3958,CCOC(NCC1(c(cccc2)c2OCC1)O)=O,0 S693-0158,Cc1cnc(-c2ccccc2)n1CC1CN(Cc(cc2)ccc2C#N)CCC1,0 F5607-0047,O=C(c(cccc1)c1Cl)Nc(cc1)ccc1Nc1ncnc(-n2cncc2)c1,0 F3348-0132,Cc1cc(C)nc2nn3c(N4CCN(Cc(cc(cc5)Cl)c5OC)CC4)cc(C)nc3c12,0 Z1719922651,O=C(C(C=C(C1CC1)N1)=CC1=O)N1CCC(C2)(CNC2=O)CC1,2 Z3583817711,C#CCOC(C1)CN1C(c1cc(C(N(C2)C(CCC(N3)=O)C3=O)=O)c2cc1)=O,2 Z2912030551,COc(cc1)ccc1C(N(CCC1)C1C(N[C@@H](CC1)Cc2c1ncs2)=O)=O,2 Z2646318963,CN(CCN(CC1)C(c2cccc(OCc3cscn3)c2)=O)C1=O,2 F6561-5537,O=C(NCc1ncccc1)N(CC1)CCC1S(Cc1ccccc1)(=O)=O,2 F6357-0493,O=C(NCC1(CCOCC1)c1cscc1)Nc(cc1)cc(Cl)c1Cl,0 Z2607045343,CCC1(CCOCC1)NC(C1NCC1(C)C)=O,2 SC88-1731,COc1ccc(Cc2noc(C(CC3)C(C4)(CN4C4CCCC4)S3(=O)=O)n2)cc1,2 F6359-3167,O=S(c1cc(C(F)(F)F)ccc1)(N(CC1)CCC1Oc1nccnc1)=O,2 C066-0710,CN(C(CNC(C(c1c2cccc1)=NN(c(cc1)cc(OC)c1OC)C2=O)=O)=O)c(cc1)ccc1Cl,2 F6507-3816,Cc1cc(C(CNC(c(cc2)ccc2OC(F)(F)F)=O)O)c(C)o1,0 Z1286617217,CCOC(C1)C2(CCCC2)C1NC(CNC(c1c(C)cccc1)=O)=O,2 L295-0097,CC(C)NS(c1c(C)c(C)cc2c1oc(C(N1CCCC1)=O)c2C)(=O)=O,0 F2004-0255,COC(c1ccc(CSc(cc2)nnc2-c2ccco2)cc1)=O,0 F6156-0407,CN(C)S(c(cc1)ccc1C(N1CC(COc(cc2)cc3c2OCO3)C1)=O)(=O)=O,2 F6356-0114,O=C(C1(CC(C2)C3)CC3CC2C1)NCCc1cocc1,2 Z2910792449,Cc1cnc(C(N(CCc2ccccc2)CC(O)=O)=O)c(C)c1,0 Z1558498387,CC(c1nocc1)NC(c1cc(-c2ccc(C)cc2)n[nH]1)=O,2 Z3101351337,CC1(CNC(N[C@@H](C2)CN(C)C2=O)=O)COC1,2 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Z3050560417,Cn1ncc(C(C(N(CC2)CCC22OCCc3c2scc3)=O)O)c1,2 SB04-0336,CC(C)c1ccc(CN(C)CCN(C(CC2)CN2C(C2CC2)=O)C2CCOCC2)cc1,2 F6708-8306,CN(C=CC=C1C(N2CC(C3)(CC3c3ccccc3)C2)=O)C1=O,2 F6553-7056,CSc(cccc1)c1C(N(CC1)Cc2c1sc(Cl)c2)=O,0 F6803-0214,Cc1cnc(C)c(OC2CCN(CC(Nc(cc3)cc4c3OCCO4)=O)CC2)n1,2 Z3599500098,CC(Nc1cccc(C(N(CC2)CCC2c2c(C)cc(N)nc2)=O)c1)=O,2 F5681-0106,Cc1c(CC(NCc(cccc2)c2Cl)=O)c(C)nn1C(CC1)CS1(=O)=O,2 Z512722910,O=C(CN(C=Nc1c2cccc1)C2=O)Nc1nnc(-c2ncccc2)s1,2 Z4919113932,CN(C)c1nc2ccccc2c(C(NC(CC2C3)C3CC2(F)F)=O)c1,2 Z1984431740,CC(CC1)(CNC1=O)C(NCCc(cc1F)cc(F)c1F)=O,0 F2775-1923,O=C(CN(C(C=C1)=O)N=C1c1cnccc1)Nc(cc1)cc(C(F)(F)F)c1F,2 SB57-0329,CCC(CC)N(C1)CC1(CN(C1)S(CC)(=O)=O)C1c1nc(C)no1,0 Z2959672049,O=C(c1ccnn1C1CCC1)N1CC2(COCCC2)OCC1,2 SA70-0386,Cc1cc(C)nn1CC(N(CCC1)CC1(CCOC)c1noc(C2CC2)n1)=O,2 Z3686987296,CN(C(C=C(N(CC1)C[C@H]1NC(c1cc2cccn2cn1)=O)N1C)=O)C1=O,0 Z1994442722,CC(CSC)C(N(CC1)CCC1C(NCC1N(CC2)CCN2C1)=O)=O,2 F5834-5112,CCCCOc(cc1)ccc1NC(Nc1ccc(CC(NC)=O)cc1)=O,0 Z1240137286,COc1cc(N(CC2)CCN2C(c(cc(cc2)N(CCN3)C3=O)c2F)=O)ncc1,0 S453-0084,COc(c(NC(CN(C(C1(CCOCC1)N1)=O)C1=O)=O)c1)cc(OC)c1Cl,0 F6506-2373,OC(CNC(C1COCC1)=O)(c1cscc1)c1cccs1,2 S698-1174,Cc1cnc(-c2cnccc2)n1C(CC1)CCN1S(c1cccs1)(=O)=O,2 Z2373260608,CC(C1)(C1(F)F)C(Nc1n[nH]c2c1ccc(F)c2)=O,0 F6571-2666,CCOc(cc1)ccc1NC(NCC1(CCCC1)OCCO)=O,0 F6521-7935,COC(CNC(c1noc(C2CC2)c1)=O)c(s1)ccc1Cl,2 F6448-2318,COc1cc([nH]c(C(Nc2cn(CC3Oc(cccc4)c4OC3)nc2)=O)c2)c2cc1,2 L932-0254,CN(c(cccc1)c1N=C1N(CC2)CCC2NC(Nc(cc2)cc3c2OCCO3)=O)C1=O,2 F6178-6442,CCOC(NCC(CC1)CCN1C(c1cocc1)=O)=O,0 Z1311008796,O=C(Cc1csc(-c2ncccc2)n1)NCc1nc(cc(cc2)F)c2[nH]1,2 J006-0440,CCn1c(cccc2)c2c(CN(CCC2)C2c2noc(C(C)C)c2)c1,0 F6616-3495,C(c1csc(C2CC2)n1)n1c(cccc2)c2nc1,2 F6554-0237,Cn1nc(C(CC2)CCN2C(C2(CCOCC2)c2ccccc2)=O)cc1,2 SC01-0283,CN(CCc1noc(-c2nn(CC3CC3)c3c2COCC3)n1)C(CCC1CCCC1)=O,2 Y502-6321,CCN(Cc1nnc(-c2ccccc2)o1)C(c1noc2c1CC(C)CC2)=O,2 Z2984417061,O=S(C1CC1)(NCc1cn(Cc(scc2)c2Cl)nn1)=O,0 F5529-0256,O=S(c1cccs1)(NCCOc1cc(C(F)(F)F)ccc1)=O,0 V017-7553,CCC(C(N1CCOCC1)=O)Oc1cc(C(c2ccc(C)cc2)N(CC2)C(C3CCCC3)=O)c2cc1,2 Z2043201458,CC(C)(C(Nc1nonc1C)=O)S(C1CC1)(=O)=O,2 Z2627918495,CO[C@@H](COC1)[C@@H]1NC(c(cccc1)c1-c(cccc1)c1C(O)=O)=O,2 SA73-0644,CN(C)S(N(CC1)CCC1(CC1CC1)c1noc(C2CCOCC2)n1)(=O)=O,0 F6561-3620,C=C(CC1)CCC1NC(c(cc1)cc2c1[nH]cc2)=O,2 Z1229979873,Cc([nH]nc1)c1C(N1CC(CCC(O)=O)CCC1)=O,0 Z1171987735,CN(CC1)CCN1C(c(cc1)cc2c1[nH]nc2)=O,2 F3376-2642,CN(c1c(C(N2)=O)n(CCCc3ccccc3)cn1)C2=O,2 L707-1265,O=C(CN(c(cc1)c(CCC2)cc1S(N1CCOCC1)(=O)=O)C2=O)N(CC1)Cc2c1cccc2,2 Z1577208491,CC(CC1)C2(CCC2)CN1C(c(nc1C2CC2)nn1-c(cccc1)c1Cl)=O,2 Z1391773507,Cc(cc1)nc(C)c1NC(CCOC1CCOCC1)=O,2 P937-3921,O=S(c1ccccc1)(N1CC(Cc2nnc(-c3ccncc3)[nH]2)CC1)=O,0 Z1101970692,Cc1c(CCC(Nc(cc2)cc(CCC3)c2NC3=O)=O)c(C)nc2ccnn12,2 Z2964383752,Cc(n(-c1ccncc1)nc1)c1C(N(CC1)CC1C(F)(F)F)=O,0 Z2437456644,CC(C)(CC1NS(c2c[nH]c(C(O)=O)c2)(=O)=O)c2c1cccc2,2 S661-1117,CCN(C(C(C1)N2CC1(CC1)CCN1C(c1n[nH]c3c1cccc3)=O)=O)C2=O,2 S606-1057,CCn1nc(C)c(CN(CC2)C[C@@H]2N(c(nccc2)c2N2CC(C)C)C2=O)c1C,0 F6752-7896,O=C(C(C1)CN1c1nccc(C(F)(F)F)n1)N1CCOCC1,0 S248-1713,O=C(c1cnccc1)N1CC(Cc2noc(-c3ccncc3)n2)CC1,2 F3411-4986,COc(cccc1)c1N(C=Cn1c(SCc(cccc2)c2Cl)nnc11)C1=O,0 F6482-3181,O=C(c1cccc(C(F)(F)F)c1)N(C1)CC1n1nccn1,0 SB36-1036,Cc1cccc(C(N(C2)[C@H](Cn3nnc(C(N4CCCC4)=O)c3)CC2(F)F)=O)n1,0 F6442-1898,CC(C)CS(C(C1)CN1C(c1ccc(Cn2cncc2)cc1)=O)(=O)=O,0 Z1155513830,Cc(nccc1)c1C(N1CC(c(c(Cl)c2)cc(F)c2Cl)OCC1)=O,0 T787-2252,CNC(C(CN(C1)C(Nc2cccc(SC)c2)=O)C11CCOCC1)=O,0 Z1897996437,Cc1nn(C)c(N(CCC2)CC2NC(N(C)Cc2ncccc2)=O)c1,2 S971-0544,COc(cc1)cc(C(N(CC2)CCC2(CC2)C2O)=O)c1Br,0 Z2380896835,O=C(NC(CC1)CS1(=O)=O)N1C[C@@H]2N(Cc3ccccc3)CC[C@@H]2C1,2 J038-0412,Brc(cc1)cc([C@H]2OCCC[C@H]22)c1NC2c1ccncc1,2 F1218-1148,COC(c1cn(-c2ccccc2)nc1-c(cc1)ccc1F)=O,0 G118-0972,O=C(Nc(cc1)cc2c1OCCO2)N(Cc(cccc1)c1-n1c2ccc1)C2c1ccccc1,2 F3334-1458,O=C(Cc1cccc2ccccc12)Nc1nonc1-c1ccccc1,2 F6443-4959,O=C(c1ccno1)N(CCC1)CC1(c1c2cccc1)OC2=O,2 SC89-0459,CN1CCN(CC(CC2)C(C3)(CN3C(Cc(cc(cc3)OC)c3OC)=O)S2(=O)=O)CC1,0 Z3132959761,O=C(c1nc(-c2ncccc2)ncc1)NC1C2(CCC2)NCC1,2 F6523-4587,CCOc(ccc(S(N(CC1)CCN1c1nnc(CCCC2)c2c1)(=O)=O)c1)c1F,2 Z4743809387,CCC1CC(CNC(NC(CCC2)CC2S(C)(=O)=O)=O)CCC1,0 F6619-5761,Cc1ccnc(N2CCN(CCCN(C(c3c4cccc3)=O)C4=O)CC2)n1,0 F6443-4087,O=C(CCc(cc1)cc(Cl)c1F)N(CC1)CCC1(c1c2cccc1)OC2=O,0 SD03-0129,CCN(CC)CCCNC(CN(CC(C1)(CC2)CCN2C(C(C)C)=O)C1c1nc(C)no1)=O,0 SC60-0967,CC(C)CN(C(C(C1)N2CC(C)(C)CN1C(c1ncc(C)nc1)=O)=O)C2=O,2 V030-5626,CC(CC1)CCN1c1nc(Oc(cc2)cc(C)c2F)c(CN(Cc(cc(C)cc2)c2F)CC2)c2n1,0 Z1603649085,OC(C1(CSCC1)NC(Cc(cc1)cc2c1OCC2)=O)=O,2 Z2784027249,Cn1nc(CCCC2)c2c1NC(C(CC1)CCN1c(ccc(C#N)c1)c1F)=O,2 F6514-6609,Cc1noc(C)c1CCC(NC(Cn1nccn1)c1ccccc1)=O,2 G804-0870,CCOc(cc1)cc(NC(c2c3cccn2)N(Cc2cccs2)C3=O)c1OCC,0 Y200-5929,CCC(CC1)Cc2c1c(C(NCc1ccc(C)cc1)=O)c(NC(CCC(O)=O)=O)s2,0 Z2511833018,COc1ccc2ncc(Br)cc2c1Cl,0 Z1580066585,NC(c1nccc(OC2CCN(Cc3cccc(F)c3)CC2)c1)=O,0 F6753-1037,O=C(C(C1)OCCN1c1cccc(C(F)(F)F)n1)N1CCOCC1,0 Z449197318,Cc1c(CNC(N2CC(CO)CCC2)=O)c(C)nn1-c1ccccc1,2 Z3175216830,CC(C)Cn1ncc(NC(N(C2)CC2(C(F)(F)F)O)=O)c1C(C)C,0 K906-2929,O=C(CN(c(ccc(S(N1CCCC1)(=O)=O)c1)c1O1)C1=O)NCC1Oc(cccc2)c2OC1,2 F2244-0412,Cc(cc1NC(COc(cc2)ccc2F)=O)nn1-c1c(cnn2-c3cccc(Cl)c3)c2ncn1,0 Z347221360,CCN(C)C(c(cc1)cnc1Cl)=O,0 G346-0213,CNC(C1CCC(CN(C(c(scc2)c2N2CC(N=C3N4C=CC=C3)=CC4=O)=O)C2=O)CC1)=O,2 Z2843385556,NC(c1cc(CN2Cc(cccc3)c3N(CCC3)[C@H]3C2)ccc1)=O,2 F1284-0662,O=S(c(cc1)ccc1Cl)(Nc(cc1)ncc1Br)=O,0 G336-0284,O=S(c1cccc2nsnc12)(N(CC1)CCN1c1nc(cccn2)c2s1)=O,2 Z1838425588,CC1=C(C)N=CN(Cc2nc(CC(F)(F)F)no2)C1=O,0 F6507-8428,OC(CNC(c1csc(-c2ccccc2)n1)=O)(CCC1)c2c1occ2,2 SB52-0690,CN(CC(C1)(CC2)CCN2C(c2nccnc2)=O)C1c1noc(C2CCC2)n1,0 F2040-0374,O=C(Cc1cccs1)Nc(cc1)cc(CCC2)c1N2C(c1ccccc1)=O,2 F6473-6395,CC(O1)=CC(OC(C2)CN2S(c(cccc2)c2F)(=O)=O)=CC1=O,0 F5222-0071,CCOc(cc1)ccc1C(NCC1(CCCC1)c1cccs1)=O,0 F5123-0851,O=S(c(cccc1)c1F)(N(CC1)CCN1c(cc1)nn2c1nnc2)=O,0 F6549-1382,O=C(NC(c1ccccc1)c1ccccc1)N(CC1)CCN1c1nsnc1,2 Z1559948167,CC(Nc(cc1)ccc1C(COC(C(C=CC1=NN2)=CN1C2=O)=O)=O)=O,0 Z3868093374,O=C(C(CC1)Cc2c1[nH]nc2)N(CCC1)C1c(cccc1)c1F,0 Z2225519234,CC(C)C(Nc1nccc(C(Nc(ccc(O)c2)c2SC)=O)c1)=O,0 F6512-0275,O=C(Cc(cc1)cc2c1OCO2)N1Cc2ccnn2CC1,2 C199-0150,CC(C)CC(N(CC1)C(COc(cc2)cc(O3)c2C(C)=CC3=O)c(cc2OC)c1cc2OC)=O,0 F6438-6365,CN(C(CCCC1)C1O)c1nc(C2CC2)ns1,2 F6441-3092,O=S(C1CC1)(N(CC1)CCC1S(c(cc1)ccc1F)(=O)=O)=O,2 Z4873991035,Cc1nc(cc(cc2)C(N(CCC3)CC3C3CNCC3)=O)c2n1Cc1cscc1,2 F5835-0443,O=S(C1CC1)(Nc(cc1)cc2c1OCCO2)=O,2 F6454-2422,Cc1nccc(N2CCC(CNS(c(cc3)cc4c3OCCCO4)(=O)=O)CC2)c1,2 Y041-8461,O=C(CCC(N(CC1)CCN1c1ncccc1)=O)Nc(cc1)cc2c1[nH]cc2,2 F6573-8949,CCN(C=C1C(NCc2cncc(-c3cocc3)c2)=O)c(nc(C)cc2)c2C1=O,2 Y040-2697,OC(CCCC1)(CC2)C1CN2C(COc(cc1)cc(O2)c1C(CCCC1)=C1C2=O)=O,0 Y032-4670,CN(C)C(N(CC1)CCC1C(Nc(cc1)ccc1S(NC1CCCCC1)(=O)=O)=O)=O,2 Z1000073886,NC(C(CC1)CCN1c(cc1)ccc1NC(c1csc(-c2cc(C(F)(F)F)ccc2)n1)=O)=O,2 Z2953012887,O[C@H](CC1)CC[C@@H]1NC(Nc1cc(Cl)cnc1)=O,0 Z1233919781,CN(CC1CC1)c(c1ncccc11)ccc1S(N)(=O)=O,2 Y043-4767,O=C(CC(C(N1Cc2ccccc2)=O)NC1=O)Nc1nc(CCC2)c2s1,0 Z4500649928,CC(Cc1cc(C(N(CCOC2)C2c2cccn2C)=O)c2)Oc1c2OC,2 F6288-0552,CC(C)(C(NCCc1nc(-c2ccco2)cn1C)=O)Oc(cc1)ccc1Cl,2 Z1510260836,CCc(c(C(N(C)C(N1C)=O)=O)c1nc1)c1C(N(CCC1)CC1(CCC1)c2c1cccc2)=O,2 F6524-4330,CCn1nccc1C(N(CC1c2nocn2)CC1c1ccccc1)=O,2 F6739-7760,CN(Cc(cc1)cc2c1OCCO2)c1c2sccc2ncn1,2 G856-2366,O=C(NC(CC1=O)CN1c1ccccc1)Nc1nccs1,0 J093-0953,O=C(c1nn2c(C(F)(F)F)cc(-c3cccs3)nc2n1)N(CC1)CCN1c1ncccc1,2 F6561-2423,Cc1cccc(S(NCCC(N(CC2)CC2OCC2CC2)=O)(=O)=O)c1,2 Z2465932073,CC(C)(C)c1nc(C(O)=O)nc(N(C)Cc2ncc[nH]2)c1,2 Z1331724420,O=C(c(cccc1)c1F)N1C(Cc2ccccc2)CC1,0 Z1104903025,CNCC(CC1)CCN1C(C1CC1)=O,0 F3225-8564,Nc(n1c(nc2)nc3c1cccc3)c2C(NC1CCCCC1)=O,2 F6773-4180,Cn1c(N(CC2)CCC2Oc2nc3ccnn3cc2)nc2c1cccc2,2 Z1895027761,CC1=CC=CN2C1=NC(CN(CC1)CCC1(CCN1C)C1=O)=CC2=O,2 Z183376940,O=C(NC1CC1)N(CCC1)CCN1c1ncc(C(F)(F)F)cc1,2 Z2966033962,CCC(c1c(C2)cccc1)N2C(CN(c(cccc1)c1N1)C1=O)=O,2 Z2466244095,Cc1noc(C)c1-c1cc(CN(C)C)ccc1,0 S995-0905,CC(C)C(N(CC1)CCC1[C@@H](C1)[C@@H](CO)CN1C(c1nc2ccccc2cc1)=O)=O,2 Y503-1021,CC(C)(C1)CC(C)(CNS(c2ccccc2)(=O)=O)CC1NS(c1ccccc1)(=O)=O,2 Z3062861635,CCn1c(CCN(CC(NCc2cc(C)ccc2)=O)C23CCOCC3)c2nc1,2 G581-0295,Cn1c(cccc2)c2c(-c2nn(CCC(N3CCCC(N4CCN(C)CC4)=O)=O)c3c2)c1,2 F6541-7640,Fc(cc1)ccc1N1CCN(CC2OCCC2)CC1,2 SC88-1710,CC(C)CN(C1)CC1(C(CC1)c2nc(Cc(cc3)ccc3OC)no2)S1(=O)=O,0 SA02-1121,Cc1ncc(COC)c(C(CC2)CCN2C(c2ccc(Cn3ncnc3)o2)=O)n1,2 F6753-1096,COc1nc(N2CC(C(N3CCOCC3)=O)OCC2)nc(OC)c1,0 Z1698641244,O=C(c1noc(COc(cccc2)c2F)c1)NCc1cc(OCC(F)(F)F)ccc1,2 F6451-0432,COC(CNC(C(Nc(cccc1)c1SC)=O)=O)c(cccc1)c1OC,0 F6425-0176,O=C(c(cc1)nnc1-n1ncnc1)N(CC1)CCN1c(cc1)cc(Cl)c1F,2 G740-1450,CC(C(NCCc1c[nH]c2c1cccc2)=O)N(C(c1c2C)=O)N=C(C)c1nn2-c1ccccc1,2 Z2627600424,CC(CN(Cc(cc1)cnc1Oc(cc1)ccc1F)C1)NC1=O,2 Z1613959339,CCOC(c1n[nH]c(NC(Cc2ccc(C(F)(F)F)cc2)=O)c1)=O,0 F6476-3890,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CC1Oc1nc2ccccc2cc1,0 V023-6897,Cc1c(C)cc(C2N(Cc(cc3)cc(OC)c3OC)CCCn3c2ccc3)cc1,0 F6443-7799,O=C(c1cc(-c2ccccc2)n[nH]1)NCC(CCC1)N1c1ccccc1,2 F6015-0470,CCOC(N(CC1)CCC1NC(CCCn1c(C)ccc1C)=O)=O,2 J500-0156,COCCNC(C(C1)C2(CCCC2)CN1C(c1cocc1)=O)=O,0 F6713-1695,Cc1cc(C)nn1C(C=C1)=NN(C(CC2)CCN2C(CN(c(cccc2)c2O2)C2=O)=O)C1=O,2 Z2071367479,OC1(CNC(C(Oc2c3ccc(F)c2)=CC3=O)=O)CCCCC1,2 Z2790362541,COCCN(C1CCOCC1)S(N(CCC1)C1C(O)=O)(=O)=O,2 Z1652081916,Cc(nc(cc1)NCCO)c1Br,0 Z3085485597,O=C(c1nn2c(C(F)(F)F)ccnc2c1)NCC=CC1CC1,2 SB99-0104,Cc1cc(C)nn1CCC(N(CC1)Cc2c1n(C)nc2CCC(N1CCCCC1)=O)=O,2 F6523-1761,O=C(C1COCC1)NC(CC1)CCN1c1n[nH]c(C2CC2)c1,2 J500-0330,COCCNC(C(C1)C2(CCCC2)CN1C(CCCc1nc(cccc2)c2s1)=O)=O,2 F6125-0567,O=C(C(C1)CN1C(c1cccs1)=O)NCc1nc(cccc2)c2[nH]1,2 8006-7072,CN(C(CC1N(CC2)CCN2c(cc2)ccc2Cl)=O)C1=O,0 F2106-0086,Oc(cc1)cc(O/C2=C\c(cccc3)c3OC(F)F)c1C2=O,0 V019-1397,CC(CN(CC1OCCC1)Cc(c(C)nn1-c2ccccc2)c1Oc(cc1)ccc1OC)O,0 F6233-0077,CN(C1=O)N=NN1c(cc1)ccc1NC(c1c(C(F)(F)F)cccc1)=O,0 Z1320206712,Cn1ncc(CC2CN(CC(NCc3cc(OC)ccc3)=O)CC2)c1,0 F2580-1842,O=C(CN(C=CN(c1cccc2ccccc12)C1=O)C1=O)Nc1cccc(Cl)c1,0 SC10-0031,CS(N(CCCN1CCOCC1)C(CC1)CN1C(c(cc(cc1)Cl)c1F)=O)(=O)=O,2 Z3654759602,COc1ccc([C@@H](CN(C2)C([C@@H](C3)[C@H]3c3cc(O)ccc3)=O)[C@H]2C(O)=O)cc1,2 8008-4240,CC(C)(C)c(cc1)ccc1C(Nc1nnc(-c2cc(C)ccc2)s1)=O,0 F6546-1150,CN(C)C(C(CC1)(CN1c(nc1)ncc1F)F)=O,0 SC21-0327,Cc1cnc(-c2nn(C)c(CC3)c2CN3S(c2cc(F)cc(F)c2)(=O)=O)n1CC1CC1,0 F477-2904,O=C(c(sc1c2cnc3ccccc13)c2-c(cc1)ccc1Cl)NCCCN1CCCC1,2 F6805-9849,CN(C=CC(CN1CC(COc(nccc2)c2Cl)CCC1)=C1)C1=O,2 Z3687023595,COc1cccc(COCC(N[C@@H](CC(Cn2nccc2)C2)[C@H]2O)=O)c1,0 F6412-1682,O=C(Cc1c[nH]c2c1cccc2)NCC#CCOc1cccc(C(F)(F)F)c1,0 E587-0635,CC(C1)OC(C)CN1C(Cn1c(cccc2)c2c(SCC(NC2CCCC2)=O)c1)=O,2 V015-8787,O=C(c1cc(F)ccc1)N(CC1CC1)Cc(n1C2CC2)cnc1S(Cc1ccccc1)(=O)=O,2 F5868-0204,O=C(COc1ncccn1)NCc(cc1)ccc1Cl,0 SA46-1090,COc1cccc(CC(N(C2)CC2(C2)OCC2N2CCCC2)=O)c1,0 S381-0570,Cc1cc(C(N(CCC2)CC2(C(N2Cc3cccc(Cl)c3)=O)NC2=O)=O)cc(C)c1,0 F849-0196,O=C(CN(c(cc(cc1)C(N2CCCCC2)=O)c1O1)C1=O)N(CC1)Cc2c1cccc2,2 Z2839198375,O=C(CN1[C@@H](C2)CN(CC(Nc3nccs3)=O)[C@@H]2C1)Nc1nccs1,2 F2879-5671,O=C(C(NC1CCCCCC1)=O)NCc(c(F)ccc1)c1F,0 Z1908518547,OC(Cc(cccc1)c1F)(CC1)CCN1C(COc(cccc1)c1F)=O,2 F2880-4110,Cc(cc(cc1)S(NCC(c2cccc3ccccc23)N(C)C)(=O)=O)c1OC,0 F6796-6675,O=C1NC(N(CC2)CCN2c2nc(ccc(F)c3)c3o2)=NC(C2CC2)=C1,2 F6523-0736,Cn1c(C(NC(CC2)CCN2c2ncnc3c2CCCC3)=O)ccc1,2 Z3627495559,C[C@@H](c1ccncc1)ONC(C(C1)OCC1c1ccccc1)=O,2 Y300-3893,O=C(C1CCCCC1)NCCSC1CCCC1,2 F6523-0008,Cc1c(C(NC(CC2)CCN2c2ncnc(C(F)(F)F)c2)=O)sc(-n2cccc2)n1,2 Z165051056,Cc1nc(-c2ccc(CCNC(c3cc(Cl)c[nH]3)=O)s2)cs1,2 S892-0518,CN(C)S(N(CCCC1)C1c1nn(Cc2ccccc2)c2c1COCC2)(=O)=O,0 F6403-1473,CCN(Cc1cnc2n1cccc2)S(c(cc(cc1)F)c1OC)(=O)=O,2 F5833-1260,Cc1noc(C)c1S(NCC(c1cccn1C)N(C)C)(=O)=O,2 F3394-1373,CCc(c(C(CC(C)(C)C1)=O)c1nc1SCC(Nc2cc(C)ccc2)=O)c1C#N,0 Z636475244,Cc(cc1)cnc1NCc1cccc(O)c1,0 F6713-4667,Cc(cc1)nnc1N(CC1)CCN1c1nccc(C#N)c1,0 Z4010115904,Cc1c(C(N[C@@H](C2)[C@@H]2[C@H](C2)[C@H]2C(O)=O)=O)oc(C2CC2)n1,2 Z2961838178,O=C(c([nH]c1ccc2)cc1c2F)NC[C@@]1(CCC2)[C@H]2OCC1,2 SA73-0655,COc1cccc(CN(CC2)CCC2(CC2CC2)c2noc(C3CCOCC3)n2)n1,2 F6445-3102,Cc1nn(cc(CCCNC(Cc2cn(C)c3c2cccc3)=O)cn2)c2c1,2 SD56-0657,O=C(CCC1CCCCC1)N(CCC1)CC(C(N2C3CCCCC3)=O)N1C2=O,2 Z1241474740,Cc1ccc(C2N(CC(SC3=NC(C)=C4)=NN3C4=O)CCCCC2)o1,2 Z1667226005,CCOc(cccc1)c1C(N1CCC(C)(CN2CCN(C)CC2)CC1)=O,0 Z3026725044,O=C(CC(CC1)CC1(F)F)NCc(nc1n2cccc1)c2Cl,2 SA24-0253,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(Cc1cccc(Cl)c1)=O,0 Z2721909552,CC1(COC)OCCN(Cc(cc(cc2)C(O)=O)c2Cl)C1,0 SD08-0567,CN(C)C(NCc1c(COC(CCC2)(C3)CN2C(c2ncncc2)=O)n3nn1)=O,2 Z2394266934,Cc1c(C(N(CCNC2)C2c2cccc(F)c2)=O)nc(-c2cn(C)nc2)o1,0 F6363-0177,COc(nc1)ncc1NC(c(ccc(Cl)c1)c1Cl)=O,0 V022-6902,CC(C)CCN(CC(C)O)CC(N(CC1)C(COc2cc(F)ccc2)c2c1scc2)=O,0 CM4582-2414,Cc(cc1)c(C)cc1NC(N(CC1)CCC1N(C1)[C@H](COCC2CC2)CC1(F)F)=O,0 Z3899644922,COc(cc1)ccc1C(CSC(N1)=Nc2nc(O)c(CCC(O)=O)nc2C1=O)=O,2 Z2900731740,CCc1nc(CNc(cc2)ncc2S(C)(=O)=O)c[nH]1,2 Z1720185490,Cc1c(CNC(c2c(-c(cc3)ccc3F)ocn2)=O)nco1,2 Z2790040342,CC(C1)(CN1S(c1cc(CC(O)=O)ccc1)(=O)=O)O,0 G352-2029,O=C(c(cnn1c(-c2ccccc2)c2)c1nc2-c1ccccc1)NCCCN(CCC1)C1=O,2 Z2460722858,CC(C)Cc1ccc(C(C)NC(C2(CCOCC2)C(O)=O)=O)cc1,0 Z1892256821,CCc(ccc(C(O)=O)c1)c1S(N(CC1)CCC1(CCN1C)C1=O)(=O)=O,0 F6523-3940,CC(NC(CCSC)C(N(CC1)CC2=C1N=C(C=CC(F)=C1)N1C2=O)=O)=O,2 F6497-0044,O=C(c1cc(Br)cnc1)N1CC(Cc2nc(-c(cccc3)c3F)no2)CCC1,0 Z1798213646,O=C(C(CCC1)N1c1c(ccc(C(F)(F)F)c2)c2ncc1)NCc1ccco1,0 F6573-6317,CS(c1ccc(CCC(N(CC2)CCC2(C2)C2(F)F)=O)cc1)(=O)=O,0 F6571-5644,CC(Cc1csc2c1cccc2)NC(c1noc(C)c1)=O,2 Z3759773739,CCC(C)(CC1)CN1c1nnc(C(N2CCCC2)=O)n1CCC(N1CCCCCC1)=O,2 L010-0477,O=C(c(cc1)ccc1-c1ncnc(NC2CCCCC2)c1)Nc(cc1)cc2c1OCCO2,2 Z2801056818,C[C@](CC1)(C(N(C2)CC2OC(F)F)=O)NC1=O,0 Z3411091522,Cc1nn(C2CCN(Cc(cc3)ccc3C#N)CC2)c(N)n1,2 SA58-1206,Cc1nn(C)cc1CN1C(CCc2noc(-c3ccccc3)n2)CCC1,0 F5250-0271,O=C(CSCc1ccccc1)N1CCN(Cc2nnnn2-c(cc2)ccc2Cl)CC1,2 F2758-0166,CC(C)(C)NC(NCC(c1c2cccc1)=NNC2=O)=O,0 Z2296072893,OC(c1cn(C(CC2)CCN2C(c2n[nH]c3c2CCCC3)=O)nc1)=O,2 F6494-0891,CCOc1cc(C(Nc2nc(ccc(Cl)c3)c3s2)=O)ncn1,0 Z3027211338,C[C@@H](C1)[C@@]1(C)S(NCCc1cn(CCCC2)c2n1)(=O)=O,2 SC67-0122,CC(C)N(C1)CC2(CCN(Cc(cc3)cc4c3OCC4)CC2)C1c1nncn1C,2 F6529-0958,CN(C(C(F)(F)F)=NN1C(CC2)CCN2C(CN2N=CC=CC2=O)=O)C1=O,2 Z2359196212,C[C@](C1)(C[C@@H]1NS(c(cc(s1)Cl)c1Cl)(=O)=O)O,0 Z1289844002,Cc1nn(C(CC2)CS2(=O)=O)c(NC(CN(CC2)CC22CCOCC2)=O)c1,2 Z1973500534,COc(cc1)cc(NS(c2ccc(C#N)s2)(=O)=O)c1C(O)=O,0 V018-3035,Cc1c(CN(CCN2CCOCC2)CC(COc2c(C)cccc2)O)cccc1,0 F6562-0858,Cn1ncc(C(CN(C2)C(C(CCC3)N3c3nc(cccc4)c4o3)=O)c3c2cccc3)c1,2 SA01-0832,CN(C)C(c1cnc(N(C)C)nc1C(CC1)CN1C(c(cc1)cc(F)c1OC)=O)=O,0 V010-6347,O=C(c(cc1)ccc1-c1c(CCCc2c-3cccc2)c3n[nH]1)NCCc1cccs1,2 Z2771401823,CCc1nc(NCc2nnc(C3CCOCC3)[nH]2)c(ccs2)c2n1,2 F5652-3218,CC(C)(C(NCCc1c[nH]c2c1cccc2)=O)N(C(C=C1)=O)N=C1c1ccco1,2 Z1903237525,Cc1nnc(C2OCCN(Cc3cc(F)cc4cccnc34)C2)o1,2 Z2745005795,CCNS(c1ccc(CNc2nn3c(-c4cc(F)ccc4)nnc3cc2)cc1)(=O)=O,0 S810-0237,Cc1noc(C)c1S(N(CC1)CCC1(C1)C1c1noc(C)n1)(=O)=O,2 Z2071993590,CC(C)c1cc(C(NCC2(CCOCC2)O)=O)c(C)o1,0 Z4761671418,CC(C)c(c(C(NCc1cnccc1)=O)c1)nn1-c1ccccc1,0 S984-0447,CN(C)C([C@@](CN(C1)C(Cc2cscc2)=O)(C2)[C@@H]1CN2C(c1ccncc1)=O)=O,2 F6549-5418,Cn1c(C(CC2)CCN2C(CCN(C=Nc2c3cccc2)C3=O)=O)cnc1,2 F6619-7962,Cc1cc(C)nn1-c(cc1)nnc1N1CCN(Cc2noc(C)c2)CC1,2 F6529-3912,CCOc(cccc1)c1NC(CN(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O)=O,0 Z1626935309,O=C(c1cccc2cnccc12)N(CC1)CCN1C(CCCN1Cc2ccccc2)C1=O,2 D398-0593,O=C(c1noc(-c(cc2)ccc2Cl)c1)N(CCC1)C1c1ccco1,2 F6435-1823,N#Cc(cc1)ccc1C(N(C1)Cc2c1cncn2)=O,0 F2539-0242,CC(C)(C)CC(NC(CC1=O)CN1c1cc(C)c(C)cc1)=O,0 3715-0093,Cc1nc(NS(c(cc2)ccc2NC(CSc2nc(CCC3)c3cc2C#N)=O)(=O)=O)nc(C)c1,2 D454-0287,COc(ccc(N1Cc2nc(cccc3)c3n2CC1)c1)c1NC(Nc1ccccc1)=O,0 Z3063571186,CC(C)n1nccc1C(N(CCN1C)c2c1ncc(C)c2)=O,2 J500-0702,CN(C)C(C(C1)C2(CCCC2)CN1C(c(ccc(OC)n1)c1OC)=O)=O,0 F6186-0262,CC(CNS(c(cccc1)c1Cl)(=O)=O)(CSC)O,0 Z1408055820,Cc(cc(cc1)C(O)=O)c1S(N(C)c(cc1)ccc1C(N)=O)(=O)=O,0 Z3700232053,CC(C)c1c(CNC(N2CC(C)CC(C)C2)=O)[nH]nc1,2 SA58-0504,O=C(c1cscc1)N1C(CCc2noc(C3CC3)n2)CCC1,2 SA95-0307,CCn1nc(C)c(CN(CCC2)C2c2ncc(C)n2Cc(cc2)ccc2OC)c1,0 F6514-8900,CC(C(NCc1cc(-c2cnccc2)ncc1)=O)n1nccc1,2 F058-2150,CCCn1nnc2c1ccc(C(Nc(cc1)ccc1NC(C)=O)=O)c2,0 SB03-0359,CN(CCN(C1CCOCC1)C(CCC1)CN1C(C1CC1)=O)C(c1cscc1)=O,2 Z2330035069,Nc1nccc(CN2[C@H](CCC3)[C@H]3OCC2)c1,2 Z2974889948,N#CC(CCC1)CN1c1ncnc(-n2cncc2)c1,2 S639-9036,CN(C)C[C@@H](CN(C1)c2ncccn2)[C@H]1NC(c1ncncc1)=O,2 F6561-8105,COC(c(cc1)ccc1C(N(CC1)CC1N(CCO1)C1=O)=O)=O,0 F6549-5174,Cn1ncc(C(CCC2)CN2S(c(s2)ccc2Br)(=O)=O)c1,2 F6678-8739,Cc1nc(cccc2)c2n1C(C1)CN1c(ccnc1)c1Cl,0 F6279-0125,Cn(c(C(NCC(c1cscc1)N1CCOCC1)=O)c1)nc1-c(cc1)ccc1F,2 F6562-2047,O=C(NCc1cncc(N(CCC2)C2=O)c1)OCC(F)(F)F,2 F6808-8424,OCC(CCC1)CN1c1cnc(C(F)(F)F)cc1,0 Z2213916259,O=C(C(CCCN1c2ccccc2)C1=O)NCc1cnccc1,2 F5773-2556,CCOc1cccc2c1nc(N(CC1)CCN1C(c1noc(-c3ccco3)c1)=O)s2,2 L949-2789,COc1cccc(-c2noc(C(CCC3)N3C(Nc(cc(cc3)Cl)c3OC)=O)n2)c1,0 F6550-6648,O=C(CCCC(N(C1)CC1Nc1ncncc1)=O)c1ccccc1,2 Z4958830499,Cc1c(-c(cc2)ccc2Br)oc(CCC(Nc(cc2)cc(CO)c2F)=O)n1,0 F6619-7958,Cc1cc(C)nn1-c(cc1)nnc1N(CC1)CCN1c1nccc2c1ccs2,2 SB91-0438,Cc1nccc(C(N(CC2)CC2N(CCN2CCOCC2)S(C)(=O)=O)=O)c1,2 F6436-0598,Cc(n(C)nc1C)c1S(NCC(CC1)CCN1C(OC)=O)(=O)=O,0 S720-0521,COCCNC([C@H](C[C@@H](C1)Oc2ccccc2)N1C(CCc1c[nH]c2c1cccc2)=O)=O,2 Z2976430671,Cc1cnc(N(CC2)CCC2c(cc2)ccc2S(N)(=O)=O)nc1,0 Z3681766677,CC(C)CC(CC([O-])=O)C(N[C@@H]([C@@H]1C2)[C@H]1c1c2cccc1)=O,2 Z3063546856,CCNC(N(CC1)C[C@H]1Oc1c(N(C)C)nccc1)=O,0 5568-0374,CCCCC(CC)(NC1=S)NN1c1cc(C)c(C)cc1,0 Z2993287064,Cc(cc1)cc(CN[C@@H](CCOC2)[C@H]2O)c1NC,2 V021-9940,OC(CN(CC1CC1)Cc1c(N2CCCCC2)onc1-c1ccccc1)COc1ccccc1,0 F6764-1471,Cc1cc(C(N(CC2)CCC2c2ccc(cc(cn3)Cl)c3n2)=O)c(C)o1,2 G786-0637,CNC(c1c(NC(c(cc2)ccc2S(N(CCC2)c3c2cccc3)(=O)=O)=O)sc2c1CCC2)=O,2 F2294-0009,CN(CCC1)c2c1cc(CCNS(c(cc1)cc(OC)c1OC)(=O)=O)cc2,0 Z4856943588,O=C(C(CC1)CN1c(cccc1)c1Cl)NCC(CC1)CN1c(cc1)ccc1Cl,2 3448-5873,CCCCC(C)(NC1=S)NN1c(cc1)ccc1Cl,0 S835-2623,CN(CC1(CC2(CCNCC2)OCC1)O)C(c(cc1)cc(F)c1F)=O,2 Z3071585115,CCCC(C)N(C)c1ncnc2c1nnn2C1CC1,2 S915-0039,CO[C@@H](C[C@H]1CN(C2)S(c(cc(cc3)OC)c3OC)(=O)=O)CN1C2=O,2 Z5001783368,Cn1ncc(CC(C(NS(c2cn(-c3cc(C(F)(F)F)ccc3)nc2)(=O)=O)=O)N)c1,2 F6435-7333,CC(C)(C)S(C(CC1)CN1S(C1CCCCC1)(=O)=O)(=O)=O,0 K284-6113,CCC(C(NCCOC)=O)SC(N1CCC2=CCCCC2)=Nc(cc(c(OC)c2)OC)c2C1=O,2 Z803854198,CC(c1ccccc1)NC(C(CCN1c(cc2)cc(F)c2F)C1=O)=O,0 Z1373864524,Cc1c(NC(C(C2)CN(C3CC3)C2=O)=O)n(-c2ccccc2)nc1,0 SB91-1211,Cc1noc(C)c1S(N(CC1)CC1N(CCN1CCCCC1)C(N(C)C)=O)(=O)=O,2 Z3651349247,CC1(C)OC(CCC2)(CN2C(CC2(CC3)CC3CC2)=O)NC1=O,2 Z5054602631,CC(c1nc(C(F)F)ccn1)NC(c1c(-c(cc2)ccc2F)ocn1)=O,0 Z1568398364,O=C(CCC1)N1C1CCN(Cc2cc3cccnc3cc2)CC1,2 Z1741119516,O=C(Cc1n[nH]c2c1CCCC2)NC(CCC1)CN1C(c1ccccc1)=O,2 Z1505793952,Cc1cccc(N(CC2)CCN2C(c(cc2)cc3c2n(C)cn3)=O)c1,0 F6442-6821,O=C(c1ccco1)N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F,2 F6561-5039,C=C(CC1CC2)CC2N1C(NCc(cc1)cc2c1OCO2)=O,2 Z2755514898,C[C@@H](C(O)=O)N(C)C(c1c(C)cco1)=O,0 S395-0145,Cc(cccc1)c1OCC(N(CC1)CCC1(C(N1Cc(cc2)ccc2Cl)=O)NC1=O)=O,0 F0745-0027,O=C(c(cc1)ccc1OC(F)F)Nc(cccc1)c1Br,0 F6514-1943,CC(N1CCNC(c(cc2)cnc2OC2CCCC2)=O)=CC(OC)=CC1=O,2 Z160499606,Brc1cc(CNc2cccc3cccnc23)ccc1,0 F6513-5495,O=C(c(cc1)cc2c1ncs2)NCc1c(CCCC2)n2nc1,2 Z1981897575,Nc(c(-c1ccccc1)ncc1)c1C(NCc1cnccc1)=O,0 Z1204326204,Cc1noc(COCC(N2CCCC2)=O)n1,2 Z1302797030,CCC(C)(C)CC(Nc(ccnc1)c1C#N)=O,0 Z1564500671,C[C@H](CNCc1cccc(C(F)(F)F)c1)O,0 F6656-2511,Cc(cc1)nnc1OCC(CC1)CCN1c(nc1)ncc1Br,0 Z2909248256,Cn1ncc(N(CC(C2)C(NC(CC3)CCC33CCN(C)CC3)=O)C2=O)c1,2 Z1090777692,Cc(cc1nc2)nn1c(C)c2C(Nc(cc1)cc(OCc2nc3ccccc3cc2)c1OC)=O,2 F052-0046,COc(ccc(CCNc1ccc(cc(cc2)S(N3CCCCC3)(=O)=O)c2n1)c1)c1OC,2 Y205-6093,CCn1nc(C)c(CNC(C(C2CC3CC2)C3C(O)=O)=O)c1,0 F5226-0106,CC(Nc(cc1)ccc1C(NCCNC(C1c(cccc2)c2Oc2c1cccc2)=O)=O)=O,2 Z1352653021,CN(CCC(F)(F)F)C(Nc1cccnc1Sc1ccccc1)=O,0 Z446254468,COc(c(OC)c1)cc(CNCCC(O)=O)c1Br,0 V007-2390,Cc1c(CNC(c2noc(-c3ccc(C4CCCCC4)cc3)c2)=O)cccc1,0 M758-2261,CC(C)CN(Cc1ccncc1)C(C1)CN1C(C(C)c1ccccc1)=O,2 F6516-0608,O=C(Cc(cccc1)c1Cl)NCc1ccc(-c2ccco2)o1,0 F373-0453F,CC(C)C(c1nc(-c(cc2)ccc2N2CCOCC2)no1)NS(c1ccc(C)cc1)(=O)=O,2 F2411-0088,CS(c1c2nc(N(CC3)CCN3c3nc(c(F)ccc4)c4s3)sc2ccc1)(=O)=O,2 F6619-4253,Cc1cc(N2CCOCC2)nc(N(CC2)CCN2c2ncnc3c2cnn3C)n1,2 Z3687058287,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NC(c(cc1)ccc1-c1cnco1)=O,2 Z2505229669,CCC(c1nc(C2(CCC2)c2ccncc2)no1)OC,0 Z2996050260,Cc(ccs1)c1S(N[C@@H]1C[C@H](CC(O)=O)CC1)(=O)=O,0 Z3913377651,O=C(CN(C(C=CN1Cc2ccccc2)=O)C1=O)NC(C1)C1(C1)C1(F)F,2 F2289-0182,Cc1cc(C(Nc2nnc(C3CCCCC3)o2)=O)c(C)o1,2 Z1754413321,CC(C)c1nc(C)cc(N(C[C@H](C2)OC)[C@H]2c2nnc(C)o2)n1,0 F6125-2385,CC(N(C1)CC1C(NCCc1cccs1)=O)=O,2 Z2732694943,CC(CC1)Cc2c1[nH]c(C(OC)=O)c2,0 V014-2202,Cc1cccc(NC(Cc(cc2)ccc2N(Cc2c(C)cccc2)C(C2CCCC2)=O)=O)c1,2 S582-0609,O=C(CN(c(cccc1)c1O1)C1=O)NCC(Cn1c2ccc1)N(Cc1ccccc1)C2=O,2 Z363641164,CCc(cccc1)c1N(CC(C1)C(NCc(cc2)cnc2-n2cncc2)=O)C1=O,0 Z976261744,O=C(c(cc1)cc(O2)c1NC2=O)N1c2cccc(F)c2C2(CCCC2)C1,2 F6245-4786,CN(C1=O)N=C(C(CCC2)CN2C(c(cc2)cc3c2ncs3)=O)N1c1ccccc1,2 8014-2412,CCCCC(C(C(CCC1)=O)=C1NCCc1c(C)[nH]c2c1cc(C)cc2)=O,0 Y020-4025,Cc(nc(N1CCCC1)nc1)c1C(N=C(Nc(cc1)ccc1Oc1ccccc1)N1)=CC1=O,2 S720-0361,CNC([C@H](C[C@@H](C1)Oc2ccccc2)N1C(C(c1c2cccc1)=NNC2=O)=O)=O,0 V029-6614,O=C(C(C1CCCC1)N(CC1)CCN1C(C1CCC1)=O)Nc1cccc(Cl)c1,0 F6360-9658,CCC(Nc(cc1)cc(C)c1S(N(C1)CC1Oc1cnccc1)(=O)=O)=O,0 SA44-1059,CC(C)S(N(C1)CC1(C1)CN(C)C1c1nnc(-c2ccccc2)o1)(=O)=O,0 F6231-1033,Cc1nccn1C(C=C1)=NN(CCNC(C(CC2=O)CN2c2cc(C)c(C)cc2)=O)C1=O,2 Z1646910051,O=C(CCCNC(Nc1nc(Cc2ccccc2)ncc1)=O)NC1CC1,2 F2189-0997,Cc(cc1)ccc1S(N(Cc1c2cccc1)CC2=O)(=O)=O,2 Y030-8676,CC(C)Cc1nnc(NC(C2OCCC2)=O)s1,0 Z3651339333,CC1(C)OC(CCC2)(CN2C(C(C(CC2)CCC2C(F)(F)F)O)=O)NC1=O,2 F5860-4142,COC(C(CC(C1)C2)(CC1C1)CC12NC(c1noc(-c2ccccc2)c1)=O)=O,2 Z2882051052,CC(c1nn(CCCC2)c2c1)NC(c1cccnc1C(F)(F)F)=O,2 V017-7864,CC(C1=O)N(Cc2ccccc2)CCN1c1c(C)ccc(C)c1,0 Z1625621209,COc1ccc(C(CN2CCCC2)NC(c2cccc(N3)c2OC3=O)=O)cc1,2 F6525-7087,Cc(n(CCNC(c(c(F)ccc1)c1Cl)=O)nc1C)c1-c1ccco1,0 Z2228837508,CN(Cc(cccc1)c1F)C(C(N=C(C1CC1)N1)=CC1=O)=O,0 F3139-2824,Cc1cc(NC(COc(cc2)cc(OC=C3c4ccccc4)c2C3=O)=O)cc(C)c1,2 Z1272620102,Cn1c(ncnc2Nc3cccc(CC(F)(F)F)c3)c2nc1,0 Z2527336732,COc(cc1)cc(-n2nnc(CN3C(CO)CCC3)c2)c1Cl,0 S988-0689,CCn1nccc1C(N(C[C@@H]1CN(C2)C(C3CC3)=O)C[C@@]12c1nc(C)no1)=O,0 F6057-0335,Cc1cc(C)nn1CCN(CC1)CCN1C(c1cccc(Cl)c1)=O,0 F5251-0211,O=S(c(cccc1)c1F)(N1CCN(Cc2nnnn2-c(cc2)cc(F)c2F)CC1)=O,0 G587-0375,CN1c(cc(cc2)C(N(CC3)CCN3c3ncccn3)=O)c2N(CCCC2)C2C1=O,2 F1583-0055,CCCCCOC(Nc1c(C)c(C(OCC)=O)c(C)[nH]1)=O,0 F6806-7498,Cn1c(ncnc2N(CCC3)CC3C(N(CC3)CCC3(F)F)=O)c2nc1,2 Y042-1661,COc1ccc(C2(CCOCC2)C(NC(CCC2)c3c2c(cc(cc2)Cl)c2[nH]3)=O)cc1,0 F6125-1101,O=C(C(C1)CN1C(c1c[nH]c2c1cccc2)=O)NCc1cccs1,2 F6685-8517,O=C(C1(CCOCC1)c1ccccc1)N1CC(COc2c(C(F)(F)F)cccn2)CCC1,2 F115-0349,COCc1nc2cccnc2n1C(CC1)CCN1S(c1cccc2nsnc12)(=O)=O,0 L949-1330,CCC(C)NC(N(CCC1)C1c1nc(-c2cccc(Cl)c2)no1)=O,0 E636-0516,CC(C)CCN(C(C)(Cn1c2ccc1-c1ccccc1)C(NC1CCCCCC1)=O)C2=O,2 S607-0046,CN(c1cccnc1N1[C@@H](CCC2)CN2C(COc(cc2)ccc2F)=O)C1=O,2 SA57-0231,O=S(Cc1ccccc1)(N(CC1)CCC1(C1)OCCC1Oc1nccnc1)=O,2 J029-0161,CCC(N(CC1)CCN1c(cc1)ccc1NC(C1(CCCC1)c(cc1)ccc1Br)=O)=O,0 Z942300340,CCc1n[nH]c(C(N(CC2)CC2c2ccccc2)=O)c1,0 F5012-0139,O=S(CCCOc(cc1)cc2c1OCO2)(NCCC1=CCCCC1)=O,2 F9994-0102,CN(C(c1ccccc1)=Nc1c2ccc(OC)c1)C2=O,2 Z2711337023,O=C(c1cn(C2CC2)nc1)NCCC(NO1)=NC1=O,2 E002-0226,CC(C(NC(CCC1)c2c1cccc2)=O)n1nc(C)c2c1cccc2,2 Z1127071716,Cc1c(C(NN2C)=O)c2nc(C)c1CC(NCc1cc(F)cc(F)c1)=O,0 Y031-1848,CCC(Nc(cc1)ccc1C(N1CC(C)CCC1)=O)=O,0 Z2348001134,CC(C)Cc1csc2nc(C)nc(NC(CO)c3ccnn3C)c12,0 F6792-3961,Cc1nc(C)nc(N(CC2)CCN2c2nc3ccccc3nc2)c1F,0 Z1999794646,CC(C)c1nc(CCNC(N(CC2)CCC22OCC2)=O)cs1,2 Z2073314653,CC(N1CC(CN(C)C(C(CC2)CCN2c(ccc(C#N)c2)c2F)=O)CC1)=O,2 Y040-5778,O=C(c1cc(-c2ncccc2)nc2ccccc12)Nc(cc1)cc2c1OCCO2,2 F5959-0256,Cc1nccn1CCNC(Nc1cccc(C(F)(F)F)c1)=O,0 Z3810976438,CCOC(CN(CCC1)CCN1C(c(c1c2CCC1)nn2-c(ccc(Cl)c1)c1Cl)=O)=O,2 F6524-4326,O=C(CCc1c[nH]c2c1cccc2)N(CC1c2nocn2)CC1c1ccccc1,2 Z1507104357,Cn1c(ccc(C(N2CC(c3ccco3)OCC2)=O)c2)c2nc1,2 F6246-2547,CCc(s1)ccc1S(N(CC1)CCC1C(N1c2ccccc2)=NN(C)C1=O)(=O)=O,2 F6481-4080,O=C(CCN(C=Nc1c2cccc1)C2=O)N(CC1)CCSC1c1cccs1,2 Y204-0992,CC(CN(C(C)C1)C(C2C(CC3)CC3C2)=O)N1C(C1C(CC2)CC2C1)=O,0 F6724-5407,Clc1cc(CN(CC2)c3nc(cncc4)c4s3)c2s1,2 Z1119714284,COc(cc1)ccc1-c1nc(CNc2c3sccc3ncn2)n[nH]1,2 Z432721254,Cc(n(C)nc1C)c1-c1n[nH]c(C(NC2CC2)=O)c1,2 F2487-0040,CC(C)(C(NCC1)=O)N1C(c1cccc(C(F)(F)F)c1)=O,0 Z3045722562,CCC(CC)(CNC(N(C[C@@H]1CC2)C[C@@]12N)=O)OC,0 S993-1176,O=C(NCc(cc1)ccc1F)N(CCC1C(N(Cc2cccc(F)c2)C2)=O)CCN1C2=O,2 F6416-5650,OC(CCNC(C1c(cccc2)c2Oc2c1cccc2)=O)c1cc(cccc2)c2o1,2 Z1313453216,CC(c(cccc1)c1C(NCC(N(CCC1)c2c1cccc2)=O)=O)=O,2 D442-0172,CC(C)C(C1)OCCC1(CCNCc(cccc1)c1F)c(cccc1)c1OC,0 F403-0224,Cc(c(C)c1)cc(N2CC(NCCCc3ccccc3)=O)c1N=C(CCC1)C1C2=O,0 G384-1270,CCC(N(C(C1)C(NCCC2=CCCCC2)=O)c(cc2)c1cc2S(N1CCCCC1)(=O)=O)=O,2 Z3095888450,Cn(c(-c(n1C)nnc1N1CCCC1)c1)c2c1cccc2,2 F159-0147,Cc1c(cc(cc2)NC(Nc(cc3)cc(C)c3Br)=O)c2nc(N2CCOCC2)c1,0 Z2311310980,N#Cc1nc(cc(cc2)Br)c2[nH]1,0 E760-7785,Cc1nc2cccnc2n1-c(cc(cc1)C(NC(CC2)CS2(=O)=O)=O)c1Cl,2 F6473-3674,O=C(CCc(cc1)cc(F)c1Cl)N(C1)CC1N(C(CC1)=O)C1=O,2 F6747-9537,CN(C1CCN(CC2OCCOC2)CC1)c(nc1)ncc1Cl,2 F581-0488,O=S(c1cc(CCCC2)c2cc1)(NC(C1)COc(cc2)c1cc2Br)=O,2 T473-0641,O=C(NCc(cc1)ccc1F)N(CC1)CCN1c1cc2nnc(C3CC3)n2nc1,2 F6559-1785,O=C(Cc1cccs1)NCc1nc(C2CCOCC2)no1,2 F5265-0468,CCCC(Nc(cc1)ccc1S(NCCN(CC1)CCN1c(cccc1)c1F)(=O)=O)=O,0 Z1148762420,OC(C(CC1)(CN1C(CC1(CC(C2)C3)CC3CC2C1)=O)C(F)(F)F)=O,2 F6524-5465,COc(cc1)nn2c1nnc2CNC(Cn(cc1)c2c1cccc2)=O,2 F6523-3295,O=C(c1nn(-c2ccccc2)nc1)NCCN(Cc(cc(cc1)Cl)c1OC1)C1=O,2 F6436-3502,CC(Cc1cocc1)NC(CCc(cccc1)c1F)=O,0 Z3686078555,Cc1c(CN[C@@H](CC(Cn2nccc2)C2)[C@H]2O)n(C)c2c1cccc2,0 4137-0124,O=C(Cn1c(-c2cncs2)nc2c1cccc2)Nc(cc1)cc2c1OCCO2,2 Z2052754231,CCc1cc(N(C[C@H](C2)OC)[C@@H]2C(N2CC)=NNC2=O)nc(C)n1,2 F5964-0098,OCC1(CNC(COc(cc2)ccc2F)=O)CC1,0 Z1539215574,CCc1ncnc(N2CCN(Cc(cc3)ccc3F)CCC2)c1F,2 S613-0955,Cn1nc(C(N(CCC2)C2c2nc(CCOCC3CCCC3)no2)=O)c2c1cccc2,0 F5655-0023,O=C(c1csc(-c2cc(cccc3)c3[nH]2)n1)N1CCCCC1,2 Z407262766,Cc(cccc1)c1C(NC(CC1)CCN1C(c1ncc(C)nc1)=O)=O,2 F6436-2207,COc1cc([nH]c(C(NCC(C(F)(F)F)(c2ccccc2)O)=O)c2)c2cc1,0 F5857-2400,OC(CNC(C1(CCOCC1)c1ccccc1)=O)c1cccc2ccccc12,2 Z2362314104,CCn1c(CN(CC2)CCN2c2c3sccc3ncn2)cnc1,2 F6458-0193,O=C(CSC1CCCC1)N(CC1)CCN1c(cc1)nnc1-n1ncnc1,2 Z4965062791,[O-]C(C(CC(Nc1cc2cccnc2cc1)=O)Cc1ccccc1)=O,0 Y200-4418,CC(C)(C)c1cc(NC(CCC2CCCCC2)=O)no1,2 Z1763390776,CN(CC1(CCOCC1)O)C(c1cc(Br)cnc1)=O,0 Z1359640502,CC(c1ccc(C)cc1)N(C)S(c1c(C)nc(C)s1)(=O)=O,2 F052-1261,CC(CCCC1)N1S(c1cc2ccc(N(CC3)Cc4c3cccc4)nc2cc1)(=O)=O,2 G702-0786,COc(cccc1)c1N(CC1)CCN1c1c(CCC2)c2nc2ncnn12,0 F6753-1974,O=C(C(CC1)CCN1c1nccc2c1ccs2)N(CC1)CCC1(F)F,2 F5791-1021,O=C(Cc1noc2c1cccc2)NCc1cccs1,2 Z2692247099,OC(c1ccc2c(Br)cncc2c1)=O,0 F3407-2807,COC(CC1=CC(SCc(cc2)cc(F)c2OC)=Nc(cccc2)c2N1)=O,2 F2416-1136,COC(N(CC1)Cc2c1ccc(NC(C1CC=CCC1)=O)c2)=O,2 Z3640192359,CC(C(c(cc1)ccc1OC)NC(c1cc(Cl)c(N(C)C)nc1)=O)O,0 Z1929947736,CCCc(n(-c1c(C)cccc1)nc1)c1NCc(n1-c2c3cccc2)nnc1N(C)C3=O,0 F6764-1705,Cc1noc(CN(CC2)CCC2c(ccc2c3)nc2ncc3-c2ccncc2)c1,2 Z1260477084,CC(C1CC1)(C(N1CC(N(C2CC2)C(C2)CC2c2c(C)cccc2)=O)=O)NC1=O,2 F3098-6347,CC(C)(C)c(cc1)ccc1OCC(Nc1nc(C)c(C(C)=O)s1)=O,0 F2743-2242,O=C(C1=CC=CN(Cc(cc2)ccc2Br)C1=O)Nc(cc1)ccc1OC(F)(F)F,0 Z1831637691,CC(CN(CC1)c(cccc2)c2F)N1C(C(Cc1ccccc1)NC(OC)=O)=O,0 Z1249395163,O=C(NCC1(CCCCC1)c1cccs1)N(CCC1)CC1c1ccn[nH]1,2 F1132-0426,CCOc(cc1)ccc1S(Nc1nccc(C)c1)(=O)=O,0 T655-0394,O=C(C1(CC1)c1ccccc1)N(C1)CC2(CCOCC2)C1c1nnc(-c2ccncc2)o1,2 C066-1269,CC(CC1)CCN1S(c(cc1)cc2c1N=CN(CC(NC1CCCCCC1)=O)C2=O)(=O)=O,2 F3366-0062,COc1ccc(Cc2nc(cccc3)c3n2CC(N2CCCCC2)=O)cc1,0 V018-1127,O=C(C(C1CCCC1)N(CC1)CCN1C(c(cccc1)c1Cl)=O)NCC1OCCC1,0 Z1729683006,CC(CCCC1)CN1C(c(cc1C(N2)=O)cnc1N(C)C2=O)=O,2 S691-1584,CC(C)n1c(CC(CC2)CN2S(c(cc(cc2)OC)c2OC)(=O)=O)ncc1C,0 Z3831308229,CN(C)C1CCN(CCCNc2c3sc(N(C)C)nc3ncn2)CC1,2 Z1543410182,OCC(CCC1)CN1C(NC(CCC1)CN1c(cccc1)c1F)=O,0 Z2782563846,Cc1c(C(NC2(CCCC2)C(N(C2)CC2(c2ccccc2)O)=O)=O)c(C)nn1C,2 F2879-4611,COc1c(CNC(C(NCc2ccncc2)=O)=O)cccc1,0 Z1728515414,CN(Cc(cc1)ccc1OCC(O)=O)C(c(cc1)cc2c1[nH]cc2)=O,0 F6660-0636,Cc1cc(N(CCC2NC(c(cc3)ccc3N(C)C)=O)C2=O)cc(C)c1,0 Z2486771322,O=C([C@]1(C2)[C@@H]2COC1)N(CC1)CCC1C(O1)=NNC1=O,2 Z1440960045,Cc1c(CC(N2CC(Cc3nccn3C)CCC2)=O)nc(-c2cscc2)o1,2 5750-3403,Oc1cccc(C2C(C(CCC3)=O)=C3NC(c3c4cccc3)=C2C4=O)c1,0 E856-3020,O=C(c1ccc(CN(c2cc(-c3cccc(Cl)c3)nn2CC2)C2=O)cc1)NCCc1ccco1,2 Z1428044309,Cn(cc1NC(c2csc(-c3cscc3)n2)=O)nc1-c1ncccc1,2 C470-0636,CC(C)Cn1c(C(N(C)C(N2C)=O)=O)c2nc1CN1CCN(Cc2ccccc2)CC1,0 Z3343963807,CN(C)C(C(c1ccccc1)n1nnc(Cn2ncnc2)c1)=O,0 F6734-1384,O=C(c1cc(C2CC2)n[nH]1)N(C1)CC(C2)C1CN2c(cc1)ncc1F,2 SC91-0522,O=C([C@](C[C@H]1CC2)(CN1C2=O)c(cccc1)c1Cl)N(CC1)Cc2c1scc2,2 Z3173561096,CCc1cc(C(N(CCC2)[C@@]2(C)C(O)=O)=O)no1,0 Z3370855870,CC(CC1)(CCC11OCCO1)NC(c(cc1)cc(O)c1F)=O,2 F6563-0109,COc(cc1)cc(C(N(CC2)CCC2Oc2cscc2)=O)c1Br,0 Z2358907410,Cc1cccc(Cl)c1S(N[C@@H](CCCN1)C1=O)(=O)=O,2 J006-1534,Cc1cc(C2N(Cc(cc3)ccc3SC)CCC2)no1,0 F550-3933,CC(C1)N(C(C(C=C2)=NN(CCC(N(CC3)c4c3cccc4)=O)C2=O)=O)c2c1cccc2,0 F6454-3067,O=C(NCC(CC1)CCN1C1CCSCC1)NCc1ccccc1,2 Z3087208332,Cn(c(C(F)(F)F)c1)nc1NC(C1COCCC1)=O,2 F6442-0211,O=C(c(cc1)ccc1F)c(cccc1)c1C(N(C1)CC1S(c(cc1)ccc1F)(=O)=O)=O,2 F2487-0232,O=C(COc(ccc(Cl)c1)c1Cl)N(C1)c(cccc2)c2NC1=O,0 Z1451954322,CC(C)(c(cc(cc1)C(Nc(cc2)ccc2-c2nc(C)n[nH]2)=O)c1N1)C1=O,2 Z1803865686,Cc1cc(S(NC(Cc(cc2)ccc2Br)=O)(=O)=O)cc(C)c1F,0 F755-0053,O=C(c1ccc(CN(C2=O)c3ncccc3-n3c2ccc3)o1)N(CC1)CCN1c1cccc(Cl)c1,2 Z2961282833,NC(c1cc(NC(C(CCCN2CC(F)(F)F)C2=O)=O)cs1)=O,2 Y043-6168,CCC(C)C(c1nc(cccc2)c2[nH]1)NC(CCCN(C(c(cccc1)c1N1)=O)C1=O)=O,2 F6597-2511,Cc1c(C(N2CCC(COc3nc(C(F)(F)F)ccc3)CC2)=O)sc(C)n1,2 Z1449675639,Cc(cc1)c(C)cc1N(C)S(c(cc1)cc(F)c1C(O)=O)(=O)=O,0 F6713-1915,Cc1cc(C)nn1C(C=C1)=NN(C(CC2)CCN2c2c(C)c(C)nc3ncnn23)C1=O,2 L105-0352,Cn(cc1-c2ccccc2)c(C(N2CCOC)=O)c1N=C2SCc1nc(-c2ccccc2)no1,2 F2672-0153,Cc1ccc(C(CNC(Cc(cc2)ccc2Cl)=O)N2CCN(C)CC2)cc1,0 Z1439460468,CCn1ncc(CN(C)C(Cc2c(C)sc(C)n2)=O)c1,2 G652-5678,CCCc1nc2nc(-c3ccco3)nn2c(Nc(cc2)ccc2N2CCOCC2)c1,0 T853-0714,O=C(C1(CCC(N2Cc3ccccc3)=O)C2=CCCC1)NCCc1c[nH]c2c1cccc2,2 SD68-0461,CCOc(cc1)ccc1S(N1CC(C(N(CCOC)CC2)=O)N2CCC1)(=O)=O,0 E591-0978,O=C(CCc1nnc(cc2)n1nc2N1CCOCC1)N(CC1)CCN1c(cccc1)c1F,0 Z1258656368,CC1(CN(Cc2cc(Oc3ccccc3)ccc2)CC1)C(O)=O,0 Z2170857023,OCC(C1CCCC1)NCC1=Cc(cccc2)c2OC1,2 F6266-0428,O=C(NC1(CC(C2)C3)CC3CC2C1)N1C2COCC1CC2,2 Z1918277149,COc1ncccc1Cn1nnc(C2CC2)n1,2 Z95478571,O=C(c(cc1)ccc1S(Nc1ccccc1)(=O)=O)Nc1nc(cccc2)c2[nH]1,2 Z4327150289,CCC(N1C(Cn2nnc(-c3ccccc3)c2)CCC1)=O,2 Z734181338,O=C(c1cc(F)cc2nccnc12)N(CC1)CCN1c1nccnc1,2 F6474-0123,CC(N1C)=CC(OC(CC2)CCN2C(c(cc2)ccc2-c2cscc2)=O)=CC1=O,2 Z2353367258,OC(C(CC1)CCN1C(N[C@H](C1)C[C@@H]1c1cc(F)cc(F)c1)=O)=O,0 Z2569584153,CC(C#N)N(C1CC1)S(c1c(C)ccc(S(C)(=O)=O)c1)(=O)=O,0 J500-0758,CN(C)C(C(C1)C2(CCCC2)CN1C(C1CCOCC1)=O)=O,0 Z2597412735,C[C@H](CC1)N(Cc2csc(-c(cc3)ccc3F)n2)[C@@H](C)[C@H]1C(O)=O,0 SC70-0591,CCOCC(N(C1)CC2(CCC2)C1c1n[nH]c(C)n1)=O,0 S858-2436,Cn1ncc(CN2C[C@](CO)(CN(Cc3ccccc3)C3)[C@H]3CC2)c1,0 Z1931271374,CN1CCC(CNC(Nc(cccc2)c2N2C(CC3)CC3C2)=O)CC1,2 Z594361334,Cc(ccc(F)c1)c1NC(N(CCC1)CC1N1CCCC1)=O,0 F6360-9367,O=C(c1c[nH]c2c1cccc2)N(C1)CC1Oc1cnccc1,2 Z1255637893,CC(C)(C)c1nc(-c2cnccc2)cs1,2 F6727-8377,O=C(c1cc(C2CC2)n[nH]1)N(C1)CC1N(C(C=C1)=O)N=C1c1cccc(F)c1,2 V019-4996,CCC(CN(CC1)CCN1c1nc(C)nc(C)c1Cc1c(C)ccc(C)c1)O,0 Z1082662138,Cc(n(-c(cc1)ccc1Br)nc1)c1C(N(C1)CC1Oc1ccccc1)=O,2 F6676-2649,CN(C(CC1)CCN1C(c(cccc1OC)c1OC)=O)c1ncccc1,0 G587-0340,CN1c(cc(cc2)C(N(CC3)CCN3c(cc3)ccc3Cl)=O)c2N(CCCC2)C2C1=O,0 Z1616843604,Cc1cccnc1C(N[C@H](CO)c1ccccc1)=O,0 F6475-7246,O=C(c1cc(OC2CSCC2)ncc1)Nc(cc1)cc(C(F)(F)F)c1F,0 F1900-9657,NC(CCC1)c2c1n(-c1ccc(C3CCCCC3)cc1)nc2,2 Z3681469392,NC(c1c(C2C3NCC2C3)ocn1)=O,0 F0914-6553,CC(C)OC(COc(cc1)cc(OC=C2c(cccc3)c3OC)c1C2=O)=O,0 J100-0197,O=C(C[C@H](C(Nc1c2cccc1)=O)NC2=O)Nc1nc(-c2ccncc2)cs1,2 SC88-0628,CCn1ncc(C(N(C2)CC2(C(CC2)c3nc(-c(cc4)ccc4F)no3)S2(=O)=O)=O)c1,0 Z1489350999,Cc1c(C)oc(CN2CCC(CNC(NCC3(CO)CCOCC3)=O)CC2)n1,2 8006-5512,O=C(c(cccc1)c1C1=O)N1c1cccc(-c2csc(Nc(cc3)ccc3Br)n2)c1,2 D335-0597,CCCC(NCC1(CCCCC1)N1CCOCC1)=O,0 Z2975644683,C[C@](CN(C)C1)(C2)[C@H]1CN2C(NCCc1cn(C)c2c1cccn2)=O,2 Z3480645210,CC(CC1)c(ccc(S(N(CCN(C)C2)C2c2ccccc2)(=O)=O)c2)c2N1C(C)=O,2 F6517-4839,COc1c(C2(CC2)C(NCC(c(cc2)ccc2-c2cscc2)O)=O)cccc1,2 Z3558357148,Cc1cnc(NCc2cc(N(CCC3)CC3O)ncc2)nc1SC,2 4883-0096,CCN(C(C1(CC(c(cccc2)c2OC)=O)O)=O)c2c1cccc2,0 F6609-3834,O=C(COC(c(o1)ccc1Br)=O)NCc1c(C(F)(F)F)cccc1,0 Z1140344181,O=C(c(cc1)cc(CC2)c1NC2=O)NCC1(CCOCC1)c(cccc1)c1Cl,0 F5328-0040,CCc(s1)ccc1S(NCC1(CCOCC1)c1ccccc1)(=O)=O,0 Z1931833930,OC(c1cc(S(N(C2)CN(C3CC3)C2=O)(=O)=O)c(CCCC2)c2c1)=O,2 F6734-1485,CN(C=NC(N1CC(CN(C2)c(cc3)ncc3F)C2C1)=C1)C1=O,2 F2088-0058,Cc1cc(NC(CSc2nccn2C2CCCCC2)=O)cc(C)c1,2 F5530-0471,CC(N1c(cc2)ccc2OC)=Nc(ccc(NC(Cc2cccs2)=O)c2)c2C1=O,2 Z2044737947,Cc1nccn1S(c(cc1)ccc1Br)(=O)=O,0 F6524-4305,O=C(c1cc(-n2nccc2)ccc1)N(CC1c2nocn2)CC1c1ccccc1,2 F6604-0483,CN(C(C1)CN1c(cc1)nn2c1nnc2)C(Cc1c[nH]c2c1cccc2)=O,2 Z2755330641,OC(c1cc(CNC(c2c(C3CC3)nco2)=O)ccc1)=O,0 F6436-1820,O=C(c1cc(Br)cs1)N(Cc1cscc1)Cc1ccco1,2 Z1626865761,CC(CCCC1)C1OCC(N(CCOC1)C1c1noc(COC)n1)=O,2 F6523-0375,O=C(Nc(cc1)ccc1F)N(CC1)CCN1c1ncnc(C(F)(F)F)c1,0 C653-0290,COC(C(C(c1ccccc1)N1)=C(CS(c(cc2)ccc2Br)(=O)=O)NC1=O)=O,0 Z98939482,CCn1c(SCc(n2C)ncc2Cl)ncc1-c(cc1)cc2c1OCCO2,0 L932-0277,CN(c(cccc1)c1N=C1N(CC2)CCC2NC(Nc(cc2)cc(OC)c2OC)=O)C1=O,0 F6481-4057,Cc1nc(C(N(CC2)CCSC2c2cccs2)=O)cs1,2 Z2993222503,OCc(cc(cc1)NCc2nccn2C2CC2)c1Br,0 F6228-0319,O=C(Nc1ccc(C(F)(F)F)cc1)N1CCN(CCn2nccc2)CCC1,0 V011-8441,Cc1cccc(CN(CCN2CCOCC2)CC(COc(cc2)ccc2OC)O)c1,0 V007-0921,CCOc(cc1)ccc1NC(N1CCC(Cc(cc2)ccc2-c2ccccc2)CC1)=O,2 V015-5357,CC(c1ccccc1)N(CCC(Nc1nnc(-c2ccccc2)s1)=O)C(c1cc(C(F)(F)F)ccc1)=O,2 Z1246389977,N#Cc(cc1)cc(F)c1S(Nc(cc1)ccc1C(N(CCC1)C1c1ccccc1)=O)(=O)=O,2 Z2851458918,CCOc(cc1)c(C)cc1S(NCCN=S(C)(C)=O)(=O)=O,0 SC99-0224,CC(C)n(c(CC1)c2CN1C(Cc1c(C)onc1C)=O)nc2-c1ncc[nH]1,2 F6561-3591,Cc(cc(CCC(NC(CC1)CCC1=C)=O)cc1)c1F,0 S978-0649,C[C@@H]1N(Cc2ccncc2)Cc(cc(CN(C2CC2)S(C)(=O)=O)cc2)c2OC1,2 Y300-3530,O=C(Cc1cccc(Cl)c1)NCc(cc1)ccc1N1CCCC1,2 Z803683662,CN(C)CCN(CC1)CCN1C(CCc(cc(cc1)F)c1F)=O,0 S979-0266,C[C@@H](COc(cc1)c(C2)cc1C(NCCOC)=O)N2C(CN1CCOCC1)=O,2 F6540-9131,FC(C1CCN(CC2OCCCC2)CC1)(F)F,2 8010-4135,CC(C(C(c(cccc1)c1Cl)N(CCN1CCNCC1)C1=O)=C1O)=O,2 Z3076255342,CC(C)(CC1)CN1c1nc(NC(N(C)C2=O)=O)c2[nH]1,2 Z2476583574,CC(C)(C)c(sc(C(O)=O)c1)c1S(N(CC1)C[C@@H]1OC)(=O)=O,0 Z362726852,Cn1c(-c2cccc(NC(COc(cccc3)c3Cl)=O)c2)nnc1,2 Z2592210279,CC(c1cc2cccc(OC)c2o1)NCc(cc1)ccc1N(CC1)CCC1O,2 S988-0442,CCS(N(C[C@@H]1CN(Cc2ccncc2)C2)C[C@@]12c1nc(C)no1)(=O)=O,2 Z2004640800,CS(C(CC1)CN1C(c1c[nH]cc1-c1ccccc1)=O)(=O)=O,2 F6529-0693,CN(C(C(F)(F)F)=NN1C(CC2)CCN2C(c2ccno2)=O)C1=O,2 F6556-5700,O=S(c(cccc1)c1Br)(N(CCC1)CCN1C1COCC1)=O,0 E629-1665,O=C(Cn(c(-c1cccs1)c1)c(cc2)c1cc2Cl)N(CC1)CCN1c1ncccc1,2 E591-0905,O=C(CCc1nnc(cc2)n1nc2N1CCOCC1)NC1CCCC1,2 F6442-2870,O=C(Cn1cccc1)N(C1)CC1S(c(cc1)ccc1Cl)(=O)=O,2 Z1255996032,Cc(cc1)cc(C(NC)=O)c1NC(COC)=O,0 S661-1168,CCN(C(C(C1)N2CC1(CC1)CCN1C(C(C)C)=O)=O)C2=O,0 F6753-3477,COc1cc(CN(CCC2)CC2C(N2CCSCC2)=O)cc(OC)c1,0 Z1225778590,CC(CN(CC1)CCN1c1ncccc1)NC(N1CCCC1)=O,2 F6675-7352,CCOc(cc1)ccc1NC(NC(C1)CN1c1ncccc1)=O,0 Z1954644642,CCn1ncc(-c2n[nH]cc2C(N(CCC2)CC2c2nc(N(C)C)no2)=O)c1,0 F6442-2199,O=C(C1(CCCC1)c1cccs1)N(C1)CC1S(Cc1ccco1)(=O)=O,2 C276-1590,CC(NC(CC1c2cccc(F)c2F)=O)=C1C(OCC1CCCCC1)=O,0 F6559-2343,O=C(c(cccc1)c1S(C(F)F)(=O)=O)NCc1nnc(C2)n1CCC2C(F)(F)F,0 Z1890200846,Brc(cc1)cnc1-c1noc(-c2cc(Nc3ncccn3)ccc2)n1,0 Z3071553571,CC(C)n1c(CC(NCCc2ccc(C(F)(F)F)cc2)=O)nnc1,0 F6724-4655,Cn1c(ncnc2NCC(c(s3)ccc3Cl)OC)c2nc1,2 Z1748053626,Cc1nn(CC(F)(F)F)cc1C(N(C1)CC2(CC2)C1O)=O,2 SC42-0438,CC(C)c1nc(CC2CC(CC3)(CCN3C(c3cocc3)=O)OCC2)no1,0 J006-2194,CC(C)c1cc(C2N(Cc(cc(cc3)OC)c3OC)CCC2)no1,0 Z1788070790,O=S(CCc(cc1)cc2c1OCC2)(N(Cc1ccccc1)C1CC1)=O,0 Z2355828909,CC(CC1)CCN1c(cc1)ccc1NC(C(N(CC1CCC2)CC1C2N)=O)=O,0 SB66-0598,CN(CCCNC(CN([C@@H](CN(C1)S(C)(=O)=O)[C@@H]1CCC1)C1=O)=O)c1ccccc1,2 Z1612623612,CC[C@H](C)[C@@H](C(N1C(Cc2ccccc2)C2CC2)=O)NC1=O,2 V007-8231,CC(C)c1cc(C)cc(OC(CCN(CC2)CCN2c2ccccc2)c2ccccc2)c1,0 SA96-1445,Cn1c(C(N(C2)CC2(CN(Cc2ccccc2)C2)C2C(NCC2CC2)=O)=O)cnc1,2 F5882-0557,COC(N1CCN(CCNC(c2nc3ccccc3nc2)=O)CC1)=O,0 Z2346756628,OC(C(CC1)CCN1c1nc(CCCC2)c2cn1)c1ccccc1,0 F6529-0173,CCOC(N(CC1)CCC1N(c(cccc1)c1N1C)S1(=O)=O)=O,0 8018-4843,COc1ccc(C(C2)C(C(OC3)=O)=C3NC2=O)cc1,2 Y031-3757,O=C(C(CC1=O)CN1c1ccccc1)Nc(cc1)ccc1S(NCC1OCCC1)(=O)=O,0 F6678-9795,Cc1cc(C(N(C2)CC2n2c(cccc3)c3nc2C2CC2)=O)no1,2 S639-0877,Cc(nc1)cnc1C(N[C@@H]1[C@@H](CN(C)C)CN(Cc2cnccc2)C1)=O,0 Z4740213387,Cc1nc(CCNC(c2c(cncc3)n3c(C(F)(F)F)n2)=O)n[nH]1,2 Z2963436044,C[C@@H](C[C@@H](C(NC1(COC1)c(cccc1)c1F)=O)N1)CC1=O,2 Z4494019497,CC(Cc(cccc1)c1Br)(C(O)=O)N,0 F6561-2999,O=C(CCc(cc1)ccc1Br)N(CC1)CCC1=C1CCC1,0 Y044-5031,N1(C(Nc2c(C1=O)cccc2)=O)CC(N1CC2\C=3\N(C(\C=C/C3)=O)CC(C1)C2)=O,2 F3358-0137,COc(cccc1)c1N(CC1)CCN1C(CSc1nnc(-c2ccccc2)c2ccccc12)=O,2 F6796-7422,C(CN(CC1)CCN1c1ncnc2c1ncn2C1CC1)n1nncc1,2 E734-2674,O=C(c1c2nccc1)N(Cc(cc1)ccc1S(N(CC1)CCN1c1ccccc1)(=O)=O)C2=O,0 Z4156221852,O=C(Nc1c(C2CC2)n(CC(F)(F)F)nc1)N1C(CF)CCC1,0 F6658-3378,Cc1nnc(cc2)n1nc2N(CCC1)CCN1C(CC1Oc(cccc2)c2OC1)=O,2 F6562-1913,O=C(Cn(cc1)c2c1cccc2)NCc1cc(N(CCC2)C2=O)cnc1,2 D074-0553,CCOc(cc(C(c1c2[nH]nc1-c(cccc1)c1O)N(CCO)C2=O)cc1)c1OCc1ccccc1,0 F2213-0596,CC(C1)N(C(C(C(OC)=C2)=NN(c(cc3)ccc3F)C2=O)=O)c2c1cccc2,0 Z2651637232,O=C(C12CCNCC2)NCc2c1cccc2,0 F6549-3405,O=C(c1cc(cccc2)c2s1)N1CC(Cn2ncnc2)C1,2 Z809601010,O=C(c1cncc2ccccc12)NCc(cccc1)c1-n1cncc1,2 F6788-3073,Cc1nc(C2CCC2)cc(N(CC2)CCN2c2ncnc3c2n(C)cn3)n1,2 F5479-0083,COc(cc1)cc(OC)c1C(NCCCN1N=CC=CC1=O)=O,0 G266-0567,Cc1ccc(CNC(Nc(c(N2CCOCC2)c2)cc(N3C)c2N(C)C3=O)=O)cc1,2 F5854-1123,COc1ccc(CCNC(N(Cc2cscc2)Cc2ncccc2)=O)cc1,2 Z1940148385,CC(C(C1(C)C)NC(C2(CC2)S(C)(=O)=O)=O)C1OC,0 F6037-0709,Cc(cc1)cc2c1[nH]c(C1CN(Cc(c(F)ccc3)c3Cl)C1)n2,0 Z977485590,N#Cc1c(NCC2CCOCC2)snc1Cl,0 G673-0617,CC(C)C(c1cccs1)NC(CN1c(cc(cc2)C(N3CCCC3)=O)c2N(CCCC2)C2C1=O)=O,2 Z3216017132,O=S(CC1COCCC1)(Nc(cc1)c2[nH]ncc2c1Cl)=O,2 Z739668240,CCOc(ccc(NCc1nc(CC(C)C)no1)c1)c1Cl,0 F6516-0786,O=S(Cc(cccc1)c1F)(NCc1ccc(-c2ccco2)o1)=O,2 Z2437620547,CC1(COCC1)NS(c(cc1)cc(C(F)(F)F)c1C(O)=O)(=O)=O,0 F5833-6795,Cc(cccc1)c1NC(Nc1cccc(N(CCCC2)C2=O)c1)=O,2 S428-1310,CCCn1nc(C)c(-c2n[nH]c(C(N(CCC3)C3c3nc(C4CCOCC4)no3)=O)c2)c1C,2 F6443-6633,CN(C)S(c(cc1)ccc1C(NCC(CCC1)N1c1nccs1)=O)(=O)=O,0 Z332817348,CC(CC1)Cc2c1nc(NC(c1coc(Br)c1)=O)s2,0 F1894-0242,CC(C(N1)=O)=NN=C1SCc(c(F)ccc1)c1Cl,0 F2255-0695,NC(C(CC1)CCN1c1ccc(cccc2OCc3cccc(C(F)(F)F)c3)c2n1)=O,2 Z2960328423,CCc1noc(COCC(N2C[C@@H]3OCCN(C)[C@@H]3C2)=O)n1,2 Z1100636249,CC(C)(CCC1)N1C(NCCS(c(cc1)ccc1Cl)(=O)=O)=O,0 F6744-7831,Cc1nc(SC)nc(N(C2)CC2N(CCN2)CC2=O)c1,2 Z1416052337,Cc(cc1)c(C)cc1S(N(C)CC(N(CC1)CC(C(N2)=O)N1C2=O)=O)(=O)=O,2 S625-6152,CN(C[C@@H](C1)O)[C@@H]1c1nnc(C2)n1CCN2C(CN(c(ccc(Cl)c1)c1O1)C1=O)=O,2 Z1334430054,CCC(Nc1nc(cccc2)c2n1CCc1ncccc1)=O,0 F1907-9327,Cc1cc(N(CC2)CCC2(C(F)(F)F)O)nc(C)n1,0 F6562-8345,Cc1c(C(NCC2c(cccc3)c3OC2)=O)scn1,2 Z1171929577,CC(C(N(C)C(CCN1c(cccc2)c2Cl)C1=O)=O)N(C(C1(CCCC1)N1)=O)C1=O,2 Z454304636,COCCCNC(c(cc1)cnc1Oc(cc1)ccc1Br)=O,0 SD61-0665,Cn1c(C(N(C2)CC3(CCC3)C2C(NCC2CC2)=O)=O)cnc1,2 F6252-7249,CCN1C(CNC(c2c(-c3ccccc3)nn[nH]2)=O)CCC1,2 Z2755351695,OC(C1(CSCC1)NC(C(C1)c2c1ccc(Cl)c2)=O)=O,2 Z1957597170,Cc1noc(C(CCC2)N2S(Cc(ccc(C)c2)c2F)(=O)=O)c1,0 E612-0571,O=C(C(Cc1ccccc1)N(Cc1c2cccc1)C2=O)NCCN1CCOCC1,2 SC18-0250,CN(Cc1c[nH]nc1-c(cc1)ccc1F)Cc1nc(C(CC2)CCN2S(C)(=O)=O)no1,2 S613-0693,O=C(CCc1c[nH]c2c1cccc2)N(CCC1)C1c1nc(CCOCC2CC2)no1,2 8008-9506,Cc1cc(NC(C2C3C(CC4)CC4C23)=O)c(C)cc1,0 F6609-5851,O=C(c1cn(-c2cccc(Cl)c2)nn1)NCc(ccc(F)c1)c1F,0 Z1479310477,O=C(c1n[nH]cn1)N1CC(Cc(cc2)ccc2F)CC1,2 V017-1511,O=C(c1cccc(CN(CC2)CCN2c(cccc2)c2F)c1)NCC1CC1,2 F6795-1678,CC(C)Oc1nc(N(CC2)CCN2c2ncnc3cnccc23)ccc1,2 F6804-8539,FC(C(CC1)CCN1c1nc(c(F)ccc2)c2s1)(F)F,0 Z1558486474,CC(C)c1n[nH]c(C(NC(C)c2nocn2)=O)c1Br,0 Z1623215894,Cc(ccc(C(NC(C1)CNC1=O)=O)c1)c1NC(c(cccc1)c1F)=O,2 F6416-8840,Cc1cc(C(CCNC(C(Nc2cccc(Cl)c2C)=O)=O)O)c(C)o1,2 SC96-0817,COCCCN(C1(COCC1)CN(CC1)C(c2cc(ccc(OC)c3)c3[nH]2)=O)C1=O,2 Z2965044378,COc1cc(C(CC2)C(Nc3cn(C4CCC4)nc3)=O)c2cc1,2 F6359-2997,CCSc(cccc1)c1C(N(CC1)CCC1Oc1nccnc1)=O,0 Z1558586578,Cc(cc1)c(C)cc1NC(c1cc(-c2ncn[nH]2)ccc1)=O,0 F6415-0077,CCC(C(N(CCOC)Cc1cocc1)=O)c1ccccc1,0 Z2760976330,CC(CN(C)c1ncnc2c1ncn2CC(CO)O)(c1ccccc1)O,0 Z2771255184,CCC(CC1)N1C(c1nnc(C(C)(C)C)o1)=O,2 F6496-1444,O=C(C(CC1=O)CN1c1cccc(Br)c1)NCc1ncnc(C2CC2)c1,2 D505-0075,Cc(ccc(C(C1=C2CCCC1)=NN(C)C2=O)c1)c1S(Nc1c(C)cccc1C)(=O)=O,0 Z1101613010,CNC(Cc(cc1)ccc1NC(c(cc1)cn2c1ncc2)=O)=O,0 SB32-0941,CC(C)N(CC1)CCC1N(C[C@@H]1COC)C[C@@H]1c1nc(-c2ccccc2)n[nH]1,2 Z2283165288,O=C(Cc1cc2ccccc2cc1)N(C[C@H](C1)CN23)C[C@@H]1C3=CC=CC2=O,2 Z1211688982,CN(C)C(CNC(c1cc(COc(cc2)ccc2C#N)ccc1)=O)c(cc1)ccc1OC,2 F6549-2225,O=C(c1cc(cc(cc2)F)c2s1)N(C(CC1)C2)C1CC2n1nccc1,2 F1757-0256,CCN(CC)C(Nc(cc1)ccc1C(OCC)=O)=O,0 Z2963052045,CC1(C(NCc2nc(CCOC3)c3s2)=O)Oc(cccc2)c2OC1,2 F6439-7588,O=S(c(cccc1)c1Br)(NCCn1c2ccnn2cc1)=O,0 F1736-0286,CC(CC1)Cc2c1c(C(Nc1noc(C)c1)=O)cs2,2 F6209-0101,O=C(Cc(cccc1)c1Cl)NCCCn1c(-c2ccccc2)ncc1,2 F5857-6516,COC(c(cc1)ccc1C(NCC1(C=CCCC1)O)=O)=O,0 Z2966754767,C[C@@H](C(NCCC1)=O)N1C(c(cc1C)nn1-c1ccc(C)cc1)=O,2 F6522-0226,O=C(C1CCOCC1)NCc1cc(-c2ccco2)cs1,2 G939-1692,Cc1noc(-c(cc2)cc(C)c2S(N(CC2)c3c2cccc3)(=O)=O)c1,0 F362-0211,O=C(C(CC1)CCN1c(cc1)nnc1Sc(cc1)ccc1Br)NCCCN1CCOCC1,2 C430-0322,Cc(cc1)cnc1N(C(c1c2cccc1)Nc1c(C)cccc1C)C2=O,0 Z2900744768,OC([C@H](CCCC1)[C@H]1NC(Cc1cc(O)ccc1)=O)=O,0 Z1676189827,CNS(c1csc(C(N(CC2)c3c2c(C(F)(F)F)ccc3)=O)c1)(=O)=O,0 Z1230583936,CC(C)(c1ccccc1)NC(Nc1cc(C(N(C)C)=O)ncc1)=O,0 F6416-8160,Cn(c(C(NCCC(c1cocc1)O)=O)c1)nc1-c(cc1)ccc1F,0 Z1048583634,COC(NC(Cc1ccccc1)C(N(CC1)CCC1NC(C1CCC1)=O)=O)=O,2 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F6752-2296,CC(C)(C)C(NC(CC1)CCN1c1nccc2ccccc12)=O,0 T139-0305,CC(C)NC(C(CC1)N(C(CC2)CCN2C(CC2CCCC2)=O)C1=O)=O,2 F3020-0564,Cc(cc(cc1)OCCCn2nnc3c2cccc3)c1Cl,2 SD68-0385,COCCN(CCN(CCC1)C2CN1C(c(cc1)cnc1OC)=O)C2=O,0 Z2000270723,CC(CN(C1)c2nc(C)ncc2)N(C)C1=O,0 E521-0262,CSc1ccc(CCNC(CN2c3ncccc3OC(c3ccccc3)C2=O)=O)cc1,2 8004-3095,CC(C)CCN(CCC1)C1C(Nc1c(C)cc(C)cc1C)=O,0 SB25-1115,O=C(C(CC1)CCC(N=C(c(cc2)ccc2F)N2)=C1C2=O)NCCn1cncc1,0 F6709-0098,Cc(cn1)cnc1OC1CCN(Cc(s2)ccc2Cl)CC1,0 F6178-0625,CCOc(cccc1)c1NC(C(NCC(CC1)CCN1c1ncccc1C#N)=O)=O,0 D126-0219,CCCN(C(c1c2[nH]nc1-c(cc(C)cc1)c1O)c(cc1)cc(OCC)c1O)C2=O,0 F6190-0425,OC(CCNC(C(NCC1OCCC1)=O)=O)C1CC1,2 Z1679982637,CSC(CCCC1)CN1C(c1cncnc1)=O,2 Z1999978108,Cc1noc2c1c(NC(CO)c(c(F)ccc1)c1F)ncn2,0 Z1274632084,CC(c1cc(-n2cncc2)ccc1)NC(NC1CC1)=O,2 Z1159197523,CC(C)C1N(CC(Nc(cc2)ccc2-c2ccccc2)=O)CCNC1=O,2 Z2370207718,O=S(Cc1noc(C2C(C3)C=CC3C2)n1)(NC1CC1)=O,2 SC88-0838,O=C(NCCc1ccccc1)N(C1)CC1(C(CC1)c2nc(-c3ccncc3)no2)S1(=O)=O,2 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Z1273528624,CC(C)c(c(C(N1CCC(CC(N)=O)CC1)=O)c1)nn1-c1nc(C)cc(C)n1,0 SC40-0074,Cc(nc1)cnc1C(N(CC1)CCC11OCc2c(COC)nnn2C1)=O,2 Z3089253045,CC(CC1N2)(N(CCCc3ccccc3)C2=O)Oc2c1cccc2,2 F6441-6680,COc(cc1)ccc1S(C(CC1)CCN1C(c(cccc1)c1Br)=O)(=O)=O,0 Z2310454889,CCO[C@@H](COC1)[C@H]1NC(N(CC1)CCC1N(CC1)CCN1C(C)C)=O,2 Z4916902251,[O-]C([C@H](CCO)NC(c1cc(-c2ccco2)nn1-c1ccccc1)=O)=O,2 Z2435585696,CCOc1c(CNC(CNC(CN)=O)=O)cccc1,0 T955-1185,CCCS(N(CCC1)CC1c1nc(CCOCC2CCOCC2)no1)(=O)=O,0 F5094-0577,Cn(cc1)nc1C(Nc(cc1)ccc1S(C)(=O)=O)=O,0 Z1309165811,CC(C)C(CNC(N1CCN(Cc2cscn2)CC1)=O)OC,0 F6556-3194,CS(N(CC1)CCC1C(NCC(CC1)CCN1C1COCC1)=O)(=O)=O,2 F6521-8235,COC(CNC(NCc(cc1)ccc1OC)=O)c(s1)ccc1Cl,0 S689-1956,O=C(C(C1)CN(C(C2)CN2S(c2ccccc2)(=O)=O)C1=O)NC1CC1,0 F2580-0818,Cc(cccc1)c1N(C=CN(CC(NCc1ccco1)=O)C1=O)C1=O,2 Z1518192441,CN(CC1)CCC1C(CC1)CN1C(C1c(cccc2)c2N(C)CC1)=O,2 C301-9775,O=C(CSc(cc1)ccc1NC(Nc(cc1)cc(Cl)c1F)=O)Nc1nc(-c2ccccc2)cs1,2 S615-0487,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CC1c1nc(CCOCC2CCCC2)no1,2 Z2067851583,CC(C(NCC1CCCCC1)=O)S(c1nnc(C)[nH]1)(=O)=O,2 V015-1384,CN(CC1)CCN1c1c(CN(CC2)C(c(c(F)ccc3)c3F)=O)c2nc(N2CCCC2)n1,0 8018-4163,Cc1c(C(NC(c(cc2)ccc2Br)N2Cc3ccccc3)=O)c2nc(C)c1,0 Z2295880822,CC(C)c1noc(CCC(Nc(cc2)cc(OC)c2C(O)=O)=O)n1,0 Z2058570592,NC(C1(CN(CC(Nc2cc(F)cc(F)c2)=O)CCC1)O)=O,0 G017-1679,O=C(CCC1)Nc(cc2)c1cc2S(Nc(cc1)cc2c1OCCO2)(=O)=O,2 F6754-9806,CC(N(CC1)CCN1c1ccc(c(C)c(c(C)n2)Br)c2n1)=O,0 Z1891468588,FC(COc1ncc(-c2noc(CCC3OCCC3)n2)nc1)(F)F,2 F5860-0153,CC(C)(C(N1CCN(Cc2c(C)onc2C)CC1)=O)Oc(cc1)ccc1Cl,0 Z1864395175,O=C(NC(C1)CC1(F)F)NC1c2cccc(Cl)c2OCC1,2 F6785-6431,Cc(cc1)cc(S(N2CCC(COc(cc3)nn4c3ncc4)CC2)(=O)=O)c1OC,2 S543-0543,CC(C)NC(N(C1CC1)C1CC(CC2)(CCN2C(Nc(cc2)ccc2OC)=O)OCC1)=O,0 F1174-0762,COc1cccc(C(O2)=Nc(sc3c4CCCC3)c4C2=O)c1,2 SB29-0518,Cc1c(C(N(C[C@H](C2)OCc3cc(C)ccc3)[C@@H]2c2n[nH]c(C)n2)=O)sc(C)n1,2 SA96-1449,O=C(C1C(C2)(CN2S(C2CC2)(=O)=O)CN(Cc2ccccc2)C1)NCC1CC1,2 T396-1617,COc(ccc(C(Nc(cc1)cnc1N(CCN1C2CCCC2)C1=O)=O)c1)c1OC,0 F3371-0874,Cc(cc1)cc(NC(CN2CCCCC2)=O)c1C(c1ccccc1)=O,2 P657-0576,O=S(c1ccc(-c2nnc(C3CC3)o2)o1)(NC1CCCCCC1)=O,2 Z3879212276,NC(C(c(cc1)ccc1F)N1C[C@@H](CO)CCC1)=O,0 F6717-7235,FC(Oc(cc1)ccc1Nc1nc(cncc2)c2s1)(F)F,2 F6564-2165,O=C1N(CCNS(N2CCOCC2)(=O)=O)N=C(CCCC2)C2=C1,2 Z1571511221,OC(CC1c2ccc(C(F)(F)F)cc2)CN1C(C(C1)CC1=O)=O,2 Z1603735299,OC(C(c(cc1)cc(F)c1Cl)NC(CC1CCOCC1)=O)=O,0 Z2053427264,CO[C@H]1CN(Cc(cc2)cc3c2OCCO3)[C@H](COc2cnccc2)C1,2 F305-1056,O=C(C(CC1)CCN1c(cc1)nnc1-c1cccc(F)c1)NC1CCCCCC1,2 SC66-0222,CC(C)CCC(N(C1)CC2(CCOCC2)C1c1nncn1CC(C)C)=O,0 Z2217485207,CC1(CC(C2)C2C1)C(N(CC1)CCN1c1cc(OC)ccc1)=O,2 F6556-4249,Cn1nnc(C(NCC(c2cc(cccc3)c3o2)OC)=O)c1,0 P885-0686,O=C(c(ccc(F)c1)c1F)N(CC1)CCC1N(C(C=C1)=O)N=C1c1cscc1,2 F6473-8150,CC(O1)=CC(OC(CC2)CCN2C(CCc(cccc2)c2Br)=O)=CC1=O,0 Z1643566793,O=C(Cn1nc(-c2ccccc2)nc1)N1CC2(CC2)COCC1,2 SB39-0854,CC(C)C(NC(CN(CC1(CCCC1)N1)C(Cc2cccc(Cl)c2)=O)C1=O)=O,2 G008-4632,CCc(ccc(-c1cc(C)no1)c1)c1S(N(CCC1)c2c1cccc2)(=O)=O,2 Y020-1952,NC(C(CC1)CCN1C(CC(N1c(cc2)cc3c2OCCO3)=O)C1=O)=O,2 F6481-3913,CCN(CCN(C(N(CC1)CCSC1c1ccco1)=O)C1=O)C1=O,2 Z594038566,COc(ccc(C(O)=O)c1)c1S(NCC(C1)c2c1cccc2)(=O)=O,2 F6015-0183,O=C(CCCn1cccc1)NCc(c(F)ccc1)c1F,0 Z2070017495,O=S(Cc(cccc1)c1F)(NCC1(CCC1)c1ncccc1)=O,0 Z451131444,OC(C1(CCCCC1)NC(c1cc(OCc2cnccc2)ccc1)=O)=O,0 SC08-0031,Cc1c(CN(C2)CC2c2nc(C(CC3)CCN3S(C)(=O)=O)no2)scn1,2 F6562-0752,Cn1ncc(C(CN(C2)C(C3OCCC3)=O)c3c2cccc3)c1,2 8005-9813,OC(c(cc(cc1)Br)c1NC(c(cc1)cc(C(N2c(cccc3)c3-c3ccccc3)=O)c1C2=O)=O)=O,2 8013-6105,CCCCC(NC(C(F)(F)F)(C(N1C2CCCCC2)=O)NC1=O)=O,2 G017-1699,CN(CCCN1CCOCC1)C(CC1)CCN1S(c(cc1)cc(CCC2)c1NC2=O)(=O)=O,2 F2145-0487,Fc(cc1F)cc2c1nc(NCc1ccco1)s2,0 Z2158013655,CN(C)C(N(CCC1)CC1C(NN1)=NC1=O)=O,0 F6681-9752,C(C(CCC1)CN1C1CCCC1)Oc1ncccn1,2 F6064-0274,Cc1noc(C(C2)CN2C(CSc(cc2)ccc2F)=O)n1,2 S614-0393,Cn1cnc(S(N(CCCC2)C2c2nc(CCOc(cc3)ccc3F)no2)(=O)=O)c1,2 F6573-4132,O=C(c1cnccc1)NCCOCCN(C(CC1)=O)C1=O,2 S656-0267,O=C(CN1)N(CC(C2)(CC3)CCN3S(c3cccs3)(=O)=O)C2C1=O,2 SA46-0591,Cc1noc(C)c1CCC(N(C1)CC1(C1)OCC1N1CCCCC1)=O,2 Z2755537960,OC(C(CNC(C1CCOCC1)=O)C1CCCCC1)=O,0 Z1610282124,Cc1cc(C(N(CC2)Cc3c2n(CCc2ccccc2)cn3)=O)cc(O)n1,2 S932-7224,O=C(CCc1nc(cccc2)c2s1)N(CC1)CC1n1nnc(COCC2CC2)c1,2 M410-0315,CCc1nnc(-c2cc(NC(C3Oc(cccc4)c4OC3)=O)c(C)s2)o1,2 Z2704330722,Cc1nnc(C2OCCN(Cc3cccnc3C(F)(F)F)C2)o1,2 V028-5636,Cc(cc1)c(C)cc1N1CCN(Cc(cc2)ccc2C(NCc2ncccc2)=O)CC1,0 F5971-1002,COCC(CNC(c1cscc1)=O)(c1ccccc1)O,0 E950-0060,O=C(c1cc(ccc2cccnc22)c2[nH]1)NCCN1CCOCC1,2 Z2483071048,OC(c1cccnc1CN(CC1)CCC1c1nc(CCCC2)c2s1)=O,2 Z1601566730,CN(c(cc1)ccc1C(N)=O)S(c1ccc(C2(CC2)C(OC)=O)cc1)(=O)=O,2 F6525-7768,O=C(NCCn1ncc(-c2cocc2)c1)NC1CCCC1,2 F6559-1296,Cc1nc(cccc2)c2n1C(CC1)CN1C(C(CC1)CCN1S(C)(=O)=O)=O,2 Z2095885362,CN(C)c(cc1)ncc1S(N(CC1c2ccccc2)Cc2c1cccc2)(=O)=O,0 Z2812092955,C[C@H](CC(C)(C)C1)C[C@@]1(C)NC(NCc1c(C)ocn1)=O,2 F6412-1580,COc(cccc1)c1OCC#CCNS(Cc1ccccc1)(=O)=O,2 S576-0973,COCCN1N=CC(N(CC2)CC2C(NCCCN(CC2)CCC2N2CCCCC2)=O)=CC1=O,2 Z998705264,CC1CN(CCNC(C(CCC2)CN2C(c(cc2)cc3c2[nH]nc3)=O)=O)CCC1,2 Z2014658795,COc(ccc(C1=NOC(CNC(c2c[nH]nc2-c2ccccc2)=O)C1)c1)c1F,0 F6178-4854,CN(C=CC=C1C(NCC(CC2)CCN2c2nccnc2)=O)C1=O,2 Z1182586388,COc1cc([nH]c(C(NC(CCN2CC(F)(F)F)C2=O)=O)c2)c2cc1,0 Z1252001506,CN(CCN(C1)C(C(c2ccccc2)c2ccccc2)=O)C1=O,2 F3407-3689,CCOC(N(CC1)CCN1C(CCN(C(c(cccc1)c1N1)=O)C1=O)=O)=O,2 F5857-9331,CC(CNC(C(Nc(cc1)cc(Cl)c1OC)=O)=O)(c1ccco1)O,0 8020-5716,Cc(s1)nn2c1nc(-c1cccc(S(N3CCOCC3)(=O)=O)c1)c2,2 F6513-5144,O=C(c1c(CCCC2)n2nc1)N(CC1)CCN1C(c1nc(cccc2)c2s1)=O,2 S555-1553,O=C(CN(c(cccc1)c1O1)C1=O)N1Cc(cc(cc2)NC(C3CC3)=O)c2OCC1,2 F6752-4597,N#Cc1cc(N2CC(C(N3CCCCC3)=O)OCC2)ncc1,0 F940-0476,CCC(CC)C(Nc(cc1)ccc1-c1cc(cc(cc2)F)c2[nH]1)=O,0 Z2993321614,Cc1cc(CNc([nH]nc2)c2C(N(C)C)=O)nn1C,0 Z2568459828,N#Cc(cccc1)c1S(N1C(CCCC(O)=O)CCCC1)(=O)=O,0 Z3216020090,CCCCC(NS(c1ccc(C2(C(F)(F)F)N=N2)cc1)(=O)=O)=O,0 Z419897436,COC(CNC(C(CC1)CCN1C(OCc1ccccc1)=O)=O)=O,0 Z1842973224,CCC(C)n1ncc(C(N(CCSC2)C2c2cn(C)nc2)=O)c1C,2 F5832-5046,O=C(Cc1cccs1)NCC(c1ccco1)N1CCOCC1,2 Z2188522122,Cc(cc1)c(C2(CC2)c2noc(C(N(CC3)CCN3c3ccccc3)=O)n2)cc1F,2 Z1474299390,O=C(c(scc1)c1S(N1CCCCC1)(=O)=O)NC(CCC(N1)=O)C1=O,2 Z3040182811,C(Cc1ccccc1)CN(C1)[C@H](COC2)[C@H]2C11CCNCC1,2 F6481-0282,O=C(c1cocc1)N(CC1)CCSC1c1ccccc1,0 Z1168094075,CN(C)C(CN(CC1)CCC1NC(c1ccncc1)=O)=O,0 F0777-2574,CC(Nc(cc1)ccc1S(n1c(cc(C)c(C)c2)c2nc1)(=O)=O)=O,0 F2640-0364,CCCS(c1nc(cccc2)c2n1CC(N(CC1)CCN1C(OCC)=O)=O)(=O)=O,0 F6443-7940,O=C(NCC(CCC1)N1c1ccccc1)Nc1cccs1,2 Y043-0400,CN(C(C(C(Nc1nnc(Cc2ccccc2)s1)=O)c1c2cccc1)c1ccccc1)C2=O,2 Z1254378768,CC1(CNC(Nc2cn(CC(F)(F)F)nc2)=O)CCCC1,0 J001-0927,Cc1cc(C(C=C2)=NNC2=O)cc(S(N(CC2)Cc3c2cccc3)(=O)=O)c1C,2 F6554-4836,O=C(C(CC1=O)CN1c(cc1)ccc1F)N1CC(CF)C1,0 Y031-4814,Cc(cc1)c(C)cc1N(CC(C1)C(Nc(cc2)ccc2C(N)=O)=O)C1=O,0 Z3074710172,OCCNS(c(cc1C(F)(F)F)cnc1N(CC1)CC11COCC1)(=O)=O,2 SB01-0640,Cn1nc(COc2ncccc2)c(C2)c1CCN2S(c1cc(CCC2)c2cc1)(=O)=O,2 Z1479085368,CCCCn1ncc(NC(N(CC2)C(C)c3c2cccc3)=O)c1C,0 T955-0370,CC(C)CNC(N(CCC1)CC1c1nc(CCOc(cc2)ccc2F)no1)=O,0 F3406-3562,COC(c(cccc1)c1NC(CSc1ncnc2c1[nH]c(cc1)c2cc1F)=O)=O,0 Z1991899435,COCCC(C(O)=O)NC(c1ccc(-c(cc2)ccc2F)o1)=O,0 Z1669926750,O=C(c1c(-c(cc2)cc3c2OCCO3)ocn1)NC(C1)CNC1=O,2 Z1958900192,Cc1cc(CN(C2)C(C=NNC3=O)=C3Cl)c2cc1,2 J006-1829,COc1cccc(CN(CCCCC2)C2c2cccc(F)c2)c1OC,0 F5297-1025,COc(ccc(Cl)c1)c1C(Nc1cc(-c2ccco2)nn1C(N1)=NC(c2ccccc2)=CC1=O)=O,2 F2580-2146,COc1cc(NC(CN(C=CN(c(cc2)cc(F)c2F)C2=O)C2=O)=O)cc(OC)c1,0 S787-0517,CCNC(N1CCC(Cc2ccc(CCC(NC)=O)cc2)CC1)=O,0 SD62-0474,O=C(CCc1ccccc1)N1CC2(CCC2)C(CCC(N2CCOCC2)=O)C1,2 SD31-0127,O=C(c1nn(CCNC(c(ccnc2)c2F)=O)c2c1COCC2)N1CCOCC1,2 8018-6958,CN(C(CN1Cc2ccccc2)=C(C(c(cc2)ccc2O)N2)C1=O)C2=O,0 F5831-2022,CC(Cc1ccco1)NS(CCc1ccccc1)(=O)=O,2 F5222-0097,O=C(C(CC1=O)CN1c1ccccc1)NCC1(CCCC1)c1cccs1,2 8008-8129,CC(C)CC(Nc1nnc(-c2ccc(C(C)(C)C)cc2)s1)=O,0 SC16-0070,CS(N(CC1)CCC1c1noc(CC(C2)CN2C(c2cncnc2)=O)n1)(=O)=O,2 Z1645637755,OCC1N(Cc2c(CNC(CN3c(cc(cc4)Cl)c4OCC3=O)=O)cccc2)CCC1,2 F5246-0096,CSc(cc1)nnc1NC(C1c(cccc2)c2Oc2c1cccc2)=O,2 Z3617756041,C[C@](C1)(C[C@@H]1NS(c(snc1)c1Br)(=O)=O)O,0 F6443-4065,O=C(CCc(cccc1)c1Br)N(CC1)CCC1(c1c2cccc1)OC2=O,0 Z5027903344,CC(COC)N=C(NC[C@H]1OCCOC1)N(CC1)CCN1c1cccc(F)n1,0 Z2595535151,OC(c1ccc(CNC(C2(CCCCC2)C(F)(F)F)=O)cc1)=O,0 SA31-0298,CC(C)c1nnc(COC2)n1C2(C)C(NCCN1CCC(Cc2ccccc2)CC1)=O,0 F5033-7005,COc(ccc(CC(NCC(CC1)CCN1S(C1CC1)(=O)=O)=O)c1)c1OC,0 Z2438654370,CC(CCc1ccccc1)(CC1)CN1C(C(C1)C11CNCC1)=O,2 F6473-3549,O=C(c(cc1)cc2c1OCO2)N(C1)CC1N(C(CC1)=O)C1=O,2 SA85-0305,CC(C)CN(CC(CN(C1)C(Cc2c(C)onc2C)=O)O)C1=O,2 S993-0692,CC(C)CN(CC(N(CC1)C2CCN1C(c1noc(C)c1COC)=O)=O)C2=O,2 C692-0408,CN(c1c(C(N2)=O)n(CCc3ccccc3)c(CN3CCN(Cc4ccccc4)CC3)n1)C2=O,0 Y042-7168,CC(C)c1csc(CCNC(CC2Oc(cccc3)c3NC2=O)=O)n1,2 F6560-7653,O=C(C1(CC1)c(cc1)ccc1F)NCc(cc1)cnc1-c1cocc1,2 Z3066984585,CCn1ncc(Br)c1C(Nc1nn(C)c(OC)c1)=O,0 F5267-0488,O=S(Cc(cc1)ccc1F)(NCC1(CC1)c(cc1)ccc1F)=O,2 Z2876649244,Cc(n(-c1c(C)ccc(C)c1)nc1)c1NCc1nc(Br)nn1C,0 Z1499099167,CCC(C)OCC(N(CC1)CCC1C(C(OC)=O)O)=O,0 F6448-2081,O=C(c(cc1)cc2c1[nH]cn2)Nc1cn(CC2Oc(cccc3)c3OC2)nc1,2 F6454-0840,CC(Nc(cc1)ccc1S(NCC1CCN(CC(F)(F)F)CC1)(=O)=O)=O,0 Y020-6253,CC(C)c1ccc(C(C(C(N2)=O)C#N)C(C(N3)=O)=C2N=C3N2CCCCC2)cc1,0 F5033-5260,O=C(c1cc(cccc2)c2o1)N1CCC(CNC(c(cccc2)c2Br)=O)CC1,0 S627-0215,O=C(C(C(c1cncnc1)=C1)=C(CCCC2)N2C1=O)N(CC1)c2c1cccc2,2 F2704-0056,FC(c1cc(Nc2nc(N3CCOCC3)nc(N3CCOCC3)n2)ccc1)(F)F,0 Z4085521771,OCC(C(c(cc1)ccc1Cl)O)NC(CC(Cc(cccc1)c1N1)C1=O)=O,2 Z2489741395,CN(CC(NC(CC1C(O)=O)c2c1cccc2)=O)Cc1ccccc1,2 Z1614002874,Cc(cc(cc1)NC(c2nc(-n3cncc3)ccc2)=O)c1Br,0 Z2044592712,COCC1(CCC1)C(N(CCC1)CCC1S(C)(=O)=O)=O,0 Z2167681427,Cn1c(CNC(Nc2cccc(OCC(F)F)n2)=O)cnc1,2 F2442-0307,Cc1nc(Oc2ccccc2)cc(N(CC2)CCN2C(CCc2ccccc2)=O)n1,2 Z3995725884,OC([C@H](C[C@@H]1OCC[C@H]11)N1C([C@H]1OCCC1)=O)=O,2 Z4767388677,O=C(c1cc(Cl)cs1)Nc(cc1)cc2c1[nH]c(-c1cnccc1)n2,2 F3371-0794,COc(cc1)cc(OC)c1C(CC1c2cccs2)=NN1C(CN1CCOCC1)=O,2 D226-0052,CN(c1c(C(N2C)=O)n(Cc(cccc3)c3Cl)c(N3CCN(CCO)CC3)n1)C2=O,0 Z998367376,CCN(C1CC1)C(c(s1)c(C)cc1S(N)(=O)=O)=O,2 Z1134824308,CCC(c1nc(C)cs1)NC(c(cc1)cnc1C(O)=O)=O,2 Z1225124493,CC(C)(Cc1ccccc1)C(N1CC(CCC2)N2CC1)=O,2 Z2238695853,CCc1cnc(CN2CC(CCC(O)=O)CCC2)s1,0 F6490-1130,Cc(cc1)nnc1OC(CCC1)CN1S(CCOc1ccccc1)(=O)=O,2 F6619-7069,Cc1cc(C)nn1-c1cc(N(CC2)CCN2c2c3sccc3ncn2)ncn1,2 F2899-0647,CCOc1cccc2c1nc(N(Cc1ccco1)C(Cc(cc1)ccc1F)=O)s2,0 Z3063556243,Cc1cc(CNc2nc(C)cc(C(F)(F)F)n2)cc(N)n1,0 Y020-0465,COc(cc1)cc(N(C(CC2N3CCN(Cc4ccccc4)CC3)=O)C2=O)c1OC,0 F6752-7415,CC(C)(C)NC(C(CC1)CN1c1nccc2c1cco2)=O,0 F6764-1453,Cc1cnc(CN(CC2)CCC2c2nc3ncccc3cc2)c(C)c1OC,2 Z2656850004,OC(CC1(CCOCC1)NC(c(cc(C(F)F)cc1)c1F)=O)=O,0 F6560-8717,O=C(c1c[nH]c2c1cccc2)N(C(CC1)C2)C1CC2=C1CC1,2 Z3857011622,CC(C)NC(CN(C(c1cc(c(C)nn2-c3ccccc3)c2s1)=O)c1c(C)cccc1)=O,0 F6782-6278,CC(CN(C=CN(c1cc(C)cc(C)c1)C1=O)C1=O)=C,0 Z1516012811,Cc(cc1)cc(C)c1-c1nc(C(NCC2(COCC2)O)=O)cs1,0 F6451-3192,COC(CNC(Cc(cc1)ccc1F)=O)c1ccco1,0 Z1411885092,O=C(c1cnc(Cc(cc2)ccc2F)s1)N(C1)C(CCCC2)C2NC1=O,2 F6276-2059,O=C(NCc(cc1)ccc1F)N(C1)CC1Oc1nc(cccc2)c2s1,0 S858-1882,CS(N(C1)C[C@@](CO)(C2)[C@H]1CCN2C(C1(CC1)c1ccccc1)=O)(=O)=O,0 F6609-1889,O=C(COC(c1cc(Br)cnc1)=O)NCc(cc1)cc2c1OCO2,2 Z2992108561,Cc1noc(C)c1NS(c(cc(c(OC)c1)F)c1F)(=O)=O,0 F0848-0024,CC1(C(CC2)C3)C2(C)C3(C(Nc(cc2)ccc2C(OC)=O)=O)OC1,0 C610-0425,CC(C(O)=O)Sc1nc(-c2ccco2)nc(N(C)C(N2C)=O)c1C2=O,2 F0344-0768,CC(Nc1ncc(Cc2cc(C(F)(F)F)ccc2)s1)=O,0 Z3390053423,COc1nsc(CNC([C@@H](C2)[C@H]2C(O)=O)=O)c1Br,0 F6190-1108,OC(CCNC(C1(CC(C2)C3)CC3CC2C1)=O)c1ccco1,2 Z3077971344,C(c1c(CCCC2)n2nc1)Nc1nc(cccc2)c2n2c1cnc2,2 Z2200960808,COC(CC(NN1c(cc2)ccc2C(NC(CCC2)C2(F)F)=O)=CC1=O)=O,2 Z1543210989,CNc(cccc1)c1C(NCCc(cccc1)c1C(O)=O)=O,0 V023-4769,O=C(c1cc(F)cc(F)c1)N(CCC1)CCN1c(cc1)ncc1NC(Nc(cc1)cc(Cl)c1F)=O,0 F3406-3328,CC(C)CNC(c(sc1ncccc11)c1-n1cccc1)=O,2 F6515-0007,O=C(c1ccco1)NCc1cccnc1-c1cscc1,2 Z1344589385,CC(CNC(c1cc(-c2ccccc2)nn1-c1ccccc1)=O)c1ccncc1,2 SB36-1073,Cc1nn(C)cc1C(N(C1)[C@H](Cn2nnc(C(N3CCCC3)=O)c2)CC1(F)F)=O,0 S904-1847,CC(C)C(N1Cc2nnc([C@H](C3)N(Cc4ccc(C)s4)C[C@H]3O)n2CC1)=O,0 Z952607170,CS(CC(N1C(CC2CCCCC2)CCC1)=O)(=O)=O,0 F6773-2811,C(C1)C1c1nccc(N(CC2)CCC2Oc2nccs2)n1,2 Z1873102459,CCCc(n(-c1ccc(C)cc1)nc1)c1NC(N1CCOCCC1)=O,0 Z2027583271,CC(N(CC1)CCN1C(CCNC(c(snc1O)c1Cl)=O)=O)=O,2 SB56-0757,O=C(C1CCOCC1)N(C[C@@H]1c2nc(-c3nccnc3)no2)C[C@@H]1c1cnccc1,2 D265-0267,Cc1nc(CC(Nc(cc2)ccc2N2CCOCC2)=O)cs1,2 Z2700894161,O=C(C1N(Cc(cc2)ccc2Cl)CCC1)NCc1nnnn1-c1ccccc1,2 Z1893937937,NC(c(cc(cc1)Br)c1NCc1cn(cccc2)c2c1C#N)=O,0 SD07-0451,CC(C)CCNC(N(CC1)CC11OCc2c(CNC(C3CCOCC3)=O)nnn2C1)=O,0 Z2685157793,Cc1cc(OCC(N[C@@H](CC2)[C@@H](c3cn(C)nc3)NC2=O)=O)c(C)cc1,2 Z1905686092,Fc1cccn2c1nc(CN(CCC1)CC1Oc(nccc1)c1F)c2,2 Z3713743291,O=C(C(CC1)Cc2c1[nH]nc2)N(C1)CC1Oc(cc1)ccc1Br,0 E715-0641,Cc1cc(N(C)C(C(CC2)CCN2c2ncnc3c2nc2n3CCCCC2)=O)c(C)cc1,0 F6656-2847,CC(C)(C)c(cc1)nnc1OCC(CC1)CCN1C(c(cc1)nnc1N(C)C)=O,2 Z2181057728,COc1cccc(C2(CNC(N(CCC3)C3c(cccc3)c3OC)=O)CC2)c1,0 Z1021868018,Cc(c(C(NCc1cnccc1)=O)c1)nn1-c1ccccc1,0 Z432532926,CC(C)(C)c1cc(S(CC(NC2CC2)=O)(=O)=O)c(C)cc1,2 F5319-0119,CN(C(C=C1)=O)N=C1C(NCc(cccc1)c1OC)=O,2 F6550-7053,O=S(c(cc1)cc2c1OCC2)(N(C1)CC1Nc1ncncc1)=O,2 Z1587659743,CC(c1n[nH]cn1)NC(NC1CC1)=O,0 Z1657327947,O=C(C1CC1)Nc(cc1)ccc1C(N(CC1)CCC1C1COCC1)=O,2 Z1277854030,CC(C)(C)N(CC1)CCC1NC(Nc1cc(Oc2ccccc2)ncc1)=O,2 Z1391334069,Cc(nc(cc1)-c2cccs2)c1C(N(C)CC(C1CC1)O)=O,2 F6250-0131,Cc1c(C(NC(CCC2)CC2OC(Nc2ccccc2)=O)=O)c(-c(cccc2)c2Cl)no1,2 K284-7305,CCCCCN(C(c(cc(c(OCC)c1)OCC)c1N1)=O)C1=S,0 SC44-0165,Cc1c(COC)c(C(N(CC2)CCC2(C2)OCCC2OCC(N(C)C)=O)=O)no1,0 L234-0115,O=C1N(Cc2nc(-c(cc3)ccc3Oc3ccccc3)no2)c(cc(cc2)Cl)c2OC1,0 Z2174137984,O=C(Cc1ccc(C(F)F)cc1)NS(c1cccc2cccnc12)(=O)=O,0 Y043-2159,O=C(Cn(cc1)c2c1cccc2)Nc(cc1)ccc1N(CCCC1)S1(=O)=O,0 F6244-1589,O=C(c(cc1)ccc1-n1cccc1)NCC#CCN1CCCCC1,2 Z1018320012,CC(C(N1)=O)(c2cc(CNC(N(CCC3)CC3c3nc(cccc4)c4[nH]3)=O)ccc2)NC1=O,2 Z2982758294,Brc1cncc(-c2cn(CCOC3COCC3)nn2)c1,2 F6806-6339,CC(C)(C)C(NC1CCN(CC(NCC=C)=O)CC1)=O,0 F6681-3359,O=C(c1noc(C2CC2)c1)N1CC(COc2cnccc2)C1,2 F6674-5418,CN(C=C(C(N1C)=O)N(CC2)CCC2NS(c2cc(C(F)(F)F)ccc2)(=O)=O)C1=O,0 F6516-0494,O=C(NCc1ccc(-c2cccs2)o1)Nc(cccc1)c1Cl,0 Z2168798432,CN(C)c(cc1)ccc1NC(c1c[nH]nc1-c1ncccc1)=O,0 V019-4323,CC(C)C(C)N(Cc1nc(C(NCCN2CCOCC2)=O)co1)Cc1c(C)ccc(C)c1,2 SC88-2122,COCCC(N(C1)CC1(C(CC1)c2nc(-c(cc3)ccc3Cl)no2)S1(=O)=O)=O,0 Z283888446,CNC(c1c(C(F)(F)F)c2ccccc2nc1)=O,0 F6194-1460,CC(Cc1cscc1)(CNC(Nc(c(F)ccc1)c1F)=O)O,0 F5729-0876,Cc(c(C)c1)cc2c1ncn2CC(CC1)CCN1C(c1nccnc1)=O,2 Z4108033344,CNC(CN(Cc1ccc(C2CC2)cc1)C(c1cccc(C2)c1OC2=O)=O)=O,2 Z3268556031,OC(CCC1(COCC1)NC(c(cn1)c2n1nccc2)=O)=O,2 Z2595664422,OC([C@H]1OCC[C@H]1NC(c1nccc(-n2nccc2)c1)=O)=O,2 F6730-0264,O=C(c1ncnc(C2CC2)c1)Nc1cccc2ncccc12,2 F6570-2289,O=C(Cc1cccs1)Nc(cccc1)c1-c1cn(CCCC2)c2n1,2 S509-0706,CCS(N(CC1)CCC1(CC1)CCN(Cc2ccccc2)C1=O)(=O)=O,2 Z1471232269,O=C(C1OCCCC1)N(CC1)CCN1c(cc1)ccc1Cl,2 F0919-6824,COCCNc1nc(SCC#N)nc2ccccc12,0 Z1683474950,CC(C)NC(Nc1cc(-c2nc(-c(cc3)ccc3-c3n[nH]cc3)no2)ccc1)=O,2 F6442-5783,COC(CC1)CN1C(CC1)CCN1C(c1cscc1)=O,2 Z1067812524,Cn(cc1)nc1S(Nc1cc(C(F)(F)F)ccc1)(=O)=O,0 F6673-9368,CN(C1CCN(Cc(cc(cc2)F)c2F)CC1)c(nc1)ncc1Cl,0 Z3216016224,CCOC(CCCCS(N(CCC1)CC1c1ccn[nH]1)(=O)=O)=O,2 F6524-5510,CCSc(cccc1)c1C(NCc1nnc(cc2)n1nc2OC)=O,0 Z2798121634,O=C(C1C2(CC2)C11CC1)N(CC1)CCN1C(c1c(cccc2)c2n[nH]1)=O,2 FF01-3151,OC(CCCC(N1c(cccc2)c2N(CCC2)C2C1)=O)=O,2 S975-0610,CC(C)CN(CCN([C@H]1CN([C@H]2C)C(c3cccs3)=O)C2=O)C1=O,0 F6556-0266,CCc(s1)ccc1S(NCC1(CCC1)N1CCOCC1)(=O)=O,2 Z1291518897,CC(C(NS(c(cccc1)c1OC)(=O)=O)=O)c1cscc1,0 SB39-0950,CS(NC(CN(CC1(CCCC1)N1)C(COc2ccccc2)=O)C1=O)(=O)=O,2 F5033-0988,CCOCC(NCC1CCN(Cc2cscc2)CC1)=O,0 G779-0680,O=C(CCc1nc(C2=CCN(Cc(cc3)ccc3Cl)CC2)no1)NC1CCCC1,2 Z1603608794,OC(C1(CC1)NC(CN(Cc1c2cccc1)C2=O)=O)=O,2 Z2413832093,O=C(NCC1(CC1)N1CCOCC1)N1C(C2CCOCC2)C2(CCC2)C1,2 SC15-0412,COCC(C1)CN(CC(CC2)CCN2S(c2cccs2)(=O)=O)C1=O,2 S721-0167,CC(C)NC(N(C[C@H](C1)Oc2cnccc2)[C@@H]1C(N1CCOCC1)=O)=O,2 F2966-0379,CSc1cccc2c1nc(N(Cc1ccco1)C(COc1ccccc1)=O)s2,2 F0545-0802,Cn1c(cccc2)c2c(SCC(Nc2nc(cccc3)c3s2)=O)c1,2 J500-0855,CN(C)C(C(C1)C2(CCCC2)CN1S(Cc(cc1)ccc1Cl)(=O)=O)=O,0 T990-4213,O=C1N(Cc2ncccc2)CCC1N(CC1)CCN1S(c(cc(cc1)F)c1F)(=O)=O,0 F3083-0019,Cc(cc1C)cc(C)c1S(N(CC1)CCN1C(Cc1ccccc1)=O)(=O)=O,2 F6556-5996,O=C(CCc(cccc1)c1F)N(CCC1)CCN1C1CCC1,0 Z1969117078,CN(C)C(CONC(Nc(cc1OCCOc1c1)c1Sc1ccccc1)=O)=O,2 P315-0021,COc(ccc(NC(NC(CCN1c2ccccc2)C1=O)=O)c1)c1OC,0 Z2966423211,Cn(c(C(F)F)c1)nc1C(NC(C1CC1)c1ccncc1)=O,2 F2062-0017,CCOc(cc1)nnc1-c1cccc(NS(c(cc2C)c(C)cc2OC)(=O)=O)c1,0 F3394-0263,Cc1cccc(NS(c2cccc(Cl)c2)(=O)=O)c1,0 F1929-0738,OC(CCCC(N(CC1)CCN1C(c1ccccc1)c1ccccc1)=O)=O,0 F6573-4932,Cc1c(C(NCc2cncc(C3CC3)c2)=O)c(C)nn1C,2 Z1118935536,Cc(c1ncccc11)ccc1NC(c1cn(C2CCNCC2)nn1)=O,2 Y502-7307,Cc1nn(C)cc1S(N1CCN(Cc2cc(C(F)(F)F)ccc2)CC1)(=O)=O,0 Z1165159602,CC(c1cccc(Cl)c1)NC(c1c(C)n(-c(cc2)cc3c2OCCO3)nn1)=O,0 Z2438373686,O=C(C(C1)C11CCNCC1)N(CC1)c(cc2)c1cc2-c1cccc(F)c1,2 SC60-0342,CC(C)(CN(C(C1)C(N2c(cc3)ccc3F)=O)C2=O)CN1C(C1CCC1)=O,2 Z3356249717,Cc(cc1C)cc2c1[nH]c(C(N(C1)Cc3c1cnn3C)=O)c2,0 F3395-0147,COCCN(CC1)CCC1N(CC1)CCN1c(cccc1)c1OC,0 F6194-0176,CC(C)Sc1ccc(CC(NCC(C)(Cc2ccco2)O)=O)cc1,0 F3386-2828,CC(C)(C)NS(c(cc1)ccc1-c(ccc(OC)c1)c1S(NC(C)(C)C)(=O)=O)(=O)=O,0 Z1684580621,CC(C(N1)=O)(c2cccc(-c3noc(CC4=Cc(cccc5)c5NC4=O)n3)c2)NC1=O,2 F1374-1959,CCCCC(Nc1nnc(-c(ccc(F)c2)c2F)o1)=O,0 N106-0961,O=C(CCC[C@H]([C@@H]1[C@H]([C@@H](CCC2)C3)N2CCC1)N3C(c1cccc(F)c1)=O)Nc1ccccc1,2 F1874-0025,O=C(CSc1ncnc2c1cnn2-c1ccccc1)N(CC1)c2c1cccc2,2 F6414-0180,CC(C)(C(NCC(c(cc1)cc2c1OCC2)O)=O)Oc(cc1)ccc1Cl,0 Z2837538462,O=C(N1CCN(CCN(CCC2)C2=O)CC1)N1CCN(Cc2ccccc2)CC1,2 Z1350774746,CC(C)c(nc1)nc(C(NC2(CC(O)=O)CCC2)=O)c1Cl,2 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F982-0198,COc(ccc(N(C=C(c1nc(-c2ccncc2)no1)c1c2cccc1)C2=O)c1)c1OC,2 F6400-0672,O=C(c(s1)ccc1Cl)N1C(CN2CCCC2)CSCCC1,2 Z2966071094,COc1c(C(CC2)C(NCc3ccc(CCO)cc3)=O)c2ccc1,0 Z1955268248,Cc(ccc(Br)c1)c1S(Nc(cc1)cc2c1[nH]c(C(NC)=O)c2)(=O)=O,0 Z2771444707,CNS(c(cc1)cnc1N1CCC2(CCN(C)CC2)CC1)(=O)=O,2 F6471-5202,CN(C(C=C1)=O)N=C1C(N(CC1)CC1n1nncc1)=O,2 G395-1678,O=C(CCc1nnc(cc2)n1nc2NCCCN(CCC1)C1=O)NCC1OCCC1,2 SA66-1121,O=C(CCn1cncc1)N1CC(CCc2noc(C3CCOCC3)n2)CCC1,2 Z2828191014,CN(C[C@@H]1N(Cc2ccccc2)CCCC1)C(C1NCCOC1)=O,2 F6678-7914,O=C(CCC(F)(F)F)N(C1)CC1n1c(cccc2)c2nc1,0 Z2971964867,CC(CN(C1)c2cc(Cl)c(c(C)nn3C)c3n2)N(C)C1=O,0 Z1149182657,N#Cc1cccc(NC(NC2CCC2)=O)c1,0 Z1680847711,O=C(c1cncnc1)NC(CCC(N1)=O)C1=O,0 F6507-5806,CCSc(cccc1)c1C(NCCC(c1cccn1C)O)=O,0 K288-0103,CCCN(C(c(ccc(C(N1CCN(C)CC1)=O)c1)c1N1)=O)C1=S,2 F3406-7574,CCc1noc(-c(cc2)cnc2SCC(N(CC2)Cc3c2cccc3)=O)n1,2 Z1451903773,Cc(cc1)nn1-c(cccc1)c1NC(NC1(CO)CCC1)=O,2 F6522-0515,COc(ccc(CNC(NCc1cc(-c2ccco2)cs1)=O)c1)c1OC,2 T787-4836,CN(C)C(C(CN(C1)C(c(cc(cc2)F)c2F)=O)C11CCOCC1)=O,0 F6549-7625,O=C(Cc1cccc(C(F)(F)F)c1)N(C(CC1)C2)C1CC2n1ncnc1,0 SC98-0204,CC(C)n(c(CC1)c2CN1C1CCN(Cc3ccccc3)CC1)nc2-c1ncc(C)o1,2 F0556-0475,COc(cc1)cc(OC)c1NC(COc1cccc2c1CCN(Cc(cc1)ccc1Cl)C2=O)=O,2 Z1744191958,CN(c1ccccc1)c(cc1)ncc1C(N(CC1)CC1(c(cccc1)c1N1)C1=O)=O,2 Z2826933493,NC1(CCCC1)C(NC(CCN1c(cc2)ccc2F)C1=O)=O,2 Z2004954198,O=C(c1c(-c2ccccc2)scn1)N(CC1)CCC1S(N1CCCC1)(=O)=O,2 Z3709454323,CC(Cc(cc1)ccc1OC)C(Nc1nnc(-c2cccc(Cl)c2)[nH]1)=O,0 Z2358899932,CCc1ccc(C(CC2)CN2S(c2cn(C(C)CCC3)c3n2)(=O)=O)cc1,2 SC58-0274,Cc1cnc(C2C(C3)(CN3C(c3ccc(Cc4c(C)onc4C)o3)=O)CN(C)C2)o1,2 Z3216015670,CCn1ncc(S(N(C)CCNc2ncccc2)(=O)=O)c1,2 Z1239608803,CN(CC(NCc1ccccc1)=O)C(CCCc1c[nH]c2c1cccc2)=O,0 Z3303387732,CC(C)(Cc(cc1)cc(C)c1Br)C(NC1c2cc(C(OC)=O)nn2CCC1)=O,2 G935-4051,Cc(n(CC(N(CC1)c2c1cccc2)=O)nc1C)c1S(N(CCC1)CC1C(Nc1ncccc1)=O)(=O)=O,2 Z2774667903,CC(C(NC(C)(C)c1cnc(C)cc1)=O)n1nc(C(F)(F)F)cc1,0 Z1612165681,OCC1(CCC1)NC(CC1)CCN1C(c(cccc1)c1Cl)=O,2 Z2232267565,Cc(ccc(Cl)c1)c1N(C)C(C(CC1)CCN1c(cc1)ncc1C#N)=O,0 Z3625784074,COC(C(CC1(CCC1)C1)N1C(COc1cccc(N(CCC2)C2=O)c1)=O)=O,2 Z2141595016,Cc1c(C(N[C@@H](CC2)CN2S(c2ccccc2)(=O)=O)=O)sc(Cl)n1,2 Z2141555991,CN(C(CC1)CCC1(F)F)C(CCN(CCC1)S1(=O)=O)=O,2 F6439-3088,O=C(c1nccnc1)NCCn1nc(C2CC2)cc1C1CC1,2 F6510-1130,CN(c(cccc1)c1N1CCNC(c(cc2)ccc2SC)=O)S1(=O)=O,0 D269-0550,O=C(C1Oc(cccc2)c2OC1)Nc1nc(-c(cc2)ccc2F)ns1,0 Z1678143963,Cc1n[nH]c(C(N(CC2)CCN2c2nc(C)ncc2)=O)c1,2 S380-0079,COc1cc(NC(CN(C(C2(CCCCC2)N2)=O)C2=O)=O)cc(OC)c1,0 Z1665988331,CC(Cc1ccco1)NC(Cc1c2OCCc2cc(Cl)c1)=O,2 SB16-0296,C(c(cc1)cc2c1OCCO2)N(CC1)C[C@@H]2[C@H]1N(Cc1ccccc1)CCOC2,2 F6482-2177,Cc1c(CCC(NC2CC3OCCOC3CC2)=O)scc1,2 Z2994723225,CC1(C)OC(CNC(c2nnc(-c3ccns3)o2)=O)CCC1,2 Z4607590222,NS(C(CC1)CN1S(c(cc(c(CCC1)c2)NC1=O)c2Cl)(=O)=O)(=O)=O,0 D652-0120,O=C(c1noc(-c2cccs2)c1)N(CC1)CCC1c1nc(cccc2)c2s1,2 C909-0291,O=C(c1cc(CS(c2c-3cccc2)(=O)=O)c3s1)N(CC1)CCN1c1ccccc1,2 F5517-0045,Cc1nc(cccc2)c2n1Cc1ccc(C(NCc(c(F)ccc2)c2F)=O)o1,2 Z953997330,Cc1noc(CNC(N(CCC2)C2c(cc2)cc(OC)c2OC)=O)c1,0 F6730-4909,Cc(cc1)cc(Br)c1NC(c1ncnc(C)c1C)=O,0 E135-0799,CN(C1CCCCC1)C(C(N1C)=CC(c(cc2)cc(OC)c2OC)=NS1(=O)=O)=O,0 Z1169940953,O=C(c1cocc1)N(CC1)CCC1c1nc(-c(c(Cl)ccc2)c2Cl)no1,0 P093-0158,CC(C)CNC(c1cc(N(CC2)C(NC)=O)c2cc1)=O,0 F807-0310,O=S(c1ccccc1)(c(cc1)nnc1N(CC1)CCN1c1cccc(Cl)c1)=O,0 F3386-0190,Cc1cccc(NS(c(cc(cc2)OC)c2OC)(=O)=O)n1,0 F6495-4176,Cn1c(SCCNC(C(C2)CN2c2ncnc(-c3ccccc3)c2)=O)nnc1,2 F0894-0416,CCOC(Cc1nc(-c(cc2)ccc2Cl)cs1)=O,0 Z2900717374,Cc1ccnc(N(C2)CC2NC2CCOCC2)c1[N+]([O-])=O,2 F6481-4349,O=C(c1noc2c1CCCC2)N(CC1)CCSC1c1cccs1,2 Z1447680820,O=C(NCCC1Oc(cccc2)c2OC1)N1CC2(CCOCC2)OCC1,2 SB70-0946,COCCNC(c1nn(C[C@H](C2)NC(c3c[nH]nc3-c(cc3)ccc3F)=O)c2c1)=O,2 Z1498881354,CCNC(N(CC1)c2c1ccc(NCc(ccc(-c1ccncc1)c1)c1F)c2)=O,2 P619-0212,CN(c(nccc1)c1Oc(cc1)c2cc1S(NC1CCCCC1)(=O)=O)C2=O,2 F6478-1192,CC(Nc(cc1)ccc1C(N(CC1)CC1Oc(nc1)ncc1F)=O)=O,0 F6247-0705,O=C(c1c(-c2ncccc2)n(-c(cccc2)c2F)nn1)N(CC1)CCN1c1ncccn1,2 F6676-2714,CN(C(CC1)CCN1C(Cc(ccc(F)c1)c1Br)=O)c1ncccc1,0 J006-2745,CC(C)c1noc(C2N(Cc(cc(cc3)Br)c3F)CCC2)c1,0 S698-0329,Cc1cnc(C2CCOCC2)n1C(CC1)CCN1C(c1cocc1)=O,2 Z3834697163,O=C(C(C1CCC2)C1C2(F)F)Nc(cc1)ncc1N1CCOCC1,2 F6764-3275,Cn1c(cccc2)c2c(CC(N2Cc3cc4cccnc4nc3CC2)=O)c1,2 Z3801605364,CCn1nc(C(C)(C)C)c(CN2CC(c3cn(C)nc3)OCC2)c1,0 F6523-0326,Cc1cc(C(N(CC2)CCN2c2cc(C(F)(F)F)ncn2)=O)no1,2 Z2638298420,O=C(c1ncc[nH]1)N(CCC1)CC1C(O1)=NNC1=O,2 V019-1735,O=C(CCN(Cc1ccco1)C(c1csc(Nc(cccc2)c2F)n1)=O)NCC1OCCC1,2 F6764-3259,CSc1ncccc1C(N1Cc2cc3cccnc3nc2CC1)=O,2 F3230-0052,CC(CNS(c1ccccc1)(=O)=O)n1nc(C)cc1C,0 Z2464272324,NCC(C1CCCCC1)NC(C(Cc1ccccc1)NC(c1cnccc1)=O)=O,2 F6811-1696,COc1ccnc(N(CC2)CCN2C(C=C2)=NN(Cc3ccccc3)C2=O)n1,0 F3366-5780,CC(C1)N(C(Cc(cc2)cc(OC)c2OC)=O)c(cccc2)c2NC1=O,0 Z1817057945,CC(c1nnnn1C)S(c(cc1)cc(Cl)c1Cl)(=O)=O,0 C285-0085,CCCOc(cc1)cc(C(CCC2)=C3N2C(CN(CCC2)c4c2cccc4)=O)c1OC3=O,2 Z3363060923,CC(C)(c1c(C)onc1C)NCc1cc(O)c(C)cc1,0 S606-0147,CN(c1c(N2[C@H](CC3)CN3C(Nc(cc3)cc4c3OCCO4)=O)nccc1)C2=O,2 Z2299062295,CC(C)(C1)[C@H]1C(Nc1nc([nH]cc2)c2cc1)=O,2 F5788-2066,O=C(CN(CCN1c(cc2)cc(F)c2F)C1=O)N(CC1)CCN1c(cccc1)c1Cl,0 SC66-0119,Cn1c(C(CN(C2)C(c3c[nH]nc3-c(cc3)ccc3F)=O)C22CCOCC2)nnc1,2 D330-1714,CN(C(C1Cc(c(OC)cc(OC)c2)c2OC)=O)c(cc2)c1cc2Br,0 Z4951311891,OCCNC([C@H](CC1)CC[C@H]1n1nnc(-c(cccc2)c2C(O)=O)c1)=O,2 F6245-6491,O=C(c1ccc(Cn2cncc2)cc1)NCCN1N=C(c2ccco2)N(C2CC2)C1=O,2 Z1102476612,CC(N(CCC1)CC1C(N(C)Cc1nccn1CC(F)(F)F)=O)=O,2 Z2961462951,O[C@@H](COCC1)[C@H]1NC(c(cc1F)cc(F)c1Oc1ccccc1)=O,2 F5854-0636,O=C(CSCc1ccccc1)N(Cc1ccco1)Cc1ncccc1,2 Z2014784708,CCNC(CC(N(CC1)CCC1N(CC1)c(cc2)c1cc2F)=O)=O,0 V025-6253,O=C(COc(cc1)cc(N2CC3CCC3)c1C(C(F)(F)F)=CC2=O)NCCc1ccccc1,2 Y206-8376,CCC(C(Nc(cc1)cc2c1OCCO2)=O)Oc(cc1)ccc1OC,0 SD07-0524,CCCNC(NCc1c(COC(CC2)(CN2C(c2c(C)n(CC)nc2)=O)C2)n2nn1)=O,0 Z2145956282,O=C(N[C@H]1COCCC1)N1CCN(Cc2cscn2)CC1,2 F6680-9417,C(C1CN(Cc2nnco2)CCC1)Oc1ccncc1,2 F6200-3602,OC(CNC(c(o1)ccc1Br)=O)(C1CC1)c1ccccc1,0 G491-0318,O=C(C1=CC(C(CC(C2)c3ccco3)=O)=C2NC1=O)Nc(cc1)cc2c1OCCO2,2 P315-0775,Cc1cc(N(CCC2NC(Nc(ccc(OC)c3)c3OC)=O)C2=O)cc(C)c1,0 S689-2086,O=C(CC1CCCCC1)N(C1)CC1N(CC(C1)C(NCc2ccncc2)=O)C1=O,2 Z2993761217,Cc1cnc2n(CC(N(C)c3c(C)c(C)ccc3)=O)ncc2c1,2 F6724-5386,Cn1c(ncnc2N(CC3)Cc4c3sc(Cl)c4)c2nc1,2 Z1823608778,CC(C)c1nccc(N(CC2)CCC2C(c2ncc[nH]2)O)n1,2 C202-0427,O=C(CCC1)C(C2c(cc3)ccc3Br)=C1NC(NC(N1)=S)=C2C1=O,2 Z2174478348,Cc1cc2c(N(CC3)CCN3C(C(CC3)Cc4c3nnn4C)=O)ncnc2s1,2 F1835-0244,O=C(CSc1nn2c(-c3cnccc3)nnc2cc1)N1CCCCCC1,2 V018-7183,Cc1cc(OCc2nc(C(NC(CCCC3)C3NC(C3CCC3)=O)=O)cs2)cc(C)c1,2 F6525-6848,Cn1nnc(C(NCCn2ncc(-c3ccco3)c2)=O)c1,2 F1243-0115,CN(C(Oc(cc1)ccc1OC)=O)c1ccccc1,0 G883-0217,CCC(N(CC1)c2c1cc(CNC(C(CCC1)CN1S(N1CCCC1)(=O)=O)=O)cc2)=O,2 F6523-3186,CC(C)(C)OC(N(CCC1)C1C(NCCN(Cc(cc(cc1)F)c1OC1)C1=O)=O)=O,2 F6403-0853,COc1cccc(C(N(Cc2cnc3n2cccc3)c2ccccc2)=O)c1OC,2 F5579-1278,O=C(C(CC1)CCN1C1=Nc(cccc2)c2NC1=O)NCCc1cccs1,2 7525-1027,Cc1c(C(CSc2nnc(C3CCCCC3)n2C)=O)c(cccc2)c2[nH]1,2 F6574-1326,Cc1c(C(NC(CC2)CCC2n2nccc2)=O)scn1,2 G408-1019,Cc1ncc(-c2cc(S(Nc3c(CCCC4)c4ccc3)(=O)=O)c(C)cc2)o1,2 8010-5909,OC(c(cc1)ccc1NC(C1Oc(cccc2)c2OC1)=O)=O,0 S324-0214,CC(C)CCN(CC1)Cc2c1c1c(N3CCOCC3)ncnc1s2,2 F5106-0298,Cc(cc1)cc(CCC2)c1N2C(CCCN(C(C=C1)=O)N=C1c1cccs1)=O,2 Z743659668,CC(C)(C)c1nnc(CN2C(Cc(cc3)ccc3F)CCC2)o1,2 F6517-1212,OC(CNC(C1c(cccc2)c2Oc2c1cccc2)=O)c1ccc(-c2cscc2)o1,2 D470-2099,Cc1cccc(CN[C@@H](CS(C2)(=O)=O)[C@H]2S(c(cc2)cc(C)c2F)(=O)=O)c1,0 Z3644771559,CCc1nc(COC(C2OCC3(CCC3)C2)=O)cs1,2 F6727-2434,Cc1nc(CN(C)C(C2)CN2c2nn3c(-c4cccc(F)c4)nnc3cc2)co1,2 F6064-0768,CSc(cccc1)c1C(N(C1)CC1c1nc(-c2ncccn2)no1)=O,0 F6561-3626,Cn1c(cccc2)c2c(CC(NC(CC2)CCC2=C)=O)c1,2 Z1689799285,CCC(CN(CC1)c2ccccc2)N1C(c1c(C)nccc1)=O,0 Z2871474855,COCOc(cc1)ccc1NC(c1csc(N2CCCCC2)n1)=O,0 T500-1867,Cc1c(C(N(CC2)CCC2C(N(CC2)CCC22OCCCC2)=O)=O)scc1,2 F6476-4328,O=C(CNC(OCc1ccccc1)=O)N(CC1)CC1Oc1nc2ccccc2nc1,2 D470-0155,Cc(ccc(N(C(CC1)=O)S1(=O)=O)c1)c1S(Nc(cccc1)c1Oc1ccccc1)(=O)=O,0 Z2968214596,Oc1cccc(CN2CCN(Cc3cnc4n3CCOC4)CC2)c1,2 M867-1144,O=C(CN(c1csnc1C(N1C2CC2)=O)C1=O)N(CC1)CCN1c(cccc1)c1F,2 F6802-6970,CS(NC1CN(Cc(ccc(F)c2)c2F)CCC1)(=O)=O,0 V010-2310,CC(C)C(C)N(Cc(cc(cc1)NC(C(C)C)=O)c1N(C)C)C(CC(C)(C)C)=O,0 Z3354098629,Cn(cc1)c2c1[nH]c(C(N(CC1)CCC1C(O1)=NNC1=O)=O)c2,2 Z1837975791,CC(c1nnnn1C1CC1)S(c(cc1)ccc1Cl)(=O)=O,2 F6734-1452,O=S(c1c[nH]cn1)(N1CC(CN(C2)c(cc3)ncc3F)C2C1)=O,0 SC97-0060,CC(C)N(CC1)CC(CC2)(CN2C(c2c(C)ccs2)=O)NC1=O,2 Z2068578173,CC(C)C(c1noc(CCOCC2CC2)n1)Oc(cc1)ccc1Br,2 F6294-0525,COc(ccc(CC(NCc1nn(C2CCCC2)c(-c2cccs2)c1)=O)c1)c1OC,2 S700-1325,CCC(C)NC(N(C1)CC1c1nc(CCOc2cc(C)ccc2)no1)=O,2 T475-0372,CCN(c1ncccc1N=C1C(NCC(C)C)=O)C1=O,0 T853-0419,COCCN(C(CC1)=O)C2=CCCCC12C(Nc(cc1)ccc1OC)=O,0 Z1614590094,CN(Cc1nocn1)C(c1cccn1C)=O,0 Z394281080,CN(CC(C1)C(NCC2(CCOCC2)c2ccccc2)=O)C1=O,2 7407-0821,CC(C)c1cc(C(CC(c(cc(cc2)Br)c2N2Cc3ccccc3)(C2=O)O)=O)c(C)cc1,0 F6560-0787,Cc1c(C(NC(C2CCOCC2)c2cccs2)=O)sc(C)n1,2 F2496-2894,O=C(c1ccc(Cn2cncc2)cc1)OCc1noc(-c2cccs2)c1,2 F6477-3158,O=C(c(cc1)cc2c1OCO2)NC(CC1)CCN1c1nc(-c2cnccc2)cs1,2 Z2963185815,COc1cccc([C@@H](C2)[C@H]2C(NCc2cncc(O)c2)=O)c1,0 SB95-1316,CS(N(CCN1CCOCC1)C(CCC1)CN1C(c1cscc1)=O)(=O)=O,2 F6559-2363,CC(C)COc(cc1)ncc1C(NCc1nnc(C2)n1CCC2C(F)(F)F)=O,0 Z3051106283,OC(CC1)(CCN1C(c1nc(-c2ccccc2)ncc1)=O)C(F)F,2 F980-0743,O=C(CC1CCCCC1)N(CC1)CCN1C(C=C1)=NN(c(cc2)ccc2Cl)C1=O,2 Z3302374488,COCCCC(N1)=NC(c(cc2)ccc2Cl)=CC1=O,0 Z1680010600,Cc1c(C)[nH]c2c1c(NC(c1cncnc1)=O)ncn2,2 Y043-6251,O=C(CC(C(Nc1c2cccc1)=O)NC2=O)NC(CCC1)c2c1c1cccc(Cl)c1[nH]2,2 F2095-0186,COc(cc1)ccc1-c1c(C(Nc(cc2)cc3c2OCCO3)=O)c(cc(cc2)OC)c2o1,2 F6502-1254,Cc1c(C(NCCn2c(-c3nccnc3)ncc2)=O)c(C)nn1C,2 F6193-0179,O=C(C(c1ccccc1)c1ccccc1)Nc1cc(C(NCC2)=O)c2cc1,2 Z4499936373,O=C(C(c1c2cccc1)=NNC2=O)Nc1cc(C(CCCC2)=O)c2cc1,2 C857-0115,CC(CCC1)C(C)C1NC(C(CC1)CCN1c1nnc(-n2cccc2)s1)=O,2 8017-4540,OC(CCc1ccc(-c(cc2)ccc2F)n1CC1OCCC1)=O,2 SA01-0868,CN(C)C(c1c(C(CC2)CN2C(CC2CC2)=O)nc(N(C)C)nc1)=O,0 Z26341471,Clc(cc1)ccc1-c1nnc(COc(cccc2)c2Cl)o1,0 F6512-7007,Cn1ncc(S(N(CCC2)CCN2C(c2cn(C)nc2OC)=O)(=O)=O)c1,0 C793-0052,OC(c(cc1)ccc1-n1c(-c2ccccc2)cc2c1CCCC2)=O,0 F3398-1046,O=C(CCc1nnc2n1c(cccc1)c1nc2N1CCCCC1)NCc(cccc1)c1F,2 F6416-9169,CCN(CCN(C(NCCC(c1cccc(Cl)c1)O)=O)C1=O)C1=O,2 S428-0295,O=C(c1n[nH]c-2c1COc1c2cccc1)N(CCC1)CC1c1nc(C2CCOCC2)no1,2 F6218-0125,Cc1cc(C)nn1-c(nc1)ncc1NC(c(c(F)ccc1)c1Cl)=O,0 F1201-0296,CC(C1)OC(C)CN1C(c1cc(c(C)nn2-c3ccccc3)c2s1)=O,2 F6734-0804,CC(C)Oc(cc1)ncc1C(N(C1)CC(C2)C1CN2c(cc1)ncc1Cl)=O,0 L299-0524,Cc(c(-c1cc(S(N(CC2)CCN2c2ncccc2)(=O)=O)c(C)cc1)c1NC(CC2)=O)nn1C2=O,2 SD56-0407,O=C(CC1CCCC1)N(CCC1)CC(C(N2c3ccccc3)=O)N1C2=O,2 Z3278069436,NC(C1)C2(CCC2)CN1S(c(occ1)c1Br)(=O)=O,2 F6108-0098,COCCN(CC1)CCC1NC(c(ccc(Cl)c1)c1Cl)=O,0 J030-0616,CCN(CC)S(c(cc(c(Oc(cccc1)c1N1)c2)C1=O)c2N1CCN(C)CC1)(=O)=O,0 Z4946392151,Cc(cc(cc1)NC(C(CC(C2)O)N2C(Cc(cccc2)c2F)=O)=O)c1C(N)=O,0 Y042-7427,CC(C)c1nc(cc(cc2)NC(CC3(CCOCC3)n3cccc3)=O)c2[nH]1,2 Z4285944618,CC(c1ccccc1)NC(CCc1cnco1)=O,0 F5003-0400,Cn(cc1-c(n2CCOC)nnc2SCc(c(F)ccc2)c2Cl)nc1OC,0 F6738-2349,Cc(cncc1)c1OC(CC1)CN1c1cnc(cc(cc2)Cl)c2n1,2 F6438-0767,COc1cccc(NC(NCc2nc(N3CCCCC3)ccn2)=O)c1,2 F5097-2535,O=C(Cc(cc1)ccc1NC(CSc(cc1)ccc1F)=O)NCC(F)(F)F,0 F6436-2307,OC(CNC(c(cc1)ccc1-c1cscc1)=O)(CC1)c2c1cccc2,2 F5833-5419,COc(cc(cc1)NC(Nc(c(F)ccc2)c2F)=O)c1N(CCC1)C1=O,0 S985-0064,CN(C[C@H]1CN(C2)C(c3c[nH]nc3-c(cc3)ccc3F)=O)C[C@]12C(N1CCCC1)=O,2 Z1444898382,OC(CCNC(c(cc1)ccc1NC(c1ccncc1)=O)=O)=O,0 Z3786646624,O=C(CCC(N1)=Nc(cccc2)c2C1=O)N(C1)Cc2c1cccn2,2 Z2892450610,Cc1nc(N2NC(C(N(CC3CC3)Cc(cc3)ccc3F)=O)=CC2=O)nc(C)c1,0 F853-0714,Cc1cc(S(N(CC2)Cc3c2nc(Nc2cc(OC)cc(OC)c2)nc3)(=O)=O)c(C)cc1,0 Z3686302499,O[C@@H](CC(Cn1nccc1)C1)[C@H]1Nc(nc(C1CC1)nc1)c1Br,0 K783-6651,CC(CC1)CCC1NC(c(cc1)cc2c1SCCN2Cc(cc1)ccc1Cl)=O,2 Z2640927722,COc(cc1)nn2c1ncc2C(N1CCC(CF)CC1)=O,2 F3179-0293,CCC(C)NS(c(cc1)cc(OC)c1Cl)(=O)=O,0 F6564-7938,CC(C(NCCCc1nc(C)no1)=O)N1N=C(CCC2)C2=CC1=O,2 F6357-0571,O=C(c(s1)ccc1Cl)NCC1(CCCC1)c1cscc1,2 Z2527329502,Cn1ncc(Cn2nnc(CC(C3CC3)O)c2)c1,2 G406-1705,CC(CC1)CCN1S(c(cc1)cc(CC2)c1N(CC(NCc1cccs1)=O)C2=O)(=O)=O,2 E756-0409,Cn(c(cc1)c2cc1OC)c(C(NCC1OCCC1)=O)c2N(CCC1)C1=O,2 F6436-1755,COc1ccc(C2(CNC(c(cc3)ccc3-c3cscc3)=O)CCOCC2)cc1,2 Z316519296,N#Cc1ccc(Cc2cnc(NC(c3c4ncccn4nc3)=O)s2)cc1,0 F6810-6309,O=C(C1(CCN(Cc2c(C(F)(F)F)cccc2)CC1)N1)NC1=O,0 Z3686178696,C[C@H]1N(C)[C@@](CNCc2n[nH]cc2-c2ccccc2)(CO)COC1,2 Z1420372238,CC1(CC1)C(N1CCN(Cc2n[nH]c(C)n2)CC1)=O,2 F6512-2936,Cc1c(CN(CC2)CCN2C(c(cccc2)c2S(C(F)F)(=O)=O)=O)cno1,0 Z3009837564,C[C@@H](CC(O)=O)NC(C1=Cc(cc(C)cc2)c2OC1)=O,0 G887-0635,CCc1cc2c(N(CC3)CCC3C(NCCCN(CCC3)c4c3cccc4)=O)ncnc2s1,2 Z3074667837,OCCCNc(ncc(S(N1C(C2)C2CCC1)(=O)=O)c1)c1Cl,2 F6523-3808,CCOc(nccc1)c1C(N(CC1)CC2=C1N=C(C=CC(Cl)=C1)N1C2=O)=O,2 Z4497009199,CC(C(N1C(COc(cc2)ccc2F)CCC1)=O)n1nc(C(F)(F)F)cc1,2 Z1723610798,CCc1ccc(C(C)NC(C(C)N(C2)C(CO)CC2O)=O)cc1,0 Z901481720,O=C(c(cc1)cc2c1[nH]cn2)NCC1CN(Cc2ccccc2)CCC1,2 Z1528279556,OC(CN(CC1)CCN1C(c(cccc1)c1OC(F)F)=O)c(ccc(Cl)c1)c1Cl,0 F6522-0490,COc(cccc1)c1NC(NCc1cc(-c2ccco2)cs1)=O,0 Z2767322586,Cc1ccc(CC(CCC2)CN2C(C(c2c[nH]cn2)O)=O)cc1,2 F6677-6730,O=S(c(cccc1)c1F)(N(C1)CC1(C1)C1(F)F)=O,0 Z4512917487,Cc1cccc(C(CCO)NC(C2=CC=CN(CC(O)=O)C2=O)=O)c1,2 Z2958194503,CN(C[C@@H](CO)O)C(c1cc(F)cc(Br)c1F)=O,0 F5882-0170,Cc1cccc(OCC(NCCN(CC2)CCN2C(OC)=O)=O)c1,0 V015-8165,CCC(C)C(N(CC1)CCN1C(C1CCCC1)C(NCCN1CCCCC1)=O)=O,2 F5668-4623,Cc1noc(C(C2)CN(Cc(ccc(F)c3)c3Cl)C2=O)n1,2 Z1445508092,COc(cc1)ncc1C(N(CC1)CCC1(C(O)=O)O)=O,0 Z2950094728,CC(C)c1nsc(CN2C(CS(C)(=O)=O)CCCC2)n1,2 F0647-0090,Brc1c2nc(N(CC3)CCN3c3ccccc3)sc2ccc1,0 F0590-0338,Cc(cc1)cc(C)c1NC(CS(c1cn(Cc2c(C)cccc2)c2c1cccc2)(=O)=O)=O,2 Z2777197592,CSCCCNC(NCc1c(cc[nH]2)c2ccc1)=O,0 F6556-0920,COc1c(CNC(C(NCC(CSC2)(c3c2cccc3)O)=O)=O)cccc1,2 T655-0387,CS(N(C1)CC2(CCOCC2)C1c1nnc(-c2ccncc2)o1)(=O)=O,0 Z944698376,CN(CC1)CCN1C(CCNC(N1C(Cc(cccc2)c2OC)CCC1)=O)=O,2 D638-0014,Cc1nc(N2CCCC2)cc(Nc(cc2)ccc2NC(Nc(c(OC)c2)cc(Cl)c2OC)=O)n1,0 Z1546149453,Cc(cc1)ncc1NC(N(CC1)CC1C1CC1)=O,0 Z2648330042,CC(N(C[C@@H](C1)O)[C@H]1C(NCC1N(Cc2ccccc2)CCN(C)C1)=O)=O,2 8012-5533,NC(c(c(Oc1ccccc1)c1)c2cc1Oc1ccccc1)=C(c1ccccc1)S2(=O)=O,2 Z2737704698,Cc(ccc(Cl)c1)c1S(NCC1(COCCC1)C(O)=O)(=O)=O,0 F6807-7111,CS(c(cc1)ccc1N(CC1)CCN1c(cccc1)c1F)(=O)=O,0 SA01-1149,CN(C)c1ncc(C(NCCCn2nccc2)=O)c(C(CC2)CN2S(C)(=O)=O)n1,2 C094-1755,CCC(C)(C(NC1CCCCC1)=O)N(Cc1cccs1)C(CNC(C)=O)=O,2 Z1636067964,Cc1nscc1C(NC1(CCCC1)c1noc(C2CC2)n1)=O,2 SA45-0059,CN(CCCC1(CC2)CCN2C(c2ncccn2)=O)C1C(N)=O,2 SA01-1003,CN(C)c1ncc(C(NCCOC)=O)c(C(CC2)CN2C(NCc2ccco2)=O)n1,0 V020-0264,O=C(c1cccc(Cl)c1)N(CC1OCCC1)Cc(n1C2CC2)cnc1S(Cc1ccccc1)(=O)=O,2 Z992718982,Fc(cc1)cc(-c2csc(C3CCNCC3)n2)c1F,0 Y043-5149,O=C(CCC(C(N1CCc2ccccc2)=O)NC1=O)Nc1nc(-c2ncccc2)cs1,2 F2024-0634,Cc(cc1)c(C)cc1N(CC(C1)NC(NCc2ccco2)=O)C1=O,2 Z1578245557,CC(C)(C)NC(NC(CN1CCC(Cc2cnccc2)CC1)=O)=O,0 Z1420726025,Cc1cccc(C(N(CC(c2ccco2)O)Cc2ccccc2)=O)c1F,0 L631-0190,CC(C)C(N(CC1)Cc2c1n(C)nc2C(N(CC1)CCC1C(NCc1ccco1)=O)=O)=O,2 S613-0863,O=C(NCCc1ccccc1)N(CCC1)C1c1nc(CCOCC2CC2)no1,2 F6656-2919,CC(C)(C)c(cc1)nnc1OCC(CC1)CCN1c1nc(C)nc2c1cnn2C,2 S689-2074,O=C(CCC1CCCC1)N(C1)CC1N(CC(C1)C(NCc2ccncc2)=O)C1=O,2 F6807-7107,N#Cc1ccnc(N(CC2)CCN2c(cccc2)c2F)n1,0 Z2707286458,CCN1N=C(CCN(C2)C(c3ccc(Cn4nncc4)cc3)=O)C2=CC1=O,2 P578-0120,CC(CC1)CCN1c1cc(-n2cnc(C(N3CC(C)CCC3)=O)c2)ncn1,0 Z2233642508,O=C(c(cc1)cc(N=C2N3CCCCC2)c1C3=O)N(CCC(C1)=O)C1c1ccccc1,2 D577-0290,Cc1cc(Nc(cc2)ccc2NC(Nc(cc2)cc3c2OCCO3)=O)nc(NC2CCCCC2)n1,2 Z1529773006,OC[C@@H](CCC1)N1C(Cc1csc(-c2nccnc2)n1)=O,2 SC76-0620,O=C(CN(C([C@]1(COc(cc2)ccc2F)[C@H]2C1)=O)c1c2cccc1)NC1CCOCC1,2 S779-0024,Cc1cnc(-c2ccccc2)n1CC(CC1)CN1C(C1(CCCC1)c1ccccc1)=O,2 Z2946994891,CC[C@H]1OCC[C@@H]1C(Nc(cc1)cnc1N1CCCCC1)=O,2 SC67-0184,CC(C)N(C1)CC(CC2)(CCN2S(C2CC2)(=O)=O)C1c1nncn1C,2 F6276-1474,COc1cccc2c1nc(OC(C1)CN1C(COc(cccc1)c1F)=O)s2,2 Z1820551123,CN(CCC(C1)NC(c2nccc3ccccc23)=O)C1=O,2 8009-5049,CC(C1)OC(C)CN1S(c1cc(C(O)=O)ccc1)(=O)=O,0 Z4905531842,CS(c1c(C(Nc2nc(CCC3(CCCCC3)C3)c3s2)=O)nccc1)(=O)=O,2 Z1010984952,COc1ccc(CNC(CN2CCC(CCN3CCOCC3)CC2)=O)cc1,0 Z1718237433,CCC(CC1)OC1C(NS(CC1(CCC1)C#N)(=O)=O)=O,2 F6403-1458,CCN(Cc1cnc2n1cccc2)S(c1cnccc1)(=O)=O,2 SD01-1026,CCCn(c(CC1)c2CN1C(c(cc(cc1)Cl)c1F)=O)nc2-c1cocn1,2 F2206-0314,Cc(cc(c(S(Nc(cc1)ccc1-c1cn(ccc(C)n2)c2n1)(=O)=O)c1)OC)c1Cl,0 F6439-5359,Cc(n(C)nc1C)c1S(NCCn(cc1)nc1-c1cccs1)(=O)=O,2 Z2437374899,O=C(CC1CC(CC2)NC2C1)Nc(cc1)ccc1OCc1noc(C2CC2)n1,2 Z1528828193,O=C(C(CC1)CCC1(F)F)NCCc1nc(cc(cc2)F)c2[nH]1,0 F6678-8251,Cc1c(CN(C2)CC2n2c(cccc3)c3nc2)cccc1,0 F6559-1244,O=S(c(cccc1)c1Br)(N(CC1)CC1n1c(cccc2)c2nc1)=O,0 F6482-5831,O=C(Cc(cccc1)c1Cl)NCc1cc(-c2ccncc2)ncc1,0 F1318-0155,CCN(CC)C(N(CC1)CCN1c(cc1)cc(Cl)c1Cl)=O,0 S724-0558,O=C(c1cn(C(C2)CN2C(NC2CCCCC2)=O)nn1)N1CCCC1,2 F5286-0131,O=C(C(OC=C1OCc2ccccc2)=CC1=O)NCCc1c[nH]c2c1cccc2,2 P315-0723,CCOc(cc1)ccc1NC(NC(CCN1c2cc(C)cc(C)c2)C1=O)=O,0 Z1642853629,Cc1c(C(N(CC2)CC22COCC2)=O)nc(-c2cccc(C(F)(F)F)c2)o1,2 F5954-0139,FC(c1cc(Nc2nnnc3c2cnn3-c2ccccc2)ccc1)(F)F,0 Z3603670614,O=C(NC1CC1)Nc1cc(-c2c(COCC3)c3n[nH]2)ccc1,2 SB94-0135,Cc1noc(C)c1CN1CCC(CN(CC(C2)C(NC3CC3)=O)C2=O)CC1,2 SD61-0455,O=C(C(C1)C2(CCC2)CN1C(C1CCCCC1)=O)NCc1ccncc1,2 Z1546877812,CN(CC(NC1CC1)=O)C(CCN1C2CC2)C1=O,2 Z4179124530,COc(cc1)cc(O2)c1C(CN)=CC2=O,0 SB54-0997,COC[C@@H](CN(C1)C(c(ccc(OC)n2)c2OC)=O)[C@H]1c1nnc(-c2ccccc2)o1,0 F6556-7823,CC(Cc1cc(cccc2)c2o1)NC(NCc(cc1)ccc1Cl)=O,0 F6608-3897,CC(C)N1CCN(CC#CCOC(CC2)CCN2c2nc(C)cnc2)CC1,0 P223-1182,COCCN(CCCn1nc(C(CCC2)CN2C(Nc2ccccc2)=O)cc11)C1=O,0 Z2910012496,Cc1ccc(C2OCCCC2CNC(C(CC2)(CC3)CC23C(O)=O)=O)cc1,2 Z1144335746,CCC(C(NCC1)=O)N1C(CN(C(c1c2cccc1)=O)C2=O)=O,0 Z1972478984,Cn1c(ccc(F)c2)c2c(C(NC(CCCC2)C2C(N)=O)=O)c1,0 Z2298295174,CC(C)(CC(CC1)O)CN1C(c1cc(c(C)c(C)cc2)c2[nH]1)=O,0 C304-0652,CCCCN(CC)CCNC(c(cc1)cc2c1Sc(ccc(Cl)c1)c1C(C)=N2)=O,0 D753-0062,Cc1noc2nc(C)cc(C(N[C@H]3CC[C@H](CN(Cc4c5cccc4)C5=O)CC3)=O)c12,2 7287-0973,C(CC1)CC1N(CC1)CCN1c1c2oc(cccc3)c3c2ncn1,2 Z3216015639,C[C@H](c1cnccc1)N(C)S(c1c(C)n(C)nc1)(=O)=O,0 F6806-7036,O=C(C1OCCN(CCc(cc2)cc3c2OCC3)C1)N1CCSCC1,2 S565-1087,Cn1cnc(S(N(CC2)Cc3c2n(C)nc3-c2nncn2Cc2ccccc2)(=O)=O)c1,2 F6708-8309,O=C(CN(C(CC1)=O)C1=O)N1CC(C2)(CC2c2ccccc2)C1,2 Z1593246769,CC(C)(CN(Cc1ccccc1)S(c1ccc(CCNC(C)=O)s1)(=O)=O)O,0 F6796-3215,O=C1N(CC(F)(F)F)CCC1N(CC1)CCN1c1nc(cccc2)c2s1,2 M750-2005,O=C(CC(CCC1)CN1C(Nc1cc(F)ccc1)=O)N(CC1)CCN1c(cccc1)c1F,2 F6190-0262,OC(CCNS(c(cccc1)c1Cl)(=O)=O)C1CC1,0 Z199550932,CC(Nc(cc1)ccc1NC(CC1Sc(ccc(Cl)c2)c2NC1=O)=O)=O,2 8014-4822,N#Cc1ccc(-c2ccccc2)nc1SC(CC(N1c(cc2)ccc2Cl)=O)C1=O,2 Z3018458595,Cc1ncnc(Nc2cn(CCOC)nc2)c1Br,0 F6537-3127,Cc(cc(cc1)NC(C#CC)=O)c1N(CCOC1)C1=O,2 Z2597403696,OC[C@H](CN(Cc(ccc(C(O)=O)c1)c1F)C1)[C@@H]1c1cscc1,0 S509-1641,CN(CCC(CC1)(CCN1S(c1cc(CCC2)c2cc1)(=O)=O)CC1)C1=O,2 Z3132587546,CCc1cccc(N(C)c2nnc(CS(C)(=O)=O)n2Cc2ccccc2)c1,0 F6216-0141,Cc1noc(CCCNC(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=O)c1,0 Z4066529495,Cc1noc(C)c1CC(Nc1cccc(C(Nc2cccc(Cl)c2)=O)c1)=O,0 S978-0640,C[C@@H]1N(Cc2cnccc2)Cc(cc(CN(C2CC2)S(C)(=O)=O)cc2)c2OC1,2 5449-0006,CC(C)c1cc(C(CC(c(cccc2)c2N2)(C2=O)O)=O)c(C)cc1,0 F6245-4657,CN1N=C(C(CC2)CCN2C(c2nc3ccccc3nc2)=O)N(C2CC2)C1=O,2 F6481-1291,O=C(c1cc(C(F)(F)F)ccc1)N(CC1)CCSC1c(cccc1)c1F,0 Z2187974486,Cc1cc(C(N(CC2)CC2n2nccc2)=O)c(C)n1-c1nccs1,2 F6441-6583,COc(cc1)ccc1S(C(CC1)CCN1C(c(cc1)ccc1-c1cccs1)=O)(=O)=O,2 T955-0945,Cc1c(CN(CCC2)CC2c2nc(CCOCC3CCCC3)no2)scn1,2 Z741472870,O=S(NCc1cc(Br)cs1)(N1CCOCC1)=O,0 Z2373772705,OCCC(CCC1)CCN1C(C(F)(F)F)=O,0 Z1618199270,COCC1(CC1)C(N(CC1)CCN1c1c(ccs2)c2ncn1)=O,2 Z4089409455,Cc(cc1)ccc1-c1c(C(NCc2nn(C)c3c2COCC3)=O)nco1,0 P937-3750,O=C(CC1CCCCC1)N1CC(Cc2nnc(-c3ccncc3)[nH]2)CC1,2 F6559-1184,O=C(c1c(cc[nH]2)c2ccc1)N(CC1)CC1n1c(cccc2)c2nc1,2 F6448-0769,O=C(C1(CCOCC1)c1ccccc1)Nc1cn(C2COCC2)nc1,2 Z916010206,O=S(c(c(F)ccc1)c1F)(N(CC1)CCN1C1CCCCC1)=O,0 Z2066283280,Cc(cc1C(O)=O)cc(S(N2CCC(CC(N)=O)CCC2)(=O)=O)c1F,0 SB92-0248,Cc1noc(C)c1CC(N(C1)CC1N(CCN1CCOCC1)S(C)(=O)=O)=O,2 F6670-6315,CC(N1CC(CC2)CCN2C(Cc(cc2)ccc2Cl)=O)=Nc(cc(cc2)F)c2C1=O,0 S564-0071,Cc1nnc(CC(CC2)CCN2C(C2(CC2)c(cc2)ccc2OC)=O)[nH]1,2 F6390-2679,O=C(CCc1ccccc1)N(Cc1ccco1)C1CCOCC1,2 Z1498197728,CC(C(N1CCOCC1)=O)N(CC1)CCN1c1ncnc2c1cc[nH]2,2 8013-0770,CCOc(cc(C(C(C(C)=O)=C(C1=O)O)N1c1cc(Br)c(C)cc1)cc1)c1O,0 Z3216017318,OCCN(CCO)C(Nc1noc(-c2cccs2)c1)=O,2 F6667-6211,Clc(cccc1)c1N(CC1)CCN1c1nccs1,0 Z1887424777,OCC(Cc1ccccc1)(CC1)CCN1C(c(cc1)ccc1OC1CCOCC1)=O,2 F3098-8183,Cc1c(C)sc(NC(CCCOc2ccc(C)cc2)=O)n1,0 Z4509267170,CC(c1cc(-c2n[nH]nn2)ccc1)N(C)CC(N=C1N2C=C(C)C=C1)=CC2=O,2 Z1663801020,CC(N(C1)CC1NC(CN(C=NN1)C1=O)=O)=O,2 F6556-5872,O=C(Cc(cccc1)c1Cl)N(CCC1)CCN1C1CCC1,2 T408-0688,O=C(C(CC1)Cc2c1sc(C(N1CCCC1)=O)c2)NCCCn1nccc1,2 F6559-6767,Cc1nc(C(F)(F)F)cc(N(CC2)CCN2S(c2cn(C)nc2)(=O)=O)n1,2 SC13-0003,O=C(C1CCC1)N(Cc1cnccc1)C(CCC1)CN1C(C1(CCCC1)c1ccccc1)=O,2 F6761-7931,COc(ccc(CNC(N(CC1)C(C2)C1CN2c(cc1)ncc1F)=O)c1)c1OC,2 Z646185464,CC(c(cc1)cc(OC)c1OCc1ccncc1)NC(N(C)C(N(C)C1=O)=O)=C1C#N,2 F6288-0590,Cn1c(CCNS(C2CC2)(=O)=O)nc(-c2ccco2)c1,2 Z2119066878,O=C(c1ncnc(Nc2ccccc2)c1)N(CCC1)CC1Nc1ccccc1,2 Z2017599582,O=C(NC1CCCCC1)NC(CC1)CCN1C(Nc1cn(Cc2ccccc2)nn1)=O,2 8019-4884,OC(CC(c1ccc(C2CCCCC2)cc1)=O)(c(cccc1)c1N1Cc(cccc2)c2Cl)C1=O,2 Z1381666887,CCOc(cc1)cc(C)c1S(N1Cc2nc(C)nn2CC1)(=O)=O,0 F6492-0851,Cc1nc(CC(CC2)C(NCCc3cccs3)=O)c2[nH]1,2 L299-0828,Cc(c(-c(cc1)cc(S(NC2CCCC2)(=O)=O)c1Cl)c1NC(CC2)=O)nn1C2=O,0 F6253-6247,CC(c(cc1)cc(OC)c1OC)NC(C(CC1=O)CN1c(cc1)ccc1OC)=O,0 SD01-0399,COCCCn(c(CC1)c2CN1C(CCN(c(cccc1)c1O1)C1=O)=O)nc2-c1cocn1,2 F6676-1413,Cc1nccc(OCC2CCN(CCn3nncc3)CC2)c1,2 SA96-1473,CNC(N(C1)CC1(CN(Cc1ccccc1)C1)C1C(NCC1CC1)=O)=O,0 Z3201310607,CC(CN(C1)C(C(C2)Cc3c2cccn3)=O)Oc2c1cccc2,2 F3398-3072,CCOc(ccc(-c1n[nH]cc1-c1nc(-c2c(C)cccc2)no1)c1)c1Cl,0 Z1415539698,Cc(cc1)nn1-c(cccc1)c1NC(NC1CCN(C)CC1)=O,2 F6597-0876,Cc1cccnc1OCC1CCN(CC2OCCC2)CC1,2 Z2256304821,CN(C(Cc1ccccc1)C(O)=O)C(CCc(cc(cc1)F)c1F)=O,0 Z1121119530,CCNC(CN(CC)C(NC1CCN(CCc2ccccc2)CC1)=O)=O,0 SB21-1341,NC(c1cn(C[C@H](C[C@@H](C2)F)N2C(Nc(cc(cc2)F)c2F)=O)nn1)=O,0 V001-4474,CC(C)NC(N(CC1OCCC1)Cc(c(C)nn1-c2ccccc2)c1Oc1ccccc1)=O,0 G410-0060,Cc1cc(C)nn1-c(c1ccccc11)nnc1N(CC1)CCN1c(cc1)ccc1OC,0 Z1385371693,CCc([nH]1)nnc1S(Cc1cc(NC(C)=O)ccc1)(=O)=O,0 Z1900631705,Fc1c2nc(N3CC4(CC4)COCC3)oc2ccc1,2 J031-1788,CCn1c(SCC(Nc2c(C)ccc(C)c2)=O)nnc1-c1c(C)cc2OCCCOc2c1,0 F6573-2767,O=C(Cc(c(F)ccc1)c1Cl)NCCOCCn1nccc1,0 F630-0887,COc(cc1)cc(NS(c2ccc(-c3nnc(C4CCC4)o3)s2)(=O)=O)c1OC,0 SB70-1092,COCCNC(c1nn(C[C@H](C2)NC(c(cc3)cnc3OC)=O)c2c1)=O,0 F6515-3514,O=C(Cc1cscc1)N(CC1)CC1n1nccn1,2 SA24-0122,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1cc(cccc2)c2[nH]1)=O,0 Z2195640614,O=C(CCc1nc2ccccc2cc1)N(CC1)CCN1C1CC1,2 Z1851614022,Cc1csc(C(NCC2CCN(CC#N)CC2)=O)c1Br,0 F6357-1135,O=C(c1c(C(F)(F)F)cccc1)NCC1(CC1)c1cscc1,0 Z3141928276,NC(C1)C1(C1)CC1NC(c1nccc(C(F)(F)F)c1)=O,2 Z3341637974,FC(C1(c2nn(Cc3noc4c3CCCC4)nn2)NCCC1)(F)F,2 F6507-9004,COC1(CNC(c(cc2)ccc2-c2cscc2)=O)CCSCC1,2 F6515-1387,CN(C=C(C(NCc1cc(-c2ccco2)ncc1)=O)C(c1cscc1)=C1)C1=O,2 S726-1538,O=C(C1CCCC1)N(CC1)CCC11OCCC(CCOc2cnccc2)C1,2 F2606-0063,O=C(Cc1csc2nc(-c(cc3)ccc3Cl)cn12)N(CC1)c2c1cccc2,0 Z4989108264,CC1(C)Oc2c(CC(NS(c3cc(Cl)cc4cccnc34)(=O)=O)=O)cccc2C1,2 V002-7284,CN(C(CN1CCC(NCc2ccco2)=O)=C(C(c(cccc2)c2OC)N2)C1=O)C2=O,2 D757-0271,O=C([C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1)N1CCN(CC(N2)=Nc(cccc3)c3C2=O)CC1,2 F1607-0168,Cn1ncc2c1N=CN(Cc(cccc1)c1C#N)C2=O,0 F6374-0291,Cc(c(S(N1CCC(CSc2ncccc2)CC1)(=O)=O)ccc1)c1Cl,0 P114-1574,CC(C)n1c(nccc2)c2c(C(CC2)=CCN2C(Nc(ccc(OC)c2)c2OC)=O)c1,0 Z3018910036,CC(C)(CNCC1)N1C(c1cc2cccn2cn1)=O,2 Z117858734,CC(C)c(cc1)ccc1-c1nc(CC(NCC(NCc2ccco2)=O)=O)cs1,2 F5860-0002,CC(C)Sc1ccc(CC(N2CCN(CC(F)(F)F)CC2)=O)cc1,0 Z2963000687,Cn1nc(C2CC2)cc1CNC([C@@H](c1ccccc1)OC)=O,2 Z2033163287,Cc1cc2c(C)ccnc2c(C(Nc2cc(C3CC3)nn2C(CC2)CS2(=O)=O)=O)c1,2 F6550-7495,O=C(NCc1cccc2ccccc12)N(CC1)CC1Nc1nccnc1,2 J093-0463,Cc(cc1)ccc1-c1nc2nc(C(NCC3OCCC3)=O)nn2c(C(F)(F)F)c1,2 F6482-2356,CC(N=CN1CC(NC2CC3OCCOC3CC2)=O)=CC1=O,2 Z4320922944,Cc1c(CN(C)C(C(C2)(c(cc(cc3)Cl)c3NC2=O)O)=O)cnn1C,2 F6747-5876,CC(C)c1nccn1CC(C1)CN1c(nccc1)c1OC,0 Z1158466248,NC(c(c(F)c1)cc(NC(c2cc(Cl)nc(N)c2)=O)c1F)=O,0 F6683-1279,Clc(cncc1)c1OCC(CC1)CCN1c1nc(C2CC2)ncc1,2 Z2953104492,CN(C)C(c(cc1)cnc1NC(NC[C@@H](C1)[C@H]1C(F)(F)F)=O)=O,0 Z2883145444,Cc1n[nH]cc1CNC(N1CCC(CC(O)=O)CCC1)=O,2 8014-7529,NC(CN(CC1)CCN1C(CC(N1c(cc2)ccc2C(O)=O)=O)C1=O)=O,0 F6454-0739,O=C(C1CC=CCC1)NCC1CCN(CC(F)(F)F)CC1,0 Z2952190975,O=C(Nc1cn(C2CCC2)nc1)Nc1ncc(C2CCOCC2)s1,2 S996-0221,Cc1c(CN2C[C@](CO)(CN(C3)S(C)(=O)=O)[C@H]3CC2)scn1,0 Z2207821535,C[C@H](CN(C)C(C[C@H](CCCC1)[C@@H]1O)=O)O,0 Z3467210883,CC(Cc1c2ccc(Cl)c1)(C(NCC1CC1)=O)OC2=O,2 F3277-0962,Cc(nc1SCCO)nc2c1oc1c2cccc1,0 F5655-1553,CC(c1cccc(NC(c2csc(-c3cc(cccc4)c4n3CCOC)n2)=O)c1)=O,2 F0866-0964,O=C(c1cc(Cl)cc(Cl)c1)Nc1nc(-c2cnccc2)cs1,2 Z1390072125,O=C(C1C(Cc2ccccc2)C1)Nc1cn(-c2ccncc2)nc1,2 Z4032826125,O=C(c(cc1)nc(N2CCCC2)c1Cl)Nc1csnc1,2 F6476-1626,O=S(c1cccs1)(N(CC1)CC1Oc(nccc1)c1Br)=O,2 F6471-7578,COc(cccc1)c1OCC(N(CC1)Cc2c1onc2)=O,2 Z1375009193,CC(N1CCC(CNC(Nc(cc2)ncc2Cl)=O)CC1)=O,2 S212-1173,C(c1ccco1)N(CCC1)CC1OCc1nc(-c2cnccc2)no1,2 P314-1167,CCOc(cc1)ccc1C(NC(CCN1c2cc(C)cc(C)c2)C1=O)=O,0 F6506-0478,Cc(cccc1)c1NC(NCC(c1cocc1)(c1ccco1)O)=O,2 Z2295935780,CC(C(O)=O)NC(c(cc1)ccc1NC(C1CC=CC1)=O)=O,0 Z3243100181,COC(c1c2nccc(N)n2nc1)=O,0 SA85-0642,OC(CN(Cc1ccccc1)C(C1)=O)CN1C(CN(c(cccc1)c1O1)C1=O)=O,2 Z2577936654,CC(C)NS(c(cc(c(Cl)c1)Cl)c1Br)(=O)=O,0 Z1527380404,CNS(c(cc1)cc2c1n(C)c(-c(cc1)ccc1OCCOC)n2)(=O)=O,0 Z1321365535,CC(N1CCC(CNC(Nc(cc(C)cn2)c2OC)=O)CC1)=O,0 F6252-1637,O=C(c1c(-c2ccncc2)n(Cc(cccc2)c2F)nn1)Nc1c(C(F)(F)F)cccc1,0 F6806-8091,CC(C)(C)NC(C(CC1)CN1c1nc2ccccc2c(C)c1)=O,0 T158-1067,Cc1cnc(C(CC2)CN2S(c2cn(C)cn2)(=O)=O)n1CCCOC,2 Z2234883940,CC(C)(c1nccs1)NC(Nc1c(C)nc(C)cc1C)=O,0 V013-1825,O=C(C(CC1=O)CN1c(cc1)ccc1F)NC(CCC1)c2c1cccc2,0 Z2970677865,Clc1cc(-c2nnc(N3CC(Cn4nncc4)CCC3)o2)ccc1,2 F6713-1897,Cc1cc(C)nn1C(C=C1)=NN(C(CC2)CCN2c(n2C)nc3c2nccc3)C1=O,2 Z437359268,CCC(N1CCC(CN2CCCC2)CC1)=O,0 CM4557-0364,CN(C1(CCOCC1)CN(Cc(cc1)cc(O)c1OC)C1)C1=O,0 F6416-9425,OC(CCNC(NCc(cc1)ccc1F)=O)c1cccc(Cl)c1,0 Z1217204854,CCC(CC1)CCN1c(nc1)cnc1C(O)=O,0 H025-1002C,Cc(cc1)cc2c1n(CCc1ncccc1)c1c2CN(CCc2ccncc2)CC1,2 G883-0803,O=C(CN1c(cc(cc2)Cl)c2OCC1=O)NCc(cc1)cc(CC2)c1N2C(c(cc1)ccc1F)=O,0 Z1603684487,CC(COC)(C(O)=O)NC(c1cnccc1)=O,0 F325-0052,CCN(c1ccccc1)S(c(cc1)cc(CC2)c1N2C(CCC(N1CCCC1)=O)=O)(=O)=O,2 Z1683297803,CC(C)(c1nc(Cc(cccc2)c2Br)no1)NS(C)(=O)=O,0 4239-0820,Cc(cc1)cc(NC(CCN2CCCCC2)=O)c1OC,0 F6436-3032,Cc1noc(C)c1CCC(NCC(c1ccc(C(F)(F)F)cc1)O)=O,0 F6680-8768,Cc1ccc(C(N2CC(COc3cc(C)ncc3)CCC2)=O)s1,2 F6514-2904,COC(c(cccc1)c1C(N(C1)CC1OCC(F)(F)F)=O)=O,0 Z2207138295,CCOC(C)(CC1)CCN1C(Cc1csc(-c2cc(C(F)(F)F)ccc2)n1)=O,0 F1626-0005,O=C(COc1ccccc1)NCCc1nc(cccc2)c2[nH]1,2 Z2656274894,CC(C(N1Cc2cccc(C(O)=O)c2CC1)=O)c1c(C)n(C)nc1C,0 F6802-6070,CN(C(CC1)CCN1c1nc(C#N)ccn1)S(C1CC1)(=O)=O,0 Y020-4265,Cc(n(c(nc1)n2)nc2SCc2ccccc2)c1-c1nc(N2CCCC2)ncc1,2 F6482-2161,COc(ccc(CCC(NC1CC2OCCOC2CC1)=O)c1)c1OCc1ccccc1,2 8020-8434,CC(O1)=CC(O)=C(C(CC(Nc(cc2)ccc2OC(F)(F)F)=O)c(cc2)cc(O)c2OC)C1=O,0 F6194-0112,CC(Cc1ccco1)(CNC(c(cc1)ccc1C(OC)=O)=O)O,0 Y200-5401,O=S(c1cccc2nonc12)(N(CC1)CCN1c1ccccc1)=O,0 Z1933174883,O=C(CN(C=Cc1c2cccc1)C2=O)Nc1c[nH]nc1-c1nccs1,2 Z2296077260,OC([C@H](CN(C1)C(c2c3OCCOc3ccc2)=O)[C@H]1c1ccccc1)=O,2 F6497-1901,O=C(CSCc1ccccc1)N1CC(Cc2nc(-c3cscc3)no2)CCC1,2 SB94-0879,Cn1c(C(N2CCC(CN(CC(C3)C(NCC4CC4)=O)C3=O)CC2)=O)ncc1,2 Z3244744534,COc1cc(Br)c(CNCC2)c2c1,0 Z3556531381,CS(CCCNc1ncnc2c1SCCC2)(=O)=O,2 Z1247116935,O=C(c(o1)ccc1Cl)N1Cc2nnc(C(F)(F)F)n2CC1,0 F6672-0533,CC(N(C(CC1)C2)C1CC2n1ncc(Br)c1)=O,0 F6442-1688,CC(C)CS(C(C1)CN1C(c(cc1)ccc1S(N1CCOCC1)(=O)=O)=O)(=O)=O,2 Z2008661381,Cc(n1C)nnc1N(CCC1)CC1Nc1ccccc1,0 F6357-0724,CCS(NCC1(CCCC1)c1cscc1)(=O)=O,0 F6451-2850,COC(CNC(CCc(cc1)ccc1S(C)(=O)=O)=O)c(cccc1)c1Cl,0 F6574-0603,O=C(c1c(C(F)(F)F)cccc1)N(CC1)CCC1Oc1nncs1,0 Y203-3725,Cn1nc(C(NCc2ccco2)=O)c(NC(C(CCCC2)C2C(O)=O)=O)c1,2 Z2218223197,C(c1c(C2)n(-c3ccccc3)nc1)N2c1ncnc2c1[nH]cn2,2 F6519-7923,COc(cc1)cc(C(NCC(c2cscc2)n2nccc2)=O)c1Br,0 F3316-0044,CC(Cn1nc(C)nc1C)C(Nc(cc(cc1)Cl)c1OC)=O,0 F5033-1452,Cc1cc(CN2CCC(CNC(Nc3cccs3)=O)CC2)c(C)o1,2 Z2437483580,OC(C(CC1)CCN1S(NCc1ccc(C(F)F)cc1)(=O)=O)=O,0 Z4464308219,CC(N[C@@H]1[C@@H](C2)[C@H]1CN2c1cc(C2CC2)nc(S(C)(=O)=O)n1)=O,2 F6521-9490,Cc(onc1)c1C(NCC(C1)(Cc2c1cccc2)OC)=O,2 Z1696978369,COc(cc(CCC(N1)=O)c1c1)c1NS(c(ccc(F)c1)c1F)(=O)=O,0 E667-0320,CSc1cccc(NS(c(cc2)cc3c2[nH]c2c3CCCC2)(=O)=O)c1,0 F5857-2703,CCOc(cccc1)c1C(NCC(C)(c(cc1)ccc1-c1ccccc1)O)=O,0 Z1457989269,CC(N(CCC1)CC1C(Nc(c(N(C)C)ncn1)c1OC)=O)=O,2 T500-2206,O=C(c1n[nH]c(C2CC2)c1)N1CCC(CN(CC2)CCC22OCCCC2)CC1,2 F6496-3494,O=C(c1cc(-n2nccc2)ccc1)N1CCC(CN(C(C=C2)=O)N=C2c2ccccc2)CC1,2 F6300-0158,O=C(c(cccc1)c1Br)Nc1conc1,0 Z3487124547,CC(C)C(C1)(C1C(Nc(cc1OC)cc(OC)c1Cl)=O)C([O-])=O,0 Z2272099865,C(CC1)CC1(C1)OCCC1Nc1nc(-c2nccnc2)ccn1,2 Z4629383617,[O-]C(C(CC(C1)O)N1C(c(scc1)c1Br)=O)=O,0 F6752-3522,N#Cc1cccc(N(CCC2)CC2NC(C2CC2)=O)n1,0 F6561-1610,O=S(c(cccc1)c1F)(NCc1cncc(-c2ccco2)c1)=O,0 S926-7842,O=S(c1cc(CCC2)c2cc1)(N(CCC1)CC1OCc1noc(-c2ccncc2)n1)=O,2 Z3063544591,O=C(c1nccnc1)N1Cc2cc(C(F)(F)F)cnc2CC1,2 F6525-2119,CN(CC(NCc1cc(-c2nccnc2)nn1C)=O)S(C)(=O)=O,0 Z2183596129,CC(C)(CNC(NCc1nc([nH]cc2)c2cc1)=O)CN1CCCC1,2 F6775-2409,Cc1cncc(N2CC(COc3nccnc3)CCC2)n1,2 Z1517691504,O=C([C@@H]1OCCC1)Nc1n[nH]c(C2C(CC3)CC3C2)c1,0 Z2641878317,CC(C)(CC1c2ccccc2)CN1C(c1cc2ncnc(N)c2cc1)=O,2 SA50-0950,Cn(c(C1)c2CN1C(NCCc1ccccc1)=O)nc2-c1nc(C2CCOCC2)no1,2 Z2966757067,C[C@@H](C(NCCC1)=O)N1C(c(cc1)ncc1Oc1cc(C)ccc1)=O,2 F3293-0135,O=C(COC(c1c(CCC2)c2nc2ccccc12)=O)c(cc1)ccc1F,2 Z1348312664,O=C(Nc1c2cccc1)N(CCC1CCCC1)S2(=O)=O,2 E864-0431,COc(ccc(NC(N(CCc1c2[nH]c(cc3)c1cc3Cl)C2c(cc1)ccc1F)=O)c1)c1OC,0 T202-0839,COc1cc(OC)c(CN2Cc3cc(-c(cc4)cc(OC)c4OC)nn3CCC2)cc1,0 SA01-1013,Cc1noc(C)c1C(N(CC1)CC1c(nc(N(C)C)nc1)c1C(NCCOC)=O)=O,2 F6668-2963,CC(C)(C)OC(N(C1)CC1N(C(C)=Nc1c2cccn1)C2=O)=O,2 F6523-1846,O=C(Cc1cscc1)NC(CC1)CCN1c1n[nH]c(C2CC2)c1,2 F6445-2772,Cc(c(S(N(CC1)c(cc2)c1cc2-c1ccncc1)(=O)=O)ccc1)c1Cl,0 F6443-4107,CC(Nc1ccc(CC(N(CC2)CCC2(c2c3cccc2)OC3=O)=O)cc1)=O,2 Z2996027769,CC(C)n1ncc(S(N(CC2)c3c2c(C(O)=O)ccc3)(=O)=O)c1,0 Z1734048484,CC1(CCN(Cc2ccccc2)CC1)C(NCC1(CCOCC1)C(N)=O)=O,2 F6685-9075,Cc1nc(n(C)nc2)c2c(N2CC(COc(nccc3)c3Cl)CCC2)n1,0 G410-0004,Cc1cc(C)nn1-c(c1ccccc11)nnc1N(CC1)CCN1c1cccc(OC)c1,0 Z4029804145,Cc1nc(-c2ccc(C)cc2)c(CC(N(C2)[C@@H](CN)C[C@H]2O)=O)s1,0 Z941072234,Cc1nccn1-c1ncc(CNC(Nc2cccc(CS(C)(=O)=O)c2)=O)cc1,0 Z1616262720,CCC(N1)=CC(C(N2CCC(CNC(c3cn(C)nc3)=O)CC2)=O)=CC1=O,2 Z1302595831,CCNC(c1cccc2cnccc12)=O,0 F069-1537,CCCCNC(C(C)N(c(cc(C)c(C)c1)c1N=C1C(F)(F)F)C1=O)=O,0 D715-0900,CC(C(C#N)=C1N2c(cccc3)c3N1)=C(CCC(Nc(cc1)cc3c1OCCO3)=O)C2=O,2 C488-0881,Cc1cn2c(Nc(cc3)cc4c3OCCO4)c(-c(cc(cc3)Br)c3F)nc2cc1,0 F926-1463,CC(C)NC(N(CCC1)CC1c1cccc(C(NCCCN(CCC2)C2=O)=O)c1)=O,2 F5882-5199,Cn1c(cccc2)c2c(CC(N(CC2)CCN2S(C2CC2)(=O)=O)=O)c1,2 SB59-0153,CCn1nccc1C(N(C1)CC1(CN(C1)S(C)(=O)=O)C1c1nncn1C)=O,0 Z1546979992,CCC(CO)(CC1)CCN1c1nccc(-c2nc(C(C)C)no2)c1,0 SA24-0246,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(CCc1c[nH]c2c1cccc2)=O,0 8137-0506,Cc1cc(NC(CC2SCCNC2=O)=O)c(C)cc1,0 F6571-5850,CC(Cc1csc2c1cccc2)NC(c1c(C)n(C)nc1C)=O,0 F6483-0225,CS(N(CC1)CCC1C(NC(CC1)CCC1Oc1ncccc1)=O)(=O)=O,2 8017-8493,Cc(cc(c(N1C)c2)N(C)C1=O)c2S(Nc1cc(NC(CC2)=O)c2cc1)(=O)=O,2 E196-0245,O=C(CSC(N1CCc2c[nH]c3c2cccc3)=Nc2nccnc2C1=O)NCCc1ccccc1,2 F6724-3144,C(CN(CC1)CCC1c1cccs1)Nc1ncnc2ncccc12,2 F6525-5658,O=C(c(cc1)ccc1OC(F)(F)F)NCCn1ncc(-c2ccncc2)c1,0 Z2219022763,CC(C)CC(c1ccccc1)NCc1cccc(O)c1Cl,0 S903-0231,CC1(CC1)C(N1Cc2nnc(C(CC3)CCN3C(N(C)C)=O)n2CC1)=O,0 F1727-0274,C(C#Cc1ccccc1)N1CCN(CC#Cc2ccccc2)CC1,2 Z2701195193,CC(c(cc1)cnc1N1Cc2c(C(F)(F)F)cccc2CC1)=O,0 Z1824611082,CC(N(C1)CC1C(Nc1n[nH]c(-c(s2)ccc2Cl)c1)=O)=O,2 V011-0316,CC(C)(C)c(cc1)ccc1C(Nc(cc1C)nn1-c(cc1)ccc1Cl)=O,0 F6660-0561,Cc1nnc2n1c(cccc1)c1nc2SCc(cc1)ccc1F,2 SA58-0666,CC1(CC1)C(N1C(CCc2noc(-c3ccncc3)n2)CCC1)=O,2 F6560-4431,CC(C)C(Cn1ncnc1)NC(Nc1ccc(C(C)(C)C)cc1)=O,0 Z65823184,Cn1c(SCC(O)=O)nnc1-c1cnccc1,2 F3394-1333,O=S(c(cccc1)c1F)(Nc(cc1)ccc1F)=O,0 D264-0578,O=C(NCC1CCN(Cc(cc2)ccc2Cl)CC1)Nc(cc1)cc2c1OCCO2,2 F0877-0163,Cc(cc1)ccc1C(CC1c(cccc2)c2F)=NN1C(c1cnccc1)=O,2 Z3687067563,COc1ccc(c(C(N[C@@H](CC(Cn2cncc2)C2)[C@H]2O)=O)ccn2)c2c1,2 F6750-6311,Cc1nc2ccccc2nc1N(CC1)CCN1c1nc(-c2cn(C)nc2)cnc1,2 F6494-0965,CCOc1cc(C(NCCc2cccs2)=O)ncn1,2 SC74-1480,CNC([C@H](C[C@H]1c2nc(-c3ccccc3)no2)C[C@@H]1NC(c1nccn1C)=O)=O,2 Z1124047553,CCN(CC)C(c(cc1)ccc1C(Nc1cn(Cc2ccccc2)nc1)=O)=O,2 SC12-0018,O=C(C1CCC1)N(CCCN(CC1)Cc2c1cccc2)C1CCOCC1,2 G945-0609,O=C(c1ccco1)NCc1nc(-c(cc2)cc3c2n(C2CCCC2)cn3)no1,2 Y041-5914,Cc(c1c2)coc1c(C)c(O1)c2C(C)=C(CC(NCC2C(CCCC3)N3CCC2)=O)C1=O,2 F6438-2585,CN(C)c(nc(N1CCCCC1)nc1)c1NS(c(cccc1)c1Cl)(=O)=O,0 F6554-4621,CC(C)n1cnc(S(N2Cc(cc(cc3)F)c3OCC2)(=O)=O)c1,2 S976-1498,O=C(Cc(cccc1)c1F)N(CCC1)CC1(C(NCc1ccncc1)=O)F,2 F6445-6208,O=C(c(cc1)ccc1F)c(cccc1)c1C(N(CC1)Cc2c1ncnc2)=O,2 F223-0453,CC(Nc1nc(ccc(CC(N(CC2)CCN2c(cc2)ccc2F)=O)c2)c2s1)=O,0 Z2807206313,CC(C(N(CC(N)=O)c1ccccc1)=O)n1nc(C(F)(F)F)cc1,0 F6436-1144,COc(cc(cc1)NC(c2cc(cccc3)c3s2)=O)c1N(CCC1)C1=O,2 M715-0141,O=C(c(cc1)ccc1-c(cc1)cnc1N1CCCCC1)NCc1ccco1,2 F1142-3226,Cc(cc1)ccc1-c(c1ccccc11)nnc1NCCCN(C)C,0 T368-3397,CCCS(N(CC1)CC1n1c(-c2ccc(C)cc2)nc2cccnc12)(=O)=O,0 F2660-0109,O=C(C(NCc(cc1)cc2c1OCO2)=O)NCC(c1ccco1)N(CC1)Cc2c1cccc2,2 SD62-0098,O=C(CCC(C1)C2(CCC2)CN1C(c1n[nH]c-2c1CCc1c2cccc1)=O)N1CCOCC1,2 F6125-2197,O=C(C(C1)CN1C(c(cc1)cc2c1OCO2)=O)N1CCC(Cc2ccccc2)CC1,2 Z2410666631,Cc(oc(Br)c1)c1C(NS(C1[C@@H](CC2)C[C@@H]2C1)(=O)=O)=O,2 F5852-1788,COc(cc1)cc(OC)c1NC(C(NCc(cc1)ccc1OCc1ccccc1)=O)=O,0 F5630-0025,Cc1nc(NCCNC(C2OCCC2)=O)nc(N2CCCCC2)c1,2 F6445-6718,CCCn(c(C(NCc(cccc1)c1-c1cscc1)=O)c1)c(N=C2N3C=CC=C2)c1C3=O,2 F6556-6448,O=S(CCc1ccccc1)(N(CCC1)CCN1C1CSCC1)=O,2 F994-0109,CN(c(c(C(N1C)=O)c2)nn2S(c2cccc3nsnc23)(=O)=O)C1=O,2 8017-1148,CC(CCc(cc1)ccc1OC)(C#CCN(CCCC1)C1c1cnccc1)O,2 F1907-2483,CC(C)(C)OC(N(CC1)CCC1c1n[nH]c(C(OC)=O)c1)=O,0 F6571-6196,OC1(CNS(c(cc2)ccc2-n2nccc2)(=O)=O)C=CCCC1,2 F6564-3826,CC(C(NCCN(C(C=C1)=O)N=C1n1nccc1)=O)N1N=C(C2CC2)C=CC1=O,2 L680-0272,Cc(cc1)cc(C)c1S(N1CCN(Cc(n2-c3cc(C)cc(C)c3)nc3c2nccc3)CC1)(=O)=O,0 Z3357322155,CCCC[C@@H](C)C(NS(c1cn(C)c(C)n1)(=O)=O)=O,0 P657-0967,Cc1ccc(CNS(c2ccc(-c3nnc(C4CCCC4)o3)o2)(=O)=O)cc1,2 Z236-0001,CC(c(cc1)ccc1N(CC1)CCN1C(CCC(Nc1nnc2n1cccc2)=O)=O)=O,2 F6161-0249,O=C(C(Oc1c2cccc1)=CC2=O)NCCN(C=NC(c1ccccc1)=C1)C1=O,2 F6562-8597,COC(c(cc1)cc(S(NCC2c(cccc3)c3OC2)(=O)=O)c1OC)=O,0 SD22-1237,COC1(CC1)C(C1)(CN1C(COc(cc1)ccc1OC)=O)NC(C1CCCC1)=O,2 Z3687063416,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NC(COCc1cnccc1)=O,2 Z2317463186,CN(C1CC1)S(c(cc1)ccc1NC(c1cc(Cl)cnc1)=O)(=O)=O,2 F2864-0031,NC(C(C1)N(C(NCc2cccs2)=O)c2c1cccc2)=O,2 V003-1629,COc(cc1)ccc1-c1cnc(-c2ccc(CNC(C3=Cc(cc(cc4)Cl)c4OC3)=O)cc2)[nH]1,0 Z2782680414,CC(C(NS(c1c(COC)cccc1)(=O)=O)=O)n1nc(C(F)(F)F)cc1,0 Z3141925471,Cn(cc1)nc1-c1cc(C(NC(C2)CC2(C2)C2N)=O)no1,2 Z872365788,CC(C)CC(N(CC1)CCC1NC(c1cccc2cccnc12)=O)=O,2 Z2485828359,CCOc1ccc(CNC(C2=CN(C)C(C)=CC2=O)=O)cc1,0 Z4180225402,COc1cc(C(CNC(c2cccc(S(N(CCN3)CC3=O)(=O)=O)c2)=O)O)cc(OC)c1,2 F6683-1693,Cc1cccc(CC(N2CCC(COc3c(C)cncc3)CC2)=O)c1,0 Z2221836639,O=S1(CC(Cc2nc(-c(cccc3)c3F)no2)CCC1)=O,0 F403-0163,Cc(c(C)c1)cc(N2CC(Nc(ccc(OC)c3)c3OC)=O)c1N=C(CCC1)C1C2=O,0 F6153-0077,O=C(c1c(C(F)(F)F)cccc1)Nc1nnc(C(CC2=O)CN2c2ccccc2)o1,0 D389-0838,CCN(C(c(n1CCC2)c(N3C)nc1N2C1CCCCC1)=O)C3=O,0 F6225-0999,Cc1c2nc(N(C)CC(NCCN(C(C=C3)=O)N=C3c3ccco3)=O)sc2c(C)cc1,2 F2493-1711,O=C(c1c(C(F)(F)F)cccc1)NCc1noc(-c2cc(cccc3)c3o2)c1,0 F6403-1429,CCN(Cc1cnc2n1cccc2)C(Nc1c(C(F)(F)F)cccc1)=O,2 Z1307108830,OC(CCC1)CN1C(NC(CCC1)CN1c(cccc1)c1Cl)=O,0 Z2999405894,CCO[C@@H](COC1)[C@H]1n1nnc(C(N(C2CC2)c2ccccc2)=O)c1,2 Z1230400157,CC(C(N(C)Cc1cccc(F)c1)=O)N(CC1)CCC1c1c[nH]c2c1cccn2,0 F145-0197,COc1cc(NC(CCC(N2)=Nc(sc3c4CCCC3)c4C2=O)=O)cc(OC)c1,2 Z1955805131,CC(C1)CN1C(c1nc(C)ns1)=O,2 S544-0701,Cn1cnc(S(N2CC(CCOc(cccc3)c3OC)CC2)(=O)=O)c1,0 Z2438952216,O=C(CC1CCNCC1)N(CC1)c(cc2)c1cc2-c1ccccc1,2 Z5003680074,OCC(CCc1ccncc1)NC(c(nc1)cn2c1nnc2)=O,2 F6245-5880,CN(C(C(F)(F)F)=NN1CCNC(CN(c(cccc2)c2O2)C2=O)=O)C1=O,2 Z2034716341,CN(C(CC1NS(c(cccc2)c2OC)(=O)=O)=O)C1=O,0 SB69-0570,O=C(c1nn(C[C@H](C2)Oc3ccncc3)c2c1)N(CC1)c2c1cccc2,2 G373-2347,Cc(cc1)ccc1-c1nc2cccnc2n1CCCNS(c1cc(CCCC2)c2cc1)(=O)=O,2 Z2280178905,CC(CC(F)(F)F)(C1)CN1S(c1c(C)oc(C)c1)(=O)=O,0 F6485-0317,O=C(c1noc2c1CCCC2)NC(CC1)CCC1Oc1ncccn1,2 Y041-5207,CC(C)C(C(O)=O)NC(C(CCC1)CN1S(c1ccccc1)(=O)=O)=O,0 L815-0068,COc(ccc(CC(NCC(N(CCC1)c2c1cccc2)=O)=O)c1)c1OC,0 Z2965708213,CC(CN(CC1)C(c2nn(cccn3)c3n2)=O)N1c1ccccc1,2 G935-0432,Cc1csc(NC(C(CC2)CCN2S(c2c(C)n(CC(N3CCCC3)=O)nc2C)(=O)=O)=O)n1,2 F6516-1652,O=C(c1nc(cccc2)c2s1)NCc1ccc(-c2cocc2)o1,2 F6471-2625,O=C(CNS(c1cccc(Cl)c1)(=O)=O)N1C2C=CCC1CC2,2 S646-0165,Fc1c(CN(CC2)CCC2N(CC23CCCCC3)C2c2ccccc2)ccnc1,2 SB21-1042,Cc(nc1)cnc1C(N(C1)[C@H](Cn2nnc(C(N(C)C)=O)c2)C[C@@H]1F)=O,0 SB70-0717,CC(C)NC(c1nn(C[C@H](C2)NS(Cc(cc3)ccc3Cl)(=O)=O)c2c1)=O,2 Z2982132511,Oc(c(C=NN1C(CC2)CCS2(=O)=O)c2C1=O)ccc2F,2 Z2614210116,CCn1c(ncnc2NCc3ccc(CNC(C)=O)cc3)c2nc1,0 Z2909995423,OC(C(CC1)(CC2)CCC12C(NCCS(c1ccccc1)=O)=O)=O,2 F6412-2248,O=C(C(CC1=O)CN1c(cc1)ccc1F)NCC#CCOc(cc1)cc2c1OCO2,2 S530-0183,CC(C)C(N1Cc(cccc2)c2OC(CC2)(CCN2C(C)C)C1)=O,0 Z1890986844,C1Oc(cc(cc2)-c3nc(-c4nc(-c5cocn5)no4)cs3)c2O1,2 Z2207116567,CC(N(CC1)CCC1c(cc1)c(C)cc1F)=O,0 4514-1995,OC(C1NC(c(cc2)cc3c2OCO3)SC1)=O,2 F6353-3293,CN(C)C(CNS(CCc(cc1)ccc1OC)(=O)=O)c(cc1)cc2c1OCC2,0 Z2032638154,O=C(c1cc(Cc2ccccc2)n[nH]1)NC(CC1)CCN1c1ccccc1,2 Z2950557214,O=C(NC(C1CCCC1)C(F)(F)F)N[C@@](C1)(CCCC2)[C@H]2NC1=O,2 F6559-6789,O=C(c1c(CCCC2)c2no1)NC(CC1)CCN1c1cc(C(F)(F)F)ncn1,2 Z2203746764,CC(c1c(C)nc(C)s1)N(C)C(c1cn(C)nc1C(C)(C)C)=O,0 Z4250199242,OC(CC1)(CCN1C(C1CC1)=O)C1(CC1)C(O)=O,2 F6445-1384,O=C(C1(CCCC1)c1cccs1)NC(CC1)CN1c1nccs1,2 Z2236915338,CC(C1C)NCCN1S(c(s1)cc(C)c1Cl)(=O)=O,0 Z2347879208,C[C@@H](c1cncc(F)c1)Nc1c(c(C)c(C)s2)c2nc(C)n1,2 F6708-8331,O=C(CN(c(cccc1)c1O1)C1=O)N1CC(C2)(CC2c2ccccc2)C1,2 F6726-0474,Cc1cc(C)nn1-c1cc(OCC(CC2)CCN2C(c2c(C)ncs2)=O)ncn1,2 Z4688802062,CN(C)c(nc1)c(CN(CC2)C(C(c3ccccc3)SC)=O)c2c1Br,2 Z1993536902,Cc([nH]nc1)c1S(N(CCCCCC1)C1C(O)=O)(=O)=O,2 F1837-0148,CCc(s1)ccc1S(NCc1cn(cccc2C)c2n1)(=O)=O,2 SA18-0481,CN(Cc1cn(-c2ccccc2)nc1)C(c1cn(CCN(CC2CC2)C2=O)c2n1)=O,2 4721-0320,O=C(C(Nc(cccc1)c1Cl)=O)NCCCN1CCOCC1,0 F2616-0662,CCc(cc1)ccc1NC(C(NCc1cc(OC)ccc1)=O)=O,0 F6544-1432,CCS(N(CC1)CCN1c1nccn1C)(=O)=O,0 Z53825227,COCCNS(c(cc1)cc2c1OCCO2)(=O)=O,0 F1876-0932,CC(C(C(N(C)C)=O)N(C=Nc1c2nnn1-c1cc(C)c(C)cc1)C2=O)=O,0 Z3299507490,C[C@H](C(N(C)CCN(C)c1nc(Oc2ccccc2)ccn1)=O)c1ccccc1,2 S926-0769,Cc1nc(COC(CCC2)CN2C(C2(CC2)c(cc2)ccc2OC)=O)no1,2 Z3366492617,C[C@H]1N(Cc2ccccc2)[C@@](CNCc2cocn2)(CO)COC1,0 F2004-0117,O=C(CSc(cc1)nnc1-c1cccs1)N(CC1)c2c1cccc2,2 Z1871776163,CCn1ncc(CC(NC(Cc2nc(C)no2)c2ccccc2)=O)c1,0 Z4971742027,CC(C)c1cccc(S(Nc(cc2)cc3c2[nH]c(C(N)=O)c3)(=O)=O)c1,0 Z3278112672,Cc1nc(-c2noc(C(CNC3)C33CCCCC3)n2)co1,2 F6677-3189,FC(c1nnc(cc2)n1nc2N1CC(Cn2ncc(Cl)c2)C1)(F)F,0 T149-1310,OC(C1n2c(-c3ccncc3)nnc2CCCC1)=O,2 Z2937199003,CCN(CCCC(O)=O)C(c1c(C)ccc(C)c1)=O,0 F5260-0088,Cn1c(C(CNC(COc(ccc(Cl)c2)c2Cl)=O)N2CCCC2)ccc1,2 Z2348248718,CC1OC(C)C(CNc2nc(C)nc(-c3ncccc3)c2)C1,2 SA99-0816,NC(C(CC1CC1)(CC1)CCN1C(CC1)CCN1C(Nc(cc(cc1)F)c1F)=O)=O,0 F5060-0139,CCn1nnc2c1N=CN(CC(N1CCC(C)CC1)=O)C2=O,2 F6415-0191,CN(C)S(c(cc1)ccc1C(N(CCOC)Cc1cocc1)=O)(=O)=O,0 F6178-8076,CCSc(cccc1)c1C(NCC(CC1)CCN1c1nccnc1C#N)=O,0 Z1953218296,CC(C)n(cc1)nc1C(N(CC1)CCN1c1cncc2ccccc12)=O,2 Z1752495109,O=C(NCc(cc1)ccc1-c1cnccc1)N(CC1)CC1(c(cccc1)c1N1)C1=O,2 G870-0200,COc(cc1)ccc1-c(cc1)nnc1OCCNC(C1CCCCC1)=O,2 D470-2270,CCOc(cc1)ccc1S([C@@H](CS(C1)(=O)=O)[C@H]1NCCC1=CCCCC1)(=O)=O,2 Y042-7642,c1(nc2c(n1C)cccc2)[C@@H](NC(=O)COc1cc2c(\C(=C/C(O2)=O)\C)cc1Cl)C(C)C,0 G856-1568,Brc(cc1)ccc1-c1nnc2sc(CN(CC3)CCN3C(c3ccccc3)c3ccccc3)cn12,2 Z2111582984,CCc(cc(cc1)NC(N2CCC(C)(CO)CC2)=O)c1F,0 Z2953880920,Cn(c(C(F)F)c1)nc1C(N1Cc2nnc(C3CC3)n2CC1)=O,2 Z4444622067,Cn1c(cccc2)c2nc1C(c1ccccc1)NC(Cc1cnnn1C)=O,2 Z4774178448,CC(CC1)CCN1S(c1ccc(C(N2C3CC(C4)CC2CC4C3)=O)s1)(=O)=O,2 F2244-0129,Cc(cc1NC(c2cccs2)=O)nn1-c1ncnc2c1cnn2-c1ccccc1,2 Z3347744196,Cc1ccc(CN(CC2)CCC2c2nc(CC(O)=O)cs2)o1,0 Z2045663736,Fc(ccc(N1CCN(Cc2ncccn2)CCC1)c1)c1F,2 V029-5725,O=C(c1cc(cc(cc2)NC(c3ccco3)=O)c2[nH]1)NCCc1ncccc1,2 F6445-6837,O=C(Cc1c[nH]c2c1cccc2)NCc(cccc1)c1-c1cscc1,2 F6525-1854,Cc(cc1)c(C)cc1NC(NCCn(c(C1CC1)c1)nc1-c1nccnc1)=O,2 SA01-1194,CC(C)NC(c1c(C(CC2)CN2C(C2CC=CC2)=O)nc(N(C)C)nc1)=O,2 S988-0438,CCS(N(C[C@@H]1CN(C2)C(c3c(C)ccnc3)=O)C[C@@]12c1nc(C)no1)(=O)=O,0 F0478-0028,O=C(CN1CCN(CCN(C(c2c3c4cccc3ccc2)=O)C4=O)CC1)c(cc1)ccc1F,2 S700-0725,Cn1ncc(C(N(C2)CC2c2nc(CCOCC3CC3)no2)=O)c1,2 Z3063544829,CC(C(Nc1nn(CCN(C)C2=O)c2c1)=O)c1cccc(F)c1,2 Z4872913927,CCOC(c1c(C)nc(NC(N(C(CC2)C3)C2CC3=O)=O)s1)=O,2 SA87-1047,COc(cc1)cc(NC(NCC(CN2CCc3ccccc3)OCC2=O)=O)c1OC,2 F5857-2131,COc(ccc(Cl)c1)c1S(NCC(C1CC1)(c1cccs1)O)(=O)=O,2 Z1167190991,Cc1nc(C(N(C(CC2)C(Nc3ccccc3)=O)c3c2cccc3)=O)nn1-c1ccccc1,0 S661-1162,CCN(C(C(C1)N2CC1(CC1)CCN1C(COc1ccccc1)=O)=O)C2=O,0 F6473-8218,CC(O1)=CC(OC(CC2)CCN2C(c(cccn2)c2OC)=O)=CC1=O,0 F926-1018,O=C(c1cc(C(CCC2)CN2C(Nc2ccccc2)=O)ccc1)NCc1cccc(Br)c1,2 Z2296024674,COc(ccc(C(C(O)=O)NC(CC1CCOCC1)=O)c1)c1Cl,0 D470-1875,Cc(cc1)ccc1S([C@@H](CS(C1)(=O)=O)[C@H]1N1CCN(C/C=C/c2ccccc2)CC1)(=O)=O,2 Z1668885209,Cc1cc(C(CC2)NC(c3cnc4[nH]nnc4c3)=O)c2cc1,2 C172-0194,CC(CCc1ccccc1)NC(C1CCC(CN(C(c(scc2)c2N2)=O)C2=O)CC1)=O,0 Z1655197965,CC(CC1)CCN1c(cc1)ccc1NC(C(N(CCC1)CC1C1(C)OCCO1)=O)=O,2 Z2595690235,CC(CC(NCc1c(C(O)=O)occ1)=O)c1c(C)cccc1,0 F6523-3315,Cn(cc1C(NCCN(Cc(cc(cc2)Cl)c2OC2)C2=O)=O)nc1OC,0 Z1233537697,O=C(CCc1ccnc2ccccc12)NC1CC1,2 Z1480913670,O=C(C1=CN=C2SCCN2C1=O)NOCc1ccc(C(F)(F)F)cc1,2 SA69-0375,CC(CCC1)(CN1C(c1c(C)ccs1)=O)c1noc(C2CCOCC2)n1,2 Z735919936,CCOC(c1c(C)c(C(NC(C(C)NC(C)c(cccc2)c2OC(C)C)=N2)=O)c2s1)=O,2 Z3389996922,CCCN(Cc(cc1)c(C)cc1F)C([C@H](CC1)C[C@H]1C(O)=O)=O,0 Z2982749995,C[C@H]1O[C@@H](C)CN(Cc2cn(C3COC3)nn2)C1,0 Y020-6132,COc(cc1)cc(NC(CC2NC(CCCC3)C3NC2=O)=O)c1OC,0 Z1930839341,CC(C)n(c(NC(N(C1)CC(C)(C)C1O)=O)c1)nc1-c1ccccc1,2 S613-1084,O=C(Nc(cc1)cc2c1OCCO2)N(CCC1)C1c1nc(CCOCC2CCCC2)no1,2 K784-4620,CC(CCC1)C(C)C1NC(c1cc(-c2ccccc2)nc2ccccc12)=O,0 J500-0417,CC(C)NC(C(C1)C2(CCCC2)CN1C(c1cnco1)=O)=O,0 Z1197799487,Cc1ccc(-c2n[nH]c(-c3nc(-c4ccncc4)no3)c2)o1,2 Z4954144008,O=C(CN(CC1)CCN1C(CC1)CN1C(c1nn(cccn2)c2c1)=O)N1CCC1,2 P244-0362,CC(C)CCNC(CC(c(nccc1)c1C1=O)N1c1ccc(C)cc1)=O,2 F6752-3685,Cc1nnc(CN(CCC2)CC2NC(C2CC2)=O)n1C,2 F5521-0198,Cc(cc1)cc(NC(CCC(C(N2C)=O)=C(C)NC2=O)=O)c1OC,0 L289-0078,O=C(C1Oc(cccc2)c2NC1=O)Nc(ccc(Br)c1)c1F,0 Z2378679658,CC(C)(C(Nc1ncc(C2CCNCC2)s1)=O)c1ccccc1,2 Z1102335856,COc1cccc(-n2nnc(CNC(c3cscn3)=O)c2)c1,2 SB96-0052,Cc1c(C(N(CC2)CC2N(CCn2c(C)ncc2)S(C)(=O)=O)=O)sc(C)n1,2 Z2974617741,CN(C1CN(Cc2cnc3n2CCOC3)CC1)c1ccccc1,2 F6363-0809,CC(N(CC1)CCN1c1ncnc(Nc2ncccc2)c1)=O,0 Z2231337998,CC(C)CC(C(NCCC1)=O)N1C(CC1SC(N)=NC1=O)=O,2 P664-1917,CCCc1cc(N(CC2)CCN2C(C(C)c2ccccc2)=O)nc2nnc(CC)n12,0 G586-0166,Cc1ccc2nc3sc(C(NCCCN(CC4)CCN4c(cc4)ccc4F)=O)cc3cc2c1,2 Z2439898948,NCC(CC1)CCN1C(c1c(C(F)(F)F)n(-c(cccc2)c2F)nc1)=O,0 E203-1496,CC(CC1)CCN1C(C(CCC1)CN1S(c(cc1)cc(C2(C)C)c1N(C)C2=O)(=O)=O)=O,2 Z296828842,O=C(c1n[nH]c2c1cccc2)NC(c1ccccc1)c1ncccc1,2 D621-0009,O=C(CSc([nH]c(-c1ccccc1)n1)c1S(c1ccccc1)(=O)=O)NC(CC1)CS1(=O)=O,2 Z3616771276,CC(CNS(Cc(cc1)cc(C)c1Br)(=O)=O)O,0 Z2071436039,Cc(ccnc1)c1NC(N1C(C2)C2CCC1)=O,0 F5857-5683,COc(ccc(CNC(NCC(CC1)(c2c1cccc2)O)=O)c1)c1OC,2 Z2961463015,CCc(ccc(Br)c1)c1C(N[C@@H](CCOC1)[C@H]1O)=O,0 Z2184069763,Cc1c(ccc(NS(c(cc2)ccc2C(O)=O)(=O)=O)c2)c2nn1C,2 Z1920112017,Cc1n[nH]cc1CNC(N[C@H](C1)[C@@H]1C1CCCCC1)=O,2 SA99-0059,COCCC(CC1)(CCN1C(c1cc2cccnc2cc1)=O)C(N)=O,2 Z2771249338,O[C@@H](CN(C1)c2nc(C3CCCC3)ncc2)[C@H]1Oc1ccccc1,2 Z2519128773,Cn1nnc(C(NC(CC(O)=O)C(F)(F)F)=O)c1,0 F3407-2909,O=C(CN(C(C=C1)=O)N=C1S(c1cc(F)ccc1)(=O)=O)N(CC1)Cc2c1cccc2,2 V018-7100,COCC(Nc1cccc(N(CCCN2Cc3cc(OC)ccc3)C2=O)c1)=O,0 F5777-0259,COc(cccc1)c1C(Nc(cccc1)c1NC(Nc1cccs1)=O)=O,0 F6199-0027,COc1cccc(-c2n[nH]c(C(N3CCN(CCn4cncc4)CC3)=O)c2)c1,2 Z1662798209,Cc1nc2cc(C(Nc3c(C)ccc(F)c3)=O)cnc2[nH]1,0 C796-0501,CC(C)CCNC(C(C)(Cn1c2nc3c1cccc3)N(Cc(cc1)ccc1OC)C2=O)=O,2 Z1837848792,CCC(C)CC(N(C)Cc(cc1)ccc1SC)=O,0 F6752-3402,O=S(C1CC1)(NC1CN(CC2OCCCC2)CCC1)=O,2 Z3024748181,CC(CC(C)(C)C)CC(NCC(C(N1)=O)(c2nccn2C)NC1=O)=O,2 Z5011956753,OCC(C1(CC(C2)C3)CC3CC2C1)NC(c1cnc(N2CCNCC2)s1)=O,2 Y021-1344,CC1c2cc(-c3ccnc4nc(SCc5ccc(C)cc5)nn34)c(C)cc2NC(C)(C)C1,2 F6549-5573,Cn1c(C(CC2)CCN2C(C(CC2)Oc3c2cccc3)=O)cnc1,2 F5950-0778,O=C(Cc1csc(Nc(cc2)ncc2Cl)n1)NCc(cccc1)c1Cl,0 F6201-0188,Cc1cc(CNC(COc(ccc(Cl)c2)c2Cl)=O)c(C)o1,0 Z2969469686,CCN(CCC1)CCN1c1nc(C2CC2)nc(C2CC2)c1,2 S904-1792,CC(C)C(N1Cc2nnc([C@H](C[C@@H](C3)O)N3C(c3cocc3)=O)n2CC1)=O,0 Z1307109614,CNC(CCN(C)C(NC(CCC1)CN1c(cccc1)c1Cl)=O)=O,0 E699-1338,CC(C1)N(C(C2CCC2)=O)c(cc2)c1cc2S(N(CC1)CCN1c(cc1)ccc1Cl)(=O)=O,0 Z2436755574,CC(CN(C)C(CCCCN)=O)c1ccccc1,0 F6562-4335,CN(C)c1nc(CCC(C2)NC(c3cscn3)=O)c2cn1,2 Z2014447816,O=C(c1cccc2nccnc12)Nc1c[nH]nc1-c(cccc1)c1F,2 F6512-0664,O=C(c1cccc2ccccc12)Nc1cc2ccnn2cc1,2 Z5001783506,CN(CC(O)=O)C(c1c[nH]nc1-c1cnccc1)=O,0 F6747-5734,CCc1nccn1CC(C1)CN1c1cc(C)c(ccc(OC)c2)c2n1,0 Z1416662211,OCC1Oc(cccc2)c2N(Cc2nc(C3CC3)no2)C1,2 F6677-1383,CCc1nccn1CC(C1)CN1C(C(CC1)Oc2c1cccc2)=O,2 F262-0017,CS(c(cc1)nnc1-c(cc1)ccc1NS(c(cc1)cc2c1OCCO2)(=O)=O)(=O)=O,2 Z3687015906,Cc(cc1)c(C(N[C@@H](CC(Cn2nccc2)C2)[C@H]2O)=O)c2c1[nH]nc2,2 Z1636303072,Cc1noc(CNC(N2CCC(CC(N(C)C)=O)CC2)=O)c1,2 F2182-0063,CCN(CC)CCNc1nc(c(OC)ccc2)c2s1,0 Z2497126562,CC(CNC(CCC1CCCCCC1)=O)CN1CCOCC1,2 F6562-4130,CN(C)c1nc(CCC(C2)NC(c(cc3)ccc3S(N3CCOCC3)(=O)=O)=O)c2cn1,2 S535-0304,O=C(C1(CC1)c1ccccc1)N1CCC(CN2CCCC2)CCC1,2 F371-0337,O=C(NC1CCCCC1)N(CC1)CCC1c1nc(-c(cccc2)c2Cl)no1,0 S978-0664,C[C@@H](COc1c(C2)cc(CN(C3CC3)S(C)(=O)=O)cc1)N2C(c1cncnc1)=O,2 Z1474345089,NC(N1CCN(CC(NCc2cn(Cc3ccccc3)nc2-c2ccccc2)=O)CCC1)=O,2 C470-0234,CN(c1c(C(N2C)=O)n(Cc(c(F)ccc3)c3Cl)c(CN(CC3)CCN3c(cccc3)c3F)n1)C2=O,0 F5857-3587,OC(CNS(CCc1ccccc1)(=O)=O)(C(F)(F)F)c1ccccc1,0 M652-0625,CC(C)N(CC1)CCN1C(CN(c1c(-n2c3nnc2C)nccc1)C3=O)=O,2 Z1452859549,CC(Cc1n[nH]c(C)c1)NC(N1CC(CN2CCCC2)CC1)=O,2 Z3414370682,COc1cccc(Cl)c1CC(N=S(CCC1)(CC11NCCC1)=O)=O,0 Z1721078742,OC(Cc1cccc(F)c1)(CC1)CCN1C([C@@H](CC1)NC1=O)=O,0 S640-0499,Cc1noc([C@@H](CN(C2)S(c(cc3)cc4c3OCCO4)(=O)=O)[C@H]2C(N)=O)n1,2 F2356-0482,O=C(CN(CC1)CCC1C(Nc(cc1)cc2c1OCO2)=O)Nc(cc1)ccc1F,2 Z2760952619,CN(Cc1cc(cccc2)c2o1)c1ncnc2c1ncn2C(CO)CO,0 Z2166635126,Cc(onc1N)c1S(N(CC1)Cc2c1c(OC)ccc2)(=O)=O,0 F6807-7004,CCOC(N1CCN(Cc2nnc(C)n2C)CC1)=O,2 Z4104627235,CC1(CNC(Cn(cc2Br)nc2N)=O)CCCC1,2 S545-0707,CC(C)NC(N(CCCCC1)C1c1nc(-c2ccncc2)no1)=O,2 SB04-0257,Cc1c(CN(C)CCN(C(CC2)CN2S(C)(=O)=O)C2CCOCC2)cnn1C,2 Z3056357686,C[C@](C1)(C2)[C@H]1CN2C(c(cc1)ccc1S(Nc1ccncc1)(=O)=O)=O,2 SC09-0250,CC(C)CC(N(C1)[C@H](C)COc(cc2)c1cc2-c1cncnc1)=O,0 Z1988099244,CC(N1)=CC=C(C(Nc(cc2)cc(CN(C)C)c2Cl)=O)C1=O,0 Z4521691184,CC(N1)=NC(C(N(CC2)C[C@@H]2NC(CC2CSC2)=O)=O)=CC1=O,2 E612-0534,O=C(C(Cc1ccccc1)N(Cc1c2cccc1)C2=O)NCCc1c[nH]c2c1cccc2,2 F2167-4185,CC(C)(C)OC(N(CC1)CC1Oc1nccs1)=O,2 Z31725770,Cc(cc1)ccc1-c1c(CC(NCCO)=O)nc(-c2ccccc2)s1,0 F6670-5542,COc(cc1)cc(N=CN2CC(CC3)CCN3c3ncc(C(F)(F)F)cc3)c1C2=O,0 F1605-0999,CC(NCCNc1nc2c(-c3cccc(C(F)(F)F)c3)nnn2c2c1cccc2)=O,2 S593-0553,Cc(cc(cc1)S(N(CCC2)C2c2noc(COc(cc3)ccc3F)n2)(=O)=O)c1F,0 P218-1984,O=C(Nc(cc1)cc2c1OCCO2)N1Cc2cc(-c3cccc(Cl)c3)nn2CCC1,2 SB54-1038,COC[C@@H](CN(C1)S(c2cc(F)cc(F)c2)(=O)=O)[C@H]1c1nnc(-c2ccccc2)o1,0 F5834-1222,O=C(C1CCCC1)N(CC1)c2c1ccc(NC(NCc1cccc3ccccc13)=O)c2,2 F6755-0855,COCc1nsc(N(CC2)CCN2c(cc2)cc(Cl)c2Cl)n1,0 P161-0031,CC(CCc1ccccc1)NC(CN(C=Nc1c2snc1C(N)=O)C2=O)=O,2 F6436-2482,CC(C)(C)NC(N1CCC(CNC(CCc(cccc2)c2Br)=O)CC1)=O,0 Z1229977895,Cc1cccc(C(NCC2(CCCCCC2)O)=O)c1C,0 J500-0456,CC(C)NC(C(C1)C2(CCCC2)CN1C(Nc(ccc(C)c1)c1Cl)=O)=O,0 F5860-2458,O=C(CCc1cccc(Oc(cc2)ccc2F)c1)NCc1nc(-c2ccccc2)no1,2 Z1416540233,CCCC(C)c1n[nH]c(NS(c(cc2)c(C)cc2[N+]([O-])=O)(=O)=O)c1,0 Z2482901367,Cc1cc(CN(C)Cc(cc2)cc(Cl)c2C(O)=O)no1,0 Y205-4309,CC(CN(CC1)C(Nc(cc2)ccc2F)=O)N1c1ccc(C)cc1,0 F6810-4573,COc(ccc(CN(CC1)CCN1c1nc(C2CC2)nc(C(F)F)c1)c1)c1F,0 F6802-6067,CN(C(CC1)CCN1c(ccnc1)c1Br)S(C1CC1)(=O)=O,0 V005-2698,Cc1nc(C2CC2)nc(N(CC2)CCN2C(N(C)C)=O)c1Cc(c(F)ccc1)c1Cl,0 Z4496992658,Cc(c(C(N(C)C(N1C)=O)=O)c1nc1)c1C(N(CCc1cc(F)c2)Cc1c2F)=O,0 Z2188038884,OCC(CC1)(CN1C(Cc(cc1)nn1-c1ccccc1)=O)c1ccccc1,2 Z2435936879,CC(CC(C)C1)CN1C(CN1CCN(CCc2nc(C)ccc2)CC1)=O,2 F6015-0084,O=C(CCCn1cccc1)N(CC1)c2c1cccc2,2 F6608-2399,O=C1NCCCC1N(CC1)CCC1Oc(nc1)ncc1F,2 Z4655554188,Nc1ncc(CNC(c2c(C(F)(F)F)c3ccccc3nc2)=O)cc1,0 C276-0995,COc(cc(C(C1)C(C(CCC2)=O)=C2NC1=O)cc1)c1OCc1ccccc1,0 F6015-0142,O=C(CCCn1cccc1)Nc(cc1)cc(Cl)c1F,0 Z1578939479,O=C(Nc(cc1)cnc1Cl)N1C(CC2)CCC2C1,2 SA50-0569,Cn(c(C1)c2CN1C(C1CCC1)=O)nc2-c1nc(COC)no1,2 F6709-4101,Cc1ccc(CN(C2)CC2Oc2ccncc2)s1,2 Z4144026690,CC(c1cc(CNC(c2cn(CC(O)=O)nn2)=O)ccc1)(F)F,0 Z3883853737,CC1(C)CN(CC2=Cc(cc(cc3)OC)c3NC2=O)C(CC(N)=O)C1,2 Z2963654367,CCc(n(Cc1ccccc1)nc1)c1C(N[C@H]1C[C@H](CO)C1)=O,0 L239-0298,O=C(Cn1nc(C(N2CCCC2)=O)c2c1cccc2)N(Cc1ccco1)C1CCCC1,2 F6454-2313,Cc1nccc(N2CCC(CNS(C3CC3)(=O)=O)CC2)c1,2 S995-0418,CC(N(CC1)CCC1[C@@H]1[C@@H](CO)CN(Cc2ccncc2)C1)=O,2 Z2466123187,C[C@H]1N(Cc(cc(cc2)Cl)c2OCc2cnccc2)CCNC1,0 Z1636544191,CC(C)c1nccc(NCc2c(N3CCCC3)nc(C)cc2)n1,0 F6743-6388,CN(C(CC1)CCN1c1cnc(cc(cc2)Cl)c2n1)S(C1CC1)(=O)=O,0 SA46-0425,CN(Cc1ccccc1)C1COC(C2)(CN2C(c(ccnc2)c2F)=O)C1,0 Z1608441083,O=C(C(CC1=O)CN1c1ccccc1)Nc1cnc(CCOC2)c2c1,0 Z1663800455,OC1(CCC1)C(NC(CCC1)CN1c(cccc1)c1Cl)=O,2 F6743-9913,Cc1nnc(CN(CCC2)CC2NS(C)(=O)=O)n1C,0 F6541-4286,CC(N(CC1)CCN1c1nccc2c1ccs2)=O,2 F6549-7515,Cc1noc(C)c1CCC(N(C(CC1)C2)C1CC2n1ncnc1)=O,2 D205-0298,CC(C(Nc1nn2c(O)c(C)c(C)nc2n1)=O)Oc1ccccc1,0 Z2138583327,CC(Cn(cc1)c2c1cccc2)C(NC(CC(C1)C2)(CC1C1)CC12O)=O,2 SA49-0364,Cc1noc(C)c1CCC(N(C1)CC11OCC(CC(N2CCCC2)=O)C1)=O,2 S689-1659,COCCNC(C(C1)CN(C(C2)CN2S(Cc2ccccc2)(=O)=O)C1=O)=O,2 C660-0765,Clc(cc1)ccc1-c1noc2ncnc(N(CC3OCCC3)Cc3ccco3)c12,0 Z1313891985,CC(Cc1c(C)[nH]nc1C)C(N(CC1)CCC1C#N)=O,0 F6482-7061,O=C(C1CCCC1)NCc1cc(-c2cscc2)ncc1,2 F6514-1959,Cc1c(C(NCCN(C(C)=CC(OC)=C2)C2=O)=O)c(C)nn1C,2 S751-0991,CC(C)CC(NCCn1c(-c2ccncc2)ncc1C)=O,2 Z1928120136,O=C(c1cc(occ2)c2s1)N1c2c[nH]nc2CCC1,2 F6245-6826,COc(nccc1)c1C(NCCN1N=C(c2cccs2)N(C2CC2)C1=O)=O,2 F898-0040,CN(CC(NC1CCCCC1)=O)S(c1c[nH]c(C(N2CCCC2)=O)c1)(=O)=O,2 T990-4858,O=C1N(CCc2ccccc2)CCC1N(CC1)CCN1S(c1cccc(Cl)c1)(=O)=O,0 Z1944163350,COc(ccc(Cl)c1)c1C(N(CC1)CCN1C(c1cc(Cl)ccc1)C#N)=O,0 F6513-2362,Cc1c(CN(CC2)CCN2c2ncccc2)cno1,2 CM3891-1564,OC(CN1CCCC1)(CC1)CCC1(CC1)CCN1S(c1cc(F)cc(F)c1)(=O)=O,0 F2504-0112,O=C(COc1ccccc1)NCC(c1ccco1)N(CC1)CCN1c1ccccc1,2 Z2437611328,CCCC(COC)(CCC1)N1S(c1ccc(C(O)=O)o1)(=O)=O,0 F5017-1816,O=C(COc1ccccc1)N1CCC(CNS(c(cccc2)c2Cl)(=O)=O)CC1,2 G856-6405,CN1C(SCC(N(CCC2)c3c2cccc3)=O)=NC=C(C(Nc(cc2)ccc2Cl)=O)C1=O,0 Z2033468097,CC(C)c1c(C(N(C)CC(CC2)CN2C(C)=O)=O)occ1,2 Z351721828,CCOCC(Nc(cccc1)c1C(O)=O)=O,0 Z2755306807,Cc1c(C(C2)CC2N(C2CC2)C(c2ccc(CC(O)=O)cc2)=O)cccc1,0 S616-2196,Cc(ccnc1)c1C(N(CC[C@H]1C2)C[C@@H]1N2S(C)(=O)=O)=O,2 SC04-0669,C(COC(CCC1)CN1C1CCC1)c1noc(C2CC2)n1,2 S649-0619,COCCOC(C1)C2(CCCCC2)N1C(CC1)CCN1C(Nc(cccc1)c1F)=O,2 F6089-9731,O=C(NCC1OCCC1)NCC1(CC1)c1cccs1,2 F6678-9551,CC(C)(C)c1nc(cccc2)c2n1C(C1)CN1C(Nc(cccc1)c1F)=O,0 SC19-0693,CCn1nc(CN(CC2)CCC2NC(Cn2nc(C)cc2C)=O)c2c1CCOC2,0 F6471-8503,Cn1c(S(C(CC2)CCN2C(C2CC2)=O)(=O)=O)ncc1,2 F6554-4514,CCC(C)NC(N1Cc(cc(cc2)F)c2OCC1)=O,0 F6479-3388,Cc(c(Cl)ccc1)c1S(N(CC1)CCC1Oc(ccnc1)c1Cl)(=O)=O,0 K292-0371,CCC(C)NC(CSC(N(Cc(cccc1)c1Cl)C1=O)=Nc2c1scc2)=O,0 Z2476686017,CN(CC1)CC(Cc2ccccc2)N1C(c(cc1)cn2c1nnc2)=O,2 SB15-1005,COCC(N(C1CCOCC1)C(CCC1)CN1S(c1cc(CCC2)c2cc1)(=O)=O)=O,2 Y500-4806,O=C(c(cnn1c(C(F)(F)F)c2)c1nc2-c1ccco1)Nc(cc1)cc(F)c1F,0 S565-0868,Cn(c(CC1)c2CN1C(c1nc3ccccc3cc1)=O)nc2-c1nncn1CC1CC1,2 V016-3053,CC(C)NC(c1coc(COc2cc(C(c3cccc(F)c3)N(CC3)C(C4CC4)=O)c3cc2)n1)=O,2 Z1367488098,CC(CC1)CN1c1nccc(C(N(CC2CC(N(C)C)=O)c(cc3)c2cc3Cl)=O)c1,2 Z810639882,NC(C1(CCCCC1)NC(c1noc(C2CC2)c1)=O)=O,2 F6816-2740,N#Cc(cc1)nnc1N(CC1)CCN1c(cccc1)c1F,0 F6454-1063,O=C(c1cccs1)NCC(CC1)CCN1c(nc1)ncc1F,2 Z54848447,CCOC(c(cc1)cc2c1OCCO2)=O,0 M183-0458,O=C(CN(C(c1c2cccc1)=O)N=C2N1CCOCC1)Nc(ccc(Br)c1)c1F,0 C762-0176,Cc(cc1)cc-2c1OCc1c2n(CC(N(CC2)CCN2c2c(C)ccc(C)c2)=O)nc1,2 S915-0312,CO[C@@H](C[C@H]1CN([C@H]2Cc3ccccc3)C(NCCc3ccccc3)=O)CN1C2=O,2 Z4119029109,CC(C(Nc1ncnn1-c1ncccn1)=O)Oc1cc(Cl)cc(Cl)c1,2 S614-1121,N#Cc1ccc(CN(CCCC2)C2c2nc(CCOCC3CCOCC3)no2)cc1,0 P072-1444,O=C(CN(c1cccnc1N1c(cc2)ccc2F)C1=O)Nc(cc1)ccc1N1CCOCC1,2 S700-1366,CCn1ncc(S(N(C2)CC2c2nc(CCOc3cc(C)ccc3)no2)(=O)=O)c1,2 V030-2808,CC(C)CNC(CC(C1CCCCC1)c1c[nH]c(cc2)c1cc2Cl)=O,2 F5882-0914,CCOc1ccc(CC(Nc2cc([nH]nc3)c3cc2)=O)cc1,2 C430-0221,COc(ccc(NC(c(cccc1)c1C1=O)N1c1ncccc1)c1)c1Cl,0 F2147-1028,Cc(cc1)ccc1S(N1CC(CNC(c2ccccc2)c2ccccc2)(CO)C1)(=O)=O,2 L309-0421,CCC(C)NS(c(cc1)cc(N2Cc3noc(CC)n3)c1OCC2=O)(=O)=O,0 F6435-1975,COc(cc1)ccc1N(CC(C1)C(N(C2)Cc3c2cncn3)=O)C1=O,2 F5823-0338,O=C(CN(C(c1c2cccc1)=O)C2=O)N1CCC(Cn2nccc2)CC1,2 F5033-7963,CN(C)c1cccc(C(NCC(CC2)CCN2C(c(cccc2)c2F)=O)=O)c1,0 F6472-7806,CC1=C(C)N=CN(CC(N(C2)CC2N(CC2)Cc3c2cccc3)=O)C1=O,2 Z1603599099,CC(C)n(cc1)nc1C(NC(C(O)=O)c(cc1)ccc1OC)=O,0 F6550-6851,O=C(C1(CC1)c(cc1)ccc1F)N(C1)CC1Nc1ncncc1,2 Z1647327248,CC(CCC(N(CC1)CCC1C(O)=O)=O)OC,0 Z1939155125,O=C(C1OCCC1)N(CC1)CCN1c1nc(C(F)(F)F)ns1,0 F830-0835,COc1cccc(-c2noc(CN(C=Nc3c4nnn3Cc3cccc(F)c3)C4=O)n2)c1,0 F6530-0530,COC(C(C(N(CC1)CCN1C(c1ccco1)=O)=O)=C1N2CCC1)=CC2=O,2 F5857-3484,COC(c(cc1)ccc1C(NCC(C(F)(F)F)(c1ccccc1)O)=O)=O,0 F0672-0414,CCOC(c1c(C)c(C(Nc2c(C)c(C)ccc2)=O)c(C)n1C)=O,0 Z3082409518,CCn1ncc(Br)c1C(Nc1c(N(C)C)ncnc1)=O,0 F6507-3851,Cc1cc(C(CNC(c2cnc(C(F)(F)F)cc2)=O)O)c(C)o1,0 Z2147343653,CC(N(C1)c(cccc2)c2OC1C(N(CCOC1)CC1(F)F)=O)=O,2 2425-3532,COc1cc(NS(c(cc2)ccc2N(C(c2c3cccc2)=O)C3=O)(=O)=O)nc(OC)n1,2 Z2131234260,CC(c(cc1)c(C)c(OC)c1OC)NC(N(CCC1)CCN1c1ccccc1)=O,0 F6443-1247,COC(CC1)CN1c(cc1)ccc1C(N(CC1)Cc2c1scc2)=O,2 F6554-2023,CC(C)(C)OC(N(CCC1)CC1C(N1C(C2)COC2C1)=O)=O,2 F6515-0863,O=C(c(cc1)cc2c1ncs2)NCc1cc(-c2cccs2)ncc1,2 Z1747467599,Cc1ccc(-c2c[nH]cc2C(N2CCC(CCC(N)=O)CC2)=O)s1,2 Z4286682709,Nc1nc(cc(cc2)C(NCC3CCCC3)=O)c2[nH]1,2 F6557-2094,O=C(CN(C=NC(C1CC1)=C1)C1=O)N(CCC1c(cccc2)c2Cl)CCS1(=O)=O,2 F6188-0985,O=C(c(cc1)ccc1OC(F)(F)F)NCC1(CCOCC1)Sc1ccccc1,0 G348-0254,Cc(cc1)cc2c1OCCN2C(CN(CCCN1Cc(cc2)ccc2F)S1(=O)=O)=O,0 Z1370993201,OC(CN(Cc1ccccc1)C(C(C=C1)=NN(c(cc2)ccc2F)C1=O)=O)c1ccco1,2 P166-1609,COc(cc1)ccc1N1CCN(Cc2nc(-c(cc3)cnc3N3CCCCCC3)no2)CC1,2 Z2483074847,OC(c1coc(CN(CC2)CCC2c(cccc2)c2Br)n1)=O,2 F6553-7166,O=C(C1(CC1)c(cc1)ccc1F)N(CC1)Cc2c1sc(Cl)c2,2 SA49-0394,Cc1c(COC)c(C(N(C2)CC22OCC(CC(N3CCCC3)=O)C2)=O)no1,2 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Z2846219368,CC(C)N(CC1)CCC1NC(Cn1nnc(C(c2ccccc2)O)c1)=O,2 F6609-0203,O=C(c1ccco1)N(CC1)CCN1C(c1cc(CCCC2)c2s1)=O,2 F6523-0749,CCn1nc(C(NC(CC2)CCN2c2ncnc3c2CCCC3)=O)c(Cl)c1,2 Z1417277301,CCOc(ccc(S(NC(Cc1ccc(C)cc1)=O)(=O)=O)c1)c1Br,0 Z3337547297,CC(C)(C[C@@H]1OCC[C@@H]1C1)CN1C(C)=O,2 Z2179926296,O=C(NCC1(CC1)c1ccccc1)N(CC1)CC1n1ncc(Cl)c1,0 SB24-0141,CCN(CC)C(c1cn(C(CC2)C2(CC2)CCN2C(NCC(C)C)=O)nn1)=O,0 SA46-0426,Cc1cc(C(N(C2)CC2(C2)OCC2N(C)Cc2ccccc2)=O)no1,2 F0173-0134,O=C(C=CN1c2c(-c3ccccc3)oc(-c3ccccc3)n2)NC1=O,2 G508-0047,O=S(c(cc1)ccc1N(CCCC1)S1(=O)=O)(N1CCCC1)=O,2 F6445-2657,O=C(CN1N=CC=CC1=O)N(CC1)c(cc2)c1cc2-c1ccncc1,2 Z1016990876,O=C(NCc(cc1)cc(F)c1F)N(CC1)CCN1c1nnccc1,0 Z2947597910,CC(C)N(Cc(c(F)cnc1)c1F)CC(N1)=Nc(cccc2)c2C1=O,2 F3411-4060,O=C(CN(CC1)CCC1(NC1=O)N=C1c1cccc(F)c1)Nc1cc(C(F)(F)F)ccc1,0 Z1098685821,CC1(C)N(CCNC(C(CCC2)CN2C(C)=O)=O)CCOC1,2 M026-1311,Cc1noc(/C=C\c(cc2)ccc2S(NC2CCCCCC2)(=O)=O)c1NC(C1CC1)=O,2 SB68-0667,O=C(c1c(C[C@@H](C2)NC(c(nccc3)c3F)=O)n2nc1)NCc1cnccc1,2 V030-7766,CC(C)CC(N(CC1)C(c2ccc(C)cc2)c2c1ccc(OCc1nc(C(NC(C)C)=O)cs1)c2)=O,2 Z1333993663,COc1cccc(Nc(cccc2)c2C(N(CC2)CCC2NC(N)=O)=O)c1,0 F6512-0994,CCCc(cc1)ccc1S(Nc1cc2ccnn2cc1)(=O)=O,0 F5964-0177,OCC1(CNC(Cc(cc2)ccc2-c2ccccc2)=O)CC1,2 Z4635073085,CN(CC(Nc1cc(F)cc(F)c1)=O)C(c(cnn1Cc2ccccc2)c1Br)=O,0 V007-4057,CCN(CC)S(c(cc1)cc2c1n(CC1OCCC1)c(SCc(cc(cc1)OC)c1OC)n2)(=O)=O,0 SB52-1184,CN(CC1(C2)CCN(Cc3nc(OC)ccc3)CC1)C2c1noc(C2CCC2)n1,2 Z2044453197,CC(C)c1c(C(NCC(CC2)OC22CCCCC2)=O)occ1,2 F6482-7772,O=C(NCc1cccnc1-c1cccs1)Nc1c(C(F)(F)F)cccc1,0 F6259-0801,CN(C(C=C1)=O)N=C1N(CCC1)CC1C(Nc1c(C(F)(F)F)cccc1)=O,0 D216-0063,O=S(Cc1ccccc1)(N(CC1)CCC1c1nc(cccc2)c2s1)=O,2 F2646-0550,CCS(c(cccc1)c1C(Nc1nc(-c2ccccc2)c(C(c2ccccc2)=O)s1)=O)(=O)=O,2 Z1616022580,CCC(C)n(c(C)c1)nc1C(N(CC1)CCC1c(cc1)ccc1O)=O,0 8018-3807,COc(c(OC)c1)cc(F)c1S(N(CCC1)CCN1S(c(cc(c(OC)c1)OC)c1F)(=O)=O)(=O)=O,0 Z646220584,O=C(CN(c(cccc1)c1N1)C1=O)Nc(cc1)ccc1-c1n[nH]cc1,2 V019-1582,CC(C)c1nc(N(CC2)CCN2C(COCc2ccccc2)=O)c(c(CCC(C)C2)c2s2)c2n1,0 F5596-0318,CC(C)c1nnc(C(CC2)CCN2C(COc(ccc(Cl)c2)c2Cl)=O)o1,2 F6312-0276,O=C(c(s1)ccc1Cl)NCCCn1c2ncccc2cc1,2 SA96-1402,O=C(C1CCC1)N(C1)CC1(CN(Cc1ccccc1)C1)C1C(NCC1CC1)=O,2 Z1652495636,CCC(C)NC(CCNC(N(CC1)CC1Oc1cccc(F)c1)=O)=O,0 F6725-2720,Cn1ncc(-c2nccc(CNc3ncnc4cnccc34)c2)c1,2 Z4497187474,O=C(C(C1)C(CCCC2)C2NC1=O)Nc(cc(cc1)S(N2CCOCC2)(=O)=O)c1F,2 F2302-0520,COc1cc(Cn2c(cccc3)c3c(CC(NCc3ccco3)=O)c2)cc(OC)c1,2 F5857-6724,OC1(CNC(C(NCCc2ccccc2)=O)=O)C=CCCC1,2 F6495-2521,O=C(c1ncnc(N2CCOCC2)c1)NCc1cccs1,2 SC42-0003,Cc1nc(CC2CC(CC3)(CCN3C(C3(CCCC3)c3ccccc3)=O)OCC2)no1,2 Z4999841126,CC(CCC1)(CN1C(c1cc(C(N(C2)C(CCC(N3)=O)C3=O)=O)c2cc1)=O)C(O)=O,0 F6125-0925,Cc1cc(C(N(C2)CC2C(NCC(F)(F)F)=O)=O)no1,0 Z2960365547,O=C(C1(c2ccccc2)OCCC1)NCc1nnc(C2CC2)s1,2 Z2492912273,Cc(cc(cc1)S(N(CC(O)=O)C2CCC2)(=O)=O)c1F,0 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SA46-1134,Cc(nc1)cnc1C(N(C1)CC1(C1)OCC1N1CCCC1)=O,2 F2515-3886,CCOc1cccc2c1nc(N(Cc1cnccc1)C(CN(C)S(C)(=O)=O)=O)s2,0 Z4091799126,CC(c1ccccc1)N(CC(C1)C(N2C(CO)c3c[nH]nc3C2)=O)C1=O,2 SC40-1045,Cc1cc(C)nn1CC(N(CC1)CCC11OCc2c(COc3ccccc3)nnn2C1)=O,2 C732-0643,O=C(CN(c(ccc(S(NC1CCCCC1)(=O)=O)c1)c1O1)C1=O)N1CCCCCC1,2 Z1736383277,CC(c1c(C)[nH]nc1C)c1nc(-c(cc2)ccc2N2CCCCC2)no1,2 C200-1167,COc(cc1)ccc1NC(CCCN(C(c(scc1)c1N1CC(NCCC2=CCCCC2)=O)=O)C1=O)=O,2 J500-0337,CC(C)NC(C(C1)C2(CCCC2)CN1S(c1cn(C)c(C)n1)(=O)=O)=O,0 F6539-3283,COc(ccc(C(NCc(cc1)ccc1-c1cocc1)=O)c1)c1F,0 Y502-7861,CCn1nc(C(NC)=O)c(NC(C(CCC2)CN2S(C)(=O)=O)=O)c1,0 Z3367768720,CCc1c(NCc(n(C)nc2C)c2Cl)[nH]nc1C,2 J004-1369,CCCc1cc(C(CCC2)N2C(c2noc(-c3cccs3)c2)=O)no1,2 S904-0940,CN1Cc2nnc([C@H](C3)N(Cc4cscc4)C[C@H]3O)n2CC1,2 F2971-0149,O=C(CSc1ccccc1)N(CCCn1cncc1)c(sc1ccc2)nc1c2Cl,2 F6515-4199,O=S(c1cc(CCCC2)c2cc1)(NCc1cncc(-c2cnccc2)c1)=O,2 S693-2087,Cc1cnc(COC)n1CC1CN(Cc2ccncc2)CCC1,2 Z2347967240,Cc(cc12)ccc2ncnc1NC(CC1)CCC1OC,0 F946-0579,CCN(Cc1ccccc1)S(c(cc(cc1)C(C=C2)=NN(c3c(C)onc3C)C2=O)c1OC)(=O)=O,0 Z2493895892,Cc1c(-c2ccccc2)sc(C(N(CC2)CCN2c(nc2)ncc2F)=O)c1,0 Z1207308091,CN(C)C(C(CCC1)CC1NC(c(cc1)ccc1OC(F)(F)F)=O)=O,0 Z3290575194,CC1CC(CS(N(C)CCN(CCC2)C2=O)(=O)=O)CC1,2 F6807-5360,Cc1cc(ncnc2N(CCc3c4)Cc3cc(OC)c4OC)c2[nH]1,2 E947-0599,CC(C)CN(C=Nc1c2c(C(NC(CCC3)c4c3cccc4)=O)c(C)o1)C2=O,2 Z2438850385,Cc1ncc(CN(CC2CC2)C(Nc(cc2)cnc2-n2nccn2)=O)cc1,2 F6514-1949,CC(N1CCNC(c2cc(-n3nccc3)ccc2)=O)=CC(OC)=CC1=O,2 Z2774416599,OCC(CC1)CCC1NC(c(cc1)ncc1-c1c[nH]nc1)=O,0 8018-4044,O=C(C(Nc(cc1)cc2c1OCO2)=O)NCc1ccc(CN2CCCCC2)cc1,2 Z100733990,O=C(c1cn(Cc2ccccc2)nc1)NC1CCN(Cc2ccccc2)CC1,2 Z365699760,CCc1n[nH]c(C(N(CC2)CCN2c2nccnc2)=O)c1,0 F6496-1398,Cc1cc(C(NCc2ncnc(C3CC3)c2)=O)c(C)o1,2 V028-6974,CCCc([nH]nc1-c2cccc(Cl)c2)c1NC(C1CCC1)=O,2 F6796-3234,Cc1nn2c(N(CC3)CCN3c3nc(cccc4)c4s3)cc(C)nc2c1,2 SA41-0841,CN1C(COCc2ccccc2)CC(C2)(CN2C(c(ccnc2)c2F)=O)C1,2 F6400-1265,Cc1noc(C)c1CCC(N1C(CN2CCOCC2)CSCCC1)=O,2 G803-0091,Clc1cc(-c2noc3ncnc(N(CC4)CCN4c4ncccc4)c23)ccc1,0 Z2896103492,CCC(C)(c1cc(C(Nc2cccc(F)c2)=O)no1)O,0 E750-0899,COc(cc1)ccc1NC(CC(C(N1c(cc2)ccc2Cl)=O)N(Cc2ccco2)C1=O)=O,0 E867-1188,CN(CC1)CCN1C(Cc(cc1)ccc1NC(N1c2cccnc2SCC1)=O)=O,2 K788-1319,CC(CC1)CCN1S(c(ccc1nc(-c2cnccc2)c2)cc1c2C(NC1CC1)=O)(=O)=O,2 F6178-5854,O=C(NCC(CC1)CCN1c1nc(cccc2)c2o1)NCc1cccs1,2 SA99-0742,NC(C(CC1CC1)(CC1)CCN1C(CC1)CCN1C(CCc1c[nH]c2c1cccc2)=O)=O,2 L858-0078,CC(N(CC(NC1CCCC1)=O)C1=O)=Nc2c1sc1ncccc12,2 E646-3113,CC(CN(C1)S(C)(=O)=O)(C(NCc2ccccc2)=O)N(CCCc2ccccc2)C1=O,2 F1700-0213,CC(C)COC(C(C1c2cccs2)=C(C)NC(N(C)C(N2C)=O)=C1C2=O)=O,2 Z2496317947,CCN(c(cc(cc1)C(NC(C)c2c(C)oc(C)c2)=O)c1N1)C1=O,0 F6518-2295,CC(c1ccc(CCNC(COCc2ccccc2)=O)s1)=O,2 SD08-0418,CCn1ncc(C(N(CCC2)CC22OCc3c(CNC(C4CC4)=O)nnn3C2)=O)c1,2 Y031-4096,CC(CC1)CCN1S(c(cc1)ccc1NC(C(C1)CN(C2CCCC2)C1=O)=O)(=O)=O,2 Z1440587444,CC1(C)C(C2)C1CN2C(NCCC1Oc(cccc2)c2OC1)=O,2 F6508-0607,O=C(c1csc(-c2ccccc2)n1)NCC(c1cscc1)c1ccco1,2 F6724-0478,Clc1cc2c(NCC(c3cscc3)N3CCOCC3)ncnc2cc1,2 D578-0195,Cc1cc(Nc(cc2)ccc2NS(c2cccc(Cl)c2)(=O)=O)nc(NC2CCCCC2)n1,0 Z1174170203,CCN(CC1OCCC1)C(c1ccc(-c2ccccc2)[nH]1)=O,2 Y500-0673,O=C(c1nn2c(C(F)(F)F)cc(-c(cc3)ccc3Br)nc2c1)N(CC1)CCN1C(c1ccccc1)=O,2 Z1192575039,CC(C(C)S(C)(=O)=O)N(C)C(c1n[nH]cc1)=O,0 F6360-9660,O=S(c(cccc1)c1OC(F)(F)F)(N(C1)CC1Oc1cnccc1)=O,0 SA64-0651,CC1(CCCCC1)C(N(CC1)CCC11OCCC(CNS(C)(=O)=O)C1)=O,2 F6435-3457,O=C(C1(CCCC1)c(cc1)ccc1Cl)N(CC1)CC1(C1)Oc(cccc2)c2C1=O,2 Z4927734612,CC(C)c1n[nH]c(C(N)=O)c1NC(Cc1ccc(CCN)cc1)=O,0 Z2922652434,C[C@@H](C[C@H](CC1)C(O)=O)N1C(c(cc1)nn1-c(cc1)ccc1F)=O,0 Z1761209239,CC1(CC(N(CC2)CC2Nc(cc2)nn3c2ncc3)=O)CCCCC1,2 K061-0160,Oc(ccc(Cl)c1)c1NC(c1nn2c(C(F)(F)F)cc(-c3ccccc3)nc2c1)=O,0 F6252-5769,CCOC(CNC(c1c(-n2cccc2)n(-c2ccccc2)nn1)=O)=O,2 F6808-5929,CN(C(C=C(N1C)N(CC2)CCC2(c2ccccc2)C#N)=O)C1=O,0 SA85-0982,OC(CN(Cc1c(C(F)(F)F)cccc1)C1)CN(CCc2ccccc2)C1=O,2 F2167-1172,O=C(N(CC1)CC1S(c1ccccc1)(=O)=O)N1CCCCC1,2 S976-1151,O=C(C(CCC1)(CN1C(c1cscc1)=O)F)NCC1CC1,2 Z453457580,Cn1c(-c2c(N)n(C)nc2)nc2cccc(Cl)c12,0 Z3135128351,Cn1nc(C(CC2)CCN2C([C@H](C2)[C@H](C3)[C@H]3[C@H]2N)=O)cc1,2 G868-1195,Cc1nc(N(CC2)CCN2S(c(cc2)cc(OC)c2OC)(=O)=O)nc(Nc(cc2)ccc2OC)c1,0 F6481-3220,O=C(c1ncn[nH]1)N(CC1)CCSC1c(cc(cc1)F)c1F,0 F2491-0032,COc1c(CCNC(c2n[nH]c3c2cccc3)=O)cccc1,0 F3172-0075,CC(C1)OC(C)CN1c1nc2ccccc2c(-c2ccccc2)n1,2 F6571-0923,CN(C)C(CNC(C(Nc(cccc1)c1SC)=O)=O)c1cc(cccc2)c2o1,0 Z3299529974,CC(C)n1nc(CC(NC(CCC2)(CC3)C2N3C(CC(C)SC)=O)=O)cc1,0 Z3175294299,CN(Cc1csnc1OC)C(Nc1cnc(CCC2)c2c1)=O,2 L315-0063,O=C(Nc1cc(-c2cc(cccc3)c3[nH]2)ccc1)Nc(cc1)cc2c1OCCO2,2 Z1609589498,Cc1c(c(CC(N(CC(C2)OC)C2C(O)=O)=O)c[nH]2)c2ccc1,0 H025-3030C,Cc(c1c(n2nc3SC)N(C)CCN1C)nc2c3S(c1ccccc1)(=O)=O,2 S357-0183,O=C(C(CC1)CCN1C(c1c(COC(C2)c(cc3)ccc3Cl)n2cn1)=O)NC1CCCC1,2 Z1171690640,Cc1nc(C(NCCN2CCCCC2)=O)c[nH]1,2 F6452-0531,CCC(CNC(C1CCC1)=O)(c1ccccc1)OC,0 Z1441327110,CN(CCC1)C(CC2)C1CN2C(CCc1nc(-c2cccs2)no1)=O,2 Z3483851980,Cc(cc1)nn1S(c(cc1)cc(C)c1Cl)(=O)=O,0 Z1507430953,CC(C)(C)C(CC1)CCC1(CNC(N[C@H](CC1)CC[C@@H]1O)=O)O,0 F5243-0610,CC1=C(C)N=C2SC=C(c3cccc(NC(c(o4)ccc4Br)=O)c3)N2C1=O,2 Z3142629899,NCC(CCC1)C1(CC1)CCN1C(c1c[nH]cc1-c(cc1)ccc1F)=O,2 P804-0883,O=C(C1(CC1)c1ccccc1)N(CC1)CCN1c1cc(-c(cc2)ccc2Cl)n[nH]1,2 S592-0603,COc(cc1)ccc1S(N(CC1)CC1c1noc(COc(cc2)ccc2F)n1)(=O)=O,0 F5033-2850,CS(N1CCC(CNC(c(s2)ccc2Cl)=O)CC1)(=O)=O,0 F6368-0297,CCOc(cccc1)c1NC(CN1CCN(CCn2c(-c3ccccc3)ncc2)CC1)=O,2 F6495-4479,O=C(C(C1)CN1c1ncnc(-n2cncc2)c1)NCCC1=CCCCC1,2 F6660-1189,O=C(COC(c(o1)ccc1Br)=O)Nc1c(C(F)(F)F)cccc1,0 Z1754176954,Cc1nnc(C(C2)OCCN2C(CC2CC2)=O)o1,2 F6389-1138,O=C(c1nccc(-n2cncc2)c1)N(CC1)CCN1c1ncccc1,2 Z57515424,CCOc(cccc1)c1-c1nc(-c2ccncc2)no1,0 F6517-1184,OC(CNC(c(cccc1)c1Br)=O)c1ccc(-c2cscc2)o1,0 Z2795687727,CCN(CC1)CCN1C(c1coc(C(C)(C)C)n1)=O,0 Z1311010705,CC(C)n1c(cccc2)c2nc1C(CCC1)N1C(c(cc1)ccc1N(CCN1)C1=O)=O,2 S858-6355,CS(N(C1)C[C@@](CO)(C2)[C@H]1CCN2C(C(C=C1)=NNC1=O)=O)(=O)=O,2 F6200-3074,Cn1c(cccc2)c2c(C(CNC(c2nc(cccc3)c3s2)=O)O)c1,2 F3126-0383,Cc1c(C(Nc(cccc2)c2Cl)=O)nnn1-c(cccc1)c1F,0 Z1549666371,Cc1nnnn1-c(cc(cc1)NC(C(c2cnccc2)O)=O)c1OC,2 Z1337348923,Cc(ccc(CN(C)C)c1)c1NC(c1cc(CCC2)c2cc1)=O,0 F5857-0741,COc1ccc(CNC(NCC(C2CC2)(c2ccco2)O)=O)cc1,2 F5833-1279,CN(C)C(CNC(Nc1cccs1)=O)c1cccn1C,2 F6471-5931,O=S(Cc(cccc1)c1Cl)(N(CC1)CCC1n1nncc1)=O,2 D398-0164,Cn1nc(C(F)(F)F)cc1C(N(CCC1)C1c(cc1)ccc1Cl)=O,0 F6556-5578,O=C(c1cc(Br)cs1)N(CCC1)CCN1C1COCC1,2 Z3634439941,COc(nc(cc1)N2CCOCC2)c1NC(N1CCOCC1)=O,2 Z2394048729,CC1(CNC(c(c2c3CCC2)nn3-c2ccc(C)cc2)=O)CCNCC1,2 F3398-5047,Cc1cc(OCC(Nc2cccc(Br)c2)=O)nc(N2CCCC2)n1,0 Z2218481937,CCN(CC)CCNC(c1cc(NC(c2c(N)n(-c3ncccc3)nc2)=O)ccc1)=O,0 F2490-0070,C(CNc1nc(N2CCOCC2)nc(N2CCOCC2)n1)c1ccccc1,0 Y043-5762,c1(n2c(nn1)cccc2)[C@@H](NC(CC1(n2cccc2)CCCCC1)=O)CC(C)C,2 Z1688670045,CCC(N(CC1)CC1NC(Nc1cn(C)nc1C(F)(F)F)=O)=O,0 F5857-0867,Cn1c(C(CNC(CN(c(cccc2)c2O2)C2=O)=O)O)ccc1,2 Z2010118153,Cc1c(C)sc(NC(c2coc(C3CCOCC3)n2)=O)c1C#N,0 T499-1834,CCOc1c(CN(CC2)CC2c(n2C)nc3c2nccc3)cccc1,0 F6726-5652,CN(Cc1nnc(C2CCOCC2)o1)C(C1)CN1c(ncnc1-c(cc2)ccc2F)c1F,2 G857-0118,O=C(CSC(C(CCC1)=C1N1CCN2CCOCC2)=NC1=O)N(CCC1)c2c1cccc2,2 F6725-1193,Cc1nsc(N(CC2)CCC2N(CC2)Cc3c2scc3)n1,2 SA68-0891,Cc(nc1)cnc1C(NCCN(C(CC1)CCN1C(C1CC1)=O)C1CCOCC1)=O,2 F6519-4359,O=C(c1noc2c1CCCC2)NCC(c1cccs1)n1nccc1,2 F6523-0822,Cc1nc(CCCC2)c2c(N(CC2)CCC2NC(c2cccnc2SC)=O)n1,2 Z2330655206,NC(C1(CN(Cc2nc(-c3cccc(Cl)c3)no2)CC1)c1ccccc1)=O,0 SB32-0106,Cc1n[nH]c([C@@H]2[C@@H](COC)CN(Cc3c[nH]nc3-c3ccccc3)C2)n1,0 D473-1212,CC(C)(CS(N1c(cc2)ccc2C(Nc(cccc2)c2C(N)=O)=O)(=O)=O)C1=O,0 Z4335748198,Cn1nccc1-c1cccc(NC(c2n[nH]c(-c3ccco3)c2)=O)c1,2 V030-1770,O=C(C(CCC1)N1C(c1csc(Nc(cc2)ccc2F)n1)=O)NCC1OCCC1,2 Z995123326,OC(C(C1CC1)NC(c1c2OCCOc2ccc1)=O)=O,2 Z4475766863,O=C(C1C(c2cn(-c(cccc3)c3F)nc2)OCC1)N(CC1(F)F)Cc2c1cccc2,2 C519-0695,CN(C1CCCCC1)S(c(cc1)cc2c1N(C)C=C(C(NCCC1=CCCCC1)=O)C2=O)(=O)=O,2 F0594-1743,COc(cccc1)c1-c(o1)nnc1SCc1cc(C(F)(F)F)ccc1,0 SB30-0154,CN(CC1(CCOCC1)N1C(CC2)CCN2C(c2cocc2)=O)C1=O,0 F6755-5429,C(CN(C1)c2nccc3c2ccs3)c2c1ccs2,2 Z54128040,CC(C)(C)NC(c(cc1)cnc1Cl)=O,0 SA90-0049,CC(C)NC(CC(C1)OC(CC2)(CCN2C(c2cncn2C)=O)c2c1cccc2)=O,2 F0806-0840,N#Cc(cccc1)c1NC(COc(ccc(Cl)c1)c1Cl)=O,0 G852-0063,O=C(C=C1)Nc(cc2)c1cc2S(N(CC1)CCN1C(c1ccccc1)c1ccccc1)(=O)=O,2 F6178-7818,Cc1cccc(NC(C(NCC(CC2)CCN2C2CSCC2)=O)=O)c1C,0 F6619-5183,FC(c1cc(F)c(N(CC2)CCN2c2nc(N3CCOCC3)ncc2)nc1)(F)F,2 8244-1278,CN(C)c(cc1)ccc1N(C(CC1Nc(cc2)ccc2N2CCOCC2)=O)C1=O,0 Z1497444933,CN(C)CCN(CC1)CCN1C(CCc(ccc(F)c1)c1F)=O,0 Z3892000391,Cc1c(NCC2(CC3)OCC3(CN)CC2)nc(-c2ncccc2)nc1Cl,2 SA65-1119,O=C(c1cccs1)N1CCC(CCc2noc(C3CCOCC3)n2)CC1,0 Z1633347546,CC(CC(NC(CC1)CCN1C1CCCC1)=O)(c1ccccc1)O,0 SB14-0468,CS(N(CC1)CC1N(C1CCOCC1)C(CC1CCCC1)=O)(=O)=O,2 S932-2732,COc(cc1)cc(OC)c1C(N(CC1)CC1n1nnc(COCC2CC2)c1)=O,2 F1907-9062,CC(C)(C)c1n[nH]c(C(N(CC2)CC2(F)F)=O)c1,0 F6764-1615,Clc1cc2ccc(C3CCN(Cc4nnco4)CC3)nc2nc1,2 Z3290631549,C[C@H](c1ncc[nH]1)NC(Nc1c(N2CCCC2)nccc1)=O,2 SD07-0395,CCOCC(N(CC1)CC11OCc2c(CNC(C3CCOCC3)=O)nnn2C1)=O,0 Z1834126697,CCN(C)C(C(C)NC(Cc1csc(-c2ccc(C(C)C)cc2)n1)=O)=O,0 F543-0641,COc(ccc(Cc1nc(-c(cc2)cc(N3)c2N(C2CCCC2)C3=O)no1)c1)c1OC,2 SA67-0448,CN(C)S(N1CC(CCc2noc(C3CC3)n2)CC1)(=O)=O,0 F6414-3755,CC(CNC(c1cocc1)=O)(c1cc(cccc2)c2s1)O,2 F6604-3010,CC(C)(C)c1nnc(cc2)n1nc2N(C1)CC1N(C)CCc(cc1)cc2c1OCC2,2 Z3556280821,CC(C)(C1)OCCN1c1ncnc(OC2)c1NC2=O,2 Z67676250,CC(C)C(Nc1nc(cc(c(OC)c2)OC)c2s1)=O,0 Z1651452519,Cc(cc(cc1)OC)c1NC(c1ccc(-c2ccccc2)o1)=O,0 F5049-0285,CCS(N(CC1)CCC1(C(N1CCOc2ccccc2)=O)NC1=O)(=O)=O,2 F6805-9843,O=C(CN1CC(COc(nccc2)c2Cl)CCC1)Nc(cccc1)c1F,2 F722-0251,Cc1cc(Cn2c3nnc(-c(cc4)ccc4OC)n3c(N(C)C(N3)=O)c2C3=O)c(C)cc1,2 Z2087486576,CCc(cc(cc1)NC(CN(C=CC=N2)C2=O)=O)c1F,0 Z2002869738,NC(CN(CCC1CCCCC1)C(C(CCC1)CC1(F)F)=O)=O,2 F6793-7623,CC(C)c1ncnc(N2CCN(CC(F)(F)F)CC2)c1F,0 F6261-3935,Cc1c(CNC(c(cccn2)c2OC)=O)sc(-c(cccc2)c2Cl)n1,0 SA42-1010,CN(CC(C1)(CN1C(COc1ccccc1)=O)C1)C1c1noc(-c2ncccc2)n1,2 F6089-3678,CN(CCOc(cc1)c2cc1NC(c1nn(-c3ccccc3)nc1)=O)C2=O,2 Z3268555506,COCCn1nnc(C2)c1CCN2c(cc(cc1)F)c1C#N,2 SD25-0283,Cn1c(C(N2CC3(CCCCC3)C(CCC(NC3CC3)=O)C2)=O)cnc1,2 Z649783520,Cc1c(C(NC(CC2)CCS2(=O)=O)=O)scc1,0 S988-1307,Cc1noc([C@@](CN(C2)C3CCOCC3)(C3)[C@@H]2CN3S(N2CCOCC2)(=O)=O)n1,2 F399-0517,CCOc1c(CN(C2=O)C(SCC(c3ccccc3)=O)=Nc3c2sc2ncccc23)cccc1,0 Z2481222532,O[C@H](CC1)CN1C(C1)CN1S(c(cc1)cc(N2)c1NC2=O)(=O)=O,2 Z3144731002,CC[C@H](c1nnc(N(C2)C3C2CCC3)n1CC(C)=C)O,0 Z2628136287,CSCCC(c1nnc2n1cccc2)NC(C(NCC1=CCCC1)=O)=O,2 Z4119276210,Cc1cc(F)cc(C(NCCc2nn(-c3ccccc3)nc2)=O)c1,0 T408-1906,Cc(cc(cc1)Cl)c1NC(C(CC1)Cc2c1sc(C(N(C)C)=O)c2)=O,2 Z2839305649,NC(CONC([C@H]1OC[C@@H]2[C@H]1CCC2)=O)=O,2 F6561-8141,CC(C)(Cc1ccc2)Oc1c2OCC(N(CC1)CC1N(CCO1)C1=O)=O,2 Z645423024,FC(c1nc2ccccc2c(NCCCCN2CCOCC2)n1)(F)F,0 F6539-2735,CN(C)C(N1CCC(CNC(Cc(cc2)ccc2-c2ccccc2)=O)CC1)=O,2 Z751407910,CC(NC(C1CC1)c(cc1)cc2c1OCCO2)=O,2 F2496-2591,O=C(C1(CCCC1)c1cccs1)OCc1noc(-c(cc2)ccc2F)c1,2 SB36-1095,Cc1c(C(N(C2)[C@H](Cn3nnc(C(N4CCOCC4)=O)c3)CC2(F)F)=O)sc(C)n1,2 F6713-5972,Fc1c(N(CC2)CCN2c(cc2)nnc2-c2cnccc2)ncnc1,2 F5079-0075,O=C(c1cc(CCCC2)c2cc1)Nc1nnc(Cc2cccs2)o1,2 J004-1687,CCc1noc(C(CCC2)N2C(c2c(C)onc2-c(c(F)ccc2)c2Cl)=O)c1,2 Z1129770609,CCC(c1nc(C)cs1)NC(c(cccc1)c1N(CCC1)C1=O)=O,0 C319-0210,Cc1cc(NC(CN(CCc2ccccc2)Cc2ccccc2)=O)nc(-c(cccc2)c2O2)c1C2=O,2 Z2966758081,C[C@@H](C(NCCC1)=O)N1C(c1nn(C2CCOCC2)c(C)c1)=O,2 F2699-0160,CCOC(C(C(OCC(Nc1cc(OC)ccc1)=O)=C1)=NN(c(cccc2)c2Cl)C1=O)=O,0 Z4493465145,Cc1nn(C)cc1[C@H](C1)Nc2cc(C(NC3CCCC3)=O)nn2[C@H]1C(F)(F)F,2 F2017-0350,O=C(CS(c1cn(CC(N2CCOCC2)=O)c2c1cccc2)(=O)=O)NCc(cccc1)c1Cl,2 F6439-4309,O=C(Cc(cccc1)c1Cl)NCCn(cc1)nc1-c1ncccc1,0 F6245-4653,CN1N=C(C(CC2)CCN2C(CSc(cc2)ccc2F)=O)N(C2CC2)C1=O,2 Z1577827665,CN(C)c1cccc(CNC(N2CCC(Cc3cnccc3)CC2)=O)n1,2 Z2965008107,CN(CCN(C)CC1)CCN1C(c1cc(ccc(OC(F)(F)F)c2)c2[nH]1)=O,2 F6357-1895,CC(C)(CNC(C(Nc(cccc1)c1SC)=O)=O)c1cscc1,0 D757-0192,OC(CC1)(CCN1C([C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1)=O)c(cc1)ccc1Cl,2 Z2181771469,CCCCC(C)N(C)C(c1cn(C(C)(C)C)nc1Br)=O,0 Z2089074967,O=C(c1ncccc1)N(CC1)CCN1c1nc(C(F)(F)F)ns1,0 Z1556444445,COCc1nn(CCCC2NC(NC(Cc(cc3)ccc3F)CO)=O)c2n1,2 Z2984403369,CC(c(cccc1)c1Br)n1nnc(CN(C)C(C)=O)c1,0 V012-0905,Cc(cc1)ccc1S(N(C1CCN(Cc2cscc2)CC1)c1cc(F)c(C)cc1)(=O)=O,0 SC98-0986,CCOCCn(c(CC1)c2CN1S(c1cc(F)c(C)cc1)(=O)=O)nc2-c1ncc(C)o1,0 F6438-0149,Cc1nc(N2CCN(C)CC2)nc(C)c1NC(C1CC1)=O,2 Z3347583058,Cc1c(CN(CCC2)C2C(O)=O)[nH]nc1C(F)(F)F,2 SA57-0384,Cc1noc(C)c1CC(N(CC1)CCC1(C1)OCCC1Oc1nccnc1)=O,2 F6192-0732,O=S(Cc1ccccc1)(NCC(c1ccco1)c1cccs1)=O,2 F6481-1488,O=C(Cc1cscc1)N(CC1)CCSC1c(cccc1)c1F,2 F5607-0075,CCCS(N(CC1)CCN1c1ncnc(-n2cncc2)c1)(=O)=O,0 Z1185785078,CCc1n[nH]c(CNC(c(cc2-c3ccccc3)nn2-c2ccccc2)=O)c1,2 SB52-0208,CN(CC(C1)(CC2)CCN2C(c2cocc2)=O)C1c1noc(COC)n1,2 Z1895737648,CC(c1ccnn1C)NCc(cc1)cnc1N1CC(C)OCC1,2 3793-2944,COc1cc(NS(c(cc2)ccc2NC(CN(C(c2c3cccc2)=O)C3=O)=O)(=O)=O)nc(OC)n1,0 E545-0443,Cc(cc1)c(C)cc1N(C(c(oc1c2cccc1)c2N1Cc2cc(OC)ccc2)=O)C1=O,0 3209-1386,CC(c1cccc(NC(c2nn(C(CC(c(cc3)ccc3Cl)N3)C(F)(F)F)c3c2)=O)c1)O,0 S926-1994,COCc1nc(COC(CCC2)CN2C(Nc(cc2)cc(F)c2OC)=O)no1,0 Z608614366,NC(CC(N(CCC1)C1c1cccs1)=O)c1ccccc1,0 Z1684173981,CCc(cc1)ccc1N(CC(C1)c2nc(Cc3cc(C(N)=O)ccc3)no2)C1=O,0 Z1540614898,CC(CC(C1)C2)(CC1(C)C1)CC12C(Nc1cccc(O)c1F)=O,0 L702-0295,CC(C1)N(C(C(C=C2)=NN(CC(N(C)Cc3ccccc3)=O)C2=O)=O)c2c1cccc2,2 Z1002843940,Fc1ccc(CC2CCN(Cc3ncccc3)CC2)cc1,0 F6471-1058,CS(N(C(CC1)C2)C1CC2NC(COc(cccc1)c1F)=O)(=O)=O,0 F6806-7232,O=C(C(CC1)CCN1c(ccnc1)c1Br)NC1CC1,2 Z2410017425,Cc1nc(C)nn1C(C1)CN1C(c(cc1)c(C)c(OC)c1OC)=O,0 D725-0097,O=C(c(cc1)cc2c1OCCO2)Nc(cc(cc1)-c2nc(nccc3)c3o2)c1Cl,0 Z2968404904,Cc1ccc(N2CCN(Cc3nccn3C3CC3)CCC2)nn1,2 F6562-0933,Cn1ncc(C(CN(C2)C(CN(C=NC(C3CC3)=C3)C3=O)=O)c3c2cccc3)c1,2 F3386-2903,CCOc(cccc1)c1N(CC1)CCN1S(c1c(C)cc(C)c(OC)c1)(=O)=O,0 F620-0021,Cc(cc1)c(C)cc1N(CC(C1)c2nc(CN(c(cccc3)c3O3)C3=O)no2)C1=O,0 F6439-4542,O=C(NCCn(cc1)nc1-c1ncccc1)Nc1cccs1,2 Z1928974279,Cn(cc1C(Nc2cc(CN(CC(N)=O)CC3)c3cc2)=O)nc1-c1cccs1,2 D757-0160,O=C([C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1)NCC1(Cc2nnc3n2cccc3)CCCCC1,2 Z3521138449,CC(CN)(CC1)CCN1C(C(Cc1ccccc1)NC(OC)=O)=O,0 S639-3746,CN(C)C[C@@H](CN(C1)c2ncccn2)[C@H]1NC(COCc1ccccc1)=O,0 S724-0666,CC(C(N(C1)CC1n1nnc(C(N2CCOCC2)=O)c1)=O)Oc1ccccc1,2 Z1558650597,CC1N(Cc2ccc(CNC(NC3CC(C)OC(C)C3)=O)cc2)CCCC1,2 S720-0485,CCn1ncc(S(N(C[C@H](C2)Oc3ccccc3)[C@@H]2C(NC)=O)(=O)=O)c1,2 F862-0240,CC(CCc1ccccc1)NC(CC(CC1)CCN1C(c1c(C)c(C(OC)=O)c(C)[nH]1)=O)=O,2 S543-0560,CC(C)NC(N(C1CC1)C1CC(CC2)(CCN2C(NC(C)C)=O)OCC1)=O,0 S614-0957,Oc(c(CN(CCCC1)C1c1nc(CCOCC2CCCC2)no1)ccc1)c1F,0 Z2352634572,CC(C)n1ncc2cc(C(Nc3cc(C(C)C(O)=O)ccc3)=O)cnc12,0 Z1995344545,Cc1c[nH]nc1C(N(CC1)CCN1c(ccc(C#N)c1)c1F)=O,0 Z433986302,Cc1ccc(-c2n[nH]c(C(NCC3CC3)=O)c2)o1,2 Z4656798291,O=C(CN(CC1)CCC1(CC1)CCN1C(CCn1nncc1)=O)N1CCC1,2 Z1311821489,CN(CCc(cc1)ccc1F)C(Nc1cn(CC2OCCC2)nc1)=O,0 F6514-7924,O=S(c(cccc1)c1Cl)(NCCn1nccn1)=O,0 F6443-8310,O=C(C(CCC1)N1c1nc(cccc2)c2o1)Nc1nc(ccc(Cl)c2)c2s1,2 F5033-7989,O=C(c1noc(-c2ccco2)c1)NCC(CC1)CCN1C(c(cccc1)c1F)=O,2 Z2323693364,Cc1nccn1-c1nc2ccccc2c(C(NC(CC2)(CC3)CCC23F)=O)c1,2 F5857-9125,CC(CNC(c1cccc2ccccc12)=O)(c1ccco1)O,2 F0687-0473,COc1c(C(CC2)CN2C(Cc(cccc2)c2Cl)=O)cccc1,0 Z1259049818,CCc1nsc(N(CC2)CC2N)n1,0 Z3687089662,Cc1coc(CNC(N(C[C@@H]2CC(NC)=O)C[C@@H]2O)=O)c1,0 V023-5773,Cc1c(C)sc2c1c(N(CC1)CCN1S(c1ccccc1)(=O)=O)nc(C1CC1)n2,0 F5834-2933,O=C(c1ccco1)N(CC1)Cc2c1ccc(NC(NC1CCCCC1)=O)c2,2 F6372-1232,COc(ccc(F)c1)c1S(Nc1c(Cc2nc(-c3cnccc3)no2)cccc1)(=O)=O,2 F6412-6636,Cc(cccc1)c1C(NCC#CCOc(cccc1)c1C(N)=O)=O,0 T991-1622,COc(ccc(Cl)c1)c1NC(N(CCC1)CCN1C(CCN1CC2CC2)C1=O)=O,2 S625-2070,CN(C[C@@H](C1)O)[C@@H]1c1nnc(C2)n1CCN2S(c1cc(F)cc(F)c1)(=O)=O,2 F6734-1514,O=C(c(c(F)ccc1)c1F)N(C1)CC(C2)C1CN2c(cc1)ncc1F,0 F6258-0229,CC(N=CN1CCNC(c(o2)ccc2Br)=O)=CC1=O,2 F6416-8656,Cc1cc(C(CCNC(C2CC=CCC2)=O)O)c(C)o1,2 F6567-8958,Cc1cc(N2CC(CN(Cc3ccc(C(F)(F)F)cc3)C3)C3C2)ncn1,0 Z3071552986,OC1(COC1)c(cc1)ccc1C(NCC1(CCCC1)C(F)(F)F)=O,2 Z2179767243,CC(C)(C1)C1(C#N)NS(c(cc(cc1)Cl)c1Br)(=O)=O,0 F6782-0676,Nc1c(-c2cccc(Cl)c2)nnn1-c1ccccc1,0 F5600-0028,Cc(cc1)nnc1NCCNC(c(cccc1)c1Cl)=O,0 Z2717193366,Fc1cnc(CN(CC2)C[C@@H]2Oc2cccc(Cl)c2)cc1,0 D430-2322,Cc1nc(N2CCCC2)cc(Nc(cc2)ccc2NC(Nc2cc(OC)cc(OC)c2)=O)n1,0 Z3599800926,CC1(CCC(Nc2nc(C3CC3)ns2)=O)N=N1,2 V007-1657,O=S(c1ccccc1)(N(CCC1)C1c1nc(cc(cc2)-c3ccc(C(F)(F)F)cc3)c2o1)=O,0 Z2477783112,CCn1nc(CC(N(CCCC2)C2C(N)=O)=O)cc1,0 F2135-1762,Fc1cccc(Cl)c1CSc1nncc2ccccc12,0 F6524-5391,O=C(Cc(cc1)cc2c1OCO2)NCc1nnc(cc2)n1nc2N1CCCC1,2 F2880-1600,CN(C)C(CNC(C(NCc1cccs1)=O)=O)c1ccco1,2 F5269-0385,O=C(c1csc2nc(-c(cc3)ccc3F)cn12)N(CC1)c2c1cccc2,2 F6186-1460,CC(CCSC)(CNC(Nc(cccc1)c1Cl)=O)O,0 Z2352656405,CCC(CNC(c1ccc(C)s1)=O)(C(O)=O)c1ccccc1,0 Z941356822,CC(C)n1ncc2cc(C(N(CC3)c(cc4)c3cc4OC)=O)cnc12,0 Z2645600475,Cc(ccn1nc2)nc1c2C(N(CC1)C[C@@H](CO)[C@H]1c1ccccc1)=O,2 Z3269089371,CC1(c2cccc(C(O)=O)c2)n2nnnc2-c(cccc2)c2N1,0 Z3019121968,CCNC(NC(CC1C(F)(F)F)Cc2c1cn[nH]2)=O,0 T955-0388,O=S(Cc1ccccc1)(N(CCC1)CC1c1nc(CCOc(cc2)ccc2F)no1)=O,2 F835-0629,Cc1c(CSC(n(c2c3)nc3-c3ccco3)=NNC2=O)nc(-c2ccccc2)o1,0 Z1170080936,CS(c(cc1)ccc1-c1nc(Cc(cccc2)c2Cl)no1)(=O)=O,0 G851-1175,O=C(Cn1nc(C(N2CCCC2)=O)c2c1cccc2)N(CC1)c2c1cccc2,2 Z1507465947,O[C@H](CC1)CC[C@@H]1NC(c(cccc1)c1SCc1cn(cccc2)c2n1)=O,0 S740-0946,CCCN(C([C@H](C[C@@H](C1)NC(c2nccc3ccccc23)=O)N1CC1)=O)S1(=O)=O,2 F6415-1177,O=C(C1CC1)N(CCc1cccs1)Cc1cocc1,2 SA04-0133,Cc1ncc(COC)c(C(CCC2)CN2S(c(ccc(F)c2)c2F)(=O)=O)n1,0 Z1430851793,OC(CNC(C(C(c1c2)=O)=CN(C3CC3)c1cc(Cl)c2F)=O)C1CCCCC1,2 SC19-0454,CCn1nc(CN2CCN(Cc3ccc(C)o3)CC2)c2c1CCOC2,2 Z1250967012,CC(Nc1nc(-c(cc2)ccc2O)cs1)=O,0 F6458-0252,CC(N(CC1)CCN1c(cc1)nnc1-n1ncnc1)=O,2 S700-0601,COc(cc1)nc(OC)c1C(N(C1)CC1c1nc(CCOCC2CC2)no1)=O,2 Z737952858,Cc1cccc(C(N)=O)c1NS(c1csc(C(O)=O)c1)(=O)=O,0 F5831-8169,O=C(NCCN(CC1)CCN1c1ccccc1)Nc1c(C(F)(F)F)cccc1,0 Z1455064334,Cc(cc1)nn1-c1cccc(C(NCCC(O)=O)=O)c1,0 Z318897100,FC(c1nc(NCCCOC2CCCCC2)ncc1)(F)F,2 F2036-0132,Cc1cc(S(Nc(cc(cc2)N(CCC3)S3(=O)=O)c2OC)(=O)=O)c(C)cc1,0 F6443-6614,O=C(c1c(C(F)(F)F)cccc1)NCC(CCC1)N1c1nccs1,0 F6795-3511,Cc1c(C)nc(cc2)n1nc2N1CCN(CCn2nncc2)CC1,2 Y040-2655,CC(C(NCC(O)=O)=O)Oc(cc1)c(C)c(O2)c1C(CCC1)=C1C2=O,0 F3406-9136,CC(N1CC(Nc(cc(cc2)Cl)c2OC)=O)=NC=C(C(NC2CCCC2)=O)C1=O,2 F6560-1689,Cc1nc2ncnn2c(OC(C2)CN2S(c2c(C(F)(F)F)cccc2)(=O)=O)c1,0 Z3392621641,NC([C@@H](CN(C1)c(c(F)cnc2)c2Cl)[C@H]1c1ccccc1)=O,2 F2493-0128,COC(c(cccc1)c1C(NCc1noc(-c2ccccc2)c1)=O)=O,0 K221-2633,CC(CCc1ccccc1)NC(CCN(C(c(cccc1)c1N1)=O)C1=O)=O,2 Z1070063854,COCC(N(CCC1)CCC1c1ccccc1)=O,2 SA70-0688,Cc1nc(C(CCOC)(CCC2)CN2S(c(cc2)cc(C3)c2N(C)C3=O)(=O)=O)no1,2 F6442-1808,CC(C)CS(C(C1)CN1C(c1nn(-c2ccccc2)nc1)=O)(=O)=O,0 Z1415578056,CCC(CC)CC(N(CCC1)S1(=O)=O)=O,0 F6381-4190,CSc(cccc1)c1C(N(CCCC1)CC1c(cc1)ccc1F)=O,0 Z1738891820,Cc(c(C)c(cc1)S(NC(CCC(O)=O)Cc2ccccc2)(=O)=O)c1OC,0 F6201-0469,Cc1cc(CNC(NCc(cc2)ccc2F)=O)c(C)o1,0 Z2755691877,Cc1c(C(O)=O)sc(C(CC2)CCN2C(CC2=CCCCC2)=O)n1,2 F633-0435,CC1Oc(ccc(S(N(CC2)CCC2C(NC2CCCC2)=O)(=O)=O)c2)c2NC1=O,2 F5857-2450,OC(CNS(CCc1ccccc1)(=O)=O)c1cccc2ccccc12,2 F6451-2836,Cc1noc(C)c1CC(NCC(c(cccc1)c1Cl)OC)=O,0 Z4080122157,CC(N(CCC1NCCc2cn(cccc3C)c3n2)c(cc2)c1cc2F)=O,2 F6754-9761,Cc1nc(SC)nc(NCc(c(F)ccc2)c2F)c1,0 F6125-3284,O=C(C(C1)CN1S(C1CC1)(=O)=O)NCc1nc(cccc2)c2[nH]1,2 F6445-3181,Cc1nn(cc(CCCNC(CN2N=CC=CC2=O)=O)cn2)c2c1,2 Y205-0949,Cc1ccc(-c2nc3ccccc3c(C(N(CC3)CCN3S(C)(=O)=O)=O)c2)o1,2 Z1238476226,CC(C)NC(CN(C)Cc1nc(C(C)(C)NC(c2cccc(Cl)c2)=O)no1)=O,0 Z1560604993,CCC(N(CC1)CC1C(Nc1nn(CCC#N)c(C)c1)=O)=O,2 Z1996684704,O=C([C@@H](CCC1)NC1=O)Nc1nc(-c(cc2)cc3c2OCC3)ccc1,2 F6761-7712,Cc1nnc2n1ccnc2N(CC1)C(C2)C1CN2c1nccc(C(F)(F)F)c1,2 Z1439697339,Cc(cc(cc1)Oc2ncccc2C#N)c1Br,0 Z808571918,O=C(CC1NCCC1)Nc(cc1)cc(Cl)c1F,0 Z1724126152,COC1(CCCCC1)C(NCc(cc1)cnc1-n1cncc1)=O,2 F6443-8181,O=C(C(CCC1)N1c1nc(cccc2)c2o1)NCc(cc1)cc2c1OCO2,2 V019-3589,CC(CC1)CCN1c1c(CN(CC2)C(c3ccco3)=O)c2nc(N2CCOCC2)n1,2 Z3555723055,C(CC1)CC1Nc1nc2ncccc2cc1,2 F6619-5830,COc1nc(N(CC2)CCN2c2nc(CCC3)c3cc2C#N)ncc1,2 F6519-5778,O=C(C1Oc(cccc2)c2OC1)NCC(c1ccco1)n1nccc1,2 G015-1110,O=C(c1cccn1-c1nnc(N2CCCCC2)s1)N(CC1)CCN1C1CCCCC1,2 SA46-0580,COc1ccc(C2(CC2)C(N(C2)CC2(C2)OCC2N2CCCCC2)=O)cc1,2 F6515-0083,O=C(CSc(cc1)ccc1F)NCc1cccnc1-c1cscc1,2 SC42-0074,Cc1nc(CC2CC(CC3)(CCN3S(N(C)C)(=O)=O)OCC2)no1,0 S976-0493,O=C(C(CCC1)(CN1C(NCCc1ccccc1)=O)F)NCc1cnccc1,2 Z3173924242,Cc(cc(cc1)N2CCOCC2)c1NC(N1C2(CCCC2)C=CC1)=O,2 F6594-1186,O=C(C=C1)N(CC2CCN(CCc(cc3)cc4c3OCC4)CC2)N=C1n1ncnc1,2 Z2790327125,COc(c(F)ccc1)c1S(N(CC(O)=O)C1CCOCC1)(=O)=O,0 Z4367953504,Cc(cc1C)cc(C)c1S(NC(CCC1OCCC1)=O)(=O)=O,2 P702-0527,Cc1ccc(c(Nc2cc(F)cc(F)c2)c(cn2)-c3nc(C4CC4)no3)c2n1,0 F6619-6717,Cc1nc(-n2nccc2)cc(N2CCN(Cc(c(F)ccc3)c3Cl)CC2)n1,0 SA01-0870,Cc1cc(C(N(CC2)CC2c2nc(N(C)C)ncc2C(N(C)C)=O)=O)cnc1,0 SC12-0818,Cc(cccc1)c1NC(N(CCCN1CCCC1)C1CCOCC1)=O,2 Z1737941521,Cn(c(C(O)=O)c1)nc1NS(c1cccc(Cl)c1Cl)(=O)=O,0 F6541-7633,OC(COC1)C1N(CC1)CCN1c(cccc1)c1F,2 Z3519004270,Cc(c1c2cc(C(N[C@H](CC3)CC[C@H]3NC)=O)[nH]1)ccc2OC,0 Z1941228754,Cc(oc1ccc2)nc1c2C(NC1CCN(C)CC1)=O,2 8019-8800,COc(c(OC)c1)cc(Cc(c2c3)nccc2cc(OC)c3OC)c1NC(CSC1=Nc(cccc2)c2NC1=O)=O,2 Z1191284274,CC(C(N(CC1)CCC1c1nncn1C1CC1)=O)Oc(ccc(F)c1)c1Cl,2 F6443-6837,O=C(Cc1c[nH]c2c1cccc2)NCC(CCC1)N1c1nccs1,2 F6802-8109,O=C(CN(CCC1)CC1C(N1CCSCC1)=O)Nc1cc(C(F)(F)F)ccc1,0 Y044-0881,Cc1c(C)sc(N=CN2CC(c(cc3)cc(CC4)c3N4S(C)(=O)=O)=O)c1C2=O,2 SB32-0706,COC[C@@H](CN(C1)S(C)(=O)=O)[C@H]1c1nc(C2CC2)n[nH]1,0 Z1067745948,Cc1c(CNC(c(cc2)ccc2N(C)C)=O)sc(-c2ccccc2)n1,0 F6512-6993,Cc1cc(C(N(CCC2)CCN2S(c2cn(C)nc2)(=O)=O)=O)c(C)o1,2 Z2781252875,O=C([C@@H](CCC1)NC1=O)N[C@@H]1[C@@H](c(cc2)cc(F)c2Cl)OCC1,2 Z738775550,OC(c(cc1)ccc1C(Nc(cc1)ccc1C(N1CCCCCC1)=O)=O)=O,2 C466-0491,Cc1cc(N([C@@H](c(cc(cc2)Br)c2OC)N2[C@@H]3CCC2)C3=O)no1,2 Z373939990,CN(C)S(c1cc(C(NCC(Nc2cc(CN3CCCC3)ccc2)=O)=O)ccc1)(=O)=O,2 F6485-1884,Cc1nc(OC(CC2)CCC2NC(COc(cccc2)c2OC)=O)nc(C)c1,0 F5476-0085,CN(C)C(CNC(c(cccc1)c1Br)=O)c1cn(C)c2c1cccc2,0 Z3079526141,CC(c(cc1)cc(OC)c1S(C)(=O)=O)Nc1nc(C)nc(C)c1,0 Z2955093956,CC(c(cc1)c(CC2)cc1F)N2C(Cn1nc(C)c2cccnc12)=O,0 Z2230778682,CCCc1c(C(Nc(cc2)cc(NC(N)=O)c2F)=O)[nH]c(C)c1C(C)=O,0 F6442-1597,CC(C)CS(C(C1)CN1C(c1c(C)oc(C)c1)=O)(=O)=O,0 SA45-0137,CN(C)C(C1N(C)CCCC1(CC1)CCN1C(c(cc(cc1)F)c1F)=O)=O,2 Z2959355482,OCC(CN1CCOCC1)NC(c1cc2cccn2cn1)=O,2 F6259-2554,O=C(C(CCC1)CN1c1ncnc(C2CC2)c1)Nc(cc1)cc(Cl)c1F,0 F6755-2735,Cc1nc(CN(CC2)CCN2c2c(C)c(C)ccc2)no1,0 SC21-0373,Cc1cnc(-c2nn(C)c(CC3)c2CN3C(NCCc2ccccc2)=O)n1CC1CC1,2 F6786-7718,O=S(c1cccc(Cl)c1)(N1CC(COc(cc2)nn3c2nnc3C2CC2)CC1)=O,2 Z298933748,CNS(c1ccc(CNC(c(cccc2)c2-c2ncc(-c(cccc3)c3F)o2)=O)s1)(=O)=O,0 Z1978452413,OC(CC1)(CCN1C(CCc1ccccc1)=O)c1nnn[nH]1,0 P120-0803,Cc(cc1)ccc1C(NC1=CC=C(C)N(CC(N2CCN(C)CC2)=O)C1=O)=O,2 Z2700775440,CC(C)(C)c1noc(-c2cn(C3CC3)nc2)n1,2 F1681-0055,CC(c(cccc1)c1OCC(COc(cccc1)c1C(C)=O)O)=O,0 F6571-5714,CC(Cc1csc2c1cccc2)NC(Cc(cccc1)c1Cl)=O,0 J006-1821,Cc1cccc(C2N(Cc3cccc(OC)c3OC)CCCCC2)c1,0 F782-1498,O=C(C1CCC1)Nc(cc1)cc2c1sc(NC(C1CCCCC1)=O)n2,2 Z2959349979,Cc(ccnc1)c1N(CC1)CCN1C(C(C(OC)=C1)=CNC1=O)=O,2 7287-0230,Cc1c(c2ncnc(N(CC3)CCN3c3ccccc3)c2s2)c2nc(C)c1,2 F6507-5901,Cn1c(C(CCNC(CCc(cccc2)c2Br)=O)O)ccc1,2 F5865-0314,Cc1nc(Nc(cc2)ccc2NC(c2ncccn2)=O)nc(N(C)C)c1,2 F6481-3766,O=C(C1CCOCC1)N(CC1)CCSC1c1ccco1,2 F3097-4767,CC(C)Oc(cc1)ccc1NC(c1cccc(Cl)c1)=O,0 SC66-0002,Cn1c(C(CN(C2)C(C3CCCCC3)=O)C22CCOCC2)nnc1,2 Z1536953633,CO[C@@H](CC1)CN1C(c1cc(OC2CCC2)ncc1)=O,0 SD61-0497,O=C(C(C1)C2(CCC2)CN1C(c1nc2ccccc2cc1)=O)NCc1ccncc1,2 F6363-0742,O=S(Cc1ccccc1)(N(CC1)CCN1c1ncnc(-n2cccc2)c1)=O,2 Z1738497825,CCC(C)c(cc1)ccc1S(NCCc1nc(C)c(C(O)=O)s1)(=O)=O,0 Z1994054109,O=C(c1cn(CCCC2)c2n1)NCC1CN(CC(F)(F)F)CC1,2 Z1204113020,Cc1cc(OC(F)F)c(C(N2CC(CCCC3)N3CC2)=O)s1,2 S734-0939,COc(cc1)ncc1C(NCC(N(CCCCCNC(C1)=O)C1c1ccccc1)=O)=O,2 Y044-1750,CC(C)C(Nc1c2cccc1)N(CC(Nc1nc(CCC3)c3s1)=O)C2=O,2 F5596-1005,O=C(c1cscc1)N(CC1)CCC1c1nnc(-c(cc2)ccc2F)o1,2 F6416-7969,OC(CCNC(CC1CCCC1)=O)c1cocc1,2 F1878-0816,CC(C)(C)n1nc(CSC2)c2c1NC(CN(c(cccc1)c1O1)C1=O)=O,2 G115-0537,CC(CCNS(c1ccc(C(C=C2)=NNC2=O)s1)(=O)=O)N1CCOCC1,2 F6619-5930,FC(c1ccnc(N2CCN(Cc(ccc(F)c3)c3F)CC2)n1)(F)F,0 Z772254134,O=C(c(cccc1)c1OC(F)F)Nc(cc1)ccc1-c1cnco1,0 K978-0758,Cc(cc1)ccc1S(CCC(NCc(cc1)ccc1Cl)=O)(=O)=O,2 Z2781379693,CSC(CC1)CCN1C(c1ccc(Cn2ncnc2)cc1)=O,2 F3406-5868,CCn(cc1C(NC2CCCCC2)=O)nc1S(N(CC1)CCN1c1cccc(Cl)c1)(=O)=O,2 Z2273497460,Cc1cc(N2[C@H](COc3ccccc3)CCC2)ncn1,0 S897-1052,CCc(cccc1)c1S(N(CC1)CCC1Oc1nc(C(C)C)nc2c1CCOCC2)(=O)=O,0 Z1531971123,CN(C(CCN1)C1=O)C(CCc(s1)ccc1Cl)=O,2 D074-0013,Oc(cccc1)c1-c1n[nH]c2c1C(c1cc(Oc3ccccc3)ccc1)N(CC1OCCC1)C2=O,2 F6529-2315,Cn(cc1C(N(CC2)CCC2N(CC(N2c3ccccc3)=O)C2=O)=O)nc1OC,0 F6089-2986,Cn1c(cccc2)c2c(CC(Nc(cc2)cc(C3)c2N(C)C3=O)=O)c1,2 Z2274792485,Cc1nsc(N=CN2Cc3cnc(C)s3)c1C2=O,0 F6517-0078,COc1cccc(CC(NCC(c2ccc(-c3ccco3)o2)O)=O)c1,0 Z803460976,OC(C1(CCCCC1)n1cncc1)=O,0 Z2755335596,Cc1c(C(N(C)CCC(O)=O)=O)sc(C)c1,0 F6783-6624,CC(C)n1c(N2CC(CN(C3)C(c4c[nH]cn4)=O)C3C2)nc2c1cccc2,2 F6656-2262,Cc1nc(CN2CCC(COc3nnc(CCC4)c4c3)CC2)co1,2 F6562-1875,CCc1nc(ccc(C(NCc2cncc(N(CCC3)C3=O)c2)=O)c2)c2s1,2 S837-1299,COCCCNC([C@H](CN(Cc1ccccc1)C1)[C@H]1C(O)=O)=O,0 F5310-0068,O=C(C1(CCCC1)c1cccs1)Nc(ccc(F)c1)c1F,0 SB03-0365,Cc1c(C(N(C)CCN(C2CCOCC2)C(CCC2)CN2C(C2CC2)=O)=O)sc(C)n1,0 F6439-4701,O=C(c1noc(-c2ccco2)c1)NCCn1nc(C(F)(F)F)cc1,2 F6014-0078,O=C(C(c1ccccc1)n1cccc1)NCCc1c[nH]c2c1cccc2,2 Z1931196446,Cn1nc(C2COCCC2)cc1NC(N[C@H]([C@@H](C1)O)c2c1cccc2)=O,2 Z1507436185,O[C@H](CC1)CC[C@@H]1NC(N(CC1)CCC1c1cccc2ccccc12)=O,2 F6456-1284,CCOc(cccc1)c1NC(C(CCC1)CN1c1ncnc(-n(cc2)c3c2cccc3)c1)=O,2 8019-0918,CCOC(C(C(F)(F)F)(c(cc1)cc(OC)c1NC(NC1CCCCC1)=O)O)=O,0 Z2974988506,Cc1cc(CO)cc(C)c1CNc1nc(C)cc(OC)n1,0 S555-0164,O=S(Cc1ccccc1)(N1Cc(cc(cc2)N3CCOCC3)c2OCC1)=O,0 C169-0391,CCc(cccc1C)c1Nc1c(-c(cc2)ccc2N2CCOCC2)nc2n1ccnc2,0 Z952384408,CC(CNC(c1nocc1)=O)N1CCC(C)CC1,2 S296-1609,CCC(c1cccs1)N(C([C@H]1[C@@H]2CN(CCC(C)C)C1)=O)C2=O,0 F6511-9322,OCCc1cn(-c(cccc2)c2Br)nn1,0 Z1390245716,CC(CC(N(CC1)CCNC1=O)=O)COC,0 F6442-1676,CC(C)CS(C(C1)CN1C(C1(CCOCC1)c1ccccc1)=O)(=O)=O,2 Z3079493075,CC1(C)c2nc(Cl)nc(N3C[C@H](CCO)[C@H](CCO)C3)c2CCC1,0 F5527-2206,Cc1cc(NC(C(CCC2)CN2c(cc2)nnc2-c(cc2)ccc2Cl)=O)no1,2 S530-0241,CC(C)N(CC1)CCC1(CN(C1)C(C2(CC2)c2ccccc2)=O)Oc2c1cccc2,2 SB73-0229,O=C([C@H](C[C@@]12CN(Cc3ccccc3)CC2)NC1=O)NCC1CC1,2 F6515-1843,O=C(CSC1CCCC1)NCc1c(-c2ccco2)nccc1,2 Z2446483031,Cn1ncc(CC(N(CC(O)=O)C2CCOCC2)=O)c1,0 4401-0056,CC(c1ccccc1)NC(CCC1)c2c1c(cc(cc1)-c3ccccc3)c1[nH]2,2 Z1466348895,Cc1nc(-n2nccc2NC(c(ccc(Cl)c2)c2Cl)=O)nc(C)c1,0 S976-1556,O=C(C1(CN(Cc2c[nH]nc2-c(cc2)ccc2F)CCC1)F)NCc1ccncc1,0 SB20-0843,CCn1ncc(C(N2[C@H](Cn3nnc(C(N(CC4)Cc5c4cccc5)=O)c3)CCC2)=O)c1,0 V027-3252,CC(C)Cn1c(S(Cc2cccc(Cl)c2)(=O)=O)ncc1CN(CC1OCCC1)S(c1ccccc1)(=O)=O,2 8013-6071,CC(c1nc(cccc2)c2n1CCC1CCCCC1)O,0 S984-0874,CN(C)C([C@@](CN(C1)C(COc2ccccc2)=O)(C2)[C@@H]1CN2C(c1nccnc1)=O)=O,0 Z1956091641,Cc(ccc(C(N(CC1)CCC1(COC)C(O)=O)=O)c1)c1Cl,0 Z1549724738,COc1cccc(C(C(NCC2CN(CCc3ccccc3)CC2)=O)O)c1,2 Z1544805819,O=C(NCc1noc(C2CC2)n1)NC1CC1,2 K284-3747,O=C(CCN1C(SCC(NCC2OCCC2)=O)=Nc(cccc2)c2C1=O)NCCc1ccccc1,2 Z3132876021,CCOc1cccc(CC(N(CC2CCC3)CC23N)=O)n1,0 G788-0628,Cc(cc(n1nc2)SCC(Nc(cc3)cc4c3OCCO4)=O)nc1c2-c(cc1)ccc1OC,2 Z1070746218,CCn1ncc(S(N(CC2)CCC2C(NC)=O)(=O)=O)c1,0 V001-6762,O=C(C(C1CCCC1)N(CC1)CCN1C(Nc(cc1)ccc1F)=O)N1CCCCC1,0 F5831-8993,O=S(C1CC1)(NCCN(CC1)CCN1c(cccc1)c1F)=O,2 Z1157917309,CN(C)C(c1cc(NC(c2cncc(-c3cn(C)nc3)c2)=O)ccc1)=O,0 Z2959686390,CCS(C(C=C1C(N(C)[C@H](C2)C[C@H]2OC)=O)=CNC1=O)(=O)=O,2 Z2270170692,CC(CC#N)N(C)C(c1csc(Nc2cc(F)cc(F)c2)n1)=O,0 Z1128813474,O=C(C(CCCC1)N1C(c1ccccc1)=O)N(CCC1)CC1C1OCCO1,0 Z1403684744,Cc(cc1)cc(C(C(C(Nc(cc2)ccc2F)=O)=C(C)N2)NC2=O)c1OC(F)F,0 F2774-1223,O=C(CN(C(C=C1)=O)N=C1c(cc1)ccc1Br)NC1CCCC1,2 Z2527301680,CCC(C)(c1cn(-c2ccccc2)nn1)O,0 Z433263800,CS(NC(CCC1)CN1C(Nc1cc(-c2nnc3n2CCC3)ccc1)=O)(=O)=O,2 Z2295169379,OC(c1ccc(CN(CC2)CCC2NS(c(cc2)ccc2F)(=O)=O)cc1)=O,0 F793-0210,COc1cc(NC(N(CCC2)C2c2nnc(C(Nc(cc3)ccc3Cl)=O)s2)=O)cc(OC)c1,0 F6389-0246,O=C(c1nccc(-n2cccc2)c1)Nc1nc(CCCC2)c2s1,2 F6773-4132,CC(C)(C)c(cc1)nnc1N(CC1)CCC1Oc1nc2ccnn2cc1,2 Z2271407748,CS(N(CCC1)CC1Nc1ncnc2c1c(cccc1)c1[nH]2)(=O)=O,2 F0006-0078,CC1=CC=CN2C1=Nc(n(C)c(C(O)=O)c1)c1C2=O,0 Z27993242,Cc1cccc(C(NCC(Nc(cc2)c(C)cc2Br)=O)=O)c1O,0 Z2904115174,O=C(NCc1cnccc1)N(C[C@H]1COC2)C[C@]12c1ccccc1,2 F6573-7161,COc(ccc(S(N(CCN1c2ncccc2)CC1=O)(=O)=O)c1)c1Cl,0 E533-0615,CC(C)CCNC(C(C)(Cn1c2ccc1-c1ccco1)N(CCc1ccccc1)C2=O)=O,0 F6764-1565,Cc1nc(n(C)nc2)c2c(N(CC2)CCC2c2ccc(cc(cn3)Cl)c3n2)n1,2 F6475-6466,COC(C(Cc1c[nH]c2c1cccc2)NC(c1cc(OCC2CC2)ncc1)=O)=O,2 Z2923538371,OC(c1ccc(CCNC([C@H](C2)[C@H]3O[C@@H]2[C@H]2[C@@H]3C2)=O)cc1)=O,2 Z2033141222,CC(C)c1c(C(N(C)Cc2nnc[nH]2)=O)occ1,0 E960-1368,CCC(C)NC(CSC(N(Cc1cccs1)C1=O)=Nc2c1n(CC)nc2C)=O,2 D622-0096,O=C(Cn1c(cc2OCCOc2c2)c2nc1C(F)(F)F)N(CCC1)c2c1cccc2,2 M950-0558,Cc1c(-c2nnc(C3CC3)o2)[nH]c(C)c1S(NCc1cc(F)cc(F)c1)(=O)=O,0 F6445-2803,O=S(c(cc1)ccc1OC(F)(F)F)(N(CC1)c(cc2)c1cc2-c1ccncc1)=O,0 F6473-7316,O=C(Cc(cc1)cc2c1OCO2)N(C(CC1)C2)C1CC2N(C(CC1)=O)C1=O,2 Z1964691700,COCCC1(CNS(c2c[nH]c(C(O)=O)c2)(=O)=O)CC1,2 Z2409360973,Cc(cc1)cc(C)c1S(N(CCC1)CC1n1nncc1)(=O)=O,0 F6529-6468,COCCN(C(CN1C(CC2)CCN2C(CSCc2ccccc2)=O)=O)C1=O,2 F6604-2188,Cc1c(C(N(C)C(C2)CN2c(cc2)nn3c2nnc3C2CCC2)=O)scn1,2 Z451397930,CCNC(c1ccc(CNC(C(CCC2)CN2C(N2CCCC2)=O)=O)cc1)=O,0 Z733924334,NC([C@H](C1)N(Cc2cccc(C(N3CCCCC3)=O)c2)Cc2c1cccc2)=O,2 Z3568221055,CC1C(CCOC(c2ncnc3c2cc[nH]3)=O)OCC1,2 SC04-0547,CC(C)Cc1nc(CCOC(CCC2)CN2C(c2coc(C)n2)=O)no1,0 8003-0194,CN(CC1)CCN1C(c1nn2c(C(F)(F)F)cc(-c3cccs3)nc2n1)=O,2 F6514-7663,O=C(c1cc(cc(cc2)F)c2s1)NCCn1nccn1,2 F6416-7898,Cc(cccc1)c1NC(NCCC(c(cc1)cc2c1OCO2)O)=O,2 G765-0628,COc(cc1)cc(CNC(NC(C2)COc(cc3)c2cc3OC)=O)c1OC,0 Z4970359999,CC(C)(C)OCc1cc(C(Nc2c(ccs3)c3nc(-c3ncccc3)n2)=O)no1,0 Y031-6726,CCC(C)c(cc1)ccc1NC(Cn1c(C(N(C)C(N2C)=O)=O)c2nc1)=O,2 F6312-0207,O=C(C1c(cccc2)c2Oc2c1cccc2)NCCCn1c2ncccc2cc1,2 F6523-2880,CCn1c(-c2noc(CNC(C3=CC=CN(C)C3=O)=O)n2)ccc1,2 F6609-1895,O=C(COC(c1cc(Br)cnc1)=O)NCc(cc1)cc(Cl)c1F,0 F6510-2042,CN(c(ccc(F)c1)c1N1CCNC(COc(ccc(Cl)c2)c2Cl)=O)S1(=O)=O,2 Z645520588,CCN(CC1)CCN1c1ncc(CNc2ncnc3c2cn[nH]3)cc1,2 F6574-0192,O=C(Cc(c(F)ccc1)c1Cl)NCc1nccnc1-c1cocc1,0 F6438-6725,O=C(c1cc(Br)cnc1)NC(COC1)C1F,0 Z4826538575,CCc1c(C(NCc2nccc(N(C)C)c2)=O)n(cc(cc2)Cl)c2n1,2 F6502-5255,CC(C(Nc1cn2nc(C(F)(F)F)cc2nc1)=O)Oc1ccccc1,0 Z1319602913,CNC([C@H](Cc1c[nH]c2c1cccc2)NC(c(cc1)cc2c1[nH]nc2)=O)=O,2 Z2444625797,CC1(CCN(Cc(cc2)cc(S3)c2N(C)C3=O)CC1)C(O)=O,0 Z2305234770,Cc(ccc(S(NC1CC1)(=O)=O)c1)c1C(N1C2COCC1CC2)=O,2 F6473-0702,CN(C(C=C1)=O)N=C1C(N(C1)CC1N(CC1)Cc2c1scc2)=O,2 S689-0528,O=C(C(C1)CN(C(C2)CN2S(c2cccs2)(=O)=O)C1=O)N1CCCC1,2 F0696-0471,Cc(cc1)c(C)cc1N(C(C(C(Nc1cccc(Cl)c1C)=O)=CN1)=O)C1=O,2 Z2110667527,CC(c1nnc(C2CCCC2)n1CC1)N1C(NCc1ccc(CN(CCC2)C2=O)cc1)=O,2 F6222-0100,O=C(C1CCCCC1)Nc1cnc(N2CCCC2)nc1,2 F6412-1965,CS(NCC#CCOc1cc(C(F)(F)F)ccc1)(=O)=O,0 F6530-6123,Cc(nc(nc1)OC)c1-c1nc(-c2cccc(C(F)(F)F)c2)no1,0 F6514-1995,CC(N1CCNC(NCCCc2ccccc2)=O)=CC(OC)=CC1=O,2 Y600-2620,CN(c1c(C(N2C)=O)[nH]c(N(CC3)CCN3c(cccc3)c3O)n1)C2=O,0 Z111590754,O=C(C1CC1)NCc1noc(-c2ccco2)n1,0 S971-0486,CCCC(CC1)(C1(CC1)CCN1C(c1c(C)onc1C)=O)O,2 F6445-3611,O=C(c(cccc1)c1Cl)NCCCc1cn2ncnc2nc1,0 SD12-1250,Cc(cccc1)c1NC(N(CCN1)C(Cc2nc(-c3ccccc3)no2)C1=O)=O,0 F0239-0170,OC(c1cc(-c(cc2)ccc2F)nc2ccccc12)=O,0 K263-0423,O=C(CSC(N(CCCN1CCOCC1)C1=O)=Nc2c1sc1c2cccc1)NCC1OCCC1,2 F6559-1794,O=C(C(CC1)CCN1C(c1ccccc1)=O)NCc1nc(C2CCOCC2)no1,2 Z2765910974,Cc1cccc(C(CNC(C2(C3)C3CCCC2)=O)N2CCOCC2)c1,2 Z2169665589,CCc(cc1)ccc1N(CC(N=C1SC(C)=NN11)=CC1=O)C(C)C,2 F6477-0462,O=C(Cn1c(cccc2)c2nc1)N(CC1)CCN1c1nc(-c2cscc2)cs1,2 Z872916868,O=C(C1CCN(CC(F)(F)F)CC1)NCc(cc1)ccc1C(Nc1ccncc1)=O,2 F2392-0371,CN(CC1)CCN1C(CNC(Cc1cccc2ccccc12)=O)c1cscc1,2 8017-8508,COc(c(OC)c1)cc(F)c1S(N1CC(COc2ccccc2)OCC1)(=O)=O,2 Z2190104495,Cc1cscc1NC(N1CC(Cc2ccccc2)(CO)CCC1)=O,2 F6597-0551,Cc1cccnc1OCC(CC1)CCN1C(C1(CC1)c(cc1)ccc1F)=O,2 F5791-2451,Cc(nc1)cnc1C(N(CC1)CCN1c1ncccn1)=O,2 SC23-0593,CS(N(CCc1noc(C2CC2)n1)C1CN(CCCc2ccccc2)C1)(=O)=O,2 S511-0229,O=C(CC1CC(CC2)(CCN2C(C2(CC2)c2ccccc2)=O)OCC1)N1CCOCC1,2 Z4921564821,CC(N(CCC1)CC1C(N(C1)C[C@@H](C2)[C@H]1CN2C(c1cc(scc2)c2cn1)=O)=O)=O,2 C548-3372,CN(C(C(CCC1)N1S(c1cccc2nsnc12)(=O)=O)=O)c(cc1)ccc1Br,0 Z2717963333,CC(CC1)(CN1C(CC1)CCN1C(C(CCC1)CN1C(C)=O)=O)O,0 S296-4426,CCn1ncc(CN(C[C@H]2C(N3CCCN(CCC4)C4=O)=O)C[C@@H]2C3=O)c1,2 S963-3135,CNC([C@@H](CN(Cc1cnccc1)C1)[C@H]1NC(c1ncncc1)=O)=O,2 F6507-3833,Cc1cc(C(CNC(CCc(cccc2)c2F)=O)O)c(C)o1,0 Z4924614996,COC(c(cc(c1c2)O)nc1ccc2OC)=O,0 Y040-7838,O=C1Oc(cc(cc2)OCc3cc(Oc4ccccc4)ccc3)c2C2=C1CCCC2,2 F6502-0935,O=C(c1nn(-c2ccccc2)nc1)NCCn1c(-c2nccnc2)ncc1,2 Z2267841415,CC(CC1)CN1C(c1nn(CCCC2)c2c1)=O,2 Z3091864309,CCCNC(CN1[C@@H](CCc2ncccc2)CCC1)=O,0 Z979270014,CN(Cc1ccccc1)S(c1cn(C)cn1)(=O)=O,0 G856-4969,O=S(c(cc1)cc2c1OCCO2)(NCC(c1ccco1)N(CC1)CCN1c(cccc1)c1F)=O,0 Z359626564,OCc(cc1)ccc1OCC(N(CC1)CCC1N(c(cccc1)c1N1)C1=O)=O,0 F6617-2955,C(c1ccco1)Nc1nc(cccc2)c2c2nc(-c3ccncc3)nn12,2 V024-1263,CC(C)(C)C(N(CC1)C(c2ccccc2)c2c1ccc(OCc1ccc(C(NCC=C)=O)o1)c2)=O,0 F2898-5217,Cc(n(-c1ccccc1)nc1)c1C(N(CC1OCCC1)c1nc(c(OC)ccc2)c2s1)=O,2 Z3207135168,CCC(NC(C(NC(C1)CC1C1CCC1)=O)c1ccccc1)=O,2 8019-0551,O=C1N(Cc2cc3nsnc3cc2)C=Nc2c1c(CCC1)c1s2,2 F6560-5246,Cn1ncc(-c2cc(CNC(CSCc3ccccc3)=O)cnc2)c1,2 D090-0055,Cc(cc1)cc2c1n(C)c1c2CCCC1NC(N)=O,0 F6773-4248,Clc1cc2ncc(N(CC3)CCC3Oc3nc4ccnn4cc3)nc2cc1,2 S698-1137,Cc1cnc(-c2cnccc2)n1C(CC1)CCN1C(Nc(cc1)cc2c1OCCO2)=O,2 SB52-0098,Cc1noc(C)c1CCC(N1CCC(C2)(CN(C)C2c2noc(C)n2)CC1)=O,2 F6809-1147,CC(C)(C)c1nccc(N(CC2)CCC2(c(cc2)ccc2Cl)O)n1,0 CM3891-1491,OC(CN1CCCC1)(CC1)CCC1(CC1)CCN1S(c1cccc(Cl)c1)(=O)=O,0 SB33-1259,Cc1n[nH]c([C@@H](CN(C2)C(NC3CCCC3)=O)[C@H]2NC(c2ccccc2)=O)n1,2 Z1421535714,Cc1nc(-c2cc(NC(CN3C4CCCC3CC4)=O)c(C)cc2)n[nH]1,2 Z3140021694,C[C@H](c(ccc(OC)c1)c1OC)NC(N(C(CC1)C2)C1CC2=C)=O,0 Z2271103057,O=C(CNc1nc(C2CCC2)no1)NC1CC1,2 J007-1316,CC(C)c1noc(C(CCC2)N2C(Nc2c(C)ccc(Cl)c2)=O)c1,0 Z2959657154,CC(C)C1(COC1)C(N[C@H](C1)[C@H](c2ccnn2C)N(C)C1=O)=O,2 S545-0278,O=C(c1cocc1)N(CCCCC1)C1c1nc(C2CC2)no1,2 V004-0166,O=C(C(CN(C1)C(c2cccc(Cl)c2)=O)C1c1ccccc1)NC1CC1,2 F6539-2553,CN(C)S(N1CCC(CNC(NCCOc2ccccc2)=O)CC1)(=O)=O,0 Z1269142316,O=C(NC1)Oc(cc2)c1cc2Br,0 Z1975468321,FCCNCc1c(cccc2)n2nc1,0 Y200-2209,COc(cc1)cc(-c2nc3ccccc3c(C(Nc3nnc(C4CC4)s3)=O)c2)c1OC,0 C741-0831,CC(C)N(CCNC(CCc(n1-c2c3cccc2)nnc1N(CCc1ccccc1)C3=O)=O)Cc1ccco1,2 8007-7062,O=C(C1C2C(CC3)CC3C12)Nc(cc1)ccc1Br,0 Z2447328262,CC(C(C)N)C(Nc1cc(S(Nc(cc2)ccc2OC)(=O)=O)c(C)cc1)=O,0 F6667-6264,Cn1ncnc1CN(CC1)CCN1c(cccc1)c1Cl,0 F6357-0507,O=C(C1CCC1)NCC1(CCCC1)c1cscc1,2 S976-0029,O=C(C(CCC1)(CN1C(c1nc2ccccc2cc1)=O)F)N1CCCC1,2 F6816-4428,CCn1nc(C(F)(F)F)c(CNc(ncnc2)c2F)c1,0 Z2964723178,CC(C(NC1(COC1)c1ccccc1)=O)c1ccc(C)o1,0 F6367-0484,Cc(cc1)cc2c1nc(N(C1)CC1C(NC1CCN(Cc3ccccc3)CC1)=O)s2,2 F5792-0423,Cc1cc(C(N(CC2)CCN2C(SC2)=NN=C2c2ccccc2)=O)c(C)o1,2 Z3268557780,OC(C(C1)CN(Cc2nnnn2C2CC2)c(cc2)c1cc2F)=O,2 F6709-4604,Cc1nccc(OC(C2)CN2C(c(cc2)cc3c2ncs3)=O)c1,2 F6212-0415,COC(C(Cc1c[nH]c2c1cccc2)NC(c1c2OCCCn2nc1)=O)=O,2 Z1558792259,CCc1ncnc(N2CCN(Cc3cn(C)nc3)CCC2)c1F,2 Z2919673741,CC(C)N(C)C(N(C[C@@H]1C2CC2)C[C@@H]1c1nc(C)n[nH]1)=O,0 Z2482195443,O=C(NCCC1CCNCC1)NCCc1cccc(Cl)c1,2 F6471-2776,O=C(Cc1cccc2ccccc12)N1C2C=CCC1CC2,2 Z1952279419,Cc1c(C(C2)CC2N(C2CC2)C(C(CC2)OC2C(N)=O)=O)cccc1,2 Z755066076,Cc1c(CN(CC2)CCN2C(c2c[nH]nn2)=O)cccc1,0 S398-0154,Cn1nc(C(NC2CC2)=O)c(C2)c1CN2C(c(cc1)cnc1OC)=O,2 Y080-0707,CC(C)Cn1c(cccc2)c2nc1C(CC1=O)CN1c1cc(OC)ccc1,0 F5979-0015,Cn(cc1C(N(CCC2)CC2C(N2c3nc(cccc4)c4n3CC2)=O)=O)nc1OC,2 SC69-0894,Cc1noc(C)c1C(N(C1)CC2(CCCC2)C1c1nncn1C1CC1)=O,2 F6476-3307,O=C(NCc(cc1)ccc1Cl)N(CC1)CC1Oc1nccc(C(F)(F)F)c1,0 SA31-0296,CC(C)c1nnc(COC2)n1C2(C)C(NCCCN(CCC1)c2c1cccc2)=O,2 6944-0018,CCOC(C(O)=O)(c1ccccc1)c1ccccc1,0 G229-0237,Cc1cc(N(CC(C2)c3nc(-c4cnccc4)no3)C2=O)cc(C)c1,0 F2385-0110,O=C(CC1)N(Cc2ccccc2)c(cc2)c1cc2NS(c1cccc(Cl)c1)(=O)=O,2 Z1701486281,CCN(CCC1)CC1NC(C)c1nc(C(F)(F)F)cs1,2 Z2802239619,CCc1nn(C)c(C(NCc(cc(cc2)F)c2OC(F)F)=O)c1,0 F6549-3615,O=S(c(s1)ccc1Br)(N1CC(Cn2ncnc2)C1)=O,2 SC08-0068,CN(C)S(N(C1)CC1c1nc(C(CC2)CCN2S(C)(=O)=O)no1)(=O)=O,0 F5822-2417,Cc1nccn1CC(CC1)CCN1C(Nc1cccc(Cl)c1)=O,0 F1105-0075,CN(C(c1cccc(NC(c2cc(-c3ccccc3)nc3ccccc23)=O)c11)=O)C1=O,2 F5017-0950,O=S(CCc1ccccc1)(NCC1CCN(Cc2cscc2)CC1)=O,2 S590-0020,Cn1ncc(C(NCC2N(C)Cc3cccn3C2)=O)c1,2 Z1211582311,CC(CC1)CCC1N(CC1)CCN1C(c1ccc(C(N)=O)s1)=O,2 F6435-0687,O=C(c1cscc1)N(CC1)CC1S(c1ccccc1)(=O)=O,2 SC03-0704,C(COC(CC1)CCN1C1CCOCC1)c1noc(C2CC2)n1,2 F6525-5057,Cc(n(CCNS(c1cc(C(F)(F)F)ccc1)(=O)=O)nc1C)c1-c1ccccc1,0 Z4579754142,CN(C(NC1(Cc2cccc(F)c2)CCC1)=O)c(cc1)ccc1F,0 Z1506264301,O=C(Cn1ncc(C(N2CC(CC3)(c4c3cccc4)OCC2)=O)c1)NC1CCCC1,2 C782-1239,CC(CCC1)C(C)C1NC(C(CC1)CCN1c1nc(c(C)cc(C)c2)c2s1)=O,0 SC74-1045,CCOCC(N[C@@H](C[C@@H](C1)C(N(CC2)c3c2cccc3)=O)[C@@H]1c1nc(-c2ccccc2)no1)=O,0 F6543-1524,Cc1c(C)ncnc1N(CC1)CCC1c1nn(C)cc1,2 Z751454846,CC(C(Nc1nc(-c2c(C)oc(C)c2)cs1)=O)n1nccc1,2 S971-0533,OC(CC1)C1(CC1)CCN1C(CCc1nc(cc(cc2)Cl)c2[nH]1)=O,2 Z1506272873,C(c1nc(-c2ccccc2)no1)N1CC(CC2)(c3c2cccc3)OCC1,0 F5831-9923,COc(ccc(Cl)c1)c1NC(NCC1(CC1)c1cccs1)=O,0 Z1532886271,Cc(cc1)ccc1SCC(N(CC1)CCN1C(CO)=O)=O,0 C509-0753,O=C(CSc1c(cc(cc2)Cl)c2nc2c1CCCC2)NCCCN1CCOCC1,2 F6438-3285,COc1nc(N2CCCC2)nc(CNC(CCc(cc2)cc(Cl)c2F)=O)n1,2 F6619-7312,Cc1nc(CN(CC2)CCN2c(cc2)nnc2N(C)C)no1,2 C760-0784,CC(CC1)Cc2c1c(C(NCCCSC1CCCCC1)=O)cs2,2 F2551-0008,O=C1NC(CSCc2ccccc2)=Nc2c1cccc2,2 L578-0445,O=C(C(CCC1)CN1C(c1cc(NC(c2ccccc2)=O)ccc1)=O)NCC1CCCCC1,2 SC25-1116,COCCN(Cc1cccs1)C(C1c2nnc(-c3nccnc3)n2CCC1)=O,2 Z3688908315,Cc1cccc(CS(CCC(Nc2nn(Cc3cc(F)ccc3)cn2)=O)(=O)=O)c1,2 F6444-1654,COC(C(CC(C1)Oc(cccc2)c2F)N1C(COc(cccc1)c1OC)=O)=O,0 Z1241537355,Cc1c(C)oc(CN(CCC2)CCN2S(c2cc(Cl)c(C)cc2)(=O)=O)n1,2 F5224-0081,O=S(Cc1cccc(Cl)c1)(NCC1(CCCC1)c1cccs1)=O,2 F1217-0050,CC(C)(C1)CC(O)=C(C(c2c[nH]c3c2cccc3)c2ncccc2)C1=O,2 Z1116601863,N#CC1=CN(CC(N2CCCC2)=O)c(ccc(Br)c2)c2C1=O,2 F6481-0844,O=C(Cn1nccc1)N(CC1)CCSC1c(cccc1)c1Cl,0 Z1583386691,CCN(C=CN=C1N(CCC2)CC2Nc2ccccc2)C1=O,2 F6378-0137,COc(ccc(CCNC(C(COC1)N(Cc2cccs2)C1=O)=O)c1)c1OC,2 F6246-0015,CC(C)c1nnc(C2CCN(CC(NC3CC3)=O)CC2)o1,2 Z2874740233,CCC(C)(C)C(NS(c1c(C)nc(N(C)C)s1)(=O)=O)=O,0 F2871-0153,O=C(COc1ccccc1)NCCOc(cc1)nnc1-c1cccs1,2 Z1545706223,O=C(CN(c(cccc1)c1C(N1)=O)C1=O)N(CC1)CC1C1CC1,2 Z2595576648,OC(CC1)(CCN1C(C(CC1)c(cc2)c1cc2F)=O)C(O)=O,0 Z2065710777,O=C(C(C1)ON=C1c(cc1)ccc1F)N1CCCCC1,0 F6448-0565,Cc(n(-c1ccccc1)nc1)c1C(Nc1cn(C2COCC2)nc1)=O,2 F3375-3006,Cc1c(-c2nnc(-c3ncccc3)o2)oc2c1cccc2,2 Z2960598697,CC(C)CN1NC(CC(N(CC2)CCC2c2ncco2)=O)=CC1=O,2 F3382-2610,COc1cccc(CNC(CSc2ncc(-c(cc3)ccc3F)o2)=O)c1OC,0 Z71174797,CCSc1nc2ccccc2c(NC)n1,0 Z4241417999,CN(CCCC1)C1(CC1)CCN1C(C(Cc1ccccc1)S(C)(=O)=O)=O,2 S219-0165,CCOc(cccc1)c1NC(N(C(C1)c2nc(C3CC3)no2)c2c1cccc2)=O,0 Z2061170383,Cc1nnc(NC(Cc2ccc(C)cc2)=O)n1C1CC1,0 V011-1148,COc(ccc(S(N1CCC(Cc2ccc(C(F)(F)F)cc2)CC1)(=O)=O)c1)c1OC,0 F2548-0084,O=C(COc(ccc(Cl)c1)c1Cl)N(CC1)CCC1(C1)Oc(cccc2)c2C1=O,2 Y044-4585,OC(C(Cc1c[nH]c2c1cccc2)NC(CC(CC1)CS1(=O)=O)=O)=O,2 F2006-0732,Cc1c(-c(cc2)nnc2SCc2cn(cccc3)c3n2)sc(-c(cc2)ccc2F)n1,2 SD12-0056,Cc1c(Cn2nccc2)c(C(N(CCN2)C(Cc3nc(C)no3)C2=O)=O)no1,2 F997-0683,Cc(cc1)cc(C)c1S(N(Cc1cc(CN2CCOCC2)cs1)c(cc1)ccc1Cl)(=O)=O,0 F6482-6584,Cc1c(C(NCc(cc2)cnc2-c2ccco2)=O)sc(-n2cccc2)n1,2 Z3100611027,CN(C)C(CC(c1ccccc1)NC(C[C@H](Cc1ccccc1)N)=O)=O,0 Z2489740711,CCOc(cc1)ncc1C(NC(CC1C(O)=O)c2c1cccc2)=O,0 S639-8454,CN(C)C[C@@H](CN(C1)c2ncncc2)[C@H]1NC(c1n[nH]c(C2CC2)c1)=O,2 Z2482910075,CN(CC(F)(F)F)Cc1c(C(O)=O)nc(-c2ccccc2)o1,0 Z2597309933,CN(CCn1nccc1)C(C(O)=O)c(cccc1)c1Br,0 C703-1103,Cn(c(C(NCCCN(CC1)CCN1C1CCCCC1)=O)c1)c2c1scc2,2 Z3890509400,COC(CC(CC(C1)C2)(CC1C1)CC12N)=O,0 Z1503917091,O=C(c(cccc1)c1N1)N(CCN2CCCCC2)C1=O,2 Z2996351718,OC(C1N(Cc2cn(CCF)nc2)CCc2c1cccc2)=O,0 F6473-0522,Cc1cc(C(N(C2)CC2N(CC2)Cc3c2scc3)=O)c(C)o1,2 S617-0951,OC[C@H](CCN(C1)C2CCC2)[C@H]1NC(c1ccccc1)=O,2 Z1870500849,OC(c1c(CCC(N(CC2)CCC2(C2)C2C(N2CCCCC2)=O)=O)cccc1)=O,2 Z1269234022,Cc1c(C(O)=O)c(ccc(Br)c2)c2[nH]1,0 F5599-0366,Cn(c(NC(C1)=O)c2C1c1ccccc1)nc2NC(c1cccs1)=O,2 F6353-3095,CN(C)C(CNC(c1nc(cccc2)c2s1)=O)c(cc1)cc2c1OCC2,2 F6556-0834,OC(CNS(c(cccc1)c1Br)(=O)=O)(CSC1)c2c1cccc2,2 F3406-5720,COc1c(CNC(CN2N=C(C(N3CCSCC3)=NC=C3)N3C2=O)=O)cccc1,2 F6713-6151,Cc1nc(CN(CC2)CCN2c(cc2)nnc2-c2ccco2)cs1,2 G672-0002,CN(C)S(c(cc1)cc(N2CC(N3CCCCCC3)=O)c1N(CCCC1)C1C2=O)(=O)=O,2 Z5023570945,CC(CC(N)=O)c(cc1)ccc1Nc1ncnc2c1c(C)no2,0 H025-1005C,Cc(cc1)cc2c1n(CCc1ncccc1)c1c2CN(Cc2ccncc2)CC1,2 F6745-8226,COc(cc1)cc2c1nc(N(CC1)CCC1C(F)(F)F)s2,0 F6125-2825,CCOC(N(CC1)CCC1NC(C(C1)CN1S(C)(=O)=O)=O)=O,2 F6560-4332,CC(C)C(Cn1ncnc1)NC(C1(CC1)c(cccc1)c1OC)=O,2 F6515-3382,O=C(c1cc(OCc2ccccc2)ccc1)N(CC1)CC1n1nccn1,2 F6091-0238,CC(C(NCc1csc(-c2ccccc2)n1)=O)N(C(C=C1)=O)N=C1c1cnccc1,2 F6240-6962,O=C(Cc1c[nH]c2c1cccc2)NC(CC1)CCN1c1nc2cccnc2s1,2 Z2966500181,O[C@@H]([C@@H](C1)NC(c2conc2C2CCCC2)=O)c2c1cccc2,2 Z2313016595,CN(CC(Cc1ccccc1)O)C[C@@H](C1)[C@H]1c1ccccc1,2 SB95-0247,CS(N(CCN1CCCCC1)C1CN(Cc(cc2)cc3c2OCC3)CCC1)(=O)=O,2 P103-2154,CC(C)N(CC1)CCN1C(CSc1ncccc1-c1noc(C2CCC2)n1)=O,2 D718-1614,O=C(CC1n2ncnc2NC1=O)Nc(cc1)cc(F)c1F,0 F0748-0461,CCC(C(Nc1nnc(-c2c(C)cccc2)s1)=O)Sc1ccccc1,2 F216-0167,CC(c1cccc(NC(c2cn(C)c(C(N3c(cc4)ccc4Cl)=O)c2NC3=O)=O)c1)=O,0 Z3207803341,CC(C)C(CC1)(CCN1C(CCN(C=Nc1c2cccc1)C2=O)=O)O,2 Z2789591674,CCN(CC=C)S(c1cc(F)cc(C(O)=O)c1)(=O)=O,0 F6544-0617,C(c(cc1)cc2c1OCC2)NC1Cc2ccnn2CC1,2 Z3497804243,CC(C)(C)c1ccc(CN(Cc2c(C3)[nH]cn2)[C@H]3C(O)=O)cc1,0 SC66-0094,Cn1c(C(CN(C2)S(c3cccc4cccnc34)(=O)=O)C22CCOCC2)nnc1,2 Z2308931563,CCC(CO)(CC1)CCN1C(NCc(cc(C1CC1)cc1)c1F)=O,0 Z1778570587,OC1(CN(Cc2ccccc2)CC1)c1nc(-c(cc2)ccc2Cl)no1,0 Z956141262,CCN(CC1)CCN1c1nccc(CNC(N2CCCC2)=O)c1,0 E761-0125,O=C(c1cc2cccc3c2n1CCS3)NCCC1=CCCCC1,2 SC02-0151,COCCC(CC1)(CN1C(Cn1nccc1)=O)NC(c(cc1)ccc1F)=O,2 F6816-4445,CCn1nc(C(F)(F)F)c(CNc2ncnc3cnccc23)c1,2 Z2495398932,CC(C(CC1)CCC1(F)F)NC(NC(C)c(cc1)cc2c1OCO2)=O,2 Z3367980051,O=C(c1ccc(C2COCC2)cc1)N(CC1)CCC1c1nc(CCC2)c2s1,2 Z2755336973,CC(CNC(c1ccc(C2CCOCC2)cc1)=O)C(O)=O,0 SB15-1112,Cn1c(C(N(CCC2)CC2N(C2CCOCC2)C(C2CC2)=O)=O)cnc1,2 M114-0116,O=S(c1cccn2c(SCc3cc(F)cc(F)c3)nnc12)(N1CCCC1)=O,0 F6561-7753,O=C(Cc(ccc(F)c1)c1F)NC1CN(Cc2cscc2)CC1,0 F6545-0242,CC(C(CC1)CN1S(C1CCCCC1)(=O)=O)=O,0 F6560-7641,CC(C)Oc(cc1)ncc1C(NCc(cc1)cnc1-c1cocc1)=O,2 Z2964509529,O=C(c1csc(Nc2ncccc2)n1)N(CC1)C(CCC2)N2C1=O,2 C519-1939,CCN(C=C1C(NC2CCCCCC2)=O)c(ccc(S(N2CC(C)CC(C)C2)(=O)=O)c2)c2C1=O,2 SC69-0122,Cn1c(C(C2)C3(CCCC3)CN2C(CCc2nc(cccc3)c3s2)=O)nnc1,2 Z741559378,NC(c([nH]c1c2cccc1)c2Br)=O,0 Z2607169276,CC[C@H](CNc(ncc(C(O)=O)c1)c1Cl)O,0 SC15-0098,COc1cccc(NC(N2CCC(CN(CC(COc3nccnc3)C3)C3=O)CC2)=O)c1,0 F6443-1629,COC(CC1)CCN1c(cc1)ccc1C(N(CC1)CCN1c(cccc1)c1F)=O,0 G856-7589,O=C(Cc(cc1)ccc1Cl)NC(CC1=O)CN1c(cc1)cc2c1OCCO2,2 Z4783342574,NC(C(c1c[nH]nc1C1)N1C(C1CC1)=O)=O,2 F1016-0492,Cc1cc(NC(CSCc2ccccc2)=O)no1,2 Z5015110149,CC(C)Oc(cc1)cc(F)c1NC(c1csc(N2CCCCC2)n1)=O,0 Y030-4640,CCC(C(Nc(cc1)cc(C)c1Br)=O)c1ccccc1,0 S994-0823,Cc1cc(C(N(CC2)CCN(CCN3Cc(cc4)ccc4F)C2C3=O)=O)c(C)o1,2 Z2504039366,CCCCN(c(c(C(N1)=O)c2)ncc2C(NC(CN)C(F)(F)F)=O)C1=O,0 Z1478319664,CC(COCCC1)N1c1ncccc1C#N,2 8019-3911,CC(C(c1cc(CCC2)c2cc1)=O)Oc(cc1)cc2c1oc1c2cccc1,2 F6357-0143,O=C(c1cc(Cl)cc(Cl)c1)NCC1(CCOCC1)c1cscc1,2 F5871-0878,O=C(Cc(cc1)ccc1F)N1CCN(CCNC(c2cscc2)=O)CC1,2 Z1198959396,O=C(c(cccc1)c1OCCOc1ccccc1)Nc(cc1)cc(C2)c1NC2=O,2 F6554-1062,Cn1nc(C(CCC2)CN2C(NCC(OC)=O)=O)cc1,0 F6418-0555,OC(c1ccco1)c1ccc(CNC(Cc(cc2)ccc2F)=O)s1,2 F6481-4298,Cn1nnc(C(N(CC2)CCSC2c2cccs2)=O)c1,2 T158-1292,CC(C)NC(N(CC1)CC1c1ncc(C)n1Cc1ccccc1)=O,0 F6215-0212,Cc1noc(CCNC(C(Oc2c3cccc2)=CC3=O)=O)c1,2 F3406-4220,O=C(CSc1cc(NCc(cc2)ccc2Cl)ncn1)NCc1ccco1,2 Z3292179383,C[C@H](CC(O)=O)NC([C@@H](CC[C@@H]12)C[C@@H]2C1(F)F)=O,2 F6747-6012,Clc1cn(CC(C2)CN2c2ccc(ccc(Br)c3)c3n2)nc1,2 3261-0802,COc(cc1)ccc1NC(c1c(NC(COc(cc2)ccc2Cl)=O)sc2c1CCCCC2)=O,0 F6502-0966,O=C(c1ccccc1)c(cccc1)c1C(NCCn1c(-c2nccnc2)ncc1)=O,2 Z2483070907,OC(c1cccc(Cl)c1CN(CC1)CCC1c1nc(CCCC2)c2s1)=O,2 Z2415860653,O=C(NC1CC(C2)C2C1)Nc1cc(F)cnc1,2 Z3019995715,OC([C@@H](C1)[C@H]1c(ccc(Br)c1)c1Cl)=O,0 SA49-1042,O=C(CC1COC(C2)(CN2C(Cc(cccc2)c2Cl)=O)C1)NCC1CC1,0 P085-0479,CCC(C)(C)NC(c(cc1)ccc1-c1nnc(cc2)n1cc2NC(C1CC1)=O)=O,2 F6667-6236,Clc(cccc1)c1N1CCN(Cc2cnccc2)CC1,0 F6199-0247,O=C(c(s1)ccc1Cl)N1CCN(CCn2cncc2)CC1,2 F6804-8545,CCc1cnc(N(CC2)CCC2C(F)(F)F)nc1,0 SD25-0284,O=C(CCC(CN(C1)C(c2ncncc2)=O)C11CCCCC1)NC1CC1,2 Z1374247342,NC(c1cc(C(N(CCC2)CC2(CCC2)c3c2cccc3)=O)nn1-c1ccccc1)=O,2 SD54-0537,CCOc1nc(-c2ccccc2)nc(CC2)c1CCC2C(N(C)CC(NC1CC1)=O)=O,2 F6473-0145,NC(C(CC1)CCN1C(C1)CN1C(CCc1cc(OCc2ccccc2)ccc1)=O)=O,2 V012-6262,CCC(C)N(CC(N(CC1OCCC1)Cc1ccco1)=O)C(COCc1ccccc1)=O,0 Z1984183452,CC(C)(C)C(c1c(C)cccc1)NC(c1cnnn1C)=O,0 S331-0024,CNC(N(CC1)CCC1C(CC1)CN1C(CCc1ccccc1)=O)=O,2 F6497-0652,O=C(CNC(OCc1ccccc1)=O)N1CC(Cc2nc(C3CC3)no2)CCC1,2 F2256-0014,CCN(C(C1)=O)c(cc2)c1cc2NS(c(cccc1)c1Br)(=O)=O,0 V004-7297,COc(cc1)cc(OC)c1NC(N1CCN(Cc2noc(-c3cc(OC)cc(OC)c3)n2)CC1)=O,0 Z2256336670,CC(C(NC(CC1CCCCC1)C(O)=O)=O)n1ncnc1,2 S903-1487,CN(C)C(N(CC1)CCC1c1nnc(C2)n1CCN2C(CCCc1ccccc1)=O)=O,2 F6383-0180,Cc1noc(C(CC2)CCN2C(CCCc2ccccc2)=O)n1,2 Z2996783327,Cc(cc1)cc(Cc2noc(C(N)=O)n2)c1OC,0 F6245-5138,COCCN1N=C(C(CCC2)CN2C(c(cccc2)c2OC)=O)N(C2CC2)C1=O,2 Z2290837558,O=C(NCc(cc1)ccc1Cl)N1CC(CC2)(CS2(=O)=O)CCC1,0 F6604-8532,O=C1N(CC(C2)CN2c2nc(cc(cc3)F)c3o2)N=C(CCC2)C2=C1,2 Z3688166973,CC(CO)(c1cc(O)ccc1)NC(Nc(c1c2CCC1)nn2-c(cc1)ccc1F)=O,0 Z1522904739,CC(c1c[nH]nc1)NC(c1noc(C(C)(C)C)c1)=O,2 F6573-9559,CC(C)Oc(cc1)ncc1C(NCc1nccnc1-c1ccncc1)=O,0 F3222-3094,CCOc(cc1)ccc1N(C=Cn1c2nnc1CC(C)CC(NCc(cccc1)c1Cl)=O)C2=O,0 Z1966636754,CC(CC1)(CN1c1c(ccc(C(F)(F)F)c2)c2ncc1)C(NC)=O,0 Z4486250053,CC(C)CCC(NC(CC1)C(C)CN1C(CN(C)C(C)C)=O)=O,0 F6471-3614,O=C(c(cc1)ccc1OC(F)(F)F)N(C1)CC1Oc1nccs1,0 Z2464264458,Cc(nc(cc1)-c2ccccc2)c1C(NC1(CN)CCCC1)=O,2 F5033-7904,O=C(c1ncccc1)NCC(CC1)CCN1C(c(cccc1)c1F)=O,2 Y080-1750,CCOc(cccc1)c1NC(C(CC1=O)CN1c(cccc1)c1OCC)=O,0 SC89-0388,O=C(c1ncncc1)N(C1)CC1(C(CN1CCOCC1)CC1)S1(=O)=O,2 Z2456600059,OC(Cn1nncc1)(CCC1)CN1C(c1cn(-c(cc2)ccc2F)nc1)=O,2 F6178-4484,N#Cc1cccnc1N1CCC(CNC(NCc2cccs2)=O)CC1,2 F5893-0209,CCSc(cccc1)c1C(Nc(c1n2)cccc1ccc2OC)=O,0 F2392-1545,COCCNC(C(NCC(c1cscc1)N(CC1)Cc2c1cccc2)=O)=O,0 T640-0423,Cc(cc1)cc(F)c1-n1nnc(C(O)=O)c1COC,0 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E646-3813,CC(CN(C1)S(C)(=O)=O)(C(NCc2ccc(C)cc2)=O)N(Cc(cc2)ccc2OC)C1=O,0 D107-1011,CC1Cc2c(NC(c(cc3)ccc3Br)=O)onc2CC1,0 Z1863986600,Cc1nc(n(-c2ccccc2)nc2)c2c(N(CC2)CC2(C(N)=O)O)n1,0 Z2569704973,C[C@H](CN(Cc(c(C(O)=O)ccc1)c1Cl)CC1)N1S(C)(=O)=O,0 Z4010113232,Cn1c(ccc(C(N[C@@H](C2)[C@@H]2[C@H](C2)[C@H]2C(O)=O)=O)c2)c2nc1,2 F6204-0671,O=S(Cc(cccc1)c1Cl)(NC1(CCCC1)c1cccs1)=O,2 F6496-1317,Cc1c(C(NCc2ncnc(C3CC3)c2)=O)sc(C)n1,2 F2093-0681,O=C(c(s1)ccc1Cl)Nc1nc(CCN(Cc2ccccc2)C2)c2s1,2 Z2607214596,Cc1csc2ncnc(NCC(C3CCC3)C(O)=O)c12,2 F6529-2280,CCOC(N(CC1)CCC1N(CC(N1c2ccccc2)=O)C1=O)=O,0 V017-7619,COCCN(C(C(C(N1CCN(Cc2ccccc2)CC1)=O)c1c2cccc1)c1ccccc1)C2=O,2 Z2357395409,CC(CCC(C1)C(O)=O)N1C(COc1c(C)ccc(C)c1)=O,0 SD67-0158,CC(C)CN(CC(N(CCC1)C2CN1S(Cc1ccccc1)(=O)=O)=O)C2=O,2 SC51-0649,CCN(CCN(C)C)C(CN(CCC(CC1)(CC2)N(Cc3ccccc3)C1=O)C2=O)=O,0 Z1425828553,CCC(N(CC1)CC1NC(Nc(cc1)cnc1S(C)(=O)=O)=O)=O,0 Z1083388832,Cc1c(C(CC2)CN2C(c2c3nc(C)ccn3nc2)=O)cccc1,2 Z2183128915,O=C(NCc1nccn1CCc1ccccc1)N1[C@H](CN2CCOCC2)CCC1,2 P244-0077,O=C(CC(c(nccc1)c1C1=O)N1c1ccccc1)NC1CCCCCC1,2 Z1314953867,CCN1CCN(CC(C)CNC(c2c(C(F)F)onc2C)=O)CC1,2 Z941891432,Cc1csc(C(CC(N(CC2)CCC2N2CCCCC2)=O)(C(F)(F)F)O)n1,2 Z1918186023,Cc(sc(C(O)=O)c1)c1S(N(CC(C1)O)c2c1cccc2)(=O)=O,2 F6561-6424,Cc(cc1)c(C)cc1N(CC(C1)C(NCc2c(-c3cn(C)nc3)nccc2)=O)C1=O,2 F0852-0003,CC(c1ccccc1)Sc1nc(cccc2)c2[nH]1,0 SC02-0321,COCCC1(CN(Cc(cc2)ccc2Cl)CC1)NS(c1ccccc1)(=O)=O,2 Z3133794157,O=C(C1(CC1)n1nccc1)NCc(ccnc1)c1O[C@@H]1CNCC1,2 D347-2998,CCOCCn1c(cccc2)c2nc1C(C1)CN(Cc(cc2)ccc2F)C1=O,0 F3358-0346,N#Cc1cccnc1SCc(cc1)ccc1Cl,0 T991-1779,CCCc(cc1)ccc1S(N(CCC1)CCN1C(CCN1CC2CC2)C1=O)(=O)=O,2 F6676-1248,Cc1nccc(OCC(CC2)CCN2C(C2OCCCC2)=O)c1,2 F6795-3167,Cc(nc1cc2)cn1nc2N1CCN(Cc2c(C)onc2C)CC1,2 F6514-8889,O=C(C(CC1=O)CN1c1ccccc1)NCc1cc(-c2cnccc2)ncc1,2 Z1609728996,Cn1ncc(C(C(CC2)C(N3CC(CCC(O)=O)CCC3)=O)N(C)C2=O)c1,2 F6469-1109,Cc1nc(-c(cccc2)c2NC(C(C(OC)=C2)=NN(c3ccccc3)C2=O)=O)cs1,2 F5620-0066,CCCS(N1CCN(Cc2nc(cc(cc3)OC)c3[nH]2)CC1)(=O)=O,0 Z86198417,COc(cc(CNCC(CN1CCOCC1)O)cc1)c1OCc1ccccc1,2 F6360-9556,CN(CC1)CCN1C(N(C1)CC1Oc1cnccc1)=O,2 F6522-0576,O=C(c1cccc(Cl)c1)NCc1cc(-c2cscc2)cs1,0 Z2982755603,O=C1NCCN(Cc2cn([C@@H](CCC3)c4c3ccc(Cl)c4)nn2)C1,2 3805-1476,O=C(c1ccccc1)c(cc1)cc2c1NC(c1cccc(Cl)c1)C(C(CCC1)=O)=C1N2,2 F5896-0208,CSc(cccc1)c1C(Nc1cccc2ccc(-n3cccc3)nc12)=O,0 Z1579677241,Cc1cccnc1CN(CC1)CCN1S(Cc1nocc1)(=O)=O,0 F6057-0216,CC(C)Sc1ccc(CC(N2CCN(CCn3nccc3)CC2)=O)cc1,0 F6748-8244,Clc(cccn1)c1OCC(CCC1)CN1c1nccn2nc(C3CC3)cc12,2 F6525-6944,O=C(NCCn1ncc(-c2ccco2)c1)N1CCOCC1,2 E646-3830,CC(CN(C1)S(C)(=O)=O)(C(NCc2ccc(C)cc2)=O)N(Cc2cc(C)ccc2)C1=O,0 Z446507374,CC(C)(C)n1ncc(CNc(cc2)cc(C(O)=O)c2Cl)c1,0 F0912-2391,c(cc1)ccc1-c1nc2ccncc2nc1-c1ccccc1,2 C794-1031,CCC(c1c(-n2cccc2)sc2c1CCN(CC)C2)NC(Nc(cc1)cc(C)c1Br)=O,0 F1174-0318,CC(CC1)CCN1C(C=CC1=Nc2c3cccc2)=NN1C3=O,2 F5017-0832,O=S(Cc(cc1)ccc1F)(NCC1CCN(Cc2ccco2)CC1)=O,2 Z2600486546,CC(C)NC([C@H](CCC1)CN1C(NCc1cn(Cc2ccccc2)nc1)=O)=O,2 F6064-8211,Cn(c(C(N(C1)CC1c1nc(-c2ccco2)no1)=O)c1)nc1-c1ccccc1,2 Z2631482484,CCC(C=C1C(N(C2)C(C)Cc3c2cccc3)=O)=CNC1=O,0 F6438-1549,O=C(c(cc1)ccc1Oc1ncccn1)N(CC1)CCN1c1cnnc(N2CCCC2)c1,2 Z2957339516,Cc1noc(C(CC2)CN2C(Nc2ccnn2C2CCC2)=O)n1,2 Z5057727517,Cc1c(CNC(COc(cc2)ccc2Cl)=O)cncc1,0 F6524-1831,COc1cccc2c1oc(C(N(CC1)CC1c1nocn1)=O)c2,2 Z3965266719,CC(C)(C)C(c1noc(O)n1)NC(C1CN(Cc2cnccc2)CCC1)=O,2 Z2790270990,CC(CC(F)F)(C1)CN1S(c1cc(F)cc(C(O)=O)c1)(=O)=O,0 Z929401698,CCc(n(-c1ccccc1)nc1)c1C(Nc1c(C)ccc(C(N)=O)c1)=O,0 SB99-0173,Cn1nc(CCC(N2CCOCC2)=O)c(C2)c1CCN2C(c1n[nH]c2c1cccc2)=O,2 V028-6777,COc(ccc(N(C1CCN(Cc2cccs2)CC1)S(c(cc1)ccc1F)(=O)=O)c1)c1OC,0 Z4626507098,Cn1nc(Cc2noc(C3CCCCCC3)n2)c(Br)c1,2 F6796-3520,FC(c1nnc(cc2)n1nc2N1CC(COc2nnc(CCC3)c3c2)CC1)(F)F,2 F1736-0821,O=C(C(Cc1c2cccc1)OC2=O)Nc(cccc1)c1C(c1ccccc1)=O,2 Z1506227469,CC(C)(C)n1ncc(C(N(C)CCc2nccs2)=O)c1C,0 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F6573-4277,O=C(c(cc1)ccc1-c1cccs1)NCCOCCN(C(CC1)=O)C1=O,2 F6494-0731,CCOc1cc(C(N(CC2)CCN2C(c2ccco2)=O)=O)ncn1,2 Z1384828392,Cc1c(CC(NS(c2cc(C#N)cc(Br)c2)(=O)=O)=O)cccc1,0 C174-0419,CCCCCn1c(cccc2)c2nc1C(C)NC(CCC)=O,0 0200-5174,CCCC(CC1)CCC1c(cc1)ccc1C(Nc1nnc(CC)s1)=O,0 F6451-0068,COC(CNC(CN(C(CC1)=O)C1=O)=O)c(cccc1)c1OC,0 J106-0698,O=C(C(CC1=O)CN1c1n[nH]c2c1ccc(Br)c2)N(CC1)Cc2c1cccc2,2 F5016-1068,Cc1cc(CN2CCC(CNC(C(NCCC3=CCCCC3)=O)=O)CC2)c(C)o1,2 F2751-0110,COc1c(CCNS(CCNC(c2ccccc2)=O)(=O)=O)cccc1,2 Z2068622875,O=S(c1cc(-c2ccccc2)ccc1)(N(CCC1)C1c1ccncc1)=O,2 F6734-2497,Cn1ncc(S(N2CC(CN(C3)c(cc4)nnc4-c4ccccc4)C3C2)(=O)=O)c1,2 F6560-5174,Cn1ncc(-c2cc(CNC(c3ccco3)=O)cnc2)c1,2 F6734-1549,O=C(c1c(CCCC2)c2no1)N(C1)CC(C2)C1CN2c(cc1)ncc1F,2 J007-1332,CC(C)c1noc(C(CCC2)N2C(Nc(ccc(Br)c2)c2F)=O)c1,0 Z1693370790,CN(CN(C1)C(NC(C2)CC2c2ccccc2)=O)C1=O,2 M040-1082,COc(cccc1)c1-c1noc(Cc2nc(C3=Cc(cc(cc4)Br)c4OC3=O)cs2)n1,2 Z1651008961,CN(c1cc(CCC(O)=O)ccc1)S(c(cccc1)c1C#N)(=O)=O,0 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C260-1942,O=C(CN(c(cccc1)c1C(N1CCCC(NC2CCCC2)=O)=O)C1=O)c(cc1)ccc1Br,2 F6656-4523,CC(C)(C)C(C=C1)=NN(C(CC2)CCN2S(c(cc2)cc3c2OCC3)(=O)=O)C1=O,2 Z164994416,CC(NCc(cc1)ccc1C(N(CCC1)C1c1cnccc1)=O)=O,0 F6726-4297,Fc1c(N2CCN(Cc3cn(cccc4)c4n3)CC2)ncnc1-c1ccccc1,2 Z2408133450,Cc1cccc(F)c1-n1nc(C(NC(CCC(N2C)=O)C2=O)=O)c2c1CCC2,0 Z1852373744,CC(C)CN(CCN(C1C)C(c2ncc(C)cc2OC)=O)C1=O,0 Z771211164,CC(C)(C)NC(c1cccc(NC(c2c(C)n(C(C=C3)=NNC3=O)nc2)=O)c1)=O,0 F6541-5775,O=C(C1CC1)N(CC1)CCN1c(ccnc1)c1Cl,2 Z1999984271,Cc1noc2ncnc(NC(COCc3ccccc3)c3ccccc3)c12,2 F6244-2989,Cc1cc(C(NCC#CCN(CC2)Cc3c2cccc3)=O)c(C)o1,2 F6471-8535,Cn1c(S(C(CC2)CCN2C(C2=CC=CN(C)C2=O)=O)(=O)=O)ncc1,2 Z1416549874,CCCC(C)c1n[nH]c(NS(c2c(C)ccc([N+]([O-])=O)c2)(=O)=O)c1,0 F6725-2060,Cn1ncc(C(CCCC2)N2c(nc2)ncc2Br)c1,0 F3374-0606,CCN(C(C)=C1)c(ccc(C(Nc2nc(C)c(C)s2)=O)c2)c2C1=O,2 Z385466722,O=C(c1cc2ccccc2c(Cl)n1)Nc1ncccc1,2 F1403-0071,O=C(CCC1)C(C2c3cnccc3)=C1OC(CCC1)=C2C1=O,2 Z45630530,Cc(cccc1)c1NS(c(cc1)ccc1Br)(=O)=O,0 Z2434045919,N#Cc1cc(N(CCC2)C2C2COCCC2)ncc1,0 T853-0457,COCCN(C(CC1)=O)C2=CCCCC12C(NCCc1c[nH]c2c1cccc2)=O,0 F9994-0366,O=C(c(cc1)cc2c1n(C1CCCC1)nn2)Nc1cccc(F)c1,0 F6482-2423,O=C(NC1CC2OCCOC2CC1)Nc(c(F)ccc1)c1F,0 F6713-0620,O=S(Cc1ccccc1)(N1CCC(COc2nnc(CCCC3)c3c2)CC1)=O,2 SB66-0171,O=C(C1CC1)N(C[C@H]1CCC2)C[C@@H]1N(Cc1cccc(F)c1)C2=O,2 F6668-2858,Cn1ncnc1CN1CCC(COc(nc2)ncc2Br)CC1,2 5339-0096,Cc1cc(Oc2nc(N(C)C(N(C)C3=O)=O)c3n2Cc2cc(OC)ccc2)cc(C)c1,0 F6471-7223,Cn1c(cccc2)c2c(CC(NCCCc2conc2)=O)c1,2 Z2836700786,Cc(ccc(Cl)c1)c1NC(CN(CC1)CC1C(NC(N1)=O)=CC1=O)=O,0 Z1257255039,CC(CN(Cc1ccccc1)C(CCC1=C(C)Nc2ncnn2C1=O)=O)O,2 Z1274460747,COCc1cccc(C(NCc2nc(C(O)=O)cs2)=O)c1,0 F8890-6232,Cn1c(-c2noc(C(CC3)CCN3S(C3CC3)(=O)=O)n2)ccc1,2 F6573-7494,CC(C(N(CCN1c2cnccc2)CC1=O)=O)Oc(cccc1)c1F,0 L285-0562,CCN(CC1)CCN1c(cc1)nnc1-c1cc(S(N2CCCC2)(=O)=O)c(C)cc1,0 F3408-0075,CCOC(CN1CCN(CCN(C(c2c3c4cccc3ccc2)=O)C4=O)CC1)=O,0 C470-0227,CN1CCN(Cc2nc(N(C)C(N(C)C3=O)=O)c3n2Cc(c(F)ccc2)c2Cl)CC1,0 F6480-4250,O=C(c1c[nH]c2c1cccc2)N(CCC1)CC1Oc(nc1)ncc1Br,2 F6543-1224,N#CC(C1)CN1C(c1cc(Br)cnc1)=O,0 Z2922697465,OC([C@H](C1)[C@H](C2)[C@H]2[C@H]1NC(Cc(cc1)cc2c1[nH]nc2)=O)=O,2 SB57-1314,Cc1noc(C(C2)C(C3)(CN3C(Nc(cc3)ccc3OC)=O)CN2C(COC)=O)n1,0 F6709-0343,CCc(cn1)cnc1OC(CC1)CCN1c1nncs1,2 F072-1351,CCN(CC)C(N1Cc2ccc(C)cc2)=Nc(cc(cc2)C(NCC3CC3)=O)c2C1=O,2 V028-2568,CC(C)N(C)C(C(CN(C1)C(c2cccs2)=O)C1c1cc(C(F)(F)F)ccc1)=O,2 SA95-0572,Cc1cnc(C2N(Cc3c(C)ncs3)CCC2)n1Cc1cnccc1,2 SC88-0401,Cc(cc1)ncc1C(N(C1)CC1(C(CC1)c2nc(C3CCCC3)no2)S1(=O)=O)=O,0 Z1991670560,CC(C)(Cc(cccc1)c1OC)NC(c(nc1)cnc1C(O)=O)=O,0 SB27-0653,O=C(C1)N(Cc2ccccc2)CC2(COCC2)N1C1CCN(CCCc2ccccc2)CC1,2 F0725-0480,O=C(c1cccs1)Nc1cccc(-c2nc(cccc3)c3s2)c1,2 SA01-0965,CN(C)c(nc1)nc(C2CN(Cc3ccncc3)CC2)c1C(NCCOC)=O,0 F6471-6904,Cc1cc(S(NC(CC2)CN2C2CCOCC2)(=O)=O)c(C)cc1,0 F6709-0396,CCc(cn1)cnc1OC1CCN(Cc2csc(C3CC3)n2)CC1,2 Z3464412094,CN(C(CCN1c(cccc2)c2OC)C1=O)S(c1cccc2cnccc12)(=O)=O,0 S968-0535,CS(NC(C1)C1(CC1)CCN1C(c1nccc2ccccc12)=O)(=O)=O,2 Z2237699276,OC(c(cccc1)c1S(N(CC(F)F)C1CC1)(=O)=O)=O,0 Z913590138,N#Cc(cc1)ccc1N(CC(C1)C(NCc2cnccc2)=O)C1=O,0 Z1273580049,CCC(CC)C(N(CC1)CCC1NC(c1cc(cc(C(F)(F)F)cc2)c2n1C)=O)=O,2 D125-2166,CCOc(cc1)ccc1N(CC(C1)c2nc(cccc3)c3n2CCC2CCCCC2)C1=O,0 SC45-0365,CC1n2nnc(CNC(Cc3cccs3)=O)c2CN(C)C1=O,2 F6682-6573,Cc1c(CN2CC(COc3nccc(C#N)c3)CCC2)cno1,0 Z1743628569,Cc1ccc(CN(C=CC=C2NC(CC3C=CCCC3)=O)C2=O)cc1,2 S515-0267,CC(CCCC1)(C(NCCCN(CCC2)c3c2cccc3)=O)NC1=O,0 F6514-2799,O=C(c(cc1)ccc1-c1cscc1)N(C1)CC1OCC(F)(F)F,2 G122-1398,O=C(c1ccc(N(CCC2)c3c2cccc3)s1)NCCCN(CC1)CCN1c1cccc(Cl)c1,2 L711-0146,Cc(c1c2nc(N(CCC3)CC3C(NC3CCCCCC3)=O)s1)nn2-c(cc1)ccc1Cl,2 F259-0408,CCC(Nc1nc(ccc(NC(CCn2c(cccc3)c3c3c2CCCC3)=O)c2)c2s1)=O,2 SD25-0618,Cc1cn(CC(N2CC3(CCCCC3)C(CCC(N3CCOCC3)=O)C2)=O)nc1,2 G305-0231,CC(CCc1ccco1)N(C)C(CN(c(cccc1)c1O1)C1=O)=O,2 S892-0389,Cn1nc(C(CCCC2)N2S(c(cc2)cc(OC)c2OC)(=O)=O)c2c1CCOC2,0 F6480-4917,O=C(c1cc2c(-c3ccccc3)onc2cc1)N(CCC1)CC1Oc(nc1)ncc1Cl,2 S248-3276,Cc1c(C(N2CC(Cc3noc(-c(cc4)ccc4F)n3)CC2)=O)sc(C)n1,2 Z1127026250,Cc1c(C(NN2C)=O)c2nc(C)c1CC(NCc(cc1)ccc1Cl)=O,0 F6523-3077,O=C(NCCN(Cc(cccc1)c1OC1)C1=O)N(c1ccccc1)c1ccccc1,2 Z1527126878,CNC(c1cc(CNC(c2cn(C)cn2)=O)ccc1)=O,0 V003-2560,CC(CC(C)(C)C)CC(Nc1cccc(C(N2c3ccc(C(F)(F)F)cc3)SCC2=O)c1)=O,2 F6454-2685,O=C(c(ccc(F)c1)c1Cl)NCC(CC1)CCN1C1CCSCC1,0 Z1857144530,CC(C)(C)S(N(CC1)CCC1NC(N(C1)CC1F)=O)(=O)=O,2 F6506-0507,OC(CNC(NCc1cccc2ccccc12)=O)(c1cocc1)c1ccco1,2 F6774-4143,Cn(cc1)c2c1c(N(CC1)CC1Oc(nc1)ncc1OC)ncn2,2 F2224-0167,CC(N1c2cc(NC(C3CC3)=O)ccc2)=Nc(nccc2)c2C1=O,2 F6390-3097,CC(C)S(c1ccc(CC(N(Cc2cccs2)C2CCOCC2)=O)cc1)(=O)=O,0 F0838-0043,COc(ccc(Br)c1)c1S(n1c(-c2ccccc2)ncc1)(=O)=O,0 F3395-0351,O=C(c1nn(CCCO2)c2c1)N(CC1)CCC1N(CC1)CCN1c1c(C(F)(F)F)cccn1,2 Z1916116120,CC(C)C(NC(CC1)CCN1C(c(cc1)cc(C#N)c1F)=O)=O,0 F5883-0862,OCCn(c(NC(c(c(F)ccc1)c1Cl)=O)c1)nc1-c1ccco1,0 Z2482792388,OC(c(ccc(CN1Cc2ncnn2CC1)c1)c1Cl)=O,0 Z2777644676,Cn1ncc(C(CC(C2)C(O)=O)CN2C(c2cscc2)=O)c1,0 F6783-7119,Cc1nc(CCC2)c2c(N2CC(CN(C3)c(cc4)cnc4C#N)C3C2)n1,2 Z1239497117,Cc1nn2c(C)cc(C)nc2c1C(NC(CC1)CCN1c1cccc(F)c1)=O,2 SB21-0207,O=C(C1(CC1)c1ccccc1)N(C1)[C@H](Cn2nnc(C(N3CCCC3)=O)c2)C[C@@H]1F,2 C519-0508,CN(CCNC(C1=CN(C)c(ccc(S(N2CCOCC2)(=O)=O)c2)c2C1=O)=O)Cc1ccccc1,2 Z4142715729,Cn1ncc(CC2)c1CC2C(N(CC1)CC1c1cccc2ccccc12)=O,2 Z1446898906,Cc(cc(cc1)OCC(N2CCCC2)=O)c1F,0 F6561-1579,COc1ccc(CNC(NCc2cncc(-c3ccco3)c2)=O)cc1,0 F6573-0304,Cn1nccc1-c1ncc(CNC(c2cscn2)=O)cc1,2 SB18-1087,Cc1c(C(N(C[C@H](C2)NS(C)(=O)=O)[C@@H]2c2nc(-c3ccccc3)n[nH]2)=O)sc(C)n1,2 F6506-5041,CCN(CCN(C(NCC(C1CCOCC1)(c1ccccc1)O)=O)C1=O)C1=O,2 Z2755290055,OC(c1cn(CC(N(CCN2)C(c3ccccc3)C2=O)=O)nc1)=O,0 G802-0227,COc(cccc1)c1N(C=Cn1c(SCC(Nc(cc2)cc3c2OCCO3)=O)nnc11)C1=O,0 CM4495-4559,Cn1cnc(C(N(C2)C(COc(cc3)ccc3OC)CC22CCCCC2)=O)c1,2 SD08-0488,Cn1cnc(S(N(CCC2)CC22OCc3c(CNC(C4CC4)=O)nnn3C2)(=O)=O)c1,2 F6031-1192,OC(CN1CCN(CC(N2CCCC2)=O)CC1)C1CC1,2 F2773-0224,O=C(C=C1)N(Cc2cccc(Cl)c2)N=C1c1cccs1,2 J093-0642,O=C(c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2n1)N(CC1)CCN1c(cc1)ccc1Cl,2 F6795-1299,Cc1c(C(C=C2)=NN(CC(CC3)CCN3c3nc(ccc(F)c4)c4o3)C2=O)sc(C)n1,2 F5003-0020,CCOC(N(CC1)CCN1C(CSc1nnc(-c2cn(C)nc2OC)n1C)=O)=O,2 F5882-0117,CCC(CC)C(NCCN(CC1)CCN1C(OC)=O)=O,0 C786-4683,CCC(n(c1c2)c(cc3)c2cc3F)=NN(CC(NC(C)CCc2ccccc2)=O)C1=O,2 Z1609535825,Cc1ccc(C(N(C)CC(N(CCC2)CC2C(O)=O)=O)=O)s1,0 Z2768784059,COC(C1Cn2c(-c(cc3)cc(Br)c3OC)nnc2CC1)=O,0 Z1343762373,CC(c1cccc(F)c1)N(CCC(N1)=O)C1=O,0 Z1603582163,CC(C1CC1)(C(O)=O)NC(c1cc(Br)cs1)=O,0 SB04-0676,CN(C)C(N(CC1)CC1N(CCN(C)C(NC1CCCC1)=O)C1CCOCC1)=O,0 F6448-1023,O=C(c1ccno1)Nc1cn(CC2CCOCC2)nc1,2 Z1623088686,COCc1nn(CC(CC2)NC(NCc(cccc3)c3N3CCCCC3)=O)c2n1,2 Y202-7148,CCC(C(Nc1c(C(N)=O)c(CCC(CC)C2)c2s1)=O)Oc1cc(C)c(C)cc1,0 F1441-0027,CC1CCN(CC(NCCc(cc2)cc(OC)c2OC)=O)CC1,0 Z1386781617,CC(C)(C)OC(c1cc(cccc2)c2[nH]1)=O,0 F6495-2001,O=C(c1ncnc(N2CCCC2)c1)NCCN(C(C=C1)=O)N=C1c1cccs1,2 Z3417078966,CN(C(CCCN1c2ccccc2)C1=O)C(c(cc1)cc(CN2C(CCC(N3)=O)C3=O)c1C2=O)=O,2 F6764-1469,O=C(c1noc(C2CC2)c1)N(CC1)CCC1c1ccc(cc(cn2)Cl)c2n1,2 SD07-0626,CCN(CC)C(NCc1c(COC(CC2)(CN2C(Cn2ncc(C)c2)=O)C2)n2nn1)=O,0 SA87-0942,COCCN(CC(CNC(C1(CC1)c(cc1)ccc1OC)=O)OC1)C1=O,0 SA71-1169,Cc1noc(C)c1S(N(CCC1)CC1(CC1CC1)c1noc(-c2cnccc2)n1)(=O)=O,2 Z1140036702,CCn1ncc(NS(c(cc2)cc3c2OC(C)C3)(=O)=O)c1,0 F6515-1805,COc(nccc1)c1C(NCc1c(-c2ccco2)nccc1)=O,2 F6549-7397,Cc(cccc1)c1OCC(N(C(CC1)C2)C1CC2n1ncnc1)=O,0 SB04-0069,CS(N(CC1)CC1N(CCNC(NCc1ccccc1)=O)C1CCOCC1)(=O)=O,0 SD60-0274,O=C(C1CC1)N(C1)CC11OCC(CCOCc(cccc2)c2F)C1,2 Z4966735318,C[C@H](CNS(C(C1)C1c(cccc1)c1Br)(=O)=O)O,0 F532-4349,O=C(NC1CCCCCC1)Nc(cc1)ccc1-c1noc(C2CCC2)n1,2 F9994-0707,CC(C)(C)OC(N(CC1C(O)=O)c2c1cccc2)=O,0 F472-0781,CCC(C)NC(c(cc1)cc(-n2c(SCC(c3c(C)ccc(C)c3)=O)nnc2N2C)c1C2=O)=O,2 Z1608247500,Cc1noc2nc(C3CC3)cc(C(N(CC3)CC3(c(cc3)ccc3F)O)=O)c12,0 SC02-0354,COCCC(CC1)(CN1C(c1c[nH]c2c1cccc2)=O)NS(c1ccccc1)(=O)=O,2 F6475-1841,O=C(c(cn1)cc(Cl)c1OC1COCC1)Nc(cc1)cc(C2)c1-c1c2cccc1,2 Z2979957789,CN(c1cc(CNC(N(CC2)C[C@H]2OC)=O)ccc1)S(C)(=O)=O,0 F6007-0186,Cc1c(C(C=C2)=NN(CCNC(C3(CCCC3)c3cccs3)=O)C2=O)sc(C)n1,1 F6438-1322,CN(C)c1ccnc(CNC(COc2ccccc2)=O)n1,1 F6565-4774,O=C(C(C=C1)=NN(Cc(cc2)ccc2F)C1=O)N(CC1)CCN1c1nnc(CCC2)c2c1,1 Z2440989911,Cc1cncc(C(NC(CCC2)CC2N)=O)c1O,0 Z1362885160,Cc1nn(CCCC2NC(Nc(ccc(F)c3)c3Cl)=O)c2n1,0 T619-4442,O=C(c1nccc2ccccc12)N(CCCC1)C1c1nc(C2CC2)no1,1 F6656-1313,Cc(cc1)c(C)cc1N(CC(C1)C(N2CC(CN3N=C(C4CC4)C=CC3=O)C2)=O)C1=O,1 P297-4797,CCCc(cc1)ccc1S(N(CC1)CC1n1c2ncccc2nc1-c1ccco1)(=O)=O,0 F6441-5089,O=C(c(o1)ccc1Br)N(C(CC1)C2)C1CC2S(c1ccccc1)(=O)=O,1 S905-0707,CC(C)C(N1CCn2c(C(CC3)CCN3C(CCS(c3ccccc3)(=O)=O)=O)nnc2CC1)=O,1 8005-2202,O=C(C(CC1=O)CN1c1ccccc1)Nc1nccs1,0 F3406-4202,O=C(CSc1cc(NCc(cc2)ccc2Cl)ncn1)Nc1c(C(F)(F)F)cccc1,0 Z1444737190,OC(CC1(CCOCC1)NC(c1noc(-c2ccco2)c1)=O)=O,1 Z1987363121,CCC(CO)(CCC1)CN1C(c1cnnn1C)=O,1 F6276-1857,Cc1cccc2c1nc(OC(C1)CN1C(C(CC1)CCN1S(C)(=O)=O)=O)s2,1 F6495-2378,COC(c(scc1)c1NC(c1ncnc(N2CCCCC2)c1)=O)=O,1 F6560-1405,Cc1nc2ncnn2c(OC(C2)CN2C(c2cc(-c3cc(OC)ccc3)nn2C)=O)c1,1 Z45655873,O=S(c1ccccc1)(Nc1cccc(S(Nc2cc(C(F)(F)F)ccc2)(=O)=O)c1)=O,0 F5323-0020,Cn1nc(CCC2)c2c1NC(c(cc1OC)cc(OC)c1OC)=O,0 SA99-0750,NC(C(CC1CC1)(CC1)CCN1C(CC1)CCN1C(COc(cc1)ccc1F)=O)=O,1 F2392-1372,O=C(C(NCC(c1cscc1)N1CCOCC1)=O)NCCC1=CCCCC1,1 Z5001810723,CCC(C(CCCC1)N1S(c1c(C)ccc2ccccc12)(=O)=O)O,0 Z1126943084,O=C(C1CN(Cc2cccc(F)c2)CCC1)N(CC1)CC11OCCO1,1 Z906007384,CC(C)(C)n1ncc(NS(c2c(C)sc(C)c2)(=O)=O)c1,0 S034-2115,O=C(c1cccs1)N[C@@H](C[C@@H]1C2)[C@@H]2CN1S(c1cc(CCCC2)c2cc1)(=O)=O,1 F6727-5719,CN(C(C=C(N1)N(CC2)CCC2N(C(C=C2)=O)N=C2c2ccccc2)=O)C1=O,1 Z3369091354,CC(C1)OC(C)CN1c(cc1)ncc1C(Nc(cc1)cnc1OCCO)=O,0 Z2476185800,OC(CN(CC1CC1)Cc(ccc(Cl)c1)c1-n1ncnc1)=O,1 Z369327392,O=S(c1cccc(Br)c1)(NCc1cc(F)ccc1)=O,0 Z2997229682,Cc1cnc2n(Cc3nc(C4(CCCCC4)OC)no3)ncc2c1,1 Z2952188753,Cc1n[nH]c(N2CCN(Cc3ncc(C)cn3)CC2)n1,0 Z195593672,COc1cc(CCN(CC(N(C23CCCC3)c(cccc3)c3NC2=O)=O)C2)c2cc1OC,1 F3411-6715,O=C(CN(C=Nc1c2sc(N3CCOCC3)n1)C2=O)N(CC1)CCN1c(cccc1)c1F,1 Z1176977502,CCc1cccc2c1[nH]cc2CCNCc(cc1)cc(O)c1OC,0 M087-0151,O=S(c1cc(-c2noc(C(F)(F)F)c2)cs1)(NC1CCN(Cc2ccccc2)CC1)=O,1 Y031-4823,CC(C)(C)c1nnc(NC(C(CC2=O)CN2c2cc(C)c(C)cc2)=O)s1,0 Z1922289997,O=C(C1CC1)N1CCN(Cc2cc(cccc3)c3[nH]2)CC1,1 Z1263730904,COc(cccc1)c1S(N(CCOC1)C1C(O)=O)(=O)=O,0 Z1230709403,CC(C)(C)c1n[nH]c(NS(c2cc(Cl)cc(Cl)c2)(=O)=O)c1,0 F6412-1852,Cc1c(C(NCC#CCOc2cc(C(F)(F)F)ccc2)=O)sc(C)n1,1 F6471-5648,COc(ccc(CCC(N(CC1)CCC1n1nncc1)=O)c1)c1Br,0 F2201-0047,Cc1cc(-n2ncc3c2ncnc3N(CC2)CCN2c(cccc2)c2OC)cc(C)c1,0 Z3655600188,COc(c(F)ccc1NC(c2c3nc(CC4CC4)[nH]c3ncc2)=O)c1F,1 F953-1065,Cc1c(-c2nnc(C(NCCCN(CCC3)c4c3cccc4)=O)o2)oc2c1cc(C)cc2,1 F6440-2696,O=C(c1ccco1)NCc1nn(C2CCCC2)c2c1CCCC2,1 Z2126030796,Cc1nn(C)c(N(CCC2)CC2NC(c2nccc(C#N)c2)=O)c1,0 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Z3900779354,CCOC(CN(C)c1nc(-c2cc(OC)ccc2)nc2ccccc12)=O,0 Z2952657818,COc1cc(CCCN(C2)C(c3cc(nccc4)c4o3)=O)c2cc1,1 F6359-3641,Cc(cc1)nnc1OC(CC1)CCN1C(c1cc(Br)cnc1)=O,1 V019-1329,CCCC(C)c1nc(n(-c2ccccc2)nc2)c2c(N2CCN(CC(C)C)CCC2)n1,0 SB04-0408,CN(C)C(N(CC1)CC1N(CCNC(c1cccs1)=O)C1CCOCC1)=O,0 5408-1876,COc1cc([C@H]([C@H](CC=C2)[C@H]2c2ccc3)Nc2c3Cl)cc(Br)c1OC,0 F6279-0434,Cn(c(C(NCC(CC1)(c2c1cccc2)O)=O)c1)nc1-c(cc1)ccc1F,1 Z1761510709,O=C(NC1C=CCCC1)N(CC1)CC1Nc(cc1)nn2c1ncc2,1 F3398-5080,CC(C)CCNC(c(cccc1)c1N1CC(NCc(cccc2OC)c2OC)=O)=NC1=O,1 F6713-4934,FC(c1nnc(cc2)n1nc2N1CCN(Cc2nnc(C3CCOCC3)o2)CC1)(F)F,1 L075-0499,COc1cc([nH]c(C(N2CCC(CC(N(CC3)CCN3c3ccccc3)=O)CC2)=O)c2)c2cc1,0 L942-0085,CCC(C)NC(CCN(c(n1-c2c3cccc2)nnc1SCC(NC1CCCCC1)=O)C3=O)=O,1 G516-0221,COc(cc1)ccc1-c1nc2ccccc2c(N(CC2)c3c2cccc3)n1,1 Z2437488570,CN(C(CCN1c2ccccc2)C1=O)C(C(C1)C11CCNCC1)=O,1 P223-1458,Cc1noc(C)c1C(N(CCC1)CC1c1nn(CCCN(C)C2=O)c2c1)=O,0 F6748-0564,Cc(c1ccc(N(C)C(C2)CN2c2nccnc2)nc1nc1C)c1Br,1 S618-1992,CNC(NC[C@H](CCN(C1)S(c2cc(OC)ccc2)(=O)=O)[C@H]1N(C)C)=O,0 F6480-3165,Cc1nc(OC(CCC2)CN2C(c2cc(-c3cc(OC)ccc3)nn2C)=O)nc(C)c1,0 Z272388550,O=C(C1(CC(C2)C3)CC3CC2C1)Nc(cc1)cc(-c2nnc3n2CCCCC3)c1F,1 8017-9185,CC(CC1)CCN1S(c(cc(c(N(C=CC(C)=C1)C1=N1)c2)C1=O)c2Cl)(=O)=O,1 Z3024747410,Cc1n[nH]c(CCC(NCC(C(N2)=O)(c3nccn3C)NC2=O)=O)c1,1 K842-0030,O=C(CSc(cc1)ccc1Br)Nc(cc1)ccc1Oc(cc1)cc(C(N2Cc3ccco3)=O)c1C2=O,1 SB04-0391,Cc1nn(C)c(CN(C)CCN(C(CC2)CN2C(C2CC2)=O)C2CCOCC2)c1,1 F6749-0717,COc1nc(N2CCC(COc3ncccn3)CC2)nc(OC)n1,1 F2024-1188,COc(cc1)ccc1N(CC(C1)NC(Nc2cnccc2)=O)C1=O,1 L566-0415,CC(CCC1)(CN1C(Nc(ccc(Br)c1)c1F)=O)C(NCc1ccc(C)cc1)=O,0 F6752-6252,O=C(C(CCC1)CN1c1ncnc2c1CCCC2)N(CC1)CCC1(F)F,1 T499-1737,Cc(cc(cc1)S(N(CC2)CC2c(n2CCOC)nc3c2nccc3)(=O)=O)c1F,0 F2516-0242,COc1cccc(C(Nc(cc2)cc3c2OCO3)=O)c1OC,0 F6502-9206,Cc1cc(CCNC(Nc2ccc(C(F)(F)F)cc2)=O)nn1C,0 Z1682988927,Fc(cncc1)c1-c1nc(-c(cc2)ccc2Oc2ncccn2)no1,1 Z2230365159,CCC(CC1)N1C(c1c(C)nc2n(CC)ncc2c1)=O,0 Z3687065633,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NC(CCCc1ccc(C2CC2)cc1)=O,1 Z1868185053,COCC(CCC1)CN1S(c(ccc(C(O)=O)c1)c1F)(=O)=O,0 Z2235047694,Cc(nc(N(C)C)s1)c1S(NC(CCCc1ccccc1)=O)(=O)=O,1 Z1603189121,CC(C)c(ncnc1)c1C(NC(Cc1ccccc1)C(O)=O)=O,0 Z3396257997,CC(C)c(cc1)cc(S(n2nnc3c2ccc(C)c3)(=O)=O)c1OC,0 Z1786987337,COCCn(cc1)nc1C(NCC1(CCCCCC1)O)=O,1 F993-0479,CN(c(sc(C(NCCCN(CC1)CCN1c1ccccc1)=O)c1)c1C(N1C)=O)C1=O,1 Z2174397917,CC(CC1)(CN1C(c1nn(CCO2)c2c1)=O)F,1 F924-0457,O=C(Nc1cccc(Cl)c1)N(CC1)Cc2c1n1nc(-c3ccccc3)nc1s2,0 F6561-1467,O=C(NCc1cncc(-c2ccco2)c1)Oc1ccccc1,1 L100-0326,COc(cc1)ccc1C(c1c2cccc1)=NN(Cc1nc(-c3cccc(Br)c3)no1)C2=O,0 S823-4309,CN(C)[C@@H](C1)[C@@H](CO)CN1C(c1cc2cccnc2cc1)=O,0 P935-1740,O=C(NCc(cc1)ccc1F)N(CCCC1)C1c1nncn1CC1CC1,1 F6658-3906,COc1nc(N(CCC2)CCN2c(cc2)nn3c2nnc3C2CCC2)ncc1,1 F5852-1432,CCOC(N(CC1)CCC1NC(C(Nc1cccc(Cl)c1C)=O)=O)=O,0 Z1564113289,Fc1ccc(COC(CC2)CCN2c2ncccc2)cc1,0 Z1538689658,CC(C)(C)n1ncc(C(NC(CCO)c2cccs2)=O)c1C(F)(F)F,0 F5855-0463,COc1cccc(-c2n[nH]c(C(N(CC3)CCN3C(C(C3)C3c3ccccc3)=O)=O)c2)c1,1 Z2226367888,CCN(C(CCN1)C1=O)C(c1csc(-c(cc2)ccc2Cl)c1)=O,1 F6186-0373,CC(CNC(C(NCc(cc1)ccc1F)=O)=O)(CSC)O,0 Z4969863631,CC(N=C(c1cnccc1)N1)=C(CC(Nc2cc(CN)ccc2)=O)C1=O,0 Z1468537199,CC(C)(C(NCC1CCCC1)=O)NC(c1cnccc1)=O,1 F6619-7844,Cc1cc(C)nn1-c1ccc(N2CCN(Cc3ncccc3)CC2)nn1,1 SB46-0201,O=C([C@H](C[C@H]1CN(C2)C(C3CCOCC3)=O)C[C@@H]1NC2=O)N(CCC1)CCN1c1ncccn1,1 E216-5261,CCC(C1)Oc(ccc(C)c2)c2N1C(Nc(cc(C)cc1)c1OC)=O,0 S855-0692,O=C(C1CC1)NCC(CN(C1)S(c2cccs2)(=O)=O)C11CCCCC1,1 F6679-2783,Brc(cncc1)c1OC(CC1)CN1c1nnc(C2CC2)s1,1 G536-1056,COc1cc(CCN(CC(Nc(cc2)ccc2Br)=O)C2CC([O-])=O)c2cc1OC,0 F6443-4106,O=C(c1cc(cc(cc2)F)c2s1)N(CC1)CCC1(c1c2cccc1)OC2=O,1 Z2952755416,C[C@H](c(cc1)c(C)cc1F)NC(Nc1nc(COC)ncc1)=O,0 SA63-1307,O=C(CCn1cncc1)N(CC1)CCC11OCCC(CCNC(C2CC2)=O)C1,1 K784-9686,CCC1Oc(ccc(C)c2)c2N(CC(NCCCN(CC)c2cc(C)ccc2)=O)C1=O,0 SD61-0337,O=C(C(C1)C2(CCC2)CN1C(c1cc([nH]cc2)c2cc1)=O)NCc1ncccc1,1 F6412-1398,COc(cccc1)c1OCC#CCNC(Cc(cc1)ccc1F)=O,0 F6228-0611,Cc1cc(C)nn1CCN(CCC1)CCN1C(CCc(cc1)ccc1OC)=O,1 Z285613588,CCCN(CCC)S(c(cccc1)c1C(O)=O)(=O)=O,0 S633-0166,Cc1cc(C)nn1CC(N(C1)CC1c1noc(C2N(C)CCC2)n1)=O,1 F3157-0069,O=C(COC(c1cnccc1)=O)c(cc1)ccc1-c1ccccc1,1 Z2755340784,CC(C)(C(Nc1cccc(C(N(CCCC2)C2C(O)=O)=O)c1)=O)c1cnccc1,1 F6818-0632,Cc1nc(CCC2)c2c(N(CC2)CCN2c(ncc(C(F)(F)F)c2)c2F)n1,0 Z2335397727,Cc1cnc(C(N[C@@H](CC2)[C@@H](c3ccccc3)NC2=O)=O)c(C)c1,1 Z1369824962,CC(CCC1)N1C(Nc1nnc(C(C)(C)c2ccccc2)s1)=O,0 F6515-4445,Cn1nc(cc(cc2)Br)c2c1C(NCc1cncc(-c2cccs2)c1)=O,1 SC66-0775,COc1cc(C(N(C2)CC3(CCOCC3)C2c2nncn2CC2CC2)=O)cc(OC)c1,1 Z1531240712,CCS(Nc(cc1)c(C)cc1NC(NCC1CCC(C)(C)CC1)=O)(=O)=O,1 F6043-0501,Cc(n(C(CC1)CS1(=O)=O)nc1C)c1N(CC1)CCN1C(C1(CCCC1)c1cccs1)=O,1 F6502-0156,O=C(Cc1cccc2ccccc12)NCCn1c(-c2ncccc2)ncc1,1 F2733-0043,O=C(c1cc(C(F)(F)F)ccc1)Nc1c(ccs2)c2ncn1,0 F3222-0004,CC(C=C(C)N(CC(Nc(cc(cc1)Cl)c1C(OC)=O)=O)C1=O)=C1C#N,0 F2637-0559,Cc(c1c(cc2)sc(N(CC3)CCN3C(c(cc3)cc4c3ncs4)=O)n1)c2Cl,0 F2879-2093,O=C(C(NCc1ccncc1)=O)NCc(cc1)ccc1F,0 Z2909960967,CC(C)C(C)NC(C(CC1)CCN1C(C(C1)(C2)CC12C(O)=O)=O)=O,1 SB23-0938,Cc1n[nH]c([C@@](CN(C2)C(C3CC3)=O)(CC3)[C@@H]2CN3C2CCN(C)CC2)n1,1 F6188-0640,O=C(c(o1)ccc1Br)NCC1(CCOCC1)Sc1ccccc1,1 Z2964600924,O=C(C(C1)CC1(F)F)Nc1nc2ccc3scnc3c2s1,1 F2342-0214,O=C(Cn1c(cccc2)c2nc1)NCCN(C(C=C1)=O)N=C1c1cccs1,1 F6562-5265,O=C(C1(CCCC1)c1cccs1)NCCN(C=CC=N1)C1=O,1 Z4924723259,O=S(c1c2occc2ccc1)(Nc(cc1)cc(Cl)c1F)=O,0 Z3144156952,CC(C)N(C=C(CNC([C@@]1(CCCC2)[C@H]2NCC1)=O)C(N1)=O)C1=O,1 F5074-0042,Cc1nn(C)c(-c2nnc(NC(c3cccc(C(F)(F)F)c3)=O)o2)c1,0 Z2066021100,OC(CC(c1cccc(Cl)c1)NS(c1cscc1)(=O)=O)=O,0 F6411-1044,Cc1cc(N(C=CN(CC(NC2CCCC2)=O)C2=O)C2=O)cc(C)c1,1 Z2066020026,OC(c(cc1)cc(O)c1NS(c1csc2c1cccc2)(=O)=O)=O,0 SB75-1268,CCS(N[C@H](C[C@H]1CN(C2)C(c3cc(C)c(C)cc3)=O)C[C@]12c1nc(C)no1)(=O)=O,0 F3226-1687,CCN(CC)CCN(C(C(C(c1cccs1)=O)=C1O)c2ncccc2)C1=O,1 S812-1461,Cc1nn(C)c(C(N2C(c3cn(C)nc3)c3nccn3CCC2)=O)c1,1 F6609-8838,O=C(c(cccc1)c1N1)N(Cc2cn(-c3ccccc3)nn2)C1=O,1 F6495-1877,CCOC(c(cccc1)c1NC(c1ncnc(N2CCCC2)c1)=O)=O,0 F6474-3710,O=C(c(cccc1)c1Cl)N(CC1)CCC1Oc1cccc2cccnc12,0 F6438-2243,CCOc(nc1)nc(N(C)C)c1NC(Nc1c(C)cc(C)cc1)=O,0 Z4510085936,Fc1cc(OC2CCN(CCCc3n[nH]nn3)CC2)ccc1,1 Z1239087273,N#Cc(cccc1)c1S(N(CC1)CCN1C(C(c(cc(cc1)F)c1N1)=CC1=O)=O)(=O)=O,0 Z3792889649,NCC(N([C@@H](CCC1)[C@@H]1C1)[C@@H]1C(NC1CCN(Cc2cnccc2)CC1)=O)=O,1 F6574-0014,O=C(c1nccnc1)NCc1nccnc1-c1cocc1,1 Z1585077827,CCc1nn(C)cc1NC(c1cn(CC(NC2CCCCC2)=O)nc1)=O,1 F6360-9436,Cn(c(C(N(C1)CC1Oc1cnccc1)=O)c1)nc1-c1cccs1,1 Z2982752195,Cc(cc(cc1)Cl)c1-n1nnc(CN(CC2)CCC2O)c1,0 F6549-6989,O=C(c(cc1)cc2c1[nH]cc2)N1CC(CN(C(CC2)=O)C2=O)C1,1 Z2228298164,CCN(CC)C(C1CN(Cc2ccccc2)CC1)=O,0 Z2226521272,Cc1nocc1CN1CC(c2nnc(C)o2)OCC1,1 C700-2011,CCC(c1c(CC2)c(cccc3)c3[nH]1)N2C(Nc1cc(OC)ccc1)=O,0 8016-2989,COc(cc1)cc(S(Nc(cc2)cc3c2oc2c3CCCC2)(=O)=O)c1OC,0 Y032-4683,CN(C)C(N(CC1)CCC1C(Nc(cc1)ccc1S(N(CCC1)c2c1cccc2)(=O)=O)=O)=O,1 Z1317913972,CCc1nc(CN(CCC2)CC2C(Nc2ncc(C)cc2)=O)cs1,0 Z4125283566,O=C(c1csc(-c2cnccc2)n1)NCC1(CCOCC1)c1cccc(Cl)c1,1 M459-3428,Cc1cc(N(CC2)CCN2c2ccnc(SCC(Nc3cc(C)cc(C)c3)=O)n2)c(C)cc1,0 SA63-0648,CN(C)CCC1CC(CC2)(CCN2C(c2cccn2C)=O)OCC1,1 SD56-0791,CCn1ncc(C(N(CCC2)CC(C(N3C4CCCCC4)=O)N2C3=O)=O)c1,1 F6614-7302,Cc1c(CN(CC2)CCC2n2nccc2)cccc1,1 G433-0287,Cc(cc(c(N1C)c2)N(C)C1=O)c2NS(c(cc1)cc(N2C)c1N(C)C2=O)(=O)=O,0 C201-1422,O=C(CSc(c1ccccc11)nnc1N1CCOCC1)Nc1cc(CCC2)c2cc1,1 F6444-6807,O=S(Cc1cc(C(F)(F)F)ccc1)(N(C1)Cc2c1cnc(N1CCOCC1)n2)=O,1 Z2305281833,OCc1cn(C(CCC2)CN2C(NCc(cc2)ccc2OC2CCCC2)=O)nn1,1 SB03-0288,O=C(C1CC1)N(CCC1)CC1N(CCNC(c1n[nH]c(C2CC2)c1)=O)C1CCOCC1,0 Z1835798599,COC(c1n[nH]cc1NC(Cc1cccc(F)c1)=O)=O,0 Z2073763445,CC[C@H](C)[C@@H](C(NCC(C1)CC1OCc1ccccc1)=O)NC(C)=O,1 D454-0302,COc(ccc(N1Cc2nc(cccc3)c3n2CC1)c1)c1NC(c1cccs1)=O,1 Z1049116564,COCCC(N(CC1)CCN1C(N1CCOCC1)=O)=O,0 F6562-4457,CN(C)c1nc(CCC(C2)NC(NCc(cc3)cc(OC)c3OC)=O)c2cn1,1 4986-0488,CCn1c(ccc(NC(COc2cc(C)cc(O3)c2C(CCC2)=C2C3=O)=O)c2)c2c2c1cccc2,1 Z3687083893,CNC(C[C@@H](CN(C1)C(NCc2coc(cc3)c2cc3F)=O)[C@H]1O)=O,0 SD61-0444,Cn1c(C(N(C2)CC3(CCC3)C2C(NCc2ncccc2)=O)=O)ncc1,1 Z4507917707,O[C@H](C1)C[C@@H]2[C@H]1CN(Cc(ccc(-c1n[nH]nn1)c1)c1Cl)C2,1 Z1212109844,Cc1c(CN(CC2)CCN2C(Cc2ccc(C(F)(F)F)cc2)=O)c(C)nn1C,0 Z3681307716,Cc1c(-c(cc2)ccc2Cl)onc1C(OC)=O,0 Z3040276082,Cc1nc(S(N(C2)[C@H](COC3)[C@H]3C22CCN(C)CC2)(=O)=O)cn1C,1 S700-1118,COc1ccc(CNC(N(C2)CC2c2nc(CCOCC3CCOCC3)no2)=O)cc1,0 Z1991064555,CN(CCCSC)C(Nc1nccc(C(F)(F)F)c1)=O,0 Z425223890,O=C(c1cc(Cn2cncc2)ccc1)NCCCN1CCCCC1,1 F6192-1360,O=C(C(NCc(cc1)ccc1F)=O)NCC(c1cscc1)c1ccco1,1 F6472-9253,O=C(CSC1CCCC1)N(C1)CC1N(CCN1)CC1=O,1 S990-0724,CC1(CC1)C(N(CCC1c2nc(C)no2)CCN1C(c1ccccc1)=O)=O,1 F6670-4718,O=C1N(CC(CC2)CCN2c(nc2)ncc2Cl)C=Nc2c1cccc2,0 S629-1668,O=C(CCc(cc1)cc(C2)c1OCCN2C(c1nc2ccccc2cc1)=O)NC1CC1,1 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Z1274761024,Cc(n(C(CC1)CS1(=O)=O)nc1C)c1NC(c1cc(c(C)cc(C)c2)c2[nH]1)=O,1 D232-0275,Cc1cc(OCC(NCC(c2ccco2)N2CCOCC2)=O)cc(C)c1,0 F6619-7134,Cc(cc1)nnc1N1CCN(Cc2csc(-c3ccccc3)n2)CC1,1 Z1015543730,Cc(cc1)cc2c1c(CC(N(CCC1)C1c(cc1)ccc1O)=O)c[nH]2,1 8020-7476,Cc1cc(NC(C(C2c(cc3)ccc3Cl)OC(c(cccc3)c3O3)=C2C3=O)=O)no1,0 Z952096074,COc1cccc(CC(NCc(cc2)ccc2-c(cc2)cc3c2OCC3)=O)c1,1 F5778-0264,CC(C(Nc(cccc1)c1NC(c1c(C(F)(F)F)cccc1)=O)=O)NC(C)=O,0 Z1685050921,Cc1cc(-c2nc(Cc3nocc3)no2)c2[nH]ncc2c1,1 Z1443595754,Cc1c(C(NCc(cc2)ccc2C(O)=O)=O)oc(C)n1,0 F6064-1247,COc(ccc(CC(N(C1)CC1c1nc(-c2cnccc2)no1)=O)c1)c1OC,1 SB11-0112,OC(Cn1nnc(C(N2CCOCC2)=O)c1)(CC1)CCN1C(C1CCCCC1)=O,1 Z1898352772,CC(CN(CC1)CCC1(CO)OC)=Cc1ccccc1,0 Z4017958121,O=C([C@H]1C[C@H](CC2)O[C@H]2C1)NCCC(NO1)=NC1=O,1 Z3583507309,OCC(CCc1ccncc1)NC(c1cnc2OCCCc2c1)=O,1 Z394644980,Cc1cc(S(NCC(O)=O)(=O)=O)cc(C)c1OC,0 Z2735690705,O=C(c1nc(-c2nccnc2)no1)NC1CC1,1 SD08-0470,O=C(C1CC1)NCc1c(COC(CCC2)(C3)CN2C(C2CCOCC2)=O)n3nn1,1 Y040-2709,CC(C(NCC(N(CC1)CC(CCCC2)C12O)=O)=O)Oc(cc1)cc(O2)c1C(CCCC1)=C1C2=O,1 G370-0084,O=C(c(cc1)ccc1NC(C1=CSCCO1)=O)NC1CCCCCCC1,1 Z3604832716,Cc1c(C(N(CC2)CC2(c(cccc2)c2F)O)=O)c(C(N(C)C=N2)=O)c2o1,1 Z1849413181,CC1(C)Oc2c(CN(CCCC3)C3c3nnc(C4CCOCC4)o3)cccc2C1,1 S928-4216,Cc1cc(NC(N2CC(Cc3nnc(-c4ccccc4)o3)CC2)=O)cc(C)c1,1 F6482-6632,O=C(c(cc1)cc2c1ncs2)NCc(cc1)cnc1-c1ccco1,1 F3102-0010,Cc1c(C)sc(N=C2SC(c3ccccc3)=CCN22)c1C2=O,1 F6809-6111,N#Cc1cc(Br)cnc1N(CC1)CCN1C(c1ccccc1)=O,0 Z2683638331,CC(C(CCCC1)N1S(c(ccc(C(O)=O)c1)c1F)(=O)=O)O,0 Z1216705452,CN(c(ccc(NS(c(cc1)ccc1Oc(cccc1)c1Cl)(=O)=O)c1)c1O1)C1=O,1 S984-0846,CN(C)C([C@@](CN(C1)C(Cc(cccc2)c2F)=O)(C2)[C@@H]1CN2C(c1nccnc1)=O)=O,0 SB76-0589,COc(cc1)cc(S(N(C2)C[C@@H](CN3)[C@H]2CC3=O)(=O)=O)c1OC,0 CM4410-6822,NC(CN(CC1(CCCCC1)N(Cc(c(F)ccc1)c1Cl)C1)C1=O)=O,0 T955-0772,O=C(NCc1ccccc1)N(CCC1)CC1c1nc(CCOCC2CC2)no1,1 F6524-2236,COc(ccc(Cl)c1)c1C(N(CC1)CC1c1noc(-c2cccs2)n1)=O,0 F6441-2355,Cc1c(cc(cc2)C(N(CC3)CCC3S(c3ccccc3)(=O)=O)=O)c2ncc1,1 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F6471-3054,CC(C(N(CC1)CC1Oc1nccs1)=O)Oc1ccccc1,1 F6553-7159,CC(C)S(c1ccc(CC(N(CC2)Cc3c2sc(Cl)c3)=O)cc1)(=O)=O,0 Z1841251532,CCc(n(-c(cccc1)c1Cl)nc1)c1NCc1cncn1C,1 Z2961626444,CC(CC1)(C(N(C)[C@@H](COC2)[C@H]2O)=O)Oc(c(C)c2C)c1c(C)c2O,1 Z1772028205,CCC(C(Nc1cc(-c(cc(C)cc2)c2F)n[nH]1)=O)N(CCC1)C1=O,1 F2501-1025,Cc(cc1)c(C)cc1NC(C(C(N1C)=O)=CN=C1SCC(NCC1OCCC1)=O)=O,1 V028-8265,CCNC(N1CC(CN(CCC2)CCN2C(c2ccc(C(F)(F)F)cc2)=O)OCC1)=O,0 V003-8141,COc(cc1)ccc1OCC(CN(CC1CCCCC1)Cc1cccn1Cc1ccccc1)O,1 F2504-0557,O=S(c(cc1)ccc1Cl)(NCC(c1ccco1)N1CCOCC1)=O,0 Z4026814347,COC(c1cccc(OC(CC2)CN2C(c2cc(C(CCC3)=O)c3[nH]2)=O)c1)=O,1 F3161-0146,Cc(cc1)cc(C)c1NC(C1=C(C)Nc2ncnn2C1/C=C/c1ccccc1)=O,1 F6454-2797,Cc1noc(C)c1CC(NCC(CC1)CCN1C1CCSCC1)=O,1 F6807-6950,CCOC(N(CC1)CCN1c(sc1ccc2)nc1c2S(C)(=O)=O)=O,0 F6557-0979,O=C(c(ccnc1)c1F)N(CCC1c2ccccc2)CCS1(=O)=O,1 E977-0244,CN(CC(N(CC1)CCN1c(cc1)ccc1Cl)=O)S(c(cc1)cc(CCC2)c1NC2=O)(=O)=O,1 Z4286578341,CC(c(cccc1)c1OC(F)F)NC(c(cc1)cc(N2)c1N=CC2=O)=O,1 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F2726-0702,CC(CC1)Cc2c1nc(NC(Cc(cc1)ccc1F)=O)s2,1 F6443-6338,Cc1c(C(NCC(CCC2)N2c2nc(cccc3)c3o2)=O)sc(-n2cccc2)n1,1 Z2936913962,C[C@H](CNS(c(nc1)c(cc2)n1cc2C(OC)=O)(=O)=O)O,0 SC04-0860,COCc1nc(CCOC(CCC2)CN2C2CCOCC2)no1,1 F6562-8452,O=C(NCC1c(cccc2)c2OC1)Nc1cccs1,1 F1721-0084,COc(cccc1)c1OCc1nnc(-c(cccc2)c2Cl)o1,0 J098-0062,CS(N(CC1)c(cccc2)c2OC1C(Nc(cc1)ccc1Br)=O)(=O)=O,0 Z2766439140,CCc(cc(cc1)C(NC[C@H](C[C@@H](C2)OC)N2c2ncnc(C)c2)=O)c1O,0 Y020-1030,O=C(C(C1)Nc2ncnn2C1=O)Nc1ccccc1,0 Z1685151651,O=C(CC(C1)c2noc(CC3C(CC4)CC4C3)n2)N1C1CC1,1 Z814215270,O=C(CN1CCOCC1)N(CC1)CCN1C(NC1c2cccc(F)c2CC1)=O,1 Z4525863366,COCC(NC[C@](CCC1)(C2)[C@H]1CN2C(c1c(-c2ccccc2)ocn1)=O)=O,1 Z1961439244,CC(CC1)=C(C)CN1C(C(CC1=O)CN1c(cc1)cc2c1OCCO2)=O,1 Z2736335942,O=C(c1csc(N2CCCCC2)n1)NC1CC1,1 Z1608831915,CC(C)(CN(CC1)C(N(C)C)=O)N1C(c1nc(C2CC2)ncc1)=O,1 V021-7141,O=C(c1coc(CN(Cc2ccc(C(F)(F)F)cc2)Cc(cc2)ccc2F)n1)NCC1OCCC1,0 Z3687072299,C[C@H](C1)O[C@@H](C)c2c1c(C(NC(CC1)CCC1c1nc(C)no1)=O)nn2C,1 Z3402992259,Cc1conc1CS(N1CCN(Cc2ncccc2)CC1)(=O)=O,0 F5382-0509,O=C(Cc1csc(Nc(cc2)ccc2F)n1)NCc1cnccc1,1 Z1370793104,O=C(c1c(C(F)(F)F)n(-c(cc2)ccc2F)nn1)N(CC1)CC(CN2)N1C2=O,1 F6245-5877,CN(C(C(F)(F)F)=NN1CCNC(CSc(cc2)ccc2F)=O)C1=O,1 F1967-0164,Cn(c(C(O)=O)c1)nc1-c1ccc(C2CCCCC2)cc1,1 F6445-3368,Cc1nn(cc(CCCNS(c2c(C(F)(F)F)cccc2)(=O)=O)cn2)c2c1,0 Z3385966884,CN(C(C1)C2(CCNCC2)S1(=O)=O)C(Cc1cc(C(F)(F)F)ccc1)=O,1 F6791-8279,Cc1nsc(N(CC2)CCC2c2nnc(C3CC3)o2)n1,1 S896-0088,Cc1nc(CCOCC2)c2c(N(CC2)CCN2S(c2cccs2)(=O)=O)n1,1 C301-1007,O=C(C1Oc(cccc2)c2OC1)Nc(cc1)ccc1S(N1CCCC1)(=O)=O,1 G795-0267,O=C(c1nsc2c1cccc2)Nc1cc(C(N(CC2)CCN2C(c2ccco2)=O)=O)ccc1,1 Z2617448794,CC(C)Oc1cccnc1-c1noc([C@H](C)Oc(cc2)cnc2Cl)n1,0 F6808-5922,Cc1nc2cnccc2c(N(CC2)CCC2(c2ccccc2)C#N)n1,0 F6564-5442,Cc1c(C(N(CC2)CCN2c2nnc(C3CC3)cc2)=O)sc(-c(cccc2)c2Cl)n1,1 F6491-0592,N#Cc1nccnc1OC(CCC1)CN1C(Cn1c(cccc2)c2nc1)=O,1 SD14-0760,Cc1ccc(CN(CC[C@@H]2N(C)C(CN3Cc4ccccc4)=O)C[C@H]2C3=O)o1,1 Z3043545553,CCN(CC1)C2(COCC2)CN1C(c1c(C)onc1-c(cccc1)c1Cl)=O,1 Z2225875815,CNS(N(CC1)CCN1C(CC1CC1)=O)(=O)=O,1 SA71-1092,C(C1CC1)C1(CNCCC1)c1noc(-c2ccncc2)n1,1 Z1996120734,Cc1c[nH]nc1C(Nc(cc(cc1)C(N)=O)c1N1CCCC1)=O,1 Z1860298888,CC[C@H](C)[C@@H](C(O)=O)NCc1ccccc1,0 Z2963774911,OCC(c(cccc1)c1OCC1)N1C(c1cocn1)=O,0 D079-0092,CC(C1)N(Cc2nnc(-c3ccccc3)o2)c2c1cccc2,0 Z4085680304,CN(C)Cc(cc1)ncc1C(NCCc1c[nH]c2c1ccc(Cl)c2)=O,0 Z1353378114,O=C(c(cc1)cc2c1OCCO2)OC1CCC1,1 F6476-1463,O=C(c(cccc1)c1SC(F)F)N(CC1)CC1Oc(nccc1)c1Br,0 F6194-0146,CC(Cc1ccco1)(CNC(c(o1)ccc1Br)=O)O,1 P297-4626,O=C(Nc(cc1)ccc1F)N(CC1)CC1n1c2ncccc2nc1-c1ccco1,0 SB27-0041,COc(cc1)ncc1C(N(CC1)CCC1N(C1)C2(COCC2)CNC1=O)=O,1 C566-0368,O=C(c(cc1)cc(C=C2S(c(cc3)ccc3F)(=O)=O)c1OC2=O)NCc(cc1)ccc1F,1 Z4499936314,O=C(C(CN1)c(cccc2)c2C1=O)Nc([nH]nc1)c1-c1ccccc1,1 S721-0895,CCNC(N(C[C@H](C1)Oc2cnccc2)[C@@H]1C(N1CCCC1)=O)=O,1 Z2960356193,Cc1nc(C(CC2)CN2C(c2cc3c(C)ccc(F)c3o2)=O)n[nH]1,1 Z1510571352,O=C(CCc1ccncc1)N(CC1)CCC1c1ncccc1,1 F5072-4243,O=C(Nc1cccs1)N(CC1)CCN1c(cc1)nnc1-c1ccco1,1 Z1860206157,CCC(C)(C)CNS(c(n(C)nn1)c1Br)(=O)=O,0 V013-8435,CN(C(CN1CC(N2CCC(Cc3ccccc3)CC2)=O)=C(C(c2c(C(F)(F)F)cccc2)N2)C1=O)C2=O,1 Z1436840294,Cc(nc(-c1ccccc1)nc1)c1C(NC1CCCC1)=O,0 F6556-1360,Cn1ncc(S(NCC2(CCSCC2)N2CCOCC2)(=O)=O)c1,1 F6573-9285,Cc1cc(C(NCc2nccnc2-c2ccncc2)=O)no1,1 F0877-0139,COc1cc(C(c(cc(cc2)Cl)c2N2)=NC2=O)cc(OC)c1OC,0 Z826822776,O=C(CN(C=Nc1c2oc3c1cccc3)C2=O)NCc1nnc[nH]1,1 F6560-4762,CC(C)C(Cn1nncc1)NC(c1cc(cccc2)c2[nH]1)=O,0 SC44-0320,O=C(COC1CC(CC2)(CCN2C(C2CCC2)=O)OCC1)N1CCOCC1,1 Z1728380258,CC(CN(C)C(c(cc(c(N1)c2)OCC1=O)c2Br)=O)c1nnn[nH]1,1 Z5064115023,CC(C)(Cc1c2cnc(SCc3cscc3Br)n1)CC2=O,0 F5857-0451,OC(CNC(c1nc(cccc2)c2s1)=O)(C1CC1)c1ccco1,1 Z1819003242,Cc(cc1)cc(C)c1-c(o1)nnc1SC1COC1,1 F6507-8774,COc1cccc(NC(NCC(CCC2)(c3c2occ3)O)=O)c1OC,0 S556-0934,O=C(C1CC1)N(C1)CC1Oc(cc1)ccc1-c1noc(C2CCOCC2)n1,1 F6064-5490,COc1c(Cc2noc(C3CN(Cc4csc(-c5ccccc5)n4)C3)n2)cccc1,1 Z3278072129,Cn1cnc([C@@H](CN(C2)S(c(cccc3)c3F)(=O)=O)[C@H]2N)c1,0 S069-4629,CCn1ncc(S(N(CC2)CC2c2noc(-c3nccnc3)n2)(=O)=O)c1,1 F0469-0023,C=C(Cn1c(cccc2)c2nc1COc1ccccc1)Br,0 F6200-4170,OC1(CNC(C2CC=CCC2)=O)c(cccc2)c2OCC1,1 Z5015110230,CCN(C(C1=CN=C2SC=C(C)N2C1=O)=O)c(cc1)cc(C)c1F,0 Z2294379958,COc1nccc(NC(N(CC2)CCN2c2cc(F)ncc2)=O)c1,1 Z2912616059,OC(c1coc(C(NCC(C(F)(F)F)N2CCOCC2)=O)c1)=O,0 F5772-7592,C=CCNC(Nc1nc(-c2c(CC3)cccc2)c3s1)=O,0 Z2714792091,Cn1nc(C2COCCC2)cc1NC(C(N1[C@H](CCC2)[C@H]2OCC1)=O)=O,1 C593-1265,Cc(cc1)cc(-c2c3cc(C(NCCN4CCN(Cc5ccccc5)CC4)=O)s2)c1OC3=O,1 F6802-8111,O=C(CN(CCC1)CC1C(N1CCSCC1)=O)NCc1ccccc1,1 Z2996687794,OCC1N(Cc(ccc(C(O)=O)c2)c2F)CCCCC1,0 F6796-9007,N#Cc1ccc(CN(C2)CC(C3)C2CN3c(nccc2)c2F)cc1,0 F5461-2010,O=C(C(C=C1)=COC1=O)N1CCN(Cc2nc(-c3ccccc3)cs2)CC1,1 Z2695622215,C[C@@H](CN(C1)C(C(C2)c3c2cccc3)=O)[C@@]1(C)C(O)=O,0 Y021-1083,CC1c2cc(-c3ccnc4ncnn34)c(C)cc2NC(C)(C)C1,0 SC45-0331,CC1n2nnc(CNC(Cc3cccc(Cl)c3)=O)c2CN(C)C1=O,1 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Y041-6974,O=C(c(cc1)cc2c1[nH]c1c2CCCCC1)NCC1CCOCC1,1 Z2015485083,O=C(c(nc1-c2ccccc2)nn1-c1cccc(C(F)(F)F)c1)N(C1)CC2OC1COC2,1 S975-0523,COCCN(CCN([C@H]1CN([C@H]2Cc3ccccc3)C(c3cscc3)=O)C2=O)C1=O,1 4676-0846,OC(c1cccnc1SC(CC(N1c(cccc2)c2Cl)=O)C1=O)=O,0 SB57-1546,Cc1noc(C)c1CCC(N(C1)CC1(CN(C1)S(C)(=O)=O)C1c1nc(C2CC2)no1)=O,1 Z2643747997,CCN(C1CN(C)CC1)C(C(C)c1ccc(C(F)(F)F)cc1)=O,0 F6520-1654,COc1ccc(CCC(NCCc2ccc(-c3cocc3)s2)=O)cc1,1 Z3687118386,C[C@H]1N(C)[C@@](CNC(c2nc(CCCC3)c3nc2)=O)(CO)COC1,1 Z1012353020,CCn1c(cccc2)c2nc1C(CCC1)N1C(NCCc1nnc2n1CCCCC2)=O,0 F6561-4637,C=C(CC1CC2)CC2N1C(c(s1)ccc1Cl)=O,1 Z1445495607,Cc1noc(C)c1C(Nc(cc1)ccc1C(N(CC1)CCC1C(O)=O)=O)=O,1 F1028-0008,O=C(c1ccccc1)NC(CS(C1)(=O)=O)C1NCc1ccco1,1 P809-0986,O=C(c1cc(cccc2)c2[nH]1)NC(CC1)CN1c1cc(-c2cccs2)n[nH]1,1 Z1441541368,C[C@H](CN(Cc1ccccc1)CC1)N1C(Nc(cc1)cc2c1oc(N(C)C)n2)=O,1 Y043-7172,O=C(NCC1Oc(cccc2)c2OC1)N(C[C@@H](C1)CN23)C[C@H]1C3=CC=CC2=O,1 D393-0098,CC(CC1)CCN1c1cc(C)nc2c(C)c(-c3ccccc3)nn12,0 F6550-7680,O=C(C1Oc(cccc2)c2OC1)N(C1)CC1N(C(C1C2C1)=O)C2=O,1 Z1845312837,CCn1cc(CN(C)C(C)C(N(CC2)CCN2c2ncccn2)=O)cc1,1 Z4407849962,OC(c1c(CCC(NC[C@H]2C[C@@H](Cn3nnc(-c4cncs4)c3)CCC2)=O)cccc1)=O,1 SB07-0291,CC(CCCC1)(c2noc(C3CC3)n2)N1C(c1c(C)nc(C)s1)=O,1 E570-0242,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(N(C)c(ccc(OC)c1)c1OC)(=O)=O,0 Y041-5133,N\1(C(c2c(\N=C1)cccc2)=O)[C@@H](C(=O)NCCC(=O)NCCc1c[nH]c2c1cccc2)C,1 SA93-0274,CCC(CCC1)(CN1C(CCN(c(cccc1)c1O1)C1=O)=O)C(N)=O,0 F6438-3588,CN(C)c1nc(CNS(c(cc2)cc3c2OCC3)(=O)=O)nc(N(C)C)n1,1 SD24-0037,CCN(C[C@@H]1CN(C2)C(c(cc3)ccc3OC(F)(F)F)=O)C[C@@H]2NC1=O,0 S903-0747,CC(C)S(N(CC1)CCC1c1nnc(C2)n1CCN2C(Cc1cc(F)ccc1)=O)(=O)=O,0 S932-2992,O=C(c1cscc1)N(CC1)CC1n1nnc(COCC2CC2)c1,1 F6687-5238,CN(CC(CC1)CCN1C(N1CCOCC1)=O)c1nccc(C(F)(F)F)c1,1 F5795-0349,CC(C1)N(C(c2cc(S(N(C)C)(=O)=O)c(C)o2)=O)c2c1cccc2,0 S720-0256,CNC([C@H](C[C@@H](C1)Oc2ccccc2)N1C(c1nc2ccccc2cc1)=O)=O,0 SB95-0082,COc(cc1)ccc1NC(N(CCN1CCCCC1)C1CNCCC1)=O,1 Y041-8988,Cn(cc1)c(cc2)c1cc2NC(CC(c1c2cccc1)NC2=O)=O,1 Z4480904610,CCC(C)C(C)C(NC(CC1)CCN1C(Cc1c(C)ccnc1)=O)=O,1 S423-1010,OC1CC2(CCN(Cc(ccnc3)c3F)CC2)OCC1,1 F6724-3010,C(C1(CCOCC1)c1cscc1)Nc1c2sccc2ncn1,1 F5857-8615,CC(CNC(NCCCc1ccccc1)=O)(c1cccs1)O,1 Z2357398681,CC(CCC(C1)C(O)=O)N1S(c(cccc1)c1Br)(=O)=O,0 V017-7757,Cc1nc2ncnn2c(N(CC2)CCC2N2CCOCC2)c1Cc1ccccc1,1 8020-8349,CC(O1)=CC(O)=C(C(CC(Nc2ccc(C(F)(F)F)cc2)=O)c(cc2)cc(O)c2OC)C1=O,0 SA65-1123,Cc1ccc(CN2CCC(CCc3noc(C4CCOCC4)n3)CC2)s1,1 Z2494959068,CC(C)C(C(NC(CC(C)(C)C)COC)=O)NC(c1ccco1)=O,0 F2879-8066,O=C(C(Nc(cc1)cc2c1OCCO2)=O)Nc1cccc(C(F)(F)F)c1,1 Z2595618748,CC(C(O)=O)N(Cc1ccccc1)C(c1cn(C(C)(C)C)nc1C)=O,0 V005-7451,CC(C)c1nc(sc2c3CCC(C)C2)c3c(N(CC2)CCN2C(c2cccc(Br)c2)=O)n1,0 Z2704760743,OCc(cc1)cc(CN(CC2)CC2c2nnc[nH]2)c1F,1 F6441-6548,COc(cc1)ccc1S(C(CC1)CCN1C(CCc(cc1)cc(Cl)c1F)=O)(=O)=O,1 Z345249914,CC(c(cc1)cc(OC)c1OC)NC(c1cn(cccc2)c2n1)=O,0 F3371-0883,CS(N(C(C1)c2ccco2)N=C1c1cscc1)(=O)=O,1 SC02-0744,COCCC(CC1)(CN1C(Nc(cc(cc1)F)c1F)=O)NS(C)(=O)=O,0 Z27529435,COC(CCCNC(C(Cc1c[nH]c2c1cccc2)NC(c(cccc1)c1Cl)=O)=O)=O,0 F0266-0141,O=C(c(cc1)ccc1Cl)N(CC1)c2cc3ccccc3cc2C1=O,1 F2964-2871,COc(cc1)ccc1-c(n1-c(cc2)ccc2F)cnc1SCC#N,0 Y043-4041,Cc1nn(C(CC2)CS2(=O)=O)c(NC(CN(C(C)=Nc(cc2)c3cc2F)C3=O)=O)c1,1 F6617-2021,CSC(N(CC1OCCC1)C(c1ccc2)=O)=Nc1c2F,0 F6529-0482,CN(c(cccc1)c1N1C2CCN(CC#N)CC2)S1(=O)=O,0 Z2327485459,OC(C(N(CC1)CCN1C(C(CCC1)c2c1cccc2)=O)=O)=O,1 F5258-0090,O=C(c1cccc(C(F)(F)F)c1)NCCNc(cc1)nnc1Nc1cnccc1,1 Z839515950,Cc([nH]nc1C)c1S(N(C)c1cc(C#N)ccc1)(=O)=O,0 SC99-0164,CCn(c(CC1)c2CN1S(Cc1ccc(C)cc1)(=O)=O)nc2-c1ncc[nH]1,1 Z1843646910,CC(Cc1ccccc1)(C1)CN1C(c1cc(Nc2ncccn2)ccc1)=O,1 Z2966638174,C[C@H](CC1)CN1C(C(Cc1ccccc1)NC(N)=O)=O,0 Z1875638881,CCc1ccc(C(C)C(N(C2)CC2c2nc(C)no2)=O)cc1,1 L958-0871,Cc(cc1)ccc1-c1csc(-c2cccn2CC(NCCCN2CCCC2)=O)n1,1 F2068-0251,COc1ccc(CCC(NCCS(N(CC2)CCN2c(cccc2)c2F)(=O)=O)=O)cc1,1 F6520-0226,O=C(C1CCOCC1)NCCc1ccc(-c2cccs2)s1,1 F6443-5652,CS(c1ccc(CCC(NCc2cc(Oc3ncccc3)ccc2)=O)cc1)(=O)=O,0 T396-1001,O=C(Cc1cscc1)Nc(cc1)cnc1N(CCN1C2CCCCC2)C1=O,1 Z2909015590,CCc1nnc(C(NCC2(COC)CCOCC2)=O)s1,1 Z605715230,Cc1nc(-c2cccc(NC(c3ccc(CN(C(CC4)=O)C4=O)cc3)=O)c2)n[nH]1,1 F6478-5936,O=C(C(c1ccccc1)c1ccccc1)N(CC1)CC1Oc(nc1)ncc1Cl,1 Z535939054,Cc1n[nH]cc1CNC(N1CCN(CC(F)(F)F)CCC1)=O,0 F6666-8776,CN(C=CC=C1C(Nc(cc2)cc(F)c2Cl)=O)C1=O,0 F3284-1648,O=C(c(cc1)ccc1F)N(CCCCN(C(c1c2cccc1)=O)C2=O)c(ccc(F)c1)c1F,1 Z1889877858,CC(C)C(CC1)(CN1C(c(cc1)nn1-c1ccccc1)=O)C(O)=O,0 F5860-4566,C=CCNC(NCc1cccc(Oc(cc2)ccc2F)c1)=O,0 T404-1973,O=C(CCCc1ccccc1)NC(CC1)CCN1c1nnc2n1cc(C(F)(F)F)cc2,1 Z2936883598,CCC(CC)(c1nc(-c2cc(N)nc3ccccc23)no1)C#N,1 K410-0119,Cc(cccc1)c1-n1nc(CS(C2)(=O)=O)c2c1NC(c(cccc1)c1Br)=O,0 S661-1108,CCN(C(C(C1)N2CC1(CC1)CCN1C(C1CC1)=O)=O)C2=O,1 S836-3557,CNC([C@@H](C1)[C@@H](COC)CN1C(CCCc1c[nH]c2c1cccc2)=O)=O,1 S694-2099,Cc1cnc(COC)n1C(CC1)CN1C(C1(CCCC1)c1ccccc1)=O,1 F6057-0548,Cc(cc1)cc(C)c1S(N1CCN(CCn2nccc2)CC1)(=O)=O,0 Z3132874426,Cc1cc(COCC(N(CC2CCC3)CC23N)=O)no1,1 F6479-5803,Cc1nccc(OC(CC2)CCN2C(CCC(c(cc2)ccc2Cl)=O)=O)n1,1 F1874-0456,CCCCSc1ncnc2c1cnn2-c(cc1)ccc1F,0 F6525-7361,Cc(n(CCNC(NCc1cccs1)=O)nc1C)c1-c1ccco1,1 Z1852342882,Cc1cnc(C(N(CCN2)C(c3ccc(C(F)(F)F)cc3)C2=O)=O)c(OC)c1,0 Z31071491,O=C(C1CC1)N(CC1)CCN1c1nsc2c1cccc2,1 G540-1010,Cc1cc(N2CCN(CCCNc3c(c(-c(cc4)ccc4Cl)cs4)c4ncn3)CC2)c(C)cc1,0 Z1310339672,CCOC(c1c(CN(C)c2ccccc2)oc(-c2ccccc2)n1)=O,1 Z2483451730,Cc1cccc(CCN(C[C@H]2C(O)=O)C[C@H]2c(cc2)ccc2Br)n1,1 Z2358961828,O[C@@H](CCC1)[C@H]1NS(c1cnc(ccs2)c2c1)(=O)=O,1 F6441-0645,O=C(c(s1)ccc1Cl)N(CCC1)CC1S(c(cc1)ccc1F)(=O)=O,1 F6543-1220,Cn1c(cccc2)c2c(CC(N(C2)CC2C#N)=O)c1,0 F0672-0047,CCOC(c1c(C)c(C(N(CC2)CCN2C(c2ccco2)=O)=O)c(C)[nH]1)=O,1 Y040-8652,OC([C@H]1CC[C@H](CNC([C@H]2CC[C@H](CN(C(c(cccc3)c3N3)=O)C3=O)CC2)=O)CC1)=O,0 V017-3957,CC(C)Cn1c(S(Cc2ccccc2)(=O)=O)ncc1CN(CC1CC1)C(c1cc(F)ccc1)=O,0 F3222-5455,Cc1c2c(NCc3ccc(C)cc3)ncnc2c(C(N2CCCC2)=O)s1,1 SC89-0271,O=C(c1ccccc1)N(C1)CC1(C(CN1CCCCC1)CC1)S1(=O)=O,0 Y500-1053,NC(c1c(NC(C(c2ccccc2)Sc2ccccc2)=O)sc2c1CCCC2)=O,1 SA91-0019,CN(C(C12CCN(CCCO)CC2)=O)c(cc2)c1cc2C(O)=O,0 Z1418828864,Cc1c(C)c(S(N(CC2)CCN2C(C(C=CN2)=CC2=O)=O)(=O)=O)c(C)c(C)c1,1 Z1683606034,O=C(C1CC1)N(CC1)CCC1c1nc(C2CCC2)no1,1 Z2447951113,O=C(C(C1)C11CCNCC1)Nc(cc1)cc(Cl)c1C(N1CCOCC1)=O,1 L470-0593,O=C(c1ccc(C(F)(F)F)cc1)NCc(s1)ccc1S(N1CCOCC1)(=O)=O,1 F5860-4505,CC(C)(C)NC(N1CCN(CC(F)(F)F)CC1)=O,0 K788-9260,Cc1nn2c(N(CC3)Cc4c3cccc4)cc(C)nc2c1-c(cccc1)c1OC,0 Z3076721666,Cn(c(C(F)(F)F)c1)nc1C(N(Cc1ccncc1)C1CC1)=O,1 F535-0151,Cc1c(C(N2CCCC2)=O)c(S(NCCC(Nc(cc2)cc3c2OCCO3)=O)(=O)=O)c(C)[nH]1,1 Z2911856105,Cn1ncc(NC(C2(CC3(CCC3)C2)C(O)=O)=O)c1,1 L302-0999,CC(C)C(N(CC1(C)C)c(cc2)c1cc2S(N1CCOCC1)(=O)=O)=O,1 Z973274774,NC(c(cc1)cnc1C(N(CC1)CCN1C(C1OCCC1)=O)=O)=O,0 Z1385409960,C(c1c[nH]nn1)Nc1c2sccc2ncn1,1 C583-0200,CC(C)CC(C(Nc1nc(ccc(C)c2)c2s1)=O)NS(c(cc1)cc2c1nc(C)s2)(=O)=O,0 V003-9217,CCN(C(C)=C(C(c(cc1)ccc1NC(Cc(cc1)ccc1OC)=O)N1)C(OC(C)C)=O)C1=S,0 Z2846219101,CC(C)N(CC1)CCC1NC(Cn1nnc(C2CCNCC2)c1)=O,1 F6608-3715,Cc1c(C)ncnc1N(CC1)CCC1OCC#CCN(CC1)CCN1c1ccccc1,0 Z976263252,Cc1noc(-c(cc2)ccc2C(N2c3cccc(F)c3C3(CCCC3)C2)=O)n1,1 F6448-1287,O=C(c(s1)ccc1Cl)Nc1cn(CC2CCOCC2)nc1,1 Z2272831144,OC(c1nc(C(N(CC23CC3)Cc3c2cccc3)=O)ccc1)=O,1 F6521-3682,CC(CNC(Cc1cc(OC)ccc1)=O)(c1cc(cccc2)c2o1)O,0 Z3216017694,C[C@@H]([C@@H]1C(N2CC(CCC(O)=O)CCC2)=O)C1(F)F,0 CM3542-7109,CN(CC(CC1)OC11CCN(Cc2cn(C)nc2)CC1)Cc1ccncc1,1 F6561-5716,CC(C)Oc(cc1)ccc1S(N(CC1)CCC1S(Cc1ccccc1)(=O)=O)(=O)=O,1 F6438-3490,CN(C)c1nc(CNC(Nc(cc2)cc(C(F)(F)F)c2Cl)=O)nc(N(C)C)n1,0 Z2971778011,OCC1(CNc2nccn3nc(C(F)(F)F)cc23)CC2(CCC2)C1,1 Z2335177340,O=C(C(C1)C1(CC1)CCS1(=O)=O)N(C1)CC2(CCC2)C1c1ccccc1,1 Z1447599277,Cc1cccc(C2(CNC(c(cc(CCC(N3)=O)c3c3)c3F)=O)CCCC2)c1,0 Z2874711184,O=C(C1CC2(CCC2)OCC1)NS(c1cc(Br)cs1)(=O)=O,1 Z2256338391,OC(C(CC(F)(F)F)NC(c1ccc(COc(cc2)ccc2F)o1)=O)=O,0 SC04-0351,O=S(c1cnccc1)(N(CCC1)CC1OCCc1noc(C2CCOCC2)n1)=O,1 F6525-2416,CCOCC(NCCn(c(C)c1)nc1-c1cnccc1)=O,0 F6559-5274,Cc1nc(N(C2)CC3(CCC3)C2C(O)=O)nc(C)c1,0 F3411-7278,CCc1nnc2n1c(cccc1)c1nc2SCC(Nc(cc(cc1)Cl)c1OC)=O,0 F6471-2744,O=C(Cn1c(cccc2)c2nc1)N1C2C=CCC1CC2,1 F2790-0357,O=S(c1cccs1)(N(CC1)CCN1c(cc1)nnc1N1CCCC1)=O,1 F6557-1845,O=C(c1cc(C(F)(F)F)ccc1)N(CCC1c(cccc2)c2Cl)CCS1(=O)=O,0 Z1866719212,OCCC(C1CCOCC1)NC(c1cccc(Br)c1F)=O,0 D401-0312,CSc(cc1)ccc1-c1c(Nc2cc(C(NCC3OCCC3)=O)ccc2)n(ccnc2)c2n1,0 Z1174802264,CC(C)(C)c1cc([nH]c(C(N(CC2)CCC2c2nncn2C2CC2)=O)c2)c2cc1,0 Z3538287261,CC(c(cc1)ccc1-c1cnccc1)NC(C1(CC(C)(C)C1)O)=O,1 F2879-1093,O=C(C(Nc(cc1)ncc1Cl)=O)NCCC(c1ccccc1)c1ccccc1,1 S948-0508,CCOC[C@](CN(C1)C(C2(C)CC2)=O)(CC2)[C@H]1CN2c(cc1)cc(C(F)(F)F)c1C#N,0 SA71-0526,O=C(c1ncncc1)N(CCC1)CC1(CC1CC1)c1noc(-c2cnccc2)n1,1 Z2296277339,OC(CC1)(CCN1C([C@@H](C1)[C@H]1c1cccc(Cl)c1)=O)C(F)F,0 F5860-0039,O=C(c(cc1)ccc1Cl)N1CCN(CC(F)(F)F)CC1,0 SC13-0636,CS(N(Cc1cnccc1)C(CCC1)CN1C1CCCC1)(=O)=O,1 Z1139943335,O=C(CN1N=C(CCCCC2)N2C1=O)Nc1ccnn1Cc(cccc1)c1F,0 F6796-3796,COc(cc1)c2nc(N(CCC3)CCN3c(cc3)nn4c3ncc4)sc2c1Cl,1 F1872-0914,O=C(CSc1nccn1Cc1ccco1)NC1CCCCC1,1 F6549-3523,O=C(NC(c1ccccc1)c1ccccc1)N1CC(Cn2ncnc2)C1,1 Z5027903390,COC(C1N(CC(N=C2N3N=C(N)N2)=CC3=O)CCOc2c1cccc2)=O,0 F6658-3411,Cc1nnc(cc2)n1nc2N(CCC1)CCN1C(CN(C=NC(c1ccccc1)=C1)C1=O)=O,1 F6471-2262,O=C(c(o1)ccc1Br)N(C(CC1)C2)C1c1c2ncnc1,1 F5481-0025,Cc(c1c2n(-c3ccccc3)nc1)nnc2SCC(NCc1ccco1)=O,1 F3334-2541,CCCOc(cccc1)c1C(Nc1nonc1-c1ccc(C)cc1)=O,0 Z4107122819,C[C@H]1O[C@@H](C)c2nn(C)c(C(N(C3)CC3Oc3ncccc3)=O)c2C1,1 G514-0139,O=S(c(ccc(F)c1)c1F)(Nc1cc(N(CCC2)S(c(cc3)ccc3F)(=O)=O)c2cc1)=O,0 F6442-0541,Cc1cc(C(N(C2)CC2S(c(cc2)ccc2OC)(=O)=O)=O)no1,1 Z4464308279,CC1(C)c2nc(Cl)nc(N3CCC(CNC(C(F)(F)F)=O)CC3)c2CCC1,0 5910-0280,O=C1N=C(Nc2nc(-c3ccccc3)c(cc(cc3)Cl)c3n2)NC2=C1CCC2,1 F6471-9293,Cn1c(S(C(C2)CN2C(c(cc2)ccc2S(N2CCCC2)(=O)=O)=O)(=O)=O)ncc1,1 SC66-0232,CC(C)Cn1c(C(CN(C2)C(NCc3ccccc3)=O)C22CCOCC2)nnc1,1 J025-0008,COc1c(C(C2)c(scc3-c4ccccc4)c3NC2=O)cccc1,0 SC76-0542,Cc1nccn1CCNC(CN(C([C@]1(COc2ccccc2)[C@H]2C1)=O)c1c2cccc1)=O,0 Z2233385027,Cc1c(C(N(CC2)CCC2c2nnc(N)[nH]2)=O)nnn1-c1cccc2cccnc12,1 Z5001783628,C[C@H](C(N(C1)CC(NC(N2)=O)=C1C2=O)=O)N(Cc1c2cccc1)C2=O,1 Z4082242535,O=S(c1c2OCCCn2nc1)(N(CC1)CCN1C1(C2)CC2C1)=O,1 SB39-0438,CCS(N(CC1NC(NC2CCCCC2)=O)CC2(CCCC2)NC1=O)(=O)=O,1 F6561-0818,COCc1cn(C(CC2)CN2C(COc(ccc(Cl)c2)c2Cl)=O)nn1,0 V019-1848,CC(C)c1ccc(C2N(Cc3cccnc3)CCCn3c2ccc3)cc1,1 F6064-4822,O=C(c1ncccc1)N(C1)CC1c1nc(-c2cscc2)no1,1 Z1101926247,CC(N(CC1)CCC1C(Nc1cc(CN(CCC2)CC2C(N)=O)ccc1)=O)=O,1 Z1265649918,CC(C1)Oc(cc(cc2)F)c2N1S(c1c(C)[nH]nc1C)(=O)=O,0 F6363-0635,O=C(c1c(C(F)(F)F)cccc1)NCCNc1ncnc(-n2cccc2)c1,0 L598-0151,Cc1nc(-c2cc(S(Nc(cc3)cc4c3OCCO4)(=O)=O)c(C)cc2)cs1,0 8013-3190,COc(cc1)ccc1C(NC(C(F)(F)F)(C(N1c(cc2)ccc2OC)=O)NC1=O)=O,0 F6793-6920,Cc1noc(C)c1CN1CCN(CC(F)(F)F)CC1,0 F228-0525,Cc1c(C)oc2c1c(N(CCC1)CC1C(NCCN1CCOCC1)=O)ncn2,1 F6523-1672,Cc1cc(N(CC2)CCC2NC(c(cccc2)c2OC(F)(F)F)=O)n[nH]1,0 F6573-6436,O=C(Cc(cc1)cc2c1OCO2)N(CC1)CCC1(C1)C1(F)F,1 F6752-2303,CC(C)(C)C(NC(CC1)CCN1c1nc(COC)ns1)=O,0 Z2843431039,Cc(n1C)nnc1N(CC1)CCN1C(c1csc(Cc2ccccc2)n1)=O,1 G620-0796,Cc(s1)ccc1S(Nc(cc1)ccc1-c(cc1)nnc1N1CCCCC1)(=O)=O,1 S606-0478,COCCN(c1c(N2[C@H](CC3)CN3C(NCCc3ccccc3)=O)nccc1)C2=O,1 L678-0054,CC(Cc1c2cccc1)(C(NCc1ccc(C)cc1)=O)N(Cc1ccco1)C2=O,1 Z1530719655,Cc1cn(CC(Nc2cncc3ccccc23)=O)c2c1cccc2,1 Z2233664511,CC1(CC1)C(Nc1n[nH]c2c1ccc(O)c2)=O,0 F6521-4194,CN(C)c1cccc(C(NCC(c2csc3c2cccc3)O)=O)c1,0 D330-0144,O=C(C1Cc2cc(cccc3)c3o2)Nc2c1cccc2,0 S651-0620,CCn(cc1)nc1C(N1CCC(C2)(CN(C)C2C(N2CCOCC2)=O)CC1)=O,1 T787-4932,CN(C)C(C(CN(C1)C(COc2ccccc2)=O)C11CCOCC1)=O,0 Z4107122053,C[C@H]1O[C@@H](C)c2nn(C)c(C(NCc3c(C)onc3C)=O)c2C1,0 Y042-7397,c1(nc2c([nH]1)cccc2)[C@@H](NC(=O)COc1cc2OC(\C=C(/c2cc1)\C)=O)CC(C)C,0 Z2158438894,COC1(CCCC1)c1nc(-c2cc(scc3)c3nc2)no1,1 G589-0450,CCC(C)NC(N(CCC1)CCN1S(c(cc1)cc2c1n(CC)cc2)(=O)=O)=O,1 Z1769488243,CC(C1)N(CC(C)(C)O)CCN1C(c(cc(C)cc1)c1N1CCCC1)=O,1 Z4010104636,OC([C@@H](C1)[C@@H]1[C@H](C1)[C@H]1NC([C@@H]1CC=CCC1)=O)=O,1 F2211-0054,Cc(cccc1)c1C(Oc(cc1)c2cc1NC(c1cnccc1)=O)=CC2=O,1 SC89-0383,O=C(c1ccco1)N(C1)CC1(C(CN1CCOCC1)CC1)S1(=O)=O,1 Z5027903599,Cc1c(COC(c(cc2NC(c3ccccc3)=C3)nn2C3=O)=O)cccc1OC,0 F3097-6264,COCCNC(COc(ccc(-c1ccccc1)c1)c1Br)=O,0 Z1704006856,Cc1c(CCC(N(CC2)CCC2(c2ccccc2)O)=O)c(C)nc2cc(O)nn12,1 SC10-0925,Cc1noc(C)c1S(N(CC1)CC1N(CCCN1CCCC1)S(C)(=O)=O)(=O)=O,0 F6294-0584,O=C(C1CC=CCC1)NCc1nn(C2CCCC2)c(-c2cccs2)c1,1 Z1608817544,CC(N1CCN(Cc(cc2)ccc2NC(c2nn(C)c(C3CC3)c2)=O)CC1)=O,1 F6605-0205,Cc1cc(C)nn1C(C=C1)=NN(CC(C2)CN2S(c2cn(C)c(C)n2)(=O)=O)C1=O,1 Z3004383063,O=C([C@@H]1[C@@H](c(cc2)ccc2Cl)OCC1)NC(CC1)CS1(=O)=O,1 S988-0452,CCS(N(C[C@@H]1CN(C2)C(c3ncncc3)=O)C[C@@]12c1nc(C)no1)(=O)=O,1 SB59-0616,CCCS(N(C1)CC1(CN(Cc1ccccc1)C1)C1c1nncn1C)(=O)=O,0 Z1319238279,O=C(c(cc1)cc2c1[nH]nc2)NCc1nc2ccccc2cc1,1 F6439-2022,COC(c(cc1)ccc1C(NCCn(c(C1CC1)c1)nc1-c1cccs1)=O)=O,1 S646-0236,C(C1(CCCC1)C1c2ccccc2)N1C1CCNCC1,1 F3406-7252,CCC(N=C(C)N1CC(Nc(cc2)ccc2OCC)=O)=CC1=O,0 Z2872633543,CC(c1c(C)sc(NC(C2CC2)=O)n1)=O,0 D639-0018,Cc1nc(N2CCCC2)cc(N(CC2)CCN2C(Nc(c(OC)c2)cc(Cl)c2OC)=O)n1,0 F0452-6141,OC(c1nn2c(-c3ccccc3)cc(-c3ccccc3)nc2c1)=O,1 F6524-1632,CC(N=C(N1)N(CC2)CCC2NC(c(cc2)ccc2-n2cccc2)=O)=CC1=O,1 Z4967398156,CNC(C(CC1)CN1S(C(C1)C1c1ccccc1)(=O)=O)=O,0 SA89-0247,O=C(Cc1cscc1)N1CCC(CN(CCN2CCOCC2)C2CCOCC2)CC1,1 Z1067641808,CCCN(Cc1ccc2)Cc1c2NC(C1CC1)=O,1 F6549-7456,O=C(C1CC=CCC1)N(C(CC1)C2)C1CC2n1ncnc1,1 Z3071537590,CN(CCNC(COCC1OCCC1)=O)c1ncccc1,1 V009-2565,CC(C)(C)CC(C)(C)Nc1c(-c(cc2)ccc2Cl)nc(cc2)n1cc2Cl,0 F6793-5192,O=C(c(s1)ccc1Br)N1CC(CF)CCC1,0 F5069-0425,COC(C(CC1)CCN1C(c(c(OCc1ccccc1)c1)nn1-c(cc1)ccc1F)=O)=O,1 Z3640692601,O=C(c1c(c(C2CC2)no2)c2nc(-c2ccco2)c1)NC1CC(CC2)OC2C1,1 Z3772905340,CCC(C)(CCC1)CN1C(c(o1)cc(C)c1Br)=O,0 Z1455179293,Cc1cccc2c1n(C)c(-c1c(N)n(C)nc1)n2,0 Z1852076649,NC(c1c(CC(CNC(CCc(cc2)cc3c2[nH]cc3)=O)CC2)n2nc1)=O,1 F6476-6038,Cc1noc(C)c1C(N(CC1)CC1Oc(ccnc1)c1Cl)=O,1 Z1449928807,CCN1CC(CC2)N(CCc(cc3)cc(F)c3F)C2CC1,1 Z3843855737,OC(C1)CN1C([C@H](C1)[C@H]1c1nc(C(F)(F)F)no1)=O,1 SB36-0621,O=C(c1cn(C[C@H](C2)N(CC3CC3)CC2(F)F)nn1)N1CCOCC1,1 M563-0668,CCCC(Nc1cc(CN(C(C2)C(N(C)C)=O)C(c3cccs3)=O)c2cc1)=O,0 G373-1549,CCOc(cc1)ccc1-c1nc(CN(CC2)CCN2S(c(cc(cc2)OC)c2OC)(=O)=O)c(C)o1,0 SC88-0807,O=C(NCc1ccccc1)N(C1)CC1(C(CC1)c2nc(-c3ccncc3)no2)S1(=O)=O,1 S615-0574,Cc(cccc1)c1S(N(CC1)CC1c1nc(CCOCC2CCCC2)no1)(=O)=O,0 Z2351783641,CC(C)(CNS(c(cc1)cc(Br)c1C(O)=O)(=O)=O)C(C)(C)O,0 Y031-5101,CC(C)N(CC(C1)C(Nc(cc2)ccc2C(Nc(cc2)cc3c2OCCO3)=O)=O)C1=O,1 D578-0136,Cc1noc(C)c1S(Nc(cc1)ccc1Nc1nc(N2CCOCC2)nc(C)c1)(=O)=O,1 8014-7592,NC(C(CC1)(CCN1C(CC(N1Cc(cc2)ccc2N(CCC2)C2=O)=O)C1=O)N1CCCCC1)=O,1 F6564-3181,O=C(CN1N=C(C2CC2)C=CC1=O)Nc1nccnc1,1 F6510-2236,CN(c(ccc(F)c1)c1N1CCNC(c(ccc(OC)c2OC)c2OC)=O)S1(=O)=O,0 F6726-0508,Cc1cc(C)nn1-c1cc(OCC(CC2)CCN2c(nc2)ncc2F)ncn1,1 C301-8798,O=C(c1nc2ccccc2nc1N1CCOCC1)Nc1cccc2nsnc12,1 F018-0003,CCc(cc1)ccc1N(C(CC1NCc(cc2)ccc2OC)=O)C1=O,0 SB23-0644,CC(C)C(N(C[C@H]1CN(CC2)C(c3cccs3)=O)C[C@@]12c1nc(C)n[nH]1)=O,0 Z3047132967,NCc1cccc(CNC(NC(Cc2cc(F)c3)COc2c3F)=O)c1,0 F432-0397,CC(C)c(cc1)ccc1S(Nc(cc(c(N1C)c2)N(C)C1=O)c2Sc(cc1)ccc1OC)(=O)=O,0 S721-0970,O=C(C1CCC1)N(C[C@H](C1)Oc2cnccc2)[C@@H]1C(NC1CC1)=O,1 Z3799548640,CC(CN(C)C(c1cnc(C2(CN)CCC2)cc1)=O)c(ccc(F)c1)c1F,1 Z953951822,Cc1noc(C(CC2)CCN2C(NCC2COCCC2)=O)n1,1 Z2482868518,COc1cc(C(C(O)=O)N(CC2)Cc3c2scc3)cc(OC)c1,0 F5679-0154,O=C(Cc1csc(-n2cccc2)n1)Nc(cc1)cc(C(F)(F)F)c1F,0 F5882-3041,O=C(NCc1cccc2ccccc12)Nc(cccc1)c1N(CCN1)CC1=O,1 F6510-3780,Cc(c(NC(C1c(cccc2)c2Oc2c1cccc2)=O)c1)cc(N2C)c1N(C)S2(=O)=O,1 Z290420242,O=C(c(ccc(Cl)c1)c1N(CCC1)C1=O)NCC1CC1,1 F0537-0337,O=C(c1cc(CCCC2)c2cc1)Nc1nccs1,0 Z4766280502,C[C@](CO)(CCC1)[C@H]1NC(c(cc1)cc2c1[nH]c1c2CCCC1)=O,1 F6734-0777,CC(C=C1)=NN(CC(N(C2)CC(C3)C2CN3c(cc2)ncc2Cl)=O)C1=O,1 F6549-2872,O=C(Cc1cscc1)N(C(CC1)C2)C1CC2n1cncc1,1 V030-2683,O=C(CCc1c(-c2ccccc2)nc(cc2)n1cc2-c1cc(cccc2)c2s1)NCCc1ncccc1,1 Z4881506383,CC(c1cc(-c2n[nH]nn2)ccc1)NC(c1c(Cc2ccccc2)n(C)nc1)=O,0 Z2351775059,NC([C@@H](CCC1)N1S(c(cc1)cc(F)c1C(O)=O)(=O)=O)=O,0 Z2370122428,C(c1ccno1)c1noc(-c2cc(CN3CCCCC3)ccc2)n1,1 F6360-9481,Oc(ncc(C(N(C1)CC1Oc1cnccc1)=O)c1)c1Cl,0 G221-0703,Fc1c(C(c2nnc(-c3ccccc3)o2)NCC2CCN(Cc(cc3)ccc3Cl)CC2)cccc1,1 Z1684176339,Cc1cccc(-c2noc(C(C3)CN(C)C3=O)n2)n1,1 Y503-4563,FC(c1c(c(C2CC2)nn2-c3ccccc3)c2nc(-c(cc2)ccc2F)c1)(F)Cl,0 F6619-6084,Cc1nc(N(CC2)CCN2c2ncccc2C#N)cc(N2CCOCC2)n1,1 Z1423399122,CC(C(C)(C)C)NC(c1cncc(O)c1)=O,0 F2392-0595,O=C(C1CCCC1)NCC(c1cscc1)N1CCOCC1,1 F6246-1861,CCc(s1)ccc1S(N(CC1)CCC1c1nnc(C(F)(F)F)o1)(=O)=O,0 F6502-5280,O=C(CCc1ccccc1)Nc1cn2nc(C(F)(F)F)cc2nc1,0 Y041-7203,O=C(c1cc(Nc2ncccn2)ccc1)NCC1CCOCC1,1 F6471-0690,CC(Nc1ccc(CC(N(C2)CC2n2nnc(-c3ccccc3)c2)=O)cc1)=O,0 F6471-5695,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)N(CC1)CCC1n1nncc1,1 F6597-2523,Cc1noc(C)c1CC(N1CCC(COc2cccc(C(F)(F)F)n2)CC1)=O,1 Z2790708326,OC1(CC(CC2)N(Cc3nc(C(O)=O)cs3)C2C1)c1ccccc1,1 Z2646823652,O=C(C1=CC=C(c2ccncc2)NC1=O)N1CC(C2)C2CC1,1 Z2963774104,CC(C)OCCC(N1C(CO)c(cccc2)c2OCC1)=O,0 Z2770633860,C([C@H](CCC1)N1c(cc1)nnc1N1CCCC1)Oc1ccccc1,0 G008-0634,O=C(C(CC1)CCN1S(c(cc1)cc2c1[nH]c1c2CCCCC1)(=O)=O)NCCC1=CCCCC1,1 D437-0714,CC1Oc(ccc(-c2csc(NC(c3cc(OC)cc(OC)c3)=O)n2)c2)c2N(C)C1=O,0 Z2438447546,CC(C)CCOc(cc1)ccc1NC(c1c(C)n(C2CCNCC2)nn1)=O,0 F0854-0078,CC(c(cc1)ccc1NC(Cn1nnc2c1cccc2)=O)=O,0 F6660-0999,CCOC(C1=NN(c(cc2)cc3c2OCO3)c(cccc2)c2C1=O)=O,1 S997-0342,CC(N1C[C@@H](CN(Cc2nc(OC)ccc2)C2)[C@]2(CO)CC1)=O,1 SC42-0117,Cc1nc(CC2CC(CC3)(CCN3C(CCc3nc(cccc4)c4s3)=O)OCC2)no1,1 Z4573437442,COC(c1cc(CCC2N)c2cc1)=O,0 F5833-6683,O=C(CSCc1ccccc1)Nc1cc(N(CCCC2)C2=O)ccc1,1 S606-1850,O=C(c1n[nH]cn1)N(CC1)C[C@@H]1N(c(nccc1)c1N1CC2CCCCC2)C1=O,1 SB36-1327,CNC(c1cn(C[C@H](CC(C2)(F)F)N2C(c2n[nH]c-3c2CCc2c3cccc2)=O)nn1)=O,1 F6515-1334,Cc(n(-c1ccccc1)nc1)c1C(NCc1cc(-c2ccco2)ncc1)=O,1 F3368-0160,CC(Nc(cc1)ccc1OCC(CSc1ncccc1)O)=O,0 T501-1456,O=C(CCS(c(cc1)cc(CC2)c1NC2=O)(=O)=O)N1CC(Cc2nncn2-c2ccccc2)CCC1,1 Z2992183239,O=S(c1ccnn1C1CCC1)(Nc1cc(-c2cccs2)n[nH]1)=O,1 D374-0174,CCC(C(Nc(cc1)cc(N2)c1OCC2=O)=O)Oc(cc1)ccc1F,0 Y041-4311,Cc1cc(OCC(N(C)C(CC2)CS2(=O)=O)=O)c(C(C)=C(C)C(O2)=O)c2c1,0 Z3043545438,CCN(CC1)C2(COCC2)CN1C(c(scc1)c1-c1ccccc1)=O,1 Z1688272071,NS(c(cc1F)cc(Br)c1N1CCCCC1)(=O)=O,0 Z2434663821,CC(CC(Nc(cc1)ccc1-n1nccc1)=O)C1CCNCC1,0 V017-6681,Cc1cccc(C(C(C(NC2CC2)=O)c2c3cccc2)N(C2CC2)C3=O)c1,1 S632-4253,Cc1ccc(C(N(CC2)CC2C(CC2)CCN2C(NC)=O)=O)s1,0 Z1508112881,NC(c1cc(OCC2CCC2)ccc1)=O,1 F5688-0029,Cc(cc1)c(C)cc1NC(NCCN1N=C(c2ccccc2)N(C)C1=O)=O,1 Z4473481088,CCOC(C(CC1)(CC2)CCC12C(N(C1)CC1(CC1)CCC1OC)=O)=O,1 F6555-6416,CC(C(N(C1)Cc2c1cccn2)=O)Oc(cc1)cc2c1OCO2,1 Z1218323089,Cc1nc(CN(CCC2)CCN2C(Nc2ccncc2)=O)cs1,1 Z826945812,CN(c([nH]1)c(C(N2)=O)nc1N1CCCC1)C2=O,1 F6357-0844,COCCNC(C(NCC1(CCCC1)c1cscc1)=O)=O,0 Z3092006426,CCN(Cc1nc(CCC(C)C2)c2s1)C(c1nsnc1)=O,1 F6709-4332,Cc(nc1)cnc1C(N(C1)CC1Oc1cc(C(F)(F)F)ncc1)=O,1 F345-1398,COc1cc(NC(N2CCC(CC(NCc(cc3)ccc3F)=O)CC2)=O)cc(OC)c1,0 Y020-3533,CC(c(cc1)ccc1NC(C(CC(N1)=O)C(C(N2)=O)=C1N=C2N(CC1)Cc2c1cccc2)=O)=O,0 Z1022729392,O=C(CCC1CCCC1)NCC(NCC(NC1CC1)=O)=O,1 Z3103204852,NC(CC1)CCC1(C1)C1C(Nc1cn(Cc2cnccc2)nc1)=O,1 F0885-0034,CCOC(N(CC1)CCN1C(CCN(C(c1c2c3cccc2ccc1)=O)C3=O)=O)=O,1 F6571-3263,CN(C)c1cccc(C(NCC2(CSCC2)OCCO)=O)c1,0 Z740394630,CC(C)(C)c1nnc(NC(C(C)(C)Oc(cc2)ccc2Cl)=O)s1,0 Z1739083454,Cc(ccs1)c1S(N(CCC1)C[C@H]1C(O)=O)(=O)=O,0 Y040-9781,O=C(CN1N=C(CCCCC2)C2=CC1=O)NC1CC1,1 F6523-3648,O=C(C1(CCOCC1)c1ccccc1)N(CC1)CC2=C1N=C(C=CC=C1)N1C2=O,1 F6677-3213,Clc1cn(CC(C2)CN2c2ncnc3c2CCCC3)nc1,1 F5831-2206,CC(Cc1ccco1)NC(NCc1cccs1)=O,0 F6519-5776,O=C(c1nc(cccc2)c2s1)NCC(c1ccco1)n1nccc1,1 G944-0638,O=S(c1ccccc1)(NCc1nc(-c(cc2)cc3c2n(C2CCCC2)nn3)no1)=O,0 S248-3531,Cc(nc1)cnc1C(N1CC(Cc2noc(-c3ccncc3)n2)CC1)=O,1 F6524-0990,O=C(c1cc(cccc2)c2s1)NCCN1N=Nc(cccc2)c2C1=O,1 Z1020845572,CC(c1nc(Cc(cccc2)c2Br)no1)NC,0 Z1241547890,CC(Cc1ccc(C)cc1)N(C)S(c(cccc1)c1OC(F)F)(=O)=O,0 Z737923200,Cn1nnnc1-c1cccc(NS(c(cc(CCC(N2)=O)c2c2)c2F)(=O)=O)c1,1 K784-0877,Cc1c(CSCCC(NC2CCCCCC2)=O)cccc1,1 Z1615890422,CC(c1nc(cccc2)c2o1)N(CC1)CCN1c1ncccn1,0 S635-1616,COCCN1CC2(CCN(Cc(cc3)cc(F)c3Cl)CC2)C(CO)C1,0 Z795488404,COc(cc1)ccc1-c1cc(C(OCc(nns2)c2Cl)=O)nn1-c1ccccc1,1 F5596-0123,COc(cccc1)c1C(N(CC1)CCC1c1nnc(-c(cc2)ccc2F)o1)=O,0 F6518-2575,CC(c1ccc(CCNC(Nc2cc(C(F)(F)F)ccc2)=O)s1)=O,0 Z2597304883,CS(N(CCC1)CCN1C(C(O)=O)c(cccc1)c1Br)(=O)=O,0 Z2968711356,CC(NCC(CCC1)CN1c(cc1)nnc1-c(cccc1)c1Cl)=O,0 F6755-4600,COc(cc1)cc2c1sc(N(CC(C1)CN34)CC1C4=CC=CC3=O)n2,1 Z2595760477,CCCn1nccc1C(N[C@H](C1)C[C@@H]1C(O)=O)=O,0 Z2439958412,CN(C1CCNCC1)C(CCc1ccncc1)=O,0 F6560-5484,Cn1ncc(-c2cc(CNC(Oc3ccccc3)=O)cnc2)c1,1 F6359-3847,Cc(cc1)nnc1OC(CC1)CCN1C(c(s1)ccc1Cl)=O,1 Z2066041613,OC(CC(C1)c(cccc2)c2N1S(c1cocc1)(=O)=O)=O,1 Z4031091917,OCC(C1)(C2)CN(Cc3csc(Nc4ccccc4)n3)CC12F,1 Z1451610920,O=C(c1ccnn1C1CCCC1)NC1CC2(CCOCC2)OCC1,1 F1757-0300,Cc(cc1C)cc(C)c1S(N(CC1)CCN1C(N(C)C)=O)(=O)=O,0 Z3687008339,Cc(ccc(CNC(N(C[C@@H]1CC(N)=O)C[C@@H]1O)=O)c1)c1Br,0 F6524-2535,Cn1c(C(N(CC2)CC2c2noc(-c3ccco3)n2)=O)ccc1,1 F6560-7438,O=C(C1(CCCC1)c1cccs1)NCc(cc1)cnc1-c1cocc1,1 S779-2120,Cc1cnc(C2CCC2)n1CC(CC1)CN1C(CCCc1c[nH]c2c1cccc2)=O,1 Z1287189462,COc1cccc(NC(N2CC(CN3CCCCC3)CC2)=O)c1,0 SC69-0872,Cc1noc(C)c1S(N(C1)CC2(CCCC2)C1c1nncn1C1CC1)(=O)=O,1 G849-0103,O=C(CCNS(c(cc1)cc(CC2)c1N2C(C1CC1)=O)(=O)=O)N(CC1)CCN1C(c1ccco1)=O,1 SC42-0328,O=C(C1CCC1)N(CC1)CCC11OCCC(Cc2noc(C3CCC3)n2)C1,1 SC17-0003,CS(N(CC1)CCC1c1noc(CCNC(C2(CCCC2)c2ccccc2)=O)n1)(=O)=O,1 F6247-2082,CCOc1c(CNc(nc2)nc(NC(N3Cc(cccc4)c4F)=O)c2C3=O)cccc1,1 Z929407432,Cc(ccc(C(N)=O)c1)c1NC(c1cc(-n2ncnc2)ncc1)=O,1 Z764481574,CNC(C(C1)Oc(cccc2)c2N1C(Cn(cc1)c2c1cccc2)=O)=O,0 S543-0610,CC(C)NC(N(C1CC1)C1CC(CC2)(CCN2C(CCC2CCCC2)=O)OCC1)=O,1 S904-0104,CC(C)N(C[C@H](C1)O)[C@@H]1c1nnc2n1CCN(C)C2,1 SD02-1380,CCC(CC)C(N1CCC(C2)(CN(CC(N3CCOCC3)=O)C2c2nnc(C(C)C)o2)CC1)=O,1 F6522-0483,O=C(NCc1cc(-c2ccco2)cs1)Nc(cccc1)c1F,0 Z2365132615,C[C@](C1)(C[C@@H]1Nc1ncnc2c1cn[nH]2)O,1 Z2093727904,Cc1ccc(C(CC(C2)C3)(CC2C2)CC23C(NC(CC2)CCC2(C(N2)=O)NC2=O)=O)cc1,1 SA04-0075,Cc1cc(C(N(CCC2)CC2c2nc(C)ncc2CO)=O)c(C)n1CCCOC,0 Z3634355369,OCC(C1(CC(C2)C3)CC3CC2C1)NC(c1nnc(C2CC2)o1)=O,1 S896-0531,C(CN1CCOCC1)Nc1nc(C2CCCC2)nc2c1CCOCC2,1 Z3677410467,CCCNC(c1c(C)[nH]c(-c2csc(N3CCNCC3)n2)c1CC)=O,0 Z2272348714,CC(C(NC(Cc1c[nH]c2c1cccc2)CO)=O)OCc(cc1)ccc1F,0 Z851799816,COc1c(C(c(cc2)ccc2Cl)N)ccc(Cl)c1,0 8006-4625,OC(C(CC1)CCN1C(CC(N1c(cc2)ccc2Cl)=O)C1=O)=O,0 P113-1240,O=C(c1csc(N(CC2)CCN2c(cc2)ccc2Cl)n1)N1CCOCC1,1 F6562-4056,CN(C)c1nc(CCC(C2)NC(C3=CC=CN(C)C3=O)=O)c2cn1,1 Z2175133878,CC(CCOCC1)N1C(CNS(c(cc1)ccc1Cl)(=O)=O)=O,0 SC19-0648,CCn1nc(CN(CC2)CCC2NS(c2cccs2)(=O)=O)c2c1CCOC2,1 SA96-1319,O=C(C1C(C2)(CN2C(C2CCOCC2)=O)CN(Cc2ccccc2)C1)N1CCCC1,1 C276-0803,CC(C)(C1)CC(NC(CC2c(cc(c(OC)c3)OC)c3Br)=O)=C2C1=O,0 SB06-0396,O=C(CC(CC1)C1(CC1)CCN1S(Cc(cc1)ccc1Cl)(=O)=O)N1CCOCC1,1 SC04-0368,O=C(c1c[nH]nc1)N(CCC1)CC1OCCc1noc(C2CCOCC2)n1,0 F6678-8502,Cc1nc(cccc2)c2n1C(C1)CN1S(C1CC1)(=O)=O,1 F2662-0105,O=C(C(NCc(cc1)cc2c1OCO2)=O)NCC(c1cccs1)N(CC1)Cc2c1cccc2,1 Y031-7035,CN(c1c(C(N2C)=O)n(CC(Nc(cccc3)c3C(NCC3OCCC3)=O)=O)cn1)C2=O,1 Z3052474753,Cc1c(C(N[C@@H](CC2)C[C@@H]2C(N)=O)=O)snn1,1 SB99-0384,Cn1nc(CCC(NC2CC2)=O)c(C2)c1CCN2C(CC1CCCC1)=O,1 Z1918036968,Cc1cccc(S(NCC(C(O)=O)c2ccccc2)(=O)=O)c1C#N,0 F6725-2690,CCc1ncnc(NCc2cc(-c3cn(C)nc3)ncc2)c1F,1 Y020-9446,Cc(nc(NCCc1ccccc1)nc1)c1C(O)=O,0 Z2482827572,OC(C(c1cccc(Br)c1)N(CC1)CCN1c1ncccn1)=O,0 F5857-3503,OC(CNC(CSCc1ccccc1)=O)(C(F)(F)F)c1ccccc1,0 F6540-0644,CN(CC1)CCN1C(N(CC1)Cc2c1ncnc2)=O,1 Y044-0999,OC(C(CCC1)CN1C(Cn(cc1)c2c1ccc(Br)c2)=O)=O,0 Z2442523014,Cc(nc(cc1)-c2cscc2)c1-c1nc(C2(CCC2)N)no1,1 F6448-1233,CCSc(cccc1)c1C(Nc1cn(CC2CCOCC2)nc1)=O,0 F1929-0458,OC(c(cccc1)c1C(N(CC1)CCN1C1CCCC1)=O)=O,1 Z2627913618,OC(c1ccc(CCC(N[C@H](C2)C[C@@H]2c2cccc(F)c2)=O)cc1)=O,0 F6475-1889,O=C(CNC(c(cn1)cc(Cl)c1OC1COCC1)=O)OCc1ccccc1,1 Z2962538565,Cc1ccc(-c2n[nH]c(C(N(CC3)CCC3(C3CCC3)O)=O)c2)o1,1 SB03-0195,O=C(C1CC1)N(CCC1)CC1N(CCNC(C1CCCCC1)=O)C1CCOCC1,1 SA65-1016,COc1cc(OC)c(CN2CCC(CCc3noc(C4CC4)n3)CC2)cc1,1 Z1543259344,CC(C)NC(Nc(cccc1)c1C(NC(C(C1)O)c2c1cccc2)=O)=O,0 Z237580794,O=C(CC1)NCCN1c1ncnc2c1cn[nH]2,1 F6518-4335,O=C(c1cocc1)N(CC1)CC1c(cc1)cc2c1OCO2,1 L367-0067,O=C(c(cc1)ccc1-c1cnc(N2CCCC2)nc1)Nc(cc1)ccc1Cl,0 T835-1402,CC(C)n1c(nccc2)c2nc1CC(CC1)CN1C(CSc1ccccc1)=O,1 SB70-0883,Cc(occ1)c1C(N[C@@H](Cc1c2)Cn1nc2C(NCc1ccccc1)=O)=O,1 Y020-8792,O=C(C(CC(N1)=O)C(C(N2)=O)=C1N=C2N(CC1)Cc2c1cccc2)Nc1ccccc1,0 F5833-1182,O=C(NCC(CC1)CCN1C1CCCC1)Nc(cc1)cc2c1OCO2,1 S726-0385,COCCC1CC(CC2)(CCN2C(c2cc3cccnc3cc2)=O)OCC1,1 F5939-0252,O=C(c1cc(CCCC2)c2cc1)N(CC1)CCC1Oc1nc(cccc2)c2s1,1 Z27804950,CC(C)c(cc1)ccc1S(N(CC1)CCC1C(Nc(cc1)ccc1F)=O)(=O)=O,0 F6560-3165,COc(ccc(C(NCc1cn(-c2cccs2)nn1)=O)c1)c1F,0 V014-9667,Cc(cc1)ccc1NC(N(CCC1)CC1OCc1c(C)cccc1)=O,0 Z1239579947,CCc(ncnc1)c1C(NC(CC1)CN(C)C1=O)=O,1 Z1601815117,CC(C1)OCCC1C(N1C(Cc2ccccc2)CCCC1)=O,1 F6539-2669,CN(C)C(N1CCC(CNC(c(cc2)ccc2C(OC)=O)=O)CC1)=O,0 F6186-1352,CC(CCSC)(CNC(C(NCCc1ccccc1)=O)=O)O,0 F6619-3889,CC(C)c1c(CN(CC2)CCN2c2nc(N3CCCC3)cc(C)n2)nco1,1 F6521-7457,Cn(cc1)c2c1cc(C(CNS(C)(=O)=O)O)cc2,0 F6677-2619,Cc1cn(CC(C2)CN2c2nc(C3CC3)ns2)nc1,1 E958-0380,O=C(C(CCC1)CN1c1nnc(-n2cccc2)s1)N1CCCCCC1,1 F6743-7970,CC(C)(C)C(N(C)C(CCC1)CN1c(cc1)ncc1C#N)=O,0 SB54-0700,COC[C@@H](CN(C1)C(Cc(cccc2)c2F)=O)[C@H]1c1nnc(-c2ccccc2)o1,0 F5002-0241,Cc1noc(C(Nc2cc(-c3nc(cccc4)c4o3)ccc2)=O)c1,1 D473-1134,CCN(C(CC1)CS1(=O)=O)C(c(cc1)ccc1N(C(C(C)(C)C1)=O)S1(=O)=O)=O,0 Z1270330630,CCc1nn(C)c(C(NCc2nc(C)c(C(O)=O)s2)=O)c1,0 Z2798388094,CC(c1cccc(OC(F)F)c1)NC(N(CCC1)C[C@@H]1C(O)=O)=O,0 E596-0949,CC(C)CCN(c1nnc(CCCC(NC(C)CCc2ccccc2)=O)n1-c1c2scc1)C2=O,1 D398-0618,Cc1cc(C(F)(F)F)nn1CC(N(CCC1)C1c1ccco1)=O,1 Z2966751649,C[C@@H](C(NCCC1)=O)N1C(c1c(C)n(-c2ccc(C)cc2)nn1)=O,1 F6675-6489,CN(C(C1)CN1c1ncccc1)c1nccc(OC)n1,0 Z3367764398,CC(C)CC1(COC1)c1nc(-c(n(cccc2)c2n2)c2Cl)no1,1 Z1249432460,CC(C)C(C)CNC(N(CCC1)CC1C(NC)=O)=O,0 F6709-6851,CN(C(C=C1)=O)N=C1C(N(CC1)CC1Oc1c2ncn(CC(F)F)c2ncn1)=O,1 F1143-4680,CN1CCN(CCC(Nc(cc2)cc3c2OCCO3)=O)CC1,1 D399-1517,Cc1cc(C)c(CN(CCC2)C2c(cc2)ccc2OC)cc1,0 G732-0129,CCN(CC)S(c(cc1)cc2c1n(C)c(C(NCC1OCCC1)=O)c2)(=O)=O,0 K906-4959,O=C(C=C1)NN=C1c(s1)ccc1S(N(CC1)CC1c1ccccc1)(=O)=O,1 F6573-5193,O=C(c(s1)ccc1Cl)NCc1cnc(C2CC2)cc1,1 F6441-6726,COc(cc1)ccc1S(C(CC1)CCN1C(Nc(cc1)ccc1F)=O)(=O)=O,0 F6619-5871,O=C(c1c2cccc1)N(CCN(CC1)CCN1c1nccc(C(F)(F)F)n1)C2=O,1 F6439-4723,CCSc(cccc1)c1C(NCCn1nc(C(F)(F)F)cc1)=O,0 Z1215515116,O=C(NCc1cc(-c2nnc[nH]2)ccc1)NC1CCN(CC2OCCC2)CC1,1 F6441-6400,CN(C=CC=C1C(N(CC2)CCC2S(c(cc2)ccc2OC)(=O)=O)=O)C1=O,1 F6244-3356,CN(Cc1ccccc1)CC#CCNC(c1ccco1)=O,1 S831-3485,COC[C@@H](CN(Cc(ccc(F)c1)c1F)C1)[C@H]1c1ncccc1,0 Z245658026,Cc(cc1NC(C(C2)c(cccc3)c3NC2=O)=O)nn1-c(cc1)ccc1F,0 S431-0122,O=C(C1CCCC1)N(CC1)CCC1(C1)OCCC1N1CCOCC1,1 F6560-0372,Cc1nc(cc(cc2)NC(N(C(CC3)C4)C3CC4Oc3ncccc3)=O)c2s1,1 Z1667162940,CC(CC1c2cnccc2)CN1C(Cc1c(C)[nH]nc1C)=O,0 SB52-1029,CN(CC1(C2)CCN(Cc(ccnc3)c3F)CC1)C2c1noc(-c2ccccc2)n1,1 F6441-4586,Cc(n(-c1ccccc1)nc1)c1C(N(C(CC1)C2)C1CC2S(C)(=O)=O)=O,1 F398-0373,COc(cc1)cc(S(N(CC2)Cc3c2nc(-c(cc2)cc(OC)c2OC)s3)(=O)=O)c1OC,0 F6184-0723,O=C(Nc1cccs1)N(CC1)CCC1c1cscc1,1 F5882-6445,Cc1nnc(CNC(c2cc(-c(cc3)ccc3F)c[nH]2)=O)o1,1 Z1863704198,CN(Cc1ccc(C(F)(F)F)cc1)C(c(cn1)ncc1OCc1ccccc1)=O,0 Z3687016177,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(c1ccc(C2CCOCC2)cc1)=O,1 F6359-1648,N#Cc1cccnc1OC(CC1)CCN1C(CN(C=Nc1c2cccc1)C2=O)=O,1 F2879-3709,O=C(C(NC(c1ccccc1)c1ccccc1)=O)NCc(cc1)cc2c1OCO2,1 Z1771589198,Cn1nc(C(F)F)c(C(NCCc2nnc(-c3ccccc3)n2C)=O)c1,0 F6526-1182,O=C(c1ccco1)N(CCn(cc1)nc1-c1ccncc1)C1CCCC1,1 F6221-0137,Cc1nccn1-c(nc1)ncc1NC(c1cccs1)=O,1 K221-2909,O=C(CCCCN(C(c(cccc1)c1N1)=O)C1=O)NC1CCCCC1,0 Z807449260,COc1ncc(CNC(N(CC2OCCC2)Cc2ccccc2)=O)cc1,1 Z3409610309,CC(C1)Oc(cc2)c1cc2S(N1CC(Cc2nnn[nH]2)CC1)(=O)=O,1 S646-0749,O=C(Cc1cnccc1)N(CC1)CCC1N(CC12CCCCC2)C1c1ccncc1,1 Z2272835244,CC(C)c1nnc(NCc2cc(N3CCCC3)nc(C)c2)o1,0 E667-1068,CC(CC(Nc1cc(OC)cc(OC)c1)=O)S(c(cc1)cc(N2)c1OCC2=O)(=O)=O,0 SB25-0879,Cc1nccn1CCNC(C(CC1)CCC(N=C(c(cc2)ccc2F)N2)=C1C2=O)=O,0 Z3856686285,C[C@H](CN(C1CC1)C(Cc1c(cccc2)n2nc1)=O)O,0 Z1579199667,CC1Oc(cccc2)c2N(CC(NCC(CC2)CCN2c2ccncc2)=O)C1=O,1 Z2779624748,COc1cc(OCC(C2)C(N(CCC3)CC3c3cnccc3)=O)c2cc1,1 Y040-5644,CC(Cc1c[nH]c2c1cccc2)NC(CC1=C(C)c(c(O)cc(C)c2)c2OC1=O)=O,0 J005-0577,Cc1noc(C)c1C(CCC1)N1S(c(cc1)cc(Cl)c1F)(=O)=O,0 Z1725372538,COCC(CCC1)CN1C(Nc1c2cn[nH]1)=NC2=O,1 F0556-0596,Cc1cccc(CN(CCc2c3cccc2OCC(NC2CCCCC2)=O)C3=O)c1,1 F3019-0030,CCc(cc1)ccc1N(C(CC1NC2(CC(C3)C4)CC4CC3C2)=O)C1=O,1 F0344-1359,COc(cccc1)c1OCC(Nc1ncc(Cc2cc(C(F)(F)F)ccc2)s1)=O,0 Z3687139648,Cc(cc1)c(C(N(C[C@@H]2CC(NC)=O)C[C@@H]2O)=O)c(OC)c1Br,0 F5074-0379,Cc1cc(CC(Nc2nnc(-c3ccnn3C)o2)=O)c(C)cc1,1 J092-0145,CCCc(cc1)ccc1C(CC(c(cc(C)cc1)c1N1)(C1=O)O)=O,0 Z2443827080,CC(C)n1ncc(S(NC(c2c(CC(C)CC3)n3nc2)=O)(=O)=O)c1,1 F6452-1476,CC(CNC(C(Nc(cccc1)c1SC)=O)=O)(c1cccc(Cl)c1)OC,0 Z2040354542,O[C@H](C[C@@H]1C(O)=O)CN1C(OC1CCCC1)=O,1 Z3071539513,CC(C)(C1)[C@H]1C(Nc(cc(cc1)S(N)(=O)=O)c1NC)=O,0 3448-6068,COc(cc1)ccc1N(CC(C1)C(Nc(cc2)cc(Cl)c2Br)=O)C1=O,0 S759-0499,CC(C)N(C[C@H]1Oc2ccccc2)[C@@H]1C(CC1)CCN1S(C)(=O)=O,0 S988-1257,Cc(occ1)c1C(N(C[C@@H]1CN(C2)C3CCOCC3)C[C@@]12c1nc(C)no1)=O,1 F6240-4997,O=S(c(cc1)cc2c1OCCO2)(NC1(CCCCC1)c1nc(-c2ccncc2)no1)=O,1 F6685-3810,COc(cc1)ncc1C(NC(C1)CN1c1c2sccc2ncn1)=O,1 SA95-0176,Cc1cnc(C2N(Cc(cc3)cc4c3OCCO4)CCC2)n1Cc(cc1)ccc1OC,1 F6279-0539,CSc1c(CN2CCC(CNC(c3noc(C4CC4)c3)=O)CC2)cccc1,1 F6438-3835,Cc(cccc1)c1NC(NCc1nc(N2CCOCC2)nc(N2CCCC2)n1)=O,1 F6783-6450,CC(N=CN1CC(N(C2)CC(C3)C2CN3c2nc(cccc3)c3n2C)=O)=CC1=O,1 Z1983380022,Cn1c(N2CCN(Cc3cscn3)CC2)nc2c1cccc2F,1 D470-0048,Cc(ccc(N(C(CC1)=O)S1(=O)=O)c1)c1S(NCCc1c[nH]c2c1cccc2)(=O)=O,0 F6514-2718,O=C(c(s1)ccc1Cl)N(C1)CC1OCC(F)(F)F,0 Z1900880366,CN(CC(C(NOCc1ccccc1)=O)c1c2cccc1)C2=O,1 F6571-0230,CCN(CCN(C(NCC(c1csc2c1cccc2)N(C)C)=O)C1=O)C1=O,1 F5791-0274,O=C(c1cc2nsnc2cc1)NC(CCC1)c2c1cccc2,1 F6791-6615,Cc1cc(C)nn1-c1ncnc(NCCCn2cncc2)c1,1 P936-3578,O=S(c1cc(CCC2)c2cc1)(N1CC(Cc2nncn2Cc2ccccc2)CC1)=O,1 Z364987276,COc(cccc1)c1C(N(CC1)CCN1C(Cn1nnnc1)=O)=O,0 F0863-0228,Cc(c(cccc1)c1n12)cc2nnc1SCc(cccc1)c1F,1 Z4607579059,CN(C)CC1(CC1)C(N[C@@H]1CN(Cc2nccn2C(F)F)CC1)=O,1 F6448-1340,O=C(c1cn(cccc2)c2c1)Nc1cn(CC2CCOCC2)nc1,1 Z1444142234,CC(C)C(C)(CNC(c(cc1)ccc1C(O)=O)=O)O,0 Z2798405270,OC([C@H](C1)C[C@H]1NC(NCc1cccc(CN(CCC2)C2=O)c1)=O)=O,1 E207-1485F,Cn1nc(C(N(CC2)c3c2cccc3)=O)c(C2)c1-c(cccc1)c1S2(=O)=O,1 F6542-0418,CC(C)(C)NC(N(CC1)CC1c1cscc1)=O,0 S614-0941,N#Cc1cccc(CN(CCCC2)C2c2nc(CCOCC3CCCC3)no2)c1,0 Z2304046102,CCO[C@H](C1)C[C@H]1NC(c1c(CCC2)n2nc1)=O,1 SA52-0121,CC(C)CN(CCCN(C1)C(c2c(C)oc(C)c2)=O)C1c1nc(C)no1,0 Z929384576,CC(CC1)Cc2c1c(C(Nc1c(C)ccc(C(N)=O)c1)=O)cs2,0 Z1544036355,OC(CNC(Cc(cc1)cc(F)c1F)=O)c(cc1)cc(F)c1Cl,0 F3165-0318,COc(cc1)cc(NC(CN(CCCN2Cc(cc3)ccc3Cl)S2(=O)=O)=O)c1OC,0 F6174-1413,COc(cc1)ccc1-c1cc(N(CCC2)CC2C(NCc2cccs2)=O)ncn1,1 F6713-0391,CC(C)(C)c(cc1)nnc1OCC(CC1)CCN1S(c(cccc1)c1OC)(=O)=O,0 F0676-0604,COc(cc1)ccc1-c1nnc(cc2)n1nc2SCC(N(CC1)CCN1c1ccccc1)=O,1 6540-0363,Cc1ccc(C(CC(c(cccc2)c2N2Cc(cc3)ccc3Cl)(C2=O)O)=O)o1,1 Z3345262613,CC(C=CC1=NC(CN(CC2)CCC2C(c2ccccc2)C#N)=C2)=CN1C2=O,0 F5832-5698,CN(C)C(CNC(NCc1cccs1)=O)c(cccc1)c1Cl,0 F3375-1293,Cn1c(-c(cc(C(F)(F)F)cc2)c2Cl)ccc1C(N1CCOCC1)=O,1 V021-8569,COc(ccc(N(C1CCN(Cc(cccc2)c2F)CC1)S(c(cc1)ccc1F)(=O)=O)c1)c1OC,0 Z819258578,OC(C(CC1)CCN1S(NCCc1cscc1)(=O)=O)=O,0 F6515-1128,CSc1ncccc1C(NCc1cc(-c2ccco2)ncc1)=O,0 F6560-0834,O=C(CNC(OCc1ccccc1)=O)NC(C1CCOCC1)c1cccs1,1 Z2119247665,CC(C(CCC1)CN1C1CCC1)NC(N(CCCC1)C1c1nc(C)no1)=O,1 Z1866659928,COCC(C(N)=O)NC(c1cc(scc2)c2[nH]1)=O,0 F6238-0472,Cc1nccn1-c(cc1)nnc1C(N(CCC1)c2c1cc(C)cc2)=O,1 F6573-6208,N#Cc1cccc(C(N(CC2)CCC2(C2)C2(F)F)=O)c1,0 Z2879607750,O=C1NC(C(F)(F)F)=CC=C1c1noc(C2(CCC2)C2CCC2)n1,1 Z2842948299,CCc(n(C)nc1)c1C(N(C)Cc1noc(O)n1)=O,0 Z4436962850,Cn1nnnc1CN(Cc1c(C2)ccc(Br)c1)C2C(OC)=O,1 Z4409859013,CN(Cc1cc(N2CCCC2)ccc1)C(c1c(ccn2C)c2ccc1)=O,1 Z1870104750,OC(CCC(CCC1)CN1C(c(cc1)cc(F)c1Cl)=O)=O,0 T842-2016,CC(C)Cn1c(cncc2)c2nc1C(CC1)CN1S(c(cc1)cc2c1OCCO2)(=O)=O,1 Z1616011770,CCC(C)n(c(C)c1)nc1C(N(CC1)CCC1N(c(cccc1)c1N1)C1=O)=O,1 Z2033154196,CN(Cc(cc1)ccc1S(C)(=O)=O)C(C(CC1)(Cc2c1cccc2)O)=O,0 D389-0376,CC(Cn1c2nc(N(C)C(N3C)=O)c1C3=O)CN2c1ccc(C)cc1,0 F3225-1608,CC(C)(C)OC(c1c(N)n(Cc2ccco2)c2nc3ccccc3nc12)=O,1 Z3535455416,C[C@@H](CN(CCC(N1CCC#CC)=O)C1=O)OC,1 F6549-3722,CCCc1c(C(N(CCCC2)C2c2ccnn2C)=O)snn1,1 F6556-7440,CC(Cc1cc(cccc2)c2o1)NC(c1ccco1)=O,0 S579-0265,CN(C(CCCC1)C1=C1CC(NCCCN(CCC2)c3c2cccc3)=O)C1=O,1 Z2998554221,CCN(C(c1cc(C2CC2)nn1C)=O)c1c(C)nccc1,1 F6512-0711,O=C(c(o1)ccc1Br)Nc1cc2ccnn2cc1,1 SC89-1027,CN1CCN(CC(CC2)C(C3)(CN3C(c(cc(cc3)Cl)c3OC)=O)S2(=O)=O)CC1,0 F6507-5291,CC(CNC(CSc(cc1)ccc1F)=O)(COC)OC,0 F6562-0116,Cn(c(C(NCc1cn(-c2cscc2)nn1)=O)c1)nc1-c(cc1)ccc1F,1 F6218-0083,O=C(c1ncccc1)Nc1cnc(-n2nccc2)nc1,1 F6360-9313,O=C(COc(cccc1)c1F)N(C1)CC1Oc1cnccc1,0 Z3026525564,NC(CN(C1)C(c2nc3ccccc3cc2)=O)C11CCOCC1,1 F6516-0361,O=S(CCC(F)(F)F)(NCc1ccc(-c2cccs2)o1)=O,0 Z1609502852,Cc1cc(C(NCC2COCCC2)=O)cc(O)n1,1 F6125-3666,O=C(C(C1)CN1C(c1nccnc1)=O)N1c2nc(cccc3)c3n2CC1,1 F6494-4799,Cc1cc(N(CC2)CCN2C(C(c2ccccc2)=NN2)=CC2=O)nc(C2CC2)n1,1 F1915-2664,FC(c(ccc(-c1ncccc1)c1)c1F)(F)F,0 F6481-3738,O=C(c1cocc1)N(CC1)CCSC1c1ccco1,1 Z1479198649,CCC(N(CC1)CC1C(N1CC(c2cccc(F)c2)OCC1)=O)=O,1 Z1029634648,CC(CC(NC1(CCCCC1)c1noc(C)n1)=O)c(cccc1)c1F,0 G856-6566,O=C(CSc1nnc(cc2)n1nc2-c1cccs1)NCC1OCCC1,1 F6445-3152,Cc1nn(cc(CCCNC(c(o2)ccc2Br)=O)cn2)c2c1,1 Z3071567865,CC(C)CN(C1CC1)S(CCOC1(CCOCC1)C#N)(=O)=O,1 F6562-4273,CN(C)c1nc(CCC(C2)NC(CN(C=Nc3c4cccc3)C4=O)=O)c2cn1,1 Z2619376833,CC1Oc(ccc(NC(c2c(C)n(C3CCOCC3)c(C)c2)=O)c2)c2NC1=O,1 F6540-0667,Cc1noc(C)c1CN(C(CC1)C2)C1CC2OC,1 Z2897965166,OC(COc(cc1)ccc1C(N1CCC(CCF)CC1)=O)=O,0 Z1143010551,CC(C)(CN(CC1)CCN1C(c1cc(F)cc2nccnc12)=O)O,1 Z1952848689,CCc(c1c2)noc1ncc2C(N(CC1)CCN1c1nccc(C(F)(F)F)c1)=O,0 SB75-0263,Cc1noc([C@@](C[C@@H](C2)NS(N(C)C)(=O)=O)(C3)[C@@H]2CN3S(C)(=O)=O)n1,0 J029-0288,O=C(C1(CCCC1)c1ccccc1)Nc(cc(cc1)-c2nc(nccc3)c3o2)c1Cl,0 F6424-0220,Cn(c(C(Nc(cccc1)c1C(C=C1)=NNC1=O)=O)c1)nc1-c1ccccc1,1 SB04-0361,CN(C)S(N(C)CCN(C(CC1)CN1C(C1CC1)=O)C1CCOCC1)(=O)=O,1 Z1103014357,Cc(cc(CN(C)c(ccc(S(N)(=O)=O)c1)c1C(OC)=O)cc1)c1OC,0 F6439-4319,O=C(c1nc(cccc2)c2s1)NCCn(cc1)nc1-c1ncccc1,1 E984-0445,CCC(C(NCCCN1CCN(CC)CC1)=O)N(c1cc(C)nn1CC1)C1=O,1 F6178-2294,O=S(c1cccc2ccccc12)(NCC(CC1)CCN1c1nccnc1)=O,1 Z2693536990,CC(Cc1cn(-c2cc(F)c(C)cc2)nn1)O,0 Z2638457164,Cn1ncc(-c2n[nH]cc2C(N(CCC2)CCC2N2CCOCC2)=O)c1,1 F3382-1750,CC(C)N(C1=O)C(SCC(Nc(cc(cc2)Cl)c2OC)=O)=Nc2c1[nH]cc2-c1ccccc1,1 J106-0678,O=C(C(CC1=O)CN1c1n[nH]c2c1ccc(Br)c2)NC1CC1,1 F6277-0018,O=C(Cn1c(cccc2)c2nc1)N(CC1)CCN1c1nc(c(C(F)(F)F)ccc2)c2s1,1 F2713-0117,Cc1ccc(CC2=NN=C(Nc3cc(C)c(C)cc3)NC2=O)cc1,0 Y502-8508,CCc1ccc(-c(cc(C(F)(F)F)n2nc3)nc2c3C(NC(C)C2C(CC3)CC3C2)=O)s1,1 SA50-0006,Cc1nc(S(N(C2)Cc3c2c(-c2nc(C)no2)nn3C)(=O)=O)cn1C,1 F6522-0072,CCC(C(NCc1cc(-c2ccco2)cs1)=O)c1ccccc1,1 8013-2772,CN(C(c1nn2c(C(F)(F)Cl)cc(-c3cccs3)nc2c1)=O)c(cc1)ccc1OC(F)(F)F,0 D574-0226,Cc1cc(N(CC2)CCN2C(Nc(cc2)cc3c2OCCO3)=O)nc(N2CCOCC2)n1,1 Z2936883544,CC(C)(C)Cc1nc(-c2cc(C)c(CS(N)(=O)=O)c(C)c2)no1,0 F6230-0303,O=C(NCCc1ccccc1)NCc1c(cccc2)n2nc1,1 F6473-2068,O=C(C1Oc(cccc2)c2OC1)N(C1)CC1n1nncc1,1 Z1618026186,Oc(ccc(C(C1)CNC1=O)c1)c1F,1 SD07-0449,O=C(C1CCOCC1)NCc1c(COC(CC2)(CN2C(c2ccccc2)=O)C2)n2nn1,0 SD07-0645,CCN(CC)C(NCc1c(COC(CC2)(CN2C(c2c(C)ccs2)=O)C2)n2nn1)=O,0 Y030-9098,CCCC(Nc(cc1)ccc1C(N1CCC(C)CC1)=O)=O,0 F782-0789,CCC(Nc1nc(cc(cc2)NC(CC(C)C)=O)c2s1)=O,0 Z2109685649,Cc1nsc(NC(N2C(CC3)CCC3C2)=O)c1Cl,1 Z1612314368,CC1(CCOCC1)NC(Nc1cc(OCC(F)(F)F)ncc1)=O,0 C130-0505,FC(c1cc(-c2cccs2)nc(N(CC2)Cc3c2cccc3)n1)(F)F,1 F3358-0296,NC(CSc1nc2ccccc2c2ccccc12)=O,1 Z2181168268,CC(C)(C1)C(C2OCCC2)N1C(C(C1)c(ccc(F)c2)c2NC1=O)=O,1 D505-0590,CCc(ccc(C(C1=C2CCCC1)=NN(C)C2=O)c1)c1S(N(CC1)Cc2c1cccc2)(=O)=O,0 F6439-5254,Cc(c(S(NCCn(cc1)nc1-c1cccs1)(=O)=O)ccc1)c1Cl,0 Z1176631233,CNC(C1CN(Cc2nc(-c(cc3)ccc3F)no2)CCC1)=O,0 F0328-0372,O=C(c1cc(F)ccc1)Nc1nc(-c(s2)ccc2Br)cs1,0 S787-0773,CN(C)C(CCc1ccc(CC2CCN(Cc(cc3)cc4c3OCC4)CC2)cc1)=O,1 Z2275459777,CC(CCC1)CN1S(Nc1ccc(C(CC(N2)=O)CC2=O)cc1)(=O)=O,0 F2392-1023,CN(C)C(CNC(C(NC1CC1)=O)=O)c1cscc1,0 Z3091770307,CC(C)([C@@H](CCC1)N[C@@H]1C(F)(F)F)c1nc(-c2ncncc2)no1,1 F6561-5582,O=C(Nc1cccs1)N(CC1)CCC1S(Cc1ccccc1)(=O)=O,1 Z1890977858,Cc1c(Cc2noc(-c(cc3)ccc3S(C)(=O)=O)n2)ccc(F)c1,0 P315-0018,Cc1cc(NC(NC(CCN2c3ccccc3)C2=O)=O)c(C)cc1,0 F325-1292,O=C(CCC(N1CCOCC1)=O)N(CC1)c(cc2)c1cc2S(NCC1OCCC1)(=O)=O,1 Z1667623066,CC(C1(CC2)CCOCC1)N2C(C(CC1)CCN1S(N)(=O)=O)=O,1 Y501-2458,CC(c1ccncc1)NC(c1cc(-c2cccs2)nc2c1c(-c1ccccc1)no2)=O,1 F6125-2657,CS(N(C1)CC1C(NCCCN(CCC1)C1=O)=O)(=O)=O,1 Z1552309856,O=C(NCc(c(OC(F)F)ccc1)c1F)N1CC2(CCC2)OCC1,1 V024-2377,CC(C)CNC(c1ccc(CN2c(cccc3)c3OCC2=O)o1)=O,0 F6792-3697,CCc1cc(OCC(CC2)CCN2c2nc(C)nc3cnccc23)nnc1C,1 F6792-1943,Cn1c(ncnc2N(CC3)CCN3c3c4sccc4ncn3)c2nc1,1 S858-1257,Cc1c(CN2C[C@](CO)(CN(C3)C(C4CC4)=O)[C@H]3CC2)cnn1C,0 F6564-4640,Cc1nc2ccccc2c(NC(C(CC2)CCN2c2nnc(C3CC3)cc2)=O)c1,1 F6436-0702,Cc(onc1)c1C(Nc(cc1)cc2c1OCCC(CCCC1)N1C2=O)=O,1 Z4870864983,C[C@@H](CC[C@@H](C1)NC(c2c(CCOC3)c3co2)=O)N1C(c1c[nH]nn1)=O,1 F3407-4210,CCOC(CC1=CC(SCC(Nc(ccc(Cl)c2)c2F)=O)=Nc(cccc2)c2N1)=O,0 D466-0422,COCCCN1Cc2nc(cc(cc3)NC(C4CCCCC4)=O)c3n2CC1,1 F6439-3668,CCCCS(NCCn1nc(C(F)(F)F)cc1C1CC1)(=O)=O,0 F6473-2499,O=C(CC1)N(CCc2c3)c2c1cc3S(N(C1)CC1n1nncc1)(=O)=O,1 Z1161797587,OC(CC(C1)C2)(CC1C1)CC12C(N(CC1)CCN1S(c(cc1)cc(N2)c1OCC2=O)(=O)=O)=O,1 F6125-3663,O=C(C(C1)CN1C(c1nccnc1)=O)NCCOc(cc1)ccc1F,1 S953-5567,CN(C)C(C(CC(C1)(CC2)CCN2S(N(C)C)(=O)=O)N1c(cc1)cc(C(F)(F)F)c1C#N)=O,0 Z1006422408,O=C(c1c(cc(cc2)Br)c2nc(-c2ccncc2)c1)NCC1OCC(CCC2)N2C1,1 E641-3285,CC1CCN(CCCN(C(CC2)CCN2C(C)=O)C(Nc(ccc(C)c2)c2Cl)=O)CC1,0 F3316-0340,Cc1cc(C)nn1CC(COc(cc1)cc(OC=C2Oc3cc(C)cc(C)c3)c1C2=O)O,1 D345-0560,CC(CC1)Cc2c1nc(NC(c1c(C)c(cc(cc3)Br)c3o1)=O)s2,1 F6414-2173,CC(C)(C(NCC(c(cc1)ccc1SC)O)=O)Oc(cc1)ccc1Cl,0 Z1591001882,Cn1ncc(C(N(CCC2)CC2C(N)=O)=O)c1-c1ccccc1,1 G857-1906,COc1cccc(C(c(sc2nc(-c3ccco3)nn22)c2O)N(CC2)CCC2O)c1,1 F6724-1368,OC(CNc1nc(cccc2)c2o1)C1CCCCC1,1 F3371-0830,CCOC(C(C(CC(c(ccc(OC)c1)c1OC)=C1)c2ccco2)C1=O)=O,1 SA73-0187,Fc1c(CN(CC2)CCC2(CC2CC2)c2noc(-c3cnccc3)n2)ccnc1,1 Z1805647431,O=C(C1)NCC11CN(CC2OC3(CCCC3)CC2)CCC1,1 F3379-0368,Cc1nccn1-c1ncnc2c1cnn2-c1ccccc1,1 F6258-1223,O=C(c1cc(-c2ccccc2)n[nH]1)NCCN(C=NC(C1CC1)=C1)C1=O,1 Z1643230111,Cc1cc(OC(CC2)CCN2C(CCC(N2)=Nc(cccc3)c3C2=O)=O)ncc1,1 Z27805332,CCOc(cc1)ccc1S(N(CC1)CCC1C(Nc(cc1)ccc1F)=O)(=O)=O,0 S823-3270,Cc1nn(C)c(CN(C[C@@H]2CO)C[C@@H]2NC(C2CCC2)=O)c1,1 Z2870734416,CC(N1)=Nc(cc(cc2)C(N(CC(F)F)CC3CCC3)=O)c2C1=O,1 F6519-7407,Cc1cc(C)nn1C(CNC(c(cc1)ccc1S(N(C)C)(=O)=O)=O)c1cscc1,0 Z5064114048,CC(C)c(cc1)cnc1C(N(CCc1ccc2)Cc1c2SC)=O,0 S699-0905,CN(CCc1noc(C(C2)CN2C(c2cscc2)=O)n1)C(C1CCOCC1)=O,1 Z2178307764,Cc(cc(c(C(Nc1nn(C)c(C2CC2)c1)=O)c1)OC)c1Br,0 F6507-5883,Cn1c(C(CCNC(c2noc(C3CC3)c2)=O)O)ccc1,1 F6418-0715,OC(c1ccco1)c1ccc(CNC(c(cc2)ccc2OC(F)(F)F)=O)s1,0 Z1321364578,Cc(cn1)cc(NC(N(CC2)CCN2c2ncccn2)=O)c1OC,1 E959-1858,CC1CN(CCCNS(c2ccc(C(C=C3)=NNC3=O)o2)(=O)=O)CCC1,1 F6680-0884,Cc1nnc(N(C2)CC2NC(c(ccc(OC)c2)c2OC)=O)s1,0 F6523-4342,CN1N=C(CCC(C2)NC(c3n[nH]c4c3CCCC4)=O)C2=CC1=O,1 F6546-0812,Cc1c(C)ncnc1N1CC(CN(C2)C3CC3)C2C1,1 8016-4618,COc(cc1)ccc1N(C(CC1N(CC2)CCC2(C(NC2)=O)N2c2ccccc2)=O)C1=O,1 Z2910527469,CC(C)c1nc(C(Nc2cc(C(O)=O)cc(Cl)c2)=O)c(C)o1,0 SA70-1184,Cc1c(C(N(CCC2)CC2(CCOC)c2noc(C3CCOCC3)n2)=O)sc(C)n1,1 Z2851574257,O=S(C1CCC1)(NCc1ccc(-c2ccccc2)s1)=O,1 SC91-0416,COc1cccc([C@@](C[C@H]2CC3)(CN2C3=O)C(NCCc2cccs2)=O)c1,0 Z1134727891,CN(C)S(c(cc1)cc(C(N2C(Cc(cc3)ccc3F)CCCC2)=O)c1Cl)(=O)=O,0 V030-9807,CCc1nc2ncnn2c(N(CC2)CCN2c2c(C(F)(F)F)cccc2)c1,0 F2245-0596,O=C(Cc1cccs1)N(Cc1ccco1)c1nc(cccc2)c2s1,1 Z1736608655,Cc(ccc(C#N)c1)c1NC(N1CC(CN2CCOCC2)CC1)=O,0 Z4416749065,CC(C)(C)CC(CNC(c1cc(F)cnc1)=O)c1cn(-c2cncc(C(O)=O)c2)nn1,0 Z2636024324,CC(C(N1CCC(Cc2cc(OC)ccc2)CC1)=O)n1c2ncnc(N)c2nc1,1 Z1035004022,CNc(cc1)ncc1NC(Nc1cccc(F)c1)=O,0 Z972937626,CN(C(C1CCN(Cc(cccc2)c2F)CC1)=O)c1ccccc1,0 Z2982565515,OC(CCNS(c(occ1)c1Br)(=O)=O)=O,0 S421-1224,O=C(CC(CC1)CN1C(CC1CCCC1)=O)NCc1ccncc1,1 D047-0199,CCOc(cc1)ccc1NC(N(CC1)CCN1C(c(cc1)ccc1F)c(cc1)ccc1F)=O,0 Z407380958,O=C(Cn1nnc2c1cccc2)NCc1cc(Oc2ccccc2)ccc1,1 Z3173673467,CCC(CCC1)c2c1sc(NC(Cn(cc1)nc1C(O)=O)=O)n2,0 F1757-0222,O=C(CN(CC1)CCN1S(c1ccccc1)(=O)=O)Nc(cc1)ccc1Br,0 Z1255795152,Cc1ccc(cccc2C(Nc(cc3)cc(F)c3-n3cncc3)=O)c2n1,0 Z1347889377,Cc([nH]cc1)c1C(NC1CCN(Cc2c(C)cccc2)CC1)=O,1 Z2362306108,CCc(n(CCC(C)C)nc1)c1NC(N1CC(C(O)=O)OCC1)=O,0 Z1528965188,C(CC1c2nc(-c3ccccc3)n[nH]2)CN1c1c2sccc2ncn1,1 F6230-0048,O=C(CCN(C=Nc1c2cccc1)C2=O)NCc1c(cccc2)n2nc1,1 Z3772558436,COc(cc1)cc2c1c(NC(CCCOc(cc1)cc(F)c1F)=O)n[nH]2,0 C216-0043,COc(c(OC)c1)cc(C(C2)c(cc3)ccc3SC)c1NC2=O,0 S836-2401,CNC([C@@H](C1)[C@@H](COC)CN1S(c(cc(cc1)F)c1F)(=O)=O)=O,0 Y041-4374,O=C(Cn(cc1)c2c1ccc(Br)c2)N(CC1)CCN1C(CC1)CS1(=O)=O,0 F6541-3619,O=C(c(cc1)cc2c1[nH]cc2)NCc1cnccc1,1 F6520-0574,O=C(c(cccc1)c1Cl)NCCc1ccc(-c2ccco2)s1,0 SB04-0518,CN(C)C(N(CC1)CC1N(CCNC(c1nccnc1)=O)C1CCOCC1)=O,0 Z1725473905,Cc1cccc(F)c1S(NCC(C(F)(F)F)(c1ccccc1)O)(=O)=O,0 Z1411900918,O=C(CN(C1)C(CCCC2)C2NC1=O)NC(NCc1ccco1)=O,1 F2199-0557,Cc(cc1N)nn1-c1ncnc2c1cnn2-c1c(C)cc(C)cc1,0 Z2597403628,CC1(C)OC(COc2ccccc2)CN(Cc2c(C(O)=O)scc2)C1,0 SD02-0407,CC(C)c1nnc(C(C2)N(CC(NC3CC3)=O)CC2(CC2)CCN2C(c2c(C)oc(C)c2)=O)o1,1 G229-0346,Cc(cc1)cc(C)c1N(CC(C1)c2nc(-c(cc3)ccc3Br)no2)C1=O,0 Z2041380809,CC(C)(c1nc(-c(cc2)ccc2S(C)(=O)=O)no1)S(C1CC1)(=O)=O,0 Z2110990225,CC(Cc1c(C)cccc1)NC(c(cc1)cc2c1OCCN2C)=O,1 Z1376327581,COc1cc(C(NCCc2csc(-c3ccccc3)n2)=O)cc(OC)c1,0 8017-2885,O=C(C1N2CCC1)Nc(ccc(Br)c1)c1C2=O,1 T629-2306,Cc1cc(C)nn1CCC(N(CCC1)CC1c1nnc(C2CC2)[nH]1)=O,1 F6415-0861,CN(C)c1cccc(C(N(Cc2cocc2)Cc2cccs2)=O)c1,0 Z4052028427,Cc(cccc1)c1C(NC[C@](CCC1)(C2)[C@H]1CN2c1nn2nnnc2cc1)=O,1 Z3378824694,Cc1cn(C)nc1C(NCCn1nnc(-c2ccccc2)c1)=O,0 Z129748754,Cc1cnc(C)c(N(CC2)CCC2N(c(cccc2)c2N2)C2=O)n1,1 F3176-0116,CN(c1c(C(N2C)=O)[nH]c(Nc(cc3)ccc3OC)n1)C2=O,0 Z2878578169,OC(C1CCOCC1)c1nc(-c2n[nH]c3c2cccc3)no1,0 S635-0085,OCC(CN(C1)C(COc(cc2)ccc2F)=O)C11CCNCC1,1 Z527038800,Cc(ccc(CNC(C(CC1)CCN1C(NCC(CCC1)c2c1cccc2)=O)=O)c1)c1F,1 Y032-4348,O=S(c(cc1)ccc1OC(F)(F)F)(NCC1OCCC1)=O,0 Z2950055600,O=C(c1cc(Br)cnc1C1CC1)NCCn1nccc1,1 F6548-0614,Cc1c(CN(CC2)CCN2C(c(cccc2)c2Cl)=O)nc(-c2ccc(C)cc2)o1,1 M950-0577,Cc1c(-c2nnc(C3CC3)o2)[nH]c(C)c1S(Nc(cc1)ccc1SC)(=O)=O,0 Z1264144685,Cc(cc1NC(c(nc(C)nc2)c2Cl)=O)nn1-c1ccccc1,0 SB32-0704,COC[C@@H](CN(C1)C(CC2CC2)=O)[C@H]1c1nc(C2CC2)n[nH]1,1 Z1900999340,CN(C1CCCCC1)C(N(CC1)CCN1C(c1ccco1)=O)=O,1 F6523-0986,CN1N=C(CCC(C2)C(N(CC3)CCN3C(c3ccco3)=O)=O)C2=CC1=O,1 F6561-5904,Cc1noc(C)c1CCC(NCc1cc(-c2cn(C)nc2)ncc1)=O,1 F6529-2604,CC(C)c1noc(CN(CC2)CCC2N(CC(N2c3ccccc3)=O)C2=O)n1,1 F6806-8310,O=C(C(C1)CN1c(ccnc1)c1Br)N1CCOCC1,0 Z2999709613,CN(C(C1=CC(Br)=CN(C2CC2)C1=O)=O)c1nocc1,1 F6190-2459,COc1cc(NC(NCCC(c2cccc3ccccc23)O)=O)cc(OC)c1,0 Z2471079399,CC(NC(N1)=O)=C(CCC(NCC=C(Cl)Cl)=O)C1=O,0 D400-6716,COc(ccc(S(NC1CCCCC1)(=O)=O)c1)c1-c1noc(C2CCCCC2)n1,1 Z1037582066,Nc(c(S(N(CC1)CC1O)(=O)=O)c1)ncc1Br,0 F6662-5375,Fc(cccc1)c1N(CC1)CCN1c1nccs1,0 S823-1218,Cc1noc(C)c1C(N[C@@H]1[C@@H](CO)CN(Cc2ncccc2)C1)=O,0 F6573-2768,O=C(c(c(F)ccc1)c1F)NCCOCCn1nccc1,0 6466-1025,CCOc(cccc1)c1NC(c1nn([C@H](C[C@@H](c2ccco2)N2)C(F)(F)F)c2c1)=O,0 Z3063544681,CCNC(CCC(N(CC1)C[C@H]1Oc1c(N(C)C)nccc1)=O)=O,0 T408-0357,O=C(C(CC1)Cc2c1sc(C(N1CCOCC1)=O)c2)Nc1cc(CCC2)c2cc1,1 V014-5236,O=C(C1CCCC1)Nc(cc1)cnc1N(CC1)CCN1C(c1cccs1)=O,1 V028-5096,CCNC(N(CC1OCCC1)Cc1noc(-c(cc(cc2)OC)c2OC)c1)=O,0 E646-2928,CC(CN(C1)S(c2ccccc2)(=O)=O)(C(NCc2ccccc2)=O)N(CCc2ccco2)C1=O,1 D294-3693,CCC(Nc1cccc(C(Nc2nnc(C(CC3=O)CN3c3ccc(CC)cc3)s2)=O)c1)=O,0 Y205-3266,Cc1noc(C)c1C(NC(CCC1)c2c1cccc2)=O,1 L090-1963,CN(C=Nc1c2n(-c3ccccc3)nc1C(NCC1OCCC1)=O)C2=O,0 F6696-0112,Cc1nnc(N(CC2)CC2Oc2c(C)cncc2)s1,1 Z1869835362,CC(C1)OCCC1C(Nc1cccc(-n2ncc(C(O)=O)c2C(F)(F)F)c1)=O,1 F6806-6806,N#Cc1ccnc(N2CC(C(N(CC3)CCC3(F)F)=O)OCC2)n1,0 F6222-0392,O=C(c(cccc1)c1Cl)Nc1cnc(N(CC2)CCN2c2ccccc2)nc1,1 Z2229027347,CNc(cccc1)c1C(N(CC1)CCC1c1nncn1C1CC1)=O,0 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S986-0325,CN(C)C[C@](CN(C1)C(c2cccs2)=O)(C2)[C@H]1CN2C(c1ccccc1)=O,1 Z1726974294,O=C(c1cccc(OCC(F)(F)F)c1)NCc1nc(N2CCOCC2)ccc1,0 Z1230381436,CN(c1nnc(CN(CCC2)CC2N2CCCC2)n1-c1c2cccc1)C2=O,1 SB07-0207,CC(CCCC1)(c2noc(C3CC3)n2)N1C(CC1CC1)=O,1 F2197-4627,CCc1cnc(N(C)CC(CC2)CCN2C(OC(C)(C)C)=O)nc1,1 Z1739153720,CC(CC(O)=O)C(CC1)CCN1C(N(C)Cc1ccccc1)=O,0 Z369737824,OC(c1cc(-c(cccc2)c2Cl)no1)=O,0 F6374-1406,Cn1c(SCC(CC2)CCN2C(C(Oc2c3cccc2)=CC3=O)=O)ncc1,1 SA01-0813,Cc1cc(C(N(CC2)CC2c(nc(N(C)C)nc2)c2C(N(C)C)=O)=O)no1,0 G765-0391,COc(cc1)cc(C2)c1OCC2NC(N1CCCCC1)=O,1 Z2295867812,CCCC(C1)C1NC(c(cccc1)c1-c(cccc1)c1C(O)=O)=O,1 Z2440549731,CC(C)C(CCN(C)C(c1csc(-c(cc2)ccc2Cl)n1)=O)N,0 G856-0933,Cc1cc(N(C2=O)C(SCC(N(CC3)c4c3cccc4)=O)=Nc3c2[nH]c2c3cccc2)cc(C)c1,1 SB33-0193,Cc1n[nH]c([C@@H](CN(C2)C(COc(cc3)ccc3F)=O)[C@H]2NC(C2CCCC2)=O)n1,1 P930-5628,O=S(c(cc1)cc2c1OCCO2)(N(CCC1)[C@@H]1c1nnc(-c(cc2)ccc2F)[nH]1)=O,1 Z4922010430,O=C(CC1C2(CC2)CCC1)Nc1cc(C(N(C2)C(CCC(N3)=O)C3=O)=O)c2cc1,1 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Z966378930,COc(cc1)cc(F)c1-c1cc(C(Nc(cc2)ccc2NC(NCc2ccco2)=O)=O)no1,1 Z1313482482,CC(C)(C)C(Cn1nnc(C(Nc(cc2)ccc2C(N2)=NC(C)=CC2=O)=O)c1)=O,1 Z1314145405,CN1CCN(Cc2cccc(C(N(CC3)CCC3C(c(cccc3)c3N3)C3=O)=O)c2)CC1,1 S615-0341,O=S(c1ccccc1)(N(CC1)CC1c1nc(CCOCC2CC2)no1)=O,0 Z2483033473,CC(C)CC1N(Cc(c(C(O)=O)ccc2)c2Cl)CCCC1,0 Z1526895326,CC(C(NC1CC1)=O)N(CC1)CCN1C(C(CC1)CCC1(F)F)=O,1 SC10-1090,O=C(C1CC1)N(CCCN1CCCC1)C(CC1)CN1S(N1CCOCC1)(=O)=O,1 Z3389649023,CC[C@H](CC(O)=O)NC(c1nc(C)c(C)s1)=O,0 F6493-1206,O=C(COc1c(CCCC2)c2ncc1)N(CC1)CCN1c1ncccn1,1 S661-1191,CCN(C(C(C1)N2CC1(CC1)CCN1C(c1c(C)n(CCCOC)c(C)c1)=O)=O)C2=O,0 F6512-1263,Cc1cc(C(NC2Cc3ccnn3CC2)=O)c(C)o1,1 F6560-5342,Cn1ncc(-c2cc(CNC(c3cc([nH]cc4)c4cc3)=O)cnc2)c1,1 F0725-0360,O=C(C1CC1)Nc(cc1)ccc1-c1nc(cccc2)c2[nH]1,1 G414-0680,Cn1ncc2c1nc(N(CC1)CCN1C1CCCCC1)nc2NCc(cc1)ccc1OC,0 Z3104819223,C[C@H](c1cccc2ccccc12)NC(NC(C1)C11CCOCC1)=O,1 Z3084313143,Cc(cncc1)c1N(C)C(c1nn(CCC(F)(F)F)cc1)=O,0 F6192-0638,O=C(C(Oc1c2cccc1)=CC2=O)NCC(c1ccco1)c1cccs1,1 F6559-1641,O=C(c(cc1)cc2c1[nH]cc2)N1CCN(CCF)CC1,0 F0817-0557,Cn(cc1C(Nc(cc2)ccc2-c2nc(cccc3)c3o2)=O)nc1OC,1 S382-1339,CN(C(C1(CN(Cc(cc(cc2)F)c2F)CC1)N1CCOC)=O)C1=O,0 Z2772731681,Cc1cc(CCC2NS(c3c[nH]nc3C(F)(F)F)(=O)=O)c2cc1,0 F5041-0268,O=S(C1CC1)(N(CC1)CCN1c(cc1)nnc1-c1ncccc1)=O,1 F6523-3627,O=C(Cc1noc2c1cccc2)N(CC1)CC2=C1N=C(C=CC=C1)N1C2=O,1 F6806-6868,O=C(C(C1)OCCN1c1ncnc2c1cc[nH]2)NC1CC1,1 F6359-1013,Cc1cc(C(N(CC2)CCC2Oc(nccc2)c2Cl)=O)c(C)o1,1 P314-0782,CC(C)(C)CC(NC(CCN1c(cc2)ccc2F)C1=O)=O,0 S064-0291,CCOc1nccnc1N(CC1)CC1NC(c1cc([nH]cc2)c2cc1)=O,1 Z1102444773,CCc1noc(CN(C)C(c2c[nH]nc2)=O)n1,0 F1709-0009,CCOC(c(cc1)ccc1NC(CC1NCCNC1=O)=O)=O,0 F6678-8898,Cc1ccc(CN(C2)CC2n2c(cccc3)c3nc2C)s1,1 F3406-6412,CCc(cc1)ccc1Oc1cc(N(CC2)CCC2C(NCCc2cccs2)=O)ncn1,1 D753-0204,O=C(COc1cc(-n2cnnc2)ccc1)N[C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1,1 SC11-0433,O=C(C1CC1)N(CCCN1CCOCC1)C(CCC1)CN1C(C1CCC1)=O,1 Z2989397653,CC(CN(CC1)c(nc(C(F)(F)F)cc2)c2C(C)=O)C1C(O)=O,0 F6752-7861,CC(C)(C)c(cc1)nnc1N(C1)CC1C(N1CCOCC1)=O,1 G802-0494,CCC(C(Nc1cc(OC)cc(OC)c1)=O)Sc1nnc2n1C=CN(c(cc1)ccc1F)C2=O,0 F6452-0463,CC(CNC(C(Nc1cc(N(CCCC2)C2=O)ccc1)=O)=O)(c(cccc1)c1F)OC,0 F6247-1846,CCn1ncc(CN(C)c(nc2)nc(NC(N3c4ccccc4)=O)c2C3=O)c1C,1 Z1211465600,CC(C(C)(C)C)C(N(CC1)CCC1NC(c1c(C)cccc1)=O)=O,0 F5286-0391,CSc1cc(NC(C(OC=C2OCc(cc3)ccc3F)=CC2=O)=O)ccc1,0 F6556-8854,O=C(C1CC=CCC1)NC(c1cscc1)c1cccs1,1 Z2981799423,CC(C)(c1nc(-c(cc2)ccc2O)cs1)S(C)(=O)=O,0 Z809505960,O=C(c1n[nH]cc1)N(CCC1)CCN1C(c(cc1)ccc1Cl)=O,0 F1874-0603,CSc1c(cnn2-c(cc3)ccc3Cl)c2ncn1,0 F5791-2254,O=C(c1n[nH]c(-c2cccs2)c1)NCCOc(cc1)ccc1F,1 F6439-1114,O=C(NCCn(c1c2CCCC1)nc2-c1ncccc1)Nc(c(F)ccc1)c1F,1 K405-3751,Clc1cc(-n2ncc3c(N(CC4)c5c4cccc5)ncnc23)ccc1,0 Z1724329701,Cc1csc2nc(C)nc(NCC3(CCCC3)O)c12,0 Z1728515534,CN(Cc(cc1)ccc1OCC(O)=O)C(C1CCCCCC1)=O,0 Z3681228105,CNC(c1c(C2C3NCC2C3)ocn1)=O,0 Z2154856069,O=C(CC(CCC1)NC1=O)Nc1cccc(Cl)c1OCC(F)F,0 G786-0412,O=C(c(cc1)cc2c1OCCO2)N(CC1)CCN1c1nc(ccc(F)c2)c2s1,0 Y031-4017,CC(CCc1ccccc1)NC(C(C1)CN(C(C)(C)C)C1=O)=O,1 5751-8436,CCCOc1ccc(C(C2)c(cc(C)c(C)c3)c3NC2=O)cc1,0 F5557-0004,O=C(CSc1ncccc1-c1nc(cccc2)c2[nH]1)N1CCOCC1,1 7706-0434,CC(C)CNc1nc(N(C)C(NC2=O)=O)c2n1CC(COc1cc(C)ccc1)O,0 F6359-1711,N#Cc1cccnc1OC(CC1)CCN1C(c(cccc1)c1Br)=O,0 Z1474297597,Cc(n(-c1ccc(C)cc1)nc1)c1C(NC(CCC(N1)=O)C1=O)=O,1 E715-0271,O=C(C(CCC1)CN1c1ncnc2c1nc1n2CCCCC1)N(CC1)CCN1c1ncccn1,1 F6795-2259,CC(N=C(NC1=O)N(C)CC(C2)CN2c2c3sccc3ncn2)=C1F,1 F820-1216,O=C1Oc(cc(cc2)S(NCCc(cc3)ccc3Cl)(=O)=O)c2N1Cc1noc(C2CC2)n1,1 Z1071387034,O=C(NCc1c(CS(N2CCOCC2)(=O)=O)cccc1)N1CC(c(cccc2)c2F)OCC1,1 T408-2194,CCNC(C(CC1)Cc2c1sc(C(N1CCOCC1)=O)c2)=O,1 F5493-0325,CN(C(C=C1)=O)N=C1C(N(CCC1)CC1c1nnc(-c(cccc2)c2F)s1)=O,1 F6374-1304,Cn1c(SCC(CC2)CCN2C(c(cc2)cc3c2OCO3)=O)ncc1,1 Z2988981568,C[C@@H](CC(OC)=O)NC(c1ccc(ccc(Cl)c2)c2n1)=O,0 F6560-7811,Cc1cccc(CS(NCc(cc2)cnc2-c2cocc2)(=O)=O)c1,1 Y300-0644,CN(CC1)CCN1c1ccc(CNC(COc(cccc2)c2F)=O)cc1,0 L269-0934,O=S(c1ccc(C2CCCCC2)cc1)(N1CCN(Cc2noc3c2cccc3)CC1)=O,1 F6418-2929,OC(c1ccc(CNC(Nc2ccccc2)=O)s1)c1ccccc1,1 Z1538172551,COCc1cccc(CN(CC2)CCN2c(nccc2)c2F)c1,0 F6562-7293,O=C(Nc(cc1)cc(Cl)c1Cl)N(CC1)CCC1N(C(COC1)=O)C1=O,0 Z728850288,CCCN(CC(O)=O)C(c1nn2c(C)cc(C)nc2n1)=O,0 Z2297806428,O=C(C(CC1)NC1=O)N(CCC1)CCc2c1cccc2,1 S556-0055,Fc(cc1)cc(CN(C2)CC2Oc(cc2)ccc2-c2noc(C3CC3)n2)c1F,1 Z2295909619,OC(C(CNC(C(CCN1c(cc2)ccc2F)C1=O)=O)C1CCOCC1)=O,1 F6555-6388,Cc(ccc(C(N(C1)Cc2c1cccn2)=O)c1)c1F,0 SA40-0118,CN(CC1(CN(Cc2ccccc2)C1)C1)C1C(N(CC1)CCN1C(c1ccco1)=O)=O,1 F6713-1827,CC(C)Oc(cc1)ncc1C(N(CC1)CCC1N(C(C=C1)=O)N=C1n1nc(C)cc1C)=O,1 F5265-0389,Cc(cc(cc1)OC)c1S(NCCN(CC1)CCN1c(cc1)ccc1Cl)(=O)=O,0 C548-3130,O=C(C(CCC1)N1S(c1cccc2nsnc12)(=O)=O)NC1CCCCCC1,1 SC89-0325,O=C(Cc1cscc1)N(C1)CC1(C(CN1CCOCC1)CC1)S1(=O)=O,1 Z1592706287,CC(N12)=C(C)SC2=NC=C(C(Nc2cc(C)cc(C)c2)=O)C1=O,0 Z2982446526,Cc(cc1)c(C)cc1S(CCNC(C1CC1)=O)(=O)=O,0 Z599604190,CN(Cc1cccc(Cl)c1)S(N(CC1)CCC1C(O)=O)(=O)=O,0 F0010-0479,O=C1N=C(c2ccccc2)c(cc(cc2)Br)c2N1,0 Z413363388,Cc(ccc(NC(N(CC1c2ccccc2)Cc2c1cccc2)=O)c1)c1-n1nnnc1,1 S997-1222,COC[C@](CN(C1)S(C)(=O)=O)(CC2)[C@H]1CN2C(c1nc2ccccc2cc1)=O,1 F2884-0142,CC(C)c(cc1)ccc1N(CC(C1)c2nc(-c3ncccc3)no2)C1=O,1 F6734-0724,O=C(C(C1)CN(C2CCOCC2)C1=O)N(C1)CC(C2)C1CN2c(cc1)ncc1Cl,1 M088-0129,Cc(sc(-c1noc(C(F)(F)F)c1)c1)c1S(N(CC1)CCN1c1ncccc1)(=O)=O,1 Y205-0790,CC(C(N(C(C)C1)c2c1cccc2)=O)Oc(cc1)cc(C)c1Cl,0 F6481-1176,O=C(c1ccc(Cn2cncc2)cc1)N(CC1)CCSC1c(cccc1)c1F,1 F6178-5605,COc(ccc(Cl)c1)c1NC(NCC(CC1)CCN1c1nc(cccc2)c2s1)=O,0 Z1545829998,CC(C)c1c(C(N(C)Cc2c(C)nc3sc(C)cn23)=O)c(C)n[nH]1,0 Z2991040109,CC(C)(C(O)=O)c1cccc(-c2ccc(C(CC3)NC3=O)cc2)c1,0 F6739-7865,Cc1nc(CN(C)Cc(cc2)cc3c2OCCO3)no1,1 Z1721144442,Cc1c(CCC(N2CC3(CC3)CCC2)=O)c(C)n[nH]1,1 S066-0097,CN(C)c1cc(OC(CC2)CN2C(c2ccccc2)=O)ncn1,0 F1032-0054,COc(cccc1)c1N1CCN(CC(COc(ccc(Cl)c2)c2Cl)O)CC1,0 Z3009380538,Cc1c(CNS(c2c(C)c(F)ccc2)(=O)=O)ocn1,0 F6672-2285,N#Cc(cc1)cnc1N(C(CC1)C2)C1CC2=C1CCC1,1 Z239097106,NCc(cc1)ccc1NC(c1ccccc1)=O,0 Z3094473839,CC(c(n1C)nnc1N(CC1)CCN1S(c(cccc1)c1Cl)(=O)=O)O,0 S974-2630,C[C@@H](C(N(C[C@H](C1)N(C)C)[C@@H]1C1)=O)N1C(c1cc(C)n[nH]1)=O,1 3334-4856,CC(c(ccc(Oc1c(c(CCCC2)c2s2)c2ncn1)c1)c1O1)=CC1=O,0 S721-0780,O=C([C@H](C[C@@H](C1)Oc2cnccc2)N1C(c1cc2cccnc2cc1)=O)N1CCCC1,1 Z2768784097,CCC(C)c1nnc(CC2)n1CC2C(OC)=O,0 F2902-1705,O=C(C(CC1=O)CN1c(cc1)ccc1F)NCCn1ncc2c(NCCc3ccccc3)ncnc12,1 F6658-4679,CN(C(C=C(N1)N(CC2)CCN2c2nc3ccccc3nc2)=O)C1=O,1 F6512-1351,O=C(c1cnc(C(F)(F)F)cc1)NC1Cc2ccnn2CC1,1 Z1417700587,Cc(nc(cc1)OC)c1NC(N1CCN(Cc2cscn2)CC1)=O,0 Z666646608,CC(c(cc1)cc(N2)c1NC2=O)NC(c1cn(Cc(cccc2)c2Cl)nc1)=O,1 Y030-7457,O=C(CCc1ccccc1)Nc1nnc(C2CCCCC2)s1,0 F3382-7112,COc(cc1)ccc1NC(CN(C=CN1c(cc2)ccc2OC)C1=O)=O,1 Z4235706361,O=C(CNC(c1cc2ncccc2cc1)=O)Nc(cccc1C(NN2)=O)c1C2=O,1 Z1367238538,CS(N(CC1)CCN1C(C1(Cc2ccccc2)CC1)=O)(=O)=O,1 F2446-0068,CCOC(c1c(-c2ccccc2)nc(NC(c2nn(C)c(C)c2)=O)s1)=O,0 J038-2691,Cc(cc1)cc([C@H]2OCC[C@@H]22)c1NC2c(cc1)ccc1Cl,0 F0630-0909,CN(C)S(c(cc1)ccc1C(N1C(SCc(c(F)ccc2)c2Cl)=NCC1)=O)(=O)=O,0 F6753-2030,O=C(C(CC1)CCN1c1nccs1)N(CC1)CCC1(F)F,1 L927-0445,CCOc1cccc(-c2noc(CN(c3c(C(N4c5cc(F)ccc5)=O)scc3)C4=O)n2)c1,0 Z2951165337,O=C(NC(C1CC1)c1ccncc1)Nc1nccc(Br)c1,1 Z2407929250,CC(C)(COC)N(CC1)CCN1C(C1Cc2nccn2CC1)=O,0 F312-0086,O=C1Oc(ccc(Br)c2)c2C=C1S(N(CC1)Cc2c1cccc2)(=O)=O,0 F6788-9574,CN(C(CC1)CN1c1ncnc2c1ncn2C)S(Cc1ccccc1)(=O)=O,1 F6481-1145,O=S(N1CCOCC1)(N(CC1)CCSC1c(cccc1)c1Cl)=O,0 L866-2116,Cc(cc1)cc2c1OCCN2C(CN(c(cccc1)c1N=C1CCC(NC)=O)C1=O)=O,1 Z2897419900,OC(C(CC1CCCCC1)NCc1nc(CCC2)c2cc1)=O,1 F2730-0667,CSc(cc1)cc2c1nc(N(CC1)CCN1C(c1c[nH]c3c1cccc3)=O)s2,1 F6571-2659,OCCOC1(CNC(NCc(cc2)ccc2F)=O)CCCC1,0 E977-0681,O=C(C(CCC1)CN1S(c(cc1)cc(CCC2)c1NC2=O)(=O)=O)Nc(cc1)ccc1F,0 F6443-6717,CCCn(c(C(NCC(CCC1)N1c1nccs1)=O)c1)c(N(C)C(N2C)=O)c1C2=O,1 F6064-1230,O=C(COc(ccc(Cl)c1)c1Cl)N(C1)CC1c1nc(-c2cnccc2)no1,1 F1911-5788,CC(C)(C)OC(N1CC(CN2N=C(C)C=CC2=O)C1)=O,0 F5823-0892,Cc1cc(C)nn1CC1CCN(Cc2csc(C)n2)CC1,1 F6279-0398,OC(CNC(c(cc1)ccc1OC(F)(F)F)=O)c1cccc2ccccc12,0 Z1455361357,OC([C@@H](CCC1)N1C(CC(CC1)CCC1c1ccccc1)=O)=O,1 Z1693587351,O=C(CN(C(C1(CCCC1)N1)=O)C1=O)NC(Cc1ccccc1)C(N1CCOCC1)=O,1 3209-0402,O=C(c1nn(C(CC(c2ccccc2)N2)C(F)(F)F)c2c1)N(Cc1ccccc1)Cc1ccccc1,1 F3082-0024,O=C(c1cccc2nc3ccccc3nc12)NCc(cc1)ccc1F,1 F6743-7733,CN(C(CCC1)CN1c1nc(C(F)(F)F)ccc1)S(C1CC1)(=O)=O,0 F5791-2866,Cc1ccc(c(NC(c(c(F)ccc2)c2Cl)=O)ccc2)c2n1,0 F2135-1596,N#Cc1cccnc1SCc1cc(C(F)(F)F)ccc1,0 Z3466149713,O=C(c1c(C2c3c[nH]c4c3cccc4)cccc1)N2C(CCC(N1)=O)C1=O,1 D399-1037,COc1cc(CN(CCC2)C2c(cc2)ccc2Cl)cc(OC)c1,0 F6178-7041,COC(c(cc1)ccc1C(NCC(CC1)CCN1C1CCOCC1)=O)=O,0 Z423505082,Cc(n(Cc1ccccc1)nc1)c1C(NC1c(cccc2)c2OC2(CCN(C)CC2)C1)=O,0 Y200-5979,CC(CC1)Cc2c1c(C(NC1CCCCC1)=O)c(NC(CCCC(O)=O)=O)s2,0 Z5001810247,OCC(C1)OCC2(CC2)N1S(c(cc1)cc(C(N2)=O)c1NC2=O)(=O)=O,1 F6571-0035,Cc1c(C(NCC(c2csc3c2cccc3)N(C)C)=O)snn1,1 F5857-3882,CC(Cc(cc1)ccc1OC)(CNC(CSCc1ccccc1)=O)O,1 SB73-0425,CC(C)C(N(CC1)C[C@]1(C[C@@H](C(NCc1ccc(C)o1)=O)N1)C1=O)=O,0 SC19-0535,CCn1nc(CN(CC2)CCN2C(C2(CC2)c(cc2)ccc2OC)=O)c2c1CCOC2,1 F6521-3876,CC(CNS(c1cccc(Cl)c1)(=O)=O)(c1cc(cccc2)c2o1)O,0 F6523-0351,O=C(c(cccc1)c1SC(F)F)N(CC1)CCN1c1ncnc(C(F)(F)F)c1,0 F6619-7096,Cc1cc(C)nn1-c1cc(N2CCN(Cc3nnc(C)o3)CC2)ncn1,0 F118-0497,CN(C)C(c(cc1)cc(N2CC(N(CC3)Cc4c3cccc4)=O)c1OCC2=O)=O,1 F6673-4852,Cc1cnc(N(C)C(CCC2)CN2C(Cc(cccc2)c2Br)=O)nc1,0 SA01-0858,CN(C)C(c1c(C(CC2)CN2C(CC2CCCCC2)=O)nc(N(C)C)nc1)=O,1 Z2912217926,Cc1c(C(NC(C2CCC2)c(cc2)ccc2OC)=O)oc(C(O)=O)c1,1 F5831-8947,O=C(CSCc1ccccc1)NCCN(CC1)CCN1c(cccc1)c1F,1 Z3254883573,CCn1nnc2c1N=CN(CC1(CCC1)O)C2=O,0 Z2710305778,CC(C)(CNC(Nc1cc(C2OCCC2)nn1C)=O)c1cc2ccccc2cc1,1 F6680-8898,Cc1nccc(OCC2CN(CC(N)=O)CCC2)c1,0 Z1326545458,CCCc1n[nH]c(C(NCC(c(cccc2)c2F)O)=O)c1,0 Z3095725224,CC[C@@H](c(n1C)nnc1N(CC1)CCN1S(c(cc1)ccc1F)(=O)=O)O,0 F6785-6236,O=C(C1OCCc2c1cccc2)N1CCC(COc(cc2)nn3c2ncc3)CC1,1 F3406-7062,O=C(CSc1ncnc(-n2nccc2)c1)Nc(cc1)cc(C(F)(F)F)c1Cl,0 Z2380441593,Cc1ncc(CN(C)Cc(ccc(C(O)=O)c2)c2F)s1,0 Z2228801186,O=C(C(CC1)Cn2c1cnc2)N1CCSCC1,1 Z1885432654,CC(C)(CNC(c1coc(C2CCOCC2)n1)=O)c(cccc1)c1Br,0 S562-0028,O=C(c1c[nH]nc1-c(cc1)ccc1F)NCC(CCCC1)NC1=O,1 F5871-2205,Cc(cc1)c(C)cc1NC(N1CCN(CCNC(c2cscc2)=O)CC1)=O,1 S591-0208,O=C(c1cocc1)N(C1)CC1N(CC1CC1)C1CCOCC1,1 Z2409475873,CC(C)(CC1c2ccccc2)CN1S(c1cnc2n1CCC2)(=O)=O,1 F6523-2319,CCn1nc(C(N(CC2)CCC2N(C(c(cc(cc2)F)c2N2)=O)C2=O)=O)c(Cl)c1,1 E216-1576,CC(c(cc1)cc2c1OCCO2)NC(C(CC1)CCN1C(N1c(cc(C)cc2)c2OC(C)C1)=O)=O,1 Z2947915219,CC(C)OCc1noc(CN2c(cccc3)c3N(C)CCC2C)n1,0 Y044-1293,COc(cc1)cc2c1nc(NC(CC(C(Nc1c3cccc1)=O)NC3=O)=O)s2,1 Z1071495910,Cc1noc(CNC(N(CCC2)CCC2c2ccccc2)=O)c1,1 Z1449574394,CC(C)n1ncc2c1N=CN(Cc(c(F)ccc1)c1Cl)C2=O,0 SB16-0930,CCS(N1[C@@H](CCN(Cc2c(C)onc2C)C2)[C@@H]2COCC1)(=O)=O,1 D724-0355,Cc1cc(C)nc2nn3c(N(CC4)CCN4c4nc(C)ccc4)cc(C)nc3c12,1 Z511692832,O=C(C1CCCC1)Nc(cc1)ccc1OCC1OCCC1,1 Z1778572054,OC(C1)(Cc2c1cccc2)c1nc(Cc2ccccc2)no1,0 F6433-0315,O=C(Cn1ncnc1)Nc1ncnc(-n(cc2)c3c2cccc3)c1,1 Z1188608595,Cc1csc(C2(CCCC2)NC(c(cccc2)c2OC)=O)n1,1 F6210-1071,Cn(c(C(NC(C1)CN(C2CC2)C1=O)=O)c1)nc1-c(cc1)ccc1F,1 F6764-3523,Cc1c(C(N(CC2)Cc3c2nc2ncc(Br)cc2c3)=O)c(C)nn1C,1 Z1991861441,CC(C)(C(O)=O)n1ncc(NC(c2cc(C)cc(C)c2)=O)c1,0 Z964220784,CCS(N(CC1)CCN1C(NCc1c(CS(N2CCOCC2)(=O)=O)cccc1)=O)(=O)=O,1 F6245-5001,CC1=C(C)N=CN(CC(N(CCC2)CC2C(N2c3ccccc3)=NN(C)C2=O)=O)C1=O,1 S751-0282,Cc1cnc(C2CC2)n1CCNC(C1(CCCC1)c1ccccc1)=O,0 G581-0220,Cn1c(cccc2)c2c(-c2nn(CCC(N3CC(NCCCN4CCN(C)CC4)=O)=O)c3c2)c1,1 Z4475021601,Cc(cc1c(C(NC(C2)COC22COCC2)=O)c2)ccc1nc2-c1cnccc1,1 F6562-9612,CCOc(cccc1)c1NC(NCc1nccnc1-c1ccco1)=O,0 Z2996946719,Cc1csc(-c2noc(CC3CCN(CC(F)F)CC3)n2)n1,1 SA02-0064,Cc1ncc(CO)c(C(CC2)CCN2C(C2(CC2)c(cc2)ccc2OC)=O)n1,0 3209-0742,COc(ccc([C@H](C[C@H](C(F)(F)F)n1nc2)Nc1c2C(NCCc1ccccc1)=O)c1)c1OC,1 Z2954358198,CCc1noc(COCC(N(C)C(CC2)Cc3c2cccc3)=O)n1,1 F6680-8629,Cc1nccc(OCC(CCC2)CN2C(c2cn(C)nn2)=O)c1,1 Z3024904984,OC(C(C(C1)CC2)C12C1CCNCC1)=O,1 Z1330185423,CCOCC(CC1)CN1C(c1coc2c1cccc2)=O,0 Z1418656952,CC(C1)(c2ccccc2)OCCN1C(NCc(cc1)cc(F)c1Oc1cnccc1)=O,0 G857-0450,O=C(CSC(C(CCC1)=C1N1Cc2ccncc2)=NC1=O)NCC1OCCC1,1 F6660-0659,COc(cc1)ccc1-c(nc1)ncc1NC(c1cscc1)=O,1 Z915993632,CCN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)CC#N,0 M754-1480,O=C(C1(CC1)c1ccccc1)N(CCCC1)C1c1nnc(-c2ccncc2)[nH]1,1 6948-4511,O=C(Cn1c(cccc2)c2c(C(C2CCCCC2)=O)c1)Nc1c(C(F)(F)F)cccc1,1 Y031-5136,CC(Nc(cc1)ccc1N(CC(C1)C(N2CCCCC2)=O)C1=O)=O,0 S512-0338,O=C(c1ccco1)N(CC1)CC1Oc1cccc(F)c1,0 G069-0561,CC(C)(c(cc(cc1)S(N2CC(CN(CC3)Cc4c3cccc4)CCC2)(=O)=O)c1N1C)C1=O,1 Y031-5346,O=C(C(CC1=O)CN1c1ccccc1)Nc(cc1)ccc1C(NCC1OCCC1)=O,1 Z1733277283,O=C(c1ccc(CN(CCCC2)C2=O)cc1)N(CC1)Cc(cccc2)c2S1(=O)=O,1 F6363-0634,O=C(c(c(F)ccc1)c1Cl)NCCNc1ncnc(-n2cccc2)c1,0 S688-3283,COCCC(CC1)(CCN1C1CCCCC1)NC(c1ccccc1)=O,1 S635-4249,COCC(CN(C1)C2CCC2)C1(CC1)CCN1C(C1CCCCC1)=O,1 Z2903922127,OC([C@@H]1[C@H](C2)[C@@H]1CCN2C([C@@H]1C[C@H](C2)[C@H]2C1)=O)=O,1 Z1552196875,CC(C(N(CC1)CCN1c(cc1)nnc1C(N)=O)=O)O,0 M347-0273,CC(CC1)CCN1S(c1cn(CC(N2CCCCC2)=O)c(-c2nc(C)cs2)c1)(=O)=O,1 F6262-1337,COc1cc(NC(Cc(c(F)ccc2)c2Cl)=O)ncn1,1 F6440-4424,O=C(C1CC=CCC1)NCc1nn(C2CCCC2)c(C2CC2)c1,1 Z2897884751,CC(C)(C(O)=O)NC(Cc1c(C)ccnc1)=O,0 F5857-4938,OC(CNC(c1cscc1)=O)C1CCCCC1,1 F0699-0088,O=C1N(Cc(c(F)ccc2)c2Cl)C=Nc2c1oc1c2cccc1,1 SC60-0966,CC(C)CN(C(C(C1)N2CC(C)(C)CN1C(Cn1cncc1)=O)=O)C2=O,1 Z3071638897,Brc1cn2ncnc2c(-c2noc([C@@H]3OCCC3)n2)c1,1 V028-6374,COc(ccc(CN(CCN1CCOCC1)CC(COCc1ccccc1)O)c1)c1OC,0 F6752-6365,O=C(C1CN(Cc2csc(C3CC3)n2)CCC1)N(CC1)CCC1(F)F,1 F5461-0170,O=C(c1cccs1)N1CCN(Cc2nc(-c(cc3)ccc3F)cs2)CC1,1 F2617-0668,O=C(COC1=COC(CN(CC2)CCN2c(cccc2)c2F)=CC1=O)NCc1ccco1,1 SD02-1015,CC(C)c1nnc(C(C2)N(CC(N3CCCCC3)=O)CC2(CC2)CCN2C2CCOCC2)o1,1 Z131525370,CC(c1nnc2n1cccc2)NC(c(cc1)cc(Cl)c1Cl)=O,0 F5596-0791,O=C(CSc(cc1)ccc1F)N(CC1)CCC1c1nnc(C2CC2)o1,1 Z2027055707,Oc(c(Cl)ccc1)c1S(Nc1cccc(Cl)c1F)(=O)=O,0 Z2959763726,CC(C)(c1c(C)onc1C)NC(c1cc(C(F)F)ncn1)=O,0 F6473-7288,O=C(COc(ccc(Cl)c1)c1Cl)N(C(CC1)C2)C1CC2N(C(CC1)=O)C1=O,0 Z364305588,COc(ccc(CC(NC1(CCCCC1)C(O)=O)=O)c1)c1F,0 F6125-1022,CCOC(C(CCC1)CN1C(C(C1)CN1C(c1c[nH]c2c1cccc2)=O)=O)=O,1 Z2597416180,O[C@@H]1C[C@H](CN(Cc2csc(-c(cc3)ccc3C(O)=O)n2)C2)[C@H]2CC1,1 Z1548885883,O[C@H](C(NC(CC1)CCN1C1CC1)=O)c1ccccc1,1 Z2527352229,Fc1cc(OCc2cn(C3CCNCC3)nn2)cc(F)c1,0 F5831-8405,Cc1c(C(NCCN(CC2)CCN2c(cc2)ccc2F)=O)n(cccc2)c2n1,1 Z2226634860,N#CC1(CC(NCc2cnc(-c(cc3)ccc3Cl)s2)=O)CC1,1 F6481-4025,O=S(N1CCOCC1)(N(CC1)CCSC1c1ccco1)=O,1 C884-1020,CC(CNC(C(C)n1c(C(NN=C2)=O)c2c2c1cccc2)=O)c1ccccc1,0 F1065-0786,O=C(CC1Nc(cccc2)c2NC1=O)Nc(cccc1)c1OC(F)F,0 Z1553009418,CCCC(C(NCC1)=O)N1C(c1cc(cccc2OC)c2o1)=O,0 Z4107123398,C[C@H]1O[C@@H](C)c2nn(C)c(C(N(CCc3c(C)cc4)Cc3c4F)=O)c2C1,1 Z2361652794,CC(CNS(c(c(C)c1)cc(Br)c1F)(=O)=O)(C(O)=O)O,0 F6489-0006,O=C(Cn(cc1)c2c1cccc2)N(CC1)CC1Oc1nnccc1,1 F1878-0811,CC(C)(C)n1nc(CSC2)c2c1NC(c1nc(cccc2)c2s1)=O,1 Z1631449251,O=C(c1c[nH]nc1-c1cnccc1)N(CC1)CCN1C(CCCN1Cc2ccccc2)C1=O,1 F2784-0521,Cc(ccc(NC(c1cccc(Br)c1)=O)c1)c1N(CCCC1)C1=O,0 Z4435904053,Cc1cccn2c1ncc2CC(NC1(CCCC1)c1ccccc1)=O,1 F6557-1811,COc(cc1)cc(OC)c1C(N(CCC1c(cccc2)c2Cl)CCS1(=O)=O)=O,0 S976-1163,O=C(C1(CN(Cc2ccncc2)CCC1)F)NCC1CC1,1 E947-0224,CC(CCCC1C)N1C(c1c(C)oc(N=CN2C)c1C2=O)=O,1 Z3416715393,CCCOc(cc1)cc(OC)c1C(N(CC1)C(C(N)=O)c2c1n(C)nc2)=O,0 F6497-1267,Cc1noc(C)c1S(N1CC(Cc2nc(-c3c(C)cccc3)no2)CCC1)(=O)=O,1 F6743-6292,CN(C(CC1)CCN1c(cc1)nn2c1nnc2C(F)(F)F)S(C1CC1)(=O)=O,1 F473-2145,CCOc(c1c2)cc(-c(cc3)ccc3F)nc1ccc2C(Nc(cc1)cc2c1OCCO2)=O,1 Z1127368998,CCN(CCCC1)C1C(NC1CCN(Cc2ccncc2)CC1)=O,1 Z364350954,CC(Nc1ccc(CC(NC2(CCCC2)C(O)=O)=O)cc1)=O,0 Z2972955004,Cc1n[nH]c(CNC(NC(CC2)c3c2ccc(-c2ccccc2)c3)=O)n1,1 F5822-0701,O=C(Cc(c(F)ccc1)c1Cl)N1CCC(Cn2cncc2)CC1,0 Z1682503231,CC(C)c(cc1)ccc1-c1noc(Cc2csc(-c3nnc[nH]3)n2)n1,0 Z3091717269,CC(CC(C)(C)C)CC(N(CCC1)CC1c1nnc(CO)n1C)=O,0 F6529-0047,CN(c(cccc1)c1N1C(CC2)CCN2C(c(cccn2)c2OC)=O)S1(=O)=O,0 G325-1108,CC(CC(N(Cc1ccco1)C1CCCCC1)=O)S(c(cc1)cc(CC2)c1N2C(C1CC1)=O)(=O)=O,1 S893-0308,CCn1nc(C(CCC2)N2S(c(cc2)ccc2OC)(=O)=O)c2c1CCOC2,0 F6472-7207,Cc1nn2c(CCN(C3)C(CCc4c(C)onc4C)=O)c3cnc2c1,1 F0777-2812,O=C(C(c1ccccc1)c1ccccc1)NCCCN1CCOCC1,1 Z1511505346,O=C(CN(CC1)CCC1c1ncccc1)N1CCCCC1,1 Z2966754594,C[C@@H](C(NCCC1)=O)N1C(c1c(C)n(C2CCOCC2)nc1)=O,1 Z1273139525,COc1cccc(CNC(C(CC2)CCC2c2ccccc2)=O)c1,1 F6472-7451,Cc1nn2c(CCN(C3)S(c(cc4)ccc4OC(F)(F)F)(=O)=O)c3cnc2c1,1 F6094-0610,CC(C(NCCOc(cc1)nnc1-c1ncccc1)=O)Oc(cccc1)c1F,0 F5854-0937,COc(ccc(Cl)c1)c1C(N(Cc1cscc1)Cc1ncccc1)=O,0 Z2396453417,Cc(cncc1)c1C(NC[C@@H](CC1)O[C@@H]1c1nc(C2CC2)n[nH]1)=O,1 Z4480906539,NC(CC(CC1)CCN1c1nnc(C(N2CCCC2)=O)n1CCc(cc1)ccc1F)=O,1 F5857-0860,Cn1c(C(CNC(C(Oc2c3cccc2)=CC3=O)=O)O)ccc1,1 S696-0472,Cc1cnc(C2CCOCC2)n1CC(C1)CN1C(c1c(C)onc1C)=O,1 M505-0677,Cc1c(CNCc2cccnc2)c(C)nn1-c1ccccc1,1 Z1677458261,Cc1nccc(N2CCN(Cc(cc3)ccc3OC(F)F)CC2)n1,0 Z1754413110,CC(C)(C)c1nsc(N(C[C@H](C2)OC)[C@H]2c2nnc(C)o2)n1,0 SD14-0627,CN([C@@H](CCN(C1)C2CCCC2)[C@@H]1C(N(Cc1cnccc1)C1)=O)C1=O,1 F6753-2064,N#Cc(ccnc1)c1N(CC1)CCC1C(N(CC1)CCC1(F)F)=O,0 Z3497804087,CCOc1ccc(CN(Cc2c(C3)[nH]cn2)[C@H]3C(O)=O)cc1,0 F6472-8098,O=C(C1(CCOCC1)c1ccccc1)N(CC1)CC1N(CC1)Cc2c1cccc2,1 F6438-3726,CN(C)c1nc(CNC(c2cn(C)nn2)=O)nc(N2CCCCC2)n1,1 SB20-1442,O=C(Cc(cc1)ccc1F)N1[C@H](Cn2nnc(C(NC3CCCC3)=O)c2)CCC1,1 Z2924179735,CC(CCN1C)(C1=O)c1nc(C2(CCC2)c2ccncc2)no1,1 SB01-0550,Cn1nc(COc2ncccc2)c2c1CCN(Cc(cc1)cc3c1OCCO3)C2,1 F6558-0128,CC(C)(C)C(CN1)C(C(NC(c2ccccc2)c2ccccc2)=O)C1=O,1 SC10-0115,Cn1ncc(C(N(CC2)CC2N(CCCN2CCOCC2)S(C)(=O)=O)=O)c1,0 T990-2316,COCCN(CCC1N(CC2)CCN2S(c2c(C(F)(F)F)cccc2)(=O)=O)C1=O,0 Z748081920,CN(CC1)CCN1C(c(cccc1)c1NC(c1noc2c1CCCC2)=O)=O,1 Z1183868990,NS(C(CC1)CN1C(c1ccc(C2CCCCC2)cc1)=O)(=O)=O,0 SA93-0132,CC(CCC1)(CN1C(c1noc(Cn2ncc(C)c2)c1)=O)C(N)=O,0 F6789-5266,CC(C)(C)c1cc(Nc(cc2)ccc2S(C)(=O)=O)nc(C)n1,0 F6761-7676,FC(c1cc(N2CC3N(Cc4cn(cccc5)c5n4)CCC3C2)ncc1)(F)F,1 Z2581487918,Cc(cc1)cc(C(NC2(CC(O)=O)CCOCC2)=O)c1Br,0 T604-0328,CC(C)Oc(cc1)ccc1-c1nc(CN(C(c(cc2)ccc2F)=NC(C)=C2CCO)C2=O)c(C)o1,1 Z1270412357,CC(CNC(C1OCCCC1)=O)(C(O)=O)O,0 F6495-4986,O=C(C(C1)CN1c1ncnc(-n2ncnc2)c1)NCc1ncccc1,1 F2617-1444,COc(cc1)ccc1C(COC1=COC(CN(CC2)Cc3c2cccc3)=CC1=O)=O,1 F6481-4420,O=C(CN(CCN1c2ccccc2)C1=O)N(CC1)CCSC1c1cccs1,1 F6125-0077,O=C(C(C1)CN1C(c1nccnc1)=O)NCc(c(F)ccc1)c1F,0 S615-0212,O=S(Cc1ccccc1)(N(CC1)CC1c1nc(CCOc(cc2)ccc2F)no1)=O,0 S904-1864,CC(C)C(N1Cc2nnc([C@H](C3)N(Cc4cn(C)c5c4cccc5)C[C@H]3O)n2CC1)=O,0 SC44-0342,Cc(occ1)c1C(N(CC1)CCC1(C1)OCCC1OCC(N1CCOCC1)=O)=O,1 F6263-0077,CCC(C(N1C2CN(Cc3ccccc3)CC1CC2)=O)c1ccccc1,1 F5607-0190,CC(C)(C(NCCNc1ncnc(-n2c(C)ncc2)c1)=O)Oc(cc1)ccc1Cl,1 SB24-0393,Cc1c(COC)c(C(N(CC2)CCC2(CC2)C2n2nnc(C(N(C)C)=O)c2)=O)no1,0 Z1259194428,O=C1NCC(C2CC2)n2c1cc(Br)c2,1 F6401-0034,C(c1ncccc1)N(CC1)CCC1c1cccs1,1 E015-0470,CC(CCC1)C(C)C1NC(CCC(N1c(cc(cc2)Cl)c2OC(C)C1)=O)=O,1 F6658-3110,O=C(c1cnc(C(F)(F)F)cc1)N(CCC1)CCN1c(cc1)nn2c1nnc2,0 Z2863938097,CN(Cc1nnc2n1CCNC2=O)C(C(C1)C1C1CCCCC1)=O,1 F3222-1599,COc(c(NC(C(CC1)CCN1c1nc2ccccc2nc1)=O)c1)cc(OC)c1Cl,0 V007-8339,O=S(c(cc1)cc2c1n(CC1OCCC1)c(SCc(cc1)ccc1Br)n2)(N1CCOCC1)=O,0 SD56-0728,O=C(C(C1)N2CCCN1S(C1CC1)(=O)=O)N(C1CCCCC1)C2=O,1 SC66-0307,CC(C)Cn1c(C(CN(C2)C(Nc(cc(cc3)F)c3F)=O)C22CCOCC2)nnc1,0 P814-5932,CN(c1c(N2C(CC3)CCN3C(NCc3ccco3)=O)ncnc1)C2=O,1 Z2448028797,CCCC(C(Nc(cccc1)c1C(N1CC(C)CC(C)C1)=O)=O)N,0 S066-0333,CN(C)S(N(CC1)CC1Oc1ncnc(N2CCOCC2)c1)(=O)=O,1 Z2273632229,F[C@@H](CC1)CN1c1c(ccs2)c2ncn1,1 F2966-0344,COC(c(cc1)ccc1C(N(Cc1ccco1)c1nc(c(SC)ccc2)c2s1)=O)=O,0 F6359-5072,O=C(Nc1cccs1)N(CC1)CCC1Oc(nccc1)c1Br,0 F6734-2633,COCc1nsc(N(C2)CC(C3)C2CN3c2nnc(C3CC3)cc2)n1,1 F6490-0887,Cc(cc1)nnc1OC(CCC1)CN1C(c1cc2nccnc2cc1)=O,1 F6792-4321,Cc1nc(C)nc(OCC(CC2)CCN2c2nc(C)nc3cnccc23)c1F,1 F5854-2997,Cn1c(CN(Cc2cccs2)C(c2noc(-c3ccccc3)c2)=O)ccc1,1 Z4121707726,O[C@H](CC1)CC[C@@H]1Nc1nc(ccc(C(NC2(CC2)c(cc2)ccc2F)=O)c2)c2n2c1ncc2,0 S629-2489,O=C(CCc(cc1)cc(C2)c1OCCN2C(Nc(cc1)cc2c1OCCO2)=O)N1CCCC1,1 S932-1812,COCc1cn(C(CC2)CN2C(c2cscc2)=O)nn1,1 Z2699738987,Cc1cccc(NC(c(cc2)ccc2C(N2CCOCC2)=O)=O)n1,0 Z2188033112,OCC(CC1)(CN1C(c1c(C(F)(F)F)cncc1)=O)c1ccccc1,0 F5882-2951,O=C(c(cc1)cc2c1OCO2)NCCN(CC1)CCN1C(NCCCc1ccccc1)=O,1 Z2097167385,CN(CC1(CCC1)O)S(c1c(C(F)(F)F)nccc1)(=O)=O,1 F6708-8366,CN(C)S(N1CC(C2)(CC2c2ccccc2)C1)(=O)=O,1 T842-2460,COCCn1c(cncc2)c2nc1C(CC1)CN1S(c(cc1)cc(Cl)c1F)(=O)=O,1 F2758-0469,CN1N=C(CNC(COc(cccc2)c2F)=O)c(cccc2)c2C1=O,1 Z1022366162,Cc(cc1)cnc1NC(CN(C)C(C1CCCC1)=O)=O,1 F6796-9041,CC(C)c1c(CN(C2)CC(C3)C2CN3c(nccc2)c2F)nco1,0 Z7754942160,CN([C@@H]([C@H](C1)C(N(CC2)C[C@H]2N)=O)c2cccc(F)c2)C1=O,1 F6015-0416,Cc1ccc(C)n1CCCC(Nc(cc1)cc2c1OCCO2)=O,1 F0196-0714,O=C1C(c2cc(cccc3)c3o2)=COc2c1cccc2,1 Z4421147698,CN(C(C1)=O)c(cc2)c1cc2S(NC(CC(F)(F)F)c(cc1)ccc1Br)(=O)=O,0 F2898-5130,COC(c(cccc1)c1C(N(CC1OCCC1)c(sc1ccc2)nc1c2Cl)=O)=O,0 Z1554278694,O=C(Nc(cccc1)c1N1CCCC1)N1CC2(CCC2)OCC1,1 F5449-0012,COc(cccc1)c1N(CC1)CCN1C(C(OC=C1OC)=CC1=O)=O,0 F3385-5968,COC(c(cc1)ccc1OC1=COc(c2c(cc3)OCN(Cc4ccco4)C2)c3C1=O)=O,1 F5725-0189,O=C(Cn1c(-c2nccnc2)nc2c1cccc2)NCCc1c[nH]c2c1cccc2,1 Z2607461955,CC(C)(C1)C1(CNC([C@H]1CNCCC1)=O)c1ccccc1,1 L679-0574,Cc1cccc(-n2c(nccc3)c3nc2CN(CC2)CCN2C(Nc2cc(CCC3)c3cc2)=O)c1,0 S824-2251,Cc1cn(CC(N(C[C@@H]2COC)C[C@@H]2c2ccncc2)=O)nc1,1 M339-0051,O=C(C(CC1=O)CN1c1cccc(Cl)c1)Nc1cc(OCc2nnc(-c3ccccc3)o2)ccc1,0 SB39-0418,CCS(N(CC1NC(CC(C)C)=O)CC2(CCCC2)NC1=O)(=O)=O,0 S633-1273,CNC(N(CCC1)C1c1nc(C(C2)CN2C(Nc2ccccc2)=O)no1)=O,1 F6233-0051,CCOc1cc(C(Nc(cc2)ccc2N2N=NN(C)C2=O)=O)cc(OCC)c1OCC,0 8012-6683,Cc(ccc(NC(CN(CC1)CCN1c(cc1)ccc1Cl)=O)c1)c1Br,0 F6573-7614,COc(ccc(Cl)c1)c1NC(N(CCN1c2cnccc2)CC1=O)=O,1 SB20-0034,Cc1ccc(CN2[C@H](Cn3nnc(C(NC4CCCC4)=O)c3)CCC2)o1,1 F6258-2527,CC1=C(C)N=CN(CCNS(c(cc2)ccc2OC(F)(F)F)(=O)=O)C1=O,0 C712-1032,O=C(c1cc(COc2c-3cccc2)c3s1)Nc1nc(cccc2)c2s1,1 Z1238996108,c1cn(-c(cc2)ccc2Oc2nc(-c3cnccc3)nc3ccccc23)nc1,1 F413-0319,Cc1c(CSC(N2Cc3cc(OC)ccc3)=Nc(cccc3)c3C2=O)nc(-c(cccc2)c2OC)o1,0 F6525-7757,COc1ccc(CCNC(NCCn2ncc(-c3cocc3)c2)=O)cc1,1 Z1491221195,Cn1ncc(S(N2CCNCC2)(=O)=O)c1,0 F3294-0361,CC(NC(c(cc(cc1)Cl)c1N1Cc(cccc2)c2OCC=C)C1=O)=O,0 Y207-4739,O=S(c(ccc(F)c1)c1F)(N1CC(CCC2)N2CC1)=O,0 F3386-0117,CC(C)(C)c(cc1)ccc1S(N1CCN(CCO)CC1)(=O)=O,0 F6420-0994,COC1(CNC(NC(c2ccccc2)c2ccccc2)=O)CSCC1,1 6214-0719,CCc(cc1)ccc1OCC(N(Cc(cc1)ccc1N(C)C)C(CC1)CS1(=O)=O)=O,0 S571-0482,O=C(CCC1CCCC1)NCC1(CCC(N2CC3CC3)=O)C2=CCC1,1 Y500-1605,Cn1ncc(NC(c2c3nc(C4CC4)cc(C(F)(F)F)n3nc2)=O)c1C(N)=O,1 G551-0102,CCCC(c1cccn1CC1)N1C(Nc1cc(C)cc(C)c1)=O,0 SB39-0828,CC(C)C(NC(CN(Cc1nc2ccccc2cc1)CC1(CCCC1)N1)C1=O)=O,1 Z2482888157,OC(c1cccnc1CN(CC1)CCC1Oc(cccc1)c1Cl)=O,0 SB70-0977,COCCNC(c1nn(C[C@H](C2)NC(c3n[nH]c(C4CC4)c3)=O)c2c1)=O,1 V022-8400,CCN(C(CN1C(C(C)C)C(NCc2ccco2)=O)=C(C(c2c(C)cc(C)cc2)N2)C1=O)C2=O,1 Z2850025709,Cc1nc(C#N)cc(N(CCC2)C2c(ccc(OC)c2)c2OC)n1,0 SB94-0848,O=C(CCN1CCOCC1)N1CCC(CN(CC(C2)C(NCC3CC3)=O)C2=O)CC1,1 F5490-0005,O=C(c1cccs1)N(CCC1)CC1c1nnc(Cc(cc2)ccc2F)o1,1 SD22-0180,COC1(CC1)C(C1)(CN1C(c1nc2ccccc2cc1)=O)NC(c1ccccc1)=O,1 F3385-5112,CC(C)OC(COc(cc1)cc(O/C2=C\c(cccc3)c3F)c1C2=O)=O,0 L679-0379,O=C(Nc(cc(cc1)F)c1F)N1CCN(Cc(n2-c3ccccc3)nc3c2nccc3)CC1,0 SC77-0964,O=C([C@H](CN(Cc(cc1)ccc1F)C1)[C@@]11OCCNC1=O)NCc1cnccc1,1 Z771183888,O=C(c(cc1)cc(CC(c2ccccc2)O2)c1C2=O)N(CCNC(C1)=O)C1c1ccccc1,1 F3394-0805,O=S(c1cccc2cccnc12)(Nc(cc1)cc2c1OCCO2)=O,1 F924-0245,CCC(C)NC(N(CC1)Cc2c1n1nc(-c(cc3)ccc3Cl)nc1s2)=O,1 F6786-7335,O=S(c(cccc1)c1F)(N1CC(COc(cc2)nn3c2nnc3C(F)(F)F)CC1)=O,1 F2495-0112,CSc(cccc1)c1NC(CC(CSC1=NC=C2)N1C2=O)=O,0 S698-0670,Cc1cnc(C2CC2)n1C(CC1)CCN1C(C1CCOCC1)=O,1 S223-0109,Cc1cc(C)nn1CCC(N1CC2(CCOCC2)C(CN(C)C)C1)=O,1 Z330915892,CC(c(ccc(OCCCN)c1)c1O1)=CC1=O,0 S576-0323,Cc1ccc(CNC(C(CC2)CN2C(C=NN2CC3CC3)=CC2=O)=O)o1,1 Z1738876873,OC(C(C1)CN(CCNS(c(cc(C(F)(F)F)cc2)c2F)(=O)=O)C1=O)=O,0 F6502-2569,Cn1nnc(C(NCCn2c(C3CC3)ncc2)=O)c1,1 F2266-0222,O=C(COc1cc2ccccc2cc1)Nc(cc1)cc(CC2)c1NC2=O,1 F5097-0499,CN(C)C(Cc(cc1)ccc1NC(c(cc1)ccc1C(OC)=O)=O)=O,0 F070-1195,O=C(NC1CCCC1)N(CC1)CCN1c1nc2ccccc2nc1C(F)(F)F,1 Z3480645317,Cc(n(C)nc1)c1S(N(C)C(c1ccccc1)c(cccc1)c1Br)(=O)=O,1 F594-0830,CC1N(CCN(CCC(N2CCNCC2)=O)C(c(cc2)ccc2Br)=O)CCCC1,0 Z812034050,CN(C(C1)Cc2c1cccc2)C(c1c2[nH]ncc2ccc1)=O,1 Z871786366,Cc(cc1)ccc1-c1csc(N2CCNCC2)n1,0 Z3050519298,Cc1c(C(NC2(CCO)CCN(C)CC2)=O)[nH]nc1C(F)(F)F,1 F5479-0207,O=C(Cc(cccc1)c1F)NCCCN1N=CC=CC1=O,1 F6395-4297,O=C(Nc1cccc(C(F)(F)F)c1)N1CC2(CCOCC2)OCC1,0 Z2851563836,CCO[C@H](C[C@@H]1CN(C2)S(C3CCC3)(=O)=O)CN1c1c2cccn1,0 F6775-2396,FC(c1ncnc(N2CC(COc3nccnc3)CCC2)c1)(F)F,0 D330-0866,CCc1c(CC(c(cccc2)c2N2C)C2=O)c(cccc2)c2o1,0 Z2802542022,Cc1c(C(C2)NCCN2C(C(N2)=CC=C(C(F)(F)F)C2=O)=O)cccc1,1 F2290-0394,Cc1nn(C)c(C(Nc2nc(-c3cc(cc(cc4)OC)c4o3)cs2)=O)c1,1 Z1994131582,Cc1c(C)sc2nc(CN3CCCC3)nc(N(CC3)CCN3c3nccnc3C)c12,1 Z2217872123,COc1c(C2(CCCCC2)C(N(CCC2)CC2c2nnc3n2cccc3)=O)cccc1,1 SC77-0162,Cn1c(cccc2)c2nc1CCNC([C@H](CN(Cc1ccccc1)C1)[C@]11OCCNC1=O)=O,1 F537-0187,CC1Oc(ccc(S(N(CC2)CCN2C(c(cc2)cc(F)c2F)=O)(=O)=O)c2)c2NC1=O,0 Z1511703016,O=C(C(C=CC1=NN2)=CN1C2=O)Nc(cc1)cc2c1OCCO2,1 Z924450798,CCC(c1ccccc1)NC(Nc1cnccc1)=O,0 Z875360354,O=C(C1COCC1)N1CCC(Cc2ccccc2)CC1,1 Z1260672568,CC(C)CC(NCCC(NC1CCN(Cc(cc2)ccc2Cl)CC1)=O)=O,0 SA67-0480,CC1(CCCCC1)C(N1CC(CCc2noc(-c3cnccc3)n2)CC1)=O,1 C174-0312,CCCCn1c(cccc2)c2nc1C(C)NC(C)=O,0 F362-0233,CC(CNC(C(CC1)CCN1c(cc1)nnc1Sc(cc1)ccc1Br)=O)c1ccccc1,0 Z1934714989,CC(C1)OC2(CCOCC2)CN1C(CCc1nc(-c(cc2)cc(C)c2F)no1)=O,1 F6186-1268,CC(CCSC)(CNS(c(cc1)c(C)cc1OC)(=O)=O)O,0 8009-0075,CC(C)=C1C(C2C(N3c(cc4)cc(C(O)=O)c4Cl)=O)C=CC1C2C3=O,0 Z1236572107,CC(c(cc1)cc2c1OCO2)NC(N1CCN(Cc2nccn2C)CCC1)=O,1 F6178-4375,CCSc(cccc1)c1C(NCC(CC1)CCN1c1ncccc1C#N)=O,0 Z5001699731,C[C@H](CC1)CC[C@@H]1NC(c(cccc1)c1SCc1csc(Cl)n1)=O,0 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SA72-1245,COCCC(CC1)(CCN1S(N1CCOCC1)(=O)=O)c1noc(-c2cnccc2)n1,1 P619-0211,CN(c(nccc1)c1Oc(cc1)c2cc1S(NC1CCCCCC1)(=O)=O)C2=O,1 Z2046679002,CS(NCC(CCC1)CN1C(c(cc1)cc2c1C=CCC2)=O)(=O)=O,0 Z1919519403,O=C(Nc1cc([nH]cc2)c2cc1)N1CCCCCCC1,1 Z3403576563,Cn1ncc(NC(NC2(CO)C(CC3)CCC3C2)=O)c1,1 Z3026726226,CC(CCC1)CN1C(c1nn(C)c(Cl)c1C(F)(F)F)=O,0 Y042-2409,CC(N1CCCC(NC(Cc2ccccc2)c2nc(cccc3)c3n2C)=O)=CC(O)=CC1=O,1 F6178-0837,O=C(C(Nc(cccc1)c1Cl)=O)NCC(CC1)CCN1c1nccnc1,0 E852-1363,CCN1CCN(CCNC(c2nn(CC(C)(C(NCc3ccccc3)=O)N(C)C3=O)c3c2)=O)CC1,1 SD67-0613,Cc1c(C(N(CCC2)CC(C(N(Cc(cc3)ccc3F)C3)=O)N2C3=O)=O)sc(C)n1,1 F6752-4716,CSc(nc1)nc(N2CC(C(N3CCCCC3)=O)OCC2)c1C#N,0 SA92-0877,Cn1ncc(CN(CCC2)CC2(c2nc(C3CC3)no2)F)c1,0 F6452-2225,COC1(CNC(COc(cc2)ccc2Cl)=O)C2CC(C3)CC1CC3C2,1 Z1705194459,Cc1cc(Cl)c(CC(N(CC2)CCN2S(c2nnc[nH]2)(=O)=O)=O)cc1,0 Z3075956635,FC(c1nc(N(CCC2)C2C2CCC2)c2nc[nH]c2n1)(F)F,1 Z251176348,O=C(c(cc1)cc2c1[nH]nn2)NCC(c(cccc1)c1Cl)N1CCCC1,1 F6564-3309,Cc(cc1)nnc1N(CC1)CCN1C(CN1N=C(C2CC2)C=CC1=O)=O,1 Z4912576386,CC(C)(C)c(cc1)ccc1N(C)C(c(cc1)ncc1NC)=O,0 V001-7683,CC(C)C(C)N(Cc(cc(cc1)NC(C2CCCC2)=O)c1N(C)C)C(C(C)(C)C)=O,0 F438-0392,Cn1c(cccc2)c2c(CN(CC2)CCN2C(CCCN(C(c2c3cccc2)=O)C3=O)=O)c1,1 Z989234360,CCCN(CC1)CCC1Nc1c(C(F)(F)F)cc(-c2ccco2)nn1,0 Z1260950044,O=C(C(CCC1)CN1C(N(CC1)Cc2c1scc2)=O)N(CCC1)CC1N(CCN1)C1=O,1 F6296-1240,Cc(cc(cc1)OC)c1S(NCc1cc(-c2ccncc2)nn1C)(=O)=O,1 F2898-5747,O=C(CN(C(CC1)=O)C1=O)N(CC1OCCC1)c1nc(c(C(F)(F)F)ccc2)c2s1,1 F6709-4822,Cc1nccc(OC(C2)CN2C(c(cc2)cnc2OC2CCCC2)=O)c1,1 Z1822932304,CC(N(C1)CC1C(NCc1cc(N(C)C)ccc1)=O)=O,0 F6523-0161,Cc1nc(C(F)(F)F)cc(N(CC2)CCC2NC(c(cc2)cc3c2ncs3)=O)n1,1 E715-0606,CC(CC(C)C1)CN1C(C(CC1)CCN1c1ncnc2c1nc1n2CCCCC1)=O,0 SA65-1114,O=S(c(cc1)ccc1F)(N1CCC(CCc2noc(C3CCOCC3)n2)CC1)=O,0 Z1603760807,CC1(COCC1)NC(c1cc(C(O)=O)ncc1)=O,1 V004-9622,CCC(C)c1nc(N(CC2)CCN2C(NC(C)C)=O)c(Cc(cccc2)c2F)c(CC)n1,0 T505-0989,O=C(CN(c(cccc1)c1O1)C1=O)N1C(CCn2nnc(C(N3CCOCC3)=O)c2)CCCC1,1 S737-0013,COc1cccc(CC(N(CC2)CC(C(N3C4CC4)=O)N2CCS3(=O)=O)=O)c1,0 Z2768784370,Cc(cc1)ccc1OCc1nnc(C2)n1CCC2C(OC)=O,0 Z1495774257,CC(C)(C)NC(c1cc(NC(C2Cc3cncn3CC2)=O)ccc1)=O,0 Z934180372,NCC1CN(Cc2cccc(Oc3ccccc3)c2)CC1,0 Y031-4099,O=C(C(C1)CN(C2CCCC2)C1=O)Nc1nnc(Cc2ccccc2)s1,1 F5772-8598,COc1cc(NC(Nc(cc2)ccc2-c2nc(cccc3)c3o2)=O)cc(OC)c1OC,0 7282-5795,CN(c1c(C(N2C)=O)n(Cc3cccc(Br)c3)c(N3CCOCC3)n1)C2=O,1 F5250-1073,COc(cc1)ccc1-n1nnnc1CN(CC1)CCN1C(c(c(F)ccc1)c1F)=O,0 F5852-1469,Cc(ccc(NC(C(NCCOc(cc1)ccc1F)=O)=O)c1)c1Cl,0 Z352783786,CC(CC(O)=O)c(cc1)ccc1OC(F)(F)F,0 Z3016325333,CC(CNC(c1c(N[C@@H](C)C[C@H]2C(F)F)n2nc1)=O)N(C)C1CC1,1 S699-1041,CN(CCc1noc(C(C2)CN2S(c2cccs2)(=O)=O)n1)C(C1CCOCC1)=O,1 Z1768797034,Cc1nnc(-c2cccc(C(N(C)CC3(CCOCC3)O)=O)c2)o1,1 Z3714264668,C[C@H](C1)O[C@@H](C)CN1C(CC1)CCN1C(c(c1n2)cccc1ccc2O)=O,1 Z1538548295,O=C(c1cc(-c2ccncc2)nc2ccccc12)NCC1OCC(CCCC2)N2C1,1 P314-0217,Cc(cc1)ccc1N(CCC1NC(Cc2cc(OC)ccc2)=O)C1=O,0 F5852-1482,Cc(ccc(NC(C(NCCc1cccs1)=O)=O)c1)c1Cl,0 Z423928870,Cc(cc1)cc2c1[nH]c(C(N(CC1)Cc3c1n(-c1ccccc1)nc3)=O)c2,0 F6424-0741,CN(C(C=C1)=O)N=C1c(cccc1)c1NC(c1ccc(Cn2cncc2)cc1)=O,1 G856-2373,O=C(NC(CC1=O)CN1c(cc1)cc2c1OCCO2)Nc1nccs1,1 F6389-1038,O=C(c1nccc(-n2cncc2)c1)N(CCC1)c2c1cccc2,1 F6439-5105,O=C(CSCc1ccccc1)NCCn(cc1)nc1-c1cccs1,1 Z5020305469,CCn1nc(C)c(-c2ccc(cc(cc3)O)c3c2)c1C,0 J031-2321,O=C(CSc1nnc(-c(cc2)cc3c2OCCCO3)n1C1CC1)c(cc1)cc2c1OCCC2,1 F6215-0278,Cc1noc(CCNC(c(cc2)ccc2OC(F)(F)F)=O)c1,0 Z2433801469,NC(CC(NCC(C1)COc2c1cccc2)=O)c1ccccc1,1 Z3000778287,CC(CN(C(Cc1nocc1)=O)c1c2)Oc1cc(F)c2F,0 Z1376169484,CCc1c(CC)nc(cc(cc2)C(N(CC3)CC4(CCCCC4)S3(=O)=O)=O)c2n1,1 Z611403086,Cc(cccc1)c1S(NC(C1OCCOC1)=O)(=O)=O,0 S776-0093,Cc1cnc(C2CC2)n1CCC(CC1)CCN1C(c1c(C)nco1)=O,1 Z3686921625,CN(C)c1cc(N(C2)[C@@H](CNC(CCc3ccncc3)=O)C[C@H]2O)ncn1,1 G340-0800,O=C(C(CCC1)CN1c1nc(cccn2)c2s1)Nc(ccc(Br)c1)c1F,1 SC72-0369,CCn1nccc1C(N(C1)CC11OCc2c1cnc(C1CC1)n2)=O,1 F6515-3992,O=C(c1cccc(Br)c1)NCc1cncc(-c2cnccc2)c1,0 Z1528684725,CC(C)(CCC1)CCN1C(COc1cccc(C(NC)=O)c1)=O,0 V027-5923,CC(C)c1ccc(C2N(Cc(cccc3)c3O)CCCn3c2ccc3)cc1,0 2613-0035,CN(Cc1ccccc1)CC#CCC(C1CCCC1)(c1ccccc1)O,0 F2378-0849,O=C(C(CCC1)N1S(c(cc1)ccc1Cl)(=O)=O)Nc1nc(CCC2)c2s1,1 F6677-0770,CC(C)c1nccn1CC(C1)CN1S(c(cccc1)c1Br)(=O)=O,0 F6656-3215,Cc1noc(C)c1CN1CCC(COc2nnc(C3CC3)cc2)CC1,1 F6435-9095,COC(CSC(CC1)CN1C(c1nc(cccc2)c2s1)=O)=O,0 Z1365731386,CC(CCC1)N1c1nc2ccccc2c(C(N)=O)c1,0 Z2774711957,CNC(C(CC1)CN1S(CC1C(CC2)CC2C1)(=O)=O)=O,1 E786-1993,CC(CNS(c1ccc(CN(C(c2c3nccc2)=O)C3=O)s1)(=O)=O)c1ccccc1,1 Z2325800787,CCC(C1CCCC1)NC([C@@H](C1)[C@@H](c2cnccc2)N(CC)C1=O)=O,1 C608-0034,CC(c1ccccc1)NS(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,0 Z406533360,CC(C)Oc(cc1)ncc1C(N(CC1)CCN1C(C1OCCC1)=O)=O,1 Z2290115301,COC([C@H](CN(C1)C(NCc2cnccc2)=O)[C@H]1c1ccccc1)=O,0 Z4780408747,CC(C)C(Cc1ccccc1)NC(C(Nc1c2ccc(C)c1)NS2(=O)=O)=O,1 S720-2262,NC([C@H](C[C@@H](C1)Oc2ccccc2)N1C1CCCCC1)=O,1 Z3686324402,CCN(c(cccc1)c1N=C1N[C@@H](CC(Cn2cncc2)C2)[C@H]2O)C1=O,1 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F6064-0315,Cc1noc(C2CN(Cc(cc(cc3)Br)c3F)C2)n1,0 Z4119276216,Cc(cc(cc1)C(NCCc2nn(-c3ccccc3)nc2)=O)c1F,0 L679-0200,COc(cc1)ccc1NC(N1CCN(Cc2nc3cccnc3n2-c(cc2)ccc2F)CC1)=O,0 F2146-0639,Nc1c(CCC2)c2nn1-c1nc(cccc2)c2s1,1 F6514-2400,O=C(Cc1c[nH]c2c1cccc2)NC(C1CCOCC1)c1cnccc1,1 F5140-0427,CS(N(CCC1)CC1C(Nc(cc1)cc2c1OCCO2)=O)(=O)=O,1 Z2277725710,CCc1cccc(C(N(CC2)c(cc3)c2cc3F)=O)n1,0 F6520-0062,O=C(c(c(F)ccc1)c1F)NCCc1ccc(-c2cccs2)s1,0 G511-0347,CC(C)CC(Nc1cc(N(CCC2)C(C(C)C)=O)c2cc1)=O,0 Z4099686629,COc(cc1)nn2c1nnc2CNC(C1OCCO1)=O,1 F6446-1254,CC(Nc1ccc(CC(NCC(CCC2)CN2c2nccs2)=O)cc1)=O,0 Z1245779765,Cc(cc1)ccc1S(N(C[C@H](C1)O)[C@@H]1C(O)=O)(=O)=O,0 F2496-0605,COc1cccc(-c2cc(COC(COc(cccc3)c3F)=O)no2)c1,0 S993-0656,CC(C)CN(CC(N(CC1)C2CCN1C(c1cccn1C)=O)=O)C2=O,1 G603-0064,Cc(cc1)ccc1S(N(CCC1)CC1c1nc(-c2cccc(Cl)c2)no1)(=O)=O,0 Z146825394,CN(C)S(c1cc(C(NCC(Nc2cc(C(NC3CC3)=O)ccc2)=O)=O)ccc1)(=O)=O,1 F6550-4966,O=C(c(ccc(F)c1)c1Cl)N(C1)CC1Nc1nccnc1,0 S497-1339,Cc(cccc1)c1S(N(C1)CC1Oc(cccc1)c1-c1nc(CCOC)no1)(=O)=O,0 5055-7465,Cc(cc1)c(C)cc1-c1csc2ncnc(NCCc(cc3)cc4c3OCCO4)c12,1 Z1899854830,CCC(C)(C)NC(CN1N=C(C)SC1=O)=O,0 F6562-8204,O=C(COc1cc2ccccc2cc1)NCC1c(cccc2)c2OC1,1 F1813-0615,COc(cc1)c2nc(NC(C3CC3)=O)sc2c1OC,0 V013-4181,O=C(C1CCCC1)Nc(cc1)ccc1N(CCCN1Cc(cc(cc2)F)c2F)C1=O,1 Z2997036952,COC1(CCC1)c1noc(C(CCN2Cc3ccccc3)C2=O)n1,1 SC09-0134,C[C@@H]1N(Cc2cc(C)nn2C)Cc(cc(cc2)-c(cc3)ccc3F)c2OC1,0 S831-2216,CCn1ncc(C(N(C[C@@H]2COC)C[C@@H]2c2ncccc2)=O)c1C,0 Z1546867311,Cc1c(C)nc(N(CCC2)CC2Nc2ccccc2)nc1,0 F0630-1722,O=C(COc(ccc(Cl)c1)c1Cl)N1C(SCc2cnccc2)=NCC1,1 Z1240834133,O=C(CCn1nccc1)NCC(CC1)CCN1C(c1ccccc1)=O,1 Z2686946223,O=C(c(cccc1)c1Br)NC1C(CC2)NCC2C1,1 Z2796342882,COc1ccc(CN(CC2)C2C(N(CC2)Cc3c2[nH]nc3)=O)cc1,1 J006-0783,Cc1noc(C)c1C1N(Cc2c[nH]nc2-c2cccs2)CCC1,0 Z3403730859,Cc1noc(C(CCC2)N2S(CC2CC3(CC3)C2)(=O)=O)c1,1 F6734-1318,O=C(NC1CCOCC1)N(C1)CC(C2)C1CN2c(cc1)ncc1Br,1 F6518-4509,COCCNC(N(CC1)CC1c(cc1)cc2c1OCO2)=O,1 F3382-2848,O=C(CSc1ncc(-c2cccc(Cl)c2)o1)Nc(cc(cc1)F)c1F,0 F6773-3025,Clc1c(CN(CC2)CCC2Oc2nccs2)cccc1,0 F2236-1140,CCOc(cc1)ccc1C(C=C1)=NN(CCNC(C2=CC=CN(C)C2=O)=O)C1=O,1 SB36-0655,CCn1ncc(C(N(C2)[C@H](Cn3nnc(C(N4CCOCC4)=O)c3)CC2(F)F)=O)c1C,0 S296-1898,CN(C([C@H]1[C@@H]2CN(Cc3c(cc[nH]4)c4ccc3)C1)=O)C2=O,0 Z2183890920,COCC1(CSc2nc(ncnc3)c3[nH]2)CCC1,0 1959-0141,Fc1ccc(C(C2C3C=CC2)Nc(cc2)c3cc2Cl)cc1,0 Z3216016717,CC(C)S(CCCN(C=C(c1c2ccs1)Cl)C2=O)(=O)=O,0 F1872-0468,O=C(CSc1nccn1-c1cc(C(F)(F)F)ccc1)Nc(cc1)cc2c1OCCO2,1 Z1915842667,CC(C)n(c1nc(C)c2)ncc1c2C(N1CC(C(C2CC2)=O)OCC1)=O,1 Z2683367788,COc(cc1)c(CN2[C@H](CCC3)[C@H]3OCC2)cc1C(O)=O,1 F6524-4773,COc1nccn2c1nnc2CNC(CSCc1ccccc1)=O,1 Z2290599440,O=C(Nc(cc1)ccc1-n1nnnc1)N1C(CC2CCC2)COCC1,1 Z1498221772,Cc(cc12)ccc2ncnc1NCc(nccc1)c1F,0 S827-1849,O=C(CN1CCOCC1)N(CC(C1)(F)F)[C@@H]1c1nc(C2CC2)no1,1 SB16-0980,CCS(N1[C@@H](CCN(C2)C(c3cscc3)=O)[C@@H]2COCC1)(=O)=O,1 F2736-4566,CN(CC(N(CCCN1CCOCC1)c1nc(c(F)ccc2)c2s1)=O)S(C)(=O)=O,0 Z1230400296,O=C(CN(CC1)CCC1c1c[nH]c2c1cccn2)N1CCCCC1,1 S812-2843,CCC(c1nccn1CCC1)N1C(c1ccc(Cn2ncnc2)o1)=O,1 Z2573504000,CCC(C(O)=O)N(CC1)CCC1C(NCc1ccccc1)=O,0 Y041-5251,OC(CCCC1)(CC2)C1CN2C(CN(C(C=C1)=O)N=C1c(cc1)ccc1Cl)=O,1 F6708-9689,Cc(cn1)cnc1OC(CC1)CCN1C(CCC(F)(F)F)=O,0 Z437630136,CN(CC(C1)C(Nc(cc2)cc(F)c2Cl)=O)C1=O,0 L567-0048,CC(C)c(cc1)ccc1S(N(CCC1)CC1(C)C(NCc(cc1)ccc1OC)=O)(=O)=O,0 F6200-3762,COc1ccc(CCS(NCC(C2CC2)(c2ccccc2)O)(=O)=O)cc1,1 Z1084808134,CN(C)C(CCC1)CN1C(Nc1nccs1)=O,0 Z4561574077,CN(C)c1ccc(C2(CC2)C(NC2c(cccc3)c3OC3(CCCC3)C2)=O)cc1,1 E591-0381,CC(CCc1ccco1)NC(CCc1nnc(cc2)n1nc2N1CCCC1)=O,1 Z1038258716,CCn1nc(C)c(C(NCCN2C(C)CCCC2)=O)c1C,1 F6597-0604,Cc1ccc(C(N2CCC(COc3ncccc3C)CC2)=O)s1,1 Z2795723258,CCc1nn(C)c(C(N(CC2)CCN2c(cccc2)c2Cl)=O)c1,0 F6809-5675,N#Cc1cccc(N(CC2)CCN2c(cc2)ccc2Br)n1,0 CM3471-4209,CC(C)CC(c1nccn1CCC1)N1C(CN(CCC1)C1=O)=O,1 F2585-0134,CC(N1)=CC(SCc2cc(F)ccc2)=NC1=O,0 F6713-1348,CC(C)(C)C(C=C1)=NN(C(CC2)CCN2C(CN(C=NC(C)=C2C)C2=O)=O)C1=O,1 F1800-0089,CCCCc(cc1)ccc1NC(CN(C(C(C)SC1C)=O)C1=O)=O,0 F6724-3827,CC(CNc1ncnc2c1cnn2C)(c(cccc1)c1F)OC,0 F5033-1037,O=C(Cc(cc1)ccc1F)NCC1CCN(Cc2cscc2)CC1,0 F0048-0023,CC(C)(C)c1csc(NC(C2(CC(C3)C4)CC4CC3C2)=O)n1,1 E679-0661,C(c1ccccc1)N(CC1)CCN1c1ncnc2c1nc1n2CCCCC1,1 Z2079445123,O=C(C(CC1=O)CN1c1c[nH]nc1)N1CCC(CC(F)(F)F)CC1,1 SB11-0219,OC(Cn1nnc(C(N2CCOCC2)=O)c1)(CC1)CCN1C(NC1CCCC1)=O,1 Z1869966492,COc(cc(cc1)C(Nc2cc(CC(O)=O)ccc2)=O)c1Cl,0 Z2603111723,O=C(CN(CC1)C1c(cc1)ccc1F)Nc1nc(CCC2)c2s1,1 Z632-3195,CCc1cccc(NC(N(CCC2)C2c2noc(C)c2)=O)c1,0 Z2381150549,CC(C)(CC1)CC1Sc1nnc(CN(CCCCC2)C2=O)n1-c1cnccc1,0 K263-0454,CCC(C(NC1CCCC1)=O)SC(N(CCCOC)C1=O)=Nc2c1sc1c2cccc1,1 Z1842469077,CC(c1nncn1CC1)N1C(c1cn(-c(cccc2)c2F)nc1)=O,0 F3406-5065,Cc(cc1)ccc1OC(C1=NN2CC(NCCC3=CCCCC3)=O)=NC=CN1C2=O,1 SC08-0011,Cc1cc(C(N(C2)CC2c2nc(C(CC3)CCN3S(C)(=O)=O)no2)=O)no1,1 S787-0892,O=C(CCc1ccc(CC(CC2)CCN2C(C2COCC2)=O)cc1)NC1CC1,1 Z2331138019,CCCN(CC(C1)C(N(C)Cc2nocc2)=O)C1=O,0 F6807-5353,COc1cc(CCN(C2)c(nccc3)c3Br)c2cc1OC,0 F6673-4954,Cc1c(CN(CCC2)CC2N(C)c2ncc(C)cn2)sc(C)n1,1 E223-0139,CC(Cn(c1c2)nc2-c2cccs2)(C(NC2CCCCC2)=O)N(Cc(cccc2)c2Cl)C1=O,0 F707-0204,Cc1nnc(cc2)n1nc2N(CC1)CCC1C(NCc(cc1)ccc1SC)=O,0 F6549-4242,Cn1ncc(C(CCCC2)N2C(c2nc3ccccc3nc2)=O)c1,1 Z1579051455,Cc1noc(C)c1CCNS(c(cc1)cc2c1OCCC2)(=O)=O,1 F153-1289,CCc(ccc(C(C1=C2CCCC1)=NNC2=O)c1)c1S(Nc1c(C)ccc(C)c1)(=O)=O,0 Y031-6500,CC(Cc1nnc(NC(C(CC2)CCN2C(N(C)C)=O)=O)s1)c1ccccc1,0 F3374-0113,CCOC(c(ccc1nc(C)c2)cc1c2NC(COc1ccccc1)=O)=O,0 F2740-0134,Cc1cc(cccc2)c2n1CCNC(Nc1c[nH]c2c1cccc2)=O,1 F6524-5875,Cc1c(C(NCc2nnc3n2cccc3C(F)(F)F)=O)c(C)nn1C,0 F6805-9104,Cc(cncc1)c1OCC(CC1)CCN1c(nccc1)c1Br,0 Z923982876,CC(c1ccco1)N(C)S(c(cc1)cc(CCC2)c1NC2=O)(=O)=O,0 F1899-2279,O=C(CSc(cc1)nnc1-n1nccc1)Nc(cc(C(F)(F)F)cc1)c1Cl,0 Z2234647360,Cc(cc1)c(C(F)(F)F)cc1S(Nc(c(O)ccc1)c1Cl)(=O)=O,0 SB36-0623,O=C(Cn1cncc1)N(C1)[C@H](Cn2nnc(C(N3CCOCC3)=O)c2)CC1(F)F,1 SC15-0501,Cc1cc(C(N2CCC(CN(CC(COC)C3)C3=O)CC2)=O)c(C)n1CCCOC,1 Z2595686369,OC(C(c(cccc1)c1Br)NC([C@@H]1[C@@H]2[C@H]1COC2)=O)=O,1 F6550-3020,O=C(CCc1ccc(C(F)(F)F)cc1)N(CC1)CCC1=C1CC1,0 F5493-0339,Cc1noc(C)c1CCC(N(CCC1)CC1c1nnc(-c(cccc2)c2F)s1)=O,1 F2076-0394,Cc1nc(ccc(S(N(CC2)CCN2c2nc(N3CCOCC3)cc(C)n2)(=O)=O)c2)c2s1,1 F6357-0370,Cc1cccc(NC(C(NCC2(CCOCC2)c2cscc2)=O)=O)c1C,1 Z1217758272,CCc1nn(C)c(NC(c2c[nH]nn2)=O)c1,0 F3007-0052,COc(cc1)ccc1Nc1nc2ccccc2c(N2CCCC2)n1,1 F6658-3970,CC1=C(C)N=CN(CC(N(CCC2)CCN2c(cc2)nn3c2nnc3C2CCC2)=O)C1=O,1 Z1203969996,CC(CC1CCCC1)C(NC1(CCCCC1)c1noc(C)n1)=O,1 Z3900777594,CCNc1ccc(CNc2nc(C(C)(C)C)ncc2)cc1,0 Z3268509850,CC(C)c1c(C(NCc(cc2)cnc2N)=O)ncs1,0 F6374-3618,O=C(c1nc(cccc2)c2s1)N1CCC(CSC2=NCCS2)CC1,1 Z4872408271,CC(N(CC1)C(CC(N[C@@H](CC(OC)=O)c2cc(Cl)cc(Cl)c2)=O)c2c1cccc2)=O,0 F6663-1224,O=C(c(ccc(F)c1)c1Cl)N1CCSCC1,0 Z1676302362,CC(C)(c1cnc(C)cc1)NC(c1c2nc(C)ccn2nc1)=O,0 S613-0756,Cc1cc(C)nn1CC(N(CCC1)C1c1nc(CCOCC2CC2)no1)=O,1 F6556-7776,CC(Cc1cc(cccc2)c2o1)NS(c1cn(C)nc1)(=O)=O,1 G756-0966,CC(C=CN12)=CC2=NC(COc(cccc2)c2NC(Nc(cc2)cc3c2OCCO3)=O)=CC1=O,0 F6293-0411,Cc1csc(C(NCc2nn(CCOC)c(-c3ccco3)c2)=O)c1,0 Z1147999214,Cc1cc(N(C(c(cc2)c3cc2C(N(CC2)CC2c(cccc2)c2F)=O)=O)C3=O)c(C)cc1,0 Y031-2842,O=C(C(CC1=O)CN1c(cc1)ccc1F)NCCN1CCOCC1,0 SA92-0712,O=C(c1nccnc1)N(CCC1)CC1(c1nc(C2CC2)no1)F,1 Z2256302799,OC(c1cn(-c2cc(NC(CC3C=CCC3)=O)ccc2)nn1)=O,1 S892-0751,CCn1nc(C(CCCC2)N2C(COc(cc2)ccc2F)=O)c2c1CCOC2,1 F6549-7796,CC(c(cc1)ccc1S(N(C(CC1)C2)C1CC2n1ncnc1)(=O)=O)=O,1 F5284-0074,O=C1N(CCNS(CCc2ccccc2)(=O)=O)N=CC=C1,1 Z1919867643,NC(CN(CC1)Cc2c1ccc(NC(CN(CCc1c3cccc1)C3=O)=O)c2)=O,1 F2334-0018,O=C(CN(C1=O)N=C(N(CC2)c3ccccc3)N2C1=O)N(CC1)c2c1cccc2,1 Z4131962189,O=C(Nc1nn(Cc2cccc3cccnc23)cc1)Nc1ncnc2ncccc12,1 SA93-0960,COCCC(CCC1)(CN1C(CC1)CCN1C(Nc1cc(OC)ccc1)=O)C(N)=O,0 Z2768785425,COC(C(CC1)CCn2c1nnc2Cc1ncccc1)=O,1 F6764-3269,CC(C)S(c1ccc(CC(N2Cc3cc4cccnc4nc3CC2)=O)cc1)(=O)=O,0 G795-0048,O=C(c1nsc2c1cccc2)Nc(cc1)ccc1C(NC(CC1)CS1(=O)=O)=O,1 Z1900734542,FC(c1nc(-c2cnccc2)nc(N(CC2)CCC2Oc2nccnc2)c1)(F)F,1 Y070-0783,O=C(CC1N(C(c(cccc2)c2Cl)=O)c(cccc2)c2NC1=O)Nc(cc1)ccc1Br,1 SD69-0416,CC(C)C[C@@H](Cn1nnc(C(N(CC2)c3c2cccc3)=O)c11)NC1=O,1 Z1553129506,Cc1c(C(COCC2)N2C(CN(Cc2c3cccc2)C3=O)=O)c(C)n[nH]1,1 Z2761535684,O=C(Cn1ncc(Cl)c1)NCc(ccnc1)c1O[C@@H]1CNCC1,1 F6764-3274,O=C(Cc1noc2c1cccc2)N1Cc2cc3cccnc3nc2CC1,1 Z5009980394,CC(C)(C)NS(c1cnc(NC(C(CCN2C)CC2=O)=O)s1)(=O)=O,1 S439-0643,Clc1c(C2OCc3c(-c4noc(COc5ccccc5)n4)nnn3C2)cccc1,1 S841-0119,C(c1ccccc1)N(CC1)CC1c1nnc2n1CCN(Cc1cccnc1)CC2,1 F6789-2529,O=C(c(cc1)nn2c1nc(C1CC1)c2)NCc(cccc1)c1F,1 F6562-0871,CC(C(N(CC1c2cn(C)nc2)Cc2c1cccc2)=O)Oc(cccc1)c1F,1 Z4022218410,CCC(C1)(C2)CC12C(Nc1cc(C(C)C(OC)=O)ccc1)=O,1 Z2962763643,COc1ccc(C(C2CCC2)NC(c2nn(CCCO3)c3c2)=O)cc1,1 F6542-5816,Cn1c(CN(CC2)CCC2c2cccs2)nnc1,1 V022-4434,Cn(c(Oc(cc1)ccc1Cl)c1CN(CC(Cc2ccccc2)O)C2CC2)nc1-c1ccccc1,1 Z4464308380,CC(NCC(N(CC1)CC1N(C)c1cc(C2CC2)nc(S(C)(=O)=O)n1)=O)=O,1 Z1550852875,O=C(c(cc1)ccc1-c1nc(C2CC2)no1)N(CCCC1)C1C(C1)CNC1=O,1 F6111-2066,Cc(ccc(NC(CN1CCC(COCc(cc2)ccc2C#N)CC1)=O)c1)c1Cl,0 F1174-2120,O=C(CSc1nnc2sc(cccc3)c3n12)c(cc1)ccc1F,1 F6438-0469,CCOc(nc1C)nc(C)c1NC(Nc(cc(cc1)Cl)c1OC)=O,0 Z51815019,Cc(cc1)c(C)cc1-c1nn(Cc2ccccc2)cc1C(NCCOC)=O,0 Z30172614,CC(c(cc1)ccc1-c1ccc(C(NCc2cnccc2)=O)o1)=O,0 Z3610621898,Cn(cc1)cc1C(Nc1ccc(C(C2)OCCN2C(c2cn(C)cc2)=O)cc1)=O,1 F6245-3469,CN(C1=O)N=C(C(CC2)CCN2C(C2CC=CCC2)=O)N1c1ccccc1,1 S233-1984,CCCN([C@H](CCC1)[C@]1(CNC(CCc1c[nH]c2c1cccc2)=O)CC1)C1=O,1 7294-0805,CC(CC1)CCN1c(oc(-c1cc(OC)ccc1)n1)c1S(c1ccc(C)cc1)(=O)=O,0 Z1975208938,CC(CC(N[C@@H](CC1)C[C@@H]1C(N1CCCCC1)=O)=O)n1nc(C)cc1C,1 Z1159343289,Cc1c(CN(C)S(c2cn(-c3ccccc3)nc2)(=O)=O)scn1,0 SA49-0431,O=C(Cc1cnccc1)N(C1)CC11OCC(CC(N2CCOCC2)=O)C1,1 S699-0583,CCn1ncc(C(N(C2)CC2c2nc(CCN(C)C(C3CC3)=O)no2)=O)c1C,1 Y040-0769,Cc1cc(OCC(c(cc2)ccc2Br)=O)c(C(CCCC2)=C2C(O2)=O)c2c1,0 Z444126444,CN(C)c(nccc1)c1NC(CN(CCC1)C1=O)=O,0 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SB17-0743,CC(C)NC([C@@](CC1)(CN(CC2)C(COc3ccccc3)=O)[C@@H]2N(CCOC)C1=O)=O,1 F6166-0266,CC(C(N(CC1)CCN1c1ncnc(-c2ccccc2)c1)=O)N(C(C=C1)=O)N=C1c1cccs1,1 Z3464417128,OC(C1(CCN2CC1)CS2(=O)=O)=O,1 Z2909748088,OC(CC(CC1)CCN1C(CCc(cc1)ccc1O)=O)=O,0 F0719-0213,CC1CCN(CC(COc(cc2)c(C)cc2Cl)O)CC1,0 Z3140096048,CN(Cc1nn(C)cc1)C(C1NCCOc2c1cccc2)=O,1 F6442-0990,COc(cc1)ccc1S(C(C1)CN1S(c(cc(cc1)Cl)c1OC)(=O)=O)(=O)=O,0 F6510-3722,Cc(c(NC(c1c(C(F)(F)F)cccc1)=O)c1)cc(N2C)c1N(C)S2(=O)=O,0 F0191-2592,Cc1nccn1S(c1c(C)cc(C)cc1C)(=O)=O,0 F5782-0126,Cc1c(C(NCC(CC2)CCC2c2nc(cccc3)c3[nH]2)=O)sc(-n2cccc2)n1,1 Z1754148201,Cc1nnc([C@@H](C[C@@H](C2)OC)N2C(C2=Cc(cc(cc3)F)c3OC2)=O)o1,0 G856-1562,COc1cccc(-c2nnc3sc(CN(CC4)c5c4cccc5)cn23)c1,0 F6560-3047,O=C(C1OCCC1)NCc1cn(-c2cccs2)nn1,1 Z1212591146,Cc1c(C2(CCOCC2)C(NC2CN(CCN3CCOCC3)CC2)=O)cccc1,1 F6561-5846,Cn1ncc(-c2nccc(CNC(C3(CCCC3)c(cc3)ccc3Cl)=O)c2)c1,1 F1067-0242,CCc(c(OCC(O)=O)c1)cc(C2=O)c1OC(C)=C2Oc(cccc1)c1F,0 Z2451816055,CC(C)c(ncnc1)c1C(N(C[C@H]1c2ccccc2)C[C@H]1N)=O,1 SA57-0243,Cc1cc(C(N(CC2)CCC2(C2)OCCC2Oc2nccnc2)=O)c(C)o1,0 Z750588354,O=C(c1cc(C(NC(N2)=O)=O)c2nc1)N1C(CCc2ccccc2)CCC1,1 P207-8872,CC(CC1)CCN1C(c1cc(CC(CC2)C(O)=O)c2s1)=O,0 F0777-1879,CCc(cc1)ccc1S(N(CC)c1ccccc1)(=O)=O,0 8020-2135,NC(C(CC1)CCN1C(N1)=NC(NC(C2CC(Nc(cc3)cc4c3OCCO4)=O)=O)=C2C1=O)=O,1 F0841-0020,Cc(cc1)ccc1S(N(C)c(cc1)ccc1OCC(N1CCOCC1)=O)(=O)=O,1 Z3091703803,CCCc1cc(C(NC2(CO)C(C)(C)CCC2)=O)no1,0 G008-3516,Cc1noc(-c(cc2)cc(S(N(CC3)CC3c3ccccc3)(=O)=O)c2OC)c1,0 Z1080673522,CC(C)CN(CC(O)=O)S(c(cc(cc1)F)c1F)(=O)=O,0 Z3059444504,C[C@@H](C(NC)=O)N(C)C(Cc1cn(cccc2)c2n1)=O,0 Y600-4600,CN(c1c(-c2c3ccs2)nc(Nc2ccc(Cn4ncnc4)cc2)nc1)S3(=O)=O,1 D347-3822,CCC(N(CCC1)C1c1nc(cccc2)c2n1CCC(C)C)=O,1 V030-3088,CCc(c(CN(CC(Cc1ccccc1)O)CC1CC1)c1Oc(cccc2)c2OC)nn1-c1ccccc1,0 F6216-0244,Cc1noc(CCCNC(c2cscc2)=O)c1,1 S625-0099,Cc1noc(C)c1C(N1Cc2nnc([C@H](C3)N(C)C[C@@H]3O)n2CC1)=O,1 Z3062022988,Cc1c(CN(C[C@H]2CNC(C3CC3)=O)C[C@H]2c2cncn2C)cccn1,1 F6678-8904,Cc1nc(cccc2)c2n1C1CN(Cc2ccnc3ccccc23)C1,1 F1278-0686,OC(C(CC(Nc(ccc(Cl)c1)c1Cl)=O)N1CCOCC1)=O,0 F6619-7568,COc1cc(OC)nc(N(CC2)CCN2c(cc2)nnc2-n2nccc2)n1,0 Z2734798357,CC(c(sc1nc(SCC(NCc2ccccc2)=O)n2)c(C)c1c2O)=O,1 Z2445346354,FC1(CNCC1)c1nc(-c2cc(OC3CCC3)ncc2)no1,1 F2795-0731,COc(ccc(NC(C(NC1CCCCCC1)=O)=O)c1)c1OC,0 F1142-1755,CCOC(c1c(C)c(C#N)c(-n2c(C)ccc2C)s1)=O,1 F6439-8233,CN(C)S(c(cc1)ccc1C(NCCn1c2cc(-c3ccco3)nn2cc1)=O)(=O)=O,1 F6441-6971,CCSc(cccc1)c1C(N(CC1)CCC1S(c1nncn1C)(=O)=O)=O,0 F6808-1510,FC(c(cc1)cnc1N1CCN(CC(C2)CC2(F)F)CC1)(F)F,0 Y203-9888,Cc1ccc(-c2nc3ccccc3c(C(N(CC3)c4c3cccc4)=O)c2)s1,1 Z1583886058,NC(c(cc1)cc(F)c1NC(c(cn1)ncc1Oc1ccccc1)=O)=O,1 Z2360953876,O=C(NCCN1CCNCC1)NCC(CCC1)c2c1cccc2,1 F6481-4052,O=C(CSc1nc(cccc2)c2o1)N(CC1)CCSC1c1cccs1,1 F6612-0024,O=C(COc(cc1)ccc1Cl)N1c2nc(N3CCOCC3)ncc2CCC1,1 F5854-4077,COc(cccc1)c1C(N(Cc1cscc1)C1CC1)=O,0 5350-0970,CN(CC1)Cc(c(-c2cccs2)c2C#N)c1nc2SCC(Nc(cccc1)c1OC(F)(F)F)=O,1 F0537-0448,O=C(c(cc1)cc2c1ncs2)Nc(cccc1)c1-c1nc(cccc2)c2[nH]1,1 Z2070912329,COc1cccc(C2(CC2)C(NC(CC2)c3c2c(O)ccc3)=O)c1,0 Y300-3552,CCC(NCc1ccc(CN(CCC2)C2=O)cc1)=O,0 L287-0838,CCN(c1ccccc1)S(c1cc(-c2noc(C3CC3)n2)cs1)(=O)=O,0 C301-7610,CCCNC(c(cccc1)c1OC1=O)=C1NS(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,0 F6560-0375,O=C(NC(CC1)CS1(=O)=O)N(C(CC1)C2)C1CC2Oc1ncccc1,1 F6296-1280,Cn(c(CNC(c1noc(-c2ccco2)c1)=O)c1)nc1-c1ncccc1,1 F3382-6821,COC(c1ccc(CN(C=Nc2c3scc2-c2cc(F)ccc2)C3=O)o1)=O,1 Z645139308,CC(CN1CCOCC1)Nc1nccnc1,0 SA99-0438,COCCC(CC1)(CCN1C(CC1)CCN1C(CC1CCCC1)=O)C(N)=O,1 F6064-1532,COCCNC(N(C1)CC1c1nc(-c2cnccc2)no1)=O,1 F6560-0568,O=S(N(C(CC1)C2)C1CC2Oc1ncccc1)(N1CCOCC1)=O,1 F5831-9090,O=C(c1cscc1)NCC1(CC1)c(cc1)ccc1F,1 K786-1293,CCN(Cc1ccccc1)C(c1c(C)c(cc(cc2)S(N3CC(C)CC(C)C3)(=O)=O)c2o1)=O,1 S923-0504,Cc1c(CN2CCn3c(C(CCCC4)N4S(C)(=O)=O)nnc3CC2)scn1,1 S836-2315,COC[C@@H](CN(C1)C(c2nccc3ccccc23)=O)[C@H]1C(N)=O,0 Z2964721158,O=C(c1cc(NC2CCC2)ncc1)NC1(COC1)c1ccccc1,1 S576-0282,O=C(C(CC1)CN1C(C=NN1CC2CC2)=CC1=O)NCCCN(CCC1)C1=O,1 Z908049246,CC(C(Nc1cn(CC(NC2CC2)=O)nc1)=O)Oc(cc1)cc(F)c1F,0 F0848-0042,CC(C)(C1(C)CC2)C2(C(N(CCC2)c3c2cccc3)=O)OC1=O,1 Z1571505411,OCC(N(CC(C1)O)C1c1ccc(C(F)(F)F)cc1)=O,0 F6564-5208,O=C(c(cc1)cc2c1[nH]cn2)N(CC1)CCN1c1nnc(C2CC2)cc1,1 G754-0141,O=C(CSc(n1-c2ccccc2)nc2c1N=CNC2=O)N(CCC1)c2c1cccc2,1 G539-0004,O=C(Nc1cccc(Cl)c1)N(CCc1c2sc3c1CCCC3)C2c1ccccc1,0 F6812-1708,N#Cc1cc(Cl)c(N(CC2)CCN2c2nc(-c3cnccc3)ccn2)nc1,0 SD64-0432,CNC([C@]1(C[C@H](C2)NS(c3cccs3)(=O)=O)[C@@H]2CN(Cc2ccccc2)C1)=O,1 P909-5503,C[C@@H](CN(C1)C(Nc2c(C)ccc(C)c2)=O)[C@H]1c1nc(-c2ccncc2)no1,0 F6545-0145,CC(C(CC1)CN1c1nccc(C(F)(F)F)n1)=O,0 D401-0751,OC(c(cc1)ccc1Nc1c(-c(cc2)ccc2N2CCOCC2)nc2n1ccnc2)=O,0 F6681-9600,O=C(NCc(cc1)ccc1F)N1CC(COc2ncccn2)CCC1,1 F2359-0313,CC(C1)OC(C)CN1c1nc2nccnc2c(Nc2cc(C)c(C)cc2)n1,1 F6464-0556,O=C(Cn1nccc1)N(CCCC1)CC1c(cc1)ccc1Cl,1 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SA40-0184,CCN(Cc1c(C)n(CC)nc1C)C(C1N(C)CC2(CN(Cc3ccccc3)C2)C1)=O,0 SC02-0546,Cn1c(C(N(CC2)CC2(CCOC)NC(C2CCOCC2)=O)=O)ccc1,1 Y044-4299,Cn(c(C(N1Cc2nnc(C(F)(F)F)n2CC1)=O)c1)c2c1cccc2,1 Z1895029576,CC(C(N(C1)c(cccc2)c2NC1=O)=O)N(CC1)CCC1(CCN1C)C1=O,1 Z2453213047,NC(c(cc1)ccc1NC(C(CC1)Cc2c1ncnc2)=O)=O,0 Z2316083214,Cc1c(C(N(CC2)CCN2c2cccc(F)c2)=O)nc(C)o1,1 F6363-0733,Cc1nc(-n2cccc2)cc(NCCNS(c(cccc2)c2F)(=O)=O)n1,0 Z1999787206,O=C(COc1cscc1)N(C1CC1)C(CC1)c2c1cccc2,1 F0777-1078,O=C(c(cccc1)c1C1=O)N1c(cc1)cc(Cl)c1Cl,0 SA92-0009,FC1(CN(Cc(cc2)cc3c2OCCO3)CCC1)c1nc(-c2ccccc2)no1,1 L507-0835,Cc(n(C)c(-c1nc(C)c(C(N2CCOCC2)=O)s1)c1)c1S(NCCN(C)C)(=O)=O,0 F6481-4468,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CCSC1c1cccs1,0 Z445158780,OC(CN(CC1CC1)S(c(s1)ccc1Cl)(=O)=O)=O,1 Z2019179059,COc1ccc(C(CNC(CN2C3(CC3)COCC2)=O)c2c[nH]c3c2cccc3)cc1,1 SD61-0656,O=C(Cc1ccncc1)N(C1)CC2(CCC2)C1C(NCC1CC1)=O,1 Z2992274666,COc1cccc(-c2noc(CC3CCN(CC(F)F)CC3)n2)c1,1 Z2568666072,NC(CC(C1)N2CCN1c1nc(OC3CCCCC3)cnc1)C2=O,1 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Z2446042147,CCn1ncc2c1N=CN(CCOc(cccc1)c1C(O)=O)C2=O,0 V016-9475,CCC(C(N(C1)C2CCCCC2)=O)Oc(cc2)c1cc2NC(Cc1cccs1)=O,1 Z2973104941,Cc1cnc(NCC(N2)=NC(C)=CC2=O)nc1,0 F6523-1079,Cn(cc1C(N(CC2)CCN2c2nccn3nc(CCCC4)c4c23)=O)nc1OC,1 Z1616388817,CC(C)(C1)OC(C)(C)C1NC(Nc1ncnc(COC)c1)=O,0 Z3026725035,CCOC1CC(CC(NCCc(c2c3)c[nH]c2cnc3Cl)=O)C1,1 G410-0088,Cc1cc(C)nn1-c(c1ccccc11)nnc1N(CC1)CCN1c(cc1)ccc1F,0 E856-3176,O=C(c1ccc(CN(c2cc(-c(cc3)ccc3Cl)nn2CC2)C2=O)cc1)NCC1OCCC1,1 G533-0426,CCc(cc1)ccc1N(CCC1C(NC2CCCC2)=O)C1=O,1 F6559-1657,O=C(c(cccc1)c1S(C(F)F)(=O)=O)N1CCN(CCF)CC1,0 L810-1160,O=C(C1=CN(c(cc2)ccc2Oc2ccccc2)c(cc(cc2)F)c2S1(=O)=O)N1CCOCC1,1 F6514-3930,CN(C(C=C1)=O)N=C1C(N(C1)CC1n1nnc(COc2ccccc2)c1)=O,1 F6559-1315,Cc1nc(cccc2)c2n1C(CC1)CN1C(CNC(OCc1ccccc1)=O)=O,1 Z2442374297,Cc(c(C(O)=O)cc(S(Nc1cn(CCOC)nc1)(=O)=O)c1)c1F,0 Z4135141573,CCn1nncc1-c1nc(C(C)Oc(ccc(Br)c2)c2Cl)no1,1 S700-0849,O=S(c1cnccc1)(N(C1)CC1c1nc(CCOCC2CC2)no1)=O,1 8012-7141,CCOc(cc(CCNC1c(cc2C)cc(C)c2O)c1c1)c1OCC,0 SB27-0048,COc(ccc(F)c1)c1S(N(CC1)CCC1N(C1)C2(COCC2)CNC1=O)(=O)=O,0 Z2292719949,O=C(Nc(cc1)cnc1F)N(C1)CC1C1CCCCC1,0 Z3816019615,Cc(cc1)ccc1S(NC1(CC2)CNCC2C1)(=O)=O,1 Y501-6635,O=C(c1c2nccc(-c3ccco3)n2nc1)Nc(c1ncccc11)ccc1Br,1 F6438-3005,COc1nc(CNC(c2nc3ccccc3nc2)=O)nc(OC)n1,1 Z2454442227,CC(NCCN(C)C(c(cc1)cnc1-n1nc(C)cc1C)=O)=O,0 Z1553088910,O=C(Cc1n[nH]c2c1cccc2)N1CC2(CCC2)OCC1,1 S629-1892,COc(cc1)cc(S(N2Cc(cc(CCC(NC3CC3)=O)cc3)c3OCC2)(=O)=O)c1OC,0 F2296-0014,CC(C)(COc(cc(cc1)NS(c(cccc2)c2Br)(=O)=O)c1N1C)C1=O,0 Z3091706699,COC(c1c(C(CC2)CCN2C(C2CCCCCCC2)=O)ocn1)=O,1 Z5034431081,CCc1cccc2c1[nH]cc2C(COC(c(nc1)cn1-c(cccc1)c1OC)=O)=O,0 S615-0343,CCCS(N(CC1)CC1c1nc(CCOCC2CC2)no1)(=O)=O,1 SA73-0642,CCN(CC)C(N(CC1)CCC1(CC1CC1)c1noc(C2CCOCC2)n1)=O,0 Y044-5238,c1(nsc2c1cccc2)N1CCN(C(N[C@H](C(=O)O)C)=O)CC1,0 S720-0791,CC1(CCCCC1)C(N(C[C@H](C1)Oc2ccccc2)[C@@H]1C(N1CCCC1)=O)=O,1 F6801-7964,Cc1c(N(C)Cc(cc2)cc3c2OCCO3)n2ncnc2nc1C,1 L776-0633,Cc1ccc(COCc2nn(C)c(CC3)c2CN3S(c2cc(F)c(C)cc2)(=O)=O)cc1,0 F2866-0310,CCc(s1)ccc1S(N(CC1)CCN1c1ncnc2c1nnn2Cc1ccccc1)(=O)=O,1 SB04-0090,Cc1noc(C)c1CC(NCCN(C(CC1)CN1S(C)(=O)=O)C1CCOCC1)=O,1 Z1095286710,CC(CCC1)(CN1C(N(CC1)Cc2c1cccc2)=O)C(O)=O,1 F6523-3773,O=C(CCC(N(CC1)CC2=C1N=C(C=CC(Cl)=C1)N1C2=O)=O)c1ccccc1,1 F5835-0258,COc(ccc(CC(Nc(cc1)ccc1-c1n[nH]cc1)=O)c1)c1OC,0 Z431573862,Cc([nH]nc1C)c1NC(c(cc1)ccc1S(C)(=O)=O)=O,0 F5854-2217,Cc(c(S(N(CCOC)Cc1ccncc1)(=O)=O)ccc1)c1Cl,0 F3395-0572,Cc1noc(CN(CC2)CCC2N(CC2)CCC2Oc2ncc(C(F)(F)F)cc2)n1,1 Z1506014169,CC(C)(c(cc1)ccc1F)NC([C@@H]1C(C)(C)C1)=O,0 L435-0181,Cc(cc1)c(C)cc1NC(Nc(cc1)cc(Cl)c1-c1nnc(-c2ccccc2)o1)=O,0 F2147-1759,OC(CN(CCN1c(cc2)cc(F)c2F)C1=O)=O,0 F6543-8697,Cn1c(S(N(C2)Cc3c2cccc3)(=O)=O)ncc1,1 F6726-5590,CN(C(C1)CN1c(ncnc1-c(cc2)ccc2F)c1F)C(C1COCC1)=O,1 E589-3771,CN(C1CCCCC1)C(CN1c(cc(cc2)S(N3CCCCCC3)(=O)=O)c2OCC1=O)=O,0 CM3123-0155,Cc1cc(C)nn1CCC(NC(CC1)CN1C(C=C1)=NNC1=O)=O,0 Z1980585931,CCn1nc(C(F)(F)F)c(C(Nc(cc(C)cc2)c2OC)=O)c1,0 F325-0073,O=C(CCC(N(CC1)c(cc2)c1cc2S(N(CC1)CCN1c1ccccc1)(=O)=O)=O)N1CCCC1,1 F6178-6654,O=C(C1CC=CCC1)NCC(CC1)CCN1C(c1cocc1)=O,1 Z1493220363,N#Cc(cc1)cnc1N(CC1)CCC1NC(NCC(c1ccncc1)O)=O,1 F6436-0873,Cc(onc1)c1C(NCC(C1CC1)(c1ccccc1)O)=O,1 F6786-6439,Cn1ncc(C(N2CC(COc(cc3)nnc3-c3ccccc3)CC2)=O)c1,1 S632-0829,CNC([C@@H](CN(C1)C(c2c[nH]c3c2cccc3)=O)[C@H]1C1CCN(C)CC1)=O,1 F6257-6736,O=C(NCc1cccs1)N(CC1)CCN1c1ncnc(C2CC2)c1,1 F6438-0709,Cc(cc1)nnc1Oc1cccc(C(NCc2nc(N3CCCCC3)cc(C)n2)=O)c1,1 F3337-0015,CC(C)(C=C)OCC(CN1CCN(CCO)CC1)O,0 S928-4360,Cc1noc(C)c1S(N1CC(Cc2nnc(-c3ccccc3)o2)CC1)(=O)=O,1 F6564-3185,O=C(CN1N=C(C2CC2)C=CC1=O)N1CCN(Cc2ncccc2)CC1,1 F6472-0580,O=C(CSCc1ccccc1)NCCSC1CCOCC1,1 F3395-0513,FC(c1nc(N(CC2)CCN2C2CCN(Cc3nc(cccc4)c4o3)CC2)ccc1)(F)F,1 Z3134199195,O=C([C@@]1(CCCC2)[C@H]2NCC1)NCC(C(N1)=O)=CN(C2CC2)C1=O,1 F2501-0950,Cc(cc1)c(C)cc1NC(C(C(N1C)=O)=CN=C1SCc1cc(F)ccc1)=O,1 G346-0137,CNC(C1CCC(CN(C(c(scc2)c2N2CC(NCCc3ccccc3)=O)=O)C2=O)CC1)=O,1 SA46-0371,Cn1c(C(N(C2)CC2(C2)OCC2N2CCN(C)CC2)=O)ccc1,1 F6194-0328,CC(Cc1ccco1)(CNS(c(cc1)ccc1OC(F)(F)F)(=O)=O)O,0 Z2593963907,CC(C)(C(N(CC1)Cc2c1ccc(Cl)c2Cl)=O)N,0 F3222-4173,Cc1c(C(OCc2ccccc2)=O)nnn1-c1cccc(SC)c1,0 F6228-0379,CC(c1cccc(S(N2CCN(CCn3nccc3)CCC2)(=O)=O)c1)=O,0 F2271-0538,CCN(CCC1)c2c1cc(CCNC(C(Nc1cc(C)nc3ccccc13)=O)=O)cc2,1 Z1474144300,CCc(cccc1)c1OCC(NC(CCC(N1)=O)C1=O)=O,0 Z2974471044,Cc1nc(C(C2)CN2c2cc(C)nc(-c3cccs3)n2)n[nH]1,1 F6478-0824,CC(C)Sc1ccc(CC(N(CC2)CC2Oc2nc(C)cc(C)n2)=O)cc1,0 F5669-0515,O=C(COc1cccc(C(F)(F)F)c1)N(CC1)CCN1c1ncnc(N2CCCCC2)c1,1 F6564-5476,O=C(CN(C=Nc1c2cccn1)C2=O)N(CC1)CCN1c1nnc(C2CC2)cc1,1 F6680-3467,COc1nccc(N(CCN(Cc2nc(CCC3)c3s2)C2)C2=O)c1,1 F6472-7288,Cc1nn2c(CCN(C3)C(COc(ccc(Cl)c4)c4Cl)=O)c3cnc2c1,1 S719-0193,CN(Cc1ccccc1)C([C@H](CN(Cc1ccccc1)C1)[C@H]1C(O)=O)=O,0 Z2878714029,CC(C1)COC1c1nc(-c2ccco2)no1,1 F3406-3321,Cc1c(C(NCc(cccc2)c2OC)=O)sc(Nc2nc(C)ccc2)n1,1 Z2961167579,CCn1nnc(C(N2CC(Cc(cccc3)c3Br)C2)=O)c1,1 C378-0585,Cc(cc1)ccc1C(c1c2cccc1)=C(C(NC1CCCC1)=O)OC2=O,1 F6616-7216,Cc1c(C(Nc2nc(C)c(C)s2)=O)c(C)nn1C,0 J029-0107,CC(CC1)Cc2c1c(C(N)=O)c(NC(C1(CCCC1)c(cc1)ccc1Cl)=O)s2,1 Z1911007102,CCc1cc(N(CC2)CCC2Nc2cc(C)nc(CO)n2)ncn1,0 Z1177404026,CC(Cc1c2cccc1)C2NC(N(CC1)CCC1C(c(cc1)cc(N2)c1OC(C)C2=O)=O)=O,0 L409-0132,CC(C(N(CC1)c2c1cccc2)=O)NC(Nc(ccc(Br)c1)c1F)=O,0 C300-0064,COc(ccc(CCNC(CCS(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O)=O)c1)c1OC,0 F0911-1968,COC(c1ccc(CSc2ncccn2)cc1)=O,0 Y031-6420,CC(C)(Cc1c2sc(NC(C(CC3)CCN3C(C)=O)=O)n1)CC2=O,1 Z2033576164,CC(C)(C(N(CC1)CCC1(C)OC)=O)S(C1CC1)(=O)=O,1 F2806-0223,O=C(c(cccc1)c1F)Nc(cc1)cc2c1scn2,0 Z1692908196,Cc1cc(C(NC(CC2)CCN2c(nc(C)cc2)c2Cl)=O)c(C)o1,0 F5332-0123,O=C(Cc1cccc2ccccc12)NCCCS(N(CC1)Cc2c1cccc2)(=O)=O,1 Z2483031608,CCC1(CCN(Cc(ccc(C(O)=O)c2)c2Br)CC1)O,0 G856-7348,Cc(cc1)c(C)cc1N(CC(C1)NC(c2ccco2)=O)C1=O,0 F6561-1992,O=C(c1cc(cccc2)c2s1)N(C1)CC1OCC1COCC1,1 F6751-4255,O=C1N(Cc2ccccc2)CCN(CCn2nccc2)C1,1 F6178-3562,O=C(c1cccc(C(F)(F)F)c1)NCC(CC1)CCN1C(c1cnccc1)=O,0 F6764-1430,O=S(C1CCCCC1)(N(CC1)CCC1c1nc2ncccc2cc1)=O,1 Z2773407534,CC(c1nc(-c2c(C)ccc(F)c2)no1)n1nc(C(F)(F)F)cc1,0 Z2177482913,O=C(c1ccc(-c(cccc2)c2Cl)o1)N(CCC1)CC1C1CC1,1 G620-0039,Cc1cc(S(Nc2cc(-c(cc3)nnc3N3CCOCC3)ccc2)(=O)=O)c(C)cc1OC,0 Z2437904274,NCc(cc1)ccc1C(NC1CCN(CCOc(cc2)ccc2Cl)CC1)=O,1 K284-4057,O=C(c1ccc(CN(C(c(cc(cc2)Br)c2N2)=O)C2=S)cc1)NCCCN1CCCCC1,1 Z1244434999,CC(C(CC1)CCN1C(NC(CCC1)CN1c(ccc(C#N)c1)c1F)=O)O,0 Z1270044105,CN(CC1)c(ccc(C(NCc(cc(cc2)F)c2F)=O)c2)c2NC1=O,0 Z3269089404,C(CSC1)C11n2nnnc2-c(cccc2)c2N1,1 S900-0078,CS(N(CC1)CCN1C([C@H](C1)NC2(CCCC2)c2c1[nH]cn2)=O)(=O)=O,0 Z1311069056,O=C(CC(c1ccccc1)NC(c(cccc1)c1Cl)=O)NCCC(N1)=NNC1=O,0 S629-2581,O=C(CCc(cc1)cc(C2)c1OCCN2C(C1Oc(cccc2)c2OC1)=O)N1CCOCC1,1 Z2231625639,CC(C)(CCC1)C1(CNC(C(Oc1c2ccc(F)c1)=CC2=O)=O)O,0 Z2351907008,Cc(c(F)c(cc1)F)c1N(C(C1(CCCCC1)N1)=O)C1=O,0 F6261-4024,Cc1c(CNC(C(CC2=O)CN2c2cc(F)ccc2)=O)sc(-c(cccc2)c2Cl)n1,1 Z2335416896,CNC(NC(CC1)CCN1C(c1cc(Br)c2OCOc2c1)=O)=O,1 Z1261798515,COCC(C1)OCCN1C(CNC(c1cccc(Cl)c1)=O)=O,0 Z3303387752,O=C(C(C1)CC1OCc1ccccc1)N(CCn1c(C(F)(F)F)n2)Cc1c2Br,1 Z2296055507,CC(C)(C(N(C)CC1)=O)N1C([C@@H](C1)[C@H]1c1cccc(Cl)c1)=O,0 Z2122427837,CCc1c(C(O)=O)sc(-c2nnc[nH]2)n1,0 F6594-2152,CC(C=C1)=NN(CC2CCN(CC3(CCOCC3)O)CC2)C1=O,1 F6764-4823,COc1ccc(CCNC(N2Cc3cc4cccnc4nc3CC2)=O)cc1,1 Z2877332734,CC(CN(CC1)c2ccncc2)N1C(c1cc(Cl)cc(F)c1)=O,0 Z366647900,O=C(c1cc(-c2ccncc2)nc2ccccc12)NCc1cc(-n2nccc2)ncc1,1 Z1324220505,COCC(c1ccco1)NS(c(s1)ccc1Cl)(=O)=O,0 J047-0034,Cn1c(SCC(Nc(cc2)cc(N3)c2NC3=O)=O)nnc1-c1cc(cccc2)c2o1,0 Z1666168737,O=C(NCc(cccc1)c1-n1nccc1)N1CC(CCc2ccccc2)OCC1,0 Z250-0023,CC(CN(CC1)C(NC2=O)=Nc3c2scc3-c2ccccc2)N1c1cc(C)ccc1,0 Z1414486852,CC(C)COC(CC1)CN1C(NCc(cc1)cc2c1OCCCO2)=O,1 F6573-3415,O=C(NCCOCCn1cncc1)OCc1ncccc1,1 Z3045773856,NC[C@H](C1)C[C@@H]1NC(NC(CC1)Cn2c1nc(-c(ccc(F)c1)c1F)c2)=O,1 F6443-1493,COC(CC1)CCN1c(cc1)ccc1C(NCc1ncccc1)=O,1 S726-0042,OCCC1CC(CC2)(CCN2C(C2CCC2)=O)OCC1,0 F2438-0273,CC(CNC(Nc1cc(Cl)c(C)cc1)=O)N1CCCC1,1 Z2483105533,OC(c1cc(OCCN(CCOC2)C2C2OCCC2)ccc1)=O,1 Z3000309327,NC(c1ccc(C(N(CCCCC2)C2C(F)(F)F)=O)s1)=O,0 G856-1520,C(c1ccccc1)N(CC1)CCN1c1c(c(CCC2)c2s2)c2ncn1,1 F0852-0104,CCCCCCCn1c(cccc2)c2nc1CCCO,0 F6471-5022,Cc1cc(C(N(CC2)CC2n2nncc2)=O)c(C)o1,0 SD68-0821,O=C(c(cc(cc1)Cl)c1F)N1CC(C(N(Cc(cc2)ccc2F)CC2)=O)N2CCC1,1 Z1738499584,Cc1c(C(O)=O)sc(CCNS(c(cccc2C)c2F)(=O)=O)n1,0 F616-0606,O=C(c(cc1)ccc1N(C(C=C1)=O)N=C1Sc(cc1)ccc1Cl)Nc1c(CCCC2)c2ccc1,1 G868-0072,CCNc1cc(C)nc(N(CC2)CCN2C(C2=Cc(cccc3)c3OC2=O)=O)n1,0 S759-0367,CC(C)N(C[C@H]1Oc2ccccc2)[C@@H]1C(CC1)CCN1C(C1(CC1)c1ccccc1)=O,0 SA45-0058,CN(CCCC1(CC2)CCN2C(c2ncncc2)=O)C1C(N)=O,1 F6448-2471,COc(cc1)cc(S(Nc2cn(CC3Oc(cccc4)c4OC3)nc2)(=O)=O)c1OC,1 F6560-2432,COc1c(CCC(NCc2cn(-c3ccncc3)nn2)=O)c2ccccc2cc1,1 Z2654363920,CC(C1CC1)NC(NCc(cc(cc1)OC)c1F)=O,0 F3406-3316,Cc1c(C(N(CC2)CCN2c2c(C)ccc(Cl)c2)=O)sc(Nc(cc2)ncc2F)n1,1 Z2106058460,O=C(Nc1cc(Cn2nccc2)ccc1)N1C(C2)C2CCC1,1 Z3389120476,Cc(cc1)cc(nn2)c1n2S(c(cc(cc1)Br)c1OC)(=O)=O,0 Z1522081816,O=C(c1cn(-c(ccc(F)c2)c2F)nc1)N1Cc2cccc(Cl)c2CC1,0 Z916761080,OCc1cccc(C(NCc(cc2)ccc2Cl)=O)c1,0 F6519-3817,Cc1cc(C)nn1C(CNC(c1c(C)onc1)=O)c1cccs1,1 1000-0651,NC(c1c(NC(c(cc2)ccc2S(N2CCCC2)(=O)=O)=O)sc2c1CCCC2)=O,1 F6089-9876,COC(CNC(NC1CCOCC1)=O)c1ccco1,0 F6773-4818,Cc1c(CN(CC2)CCC2Oc2nc(C)cnc2C)sc(C)n1,1 D473-2066,CC(C)c1cc(C(Nc2cc(-c3nc(cccc4)c4o3)ccc2)=O)nn1C(CC1)CS1(=O)=O,1 F6796-0069,Cc(cn1)c(Nc(cc2)cc(OC)c2OC)nc1SC,0 V027-3730,O=C(NC1CCCCC1)N(CCC1)C1c1nc(cc(cc2)-c3ccccc3)c2o1,0 F184-1657,CC(C)CCNC(C(CCC1)CN1S(c(cc1OC2C)c(C)cc1NC2=O)(=O)=O)=O,0 Z3215989306,Cc1c(C(N(C2)CC2c2n[nH]cc2)=O)sc2c1c(F)ccc2,1 F6089-1481,Cc(ccc(N(CCC1)S1(=O)=O)c1)c1NC(CSC1CCCC1)=O,1 D337-0695,COc(ccc(CN(C(CC1)CS1(=O)=O)C(c1noc(-c2cccs2)c1)=O)c1)c1OC,0 M333-0401,Cc1c(-c2cc(S(N(CC3)CCN3c3c(C)ccc(C)c3)(=O)=O)c(C)s2)[nH]nc1C,0 SA22-0636,COCC(N(C1)CC1N(CC(C1)(F)F)[C@@H]1C(NCc(cccc1)c1OC)=O)=O,1 F2372-0183,CCOC(CCNC(NCC(CC1=O)CN1c(cc1)ccc1F)=O)=O,0 7591-0334,O=C(c1ccco1)NC(C(F)(F)F)(C(N1Cc2ccccc2)=O)NC1=O,1 F6564-2445,O=C(c1nc2ccccc2nc1)NCCN1N=C(C2CC2)C=CC1=O,1 SD60-0043,COCCC1COC(C2)(CN2C(Cc2cnccc2)=O)C1,1 F6752-4296,O=C(C(C1)OCCN1C(CCCN1)C1=O)NC1CC1,1 S296-0714,COCCN(C([C@H]1[C@@H]2CN(Cc(ccc(OC)c3)c3OC)C1)=O)C2=O,0 E218-1647,CC(C)CCN(C(C)(Cn1c2cc3c1cco3)C(NC1CCCCCC1)=O)C2=O,1 Z2041182392,CC(N(CC1)CCc2c1ccc(S(Nc1cc(-c(cccc3F)c3F)n[nH]1)(=O)=O)c2)=O,1 F6752-2442,CC(C)(C)C(NC(CC1)CCN1C(CCN1CC(F)(F)F)C1=O)=O,1 Z282713988,Cc1nn(C)c2nc(-c3ccccc3)cc(C(NCCc3cccc4cccnc34)=O)c12,1 Z2814757209,O=C(C1(CCOCC1)F)Nc1nc(-c(cccc2)c2F)co1,0 Z3104405776,Cn1c(CNC(N(CCC2)CC2C2CCCC2)=O)cnc1,1 4112-3397,Cc1cc(NS(c(cc2)ccc2Nc2nc(-c3c(C)nc4n3cccc4)cs2)(=O)=O)no1,0 F6752-6227,O=C(C(CCC1)CN1c(cc1)nn2c1nnc2)N(CC1)CCC1(F)F,1 F6683-1332,Clc(cncc1)c1OCC(CC1)CCN1c1ncnc2c1CCCC2,1 F6806-7030,O=C(CN1CC(C(N2CCSCC2)=O)OCC1)NCc1ccco1,1 Z1696367988,O=C(c(cc1)ncc1Br)NC1(CCOCC1)C1CC1,1 V019-4888,O=C(c1coc(CN(Cc2cc(C(F)(F)F)ccc2)Cc(cccc2)c2F)n1)NCC1OCCC1,0 S639-0080,CC(C)CCC(N[C@@H]1[C@@H](CN(C)C)CN(C)C1)=O,0 F6529-4175,O=C(CN1C(CC2)CCN2S(N2CCOCC2)(=O)=O)N(CC(F)(F)F)C1=O,1 V024-8281,CN(CCc(cc1)cc(OC)c1OC)c1cc(COC)nc(SCc2ccc(C(NCC3OCCC3)=O)o2)n1,1 F6488-2572,CN(C)c1cncc(OC(CC2)CN2C(Cn2nccc2)=O)n1,1 Z3610356244,CN(CC1)CCC1NC(CNC([C@@H](C1)[C@H]1c1cc2ccccc2cc1)=O)=O,0 Z1155913593,O=C(NCc1cnccc1)N(CC1)C(c2ccccc2)c2c1cccc2,1 F6349-0559,O=C(Cc(cccc1)c1Cl)N(CC1)CCN1C(c1c(cccc2)n2nc1)=O,1 F6559-0514,O=C(c1noc(-c2cnccc2)c1)N(CCC1)CC1N(C=Nc1c2cccc1)C2=O,1 F6612-0031,COc(cc1)cc(C(N2c3nc(N4CCOCC4)ncc3CCC2)=O)c1Br,0 Z1539211912,CCc1ncnc(N2CCN(Cc3ccncc3)CC2)c1F,0 F1288-0034,CC(c1ccccc1)NCC(COc(cc1)ccc1NC(C)=O)O,0 Z1547596464,COc1c(C2(CC2)C(N(CC2)Cc(cccc3)c3N2S(C)(=O)=O)=O)cccc1,0 Z2798235964,CCN(C(c(cnn1CC)c1Br)=O)c1cnccc1,0 F2255-1088,O=C(COc1cccc2ccc(N3CCOCC3)nc12)NCc(cc1)cc2c1OCO2,1 Z1494878372,O=C(c1c(CCCC2)n2nc1)NCC1CN(CC(F)(F)F)CC1,1 F2496-2980,O=C(c1ccc(Cn2cncc2)cc1)OCc1noc(-c(ccc(F)c2)c2F)c1,1 L948-3603,O=C(Cc1cccs1)N(CCC1)C1c1nc(-c(ccc(F)c2)c2F)no1,1 F2254-0474,O=C(C(CCCC1)N1S(c1cccs1)(=O)=O)Nc(cc1)cc2c1OCCO2,1 E216-1484,CC(CCC1)C(C)C1NC(C(CC1)CCN1C(N1c(cc(C)cc2)c2OC(C)C1)=O)=O,0 F1876-0008,O=C1N(C/C=C/c2ccccc2)C=Nc2c1nnn2-c1cccc(F)c1,1 F5957-0129,Cc1cc(C)nn1CCNC(CSc(cc1)ccc1F)=O,1 F6554-8442,O=C(c1cc(cccc2)c2s1)N1C(C2)CSC2C1,1 Z7760205451,Cc(cc1)nc(NC)c1C(N(CC1)C(C(O)=O)c2c1occ2)=O,0 F6608-1332,O=C1NCCCC1Oc1cccc(C(F)(F)F)n1,0 Z3597608039,OCC(CC1)(CN1C(c(sc(N1CCCC1)n1)c1Cl)=O)C1CCOCC1,1 Z3538881776,N#Cc(ccn1nc2)cc1c2C(N1C(Cc2ccccc2)COCC1)=O,0 SB99-0437,CCn1ncc(C(N(CC2)Cc3c2n(C)nc3CCC(NC2CC2)=O)=O)c1C,1 Z1183653469,Cn1ncc(-c2ncc(C(N3CCN(CC(NC4CC4)=O)CC3)=O)s2)c1,1 Z729142514,CN(CC1)CCC1NC(C(CCC1)CN1C(c(cccc1)c1OC(F)F)=O)=O,1 Z1343139254,CC(CCCC1)N1c1c(cc(cc2)F)c2ncn1,0 Z3091770097,CC(c1nc(-c2cccc(CN3CCOCC3)c2)no1)O,0 Z2225198130,CCn1nncc1C(N1CC(C)(C)OC(C)(C)C1)=O,0 F6367-0487,Cc(cc1)cc2c1nc(N(C1)CC1C(N(CC1)CCN1c1ncccc1)=O)s2,1 V026-0476,CC(C)C(N(CC(N(CC1)C(COc(cc2)ccc2Cl)c2c1scc2)=O)C(C)C)=O,0 Z1969807726,CC1(C)C(C)(C)C1CNC(Nc1ccnn1C)=O,1 D289-0310,NC(C(CC1)CCN1C(CN(c(ccc(Br)c1)c1-c1c2cccc1)S2(=O)=O)=O)=O,1 Y502-7934,CS(N(CCC1)CC1C(Nc(c1ncccc11)ccc1Br)=O)(=O)=O,1 S694-1097,CCn1ncc(CN(CC2)CC2n2c(-c3cccnc3)ncc2C)c1,0 S720-1039,O=C([C@H](C[C@@H](C1)Oc2ccccc2)N1C(c1ccncc1)=O)NC1CC1,1 Z1507502741,CCC(CC)(CNC(C1=CN(Cc2ccccc2)c(cccc2)c2C1=O)=O)CO,1 F6478-1995,O=C(c1noc(C2CC2)c1)N(CC1)CC1Oc(nc1)ncc1Br,1 F6761-2740,Cc(n(-c1ccccc1)nc1)c1C(N(CC1)CCC1Oc(nc1)ncc1-c1cn(C)nc1)=O,1 F153-0935,COc(ccc(C(C1=C2CCCC1)=NNC2=O)c1)c1S(N1CCOCC1)(=O)=O,0 F6788-3954,FC(c1cc(N(CC2)CCN2c(nc2)ncc2Br)nc(C2CC2)n1)F,0 F6515-0343,CCOc(cc1)ncc1C(NCc1cccnc1-c1cscc1)=O,1 Z3686083983,COc(ccc(CN[C@@H](CC(Cn1nccc1)C1)[C@H]1O)c1)c1C#N,0 Z3135021870,O=C(C(CC1)CCN1S(c(cccc1)c1F)(=O)=O)NC1CONC1,1 Z2646326286,CC(C)C(C(N(CC1)CCN(C)C1=O)=O)OC,0 Z1375778104,O=S(Cc(ccc(F)c1)c1F)(c1nnc2n1CCCCC2)=O,0 Z758467890,C[C@@H](C(NCc1cc(O)ccc1)=O)NS(c(cc1)ccc1Cl)(=O)=O,0 SA01-1010,CCn1nccc1C(N(CC1)CC1c(nc(N(C)C)nc1)c1C(NCCOC)=O)=O,0 F6667-1815,COc(cc(cc1)NC(CCC(F)(F)F)=O)c1F,0 Z2231133134,O=C(C(C1=NN2)=CC=CN1C2=O)NCc1cc(N2CCOCC2)ccc1,1 S721-0744,O=C(Cc1c[nH]c2c1cccc2)N(C[C@H](C1)Oc2cnccc2)[C@@H]1C(N1CCCC1)=O,1 F6266-0175,O=C(Cc(cc1)ccc1-c1ccccc1)N1C2COCC1CC2,1 Z2933232742,CN(CCC1)c2c1ccc(NC(COc(cc1)ccc1F)=O)c2,0 F5857-5366,CSc1ncccc1C(NCC(CC1)(c2c1cccc2)O)=O,1 F2383-0560,CCS(N(CC1)Cc2c1ccc(NS(Cc(cccc1)c1F)(=O)=O)c2)(=O)=O,0 F6442-6831,O=C(c1cscc1)N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F,1 F5833-6679,COC(c(cc1)ccc1C(Nc1cccc(N(CCCC2)C2=O)c1)=O)=O,0 Z2994763958,Oc(c(CNC(c1nc(C2CC2)no1)=O)ccc1)c1Cl,0 G491-0093,O=C(C1=CC(C(CCC2)=O)=C2NC1=O)Nc(cc1)cc2c1OCCO2,1 J107-0806,O=C(COc1cc(-n2cnnc2)ccc1)NC(CCC1)c2c1c(cccc1)c1[nH]2,1 Z274632840,O=C(C1CCN(Cc(cccc2)c2F)CC1)N(CC1)c2c1cccc2,1 S550-0192,O=C(c1nc2ccccc2cc1)NCc1nnc2n1cccc2-c1nc(C2CC2)no1,1 SB04-0626,CN(C)C(N(CC1)CC1N(CCN(C)C(c1cscc1)=O)C1CCOCC1)=O,0 SB66-0056,Cc1ccc(C(N(C[C@H]2CCC3)C[C@@H]2NC3=O)=O)s1,1 Z915711348,O=C(c1n[nH]c(C2CC2)c1)Nc1cn(C(F)F)nc1,1 Y044-2282,Cc1c(CCC(Nc2nnc(C3CCCCC3)s2)=O)c(C)nn2c1nnc2,1 F0318-0070,Cc1cccn2c1nc(CSc1nc(cccc3)c3[nH]1)c2,1 Z1946258170,O=C(NCc1ccccc1)NC1CNCC1,0 Z2434305322,Cc(nc(cc1)Oc2c3OCCCc3ccc2)c1C#N,0 Z3138681830,O=C([C@]1(CCC2)[C@@H]2NCC1)NCCc1cc([nH]nc2)c2cc1,1 F6604-9383,O=C(c1n[nH]c2c1cccc2)N1CC(CN(C(C=C2)=O)N=C2c2cnccc2)C1,1 F5017-1493,CCc(s1)ccc1S(NCC(CC1)CCN1c1ncccn1)(=O)=O,1 Z1824010942,COc(cc1)cc(OCC2CC2)c1C(NCc(cc1)ccc1C(Nc1ccncc1)=O)=O,0 K405-3209,Cc(ccc(-n1ncc2c(Nc(cc3)cc4c3OCCO4)ncnc12)c1)c1Cl,1 Z2936894796,O=C(CC(C1CCC1)C1CCC1)N(CCC1)CC1c1nocn1,1 F0745-0770,COC(c1cccc(Oc2nnc(-c(cc3)ccc3F)c3ccccc23)c1)=O,0 SD63-0072,O=C(COc1ccccc1)N(CC1)CC1c1n[nH]c2c1COCC2,1 Z1172782950,CCn1ncc(NC(C2(CCOCC2)c2ccc(C)cc2)=O)c1,0 F6808-5469,CC(C)NC(C(C)N1CCN(CCn2nccn2)CC1)=O,1 F6793-6817,Cc1c(C(N2CCN(CC(F)(F)F)CC2)=O)sc(C)n1,1 F6438-3723,CN(C)c1nc(CNC(c2nc(cccc3)c3s2)=O)nc(N2CCCCC2)n1,1 SB04-0494,CN(C)C(N(CC1)CC1N(CCNC(c1cn(C)nc1)=O)C1CCOCC1)=O,0 SB33-0055,Cc1n[nH]c([C@@H](CN(C2)C(c3nn(C)cc3)=O)[C@H]2NC(C2CCOCC2)=O)n1,1 SC91-0570,O=C([C@](C[C@H]1CC2)(CN1C2=O)c(cccc1)c1Cl)NCCN1CCOCC1,1 Z1401869957,O=C(CCc1ccccc1)N(CC1)CC1NC(c(cc1)ccc1-n1cncc1)=O,1 Z1827697357,O=C(c1ccc(Oc2ccccc2)o1)NCC(CC1)CCN1c1ncccn1,1 Z1319428818,CN1CCC(CNC(c(cc2)ccc2N2CCCCC2)=O)CC1,1 S742-0196,CO[C@H](C1)[C@@H](c2ccncc2)N1C(CC1)CCN1C(Nc1ccccc1)=O,0 Z3772485736,CCn1ncc(C(N(CC(C(C)C)c2ccnn2C)CC(NC)=O)=O)c1C1CC1,1 Z1881557930,Cc(cc(cc1)S(N(C)C(C(O)=O)c2ccccc2)(=O)=O)c1C#N,0 F5001-0234,CC(C1)N(C(Cc2noc(-c3ccc(C)cc3)c2)=O)c2c1cccc2,1 F6454-0684,O=C(c(cccc1)c1Br)NCC1CCN(CC(F)(F)F)CC1,0 8013-0850,Cc(cc1)ccc1-c(cc1cc2C)cn1c(N1CCCCCC1)c2C#N,1 Y043-5132,OC(CC1(CNC(CCc2nc(-c3cc([nH]cc4)c4cc3)no2)=O)CCCCC1)=O,1 F5017-3394,O=S(Cc1cc(F)ccc1)(NCC(CC1)CCN1S(C1CC1)(=O)=O)=O,1 V028-0400,CC(C)CC(N1C2(CCC(C)CC2)OCC1C(NCC1OCCC1)=O)=O,1 D562-0976,CC(C)Oc1c(C(C2)c(sc(C(O)=O)c3-c4cc(F)ccc4)c3NC2=O)cccc1,0 F6190-1583,OC(CCNC(COc(cccc1)c1F)=O)c1cccs1,0 F6554-8596,CCOC(c1c(C)c(cc(cc2)S(N3C(C4)CSC4C3)(=O)=O)c2o1)=O,1 D025-0068,CC(C)CCOc1ccc(C(C(C)C)(C(CN2CCOCC2)c2ccccc2)O)cc1,0 Z1499603412,O=C(CC1C(CC2)CC2C1)N1CC(Cn2nncc2)CCC1,1 L567-0368,CC(CCC1)(CN1S(c1cccs1)(=O)=O)C(NCc1ccc(C)cc1)=O,1 Z1662093050,Cn1c(cccc2)c2c(-c2nnc(CCc3nc(-c4ncccc4)no3)o2)c1,1 S993-1168,O=C(C1(CC1)c1ccccc1)N(CCC1C(N(Cc2cccc(F)c2)C2)=O)CCN1C2=O,0 F3406-9876,Cc(cccc1)c1N(CC1)CCN1C(c(nc1)cn1-c1cc(N2CCSCC2)ncn1)=O,1 E786-0546,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(CCC(Nc1cc(C)cc(C)c1)=O)(=O)=O,0 Z1203330936,OC1(CNC(C(Oc2c3cccc2)=CC3=O)=O)CCCC1,0 Y207-1793,CCc1ccc(C(C)NC(Nc2cc(CCC3)c3cc2)=O)cc1,0 F820-1357,Cc1ccc(CNS(c(cc2)cc(O3)c2N(Cc2noc(C4CC4)n2)C3=O)(=O)=O)o1,1 Z2216300812,CNCc(cc1)ccc1NC(Cn1nnnc1)=O,0 F6558-0420,CC(C)(C)C(CN1)C(C(Nc2cc(Br)c(C)cc2)=O)C1=O,0 S722-0859,O=S(c1cccs1)(N1CCC(Cc2ccc(CN3CCOCC3)cc2)CC1)=O,1 Z1444360516,OC(CN(Cc1ccccc1)C(C1=NNc(cccc2)c2C1=O)=O)=O,1 Z4874776729,C[C@@H](c(cccc1)c1F)NC(CN(CCC(c1ccccc1)N1)C1=O)=O,1 Z942013754,Cc1csc(C(CC(N(CC2)CCC2n2nccc2)=O)(C(F)(F)F)O)n1,1 Z3173266841,OC[C@@H](C[C@@H]1C2)C[C@H]1N2C(Nc1nc(-c2cnccc2)cs1)=O,1 F279-0459,CCC(C(N(CC)c1ccccc1)=O)N1N=C(C)c2c(C)onc2C1=O,0 V011-9656,O=C(c(cc1)ccc1-c1c(CCCc2c-3cccc2)c3n[nH]1)NCCCCc1ccccc1,1 Z4626507115,CCCc1nc(Cc2nn(C)cc2Br)no1,1 F6372-0438,COc(cccc1)c1C(Nc1c(Cc2nc(C3CC3)no2)cccc1)=O,0 F6186-1015,CC(CCSC)(CNC(c1noc(C)c1)=O)O,0 F6617-5876,O=C(c1ccco1)NCC(CC1=O)CN1c(cc1)cc(F)c1F,1 G266-0616,CN(c(cc(c(N1CCCC1)c1)NC(NC2CCCC2)=O)c1N1C)C1=O,1 F6549-2658,O=C(c(ccc(F)c1)c1Cl)N(C(CC1)C2)C1CC2n1cncc1,0 Z3071636546,CCc1cc(CC)nn1CC(NCc1ccco1)=O,0 F6743-6385,CN(C(CC1)CCN1c1nc(SC)ncc1C#N)S(C1CC1)(=O)=O,0 F6734-1328,O=C(Cc1noc2c1cccc2)N(C1)CC(C2)C1CN2c(cc1)ncc1Br,1 Z1738876858,OC(C(C1)CN(CCNS(c(cc(C(F)(F)F)cc2)c2Cl)(=O)=O)C1=O)=O,0 SB36-1180,O=C(c1cn(C[C@H](CC(C2)(F)F)N2C(C(C=C2)=NNC2=O)=O)nn1)NCc1ccccc1,1 Z1744680670,O=S(c1cn(CC(F)F)nc1)(N(CCc1ccc2)c1c2F)=O,0 F5652-1709,CC(CC1)N(C(CN2N=C(C)C=CC2=O)=O)c(cc2)c1cc2F,1 SB52-1476,CC(C)c1nc(C(C2)N(C)CC2(CC2)CCN2C2CCC2)no1,1 Z957042280,COCCNC(NC(CC1)CCN1c(cccc1)c1OC)=O,0 Z1685064822,C(C1CCOCC1)c1nc(-c2n[nH]c3c2cccc3)no1,0 Z1208561245,CC(C)N(CCC1NC(c2ccc(CN3CCN(C)CC3)cc2)=O)C1=O,1 F5854-3812,Cn1c(CN(C2CC2)C(c2cccnc2SC)=O)ccc1,1 Z1594685227,CC(C)n1nccc1C(NC1c(ccc(Cl)c2)c2OCCC1)=O,0 F2158-1754,CCOC(c1c(C)nc(Nc2ncccc2)s1)=O,0 Y030-5945,CCN(CC1)CCN1C(c(cc1)ccc1NC(C)=O)=O,0 F6467-0119,Cc1noc(-c2c(NC(c3ccc(C(F)(F)F)cc3)=O)scc2)n1,1 SA87-0644,CC(C)CN(CC(CNC(NC(C)C)=O)OC1)C1=O,0 8020-1477,CN(C(CN1c(cc2)ccc2O)=C(C(c(cc2)ccc2Cl)N2)C1=O)C2=O,0 F403-0271,Cc(c(C)c1)cc(N2CC(NCc(cccc3OC)c3OC)=O)c1N=C(CCC1)C1C2=O,0 D289-0129,CC(C)c(cc1)cc(-c2c3cccc2)c1N(CC(N(C)Cc1ccccc1)=O)S3(=O)=O,0 Z1404667634,OC(CC(COCC1)N1C(c1csc(Br)c1)=O)=O,1 Z1467492712,CC(C(c(cc1)ccc1F)O)NC(CN(C(C1(C(C)CCCC1)N1)=O)C1=O)=O,0 Z4009714064,C(c1c(CCC2)n2nc1)N(CC1)CC1C1(C2)CC2C1,1 V011-5083,COc(cc1)ccc1S(N(CC1OCCC1)CC(N(CC1)C(COc(cc2)ccc2Cl)c2c1scc2)=O)(=O)=O,1 4903-2134,Cc(ccc(-c(c1ccccc11)nnc1NC1CCCCC1)c1)c1S(NCc1nc(cccc2)c2[nH]1)(=O)=O,1 F6803-0215,Cc1cnc(C)c(OC2CCN(CC(Nc(cc(C(F)(F)F)cc3)c3Cl)=O)CC2)n1,1 V021-3768,Cc(cc1)cc2c1[nH]c(CC1)c2CC1NC(CC1C=CCC1)=O,1 F5659-0433,CCc(cc1)ccc1N(CC(C1)c2nocn2)C1=O,1 F5016-2555,CSc1c(CN2CCC(CNC(C(Nc(cc3)ccc3OC(F)(F)F)=O)=O)CC2)cccc1,0 Z2701724922,O=C(N[C@@H](C1)[C@H]1c1cscc1)N(CC1)CCC11CCOCC1,1 F5857-6789,OC1(CNC(NCc2cccs2)=O)C=CCCC1,1 Z3290576469,Cc1csc(NC(N(CCc2c3[nH]cn2)C3c2cnccc2)=O)n1,0 Z1570115897,OC(C(CC1)CCC1NC(c1cc(-c2nc(cccc3)c3s2)nc2ccccc12)=O)=O,1 Z1875123540,CCOc(cccc1)c1C(N(CCC1)C1C(N(C1)CC1(C)O)=O)=O,0 SB14-1138,Cc1c(CN(CC2)CC2N(C2CCOCC2)C(COC)=O)scc1,1 Z2307891412,CN1CC(CC2)(CN2C(NC(CC2)Cc3c2[nH]cn3)=O)CCC1,1 F6573-4934,O=C(c1cc(Br)cs1)NCc1cncc(C2CC2)c1,1 SA01-0918,CN(C)C(c1c(C2CN(Cc3cocc3)CC2)nc(N(C)C)nc1)=O,1 Z3027210849,CCC(N1CCC(COc2ncc(C(F)(F)F)cc2)CC1)=O,0 Z3182043706,Cc(cncc1)c1N(C(CN1Cc(cccc2)c2O)=O)C1=O,0 Z5020305478,Oc1ccc(cc(cc2)-c3cn(CCF)nc3)c2c1,0 S893-0252,CCn1nc(C(CCC2)N2C(NC2CCCCC2)=O)c2c1CCOC2,1 F258-1022,Cc1cccc(OCc2nc(CCN(C)S(c(cc3)cc4c3OCCO4)(=O)=O)no2)c1,1 Y042-2066,Cc1noc(C)c1CN(CC1)CCN1C(CCC(C(N1c2ccccc2)=O)NC1=O)=O,1 Z2876625524,O=C(C(CC1)CNC1=O)N(C[C@@H]1CCC2)C[C@]12C(F)(F)F,1 Z3278092617,N[C@]1(CC2)[C@@H]2CN(Cc2n[nH]c3c2COCC3)C1,1 C797-0157,CC(CC1)CCN1c1nc(ccc(C(NC2CCCCC2)=O)c2)c2s1,0 F6795-0422,COc1cccc2c1nc(N1CCN(Cc3csc(C4CC4)n3)CC1)s2,1 Z1743216393,CC(COC)n(cc1)nc1NS(c(cc1)cc(Cl)c1C(O)=O)(=O)=O,0 F6478-3477,CCc1ncnc(OC(CC2)CN2C(C2=CC=CN(C)C2=O)=O)c1F,1 F6279-0245,O=C(c(cc1)ccc1OC(F)(F)F)NCC1(CCOCC1)c1ccccc1,0 F6561-0985,COCc1cn(C(CC2)CN2C(Nc2ccc(C(F)(F)F)cc2)=O)nn1,0 Z2440878368,Cc1c(C(NCC2=CCNCC2)=O)nnn1-c1cc2cccnc2cc1,1 Z3000706848,CN(C1(CC1)C(F)(F)F)C(C(CC1=O)CN1c1cn(C)nc1)=O,1 SB04-0137,Cc1cn(CCC(N(C)CCN(C(CC2)CN2S(C)(=O)=O)C2CCOCC2)=O)nc1,0 Z915547192,CC(C)(C)c(cc1)ccc1S(Nc1c(C)onc1C)(=O)=O,0 F6473-8706,CC(N1C2CC2)=CC(OC(C2)CN2C(c2cc(-c3ccccc3)n[nH]2)=O)=CC1=O,1 Z997450882,CC(CCC1)(c2c1cccc2)NC(Cc1noc2c1cccc2)=O,1 SB32-0772,COC[C@@H](CN(Cc1c[nH]nc1-c(cc1)ccc1OC)C1)[C@H]1c1nc(C2CC2)n[nH]1,1 Z4921564823,CN(CC(CC1)C(N2CCC(CNC(c3cccc4c3ncs4)=O)CC2)=O)C1=O,1 Z2482893902,OC(C(c(cc1)ccc1F)N(CC1)CCC1NS(c1cccs1)(=O)=O)=O,0 D731-0682,CC(Cc1c2cccc1)(C(Nc1cc(C)c(C)cc1)=O)OC2=O,0 SC70-0479,CCCc1nc(C(C2)C3(CCC3)CN2C(Nc(ccc(C)c2)c2Cl)=O)n[nH]1,0 SD60-0121,Cn(cc1)nc1C(N(C1)CC11OCC(CCOC)C1)=O,0 Z4958830442,OCc1cc(NC(C2=CC=C(c3cccs3)NC2=O)=O)cc(CO)c1,0 Z2965100922,CO[C@@H](CCOC1)[C@H]1NC(c1cc(ccc(OC)c2)c2s1)=O,1 F5939-1178,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1)CCC1Oc(sc1ccc2)nc1c2Cl,1 Z1404667383,OC(CC(COCC1)N1C(c1c[nH]nc1)=O)=O,0 F6440-3630,O=C(COc(ccc(Cl)c1)c1Cl)NCc1nn(C2CCCC2)c2c1COCC2,1 Z3026725178,CC(C)C(CC(C1)N2CCCC2)N1C(c1nsnc1)=O,1 Y203-8188,CCC(C)(C)C(CC1)Cc2c1c(C(N)=O)c(NC(Cc(cc1)cc(OC)c1OC)=O)s2,0 F2580-0991,COc(ccc(N(C=CN(CC(Nc(cccc1)c1Cl)=O)C1=O)C1=O)c1)c1OC,0 F0317-0273,O=C(c1cccc(C(F)(F)F)c1)Nc(cccc1)c1-c1nc(cccc2)c2[nH]1,0 F1011-0800,O=C(CN(C(c1c2cccc1)=O)C2=O)NCc1ccco1,1 Z5461592610,CC(CN1)(C(Nc2c(CCCC3)c3cnc2)=O)c(cc(cc2)Cl)c2S1(=O)=O,0 F6523-3615,O=C(c1nn(-c2ccccc2)nc1)N(CC1)CC2=C1N=C(C=CC=C1)N1C2=O,1 F6231-0433,Cc1cc(C)nn1C(C=C1)=NN(CCNC(C(CC2=O)CN2c2cc(C)c(C)cc2)=O)C1=O,1 SC25-1057,Cc1ccc(C)n1CCN(CC1)CCN1C(C1c2nnc(-c3nccnc3)n2CCC1)=O,1 F2083-0010,O=C(C1(CC(C2)C3)CC3CC2C1)NCc1c(-c2ccccc2)nc2SCCn12,1 Z1411111954,COc(cccc1)c1-n1ncc(S(N2CC3(CCC3)CC2)(=O)=O)c1,1 F6680-9007,O=C(c1cnccc1)N1CC(COc2ccncc2)CCC1,1 F6372-1826,O=C(CCC(Nc1c(Cc2nc(-c3ccco3)no2)cccc1)=O)c(cc1)ccc1Cl,1 F167-0074,CCC(C)(C)c(cc1)ccc1Oc1nc2ccccc2nc1N1CCCC1,1 D753-0051,O=C(CN(C(C=C1)=O)N=C1c(cccc1)c1F)N[C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1,0 Z2174485985,Cn1nnc(CC2)c1CC2C(N(CC1)CCc2c1ccc(OC)c2)=O,1 SB95-1200,Cn1c(C(N(CCC2)CC2N(CCN2CCOCC2)C(C2CC2)=O)=O)cnc1,1 Z1430552668,Cc1c(CN2Cc3nnc(C(F)(F)F)n3CC2)cc(C(O)=O)s1,0 F6724-4694,COC(CNc1ncnc2cnccc12)c(s1)ccc1Cl,1 F6192-0297,Cc1c(C)c(S(NCC(c2ccco2)c2ccco2)(=O)=O)c(C)c(C)c1,0 Z2464204145,Cc1c(C)nc(cc(cc2)C(N(C3CC3)C3CCNCC3)=O)c2n1,1 Z2439525339,O=C(C(C1)C11CCNCC1)Nc(cc1)cc2c1nc(-c(cc1)ccc1F)o2,1 8019-8421,Cn(c(cc1)c2cc1Cl)c(C(O)=O)c2-c(cc1)ccc1Cl,0 L914-1039,O=C(c1nc(CN(c(cc(cc2)Cl)c2O2)C2=O)no1)NCCN1CCCCCC1,1 L702-0869,O=C(CN(C(C=C1)=O)N=C1C(N(CC1)c2c1cccc2)=O)NC1CCCC1,1 F6511-9285,CC(C)(c1cn(-c(c(C)ccc2)c2Cl)nn1)O,0 P038-4224,CN(C(c1cc(C(Nc(cc2)cc3c2OCCO3)=O)cnc1N1c2ccccc2)=O)C1=O,0 S971-1091,Cc1cc(C)nn1CCC(N(CC1)CCC1(CC1)C1O)=O,1 SA99-0275,NC(C(CC1CC1)(CC1)CCN1C(C1(CC1)c1ccccc1)=O)=O,0 Z2958514304,CC(N1c2cccc(NC([C@H]3COCC3)=O)c2CC1)=O,1 T138-0376,CN(CC1(COCC1)N1C(CC2)CCN2C(COc2ccccc2)=O)C1=O,1 Z1360376246,O=C(c(occ1)c1Br)N(CCC1)C1c1c2OCCOc2ccc1,0 F6277-0221,Cn(cc1C(N(CC2)CCN2c2nc(c(C(F)(F)F)ccc3)c3s2)=O)nc1OC,1 C429-0462,O=C(c1c2cccc1)N(Cc(cccc1)c1Cl)C2Nc(cccc1)c1Br,0 Z3759792350,Oc(cc1)ncc1C(NCCN(Cc1ccccc1)c1ncccc1)=O,1 F6440-4542,O=C(NCc1nn(C2CCCC2)c(C2CC2)c1)Nc1cccs1,1 Z1452025589,CC(C(N1)=O)(c2cc(C(NCc3cc(-c4cc(C)ccc4)ccc3)=O)ccc2)NC1=O,1 F727-0129,Cc(cc1)c(C)cc1S(N(CC1)CCN1c1ncnc(-c(cc2)ccc2F)c1)(=O)=O,0 Z2297820613,COc1c(CN(CC2)C(c3cc(C(NC4CC4)=O)ccc3)=O)c2ccc1,1 Z1162912253,CC(CN1CCOCC1)Nc(nc1)ncc1Br,1 Z2960172970,CC(CN(C1)C(c(cc2)cc(N3)c2N(CC2CC2)C3=O)=O)NC1=O,1 S687-2125,O=C(Nc(cc1)cc2c1OCCO2)N(CC1)CCC11OCCC(Cc2nc(-c3cnccc3)no2)C1,1 Z1676023771,Cc1nccc(N(CC2)CCN2C(C(CC2)CNC2=O)=O)n1,1 Z1529062876,Cc1c(CC(C2)CN2C(C(CC2)CCC2(F)F)=O)cccc1,0 Z1584162565,CC(Cc1ccccc1)n1c(C(N2C3(CCCC3)COCC2)=O)ccc1,1 Z2941715059,CN(CC[C@H]1CC2)C[C@@H]1N2c1nc2ccccc2cc1,1 Z1708363117,Cc1c(CNC(N2CC3(COCC3)OCC2)=O)c(cccc2)c2o1,0 Z3091624632,CCc1cc(N(CCC2)CC2c2nnc(CO)n2C)nc(CC)n1,0 F6672-0065,C(/C=C/c1ccccc1)N(C(CC1)C2)C1CC2n1nccc1,1 F897-1074,CC(C)n1nc(C)c(S(N(CC2)CCN2C(COc(cc2)ccc2OC)=O)(=O)=O)c1C,0 Z3128248803,CN(CC(F)(F)F)C(C1NCCOc2c1cccc2)=O,0 F5860-4145,COC(C(CC(C1)C2)(CC1C1)CC12NC(CN(C(CC1)=O)C1=O)=O)=O,1 G557-0249,CCN1CCN(CCNC(C(C(C)C)NS(c2cccs2)(=O)=O)=O)CC1,1 Z2176925726,Cc(cc(C(CCC1)N1C(c1nn(C)cn1)=O)cc1)c1Br,1 Z1626395762,C(c1nnc(CC2)n1CC2NC1CCCC1)c1ccccc1,1 Z1979120539,CC(NCC(CC1)CCN1C(C(c1cncn1C)N(C)C)=O)=O,0 F536-0317,CC1Oc2cc(S(N(CC3)CCN3C(c3c(C)ccs3)=O)(=O)=O)c(C)cc2NC1=O,0 V018-1103,O=C(C(C1CCCC1)N(CC1)CCN1C(c1ccc(C(F)(F)F)cc1)=O)NCC1OCCC1,0 SD08-0411,O=C(C1CC1)NCc1c(COC(CCC2)(C3)CN2C(c2ncccc2)=O)n3nn1,1 Z1444301419,CCCCNC(C1(CCCCC1)NCc1nc2nc(C(F)(F)F)nn2c(OCC)c1)=O,1 J038-4286,CCOc(cc1)c(C([C@H]2[C@@H]3OCC2)Nc2c3cc(C)cc2C)cc1Br,0 F6414-3043,CC(C)(C)C(NCC(c(cc1)cc(OC)c1OC)O)=O,0 D051-0159,CC(C)Oc(cc1)ccc1C(N(Cc1ccc(C)o1)C(CC1)CS1(=O)=O)=O,0 F6708-9462,CC(C)(C1)CC1(C1)CN1c1ncnc2ccccc12,1 Z1579341963,CCc1nc(cccc2)c2n1C(CC1)CCN1C(NCC(N1CCCCC1)=O)=O,1 Z3914660889,NCc(cc1)cnc1NC(c1cc(O)ccc1)=O,0 F1911-4957,CC(C)(C)OC(N(C1)CC2(CO)C1CCCC2)=O,1 Z2195036182,NC(CC(CC1)CCN1C(C(c(cc1)ccc1Cl)O)=O)=O,0 L302-0848,CC(C)C(N(CC1(C)C)c(cc2)c1cc2S(N(CC1)c2c1cccc2)(=O)=O)=O,0 Z2952484934,Cc1nocc1NC(N[C@@H]([C@H](CC1)O)c2c1cccc2)=O,1 5682-0127,O=C(CN1CCC(Cc2ccccc2)CC1)N(CCC1)C2=C1c(cc(cc1)OCc3ccccc3)c1OC2=O,1 F3096-1648,COc1ccc(CCNC(c(cc2)ccc2Br)=O)cc1,0 F6514-4793,O=C1N(Cc2cn(C(C3)CN3S(Cc(cccc3)c3F)(=O)=O)nn2)CCC1,1 Z1020745768,Nc1nonc1-c1nc2cccc(Cl)c2s1,0 F5866-0137,Cc1ccnc(Oc(cc2)ccc2C(Nc(cc2)cc3c2OCO3)=O)n1,1 Y503-3784,Cc(n(C)nc1)c1S(N(CCC1)CC1C(Nc1c(C(NCc2ccco2)=O)n(C)nc1)=O)(=O)=O,1 L285-1616,Cc(ccc(-c(cc1)nnc1Nc(ccc(F)c1)c1F)c1)c1S(N1CCOCC1)(=O)=O,0 S868-0141,O=C(c1ccc2n1CCCN(Cc1ccccc1)C2)NCCN(CC1)Cc2c1cccc2,1 F6573-7615,O=C(NCc1cccc2ccccc12)N(CCN1c2cnccc2)CC1=O,1 Z2795226652,OC(C(C1CC1)N(CCC1)CCN1S(c(s1)ccc1Cl)(=O)=O)=O,1 L918-1883,N#Cc1cccc(S(N(CC2)CCC2c2noc(-c(cc3)ccc3Cl)n2)(=O)=O)c1,0 Z1874687357,Cc1c(CC(NCC(CCCC2)N2C2CC2)=O)c(C)nn1C(F)F,1 SC55-0093,Cc1noc(C)c1CCC(N(C1)CC1(CN(C)C1)C1c1nc(-c2ccccc2)n[nH]1)=O,1 V022-4428,CC(CN(CCCOC)CC(N(CC1)C(COc(cc2)ccc2F)c2c1scc2)=O)O,0 V016-8415,COc1cccc(CN(Cc(cc(cc2)NS(c3ccccc3)(=O)=O)c2OC2)C2=O)c1OC,0 F5796-1950,CC(C)NS(c1c(C)oc(C)c1C(NCc1ccco1)=O)(=O)=O,0 SA96-1437,CN(C)S(N(C1)CC1(CN(Cc1ccccc1)C1)C1C(NCC1CC1)=O)(=O)=O,0 S634-1803,Cc1c(CN(CCC2)CC2c([nH]cc2)c2C(NC)=O)scn1,1 S990-0688,Cc1noc(C)c1CCC(N(CCC1c2nc(C)no2)CCN1C(C1CCCC1)=O)=O,1 Z1320206849,Cn1ncc(CC2CN(CC(Nc(cc3)ccc3N3CCCCC3)=O)CC2)c1,1 Z1011053398,CC(C(NCCc1ccccc1)=O)N(CC1)CC1c1c(C)cccc1,1 F6807-6938,CCOC(N(CC1)CCN1c(ncc(C(F)(F)F)c1)c1Br)=O,0 Z5033315901,C[C@H]([C@@H](C(OC)=O)NC(C(CC(C1)O)N1C(c1cc(CCC2)c2cc1)=O)=O)O,0 F6476-5983,CS(N(CC1)CCC1C(N(CC1)CC1Oc(ccnc1)c1Cl)=O)(=O)=O,1 F6471-5593,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1)CCC1n1nncc1,1 F6266-0072,O=C(c1cc(cccc2)c2o1)N1C2COCC1CC2,1 L929-0436,CCCc1nc(cc(CCC(NCc(ccc(F)c2)c2Cl)=O)cc2)c2[nH]1,0 Z382880736,COc1c(C(CNC(c(cc2)cc(CCC3)c2NC3=O)=O)N2CCCC2)cccc1,1 SB74-0183,CC(C)N(CC1)C[C@@]1(C[C@@H](C(NCCc1c[nH]c(cc2)c1cc2Cl)=O)N1)C1=O,0 V005-9760,O=C(c1cccc(Br)c1)NC(CC1)CCN1c(cccc1)c1C(N(CC1)CCN1C1CCCC1)=O,0 SB59-0613,Cn1c(C2C(C3)(CN3C(c3cocc3)=O)CN(Cc3ccccc3)C2)nnc1,0 Z1518519614,CC1(COCC1)NC(c1cnc(-c(cccc2)c2F)s1)=O,1 F6523-0753,Cc1nc(S(NC(CC2)CCN2c2ncnc3c2CCCC3)(=O)=O)cn1C,1 P936-3717,O=C(COCc1ccccc1)N1CC(Cc2nncn2CC2CC2)CC1,1 F6492-0991,Cc1nc(CC(CC2)C(NCC3Oc(cccc4)c4OC3)=O)c2[nH]1,1 V027-4989,CCC(C)NC(c1nc2cc(-c3ccccc3)nn2c(-c(cc2)ccc2F)c1)=O,0 SB36-0586,Cc(nccc1)c1C(N(C1)[C@H](Cn2nnc(C(N3CCCC3)=O)c2)CC1(F)F)=O,1 Z1869718186,OC(CCN(CC1OCCC1)C(c1cncc2ccccc12)=O)=O,1 F2667-0116,CC(c1cc(S(Nc2cccc(Cl)c2Cl)(=O)=O)cc2c1N1CCC2)C1=O,0 Z2174522617,CC(C)(C)c1cc(CN(C)C(C(CC2)Cc3c2nnn3C)=O)n[nH]1,1 D531-0411,NC(C(S(c1c2cccc1)(=O)=O)=C2NCC1OCCC1)=O,1 F2373-0261,Cc(cc1)ccc1N(CC(CNC(Cc1cccc2ccccc12)=O)O1)C1=O,1 S063-0237,CCOc1nccnc1NC(CC1)CCN1C(C1OCCC1)=O,1 F6512-0651,COc(ccc(Cl)c1)c1C(Nc1cc2ccnn2cc1)=O,0 F5095-0846,O=C(CCCc1ccccc1)N(CC1)CCN1c1nccn1-c1cccc(Cl)c1,1 Z3687024994,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(CN(c(cccc1)c1OCC1)C1=O)=O,1 F2135-1543,C(c1cnccc1)Sc1nccc2ccccc12,1 F6473-2372,COc1ccc(CNC(N(C2)CC2n2nncc2)=O)cc1,1 Z1974312819,CC(C)(C)c1cc(C(N[C@H](CC2)C[C@H]2C(O)=O)=O)no1,0 Z2699063347,CCN(CC1)CCN1C(CC1)CN1c1nc(-c(cc2)ccc2F)no1,1 F6125-3118,O=C(C(C1)CN1S(C1CC1)(=O)=O)Nc1cccc(Cl)c1Cl,0 F6435-3309,Cc1csc(C(N(CC2)CC2(C2)Oc(cccc3)c3C2=O)=O)c1,1 F0554-0021,O=C(CSc1cn(CCNC(c2ccccc2)=O)c2c1cccc2)N(CC1)c2c1cccc2,0 T499-1804,Cn1c(nccc2)c2nc1C1CN(Cc2cccc(C(F)(F)F)c2)CC1,0 Z3686276853,Cc1cc(N[C@@H](CC2)CN2C(N(C)C(N2C)=O)=CC2=O)nc(-c2ncccc2)n1,1 F2289-0094,O=C(CSc1ccccc1)Nc1nnc(C2CCCCC2)o1,1 Z1627399552,Cc1cc(S(N)(=O)=O)cc(NC(c(cc2)ccc2-c2nn(C)cn2)=O)c1C,1 F0013-1165,CC(NCC(Nc(ccc(Br)c1)c1C(c1ccccc1)=O)=O)=O,0 F6436-1868,Cn1c(CN(Cc2cccs2)C(c(cccc2)c2S(C(F)F)(=O)=O)=O)ccc1,0 F6378-0114,O=C(C(COC1)N(Cc2cccs2)C1=O)NCCC1=CCCCC1,1 Z1616949864,CC(C)(C1)OC(C)(C)C1NC(C(CC1)CCN1S(N)(=O)=O)=O,1 Z2982740155,CCc(cccc1)c1-n1nnc(CN(CCN2)CC2=O)c1,0 E644-0342,CCC(C)NC(c(cc1)ccc1-n1c(CCC(C)C2)c2cc1C)=O,0 Z1995279464,Cc1c[nH]nc1C(Nc1ccc(Cc2ccncc2)cc1)=O,0 Z343768890,O=C(c1ccc(C(F)(F)F)cc1)N(CC1)CCN1C(c(ccc(Cl)c1)c1Cl)=O,0 Z2435897108,Cc1cccc(CCN(CC2)CCN2C(C2CC2)=O)n1,1 F6666-5461,FC(F)(F)Sc(cc1)ccc1NCc1cccs1,0 P174-0266,Cc1n[nH]c(-c2cc(S(N(CC3)CCN3c3ccccc3)(=O)=O)c(C)o2)c1,1 F6806-4781,Cc1nc(CCC2)c2c(N(CC2)CCN2c2nc(-c3cn(C)nc3)cnc2)n1,1 F1912-1540,CN(C)c1cc(N(C2CC2)C2CCNCC2)ncn1,0 SA70-0683,Cc1nc(C(CCOC)(CCC2)CN2C(Nc(cccc2)c2Br)=O)no1,0 Y044-4477,O=C(CC1Oc(cccc2)c2NC1=O)NCCc1nc(-c2ncccc2)no1,1 Z1318903328,Cc1ccc(C(COC)NC(c2cc(COCC3)c3s2)=O)o1,0 F6412-1874,O=C(c1nccnc1)NCC#CCOc1cccc(C(F)(F)F)c1,0 V001-7655,CCNC(N(CC1CC1)Cc(c(C(C)C)nn1-c2ccccc2)c1Oc1cccc(F)c1)=O,0 CM2642-1651,CN(CC1OCCOC1)C(c1nn(CCOC)c2c1CNCC2)=O,1 Z756853772,CC(c1c(C)n(C)nc1)NC(c1c[nH]nn1)=O,0 T654-0299,O=C(C1(CC1)c1ccccc1)N(C(C1)c2noc(C3CCOCC3)n2)c2c1cccc2,1 F6760-1829,O=C(c(cc1)nn2c1ncc2)N(CC1)CCN1c1ncccn1,1 F6656-1181,O=C(c1csc(-c2ccccc2)n1)N1CCC(CN2N=C(CCC3)C3=CC2=O)CC1,1 Z2232120160,CC(C(N1)=O)(c(cc2)ccc2C(N(CC2)[C@@H](c3ccccc3)c3c2cccc3)=O)NC1=O,1 Z898989832,COc(cccc1)c1C(Nc(cc1)cc(C(F)(F)F)c1F)=O,0 S614-1168,CNC(N(CCCC1)C1c1nc(CCOCC2CCOCC2)no1)=O,0 G783-0318,O=C(C1OCCC1)N(CC1)CCN1c1nc(-c(cc2)ccc2Cl)no1,1 Z1551981977,CC(N(CC1)CCN1C(C(C1CC1)c1ccccc1)=O)=O,1 Z4917830981,COC(COc1cccc(C(Nc2ncnc(-c(cc3)ccc3OC)c2)=O)c1)=O,0 Y043-2480,N1(C(c2c(C1)cccc2)=O)[C@H](C(=O)NCCn1c2c(cc1)ccc(c2)Br)C,1 F6573-6263,O=C(COc(cc1)ccc1Cl)N(CC1)CCC1(C1)C1(F)F,0 G505-0068,Cc(cc1)ccc1S(N(CCC1)c(cc2)c1cc2NS(c(cc1)cc(F)c1OC)(=O)=O)(=O)=O,0 Z2961890539,CC(C(NCc1cc(C(F)(F)F)nn1C)=O)Oc1ccccc1,0 F6617-6498,O=C(C(CC1)CCN1c1nccn2nc(CCCC3)c3c12)Nc(cccc1)c1F,1 F6761-7730,COc1cc(NC(N(CC2)C(C3)C2CN3c2nccc(C(F)(F)F)c2)=O)cc(OC)c1,1 Z1543535638,COc1cccc(C(COC(C(C=CC2=NN3)=CN2C3=O)=O)=O)c1,0 F6514-7002,CC(C)C(Cn1nccn1)NC(c(cc1)ccc1N(C)C)=O,0 F0687-0490,CC(Nc1ccc(CC(N(CC2)CC2c(cccc2)c2OC)=O)cc1)=O,0 F6782-7204,Cc1c(C)cc(CN(CC(CN(C2=O)C(SC)=Nc3c2scc3)C2)C2=O)cc1,1 E786-1870,COc(ccc(NS(c1ccc(CN(C(c2c3nccc2)=O)C3=O)s1)(=O)=O)c1)c1OC,0 F584-1512,Cn1nc(C(N2CCOCC2)=O)c(C2)c1CCN2C(Nc(ccc(Br)c1)c1F)=O,0 F6359-4224,O=C(c1cscc1)N(CC1)CCC1Oc1nc2ccccc2nc1,1 Z2196887619,CC(C)C(C)(CNS(c(cc(cc1)C(O)=O)c1OC)(=O)=O)O,0 Z3346913947,CC(CC1)Cc2c1nc(-c(cc1)cnc1F)s2,0 Z4995242125,CC(C(c1cc2ccccc2cc1)NC(c1nc2ccnn2cc1)=O)N,1 Z3019168389,Cc1c(C)sc(NC([C@](C2)(C[C@@H]2N)c2ccccc2)=O)n1,1 Z4969954538,CCOC(CCC1)C1S(NCCc1csc(C(C)C)n1)(=O)=O,0 L309-1207,CCC(C)NS(c(cc1)cc(N2Cc3noc(C4CCC4)n3)c1OCC2=O)(=O)=O,0 Z1289512898,CN(CCCO)C1CCN(Cc(cc2)nn2-c(cc2)ccc2F)CC1,0 Z2963308456,Cc(n(C)nc1C)c1-c1n[nH]c(C(N2C(CC3CC3)COCC2)=O)c1,1 Z3482433451,O=C(c1cc(NC(NC2)=O)c2cc1)Nc1cnccc1,1 Z1953015034,CC(CN(CC1)CC(C)N1C(Cc1cn(-c2ccccc2)nc1-c(cc1)ccc1F)=O)O,1 F6296-1168,Cn(c(CNC(C(CC1=O)CN1c(cc1)ccc1F)=O)c1)nc1-c1cccs1,1 Z1190325817,NS(c1cccnc1NCC1(CCOCC1)c(cc1)ccc1Cl)(=O)=O,0 Z286658828,CN(Cc1c(C(F)(F)F)cccc1)CN(c(cccc1)c1C1=O)C1=O,0 Z2900718722,CN(C)CCC(CC1)CN1C(c1cc2cccc([N+]([O-])=O)c2[nH]1)=O,0 1683-6891,OC(C(C(c1ccccc1)c1ccccc1)c1ccccc1)=O,1 C259-1147,CCC(N(CCc1c2)c1cc(S(N(CCC1)CC1C(NC1C(C)CCCC1)=O)(=O)=O)c2Br)=O,1 G856-6440,O=C(CSc1nnc(cc2)n1nc2-c1ccccc1)N(CCC1)c2c1cccc2,0 F6549-3739,Cn1nccc1C(CCCC1)N1C(CSCc1ccccc1)=O,1 SA02-0173,Cc1ncc(COC)c(C(CC2)CCN2C(C2(CC2)c2ccccc2)=O)n1,0 F2416-0506,O=C(c1ccco1)N(CC1)Cc2c1ccc(NC(c(cc1)cc3c1OCO3)=O)c2,1 SC44-0369,Cn1c(C(N(CC2)CCC2(C2)OCCC2OCC(N2CCOCC2)=O)=O)cnc1,1 F6442-1271,CN(C(C=C1)=O)N=C1C(N(C1)CC1S(C1CCCCC1)(=O)=O)=O,1 S511-0555,O=C(CC1CC2(CCN(Cc(cc3)cc4c3OCC4)CC2)OCC1)N1CCOCC1,1 Z2900719186,CC(C)(C1C=C(C)C)C1C(NCCc1nnc2n1C=CNC2=O)=O,1 F5871-1975,CCCCOc(cc1)ccc1C(NCc1nc(C)no1)=O,0 F6525-0263,Cn1nc(CCC2)c2c1CNC(N1CCOCC1)=O,1 F6482-6168,O=C(NCc1cc(-c2ccncc2)ncc1)Nc(c(F)ccc1)c1F,1 Z4220662625,CC(C(C(F)(F)F)NC(c1c(CCN2)c2ncc1)=O)O,0 S903-0808,CC(C)S(N(CC1)CCC1c1nnc(C2)n1CCN2C(COc1ccccc1)=O)(=O)=O,0 Z1014444306,CC(C)c1nc(cc(cc2)NC(Cc3c[nH]c4c3ccc(C)c4)=O)c2o1,0 Z2439866338,O=C(c1cn(-c2ncc(C(F)(F)F)cc2)nn1)N1CCNCCC1,1 V010-9031,Cc1cc(C2=C(C)N=C(C(OCC(c(cc3)ccc3Cl)=O)=CC=C3)N3C2=O)nn1-c(cc(cc1)F)c1F,1 Z3254824245,O[C@@H](CCC1)[C@H]1n1nnc(C(c2ccccc2)=O)c1,1 F6471-1154,CS(N(C(CC1)C2)C1CC2NC(CCc(c(F)ccc1)c1Cl)=O)(=O)=O,0 L567-0285,CC(CCC1)(CN1S(c(cc1)cc(Cl)c1F)(=O)=O)C(NCc(cc1)ccc1F)=O,0 F6559-2299,Cn1c(cccc2)c2c(CC(NCc2nnc(C3)n2CCC3C(F)(F)F)=O)c1,1 G540-1014,Clc(cc1)ccc1-c1csc2ncnc(NCCCN(CC3)CCN3c3ccccc3)c12,0 CM4573-0960,COc(cc1)cc(-c2n[nH]cc2CN(C2)[C@H](CN3CCCCC3)CC2(F)F)c1OC,1 Z2157299344,CCN(CC)c(cc1)cc2c1nc(NC(c1cc(C)nn1CC)=O)s2,0 F6381-4621,O=C(c1ncccc1)N(CC1)CCC1(CC1)Oc2c1cccc2,1 V016-9472,COCCCN(CC(COCc1ccccc1)O)Cc1c(N2CCCC2)onc1-c1ccccc1,0 Z2900720788,O=S(c1cn(C2CCCC2)nc1)(N(CC(F)F)CC(F)F)=O,0 K292-1867,O=C(c1ccc(CN(C(c(scc2)c2N2)=O)C2=S)cc1)NCCC1=CCCCC1,1 F6514-4523,Cc(nc1)cnc1C(N(C1)CC1n1nnc(CN(CCC2)C2=O)c1)=O,1 Z2910803997,O=C(C(CC1=O)CN1c1ncccc1)NOCc1ncccc1,1 Z1132076663,CCc(cc1)ccc1NC(N(CC1)CCN1c1nccc(OC)c1)=O,0 F2672-0022,CN(CC1)CCN1C(CNC(Cc(cc1)ccc1F)=O)c(cc1)ccc1OC,0 F6756-2578,O=C(C(CN(C1)c2ncnc3c2cc[nH]3)C1C1=O)N1c1ccccc1,1 V023-2200,COc1ccc(CN2CC(COc(cc3)ccc3OC)OCC2)cc1,0 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S997-1825,OC[C@](CN(Cc1ccccc1)C1)(CC2)[C@H]1CN2S(c1cc(F)cc(F)c1)(=O)=O,0 E793-3712,OC(C1CCC(CN(C2=O)C(SCC(NCCCc3ccccc3)=O)=Nc3c2scc3)CC1)=O,0 Z1105575623,O=C(C(CCC1)c2c1cccc2)N(CC1)CCC1C1NCCC1,1 F6560-2333,CN(C=CC=C1C(NCc2cn(-c3ccncc3)nn2)=O)C1=O,1 F6725-2303,CCc1cnc(NCc(cc2)cnc2-c2cocc2)nc1,1 Z2198024264,O=C(CCc1nc2ccccc2cc1)NCC(NCC1CC1)=O,1 S535-0422,O=C(Nc(cc1)cc2c1OCCO2)N1CCC(CN2CCOCC2)CCC1,1 V015-1352,O=C(c1nc2ccccc2nc1)N(CCc1nc(N2CCCCC2)n2)Cc1c2Oc1ccccc1,1 Z1698660291,Cn(c(OC(F)F)c1)nc1C(NCc1cccc2ccccc12)=O,1 F6468-0023,O=C(c(cccc1)c1Cl)Nc(cc1)ccc1-c1csc(Nc2cnccc2)n1,1 Z119737566,CCNC(N(CC1)CCN1C(c1cccc2ccccc12)=O)=O,0 Z2004769513,CC(C(N(CC1)CC1(c1cc(C)cc(F)c1)F)=O)c1c(C)[nH]nc1C,0 7706-0448,CCN(CC)CCNc1nc(N(C)C(N(C)C2=O)=O)c2n1CC(COc1cc(C)ccc1)O,0 Z1233553779,CCNC(N(CC1)CCN1C(c1nc(-n2nccc2)ccc1)=O)=O,1 Z1560711219,N#Cc(cc1)ccc1C(CC1)=CCN1C(c(cc1)ccc1-n1ncnc1)=O,0 Z838108638,CS(N(CCC1)CC1Nc1ncnc2ccccc12)(=O)=O,0 F5486-0533,O=C(Cc(cccc1)c1Cl)Nc1c(CSC2)c2nn1CC(NCc1ccco1)=O,1 Z2444281355,Cn1c(N(CC2)C[C@H]2Oc2ccccc2)nnc1-c1cccc(S(C)(=O)=O)c1,0 Y043-8436,O=C(CC(c1cscc1)n1cccc1)N(CCC1)C1c1nc(cccc2)c2[nH]1,1 F2573-0036,CC(C)(C)NC(NCC(c(cc1)cc2c1OCO2)N1CCN(C)CC1)=O,0 F6178-2218,Cc(cc1)nnc1N1CCC(CNS(c(cccc2)c2Br)(=O)=O)CC1,0 SC19-0338,CCn1nc(CN(CCC2)CCN2C(c2c(C)nco2)=O)c2c1CCOC2,1 Z1389452941,Cn1c(C(Nc2ccc(Cn3ncnc3)cc2)=O)cc(C(N)=O)c1,1 F6192-0857,CC(c1ccccc1)NC(C(NCC(c1ccco1)c1cccs1)=O)=O,1 SC85-0559,Cc1noc(C)c1CN(C1)C[C@]2(CN(C)CC2)[C@@H]1c1nc(-c(cc2)ccc2F)no1,1 Z2770714344,CC(NC(CC1)CN1c1c(c(-c2cccs2)cs2)c2ncn1)=O,1 Z1742937076,CC(C)(C)n1c(NC(c2ncncc2)=O)nc2c1cccc2,0 D154-0450,COc(cc1)cc(C(CN(CC2)CCN2C2CCCCC2)=C2)c1OC2=O,0 S698-2620,Cc1cnc(C2OCCC2)n1C(CC1)CCN1S(c1cc(CCC2)c2cc1)(=O)=O,1 F3385-6018,COC(c(cc1)ccc1OC1=C(C(F)(F)F)Oc(c(C2)c(cc3)OCN2C2CC2)c3C1=O)=O,1 SC03-0457,Cc1c(CN(CC2)CCC2OCCc2noc(C3CCOCC3)n2)cnn1C,0 F6514-4048,O=C(Cc1cnccc1)N(C1)CC1n1nnc(COc2ccccc2)c1,1 F6808-1031,Cc(ccc(Cl)c1)c1N(CC1)CCN1c(cc1)nn2c1nnc2C1CC1,0 F6605-3375,Cc1cc(C)nn1-c1ncnc(N2CC(CN(CCn3nccn3)C3)C3C2)c1,1 C795-0685,CC1CN(CCCNC(CN(C2=O)N=Cn3c2ccc3)=O)CC(C)C1,0 Z4519653505,CCC(C(Nc1c[nH]nc1-c1nccs1)=O)Oc(cccc1)c1F,0 F6754-5196,FC(c1cc(N(CC2)CC2(F)F)ncn1)(F)F,0 F3406-3576,COc(cc1)cc2c1[nH]c1c2ncnc1SCC(N(CC1)CCN1c(cccc1)c1F)=O,0 Z414534778,CN(CC1)CC(c2ccccc2)N1S(c1c(C(F)(F)F)cccc1)(=O)=O,0 Y207-3697,O=C(CN1CC(CCC2)N2CC1)Nc(ccc(Br)c1)c1Cl,0 G856-9017,O=C(c1nc(cccc2)c2s1)N(CC1)CCN1c1nc(ccc(F)c2)c2s1,0 F6312-0124,O=C(c(cccc1)c1F)NCCCn1c2ncccc2cc1,0 Z1620700158,O=C(C(CCC1)N1C(c1ccccc1)=O)N1CC(Cc2ccccc2)C1,1 F6725-1310,Clc1cnc(N(C(CC2)C3)C2c2c3[nH]nc2)nc1,0 F6658-5707,O=C(c1nccnc1)N1CCC(COc2ncnc(C3CC3)c2)CC1,1 Z4857137611,OC(CN(Cc1ccccc1)Cc(cc(cc1)O)c1Cl)C(F)(F)F,0 Z3016339168,CCC1(CC1)c1noc(C(C)c2cn(C)nc2)n1,0 F902-0168,Cc1noc(-c2cc(S(N(CC3)CCN3c3ncccn3)(=O)=O)c(C)s2)c1,1 F6518-6063,Cc(cccc1)c1NC(NCCc(cc1)ccc1-c1cn(C)nc1)=O,1 P132-0434,O=C(c(cc1)ccc1-c1nccnc1N1CCCC1)NCc(cc1)ccc1N1CCCCC1,1 Z1444352413,CC(C)Oc(ccc(C(O)=O)c1)c1NC(COC)=O,0 Z1314960695,Cc1c(C(NCC2CCN(CCN(C)C)CC2)=O)oc(-c2ccccc2)n1,1 8563-0897,O=C(CC(C(NCC1)=O)N1C(c1cccs1)=O)N(CC1)CCN1c1ccccc1,1 F5857-0797,Cn1c(C(CNC(CN(C(CC2)=O)C2=O)=O)O)ccc1,1 F6480-3257,Cc1nc(OC(CCC2)CN2C(CSc2c[nH]c3c2cccc3)=O)nc(C)c1,1 Z1492646394,CNC(c1ccc(CN(CC2CC(N(C)C)=O)c(cc3)c2cc3Cl)cc1)=O,0 S558-0464,CCOc1cccc(CN(CC2)CC2Oc(cccc2)c2-c2nc(C3CCOCC3)no2)c1,1 Z3055835829,O=C(C1C2(CC2)C11CC1)Nc1cccc2c1CN(C(CCC(N1)=O)C1=O)C2=O,1 SB52-1130,CN(CC1(C2)CCN(Cc3cccc4cccnc34)CC1)C2c1noc(C2CCC2)n1,1 S828-1841,FC(C1)(CN(Cc2cocc2)[C@@H]1c1nnc(-c2nccnc2)o1)F,1 SA24-1161,N#Cc1cccc(S(N(C2)CC2N(C2)[C@H](CO)CC2(F)F)(=O)=O)c1,0 L928-0145,O=C(C(CC1)CCN1c1ncnc2c1oc1c2cccc1)N1CCC(Cc2ccccc2)CC1,1 Z45642316,CCN(CC)C(c(cc1)ccc1NS(c1c(C)cc(C)cc1C)(=O)=O)=O,0 L309-0828,O=C1N(Cc2noc(C3CC3)n2)c(cc(cc2)S(NC3CCCC3)(=O)=O)c2OC1,1 Z2864059695,CCC1(Cn2nnc(-c3csc(-c4cn(C)nc4)n3)c2)COC1,1 Z2098109826,CCCC(NC(CC1)CCN1C(c(cc1)cc2c1ncn2-c(cc1)ccc1Cl)=O)=O,0 F0674-0058,O=C(CSc1ncnc2ccccc12)Nc(cc(C(F)(F)F)cc1)c1Cl,0 E957-0115,CC(C(Nc1c(C(N(CC2)CCN2c2ccccc2)=O)oc2c1cccc2)=O)Oc1ccccc1,0 Z1850730862,Fc(cc1)cc(F)c1-n1nc(CN(CC2)CCC2c2nnc[nH]2)cc1,1 Y041-8474,Cc1cccnc1NC(CCC(N(CC1)CCC1c1noc(cc2)c1cc2F)=O)=O,1 F6230-0021,CN(C=CC=C1C(NCc2c(cccc3)n3nc2)=O)C1=O,1 Y020-5078,CC(C)(CC1(C)c(cc2)ccc2Cl)Nc2c1cccc2,0 F2145-0086,CS(c(cc1)cc2c1nc(NCC1OCCC1)s2)(=O)=O,0 F5083-0276,O=C(C1CC1)Nc1noc2nc(-c3ccccc3)cc(C(F)(F)F)c12,1 F249-0637,CCC(CN(C)Cc1ccccc1)NC(C(CC)n1c(C(N(C)N=C2)=O)c2c2c1cccc2)=O,0 Z1656442027,CC(C)c(cccc1)c1Oc(cccc1)c1C(NCC1(CS(C)(=O)=O)CC1)=O,0 S698-1484,Cc1cnc(-c2ccncc2)n1C(CC1)CCN1S(c1c(C)onc1C)(=O)=O,1 S996-0267,CS(N(C1)C[C@]2(CO)[C@H]1CCN(Cc1ccco1)C2)(=O)=O,0 Z2359196265,C[C@](C1)(C[C@@H]1NS(c1cc(Cl)cc(Cl)c1)(=O)=O)O,0 SA89-0271,Cn1c(C(N2CCC(CN(CCN3CCOCC3)C3CCOCC3)CC2)=O)ccc1,1 SC97-0081,CC(C)N(CC1)CC(CC2)(CN2S(c2cn(C)cn2)(=O)=O)NC1=O,1 F6374-1736,COc(cc1)ccc1SCC(CC1)CCN1C(CN(C(CC1)=O)C1=O)=O,1 Z1651480969,NC(C1CN(Cc2cccc(CNC(c3cn(CCC(F)(F)F)nc3)=O)c2)CCC1)=O,0 T655-0095,CC(C)c1nnc(C(CN(C2)C(c3c(C)ccnc3)=O)C22CCOCC2)o1,1 8018-1026,O=C(CCC1)N1c(cc1)ccc1S(N(CC1)CC1c1ccccc1)(=O)=O,1 F322-0825,Cc1c(-c2c(C)sc(C)c2S(NC2CCCCCC2)(=O)=O)onc1C,1 Z223-0562,O=C(Cn1ncc2c(N3CCOCC3)ncnc12)N(CC1)CCN1c1ncccc1,1 G115-0399,O=C(C=C1)NN=C1c(s1)ccc1S(N(CC1)CCN1c1ncccc1)(=O)=O,1 Z976264498,O=C(c(cc1)ccc1S(N1CCCC1)(=O)=O)N(CC12CCCC2)c2c1c(F)ccc2,1 F6471-7240,O=C(Cc(c(F)ccc1)c1Cl)NCCCc1conc1,1 F5860-1671,O=C(Cn1nccc1)NCc(cc1)ccc1OCc1ccccc1,1 Z5020305726,Cc(cc1)cnc1-c1ccc(cc(cc2)O)c2c1,0 SC66-0599,CCn1c(C(CN(C2)C(c3c(C)nco3)=O)C22CCOCC2)nnc1,1 F6559-2037,CC(C(NCc1nc(C2CCSCC2)no1)=O)NC(OC(C)(C)C)=O,1 SB21-1100,CN(C)C(c1cn(C[C@H](C[C@@H](C2)F)N2C(Nc(cc2)cc(Cl)c2F)=O)nn1)=O,0 S398-0033,Cn1nc(C(NC2CC2)=O)c(C2)c1CN2C(c1cccs1)=O,1 F6802-8079,O=C(C(CCC1)CN1c(c(C(F)(F)F)c1)ncc1Br)N1CCSCC1,0 F6245-4990,CN(C1=O)N=C(C(CCC2)CN2C(c(s2)ccc2Cl)=O)N1c1ccccc1,1 Z2804867922,CC(C)n(cc1)nc1C(N[C@H](C)c1cnc(C(F)(F)F)cc1)=O,0 F2640-0118,CCS(c1nc(cccc2)c2n1C/C=C/c1ccccc1)(=O)=O,0 Z2987058669,CCn1c([C@H]2OCCC[C@@H]2NC(c2cccc(Cl)c2)=O)ncc1,0 Y205-1034,O=C(C(C1)C1c1ccccc1)Nc1nnc(-c2cnccc2)s1,1 Z1588185142,CCc1cc(C(N(CC2)c3c2cc(C)cc3)=O)ncc1,0 F154-0339,O=C(c1ccc(Cn2c(SCc(cc3)ccc3Cl)nc3c2cncc3)cc1)NCCCN(CCC1)C1=O,1 SD08-0497,CN(C)C(NCc1c(COC(CCC2)(C3)CN2C(c2nc4ccccc4cc2)=O)n3nn1)=O,1 Z4143129332,CC(C)c1cccc(-c2ccc(C(N(C[C@@H](C3)[C@@H]4O)C[C@H]3[C@H]4O)=O)o2)c1,1 Z2983004446,CC(C)(CC(N1CC(C2(CCOCC2)O)O)=O)C1=O,1 F6478-0584,Cc1nc(OC(CC2)CN2C(CSC2CCCC2)=O)nc(C)c1,1 F6245-3138,Cc1nnc(C(CC2)CCN2C(CC(CSC2=NC(C)=C3C)N2C3=O)=O)s1,1 S555-0071,Cn1c(C(N2Cc(cc(cc3)N4CCOCC4)c3OCC2)=O)ccc1,1 F6679-0103,Cc1nnc(cc2)n1nc2N(C1)CC1n1c(cccc2)c2nc1C1CC1,1 F6818-0784,Cn1c(N(CCC2)CCN2C(c2c3cccc2)=NS3(=O)=O)nc2c1cccc2,1 F431-0073,CN(c(c(N1C)c2)cc(NC(c(cccc3)c3Br)=O)c2SC2CCCCC2)C1=O,0 S836-2467,CNC([C@@H](C1)[C@@H](COC)CN1C(c1ccc(Cn2cncc2)o1)=O)=O,1 F6724-4477,OC(CNc(nc1)ncc1Br)(CCC1)c2c1occ2,1 F5033-0818,COc(ccc(Cl)c1)c1C(NCC1CCN(Cc2ccco2)CC1)=O,0 P271-0641,O=C(C(CC1)CCN1c1cc2nccnc2nc1)N(CC1)CCN1c(cc1)ccc1Cl,0 Z1175804307,O=C(CN(C=CC=C1)C1=O)NCCc1nc(C2CCCCC2)cs1,0 Z1480918093,Cc1cc(N(C(CC2)=O)N=C2C(NOCc2cnccc2)=O)c(C)cc1,0 Z1091706350,COc1cc(CCN(CC(NC2CCOCC2)=O)C2c3cccs3)c2cc1OC,1 Y205-0994,CCC(C)(C)c(cc1)cc2c1c(C(NC(C)C1OCCC1)=O)cs2,1 S835-1558,Cc1nn(C)c(CN(CC2)CCC2(C2)OCCC2O)c1,0 F6619-7288,CN(C)c1ccc(N(CC2)CCN2c2ncnc3c2ncn3C)nn1,1 F5097-0743,COc1ccc(CCC(Nc2ccc(CC(NC3CC3)=O)cc2)=O)cc1,0 Z1250578093,O=C(Cc1nocc1)N(CC1)c2c1cccc2,0 SB70-0034,CN(C)[C@@H](Cc1c2)Cn1nc2C(NCCCc1nc(cccc2)c2[nH]1)=O,1 F6726-0514,Cc1cc(C)nn1-c1cc(OCC(CC2)CCN2c2cc(C)nc3ncnn23)ncn1,1 Z1582996410,C[C@H](CCNC(C)c(cc1)ccc1-c(cccc1)c1OC)O,0 F6287-0657,Cn1c(CCNS(c2cc(CCCC3)c3cc2)(=O)=O)nc(-c2cccs2)c1,1 Z1097488532,CCc1n[nH]c(NC(Cc2cn(cccc3)c3n2)=O)c1,1 Z2595770125,OC([C@H](CCC1)[C@H]1NC(c(cc1)ccc1N(CCN1)C1=O)=O)=O,1 L712-0527,COc(cc1)cc(OC)c1NC(N1CCN(CCn2c(-c3ccncc3)nc3cccnc23)CC1)=O,0 S607-0081,Cc1c(C(N(CCC2)C[C@H]2N(c2ncccc2N2C)C2=O)=O)sc(C)n1,1 P658-0765,O=S(c1cc(-c2nnc(C3CCC3)o2)co1)(N(CC1)Cc2c1cccc2)=O,1 Z2947328857,NC(NC1CCN(C[C@@H]([C@@H]2c3ccccc3)C2(F)F)CC1)=O,1 F6517-3810,OC(CNC(C1CC=CCC1)=O)c(cc1)ccc1-c1ccco1,1 T502-0566,O=C(C(CC1)(CCN1S(c1cccc2nsnc12)(=O)=O)F)N1CCOCC1,1 Z1995137069,CC(CCNC1=O)C1NC(N(CC1)CCN1c1cccc(C(F)(F)F)c1)=O,0 S259-1527,Cc1noc(C)c1CN(CCC1)CCN1C(C1CNCCC1)=O,1 F6204-0910,O=C(c(o1)ccc1Br)NC1(CCOCC1)c1cccs1,1 Z2970804906,Cc1c(CNC(NC2CC(CCO)C2)=O)oc2c1cccc2,1 Z4497727194,O[C@H](C[C@H]1C(NC2CC(c3ccncc3)OCC2)=O)CN1C(OCc1ccccc1)=O,1 F6560-0809,O=C(c(cccc1)c1Br)NC(C1CCOCC1)c1cccs1,1 F6727-2357,CN(C(C1)CN1c1nn2c(-c3cnccc3)nnc2cc1)S(c1cc(F)ccc1)(=O)=O,1 Z2974175909,Cc1c(C)nc(C)nc1N(CCC1)CCC1n1nncc1,1 SC88-0638,COCCNC(N(C1)CC1(C(CC1)c2nc(-c(cc3)ccc3F)no2)S1(=O)=O)=O,0 Z403721628,O=C(C1(CCCC1)c1cc(C(F)(F)F)ccc1)NCCN(CC1)CCS1(=O)=O,0 F6525-5681,O=C(c1cocc1)NCCn1ncc(-c2ccncc2)c1,1 F2224-0144,Cc(cc(cc1)N(C(C)=Nc2c3cccn2)C3=O)c1NC(c(o1)ccc1Br)=O,1 Z4119276083,N#Cc1cccc(C(NCCc2nn(-c3ccccc3)nc2)=O)c1,0 S595-0508,O=C(COc(cc1)ccc1F)N(CCCC1)C1c1noc(COc(cc2)ccc2F)n1,1 S423-0455,C(c1ccccc1)OC1CC2(CCNCC2)OCC1,1 E135-0563,CN(C(C(Nc1cn(Cc(cc2)ccc2F)nc1)=O)=CC(c(cc1)ccc1F)=N1)S1(=O)=O,1 F6161-0404,COc(cc1)ccc1C(N=CN1CCNC(COc2cccc(C(F)(F)F)c2)=O)=CC1=O,0 F3406-9255,Cc1ccc(Cn2nnc(-c3noc(-c(cc4)ccc4OC)n3)c2)cc1,0 Z2879497893,CC(c1nc(-c2nccc(OC)c2)no1)n1nc(C(F)(F)F)cc1,0 T831-0219,CC(C)C(NCC(CC1)CCN(Cc2ccccc2)C1=O)=O,1 F6560-7420,O=C(CSCc1ccccc1)NCc(cc1)cnc1-c1cocc1,1 F1589-0304,O=C(C(Cc1c2cccc1)OC2=O)Nc1cc(Cl)c(C(F)(F)F)cc1,0 F6709-3597,O=C(Cc1ccccc1)N(C1)CC1Oc1ccncc1,0 Z4288458052,CC(C1CC1)N(Cc1ccccc1)C(C(C=C1C)=CNC1=O)=O,1 E203-1080,Cn1c(C(Nc(ccc(F)c2)c2F)=O)cc(S(N(CC2)c3c2cccc3)(=O)=O)c1,1 SD49-0026,CN1CC2(CN(Cc3c(C(F)(F)F)cccc3)C2)C(CCC(N2CCOCC2)=O)C1,1 Z1141405082,CC(C)C(N(CC1)CCN1C(NC(C1)CC1(C)c1ccccc1)=O)=O,0 Z1603504171,CC(C)OCC(Nc(cc1)c(C)cc1OCC(O)=O)=O,0 F538-0315,CC(C)NC(Nc1cccc(-c2noc(C(CC3=O)CN3c3ccc(C)cc3)n2)c1)=O,0 F6415-1505,COC(c(cc1)ccc1S(N(CCc1cccs1)Cc1cocc1)(=O)=O)=O,0 Z1445537719,OC(C(CNC(c1cccc(N(CCC2)C2=O)c1)=O)c1ccccc1)=O,1 F6713-5438,N#Cc1nc(N(CC2)CCN2c2ncnc(C3CC3)c2)ccc1,1 F6230-0207,COc1ccc(CCC(NCc2c(cccc3)n3nc2)=O)cc1,1 Z2437476794,OC(c1ccc(CS(N(CC23CC3)c3c2cccc3)(=O)=O)cc1)=O,1 F6782-7494,CC#CCN(C=CN(Cc(cc1)ccc1F)C1=O)C1=O,0 Z4511729903,Cc(ccnc1)c1NC(Cn(cc1)c2c1ccc(F)c2)=O,0 F6573-3255,O=C(c(cccc1)c1Cl)NCCOCCn1cncc1,0 Z2295156283,OC(C(CC1)CN1C(CCN1c(ccc(Cl)c2)c2Cl)C1=O)=O,0 Y042-3657,O=C(C(CC1=O)CN1c(cc1)ccc1Br)Nc1ccc(Cn2ncnc2)cc1,0 F1885-0461,CSc1nnc(CNC(c2cc(C(F)(F)F)ccc2)=O)o1,1 Z2008089015,Cn1c(N(CC2)CCC2C(Nc2nccnc2)=O)nnc1-c(ccc(Cl)c1)c1Cl,1 Z2965031884,CC(CCN1)(C1=O)NC(c1cc2nc(C)cn2cc1)=O,1 Z2021034917,NC(NC(c1cccc(NC(CN(C(C(CCC2)(c3c2cccc3)N2)=O)C2=O)=O)c1)=O)=O,1 E715-0039,O=C(C(CCC1)CN1c1ncnc2c1nc1n2CCCCC1)NC1CCCCCC1,1 V013-8842,COc1cccc(-c2n[nH]c(-c(cc3)ccc3C(NCc(cc3)cc(F)c3F)=O)c2)c1,0 8019-4671,COC(CCC/C=C(\[C@H]1O)/SC[C@H]1NC(c1ccccc1)=O)=O,1 F6549-8829,O=S(c(cccc1)c1Cl)(N(C(CC1)C2)C1CC2Oc1cnccc1)=O,0 Z3016325381,CC(C)[C@@H](CO)NC([C@H](CC1)CC[C@H]1Nc1ncccc1)=O,0 Z2107195420,CC(CNC(Nc1cc(Oc2ccncc2)ccc1)=O)(CO)c1ccccc1,0 C648-0014,CN(c(ccc(S(N(CCC1)CC1C(NCCC1=CCCCC1)=O)(=O)=O)c1)c1O1)C1=O,1 Z2625405837,O=C(Nc1nc(C2CC2)ns1)N(CC1)CCC1N(CCC1)C1=O,1 C096-0479,CC(CC1)CCN1S(c1c(C)sc(N=CN2CC(NCC3OCCC3)=O)c1C2=O)(=O)=O,1 S782-3224,CCCNC(N(CCCCCCN1C)CCC1=O)=O,1 F2368-0349,COc1cccc2c1oc(C(Nc1nnc(Cc(cc3)ccc3F)o1)=O)c2,1 F6754-9209,COc(ccc(CCNc1ncnc2c1CCCC2)c1)c1OC,0 D677-0727,O=C(c(cc1)ccc1-c1noc(C2CC2)n1)NCc1noc(-c2ccco2)n1,1 F5854-4146,O=C(c1c(C(F)(F)F)cccc1)N(Cc1cscc1)C1CC1,0 Z3027353749,COCCCc1nc(-c2csnc2)cs1,1 F6374-5493,O=C(c1c[nH]c2c1cccc2)N1CCC(CSCc2ccco2)CC1,1 Z1950264115,O=C(c(cc(cc1)F)c1-n1nccc1)NC1CCOCC1,1 V017-7503,O=S(c(cc1)ccc1F)(N(C1CCN(Cc2cccs2)CC1)c(cc1)ccc1F)=O,0 Z4119259628,Cn1nc(C(NCCn2nnc(-c3ccccc3)c2)=O)c(C(F)(F)F)c1,0 Z999975568,COc1cccc(-n2nnc(CNC(Cc3ccccc3)=O)c2)c1,0 F3406-5625,O=C(CSc1nc(N2CCCC2)ccn1)Nc(cc1)cc(Cl)c1F,0 Z1240739988,Cn1ncc(-c2ncc(C(NC(CCC3)CC3C(N)=O)=O)s2)c1,0 SC73-1305,Cn1nc(C(N2CCCC2)=O)c2c1CC1(CCN(C)CC1)OC2,0 F2723-0078,Cc(cc1)cc(S(Nc(cc(cc2)N(C(C)=Nc3c4cccc3)C4=O)c2F)(=O)=O)c1OC,1 Z3016328621,CCC(NC(CCc(cc(cc1)C(OC)=O)c1N1)C1=O)=O,0 SD14-0619,CN([C@@H](CCN(Cc(cc1)cc2c1OCC2)C1)[C@@H]1C(N(Cc1cnccc1)C1)=O)C1=O,1 Z1404667958,OC(CC(COCC1)N1C(C(C1)COc2c1cccc2)=O)=O,1 Z4024600573,CC(C)CCNc1cc(Br)cc(F)c1S(N)(=O)=O,0 T835-0018,Cn1c(nccc2)c2nc1CC(CC1)CN1C(C1COCC1)=O,0 F6810-5317,OCC1(CCC2)C2CN(Cc(cccc2)c2Br)C1,0 Z7056091919,O=C(c1c(cc(C(CC2)CCN2C(c2ccccc2)=O)cc2)n2nc1)NCCn1ncnc1,1 Z2632930151,Cc1cccc(CC(C2)CN2C(c2ncnc3c2cc[nH]3)=O)c1,1 F6448-2321,O=C(C1CC=CCC1)Nc1cn(CC2Oc(cccc3)c3OC2)nc1,1 Z2438108226,O=C(CN(C=Nc1c2ccc(Cl)c1)C2=O)N1CCNCC1,0 Z2440222473,CC(C)n1nc(CC(N2CC(CNC)CC2)=O)cc1,0 Z2595661837,OC([C@H]1OCC[C@H]1NC(c(s1)ccc1Cl)=O)=O,0 Z2348650645,CC[C@H](c1ccccc1)NC(N(CC1)CCN1c1nccnc1C)=O,0 F6443-5320,O=C(Nc1cccs1)N(CCC1)CC1(c1c2cccc1)OC2=O,1 S903-1451,CN(C)C(N(CC1)CCC1c1nnc(C2)n1CCN2C(c1cocc1)=O)=O,0 J001-0945,CC(CC(C)C1)CN1S(c1c(C)c(C)cc(C(C=C2)=NNC2=O)c1)(=O)=O,1 F6438-3738,CN(C)c1nc(CNC(c(cc(cc2)OC)c2Br)=O)nc(N2CCCCC2)n1,0 F6560-4204,CC(C)C(Cn1ncnc1)NC(c(cc1)ccc1-n1cccc1)=O,1 Z2965713744,O=C(c1c(cc[nH]2)c2cnc1)N1CC(Cc2nccs2)CC1,1 F6812-1347,Cc1noc(C)c1CN(CC1)CCN1c1nc(-c2ncccc2)ccn1,1 F5042-0356,O=C(c1cc(Br)cnc1)N(CC1)CCN1c(cc1)nnc1-c1cccs1,1 Z3091717346,CN(C)CCC(CCC1)N1C(CCN(C=CC=C1)C1=O)=O,1 F6448-1736,O=C(C(CC1=O)CN1c(cc1)ccc1F)Nc1cn(C2CCOCC2)nc1,1 Z2454312851,Cc1cc(C(NC2(CCC2)c2cccc(F)c2)=O)ncc1C#N,0 Z1249228663,Cn1ncc(CNC(N(C2CC3)C3c3c2cccc3)=O)c1,1 Z3278087812,CCCOc1cccc(-c2noc([C@H](C3)[C@H](C4)[C@H]4[C@H]3N)n2)c1,0 F6231-0972,Cc1nccn1C(C=C1)=NN(CCNC(c2cccs2)=O)C1=O,1 F6752-6213,O=C(C(CCC1)CN1c(nccc1)c1Cl)N(CC1)CCC1(F)F,0 G603-0285,COc1cc(-c2noc(C(CCC3)CN3S(c3cccs3)(=O)=O)n2)cc(OC)c1,0 S759-0016,CC(C)N(C[C@H]1OC)[C@@H]1C(CC1)CCN1C(c1cccs1)=O,1 Z886086272,O=C(NCC1COCCC1)N(CC1)CCN1c(cc1)ncc1Cl,1 F2147-0978,CC(C)(C)OC(NCC(NC1(CCCC1)C(OC)=O)=O)=O,0 Z2697278834,O=C(c1nn(C2CCOCC2)cc1)N1CCN(Cc2ccccc2)CC1,1 F447-0563,CC(C)CC(C)N(CC1)CCN1c1cc(C(O)=O)c(cc(cc2)NS(c3c(C)ccc(F)c3)(=O)=O)c2n1,0 S970-0423,O=C(c1cscc1)N(CC(C1)(F)F)[C@@H]1c1nncn1CC1CC1,1 Z3016340448,Cn(c(CNC(N(C[C@H]1F)C[C@@H]1F)=O)nc1ccc2)c1c2Cl,0 F6609-4213,O=C(COC(c(cccc1)c1Cl)=O)Nc(cc1)cc2c1OCO2,0 Z1256636809,CC(CN(Cc1ccccc1)CC(Nc1ccnn11)=CC1=O)O,1 Z2171570653,CC(COCC1)C1NCCc1c[nH]c2cccc(Br)c12,1 Z3416720192,Cn1ncc(C2C(N)=O)c1CCN2C(CCc(cc1)cc2c1OCCO2)=O,1 Z339653202,CCn1c(cccc2)c2nc1CNC(N1CCCC1)=O,0 Z3582401175,Cc1c(CC(C(NC(CC(N2)=O)C2=O)=O)(F)F)c(cccc2)c2[nH]1,1 F2205-0249,CC(C)(Cc1ccc2)Oc1c2OCc(cc1)ccc1C(N(CC1)CCC1C(OC)=O)=O,1 SA18-0142,CN(CCn1c2nc(C(N3CCN(CCOc(cc4)ccc4Cl)CC3)=O)c1)C2=O,0 Z2779035242,CCN(CC1)CC1NC(c1c(C)nc2c(Cl)cccc2c1)=O,1 SC67-1117,CCCn1c(C(CN(C)C2)C2(CC2)CCN2C(C2CCC2)=O)nnc1,1 J500-0861,CN(C)C(C(C1)C2(CCCC2)CN1C(c1cn(C)nc1)=O)=O,0 F6438-3533,CN(C)c1nc(CNC(c2noc(C3CC3)c2)=O)nc(N(C)C)n1,1 F6178-2473,O=S(Cc1cc(F)ccc1)(NCC(CC1)CCN1c1nc(cccc2)c2s1)=O,1 Z1798893711,CC(C)(C1)OC2(CCCC2)CN1C(NCC(CC1)CCN1c1ccncc1)=O,1 Z2911997905,Cc1c(C(NC2CC(CC(O)=O)C2)=O)c(-c2ccc(C(F)(F)F)cc2)no1,1 Z1869462726,COc(ccc(C(CC(O)=O)NC(CCC1=Cc(cccc2)c2NC1=O)=O)c1)c1OC,1 Z1952254990,CC(N(C[C@@H](C1)O)[C@H]1C(NCc1nc(C(F)(F)F)cs1)=O)=O,0 Y041-8106,COc1ccc(C2(CCOCC2)C(NCCc2nnc3n2cccc3)=O)cc1,1 F5016-0810,COc(ccc(NC(C(NCC1CCN(Cc2ccco2)CC1)=O)=O)c1)c1Cl,0 F3202-0130,CCOc(c(C)c1)cc(S(Nc(cc2)ccc2F)(=O)=O)c1OCC,0 SA41-0141,Cc1cccc(OCC(N(C2)CC22CN(C)C(COC)C2)=O)c1,0 F6279-0579,CC(C)(CO)NC(Cc(cc1)ccc1NC(c(cc1)ccc1OC(F)(F)F)=O)=O,0 Z1497494170,O=C(c1cccc(N2)c1OC2=O)N1CCN(Cc2ccccc2)CCC1,1 Z2027216832,CN(C)c1n[nH]c(C(CC2)CCN2C(COc2ccccc2)=O)n1,1 Z3360078109,CC(C1(CCOCC1)O)Nc(cc1)cc2c1C=CN(C)C2=O,1 Z1837973425,FC(Cn1c(SCc2ncccn2)ncc1-c1ccccc1)(F)F,0 CM3891-3578,CN1CCN(CC(CC2)(CCC2(CC2)CCN2C(c2cocc2)=O)O)CC1,1 F6560-4182,CC(C)C(Cn1ncnc1)NC(C(c1ccccc1)c1ccccc1)=O,1 F6553-0907,O=C(c1noc(-c2ccco2)c1)N(CC1)CC1c(cc1)cc2c1OCC2,1 Z2964160686,Cc1nn(cccn2)c2c1C(N1CCC(CN(CCN2)C2=O)CC1)=O,1 Z2256374157,COCC(CCC1)(CN1C(C(CC1)CCC1(F)F)=O)C(O)=O,0 Z2456794614,O=C(C1(CC1)C(F)F)N1CC2(CC2)C1,1 L299-3659,CCc(c(-c(cc1)cc(S(Nc2cc(C)cc(C)c2)(=O)=O)c1OC)c1NC(CC2)=O)nn1C2=O,0 Z1102793569,COc1cc(CCCN(C2)C(CN(C=Nc3c4cc(-c5ccccc5)s3)C4=O)=O)c2cc1,1 Z1416979395,CC(N1CC(N2CC(Cc(cc3)ccc3F)CC2)=O)=CC(O)=CC1=O,1 M034-4661,O=C(c(cc(cc1)F)c1Cl)N(CC1)CCN1c1ncccc1-c1nnc(C2CC2)o1,1 F6510-3612,Cc(c(NC(Cn1c(cccc2)c2nc1)=O)c1)cc(N2C)c1N(C)S2(=O)=O,1 F6523-0897,CC(C)n1nc(C)c(S(NC(CC2)CCN2c2nc(C)nc3c2CCCC3)(=O)=O)c1C,1 Z1982957893,NS(c(cc1)cc(C(N2CC(c3c(C(F)(F)F)cccc3)OCC2)=O)c1F)(=O)=O,0 Y042-4039,CN(C)S(c(cc1)ccc1N(CC(C1)C(Nc(cc2)cc3c2OCCO3)=O)C1=O)(=O)=O,0 SB13-0321,COCCN([C@@H]([C@H](CC1)C(N(CC2)c3c2cccc3)=O)c(cc2)ccc2F)C1=O,1 F6796-8974,COc(cc1)cc2c1sc(N(C1)CC(C3)C1CN3c1ncccc1C#N)n2,0 F6559-6105,CC1Cc2c(c(N(CC3)CCN3C(c3cc(C)nn3C)=O)ncc3)n3nc2CC1,1 Z2482978372,Cc1c(CN(CC2)CCC2C(c(cc2)ccc2F)O)cc(C(O)=O)s1,0 SD08-0511,Cc(nc1)cnc1C(N(CCC1)CC11OCc2c(CNC(N(C)C)=O)nnn2C1)=O,1 L284-2466,Cc1csc(-c2cc(S(N3CCC(Cc4ccccc4)CC3)(=O)=O)c(C)n2C)n1,1 F6550-4578,O=C(CSC1CCCC1)N(C1)CC1Nc1ncccn1,1 Z1983678473,Cn1ncc(CC2)c1CC2C(N(CC1)CCN1C(Cc(cccc1)c1F)=O)=O,1 F6760-5068,Cc1nc(-c2cc(NC(c(c(C)c3)ncc3F)=O)ccc2)cs1,1 Z3216020089,CC(C1)C1C(NS(c1ccc(C2(C(F)(F)F)N=N2)cc1)(=O)=O)=O,0 Z2496764483,CC(N1CCC(CNC(c2n[nH]c(-c3cn(C)cc3)c2)=O)CC1)=O,1 F6549-2432,CC(C)(C)OC(N1CCC(CC(N(C(CC2)C3)C2CC3n2nccc2)=O)CC1)=O,1 F6464-0289,O=C(c1ccno1)N(CCCC1)CC1c(cc1)ccc1Cl,1 Z2613442090,Cc1c(C)sc2ncnc(NCc3noc(C(F)(F)F)c3)c12,1 S606-1176,CCN(c1c(N2[C@H]3CN(CCC(C)C)CC3)nccc1)C2=O,0 Z2466863820,Cc1cn(CCC(N(C(CC2)C3)C2C3C(O)=O)=O)nc1,1 Z1461609287,CC(C)C(NC(CO)C(c(cc1)ccc1[N+]([O-])=O)O)=O,0 G505-0105,Cc(cc1)ccc1S(N(CCC1)c(cc2)c1cc2NS(c1c(C)ccc(C)c1)(=O)=O)(=O)=O,0 F6678-9652,CC(C)(C)c1nc(cccc2)c2n1C(C1)CN1c1nc(C)nc(C)c1,0 Z7776121336,Cn1c([C@@H](CN(C2)C(OCC(F)(F)F)=O)[C@H]2C(OC)=O)cnc1,0 S900-0079,CC(C)NC(CN(CC1)CCN1C([C@H](C1)NC2(CCCC2)c2c1[nH]cn2)=O)=O,0 Z2184186635,CC(Nc1ncnn11)=C(CCC(NC(Cc2ccccc2)c(cc2)ccc2OC)=O)C1=O,0 Z1940553377,CCN(C(C=C1)=O)N=C1C(N(CC1)CCC1(C)c(cc1)ccc1Cl)=O,0 F5834-1848,CC(N(CC1)c2c1ccc(NC(Nc(cccc1)c1Cl)=O)c2)=O,0 Z2602296308,CC(C1)(C2CC2)OCCN1C(N[C@H](CCC1)CN1S(N(C)C)(=O)=O)=O,1 J007-0962,Cc1ccc(C(CCCCC2)N2C(Nc(cc2)cc3c2OCCO3)=O)s1,1 F5065-0031,Cn1nnc2c1ncnc2N(CC1)CCN1C(NCc1cccs1)=O,1 F6482-2358,CSc1cc(C(NC2CC3OCCOC3CC2)=O)ccc1,0 F6782-3770,OC(c1cnc(NCc2ncccc2)nc1-c(cc1)ccc1Cl)=O,1 F6788-7925,CN(CC(C1)CN1c1ncnc2cnccc12)S(C)(=O)=O,1 F6492-0572,Cc1nc(CC(CC2)C(N(CC3)CCN3c(cc3)ccc3F)=O)c2[nH]1,0 Y041-6240,c1(n2c(nn1)cccc2)[C@@H](NC(Cc1c([nH]nc1C)c1ccc(cc1)Cl)=O)CC(C)C,0 Z2374024656,Cn1c(C(NC2(CC(O)=O)CC2)=O)cc(Br)c1,0 Y030-7552,Cc1c(C(Nc2nnc(C3CCCCC3)s2)=O)c(-c2ccccc2)no1,1 SB15-0705,CC1(CC1)C(N(CCC1)CC1N(C1CCOCC1)S(C)(=O)=O)=O,0 F6510-3632,Cc(cc(c(N1C)c2)N(C)S1(=O)=O)c2NC(c(cc(cc1)OC)c1Br)=O,0 F5831-9347,CCCS(NCC1(CCOCC1)c1ccccc1)(=O)=O,0 S836-2816,Cc1cc(C(N(C[C@@H]2COC)C[C@@H]2C(N)=O)=O)cnc1,0 Z2222262945,COc1cc(C(NCCc(cc2)nn2-c(cc2)ccc2F)=O)cc(Cl)c1,0 F6359-1670,N#Cc1cccnc1OC(CC1)CCN1C(C1(CC(C2)C3)CC3CC2C1)=O,1 Z2610847305,Cc1nc(C)nc(Nc2cn(CCOC)nc2)c1Br,0 Z1311049947,Cc1cc(C)nn1CC(NCc1c(CN(CC2)CCC2O)cccc1)=O,0 Z2959094574,Cn1c(C(CCC2)CN2C(C(C(CCCC2)=C2N2)=CC2=O)=O)ncc1,0 Z425610460,Cc1cc(S(N(CC2)CCN2C(c2c[nH]nc2)=O)(=O)=O)c(C)cc1,1 F6529-6492,COCCN(C(CN1C(CC2)CCN2C(c2cccs2)=O)=O)C1=O,1 F0174-0315,O=C(c(s1)ccc1Cl)Nc(ccc(F)c1)c1F,0 T834-1664,CC(c1ccco1)NC(c(cc12)nn1-c(cccc1)c1N(CCOC)C2=O)=O,0 F6169-0031,CC(C1)N(C(CN(C(C=C2)=O)N=C2n2nccc2)=O)c2c1cccc2,1 Z1408532063,CC(C)(C)c1noc(-c(cccc2)c2C(NC2C=CCCC2)=O)n1,1 F3375-3013,Clc(cc1)cc2c1OC=CC(c1nnc(-c3cnccc3)o1)=C2,1 SC66-0441,O=C(COc1ccccc1)N(C1)CC2(CCOCC2)C1c1nncn1C1CC1,1 F6519-4374,Cc1cccc(S(NCC(c2cccs2)n2nccc2)(=O)=O)c1,0 Z2864061628,CC(C)(c(cccc1)c1OC)n1nnc(CC2(CCNCC2)O)c1,0 Z1666608789,CCC(c1nc(C)cs1)NCC(Nc(cccc1)c1C(NCc1ccccc1)=O)=O,1 Z284078866,Cc(cc1)cc(CCC2)c1N2C(c(cc1)cnc1C(O)=O)=O,0 SD07-0422,COc(cc1)nc(OC)c1C(N(CC1)CC11OCc2c(CNC(C3CCOCC3)=O)nnn2C1)=O,1 Z2910787130,COc1cc(CCN(C2CC(O)=O)C(c3ncc4n3cccc4)=O)c2cc1OC,1 F6471-2609,Cc1c(C(N2C3C=CCC2CC3)=O)c(-c(cccc2)c2Cl)no1,1 F5111-0081,CCCc1nnc(NC(CN(C(CCC2)=C2C(N2C3CCCCC3)=O)C2=O)=O)s1,1 Z28853208,Cc1cccc(N(C(CC2)=O)N=C2C(NOCc2ccccc2)=O)c1,0 F6502-9137,Cc1cc(CCNC(Cc2cccc(C(F)(F)F)c2)=O)nn1C,0 Z1432291191,Cc1cc(CNc2nn(CCO)cc2)cc(C)c1,0 E856-2653,CC(Cc1ccco1)NC(c1ccc(CN(c2ccnn2CC2)C2=O)cc1)=O,1 Z4924723169,Cc1cccc(NS(c2cc(-c3ccccc3)no2)(=O)=O)c1,0 SB55-1147,CCc1nc([C@@](CCC2)(C3)[C@@H]2CN3S(c2cnccc2)(=O)=O)no1,1 Z1162658163,O=C(CNC(C(COC1)N(Cc2ccccc2)C1=O)=O)Nc1c[nH]nc1,1 Z1255883438,CC(C)[C@@H](C(NCc1cc(-n2cncc2)ncc1)=O)NC(COC)=O,0 F6543-1473,CC(C)(C)NC(CN(CC1)CCC1c1nn(C)cc1)=O,0 F6604-7091,CC(C=C1)=NN(CC(C2)CN2c2nc3ccccc3nc2C)C1=O,1 Z2409305102,O=S(c1cc(cccc2)c2o1)(NC[C@@H](C1)[C@H]1C1CCC1)=O,1 Z2185580242,CCCc1nsc(N(CCC2)CCN2S(C)(=O)=O)n1,0 C514-0214,Cc1noc(/C=C/c2cccs2)c1S(N(CC1)CCC1C(NCCCN(CCC1)C1=O)=O)(=O)=O,1 S736-0195,COC(C1)C(CC2)(CCN2C(C2CC2)=O)N1c1cccc(F)c1,1 F6192-0990,COC(NCC(c1cscc1)c1ccco1)=O,0 F6441-3835,O=C(c1c(C(F)(F)F)cccc1)N(CC1)CCC1S(Cc1ccco1)(=O)=O,0 S954-5279,CC1(CC1)C(N(CC1)CCC1[C@@H](CN(C1)c(cc2)cc(C(F)(F)F)c2C#N)[C@H]1C(NC1CC1)=O)=O,1 C115-0430,CN(C(C(C(NC1CCCCC1)=O)c(cc1OC)c2cc1OC)c(cc1)ccc1OC)C2=O,1 F6477-0412,O=C(c(cccc1)c1Cl)N(CC1)CCN1c1nc(-c2cscc2)cs1,0 F6443-7764,Cn1nc(cc(cc2)Br)c2c1C(NCC(CCC1)N1c1ccccc1)=O,1 F6675-8396,CN(C(C1)CN1c1nccnc1C#N)C(N1CCOCC1)=O,1 3793-3914,CC(C)CC(C(Nc(cc1)ccc1S(Nc1nc(C)nc(C)c1)(=O)=O)=O)N(C(c1c2cccc1)=O)C2=O,0 F6514-2411,O=C(COc(ccc(Cl)c1)c1Cl)NC(C1CCOCC1)c1cnccc1,1 J107-0677,O=C(CN(C(C=C1)=O)N=C1c1cccs1)NC(CCC1)c2c1c(cccc1)c1[nH]2,1 Z1445538974,CC(C)n1ncc2cc(C(NCC(C(O)=O)c3ccccc3)=O)cnc12,1 Z1429072301,O=C(C(c1ccccc1)NC(c1cccs1)=O)NC(CC1)CN1C(C1CCCC1)=O,1 Z4387752369,O=C(Nc1ccc2)Nc1c2-c1nc(C(CC2)CS2(=O)=O)no1,1 F2371-0083,CCCS(NCC(CC1=O)CN1c(cc1)ccc1OCC)(=O)=O,0 G395-1310,O=C(CCc1nnc(cc2)n1nc2NCc(cc1)ccc1F)NCC1OCCC1,0 F5832-9281,Cc1c(CCNC(Nc2c(C(F)(F)F)cccc2)=O)sc(-c2cc(F)ccc2)n1,1 Z3319486114,CCn1nnc(CN(CCC2CCO)c3c2cccc3)c1,0 F6725-2778,Cc1c(N(CC2)CC2N(CCO2)C2=O)n2ncnc2nc1C,1 F6787-0312,Cc1c(C)ncnc1OCC(CCC1)(C2)C1CN2c1ncnc2c1ncn2C,1 F0685-0139,Cc(cc1C)cc(C)c1S(NCCc1csc(-c2cnccc2)n1)(=O)=O,1 C255-1077,CC(C)Oc1ccc(CN(C(C)(CC2)C(NCc3ccccc3)=O)C2=O)cc1,0 Z1692346257,O=C(C(C1)C11COCC1)NS(c1cc(COC2)c2cc1)(=O)=O,1 Z442888920,O=C(c1n[nH]cc1)Nc1ccc(Cc2ccncc2)cc1,0 T500-0394,O=C(Nc(cc1)cc2c1OCCO2)N(CC1)CCC11OCCC(Cc2ccccc2)C1,1 Z1444496675,CCC(C(O)=O)(c1ccccc1)NC(Cc1cnc(C)cc1)=O,1 F6809-7972,COc(cc1c(N2Cc3nnc(C(F)(F)F)n3CC2)ncnc1c1)c1OC,1 V010-7734,Cc1cccc(S(N(CC2)CCN2c2nc(-c3cc(C(F)(F)F)ccc3)ccn2)(=O)=O)c1,0 Z3000833386,O=C([C@@H](C1)[C@H]1C1CCOCC1)N(CC(Nc1c2)=O)c1cc(F)c2F,1 S963-2868,Cc(occ1)c1C(N[C@@H](CN(Cc1ccncc1)C1)[C@H]1C(NC)=O)=O,0 F6798-4662,CCn1c(ncnc2N3CC(CN(Cc4nc(C(C)C)no4)C4)C4C3)c2nc1,1 F5854-5699,O=C(c(ccc(F)c1)c1Cl)N(CC(F)(F)F)Cc1cscc1,0 CM4410-3103,Cc1noc(C)c1COc1cccc(CN(C2)C3(CCCCC3)CN(CCOC)C2=O)c1,1 F6617-4205,CCOC(C(C(c1c(C)cccc1)N1)=C(CS(c2ccc(C)cc2)(=O)=O)NC1=O)=O,0 Z2440209042,O=C(C(C1)Oc2c1cccc2)Nc1cccc(C(NCCC2CNCC2)=O)c1,1 S584-0353,COc(cc1)ccc1S(N1CCn2c(C3CC3)nnc2CC1)(=O)=O,0 Z1254394474,CS(Nc(cc1)ccc1NC(N1CCN(CC(N2CCCCCC2)=O)CC1)=O)(=O)=O,1 S928-4587,Cn1cnc(S(N2CC(Cc3nnc(-c4ccccc4)o3)CC2)(=O)=O)c1,1 SA92-0596,FC1(CN(Cc(ccnc2)c2F)CCC1)c1nc(-c2cnccc2)no1,1 Z2232044654,CC(N(C[C@@H](C1)O)[C@H]1C(NCc(cc1)cc(F)c1OC(F)F)=O)=O,0 F6791-7932,Cn1c(ncnc2N(CC3)CCC3N(CC(N3c4ccccc4)=O)C3=O)c2nc1,1 Z1999598411,CNC(C(CC1)CCN1C(c(cncc1)c1Oc1ccccc1)=O)=O,0 L001-0034,O=C(Nc(ccc(Br)c1)c1F)N(CC1)CCC1N(CCN1Cc(cc2)ccc2F)C1=O,0 F6514-2352,O=C(c(cc1)ccc1-n1cccc1)NC(C1CCOCC1)c1cnccc1,1 P314-1186,Cc1cc(N(CCC2NC(COc3ccccc3)=O)C2=O)cc(C)c1,0 Z2355586638,CCN(C1CN(Cc2ccccc2)CC1)C(c1cn(CCOC)nn1)=O,1 F6561-6753,Cn1ncc(-c2c(CNC(NCc(cc3)cc(OC)c3OC)=O)cccn2)c1,1 Z4452678688,CCc1nnc(N(C)C2CCC(C)(C)CC2)s1,0 SB30-0508,O=C(Cc1cccs1)N(CC1)CCC1N(C1(CN2CC3CC3)CCOCC1)C2=O,1 S460-0730,CC(C)c1noc(-c2cn(C(CC3)CN3C(C3(CC3)c3ccccc3)=O)nn2)n1,1 F3386-4044,COc(c(S(Nc1cc2ccccc2nc1)(=O)=O)c1)cc(Cl)c1OC,1 Z1531998251,OC([C@@H](Cc1ccccc1)NS(c1cc(CCC2)c2cc1)(=O)=O)=O,1 SA47-0122,CC1(COC(C2)(CN2C(c2nn(C)c3c2cccc3)=O)C1)O,0 Z1157884042,Cn1ncc(-c2cc(C(NCC3CCCCC3)=O)cnc2)c1,1 Z3494548533,CCN(c1c(C)nccc1)S(c1ccnn1CC1CC1)(=O)=O,1 L780-0057,Cc(c(C)c1)cc(N2)c1N=C(CSc(cc1)ccc1NC(CCC1CCCC1)=O)C2=O,1 SD07-0976,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(Cc2cscc2)=O)C2)n2nn1)=O,1 F1907-2457,CC(C)(C)OC(N(CC1)c2c1ccc(C(OC)=O)c2)=O,0 J030-0457,O=C(c1c2)Nc(cccc3)c3Oc1cc(NCCc1ccccc1)c2S(N1CCCC1)(=O)=O,1 SC70-0504,CCCc1nc(C(C2)C3(CCC3)CN2C(c2ccc(Cn3cncc3)o2)=O)n[nH]1,1 Z2689796257,CC(CCCC1)N1C(N(C1)CC1(C(O)=O)O)=O,0 Z3216017570,O=C(NCCc1cccc(F)c1)N(CC1)CC1C(NC(N1)=O)=CC1=O,1 Z4136544829,CCNS(c(cc(N1CCCC1)nc1)c1F)(=O)=O,0 Z445431084,O=C(C1CCNCC1)Nc(cc1)cc2c1[nH]nc2,1 V023-9674,CCC(C(NCc1ccco1)=O)N(c(cc(cc1)Cl)c1C(N1c2cc(OC)ccc2)=O)C1=O,0 E944-0313,CC(CN(CCCNc1c(c(C)no2)c2ncn1)CC1)N1c1cc(C)ccc1,1 Z4497431012,OC(C(CC1CC2)C2N1C(C[C@@H](C(Nc1c2cccc1)=O)NC2=O)=O)=O,1 Z1233862385,CC(CN(CC1)C(c2ccccc2)=O)N1c1nc(C)cs1,0 Z2639875566,CC1(CNC(c2c(C3CC3)cnn2C)=O)OCCc2c1ccs2,1 Z1190721071,CC(C)(C(N(C)Cc1cnccc1)=O)S(C)(=O)=O,0 Z1395611083,CC(C)CN(CC(c(cc1)ccc1F)O)C(c1cnc(C2CC2)s1)=O,1 SA87-0665,CC(C)CN(CC(CNC(C1(CC1)c1ccccc1)=O)OC1)C1=O,0 F1899-2067,Cc1cc(C)nn1-c(cc1)nnc1SCc1ccc(C(OC)=O)o1,1 F6441-4070,O=C(CN1N=CC=CC1=O)N(CC1)CCC1S(Cc1ccco1)(=O)=O,1 F6571-3316,COc(ccc(Cl)c1)c1C(NCC1(CSCC1)OCCO)=O,0 F6608-3909,CC(C)N1CCN(CC#CCOC(CC2)CCN2c2ncnc3c2ncn3C)CC1,1 F6445-3490,COc(cc1)cc(C(NCCCc2cn3ncnc3nc2)=O)c1Br,0 F819-0025,O=C(CC(C1)c2nc(-c(cc3)ccc3S(N3CCCC3)(=O)=O)no2)N1c1cccc(Cl)c1,1 Z1232985518,CCc1ccc(C(COCC2)N2C(NCc(cc2)cnc2-n2cncc2)=O)o1,1 Z1443045518,O=C(CN(C=Nc1c2cccc1)C2=O)Nc1nnc(-c2ccncc2)s1,1 F6438-2334,COc(nc1)nc(N2CCCC2)c1NS(c(cc1)cc2c1OCCO2)(=O)=O,1 F6525-6589,Cc(n(CCNC(NC1CCCC1)=O)nc1C)c1-c1cscc1,1 F6476-3122,O=C(c1cscc1)N(CC1)CC1Oc1nccc(C(F)(F)F)c1,1 SC58-0142,Cc1cnc(C2C(C3)(CN3C(c3cocc3)=O)CN(C)C2)o1,1 Z3082320141,CC(C=CN(C)C1=O)=C1NC([C@@H](C1)[C@H]1c1ccncc1)=O,1 Z2946003976,CC(C)N(CC(N)=O)C(c1cccc2c1nc(C(F)F)[nH]2)=O,0 F6489-1427,COc(cc1)nnc1OC(CC1)CN1C(c1cc([nH]cc2)c2cc1)=O,1 Z968009472,Oc1c(CNC(Nc2nnc(-c3ccco3)s2)=O)cccc1,1 Z2922589562,CC(C)(C)n(c(C)c1)nc1C(N(C)Cc1ccc(C(O)=O)o1)=O,0 F6435-2712,O=C(C1c(cccc2)c2Oc2c1cccc2)N1C(CS(c2ccccc2)(=O)=O)CCC1,1 S827-3411,Cc1ccc(CN(CC(C2)(F)F)[C@@H]2c2nc(C(NC)=O)no2)o1,1 SA24-1733,Cc(nc1)cnc1C(N(C1)CC1N(C1)[C@H](COC)CC1(F)F)=O,0 F6031-1326,OC(CN1CCN(CC(N(CC2)c3c2cccc3)=O)CC1)c1ccco1,1 SA58-1287,O=C(CC1CCCC1)N1C(CCc2noc(-c3ccccc3)n2)CCC1,1 SC76-0571,CS(N(CC1)CCN1C(CN(C([C@]1(COc2ccccc2)[C@H]2C1)=O)c1c2cccc1)=O)(=O)=O,0 SC44-0081,CN(C)C(COC1CC(CC2)(CCN2C(c2cnncc2)=O)OCC1)=O,1 C200-2211,Cc1c(CSC(N(Cc2ccccc2)C2=O)=Nc3c2n(C)c(cc2)c3cc2OC)cccc1,1 G747-0405,CC(CC1)CCN1C(c1cccc(F)c1)C(C(N(Cc1ncccc1)C(C)=C1)=O)=C1O,1 Z4999882373,O=C(c1cc(C(N(C2)C(CCC(N3)=O)C3=O)=O)c2cc1)Nc1c(C2CCNCC2)cccc1,1 F6436-1266,CN(C(CC1)=O)c(cc2)c1cc2NC(c1cc(cccc2)c2s1)=O,1 F6672-1923,O=C(NCc(cc1)ccc1F)N(C(CC1)C2)C1CC2=CC1CC1,1 Z2936904381,O=C(Cc1n[nH]c(C2CC2)n1)Nc(cc1)ccc1SC(F)F,0 Z2960126418,COCC(C1)(CN1C(c(cc1F)cc(F)c1Oc1ccccc1)=O)O,1 F6465-0166,OC(CNC(CSCc1ccccc1)=O)CN(C=CC=C1)C1=O,1 F6562-8487,Cc(cccc1)c1NC(NCC1c(cccc2)c2OC1)=O,1 SC69-0848,Cc1noc(C)c1CCC(N(C1)CC2(CCCC2)C1c1nncn1C1CC1)=O,1 C648-0096,CN(c(ccc(S(N(CCC1)CC1C(Nc(ccc(Br)c1)c1F)=O)(=O)=O)c1)c1O1)C1=O,0 C274-7992,CCOc(cc1)cc2c1nc(NC(C(CCC1)CN1S(C(C(N1)=O)=C(C)NC1=O)(=O)=O)=O)s2,1 S986-0351,Cc1c(C(N(C2)C[C@@](CN(C)C)(C3)[C@H]2CN3C(c2ccccc2)=O)=O)sc(C)n1,1 D430-1284,Cc(cc1)c(C)cc1S(Nc(cc1)ccc1Nc1nc(C)nc(N2CCOCC2)c1)(=O)=O,0 F6489-1953,CN(C)c(cc1)nnc1OC(CC1)CN1C(C(CC1)CCN1S(C)(=O)=O)=O,1 F6514-7461,CC(C)C(Cn1nccn1)NS(c1cc(-c2ccccc2)ccc1)(=O)=O,1 F3398-4649,CN(Cc1ccccc1)c1nc(ncnc2SCC(Nc(ccc(F)c3)c3Cl)=O)c2s1,1 F5834-0170,CN(CCOc(cc1)c2cc1NC(CSc(cc1)ccc1F)=O)C2=O,1 G935-2608,Cc(n(CC(N1CCCC1)=O)nc1C)c1S(N(CCC1)CC1C(N(CC1)c2c1cccc2)=O)(=O)=O,1 F6125-0162,O=C(C(C1)CN1C(c1nccnc1)=O)NCc(cc1)ccc1OC(F)(F)F,0 Z1321362343,Cc(cn1)cc(NC(N(CC2)CCN2C(C2OCCC2)=O)=O)c1OC,0 F6524-1679,CC(N=C(N1)N(CC2)CCC2NC(C(CC2=O)CN2c2ccccc2)=O)=CC1=O,1 F2716-0110,CCCC(N=C(N1)SCc2cc(OC)cc(OC)c2)=CC1=O,0 CM2843-7955,O=S(c1cc(F)cc(F)c1)(N(CCC1)C1c1nncn1Cc1ccncc1)=O,1 F2751-0155,CCOC(C(CCC1)CN1S(CCNC(c1cc(OC)ccc1)=O)(=O)=O)=O,0 SB52-0290,CN(CC(C1)(CC2)CCN2S(c2cc(OC)ccc2)(=O)=O)C1c1noc(COC)n1,0 S614-1027,O=C(c1cocc1)N(CCCC1)C1c1nc(CCOCC2CCOCC2)no1,1 F6619-7783,Cc(cc1)nn1-c(cc1)nnc1N(CC1)CCN1c1cc(C(F)(F)F)ncc1,1 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Z1132138703,CNC(c1cccc(NC(N(CC2)CC2c2cccc(F)c2)=O)c1)=O,0 Z1375290783,Cc(cc1)c(C)cc1OCC(N(CCC1)C1C(CCCC1)C1=O)=O,1 Z2297451276,CC(C)(C)C(Nc1nc(CC(Nc2cc(C(N)=O)cc(C)c2)=O)cs1)=O,0 Z4881285838,Cn1nc(C(N2)=Nc(cc3OCOc3c3)c3C2=O)nc1,1 F3222-2967,O=C(CN(CCCN1Cc(cccc2)c2Cl)S1(=O)=O)NCc(cc1)ccc1Cl,1 Z1426518587,O=C(CCc1nc(C2CCCC2)no1)N1CCC(CCN2CCOCC2)CC1,1 Z1170061891,CC(C1)C1C(NCc1nc(-c2cc(O)ccc2)no1)=O,0 Y600-2708,CN(c1c(C(N2C)=O)n(Cc(cccc3)c3Cl)c(NCC3OCCC3)n1)C2=O,0 F6502-6042,O=S(Nc1cn2nccc2nc1)(N1CCCC1)=O,1 F6668-2894,O=C(Cn(cc1)c2c1cccc2)N1CCC(COc(nc2)ncc2Br)CC1,1 Z1081919914,CC(c1ccc(C(N(CCC2)CC2c2ncc[nH]2)=O)s1)=O,0 Z1870480665,COCC(CCC1)N1C(C(C1)C1C(O)=O)=O,0 SA43-0904,Cc1cc(C)nn1CCC(N(C1)CC1(C1)CN(C)C1c1nc(-c2ccncc2)no1)=O,1 Z4502413067,CC(C)CN(C)C(c1nn([C@H](C[C@@H](c2cn(C)nc2C)N2)C(F)(F)F)c2c1)=O,0 F6537-3126,CC#CC(Nc(cc1)cc2c1oc(-c1cnccc1)n2)=O,1 F6550-6268,O=C(Cc1cscc1)N(C1)CC1Nc1nnccc1,1 Z1721078726,OC(Cc1cc(F)ccc1)(CC1)CCN1C(c1cnc(-c2ncccn2)s1)=O,1 T501-0551,CCn1ncc(S(N2CC(Cc3nncn3CC3CC3)CCC2)(=O)=O)c1,1 Z2760977073,COCc1nnc(C2)n1CCN2c1ncnc2c1ncn2C(CO)CO,1 Z3687023557,Cc1cc(C)nn1-c1ccc(CC(N[C@@H](CC(Cn2nccc2)C2)[C@H]2O)=O)cc1,0 Z3009813149,O=S(C1CC1)(N(C[C@H]1S(CCC2)(=O)=O)C[C@@]12C(F)(F)F)=O,1 E786-1875,O=C(c1c2nccc1)N(Cc(s1)ccc1S(Nc1cc(C(F)(F)F)ccc1)(=O)=O)C2=O,0 S530-0185,CC(C)N(CC1)CCC1(CN(C1)C(C2CCC2)=O)Oc2c1cccc2,1 F2573-0538,CS(NCC(c(cc1)cc2c1OCO2)N(CC1)CCN1c1ccccc1)(=O)=O,0 Z3711573167,CC(CCC(F)(F)F)NC(c(cc1)cc(N=C(C)N2)c1C2=O)=O,0 F6808-5816,N#CC(CC1)(CCN1c1cccc(C(F)(F)F)n1)c1ccccc1,0 L383-0851,Cc1cc(N(CC2)CCN2c(cc2)nnc2SCC(Nc2cc(C)c(C)cc2)=O)c(C)cc1,0 G404-0782,Cc1csc(NC(C(CCC2)CN2S(c2cn(C)cn2)(=O)=O)=O)n1,1 F070-0880,O=C(c1ccco1)N(CC1)CCN1c1nc2ccccc2nc1C(F)(F)F,0 F5882-2383,CCOC(C(CCC1)CN1C(c1cc(-c2cccs2)nn1C)=O)=O,1 E207-1570,CCC(C)N(CCCNC(c1nn(C)c(-c2c3cccc2)c1CS3(=O)=O)=O)Cc1ccco1,1 Z1151571605,CCC(CC1)CCC1NC(c(cc(cc1)F)c1N1CCOCC1)=O,1 SA93-0884,Cc1ccc(C(N(CC2)CCC2N(CCC2)CC2(CCOC)C(N)=O)=O)s1,1 F2740-0805,COCCn1c(cccc2)c2c(NC(Nc(cccc2)c2SC)=O)c1,0 Z2635788506,Cc(cc1)cc2c1[nH]c(CC1)c2CC1NC(c1c(CCCC2)c2no1)=O,0 F6261-2361,Cc1c(CNC(c2c(C)onc2-c(cccc2)c2Cl)=O)sc(-c(cccc2)c2F)n1,1 F0020-1639,O=C(CC1(CC(C2)C3)CC3CC2C1)N1CCCCC1,1 Z1029496330,CCCN1C(SCCCn2c3ncnc(N)c3nc2)=Nc(sc2c3CCC2)c3C1=O,1 F1021-0619,OC(CNCc1ccco1)Cn1c(cccc2)c2c2c1cccc2,0 Y502-9158,CCn1nc(C)c(CN(C([C@H]2[C@@H]3CCCC2)=O)C3=O)c1,1 Z3016340260,CCC1CCC(CNC(C2NCc3n[nH]cc23)=O)CC1,0 F0725-0462,O=C(c(cccc1)c1Br)Nc1cc(-c2nc(cccc3)c3s2)ccc1,0 F6670-4606,N#Cc(cccc1)c1S(N1CCC(CN(C=Nc2c3cccc2)C3=O)CC1)(=O)=O,0 F5243-1138,CC(N1C2=O)=C(C)SC1=NC(C)=C2NC(c(o1)ccc1Br)=O,1 P937-4167,O=C(Nc(cc1)cc2c1OCCO2)N1CC(Cc2nnc(-c3ccccc3)[nH]2)CC1,1 Z1462572355,C(c1cccnc1)Nc(cc1)ccc1-c1cn(CCCC2)c2n1,1 Z1183333997,CCS(NC(C(CC1)CCN1S(c(cccc1)c1F)(=O)=O)=O)(=O)=O,0 T633-0276,Cn1c(C2CN(Cc(ccc(F)c3)c3Cl)CCC2)nnc1,1 Z1646834387,CCC1(CCOCC1)NC(Nc1c(C)n(-c(cccc2)c2F)nc1)=O,0 Y200-6925,CN(CC(NC1CCCCC1)=O)C1CCCCC1,1 F6520-1634,CSc(cccc1)c1C(NCCc1ccc(-c2cocc2)s1)=O,0 S715-0214,Cn1c(-c2noc(C3CN(Cc4noc(-c5ccccc5)n4)CC3)n2)ccc1,1 F6247-1687,CCC(C(Nc(cc(cc1)F)c1F)=O)N(C=C(C=C1)c2nc(C)no2)C1=O,1 F6573-9081,O=C(NCc1cncc(-c2cocc2)c1)OCCN1CCOCC1,1 Z2869247343,CNC(COc1cc(CNC(CCCCc2ccccc2)=O)ccc1)=O,1 Z3054836396,O=C(c(nc1-c2ccccc2)nn1-c(cc1)ccc1F)N(CC1C2)CC2C1(F)F,1 V002-2019,COc1c(CN(CCCn2c3ccc2)C3c2cccc(Oc3ccccc3)c2)cccc1,0 S968-0539,CS(NC(C1)C1(CC1)CCN1C(c1cscc1)=O)(=O)=O,1 F6222-0061,CC(C(Nc1cnc(N(C)C)nc1)=O)Oc1ccccc1,0 F2541-0214,COc(cc1)cc(S(NC(CC2=O)CN2c(cc2)ccc2Cl)(=O)=O)c1OC,0 Z1874592642,Cc1c(CC(N2CC(CC(F)(F)F)CC2)=O)c(C)n[nH]1,0 Z3834684535,CN(C(CC1)c2c1cccc2)C(COCC1CCC1)=O,1 V009-6696,COc1cccc(COC(CN(CC2)CCN2S(c2cccs2)(=O)=O)c(cc2)ccc2Cl)c1,0 Z1127828362,NC([C@H](Cc1c(C2)cccc1)N2C(CCCc(cc1)cc(C2)c1NC2=O)=O)=O,1 Z4339763936,CCCCCC(Nc1c(C(F)(F)F)ccnn1)=O,0 F5857-3537,OC(CNC(C1(CCOCC1)c1ccccc1)=O)(C(F)(F)F)c1ccccc1,0 F2774-1273,O=C(CN(C(C=C1)=O)N=C1c(cc1)ccc1Br)N(CC1)c2c1cccc2,0 SA93-0217,CCC1(CN(Cc(cc2)cc3c2OCC3)CCC1)C(N)=O,0 Z7109718387,Nc(c(O)ccc1)c1C(N(CCC(N1CCNCC1)=O)Cc1cccc(Cl)c1)=O,0 F6473-2412,CCc(s1)ccc1S(N(C1)CC1n1nncc1)(=O)=O,1 F6504-1217,Cc1c(CCNC(c2cnc(C(F)(F)F)cc2)=O)c(C)nn1-c1ncccc1,1 F6503-5037,Cn1nc(CN(Cc2ccco2)C(N(CCN2S(C)(=O)=O)C2=O)=O)c2c1CCC2,1 S947-0344,N#Cc(cc1)c(C(F)(F)F)cc1N(C1)C[C@]2(COCC3CC3)[C@H]1CCN(Cc(ccnc1)c1F)C2,0 Z666717628,O=C1NC(c2cc(-n3nccc3)ncc2)=Nc2c1sc(-c(cccc1)c1Cl)c2,1 Z2177988282,Cc1nnc(CC2)n1CC2C(NCC1(CC1)c1cc(OC)ccc1)=O,0 Z1259266479,CC(CCCCC1)N1C(c1c(C)c(C)cc(S(N)(=O)=O)c1)=O,0 Z1449856064,C(c1nncn1C1CC1)Nc1c(CCC2)c2nc(-c2cnccc2)n1,1 SB54-0179,Cc1nnc([C@@H](C2)[C@@H](COC)CN2S(c2cccs2)(=O)=O)o1,1 P006-0637,CC(c(cc1)ccc1N(CC1)CCN1c1nc(-c2cc(C)ccc2)nnc1C)=O,1 F5860-2319,O=C(Cn(cc1)c2c1cccc2)N1CCN(C/C=C/c2ccccc2)CC1,1 F5040-0510,O=C(CSC1CCCC1)N(CC1)CCN1c(cc1)nnc1-c1cnccc1,1 F6561-4759,C=C(CC1CC2)CC2N1C(c(cccc1)c1Cl)=O,0 F0674-0074,O=C(CSc1ncnc2ccccc12)NCc(cccc1)c1Cl,1 Z2298125625,Cn1c(C2CC2)nnc1CN(CC1CO)CC1O,1 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V022-6867,COCCCN(CC(COC)O)CC(N(CC1)C(COc2cc(F)ccc2)c2c1scc2)=O,0 Z2974993638,Cc1noc2c1c(Nc(cc1)ccc1N(C)C(C1CC1)=O)ncn2,1 F6471-7098,O=C(C1(CCOCC1)c1ccccc1)NCCCc1conc1,1 Z2731511427,Cc1n[nH]c(NC([C@@H](C2)[C@H]2c2cncn2C)=O)c1-c(cc1)ccc1F,1 SA18-0490,Cn1c(cccc2)c2nc1CCNC(c1cn(CCN(CC2CC2)C2=O)c2n1)=O,1 Z2000560103,CC(CC1)CN1C(N(CC1)CCN1S(c(cc1)ccc1C(O)=O)(=O)=O)=O,0 F902-0964,CC(Cc1c2cccc1)N2S(c1c(C)sc(-c2ccno2)c1)(=O)=O,1 C713-0286,O=C(c(cc1)ccc1F)N(CC1)CCN1c1nn2c(-c(cc3)ccc3F)nnc2cc1,0 M739-0183,O=C(c(cc1)ccc1OCC(CCC1)N1C(c(cc1)ccc1Cl)=O)N1CCCC1,0 F6252-4102,O=C1N(CC2OCCC2)C=CC=C1c1nc(-c2cscc2)no1,1 Z982249574,Cn1c(C2CC2)nnc1CSc1ncc(-c2ccccc2)n1CC(F)(F)F,0 S576-0625,O=C(C(CC1)CN1C(C=NN1Cc2ccccc2)=CC1=O)N1CCCC1,1 F2242-0102,O=S(c(cc1)cc2c1OCCCO2)(NC1CCCCC1)=O,1 SB03-0076,Cc1nn(C)c(C(NCCN(C2CCOCC2)C(CCC2)CN2S(C)(=O)=O)=O)c1,0 F5871-3322,O=C(Cn(cc1)c2c1cccc2)N(CC1)CCC1C(Nc1nccs1)=O,1 G234-0152,Clc(cccc1)c1-c1nnc(C(c2ccccc2)Nc(cc2)cc3c2OCCO3)o1,0 Z128147774,O=C1Nc(cc(cc2)S(N(CC3)CCN3c(ncc(Cl)c3)c3Cl)(=O)=O)c2N1,1 F5836-0046,CN(C(C=C1)=O)N=C1C(Nc(cccc1)c1NC(c1cnccc1)=O)=O,1 Z2406135926,OC(CC1(COCC1)NS(c1cn(-c2ccccc2)nc1)(=O)=O)=O,0 E852-5581,CC(Cn(c1c2)nc2C(NCCc2c(C)onc2C)=O)(C(NCc(cc2)ccc2F)=O)N(C)C1=O,1 F6489-0189,O=C(c(o1)ccc1Br)N(CC1)CC1Oc1nnccc1,1 CM3655-1319,COC(CC1)C1(CC1)CCN1S(c(cc1)ccc1F)(=O)=O,0 Z1898971463,CC(C)c1ccc(CCNC(c2cn(Cc3noc(C)n3)nn2)=O)cc1,0 Z1171739869,O=C(COc1cc2ccccc2cc1)NCC1(CCOCC1)N1CCCCC1,1 F6811-1571,CC(C)N(C(C=C1)=O)N=C1N(CC1)CCN1c1cnc(C(F)(F)F)cc1,1 Z2114007873,CSCCNC(c(cc1)ccc1-c1noc(C(F)F)n1)=O,0 D757-0261,O=C([C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1)NCCCc1nnc2n1cccc2,1 Z1996321419,CC(C)(C)N(CC1)CCC1NC(c1ncccc1Oc1ccccc1)=O,1 F6374-5635,O=S(c1cc(C(F)(F)F)ccc1)(N1CCC(CSCc2ccco2)CC1)=O,0 F0913-2039,CC(C)(c1ccccc1)c(cc1)ccc1OCC(N1CCOCC1)=O,1 S932-4236,Cc1noc(C)c1CC(N(CC1)CC1n1nnc(COc2nccnc2)c1)=O,1 F3167-1456,CCOc(cc1)ccc1-c1nc(CN(C2C(N3c4cc(C)cc(C)c4)=O)N=NC2C3=O)c(C)o1,1 S787-1848,O=C(CCc1ccc(CC(CC2)CCN2C(NCC2OCCC2)=O)cc1)NCC1CC1,1 Z2410549736,CC(CCCC1)C1C(NS(CCc1c(C)ncs1)(=O)=O)=O,1 F2282-0126,O=C(C(CC1=O)CN1c(cc1)ccc1F)NCCS(N(CC1)Cc2c1cccc2)(=O)=O,0 F6672-0142,Cc1cn(C(CC2CC3)CC3N2C(c2ncccc2)=O)nc1,1 Y041-6005,O=C(c(cc1)cc2c1[nH]c1c2CCCCC1)NCC1C(CCCC2)N2CCC1,1 Z3027353746,C(COCC1)C1c1nc(-c2csnc2)cs1,1 F6682-6529,N#Cc1cc(OCC(CCC2)CN2c2c3sccc3ncn2)ncc1,1 F6257-1894,COc1cccc2c1oc(C(Nc1ncnc(N3CCOCC3)c1)=O)c2,1 Z955229104,CN(CC(N1)=Nc(cccc2)c2C1=O)C(c1cc(COC2)c2cc1)=O,1 F5620-0094,Cn1c(cccc2)c2nc1CN(CC1)CCN1S(c(cc1)cc2c1OCCO2)(=O)=O,1 T955-1048,CCOCC(N(CCC1)CC1c1nc(CCOCC2CCOCC2)no1)=O,0 4715-0117,Cc1nc(NS(c(cc2)ccc2NC(CSC(NC2=O)=NC(c3ccccc3)=C2C#N)=O)(=O)=O)nc(C)c1,1 Z1193297841,CC(C)NC(CC1)CCN1c1nc2ccccc2nc1C,0 Z1419254730,CC1(CC1)C(NCc1nc(-c2ccccc2)no1)=O,0 Z1269239412,Cc1ccc(ccc(Br)c2)c2n1,0 F0012-0714,O=C(c(ccc(Cl)c1)c1Cl)Nc1nc(-c2cccs2)cs1,0 F6560-6121,Cn1nccc1-c1cc(CNC(NCc(cccc2)c2F)=O)cnc1,0 M248-3542,O=C(c1cocc1)N1Cc(cc(cc2)C(N3CCOCC3)=O)c2OCC1,0 Z2033413817,Cc(nc(cc1)N2CCOCC2)c1NC(c1cc(Cc2ccccc2)n[nH]1)=O,1 SA44-0526,CC(C)Cc1nnc(C2N(C)CC(C3)(CN3C(C3CCC3)=O)C2)o1,1 F6353-3448,CN(C)C(CNC(NCc1cccs1)=O)c(cc1)cc2c1OCC2,1 S632-3106,COc(cc(CN(CC1)CCC1C1CNCC1)cc1)c1F,0 Z362757536,OC(c(c1c2CCCC1)nn2-c1ccccc1)=O,0 P719-1157,CC(C)CN(CCn1c2cc(S(N(CC3)CCN3c3ccccc3)(=O)=O)c1)C2=O,1 Z1554579440,CCn1ncc(Nc2nc(C3CC3)nc3c2CCC3)c1,1 Z2473133472,CS(NC(CC1)CCN1C(C(CC1)Cc2c1cccc2)=O)(=O)=O,1 F6524-3972,Cc1noc(C(CN(C2)C(c3noc4c3CCCC4)=O)C2c2ccccc2)n1,1 Z4105195555,CCn1nc([C@H](C)O[C@H](C)C2)c2c1C(N1Cc2cc(C(F)(F)F)nn2CC1)=O,0 F5832-2030,CN(C)C(CNC(c1cc2nsnc2cc1)=O)c1cccc2ccccc12,1 Z4745287946,CN(CC1)CCC1(CN(C1)c2ncnc3c2cn[nH]3)c2c1cccc2,1 SB24-0326,CN(C)C(c1cn(C(CC2)C2(CC2)CCN2C(c2nn(C)c3c2cccc3)=O)nn1)=O,1 S779-2218,CCn(cc1)nc1C(N1CC(Cn2c(C3CCC3)ncc2C)CC1)=O,1 Z2975254583,CCc1ncnc(N(CC2)CCN2c2cnncc2)c1F,1 F6524-1714,CC(N=C(N1)N(CC2)CCC2NC(c2cc(-c(cc3)ccc3F)c[nH]2)=O)=CC1=O,1 E515-2862,CCN(c(cc1)ccc1OCC)S(N(CCC1)CC1C(Nc(cc(cc1)F)c1F)=O)(=O)=O,0 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Z3685807642,NC[C@@H](C[C@H](C1)O)N1c1ncnc(N2CCN(CC=Cc3ccccc3)CC2)c1,1 SD56-0684,O=C(c(cccc1)c1OC(F)(F)F)N(CCC1)CC(C(N2C3CCCCC3)=O)N1C2=O,0 Z2453709945,O=C(C1CC1)N(CCC1)[C@@H]1C(NCC1C2CC(C3)CC1CC3C2)=O,1 SC12-0545,O=C(Cc1c[nH]c2c1cccc2)N(CCCN(CCC1)C1=O)C1CCOCC1,1 F6507-9018,COC1(CNC(c2c3OCCOc3ccc2)=O)CCSCC1,1 F6670-4711,O=C1N(CC(CC2)CCN2c(ccnc2)c2Cl)C=Nc2c1cccc2,0 6466-1085,COc(ccc(-c1cc(C(F)(F)F)nc(SCC(NCC2OCCC2)=O)n1)c1)c1OC,1 D404-0001,O=C(c1ccccc1)N(CC1)CCN1c(oc(-c1ccco1)n1)c1S(c1ccccc1)(=O)=O,0 F707-2735,CC(CC1)CCN1C(C(CC1)CCN1c1nn2c(-c(cccc3)c3Cl)nnc2cc1)=O,0 S988-0405,CCS(N(C[C@@H]1CN(C2)C(Cc(cc3)ccc3OC)=O)C[C@@]12c1nc(C)no1)(=O)=O,0 Z749657588,Cc(c(C)c1C(N)=O)c(C)nc1SCC(NCc1cc(NC(c2cnccc2)=O)ccc1)=O,1 F5826-0149,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CCN1c1nc(cccc2)c2n1Cc1ccccc1,0 Z4579754269,CN(C(NC1(Cc(cc2)ccc2Cl)CC1)=O)c1ccccc1,1 F6293-0211,Cn1nc(CNC(C2CC=CCC2)=O)cc1-c1ccco1,1 D578-0171,Cc1cc(Nc(cc2)ccc2NS(c2ccccc2)(=O)=O)nc(NC2CCCCC2)n1,0 Z3027211157,CN(C1COC1)S(c(cc1)cc2c1onc2Cl)(=O)=O,1 Z4144081160,CCCN(CCC)C(c(cc1)ccc1N(CC1)CC1C(C)O)=O,0 F6416-9130,OC(CCNC(C1(CC1)c(cc1)ccc1F)=O)c1cccc(Cl)c1,1 F6178-7940,CCCCOc(cc1)ccc1NC(NCC(CC1)CCN1C1CSCC1)=O,0 L422-0453,Cc(cccc1)c1C(Nc(cc1)ccc1OCc1cc(C(NC2CCCCCC2)=O)no1)=O,0 Z1303413441,Cc(cc1)cc2c1[nH]c(CNC(Cc1csc(-c3cc(C)ccc3)n1)=O)n2,0 F6722-3271,CC(C)c1noc(CN(CC2)CCN2c2cc(OC)ccc2)n1,0 F2147-1631,CC(C)(C)OC(N(CC1)CCC1Oc1nccnc1)=O,0 S649-0855,O=C(C1CCC1)N(CC1)CCC1N(C1)C2(CCOCC2)C1OCC1CC1,1 F1801-0060,CCOc1cc(C(NC(N(C)C(N2C)=O)=CC2=O)=O)cc(OCC)c1OCC,0 P658-0076,Cc1nnc(-c2coc(S(N3CCC(Cc4ccccc4)CC3)(=O)=O)c2)o1,1 F0910-0684,CC(C)(C)c(cc1)ccc1OCC(Nc(cc1)ccc1F)=O,0 C361-1147,Cc1cc(N(C)S(c(cc2)cc(CC3)c2N3C(C2CCC2)=O)(=O)=O)c(C)cc1,0 F2252-0299,CCOc1cccc2c1oc(-c1csc(NC(c(cccc3OC)c3OC)=O)n1)c2,0 Z2755428210,CC(c(cc1)ccc1OCC(O)=O)NC(c1cn(C)cn1)=O,0 S639-3633,CN(C)C[C@@H](CN(C1)c2ncccn2)[C@H]1NC(Cc1c[nH]c2c1cccc2)=O,1 Z2936895724,CC(C)(CN(C)C1)C1NC(c(cc1)cc(OC)c1OCC(NC)=O)=O,0 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F6237-1920,O=C(c1nn(-c(cc2)ccc2F)nn1)N(CC1)CCN1c1ncc(C(F)(F)F)cc1,0 SB04-0459,CN(C)C(N(CC1)CC1N(CCNC(c1ncncc1)=O)C1CCOCC1)=O,0 Z4909204068,CC(C)c(cc1)ccc1-n1nnc(CN(CCC2)CC2C(OC)=O)c1,0 Z1000676060,O=C(C(CC1)CCN1C(c1c2cccc1)=NS2(=O)=O)NC(CCC1)CN1C(c1ccccc1)=O,1 S836-1456,Cc1nocc1C(N(C[C@@H]1COc2ccccc2)C[C@@H]1C(N)=O)=O,1 Z2435410964,CC(CC(Nc(cc1)cc(OC2)c1NC2=O)=O)C1CNCCC1,1 Z1864202470,C[C@@H](CNC(Nc1cc(C(N)=O)ccc1)=O)Oc(cc1)ccc1Cl,0 F6573-8780,O=C(Cc1cccs1)NCc1cncc(-c2cocc2)c1,1 D403-2206,O=C(c1ccco1)N(CC1)CCN1c(oc(-c(cc1)ccc1F)n1)c1S(c(cc1)ccc1F)(=O)=O,1 Z2284944925,CC(C(CC(N(CC12)CC2C2OC1C=C2)=O)=C(C)N1N2)=NC1=CC2=O,1 Z1474304455,CCc(ncnc1)c1C(NC(CCC(N1)=O)C1=O)=O,0 K284-4520,O=C(c(cc1)cc(N=C(N2Cc3ccco3)SCc(cc3)ccc3F)c1C2=O)NCC1OCCC1,1 S631-1105,CCOC(CNC(N(CC1)CCC1N(C(C12CCCCC2)c2ccncc2)C1=O)=O)=O,1 D724-0566,Cc1nn2c(NC3CCCC3)c(CCC3)c3nc2c1-c1ccccc1,1 Z1513507216,FC(c(cc1)nnc1NCC(c(cccc1)c1Cl)N1CCOCC1)(F)F,0 Z4450360252,CCOC(CNC)(CC1)CCS1(=O)=O,0 Z3618285732,CCc1n[nH]cc1S(N(CC1)C1C1CCC1)(=O)=O,1 F6475-7516,O=C(c1cccnc1OC1CSCC1)NCCOc(cc1)ccc1F,1 Z827390006,CCN(CC)C(CCc1nc(N(C)C(NC2=O)=O)c2[nH]1)=O,0 F6795-4296,CCc1cc(N2CCN(Cc3coc(C)n3)CC2)nc(C(C)(C)C)n1,0 Y020-4239,CCc(nc1nc2)nn1c(C)c2-c1ccnc(N2CCC(C)CC2)n1,0 Z2017468022,CC(C)n1ncc(C(N(CC2)CCN2c(cc2)cc(OC)c2F)=O)c1,0 Z2456192527,O=C(c1cn(C2CCC2)nn1)N(CC1)Cc(nc2)c1n2-c(cc1)ccc1F,0 Z1556451030,CC(CCC1)(CN1C(NCCC1Oc(cccc2)c2OC1)=O)O,1 F258-0189,Cc(cc1)ccc1-c1nc(CCN(C)S(c2ccc(C3CCCCC3)cc2)(=O)=O)no1,1 C917-0213,CC(C)c(cc1)ccc1S(C(C(C1)c(cc(cc2)Br)c2OC1(C)N1)C1=O)(=O)=O,0 Z1275893461,CC(C1)C(c2ccccc2)N1C(c1cc(Nc2nccnc2)ccc1)=O,1 Y205-1865,O=C(C(C1)C1c1ccccc1)Nc(nccc1)c1Cl,1 G702-2820,CCc1nn2c(N(CC3)CC(C)N3c3cc(C)ccc3)c(CCC3)c3nc2n1,0 F2582-0088,CC1N(Cc2nc(N(C)C(N(C)C3=O)=O)c3n2C/C=C/c2ccccc2)CCCC1,1 D011-3159,COc(cccc1)c1OCCn1c(cccc2)c2nc1C(CC1=O)CN1c1cccc(C(F)(F)F)c1,0 Z3133072672,CC(C)(C(CC1)c(cc2)ccc2F)N1C(c1c(C)sc(CCN)n1)=O,0 F5583-0075,COc(ccc(F)c1)c1S(N1CCN(Cc2nc(-c3ccccc3)cs2)CC1)(=O)=O,1 S720-1013,Cn1nc(C(N(C[C@H](C2)Oc3ccccc3)[C@@H]2C(NC2CC2)=O)=O)c2c1cccc2,1 F3406-1286,O=C(c(nnn1Cc2cc(F)ccc2)c1-n1cccc1)NCc(ccc(F)c1)c1Cl,1 Z45540878,CC(C)(C)CC(C)(C)NS(c(cc1)ccc1OC)(=O)=O,0 G414-0729,Cc1ccc(CNc2c(cnn3C)c3nc(NC3CCN(Cc4ccccc4)CC3)n2)cc1,1 F6787-1299,Cc1ccnc(OCC(CCC2)(C3)C2CN3c2nc(COC)ns2)n1,1 Z4875261179,NCC1C(CC(F)(F)F)CCCC1,0 Z2628993467,CC(CN(CC1)C[C@H](C2)[C@@]12O)=Cc1ccccc1,1 Z3666852686,CC(c1ccccc1)N(CC1)CC1NC(c1cc(ccc(O)c2)c2[nH]1)=O,1 Z2034448223,CC(NCC(CC1)CCN1c(cc1)ncc1F)=O,0 V018-4224,CC(C(N(CC1)c(cc2)ccc2Oc2ccccc2)=O)N1C(c(cc1)ccc1Br)=O,0 F6142-0206,Cc1nc(Nc(cc(cc2)Cl)c2OC)nc(N)c1,0 F6445-7064,Cc1cc(NC(C(C(OC)=C2)=CN(C)C2=O)=O)no1,1 F6556-7797,CC(Cc1cc(cccc2)c2o1)NC(Nc1cccs1)=O,1 F6515-1393,O=C(NCc1cc(-c2ccco2)ncc1)N(CCN1)C1=O,1 Z1343760562,Cc(cc1)cc(C)c1N(CCC(N1)=O)C1=O,0 F711-0370,OCc(n1CC(NC2CCCC2)=O)cnc1SCC(N(CC1)c2c1cccc2)=O,1 F6807-6884,CCOC(N(CC1)CCN1c1nccc(C(F)(F)F)n1)=O,0 E783-0159,Cn1c(-c(cc(cc2)S(NCCN(CC3)CCN3c(cc3)ccc3OC)(=O)=O)c2OC2=O)c2nc1,1 G262-0690,CC(CC(NCCCN(CCC1)c2c1cccc2)=O)n1nc(C)cc1C,1 Z2178315053,CCS(c(cc1)ccc1C(Nc1nn(C)c(C2CC2)c1)=O)(=O)=O,0 Z4180225438,Cc1nnc(CNC(Cn2nnc([C@@H](c3ccccc3)O)c2)=O)s1,1 SD62-0032,O=C(CCCc1c[nH]c2c1cccc2)N1CC2(CCC2)C(CCC(N2CCOCC2)=O)C1,1 F6482-4010,O=C(NC1(CC(C2)C3)CC3CC2C1)N(CC1)CCC1n1nccn1,1 F6368-0264,O=C(CN1CCN(CCn2c(-c3ccccc3)ncc2)CC1)N1CCOCC1,1 F417-0190,CCC(C)NC(CN(c(cccc1)c1-n1c2nnc1C)C2=O)=O,1 F6514-3115,CC(c1cccc(S(N(C2)CC2OCC(F)(F)F)(=O)=O)c1)=O,0 Z2449416528,CC(C)(Cc1c(C)cccc1)NC(c1ccc(CN)cc1)=O,0 Z3524012572,CC(C)(C(O)=O)c(cc1)ccc1C(NC(C)(CC1)CC1(F)F)=O,0 Z1583412122,Cc1c(C)sc(S(Nc2cn(-c3ncccc3F)nc2)(=O)=O)c1,0 F6673-9329,Cc1noc(C)c1CN(CC1)CCC1N(C)c(nc1)ncc1Cl,1 F6469-1016,CC(C(Nc(cccc1)c1-c1csc(C)n1)=O)N(C(C=C1)=O)N=C1c1cccs1,1 Z1949047379,CC(N(C[C@@H](C1)O)[C@H]1C(NCc(cc1)ccc1OC(F)(F)F)=O)=O,0 M976-0210,CCC(N(CC1)c(cc2)c1cc2N(CC(C1)C(NCc2ccncc2)=O)C1=O)=O,1 SB57-1282,Cc1noc(C(C2)C(C3)(CN3C(c(cc(cc3)Cl)c3F)=O)CN2C(COC)=O)n1,0 D512-0279,CCOc(cc1)ccc1N([C@@H](CS(C1)(=O)=O)[C@@H]1N(CCC(C)C)C1)C1=O,0 Z1935250890,CCC(C(N(CSC1)C1C(NCC1CC1)=O)=O)c1ccccc1,1 G857-0425,O=C(CSC(C(CCC1)=C1N1Cc2ncccc2)=NC1=O)N(CC1)c2c1cccc2,1 Z1763584640,CC(Nc1cc(C(N(Cc2c(C3)cccc2)[C@@H]3C(N)=O)=O)c(C)cc1)=O,0 F6495-2822,O=C(c1ncnc(N2CCOCC2)c1)NCCN(C=NC(c(cc1)ccc1F)=C1)C1=O,1 Z739989904,NC(C(CCC1)CN1c1ccc(CNC(c(cc2)ccc2N(CCCC2)C2=O)=O)cc1)=O,1 Z2762267451,O=C(Cc(ccc(F)c1)c1F)Nc1c(C2CNCC2)[nH]nc1,0 Z1225584407,CC(NCC1OCCN(CC(Nc2cc(C)nn2-c(cccc2)c2F)=O)C1)=O,1 F6438-3556,CN(C)c1nc(CNC(CN(C=Nc2c3cccc2)C3=O)=O)nc(N(C)C)n1,1 F6616-8125,Cc1c(C)sc(N2CCN(Cc3cnccc3)CC2)n1,1 S700-1107,O=S(c1cc(CCC2)c2cc1)(N(C1)CC1c1nc(CCOCC2CCOCC2)no1)=O,1 F6262-1119,CCOc1c(C(Nc2ncnc(OC)c2)=O)c2ccccc2cc1,1 Y044-5652,O=C(CC(c1cscc1)n1cccc1)Nc1n[nH]c(CCC2CCCC2)n1,1 Z1319382913,O=C(C(CC1)CCN1c1nccnc1)Nc(cc1)cc2c1nc[nH]2,1 S428-1348,CN(CC(N(CCC1)C1c1nc(C2CCOCC2)no1)=O)S(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,1 Z3101565377,CC1(C)N(CCNC(N(CC2)CCC2c2cncn2C)=O)CCOC1,1 Z2936883573,CC(C1CC1)(c1nc(-c(nc2Br)ccc2OC)no1)O,0 Z4475764860,CC(C(N1)=O)(c2cccc(C(N3CC(c(cc4)ccc4S(C)(=O)=O)OCC3)=O)c2)NC1=O,0 F2496-1997,Cc1cc(COC(COc(ccc(Cl)c2)c2Cl)=O)no1,1 SB21-1328,NC(c1cn(C[C@H](C[C@@H](C2)F)N2C(c2n[nH]c-3c2COc2c3cccc2)=O)nn1)=O,1 8602-0409,CC(C(C1(C(F)(F)F)NC(c(cccc2)c2OC)=O)=C(C)N(CC2OCCC2)C1=O)=O,1 8018-2038,COc1ccc(C(C2)c(c(-c(cc3)ccc3OC)n[nH]3)c3OC2=O)cc1,0 Z2930761716,CC(C)(C)c1nnc(C2)n1CCN2C(NCC1C(C)(C)OC(C)(C)C1)=O,0 Z3906587372,OC(CC1C2)(C2CC1NC(Cc1csc(C2CCCC2)n1)=O)C(F)(F)F,1 F2573-0444,O=C(c(c(F)ccc1)c1F)NCC(c(cc1)cc2c1OCO2)N(CC1)CCN1c(cccc1)c1F,1 Z1592799397,CCC(C(N(CC1)Cc2c1[nH]nc2)=O)c(cc1)ccc1OC,0 Z1539031204,Cc1nc(cccc2)c2n1CC(CCC1)N1C(CNC(NC)=O)=O,1 T622-0152,CC(C)N(CC1)CCN1C1CC(CC2)(CCN2S(c2cn(C)cn2)(=O)=O)OCC1,1 Z2160449149,CN(c(c(C(N1)=O)c2)ncc2-c2nc(C3(CCC3)NC(c3ccccc3)=O)no2)C1=O,1 Z291919488,Cc(cc1)ccc1SCC(CN1)OC1=O,0 Z1474299728,Cc(c1cc(C(NC(CCC(N2)=O)C2=O)=O)cnc11)nn1-c1ccccc1,1 F6444-0612,O=C(COc(cc1)ccc1Cl)N(CC1)CCC1N1C(COCc2ccccc2)CCC1,1 Z4438322109,CCN(c(cccc1)c1N1CC(Nc2cncc(F)n2)=O)C1=O,0 F6178-5720,O=C(c(c(F)ccc1)c1Cl)NCC(CC1)CCN1c1nc(cccc2)c2o1,0 F6685-8987,O=C(c(ccnc1)c1F)N1CC(COc(nccc2)c2Cl)CCC1,1 Z57705817,Cc(cc1)ccc1N(CC1)CCN1S(c1ccccc1)(=O)=O,0 Z4057124156,CC(C)C1OCCC1CN(CC(NC)=O)C(c1ccc(C)o1)=O,1 T473-1498,CCn1ncc(CN(CC2)CCN2c2cc3nnc(C4CC4)n3nc2)c1C,1 F2979-0559,O=C(CSCc1ccccc1)N(Cc1ccco1)c1nc(cccc2)c2s1,1 S824-2255,Cc1noc(C)c1C(N(C[C@@H]1COC)C[C@@H]1c1ccncc1)=O,1 SC42-0419,Cc1noc(C)c1C(N(CC1)CCC11OCCC(Cc2noc(C3CCC3)n2)C1)=O,1 F6559-0072,Cn(cc1)c2c1C=CN(CCNC(c(cn1)cc(Cl)c1O)=O)C2=O,1 Y204-3610,OC(C(C1CC2CC1)C2C(Nc(cc1)cc2c1OCCO2)=O)=O,0 Z2720358793,O[C@H]1C[C@@H](CNC(c2coc(cc3)c2cc3F)=O)C1,1 Z4591044357,COC(c1ccc(C2CNCC2)cc1)=O,0 E197-0310,CC(CC1)CCC1NC(CN(C)S(c(cc1)cc(C2(C)C)c1N(C)C2=O)(=O)=O)=O,0 Z66173077,Cc(cc1)ccc1-c(n1-c2ccc(C)cc2)nnc1SCC(O)=O,0 Z816263284,O=C(C1(CCOCC1)c(cc1)ccc1F)NCc1nnc2n1CCCCC2,1 F6482-2262,O=C(CSC1CCCC1)NC1CC2OCCOC2CC1,1 F414-0392,O=C(c1c(Nc2cccc(Cl)c2)[nH]nn1)NCc(cc1)ccc1Cl,0 Z1348374002,CS(N1CCC(CNc2nc3ccccc3cc2C#N)CC1)(=O)=O,1 F3145-4944,CCOC(c(cc1)ccc1NC(c1cnccc1)=O)=O,0 SB33-0121,Cc1n[nH]c([C@@H](CN(C2)C(CC3CCCC3)=O)[C@H]2NC(C2CCCC2)=O)n1,1 Z2359027236,CC(C)(C1)CC1N(C)S(c(cccc1C)c1C#N)(=O)=O,0 F6415-1258,CC(C(N(CCc1cccs1)Cc1cocc1)=O)Oc1ccccc1,1 Z2983354138,NC1(CCCC1)c1noc(C2NCCOc3c2cccc3)n1,0 SA50-0551,Cn(c(C1)c2CN1S(Cc1ccccc1)(=O)=O)nc2-c1nc(COC)no1,0 F6556-6550,O=S(c(cc1)ccc1-n1nccc1)(N(CCC1)CCN1C1CSCC1)=O,1 SC85-0879,Cc1cc(C)nn1CCC(N(C1)C[C@]2(CN(C)CC2)[C@@H]1c1nc(-c2nccnc2)no1)=O,1 Z3203056901,CC(C)(C)C(c1noc(O)n1)NC(C(CC1)CCC1Cl)=O,1 F6543-5604,O=S(c1c2cccc1)(N=C2N(C1)CC1C(F)F)=O,1 J087-0121,O=C(C(S(c1c2cccc1)(=O)=O)=C2NCC1OCCC1)Nc1ccccc1,0 Z1827253829,N[C@@H](CCCC1)[C@H]1NC(c1c(cccc2)n2nc1)=O,0 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Z787489436,O=C(C(c1c2cccc1)=NNC2=O)N1CCN(CC2CCCCC2)CC1,1 Z3832074632,C=C[C@@H](C1)[C@H]1C(NS(c1cnccc1)(=O)=O)=O,0 Z1958054362,Cc1c(C)sc(CCNS(c2c(C)cc3OCOc3c2)(=O)=O)n1,0 Z2951400432,CCN(C)C(CN(CC1)CCN1c1cncc(OC)c1)=O,0 Z2980898209,Cc1nn(CC(CC2)C(N(C3)CC3c3cccc(Cl)c3)=O)c2n1,1 Z2004198609,Cc(n1nc2)cc(C)nc1c2C(N(CC1)CCC1N(CC1)c2c1cccc2)=O,1 J500-0606,CN(CC1)CCN1C(C(C1)C2(CCCC2)CN1S(C)(=O)=O)=O,0 D393-0236,Cc1c2nc(C)cc(NC3CCCC3)n2nc1-c(cc1)cc(OC)c1OC,0 Y300-1053,CC(C)Oc1cccc(CNC(c2ccc(CN3CCCC3)cc2)=O)c1,0 Z1531355670,CC(C(N(CC1)CCC1(COC)O)=O)N1CCC(Cc2ccccc2)CC1,1 Y031-4953,CCCCN(CC(C1)C(Nc2nc(ccc(OC)c3)c3s2)=O)C1=O,0 Z4945791118,Cc1cccc(-c2cccc(C(NC)=O)c2)c1,0 SA45-0870,CN(CCCC1(CC2)CCN2C(COc2ccccc2)=O)C1C(N1CCCC1)=O,1 F6244-3045,CN(CC(NCC#CCN(CC1)Cc2c1cccc2)=O)S(C)(=O)=O,0 SA45-1067,CN(C)C(C1N(C)CCCC1(CC1)CCN1C(C1CCCC1)=O)=O,1 T158-0715,CC(C)n1c(C2CN(Cc3ccc(C(F)(F)F)cc3)CC2)ncc1C,0 Z1970516326,CCCN(CCC)S(N[C@@H](CC1)C[C@@H]1C(O)=O)(=O)=O,0 F6677-1389,CCc1nccn1CC(C1)CN1C(c1cscn1)=O,1 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F6523-1978,O=C(C1COCC1)NC(CC1)CCN1c1n[nH]c(-c2cccs2)c1,1 F2705-0088,CCOCCN(C(c1c(N2C)nc3oc(C)c(C)n13)=O)C2=O,1 F5140-0338,CS(N(CCC1)CC1C(N(CC1OCCC1)c1nc(cccc2)c2s1)=O)(=O)=O,1 S615-0347,O=S(c1cnccc1)(N(CC1)CC1c1nc(CCOCC2CC2)no1)=O,1 F6673-9288,Cc1ccnc(N(CC2)CCC2N(C)c(nc2)ncc2Cl)n1,0 F6199-0154,O=C(COc(cccc1)c1F)N1CCN(CCn2cncc2)CC1,0 Z1696868584,CC(C)(c1cn(-c(cc2)cc(F)c2Br)nn1)O,0 F6658-2271,CN(C(C1)CN1c(cc1)nn2c1nnc2)S(Cc1cc(C(F)(F)F)ccc1)(=O)=O,1 8017-4483,CN(c1c(C(N2C)=O)n(Cc3cc(C(F)(F)F)ccc3)c(SCC(NC3CCCCCC3)=O)n1)C2=O,1 E234-0787,CC(CCCC1)C1NC(C(C)(Cn(c1c2)c3c2c(OC)ccc3OC)N(Cc2cccs2)C1=O)=O,1 SB66-0036,CC(C)n1ncc(CN(C[C@H]2CCC3)C[C@@H]2NC3=O)c1,1 Z1686738097,CC(c1nc(-c2cc(F)c(C)cc2)no1)Nc1cn(CC(F)F)nc1,0 F6561-3515,C=C(CC1)CCC1NC(c1cc2nsnc2cc1)=O,1 F6808-5286,CC(C)NC(C(C)N(CC1)CCN1c1nc(cncc2)c2s1)=O,1 Y040-1246,O=C(COc(cc1)cc(O2)c1C(CCC1)=C1C2=O)Nc(cc1)ccc1S(N1CCOCC1)(=O)=O,1 F6521-9371,COC(CNC(c(cccc1)c1SC)=O)(C1)Cc2c1cccc2,0 F6561-4804,C=C(CC1CC2)CC2N1C(CSC1CCCC1)=O,1 Z1569426070,CNC(N1CCN(Cc2ccc(-c(cc3)ccc3Cl)o2)CC1)=O,0 F6515-0603,COC(c(cc1)ccc1C(NCc1cc(-c2cccs2)ncc1)=O)=O,0 F5855-0335,CC(C)Sc1ccc(CC(N(CC2)CCN2C(C(C2)C2c2cccs2)=O)=O)cc1,1 F3375-0246,Cc(cc1)ccc1SC(Cc1ccccc1)C(O)=O,1 V002-2706,CC(CN(CC1)c2cc(Oc(ccc(Cl)c3)c3F)ncn2)N1C(COc1ccccc1)=O,0 V003-6376,CCc1nc(C2CC2)nc(N(CC2)CCN2C(N(C)C)=O)c1Cc1cccc(Cl)c1,0 Z1007500358,Oc1cccc(C(N(CC2)CCN2C(c2c(C3CC3)oc(-c3ccccc3)n2)=O)=O)c1,1 S219-0134,Cc(nc1)cnc1C(N(C(C1)c2nc(C3CC3)no2)c2c1cccc2)=O,1 F6573-8247,O=C(c1ccco1)N(CCN1c(nc2)ncc2F)CC1=O,1 F6480-5406,O=C(Cc(cccc1)c1Cl)N(CCC1)CC1Oc1ncncc1,0 F6497-1165,Cc(cccc1)c1-c1noc(CC(CCC2)CN2C(c2c3OCCOc3ccc2)=O)n1,1 V015-1847,Cc(c(CN(CC(Cc1ccccc1)O)C1CC1)c1Oc(cc2)ccc2OC)nn1-c1ccccc1,0 S696-0234,Cc1cnc(-c2ccccc2)n1CC(C1)CN1C(NC1CCCCC1)=O,1 F2072-0212,O=C(NCc1nnnn1-c(cc1)ccc1Cl)NC1CCCCC1,1 Z2923139983,Cc1nn(Cc2ccccc2)c(Cl)c1CN1[C@@H](CS(C2)(=O)=O)[C@@H]2NCC1,1 F6372-1836,Cc(n(-c1ccccc1)nc1)c1C(Nc1c(Cc2nc(-c3ccco3)no2)cccc1)=O,1 F6178-7666,O=C(c1noc(C2CC2)c1)NCC(CC1)CCN1C1CSCC1,1 SC98-0288,CC(C)n(c1c2CN(Cc3cc(F)cc(F)c3)CC1)nc2-c1ncc(C)o1,0 F6230-0187,O=C(c(cc1)ccc1S(N1CCOCC1)(=O)=O)NCc1c(cccc2)n2nc1,1 F6549-2862,O=C(c1cccc(OC(F)(F)F)c1)N(C(CC1)C2)C1CC2n1cncc1,0 P316-0609,Cc1cc(N(CCC2NS(c(cc(cc3)OC)c3OC)(=O)=O)C2=O)cc(C)c1,0 C786-4157,CC(c(cc1)cc2c1OCCO2)NC(CN(C(c1c2)=O)N=Cn1c(cc1)c2cc1F)=O,1 F5893-0006,COc1ccc(cccc2NC(Cn(cc3)c4c3cccc4)=O)c2n1,1 SB24-0411,O=C(c1cn(C(CC2)C2(CC2)CCN2C(c2cnccc2)=O)nn1)N1CCOCC1,1 Z4522000270,CCn1nc(C2CC2)c(C(N(C2)C(C)CCC2NC(C2(C)CC2)=O)=O)c1,1 Z2091790304,CC(CC(CCC1)N1C(C(CCC1)CC1(F)F)=O)(C(N1)=O)NC1=O,1 Z976262608,O=C(c(cc1)ccc1N(CCO1)C1=O)N1c2cccc(F)c2C2(CCCC2)C1,1 F6516-0232,O=C(c1noc2c1CCCC2)NCc1ccc(-c2cccs2)o1,1 F1407-0059,CC(CCCC1C)N1C(c1cccc2c1-c(cccc1)c1C2=O)=O,1 Z2219675552,COc1cc(C(NCCc2coc(-c3ccccc3)n2)=O)cc(Cl)c1,0 Z2971544880,COC(C1)(CN1C(NCc1ccc(C(N)=O)o1)=O)C(F)(F)F,1 Z2267530966,CC(C(N(CC1)c(cc2)c1cc2OC)=O)Oc1ncccc1,1 S984-1688,CC(C)N(C[C@H]1CN(C2)C(c3cnco3)=O)C[C@]12C(N1CCCC1)=O,0 F1441-0767,Cc1noc(C)c1CSc1nnc2n1c(cccc1)c1cc2C,1 SC85-0502,CN(CC1)C[C@@]1(CN(C1)C(c2cc(Br)cnc2)=O)[C@@H]1c1nc(-c(cc2)ccc2F)no1,1 Y040-4906,O=C(COc(cc1)ccc1C1=Cc(cccc2)c2OC1=O)NC(CC1)CS1(=O)=O,1 Z1172022524,CC(C(N(CCC1)C1c(cc1)ccc1F)=O)c1c(C)[nH]nc1C,1 Z4327478558,CC(c1cn(-c(cc(C)cc2)c2C(N2[C@@H](C)CCC2)=O)nn1)NC,1 Z2287839649,C[C@H]1[C@@H](C(NS(c2cc(N(C)C)c(C)cc2)(=O)=O)=O)OCC1,0 F6454-0004,O=C(C1CC1)NCC(CC1)CCN1c1cnccc1,1 F6529-0091,CN(c(cccc1)c1N1C(CC2)CCN2C(c(cc2)cc3c2OCO3)=O)S1(=O)=O,1 Z3595074680,Cc1cc(C(N(C)CC(N2)=NNC2=O)=O)nn1-c1ccc(C)cc1,1 Z1510559988,Cc(ccc(C(N(CC1)CCC1c1ncccc1)=O)c1)c1S(C)(=O)=O,0 Y205-5390,CCn1ncc(S(Nc(cc2)ccc2S(N2CCC(C)CC2)(=O)=O)(=O)=O)c1,1 F946-0420,Cc1noc(C)c1N(C(C=C1)=O)N=C1c(cc1)cc(S(N(C)Cc2ccccc2)(=O)=O)c1OC,0 F6110-1862,CC1N(CC(CC2)CCN2C(COC)=O)CCN(C)C1,0 Z2974629647,O=C1N(CCNc2ncnc3c2CCC3)Cc(cccc2)c2OC1,1 F3237-0545,CCOc(cc(C)c(C(C)C)c1)c1S(N(C)C)(=O)=O,0 SC03-1159,O=C(c1nccnc1)N(CC1)CCC1OCCc1noc(C2CC2)n1,1 F3395-0439,O=C1OCCC1N(CC1)CCC1N(CC1)CCN1c1ncc(C(F)(F)F)cc1,1 F6670-6096,CC(N1CC(CC2)CCN2c2ncnc3c2CCCC3)=Nc(cccc2)c2C1=O,1 F6149-0020,O=C(C(CCC1)CN1c(cc1)nnc1-n1nccc1)NCc1ccco1,1 8017-8503,Cc1ccc(-c2nnc(CSc3nc(cc(cc4)Cl)c4n3C3CCCCC3)o2)o1,1 SB29-0240,Cc1noc(C)c1CN(C[C@H](C1)OCc2ccccc2)[C@@H]1c1n[nH]c(C)n1,1 Z4052028582,Cc1nn(cc(cc2)NC(c3cc(C(Nc4ccccc4)=O)ccc3)=O)c2n1,1 S900-0089,CC(C)NC(CN(C)C([C@H](C1)NC2(CCCC2)c2c1[nH]cn2)=O)=O,0 F6436-3652,COCCN(Cc1cocc1)C(Cc(c(F)ccc1)c1Cl)=O,0 Z2971266295,Cn(cc1CNC(NC(CC2)c3c2c(O)ccc3)=O)nc1OC,0 F6471-3833,COC(C(C(N(C1)CC1Oc1nccs1)=O)=CN1c2ccccc2)=CC1=O,1 F6752-4238,O=C(C1OCCN(Cc2nc(CCC3)c3s2)C1)NC1CC1,1 F6713-7358,Cc1c(CN(CC2)CCN2c(cc2)nnc2-c2cc(F)ccc2)sc(C)n1,1 Z4767056383,CC1N(Cc2c(CNC(c3c(Cn4nncc4)cccc3)=O)cccc2)CCCC1,1 F5475-0124,O=C(C1(CC1)c(cc1)ccc1F)N(CC1)CCN1c(cccc1)c1F,0 Z740736156,COc(ccc(Br)c1)c1NC(c1ccc(Cn2nnc3c2cccc3)cc1)=O,0 S904-1722,CN1Cc2nnc([C@H](C3)N(Cc(cc4)cc(Cn5cncc5)c4OC)C[C@H]3O)n2CC1,1 Y041-4867,c12c(\C(=C/C(O1)=O)\C)cc(c(c2)OC)CCC(N[C@H](C(=O)O)c1ccccc1)=O,1 F5832-5077,O=C(Cc(cccc1)c1Cl)NCC(c1ccco1)N1CCOCC1,1 D016-0642,CC(c(c1c2ccc(OCC(CN3CCOCC3)O)c1)c(C)n2-c1ccc(C)cc1)=O,1 Z2435069459,CC1(CC1)NS(c1cc(cccc2C)c2s1)(=O)=O,1 F6401-0082,O=C(CC(C1)c2cccs2)N(Cc(cc(cc2)F)c2F)C1=O,1 F6658-5802,CN(C=CC(CN1CCC(COc2ncnc(C3CC3)c2)CC1)=C1)C1=O,1 F6562-8055,O=C(c1cscc1)NCC1c(cccc2)c2OC1,1 Z1836535621,CC1N(Cc2ccc(CNC([C@@H](C[C@H](C3)O)N3C(C)=O)=O)cc2)CCCC1,1 SA93-0110,CCOc(cc1)ccc1-c1n[nH]cc1CN(CCC1)CC1(C)C(N)=O,0 F0915-2916,CC(C)c(ccc(C)c1)c1OCC(Nc(cc1)ccc1C(O)=O)=O,0 Z4605252260,CC(C)c1ccc(C(N(C)C2CN(CC3CCCC3)CC2)=O)s1,1 F2609-4396,O=C(c1nccnc1)N(CC1)CCN1c(sc1ccc2)nc1c2Cl,0 F5190-1923,Cc(cc1C)cc(C)c1S(Nc1ccc(CC(N(CC2)CCC2O)=O)cc1)(=O)=O,1 F6619-6053,Cc1nc(N2CCOCC2)cc(N2CCN(CCN(C(c3c4cccc3)=O)C4=O)CC2)n1,1 Z4965653227,[O-]C(C(CC(Nc1cc2ccccc2nc1)=O)Cc1ccccc1)=O,1 F6472-0878,O=C(NCCSC1CCOCC1)NCc1cccs1,1 SC02-0441,Cc1c(COC)c(C(N(CC2)CC2(CCOC)NS(c2ccccc2)(=O)=O)=O)no1,1 Z1465421913,O=C(NCCc1cc(cccc2)c2[nH]1)NC(CC1)CCN1C1CCCCC1,1 F5042-0459,O=C(CSc(cc1)ccc1F)N(CC1)CCN1c(cc1)nnc1-c1ccco1,1 V010-2949,CCCC(CN(CC1CC1)CC(N(CC1)C(COc2ccc(C(C)C)cc2)c2c1scc2)=O)O,0 F1967-2627,COC(c1noc(-c(cc2OC)cc(OC)c2OC)c1)=O,0 F6475-5299,O=C(c1cc(OCC2CCOCC2)ncc1)N(CC1)CCN1c(cc1)ccc1Cl,1 Z1452017199,CC(C1)(C2)CC(C)(C)CC1N2C(Nc1cc(-n2nncc2)ccc1)=O,1 D757-0275,O=C([C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1)N(CC1)CCC1c1nnc2n1cccc2,1 Z785019324,CC(c1cnccc1)Sc1nc(cccc2)c2c2nc(C)nn12,1 G430-1287,C(c1ccccc1)N(CC1)CCN1c(c1c2)nccn1nc2-c1ccccc1,0 Z3057073551,OCC(C[C@H]1C2)C[C@@H]1[C@@H]2NC(c(cc1)ccc1Cl)=O,1 Z2475520638,Cc1c([C@@H](C2)[C@H]2N(C(C(Cc2ccccc2)N2)=O)C2=O)cccc1,1 F5857-6842,OC(CCNC(Cc1cccs1)=O)c1ccccc1,0 Z3468475018,Cc(cc1)cc2c1c(C(N(C)CC1CC1)=O)c[nH]2,0 Y043-2150,Cn(cc1)c2c1ccc(C(Nc(cc1)ccc1N(CCCC1)S1(=O)=O)=O)c2,1 S694-1819,Cc1cnc(C2CCC2)n1C(CC1)CN1C(CCCc1c[nH]c2c1cccc2)=O,1 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F3407-2766,CCOC(c1cccc(NC(CN(c(cc(C)c(C)c2)c2N=C2C3CCC2)C3=O)=O)c1)=O,0 Z2179611192,Cn1c(N(CC2)CCC2NCCO)nc2cccc(F)c12,0 F6481-0916,O=C(c1ncn[nH]1)N(CC1)CCSC1c(cccc1)c1Cl,0 Z2874526312,Cn1nc(CCCC2)c2c1C(NS(Cc1cc(F)ccc1)(=O)=O)=O,1 F5835-0683,O=C(c1nc2ccccc2nc1)Nc(cc1)ccc1-c1n[nH]cc1,1 Y041-7785,O=C(C(CCC1)CN1c1ncccn1)NCCCc1nc(cccc2)c2[nH]1,1 Z2963399829,Cn1nc(C(NC(CO)c2c(C(F)(F)F)cccc2)=O)c(Cl)c1,0 F1762-0047,COc(cccc1)c1NC(c1ccc(CSc2ncccn2)cc1)=O,0 Z1083321022,Cc(ccn1nc2)nc1c2C(NCc(cc1)cnc1OC)=O,0 Z3595114449,Oc1noc(C(CC2)CCN2C([C@@H](CCC2)N2C(c2ccccc2)=O)=O)c1,1 Z1606544797,NS(c(cc1)cc2c1OCCC2=O)(=O)=O,0 S629-1901,O=C(CCc(cc1)cc(C2)c1OCCN2S(c1cc(CCC2)c2cc1)(=O)=O)NC1CC1,1 F6374-0166,O=C(CN(C(CC1)=O)C1=O)N1CCC(CSc2ncccc2)CC1,1 G266-0631,CN(c(c(N1C)c2)cc(NC(NCc(cc3)ccc3F)=O)c2N2CCCC2)C1=O,0 F6359-4786,O=C(CCC(N(CC1)CCC1Oc(nccc1)c1Br)=O)c1ccccc1,0 Z1738899182,COc(cc(cc1)Cl)c1S(NCC1(CCOCC1)C(O)=O)(=O)=O,0 F1174-0307,C(CN(CC1)c2ncccc2)N1c1nnnn1-c1ccccc1,1 S971-1113,OC(CC1)C1(CC1)CCN1S(N1CCOCC1)(=O)=O,1 L461-0286,O=S(c1c(C(F)(F)F)cccc1)(N(CCC1)CCN1c1nc(cccn2)c2s1)=O,0 T159-0689,CCCn1c(CC2CN(Cc3cccc(F)c3)CCC2)ncc1C,0 SD22-0143,COC1(CC1)C(C1)(CN1C(c1cocc1)=O)NC(c1ccccc1)=O,1 F6616-7259,Cn1ncc(NC(c2cc(Br)cs2)=O)c1,1 Z230166938,Cc1cc(-c2cc(C(Nc3ccc(Cn4cncc4)cc3)=O)c(c(C)no3)c3n2)c(C)o1,1 Z2465400400,O=C(c1cnc(C(F)(F)F)cc1)N(CCNC1)C1c1cccc(F)c1,0 Z4277550537,CS(N[C@@H](CC1)CN1S(C(C1)C11CCCCC1)(=O)=O)(=O)=O,1 F5147-0712,O=C(COc(cc1)ccc1Cl)NCCCN(C(C=C1)=O)N=C1c1ccco1,1 L008-0327,O=C(c(cc1)ccc1-c(cc1)nnc1N1CCOCC1)Nc(cc1)cc2c1OCCO2,1 Z1173753626,Cc1c(CNc2ncnc3c2ncn3C)ccc(Br)c1,0 Z1347702902,CC(NC(C(C(NCc1cnccc1)=O)=C1)=O)=C1c1ccccc1,1 F6573-5308,CN(C(C=C1)=O)N=C1C(NCc1cnc(C2CC2)cc1)=O,1 Z1899659356,Cc1csc2c1N=CN(Cc1noc(-c3ccccc3)c1)C2=O,1 F6556-2172,O=C(c(cccc1)c1Br)NCC1(CCOCC1)N1CCSCC1,0 SB56-1128,O=S(c1cnccc1)(N(C[C@@H]1c2nc(C3CCCC3)no2)C[C@@H]1c1cnccc1)=O,1 F6451-2696,CC(C(NCC(c(cccc1)c1Cl)OC)=O)Oc1ccccc1,0 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Z2959259246,O=C(c1cc(Br)cnc1C1CC1)N[C@@H]1[C@@H]2[C@H]1COC2,1 P223-1730,CCN(CCCn1nc(C2CN(Cc3cn(C)nc3C)CCC2)cc11)C1=O,1 Z1037574560,OC(CC1)CN1c1ncc(C(F)(F)F)cc1,0 S582-0016,CN(C(CNC(c1cc(-c2ccccc2)n[nH]1)=O)Cn1c2ccc1)C2=O,0 F6524-6291,Cc(cc(cc1)F)c1S(N(CC1)CCN1C(CC1)CCS1(=O)=O)(=O)=O,0 F6481-3336,O=C(N1CCOCC1)N(CC1)CCSC1c(cc(cc1)F)c1F,0 S812-0295,CCCC(c1nccn1CCC1)N1C(c1cccn1C)=O,1 F6574-0079,O=C(CSCc1ccccc1)NCc1nccnc1-c1cocc1,1 F6681-3597,C(C(C1)CN1c(cc1)nn2c1nnc2)Oc1cnccc1,1 S595-0616,O=S(c(cc1)ccc1F)(N(CCCC1)C1c1noc(COCC2CC2)n1)=O,0 F6619-5505,CCNc1nccc(N(CC2)CCN2c(ncnc2)c2F)n1,0 Z3009379623,Cc1c(CNS(N(CC2)CCC2OC)(=O)=O)ocn1,1 P121-0750,Cc1cccc(NC(NC2=CC=C(C)N(CC(N3CCN(C)CC3)=O)C2=O)=O)c1,1 F5003-0107,CC(CSc1nnc(-c2cn(C)nc2OC)n1C)=O,1 Z229304254,Cc1cccc(CN(C)S(c2cccc(Cl)c2)(=O)=O)c1,0 SA92-0746,O=S(C1CC1)(N(CCC1)CC1(c1nc(C2CC2)no1)F)=O,1 F6546-1833,CC(CCC1=NN2CCn3nccc3)CC1=CC2=O,1 G856-5132,O=S(c(cc1)cc2c1OCCO2)(NCCc1csc2nc(-c(cc3)ccc3Cl)nn12)=O,0 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F5791-2809,Cc1ccc(c(NC(CSC2CCCC2)=O)ccc2)c2n1,1 SC89-0464,CN1CCN(CC(CC2)C(C3)(CN3C(c3cc(ccc(OC)c4)c4[nH]3)=O)S2(=O)=O)CC1,1 Z4025709945,CCOC(c1c(C(F)F)nc(N(CC2)CC(N=CN3)=C2C3=O)s1)=O,0 F6241-0130,O=C(C(COC1)N(Cc2ccccc2)C1=O)NCc1cnccc1,1 F6482-2010,CCS(C(C1)CN1S(c(cc1)ccc1-n1nccc1)(=O)=O)(=O)=O,0 F153-0812,COc(ccc(C(C1=C2CCCC1)=NNC2=O)c1)c1S(N1CCCCCC1)(=O)=O,1 Z2296047565,OC(CN(Cc1cccc(Br)c1)C(CC1CCOCC1)=O)=O,0 S606-1202,CCN(c1c(N2[C@H]3CN(CC4CCCCC4)CC3)nccc1)C2=O,1 F6713-1436,CC(C)(C)C(C=C1)=NN(C(CC2)CCN2c2ncnc(C)c2C)C1=O,1 Z3138579434,O=C(c1cc(cncc2)c2[nH]1)N[C@]1(CCC2)[C@@H]2CNC1,1 Z1473858825,CCC(C)(C(Nc(cc1)cc(C)c1C(O)=O)=O)C#N,0 F6761-7665,CC(C)OCc1ccc(C(N(CC2)C(C3)C2CN3c2nccc(C(F)(F)F)c2)=O)o1,1 Z3655302095,OC([C@H](C1)SC[C@H]1NC([C@H](C[C@@H]12)C[C@@H]2C1(F)F)=O)=O,1 S594-0816,Cn1cnc(S(N(CC2)CCC2c2noc(COc3cnccc3)n2)(=O)=O)c1,1 Z1865617015,Cc1noc(CC(c2ccccc2)NC(Cc2c(C)cccc2)=O)n1,1 P935-0400,Cn1c(C(CCCC2)N2S(c2cccs2)(=O)=O)nnc1,1 F6782-7241,Cc1cccc(NS(c(cccc2)c2N)(=O)=O)c1C,0 SB21-1407,O=C(Cc1cnccc1)N(C1)[C@H](Cn2nnc(C(N(CC3)c4c3cccc4)=O)c2)C[C@@H]1F,1 F2638-0193,CCC(C(Nc1cccc(N(C(C)=Nc2c3cccc2)C3=O)c1)=O)c1ccccc1,0 Y040-8330,CC[C@@H](C)[C@@H](C(O)=O)NC(COc1cc(C)cc(O2)c1C(C)=C(C)C2=O)=O,0 F727-0150,O=S(c(cc(cc1)F)c1F)(N(CC1)CCN1c1ncnc(-c(cc2)ccc2F)c1)=O,0 Z1240717559,O=C(C1=CN=C2SC=CN2C1=O)N(CCC1)CCN1C1CCCC1,1 F6560-4885,CC(C)C(Cn1nncc1)NC(c1cccc(SC)c1)=O,0 S721-0476,CNC([C@H](C[C@@H](C1)Oc2cnccc2)N1S(c1cc(CCC2)c2cc1)(=O)=O)=O,1 F6560-4898,CC(C)C(Cn1nncc1)NC(c(cc1)ccc1N1CCOCC1)=O,1 Z2953076667,CC(CCN1)(C1=O)NC(Nc1nc2ccccc2cc1)=O,0 F6064-0220,Cc1noc(C(C2)CN2C(CSCc2ccccc2)=O)n1,1 Z2955958677,NC(NC(CC1)CCN1C(C1(c2ccccc2)OCCC1)=O)=O,0 F6525-1576,O=C(c(o1)ccc1Br)NCCn(c(C1CC1)c1)nc1-c1nccnc1,1 K786-6140,O=C(CN(C(CC1)=O)N=C1c(cc1)ccc1Cl)NCCC1=CCCCC1,1 Z2409367235,CNc(cc1)cc(C(Nc2cc(C3CCCCC3)nn2C)=O)c1Cl,1 C612-0515,N#CCc(cc1)ccc1NC(c1c2cccc1)N(Cc1ccccc1)C2=O,0 8020-7486,COc1ccc(C2C(C(Oc3c4cccc3)=O)=C4OC2C(NCCc2cccs2)=O)cc1,1 T990-2409,O=C1N(CCc2ccccc2)CCC1N1CCN(Cc2cnccc2)CC1,1 Z3670130212,Oc1cc([nH]c(C(N(CCO2)CC2(F)F)=O)c2)c2cc1,0 F5782-0017,O=C(CSc1ncccn1)NCC(CC1)CCC1c1nc(cccc2)c2[nH]1,1 J007-1160,CC(C)CCNC(N(CCCCC1)C1c1ccc(C)s1)=O,1 T408-1891,CN(C)C(c1cc(CC(CC2)C(Nc3cc(CCC4)c4cc3)=O)c2s1)=O,1 Y300-0103,O=C(COc(cccc1)c1F)NCc(cc1)ccc1N1CCCCC1,0 Z3528122734,CC(C)(C(CC(N(CC1)CCN1c(cc1)ncc1C#N)=O)C1)C1O,1 SC77-0773,CCC(C)(C)NC([C@H](CN(C1)S(C)(=O)=O)[C@@]11OCCNC1=O)=O,0 Z4120967043,CN1CCN(CC(N(CC2)CCN2c2c(cn[nH]3)c3ccc2)=O)CC1,1 F6560-8769,CN(C=C(C(N(C(CC1)C2)C1CC2=C1CC1)=O)C(OC)=C1)C1=O,1 F6436-0765,O=C(CSC1CCCC1)NCC(CC1)CCN1S(c1cnccc1)(=O)=O,1 F5857-1630,Cc1c(C(CNC(C2(CCCC2)c2cccs2)=O)O)scc1,0 Z2437349545,CC(C)(c1ncc(C)s1)NS(c1cnc(C)c(C(O)=O)c1)(=O)=O,0 F6436-3297,OC(CNC(c1cc(cccc2)c2s1)=O)(C1CC1)c1ccccc1,1 4333-3481,O=C1N(c2ccccc2)C(SCCc2ccccc2)=Nc2c1c(CCCC1)c1s2,1 F6559-7803,O=S(N(CC1c2nocn2)CC1c1ccccc1)(N1CCCCCC1)=O,1 Z4421150311,CC(Cn1c(N2CCC(CCN3C(C)CCCC3)CC2)nnc1C(Nc1ncccc1)=O)OC,1 D072-1610,O=S(c1c(N2CCCC2)oc(-c(cccc2)c2F)n1)(c1ccccc1)=O,0 SA47-0141,CC1(COC(C2)(CN2C(c2ccc(Cc3c(C)onc3C)o2)=O)C1)O,0 Z2444606548,CC(C)(CC(CCC1)CN1c(cc1)ncc1C(O)=O)C(N)=O,0 F6792-0847,CSc1nc(N(CC2)CCN2c2nccn3nccc23)cc(C2CCOCC2)n1,1 Z1602784950,C[C@@H](CN(CC1)C(c2nccc3ccccc23)=O)N1S(C)(=O)=O,1 Z3173356890,OC(C(C(CC1)CN1C(C1CCCCC1)=O)F)=O,0 F6414-2068,CN(C)c1cccc(C(NCC(c(cc2)ccc2SC)O)=O)c1,0 Z1145750786,CC(c1nc(C(C)(C)C)cs1)NC(c1nccnc1N)=O,1 F2672-0001,CN(CC1)CCN1C(CNC(Nc1ccccc1)=O)c(cc1)ccc1OC,0 Z4989107797,Cc1nsc(N=CN2Cc(scc3)c3Br)c1C2=O,0 F6554-2305,Cc1nc(-c(cc2)ccc2S(N2C(C3)COC3C2)(=O)=O)co1,1 F1289-0110,CN(c1c(C(N2C)=O)n(Cc3cccc4ccccc34)c(OCCOC)n1)C2=O,1 K784-7167,COc1ccc(C(C(N(CCc2ccccc2)C2)=O)N(CCc(cc3)cc(OC)c3OC)C2=O)cc1,1 Z2479699541,O=C(C1(CC2)CC2CC1)NS(Cc1cccc2ncccc12)(=O)=O,1 F824-0128,CC1Oc(ccc(S(N(CC2)CCN2C(Nc(cccc2)c2Cl)=O)(=O)=O)c2)c2NC1=O,0 F6677-2248,Cc1cn(CC(C2)CN2C(c2c(C)cc(C)cc2C)=O)nc1,0 S953-0372,N#Cc(cc1)c(C(F)(F)F)cc1N1CCC(CC2C(NC3CC3)=O)(CN2C(c2ncccn2)=O)CC1,1 F2774-0067,CCOC(N(CC1)CCN1C(CN(C(C=C1)=O)N=C1c1ccccc1)=O)=O,1 F536-0509,CC(C(Nc1c2)=O)Oc1cc(S(N(CC1)CCN1C(c1cccs1)=O)(=O)=O)c2Cl,0 Z298419280,CNC(COC(c1c(-n2cccc2)n(-c(cc2)ccc2F)nc1)=O)=O,0 F5831-8608,CC(C)Sc1ccc(CC(NCCN(CC2)CCN2c(cccc2)c2OC)=O)cc1,0 Z1455015235,Cc1c(-c(cc2)ccc2Br)oc(CCC(NCC(O)=O)=O)n1,0 F6513-1066,O=C(c1nn(CCCC2)c2c1)N(CC1)CCN1C(c(cc1)ccc1-n1cccc1)=O,1 SC72-0190,Cc1ccc(C(N(C2)CC22OCc3c2cnc(C)n3)=O)s1,0 F1274-0039,CC1(c(cc2)ccc2OC)N(c(cccc2)c2O2)C2=NN1,1 SD02-1775,CC(C)c1nnc(C(C2)N(CC(N3CCOCC3)=O)CC2(CC2)CCN2C(c2ncccn2)=O)o1,1 Z3503299039,C(c(cc1)cnc1-c1ncccc1)NC(CC1)CN1C1CC1,1 F6246-5007,O=C(c1cnccc1)N(CC1)CCC1c1nnc(-c2cocc2)o1,1 8020-8469,CN(C(C(CC(N1c(cc2)ccc2OC)=O)c(cc2)ccc2OC)C1=N1)C1=O,1 F3083-0169,OC(CN(CC1)CCN1S(N1CCCCC1)(=O)=O)COc(cc1)ccc1C(c1ccccc1)=O,1 Z1687983702,CCc1ccc(CC(NS(c2nccs2)(=O)=O)=O)cc1,0 F6480-6374,Cc1nccc(OC(CCC2)CN2C(c(cc2)cc3c2ncs3)=O)n1,1 F6549-4285,CN(C)S(c(cc1)ccc1C(N(CCCC1)C1c1cn(C)nc1)=O)(=O)=O,0 F6512-0271,O=C(CNC(OCc1ccccc1)=O)N1Cc2ccnn2CC1,1 E591-0762,CCN(CC)c(cc1)nn2c1nnc2CCC(NC(C)CCc1ccco1)=O,1 Z1385384733,Cc1cc(-c2n[nH]c(NS(c(cc3)cc(C4)c3N(C)C4=O)(=O)=O)c2)cc(C)c1,0 SC09-0505,C[C@@H]1N(Cc2ccc(C)s2)Cc(cc(cc2)-c3cnccc3)c2OC1,1 Z1626104023,OC1(CN2CCOCC2)CCN(CCCC(c(cc2)ccc2F)c(cc2)ccc2F)CC1,1 D319-0336,Cc1c(C(Nc2c(C(NCC3OCCC3)=O)c(CCC3)c3s2)=O)snn1,1 F6481-3247,CSc(nccc1)c1C(N(CC1)CCSC1c(cc(cc1)F)c1F)=O,0 F6553-7148,CC(C)(Cc1ccc2)Oc1c2OCC(N(CC1)Cc2c1sc(Cl)c2)=O,1 F3088-0077,CCc1nnc(NC(c2ccc(-c(cccc3)c3F)o2)=O)s1,1 S667-0379,CCN(C1(CCOCC1)CN(C1)C(COc2ccccc2)=O)C1=O,1 F6525-6407,Cc(n(CCNC(CSc(cc1)ccc1F)=O)nc1C)c1-c1cscc1,1 Z2300971499,OC(C(CN(CC1)S(c(scc2)c2F)(=O)=O)C1(F)F)=O,0 Z1873387535,CN1c(cc(cc2)C(NC(CC3)c(cc4)c3cc4F)=O)c2OCC1,1 F6709-0294,CCc(cn1)cnc1OC(CC1)CCN1c1nc2ccccc2nc1,1 F2017-0126,COc(ccc(Cl)c1)c1NC(CS(c1cn(CC(N2CCCC2)=O)c2c1cccc2)(=O)=O)=O,1 SC11-1564,Cc1noc(C)c1C(N(CCC1)CC1N(CCCN1CCCC1)S(C)(=O)=O)=O,1 F6529-0460,CN(c(cccc1)c1N1C2CCN(Cc(c(F)ccc3)c3Cl)CC2)S1(=O)=O,1 F6524-1930,O=C(c(cccc1)c1OC(F)(F)F)N(CC1)CC1c1nocn1,0 K783-6465,O=C(C(c1cccn1C1)N(Cc(cc2)ccc2Cl)C1=O)NC1CCCC1,1 Z3552055278,O=C(c1n[nH]c(-c2ccncc2)c1)N(CCC1)CC1N1CCOCC1,1 F6529-2045,CCOc(cc1)c(C)cc1S(N(CC1)CCC1N(CC(N1C)=O)C1=O)(=O)=O,0 Z2066961495,Cc(cc(cc1)C(O)=O)c1S(NCC(CCCC1)C1O)(=O)=O,0 F2073-0056,CC(N=C(C=CC=C1)N1C1=O)=C1NC(c1c(C(F)(F)F)cccc1)=O,0 S694-0984,Cc1cnc(-c2cnccc2)n1C(CC1)CN1C(C1(CC1)c1ccccc1)=O,0 Z1084387208,COc1c(C2N(Cc3cccc(C(N)=O)c3)CCC2)cccc1,0 F6523-0416,O=C(C(CC1)CCN1C(c1ccccc1)=O)N(CC1)CCN1c1cc(C(F)(F)F)ncn1,1 Y080-0491,O=C(C1)N(CCc2ccccc2)CC1c1nc(cccc2)c2[nH]1,0 E002-0615,O=C(Cn(c1ccc2)ncc1c2Cl)NCCc(cc1)ccc1Cl,1 F0739-0014,Cc1c(C)sc(N=C(N2c3ccccc3)SCC(NCCCN3CCOCC3)=O)c1C2=O,1 Z3582385894,CC(N(C)c(cc1)ccc1C(NC(CC(N1)=O)C1=O)=O)=O,1 F6791-4387,CC(C)(C)c1nc(CCC2)c2c(N(CC2)CC2(C(N)=O)F)n1,0 F6420-0341,COC(CNC(C(NC1CC1)=O)=O)c1cscc1,0 V011-1239,CCCc1nc(n(-c2ccccc2)nc2)c2c(N2CCN(Cc3ccco3)CCC2)n1,1 S429-1165,CC(CC1)(CCN1C(CCc1nc(cc(cc2)Cl)c2[nH]1)=O)c1noc(C2CC2)n1,1 Y502-2678,Cc(n(Cc1cccc(Cl)c1)nc1C)c1NC(c1ccc(COc2cc(CCC3)c3cc2)o1)=O,1 Z2630998488,Cc1nnc(C(Cc2c(C3)cccc2)N3C(CC(CC2)CCN2OC)=O)o1,1 Z1884537558,CC(C)(CNC(c1coc(C2CCOCC2)n1)=O)c(cc1)cc(OC)c1OC,0 Z1278196890,CNC(Cn(cc1)c2c1ccc(NC(N1CCCC1)=O)c2)=O,0 Z2256305063,CN(C(Cc1ccccc1)C(O)=O)C(CCc(cc1)cc(F)c1OC)=O,0 Z2951553868,COc1cnc(NC(NCCN(CC2)c3c2cccc3)=O)s1,1 F6481-1106,COC(c(cc1)ccc1S(N(CC1)CCSC1c(cccc1)c1Cl)(=O)=O)=O,0 Z1802173329,CC(C)CN(CC1)CCC1NC(c1cnnc(C)c1)=O,1 Z757878492,Cc1nc(-c2cccc(NC(c(cc3)cnc3C(O)=O)=O)c2)n[nH]1,0 F5303-0034,CCOC(C(CCC1)CN1S(c1cn(C)nc1C)(=O)=O)=O,0 S591-0345,O=C(NCCc1ccccc1)N(C1)CC1N(CC1CC1)C1CCOCC1,1 Z1443350227,O=C(CCC(Nc1c2c(CCC3)c3s1)=NC2=O)N(CCC1)CCN1c1cncc(F)c1,1 P936-3107,O=C(C1CCCC1)N1CC(Cc2nncn2-c2ccccc2)CC1,1 F6511-8684,CN(CC12)CC2C1NC(c(o1)ccc1Br)=O,1 F5286-0390,COc(ccc(NC(C(OC=C1OCc(cc2)ccc2F)=CC1=O)=O)c1)c1Cl,0 Z5030948208,Cc1n[nH]c2c1c(NC1CCCCC1)ncc2,1 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F6523-2362,CC(C)(C(NCc1nnc(cc2)n1nc2-c1cccs1)=O)Oc(cc1)ccc1Cl,1 SD06-0821,COCC(N[C@@H](C[C@@H](COc1ccccc1)C1)[C@H]1C(NCCN(CC1)Cc2c1cccc2)=O)=O,1 SC13-0568,CS(N(Cc1cnccc1)C1CN(CCCc2ccccc2)CCC1)(=O)=O,1 F6562-1130,Cn1ncc(C(CN(C2)S(c(cc3)cc4c3OCC4)(=O)=O)c3c2cccc3)c1,1 Z2883518630,O=C(CN(CCCCC1)C1=O)N(CC1)CC1n1nnc(C2CC2)c1,1 Z1577205327,CC(CC1)C2(CCC2)CN1C(c1cc(Cl)nc(Cl)c1)=O,1 S932-7571,C(c1cn(C2CN(Cc3ccccc3)CC2)nn1)OCc1ccccc1,1 F3088-1656,Cc1cc(C(Nc(cc2)ccc2Br)=O)c(C)o1,0 SB32-0959,COC[C@@H](CN(C1)C(c(ccc(OC)n2)c2OC)=O)[C@H]1c1nc(-c2ccccc2)n[nH]1,0 V020-9787,CC(CC1)CCN1c1nc(CCN(Cc2cccn2C)C2)c2c(Oc(cc2)cc(C)c2F)n1,0 Z5009673903,CC(CCN(C1)C(c2cc(cc(C)cc3)c3[nH]2)=O)C1C(OC(C)(C)C)=O,0 Z2732677556,Cc(cc(N)n1nc2)nc1c2C(O)=O,0 F5871-3498,Cc1nsc(NC(c(c(F)ccc2)c2F)=O)c1,0 Z1685180149,Cn1ncc(cc2)c1cc2-c1noc(-c(ccc(NC(c2cc(F)cc(F)c2)=O)c2)c2O)n1,1 Z219628462,NC(NC(CCN(C(C(Cc1ccccc1)(c1ccccc1)N1)=O)C1=O)=O)=O,1 Z1565008146,COCCN(CCN(CC(N1CCC(Cc2ccccc2)CC1)=O)C1)C1=O,1 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Z2256352702,CC(C)C(C)(CC(O)=O)NC(c1cc(CCC2)c2cc1)=O,0 F6619-6025,Cc1c(CN(CC2)CCN2c2nc(C)nc(N3CCCC3)c2)cno1,1 S726-1276,COc1ccc(C2(CC2)C(N(CC2)CCC22OCCC(CCOc3ccncc3)C2)=O)cc1,1 Y044-5222,COc(ccc(CCNC(NC(CC1)c(cc2OC)c1cc2OC)=O)c1)c1OC,0 F5857-3413,OC(CNC(C1CCC1)=O)(C(F)(F)F)c1ccccc1,0 F6792-3754,CC(C)(C)c(nc1C)nc(N2CCN(Cc3c(C)onc3C)CC2)c1F,0 F1969-0038,Cc1nc(N2CCN(Cc3ccccc3)CC2)nc(N)c1,0 Z2440983654,CC(CC1)(CCN1C(c1csc2c1cccc2)=O)N,1 Z283696932,[O-][N+](c(cc(cc1)N(CC(C2)C(N(CCC3)c4c3cccc4)=O)C2=O)c1F)=O,0 F6514-4323,O=C(c(s1)ccc1Cl)N(C1)CC1n1nnc(CN(CCC2)C2=O)c1,1 F6681-9615,CN(C(C=C1)=O)N=C1C(N1CC(COc2ncccn2)CCC1)=O,1 Z1217403510,O=C(c(cc1)cnc1F)N(CC1)CCc2c1cccc2,1 F5854-4336,O=C(Nc1cc(C(F)(F)F)ccc1)N(Cc1cscc1)C1CC1,0 F6473-0796,O=C(c1cc(-c(cc2)ccc2F)n[nH]1)N(C1)CC1N(CC1)Cc2c1scc2,1 F6521-1644,CC(c1ccc(C2(CNC(c(cc3)cc4c3ncs4)=O)CCCC2)s1)O,1 Z4521696795,CC(NN=C1COC(CCC(CC2)NC2=O)=O)=CC1=O,1 F2135-1569,Cn1c(SCc(cc2OCOc2c2)c2Cl)nnc1,1 D424-0223,CC1CCN(CC(c2c(C)[nH]c3c2cccc3C)O)CC1,0 Z1204997782,Cc(c1c2)nsc1ncc2C(N(CCC1)C1c1cc(C)cc(C)c1)=O,1 Z247398174,CC(C)C(Nc1nc(C(C)=O)cs1)=O,0 F6211-0350,O=C(c1nn(CCCO2)c2c1)NCCN(C(C=C1)=O)N=C1c1ccco1,1 Z3307798208,C[C@H]([C@@H](C(Nc1c2c(CCC3)c3s1)=O)N=C2c1ccncc1)O,0 F2881-1296,O=C(C1Oc(cccc2)c2OC1)NCCOc(cc1)nnc1-c(cc1)ccc1F,1 F396-1288,CC(C)CCN(C1=O)C(SCC(Nc(cc2)cc3c2OCCO3)=O)=Nc2c1sc1ncccc12,1 F6560-4725,CC(C)C(Cn1nncc1)NC(CCc(ccc(OC)c1)c1OC)=O,1 SC15-0285,O=C1N(CC(CC2)CCN2S(c2cc(F)ccc2)(=O)=O)CC(COc2ncccn2)C1,1 Z2397026641,N[C@@H](CCCC1)[C@H]1NC(NC(CC1)CC1c1cccc(F)c1)=O,1 Z2178748913,COCc1cc(Cl)cc(S(NCC(O)=O)(=O)=O)c1,0 J029-1027,O=C(C1(CCCC1)c(cc1)ccc1Cl)Nc(cc1)ccc1-c1nc(nccc2)c2o1,0 F6438-3138,Cc(cc1)cc(NC(NCc2nc(OC)nc(N(C)C)n2)=O)c1OC,0 F5051-0678,CCOc(cc1)nnc1-c1cc(NC(c2ccco2)=O)c(C)cc1,1 G856-0692,CC(c(cc1)ccc1NC(C(Cc1c(C2)cccc1)N2S(c1cccs1)(=O)=O)=O)=O,0 F680-0672,CC(CCc1ccccc1)NC(CSC1=Nc(cccc2)c2N(Cc2ccc(C)cc2)C1=O)=O,1 7181-0038,CC1(C)OCCC(CNCCC(c2ccco2)c(cc2)ccc2F)C1,1 Z1931544787,CC(CN(C=CC(C)=C1)C1=O)(C(N(CC1)CCC1c1ncc[nH]1)=O)O,1 F5486-0473,CCSc(cccc1)c1C(Nc1c(CSC2)c2nn1CC(NCC1OCCC1)=O)=O,1 SC91-1145,CCN(CCNC([C@](C[C@H]1CC2)(CN1C2=O)c1cc(OC)ccc1)=O)Cc1ccccc1,0 D715-1477,COc(cc1)cc(C=C2c(cc3)ccc3OCC(N(CC3)CCC3O)=O)c1OC2=O,1 F5097-0763,O=C(Cc(cc1)ccc1NC(c(cccc1)c1F)=O)NC1CC1,0 Z1626760497,CCC(C)(COCC1)N1C(c1ncc(N(C)C)nc1)=O,0 Z1335936956,O=C(CN(CC1)S(c2cn(Cc3ccccc3)nc2)(=O)=O)N1C1CC1,1 F6125-1881,O=C(COc(cccc1)c1F)N(C1)CC1C(NCc1cccs1)=O,1 S724-0822,O=C(c1cn(C2CN(Cc(ccc(F)c3)c3F)C2)nn1)N1CCOCC1,1 Z1681362660,OC(c1cc(NC(CCC2)=O)c2cc1)=O,0 Z1479088060,CCCCn1ncc(NC(N(CCC2)CCS2(=O)=O)=O)c1C,0 F6559-7828,O=C(c1cc2cccnc2cc1)NC(CC1)CCN1C(CC1)CS1(=O)=O,1 F6439-4285,O=C(c(s1)ccc1Cl)NCCn(cc1)nc1-c1ncccc1,1 D512-0035,Cc1cccc(N([C@@H](CS(C2)(=O)=O)[C@@H]2N(CCc(cc2)cc(OC)c2OC)C2)C2=O)c1,0 S835-4673,COCC1(CC2(CCN(Cc(cc3)cc(OC)c3F)CC2)OCC1)O,0 F6436-1959,O=C(c1cc(Br)cs1)N(CCc1cccs1)C1CC1,1 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Z3091747871,O=S(c(cccc1)c1F)(N(CCC1)[C@H]1c1n[nH]cn1)=O,0 Z369250528,Cc1nc(C2(CCCCC2)NS(c(cccc2)c2OC(F)(F)F)(=O)=O)no1,0 F6564-2818,CCOc(ccc(S(NCCN1N=C(C2CC2)C=CC1=O)(=O)=O)c1)c1F,0 Z2092551386,Cc(n1nc2)cc(C)nc1c2C(N1CCC2(CCC2)CC1)=O,1 Z2456835428,CC(CC1)(C(NC[C@H](CCCC2)[C@@H]2O)=O)c2c1cccc2,1 F6443-6191,Cn1nc(cc(cc2)C(NCC(CCC3)N3c3nc(cccc4)c4o3)=O)c2c1OC,1 F6677-3263,Clc1cn(CC2CN(CC3COCCC3)C2)nc1,1 F0518-0141,CCOC(C(CC1)CCN1c1ncnc2c1cnn2-c1ccccc1)=O,0 Z1843461213,CCCc(cc1)ccc1S(NC(C(C1CCOCC1)(F)F)=O)(=O)=O,0 8011-4762,Cn1c(SCC(N2c3ccccc3)=Nc(cccc3)c3C2=O)nc2c1cccc2,0 F5825-0136,COc(cccc1)c1S(N(CC1)CCN1c1nc(cccc2)c2[nH]1)(=O)=O,0 T990-3808,CC(C)CCN(CCC1N(CC2)CCN2S(Cc(ccc(F)c2)c2Cl)(=O)=O)C1=O,0 S823-0202,OC[C@@H](CN(C1)c2ncncc2)[C@H]1NC(c(cc1)ccc1F)=O,0 F6381-4014,O=C(c1cc(-c2ccco2)n[nH]1)N(CCCC1)CC1c(cc1)ccc1F,1 F6709-3616,COc(cccc1)c1C(N(C1)CC1Oc1ccncc1)=O,0 F5833-7246,CCOC(CCC(Nc1cc(N(CCC2)C(COC)=O)c2cc1)=O)=O,0 S896-0447,COCCc1nc(CCOCC2)c2c(N(CC2)CCC2NC(NC2CCCCC2)=O)n1,1 F5852-0137,Cc1nccn1CCNC(C(NCc1ccccc1)=O)=O,1 Y044-6978,OC(C1C(c(cccc2)c2N2)(C2=O)N(CCC2)C2C1)=O,1 Z4985466617,Cc1cccc(C(CC2)CN2c(cc2)ncc2C(O)=O)c1,0 Z1155110826,Cc(nccc1)c1C(Nc(cc1)ccc1-c1nc(C2CC2)n[nH]1)=O,0 Z2984769418,Cc(nncc1)c1C(N(CCOC1)C1c1ccc(COC)o1)=O,1 SA23-1212,Cc1noc(CC(N(C2)CC2N(C2)[C@H](CN(C)C)CC2(F)F)=O)c1,1 F5857-3749,OC(CNC(Nc1cccs1)=O)(C(F)(F)F)c1ccccc1,0 F6519-5832,O=C(c1cc(Br)cnc1)NCC(c1ccco1)n1nccc1,1 F6529-6353,Cc1noc(C)c1CCC(N(CC1)CCC1N(CC(N1CCOC)=O)C1=O)=O,1 F6574-1436,O=C(NCc(cc1)cc2c1OCO2)NC(CC1)CCC1n1nccc1,1 S382-1369,Cc1noc(C)c1CN(CC1)CC1(C(N1C)=O)N(CCOC)C1=O,0 F821-0045,COc1cc(NC(C(CCC2)CN2S(c(cc2)cc(N3)c2OCC3=O)(=O)=O)=O)cc(OC)c1,0 Z2193231147,O=C(c(nc1-c2ccccc2)nn1-c1cccc(C(F)(F)F)c1)N1C2COCC1CCC2,1 F6125-1100,O=C(C(C1)CN1C(c1c[nH]c2c1cccc2)=O)NCc1ccco1,1 F5852-0845,O=C(C(NCc(ccc(F)c1)c1F)=O)NCCC1=CCCCC1,0 Z3392384136,Cc1cc(CNc(nc2)cnc2Cl)cc(N2CCCC2)n1,0 J087-0081,O=C(C(S(c1c2cccc1)(=O)=O)=C2Nc(cc1)cc2c1OCCO2)Nc1ccccc1,0 F2571-0551,Cc(cc(cc1)S(N2C(CCNC(C(NCc(cccc3)c3F)=O)=O)CCCC2)(=O)=O)c1F,0 V007-0446,CC(C)CCNC(c1ccc(-c(cc2)ccc2F)s1)=O,0 C696-0437,CC(CN(CC1)c2nnc(Cc3ccncc3)c3ccccc23)N1c1ccc(C)cc1,0 F6525-1734,Cc1noc(C)c1CCC(NCCn(c(C1CC1)c1)nc1-c1nccnc1)=O,1 Z650987774,Cc(n1-c2cc(C)ccc2)nnc1SCCOc1cc(C#N)ccc1,0 F5096-0055,Cn1c(N2CCN(CC(NCC3OCCC3)=O)CC2)ncc1,1 Z3134306368,O=C([C@@]1(CCCC2)[C@H]2NCC1)N1Cc2cnnn2CCC1,1 F6247-0702,O=C(c1c(-c2ncccc2)n(-c(cccc2)c2F)nn1)N(CC1)CC=C1c1ccccc1,1 Y020-5707,CC(C)(C1)CC(NC(c2c3cccc2)=C(C2c(cccc4)c4Br)C3=O)=C2C1=O,0 Z1927916985,O=C(c1cc(Nc2ccccc2)ccc1)NCC(CC1)CCN1c1ncccn1,1 Z1929484553,OC(C1)Cc2c1ccc(NC(c1ncccc1O)=O)c2,1 Z2962714193,Cn(cnc1ccc2)c1c2C(N1CC(CS(N)(=O)=O)CC1)=O,1 S232-1816,O=S(c1cccc2nsnc12)(N1C[C@@H]2N(Cc3ccccc3)CCOC[C@@H]2CC1)=O,1 F6523-2881,CCn1c(-c2noc(CNC(c3cc(cccc4OC)c4o3)=O)n2)ccc1,1 F6495-5550,O=C(C(C1)CN1c1ncnc(-n2nccc2)c1)NC(CCC1)c2c1cccc2,1 SA65-1129,Fc1cc(CN2CCC(CCc3noc(C4CCOCC4)n3)CC2)cc(F)c1,0 SD67-0488,O=C(CCCc1ccccc1)N(CCC1)CC(C(N(Cc2ccccc2)C2)=O)N1C2=O,1 S692-1689,Cc1cnc(C)n1C(CCC1)CN1C(CCc1c(C)onc1C)=O,1 F6184-1113,O=S(Cc1ccc(C(F)(F)F)cc1)(NCCN(CC1)CCC1c1cccs1)=O,1 F2743-0649,O=C(C1=CC=CN(Cc(c(F)ccc2)c2Cl)C1=O)Nc(cc1)cc2c1OCO2,1 F6725-1421,Cc1cccc2c1nc(N(C1)CC1N(C(CN1)=O)C1=O)s2,1 F5490-1274,Cn1ncc(-c2cnc(NCC3OCCC3)nc2)c1,1 SB96-0070,Cc1nccn1CCN(C(CC1)CN1C(c1cc(OC)cc(OC)c1)=O)S(C)(=O)=O,0 Z2275518863,CC1(CC1)S(NCC1(CCOCC1)c1cccc(Br)c1)(=O)=O,1 S352-0344,O=C(c1ccc[nH]1)N(CC1)CCN1C(c1c(COC(C2)c(cc3)ccc3Cl)n2nn1)=O,1 S928-4581,O=C(c(cc1)cc2c1[nH]cn2)N1CC(Cc2nnc(-c3ccccc3)o2)CC1,1 F6511-9287,CC(C)(c1cn(-c2cccc(Cl)c2F)nn1)O,0 F2774-1695,O=C(C=C1)N(Cc2cc(C(F)(F)F)ccc2)N=C1c(cc1)ccc1F,0 Z1661961546,Cc1cccc(C2CN(Cc3c[nH]nc3-c3cccs3)CC2)c1,1 Z4302228120,Nc1nc(C(NCC2CC2)=O)c(-c2ccccc2)s1,1 Z3689333039,CCC(CNc1ccccc1)NC(C(Nc1cnc2c(F)cccc2c1)=O)=O,1 F6571-4251,COc(cccc1)c1C(NCC(c1cscc1)OCCO)=O,0 Z992493894,OC(Cc(cccc1)c1NC(c1ccccc1)=O)=O,0 F6416-8418,OC(CCNC(NCCOc1ccccc1)=O)c1cocc1,1 F2036-0462,COc(cc1)ccc1OCC(Nc(cc1)cc(N(CCC2)S2(=O)=O)c1Cl)=O,0 F6034-0081,O=S(c(cc1)cc2c1OCCO2)(N1CC(COCc2ccccc2)CCC1)=O,1 F6448-0270,Cc1noc(C)c1CC(Nc1cn(CC2OCCCC2)nc1)=O,1 F6512-0520,Cc1nc(-c(cc2)ccc2S(N2Cc3ccnn3CC2)(=O)=O)co1,1 Z99504203,Cc1c(C(OC)=O)sc(NC(C2CCCC2)=O)c1,1 Z1824719419,C[C@H](c1ccc(C(F)(F)F)cc1)NC(C(C(N1)=O)=CN(CCO)C1=O)=O,0 F6562-2352,CC(C(NCc1cc(N(CCC2)C2=O)ncc1)=O)Oc1ccccc1,1 Z2138598973,Cc1c(C(NC(CC(C2)C3)(CC2C2)CC23O)=O)nnn1CCOc(cc1)ccc1F,1 F6788-1641,Cc1c(C)nc(C)nc1N(CC1)CCN1c1nc2ccnn2cc1,1 SB32-0174,CCOc(ccc(CN(C[C@@H]1COC)C[C@@H]1c1nc(C)n[nH]1)c1)c1OC,0 Z2610095455,Cc([nH]nc1C)c1S(N(CC12CCC2)C1C(O)=O)(=O)=O,1 P218-3807,CCOc(cc1)ccc1-c1nn(CCCN(C2)C(CCN(C(C(C)(C)N3)=O)C3=O)=O)c2c1,0 Z2628877909,CNC(C(CCC1)CN1C(c1cc2ncnc(NC)c2cc1)=O)=O,1 L834-1055,CCCN1c(cc(cc2)-c3noc(C(C(C)C)NC(c4ccco4)=O)n3)c2OCC1=O,1 Z2906376187,O=C(CCCN(C(NN1)=O)C1=O)N(CCC1)C1c(cccc1)c1Br,0 F6755-0613,Cc1cc(N(CC2)CCN2c(cc2)ncc2C#N)c(C)cc1,0 F2774-2999,COc(cc1)cc(C(C=C2)=NN(CC(NCc3ccco3)=O)C2=O)c1OC,0 E632-2268,O=C(Nc1cccc(Br)c1)N1CC(CN(CC2)Cc3c2cccc3)CCC1,0 Z1895246028,Cc(cc1)cn2c1nc(CN(CC1)CCC1Oc(nccc1)c1F)c2,1 Z3290576464,Cc1cnc(NC(N(CCc2c3[nH]cn2)C3c2cnccc2)=O)s1,0 F6440-2969,O=S(c(cc1)cc2c1OCCO2)(NCc1nn(C2CCCC2)c2c1CCCC2)=O,1 F170-0118,CCOC(Cc(cc1)ccc1NC(N1CCC(CC2CCC(C)CC2)CC1)=O)=O,0 F5834-3801,CCCS(N(CC1)Cc2c1ccc(NC(C1(CCCC1)c1cccs1)=O)c2)(=O)=O,1 Z3269006945,CC(CC(F)(F)F)(C1)CN1C(N1)=NC(C)=CC1=O,1 Z353295958,CC(CO)NC(OCc1ccccc1)=O,0 F6111-0018,Cc1cccc(NC(CN2CCC(COCc3ccccc3)CC2)=O)c1C,0 F6420-0712,COC1(CNC(C2(CC2)c(cc2)ccc2F)=O)CSCC1,1 F6556-5164,O=C(Cc(c(F)ccc1)c1Cl)N(CCC1)CCN1C1CCSCC1,0 Z2796041075,Cc1nc(-c(cc2)ccc2NC(CCCc2nnn[nH]2)=O)cs1,1 Z1595586184,CCC(C)n1nccc1NC(N[C@H](CC1)CC[C@@H]1O)=O,1 F069-0441,CCC(C(Nc1cc(C(C)=O)ccc1)=O)N(c(cccc1)c1N=C1C(F)(F)F)C1=O,0 Z415741886,CC(C)(C)n(c(N)c1)nc1-c(cc1)ccc1F,0 F6411-4390,Cn1nc(C(Nc(ccc(F)c2)c2Br)=O)c2c1cccc2,0 F6514-6774,Cc1c(C(NC(Cn2nccn2)c2ccccc2)=O)c(C)nn1C,1 Z2447769791,C[C@@H](C1)NCC[C@@H]1C(Nc1cc(C)nn1-c1cccc(C(F)(F)F)c1)=O,1 Z1614125597,C(c1noc2c1CCCC2)N(CCC1)CC1c1n[nH]c(C2CCCCC2)n1,1 C444-0103,CC(c1ccccc1)NC(C(CCC1)CN1S(c1cccc2nsnc12)(=O)=O)=O,0 Y041-4166,n1c(scc1CC(NCC1(CC(=O)O)CCCCC1)=O)c1ccc(OC(F)(F)F)cc1,0 SB20-1382,Cc1noc(C)c1S(N1[C@H](Cn2nnc(C(NCCOC)=O)c2)CCC1)(=O)=O,0 Z1271863119,Cc1cccc2c1[nH]cc2CCNCc1cccc(O)c1,0 Z1652952044,CC[C@H](c(cc1)ccc1F)NCC(c(cccc1)c1F)O,0 S646-0102,CCn1ncc(S(N(CC2)CCC2N(CC23CCCCC3)C2c2ccccc2)(=O)=O)c1,1 S835-2186,CC1(CC(CC2)(CCN2C(c2nccc3ccccc23)=O)OCC1)O,0 Z4544892061,OCCN([C@H](CC1)C2)[C@@H]1CN2C(c1cc(-n2ncnc2)ncc1)=O,1 Z1744183990,CC(Cc1c2cccc1)N2S(c1cn(CC(F)F)nc1)(=O)=O,0 Z2352635053,OC([C@H](C1)C[C@H]1NC(c1c(-c2ccccc2)ncnc1)=O)=O,1 F6442-6899,O=C(CSc(cc1)ccc1F)N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F,1 V017-8976,COCCCN(CC(COc1ccccc1)O)CC(N1)=Nc(sc2c3CCCC2)c3C1=O,0 F6519-4228,O=C(c1nc(cccc2)c2s1)NCC(c1cccs1)n1nccc1,1 Z1159873570,CC(C)CN(C1CC1)C(Cc1csc(-c2nnc[nH]2)n1)=O,1 F5581-1313,COc1cccc2c1oc(C(N(CCn1nccc1)c1nc(c(F)ccc3)c3s1)=O)c2,1 F6573-7767,O=C(c1cc(cccc2)c2o1)N(CCN1c2nccs2)CC1=O,1 Y203-8415,CC(CC1)N(C(C2CCCCC2)=O)c(cc2)c1cc2F,0 Z2997275172,CC(C)(C)CN(C)Cc1nc(-c2ncnc(O)c2)no1,0 F1501-0103,O=C(CSc1nc(cccc2)c2[nH]1)c(cc1)ccc1Cl,0 F5597-0152,CC(C)c1nnc(C(CC2)CCN2S(c(s2)ccc2Br)(=O)=O)o1,0 F1130-0080,OC(CNC(CC1(CC(C2)C3)CC3CC2C1)=O)=O,0 G856-6404,CN1C(SCC(N(CC2)c3c2cccc3)=O)=NC=C(C(Nc(cc2)ccc2Cl)=O)C1=O,1 Z1492379139,Cc(c1c2)nn(C)c1ncc2NC(C1Cc2cncn2CC1)=O,0 F6514-2656,O=C(CC1)N(CCc2c3)c2c1cc3S(NC(C1CCOCC1)c1cnccc1)(=O)=O,1 F2163-0211,O=C1NN=C(c(cc2)ccc2Br)OC1,1 E216-5498,CCC(C1)Oc(cccc2)c2N1C(N(CC1)CCC1C(NCCCN(CCC1)C1=O)=O)=O,1 F6561-5568,O=C(Nc1nc(CCCC2)c2s1)N(CC1)CCC1S(Cc1ccccc1)(=O)=O,1 Y043-5590,S1(N(c2ccc(NC([C@@H](n3cccc3)CC(C)C)=O)cc2)CCCC1)(=O)=O,0 F2416-1024,COC(N(CC1)Cc2c1ccc(NC(c1nc(cccc3)c3s1)=O)c2)=O,1 SA87-1059,O=C1N(CCc2ccccc2)CC(CNS(Cc(cccc2)c2Cl)(=O)=O)OC1,0 F6555-0883,O=C(N(CC1)CC1n1nnc(C2CC2)c1)OC(CC1)CN1c1nccs1,1 Z2918846830,Cn1nc(CNS(CCc2cc(F)ccc2)(=O)=O)c(C(F)F)c1,0 F5972-0091,CC(CNS(c1ccc(C(F)(F)F)cc1)(=O)=O)(COC)O,0 F5053-0089,CC(C(NCC1)=O)N1C(c1cc2ccccc2cc1OC)=O,1 F555-0183,O=C1Oc(cccc2)c2C(NCc2ccccc2)=C1NS(c1cccc2nsnc12)(=O)=O,1 Z1071084560,CC(CNCc1cc2ccccc2nc1)C1CC1,1 Z1845552776,CCNc(ccc(Cl)c1)c1C(NCc1cn(CC)nc1)=O,0 F6764-1754,CCS(N(CC1)CCC1c(ccc1c2)nc1ncc2-c1ccncc1)(=O)=O,1 G501-0108,CN(C)c1ccc(C(CNS(CCc2ccccc2)(=O)=O)N2CCCC2)cc1,1 F6660-4690,CC(C)(C)OC(NC(CCC1)CN1C1=NC=CN(C)C1=O)=O,0 Z1151983207,CN(CC1COCCC1)C(C(Cc1ccccc1)NC(c1cnccc1)=O)=O,1 Z2656433443,CC(c1ncc(C(O)=O)s1)NC(CC1COCC1)=O,1 F6518-2306,CCCCS(NCCc1ccc(C(C)=O)s1)(=O)=O,0 Z1118533035,Cc1c(CNc2ncnc(C)c2)scn1,0 Z1731326754,CN(CCN(C1)c2ncnc(N3CC4(COCC4)OCC3)c2)C1=O,1 Z1369143053,CCN(CC)C(CNC(c(cc1C)cc(C)c1OCC(OC)=O)=O)=O,0 Z915038974,COc1ccc(CN2CCC(CNC(Nc3cc(C(N)=O)ccc3)=O)CC2)cc1,0 F6438-3652,CN(C)c1nc(CNC(c(cccc2)c2S(C(F)F)(=O)=O)=O)nc(N2CCCC2)n1,0 F6677-0400,Cc1nccn1CC(C1)CN1c(cc1)nn2c1nnc2C(F)(F)F,1 F1081-0025,O=C(CN(C(c1c2c3cccc2ccc1)=O)C3=O)N(CC1)CCN1c1ncccc1,1 8015-9089,CC(C)(C#Cc1ccc(C(N(CCC2)C2C(O)=O)=O)s1)O,0 F5295-0149,CC(C)c(cc1)ccc1N(C(CS(C1)(=O)=O)C1N(Cc1ccccc1)C1)C1=O,1 SA73-1019,Cn1c(C(N(CC2)CCC2(CC2CC2)c2noc(C3CCOCC3)n2)=O)ncc1,1 Z2378121645,O=C(C(N1CC2(CC2)CCC1)=O)N(CCC1)CC1N1CCNCC1,1 Z2996710751,OC(c1csc(CN2[C@H](COc(cc3)ccc3F)CCC2)n1)=O,0 F6482-3875,O=C(c(o1)ccc1Br)N(CC1)CCC1n1nccn1,1 F6773-4161,CCc1ncnc(N(CC2)CCC2Oc2nc3ccnn3cc2)c1F,0 V030-0222,CC(C)(C)c1ccc(CNCCN2CCCCC2)cc1,1 Z1105575799,O=C(c(cc1)cc(F)c1F)N(CC1)CCC1C1NCCC1,1 M435-1277,OC(Cc(cc1)ccc1NC(C(C(Nc1c2c(CCCC3)c3s1)=O)=C2O)=O)=O,0 Z1390819743,COc(cc1)ccc1-n1nnc(CNC(c2cc(cccc3)c3s2)=O)c1,0 SA87-0918,COCCN(CC(CNC(Cc(cc1)ccc1F)=O)OC1)C1=O,0 F6529-1048,CN(C(C(F)(F)F)=NN1C(CC2)CCN2C(C2(CC2)c(cc2)ccc2F)=O)C1=O,1 F2495-0071,O=C(CC(CSC1=NC=C2)N1C2=O)NCc1ncccc1,1 Z1269636701,COc(ccc(C(O)=O)c1)c1NS(c1cc(COC2)c2cc1)(=O)=O,0 F2043-0436,CCS(N(CCC1)c(cc2)c1cc2NS(C1CCCCC1)(=O)=O)(=O)=O,1 Z1232395217,O=C(CCc1ccncc1)NC1CCN(CC2COCC2)CC1,1 Z4518120323,OC(CNC(C1(CCCC1)N(C(c1c2cccc1)=O)C2=O)=O)=O,1 Z3991663760,CC(CNCC1)C1C(c1ccccc1)=O,0 Z1411451186,CC(C)COc(cc1)ncc1NC(N(CCN1)C(C)C1=O)=O,0 Z1439771940,Cc1cc(N(CC2)CCN2C(c(cc(cc2)N(CCC3)C3=O)c2F)=O)ncc1,1 F5854-5452,CCCN(Cc1cscc1)S(c(cccc1)c1F)(=O)=O,0 SB18-0958,Cn1ncc(CN(C[C@H](C2)NS(C)(=O)=O)[C@@H]2c2nc(-c3ccccc3)n[nH]2)c1,0 F1872-0490,NC(CSc1nccn1-c1cc(C(F)(F)F)ccc1)=O,0 Z2983806372,Cc1cccc(OC)c1N(C(C(Cc1cncs1)N1)=O)C1=O,0 SC25-1035,O=C(C1c2nnc(-c3nccnc3)n2CCC1)NCc1nccnc1,1 F6675-7745,CN(C(C1)CN1c1nccnc1)C(C1(CCOCC1)c1ccccc1)=O,1 D627-0314,Cc1cc(NC(c2nn(C(CC3)CS3(=O)=O)c(-c3cc(C)c(C)cc3)c2)=O)cc(C)c1,0 F6561-1229,O=C(CSCc1ccccc1)NCc1cncc(-c2ccco2)c1,1 T408-1070,CCCn1nc(C)c(CNC(C(CC2)Cc3c2sc(C(N(C)C)=O)c3)=O)c1,1 SB20-1453,COc(cc1)ncc1C(N1[C@H](Cn2nnc(C(NC3CCCC3)=O)c2)CCC1)=O,1 Z1643856407,CC(CN1CCOCC1)NC(c1ncc2OCCCc2c1)=O,1 F2024-1765,OCCN(Cc1ccccc1)C(NC(CC1=O)CN1c(cc1)ccc1F)=O,1 SC58-0187,CCNC(N(C1)CC1(CN(C)C1)C1c1ncc(C)o1)=O,0 F6238-0159,O=C(c(cc1)nnc1-n1cncc1)Nc(cccc1)c1-c1ccccc1,1 Z1121987870,Cc1c(CC(N2CC(c(cccc3)c3Cl)OCC2)=O)c(C)n[nH]1,0 C701-0437,CC(c1nc(cccc2)c2n1C1CC(Nc(cc(C(F)(F)F)cc2)c2Cl)=O)N(Cc2ccccc2)C1=O,1 F6454-0919,CCc(cc1)ccc1NC(C(NCC1CCN(CC(F)(F)F)CC1)=O)=O,0 Z1216705436,Cc(cc(cc1)NS(c(cc2)ccc2Oc(cccc2)c2Cl)(=O)=O)c1S(N)(=O)=O,0 F6682-6546,N#Cc1cc(OCC(CCC2)CN2C(N=C2N3C=CC=C2)=CC3=O)ncc1,1 F6556-8805,O=C(C1(CCCC1)c1cccs1)NC(c1cscc1)c1cccs1,1 8018-9223,CN(C)c1cc(OC(N)=C(C2c(c(F)ccc3)c3F)C#N)c2cc1,0 Y043-1186,N1(\N=C(/C=C\C1=O)\c1ccccc1)CC(N[C@H](C(=O)O)Cc1ccccc1)=O,0 Z4662142778,CCN(CC)S(c(cc1)cc(NC(C2(CCCC2)C(O)=O)=O)c1O)(=O)=O,0 Z2166776348,CCC(CN(C)CCC1)N1S(c1cncc(F)c1)(=O)=O,1 F6573-3422,O=C(C(CC1)Oc2c1cccc2)NCCOCCn1cncc1,1 F6744-6568,CN(C(CC1)CCN1c1c(cc(c(OC)c2)OC)c2ncn1)c1ncccc1,1 F6469-0340,CC(C(Nc(cccc1)c1-c1cn(ccs2)c2n1)=O)N(C(C=C1)=O)N=C1n1nccc1,1 Z2295337420,CS(C(CC1)CN1C(Nc1ncc(C2CCC2)cc1)=O)(=O)=O,1 Z1684581156,CC(C(N1)=O)(c2cccc(-c3noc(C(CC4=O)CN4c(cc4)ccc4F)n3)c2)NC1=O,1 F6573-2907,O=C(C(CC1)Oc2c1cccc2)NCCOCCn1nccc1,1 Z1538053873,O=C(CN1c(cccc2)c2OCCC1)NCc(cc1)ccc1C(N1CCCC1)=O,1 J032-0162,COc(ccc(-c1ccc(CNCC2OCCC2)o1)c1)c1Cl,0 F2529-0108,CC(C=CC1=NC=C2C(Nc(cccc3)c3SC)=O)=CN1C2=O,0 SB04-0498,CN(C)C(N(CC1)CC1N(CCNC(CCn1nccc1)=O)C1CCOCC1)=O,0 Z1680809173,N#Cc1cccc(N2CCN(CC3OCCO3)CC2)n1,1 F6521-7288,Cn(cc1)c2c1cc(C(CNC(c(s1)ccc1Cl)=O)O)cc2,1 P392-0052,CN(C)C(c1cccnc1OC(CC1)CN1C(Cc(cc1)ccc1Cl)=O)=O,0 SC08-0054,CS(N(CC1)CCC1c1noc(C(C2)CN2C2CCOCC2)n1)(=O)=O,1 Z1612436468,O=C(CN(C(C(C1)N2C3C1CCCC3)=O)C2=O)N(CC1)c2c1cccc2,1 Z2256352160,CC(C)C(C)(CC(O)=O)NC(c1nc(-n2nccc2)ccc1)=O,0 Z1174624841,CCn1nc(C)c(C(N(CC2)CCC2c2nncn2C(C)C)=O)c1C,0 7591-0663,CC(C)(CC(N(Cc1ccccc1)C1=O)=C2C1(C(F)(F)F)NC(CCc1ccccc1)=O)CC2=O,1 G125-0834,CC(C)CCNC(C(CC1)CCN1C(c1ccc(-n(cc2)c3c2cccc3)s1)=O)=O,1 L285-1617,Cc(ccc(-c(cc1)nnc1Nc1cc(OC)cc(OC)c1)c1)c1S(N1CCOCC1)(=O)=O,0 Z339758828,O=C(N1CCCCC1)N(CC1)CC=C1c1c[nH]c2c1cccn2,1 F6808-8384,NC(C(CCC1)N1c1cnc(C(F)(F)F)cc1)=O,0 Z1730025128,O=C(CCc1c2)Nc1cc(F)c2S(Nc1c2[nH]ccc2ccc1)(=O)=O,1 F6808-5918,Cc1nn2c(N(CC3)CCC3(c3ccccc3)C#N)cc(C)nc2c1,1 SC10-0389,O=C(C1CCC1)N(CCCN1CCOCC1)C(CC1)CN1C(c1cnccc1)=O,1 F589-0474,Cc1c(C(CC2)CCN2S(c2c(C)cccc2)(=O)=O)c(cccc2)c2n1Cc1cc(OC)ccc1,0 Z4744115525,Cn1c2nccc(C(N(Cc3cccc(F)c3C3)C3C(O)=O)=O)c2nc1,1 SA01-0248,CN(C)c1ncc(C(NCCN2CCOCC2)=O)c(C(CC2)CN2S(C)(=O)=O)n1,1 F6436-2775,O=C(Cc(cc1)ccc1NC(c1cc(Br)cs1)=O)NCC(F)(F)F,0 S647-0353,CC(C)N(CC12CCN(Cc3ccncc3)CC2)C1c1ccccc1,1 D064-0303,C1Oc(cccc2)c2OC1c1nnc2sc(/C=C/c3ccccc3)nn12,1 Z2961801387,Cc1c(C(NCCc2cccc(Br)c2C)=O)ocn1,0 Z2440014635,O=C(c1ccc(-c(cc2)cc3c2OCCO3)s1)NC1CC(CC2)NC2C1,1 F3395-1279,O=C(C1CC1)NC(CCN(C(CC1)C2)C1CC2(CN1C2CC2)OCC1=O)c1ccccc1,1 F0060-0017,CCOC(c1csc(NC(c(cccc2)c2Br)=O)n1)=O,0 Z1650048107,Cc(cc(cc1)F)c1C(NCC1(CCC1)C(O)=O)=O,0 F2135-1525,Fc1ccc(CSc2nc3ccccc3cc2)cc1,0 Z1838651119,COC1(CC(N(CC2)CCC2C(Nc2nncs2)=O)=O)CCC1,1 Z2293372966,Cc(nc(cc1)NC(N(C2)CC22CCOCC2)=O)c1Br,1 SC72-0197,Cc1nc(COC2(C3)CN3C(CCCc3c[nH]c4c3cccc4)=O)c2cn1,1 Z763839338,CC(C)Cc1nnc(NC(C(CCCC2)N2C(c2ccco2)=O)=O)s1,0 F6680-8649,Cc1nccc(OCC(CCC2)CN2S(c(cccc2)c2F)(=O)=O)c1,0 SC87-1065,O=C(CCC1CCCC1)NCC(CC1)CCC(N=C(c2ccccc2)N2)=C1C2=O,1 F831-0770,O=C(CSc1nnc(c2c3)n1ccn2nc3-c(cc1)ccc1Cl)N1CCCC1,0 SC16-0065,CS(N(CC1)CCC1c1noc(CC(C2)CN2C(c2cnncc2)=O)n1)(=O)=O,1 D389-0754,CN(c1c(C(N2Cc(cc3)ccc3Cl)=O)n(CCCN3Cc4ccccc4)c3n1)C2=O,0 SC11-1313,CC(C)C(N(CCCN1CCCC1)C(CCC1)CN1C(c1c(C)n(C)nc1)=O)=O,0 Z826479376,O=C(CN(CC1)CCN1C(NCc(cc1)cc(F)c1-n1cncc1)=O)N(CC1)c2c1cccc2,1 F6438-1328,CCCCOc(cc1)ccc1C(NCc1nc(N(C)C)ccn1)=O,0 Z2443563261,CCC(C)S(NC(c(cc1)cc2c1OC(C)(C)C2)=O)(=O)=O,0 F6288-0587,Cn1c(CCNC(c2cc(-c(cc(cc3)OC)c3OC)nn2C)=O)nc(-c2ccco2)c1,1 Z3019773397,CCN(Cc(cc1)ccc1Cl)C(C1NCc2c1cncn2)=O,0 Z1267026769,O=C(C(CCCC1)N1C(c1ccco1)=O)N1CC(CN2CCOCC2)CC1,1 M086-0759,COc(ccc(-c1noc(C(F)(F)F)c1)c1)c1S(N1CCC(Cc2ccccc2)CC1)(=O)=O,1 T636-2244,CCn1ncc(CN(CCC2)CC2Nc2ncnc3c2CCC3)c1C,0 Z2312768590,CCC(C1)(CN1C(Nc1cn(Cc2ccccc2)nn1)=O)O,0 Z2910694503,O[C@H](C1)C[C@H]1C(NCCOc(cc1)ccc1C(O)=O)=O,1 Z2884533432,CC(C(C1)N(c2ccccc2)N=C1C(N(CC1)CC1(CO)C(F)(F)F)=O)=O,1 S812-3948,CC(C)C(c1nccn1CCC1)N1C(Cc1c(C)onc1C)=O,1 F3411-5740,O=C(CSc(n1-c2c3cccc2)nnc1N(CCc1ccccc1)C3=O)NCc1ccco1,1 Z2878921276,CN(CCC1)CC1N(CC1)CCN1C(C(N=C1)=CN(C)C1=O)=O,1 F6512-1070,O=C(CSC1CCCC1)NC1Cc2ccnn2CC1,1 D294-5014,CCc1c(-c2ccccc2)nc(NC(C(C2)CN(CCc3c[nH]c(cc4)c3cc4Cl)C2=O)=O)s1,1 Z1918991472,Cc1c(C(C2CC2)NC(N(CC2)CCS2(=O)=O)=O)cccc1,1 F6660-6379,O=C1N(CCc2ccccc2)C=CN(Cc2cccc(C(F)(F)F)c2)C1=O,1 SB75-1086,CC(C)C(N(C[C@@H]1C[C@H](C2)NC(COc3ccccc3)=O)C[C@@]12c1nc(C)no1)=O,0 Z1440120736,CCC(C)CN(CC)C(c(cc1)cc(N2)c1N(CC(F)(F)F)C2=O)=O,0 SC70-0659,Cc1nc(C(C2)C3(CCC3)CN2C(c2c[nH]nc2-c(cc2)ccc2F)=O)n[nH]1,1 Z2089761968,Cc1c(C(N(C)[C@H](CCC2)[C@@H]2O)=O)c(-c(c(F)ccc2)c2Cl)no1,1 F6708-9864,Cc(cn1)cnc1OC(CC1)CCN1C(CN(C=NC(C1CC1)=C1)C1=O)=O,1 Z1726131355,CCc(cncc1)c1NC(C1(CCCCC1)OC)=O,1 S562-0137,COc1ccc(C2(CC2)C(NCC(CCCC2)NC2=O)=O)cc1,1 K906-3623,Cn1c(C(Nc(cc2)ccc2S(N2CCOCC2)(=O)=O)=O)cc(S(N2CCCC2)(=O)=O)c1,1 F6676-9837,FC(c1ncnc(N2CC(Cn3cncc3)C2)c1)(F)F,0 F6258-1299,O=C(c(cccc1)c1Nc1ccccc1)NCCN(C=NC(C1CC1)=C1)C1=O,1 F6573-4671,CN(C=CC=C1C(NCc2cncc(C3CC3)c2)=O)C1=O,1 Z3559282232,C(C(C1)CN1c1c2SCCCc2ncn1)c1cscc1,1 6150-0130,Cc1nc(NS(c(cc2)ccc2NC(C2(CCOCC2)c2ccccc2)=O)(=O)=O)nc(C)c1,1 F5013-1977,CS(N(CC1)CCN1C(CCCN(C(C=C1)=O)N=C1c(cc1)ccc1F)=O)(=O)=O,1 F6524-4327,O=C(CCc1nc(cccc2)c2[nH]1)N(CC1c2nocn2)CC1c1ccccc1,1 C722-0554,CCn1c(C(OCC)=O)c(C)c(C(NC2CC(C)(C)CC(C)C2)=O)c1C,0 Z2275180285,Cc(cc1)cc2c1[nH]c(C1N(Cc3cccc(C#N)c3F)CCC1)n2,0 F6475-1364,O=C(c1cc(OC2COCC2)ncc1)NCc(cccc1)c1OC(F)(F)F,0 Z1241095192,Cc1cccc(C)c1CNc(cc(cc1)C(N)=O)c1Cl,0 SB57-0198,Cc1noc(C(C2)C(C3)(CN3C(Cc3cccc(Cl)c3)=O)CN2C(COC)=O)n1,0 F5606-0107,CN1CCN(Cc(cc2)ccc2NC(Nc(cc2)ccc2F)=O)CC1,0 F2758-0052,CCOc1cc(C(NCC(c2c3cccc2)=NNC3=O)=O)cc(OCC)c1OCC,0 F5284-0057,O=C1N(CCNS(c(cccc2)c2Cl)(=O)=O)N=CC=C1,0 Z2872407046,CCc1c(C)cc(C(NC2(CCN(CC)CC2)C(F)(F)F)=O)o1,0 F6515-2383,Cc(nc1)cnc1C(N1C(Cn2nccn2)CCC1)=O,1 F6510-4281,CN(c(cccc1)c1N1Cc2ncccc2)S1(=O)=O,1 V029-8987,CCc(c(CN(CCC(C)C)Cc1cocc1)c1N2CCN(C)CC2)nn1-c(cc1)ccc1F,1 G125-0751,Cc1cc(cccc2)c2n1-c1ccc(C(N(CC2)CCC2C(N2CCN(C)CC2)=O)=O)s1,1 Y031-3712,O=C(C(CC1=O)CN1c1ccccc1)NC1CCCCCC1,1 Z1708056760,CC(C)(C)CC(CC(O)=O)NS(c1ccnn1C)(=O)=O,0 V006-1301,O=C(C(C1)C(CN(CC2)C(c3ccco3)=O)N2c2c1cc(C(F)(F)F)cc2)NCCN1CCCCC1,1 Z4871131648,NCCC(CCC1)CN1C(c(cc1)ncc1C(N)=O)=O,0 F6471-5458,O=S(Cc1ccccc1)(N(CC1)CC1n1nncc1)=O,1 Y010-1614,Cn1c2c(cccc3)c3c(C(c(cccc3)c3Cl)=O)n2cc1-c1ccccc1,1 Z2440096592,Cc1nn(C)c2c1cc(C(N(CC1)CC1N)=O)s2,1 S932-2947,O=S(c(cccc1)c1F)(N(CC1)CC1n1nnc(COCC2CC2)c1)=O,0 Z3251529939,O=C(CC1)Nc(cc2)c1cc2S(Nc(cn1)cnc1Oc1ccccc1)(=O)=O,1 Z4914935773,OC(CNC(c(s1)ccc1Cl)=O)c1cccc2ccccc12,1 Z2836701946,O=C(C=C(C1CN(Cc(c2ncccc2cc2)c2Cl)CC1)N1)NC1=O,1 F6424-0718,CN(C(C=C1)=O)N=C1c(cccc1)c1NC(c1nn(-c2ccccc2)nc1)=O,1 Z2948191580,CC(C)Cc1c(CN(CC2)CCC2S(N)(=O)=O)cccc1,0 F6608-1591,CN(C(CC1)C2)C1CC2Oc1c(C(F)(F)F)cccn1,0 Z1680228851,O=C(c1cc(Br)cs1)NCCCC1OCCCC1,1 F6438-3741,CN(C)c1nc(CNC(C(CC2)Oc3c2cccc3)=O)nc(N2CCCCC2)n1,1 SA65-1105,C(Cc1noc(C2CCOCC2)n1)C1CCN(Cc(cc2)cc3c2OCCO3)CC1,1 S544-0329,O=C(COc1ccccc1)N1CC(CCOc(cccc2)c2F)CC1,0 E225-0672,CC(Cn(c1c2)nc2-c2ccccc2)(C(NCc(cccc2)c2OC)=O)N(Cc2ccco2)C1=O,1 Z2179609023,OCCNC(CC1)CCN1c1ncnc2c1[nH]cn2,1 F6448-2275,O=C(c1nc(cccc2)c2s1)Nc1cn(CC2Oc(cccc3)c3OC2)nc1,1 SC66-0069,Cn1c(C(CN(C2)C3CCOCC3)C22CCOCC2)nnc1,1 F6471-6107,Cc(cc1)c(C)cc1N(CC(C1)C(NCc2cc(-c3cscc3)cnc2)=O)C1=O,1 Z1889212735,Cn1ncc(C(NC(CCC2)c3c2cn[nH]3)=O)c1Cc1ccccc1,1 E591-0464,CN(CC1)CCN1c(cc1)nn2c1nnc2CCC(NCCC1=CCCCC1)=O,1 F5831-3184,O=C(C(Oc1c2cccc1)=CC2=O)N(CC1)CC1c1ccccc1,1 Z2410036437,C[C@](C1)([C@H]1c1ccccc1)C(N(CC1)CCC1C(O1)=NNC1=O)=O,1 F6475-4132,O=C(c(cn1)cc(Cl)c1OC1CCOCC1)NCc1ccco1,1 F6573-7371,O=C(c1cc(-c2ccccc2)n[nH]1)N(CCN1c2cnccc2)CC1=O,1 L090-3316,Cc(cc1)ccc1-n1nc(C(Nc(cc2)cc3c2OCCO3)=O)c(N=CN2C)c1C2=O,1 F6171-0381,CN(c1ccccc1)S(CCOc(cc1)ccc1OC)(=O)=O,0 Z1987694330,CC(C(N1CC(N(CCC2)CC22CCN(C)CC2)=O)=O)(c2ccccc2)NC1=O,1 F6793-7622,N#Cc1ccnc(N2CCN(CC(F)(F)F)CC2)n1,0 Z3063574867,CCN(CC)C(C(C)N(CC1)CCC1c1cnco1)=O,1 F2774-2889,COc1cc(C(C=C2)=NN(CC(Nc(ccc(F)c3)c3F)=O)C2=O)cc(OC)c1OC,0 F3375-0411,CCOC(c1cc(NC(c2c(C)n(-c3ccccc3)nn2)=O)ccc1)=O,0 Z2301736543,O=C(c1cncn1-c1ccccc1)N1CC(CNC2)C2CC1,1 F5755-0049,COc(ccc(Cl)c1)c1NC(N1CCC(Cn2c(cccc3)c3nc2)CC1)=O,0 Z1767642681,CN(C(C(CC1)C(N(CCC2)CCN2C(C2CC2)=O)=O)c2ccccc2)C1=O,1 F5871-1984,Cc1noc(CNC(c(cccc2)c2Br)=O)n1,0 Z2272519957,Cc(ccn1nc2)cc1c2C(N(CCC1)CC1S(N1CCOCC1)(=O)=O)=O,1 Z3057405539,CCn1ncc([C@H]2OCC[C@@H]2C(N2C[C@@H]3[C@@H](CC4)O[C@@H]4[C@@H]3C2)=O)c1,1 F6473-2206,O=C(c1cc(-c2ccccc2)n[nH]1)N(C1)CC1n1nncc1,1 F6415-0094,COCCN(Cc1cocc1)C(COc(cccc1)c1F)=O,0 SA93-0509,COCCC(CCC1)(CN1C(CCN(c(cccc1)c1O1)C1=O)=O)C(N)=O,0 Z1651007771,CN(c1cc(CCC(O)=O)ccc1)S(c1cc(OC)ccc1)(=O)=O,0 8015-8218,OC(CC(c(cc1)ccc1OC1CCCC1)NC(Nc1ccccc1)=O)=O,1 F6395-4071,O=C(COc(cc1)ccc1Cl)N1CC2(CCOCC2)OCC1,1 Z1391559809,CC1(CNC(c2c[nH]c(-c3ccccc3)n2)=O)OCCC1,1 F6495-5497,Cc1cc(C)nn1CCNC(C(C1)CN1c1ncnc(-n2nccc2)c1)=O,1 M710-0206,O=C(c(cc1)cnc1-c1cscc1)NCCCN1CCCCC1,1 F6441-7004,Cn1c(S(C(CC2)CCN2C(C2CC=CCC2)=O)(=O)=O)nnc1,1 SC55-1563,CC(C)c1n[nH]c(C2C3(CN(Cc(cc4)cc5c4OCC5)C3)CN(Cc3ccccc3)C2)n1,1 Z1742395424,O=C(NCCc(cc1)cc2c1OCCO2)N1CCC(Cn2ncnc2)CC1,1 Z1069624314,Cc1n[nH]c(C(N2CC(c(cc3)cc(Cl)c3F)OCC2)=O)c1,0 L284-3551,Cc(n(C)c(-c1nc(C)c(C)s1)c1)c1S(NC1CCCCCC1)(=O)=O,1 Z1783436773,CS(NCC(CCC1)CN1C(c1c(-c2ccccc2)scn1)=O)(=O)=O,0 E019-0306,CC(C(N(CC1)CCC1C(N)=O)=O)N1N=C(C)c(sc2c3cccc2)c3C1=O,1 F6476-7239,Cc(cc1)cnc1OC(CC1)CN1C(CC1CC1)=O,1 F6561-3586,C=C(CC1)CCC1NC(CCc1ccc(C(F)(F)F)cc1)=O,0 F6037-0552,Cc1cc(C(N(C2)CC2c2nc(cc(C)cc3)c3[nH]2)=O)c(C)o1,1 SA85-0293,CC(C)CN(CC(CN(C1)C(c2c[nH]nc2-c2ccccc2)=O)O)C1=O,1 Z1262410869,NC(c(cc1)nnc1N1CCN(CCc2ccccc2)CC1)=O,0 F6524-2658,O=C(c1ncccc1)N(CC1)CC1c1noc(C(F)(F)F)n1,1 F3166-0379,Cc(cc1)cc(C)c1N(CC1)CCN1C(c1cccc(N(CCC2)S2(=O)=O)c1)=O,1 Z3103401914,CS(c1ccc(CNC(N(CCC2)[C@@H]2C(F)F)=O)s1)(=O)=O,1 F6751-4277,COc1cc(CN(CCN2Cc3ccccc3)CC2=O)cc(OC)c1,0 F6442-0430,O=S(C(C1)CN1S(c(s1)ccc1Cl)(=O)=O)(c(cc1)ccc1F)=O,1 F5114-0021,O=C(c1ccccc1)Nc1nc2ncccc2cc1-c1ccccc1,0 3716-0197,CC(NC(CCC1)=C(C2c(cc3)ccc3Cl)C1=O)=C2C(Nc1ncccc1)=O,1 F6521-8488,COc1cc(CCCC2(CNC(c3cnc(C(F)(F)F)cc3)=O)O)c2cc1,1 7202-2502,O=S(c1cccc2cccnc12)(Nc(cc1)cc2c1oc1c2CCCC1)=O,1 F5947-0183,Cc1cc(-c2nnc(NC(C3c(cccc4)c4Oc4c3cccc4)=O)o2)c(C)o1,1 J005-0086,Cc1cc(C(CCC2)N2S(c(cc2)cc3c2OCCO3)(=O)=O)no1,1 Z1655708747,CC(C(N1CC(C)(c2ccccc2)OCC1)=O)c1c(C)[nH]nc1C,0 S926-1872,Cc1cc(NC(N(CCC2)CC2OCc2noc(COC)n2)=O)cc(C)c1,0 V002-5160,CCN(CCC(NCCC(C)C)=O)C(c1c(C)oc(C)c1)=O,0 S606-0845,COc(cc1)ccc1S(N(CC1)C[C@@H]1N(c1ncccc1N1)C1=O)(=O)=O,0 Z4881277980,Cc(ccc1cnccc11)c1NC(C1c(cccc2)c2OCC1)=O,1 S836-0363,COC[C@@H](CN(C1)c2ncccn2)[C@H]1C(NCc1ncccc1)=O,1 Z2370223105,CC(C)C(c1noc(C2(COCC2)O)n1)Oc(cc1)ccc1Br,1 V019-1726,COCC(Nc(cc1)ccc1N(CCCN1Cc2ccc(C(F)(F)F)cc2)C1=O)=O,0 F6442-2317,O=C(c(cc1)ccc1-c1cccs1)N(C1)CC1S(Cc1ccco1)(=O)=O,1 F5557-0071,COc(ccc(Cl)c1)c1NC(CSc1ncccc1-c1nc(cccc2)c2[nH]1)=O,0 L678-0295,CC(Cc1c2cccc1)(C(NCc(cccc1)c1OC)=O)N(Cc(cc1)ccc1OC)C2=O,0 F6573-8779,Cc1csc(C(NCc2cncc(-c3cocc3)c2)=O)c1,1 SC09-0027,C[C@@H](COc(cc1)c(C2)cc1-c(cc1)ccc1F)N2C(CCN1CCOCC1)=O,1 S558-0878,COc(cccc1)c1NC(N(CC1)CC1Oc(cccc1)c1-c1nc(C2CC2)no1)=O,1 Z2915516984,NS(NC(C1)CN1C(C1(CCC1)C1CCC1)=O)(=O)=O,1 F6502-1251,O=C(COCc1ccccc1)NCCn1c(-c2nccnc2)ncc1,1 D627-0015,O=C(c1nn(C(CC2)CS2(=O)=O)c(-c2cccs2)c1)N1CCOCC1,1 Z1746442515,CCn1ncc(-c2n[nH]cc2C(N(CC2)CCC2c2nccs2)=O)c1,0 Y207-5559,CC(C)Oc(ccc(C(C1)CC(NC(CC2c(cccc3)c3Cl)=O)=C2C1=O)c1)c1OC,0 K221-3239,O=C(C1CCC(CN(C(c(cccc2)c2N2)=O)C2=O)CC1)N(CC1)CCN1c1cccc(C(F)(F)F)c1,1 Z2827466085,CSCC[C@@H](C(N[C@@H]1[C@@H](c(cc2)cc(F)c2Cl)OCC1)=O)N,0 S947-0346,N#Cc(cc1)c(C(F)(F)F)cc1N(C1)C[C@]2(COCC3CC3)[C@H]1CCN(Cc1ccncc1)C2,0 Z291840352,O=C(COC(CCCc1c[nH]c2c1cccc2)=O)NCC1CC1,0 Z1445481876,CC(C)(CNC(c1noc(-c2ccccc2)c1)=O)C(O)=O,0 SD14-0028,CN(CC(N[C@@H]1[C@H]2CN(Cc3c[nH]nc3-c(cc3)ccc3OC)CC1)=O)C2=O,0 F6490-0295,CC(NC(CCSC)C(N(CCC1)CC1Oc1nnccc1)=O)=O,0 Z1603456333,Cn1nc(C2CCCCC2)c(C(Nc(cc2)cc(C(O)=O)c2Cl)=O)c1,0 Z2286393078,CC1(CC1)c1noc(Cc2cn(C)nc2C)n1,0 E942-0376,CC(C)CN(C=C(c1c2cccc1)NC(NCC1CCN(Cc(cc3)ccc3F)CC1)=O)C2=O,1 Z1334658497,O=C(c1ccc(-c2nc(cccc3)c3s2)s1)N(CCN1C2CC2)CC1=O,1 D468-0984,O=C(CSC(C(CCC1)=C1N1c2ccccc2)=NC1=O)c(cc1)cc2c1OCCO2,1 Z1498435197,CN(c(cc(cc1)C(NCC2C(c3ccc(C(F)(F)F)cc3)N(C)CCC2)=O)c1N1)C1=O,1 F6442-2733,COc(cc1)cc(C(N(C2)CC2S(c(cc2)ccc2Cl)(=O)=O)=O)c1Br,0 F6471-6067,COC(c(cc1)ccc1C(NCc1cc(-c2cscc2)cnc1)=O)=O,0 F0885-0072,O=C(C1(CC1)S(c1ccccc1)(=O)=O)NCc(cc1)cc2c1OCO2,1 F5072-3613,O=C(COc1cccc2ccccc12)N(CC1)CCN1c(cc1)nnc1-c1ccncc1,1 Z406634582,CC(C)Oc(cc1)ncc1C(N(CC1)CCC1NC(c1ccccc1)=O)=O,1 S696-0245,Cc1cnc(-c2ccccc2)n1CC(C1)CN1C(NCCCOC)=O,0 Z2948975683,CN(C[C@@H]1CNC(NC2=CC=CN(C)C2=O)=O)C[C@@H]1c1ccccc1,1 F6803-2428,CN(C=NC(N(CC1)CC1Oc(nc1)ncc1OC)=C1)C1=O,1 F6553-8761,COc(ccc(C(N(C1)CC1N1CCCC1)=O)c1)c1F,0 Y030-4346,CC(C)(C)CC(Nc(cc(cc1)Cl)c1OC)=O,0 E823-0375,O=C(CCc1nc(CN(CC2)CCN2C(c2cccs2)=O)no1)N1CCCC1,1 F3288-0138,O=C(c1cnccc1)NCCOC(Nc1ccccc1)=O,1 SB21-1165,Cn1nc(C(N(C2)[C@H](Cn3nnc(C(N4CCCC4)=O)c3)C[C@@H]2F)=O)c2c1cccc2,0 T634-0553,O=C(C1OCCC1)N1Cc(cc(CN2CCCCCC2)cc2)c2OCC1,1 3209-0986,O=C(c1c(NC(CC2C(F)(F)F)c(cc3)ccc3Br)n2nc1)N(CC1)CCN1C(c1ccccc1)=O,1 8016-9948,Cc(c(NC(CSc1nc(cc(C(F)(F)F)cc2)c2n1C1CC1)=O)ccc1)c1Cl,1 Z2453453162,CC(CCn1nc2)Cc1c2C(Nc1c(C)ccc(C(N)=O)c1)=O,0 F5791-1363,CS(Nc1cc(NC(Cn(cc2)c3c2cccc3)=O)ccc1)(=O)=O,0 Z2478609220,CN(C)S(N(C)CC(NC1(CC1)c1cc(C(F)(F)F)ccc1)=O)(=O)=O,0 Z1531366339,COCC(CC1)(CCN1C(Cn(cc1)c2c1cccc2)=O)O,0 SD02-1407,CC(C)c1nnc(C(C2)N(CC(N3CCOCC3)=O)CC2(CC2)CCN2C(c2cscn2)=O)o1,1 Z2440428155,O=C(CSc1cc(C(F)(F)F)ccc1)N(CC1)CCC1NCC1CC1,1 F6514-6435,Cc1cc(C(NC(Cn2nccn2)c2ccccc2)=O)no1,1 Y041-5181,OC(C1NC(c(cccc2)c2OC(F)(F)F)SC1)=O,0 F779-0927,CCn1c(cccc2)c2nc1CCc1cccc(NC(c2ccncc2)=O)c1,1 SA85-1038,OC(CN(CCc1ccccc1)C(C1)=O)CN1S(Cc(cc1)ccc1Cl)(=O)=O,1 F6805-8048,COc1nccc(N(CCN(Cc2cncs2)C2)C2=O)c1,0 F1773-0196,CCOc(c(S(NCc1ncccc1)(=O)=O)ccc1Cl)c1Cl,0 F6724-1256,Cn1c(ncnc2NCC(C(F)(F)F)(c3ccccc3)O)c2nc1,0 Z237-1219,O=C(c1cc2nnc(-c(cccc3)c3Br)n2cc1)N(CC1)CCN1C1CCCCC1,1 Z1527674183,CCCC(C1)OCCN1C(NCc1c(C)onc1C)=O,1 F6435-9041,Cc1cc(C(N(CC2)CC2SCC(OC)=O)=O)no1,0 C260-1513,CC(N12)=CC=CC2=NC(CN(c(cccc2)c2C(N2CCCC(NCc3ccco3)=O)=O)C2=O)=CC1=O,1 Z3787031058,C=CCNS(c(cc(c(Cl)c1)Cl)c1Br)(=O)=O,0 Z2089350714,CC(CC1)N(CCNc2c3ncn([C@@H]([C@@H]4O)O[C@H](CO)[C@H]4O)c3ncn2)c2c1cccc2,1 F6523-3245,O=C(Cc(cccc1)c1Cl)NCCN(Cc(cc(cc1)F)c1OC1)C1=O,0 SB74-0436,CC(C)C(N(CC1)C[C@@]1(C[C@@H](C(NCCc1c[nH]c2c1cccc2)=O)N1)C1=O)=O,0 F6089-9786,Cc1nccn1CCNC(NC1CCOCC1)=O,1 Y205-7758,O=C(Nc(cc1)cc2c1OCCO2)N(CC1)CCN1c(cc1)ccc1F,0 F5241-0110,CCCS(N(CC1)CCN1c1nc(OC)nc(OC)c1)(=O)=O,0 Z2910078736,CC(c([nH]c1c2)nc1cc(Cl)c2Cl)NC(C1CCC1)=O,1 Z830179124,Cc1noc(C)c1CNS(c1c(C)ccc(Cl)c1)(=O)=O,0 Z1696695135,CC(NCc(cc1)ccc1C(OCc1cc(F)c(C)cc1)=O)=O,0 Z2700229102,OC(CC1)(Cc(cc2)c1cc2Br)c1nc(Cc2cccs2)no1,1 F6218-0009,O=C(C1CCCC1)Nc1cnc(-n2nccc2)nc1,1 F6556-3517,O=C(NCC(CC1)CCN1C1COCC1)Nc(cccc1)c1Cl,0 V028-4448,COc1ccc(CN(CCN2CCOCC2)CC(COc(cc2)ccc2Cl)O)cc1,0 Z1188909265,CC(C)(CCC1)CN1C(c(cc1)ccc1S(NC1CC1)(=O)=O)=O,1 F6663-4323,Fc(cc1)cc(CN(CC2)CCN2C2CCC2)c1F,1 F2898-4878,COc(ccc(Cl)c1)c1C(N(CC1OCCC1)c1nc(c(F)ccc2)c2s1)=O,0 Y044-4991,Cc1nnc(NC(C(C2)C(c3cnccc3)N(C)C2=O)=O)s1,1 S726-1287,O=C(c1n[nH]c-2c1COc1c2cccc1)N(CC1)CCC11OCCC(CCOc2ccncc2)C1,1 Z1230400425,O=C1NC(CN(CC2)CCC2c2c[nH]c3c2cccn3)=Nc(cc2)c1cc2Cl,1 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Z1612660862,O=C(CN1)N(Cc(cc2)cnc2Oc2c(C(F)(F)F)cccc2)C1=O,1 3448-6881,O=C(C(CC1=O)CN1c(cc1)ccc1Br)Nc1nc(cccc2)c2s1,0 F6245-6292,CN(C(c1ncccc1)=NN1CCNC(Cn(cc2)c3c2cccc3)=O)C1=O,1 Z1620399497,CC(C(N1)=O)(c2cc(C(NC(CC3)Cc4c3[nH]c3c4cc(C)cc3)=O)ccc2)NC1=O,1 Z2256273103,OC(c1ccc(CC(N(CC2)CC2c(cc2)ccc2F)=O)cc1)=O,0 F3173-0044,CCOC(c1cnc(c(C)c(cc2)Cl)c2c1O)=O,0 Z1728664380,OC(c(cc1)cc(Br)c1S(N1CC=CCC1)(=O)=O)=O,0 Z2355041740,CC1NCCCC1NC(Nc1cccc(C(Nc(cc2)ncc2Cl)=O)c1)=O,0 F6024-1019,O=C(C1(CC1)c1noc(-c(cccc2)c2F)c1)NCCC1=CCCCC1,1 Z4439098437,CCCN(C)C(CNc1ncnc2c1ncs2)c(cc1)ccc1Cl,1 Z2982138701,CC(C1)OC(C)CC1N(C(CC1)=O)N=C1c(cc1)ncc1Cl,1 8012-9755,CCOc(c(NC(c1ccccc1)=O)c1)cc(N(C(C2)C(C3)CS2(=O)=O)C3=O)c1OCC,1 Z1413251858,O=C(C1CCN(Cc2ccccc2)CC1)N(CC1)CCN1C1COCC1,1 Z2655463663,Cc1cc(NC(NCCC(C2)C2(F)F)=O)nn1-c1cccc(Cl)c1,0 F3398-4461,O=C(CSc1nccn1-c(cc1)ccc1C(NCc1cccs1)=O)NC1CCCC1,1 Z1560546219,Cc(cncc1)c1NC(N1CC(c(cc2)cc(Cl)c2Cl)OCC1)=O,0 SC02-0659,COCCC(CC1)(CN1C(NCc1ccccc1)=O)NS(C)(=O)=O,0 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F6442-3068,O=S(C(C1)CN1S(c1cccc2ccccc12)(=O)=O)(c(cc1)ccc1Cl)=O,1 Z2231309282,OCC(C1)c(cccc2)c2N1C(CN(CCC1)S1(=O)=O)=O,0 F6441-6943,Cc(cccc1)c1OCC(N(CC1)CCC1S(c1nncn1C)(=O)=O)=O,1 Z1673675613,CC(Cc1cc(OC)ccc1)NC(N(CC1)CC2N1CCOC2)=O,1 SB20-0028,Cc1nccn1CC(N1[C@H](Cn2nnc(C(NC3CCCC3)=O)c2)CCC1)=O,1 Z4951950858,CNS(c(cc1)ccc1NC(c1csc(N=CN2)c1C2=O)=O)(=O)=O,0 Z3464484383,C[C@@H](C(N[C@H](CO)[C@@H](c(cc1)ccc1[N+]([O-])=O)O)=O)O,0 Z2287873739,CC(C)(C)c(s1)ccc1S(NC(C(C1)C1(F)F)=O)(=O)=O,0 E852-1107,CCOc1ccc(CNC(c2nn(CC(C)(C(NCCC(C)C)=O)N(C)C3=O)c3c2)=O)cc1,1 Z2437620504,CC1(COCC1)NS(c(cc1)cc2c1oc(C(O)=O)c2C)(=O)=O,1 Z1412310304,CC(CCC1)N1C(NC(CC1)Cc2c1cn[nH]2)=O,1 S904-0068,CC(C)N(C[C@H](C1)O)[C@@H]1c1nnc2n1CCN(Cc(ccnc1)c1F)C2,0 Z2094048567,CC(C)N(CC(N1CCCCCC1)=O)C(c1cnccc1)=O,0 Z2962548661,CCn(nc1)nc1C(N(CC1)CCC1(CO)C(F)(F)F)=O,0 F6465-0312,OC(CNC(c(cccc1)c1SC(F)F)=O)CN(C=CC=C1)C1=O,0 G118-1206,CCOc(cccc1)c1NC(N(Cc(cccc1)c1-n1c2ccc1)C2c(cc1)ccc1N(C)C)=O,0 F6443-7616,O=C(c(s1)ccc1Cl)NCC(CCC1)N1c1ccccc1,1 S727-0116,Cc1ccc(C)n1-c(cc1)ccc1C(N(C1)CC1n1nnc(CO)c1)=O,1 F6523-2496,O=C(c1cc(C(F)(F)F)ccc1)NCc1nnc(cc2)n1nc2-c1cccs1,0 Z2620840174,O=C(C1C(C2)C2CCC1)N(Cc1ccccc1)CC(NC1=O)=Nc2c1scc2,1 S827-2921,O=C(Cc1ccncc1)N(CC(C1)(F)F)[C@@H]1c1nc(C2CC2)no1,1 F6215-0004,Cc1noc(CCNC(c2c(C)nc(-n3cccc3)s2)=O)c1,1 S988-0677,Cc1noc([C@@](CN(C2)C(C3CC3)=O)(C3)[C@@H]2CN3C(c2cnccc2)=O)n1,0 Z1939442284,Cn1c2ncnc(C(O)=O)c2c(Br)c1,0 C548-3513,CN(C1CCCCC1)C(C1CCC(CNS(c2cccc3nsnc23)(=O)=O)CC1)=O,0 Z1143248756,CC(C)c(cc1)ccc1C(CSc(n1nc2C)nnc1nc2O)=O,0 S480-0168,CC(c(cc1)ccc1OC)NC(CN(C(C(CC1)(CCS1(=O)=O)N1)=O)C1=O)=O,1 Z2370682082,COCC(CCCC1)N1S(c1c2OCCc2ccc1)(=O)=O,0 Z2883178643,COCC(CC1)(CN1C(N[C@H](CCC1)[C@@]11OCCC1)=O)C(O)=O,1 8020-3455,O=C(c1c(-c(cc2)ccc2Cl)n2ncnc2nc1C=C1)N1c1ncn[nH]1,0 S902-1206,CN(C)C(N(CCCC1)C1c1nnc(C2)n1CCN2C(C1CCC1)=O)=O,1 Z25220858,O=C(CSc1nnc(-c(cc2)ccc2Cl)[nH]1)NCCCc1ccccc1,0 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F5527-1252,O=C(C(CCC1)CN1c(cc1)nnc1-c1ccco1)NCc(cc1)cc2c1OCO2,1 Z4328258819,CC(c(cccc1)c1OCc1cn(C2CCNCC2)nn1)O,0 Z1166962205,CN(CC1)CCC1NC(c(cc1)cc2c1-n1ncnc1NS2(=O)=O)=O,0 S454-0728,O=C(c1ccc[nH]1)N(CC1)CCC1n1nnc(-c2nc(C3CC3)no2)c1,1 Z1295816843,Cc(nc(cc1)N)c1-c(cc1)cnc1OC,0 Z2771409007,Cc1c(C)oc(NC(N[C@H](COC2)[C@H]2O)=O)n1,1 Z1258898112,COc(cccc1)c1S(NC(CN)C1CC1)(=O)=O,0 V005-0842,CCC(C(NC1CC1)=O)Oc1cc(C(c(cc2)ccc2F)N(CC2)C(C3CCCC3)=O)c2cc1,0 Z4002430131,Cc(cc1)ccc1-c1cnc(NC(C(CC2)(CC3)CC23C(OC)=O)=O)s1,0 S836-7339,Cc(occ1)c1C(N(C[C@@H]1COc2ccncc2)C[C@@H]1C(N)=O)=O,1 E557-3071,CC(C)(c(cc(cc1)S(N(CCC2)CC2C(NCCc2ccc(C)cc2)=O)(=O)=O)c1N1C)C1=O,1 F148-0537,CN(c(n1nc2)c2C(NCCC2=CCCCC2)=O)C(CCN(Cc2ccccc2)C2)=C2C1=O,1 Z4180010863,OC(C(CC1)NCC1C1CCCC1)=O,1 F6523-3301,Cc1nc(C(NCCN(Cc(cc(cc2)Cl)c2OC2)C2=O)=O)cs1,1 Z1725335282,Cc1nn(ccnc2NCCCCN3CCOCC3)c2c1,1 Z1739199226,Cc([nH]nc1)c1S(N(CCC(O)=O)Cc1cc(F)ccc1)(=O)=O,0 Z1359797115,CN(C)C(c(cccc1)c1OCc(cccc1)c1C#N)=O,0 F6201-0402,Cc1cc(CNC(C(Nc(cc2)cc(Cl)c2F)=O)=O)c(C)o1,0 T505-0107,O=C(CN(c(cccc1)c1O1)C1=O)N1C(CCn2nnc(-c3ccccc3)c2)CCCC1,1 Z367327208,Cc1c(C(N(CC2)CCC2C(c2c(C)cc(C)cc2)=O)=O)sc(-c2cccs2)n1,1 Z2160072663,CC(C)(C(F)F)c1nc(Cc2nncn2-c2ccccc2)no1,0 V028-1824,CC(C)CN(CC(N(CC1OCCC1)Cc1ccco1)=O)S(C)(=O)=O,0 F6089-9682,CCCS(N(CCC1)c(cc2)c1cc2NC(NC1CCOCC1)=O)(=O)=O,1 S926-1520,Cc1noc(C)c1S(N(CCC1)CC1OCc1noc(C2CC2)n1)(=O)=O,1 F6795-5678,Cc(cn1)c(N(CC2)CCN2c2ncnc3c2cnn3C)nc1SC,0 S615-0285,Cc1cc(C(F)(F)F)nn1CC(N(CC1)CC1c1nc(CCOCC2CC2)no1)=O,1 SA46-2248,Cc1c(Cn2nccc2)c(C(N(C2)CC2(C2)OCC2N(C)Cc2ccccc2)=O)no1,1 F6261-3664,Cc1c(CNS(c(cc(cc2)Br)c2OC)(=O)=O)sc(C)n1,0 Y020-8424,O=C(c1c(C=C2)nc(N3CCCC3)nc1)N2c(cc1)ccc1OC(F)(F)F,1 Z4245316542,O=C(C1CC1)NCC(c1n[nH]c2c1CCC2)(F)F,1 Y043-7954,O=C(C1Oc(cccc2)c2OC1)Nc(cc(cc1)Cl)c1N(CCC1)C1=O,1 Y043-2037,CSc(cc1)ccc1C(C=C1)=NN(CC(Nc2nnc(C3OCCC3)s2)=O)C1=O,0 SB29-0186,Cc1nc([C@H](C[C@@H](C2)OC)N2C(CCc2ccccc2)=O)n[nH]1,1 F6523-0162,Cc1nc(N(CC2)CCC2NC(Cc2noc3c2cccc3)=O)cc(C(F)(F)F)n1,1 F2773-0164,COC(c1ccc(CN(C(C=C2)=O)N=C2c2cccs2)o1)=O,1 F6562-2365,COC(c(cc1)ccc1C(NCc1cc(N(CCC2)C2=O)ncc1)=O)=O,0 Z836907152,CCOc1ccc(CN(C)CCCC(O)=O)cc1,0 P666-2569,CCC(n1c2cc(S(N3CCC(Cc4ccccc4)CC3)(=O)=O)c1)=NN(CC)C2=O,0 F6556-3355,O=S(c1cc(C(F)(F)F)ccc1)(NCC(CC1)CCN1C1COCC1)=O,0 SA65-1029,O=S(c1cccs1)(N1CCC(CCc2noc(C3CC3)n2)CC1)=O,1 SC10-0123,Cc1cn(CC(N(CC2)CC2N(CCCN2CCOCC2)S(C)(=O)=O)=O)nc1,1 S689-0330,O=C(C(C1)CN(C(C2)CN2C(c2nc3ccccc3cc2)=O)C1=O)N1CCCC1,1 Z1881602795,Cc1cc(C(O)=O)cc(S(NCc(cc2)ncc2OC)(=O)=O)c1C,0 Z1159133210,Cc1c(CN(C)c2ncnc(C)c2F)scn1,0 SB36-0636,COCC(N(C1)[C@H](Cn2nnc(C(N3CCOCC3)=O)c2)CC1(F)F)=O,0 V029-4404,COCCNC(CC(c1c[nH]c(cc2)c1cc2Cl)c(cc1)cc2c1OCCO2)=O,1 Z2963171764,Cn1nccc1C(CNC(C1(CC1)C1CCCCC1)=O)O,1 Z200195872,CC1Oc(cccc2)c2OC1C(N(C)c1ccccc1)=O,0 F3126-1245,Cc1c(C(Nc(cc(c(OC)c2)OC)c2C(OC)=O)=O)nnn1-c(cccc1)c1F,0 E715-0543,O=C(C(CC1)CCN1c1ncnc2c1nc1n2CCCCC1)NCCCN1CCCCC1,1 Z1620697957,NC(NCc(cc1)ccc1C(N1CC(Cc2ccccc2)C1)=O)=O,0 M350-0051,O=C(C(CC1=O)CN1c1cccc(Cl)c1)Nc(cc1)ccc1OCc1nnc(-c2ccccc2)o1,1 F6411-3606,O=C(C1CCN(Cc2nc(-c3ccccc3)no2)CC1)Nc(cccc1)c1Br,1 C188-0312,CCC(C(Nc1c(-c2cccs2)nc2n1cccc2)=O)c1ccccc1,1 Z2755372661,CC(C(NC(Cc1c[nH]c2c1cccc2)C(O)=O)=O)OCc1ccc(C)cc1,0 Z2450908212,O=C(c1c(cn[nH]2)c2ccc1)N[C@@H]1CNCCC1,1 Z3138953558,Cn(c(C(N(C1)CC2(CCC2)C1N)=O)c1)nc1-c1ccncc1,1 G516-1393,Clc(cc1)ccc1-c1nc2ccccc2c(NCCCN(CC2)Cc3c2cccc3)n1,1 F6792-4964,CCc1ncnc(N2CC(CN(Cc3noc(C)n3)C3)C3C2)c1F,1 Z1505800339,CCOc1c(C(C(N2CC(C)OCC2)=O)(F)F)cccc1,0 V020-0254,Cc(cc1)ccc1S(N(CCN1CCOCC1)Cc(n1CCOC)cnc1S(Cc1ccccc1)(=O)=O)(=O)=O,1 Y501-3887,CC(c1c(C)nc(N(C(c2c(c(C)no3)c3nc(C3CC3)c2)=O)c(ccc(F)c2)c2Cl)s1)=O,1 Z1897283064,Cn1ncc(C(C(F)(F)F)NS(c2cn(C)nc2)(=O)=O)c1,0 F2261-0276,CC(C)(COc(cc(cc1)NC(c(o2)ccc2Br)=O)c1N1CC=C)C1=O,0 SB95-0870,O=S(c1cc(CCCC2)c2cc1)(N(CCN1CCOCC1)C1CNCCC1)=O,1 F5788-1481,CC(CC1)N(C(CN(CCN2c3cccc(Cl)c3)C2=O)=O)c(cc2)c1cc2F,1 V025-7219,CN(C)c(cc1)c(CN(CC2CC2)C(c(cc2)ccc2F)=O)cc1NC(C1CC1)=O,1 F6550-5130,O=C(c1cccc(Br)c1)N(C1)CC1Nc1nccnc1,0 F1800-0077,CC(C(N1CC(Nc(cc2)ccc2OC(F)(F)F)=O)=O)SC(C)C1=O,0 F6400-0414,O=C(c1csc(-c2ccccc2)n1)N1C(CN2CCCC2)CSCCC1,1 Z2763953173,OC1(CCC1)c1cn(-c2cccc(F)c2)nn1,0 Z1554873186,CN(C(CC1)CCN1C(c1csc(S(C)(=O)=O)c1)=O)c1ccccc1,1 F512-0718,O=C(CN(CCN(Cc(cc1)ccc1F)C1=O)C1=O)NCCCN1CCCCC1,0 F6788-4066,Cc1nc2cnccc2c(N(CC2)CCN2c2cc(C(F)F)nc(C3CC3)n2)n1,1 Y041-5942,COCCn1c(cccc2)c2c(CCC(NC[C@@H]2[C@H](CCCC3)N3CCC2)=O)c1,1 Z827254612,Cc(cc1)c(C)cc1OCC(N[C@@H]([C@H](C1)O)c2c1cccc2)=O,0 Z407263030,Cc(cccc1)c1C(NC(CC1)CCN1C(Cc1cccs1)=O)=O,0 8020-8629,COc1ccc(C(CC(NCCc(cc2)ccc2O)=O)C(C(Oc2c3cccc2)=O)=C3O)cc1,1 S663-0248,COCC(NC(CC1)C1(CC1)CCN1S(c1cccs1)(=O)=O)=O,1 F2743-0997,Cc1cc(CN(C=CC=C2C(Nc3cc(C)c(C)cc3)=O)C2=O)c(C)cc1,0 Z1452232152,Cc1ccc(C(NCCCN2CCCC2)=O)c(Sc2ccccc2)n1,1 Z4662124258,O=C(c1ncncc1)N(C1)C(c(cccc2)c2F)c(cc(cc2)Cl)c2NC1=O,1 F6438-1621,Cc1cc(CNC(c(cc2)cc3c2OCO3)=O)nc(N2CCCC2)n1,1 Z2850772601,O=S(CCC1OCCCC1)(N(CC1)CC11OCc2c1cccc2)=O,1 F6436-2216,OC(CNC(N(CCN1)C1=O)=O)(C(F)(F)F)c1ccccc1,0 Z1849791414,CC(C)c1nccc(N(C[C@H]2OC)C[C@@H]2OC)n1,0 Z1129739297,Cc1nc(-c2ccc(C)cc2)c(CC(NCC2(CCOCC2)N2CCCC2)=O)s1,1 D399-2429,COc(cc1)c(CN(CCC2)C2c(cc2)ccc2F)cc1Br,0 F2378-0440,Cc(c1c2nc(NC(C(CCC3)N3S(c(cc3)ccc3F)(=O)=O)=O)s1)ccc2OC,1 F6481-0740,O=C(COc(cccc1)c1F)N(CC1)CCSC1c(cccc1)c1Cl,0 Z1186109607,CC(c(cc1)cc2c1OCO2)NC(N1C(Cn2ncnc2)CCC1)=O,1 C241-0771,O=C(c(scc1)c1N1Cc(cccc2)c2Cl)N(c2cc(C(F)(F)F)ccc2)C1=O,0 F5652-1818,CC(C=C1)=NN(CC(N(CC2)CCN2c(cc2)ccc2F)=O)C1=O,1 Z394502612,Cc1nnnn1-c1cccc(NC(c2cccc(OC)c2OC(F)F)=O)c1,0 Z1550031602,CCC(C)C(C(N1C(CC(c2ccccc2)O)CCC1)=O)O,0 SC44-0100,CCCNC(N(CC1)CCC1(C1)OCCC1OCC(N(C)C)=O)=O,0 F6709-4649,Cc1nccc(OC(C2)CN2C(C2COCC2)=O)c1,1 Z2439802188,O=C(Cc(cc1)ccc1-n1nccc1)NC1CCNCC1,1 S543-0817,Cc1c(C(N(CC2)CCC2(C2)OCCC2N(C2CC2)S(C)(=O)=O)=O)sc(C)n1,0 F6752-3836,Cc1csc(N2CC(C(N(CC3)CCC3(F)F)=O)OCC2)n1,1 F6442-6884,COC(c(cc1)ccc1C(N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F)=O)=O,0 Z199974276,O=C(COc(cc1)ccc1F)Nc(cc1)ccc1SCc1cnccc1,0 F6744-5913,C(C1)C1c1nccc(NC(CC2)CN2C2CCOCC2)n1,1 F6249-0354,COC(N(CC1)C(C(NCC(F)(F)F)=O)c2c1cccc2)=O,0 Z2952465493,Cn1nnc2c1ccc(NC(N(CCC1)C1c(cc1)ccc1O)=O)c2,0 Z407005596,Cc1cc(C(CCC2)N2C(Cc2c[nH]c(cc3)c2cc3OC)=O)no1,1 F6353-5652,COC(c(cc1)ccc1C(NCC(c1cocc1)N1CCSCC1)=O)=O,0 F6497-2907,Cc(cccc1)c1N(C(CC(CC1)CCN1C(C1=CC=CN(C)C1=O)=O)=NN1)C1=O,1 SC89-0221,COc(cc1)cc(OC)c1C(N(C1)CC1(C(CN1CCCCC1)CC1)S1(=O)=O)=O,0 F6448-2335,O=C(Cn1ncnc1)Nc1cn(CC2Oc(cccc3)c3OC2)nc1,1 SB17-0171,Cc1cc(C(N(CC[C@H]2NC(CC3)=O)C[C@]23C(N2CCCC2)=O)=O)no1,1 S458-0032,Cc1ccc(C(N(CCC2)CC2n2nnc(-c3noc(C)n3)c2)=O)s1,1 F6557-2034,O=C(N(CCC1c(cccc2)c2Cl)CCS1(=O)=O)OCc1ccccc1,1 Z2899507922,CO[C@@H](CN)c1nc(C2(CCCC2)c(c(F)ccc2)c2F)no1,1 Z2178763368,CC(C(O)=O)N(C)S(c1cc(COC)cc(Cl)c1)(=O)=O,0 F6475-2621,COCCOc1nccc(C(NCc(cccc2)c2Cl)=O)c1,0 F6473-4245,COC(c(cccc1)c1C(N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O)=O)=O,0 Z2066029296,OC(C[C@@H](c(ccc(F)c1)c1F)NS(c1cscc1)(=O)=O)=O,0 Z4398904490,OC(c1cc(-n2nnc(CN(Cc(cc3)ccc3F)C(CC3CCCC3)=O)c2)cnc1)=O,1 F6752-3679,Cc1noc(CN(CCC2)CC2NC(C2CC2)=O)c1,1 SA64-0636,CS(NCC1CC(CC2)(CCN2C(Cn2cncc2)=O)OCC1)(=O)=O,1 F6677-0429,Cc1nccn1CC(C1)CN1c1nc(c(F)ccc2)c2s1,0 F6473-0772,O=C(c1c[nH]c2c1cccc2)N(C1)CC1N(CC1)Cc2c1scc2,1 Z2967559065,CC(C)C(N(CC1)CCN1c1nc(-n2c(cccc3)c3nc2)ccc1)=O,1 F6514-2807,Cc1cccc(S(NCCC(N(C2)CC2OCC(F)(F)F)=O)(=O)=O)c1,0 SC42-0433,Cc1c(COC)c(C(N(CC2)CCC22OCCC(Cc3noc(C4CCC4)n3)C2)=O)no1,0 Z2711558584,Cc1cn(C(CC2)CN2C(Nc(cc2)ccc2-c2nnnn2C)=O)nc1,1 F6574-1409,O=C(NC(c1ccccc1)c1ccccc1)NC(CC1)CCC1n1nccc1,1 F6520-1164,O=C(c1c(C(F)(F)F)cccc1)NCCc1ccc(-c2cscc2)s1,0 D294-3093,CC(C)C(Nc(cc1)ccc1C(Nc1nnc(C(CC2=O)CN2c2cc(C)cc(C)c2)s1)=O)=O,0 F6512-9212,Cc1c(CNC(Nc2c(C(F)(F)F)cccc2)=O)cno1,0 F978-0674,Cc(cc1)ccc1N(C(C=C1)=O)N=C1N(CC1)CCN1C(Nc(ccc(Br)c1)c1F)=O,0 Y203-5588,CC(C)(CNC(C1C(CC2)CC2C1)=O)CNC(C1C(CC2)CC2C1)=O,1 Z2377886327,CC(C)C(CCC1)CN1C(C(N1CC(C(C)N)OCC1)=O)=O,1 Z2974115530,Cc1cncnc1N(C)Cc1ncccn1,0 Z637694162,CCN(CC)S(c(cc1)cc2c1n(C)c(-c(ccc(OC(F)F)c1)c1OC(F)F)n2)(=O)=O,0 L249-1291,O=C(CC(CC1)CCN1C(c(cc1)cc2c1oc(C1CC1)n2)=O)NCCC1=CCCCC1,1 E570-0522,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(N(C)CC(N(C)Cc1ccco1)=O)(=O)=O,1 Z4658051048,CCOc1cc(NCC(CNC(CC2(C)CC2)=O)(C2)C22CCC2)ncn1,1 Z1047605306,O=C(CN(c1c(CCC2)cccc1)C2=O)Nc1cccc(F)c1,0 Z1677782908,Cc1cccc(NC(N(CC2)CCN2c2nc(C)ncc2)=O)c1F,0 S511-2645,CS(N(CC1)CCC11OCCC(CC(N(CCC2)c3c2cccc3)=O)C1)(=O)=O,1 F6472-7585,O=C(c1noc(-c2ccccc2)c1)N(C1)CC1N(CC1)Cc2c1cccc2,1 Z756390548,CC(Cc1ccc(C(C)(C)C)cc1)C(O)=O,0 F6440-3077,CC(C)(C)C(NCc1nn(C)c2c1COCC2)=O,0 F6809-8103,FC(c1nnc2n1CCN(CC1OCCOC1)C2)(F)F,1 C105-0898,O=C(CCS(c1cccc2nsnc12)(=O)=O)N(CC1)CCN1c(cccc1)c1F,1 F3394-1289,O=C(c(cccc1)c1Br)N(CC1)CCN1c1nnnn1-c1ccccc1,1 F6553-7184,O=C(c1cc(cccc2)c2s1)N(CC1)Cc2c1sc(Cl)c2,1 V017-4724,CC(C(N(Cc(cc1)ccc1Cl)C1)=O)Oc(cc2)c1cc2NC(Nc1cc(OC)ccc1)=O,0 Z1506478328,Cc1nc(-c(cc2)ccc2Cl)nc(C(N(C)CCCC(NC)=O)=O)c1,0 F6574-1813,COC(CC1)CN1c(cc1)ccc1C(NCc1nccnc1-c1cccs1)=O,1 F5834-1971,Cc(c(S(Nc1ccc(CC(N2CCCC2)=O)cc1)(=O)=O)ccc1)c1Cl,0 Z1679912067,O=C(c1cncnc1)Nc1cccc(CSC2CCCC2)c1,1 Z1192343883,CC(C)(C1)OCCC1NC1CCN(Cc2ccccc2)CC1,1 Z1647389353,CCOC(CCC1)CN1C(c1cc(NCC2)c2cc1)=O,0 Z1631839084,CCCCC(CC1)CCC1C(NCC(C1)CN(C2CC2)C1=O)=O,1 Z2505232710,CC(C)(C(N)=O)c1nc(C2(CCC2)c2ccncc2)no1,0 Z2851883407,Cc1c(N(C2)Cc3c2cnn3C)n2ncnc2nc1C,1 Z2460807843,CC(C(N(CCc1ccc2)Cc1c2C(O)=O)=O)c1c(C)n(C)nc1C,0 Z3345472233,CC(CN[C@H](Cc1ccccc1)C(O)=O)(C(F)(F)F)O,0 SB32-0936,COC[C@@H](CN(C1)C(C2CC2)=O)[C@H]1c1nc(-c2ccccc2)n[nH]1,1 Z1229906660,CC(C)(C)n1ncc(C(N2CCC(CN(CCCC3)C3=O)CC2)=O)c1,1 Z2218975042,Cn1cnc(S(N(CCC2)CCC2O)(=O)=O)c1,0 K780-0238,CCC(Nc(cc(cc1)C(O)=O)c1Sc(cc1)ccc1OC)=O,0 F6112-0284,COc(ccc(Cl)c1)c1NC(CN1CC(COCc2ccccc2)CCC1)=O,1 S826-6324,OC[C@@H](CN(C1)C(CC2CCCC2)=O)[C@H]1c1nc(-c2cnccc2)no1,1 8139-0249,CCOc(cc1)ccc1N(C(CC1NC(CC2)CCN2S(c(cc2)ccc2OC)(=O)=O)=O)C1=O,1 J007-1414,CC(C)CNC(N(CCC1)C1c1cc(C(C)C)no1)=O,0 SA92-0406,Cc1noc(C2(CN(Cc3cccn3C)CCC2)F)n1,1 F6570-2657,CC(C)(C)OC(N(CCC1)C1C(Nc(cccc1)c1-c1cn(CCCC2)c2n1)=O)=O,1 SD56-0042,COCCN(C(C(C1)N2CCCN1C(c1nc3ccccc3cc1)=O)=O)C2=O,0 F550-2849,O=C(CCN(C(C=C1)=O)N=C1C(N(CC1)c2c1cccc2)=O)N(CC1)CC=C1c1ccccc1,0 F3167-0348,O=C(C(NCc(cc1)cc2c1OCO2)=NC=C1)N1c(cc1)ccc1Br,1 Z244065690,CC(CC1)(CS1(=O)=O)NC(C(CC1)CCN1c(cc1)ncc1C#N)=O,0 Z2238446208,CC(CNc1nc2ccccc2cc1C)(CO)CO,0 Z393468108,OC(c(cc1)ncc1C(Nc(cccn1)c1Oc1ccccc1)=O)=O,1 F6089-0106,Cc(cc1)ccc1S(N1C(CCNC(C2=CC=CN(C)C2=O)=O)CCCC1)(=O)=O,1 Z1926536730,CC(C)(CCCC1)C1C(NC1CCN(Cc2ccncc2)CC1)=O,1 F6502-2609,O=C(c(cccc1)c1S(C(F)F)(=O)=O)NCCn1c(C2CC2)ncc1,0 Z1781449541,CN(C)C1(CN(C)C(c2cccc(N(CCN3)C3=O)c2)=O)CCC1,1 F6525-7608,O=C(C1(CCCC1)c1cccs1)NCCn1ncc(-c2cocc2)c1,1 D323-0216,O=C(C1Oc(cccc2)c2OC1)Nc1nc(-c(cc2)ccc2Br)ns1,0 F6064-8365,O=C(Cc(cccc1)c1Cl)N(C1)CC1c1nc(-c2ccco2)no1,1 V028-2243,O=C(C(CCC1)N1C(c1noc(-c(cccc2)c2Cl)c1)=O)NCc1ccco1,1 F6436-1521,COc1cc([nH]c(C(Nc2ccc(CC(N3CCOCC3)=O)cc2)=O)c2)c2cc1,1 Z2957802703,CN(C)C(CC1)CCN1C(Nc(cc1)nnc1-c(cccc1)c1F)=O,0 F5599-0364,Cn(c(NC(C1)=O)c2C1c1ccccc1)nc2NC(c1ccco1)=O,1 F5854-4620,CC(C)(C)c(cc1)ccc1NC(N(CCc1cccs1)C1CC1)=O,0 Z2188020688,O[C@H](CCCC1)[C@@H]1NC(CCC1)c2c1ccc(O)c2,0 D294-4958,CC(C)CCNC(C(C1)CN(CCc2c[nH]c(cc3)c2cc3Cl)C1=O)=O,0 Z1198345843,CCc1nnc(NC(C2C(CC3)OC3C2)=O)s1,0 Z2763055551,CC(C(O)=O)N(C)S(c1c(C(F)(F)F)cnn1C)(=O)=O,0 F0601-0029,CCOC(CSc1nnc(CNC(c(cccc2)c2F)=O)n1-c1cc(C(F)(F)F)ccc1)=O,0 Z2933381065,Cn(cc1)c2c1c(NCc(cc1)ccc1OC)ncn2,0 T831-0267,O=C(NCC(CC1)CCN(Cc2ccccc2)C1=O)NCc1ccccc1,1 Z2000271809,CC(CN(C1)c2ncnc3c2cn[nH]3)N(C)C1=O,0 D330-0198,Cc1c(CC(c(cc(cc2)Br)c2N2)C2=O)scc1,0 F6492-0500,CN(Cc1nc(cccc2)c2[nH]1)C(C(CC1)Cc2c1[nH]cn2)=O,1 Z2928069860,COc(c(F)c1)cc(F)c1S(N1CC(C(O)=O)OCC1)(=O)=O,0 F6441-2909,COc1cccc(C(NCC(N(CC2)CCC2S(c(cc2)ccc2F)(=O)=O)=O)=O)c1,1 F6443-6560,O=C(Cc(cc1)ccc1F)NCC(CCC1)N1c1nccs1,1 Z1889215477,Cc1cccc(C(CNC(c2c(Cc3ccccc3)n(C)nc2)=O)O)c1,0 F6679-2725,N#Cc(cc1Cl)cnc1N(CC1)CC1Oc(ccnc1)c1Br,0 Z2436622653,Cc1c(C2(CNC(c3cn(C4CCNCC4)nn3)=O)CC2)cccc1,1 Z2378680126,O=C(c1ccc(C(F)(F)F)cc1)Nc1ncc(C2CCNCC2)s1,0 3285-2572,CC(CCC1C(N2c(cc3)ccc3C(O)=O)=O)CC1C2=O,0 F6496-1159,Cc1cc(CNS(c(cc2)ccc2OC)(=O)=O)ncn1,0 P048-1925,Cc1nnc(cc2)n1cc2S(N(Cc(cc1)cc(F)c1OC)c(cc1)ccc1F)(=O)=O,0 F6754-5232,COc(cc1)c2nc(N(CC3)CC3(F)F)sc2c1OC,0 SA66-0641,COc1cccc(CN2CC(CCc3noc(-c4cnccc4)n3)CCC2)n1,1 F2070-1414,O=C(c1cc(cccc2)c2o1)NCc1nnnn1C1CCCCC1,1 F6245-3451,CN(C1=O)N=C(C(CC2)CCN2C(C2(CCCC2)c2cccs2)=O)N1c1ccccc1,1 S629-1890,Cn1cnc(S(N2Cc(cc(CCC(NC3CC3)=O)cc3)c3OCC2)(=O)=O)c1,1 Z1474250500,CN(CC1CN(C)CC1)C(c1n[nH]cn1)=O,1 6466-0117,O=C(Cn1nc(C(F)(F)F)c2c1CCC2)Nc(cc1)cc(Cl)c1-n1cccc1,1 F5226-0442,COc1cccc(OC)c1C(NCCNC(c(cc1)ccc1NC(C1CC1)=O)=O)=O,0 Z2482958026,Cc1csc(C2CN(Cc3csc(-c4cc(C(O)=O)ccc4)n3)CCC2)n1,1 F6476-0742,Cc1cccc(OC(CC2)CN2C(CSCc2ccccc2)=O)n1,1 Z2061552702,Cn1nnc2c1ccc(C(N(CCC1)CC1(C(N)=O)O)=O)c2,0 F6544-1357,Cn1c(N(CC2)CCN2C(c2ncccc2)=O)ncc1,1 Z3216017628,CC(CC(Nc1cc(C(O)=O)n[nH]1)=O)c1c(C)cccc1,0 S740-1097,COCCCN(C([C@H](C[C@@H](C1)NC(CC2CCCC2)=O)N1CC1)=O)S1(=O)=O,1 Z343941440,CN(C(CC1)=O)N=C1C(N(CC1)Cc2c1[nH]c(cc1)c2cc1C(O)=O)=O,1 F6529-0478,CN(c(cccc1)c1N1C2CCN(Cc3cn(cccc4)c4n3)CC2)S1(=O)=O,1 F6573-4767,CCOc1c(CCC(NCc2cncc(C3CC3)c2)=O)cccc1,0 Z2297494839,CS(CC(CCCC1)N1C(c1cc(CCCC2)c2cc1)=O)(=O)=O,0 Z4119259589,O=C(c1cc(F)cc(F)c1)NCCn1nnc(-c2ccccc2)c1,0 F5528-1687,O=C(C(CC1)CCN1c(cc1)nnc1-c1cnccc1)Nc(cc(C(F)(F)F)cc1)c1Cl,0 F6445-7327,CN(C=C(C(N(CC1)CCN1c1ncc(C(F)(F)F)cc1)=O)C(OC)=C1)C1=O,1 F5882-0155,COC(N1CCN(CCNC(c2cccc3ccccc23)=O)CC1)=O,0 F6712-4048,CC(C)(C)c(cc1)nnc1N1CC(CN(C2)C(CCc3ccccc3)=O)C2C1,1 Z991649962,Cc1noc(C)c1CC(Nc1cccc(C(Nc2ccncc2)=O)c1)=O,1 Z2983318781,C([C@H]1CCOC2)NC[C@]12c1nc(-c2ccncc2)no1,1 SC70-0026,O=C(C1CC1)N(C1)CC2(CCC2)C1c1n[nH]c(-c2ccncc2)n1,1 E612-0100,Cc1cc(NC(C(c2ccccc2)N(Cc2c3cccc2)C3=O)=O)cc(C)c1,0 F6523-3705,O=C(c1cc(C2CC2)n[nH]1)N(CC1)CC2=C1N=C(C=CC=C1)N1C2=O,1 Z3482423417,CC(C)c1cccc(-c2cc(NC(NC3)=O)c3cc2)c1,1 Z3503624915,Cc1noc(C)c1S(NC([C@@H]1[C@H](C2)[C@H]2CC1)=O)(=O)=O,1 F403-0007,Cc1cc(NC(CN(c(cccc2)c2N=C2C3CCC2)C3=O)=O)c(C)cc1,0 Y043-6281,Cc(c(O1)c(cc2CN(C)C[C@@H]3[C@H](CCCC4)N4CCC3)C(c3ccccc3)=CC1=O)c2O,1 Z1954779984,CCC(C)c(cccc1)c1N(CC(C1)C(N(CCCO)Cc2ncccc2)=O)C1=O,0 F6660-4495,Cc(cc1)ccc1N(C(C1CCNCC1)=NN1)C1=O,1 S976-0561,COCCNC(C(CCC1)(CN1C(CCc1ccccc1)=O)F)=O,0 SB14-1167,COCC(N(C(CC1)CN1C(c(cc1)cnc1OC)=O)C1CCOCC1)=O,1 F6436-3653,Cn1nnc(C(N(CCOC)Cc2cocc2)=O)c1,1 F5796-1031,Cc1c(C(Nc2c(C(F)(F)F)cccc2)=O)c(S(N2CCOCC2)(=O)=O)c(C)o1,1 3043-0104,OC(c(cccc1)c1C(Nc(cc1)ccc1N(C(C1C2C3CC1CC3)=O)C2=O)=O)=O,1 F6562-5749,CC(C)(C)SCC(CCCC1)N1C(c1ccco1)=O,0 Z2475948636,Cn1nncc1S(N[C@@H](CCc1ccccc1)C(O)=O)(=O)=O,1 C733-0337,O=C(c1cccnc1N1Cc(cccc2)c2F)N(CCc2c[nH]c3c2cccc3)C1=O,1 F2647-0191,CCSc1cccc(C(Nc2nccs2)=O)c1,0 Z1831398456,Cn(cc1NC(N(CCC2)CCN2S(C)(=O)=O)=O)nc1OC,0 Z2755718889,CN(C)CCCC(C1)OCCN1C(C1(CCCC1)C(O)=O)=O,1 F5490-0210,CC(C)(C)Cc1nnc(C(CCC2)CN2C(c(cc2OC)cc(OC)c2OC)=O)o1,0 Z2262014739,CCc1cc(N[C@@H]2[C@H](CO)CCC2)nc(C)n1,0 Z1974295767,COc(cc1)c(CNC(C(CC2)CCC2C(O)=O)=O)cc1Br,0 F2783-0495,Cc(ccc(NC(C1CCCC1)=O)c1)c1N(CCC1)C1=O,1 Z1271519378,CN(C)c1cccc(CN(C)S(c2cccc(Cl)c2)(=O)=O)c1,0 Z1039182654,CCC(C(N)=O)N(CCC1)CC1c1nc(-c(cc2)ccc2Cl)no1,0 D398-0171,O=C(c1c2ncccn2nc1)N(CCC1)C1c(cc1)ccc1Cl,1 SB16-0817,CCCNC(N1[C@@H](CCN(C2)C(c3cc(C)nn3C)=O)[C@@H]2COCC1)=O,1 V001-3916,CC(C)c1nc(sc2c3CCC(C)C2)c3c(N(CC2)CCN2S(c2ccccc2)(=O)=O)n1,0 F5601-0870,CSc1cc(NC(N(CC2)CCN2c2nc(N3CCOCC3)nc(-n3cncc3)n2)=O)ccc1,1 Z3063544906,CC(c1c(C)[nH]c(C(NCC(C(F)F)n2nccc2)=O)c1C)=O,1 F6512-6294,Cn1cnc(S(N(CCC2)CCN2S(N2CCOCC2)(=O)=O)(=O)=O)c1,1 D074-0321,OCCCN(C(c1c2[nH]nc1-c(cccc1)c1O)c1cc(Oc3ccccc3)ccc1)C2=O,1 Z1563211808,CC(CN1CCC(CN(C)C)CC1)=Cc1ccccc1,0 F2711-2076,CN(C(CN1Cc2ccco2)=C(C(c(cc2)ccc2OC)N2)C1=O)C2=O,0 Z422582738,CC(N1CCN(CCNC(c2cn(Cc3ccccc3)nc2)=O)CC1)=O,1 P207-8868,OC(C(CC1)CCN1c1nc2ccc(-c3cncnc3)nc2s1)=O,1 P621-0551,CCN1c2ncccc2OC(C)(C(NCc(ccc(OC)c2)c2OC)=O)C1=O,0 Z1129185548,CC1N(CCNC(c2nccnc2)=O)CCOC1,0 Z4655554198,Nc(cc1)ncc1C(Nc(cc1)ccc1-n1nc(C(F)(F)F)cc1)=O,1 Z1601829427,CC(C1)OCCC1C(NC(N1)=Nc(cccc2)c2C1=O)=O,1 P681-0351,CN(C(C1(CC2)CN2C(NCCc2ccccc2)=O)=O)c2c1cccc2,0 F6725-2674,Cc1nnc2n1ccnc2NCc1cc(-c2cn(C)nc2)ncc1,1 F6556-4056,CC(C)(C)C(NCC(c1cc(cccc2)c2o1)OC)=O,0 Z1519150914,CC(N(CCCC1)C1C(N(CC1)CCN1c1nccc(OC)c1)=O)=O,1 Z1615169748,O=C(c(cc1)cc2c1ncs2)NC(CCN1c(cc2)cc(Cl)c2Cl)C1=O,1 SC02-0351,Cc1c(C(N(CC2)CC2(CCOC)NS(c2ccccc2)(=O)=O)=O)sc(C)n1,1 F2849-0177,Cc1nc(SCC(N(CC(NC2CCCCC2)=O)C=C2OC)=CC2=O)nc(C)c1,1 F1374-0103,O=C(COc1ccccc1)Nc1nnc(-c(cccc2)c2Cl)o1,0 Y204-1758,O=C(c1cc(-c2cccc(Br)c2)nc2ccccc12)N(CC1)c2c1cccc2,0 F0920-0928,O=C(c(cccc1)c1N1)N(c(cc2)cc(Cl)c2Cl)C1=O,0 F6523-3260,COc(cc1)nc(OC)c1C(NCCN(Cc(cc(cc1)F)c1OC1)C1=O)=O,0 F6660-0843,CCc(cc1)ccc1C(CCc1nc(cccc2)c2[nH]1)=O,1 F2236-1164,CCOc(cc1)ccc1C(C=C1)=NN(CCNC(CN(C=Nc2c3cccc2)C3=O)=O)C1=O,1 F6477-0634,CN(C)S(N(CC1)CCN1c1nc(-c2cscc2)cs1)(=O)=O,1 F5866-0390,Cc1ccnc(Oc(cc2)ccc2C(NCc(cc2)ccc2Cl)=O)n1,1 Z1685121390,C1Oc(cc(cc2)-c3nc(-c4nc(-c5ncc[nH]5)no4)cs3)c2O1,1 F5607-0068,Cc1nccn1-c1cc(NCCNS(Cc2ccccc2)(=O)=O)nc(C)n1,1 F6764-3312,Cc(c(C)nc1ncnn11)c1N1Cc2cc3cccnc3nc2CC1,1 G551-0161,CCCC(c1cccn1CC1)N1C(Nc1cccc(SC)c1)=O,0 F5854-1934,O=S(c(cc1)cc2c1OCCO2)(N(CCc1cccs1)Cc1cnccc1)=O,1 F6785-6695,Cc(nc1cc2)cn1nc2OCC(CC1)CCN1C(C(C=C1)=NN(C)C1=O)=O,1 F6279-0327,O=C(C1CC=CCC1)N(Cc1cscc1)Cc1ccco1,1 G289-0399,Cn1nc(C(Nc(cc2)ccc2-c2ccno2)=O)c(CC2)c1-c1c2scc1,1 F6793-7265,O=C(c(cc1)ccc1N1CCOCC1)N1CCN(CC(F)(F)F)CC1,1 Z2876627849,O=C(CC(c1c2cccc1)=NNC2=O)N(C[C@@H]1CCC2)C[C@]12C(F)(F)F,1 Z1084914196,CC(C)C(N(CCC1)CCN1C(NCc(cc1)ccc1S(C)(=O)=O)=O)=O,1 SA71-1133,O=C(Nc(cccc1)c1F)N(CCC1)CC1(CC1CC1)c1noc(-c2cnccc2)n1,1 Z4407849719,Cn1ncc(C(N2C(Cn3nnc(-c(cc4)ncc4C(O)=O)c3)CCC2)=O)c1,1 E852-0044,CCN(CC)CCCNC(c1nn(CC(C)(C(NC2CCCC2)=O)N(C)C2=O)c2c1)=O,0 F6756-2678,O=C(C(C1)C2CN1C(CCN1CC(F)(F)F)C1=O)N(Cc1ccccc1)C2=O,1 Z352885204,Cc(cc1OC)c(CN(C)C(NCc(cc2)cnc2-n2cncc2)=O)cc1OC,0 F6617-6849,O=C(C1(CCSCC1)N1)N(Cc2cn(Cc(cc3)ccc3Cl)nn2)C1=O,1 F6089-2485,Cn1c(cccc2)c2c(CC(Nc2cc(N(CCC3)C(COC)=O)c3cc2)=O)c1,1 Z2435875598,CCOc(cc1)ccc1NC(CNC(C(C1)C11CCNCC1)=O)=O,1 Z3087209470,Cn(c(C(F)(F)F)c1)nc1NC(C1CCOCC1)=O,1 F3023-0145,O=C(C1C(c(cccc2)c2Cl)NN(Cc2ccccc2)C11)NC1=O,1 E019-0555,CC(C(NCCc(cc1)ccc1SC)=O)N1N=C(C)c(sc2c3cccc2)c3C1=O,0 Z1680009376,CC(C(NCC1)=O)N1C(c1cncnc1)=O,0 Z1627214492,CCC(C)C(C)C(N(CCC1)C1C(NC1CC1)=O)=O,0 E015-0282,CC(c(cc1)cc2c1OCCO2)NC(CCC(N1c(cc(cc2)Cl)c2OCC1)=O)=O,1 F6031-1314,OC(CN1CCN(Cc(cc2)cc(F)c2F)CC1)C1CC1,0 F3320-0954,Cc(c(C)c1)cc2c1ncn2CC(CN(C)c1ccccc1)O,1 Z2489600530,CC(CCN1CCOCC1)NC(c1cc(C(O)=O)ncc1)=O,1 F6573-6279,CS(N(CC1)CCC1C(N(CC1)CCC1(C1)C1(F)F)=O)(=O)=O,0 F1805-0147,Oc1c(C(c2cc(F)ccc2)N(CC(C2)CN34)CC2C4=CC=CC3=O)sc2ncnn12,1 Z3357351768,O=C([C@H](C1)[C@H]2O[C@@H]1[C@H]1[C@@H]2C1)NS(Cc1cccc2ncccc12)(=O)=O,1 F5564-0061,Cc1nc(-n2nccc2)cc(Nc(cc2)ccc2NC(Cc(cc2)ccc2Cl)=O)n1,1 J006-0568,Cc1noc(C)c1C1N(Cc(cc2)cc(CN3CCOCC3)c2OC)CCC1,0 S722-2629,Cc1noc(C)c1S(N1CCC(Cc2ccc(CN3CCCCC3)cc2)CC1)(=O)=O,1 D473-0846,O=C(c(cc1)ccc1N(C(CC1)=O)S1(=O)=O)N(CC1)c2c1cccc2,0 F6517-4118,COc(ccc(Cl)c1)c1NC(NCC(c(cc1)ccc1-c1ccco1)O)=O,0 Z1646108494,Cc(cc1)c(C)cc1S(Cc1nnc(C2CC2)n1C1CC1)(=O)=O,1 Z373022570,C(C(c1ccccc1)c1ccccc1)Nc1ncnc2c1[nH]cn2,1 Z2117259709,OC1(CNC(c2cccc(-c3noc(C(F)(F)F)n3)c2)=O)CCOCC1,0 SC89-0205,Cc1cc(C(N(C2)CC2(C(CN2CCCCC2)CC2)S2(=O)=O)=O)no1,1 F6775-2397,CN(C)c1ccnc(N2CC(COc3nccnc3)CCC2)n1,1 F2323-1567,CCSc(cccc1)c1C(NCCn1ncc2c1N=CN(Cc1ccc(C)cc1)C2=O)=O,1 F6521-3665,CC(CNC(CN(C(CC1)=O)C1=O)=O)(c1cc(cccc2)c2o1)O,0 Z509949578,Cc(cc1)ccc1Oc(cc1)ncc1NC(NCc1c(-n2cncc2)nccc1)=O,1 Z2298757966,CC[C@@H](CC[C@H]1C)CN1C(C(C(C=C1C)=O)=NN1c1ccccc1)=O,1 SA69-0310,CCOc(cc1)ccc1NC(N(CCC1)CC1(C)c1noc(C2CCOCC2)n1)=O,0 Z4423453839,CC(C(F)(F)F)(C(Nc(cc1)ccc1-c1cc(O)ccc1)=O)O,0 Z4581810295,OC(CC(CC1)CCN1C(c1ncc2n1cccc2F)=O)=O,0 F6791-7981,CN1N=C(C(CC2)CCN2c2c3sccc3ncn2)N(C2CC2)C1=O,1 F372-1964,O=C(NC1CCCCC1)N(CC1)c(cc2)c1cc2S(NCc1ncccc1)(=O)=O,1 F6573-9066,O=C(COCc1ccccc1)NCc1cncc(-c2cocc2)c1,1 Z3668062047,O[C@H](C1)C[C@H]1NC(c(cc1)ccc1N(C(C1)=O)N=C1C(F)(F)F)=O,1 F6474-3806,CC1=C(C)N=CN(CC(N(CC2)CCC2Oc2cccc3cccnc23)=O)C1=O,1 SA46-0193,CCn1ncc(C(N(C2)CC2(C2)OCC2N2CCCC2)=O)c1C,1 8015-6650,CN(C(CN1Cc2ccco2)=C(C(c(cc2)ccc2O)N2)C1=O)C2=O,0 Z2984972387,CN(CC(Nc1ccc(cc(cn2)Br)c2n1)=O)C1CCC1,1 F6811-1652,O=C(C=C1)N(Cc2ccccc2)N=C1N(CC1)CCN1c1ncnc2c1nc[nH]2,1 Z2356965514,Cc1c(C(N(CCOc2c3F)c2ccc3F)=O)nnn1C,0 Z1888865846,CC(c1cc(O)ccc1)NC(c1c(Cc2ccccc2)n(C)nc1)=O,0 J004-1573,Cc1noc(C)c1C(CCC1)N1C(c1noc(-c2ccco2)c1)=O,1 Z3575751268,O=C(c1n[nH]c(-c2ccncc2)c1)N(C1CC1)C1CC1,1 Z2475520371,CC[C@H](C)[C@@H](C(N1[C@@H](C2)[C@H]2c2c(C)cccc2)=O)NC1=O,0 Z1496980881,OC(CNS(c1ccccc1)(=O)=O)COc(cc1)cc(F)c1F,0 S427-0031,O=C(CCc1nc(cccc2)c2s1)N1CC(Cc2noc(C3CC3)n2)CCC1,1 Z3637893460,C[C@@H](c1cccc(-c2noc(-c3noc4c3CCCCC4)n2)c1)O,1 F3406-3651,O=S(c1cccn2c(SCc(c(F)ccc3)c3Cl)nnc12)(N1CCCC1)=O,0 Z2947405089,CC(CC1)OCCN1C(Nc(cc1)cc(F)c1-n1nc(C)cc1C)=O,0 SD14-0727,CN([C@@H](CCN(Cc(ccc(OC)c1)c1OC)C1)[C@@H]1C(N(Cc1ccccc1)C1)=O)C1=O,0 S607-0196,CCCS(N(CCC1)C[C@H]1N(c1ncccc1N1CC2CC2)C1=O)(=O)=O,0 S988-0408,CCS(N(C[C@@H]1CN(C2)C(c3cccs3)=O)C[C@@]12c1nc(C)no1)(=O)=O,0 S296-1847,CN(C([C@H]1[C@@H]2CN(Cc(ccc(F)c3)c3F)C1)=O)C2=O,0 Z952602696,CC(C(NCC1CCN(Cc2cccs2)CC1)=O)NC(c1cccs1)=O,1 Y042-7376,N1(C(c2c(C1)cccc2)=O)[C@H](C(NCc1nc2c(n1CCOC)cccc2)=O)C,0 Z2895264577,CC(C)(C)NS(c(cc(c(Cl)c1)Cl)c1Br)(=O)=O,0 S976-1384,O=C(C1(CN(Cc2ccncc2)CCC1)F)N1CCCC1,1 Z2068604310,CCOc1ccc(C(CCC2)N2S(c2c(C)cnn2C)(=O)=O)cc1,0 F6562-4117,CN(C)c1nc(CCC(C2)NC(C3(CCCC3)c3cccs3)=O)c2cn1,1 E975-1306,O=S(c(cc1)cc2c1[nH]c1c2CCCCC1)(NCc1ccco1)=O,1 F6178-0834,O=C(C(NCC(CC1)CCN1c1nccnc1)=O)NCCC1=CCCCC1,1 S900-0091,CN(CC(N1CCOCC1)=O)C([C@H](C1)NC2(CCCC2)c2c1[nH]cn2)=O,1 F6471-6903,O=S(CCc1ccccc1)(NC(CC1)CN1C1CCOCC1)=O,1 Z826155186,O=C(C1CC1)NCc(cc1)cc(F)c1-n1cncc1,0 Z2482792333,OC(c1cc(cc(CN2Cc3ncnn3CC2)cc2)c2o1)=O,1 SB66-0049,Cc1cn(Cc2c(C)onc2C(N(C[C@H]2CCC3)C[C@@H]2NC3=O)=O)nc1,0 G395-1052,Cc1ccc(CN2CC(CNC(CCc3nnc(cc4)n3nc4NCc3cnccc3)=O)CC2)cc1,1 SD69-0501,CC(C)C[C@@H](Cn1nnc(C(N(C)Cc2cn(C)nc2C)=O)c11)NC1=O,0 Z2810335456,CSCC(CCO)NC(N[C@@H]1[C@@H](c(cc2)cc(F)c2Cl)OCC1)=O,0 F6479-4311,Cc1cc(OC(CC2)CCN2C(CN(C=NC(C)=C2C)C2=O)=O)nc(C)n1,1 Z3799777678,CC(C)c1nnc([C@](CC2)([C@@H]2CC2)N2C(c2c(N)n(C(C)C)nc2)=O)o1,0 F5823-0702,CC(Nc(cc1)ccc1S(N1CCC(Cn2nccc2)CC1)(=O)=O)=O,0 F6573-8636,O=C(NCc1cccs1)N(CCN1c(nc2)ncc2F)CC1=O,1 F6443-4974,Cc1cc(C(N(CCC2)CC2(c2c3cccc2)OC3=O)=O)c(C)o1,1 Z1495052543,Cc1nnc(CC2)n1CC2C(NCC1(CCCCC1)c1cccc(C(F)(F)F)c1)=O,1 Z1381365577,CC(C)(c1noc(Cn2nnc3c2cccc3)n1)OC,0 F6782-6754,COC(CN(c(cccc1)c1S(N1Cc(cc2)ccc2F)(=O)=O)C1=O)=O,1 F2960-0039,O=C(c(s1)ccc1Br)Nc(cc1)c2scnc2c1Cl,1 Y020-7047,O=C(CC1NCCNC1=O)Nc(cc1)cc2c1OCCO2,1 Z995325500,O=C1N(Cc(n2-c3cnccc3)nnc2SC2CCCC2)CCCCC1,0 SA17-0025,C[C@@H]([C@H](CC1)C(NCc(cccc2)c2Cl)=O)N(CCOC)C1=O,0 S529-0303,O=C(CN(CCCc1c2cnc(C3CC3)n1)C2=O)NC1CCCCC1,1 SB53-0001,Cc1nnc([C@@H](C2)[C@@H](CN(C)C)CN2S(c2cc(OC)ccc2)(=O)=O)o1,0 Z2654637240,Cc1noc(Cn2ncc(C(NC3CC3)=O)c2)n1,0 Z2964512827,Cc(nc(cc1)-c2cccs2)c1C(N(CC1)C(CCC2)N2C1=O)=O,1 Z3054737210,Cc(c1c2)nsc1ncc2C(NCC1(CC(OC)=O)CCCC1)=O,1 F5854-1718,O=C(c1ccco1)N(CCc1cccs1)Cc1cnccc1,1 Z453584346,Cc(c1c2)nn(C)c1nc(C)c2C(NC(C1CCCC1)c(cc1)ccc1F)=O,1 SC11-0506,Cc1cc(C)nn1CC(N(CCC1)CC1N(CCCN1CCOCC1)C(C1CC1)=O)=O,0 Z2952036546,Oc(c(CNC(Nc1nc(C2CC2)ccc1)=O)ccc1)c1Cl,0 Z2374371008,O=C(C1CC(C2)C2CC1)NS(c(scc1)c1Cl)(=O)=O,0 F3309-4687,CC(N(CC1)CCN1c(oc(-c(cc1)ccc1OC)n1)c1S(c1ccccc1)(=O)=O)=O,0 S988-0122,Cc1noc([C@@](CN(C2)C3CCOCC3)(C3)[C@@H]2CN3C(Cc2cccs2)=O)n1,1 F5496-1468,CN(C(C=C1)=O)N=C1C(N(CC1)CCC1c1nnc(Cc(cc2)ccc2OC)s1)=O,1 Z2963398222,Cc1cnc(C(NC(CO)c2c(C(F)(F)F)cccc2)=O)c(C)c1,0 SB46-0217,O=C([C@H](C[C@H]1CN(C2)C(C3CCOCC3)=O)C[C@@H]1NC2=O)N(CCC1)c2c1cccc2,1 F6809-6037,O=C(c1ccccc1)N(CC1)CCN1c1ccnc2ccccc12,1 Z2209374240,CS(NCC(CCCC1)N1C(c1csc(-c(cc2)ccc2Cl)c1)=O)(=O)=O,1 F6808-6032,N#CC1(CCN(Cc2cccc(C#N)c2)CC1)c1ccccc1,0 F5607-0029,O=C(Cc1noc2c1cccc2)N(CC1)CCN1c1ncnc(-n2cncc2)c1,1 F6559-1117,COc1cc([nH]c(C(N(CC2)CC2n2c(cccc3)c3nc2)=O)c2)c2cc1,1 Z1209816109,CN1CCN(Cc2cccc(CNC(N(CC3)CCC3c3c[nH]c4c3cccn4)=O)c2)CC1,1 F6489-0778,Cc(cc1)nnc1OC(CC1)CN1C(C(CC1=O)CN1c(cc1)ccc1OC)=O,1 F789-2745,CCc1ccc(C(C)NC(C(CCC2)CN2c(cc2)nnc2N2CCC(C)CC2)=O)cc1,0 F5834-0006,CC(C)CCN(c(cc(cc1)NC(C(Oc2c3cccc2)=CC3=O)=O)c1OCC1(C)C)C1=O,1 F6435-1429,CS(C(CC1)CCN1C(c1ncccc1)=O)(=O)=O,0 Z4359046087,O=C(CN(C[C@@H]12)C[C@@H]2[C@H]1NC(c(cc1)ncc1F)=O)N(CC1)Cc2c1cccc2,1 F5871-4155,O=C(c1cccs1)N1CCN(CCNC(Nc2ccc(C(F)(F)F)cc2)=O)CC1,0 5754-2923,CN1N=C(c(cc2)cc(NS(c3ccccc3)(=O)=O)c2N2CCCCC2)c(cccc2)c2C1=O,1 Z2996127797,Cn1nc(C2CC2)cc1S(Nc(c(Cl)ccc1)c1Cl)(=O)=O,0 Z1522926629,CCC(c1c(C)onc1C)NC(c1cc(C)c(C)s1)=O,0 F6550-6069,O=C(CSc(cc1)ccc1F)N(C1)CC1Nc1nnccc1,1 Z3050258251,O=C(c1ccc(CC2CC2)s1)N1C(Cn2nncc2)CCCC1,1 V020-3128,CC(C)c1ccc(CN(CCCN2c(ccc(C)c3)c3NC(Nc3cc(OC)ccc3)=O)C2=O)cc1,0 Z1465680779,COc(cc1)ccc1N(CC(C1)C(NCCc2cc(cccc3)c3[nH]2)=O)C1=O,1 S551-0597,O=C(c1ccco1)NCc1nnc2n1ccc(-c1nc(C3CC3)no1)c2,1 C884-0421,CC(c1ccccc1)NC(Cn1c(C(N(C)N=C2)=O)c2c2c1cccc2)=O,0 F6440-2433,Cn1nc(CNC(c2noc(-c3ccccc3)c2)=O)c2c1CCCC2,1 SB32-0782,CCn1c(ccc(OC)c2)c2c(CN(C[C@@H]2COC)C[C@@H]2c2nc(C3CC3)n[nH]2)c1,1 SD03-0162,CC(C)C(N1CCC(C2)(CN(CC(NCCN3CCOCC3)=O)C2c2nc(C)no2)CC1)=O,1 F6440-3393,Cn1nc(CNC(Nc2cccs2)=O)c2c1CCOC2,1 Z3590544031,Cc1ncc(CSC(N2c3c(C)cc(C)cc3)=Nc(cccc3)c3C2=O)o1,1 G017-1167,CC(C)C(C(NC1CCC(C)CC1)=O)NS(c(cc1)cc(CCC2)c1NC2=O)(=O)=O,0 F184-3487,CCC1Oc2cc(S(N(CCC3)CC3C(NC3CC3)=O)(=O)=O)c(C)cc2NC1=O,1 Z3211240931,O=C(C1(CC1)CN1)N(Cc(cc2)ccc2OC(F)(F)F)C1=O,1 Z30172559,O=C(c1ccc(-c2ccccc2)s1)NCc1cnccc1,0 T955-1082,O=C(c1ccco1)N(CCC1)CC1c1nc(CCOCC2CCOCC2)no1,1 Z806934982,CC(CCC1)CN1C(C)(C)CNC(c1cc(C)n[nH]1)=O,1 Z1411504605,CC(C(NCC1)=O)N1C(NC1=CC=CN(CC(F)(F)F)C1=O)=O,1 F5017-0210,COCCN1CCC(CNS(c2cc(F)ccc2)(=O)=O)CC1,0 F6791-5037,CC(C)(C)c1nc(SC)nc(N2CCN(Cc3cnccc3)CC2)c1,0 F6230-0166,O=C(CSCc1ccccc1)NCc1c(cccc2)n2nc1,1 F6186-0082,CC(CNC(c(cc1)ccc1N(C)C)=O)(CSC)O,0 S976-0166,O=C(C1(CN(Cc2c[nH]nc2-c2cccs2)CCC1)F)N1CCOCC1,1 L010-0465,O=C(c(cc1)ccc1-c1ncnc(NC2CCCCC2)c1)NCCN1CCCCC1,1 F6414-2501,CSc1ccc(C(CNC(Nc2c(C(F)(F)F)cccc2)=O)O)cc1,0 SA23-1172,CN(C)C[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1cc(F)cc(F)c1)=O,0 F926-0577,CCOc(cc1)ccc1NC(c1cccc(C(CCC2)CN2C(Nc(cc2)ccc2Cl)=O)c1)=O,0 T408-1903,CN(C)C(c1cc(CC(CC2)C(Nc(cc3)ccc3N3CCOCC3)=O)c2s1)=O,1 S039-3703,Cc1c(CN(CC2)CCC(N=C(N3)N4CCN(C)CC4)=C2C3=O)scn1,1 Z1743861380,OC(C1)C2(CC2)CN1c(s1)nn2c1nc(-c(cc1)ccc1F)c2,1 F6764-2020,C(C1COCC1)N(CC1)CCC1c1nc2ncc(C3CC3)cc2cc1,1 Z1551830209,OCC(N1C(CNC(c2ccccc2)=O)CCCC1)=O,0 Z1174580979,O=C(CC(F)(F)F)NCc1nncn1C1CC1,1 G242-0486,Cc1c(C(N2CCCCC2)=O)c(S(N(CC2)CCN2C2CCCCC2)(=O)=O)c(C)[nH]1,0 F1899-2232,O=C(CSc(cc1)nnc1-n1nccc1)N(CC1)c2c1cccc2,1 F2890-0122,CSc(cccc1)c1NC(C(CCC1)N1S(c(s1)ccc1Cl)(=O)=O)=O,1 V005-9004,COc(ccc(S(NCCCN1CCOCC1)(=O)=O)c1)c1N(CC1)CCN1C(C1(CCCC1)c(cc1)ccc1Cl)=O,1 F5228-3037,O=C(CN(C=NC(c(cc1)ccc1Cl)=C1)C1=O)NCc(cccc1)c1OC(F)(F)F,1 C796-0367,Cc1ccc(CN(Cc2cccn2-c2nnc(N(CCC3)C3=O)s2)C(Nc2c(C)ccc(C)c2)=O)cc1,0 F6521-4797,CSCCC(CNC(C1(CCOCC1)c1ccccc1)=O)O,0 Z2475570955,CC(Cc1cccc(Cl)c1)(CCC1)N1C(c1cc2ccncc2nc1)=O,1 Z2285259523,CC(CN(C1)C(c2cccn2Cc2ccccc2)=O)NC1=O,1 Z1251606038,CC(COCC1C)N1C(c1csc(-c2cn(-c3ccccc3)nc2)n1)=O,1 S632-3235,Cc(ccc(F)c1)c1S(N(CC1)CCC1C1CNCC1)(=O)=O,0 SC88-0658,Cc1ccc(CN(C2)CC2(C(CC2)c3nc(-c(cc4)ccc4F)no3)S2(=O)=O)o1,1 Z3519076384,NC(CCC1)c(cc2)c1cc2C(NC[C@@]1(CO)N(CCC2)[C@H]2COC1)=O,1 V018-8269,CC(C1=O)N(Cc2c(C)cccc2)CCN1c(ccc(F)c1)c1F,0 S694-0874,CCn1ncc(C(N(CC2)CC2n2c(C3CC3)ncc2C)=O)c1,1 F6786-6010,Cn1nc(C(N2CC(COc3nnc(C4CC4)cc3)CC2)=O)c2c1cccc2,1 S213-1298,CCCN(CC1COCC1)S(c1cc(CCCC2)c2cc1)(=O)=O,1 Z1488212203,CC(C)c1ncc(C(NCC2(CO)CCOCC2)=O)s1,1 V028-6100,O=C(Nc1c(-c2cccc(Cl)c2)[nH]nc1C1CC1)Nc(ccc(F)c1)c1F,0 V016-9133,CC(C)N(CC(Cc1ccccc1)O)CC(N1)=Nc(scc2-c(cc3)ccc3OC)c2C1=O,0 S727-0637,CCn1ncc(C(N(C2)CC2n2nnc(COc(cc3)ccc3F)c2)=O)c1C,0 Z3071621076,Cc1ccc(-c2n[nH]c(C(N[C@](C3)(C[C@H]3O)C(O)=O)=O)c2)o1,1 F6259-1406,Cc1cccn2c1nc(-c1cccc(NC(C(CC3)CCN3C(C=C3)=NN(C)C3=O)=O)c1)c2,1 F3406-9618,O=C(CN(C(N1C=C2)=O)N=C1N=C2Nc(cc1)ccc1F)N(CCC1)c2c1cccc2,1 Z2220183143,CN(CCN(C1)C(C(CCc2ccc3)c2c3OC)=O)c2c1cccc2,1 Y044-5597,O=C(Nc(cc1)cc2c1OCCCO2)N(CCCC1)C1c1nc(cccc2)c2[nH]1,1 Z1951538826,CC(CC(Nc1cc(N2CCCC2)ccc1)=O)NC(c(cc(cc1)F)c1-n1nccc1)=O,1 Z166762754,O=C(CCN(C=Nc1c2c(CCCC3)c3s1)C2=O)N(CCC1)C1c(cc1)cc2c1OCCO2,1 F6480-1206,Cc(n(-c1ccccc1)nc1)c1C(N(CCC1)CC1Oc(ccnc1)c1Cl)=O,1 CM1461-1616,Cn1nc(CN2CCOCC2)c(C2)c1CCN2C1CCCC1,1 F6676-2440,CN(C(CC1)CCN1C(CN(C(CC1)=O)C1=O)=O)c1ncccc1,1 Z1365519136,Cc1noc(C)c1CCC(NCc1ccc(C(O)=O)o1)=O,1 SC89-0444,CN1CCN(CC(CC2)C(C3)(CN3C(C3CCCC3)=O)S2(=O)=O)CC1,1 F3411-6213,COc1c(CN(C(N2c3c4scc3)=NN(Cc(c(F)ccc3)c3Cl)C2=O)C4=O)cccc1,1 Y031-3480,O=C(CS(c1ccccc1)(=O)=O)Nc(cc1)ccc1S(N(CCC1)c2c1cccc2)(=O)=O,1 Z2973808847,C=C(CNC(N[C@@H]1c(cccc2)c2OC[C@@H]1CO)=O)c1ccccc1,1 V025-6879,CCCN(Cc(cc(cc1)NC(C2CCC2)=O)c1N(C)C)C(C(CC)c1ccccc1)=O,1 S615-0473,O=C(c(cccc1)c1F)N(CC1)CC1c1nc(CCOCC2CCCC2)no1,1 F6573-4179,O=C(COc(cc1)ccc1F)NCCOCCN(C(CC1)=O)C1=O,0 F6451-2720,COC(CNC(c(cc1)cc2c1ncs2)=O)c(cccc1)c1Cl,0 Z2644636314,N#CC(CCCC1)C1NC(c1ccc(F)s1)=O,0 Z1633439439,COc(cccc1)c1OCC(N(C1)CC11CCCCC1)=O,1 4554-3473,Cc(n(C(C(CCC1)N1S(c1ccccc1)(=O)=O)=O)nc1C)c1Sc1ccccc1,1 F6549-8575,O=C(Cn(cc1)c2c1cccc2)N(C(CC1)C2)C1CC2Oc1cnccc1,1 P271-0532,CCc1c(CC)nc2ncc(N(CCC3)CC3C(N(C)Cc3ccco3)=O)cc2n1,1 V030-9793,CC(C)CN(CC(c1ccccc1)O)Cc1cccc(OC)c1,0 Z2987481162,COc1c(CC(Nc2noc3c2CCCC3)=O)cccc1,0 Y042-3793,Cc1nnc(NC(C(C2)CN(Cc(cc3)ccc3Cl)C2=O)=O)s1,1 Z2655926377,CC1(C(C2CC2)OCC1)NC(c(cc1)ccc1OCC(O)=O)=O,1 F5854-4279,CCOc(ccc(S(N(Cc1cscc1)C1CC1)(=O)=O)c1)c1F,1 SB21-0184,CC(C)NC(c1cn(C[C@H](C2)N(CC3CCCCC3)C[C@H]2F)nn1)=O,1 F5014-0327,COc(cc1)nn2c1nc(-c(cc1)ccc1NC(c(c(F)ccc1)c1Cl)=O)c2,1 Y032-4230,O=C(C(CC1=O)CN1c1ccccc1)Nc1cc(CCC2)c2cc1,0 F0696-4242,N#Cc(ccc(Cl)c1)c1NC(c(cc1)nnc1N1CCCCC1)=O,0 F1318-0229,Cc(ccc(NC(N(C)c1ccccc1)=O)c1)c1Cl,0 Z2042949405,O=C(C(CC1)c(cccc2)c2S1(=O)=O)NC1(CCCC1)c(cc1)ccc1Br,0 F5596-1252,Fc1cc(CN(CC2)CCC2c2nnc(C3CC3)o2)ccc1,0 SB91-0326,O=C(C1CC1)N(CCN1CCCCC1)C(CC1)CN1S(N1CCOCC1)(=O)=O,1 F400-0689,Cc(cc1)cc2c1n(Cc(ccc(F)c1)c1Cl)c1c2N=CN(CCc(cc2)cc(OC)c2OC)C1=O,0 Z850977232,CC(C)CN(CC(C)C)C(Cn1nncc1)=O,0 Z3686870762,Cc1cc(CNC(c2nc(N(CC3)C[C@@H]3N(C)C)c(C)c(C)n2)=O)no1,0 Z1039070116,CC(c(cccc1)c1Cl)N(CC1)CCN1c1ncnc2c1cc[nH]2,0 Z1609495152,CC(C)(CCC1)CN1C(Cc1cccc(C(O)=O)c1)=O,0 F5597-0223,O=S(C1CC1)(N(CC1)CCC1c1nnc(C2CC2)o1)=O,1 Z1958803891,CC(C)(C)c1nnc(cc2)n1nc2N1CC(C)(C)OC2(COCC2)C1,0 Z1580808230,CCn1nc(C)c(NC(N(CC2)CCN2c2ncccn2)=O)c1C,0 F5854-4023,Cn1c(CN(C2CC2)C(Nc(c(F)ccc2)c2F)=O)ccc1,0 Z1939438993,Cn1c2ncnc(C(OC)=O)c2c(Br)c1,0 F6454-2799,Cn1nnc(C(NCC(CC2)CCN2C2CCSCC2)=O)c1,1 Z2067391041,Cc(cnn1C)c1S(Nc1cccc(Cl)c1N(C)C)(=O)=O,0 F6031-1861,CC(C)(C)NC(N1CCN(CC(c2ccco2)O)CC1)=O,1 F5857-3133,CC(CNC(c1c(C(F)(F)F)cccc1)=O)(c(cc1)cc2c1OCO2)O,0 Z2407054841,CC(C)(C)n1ncc(C(Nc(cc2)ccc2NC(CN(C)C)=O)=O)c1N,0 Z1407872149,CC(C(N1c(c(C)nn2C)c2OCC1)=O)Oc(ccc(Cl)c1)c1Cl,0 F9995-2687,CCc(cc1)ccc1NC(N(CC1)CC=C1c1c[nH]c2c1cccc2)=O,1 6225-0880,Cc1c(C(c(cccc2)c2N2CCCc3ccccc3)(C2=O)O)c(cccc2)c2[nH]1,1 Y031-0552,O=C(Cc(cc1)ccc1Br)Nc(cc1)ccc1S(NCC1OCCC1)(=O)=O,1 SC96-0847,COCCCN(C1(COCC1)CN(CC1)C(Cc2cccs2)=O)C1=O,1 SB95-1345,CS(N(CCN1CCOCC1)C1CN(CCCc2ccccc2)CCC1)(=O)=O,1 F6513-5980,Cc(cc(cc1)F)c1S(NCc1c(CCCC2)n2nc1)(=O)=O,0 G368-0050,O=C(Nc1cccc(C(F)(F)F)c1)N(CC1)CCC1(N1)Oc(cccc2)c2C1=O,0 Z1725103866,CC(C(N(C)C[C@H]1OCCC1)=O)Oc1cnccc1,1 SB13-0318,COCCN([C@@H]([C@H](CC1)C(NCCc(cc2)ccc2Cl)=O)c(cc2)ccc2F)C1=O,1 Z3698522408,NCCc1cc(C(N2[C@H](COc(cc3)ccc3F)CCC2)=O)no1,1 K666-0129,Cc1cc(N(CC2)CCN2S(c2cccc3nonc23)(=O)=O)c(C)cc1,0 F5658-0142,CCOC(c(cc1)ccc1NC(COc1cc(C(CC2)=O)c2cc1)=O)=O,0 Z1277983604,CN(C=CC=C1NC(NCC2CN(Cc3ccccc3)CCC2)=O)C1=O,1 F6212-0408,COC(C1(CCCC1)NC(c1c2OCCCn2nc1)=O)=O,0 Z31216533,O=C1N(c2ccccc2)N=CC(NCc2cnccc2)=C1Cl,1 L008-0007,CCCNC(c(cc1)ccc1-c(cc1)nnc1N1CCCC1)=O,1 Z1155307273,C[C@@H](C(N1CCCCC1)=O)NC(Cc1nn(-c2ccccc2)nc1)=O,1 Z613170010,Cc(s1)ccc1S(NC(Cc(cc1)ccc1Br)=O)(=O)=O,0 F6809-6051,O=C(c1ccccc1)N(CC1)CCN1c(ncc(Cl)c1)c1Cl,0 Z2960215038,CCn1ncc(C(C)NC(c2cc(c(C)ccc3)c3o2)=O)c1,0 E864-0148,Cc1ccc(C(c2c(CC3)c(cccc4)c4[nH]2)N3C(NC2CCCC2)=O)cc1,0 F6518-4367,O=C(c1cnc(C(F)(F)F)cc1)N(CC1)CC1c(cc1)cc2c1OCO2,1 Z2368193907,Cc(c(C#N)c1)nc(N(CC2)C[C@@H]2N)c1Cl,0 F6573-4450,O=C(c(ccnc1)c1F)NCCOCCN(C(CC1)=O)C1=O,1 F6573-8668,O=C(CN(CC1)S(CCc2ccccc2)(=O)=O)N1c(nc1)ncc1F,1 F6441-6857,Cc(n(C)nc1C)c1S(N(CC1)CCC1S(c(cc1)ccc1OC)(=O)=O)(=O)=O,1 F5030-0129,Cc(cc1NC(C(CC2=O)CN2c2ccccc2)=O)nn1-c1nc(-c2ccccc2)cs1,1 Y300-0533,CC(C)(CC1NC(C(CC2)CCN2S(N(C)C)(=O)=O)=O)Oc2c1cccc2,0 F6805-9092,Clc(cncc1)c1OCC1CCN(Cc2cncs2)CC1,0 Z1171735806,O=C(CN(C=C(C=C1)Br)C1=O)NCCc1nc(C2CCCCC2)cs1,0 V028-2784,O=C(c1ccccc1)N(Cc(n1CC2OCCC2)cnc1S(Cc(cc1)ccc1F)(=O)=O)Cc1ccco1,0 C130-0360,COc(ccc(-c1cc(C(F)(F)F)nc(N2CCN(Cc3ccccc3)CC2)n1)c1)c1OC,0 ZC43-0159,OC(c1cc(C(N(CC2)C(C(CC3)CCN3C(c3c[nH]nc3)=O)c3c2nc[nH]3)=O)ccc1)=O,1 J107-0848,CN(c(cccc1)c1C(C(NC(CCC1)c2c1c(cccc1)c1[nH]2)=O)=C1)C1=O,0 SA93-0068,CC(CCC1)(CN1C(c1ncc(C)nc1)=O)C(N)=O,0 Z2966749646,C[C@@H](C(NCCC1)=O)N1C(c1cc(Cl)c2OCCOc2c1)=O,1 Z1765537698,OCC(CC(C1)F)N1c1nnc(C(F)(F)F)cc1,0 Z3216016174,CCC(C)(C1)CN1S(Cc1nn(C)cc1Br)(=O)=O,1 Z1455177864,OC(C(CCC1)N1C(c1cn(-c2cccc(C(F)(F)F)c2)nn1)=O)=O,0 8015-0884,COc(cc1)ccc1-c1csc(N(CC2)CCN2c2nc(-c3ccccc3)cs2)n1,0 F6516-0589,CCC(C(NCc1ccc(-c2ccco2)o1)=O)c1ccccc1,0 Z1269222120,Nc(c1ccccc11)ncc1Br,0 F6089-7292,Cn1c(cccc2)c2c(CC(NCC2(CCCC2)c(cc2)ccc2OC)=O)c1,1 F6725-1661,CN(C=CN=C1NCc2cn(-c3cccs3)nn2)C1=O,1 F5669-0400,Cc(c(NC(N(CC1)CCN1c1ncnc(N2CCCC2)c1)=O)ccc1)c1Cl,0 F3406-6571,CCOc(cc1)ccc1Nc(nccc1)c1S(NC)(=O)=O,0 Y040-2283,Oc(cc1)c(CN2CCOCC2)c(O2)c1C(CCCC1)=C1C2=O,1 Z2454295698,CC(C)(C)C(NCCCc1nn(C)cn1)=O,0 F6678-9859,O=C(C1CC=CCC1)N(C1)CC1n1c(cccc2)c2nc1C1CC1,1 8017-9568,O=C(CC(C1=O)N(CC2)CCN2c2c(ccc(Cl)c3)c3ncc2)N1c(cc1)ccc1F,0 C470-0494,CN(c1c(C(N2C)=O)n(CC(c3ccccc3)=O)c(CN(CC3)CCN3c3cccc(Cl)c3)n1)C2=O,1 Z1741834383,OC(CC1)CCN1C(N=CN1)=CC1=O,0 F3406-4436,Cc1nc(-c2ncccc2)cc(SCC(Nc(cc2)cc(Cl)c2F)=O)n1,0 Z1991809789,CC(CC1c(cccc2)c2F)CN1C(CCc(cccc1)c1C(O)=O)=O,0 Z2903975075,CN(C(CCC1)C(N(CC2)CCN2c(cccc2)c2Cl)=O)C1=O,0 Z991897032,C(CN(C1)c2ncnc3c2cc[nH]3)c2c1cccc2,0 F6448-1874,Cc1c(C(Nc2cn(C3CCOCC3)nc2)=O)scn1,1 P223-0965,CN(CCCn1nc(C(CCC2)CN2S(c2cccs2)(=O)=O)cc11)C1=O,1 F2106-0210,CCOC(c(oc(cc1)c2cc1Br)c2N)=O,0 T422-0632,O=C(CCC(CC1)CCN1c1ncnc(NC2CC2)c1)NCc1cc(F)cc(F)c1,1 F3382-7936,CSc(cc1)ccc1-c1noc(CN(C(C=C2)=O)N=C2c(cccc2)c2Br)n1,0 Z2224470831,CN(C([C@@H](C1)[C@H]1C1CC1)=O)c1nncs1,1 F6563-0542,O=S(c1c(C(F)(F)F)cccc1)(N(CC1)CCC1Oc1cscc1)=O,0 8018-1509,CC(C1)N(CC(COc(cc2)ccc2-c2ccccc2)O)c2c1cccc2,1 Z2615654607,CC(C1(CC1)Nc1nc2cccc(F)c2s1)O,1 F6559-1409,O=C(c1ccc(Cn2cncc2)cc1)NC(CC1)CCC1(F)F,1 Z1989787766,CC(NCC(CCC1)CN1c1c(ccc(OC)c2F)c2ncn1)=O,0 F2515-3945,Cc(n(-c1ccccc1)nc1)c1C(N(Cc1cnccc1)c1nc(c(F)ccc2)c2s1)=O,1 F6523-0200,Cc1nc(C(F)(F)F)cc(N(CC2)CCC2NC(c(cn2)cc(Cl)c2O)=O)n1,0 Z2014379109,CCc1n[nH]c(C(N2CC(C)C2)=O)c1Br,0 Z2792081332,CC(C)C(C(O)=O)N(Cc1ncccc1)C(C)=O,0 M676-0540,CC(C)CC(N(CCC1)CC1c1nc(CNC(C2CC2)=O)cs1)=O,1 L218-0085,O=C(CN(c(cccc1)c1N12)C2=NC(c(cc2)ccc2Cl)=CC1=O)NC1CCCC1,1 S976-1010,O=C(C(CCC1)(CN1S(c(cc1)ccc1F)(=O)=O)F)N1CCOCC1,0 Z647398406,Cc1noc(CCCC(Nc(cc2)cc(CC3)c2NC3=O)=O)n1,1 F6764-3304,C(C1)c2nc3ncccc3cc2CN1c1nc(cccc2)c2o1,1 Z2936909905,CCn1ncc(S(N(CC2)CCC2c2ncccn2)(=O)=O)c1,1 F0666-0598,O=C(CCc1ccccc1)Nc1c(C(Nc(cccc2)c2F)=O)oc2c1cccc2,1 F5833-3612,CC1Oc(cccc2)c2OC1C(Nc1cc(N(CCC2)S(c(cc3)ccc3F)(=O)=O)c2cc1)=O,1 V008-6024,O=C(C1CCCCC1)Nc(cc1)ccc1-c1nc(-c(cc2)cc3c2OCCO3)ccc1,1 SA49-0130,Cc(ccnc1)c1C(N(C1)CC11OCC(CC(NCC2CC2)=O)C1)=O,0 F6672-1352,Cn1ncnc1CN(C(CC1)C2)C1CC2n1ncc(Cl)c1,1 F6435-9490,COC(CSC(CC1)CN1S(c(cc(cc1)Cl)c1OC)(=O)=O)=O,0 Z2768171892,Cc1cc(Br)cc2cccnc12,0 F6494-4842,CCOc(nccc1)c1C(N(CC1)CCN1C(C(c1ccccc1)=NN1)=CC1=O)=O,1 S545-0302,COc1ccc(C2(CC2)C(N(CCCCC2)C2c2nc(C3CC3)no2)=O)cc1,0 F6508-1214,O=C(c1cocc1)NCC(c1ccco1)c1cccs1,1 F6517-0032,Cc1cc(C(NCC(c2ccc(-c3ccco3)o2)O)=O)c(C)o1,1 D074-0271,CSc1ccc(C(c2c3[nH]nc2-c(cccc2)c2O)N(CCc2ccccc2)C3=O)cc1,0 F5543-0102,CC(C)(C)NC(Nc(cc1)cc2c1Oc(ccc(C)c1)c1NC2=O)=O,0 F6681-3382,O=C(N1CC(COc2cnccc2)C1)N1CCOCC1,1 Z2700192129,O=S(N(CC1)C2C1CCNC2)(N1CCCCCC1)=O,1 K061-0005,CC(c(ccc(NC(c1nn2c(C(F)(F)F)cc(-c3cccs3)nc2c1)=O)c1)c1O1)=CC1=O,1 D563-0162,Cc(cc1)ccc1S(c1csc(C(C2)c(cc3)cc(OC)c3OCC(N)=O)c1NC2=O)(=O)=O,0 F6473-7715,CC(O1)=CC(OC(CC2)CN2C(c2cc(cccc3)c3[nH]2)=O)=CC1=O,1 F6754-9287,Cc1cc(NCCc(cc2)ccc2OC)nc(C2CC2)n1,0 Z2182370843,OC(C1)(CN1C(NC1CCN(Cc2ccncc2)CC1)=O)c(cc1)ccc1F,1 F3406-0075,O=C(C(CCC1)CN1c(cc1)nnc1Sc(cc1)ccc1Br)NCc1cnccc1,1 Z1581070942,Cn(cc1C(NC2c(cccc3)c3OC3(CCN(C)CC3)C2)=O)nc1-c1ccccc1,0 SD61-0535,O=C(CC1CCCC1)N(C1)CC2(CCC2)C1C(NCc1ccncc1)=O,1 P180-0521,O=C(c1n[nH]c2c1cccc2)Nc1c(-c2nnc(C3CC3)o2)scc1,1 Z1971423972,CC(C)c1nn(C)cc1NC(N(CC1)CC(C)CS1(=O)=O)=O,0 F6489-2008,Cc1noc(C)c1C(N(CC1)CC1Oc(cc1)nnc1N(C)C)=O,1 F6204-0940,CC(C)Sc1ccc(CC(NC2(CCOCC2)c2cccs2)=O)cc1,1 Z4135998400,CC(C1)c(cc(cc2)NS(c3cccc(Cl)c3F)(=O)=O)c2N(C)C1=O,0 S984-1169,CCC(CC)C(N(C[C@H]1CN(C2)C(c3ccccc3)=O)C[C@]12C(N(C)C)=O)=O,0 F5074-0661,Cn1nccc1-c1nnc(NC(C2(CC(C3)C4)CC4CC3C2)=O)o1,1 F3023-0203,COc(ccc(CCN(C(C(C12)C3OC2C=C3)=O)C1=O)c1)c1OC,1 F6485-2032,Cc1nc(OC(CC2)CCC2NC(C(c2ccccc2)O)=O)nc(C)c1,1 Z2627914614,OC(COc1cccc(C(N(CC2)C[C@H]2OC(F)F)=O)c1)=O,0 F6374-0179,CC(C)S(c1ccc(CC(N2CCC(CSc3ncccc3)CC2)=O)cc1)(=O)=O,0 F2545-0177,CCN(C(CC1)CS1(=O)=O)C(c(c(F)ccc1)c1F)=O,0 Z1568877718,Cc1c(CN2CC(COC)CCC2)c(C)nn1-c(cc1)ccc1F,0 F6529-1037,CN(C(C(F)(F)F)=NN1C(CC2)CCN2C(c(cc(s2)Cl)c2Cl)=O)C1=O,1 Z3590696339,C[C@@H](c1cnccc1)N(C)C(Cn1nc(C#N)nc1)=O,1 Z2042354924,CC(N(CC1)CCc2c1ccc(S(N(CC1c3ccccc3)c3c1cccc3)(=O)=O)c2)=O,1 Z2370705628,CNC(C(CC1)CN1S(c(scc1)c1Cl)(=O)=O)=O,0 Z4020179346,O=C(C(C1)COc2c1ccc(F)c2)Nc1cc(F)ccc1,0 SB24-0476,Cc1cc(C(N(CC2)CCC2(CC2)C2n2nnc(C(N3CCOCC3)=O)c2)=O)c(C)o1,0 F3097-6306,Cc(cc(c(OC)c1)NC(c2cccs2)=O)c1Cl,0 F6812-1341,Cc(c(C)nc1ncnn11)c1N(CC1)CCN1c1nc(-c2ncccc2)ccn1,1 F5658-0056,O=C(COc1cc(C(CC2)=O)c2cc1)Nc1cnccc1,1 F6524-5770,O=C(c1cc(-n2nccc2)ccc1)NCc1nnc2n1ccc(C(F)(F)F)c2,1 Z1360498451,Cn1nccc1C(CC1)CCN1C(CCC1COCC1)=O,1 F6789-6693,Cc1nc(Nc(cc2OC)cc(OC)c2OC)cc(C2CCOCC2)n1,0 F6414-2047,CSc1ccc(C(CNC(Cc(cc2)ccc2F)=O)O)cc1,0 Z1521853837,CC(C)CC(N(CC1)CCC1NC(C(N1C)=CC=CC1=O)=O)=O,1 Z3522872095,O=C(C1=CN=C(C2CCC2)NC1=O)N(CCOC1)CC11NCCOC1,1 F6451-2722,COC(CNC(c(cc1)ccc1C(OC)=O)=O)c(cccc1)c1Cl,0 Z2898205201,OC([C@@H](CCCC1)N1C(C(CC1)Cn2c1ncc2)=O)=O,1 Z3504298474,O=C(CC1OCCC1)N(C(Cc1ccccc1)CC1)S1(=O)=O,1 F5033-0905,O=C(c1cc(C(F)(F)F)ccc1)NCC1CCN(Cc2cccs2)CC1,0 F6518-4488,Cn1ncc(S(N(CC2)CC2c(cc2)cc3c2OCO3)(=O)=O)c1,1 SA46-2254,CN(Cc1ccccc1)C1COC(C2)(CN2C(c2ccc(Cn3cncc3)o2)=O)C1,1 Z4884575299,N#Cc1cc(Br)cc(S(NC(Cc2ccc(C3CCC3)cc2)=O)(=O)=O)c1,1 F588-0081,Cc(n(Cc(cc1)ccc1Cl)c1c2cccc1)c2C(CC1)=CCN1S(c(cc1)cc2c1OCCO2)(=O)=O,1 SC98-0209,CC(C)n(c(CC1)c2CN1C(COc(cc1)ccc1F)=O)nc2-c1ncc(C)o1,1 F6773-4131,Cc1nnc(N(CC2)CCC2Oc2nc3ccnn3cc2)s1,1 Z2185545514,CC(C)c1ccc(CN(CC2)CCN2C(c2nn(C(C)(C)C)cn2)=O)cc1,1 Z2768199980,CN(Cc1cc(F)cnc1)[C@@H](CCC1)[C@H]1O,1 Z3235502354,CCOc(c(C)c1)cc(C)c1S(Nc(cc1)ccc1C(C)=O)(=O)=O,0 Z2607580473,OC(COc(cc1)ccc1C(N(CC1)CCN1C(NC1CCCCC1)=O)=O)=O,1 SA65-1265,CC(C)n1ncc(CN2CCC(CCc3noc(C4CCOCC4)n3)CC2)c1,0 S971-1115,CCn1nccc1C(N(CC1)CCC1(CC1)C1O)=O,1 V021-4571,O=C(N(Cc1cc(C(F)(F)F)ccc1)CCC1)N1c1cccc(NS(c(cc2)ccc2F)(=O)=O)c1,0 F6786-5951,O=S(N1CCCC1)(N1CC(COc2nnc(C3CC3)cc2)CC1)=O,1 S694-2126,Cc1cnc(COC)n1C(CC1)CN1C(Cc1c[nH]c2c1cccc2)=O,1 F6412-1819,CN(C)S(c(cc1)ccc1C(NCC#CCOc1cc(C(F)(F)F)ccc1)=O)(=O)=O,0 S836-2227,CNC([C@@H](C1)[C@@H](COC)CN1C(CN(c(cccc1)c1O1)C1=O)=O)=O,1 Z2965085036,OCC(CC1)N1C(c1cc(COCC2)c2s1)=O,1 Z1368052248,Cc1c(C(N2CCN(CC(NC3CC3)=O)CC2)=O)nc(-c2cn(C)nc2)o1,1 Z2120309942,CN(C(CC1)C(Nc(cc2)nn2-c(nccc2)c2Cl)=O)C1=O,1 Z3868523974,Cc(nc1)nc(C(N(CCc2ccc3)Cc2c3SC)=O)c1Br,0 F6515-2784,Cc(cc1)c(C)cc1N(CC(C1)C(N(C(CC2)C3)C2CC3n2nccn2)=O)C1=O,1 F6445-3047,Cc1nn(cc(CCCNC(c2cc3nn(C)c(OC)c3cc2)=O)cn2)c2c1,1 Z1903503552,OC1(Cc(cccc2)c2F)CCN(CC(NC(c2nccs2)c2ccccc2)=O)CC1,1 Z1907551129,Cc(ccc(NC(c1cnc[nH]1)=O)c1)c1C(N1CCOCC1)=O,1 V008-4472,Cc1c(CN(CCN2CCOCC2)CC(COc(cc2)ccc2OC)O)cccc1,0 Z740877914,CC(C)N(CC1CC1)S(c1csc(C(O)=O)c1)(=O)=O,0 F3406-6294,O=C(C(CC1)CCN1c1ncnc(Oc2ccccc2)c1)N(CC1)CCN1c(cccc1)c1Cl,1 F6064-2322,O=C(CSc(cc1)ccc1F)N(C1)CC1c1nc(-c2nccnc2)no1,1 F6806-7561,O=C(CN(CCC1)CC1C(N(CC1)CCC1(F)F)=O)NCc1ccco1,1 Z2228880530,O=C(c(cc1)nc(N2)c1OC2=O)N1CCC(COc2ccccc2)CC1,1 7472-0012,O=C(CSc1nc2ccccc2nc1N1CCCC1)N(CC1)CCN1c1ccccc1,1 Z2962767714,CC(C)C(c1cn(C)nc1)NC(c1c(CCC2)n2nc1)=O,1 Y300-1080,CCN(Cc1nc(-c2cccs2)no1)C(C(CCC1)CN1S(CC)(=O)=O)=O,0 J095-0263,CC(NC1=O)=Nc(n2C)c1nc2SCC(N(CCC1)c2c1cccc2)=O,1 Z608066394,O=S(c1c[nH]nc1)(NC1CCOCC1)=O,0 SC74-0566,CN(C)C([C@H](C[C@H]1c2nc(-c3ccccc3)no2)C[C@@H]1NC(c1ccccc1)=O)=O,0 Z1276906975,O=C(Nc(cccc1)c1N1CCCC1)N(CC1)CC11CCOCC1,1 Z4574658811,CC(CCO)N(CC1)CCC1(C)c(cc1)ccc1Br,0 V011-9299,CC(CC1)CCN1c(ccc(NC(Nc1ccc(C(F)(F)F)cc1)=O)c1)c1C(NCCc1ccccc1)=O,1 Z1284859846,Cn1c(CNC(N2C(Cc3cccc(F)c3)CCC2)=O)ccc1,1 F6617-2762,O=C(C1CCCCC1)N(CC1)CCC1c1nc(cccc2)c2[nH]1,1 F6444-6680,O=C(NCc1cccs1)N(C1)Cc2c1cnc(N1CCOCC1)n2,1 Z239128462,OC(c(cc1)ccc1NC(c1cnccc1)=O)=O,0 V012-7820,CCCc1nc(N(CC2)CCN2C(Nc2c(C)cc(C)cc2)=O)c(c(-c2cccc(C(F)(F)F)c2)no2)c2n1,1 F6709-0183,CCc(cn1)cnc1OC(CC1)CCN1S(CC(C)C)(=O)=O,0 Z2800792131,CCC(C)(C)C(C(NC(CC1)CCC1Oc(cc1)ncc1C#N)=O)O,0 SB24-0566,CCCNC(N(CC1)CCC1(CC1)C1n1nnc(C(NCC(C)C)=O)c1)=O,0 F2044-0009,O=C(c(cc1)ccc1N(CCCC1)S1(=O)=O)Nc(cc1)cc(C(F)(F)F)c1F,0 S932-2980,Cn1nc(C(N(CC2)CC2n2nnc(COCC3CC3)c2)=O)c2c1cccc2,1 8019-0041,O=C(CC1c(cc2)ccc2OCCc2ccccc2)Nc2c1scc2,0 F6378-0323,CS(N(CC1)CCN1C(C(COC1)N(Cc2cccs2)C1=O)=O)(=O)=O,1 Z1551625851,O=C(c1cnc(-c2ccccc2)nc1)N(CCC1)C1C(CCC1)C1=O,1 F6043-1987,Cc(n(C(CC1)CS1(=O)=O)nc1C)c1N1CCN(CC(NCC2OCCC2)=O)CC1,1 F5126-0765,CC(C)C(Nc(cc1)nnc1SCCN1CCOCC1)=O,1 F2708-0153,CCS(c(cccc1)c1C(Nc(sc1c(cc2)Cl)nc1c2OC)=O)(=O)=O,0 S651-1416,Cc1noc(C)c1C(N1CCC(C2)(CN(C)C2C(N2CCN(C)CC2)=O)CC1)=O,1 F6482-3234,O=C(CCc(cccc1)c1Br)N(C1)CC1n1nccn1,0 Z2453159313,CN(C=CN=C1N2[C@H](CO)CCC2)C1=O,0 F6125-0586,Cc1cc(C)nn1CCNC(C(C1)CN1C(c1noc(C)c1)=O)=O,1 F6571-5937,CC(Cc1csc2c1cccc2)NS(CCc(cc1)ccc1OC)(=O)=O,1 F6471-0089,O=C(C(Oc1c2cccc1)=CC2=O)N(CC1)CC1n1nnc(-c2ccccc2)c1,1 Z4496992657,Cc(c(C(N(C)C(N1C)=O)=O)c1nc1)c1C(N(CCc1c2)Cc1cc(F)c2F)=O,0 Z1969360992,CC(CCC1)N1C(c1cn(C)c(cc2)c1cc2F)=O,0 Z2691003168,CN(Cc1cocc1)C(c1noc2c1COCC2)=O,1 F6795-6456,Cc1noc(CN(CC2)CCN2c2nc(C)cc(C(F)(F)F)n2)n1,1 Y206-4214,OC(C(C1CC2CC1)C2C(Nc(cc1)ccc1C(N1CCOCC1)=O)=O)=O,1 F2496-1734,O=C(Cc(cccc1)c1Cl)OCc1noc(-c(cc2)cc3c2OCCO3)c1,1 F2517-1077,O=C(c1c(C(F)(F)F)cccc1)Nc1nnc(COc2ccccc2)o1,1 Z2068692184,Cc(cnn1C)c1S(N(CCC1)C1c(cccc1)c1Cl)(=O)=O,0 S694-1455,Cc1cnc(-c2ccncc2)n1C(CC1)CN1S(c(cc1)ccc1C#N)(=O)=O,0 P150-0988,CN(CC1)Cc2c1nc(N1CCN(CC3CCCCC3)CC1)s2,1 F6472-0825,O=C(Cc1ccc(C(F)(F)F)cc1)NCCSC1CCOCC1,0 J006-0747,Cc1noc(C)c1C1N(Cc2c[nH]nc2-c(cc2)ccc2OC)CCC1,0 F6559-1455,O=C(C(CC1=O)CN1c(cc1)ccc1F)NC(CC1)CCC1(F)F,1 Z1171644417,Cc(cc1)c(C)cc1NC(CN(CC(N1)=O)C1=O)=O,0 F6523-0325,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1)CCN1c1cc(C(F)(F)F)ncn1,1 Z757545594,O=C(c1ccco1)NC1CCN(Cc(cc2)cc(F)c2F)CC1,0 F6523-3333,O=C(c1cnc(C(F)(F)F)cc1)NCCN(Cc(cc(cc1)Cl)c1OC1)C1=O,0 SB15-0886,COCC(N(C1CCOCC1)C(CCC1)CN1C(COc(cc1)ccc1OC)=O)=O,0 CM4573-6716,CC1(CC1)C(N(C1)[C@H](CN(CCC2)c3c2cccc3)CC1(F)F)=O,1 F1105-0500,O=C(C1(CCCC1)c(cc1)ccc1Cl)Nc(cccc1C(N2)=O)c1C2=O,1 Z2309089230,CCC1C(CNC(N(CCC2)CC2C(NC)=O)=O)CCCC1,0 8014-5806,COc(cc1)ccc1OCc(n1-c2ccccc2)nnc1SCC(c(cc1)cc2c1OCCO2)=O,1 D622-0098,FC(c1nc(cc2OCCOc2c2)c2n1Cc(cccc1)c1Cl)(F)F,0 Z2149791431,O=C(CN(CCC1)CC1C1CC1)NC(CCC1)c2c1cccc2,1 Z1515198072,OC(CC1CC2)CC2N1c1nnc(C(F)(F)F)cc1,1 C260-2557,O=C(C1CCC(CN(C(c(cccc2)c2N2Cc3cccc(Cl)c3)=O)C2=O)CC1)NCc1ccccc1,1 Z3796726491,Cn1nc(CS(NC([C@H]2C[C@H](CC3)O[C@H]3C2)=O)(=O)=O)cc1,1 S720-0743,O=C(C1CCC1)N(C[C@H](C1)Oc2ccccc2)[C@@H]1C(N1CCCC1)=O,1 F6672-0967,CC(Nc1ccc(CN(C(CC2)C3)C2CC3n2ncc(Br)c2)cc1)=O,0 F6442-1638,CC(C)CS(C(C1)CN1C(c1nc2ccccc2nc1)=O)(=O)=O,0 Z4441850536,NC([C@@H](COCC1)N1C(Cc1c[nH]c2c1cccn2)=O)=O,1 F6788-3482,Cc1nc(N(CC2)CCN2c2ncnc3c2n(C)cn3)cc(C(F)(F)F)n1,0 Z2352272156,O=C(N[C@@H](CC1)[C@@H](c2ccccc2)NC1=O)N1CCCCC1,1 SA42-0974,CN(CC(C1)(CN1C(Cc(cc1)ccc1Cl)=O)C1)C1c1noc(-c2ncccc2)n1,1 F6709-4282,CC(C)CNC(N(C1)CC1Oc1cc(C(F)(F)F)ncc1)=O,0 C884-0989,CCCNC(C(C)n1c(C(NN=C2)=O)c2c2c1cccc2)=O,0 F6556-5609,CCCCS(N(CCC1)CCN1C1COCC1)(=O)=O,0 Z1565097875,CC(N(CCC1)C11CCN(C)CC1)=O,1 SB95-0289,Cc(cccc1)c1NC(N(CCC1)CC1N(CCN1CCCCC1)S(C)(=O)=O)=O,1 Z1999614819,CC(c(cc(cc1)F)c1OC)NC(N1CCC(CS(N)(=O)=O)CC1)=O,0 Z2960983550,Cc1cccn2c1cc(C(NC(C1(CO)CCC1)c1ccncc1)=O)c2,1 F6203-1559,CCC(C(NCC(c1ccc(C)cc1)OCCO)=O)c1ccccc1,0 V030-7762,CCNC(c1ccc(COc2cc(C(c3ccc(C)cc3)N(CC3)C(CC(C)C)=O)c3cc2)o1)=O,0 Z595774700,O=C(c1ccc(CNC(Nc2cccc(N(C(CN3)=O)C3=O)c2)=O)cc1)N1CCCCCC1,1 Z2999582622,CC(CCN1)(CC1=O)C(Nc1c(C(F)F)cccc1)=O,0 Z2917021274,CCS(N(CC1)CCC1NC(NCCC1(CC1)c1ccccc1)=O)(=O)=O,1 8014-1901,CC(C(C1C(N2c(cccc3)c3OC)=O)C2=O)NC1(c(cccc1)c1N1)C1=O,1 F5599-0341,Cn(c(NC(C1)=O)c2C1c1ccccc1)nc2NC(c1c(C(F)(F)F)cccc1)=O,0 SB18-0926,Cc1c(CN(C[C@H](C2)NS(C)(=O)=O)[C@@H]2c2nc(-c3ccccc3)n[nH]2)scc1,1 SC42-0382,O=S(C1CC1)(N(CC1)CCC11OCCC(Cc2noc(C3CCC3)n2)C1)=O,1 Z3268511753,Cc1c(C(CC2)CCN2C(c2cc(N(C)C)ncc2)=O)cnc(N)c1,1 Z2484433668,O=C(c(cccc1)c1-n1nnnc1)N1CC(C2)(CC2C(F)(F)F)C1,1 E002-0869,CC(CC1)CCC1Nc(n1nc2)c(-c3cccs3)[nH]c1c2C#N,1 SC69-0674,CCn1c(C(C2)C3(CCCC3)CN2C(Nc(cc2)cc3c2OCCO3)=O)nnc1,1 Z1393320714,NC(c1cccc(NC(N(CC2)CC2c(cc2)ccc2F)=O)c1)=O,0 F0600-2293,Cc1cc(C(Nc2nc3cc(C)cc(C)c3s2)=O)c(C)o1,0 F6755-7709,Clc(cc1)cc2c1oc(NCc1ncccn1)n2,1 F6439-4780,CC(C)(Cc1ccc2)Oc1c2OCC(NCCn1nc(C(F)(F)F)cc1)=O,1 F6525-1182,O=C(c1ccco1)NCCn(cc1)nc1-c1nccnc1,1 S893-0011,O=S(c1ccccc1)(N(CCC1)C1c1n[nH]c2c1COCC2)=O,0 F6814-2951,CC1N(Cc(ccc(F)c2)c2F)CCN(Cc2n[nH]c3c2CCC3)C1,1 Z1894287289,O=C(c1nc2cccnc2s1)N(CCCCC1)C1c1ccco1,1 SA44-1141,Cc1noc(C)c1S(N(C1)CC1(C1)CN(C)C1c1nnc(-c2ccccc2)o1)(=O)=O,1 S720-0799,O=C([C@H](C[C@@H](C1)Oc2ccccc2)N1C(c1ccco1)=O)N1CCCC1,1 F6523-3534,Cc1cc(C)nn1CCC(NCCN(C=Nc1c2scc1)C2=O)=O,1 8602-0243,COc(ccc(CCN(C(C(C(F)(F)F)(NC(CCc1ccccc1)=O)N1)=O)C1=O)c1)c1OC,1 CM2642-3818,CC(C)C(C)NC(c1nn(CCOc2ccccc2)c2c1CNCC2)=O,1 F6474-0106,CC(N1C)=CC(OC(CC2)CCN2C(c(cc(cc2)OC)c2Br)=O)=CC1=O,0 SD12-0357,Cc1c(CN(CCN2)C(Cc3nc(-c4ccncc4)no3)C2=O)scc1,1 F2121-0288,Cn1c(-c(cc2)ccc2Br)ccc1C(O)=O,0 F6123-0114,CC(CCOC)(CNC(COc1cc(OC)ccc1)=O)O,0 G620-0354,O=S(c(cc(cc1)F)c1F)(Nc1cc(-c(cc2)nnc2N2CCOCC2)ccc1)=O,0 Z2903185146,O=C(c1c(C(F)(F)F)cccc1)NCc1nc(-c(cccc2)c2F)no1,0 F2616-0869,COc(cccc1)c1NC(C(NCc1ncccc1)=O)=O,0 L161-0113,O=C(c(cc1)cnc1SCCN1CCCCC1)NCCC1=CCCCC1,1 Z2982760034,Cc1noc(C)c1-c1cn(CCOC2COCC2)nn1,1 C205-0024,CCN(CC)CCCNC(CN1c(cc(C)cc2)c2OCC1=O)=O,0 F6438-3720,CN(C)c1nc(CNC(c(cc2)ccc2S(N(C)C)(=O)=O)=O)nc(N2CCCCC2)n1,0 S509-1926,COc1ccc(C2(CC2)C(N(CC2)CCC2(CC2)CCN(Cc3ccccc3)C2=O)=O)cc1,1 SA53-0993,Cc1n[nH]c(C(CN(CCC2)C(c3cscc3)=O)N2C(c2ccncc2)=O)n1,1 F6556-0258,COc1cccc(S(NCC2(CCC2)N2CCOCC2)(=O)=O)c1,0 F6252-1191,Cc1noc(-c(cc2)cnc2N(CCC2)CC2C(NCc2c(C(F)(F)F)cccc2)=O)n1,0 Z1262369875,CCC(C(NCC1CCN(Cc2cccs2)CC1)=O)N(CCC1)C1=O,0 F5792-0393,O=C(c(cccc1)c1F)N(CC1)CCN1C(SC1)=NN=C1c1ccccc1,0 Z976488736,CCC(CC)C(N(CC1)CCC1NC(C1(CC1)c(cccc1)c1OC)=O)=O,0 F1065-0568,O=C(c1cccs1)Nc(cc1)ccc1OC(F)F,0 Z1269908231,CCCS(NC(CC1)CCN1C(C(C1)(Cc2c1cccc2)O)=O)(=O)=O,0 Z1335057810,O=C(CC1CC(CC2)NC2C1)N1CCC(Cc2ccccc2)CC1,1 V013-4901,Cc1c(CNC(c(cc2)ccc2-c2cc(-c(ccc(Cl)c3)c3Cl)n[nH]2)=O)cccc1,0 F6808-5392,CC(C)NC(C(C)N(CC1)CCN1c1nnc(C(C)(C)C)s1)=O,1 J102-0084,O=C(CN1N=C(CCCCC2)C2=CC1=O)Nc1nc(ccc(OC(F)(F)F)c2)c2s1,1 Z4784462017,Oc(nc(ccc(F)c1)c1c1)c1C(NCC1CC1)=O,0 F6240-5059,O=C(c1ccco1)NC1(CCCCC1)c1nc(-c2nccnc2)no1,1 SB49-1109,CCn1ncc(C(N(CCCC23CCOCC3)C2C(N)=O)=O)c1C,0 F6474-7423,CCOc(cccc1)c1S(N(C1)CC1N(C(CN1)=O)C1=O)(=O)=O,1 Z1717400757,Cn1c(-c(cc2)ccc2Cl)nnc1CN(CC1)CCC1N(CCCC1)C1=O,1 S942-0317,O=S(c1ccccc1)(N(CC1)CCC1(c1nc(-c2ccncc2)no1)F)=O,0 F5854-2943,Cn1c(CN(Cc2cccs2)C(c2cc(cccc3)c3o2)=O)ccc1,1 Z905084026,CN(Cc(occ1)c1C(O)=O)c(cccc1)c1OC,0 Z1824196998,CC(C)N1CCN(CCCN(CC2)CCC2N(c(cccc2)c2N2)C2=O)CC1,1 G546-0075,O=C(c1cc(-c2ncccc2)nc2ccccc12)NCCCN(CCC1)c2c1cccc2,1 F3257-0320,CC(N(C)Cc1nc(cccc2)c2n1CCOc(cccc1)c1Cl)=O,0 F1798-0118,CC(C)C1C(C#N)=C(N)OC(C=C(C)N2Cc3ccccc3)=C1C2=O,1 Z3389288151,CC(Cc1cnc[nH]1)C(N(C[C@@H]1C(O)=O)C[C@@H]1c(cc1)ccc1OC)=O,1 F6555-0722,O=C(c1cc(cccc2)c2[nH]1)N(CC1)CC1n1nnc(C2CC2)c1,1 F3374-0819,COc(ccc(NC(c1cnc(cc(cc2F)F)c2c1O)=O)c1)c1OC,0 Z4987300170,Cc1noc2nc(C)cc(N(CCC3)CC3C3CCC3)c12,1 Z1232864613,CC(Cc1cc(S(NCC2CCOCC2)(=O)=O)c2)Oc1c2Cl,1 Z3026724984,CC(C)Cn1nccc1C(NCc1nonc1)=O,1 Z367749602,CNC(C(C1)COc(cc2)c1cc2OC)=O,0 Z2194019170,O=C(c1c[nH]nc1-c1ncccc1)Nc1cnccc1,1 C470-0652,CC(C)CCn1c(C(N(C)C(N2C)=O)=O)c2nc1CN1CCC(Cc2ccccc2)CC1,0 Z295542144,CC(C(NCc(cc1)cnc1-n1cncc1)=O)Oc(cc1)ccc1F,0 F6745-0548,COc1cccc(CN(CC2)CCN2c2nsnc2)c1,0 Z1005229256,CCCc1nnc(NC(c2ncccc2O)=O)s1,0 Z2900815077,COc(cccc1)c1-c1cn(CCF)nc1,0 Y503-2054,CC(C)c1ccc(C(CC(C(F)(F)F)n2nc3)Nc2c3C(O)=O)cc1,0 Z729589962,CC(c(cc1)ccc1NC(C(C1)=NOC1c1ccccc1)=O)=O,0 Z3210755508,OC([C@H]1OCCC[C@H]1c1ccccc1)=O,0 C887-1187,CCCN(CC1)CCN1C(CCCN(C1=O)N=C(C)n2c1cc1c2cco1)=O,1 F6750-6300,Cc1nnc2n1ccnc2N(CC1)CCN1c1nc(-c2cn(C)nc2)cnc1,1 Z2970070792,CC(CCC1)N1c1cccc2nncn12,0 Z1819157741,CC(CO)N(CCC1)CCN1C(c1cc(cccc2)c2n1Cc1ccccc1)=O,0 Z3290588623,O[C@@H]1[C@@H](CC(Nc2cn(Cc3ccccc3)nc2)=O)COC1,1 S233-1828,CCn1nc(C)c(-c2cc(C(NC[C@](CCC3)(CC4)[C@@H]3N(CCOC)C4=O)=O)no2)c1C,1 S898-0309,CC(C)CNC([C@H](C1)NC(CC2)(CCN2C(CCc2c(C)onc2C)=O)c2c1[nH]cn2)=O,1 Z1449633893,CC(C)(C)c1cc(S(CCNC(C2CCCC2)=O)(=O)=O)c(C)cc1,1 F680-0307,CCCC(c1cccs1)NC(CSC1=Nc(cccc2)c2N(CC)C1=O)=O,1 F6438-1479,CN(C)c1cc(N(CC2)CCN2C(COc2ccccc2)=O)cnn1,1 F0655-1137,CCN(CC1)CCN1C(C(C)NC(NC1CCCCC1)=O)c1cccs1,1 S694-1560,Cc1cnc(C)n1C(CC1)CN1C(CC1CCCC1)=O,1 Z1307641923,Cc1csc(C(C2CC2)NC(N[C@@H]([C@H](C2)O)c3c2cccc3)=O)n1,1 Z827755676,CCc1c(C)cc(C(NCc2c(C)onc2C)=O)s1,0 F6454-2310,Cc1nccc(N2CCC(CNC(c3cnc(C(F)(F)F)cc3)=O)CC2)c1,1 S985-0130,CC(C)N(C[C@H]1CN(C2)C(CCCc3ccccc3)=O)C[C@@]12C(N1CCCC1)=O,0 S592-0253,O=C(NCc1ccccc1)N(CC1)CC1c1noc(COCc2ccccc2)n1,1 Y031-7390,CN(C)C(N(CCC1)CC1C(Nc1nnc(C(F)(F)F)s1)=O)=O,0 Y042-2528,COc1cc(CCC2NC(CN3N=Cc(cccc4)c4C3=O)=O)c2cc1OC,1 F3127-0273,CCc(cccc1)c1N(CC1)CCN1C(c(cc1)ccc1N(C(C1C2CCCC1)=O)C2=O)=O,0 F5033-0355,Cc(cccc1)c1OCC(NCC(CC1)CCN1C1CCCC1)=O,1 Z2740085301,OC(c1cccc(CNC(N(CCC2)C[C@H]2C(F)(F)F)=O)c1)=O,0 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F5095-0128,Cn1c(N(CC2)CCN2C(C(CC2=O)CN2c(cc2)ccc2Cl)=O)ncc1,1 7593-0001,C(CNCc(cc1)cc2c1OCO2)CN1CCOCC1,1 F6619-5058,C(CC1)CN1c1nc(N(CC2)CCN2c2ncnc3cnccc23)ccn1,1 F6523-0288,O=C(Cn(cc1)c2c1cccc2)N(CC1)CCN1c1cc(C(F)(F)F)ncn1,1 Z1021863508,CC(c1ccccc1)NC([C@H](C1)N(C(C)=O)c2c1cccc2)=O,0 Z2142772103,O=C(c(cccn1)c1F)Nc(cccc1)c1-c1nc(cccc2)c2s1,1 F5323-0076,Cn1nc(CCC2)c2c1NC(Cc1cccc2ccccc12)=O,1 Y031-4395,O=C(C(CC1)CCN1C(c1ccco1)=O)N(CC1)Cc2c1cccc2,1 F6666-9902,O=C(CNC(c1ccccc1)=O)Nc1cccc(F)c1F,0 V027-6796,CCCCNC(N(CC1)CCN1c1cc(Oc(cc2)ccc2F)ncn1)=O,0 Z4632454248,CC(CCC(C)(C)C)C(N[C@H](CC1)CN1C(CCC1COCC1)=O)=O,0 8020-7567,CC(C)c1ccc(C(c2c(C3=O)[nH]nc2-c2cccs2)N3c2nccs2)cc1,0 S248-3954,O=C(NCCc1ccccc1)N1CC(Cc2noc(C3CCOCC3)n2)CC1,1 Z1545613798,O=C(c(cccc1)c1F)NCC1(CC1)c(cccc1)c1Cl,0 F6481-3210,Oc(ncc(C(N(CC1)CCSC1c(cc(cc1)F)c1F)=O)c1)c1Cl,0 P898-0346,O=C(c1c(-c(o2)ccc2S(N2CCCCCC2)(=O)=O)[nH]nc1)N1CCOCC1,1 Z1230898390,CCN(CC)S(c1cc(C(Nc2n[nH]c(C3CCCCC3)c2)=O)ccc1)(=O)=O,1 Z1603237097,CCC1(COC1)C(N(CC1)CCC1(C1)C1C(O)=O)=O,1 Z1155217416,CC(NCc(cc1)ccc1C(NCc1cc(CN(CCC2)CC2C(N)=O)ccc1)=O)=O,1 Z1609106077,CCOc(c(C(Nc1cnc(CCOC2)c2c1)=O)ccc1)c1F,0 Z2070225763,CC(C)n1c(C(CCC2)CN2C(c(scc2)c2Cl)=O)nnc1,0 F3382-4407,O=S(Cc(cc1)ccc1Cl)(c(cc1)nnc1NCCC1=CCCCC1)=O,1 V002-2047,COc1cccc(COC(CN(CC2)CCN2S(c2c(C(F)(F)F)cccc2)(=O)=O)c(cc2)ccc2Cl)c1,0 Z1343760666,Cc(ccc(F)c1)c1N(CCC(N1)=O)C1=O,0 Y031-4819,Cc(cc1)c(C)cc1N(CC(C1)C(Nc2nc(ccc(S(C)(=O)=O)c3)c3s2)=O)C1=O,0 Z3687014052,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(c1c(cc[nH]2)c2ncc1)=O,1 Z1700857188,CC(C(Nc(cccc1)c1C(C)=O)=O)N1CC(COC)CCCC1,0 S428-0792,O=C(C1CCOCC1)N1CCC(Cc2nc(C3CCOCC3)no2)CC1,1 F5558-0073,Cc1c(C(N(CC2)CCN2c2nc(C)nc(-n3nccc3)c2)=O)sc(-c2ccccc2)n1,1 S529-0305,COc1cc(NC(CN(CCCc2c3cnc(C4CC4)n2)C3=O)=O)cc(OC)c1,1 S845-0136,Cc1noc(C)c1S(N(CCC1)C1c1nncn1C1CCCC1)(=O)=O,1 F6395-4156,O=S(Cc1ccccc1)(N1CC2(CCOCC2)OCC1)=O,1 F6806-7525,O=C(C(CCC1)CN1c1ncnc2cnccc12)N(CC1)CCC1(F)F,1 S951-5662,Cc1noc(C)c1CC(N(CCN(C1)c(cc2)cc(C(F)(F)F)c2C#N)C1C(N(C)C)=O)=O,1 S661-1174,CCN(C(C(C1)N2CC1(CC1)CCN1C(CN1CCOCC1)=O)=O)C2=O,1 F6573-4185,Cc1c(C(NCCOCCN(C(CC2)=O)C2=O)=O)n(cccc2)c2n1,1 Z2934177498,Oc1cccc(NC(Nc2cnccc2)=O)c1,0 Z2446731414,CCOC(C)C(Nc1nn(CC(O)=O)cn1)=O,0 F6559-0684,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)N(CC1)CCC1N(C=Nc1c2cccn1)C2=O,1 Z3511713224,OC1CCN(Cc2nnc(N3CCCCC3)o2)CC1,1 Z4919113977,CN(C)c1nc2ccccc2c(C(NC2[C@@H]3C[C@@H](CO)C[C@H]2CC3)=O)c1,1 F0556-0201,CCN(CCc(c1ccc2)c2OCC(N(C(C2)c(cc3)ccc3F)N=C2c2cccs2)=O)C1=O,1 F477-1428,O=C(c(sc1c(cc(cc2)Cl)c2ncc11)c1-c(cc1)ccc1F)NCCCN(CCC1)C1=O,1 SB03-0135,CN(CCN(C1CCOCC1)C(CCC1)CN1S(C)(=O)=O)Cc1cn(C)nc1,0 F1549-0018,CC(C)(C)NS(c(cc1)ccc1NC(COc1c(C)cc(C)cc1)=O)(=O)=O,0 Z1481683078,CCc1nc(cccc2)c2n1CC(NOCc1cnccc1)=O,1 F6497-2208,O=C(Cn(cc1)c2c1cccc2)N1CCC(CC(N2c(cccc3)c3F)=NNC2=O)CC1,1 F3406-4542,CN(Cc1ccccc1)c(nc1)nc(N)c1S(c(cc1)cc(Cl)c1OC)(=O)=O,1 Z2960253339,CN(C)Cc(cc1)cc(OC)c1NC(c(cc1)cc(N2)c1N(CC1CC1)C2=O)=O,1 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Z2439242774,O=C(c1cc(COc2c-3cccc2)c3s1)N(CC1)CC1N1CCNCC1,1 Z2010480335,Cn(c1ncc2)nnc1c2C(NC1(CCCC1)c(cc1)ccc1Br)=O,1 Z2212596037,CC(C)C(N(CCC1)CCN1S(c1c(C)cc(C)s1)(=O)=O)=O,1 F6435-2800,Cc(c(S(N1C(CS(c2ccccc2)(=O)=O)CCC1)(=O)=O)ccc1)c1Cl,0 V021-9527,O=C(C(C1CCCC1)N(CC1)CCN1C(c(cc1)ccc1F)=O)NCc1ccco1,1 F5139-0416,CS(N(CC1)CCC1C(Nc(cccc1)c1Oc1ccccc1)=O)(=O)=O,1 Z3780826339,O=C([C@@H]1[C@@H](C2)[C@H]1CC2(F)F)NS(CC(C1)CC1(F)F)(=O)=O,1 SC77-0701,CCN1CCN(CCCNC([C@H](CN(C2)S(C)(=O)=O)[C@@]22OCCNC2=O)=O)CC1,0 F5871-1372,CS(N1CCN(CCNC(c2nc3ccccc3nc2)=O)CC1)(=O)=O,0 F0844-0002,COc1cccc(-c(n2-c3ccccc3)nnc2SCC(NCc2cnccc2)=O)c1,1 SA52-0981,Cc1c(C(N(CCC2)CC(c3nc(C)no3)N2C(c2cnccc2)=O)=O)ocn1,1 F0651-0539,Cc1cc(cc(CNC(NC2CCCCC2)=O)cc2)c2n1C,1 Z2141491378,Cc(ccc(S(C)(=O)=O)c1)c1C(Nc1ccc(C2(COC2)O)cc1)=O,1 Z1099690616,Cc1c(CC(N(CC2)CC2c2c(C)cccc2)=O)c(C)n[nH]1,0 F6448-0222,O=C(Cc(cccc1)c1Cl)Nc1cn(CC2OCCCC2)nc1,0 SA69-1563,CC(CCC1)(CN1C(C1(CC1)c(cc1)ccc1OC)=O)c1noc(COc2ccccc2)n1,1 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F6414-1213,OC(CNC(c(cc1)ccc1OC(F)(F)F)=O)(CC1)Cc2c1cccc2,0 Z4521999985,Cc1nsc(N2C3(CC3)C(CNC(CCc3nnc[nH]3)=O)CC2)n1,1 F6791-6864,Cc1cn(-c2cc(N(CC3)CCN3c3cccc(OC)c3)ncn2)nc1,0 V015-2440,Cc1cccc(S(N2Cc3c(N(C)C)nc(N(CC4)CCN4c(cccc4)c4F)nc3CC2)(=O)=O)c1,1 F2600-0053,O=C(C1c(cccc2)c2Oc2c1cccc2)N(CC1)CCC1c1nc(cccc2)c2[nH]1,1 L470-0097,CC(C(NCc(s1)ccc1S(N1CCCC1)(=O)=O)=O)Oc1ccccc1,1 F6451-0237,COC(CNC(CCc(cccc1)c1Br)=O)c(cccc1)c1OC,0 Z2998788907,CC1=Cc(cc(cc2)NCC(CC3(CCCC3)O)O)c2N(C)C1=O,1 S594-0753,CCn1ncc(S(N(CC2)CCC2c2noc(COCC3CC3)n2)(=O)=O)c1,1 Z3347744305,Cc1c(CN(CC2)CCC2c2nc(CC(O)=O)cs2)occ1,0 F0919-3279,CCOC(N(CC1)CCN1C(N1c(cccc2)c2Sc2c1cccc2)=O)=O,1 F3382-8198,Cc1c(CN(c(cccc2)c2C(N2CC3OCCC3)=O)C2=O)nc(-c(cccc2OC)c2OC)o1,0 F5139-0120,CCOC(c(oc1c2cccc1)c2NC(C(CC1)CCN1S(C)(=O)=O)=O)=O,1 Z2434142673,O=C(C1(CNCC1)F)Nc1cc2ccccc2nc1,1 SA66-0636,C(Cc1noc(-c2cnccc2)n1)C1CN(Cc2ccncc2)CCC1,1 Z2922722822,CCn1c(CCN(C2)C(c3cccc(C(O)=O)c3)=O)c2nc1,0 Z4143393527,CC(C)(CNC(C1CCCC1)=O)c1nc(C)no1,1 Z1225025026,CC(C)c1n[nH]c(-c(cccc2)c2NC(C(C)Oc2cnccc2)=O)n1,1 S511-1323,CN(C)C(CC1CC(CC2)(CCN2C(CCC2CCCC2)=O)OCC1)=O,0 Z4898037328,Cc1nc([C@H](CC2)CC[C@@H]2NC(C(CCC2)CN2C(N(CC2)Cc3c2scc3)=O)=O)n[nH]1,1 Z1725673843,CCCS(N(CCC1)C1C(N(C1)CC1NC(COC)=O)=O)(=O)=O,1 Z1172546362,Cc1cc(NC(CCC2OCCCC2)=O)ncc1,0 D491-4206,CC1Oc(ccc(NC(c2c(C)c(cc(cc3)Br)c3o2)=O)c2)c2NC1=O,1 P147-2206,O=C(C1CCC1)NCc1cn(-c(cc2)ccc2C(N(CC2)CCN2C2CCCC2)=O)nc1,1 P121-0145,CC(C)CCNC(CN(C(C)=CC=C1NC(NC)=O)C1=O)=O,0 F429-0119,Cc(onc12)c2C(C)=NN(CCC(N(CC2)CCN2C(c2ccco2)=O)=O)C1=O,1 Z2846219365,CC(C)N(CC1)CCC1NC(Cn1nnc(CNC)c1)=O,1 F5791-0758,O=C(c1ccc(Cn2cncc2)cc1)NCc1nc(-c2ccccc2)no1,1 Z957122322,CC(CCCC1)N1C(NC(CC1)CCN1c(cccc1)c1OC)=O,1 J006-0797,CCOc(cc(CN(CCC1)C1c1noc(C)c1)cc1)c1OC(C)C,0 E715-0496,CCOc(cc1)cc2c1nc(NC(C(CC1)CCN1c1ncnc3c1nc1n3CCCCC1)=O)s2,1 C076-0467,O=C(c1cc(C(F)(F)F)ccc1)N(C1)C(c(cc2)ccc2F)c(cc(cc2)F)c2NC1=O,0 S380-0093,O=C(CN(C(C1(CCCCC1)N1)=O)C1=O)NCCc(cc1)ccc1Cl,0 8008-9631,CC(C)=C1C(C2C(N3c4cc(C(O)=O)ccc4)=O)C=CC1C2C3=O,0 4099-6537,Cc(c(C)c1)cc(C(C2)c(cc3)cc(Br)c3F)c1NC2=O,0 Z1584222039,NC(COc1ccc(CN(CCN2)c(cccc3)c3C2=O)cc1)=O,0 F5017-0798,O=S(CCc1ccccc1)(NCC1CCN(Cc2ccco2)CC1)=O,1 Z2283263995,CCCn1ncc(NC(C(C)CCc2cccc(F)c2)=O)c1C1CC1,0 F6744-6547,CN(C(CC1)CCN1c1nc(c(OC)ccc2)c2s1)c1ncccc1,0 Z2028264961,CN(Cc1ccccc1)C(C(N1CC(c2ccccc2)OCCC1)=O)=O,1 Z1666738111,Cc1c(CN(CC2)CCC2NC(c2cc(OC3COCC3)ncc2)=O)cccc1,1 F5329-0031,CSc(cccc1)c1NC(C(NCC1(CCOCC1)c1ccccc1)=O)=O,0 G017-1780,O=C(CCC1)Nc(cc2)c1cc2S(NCCN(Cc1ccco1)C1CCCC1)(=O)=O,1 F6525-2188,Cc1c(C(NCc2cc(-c3nccnc3)nn2C)=O)c(-c(cccc2)c2Cl)no1,1 L310-2770,Cc(cc(c(OC1)c2)N(Cc3noc(C4CC4)n3)C1=O)c2S(NCc1cnccc1)(=O)=O,1 F6560-2362,Cc1c(C(NCc2cn(-c3ccncc3)nn2)=O)n(cccc2)c2n1,1 J031-1643,Cc1c(C(CSc2nnc(-c3c(C)cc4OCCCOc4c3)n2C)=O)c(cccc2)c2[nH]1,0 T408-0670,CN(CC1)CCC1N(CC1)CCN1C(C(CC1)Cc2c1sc(C(N1CCCC1)=O)c2)=O,1 Z2691431942,O=C(c1nn(CC(F)F)cc1)N(CCn1nc2)c1c2Br,0 F6374-1660,COc(cc1)ccc1SCC(CC1)CCN1C(COc(cc1)ccc1Cl)=O,1 F3407-4975,COc(cc1)ccc1-c1nnc(CC(N(CC2)CCN2c2cccc(C(F)(F)F)c2)=O)o1,1 F3407-4991,O=C(Cc1nnc(-c2cccc(Br)c2)o1)N(CC1)CCN1C1CCCCC1,1 Z3442875923,C[C@H](C1)O[C@@H](C)c2c1c(C(NCCc1nc(ccc(F)c3)c3n1C)=O)n[nH]2,0 SB21-0074,CN(C)C(c1cn(C[C@H](C[C@@H](C2)F)N2C(c(ccc(OC)n2)c2OC)=O)nn1)=O,0 F1909-1896,CC(C)(C)OC(N(C1)CC(C2)C1CN2C(c1c2cccc1)=NS2(=O)=O)=O,1 F1905-8992,CC(C)(C)N(C(C(C(O)=O)OC1)c2ccc(C)o2)C1=O,1 F0696-5105,Cc1c(C)sc(NC(c(cc2)nnc2N2CCC(Cc3ccccc3)CC2)=O)n1,1 Z2695631166,C[C@@H](CN(C1)S(C)(=O)=O)[C@@]1(C)C(O)=O,0 Z2279577959,CN(C)C(NC1CN(CC(NC2C3CC(C4)CC2CC4C3)=O)CCC1)=O,0 Z2328393420,Cc(cc1)nnc1C(N1CCN(CCc2ccccc2)CC1)=O,0 F6240-7422,C(c1cccs1)Nc1ncncc1-c1nc(-c2ccccc2)no1,1 F6178-1580,O=C(c1ccncc1)N1CCC(CNS(C2CC2)(=O)=O)CC1,1 Z1560360983,CN(CC1CCOCC1)C(Nc1cccnc1Sc1ccccc1)=O,1 F5882-2047,CCSc(cccc1)c1C(NCc1nc(COc(cc2)ccc2OC)no1)=O,0 Z4493403756,O=C(NC(CC1=O)CN1c1cccc(C(F)(F)F)c1)N(Cc(cccc1)c1N1)CC1=O,1 F6452-0072,CC(CNC(CSC1CCCC1)=O)(c(cccc1)c1F)OC,0 Z1512513032,Cn1nc(C2CCCCC2)c(C(Nc(ccc(Cl)c2)c2O)=O)c1,0 S471-0214,CC(C(N(CC1)CCN1c1cc(C(F)(F)F)nc(C)n1)=O)Oc1ccccc1,0 F0328-0336,O=C(c1cc(F)ccc1)Nc1nc(ccc2ccccc22)c2s1,1 J030-0465,O=C(c1c2)Nc(cccc3)c3Oc1cc(N1CCCC1)c2S(N1CCCC1)(=O)=O,1 Z1127048377,CC(C)c1nc(C)cc(N(CC2)CCN2C(C2=CC=CN(C)C2=O)=O)n1,1 F2633-0516,Nc1c(C(c2ccccc2)=O)n(cccc2)c2c1C(Nc(cccc1)c1Cl)=O,0 4817-2931,CCCCN(CC1)c2c1c(N)c(cc(cc1)Br)c1n2,1 Z4482985456,Nc1cc(Cl)ncc1C(N(CC1)CC1c1ccccc1)=O,0 F6609-3570,O=C(COC(c1cccs1)=O)NCc(ccc(F)c1)c1F,0 F6523-1495,Cc1cc(N(CC2)CCC2NC(Cn(cc2)c3c2cccc3)=O)n[nH]1,1 F5033-0838,CCOc(ccc(C(NCC1CCN(Cc2ccco2)CC1)=O)c1)c1OCC,0 Z1602045399,CC(Nc(cc(cc1)C(NC2CCOCCC2)=O)c1F)=O,0 Z4149228173,CC(N1C)=Cc([nH]nc2NC(C(C3)C3(C3)C3(F)F)=O)c2C1=O,1 SB95-1136,Cc1cc(C(N(CCC2)CC2N(CCN2CCOCC2)C(C2CC2)=O)=O)no1,1 S855-0703,Cc1noc(C)c1S(N1CC2(CCCCC2)C(CNC(C2CC2)=O)C1)(=O)=O,1 L694-0321,CC(C)N(c(ccc(S(N(CC1)CCN1C(c1cscc1)=O)(=O)=O)c1)c1O1)C1=O,1 F6793-6470,O=S(c1cccc2ccccc12)(N1CCC(CF)CC1)=O,0 F6125-2784,CC(N(C1)CC1C(Nc(cc1)ccc1S(C)(=O)=O)=O)=O,0 S423-0833,CCOC1CC(CC2)(CCN2C(NCc(cc2)ccc2F)=O)OCC1,0 Z1974788403,Cc(n(-c1ccncc1)nc1)c1C(N[C@H](C1)C[C@@H]1c1cccc(C(F)(F)F)c1)=O,1 Z3174025269,OC(COc(cc1)ccc1C(N1C(CC(F)(F)F)COCC1)=O)=O,0 G275-1293,Cc1c(-c(s2)ccc2S(N(CC2)CCN2C2CCCCC2)(=O)=O)[nH]nc1C,1 F2066-0028,Cc(n(nc1C)S(c(cc2)ccc2F)(=O)=O)c1S(N1CCOCC1)(=O)=O,1 F6796-3300,N#Cc1cc(CCC2)c2nc1N1CC(COc(cc2)nn3c2ncc3)CC1,1 F5865-0137,Cc1ccnc(C(Nc(cc2)cc3c2OCO3)=O)n1,1 Z2912494683,CC(C)(CC1c2ccccc2)CN1C(CCCN(C(NN1)=O)C1=O)=O,0 G702-0619,Cc(ccc(Cl)c1)c1N(CC1)CCN1c1c(CCC2)c2nc2ncnn12,0 F3411-0140,CCOc(cc1)cc2c1N(CC(Nc(ccc(OC)c1)c1OC)=O)c(nccc1)c1C2=O,1 Z1452253396,Nc1nonc1-c1nc2cc(F)cc(F)c2[nH]1,0 Z1419837016,CC1(CC1)C(NCC(Nc1c[nH]nc1)=O)=O,0 Z1027972908,CC(CN1CCCCC1)NC(Nc(cc1)cc(-n2nnnc2C)c1OC)=O,1 Z1732145230,CN(C[C@H]1OCCC1)CC(N(C1)c(cccc2)c2NC1=O)=O,1 F6519-5835,O=C(c1csc(-c2ccccc2)n1)NCC(c1ccco1)n1nccc1,1 Z5343170280,CNCCC(Nc(cc1)cnc1Oc1ccc(C(F)(F)F)cc1)=O,0 SB94-0877,Cc1noc(C)c1C(N1CCC(CN(CC(C2)C(NCC3CC3)=O)C2=O)CC1)=O,1 Z102397320,OC1(CC(C2)C3)CC3(CC(NCc3c(CN4CCOCC4)cccc3)=O)CC2C1,1 E858-0041,Cc(cc1)cc(C)c1NC(N1CC(CCCC2)N2CC1)=O,0 Z1139293037,O=C(CC1C=CCC1)N1Cc2nncn2CC1,1 Z3514757461,CC(CCCC1)C1NCc1nnc(N2CCOCC2)o1,1 F6491-1500,COc1nccnc1OC(CCC1)CN1C(C1COCC1)=O,1 Z1570107338,Cc1nc(-c2ccccc2)c(C(NC(CC2)CCC2C(O)=O)=O)s1,1 F052-1708,CC(C)c(cc1)ccc1Nc1ccc(cc(cc2)S(N3CCOCC3)(=O)=O)c2n1,0 Z2964858212,CC(C)(Cc1c2c(C)c(C(N(C3)CC3N(CCC3)C3=O)=O)[nH]1)CC2=O,1 Z2359195918,C[C@](C1)(C[C@@H]1NS(c(cc1)cc(N2C)c1N(C)C2=O)(=O)=O)O,1 F6415-0379,COCCN(Cc1cocc1)C(Nc(cccc1OC)c1OC)=O,0 Z1931796771,CN(CC(C1)OCCN1C(C1(CCC1)c1ccccc1)=O)CC(O)=O,1 Z511987618,COc(cc1)cc(O)c1C(N1C(Cc2cccc(F)c2)CCC1)=O,0 G831-0199,CCCC(NCc(n1CCOC)nc2c1nccc2)=O,0 S570-0566,COCCN1C2=CCCCC2(CNC(CCc(cc2)ccc2OC)=O)CCC1=O,0 Z1663094032,Cc(cccc1)c1C(N(CC1)CCN1S(c1nnc[nH]1)(=O)=O)=O,0 F6440-4392,CC(C)(C(NCc1nn(C2CCCC2)c(C2CC2)c1)=O)Oc(cc1)ccc1Cl,1 Z2497943385,CC(C)(C)c1cc(CN(CC2)C(C(c3c(N4)ncn3C)=CC4=O)=O)c2cc1,1 F2368-1958,Cc1c(C)cc(Cc2nnc(NC(C3CC3)=O)o2)cc1,1 F6808-5250,CC(C)NC(C(C)N(CC1)CCN1c(cc1)ncc1Br)=O,0 SB04-0209,CS(N(CC1)CC1N(CCNC(c1ncccc1F)=O)C1CCOCC1)(=O)=O,0 Z2089426546,Cc1c(C(N[C@@H](CO)C(N)=O)=O)nc(C)s1,0 F6497-0166,O=C(c1nc(cccc2)c2s1)N1CC(Cc2nc(-c(cccc3)c3F)no2)CCC1,1 Z931385854,Cc(ccc(NC(Cn1nnc(CN)c1)=O)c1)c1F,0 S641-4504,Cc1cc(C)nn1CCC(N(C[C@@H]1C(NC)=O)C[C@@H]1c1nc(C)n[nH]1)=O,1 F6739-7714,CN(Cc(cc1)cc2c1OCCO2)c1nccc2c1cco2,1 Z1404682436,CC(C)Oc1c(C(c(cc2)ccc2Cl)N)cccc1,0 M341-0813,CC(c1ncccc1)NC(CN(c(cc(cc1)C(Nc2ccccc2)=O)c1O1)C1=O)=O,1 S640-0227,Cc1noc([C@@H](CN(C2)C(CCc3cc(OC)no3)=O)[C@H]2C(N)=O)n1,1 F6244-2657,O=C(NCC#CCN1CCOCC1)Nc1ccccc1,0 Z912998506,CCC(C)NC(C(C)NC(NC1CCN(Cc(cc2)ccc2Cl)CC1)=O)=O,0 Z2483690401,CC(C)S(CC(N(CC1)C11CCCC1)=O)(=O)=O,1 Z2958027632,Cc1nc(cccc2)c2n1CC(CCC1)N1C(c1nccc(O)c1)=O,0 C548-2916,CC(C)C(C(Nc(cc1)cc2c1OCCO2)=O)NS(c1cccc2nsnc12)(=O)=O,1 V010-8398,CC(C)c(cc1)ccc1OCc1nc(C(NC(CC2)CCC2NC(CCC2CCCC2)=O)=O)cs1,0 F6573-6430,O=C(CNC(OCc1ccccc1)=O)N(CC1)CCC1(C1)C1(F)F,1 F6395-2686,CN(CC1OCCOC1)C(CN(C(c1c2cccc1)=O)C2=O)=O,1 F2726-0834,CN(C(c1cccc(NC(Cc(cc2)ccc2F)=O)c11)=O)C1=O,1 Z2445912707,CC[C@@H](CN(C=Nc1c2nnn1C)C2=O)O,1 E591-0957,O=C(CCc1nnc(cc2)n1nc2N1CCOCC1)Nc(cc1)cc2c1OCCO2,1 F6529-3641,O=C(COc1ccccc1)N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O,0 Z2438248455,CC1(C)C(C2)C1CN2C(c1c(C)n(C2CCNCC2)nn1)=O,1 Z4422570416,O=C(C1OCC2(CC2)NC1)Nc1cn(Cc2ccc(C(F)(F)F)cc2)nn1,1 F6796-8879,N#Cc1cccnc1N1CC(CN(Cc2csc(C3CC3)n2)C2)C2C1,1 Z1556274242,CC(CCC1)(CN1C(NC(CC1)CCN1C(c1ccc(C)cc1)=O)=O)O,0 F6513-3779,CC(Nc(ccn1nc2)cc1c2C(Nc(cc1)cc(C2)c1-c1c2cccc1)=O)=O,1 F6404-4858,Cc(c(NC(c1cc(OCc2ccccc2)no1)=O)ccc1)c1Cl,0 Z2448549882,CS(Nc1nnc(NC(C(CCCCCC2)C2N)=O)s1)(=O)=O,1 SA73-0943,O=C(C1(CC1)c1ccccc1)N(CC1)CCC1(CC1CC1)c1noc(-c2cnccc2)n1,1 F6544-0826,CC(NC(CC1)CCN1C(NC1CCCCC1)=O)=O,0 F6200-4292,OC1(CNC(C(NC2CC2)=O)=O)c(cccc2)c2OCC1,1 F5832-4892,Cc1c(C(NCC(c2ccco2)N(C)C)=O)n(cccc2)c2n1,1 F6435-9230,CC(Nc1ccc(CC(N(CC2)CC2SCC(OC)=O)=O)cc1)=O,0 Y200-3580,Cc(cc1)c(C)cc1-c1cc(C(NC2CCCCC2)=O)c(cc(cc2)Br)c2n1,0 F575-0278,Cc(cc1)ccc1-c(cc1)nnc1Nc1cccc(C(NCc(cc2)ccc2SC)=O)c1,0 F6222-0238,O=C(c(ccc(F)c1)c1Cl)Nc1cnc(N2CCOCC2)nc1,0 F731-0063,CCN(c(cccc1)c1Oc(cc1)c2cc1NC(CCC1CCCC1)=O)C2=O,1 F5729-0038,O=C(c1cccc(Br)c1)N1CCC(Cn2c(cccc3)c3nc2)CC1,0 Z1455060444,OC(CCNC(c1cc(-n2cncc2)ncc1)=O)=O,0 F3309-0376,N#Cc1c(N(CC2)CCN2C(c2ccco2)=O)oc(/C=C/c(cc2)ccc2Cl)n1,1 Z4185521015,CC(Cc1cc(C)ccc1)N(C)CC(Nc(cc1)cc2c1[nH]c(C)n2)=O,1 Z2091401662,Cc1c(C(C(CC2)CCN2C(c2cn(-c(cccc3)c3Cl)nn2)=O)O)cccc1,0 Z1151613495,CC(C)(C(NC1CCN(Cc2ccncc2)CC1)=O)OC,0 Z4070814092,OC(Cc(cccc1)c1F)(CC1)CCN1C(C1(CCC1)C(O)=O)=O,0 V005-9493,O=S(c1cccc(Cl)c1)(N(CC1)CCN1c1nc(-c2cc(C(F)(F)F)ccc2)ccn1)=O,0 E864-0393,COc1ccc(C(c2c(CC3)c(cc(cc4)Cl)c4[nH]2)N3C(NC2CCCC2)=O)cc1,0 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Z758620686,CC(C)(C)N(CC1)CCN1C(c(cccc1)c1C(c1ccccc1)=O)=O,0 SB21-1255,NC(c1cn(C[C@H](C[C@@H](C2)F)N2C(c(cc2)cc(Cl)c2F)=O)nn1)=O,0 Z4767388680,O=C(c1cscc1Cl)Nc(cc1)ccc1-c1nc(ccnc2)c2[nH]1,0 F5461-0116,Cc1csc(CN(CC2)CCN2C(Cc2cccc3ccccc23)=O)n1,1 Z3016333019,O[C@@H]1[C@@H](CNc2cc(OC3CCOCC3)ncn2)CCCC1,1 Z1834967263,Cn(c(C(NC1(CC1)c1nnn[nH]1)=O)c1)c(N(C)C(N2C)=O)c1C2=O,1 G868-0737,Cc1nc(N(CC2)CCN2C(C2=Cc(cccc3)c3OC2=O)=O)nc(N2CCOCC2)c1,1 F6473-7240,O=C(Cc(c(F)ccc1)c1Cl)N(C(CC1)C2)C1CC2N(C(CC1)=O)C1=O,0 F6473-6202,CC(O1)=CC(OC(C2)CN2C(C(C=C2)=NN(C)C2=O)=O)=CC1=O,1 S233-1636,COc(cc1)nc(OC)c1C(NC[C@](CCC1)(CC2)[C@@H]1N(CC1CCCCC1)C2=O)=O,1 F6258-1354,O=C(C(CCC1)CN1c(cc1)nnc1-c1ccccc1)NCCN(C=NC(C1CC1)=C1)C1=O,1 Z5020304500,Cc(n(C)nc1)c1-c1ccc(cc(cc2)O)c2c1,0 Z1980541597,Cc1nn(cc(cc2)NC(NCCC3=CCCCC3)=O)c2n1,1 F6561-8212,O=C(c(cc1)cc2c1[nH]cc2)N(CC1)CC1N(CCO1)C1=O,1 SB71-0700,O=C(c1nn(CCN(C2)C(c3cnccc3)=O)c2c1)NC1CCCC1,0 Z2350519696,CC(C)N(CC(CC1)NC1=O)C(c1cc(-c(cc2)ccc2Cl)n[nH]1)=O,1 Z1622550433,CC(c1n[nH]cn1)NC(NCC1CCN(Cc2ccccc2)CC1)=O,0 F6473-0155,NC(C(CC1)CCN1C(C1)CN1C(CCc(ccc(Cl)c1)c1Cl)=O)=O,0 L505-2519,O=C(Cn1c(-c2nnc(C3CCC3)o2)ccc1)Nc(cc1)cc(F)c1F,1 SA01-0734,CC(C)NC(c1c(C(CC2)CN2C(C2CCOCC2)=O)nc(N(C)C)nc1)=O,0 F6812-1609,FC(c1nc(N(CC2)CCN2c2nc(-c3cnccc3)ccn2)ncc1)(F)F,0 G672-0263,O=C(CN1c(cc(cc2)S(N3CCCC3)(=O)=O)c2N(CCCC2)C2C1=O)NCc1ncccc1,1 V011-6668,COc1ccc(Cn2c(C(N(Cc3ccco3)C(N3c(cc4)ccc4F)=O)=O)c3nc2)cc1,0 S259-1664,Cc1noc(C)c1CN(CCC1)CCN1C(NC1CCCCC1)=O,1 F5860-0300,Cc1noc(C)c1CN(CC1)CCN1C(Cc1cccs1)=O,1 C470-0665,CC(C)CCn1c(C(N(C)C(N2C)=O)=O)c2nc1CN(CC1)CCN1c(cc1)ccc1OC,0 Z1278946636,COc(cc1)ncc1NC(C(C1)C1(CC1)c2c1cccc2)=O,1 F6560-0370,O=C(NCc1ncccc1)N(C(CC1)C2)C1CC2Oc1ncccc1,1 F6521-8469,COc1cc(CCCC2(CNC(CCc(cccc3)c3Br)=O)O)c2cc1,1 F5097-2734,OC(CC1)CCN1C(Cc(cc1)ccc1NC(c1cc(cccc2)c2o1)=O)=O,1 D437-0239,Cc1c(-c(cc2)cc(N3)c2OCC3=O)nc(NC(CCC2CCCCC2)=O)s1,0 L694-0175,CCN(c(ccc(S(N(CC1)CCN1C(c1c(C)ccs1)=O)(=O)=O)c1)c1O1)C1=O,0 F6658-5637,Cc1c(C)ncnc1OCC1CCN(Cc2c(CCC3)c3nn2C)CC1,1 F6519-6185,O=C(NCC(c1ccco1)n1nccc1)Nc1c(C(F)(F)F)cccc1,0 F6484-0264,O=C(c(s1)ccc1Cl)NC(CC1)CCC1Oc1nccnc1,1 Y600-2919,CN(c1c(C(N2C)=O)[nH]c(N(CC3)CCN3C(CN(CC3)CCC3C(N)=O)=O)n1)C2=O,1 Z2187800756,CCC(C)(C1)CN1C(CCc1nc(-c2ccco2)no1)=O,1 F2744-0212,CCOc(cc1)cc2c1nc(NC(C(C=C1)=CN(Cc3cc(F)ccc3)C1=O)=O)s2,1 F2972-0298,Cc1c2nc(N(CCCn3cncc3)C(c(cc3)cc4c3OCCO4)=O)sc2c(C)cc1,1 SB71-0747,Cc1nccc(C(N2Cc3cc(C(NC4CCCC4)=O)nn3CC2)=O)c1,1 F537-0382,CCC1Oc(ccc(S(N(CC2)CCN2C(COc(cc2)ccc2Cl)=O)(=O)=O)c2)c2NC1=O,0 Z3341389966,CC(C)c1ncc(CN(C=Nc2c3c(C)ns2)C3=O)s1,0 Z1175231948,CCN(C(CCN1c2ccccc2)C1=O)C(c1ccc(CNC(N)=O)cc1)=O,0 SB94-0307,Cc1ccc(CN2CCC(CN(CC(C3)C(N4CCOCC4)=O)C3=O)CC2)o1,1 F6518-4561,Cn1nccc1-c1ccc(CCNC(C2CCC2)=O)cc1,1 F0630-1662,O=C(C1(CC(C2)C3)CC3CC2C1)N1C(SCc2cnccc2)=NCC1,1 Z220351418,NC([C@H](Cc1c(C2)cccc1)N2C(c1cc(CCC2)c2cc1)=O)=O,1 SC98-0037,Cc1cn(CC(N(CC2)Cc3c2n(C)nc3-c2ncc(C)o2)=O)nc1,0 Y041-0351,O=C(c(ccc(N(CCCC1)S1(=O)=O)c1)c1Cl)NC1CCCCC1,1 Z2272339216,Cc1c(C(CCC2)N2C(c2c(C)nc(C)cc2)=O)c(C)n[nH]1,0 Z4884575356,N#Cc1cc(Br)cc(S(NC(C2(CC2)c(ccc(Cl)c2)c2F)=O)(=O)=O)c1,0 P659-2854,Cc1nc2nc(CN(CC3)CCN3c(cccc3)c3Cl)nn2c(N(C)C)c1,0 Z4914935312,OC(CNS(c1cccc(Cl)c1Cl)(=O)=O)c1cccc2ccccc12,0 F6798-4859,Cc1cc(C(N(C2)CC(C3)C2CN3C(NC2=O)=NC(C)=C2F)=O)ncc1F,1 Z1455186618,Cc(ccc(S(NC1CC1)(=O)=O)c1)c1C(N(CCC1)C1C(O)=O)=O,1 SC13-0540,Cc(ccc(F)c1)c1S(N(CCC1)CC1N(Cc1cnccc1)S(C)(=O)=O)(=O)=O,0 S951-5083,NC(C(CN(CC1)c(cc2)cc(C(F)(F)F)c2C#N)N1C(CC1CCCC1)=O)=O,1 F5461-1080,CCOC(CCC(N1CCN(Cc2nc(C(C)(C)C)cs2)CC1)=O)=O,0 Z316130150,O=C(C(CCC1)CN1c1ncccn1)Nc(cccc1)c1Oc1ccccc1,1 SA65-1513,CN(C)c1nc(CCC(CC2)CCN2C(CCc2nc(cc(cc3)Cl)c3[nH]2)=O)no1,1 F1899-1997,COc1cc(-c(cc2)nnc2SC2CCCC2)cc(OC)c1OC,1 F5596-0468,Cc(n(-c1ccccc1)nc1)c1C(N(CC1)CCC1c1nnc(-c2ccco2)o1)=O,1 2188-1919,C=CCSC(NC(CC1c(ccc(Cl)c2)c2Cl)=O)=C1C#N,0 SC21-0004,CCn(c(CC1)c2CN1C(COC)=O)nc2-c1ncc(C)n1CC1CC1,0 F6675-8481,CN(C(C1)CN1c1nccnc1C#N)S(c1c(C(F)(F)F)cccc1)(=O)=O,1 F0417-2570,CN(C(c1cc(C(F)(F)F)ccc1)=O)c1nnc(C2(CC(C3)C4)CC4CC3C2)s1,0 Z2924097772,CC(C)C(c1noc([C@@H](CC2)N(C)C2=O)n1)Oc(cc1)ccc1Br,0 Y044-3015,O=C(CC(c1c2cccc1)NC2=O)Nc1nc(-c2ncccc2)cs1,1 F6031-1250,OC(CN1CCN(CC(NCc2ccccc2)=O)CC1)C1CC1,1 Z1222839109,O=C(CNC(c1cccs1)=O)NCC1(CCOCC1)N1CCCCC1,1 F6510-2213,CCOc(cc1)ncc1C(NCCN(c(cc(cc1)F)c1N1C)S1(=O)=O)=O,0 K788-4718,O=C(C1=CNc(ccc(S(Nc(cc2)cc3c2OCCO3)(=O)=O)c2)c2C1=O)NCc1cccs1,1 Z1215597971,CN(CCN1CCOCC1)C(NC(CCC1)CN1c1ccccc1)=O,0 Z827640172,CCN(CCC#N)C(c1cc(Cl)cc(Cl)c1)=O,0 F6064-1623,CC(C)Sc1ccc(CC(N(C2)CC2c2nc(-c3cccs3)no2)=O)cc1,1 Z2295237843,Cc1cc(Br)c(CCN(CCS(CC(O)=O)(=O)=O)C2)c2c1,0 V016-9155,Cc1cc(-c2csc(N=C(CN(CCCOC)CC(c3ccccc3)O)N3)c2C3=O)c(C)cc1,1 F2391-0917,CCS(N(CC1)Cc2c1ccc(NC(c(ccc(OC)c1OC)c1OC)=O)c2)(=O)=O,0 SB32-0926,COC[C@@H](CN(C1)C(c2ccccc2)=O)[C@H]1c1nc(-c2ccccc2)n[nH]1,1 J106-0104,O=C(C(CC1=O)CN1c1n[nH]c2c1ccc(Br)c2)NCCc1ccncc1,1 Z2194518117,O=C(c1nn(cccn2)c2c1)NCc1ccccc1,0 C604-0036,O=C(CSC(N(CCCC(NC1CCCC1)=O)C1=O)=Nc2c1sc1c2cccc1)c(cc1)ccc1Br,1 Z96990334,CN(C)C(CNC(CSc1nnc(C2CC2)n1Cc1ccccc1)=O)=O,1 F2392-1507,O=C(C(NCc(cccc1)c1Cl)=O)NCC(c1cscc1)N1CCCCCC1,1 T505-1162,CCn1ncc(C(N2C(CCn3nnc(C(N4CCOCC4)=O)c3)CCCC2)=O)c1,0 Z1474291438,O=C(C(c1ccccc1)Oc(cc1)cc(Cl)c1Cl)NC(CCC(N1)=O)C1=O,1 Z1548448505,O=C(c(scc1)c1-n1cccc1)N(CC1)CC(C(N2)=O)N1C2=O,1 G516-0298,COc(cc1)ccc1-c1nc2ccccc2c(NCCCN(CC2)CCN2c2ccccc2)n1,0 Z1550267772,CC(C)(C(CCC1)N1C(c1cn(Cc2ccccc2)nn1)=O)O,0 F6442-2285,O=C(CCc(cc1)cc(C(F)(F)F)c1Cl)N(C1)CC1S(Cc1ccco1)(=O)=O,0 SC09-0317,C[C@@H](COc(cc1)c(C2)cc1-c1cncnc1)N2C(C1(CC1)c1ccccc1)=O,1 Z2904155853,CN(CC(Nc(cc1)ccc1Cl)=O)C(C(C1CC2)C1C2=O)=O,1 F3222-4916,O=C(CSc1nnc2n1C=CN(Cc(cc1)ccc1F)C2=O)NC1CCCC1,1 T159-0530,Cc1cnc(CC(CCC2)CN2S(c(cc2)cc3c2OCCO3)(=O)=O)n1CC1CC1,1 Z2960051056,Oc(nc(C1CC1)cc1)c1C(N1c(cccc2)c2N(CCCC2)C2C1)=O,1 Z4896599622,CCC(C)(CCC1)CN1C(c1nc2c(C(N)=O)ncn2c(-c2ccco2)c1)=O,1 SC97-0886,Cn1cnc(S(N(CC2)CC2(CN(Cc2cc(F)ccc2)CC2)NC2=O)(=O)=O)c1,1 F5857-1642,Cc1c(C(CNC(C2(CCOCC2)c2ccccc2)=O)O)scc1,0 Z1684581535,CC(c1nc(-c2cccc(C(C)(C(N3)=O)NC3=O)c2)no1)Oc1cc(CCC2)c2cc1,1 Y031-3435,COCCSc(cccc1)c1C(Nc(cccc1)c1C(NCC1OCCC1)=O)=O,0 Z2527313328,CN(CCO)Cc1cn(-c(ccc(Br)c2)c2Cl)nn1,0 Z3798905010,NC[C@](CC1)(C[C@H]1NC(C(c1c(C(F)(F)F)cccc1)O)=O)F,0 SB95-1224,Cc1n[nH]c(C(N(CCC2)CC2N(CCN2CCOCC2)C(C2CC2)=O)=O)c1,1 F6573-8906,CCc1nc(ccc(C(NCc2cncc(-c3cocc3)c2)=O)c2)c2s1,1 J093-0620,COc(c(NC(c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2n1)=O)c1)cc(Cl)c1OC,1 S649-0952,FC(c1ccc(CN(CC2)CCC2N(C2)C3(CCOCC3)C2OCC2CC2)cc1)(F)F,0 Z4387194528,N[C@H](C1)C[C@@H]1c1cccc(-c2cccc(N3)c2OCC3=O)c1,1 SB95-0292,Cc1noc(C)c1CC(N(CCC1)CC1N(CCN1CCCCC1)S(C)(=O)=O)=O,1 F6476-1450,O=C(CN1N=CC=CC1=O)N(CC1)CC1Oc(nccc1)c1Br,1 F5860-0243,CS(N(CC1)CCC1C(N1CCN(CC(F)(F)F)CC1)=O)(=O)=O,1 F6473-3584,COc(ccc(Cl)c1)c1C(N(C1)CC1N(C(CC1)=O)C1=O)=O,0 V012-6228,CCC(C)N(CC(N(CC1OCCC1)Cc1ccco1)=O)C(C1CC1)=O,0 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Z1606914064,COc(cc(cc1)S(Nc(cc2)ccc2O)(=O)=O)c1Br,0 S233-1683,O=C(c1ncccc1)NC[C@](CCC1)(CC2)[C@@H]1N(CC1CCCCC1)C2=O,1 F6554-4309,Cc1csc(C(N2Cc(cc(cc3)F)c3OCC2)=O)c1,0 Z908355806,CC(C(N(CC1)Cc2c1[nH]nc2)=O)NC(c(cc1)ccc1Cl)=O,1 F6488-1389,COc1nccnc1OC(CC1)CN1C(c1nc2ccccc2nc1)=O,1 Z3104379155,CC(c(cc(cc1)F)c1N(C)C)NC(N[C@H]1COCCC1)=O,0 S779-1053,Cc1cnc(-c2cnccc2)n1CC1CN(Cc2cccc(F)c2)CC1,0 Z1278199405,CN(C)CCn(cc1)nc1NC(N(CC1)Cc2c1ccc(O)c2)=O,0 F6474-3698,O=C(Cn1ncc(-c(cc2)ccc2F)c1)N(CC1)CCC1Oc1cccc2cccnc12,1 Z1455371305,OC([C@H](c1ccccc1)NC(c(cc1)ncc1Cl)=O)=O,0 Z3063655573,O=C(Cn1c(CCNC23CCOCC3)c2nc1)NC(CCC1)C11CCCCC1,1 F5939-1185,O=C(c1ncccc1)N(CC1)CCC1Oc(sc1ccc2)nc1c2Cl,1 Z839724310,CC(C)CNC(c(cc(C)cc1)c1OCC(NC(C)C1CC1)=O)=O,0 C794-0282,CC(C(NCc(cc(cc1)Br)c1OC)=O)N(C1=O)N=C(C)n2c1cc1c2cco1,0 F6519-7421,Cc1cc(C)nn1C(CNC(C1(CC1)c(cccc1)c1OC)=O)c1cscc1,1 Y501-1619,COc1ccc(C(c2c(CC3)c(cc(cc4)OC)c4[nH]2)N3C(NC2CCCCC2)=O)cc1,1 F6279-0270,O=S(Cc1ccc(C(F)(F)F)cc1)(NCC1(CC1)c1cccs1)=O,1 Z2230606724,Cc(cc1)cc(C(N2CC(CS(C)(=O)=O)CCC2)=O)c1-n1cnnc1,1 Z1222745573,CN(CCCc1ccccc1)C(c([nH]c1c(cc2)F)cc1c2F)=O,0 S615-0335,O=C(Nc(cc1)cc2c1OCCO2)N(CC1)CC1c1nc(CCOCC2CC2)no1,1 D473-0987,CC(CS(N1c(cc2)ccc2C(N(CC2)CCN2c2ncccn2)=O)(=O)=O)C1=O,1 Z2951486335,CCn1ncc(NC(NCc2ncc(C)cc2C)=O)c1C(F)(F)F,0 F614-0204,Cc(cc1NC(CCC2CCCC2)=O)nn1-c1c(cnn2-c3cccc(Cl)c3)c2ncn1,1 F6471-2549,O=C(c(cc1)cc2c1OCO2)N1C2C=CCC1CC2,1 Z1092091498,CN1CCN(Cc2cccc(CNC(N(CCC3)C3c3cccc(F)c3)=O)c2)CC1,1 Z2085855157,CC(C)(C)c1nnc(cc2)n1cc2C(N1CC2(COCCC2)OCC1)=O,1 F6496-3480,O=C(Cn1nnc2c1cccc2)N1CCC(CN(C(C=C2)=O)N=C2c2ccccc2)CC1,1 F9995-2670,CCOC(C(CN(C1)C(OC(C)(C)C)=O)C1C(OCC)=O)=O,0 Z1941162454,O=C(C(C1)Oc(cc2)c1cc2Br)NCCCn1cncc1,0 F1872-0917,O=C(CSc1nccn1Cc1ccco1)NCc(cc1)ccc1F,1 Z1929055511,COc1nc(C(N(CC2)CC2(C2)CNC2=O)=O)cc2ccccc12,1 Z3006379255,CCOC(C1)CC1C(N[C@H](Cc1c2cccc1)[C@@H]2N)=O,0 SB54-0371,CC(C)c1nnc([C@@H](C2)[C@@H](COC)CN2C(c2cccs2)=O)o1,1 Z1637907826,CCC1(CCC1)NC(Nc1cn(-c2ccccc2)nc1C)=O,0 SD67-0214,CC(C)CN(CC(N(CCC1)C2CN1C(c1n[nH]cc1)=O)=O)C2=O,1 F5141-0434,CSc(cccc1)c1NC(C(CCCC1)N1S(C)(=O)=O)=O,0 Z3579659056,CC(CNC(N1CCC1)=O)c(cc1)cnc1N(C)C,1 Z3305298209,Cc1csc(C(NC2CC(Cn3nncc3)C2)=O)c1Cl,1 F6471-2914,O=S(c(cccc1)c1Cl)(N1C2C=CCC1CC2)=O,0 Z2115412715,CC(C)(Cc1ccccc1)CNC(N1Cc(ccc(O)c2)c2OCC1)=O,1 SC15-0497,Cc(cc1)cc(Cl)c1NC(N1CCC(CN(CC(COC)C2)C2=O)CC1)=O,0 SB71-0072,CN(C)C(c1nn(CCN(C2)C(c3cc(cc(cc4)OC)c4[nH]3)=O)c2c1)=O,0 C188-0521,CC(C)(C(Nc1c(-c(cc2)ccc2OC)nc2n1ccc(C)c2)=O)Oc(cc1)ccc1Cl,1 SC73-0650,Cn1nc(C(NC2CCCCC2)=O)c2c1CC1(CCNCC1)OC2,1 Z3071553573,CC(C)n1c(CC(NCC(c2ccc(C)cc2)N(C)C)=O)nnc1,0 D750-0142,Cn1c(cccc2)c2nc1CCNC(CC1(CCCCC1)N(Cc1c2cccc1)C2=O)=O,0 F6203-0450,COCCNC(NCCC(CCO)c1ccccc1)=O,0 Y206-4956,CC(CCCC1)C1NS(c(cc(cc1)F)c1F)(=O)=O,0 S591-0073,CC(C)CN(C(C1)CN1C(c(cc1)cc2c1[nH]cc2)=O)C1CCOCC1,1 F6573-1716,Cn1ncc(-c2nccnc2CNC(Cn2nccc2)=O)c1,1 V015-1235,CC(C)CN(CCC(NC1CC1)=O)c1c(ccc(Cl)c2)c2nc(-c(cc2)ccc2F)n1,1 Z2196644725,Cn(c1c2c(NC(CC(Cc3ccccc3)O)=O)n[nH]1)nc2-c1ccccc1,1 F6482-3352,O=C(c1cccc2ccccc12)N(C1)CC1n1nccn1,1 F5868-0471,Cc1ccnc(OCC(N(CC2)CCN2c2nc(C)nc(N3CCCC3)c2)=O)n1,1 Z1526806779,O=C(C(CC1)CCC1(F)F)NC(CC1)CS1(=O)=O,1 Z1580806625,CCn1nc(C)c(NC(NCc2c(C)n(C)nc2C)=O)c1C,0 G603-0045,Cc(cc1)ccc1S(N(CCC1)CC1c1nc(-c2ncccc2)no1)(=O)=O,1 SA42-0797,CN(CC(C1)(CN1C(CC1CC1)=O)C1)C1c1noc(-c2ccccc2)n1,1 Z4739395867,CC(N1)=Cn2nnc(C(NC(C3)CN3S(c(cc3)ccc3OC)(=O)=O)=O)c2C1=O,1 F3202-0238,COc(ccc(Br)c1)c1S(Nc1ccncc1)(=O)=O,0 Z1651808249,O=C(Cc1cc(NC(C2)=O)c2cc1)Nc1cc(CCN2CCCC2)ccc1,1 4383-0168,CC(NC(NC1c(cc2)cc(OC)c2O)=O)=C1C(Nc(ccc(OC)c1)c1OC)=O,0 Z3071627284,Cn(c1c2cccc1)c(C(OC)=O)c2NC(C1OCCCC1)=O,1 S740-0736,COCCN(C([C@H](C[C@@H](C1)NC(c2cncnc2)=O)N1CC1)=O)S1(=O)=O,1 Z2725346973,CC(C)NC(CCC1)CN1C(C(C1C2)C1c1c2cccc1)=O,1 F6604-7702,CC(C)(C)C(C=C1)=NN(CC(C2)CN2C(C2CCC2)=O)C1=O,1 F6253-1435,O=C(CCN(C=Cn(c1c2)nc2-c(cc2)ccc2F)C1=O)N(CC1)CCN1C(c1ccco1)=O,1 Z3290588563,CCC(CC#N)NC(c1cncc(Br)c1N)=O,0 F6530-5877,COC(C(c1nc(-c2ccncc2)no1)=C1N2CCC1)=CC2=O,1 F2504-0051,O=C(C(NCC1OCCC1)=O)NCC(c1ccco1)N1CCOCC1,1 Z3217386641,CC(C)c1ccc(C(CO)N(C)S(c2cccc3cnccc23)(=O)=O)cc1,0 S646-0741,COCCC(N(CC1)CCC1N(CC12CCCCC2)C1c1ccncc1)=O,0 Y042-6676,N1(C(c2c(C1=O)ccnc2)=O)CCC(N[C@H](c1nc2c([nH]1)cccc2)C(C)C)=O,1 V017-6344,CCOc(cc(CN(CCCn1c2ccc1)C2c(cc1)ccc1F)cc1)c1O,0 CM3593-5198,C(C1CNCCC1)n1nnc(COc2cc(CCC3)c3cc2)c1,0 Z1587231878,Cc1nc2ccccc2c(NCC2CN(C)CCC2)c1,1 Z1918038663,Cc(cc1)cc(F)c1S(NCC(C(O)=O)c1ccccc1)(=O)=O,0 E787-1066,Cc1ccc(C(CC(N(CC2)CCN2C(c2ccco2)=O)=O)N(Cc2c3cccc2)C3=O)cc1,0 Z1639349981,CC(c1cncc(F)c1)NS(c1cnc2onc(C)c2c1)(=O)=O,1 F6506-5157,CC(C)n1cnc(S(NCC(C2CCOCC2)(c2ccccc2)O)(=O)=O)c1,1 Y030-9095,CCCC(Nc(cc1)ccc1C(NCC(C)C)=O)=O,0 Z1609506555,CCCCCn1c(cccc2)c2c(C(NCc2nc(C)no2)=O)c1,1 Z1643510156,CC(C(NC1CCCC1)=O)N(CC1)Cc2c1c(OC)ccc2,1 Z2964369370,CCC(CC)(CO)C(N(C[C@@H]1CCC2)C[C@@]12c1nnc(C2CC2)o1)=O,0 D216-2016,Cc(cc1)cc(C2=O)c1NC=C2NC(N(CCC1)CC1c1ccccc1)=O,1 Z240347104,CC(C)n1nccc1NC(c1c(c(C)nn2C)c2nc(C)c1)=O,0 F835-0563,Cc1c(CSC(n(c2c3)nc3-c3cccs3)=NNC2=O)nc(-c2ccccc2)o1,1 F2410-0957,O=C(C1CCCC1)Nc1c(C(Nc(cccc2)c2F)=O)oc2c1nccc2,1 Z2763665341,CCC(C)(C(N1c2csc(C)c2)=O)NC1=O,0 F3095-4218,CC(C)c1cccc(C(C)C)c1NC(c1ccncc1)=O,0 Z354529136,O=C(CCC(Cc(cccc1)c1N1)C1=O)N(CCC1)C1C(NC1CC1)=O,1 Z1175489016,CNC(C(CCC1)CN1C(Cc(cc1)cc2c1OCC2)=O)=O,0 Z1658135071,O=C(C(CC1=O)CN1c1ncccc1)NOC1COCC1,1 Z1724309778,COC1(CCCCC1)C(NC(CC1)CCN1c(cccc1)c1OC)=O,1 Z2374345224,Cc(cc(cc1)OC)c1S(NC(C1CC(C2)C2CC1)=O)(=O)=O,0 S700-0848,Cn1cnc(S(N(C2)CC2c2nc(CCOCC3CC3)no2)(=O)=O)c1,1 Z2296019356,CC(CCC1)CC1C(NC(C(O)=O)c(cc1)cc2c1OCC2)=O,1 F6788-4005,FC(c1nc(C2CC2)nc(N2CCN(CCn3nncc3)CC2)c1)F,1 F6806-8078,CC(C)(C)NC(C(CC1)CN1c1nc(c(F)ccc2)c2s1)=O,0 F5788-1256,COc(ccc(NC(CN(CCN1c(cccc2)c2F)C1=O)=O)c1)c1Cl,0 SA65-1501,CN(C)c1nc(CCC(CC2)CCN2C(C2(CC2)c(cc2)ccc2OC)=O)no1,1 SA93-0410,NC(C(CC1CC1)(CCC1)CN1C(Nc1cccc(Br)c1)=O)=O,0 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Z2188435596,O=C(C(CCC1)c2c1[nH]nc2)NOC1CCC1,1 Z1232176477,O=C(CN(CC1)CCS1(=O)=O)Nc1n[nH]c(C2CCCCCC2)c1,1 S904-5361,Cc1n[nH]c(C(N2Cc3nnc([C@H](C4)N(Cc5ccccc5)C[C@H]4O)n3CC2)=O)c1,1 SD03-0920,Cc1noc(C(C2)N(CC(NC3CCC3)=O)CC2(CC2)CCN2C(C2CC2)=O)n1,1 F6469-1036,Cc1nc(-c(cccc2)c2NC(C(CC2=O)CN2c2cc(F)ccc2)=O)cs1,1 F6612-0011,O=C(c1cscc1)N1c2nc(N3CCOCC3)ncc2CCC1,1 Z1212310183,Cc(cc1)ccc1OCC(N(CC1)CCN1C1CN(C)CCC1)=O,1 J006-2730,CC(C)c1noc(C2N(Cc3c[nH]nc3-c3cc(C)c(C)cc3)CCC2)c1,0 F667-0245,CC(N(C)C(N(C)C1=O)=O)=C1N(CC1)CCN1C(c1cc(cc(cc2)Cl)c2[nH]1)=O,1 F5759-0407,CC(c1cc(Nc2ncnc(-c(cc3)ccc3OC)c2)ccc1)=O,0 F6756-2457,CN(C(C(C1)C2CN1c1nc(cncc3)c3s1)=O)C2=O,1 F6619-6651,C(C1)Cc2c1c(N(CC1)CCN1c1ncnc(-n3nccc3)c1)ncn2,1 F6795-5530,Cc(cnc(SC)n1)c1OCC(CC1)CCN1c1nc(C)nc2c1cnn2C,0 Z2078658305,O=C(C(N1)=Cc(cccc2)c2C1=O)N[C@H](C1)C[C@@H]1c(cc1)cc(Cl)c1F,0 SC09-0260,C[C@H](COc(cc1)c(C2)cc1-c1cncnc1)N2C(c(cc1)ccc1OC(F)(F)F)=O,1 F6475-4330,O=C(c(cn1)cc(Cl)c1OC1CCOCC1)N1CCN(Cc2ncccc2)CC1,1 Z1483059605,CC(C)(COc1ncc(C(F)(F)F)cc1)NC(C1OCCN(C)C1)=O,1 F870-1298,O=C(c(cc1)ccc1Nc1nc(-c2ccccc2)ncc1)Nc(cc1)cc(Cl)c1F,0 S388-0774,COc1cccc(CCC(N(CC2)CCC2(NC2=O)NN2c2cccc(F)c2)=O)c1,0 Z2914485521,CC(C)n1c(NC(C(CCC2)N(C)C2=O)=O)nc2c1cccc2,0 F2257-0257,O=C(Cc(cc1)ccc1F)Nc(cc1)cc(C2)c1NC2=O,0 F6064-4671,CCOC(CCC(N(C1)CC1c1nc(-c2cscc2)no1)=O)=O,1 SB95-1367,CS(N(CCN1CCOCC1)C(CCC1)CN1C(NC1CCCC1)=O)(=O)=O,1 F6438-0088,Cc1nc(N2CCCC2)nc(C)c1NC(c1ncccc1)=O,1 F2443-0017,CC(Nc(cc1)ccc1S(N(CC1)CCN1c1nc(C)nc(OC)c1)(=O)=O)=O,0 F6481-0754,O=C(Cc1cccs1)N(CC1)CCSC1c(cccc1)c1Cl,1 Z1258036857,CC(CNC(NCc1cc(-n2cncc2)ncc1)=O)c1cc(C)ccc1,1 F6793-7175,O=C(c1ccc(Cn2cncc2)cc1)N1CCN(CC(F)(F)F)CC1,1 F6564-2600,O=C(c1cscn1)NCCN1N=C(C2CC2)C=CC1=O,1 Z4924723263,Cn(ccc1ccc2)c1c2S(Nc(cc1)cc(Cl)c1F)(=O)=O,1 F2543-0774,CC(C1)OC(C)CN1C(CSC(N=C1N2C=CC=C1C)=NC2=O)=O,1 Z2959247773,COc1ccc([C@H](C2)[C@@H]2NC(c2ccc(Cn3nncc3)o2)=O)cc1,1 Z4367996940,CC(C)CC(NS(c(ccc(C)c1)c1Cl)(=O)=O)=O,0 F5017-0867,O=S(c(cc1)cc2c1OCCO2)(NCC1CCN(Cc2cccs2)CC1)=O,1 L644-0669,O=C(c(cc1)ccc1Br)Nc(cc1)ccc1N(C=CC=C1C(NC2CCCCC2)=O)C1=O,1 Z3105619775,Cc1n[nH]c(C(CC2)CCN2C(C[C@@H](CCc2ccccc2)N)=O)c1,1 F5966-0042,COc(ccc(Cl)c1)c1NC(NCC1(CO)CC1)=O,0 Z4662165669,CCCOC(N1CCN(CC(Nc2c3cccc2)=NS3(=O)=O)CC1)=O,0 F6438-3536,CN(C)c1nc(CNC(Cc(cccc2)c2F)=O)nc(N(C)C)n1,0 F3095-4475,Cc1cc(C)c(C(NCCc2ccccc2)=O)c(C)c1,0 Z4992009684,Cc(cc(cc1)-c2ccccc2)c1-c1cn(CCCOC)nc1,0 Z3644074805,COc1c(C(OCC2CC2)=O)c2cccnc2cc1,1 F6725-0011,O=S(C(CC1)CCN1c(ccnc1)c1Cl)(c1ccccc1)=O,1 G702-1679,Fc(cc1)cc(F)c1Nc1c(CCCC2)c2nc2nc(-c3ccco3)nn12,0 Z1312743030,NC(c1nccnc1C(N(CCC1)CC1c1nnc2n1cc(C(F)(F)F)cc2)=O)=O,1 SA67-1137,O=C(C1CCCC1)N1CC(CCc2noc(-c(cc3)ccc3F)n2)CC1,1 G658-0769,CCC1Sc(cccc2)c2N(CC(Nc(ccc(OC)c2)c2OC)=O)C1,1 Z1895244813,Fc1cccnc1OC1CCN(Cc(cc2)ncc2Cl)CC1,0 Z4661212450,Cc([nH]nc1)c1C(NCC(CCC1)CN1c1nc(cccc2)c2s1)=O,1 F5012-0088,CC(C)(Cc1ccc2)Oc1c2OCCCS(N(CC1)CCN1c1ncccn1)(=O)=O,1 Z1273191783,CC(C)C(C(N(CC1)CCN1C(CC1)CS1(=O)=O)=O)c1ccccc1,1 F5857-2368,OC(CNC(CSc(cc1)ccc1F)=O)c1cccc2ccccc12,1 G857-1728,OCCN(CC1)CCN1C(c(sc1nc(-c2ccco2)nn11)c1O)c(cccc1)c1Cl,0 F5496-1643,CCOC(N(CC1)CCC1c1nnc(Cc(cc2)ccc2OC)s1)=O,0 Z3325060722,NC1(CCC1)c1n[nH]c(-c2cccs2)n1,1 Z1753051217,CCC(C1)(CN1c1cc(C(F)(F)F)nc(-c2ccncc2)n1)O,1 F0537-0449,Cc1cccc(NC(c2cc(CCCC3)c3cc2)=O)n1,1 Z1669868808,O=C(Nc(cc1)cnc1Oc1cccc(F)c1)N(CC1)CC2N1CCOC2,0 F3398-0109,Cc(cc1)ccc1-c1csc2c1N=CN(CC(N1CCCC1)=O)C2=O,0 F6677-0403,Cc1nccn1CC(C1)CN1c1nccc(C(F)(F)F)n1,0 C276-0741,CC(C)(C1)CC(NC(CC2c3cccc(Br)c3)=O)=C2C1=O,0 F6745-4811,C(C(C1)N2CC(CCC3)C3C2)N1c1ncnc2ccccc12,1 Z1232626712,Cc1ccnc(N(CC2)CCN2C(CN2CCOCC2)=O)n1,0 F6190-1601,COc1ccc(CCC(NCCC(c2cccs2)O)=O)cc1,1 C548-3563,O=C(C1CCC(CNS(c2cccc3nsnc23)(=O)=O)CC1)NC(CCC1)c2c1cccc2,1 Y043-8138,O=C(CC(C(Nc1c2cccc1)=O)NC2=O)N(CCC1)CC1c1nc(cccc2)c2s1,1 F6764-3970,Cn1nccc1C(N(CC1)CCC1c1nc2ncccc2cc1)=O,1 S721-0719,O=C([C@H](C[C@@H](C1)Oc2cnccc2)N1C(c1cocc1)=O)N1CCCC1,1 Z1514474804,CC(C1c(cccc2)c2OC1)NC(C1=CN=C2SC(Cc3ccccc3)=CN2C1=O)=O,1 SC44-0411,Cc1nn(C)c(C(N(CC2)CCC2(C2)OCCC2OCC(N2CCOCC2)=O)=O)c1,1 F6561-8074,CN(C=CC=C1C(N(CC2)CC2N(CCO2)C2=O)=O)C1=O,1 F6519-3745,Cc1cc(C)nn1C(CNC(C(Oc1c2cccc1)=CC2=O)=O)c1cccs1,1 Z3640393821,CC(C)(CC(CC1)(F)F)C1NCC1(CC1)n1nncc1,1 F5285-0004,FC(c(cc1)ccc1Nc1ncnc2c1cn[nH]2)(F)F,0 Z1289569684,CC(c(cccc1)c1OC)NC(CN1CC2(CCCCC2)OCC1)=O,1 Z335447622,CC(C)c(n(-c(ccc(Cl)c1)c1Cl)nc1)c1C(O)=O,0 Z4908742128,CC(C)c1c(CNC(C2(C(CC3)CC3C2)O)=O)cccc1,0 F6200-1367,OC(Cc1ccccc1)CNC(C(Nc(cccc1)c1Cl)=O)=O,0 Z2448358381,O=C(CC1CC(CC2)NC2C1)Nc(cc1)ccc1-c1cnc(C2CC2)o1,1 F6559-2490,Cn(c(C(NC(CC1)CN1c1nccn2c1nnc2)=O)c1)nc1-c1cccs1,1 S752-1135,CC(C)N1CCC(Cc2ccc(CCNC(CN(CCC3)C3=O)=O)cc2)CC1,1 Z2953328651,C[C@@H](c1cnccc1)NC([C@H](C1)[C@H](C(F)F)Oc2c1cccc2)=O,0 Z3396331087,O=C(NCCC(C1)c(cccc2)c2N1c1ncnc2c1cn[nH]2)Nc(cc1)cc2c1OCCCO2,1 Z1410130430,CNC(CN(CC1)CCN1C(c1cc(-c(cc2)ccc2Cl)cnc1)=O)=O,0 G810-0438,O=C(c(cc1)ccc1Cl)N(CC1)c2c1cc(CNS(c1cccc3nsnc13)(=O)=O)cc2,0 F6275-0165,O=C(Cc1cccc2ccccc12)N(CC(F)(F)F)C1CCOCC1,1 Z3409924679,[O-][N+](c(cc1)cc2c1c(C(N(CC1)Cc3c1ccc(F)c3Br)=O)c[nH]2)=O,0 F6471-5182,CCCn(c(C(N(CC1)CC1n1nncc1)=O)c1)c(N(C)C(N2C)=O)c1C2=O,1 SC10-0326,O=C(C1CC1)N(CC1)CC1N(CCCN1CCOCC1)C(C1CCC1)=O,1 F6514-8944,CCOc(cccc1)c1NC(NCc1cc(-c2cnccc2)ncc1)=O,1 Z1198605846,Cc1cccc(NC([C@H](CCC2)N2C(C2CCCC2)=O)=O)n1,1 6466-0061,CC(CC1)Cc2c1c(C(N)=O)c(NC(Cn1nc(C(F)(F)F)c3c1CCCC3)=O)s2,1 Z1580063590,COc(cc1)ccc1NC(CCN(CC1)CCC1Oc1cc(C(N)=O)ncc1)=O,0 F6549-8790,O=C(NCc1cccs1)N(C(CC1)C2)C1CC2Oc1cnccc1,1 E852-0261,CC(Cn(c1c2)nc2C(N(CC2)CCN2c(cc2)ccc2F)=O)(C(NC2CCCC2)=O)N(C)C1=O,1 Z2304035729,CCO[C@H](C1)C[C@H]1NC(C1C(C)(C)C1)=O,0 V020-2561,COc(ccc(NC(c(cccc1)c1Cl)=O)c1)c1N(CCCN1Cc(cccc2)c2F)C1=O,0 F6178-3284,O=C(Cc1cccc2ccccc12)NCC(CC1)CCN1C(c1ccncc1)=O,1 F6658-5628,Cc1c(C)ncnc1OCC1CCN(CC(C(F)(F)F)O)CC1,0 Z1471308917,CC(C)c(cc1)ncc1C(NCc1nnc(C)n1C)=O,1 Z4954144005,O=C(CN(CC1)CCN1C(CC1)CN1C(c1cccs1)=O)N1CCC1,1 Z1576016500,O=C(NC1CN(CC(F)(F)F)CC1)N1CCC(Cc2cnccc2)CC1,1 Z3278074012,Cc1cccc(S(N(C[C@@H]2c3cn(C)cn3)C[C@@H]2N)(=O)=O)c1F,0 Z2454154015,O=C(Cn1nc(C(F)(F)F)cc1)N(CC1)C[C@H]1Oc1ccccc1,1 Z45529908,C=CCNS(c(cc1)ccc1[N+]([O-])=O)(=O)=O,0 F6360-9157,O=C(CSC1CCCC1)N(C1)CC1Oc1cnccc1,1 G505-0255,COc(cc1)ccc1S(N(CCC1)c(cc2)c1cc2NS(c1ccccc1)(=O)=O)(=O)=O,0 L907-0180,Cc(cc1)cc(C)c1-c1coc(-c(cc2)ccc2NC(Nc2c(C)cccc2)=O)n1,0 Z4908740394,CC(C)c(cc1)ccc1NC(NC(CC1(C)C)C1OC)=O,0 V001-2407,O=C(c1ccc(C(F)(F)F)cc1)N(CCC1)C1c1nc(cc(cc2)-c3ccccc3)c2o1,0 Y502-8299,CS(N(CC1)CCC1C(NCCCn1nc(C(F)(F)F)cc1C1CC1)=O)(=O)=O,1 S736-0259,COC(C1)C(CC2)(CCN2C(C2(CC2)c2ccccc2)=O)N1c1cccc(F)c1,0 Z1203159492,Cn(c(C(O)=O)c1)c(cc2)c1cc2OC,0 Z1139293697,O=C(c(cccc1)c1OC(F)F)N1Cc2nncn2CC1,0 S988-0125,Cc1noc([C@@](CN(C2)C3CCOCC3)(C3)[C@@H]2CN3C(c2nccnc2)=O)n1,1 Z2974831501,NS(C1(CNc2nc(cccc3F)c3s2)CCC1)(=O)=O,1 F6438-3859,O=C(c(cc1)ccc1-n1cccc1)NCc1nc(N2CCOCC2)nc(N2CCCC2)n1,1 Z1530724071,COc1c(CC(Nc2cncc3ccccc23)=O)cccc1,0 Z2711352070,O[C@@H](CCC1)CN1C([C@@H](CN(Cc1ccccc1)C1)[C@H]1C1CCCC1)=O,1 F6796-6908,Cc1ncnc(N(C)CC(CC2)CCN2c(cc2)nn3c2nnc3C(F)(F)F)c1F,1 F3101-0010,Cc(ccc(N(C(CS(C1)(=O)=O)C1N1c2cc(C(F)(F)F)ccc2)C1=O)c1)c1Cl,0 F3308-2409,FC(c1nc2ccccc2c(N2CCOCC2)n1)(F)F,0 SB32-0121,Cc1n[nH]c([C@@H]2[C@@H](COC)CN(Cc3ccccc3)C2)n1,0 Z4521092831,NC(Nc1cc(NC(Cc2n[nH]c(C3CC3)n2)=O)ccc1)=O,0 F6451-2626,COC(CNC(c1ccno1)=O)c(cccc1)c1Cl,0 F1107-0105,COc(ccc(C(Nc(cc1)ccc1OCc1ccccc1)=O)c1)c1OC,1 F6471-2743,O=C(c1cc2c(-c3ccccc3)onc2cc1)N1C2C=CCC1CC2,1 K785-0317,Cc(n1nc2)c(Cc(cc3)ccc3Cl)c(C)nc1c2C(NCCC1=CCCCC1)=O,0 E959-0274,O=C(C(CCC1)CN1S(c1ccc(C(C=C2)=NNC2=O)s1)(=O)=O)Nc(cc1)ccc1F,1 Z3243746252,COc(c(S(Nc(cc1)ccc1Cl)(=O)=O)c1)cc(Cl)c1OC,0 Z2928066511,OC(C1(CNS(c(occ2)c2Br)(=O)=O)CCC1)=O,1 F6521-8947,OC(CNC(C1(CCCC1)c(cc1)ccc1Cl)=O)(C1)Cc2c1cccc2,1 E786-0506,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(CCC(N(CC1)CCN1c1ccccc1)=O)(=O)=O,0 Z3054382456,CCOC(c1c(C2CC2)c(NC(C2C(C)C2)=O)n[nH]1)=O,1 F5115-0185,O=C(Cn1c(cccc2)c2c(-c2nnc(-c3ccco3)o2)c1)N1CCOCC1,1 F2493-1650,CSc(cccc1)c1C(NCc1noc(-c2ccco2)c1)=O,1 F6439-3997,CS(N(CC1)CCC1C(NCCn(cc1)nc1-c1ccncc1)=O)(=O)=O,1 SD61-0019,O=C(C(C1)C2(CCC2)CN1c1ncccn1)NC1CCCC1,1 SA24-0016,Cc1cccc(-c2c(C(N(C3)CC3N(C3)[C@H](CO)CC3(F)F)=O)nco2)c1,1 F6485-1447,CC(NC(CCSC)C(NC(CC1)CCC1Oc(nc1)ncc1F)=O)=O,0 SA99-0835,NC(C(CC1CC1)(CC1)CCN1C(CC1)CCN1C(Nc(ccc(Cl)c1)c1F)=O)=O,0 F6515-2430,COc1cc([nH]c(C(N2C(Cn3nccn3)CCC2)=O)c2)c2cc1,1 Y031-4601,CCC(C)(C)NC(C(CC1)CCN1C(C(CC1=O)CN1c1ccc(C)cc1)=O)=O,0 F6240-6912,COc(cccc1)c1OCCNC(c1cccc(-n2c(S(C)(=O)=O)ncc2)c1)=O,1 S615-0674,CC(C)S(N(CC1)CC1c1nc(CCOCC2CCOCC2)no1)(=O)=O,0 Z2204934138,CC(C)(C1)C(C2CC2)N1C(c(cccc1)c1-n1nccc1)=O,1 Z1400421303,COc(cccc1)c1N(CCC1N(CC2)CCN2C(c2ccccc2)=O)C1=O,1 Z1411374090,O=C(C(C1)CN(C2CCCCC2)C1=O)NS(c1nccnc1)(=O)=O,1 S571-0311,Cc1ccc(C)n1-c(cc1)ccc1C(NCC1(CCC(N2C)=O)C2=CCC1)=O,1 8016-4401,CC(C(O)=O)NC(c1ccc(C#CC(C)(C)O)s1)=O,0 Z1870294633,CC(CC1)(CN1C(c1nn(CCCO2)c2c1)=O)F,0 F5313-0627,O=C(CC(c1ccccc1)c1ccccc1)N(CC1)CCN1c(cc1)nn2c1nnc2,1 F6441-6788,COc(cc1)ccc1S(C(CC1)CCN1S(c(cccc1)c1Cl)(=O)=O)(=O)=O,0 F6683-1868,Cc(cncc1)c1OCC1CCN(CC2CC2)CC1,0 F6225-1301,CN(CC(NCc1nc(-c2ccccc2)no1)=O)c1nc(c(C(F)(F)F)ccc2)c2s1,1 Z979612504,CCOC(CC1)CCN1C(NC(CC1)Cc2c1cccc2)=O,1 F6359-1063,Cn1nnc(C(N(CC2)CCC2Oc(nccc2)c2Cl)=O)c1,1 F6560-3060,O=C(Cn(cc1)c2c1cccc2)NCc1cn(-c2cccs2)nn1,1 F2805-1654,CN(c1nccc(SCC(NCc2ccco2)=O)c1C(N1C)=O)C1=O,1 Y043-1032,CC(C)c1cc(C(Nc2nnc(C3CC3)s2)=O)c(cnn2C(C)C)c2n1,1 Z3299566782,CC(C(NCC(C)(C1)OCCN1C(Cc1ccccc1)=O)=O)OCC#C,0 8009-2084,CC(C(C(c(cc1)ccc1OC)N(CCc1ccccc1)C1=O)=C1O)=O,0 F6489-2276,Cc(n(C)nc1C)c1S(N(CC1)CC1Oc(cc1)nnc1N(C)C)(=O)=O,1 F6442-0345,O=C(CN(C=Nc1c2cccc1)C2=O)N(C1)CC1S(c(cc1)ccc1F)(=O)=O,1 S812-0505,Cn1cnc(C(N2C(C3CCCC3)c3nccn3CCC2)=O)c1,1 S928-4472,COCC(N1CC(Cc2nnc(-c3ccccc3)o2)CC1)=O,0 Y205-5257,Cc(cccc1)c1-c1nc(CSC(N2)=Nc(sc3c4CCCC3)c4C2=O)cs1,1 G346-0385,O=C(C1CCC(CN(C(c(scc2)c2N2Cc3ccccc3)=O)C2=O)CC1)N1CCCC1,0 Z1645579081,O=C(c(cc(c(N1)c2)OCC1=O)c2Br)NC(C1)CNC1=O,1 Z2037435095,Cc1cc(C)nn1-c1ccc(CCNC(C(N2CC(CO)CC2)=O)=O)cc1,1 Z1657523633,Oc(cccc1cc2)c1nc2N(CC1)CCC1C(N(C1)CC1F)=O,1 S959-0643,O=C(c(cc(cc1)F)c1F)NCCN(CCC1N2CCCC2)C1=O,1 Z2905848662,CCO[C@@H](COC1)[C@H]1n1nnc(C(N(C)c(cccc2)c2F)=O)c1,1 Z2179933347,Cc1cc(CNc2nc(OC)cc(OC)n2)cc(N2CCCC2)n1,0 F819-0100,O=S(c(cc1)ccc1-c1noc(CCc2c[nH]c3c2cccc3)n1)(N1CCCC1)=O,1 Z4108737695,CC(C)c1cc(CN(C(Cc(cc2)ccc2F)=NO2)C2=O)n[nH]1,0 Z603212448,O=C(Nc1ccccc1)N(CCC1)C1c(cccc1)c1Cl,0 SD22-1022,COC1(CC1)C(C1)(CN1C(CC1CC1)=O)NC(c1ccccc1)=O,1 F6525-7197,Cc(n(CCNC(c1nc(cccc2)c2s1)=O)nc1C)c1-c1ccco1,1 F6472-0779,O=C(c(cccc1)c1Br)NCCSC1CCOCC1,0 S480-0203,CC(C)CCNC(c1ccc(CN(C(C(CC2)(CCS2(=O)=O)N2)=O)C2=O)cc1)=O,0 F6473-4225,O=C(c1cc(Br)cnc1)N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O,0 Z1492645562,CCc1nnc(CN(CC2CC(N(C)C)=O)c(cc3)c2cc3Cl)o1,0 Z4954139000,O=C(Cn(cc1)c2c1cccc2)NCC(N1c(cccc2)c2OCC1)=O,1 Z1784140539,CN(CCN(C(c1c2cccc1)=O)C2=O)C(C(C1CCCCC1)O)=O,1 F6439-1164,O=C(c1ccco1)NCCn1nc(C(F)(F)F)c2c1CCCC2,1 Z1024052734,Cc1cc(C)nn1Cc1cccc(C(N(CC2)CCC2C(c(cccc2)c2N2)C2=O)=O)c1,0 SC11-1443,Cc1nn(C)cc1C(N(CCC1)CC1N(CCCN1CCCC1)C(COC)=O)=O,0 F5857-2653,OC(CNC(NC(c1ccccc1)c1ccccc1)=O)c1cccc2ccccc12,1 Z2701055878,CC(Nc(cc(cc1)NC(CC(C2CCC2)C2CCC2)=O)c1Cl)=O,1 F1909-1853,COC(C1(CN(Cc2ccccc2)C2)C2CCCC1)=O,0 Z1175490033,CNC(C(CCC1)CN1C(CCc1nc(cccc2)c2o1)=O)=O,1 SA04-1149,Cc1cc(C)nn1CC(N(CCC1)CC1c1nc(C)ncc1CO)=O,1 S896-0673,CCC(C)NC(NC(CC1)CCN1c1nc(C2CCCC2)nc2c1CCOCC2)=O,0 F5686-0128,Fc1cccc(Cl)c1CSc1ncnc(N2CCOCC2)c1,1 F6806-6982,Cc(c1ccccc11)nnc1N1CC(C(N2CCSCC2)=O)OCC1,1 F6374-1427,Cc1cc(C(N2CCC(CSc3nccn3C)CC2)=O)no1,1 F2414-0083,O=C(C1Oc(cccc2)c2OC1)Nc1c(CCCC2)c2no1,1 C614-0551,CC(c1cccc(NC(c(cccc2)c2C2=O)N2c2nccc(C)c2)c1)=O,0 SD12-0034,CCn(cc1)nc1C(N(CCN1)C(Cc2nc(C)no2)C1=O)=O,1 F6445-3497,Cn(c(C(NCCCc1cn2ncnc2nc1)=O)c1)nc1-c(cc1)ccc1F,1 F2302-0507,COc1cc(Cn2c(cccc3)c3c(CC(NCC3OCCC3)=O)c2)cc(OC)c1,1 F6123-0447,CC(CCOC)(CNC(NCc(cc1)ccc1OC)=O)O,0 Z2831788165,OC(C1(CC1)NS(c1ccns1)(=O)=O)=O,0 D715-2604,CC(C(O)=O)Oc(cc1)c(C)c(O2)c1C(CCC1)=C1C2=O,0 F6471-5279,O=C(c(cccc1)c1Br)N(CC1)CC1n1nncc1,0 F6812-1549,C(c1csc(C2CCCC2)n1)N(CC1)CCN1c1nc(-c2ncccc2)ccn1,1 S823-2476,OC[C@@H](CN(C1)C2CCOCC2)[C@H]1NC(c(cc(cc1)F)c1F)=O,0 S724-2168,CN(CCOC)C(c1cn(C(C2)CN2S(c2cccc3cccnc23)(=O)=O)nn1)=O,1 Z3391648048,CC(CN(C)c1nccc(Br)c1)c1nnn[nH]1,1 F6089-9489,O=C(c(cc1)cc2c1ncs2)Nc(cc1)cc2c1OCCC(CCCC1)N1C2=O,1 SD07-0156,CC(C)C(NCc1c(COC(CC2)(CN2C(c2ccc(C(C)C)cc2)=O)C2)n2nn1)=O,0 F6543-1631,Cn1nc(C2CN(Cc3ccncc3)CCC2)cc1,1 Z1368926427,CCN(C(C(C1)N2CCN1C(C1(CC1)c1cc(C)cc(C)c1)=O)=O)C2=O,1 P114-1709,CC(C)n1c(nccc2)c2c(C(CC2)=CCN2S(c2cccc3cccnc23)(=O)=O)c1,1 F0382-0070,Cc1cc(NC(c(cc2)ccc2C#N)=O)cc(C)c1,0 F6523-3801,O=C(Cn1cccc1)N(CC1)CC2=C1N=C(C=CC(Cl)=C1)N1C2=O,1 Z365568102,CCc1n[nH]c(C(N(CC2)CCC2N(c(cccc2)c2N2)C2=O)=O)c1,1 Z2916312254,CC(SC1=NC=C2C(N(C3CCC3)c3ccccc3)=O)=CN1C2=O,1 Z2118870768,CC(C)(C)[C@@H](C(N)=O)NC(C1=CN(C2CC2)C(C)=CC1=O)=O,0 SC04-0850,COCc1nc(CCOC(CCC2)CN2S(c2cnccc2)(=O)=O)no1,0 SC67-0171,CC(C)N(C1)CC2(CCN(Cc3cocc3)CC2)C1c1nncn1C,1 F6442-1595,CC(C)CS(C(C1)CN1C(c(cccc1)c1F)=O)(=O)=O,0 M739-0201,CN(C)c(cc1)ccc1C(N1C(COc(cc2)ccc2C(N2CCCC2)=O)CCC1)=O,0 F5600-0444,Cc(cc1)nnc1N(CC1)CCN1C(Nc(cc1)cc2c1OCO2)=O,1 SB27-0020,O=C(C1)NCC2(COCC2)N1C1CCN(Cc2cocc2)CC1,1 S570-0641,COCCN1C2=CCCCC2(CNC(COc2ccccc2)=O)CCC1=O,0 D470-2001,COc(cc1)ccc1S([C@@H](CS(C1)(=O)=O)[C@H]1NCC1OCCC1)(=O)=O,0 S976-0583,Cc1noc(C)c1CC(N(CCC1)CC1(C(NCCOC)=O)F)=O,0 F6476-6328,O=S(CCC(F)(F)F)(N(CC1)CC1Oc(ccnc1)c1Cl)=O,0 Z1122515495,CN(CC(F)F)CC(NCc1cc(OC)ccc1)=O,0 F6473-6954,CC(N1C)=CC(OC(C2)CN2S(c(cc2)ccc2C(OC)=O)(=O)=O)=CC1=O,0 SA99-0757,NC(C(CC1CC1)(CC1)CCN1C(CC1)CCN1C(NCc1ccccc1)=O)=O,1 Z1129289197,Cc1cn(CC(Nc2c(C)ccnc2)=O)c2c1cccc2,0 F6515-1406,COc(ccc(C(NCc1cc(-c2ccco2)ncc1)=O)c1)c1F,0 T990-2286,COCCN(CCC1N(CC2)CCN2S(c(cc2)ccc2F)(=O)=O)C1=O,0 Z2655191686,Cc1cccc(NC(CN(CC2)CCN2c(ccc(F)c2)c2C(N)=O)=O)c1C,0 Z1669356501,CN(C(CC1)CCN1S(C)(=O)=O)C(c(cc1)nc2c1nc[nH]2)=O,0 Z2352635680,OC([C@H](C1)C[C@H]1NC(c1cc(O)nc2ccccc12)=O)=O,1 F6155-0458,COc(cc1)cc2c1nc(N(C1)CC1C(NCCc1cccs1)=O)s2,1 Z1899607689,CC1OCCC(CN(C(C(CC2)(c3c2ccc(OC)c3)N2)=O)C2=O)C1,1 F6554-4369,O=C(c1nccc2ccccc12)N1Cc(cc(cc2)F)c2OCC1,1 Z4661510000,O=C(c1n[nH]c2c1cccc2)N[C@@H](CC1)CN1c1ccnc(Cl)n1,0 Z3803485016,OC(C(CC1)(CC2)CCC12NC(c1cc(OCC2OCCC2)ccc1)=O)=O,1 Z3216016284,O=S(CCCn1nnnc1)(N(CCC1)CC1c1ccn[nH]1)=O,1 P316-0013,COc(cc1)ccc1S(NC(CCN1c2ccccc2)C1=O)(=O)=O,0 Z1509963473,CCc(n(C)nc1CC)c1S(N1CCC(C)(C)CC1)(=O)=O,0 F5854-3040,Cn1c(CN(Cc2cccs2)C(c(cc(cc2)OC)c2Br)=O)ccc1,0 F6203-1739,Cc1ccc(C(CNS(c(cc2)cc(C)c2F)(=O)=O)OCCO)cc1,0 F5583-0257,O=S(c1cnccc1)(N1CCN(Cc2nc(-c3ccco3)cs2)CC1)=O,1 F6442-4210,Cc(nc1oc(-c2ccccc2)nc1c1)c1NC(c1cccs1)=O,1 F2881-1306,Cc1c(C(NCCOc(cc2)nnc2-c(cc2)ccc2F)=O)sc(-n2cccc2)n1,1 P634-0305,CN(CCc1ccncc1)C(CCC(CCC1)CN1c1ncnc(NC2CC2)c1)=O,1 Z3105433944,O=C([C@@H]1[C@H](CC2)N[C@H]2C1)NC(CCN1c2c(C(F)(F)F)cccc2)C1=O,1 M030-0086,O=S(c(cc1)cc-2c1OCc1c2onc1)(N(CCC1)c2c1cccc2)=O,1 F6478-3790,CCc1ncnc(OC(CC2)CN2C(c2c(C)onc2)=O)c1F,1 F6709-4260,COc(ccc(Cl)c1)c1S(N(C1)CC1Oc1cc(C(F)(F)F)ncc1)(=O)=O,0 S988-0412,CCS(N(C[C@@H]1CN(C2)C(Cc(cc3)ccc3Cl)=O)C[C@@]12c1nc(C)no1)(=O)=O,0 F5095-0093,CC(C)c(cc1)ccc1OCC(N(CC1)CCN1c1nccn1C)=O,0 F6523-4332,CN1N=C(CCC(C2)NS(c(cc3)ccc3F)(=O)=O)C2=CC1=O,1 Z3509394196,CCn1ncc(C(N(CCC2CC(O)=O)c3c2cccc3)=O)c1C,1 S550-0277,O=C(c1cnccc1)NCc1nnc2n1cccc2-c1nc(C2CC2)no1,1 6671-0133,Fc(cccc1)c1N(CC1)CCN1C1CCN(Cc2ccncc2)CC1,1 Z1220581665,O=C(c1cc(cc(cc2)Cl)c2[nH]1)N(CCOC1)C1c1ccco1,0 F6808-5363,CC(C)NC(C(C)N(CC1)CCN1c(nc(nc1)SC)c1Br)=O,0 F3305-0227,CC(C)(C)c(cc(n1nc2C)SCC(OC)=O)nc1c2-c1ccccc1,0 Z2745984861,Cc(cc(CNc1nn2c(-c(cc3)ccc3F)nnc2cc1)cc1)c1S(N)(=O)=O,0 F6443-9820,Cn(c(C(NC(CC1)CN1c1ncc(C(F)(F)F)cc1)=O)c1)nc1-c1cc(OC)ccc1,1 Z1870061732,Cc1cccc(C(NCCOc(cc2)ccc2C(O)=O)=O)c1Cl,0 Z1171740470,O=C(c(cc1)ccc1SC(F)F)NCc1nc(cc(cc2)Cl)c2[nH]1,0 L927-0114,CC(C)Oc(cc1)ccc1-c1noc(CN(c2c(C(N3c4cc(OC)ccc4)=O)scc2)C3=O)n1,0 M339-0534,O=C(C(CC1=O)CN1c1ccccc1)Nc1cccc(OCc2nnc(-c(cc3)ccc3F)o2)c1,0 7591-0587,CC(C)(CC(N(C1=O)c(cc2)ccc2OC)=C2C1(C(F)(F)F)NS(c1ccc(C)cc1)(=O)=O)CC2=O,0 F5529-0198,Cc1cc(OCCNS(c(cc2)ccc2Cl)(=O)=O)cc(C)c1,0 Z2942656776,CCNC(CCc1cccc(S(N)(=O)=O)c1)=O,0 F0035-0406,CC(C)(C)OC(NC1(CC(C2)C3)CC3CC2C1)=O,0 F5644-0012,Cc(cc1)nnc1Oc(cc1)ccc1NC(COc(ccc(Cl)c1)c1Cl)=O,1 F6031-0671,OC(CN(CC1)CCN1C(c1c[nH]c2c1cccc2)=O)c1ccco1,1 F6523-2168,O=C(c(o1)ccc1Br)N(CC1)CCC1N(C(c(cccc1)c1N1)=O)C1=O,1 F1917-5680,CC(C)(C)OC(N1CC(Cn2c(C)ncc2)C1)=O,1 SC69-0099,Cn1c(C(C2)C3(CCCC3)CN2C(C2(CC2)c(cc2)ccc2OC)=O)nnc1,0 Z902683166,CCN(CC)C(C1N(Cc2nc(-c(ccc(OC)c3)c3OC)no2)CCC1)=O,1 F6441-5476,COc(ccc(CCC(N(C(CC1)C2)C1CC2SC)=O)c1)c1Br,0 Z2911537856,CCN(CCC1)CC(C)N1C(c1cccc(F)c1)=O,0 Z1260122159,O=C(CCN(C(CC1)=O)C1=O)N1CC(Cc2ccccc2)CC1,1 F5319-0697,O=C(C(C=C1)=NN(Cc2cccc(F)c2)C1=O)NCC1OCCC1,1 Z3651522069,COC(Cn(cc1)c(cc2)c1cc2NC(C1CC1)=O)=O,0 Z1537401435,COc(ccc(C(N1CCCC1)=O)c1)c1NC(c1cccc(C(O)=O)c1)=O,0 Z1370794664,O=C(CC1(CC(C2)C3)CC3CC2C1)NCC(N(CC1)CC(CN2)N1C2=O)=O,1 F6752-7524,CC(C)(C)NC(C(CC1)CN1c1nc(c(OC)ccc2)c2s1)=O,0 F6512-6532,O=C(C1(CCOCC1)c1ccccc1)N(CCC1)CCN1S(c1c[nH]cn1)(=O)=O,1 F6241-0313,CCOC(N(CC1)CCC1NC(C(COC1)N(Cc2ccccc2)C1=O)=O)=O,1 Z2777618230,CCC(C1)OCCC1C(Nc(cc1)cc(C(O)=O)c1O)=O,0 L822-0207,Cc1c(-c2noc(C(CC3=O)CN3c3ccc(C)cc3)n2)oc2c1cc(C)cc2,0 Z1642072026,CCc1cc(Nc2cn(C(C)(C)C)nc2)nc(C)n1,0 Z3687050291,CN(C(C(C(CC1)C2CC2)N1C(NCc1cc(COCC2)c2cc1)=O)=NN1)C1=O,1 E223-1216,CC(Cn(c1c2)nc2-c2cccs2)(C(NC2CCCC2)=O)N(Cc(cccc2)c2F)C1=O,0 Z1721206846,CC(C)OCC(C1)OCCN1C(c1cc2nc(C)c(C)nc2cc1)=O,1 Z2482941502,Cc1cc(S(N2CCN(Cc(cccc3)c3C(O)=O)CC2)(=O)=O)c(C)s1,0 F6415-1279,O=C(c1noc(-c2ccco2)c1)N(CCc1cccs1)Cc1cocc1,1 F6617-7546,Cc(cc1)ccc1S(Cc1nnc(-c2ccc(C(F)(F)F)cc2)o1)(=O)=O,1 Z3063545527,CCCNC(C(CC1)CCN1C(c(ccc1ccc2)cc1c2O)=O)=O,0 Z2482858680,Cc1c(CN(CC(c2c(cc3)OC)O)Cc2c3OC)cc(C(O)=O)s1,0 8018-0411,N#Cc1cccc(CSC(N2c3ccccc3)=Nc(sc3c4CCC3)c4C2=O)c1,0 F6442-0072,COC(c(cc1)ccc1C(N(C1)CC1S(c(cc1)ccc1F)(=O)=O)=O)=O,0 SA01-1049,CN(C)c1ncc(C(NCCOC)=O)c(C(CC2)CN2C(c(cc2)cnc2OC)=O)n1,0 F6491-2544,Cc1cc(C(N(CCC2)CC2Oc2nccnc2N(C)C)=O)no1,1 F3111-1546,CC(CCCC1)N1C(c(cc1)ccc1NS(c1cc(OC)ccc1)(=O)=O)=O,1 F6488-1432,Cc1noc(C)c1C(N(CC1)CC1Oc1nccnc1OC)=O,1 SB57-0357,CCS(N(C1)CC(C2)(CN2C(c(cc(cc2)F)c2F)=O)C1c1nc(C)no1)(=O)=O,0 Z2042869142,Cn1c(C(CC2)CN2S(c(cc(cc2)Cl)c2F)(=O)=O)ncc1,0 4339-0292,Cc(cc1)ccc1NC(C(C(c(cc1)ccc1Br)N1)=C(C)NC1=O)=O,0 F3314-0287,COc(cc1)cc(COCC(CN(CC2)CCN2c(cc2)ccc2F)O)c1OC,0 F6192-0714,O=C(C1(CC1)c(cc1)ccc1F)NCC(c1ccco1)c1cccs1,0 F6541-5822,CC(C)(C)CN(CC1)CCN1C(C1OCCC1)=O,0 F6257-1566,Cc1cccc(NC(Nc2ncnc(N3CCN(C)CC3)c2)=O)c1C,1 F6436-3387,CC(CNS(c(cccc1)c1OC(F)(F)F)(=O)=O)(c1ccco1)O,0 F5615-0025,O=C(COc(cccc1)c1F)N1CCN(Cc2csc(-c3ccccc3)n2)CC1,1 F3385-5705,COc(cccc1)c1C1=C(C(F)(F)F)Oc(c2c(cc3)OCN(Cc4cccs4)C2)c3C1=O,0 F6473-3567,COC(c(cc1)ccc1C(N(C1)CC1N(C(CC1)=O)C1=O)=O)=O,0 C155-0668,CC(CC1)CCC1C(NC(Cc1ccccc1)C(NCc1ccco1)=O)=O,1 F6752-3992,Cc1cc(CN2CC(C(N(CC3)CCC3(F)F)=O)OCC2)no1,1 F2147-6720,CC(C)(C)OC(NC(C(C1)C1c1ccccc1)C(O)=O)=O,0 Z1330143549,CC(C)(C1)NCCN1C(Cc1coc(-c(cc2)ccc2Cl)n1)=O,1 Z1689194778,CCc(s1)ncc1S(N(CCC1)CC1c1nncn1C)(=O)=O,1 F5838-0014,O=C(COc(cc1)ccc1Cl)Nc(cccc1)c1NC(c1cnccc1)=O,1 Z457371480,Cn1ncc(-c2nc(C(N(CCN(C)C3)C3c3ccccc3)=O)cs2)c1,0 F6764-3311,FC(c1nc(N2Cc3cc4cccnc4nc3CC2)ncc1)(F)F,0 F6425-0230,Cc1cc(OCCNC(c(cc2)nnc2-n2ncnc2)=O)cc(C)c1,1 F6752-4534,O=C(C1OCCN(Cc(cc2)cc(Cl)c2Cl)C1)N1CCSCC1,0 P223-0618,CC(C)CCNC(N(CCC1)CC1c1nn(CCCNC2=O)c2c1)=O,0 Z1486020636,Cc1cnc2c(Br)cccc2c1,0 F6529-0192,Cc1cc(C(N(CC2)CCC2N(c(cccc2)c2N2C)S2(=O)=O)=O)c(C)o1,1 Z2796496681,CCN(C(CCN(C=C(C(N1)=O)C#N)C1=O)=O)c1cc(C)ccc1,0 Z1621307429,CC(c(cc1)ncc1F)Nc1c(C)n(-c2c(C)ccc(C)c2)nc1,1 Z57633529,Cc(cc(cc1)Cl)c1NS(c(cc1)ccc1OCC(OC)=O)(=O)=O,0 SB15-1195,Cc(n(C)nc1)c1C(N(CCC1)CC1N(C1CCOCC1)C(C1CC1)=O)=O,1 F6194-0101,CC(Cc1ccco1)(CNC(Cc(cccc1)c1Cl)=O)O,0 F6218-0134,Cc1cc(C)nn1-c(nc1)ncc1NC(Cc(cc1)ccc1OC)=O,0 Z2182690264,CC(N1CCC(CNC(N(C2)CC2(c2ccccc2)O)=O)CC1)=O,1 SD24-0165,CCN(C[C@@H]1CN(C2)S(Cc(cc3)ccc3Cl)(=O)=O)C[C@@H]2NC1=O,1 Z1784134275,CC(C)Oc1nccc(CNC(C2(Cc(cc3)ccc3F)CC2)=O)c1,0 F3257-0033,Clc1cc(Cl)c(Cn2c(cccc3)c3nc2CN2CCOCC2)cc1,0 S984-0319,CN(C)C([C@@](CN(Cc1cnccc1)C1)(C2)[C@@H]1CN2C(c1cccs1)=O)=O,0 F6515-1112,O=C(c1cc(cccc2)c2o1)NCc1cc(-c2ccco2)ncc1,1 Y043-6429,Cc1nnc(NC(CNC(N(CC2)CCN2c2nsc3c2cccc3)=O)=O)s1,0 F0805-0170,O=S(c1ccccc1)(N(C(C1)c(cc2)ccc2Br)N=C1c1cccs1)=O,1 M952-0168,CC(CCC1)CN1S(c1c(C)[nH]c(C)c1-c1nnc(C)o1)(=O)=O,1 F6111-2215,CCCS(N1CCC(COCc(cc2)ccc2C#N)CC1)(=O)=O,0 Z1570111123,OC(C(CC1)CCC1NC(c1c[nH]cc1)=O)=O,0 Z1566262139,Cn1nc(CNC(N(CCC2)CC2OC)=O)nc1,0 F6507-5504,CC(CNS(c(s1)ccc1Br)(=O)=O)(COC)OC,0 F6513-2465,Cc1c(CN(CC2)CCN2c2nsc3c2cccc3)cno1,1 Z1529126196,CC(C)Cn1ncc(C(N(C2)CC2O)=O)c1C(F)F,0 F5004-0111,CN(c(sc(C(NCCC(c1ccccc1)c1ccccc1)=O)c1)c1C(N1C)=O)C1=O,1 Z2610463933,C([C@H](C1)C[C@H]1c1ccccc1)NCc(cc1)cc2c1[nH]cn2,1 Z4076352966,O=C(C1[C@@H](CC2)[C@@H]2C1)NCC(N1)=NNC1=O,1 S984-1697,CC(C)N(C[C@H]1CN(C2)C(Cc3c(C)cccc3)=O)C[C@@]12C(N1CCCC1)=O,0 D754-0214,CC(C)Oc(cc1)nn2c1nnc2CCC(NC[C@@H](CN(Cc1c2cccc1)C2=O)c1ccccc1)=O,1 F3406-9884,CN(C)c1cc(-n2cnc(C(Nc(cc3)cc(Cl)c3OC)=O)c2)ncn1,1 Z1103191804,CC(Nc(cc1)ccc1NC(CN(C)Cc(cc1)cc(C)c1OC)=O)=O,0 F6514-4058,CN(C=C(C(N(C1)CC1n1nnc(COc2ccccc2)c1)=O)C(OC)=C1)C1=O,1 Z3140110775,OC(CNC(CC1NCCC1)=O)CN(CC1)Cc2c1cccc2,1 F5105-0099,O=S(c(cccc1)c1Br)(NCCc1cscc1)=O,0 F6502-0428,O=S(Cc(cc(cc1)F)c1F)(NCCn1c(-c2ncccc2)ncc1)=O,1 F6360-9203,Cc(n(-c1ccccc1)nc1)c1C(N(C1)CC1Oc1cnccc1)=O,1 F3120-0056,O=C(CSc1nc2ccccc2nc1)NC1CCCC1,1 L880-0312,CCC(C)NC(CSC(N(C)C1=O)=Nc2c1n(C)c(cc1)c2cc1OC)=O,0 Z3177684591,C[C@@]1(C2)[C@@H](C3)C=C[C@@H]3[C@@H]1CN2C(Nc1ncc(CC2OCCOC2)s1)=O,1 Z85914859,Cc(cc1)c(C)c2c1c(CC(NCCC(O)=O)=O)co2,0 V002-8475,CC1N(CCCNC(c(cc2)ccc2-c2cc(-c3cc(OC)ccc3)n[nH]2)=O)CCCC1,0 E557-3875,CC(C)(c(cc(cc1)S(NCC(CC2)CCC2C(NCc2cccs2)=O)(=O)=O)c1N1C)C1=O,1 L285-3984,CCc(cc1)ccc1Nc(cc1)nnc1-c(cc1)cc(S(N2CCOCC2)(=O)=O)c1OC,0 F6676-2678,Cc1cc(C(N(CC2)CCC2N(C)c2ncccc2)=O)nn1C,1 F6451-2747,COC(CNC(Cc1cccc2ccccc12)=O)c(cccc1)c1Cl,1 SA85-0525,Cc1c(CN(CC(CN2CCc3ccccc3)O)CC2=O)scn1,1 SB36-0775,Cc1cn(CC(N(C2)[C@H](Cn3nnc(C(NCCOC)=O)c3)CC2(F)F)=O)nc1,0 Z3325175304,O=C(c(cccc1)c1F)Nc1cccc(-c2noc(-c3cc(Cl)cnc3)n2)c1,0 Z3609347744,CN(C)Cc1nc(ccc(NC(C2CC2)=O)c2)c2[nH]1,1 F6608-3987,Cc1cnc(N(CC2)CCC2OCC#CCN(CC2)CCN2c2ncccc2)nc1,1 F6561-2557,O=C(CNC(OCc1ccccc1)=O)N(CC1)CC1OCC1CC1,1 Z1733420613,Cc(cc(cc1)C(NC2(Cc3cccc(F)c3)CCC2)=O)c1-n1nnnc1,1 Y043-4972,CC[C@H](C)[C@@H](c1nc(cccc2)c2[nH]1)NC(C(C1)CN(CC(C)C)C1=O)=O,0 F6783-5529,O=C(C1OCCCC1)N(C1)CC(C2)C1CN2c(cc1)nn2c1nnc2,1 F3328-0098,FC(c1nc(SCc2nc(cccc3)c3[nH]2)nc(-c2ccco2)c1)(F)F,1 F6734-2580,Cc1cc(C(N(C2)CC(C3)C2CN3c(cc2)nnc2-c2ccccc2)=O)nn1C,1 F2726-0178,Cc1cc(C)c(CC(Nc(cccc2)c2-c2nc(cccc3)c3[nH]2)=O)cc1,1 Z401382860,COc(ccc(S(N(CCC1)CC1c1nnc2n1CCCCC2)(=O)=O)c1)c1F,0 F3407-4559,O=C(Cn(cc1-c2ccccc2)nc1N1CCOCC1)NCCC1=CCCCC1,1 F1900-9652,O=C(CCC1)c2c1n(-c(cc1)ccc1Br)nc2,1 S903-0707,CC(C)S(N(CC1)CCC1c1nnc2n1CCN(Cc(cccc1)c1Cl)C2)(=O)=O,1 F6438-1239,Cc1nc(CNC(Cc(cc2)ccc2F)=O)nc(N(C)C)c1,1 Z3891738564,CC1(CNc2c(C)c(Cl)nc(-c3ncccc3)n2)NCCC1,0 F6662-7122,OC(CC1)CN1S(c1cc(C(F)(F)F)ccc1)(=O)=O,0 F6557-1575,COc(cc1)ccc1N(CCN1CC(N(CCC2c(cccc3)c3F)CCS2(=O)=O)=O)C1=O,1 Z1551957294,CCOC(c1cnc2sc(C)cn12)=O,0 F6259-1050,CN(C(C=C1)=O)N=C1N(CCC1)CC1C(Nc1c(-c2ccccc2)nc2n1cccc2)=O,1 Z647137072,CN(C)C(N(CC1)CCC1C(Nc1nnc[nH]1)=O)=O,0 F2416-1138,Cn(c(C(Nc1cc(CN(CC2)C(OC)=O)c2cc1)=O)c1)nc1-c(cc1)ccc1F,1 G856-0924,Cc(cc1)ccc1N(C1=O)C(SCC(Nc2cc(Cl)c(C)cc2)=O)=Nc2c1[nH]c1c2cccc1,0 Z2982733348,O=C1NCCN(Cc2cn(-c3cnccc3)nn2)C1,1 Z1589227593,CC(CCOCC1)N1C(CNC(Cc1cccc(F)c1)=O)=O,1 Z1618113732,COCc(cccc1)c1S(Nc1cn(CC(F)(F)F)nc1)(=O)=O,0 F6556-1493,O=C(NCC1(CCSCC1)N1CCOCC1)Nc(cccc1)c1Cl,1 F2050-0266,O=C(c1ccccc1)N(CCC1)c2c1ccc(NS(c(cccc1)c1Br)(=O)=O)c2,1 Z2483744496,COCCn1c(N(CCC2)CC2(F)F)nnc1C1CCC1,1 Z2086489271,O=C(C(CC1CC1)N1)N(Cc2cc3cccnc3cc2)C1=O,1 Z1455277663,CCC(CO)NC(Cc(cc1)ccc1NC(c1cc2c(C)[nH]nc2nc1)=O)=O,0 Z1193085379,O=C(CCNC(c1cn(Cc2ccccc2)c2c1cccc2)=O)Nc1ccccc1,1 P611-0591,CC(C)n1c(nccc2)c2c(-c2nc(C)c(C(NC3CCCC3)=O)s2)c1,1 F6573-4469,O=C(NCCOCCN(C(CC1)=O)C1=O)NCc(cccc1)c1F,1 SA44-0318,CC(C)c1nnc(C2N(C)CC(C3)(CN3C(c3cn(C)nc3C)=O)C2)o1,0 S423-0233,COc(cc1)ccc1S(N(CC1)CCC1(C1)OCCC1OCC1CC1)(=O)=O,1 Z1322597565,Cc1noc(C)c1NC(N(CC1)CC11CN(Cc2ccccc2)CCC1)=O,1 F6188-0793,O=S(c(cc1)cc2c1OCCO2)(NCC1(CCOCC1)Sc1ccccc1)=O,1 Z2055072717,CO[C@H](C[C@H]1c2nnc3n2CCC3)CN1C(c1noc2c1CCCC2)=O,1 Z1829014865,CCOC(C1)C(C)(C)C1(CNc(nc(nc1)OC)c1Cl)O,0 V018-6005,CCCN(CC(COC)O)CC(N1)=Nc(sc2c3CCC2)c3C1=O,1 F6524-6640,CCOc(cc1)ncc1-c1noc(CNC(c2c(C)oc(C)c2)=O)n1,1 F6216-0381,Cc1noc(CCCNS(c2cccc(Cl)c2C)(=O)=O)c1,0 Z1557653398,OCC(Cc(cc1)ccc1F)NC(C1Oc(cccc2)c2OC1)=O,0 F6791-8035,CN1N=C(C(CC2)CCN2c(ncc(C#N)c2)c2Cl)N(C2CC2)C1=O,1 Z2951075361,Cn(cc1NC(NCc2c3OCCOc3ccc2)=O)nc1OC,1 F5123-0429,O=C(COc(ccc(F)c1)c1F)N(CC1)CCN1c1nn2c(-c3ccco3)nnc2cc1,1 Z4783095046,Cc(cc1)c(C(N2C(CNC(C3CC3)=O)CC2)=O)c2c1[nH]nc2,1 F6802-8081,O=C(C(CCC1)CN1c1nc2ccnn2cc1)N1CCSCC1,1 Z3016340861,CCC(C)(Cc1cn(-c(c(C)ccc2)c2F)nn1)O,0 S632-4622,CNC(N(CC1)CCC1C(CC1)CN1S(c1cc(C#N)ccc1)(=O)=O)=O,0 F6286-0284,Cc1nc(CCNS(c2cc(CCCC3)c3cc2)(=O)=O)nc(C(F)(F)F)c1,1 F6573-6342,Cc1noc(C)c1CCC(N(CC1)CCC1(C1)C1(F)F)=O,0 L495-0742,O=C(C1CCCCC1)Nc1nc(cc(cc2)NC(NC3CCCCC3)=O)c2s1,1 F6726-4508,COc(cc1)ccc1-c1ncnc(N(CC2)CCN2C(NCC2OCCC2)=O)c1F,1 F6798-4416,Cc1nnc(N(C2)CC(C3)C2CN3c2ncnc3c2ncn3CCOC)s1,1 P621-0072,CC1(C(Nc(cc(cc2)OC)c2OC)=O)Oc2cccnc2NC1=O,0 Z2897624528,OC(CN(C=CC=C1C(N(CC2)CC2c(cc2)ccc2F)=O)C1=O)=O,0 Z4368011266,CC(CC(NS(c(cc1F)cc(F)c1F)(=O)=O)=O)C1CC1,1 SC89-0103,COc(cc1)ccc1-c1n[nH]cc1C(N(C1)CC1(C(CN1CCCC1)CC1)S1(=O)=O)=O,1 8009-8933,CC(CC1Nc2ccccc2)N(C(CCC2CCCCC2)=O)c2c1cccc2,1 Z2460731698,OC(C1(CCCC1)C(Nc1cccc(OCC(F)(F)F)c1)=O)=O,0 Z4761671459,CCc1c(C(NCc2cnccc2)=O)nnn1-c1ccccc1,0 F6656-2075,O=C(NC1CCOCC1)N1CCC(COc2nnc(CCC3)c3c2)CC1,1 J025-0363,COc(cc1)ccc1-c1csc(C(C2)c(cc3)cc(OC)c3OCC(N)=O)c1NC2=O,0 F5729-0563,O=C(c1cccc(Cl)c1)N1CCC(Cn2c(cccc3)c3nc2C(F)(F)F)CC1,0 L505-2432,O=C(Cn1c(-c2nnc(C3CCC3)o2)ccc1)N(CC1)CCN1C1CCCCC1,1 Z46504292,Cc(cc1C)cc(C)c1NC(CN(CC1)CCN1c1c(C)cccc1)=O,0 Y200-5993,CCC(CC1)Cc2c1c(C(NC1CC1)=O)c(NC(COCC(O)=O)=O)s2,0 F6436-1493,O=C(Cc(cc1)ccc1NC(c1cc(cccc2)c2s1)=O)NC1CC1,1 F5857-6547,OC1(CNC(c(o2)ccc2Br)=O)C=CCCC1,1 E588-0668,CC(C1)OC(C)CN1C(Cn1c(cccc2)c2c(S(Cc2cccc(Cl)c2)(=O)=O)c1)=O,0 L398-0025,CC(C)(C)C(Nc(cc1)ccc1SCc1nnc(-c2ccccc2)o1)=O,0 Z2868889887,Cc1nsc(NC(N2CC(C3)C3C2)=O)c1Cl,1 F6178-3605,CC(C)(C(NCC(CC1)CCN1C(c1cnccc1)=O)=O)Oc(cc1)ccc1Cl,0 SC87-1097,O=C(C1(CC1)c1ccccc1)NCC(CC1)CCC(N=C(c2ccccc2)N2)=C1C2=O,1 D146-0425,CC(c(cc(c(-c(cc1)ccc1F)co1)c1c1)c1O1)=C(CC(NCc(cc2)ccc2Cl)=O)C1=O,1 Z2952553405,Cc1noc([C@H]2[C@H](C3CCN(CCCC4CC4)CC3)OCCC2)n1,1 F2543-0439,CC(C=CC1=NC(SCC(OCc2ccccc2)=O)=N2)=CN1C2=O,1 Z4262616955,Cc1cccc(NC(N(C)C[C@@H]2N(C)CCC2)=O)c1C(N1CCCC1)=O,1 Z4927216943,Cc1ccc(cc(cc2)C(N(CCC3)CC3C(C3)CN3C(C(CN3C)NC3=O)=O)=O)c2c1,1 F6438-0652,Cc1nc(CNC(Cc(cc2)ccc2Cl)=O)nc(N2CCCC2)c1,1 Z4970359547,O=C(c1c(C(F)(F)F)scn1)Nc1nc(-c2ncccc2)nc2c1ccs2,0 Z3360135451,CCn1nccc1C(C)NCc1nn(C)nc1,1 S951-0465,COCCC(N(CC1)CC(C(NCCOC)=O)N1c(cc1)cc(C(F)(F)F)c1C#N)=O,0 SA72-0990,COCCC(CC1)(CCN1C(c1cocc1)=O)c1noc(C2CCOCC2)n1,1 S607-0112,CN(c1cccnc1N1[C@@H](CCC2)CN2C(CN(c(cccc2)c2O2)C2=O)=O)C1=O,1 S948-5006,CC1(CC1)C(N1C[C@@H](CN(C2)c(cc3)cc(C(F)(F)F)c3C#N)[C@]2(CO)CC1)=O,0 Z3513316253,Cc1nsc(N=CN2Cc3coc(C(F)(F)F)n3)c1C2=O,1 E787-0144,Cc1csc(NC(CC(c(cc2)ccc2F)N(Cc2c3cccc2)C3=O)=O)n1,0 Z1132221238,Cc(cc(cc1)N2CCOCC2)c1NC(N1CC(CCCC2)N2CC1)=O,1 S639-8607,CCn1ncc(C(N[C@@H]2[C@@H](CN(C)C)CN(Cc3ncccc3)C2)=O)c1,0 F6356-0098,O=C(c1cccc2ccccc12)NCCc1cocc1,0 V016-1708,CCCOc(cc1)cc(Cl)c1-c1nc(C(NCC2OCCC2)=O)cs1,0 F6478-2719,O=C(Nc1cccs1)N(CC1)CC1Oc1ncncc1,1 D327-0053,O=C(CN(C(C=C1)=O)N=C1c(cc1)cc2c1OCCO2)Nc(cc1)ccc1OC(F)(F)F,1 F6549-9020,CS(N(CC1)CCC1C(N(C(CC1)C2)C1CC2Oc1ccncc1)=O)(=O)=O,1 G632-2176,CC(C)CC(C(N1CCOCC1)=O)NS(c(cc1)cc(C=C2)c1NC2=O)(=O)=O,1 SD25-0278,Cc1cccc(C(N2CC3(CCCCC3)C(CCC(NC3CC3)=O)C2)=O)n1,1 L498-0640,CC1CCN(CCCNC(c(cc2)ccc2-c2nc(-c(cc3)ccc3F)no2)=O)CC1,0 L564-0778,O=C(c1cc(-c(cn2)cnc2Oc2ccccc2)ccc1)Nc1cccc(Cl)c1,0 F2964-2320,O=C(CSc1ncc(-c2ccccc2)n1Cc1ccco1)Nc1nccs1,1 P218-3652,O=C(C(CCC1)CN1S(N1CCCC1)(=O)=O)N1Cc2cc(-c3cc(F)ccc3)nn2CCC1,1 4300-0830,CC(C(c1ccccc1)=O)Oc(cc1)cc(O2)c1C(CCC1)=C1C2=O,0 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Z3899644932,OC(CCc(nc(C(NC(SCc(cccc1)c1F)=N1)=O)c1n1)c1O)=O,0 Z1827672774,CC(CNC(c1cc(-c2ccccc2)nc2ccccc12)=O)N(CCCC1)C1=O,1 M049-0756,CN(c(cccc1)c1N=C1c(cc2)ccc2C(NCC2OCCC2)=O)C1=O,1 Z2595590963,CC(C)(C(CCC1)CN1C([C@@H](C1)[C@H]1c(cc1)ccc1OC)=O)C(O)=O,0 F6356-0175,O=C(Cc(cc1)ccc1-c1ccccc1)NCCc1cocc1,1 F6439-7552,Cc(c(S(NCCn1c2ccnn2cc1)(=O)=O)ccc1)c1Cl,0 Z2062964683,O=C1NCCN(Cc2noc(-c3ccccc3)c2)C1c1ccccc1,0 F5496-1855,Cc1cccc(NC(CN(CC2)CCC2c2nnc(-c3ccco3)s2)=O)c1C,1 S932-2880,O=C(c1cocc1)N(CC1)CC1n1nnc(COCC2CC2)c1,1 S824-2625,CCn1nccc1C(N(C[C@@H]1CO)C[C@@H]1c1ccncc1)=O,0 8019-6517,C1Oc(cccc2)c2OC1c(s1)nn2c1nnc2-c1ccco1,1 Z1230584208,CN(C)C(c1nccc(NC(NC(C2CC2)c2ccccc2)=O)c1)=O,1 SC04-0913,Cc(cc1)ccc1-c1n[nH]cc1CN(CCC1)CC1OCCc1noc(COC)n1,1 G802-0769,CCC(C(Nc(ccc(OC)c1)c1OC)=O)Sc1nnc2n1C=CN(c1cc(OC)ccc1)C2=O,0 F819-0424,CC(CC1)CCN1S(c(cc1)ccc1-c1noc(/C=C/c2ccco2)n1)(=O)=O,1 F6543-0212,O=C(Cn(cc1)c2c1cccc2)N(CC1)CC1(F)F,0 F6524-5814,O=S(C1CC1)(NCc1nnc2n1ccc(C(F)(F)F)c2)=O,1 SB57-1052,Cc1noc(C2C3(CN(CC4CCCCC4)C3)CN(Cc3ccccc3)C2)n1,1 Z2077110006,O=C(c1nccc2ccccc12)Nc1cccc(C(N2)=NNC2=O)c1,1 E944-0150,Cc1noc2c1c(N(CC1)CCN1c1c(C)ccc(Cl)c1)ncn2,1 F6436-3882,O=C(Cc1cscc1)N(Cc1cocc1)Cc1cccs1,1 Z2456064693,Cc1nc(cccc2)c2n1CC(CCC1)N1C(c1cccc(SC)n1)=O,0 Z4500949717,O=C(c1n[nH]c(-c2cc3ccccc3cc2)c1)N(CCC1)CC1c1nnc2n1cccc2,1 Z3185480188,[O-]C(c1nnc(Cc(c(F)ccc2)c2Cl)o1)=O,0 F6573-3394,O=C(c1cscn1)NCCOCCn1cncc1,1 Z1873015379,CC(CN(CC1)C(Nc2cn(CC(F)F)nc2)=O)CS1(=O)=O,0 F5835-0546,O=C(C(CC1=O)CN1c1ccccc1)N(CC(C1)CN23)CC1C3=CC=CC2=O,0 Y030-2727,Cc1ccc(CNC(c(cc(cc2)Cl)c2Cl)=O)cc1,0 Z1532935592,CNC(C(CCC1)CN1C(c1cc(OC2CCC2)ncc1)=O)=O,1 SA69-0270,CC(CCC1)(CN1C(Nc1c(C)c(C)ccc1)=O)c1noc(C2CCOCC2)n1,0 Z1499031781,CN(C)c(cc1)cc(F)c1C(Nc1nnc(-c2ccncc2)s1)=O,0 Z2093914600,CCN(CC(N1CCCCCC1)=O)C(CN(C=Nc1c2ccs1)C2=O)=O,1 F6475-2656,CC(CC1)N(C(c2cc(OCCOC)ncc2)=O)c(cc2)c1cc2F,0 Z1823373772,O=C(Nc1nnc(C(F)(F)F)cc1)N(CCC1)C1c1ccccc1,1 G803-0955,CCC1N(CCCNc2c(c(-c(cccc3)c3OC)no3)c3ncn2)CCCC1,0 L662-0318,Cc1cccc(-c2nccc(Oc(cc3)ccc3C(NC3CCCCCC3)=O)n2)c1,1 SC68-1747,Cn1ncc(C(N(C2)CC3(CCCCC3)C2c2nncn2CC2CC2)=O)c1,1 SC77-0827,CCn1nc(C)c(CNC([C@H](CN(C2)S(C(C)C)(=O)=O)[C@@]22OCCNC2=O)=O)c1C,0 F6457-0459,O=S(Cc1noc2c1cccc2)(N(CC1)Cc2c1cccc2)=O,1 F6359-1814,N#Cc1cccnc1OC(CC1)CCN1C(Cc(cccc1)c1Cl)=O,0 Z2432899756,Cc(nc(cc1)N2CCN(CCF)CC2)c1C#N,0 Z2409341979,CNc(cc1)cc(C(NC(CC2)Cc3c2cn[nH]3)=O)c1Cl,0 Z2612024507,CCN(CC(CC1)CN1C(N(C)C(N1C)=O)=CC1=O)CC(F)(F)F,0 T505-1177,CCn1ncc(C(N2C(CCn3nnc(C(N4CCOCC4)=O)c3)CCCC2)=O)c1C,0 S497-1343,Cc1noc(C)c1S(N(C1)CC1Oc(cccc1)c1-c1nc(CCOC)no1)(=O)=O,1 7282-5407,CC(CCO)Nc1nc(N(C)C(N(C)C2=O)=O)c2n1Cc(cc1)ccc1Br,0 F3301-0096,Cc1nc(NC(c2cccc(S(N3CCCCC3)(=O)=O)c2)=O)nc(C)c1,1 Z1888648772,O=S(CCc(cc1)cc2c1OCC2)(N(Cc1ncccc1)C1CC1)=O,1 Z2198022586,CCc1c(C)ccc(NC(C(C)(C2CCC2)O)=O)c1,0 F1900-9643,CC(C)(C)OC(N1CCC(COc2nccnc2N(C)C)CC1)=O,1 Y041-3703,O=C(C(c(cccc1)c1N1)=CC1=O)N(CC1)Cc2c1[nH]c1c2cccc1,1 Z2850813095,Cc1cncnc1N(CCC1)CC1Nc1ccccc1,0 F3386-0500,CC(C)c(c(C)c1)cc(S(N(CC2)CCN2C(C)=O)(=O)=O)c1OC,0 F6525-0494,Cc1cc(C(N2Cc3c(CCC4)c4nn3CC2)=O)c(C)o1,1 F6573-6299,O=C(c(cc1)ccc1-c1cscc1)N(CC1)CCC1(C1)C1(F)F,1 F6564-7959,CC(C(NCCN(C=NC(c(cc1)ccc1OC)=C1)C1=O)=O)N1N=C(CCC2)C2=CC1=O,1 S948-5189,Cn1cnc(S(N2C[C@@H](CN(C3)c(cc4)cc(C(F)(F)F)c4C#N)[C@]3(COC)CC2)(=O)=O)c1,0 F6549-5501,Cn1c(C(CC2)CCN2C(C(C(OC)=C2)=CN(C)C2=O)=O)cnc1,1 Z1378131687,O=S(c1cc(cccc2)c2o1)(Nc1cc(C(F)(F)F)ccc1)=O,0 F5913-0492,O=C(CN(C=NC(c1cccs1)=C1)C1=O)N(CC1)CCN1c1ncc(C(F)(F)F)cc1,1 V006-1998,CC(c1ccccc1)NC(C(C1)C(CN(CC2)C3CCCC3)N2c2c1cc(C(F)(F)F)cc2)=O,1 Z4905038894,Cc1nc2cncc(C(NCc3cc(C(NC)=O)ccc3)=O)c2[nH]1,1 F6515-3554,O=C(c1cc(-n2nccc2)ccc1)N(CC1)CC1n1nccn1,1 F2541-0144,CCOc(cc1)ccc1N(CC(C1)NS(N(C)C)(=O)=O)C1=O,0 7591-0594,CC(C)(CC(N(C1=O)c2ccc(C)cc2)=C2C1(C(F)(F)F)NS(c1ccc(C)cc1)(=O)=O)CC2=O,0 Z1709869309,O=C(Cc1c[nH]c(cc2)c1cc2Cl)N1CC2(COCC2)OCC1,1 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Z1823890221,CC(COC)Oc(ccc(Cl)c1)c1S(NC(Cn1ncnc1)=O)(=O)=O,1 Z1272308233,O=C(C(CC1)CCN1c1nc(-c2ccncc2)nc(C(F)(F)F)c1)Nc(cc1)ccc1F,1 Z1934796621,Cc(n(C)nc1)c1C(Nc1cc(C2COCCC2)nn1C)=O,1 F6556-7608,CC(Cc1cc(cccc2)c2o1)NC(c(cc(cc1)OC)c1Br)=O,0 F1477-0041,COc1cc(C(O2)=Nc(cccc3)c3C2=O)cc(OC)c1OC,0 S810-0226,Cc1nc(C(C2)C2(CC2)CCN2S(c2cccs2)(=O)=O)no1,1 SB30-0524,CCn1ncc(CN(CC2)CCC2N(C2(CN3CC4CC4)CCOCC2)C3=O)c1C,0 Z744323678,O=C(c1noc2c1CCCC2)Nc(cccc1)c1C(NC1CC1)=O,1 Y041-2079,c12c(/C(=C\C(O1)=O)/C)c(cc1c2CC[C@](O1)(C)C)OCC(NCC(N[C@@H](C(=O)O)C(C)C)=O)=O,0 F6436-1999,COCCN(Cc1cscc1)C(CCc1ccc(C(F)(F)F)cc1)=O,0 F6793-7296,O=C(C(CCC1)CN1c(cc1)nnc1-c1ccccc1)N1CCN(CC(F)(F)F)CC1,0 S694-2179,Cc1cc(C(F)(F)F)nn1CC(N(CC1)CC1n1c(COC)ncc1C)=O,0 Z2955940930,CC(C)CN1NC(CC(N(CCC2)CCN2c2nc(C)ns2)=O)=CC1=O,1 F6529-0144,CN(c(cccc1)c1N1C(CC2)CCN2C(COc(cccc2)c2F)=O)S1(=O)=O,1 Z2178701359,CNC(N(CC1)CC1(CC1)Oc2c1cccc2)=O,0 Z3467938292,OC1(CC1)C(Nc(cc1)cnc1N(CCN1)CC1=O)=O,1 Z1169844911,CCN(C(c(ccc(-c1nc(-c2ccccc2)no1)c1)c1N1)=O)C1=O,0 S990-1297,Cc1nn(C)cc1CN(CCC1c2nc(C)no2)CCN1C(C1CCCC1)=O,1 F3095-3634,CC(C)(C)NC(COc(cc1)ccc1-c1ccc(C)cc1)=O,0 P578-0313,O=C(c(nc1)cn1-c1ncnc(N2CCCC2)c1)Nc(cc1)cc2c1OCCO2,1 Z2981451403,CN(CCc1nc(cccc2)c2[nH]1)C(C1CC2(CCCC2)OCC1)=O,1 V010-5069,COc(cc1)ccc1-c(cc1)cc2c1oc(C(CCC1)N1C(Nc(ccc(OC)c1)c1OC)=O)n2,0 F6471-3520,O=C(c(cccc1)c1F)N(C1)CC1Oc1nccs1,0 Z1199429288,Cc(cc1)c(C)cc1NC(CN(CC1)CCC1(C1)C1C(OC)=O)=O,1 F2493-1737,O=C(COc(cccc1)c1F)NCc1noc(-c2cc(cccc3)c3o2)c1,1 F6753-2161,O=C(C1CCN(Cc2nc(CCC3)c3s2)CC1)N(CC1)CCC1(F)F,1 Z1684366251,CC(N1c2cccc(-c3noc(-c(ccnc4)c4Cl)n3)c2)=CNC1=O,0 G749-0207,Cc1cc(C)nc(N(C2CC2)C(SCC(N=C2N3C=CC=C2)=CC3=O)=N2)c1C2=O,1 SC21-0094,CCn(c(CC1)c2CN1C(Nc(cc(cc1)F)c1F)=O)nc2-c1ncc(C)n1CC1CC1,1 Z1498492317,N#Cc1ccc(C(Nc2ccc(CC(CC(N3)=O)C3=O)cc2)=O)[nH]1,1 Z3687017173,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(Cc(cc1)cc2c1OCCC2)=O,0 Y043-8381,O=C(CC1(CCOCC1)n1cccc1)Nc1nc(ccc(F)c2)c2s1,1 F2929-0010,Cc1c2sc(NC(CC3CCCC3)=O)nc2nc(C)c1,1 F6250-0550,COc(ccc(CNC(NC(CCC1)CC1OC(Nc(cc1)ccc1F)=O)=O)c1)c1OC,1 Z3714275400,CCC1(COC1)N(CC1)CCN1C(C(CCC1)CN1c1nc(C)ccc1C#N)=O,1 Z1625508292,Cc(onc1CC(N(CCOC2)C2c2ccccc2)=O)c1C#N,0 F731-0364,Cc(cc1)cc(N2C)c1Oc(ccc(NC(c1ccc(C(F)(F)F)cc1)=O)c1)c1C2=O,0 F6457-0486,COC(c(cccc1)c1NS(Cc1noc2c1cccc2)(=O)=O)=O,0 T482-1879,O=S(c1cccc2nsnc12)(Nc1cccn2nc(C3CC3)nc12)=O,1 V020-1272,CC(C(N(CC1)c(cc2)ccc2Oc2ccccc2)=O)N1C(c1cccs1)=O,1 Z3041048378,CN([C@@H]([C@H](C1)C(N(CCC2)CCN2C(C2CC2)=O)=O)c2nccn2C)C1=O,1 F3342-0344,CC(OC(CN(Cc1ccco1)S(C)(=O)=O)Cn1c(cccc2)c2c2c1cccc2)=O,0 S824-0228,Cc1cc(C(N(C[C@@H]2COCC3CC3)C[C@@H]2c2ccncc2)=O)no1,1 F6349-0923,O=C(Cc(cccc1)c1Cl)Nc1cc(-c2cnc3n2CCC3)ccc1,1 F6724-3468,OC(CNc(nc1)ncc1Cl)c(cc1)cc2c1OCC2,0 F6662-9686,N#Cc1cc(CN(CC2)CCN2c2ccccc2)ccc1,0 Z826873170,O=C(CN(C=C1)c(cccc2)c2C1=O)NC1CCN(Cc2ccccc2)CC1,1 F6471-2790,CC(C)(C)c(cc1)ccc1C(N1C2C=CCC1CC2)=O,0 M307-1772,O=C(CCC(CC1)CCN1C(c(cccc1)c1Cl)=O)NCC1CCCCC1,1 Z2950528501,Cc(nncc1)c1NC(NC[C@@H](CN(C)C1)[C@H]1c1ccccc1)=O,1 Z1498561807,CC(C1CCOCC1)NS(c1cc(Cl)cnc1N)(=O)=O,1 F6416-8550,CCOc1ccc(CC(NCCC(c2c(C)oc(C)c2)O)=O)cc1,1 SD14-0677,CN([C@@H](CCN(CC1CC1)C1)[C@@H]1C(N(Cc1cnccc1)C1)=O)C1=O,1 Z3045477486,Cn1nccc1CCNC(N(C[C@@H]1CC2)C[C@@]12N)=O,1 F5526-0022,CC(C(NCCOc1ccccc1)=O)Oc1cccc(F)c1,0 F6442-6853,Cn(cc1C(N(CC2)CCC2N(CC2)CCC2Oc(cccc2)c2F)=O)nc1OC,1 SA43-0762,Cc(occ1)c1C(N(C1)CC1(C1)CN(C)C1c1nc(-c2ccccc2)no1)=O,1 8018-4356,O=C(CC(C1=O)N2CCN(CCCc3ccccc3)CC2)N1c(cc1)ccc1F,1 F6395-1538,O=C(C1(CCCC1)c1cccs1)N(CC1)CC(C=C2)=C1NC2=O,1 Z1964888917,CC(C(CC(NC(CC(NC)=O)c1ccccc1)=O)=C(C)N1N2)=NC1=CC2=O,0 Z321288878,CC(c1c[nH]c(C(N(CCC2)CCN2C(c(cc2)ccc2F)=O)=O)c1)=O,0 Z4085898059,CC(CO)(c1cc(C)c(C)cc1)NC(C1OCCC1)=O,0 Z3686181391,C[C@H]1N(C)[C@@](CNCc2c(N(C)C)nc(C(F)(F)F)cc2)(CO)COC1,1 F2879-6340,Cc1nc2ccccc2c(NC(C(NCc(cccc2)c2OC)=O)=O)c1,0 F6559-3424,CCn1ncc(-c2noc(CNC(c(cc(cc3)OC)c3Br)=O)n2)c1,0 F6802-8105,COc(cccc1)c1NC(CN(CCC1)CC1C(N1CCSCC1)=O)=O,0 SB99-0085,Cn1c(C(N(CC2)Cc3c2n(C)nc3CCC(N2CCCCC2)=O)=O)cnc1,1 F5981-0041,Cn(cc1C(NCC(N(CC2)Cc3c2cccc3)=O)=O)nc1OC,1 F6619-5451,CCNc1nc(N(CC2)CCN2C(C)c2ccccc2)ccn1,0 F6573-4802,O=C(c1nn(-c2ccccc2)nc1)NCc1cncc(C2CC2)c1,1 D154-0576,Cc(cc1)cc(O2)c1C(CN(CC1)CCC1C(c1ccccc1)(c1ccccc1)O)=CC2=O,1 Z1426730835,O=C(c1cnc2n1cccc2)NCc(cc1)ccc1OCCN1CCCC1,1 F6514-6720,O=C(c1cc(cccc2)c2s1)NC(Cn1nccn1)c1ccccc1,1 Z1897786170,Cc1cccc(S(Nc2nnc(C3CC3)o2)(=O)=O)c1,0 F5033-6979,O=C(CSCc1ccccc1)NCC(CC1)CCN1S(C1CC1)(=O)=O,1 Z2379048718,CC(C1)(CN1C(c1nccc2ccccc12)=O)C(O)=O,1 SC74-1162,CN(C)C([C@H](C[C@H]1c2nc(-c3ccccc3)no2)C[C@@H]1NC(c1cccs1)=O)=O,0 F6481-1147,Cc1nc(S(N(CC2)CCSC2c(cccc2)c2Cl)(=O)=O)cn1C,0 F6454-2825,CCN(CCN(C(NCC(CC1)CCN1C1CCSCC1)=O)C1=O)C1=O,1 Z828199088,Cn1ncc(NC(C2(CCOCC2)c(cc2)ccc2OC)=O)c1,0 F6471-2716,O=C(c(cc1)cc2c1[nH]cn2)N1C2C=CCC1CC2,1 F6519-4336,Cn1nnc(C(NCC(c2cccs2)n2nccc2)=O)c1,1 F6726-5426,CN(C(C1)CN1c1ncnc(-c2ccccc2)c1F)S(c1cnccc1)(=O)=O,1 F6452-2218,COC1(CNC(CSCc2ccccc2)=O)C2CC(C3)CC1CC3C2,1 V027-2144,CCCCn(c(C(NCC(C)C)=O)c1)c(cc2)c1cc2NC(C1CCCC1)=O,0 Z2851996675,Cc(c(CS(C)=O)ccc1)c1NS(c1c2OCCCn2nc1)(=O)=O,0 F6508-0082,O=C(NCCOc1ccccc1)NCC(c1ccco1)c1ccco1,1 SB66-0392,Cc1ccc(CN([C@@H](CN(C2)C(c3nccnc3)=O)[C@@H]2CCC2)C2=O)cc1,0 Z2961544193,O=C(C1CC[C@H](C2)[C@H]2CC1)NCc1nnc2n1CCNC2=O,1 F6259-0421,Cc1csc(NC(C(CC2)CCN2c2ncnc(C3CC3)c2)=O)n1,1 Z1348428295,Cn1ncc2c1ncnc2NC(COc1ccccc1)c1ccccc1,1 F2416-0453,O=C(c1ccco1)N(CC1)Cc2c1ccc(NC(c(c(F)ccc1)c1Cl)=O)c2,0 Z2968355186,NC(CN(CCC1)CCN1c(cc1)nnc1-c(cccc1)c1Cl)=O,0 Z1870006483,CCOc(cccc1)c1-c1cccc(C(NC(C)(COC)C(O)=O)=O)c1,0 Z1891706243,CC(CCC1)C(C(O)=O)N1C(c(scc1)c1Br)=O,0 4383-0205,CC(NC(NC1c(ccc(OC)c2)c2OC)=O)=C1C(Nc(cc(cc1)OC)c1OC)=O,0 F6204-0707,O=S(c(cccc1)c1Br)(NC1(CCCC1)c1cccs1)=O,1 S836-4246,Cc1nn(C)c(CN(C[C@@H]2CO)C[C@@H]2C(NC2CC2)=O)c1,1 F6608-0981,CN(C=CN=C1OC(Cc2c3cccc2)C3N)C1=O,1 Z4487756794,Cc1noc(C2(CCOCC2)NC([C@H](C2)C[C@@H]2O)=O)n1,1 Y040-2776,C[C@H](C(N[C@@H](C(O)=O)c1ccccc1)=O)N(C(c(cccc1)c1N1)=O)C1=O,0 Z2660587466,Cc(cc1C)cc(C)c1NS(c1ccnn1CCc1ccccc1)(=O)=O,1 G786-1474,Cc1csc(NC(CSC(C(CCC2)=C2N2CCN3CCOCC3)=NC2=O)=O)n1,1 F5033-2442,O=C(C1c(cccc2)c2Oc2c1cccc2)NCC(CC1)CCN1c1ncccn1,1 S935-0201,COc(cc1)ccc1S(N1C(Cc2noc(-c3nccnc3)n2)CCC1)(=O)=O,0 Z2465400596,O=C(c1ncc(C(F)(F)F)cc1)N(CCNC1)C1c(cccc1)c1Cl,0 F6597-2603,Cc1nc2ncnn2c(N2CCC(COc3cccc(C(F)(F)F)n3)CC2)c1,1 C884-1546,CCC(C(NCc1ccco1)=O)n1c(C(N(C)N=C2)=O)c2c2c1cccc2,0 Z1552384394,CN(C)C(N1CCN(CCc(cc2)cc(Cl)c2Cl)CC1)=O,0 L701-0062,O=C(CCn1nnc2c1ccc(-c1noc(CCC3CCCC3)n1)c2)N1CCCC1,1 Z448269246,CCC(c1ccc(C)cc1)NC(N(CC1)CCN1c1nccnc1)=O,0 F396-1184,CCC(C)NC(CSC(N(CC(C)C)C1=O)=Nc2c1sc1ncccc12)=O,0 F6436-3144,Cc1cc(CNC(CCc2ccc(C(F)(F)F)cc2)=O)c(C)o1,0 Z4607579058,CC1(CC1)C(NCCN1CCN(Cc2nccn2C(F)F)CC1)=O,1 F6374-0131,Cc1c(C(N2CCC(CSc3ncccc3)CC2)=O)c(-c(cccc2)c2Cl)no1,1 SC15-0323,Cc1nc(C(N2CCC(CN(CC(COc3ncccn3)C3)C3=O)CC2)=O)co1,1 E776-1474,Cc1c(CS(c2ccc(C)cc2)=O)nc(-c(cc2)ccc2C(NCc(cccc2)c2Cl)=O)o1,1 SB70-0876,O=C(c1cscc1)N[C@@H](Cc1c2)Cn1nc2C(NCc1ccccc1)=O,1 Z2157567321,Cc(cc1)cnc1N(C)C(c(cc1)ccc1S(C)(=O)=O)=O,0 SA04-0096,Cc1ncc(CO)c(C(CCC2)CN2C(CN2CCCCCC2)=O)n1,1 F3406-8184,Cc1cc(C)nn1-c(cc1)ncc1C(NCc(cc1)ccc1SC)=O,0 D078-0205,COc(cc1)ccc1OCCCn1c(cccc2)c2nc1C1OCCC1,0 F6556-5003,O=C(CCc1ccccc1)N(CCC1)CCN1C1CCSCC1,0 Z3495288643,OC(C(C1)CN(Cc2ccn[nH]2)c(cc2)c1cc2F)=O,1 F5773-0373,CSc(cc1)cc2c1nc(N(CC1)CCN1C(Nc(cccc1)c1F)=O)s2,0 F6374-1430,Cn1c(SCC(CC2)CCN2C(c2cscc2)=O)ncc1,1 Z2387684430,C[C@H](C[C@H]1NC2CC(CC(OC)=O)C2)Oc2c1cccc2,0 F6472-0949,O=S(c(cccc1)c1Br)(NCCSC1CCOCC1)=O,0 Z1531857870,CCc(onc1C)c1NC(N(C)Cc1nccs1)=O,0 F6473-3666,Cc1c(CCC(N(C2)CC2N(C(CC2)=O)C2=O)=O)scc1,1 L390-0748,CC(C)c(cc1)ccc1-c(n1nc2)ccnc1c2C(NCC(C)O)=O,1 F6523-0361,O=C(Cc(ccc(F)c1)c1F)N(CC1)CCN1c1ncnc(C(F)(F)F)c1,0 Y042-4767,O=C(C(CC1=O)CN1c(cccc1)c1F)Nc1nnc(COc2ccccc2)s1,0 Z1682210759,OC(CCC(c(cc1)ccc1S(N1CCC2(CCCC2)CC1)(=O)=O)=O)=O,1 Z1603579291,CNC(C1(CCC1)C(Nc(cc(cc1)C(O)=O)c1F)=O)=O,0 F2756-3942,Cc1cc(C(N(CCN2CCOCC2)c2nc(c(C(F)(F)F)ccc3)c3s2)=O)nn1C,1 F6472-0935,O=S(c1cc(CCCC2)c2cc1)(NCCSC1CCOCC1)=O,1 Z1041173470,CC(C)(CC(Nc(cc1)cnc1-n1cncc1)=O)CC(O)=O,0 S639-1774,CN(C)C[C@@H](CN(C1)C2CCOCC2)[C@H]1NC(COCc1ccccc1)=O,1 SA70-0146,COCCC(CCC1)(CN1C(COc(cc1)ccc1F)=O)c1noc(C2CC2)n1,1 Z2186819448,CCc1c(C(NCc2c(CN(CC3)CC3O)cccc2)=O)n(cc(cc2)Cl)c2n1,1 Z1796297531,CC(Nc1cccnc1NC(C(CCC1)CC1C(F)(F)F)=O)=O,0 J006-0689,Cc1cc(C2N(Cc3cccc(F)c3)CCC2)no1,0 F1094-0321,CCN(c(c1c2cccc11)ccc1S(N(CC1)CCN1c(cccc1)c1F)(=O)=O)C2=O,1 Z2984395401,O=S(C1CC1)(NCc1cn(Cc(cc2)cc(F)c2Cl)nn1)=O,0 F6451-1083,Cc1csc(C(NCC(c2cc(F)ccc2)OC)=O)c1,0 F6560-5349,Cn1ncc(-c2cc(CNC(CCC(c3ccccc3)=O)=O)cnc2)c1,1 G794-0511,Cc1c(C(NCCC2=CCCCC2)=O)c(-c(cccc2)c2F)no1,0 S512-0305,O=C(c1cc(Br)cnc1)N(CC1)CC1Oc1cc(F)ccc1,0 F5834-2078,O=C(CSc(cc1)ccc1F)Nc1ccc(CC(N2CCOCC2)=O)cc1,1 Z2440725161,CC(C)c(ccc(C(N1CCC(CCNC)CC1)=O)c1)c1Cl,0 Z2647877603,O=C(C(C1)=NNC1=O)NCCCc1ccco1,1 F0600-2376,O=C(c1c[nH]c2c1cccc2)Nc1nc(c(F)ccc2)c2s1,0 S937-0891,O=S(c1cc(CCC2)c2cc1)(N(C1)CC1n1c(C2OCCC2)nnc1)=O,1 Z1449782134,C(c1nnc2n1CCCC2)Nc1c(CCC2)c2nc(-c2cnccc2)n1,1 D470-1934,O=S([C@@H](CS(C1)(=O)=O)[C@H]1N(CC1)Cc2c1cccc2)(c(cc1)ccc1F)=O,0 F6469-1791,O=C(c1noc(C2CC2)c1)Nc(cccc1)c1-c1cn(cccc2)c2n1,1 SA45-0112,CN(CCCC1(CC2)CCN2C(c2n[nH]c(C3CC3)c2)=O)C1C(N)=O,1 S519-1860,COc1cc(OC)c(CN([C@@H](COC2)C(NCc(cc(cc3)F)c3F)=O)C2=O)cc1,0 F3371-0240,Cn1nccc1C(CC1c2cc3nccnc3cc2)=NN1S(C)(=O)=O,0 Z1271475240,Cc1c(CNS(c2cn(C)cn2)(=O)=O)c(C)nn1C,0 F0777-0700,O=C(c1c2cccc1)N(CN(Cc1ccccc1)Cc1ccccc1)C2=O,1 Y032-0928,CC(c1ccccc1)NC(CN(C(c1c2cccc1)=O)C2=O)=O,1 Z2999713666,CC(C)(C(C)(F)F)NC(c1c(CS(CC2)(=O)=O)c2nn1C)=O,1 Z2766246778,O=C(c1cccc(Cl)c1F)NC[C@@H](CC1)O[C@@H]1c1ncn[nH]1,0 Z1481158106,CCc1cc2c(NCC3c4nccn4CCC3)ncnc2s1,1 F6223-0017,Cc(cc1C)cc(C)c1S(Nc1cnc(N(C)C)nc1)(=O)=O,0 Z1186278038,O=C(C(C1)=NNC1=O)N(CCC1)CCN1c1ncccn1,1 Z2610934186,CC(CS(C)(=O)=O)NS(c1cc(C)c(C(O)=O)o1)(=O)=O,0 P297-4746,CCCc(cc1)ccc1S(N(CC1)CC1n1c2ncccc2nc1-c1cocc1)(=O)=O,0 F6559-0250,Cc1nnc2n1ccnc2N(CC1)CCC1NC(OCc1ccccc1)=O,1 F5676-0023,COc(ccc(Cl)c1)c1NC(N1CCN(CC(c2cccs2)=O)CC1)=O,1 Z1657343999,CCCC(N(CCCC1)C1C(N(CC1)CCC1C1COCC1)=O)=O,1 Y040-5611,Cc(c1c2)coc1cc(O1)c2C(C)=C(CC(N(CC2)CC(CCCC3)C23O)=O)C1=O,0 Z4525837046,FC(Oc1cc(CNCC2)c2cc1)F,0 Z2055066467,CN(C)c1cc(C(N(C[C@@H](C2)OC)[C@@H]2c2nnc3n2CCC3)=O)ncc1,1 F6713-5846,CC(C)c1noc(CN(CC2)CCN2c(cc2)nnc2-c2ncccc2)n1,1 3393-0127,CC(C)(C1)CC(Nc(cccc2)c2NC2c3cnccc3)=C2C1=O,0 F6709-4846,Cc1nccc(OC(C2)CN2C(Cc(ccc(F)c2)c2Br)=O)c1,0 Z2283498072,COCC(C1)(CN1C(Cc1csc(cc2)c1cc2Cl)=O)O,1 Z1542941806,CCc(onc1C)c1NC(N1CC(C)N(CC(F)(F)F)CC1)=O,0 Z1941926541,CN(CC1CCC1)C(c1cc2ccccc2c(O)c1)=O,1 F6803-4500,N#Cc(cc1)ccc1N1CC(COc2nccnc2)CCC1,1 F2443-0163,CC(C)Oc1cc(N(CC2)CCN2S(C)(=O)=O)nc(C)n1,0 Z2437430094,COc(cc(cc1)C(O)=O)c1S(N(CC1)CCC1C=C)(=O)=O,0 F0344-0873,O=C(c(cccc1)c1Cl)Nc1ncc(Cc2cc(C(F)(F)F)ccc2)s1,0 8017-1586,C(c1nc(cccc2)c2[nH]1)Sc1nnc2n1c(cccc1)c1n2Cc1ccccc1,1 Z815411098,CN1CCN(CC(CC2)CCN2C(c2cscc2)=O)CC1,1 E203-0183,CC(C1)N(C(c2cc(S(N3CCCC3)(=O)=O)cn2C)=O)c2c1cccc2,1 F6443-8013,Cc(ccc(S(NCC(CCC1)N1c1ccccc1)(=O)=O)c1)c1Cl,0 Z1618378204,CC(C)NS(N(CC1)CCC1NC(c1c(C)cccc1)=O)(=O)=O,0 SD25-0258,O=C(CCC(CN(C1)C2CCOCC2)C11CCCCC1)NC1CC1,1 F6454-2478,Cc1cccc(NC(C(NCC(CC2)CCN2c2cc(C)ncc2)=O)=O)c1C,0 Z1786224189,Cc1cc(NC(c2cc(C(NC3CC3)=O)ccc2)=O)nn1CC(NC)=O,1 Z1673651663,COc(cccc1)c1Oc1ccc(CNC(N(CC2)CC3N2CCOC3)=O)cc1,0 F5831-6521,O=C(Cc(cccc1)c1Cl)NCC1CCN(Cc2ccccc2)CC1,0 Z599607690,CCCC(c1ccccc1)NS(N(CC1)CCC1C(O)=O)(=O)=O,0 F6497-1207,Cc(cccc1)c1-c1noc(CC(CCC2)CN2C(Nc2cccs2)=O)n1,1 Z2788315438,OC(C(C1)CC1NS(c1csc2c1cccc2)(=O)=O)=O,1 F5277-0369,O=C(c(c(F)ccc1)c1Cl)NCCCN(CC1)CCN1c1ccccc1,0 Z1659986272,CC(C(C)N)C(Nc1cc(Cn2ncnc2)ccc1)=O,0 SD12-0340,CC(C)c1ccc(CN(CCN2)C(Cc3nc(-c4ccncc4)no3)C2=O)cc1,0 Y207-5328,CC(CC1)Cc2c1nc(NS(c(cc(cc1)F)c1F)(=O)=O)s2,0 F2434-0464,COc(cc1)ccc1-c1cnc(C(Nc(cc(C(F)(F)F)cc2)c2OC)=O)o1,0 F6471-0769,CN(c1c(C(N2C)=O)n(CC(N(C3)CC3n3nnc(-c4ccccc4)c3)=O)cn1)C2=O,1 F6658-4156,COc(cc1)ccc1C(N(C1)CC(C2)C1CN2c1ncnc(C2CC2)c1)=O,1 J029-0266,Cc1ccc(C2(CCCC2)C(Nc2c(C)ccc(-c3nc(nccc4)c4o3)c2)=O)cc1,0 Z321294226,COc(ccc(Cl)c1)c1C(N(CCC1)CCN1C(c(cccc1)c1F)=O)=O,0 D074-0012,COc(ccc(C(c1c2[nH]nc1-c(cccc1)c1O)N(CC1OCCC1)C2=O)c1)c1OC,0 F6619-6168,Cc1nc(N2CCOCC2)cc(N(CC2)CCN2c2nccc3c2ccs3)n1,1 Z2851514071,CCc1cc2c(N3C[C@H](C)OCC3)nc(C)nc2s1,0 M100-0380,CN(C(C=C1)=O)N=C1c1csc(S(N(CC2)c3c2cccc3)(=O)=O)c1,1 F6541-3897,Cc1nccc(N(CC2)CCN2c(cccc2)c2F)n1,0 F3411-4461,CCn1nc(C)c(N(CC(NCC2OCCC2)=O)C(N2Cc(cc3)ccc3F)=O)c1C2=O,1 Z1693936309,Oc1ccc(CC(NCC(N(CC2)CCN2c2nccc(C(F)(F)F)n2)=O)=O)cc1,1 Z3586359085,CN(c(sc(C(N1[C@H](Cc2cccs2)CCC1)=O)c1)c1C(N1C)=O)C1=O,1 5517-0104,CCN(CC)S(c(cc1)ccc1NC(C(CCCC1)C1C(O)=O)=O)(=O)=O,0 F6482-7101,O=C(c(cccc1)c1Br)NCc1cc(-c2cscc2)ncc1,0 Z3836094168,OC(C(CC1)(CC2)CCC12NC(C(CC1)C1c1ccccc1)=O)=O,1 Z2305938050,CC1(CC=CCC1)NC(c(cc1)cc(S(N(C)C)(=O)=O)c1OC)=O,1 F6215-0051,Cc1noc(CCNC(c2nc3ccccc3cc2)=O)c1,1 F6792-2234,Cc1nc(CCC2)c2c(N2CCN(Cc3csc(C4CC4)n3)CC2)n1,1 F0838-0394,CC(C)c(c(C)c1)cc(S(n2nnc3c2cccc3)(=O)=O)c1OC,0 Z2950370231,O=C(NCC(CC1)OC11CCOCC1)Nc1cnc(CCCC2)c2c1,1 F5860-4312,COC(C(CC(C1)C2)(CC1C1)CC12NC(Nc1c(C(F)(F)F)cccc1)=O)=O,0 V024-2027,CC(C)C(N(Cc(n1CC2OCCC2)cnc1S(Cc(cccc1)c1F)(=O)=O)Cc1ccco1)=O,0 F6529-1308,Cc(c(S(N(CC1)CCC1N1N=C(C(F)(F)F)N(C)C1=O)(=O)=O)ccc1)c1Cl,1 F0657-0281,COc(ccc(-c1cn(cccn2)c2n1)c1)c1NC(c1cccc(C(F)(F)F)c1)=O,0 S988-1004,CC(C)n1ncc(CN(C[C@H]2CN(C3)C(c4ccccc4)=O)C[C@]23c2nc(C)no2)c1,0 Z1839650089,OC(COC(CC1)CCN1S(c1cc(C(F)F)ccc1)(=O)=O)=O,0 F5854-4687,COCCN(Cc1cscc1)C(Cc1cc(OC)ccc1)=O,0 Z3141454070,COc1nccc(C(N(C[C@@H]2CC3)C[C@@]23N)=O)n1,1 Z5550935878,O=C(C(CN1)c(cc(cc2)Cl)c2S1(=O)=O)Nc1c(CCCC2)c2cnc1,0 F1016-0281,CCOc(cc1)ccc1NC(CSC1=NCCS1)=O,0 Z1700518660,CC(c1noc(CN(CC2)CCC2(c2ccccc2)O)n1)OC,0 F6488-0139,O=C(c1cccc(C(F)(F)F)c1)N(CC1)CC1Oc1nccnc1,0 Z3173504044,OC(c1cc(C(N(CCC2)CC2OCCC(F)(F)F)=O)cnc1)=O,0 Z816624010,C=CCN(C(CC1)CS1(=O)=O)C(c1n[nH]cc1)=O,0 SB03-0231,O=C(Cn1cncc1)NCCN(C1CCOCC1)C(CCC1)CN1C(C1CC1)=O,1 F6523-0880,Cc1noc(C)c1CC(NC(CC1)CCN1c1nc(C)nc2c1CCCC2)=O,1 Z3509083054,Cc1cn(CC(N[C@](C2)(C[C@H]2O)C(O)=O)=O)c2c1cccc2,1 F2724-1193,CCOc(cc1)nnc1-c1cccc(NC(c(c(F)ccc2)c2Cl)=O)c1,0 F732-0204,CC(C)c(cc1)ccc1S(Nc(cc1)cc2c1Oc(ccc(C)c1)c1NC2=O)(=O)=O,0 SC88-1006,O=C(N(C1)CC1(C(CC1)c2nc(-c3ccccc3)no2)S1(=O)=O)N1CCOCC1,1 Z1697638834,CCN(CCN(C1)C(NCc2cc(-c3cnccc3)ccc2)=O)C1=O,0 Z3339936809,Fc1ccc(Cn2ncc(OCc3noc4c3COCC4)c2)cc1,1 Z1747875272,Cc1c(C(NN2C)=O)c2nc(C)c1CC(NCc(ccc(Cl)c1)c1F)=O,0 J009-0240,O=C(C(CCC1)CN1S(Cc1ccccc1)(=O)=O)Nc(ccc(Cl)c1)c1C(c1ccccc1)=O,1 L333-0448,O=C(C1(CC1)c1ccccc1)NCCC(CC1)CCN1C(Nc1ccccc1)=O,0 P085-0501,CCOc(cc1)ccc1NC(c(cc1)ccc1-c1nnc(cc2)n1cc2NC(C1CC1)=O)=O,1 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Z1264985205,O=C(c1c(-c(cc2)cc3c2OCCO3)ocn1)NC(C1)CN(CCOc2ccccc2)C1=O,1 F6709-4645,Cc1nccc(OC(C2)CN2C(c2cc(cccc3)c3s2)=O)c1,1 C216-0045,Cc1ccc(C(C2)c(cc(c(OC)c3)OC)c3NC2=O)s1,1 SB15-1084,Cn1cnc(C(N(CCC2)CC2N(C2CCOCC2)C(C2CC2)=O)=O)c1,1 F6516-0068,O=C(c(s1)ccc1Cl)NCc1ccc(-c2cccs2)o1,1 Z2015200536,CN(CC1)CCN1C(CCN(CC1)CCN1c1nccc(OC)c1)=O,1 F2696-0271,Cc1cc(CSC2=NC=CN(c(cc3)cc4c3OCCO4)C2=O)c(C)cc1,0 Z421713860,CN(CCCc1ccccc1)C(c1cc(Cl)c[nH]1)=O,1 Z2358676209,CC(CCC1)n2c1nc(S(Nc1ccncc1)(=O)=O)c2,1 3019-0256,O=C(c1cc(S(N(CCC2)c3c2cccc3)(=O)=O)cs1)Nc1ccccc1,1 V031-1004,O=C(C(C1)C(CN(CC2)c3ncccn3)N2c2c1cccc2)NCc1ccco1,1 F6512-0256,COc1cc([nH]c(C(N2Cc3ccnn3CC2)=O)c2)c2cc1,0 Y042-1890,COc(ccc(-c1ccnc2nc(C3Oc(cccc4)c4OC3)nn12)c1)c1OC,1 F6782-7671,Cc1cc(N(C=CN(CC2CCOCC2)C2=O)C2=O)c(C)cc1,1 Z4766380596,NC(C1)C(CC(N[C@H](C2)C[C@@H]2S(c2ccccc2)(=O)=O)=O)C1O,1 Z1918084674,CN(C)C(N(CC1)CCC1c1nc(-c2cscn2)no1)=O,1 K788-0090,CC(C)N(CCNC(C(CC1)N(Cc(cccc2)c2Cl)C1=O)=O)Cc1ccccc1,1 Z3016339745,CC(C(C(OC)=O)Sc1nnc(-c2c(C)cc(C)cc2)o1)=C,0 F6416-7623,CC(C)(C(NCCC(c(cc1)cc2c1OCO2)O)=O)Oc(cc1)ccc1Cl,0 F6559-2451,O=C(CSCc1ccccc1)NC(CC1)CN1c1nccn2c1nnc2,1 D154-0110,CCOc(cc1)cc(C(CN(Cc2ccco2)C2C(C)CCCC2)=C2)c1OC2=O,1 Z1724060920,CC(C(Nc1cnccc1)=O)c1ccccc1,0 Z4927216296,CC(CCC1)(C(N[C@@H]([C@@H](C2)NC(CC(CC(N3)=O)C3=O)=O)c3c2cccc3)=O)c2c1cccc2,1 F6523-2876,CCn1c(-c2noc(CNC(Cn(cc3)c4c3cccc4)=O)n2)ccc1,1 Y031-6484,CCN(CC)C(N(CC1)CCC1C(Nc1nnc(C2CCCCC2)s1)=O)=O,1 SC66-0383,O=C(c(cc1)cc(F)c1F)N(C1)CC2(CCOCC2)C1c1nncn1C1CC1,0 Y040-1905,CC(C(c1ccccc1)=O)Oc(cc1)c(C)c(O2)c1C(C)=C(C)C2=O,0 F5964-0138,OCC1(CNC(c2noc(-c3ccccc3)c2)=O)CC1,1 F6658-0127,O=C(c1cc(F)cnc1)N(CC1)CCC1c1nnc2n1nc(C1CC1)cc2,0 Z365591564,Cc1ccc(C(CNC(c2c(C)[nH]c3c2cccc3)=O)N2CCOCC2)o1,1 Z3583173928,CC(CONC([C@H](CCC1)N1C(C)=O)=O)O,0 Z3383253833,NCc1ccc(CC(NC(CS(C2)(=O)=O)c3c2cccc3)=O)cc1,0 Z1219172815,CC(C)(C)c(nc1)ncc1NC(NC(C)(C)c1nccs1)=O,0 F0818-0061,O=S(c1cccc2cccnc12)(N(CC1)Cc2c1cccc2)=O,1 Z2645377697,Cn1c(ccc(C(N(CCC2)CC2(C2CC2)O)=O)c2)c2nc1C(F)F,1 Z738204686,CCOc(cc(C)cc1)c1NC(c1c(C(F)(F)F)n(C)nc1)=O,0 SA46-0342,CN(CC1)CCN1C1COC(C2)(CN2C(c2nccc3ccccc23)=O)C1,1 F6523-0975,CN1N=C(CCC(C2)C(N(CC3)CCN3c3cccc(Cl)c3)=O)C2=CC1=O,1 F6465-0017,OC(CNC(c1cc(cccc2)c2[nH]1)=O)CN(C=CC=C1)C1=O,1 V013-6212,CC1N(CCCNC(c(cc2)ccc2-c2cc(-c3cccc(C(F)(F)F)c3)n[nH]2)=O)CCCC1,0 F6436-0679,Cc(n(C)nc1C)c1S(NCC(CC1)CCN1C(c(cccc1)c1F)=O)(=O)=O,1 Z2690966205,CCN(CC1)CCN1C(C(CC(C)C1)c2c1cn[nH]2)=O,1 Z2026060362,O=C(c(n1CC2COCC2)nnc1N(CC1)CC1(F)F)N1CCCC1,1 Z274591908,O=S(Cc(cc1)ccc1Br)(Nc1cnccc1)=O,0 F6482-5340,O=C(C1c(cccc2)c2Oc2c1cccc2)NCc1c(-c2ccncc2)nccc1,1 D399-0094,CC(C)c(cc1)ccc1S(N(CCC1)C1c(cc1)ccc1Cl)(=O)=O,0 F6472-2827,O=C(CC1CC1)N(C(CC1)C2)C1CC2n1nncc1,1 Z2641471500,CC1(CC=CCC1)NC(c1nn(cc(C)cn2)c2n1)=O,1 SD69-0553,CC(C)[C@@H](Cn1nnc(C(NC2CCCCCC2)=O)c11)NC1=O,1 F6411-2839,Cc1noc(C)c1CN(N=C(c1ccccc1)c1c2cccc1)S2(=O)=O,1 Y200-0859,O=C(c1cc(-c2cccs2)nc2ccccc12)NCCC1=CCCCC1,1 Z1471321348,CC(C)c(cc1)ncc1C(N1Cc2nncn2CC1)=O,1 F6284-0527,O=C(C1(CCCC1)c1cccs1)NCCc1cnc(-c2ccccc2)nc1,1 F5583-0254,O=S(c(cc1)cc2c1OCCO2)(N1CCN(Cc2nc(-c3ccco3)cs2)CC1)=O,1 Z4368555709,CCC(CC)CN(CCc1n[nH]nn1)C(C(C)OCC)=O,0 Z4120169222,CCNS(c(cc(NCCOC)nc1)c1F)(=O)=O,0 SB56-0886,Cc1noc(C)c1CC(N(C[C@@H]1c2nc(C3CCCC3)no2)C[C@@H]1c1cnccc1)=O,1 Z729693300,Cc1nccn1-c(ccc(NC(c1ccncc1)=O)c1)c1F,0 Z2335541729,O=C(Cc1c[nH]c2c1cccc2)NC(CC1)CN1c(cc1)ccc1F,1 J092-0004,COc(cc1)cc(C2(CC(c3ccc(-c(cc4)ccc4Cl)o3)=O)O)c1NC2=O,0 Z338359866,CCc1ccc(CN(C2CC2)C(c(cc2)cc3c2[nH]nn3)=O)cc1,0 F6031-0460,OC(CN(CC1)CCN1C(c(s1)ccc1Cl)=O)C1CC1,1 Z448438568,COCC(N(CC1)CCN1C(NCc1cn(cccc2)c2n1)=O)=O,1 F5584-0214,O=C(NCc(cc1)ccc1F)N1CCN(Cc2nc(-c3cccs3)cs2)CC1,1 F6658-5616,Cc1c(C)ncnc1OCC(CC1)CCN1c1nc(CCOC2)c2cc1C#N,1 F6516-0700,CN(C)S(c(cc1)ccc1C(NCc1ccc(-c2ccco2)o1)=O)(=O)=O,0 F6783-7347,CC(N=C(NC1=O)N(CC2)CCN2C(c2cn(C)nc2C(F)F)=O)=C1F,1 Z276229662,[O-][N+](c1ccc(C(C(CO)NC(c2cccs2)=O)O)cc1)=O,0 Z3416216894,CC#CCN(CC1)CCC1(C1)Oc2cn(C3CCCC3)nc2C1O,0 F5324-0157,CN(CC1)CCN1c1nc(ccc(NC(c2cc(cccc3)c3o2)=O)c2)c2s1,1 V026-5629,CCC(C)CN(C(CC1)(CCN1C(c(cc1)ccc1OC)=O)NC1C)C1=O,0 F6560-2477,Cn1c(cccc2)c2c(CC(NCc2cn(-c3ccncc3)nn2)=O)c1,1 SA72-1070,COCCC(CC1)(CCN1C(C1(CC1)c1ccccc1)=O)c1noc(C2CCOCC2)n1,1 Y204-3071,OC(C(C1CC2CC1)C2C(NCc1cccs1)=O)=O,1 Z982160038,Cn1c(-c2nnc3n2CCCC3)ccc1,0 SB04-0214,CS(N(CC1)CC1N(CCNC(c1ccco1)=O)C1CCOCC1)(=O)=O,0 F2356-1085,COc(cc1)cc(OC)c1NC(CN(CC1)CCC1C(NCc1ccco1)=O)=O,1 SB17-0173,Cc(occ1)c1C(N(CC[C@H]1NC(CC2)=O)C[C@]12C(N1CCCC1)=O)=O,1 SB54-1016,COC[C@@H](CN(C1)C(c(cc2)cc(F)c2F)=O)[C@H]1c1nnc(-c2ccccc2)o1,0 S726-0932,O=C(C1CCC1)N(CC1)CCC11OCCC(CCOc(cc2)ccc2F)C1,1 F6279-0485,CC(C)(C)NC(N1CCC(CNC(C2CC=CCC2)=O)CC1)=O,0 D399-0368,CCC(N(CCc1c2)c1cc(S(N(CCC1)C1c1ccco1)(=O)=O)c2Br)=O,1 F180-0084,Cc1noc(C)c1-c(cc1)ccc1S(N(CC1)CCN1c1c(C)ccc(C)c1)(=O)=O,1 Z450232346,CCCCCc1nnc(NC(C(CCC2)CC2C(F)(F)F)=O)s1,0 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Z466808324,CC(N(CC1)CCC1NC(C(c1ccccc1)Oc(cc1)ccc1Br)=O)=O,0 F6482-3562,O=S(c(cccc1)c1Br)(N(C1)CC1n1nccn1)=O,0 F6444-0537,O=C(c1ccncc1)N(CC1)CCC1N1C(COCc2ccccc2)CCC1,1 F6504-1165,Cc1c(CCNC(c2cc(-c(cc3)ccc3F)nn2C)=O)c(C)nn1-c1ncccc1,1 Z85895859,Cc1noc(C)c1CC(N(C)CC(O)=O)=O,0 Z5027904358,COCc(cn1)cc(COC(c(cc2NC(c3ccccc3)=C3)nn2C3=O)=O)c1OC,1 Z1545287634,CC(C)N1CC(CNC(NC(CCC2)c3c2ccc(C)c3)=O)CC1,1 S724-0754,O=C(C1(CC1)c1ccccc1)N(C1)CC1n1nnc(C(N2CCOCC2)=O)c1,1 F6683-1312,Cc1nnc(cc2)n1nc2N1CCC(COc(ccnc2)c2Cl)CC1,1 Z3687153207,C[C@H](C1)O[C@@H](C)c2c1c(C(NCc1nnc(C)n1C1CC1)=O)nn2C,1 F6525-0580,O=C(Cc1ccc(C(F)(F)F)cc1)N1Cc2c(CCC3)c3nn2CC1,1 Z3298814554,O=C(C1(CCC2)C2CCC1)Nc(cc1)cnc1F,1 SB75-0186,Cc1noc([C@@](C[C@@H](C2)NC(C3(CC3)c(cc3)ccc3OC)=O)(C3)[C@@H]2CN3S(C)(=O)=O)n1,0 F6360-9170,CN(C=CC=C1C(N(C2)CC2Oc2cnccc2)=O)C1=O,1 SB04-0482,CN(C)C(N(CC1)CC1N(CCNC(NCCc1ccccc1)=O)C1CCOCC1)=O,0 F3366-5130,CC(C)NC(Cn1c(cccc2)c2nc1C(CC1=O)CN1c(cc(cc1)Cl)c1OC)=O,0 F5837-0014,O=C(C1(CCCC1)c1cccs1)Nc(cccc1)c1NC(c1ncccc1)=O,1 F6492-0309,O=C(C(CC1)Cc2c1[nH]cn2)N(CC1)CCN1c1ncccc1,0 F6212-0009,O=C(c1c2OCCCn2nc1)NCc1nc(cccc2)c2[nH]1,1 F6523-3036,O=C(Cn1cccc1)NCCN(Cc(cccc1)c1OC1)C1=O,1 Y040-9009,Cc(c1c2)coc1c(C)c(O1)c2C(C)=C(CCC(N2CCN(Cc3ccncc3)CC2)=O)C1=O,1 F6436-1767,COc1c(C2(CNC(CCc(cccc3)c3Br)=O)CCOCC2)cccc1,0 Z1904033496,Cc(ccc(S(NC(C1CCOCCC1)=O)(=O)=O)c1)c1N(C)C,1 S649-0879,O=C(Cc1cnccc1)N(CC1)CCC1N(C1)C2(CCOCC2)C1OCC1CC1,1 SB69-0473,O=C(c1nn(C[C@H](C2)Oc3cnccc3)c2c1)NCc1cnccc1,1 Z2495581331,CC(C(CC1)CCC1(F)F)NC(NC1c(cccc2)c2OC1)=O,1 Z2058955636,CC(CC1)CCC1N(CC(C1)C(N[C@@H](COC2)[C@@H]2n2nncc2)=O)C1=O,1 Y042-2691,COc1cc(CCC2NC(CCN(Cc3c4cccc3)C4=O)=O)c2cc1OC,1 Z1426575516,COc(c(C(N)=O)c1)ncc1NC(c1cc([nH]cc2)c2cc1)=O,1 Z3062000626,Cn1c([C@H](CN(Cc(ccc(F)c2)c2F)C2)[C@@H]2NC(COC)=O)ncc1,0 D750-2526,CC(c1nc(cccc2)c2n1C)NC(CC1(CN(Cc2c3cccc2)C3=O)CCCCC1)=O,0 Z2954391067,CC(C)c(onc1C)c1NC(N(CCCC1)C1c1ccccc1)=O,1 F6451-2847,COC(CNC(CCc(cccc1)c1Br)=O)c(cccc1)c1Cl,0 F523-0530,O=C(CN(CC1)CC=C1c1cn(-c2ccccc2)nc1)N(CCC1)c2c1cccc2,1 P271-0360,Cc1c(C)nc2ncc(N(CCC3)CC3C(Nc(cc3)ccc3SC)=O)cc2n1,1 E984-3662,O=C(CN(c1cc(-c(cc2)ccc2Cl)nn1CC1)C1=O)NCC1OCCC1,1 Z2297796635,CC(CN(Cc1ccccc1)CC1)CN1C(C1CCOCC1)=O,1 V017-0980,Cc1ccc(CN(CCc(cc2)cc(OC)c2OC)C(CN(C2CC2)C(C2CCC2)=O)=O)o1,1 F6562-0583,Cn1ncc(C(CN(C2)C(c3ccco3)=O)c3c2cccc3)c1,1 F6473-7253,O=C(CSC1CCCC1)N(C(CC1)C2)C1CC2N(C(CC1)=O)C1=O,1 Z966640522,CNC(CN(CCC1)CCN1C(c1cc(cc(cc2)Br)c2[nH]1)=O)=O,1 Z3398928577,OC(C(CC1)CCN1C(C(CCC1)CCC1(F)F)=O)=O,0 F3385-4822,O=C(c1cc(cc(cc2)Br)c2o1)Nc1nc(cccc2)c2[nH]1,1 E692-1596,CC(CC1)CCN1S(N(CCC1)CC1C(NCCCN(CC1)Cc2c1cccc2)=O)(=O)=O,1 Z1497389655,CCC(CC)(C1)c(cccc2)c2N1S(c(cc1)ccc1C(CCC(O)=O)=O)(=O)=O,0 Z1778917778,CCc1nc(N(C2)C(C)CN(C)C2=O)c(ccs2)c2n1,0 F6725-1389,O=C(CN1)N(C(C2)CN2c2nc(C3CC3)ncc2)C1=O,1 F6496-2790,O=C(CC(c1ccccc1)c1ccccc1)Nc(cc1)cc2c1onc2CN1CCOCC1,1 S655-0298,CN(CC(C1)(CC2)CCN2C(CC2CCCCC2)=O)C1c1nnc(COC)o1,0 F2527-0136,Cc1c(C(OCN2C(SC)=NN=C(C)C2=O)=O)c(-c(cccc2)c2Cl)no1,1 Z2777919917,O=C(c1nc(N2CCCC2)cnc1)NCc1cc(N2CCOCC2)ccc1,1 F6802-9551,C(c1cncs1)N(CC1)CCC1Oc1nccs1,0 F0694-0063,CCOc(nccc1)c1C(Nc(cc1)ccc1-c1nc2cccnc2s1)=O,1 F6672-0451,Cc1cn(C2CC(CC3)N(Cc4cccc(OC)c4)C3C2)nc1,0 F6359-1383,O=C(c(o1)ccc1Br)N(CC1)CCC1Oc(cc1)ncc1Cl,0 F3406-4563,CCOc(cccc1)c1NC(CN(c(cc1)c2cc1Cl)N(C(C)(C)C)C2=O)=O,1 F5788-2968,Cc1nc(cc(cc2)NC(CN(CCN3c(cccc4)c4OC)C3=O)=O)c2s1,1 G122-2045,CC(C1)N(c2ccc(C(NC3CCCCC3)=O)s2)c2c1cccc2,1 F5309-0305,CC(c1ccccc1)NC(C(NCCCN(CC1)CCN1c1ccccc1)=O)=O,1 F6773-2812,C(CN(CC1)c2c3sccc3ncc2)C1Oc1nccs1,1 F6445-1517,O=C(c1nn(-c2ccccc2)nc1)NC(CC1)CN1c1nccs1,1 Z2285254068,CC(C)COc(ncc(C(N(CC(C)N1)CC1=O)=O)c1)c1Cl,0 F3222-1615,O=C(C(CC1)CCN1c1nc2ccccc2nc1)NCc(cc1)ccc1F,1 F5831-3143,O=C(c1cccc2ccccc12)N(CC1)CC1c1ccccc1,1 P223-1140,Cc1noc(C)c1CC(N(CCC1)CC1c1nn(CCCNC2=O)c2c1)=O,0 Z1898934186,FC(Cn1c(SCc2nnc3n2CCCC3)ncc1-c1ccccc1)(F)F,1 E699-1345,CC(C1)N(C(C2CCC2)=O)c(cc2)c1cc2S(Nc1cc(OC)cc(OC)c1)(=O)=O,0 V023-3116,COCc1nc(N(CC2)CCN2C(COCc2ccccc2)=O)c(c(CCCC2)c2s2)c2n1,0 F6560-4636,CC(C)C(Cn1nncc1)NC(c(s1)ccc1Cl)=O,1 F6245-7189,O=C(c(c(F)ccc1)c1Cl)NCCN(C1=O)N=C(C2CC2)N1c1ccccc1,0 F6036-0379,CC(C)(C(N(C1)CC1c1nc(-c2ncccc2)no1)=O)Oc(cc1)ccc1Cl,1 Z1426777951,CC(C1CCOCC1)NC(Nc1cn(CC(F)(F)F)nc1)=O,1 F6441-4673,CS(C(CC1CC2)CC2N1S(c(cccc1)c1F)(=O)=O)(=O)=O,0 Z4662037688,CC(NCc(cc1)ccc1S(NC(CN(CCN1C)CC1=O)=O)(=O)=O)=O,1 Z1269847578,Cc(cc1)cc(CCNC(C2OCCN(CC(N3)=Nc(cccc4)c4C3=O)C2)=O)c1OC,1 SB75-0202,Cc1noc([C@@](C[C@@H](C2)NC(c3ncncc3)=O)(C3)[C@@H]2CN3S(C)(=O)=O)n1,0 F5939-1818,O=C(CN(C(CC1)=O)C1=O)N(CC1)CCC1Oc1nc(ccc(F)c2)c2s1,1 F6516-1606,Cn(cc1C(NCc2ccc(-c3cocc3)o2)=O)nc1OC,0 Z900012768,Cc1c(C(NCc(cccc2)c2-n2nccc2)=O)c(-c(cccc2)c2Cl)no1,1 V023-8459,COc(ccc(Cl)c1)c1N(CC1)CCN1c1nnc(C(NC2CC2)=O)c2ccccc12,1 Z2353416488,OC(CCCNC(N(CCC1)CCc2c1cccc2)=O)=O,0 F6411-4389,Cn1nc(C(Nc2cccc(Cl)c2F)=O)c2c1cccc2,0 F6802-6342,CC(C)(C)C(N(C)C(CCC1)CN1c(ccnc1)c1Br)=O,0 Z1868714388,CC(COC)(C(N1c2cc(F)cc(F)c2)=O)NC1=O,0 F5857-8603,CC(CNC(NCc1cccs1)=O)(c1cccs1)O,0 Z1626899657,CC(C)c1nc(C(CCCCC2)N2C(CN(CCC2)C2=O)=O)no1,1 Z1727060664,CC(N(CC12CC2)Cc2c1cccc2)=O,0 T636-2176,Cn1nccc1C(N(CCC1)CC1Nc1ncnc2c1CCC2)=O,1 SB32-0159,Cc1n[nH]c([C@@H](C2)[C@@H](COC)CN2S(c(ccc(F)c2)c2F)(=O)=O)n1,0 G516-2019,Clc(cccc1)c1-c1nc2ccccc2c(NCCN(CCC2)c3c2cccc3)n1,1 Y031-2011,Cc1csc(NC(C(C2)CN(C3CCCCC3)C2=O)=O)n1,1 SB18-1267,Cc1n[nH]c([C@H](C[C@@H](C2)NC(C3CCOCC3)=O)N2C(c2cocc2)=O)n1,0 F2773-0241,O=C(CN(C(C=C1)=O)N=C1c1ccco1)c(cc1)ccc1Cl,1 T160-0220,Cc1cnc(CC(CC2)CCN2C(C2(CC2)c(cc2)ccc2OC)=O)n1CC1CC1,1 SD25-0335,Cn1ncc(C(N2CC3(CCCCC3)C(CCC(NC3CC3)=O)C2)=O)c1,1 L779-0020,Cc1cc(N2CCN(CC3=Nc(cc(C)c(C)c4)c4NC3=O)CC2)c(C)cc1,0 Z4497727149,CC(C)CC(c1c(C)cccc1)NC(C(CC(C1)O)N1C(Cc(cccc1)c1F)=O)=O,0 Z2932904435,CCCCN(Cc1c(C)oc(C)c1C)C(CC(c1c2cccc1)=NNC2=O)=O,0 F545-0992,O=C(c1cc(-c2noc(C3CCC3)n2)ccc1)NC1CCCCC1,1 F3284-8584,Cc1cc(C(CSc2nc(C)cc(C)c2C#N)=O)c(C)n1CCOC,1 F6724-3782,Cc1ccc(C(CNc2ncnc3c2cnn3C)OC)s1,1 Y031-7329,CC(C)CCNC(C(CCC1)CN1C(C(C)(C)C)=O)=O,0 Z744059824,Cc1cc(NC(N(CCC2)C2c(cccc2)c2Cl)=O)no1,0 F2571-0470,O=C(C(NCCc1ccccc1)=O)NCCC(CCCC1)N1S(c(cc1)ccc1Cl)(=O)=O,1 SB95-1236,Cc1noc(C)c1S(N(CCC1)CC1N(CCN1CCOCC1)C(C1CC1)=O)(=O)=O,1 Z1530229836,Cc1c(C(NCc(cccc2)c2-c2cn(C)nc2)=O)c(-c(cccc2)c2Cl)no1,1 P025-0685,O=C(C1CCC1)N(CC1)Cc2c1sc(S(N(CC1)CCN1c1ccccc1)(=O)=O)c2,1 Z1359908047,Cc(cc(cc1)F)c1S(NCCc1nnc[nH]1)(=O)=O,0 S428-1285,CC(CC1)CCN1S(N(CC1)CCC1C(N(CC1)CC1c1nc(C2CCOCC2)no1)=O)(=O)=O,1 Z1745285765,O[C@@H](CCCC1)[C@H]1NCc1cc(Br)cnc1,0 8012-3857,O=C(COc(cc1)c(C2CCCCC2)cc1Cl)Nc1cnccc1,1 Z1330400459,CN(C(CNC(CNC(c(cc1)ccc1O)=O)=O)=CC(N1C)=O)C1=O,0 F6730-4470,COc1cc(NC(c2ncnc3c2CCCC3)=O)cc(OC)c1OC,0 F5017-1370,Cc1noc(C)c1S(NCC(CC1)CCN1c1ncccc1)(=O)=O,1 Z1609497170,OC(c1ccc(C(NCCOc(ccc(F)c2)c2F)=O)o1)=O,1 SA68-0971,CC(N(CC1)CCC1N(CCNC(c1cc([nH]cc2)c2cc1)=O)C1CCOCC1)=O,1 S565-1471,Cn(c(CC1)c2CN1C(c1n[nH]c-3c1CCc1c3ccc(OC)c1)=O)nc2-c1nncn1CC1CC1,1 Z1495966444,CCC(CC)(CNC(c1n[nH]c(C)c1)=O)C(O)=O,0 F6724-3452,OC(CNc1nc(cccc2)c2o1)c(cc1)cc2c1OCC2,1 8244-0447,O=C(CC(C1=O)Nc(cc2)ccc2N2CCOCC2)N1c(cc1)ccc1Cl,0 F2493-2252,Cc1cc(CNC(CSc2ccncc2)=O)no1,1 G869-1260,Cc1nc(Nc(cc2)ccc2NS(c2cccc(Cl)c2)(=O)=O)nc(N2CCCC2)c1,0 Z1395261179,CC(C(NC)=O)NCCc(cc1)c(C)cc1F,0 F1813-1169,O=C(COc(cc1)ccc1Cl)Nc1nc(c(F)cc(F)c2)c2s1,0 D330-0080,COc(cc(cc1CC(c(cccc2)c2N2)C2=O)Br)c1OC,0 Z1541813624,Oc1cccc(NS(c(cc2)ccc2Oc(cccc2)c2Cl)(=O)=O)c1,0 F3320-0263,O=C(Cn1c(cccc2)c2nc1C(C1)CN(Cc2ccccc2)C1=O)N(CCC1)c2c1cccc2,1 T482-4317,Cc1nn(cccc2NC(CC3)CCN3S(C3CC3)(=O)=O)c2n1,1 SC72-0673,O=C(c1cocn1)N(C1)CC11OCc2c1cnc(-c1ccccc1)n2,1 Y043-5110,O=C(CC(C(N1Cc(cccc2)c2Cl)=O)NC1=O)Nc1nc(CCC2)c2s1,0 F0846-0687,O=C(CN(C(CC1)=O)C1=O)Nc(cccc1)c1-c1nc(cccc2)c2o1,1 F6803-0114,Cc1cnc(C)c(OC(CC2)CCN2c2nccc(C(F)(F)F)n2)n1,0 F6539-3096,O=C(c1cscc1)NCc(cc1)ccc1-c1cocc1,1 Z2951074357,Cn(cc1NC(NCc2nc(CCOC3)c3s2)=O)nc1OC,1 F5831-9793,Cc1cc(C(NCC2(CC2)c2cccs2)=O)c(C)o1,1 F6523-3926,O=C(CSc(cc1)ccc1F)N(CC1)CC2=C1N=C(C=CC(F)=C1)N1C2=O,1 Z3063556654,Cc1nn(ccnc2N(C3)CC3Nc(nccc3)c3C#N)c2c1,1 Z2863953421,CCc1c(-c2csc(C(CC3)CN3C(C)=O)n2)[nH]c(C)c1C(C)=O,0 F6487-1144,CCn1nc(C)c(S(N(C)CC(C2)OCc3c2cccc3)(=O)=O)c1C,1 SB95-1177,O=C(C1CC1)N(CCN1CCOCC1)C1CN(Cc2ccncc2)CCC1,1 F6525-6874,Cc(onc1)c1C(NCCn1ncc(-c2ccco2)c1)=O,1 Z4912742928,CC(CN(CC1)C(c2cccs2)=O)N1C(NCCOC)=O,0 F899-0008,Cc1csc(NC(C(CCC2)CN2S(c2c[nH]c(C(N3CCCC3)=O)c2)(=O)=O)=O)n1,1 Z3138315566,Cc1ccc(-c2nn(C)cc2C(NC(C2)C3(CCC3)C2N)=O)o1,1 SD62-0276,O=C(CCC(C1)C2(CCC2)CN1C(c1ccc(Cn2cncc2)o1)=O)N1CCCC1,1 L164-0715,O=C(C1(CC1)c(cc1)ccc1NS(c1ccccc1)(=O)=O)NCCCc1ccccc1,0 S759-0369,CC(C)N(C[C@H]1Oc2ccccc2)[C@@H]1C(CC1)CCN1C(CN(c(cccc1)c1O1)C1=O)=O,1 F6475-2513,COCCOc1nccc(C(Nc2c(CCCC3)c3no2)=O)c1,1 D473-1683,CC(C)(CS(N1c2cc(C(NC3CCCC3)=O)ccc2)(=O)=O)C1=O,1 Z4277983587,O=S(c1cnc(C2CC2)o1)(NCC(C1)ON=C1C1CC1)=O,1 F6510-4031,Cc(c(NC(N(c1ccccc1)c1ccccc1)=O)c1)cc(N2C)c1N(C)S2(=O)=O,1 S826-4355,Cc1noc([C@@H]2[C@@H](COC)CN(Cc3cnccc3)C2)n1,1 Z98643738,CCOc1cc(C(N[C@@H](C(C)C)C(O)=O)=O)cc(Cl)c1O,0 Z739381288,CC(C)Cc1noc(CNc(cc2)ccc2OC(F)(F)F)n1,0 Z1559954421,CC(C)c1ccc(CN(C2CC2)C(COC(C(C=CC2=NN3)=CN2C3=O)=O)=O)cc1,1 Z2996035985,Cc1nn(C)cc1S(N[C@H](Cc1c2cccc1)[C@@H]2N)(=O)=O,0 SD08-0419,Cc1noc(C)c1C(N(CCC1)CC11OCc2c(CNC(C3CC3)=O)nnn2C1)=O,1 F6413-0654,O=C(c1ccco1)c1ccc(CNC(c(cccc2)c2Br)=O)s1,0 Z4895317217,COC(C1(CCC1)c1cccc(NC(c2cc(CNCC3)c3cc2)=O)c1)=O,1 J037-0140,CC(C)c(cccc1)c1NC(CSc1cc(C)c(cc(cc2)S(N3CCOCC3)(=O)=O)c2n1)=O,0 Z2024432605,Cc1c(CN(CC2)C[C@H]2OC(F)F)c(C)nn1-c(cc1)ccc1F,0 F978-0206,O=C(Nc(cc1)cc(Cl)c1F)N(CC1)CCN1C(C=C1)=NN(c(cc2)ccc2F)C1=O,0 F5826-0109,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CCN1c1nc(cccc2)c2[nH]1,0 F6253-3655,Cc1cccc(CSCc2ccc(C(NCc(cc3)ccc3OC)=O)o2)c1,1 Z4670406887,CCS(N(C)c(cc1)ccc1NC(CCN(c(cccc1)c1C(N1)=O)C1=O)=O)(=O)=O,0 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Z2474799490,CNC(C(C1)N(C(CN2N=C(CCCC3)N3C2=O)=O)c2c1cccc2)=O,1 G786-0880,CC(CCCC1)N1S(c(cc1)ccc1C(Nc1nc(ccc(Br)c2)c2s1)=O)(=O)=O,0 F2342-0136,O=C(CSC1CCCC1)NCCN(C(C=C1)=O)N=C1c1cccs1,1 F6571-3247,OCCOC1(CNC(c(cccc2)c2Cl)=O)CSCC1,0 F2617-1159,COC(c1ccc(COC2=COC(CN(CC3)CCN3c3ccccc3)=CC2=O)o1)=O,1 SB30-0529,O=C(c1cccs1)N(CC1)CCC1N(C1(CN2CC3CC3)CCOCC1)C2=O,1 SB24-0077,CNC(c1cn(C(CC2)C2(CC2)CCN2C(c2c[nH]nc2-c(cc2)ccc2F)=O)nn1)=O,0 SC96-0210,O=C(c1ccccc1)N(CC1)CC2(COCC2)N(CC2CC2)C1=O,0 F6188-1007,COc1cc([nH]c(C(NCC2(CCOCC2)Sc2ccccc2)=O)c2)c2cc1,1 F5782-0214,O=C(c1nccnc1)NCC(CC1)CCC1c1nc(cccc2)c2[nH]1,1 SA85-1066,CC(C)CN(CC(CN(C1)C(c2nccnc2)=O)O)C1=O,1 Z1275895079,CC(C1)C(c2ccccc2)N1C(C(C1)CN(Cc2ncccc2)C1=O)=O,1 N039-0012,COc(ccc([C@H]1OC[C@@H]2[C@@H](c(cc3)cc(OC)c3OC)OC[C@H]12)c1)c1OC,1 Z2066139706,CC(CNc1c(c(C)cs2)c2ncn1)(C(F)(F)F)O,0 F6184-0742,O=C(Nc(c(F)ccc1)c1F)N(CC1)CCC1c1cscc1,0 F6471-0262,O=C(c(o1)ccc1Br)N(CC1)CC1n1nnc(-c2ccccc2)c1,1 F6573-6204,Cc1csc(C(N(CC2)CCC2(C2)C2(F)F)=O)c1,1 K784-8956,CC(C(NC1CCCCC1)=O)Sc1nn2c(C)cc(C)nc2n1,1 F6523-3266,O=C(c(s1)ccc1Cl)NCCN(Cc(cc(cc1)F)c1OC1)C1=O,0 Z1887428879,CC(C)Cc1c(C(N2CCC(Cc3ccccc3)(CO)CC2)=O)sc(C)n1,1 F6480-1025,O=C(NC1CCCC1)N(CCC1)CC1Oc1ccncc1,1 Y042-2422,Cn1c(cccc2)c2c(CCCC(NC(c2nc(cccc3)c3[nH]2)c2ccccc2)=O)c1,1 V024-0796,CN(CC1)CCN1c1nc(Oc(cc2)ccc2OC)c(CN(CC2)C(c3cccs3)=O)c2n1,1 P752-0160,CCc1cccc(NC(C(C=C2)=CN(CCN3CCCC3)C2=O)=O)c1,0 Z29210989,CC(CN(C1)C(c2cc(Cl)nc(Cl)c2)=O)c2c1cccc2,0 SC19-0322,CCn1nc(CN(CCC2)CCN2C(c2cscc2)=O)c2c1CCOC2,1 F6438-3547,CN(C)c1nc(CNC(c(cc2)ccc2-c2cccs2)=O)nc(N(C)C)n1,0 Z1455205797,CC(C)(CCC(O)=O)NC(COc(c1ccccc11)ccc1Cl)=O,0 F6539-2818,Cc(s1)ccc1S(NCC(CC1)CCN1C(N(C)C)=O)(=O)=O,0 V022-3327,CC(C)CCN(CC(COC)O)CC(N1)=Nc(sc2c3CCCC2)c3C1=O,0 F6519-5581,Cc1cc(C)nn1C(CNC(C(Nc(cc(C)cc1)c1OC)=O)=O)c1ccco1,0 F2829-0724,CCS(c1ccc(CC(N(CC2)CCN2c2ccccc2)=O)cc1)(=O)=O,0 Z2199886143,CCn1c(ncnc2N(C3)CC(C)(C)OC3C(F)(F)F)c2nc1,0 F6782-7232,Cc(cc1)c(C)cc1-n1nnc2c1N=CN(c1c(C)ccc(Cl)c1)C2=O,1 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Z3045005468,O[C@@H](CN[C@@H](CCCC1)[C@H]1O)c(cc1)cc(Cl)c1Cl,0 G868-1105,Cc1nc(N(CC2)CCN2S(c(cc2)ccc2-c2ccccc2)(=O)=O)nc(Nc2ccccc2)c1,1 V029-1962,Cc1cccc(Cn(c(C(NCCc2ncccc2)=O)c2)c(cc3)c2cc3NC(c2cccc(F)c2)=O)c1,1 G827-0031,CC(CC1)CCN1C(CCc1c(C)n(-c(cc2)nn3c2nnc3)nc1C)=O,1 Z2964268656,C[C@@H](C1)[C@@H](CS(N)(=O)=O)CN1C(c(nc1)c2n1ccc(C)c2)=O,1 Z324720458,O=C(Cn1nc(C(F)(F)F)cc1)N(C1CC1)C1CCCC1,1 F2604-0521,O=C(c1cccc(Cl)c1)N(CC1)CCN1c(cc1)nnc1N1CCOCC1,0 F1736-0278,CC(CC1)Cc2c1c(C(NCCc1ccccc1)=O)cs2,1 Z1439472331,CC(c(cc1)cc(CC(N(CC2)CC(CCCC3)C23O)=O)c1OC)=O,1 SB03-0234,Cc1c(C(NCCN(C2CCOCC2)C(CCC2)CN2C(C2CC2)=O)=O)sc(C)n1,0 S953-5535,CN(C)C(C(CC(C1)(CC2)CCN2C(C2CCC2)=O)N1c(cc1)cc(C(F)(F)F)c1C#N)=O,0 F6753-2621,Cc1c(C)ncnc1N(CCC1)CC1C(N1CCOCC1)=O,0 Z1848872694,CCC(c1cn(C)nc1)(C(N1Cc(cc2)nn2-c(ccc(F)c2)c2F)=O)NC1=O,1 S924-0069,Cc1noc(C)c1CN(C(CC1)(CC2)CCN2S(c(cc2)ccc2OC)(=O)=O)C1=O,1 F6612-0020,O=C(c1nc(cccc2)c2s1)N1c2nc(N3CCOCC3)ncc2CCC1,1 F6796-8616,FC(c1c(N2CC(CN(C3)c4nc(cccc5)c5o4)C3C2)nccc1)(F)F,0 F5016-3432,O=C(C(NCc(cccc1)c1Cl)=O)NCC(CC1)CCN1C(c(cccc1)c1F)=O,1 F2416-0955,Cc1cc(C(Nc2cc(CN(CC3)C(OC)=O)c3cc2)=O)c(C)o1,0 V019-5063,CCCC(CN(CC1)CCN1c1c(Cc(cc2)ccc2Cl)c(C)nc(C)n1)O,0 L507-0948,Cc1cc(NS(c2c(C)n(C)c(-c3nc(C)c(C(N4CCOCC4)=O)s3)c2)(=O)=O)no1,1 SC39-0055,Cc(occ1)c1C(N(CC1)CC1(c1nc(C2CCOCC2)no1)F)=O,1 Z1210214340,O=C(c(cccc1)c1F)NC(CCC1)CN1c1ccccc1,0 Z1306427751,CCC(Cc1ccccc1)NC(N1C(CN2CCOCC2)CCC1)=O,1 Z1455363136,CCc(cc1)ccc1-c1nc(CC(N(CCC2)[C@H]2C(O)=O)=O)cs1,0 F6675-9558,Cc1cccnc1OCC(CC1)CCN1C(NCc(cc1)ccc1F)=O,1 G551-0406,CC(C)C(c1ccc(C)n1CC1)N1C(NCc1ccc(C)cc1)=O,0 F5854-2034,COCCN(Cc1ccncc1)C(CCc1ccccc1)=O,1 F5309-0272,COCCNC(C(NCCCN(CC1)CCN1c1ccccc1)=O)=O,0 Y207-1686,CC(C(N1CCN(Cc2ccco2)CC1)=O)Oc(cc1)ccc1F,1 Z2916105854,O=C(c1nn(CCCN2)c2n1)N(C1)CC1Nc(cc1)ccc1F,1 F6244-3016,O=C(c1cscc1)NCC#CCN(CC1)Cc2c1cccc2,1 Z2786574860,OCCC1NCCN(CCc(cc2)cc3c2OCC3)C1,0 F5788-3215,CCOc(cc1)ccc1N(CCN1CC(Nc(cc(C(F)(F)F)cc2)c2Cl)=O)C1=O,0 F6561-6664,Cn1ncc(-c2c(CNC(OCCN3CCOCC3)=O)cccn2)c1,1 S738-0551,CC(C)(C)NC(N(C1)CC1c1ncc(C)n1Cc1cnccc1)=O,1 L269-0964,O=S(c(cc(cc1)F)c1F)(N1CCN(Cc2noc3c2cccc3)CC1)=O,0 F6619-6983,Cc1cc(C)nn1-c1cc(N(CC2)CCN2c(nc(CCCC2)c2c2)c2C#N)nc(C)n1,1 F6752-3608,CSc1nc(N(CCC2)CC2NC(C2CC2)=O)ccn1,0 Z2205478893,OC([C@H](CN(C1)C(c2c3OCOc3ccc2)=O)[C@@H]1c1ccccc1)=O,1 L679-0450,Cc1cc(-n2c(nccc3)c3nc2CN(CC2)CCN2C(Nc2cc(F)c(C)cc2)=O)cc(C)c1,0 4356-0460,CN1CCN(Cc(c(O2)c(cc3)C=C(c4nc(cccc5)c5s4)C2=O)c3O)CC1,0 Z1127372863,CC(COc1cccc(F)c1)NC([C@H](C[C@H](C1)O)N1C(OCc1ccccc1)=O)=O,1 Z954102554,CCCCN(C)C(NCC1CCN(Cc2cccs2)CC1)=O,0 L409-0438,O=C(C(Cc1ccccc1)NC(Nc(cc(cc1)F)c1F)=O)N(CC1)c2c1cccc2,0 F6279-0555,O=C(C1CC=CCC1)NCC(CC1)CCN1S(C1CC1)(=O)=O,1 F255-0679,Cc(cc1)cc2c1[nH]c(CCc(cc1)ccc1NC(CCCN1c(cc(C)cc3)c3OCC1=O)=O)n2,1 V019-5378,CCOC(C(C(c1cccc(Cl)c1)N1)=C(CN(C)Cc2ccccc2)N(C)C1=O)=O,1 SB36-1419,Cn1nc(C(N(C2)[C@H](Cn3nnc(C(NCCOC)=O)c3)CC2(F)F)=O)c2c1cccc2,0 F6446-0699,COc1c(CCC(NC(CC2)CCN2c2nccs2)=O)c2ccccc2cc1,1 Z4912742923,CC(CN(CC1)C(c2cocc2)=O)N1C(NCC1CC1)=O,1 Z737409934,CCC(CC1)CCC1(C(N1CC(Nc2cc3nccnc3cc2)=O)=O)NC1=O,1 V031-0403,N#Cc1cccc(S(N(CC2)CCN2C(c2ccccc2)c(cc2)ccc2Cl)(=O)=O)c1,0 F6524-1996,CCOc(cc1)c(C)cc1S(N(CC1)CC1c1nocn1)(=O)=O,0 F0007-1028,COc(cccc1)c1-c1csc(NC(c(cc2)ccc2C(c2ccccc2)=O)=O)n1,1 Z2454301997,O=C([C@H](Cc1c(C2)cccc1)N2C(c1cc(C(F)(F)F)cnc1)=O)NC1CC1,1 Z4497410969,O=C(C(C1)CN(Cc(cccc2)c2Cl)C1=O)N1Cc(cccc2)c2N(CCC2)[C@H]2C1,1 K284-1530,CN(C)c(cc1)ccc1NC(CSC(N1CCCN(CCC2)C2=O)=Nc(cccc2)c2C1=O)=O,1 SB66-0005,O=C(CCc1conc1-c1ccccc1)N(C[C@H]1CCC2)C[C@@H]1NC2=O,1 F6676-2730,Cc1nnc(N(CC2)CCC2N(C)c2ncccc2)s1,1 Z2297953225,O[C@@H]1[C@@H](CNC(C(C2)CN2C(C2CCCCC2)=O)=O)CCCC1,0 Z1185968259,COc1ccc(CCN(CCC2)CC2N(CCCC2)C2=O)cc1,1 Z3508018084,COc1ccc(CCC(C(O)=O)NCc2nc(CCC3)c3cc2)cc1,1 Z2960064454,CC(C)(C)c(cc1)cc2c1[nH]c(C(NCCc1ncn[nH]1)=O)c2,0 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D473-1983,COc(cc1)ccc1-c1cc(C(Nc(cc2)cc(N3)c2OCC3=O)=O)nn1C(CC1)CS1(=O)=O,1 Z3051402302,CCCn1cc(CNC(C(CC(C2)O)N2C(Cc(cccc2)c2F)=O)=O)cc1,1 F6357-1878,CC(C)(CNC(C(Nc(ccc(F)c1)c1F)=O)=O)c1cscc1,0 F1589-0481,CC(Nc(cc1)ccc1NC(c1ccc(-c2cccc(C(F)(F)F)c2)o1)=O)=O,0 Z3417058876,CCC(C1)OCCN1C(c1cc(C(N(C2)C(CCC(N3)=O)C3=O)=O)c2cc1)=O,1 F6495-4339,O=C(C(C1)CN1c1ncnc(-n2cncc2)c1)Nc(cc(C(F)(F)F)cc1)c1Cl,0 SA46-0565,O=C(c1cc2cccnc2cc1)N(C1)CC1(C1)OCC1N1CCCCC1,1 F5831-2410,CC(C)Sc1ccc(CC(NC(C)Cc2cccs2)=O)cc1,0 V028-7980,CCC(C)N(CC(N(Cc1ccc(C)s1)Cc(cc1)ccc1F)=O)C(C1CCC1)=O,0 Z1024658084,O=C(CN1CCC(CCN2CCOCC2)CC1)Nc1nc(CCC2)c2s1,1 S836-2567,Cc(cccc1)c1C(N(C[C@@H]1COC)C[C@@H]1C(NC)=O)=O,0 F6562-5763,CC(C)(C)SCC(CCCC1)N1C(c(cccc1)c1F)=O,0 F6166-0176,O=C(CSC1CCCC1)N(CC1)CCN1c1ncnc(-c2ccccc2)c1,1 F2551-0003,CCCCOC(CSCC(N1)=Nc(cccc2)c2C1=O)=O,0 F853-0131,O=S(c1cccs1)(N(CC1)Cc2c1nc(N1CCCCC1)nc2)=O,1 SD22-0175,COC1(CC1)C(C1)(CN1C(Cc1c[nH]c2c1cccc2)=O)NC(c1ccccc1)=O,1 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Z1225632867,COC([C@H](Cc1ccccc1)NS(C(C1)CN1C(OCc1ccccc1)=O)(=O)=O)=O,0 T853-0551,COc(cc1)ccc1NC(C1(CCC(N2c3ccccc3)=O)C2=CCCC1)=O,0 F6806-6745,O=C(C1CC1)NC1CN(CC(CN2)OCC2=O)CCC1,1 F2004-0194,O=C(CSc(cc1)nnc1-c1ccco1)NCc(cccc1)c1Cl,1 F6513-5788,Cc(nc1)cnc1C(NCc1c(CCCC2)n2nc1)=O,1 Z2460782709,Cc1cc(C(N(CC2)CC2(C(O)=O)c2ccccc2)=O)co1,0 Z4597720667,CCOC(C1)CC1(CNc1c(cnn2Cc3cccc(Cl)c3)c2ncn1)N1CCOCC1,1 SD62-0217,Cc1cc(C(N2CC3(CCC3)C(CCC(N3CCCC3)=O)C2)=O)cnc1,0 F6043-0275,Cc(n(-c1ccccc1)nc1C)c1N(CC1)CCN1C(c1cc(-c2ccccc2)n[nH]1)=O,1 C887-1188,CC(n1c2cc3c1cco3)=NN(CCCC(N1CCC(Cc3ccccc3)CC1)=O)C2=O,1 F6680-2739,CC(C(N(CCN1c2cc(C(F)(F)F)ncc2)CC1=O)=O)Oc(cccc1)c1F,0 Z2440209888,COc1ccc(CCCC(NCCC2CNCC2)=O)cc1,1 D153-0164,CC(c1nn(-c(cc2)ccc2OC(F)(F)F)nc1Nc(cc1)ccc1C(NC1CC1)=O)=O,1 F6416-5500,Cc1cc(C(NCCC(c2cc(cccc3)c3o2)O)=O)c(C)o1,0 F6619-4109,Cc1nc2ccccc2nc1N(CC1)CCN1c1nccc(N2CCOCC2)n1,1 Z1787721999,CC(CCN(C1)C(CSCC(N)=O)=O)C1OC,0 Z2217566625,CCn1nncc1C(N1CCN(CC(Nc(cccc2)c2Cl)=O)CC1)=O,1 Z2897919816,OC(c1n[nH]cc1NC(C(C1)C1(Cl)Cl)=O)=O,0 S651-1019,CN(CC(C1)(CC2)CCN2C(c2cscn2)=O)C1C(N1CCCC1)=O,1 Z1310784003,Cc1cccc2c1nc(-c1nonc1N)s2,0 F6312-0200,O=C(c(o1)ccc1Br)NCCCn1c2ncccc2cc1,1 V005-9376,CCN(CC)c1c(CN(C2CC2)C(c2cccc(C(F)(F)F)c2)=O)c(-c2ccccc2)no1,1 F6381-3996,O=C(Cn1c(cccc2)c2nc1)N(CCCC1)CC1c(cc1)ccc1F,1 S953-0366,CN(C)S(N(CC(C1)(CC2)CCN2c(cc2)cc(C(F)(F)F)c2C#N)C1C(NC1CC1)=O)(=O)=O,1 F3406-9756,CC(N=C(N1CC(Nc(ccc(OC)c2)c2OC)=O)N2CCOCC2)=CC1=O,0 Z1066610900,O=C(c(cc1)ncc1Br)NC(CN1CCOCC1)c1ccccc1,1 V020-2126,Cc1ccc(C(NC2C(CC3)CC3C2)=O)c(C(CC2)CCN2C(c2cccc(Cl)c2)=O)n1,0 F6451-1391,COC(CNS(c(cc1)ccc1OC(F)(F)F)(=O)=O)c1cc(F)ccc1,0 F3225-7120,CC(C)CN(C(c1cccs1)=NC(N(C)c1c2cccc1)=C1C2=O)C1=O,1 S606-0964,CN(c1cccnc1N1[C@H]2CN(Cc3cc(F)cc(F)c3)CC2)C1=O,0 F0413-0119,CC(C)(CO)NC(C(c1ccccc1)c1ccccc1)=O,0 F6469-2575,O=C(Cn1nccc1)N(CC1)CCN1c1ncnc(-n2ncnc2)c1,1 K788-6710,Cc1nn2c(N(CC3)Cc4c3cccc4)cc(C)nc2c1-c(cc1)ccc1Cl,0 F6401-0042,COc(cc1)ccc1C(CN(CC1)CCC1c1cccs1)=O,1 S543-0597,CC(C)NC(N(C1CC1)C1CC(CC2)(CCN2C(C2CCC2)=O)OCC1)=O,1 SC04-0927,Cc1noc(C)c1Cc1ccc(C(N(CCC2)CC2OCCc2noc(COC)n2)=O)o1,1 Z2984266476,Fc(cc1)cc2c1nc(N(CCC1)C11CNCC1)s2,1 8010-6263,OC(CCC1)c2c1c(cc(cc1)Br)c1[nH]2,0 Y043-1863,N1(\N=C(/C=C\C1=O)\c1ccc(cc1)Br)CC(N[C@H](C(=O)O)Cc1ccccc1)=O,0 Z594357260,O=C(Nc(cc1)cc(F)c1F)N(CCC1)CC1N1CCCC1,0 Z2698609824,OC(CC1)CCN1c1c(ccs2)c2nc(-c2ncccc2)n1,0 S963-0222,Cc1cc(S(N[C@@H](CN(C)C2)[C@H]2C(NC)=O)(=O)=O)cc(C)c1,0 F2086-0330,COC1=CN(CC(NCC2OCCC2)=O)C(CN2CCCCCC2)=CC1=O,1 Z4473012482,CN(C(CC1)CCC1C(F)(F)F)C(c(cc1)nc2c1[nH]nn2)=O,1 Z2569537384,CCC(Cc(cc1)ccc1F)NS(c1ccc(C(O)=O)o1)(=O)=O,1 F6520-2000,O=C(C(Nc1c(C(F)(F)F)cccc1)=O)NCCc1ccc(-c2cocc2)s1,1 F6521-7939,Cn(c(C(NCC(c(s1)ccc1Cl)OC)=O)c1)nc1-c(cc(cc1)OC)c1OC,1 SC03-0451,Cn1ncc(C(N(CC2)CCC2OCCc2noc(C3CCOCC3)n2)=O)c1,0 SB70-0874,O=C(Cn1cncc1)N[C@@H](Cc1c2)Cn1nc2C(NCc1ccccc1)=O,1 F6443-5156,Cc1nc(ccc(C(N(CCC2)CC2(c2c3cccc2)OC3=O)=O)c2)c2s1,1 SA02-0199,CCn1nc(C)c(-c2cc(C(N(CC3)CCC3c3nc(C)ncc3COC)=O)no2)c1C,0 SA17-0636,Cc1ccc([C@H]([C@@H](CC2)C(NC3CC3)=O)N(CCOC)C2=O)cc1,1 S428-0674,O=C(c1noc(CN2CCOCC2)c1)N1CCC(Cc2nc(C3CCOCC3)no2)CC1,1 Z3138681138,NC(CC1)CCC1(C1)C1C(NCCc1cc([nH]nc2)c2cc1)=O,1 F727-0278,O=S(Cc1ccccc1)(N(CC1)CCN1c1ncnc(-c2cc(F)ccc2)c1)=O,1 C200-9103,Cc1c(CSC(N2)=NC(CCN(Cc(cc3)ccc3Cl)C3)=C3C2=O)nc(-c(cc2)ccc2OC)o1,0 F3406-4328,Cc(cc1)cc(Br)c1NC(COc1nc(-c(cc2)ccc2F)nc(C)c1)=O,0 F6368-0051,Cc(n(-c1ccccc1)nc1)c1C(N1CCN(CCn2c(-c3ccccc3)ncc2)CC1)=O,1 F6497-8055,O=C(c1cc(C(CC2)CCN2C(c2cnc(C(F)(F)F)cc2)=O)n[nH]1)NCC(F)(F)F,0 Z3416516609,CN(C1)CC(C2)(CN2C(CCC2CC2)=O)C1c1nc(N2CCCC2)ncc1,1 Y200-6025,CC(CC(Nc1c(C(Nc2c(C)cccc2)=O)c(CCCC2)c2s1)=O)CC(O)=O,0 SA96-1352,O=C(C1C(C2)(CN2C(C2(CC2)c2ccccc2)=O)CN(Cc2ccccc2)C1)N1CCCC1,1 Y031-3769,CCc1nnc(NC(c(cccc2)c2NC(C(CC2=O)CN2c2ccccc2)=O)=O)s1,0 SC72-0603,Cn1c(CN(C2)CC22OCc3c2cnc(-c2ccccc2)n3)ccc1,1 Z2618929636,O=C(C1c2ccc(C(c3ccccc3)=O)n2CC1)N(Cc1ncccc1)C1CC1,1 Z5009889429,N#Cc1nc(N2Cc(cccc3)c3NCC2)ccn1,0 Z375282538,Cc1c(C)cc(CC(N2CCN(CC(N)=O)CC2)=O)cc1,0 F532-0339,CC(C)NC(Nc(cc1)ccc1-c1noc(-c(cc2)ccc2C#N)n1)=O,0 Z2912015517,CC(NCc(cc1)ccc1C(N[C@@H](CC1)Cc2c1ncs2)=O)=O,0 F6245-4647,CCN(C=C1C(N(CC2)CCC2C(N2C3CC3)=NN(C)C2=O)=O)c(nc(C)cc2)c2C1=O,1 SC55-1176,Cc(cccc1)c1NC(N(C1)CC1(CN(Cc1ccccc1)C1)C1c1nc(C2CC2)n[nH]1)=O,1 F6562-4027,CN(C)c1nc(CCC(C2)NC(c3ccco3)=O)c2cn1,1 SC73-0206,CCOCC(N(CC1)CCC1(C1)OCc2c1n(C)nc2C(NC1CC1)=O)=O,1 Z2287281261,CC(CC1)C(C)CC1C(NS(c(s1)ccc1Cl)(=O)=O)=O,0 SC46-0232,C(C1)C1c1n[nH]c(C(C2)C3(CCCC3)CN2C2CCOCC2)n1,1 F6480-3113,Cc1nc(OC(CCC2)CN2C(CN(C(CC2)=O)C2=O)=O)nc(C)c1,1 Z2843946152,O=C(CC(CCN1)C1=O)Nc(cc1)cc(C=CN2)c1C2=O,1 Z1039263868,O=S(c1cncc(F)c1)(N1CCN(Cc2ccccc2)CCC1)=O,1 Z1711864675,CN(CC1)CCN1c1ncc(CNC(N2CCOC3(CCOCC3)CC2)=O)cc1,1 F2449-0160,O=C(C(CC1)CCN1S(c(cc1)ccc1F)(=O)=O)Nc1ncnc2c1CCC2,1 F3379-0800,Fc(ccc(-n1ncc2c(NCc3ncccc3)ncnc12)c1)c1F,1 F6729-7458,Cc1noc(CN(C)C(C2)CN2c(cc2)nnc2-c(cc2)ccc2F)n1,1 F6479-3162,O=C(c1cocc1)N(CC1)CCC1Oc(ccnc1)c1Cl,1 C779-1145,CCn(c(C(N(CC1)CCC1C(NC1C(C)C(C)CCC1)=O)=O)c1)c2c1scc2,0 F6748-5123,CSc(nc1)nc(N2CC(COc3ccncc3)CCC2)c1Br,0 F3110-1477,COCCNS(c(cc(cc1)F)c1OC)(=O)=O,0 S069-1751,O=C(c1nccc2ccccc12)N(CC1)CC1c1noc(C2CC2)n1,1 Z4327622711,CN(C)S(c(cc1)cnc1NC(N(CC1)CCC1Nc(cc1)ccc1Cl)=O)(=O)=O,1 S779-2170,Cc1cnc(C2CCC2)n1CC(CC1)CN1C(c1ccco1)=O,1 Y043-3397,COc(c(OC)c1)cc(C2)c1C=CN(CC(c(cc1)cc(CC3)c1N3S(C)(=O)=O)=O)C2=O,1 Z1220414133,CNC(CN(Cc1cccc(C(F)(F)F)c1)C(c(cc1)cnc1C(OC)=O)=O)=O,0 F6192-0184,CC(C)(C(NCC(c1ccco1)c1ccco1)=O)Oc(cc1)ccc1Cl,0 S954-5168,NC([C@@H](CN(C1)c(cc2)cc(C(F)(F)F)c2C#N)[C@H]1C(CC1)CCN1C1CCCC1)=O,0 Z1514200304,Cc1cnc(CCN(C)S(N2CC(CCCC3)C3CC2)(=O)=O)s1,1 SA49-1325,O=C(CC1COC(C2)(CN2C(c(cc(cc2)Cl)c2F)=O)C1)NCc1ccncc1,0 Y031-4300,CCCC(C)c1nnc(NC(C(C2)CN(CCc(cc3)ccc3F)C2=O)=O)s1,0 Z295684924,CS(c(cc1)ccc1C(N(CC1)CCN1c1ncnc2c1ccs2)=O)(=O)=O,0 G805-0634,CC(CCCC1)N1S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O,0 Z1971457499,CCC(N(CC1)CC1NC(Nc1cn(C)nc1C(C)C)=O)=O,0 Z1631854489,O=C(c1c[nH]nc1-c(cccc1)c1Cl)N1CC(COc2ccccc2)CC1,1 Z1534674204,COCC(Cc1ccccc1)NC(N(CCOC1)C1C1CC1)=O,1 F258-0353,CN(CCc1noc(-c(cccc2)c2Cl)n1)S(c1cc(CCCC2)c2cc1)(=O)=O,0 T990-4854,O=C1N(CCc2ccccc2)CCC1N(CC1)CCN1S(c(cc1)cc(F)c1F)(=O)=O,0 F3222-5489,Cc1nc2ccccc2c(OCC(Nc(ccc(Br)c2)c2F)=O)n1,0 Z368566346,C(C1CCCC1)Nc1nc2ccccc2nc1,0 V009-1587,CCCC(CN(CC1CC1)Cc(c(C(C)C)nn1-c2ccccc2)c1Oc(cccc1)c1F)O,0 F6495-5477,O=C(C(C1)CN1c1ncnc(-n2nccc2)c1)NCc1nc(cccc2)c2[nH]1,1 SA24-0085,OC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1ccccc1)=O,0 Z1578885553,Cc1cnc(CNc(ccc(Cl)c2)c2C(N2CCCC2)=O)s1,0 F543-0602,CC(C)C(c1nc(-c(cc2)cc(N3)c2N(C2CCCC2)C3=O)no1)NC(c1ccco1)=O,1 Z2185545067,OC(C(CC1)N1S(c(cc(C(F)(F)F)cc1)c1Cl)(=O)=O)=O,0 F5614-0140,O=C(c(cccc1)c1Cl)N1CCN(Cc2nc(cccc3)c3[nH]2)CC1,0 Z2850543418,CCOC(c(nc(cc1)N(C)CCN(CCC2)C2=O)c1Br)=O,1 F6212-0402,O=C(c1c2OCCCn2nc1)NCc1nncn1-c1ccccc1,1 Z1550919585,CCOc1c(C)ccc(C(N(CCC2)C2c2c(C)[nH]nc2C)=O)c1,0 Z1898841338,CN(CC(C(NCc1ccccc1)=O)c1c2cccc1)C2=O,0 Z4095380018,CC(C1)(C2)OCCC12NC(c1cc(C(F)(F)F)nc2ccccc12)=O,1 F6512-7083,Cn1ncc(S(N(CCC2)CCN2C(OCc2ccccc2)=O)(=O)=O)c1,1 Z3686689562,CN(C)C[C@@H](C[C@H](C1)O)N1c1cc(N(C)CC(N2)=CC=CC2=O)ncn1,1 D146-0225,Cc(c1c2)coc1c(C)c(O1)c2C(C)=C(CC(NCCc(cc2)cc(OC)c2OC)=O)C1=O,0 F6559-1171,CSc1cc(C(N(CC2)CC2n2c(cccc3)c3nc2)=O)ccc1,0 F5591-0742,O=C(c(o1)ccc1Br)N(CC1)CCN1c(cc1)ncc1-c1noc(C2CC2)n1,1 Z2958886715,O=C(Cc(cc1)cc2c1OCC2)Nc1c[nH]nn1,1 F6604-7635,OC(CCC1)C1N1CC(CN2N=C(C3CC3)C=CC2=O)C1,1 F6729-7416,Cc(n(C)nc1C)c1S(N(C)C(C1)CN1c(cc1)nnc1-c(cc1)ccc1F)(=O)=O,1 F5999-1160,Cc(cc1)c(C)cc1-n1nc(CN(C2)C(c3ccno3)=O)c2c1-n1cccc1,1 F2073-0589,CC(C=CC1=NC(C)=C2NC(c(cc3)ccc3S(N3CCCC3)(=O)=O)=O)=CN1C2=O,1 Z4246902404,CN(CC1)CCN1C(C(CCSC)NC(c1cc(scc2)c2[nH]1)=O)=O,1 S556-0918,Cc1noc(C)c1S(N(C1)CC1Oc(cc1)ccc1-c1noc(COC)n1)(=O)=O,1 S426-0387,CCOCc1nc(C(CCC2)CN2C(NC2CCCC2)=O)no1,0 F6660-0337,O=C1N(Cc(cccc2)c2F)C(N2CCCC2)=NC(c2ccncc2)=C1,1 Z4607150947,COC(c1cc(CCC(C2)N)c2cc1)=O,0 Z2053810780,CC(CN(CC1)CC(C)N1C(Nc1cc(OCCN(C)C)ccc1)=O)O,0 Z813353338,O=C(NCc1cc(F)ccc1)N(CCC1)CCN1S(c1ccccc1)(=O)=O,0 Y206-3526,CC(CC1)Cc2c1c(C(N)=O)c(NC(CN1CCOCC1)=O)s2,1 F6438-3427,COc1nc(N2CCOCC2)nc(CNC(c2cc(-n3nccc3)ccc2)=O)n1,1 F6660-0444,Cc(nc(c1c2)N3CCSCC3)cn1nc2C(NCCc1cccs1)=O,1 V008-4842,O=C(c(ccc(F)c1)c1F)NC(CC1)CCN1c(cccc1)c1C(N(CC1)CCN1c1ncccc1)=O,1 F3375-3093,CCOC(c1c(-n2nnnc2)scc1-c1ccccc1)=O,1 V028-8045,CC(C)c(cc1)ccc1NC(N1Cc2c(N3CCN(C)CC3)nc(N3CCCC3)nc2CC1)=O,1 Z2144547722,O=C(c1nocc1)NC1CN(CC(F)(F)F)CCC1,1 F6442-2029,CCOc(cc1)c(C)cc1S(N(C1)CC1S(CC(C)C)(=O)=O)(=O)=O,0 Z2372644695,CC(C)(C(CC1)c2ccccc2)N1C(Cc1c[nH]c2c1cccn2)=O,0 SB57-1574,Cn1ncc(CN(C2)CC2(CN(C2)S(C)(=O)=O)C2c2nc(C3CC3)no2)c1,1 Z3416867743,CNC(c1c(C(C(C2)C3)C2N3C(c(cc2)cc(C(F)F)c2F)=O)ocn1)=O,0 Z1068745018,CCC(C)N(C)C(C(CCC1)CN1C(Nc(cccc1)c1F)=O)=O,0 Z1102998612,CC(c(cc1)ccc1S(NC)(=O)=O)Nc1nn2c(-c3ccccc3)nnc2cc1,0 Z2964979557,CC(CC(N)=O)c(cc1)ccc1NC(c1cnc2n1CCCC2)=O,0 F3386-2901,CCOc(cccc1)c1N(CC1)CCN1S(c(cc(c(OC)c1)Cl)c1Cl)(=O)=O,0 G282-3493,CCCN(C(C)(Cn1c2c(C(NCCCc3ccccc3)=O)nc1)C(NCCC(C)C)=O)C2=O,1 F6420-0699,CC(C)S(c1ccc(CC(NCC2(CSCC2)OC)=O)cc1)(=O)=O,0 F5022-0125,CC(C)(C)C(NCCCN1CC(c2ccccc2)OCC1)=O,0 Z3061110836,CCn1c(CN(CCC(O)=O)Cc2cc(C)ccc2)ncc1,0 Y503-4036,CCn1ncc(NC(C(CCC2)CN2S(c2c(C)n(C)nc2)(=O)=O)=O)c1C(N(C)C)=O,0 Z1730036644,CC(C)(C)c1cccc(NS(c2cnc3n(C)nc(C)c3c2)(=O)=O)c1O,1 Z2097726495,CC(c1nnc(C2CCCC2)n1CC1)N1C(N(C)Cc1ccccc1)=O,1 S974-0518,CC(C)C[C@@H](C(N(C[C@H](C1)N(C)C)[C@@H]1C1)=O)N1C(Cc(cc1)ccc1Cl)=O,0 D445-0200,Cc(cc(cc1)N(C(CC2)=O)S2(=O)=O)c1S(N(C)C(CC1)CS1(=O)=O)(=O)=O,0 F6521-6700,OC(CNC(Nc(cc1)cc(Cl)c1Cl)=O)c(cc1)ccc1-n1nccc1,1 Z3071585179,Cn(c(c1n2)c(N(CC3)C[C@H]3OC)nc2Cl)nc1Br,1 4673-0492,O=C(C1=Cc(cccc2)c2OC1=O)Nc(cccc1)c1Sc1c(c(CCCC2)c2s2)c2ncn1,1 F6752-6197,O=C(C(CCC1)CN1c1nc(cccc2)c2o1)N(CC1)CCC1(F)F,1 SB23-0925,Cc1n[nH]c([C@@](CN(C2)C(C3CC3)=O)(CC3)[C@@H]2CN3C(Cc(cc2)ccc2Cl)=O)n1,1 Z1473521230,CC(C)C(C(NCc1cc(F)c(C)cc1)=O)N(CCC1)S1(=O)=O,0 S858-2487,OC[C@](CN(Cc1ccccc1)C1)(C2)[C@H]1CCN2C(c(cc1)cc(F)c1F)=O,1 SA24-1134,Cc1nc(C(N(C2)CC2N(C2)[C@H](CO)CC2(F)F)=O)co1,0 F5876-0040,Cc1noc(C)c1CCC(NCCOc1cccc2cccnc12)=O,1 SC54-0289,Cc1nnc([C@@](CN(Cc2ccccc2)C2)(CC3)[C@@H]2CN3C(COc(cc2)ccc2F)=O)o1,1 Z425372918,COC(c1cc(c(OC)cc(OC)c2)c2[nH]1)=O,0 V014-8968,CC(CC1)CCN1C(C(C1CCCC1)N(CC1)CCN1C(Nc(cc1)ccc1F)=O)=O,0 Z1451192894,CC(C(N(C)C(CCO)c1ccccc1)=O)c1c(C)onc1C,0 Z2201754556,Cc1n[nH]c(CNC(CC2)CN2c(cccc2)c2F)c1,1 S742-0247,Cc1noc(C)c1S(N(CC1)CCC1N(C[C@H]1OC)[C@@H]1c1ccncc1)(=O)=O,1 Y300-3801,CCOc(cc1)c(C)cc1C(NCc(cc1)ccc1N1CCN(C)CC1)=O,0 Z2311343408,COC(CC1)CCC1NC(N(CCCCC1)C1c1ccco1)=O,1 S427-0689,Cc(cccc1)c1S(N1CC(Cc2noc(-c3ccncc3)n2)CCC1)(=O)=O,0 Z2330669633,NC([C@@H](CN(Cc1cnccc1)C1)[C@H]1c1ccccc1)=O,0 F6541-2412,O=C(c1nc2ccccc2cc1)N(CCN1)CC1=O,0 F6156-0603,O=C(c1cc(C(F)(F)F)ccc1)N1CC(COc(cc2)ccc2F)C1,0 Z3577182855,CC(C)(CC[C@@H]1O)C[C@@H]1NC(c1cc(Cc2ncccc2)ccc1)=O,1 S570-0129,O=C(C1(CC1)c1ccccc1)NCC1(CCC(N2)=O)C2=CCCC1,0 G856-7479,O=C(CCCc1ccccc1)NC(CC1=O)CN1c1cccc(F)c1,1 Z1430531716,Cc1c(C)c(N(CC2)CCN2C(CN2CCOCC2)=O)nn2c1nnc2C(F)(F)F,1 F1907-9087,OC(CC1)(CCN1C(CC1CC1)=O)C(F)(F)F,0 F5596-0932,O=C(COc(cc1)ccc1Cl)N(CC1)CCC1c1nnc(-c(cc2)ccc2F)o1,1 F6444-6407,O=C(c(cc1)ccc1OC(F)(F)F)N(C1)Cc2c1cnc(N1CCOCC1)n2,0 F6286-0661,O=S(c(cc1)cc2c1OCCO2)(NCCc1nc(C(F)(F)F)cc(C2CC2)n1)=O,1 F5791-2702,Cc1noc(C)c1CCC(NCCOc(cc1)ccc1F)=O,1 F5832-0378,COc1ccc(C2(CNC(Nc(cc3)cc(OC)c3OC)=O)CCCC2)cc1,0 M569-0165,O=S(c1cccc2nsnc12)(N(CC1)Cc2c1nc(-c(cc1)ccc1F)nc2)=O,0 F6359-4039,O=C(c1cc(Br)cnc1)N(CC1)CCC1Oc1nc2ccccc2nc1,1 T158-0282,Cc1cnc(C(CC2)CN2S(Cc(cccc2)c2F)(=O)=O)n1CCOC,0 8020-1896,CCNc1nc(NC(CC2c(cc3)cc(CSc4ncccc4)c3OC)=O)c2s1,1 Y042-2825,Cn(c(C(NCC(O)=O)=O)c1)c2c1c(OC)cc(OC)c2,0 F6514-6532,O=C(c(cc1)ccc1S(N1CCOCC1)(=O)=O)NC(Cn1nccn1)c1ccccc1,1 F6222-0192,COCC(Nc1cnc(N2CCOCC2)nc1)=O,0 S728-0027,OCCC(C1)(C11CCOCC1)C(NC1CCCCC1)=O,1 Z952366222,COc1ccc(CCCC(NCc2nc(Cc3ccccc3)no2)=O)cc1,1 SC11-1520,CS(N(CCCN1CCCC1)C(CCC1)CN1C(c1ncccn1)=O)(=O)=O,1 CM3593-1146,CC(C)n1c(ccc(OC)c2)c2c(CN2CC(Cn3nnc(COC)c3)CCC2)c1,1 S725-1812,CCC(N(CC1)CCC1(CC1CC1)NC(COC)=O)=O,0 F6560-7597,Cn(c(C(NCc(cc1)cnc1-c1cocc1)=O)c1)nc1-c1cc(OC)ccc1,0 F6475-7009,O=C(c1cc(OC2CSCC2)ncc1)NCc1nc(cccc2)c2[nH]1,1 Y041-4405,COc(cccc1)c1C(C=C1)=NN(CC(N(C(CC2)CS2(=O)=O)c2ccccc2)=O)C1=O,0 SA72-1044,COCCC1(CCN(CC2CCCCC2)CC1)c1noc(C2CCOCC2)n1,1 F6374-5612,COc(ccc(F)c1)c1S(N1CCC(CSCc2ccco2)CC1)(=O)=O,0 SC55-0427,CN(C1)CC(C2)(CN2C(NC2CCCCC2)=O)C1c1nc(CCOC)n[nH]1,1 Z3405711537,CN(C)C(c(cc1)cc(CC2)c1N2S(CC1CC2(CC2)C1)(=O)=O)=O,1 Z1626890810,Cc1nc(C(CCCCC2)N2C(c(cc2)cnc2C(NC)=O)=O)no1,1 Z2772015109,Cn1c(N(CCC2)CCC2c(cccc2)c2OC)nc2c1ccnc2,1 Z2362281550,CCC(C)n1ncc(NC(NC(CC2)CCC2C(O)=O)=O)c1C1CC1,1 Z963641074,OC(c(cc(cc1)NC(C2OCCCC2)=O)c1Cl)=O,0 F3145-1818,COc(cc1)ccc1C(NCCC1=CCCCC1)=O,1 Y044-4485,O=C(CC1Oc(cccc2)c2NC1=O)NCCc1c[nH]c2c1cccc2,1 F5854-1989,O=C(Nc(cc1)cc2c1OCO2)N(CCc1cccs1)Cc1cnccc1,1 Z1972768498,CC(CNC(c1cc(-c2nc(cccc3)c3s2)nc2ccccc12)=O)c1nncn1C,1 F6658-5593,Cc1c(C)ncnc1OCC(CC1)CCN1C(C(C1)CN(C2CCOCC2)C1=O)=O,1 Z2443703210,CC(CCn1nc2)Cc1c2C(NS(C1CCC1)(=O)=O)=O,1 Y200-5995,CC(CC(Nc1c(C(NCc2ccccc2)=O)c(CCC2)c2s1)=O)CC(O)=O,1 Z4999452335,CC(C)(C(Nc1ccccc1)=O)NC(c(cc1)cc(CN2C(CCC(N3)=O)C3=O)c1C2=O)=O,1 F2135-1436,COC(c1ccc(CSc2nc(-c3ccccc3)ccn2)cc1)=O,0 Z1518059012,CC(C)(C)c1cc(C)c(CCNC(N(CC2)CC2c2nccn2C)=O)c(C)c1,0 E130-0785,COc(cc1)ccc1Nc1nc(-c(cccc2)c2OC2)c2c(-c2cccc(Cl)c2)n1,0 Z45509341,O=S(c(cc1)ccc1Br)(NC1CCCCC1)=O,0 Z2223917397,CCN(CC)S(c(cc1)cc(NC(c2cc(F)c[nH]2)=O)c1O)(=O)=O,0 Z1546232974,CC(CC(N(CCC1)C1c1cc(C)c(C)cc1)=O)c1c(C)[nH]nc1C,1 Z1903107322,OC1(CCN(Cc2nc(CC(F)(F)F)no2)CC1)c(cc1)ccc1-c1ccccc1,0 F2865-0588,O=C(c1cccs1)N(CC1)CCN1c1ncnc2c1nnn2-c1cc(F)ccc1,1 V019-0919,CCC(CN(CCC(C)C)CC(N1)=Nc(scc2-c(cc3)cc(OC)c3OC)c2C1=O)O,0 F5042-0048,CCc(s1)ccc1S(N(CC1)CCN1c(cc1)nnc1-c1ccco1)(=O)=O,1 Z2947537387,CC(C)c1nsc(CN(CC2)CCN2C(c(cc2)ccc2O)=O)n1,1 F2094-0240,CCc(cnc(N(C)C(N1Cc(c(F)ccc2)c2Cl)=O)c2C1=O)c2OC,1 Z3629870058,CC(N(CC1)C2(CC2)C11CCOCC1)=O,1 M049-0789,CN(c(cccc1)c1N=C1c(cc2)ccc2C(NCCC2=CCCCC2)=O)C1=O,0 SB55-0244,Cc1noc(C)c1S(N(C[C@@H]1CCC2)C[C@@]12c1noc(C)n1)(=O)=O,0 F6557-0767,COc1cccc(N(CC(C2)C(N(CCC3c4ccccc4)CCS3(=O)=O)=O)C2=O)c1,1 F6479-4159,Cc1cc(OC(CC2)CCN2C(c(c(F)ccc2)c2Cl)=O)nc(C)n1,0 Z2704328089,Fc(cccn1)c1OC1CCN(Cc2noc(C3CCC3)n2)CC1,1 F6755-2658,Cc1cccc(N(CC2)CCN2c2nc(C)cc(C)n2)c1C,0 F6521-9715,COC(CNC(C(Nc(cccc1)c1SC)=O)=O)(C1)Cc2c1cccc2,0 Z1884943773,CC(COCC1)C1C(N(CC1)CCN1c1nc2ccccc2cc1)=O,0 Z370305354,O=C(C(CCC1)N1C(c(cc(cc1)Cl)c1Cl)=O)Nc1ccncc1,1 F6525-4512,O=C(Cc1cscc1)NCCn1ncc(-c2ccccc2)c1,1 F6670-6373,CC(N1CC(CC2)CCN2S(C2CC2)(=O)=O)=Nc(cc(cc2)F)c2C1=O,1 Z1325960591,CNC(c(cc1)cc(NCC(N2CCCCCC2)=O)c1Cl)=O,0 F6656-2775,CC(C)(C)c(cc1)nnc1OCC(CC1)CCN1C(c(o1)ccc1Br)=O,1 Z1625479110,CC(C(C(N1CC(Cc(cc2)ccc2F)CC1)=O)NC(C1CC1)=O)O,0 F6245-5870,CN(C(C(F)(F)F)=NN1CCNC(C(CC2)CCN2S(C)(=O)=O)=O)C1=O,1 F3394-1032,CC(C(Nc(ccc(Br)c1)c1F)=O)NS(c1cc(Cl)ccc1)(=O)=O,0 M575-0171,CCN(C(C(NCc(cc1)ccc1Br)=O)c1c(C2)cccc1)C2=O,1 Z1239272816,COc(cc1)nnc1C(N(CC1)CCN1C(c(c(F)ccc1)c1Cl)=O)=O,0 S976-1552,O=C(C1(CN(Cc2ccco2)CCC1)F)NCc1ccncc1,1 8014-2409,CCC(C(C(CCC1)=O)=C1NCCc1c(C)[nH]c2c1cccc2)=O,0 Z2952183418,Cc1nn(C)c(NC(CN(CC2)CCN2c2nc(C)n[nH]2)=O)c1,1 J030-0509,O=C(c1c2)Nc(cccc3)c3Oc1cc(Oc1cnccc1)c2S(N1CCOCC1)(=O)=O,0 G940-0479,O=C(C(CC1)CCN1S(c1cnccc1)(=O)=O)Nc(cc1)cc2c1OCCO2,1 F2666-0029,O=C(c1cccc(Br)c1)Nc(cc1C2)cc(CCC3)c1N3C2=O,0 Z1725403438,CC(C)(c1ccc(CNC(C(CCCC2)N2C(c2ccco2)=O)=O)cc1)O,0 Z4931450486,CC(C1)OC2(CCCCC2)CN1c1cc(Cl)nc(-c2cocc2)n1,1 S049-0212,COCc1nc(-c(cc2)ccc2OC2CN(Cc(cc(cc3)F)c3F)CC2)no1,0 Z2903947513,OC(C1(CCC1)S(NC(C1)COc2c1cccc2)(=O)=O)=O,0 P681-0399,CN(C(C1(CC2)CN2C(c(ccc(OC)c2)c2OC)=O)=O)c(cc2)c1cc2OC,0 SC10-0321,O=C(C1CCC1)N(CCCN1CCOCC1)C(CC1)CN1C(c1cccs1)=O,1 Z1185404896,CC(NC(c1ncccn1)=N1)=C(CC(N(C2CC2)C(CC(N2)=O)C2=O)=O)C1=O,1 Z1626861333,CC(C)c1nc(C(COCC2)N2C(C2CC2)=O)no1,0 F5854-4520,Cc(cc(cc1)F)c1S(N(CCc1cccs1)C1CC1)(=O)=O,0 F6561-5847,Cn1ncc(-c2nccc(CNC(C3c(cccc4)c4Oc4c3cccc4)=O)c2)c1,1 F1125-0130,COc(cccc1)c1N1CCN(CC(COc(c(OC)ccc2)c2OC)O)CC1,0 F3225-7250,COc(cc1)ccc1C(NC(Sc1c2cccc1)=C(c1cccs1)C2=O)=O,1 Z1218145412,CC(C(O)=O)N(CC1)Cc2c1n(-c1ccccc1)nc2,0 Z1382537694,CC(C)CC(NCCC(N1C(CC(c2ccccc2)=O)CCC1)=O)=O,0 Z1521853203,COc1ccc(CCC(N(CC2)CCN2C(C(CC2)Cc3c2[nH]nc3)=O)=O)cc1,1 F6529-1195,Cc1noc(C)c1CN(CC1)CCC1N1N=C(C(F)(F)F)N(C)C1=O,1 Y041-4761,C=1(/C(Oc2c(\C1)cccc2)=O)\c1ccc(OCC(N[C@@H](Cc2ccccc2)CO)=O)cc1,0 Z1985851976,Cc1cn(-c(cc2)ccc2Cl)nc1NC(CCc1c(C)n2nc(N)nc2nc1C)=O,0 F6041-0426,CCOC(N(CC1)CCC1NC(c(cc1)ccc1OCc1nc(C2CC2)cs1)=O)=O,1 F0651-0240,Cc1cc(cc(CNC(c2cc(cccc3)c3o2)=O)cc2)c2n1C,1 SB15-1170,O=C(C1CC1)N(C1CCOCC1)C(CCC1)CN1S(N1CCOCC1)(=O)=O,1 C630-0278,CC(C)Cn1c(cccc2)c2nc1C(CC1=O)CN1c(cccc1)c1Br,0 Z3173804960,COc(ccc(C[C@H](CCC1)N1C([C@H](C1)C[C@H]1C(O)=O)=O)c1)c1OC,1 Z1438694725,CC(C)Oc1cc(C(N(CC2)CCC2c2ncc[nH]2)=O)cnc1,0 Y042-6797,N1(C(c2c(C1=O)nccc2)=O)CCC(N1[C@H](c2nc3c([nH]2)cccc3)CCC1)=O,1 Z2766244844,Cc(nccc1)c1C(NC[C@@H](CC1)O[C@@H]1c1ncn[nH]1)=O,0 SA24-2147,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(Cc1ccncc1)=O,0 F6190-1562,OC(CCNC(c(s1)ccc1Cl)=O)c1cccs1,0 F6791-7942,CN1N=C(C(CC2)CCN2c(cc2)nn3c2nnc3)N(C2CC2)C1=O,1 Y020-0395,CN(CC1)CCN1C(CC(N1c(cc2)ccc2Oc2ccccc2)=O)C1=O,1 Z3589003984,C[C@H]1N(Cc2ccccc2)[C@@](CNC(c2cnc(C)c(C#N)c2)=O)(CO)COC1,1 F2135-1026,OC(c1cn(Cc2ccccc2)nc1OCc1ccccc1)=O,1 F3406-8207,CC(C)C(Nc(cc1)cnc1-n1cnc(C(N(CC2)Cc3c2cccc3)=O)c1)=O,1 F6619-4410,CCNc1cc(C)nc(N(CC2)CCN2c2ncnc3ncccc23)n1,1 F6512-0339,O=C(c(cc(s1)Cl)c1Cl)N1Cc2ccnn2CC1,1 Z635048886,OCC(CC1)CCN1C(C(N1)=Cc(cccc2)c2C1=O)=O,0 V026-6623,COc1cc(CCN(Cc(cccc2)c2F)C2CNS(c3ccccc3)(=O)=O)c2cc1OC,0 Z1971441955,CC(C)c1nn(C)cc1NC(NCC1(CCC1)O)=O,0 F6709-4394,CCc1ncnc(N(C2)CC2Oc2cc(C(F)(F)F)ncc2)c1F,1 F0916-6823,O=C(CCCN1N=Nc(cccc2)c2C1=O)NCc1cccs1,1 F6495-1814,O=C(c1ncnc(N2CCCC2)c1)N(CC1)c2c1cccc2,1 C071-0494,COc(ccc(-c1cc(C(F)(F)F)nc(S(CCCC(N(CCC2)c3c2cccc3)=O)(=O)=O)n1)c1)c1OC,1 Z1281106955,OC(CNC(c1c[nH]nc1-c1cccc(OC(F)F)c1)=O)(CCC1)c2c1cccc2,1 F6108-0102,COCCN(CC1)CCC1NC(c(cc(cc1)Cl)c1OC)=O,0 F6363-0691,O=C(c1ncccc1)N(CC1)CCN1c1ncnc(-n2cccc2)c1,1 SC09-0335,C[C@H](COc(cc1)c(C2)cc1-c1cncnc1)N2C(NCCc1ccccc1)=O,1 T787-4552,O=C(C(CN(C1)C(NCc2ccco2)=O)C11CCOCC1)N1CCCCC1,1 Z2091763031,CNC(C1(CC1)C(N(CCC1)CCC1(C(F)(F)F)O)=O)=O,0 S948-5264,COCCNC(N1C[C@@H](CN(C2)c(cc3)cc(C(F)(F)F)c3C#N)[C@]2(COC)CC1)=O,0 Z2376915665,C[C@@H]([C@H](CCC1)C(O)=O)N1C(CC(C(F)(F)F)c1ccccc1)=O,0 8010-8363,CC(C(C(c(cc1)ccc1Br)N(CCN1CCOCC1)C1=O)=C1O)=O,0 F6432-0318,O=C(C1CC=CCC1)Nc1ncnc(-n2ncnc2)c1,1 Z2088850036,COc1nc(N(CC2)CCC2C(N2CCCC2)=O)nc(OC)c1,1 Z1443703160,Cn1ncc(C(NCC(O)=O)=O)c1C(F)F,0 K061-0828,O=C(c(cnn1c(C(F)(F)F)c2)c1nc2-c(cc1)ccc1Br)N1CCCC1,1 8019-8868,CS(N(CCC1)c(cc2)c1cc2C(Nc(cc1)cc(CO2)c1C2=O)=O)(=O)=O,1 F6439-0827,Cn(cc1C(NCCn(c2c3CCCC2)nc3-c2ncccc2)=O)nc1OC,1 L534-0749,O=C(c1cc(-c2ncnc(Oc3ccccc3)c2)ccc1)NC(CCC1)c2c1cccc2,0 E990-0570,CCN(CC)C(C(CCC1)CN1c1ncnc2c1c(C)no2)=O,0 F5581-0268,Cc1cc(C(N(CCn2nccc2)c(sc2ccc3)nc2c3Cl)=O)no1,1 Z651154462,O=C(c1c[nH]nc1)NCc1cc(Oc2ccccc2)ncc1,0 CM4573-0163,COc(cc1)cc(-c2n[nH]cc2CN(C2)[C@H](CN3CCCC3)CC2(F)F)c1OC,1 F6571-1819,OCCOC1(CNC(C2(CCCC2)c2cccs2)=O)COCC1,1 SB91-1347,Cc(n(C)nc1)c1C(N(CC1)CC1N(CCN1CCCCC1)C(N(C)C)=O)=O,0 F6677-3826,Brc1cn(CC(C2)CN2c2nnc(C3CC3)s2)nc1,1 Z1598091640,O=C(C(CC1)(CCC1NC(CCC1)C1c1ccccc1)N1)NC1=O,1 Z1488105899,Cc1csc(C(CC(N(CC2)CCC2N(CCCN2)C2=O)=O)(C(F)(F)F)O)n1,1 Z2958001336,OCC1(CC1)NC(c1ccc(Cn2nc(C(F)(F)F)c(Cl)c2)cc1)=O,1 SA89-0254,Cc(occ1)c1C(N1CCC(CN(CCN2CCOCC2)C2CCOCC2)CC1)=O,0 F6724-4467,OC(CNc1nc(cccc2)c2o1)(CCC1)c2c1occ2,1 F6442-0206,CC(Nc1ccc(CC(N(C2)CC2S(c(cc2)ccc2F)(=O)=O)=O)cc1)=O,0 Z2722820802,C[C@@H](C[C@@H](CO)CC1)N1C(Cc1c[nH]c(cc2)c1cc2Cl)=O,0 Z2860206550,O=C(C(C1)CC11CCCCC1)Nc1cnc(N2CCNCC2)nc1,1 F6349-0173,CCOC(c1c(cc(cc2)NC(C3c(cccc4)c4Oc4c3cccc4)=O)n2nc1)=O,1 F2495-0152,COc(ccc(Cl)c1)c1NC(CC(CSC1=NC=C2)N1C2=O)=O,0 Z993607256,CC(CC1)CN1C(c1c(C)n2nc(C)cc2nc1)=O,0 Z3517742852,NC(C1CC2(CCC2)C1)C(N[C@H](C1)C[C@@H]1S(c1ccccc1)(=O)=O)=O,1 SC73-0124,CN(C)C(c1nn(C)c2c1COC(CC1)(CCN1C(c1ccco1)=O)C2)=O,1 F6604-2223,CC(C)c1nc(S(N(C)C(C2)CN2c(cc2)nn3c2nnc3C2CCC2)(=O)=O)cn1C,1 SA24-2151,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1conc1C)=O,0 S836-2318,COC[C@@H](CN(C1)C(c(cc2)cc3c2OCO3)=O)[C@H]1C(N)=O,1 SA49-0333,O=C(CC1COC(C2)(CN2C(c2n[nH]cc2)=O)C1)N1CCCC1,1 F6403-2883,O=C(Cn(cc1)c2c1cccc2)NCCc1csc(-n2nccc2)n1,1 Z2646486056,COC(c1ccc(C(N[C@@H](CC2)[C@@H]2c2ccccc2)=O)s1)=O,1 F1883-1573,O=C(c(oc1c2cccc1)c2NC(c(cccc1)c1Cl)=O)Nc(cc1)cc2c1OCCO2,1 F6807-7262,COc(cccc1)c1N1CCN(Cc2noc(C3CCOCC3)n2)CC1,1 F6474-0500,CC(C)n1cnc(S(N(CC2)CCC2OC(C=C(C)N2C)=CC2=O)(=O)=O)c1,1 F6806-7016,O=C(CN1CC(C(N2CCSCC2)=O)OCC1)NC1CCCC1,1 SA67-0969,Cc1nc(CCC(CC2)CN2C(Cc2cccs2)=O)no1,1 F2019-2247,CCOc(cc1)ccc1C(N(CCCN(C)C)c1nc(c(C)cc(C)c2)c2s1)=O,0 F5788-4112,O=C(CN(CCN1c(cc2)cc3c2OCCO3)C1=O)NCCCn1cncc1,1 C648-0045,CN(c(ccc(S(N(CCC1)CC1C(Nc(c(OC)c1)cc(Cl)c1OC)=O)(=O)=O)c1)c1O1)C1=O,0 F6525-2088,Cn(c(CNC(c1nc(cccc2)c2s1)=O)c1)nc1-c1nccnc1,1 T636-2097,O=C(c1cocc1)N(CCC1)CC1Nc1ncnc2c1CCC2,1 F3358-0303,CC(CC1)CCN1c1ccnc(SCCCN(c(cccc2)c2N2)C2=O)n1,1 F6709-4210,CN(C)S(c(cc1)ccc1C(N(C1)CC1Oc1cc(C(F)(F)F)ncc1)=O)(=O)=O,0 Z477223268,CCc1c(C)cc(C(NS(C)(=O)=O)=O)s1,0 F6806-6455,O=S(C1CC1)(N(CCC1)CCN1c1ncncc1F)=O,0 F6617-2044,CC(CN(c1cccc(F)c1C(N1C2CC2)=O)C1=O)=O,0 F5087-0296,CC(C)n1nc(C)cc1NC(c1cccc(SC)c1)=O,0 Z434369716,Cn1c(C(CC2)CCN2C(c2cc(c(Cl)c(cc3)Cl)c3[nH]2)=O)nnc1,0 F6520-0928,O=C(C(NCCC1=CCCCC1)=O)NCCc1ccc(-c2ccco2)s1,1 F6491-2329,Cc1nc(C(N(CCC2)CC2Oc2nccnc2N(C)C)=O)cs1,1 S212-0805,O=C(Cn1cncc1)N(CCC1)CC1OCc1nc(C2CC2)no1,1 Z2437594238,CC(c1nc(C(C)(C)C)no1)NS(c1c[nH]c(C(O)=O)c1)(=O)=O,0 F2337-0595,COCCNc1c(cnn2CCNC(c(ccc(F)c3)c3F)=O)c2nc(SC)n1,0 6408-0465,CCOc1c(CNc(cc2)ccc2N2CCN(Cc3ccccc3)CC2)cccc1,1 Z2296071895,OC(c1cn(C(CC2)CCN2C(c(cc2)cc3c2[nH]nc3)=O)nc1)=O,1 F6554-8162,O=C(c1cc(-c2ccco2)n[nH]1)N1C(C2)CSC2C1,1 Z3091743360,Cc1c(CNc2nccc(Br)c2)[nH]nc1C,0 F6204-0875,O=C(c1nc(cccc2)c2s1)NC1(CCOCC1)c1cccs1,1 Z1282765801,Cc1nc(CNC(NC2CN(Cc3ccccc3)CCC2)=O)no1,1 F2077-0096,CC(Nc(cc1)ccc1Nc1nc(Nc2ccccc2)cc(C)n1)=O,1 F6480-1051,O=S(c1cccs1)(N(CCC1)CC1Oc1ccncc1)=O,1 Z4444512565,COc(ccc(COc1cn(Cc(cc2)ccc2F)nc1)c1)c1F,1 SA58-0549,O=C(c1ccco1)N1C(CCc2noc(C3CC3)n2)CCC1,1 M759-2468,CS(N(Cc1cnccc1)C(C1)CN1C(Cc1c[nH]c2c1cccc2)=O)(=O)=O,1 V027-2101,CC(C)CC(Nc(cc1)cc(CN(C2CCCCC2)C(C2CC2)=O)c1N(C)C)=O,0 Z2256273516,CCC1(CCC1)NC(Cc(cc1)ccc1C(O)=O)=O,0 Z645939460,Clc1cc2ncnc(N(CCC3)CC3N3CCCC3)c2cc1,0 Z2445648843,O=C(C(NC1c(cc(cc2)Cl)c2OC1)=O)NCCCC1CCNCC1,1 E632-0291,CCOc(cc1)ccc1NC(N1CCC(CN(CC2)Cc3c2cccc3)CC1)=O,0 F6560-0722,O=C(c1cc(Oc(cc2)ccc2F)ccc1)NC(C1CCOCC1)c1cccs1,1 F396-0658,O=C(CSC(N(CC1OCCC1)C1=O)=Nc2c1sc1ncccc12)NCCc1ccccc1,1 8017-0798,COc(cc1)ccc1NC(CC1)CCN1C(CC(N1c(cc2)ccc2F)=O)C1=O,0 Z1452667155,CCNc1nc(C(N2CC(C)(C)CC2)=O)cs1,0 SB94-0520,COCCNC(C(C1)CN(CC(CC2)CCN2C(C2(CC2)c2ccccc2)=O)C1=O)=O,1 J031-1706,O=C(CSc1nnc(-c(cc2)cc3c2OCCCO3)n1C1CC1)NC1CCCC1,1 SB21-1248,NC(c1cn(C[C@H](C[C@@H](C2)F)N2C(c(ccnc2)c2F)=O)nn1)=O,0 F6296-1320,Cn(c(CNC(Nc(cc1)cc2c1OCO2)=O)c1)nc1-c1ncccc1,1 SA65-1102,Cc1nc(S(N2CCC(CCc3noc(C4CCOCC4)n3)CC2)(=O)=O)cn1C,1 S824-3364,Cc(cccc1)c1S(N(C[C@@H]1COC)C[C@@H]1c1ccncc1)(=O)=O,0 F6522-0596,CC(C(NCc1cc(-c2cscc2)cs1)=O)Oc1ccccc1,1 Z987896878,CC1Oc(ccc(NC(NCc(cc2)ccc2-c(cc2)cc3c2OCCC3)=O)c2)c2NC1=O,1 Z636395116,Fc(cc1)ccc1NCc1cn(-c2ccccc2)nc1-c1cnccc1,0 F6525-4629,CS(NCCn1ncc(-c2ccccc2)c1)(=O)=O,0 Y502-1349,O=C(c1ccc(COc2cc(CCC3)c3cc2)o1)Nc1nn(Cc(c(F)ccc2)c2Cl)cn1,0 F6708-8542,C(C(C1)c2ccccc2)C1(C1)CN1c1nncs1,1 M281-4624,CC(c1c(C)cc(C)cc1)NC(CCn1nnc2c1ccc(C(NC1CCCCC1)=O)c2)=O,1 F5882-5252,Cc1c(C(N(CC2)CCN2S(C2CC2)(=O)=O)=O)c(-c(cccc2)c2Cl)no1,1 F1122-1378,CC(CCC1)CN1S(c(cc1)ccc1C(Nc(cccc1)c1-c1nc(cccc2)c2o1)=O)(=O)=O,1 Y030-7544,COCc1nnc(NC(C2CCCCC2)=O)s1,0 F2146-0031,CC(CC1)Cc2c1c(-c1nc(cccc3)c3s1)c(N)s2,1 Z1817649597,CC(C)C(CC(O)=O)NS(c1c(C(C)C)cccc1)(=O)=O,0 Y042-4915,COCc1nnc(NC(CCN(C(c2ccccc2)Nc2c3cccc2)C3=O)=O)s1,1 Z397792420,CN(C)C(CC1)CCN1c1nc(C(F)(F)F)nc2ccccc12,0 Z3344387702,CC(C)(C)c1nnc(C(NCc2nc(CCCC3)c3[nH]2)=O)o1,1 Z2987054426,CCn1c([C@H]2OCCC[C@@H]2NC(c2cnc3n2CCC3)=O)ncc1,1 Z2771389157,Cc1nn(C)cc1NC(c1cn(CCN(C)C)nc1)=O,0 Z3342934130,Cc1cccc(-c2cn(CCN3CCCCC3)nn2)n1,1 F6188-1020,O=C(CCc1ccc(C(F)(F)F)cc1)NCC1(CCOCC1)Sc1ccccc1,0 Z3352572409,OCC(C1)CN1C(c1ccc(C2COCC2)cc1)=O,1 Z1265655875,CCn1nc(C)c(NS(c2c(C)sc(C)c2)(=O)=O)c1C,0 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F6564-2341,O=C(c1ccno1)NCCN1N=C(C2CC2)C=CC1=O,1 SC72-1662,O=S(C1CC1)(N(C1)CC11OCc2c1cnc(-c1ccccc1)n2)=O,1 Z635715668,CC(CNCc(cc1)cc(OC)c1OCc1ccccc1)CN1CCCC1,0 Y205-4811,CS(N(CC1)CCN1C(C(c1ccccc1)Sc1ccccc1)=O)(=O)=O,1 Z1974146555,Cc([nH]c1ncc2)nc1c2C(N1C(CC(c(cc2)ccc2F)=O)CCC1)=O,1 F1021-0004,COc(cccc1)c1NCC(CN1c(cccc2)c2Sc2c1cccc2)O,1 F6252-1353,COc(cc1)cc(C(CN(C=C(C=C2)c3nc(C4CC4)no3)C2=O)=O)c1OC,1 F2493-3346,CN(C(C=C1)=O)N=C1C(NCc1noc(-c(cccc2)c2F)c1)=O,1 Z3899216817,Cc(n(C)nc1C(F)F)c1NC(c1c(C)c(C#N)ccc1)=O,0 M039-0233,Cc(n1nc2)cc(C)nc1c2-c(cc1)cc(S(Nc2cc(OC)ccc2)(=O)=O)c1OC,0 Z1344930911,O=C(c(ncnc1)c1Cl)NCCc1coc(-c(cc2)ccc2F)n1,1 F6675-6445,CN(C(C1)CN1c1ncccc1)c(nc1)ncc1Br,0 F3225-2122,Nc1c(C(OCC2OCCC2)=O)c2nc3ccccc3nc2n1Cc(cc1)cc2c1OCO2,1 Z1171736292,O=C(CN(C=CC=C1C(F)(F)F)C1=O)NCCc1nc(C2CCCCC2)cs1,0 F5261-0064,Cn1c(C(CNS(c(cc(cc2)Cl)c2OC)(=O)=O)N2CCCC2)ccc1,1 F6514-2900,O=C(c(c(F)ccc1)c1F)N(C1)CC1OCC(F)(F)F,0 L008-0618,O=C(c(cc1)ccc1-c(cc1)nnc1NCc1ccccc1)NCCC1=CCCCC1,1 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Z1275063241,CN(Cc1ccccc1)C(CC1)CN1C(Cc(cc1)ccc1F)=O,0 F6519-5818,O=C(CN(c(cccc1)c1O1)C1=O)NCC(c1ccco1)n1nccc1,1 Z1260481995,CC(Cc1c(C2)cccc1)N2C(c(cc1)ccc1S(CCOC)(=O)=O)=O,0 Z1129361294,Cc1cccc(C2)c1CCN2C(CCCC(N1)=Nc(cccc2)c2C1=O)=O,0 F6359-3780,Cc(cc1)nnc1OC(CC1)CCN1C(c(cccc1)c1C(OC)=O)=O,0 F6806-6977,O=C(C(C1)OCCN1c(c(F)c1)ncc1Br)N1CCSCC1,0 F2392-0848,COc1ccc(CCC(NCC(c2cscc2)N(CC2)Cc3c2cccc3)=O)cc1,1 F6472-8175,O=C(CCc(cc1)cc(C(F)(F)F)c1Cl)N(CC1)CC1N(CC1)Cc2c1cccc2,1 D503-0219,Cc1c2nc(C)cc(NCC3OCCC3)n2nc1-c1cccc(Cl)c1,0 Z1434008755,C[C@@H](CO)NC(NC1CN(Cc(c(F)ccc2)c2F)CCC1)=O,0 Z1982205916,Cn(cnc1ccc2)c1c2C(N(CC1)CC1c1ccccc1)=O,1 V009-7304,CC(C)c(cc1)ccc1-n1c(-c(cccc2)c2OC2)c2cc1CCC(NCC1OCCC1)=O,1 Z1566593674,C[C@H]1NCCN(Cc(cc(cc2)Cl)c2OCc2cnccc2)C1,0 Y031-4093,O=C(C(C1)CN(C2CCCC2)C1=O)Nc1nnc(C2CCCCC2)s1,1 SB56-1157,CN(C)S(N(C[C@@H]1c2nc(C3CCCC3)no2)C[C@@H]1c1cnccc1)(=O)=O,0 S688-1103,Cc1cccc(CN(CC2)CCC2(CCOC)NC(C2CC2)=O)c1,0 Z2296067789,CC(CC(O)=O)(c1cc(OC)ccc1)NC(C(C=C1)=CN(C)C1=O)=O,0 Z2936916360,CCS(c(cc1)cc(C(NC(CCNC2)C2F)=O)c1Cl)(=O)=O,0 Z1893546757,OCCC1(COCC1)NC(c(cc1)ccc1Cl)=O,0 F5868-0348,Cc1cc(C)nn1-c1cc(NCCNC(COc2nc(C)ccn2)=O)nc(C)n1,1 F6247-0228,O=C(COc(cc1)c(C2)cc1Br)N2c(cc(cc1)F)c1Cl,0 Z1272656549,CCN(CC)C(CC1)CN1c(cc1)ncc1-c1nc(C)no1,1 S823-0306,Cn1cnc(C(N[C@@H](C2)[C@@H](CO)CN2c2ncncc2)=O)c1,1 Z1591615145,Fc(cc1)cnc1N1CCN(CCc2ncccc2)CC1,1 F217-0381,CC(C)(Cc1ccc2)Oc1c2OCc(cc1)ccc1C(Nc1c(C)cc(C)cc1)=O,0 F6506-4290,COCC(CNC(NCCOc1ccccc1)=O)(c1ccccc1)O,0 Z1447117492,O=C(c(cc1)ccc1Nc1ncccn1)Nc1cccc(OCC(F)(F)F)c1,0 H025-3208C,CNc(c1cccc(N2CCNCC2)c1nc1)c1S(c1ccccc1)(=O)=O,1 Z1840279002,CCOC(CCC1)CN1c1ncc(C(F)(F)F)s1,0 Z1645540932,CCc(cc(cc1)Br)c1NC(c1nc(-n2cncc2)ccc1)=O,0 SB32-0707,Cc1cnc(CN(C[C@@H]2COC)C[C@@H]2c2nc(C3CC3)n[nH]2)cc1,1 Z2347553214,Cc1nc(-c2cccs2)nc(N2CC(CC(N)=O)C2)c1,1 V026-6103,COc1cccc(CN(CC2)C(CNS(c3ccccc3)(=O)=O)c(cc3OC)c2cc3OC)c1,0 F2617-0208,O=C(COC1=COC(CN(CC2)Cc3c2cccc3)=CC1=O)N(CCC1)c2c1cccc2,1 S761-0267,COC[C@@H]1N(Cc2ccccc2)CCC[C@@H]1C(NCCN1CCCCC1)=O,1 Z2942656775,CNC(CCc1cccc(S(N)(=O)=O)c1)=O,0 F6796-9167,CCc(ncnc1N(C)CC(CC2)CCN2c2c(ccs3)c3ncn2)c1F,1 P657-0945,O=S(c1ccc(-c2nnc(C3CCCC3)o2)o1)(NC1CCCC1)=O,1 Z3073925103,CCOC(CC1)CCN1C([C@@H](CCc1ccccc1)N)=O,0 F6543-1047,FCCN(CC1)CCN1c1c(cc(cc2)F)c2ncn1,0 F6363-0826,O=C(Cc(cc1)ccc1F)N(CC1)CCN1c1ncnc(Nc2ncccc2)c1,1 Y044-4677,N1(C(c2c(C1)cccc2)=O)[C@H](C(N1CC2\C=3\N(C(\C=C/C3)=O)CC(C1)C2)=O)CC(C)C,1 Z3416005336,CCN=S(CC1)(CCC1(C1)OCCN1C(NC1COCCOC1)=O)=O,1 Z4360433225,CN(CC1)Cc2c1c(C(N)=O)c(NC(CC1CC1)=O)s2,1 Z3517929213,CC1OC(C)C(CC(Nc2cnc(N3CCNCC3)nc2)=O)C1,1 Z1964784454,CC(C1CCOCC1)NC(c1ccc(C(O)=O)o1)=O,0 SD61-0393,O=C(CN(c(cccc1)c1O1)C1=O)N(C1)CC2(CCC2)C1C(NCc1ncccc1)=O,1 Z3217436969,CC(C)(C(O)=O)Oc(cc1OCCc1c1)c1-c1cnccc1,0 Z355232462,CNC(c1ccc(CNS(c(cc2)cc3c2OCCO3)(=O)=O)cc1)=O,0 Z2919606868,CCNCc1c(COCC2)c2nn1C,1 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F3406-6098,CC(c(cc1)ccc1OC)NC(CSc(cc1)nnc1-n1cnc(C)c1)=O,1 Z2483014298,CC(C)C1OCCN(CCOc2cccc(C(O)=O)c2)C1,0 F6485-0116,O=C(c(cccc1)c1Cl)NC(CC1)CCC1Oc1ncccn1,0 F0537-0301,CCOC(c1csc(NC(c2cc(CCCC3)c3cc2)=O)n1)=O,0 F1618-0665,COc1cc(-c2nnc(/C=C/c3ccccc3)o2)cc(OC)c1OC,1 Z3063570559,CC(NCc1nc(-c2cc(CN3CCCCC3)ccc2)no1)=O,0 F6814-0502,C(CN(CC1)c(cc2)nn3c2ncc3)N1c1nc(cccc2)c2[nH]1,1 F6747-5755,CCc1nccn1CC(C1)CN1c(sc1c(cc2)OC)nc1c2OC,0 Z872638790,COc1cccc(CC(N(CC2)CCN2C(c(cc2)cc(CC3)c2NC3=O)=O)=O)c1,1 Z1756212267,Cc(ccc(NC(c1cn(C)nc1C1COCC1)=O)c1)c1S(C)(=O)=O,0 S551-0565,O=C(c(cc1)cc2c1[nH]cc2)NCc1nnc2n1ccc(-c1nc(C3CC3)no1)c2,1 F6676-1340,Cc1nccc(OCC(CC2)CCN2c(ncnc2)c2F)c1,0 SC77-1366,CC(C)S(N(C[C@H]1C(NCCc2cccs2)=O)C[C@@]11OCCNC1=O)(=O)=O,1 F6559-5570,Cc1nc(N(CC2C(F)(F)F)CC2C(O)=O)nc(C)c1,0 Z3085378657,Cn1ncc(-c2nc(cccc3)c3[nH]2)c1NC([C@@H]1[C@H]2OCCC[C@@H]12)=O,1 Z2872632494,OC(C1)(C2)C1CN2C(C(Nc(cc1)ccc1N1CCCCCC1)=O)=O,1 Z3325177951,COc1cc(F)c(C(Nc2cc(Oc3ccnc4ccccc34)ccc2)=O)nc1,0 Z1490900217,CN(Cc1cscn1)C1CCN(Cc2ccccc2)CC1,0 Z30172450,O=C(C(CSC1(CC2)c3ccccc3)N1C2=O)NCc1cnccc1,0 D064-0300,COc(cc1)ccc1OCc(s1)nn2c1nnc2C1Oc(cccc2)c2OC1,1 P930-5507,O=C(COc(cc1)ccc1F)N(CCC1)[C@@H]1c1nnc(-c(cc2)ccc2F)[nH]1,1 F6411-2816,CC(C)Cc(cc1)ccc1C(C=C1)=NN(Cc2c(C)onc2C)C1=O,1 Z2895261633,Cc(n1S(c(cc2)cc(C=C3)c2OC3=O)(=O)=O)ncc1[N+]([O-])=O,0 Z1389241088,O=C(Cc(ccc(F)c1)c1F)N1CCN(Cc2ccccc2)CCC1,0 Z4896538199,CN(CC1NCCC1)S(c(cccc1)c1[N+]([O-])=O)(=O)=O,0 C255-1161,CC(CC1)(C(NCc2ccccc2)=O)N(CCc(cccc2)c2Cl)C1=O,0 SA93-0140,CC1(CN(Cc2c(C)onc2C)CCC1)C(N)=O,0 8017-2402,OC(c(cc1)c(C2C=CCC2C(c2ncccc2)N2)c2c1Cl)=O,0 Z2968362860,Cc(cc1)ccc1C(C(CC1)CCN1c1cccc(F)c1C(N)=O)=O,1 Z3686844745,CN(C(C(C(CC1)C2CC2)N1C(Nc(ccnc1)c1F)=O)=NN1)C1=O,0 Z741645832,Cc1cccc(S(Nc2cc(Cn3ncnc3)ccc2)(=O)=O)c1,0 F6806-6501,O=S(C1CC1)(N1CCN(Cc2cncs2)CCC1)=O,1 F5854-0689,O=C(CC(c1ccccc1)c1ccccc1)N(Cc1ccco1)Cc1ncccc1,1 G603-0245,Cc(cc1)c(C)cc1S(N(CCC1)CC1c1nc(-c2cccc(Br)c2)no1)(=O)=O,0 8019-2339,CC(C)N(C(Cn1c(cccc2)c2nc1C1OCCC1)=O)c1ccccc1,0 Z2800671970,O=C(C(C1)OCC1c1ccccc1)NOCc1cnccc1,1 Z1608827067,CC(C)(CN(CC1)C(N(C)C)=O)N1C(c(cc1)cc2c1[nH]cc2)=O,0 E216-5325,CCC(C1)Oc(cccc2)c2N1C(Nc(cccc1)c1OCC)=O,0 S649-1289,COC(C1)C2(CCOCC2)N1C(CC1)CCN1C(c1cccs1)=O,0 F6507-8798,COC1(CNC(c2ccco2)=O)CCSCC1,1 F6111-1365,O=C(c(cc1)cc2c1OCO2)N1CCC(COCc(cc2)ccc2Cl)CC1,1 F6549-4764,Cn1ncc(C(CCC2)CN2C(c2nc(cccc3)c3s2)=O)c1,1 F6725-0006,O=S(C(CC1)CCN1c1nc(cccc2)c2o1)(c1ccccc1)=O,1 Z1171751002,CNc1cc(C(NCc2cc(NC(c(cc3)ccc3F)=O)ccc2)=O)cc(Cl)n1,0 F6546-0875,O=S(C1CCCCC1)(N1CC(CN(C2)C3CC3)C2C1)=O,1 F6517-3784,CC(C)(C(NCC(c(cc1)ccc1-c1ccco1)O)=O)Oc(cc1)ccc1Cl,0 F6215-0042,Cc1noc(CCNC(c(cc(cc2)OC)c2Br)=O)c1,0 Z2478683687,O=C([C@@H](C1)[C@H]1C1CCC1)NS(c(s1)ccc1Cl)(=O)=O,0 Z780461730,CC(C1)OC(C)CN1c(cc1)ncc1NC(c(cc1)ccc1S(N)(=O)=O)=O,0 Z2467427043,Cc1cc(C(NCC(CC2CC2)C(O)=O)=O)c(C)cc1,0 Z3396939443,CN(C)CC1(C2)N(Cc3ccccc3)CC2C1,0 Z1927292340,CCc1cc(C(NC(C2)CN(C(C)(C)C)C2=O)=O)cnc1,0 F6443-7818,Cn1c(cccc2)c2c(CC(NCC(CCC2)N2c2ccccc2)=O)c1,1 Z2768189267,C[C@@H](C1)[C@@H](CO)CN1C(c(cc(cc1)F)c1F)=O,0 F5098-0150,O=C(C1CCCC1)N(CC1)c2c1ccc(NC(c(ccc(F)c1)c1Cl)=O)c2,1 F2200-0357,OCc(n1C2CCCC2)cnc1SCc1cccc2ccccc12,1 Z1875036578,CC(Nc(ccc(C(Nc1n[nH]c(C2CCOCC2)c1)=O)c1)c1F)=O,0 F9994-0488,Clc1cn(Cc2nc(-c3ccccc3)no2)nc1,0 Z809596516,O=C(Cn1nccc1)NCc(cccc1)c1-n1cncc1,1 F6192-0467,COc(cccc1)c1NC(NCC(c1ccco1)c1ccco1)=O,0 Z1944256600,O=C(C(c1c2cccc1)=NNC2=O)N[C@H](C1)[C@@H]1c(cc1)cc(F)c1Br,1 SC10-0001,CS(N(CCCN1CCOCC1)C1CN(Cc2cccc3cccnc23)CC1)(=O)=O,1 Z33559390,CN(C(C=C1)=O)N=C1C(Nc1ccc(Cc2ccncc2)cc1)=O,1 Z1319462984,O=C(c(cc1)ccc1N1CCCCC1)N(CCC1)CC1c1ncc[nH]1,1 Z2394588057,CN(C=C(C=C1)C(N(CCNC2)C2c2cccc(Cl)c2)=O)C1=O,0 Z2482792406,OC(c1c(CN2Cc3ncnn3CC2)c(cc(cc2)Br)c2o1)=O,0 G663-1053,CC1Cc2cc(C(N(Cc3c(C)oc(-c(cccc4)c4Cl)n3)C=N3)=O)c3nc2CC1,0 P297-4800,O=S(c1cc(CCC2)c2cc1)(N(CC1)CC1n1c2ncccc2nc1-c1ccco1)=O,1 C085-0867,COc(cc1)cc(S(N(CC2)CCN2c2cc(C(F)(F)F)ccc2)(=O)=O)c1OC,0 F5852-1449,CCOCCCNC(C(NCc(cccc1)c1Cl)=O)=O,0 SB59-0532,Cc1c(CN(C2)CC2(CN(C2)C(COC)=O)C2c2nncn2C)scc1,0 F6523-3340,Cc1c(C(NCCN(Cc(cc(cc2)Cl)c2OC2)C2=O)=O)c(C)nn1C,0 K906-3920,CN(CC(Nc1nc(ccc(OC)c2)c2s1)=O)S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O,1 Z4791768416,Cc(cc(cc1)C(NC(C(CC2)c3c2cccc3)C(O)=O)=O)c1Br,0 Z3138317577,NC(C1)C2(CCC2)C1NC(c1nn(CCC2)c2c1Br)=O,1 Z2958770268,Cc(cc1)cc2c1c(CCNC(c1cn(C3CCC3)nc1)=O)cn2C,1 Z1353024932,CC(C)N(CC1)CCN1c1nc(-c(cc2)ccc2F)cs1,0 S724-1494,O=C(c1cn(C(C2)CN2C(NCC2OCCC2)=O)nn1)NCC1CC1,1 F2553-0073,CC(c1c(C)nc(NC(c(cccc2)c2SC)=O)s1)=O,0 F6561-9384,CCN(C=C1C(NCc2cn(-c3cnccc3)nn2)=O)c(nc(C)cc2)c2C1=O,1 Z2234647427,Oc1cccc(Cl)c1NS(c1cc(CCC2)c2cc1)(=O)=O,1 Z2219718184,Nc(n(-c1ncccc1)nc1)c1C(Nc1cc(NC(CN2CCCCCC2)=O)ccc1)=O,1 C155-0501,CC(C)CC(C(Nc(ccc(OC)c1)c1OC)=O)NC(C1CCC(C)CC1)=O,0 Z2024466125,CC(CN(CC1)CC1(CO)F)=Cc1ccccc1,0 Z2796697752,Cc1c(CN(CCC2)C[C@H]2C(O)=O)c(cccc2)c2o1,1 F6424-0166,O=C(Cc(cccc1)c1F)Nc(cccc1)c1C(C=C1)=NNC1=O,1 C130-0513,FC(c1cc(-c2cccs2)nc(N(C2CCCCC2)C2CCCCC2)n1)(F)F,1 D470-1978,COc1cc(CCN(C2)[C@@H](CS(C3)(=O)=O)[C@H]3S(c(cc3)ccc3F)(=O)=O)c2cc1OC,0 Z2160594941,Cc(cc1)c(C2(CC2)c2noc(C(C3)C3(CC3)CCS3(=O)=O)n2)cc1F,1 8018-0828,CCOc(cc(C1Nc2nonc2NC(CC(C)(C)C2)=C1C2=O)cc1)c1O,0 Z2982566464,CN(CCC(O)=O)S(c(cccc1OC)c1OC)(=O)=O,0 F2245-0584,COc(cc1)c2nc(N(Cc3cnccc3)C(Cc3cccs3)=O)sc2c1OC,1 S687-1583,Cc(cc1)c(C)cc1NC(N(CC1)CCC11OCCC(Cc2nc(CCOC)no2)C1)=O,0 C798-0274,CCC1N(CCCNC(CCCN2c(cc(C)cc3)c3OCC2=O)=O)CCCC1,1 F0906-6546,Cc(c(C)c1)cc2c1ncn2Cc(cccc1)c1Cl,0 F5033-7753,O=C(CSCc1ccccc1)NCC(CC1)CCN1C(Nc(cc1)ccc1F)=O,1 F6108-0092,COCCN(CC1)CCC1NC(c(cccc1)c1Br)=O,0 S651-0684,CCn1nc(C)c(CN2CCC(C3)(CN(C)C3C(N3CCOCC3)=O)CC2)c1,1 F6472-7357,Cc1nn2c(CCN(C3)C(Nc4cccs4)=O)c3cnc2c1,1 F6188-0982,O=C(NCC1(CCOCC1)Sc1ccccc1)NC(c1ccccc1)c1ccccc1,1 Z4617222046,CC(C)CCC(CC1)CCN1C(C(N=C(C)N1)=CC1=O)=O,1 Z2962726898,CCO[C@@H](CC1)CN1C(c1coc(CCC2)c1C2=O)=O,1 F2631-0608,CCc1nn(c(O)c(C(c2cccs2)N(CC2)CCN2c(cccc2)c2F)s2)c2n1,1 Z2349279923,CC(c1csnn1)NC(N(CC1)Cc(cc2)c1cc2Cl)=O,0 Z2621730206,CN(C)C(N(CC1)CCN1C([C@@H](C1)[C@H]1c(cc1)ccc1OC)=O)=O,0 SC42-0137,Cc1noc(C)c1S(N(CC1)CCC11OCCC(Cc2noc(C)n2)C1)(=O)=O,0 F0616-0025,Cn1c(cccc2)c2c(SCC(NC2CCCC2)=O)c1,1 Z2778106642,CC(N(CCC1)[C@H]1C(NC1(CC1)c(cc1)ccc1OC(F)(F)F)=O)=O,1 F0382-0131,O=C(c(s1)ccc1Br)Nc(cc1)ccc1F,0 Z1834960839,O=C(Cc1ccccc1)Nc1cnns1,0 F1274-0038,CC1(c(cc2)ccc2OC)N(c(cccc2)c2S2)C2=NN1,1 K892-0181,Cc1c(C(Nc2nc(c(C)ccc3)c3s2)=O)sc(N=CN2CC(Nc3cc(C(F)(F)F)ccc3)=O)c1C2=O,0 F3407-0663,C=CCN(C(c(ccc(C(N(CC1)CCN1c1cccc(Cl)c1)=O)c1)c1N1)=O)C1=O,0 Z1139293681,O=C(CN1c(cc(cc2)Cl)c2OCC1=O)N1Cc2nncn2CC1,0 F6604-0538,CN(C(C1)CN1c(cc1)nn2c1nnc2)c(nccc1)c1C#N,1 F6524-2002,CC(C)n1nc(C)c(S(N(CC2)CC2c2nocn2)(=O)=O)c1C,0 Z1174819450,N#CCCN(C(c1noc(C2CC2)c1)=O)c(cc1)ccc1F,0 Z2482859457,CCc1c(CN(C)CC2(CC2)C(O)=O)c(cccc2)c2o1,1 Z1466179750,Cc1noc2nc(-c3cccs3)cc(C(NC3CC4(CCSCC4)OCC3)=O)c12,1 SA85-0628,OC(CN(Cc1ccccc1)C(C1)=O)CN1C(CCc1ccccc1)=O,1 F6529-1263,CN(C(C(F)(F)F)=NN1C(CC2)CCN2C(NC2CCOCC2)=O)C1=O,1 Z2284574867,CCC(NCCc1ncccc1C)=O,0 F6516-1542,O=C(NCc1ccc(-c2cscc2)o1)NCc1cccc2ccccc12,1 S858-2391,OC[C@](CN(Cc1ccccc1)C1)(C2)[C@H]1CCN2C(N1CCCC1)=O,1 F5033-7531,COc(cccc1)c1NC(N1CCC(CNC(c(cccc2)c2Br)=O)CC1)=O,0 F6448-2359,O=C(c(cccc1)c1S(C(F)F)(=O)=O)Nc1cn(CC2Oc(cccc3)c3OC2)nc1,0 Z1128655074,Cn1nnc2c1ccc(C(NC(CC1)CCN1c(cccc1)c1OC)=O)c2,1 Z30815113,CC(c1cccc(NC(Cn2nnnc2)=O)c1)=O,0 F6279-0541,Cn(c(C(NCC1CCN(Cc(cccc2)c2SC)CC1)=O)c1)nc1-c(cc1)ccc1F,1 Z372215860,CCC(c1ccccc1)NC(C(C1)CN(C(CC2)CS2(=O)=O)C1=O)=O,1 F6171-0167,O=S(CCOc1ccccc1)(Nc(cc1)cc(C2)c1-c1c2cccc1)=O,1 Z5003680115,CC(CN(CC(O)=O)C(C(Cc(c1ccc2)c2F)OC1=O)=O)O,1 Z1915813311,CC(C1)CN1C(c1cnc2n(C)nnc2c1)=O,0 Z1330701816,CC(CNC(N(CC1)CC1(C(F)(F)F)O)=O)Cn1nccc1,1 Z908366270,CC(C(N(CC1)Cc2c1[nH]nc2)=O)Oc(cc1)c(C)cc1Cl,0 F3406-4183,COc(cccc1)c1NC(CSc1cc(NCc(cccc2)c2Cl)ncn1)=O,0 F6745-8234,Cc(cc(C)nc1N(CC2)CCC2C(F)(F)F)c1C#N,0 Z3398291339,CN(C)C(CC1)(CC2)CCC12C(O)=O,0 SB71-0798,CC(C)CNC(c1nn(CCN(C2)C(c3n[nH]c(C4CC4)c3)=O)c2c1)=O,0 F3191-0207,CC(C)(C)OC(N(CCN1)C(CC(OCC2OCCC2)=O)C1=O)=O,1 F6436-2946,O=C(c1cc(cccc2)c2s1)NCC(CC1)CCN1C(c1cnccc1)=O,1 F6802-7337,O=C(C(C1)OCCN1c(nccc1)c1Br)N1CCOCC1,0 Z2295663002,OC(CCC(CCC1)CN1C(c1c(C(F)(F)F)cncc1)=O)=O,0 SA04-1139,Cc1ncc(CO)c(C(CCC2)CN2C(c2cocn2)=O)n1,1 SD56-0335,COc(cc1)nc(OC)c1C(N(CCC1)CC(C(N2c3ccccc3)=O)N1C2=O)=O,0 F6789-2007,CC(C)(C)c(nc1cc2)cn1nc2C(NCCc1c[nH]c2c1cccc2)=O,1 F6677-1075,CC(C)c1nccn1CC1CN(Cc(cccc2)c2Br)C1,0 Z1844746235,NC(C(CC1)(CCN1C(CCc(cccc1)c1N1)C1=O)c1ccccc1)=O,1 Z1421792549,CC(C)CC(CC1)CCN1C(c1c(C)n(C(C=C2)=NNC2=O)nc1)=O,1 F6619-5237,Cc1cc(N2CCN(Cc3csc(-c4ccccc4)n3)CC2)nc(N2CCOCC2)n1,1 F6560-0857,O=C(C(CCC1)N1c1nc(cccc2)c2o1)NC(C1CCOCC1)c1cccs1,1 SA44-0579,CC(C)Cc1nnc(C2N(C)CC(C3)(CN3C(CCn3nc(C)cc3C)=O)C2)o1,1 F5030-0259,Cc(cc1NC(Cc2cccs2)=O)nn1-c1nc(-c(cc2)ccc2Cl)cs1,1 L987-0310,O=C(CN(C=C(C=C1)c2nc(-c(cc3)ccc3Cl)no2)C1=O)NC1CCCC1,1 F0758-0108,Cc(cccc1)c1C1=C(C(F)(F)F)Oc(cc(cc2)OC)c2C1=O,0 F3222-2858,COC(c(scc1)c1NC(CN(CCCN1Cc(cccc2)c2Cl)S1(=O)=O)=O)=O,1 F6805-3689,COc(cc1)cc(N=CN2CC3CCN(Cc4nnc(C5CC5)o4)CC3)c1C2=O,1 F6745-1716,Brc1cc2cnc(N3CC(Cn4cncc4)C3)nc2cc1,1 Z1169977404,Cc1nc(Cc2noc(-c3csc(-c(cc4)cc5c4OCO5)n3)n2)no1,1 F6244-3014,COc1cccc(CC(NCC#CCN(CC2)Cc3c2cccc3)=O)c1,1 F6561-3745,CC(C)COc(cc1)ncc1C(NC(CC1)CCC1=C)=O,1 F6562-5289,O=C(c(cc1)ccc1-c1cscc1)NCCN(C=CC=N1)C1=O,1 S582-0767,O=C(CC1CCCC1)NCC(Cn1c2ccc1)N(Cc1cnccc1)C2=O,1 Z1524770596,Cc1cc([nH]c(C(NC(CC(c2ccccc2)O)CO)=O)c2)c2c(C)c1,0 M089-0081,Cc(sc(-c1n[nH]c(C(F)(F)F)c1)c1)c1S(N(CC1)CCN1c1c(C)c(C)ccc1)(=O)=O,0 F2255-1219,O=C(COc(cccc1cc2)c1nc2N(CC1)CCN1C(c1ccco1)=O)Nc1ccccc1,1 Z1134159774,O=C(NCC1CC1)Nc(cc1)cc2c1[nH]nc2,1 Y040-7135,O=C(C(c1ccccc1)Oc(cc1)cc(O2)c1C(c1ccccc1)=CC2=O)c1ccccc1,1 F6482-3942,CN(C=C(C(N(CC1)CCC1n1nccn1)=O)C(OC)=C1)C1=O,1 Z2482963615,COc1cc(C(C(O)=O)N2CC(c(cc3)cc(F)c3F)OCC2)cc(OC)c1,0 F6381-3988,O=C(CSC1CCCC1)N(CCCC1)CC1c(cc1)ccc1F,1 F6617-2748,COc(ccc(Nc1c(cc(c(OC)c2)OC)c2ncn1)c1)c1OC,0 S984-0893,CN(C)C([C@@](CN(C1)C(c2nccnc2)=O)(C2)[C@@H]1CN2C(NCCc1ccccc1)=O)=O,1 F2569-0391,O=C(NCC(c1ccco1)S(c(cc1)ccc1Cl)(=O)=O)OCc1ccccc1,1 Z3134713695,O=C([C@]1(CC2)[C@@H]2CNC1)NCCc1ccnn1-c1ccccc1,1 F6002-0215,CC1=CN=CN(CC(NCCOc2ccccc2)=O)C1=O,0 F6559-2193,O=C(C1(CCOCC1)c1ccccc1)NCc1nnc(CC2)n1CC2C(F)(F)F,1 Z2483017831,OC(C(c1cccc(Cl)c1Cl)N1CCC(CN(CCCC2)C2=O)CC1)=O,0 F6525-7783,CN(C)S(NCCn1ncc(-c2cocc2)c1)(=O)=O,0 S512-0562,COc(cc1)ccc1NC(N(CC1)CC1OCc1ccccc1)=O,0 Z1175486669,Cc1nc(-c2c[nH]c(C(N(CCC3)CC3C(NC)=O)=O)c2)cs1,0 Z1155345797,CC(C(Nc1cc(CC(C)(C)C)nn1C)=O)n1ncnc1,0 Y020-0302,Cc1c(C)cc2nc(NC(NC3=C4CCCC3)=NC4=O)nc(C)c2c1,1 F6454-0361,Cn1cnc(S(NCC(CC2)CCN2c2cnccc2)(=O)=O)c1,1 Z4345752263,Cn1ncc(NC(N(CC2)CCC2C2(CC2)O)=O)c1Cc1ccccc1,1 Z1267028216,O=C(CNC(c1ccc(C(F)(F)F)cc1)=O)N1CC(CN2CCOCC2)CC1,1 SB46-0121,O=C([C@H](C[C@H]1CN(C2)C(c3ccccc3)=O)C[C@@H]1NC2=O)NCc1ccco1,1 F6609-3964,Cc1c(C(OCC(Nc(cc(cc2)F)c2F)=O)=O)scc1,0 SB24-0113,CCCNC(N(CC1)CCC1(CC1)C1n1nnc(C(N(CC)CC)=O)c1)=O,0 F6125-3022,O=C(C(C1)CN1S(C1CC1)(=O)=O)NCCCn1cncc1,1 Z2087410738,CCc(cc(cc1)N(C(C(Cc2ccccc2)N2)=O)C2=O)c1F,0 V011-8448,CC(c1ccccc1)N(CC1)CCN1S(c1cc(OC)ccc1)(=O)=O,0 SA49-1169,O=C(CC1COC(C2)(CN2C(c(cc2)cc(Cl)c2F)=O)C1)N1CCCC1,0 CM3891-1306,OC(CN1CCCC1)(CC1)CCC1(CC1)CCN1S(c(cc1)ccc1F)(=O)=O,0 Z4924723266,O=S(c(cc1)c(cco2)c2c1F)(Nc(cc1)cc(Cl)c1F)=O,1 F924-0232,O=C(Nc(cc1)cc2c1OCCO2)N(CC1)Cc2c1n1nc(-c(cc3)ccc3Cl)nc1s2,1 F6037-0843,Cc(cc1)cc2c1[nH]c(C(C1)CN1S(c1cccc(Cl)c1)(=O)=O)n2,0 F6791-7617,Cc(cc1)c2sc(N(CC3)CCC3N(CC(N3CCOC)=O)C3=O)nc2c1OC,0 F5320-0182,CC(C)(C)NC(C(C=C1)=NN(Cc(cc2)ccc2F)C1=O)=O,0 F6752-5331,O=C(C(CC1)CCN1c1nc(cc(cc2)Cl)c2o1)NC1CC1,1 Z1878287657,CN(C(NC1(Cc2cccc(F)c2)CCC1)=O)c1ccccc1,0 SD01-1086,CCCn(c(CC1)c2CN1S(c(cc1)ccc1OCCC)(=O)=O)nc2-c1cocn1,0 Y041-6838,Cc1c(CCC(N2Cc3nnc(C(F)(F)F)n3CC2)=O)c(C)nc2ncnn12,1 Z2376856468,CC(C)(C)c(cc1)cnc1C(N[C@H](Cc1ccccc1)C(O)=O)=O,0 S978-0652,C[C@@H]1N(Cc2nc(OC)ccc2)Cc(cc(CN(C2CC2)S(C)(=O)=O)cc2)c2OC1,1 F5226-0388,O=C(C1CC1)Nc(cc1)ccc1C(NCCNC(c1cccc2ccccc12)=O)=O,1 Z2335284601,CC(C1(CCC1)OC)NC(c1cc(Br)c2OCCOc2c1)=O,1 G868-1397,Cc(cc1)ccc1S(N(CC1)CCN1c1nc(N2CCOCC2)cc(C)n1)(=O)=O,0 Z2438039531,OC(c1csc(CCNS(CC2COCCC2)(=O)=O)n1)=O,1 C692-0276,Cc1c(Cn2c(C(NC(N3C)=O)=O)c3nc2CN(CC2)CCN2c2cccc(Cl)c2)cccc1,0 F6211-0342,O=C(c1nn(CCCO2)c2c1)Nc(cc1)cc(C2)c1-c1c2cccc1,1 Z1654298769,CC(C(N1CC(N2CC3(CCOCC3)COCC2)=O)=O)(c2ccc(C)cc2)NC1=O,1 F3238-0106,OC(CNc(cc1)ccc1F)COc(cc1)ccc1C(c1ccccc1)=O,1 F6512-5507,Cc1nc(S(N(CCC2)CCN2C(c2cn(C)nc2OC)=O)(=O)=O)cn1C,1 D216-0523,CCC(c1c2cccc1)=NN(CC(NC(COc(cc1)ccc1OC)C(C)C)=O)C2=O,1 Z1642092435,CCc1cc(N2Cc3nnc(C4CC4)n3CC2)nc(C)n1,1 F6524-1105,O=C(Cc(cc1)cc2c1OCO2)NCCN1N=Nc(ccc(F)c2)c2C1=O,1 L598-0939,Cc1nc(-c(cc2)cc(S(NC3CCN(Cc4ccccc4)CC3)(=O)=O)c2OC)cs1,1 Z2905495372,NC(CCC(N(CC1)CCC1c1nc(cc(cc2)Cl)c2o1)=O)=O,1 SD02-0258,CC(C)c1nnc(C(C2)N(CC(N3CCCC3)=O)CC2(CC2)CCN2C(c2c(C)oc(C)c2)=O)o1,0 F6624-9648,Cc(cc1)nnc1N(C1)CC1N(C)C(N1C)=Nc(cccc2)c2C1=O,1 G369-0006,O=C1NC(CC2)(CCN2S(c2ccccc2)(=O)=O)Oc2c1cccc2,0 F0430-0100,Cn1c(cccc2)c2nc1CSc1nc(cccc2)c2o1,1 S240-1073,COCC(N[C@@H]1CN(Cc2c[nH]c3c2cccc3)[C@H](CO)C1)=O,1 Z2230843529,CC(C(C(N(CC1)CCC1(CO)c1ccccc1)=O)NC(C1CCCC1)=O)O,1 F6752-3707,O=C(C1CC1)NC1CN(Cc2cccc(Br)c2)CCC1,0 Z1494898560,O=C(c1c(CCCC2)n2nc1)N1CCN(Cc(cc2)ccc2F)CCC1,1 Z1887322993,Cn1c(C(Nc(cc2)ccc2Nc2ncccn2)=O)cc(C(N)=O)c1,1 Z348905270,CC(C)CCN(C1CCCC1)C(c1coc(Br)c1)=O,0 Z1438235832,OC(Cc1c(CNC(Cc2ccccc2)=O)cccc1)=O,0 V028-2109,Fc(cc1)cc(Cl)c1Oc1ncnc(N2CCN(CCN3CCOCC3)CC2)c1,1 SB27-0005,CCn1nccc1C(N(CC1)CCC1N(C1)C2(COCC2)CNC1=O)=O,1 Z1222610251,CC(C)CN1N=C(C(NCC(CC2)Cc3c2cccc3)=O)c(cccc2)c2C1=O,1 Z1118932111,O=C(c1cn(C2CCNCC2)nn1)Nc(cc1)ccc1Oc1ccccc1,1 Y042-4834,O=C(C(CC1=O)CN1c1ccccc1)Nc1nnc(C2CCC2)s1,0 Z2011162246,CC(CC(O)=O)C(CC1)CCN1C(N(C)C1CCOCC1)=O,0 M039-0403,Cc(n1nc2)cc(C)nc1c2-c(cc1)cc(S(NCc(cc(cc2)OC)c2OC)(=O)=O)c1OC,0 S724-0675,O=C(c1cocc1)N(C1)CC1n1nnc(C(N2CCOCC2)=O)c1,1 Z2971171601,COc1ccc(ccc(N(CCC2)CC2S(C)(=O)=O)n2)c2c1,0 Z1656497940,CN(C)S(CC(N(Cc1c(C2)ccc(Cl)c1)C2c1ccccc1)=O)(=O)=O,0 Z2410314171,Cc1cc(C(NC(CC2)CCN2C(CCN2C)C2=O)=O)cnc1,1 F2776-0012,O=C(NCCCSc(cc1)ccc1Cl)Nc1ncccn1,0 L700-0043,O=C(CCn1c(ccc(-c2noc(C(CC3=O)CN3c3ccccc3)n2)c2)c2nc1)N1CCCC1,1 F5782-0161,Cn(c(C(NCC(CC1)CCC1c1nc(cccc2)c2[nH]1)=O)c1)nc1-c1ccccc1,1 D563-0493,CCOc(cc(C(C1)c(scc2S(c(cc3)ccc3OC)(=O)=O)c2NC1=O)cc1)c1O,0 Z1444088786,OC(c1nccc(C(N(CC2OCCC2)Cc2cccc(F)c2)=O)c1)=O,1 L564-0336,Cc1cccc(NC(c2cc(-c(cn3)cnc3Oc3cc(OC)ccc3)ccc2)=O)c1,0 Z2959763974,CC(C)(c1c(C)onc1C)NC(C(C1CCCCCCC1)O)=O,1 T634-0396,CCN(CC)Cc(cc1)cc(C2)c1OCCN2C(C1(CC1)c1ccccc1)=O,0 8016-3015,Cc(cccc1)c1N(C(c1cccc(C(F)(F)F)c1)Nc1c2cccc1)C2=O,0 F6443-3972,O=C(c1nc(cccc2)c2s1)N(CC1)CCC1(c1c2cccc1)OC2=O,1 Z4066218668,NC(CC1CC1)C(N1CCC(Cc2ccn[nH]2)CC1)=O,1 F6414-1212,OC(CNC(C1CC=CCC1)=O)(CC1)Cc2c1cccc2,1 L500-1221,O=C(C(CC1)CCN1S(c1cc(-c2noc(C3CCC3)n2)cs1)(=O)=O)NC1CCCC1,1 L918-1841,COc(cc1)cc(S(N(CC2)CCC2c2noc(-c(cc3)ccc3Cl)n2)(=O)=O)c1OC,0 8019-0194,CC(C(C(c(cc1)ccc1F)N(CCc1c[nH]c(cc2)c1cc2OC)C1=O)=C1O)=O,0 Z3687019350,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(Cc1n[nH]c2c1CCCC2)=O,0 Z164843604,O=C(C1CC1)NCCNC(c1cccc(Oc2cccc(C(F)(F)F)c2)c1)=O,1 Z1522076823,CC(C(N(CC1)CCN1C(C(CC1)Cc2c1[nH]nc2)=O)=O)Oc1c(C)cc(C)cc1,0 Z1151611015,CC(C)(C(N1CCC(Cc2cccc(F)c2)CC1)=O)OC,0 Z3008617398,CC(C)C(C)(CNS(c1cc(cccc2)c2s1)(=O)=O)O,0 Z2959487960,Cc1cccc2c1cc(C(N(C(CC1)C3)C1CC3c1ccnn1C)=O)o2,1 K906-4910,O=C(c1c2nccc1)N(Cc(s1)ccc1S(N(C1)c(cccc3)c3NC1=O)(=O)=O)C2=O,1 F6559-2366,O=C(c(cc(s1)Cl)c1Cl)NCc1nnc(C2)n1CCC2C(F)(F)F,0 F3411-3350,CCOC(c(cccc1)c1NC(CN(C=Cn(c1c2)nc2-c(cc2)cc3c2OCO3)C1=O)=O)=O,1 F6612-0056,O=C(c(ccc(Cl)c1)c1Cl)N1c2nc(N3CCOCC3)ncc2CCC1,0 Z4784358008,CN(Cc1c[nH]cn1)C(c1cc(cc(cc2)Br)c2[nH]1)=O,1 M754-0776,Cc1nnc(C(CCCC2)N2C(NCCc2ccccc2)=O)[nH]1,1 F0600-2252,Cc1c(C(Nc2nc3c(C)ccc(C)c3s2)=O)n(cccc2)c2n1,0 Z2527348300,Cc1noc(C)c1-c1cn(C2CC2)nn1,1 Y030-7452,O=C(Cc(cc1)ccc1Br)Nc1nnc(C2CCCCC2)s1,0 F5490-1255,CC(c(cc1)ccc1-c1cnc(NC2CCCC2)nc1)=O,0 8015-5226,O=C(CC(C1=O)N(CC2)CCC2c2nc(cccc3)c3[nH]2)N1c1cccc(F)c1,0 P147-0745,CC(CC1)CCN1C(c(cc1)ccc1-n1ncc(CNC(C2CC2)=O)c1)=O,1 Z1574890879,Cc1n[nH]c(-c(cc2)ccc2NC(C(C2=NN3)=CC=CN2C3=O)=O)n1,1 Z1538142590,O=C(NC(CC1)CN1c1ncccc1)NC(CC1)CCC1(F)F,1 F6445-6108,O=C(C1c(cccc2)c2Oc2c1cccc2)N(CC1)Cc2c1ncnc2,1 F6363-0008,Cc1nccn1-c1cc(N(CC2)CCN2C(c2nc(C)nc(-n3nccc3)c2)=O)ncn1,1 F6764-4004,COc(nccc1)c1C(N(CC1)CCC1c1nc2ncccc2cc1)=O,0 Z1762709226,CN(CC(C1)OCCN1C(c(cccc1)c1OC)=O)CC(O)=O,0 V027-8438,O=C(CN(CC1)CCN1c1cc(Oc(cc2)cc(F)c2F)ncn1)N1CCCC1,1 L834-0615,CCN1c(cc(cc2)-c3noc(C4(CC4)c4ccccc4)n3)c2OCC1=O,1 Z3019476796,CC(C)Oc(cc1)ccc1NC(c1c(C2CCNCC2)ocn1)=O,0 Y020-3457,CN(CC1)CCN1c(nc1)nc(C=CN2CCc(cc3)cc(OC)c3OC)c1C2=O,1 Z2649859748,CC(C(N(CC(C1)C2)C12c1ccccc1)=O)n1nnc(-c2ccccc2)n1,1 Z62687800,Cc1noc(C)c1CC(N(CC1)CCC1C(N)=O)=O,0 Z2493803544,CN1C2(CCCCC2)CN(CC(N2)=Nc(cc(c(OC)c3)OC)c3C2=O)CC1,1 SC19-0121,CCn1nc(CN(CC2)CC2NC(c2nn(C)c(C)c2)=O)c2c1CCOC2,0 Z2646026051,CC(C)n1c(NC([C@@H](CCC2)NC2=O)=O)nc2c1cccc2,0 F6413-2492,CCOCC(NCc1ccc(C(c2ccccc2)=O)s1)=O,0 Z2376845839,CC(C)c1nn(C)c2c1cc(C(NCc1ccc(C(O)=O)s1)=O)s2,1 Z1265799618,Cc(cc(cc1)C(NCC2CC2)=O)c1-n1ncnc1,1 Z1422321917,Cc1nc(C(CCC2)CN2C(C(CC(C2)C3)(CC2C2)CC23C(F)(F)F)=O)n[nH]1,1 SC72-0309,O=C(Cc1cscc1)N(C1)CC11OCc2c1cnc(C1CC1)n2,1 Z1974530223,Cc(n(C1CCOCC1)nc1)c1C(N[C@H](C1)[C@@H]1c1cccc(Cl)c1)=O,1 E220-0280,O=C(c1ccc(CN(CC(N2C3CCC2)=O)C3=O)cc1)NCc(cccc1)c1Br,0 S663-0074,COCC(NC(CC1)C1(CC1)CCN1C(COc1ccccc1)=O)=O,0 S632-5011,CS(N(CC1)CCC1C(CC1)CN1C(CN1CCOCC1)=O)(=O)=O,1 Z2783017879,CC(C1)OC(C)C1NC(c1c(C(F)(F)F)n(-c(nccc2)c2Cl)nc1)=O,1 F6676-1263,Cc1nccc(OCC(CC2)CCN2C2=NC=CN(C)C2=O)c1,1 Z1376306876,CC(C(NC(CC1)CCN1S(C1CC1)(=O)=O)=O)OC,0 Z3046577674,NC(c(cc(cc1)NC(C(Cc2ccccc2)C2CC2)=O)c1F)=O,1 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T396-0382,O=C(c1cnccc1)Nc(cc1)cnc1N(CCN1c2ccccc2)C1=O,1 F794-0997,O=C(c1nnc(C(CCC2)N2S(c(cc2)ccc2F)(=O)=O)s1)Nc(ccc(F)c1)c1F,0 SB52-0003,Cc1nc(C(C2)N(C)CC2(CC2)CCN2S(c2cn(C)cn2)(=O)=O)no1,0 F6524-2538,O=C(c1cc(-n2nccc2)ccc1)N(CC1)CC1c1noc(-c2ccco2)n1,1 F6414-2118,CSc1ccc(C(CNC(CSCc2ccccc2)=O)O)cc1,0 Z1822703200,Cc(cc(C)c(NC(c(cc1)nnc1OC)=O)c1)c1C(O)=O,0 Z1437936080,Cc1ccc(cccc2NS(N3CCOCC3)(=O)=O)c2n1,0 Z2295230442,Cn1c(C2N(Cc(cc3)ccc3C(O)=O)CCC2)nnc1,0 F6356-0678,CC(Cc1cocc1)NC(C(C)(C)Oc(cc1)ccc1Cl)=O,0 Z1676362073,O=C(C1CC1)NCc1nc(cccc2)c2n1C1CC1,1 Z908275068,CC(C(NC(C)(C)C)=O)NC(C(CCCC1)N1C(c1cccs1)=O)=O,0 Z3500583100,CC(C)C(c1noc(C2(CCC2)C(N)=O)n1)Oc(cc1)ccc1Br,0 F6510-3040,CN(c(cc(c(F)c1)NC(c(cc2)ccc2-n2cccc2)=O)c1N1C)S1(=O)=O,1 Z1787225484,CCCCOc(cc1)ncc1NC(N(CCC1)CCN1c(nccc1)c1F)=O,0 F0556-0216,COC(c1ccc(COc2cccc3c2CCN(Cc2ccccc2)C3=O)o1)=O,1 Z2908033432,C[C@H](C1)[C@@H]1NC(c1cc(-c2cnccc2)nn1C)=O,1 Z3828992490,CC(C)[C@@H](CO)Nc(nc1)cnc1C(NC)=O,0 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F6473-2177,Cc(cc(CCC(N(C1)CC1n1nncc1)=O)cc1)c1F,1 Z1832823405,O=C(C(C1)c(cccc2)c2C1=O)Nc1nnc2n1CCCC2,1 Z3052004151,OCC(C(N(CCOC1)CC1(F)F)=O)NS(c(cc1)ccc1Cl)(=O)=O,0 Z3542774690,Cc1n[nH]c(CC2)c1CC2C(N(CC1)Cc2c1ccc(C(OC)=O)c2)=O,0 Z4093802331,CON1CCC(CC(NS(c(cc2)cc3c2onc3Cl)(=O)=O)=O)CC1,1 Z1402875981,O=C(CCc1ccccc1)N(CC1)CC1NC(N1CC(CN2CCCC2)CC1)=O,1 Z4105194721,CCn1nc([C@H](C)O[C@H](C)C2)c2c1C(N(CC1)Cc2c1c(O)nn2C)=O,1 F6814-3208,CC1N(Cc2cc(F)cc(F)c2)CCN(CCn2nccn2)C1,1 F6681-8878,Brc(cn1)cnc1OCC(CCC1)CN1c1nncs1,1 F5493-0447,Cc1c(C(N(CCC2)CC2c2nnc(-c(cccc3)c3F)s2)=O)sc(C)n1,1 Z1385466327,O=C(c(ccc(NCc1nnc(C2CC2)o1)c1)c1Cl)N1CCCCC1,1 F6412-2092,COC(c(cc1)ccc1C(NCC#CCOc(cc1)cc2c1OCO2)=O)=O,0 SD07-0462,Cc1noc(C)c1C(N(CC1)CC11OCc2c(CNC(C3CCOCC3)=O)nnn2C1)=O,1 F2145-0249,FC(Oc1cc(-c2noc(C3CNC3)n2)ccc1)(F)F,0 Z2266874733,OC(C1CCC1)C(N(CCC1)CCN1C(c(cc1)ccc1Cl)=O)=O,1 F5033-2302,N#Cc1cccc(C(NCC(CC2)CCN2c2ncccn2)=O)c1,0 F6495-5342,O=C(C(C1)CN1c1ncnc(-n2nccc2)c1)N(CC1)c2c1cccc2,1 Z1426695093,CC(C1CCOCC1)NC(Nc1nnc(C(F)(F)F)s1)=O,1 Z2949913040,CCc1noc(C)c1NC(NCc1c2OCCOc2ccc1)=O,1 Z3307412603,C(c1noc2c1COCC2)NC1CC2(CCC2)C1,1 F6416-6935,OC(CCNC(NC1(CC(C2)C3)CC3CC2C1)=O)c1cscc1,1 K906-4927,O=C(c1c2nccc1)N(Cc(ccc(F)c1)c1S(N1c(cc(cc3)Cl)c3OCC1)(=O)=O)C2=O,1 Y200-1676,Cc(cc1)cc(C)c1-c1csc(NC(C2OCCC2)=O)n1,0 Z1682572868,Cc1c(Cc2noc(-c(cc3)ccc3NS(C)(=O)=O)n2)cccc1,0 Y300-1210,CN(CC1)CCN1c1ccc(CNC(COc(cc2)ccc2F)=O)cc1,0 Z1507121541,Cc(ccc(Cl)c1)c1C(N(C)Cc1cc(O)ccc1)=O,0 F5832-5769,CN(CC1)CCN1C(CNC(c(cc1)ccc1C(OC)=O)=O)c(cc1)ccc1F,0 Z273993528,CCCCCN1N=C(c2nnc3n2CCCC3)c(cccc2)c2C1=O,0 F2743-1496,Cc1nc2ccccc2c(NC(C2=CC=CN(Cc3cccc(Cl)c3)C2=O)=O)c1,1 Z2997607679,CCO[C@@H](COC1)[C@H]1n1nnc(C(N(C)c2cc(C)ncc2)=O)c1,1 Y041-4032,Cc(cc1)cc(O2)c1C(CN(CC1)CCN1C(c1ccccc1)c1ccccc1)=CC2=O,0 Z2217874117,CC(C)(C)c1n[nH]cc1C(N1CCN(Cc(cc2)ccc2F)CCC1)=O,0 Z3362215487,Cc(ccc(CNc1ncc(CN2CCOCC2)cc1)c1)c1O,1 Z2471157220,OC([C@H]1NCCC[C@H]1C(F)(F)F)=O,0 F3398-3659,COc1ccc(CNC(CSc2ncnc(N3CCCCC3)c2)=O)cc1,1 F0630-1746,O=C(c1cc(cccc2)c2o1)N1C(SCc2cnccc2)=NCC1,1 F6609-6561,CC(N(CC1)CCN1c(c1c2)nccn1nc2-c1c(C)cccc1)=O,1 Z2966412345,CC(C)C[C@@H](CN(C)C)NC(c1ccc(-c2n[nH]cc2)s1)=O,0 F0624-0079,CC(C(OCN1N=Nc(cccc2)c2C1=O)=O)Oc1ccccc1,1 Z4099035734,Cc(ccnc1)c1NC(C1C2(CCC2)CC1)=O,1 F6573-2874,O=C(c1cc(Br)cs1)NCCOCCn1nccc1,0 L165-0786,CCCCC(Nc1ccc(C2(CC2)C(NCC2CCCCC2)=O)cc1)=O,1 F6513-5352,CN(C)S(N(CC1)CCN1C(c1c(CCCC2)n2nc1)=O)(=O)=O,1 SC46-0518,CC(C)c1n[nH]c(C(C2)C3(CCCC3)CN2S(N(C)C)(=O)=O)n1,0 Z1227834695,Cc(cc1)nc(C)c1C(N(CCC1)C1c1cnccc1)=O,0 L865-0040,O=C(C(CC1)CCN1c1nc(N=CNC2=O)c2s1)Nc(cc1)cc2c1OCCO2,1 Z963585070,Cc1cc(CNC(N2C(CCC(O)=O)CCCC2)=O)no1,1 F2879-3997,O=C(C(NCc(cccc1)c1Cl)=O)NCCC1=CCCCC1,0 F6724-4549,CC(CNc1ncnc2cnccc12)(c1cc(cccc2)c2s1)O,1 S699-0376,CN(CCc1noc(C(C2)CN2C(CCC2CCCC2)=O)n1)C(C1CC1)=O,1 G366-0494,CCC(N(C(C1)C(NCCN2CCOCC2)=O)c2c1cccc2)=O,1 Z1513514997,Clc([nH]1)cc2c1ncnc2N1CC(Cn2ncnc2)CCC1,1 F2296-0609,CC(C)CCN(c(ccc(NS(c(cc1)cc2c1OCCO2)(=O)=O)c1)c1OCC1(C)C)C1=O,1 S715-3072,Cn1c(-c2noc(C(CC3)CN3C(CC3CCCC3)=O)n2)ccc1,1 Z2335450923,COc1cccc([C@@H]2[C@@H](CNC(c3cc(NC(C4CC4)=O)ncc3)=O)C2)c1,1 Z1435243391,O=C(c1nn(C2CCCC2)cc1)NC1CCN(Cc2cnccc2)CC1,1 Z927544720,O=C(CNC(c1n[nH]c(-c2ccccc2)c1)=O)NCc1ccncc1,0 SC72-0137,Cc1nc(COC2(C3)CN3C(c3cc(-c(cc4)ccc4OC)n[nH]3)=O)c2cn1,0 F6188-0635,O=C(c1cc(C(F)(F)F)ccc1)NCC1(CCOCC1)Sc1ccccc1,0 Z1272200450,[O-][N+](c1cc(N(CC2)CCN2C(N2)=Nc(n(-c3ccccc3)nc3)c3C2=O)ccc1)=O,1 Z1360223620,CC(C(CC1)c2ccccc2)N1C(c(o1)ccc1S(C)(=O)=O)=O,0 F6201-0289,Cc1cc(CNS(Cc(cccc2)c2Cl)(=O)=O)c(C)o1,0 P511-1734,O=C(CN(C=C(C=C1)S(N2CCOCC2)(=O)=O)C1=O)N(CCC1)c2c1cccc2,1 Z1094883400,O=C(CCN(C=Nc1c2cccc1)C2=O)Nc1ccnc2ccnn12,1 SD25-0197,O=C(CCC(CN(C1)C(CCN(c(cccc2)c2O2)C2=O)=O)C11CCCCC1)NC1CC1,1 Z2066140279,Cc1csc2ncnc(NCc3nc(C(F)(F)F)n[nH]3)c12,1 Z1554809835,CS(c1cc(C(N2CC(Cc3ccccc3)CC2)=O)cs1)(=O)=O,1 Y503-4538,CCn1nc(C)c(-c2cc(C(F)(F)F)c(c(C3CC3)nn3C)c3n2)c1,0 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Z1559757700,CC(C1(CCCC1)N1CCOCC1)NC(c1cn(-c(cc2)c(C)cc2F)nn1)=O,1 8013-5875,COc1cccc(C(C(C2C(N3c(cc4)ccc4Cl)=O)C3=O)NC2(Cc2c[nH]cn2)C(O)=O)c1O,1 F2167-9488,CC(c(ccc(N1CCOCC1)c1)c1Br)=O,1 SA23-1241,Cc1c(C(N(C2)CC2N(C2)[C@H](CN(C)C)CC2(F)F)=O)ocn1,0 F6445-1122,O=C(C(C1)CN1c1nccs1)N1CCOCC1,1 Z509415712,Cc1c(CC(NCC2(CC2)c(cc2)ccc2F)=O)c(C)nn1-c1nc(C)cc(C)n1,0 Z3077806642,CCc1cc2c(N(CC3)CCC3(c3nccn3C)O)ncnc2s1,1 L470-0024,Cc(cc1)ccc1N(CC(C1)C(NCc(s2)ccc2S(N2CCCC2)(=O)=O)=O)C1=O,0 Z1693173142,CC(C)(c(cc1)cc(F)c1F)NS(c1ccnn1C)(=O)=O,0 C200-0580,CCOc(cc1)ccc1N(C(c1c(N2CC(c(cc3)ccc3Cl)=O)sc(C)c1C)=O)C2=O,1 Z1455296804,Cn1ncc(CC(N[C@@H](Cc2ccccc2)C(O)=O)=O)c1,1 Z113829110,CC(c1c[nH]c(C(OCC(c(cc2C)c(C)n2C(C2=O)=C(C)N(C)N2c2ccccc2)=O)=O)c1)=O,0 Z1360563477,O=C(c(cccc1)c1NCc1cnccc1)N(CCC1)CC1c1nnc2n1CCC2,1 V029-8626,CCN(C(CN1C(C)(C)C(NCc2ncccc2)=O)=C(C(c2ccc(C)cc2)N2)C1=O)C2=O,1 F6359-0801,O=C(c(cc1)ccc1-n1cccc1)N(CC1)CCC1Oc(nccc1)c1Cl,1 Z2439805359,O=C(c1cnc(-c(cc2)cc3c2OCO3)s1)NC1CCNCC1,1 P297-4611,Cc1ccc(CNC(N(CC2)CC2n2c3ncccc3nc2-c2cocc2)=O)cc1,1 Z1182457391,CC(N(CCC1)CCN1C(CC(CC1)Cc2c1cccc2)=O)=O,1 Z2964425893,O=C(C1(CC2)CC2CC1)NC(CCC1)CN1C(C1(CC2)CC2CC1)=O,1 Z4766582514,Cc1nccn1-c(ccc(NC(c1c(C)c(F)ccc1)=O)c1)c1F,1 Z1930422408,CC(C(N(C)C)=O)S(N(C1)CN(C2CC2)C1=O)(=O)=O,0 D494-0274,CC(C)c1nc2nc(-c3cnccc3)nn2c(N2C(C)CCCC2)c1,1 E750-0870,COc1cccc(N(C(C(CC(Nc2cc(OC)cc(OC)c2)=O)N2Cc3ccco3)=O)C2=O)c1,0 Z1603609279,OC(C(c(cc1)ccc1Cl)NC(CCC(c1ccccc1)=O)=O)=O,0 Z89217778,CN(CC(Nc(cc1)cc2c1OCCCO2)=O)Cc(cc1)cc2c1OCO2,1 S903-0337,Cc1c(COC)c(C(N2Cc3nnc(C(CC4)CCN4C(N(C)C)=O)n3CC2)=O)no1,0 SB18-0927,CS(N[C@@H](C1)CN(Cc(cc2)cc(F)c2F)[C@@H]1c1nc(-c2ccccc2)n[nH]1)(=O)=O,1 K292-1038,Cc(cc1)c(C)cc1N(C1=O)C(SCC(Nc2c(C(F)(F)F)cccc2)=O)=Nc2c1scc2,1 F6667-1147,O=C(C1COCC1)Nc1cccc(Br)c1F,0 SB04-0275,Cc1ccc(C(N(C)CCN(C(CC2)CN2C(C2CC2)=O)C2CCOCC2)=O)s1,1 F6724-2754,Brc1cnc(NCCCn2c(-c3ccccc3)ncc2)nc1,1 F2773-0474,O=C(CN(C(C=C1)=O)N=C1c1ccco1)N(CC1)CCN1c1ncccn1,1 Z1626109456,Cc1noc(-c2cccc(NC(NCCN(C)C)=O)c2)n1,0 Z2066033121,Cn1ncc(CC(CNS(c2cscc2)(=O)=O)C(O)=O)c1,1 Z2159753184,CC(C)(c1nc(-c2cncs2)no1)Oc(cc1)ccc1Cl,1 F6057-0140,COc(ccc(CC(N1CCN(CCn2nccc2)CC1)=O)c1)c1OC,0 Z2126906302,O=C(NCc1c(cccc2)n2nc1)N1CCOC2(CCOCC2)CC1,1 Z2905244849,CC(C(CC1)C(NCC2CCCC2)=O)c2c1[nH]nc2,0 F3244-0054,CC(Cc(cc1)c2cc1Br)(C(N(CCC1)c3c1cccc3)=O)OC2=O,1 Z1679197283,Cc1n[nH]c(C(CC2)CCN2C(c2cc(cc(c(OC)c3)OC)c3[nH]2)=O)c1,0 SB18-0295,Cc1n[nH]c([C@H](C2)N(Cc3cscc3)C[C@H]2NC(C2CCOCC2)=O)n1,1 F5003-0038,Cn(cc1-c(n2C)nnc2SCC(Nc(ccc(F)c2)c2F)=O)nc1OC,1 M867-0063,O=C(CN(c1csnc1C(N1Cc2ccccc2)=O)C1=O)NCC1OCCC1,1 F6483-0362,Cc1c(C(NC(CC2)CCC2Oc2ncccc2)=O)c(C)n[nH]1,1 Z2278653753,Cc1c(CN(C[C@@H]2O)C[C@@H]2OC)nc(-c2cscc2)o1,1 Z4444622097,CNC(OC(CC1)CCN1C(c1ccncc1)=O)=O,0 F417-0615,CC(C)c1nnc2n1-c(cccc1)c1N(CC(Nc(cc1)cc(C(F)(F)F)c1Cl)=O)C2=O,0 Z1454160298,O=C(c([nH]c(cc1)c2cc1Cl)c2Cl)N1CC2(CCOCC2)OCC1,1 Z3992152112,OCC(Cc1cc(F)ccc1)NC(c1c(cccc2)c2ns1)=O,0 L697-1142,COc1ccc(C2(CC2)c2nc(Cn3cnc(S(N4CCOCC4)(=O)=O)c3)no2)cc1,1 F2463-0523,COc(cc1)cc(C(Nc(cccc2)c2S(C)(=O)=O)=O)c1OC,0 Y040-8480,C=1\2/c3c(OC(\C1\CCC2)=O)cc(cc3OCC(N[C@H](C(=O)NCCC(=O)O)C(C)C)=O)C,0 Z608648046,NCc(cc1)ccc1C(N(CCC1)C1c(cc1)cc(Cl)c1Cl)=O,0 Z2185142635,O=C(NCc1noc2c1CCCC2)N1[C@H](CN2CCOCC2)CCC1,1 Z4089507265,CCOc(nccc1)c1S(NC(c1c(C)ccc(C#N)c1)=O)(=O)=O,0 Z2944415980,CC[C@@H](CC(O)=O)NC(c1cc(C)co1)=O,0 F6561-2218,Cc(ccc(S(N(C1)CC1OCC1COCC1)(=O)=O)c1)c1Cl,0 S727-1055,Cc1c(C(N(C2)CC2n2nnc(COCC3CC3)c2)=O)sc(C)n1,1 F6619-4268,Cc1cc(N(CC2)CCN2c2nc(C)cc(N3CCOCC3)n2)nc(C2CC2)n1,1 G786-0752,O=C(Nc(cccc1)c1Cl)N(Cc1nnc2n1CCCCC2)c(cc1)ccc1F,0 F5882-0001,CC(C)(C)OC(N1CCN(CCNC(c2cc(C#N)ccc2)=O)CC1)=O,0 Z3063544929,CC(c1c(C)[nH]c(C(N2C(CO)CCC3(CCCC3)C2)=O)c1C)=O,1 Z2182189842,OC1c(cccc2)c2OCC1NC(NC1CC(CCCC2)C2CC1)=O,1 F6230-0127,O=C(c(c(F)ccc1)c1Cl)NCc1c(cccc2)n2nc1,0 F3348-0608,Cc(cc(N1CCCC1)n1nc2C(F)(F)F)nc1c2-c1ccccc1,0 S649-0328,O=C(COc1ccccc1)N(CC1)CCC1N(C1)C2(CCCCC2)C1OCC1CC1,1 Z2993050346,O=C(C1CC2(CCCC2)OCC1)Nc1ccnc2ccccc12,0 Y503-1397,CCn1nc(C)c(S(N(CC2)CCN2S(c2cn(CC)nc2C)(=O)=O)(=O)=O)c1,0 SD56-0352,Cc1ccc(CN(CCC2)CC(C(N3c4ccccc4)=O)N2C3=O)s1,1 F6670-5131,Cc1cc(N2CCC(CN(C=Nc3c4ccc(F)c3)C4=O)CC2)nc(C2CC2)n1,1 Z1769677348,CC(C1=NC=C2C(NOCc(ccc(F)c3)c3Br)=O)=CC=CN1C2=O,1 SD08-0415,O=C(C1CC1)NCc1c(COC(CCC2)(C3)CN2C(c2ncccn2)=O)n3nn1,1 F6753-1012,O=C(C(C1)OCCN1c1ncnc(C2CCC2)c1)N1CCOCC1,1 F2145-0369,C1Oc(cc(cc2)C3=NN=C(N4CCNCC4)SC3)c2O1,1 Z3827524875,CC(Cc1c(C2)cccc1)N2S(c1c(C(NC[C@@H]2NCCCC2)=O)scc1)(=O)=O,0 F5854-1114,O=C(Nc(cccc1)c1Cl)N(Cc1cscc1)Cc1ncccc1,0 F5835-0558,O=C(CN(C(c1c2cccc1)=O)C2=O)N(CC(C1)CN23)CC1C3=CC=CC2=O,1 F5323-0050,Cn1nc(CCC2)c2c1NC(COc(ccc(Cl)c1)c1Cl)=O,0 SC91-0525,O=C([C@](C[C@H]1CC2)(CN1C2=O)c(cccc1)c1Cl)NCCc1nc(cc(cc2)F)c2[nH]1,0 V016-3834,O=C(Cc(cc1)ccc1N(Cc1ccccc1)C(C1CCCC1)=O)NCC1OCCC1,0 F5857-1739,Cc1c(C(CNS(c(cc(C)c(C)c2)c2OC)(=O)=O)O)scc1,0 F6562-9428,O=C(COc(ccc(Cl)c1)c1Cl)NCc1nccnc1-c1ccco1,1 S724-0251,CN(C)C(c1cn(C(C2)CN2C(Nc(cc2)cc3c2OCCO3)=O)nn1)=O,1 F6806-6811,N#Cc(cc1)ccc1N1CC(C(N(CC2)CCC2(F)F)=O)OCC1,1 F2157-1750,CCOC(c1cn(Cc2ccc(C(F)(F)F)cc2)nn1)=O,0 F6619-6936,Cc1cc(C)nn1-c1cc(N(CC2)CCN2c2nccn3c2nnc3C)nc(C)n1,1 G589-0103,Cn(cc1)c(cc2)c1cc2S(N(CC1)CCN1C(Nc(cc(cc1)OC)c1OC)=O)(=O)=O,0 F6064-3122,O=C(CN(C=Nc1c2cccc1)C2=O)N(C1)CC1c1nc(-c2cccc(C(F)(F)F)c2)no1,1 F6435-9133,CC(C)(Cc1ccc2)Oc1c2OCC(N(CC1)CC1SCC(OC)=O)=O,1 Z1958284646,CCc1nc(NCc2ncccc2NC)c(ccs2)c2n1,0 F6471-2671,Cc1c(cc(cc2)C(N3C4C=CCC3CC4)=O)c2ncc1,1 F6276-1066,O=C(C1CCCC1)N(C1)CC1Oc1nc(c(C(F)(F)F)ccc2)c2s1,1 8017-6272,CN(CC(C1)C(Nc2cc(C(c3ccccc3)=O)ccc2)=O)C1=O,1 Z1076994682,C[C@H](CO)NCc1csc(-c2cccc(Br)c2)n1,0 F6660-4421,CC(C)(C)OC(N(CCC1)CC1(C(N1Cc(cc2)ccc2Cl)=O)NC1=O)=O,1 F6439-5337,O=C(NCCn(cc1)nc1-c1cccs1)NC1(CC(C2)C3)CC3CC2C1,1 Y030-7921,CCC(CC)C(Nc1nnc(C(C)(C)C)s1)=O,0 F6672-1426,C=C(CC1CC2)CC2N1C(CCc1nc(-c2ccccc2)no1)=O,1 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S904-1293,CC(C)C(N1Cc2nnc([C@H](C[C@@H](C3)O)N3C(CCC3CCCC3)=O)n2CC1)=O,1 F6104-0217,Cc1cc(C(NCC(Cc2cccc(F)c2)N(CCN2)C2=O)=O)c(C)o1,1 C481-1374,O=C(C(c1ccccc1)NS(c1cccc2nsnc12)(=O)=O)N(CC1)CCN1C(c1ccco1)=O,1 V019-1330,CC(C)Cc1nc(n(-c2ccccc2)nc2)c2c(N2CCN(Cc3cc(C)ccc3)CCC2)n1,0 SD48-0322,CC(C)n1nc(CCC(N(CCc2ccncc2)CC2OCCC2)=O)c2c1CCOC2,1 Z2568440740,CCC(CC1)CCN1S(N(CC1)c(cc2)c1cc2C(O)=O)(=O)=O,1 F6805-3728,CC(N1CC2CCN(Cc3nnc(C4COCC4)o3)CC2)=Nc(cccc2)c2C1=O,1 P799-0362,Cc1noc(C)c1CN(C(N(c1cc(SC)ccc1)c1c2cccn1)=O)S2(=O)=O,0 Z1837719596,CC(C)(C)[C@@H](C(O)=O)NC(c1cncn1C)=O,0 G397-1673,CN(CCCNC(C(CC1)CCN1c1nnc(N(CCCC2)C2=O)s1)=O)C1CCCCC1,1 V020-4739,O=C(C(C1CCCC1)N(CC1)CCN1C(C1CCCC1)=O)NCCN1CCCCC1,1 Z1146825071,N#Cc(ccc(S(NC(Cc(cc1)ccc1Cl)=O)(=O)=O)c1)c1Cl,0 SC66-0356,O=C(c1cocc1)N(C1)CC2(CCOCC2)C1c1nncn1C1CC1,1 F6154-0218,O=C(c1coc(NC(c2ccccc2)=O)n1)NCC(F)(F)F,1 Z1308270884,NC(COc1cccc(CNC(N2CC(Cc(cc3)ccc3F)CC2)=O)c1)=O,0 Z2437195981,O=C(C(C1)C11CCNCC1)NCc1cc(N2CCCCCC2)ncc1,1 F6567-1941,CN(C(C=C(N1)N2CC(CN(Cc3ccccc3)C3)C3C2)=O)C1=O,1 Z3255879445,COC(c1c(COCC2)n2c(CNC(CCc(cc2)ccc2F)C(O)=O)c1)=O,0 Z1891007202,Cc1cc(-c2noc(C(CC3)CNC3=O)n2)cc(C)c1Br,1 T990-3581,CC(C)CCN(CCC1N(CC2)CCN2S(c2c(C)ccc(F)c2)(=O)=O)C1=O,0 SA96-1259,CC(C)CNC(C1C(C2)(CN2C(c2cccn2C)=O)CN(Cc2ccccc2)C1)=O,1 Z2000001796,CN1CCC(CCNC(N(CC2)CC2S(C)(=O)=O)=O)CC1,1 F6279-0082,O=S(Cc1ccc(C(F)(F)F)cc1)(NCCc1csc(-c(cc2)ccc2F)n1)=O,1 Z4685004178,O=C(C(Cc1ccc(C(F)F)cc1)NC1=O)N1c1cc(F)cnc1,0 F5092-0182,Cc1nc(-c2cccs2)c(CCC(N(CC2)Cc(cc3OC)c2cc3OC)=O)s1,1 F6668-2870,Brc(cn1)cnc1OCC1CCN(Cc2nc(CCC3)c3s2)CC1,1 Z2795225884,OC(C(C1CC1)N(CC1)CCN1C(COc(cc1)ccc1F)=O)=O,0 F6111-0500,COc1cc(COCC(CC2)CCN2C(c2noc(C3CC3)c2)=O)cc(OC)c1,1 F6454-2375,Cc1nccc(N2CCC(CNS(Cc3cccc(Cl)c3)(=O)=O)CC2)c1,1 Z1702338426,OCC1N(Cc2c(CNC(Cn3c(cccc4)c4nc3)=O)cccc2)CCC1,1 Z4927220678,Nc1cncc(C(N(CC2)CCC2(CN(C2)C(C(C3)C33CCC3)=O)Oc3c2cccc3)=O)n1,1 S831-3505,COC[C@@H](CN(C1)C(CCC2CCCC2)=O)[C@H]1c1ncccc1,1 F6215-0323,Cc1noc(CCNC(Nc2c(C)cccc2)=O)c1,0 F5594-0175,CC(C)(C)c1csc(CN2CCN(CC(Nc(cc3)ccc3OC(F)(F)F)=O)CC2)n1,0 F6574-1950,O=C(NCc1cccc2ccccc12)NCc1nccnc1-c1cccs1,1 Z4166486236,CC(CC1)(CC1(F)F)NC(c1c(CC(C2)(F)F)n2nc1)=O,1 Z2949583272,Cc(nc(cc1)OC)c1NC(N[C@@H]([C@H](CC1)O)c2c1cccc2)=O,0 F6597-2645,CN(C(C=C(N1)N2CCC(COc3cccc(C(F)(F)F)n3)CC2)=O)C1=O,1 Z4561576853,[O-]C([C@](C1)(C[C@@H]1O)NC(Cc1cscc1)=O)=O,0 S615-0326,O=C(NC1CCCCC1)N(CC1)CC1c1nc(CCOCC2CC2)no1,1 SC54-0422,CCCNC(N(C[C@H]1CN(CC2)C(c3c(C)onc3C)=O)C[C@]12c1nnc(C)o1)=O,1 F2740-0431,Cc1csc(NC(Nc2cn(C)c3c2cccc3)=O)n1,1 Z2273971235,CCOc(cc(c(N(CC(C)N1)CC1=O)ccn1)c1c1)c1OCC,1 Z1343573411,Cn1ncc(N(CCC2C(O)=O)C2=O)c1,0 Y300-1091,CC(c(cc1)ccc1N1CCC(C)CC1)NC(C(CC1)CCN1S(N(C)C)(=O)=O)=O,1 F6186-0188,CC(CNC(COc(ccc(Cl)c1)c1Cl)=O)(CSC)O,0 F6479-4600,CCn1nc(C)c(S(N(CC2)CCC2Oc2nc(C)nc(C)c2)(=O)=O)c1C,1 F6813-8022,CSc1nc(N2CCN(Cc(ccnc3)c3F)CC2)ccn1,0 Z4607590189,Cc(cc(CCN(C1)C(c2coc(S(N(C)C)(=O)=O)c2)=O)c1c1)c1Br,0 F2749-0128,CC(C1)N(C(CCN(C(c2c3cccc2)=O)S3(=O)=O)=O)c2c1cccc2,1 F6212-0375,Cc1c(C)sc(NC(c2c3OCCCn3nc2)=O)n1,1 Z646029678,COc1ccnc(N(CC2)CCC2Oc(ccc(F)c2)c2F)n1,0 E852-1073,CC(C)CCNC(C(C)(Cn(c1c2)nc2C(NCCCN2CCN(C)CC2)=O)N(C)C1=O)=O,1 Y031-2861,O=C(C(CC1=O)CN1c(cc1)ccc1F)Nc(ccc(Cl)c1)c1C(c1ccccc1)=O,1 CM3123-0416,O=C(CCCc1c[nH]c2c1cccc2)NC(CC1)CN1C(C=C1)=NNC1=O,1 F6212-0342,O=C(c1c2OCCCn2nc1)Nc(cc1)cc(C2)c1-c1c2cccc1,1 SB95-1364,Cc1cc(NC(N(CCC2)CC2N(CCN2CCOCC2)S(C)(=O)=O)=O)c(C)cc1,1 F6734-1203,O=S(c(cccc1)c1F)(N1CC(CN(C2)c(cc3)ncc3Br)C2C1)=O,0 F5581-3151,O=C(CN(c(cccc1)c1O1)C1=O)N(CCn1nccc1)c1nc(c(C(F)(F)F)ccc2)c2s1,1 Z1452419285,CCOc(cc(CNC(NC1C2C(CC3)CC3C12)=O)cc1)c1OC,1 F6512-1882,O=C(c1cnc(C(F)(F)F)cc1)NCc1nc(C2CCCCC2)cs1,1 Z2607624947,CC(c1nc(Cc2ccccc2)no1)NC(C1(CCC1)C(O)=O)=O,1 F6356-0168,CS(N(CC1)CCC1C(NCCc1cocc1)=O)(=O)=O,1 Z4909205687,CCCC(N1CC(Cc2cn(-c3ccc(C(F)(F)F)cc3)nn2)C1)=O,1 G243-0486,Cc1c(C(N2CCCCC2)=O)c(S(N(CC2)CCN2C2CCCCC2)(=O)=O)c(C)n1C,0 F6726-0626,Cc1cc(C)nn1-c1cc(OCC(CC2)CCN2c2c(C#N)nccc2)ncn1,1 F5854-4076,O=C(COc1ccccc1)N(Cc1cscc1)C1CC1,1 F6619-4330,Cc1nc(N(CC2)CCN2c(nccc2)c2S(C)(=O)=O)nc(N2CCOCC2)c1,0 F5831-8641,COc(cccc1)c1N1CCN(CCNS(c2cnccc2)(=O)=O)CC1,1 F2974-0691,CS(c1c2nc(N(CC3)CCN3C(c3cc(cccc4)c4o3)=O)sc2ccc1)(=O)=O,1 F6753-2095,Cc(cc1)c2sc(N(CC3)CCC3C(N(CC3)CCC3(F)F)=O)nc2c1OC,0 SA42-0306,CC(C)c1nc(C2N(C)CC(C3)(CN3C(c3ccccc3)=O)C2)no1,1 F6239-0158,CSc(cccc1)c1NC(c(cc1)nnc1-n1nccc1)=O,0 S453-0054,COc(cc1)ccc1NC(CN(C(C1(CCOCC1)N1)=O)C1=O)=O,0 C206-0161,CC(C)Cc(cc1)ccc1S(N(C(C)CC1)c2c1ccc(F)c2)(=O)=O,0 Z4472938751,O=C(c1coc(Oc2ccccc2)n1)N(CCCC1)C1C1CCOCC1,1 Z2370683506,CN(C)C(C(CC1)CN1S(c1c2OCCc2ccc1)(=O)=O)=O,0 F6215-0007,Cc1noc(CCNC(c2csc(-c3ccccc3)n2)=O)c1,1 Z4368060242,CC(C(NS(C)(=O)=O)=O)c(cc1)cc2c1[nH]cc2,0 SA49-0424,O=C(CC1COC(C2)(CN2S(c(ccc(F)c2)c2F)(=O)=O)C1)N1CCOCC1,1 Z2956269344,CCc(ccc(Br)c1)c1C(N(C[C@@H](C1)O)C[C@H]1O)=O,0 Z2012322218,Cc1c(C(N(CCC2)CC2c2ccnn2C)=O)sc(NC(c2cc(F)ccc2)=O)c1,1 Z1069623150,Cc1c(C(N2CC(c(cc3)cc(Cl)c3F)OCC2)=O)nco1,0 Z1414658669,CCCCC(Nc(cccc1)c1-n1nc(C)cc1)=O,0 F6521-7972,COC(CNC(c1cnc(C(F)(F)F)cc1)=O)c(s1)ccc1Cl,0 Z2916366076,O=C(C(C=C1Br)=CNC1=O)N1[C@@H](C2)CN(Cc3ccccc3)[C@@H]2C1,1 F6156-0377,O=C(COc(ccc(Cl)c1)c1Cl)N1CC(COc(cc2)cc3c2OCO3)C1,1 V007-5495,Cc(cc1)ccc1NC(N(CCn1c2ccc1)C2c1cc(Oc2ccccc2)ccc1)=O,1 Z4463284869,COc1ccc(C(CC2)CN2C(c2cc(scc3)c3n2CC2CC2)=O)cc1,1 Y043-5194,CC(C)C(c1nc(cccc2)c2n1C(C)C)NC(CC(C(Nc1c2cccc1)=O)NC2=O)=O,0 L470-0472,O=C(C(CC1=O)CN1c1cccc(Cl)c1)NCc(s1)ccc1S(N1CCOCC1)(=O)=O,0 G585-0698,CCn(cc1)c(cc2)c1cc2S(N(CC1)CCC1C(NCC1OCCC1)=O)(=O)=O,1 F5777-0165,CCNC(Nc(cccc1)c1NC(c1c(C)cccc1)=O)=O,0 F6679-2671,O=C(c1ccc(Cn2cncc2)cc1)N(CC1)CC1Oc(ccnc1)c1Br,1 SB27-0040,COc(cc1)cc(S(N(CC2)CCC2N(C2)C3(COCC3)CNC2=O)(=O)=O)c1OC,0 E717-0276,CCCn1c(C(N(CC(N(CCCN2CCOCC2)Cc2ccco2)=O)N=C2)=O)c2c2c1cccc2,1 Z1460612076,CN(CCN(C1)C(NCc2c3OCCCOc3ccc2)=O)c2c1cccc2,1 Z2444671677,COc(cc1)ccc1-c(c(CN1CCNCC1)c1)nn1-c1ccccc1,1 P657-0866,O=S(c1ccc(-c2nnc(C3CCC3)o2)o1)(N1CCCC1)=O,1 Z1567640525,Cn1nccc1C1CCN(Cc(cccc2)c2OCC(N2CCCC2)=O)CC1,1 SD67-0175,CC(C)CN(CC(N(CCC1)C2CN1C(COc(cc1)ccc1OC)=O)=O)C2=O,0 F6471-2253,O=C(CSC1CCCC1)N(C(CC1)C2)C1c1c2ncnc1,1 Z250-0021,Cc1cc(N(CC2)CCN2C(NC2=O)=Nc3c2scc3-c2ccccc2)c(C)cc1,0 F6448-1290,O=C(c1noc(C2CC2)c1)Nc1cn(CC2CCOCC2)nc1,1 F2783-0987,O=C(C(Nc1cc(N(CCC2)C2=O)ccc1)=O)NCc(cc1)ccc1F,1 F5010-0114,CN(C)S(c(cc1)ccc1C(N(CC1)CCN1c(cc1)nnc1OC)=O)(=O)=O,0 F6416-8924,Cc1cc(C(CCNC(NCc2cccc3ccccc23)=O)O)c(C)o1,1 Y200-6927,O=C(CCC1CCCCC1)NC(CC1)CCC1NC(CCC1CCCCC1)=O,1 F6604-0612,CN(C(C1)CN1c(cc1)nn2c1nnc2)c1nccc(OC)n1,0 F5118-0580,CCn1nccc1C(Nc(cccc1)c1S(C)(=O)=O)=O,0 F2982-0207,O=C(CS(Cc1ccccc1)(=O)=O)N(CC1)CCN1c1ccccc1,1 F6279-0291,O=C(c(cc1)ccc1OC(F)(F)F)N(Cc1ccco1)Cc1ncccc1,0 Z1647802253,Cn(cc1NC(c2ccc(-c3cccs3)o2)=O)nc1-c1ncccc1,1 Z1700479861,Cc(cc1)nc(C)c1NC(N1CC(c2cccc(Cl)c2)OCC1)=O,1 F6609-1359,O=C(c1ccco1)N1CCN(Cc2nc(-c(cc3)ccc3OCc3ccccc3)no2)CC1,1 S736-0418,COC(C1)C(CC2)(CCN2S(c2cc(CCC3)c3cc2)(=O)=O)N1c1cc(F)ccc1,1 F848-0417,CN(C)S(c(cc1)cc2c1n(CCCC(NCC1OCCC1)=O)nn2)(=O)=O,1 Y070-1116,O=C(CC1N(C(c2ccco2)=O)c(cccc2)c2NC1=O)Nc1cccc(Cl)c1,0 Z3104734356,CC(c1nnnn1C)NC(NCc1cc(C(F)(F)F)ncc1)=O,0 Z2143826022,COc(cccc1)c1N(CCO)S(c1cn(-c2ccccc2)nc1)(=O)=O,0 F5834-3778,CCCS(N(CC1)Cc2c1ccc(NC(c(cccn1)c1SC)=O)c2)(=O)=O,1 F6437-0100,Cc1nsc(C(NCc(cccc2)c2Cl)=O)n1,0 F5029-0012,O=C(CN(C(C1CC1)=Nc1c2cnn1-c1ccccc1)C2=O)N1CCOCC1,1 G428-0520,O=C(CS(c(cc1)cc2c1NC=NS2(=O)=O)(=O)=O)N1CCCCCC1,1 Z1529696579,COc(cc(cc1)C(NC(CC2)CN2c2ncccc2)=O)c1Cl,0 F6111-0581,Cc1csc(NC(CN2CCC(COCc3cc(OC)cc(OC)c3)CC2)=O)n1,1 Z3138075670,Cn1nccc1C(CCC1)CN1C(NC[C@@H](C1)[C@H]1c1ccccc1)=O,1 F6752-7978,O=C(C(C1)CN1c1nc(ccc(Br)c2)c2s1)N1CCOCC1,0 S544-0611,Cc1c(C(N2CC(CCOc3ccncc3)CC2)=O)scc1,1 F6678-8376,Cc1cc(C(N(C2)CC2n2c(cccc3)c3nc2C)=O)c(C)o1,1 Z1333157339,Cc(cccc1)c1C(NC(CC1)CCN1c(nc1)ncc1Cl)=O,0 D076-0213,O=C(COc(cc1)ccc1Br)N(Cc(cccc1)c1F)C(CC1)CS1(=O)=O,0 Z3727448979,CC(Nc(cc(c(S(N(C1CC1)C(C1)CC1c1c(C)cccc1)(=O)=O)c1)OC)c1Cl)=O,1 Z3290580256,CC(C)c1nc(C)c(C(NCCN(C)Cc(cc2)ccc2OC)=O)o1,1 F5686-0861,O=C(CSc1ncnc(N(CC2)CCN2c(cccc2)c2F)c1)NCc1cccs1,1 F6416-9170,OC(CCNC(c1cnc(C(F)(F)F)cc1)=O)c1cccc(Cl)c1,0 S738-0607,Cc1cnc(C(C2)CN2S(c(cc(cc2)OC)c2OC)(=O)=O)n1Cc1cnccc1,1 Z2455673974,CC(C(CC1)CCN1C(Cc(cc1)cc2c1OCCC2)=O)O,1 Z2852747969,CC(CCN(C1)C(NCc2cnccc2)=O)C1c1ccccc1,0 Z2295936083,CCc1noc(C)c1C(Nc(cc1)ccc1C(NC(C)C(O)=O)=O)=O,0 L860-0258,O=C(CSc1nnc(cc2)n1cc2C(Nc1cc(F)ccc1)=O)Nc(cc1)cc2c1OCCO2,1 Z3045882400,C=CCN(Cc1cccs1)C(C(CCC1=NN2)CN1C2=O)=O,1 F6184-1278,O=C(c(cc1)ccc1OC(F)(F)F)N(CC1)CCC1c1cscc1,0 F6557-1926,CC1Oc(cccc2)c2OC1C(N(CCC1c(cccc2)c2Cl)CCS1(=O)=O)=O,1 F6031-0713,OC(CN(CC1)CCN1C(C1CC=CCC1)=O)c1ccco1,1 Y031-0020,CCC(CC)C(Nc1cccc(C(Nc2nnc(C3CCCCC3)s2)=O)c1)=O,0 Z1528049509,O=C(c1c(-n2cccc2)sc2c1CCC2)N(C1)CC1n1ncnc1,1 F6471-7914,O=S(c(cccc1)c1Cl)(N(CC1)Cc2c1onc2)=O,0 Z318797444,CCOC(c(cc1)cnc1N(CC1)CCN1C(C1CC1)=O)=O,0 D724-0525,Cc1nn2c(N3CCCC3)c(CCCC3)c3nc2c1-c1ccccc1,1 Z423928830,Cc1cc([nH]c(C(N(CC2)Cc3c2n(-c2ccccc2)nc3)=O)c2)c2cc1,0 S824-3378,Cn1cnc(S(N(C[C@@H]2COC)C[C@@H]2c2ccncc2)(=O)=O)c1,1 Z2991036021,O=C(CCC1CCNCC1)NS(c1cccc2ncccc12)(=O)=O,1 Z434359616,O=C(C1(CCCC1)c1ccccc1)NCCN(CC1)CCS1(=O)=O,0 F3371-0901,Cc1ccc(C(C2)N(C(c3ccco3)=O)N=C2c(cc2)ccc2F)s1,1 Z453629472,CC(C)(C)C(c(cc1)ccc1F)NC(CN(CCC1)S1(=O)=O)=O,0 F5596-0843,O=C(c1cc(cccc2)c2[nH]1)N(CC1)CCC1c1nnc(-c(cc2)ccc2F)o1,1 F2574-0260,Cc(cc1C)cc(C)c1S(N1C(CNC(C(Nc2cc(F)ccc2)=O)=O)CCC1)(=O)=O,0 F6559-2482,O=C(c(s1)ccc1Cl)NC(CC1)CN1c1nccn2c1nnc2,1 Z826472708,O=C(NCc(cc1)cc(F)c1-n1cncc1)N(CC1)CCC11OCCO1,1 F6571-0701,CN(C)C(CNC(c1cc(-c(cc2)ccc2F)nn1C)=O)c1cc(cccc2)c2o1,0 Y020-9145,O=C(C1=CC(C(CC(C2)c3ccccc3)=O)=C2NC1=O)N1CCOCC1,1 Z1171353705,Cc1cccc(NC(CNc(cccc2)c2C(N2C(CO)CCC2)=O)=O)c1C,1 Z2627910431,CC(C1CCCCC1)N(C)C(C(C1)CC1C(O)=O)=O,1 F5058-0159,CCc1nnc(-c(cc2)ccc2NC(COCC)=O)o1,0 Y041-6108,c1(n2c(nn1)cccc2)[C@@H](NC(Cc1c([nH]nc1C)c1ccc(cc1)F)=O)C,0 F2724-0307,O=C(c(o1)ccc1Br)Nc1cc(-c(cc2)nnc2N2CCOCC2)ccc1,1 Z3741074405,NC(C1(CN(Cc2nc(-c3cccc(C(F)(F)F)c3)no2)CC1)c1ccccc1)=O,0 SD02-1796,CCn1ncc(C(N2CCC(C3)(CN(CC(N4CCOCC4)=O)C3c3nnc(C(C)C)o3)CC2)=O)c1,0 F6438-2584,Cc1cc(S(Nc2c(N(C)C)nc(N3CCCCC3)nc2)(=O)=O)c(C)cc1OC,0 F1540-0045,O=C(c1cccc(S(N2CCCCCC2)(=O)=O)c1)Nc(cc1)cc2c1OCO2,1 Z2836696980,Cc1ccc2ncc(CN(CC3)CC3C(NC(N3)=O)=CC3=O)cc2c1,1 Z1444812875,Cc1c(C(Nc(c2ccccc22)ccc2OCC(O)=O)=O)scn1,1 F5644-0025,Cc(cc1)nnc1Oc(cc1)ccc1N(C)C(c(cc(cc1)Cl)c1OC)=O,0 SB39-0413,CCS(N(CC1NC(c2cncn2C)=O)CC2(CCCC2)NC1=O)(=O)=O,1 Y020-3981,Cc(nc(N1CCOCC1)nc1)c1C(N=C(N1)N2CCC(Cc3ccccc3)CC2)=CC1=O,1 S984-0336,CCOCC(N(C[C@@H]1CN(Cc2cnccc2)C2)C[C@]12C(N(C)C)=O)=O,1 F6471-2333,COC(C(C(N(C(CC1)C2)C1c1c2ncnc1)=O)=CN1c2ccccc2)=CC1=O,1 8007-7095,O=C1N(c2ccccc2)C(SCc(cc2)ccc2-c2ccccc2)=Nc2c1c(CCC1)c1s2,1 Z1535572980,COc1cc(NC(C(C2)CN(C3CCCC3)C2=O)=O)ncc1,1 Z1419174907,Cc1cccc(C(NCCc2cn(-c3ccccc3)nc2)=O)c1F,0 Z1482064286,O=C(Cc1cccc(Cl)c1)NS(c1cc(-c2nnco2)ccc1)(=O)=O,0 Z964229304,CCS(N(CC1)CCN1C(NC1CCOCC1)=O)(=O)=O,1 F6809-1036,OC(CC1)(CCN1c(cc1)ncc1F)c(cc1)ccc1Cl,0 F5791-3372,Cc(n(-c1ccccc1)nc1)c1C(NCc1nnc(C)o1)=O,1 F5857-0601,OC(CNS(c(cc1)cc2c1OCCO2)(=O)=O)(C1CC1)c1ccco1,1 V028-9822,COc1cc(OC)c(CN(CCCn2c3ccc2)C3c(cc2)cc(F)c2F)cc1,0 E225-0973,CC(Cn(c1c2)nc2-c(cc2)ccc2OC)(C(NCc2ccccc2)=O)N(CCc2cccs2)C1=O,1 F6441-4533,CS(C(CC1CC2)CC2N1C(CCN(C=Nc1c2cccc1)C2=O)=O)(=O)=O,1 C784-3044,Cc1cc(n(c2c3)C(C)=NN(CCCC(NCCN4CCOCC4)=O)C2=O)c3o1,1 V019-8748,Cc(c1c2nc(Cc3ccccc3)nc1N1CCN(Cc3cccs3)CCC1)nn2-c(cc1)ccc1F,0 Z3216016991,Cc(ccc(S(N(CC(C1)C(O)=O)CC1N(C)C)(=O)=O)c1)c1F,0 F6608-0825,CC(C)(C)c(cc1)nnc1OCC(C1)CC1(F)F,1 Z1995529651,CC(CCNC1=O)C1NC(c(c(F)ccc1)c1Sc(cc1)ccc1Cl)=O,1 Z1481669869,O=C(C1OCCCC1)NOCc1ccc(C(F)(F)F)cc1,1 Z3369656225,COc1cccc(OC)c1C(NC[C@H](CO)O)=O,0 Y503-2437,CCn1nc(C)c(S(N(CCC2)C2C(O)=O)(=O)=O)c1,0 Z1068133594,CC(C)CC(NC(C(N(CC1)CCN1C(C)C(NC1CC1)=O)=O)c1ccccc1)=O,1 S555-1873,CN(C)c(cc1)cc(C2)c1OCCN2C(C1(CC1)c1ccccc1)=O,0 Z1930261976,Cc1noc(CNS(c2cc(C)c(C)cc2)(=O)=O)n1,0 F6677-1218,CCc1nccn1CC(C1)CN1C(c1csc(-c2ccccc2)n1)=O,1 Z2913107641,CC(C)c1nc(CC(CC2)CCN2C(C(C2)(C3)CC23C(O)=O)=O)n[nH]1,1 S661-1344,CCN(C(C(C1)N2CC1(CC1)CCN1S(c(cc1)cc3c1OCCO3)(=O)=O)=O)C2=O,1 Z2489643188,C[C@@H](CC[C@H]1C(O)=O)N1C(CN(C1=NC=N2)NC=C1C2=O)=O,1 Z2027144053,CC(C)(C1)N(C)CCN1C(C(CC1=O)CN1c(cccc1)c1OC)=O,0 Z2442567088,OC(c1ncc(C(N2CCC(Cn3nccc3)CC2)=O)nc1)=O,1 Z2335171139,CC(c1c[nH]c(C(N(CC2)CC2(C2)Oc(cccc3)c3C2=O)=O)c1)=O,0 F733-0641,Cc(cc1)ccc1-c1cc(Nc(cc2)ccc2C(NCCC2=CCCCC2)=O)ncn1,0 F6675-8131,Cc1nnc(CN(C)C(C2)CN2c2nccnc2)n1C,1 Z4662015108,CCCCN(CC1)Cc2c1ncc(C(O)=O)c2O,0 F6204-2711,O=C(c1cc(cccc2)c2s1)NC1(CCOCC1)c1cccs1,1 S606-2081,Cc1cc(C(N(CC2)C[C@@H]2N(c(nccc2)c2N2CCOC)C2=O)=O)cc(C)c1,0 G821-0071,Cc1c(C(N(CC2)CCN2c(cc2)ccc2F)=O)sc(N=CN2)c1C2=O,1 F3256-0708,Cc1nc(-c(s2)ccc2S(N(CC2)Cc3c2cccc3)(=O)=O)cs1,1 8016-1844,CC(c1ccc(C)n1CC1)N1C(c(cc1)ccc1S(N(C)C)(=O)=O)=O,1 F322-0087,Cc1c(-c2ccno2)c(S(N(CCC2)c3c2cccc3)(=O)=O)c(C)s1,0 V020-7484,Fc(cc1)cc(F)c1Oc1c(CN(Cc2cccs2)CC2)c2nc(N2CCCCC2)n1,0 F6443-7621,O=C(c(cc1)cc2c1OCO2)NCC(CCC1)N1c1ccccc1,1 Z2838112450,CCNC(NC(C(C)N[C@@H]1[C@@H](c(cc2)cc(F)c2Cl)OCC1)=O)=O,0 F1625-0083,Cc1nc(SCC(N(CCC2)c3c2cccc3)=O)nc(N2CCOCC2)c1,1 Z908014792,CC(C1)OC(C)CN1c(cc1)ncc1NC(c(cc1)cnc1C(N)=O)=O,0 F2496-1025,O=C(c1cc(cccc2)c2o1)OCc1noc(-c2cccs2)c1,1 Z2282614313,Cn1c2nccc(C(N3C[C@@H]4C(C5)C=CC5[C@@H]4C3)=O)c2nc1,1 SC12-0551,O=C(c1nccc2ccccc12)N(CCCN(CCC1)C1=O)C1CCOCC1,1 Z1870896678,Cc1cnc(C(CC2)CCN2C(c2cn(Cc3ccccc3)nc2)=O)s1,1 Y205-1294,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CCN1C(c1ccccc1)c1ccccc1,0 Z4400903774,OCCC(c(cc1)cc(Cl)c1Cl)NC(NCCC(N(CC1)CCN1c1ncccc1)=O)=O,0 F6656-1586,CC(C=C1)=NN(CC(C2)CN2C(Cc(cccc2)c2Cl)=O)C1=O,1 SB52-0147,CC(C)c1nc(C(C2)N(C)CC2(CC2)CCN2S(c2c(C)onc2C)(=O)=O)no1,1 Z1331657411,COc(cc1)cc2c1nc(-c1nonc1N)s2,0 S606-1404,O=C(c1nccnc1)N(CC1)C[C@@H]1N(c(nccc1)c1N1CC2CCCCC2)C1=O,1 Z1255773159,CCCNC(c1cc(NC(C2OCCN(Cc3ccccc3)C2)=O)ccc1)=O,1 Z3062125999,CC(N[C@H](CN(C1)C(Nc2nnc(C)c(C)c2)=O)[C@@H]1c1ccnn1C)=O,1 Y031-1968,COc(ccc(Cl)c1)c1NC(C(C1)CN(C2CCCCC2)C1=O)=O,0 F6353-3315,CN(C)C(CNS(c(s1)ccc1Br)(=O)=O)c(cc1)cc2c1OCC2,1 F6512-5493,Cc1cc(C(N(CCC2)CCN2S(c2cn(C)c(C)n2)(=O)=O)=O)c(C)o1,1 F2282-0117,O=C(c(o1)ccc1Br)NCCS(N(CC1)Cc2c1cccc2)(=O)=O,1 S959-2249,CC(NC(CCN1CCNC(Cc2c(C)cccc2)=O)C1=O)=O,0 Z45527648,CNS(c(cc1)ccc1[N+]([O-])=O)(=O)=O,0 G373-1859,CN(C)C(c(cc1)cc(N2CC(N)=O)c1N(CCCC1)C1C2=O)=O,0 F6438-6861,OC(CC1)C1NC(c(o1)ccc1Br)=O,0 Z3099119691,Cc1nc(-c(cc2)ccc2Cl)nc(C(N(C)C2CCNCC2)=O)c1,1 F5857-2258,OC(CNC(NCc(cc1)ccc1Cl)=O)(C1CC1)c1cccs1,1 Z2591284094,O=C(C(N(CC12CCC2)Cc2c1cccc2)=O)Nc1cnc2c(F)cccc2c1,1 S510-0135,CCNC(N(CCC1)C1c1noc(CCC(N2CCCC2)=O)n1)=O,1 SA90-0175,Cn1c(C(N(CC2)CCC22OC(CC(N3CCC3)=O)Cc3c2cccc3)=O)cnc1,1 SA85-0313,Cc1noc(C)c1Cc1ccc(C(N(CC(CN2CCc3ccccc3)O)CC2=O)=O)o1,1 F3320-0484,O=C(Cn1c(SCCOc(cccc2)c2Cl)nc2c1cccc2)N1CCOCC1,1 F6521-1727,CC(c1ccc(C2(CNC(c(cc3)ccc3S(N(C)C)(=O)=O)=O)CCCC2)s1)O,0 F0624-0093,O=C(c1c(C(F)(F)F)cccc1)OCN1N=Nc(cccc2)c2C1=O,0 F6680-9295,Fc1cnc(N2CC(COc3ccncc3)CCC2)nc1,1 T505-0302,Cc1c(CN2C(CCn3nnc(-c4ccccc4)c3)CCCC2)cnn1C,0 F2806-0057,CCCCOc1cccc(C(Nc(cc2)cc3c2ncs3)=O)c1,0 Y031-4075,O=C(C(C1)CN(C2CCCC2)C1=O)N(CC1)c2c1cccc2,1 Z2378175729,NCCCN(Cc1ccccc1)C(c1coc(S(N)(=O)=O)c1)=O,0 F6064-2294,O=C(c1cc(cccc2)c2o1)N(C1)CC1c1nc(-c2nccnc2)no1,1 S453-0326,O=C(c1ccc(CN(C(C2(CCOCC2)N2)=O)C2=O)cc1)NCCCc1ccccc1,1 Z1719256898,O=C(c(cc1)ccc1-c1ncn[nH]1)N1c2cccc(F)c2C2(CCCC2)C1,1 F630-0937,O=S(c1ccc(-c2nnc(C3CCC3)o2)s1)(Nc(cc1)cc2c1OCCO2)=O,1 F6561-5428,COc1cc([nH]c(C(N(CC2)CCC2S(Cc2ccccc2)(=O)=O)=O)c2)c2cc1,1 Y042-3345,COc(ccc(CCN(CC(C1)C(Nc(cc2)cc(C=C3)c2OC3=O)=O)C1=O)c1)c1OC,1 F6803-2495,Cc1cnc(CN(CC2)CC2Oc(nc2)ncc2OC)c(C)c1OC,1 F6559-2520,O=C(c(cc1)ccc1N1CCOCC1)NC(CC1)CN1c1nccn2c1nnc2,1 C361-1520,CCC(N(C(C)C1)c(cc2)c1cc2S(CCC(NCc1ccc(C)cc1)=O)(=O)=O)=O,0 F069-1088,CC(C(N(CC1)CCN1C(c1ccco1)=O)=O)N(c(cccc1)c1N=C1C(F)(F)F)C1=O,1 F6475-3953,O=C(c1cc(OC2CCOCC2)ncc1)NCCSc1c[nH]c2c1cccc2,1 Z1317378046,Cc1nn(CC(CC2)NC(N(C)C3CN(Cc4ccccc4)CCC3)=O)c2n1,1 F6605-0293,Cc1cc(C)nn1C(C=C1)=NN(CC(C2)CN2c2c3sccc3ncn2)C1=O,1 Z2676668769,Cn1nc(C(F)(F)F)cc1NC(CN(C=Nc1c2cnn1C)C2=O)=O,1 F6480-3069,Cc1nc(OC(CCC2)CN2C(c(o2)ccc2Br)=O)nc(C)c1,1 F6680-2678,O=C(NCC1OCCC1)N(CCN1c2cc(C(F)(F)F)ncc2)CC1=O,1 G267-0198,Cc(c(C(Nc(cc1)cc2c1OCCO2)=O)c1)nc(C=CN2Cc3cnccc3)c1C2=O,1 Z1575380627,CC1OCCC1C(NCC1(CCCCC1)N1CCCCC1)=O,1 F1301-0184,O=C(C1=COCCO1)Nc1cc(Cl)cc(Cl)c1,1 D510-1085,OC(Cn1c(cccc2)c2nc1C(CC1=O)CN1c(cc1)ccc1F)COc(cccc1)c1Cl,0 V019-5934,CC(C)CNC(C(C(CC1)CCN1C(NC(C)(C)C)=O)NC(c(cc1)cc2c1OCO2)=O)=O,0 F6675-8143,CN(Cc1csc(-c2ccccc2)n1)C(C1)CN1c1nccnc1,1 Z2790690648,COc1cccc(C(C(O)=O)N(CC2)CCC2c2c[nH]c3c2cccc3)c1,0 F6550-3249,O=C(Nc(cc1)cc2c1OCO2)N(CC1)CCC1=C1CC1,1 F2756-0359,CCOc1cccc2c1nc(N(CCN1CCOCC1)C(C1CCCCC1)=O)s2,1 SD54-0127,COCC(CC1)CCN1C(C(CC1)CCc2c1c(OCC1CC1)nc(-c1ccccc1)n2)=O,0 Z2955520665,CC1(C=CCC1)C(NCc(cc1)ccc1C(Nc1cnccc1)=O)=O,1 F6478-1145,Cc1nc(OC(CC2)CN2S(N2CCOCC2)(=O)=O)nc(C)c1,1 Z1303131269,COc1ccc(C(CC2)CCN2C(CCc2ccncc2)=O)cc1,1 K284-4606,O=C(CSC(N1CC(CC2)CCC2C(NCc(cccc2)c2Cl)=O)=Nc(cccc2)c2C1=O)NCCC1=CCCCC1,1 SD12-1433,Cc1noc(CC(C(NCC2)=O)N2C(Nc(cc2)cc3c2OCCO3)=O)n1,1 SB14-0963,O=C(C1CC1)N(C(CC1)CN1C(Nc(cccc1)c1F)=O)C1CCOCC1,1 Z2931992855,Cc1coc(C(N[C@H](Cc2c3cccc2)[C@@H]3N)=O)c1,0 Z1855901414,CC(NCC(C1)OCCN1S(C1COC1)(=O)=O)=O,1 SC68-1435,CCCn1c(C(CN(C2)C(Nc3cc(CC)ccc3)=O)C22CCCCC2)nnc1,0 V019-7634,Cc(cc1)ccc1S(N(Cc(n1Cc2ccccc2)cnc1S(Cc(cccc1)c1F)(=O)=O)C1CC1)(=O)=O,1 V021-3928,CC(C)CN(CC(CN(Cc1c(C(F)(F)F)cccc1)C1)C1c1cccc(F)c1)C(C(C)C)=O,0 Z1148956451,Cc(cc1)cc2c1c(CCNCc(cc1)ccc1OCCOC)c[nH]2,0 F6712-4063,CC(C)(C)c(cc1)nnc1N1CC(CN(C2)C(COc(cc3)ccc3F)=O)C2C1,1 Z30682911,CN(Cc1cccc(F)c1)C(CCc1c[nH]c2c1cccc2)=O,0 F2830-0079,CC(C)Sc1cc(C(Nc(cccc2)c2-c2nc(cccc3)c3[nH]2)=O)ccc1,0 F6523-2399,CCOc(nccc1)c1C(NCc1nnc(cc2)n1nc2-c1cccs1)=O,1 Z2390516066,CC(C)(C)c1ccc(C2(CNC(C3(CC3)N)=O)CCC2)cc1,1 F6435-1478,CS(C(CC1)CCN1C(c(s1)ccc1Cl)=O)(=O)=O,0 Z1171689859,O=C(C(C1)=NNC1=O)NC(CC1)CCN1c1ncccn1,1 F6444-2289,COC(CC1C(OC)=O)CN1C(CCc(cc(cc1)Br)c1OC(F)F)=O,0 Z2946751582,CC(c(cc1)ccc1F)N(C)C(CC(CC(N1)=O)C1=O)=O,1 SA44-0740,CN(CC(C1)(CN1C(C1CCOCC1)=O)C1)C1c1nnc(-c2ccccc2)o1,1 D494-0510,Cc1nc2nc(-c3cnccc3)nn2c(NCC(NCC2OCCC2)=O)c1,1 8018-4747,NC(C(C(C1C(c(cc2)ccc2F)=O)c2ccncc2)(C2N1c(cccc1)c1C=C2)C#N)=O,1 V016-3082,O=C(CN(CC1CC1)C(C1CC1)=O)N(CC1)C(COc(cc2)ccc2F)c2c1scc2,1 Z815702728,COc(cc1)cc(NS(c(s2)ccc2Cl)(=O)=O)c1C(O)=O,0 F1382-0022,CCOC(c1c(NC(COc2ccccc2)=O)sc2nc(C)cc(C)c12)=O,1 F6473-6236,CC(O1)=CC(OC(C2)CN2C(CCN(C=Nc2c3cccc2)C3=O)=O)=CC1=O,1 Z1694559803,CN(C)C(C(N(CCN1c2ccccc2)CC1=O)=O)c1ccccc1,1 F6436-1873,Cn1c(CN(Cc2cccs2)C(c2cc(Br)cs2)=O)ccc1,1 SA31-4459,CCN(CCCNC(C1(C)n2c(C3CCCC3)nnc2COC1)=O)Cc1ccccc1,1 FF01-3552,CNS(c(cc1)cc(N2)c1N(CCCC1)C1C2=O)(=O)=O,0 Z751013504,OC(CONS(c(cc1)ccc1-c1ccccc1)(=O)=O)=O,0 E942-0262,CC(C)CN(C=C(c1c2cccc1)NC(N(CC1)CC1c1ccccc1)=O)C2=O,1 Z878649754,O=C(C(c1c2cccc1)=NNC2=O)N(C1CC1)C1CCCCC1,1 Z3548285831,C[C@@H]1OCC[C@@H]1C(N[C@@H]([C@H]1C[C@@H]2CC1)[C@@H]2C(O)=O)=O,0 F3382-7661,CC(C)c(cc1)ccc1N(C(C1N(Cc2nc(-c3c(C)cccc3)no2)N=NC11)=O)C1=O,1 SB94-0344,Cc(occ1)c1C(N1CCC(CN(CC(C2)C(N3CCOCC3)=O)C2=O)CC1)=O,1 F6411-2805,Cc1c(CN(c2c(C(N3Cc(cc4)ccc4F)=O)scc2)C3=O)nc(-c2ccccc2)o1,1 F6559-0465,O=C(C(CC1=O)CN1c(cc1)ccc1F)N(CCC1)CC1N(C=Nc1c2cccc1)C2=O,1 F0838-0205,COc1ccc(cc(cc2)S(n3cncc3)(=O)=O)c2c1,1 Z1683818029,CC(N(CC1)CCN1c1nccc(-c2noc(C3CC3)n2)c1)=O,1 S693-0290,Cc1cnc(C2CCOCC2)n1CC(CCC1)CN1C(c1cccs1)=O,1 CM1461-4071,Cn1nc(CNC(c2c(-c(cc3)cc(OC)c3OC)ocn2)=O)c2c1CCN(C)C2,1 F6670-6556,CC(N1CC(CC2)CCN2c2nc(C(F)(F)F)ccc2)=Nc(cc(cc2)F)c2C1=O,0 Z1230718034,CC(N(CC1)CCN1c1nc(-c2cnccc2)nc(C)c1C)=O,0 Z3063544822,CC1(C(CC2)CC2C1)C(NCC(OC)OC)=O,0 Z1344200657,O=C(CC(CC1)Cc2c1cccc2)N(CCC1)CCN1C(CC(CC1)Cc2c1cccc2)=O,1 Z2993321653,CN(C)C(c1c(NCc2cc(OC)ns2)[nH]nc1)=O,0 Z3085823199,CC1(CC=CCC1)NC(C1=CNc(cccc2)c2C1=O)=O,1 Z2982740241,CC(N(C)Cc1cn(-c(ccc(Cl)c2)c2F)nn1)=O,0 F6796-3670,Cc(c(C)nc1ncnn11)c1N(CC1)CCN1c(cc1)nn2c1ncc2,1 Z1446702639,CCN(CC)S(c1cc(NS(c2cc(OC)cc(OC)c2)(=O)=O)c(C)cc1)(=O)=O,0 Z3538132347,CN(C)CCN(C)C(c1cc(CSCC2)c2nc1Cl)=O,1 Z736958012,O=C(Nc(cc1)ccc1F)N1Cc(cccc2)c2OCC1,0 Z1563993053,CC(CN(C)C1=NC=CN(C)C1=O)(CO)CO,0 D391-0081,CCN(CC)S(c1cc(C(CN(C(C(C)Oc2c3cccc2)=O)C3=O)=O)ccc1)(=O)=O,0 F6525-4583,O=C(c(cccc1)c1Br)NCCn1ncc(-c2ccccc2)c1,0 Z3091829661,CC(C)n1cnc(S(Nc2c(C)n(C)nc2C(OC)=O)(=O)=O)c1,0 F6464-0148,O=C(c1cocc1)N(CCCC1)CC1c(cc1)ccc1F,1 SB95-1337,CS(N(CCN1CCOCC1)C(CCC1)CN1C(c1ncccc1F)=O)(=O)=O,1 J029-1708,COc(cc(cc1)NC(C2(CCCC2)c(cc2)ccc2Br)=O)c1NC(c1ccco1)=O,0 F6514-2183,O=C(c(s1)ccc1Cl)NC(C1CCOCC1)c1cnccc1,1 Z1275957739,CCN(CC)C(CC1)CN1C(CN(c1c(CCC2)cccc1)C2=O)=O,1 F1358-0694,CNC(c1c(NC(c2cc(C(F)(F)F)ccc2)=O)scc1)=O,0 Z1904656731,O=C(NCCNc1ncccc1)NCc1nc(-c(cccc2)c2F)cs1,1 L501-1341,Cc1cc(NC(C(CCC2)CN2S(c2cc(-c3noc(C4CCC4)n3)cs2)(=O)=O)=O)no1,1 F2880-1582,CN(C)C(CNC(C(Nc(cc1)cc2c1OCO2)=O)=O)c1ccco1,1 E646-2661,CC(C)CCNC(C(C)(CN(CC1=O)S(c2ccccc2)(=O)=O)N1c(ccc(F)c1)c1F)=O,0 Z1127714984,CC1Oc(c(C(NCCN2CCOCC2)=O)ccc2)c2NC1=O,1 Z1978874786,CN(Cc(cc1)ccc1Cl)C(c1c(C2(CCOCC2)O)occ1)=O,1 Z4515700141,CN(CCC1)[C@H]1C(NCC(c1c[nH]c2c1cccc2)c(cc1)ccc1OC)=O,0 F5536-0011,O=C(NC(c1ccccc1)c1ccccc1)Nc(cc1)ccc1N(CCC1)S1(=O)=O,1 Z2348186201,COC(C1CC1)C(N(C[C@@H]1CCC2)C[C@H]1N2C(C(C1CC1)OC)=O)=O,1 S646-0894,CCCS(N(CC1)CCC1N(CC12CCCCC2)C1c1ccncc1)(=O)=O,0 Z339974648,Cc1c(CN(C)C(C(C=C2)=NN(c3ccccc3)C2=O)=O)scc1,1 F5772-8631,O=C(NC1CCCC1)Nc1cc(-c2nc(cccc3)c3[nH]2)ccc1,1 F6435-9260,COC(CSC(CC1)CN1C(c1nn(-c2ccccc2)nc1)=O)=O,1 Z2292920831,O=C(Nc1cnc(C(F)(F)F)cc1)N(C1)CC1C1CCCCC1,0 D146-0076,Cc(c1c2)coc1c(C)c(O1)c2C(C)=C(CCC(N2CCCC2)=O)C1=O,0 F6774-4245,COc(cn1)cnc1OC1CN(Cc(c(F)ccc2)c2Cl)CC1,0 Z2953572663,CO[C@@H](CCOC1)[C@H]1NC(NC(C(F)F)c1cccc(Cl)c1)=O,0 Z3294654288,O=S(c1ccnn1CC1CCC1)(Nc1nocc1C1CC1)=O,1 Z3685951477,Cc1c(N(CC2)C[C@@H]2NCc2nc(C)c(C)nc2C)nc(C(N(C)C)=O)nc1C,0 F6564-1588,CC(c(cc1)cc(OC)c1OCC(NCCN1N=C(CCCC2)C2=CC1=O)=O)=O,1 Z994933228,O=C(NC1CCCC1)Nc1c(cc[nH]2)c2ccc1,1 D269-1204,CC(C)Oc(cc1)ccc1-c1nonc1NC(C1Oc(cccc2)c2OC1)=O,1 Z1682852359,Cc1c(Cc2nc(-c(cc3)cnc3-n3nccc3)no2)c(cc(cc2)Br)c2[nH]1,1 Z2921372294,Cn1nccc1[C@H]([C@H](CC1)NCc(cc2)cc3c2OCC3)N(C)C1=O,1 F1911-2939,CCOC(c1c(C)nc(-c(cc2)ccc2F)s1)=O,0 S948-0106,N#Cc(cc1)c(C(F)(F)F)cc1N1C[C@@H](CN(C2)C(C3(CC3)c3ccccc3)=O)[C@]2(CO)CC1,0 Z1696868475,CC(C)(c1cn(-c2cccc(F)c2F)nn1)O,0 F6554-8601,Cc1noc(C)c1S(N1C(C2)CSC2C1)(=O)=O,1 S592-0925,CCn1ncc(S(N(CC2)CC2c2noc(COC)n2)(=O)=O)c1,0 F6556-0600,OC(CNC(c(c(F)ccc1)c1Cl)=O)(CSC1)c2c1cccc2,0 F3394-0561,O=C(CSc1nnc2scc(-c(cc3)ccc3Cl)n12)N1CCCCCC1,1 Z2407941887,Cc(c(C(N(CCC1)CC1n1nncc1)=O)ccc1)c1Br,0 F6482-4031,O=C(NCc1cccc2ccccc12)N(CC1)CCC1n1nccn1,1 Z1390435248,O=C(c(c(F)cc(Br)c1)c1F)Nc1ccnn1-c1ccccc1,0 G434-0479,CCCN(c(ccc(NS(c1ccc(C2CCCCC2)cc1)(=O)=O)c1)c1O1)C1=O,1 F6089-9772,CS(N1CCC(CNC(NC2CCOCC2)=O)CC1)(=O)=O,0 F6507-8482,OC(CNC(c1cc(cccc2)c2s1)=O)(CCC1)c2c1occ2,1 F6480-4838,CN(c1c(C(N2C)=O)n(CC(N(CCC3)CC3Oc(nc3)ncc3Cl)=O)cn1)C2=O,1 F6454-1551,O=C(NCC(CC1)CCN1c(nc1)ncc1F)Nc1c(C(F)(F)F)cccc1,0 SB91-0597,Cc(ccc(NC(N(CC1)CC1N(CCN1CCCC1)S(N(C)C)(=O)=O)=O)c1)c1F,0 Z1444861917,OC(CNC(c(cc1)ccc1NC(CC1COCC1)=O)=O)=O,0 SB15-0959,Cc1nc(C(N(CCC2)CC2N(C2CCOCC2)C(COC)=O)=O)co1,1 F6427-0261,CCSc(cccc1)c1C(NCCN(C(C=C1)=O)N=C1n1ncnc1)=O,0 Z1767654637,O=C(C1CC1)N(CCC1)CCN1C(c1cc(C2COCC2)ccc1)=O,1 Z2994024562,CC(C)c1nc(Cn2ncc(C(c3ccccc3)O)c2)no1,0 SD07-0958,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(Cc2ccc(C)cc2)=O)C2)n2nn1)=O,0 Z2763711607,CN(C[C@H]1c2cncn2C)C[C@H]1NC(c1cnc2n1CCC2)=O,1 Z2307565885,CC(CN(CC1)C2CC2)CN1C(NCC1=CC=C(C)N(C)C1=O)=O,1 P935-1593,O=C(C1CCCC1)N(CCCC1)C1c1nncn1CC1CC1,1 D396-0158,CC(C)(Cc1c2C#N)OCc1c(N1CCOCC1)nc2SCC(N1CCCCC1)=O,1 F6544-1257,Clc1cnc(N(CC2)CCN2C2CCC2)nc1,1 SB04-0502,Cc1c(COC)c(C(NCCN(C(CC2)CN2C(N(C)C)=O)C2CCOCC2)=O)no1,0 6114-0189,COc(cc1)ccc1-c(nc1SCCCN(c(cccc2)c2N2)C2=O)cc(C(F)(F)F)c1C#N,1 S976-0307,O=C(C(CCC1)(CN1S(Cc1ccccc1)(=O)=O)F)NCC1CC1,1 Z1391858215,O=C(c(cc1)ccc1NS(c1ccccc1)(=O)=O)Nc([nH]c1ccc2)nc1c2Cl,1 Z1119042237,CC(COC)C(N(CCC1)C1c1noc(C)c1)=O,0 Z1067459442,CC(CN(C)C(C1=CC=C(c2cc(C)ccc2)NC1=O)=O)c1ccccc1,1 Z1727382876,CC(C(NCC(C(OC)=O)Oc(cc1)ccc1F)=O)(c1ccccc1)O,0 Z3066986764,CCn1ncc(Br)c1C(NCCc1ncccc1C)=O,1 SA73-1081,COCCNC(N(CC1)CCC1(CC1CC1)c1noc(-c2ccncc2)n1)=O,0 Z1834418649,COCC(N(CCCC1)C1c1nc(-c2cccc(F)c2)c[nH]1)=O,0 Z2790582790,C(c1ccccc1)N(C[C@H]1CC2)C[C@@H]1C2NC(CC1)CCN1c1nccs1,1 F6441-4285,CS(C(CC1CC2)CC2N1C(c1cscc1)=O)(=O)=O,1 L228-0086,Cc1ncc(-c(s2)ccc2S(N(CC2)Cc3c2cccc3)(=O)=O)o1,1 Z4180225437,Cc1c(C)sc(CNC(Cn2nnc([C@@H](c3ccccc3)O)c2)=O)n1,0 Z2790183213,Cc(cc1C)c(CC(O)=O)c(C)c1S(N(C)CC#CC)(=O)=O,0 F6525-2354,CC(C)n1nc(C)c(S(NCc2cc(-c3nccnc3)nn2C)(=O)=O)c1C,1 F2167-4207,CC(C)(C)OC(N1C(Cn2nccn2)CCC1)=O,1 S555-0198,O=C(C1CCC1)N1Cc(cc(cc2)N3CCCC3)c2OCC1,1 F5822-0757,CCc1nccn1CC(CC1)CCN1C(CCc1c(C)onc1C)=O,1 Z513462728,CC(NCCCNC(N(CC1c2ccccc2)Cc2c1cccc2)=O)=O,0 Z3026725400,CC(C1CC1)C(N(CC1(C)C)Cc2c1[nH]nc2)=O,1 E216-5797,CCC(C1)Oc(ccc(C)c2)c2N1C(N(CC1)CCC1C(NCCc(cc1)ccc1SC)=O)=O,1 Z2434438188,CC(CCCC1)(C1C(Nc(cc1)ccc1-c1cnc(C)o1)=O)N,0 F3406-8259,COC(N(c1cc(F)ccc1)N=C1C(Nc2cccc(SC)c2)=O)=CC1=O,0 T834-1319,CC(C)CN(c(cccc1)c1-n(c1c2)nc2C(NC(C)CCc2ccco2)=O)C1=O,1 Z1174721068,O=C(C(CCC1)CN1C(N1CCCC1)=O)NCc(cc1)ccc1-c1nnn[nH]1,1 Y030-8654,Cc(cc1)cc2c1nc(NC(C1OCCC1)=O)s2,0 F2537-1430,O=C(CSc(cc1)ccc1F)Nc(cccc1)c1-c1nc(cccc2)c2[nH]1,1 Z3417081067,Cc1cccc2c1[nH]cc2CCNC(c1cc(C(N(C2)C(CCC(N3)=O)C3=O)=O)c2cc1)=O,1 5436-1129,Cc(c1c2occ1-c1ccccc1)cc(O1)c2C(c2ccccc2)=CC1=O,1 Z742529560,CSc(cc1)ccc1NC(c(o1)ccc1S(N)(=O)=O)=O,0 F5528-1117,O=C(C(CC1)CCN1c(cc1)nnc1-c1cccs1)N(CC1)c2c1cccc2,1 Z740402422,CC(C)(C)c1nnc(NC(c(o2)c(C)cc2Br)=O)s1,0 F6105-0052,O=C(NCC1)N1C(Cc1cc(F)ccc1)CNS(C1CC1)(=O)=O,1 SB75-0879,CCS(N[C@H](C[C@H]1CN(C2)C(c3c(C)ccnc3)=O)C[C@]12c1nc(C)no1)(=O)=O,0 S606-0980,CN(c1cccnc1N1[C@H](CC2)CN2S(c2cccc3cccnc23)(=O)=O)C1=O,0 Z2965467221,COC1=CN=C(C(CCC2)N2C([C@H](C2)[C@H]3O[C@@H]2[C@H]2[C@@H]3C2)=O)NC1=O,1 F6563-0045,O=C(c(s1)ccc1Cl)N(CC1)CCC1Oc1cscc1,1 F6503-4909,Cn1nc(CN(Cc2ccco2)C(c(cc2)ccc2OC(F)(F)F)=O)c2c1CCC2,0 Z1891236609,CC(C)c1noc2nc(-c3ccco3)cc(-c3nc(-c4cnc5n4ccnc5)no3)c12,0 F6729-7076,Cc(cc1)nnc1N(C1)CC1N(C)C(Nc1c(C(F)(F)F)cccc1)=O,0 S515-0119,CC(C)N(CC1)CCC1OCCCNC(C(CCCC1)NC1=O)=O,1 SB16-1097,CN(CC1)C[C@@H](COCC2)[C@H]1N2C(CN(c(cccc1)c1O1)C1=O)=O,1 F3179-0414,CCOc(c(C)c1)cc(C)c1S(NCCCn1cncc1)(=O)=O,0 M597-0119,CCC(c1cccs1)NC(c(cc1)ccc1-c1nc(N2CCCC2)ncc1)=O,1 F6606-5027,O=C1N(CC(CC2)CCN2S(c(cc2)cc3c2OCCO3)(=O)=O)C=NC=C1,1 Z3133107019,N[C@@H](C1)[C@@H](C2)[C@@H]2[C@@H]1C(N(CC1)Cc2c1cc(C(F)(F)F)cc2)=O,1 Z1018572318,Cc1noc(CCNC(N(CCN(C)C2)C2c2ccccc2)=O)n1,1 Y042-6462,C1(N2[C@H](C(Nc3c1cc(NC(=O)CCCc1ccccc1)cc3)=O)CCC2)=O,1 F6675-6868,O=C(NC(C1)CN1c1nccc(C(F)(F)F)c1)NC1CCOCC1,1 G346-0031,CN(Cc1ccccc1)C(C1CCC(CN(C(c(scc2)c2N2)=O)C2=O)CC1)=O,0 Z1718329088,O=C(c1c(-c(cc2)ccc2F)ocn1)NCc1nnc2n1CCC2,0 Z1444737319,Cc(cc(cc1)C(NC2(CC(O)=O)CCOCC2)=O)c1F,0 Y042-5143,COc1ccc(C2(CCOCC2)C(Nc2nc(-c3ncccc3)cs2)=O)cc1,1 F6562-2158,COc(cccc1)c1NC(NCc1cc(N(CCC2)C2=O)cnc1)=O,0 F3406-7875,Cc(cc(cc1)-n2nnc(C(N(CC3)CCC3NC(c(cccc3)c3Cl)=O)=O)c2)c1F,0 Z3416643471,CN=S(CCC1)(CC1(CCC1)N1C(c1cnc(C(F)(F)F)cc1)=O)=O,1 F0161-0190,Cc(cccc1)c1C(Nc1nc(-c2cc(NC(c3c(C)cccc3)=O)ccc2)cs1)=O,1 F6349-0041,CCOC(c1c(cc(cc2)NC(c3cc(-c4ccccc4)nn3C)=O)n2nc1)=O,0 S591-0247,O=C(c1nccc2ccccc12)N(C1)CC1N(CC1CC1)C1CCOCC1,1 F6512-1294,CC(C)S(c1ccc(CC(NC2Cc3ccnn3CC2)=O)cc1)(=O)=O,0 Z1228204237,CC(NC(CC1)CCC1NC(c1cc(Nc2ccccc2)ccc1)=O)=O,1 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Z1920532346,CC(CNC(NCc(cc1)cnc1NC(C)=O)=O)c1ccncc1,1 Z874787426,COc1cc(CCN(C2)C(NCC3CC=CCC3)=O)c2cc1OC,1 Z450584554,Cc(cc1NC(c(nc(N2CCCC2)nc2)c2Cl)=O)nn1-c1ccccc1,1 Z2273969552,CC(CN(C1)c2c(ccs3)c3ncn2)NC1=O,0 Z1889112310,CN(CCC1(CC2)CCN2C(NCCc2cc(OCc3ccccc3)ccc2)=O)C1=O,1 SB57-1099,Cc1noc(C2C(C3)(CN3S(N3CCOCC3)(=O)=O)CN(Cc3ccccc3)C2)n1,1 Y030-5376,CCC(CC)NC(c(cc1)cc(OCC)c1OCC)=O,0 Z2642280731,CC(C(Nc1cc(CCCCC2)c2cc1)=O)n1c2ncnc(N)c2nc1,1 F6418-0533,Cc1cc(C(NCc2ccc(C(c3ccco3)O)s2)=O)c(C)o1,1 C612-0432,COc1cccc(NC(c(cccc2)c2C2=O)N2c(cc2)ncc2Cl)c1,0 Z1480758385,Fc1cc(F)c(CNc2cc(-c3nnc[nH]3)ccc2)cc1,0 F6614-1353,N#Cc(nccc1)c1N(CC1)CCC1C(F)(F)F,0 Z2493698920,CCc1noc(CC)c1CNC(c1c2OC(C)(C)Cc2ccc1)=O,0 Z2062824911,CCN(CC)C(C1CCN(Cc2noc(-c3ccccc3)c2)CC1)=O,0 Z4010101590,OC([C@@H](C1)[C@@H]1[C@H](C1)[C@H]1NC([C@H]1C[C@H](CC2)O[C@H]2C1)=O)=O,1 G501-0379,CN(C)c1ccc(C(CNS(c(cc(cc2)F)c2F)(=O)=O)N(CC2)c3c2cccc3)cc1,0 S984-0944,CN(C)C([C@@](CN(C1)C(c2ccccc2)=O)(C2)[C@@H]1CN2C(c1nc2ccccc2cc1)=O)=O,1 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G867-0228,O=S(c(cc1)cc2c1OCCO2)(N(CC1)CCN1c1ncnc2c1nnn2Cc1ccccc1)=O,1 Z2448358654,CNCCC(Nc(cc1)ccc1-c1cnc(C2CC2)o1)=O,1 F6782-7596,Cc1cccc(N(C=CN(CC#CC)C2=O)C2=O)c1C,0 8018-6957,Cc1cc(N(CC(N2C)=C3C(c(cc4)ccc4O)NC2=O)C3=O)cc(C)c1,0 F6275-0020,O=C(CSc1nc(cccc2)c2o1)N(CC(F)(F)F)C1CCOCC1,1 F2199-0406,O=C(c1c2cccc1)N(Cc1noc(C(F)(F)F)n1)C2=O,0 Y042-7592,c1(nc2c(n1CCOC)cccc2)[C@@H](NC(=O)CCc1cc2c(OCC2)cc1)C,0 Z3415057008,CN=S(CC1)(CCC11OCCN(Cc(cccc2F)c2F)C1)=O,0 F5912-0040,COC(c(cccc1)c1NC(CCCN(C=NC(c1ccccc1)=C1)C1=O)=O)=O,0 P936-2778,CCn1c(CC(CC2)CN2S(c2cc(CCC3)c3cc2)(=O)=O)nnc1,0 Z3290576693,CC(CO)(CC1)N1C(Nc1cccc(OC(F)(F)F)c1)=O,0 F5303-0048,Cc1nn(C)cc1S(N(CC1)CCN1C(c1ccccc1)c1ccccc1)(=O)=O,1 Z394403198,Cc(ccc(F)c1)c1C(Nc1c(C)c(C(NC)=O)ccc1)=O,0 F6559-0049,Cn(cc1)c2c1C=CN(CCNC(c1cc(-c(cccc3)c3OC)n[nH]1)=O)C2=O,1 Z2626064510,O=C(C1CCCC1)NCCNC(c1c(Nc2ccccc2)scn1)=O,1 Z390140702,CN(Cc(c(Cl)ccc1)c1Cl)C(Cn1nc(C#N)nc1)=O,0 F6809-6774,O=C1N(C=CC=C2)C2=NC(N(CC2)CCC2c2noc3c2ccc(F)c3)=C1,1 Z1983487624,CC(C1)(CC1NC(CCN1c2cn(C)nc2)C1=O)c1ccccc1,1 F5486-0033,CCCNC(Cn1nc(CSC2)c2c1NC(C1(CCCC1)c(cc1)ccc1Cl)=O)=O,1 Y500-8753,CCn1nc(C)c(C(Nc2c(C(NC3CC3)=O)c(CCC(C)C3)c3s2)=O)c1C,1 F6549-5628,Cn1c(C(CC2)CCN2C(NCc2cccc3ccccc23)=O)cnc1,1 F6708-8397,CN(c(cc(cc1)S(N2CC(C3)(CC3c3ccccc3)C2)(=O)=O)c1O1)C1=O,1 Y040-7862,CC(c1ccccc1)Oc(cc(c(C1=C2CCCC1)c1)OC2=O)c1Cl,0 F6550-6185,O=C(Cn(cc1)c2c1cccc2)N(C1)CC1Nc1nnccc1,1 F5283-0226,COc(nccc1)c1C(NCCN1N=CC=CC1=O)=O,0 Z4368683323,Cc(cc(cc1)NC(c2nn(C)c3c2cccc3)=O)c1NC(c1c2ncc(CCN)cn2nc1)=O,1 Z2911060256,OC1(CCSCC1)C(NCc1cc(-c2nc(C(O)=O)cs2)ccc1)=O,1 F5615-0322,O=C(c1nn(-c2ccccc2)nc1)N1CCN(Cc2csc(-c3ccccc3)n2)CC1,1 Z1071411434,O=C(NCc(cc1)cnc1-n1cncc1)N1CC(c(cccc2)c2F)OCC1,0 F6559-0139,CCn(cc1)c2c1C=CN(CCNC(c1noc(-c3ccco3)c1)=O)C2=O,1 F2158-0845,Cc(cc1)c2nc(NCCCn3cncc3)sc2c1Cl,0 F2493-2510,CC(C)Sc1ccc(CC(NCc2noc(-c3ccccc3)c2)=O)cc1,1 Z606-1156,CCNC(N(CC1)CCC1c1nc(C(C)C)cs1)=O,0 Y020-6265,CSc1ccc(C(C(C(N2)=O)C#N)C(C(N3)=O)=C2N=C3N2CCCCC2)cc1,0 Y600-4130,CCC1N(CC(NCc2ccco2)=O)c(cccc2)c2NC(CC(C)(C)C2)=C1C2=O,0 F6436-2484,CC(C)(C)NC(N1CCC(CNC(c(cc2)ccc2-c2cscc2)=O)CC1)=O,0 F6562-1021,Cn1ncc(C(CN(C2)C(NCc(cc3)cc4c3OCO4)=O)c3c2cccc3)c1,1 Z2953124421,Cc(cc1)c(cc(C(NCCS(C)=O)=O)[nH]2)c2c1Br,0 8019-6811,CC(CC1)Cc2c1c(C(CC(N1)=O)c(cc3)ccc3OCc(cc3)ccc3F)c1s2,0 F5950-0271,CCOC(N(CC1)CCN1C(Cc1csc(Nc2nc(C)ccc2)n1)=O)=O,1 Z2940726246,CCC(c1cn(-c(c(F)ccc2)c2Br)nn1)O,0 F6089-9718,O=C(NCCN(CC1)CCN1c(cc1)ccc1F)NC1CCOCC1,0 F6565-2790,CC(C(N1CCN(Cc(cc2)cc3c2OCO3)CC1)=O)N1N=C(C(F)(F)F)C=CC1=O,1 F5860-1969,O=C(NCc1cccc2ccccc12)N1CCN(CC(F)(F)F)CC1,1 F6476-3110,O=C(CSc(cc1)ccc1F)N(CC1)CC1Oc1nccc(C(F)(F)F)c1,1 Z1273647417,O=C(CCN(C(C1C2C3OC1CC3)=O)C2=O)N(Cc1ccncc1)C1CC1,1 C908-0526,Cc1c(CCC(Nc(cc2)cc3c2oc(-c2ccncc2)n3)=O)c(C)nc2nc(CN)nn12,1 Z3992148965,CCC(N(C)c(cc1)ccc1Nc(ncnc1)c1Br)=O,0 Z3141420755,Cn1ncc(C(F)(F)F)c1C(N(C[C@@H]1CC2)C[C@@]12N)=O,0 Z3071585111,C(C1)C1n1nnc2c1ncnc2N(CCC1)CC1c1ccccc1,1 Z268757670,O=C(CN(CCC1)C1c1ccccc1)NCC(N1CCCC1)=O,0 S976-0084,O=C(C(CCC1)(CN1C(NCc1ccco1)=O)F)N1CCCC1,1 F6747-6034,Cc1csc2c1ncnc2N1CC(Cn2ncc(Cl)c2)C1,0 Z2891383837,CC(C)(COCC1)N1C(C1=Cc2cccc(C(F)(F)F)c2NC1=O)=O,1 SC39-0131,O=C(Nc(cc1)ccc1Br)N(CC1)CC1(c1nc(C2CCOCC2)no1)F,0 D168-0038,CCc1ccc(C(C)(C(CN2CCOCC2)c(cc2)ccc2Cl)O)cc1,0 D473-1244,CC(C1)N(C(c(cc2)ccc2N(C(C(C)(C)C2)=O)S2(=O)=O)=O)c2c1cccc2,0 D491-4801,CC(CC1)CCN1C(CNC(c(cc1)ccc1Br)=O)c1cccs1,1 S585-1077,CCS(N(CCC1)CC1c1nnc(C2)n1CCN2S(c1cnccc1)(=O)=O)(=O)=O,1 F6559-0595,CC(Nc(ccc(C)c1)c1S(N(CCC1)CC1N(C=Nc1c2cccc1)C2=O)(=O)=O)=O,1 Z2008535755,Cc(cc1)ccc1N(CCC1)CCN1C(NC(CN(C=CC=C1)C1=O)c1ccccc1)=O,0 Z2777617775,OC(c(cc(cc1)NC(CCC2CCOCC2)=O)c1O)=O,1 Z1451671749,CCc1nnc(NC(NC2(CO)CCC2)=O)s1,0 Z1529576765,CCC(CO)N(CC1)CCN1C(c1c(C)cc(C)[nH]1)=O,0 Z4064883587,Nc1ncc(CCN(C2)C(C3CNC4(CCCCC4)CC3)=O)c2n1,1 Z2911448330,CN(C)CC1(CC1)C(N(CC1)C(C(O)=O)c2c1occ2)=O,1 G210-0086,CCOc(ccc(-c1c2ncc(C(NC3CCC(C)CC3)=O)c(C)n2nc1C)c1)c1OCC,1 F6246-0227,O=C(CN(CC1)CCC1c1nnc(C(F)(F)F)o1)NCc(cccc1)c1Cl,1 Z1563264388,Cc1n[nH]cc1CN(CC1)CCC1NC(c1c(C)cccc1)=O,0 F5835-0187,COc(cc1)cc(C(Nc(cc2)ccc2-c2n[nH]cc2)=O)c1Br,0 F6443-8402,O=C(C(CCC1)N1c1nc(cccc2)c2o1)N(CC1)c2c1cccc2,1 F033-1352,CSc1ccc(CNC(C2=CCN(Cc3ccccc3)CC2)=O)cc1,0 Z1082940542,O=C(C1(CC1)c(cc1)ccc1Cl)N(C1)CC1n1ncnc1,0 Z1528581789,CCc1nc(C(CCCC2)N2C(CCc2c(C)n(C)nc2)=O)no1,1 S988-1175,Cc1c(CN(C[C@H]2CN(C3)C(c4ccccc4)=O)C[C@]23c2nc(C)no2)scc1,1 Z2238583991,Cc1cscc1C(N(CC(CC1)C2)C1C2C(O)=O)=O,1 Z1140549002,Cc(cccc1)c1NC(CN(CC1)CCN1c(cc1)nn2c1nnc2)=O,0 SA44-1135,CN(CC(C1)(CN1C(NC1CCCC1)=O)C1)C1c1nnc(-c2ccccc2)o1,1 F6454-0744,O=C(c1cocc1)NCC1CCN(CC(F)(F)F)CC1,0 Z1272355048,Cc(c1ncc2C#N)cc(F)cc1c2N1CCN(Cc2cn(C)nc2)CCC1,0 F5012-0163,O=S(CCCOc(cc1)cc2c1OCO2)(N(CCC1)c2c1cccc2)=O,1 S985-0050,CN(C[C@H]1CN(C2)C(Cc(cc(cc3)OC)c3OC)=O)C[C@@]12C(N1CCCC1)=O,0 F6188-0794,Cc(c(C)c1)cc(OC)c1S(NCC1(CCOCC1)Sc1ccccc1)(=O)=O,0 F0863-0014,CCc1nnc2n1cnc1c2c(-c2ccc(C)cc2)cs1,1 G008-4141,Cc1noc(-c(s2)ccc2S(N2c3nc(cccc4)c4n3CC2)(=O)=O)c1,1 F2964-1982,COCCn1c(SCc(cc2)ccc2F)ncc1-c(cc1)ccc1OC,1 F2493-2816,CN(C=CC=C1C(NCc2noc(-c(cc3)ccc3F)c2)=O)C1=O,1 C630-0499,COc(cccc1)c1OCCCn1c(cccc2)c2nc1C(CC1=O)CN1c1cccc(SC)c1,0 Z2433802653,N#Cc1cnc2c(Cl)cccc2c1N(CC1)CC1N(CCC1)C1=O,1 F6523-0611,COc1cccc(-c2n[nH]cc2C(NC(CC2)CCN2c2ncnc3c2CCCC3)=O)c1,1 S968-0606,Cn(cc1)nc1C(N(CC1)CCC1(C1)C1NS(C)(=O)=O)=O,0 Y041-3953,Cc(cc1C)cc(C(CN(CC2)CCN2C(c2ccccc2)c2ccccc2)=C2)c1OC2=O,0 Z1528212644,CN(CC1)CCN1C(CC(CC1)CCN1C(c(cc1)cc(OC)c1Cl)=O)=O,0 F6519-7807,O=C(c(s1)ccc1Cl)NCC(c1cscc1)n1nccc1,1 Z2436990348,NCCCC(Nc(cc1)cnc1Oc1ccc(C(F)(F)F)cc1)=O,0 F2334-0132,CCOC(N(CC1)CCN1C(CN(C1=O)N=C(N(CC2)c(cc3)ccc3F)N2C1=O)=O)=O,1 F6789-6406,Cc1nc(C(F)F)cc(Nc2cccc(OC(F)F)c2)n1,0 F6440-4367,O=C(C1(CCCC1)c1cccs1)NCc1nn(C2CCCC2)c(C2CC2)c1,1 F6573-8288,CN(C)c1cccc(C(N(CCN2c(nc3)ncc3F)CC2=O)=O)c1,0 SB59-0102,Cn1c(C(C2)C(C3)(CN3C(c(cc3)cnc3OC)=O)CN2S(C)(=O)=O)nnc1,0 S826-5132,Cc1cc(C)nn1CCC(N(C[C@@H]1CO)C[C@@H]1c1nc(C2CC2)no1)=O,1 SB57-0320,CCS(N(C1)CC(C2)(CN2C(NCC(C)C)=O)C1c1nc(C)no1)(=O)=O,0 F1915-2678,CC(C)(C)c1nccc(OC2CC(CC3)NC3C2)n1,1 Z4054865112,CC(C1)OCC1C(Nc1cnc(N2CCNCC2)nc1)=O,0 Z1314898295,O=C(c1csc2cncn12)N(CCC1)CC1N(CCCC1)C1=O,1 SB69-0595,O=C(c1nn(C[C@H](C2)Oc3ccncc3)c2c1)NC1CC1,1 F6560-8287,Cn1ncc(-c2ncc(CNC(NCc(cc3)ccc3F)=O)cc2)c1,1 Y044-4504,COc(cc1)cc2c1[nH]c1c2CCCC1NC(CCCc1c[nH]c2c1cccc2)=O,1 Z1499144565,Cc1nc(C(CCCC2)N2C(c2cn(Cc3ccccc3)nc2)=O)n[nH]1,1 Z2188086076,COCCC(COCC1)N1C(CCc1ccco1)=O,1 F5526-0381,O=C(C1CCCC1)NCCOc1cccc(C(F)(F)F)c1,0 F2751-0006,CC(C)CN(CC(C)C)S(CCNC(c1ccccc1)=O)(=O)=O,0 Z1688669899,Cn1nc(C(F)(F)F)c(NC(N(CC2)Cc3c2scc3)=O)c1,0 Z2365129934,C[C@](C1)(C[C@@H]1Nc1c(ccs2)c2ncn1)O,1 J006-2825,CCc1c(C2N(Cc3cn(CC)c(cc4)c3cc4OC)CCC2)c(C)no1,1 SA24-0243,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1n[nH]c2c1cccc2)=O,0 Z3576571755,CC(C)([C@@H]1C(F)F)[C@H]1C(N(C1)[C@]2(C)[C@H]1CCCC2)=O,1 L898-0683,CCC(C)NC(CSc1nccnc1Sc1c(C)cccc1)=O,0 F6774-4015,Cc1nc2ccccc2nc1N(CC1)CC1Oc(nc1)ncc1OC,1 Z1167357256,CC(C(NC(CCN1c2ccccc2)C1=O)=O)S(C)(=O)=O,0 Z1203274075,Cc1c(C(N(CC2OCCC2)c2ccncc2)=O)oc(CCC2)c1C2=O,1 G620-0425,O=S(c(cc1)cc(C(F)(F)F)c1F)(Nc(cc1)ccc1-c(cc1)nnc1N1CCOCC1)=O,0 F3088-2494,Cc1cc(NC(c2ccc(COc(cccc3)c3Cl)o2)=O)no1,1 Z1274720028,O=C(c(cccc1)c1F)NCCc(cc1)nn1-c(cc1)ccc1F,0 Z878779784,CS(Nc(cc1)ccc1C(N(CC1)CCN1c(cc1)ncc1Cl)=O)(=O)=O,0 F2541-0049,Cc(cc1)c(C)cc1N(CC(C1)NS(C)(=O)=O)C1=O,0 S956-5231,COCC(CN(CC1)C(C2(CC2)c(cc2)ccc2OC)=O)N1c(cc1)cc(C(F)(F)F)c1C#N,0 SC60-0296,CC(C)(CN(C(C1)C(N2c(cc3)ccc3F)=O)C2=O)CN1C(c1cn(C)nc1)=O,0 Z339886702,O=C(NCc1cc(N2CCOCC2)ncc1)N1CCCC1,1 8016-0904,NC(c1nn(-c2ccccc2)nc1NC(COc1nsnc1N1CCOCC1)=O)=O,1 F1193-0036,CC(C)(C)NCC(COCCOc(cc1)ccc1Cl)O,0 Z3524098519,OC(C1(CCCC1)C(N(CC1)CC1(CC1)NC1=O)=O)=O,1 Z45639813,Cc(cc1)c(C)cc1S(Nc(cccc1)c1F)(=O)=O,0 Z1995739640,O=C(Nc1nc(C2CCC2)cs1)N(CC1)CCC1c1ncc[nH]1,1 Z1729894039,CC(C(NOC1CCOCC1)=O)n1cccc1,1 Z1187135221,Cn1nccc1CNC(N(CCCC1)C1c1nc(-c2ccccc2)no1)=O,1 F1899-2229,CCOC(N(CC1)CCN1C(CSc(cc1)nnc1-n1nccc1)=O)=O,1 F6709-4242,Cc(s1)ccc1S(N(C1)CC1Oc1cc(C(F)(F)F)ncc1)(=O)=O,0 Z2113572529,Cc1ncc(C(CC2)CCN2C(Nc2nn(CCCC3)c3c2)=O)cc1,1 F6516-0728,O=C(c1cc(Br)cs1)NCc1ccc(-c2ccco2)o1,1 F6478-4401,Cc1cc(OC(CC2)CN2C(c2ncccn2)=O)nc(C)n1,1 F1886-0293,CC(CCC1)CN1c1ncnc2c1cnn2-c1cc(C)c(C)cc1,0 F5496-0147,O=C(c(ccc(F)c1)c1Cl)N(CC1)CCC1c1nnc(C2CC2)s1,1 F6414-0380,OC(CNC(C(NCCC1=CCCCC1)=O)=O)c(cc1)cc2c1OCC2,1 Z1400460627,Cc([nH]nc1C)c1S(N1c2cccc(Cl)c2CC1)(=O)=O,0 F6752-2291,CC(C)(C)C(NC(CC1)CCN1c1nc(C)c(C)s1)=O,0 Z2853036342,COC[C@H](CO)NCc(c1ncccc11)ccc1Cl,0 Z2378324787,Cc1csc(C(N2[C@H](CNC3)[C@H]3CCC2)=O)c1Cl,1 Z2441166764,CCc1noc(C)c1C(N(C[C@H]1c2ccccc2)C[C@H]1N)=O,0 M678-0462,Cn1c(C(N(CCC2)CC2c2nc(CCNC(C3CC3)=O)cs2)=O)ccc1,1 Z2597422677,CC1CC(CC2)N(Cc3csc(-c(cc4)ccc4C(O)=O)n3)C2C1,1 Y205-1663,O=C(c1ccncc1)NC1CCC(CC(CC2)CCC2NC(c2ccncc2)=O)CC1,1 Z2982767040,CC(C)n1ncc(-c2cn([C@H]3c4ncccc4CCC3)nn2)c1,1 F707-3402,O=C(C(CC1)CCN1c(cc1)nn2c1nnc2)N1CCC(Cc2ccccc2)CC1,1 Z1264436666,CC(C(NC(CCN1Cc2ccccc2)C1=O)=O)c1cccc(F)c1,1 F6523-0781,Cc1c(C(NC(CC2)CCN2c2nc(C)nc3c2CCCC3)=O)sc(-n2cccc2)n1,1 F6560-6021,Cn1nccc1-c1cc(CNC(C(C(OC)=C2)=CN(C)C2=O)=O)cnc1,1 Z1615226818,Cc1cc(C(N(C)C2CN(Cc3ccccc3)CCC2)=O)nn1-c1cccc(F)c1,1 F6562-8120,O=C(CSc(cc1)ccc1F)NCC1c(cccc2)c2OC1,1 G221-0113,COc(cc1)ccc1N1CCN(CCNC(c2nnc(-c3ccccc3)o2)c(cc2)ccc2F)CC1,0 F2593-0413,O=C(Nc(cc1)cc(Cl)c1Cl)N(C1=NCCC1)c(cc1)ccc1F,0 F874-0641,Cc(cc1)cc2c1nc(CN(CC1)CCN1C(Nc(c(OC)c1)cc(Cl)c1OC)=O)o2,0 F1897-0036,O=C(Cc(cc1)ccc1F)Nc1cccc(-c2cn(ccs3)c3n2)c1,1 F5854-2619,O=C(c(cccc1)c1F)N(CCc1cccs1)Cc1ccco1,0 Z2311485612,CC(c1nn(C)cc1)NC(N(CC12CCCCC2)C1c1ccccc1)=O,1 F6190-1527,Cc1csc(C(NCCC(c2cccs2)O)=O)c1,0 F6753-2799,O=C(C1CN(Cc2csc(C3CCCC3)n2)CCC1)N1CCOCC1,1 F3407-0322,O=C(N1Cc(cccc2)c2F)N(c2cc(F)ccc2)c(nccc2)c2S1(=O)=O,0 F5496-0186,O=C(c1c(C(F)(F)F)cccc1)N(CC1)CCC1c1nnc(-c2ccco2)s1,0 Z1657343117,O=C(CCc1nc(-c2ccco2)no1)N(CC1)CCC1C1COCC1,1 F6516-1765,O=C(c1cc(cccc2)c2s1)NCc1ccc(-c2cocc2)o1,1 F6660-0115,CC(CC1)CCN1C(c1c(COC(C2)c(cc3)ccc3F)n2nn1)=O,1 F2706-0119,O=S(c(cc1)ccc1F)(N(CCn1c2ccc1)C2c(cc1)ccc1Cl)=O,0 Z1603252934,CC(C)(C(N1CCC(CC(O)=O)CC1)=O)c(cc1)ccc1OC,0 F6512-1279,Cn(cc1C(NC2Cc3ccnn3CC2)=O)nc1OC,1 SA57-0056,O=C(Cc1cccs1)N(CC1)CCC1(C1)OCCC1Oc1ncccn1,1 F5772-6949,Cc1nc(cc(cc2)NC(C3CCN(CC(Nc4cc(C)cc(C)c4)=O)CC3)=O)c2s1,1 F6553-0968,O=C(c1csc(-c2ccccc2)n1)N(CC1)CC1c(cc1)cc2c1OCC2,1 F3205-0083,COCCCNC(CC1Nc(cccc2)c2NC1=O)=O,1 4464-0519,CC(C)(C1)OCc2c1c(C(NC(SCC(c1ccccc1)=O)=N1)=O)c1s2,0 F6556-6050,O=S(c1cccc(Cl)c1)(N(CCC1)CCN1C1CCC1)=O,0 Z4622656104,CC(C)(C)C(c1cccc(NC(c2coc(cc3)c2cc3OC)=O)c1)=O,0 V009-2492,CCCC(CN(CC1OCCC1)Cc(c(C)nn1-c2ccccc2)c1Oc(cc1)ccc1OC)O,0 K284-4734,O=C(C1CCC(CN2C(SCc(cccc3)c3F)=Nc(cccc3)c3C2=O)CC1)NCC1OCCC1,0 V028-2857,CC(C)CC(N(CC1OCCC1)Cc(n1CC(C)C)cnc1S(Cc1cc(C)ccc1)(=O)=O)=O,0 Z1929447409,CC(C)(C1)CN1C(c1cc(-c(cccc2)c2F)n[nH]1)=O,0 G115-0479,CN(C1CCCCC1)C(CC1)CCN1S(c1ccc(C(C=C2)=NNC2=O)s1)(=O)=O,1 Z2505123886,NCCCNC(NCc1noc2c1cccc2)=O,0 F6608-2357,Fc(cn1)cnc1OC(CC1)CCN1c1ncnc2cnccc12,1 F6475-2850,COCCOc1nccc(C(NCc(ccc(F)c2)c2F)=O)c1,0 Y042-7235,O=C(C(C1)CN(Cc2ccco2)C1=O)Nc(cc1)cc2c1N=CNC2=O,1 D430-2119,Cc(cc1)ccc1Nc1cc(N(CC2)CCN2C(Nc2c(C)ccc(C)c2)=O)nc(C)n1,0 P666-1558,CCN(C1=O)N=C(C)n2c1cc(S(N1CCC(Cc3ccccc3)CC1)(=O)=O)c2,0 SD22-1244,COC1(CC1)C(C1)(CN1C(c(cc1)cc(F)c1F)=O)NC(C1CCCC1)=O,1 Z2879627724,C(c1cscn1)c1nc(C2CC3(CCCC3)OCC2)no1,1 S689-0894,O=C(C(C1)CN(C(C2)CN2C(C2(CCCC2)c2ccccc2)=O)C1=O)NCC1CC1,1 Z4001647529,CN1N=C(Cn2nnc(CCC3OCCC3)c2)NC1=O,1 Z2789989721,CC(C)N(C1=O)N=Cc2c1scc2,1 Z4743809650,CC(NC[C@H](CC1)CC[C@@H]1NC(Cc1cc(OC)ccc1)=O)=O,0 Z2495083479,CCN(CC)C(CC1)CN1C(Nc(c1c2CCC1)nn2-c(cc1)ccc1F)=O,1 SA99-0780,COc1cc(C(N(CC2)CCC2N(CC2)CCC2(CC2CC2)C(N)=O)=O)cc(OC)c1,1 E596-0077,CC(c(cc1)cc2c1OCCO2)NC(CCCc(n1-c2c3scc2)nnc1N(C)C3=O)=O,1 L776-0418,Cn1nc(COCc(cc2)ccc2Cl)c(C2)c1CCN2S(c(cc1)ccc1C#N)(=O)=O,0 SA96-1275,CC(C)CNC(C1C(C2)(CN2C(CCn2cncc2)=O)CN(Cc2ccccc2)C1)=O,0 F6454-0713,O=C(C1c(cccc2)c2Oc2c1cccc2)NCC1CCN(CC(F)(F)F)CC1,1 F6554-8896,O=C(C(CC1=O)CN1c1ccccc1)N(CC1C2)C2CS1(=O)=O,1 F6089-9697,O=C(NCC1CCN(Cc2ccccc2)CC1)NC1CCOCC1,1 Z1669099276,CC(CN1CCN(C)CC1)(CC1)CCN1C(Nc(cc1)cc(F)c1F)=O,0 Z2960462502,Oc(nc(C1CC1)cc1)c1C(N1CC(CC(F)F)C1)=O,1 T499-1726,COCCn1c(nccc2)c2nc1C(CC1)CN1S(Cc1ccccc1)(=O)=O,0 Z1193362612,CN(CCOc(ccc(Cl)c1)c1Cl)C(CC1)CCN1C(c1ccccc1)=O,0 Z1272603780,Cc1nc(n(-c2ccccc2)nc2)c2c(Nc2cccc(N(CCCN3)C3=O)c2)n1,1 SC91-0472,Cc(cc1)cc2c1[nH]c(CNC([C@](C[C@H]1CC3)(CN1C3=O)c1cc(OC)ccc1)=O)n2,1 F6442-2313,O=C(Cn1ncc(-c(cc2)ccc2F)c1)N(C1)CC1S(Cc1ccco1)(=O)=O,1 F6562-7661,O=C(c(c(F)ccc1)c1F)NC(CC1)C11CCOCC1,0 Z3409581856,OCCNC(C(C(C1)(CN1C(OCc1ccccc1)=O)O)(F)F)=O,0 SA31-0206,CC(C)c1nnc(COC2)n1C2(C)C(NCCc1ccccc1)=O,1 Z2936904277,C[C@@H]([C@@H]([C@@H]1O)C(NCCc2cn(C)c3c2cccc3)=O)N(C)C1=O,1 P168-1001,CCCn1c(nccc2)c2c(C(Nc(cc2)ccc2NC(C)=O)=O)c1,1 F594-0847,CC1N(CCN(CCC(N2CCNCC2)=O)C(c2cccc(Br)c2)=O)CCCC1,0 F2373-1585,COc(ccc(Cl)c1)c1C(NCC(CN1c(cc2)cc3c2OCO3)OC1=O)=O,0 F6471-8557,Cn1c(S(C(CC2)CCN2C(c(cccn2)c2SC)=O)(=O)=O)ncc1,0 F5320-0254,Cc1cc(NC(C(C=C2)=NN(Cc(cc3)ccc3F)C2=O)=O)no1,1 Z1673150103,NC(C(Cc1ccccc1)SC(N1c(ccc(F)c2)c2F)=Nc(cccc2)c2C1=O)=O,1 F2005-0111,O=C(CSc(cc1)nnc1-c1ccncc1)Nc(cccc1)c1F,1 Z2960766816,OCC(C1CCC1)NC(c1cc(Br)cnc1C1CC1)=O,1 F6438-3800,CN(C)c1nc(CNC(CN(C(CC2)=O)C2=O)=O)nc(N2CCOCC2)n1,1 Z2295752592,Cc1nnc(C2)n1CC(C(O)=O)N2C(CCC(c1c(C)ccc(C)c1)=O)=O,1 F6279-0445,CC(CNS(c(cc1)ccc1C(OC)=O)(=O)=O)(C1CC1)O,0 F6752-2970,O=S(C1CC1)(N1CCN(Cc2noc(C3CC3)c2)CCC1)=O,1 Z1172492800,O=C(c(cc(cc1)-c2ccccc2)c1Cl)NCc1cnccc1,0 Z1500289690,O=C(c(cc1)cnc1F)N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Cl,0 Z407258112,Cc(cccc1)c1C(NC(CC1)CCN1C(C(CC1)=NN(C)C1=O)=O)=O,1 Z1994480145,CO[C@@H](CCCC1)[C@H]1NC(NCc1cc(OCC(F)(F)F)ncc1)=O,0 F6750-6308,Cn1ncc(-c2cncc(N(CC3)CCN3c3nc(C4CC4)ncc3)n2)c1,1 Z1889156093,Cn1ncc(C(N(CC2)CC(CN3)N2C3=O)=O)c1Cc1ccccc1,1 V026-6238,CC(C(NCc1ccco1)=O)N(c(cc(cc1)Cl)c1C(N1c2cc(C)ccc2)=O)C1=O,0 J500-0405,CC(C)NC(C(C1)C2(CCCC2)CN1C(c1cc(OC)cc(OC)c1)=O)=O,0 Z1117857348,Cn1c(-c2nccnc2N)nc2cccc(Cl)c12,0 T619-4633,Cn1nccc1C(N(CCCC1)C1c1nc(-c2nccnc2)no1)=O,1 F6554-9035,O=C(Cc1cscc1)N(CC1C2)C2CS1(=O)=O,1 Z2285137184,CCN(CC(C1)NC(c2cn(C)nc2C2CCCCC2)=O)C1=O,1 T159-1221,Cc1cnc(CC2CN(Cc3cccn3C)CCC2)n1Cc1ccccc1,1 F6659-2808,Cc(cc1)nnc1N(C1)CC1N(C)C(CCc(cccc1)c1F)=O,1 Z1531353964,COCC(CC1)(CCN1C(Cc(cc1)cc2c1OCC2)=O)O,0 C563-0405,OC(CCC(N(CC1)c(cc2)c1cc2S(NC1CCCCCC1)(=O)=O)=O)=O,1 F6448-1039,O=C(c1cc(cccc2)c2[nH]1)Nc1cn(CC2CCOCC2)nc1,1 V023-5933,O=C(CN(CC1OCCC1)C(c(cccc1)c1F)=O)N(CC1)C(COc(cccc2)c2F)c2c1scc2,0 F6517-3216,CCSc(cccc1)c1C(NCC(c1cc(-c2ccco2)cs1)O)=O,0 Z3799777230,CCc1nnc([C@](CC2)([C@@H]2CC2)N2C(Cc2coc3c2cccc3)=O)o1,0 Z197888146,Cc1cc(S(Nc2cc(F)cc(F)c2)(=O)=O)c(C)cc1,0 F6471-2063,O=C(c1nc2ccccc2nc1)N(C(CC1)C2)C1c1c2ncnc1,1 F6574-1263,O=C(COc(ccc(Cl)c1)c1Cl)NC(CC1)CCC1n1nccc1,1 F6658-3420,Cc1nnc(cc2)n1nc2N(CCC1)CCN1C(c(cc1)cc(F)c1OC)=O,1 Z4916289329,O=C(c1nnc(CCCC2)c2c1)NC(CC1)C11CCCCC1,1 F6247-0795,CC(c1ccco1)NC(c1c(-c2ncccc2)n(-c(cccc2)c2OC)nn1)=O,1 D512-0063,Cc(cc1)ccc1N([C@@H](CS(C1)(=O)=O)[C@@H]1N(CCc(cc1)ccc1Cl)C1)C1=O,0 SC60-0693,CC(C)(CN(C(C1)C(N2CCOC)=O)C2=O)CN1C(CCc(cccc1)c1OC)=O,0 Z2904681849,OC(C1(CNC(CC2C=CCCC2)=O)CC1)=O,1 Z3504705303,FC(CCC1(CC1)NCc1cc(-c2ccncc2)n[nH]1)(F)F,0 Z220609814,COc(cccc1)c1N1CCN(Cc2cnccc2)CC1,0 Z1662538959,C(Cc1nnc(-c2cccc3ncccc23)o1)c1nc(-c2ccco2)no1,1 SB24-0399,CN(C)C(c1cn(C(CC2)C2(CC2)CCN2C(c2ccco2)=O)nn1)=O,1 SB36-0642,Cc1c(CN(C2)[C@H](Cn3nnc(C(N4CCOCC4)=O)c3)CC2(F)F)scc1,0 Z3625438064,CN(C1)C2(CCC2)CC1NC(c1c(-n2nccc2)nccc1)=O,1 Z2949992420,CCOC(CNC(C(NC(C1)CC11COC(C)C1)=O)=O)c1ccccc1,0 F0617-0027,Cc(cccc1)c1C(NCCn1c(cccc2)c2c(SCC(Nc(ccc(F)c2)c2F)=O)c1)=O,1 K832-1422,COc(cc1)cc(C(C2)n3ncnc3NC2c(cc2)ccc2Cl)c1OC,0 SD68-0065,O=C1NCCN(CCC2)C1CN2S(c1cc(F)cc(F)c1)(=O)=O,0 M248-3685,Cc1cc(C(N2Cc(cc(cc3)C(N4CCOCC4)=O)c3OCC2)=O)no1,1 Z2328789345,CC1(CN(Cc2cc(CN3CCCCC3)ccc2)CC1)O,1 Z1182559568,CCCOc1cn(-c2ccccc2)nc1C(N(C)C(CC1)CN1C1CCN(C)CC1)=O,1 SA66-1106,Cc1nn(C)c(C(N2CC(CCc3noc(C4CCOCC4)n3)CCC2)=O)c1,0 L950-0233,O=S(c1cc(CCC2)c2cc1)(N(CCC1)C1c1nc(-c(cc2)ccc2Cl)no1)=O,1 F6465-0232,OC(CNC(CSc(cc1)ccc1F)=O)CN(C=CC=C1)C1=O,1 Z2915379465,O=C([C@@H](Cc1ccccc1)N(Cc1c2cccc1)C2=O)N(C1)CC11OCCC1,1 F6178-5690,O=C(c(s1)ccc1Cl)NCC(CC1)CCN1c1nc(cccc2)c2o1,1 F0578-0082,C(Cc1ccccc1)CNc1ncnc2c1nc[nH]2,1 Z2385056207,COC(c1nc(NC(CN(CCC2)CC2(CC(N)=O)O)=O)ccc1)=O,0 Z4988560008,Cc(cccc1)c1C(CNC(C1(C2)C2C1)=O)=O,0 D399-0666,Cc1noc(C)c1S(N(CCC1)C1c(cc1)ccc1F)(=O)=O,0 SB49-0874,NC(C(C1(CCC2)CCOCC1)N2C(Cc(cc1)ccc1Cl)=O)=O,1 F2879-3991,COc1c(CNC(C(NCCC2=CCCCC2)=O)=O)cccc1,0 SC89-0113,COc1cc(CC(N(C2)CC2(C(CN2CCCC2)CC2)S2(=O)=O)=O)cc(OC)c1,0 F6597-0701,Cc1nsc(N2CCC(COc3ncccc3C)CC2)n1,0 F3095-2928,O=C(c1ccncc1)Nc(cc1)cc2c1OCCO2,1 Z3585874290,NC(c1csc(C(NCC(CC2)CC2F)=O)c1)=O,0 S591-0298,O=C(c1ccco1)N(C1)CC1N(CC1CC1)C1CCOCC1,1 Z3290634021,Nc1nc(C(C(N(CC2)CC2c2ccccc2)=O)(F)F)cs1,1 F6279-0496,Cn(c(C(NCC(CC1)CCN1S(C)(=O)=O)=O)c1)nc1-c(cc(cc1)OC)c1OC,0 F2781-0103,COc1c(CNC(c(cc2)ccc2N(CCCC2)S2(=O)=O)=O)cccc1,1 F6448-1725,Cc1c(C(Nc2cn(C3CCOCC3)nc2)=O)c(-c(cccc2)c2Cl)no1,1 Z2041552621,CCC(N(CCC1)CC1c1nc(-c2cccc3ncccc23)no1)=O,1 SB91-0058,O=S(c(cccc1)c1Cl)(N(CCN1CCOCC1)C1CNCC1)=O,0 F6414-3703,CC(CNC(c(cccc1)c1Br)=O)(c1cc(cccc2)c2s1)O,0 K263-0466,COCCCN(C1=O)C(SCC(NC2CCCCC2)=O)=Nc2c1sc1c2cccc1,1 F5033-6884,O=C(NCC(CC1)CCN1S(C1CC1)(=O)=O)Oc1ccccc1,1 V015-8405,CCC(C)N(CC(N(CCC1)CCN1c(cc1)nnc1-c(cc1)ccc1F)=O)C(NC(C)C)=O,0 Z2967573446,CN(C)c1cc(N(CC2)CCC2C(N2CCCCC2)=O)ncn1,0 Z4613445697,Cc1n[nH]c(CN(C[C@@H]2C3)[C@@H]3CN2C(c2nccc3c2cc[nH]3)=O)n1,1 F2774-4902,COc(ccc(C(C=C1)=NN(CC(NCCc2c[nH]c3c2cccc3)=O)C1=O)c1)c1OC,1 G753-0440,Cc(cc1C)cc(NC(CN(CC2)CCN2C(c2ccco2)=O)=C2)c1C2=O,1 Z3686919706,CN(C)c1cc(N(C2)[C@@H](CNC(CCn3cccc3)=O)C[C@H]2O)ncn1,1 Z1260396291,Cc(cc1)ccc1N(CCC1NC(C2(CCOCC2)c(cc2)ccc2OC)=O)C1=O,0 G397-0443,CN(CC(NCCCN(Cc1ccco1)C1CCCC1)=O)c1nnc(N(CCC2)C2=O)s1,1 8019-7637,CCOC(C(C(c1ccccc1)N1)=C(COC(c2ccccc2)=O)N(C)C1=O)=O,1 Z1527339592,Cc(c1ncccc11)ccc1S(N(CCN1)C(c2ccc(C(F)(F)F)cc2)C1=O)(=O)=O,0 D489-0175,Cc(cc1)c(C)cc1-c(nc1NC(CNc2cccc(C(F)(F)F)c2)=C2)nn1C2=O,1 F1358-0824,COC(c1c(NC(C2c(cccc3)c3Oc3c2cccc3)=O)scc1)=O,1 F6515-3315,O=C(C1(CCCC1)c(cc1)ccc1Cl)N(CC1)CC1n1nccn1,1 S993-0652,CC(C)CN(CC(N(CC1)C2CCN1C(c1ccncc1)=O)=O)C2=O,1 F5857-2674,CC(CNC(c(cc1)ccc1C#N)=O)(c(cc1)ccc1-c1ccccc1)O,0 Z3393226424,CC(C)c(nc1C)nc(N2CC(CO)N(C)CC2)c1Br,0 F6670-5231,O=C1N(CC2CCN(Cc3nnco3)CC2)C=Nc2c1ccc(F)c2,1 Z4766188814,OCC(Cn1c2ncnc(N(CC3)CCC3n3cccc3)c2nc1)O,1 Z1127383920,Cc(cc1)ccc1-c1nc(CCNC(C2=CC=CN(C)C2=O)=O)co1,0 F6472-7093,Cc1nn2c(CCN(C3)C(CN(c(cccc4)c4O4)C4=O)=O)c3cnc2c1,1 Z2911128552,OC(c1c(CN(CC2)C(C3Cc4nccn4CC3)=O)c2ccc1)=O,1 F6294-0464,CSc(cccc1)c1C(NCc1nn(C2CCCC2)c(-c2cccs2)c1)=O,1 Z1424582083,Cc1ccc(C(CNC(c2cnc3n2cccc3)=O)N2CCCC2)o1,0 Y206-9318,Cn1c(SCC(NC2CCCCCC2)=O)nnc1-c1csc2c1cccc2,1 SB40-0578,CC(C)CN(CC1NC(C2(C)CCCCC2)=O)CC2(CCOCC2)NC1=O,1 F2774-3280,Cc1cc(NC(CN(C(C=C2)=O)N=C2c2c(C)ccc(C)c2)=O)no1,0 8009-7725,CCCNC(c1c(NC(c(cccc2)c2Cl)=O)sc2c1CCC(C)C2)=O,0 Z2080281873,CCS(c1ccc(C(C)NC(C2(CCOCC2)c2ccc(C)cc2)=O)cc1)(=O)=O,0 Z2407938460,Cc(ccc(C(N(CCC1)CC1n1nncc1)=O)c1)c1O,0 C470-0346,CC1OC(C)CN(Cc2nc(N(C)C(N(C)C3=O)=O)c3n2Cc(cccc2)c2F)C1,0 Z284256624,O=C(C(CCCC1)N1C(c1cccs1)=O)N1CCN(Cc2ncccc2)CC1,1 Z2600892190,CC1(C)OCCC1CNC(NC(CC1)CN1c(cc1)ccc1Br)=O,0 F6555-0622,O=C(CSCc1ccccc1)N(CC1)CC1n1nnc(C2CC2)c1,1 F5865-0305,Cc1nc(NCCNC(c2ncccn2)=O)nc(N(C)C)c1,1 F6451-0028,COC(CNC(c1cscc1)=O)c(cccc1)c1OC,0 Z1244409028,OCc1cccc(CNC(N2CCC3(CCCC3)CC2)=O)c1,1 F3395-0472,O=C(C(C1)OCc2c1cccc2)N(CC1)CCC1N(CC1)CCN1c1ncc(C(F)(F)F)cc1,1 Z2173838100,O=C(Cc(cc1)cc(F)c1Br)NS(c1cc(-n2nnnc2)ccc1)(=O)=O,0 Z2348781422,CC(C1)SCC1NC(N(CC1)CC1Nc(cc1)nn2c1ncc2)=O,0 F482-1183,CC1N(CCN(CCC(N2CCNCC2)=O)S(c2cccs2)(=O)=O)CCCC1,0 F5624-0147,Cc(cc1)c(C)cc1N(CC(C1)C(NCCOc2ncnc(N3CCOCC3)c2)=O)C1=O,1 Z2755767043,Cc1c(C(N(C(CC2)C3)C2c2c3ncnc2)=O)[nH]c(CCC2)c1C2=O,1 F6676-1417,Cc1nccc(OCC2CCN(CC(CC3)CCS3(=O)=O)CC2)c1,1 F6359-5361,Cc1cccc(OC(CC2)CCN2C(c(cc2)ccc2S(N2CCOCC2)(=O)=O)=O)n1,1 F3408-0028,CC(C)(C)OCC(CN1CCN(CCNC(c(ccc(Cl)c2)c2Cl)=O)CC1)O,0 Z2145935458,CCc(n(C)nc1CC)c1S(N1CC(Cc(cc2)ccc2F)(CO)CC1)(=O)=O,1 Z3415181992,CN=S(CC1)(CCC1(C1)OCCN1c1ccnc2ccccc12)=O,1 G749-0202,Cc(cc1)cc(C)c1NC(CSC(N(C1CC1)c1c2c(C)cc(C)n1)=NC2=O)=O,0 SC96-1490,O=C(CCc1nc(cccc2)c2[nH]1)N(CC1)CC2(COCC2)N(CC2CC2)C1=O,1 Z343421086,CC(CCC1)CC1N(C)C(c1coc(Br)c1)=O,0 F3379-0263,CC(c1ccccc1)Nc1cc(C)nc2cc(-c(cccc3)c3OC)nn12,0 F6475-7490,O=C(c1cc(OC2CSCC2)ncc1)N(CC1)CCC1Oc1nccnc1,1 F2805-1608,CN(c1nccc(SCC(N(CCC2)c3c2cccc3)=O)c1C(N1C)=O)C1=O,1 F6559-0490,Cn(c(C(N(CCC1)CC1N(C=Nc1c2cccc1)C2=O)=O)c1)nc1-c(cc1)ccc1F,0 SA58-1203,O=C(CCn1cncc1)N1C(CCc2noc(-c3ccccc3)n2)CCC1,1 Z811442836,Cc(c1c2)nn(C)c1ncc2C(NCc1cn(C)nc1)=O,0 F6495-5946,Cc1cc(C)nn1-c1cc(N(C2)CC2C(NCCSc2nncn2C)=O)ncn1,1 Z753585468,OC(CNC(NC1CCN(Cc(cc2)cc(F)c2F)CC1)=O)c1ccccc1,1 S556-0263,COc1cccc(CN(C2)CC2Oc(cc2)ccc2-c2noc(C3CCOCC3)n2)c1,0 F6203-0640,OCCC(CCNC(c(o1)ccc1Br)=O)c1cccs1,0 F6439-4312,CCCc1c(C(NCCn(cc2)nc2-c2ncccc2)=O)snn1,1 F5669-0174,CCc(cccc1)c1NC(N(CC1)CCN1c1ncnc(N2CCOCC2)c1)=O,0 F6294-0466,O=C(COc(cccc1)c1F)NCc1nn(C2CCCC2)c(-c2cccs2)c1,1 F6471-2224,O=C(Cn1cccc1)N(C(CC1)C2)C1c1c2ncnc1,1 SA65-1196,O=C(c1cncnc1)N1CCC(CCc2noc(C3CCOCC3)n2)CC1,1 F5467-0007,O=C(c1cccs1)NCC1(CCOCC1)c1cccs1,1 F6523-1606,Cc1cc(N(CC2)CCC2NC(c2ccco2)=O)n[nH]1,1 S904-1073,CN1Cc2nnc([C@H](C3)N(Cc4cocc4)C[C@H]3O)n2CC1,1 F6125-0434,O=C(C(C1)CN1C(c1cccs1)=O)Nc(cc1)cc(C(F)(F)F)c1F,0 F782-1499,O=C(CCC1CCCC1)Nc(cc1)cc2c1sc(NC(C1CCCCC1)=O)n2,1 S700-1618,Cc1noc(C)c1S(N(C1)CC1c1nc(CCOCc2ccccc2)no1)(=O)=O,1 Z3847822226,CCCC(N(C)C(c1ccccc1)c(cccc1)c1Br)=O,0 Z1843043384,COc(cc1)cc(COC(C(C=CC2=NN3)=CN2C3=O)=O)c1Cl,0 F6573-5432,CC(N=CN1CC(NCc2cnc(C3CC3)cc2)=O)=CC1=O,1 8012-6615,O=C1NC(SCC(N2c3cc(C(F)(F)F)ccc3)=Nc(cccc3)c3C2=O)=Nc(cc2)c1cc2Cl,1 SC96-0687,Cn1cnc(S(N(CC2)CC3(COCC3)N(Cc(cc3)ccc3F)C2=O)(=O)=O)c1,1 Z2880426755,Cc1c(-c(cc2)cc(CC3)c2NC3=O)nc(NC(C2(CC3)CCCN3C2)=O)s1,1 Z1188138142,CC(CN1CCC(CN(C)c2nccnc2)CC1)O,0 Z4497187447,O=C(C(CCC(C(F)(F)F)N1)C1=O)N(CC1)CCC1c1nccc(-c2cccc(F)c2)n1,1 E612-0900,CC(C)CC(C(N(CC1)Cc2c1cccc2)=O)N(Cc1c2cccc1)C2=O,1 F620-0022,O=C(C(c1ccccc1)c1ccccc1)NCc1nc(CN(c(cccc2)c2O2)C2=O)no1,1 F2487-0037,CC(C)(C(NCC1)=O)N1C(c(s1)ccc1Br)=O,0 F6608-1605,CN(C)C(COC1)C1Oc1nccc(C(F)(F)F)c1,0 Z1813165458,CC1Oc(cc(cc2)C(OC)=O)c2NC1,0 Z3206848369,CS(Cc1c(C(N(CC2)CC2O)=O)oc2c1cccc2)=O,0 V020-0031,CC(c1ccccc1)n1c(C(N(CC2OCCC2)C(N2c3ccccc3)=O)=O)c2nc1,0 F6773-4799,Cc1noc(C)c1CN(CC1)CCC1Oc1nc(C)cnc1C,1 F6529-3771,O=C(CN1N=CC=CC1=O)N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O,1 F6729-7591,CCn1c(C)nc(S(N(C)C(C2)CN2c(cc2)nnc2-c(cc2)ccc2F)(=O)=O)c1,1 F3156-0019,CC(C(Nc1nc(C2CCCCC2)cs1)=O)Oc1ccccc1,1 F6473-0981,O=S(c1c(C(F)(F)F)cccc1)(N(C1)CC1N(CC1)Cc2c1scc2)=O,1 Y042-1091,O=C(C(CC1=O)CN1c1n[nH]c2c1cccc2)N1Cc2nnc(C(F)(F)F)n2CC1,1 Z752100736,NC(NCC(CCC1)CN1C(NCc1c(CS(N2CCOCC2)(=O)=O)cccc1)=O)=O,1 F6349-0227,CCOC(c1c(cc(cc2)NC(C3(CCCC3)c3cccs3)=O)n2nc1)=O,1 SB39-0804,CCn1ncc(CN(CC2NC(C(C)C)=O)CC3(CCCC3)NC2=O)c1,0 G346-0006,O=C(C1CCC(CN(C(c(scc2)c2N2)=O)C2=O)CC1)NCCCN(CCC1)C1=O,1 Z4002988676,Cc(n(-c(cc1)ccc1Cl)nc1C)c1S(N(C)C1COCC1)(=O)=O,0 D627-0245,Cc(cc1)c(C)cc1-c1cc(C(NC2CCCC2)=O)nn1C(CC1)CS1(=O)=O,0 Z3584635001,NC(c1ccc(C(N(C2)CC2(C(F)(F)F)O)=O)[nH]1)=O,0 F424-0584,COc(ccc(-c(cc12)nn1C(SCC(NC1CCCC1)=O)=NNC2=O)c1)c1OC,1 SC97-0091,CC(C)N(CC1)CC(CC2)(CN2C(CCc2c[nH]c3c2cccc3)=O)NC1=O,1 F2359-0288,COc(cc1)ccc1Nc1nc(Nc(cc2)ccc2OC)nc2nccnc12,1 F6525-0198,Cn1nc(CCC2)c2c1CNC(c(cccc1)c1OC(F)(F)F)=O,0 F648-2399,CC(C)Oc1nc2cc(C)c(C)cc2nc1C(Nc1c(CCCC2)c2ccc1)=O,1 E947-0353,CC1N(CCNC(c2c(C)oc(N=CN3C)c2C3=O)=O)C(C)CCC1,1 F6524-1041,Cc1c(C)c(S(NCCN2N=Nc(cccc3)c3C2=O)(=O)=O)c(C)c(C)c1,1 Y041-4904,COc1ccc(Cc2nnc(NC(CC[C@H](C(Nc3c4cccc3)=O)NC4=O)=O)s2)cc1,1 S694-2213,Cc1cnc(COC)n1C(CC1)CN1C(c1ccnn1C)=O,1 V013-6557,O=C1NC(CN2CCCCC2)=Nc2c1c(CCCC1)c1s2,1 Z3687014258,CN(C)c1nc(cc(cc2)C(N[C@@H](CC(Cn3nccc3)C3)[C@H]3O)=O)c2[nH]1,1 Z1951411466,CCN(CC)S(c(cc1)cc(CC2)c1N2C(C(CC1)CCC1NC(C1CC1)=O)=O)(=O)=O,1 F6125-1817,CCOC(N(CC1)CCN1C(C(C1)CN1C(COc(cccc1)c1F)=O)=O)=O,1 2613-0038,OC(CC#CCN(Cc1ccccc1)Cc1ccccc1)(C1CCCC1)c1ccccc1,1 S923-0945,CCC(N(CCCC1)C1c1nnc(CC2)n1CCN2S(N(C)C)(=O)=O)=O,0 Z2091562303,NC(c1cc(OCCC(N(CC2)CC22CN(Cc3ccccc3)CC2)=O)ccc1)=O,1 Z2960756488,O=C(c1c(C2CCC2)cccc1)NCCc1noc2c1cccc2,1 C130-0278,COc(cccc1)c1-c1cc(C(F)(F)F)nc(N(C2CCCCC2)C2CCCCC2)n1,1 F6550-4492,O=C(CCc(c(F)ccc1)c1Cl)N(C1)CC1Nc1ncccn1,0 F5679-0076,Cc1ccc(c(NC(Cc2csc(-n3cccc3)n2)=O)ccc2)c2n1,1 8014-9316,CC(C)(C)c1ccc(C(CC(O)=O)NC(COc2c(C)cccc2)=O)cc1,0 Z1071970264,CC(C)(C)C(Nc1cc(-c2cccs2)n[nH]1)=O,0 Z1531377472,COCC(CC1)(CCN1C(c1csc(-c2cocc2)n1)=O)O,0 F6791-7980,CN1N=C(C(CC2)CCN2C(N=C2N3C=CC=C2)=CC3=O)N(C2CC2)C1=O,1 F6617-4357,COc(ccc(CN(CCC1)CC1c1nc(-c2cccs2)no1)c1)c1F,1 4358-3054,CC(C)(C)c(cc1)ccc1OCCCC(Nc1c(C(N)=O)c(CCCC2)c2s1)=O,0 Z1023122112,O=C(c(sc1c2ccc(C(F)(F)F)c1)c2Cl)N(CCC1)CC1c1ccn[nH]1,1 F6438-2462,CN(C)c(nc(N(C)C)nc1)c1NC(c(ccc(F)c1)c1F)=O,0 F5854-3854,Cn1c(CN(C2CC2)C(C(Oc2c3cccc2)=CC3=O)=O)ccc1,1 Z5009663397,O[C@@H](CN(C1)S(c(sc2c3cccc2)c3Cl)(=O)=O)[C@H]1c1ccccc1,1 Z1957298426,CCC(C)(C(Nc1cc(COc2ccccc2)ccc1)=O)OC,0 SC96-0629,O=C(CC1)N(Cc(cc2)ccc2F)C2(COCC2)CN1C1CCCC1,1 F5097-2650,O=C(Cc(cc1)ccc1NC(NCc1cccc2ccccc12)=O)NCC(F)(F)F,0 F6440-3601,O=C(C1(CCCC1)c1cccs1)NCc1nn(C2CCCC2)c2c1COCC2,1 F6744-5949,CCc1cc(NC(CC2)CN2C2CCOCC2)ncn1,1 F6524-3935,Cc1noc(C(CN(C2)C(Cn3cncc3)=O)C2c2ccccc2)n1,1 F6518-5058,Cn1nccc1-c1ccc(CCNC(Nc(cccc2OC)c2OC)=O)cc1,1 S988-0444,CCS(N(C[C@@H]1CN(C2)C(C3(C)CCCCC3)=O)C[C@@]12c1nc(C)no1)(=O)=O,1 F6472-8914,COC(CC1)CCN1C(C1)CN1S(c(cccc1)c1Cl)(=O)=O,0 SA43-0773,CN(CC(C1)(CN1C(c1cscn1)=O)C1)C1c1nc(-c2ccccc2)no1,1 F6660-4390,Clc(cc1)ccc1-c1n[nH]c(N2CCNCC2)c1,1 F2547-0009,CC(CC1)(CS1(=O)=O)N(C)S(c(cc1)ccc1OC)(=O)=O,0 F6244-3037,O=C(c(s1)ccc1Cl)NCC#CCN(CC1)Cc2c1cccc2,0 Z1147902448,C[C@H](c1ccccc1)NC(c1cnc(-c(cc2)cc3c2OCO3)s1)=O,1 F3406-4801,CC(C)C(Nc1c(C(NCc(cc2)cc(Cl)c2F)=O)snc1-c1ncccc1)=O,1 L662-0907,O=C(c(cc1)ccc1Oc1ccnc(-c2cccc(F)c2)n1)NC1CCCCC1,1 Z2596765606,Cc1cc2c(C(N3CCC(CCC(O)=O)CC3)=O)ncn2cc1,0 F6556-6536,Cn1cnc(S(N(CCC2)CCN2C2CSCC2)(=O)=O)c1,1 Z1665668543,CCS(N1CCC(CNc2ncnc3c2cnn3C)CC1)(=O)=O,0 Y500-4890,CCOc1ccc(C2(C)c(cc(C)cc3)c3NC(C)(C)C2)cc1,0 F6414-3619,CC(CNC(c(s1)ccc1Cl)=O)(c1cc(cccc2)c2s1)O,1 F6554-5503,O=C(Cc1cccc(C(F)(F)F)c1)N(C1)CC1C(F)F,0 F6443-1478,COC(CC1)CCN1c(cc1)ccc1C(NCCc1cccs1)=O,1 C155-0532,CC(C)CC(C(Nc(cc1)cc2c1OCCO2)=O)NC(C1CCC(C)CC1)=O,1 Y040-4374,C=1\2/c3c(OC(\C1\CCCC2)=O)cc(OC(C(NC[C@H]1CC[C@H](C(=O)O)CC1)=O)C)c(c3)Cl,1 F6360-9653,O=S(CCOc1ccccc1)(N(C1)CC1Oc1cnccc1)=O,1 Z2697324084,O=C(CC(CC1)CCC1(F)F)Nc1cnccc1,0 8015-9019,Cc(ccc1nsnc11)c1S(N1CCN(CCc2ccccc2)CC1)(=O)=O,1 Z2433824518,CC(C)C(C1(C2)CC=CC1)N2C(NC1c(cccc2)c2OC1)=O,1 Z1629794598,O=C(c1cc(CNC2)c2cc1)NC1CCN(Cc2ccccc2)CC1,1 Z813098910,O=C(NCc(cc1)ccc1F)N(CCC1)CCN1S(c1ccccc1)(=O)=O,0 SB59-0649,Cc1c(C(N(C2)CC2(CN(Cc2ccccc2)C2)C2c2nncn2C)=O)sc(C)n1,1 8019-0488,COc(cc1)ccc1-c1nc(S(c(cc2)cc3c2OCCO3)(=O)=O)c(N2CCOCC2)o1,1 F2458-0038,CN(CC(Nc1cc(C(F)(F)F)ccc1)=O)S(c1cccc2cnccc12)(=O)=O,0 8018-9498,O=C1NC(c2c[nH]nc2-c(cc2)ccc2Cl)Nc2c1c(CCCC1)c1s2,1 F6573-8928,COc(nccc1)c1C(NCc1cncc(-c2cocc2)c1)=O,1 F3040-4019,O=C(CSc1nnnn1-c1cc2ccccc2cc1)NCc1ccccc1,1 Z3091864368,CCCNC(CN(CC1)CCC1c1cnncc1)=O,1 Z1445455105,CNC(C1(CCC1)C(Nc1cc(C(O)=O)cc(Cl)c1)=O)=O,0 Z1543097864,Cc1noc(CNC(N2CCC3(CN(Cc4ccccc4)CC3)CC2)=O)n1,1 T040-0038,O=C(CCc1cc(N2CCCC2)ncc1)NCCCN1CCOCC1,1 F5823-0208,Cc1cc(C)nn1CC(CC1)CCN1C(CC(c1ccccc1)c1ccccc1)=O,1 Z2189988569,COCCC(COCC1)N1C(Nc(cc1)cnc1N(CC1)CCN1S(C)(=O)=O)=O,1 F6503-2376,Cc1nn(ccn2CCNC(c3cc(-c4ccccc4)nn3C)=O)c2c1,1 L288-0279,Cc1c(-c2noc(C(NCCCN(CCC3)c4c3cccc4)=O)n2)oc2c1cccc2,1 Z3521888776,NCCC(CC1)CC1NC(Cn1nc(cccc2)c2c1)=O,1 8019-1685,O=C(Cc1ccccc1)NC(C(F)(F)F)(C(N1CCc2ccccc2)=O)NC1=O,1 Z2864705213,C[C@H]1O[C@@H](C)CN(Cc2cn(CC(NCC3CC3)=O)nn2)C1,1 G017-1678,O=C(CCC1)Nc(cc2)c1cc2S(N(CC1)CCN1c(cc1)ccc1F)(=O)=O,0 S980-0115,C[C@H](CO)n1c(C(CC2)CCN2C(C2CCC2)=O)ncc1C,1 F6806-6789,CN1C(N2CC(C(N(CC3)CCC3(F)F)=O)OCC2)=Nc(cccc2)c2C1=O,1 F5652-2550,CC(C(Nc(cc(cc1)Cl)c1C#N)=O)N(C(C=C1)=O)N=C1c(cc1)ccc1F,0 L460-0030,CN(C1=O)C(SCc2nc(-c3ccccc3)no2)=Nc2c1sc(-c1ccccc1)c2,0 Z1692011173,N#CC(CCC1)C1NC(Nc1cn(-c(cccc2)c2Br)nc1)=O,1 F6524-1949,CSc1cc(C(N(CC2)CC2c2nocn2)=O)ccc1,0 Y043-7268,N12/C(/C3CN(Cc4c5OC(\C\6=C(/c5ccc4O)\CCC6)=O)CC(C1)C3)=C\C=C/C2=O,1 F6764-4140,Cc(n(C)nc1C)c1S(N(CC1)CCC1c1ccc(cc(cn2)Cl)c2n1)(=O)=O,1 F6773-4236,CS(c1c2nc(N(CC3)CCC3Oc3nc4ccnn4cc3)sc2ccc1)(=O)=O,1 F5834-4909,O=C(Cc(cc1)ccc1NC(NC1CC1)=O)NCc1cccs1,1 F3348-0015,Cc1nc2nc(C(F)(F)F)nn2c(N(CC2)CCN2C(c2ccccc2)c2ccccc2)c1,1 F581-0269,COc(cc1)cc(C2)c1OCC2NS(c(cc1)ccc1F)(=O)=O,0 SC66-0846,Cc1ccc(CS(N(C2)CC3(CCOCC3)C2c2nncn2CC2CC2)(=O)=O)cc1,0 F6471-3753,O=C(CSC1CCCC1)N(C1)CC1Oc1nccs1,1 F6793-5200,Cn1nc(CCC2)c2c1CN1CC(CF)CCC1,1 SB35-0010,CCn1nccc1C(N(CC(C1)(F)F)[C@@H]1c1nc(C)n[nH]1)=O,1 F6670-5989,CC(N1CC(CC2)CCN2C(c2cc3nccnc3cc2)=O)=Nc(cccc2)c2C1=O,1 Z2654349212,ClC1(C(CCNc2ncnc3c2cn[nH]3)C1)Cl,1 F6514-6711,O=C(c1cc(Oc2ncccc2)ccc1)NC(Cn1nccn1)c1ccccc1,1 S952-5356,CS(N(CC1)CCC1(CN(C1)c(cc2)cc(C(F)(F)F)c2C#N)C1C(NC1CC1)=O)(=O)=O,0 Z1521567833,CNc1c(cc(cc2)Br)c2ccn1,0 Z1647556782,CCOc(cc1)cc(C)c1NC(c1ccc(-c2cccs2)o1)=O,0 F6247-0755,CCC(c1cccs1)NC(c1c(-c2ncccc2)n(-c(cccc2)c2Cl)nn1)=O,1 Z1959634977,CCn1ncc(S(N([C@H]2[C@@H]3CN(C)CC2)c2c3cc(C)cc2)(=O)=O)c1,0 F6512-0778,O=C(c(s1)ccc1Cl)Nc1cc2ccnn2cc1,0 SA43-0957,CN(CC(C1)(CN1C(c(cc(cc1)F)c1F)=O)C1)C1c1nc(-c2cnccc2)no1,0 SA47-0162,CC1(COC(C2)(CN2C(c2c(-c(cc3)cc(OC)c3OC)ocn2)=O)C1)O,0 F6573-7793,O=C(C1Oc(cccc2)c2OC1)N(CCN1c2nccs2)CC1=O,1 P257-0330,O=C(C(CC1)CCN1c1c(N2CCCC2)ncnc1)NCc1c(C(F)(F)F)cccc1,0 F6514-2755,O=C(CSCc1ccccc1)N(C1)CC1OCC(F)(F)F,1 Z1444495955,CCC(C(O)=O)(c1ccccc1)NC(Cn1ncc(C)c1)=O,0 S223-2344,O=C(NCC(CN(C1)S(c2cccs2)(=O)=O)C11CCOCC1)N1CCCC1,1 F6808-6061,COc1cc(CN(CC2)CCC2(c2ccccc2)C#N)cc(OC)c1,0 F6764-3928,O=C(Cc(cc1)ccc1F)N(CC1)CCC1c1nc2ncccc2cc1,0 SB15-1001,COCC(N(C1CCOCC1)C(CCC1)CN1C(c1ccc(Cn2ncnc2)o1)=O)=O,1 Z2624817709,COc1cccc(NC(N2C3CCC2CC3)=O)n1,1 Z2655184150,NC(c(cc(cc1)F)c1N1CCN(CCc2ccncc2)CC1)=O,1 Z2769186432,CC(C)(C1)CC1Sc1nc(ncnc2)c2[nH]1,1 Z2002493335,O=C(C(CCC1)CC1(F)F)N1CC(c2ccccc2)OCC1,0 Z1509472028,Cc(c1c2cc(C(O)=O)[nH]1)ccc2OC,0 Z2964298481,CCc1cccnc1C(N(C1)C[C@@H](C2)[C@H]1CS2(=O)=O)=O,1 F6497-1219,Cc(cccc1)c1-c1noc(CC(CCC2)CN2C(NCc2cccs2)=O)n1,1 F6660-0351,CCC(N=C(N1Cc2ncc(C)c(OC)c2C)N2CCOCC2)=CC1=O,1 F2182-0041,Cc1c2nc(NCC3OCCC3)sc2cc(Cl)c1,0 SA87-0376,COCCN(CC(CNC(c1n[nH]c2c1cccc2)=O)OC1)C1=O,1 F2658-0159,Cc(ccc(NC(C(NCC(c1cnccc1)N(CC1)Cc2c1cccc2)=O)=O)c1)c1F,0 F6454-2257,Cc1nccc(N2CCC(CNC(c(cc3)ccc3S(N(C)C)(=O)=O)=O)CC2)c1,0 F6540-5397,Fc1c(N(C2)CC2N2CC(CCC3)C3C2)nccc1,0 5140-0427,CCC(C)(C1)OCCC1(CCNCc(cc1)cc(OC)c1OC)c(cccc1)c1OC,0 Z2060327618,OC(C(CC1)CN1c1c(ccc(C(F)(F)F)c2)c2ncc1)=O,0 F6472-0743,O=C(c1cc2c(-c3ccccc3)onc2cc1)NCCSC1CCOCC1,1 Z2437108546,COCCN(Cc1ccccc1)S(N(CCC1)C1C(O)=O)(=O)=O,0 Z2954581266,Cn(c(C(F)F)c1)nc1C(NCC1(CCCC1)C(N)=O)=O,0 F6676-4660,Cc1c(C(N(CCC2)CC2N(C)c2c(C(F)(F)F)cccn2)=O)c(C)nn1C,1 Z3687025961,CNC(C[C@@H](CN(C1)C(NCc2cc(C(F)(F)F)cnc2)=O)[C@H]1O)=O,0 K786-8926,CCN(CCCNC(c(cc1)cc(NC2=O)c1SC2N1CCCCC1)=O)c1ccccc1,1 Z1848753712,CNC(c(cc1)cnc1NC(CCOC1CCOCC1)=O)=O,1 Z2179804392,C(Cc1n[nH]cn1)CNc1c(c(-c2ccccc2)cs2)c2ncn1,1 Z3687023674,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(COCC1CC1)=O,1 Z815409056,CCOc(cccc1)c1OCC(N1CCC(CN2CCN(C)CC2)CC1)=O,0 E207-0665,Cc(cc1)cc2c1onc2CC(NCCN1CCOCC1)=O,1 Z2832191449,OCCn1ncc2c1CCCC2NC1CN(CC2CC2)CC1,1 Z2278732802,CC(C)C[C@@H](C(NCC(CO)c(cc1)ccc1Cl)=O)NC(C(C)(C)C)=O,0 S687-2112,O=C(NC1CCCCC1)N(CC1)CCC11OCCC(Cc2nc(-c3cnccc3)no2)C1,1 F5860-0026,CC(C)(C)c(cc1)ccc1C(N1CCN(CC(F)(F)F)CC1)=O,0 F5479-0266,O=C(c1csc(-c2ccccc2)n1)NCCCN1N=CC=CC1=O,1 Z1603419272,OC(CC1(CCOCC1)NC(c(cc1)cc2c1OCCCO2)=O)=O,1 Z3050538461,O=S(Cc1nocc1)(N1CCN(CC2C3C2CCC3)CC1)=O,1 Z405081308,CN(C)C(CC1)CCN1C(c1cc(CCCCC2)c2s1)=O,0 Z1676019349,Cc1nccc(N(CC2)CCN2C(c2cccc(F)c2Cl)=O)n1,0 Z2783968467,O=C(CC1C=CCC1)N(C[C@@H]1C2)[C@@H]2CN1C(CC1C=CCC1)=O,1 F6806-6764,O=C(C(C1)OCCN1c1ncnc2ncccc12)N(CC1)CCC1(F)F,1 F6474-0258,Cc(nc1)cnc1C(N(CC1)CCC1OC(C=C(C)N1C)=CC1=O)=O,1 F6516-1041,COCC(NCc1ccc(-c2cscc2)o1)=O,0 Y042-6294,C1(N[C@@H](C(Nc2c1cccc2)=O)CC(NC1CCCCC1)=O)=O,0 F2135-1526,Clc1c(CSc2ncncc2)cc2OCOc2c1,1 C464-0982,CCC(N(CC1)c(cc2)c1cc2S(NC(CC(C)C)C(NCCC(C)C)=O)(=O)=O)=O,0 F6761-7934,O=S(C1CC1)(N(CC1)C(C2)C1CN2c(cc1)ncc1F)=O,1 Z4884575468,COC(C(NS(c1cc(C#N)cc(Br)c1)(=O)=O)=O)c(cccc1)c1F,0 S740-0274,COCCCN(C([C@H](C[C@@H](C1)NC(NCc(cc2)ccc2F)=O)N1CC1)=O)S1(=O)=O,1 Z1576217184,CCc1nn(C)cc1C(N(CCC1)C1c1nc(-c2ccccc2)n[nH]1)=O,0 Z57347465,O=C(C=C1)NN(Cc2ccccc2)C1=O,0 S725-0561,CS(NC(CC1CC1)(CC1)CCN1S(c1cc(F)ccc1)(=O)=O)(=O)=O,0 F5772-7470,O=C(NC1CCCC1)Nc1nc(ccc(Br)c2)c2s1,1 C137-2127,O=C(C1CC1)N(CCc1c2)c1cc(S(NCCc(cc1)ccc1Cl)(=O)=O)c2Br,0 E002-1671,CC(CCC1)C(C)C1NC(CCC(n1ncc2c1ccc(Cl)c2)=O)=O,0 F1478-0134,CCOc(c(S(N(CC1)Cc2c1cccc2)(=O)=O)ccc1Cl)c1Cl,0 Z3546631229,CC(Cc1ccccc1)(C1)CN1C(c(nc1)cn2c1nnc2)=O,0 Z751625032,O=C(NCCc1cccs1)Nc1cn(CC2OCCC2)nc1,1 F6279-0328,O=C(c(cc1)ccc1OC(F)(F)F)N(Cc1cscc1)Cc1ccco1,0 Z1522578097,O=C(c1c(Cn2ncnc2)cccc1)NCC1(CC2)CC2CC1,1 Z759953316,Cc1cccc(N2CCN(CCO)CC2)n1,0 F6573-3638,O=C(COc1ccccc1)NCCOCCn1ncnc1,1 F6556-8778,O=C(CSCc1ccccc1)NC(c1cscc1)c1cccs1,1 Z1535263437,OC(CC1)(CCN1C(C(CCC1)CN1C(CCOc1ccccc1)=O)=O)C(F)(F)F,0 Z1588805422,CCc1cc(C(NC(C)c2cn(C)nc2C)=O)ncc1,0 Z1251160199,CC(c(cc1)ccc1NC(C(CC1)CS1(=O)=O)=O)N,1 F5096-0084,Cn1c(N2CCN(Cc3cc(OC)cc(OC)c3)CC2)ncc1,0 Z4684534735,Cc(c(C(N1CC(c2ccccc2)=CC1)=O)cnc1)c1Br,0 F6296-1189,Cn(c(CNC(c1cccs1)=O)c1)nc1-c1ccncc1,1 Z2992193238,Cc(n(Cc1ccccc1)nc1C)c1S(Nc1c(C)onc1)(=O)=O,0 Z2773677435,CCC(CCN1)(C1=O)c1nc(CC(NCc(cc2)cc(F)c2F)=O)no1,1 Z757043658,CS(CCC(NC1CCN(Cc(cc2)ccc2F)CC1)=O)(=O)=O,0 8017-2873,O=C(C(C(CCC1)N1C1c2nc3ccccc3cc2)C1C1=O)N1c1ccccc1,1 F6541-5925,CC(c1nccnc1)N(CC1)CCN1c1ccccc1,0 E234-1986,CC(C)CCNC(C(C)(Cn(c1c2)c3c2cccc3)N(Cc2cnccc2)C1=O)=O,1 F1218-0392,OCc1cn(-c2ccccc2)nc1-c1cccc(Br)c1,0 F6523-3476,Cn(c(C(NCCN(C=Nc1c2scc1)C2=O)=O)c1)nc1-c(cc1)ccc1F,1 SD64-0518,CCn1ncc(C(N[C@@H](C[C@H]2CN(Cc3ccccc3)C3)C[C@]23C(NC)=O)=O)c1,1 Z2301755733,CC(C)COc(ccc(C(C)NC([C@H](C(C)C)N)=O)c1)c1OC,0 Z2963311093,COc1c(c(CC(N2C(CC3CC3)COCC2)=O)c[nH]2)c2ccc1,1 Z773494218,Cc1cccc(CNC(c2noc(-c3ccccc3)c2)=O)n1,0 Y031-0638,CC(C)(C)CC(C)(C)NC(CSc1ccccc1)=O,0 D399-0285,COc1ccc(C(CCC2)N2S(c(cc2)cc3c2OCCO3)(=O)=O)cc1,0 F6489-0350,O=C(CCc1cccc(Cl)c1)N(CC1)CC1Oc1nnccc1,1 Z1883675035,O=C(C(CC1)CCC1C(F)(F)F)N(CCC1)CC1c1nnc2n1cccc2,1 F5777-0319,O=C(c1cccc(Cl)c1)Nc(cccc1)c1NC(NCc1cccs1)=O,0 F6276-2270,O=S(c(cc1)cc2c1OCCO2)(N(C1)CC1Oc1nc(c(F)ccc2)c2s1)=O,1 SC46-0325,CCCc1n[nH]c(C(C2)C3(CCCC3)CN2C(c2cocc2)=O)n1,1 F6502-6127,CCOC(CCC(NCCn(c(C)c1)nc1-c1ccncc1)=O)=O,0 F6479-6190,Cc1nccc(OC(CC2)CCN2C(NCc(cc2)cc(OC)c2OC)=O)n1,1 Z1270412751,CC(CNS(c(cc1)ccc1C(OC)=O)(=O)=O)(C(O)=O)O,0 8020-3664,O=C(C(C1)C(c(cc2)cc3c2OCCO3)OC1=O)NCc1cccc(C(F)(F)F)c1,0 F2964-2854,O=C(CSc1ncc(-c2ccccc2)n1-c(cc1)ccc1F)N1CCCC1,1 F2167-2528,O=C(C1CC(CC2)NC2C1)c(cc1)ccc1Br,1 D399-0332,COc1ccc(C(CCC2)N2S(c(cc(cc2)F)c2F)(=O)=O)cc1,0 SC09-0386,C[C@@H]1N(Cc2c(C)ccs2)Cc(cc(cc2)-c3ccncc3)c2OC1,1 F6257-4683,CC(CC1)CCN1c1cc(NC(NCc2cccs2)=O)ncn1,1 F6482-6418,O=C(C1CC=CCC1)NCc(cc1)cnc1-c1ccco1,1 S971-0527,Cc1cc(C(N(CC2)CCC2(CC2)C2O)=O)c(C)n1CCCOC,1 G955-0071,CCN(CC)C(Cc1c(C(O)=O)c(C)cn1C)=O,0 F5855-0453,O=C(Cn1c(cccc2)c2nc1)N(CC1)CCN1C(C(C1)C1c1ccccc1)=O,1 C741-0775,O=C(CCc(n1-c2c3cccc2)nnc1N(CCc1ccccc1)C3=O)NCCC1=CCCCC1,1 Z803231464,CCn1c(SCc2nccn2C)ncc1-c(cc1)cc2c1OCCO2,0 Z4120058768,Cc1cc(-c2noc([C@@H](CCC3)N3S(c3ccccc3)(=O)=O)n2)n[nH]1,0 Z3414324435,O=C(Cc(c(Cl)ccc1)c1Cl)N=S(CCC1)(CC11NCCC1)=O,0 2284-1583,Oc(ccc(NC(C1CCCCC1)=O)c1)c1-c1nc(cc(cc2)NC(C3CCCCC3)=O)c2o1,1 Z2262896735,C[C@@H](CNC1)[C@H]1C(Nc1cc(C(N(C)CC2)=O)c2cc1)=O,1 F6374-1724,Cc1cc(C(N2CCC(CSc(cc3)ccc3OC)CC2)=O)c(C)o1,1 F6479-4402,Cc1cc(OC(CC2)CCN2C(c2noc(-c3cccs3)c2)=O)nc(C)n1,1 Z2027423076,CCc1ccc(C(CNC(c2cc(C(F)(F)F)n[nH]2)=O)N(C)C)cc1,0 F6481-3883,CCOc(cccc1)c1NC(N(CC1)CCSC1c1ccco1)=O,0 F6212-0310,O=C(c1c2OCCCn2nc1)N(CC1)CCN1c1ncccc1,1 F2974-0113,CN(CC1)Cc2c1nc(NC(c1cc(cccc3)c3o1)=O)s2,1 F6372-0542,CCSc(cccc1)c1C(Nc1c(Cc2nc(C3CC3)no2)cccc1)=O,0 F6443-4420,O=C1OC(CC2)(CCN2S(Cc2cc(C(F)(F)F)ccc2)(=O)=O)c2c1cccc2,1 F3406-5757,CC(c1cccc(NC(CN2N=C(C(N(CC3)CCN3c3c(C)cccc3)=NC=C3)N3C2=O)=O)c1)=O,1 F6512-5940,Cn1cnc(S(N(CCC2)CCN2C(COc(ccc(Cl)c2)c2Cl)=O)(=O)=O)c1,1 F6514-6544,O=C(c(cc1)ccc1-c1cscc1)NC(Cn1nccn1)c1ccccc1,1 F6465-0047,COC(c(cc1)ccc1C(NCC(CN(C=CC=C1)C1=O)O)=O)=O,0 F6756-2688,O=C(C(C1)C2CN1c1nc(C3CC3)ns1)N(Cc1ccccc1)C2=O,1 Z3578655905,Cc(cc(n1nc2)O)nc1c2C(NC(C1)CC1Nc1ccccc1)=O,1 V018-0626,CC(C)Cn1c(S(Cc2ccccc2)(=O)=O)ncc1CN(C1CC1)C(C1CCCC1)=O,0 Z2996824768,Cc1cc(C)c(Cc2noc(C(N)=O)n2)c(C)c1,0 V022-1548,COCCN(CC(N(CC1)C(COc2cc(OC)ccc2)c2c1scc2)=O)C(COC)=O,0 D087-0568,COc(cc1)cc(NS(C(CC2)CS2(=O)=O)(=O)=O)c1OC,0 F6550-4698,COC(CCCC(N(C1)CC1Nc1ncccn1)=O)=O,1 F6454-2535,Cc1nccc(N2CCC(CNC(C(Nc3cccc(N(CCCC4)C4=O)c3)=O)=O)CC2)c1,1 F6436-1965,O=C(N(CCc1cccs1)C1CC1)N(CCN1)C1=O,1 F5857-7164,Cc1cccc(NC(NCCC(c2ccccc2)O)=O)c1,0 SB18-0183,CC(C)CC(N[C@@H](C[C@H]1c2nc(C)n[nH]2)CN1C(c1ncncc1)=O)=O,1 Z3002323163,CC(C)(C(F)(F)F)C(N(C1)CC2(CCC2)C1N)=O,0 SD07-0461,Cc1cc(C(N(CC2)CC22OCc3c(CNC(C4CCOCC4)=O)nnn3C2)=O)nn1C,0 Y205-9488,O=C(CSc1nnc(-c2ccco2)n1CC1OCCC1)Nc(cc1)ncc1Cl,1 F6523-4662,O=C(c1c2OCCOc2ccc1)NC(CC1)CCN1c1nnc(CCCC2)c2c1,1 8019-1649,O=C(c1cnccc1)NC(C(F)(F)F)(C(N1C2CCCCC2)=O)NC1=O,1 E140-0879,O=C(CSC(N1)=NC(CCN(Cc(cc2)ccc2F)C2)=C2C1=O)Nc(cc1)cc2c1OCCO2,1 Z873185242,O=S(c1cn(-c2ccccc2)nc1)(N1CCN(Cc(cc2)cc3c2OCCO3)CC1)=O,1 SB57-0328,CCS(N(C1)CC2(CN(Cc3cocc3)C2)C1c1nc(C)no1)(=O)=O,1 Z1185042723,CCOc1c(C)ccc(NC(CN2N=Cn3nccc3C2=O)=O)c1,1 F5857-0715,OC(CNC(C(Nc(cc1)ccc1OC(F)(F)F)=O)=O)(C1CC1)c1ccco1,0 F6482-6039,O=C(c1ccc(Cn2cncc2)cc1)NCc1cc(-c2ccncc2)ncc1,1 F0601-0060,CCOC(CSc1nnc(CNC(c(cccc2)c2OC)=O)n1C)=O,0 Z1271627744,Cc(cc1)ccc1C(c(cc1)cc(O2)c1N(Cc1noc(C3CC3)n1)C2=O)=O,1 F6436-1180,O=C(CCc1ccc(C(F)(F)F)cc1)Nc1cc(N(CCCC2)C2=O)ccc1,0 F6543-1597,Cc1noc(C)c1CN(CCC1)CC1c1nn(C)cc1,1 Z1005715018,Oc1c(CC(NC2CCN(Cc3ccncc3)CC2)=O)cccc1,0 V011-6351,O=C(c(cc(cc1)F)c1F)NCC(C1)Oc(cc2)c1cc2Oc1ccccc1,0 F6438-2915,COc1nc(CNC(c(cccc2)c2F)=O)nc(OC)n1,0 Z2791344614,C[C@@](CNC1)(C2)[C@]1(C)CN2C(c(cc1)ccc1N(CC1)CCC1O)=O,1 S421-1138,O=C(CC(CC1)CN1C(NCc1ccccc1)=O)NCc1ccncc1,1 F6539-2223,CN(C)S(N1CCC(CNC(c2csc(-c3ccccc3)n2)=O)CC1)(=O)=O,1 G932-0770,COc1cccc(Nc2c(cnn3-c4ccccc4)c3nc(N3CCOCC3)n2)c1,0 Z2781259074,CCCSCC(N[C@@H]1[C@@H](c(cc2)cc(F)c2Cl)OCC1)=O,0 S423-0683,CCOC1CC(CC2)(CCN2C(c2nccc3ccccc23)=O)OCC1,0 Z2963663220,OC[C@](C1)(C[C@@H]1NC(C(C=C(C1CC1)N1)=CC1=O)=O)c1ccccc1,1 G861-0099,Cc1cc(C(CN(c(cccc2)c2-c2nc(-c3cc(OC)cc(OC)c3)nn22)C2=O)=O)c(C)cc1,0 Z2961800482,Cc1noc(C(NCCc2cccc(Br)c2C)=O)n1,1 F6247-0790,Cn1c(cccc2)c2nc1CNC(c1c(-c2ncccc2)n(-c(cccc2)c2OC)nn1)=O,1 F6564-7860,CC(C(NC(CC1)CS1(=O)=O)=O)N1N=C(CCC2)C2=CC1=O,1 F3316-0392,CC(CC1)CCN1S(Nc1cc(C)cc(C)c1)(=O)=O,0 F2199-0586,Cc(cc1)ccc1SCCN(C(c1c2cccc1)=O)C2=O,1 SD07-0910,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(COc2ccccc2)=O)C2)n2nn1)=O,0 F6514-2860,CN(C(C=C1)=O)N=C1C(N(C1)CC1OCC(F)(F)F)=O,1 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F6523-0079,O=C(CCC(NC(CC1)CCN1c1ncnc(C(F)(F)F)c1)=O)c(cc1)ccc1Cl,1 F5528-1049,Cc(cc1)cc(CCC2)c1N2C(C(CC1)CCN1c(cc1)nnc1-c1c(C)cccc1)=O,1 F6724-5518,C(CSC1)C1N(CCC1)CCN1c1ncnc2ncccc12,1 D470-2253,O=S([C@@H](CS(C1)(=O)=O)[C@H]1NC1CCCCCC1)(c(cc1)ccc1Cl)=O,0 F6675-7368,Cc1c(C(NC(C2)CN2c2ncccc2)=O)sc(C)n1,1 Z4512917284,CCc1ccc(CC(Nc2cccc(-n3nnc(C(O)=O)c3)c2)=O)cc1,1 Z2174348191,CC1(C)c(cc(cc2)C(NS(CC3CCC3)(=O)=O)=O)c2OC1,1 SB47-0930,CC(C)NC(N(C[C@@H]1CN(C2)C(Cc3cccc(Cl)c3)=O)C[C@@]12c1nc(C)n[nH]1)=O,1 F6796-4325,CCc1ncnc(OCC(CC2)CCN2c(c2c3)ncnc2ccc3F)c1F,1 F6488-1750,COc1cccc2c1oc(C(N(CC1)CC1Oc1nc(OC)cnc1)=O)c2,1 F1016-0347,Cc1cc(NC(CSCc2ccco2)=O)c(C)cc1,0 E643-0127,CCC(C(N1CCCCCC1)=O)Sc([nH]1)nc2c1nccc2,1 SC58-0175,Cc1cnc(C2C3(CN(Cc(cc(cc4)Br)c4F)C3)CN(C)C2)o1,0 F6485-1984,CCCc1c(C(NC(CC2)CCC2Oc2nc(C)cc(C)n2)=O)snn1,1 F6656-3591,CN(C=CC(CN1CCC(COc2nnc(CCCC3)c3c2)CC1)=C1)C1=O,1 F2416-1122,COC(N(CC1)Cc2c1ccc(NC(c(cc1)ccc1S(N1CCCC1)(=O)=O)=O)c2)=O,1 Z1738584708,OC(CN(CC1)CCC1NS(c1cc(OC(F)(F)F)ccc1)(=O)=O)=O,0 F5854-4055,O=C(c1cccs1)N(Cc1cscc1)C1CC1,1 Z1393207505,CC(C)CC(c1nc(-c2cscc2)no1)N(CCCC1)C1=O,1 SB16-0325,COc1cccc(CN(CC2)C[C@@H]3[C@H]2N(Cc2ccccc2)CCOC3)n1,1 Z3045027265,CC(CNCc1nn(CCCO2)c2c1)(C(F)F)O,1 Z1944277762,CC(C)(C)CC(NCc1ncccc1O)=O,0 Z2873856375,NC(CCNC(N(C1)CN(CCC(F)(F)F)C1=O)=O)Cc1ccccc1,1 Z2489641075,CC(C(N([C@@H](C)CC1)[C@@H]1C(O)=O)=O)c1cc(OC)ccc1,0 F2517-0869,O=C(C1(CCOCC1)c1ccccc1)Nc1nnc(-c(cc2)ccc2OC(F)(F)F)o1,1 S582-0351,Cc1nn(C)c(C(NCC(Cn2c3ccc2)N(CCOC)C3=O)=O)c1,0 Z2475444932,Cc1c(NC(NC2CC3(CCC3)C2)=O)nnn1C,1 F6541-7639,CN1CCN(Cc2cccc(OC)c2Cl)CC1,0 Z2949801481,CC(C)Cc1ncc(C(NC(C)c2nnc3n2CCC3)=O)s1,0 L065-0044,O=C(c1nnc(C(CCC2)CN2C(Nc(cc(cc2)F)c2F)=O)s1)Nc(cc1)ccc1F,1 F6559-0601,O=C1N(C(CCC2)CN2S(c(cc2)ccc2-n2nccc2)(=O)=O)C=Nc2c1cccc2,1 Z1684086002,COc1cc(OCC(C2)c3nc(-c4cc(-c5ncn[nH]5)ccc4)no3)c2cc1,1 Z1185597016,NC(CN(Cc1ccccc1)C(c1c[nH]c2c1cccn2)=O)=O,0 Z1738566014,Cc1c(C)sc(S(NC(CC(F)(F)F)C(O)=O)(=O)=O)c1,0 D393-0397,Cc1nc2cc(-c(cccc3)c3OC)nn2c(N2CCN(C/C=C/c3ccccc3)CC2)c1,0 V012-5474,CCN(C(CN1CCC(NCC(C)C)=O)=C(C(c2ccc(C(F)(F)F)cc2)N2)C1=O)C2=O,0 F6574-0405,O=C(NCc1cccc2ccccc12)NCc1nccnc1-c1cocc1,1 F6782-4459,O=C(C=C1)N(CC2COCCC2)N=C1c(cc1)ccc1F,1 F6476-2086,O=C(c(cc1)ccc1N1CCOCC1)N(CC1)CC1Oc(cc1)ncc1Br,1 F6724-0053,Cn1c(ncnc2NCC(c3cccs3)N3CCOCC3)c2nc1,1 SD25-0530,O=C(CCC(CN(C1)C(c2nc3ccccc3cc2)=O)C11CCCCC1)N1CCOCC1,1 F6516-0991,O=C(NCc1ccc(-c2ccco2)o1)NC1CCCC1,1 F6523-1946,O=C(C1(CCCC1)c1cccs1)NC(CC1)CCN1c1n[nH]c(-c2cccs2)c1,1 F6676-4754,CN(C(CCC1)CN1C(C(C=C1)=NN(C)C1=O)=O)c1c(C(F)(F)F)cccn1,1 F5835-0774,O=C(c1ccco1)Nc1cc(-c2n[nH]cc2)ccc1,1 F2783-1015,CC(C)NC(C(Nc1cccc(N(CCC2)C2=O)c1)=O)=O,0 F6557-0135,O=C(c1cc(C(F)(F)F)ccc1)N(CCC1c2cccs2)CCS1(=O)=O,0 F2261-0245,CC(C)(COc(cc(cc1)NC(c2c(C)onc2-c(cccc2)c2Cl)=O)c1N1CC=C)C1=O,1 Z3371092383,O=C(c1cc(NC(NC2)=O)c2cc1)NCCCc1c[nH]nc1,1 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Z2610943865,OC(c(ccc(Br)c1)c1S(NC1C=CCC1)(=O)=O)=O,0 F6510-2229,Cc1c(C(NCCN(c(cc(cc2)F)c2N2C)S2(=O)=O)=O)c(C)nn1C,1 F0554-0035,O=C(CSc1cn(CCNC(c2ccccc2)=O)c2c1cccc2)Nc(cc1)cc2c1OCCO2,0 F5882-0185,COC(N1CCN(CCNC(C2(CCCC2)c(cc2)ccc2Cl)=O)CC1)=O,1 Z4453055547,Cc(cc1)cc(C(N)=O)c1NC(c(c1c2CCC1)nn2-c(cc1)cc(F)c1F)=O,0 Z289523872,CC(N(CC1c2ccccc2)Cc2c1cccc2)=O,0 S594-0314,CCn1ncc(S(N(CC2)CCC2c2noc(COCc3ccccc3)n2)(=O)=O)c1,1 F6619-5245,Cc1cc(N2CCN(Cc(cc3)ccc3OC(F)(F)F)CC2)nc(N2CCOCC2)n1,0 Z1900573012,CN(C(CC1)CCN1S(C)(=O)=O)c1nc(c(F)ccc2)c2o1,0 SC89-0363,O=C(Cc(cc1)ccc1Cl)N(C1)CC1(C(CN1CCOCC1)CC1)S1(=O)=O,0 3807-1302,CC(C)CCSC(N1Cc2ccccc2)=Nc(sc2c3CC(C)(C)OC2)c3C1=O,0 F6261-1748,Cc1c(CNC(C2Oc(cccc3)c3OC2)=O)sc(-c2c(C)cccc2)n1,1 Z1021875118,Cc1c(-c2cccc(Cl)c2)sc(C(N(CC2)CCN2c2ncccn2)=O)c1,0 Z2760951630,Cc1nn(CCN(C2)c3c4ncn(CC(CO)O)c4ncn3)c2n1,1 Z612467862,CCCCC(NS(c1c(C)onc1C)(=O)=O)=O,0 Z3831897223,CCc1ncnc(N(CC2)CC(NC(N3)=O)=C2C3=O)c1F,0 F6609-5875,O=C(c1cn(Cc(cc2)ccc2F)nn1)N1CCOCC1,1 Z2498596603,O=C(CCCc(cc1)ccc1F)NCCC(NO1)=NC1=O,1 F6549-6287,O=C(Cc1cccs1)N1CC(Cn2nncc2)C1,1 Z2408328469,Cc1cn(-c(c(F)ccc2)c2F)nc1C(NC1CC(C2)C2C1)=O,1 F2189-0086,CC1(C)N=C(c(cc2)ccc2Br)OC1,1 Z2368943556,Cn1c(ccc(Cl)c2)c2nc1CN1CC(CCC(O)=O)CCC1,0 F6512-7293,Cn1ncc(S(N(CCC2)CCN2S(CCC(F)(F)F)(=O)=O)(=O)=O)c1,0 F5078-0439,CCCOc(cc1)nnc1N(CC1)CCN1C(C(Oc1c2cccc1)=CC2=O)=O,1 Z1069643278,O=C(C1CN(CC(F)(F)F)CCC1)N1CC(c2cccc(F)c2)OCC1,1 C301-9280,CN(c(c(N1C)c2)cc(NC(c(c(F)ccc3)c3F)=O)c2Sc(cc2)ccc2Cl)C1=O,0 D011-0954,CCOc(cccc1)c1N(CC(C1)c2nc(cccc3)c3n2Cc2c(C)ccc(C)c2)C1=O,0 Z1536791442,CNC(NCC(N(CC1)CCC1c1nc(-c2ccccc2)n[nH]1)=O)=O,1 M034-4797,O=C(NC1CCCC1)N(CC1)CCN1c1ncccc1-c1nnc(C2CC2)o1,1 Z1974204934,OC(CN(Cc1nnc2n1CCOC2)Cc1ccccc1)c1ccco1,1 F6549-2091,O=C(Cc1cccs1)N(C(CC1)C2)C1CC2n1nccc1,1 Z2365392614,NCCCCNC(C(NC1c(cc(cc2)Cl)c2OC1)=O)=O,0 S570-0133,O=C(CCc1ccccc1)NCC1(CCC(N2)=O)C2=CCCC1,0 Z3476996158,CN(c1c(C(N2C)=O)nc(CCC(NCc(cc3)ccc3C(O)=O)=O)c(O)n1)C2=O,1 S582-0053,CN(C(CNS(Cc1ccccc1)(=O)=O)Cn1c2ccc1)C2=O,1 D145-0134,COc(cc1)ccc1N(C(c(cc1)ccc1Cl)c(cc1OC)c(C2)cc1OC)C2=O,1 Z2766247520,CCc1nn(C)cc1C(NC[C@@H](CC1)O[C@@H]1c1ncn[nH]1)=O,0 Z2982192145,Cc1c(CC(C(N[C@@H](CCN2)C2=O)=O)(F)F)c(cccc2)c2[nH]1,0 SB15-1010,Cc1noc(C)c1C(N(CCC1)CC1N(C1CCOCC1)C(COC)=O)=O,1 F5476-0637,CN(C)C(CNC(Nc1cccs1)=O)c1cn(C)c2c1cccc2,1 Z2595661468,Cc1c(C)nc(cc(cc2)C(N[C@H]3[C@@H](C(O)=O)OCC3)=O)c2n1,1 8188-0910,O=C(c(cc1)ccc1C1=Cc(cccc2)c2OC1=O)Nc(cccc1)c1-c1nc(cccc2)c2s1,1 Z2067412501,CN(C)C(CCNC(C(CC1)CCN1c(ccc(C#N)c1)c1F)=O)=O,0 Z2395531629,O=C(c(cc1)ccc1OCc1ccccc1)N1CCC2(CCNCC2)CC1,1 F6660-4245,CCOC(c1cc(C(OCC)=O)nn1CC(c(cc1)ccc1Cl)=O)=O,1 Z2894253391,CC(C)(c1cn(CCOC2COCC2)nn1)O,1 Z2761750979,CCCN(C)C(N(C[C@H]1C2CC2)C[C@H]1c1nc(C)n[nH]1)=O,0 Z511658670,CCOc(cccc1)c1C(N(CC1)CCN1C(C(C1)CN(Cc2ccc(C)cc2)C1=O)=O)=O,1 F6726-5644,CN(Cc1c[nH]cn1)C(C1)CN1c(ncnc1-c(cc2)ccc2F)c1F,1 F6279-0078,Cn(c(C(NCCc1csc(-c(cc2)ccc2F)n1)=O)c1)nc1-c(cc1)ccc1F,1 F6562-0302,CC(C)Oc(cc1)ncc1C(NCc1cn(-c2cscc2)nn1)=O,1 E948-1250,Cc1c(C(Nc(ccc(F)c2)c2F)=O)c2c(N3CCOCC3)nc(C)nc2o1,0 Z1676030408,CCC(CC1CCCC1)C(N(CC1)CCN1c1nc(C)ncc1)=O,1 Z2482958850,Cc1c(C)sc(C2CN(CC3(CC(O)=O)CC3)CCC2)n1,1 Z2699705199,O=S(C1CC1)(N(CCC1)CCN1c1nc(cccc2F)c2o1)=O,1 Z1412161264,CC(C(N1)=O)(c(cc2)ccc2C(Nc2cc(-c3nc(C)co3)ccc2)=O)NC1=O,0 SA93-0439,NC(C(CC1CC1)(CCC1)CN1C(CCN(c(cccc1)c1O1)C1=O)=O)=O,1 F2145-0351,CCOC(Cc1csc(NC(C2CC2)=O)n1)=O,0 F2744-1368,O=C(C(C=C1)=CN(Cc(cccc2)c2F)C1=O)Nc(cc(C(F)(F)F)cc1)c1Cl,0 Z2959515056,CCNC(CC(CCCC1)N1C(c1c(CCOC2)c2ccc1)=O)=O,0 F6559-0433,O=C(c1cc(-c2ccco2)n[nH]1)N(CCC1)CC1N(C=Nc1c2cccc1)C2=O,1 SA01-1080,Cc1nn(CC(N(CC2)CC2c(nc(N(C)C)nc2)c2C(NCCOC)=O)=O)cc1,0 F6089-7347,Cc(cc(cc1)NC(C(NCC2(CCCC2)c(cc2)ccc2OC)=O)=O)c1N(CCC1)C1=O,1 S903-0878,CCc(cccc1)c1S(N1Cc2nnc(C(CC3)CCN3S(C(C)C)(=O)=O)n2CC1)(=O)=O,0 CM3701-2393,COc(ccc(NC(NC(CC1)CN1c1nncc(N2CCCC2)c1)=O)c1)c1Cl,0 Z1940022914,CC1(CCN(CC(Nc2nc(CCC3)c3s2)=O)CCC1)O,1 F5791-0746,O=C(C(CC1=O)CN1c1cccc(Br)c1)NCCN(C(C=C1)=O)N=C1c1ccco1,1 F5871-0667,CC(C)Sc1ccc(CC(NCCN(CC2)CCN2S(C)(=O)=O)=O)cc1,0 Z3357571943,CCN(CC1)C1C(N[C@@H](Cc(cc1)ccc1O)C(OC(C)(C)C)=O)=O,1 Z2493666573,O=C(CN(CC1)CC1c1ccncc1)NC1(CCC1)c1ccccc1,1 Z2290125476,CC(CCC1)(CN1C(NC(C1=O)=C(C)N(C)N1c1ccccc1)=O)F,0 F5882-5182,O=C(Cn1c(cccc2)c2nc1)N(CC1)CCN1S(C1CC1)(=O)=O,1 F367-0166,Cc1cccc(NC(CSc(n2-c3c4cccc3)nnc2N(Cc2ccccc2)C4=O)=O)c1,0 SA92-0771,O=S(c1cc(CCCC2)c2cc1)(N(CCC1)CC1(c1nc(C2CC2)no1)F)=O,1 F6476-7421,Cc(cc1)cnc1OC(CC1)CN1S(C1CC1)(=O)=O,1 F6418-0181,CCOc1c(C(NCc2ccc(C(c3cccs3)O)s2)=O)c2ccccc2cc1,1 Z4135993722,O=C(CCCC1=O)N1c(cc1)ccc1NS(c(scc1)c1Cl)(=O)=O,1 F6796-8873,CC(C)c1noc(CN(C2)CC(C3)C2CN3c2ncccc2C#N)n1,0 Z1617947833,COCc1c(C(N(CC2)CCN2C(C2OCCC2)=O)=O)scc1,0 F1501-0118,Cc1c(C)c(Cn2c(cccc3)c3nc2)c(C)c(C)c1,0 V021-1406,CN(CC1)CCN1c1nc(Oc(ccc(F)c2)c2F)c(CN(CC2)S(c(cc3)ccc3F)(=O)=O)c2n1,0 F6442-0803,COc(cc1)ccc1S(C(C1)CN1C(Cn1c(cccc2)c2nc1)=O)(=O)=O,1 Z3687013230,Cc(c1c2)c[nH]c1ncc2C(N[C@@H](CC(Cn1nccc1)C1)[C@H]1O)=O,0 Z2000803530,CCOc1cccc(S(N(CCN2C)CC2=O)(=O)=O)c1,0 P807-0449,O=C(c1n[nH]c2c1CCCC2)NCC(CC1)CCN1c1cc(-c(cc2)ccc2F)n[nH]1,1 V007-8398,CC(CC1)CCC1C(N(CC1)Cc2c1c(C(N(C1CCCCC1)C(N1)=O)=O)c1s2)=O,1 V027-1509,CCOc1cccc(-c(cc2)cn3c2nc(-c2ccccc2)c3CCC(NC2CC2)=O)c1,1 G423-0029,O=C(CCCc1nnc2n1C=CN(c1cccc(F)c1)C2=O)NCCc1c[nH]c2c1cccc2,0 Z1730022548,CNC(c(cc1)ccc1S(Nc(c1ncccc11)ccc1OC(F)F)(=O)=O)=O,0 F5729-0880,Cc(c(C)c1)cc2c1ncn2CC(CC1)CCN1C(c1cscc1)=O,1 G118-0830,CC(c1cccn1-c1c(C2)cccc1)N2C(Nc1cc(OC)ccc1)=O,0 Z3382957696,C[C@@H](c(cc1)cc(C(N(CCC2)CCC2N(C)Cc2ccccc2)=O)c1OC)N,1 F6521-8461,Cn1nnc(C(NCC(CCC2)(c(cc3)c2cc3OC)O)=O)c1,1 Z2790701726,COCc1nc(CCN(C2)C(C(O)=O)c3cscc3)c2cn1,0 S620-0343,Cc1n[nH]c([C@H](CCN(Cc(cc2)cc3c2[nH]cc3)C2)[C@H]2N(C)C)n1,1 Z942484730,CC(C)n1nccc1NC(C(C)c1c(C)n(C)nc1C)=O,0 SC02-0272,Cc1cccc(NC(NC(CCOC)(CC2)CN2C(NCCc2ccccc2)=O)=O)c1,1 F1492-0026,O=C(C1OCCC1)N(C(C1)c2ccco2)N=C1c(cc1)ccc1Br,1 F6190-0196,COc(cc1)cc(C(NCCC(C2CC2)O)=O)c1Br,0 F5857-3407,CC(CNC(Nc(cc1)cc(Cl)c1Cl)=O)(c(cc1)cc2c1OCO2)O,1 F5856-0176,O=C(c1csc(-n2cccc2)n1)N(CC1)CCN1c1ncccn1,1 SD31-0093,O=C(c1nn(CCNC(NC2CCCC2)=O)c2c1COCC2)N1CCCC1,1 SA73-0789,Cc1nc(C(CC2CC2)(CC2)CCN2C(Nc(cc(cc2)OC)c2OC)=O)no1,0 Z1030590544,CN(c(ccc(C(N(CC1)CCC1c1nccs1)=O)c1)c1N1)C1=O,1 F0696-4870,O=C(c(cc1)nnc1N1CCOCC1)Nc(cc1)ccc1OC(F)(F)F,0 Z1223859502,CC(C)(C1)OCCCN1C(Nc(cccc1)c1N1CCCC1)=O,1 Z1031158336,COCCS(NCc1noc(-c2ccccc2)c1)(=O)=O,0 Z2686128357,CCC(C)N(CCC(N1CCCN2CCCCC2)=O)C1=O,1 V030-9286,CC(C)CNC(C(CC1)CCN1c1nc(cccc2)c2n1CC=C)=O,0 Z3290438067,O=S(C(CC1)=Cc2c1cccc2)(NCC1=NOCC1)=O,1 G802-0237,CCC(C(Nc(cc(cc1)F)c1F)=O)Sc1nnc2n1C=CN(c(cccc1)c1OC)C2=O,0 F6481-3480,O=C(c1ccc(Cn2cncc2)cc1)N(CC1)CCSC1c1ccco1,1 Z1362218028,Cc(cc1NC(c(c(Cl)c2)cc(F)c2Cl)=O)nn1-c1nc(C)nc(C)c1,1 F0613-0160,Cc1cc(cccc2)c2n1CCNC(Cc(cc1)cc(OC)c1OC)=O,1 SB18-1146,CC(C)CC(N[C@@H](C[C@H]1c2nc(C)n[nH]2)CN1C(c1ccc(C)s1)=O)=O,1 F3406-6656,COc(ccc(CN(c1c2cccc1)N=C(C(N1CCOCC1)=O)S2(=O)=O)c1)c1F,1 C430-5098,Cc(cccc1)c1N(C(c1c2cccc1)Nc(cc1)ncc1Br)C2=O,1 Z3709602679,Cc(cccc1CC2)c1N2C(c(cc1)ccc1Nc1ncccn1)=O,1 F6525-4860,Cc(n(CCNC(C1(CCOCC1)c1ccccc1)=O)nc1C)c1-c1ccccc1,1 Z2483451480,Cc1cc(CN(C[C@H]2C(O)=O)C[C@H]2c(cc2)ccc2Br)ncc1,0 S613-1085,O=C(NCCc1ccccc1)N(CCC1)C1c1nc(CCOCC2CCCC2)no1,1 F6445-7206,CN(C=C(C(NCCc1c[nH]c2c1cccc2)=O)C(OC)=C1)C1=O,1 D087-0489,COc(ccc(CCNS(C(CC1)CS1(=O)=O)(=O)=O)c1)c1OC,1 S649-0877,O=C(c(cc1)cc2c1[nH]cc2)N(CC1)CCC1N(C1)C2(CCOCC2)C1OCC1CC1,1 SA70-0485,Cc1c(COC)c(C(N(CCC2)CC2(CCOC)c2noc(C)n2)=O)no1,1 Z3141452129,N[C@@](CC1)(C2)[C@@H]1CN2C(c1c(C(F)(F)F)cn[nH]1)=O,0 F3406-5517,CCOCCCNC(CCc1nnc(cc2)n1nc2-c1cc(C)c(C)cc1)=O,0 Z4767388046,O=C(c(cc1)ncc1F)Nc(cc1)ccc1-c1nc(cccc2)c2s1,0 Z729035950,Cc1n[nH]c(C(NCC2(CCCCC2)N2CCOCC2)=O)c1,1 S836-2140,Cc1c(CNC([C@@H](C2)[C@@H](COC)CN2c2nccnc2)=O)cn[nH]1,1 Z1444191043,CC(C)(C)C(CNC(c1cc(C(O)=O)ncc1)=O)OC,0 F1201-0020,O=C(c(o1)ccc1Br)OCN(C(c1c2cccc1)=O)C2=O,1 F0696-3968,COc(cc1)ccc1-c1nc(CNC(c(cc2)nnc2N2CCCC2)=O)cs1,1 Z3000710488,CN(C1(CC1)C(F)(F)F)C(c1cnc(-c2ncccn2)s1)=O,1 S592-0443,Cc(cc1)ccc1OCc1nc(C(CC2)CN2C(C2(CC2)c2ccccc2)=O)no1,0 E591-0501,CCC1N(Cc2ccc(CNC(CCc3nnc(cc4)n3nc4N3CCN(C)CC3)=O)o2)CCCC1,1 Z4076386273,CC(c1cn(-c2ccccc2)nn1)NC([C@@H]1CN(C)CC1)=O,1 Z1576328509,CCC(C)(COCC1)N1C(c1cc(-n2nnnc2)ccc1)=O,1 S811-0147,CCn1ncc(S(N(CC2)CCC2OCc2noc(C3OCCC3)n2)(=O)=O)c1,1 F6822-4716,Cc1nc(CN(C)Cc(ccc(Cl)c2)c2Cl)no1,1 F3382-7244,CC(C)Cc(cc1)ccc1S(Cc1nc(-c(cccc2)c2Cl)no1)(=O)=O,0 F3227-1677,COc(cccc1)c1OCC(Nc(cc1)cc(Oc2c3cccc2)c1C3=O)=O,0 F5854-2577,O=C(NCc(cc1)ccc1F)N(Cc1cscc1)Cc1ccco1,1 F6515-2069,COc(ccc(Cl)c1)c1S(NCc1c(-c2ccco2)nccc1)(=O)=O,0 V011-3442,O=C(C1CCC1)N(CC1)CCN1c1nc(-c(cc2)ccc2N2CCOCC2)ccn1,1 F6734-1399,Fc(cc1)cnc1N1CC(CN(Cc(c(F)ccc2)c2Cl)C2)C2C1,0 Z284983824,Cc1c(CC(N(C)Cc2c(C(F)(F)F)cccc2)=O)c(C)n[nH]1,0 F6274-0144,COc1cccc2c1nc(N(C1)CC1OC(c(ccc(F)c1)c1Cl)=O)s2,0 J093-0696,O=C(c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2n1)N1CCOCC1,1 F6783-8399,CC(C)C(N=C(NC1=O)N(CC2)CCN2C(COc2ccccc2)=O)=C1F,1 Z785227810,Cc1nc(n(C)nc2)c2c(NCC2(CCCC2)O)n1,0 Y501-3557,CCC(C(Nc1cn(Cc2cn(CC)nc2)nc1)=O)n1nc(C(F)(F)F)c2c1CCC2,0 F2751-0216,COc1cccc(C(NCCS(NCC2OCCC2)(=O)=O)=O)c1,1 F6204-2769,O=S(CCC(F)(F)F)(NC1(CCCC1)c1cccs1)=O,0 SA96-1399,O=C(C1C(C2)(CN2C(NC2CCCCC2)=O)CN(Cc2ccccc2)C1)NCC1CC1,1 Z2845622198,CCC(C)(C)NC(C(C)n1nnc(-c2cc(Cl)cnc2)c1)=O,0 F6812-1648,COc1nc(N(CC2)CCN2c2nc(-c3cnccc3)ccn2)ncc1,0 Z1764380868,O=S(c1cc(C(F)F)ccc1)(Nc1cc(C(F)F)ccc1)=O,0 C548-3105,COc(cc1)cc2c1nc(NC(C(CCC1)N1S(c1cccc3nsnc13)(=O)=O)=O)s2,0 V024-0085,CC(C)CC(N(CC1)C(c2ccccc2)c2c1ccc(OCc1nc(C(NC3CC3)=O)cs1)c2)=O,1 Z1821398416,Cc1c(C(NCC2(CC3)CC3CC2)=O)snn1,1 F6469-2997,Cc1nc(-c(cccc2)c2NC(Nc(cccc2OC)c2OC)=O)cs1,0 SD54-0126,CN(CCOC)C(C(CC1)CCc2c1c(OCC1CC1)nc(-c1ccccc1)n2)=O,0 SB55-0397,CC(C)c1nc([C@@](CCC2)(C3)[C@@H]2CN3S(C2CC2)(=O)=O)no1,1 F0378-0069,O=C(c(cccc1)c1C1=O)N1c1nc(-c2ccccc2)cs1,1 Z1819476754,O=C(Cc1n[nH]c2c1CCCC2)NC(CCCN1Cc(ccc(F)c2)c2F)C1=O,1 P223-1150,CCn1ncc(C(N(CCC2)CC2c2nn(CCCNC3=O)c3c2)=O)c1,0 Z1838110589,CC(c1cccc(S(N)(=O)=O)c1)NC(C1(CCOCC1)c1ccc(C)cc1)=O,0 V006-0669,COc1cccc(COC(CN(CC2)CCN2S(Cc2ccccc2)(=O)=O)c(cc2)ccc2Cl)c1,0 Z1779026028,CC(C1)OCCN1S(c1ccco1)(=O)=O,0 F6619-2069,CC(CC1)(C1NC(c1cn(C)c2c1cccc2)=O)O,0 E782-0773,COc(ccc(CC(N1)=Nc(ccc(S(N2CCOCC2)(=O)=O)c2)c2S1(=O)=O)c1)c1OC,1 F2372-0251,COc(ccc(CNC(NCC(CC1=O)CN1c(cc1)ccc1Cl)=O)c1)c1OC,1 Z1445130756,CCC(Nc(cc1)c(C)cc1OCC(O)=O)=O,0 F2393-0031,CN(C)C(CNS(c(cc1)cc2c1OCCO2)(=O)=O)c1cscc1,1 F6488-2342,CN(C)c1cncc(OC(CC2)CN2C(c(cc2)cc3c2ncs3)=O)n1,1 Z1627445377,CCC(C1)OCCC1C(N(CCC1)CCN1C(c(cc1)ccc1F)=O)=O,1 F6673-4990,Cc1cnc(N(C)C2CN(CCc3ccccc3)CCC2)nc1,1 Z3086641298,CN(CC1)CCN1c1ccc(CNC(c2cc(COC)no2)=O)cc1,0 8014-1826,CCOc(c(OCC)c1)cc(CNC2c(cc3)ccc3Cl)c1-n1c2ccc1,0 D563-0514,COc(cc1)ccc1S(c1csc(C(C2)c(cc3)cc(O)c3OC)c1NC2=O)(=O)=O,0 Z1577208011,CCN(C(c(ccc(C(N1CC2(CCC2)C(C)CC1)=O)c1)c1N1)=O)C1=O,1 Z4097830902,O=C(c(cc(C(F)(F)F)cc1)c1Cl)NCCc1nnc(-c2ccccc2)o1,0 F538-0880,O=C(Nc1ccccc1)Nc1cccc(-c2noc(C(C3)CN(C4CCCC4)C3=O)n2)c1,1 S824-2034,COc(cc1)ncc1C(N(C[C@@H]1CO)C[C@@H]1c1ccncc1)=O,0 Z2951930606,CC(C)(C)n1nnc(CN2[C@@H](C3)CN(Cc4ccccc4)[C@@H]3C2)n1,0 F6473-4057,CSc1ncccc1C(N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O)=O,0 F6724-2789,Cn1ncc2c1ncnc2NCC1(c(cccc2)c2OCC1)O,1 Z1715638350,CCn1ncc(NC(c2c(C(F)(F)F)oc(C)c2)=O)c1,0 Z1303059153,CC(CNC(c(ccnc1)c1Cl)=O)(C1CC1)O,0 F6246-2828,CN1N=C(C(CC2)CCN2S(C2CC2)(=O)=O)N(C2CC2)C1=O,1 F5791-0347,O=C(c1nc(cccc2)c2s1)NC(CCC1)c2c1cccc2,1 Z2489910354,CC(C)Cc1n[nH]c(NC([C@]2(CNC3)[C@@H]3COC2)=O)c1,1 Z3583167980,CC(CONC([C@H]1[C@H](CC2)O[C@H]2C1)=O)O,1 Z1506140380,CC(C(F)(F)F)N(CC1)CCN1C(c(cc1)cc2c1n(C)cn2)=O,0 Z2465932257,CC(C)(C)c1nc(C(O)=O)nc(N(CC2)CCC2c2nncn2C2CC2)c1,0 Z2911448233,OC(C(c1c(CC2)occ1)N2C(Cc1c(CCCC2)n2nc1)=O)=O,1 F6451-3051,COC(CNC(C(Nc(cc1)cc2c1OCCO2)=O)=O)c(cccc1)c1Cl,0 Z1328240238,CC(C)(CC1)N1C(NCc1cnc(C)n1-c1ccccc1)=O,1 Z2102358222,C(c1nccs1)N(CCC1)C1c1cnccc1,0 Z1899661230,O=C1N(Cc2ccc(CF)cc2)N=CC=C1,0 Z4905039864,CNC([C@H](Cc1c(C2)cccc1)N2C(c(cc1)cc(CC2)c1N2S(C)(=O)=O)=O)=O,1 Z2237274147,CC(C)S(N(C1)CC1C(N)=O)(=O)=O,0 Z1514559798,O=C(c(cc1)ccc1-n1nc(C(F)(F)F)cc1)N(CC1)CC1C1CCOCC1,1 F6372-0201,Cc1cc(C(Nc2c(Cc3nc(C)no3)cccc2)=O)no1,1 F3407-4724,Cc(ccc(NC(CN(C1=O)N=CC(SC2)=C1N(C)C2=O)=O)c1)c1Cl,0 F6111-0989,CC(C)Sc1ccc(CC(N2CCC(COCc(cc3)ccc3F)CC2)=O)cc1,0 Z3244919323,CN(C)C(c1cc(-c2cc(O)ccc2)ccc1)=O,0 Z25990176,COc(cccc1)c1N(CC(NCc1cccs1)=O)S(c(cc1)ccc1F)(=O)=O,1 F2635-1489,O=C(C(CC1=O)CN1c1ccccc1)N(Cc1ncccc1)c1nc(ccc(F)c2)c2s1,1 F6523-0322,O=C(c1nc(cccc2)c2s1)N(CC1)CCN1c1ncnc(C(F)(F)F)c1,1 S551-0622,O=C(C1CCC1)NCc1nnc2n1ccc(-c1nc(C3CC3)no1)c2,1 Z1160973758,CC(C(N(CC1)CCC1c1nc(C)no1)=O)c(cccc1)c1F,1 F6712-9030,O=C(C(C1)CC1(F)F)NC(CC1)CCC1N1N=C(C2CC2)C=CC1=O,1 F5095-0123,Cn1c(N(CC2)CCN2C(c2cc(cccc3)c3o2)=O)ncc1,1 F6454-2440,Cc1nccc(N2CCC(CNS(c(cc3)ccc3-n3nccc3)(=O)=O)CC2)c1,1 Z431965622,CCC1OCCN(CCOc2cccc(C(O)=O)c2)C1,0 Z4874776734,Oc1ccc(C(CC2)CN2C(NC2c(cccc3)c3OCCC2)=O)cc1,1 Z1517677463,COc(nc1)nc(N2CCN(CC(Nc(cccc3)c3F)=O)CC2)c1Cl,0 F6752-3945,Cc1nnc(CN2CC(C(N(CC3)CCC3(F)F)=O)OCC2)n1C,1 F5854-2480,Cc(cc1)c(C)cc1S(N(Cc1cscc1)Cc1ccco1)(=O)=O,0 Z3008958499,C[C@H](CO)N(C)S(c(c1ccc2)c[nH]c1c2Br)(=O)=O,0 F6420-0525,COC1(CNC(c2cscc2)=O)CSCC1,1 T500-0755,COc1ccc(C2(CC2)C(N(CC2)CCC22OCCC(Cc3cccc(F)c3)C2)=O)cc1,0 F6244-1808,Cc1c(C(NCC#CCN2CCCCC2)=O)snn1,1 V001-9725,COc1cccc(C(CN(CC2)CCN2C(NCC2CCCCC2)=O)OCc2cccc(Cl)c2)c1,1 Z1968109569,Clc1nc(NCc2n[nH]cc2)c(ccs2)c2n1,1 F455-1007,COc(cc1)ccc1C(C(c(cc1)ccc1Br)N(Cc1ccco1)C1=O)=C1O,1 SB36-0101,CNC(c1cn(C[C@H](CC(C2)(F)F)N2S(c(cc2)cc(OC)c2OC)(=O)=O)nn1)=O,0 F6617-2742,NC(C(CC1)(CCN1c1c(cc(cc2)Cl)c2ncn1)N1CCCCC1)=O,1 Z3290575073,O=S(c(snc1)c1Br)(NC1CC=CCC1)=O,1 SA65-0722,CC1(CC1)C(N1CCC(CCc2noc(-c(cc3)ccc3F)n2)CC1)=O,1 Z2768783955,Cn1c(-c2nnc(CC3)n2CC3C(OC)=O)ccc1,0 F6797-2806,O=C(C(CC1)(CN1c1ncnc2c1CCCC2)F)Nc1cnccc1,1 C547-0109,CN(c(cccc1)c1C(OCC(NCCCN1CCCCCC1)=O)=C1)C1=O,1 Z4896600559,CC(C)[C@H](C(O)=O)NC(c1nc2c(C(N)=O)ncn2c(-c2ccco2)c1)=O,1 SB29-0221,Cc1nc([C@H](C2)N(Cc3ncccc3)C[C@H]2OCc2ccccc2)n[nH]1,1 SB12-0073,CC(C)CNC(C(CCc1c2cccc1)N(C)C2=O)=O,0 Z1439726936,CN(CCC1)c(ccc(F)c2)c2N1C(CCC(N(CC1)CCN1c1ncccc1)=O)=O,0 F5857-0480,OC(CNC(c1c(C(F)(F)F)cccc1)=O)(C1CC1)c1ccco1,0 F6792-3733,CCc1cc(OCC(CC2)CCN2c2ncnc3c2n(C)cn3)nnc1C,1 S824-2249,Cn1ncc(CN(C[C@@H]2COC)C[C@@H]2c2ccncc2)c1,1 M952-0161,Cc([nH]c(C)c1S(N(CC2)CCN2c2ccc(C)cc2)(=O)=O)c1-c1nnc(C)o1,1 Z2156583265,FC(C1(CCCC1)c1nc(-c(cc2)cc3c2[nH]cc3)no1)F,1 S592-0908,COCc1nc(C(CC2)CN2S(c2cc(F)ccc2)(=O)=O)no1,0 4912-0902,CC(C(C1)Sc2nc(cccc3)c3[nH]2)=CS1(=O)=O,1 Z4524718235,COC(C1(Cc2cn(CCCCC3CC3)nn2)CCCCC1)=O,1 F6190-1677,OC(CCNC(C1c(cccc2)c2Oc2c1cccc2)=O)c1cccs1,1 F3406-5573,Cc(cc1C)cc(C)c1NC(CSc1nc(N(CC2)CCN2c2ccccc2)ccn1)=O,0 F6560-8151,Cc(n(-c1ccccc1)nc1)c1C(NCc(cc1)cnc1-c1cn(C)nc1)=O,1 Z1560487911,CCN(CC1OCCC1)C(Nc1cc(C)ncc1)=O,0 D470-0163,COc(ccc(N(C(CC1)=O)S1(=O)=O)c1)c1S(NC1CCCC1)(=O)=O,1 Z3226378263,[O-][N+](c1ccc(C2CCCCC2)cc1)=O,0 F6451-2978,Cn1ncc(S(NCC(c(cccc2)c2Cl)OC)(=O)=O)c1,0 Z2043974538,O=C(C(CC1)c(cccc2)c2S1(=O)=O)N(CC1)CCN1C1CCOCC1,1 Z3103876618,CC(C)[C@H](CO)NC(N[C@H](C1)[C@@H]1c(cc1)cc(F)c1Cl)=O,0 Z1692692461,CN(CC(C1COCC1)O)C1CCCC1,1 F2145-1016,Brc(cc1)ccc1OCCN1CCOCC1,0 F6443-8139,CCOC(C(C(OCC)=O)NC(C(CCC1)N1c1nc(cccc2)c2o1)=O)=O,0 Z1211955017,O=C(c1cc(-n2ncnc2)ccc1)N1c2cccc(F)c2C2(CCCC2)C1,1 SB53-0011,Cc1nnc([C@@H](C2)[C@@H](CN(C)C)CN2S(c(cc2)cc(OC)c2OC)(=O)=O)o1,0 Z1584078010,CC(N=C1SC(CN(CC2)Cc3c2[nH]nc3)=NN11)=CC1=O,1 Z1199400295,CCNC(CCN(CC1)CCC1C(Nc(cc1)cc(Cl)c1F)=O)=O,0 5954-2332,CC(c1ccccc1)NC(COc1ccc(C(Nc2c3cccc2)N(Cc2ccccc2)S3(=O)=O)cc1)=O,1 S662-0047,O=C(c1cscc1)N(CC1)CCC1(CC1)C1N1CCOCC1,1 Z452456570,CCOC(Nc(cc1)ccc1NC(C(CC1)CCN1S(c(cc1)ccc1OCC)(=O)=O)=O)=O,0 F6212-0365,O=C(c1c2OCCCn2nc1)NCc(cc1)ccc1OC(F)(F)F,0 P058-0135,Cc1c(C(Nc(cc2)ccc2OC(F)(F)F)=O)c2c(N3CCCC3)ncnc2s1,1 Z3408195511,CNC(c1cc(CNC(c2nn(C)c3c2COCC3)=O)ccc1)=O,1 SA49-0349,O=C(CC1COC(C2)(CN2C(c2ncccn2)=O)C1)N1CCCC1,1 Z412435002,O=C(NCc1ncccc1)Nc1cc(C2CC2)nn1-c1ccccc1,1 M739-0691,CC(C)NC(c(cc1)ccc1OCC(CCC1)N1C(C1CCC1)=O)=O,1 F6573-4970,CC(C)(C)OC(N1CCC(CC(NCc2cncc(C3CC3)c2)=O)CC1)=O,1 Z4099035768,Cc(ccnc1)c1NC(CC1(C2)C2CCC1)=O,1 Z1101967662,O=C(COc(cc1)cc(O2)c1C=CC2=O)Nc(cc1)ccc1OCc1cnccc1,0 S903-1454,CN(C)C(N(CC1)CCC1c1nnc(C2)n1CCN2C(c(ccc(OC)n1)c1OC)=O)=O,0 F6454-2862,O=S(c1cccc(Cl)c1)(NCC(CC1)CCN1C1CCSCC1)=O,0 Y207-1250,CC(CC1)Cc2c1c(C(N(CC1)CCN1S(C)(=O)=O)=O)cs2,0 F6381-0044,Cc1noc(C)c1CCC(N(CCC1)C1c1nc(C)no1)=O,0 F2616-0814,Cc1cccc(C)c1NC(C(NCc1cccs1)=O)=O,0 Z1927446016,O=C(c1nn(CC(F)F)cc1)Nc1c[nH]nc1-c1ncccc1,0 F6473-6424,Cc(cc(cc1)S(N(C2)CC2OC(C=C(C)O2)=CC2=O)(=O)=O)c1OC,0 SB56-0725,CC1(CCCCC1)C(N(C[C@@H]1c2nc(-c3ccncc3)no2)C[C@@H]1c1cnccc1)=O,1 S970-0433,O=C(c1cscn1)N(CC(C1)(F)F)[C@@H]1c1nncn1CC1CC1,1 SA52-0114,CC(C)CN(CCCN(C1)S(c2ccccc2)(=O)=O)C1c1nc(C)no1,0 L702-0184,O=C(CN(C(C=C1)=O)N=C1C(N(CC1)c2c1cccc2)=O)NCCc1nc(cccc2)c2[nH]1,1 F2902-0581,O=C(C1(CCCC1)c1cccs1)NCCn1ncc2c(N3CCOCC3)ncnc12,1 F6554-4572,O=S(c1cc(C(F)(F)F)ccc1)(N1Cc(cc(cc2)F)c2OCC1)=O,0 Z1389877124,Cc1cc(CC(N(CC2)CCN2c(cc2)ccc2Cl)=O)n[nH]1,0 F0643-0106,COc1c(CCNC(CCN(c(cccc2)c2O2)C2=O)=O)cccc1,1 Z3063570868,CCn1nnc(C(NCC(CC2CC2)C(O)=O)=O)c1,1 F5526-0694,Cc1cccc(NC(NCCOc2ccccc2)=O)c1C,0 SA63-1298,O=C(CCn1nccc1)N(CC1)CCC11OCCC(CCNC(C2CC2)=O)C1,1 Z2357398749,CC(CCC(C1)C(O)=O)N1S(c(ccc(F)c1)c1Cl)(=O)=O,0 F6445-3064,Cc1nn(cc(CCCNC(c(cccc2)c2C(c(cc2)ccc2F)=O)=O)cn2)c2c1,1 Z3519740619,CCC(NC(C(N(CC1)CCC1(CCC1)C1N)=O)c1ccccc1)=O,1 C301-7611,COc(ccc(NC(NC(C(Oc1c2cccc1)=O)=C2NC1CCCCC1)=O)c1)c1OC,0 F6438-3540,CN(C)c1nc(CNC(c2cnc(C(F)(F)F)cc2)=O)nc(N(C)C)n1,0 Z2951554870,CN(C1)C[C@@H](C2)[C@H]1CN2C(Nc1ncc(OC)s1)=O,1 Z2017549004,CC(C1)OC2(CCOCC2)CN1C(Nc1nc(OC)ncc1)=O,1 F6616-3148,Cc1nc(Cn2ncc(Br)c2)cs1,1 Z4582158248,OCc1nn(Cc(cccc2)c2F)nc1-c1ccccc1,0 SB20-1519,Cc1c(CCC(N2[C@H](Cn3nnc(C(NC4CCCC4)=O)c3)CCC2)=O)c(C)n[nH]1,1 Z2851783187,CC1OC(CC2)(CN2C(C)=O)CN(Cc2ccccc2)C1,1 F6448-1722,O=C(c(o1)ccc1Br)Nc1cn(C2CCOCC2)nc1,1 F2199-0530,COC(c1c(C(c2ccccc2)=O)sc(N2CCOCC2)n1)=O,1 SC13-0108,CC(C=C(C)N1CC(N(CCC2)CC2N(Cc2cnccc2)C(C2CCC2)=O)=O)=NC1=O,1 F3088-3288,O=C(c(cc1OCCOc1c1)c1Br)Nc1ncc(Cc2ccccc2)s1,1 Z3191524999,CC(CCC1)N1C(C1(CS(C)(=O)=O)COC1)=O,0 F6438-2920,COc1nc(CNC(c2c(C(F)(F)F)cccc2)=O)nc(OC)n1,0 F5299-0363,Cc1nn(CC(NCc2ccco2)=O)c(C(N2CCOCC2)=O)c1,1 Z1152084352,Cc1nc(n(-c2ccccc2)nc2)c2c(N(CC2)CC2N2CCCCC2)n1,1 F6782-7652,O=C1N(CC2CCCCC2)C=CN(c(cc2)ccc2Br)C1=O,0 Z4444505278,Cn1nc(C2COCCC2)cc1NC(C1=CN=C(C2CC2)NC1=O)=O,1 Z1547631669,O=C([C@H]1OCCC1)Nc1n[nH]c(C2CCCC2)c1,1 F6747-6301,COc(cc1)cc(N=CN2CC(CC3)CCN3c3cnc(cc(cc4)Cl)c4n3)c1C2=O,0 F6512-6708,Cc1cc(S(N(CCC2)CCN2S(c2c[nH]cn2)(=O)=O)(=O)=O)c(C)cc1,0 F5831-7071,O=C(NCC1CCN(Cc2cccs2)CC1)Nc1cc(C(F)(F)F)ccc1,0 E135-0864,CC(CCCC1C)N1C(C(N1C)=CC(c(cc(cc2)OC)c2OC)=NS1(=O)=O)=O,0 S689-1675,COCCNC(C(C1)CN(C(C2)CN2S(c2cc(CCC3)c3cc2)(=O)=O)C1=O)=O,1 Y044-5476,c1(n(c2c(c1)c(cc(c2)OC)OC)C)C(N1CC2\C=3\N(C(\C=C/C3)=O)CC(C1)C2)=O,1 Z1249637323,O=C(C(N1Cc2nnc(C(F)(F)F)n2CC1)=O)Nc1cccc(Cl)c1Cl,0 SD01-0130,COCCn(c(CC1)c2CN1S(c(cc1)cc(OC)c1OC)(=O)=O)nc2-c1cocn1,0 F6660-6412,O=C1N(Cc2nc(Cc3cccc(F)c3)no2)C=CN(C2CCCCC2)C1=O,1 F6617-3205,COc1cccc(CN(C=CN(Cc(cccc2)c2OC)C2=O)C2=O)c1,0 Y200-1811,O=C(c1cc(-c2ccccc2)nc2ccccc12)Nc1nnc(CC2CCCC2)s1,1 F6247-1038,O=C(Cc1cccs1)NC(CC1)CCN1c(cc1)nnc1-c(cccc1)c1Cl,1 Z2911843424,Cc(cc1)c(C)cc1C(NC1CC(C2)(CC2C(O)=O)OCC1)=O,0 Z2790999242,CC(CNCc1c(CCCC2)n2c(C(F)(F)F)n1)S(C)(=O)=O,0 F6556-5572,Cc(onc1)c1C(N(CCC1)CCN1C1COCC1)=O,1 Z1553077036,CC(C)(C)Oc(cc(cc1)F)c1NC(C(C=CN1)=CC1=O)=O,0 S971-0555,OC(CC1)C1(CC1)CCN1S(c1cc(F)cc(F)c1)(=O)=O,0 Z3063547041,CN(C1CCCC1)S(NCc1cc(Br)cnc1)(=O)=O,1 SB04-0701,CN(C)C(N(CC1)CC1N(CCN(C)C(c1n[nH]c(C2CC2)c1)=O)C1CCOCC1)=O,1 F2135-1750,CCCNC(CSc1nccc2ccccc12)=O,0 F6454-1216,CC(C)(C(NCC(CC1)CCN1c(nc1)ncc1F)=O)Oc(cc1)ccc1Cl,0 Z2324409998,C[C@@H](COCC1)N1C(C(CCC1)N1c1ccccc1)=O,1 Z1445540678,Cc(cccc1)c1-n1ncc(C(NCC(C(O)=O)c2ccccc2)=O)c1,1 Y040-2783,N1(C(Nc2c(C1=O)cccc2)=O)C[C@@H]1CC[C@@H](C(N[C@H](C(=O)O)C)=O)CC1,0 F2070-0015,Cc(cc1)c(C)cc1-n1nnnc1CNC(CC1CCCC1)=O,1 F6752-3397,Cc1noc(C)c1CN(CCC1)CC1NS(C1CC1)(=O)=O,1 Y041-7471,O=C(c(ccc(N(CCCC1)S1(=O)=O)c1)c1Cl)NCc1nnc2n1cccc2,1 F6279-0593,OC(CC1)CCN1C(Cc(cc1)ccc1NC(NC1CCCCCC1)=O)=O,1 F6672-1329,Clc1cn(C2CC(CC3)N(Cc4ccncc4)C3C2)nc1,1 Z918949568,CCCN(C(CC1)c2c1cccc2)C(c1c[nH]c(C(N2CCCC2)=O)c1)=O,1 P169-1044,CCc(s1)nn2c1nc(C)c2CNS(c1cc(CCC2)c2cc1)(=O)=O,0 Z2076120016,NC(Cc(occ1)c1C(N(CCC1)CC1NC(c1ccc(C(F)(F)F)cc1)=O)=O)=O,1 Z1266585600,Cc(cc(cc1)OC)c1C(NCC(C1)(Cc2c1cccc2)O)=O,0 Z1251087780,COc1ccc(CC(NC2(COCC2)C(O)=O)=O)cc1,0 F6679-2878,Cn1ncnc1CN(CC1)CC1Oc(ccnc1)c1Br,1 F6539-2093,CN(C)S(N1CCC(CNC(c(cccc2)c2F)=O)CC1)(=O)=O,0 L859-0288,Cc(cc1)nc(N(Cc(cc2)cc(F)c2OC)C=C2c3nc(-c(cc4)ccc4Cl)no3)c1C2=O,0 F6436-2160,CC(CNC(c1cc(Br)cnc1)=O)(c(cc1)ccc1-c1ccccc1)O,1 Z2755635922,CC(C)(C)c1n[nH]c(C(NCc2cc(C)c(C(O)=O)o2)=O)c1,0 G404-1206,Cn1cnc(S(N(CC2)CCC2C(NC2CCCCC2)=O)(=O)=O)c1,0 P271-0251,Cc1c(C)nc2ncc(N(CCC3)CC3C(Nc(cc3)cc4c3OCCO4)=O)cc2n1,0 M754-1081,Cc1cccc(NC(N(CCCC2)C2c2nnc(C3CC3)[nH]2)=O)c1,1 G514-0049,O=S(CCc1ccccc1)(Nc1cc(N(CCC2)S(c3ccccc3)(=O)=O)c2cc1)=O,1 Z2976041847,Cc1c(CNc2ncnc3c2cc[nH]3)ccc(OC)c1OC,0 Z1612495496,CC(C(N1CCN(CC2)CCN2c2c(C)c(C)ccc2)=O)NC1=O,1 SB75-0175,CC(C)C(N(C[C@@H]1C[C@H](C2)NC(CCc3c(C)onc3C)=O)C[C@@]12c1nc(C)no1)=O,0 Z2496170100,CC(c1nn(C)cc1)NC(N1CCC(CCc(ccc(F)c2)c2F)CC1)=O,1 Z751645638,OCC1N(Cc2cccc(OCC(F)(F)F)c2)CCCC1,0 Z1348610750,Cn1ncc(N(CCN(CC(N2CCC(Cc3ccccc3)CC2)=O)C2)C2=O)c1,1 D724-0571,Cc1nn2c(Nc3cccc(OC)c3)c(CCC3)c3nc2c1-c1ccccc1,0 F6418-0103,OC(c1cccs1)c1ccc(CNC(c(c(F)ccc2)c2Cl)=O)s1,0 F6660-2319,CC(CN(C=Nc1c2c(CCCC3)c3s1)C2=O)=C,0 F5028-0096,O=S(c1cnccc1)(N1CC(c2ccc(C(F)(F)F)cc2)OCC1)=O,1 S615-0627,O=C(c1c[nH]nc1)N(CC1)CC1c1nc(CCOCC2CCOCC2)no1,1 Z2877482264,CN(CCC1)[C@H]1C(N[C@@H](Cc1ccccc1)C(OC)=O)=O,0 Z2761392367,COc(ccc(CNC[C@@H](CC1)O[C@@H]1c1ncn[nH]1)c1)c1C#N,0 F5937-0044,O=C(c(cccc1)c1Oc1ccccc1)NCCCn1cccc1,1 Z447496510,COc(ccc(C(CNC(N(CCCCC1)C1c1ccncc1)=O)N1CCOCC1)c1)c1OC,1 F6523-3017,C=CCCC(NCCN(Cc(cccc1)c1OC1)C1=O)=O,0 F6485-0305,O=C(Cc(cc1)cc2c1OCO2)NC(CC1)CCC1Oc1ncccn1,1 Z875634860,Cc(ncnc1)c1C(N(CC1)CCN1c(cc1)ncc1Cl)=O,0 Z751169202,CCCC(Nc1nc(ccc(NC(c(c(F)ccc2)c2F)=O)c2)c2s1)=O,0 F6089-2284,COc(ccc(NC(c1ccc(Cn2cncc2)cc1)=O)c1)c1N(CCC1)C1=O,1 Z2053310125,Cc1c(CN(C[C@@H](C2)OC)[C@@H]2c2nnc3n2CCC3)cccn1,1 Z4924503512,[O-]C(C(CCO)CN(C1)Cc(cccc2)c2-c2c1cccc2)=O,0 F2740-0825,Cc1cccc(NC(Nc2cn(CCOC)c3c2cccc3)=O)c1C,0 Z2290763304,OCC(CCC1)CCN1C(Nc1nnc(C(F)(F)F)s1)=O,1 Y041-3684,COc1cccc(C(C=C2)=NN(CC(c(cc3)cc(CC4)c3N4S(C)(=O)=O)=O)C2=O)c1,1 F6454-0694,O=C(C1(CCOCC1)c1ccccc1)NCC1CCN(CC(F)(F)F)CC1,0 Z1574608237,CC(C)Cc1n[nH]c(C(N(CC2)Cc3c2n(CCc2ccccc2)cn3)=O)c1,0 F6481-2553,CC(C)S(c1ccc(CC(N(CC2)CCSC2c2c(C)cccc2)=O)cc1)(=O)=O,0 E988-0136,Cn1c(-c2nn(CCCN3C(Nc(cc(cc4)F)c4F)=O)c3c2)ccc1,0 Z2284643506,CC(CC1)(CCN1c(ccc(Cl)c1)c1C#N)C(NCC(CCC1)C1(F)F)=O,1 F6658-0158,O=S(C1CC1)(N(CC1)CCC1c1nnc2n1nc(C1CC1)cc2)=O,1 F6524-3955,CC(Nc1cccc(C(N(CC2c3nc(C)no3)CC2c2ccccc2)=O)c1)=O,0 8018-2469,CN(c1c(C(c(cc2)cc(O)c2O)OCC2)n2c(-c2ccccc2)c1C(N1C)=O)C1=O,0 F0528-0554,COc(cc1)ccc1C(NCc(n1C2CCCCC2)nnc1SCc1cc(F)ccc1)=O,1 J007-0007,Cc1c(C(CCCCC2)N2C(NC2CCCCC2)=O)scc1,0 Z1900964729,CC(N[C@H](CC1CCC1)C(N(CC1)CCN1c(c(Cl)ccc1)c1Cl)=O)=O,1 SB16-0336,C(c1cc([nH]cc2)c2cc1)N(CC1)C[C@@H]2[C@H]1N(Cc1ccccc1)CCOC2,1 Z1870238646,OC(c1csc(NC(COc2ccccc2)=O)c1)=O,0 Y204-5727,COc(cc1)ccc1-c1csc(NC(C(C2CC3CC2)C3C(O)=O)=O)n1,0 Z3685946467,CCOc1cc(CN[C@H](CC2)CN2c2nc(C(N)=O)nc(C)c2C)cc(F)c1,0 Z2441066516,CC(C1)NCCC1NC(c1cccc(CS(c2ccccc2)(=O)=O)c1)=O,0 F5868-0217,Cc(cc1)cc(C)c1NC(COc1ncccn1)=O,0 SB04-0569,CN(C)C(N(CC1)CC1N(CCNC(Nc(cc(cc1)F)c1F)=O)C1CCOCC1)=O,0 F6492-0126,O=C(C(CC1)Cc2c1[nH]cn2)NCc(cc1)cc2c1OCO2,1 L561-0458,O=C(c(cc1)ccc1-c(cc1)nnc1Oc(cc1)ccc1F)NC1CCCC1,0 Z3520232813,CC(C(c1cc2ccccc2cc1)NC(c1nn(CCCN2)c2n1)=O)N,1 Z2347013142,CC(CC1)CCC1NC(CN(CC1)CCN1c1c(c(C)cs2)c2ncn1)=O,1 F6490-0428,O=C(NCc1cccs1)N(CCC1)CC1Oc1nnccc1,1 F3386-4840,Cc1cc(Br)c(C)cc1S(Nc(cccc1)c1O)(=O)=O,0 F6452-1388,CC(CNS(c(cccc1)c1Br)(=O)=O)(c1cc(Cl)ccc1)OC,0 P166-1894,C(C1CCN(Cc2nc(-c(cc3)cnc3N3CCOCC3)no2)CC1)c1ccccc1,1 F6802-7670,COc(nc(N(CC1)CCC1C(N(CC1)CCC1(F)F)=O)nc1)c1Br,0 S582-0525,COc1ccc(CNC(NCC(Cn2c3ccc2)N(Cc2ccccc2)C3=O)=O)cc1,0 SC72-0683,O=C(c1ccncc1)N(C1)CC11OCc2c1cnc(-c1ccccc1)n2,0 F6752-7486,CC(C)(C)NC(C(CC1)CN1c1nc(C)ns1)=O,0 F6031-1856,COCCNC(N1CCN(CC(C2CC2)O)CC1)=O,0 J006-2815,CC(C)c1noc(C2N(Cc(cc3)cc(OC)c3O)CCC2)c1,0 F5857-1163,Cc1cc(C(NCC(c2cscc2)O)=O)c(C)cc1,0 Z2172802822,CCc1n[nH]c(CNC(c2cnnc(-c3ccccc3)c2)=O)c1,1 Z2959355555,Cc(cc(C(NC(CN1CCOCC1)CO)=O)o1)c1Br,0 Z2000785780,CC(C)(CN(CC1)CCN1S(c1cc(C#N)c(C(F)(F)F)cc1)(=O)=O)O,0 F6494-0905,CCOc1cc(C(NCCn2nc(C)cc2C)=O)ncn1,0 F6476-7276,Cc(cc1)cnc1OC(CC1)CN1C(c1ncc(C)nc1)=O,1 Z1401323538,O=C(CCc1ccccc1)N(CC1)CC1NC(N(CCN1C2CC2)CC1=O)=O,1 Z3063553573,CC1(C)C2(CS(N3CC(C(NC)=O)OCC3)(=O)=O)CCC1CC2,1 F6445-7115,CN(C=C(C(NC1=NCCS1)=O)C(OC)=C1)C1=O,1 F6436-0635,Cc(onc1)c1C(NCC1CCN(Cc(cccc2)c2SC)CC1)=O,1 Z2295613680,OC(C(CC1)CCC1NC(c1ccnn1-c1ccccc1)=O)=O,1 F0643-0153,CSc(cccc1)c1NC(CCN(c(cccc1)c1O1)C1=O)=O,0 Z1400942665,CN(C)CC(CCC1)N1C(C1=CN=C2SCCN2C1=O)=O,1 SC13-0621,Cn1ncc(C(N(CCC2)CC2N(Cc2cnccc2)S(C)(=O)=O)=O)c1,1 SC72-0615,C(c1cscc1)N(C1)CC11OCc2c1cnc(-c1ccccc1)n2,1 Z1870246847,CC(Cc(cc1)ccc1NC(c1cnncc1)=O)C(O)=O,0 Z2058247808,OC(CNC(C(CC1)Cc2c1[nH]nn2)=O)(CCC1)CC1C(F)(F)F,0 F475-1015,Cc1cccc(C(Nc2c3cccc2)N(Cc2cccs2)S3(=O)=O)c1,1 F6471-3949,O=S(c(cccc1)c1Br)(N(C1)CC1Oc1nccs1)=O,0 F2604-0061,O=C(CCCc1ccccc1)N(CC1)CCN1c(cc1)nnc1NCc1ccccc1,1 Z3063557132,CC(C)c1nccc(N2CCC(Cc3c[nH]cn3)CC2)n1,1 Y040-0854,O=C(COc(cc1)cc(O2)c1C(CCCCC1)=C1C2=O)c(cc1)ccc1Br,1 F6445-6192,Cn1nc(cc(cc2)Br)c2c1C(N(CC1)Cc2c1ncnc2)=O,1 Z4188180076,CSCCCS(NC(C(C1)CC1C1CC1)=O)(=O)=O,1 Z1531957675,Cc(nc(C)s1)c1S(NCC(O)=O)(=O)=O,0 Z1647177193,Cn1nnc(CNC(N(CCc2ccccc2)Cc2cnccc2)=O)c1,1 F6374-5517,CC(C)S(c1ccc(CC(N2CCC(CSCc3ccco3)CC2)=O)cc1)(=O)=O,0 SB99-0259,Cc1noc(C)c1S(N(CC1)Cc2c1n(C)nc2CCC(N1CCOCC1)=O)(=O)=O,1 8018-0739,CC(Cc(cc1)cc(OC)c1OC)NS(c(cc1)cc(CC2)c1N2S(C)(=O)=O)(=O)=O,0 Z2900720789,COC(c1cc(S(N(CC(F)F)CC(F)F)(=O)=O)c[nH]1)=O,0 S740-0157,O=C(CCCc1ccccc1)N[C@@H](C1)CN(CCS(N2C3CC3)(=O)=O)[C@@H]1C2=O,1 Z3918226527,CC[C@@H](C(N)=O)NC(c1cnc2n1cc(C)cc2)=O,0 F2902-0192,O=C(c1cccc(C(F)(F)F)c1)NCCn1ncc2c(N3CCCCC3)ncnc12,1 P633-0804,CC(C)n1c(nccc2)c2c(S(N(CC2)CCN2c(cccc2)c2Cl)(=O)=O)c1,0 SB75-1021,Cc1noc([C@@](C[C@@H](C2)NC(C3(CC3)c3ccccc3)=O)(C3)[C@@H]2CN3S(C)(=O)=O)n1,0 F6573-8622,O=C(Nc(cccc1)c1Cl)N(CCN1c(nc2)ncc2F)CC1=O,0 Z1203757526,Cc(n(C)nc1C)c1Nc1nc(C)cc(OC)n1,0 Z1507425847,O[C@H](CC1)CC[C@@H]1NC(N(CC1)CCC1N(CCCC1)C1=O)=O,1 F6471-6201,O=C(c(cc1)ccc1-c1cccs1)NCc1cncc(-c2cscc2)c1,1 SB27-0064,COc(ccc(C(N(CC1)CCC1N(C1)C2(COCC2)CNC1=O)=O)c1)c1F,1 F6805-7942,COc1nccc(N(CCN(C2)c3nc(cccc4)c4[nH]3)C2=O)c1,1 F2984-0183,O=C(CCCS(Cc1ccccc1)(=O)=O)Nc1cccc(Br)c1,0 F6024-0048,O=C(C1(CC1)c1noc(-c2cccs2)c1)N(CC1)CCN1c(cccc1)c1Cl,1 SA93-0644,COCCC(CCC1)(CN1S(c1cc(CCC2)c2cc1)(=O)=O)C(N)=O,0 F6512-1626,O=C(Cc1noc2c1cccc2)NCc1nc(C2CCCCC2)cs1,1 F5852-1244,Cc1cc(C)nn1CCNC(C(NCc(cccc1)c1OC)=O)=O,1 G008-2135,Cc1c(-c(cc2)cc(S(N(CC3)CCN3c(cccc3)c3OC)(=O)=O)c2OC)onc1C,0 G602-0265,O=S(c1cccs1)(N(CC1)CCC1c1nc(-c2cnccc2)no1)=O,1 Y040-9980,CC(C)NC(Cn(cc1)c(cc2)c1cc2Cl)=O,0 F6573-2146,O=C(c1cccc(C(F)(F)F)c1)NCc1nccnc1-c1cnccc1,0 Z1368171231,CC(CC1)CN1c1nccc(C(Nc2ccncc2)=O)c1,1 F6252-3312,O=C(NC1CN(Cc2noc(-c3ccccc3)n2)CC1)Nc(ccc(F)c1)c1F,1 F6754-5228,Cc(cc1)cc2c1nc(N(CC1)CC1(F)F)s2,0 SC42-0673,Cc1noc(C)c1S(N(CC1)CCC11OCCC(Cc2noc(COC)n2)C1)(=O)=O,0 F1374-1616,O=C(C1(CCCC1)c(cc1)ccc1Cl)Nc1nnc(-c2cc(F)ccc2)o1,1 F6442-0627,COc(cc1)ccc1S(C(C1)CN1C(C1(CCCC1)c1cccs1)=O)(=O)=O,1 Z2364155793,CC(C)(CC(CC1)O)CN1C(NC(CCC1)CC1N)=O,1 A0061059,O=C(c(cc1)cc(NC(N2CC3OCCC3)=S)c1C2=O)NC1CCCCC1,1 Y040-6784,CC(C(O)=O)Oc(cc(c(C1=C2CCC1)c1)OC2=O)c1Cl,0 F6696-0116,Cc(cncc1)c1OC(CC1)CN1c1nc(cccc2)c2s1,1 Z2762254013,CO[C@@H](C[C@H]1CNC(COc(ccc(F)c2)c2Cl)=O)CN1c1ncncc1,0 F5243-0026,CC(N=C1SC=C(c2cc(NC(c(c(F)ccc3)c3F)=O)ccc2)N11)=CC1=O,1 F6436-0524,CC(CNC(CSC1CCCC1)=O)(C1CC1)O,1 Z1170796993,Nc1nccnc1C(N(CC1)CCC1C(c(cc1)ccc1Cl)O)=O,0 F6683-1345,COc1ccnc(N2CCC(COc(ccnc3)c3Cl)CC2)n1,0 Z1343762994,CCC(c1nccs1)N(CCC(N1)=O)C1=O,0 F6713-5051,COc(cc1)ccc1-c1nc(CNc(nc2)ncc2Br)cs1,1 F6514-6792,O=C(NC(Cn1nccn1)c1ccccc1)Nc1cccs1,1 CM3884-0502,O=C1NCCC(CC2)(CCN2S(c2cc(CCCC3)c3cc2)(=O)=O)CC1,1 F6616-2159,CN(CC1)CCC1NCc1ccc(C(F)(F)F)cc1,1 F5860-2484,O=C(CCc1cccc(Oc(cc2)ccc2F)c1)NCc1ccco1,1 Y031-2431,COc(cc1)ccc1N(CC(C1)C(Nc(cc(cc2)OC)c2OC)=O)C1=O,0 Z1322610147,O=C(NC(CC1)CS1(=O)=O)N(CC1)CC11CN(Cc2ccccc2)CCC1,1 F6372-0003,Cc1noc(Cc(cccc2)c2NC(c2nn(-c3ccccc3)nc2)=O)n1,1 F6438-3002,COc1nc(CNC(CSc(cc2)ccc2F)=O)nc(OC)n1,1 8015-4100,CN1N=C(c(cc2)ccc2C(Nc(cc2)ccc2OC(F)(F)F)=O)c(cccc2)c2C1=O,1 F6559-2208,O=C(CN1N=CC=CC1=O)NCc1nnc(CC2)n1CC2C(F)(F)F,1 Z1665502575,COc(nccc1)c1C(N(CC(O)=O)Cc1ccccc1)=O,0 F2205-0203,CC(C)(Cc1ccc2)Oc1c2OCC(NCc(c(F)ccc1)c1F)=O,0 SA46-0248,Cn1nc(C(N(C2)CC2(C2)OCC2N2CCOCC2)=O)c2c1cccc2,1 F6561-7756,CSc1cccc(C(NC2CN(Cc3cscc3)CC2)=O)c1,0 F6363-0531,O=C(c1ccco1)NCCNc(cc1)nnc1-n1cccc1,1 D627-0072,O=C(c1nn(C(CC2)CS2(=O)=O)c(-c2cccs2)c1)NC1CCCCCC1,1 M400-0250,O=C(c(cc1)cc2c1OCCN(CC1CC1)C2)NCc1ccccc1,1 Z1966498884,OC(C(CCC1)CN1S(c(cc(cc1)Cl)c1Br)(=O)=O)=O,0 Z1579005212,O=C(COCc1ccccc1)Nc1ccc(C2CC2)cc1,1 F6524-1744,CC(N=C(N1)N(CC2)CCC2NC(c2cccc(OC(F)(F)F)c2)=O)=CC1=O,0 G664-0297,Cc1ccc(CN2CC(CNC(c(sc3ncccc33)c3-n3cccc3)=O)CC2)cc1,1 F3222-3841,COc1cc(-c2nnc3n2C=CN(Cc(cc2)ccc2Cl)C3=O)cc(OC)c1OC,1 Z2595729740,C[C@H](CN(CC1)C(CNc(cccc2)c2Cl)=O)[C@H]1C(O)=O,0 F6438-1852,CN(C)c1nccc(CNC(COc2ccccc2)=O)n1,0 F400-0442,COc1cccc(CN(C=Nc2c3n(Cc(cccc4)c4F)c(cc4)c2cc4F)C3=O)c1,0 F2879-0179,O=C(C(N1CCN(Cc2ccccc2)CC1)=O)NC1CCCC1,1 SB14-1094,Cn1ncc(C(N(CC2)CC2N(C2CCOCC2)C(C2CC2)=O)=O)c1,0 F6125-2106,O=C(COc(cccc1)c1F)N(C1)CC1C(NCCc1ccncc1)=O,1 F2606-0034,CC(CC1)CCN1C(Cc1csc2nc(-c(cc3)ccc3Cl)cn12)=O,1 SA93-0247,CCC1(CN(Cc2cn(C)c(cc3)c2cc3OC)CCC1)C(N)=O,0 SA69-0994,CC(CCC1)(CN1S(c(cc1)cc(OC)c1OC)(=O)=O)c1noc(COC)n1,0 8008-8224,NC(C(CC1)CCN1C(CC(N1c(cc2)ccc2Br)=O)C1=O)=O,0 G861-0104,COc1cc(-c(nc2-c(cccc3)c3N3CC(c(cc4)cc(OC)c4OC)=O)nn2C3=O)cc(OC)c1,0 Z1567335178,CC(C)(C)CC1N(Cc2cc([nH]nc3)c3cc2)CCC1,1 F6730-4520,O=C(c1ncnc2c1CCCC2)NCC1CCCCC1,1 Z364857304,CN(C)C(c1cccc(CNC(c(cccc2)c2-c2ccc(C(F)(F)F)cc2)=O)c1)=O,0 F6754-9804,CC(N(CC1)CCN1c1ccc(ccc(Br)c2)c2n1)=O,0 F5882-0700,O=C(c1noc(-c2ccccc2)c1)N1CCN(Cc2cscc2)CC1,1 F6796-9090,N#Cc(cc1)ncc1N(C1)CC(C2)C1CN2c(nccc1)c1F,0 F6822-2620,COc(ccc(CN(CC1)CCN1c(ncc(C(F)(F)F)c1)c1F)c1OC)c1OC,0 E977-0824,CN(C)c1ccc(CNC(C(CCC2)CN2S(c(cc2)cc(CCC3)c2NC3=O)(=O)=O)=O)cc1,0 F6753-2759,Cc1nc(CN(CCC2)CC2C(N2CCOCC2)=O)co1,1 Y205-8784,CC(c(cc1)ccc1OC)NC(COc1cc(CCC2)c2cc1)=O,1 F6791-9189,CCc1nnc(C2CCN(Cc3nc(C)no3)CC2)s1,1 F6482-2458,O=S(c(cccc1)c1Cl)(NC1CC2OCCOC2CC1)=O,0 F6558-0123,CC(C)(C)C(CN1)C(C(NCc(cc2)ccc2OC)=O)C1=O,0 F6443-5854,O=C(NCc1cc(Oc2ncccc2)ccc1)NC1CCCC1,1 Z3541646060,O=C([C@@H]1[C@H](C2)[C@H]2CC1)NCC(NO1)=NC1=O,1 F6816-3644,N#Cc(cc1)nnc1N(CCC1)CCN1c1ncnc2c1CCCC2,1 Z4946692992,O=C(CNC([C@@H](C1)[C@H]1c1cc2ccccc2cc1)=O)NCc1cnccc1,1 Z2272746057,CS(C1(CCC1)C(NCc1cc(-n(cc2)nc2C(O)=O)ccc1)=O)(=O)=O,1 D089-0237,Cc1c(C(NC2CCCC2)=O)c2c(CN3CCCC3)c(O)ccc2o1,1 Z4497009025,Cc1nc(NC(Cc(cc2)c(C(F)(F)F)cc2F)=O)nn1-c1ccccc1,0 SD07-0969,CCn1nccc1C(NCc1c(COC(CC2)(CN2C(CCC2CCCC2)=O)C2)n2nn1)=O,1 SC73-1052,CC(C)NC(c1nn(C)c2c1COC(CC1)(CCN1C(Cn1cncc1)=O)C2)=O,1 F6713-4549,Fc(cc1)cc2c1nc(N1CC(CN(Cc3ccccc3)C3)C3C1)o2,1 F5630-0028,CC(C)(C)C(NCCNc1nc(Nc(cc2)ccc2OC)cc(C)n1)=O,0 SB36-0558,O=C(c1cn(C[C@H](C2)N(Cc3cc(F)cc(F)c3)CC2(F)F)nn1)N1CCCC1,1 F3165-0568,COc(cc1)ccc1N(C(C1N(Cc(c(F)ccc2)c2Cl)N=NC11)=O)C1=O,0 S951-5406,COCCNC(C(CN(CC1)c(cc2)cc(C(F)(F)F)c2C#N)N1C(c1cocc1)=O)=O,0 L234-1105,O=C(CC(C1)c2nc(-c(cc3)ccc3Oc(cc3)ccc3F)no2)N1c1ccccc1,0 F6524-3967,Cc1noc(C(CN(C2)C(Cc(cccc3)c3OC)=O)C2c2ccccc2)n1,1 F6400-1403,O=C(C1(CCCC1)c(cc1)ccc1Cl)N1C(CN2CCOCC2)CSCCC1,1 F6474-3997,COC(Nc(cc1)ccc1S(N(CC1)CCC1Oc1cccc2cccnc12)(=O)=O)=O,0 P085-1045,CN(C1CCCCC1)C(c(cc1)ccc1-c1nnc(cc2)n1cc2NC(C1CCC1)=O)=O,1 C648-0223,CCOc(cc1)cc(NC(C(CCC2)CN2S(c(cc2)cc(O3)c2N(C)C3=O)(=O)=O)=O)c1OCC,0 SC55-1096,C(c1ccccc1)N(C1)CC(C2)(CN2C2CCCC2)C1c1nc(C2CC2)n[nH]1,1 Z1997045426,O=C([C@@H](CCC1)NC1=O)N[C@@H](CCC1)c(cc2)c1cc2F,0 F5646-0012,Cc(cc1)cc(S(N(C)c(cc2)ccc2Oc2nnc(C)cc2)(=O)=O)c1OC,0 Z2641124249,Cn1ncc(-c(nccc2)c2C(NC[C@H](CCCC2)[C@@H]2O)=O)c1,1 F6436-0572,CC(C)(C)NC(N1CCC(CNS(CCOc2ccccc2)(=O)=O)CC1)=O,1 Z3086180703,CCn1ncc(Br)c1C(NC1=CN=CN(CC)C1=O)=O,1 Y042-2515,Cc(c(O1)c(cc2)C(C)=C(C)C1=O)c2OCC(NC(CC1)c(cc2OC)c1cc2OC)=O,1 Z3290588475,O=C(c1c(cn[nH]2)c2ncc1)NCC1CCN(CC2CC2)CC1,1 Z1891237139,Cc1cc(-c2nc(onc3C)c3c(-c3nc(-c4cnc5n4ccnc5)no3)c2)c(C)s1,1 S935-0139,CCCS(N1C(Cc2noc(-c3nccnc3)n2)CCC1)(=O)=O,0 Z1147361087,Cn(cc1)nc1NC(NCC1CCN(Cc2ccccc2)CC1)=O,0 G765-0257,O=C(NCCCN1CCC(Cc2ccccc2)CC1)NC(C1)COc2c1cccc2,0 F2135-1077,O=C(c1c2cccc1)N(CCc1csc(-n3cccc3)n1)C2=O,1 E734-2693,CCN(c1cc(C)ccc1)S(c1ccc(CN(C(c2c3nccc2)=O)C3=O)cc1)(=O)=O,0 E210-0112,Cc1c(C(Nc2cc(C)cc(C)c2)=O)sc(N=C(C2=Cc(cccc3OC)c3OC2=O)N2)c1C2=O,0 Z2964560414,CCc(nc(cc1)OC)c1NC(c1c(CCCC2)n2nc1)=O,1 F6469-3001,Cc1nc(-c(cccc2)c2NC(NCc2cccs2)=O)cs1,1 Z1873236821,O=C(c1c2nn[nH]c2cc(F)c1)NC(CN1CCCC1)c1ccccc1,1 F5315-0103,COc(ccc(Cl)c1)c1C(NCCCS(N(CC1)CCN1c1ncccc1)(=O)=O)=O,1 V028-9029,CCOC(c1c(C)c(C(CN(CC(C)C)C(NC(C)(C)C)=O)=O)c(C)[nH]1)=O,0 F1125-0134,COc(cccc1)c1N1CCN(CC(COc(c(F)cc(Br)c2)c2F)O)CC1,0 L413-0143,CCC(N(CC1)c(cc2)c1cc2-c(cc1)ccc1C(NC(C)Cc1ccco1)=O)=O,1 F5106-0074,O=C(CCCN(C(C=C1)=O)N=C1c1ccco1)Nc(cc1)cc(Cl)c1F,0 F6676-9818,FC(c1nc(N2CC(Cn3cncc3)C2)ccc1)(F)F,0 F6709-4195,CSc(cccc1)c1C(N(C1)CC1Oc1cc(C(F)(F)F)ncc1)=O,0 Z1982297923,Cc(cc1)cc(CN(C)C)c1NC(c1cc(CO)ccc1)=O,0 S567-0463,OC(CN(CC1)c2c1cccc2)(CC1)CCC1(CC1)CCN1C(c1nccnc1)=O,1 F5834-1190,O=C(C1CCCC1)N(CC1)c2c1ccc(NC(Nc1cccs1)=O)c2,1 T990-4327,O=C(C1CC1)N(CC1)CCN1C(CCN1Cc2cnccc2)C1=O,1 G331-0079,CC(C)CCNC(NCc1cccn1Cc1ccccc1)=O,0 Z131516968,CC(c1nnc2n1cccc2)NC(c1cccc(Cl)c1Cl)=O,0 Z1696958313,Cc1noc(C2CC2)c1NS(c(cc1)cc(F)c1C(O)=O)(=O)=O,0 F6550-2970,COc1cccc2c1oc(C(N(CC1)CCC1=C1CC1)=O)c2,1 F2756-1866,Cc(c1c2nc(N(CCN3CCOCC3)C(c(cccc3)c3Cl)=O)s1)ccc2OC,0 F6616-3717,CC(C)c1c(Cn2c(cccc3)c3nc2C)nco1,1 Z2913040665,CC(C)C(C(N(CC1)CCC1(Cc1cc(C)ccc1)O)=O)C(O)=O,0 Y500-2636,Cc(cc1)ccc1S(N1CCN(Cc2c[nH]c3c2cccc3)CC1)(=O)=O,1 F6356-1117,CC(Cc(cc1)cc2c1OCC2)NC(C(C)(C)OC(C)=O)=O,0 Z2418414170,NC(C(CC(C1)C2)C3)C1CC23C(O)=O,0 T201-0024,COc1cccc(NC(N2Cc3cc(-c(cc4)cc(OC)c4OC)nn3CCC2)=O)c1,0 Z3056028904,Cc1nn(CCN(C2)C(C(c3cccc(C(F)(F)F)c3)O)=O)c2c1,0 7752-0447,COc(c(NC(C(C1)C(C(CCC2)=O)=C2NC1=O)=O)c1)cc(Cl)c1OC,0 SC42-0399,Cc1cc(C)nn1CC(N(CC1)CCC11OCCC(Cc2noc(C3CCC3)n2)C1)=O,0 F6549-3649,Cn1ncc(S(N2CC(Cn3ncnc3)C2)(=O)=O)c1,1 Z1416854524,OCCN(CC1)CCC11OCc2c1cccc2,0 Z335266016,NC(c1cc(CNC2CCCCCCC2)ccc1)=O,1 Z2840997939,CC(C)(CC1)CC1N(C)C(CC(CCN1)C1=O)=O,1 F6812-1392,Cc1nc(CN(CC2)CCN2c2nc(-c3ncccc3)ccn2)co1,1 F6609-4094,COc(ccc(C(OCC(NCCc1ccccc1)=O)=O)c1)c1F,0 Z2178245354,CCCNC(CCC(N(CC1)CCC1c1noc2c1ccc(F)c2)=O)=O,0 Z2446916496,CN(Cc1cc(-c(c2ccccc2cc2)c2OC)no1)C1CCNCC1,1 F6678-9228,CC(C)c1nc(cccc2)c2n1C(C1)CN1c1ncnc2c1cnn2C,1 Z1404667922,OC(CC(COCC1)N1C(c1noc(C2CC2)c1)=O)=O,1 F6064-3490,COc1ccc(CCNC(N(C2)CC2c2nc(-c3cccc(C(F)(F)F)c3)no2)=O)cc1,1 F6554-5771,O=S(c(cccc1)c1Br)(N(C1)CC1C(F)F)=O,0 F6750-6372,Cc1nn(ccnc2N(CC3)CCN3c3nc(-c4cn(C)nc4)cnc3)c2c1,1 F6755-2666,Cc1cccc(N(CC2)CCN2c2nccs2)c1C,0 Z1096320375,CC(C)(Cc1c(C)cccc1)NC(C(CC1)CS1(=O)=O)=O,0 F6442-5797,Cc1cccc(CC(N(CC2)CCC2N(CC2)CC2OC)=O)c1,0 G284-0349,Cc1c(c(-n2cccc2)nn2CC(NC3CCCC3)=O)c2nc(C)c1,1 F6246-0170,O=C(CN(CC1)CCC1c1nnc(C(F)(F)F)o1)Nc(cc1)cc2c1OCCO2,1 Z1436547952,CC(C)CN(CC(O)=O)S(c1cc(OC)ccc1)(=O)=O,0 F6279-0608,CC(CNC(c(cc1)ccc1OC(F)(F)F)=O)(COC)O,0 L815-0188,CC(C(N(CCC1)c2c1cccc2)=O)NC(Cc(cccc1)c1Br)=O,0 F3097-1445,COc(ccc(CCNC(COc(cccc1)c1Br)=O)c1)c1OC,0 Z2295144008,CCC(CC1)(CN1C(Nc1nc(C2CC2)ccc1)=O)O,1 E781-0389,Cn1ncc2c1nc(N1CCC(Cc3ccccc3)CC1)nc2Nc1cccc(Cl)c1,0 F5670-0134,O=S(c1c(C(F)(F)F)cccc1)(N(CC1)CCN1c1ncnc(N2CCCC2)c1)=O,0 8019-5165,O=C(c(cc1)ccc1OC(F)(F)F)N(CC1)CCN1c1nsc2c1cccc2,1 Z2483298873,CC1(C(O)=O)N(Cc(c2c3CCC2)nn3-c2ccccc2)CCC1,1 SB21-0002,CN(C)C(c1cn(C[C@H](C[C@@H](C2)F)N2C(c2c[nH]nc2-c(cc2)ccc2F)=O)nn1)=O,0 L228-0845,O=S(c1ccc(-c2cnc(C3CCC3)o2)s1)(Nc(cc1)ccc1F)=O,0 F6668-2875,Brc(cn1)cnc1OCC1CCN(CCn2nccc2)CC1,1 F6454-1094,CN(C=CC=C1C(NCC(CC2)CCN2c(nc2)ncc2F)=O)C1=O,1 F6178-8171,N#Cc1nccnc1N1CCC(CNC(Cc(c(F)ccc2)c2Cl)=O)CC1,0 F5831-6941,COC(c(cc1)ccc1C(NCC1CCN(Cc2cccs2)CC1)=O)=O,0 Z2297798085,CC(CN(Cc1ccccc1)CC1)CN1C(Cc1ccn[nH]1)=O,1 Z1543532994,CCc(cc1)ccc1C(C(C)OC(C(C=CC1=NN2)=CN1C2=O)=O)=O,0 Z2275716876,Cc1c2OCCCn2nc1C(NC(CC1)C11CCCCC1)=O,1 Y020-4377,O=C1NC(N(CC2)Cc3c2cccc3)=Nc2nccc(-c3cccs3)c12,1 SC70-0492,CCCc1nc(C(C2)C3(CCC3)CN2C(c2noc(Cn3ncc(C)c3)c2)=O)n[nH]1,1 Z1744511504,O=C(c1cc(-c2ccncc2)nc2ccccc12)N(CC1)CC1(c(cccc1)c1N1)C1=O,1 G516-1461,CC1N(CCNc2nc(-c(cc3)ccc3Cl)nc3ccccc23)CCCC1,1 Z1865335088,CC(c1c(C2)cccc1)N2C(NC(CC1)CCN1c1nnccc1)=O,1 F5679-0084,O=C(Cc1csc(-n2cccc2)n1)N(CC1)CCC1c1nc(cccc2)c2s1,1 F5965-0078,Cc1cc(S(NCC2(CO)CC2)(=O)=O)cc(C)c1OC,0 F2245-0859,O=C(Cc(s1)ccc1Cl)Nc1cccc(Br)c1,0 Z1610101091,Cc1cc(C(N(CCC2)C2c2nc(-c3ccccc3)n[nH]2)=O)nn1-c1ccc(C)cc1,0 Z3510029394,CC(CC(N(CC12CCC2)CC1(CO)F)=O)CC(O)=O,0 SA43-0746,CN(CC(C1)(CN1C(c(cc(cc1)F)c1F)=O)C1)C1c1nc(-c2ccccc2)no1,1 F6515-0542,O=C(c1ccco1)NCc1cc(-c2cccs2)ncc1,1 F6445-1701,O=S(Cc1cc(F)ccc1)(NC(CC1)CN1c1nccs1)=O,1 F5772-6467,O=C(c(cc1)cc(nc2)c1n2-c1ccccc1)Nc1cnccc1,1 Z3278093206,Cc1cncnc1-c1noc([C@]2(CC3)[C@@H]3CNC2)n1,1 V010-0713,CCC(C)c1nc(N(CC2)CCN2C(Nc(cc2)ccc2C#N)=O)c(c(CCC(C)C2)c2s2)c2n1,0 Z1677621237,CC(C)c(cc1)ccc1N(C)C(c1c(N)n(C)nc1)=O,0 F6024-0399,O=C(C1(CC1)c1noc(-c2ccco2)c1)NCCCn1cncc1,1 Y043-8465,COc1cc(CCC2NC(CCCn3cccc3)=O)c2cc1OC,1 F6481-0944,O=C(CSc1ccncc1)N(CC1)CCSC1c(cccc1)c1Cl,1 F6573-5655,COC(c(cc1)cc(S(NCc2cnc(C3CC3)cc2)(=O)=O)c1OC)=O,0 E588-0660,CC(C1)OC(C)CN1C(Cn1c(cccc2)c2c(S(Cc(cccc2)c2Cl)(=O)=O)c1)=O,0 V026-6770,CCC(N=C(CN(Cc1ccco1)C(C1CCC1)=O)N1)=C(Cc(cc2)ccc2OC)C1=O,1 S839-0037,Cc1noc([C@]2(CN(CCO)C3)[C@@H]3CCN(Cc3cnccc3)C2)n1,1 Z1522649007,O=C(C(C1)c2c1cccc2)Nc1cc(Br)cnc1,0 M075-0809,COCCN(C(CC1)=O)c(cc2)c1cc2NS(c1cc(CCC2)c2cc1)(=O)=O,1 S039-3792,CN(CC1)CCN1C(N1)=NC(CCN(Cc(cc2)cc(OC)c2OC)CC2)=C2C1=O,0 F6190-0486,OC(CCNC(NCc1cccc2ccccc12)=O)C1CC1,1 F6353-6059,O=C(NCC(c1cocc1)N1CCSCC1)Nc1c(C(F)(F)F)cccc1,0 F6787-1363,Cc1ccnc(OCC2(CCC3)C3CN(Cc3noc(C4CC4)c3)C2)n1,1 P766-0293,C(Cc1ccccc1)c1nc(-c(cc2)cc3c2n(CCN2CCOCC2)nn3)no1,1 L695-0086,CN(c(ccc(S(N(CC1)Cc2c1cccc2)(=O)=O)c1)c1C(N1CCC(N2CCCC2)=O)=O)C1=O,1 L868-0096,Cc(cc1)ccc1NC(COc1nc(N2CCCC2)nc(C)c1)=O,0 Y041-8478,COc(cc1)ccc1N(CC1)CCN1C(CCCC(N(CCN1)CC1=O)=O)=O,1 Z287324458,O=C(NCc1cnccc1)N(CC1c2ccccc2)Cc2c1cccc2,1 Z1570976191,COc1c(COC(CC2)CCN2c(nccc2)c2F)cccc1,0 SB29-0251,Cc1c(CN(C[C@H](C2)OCc3ccccc3)[C@@H]2c2n[nH]c(C)n2)scc1,0 Z2715096738,CC(CC(F)F)(C1)CN1C(C1(C2)CC2C1)=O,1 F3406-7622,O=C(Cc1nnc(-c2cccc(Br)c2)o1)NCCc(cc1)ccc1Cl,1 Z1249308490,CSCC(CC1)CN1C(NC(CCN1c2cc(OC(F)(F)F)ccc2)C1=O)=O,0 F3406-9731,CC1=C(C)N=C(N)N(CC(NCc(cccc2)c2OC)=O)C1=O,0 Z2506217387,Cc(cc(cc1)S(N(CC2)CCC2OCC(O)=O)(=O)=O)c1Cl,0 8640-0142,CCN1C(SCC(Nc(cc2)ccc2C(C)=O)=O)=Nc(sc2c3CCN(C)C2)c3C1=O,1 F6656-2518,Cc(cc1)nnc1OCC(CC1)CCN1c1nccc(C(F)(F)F)n1,0 F9994-0322,Cc1ccc(Cn2c(N(CC3)CCC3C(NCc3cccs3)=O)nc3c2cccc3)cc1,1 Z1121002925,O=C(NC1CC1)N(CCC1)CC1n1c(cccc2)c2nc1,1 F1716-0140,CC(C)(C(C)(CC1)C(C2)=O)C12C(Nc1c(C)ccc(Cl)c1)=O,0 F5493-0091,Cc1nnc(C(CCC2)CN2C(CC2CCCC2)=O)s1,1 F323-0112,CC(C)(c(cc(cc1)S(N2CCCC2)(=O)=O)c1N1CC(N2CCN(C)CC2)=O)C1=O,1 F1716-0366,Cc(cc1)c(C)c2c1c(CC(Nc(cccc1)c1C(OC)=O)=O)co2,0 F3406-1252,O=C1N(Cc2nc(-c(cc3)cc(Br)c3F)no2)c(ccc(Cl)c2)c2OC1,0 V003-5189,COc1cccc(CN(Cc(cc(cc2)NS(c3cccc(Cl)c3)(=O)=O)c2OC2)C2=O)c1OC,0 F6411-3477,Cc1noc(C)c1CN1C(N(CC2)CCN2c2ccccc2)=Nc(cccc2)c2C1=O,1 Z1815641893,CC(c1nnnn1C)NCC1(CCOCC1)c1cccc(Cl)c1,0 F6554-0021,Cn1nc(C(CC2)CCN2C(c2cc(cccc3OC)c3o2)=O)cc1,1 S823-5051,CC(N[C@@H]1[C@@H](CO)CN(Cc(c(Cl)c2OC)ccc2OC)C1)=O,0 S984-1015,CN(C)C([C@@](CN(C1)C2CCCC2)(C2)[C@@H]1CN2C(c1ccccc1)=O)=O,1 Z2619736476,CC(C)c(cc1)ccc1-c1nnc(NC(NC(CC2)CC(C)C2O)=O)s1,1 S928-4632,CC(C)S(N1CC(Cc2nnc(-c3ccccc3)o2)CC1)(=O)=O,0 SB57-1516,Cc(nc1)cnc1C(N(C1)CC1(CN(C1)S(C)(=O)=O)C1c1nc(C2CC2)no1)=O,1 Z2296067400,CC(CC(O)=O)(c1cc(OC)ccc1)NC(c1c(C)sc(C)c1)=O,0 F6752-6242,CN(C)c1ccnc(N(CCC2)CC2C(N(CC2)CCC2(F)F)=O)n1,0 Z2800764137,CN(Cc(cc1)cc(F)c1Cl)C(CCN(C=C(C(N1)=O)C#N)C1=O)=O,0 S056-0423,COc1ncc(CN(CC2)CC2NC(NCc2ccco2)=O)cc1,1 Z2980898256,Oc(nc(C1CC1)cc1)c1C(N(C1)CC1c1cccc(Cl)c1)=O,1 Z229555944,CC(CC1)Cc2c1[nH]c(cc1)c2cc1C(N(CCC1)CC1c1nnc2n1cccc2)=O,1 F6539-2359,CN(C)S(N1CCC(CNS(Cc(cccc2)c2Cl)(=O)=O)CC1)(=O)=O,0 Z1234012879,CC(c1nnc(C)o1)N1CC(Cc(cc2)ccc2F)CC1,1 Z1956371737,CC(C)C(c(cc(cc1)F)c1F)NC(CC1)CCN1C(c1ccco1)=O,1 F6775-2569,FC(c1c(CN2CC(COc3nccnc3)CCC2)cccc1)(F)F,0 F6178-4354,N#Cc1cccnc1N1CCC(CNC(c2nc(cccc3)c3s2)=O)CC1,1 F6515-4004,O=C(Cc1cccc2ccccc12)NCc1cncc(-c2cnccc2)c1,1 F6523-1093,O=C(CNC(OCc1ccccc1)=O)N(CC1)CCN1c1nccn2nc(CCCC3)c3c12,1 F5012-0238,O=S(CCCOc(cc1)ccc1F)(NCC1OCCC1)=O,1 Z952491342,Cc1cc(C)nn1CC(NCC(c1ccc(C)cc1)N1CCCC1)=O,0 Z2677381794,O=C(C12CCNCC2)Nc2c1cccc2,0 Z1488242421,O=C(COc1cccc(NC(C2CC2)=O)c1)N1C2(CCC2)COCC1,1 F6734-2598,CCS(N1CC(CN(C2)c(cc3)nnc3-c3ccccc3)C2C1)(=O)=O,0 S751-1595,Cc1cnc(C2CCC2)n1CCNC(C1(CC1)c1ccccc1)=O,0 J006-1436,Oc(cc1)c(CN(CCCCC2)C2c2cccs2)cc1Br,0 F6560-4329,CC(C)C(Cn1ncnc1)NC(c1cc(Br)cs1)=O,1 Z1449559614,NC(CSc1c(cnn2-c(cc3)ccc3Cl)c2ncn1)=O,0 SC60-0985,CC(C)CN(C(C(C1)N2CC(C)(C)CN1C(c(cc1)cc3c1[nH]cc3)=O)=O)C2=O,1 Z1177088003,Cc1nc(CCCC2N(C)C(Nc(cc3)ccc3Cl)=O)c2s1,0 F6510-0830,CN(c(cccc1)c1N1CCNC(c2cc(Br)cnc2)=O)S1(=O)=O,0 Z31433444,Cc(cc1)cc(C)c1OCC(N1CCN(C)CC1)=O,0 F5591-1351,Cc1nc(-c(cc2)cnc2N(CC2)CCN2S(C2CC2)(=O)=O)no1,1 S994-0819,Cc1nc(S(N(CC2)CCN(CCN3Cc(cc4)ccc4F)C2C3=O)(=O)=O)cn1C,0 SB70-0917,CC1(CCCCC1)C(N[C@@H](Cc1c2)Cn1nc2C(NCCOC)=O)=O,1 F6619-6273,Fc1cc(F)c(CN(CC2)CCN2c2ncnc(N3CCOCC3)c2)cc1,0 Z1090584014,CN(C)CCc(cc1)ccc1NC(C(C1)COc(cc2)c1cc2OC)=O,0 Z1014387486,Cc1nc(cc(cc2)NC(C3CCCCCC3)=O)c2[nH]1,1 F5775-0118,COc(cccc1)c1C(Nc(cccc1)c1NC(C1(CCCC1)c1cccs1)=O)=O,1 F6481-0218,O=C(c1c[nH]c2c1cccc2)N(CC1)CCSC1c1ccccc1,1 Z1070606914,Fc1cccc(C2OCCN(Cc3nc(-c4cccc(Cl)c4)no3)C2)c1,0 V013-9794,c12c(n[nH]c1c1ccc(C(N[C@@H]3[C@@H](OCc4ccccc4)CCC3)=O)cc1)c1c(OC2)cccc1,1 Z968790400,COc1cccc(-n2nnc(CNC(c3ncccc3)=O)c2)c1,1 E922-1751,Cc1cccc(N(CC2)CCN2C(c2c(C3CCNCC3)n(-c(cc3)ccc3F)nc2)=O)c1C,1 F1757-0197,O=C(CN(CC1)CCN1C(c1ccco1)=O)Nc(cc(cc1)Cl)c1Cl,1 S937-0997,O=C(Nc(cc1)cc2c1OCCO2)N(C1)CC1n1c(-c2ccccc2)nnc1,1 D445-0073,O=C(CC1)N(c(cc2)ccc2S(N(CCC2)c3c2cccc3)(=O)=O)S1(=O)=O,1 F5644-0002,Cc(cc1)nnc1Oc(cc1)ccc1NC(C1CCCC1)=O,1 F6616-2287,O=C1N(C=CC=C2)C2=NC(NCc2cnccc2)=C1,1 Z1219222804,CCc1nn(C)c(NC(N(CC)C2CC2)=O)c1,1 Z1994615409,CC(CCNC1=O)C1NC(NCc1c(C)c(cccc2)c2o1)=O,1 Z2617776374,CON1CCC(CC(Nc2cccc(S(N3CCCCC3)(=O)=O)c2)=O)CC1,1 Z3101853791,Cc(n(C)nc1)c1NC(C1NCCOc2c1cccc2)=O,0 Z1276223335,CN(CC1CN(Cc2ccccc2)CC1)C(c1cocc1)=O,1 Z3345944893,Cc1c(C(C(O)=O)N(CC2)C[C@@H]3[C@H]2OCC3)ccc(F)c1,1 Z2272798018,Cc(cc1)ccc1OC(CC1)CCN1C(c(ccc(C(O)=O)c1)c1F)=O,0 Z2755555273,OC(c1cc(C(N(CC2OCCC2)Cc2ccco2)=O)ncc1)=O,1 S997-1804,OC[C@@]1(CN(Cc2ccccc2)C2)[C@H]2CN(Cc2c(C(F)(F)F)cccc2)CC1,0 V024-7427,COc(ccc(C1N(Cc2ccccc2)CCCn2c1ccc2)c1)c1O,0 F5033-7964,O=C(c(cc1)cc2c1OCO2)NCC(CC1)CCN1C(c(cccc1)c1F)=O,1 F6125-2651,CC(N(C1)CC1C(NCc(cc1)ccc1OC(F)(F)F)=O)=O,0 F6560-8290,Cn1ncc(-c2ncc(CNC(Nc3cccc4cccnc34)=O)cc2)c1,1 F6562-1011,Cn1ncc(C(CN(C2)C(NCc3cccs3)=O)c3c2cccc3)c1,1 Z2669630634,Cc1c(CNC(COc(cc2)ccc2F)=O)cncc1,0 F6484-2018,N#Cc1nccnc1OC(CC1)CCC1NC(Cn1cccc1)=O,1 F6415-0966,O=C(COc(ccc(Cl)c1)c1Cl)N(Cc1cocc1)Cc1cccs1,0 Z3687021297,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(c1cccc(N(CCCN2)C2=O)c1)=O,1 Z2640288218,CC(CN(C1)C(Cc2c(C)ccnc2)=O)Oc2c1cccc2,0 SA93-0362,NC(C1(CC2CC2)CN(Cc(ccc(Br)c2)c2F)CCC1)=O,0 Z1413252227,O=C(c1cscc1)N(CC1)CCN1C1COCC1,1 Z1445419720,CCc1cc(C(NCc2ccc(C(O)=O)o2)=O)n[nH]1,0 Z1021947698,CC(C(N(C1C2CN(C)CC1)c1c2cc(C)cc1)=O)N(C(C1(CCCC1)N1)=O)C1=O,1 F5831-6344,COCCN1CCC(CNC(CSc(cc2)ccc2F)=O)CC1,0 D534-0907,CC(CCCC1)N1S(c1ccc(CC2=CC(C)=NNC2=O)cc1)(=O)=O,1 Z1550271844,CC(C)(C(CCC1)N1C(Cc1cn(-c2ccccc2)nc1)=O)O,0 Z2256352631,CC(C)C(C)(CC(O)=O)NC(c(cc1)cc2c1OCC2)=O,0 F5596-0119,O=C(c1c(C(F)(F)F)cccc1)N(CC1)CCC1c1nnc(-c(cc2)ccc2F)o1,0 F5461-2005,O=C(c1cc(Br)cnc1)N1CCN(Cc2nc(-c3ccccc3)cs2)CC1,1 F6209-0484,COc(ccc(Cl)c1)c1NC(NCCCn1c(-c2ccccc2)ncc1)=O,0 F6808-5256,CC(C)NC(C(C)N(CC1)CCN1c1nc(C)cc(C)n1)=O,0 S979-0439,C[C@@H](COc(cc1)c(C2)cc1C(N1CCOCC1)=O)N2C(c1c(C)cc(C)cc1)=O,0 P890-0041,Cc1noc(C2(CCCCC2)NC(C2Oc(cccc3)c3OC2)=O)n1,1 SB99-0393,Cc1nc(C(N(CC2)Cc3c2n(C)nc3CCC(NC2CC2)=O)=O)co1,1 F2724-2497,COc(nccc1)c1C(Nc1cc(-c(cc2)nnc2N2CCOCC2)ccc1)=O,1 SA85-1075,CC(C)CN(CC(CN(C1)C(C2CCCC2)=O)O)C1=O,1 Z1798607777,CCC(C)(C1)OCCN1C(Nc1ncnc(OC)c1)=O,0 5593-2096,O=C(CC(C1=O)N(CC2)CCN2c2nc(cccc3)c3s2)N1c1cccc(Cl)c1,0 F1874-0950,CCOc(cccc1)c1NC(CSc1ncnc2c1cnn2-c1c(C)cc(C)cc1)=O,0 Z2697982801,CC1Oc(ccc(NC(c2c(C)n(C3COCCC3)c(C)c2)=O)c2)c2NC1=O,1 3076-0384,Cc(cc1)ccc1N(C(CC1Sc2nc(CCC(C3)c4ccccc4)c3cc2C#N)=O)C1=O,1 F2070-1256,O=C(C1c(cccc2)c2Oc2c1cccc2)NCc1nnnn1-c(cc1)cc(F)c1F,1 F6507-6040,Cn1c(C(CCNS(c(cccc2)c2OC(F)(F)F)(=O)=O)O)ccc1,0 Z4921677996,O=C(CNC(Nc1ccccc1)=O)N(CC1C2)C2CCC1NC([C@H](CC(N1)=O)NC1=O)=O,1 Z5007276840,Cc1cccc2c1nc(NC(C(CC1)CCN1c(ccc(C#N)c1)c1F)=O)[nH]2,0 S827-5165,CCOCC(N(CC(C1)(F)F)[C@@H]1c1nc(-c2ncccn2)no1)=O,0 L927-0143,COc1ccc(CN(C(c(scc2)c2N2Cc3nc(-c(cc4)cc(F)c4Cl)no3)=O)C2=O)cc1,0 Z290425048,O=C(c1c(CCC2)c2nc2ccccc12)NCC1CC1,1 V001-6674,CSc(nccc1)c1C(N1CCN(CC(c(cc2)ccc2Cl)OCc2ccc(C(F)(F)F)cc2)CC1)=O,1 Z2501066461,Cc1csc(C(N(C)Cc2nc(C)no2)=O)c1Cl,0 F6471-3474,COc(cc1)ccc1-c(cc1)ccc1S(N(CC1)CC1Oc1nccs1)(=O)=O,1 Y300-1765,CN(CC1)CCN1c1ccc(CNC(Nc2ccccc2)=O)cc1,1 Y020-0403,CCOc(cc1)ccc1N(C(CC1N(CC2)CCN2c(cc2)ccc2F)=O)C1=O,0 F6743-7793,CN(C(CCC1)CN1c(cncc1)c1C#N)S(C1CC1)(=O)=O,1 Z2444477250,C(C1)CC1(C1)CC1c1nc(-c2c(cc[nH]3)c3ncc2)no1,1 Z1212022037,CCN(CCC1)CC1NC(C(CC1)C(c(cc2)ccc2OC)N(C)C1=O)=O,1 F6445-3247,Cc1nn(cc(CCCNC(NCc(cc2)cc(OC)c2OC)=O)cn2)c2c1,1 Z1651013191,CN(C)C(C(CCC1)N1C(c1ccc(-c2ccccc2)o1)=O)=O,0 Z1762696402,C[C@H](C1)NCCN1S(c(cc1)cc(F)c1OC)(=O)=O,0 S779-2142,Cc1cnc(C2CCC2)n1CC(CC1)CN1C(C1CCCC1)=O,1 Z4353387879,CC(C(NC(CCC1)CN1C(C1CCC1)=O)=O)NC(c1ccco1)=O,1 Z1562845793,CC(C(NC1CC1)=O)N1CCN(CC(C)=Cc2ccccc2)CC1,0 SB32-0759,COC[C@@H](CN(C1)C(CCc2nc(-c3ccccc3)no2)=O)[C@H]1c1nc(C2CC2)n[nH]1,1 C716-0101,CCC(C(Nc1c(C)ccc(C)c1)=O)SC(NC1=O)=NC=C1S(c1ccc(C)cc1)(=O)=O,0 F2964-1579,C=CCn1c(SCC(N2CCCCC2)=O)ncc1-c(cc1)ccc1Br,1 Z1002340282,Cc1cc(CN(C)c(ccc(S(N)(=O)=O)c2)c2C(OC)=O)cc(C)c1OC,0 F6658-5671,Cc1c(C)ncnc1OCC(CC1)CCN1c1nccc(C(F)(F)F)c1,0 D450-0492,Cc1ccc(CN(c2nn3c(C)cc(C)nc3n2)S(c2ccc(C)cc2)(=O)=O)cc1,0 F6805-3109,CCc1nccn1CC1CN(CC(Nc(cc2)ccc2F)=O)C1,1 Z642426592,O=C(c1cc(C(NC(N2)=O)=O)c2nc1)N(CCC1)C1c1ccccc1,1 F6089-9672,O=C(NC1CCOCC1)Nc(cc1)ccc1N(CCC1)C1=O,1 Z2518183497,NC(N)=NCCC(c(cccc1)c1N1)C1=O,0 C444-0227,O=C(C(CCC1)CN1S(c1cccc2nsnc12)(=O)=O)NCC1Oc(cccc2)c2OC1,1 F1822-0279,O=C(C1CCCCC1)Nc(sc1ccc2)nc1c2Br,0 F3244-0187,CCOC(c1c(N)n(-c(cc2)ccc2Cl)nn1)=O,0 V020-9265,COc(cc1)cc(S(N2CCC(Cc(cc3)ccc3-c3ccccc3)CC2)(=O)=O)c1OC,0 F3411-1523,COC(c(cc1)cc(CN(C=N2)c(cc(C(F)(F)F)cc3)c3S2(=O)=O)c1OC)=O,0 F5578-1571,COc(cc1)ccc1-n1ncc(C(N2CCN(Cc(cc3)cc4c3OCO4)CC2)=O)c1-n1cccc1,1 S431-0876,O=C(c1nccc2ccccc12)N(CC1)CCC1(C1)OCCC1N1CCCCC1,1 F6475-0069,O=C(c(cc1)cnc1OC1COCC1)N(CC1)CCN1c(cccc1)c1Cl,1 8013-3849,Cc1cc(N(CC2)CCN2C(C2=Cc(cc(cc3)Br)c3OC2=O)=O)c(C)cc1,0 Z2624605170,CC(C)(C)O[C@H](C1)C[C@@H]1NC(N1CC(CCO)CC1)=O,1 F6708-8433,O=C(NCC1OCCC1)N1CC(C2)(CC2c2ccccc2)C1,1 S691-0959,Cc1cnc(CC2CN(Cc3cccc(F)c3)CC2)n1Cc1ccccc1,0 D473-1804,CC(C)Oc(cc1)ccc1NC(c1cccc(N(C(C(C)(C)C2)=O)S2(=O)=O)c1)=O,0 F6792-3381,CCc1cc(N2CCN(Cc3c(C)nc(C)s3)CC2)nc(SC)n1,0 S606-1132,COCCN(c1c(N2[C@H](CC3)CN3C(CCC3CCCCC3)=O)nccc1)C2=O,1 S827-0241,Cc1nc(C(N(CC(C2)(F)F)[C@@H]2c2nc(CCOC)no2)=O)co1,0 Z57902067,OC(C(CCCC1)C1C(Nc1nccs1)=O)=O,0 SC19-0481,CCn1nc(CN(CC2)CCN2C(c2nccnc2)=O)c2c1CCOC2,1 F6412-2289,O=C(c1cscc1)NCC#CCOc(cc1)cc2c1OCO2,1 Z2447719289,C[C@@H](C(NCc1c(CS(N2CCOCC2)(=O)=O)cccc1)=O)N,1 Z2882068645,O=C(Cc1n[nH]c2c1CCCC2)N(CC12CCC2)C1c1cnccc1,1 Z1556746235,CC(C)(C)OC([C@H](Cc1ccccc1)NC(c1c(cc(C)cc2)n2nc1)=O)=O,0 SB42-1121,CCN(Cc1ccncc1)C(CN(C[C@@H](CN1CCOC)N2[C@@H](CC(C)C)C1=O)C2=O)=O,0 F6411-0522,O=C(CN(c(cccc1)c1N=C1c2ccccc2)C1=O)NCc(cccc1)c1Cl,1 Z2335174586,O=C(c1cc(F)c[nH]1)N(CC1)CC1(C1)Oc(cccc2)c2C1=O,0 S981-0319,Cn(c(CC1)c2CN1C(NC1CCCCC1)=O)nc2NC(C1CC1)=O,1 Z1343762912,CC(c1nccs1)N(CCC(N1)=O)C1=O,0 F6559-6592,Cn1ncc(-c2noc(CNc3nccc(C(F)(F)F)n3)n2)c1,1 Z3814759582,OCCC(CCO)(CC1)CCN1C(c(cc1)ccc1S(Nc1nccs1)(=O)=O)=O,1 F6782-6575,COC(c1cccc(-n2c(SCc(cc3)ccc3F)ncc2)c1)=O,1 F5253-0179,O=C(c(cc1)cc2c1OCO2)NCCCS(N(CC1)CCN1c(cc1)ccc1F)(=O)=O,1 Y044-0882,CS(N(CC1)c(cc2)c1cc2C(CN(C=Nc1c2ccc(F)c1)C2=O)=O)(=O)=O,1 L066-0439,O=C(c1nnc(C(CCC2)CN2S(c2cccc3nsnc23)(=O)=O)s1)Nc1ccccc1,1 L498-0267,CC1CN(CCCNC(c(cc2)ccc2-c2nc(-c3ccccc3)no2)=O)CCC1,0 S576-0330,O=C(C(CC1)CN1C(C=NN1CC2CC2)=CC1=O)NCc1cccc(C(F)(F)F)c1,0 Y030-7520,CCCC(C)C(Nc1nnc(CC(C)(C)C)s1)=O,0 Z2995986886,Cn1nc(C2CCCC2)c(S(NC2C3(CCC3)NCC2)(=O)=O)c1,1 Z3104819108,Oc(c(CNC(NC(C1)C11CCOCC1)=O)ccc1)c1Cl,0 S632-0683,CN(CC1)CCC1[C@@H](CN(C1)S(c(cc2)cc(F)c2F)(=O)=O)[C@H]1C(N)=O,0 F2493-3608,Cn1c(cccc2)c2c(CC(NCc2noc(-c(cc3)cc4c3OCO4)c2)=O)c1,1 F6743-9931,CS(NC1CN(Cc2ccncc2)CCC1)(=O)=O,0 S903-1367,CC(C)CC(N(CC1)CCC1c1nnc(C2)n1CCN2C(C1CCOCC1)=O)=O,1 Z4607546008,Oc1ncc2c(C(N(CCN3)C(c(cc4)ccc4OC(F)(F)F)C3=O)=O)cccc2c1,0 S229-0754,OC[C@H](CCN(Cc1cccc(Cl)c1F)C1)[C@H]1NC(C1CC1)=O,0 F6709-4346,O=C(c(cc1)ccc1N1CCOCC1)N(C1)CC1Oc1cc(C(F)(F)F)ncc1,1 Z1715232317,CC1(C)Oc(cc(cc2)NC(c3coc(C4CCOCC4)n3)=O)c2O1,1 Z2982737396,CC(N(C)Cc1cn(Cc(s2)ccc2Br)nn1)=O,0 Z15687194,COC(CSc1c(c(-c2ccccc2)cs2)c2ncn1)=O,0 F5641-0011,Cc(cc1)nnc1Oc1cccc(NC(c(ccc(F)c2)c2F)=O)c1,1 F6429-0391,O=C(NCCN(C(C=C1)=O)N=C1n(cc1)c2c1cccc2)NC1CCCCC1,1 F6495-2386,COC(c1c(NC(c2ncnc(N3CCCCC3)c2)=O)scc1)=O,1 F6178-2585,CCc(s1)ccc1S(NCC(CC1)CCN1c1nc(cccc2)c2o1)(=O)=O,1 Z1666780632,Cn1nnc2cc(C(NC(CC3)CN3c3ncccc3)=O)cnc12,1 Z2998020550,C(c1noc(C2NCCOc3c2cccc3)n1)c1nccnc1,1 F6806-6268,CC(C)(C)C(NC(CC1)CCN1c1nccnc1)=O,0 Z1335917777,Cn1c(CSC(N(CCCCC2)C2=C2C3=O)=NC2=NN3c2ccccc2)cnc1,1 8019-5967,CN(c(sc1c2CCCC1)c2C(N1c(cc2)ccc2Cl)=O)C1=O,1 Z1840671809,CCOc(c(CC(NC1c2nn(C(C)C)cc2CCC1)=O)ccc1)c1Cl,0 P894-0140,CN(CCCNc1nnc(-c2nc(C3CC3)no2)c2ccccc12)c1ccccc1,1 G557-0284,CC(C)C(C(NCCCN(CC1)CCN1C1CCCCC1)=O)NS(c1cccs1)(=O)=O,1 L284-2459,CC(c(cc1)ccc1N(CC1)CCN1S(c1c(C)n(C)c(-c2nc(C)cs2)c1)(=O)=O)=O,0 F6564-5538,Clc(ccc(CN(CC1)CCN1c1nnc(C2CC2)cc1)c1)c1Cl,0 F6619-5557,C(c1cccc2ccccc12)N(CC1)CCN1c1ncncc1,1 F6609-1662,CC(CCCC1)N1C(Cn1c(-c2nc(-c(cc3)cc4c3OCO4)no2)ccc1)=O,1 Z1561039842,COc(c1ccccc11)ccc1S(Nc(cccc1O)c1F)(=O)=O,0 F2397-0092,CC(N=C1SC=CN1C1=O)=C1NC(C1c(cccc2)c2Oc2c1cccc2)=O,1 Z2183317379,CN(C)C1CCN(CCNC(N(C2)CC2(c(cc2)ccc2F)O)=O)CC1,0 F6014-0142,O=C(C(c1ccccc1)n1cccc1)Nc(cc1)cc(Cl)c1F,0 F6783-6115,CCc1nnc(cc2)n1nc2N(C1)CC(C2)C1CN2S(N1CCOCC1)(=O)=O,1 Z2175131640,COCc1nc(CNC(C(CC2)CN2c(cccc2)c2Cl)=O)cs1,0 F2200-0452,OCc(n1Cc(cc2)cc3c2OCO3)cnc1SCC(N(CC1)c2c1cccc2)=O,1 F3222-3752,COc(cc1)cc(s2)c1n1c2nc(-c2ccccc2)c1,1 F2629-0049,COc(cc1)nnc1-c1cccc(NS(c2cc(CCCC3)c3cc2)(=O)=O)c1,1 Z1198172355,COc1c2c(C(O)=O)n[nH]c2ccc1,0 F6734-1474,Fc(cc1)cnc1N1CC(CN(C2)c3nc(C4CC4)ns3)C2C1,1 F3382-6484,Cc(ccc(N(C(C1N(c(cc2)cc(C)c2Br)N=NC11)=O)C1=O)c1)c1F,0 Z3867033063,O=C(C(Cc1cnccc1)C1CCCC1)N(CC1)CC(NC(N2)=O)=C1C2=O,1 Z2408104103,CN(C[C@@H]1CCC2)C[C@H]1N2C(c(cccc1)c1OC1CC1)=O,1 F3406-5367,Cc1cccc(NC(CN(C2=O)N=C(C=C3)N2N=C3c(cc2)ccc2Cl)=O)c1C,1 SA59-0401,O=S(c1cccc2nsnc12)(N(CCN1CCOCC1)C1CCOCC1)=O,1 T853-0656,O=C(C1(CCC(N2Cc3ccccc3)=O)C2=CCCC1)NCCc1ccccc1,1 F6785-6243,O=C(c1nccnc1)N1CCC(COc(cc2)nn3c2ncc3)CC1,1 Y030-4252,COc(ccc(Cl)c1)c1C(NC1CCCCCC1)=O,0 F6556-4279,COC(CNS(C1CC1)(=O)=O)c1cc(cccc2)c2o1,1 Z1897729836,C[C@@H](c1cc(O)ccc1)NC(N(CC1)CC11OCc2c1cccc2)=O,1 F6788-7832,Cc1nc(N2CC(CN(C)S(C)(=O)=O)C2)nc(C)c1,0 F6204-0454,O=C(CN(C(CC1)=O)C1=O)NC1(CCCC1)c1cccs1,1 SB35-1065,Cc1n[nH]c([C@H](C2)N(CCCc3ccccc3)CC2(F)F)n1,1 Z1627810062,O=C(c1ccn[nH]1)NCCNC(NC1CCN(Cc2ccccc2)CC1)=O,1 F6749-0655,Fc1cnc(N2CCC(COc3ncccn3)CC2)nc1,1 S350-0365,O=C(CN(C(CO1)=C(C(c(cccc2)c2Cl)N2)C1=O)C2=O)NCCCc1ccccc1,1 E518-0961,COc(cc1)cc2c1c(CNCC1OCCC1)c(C(O)=O)n2Cc(cc1)ccc1F,0 F6454-2500,CCOc(cccc1)c1NC(C(NCC(CC1)CCN1c1cc(C)ncc1)=O)=O,0 D016-0624,CCN1CCN(CC(COc(cc2)cc(c(C(C)=O)c3C)c2n3-c2ccc(C)cc2)O)CC1,1 M060-0297,Cc(cc1)cc2c1OCCN2C(CSc1ncnc2c1[nH]c(cc1)c2cc1F)=O,1 SA57-0306,Cc1c(C(N(CC2)CCC2(C2)OCCC2Oc2nccnc2)=O)ocn1,1 Z4380082532,C[C@](CC1)([C@@H]1CC1)N1C(c1ccc(-c2n[nH]nn2)o1)=O,1 F6510-1923,CN(c(ccc(F)c1)c1N1CCNC(c2cc(cccc3OC)c3o2)=O)S1(=O)=O,1 Z2297791019,CCN(c(ccc(C(NC[C@H](C1)[C@@H]1C(C)C)=O)c1)c1NC1=O)C1=O,1 SC19-0583,CCn1nc(CN(CC2)CCN2S(Cc(cccc2)c2Cl)(=O)=O)c2c1CCOC2,1 Z3083919586,O=C(c1nc2ccccc2nn1)N(CC1)c(cc(cc2)F)c2N1C1CC1,1 Z4107122571,C[C@H]1O[C@@H](C)c2nn(C)c(C(N(C)Cc3cc(Cl)cn3C)=O)c2C1,1 Z2737388185,Cc1c(C(NCCn2nncc2)=O)[nH]c(cc2)c1cc2OC,0 S903-0196,CC(C)CC(N(CC1)CCC1c1nnc(C2)n1CCN2C(CCc1c(C)onc1C)=O)=O,0 Z2352625435,COc1cccc(C2(CNC([C@H](CC3)C[C@H]3C(O)=O)=O)CCCC2)c1,1 SC41-0030,FC(CC1)(CN1C1CCCCCC1)c1noc(-c2ccccc2)n1,1 F6668-2800,O=C(C(C1)CC1(F)F)N1CCC(COc2ncccn2)CC1,1 S219-0172,COc1cc(NC(N(C(C2)c3nc(C4CC4)no3)c3c2cccc3)=O)cc(OC)c1,0 Z1614006487,O=C(c1nc(-n2cncc2)ccc1)Nc(cc1)ccc1Br,0 F6562-9228,O=C(c1cc(cccc2)c2o1)NCc1nccnc1-c1ccco1,1 Z1522269228,CC(C)(C1)[C@H]1C(N[C@H]1CC[C@H](CO)CC1)=O,0 F6374-1636,COc(cc1)ccc1SCC(CC1)CCN1C(c(c(F)ccc1)c1Cl)=O,0 L728-0305,O=C(C(CCC1)N1C(c1ccccc1)=O)NCCc1csc(-c2ccccc2)n1,1 Z2999436011,COc1cc(C(N(CCC2)c3c2ccc(Cl)c3F)=O)ncn1,0 F6523-1098,O=C(c1cnc(C(F)(F)F)cc1)N(CC1)CCN1c1nccn2nc(CCCC3)c3c12,1 F6492-0074,COc(cccc1)c1N(CC1)CCN1C(C(CC1)Cc2c1[nH]cn2)=O,0 F3398-5553,CCOC(c1cccc(Nc2cc(C(N3CCSCC3)=O)nc3ccccc23)c1)=O,0 Y041-7898,N1(C(N[C@H](C1=O)CC(=O)NCC/C/1=C/CCCC1)=O)CCc1c[nH]c2c1cccc2,1 Z2974629066,CCc1ncnc(NCCN(Cc(cccc2)c2OC2)C2=O)c1F,1 V004-6960,CCCC(CN(CC1CC1)Cc(c(CC)nn1-c2ccccc2)c1Oc1cc(OC)ccc1)O,0 J105-0133,COCCN(C1(CCCC1)C(C(NCCC1=CCCCC1)=O)c1c2cccc1)C2=O,1 F8887-2824,CC(C)(C)OC(NC(C1)(CC1c1ccccc1)C(O)=O)=O,0 F6415-1157,COc1ccc(CCNC(N(Cc2cocc2)Cc2cccs2)=O)cc1,1 F6516-0642,O=C(CSc(cc1)ccc1F)NCc1ccc(-c2ccco2)o1,1 Z1629088096,CCC(C)C(N(CCC1)CC1C(Nc1ccc(cccc2Cl)c2n1)=O)=O,1 F6357-0150,O=C(CN(c(cccc1)c1O1)C1=O)NCC1(CCOCC1)c1cscc1,1 F1142-5891,O=C(CSc1nnc2n1cccc2)Nc(cc1)cc(Cl)c1F,0 Z3369128176,CC(c1nc(-c2cccn3ncnc23)no1)NC(CC1CCCCC1)=O,1 T987-2539,COc(cc1)ncc1C(N[C@@H](CCC1)[C@@H]1C(NCCC1=CCCCC1)=O)=O,1 Z2414053040,CCc1noc(C)c1CNC(N1C(C2CCOCC2)C2(CCC2)C1)=O,1 Z1492882968,CCOc(ccc(CN(CC1)CCC1N(CCCN1)C1=O)c1)c1OCC,1 F6481-4225,O=C(c1cc(cccc2)c2o1)N(CC1)CCSC1c1cccs1,1 Z872857964,CN(c(ccc(C(N(CC1)CCN1c(cc1)ccc1Cl)=O)c1)c1N1)C1=O,1 Z1328593537,Cc(c(COc1ccccc1)ccc1)c1NS(c1ccc(C(OC)=O)o1)(=O)=O,0 F788-0070,CCOc1ccc(CNC(c2c(C)c(-c3c(CC4)sc(C)n3)c4o2)=O)cc1,0 Z1067372020,O=C(Cn1nnnc1)N(CCCC1)C1c1c(C(F)(F)F)cccc1,1 SB24-0268,COCCNC(c1cn(C(CC2)C2(CC2)CCN2C(c2cocc2)=O)nn1)=O,1 S740-0776,COCCN(C([C@H](C[C@@H](C1)NC(Cc2cc(OC)ccc2)=O)N1CC1)=O)S1(=O)=O,0 F6471-3524,O=C(Cc1cccs1)N(C1)CC1Oc1nccs1,1 Z4421154381,Cc(c(CCNC(NC[C@H](CN(CC1)Cc2c1cccc2)O)=O)ccc1)c1Br,0 F6539-3412,O=S(Cc1ccc(C(F)(F)F)cc1)(NCc(cc1)ccc1-c1cocc1)=O,1 F6514-2788,O=C(c1noc(C2CC2)c1)N(C1)CC1OCC(F)(F)F,1 Z1116408955,O=C(Cc1c[nH]c2c1cccc2)N1C(CNC(Nc2ccccc2)=O)CCCC1,1 Z1715826192,CCc(cncc1)c1NC(C(C(C)C)OC)=O,0 Z1541974594,O=C(NC(CCC1)CN1c(cccc1)c1F)NC1c(cccc2)c2OCC1,1 S762-0067,CCN([C@@H](CCCC1)[C@]1(CC1)C(NCCc2c[nH]c3c2cccc3)=O)S1(=O)=O,0 C487-0318,Cc1n[nH]c(NC(CN(c(cc(cc2)C(NC3CCCCC3)=O)c2C(N2CC3OCCC3)=O)C2=O)=O)c1,1 Z1263198820,Cc1nn(C(CC2)CS2(=O)=O)c(NC(CN(CCC2)CC22CCOCC2)=O)c1,1 Z3026725548,CC1(CC1)C(N1CCC(COc2ncc(C(F)(F)F)cc2)CC1)=O,0 F5857-6815,OC1(CNC(Nc2c(C(F)(F)F)cccc2)=O)C=CCCC1,0 F3222-5047,Cc(cc1)ccc1-n1ncc2c1N=CN(Cc1nc(-c(cc3)cc(Br)c3F)no1)C2=O,0 F0508-5037,O=C(c1ccco1)NCc(n1-c(cc2)ccc2F)nnc1SCc(cc1)ccc1Br,1 Z2960559394,CCc(ccc(Br)c1)c1C(N(C)Cc1noc(O)n1)=O,0 Z1918809303,CN(CCOc1cccc(Cl)c1)C(N(CC1)CCS1(=O)=O)=O,0 Z1617219037,Cn1c(C(c(cc2)ccc2OC)NC(C(C2)CC2=O)=O)ncc1,1 V028-8828,Cn1c(ccc(F)c2)c2c(C2)c1CCN2C(Nc(ccc(OC)c1)c1OC)=O,0 F6436-3254,CC(CNC(CCc(cccc1)c1Br)=O)(CSC)O,0 Z489301942,O=C(NCc1ccc(-c2nc(cccc3)c3s2)o1)N1CCC1,1 Z1117857314,Cn1c(-c2nccnc2N)nc2c1ccc(Cl)c2,0 Z3634617150,O[C@H](CC[C@@H]1CC2)[C@H]1N2C(Nc1nccs1)=O,1 Z3383620586,NC[C@@H](CN(Cc1ccccc1)C1)[C@H]1C(NCCc1c(CCCC2)n2nc1)=O,1 Z2761331120,OC([C@@H](CC1)O[C@@H]1C(CC1)CCN1C(CN(CCC1)C1=O)=O)=O,1 E942-0071,CC(C)CN(C=C(c1c2cccc1)NC(N(CC1)CCN1c1ncccc1)=O)C2=O,1 Z113962960,Cc1cccc(N(c(n2-c3c4cccc3)nnc2SC)C4=O)c1C,1 F6212-0005,Cc1cc(C)nn1CCNC(c1c2OCCCn2nc1)=O,1 S740-1303,COCCCN(C([C@H](C[C@@H](C1)NC(Cc(cc2)ccc2F)=O)N1CC1)=O)S1(=O)=O,0 F114-0471,COCc1nc2cccnc2n1C(CC1)CCN1C(Nc(ccc(OC)c1)c1OC)=O,0 Z3788706347,Cc1noc(C(C2)CN2C(NC2CN(C)CCN(C)C2)=O)n1,1 S343-1347,COc(ccc(Cc1nc(C(C2)CN(C3CCCCC3)C2=O)no1)c1)c1Cl,1 Z2095095121,CC(C(c1cccc(Cl)c1)O)NC(c1c[nH]nc1-c(s1)ccc1Cl)=O,1 F6436-3977,COC(N(CC1)Cc2c1ccc(NS(c1cccc3cccnc13)(=O)=O)c2)=O,1 F6564-8411,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)NCCN1N=C(CCC2)C2=CC1=O,1 Z2235073650,Cn1ncc(-c2nc(cccc3)c3[nH]2)c1NC(C1CC1)=O,1 Z1865483839,CC(C)(CCC1)C1C(NS(c(cc1)cnc1OC)(=O)=O)=O,1 Z1269639742,Cc(cccc1)c1C(NC(CCC(N1)=O)C1=O)=O,0 F6524-0483,O=C(CSc(cc1)ccc1F)NCCN(C=Cc1c2occ1)C2=O,1 F3382-3031,CCOC(CSC(N(c1ccccc1)C1=O)=Nc2c1[nH]cc2-c1ccccc1)=O,1 F5223-0028,O=C(C(NCc(cc1)cc2c1OCO2)=O)NCC1(CCCC1)c1cccs1,1 Z1002043524,CC1CCN(CN(c2cccc(Cl)c2C2=O)C2=O)CC1,0 F5836-0036,O=C(c(o1)ccc1Br)Nc(cccc1)c1NC(c1cnccc1)=O,1 E213-0514,CCOc(cc1)cc2c1nc(NC(c1c(C)c(C(N(CCCCC3)C3=N3)=O)c3s1)=O)s2,1 Z1537769787,O=C(CNC(c1cscc1)=O)NC(CC1)CCC1(F)F,1 Z109254696,O=C(c(ccc(Br)c1)c1F)NCc(cc1)cc2c1OCCO2,1 Z2203349123,COc(nccc1)c1-c1noc(C2(CCOCC2)S(C)(=O)=O)n1,1 SA68-0837,CC(C)N(CC1)CCC1N(CCNC(NC1CCCC1)=O)C1CCOCC1,1 Z5020307834,Cc(cc(cc1)O)c1-c(cc1)cc(CC2)c1C2=O,0 F6508-1235,O=C(C1COCC1)NCC(c1ccco1)c1cccs1,1 Z3308136998,C(c(cc1)cnc1-n1nccc1)N(CC1)CCN1c1ncccc1,1 F6445-7812,COC(C(C(N(CC1)CCN1S(C1CC1)(=O)=O)=O)=CN1c2ccccc2)=CC1=O,1 F5772-8774,Cc(cc1)cc(C)c1-c1nnc(NC(NCc(cc2)ccc2F)=O)o1,1 Z2085869907,O=C(c(cc1)ncc1OC(F)F)N1CC2(COCCC2)OCC1,0 F2199-0242,CC(C)(C)OC(N(CC1)CCN1c1nc(cccc2)c2n1C)=O,0 Z1348887222,CCS(C(CCC1)CC1NC(c1c2[nH]c(CCCC3)c3c2ccc1)=O)=O,1 Z1651294021,CS(NCCNC(c1nccnc1Sc1ccccc1)=O)(=O)=O,0 SB40-0642,CC(C)CN(CC1NC(c2cncn2C)=O)CC2(CCOCC2)NC1=O,0 Z1766776794,OCCS(c(cc1)ccc1NC(c1c[nH]nc1-c1cc(cccc2)c2o1)=O)(=O)=O,1 Z1305295060,NC(CC(CC1)CCN1C(NC(CCC1)CN1c(cccc1)c1Cl)=O)=O,0 S530-0141,CC(C)NC(N1Cc(cccc2)c2OC2(CCN(C)CC2)C1)=O,0 F6788-3176,CCc1cnc(N(CC2)CCN2c2nc(C3CC3)nc(C3CCC3)c2)nc1,1 Z2294305541,CC(C)(c1nnc2n1CCCC2)NC(Nc1c(cc(cc2)F)c2ccc1)=O,1 Z3316383165,C[C@H](c1cnc(C(F)(F)F)cc1)NC(C(N(C)Cc1nn(C)cc1)=O)=O,1 F6497-0415,O=C(c1cc(-c(cc2)ccc2F)n[nH]1)N1CC(Cc2nc(C3CC3)no2)CCC1,1 Z1714581193,Cc1nc(N2C(CO)COCC2)cc(Cl)n1,0 F5042-0098,COc(cc1)cc(S(N(CC2)CCN2c(cc2)nnc2-c2cccs2)(=O)=O)c1OC,1 C548-1315,CC(CC1)CCC1NC(CN(c1cc(C)cc(C)c1)S(C(C(N1)=O)=C(C)NC1=O)(=O)=O)=O,1 SC56-0164,Cc1nnc(C2C(C3)(CN3S(c(cccc3)c3Cl)(=O)=O)CN(C)C2)o1,0 C430-5010,CCc(cccc1C)c1NC(c(cccc1)c1C1=O)N1c(cc1)ccc1OCC,0 SD56-0476,O=C(CCCc1nc(cccc2)c2s1)N(CCC1)CC(C(N2c3ccccc3)=O)N1C2=O,1 T808-2143,Cc1noc(C(CN(C2)C(CSc3ccccc3)=O)C22CCOCC2)n1,1 Z2139293927,CC(C(c1cccc(Cl)c1)O)NC(c1c[nH]nc1-c(cc1)cc2c1OCCO2)=O,1 Z4656744138,CC(C(NCCN(C)C(c1c2[nH]ncc2cc(C)c1)=O)=O)n1nccc1,1 Z1896081368,Cc(n(-c1c(C)ccc(C)c1)nc1)c1NC(c1ncc[nH]1)c1ncccc1,1 Z2712667197,Cc1cccc(O)c1C(N(CC1)CC11CN(Cc2ccccc2)CC1)=O,0 Z1655483652,C[C@@H](C(NCc1c[nH]nc1C)=O)c1ccccc1,1 Z3328005706,CC(C)c1ccc(C(c(cc2)ccc2Cl)N)cc1,0 F6200-1607,CC(CNC(c1cc(OC)cc(OC)c1)=O)(c1ccccc1)O,0 F0906-0675,OC(CCC(Nc(cccc1)c1-c1ccccc1)=O)=O,0 SB14-0976,O=C(C1CC1)N(C(CC1)CN1C(c1nc2ccccc2cc1)=O)C1CCOCC1,1 S893-0690,CC(C)CCNC(N(CCC1)C1c1nn(CCOc2ccccc2)c2c1COCC2)=O,0 SA87-0557,Cc1c(CC(NCC(CN2CCOC)OCC2=O)=O)cccc1,0 F6188-0738,Cc1noc(C)c1S(NCC1(CCOCC1)Sc1ccccc1)(=O)=O,1 F6608-2426,COc(cc1)c(CN(CC2)CCC2Oc(nc2)ncc2F)cc1Br,0 Z850748922,CCc(cc1)ccc1C(N(CC1)CCN1C(Cc1ccncc1)=O)=O,1 F6561-8726,Cn(c(C(NCCN(C(c1c2nccc1)=O)C2=O)=O)c1)nc1-c(cc1)ccc1F,1 Z3071615690,Cc1conc1CN(CC1)CCN1c1c2nc[nH]c2ccc1,1 S691-0552,CCn1ncc(S(N2CC(Cc3ncc(C)n3CC3CC3)CC2)(=O)=O)c1,1 F6521-9261,OC(CNC(Nc1cccc(Cl)c1)=O)(C1)Cc2c1cccc2,0 S556-0482,COc1ccc(C2(CC2)C(N(C2)CC2Oc(cc2)ccc2-c2noc(C3CC3)n2)=O)cc1,0 Z2958880277,O=C(c1coc(C2CCCCC2)n1)Nc1c[nH]nn1,1 F6438-2511,CN(C)c(nc(N(C)C)nc1)c1NC(COc(cc1)nnc1-n1nccc1)=O,1 F6514-2300,O=C(CCc(cc1)cc(C(F)(F)F)c1Cl)NC(C1CCOCC1)c1cnccc1,0 F3225-6264,O=C1C(C(N(CCc2ccccc2)C(C2CCCCC2)=N2)=O)=C2Oc2c1cccc2,1 Z1865477998,COc(cc1)ncc1S(NC(C1CCCCCC1)=O)(=O)=O,1 J093-0237,COc(cc1)ccc1-c1nc2nc(C(Nc3cc(OC)cc(OC)c3)=O)nn2c(C(F)(F)F)c1,0 SB14-1188,COCC(N(C(CC1)CN1C(c1cc(OC)cc(OC)c1)=O)C1CCOCC1)=O,1 F2088-0036,O=C(CSc1nccn1C1CCCC1)NC1CCCC1,1 F0806-0830,N#Cc(cccc1)c1NC(c1cccc(C(F)(F)F)c1)=O,0 L815-0677,N#Cc(cc1)cc(F)c1C(NC(C(N(CCC1)c2c1cccc2)=O)c1ccccc1)=O,0 Z3269089428,CC1(c(cc2)ccc2C(O)=O)n2nnnc2-c(cccc2)c2N1,0 F6452-0791,CCC(CNS(c1c(C)ccc(C)c1)(=O)=O)(c1ccccc1)OC,0 F6516-1787,O=C(c1cnc(C(F)(F)F)cc1)NCc1ccc(-c2cocc2)o1,0 F5889-0056,O=C(CNC(c1c[nH]c2c1cccc2)=O)NCC1OCCC1,1 SA01-0716,CC(C)NC(c1cnc(N(C)C)nc1C1CN(Cc2c(C)ncs2)CC1)=O,1 F3398-5766,Cc(cc(c(OC)c1)NC(COc2nc(N3CCCC3)nc(C)c2)=O)c1Cl,0 SA96-1339,O=C(CC1CCCC1)N(C1)CC1(CN(Cc1ccccc1)C1)C1C(N1CCCC1)=O,1 SB91-0277,O=C(C1CC1)N(CCN1CCCCC1)C(CC1)CN1C(c1cscn1)=O,1 SA24-1684,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c(ccnc1)c1F)=O,0 Z2157750545,O=C1NC(Cc2nc(C(c(cc3)ccc3F)(F)F)no2)CCC1,0 F6178-7590,O=C(c(o1)ccc1Br)NCC(CC1)CCN1C1CSCC1,1 F6359-3891,Cc(cc1)nnc1OC(CC1)CCN1C(NCCc(cc1)ccc1OC)=O,1 SC58-0186,CCOCC(N(C1)CC1(CN(C)C1)C1c1ncc(C)o1)=O,0 Z3616461017,O=S(c(snc1)c1Br)(NCC1CC1)=O,0 F6560-7695,O=C(C(CC1)Oc2c1cccc2)NCc(cc1)cnc1-c1cocc1,1 S615-0513,Cc1c(C(N(CC2)CC2c2nc(CCOCC3CCCC3)no2)=O)sc(C)n1,1 Z1766100272,CC(c1cn(C)cc1)NC(c1c[nH]nc1-c1cscc1)=O,1 Z1352982267,Cc1nc(C(CCC2)N2C(NCCc2cc(C(NC)=O)ccc2)=O)no1,1 Z4644052472,C[C@@H](C1)[C@H]1C(N(C1)CC2(CCC2)C1Nc1c2nc(C)sc2ncn1)=O,1 Z2965347240,OC[C@@H](COc1c2cccc1)[C@@H]2NC(Cc(cc1)cc(Cl)c1F)=O,0 Z3799775179,CCCc1nc(C)c(C(N(CC[C@@H]2CC3)[C@]23c2nnc(COC)o2)=O)s1,1 J038-2682,Cc(cc1)cc([C@H]2OCC[C@H]22)c1NC2c1ccccc1,0 F6031-0452,Cc1cc(C(N2CCN(CC(C3CC3)O)CC2)=O)no1,1 Z2277371893,CC(C1)=CCCN1C(c1cc(C(N(C)C(N2C)=O)=O)c2s1)=O,1 E521-1202,O=C(CCCN1c2ncccc2OC(c2ccccc2)C1=O)Nc(cccc1)c1Br,1 F6561-5743,Cn1ncc(-c2nccc(CNC(C3CC3)=O)c2)c1,1 F5033-2293,Cc1cc(C(NCC(CC2)CCN2c2ncccn2)=O)c(C)o1,0 F6469-2420,O=C(CSC1CCCC1)N(CC1)CCN1c1ncnc(-n2ncnc2)c1,1 Z1124502529,CC(C)(C)CCNc1c(C)ccnc1,0 F6658-6209,Cc1cc(OCC(CC2)CCN2C(c(cc2)cc(F)c2OC)=O)ncn1,0 Z1225213208,CC(N1CC(N(CCC2)C2c2cc(N(C)C)ccc2)=O)=C(C)SC1=O,0 F5869-0048,O=C(c1cc(Oc2ncccn2)ccc1)Nc(cc1)ccc1OC(F)(F)F,0 F6411-1422,COCC(N=C(c1ccccc1)N12)=CC2=NN(CC(N(CCC2)c3c2cccc3)=O)C1=O,1 F2135-1581,Cn1c(SCC(Nc(cccc2)c2C(OC)=O)=O)nnc1,0 Z2358852848,CC(C)(C)C(C1)OCCN1S(c1c2OCCCn2nc1)(=O)=O,1 Z2937598565,CC(C)C[C@@H](C(O)=O)NS(c1nn(C)nc1)(=O)=O,0 S779-2350,Cc1cnc(C2CCC2)n1CC(CC1)CN1S(c(cc1)cc2c1OCCO2)(=O)=O,1 Z4120059575,Cc1cccc(Oc2cccc(NC(CCc3nc(-c4nnc[nH]4)no3)=O)c2)c1,0 Z1527027279,COCC(CC1)(CCN1c1nc(-c2ccccc2)ncc1)O,0 F5788-1286,CS(N(CC1)CCN1C(CN(CCN1c(cccc2)c2F)C1=O)=O)(=O)=O,0 8015-4988,OC(CC(c(cc1)ccc1OC1CCCC1)NC(c1cccs1)=O)=O,1 F6524-6235,CC(C(N(CC1)CCN1C(CC1)CCS1(=O)=O)=O)Oc(cccc1)c1F,0 T158-1429,Cc1cnc(C(CC2)CN2C(C2(CC2)c(cc2)ccc2OC)=O)n1Cc(cc1)ccc1F,1 J005-0495,CC(C)c1cc(C(CCC2)N2S(c2c(C)ccc(C)c2)(=O)=O)no1,0 Z1744054501,Fc1cc(F)c(C(C2)OCCN2c2nc(cccc3)c3[nH]2)cc1,0 SA04-1485,CCOCc1cnc(C)nc1C(CCC1)CN1S(Cc(cc1)ccc1Cl)(=O)=O,1 K906-3702,CN(CC(Nc1nc(ccc(OC)c2)c2s1)=O)S(c(cc1)cc(C(NC2)=O)c1NC2=O)(=O)=O,1 Z769785608,O=C(NCc1nnc2n1CCCC2)OCc1ccccc1,0 S614-0131,N#Cc1cccc(CN(CCCC2)C2c2nc(CCOCc3ccccc3)no2)c1,0 Z2467359450,CCn1nnc(CNS(c(cc2)c(C)cc2C(O)=O)(=O)=O)c1,1 M026-1305,Cc1noc(/C=C\c(cc2)ccc2S(NCc(cc2)ccc2Cl)(=O)=O)c1NC(C1CC1)=O,1 Z2984443676,FC(c(cccc1)c1-c1nc(Cn2nnc(C3CCC3)c2)co1)(F)F,1 F6754-7348,OCCN(CC1)CCN1c1ncc(cc(cc2)Br)c2n1,0 SC58-0283,Cc1cnc(C2C(C3)(CN3C(c3cc(-c(cc4)ccc4OC)n[nH]3)=O)CN(C)C2)o1,1 F3083-0116,CC1CCN(CC(COc(cc2)ccc2NC(C)=O)O)CC1,0 S836-4103,OC[C@@H](CN(Cc(cc1)ccc1OC(F)(F)F)C1)[C@H]1C(NC1CC1)=O,0 F5791-1896,O=C(c1n[nH]c(-c(cc2)ccc2F)c1)NCc1cccs1,1 F0657-0429,CCC(CC)C(Nc1cc(-c2c(C)n(cccn3)c3n2)ccc1)=O,0 V024-5689,CCNC(N(Cc(c(C)nn1-c2cccc(Cl)c2)c1Oc(cc1)ccc1OC)C1CC1)=O,0 Z1514446052,CC1(CCC1)NC(c1ccc(C#N)[nH]1)=O,0 T140-1096,O=C(C1OCCC1)N(CC1)CCC1(N(Cc1ccccc1)C(C1)=O)S1(=O)=O,1 Z363103996,CC(C)NS(c(cc1)cc(C(Nc(cc2)ccc2-c2nc(cccc3)c3[nH]2)=O)c1F)(=O)=O,0 Z1269781097,Cn1c(C(Nc2n[nH]c(C3CCOCC3)c2)=O)ccc1,1 Z1129433448,CN(CC1CN(C)CC1)C(c1c[nH]c2c1ccc(Cl)c2)=O,1 Z2949913014,CCc1noc(C)c1NC(N1C[C@H](C)N(CC(F)(F)F)[C@H](C)C1)=O,0 Z1175487828,CNC(C(CCC1)CN1C(CN(C(CC1)=O)c2c1cccc2)=O)=O,0 F6789-1820,Cc(nc1cc2)cn1nc2C(N(CC1)Cc2c1scc2)=O,1 Z1680324899,CCOc(cccc1)c1N(CC1)CCN1C(C(C=C1)=CN(c2cn(C)nc2)C1=O)=O,1 Z2294007950,CCC(C)(CNC(N(CCC1)CCN1S(C)(=O)=O)=O)OC,0 Z2119830024,O=C(c(cccn1)c1F)N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Cl,0 Z2953226374,CCn1c(CCNC(C2(C)c(cccc3)c3OCC2)=O)nnc1,1 F6539-2547,CN(C)S(N1CCC(CNC(Nc(c(F)ccc2)c2F)=O)CC1)(=O)=O,0 F6793-7355,O=C(CN(C(C=C1)=O)N=C1c1ccncc1)N1CCN(CC(F)(F)F)CC1,1 Z3049538364,Cc(n(C)nc1)c1NC(C1(CC2)CCC2CC1)=O,1 Z26793114,O=C(CC1CCCCC1)Nc(cc1)cc(N2)c1NC2=O,1 F6472-0822,O=C(Cc1cnccc1)NCCSC1CCOCC1,1 F6274-0125,COc1cccc2c1nc(N(C1)CC1OC(c1ccco1)=O)s2,1 S632-4223,CNC(N(CC1)CCC1C(CC1)CN1C(c1cccs1)=O)=O,0 Z54787107,COC(CC1N(CC(N2CCCCC2)=O)CCc(cc2OC)c1cc2OC)=O,0 D470-1921,O=S([C@@H](CS(C1)(=O)=O)[C@H]1NCc(cccc1)c1F)(c(cc1)ccc1F)=O,0 Z1719395933,O=C(CCc1c2OCOc2ccc1)N(CC1)CCN1C(Cn1nnnc1)=O,1 F5832-4723,COc1cccc(C(CNC(CSCc2ccccc2)=O)N2CCOCC2)c1,1 S976-1444,Cc1c(CN(CCC2)CC2(C(N2CCCC2)=O)F)cnn1C,1 F6411-1071,CCOC(N(CC1)CCC1NC(CN(C=CN(Cc(cc1)ccc1Cl)C1=O)C1=O)=O)=O,1 Z1445539547,OC(C(CNC(C(C1)C1c(cc1)cc2c1OCCO2)=O)c1ccccc1)=O,1 F6787-0294,CCNC(N1CC(COc2ncnc(C)c2C)(CCC2)C2C1)=O,1 Z1670312071,Cc(cc1)nc(O)c1NC(C(c1c2cccc1)=NNC2=O)=O,0 Z1978993346,O=C(c1conc1C1CC1)NCC(F)(F)F,0 Y020-3540,O=C(C(CC(N1)=O)C(C(N2)=O)=C1N=C2N(CC1)Cc2c1cccc2)Nc(cccc1)c1F,0 Y042-3416,O=C(C(C1)CN(Cc2ccco2)C1=O)Nc1nc(cccc2)c2[nH]1,1 S957-5146,N#Cc(cc1)c(C(F)(F)F)cc1N1CC(CC2)(CCN2C(C2(CC2)c2ccccc2)=O)C(CO)C1,0 Z1419927640,CS(c(cccc1)c1NC(CC1)CN1C(C1CCCCC1)=O)(=O)=O,1 Z1334432103,CC(C1CC1)C(Nc1nc(cccc2)c2n1CCc1ncccc1)=O,0 F6089-8223,O=C(COc1ccccc1)N1CCC(CNC(C2(CC2)c(cc2)ccc2F)=O)CC1,1 F6774-4164,CC(C)(C)c1nccc(N(CC2)CC2Oc(nc2)ncc2OC)n1,0 F3202-0616,CC(CN(CC1)S(c(cc(cc2)F)c2OC)(=O)=O)N1S(c(cc(cc1)F)c1OC)(=O)=O,0 S826-2177,Cc1noc([C@@H](C2)[C@@H](COCC3CC3)CN2C(c2cnc(C)cc2)=O)n1,1 Z3712896022,Cc(cc1)cc2c1n(CC(NCC1(CC1)n1nncc1)=O)cn2,1 Z1075426054,O=C(NCc(cc1)cc(F)c1Oc1cnccc1)N1CC(c2cc(F)ccc2)OCC1,0 F6471-3893,O=S(C1CCCCC1)(N(C1)CC1Oc1nccs1)=O,1 S254-0653,O=C([C@H](C[C@@H](C1)F)N1C(NCc(cc1)ccc1F)=O)N(CC1)Cc2c1cccc2,1 F5834-5540,O=C(C1(CC1)c(cc1)ccc1F)N(CC1)CCN1c1ncccc1,1 F123-0039,Cc1c(CN(CC2)CCN2S(c2cccs2)(=O)=O)nc(-c(cc2)ccc2OC)o1,1 Z2370161670,C(C1)[C@H](C2)O[C@@H]1[C@@H]2c1nc(-c2cc(scc3)c3nc2)no1,1 F5954-0012,C(CC1)CC1Nc1c(cnn2-c3ccccc3)c2nnn1,1 8018-5830,CC(C1CC1)(c1cc(-c(cc2)ccc2OC)no1)O,1 Z811875396,Cc1c(C(N(CC2)Cc(c3cc(Cl)c4)c2[nH]c3c4Cl)=O)c(C)nn1C,1 Z2578099443,O=S(CCc(cc1)ccc1F)(N(Cc(ccc(F)c1)c1F)C1CC1)=O,0 SB94-0249,Cc1nc(C(N2CCC(CN(CC(C3)C(N4CCCC4)=O)C3=O)CC2)=O)co1,1 S233-2144,O=C(c1ncncc1)NC[C@](CCC1)(CC2)[C@@H]1N(Cc1ccccc1)C2=O,1 F6439-2617,O=S(Cc(cc(cc1)F)c1F)(NCCn(c(C1CC1)c1)nc1-c1ccncc1)=O,1 3261-0173,CCOc(cc1)ccc1NC(c1c(NC(c(cccc2)c2Br)=O)sc2c1CCC(C)C2)=O,0 3209-0969,O=C(c1c(N[C@@H](C[C@@H]2C(F)(F)F)c(cc3)ccc3Br)n2nc1)NCc1ccco1,1 F6443-6788,O=C(CCN(C=Nc1c2cccc1)C2=O)NCC(CCC1)N1c1nccs1,1 Z4883581178,Cn(c(cccc1)c1n12)c2nnc1SCc1cncc(C(O)=O)c1,1 F6472-2829,COC(CC1)CN1c(cc1)ccc1C(N(C(CC1)C2)C1CC2n1nncc1)=O,1 F0651-0136,Cc1cc(cc(CNC(C2CCCC2)=O)cc2)c2n1C,1 K889-1418,O=C(CNC(CN(C=Nc1c2c(CCCC3)c3s1)C2=O)=O)Nc1cc(C(F)(F)F)ccc1,0 Z2798535973,CCC(C(Nc(ccnc1)c1-c1ccccc1)=O)SC,0 F3411-0182,CCOc(cc1)cc2c1N(Cc1c(C)cccc1)c(nccc1)c1C2=O,1 G837-0046,O=C(c(cc1)ccc1S(N(CC1)Cc2c1cccc2)(=O)=O)Nc1nc(cccc2)c2s1,1 Z2222549642,CN(Cc1nc(C(F)(F)F)cs1)C(c(cc1)cc(NC(CN2)=O)c1C2=O)=O,1 F6802-7858,CS(c(cc1)ccc1N(CCC1)CC1C(N1CCOCC1)=O)(=O)=O,1 F1813-0162,Cc1ccc(C)c2c1nc(NC(c(cccc1)c1Br)=O)s2,0 S925-0585,C[C@@H]1N(Cc2cnccc2)[C@H](CNC(c2cocc2)=O)CN(C)C1=O,1 E957-1210,CCCN(CC1)CCN1C(c(oc1c2cccc1)c2NC(COC)=O)=O,0 F6793-5388,O=C(c1cc(Br)cnc1)N1CC(CF)CCC1,0 Z2466249374,Cc1noc(C)c1-c(cc1)ccc1S(C)(=O)=O,0 F0006-0381,CN(C)CCn(cc1)nc1-c1cccc(-c(cc(cc2)F)c2OC)c1,1 F5772-0026,CCCCOc(cc1)ccc1NC(N(CC1)CCC1c1nc(cccc2)c2[nH]1)=O,1 E717-0175,CCCn1c(C(N(CC(NC(CCC2)c3c2cccc3)=O)N=C2)=O)c2c2c1cccc2,1 F6476-6155,CC(C)c(cc1)ccc1N(CCN1CC(N(CC2)CC2Oc(ccnc2)c2Cl)=O)C1=O,1 F3398-0524,Cc(cc1)cc(Br)c1NC(CSc(cc1)nnc1NCc1ccccc1)=O,0 F6445-0238,O=C(c1cc(Oc2ncccc2)ccc1)NCCCN1N=CC=CC1=O,1 F510-0148,CC(c(cc1)ccc1NC(CN1c(cc(cc2)C(N3CCCCC3)=O)c2SCC1=O)=O)=O,1 Z1273453518,O=C(CCC1CCOCC1)Nc(cc1)ccc1-n1ncc2c1N=CNC2=O,1 V028-9538,CN(C)c(cc1)c(CN(CC2OCCC2)C(COC)=O)cc1NC(C1CCC1)=O,0 SB75-0005,Cc1noc([C@@](C[C@@H](C2)NS(C3CC3)(=O)=O)(C3)[C@@H]2CN3C(COC)=O)n1,1 F6111-0120,O=C(CN1CCC(COCc2ccccc2)CC1)Nc1cnccc1,1 F6796-6750,O=C1NC(N(CC2)CCN2c(cc2)nn3c2nnc3C(F)(F)F)=NC(C(F)F)=C1,1 F6597-2782,O=C1NCCCC1N1CCC(COc2cccc(C(F)(F)F)n2)CC1,1 L918-2259,N#Cc(cc1)ccc1S(N(CC1)CCC1c1noc(-c2cc(F)ccc2)n1)(=O)=O,0 F2372-0455,O=C(NCC(C1)CN(Cc(cc2)ccc2F)C1=O)Nc(c(F)ccc1)c1F,0 Z2983904709,Cc1noc(C)c1N(C(C1N2CCCCC1)=O)C2=O,1 Z2085852355,Cc1cnc(C(N2CC3(COCCC3)OCC2)=O)c(O)c1,0 Z2962774176,CC(C)C(c1cn(C)nc1)NC(c1cnc2n(C(C)C)ncc2c1)=O,0 F6363-0638,O=C(CCc1ccccc1)NCCNc1ncnc(-n2cccc2)c1,1 Z3772661263,Oc(cccc1cc2)c1nc2N(CC1)CCC1C(N[C@@H](C1)[C@H]1c(cccc1)c1Cl)=O,1 F6525-2156,Cn(c(CNC(c1cnc(C(F)(F)F)cc1)=O)c1)nc1-c1nccnc1,1 F3268-0063,Oc1cccc(NC(c(cccc2)c2Br)=O)c1,0 Y031-6729,CN(c1c(C(N2C)=O)n(CC(NCC3OCCC3)=O)cn1)C2=O,1 Z285648016,Cc(ccc(C(N(CC1)CCN1C(N1CCCCC1)=O)=O)c1)c1NS(C)(=O)=O,1 Z1546622782,CC(C)n1c(C(N(CC2)CCN2C(c2cc(O)ccc2)=O)=O)ccc1,0 4852-0643,CC(CC1)Cc2c1sc1ncnc(-n3nc(C)cc3C)c12,1 F6480-1052,O=S(c1cnccc1)(N(CCC1)CC1Oc1ccncc1)=O,1 S380-0011,O=C(CN(C(C1(CCCCC1)N1)=O)C1=O)N(CCC1)c2c1cccc2,1 S629-2604,O=C(CCc(cc1)cc(C2)c1OCCN2C(c1cccs1)=O)N1CCOCC1,1 SD07-0173,CC(C)C(NCc1c(COC(CC2)(CN2C(Cc2ccc(C)cc2)=O)C2)n2nn1)=O,0 F6680-2788,N#Cc(cc1)cnc1N(CCN1c2cc(C(F)(F)F)ncc2)CC1=O,0 F6357-1128,O=C(CSc(cc1)ccc1F)NCC1(CC1)c1cscc1,1 F6502-9162,Cc1cc(CCNC(c2cc(Br)cs2)=O)nn1C,1 SD63-0105,Cc1noc(C)c1Cc1ccc(C(N(CC2)CC2c2n[nH]c3c2COCC3)=O)o1,1 F6359-1758,N#Cc1cccnc1OC(CC1)CCN1C(CSCc1ccccc1)=O,0 Z2705149971,CN(c1nc(C(N2CC(COC)CCC2)=O)cs1)c1ccccc1,0 Z2952057212,COc1cc(C(N2CCC3(CCCCC3)CC2)=O)ncn1,1 Z4011036838,NS(CC(CC1)CN1C(c1cc(C(F)(F)F)nn1C1CC1)=O)(=O)=O,0 SB69-0020,CO[C@@H](Cc1c2)Cn1nc2C(NCCCn1nccc1)=O,1 Z3294580324,CCCc1nonc1NS(c1cncc(C)c1)(=O)=O,0 F6687-5380,CN(CC(CC1)CCN1C(C(CC1)CCC1(F)F)=O)c1nccc(C(F)(F)F)c1,1 Z1632708347,O=C(NCCc(cc1F)cc(F)c1F)N(CCN1)CC1=O,0 F6549-3613,O=S(c(cccc1)c1Br)(N1CC(Cn2ncnc2)C1)=O,0 Z1369048045,CC(CC1)CN1c1nccc(C(N(CC2)CCN2c2nccnc2)=O)c1,1 Z2359132571,CC(CC(C)(C)C1)N1S(c1ccco1)(=O)=O,0 M810-0585,CC(c(cc1)ccc1OC)NS(c1c(C)nc2sc(C)nn12)(=O)=O,0 F1913-5926,CC1OC2(CC(CC3)NC3C2)CN(C2CC2)C1=O,1 C276-1486,Oc1cccc(C(C2)C(C(CC(C3)c(cc4)ccc4F)=O)=C3NC2=O)c1,0 E234-2173,CC(C)CCNC(C(C)(Cn(c1c2)c3c2cccc3)N(CCc2ccco2)C1=O)=O,1 8018-9663,O=C(C1CC1)c(cc1OCCOc1c1)c1NC(c1cccc(F)c1)=O,1 G373-4077,O=S(c1cccc(Cl)c1)(N1CCN(Cc2nc(cc(cc3)-c4ccccc4)c3o2)CC1)=O,1 8356-0078,CCC(C)(C1)OCCC1(CCN(C(c1c2cccc1)=O)C2=O)C(C)C,1 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SC02-0057,Cn1c(CN(CC2)CC2(CCOC)NC(c(cc2)ccc2F)=O)ccc1,1 S032-2137F,O=C(c1cccs1)N[C@H](C[C@@H](C1)C2)[C@H]1N2S(c1cc(CCC2)c2cc1)(=O)=O,1 F2199-0382,COc1cccc(-c2noc(CN(C(c3c4cccc3)=O)C4=O)n2)c1OC,0 6401-0084,Cc(cc1)ccc1-c(n1nc(C)cc(C)c1c1N(C)C(N2C)=O)c1C2=O,0 F5854-0433,O=S(Cc(cc1)ccc1F)(N(CCc1ccccc1)Cc1ncccc1)=O,1 Z1498711625,CC(C)n1ncc(S(NC2(C)CCOCC2)(=O)=O)c1,0 F540-0168,O=C(c1csc(S(N(CC2)CCN2c2ncccn2)(=O)=O)c1)N1CCCC1,1 Z2902688813,CON(CC1)CCC1c1nc(-c(cc2)cnc2Oc(cc2)ccc2F)no1,0 F6487-0024,O=C(c1ccc(Cn2cncc2)cc1)NCC(C1)OCc2c1cccc2,1 Z2411421872,Cc1nn(C)c(CC(N(C2)CC2(C(F)F)O)=O)c1,0 Z1095286390,CC(CCC1)(CN1S(c(cc1)cc(Cl)c1OC)(=O)=O)C(O)=O,0 Z3091624823,Cc1c(C)nc(C)nc1NCc1nnc(-c2ccccc2)n1C,0 S511-3501,CC(C)NC(N(CC1)CCC11OCCC(CC(N2CCC(C)CC2)=O)C1)=O,1 Z2256302777,OC(c1cn(-c2cc(NC(COC3CCCC3)=O)ccc2)nn1)=O,1 Z2007188477,CC1C(c2nc(-c3ncccc3)no2)OC(C)C1,0 E852-1155,CC(C)CCNC(C(C)(Cn(c1c2)nc2C(N2CCN(C)CC2)=O)N(C)C1=O)=O,1 S836-3933,Cn1ncc(CN(C[C@@H]2CO)C[C@@H]2C(NC2CC2)=O)c1,0 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F926-1617,CC(C)NC(N(CCC1)CC1c1cc(C(N2CCC(C)CC2)=O)ccc1)=O,0 SD07-0621,CCN(CC)C(NCc1c(COC2(CN(Cc3cn(CC)nc3C)CC2)C2)n2nn1)=O,0 S700-0909,N#Cc1cccc(C(N(C2)CC2c2nc(CCOCC3CCOCC3)no2)=O)c1,1 Z2673640997,CN(C(C(CC1)CCC1C1CC1)=O)c(cc1)ncc1F,1 Z2689608573,OC([C@H](C1)C[C@H]1NC(c1ccns1)=O)=O,1 Z1421560314,CC(C)N(CC1)CCC1(CNC(C1(CN(Cc2ccccc2)CC1)O)=O)O,1 F6525-1330,COc1cccc(CC(NCCn(cc2)nc2-c2nccnc2)=O)c1,1 SD68-0863,O=C(CC1CCCC1)N1CC(C(N(Cc(cc2)ccc2F)CC2)=O)N2CCC1,1 Z1265200491,N#Cc1cccc(N(Cc(cc2)ccc2Cl)C(CCc2nc(-c3ncccc3)no2)=O)c1,1 Z2963774184,COc1nccc(C(N2C(CO)c(cccc3)c3OCC2)=O)c1,0 F6750-6533,Cn1ncc(-c2cncc(N3CCN(Cc4csc(C5CC5)n4)CC3)n2)c1,1 SB69-0494,O=C(c1nn(C[C@H](C2)Oc3cnccc3)c2c1)NC1CCC1,1 SC10-0007,CS(N(CCCN1CCOCC1)C1CN(Cc(cc2)cc3c2OCCO3)CC1)(=O)=O,1 V017-2492,Cc1cc(-c2csc(N=C(CN(CCCOC)CC(COc3ccccc3)O)N3)c2C3=O)c(C)cc1,0 Z1873072425,CC(C)c(n(-c(cc1)ccc1Cl)nc1)c1NC(N(CC1)CC(C)CS1(=O)=O)=O,1 J039-0220,CC(c(n1C)nnc1SCC(Nc1nc(-c2ccccc2)c(C)s1)=O)N1c(cccc2)c2OCC1=O,1 Y031-4874,COc(cc1)cc(N(CC(C2)C(Nc(c(OC)c3)cc(OC)c3Cl)=O)C2=O)c1OC,0 F6481-1638,O=S(c(s1)ccc1Cl)(N(CC1)CCSC1c(cccc1)c1F)=O,0 F5882-0517,COC(N1CCN(CCNC(c2c(C(F)(F)F)cccc2)=O)CC1)=O,0 4383-0081,Cc(cc1)cc(C)c1NC(C(C(c(cc(cc1)OC)c1OC)N1)=C(C)NC1=O)=O,0 V028-8829,O=C(C(c1ccccc1)c1ccccc1)N(CCC1)C1C(NCCNC(c1ccccc1)=O)=O,1 F6571-0084,CN(C)C(CNC(c(cccc1)c1SC)=O)c1csc2c1cccc2,0 F6443-7040,O=S(Cc1cc(C(F)(F)F)ccc1)(NCC(CCC1)N1c1nccs1)=O,1 F6562-8094,CSc(cccc1)c1C(NCC1c(cccc2)c2OC1)=O,0 Z2964453844,CON(CC1)CCC1C(Nc1c(-c2ccccc2)[nH]c2c1cccc2)=O,1 F6773-4209,COCc1nsc(N(CC2)CCC2Oc2nc3ccnn3cc2)n1,1 Y041-7442,CN(C(CC1)CS1(=O)=O)C(CN(C=Cc(cc1OC)c(C2)cc1OC)C2=O)=O,0 Z1564037726,CCc1c(C)cc(C(NCc2nn(C)cn2)=O)s1,0 Z1496001718,OC(C1(CNC(c2ccncc2)=O)CCOCC1)=O,1 Z873337650,OC(CNC(NCc(cc1)cnc1-n1cncc1)=O)c1cccc(F)c1,0 Z1874677203,O=C(c(cn1)c2n1nccc2)Nc1ccc(Cc2ccncc2)cc1,1 SB95-1328,Cc(nc1)cnc1C(N(CCC1)CC1N(CCN1CCOCC1)S(C)(=O)=O)=O,1 Z2126433943,OC1(CCCCC1)C(C(Nc1cc([nH]cc2)c2cc1)=O)(F)F,0 F6556-7607,CC(Cc1cc(cccc2)c2o1)NC(c(cc1)ccc1S(N(C)C)(=O)=O)=O,0 Z2212636740,Cc(cc(C)s1)c1S(N1c(cccn2)c2OCC1)(=O)=O,0 V014-1935,CCN(C1CCCCC1)C(c(cccc1)c1N(CC1)CCC1NC(c(ccc(F)c1)c1F)=O)=O,1 Z4327151805,CC(c1cn(-c2cccc(CNC(C(C)(C)C(C)=C)=O)c2)nn1)O,0 F6204-0428,Cc1c(C(NC2(CCCC2)c2cccs2)=O)snn1,1 F2016-0089,CCN(CC)C(Cn1c(cccc2)c2c(SCC#N)c1)=O,0 Z2231312260,CCn1nncc1C(N(CC1CO)c2c1cccc2)=O,0 Z2947716078,Cc1c(CN(C2CC2)C(c(cc2)cnc2S(C)(=O)=O)=O)cccc1,1 S975-0531,Cc(occ1)c1C(N(C[C@@H]1N2CCN(CCOC)C1=O)[C@@H](Cc1ccccc1)C2=O)=O,1 Z878371624,Cc1nc(C(N(CC2)CCN2c(cccc2)c2F)=O)cs1,0 Z1284038749,CCCNC(C(CC1)CCN1C(NCc(cc1)cc(F)c1Oc(cccc1)c1F)=O)=O,0 Z1021888920,Cc1cnc(NC(c2csc(-c(cc3)cc4c3OCO4)n2)=O)s1,1 S836-2613,COC[C@@H](CN(C1)C(c(cc2)ccc2C#N)=O)[C@H]1C(N)=O,0 P055-0990,O=C(c1cccs1)N(CC1)CCN1c1nc(CN2CCOCC2)cs1,0 SB36-0692,O=C(c1cn(C[C@H](CC(C2)(F)F)N2C(c2ncncc2)=O)nn1)N1CCOCC1,1 S694-2142,Cc1cnc(COC)n1C(CC1)CN1C(c1cscc1)=O,1 S738-0432,Cc1cnc(C(C2)CN2C(C2(CC2)c2ccccc2)=O)n1Cc1cnccc1,0 F6516-0121,O=C(CSCc1ccccc1)NCc1ccc(-c2cccs2)o1,1 F2147-1632,CC(C)(C)OC(N(C1)CC1Oc1ncccc1)=O,1 Z2439139821,COc1cccc(Nc(cccc2)c2C(N(CC2CC3)CC2C3N)=O)c1,1 F6619-6768,Cc1nc(-n2nccc2)cc(N(CC2)CCN2c2ncnc3c2cnn3C)n1,1 E017-0140,O=C(C(CC1)CCN1c1nnc(N(CCC2)C2=O)s1)NCCCN(CCC1)C1=O,1 F6481-0527,COC(c(scc1)c1S(N(CC1)CCSC1c1ccccc1)(=O)=O)=O,1 Z417910730,COC(c(cc1)nn1-c1ccccc1)=O,0 Z2053142606,CC(CN1CC(c2nc(C)no2)N(C)CC1)=Cc1ccccc1,1 L001-0344,Cc1cccc(CN(CCN2C(CC3)CCN3C(Nc(cc3)cc(C)c3Br)=O)C2=O)c1,0 Z3187166769,OCC(CC1)CCC1NC(NC(C1)CN(C2CC2)C1=O)=O,1 Z1315211406,Cc(cc1)cc2c1[nH]cc2CCC(N1CCN(CC2CCOCC2)CC1)=O,1 E002-2482,O=C(c(oc1c2cccc1)c2NC(c(cccc1)c1Cl)=O)N(CC1)CCN1c1ncccc1,0 Z2055811261,CCN(C([C@H](C[C@@H](C1)OC)N1C(c1cncc(C)c1)=O)=NN1)C1=O,1 Z2303407521,C[C@@H](CC1)C(C)(C)[C@]1(C)C(NCC(CCn1nc2)Cc1c2C(N)=O)=O,1 F447-0727,CC(C)CC(C)N(CC1)CCN1c1cc(C(O)=O)c(cc(cc2)NS(c3cc(C)cc(C)c3)(=O)=O)c2n1,0 Z2299294788,CC(C)c1n[nH]c(C(N)=O)c1NC(CC(C)Cc(cc1)ccc1Cl)=O,0 F6525-7628,Cc(n(-c1ccccc1)nc1)c1C(NCCn1ncc(-c2cocc2)c1)=O,1 F897-1081,CC(C)n1nc(C)c(S(N(CC2)CCN2C(c2cc(cc(cc3)Cl)c3[nH]2)=O)(=O)=O)c1C,1 K410-0886,Cc(cc1)cc(C)c1-n1nc(CS(C2)(=O)=O)c2c1NC(CCc1ccccc1)=O,1 Z2962838420,CC(C)(C)OCc1cccc(NC(c2cnc3n2CCCC3)=O)c1,0 F6789-0559,CN(CCc(cc1)ccc1OC)c1c(ccs2)c2ncn1,0 Z4552697007,CC(N(c1nc(Cn2nnc(Cn3c4ncnc(N)c4nc3)c2)cs1)c(cc1)ccc1F)=O,0 Z1494117912,O=C(NCc1nnc(-c2ccccc2)s1)N(CC1)CC1C1COCC1,1 SA01-0836,CN(C)C(c1cnc(N(C)C)nc1C(CC1)CN1C(Cc(cccc1)c1F)=O)=O,0 K786-9804,Cc1ccc(CCN(CC(C2)C(NCCCN(C)Cc3ccccc3)=O)C2=O)cc1,1 Z3707928483,COC([C@@H]1[C@H](CN(C2)C(c3cc(Cl)nc(Cl)c3)=O)[C@H]2OC1)=O,1 L781-0106,O=C(Nc(cc1)ccc1SCC1=Nc(cccc2)c2NC1=O)Nc(cc1)ccc1Br,1 Z1724599946,COCc1nc(OC)cc(N2CC3(CCC3)OCC2)n1,1 Y040-1533,COc(cc1)ccc1C(c(ccc(OCC(NC1CCCCC1)=O)c1)c1O1)=CC1=O,1 V025-7885,CC(C)CNC(c1coc(CN2CCN(Cc3ccc(C)cc3)CC2)n1)=O,0 Z17197017,O=C(CSc1nnc(-c2ccncc2)[nH]1)Nc1ccccc1,0 Z1864136744,CNC(c1c(N(CC2)CCC2c2ccncc2)nccc1)=O,1 F3398-3778,CCc(cccc1C)c1NC(CSc1nccn1-c(cc1)ccc1C(NCc1ccc(C)o1)=O)=O,1 F6785-6743,CC(C(N1CCC(COc(cc2)nn3c2nc(C)c3)CC1)=O)n1nccc1,1 C085-1705,O=S(c1ccc(C2CCCCC2)cc1)(N(CC1)Cc2c1cccc2)=O,1 Z2132159198,CC1N(Cc2ccccc2)CCC1NC(N(CC1)CC1(C)C(NC)=O)=O,1 Z3277626367,Clc(ccc1c2CNCC1)c2Br,0 Z3300345646,CCCCC(NS(c(snc1)c1Br)(=O)=O)=O,0 F886-0062,O=S(c1ccc(-c2noc(C(F)(F)F)c2)o1)(N(CC1)c2c1cccc2)=O,1 V022-1261,C=CCNC(N1CC(CN(CCC2)CCN2C(c(cc2)ccc2F)=O)OCC1)=O,0 Z2475580227,CN(C)CCN(CCN(C1)C(c2cc(-n3nnnc3)ccc2)=O)C1=O,0 SC40-0036,COCc1c(COC(CC2)(CCN2C(c(cc2)ccc2OC(F)(F)F)=O)C2)n2nn1,0 Z1220349938,Cc(cc1)cc(C(NC2CN(CC(N)=O)CCC2)=O)c1N1CCCC1,1 Z2697562360,O=C(C(CN1)c(cccc2)c2C1=O)N(CCN1)CC1=O,1 F5857-5554,OC(CNS(c(cccc1)c1Br)(=O)=O)(CC1)c2c1cccc2,0 Z2974823054,CNS(c(cc1)cnc1NC[C@](C1)(C[C@H]1O)c1ccccc1)(=O)=O,1 V002-6368,CC(c1ccccc1)N(Cc1nc(C(NCC2OCCC2)=O)co1)Cc1c(C)ccc(C)c1,0 F6798-4864,CC(N=C(NC1=O)N2CC(CN(C3)c4ncnc5c4n(C)cn5)C3C2)=C1F,1 CM4697-4913,O=S(c(cc1)ccc1F)(N1CC(Cc2nncn2C2CCCC2)C1)=O,1 F6178-5021,COCCNC(NCC(CC1)CCN1c1nccnc1)=O,0 G397-0541,O=C(C(CCC1)CN1c1nnc(N(CCC2)C2=O)s1)NCCCN(CCC1)C1=O,1 8017-5335,CC(C)(C1)CC(N(c2cccc(Cl)c2)C(C(C(NCCc2c(C)[nH]c3c2cccc3)=O)=C2)=O)=C2C1=O,1 P088-1788,CCCCNC(c1cccc2c1CCN2C(Nc1ccccc1)=O)=O,0 Z2960559441,CN(Cc1noc(O)n1)C(c1cc(Br)cc(OC)c1)=O,0 F6609-3733,COc1cc(C(OCC(Nc(cc(cc2)F)c2Cl)=O)=O)cc(OC)c1OC,0 F3098-7313,CC(c1ccccc1)NC(CCCOc(cccc1)c1OC)=O,1 Z2353402690,Cc1c([C@H]2OCC[C@@H]2NC(NCc(cc2)ccc2C(O)=O)=O)cnn1C,0 Z432018988,NCc(cc1)ccc1C(N(CCC1)C1c1cnccc1)=O,0 F3284-8524,C(c1cccs1)=C/c(s1)nn2c1nnc2-c1ccccc1,1 Z2936913082,O=S(CC(C1)CS1(=O)=O)(NC(C1)COc2c1cccc2)=O,1 SD61-0636,O=C(C(C1)C2(CCC2)CN1C(c(cccc1)c1OC(F)(F)F)=O)NCC1CC1,0 F6560-7650,O=C(c1nccc2ccccc12)NCc(cc1)cnc1-c1cocc1,1 F3382-6902,CCCS(c(cc1)nnc1N1CCC(Cc2ccccc2)CC1)(=O)=O,0 Z2434102764,Cc1nsc(N(CC2)[C@@H]3[C@H]2CCCC3)n1,1 4094-0279,CC(C(O)=O)Sc1nc(N(C)C(N(C)C2=O)=O)c2n1Cc1cccc(Cl)c1,0 Z2772772178,O=C([C@]1(CCC2)[C@@H]2OCC1)N(CC1)CC1OCc1ncccc1,1 SC09-0289,C[C@H](COc(cc1)c(C2)cc1-c1cncnc1)N2C(c1cn(C)cn1)=O,1 F616-0605,CC(Cc1ccco1)NC(c(cc1)ccc1N(C(C=C1)=O)N=C1Sc(cc1)ccc1Cl)=O,0 F5978-0256,Cn(cc1C(N(CC2)CCC2C(NCc(cc2OC)cc(OC)c2OC)=O)=O)nc1OC,1 F6556-8865,O=C(c1cc(Br)cs1)NC(c1cscc1)c1cccs1,0 F2199-0390,CC(C)(C)OC(N(C1)CC1C(Nc(cc1)ccc1OC(F)(F)F)=O)=O,0 Z1174429901,CC(c1cccc(S(N(C)C)(=O)=O)c1)NC(C1(CCOCC1)c1ccc(C)cc1)=O,0 J004-1752,CC(C)c1noc(C(CCC2)N2C(c(cnn2c(C(F)(F)F)c3)c2nc3-c2ccco2)=O)c1,1 F5806-0226,Cc1c(CCC(NCCc2c[nH]c3c2cccc3)=O)c(C)n[nH]1,1 Z1389173273,Cc1cc(S(N)(=O)=O)cc(NC(c(cc2)ccc2-c2cscn2)=O)c1C,0 F6796-6974,Cc(ncnc1N(C)CC(CC2)CCN2c2nc(C3CC3)ns2)c1F,1 Z3357972273,CCN(C(c1c(cncc2)n2c(C(F)(F)F)n1)=O)c1cn(C)nc1,1 Z1577936361,CCc1nnc(NC(N2CC3(CCC3)C(C)CC2)=O)s1,1 F3406-7118,Cc1cc(C)nn1-c1cc(SCC(Nc(ccc(C)c2)c2Br)=O)ncn1,0 F6660-0454,Cc(nc(c1c2)N(C)Cc3ccccc3)cn1nc2C(Nc(cc1)cc2c1OCCO2)=O,1 Z4422379534,NC(C1)CC(C2)C1CC2NC(c1nc(cccc2)c2s1)=O,1 F6752-4396,O=C(C(C1)OCCN1c1nc(C(F)(F)F)cs1)N1CCSCC1,1 Z805500780,CC(C(Nc(cccc1)c1C(C)=O)=O)N(CC1)CCC1c1nc(C)no1,0 F6445-0318,O=C(c1cc(Oc2ncccc2)ccc1)N1CCN(Cc2ncccc2)CC1,1 Z453773834,CCc1cccc(Cc2cnc(NC(c3c4ncccn4nc3)=O)s2)c1,0 F6473-8740,CC(N1C2CC2)=CC(OC(C2)CN2C(Cc(c(F)ccc2)c2Cl)=O)=CC1=O,0 Z2296021991,Cc1cc(C(C(O)=O)NC(C2CC=CC2)=O)cc(C)c1,0 F6619-7136,Cc(cc1)nnc1N1CCN(Cc(cc2)cc(F)c2F)CC1,0 F6571-2510,OCCOC1(CNS(c(cc2)ccc2OC(F)(F)F)(=O)=O)CCCC1,0 F5291-0036,CCCN1c(cc(cc2)-c3csc(NC(c4cc(F)ccc4)=O)n3)c2OCC1=O,0 Z2004778508,NC(c1c2nccc(C(NCC(CC3)CCC3(F)F)=O)n2nc1)=O,0 Z1715964850,O=C(c1c(-c(cc2)ccc2F)ocn1)NC(CC1)CC1(F)F,1 F2199-0384,CC(C)(C)OC(N(C1)CC1c1nc(CN(C(c2c3cccc2)=O)C3=O)no1)=O,1 F6484-0433,COc1ccc(CNC(NC(CC2)CCC2Oc2nccnc2)=O)cc1,1 Z1870827776,CC(CN(CC1)C(C(c2ccccc2)c2ccccc2)=O)CS1(=O)=O,1 Z2913210715,OCC1(CC=CC1)C(c1ccccc1)NC(C1=CC(C(F)(F)F)=CNC1=O)=O,1 F6443-4295,COc(ccc(CNC(N(CC1)CCC1(c1c2cccc1)OC2=O)=O)c1)c1OC,1 D437-0555,CC1Oc(ccc(-c2csc(NC(C3CCCCC3)=O)n2)c2)c2NC1=O,1 G421-1127,Brc1ccc(CN(CC2)Cc3c2nc(N(CC2)CCN2c2ncccc2)nc3)cc1,1 D715-2814,COc(cc1)cc2c1n(CC(NCCCC(O)=O)=O)cc2,0 F6810-2256,Cc1cccc(N(CC2)CCN2c2ncnc(N3C)c2N(C)C3=O)c1C,0 Z1870528456,O=C(CN1)N(CC2(CCCC2)c(ccc(F)c2)c2Cl)C1=O,1 F6685-8838,COc1cccc(C(N2CC(COc(nccc3)c3Cl)CCC2)=O)c1,0 S629-1662,O=C(CCc(cc1)cc(C2)c1OCCN2C(Cc1c[nH]c2c1cccc2)=O)NC1CC1,1 Z27212184,O=C(c1cc(-c2cccs2)nc2ccccc12)NC1C(CC2)CCN2C1,1 F6517-2779,OC(CNC(C1CC=CCC1)=O)c1ccc(-c2cscc2)s1,1 T159-0868,CC(C)n1c(CC(CCC2)CN2C(c2cn(C)cn2)=O)ncc1C,1 F6245-0032,Cc1c(C(N(CC2)CCC2c2nnc(-c(cc3)ccc3F)o2)=O)sc(-n2cccc2)n1,1 F6441-3553,CC(C)CS(C(CC1)CCN1C(c(cc1)ccc1S(N1CCCC1)(=O)=O)=O)(=O)=O,1 E958-0246,O=C(C(CCC1)CN1c1nnc(-n2cccc2)s1)N(CC1)CCN1c(cc1)ccc1Cl,1 F6513-5508,O=C(C(CC1=O)CN1c1cccc(Br)c1)NCc1c(CCCC2)n2nc1,1 L694-0111,CN(c(ccc(S(N(CC1)CCN1C(Cc1cc(OC)cc(OC)c1)=O)(=O)=O)c1)c1O1)C1=O,0 Z2000711222,CCOc1cccc(S(N2Cc3nncn3CC2)(=O)=O)c1,0 Z3133110227,COc1nccc(CCNC(C(C[C@H]2C3)C[C@@H]2[C@@H]3N)=O)c1,0 V006-5111,O=C(c1csc2c1cccc2)N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Br,1 D074-0447,CCCN(C(c1c2[nH]nc1-c(cccc1)c1O)c1cc(OCCC(C)C)ccc1)C2=O,0 V006-0326,c1(n(c2cc(c3ccc(Oc4ccccc4)cc3)ccc2)cnc1)C(N[C@@H]1[C@H](C1)c1ccccc1)=O,1 F6414-3564,CC(CNC(c1ccco1)=O)(c1cc(cccc2)c2s1)O,1 Z1737378387,CSCCCC(Nc1c(C(c2ccncc2)=O)c(CCC2)c2s1)=O,0 F0630-1693,O=C(c(cccc1)c1Br)N1C(SCc2cnccc2)=NCC1,0 C530-0281,CCN(c(cc(cc1)C(N(CC2)Cc3c2cccc3)=O)c1S(c1c2cccc1)(=O)=O)C2=O,1 F6472-8271,CCOc1cc(C(N(CC2)CC2N(CC2)Cc3c2cccc3)=O)cc(OCC)c1OCC,0 Z2646766330,Cc1cn(ccnc2C(NOCCC=C)=O)c2n1,0 Z1496613849,Cc(cc1)ccc1C(Nc1cccc(CNS(c(cccc2C)c2C#N)(=O)=O)c1)=O,0 Z2959672130,O=C(c(cc1)cnc1OC(F)F)N1CC2(COCCC2)OCC1,1 Z1246092010,CCc1c(C(Nc(cc2)ccc2-c2nnc[nH]2)=O)nco1,1 Y030-8001,CC(C)C(Nc1cccc(C(NC(C)(C)C)=O)c1)=O,0 F6171-0040,COC(c(cc1)ccc1NS(CCOc1ccccc1)(=O)=O)=O,0 V025-9025,CCCc(c(CN(CCC)Cc(cccc1)c1F)c1N2CCN(CC)CC2)nn1-c1cc(F)ccc1,0 Z1465287265,CC(C)(C(NCC1CCCC1)=O)NS(c(cc1)cc(F)c1F)(=O)=O,0 G765-0610,COc(cc1)cc(C2)c1OCC2NC(NCCCN(CC1)CCC1N1CCCCC1)=O,1 Z71410036,O=C(CC(c1c2cccc1)=NNC2=O)Nc(cc1)ncc1Br,0 S639-0888,CN(C)C[C@@H](CN(Cc1cnccc1)C1)[C@H]1NC(CSC)=O,0 F6524-1099,COc1cc([nH]c(C(NCCN2N=Nc(ccc(F)c3)c3C2=O)=O)c2)c2cc1,1 F6469-0576,COc(cc1)cc(C(Nc(cccc2)c2-c2cn(CCS3)c3n2)=O)c1Br,0 Z1560998708,CCn1c(C)nc(S(N(C)c(cc(cc2)F)c2F)(=O)=O)c1,0 F5605-0016,O=S(c(cc1)ccc1Cl)(Nc1ccc(CN(CC2)CCN2c2ncccc2)cc1)=O,1 F6680-2734,O=C(Cc(ccc(F)c1)c1F)N(CCN1c2cc(C(F)(F)F)ncc2)CC1=O,0 F5772-3453,CCOc1cccc2c1nc(N(CC1)CCN1C(NCCc(cc1)ccc1OC)=O)s2,1 Z3092237681,CCN(CC)C(CCC(N(CC1)OCCS1(=O)=O)=O)=O,0 F2758-0604,CN1N=C(CNC(NCc2cccs2)=O)c(cccc2)c2C1=O,1 F1957-0300,Brc1cnc2c(Br)cncc2c1,0 Z4597720086,C(C(C1)OCC11CCNCC1)Nc1c(c(CCCC2)c2s2)c2nc(-c2nccnc2)n1,1 C429-1103,O=C(c1c2cccc1)N(Cc1nc3cccnc3n1Cc(cccc1)c1Cl)C2=O,1 Z2958170181,Cc(c(C(NC(CO)CO)=O)c(cc1)F)c1Br,0 Y041-0298,OC(CC1)(CCN1C(CN(C(C=C1)=O)N=C1c1ccco1)=O)c(cc1)ccc1Cl,1 Z1090608538,CC(C)CCN(Cc1ccc2)Cc1c2NC(CCn1nc(C)cc1C)=O,1 Z3309265328,O=C1NC=C(CN(CCC2)C2c(cc2)cc(F)c2F)c2c1cccc2,1 SB39-0898,CS(NC(CN(Cc1cocc1)CC1(CCCC1)N1)C1=O)(=O)=O,1 Z2721909466,CC1(COC)OCCN(Cc(cccc2)c2C(O)=O)C1,0 F6253-1910,O=C(c1cc(cc(cc2)Cl)c2[nH]1)N(CC1)CCN1c1ncccn1,0 S978-0668,CC(C)C(N(C1)[C@@H](C)COc2c1cc(CN(C1CC1)S(C)(=O)=O)cc2)=O,0 F6445-6866,O=C(CN(C=Nc1c2cccc1)C2=O)NCc(cccc1)c1-c1cscc1,1 F1967-0753,CCOc(cc1)nn2c1nc(-c(cc1)cc(N)c1Cl)c2,1 F6057-0566,Cc(s1)ccc1S(N1CCN(CCn2nccc2)CC1)(=O)=O,1 Z1550652422,COc(cc1)cc2c1[nH]nc2NC(c1cccc(NC(c(cc2)cc3c2[nH]cn3)=O)c1)=O,1 Z3631148357,Cc(c(Cl)nc(Cl)c1)c1C(N(CCC1)[C@H]1C(NC)=O)=O,0 Z3692620438,NC(c1nc(-c2ccc(CN3CCCCC3)cc2)ccc1)=O,1 S649-0995,O=C(NCc1ccccc1)N(CC1)CCC1N(C1)C2(CCOCC2)C1OCC1CC1,1 F6506-5014,OC(CNC(Cc(c(F)ccc1)c1Cl)=O)(C1CCOCC1)c1ccccc1,0 F6676-0569,Cc1nnc2n1ccnc2N1CCC(COc2cccc(C(F)(F)F)n2)CC1,1 Z760101818,CC(c(s1)ccc1S(Nc1cc(C(F)(F)F)ccc1)(=O)=O)NC(C)=O,0 Z1183473265,Cn1ncc(-c2ncc(C(Nc(cccc3)c3Cl)=O)s2)c1,1 F6178-7532,COc1cccc(CC(NCC(CC2)CCN2C2CSCC2)=O)c1,0 F6562-5386,O=C(c(o1)ccc1Br)NCCN(C=CC=N1)C1=O,1 S380-0201,CC(CC1)CCC1(C(N1CC(NCCc(cc2)cc(OC)c2OC)=O)=O)NC1=O,0 E612-1030,CC(C)CC(C(NCC1CCN(Cc2c(C)ccc(C)c2)CC1)=O)N(Cc1c2cccc1)C2=O,0 S836-2185,CNC([C@@H](C1)[C@@H](COC)CN1C(c1cccn1C)=O)=O,0 F6471-2185,O=C(CCc1cccc(Oc(cc2)ccc2F)c1)N(C(CC1)C2)C1c1c2ncnc1,1 Z3290588498,CC[C@H](CO)NC(c(cc1)ccc1N(C(C1)=O)N=C1C(F)(F)F)=O,0 F6726-1331,Cc(cc1)cc2c1onc2CN(C1)CC1N(C)c(nc1)ncc1Cl,1 CM4579-4059,Cc1noc(C)c1CC(N(C1)[C@H](COc2cc(CCC3)c3cc2)CC1(F)F)=O,1 V003-8166,O=C(c1csc(COc(cccc2)c2F)n1)NC(CCCC1)C1NC(Nc(cc1)cc(F)c1F)=O,0 F6774-4215,Cc1nnc(CN(CC2)CC2Oc(nc2)ncc2OC)n1C,1 Z2949474695,Cc1nccnc1N1CCN(Cc2cnc(-c3ccccc3)o2)CC1,0 SC72-0679,C(c1ccccc1)N(C1)CC11OCc2c1cnc(-c1ccccc1)n2,0 8015-8537,OC(C(CC1)CCN1C(CC(N1c(cc2)ccc2Br)=O)C1=O)(c1ccccc1)c1ccccc1,0 S699-0522,CN(CCc1noc(C(C2)CN2C(NCc(cc2)ccc2F)=O)n1)C(C1CC1)=O,1 F0921-5447,CC(C)C(C(N(CC1)CCN1c1ncccc1)=O)NC(C1CCC(C)CC1)=O,1 S664-1627,Cc(nccc1)c1C(N(CC1)CCC1(CC1)C1OCC(N)=O)=O,0 F2158-1083,CC(C)(C)OC(Cn1c(ccc(N)c2)c2c2c1cccc2)=O,0 Z1689160762,COC1(CCCC1)c1noc(Cc2nn(-c3ccccc3)nc2)n1,0 K261-0705,O=C(CC1(CC(N2)=Nc(cccc3)c3S2(=O)=O)CCCC1)N(CC1)CCN1c1cccc(Cl)c1,1 F6479-4050,Cc1cc(OC(CC2)CCN2C(c2noc(-c3ccco3)c2)=O)nc(C)n1,1 Z2177991807,COc1cccc(C2(CNC(C(CCC3)N3C(c(cc(cc3)Cl)c3OC)=O)=O)CC2)c1,1 SA87-0411,O=C1N(Cc2ccccc2)CC(CNS(c2cc(CCC3)c3cc2)(=O)=O)OC1,1 Y030-3861,CC(C)CCNC(CC(c1ccccc1)c1ccccc1)=O,0 F5854-4432,COc1cccc(OCC(N(CCc2cccs2)C2CC2)=O)c1,1 F6617-2993,COc(cc(c1nc(-c2cnccc2)nn1c(NCCc1ccccc1)n1)c1c1)c1OC,1 G802-0076,CC(C(Nc(cc1)cc2c1OCCO2)=O)Sc1nnc2n1C=CN(c1cc(F)ccc1)C2=O,0 F6438-0321,Cc(c(C)c1)cc(C)c1S(Nc1c(C)nc(N2CCOCC2)nc1C)(=O)=O,0 Z4924722942,Cc1ncc(C(N(CCC2)CC2N(C)C([C@H](C2)C[C@@H]2N(C)C)=O)=O)o1,1 SB54-1073,COC[C@@H](CN(C1)C(Nc(cc2)cc(Cl)c2F)=O)[C@H]1c1nnc(-c2ccccc2)o1,0 Z1665853091,Cc1cc(C(F)(F)F)nc(N[C@H](CC2)CC[C@@H]2O)n1,1 Z4497727204,CC(Cc1cc(F)cc(OC)c1)NC(C(CC(C1)O)N1C(Cc(cccc1)c1F)=O)=O,0 Z1835796830,Cc(cccc1)c1C(Nc1c[nH]nc1C(OC)=O)=O,0 S979-0465,C[C@@H](COc(cc1)c(C2)cc1C(N1CCOCC1)=O)N2C(c1cscn1)=O,1 SB95-0217,CS(N(CCN1CCCCC1)C(CCC1)CN1C(c1nccnc1)=O)(=O)=O,1 F5072-7445,Cc1noc(C)c1CCC(NCCN1N=C(C)C=CC1=O)=O,1 F6525-8174,O=S(c1cnccc1)(N(CCn1nc(C(F)(F)F)cc1)C1CCCC1)=O,1 F3406-3572,COc(cc1)cc2c1[nH]c1c2ncnc1SCC(Nc(cc1)ccc1Cl)=O,0 Y040-1274,O=C(COc(cc(c(C1=C2CCC1)c1)OC2=O)c1Cl)c(cc1)ccc1Br,0 Z1693170748,CC(C(F)(F)F)N(CC1)CCN1S(c1ccnn1C)(=O)=O,1 SC85-0819,CN(CC1)C[C@@]1(CN(C1)C(Cc2cccc(Cl)c2)=O)[C@@H]1c1nc(-c2nccnc2)no1,1 SD69-0441,CC(C)C[C@@H](Cn1nnc(C(N(CCN2)CC2=O)=O)c11)NC1=O,1 Z2598613819,Cc1c(CN(CC2)CCN2C(c2ccccc2)=O)nc(C)o1,1 T502-1475,O=C(C(CC1)(CCN1S(c1cccc2nsnc12)(=O)=O)F)N1CCCC1,1 F6481-3102,O=C(Cc(cccc1)c1Cl)N(CC1)CCSC1c(cc(cc1)F)c1F,0 Z1414185986,CCN(CC(CC1)CN1C(C(C(C)=C1)=CNC1=O)=O)CC(F)(F)F,0 Y300-0175,Cc1c(CNC(CCc(cc2)cc3c2OCO3)=O)cccc1,1 Y200-0052,CC(CC1)Cc2c1c(C(NCc1cnccc1)=O)cs2,0 CM3034-2801,Fc(cc1)c(CN2CC3(CCOCC3)C(COc3cnccc3)C2)cc1Cl,1 F6678-9096,CC(C)c1nc(cccc2)c2n1C(C1)CN1S(c1cccc2cccnc12)(=O)=O,1 L370-0462,CC(C)CCNC(c(cc1)ccc1Nc(nc1)ncc1-c1cccc(F)c1)=O,0 F5854-4619,O=C(NCc(cc1)ccc1Cl)N(CCc1cccs1)C1CC1,1 Z994866438,Cc1noc(CN(CC2)CCN2c(cc2)nc(C#N)c2Cl)c1,0 Z4522000569,CC(CC1)(CN1C(COCc1noc(C)c1)=O)NC([C@H]1OCCC1)=O,1 F6670-6048,Cc1nc2ccccc2nc1N1CCC(CN(C(C)=Nc2c3cccc2)C3=O)CC1,0 Z3524459116,CN(C1CCCC1)C(c1c(N)n(-c(cc2)ccc2F)nc1)=O,0 F6549-2883,O=C(c1csc(-c2ccccc2)n1)N(C(CC1)C2)C1CC2n1cncc1,1 F6805-3145,Cc1nc(cccc2)c2n1C(C1)CN1c1cc(C(N)=O)ncc1,0 Z2408178860,Cc(ccc(C(N[C@H]1COCC1)=O)c1)c1NC(c(cccc1)c1F)=O,1 F6247-0409,CC(C(N(Cc(ccc(F)c1)c1F)C1)=O)Oc(cc2)c1cc2Br,0 SA46-1685,Cc1noc(C)c1COc(cc1)ccc1C(N(C1)CC1(C1)OCC1N1CCCCC1)=O,1 Z1991895094,CC(CNC(c(o1)ccc1Cl)=O)(C(O)=O)c1ccccc1,0 L309-1307,N#Cc(cc1)ccc1NS(c(cc1)cc(N2Cc3noc(C4CCC4)n3)c1OCC2=O)(=O)=O,0 F6560-6036,CC(C(NCc1cncc(-c2ccnn2C)c1)=O)Oc(cccc1)c1F,1 F6469-1163,O=C(c1c(C(F)(F)F)cccc1)Nc(cccc1)c1-c1csc(-c(cccc2)c2F)n1,0 Z2898545164,CCCc1n[nH]c(C(NC(C(O)=O)c(cc2)ccc2F)=O)c1,0 CM2432-1514,CC(C)CN1C[C@@H](CN(C2)C(c3cscc3)=O)[C@]2(CO)CC1,1 SB54-0766,COC[C@@H](CN(Cc1cccs1)C1)[C@H]1c1nnc(-c2ccccc2)o1,0 F6475-2951,COCCOc1nccc(C(N2CC(Cc3ccccc3)CC2)=O)c1,0 Z3649458548,Cc1cc([N+]([O-])=O)c(N2C3(CC3)[C@@H](CCC3)[C@@H]3C2)nc1,1 F6472-8599,COC(CC1)CCN1C(C1)CN1C(C(CC1)CCN1S(C)(=O)=O)=O,1 P124-0662,CCc1nc(C(N(CC(NC(C)c(cc2)ccc2F)=O)N=C2C)=O)c2s1,1 Z1978452056,Cc1cccc(C(N(CC2)CCC2(c2nnn[nH]2)O)=O)c1,1 Z2956975464,CCOC(CC1)CCN1C(Nc1nc(Oc2ccccc2)ccc1)=O,1 S779-2114,Cc1cnc(C2CCC2)n1CC(CC1)CN1C(C1CCC1)=O,1 F5009-0308,CC(C)(C)n1ncc2c1N=CN(CCC(Nc(cc1)ccc1OC(F)(F)F)=O)C2=O,1 Z2595572061,CCCn1nccc1C(NCC(C)C(O)=O)=O,0 F6481-4396,Cc1cc(C)nc2nc(C(N(CC3)CCSC3c3cccs3)=O)nn12,1 F6245-5230,COCCN1N=C(C(CCC2)CN2C(c2cccs2)=O)N(C2CC2)C1=O,1 Z1836544176,O=C(c1coc(C2CCOCC2)n1)Nc1nc(CCCCC2)c2s1,1 Z2826449567,O=C([C@@H](CNC1)[C@H]1c(cc1)ccc1Cl)NCCN(CC1N2CCCC1)C2=O,1 F3225-1551,COc1nc2ccccc2nc1N1CCN(Cc(cc2)cc3c2OCO3)CC1,0 F6562-0109,COc(cc1)cc(C(NCc2cn(-c3cscc3)nn2)=O)c1Br,0 Z4450546209,Cc(cc1)ccc1OCn(cc1)nc1C(NS(c1ccc(C)cc1)(=O)=O)=O,0 F6222-0414,O=C(c1ccco1)Nc1cnc(N(CC2)CCN2c2ccccc2)nc1,1 F5069-0293,CCCOc1cn(-c(cc2)ccc2F)nc1C(N(CC1)CCN1C(OCC)=O)=O,1 L929-0620,CC(C)c1nc(cc(CCC(NC2CCCCC2)=O)cc2)c2[nH]1,1 V018-2361,C=CCN(C(CN1CCC(NCc2ncccc2)=O)=C(C(c(cc2)ccc2Cl)N2)C1=O)C2=O,1 F5658-0123,COc(ccc(CCNC(COc1cc(C(CC2)=O)c2cc1)=O)c1)c1OC,1 SC76-0567,CN(CCOC)C(CN(C([C@]1(COc2ccccc2)[C@H]2C1)=O)c1c2cccc1)=O,0 F267-0004,Cc1c(C(c2ccc(C)cc2)=O)oc(cc2)c1cc2N,0 SB52-0677,CCOc(ccc(CN1CCC(C2)(CN(C)C2c2noc(C3CCC3)n2)CC1)c1)c1OC,0 F5761-0174,COC(c(cc1)ccc1NC(CN1N=CC=CC1=O)=O)=O,0 Z2973105480,Cc1cc(NCC(N2)=NC(C)=CC2=O)nc(C)n1,0 Z2598530437,CC(CNCc1c2OCCCOc2ccc1)(C(F)F)O,0 F6244-3321,CC(C(NCC#CCN(C)Cc1ccccc1)=O)Oc1ccccc1,1 F0014-0931,O=C1N=C(c2ccccc2)c(cc(cc2)Cl)c2N1,0 V012-5090,CC(C)c1nc(sc2c3CCCCC2)c3c(N(CC2)CCN2C(COc(cc2)ccc2Cl)=O)n1,1 Z3416516099,CN(C1)CC(C2)(CN2C(CC2(CCC2)O)=O)C1c1nc(N2CCCC2)ncc1,1 M331-0447,CCC(Nc1c(/C=C/c(s2)ccc2S(N(CC2)CCN2c2ncccc2)(=O)=O)onc1C)=O,1 Z2287278216,Cc(cccc1)c1S(NC(CC1C(CC2)OC2C1)=O)(=O)=O,0 F6258-1181,O=C(C1Oc(cccc2)c2OC1)NCCN(C=NC(C1CC1)=C1)C1=O,1 Z1686399979,CC(c1c(C)onc1C)c1nc(C2OCC(CCCC3)N3C2)no1,1 Z2703570052,Cc1cccc([C@@H](C2)[C@H]2C(NCC(N2CCCCC2)=O)=O)c1,1 F5836-0008,O=C(c1c(C(F)(F)F)cccc1)Nc(cccc1)c1NC(c1ncccc1)=O,0 Z391954076,O=C(C(C1)ON=C1c1ccccc1)NCc1cnccc1,1 F1716-0241,O=C(c1cc2nccnc2cc1)Nc(cc1)ncc1Br,1 Z1659644321,Cc(nc1NC(CC(c2c3cccc2)=NNC3=O)=O)ccc1O,0 F5857-0443,OC(CNC(Cc(cccc1)c1Cl)=O)(C1CC1)c1ccco1,1 Z2827013149,CN(C(CNC(c1cc(CNC2)c2cc1)=O)c1c2cccc1)C2=O,1 Z2226355677,CC1(CO)CCN(Cc(cc2)cc(O3)c2N(C)C3=O)CC1,0 F6559-5754,Cc1noc(C)c1CC(NCc1nc(C(CC2)CCC2(F)F)no1)=O,1 Z2879778308,O[C@@H](CC1)[C@H](C2)[C@@H]1CN2C(C(NC(CCC1)c2c1cccc2)=O)=O,0 SA57-0024,O=C(C1(CCCC1)c1ccccc1)N(CC1)CCC1(C1)OCCC1Oc1ncccn1,1 F5806-0506,Cc1c(CCC(NCCOc(cc2)ccc2F)=O)c(C)nn1C,1 F6544-0102,COC1CCN(Cc2cc(Br)cs2)CC1,0 F6438-3159,Cc1noc(C)c1CCC(NCc1nc(OC)nc(N(C)C)n1)=O,1 F6526-1333,CN(CC(N(CCn(cc1)nc1-c1ccncc1)C1CCCC1)=O)S(C)(=O)=O,0 F6553-7070,O=C(c(cc1)cc2c1ncs2)N(CC1)Cc2c1sc(Cl)c2,1 Z126266458,CC(CC1)CCN1C(CSc1nnnn1C1CC1)=O,1 Z2961146066,CN(C[C@H](C1)C[C@H]1O)C(C(CCCN1CC(F)(F)F)C1=O)=O,1 Z2953744040,OCC(CC1)N1C(Nc1cc(Cn2nccc2)ncc1)=O,1 Z4966623249,NC(c(cc1)ccc1-c1cn(-c(cc2)ccc2C(O)=O)nn1)=O,0 Z1315872627,Cc(cccc1)c1-c1nn(C)c(NC(c2nc(-n3nccc3)ccc2)=O)c1,0 Z1998264121,Cc1nc(cc(cc2)C(NCC3(CC3)S(C)=O)=O)c2n1-c1ccccc1,1 E518-0778,CC(CC1)CCC1NCc1c(C(O)=O)n(Cc(cc2)ccc2OC)c2c1ccc(OC)c2,0 F6279-0376,COCCN(Cc1cscc1)S(Cc1ccc(C(F)(F)F)cc1)(=O)=O,0 S994-0869,CS(N(CC1)CCN(CCN2Cc(cc3)ccc3F)C1C2=O)(=O)=O,0 F6713-5772,Cc1c(C)ncnc1N(CC1)CCN1c1nccc2ccccc12,1 Z875493476,CCOc(nccc1)c1NC(C1COCC1)=O,0 Z1070605456,CC(C(NC1CC1)=O)N1CC(c2cccc(F)c2)OCC1,1 Z2773769998,CC(C)(C)C[C@@H](C1)[C@H]1c1nc(-c(cn2)ncc2OC)no1,0 Z2220418447,N#Cc(cc1)ccc1Oc1cccc(NC(c2c(C3CC3)ocn2)=O)c1,1 S529-0373,O=C(CN(CCCc1c2cnc(C3CC3)n1)C2=O)N1CCCCC1,1 F6127-0103,OCC(CC(C1)NC(c2c(C(F)(F)F)cccc2)=O)C1O,0 Z2665727534,O=C([C@H](CC1)NC1=O)NOCCN(CCC1)C1=O,1 F5857-5050,OC(CNC(COc1cc2ccccc2cc1)=O)C1CCCCC1,1 F475-0511,Cc1cc(C(Nc2c3cccc2)N(Cc(cc2)ccc2OC)S3(=O)=O)c(C)cc1,0 Z2596257383,CC(c1ccc(CNC(NC(Cc(cccc2)c2N2C)C2=O)=O)cc1)N,1 F6089-6275,COc1ccc(C2(CNC(c3cc(cccc4)c4[nH]3)=O)CCOCC2)cc1,1 T159-0263,Cc1cnc(CC(CCC2)CN2S(c2c(C)onc2C)(=O)=O)n1CCOC,1 F6471-0328,COc(cc1)ncc1C(N(CC1)CC1n1nnc(-c2ccccc2)c1)=O,1 Z1628075219,CC(Cc1c(C(F)(F)F)cccc1)NC(NC1COCCC1)=O,1 S827-4679,CCS(N(CC(C1)(F)F)[C@@H]1c1nc(-c2cnccc2)no1)(=O)=O,0 SC53-0439,Cc1nc([C@@](CN(C2)S(C)(=O)=O)(C3)[C@@H]2CCN3C(NCCc2ccccc2)=O)no1,1 F6788-1694,Cc1nc2ncnn2c(N(CC2)CCN2c2nc(C3CC3)nc(C)c2C)c1,1 Z815783118,C(CN(CC1)CCN1c1c(ccs2)c2ncn1)c1cccs1,1 F6516-0495,O=C(NCc1ccc(-c2cccs2)o1)Nc(c(F)ccc1)c1F,0 Z4053196762,CN(C1CCNCC1)C(C(CCC1)c2c1sc(Nc1ccccc1)n2)=O,1 Z1678151766,Cc1nccc(N(CC2)CCN2C(C2(CCCCC2)c2cccc(F)c2)=O)n1,1 Z1357373190,Cc1nc2ccccc2c(CSc2nnc3n2c(cccc2)c2n3C)c1,1 F5448-0714,Cc(cc1)cc(Nc2nc(C(N(CC3)CCN3c3ncccn3)=O)cs2)c1OC,1 SC68-1940,CC(C)Cn1c(C(CN(Cc2ccc(C)o2)C2)C22CCCCC2)nnc1,1 L562-0407,CC(C)CNC(c1cccc(-c(cc2)nnc2Oc(cc2)ccc2F)c1)=O,0 F575-0196,COc1cccc(CNC(c2cccc(Nc(cc3)nnc3-c(cc3)ccc3F)c2)=O)c1,0 D226-0069,CN(c1c(C(N2C)=O)n(CCSc3ncccn3)c(N(CC3)Cc4c3cccc4)n1)C2=O,0 L299-5984,CCCc(c(-c1cc(S(Nc2cc(F)c(C)cc2)(=O)=O)c(C)cc1)c1NC(CC2)=O)nn1C2=O,0 J025-0121,O=C(CC1c(cc2)ccc2Cl)Nc2c1scc2-c1ccccc1,0 F6416-9117,CN(C)S(c(cc1)ccc1C(NCCC(c1cccc(Cl)c1)O)=O)(=O)=O,0 Z1413670336,CC(C(c1ccccc1)N)C(NC(C)c1cccc(C(F)(F)F)c1)=O,0 F3342-0193,Cc(cc1)ccc1S(N(C)CC(CN1CCCC1)O)(=O)=O,1 8013-3024,COc1ccc(C(CC(O)=O)NC(c(cccc2)c2Br)=O)cc1,0 F6357-1521,CC(C)(CNC(c1cccs1)=O)c1cscc1,0 F1441-0371,O=S(c(cc1)ccc1Oc(cccc1)c1Cl)(NCc1ccco1)=O,1 G340-0579,O=C(C(CC1)CCN1c1nc(cccn2)c2s1)NCCc1c[nH]c(cc2)c1cc2Cl,1 F3371-0663,O=C(c1ccco1)N(C(C1)c2cccc3nccnc23)N=C1c1ccc[nH]1,1 Z1901636923,Cc1cc(Br)cc(S(NCc2nn(C)nn2)(=O)=O)c1,0 Z1452834526,CCNc1nc(C(N(CC2)CCC2OCC2OCCC2)=O)cs1,1 Z1244105765,CC(NCCNC(N(CC1)CC1c(cccc1)c1OC)=O)=O,0 Z995179654,CC(C)(Cc(cccc1)c1Br)C(O)=O,0 S984-0951,CN(C)C([C@@](CN(C1)C(c2cscc2)=O)(C2)[C@@H]1CN2C(c1ccccc1)=O)=O,1 Z3063574669,CCN(CC)C(C(C)N(CC1)C[C@H]1Oc1c(N(C)C)nccc1)=O,0 S296-4794,CCC(c1cccs1)N(C([C@H](C1)[C@@H]2CN1S(c1c(CC)cccc1)(=O)=O)=O)C2=O,0 F6507-5518,CC(C)c1nc(S(NCC(C)(COC)OC)(=O)=O)cn1C,0 F070-0902,O=C(CC1CCCC1)N(CC1)CCN1c1nc2ccccc2nc1C(F)(F)F,1 3473-0481,CC(C)(C1)OCc2c1c(C(N(Cc1ccccc1)C(SCCOc1ccccc1)=N1)=O)c1s2,1 F6507-5616,CC(CNC(C(Nc(cc(cc1)Cl)c1OC)=O)=O)(COC)OC,0 F6734-0763,Clc(cc1)cnc1N(C1)CC(C2)C1CN2c1ncnc2cnccc12,0 F6284-0399,O=C(c1cccs1)NCCc1cnc(-c2ccccc2)nc1,1 SB18-0104,CC(C)CC(N[C@@H](C[C@H]1c2nc(C)n[nH]2)CN1C(c1ncc(C)nc1)=O)=O,1 Z1370241597,Cc(ccc(C(NC(C1)CN(C2CC2)C1=O)=O)c1)c1NC(c1ccccc1)=O,1 Z859234730,CCN(C=C(C=C1)NC(NC(C2CCCC2)c2ccccc2)=O)C1=O,1 S576-0072,O=C(C(CC1)CN1C(C=NN1)=CC1=O)NCc(cc(cc1)F)c1F,0 F6200-4139,OC1(CNC(C2c(cccc3)c3Oc3c2cccc3)=O)c(cccc2)c2OCC1,1 Z435471588,O=C(CC(CC1)CCN1C(CCc1ccco1)=O)N1CCCC1,1 Z1513814170,CCc1c(CNc2c(ccs3)c3ncn2)c(CC)nn1C,0 F6676-1423,Cc1nccc(OCC2CCN(CCC=C)CC2)c1,0 SC88-0806,O=C(C1CCOCC1)N(C1)CC1(C(CC1)c2nc(-c3ccncc3)no2)S1(=O)=O,1 Z4989108184,COc(cc1)cc(CC(NS(c2cc(Cl)cc3cccnc23)(=O)=O)=O)c1OC,0 Z2909999599,CN(C)C(NC(CC1)CCN1C(c(c(O)c1)nn1-c(cccc1)c1F)=O)=O,0 Z1564048754,Cc(nc1)cnc1C(N(CCN1CCOC)CC1=O)=O,0 E587-0538,CC(CC1)CCN1C(Cn1c(cccc2)c2c(SCC(NC2CCCC2)=O)c1)=O,1 SC11-1534,Cc(nc1)ncc1C(N(CCC1)CC1N(CCCN1CCCC1)S(C)(=O)=O)=O,0 F6726-5539,CN(C(C1)CN1c(ncnc1-c(cc2)ccc2OC)c1F)C1=NC=CN(C2CC2)C1=O,1 Z1636555284,CC(C)(C)[C@@H](CO)Nc1nc(C2CC2)ns1,0 J500-0751,CN(C)C(C(C1)C2(CCCC2)CN1C(c1cscc1)=O)=O,0 Z4232416744,O=C1Nc2cnc(NC(C3)CC4C3COC4)nc2SC1,1 F6562-7882,O=C(NC(c1ccccc1)c1ccccc1)NC(CC1)C11CCOCC1,1 F6808-8176,CN(C1=O)C(NC2CCOCC2)=Nc2c1scc2,1 SA31-0288,CC(C)c1nnc(COC2)n1C2(C)C(NCCn1c(C)ncc1)=O,1 SB95-1254,Cn1c(C(N(CCC2)CC2N(CCN2CCOCC2)C(C2CC2)=O)=O)ncc1,1 Z1274617355,CN(CC1)CCC1(CNC(Nc1cn(CCOC)nc1)=O)N1CCCCC1,1 Z2271084749,Cc1cccc(NC(CN(CC2)CCN2c(nc2)ncc2C#C)=O)c1C,0 Z2832198536,OC(C(C(CC1)CN1S(c1cccc(Cl)c1)(=O)=O)F)=O,0 Z1835885542,CN(Cc1ccncc1)c1c(ccs2)c2nc(Cl)n1,0 F6442-0688,COc(cc1)ccc1S(C(C1)CN1C(CCc(cccc1)c1Br)=O)(=O)=O,0 F6619-5904,Cc1nsc(N(CC2)CCN2c2nc(C(F)(F)F)ccn2)n1,0 Z1767723482,CN(CC1(CC1)c1ccccc1)C(c1cocn1)=O,1 F2135-1587,CC(C(C(NC)=O)Sc1cccc2cccnc12)=O,0 SC39-0071,O=C(c(cc1)ncc1F)N(CC1)CC1(c1nc(C2CCOCC2)no1)F,1 F5485-1595,CCOC(N(CC1)CCN1C(CC(C(N1)=O)=C(C)N=C1SCc(cccc1)c1F)=O)=O,1 Z1420317823,CC(C)(c(cc(cc1)S(NC(C2)CN(C3CC3)C2=O)(=O)=O)c1N1)C1=O,1 S895-0953,Cc1c(C(N(CC2)CCC2(CC2)CCn3c2nnc3CCOC)=O)scc1,0 F6215-0166,Cc1noc(CCNC(CSCc2ccccc2)=O)c1,1 J100-0217,CN(C(c(cc1)c2cc1NC(C[C@H](C(Nc1c3cccc1)=O)NC3=O)=O)=O)C2=O,1 T158-0237,Cc1cnc(C(CC2)CN2C(Nc2cc(C)c(C)cc2)=O)n1CCOC,0 F6473-7738,CC(O1)=CC(OC(CC2)CN2C(C2CCCC2)=O)=CC1=O,1 F6687-5401,CN(CC(CC1)CCN1c1nc(C2CC2)ncc1)c1nccc(C(F)(F)F)c1,1 SC72-0325,COc1cc(OC)c(CN(C2)CC22OCc3c2cnc(C2CC2)n3)cc1,0 F6549-7409,O=C(c1nc(cccc2)c2s1)N(C(CC1)C2)C1CC2n1ncnc1,1 Z2011364274,CC(c1cccc(N(CCO2)C2=O)c1)N(C)C(N(C)C1CCCC1)=O,1 F6808-5267,CC(C)NC(C(C)N(CC1)CCN1c1nc2ccccc2c(C#N)c1)=O,0 F6785-6345,CSc(cccc1)c1C(N1CCC(COc(cc2)nn3c2ncc3)CC1)=O,0 Y041-7721,N1(C(N[C@H](C1=O)CCC(NCc1nc2c([nH]1)cccc2)=O)=O)Cc1occc1,0 S565-1472,Cn(c(CC1)c2CN1C(c1n[nH]c-3c1COc1c3cccc1)=O)nc2-c1nncn1CC1CC1,1 Z4521553808,CCC(CNC(Cc1c[nH]c2c1ccnc2)=O)NC(C1CN(C)CC1)=O,1 F5834-1595,O=C(CSCc1ccccc1)Nc1cc(N(CC2)C(C3CC3)=O)c2cc1,1 SB24-0510,CC(C)CNC(c1cn(C(CC2)C2(CC2)CCN2S(C2CC2)(=O)=O)nn1)=O,0 L275-0462,CN(C)C(c(cc1)cc2c1n(C)c(CN(CC1)CCN1C(c(cc1)ccc1Br)=O)n2)=O,0 S858-1212,OC[C@@]1(CN(C2)C(C3CC3)=O)[C@H]2CCN(Cc(cc2)cc3c2OCC3)C1,1 F3371-0752,Cc1cccc(-c2nc3ccccc3nc2O)c1NS(c(cc1)ccc1F)(=O)=O,1 Z2406039659,Cn1nccc1C(C(O)=O)NS(c1cc(OC)cc(OC)c1)(=O)=O,0 Z1101522427,O=C(C(CCC1)N1c1c(ccs2)c2ncn1)NCc(cc1)cc2c1OCO2,1 Z4126466015,CCC(Cn1c(N2CC3(CC3)CCC2)nnc1C1CCC1)OC,1 F1899-0930,COc(cccc1)c1-c(cc1)nnc1SCc(c(F)ccc1)c1Cl,0 F6439-8115,O=C(c(s1)ccc1Cl)NCCn1c2cc(-c3ccco3)nn2cc1,1 Z968671698,CN(Cc1cccc(F)c1)C(CCc1nc(-c2nnc[nH]2)no1)=O,0 F5600-0506,Cc(cc1)nnc1N(CC1)CCN1C(Nc1cccc(SC)c1)=O,0 Z1627658874,CC(C)N(CCN(C1)C(C=NN(c(ccc(F)c2)c2F)C2=O)=C2Cl)C1=O,1 SC88-0550,CC(C)c(cc1)ccc1C(N(C1)CC1(C(CC1)c2nc(-c3ccccc3)no2)S1(=O)=O)=O,0 Z2275698889,Cc1ccc(CC(CNC(c2c(CCC3)n3nc2)=O)CO)cc1,1 F6616-2312,CN(CC1)CCN1C(c1cccnc1SC)=O,0 F6521-3244,CC(c1ccc(CCNC(c2cc(Br)cnc2)=O)s1)O,0 S694-0982,Cc1cnc(-c2cnccc2)n1C(CC1)CN1C(C1(CC1)c(cc1)ccc1OC)=O,0 V018-8959,COc(cc1)ccc1-c1cc(CN(CC2OCCC2)C(c2ccco2)=O)no1,0 F6560-0260,O=C(CNC(OCc1ccccc1)=O)N(C(CC1)C2)C1CC2Oc1ncccc1,1 C648-0222,CN(c(ccc(S(N(CCC1)CC1C(Nc(cc(c(OC)c1)OC)c1C(O)=O)=O)(=O)=O)c1)c1O1)C1=O,0 SC88-2015,COc1ccc(Cc2noc(C(CC3)C(C4)(CN4C4CCCCC4)S3(=O)=O)n2)cc1,1 SB46-0250,Cc1ccc(CNC([C@H](C[C@H]2CN(C3)C(C4CCOCC4)=O)C[C@@H]2NC3=O)=O)o1,1 Y043-6523,c1(nsc2c1cccc2)N1CCN(C(N[C@H](C(Nc2nccs2)=O)C)=O)CC1,1 SA24-0072,OC[C@H](CC(C1)(F)F)N1C(C1)CN1C(CN(c(cccc1)c1O1)C1=O)=O,1 Z2720861546,C#CCNC(CSc(nc1)nc(CCC2)c1C2=O)=O,1 G803-0618,Fc1cc(-c2noc3ncnc(NC4CCN(Cc5ccccc5)CC4)c23)cc(F)c1,0 S020-2493,O=C1N=C(c(cc2)ccc2F)NC(C2)=C1CCN2S(c1cccc2cccnc12)(=O)=O,0 F6446-1271,CN(C(C=C1)=O)N=C1C(NCC(CCC1)CN1c1nccs1)=O,1 SB24-0342,Cc1ccc(C(N(CC2)CCC2(CC2)C2n2nnc(C(N(C)C)=O)c2)=O)s1,0 Z1619640736,CCC1(CNC(CN2N=CN(C)C2=O)=O)CCN(Cc2ccccc2)CC1,1 F2927-0218,O=C(CN(C(c1c2sc(N3CCCCC3)n1)=O)N=C2c1ccccc1)c(cc1)cc2c1OCCO2,1 G856-4971,COc(cc1)ccc1N(CC1)CCN1C(CNS(c(cc(cc1)F)c1F)(=O)=O)c1ccco1,0 F6795-3537,Cc1c(C)nc(cc2)n1nc2N(CC1)CCN1c(nc(CCCC1)c1c1)c1C#N,1 Y041-8362,CC(C)CCN(C(C)=O)c1nc(C)c(C(N(CC2)CCC2C(N)=O)=O)s1,0 J031-1603,Cc(cc1)cc(C)c1NC(CSc1nnc(-c2c(C)cc3OCCCOc3c2)n1C)=O,0 F1827-0048,CCN(CCN(CC(Nc(cc1)ccc1C(OCC)=O)=O)C1=O)C1=O,0 P297-4239,O=C(c(cc1)ccc1Br)N(CC1)CC1n1c2ncccc2nc1-c1cocc1,1 Z2027441650,CC(c1c(C2(CCCC2)C2)cc3OCCOc3c1)N2C(c(cc1)nc(N2)c1NC2=O)=O,1 Z1625171706,Cc(ccc(C(N(CCC1)CC1C(NC)=O)=O)c1)c1O,0 Z3050741152,CC(N(CSC1)[C@H]1C(NOC1COCC1)=O)=O,1 Z1433638952,OCCN(CC1)CCN1C(Nc(cccc1)c1Sc1ccccc1)=O,1 Z1720038381,CC(C)(C1)Oc(cc2)c1cc2NC(C(C=C(C1CC1)N1)=CC1=O)=O,1 F6403-0558,O=C(c1cccs1)N(Cc1cnc2n1cccc2)C1CC1,1 F2616-0420,O=C(C(Nc(cccc1)c1F)=O)NCCc1ccco1,0 SA70-0532,Cc1cc(C(N(CCC2)CC2(CCOC)c2noc(C)n2)=O)nn1C,1 Z2647721699,Cc1c(C)sc(C(NCC(CC2)(CCC2(F)F)O)=O)n1,1 Z1623298318,O=C(c1nccc2ccccc12)N(CC1)CCC1N(CC1)CCS1(=O)=O,1 E130-0666,Clc1cc(-c2nc(NCCN3CCOCC3)nc-3c2COc2c3cccc2)ccc1,1 F5496-1568,COc1ccc(Cc2nnc(C(CC3)CCN3C(Cc3cccs3)=O)s2)cc1,1 F5256-0004,Cc1cc(-c(o2)nnc2SCC(N(CC2)c3c2cccc3)=O)c(C)o1,1 L823-0151,O=C(c1nc(-c2csc(S(Nc(cc3)cc4c3OCCO4)(=O)=O)c2)no1)N1CCCC1,1 F2487-0282,O=C(CSc1ccccc1)N(C1)c(cccc2)c2NC1=O,1 L285-0899,Cc(ccc(-c(cc1)nnc1NCC1OCCC1)c1)c1S(N1CCCCC1)(=O)=O,1 Z2641316890,CN(C(CC(N(CC1)CCN1c(cc1)ncc1OC)=O)CC1)C1=O,1 T619-3352,Cc1noc(C2N(Cc3nc(Cc(cc4)ccc4F)no3)CCCC2)n1,1 F6497-0403,O=C(Cn1c(cccc2)c2nc1)N1CC(Cc2nc(C3CC3)no2)CCC1,1 F2536-0485,CCOC(c(cc1)ccc1NC(CS(c(cc1)ccc1Cl)(=O)=O)=O)=O,0 Z2701629668,Cn1nnc2c1ncnc2N(CC1)CC1c(cc1)cc(F)c1OC,1 Z3136984736,NCC1(CCC1)C(CCCC1)N1C(c(cnnc1)c1O)=O,1 G414-0489,Cn1ncc2c(Nc3ccccc3)nc(N(CC3)CCC3N3CCCCC3)nc12,0 Z3016332265,Brc1cn(CCNC2CCC3(CSC3)CC2)nc1,1 F856-0123,CCCn1nnc2c1ccc(S(N(CCC1)CC1C(NCCN(C)C1CCCCC1)=O)(=O)=O)c2,1 SA93-0454,Cc1c(C(N(CCC2)CC2(CC2CC2)C(N)=O)=O)sc(C)n1,1 Z1603382300,OC(CCN(Cc(cc1)cc(F)c1F)C(c1cnncc1)=O)=O,0 S727-1125,Cc1nn(C)c(C(N(C2)CC2n2nnc(COCC3CC3)c2)=O)c1,0 F6521-5510,COC(CCSC)CNS(c(cccc1)c1OC(F)(F)F)(=O)=O,0 Z1343760573,Cc(cc1)c(C)cc1N(CCC(N1)=O)C1=O,0 V011-6830,O=C(CCC1CCCC1)NC(CCCC1)C1NC(c1csc(COc(cc2)ccc2Cl)n1)=O,1 Z2027201016,Cc1nc(C)nn1C(C1)CN1C(c(cc1)cc(OC)c1Cl)=O,0 F2496-3038,O=C(c1nc2ccccc2cc1)OCc1noc(-c(ccc(F)c2)c2F)c1,1 Z1068003022,CCC(NC(C(N(CC1)CCN1c(cccc1)c1F)=O)c1ccccc1)=O,0 Z2109765014,O=C(c(cccc1)c1OC1CC1)N(CC1)Cc2c1[nH]c(cc1)c2cc1F,1 F6454-0752,O=C(c1cc(Br)cs1)NCC1CCN(CC(F)(F)F)CC1,0 Z2218223710,C(c1c(C2)n(-c3ccccc3)nc1)N2c1ncnc2c1cc[nH]2,0 F6808-9123,Cc1ccc(CNC(CN(CC2)CCN2S(C2CC2)(=O)=O)=O)cc1,1 F5033-2674,CC(C)(C)NC(N1CCC(CNC(c(cc2)ccc2Br)=O)CC1)=O,0 Z3369920538,Cc(cc1)cc(C(N2CC(Cc3nnn[nH]3)CC2)=O)c1O,1 S831-2190,COC[C@@H](CN(Cc1cc(C#N)ccc1)C1)[C@H]1c1ncccc1,0 S904-0937,CN1Cc2nnc([C@H](C3)N(Cc4cc(F)cc(F)c4)C[C@H]3O)n2CC1,0 F6573-8489,O=C(c1cocc1)N(CCN1c(nc2)ncc2F)CC1=O,1 SA89-0281,Cc1noc(C)c1C(N1CCC(CN(CCN2CCOCC2)C2CCOCC2)CC1)=O,1 Z1942233103,Cc1cc(SC)c(CNC(c2c(C(F)(F)F)scn2)=O)cc1,0 F6479-3179,O=C(CN1N=CC=CC1=O)N(CC1)CCC1Oc(ccnc1)c1Cl,1 F6512-6963,Cn1ncc(S(N(CCC2)CCN2C(Cc2cccs2)=O)(=O)=O)c1,1 F2553-0268,CSc(cccc1)c1C(Nc(sc1c(cc2)Cl)nc1c2Cl)=O,0 F6178-2041,N#Cc1cccnc1N1CCC(CNS(Cc2cc(F)ccc2)(=O)=O)CC1,1 G431-0260,Cc1nc2nc(-c3ccco3)nn2c(Nc(cc2)ccc2N2CCOCC2)c1,0 F5092-0170,Cc1nc(-c2cccs2)c(CCC(N(CC2)CCN2c(cccc2)c2F)=O)s1,1 Z4497009021,Cc1nc(NC(Cc2cccc(C(F)(F)F)c2)=O)nn1-c1ccccc1,0 F6791-9618,CC(C)c1ncnc(N(C)CC2OCCOC2)c1F,0 F6492-0385,OC(Cc1c2cccc1)C2NC(C(CC1)Cc2c1[nH]cn2)=O,1 F6678-7865,O=C(COc(cc1)ccc1F)N(C1)CC1n1c(cccc2)c2nc1,1 S639-0561,CN(C)C[C@@H](CN(C1)c2ncncc2)[C@H]1NC(c1n[nH]c2c1cccc2)=O,0 F1885-0317,O=C(c(cc1)ccc1F)NCc(o1)nnc1SC/C=C/c1ccccc1,1 Z3686928275,CCN(C)c1cc(N(C2)[C@@H](CNC(c3cc(C)ncc3)=O)C[C@H]2O)ncn1,0 F6473-1156,O=C(CCc(c(Cl)ccc1)c1Cl)N(CC1)CCC1N(CC1)Cc2c1scc2,0 4802-0265,CC(C)(C1)CC(NC(c2c3cccc2)=C(C2c4cc(OC)ccc4)C3=O)=C2C1=O,0 Z915622100,Cc1nc2cc(OC)ccc2cc1C(NCCc1nccn1C)=O,1 Z1015600130,Oc1cccc(CC(N(CCCC2)C2c2ncc[nH]2)=O)c1,0 Z3051894702,O=C(c1nn(CC(F)(F)F)cc1)N1CC(c2ccco2)=CCC1,1 Z2484101574,CCCC(C)C(CO)NC(Cc1c(C)n(CC2CC2)nc1C)=O,0 SB21-1271,NC(c1cn(C[C@H](C[C@@H](C2)F)N2S(c2cnccc2)(=O)=O)nn1)=O,1 3261-1057,CCOc(cccc1)c1NC(c1c(NC(C(C)Oc(cc2)ccc2Cl)=O)sc2c1CCCCC2)=O,0 Z1609350754,CCS(NC(CC1)CCN1C(c1c(C)nc(C)nc1)=O)(=O)=O,0 F6560-3157,Cc1nn(C)c(C(NCc2cn(-c3cccs3)nn2)=O)c1,1 F5857-0526,CN(C)S(c(cc1)ccc1C(NCC(C1CC1)(c1ccco1)O)=O)(=O)=O,0 Z1757181127,CN(C=NC(C1)=C2CCN1C(NCCC1=CCCC1)=O)C2=O,1 F3320-0801,Cc(cccc1)c1OCCSc1nc(cccc2)c2n1C,0 F1406-0296,Cc(cc(cc1)S(NCc(cc2)ccc2OC)(=O)=O)c1F,0 F6438-3767,CN(C)c1nc(CNC(Cn2c(cccc3)c3nc2)=O)nc(N2CCOCC2)n1,1 Z2768784077,COC(C1Cn2c(C(Nc3ncccc3)=O)nnc2CC1)=O,1 SA44-1032,CN(CC(C1)(CN1C(c(cc1)cc(F)c1F)=O)C1)C1c1nnc(-c2ccccc2)o1,0 F114-0478,COCc1nc2cccnc2n1C(CC1)CCN1C(Nc(cc1)cc2c1OCCO2)=O,0 Z3027211279,CC(CC1)C(C)CN1S(c1cnc(C2OCCO2)s1)(=O)=O,1 F6435-9113,COC(CSC(CC1)CN1C(c(cc(cc1)Cl)c1OC)=O)=O,0 Z1189947421,COc1cccc(CNC(N(CCC2)C2c(cc2)cc(F)c2F)=O)n1,0 Z2212081302,OCC(CC1)(CCN1C(NC1CCCCC1)=O)c1ccccc1,1 F840-0743,Clc1cc(-c2noc(CSc(cc3)nnc3-c3ccc(C4CCCCC4)cc3)n2)ccc1,1 Z406230056,Cc1ccc(-c2nc(C(NC(CC3)CCC3C(N)=O)=O)cs2)o1,1 Z1869503454,OC(CNC(c(ccnc1)c1Br)=O)=O,0 L968-0420,Cc1ccc(c(Nc(cc2)cc3c2OCCO3)c(cn2)C(N3CCOCC3)=O)c2n1,1 J078-0457,O=C(CN(c(cccc1)c1C(C(N1CCCC1)=O)=C1)C1=O)Nc(cccc1)c1Cl,1 F6418-2485,CCOC(NCc1ccc(C(c2ccccc2)O)s1)=O,1 Z1005103274,Oc1cccnc1C(N(CC1)CCC1c1nc(cc(cc2)Cl)c2s1)=O,1 Z1627399559,Cc1cc(S(N)(=O)=O)cc(NC(c(cc2)ccc2-c2ncnn2C)=O)c1C,1 3368-0644,N#Cc1cc(CCCCC2)c2nc1SC(CC(N1c(cc2)ccc2Br)=O)C1=O,1 F6556-6562,O=C(NC1CCCC1)N(CCC1)CCN1C1CSCC1,1 F0909-0063,C=C1Sc2nnc(-c(cc3)ccc3Br)n2C1,1 Z3204208076,Cn1nc(C2CC2)c(C(NC(Cc(cncc2)c2N2)C2=O)=O)c1,1 Z839875778,CC(C(Nc1cccc(C(NC)=O)c1)=O)N(CC1)CCC1C(c1ccccc1)O,1 S512-0288,O=C(c1cocc1)N(CC1)CC1Oc1cccc(F)c1,0 F3077-0001,CCOc(cccc1)c1NC(c1ccc(-c2c(C(F)(F)F)cccc2)o1)=O,0 S614-0937,N#Cc1ccc(CN(CCCC2)C2c2nc(CCOCC3CCCC3)no2)cc1,0 F0916-6603,O=C(CSC(N(Cc1ccccc1)C1=O)=Nc2c1scc2)Nc1c(C(F)(F)F)cccc1,0 C887-1930,CCC(C(NCCCN(CC)c1cc(C)ccc1)=O)N(C1=O)N=C(C)n2c1cc1c2cco1,1 F6494-0700,CC(C=C1)=NN(CCNC(c2ncnc(OC)c2)=O)C1=O,1 Z1687418624,NC(c(cncc1)c1N(CC1)CCC1c1nc(cc(cc2)Cl)c2s1)=O,1 Y043-2183,O=C(CCn(cc1)c2c1ccc(OCc1ccccc1)c2)Nc1nnc(C2OCCC2)s1,1 Z2294521557,CCN(CC1OCCC1)C(Nc1c(C)nc(C)cc1C)=O,0 K284-3204,O=C(CSC(N1CCC(N(CC2)CCN2c2ccccc2)=O)=Nc(cccc2)c2C1=O)NCC1OCCC1,1 E228-3045,O=C(CCCN(c(cc(cc1)Br)c1-n1c2ccc1)C2=O)NCCc1c[nH]c2c1cccc2,1 C374-2265,Cc(cc1)ccc1-n1ncc2c1N=C(c(cccc1)c1F)N(c(cc1)cc3c1OCCO3)C2=O,1 Z1824560524,CC(CC(NCC1)=O)N1C(c(cc1)cc(nc2)c1n2-c1c(C)ccc(C)c1)=O,1 S956-5236,Cc1cc(S(N(CC2)CC(COC)N2c(cc2)cc(C(F)(F)F)c2C#N)(=O)=O)c(C)cc1,0 Z3992203372,NC(CCC(Nc(cc1)ccc1-n1ncc2c1cccc2)=O)=O,0 Z2991626871,CC(C1)OC(C)(C)CN1C(CN(C=Nc(c1ccc2)c2Cl)C1=O)=O,1 F3406-7148,Cc1cc(C)nn1-c1cc(SCC(NCc2ccc(C(F)(F)F)cc2)=O)ncn1,1 F6512-0033,O=C(Cc1noc2c1cccc2)N1Cc2ccnn2CC1,1 SC04-0286,CC(C)CNC(N(CCC1)CC1OCCc1noc(-c2ccccc2)n1)=O,0 F2183-0233,Clc1cc(-c2nc(-c3cnccc3)n[nH]2)ccc1,0 F9995-0696,Cc1c(C)c(S(NC2(CCCCC2)C(O)=O)(=O)=O)c(C)c(C)c1,0 F6436-1525,CCOc(nccc1)c1C(Nc1ccc(CC(N2CCOCC2)=O)cc1)=O,1 F6744-5907,C(C1)Cc2c1c(NC(CC1)CN1C1CCOCC1)ncn2,1 F5860-3678,CCOC(C(CC1)c2c1sc(NC(Cn1nc(C)cc1C)=O)n2)=O,1 F367-0231,CCC(C)NC(CSc(n1-c2c3cccc2)nnc1N(CCc1ccccc1)C3=O)=O,1 Z2453751001,CC(COc1c2cccc1)C2NC(Cc1cccc(CC(F)(F)F)c1)=O,0 Z3290588528,O=C(c1cc(cn[nH]2)c2s1)NCCCc1n[nH]cn1,1 Z1887392683,CCOC(C1)CC1(CNC(c1c(C)ccc(F)c1)=O)O,0 Z2720850206,N#Cc1csc(CSc(nc2)nc(CCC3)c2C3=O)n1,0 F6155-0209,O=C(C(C1)CN1c1nc(cccc2)c2s1)Nc1cccc2cccnc12,1 D323-0408,O=C(C1=Cc(cccc2)c2OC1=O)N(CC1)CCC1c1nc(cccc2)c2o1,1 P207-8975,Clc1c(Cc2nc(-c(cc3)ccc3OC3CNCC3)no2)cccc1,1 Z2784398377,CC(CC1)(CCN1c1nnc(-c(cccc2)c2Cl)n1C)F,0 F5910-0409,Cc(cc1)ccc1Nc1nc(C)cc(N(CC2)CCN2C(c2cccs2)=O)n1,1 Z1919635513,CC(CN(CC1)c2cccc3cnccc23)N1C(C(CCC1=O)n2c1ccc2)=O,1 Z1890916871,CCc1nc(C2=CC=C(C)N(C)C2=O)no1,0 4708-0284,Clc(cc1)ccc1-c1csc2ncnc(N3CCN(C/C=C/c4ccccc4)CC3)c12,1 Z1527425776,CN(Cc1cc(Cl)cc(Cl)c1)C(C(CC1)CCC1(F)F)=O,0 Z1364196599,Cc1nn(CCCC2NC(N3CC(Cc(cc4)ccc4F)CC3)=O)c2n1,1 F6258-2959,CC(C)(C)c(cc1)ccc1NC(NCCN(C=NC=C1C)C1=O)=O,0 F6513-4682,CCOC(C(CCC1)CN1c1nc2ccccc2nc1NS(c1cn(C)nc1)(=O)=O)=O,0 SA87-0106,CC(C)CN(CC(CNC(CCc1nc(cc(cc2)Cl)c2[nH]1)=O)OC1)C1=O,1 SD07-0383,Cc1cccc(C(NCc2c(COC(CC3)(CN3C(CCC3CCCC3)=O)C3)n3nn2)=O)c1,1 F2215-1098,CC(N=C(N1)n(c(NC(c(ccc(F)c2)c2Cl)=O)c2)nc2-c2ccccc2)=CC1=O,1 F6440-2511,Cn1nc(CNC(c2cc(-c(cc3)ccc3F)nn2C)=O)c2c1CCCC2,1 F6795-3620,CC(C)(C)c(nc1cc2)cn1nc2N(CC1)CCN1c(cc1)nn2c1nnc2C(F)(F)F,0 F1115-0107,CCc(cccc1C)c1N(COCC)C(CSc1nc(cccc2)c2[nH]1)=O,0 Z1162460839,CC(C)(C(OC)=O)NC(c1cncc(O)c1)=O,0 Z3063441894,O=C(Cc1cc2ccncc2cc1)N([C@@H]1[C@H](C2)OCC1)[C@@H]2C(NC1CC1)=O,1 T502-1304,COc1ccc(C2(CC2)C(N(CC2)CCC2(C(N2CCCC2)=O)F)=O)cc1,1 F6469-2472,CC(C)(C(N(CC1)CCN1c1ncnc(-n2ncnc2)c1)=O)Oc(cc1)ccc1Cl,1 Z4656798609,CC(C)(c(c(Cl)c1OC)ccc1OC)N,0 F5791-2734,Cc1noc(C)c1CCC(NCCc1ccncc1)=O,1 Z1220021055,NC(c1cn(CC(N(CCOC2)C2c2ccco2)=O)c2c1cccc2)=O,0 SC08-0030,CS(N(CC1)CCC1c1noc(C(C2)CN2C(c(cc(cc2)Cl)c2F)=O)n1)(=O)=O,1 ZC46-0088,O=C(c1cn(CCN(C2c3ccccc3)C(c3cnc[nH]3)=O)c2n1)Nc1ccccc1,1 Z809237234,CC(CN1CC(C)CCC1)NC(C(C)SCC(N1)=Nc(sc(C)c2C)c2C1=O)=O,1 Y503-3585,O=S(c1ccccc1)(N(CC1)CCC1c1nnc(Nc2nn(Cc3ccccc3)cc2)s1)=O,1 F6452-0068,CC(CNC(CN(C(CC1)=O)C1=O)=O)(c(cccc1)c1F)OC,0 SC70-0075,Cc1c(C(N(C2)CC3(CCC3)C2c2n[nH]c(-c3ccncc3)n2)=O)ocn1,1 Z1555417894,CCc1cccnc1C(N(CC1)CCN1C(CN1CCOCC1)=O)=O,0 F6713-5316,Cc1cncnc1N(CC1)CCN1c1nc(cccc2)c2o1,0 Z735646016,CC(N(CCC1)CCN1C(Cn1ncc(C)c1)=O)=O,0 F6745-1685,CSc1cccc2c1nc(N1CC(Cn3cncc3)C1)s2,0 Z2625785375,C#CCNC(CNC(c(cc1)cc(N2C3CC3)c1NC2=O)=O)=O,0 F6559-1492,O=C(c1cc(-n2nccc2)ccc1)NC(CC1)CCC1(F)F,1 F6808-5948,N#CC(CC1)(CCN1c1cnc(cc(cc2)Cl)c2n1)c1ccccc1,0 F6680-2799,CCc1ncnc(N(CCN2c3cc(C(F)(F)F)ncc3)CC2=O)c1F,0 E848-0905,O=C(Cn(cc1)c(cc2)c1cc2S(N1CCCCCC1)(=O)=O)NCC1OCCC1,1 Y042-3045,N1(C(c2c(S1)cccc2)=O)[C@H](C(=O)O)CC(C)C,1 F6616-3126,CN(C)c1ccnc(-n2ncc(Br)c2)n1,0 SA57-0517,CC1(CCCCC1)C(N(CC1)CCC1(C1)OCCC1Oc1nccc(C)c1)=O,1 Z2851481862,CC(C)(C)c1nnc(N2CC(Cc3ccccc3)(CO)CCC2)o1,1 Z1603088191,CC(C)(CN(CC1)C(C2CC2)=O)N1C(c1c(C)cc(C)[nH]1)=O,1 F6258-1272,Cc1c(C(NCCN(C=NC(C2CC2)=C2)C2=O)=O)n(cccc2)c2n1,1 F6571-2947,Cc(cc(cc1)F)c1S(NCC1(CCSCC1)OCCO)(=O)=O,0 K221-2717,CC(CCc1ccccc1)NC(CCCN(C(c(cccc1)c1N1)=O)C1=O)=O,1 F6544-1086,Fc1cnc(N2CCC(Cn3cncc3)CC2)nc1,1 F6808-8246,C(CN(C1)c2nc3ccnn3cc2)c2c1ccs2,1 Z3016331552,COC(CNS(c(c(O)ccc1)c1OC(F)(F)F)(=O)=O)=O,0 F0006-0445,Nc1nc(-c2ccc(Cc3ccccc3)cc2)co1,1 L334-2360,Cn1nccc1C(NCCC(CC1)CCN1C(Nc(cc(cc1)F)c1F)=O)=O,1 F6539-3700,O=C(CSCc1ccccc1)NCCCc1cc(cccc2)c2o1,1 Z1763108275,CC[C@@H](CO)NCc(s1)ccc1Cl,0 SB95-0713,Cn1c(cccc2)c2c(CN(CCC2)CC2N(CCN2CCCC2)C(C2CCC2)=O)c1,0 Y032-4529,CC(Cc1nnc(NC(C(CCC2)CN2C(N(C)C)=O)=O)s1)c1ccccc1,0 SA52-0204,CC(C)CCNC(N1CC(c2nc(C)no2)N(CC(C)C)CCC1)=O,0 F6517-3143,OC(CNC(COc1ccccc1)=O)c1cc(-c2ccco2)cs1,1 Z2838126937,N#CC1(CN[C@@H]2[C@@H](c(cc3)cc(F)c3F)OCC2)CC1,0 SA01-0699,CCCS(N(CC1)CC1c1nc(N(C)C)ncc1C(NC(C)C)=O)(=O)=O,0 SA24-0236,CCOC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1c(C)ccs1)=O,1 F6491-1089,CC(C)S(N(CCC1)CC1Oc1nccnc1C#N)(=O)=O,0 Z2483032775,OC(C(c(cc1)ccc1F)N(CCC1)CC1n1nncc1)=O,0 P645-1176,CCc1cc(C(Nc(cc2)cc3c2OCCO3)=O)nc2cc(-c3ncccc3)nn12,1 Y041-0390,O=C(CN1N=C(CCCCC2)C2=CC1=O)N(CC1)Cc2c1cccc2,1 Z1675214119,OC(c1coc(C(Nc2cccc(OCC(F)(F)F)c2)=O)c1)=O,0 V021-3333,CC(C)CNC(C(C1CCCC1)N(CC1)CCN1C(Cc(cc1)ccc1OC)=O)=O,1 F6519-4194,O=C(c1cc(cccc2)c2o1)NCC(c1cccs1)n1nccc1,1 Z3268557778,Cc1n[nH]c(CN(CC(C2)C(O)=O)c(cc3)c2cc3F)n1,1 E524-0985,CCC(C)NC(CCN(C1=O)c2ncccc2-n2c1ccc2)=O,1 Z1026487938,Cc1c(C(N(CCC2)CC2N2CCCC2)=O)nco1,1 Z2617134253,CCOC1(CCOCC1)c1nc(C2(CCC2)c2ccncc2)no1,1 Z1275016226,CC(C(Nc1n[nH]c(C2CCOCC2)c1)=O)c(cccc1)c1F,0 F6161-0216,O=C(CCN(C=Nc1c2cccc1)C2=O)NCCN(C=NC(c1ccccc1)=C1)C1=O,1 Z3305814074,COc(ccc(C1OCCN(CC(Nc2ccnn22)=CC2=O)C1)c1)c1OC,0 S517-1286,CN(CC(N1CCC(Cc2nncn2CC2CC2)CC1)=O)S(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,1 E569-0072,CCCCN(C)C(NCc1noc2c1cc(C)cc2)=O,0 F6788-9238,CN(C(CC1)CN1c1ncnc(C2CC2)c1F)S(C)(=O)=O,0 Z2460784761,CCOc1ccc(CC(N(CC2)CC2(C(O)=O)c2ccccc2)=O)cc1,0 Z642230190,COc1cc(CCN(CCN(CCC2)C2=O)C2)c2cc1OC,1 F2413-0183,O=C(C(CCC1)N1S(c(cc1)ccc1F)(=O)=O)Nc1c(CCC2)c2no1,1 E532-2412,Cc(cc1)cc2c1[nH]cc2CCNC(c(cccc1)c1NC(C1=C(C)OCCS1)=O)=O,1 Z2972592614,CCc1c[nH]c2c1c(NC[C@H](C)N(C)C)ncn2,0 F6660-1887,O=C1N(CCc2ccccc2)C=CN(CC2CCC2)C1=O,1 F2223-0043,Cn1c(SCC(NCc2ccco2)=O)ncc1-c1ccccc1,1 2292-0170,Cc(cc(C1(CCCCC1)c(cc1)cc(C)c1N)cc1)c1N,1 V028-2182,CCC(C)c1nc(N2CCOCC2)c(c(CCC(C)C2)c2s2)c2n1,0 F6446-1291,COc(nccc1)c1C(NCC(CCC1)CN1c1nccs1)=O,1 Z1174766344,CN(Cc1ncc[nH]1)C(C1=CC=CN(Cc2ccccc2)C1=O)=O,1 F6521-8070,COC(CNS(c(cccc1)c1Br)(=O)=O)c(s1)ccc1Cl,0 3002-0212,NC(c1c(NC(C2=Cc(cc(cc3)Br)c3OC2=O)=O)sc2c1CCCC2)=O,1 L164-0729,Cc(cccc1)c1S(Nc1ccc(C2(CC2)C(NCCCc2ccccc2)=O)cc1)(=O)=O,0 M056-0114,O=C(Cn(cc1)c2c1c(SCc(cc1)ccc1F)ncc2)NCCC1=CCCCC1,1 F6181-0220,OC(CNC(C1(CC1)c(cc1)ccc1F)=O)(c1cccs1)c1cccs1,1 F6556-6017,O=S(C1CC1)(N(CCC1)CCN1C1CCC1)=O,1 F6521-4846,CSCCC(CNC(Cc1cscc1)=O)O,0 F6191-0336,OC1CCN(CCNC(C(NC2CC2)=O)=O)CC1,1 S932-3383,O=C(CCC1CCCC1)N(CC1)CC1n1nnc(COc2ccccc2)c1,1 Z7331954756,O=C(CC(Cc(cccc1)c1Cl)C1)N1c1cncc2ccccc12,1 Z1609244443,Cc1cc(C(N(CC2)CCC2c(cc2)ccc2O)=O)cc(O)n1,0 Z2904407723,CN(Cc1cn(C)nn1)C(C(O)=O)c1cccc(Cl)c1,0 F5857-6545,OC1(CNC(C(Oc2c3cccc2)=CC3=O)=O)C=CCCC1,1 F2270-0072,Cc(ccc(Cl)c1)c1S(Nc(cc1)cc2c1Oc(cccc1)c1N(C)C2=O)(=O)=O,0 Z981547436,CCN(C1CCCC1)S(c1cccc2ncccc12)(=O)=O,1 SA96-1546,CC(C)NC(C1C(C2)(CN2C(CCc2ccccc2)=O)CN(Cc2ccccc2)C1)=O,0 Z2358598848,Cc1cc(N(C)CC(O)=O)nc(C2CC2)n1,0 F6571-0262,Cc(cc(cc1)F)c1S(NCC(c1csc2c1cccc2)N(C)C)(=O)=O,0 Z1676028306,Cc1nccc(N(CC2)CCN2C(c2cccc(F)c2F)=O)n1,0 F1762-0563,CC(Cc1c2cccc1)(C(Nc1c(C(OC)=O)c(CCCC3)c3s1)=O)OC2=O,1 F5230-0327,O=C(NCCN(C(C=C1)=O)N=C1c1cnccc1)Nc(cc(cc1)F)c1F,1 S904-1396,CCn1nc(C)c(CN(C[C@H](C2)O)[C@@H]2c2nnc(C3)n2CCN3C(C(C)C)=O)c1C,0 F372-2288,O=C(NC1CCCCC1)N(CC1)c(cc2)c1cc2S(NCc1cccc(Br)c1)(=O)=O,0 S649-1027,O=S(c1cccs1)(N(CC1)CCC1N(C1)C2(CCOCC2)C1OCC1CC1)=O,1 Z1262406470,NC(c(cc1)nnc1NC1CCCC1)=O,1 F1316-0035,CCOC(c(cc1)ccc1NC(CSc1nc2ccccc2c(C)n1)=O)=O,0 F6561-1142,COCc1cn(C(CC2)CN2S(CCC(F)(F)F)(=O)=O)nn1,1 L888-0426,CCn1c(SCC)nnc1-c1nn(C)c(CC2)c1CN2S(c(cc1)ccc1C(C)=O)(=O)=O,0 F5854-3881,CC(C)Sc1ccc(CC(N(Cc2cccn2C)C2CC2)=O)cc1,0 F6089-6670,O=C(c(s1)ccc1Cl)NCC1(CCOCC1)c(cc1)ccc1F,0 F6502-5938,O=C(Nc1cn2nccc2nc1)Nc(cccc1)c1Cl,0 C562-1240,CC(C)CC(C(Nc1nc(ccc(C)c2)c2s1)=O)NS(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,1 F5834-3765,CCCS(N(CC1)Cc2c1ccc(NC(c1cn(C)nc1OC)=O)c2)(=O)=O,1 Z435662794,CC(c(cc1)cc(CC(N2CCN(CCOC)CCC2)=O)c1OC)=O,0 3448-4397,Oc(cc1)ccc1N(C(c(cc1)ccc1Cl)Nc1c2cccc1)C2=O,0 S963-3443,CNC([C@@H](CN(Cc1cnccc1)C1)[C@H]1NC(c1nccnc1)=O)=O,0 F6445-3200,Cc1nn(cc(CCCNC(c2cc(-c(cccc3)c3OC)n[nH]2)=O)cn2)c2c1,1 F6721-8714,C(c1ccccc1)N(CC1)CCN1c1nnc(C2CC2)s1,1 F1967-1707,Nc(cccc1)c1-c1csc(-c(cccc2)c2F)n1,0 Z4083267083,Cc1n[nH]cc1CNC(C(N(CCC1)CC1c(cc1)ccc1F)=O)=O,1 Z3414639783,CC(C)Cc(cc1)ccc1C(NC[C@H](C[C@@H](C1)OC)N1c1ncncc1)=O,0 Y042-7625,c1(nc2c(n1C(C)C)cccc2)[C@@H](NC(C1CC1)=O)C(C)C,0 Z1855844118,CC(c1c(C(F)(F)F)cccc1)NS(C1COC1)(=O)=O,0 M337-0042,Cc1nnc(-c2cc(n(CC(NC3CCCC3)=O)cc3)c3cc2)o1,1 Z2953812065,O=C(c(cc1)ccc1N1CCCCCC1)NCc1nnn[nH]1,1 D635-0048,CN1CCN(Cc(c(O)c(cc2C3=C4CCCC3)Cl)c2OC4=O)CC1,1 D724-0363,Cc1cc(C)nc2nn3c(N4CCN(CCOc5cc(OC)ccc5)CC4)cc(C)nc3c12,1 Z459677818,O=C(CNC(NC1CC1)=O)Nc1cccc2ncccc12,1 S831-1756,NC(COC[C@@H](CN(C1)C2CCC2)[C@H]1c1ncccc1)=O,1 F6808-3493,FC(CN(CC1)CCN1c1nsc2c1cccc2)F,0 F6296-1135,Cn(cc1C(NCc2cc(-c3cccs3)nn2C)=O)nc1OC,1 F6573-2600,O=C(Cc1cccs1)NCCOCCn1nccc1,1 F5854-2938,Cn1c(CN(Cc2cccs2)C(CN(C(CC2)=O)C2=O)=O)ccc1,1 Z1861982562,OC(C1(CC1)NC(c(cc(cc1)O)c1Cl)=O)=O,0 Z4345773510,NC(C(CC1)CCN1c1ccc(CNC(c2cc(S(N)(=O)=O)c(CCC3)c3c2)=O)cc1)=O,1 Z1518171648,CCN1CCC(CCNC(N(CC2)CC2c2nccn2C)=O)CC1,1 F6813-0240,O=C(C1OCCC1)N(CC1)CCN1c1nc(-c2ncccc2)ccn1,1 Y044-4904,COc(c(OC)c1)cc(C2)c1C=CN(CCC(Nc1nc(CCC3)c3s1)=O)C2=O,1 Z2964072646,OC1(CCC1)C1(CNC(c2c(C(F)F)nc3n2cccc3)=O)CC1,1 Y205-5240,NC(CSC(N1CC2OCCC2)=Nc(cccc2)c2C1=O)=O,0 V007-4510,COc1c(CN(CCCn2c3ccc2)C3c2ccccc2)cccc1,0 D337-1380,Cc1ccc(CN(C(CC2)CS2(=O)=O)C(c2noc(-c(cc3)cc4c3OCCO4)c2)=O)cc1,0 F2580-0555,C=Cc1ccc(CN(C=CN(c(cc2)ccc2Br)C2=O)C2=O)cc1,0 G806-0252,CC(C)(c(cc(cc1)S(NCCN(CC2)CCN2c2ccccc2)(=O)=O)c1N1C)C1=O,0 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F6475-1891,CCOC(c1c(NC(c(cn2)cc(Cl)c2OC2COCC2)=O)n(C)nc1)=O,1 T368-3279,Cc1noc(C)c1S(N(CC1)CC1n1c2ncccc2nc1C)(=O)=O,1 D718-0744,CC(c(cc1)ccc1NC(CC(C(NCC1)=O)N1C(CN1CCN(CCO)CC1)=O)=O)=O,1 Z2187696561,COc(cc1)ccc1-c1cc(C(N(C2)CC2C2CC2)=O)nn1-c1ccccc1,1 F6436-0673,Cc(onc1)c1C(NCC(CC1)CCN1C(Nc(cc1)ccc1F)=O)=O,1 Z910582210,Cc(cc1)nn1-c1cccc(C(NCc(cc2)ccc2-c2ccn[nH]2)=O)c1,1 F3395-0438,FC(c(cc1)cnc1N(CC1)CCN1C1CCN(CC2Oc(cccc3)c3OC2)CC1)(F)F,1 Z3549436220,O=C(c1ccccc1)N[C@@H]1[C@@H]2[C@H]1CN(CCCC1CCOCC1)C2,1 Z1416054397,CC(C)Nc(cc1)ncc1C(N(CCCC1)C1c1nnc2n1CCCC2)=O,1 Z1602209442,C[C@@H](CN(CC1)C(c2noc3c2CCCC3)=O)N1S(C)(=O)=O,0 F6497-0443,O=C(c1cc(Br)cnc1)N1CC(Cc2nc(C3CC3)no2)CCC1,0 SC58-0281,Cc1cnc(C2C(C3)(CN3S(c3c(C)onc3C)(=O)=O)CN(C)C2)o1,1 Z2771446806,O=C(C1(CCC1)C(F)F)N(CC1)CCN1c1c2sccc2ncn1,1 J030-0803,Cc(cc1)cc(NC(c2c3)=O)c1Oc2cc(Oc1cnccc1)c3S(N(C)C)(=O)=O,0 V001-0864,CCN(C(CN1C(C)C(N(CC2)CCC2C(OCC)=O)=O)=C(C(c2c(C(F)(F)F)cccc2)N2)C1=O)C2=O,1 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Z2912854270,CCOc(cc1)cc2c1OCCC2NC(c1cc(C(O)=O)cnc1)=O,0 F6745-8269,CN(C=C(C(N1C)=O)N(CC2)CCC2C(F)(F)F)C1=O,0 L487-0904,CCOc(c1c2)cc(-c(cc3)ccc3Cl)nc1ccc2NC(NC1CCCCC1)=O,0 F6374-1810,COc(cc1)ccc1SCC(CC1)CCN1C(Nc(cccc1)c1Cl)=O,0 V024-2042,CCN(Cc(n1CC2OCCC2)cnc1S(Cc(cccc1)c1F)(=O)=O)C(C1CCCC1)=O,0 D491-8277,CC(CC1)CCN1C(CNC(c1noc(-c2cc(CCCC3)c3cc2)c1)=O)c1ccc(C)o1,1 8016-9946,O=C(C1CCCCC1)Nc(cc1)cc2c1oc1c2CCCC1,1 Z2975220217,Cc1cnc(N(C)CC(c2cnccc2)O)nc1,0 Z1023504216,Cc1ccc(CN(CC(C2)C(N(CCC3)CC3c3nc(-c4cccc(F)c4)no3)=O)C2=O)cc1,1 M652-0063,O=C(CN(c1c(-n2c3nnc2)nccc1)C3=O)NC1CCCCC1,0 F2496-2010,Cc1cc(COC(c(cc2)ccc2S(N(C)C)(=O)=O)=O)no1,1 Z3628517690,CC(C(CC1)c(cc2)cc(F)c2OC)N1C(C1C2(CC2)CCC1)=O,1 F6808-5947,Cn(cc1)c2c1c(N(CC1)CCC1(c1ccccc1)C#N)ncn2,1 F784-0250,CC(C(Nc(cc1)cc2c1n(C)c(CCc1ccccc1)n2)=O)N1c(cccc2)c2OCC1=O,0 C686-1304,COc(cc1)cc(OC)c1NC(c(oc1c2cccc1)c2NC(C1CCCC1)=O)=O,1 F3139-0962,O=C(COc(cc1)cc(OC=C2c(cc3)ccc3Cl)c1C2=O)c(cc1)ccc1F,1 Z3603359781,O=C(C1CC1)NCc1c[nH]nc1-c1ccccc1,0 T629-1509,CCc1nnc(C(CCC2)CN2C(C2CCCCC2)=O)[nH]1,1 F6353-3414,CN(C)C(CNC(C(Nc1cccc(C(F)(F)F)c1)=O)=O)c(cc1)cc2c1OCC2,0 S932-4405,O=C(c1nccnc1)N(CC1)CC1n1nnc(COc2nccnc2)c1,1 Z1123356266,CCS(N(CCC1)CC1C(NS(C)(=O)=O)=O)(=O)=O,0 F3098-5733,Cc1c(-c2ccc(C)cc2)nc(NC(COC)=O)s1,0 D011-0635,O=C(CC(C1)c2nc(cccc3)c3n2CCCOc(cccc2)c2Cl)N1c(cc1)ccc1F,0 Z2615135230,O=C(Nc1ccncc1)N(CCC1)CC1C1OCCCC1,1 F3412-0024,COc1ccc(C(C2)N=C3SCCN3C2=O)cc1,1 F2072-0312,O=C(NCc1nnnn1C1CCCCC1)NCc(cc1)ccc1Cl,1 Z951346840,CN(CC1)CCC1Nc1c(c(CCCC2)c2s2)c2nc(-c2nccnc2)n1,1 F6523-3458,O=C(C1c(cccc2)c2Oc2c1cccc2)NCCN(C=Nc1c2scc1)C2=O,1 Z2187939962,OCC(Cc1ccccc1)(CCC1)CN1C(C1CCCC1)=O,1 F6808-2812,Cc1cccc(N2CCN(CC(CN3)OCC3=O)CC2)c1C,0 Z2274489803,O=C(CC1)NCCC1N(CC1)CCN1c1c2sccc2ncn1,1 Z2222102121,C(C1)C1[C@@H](C1)[C@H]1c1nc(-c2cscn2)no1,1 Z2332791660,CC(C)C(C(N(C1)CC1c1cccc(Cl)c1)=O)OC,1 Z1884238586,CCS(C(CC1)CCN1C(NCc(cc(cc1)Cl)c1OC)=O)(=O)=O,0 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F6089-9028,O=C(C(NCC(F)(F)F)=O)NCC(CC1)CCN1C(Nc(cc1)ccc1F)=O,0 C700-1750,CC(C)CNC(N(CCc1c2[nH]c3c1cccc3)C2c(cc1)ccc1F)=O,0 L322-0240,CC(C)S(c(cc(c(N1C)c2)N(C)C1=O)c2NC(c1c(C(F)(F)F)cccc1)=O)(=O)=O,1 CM4579-4729,COc(cc1)ncc1C(N(C1)[C@H](COc2cc(CCC3)c3cc2)CC1(F)F)=O,1 Z3396769564,Cc1cc(SCc2cnccc2)nc(-c2ncccc2)n1,1 S988-1299,Cc1noc([C@@](CN(C2)C3CCOCC3)(C3)[C@@H]2CN3C(Nc(cc(cc2)F)c2F)=O)n1,0 Z1431771982,CCC(N=C(c1cccc(NC(NCc(cc2)ncc2F)=O)c1)N1)=CC1=O,1 Z4510295694,CN(CC1)CCN1C(C(Cc1ccccc1)NC(C(C=C1)=CN(c2cccc(F)c2)C1=O)=O)=O,1 G939-0939,CC(CN(CC1)S(c(ccc(-c2ccno2)c2)c2OC)(=O)=O)N1c1cc(C)ccc1,1 Z3409663010,CCOC(c(cn1)c(N(C)CCCOC)nc1SC)=O,0 Z2910205616,Cn(cc1)cc1C(N(CCC(O)=O)Cc(cc1)cc(F)c1F)=O,0 L888-0368,CCn1c(SCC)nnc1-c1nn(C)c(CC2)c1CN2S(c(cc1)cc2c1OCCO2)(=O)=O,1 SB75-1493,Cc1noc([C@]2(C[C@@H](C3)NS(c4cccs4)(=O)=O)[C@@H]3CN(Cc3ccccc3)C2)n1,1 F5115-0180,c([nH]c1c2cccc1)c2-c1nnc(-c2ccccc2)o1,1 F2880-0893,CN(C)C(CNC(Cc(cc1)ccc1-c1ccccc1)=O)c(cc1)ccc1F,1 F2392-1740,O=C(NCC(c1cscc1)N1CCCCCC1)NCc1cccs1,1 F6497-0842,O=S(C1CC1)(N1CC(Cc2nc(C3CC3)no2)CCC1)=O,1 F6680-2886,Cc1c(CN(CCN2c3cc(C(F)(F)F)ncc3)CC2=O)sc(C)n1,0 Z1764265985,CC(C(N1)=O)(c2cccc(NC(C3(CC3)c3cc(C(F)(F)F)cc(F)c3)=O)c2)NC1=O,0 S947-0008,CC1(CC1)C(N1C[C@](CO)(CN(C2)c(cc3)cc(C(F)(F)F)c3C#N)[C@H]2CC1)=O,0 E958-0833,Brc1cc(CNCc2cccn2-c2nnc(N(CC3)CCN3c3ccccc3)s2)ccc1,1 F5033-7479,COc(cccc1)c1NC(N1CCC(CNC(c2nc(cccc3)c3s2)=O)CC1)=O,1 Z1348949214,O=C(CCc(cc1)ccc1F)N(CC1)CCC1OCC1OCCCC1,1 Z1995563026,CCCOc(cc1)ccc1OCC(N1C2(COCC2)COCC1)=O,0 F6713-6189,Cc1nc(CN(CC2)CCN2c(cc2)nnc2-c2ccco2)co1,1 F6435-5720,CSC(CC1)CN1C(Nc(cc1)ccc1F)=O,0 J099-1053,O=C(C1=CN(CCc2ccc3)c2c3C1=O)NCCCN1CCOCC1,1 F2518-1672,O=C(c(c(F)ccc1)c1F)Nc1nnc(-c(ccc(Cl)c2)c2Cl)o1,0 F897-0090,Cc(n(Cc1ccccc1)nc1C)c1S(N(CC1)CCN1C(C1(CC1)c1ccccc1)=O)(=O)=O,1 F5075-2762,O=C(NCCOc1nn2c(-c3ccccc3)nnc2cc1)Nc1cccc(C(F)(F)F)c1,1 F6560-8177,Cn1ncc(-c2ncc(CNC(c3cccc(OC(F)(F)F)c3)=O)cc2)c1,1 F6442-1039,COc(cc1)ccc1S(C(C1)CN1S(c1c(C(F)(F)F)cccc1)(=O)=O)(=O)=O,0 V022-1655,O=C(c1cccs1)N(CCC1)C1c1nc(cc(cc2)-c3ccccc3)c2o1,0 F6773-4856,Cc1cnc(C)c(OC2CCN(Cc3noc(C4CC4)c3)CC2)n1,1 F6539-4024,O=C(C(Nc(cc1)ccc1OC(F)(F)F)=O)NCCCc1cc(cccc2)c2o1,0 C593-1082,Cc(cc1)cc(-c2c3cc(C(N4CCN(C)CC4)=O)s2)c1OC3=O,1 Z773649282,Cn1c(-c2cccc(NC(COc(cc3)ccc3OC)=O)c2)ncc1,0 F6472-0789,O=C(CN1N=CC=CC1=O)NCCSC1CCOCC1,1 SA87-0550,COCCN(CC(CNC(c1cc2cccnc2cc1)=O)OC1)C1=O,1 G421-0632,COc(cc1)cc(CN(CC2)Cc3c2nc(N2CCOCC2)nc3)c1OC,0 Z982932450,O=C(CCc1cccc(F)c1F)Nc1cn(CC2OCCC2)nc1,1 L859-0280,Cc1ccc(C(C(c2nc(-c(cc3)ccc3Cl)no2)=CN2Cc3cccc(Br)c3)=O)c2n1,0 Z850974302,Cc1n[nH]cc1CNc1c(cc(-c2ccccc2)s2)c2ncn1,1 F3375-1094,O=C(C(c1ccccc1)N1CCOCC1)Nc1nccs1,1 F6559-1337,Cc1nc(cccc2)c2n1C(CC1)CN1C(c1noc(-c2cccs2)c1)=O,1 SD31-0047,O=C(C1CCOCC1)NCCn1nc(C(N2CCCC2)=O)c2c1CCOC2,1 Z2186496359,N#CCCCC(N(CC1)CCC1c1c[nH]cn1)=O,0 Z2905592876,CN(C1CC1)c1nnnn1Cc1cccc(OC)c1OC,0 F6252-1647,O=C(c1c(-c2ccncc2)n(Cc(cccc2)c2F)nn1)NCCc1c[nH]c2c1cccc2,1 F6808-5273,CC(C)NC(C(C)N(CC1)CCN1c1nc(cccc2)c2n1C)=O,0 L694-0358,CC(C)N(c(ccc(S(N(CC1)CCN1C(Cc(cc1)ccc1F)=O)(=O)=O)c1)c1O1)C1=O,0 F870-0981,O=C(c(cc1)ccc1Nc1ccnc(-c2cccc(F)c2)n1)Nc(cc1)ccc1F,0 Z1632780790,NS(NCC(CCC1)CN1C(c(ccc(O)c1)c1O)=O)(=O)=O,0 Z1531861258,CC(C)(CC1)CCC1(C(N)=O)NC(C(C=C1)=NN(c2ccccc2)C1=O)=O,1 Z2348450673,CC[C@H]1OCC[C@@H]1NC(N(CC1)CC1C(N(C)C)=O)=O,1 S543-0525,CC(C)NC(N(C1CC1)C1CC(CC2)(CCN2C(c2ccnn2C)=O)OCC1)=O,0 Z728856442,CCN(CCC(O)=O)C(c1cc(C)c(C)s1)=O,0 F1190-0119,CC(C)C(Oc1c2ccc(O)c1C)=C(c1nc(cccc3)c3s1)C2=O,1 F5033-7734,COC(c(cc1)ccc1C(NCC(CC1)CCN1C(Nc(cc1)ccc1F)=O)=O)=O,0 F3374-0233,CCc(cccc1)c1NS(c1ccc(CN(C(c2c3cccc2)=O)C3=O)cc1)(=O)=O,1 F5591-1183,COC(N(CC1)CCN1c(cc1)ncc1-c1noc(C(F)(F)F)n1)=O,1 Z1869511798,OC([C@@H](CCC1)CN1C(c1cc(scc2)c2nc1)=O)=O,1 F6190-2061,CN(C)c(cc1)ccc1C(NCCC(c1cccc2ccccc12)O)=O,0 C255-0632,CC(CCC1=O)(C(NC2CCCC2)=O)N1c1c(C)cc(C)cc1,0 L540-6837,O=C(c(cn[nH]1)c1S(Nc(cc1)ccc1Cl)(=O)=O)Nc(cc1)cc2c1OCCO2,0 F6443-5192,COc(nccc1)c1C(N(CCC1)CC1(c1c2cccc1)OC2=O)=O,1 F3083-0114,CC(Nc(cc1)ccc1OCC(Cn1nc(C)c(Br)c1C)O)=O,0 F6482-6501,O=C(c(cc1)cc2c1[nH]cn2)NCc(cc1)cnc1-c1ccco1,1 Z2482896243,CC(C)N(Cc1ccc(C(O)=O)o1)CC(N1)=Nc(cccc2)c2C1=O,0 S724-0665,O=C(C1COCC1)N(C1)CC1n1nnc(C(N2CCOCC2)=O)c1,1 F5327-0577,O=C(c1ccco1)NCC1(CCOCC1)c(cc1)ccc1F,0 Z1160844461,Cc1c(CN(C)Cc(cc2)ccc2C(O)=O)scn1,0 Z3173323466,CC(CC(CC1C)C(O)=O)N1C(c1nn(C)nc1)=O,0 Z139630404,Cc1cc(CNCc(cccc2)c2F)no1,0 Z1419427419,CC(Cn1ncnc1)NC(c(cc1)cc2c1scc2)=O,1 F3230-0279,CC(CNC(c1cccc(Br)c1)=O)n1nc(C)cc1C,0 Z1012945934,Cc(cc1)cnc1NCCCNC(N(CC1)CCC1c1nc(cc(cc2)Cl)c2o1)=O,1 V026-3687,Cc1nc(N(CC2)CCN2C(C2CCCC2)=O)c(cnn2-c(cc3)ccc3F)c2n1,1 Z4788774691,OC(CNC(Nc1c2cn[nH]1)=NC2=O)c1cccc2ccccc12,1 F6451-0072,COC(CNC(CSC1CCCC1)=O)c(cccc1)c1OC,0 F1757-0356,O=C(CN1CCOCC1)Nc(cc1)ccc1Br,0 SC04-0687,O=C(c1cscn1)N(CCC1)CC1OCCc1noc(C2CC2)n1,1 Z1738501034,OC(Cc1csc(CCNS(c(cc2)cc3c2OCO3)(=O)=O)n1)=O,0 C121-0532,Cc1c(Cc(cccc2)c2Cl)c(C)nc2nc(SCC(N3CCCC3)=O)nn12,1 F6436-2172,CC(CNC(CCc(cccc1)c1F)=O)(c(cc1)ccc1-c1ccccc1)O,1 F2768-0097,CN(C1CCCC1)S(c(cc1)ccc1C(Nc(cc1)cc2c1scc2)=O)(=O)=O,1 SA52-0609,CCC(N(CCCN(C1)C(c2cc(Br)cnc2)=O)C1c1nc(C)no1)=O,1 T636-1798,O=C(c1cocc1)N(CC1)CCN1c1ncnc2c1CCC2,1 F6480-0757,O=C(CC(c1ccccc1)c1ccccc1)N(CCC1)CC1Oc1ccncc1,1 F6573-6290,O=C(C1CC=CCC1)N(CC1)CCC1(C1)C1(F)F,1 S823-2571,OC[C@@H](CN(C1)c2ncccn2)[C@H]1NC(c(cccc1)c1F)=O,0 8017-9308,O=C(Cc1ccccc1)Nc1nonc1N(C(C1C2CCCC1)=O)C2=O,1 SD60-0254,O=C(CCc1nc(cccc2)c2[nH]1)N(C1)CC11OCC(CCOCc2cccc(F)c2)C1,1 F6677-1398,CCc1nccn1CC(C1)CN1C(c(cc1)ccc1N1CCOCC1)=O,1 Z1183913866,OCC(c(cc1)ccc1Cl)N(CC1)CCN1c1nccnc1,0 M179-4779,COc(cc1)ccc1N(CC1)CCN1c1cc(SCC(Nc(cc(cc2)OC)c2OC)=O)ncn1,0 SA58-0664,Cc1nc(S(N2C(CCc3noc(-c4ccncc4)n3)CCC2)(=O)=O)cn1C,1 SC66-0355,O=S(Cc1ccccc1)(N(C1)CC2(CCOCC2)C1c1nncn1C1CC1)=O,1 SC77-0861,CC(C)S(N(C[C@H]1C(NCCN2CCN(C)CC2)=O)C[C@@]11OCCNC1=O)(=O)=O,1 Z807359676,CCCN1CC(CNC(N(CCC2)CCN2c2ccccc2)=O)CC1,1 P666-1111,CC(CCCC1)N1S(c(cc12)cn1C(C)=NNC2=O)(=O)=O,1 L678-0135,CC(Cc1c2cccc1)(C(NCc(cc1)ccc1OC)=O)N(Cc1ccc(C(F)(F)F)cc1)C2=O,0 Z3341694692,CC(C)n1nc(CS(c2cnccc2)(=O)=O)cc1,0 Z271-0341,CCN(CC)C(c1c(cc(C(CC2)CCN2S(c(cc2)cc(C)c2F)(=O)=O)cc2)n2nc1)=O,1 F6609-3237,CCc(cc1)ccc1NC(COC(c1c(C)ccc(C)c1)=O)=O,0 F0916-6763,O=C(c1ccc(CN2N=Nc(cccc3)c3C2=O)cc1)NCCCN1CCOCC1,1 S428-1043,CN(CC(N1CCC(Cc2nc(C3CCOCC3)no2)CC1)=O)S(c1cccs1)(=O)=O,1 Z2165588581,CC(CN(CC(C)(C)O)CC1)N1C(c1c(C2CC2)nco1)=O,1 L998-1727,CC(C)C(Nc1cccc(N(CC(C2)C(NC(C)c3c(C)cc(C)cc3)=O)C2=O)c1)=O,0 F6792-4093,Cc1nc(C2CC2)nc(N(CC2)CCN2c2ccnc3ccccc23)c1F,1 F6482-3885,O=C(c1c[nH]c2c1cccc2)N(CC1)CCC1n1nccn1,1 F6518-2126,CC(c1ccc(CCNC(c(c(F)ccc2)c2F)=O)s1)=O,0 C325-0106,Cc(cc1)ccc1-c1c(Nc(cc2)cc3c2OCCO3)n(cccn2)c2n1,0 F3406-3571,COc(cc1)cc2c1[nH]c1c2ncnc1SCC(Nc1c(C(F)(F)F)cccc1)=O,0 F5882-1800,Cc1noc(-c(cc2)ccc2NC(Cc(cc2)cc(OC)c2OC)=O)n1,1 Z3672079642,Cc(c(Cl)nc(Cl)c1)c1C(NC1c2cc(C(OC)=O)nn2CCC1)=O,1 F6518-4696,Cn1nccc1-c1ccc(CCNC(CN(c(cccc2)c2O2)C2=O)=O)cc1,1 F6774-4254,COc(cn1)cnc1OC1CN(Cc2csc(C3CCCC3)n2)CC1,1 S828-3593,Cc1nnc([C@H](CC(C2)(F)F)N2C(c(ccc(Cl)c2)c2OC)=O)o1,0 8012-7859,O=C1N(c2ccccc2)C(SCc2nc(cccc3)c3[nH]2)=Nc2c1c(CCC1)c1s2,1 Z2763041871,CC(C)C[C@H](C(O)=O)NS(c1cscc1Br)(=O)=O,0 F1300-0305,Cc(cc1)c(C)c2c1sc(NC(c(cc(s1)Cl)c1Cl)=O)n2,0 V027-5785,CC(CN(CC1)c2cc(Oc(cc3)cc(Cl)c3F)ncn2)N1C(C1CCCCC1)=O,1 Y031-6258,CCCCNC(c(cccc1)c1S(CCOC)(=O)=O)=O,0 Z1891235830,CC(C)c1noc2nc(C)cc(-c3nc(-c4cnc5n4ccnc5)no3)c12,0 Y031-3020,Cc(cc1)ccc1N(CC(C1)C(N(CC2)CCC2C(N)=O)=O)C1=O,0 F6608-1692,CN(C)C(CC1)CCC1Oc(nccc1)c1Cl,0 SC96-1476,O=C(CC1)N(CC2CC2)C2(COCC2)CN1S(Cc(cc1)ccc1F)(=O)=O,0 Z729427208,O=C(C(CCC1)N1C(C1(CC(C2)C3)CC3CC2C1)=O)Nc(cc1)cc(F)c1-n1cncc1,1 Z3406060609,CCc1nnc(NC(c2nn(CC)c(C)c2)=O)s1,1 Z1676218696,Cc1c(C)nc(cc(cc2)C(N3CC4(CCC4)COCC3)=O)c2n1,1 Z2143223113,COc(cc1)cc(Cl)c1S(Nc1cc(C(O)=O)ccc1)(=O)=O,0 F6752-4557,O=C(C1OCCN(Cc(cccc2)c2Br)C1)N1CCSCC1,0 Z3409795409,OC(CC(c(cc1)ccc1F)NS(C1(CC1)C(F)F)(=O)=O)=O,0 F6524-2649,O=C(c1noc(-c2ccccc2)c1)N(CC1)CC1c1noc(C(F)(F)F)n1,1 L299-1611,Cc(c(-c(cc1)cc(S(NC2CCCCCC2)(=O)=O)c1OC)c1NC(CC2)=O)nn1C2=O,0 E852-3430,CCN(C(C)(Cn(c1c2)nc2C(NCCCN2CCOCC2)=O)C(NC2CCCC2)=O)C1=O,0 F6672-1667,CC=C(CC1CC2)CC2N1C(CN(C=NC(C1CC1)=C1)C1=O)=O,1 G336-0305,CCC(Nc(cc1)ccc1S(N(CC1)CCN1c1nc(cccn2)c2s1)(=O)=O)=O,0 F6036-1785,O=C(c1cscc1)N(C1)CC1c1nc(Cc2ccccc2)no1,1 F6804-8577,Cc1csc(NC(CN(CC2)CCC2C(F)(F)F)=O)n1,0 F6519-5741,O=C(c1cc(cccc2)c2[nH]1)NCC(c1ccco1)n1nccc1,1 P899-0264,Cc(oc(-c([nH]nc1)c1C(N1CCOCC1)=O)c1)c1S(NC1CC1)(=O)=O,1 Z3641526823,C[C@](CC1)([C@@H]1CC1)N1C(CCNC(c1ncccc1O)=O)=O,1 F6496-1409,O=C(c1nn(-c2ccccc2)nc1)NCc1ncnc(C2CC2)c1,1 Z335502118,NC(c1cc(NC2CCCC2)ccc1)=O,0 F6440-4207,Cn1nc(CNS(CCOc2ccccc2)(=O)=O)cc1C1CC1,1 F6724-1322,CC(Cc(cc1)ccc1OC)(CNc(nc1)ncc1Br)O,0 Z2847939356,Cc1nccc(C(NC2CC(CC(O)=O)C2)=O)c1,0 F5614-0079,Cc1cc(C(N2CCN(Cc3nc(cccc4)c4[nH]3)CC2)=O)c(C)o1,1 F6222-0754,O=C(Nc1cnc(N(CC2)CCN2c2ccccc2)nc1)Nc(cccc1)c1Cl,0 SB49-1052,Cn1cnc(C(N(CCCC23CCOCC3)C2C(N)=O)=O)c1,1 F5831-2342,CC(Cc1cccs1)NC(c(c(F)ccc1)c1Cl)=O,0 Z2936895235,Cc1cc(C(NC(C2CC2)c2nocn2)=O)cc(C)c1,0 F6221-0355,CCOc(cccc1)c1NC(Nc1cnc(-n2c(C)ncc2)nc1)=O,0 F6783-7231,Cc1nc(CCC2)c2c(N2CC(CN(C3)C(Cc(cccc4)c4OC)=O)C3C2)n1,1 F6495-4276,O=C(C(C1)CN1c1ncnc(-n2cncc2)c1)NCc1ccco1,1 Z1603640695,CN(C=C(C=C1)C(NC(CC(O)=O)c(ccc(F)c2)c2F)=O)C1=O,0 F6258-0908,CCC(N=CN1CCNC(Nc2cccc(Cl)c2C)=O)=CC1=O,0 F6760-2361,O=C(c1nnc(CCCC2)c2c1)N(CC1)CCN1c1ncccn1,1 Z1536000997,FC(COc1cc(CN(CCOC2)C2C2CC2)ccc1)(F)F,0 C764-0511,Cc1ccc(CN(C2=O)C(SCC(Nc3c(C)ccc(C)c3)=O)=Nc3c2oc2c3cccc2)cc1,0 F6543-8788,Cc1nc(C(F)(F)F)cc(N2CCSCC2)n1,1 J025-1396,O=C(CC1c(cc(cc2)Br)c2F)Nc2c1scc2-c(cc1)ccc1F,0 T634-0545,O=C(C1COCC1)N1Cc(cc(CN2CCCCCC2)cc2)c2OCC1,1 Y042-3687,COCc1nnc(NC(c(cc2)cc(C(N3C4CC4)=O)c2C3=O)=O)s1,1 F2572-0142,COc(ccc(F)c1)c1S(NCC(c(cc1)cc2c1OCO2)N1CCOCC1)(=O)=O,1 F6708-8396,CC(C)c1nc(S(N2CC(C3)(CC3c3ccccc3)C2)(=O)=O)cn1C,1 S924-0136,O=C(NCc1ccccc1)N(CC1)CCC1(CC1)N(Cc(cc2)ccc2F)C1=O,1 Z1903022935,Clc1cc(CN(CC2)CCC2Oc2nccnc2)ccc1,0 F3406-0005,CCOC(c(cc1)ccc1N1C(N2CCCC2)=Nc(cccc2)c2C1=O)=O,1 F829-0005,COc(cc1)ccc1-c1noc(CN(C=Cn(c2c3)nc3-c3ccccc3)C2=O)n1,0 S968-0534,CS(NC(C1)C1(CC1)CCN1C(c1nc2ccccc2cc1)=O)(=O)=O,1 F6556-3263,CS(N(CCN1C(NCC(CC2)CCN2C2COCC2)=O)C1=O)(=O)=O,0 G373-2845,COc(cc1OC)cc(Cl)c1NC(NCCn1nnc2c1ccc(S(N1CCCC1)(=O)=O)c2)=O,0 Z2390669323,NC(CC1)CC1C(Nc(cc1)ccc1Oc1cccc(C(N)=O)c1)=O,1 F6125-2823,CS(N(C1)CC1C(N(CC1)CCN1c1ncccc1)=O)(=O)=O,0 P657-0763,O=S(c1ccc(-c2nnc(C3CCC3)o2)o1)(N(CC1)CCN1C1CCCCC1)=O,1 Z368586132,CCc1cc2c(NC(C)c3c(C)n(C)nc3)ncnc2s1,0 V016-4686,CC(CC1)Cc2c1c(C(NC(CN(CCOC)CC(COCc1ccccc1)O)=N1)=O)c1s2,0 Z4278050006,CC1(C)OC(CCC2)(CN2S(c2csc(C(F)F)n2)(=O)=O)NC1=O,0 L596-0182,CN(c(ccc(S(Nc(ccc(F)c1)c1Cl)(=O)=O)c1)c1C(N1CC(N2CCCC2)=O)=O)C1=O,0 Z370702152,COc(cc1)cc(C2)c1OCC2C(NCc1c(-n2cncc2)nccc1)=O,0 F5857-1955,CSc(nccc1)c1C(NCC(C1CC1)(c1cccs1)O)=O,0 Z4873983046,OC(CNCc(cc1)cc2c1OCO2)=O,0 Z2329137886,Nc1nccc(CN2C3(CCC3)COCC2)c1,1 SB57-1022,Cc1ccc(CN(C2)CC2(CN(Cc2ccccc2)C2)C2c2nc(C)no2)s1,1 F5111-0070,O=C(CN(C(CCC1)=C1C(N1C2CCCCC2)=O)C1=O)N(CC1)c2c1cccc2,1 G747-0333,CC(CC1)CCN1C(c(cc1)ccc1SC)C(C(N(CCOC)C(C)=C1)=O)=C1O,0 F6564-2385,COc(cc1)cc(C(NCCN2N=C(C3CC3)C=CC2=O)=O)c1Br,0 F6791-6538,Cc(ccc(Cl)c1)c1N(CC1)CCN1c1ncnc(-n2nccc2)c1,0 G267-0863,CC(CC1)CCN1C(CCc1c(C)n(-c(cc2)nnc2N2CCCCC2)nc1C)=O,1 S034-2137,O=C(c1cccs1)N[C@@H](C[C@@H]1C2)[C@@H]2CN1S(c1cc(CCC2)c2cc1)(=O)=O,1 V020-7934,CCN(C)c1c(CN(CC2)C(c3ccco3)=O)c2nc(N(CC2)CCN2c2ccccc2)n1,1 F5854-2558,CC(C)C(Nc(cc1)ccc1S(N(Cc1cscc1)Cc1ccco1)(=O)=O)=O,0 Z1593024916,CCn1c(ncnc2N(Cc3ccco3)Cc(cccc3)c3O)c2nc1,1 Z980028970,CC(Nc1cccc(CNC(C(CCC2)CN2C(C2CC2)=O)=O)c1)=O,0 K786-3565,CC(C)CCN(C)C(CC1)CCN1C(Nc1cc(OC)ccc1)=O,0 SA73-0527,Cc1cc(C(N(CC2)CCC2(CC2CC2)c2noc(C3CCOCC3)n2)=O)no1,1 SB59-0441,CC(C)C(N(C1)CC2(CN(Cc3c[nH]nc3-c3ccccc3)C2)C1c1nncn1C)=O,1 F2040-0268,O=C(COc(cccc1)c1F)Nc(cc1)cc(CCC2)c1N2C(c1cccs1)=O,1 SD15-0415,CN(CC(N(C)[C@@H](C1)[C@H]2CCN1C(c1c[nH]c3c1cccc3)=O)=O)C2=O,1 SA52-0562,CCC(N(CCCN(C1)C(c2ccc(C)s2)=O)C1c1nc(C)no1)=O,0 Z2028178439,NC(C(CC1)(CCN1C(CCc(cc1)cc2c1OCCO2)=O)O)=O,0 F6725-0330,OC(CC1)CN1C(CC1)CCN1c1ncnc2cnccc12,1 S808-0324,CN(C)C([C@@](CC1)(CN(Cc2cc(F)cc(F)c2)CC2)[C@@H]2N(C)S1(=O)=O)=O,0 Z1223176399,Cc(ccc(NC(CCCN1c(cccc2)c2OC)C1=O)c1)c1C(N)=O,0 F0394-0010,Brc(cc1)cc2c1n1nnnc1nc2-c1ccccc1,1 F6811-1750,CCc1ncnc(N(CC2)CCN2C(C=C2)=NN(Cc3ccccc3)C2=O)c1F,0 Z4068622735,Cc1nonc1CC(N(C[C@@H]1C(O)=O)C[C@@H]1c1ccccc1)=O,1 Z1893360761,O=C(Cc(cccc1)c1Cl)N(CC1)CCC1Oc1ncccc1F,0 Z2928853458,CC(NC(CC1)CCC1NCCC1OCCc2c1cccc2)=O,1 8019-7952,Cc1c(C(Nc(cc2)ccc2Cl)=O)sc(NC(C2)=O)c1C2c1cc(C(F)(F)F)ccc1,0 SB47-0608,Cc1c(CN(C[C@H]2CN(C3)C(c4ccccc4)=O)C[C@]23c2nc(C)n[nH]2)scn1,1 F6253-3599,CSc1ccc(CNC(C(CC2)CCN2S(N2CCCC2)(=O)=O)=O)cc1,0 Z1217506022,CC(C)(c1nc(C)cs1)NC(c1cocn1)=O,1 F6529-0888,Cc1c(C(N(CC2)CCC2N2N=C(C(F)(F)F)N(C)C2=O)=O)sc(C)n1,1 F1648-0038,CCOc(cc(cc1)S(NCc2cnccc2)(=O)=O)c1Cl,0 Z3828799649,Cn1c(N(CC2)CCC2C(c(cc2)ccc2Cl)O)nc2c1cncc2,1 Z2080465154,OCC(C(OCC(NC(N1)=O)=CC1=O)=O)c(cc1)ccc1Cl,0 D754-0118,COCCn(cc1)c(cc2)c1cc2C(NC[C@@H](CN(Cc1c2cccc1)C2=O)c1ccccc1)=O,1 SA01-0839,CN(C)C(c1c(C(CC2)CN2C(CCCc2ccccc2)=O)nc(N(C)C)nc1)=O,1 F2373-0923,COc(cc1)ccc1N(CC(CNC(C1CC1)=O)O1)C1=O,1 F6730-1259,CCc1cc(C(Nc(cc2)cc(OC)c2OC)=O)ncn1,0 V025-0855,CCC(C)N(Cc(cc(cc1)NC(C2CCC2)=O)c1N(C)C)C(C1CC1)=O,1 F6356-0277,Cc(cc1)cc(S(NCCc2cocc2)(=O)=O)c1OC,0 SC09-0095,CC(C)n1ncc(CN(C2)[C@@H](C)COc(cc3)c2cc3-c2cccc(F)c2)c1,0 L104-0711,Cn(cc1-c2ccccc2)c(C(N2CCOC)=O)c1N=C2SCC(N(CCC1)c2c1cccc2)=O,1 Z194107458,Cc1cc(C(COC(c2cc(Cl)c[nH]2)=O)=O)c(C)n1C(C1=O)=C(C)N(C)N1c1ccccc1,0 Z1562824976,CNC(C1CCN(Cc2cc3cccnc3cc2)CC1)=O,1 Z1715261183,CN(C)C(CCC1)CN1C(c1coc(C2CCOCC2)n1)=O,1 SB46-0244,O=C([C@H](C[C@H]1CN(C2)C(C3CCOCC3)=O)C[C@@H]1NC2=O)N(CC1)Cc2c1cccc2,1 Z1268312364,CCC(c1nc(C)n[nH]1)NC(C1c(cccc2)c2OCC1)=O,1 Z1768322608,CC(CN(CC1)C(c2ccccc2)=O)N1c1nc(cccc2)c2o1,0 Z2186210298,CCc1nc(CN(CC2)CCN2C(C(C)(C2CC2)OC)=O)no1,1 F2449-0093,COc1cc2ccccc2cc1C(Nc1ncnc2c1CCC2)=O,1 F6525-2137,Cn(c(CNC(C1=CC=CN(C)C1=O)=O)c1)nc1-c1nccnc1,1 Z1999575406,CN(C(CCC1)c2c1cccc2)C(COc1cscc1)=O,1 Z1297506057,Cc1cc(CC(N(CCOC2)C2c2ccccc2)=O)no1,0 Z1169918793,CC(c1nc(-c2cscc2)no1)OCC1OCCCC1,1 Z1613255417,O=C(NCc1cc(F)cc(F)c1)Nc(cc1)cc2c1nc(-c1ncccc1)o2,1 F0579-0576,COC(c1ccc(CSC(N(c(cc2)ccc2F)C2=O)=NC3=C2SCC3)o1)=O,1 S629-2541,O=C(CCc(cc1)cc(C2)c1OCCN2S(c(cc1)cc2c1OCCO2)(=O)=O)N1CCCC1,1 Y503-3474,Cc1cc(CNC(C(CCC2)CN2S(c2c(C)n(C)nc2)(=O)=O)=O)nn1C,0 Z3052467673,CS(C1(CC1)C(NC[C@H](CCC1)[C@@H]1O)=O)(=O)=O,1 F3375-2648,Cc1c(C(NCc2ccc(-c3ccccc3)o2)=O)nnn1-c1ccccc1,1 M563-0629,CCCC(Nc1cc(CN(C(C2)C(N(C)C)=O)C(c(cc3)ccc3C#N)=O)c2cc1)=O,0 S740-0113,O=C(Cc1c[nH]c2c1cccc2)N[C@@H](C1)CN(CCS(N2C3CC3)(=O)=O)[C@@H]1C2=O,1 S682-0302,CNC([C@H]1OCCN(C2CC2)[C@@H]1c1ccccc1)=O,0 S515-0195,CC(CCCC1)(C(NCCOc(cccc2)c2OC)=O)NC1=O,1 Y041-9025,CC(C)(C(C1)C(Nc2nc(C)c(C)s2)=O)OC1=O,1 F6554-1987,CC(Nc1cccc(C(N2C(C3)COC3C2)=O)c1)=O,0 T368-3482,Cc1noc(C)c1S(N(CC1)CC1n1c2ncccc2nc1-c1cscc1)(=O)=O,1 Z2178036047,Cn1c(CNC(C(C2)=NNC2=O)=O)cnc1,1 P937-0900,O=C(Cc1c[nH]c2c1cccc2)N1CC(Cc2nnc(C3CC3)[nH]2)CC1,1 F1501-0014,CCOc(cc1)ccc1N(CC(C1)c2nc(cccc3)c3n2CC(C)=C)C1=O,0 S997-1854,OC[C@](CN(Cc1ccccc1)C1)(CC2)[C@H]1CN2S(c1ccccc1)(=O)=O,0 Z3018893706,O=C(c1cccc(N2)c1NC2=O)N(CCC1)CC1N1CCNCC1,1 Z1272387213,Cc1noc(-c(cc2)cnc2N(CC2)CCN2C(CO)c(cc2)ccc2Cl)n1,1 Z2951276293,CC(C(NCC(NC1CCCC1)=O)=O)(c(cc1)ccc1F)O,1 F5755-0205,CCOc(cc1)ccc1NC(N1CCC(Cn2c(cc(C)c(C)c3)c3nc2)CC1)=O,0 F6564-3401,N#CC1(CCCCC1)NC(CN1N=C(C2CC2)C=CC1=O)=O,1 SC03-0461,O=C(c1n[nH]c(C2CC2)c1)N(CC1)CCC1OCCc1noc(C2CCOCC2)n1,1 F6287-0538,Cn1c(CCNC(C(CC2=O)CN2c2ccccc2)=O)nc(-c2cccs2)c1,1 S639-8419,Cc(occ1)c1C(N[C@@H](C1)[C@@H](CN(C)C)CN1c1ncncc1)=O,1 Z2067850962,CCc(cc1)ccc1NC(C(C)S(c1nnc(C)[nH]1)(=O)=O)=O,0 F6608-3723,C(C#CCOC(CC1)CCN1c(cc1)nn2c1ncc2)N(CC1)CCN1c1ccccc1,1 Z786116804,C=CCN(C(CC1)CS1(=O)=O)C(c1cscc1)=O,0 F6689-3213,CN(CC(CC1)CCN1C(c1nc2ccccc2nc1)=O)c1nccnc1OC,1 F0336-0211,CC(c1cccc(NC(COc(cc2)ccc2Cl)=O)c1)=O,0 F5498-0263,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CCC1c1nnc(-c2ccco2)s1,1 Z3686251265,CN(C(C1N(Cc(cc2)ccc2C#N)CCC1C1CC1)=NN1)C1=O,1 F6194-0083,CC(Cc1ccco1)(CNC(c1cc(N(C)C)ccc1)=O)O,0 F2537-1555,CC(c1cccc(NC(CSc(cc2)ccc2F)=O)c1)=O,0 F6801-7978,CN(Cc(cc1)cc2c1OCCO2)C(N=CN1C)=CC1=O,1 F6514-2913,O=C(CSC1CCCC1)N(C1)CC1OCC(F)(F)F,0 Z1172042756,Cc1nc(C(NC2CCN(CC(NC)=O)CC2)=O)c[nH]1,0 F6554-0818,Cn1nc(C(CCC2)CN2C(c2cn(C)nc2OC)=O)cc1,0 Y041-5185,c1(sc(c(n1)C)C(NC[C@H]1[C@@]2(N(CCC1)CCCC2)[H])=O)n1cccc1,1 F6442-7140,O=C(CN1N=CC=CC1=O)N(CC1)CCC1N(CC1)CCC1Oc(cccc1)c1F,1 Z2070041649,CC(C)c1cc(C(NCC(CC2)CCN2C(C)=O)=O)c(C)o1,0 Z2316206957,O=C(C(N(CC1)Cc2c1[nH]c(cc1)c2cc1Cl)=O)N1CCCC1,1 SB21-1475,CC(C)NC(c1cn(C[C@H](C[C@@H](C2)F)N2C(Cc2cnccc2)=O)nn1)=O,1 F2725-0852,COc(cc1)ccc1C(CSC(C(CCC1)=C1N1Cc2cnccc2)=NC1=O)=O,1 Y020-8223,CN1CCN(CC(N(CCN2)C(CC(Nc(cc3)ccc3Oc3ccccc3)=O)C2=O)=O)CC1,1 Z3009681180,CC(COCC1)(C2CC2)N1S(c1ccc(C)o1)(=O)=O,1 K603-0221,Oc(ccc(Cl)c1)c1N(C(C1C2CC=CC1)=O)C2=O,0 F6730-2900,O=C(c1ncnc(C2CCOCC2)c1)NCc1ccccc1,1 Z2964064957,CC(C)Oc(ncc(C(NCC1(CC1)C1(CCC1)O)=O)c1)c1Cl,1 Z1488979803,OC(CCN(CC1)CC1NC(Nc(cc1)ccc1F)=O)=O,1 Z1675699027,O=C(C1c(cc(cc2)Cl)c2OCC1)N1Cc2nnc(C3CC3)n2CC1,1 F6571-2499,OCCOC1(CNS(c2ccc(C(F)(F)F)cc2)(=O)=O)CCCC1,0 Z1696238437,Cn1c(C2CC2)nnc1CNc(cc1)ncc1S(N1CCCC1)(=O)=O,1 F6608-1044,CN1CC(COc2nc3ccccc3nc2)CCC1,1 F6186-1362,CC(CCSC)(CNC(C(Nc1cc(F)c(C)cc1)=O)=O)O,0 F6245-6488,O=C(c1cc(cccc2)c2[nH]1)NCCN1N=C(c2ccco2)N(C2CC2)C1=O,1 F5033-3674,COc1cccc(C(NCC(CC2)CCN2C(Oc2ccccc2)=O)=O)c1OC,0 F6104-0001,O=C(c1ccno1)NCC(Cc1cccc(F)c1)N(CCN1)C1=O,1 F6181-0106,OC(CNC(c(ccc(F)c1)c1Cl)=O)(c1cccs1)c1cccs1,1 Z1556302414,C[C@@H](c1ccccc1)NC(N1C(CC(c2cn(C)nc2)O)CCC1)=O,0 F2496-0226,Cc(cc1)ccc1-c1cc(COC(Cc2cccs2)=O)no1,1 F0806-0809,N#Cc(cccc1)c1NC(c(cc1)ccc1C(c1ccccc1)=O)=O,0 Z1991679257,OC(CCN(Cc(cc1)cc(F)c1F)C(c1c(CCC2)c2ccc1)=O)=O,0 Z2483110594,COc(cc1)cc(N2CCN(CC3(CC(O)=O)CC3)CC2)c1Cl,0 SC11-0880,O=C(c(cc(cc1)Cl)c1F)N(CCCN1CCOCC1)C1CNCCC1,0 Z2066833001,COc1cccc(C2(CC2)C(NC(CC2)CCC2c2ccccc2)=O)c1,1 D011-4959,COCCn1c(cccc2)c2nc1C(CC1=O)CN1c1ccccc1,0 F6562-1958,O=C(c(cccc1)c1Br)NCc1cncc(N(CCC2)C2=O)c1,0 F6445-0507,O=C(c(cc1)ccc1Oc1nccs1)Nc(cc1)cc2c1OCCO2,1 F5591-0339,CCc1nc(-c(cc2)cnc2N(CC2)CCN2C(C(CC2=O)CN2c2ccccc2)=O)no1,1 F6515-1426,O=C(c1cc(Br)cs1)NCc1cc(-c2ccco2)ncc1,1 F6445-0530,O=C(c(cc1)ccc1Oc1nccs1)NCCC1=CCCCC1,1 Z1169978484,Cc1ccc(-c2n[nH]c(-c3nc(Cc4noc(C)n4)no3)c2)o1,1 C769-2102,Cc(cc1)ccc1S(c1cnc(ccc(Cl)c2)c2c1Nc(cc1)cc2c1OCCO2)(=O)=O,0 Y502-6617,Cc(n(C)nc1)c1S(N(CC1)CCN1S(c1cn(C)nc1)(=O)=O)(=O)=O,0 F6608-3593,CN1CCN(CC#CCOC(CC2)CCN2c2nc(C#N)ccc2)CC1,0 C464-1026,CCC(N(CC1)c(cc2)c1cc2S(NC(CC(C)C)C(NCc1cccs1)=O)(=O)=O)=O,0 F5896-0254,CCCc1c(C(Nc2cccc3ccc(-n4cccc4)nc23)=O)snn1,1 F0696-4686,O=C(c(cc1)nnc1N1CCOCC1)Nc(cc1)cc(C2)c1-c1c2cccc1,1 V018-4567,COCCCN(CC(COCc1ccco1)O)Cc1c(N2CCOCC2)onc1-c1ccccc1,0 F5852-0770,O=C(C(NC1CC1)=O)NCCOc(cc1)ccc1F,1 Z3132871101,NC(CCC1)(C2)C1CN2C(CCc1nocc1)=O,1 SB95-1292,CS(N(CCN1CCOCC1)C1CN(Cc2cccc(Cl)c2)CCC1)(=O)=O,0 SA87-0023,O=C(CCc1ccccc1)NCC(CN1CCc2ccccc2)OCC1=O,1 Z1233569706,CC(C)N(CC(Nc(cc1)ccc1F)=O)C(c1cc(S(N)(=O)=O)c(CCC2)c2c1)=O,1 SD12-0009,Cc1noc(CC(C(NCC2)=O)N2C(c2cc(ccc(OC)c3)c3[nH]2)=O)n1,1 Z2446562359,OC(Cn1ncc(NC(c(cc2)ccc2OC2CCOCC2)=O)c1)=O,0 F6571-3511,OCCOC1(CNS(c2cc(C(F)(F)F)ccc2)(=O)=O)CSCC1,0 F2359-0532,CCOC(N(CC1)CCN1c1nc2nccnc2c(Nc(cc2)c(C)cc2Cl)n1)=O,0 S632-0320,CN(CC1)CCC1[C@@H](CN(C1)C(CCCc2c[nH]c3c2cccc3)=O)[C@H]1C(N)=O,1 F5958-0076,Cc1cc(C)nn1CCNS(CCc(cc1)ccc1OC)(=O)=O,1 Z2975549426,CC(C)c1nccc(NCC2(CC2)n2ncc(Br)c2)n1,0 Z4873983876,COc(cc1)ccc1-n1nc(-c2cn(CCO)nc2)nc1C(CC1)CCC1O,1 S248-3945,CC(C)NC(N1CC(Cc2noc(C3CCOCC3)n2)CC1)=O,0 Z1576310066,O=C(CNC(c1cccc(Cl)c1)=O)NC(C1)C11CCCCC1,1 F6480-3411,Cc1nc(OC(CCC2)CN2S(C2CCCCC2)(=O)=O)nc(C)c1,1 Z2968698137,COc(ccc(CNC(NC1C2(CCCC2)OCC1)=O)c1)c1O,1 Y042-4849,O=C(CCCC(N(CC1)CCN1c(cc1)ccc1F)=O)Nc1nnc(C2CCC2)s1,1 Z3192150765,CC(C)(c1ncc(C)s1)NC(C(NC=C1OC)=CC1=O)=O,0 Z2173351199,CC(C)c(cc1)cnc1C(Nc1n[nH]c(C2CCOCC2)c1)=O,0 Z2440078339,NC(CC1)CCC1NC(c1c(CSc(cc2)ccc2F)c(cccc2)c2o1)=O,1 F3406-5232,COc(cccc1)c1NC(CN1N=C(C(SC2CCCCC2)=NC=C2)N2C1=O)=O,1 C301-9059,COc(cc1)ccc1S(NC(C(Oc1c2cccc1)=O)=C2N1CCCC1)(=O)=O,0 F1897-0439,O=C(c(ccc(F)c1)c1F)Nc(cc1)ccc1-c1cn(ccs2)c2n1,0 Z1506272197,C(c1noc(CN2CC(CC3)(c4c3cccc4)OCC2)n1)c1ccccc1,0 F6192-0398,Cc(c(NC(C(NCC(c1ccco1)c1ccco1)=O)=O)ccc1)c1Cl,1 F5054-0046,Cc1nnc(-c(cc2)ccc2OCC(Nc2c(C(F)(F)F)cccc2)=O)o1,0 Z1175211960,O=C(CN(c(cccc1)c1N1)C1=O)N(CCC1)CCS1(=O)=O,1 F6556-5170,O=C(c1cc(cccc2)c2s1)N(CCC1)CCN1C1CCSCC1,1 Z4014698657,OC(C(C1)(C2)CC12NC(c1c(cccc2)n2nc1C1CC1)=O)=O,1 SC58-0190,Cc1cnc(C2C(C3)(CN3S(c(cccc3)c3Cl)(=O)=O)CN(C)C2)o1,0 SC02-0584,CCn1nccc1C(N(CC1)CC1(CCOC)NC(C1CCOCC1)=O)=O,1 Z2983800304,CCc(cccc1)c1N(C(C(Cc1cncs1)N1)=O)C1=O,0 Z1564086976,O=C(C1N(Cc2cc(F)cc(F)c2)CCC1)NC1CC1,0 S555-0046,Cn1nc(C(N2Cc(cc(cc3)N4CCOCC4)c3OCC2)=O)c2c1cccc2,1 F6562-7660,O=C(Cc(c(F)ccc1)c1Cl)NC(CC1)C11CCOCC1,0 Z2195780259,CN(C)CCn(cc1)nc1NC(C(c(ccc(Cl)c1)c1F)O)=O,0 SA44-0532,CC(C)Cc1nnc(C2N(C)CC(C3)(CN3C(Cc3cscc3)=O)C2)o1,1 Z2911190626,OC(C(C1)(C2(COC2)CN1C(CC1CCCC1)=O)F)=O,1 F6036-0784,CCOc(cccc1)c1NC(N(C1)CC1c1nc(-c2ncccc2)no1)=O,1 Z4149968645,CC(C)(CC(c1ccc2)O)Oc1c2NC(CCC(c(cc1)ccc1O)=O)=O,1 F6374-5607,O=S(c(s1)ccc1Cl)(N1CCC(CSCc2ccco2)CC1)=O,1 Z1652955947,Cc1c(C(NCCCn2nncc2)=O)sc2c1c(F)ccc2,1 P930-5517,O=C(Cc(cc1)ccc1OC(F)(F)F)N(CCC1)[C@@H]1c1nnc(-c(cc2)ccc2F)[nH]1,1 F6809-1226,CCOc(cc1)ccc1NC(CN(CC1)CCC1(c(cc1)ccc1Cl)O)=O,0 Z963001218,NC(C(C1)OCCN1C(NCC1(CCCC1)c1cccc(Cl)c1)=O)=O,0 F6412-1749,O=C(c(cccc1)c1F)NCC#CCOc1cc(C(F)(F)F)ccc1,0 Z1324802896,O=C(c1nc2ccccc2cc1)N(CC1)CCN1C1CCOCC1,1 8640-0379,CC(C(Nc1ccccc1)=O)SC(N1C)=Nc(sc2c3CC(C)(C)OC2)c3C1=O,1 Z2607932426,Cc1nc2ccccc2c(NCC2N(C)CCOC2)c1,1 Z1744863802,CC(C)(c(cc(cc1)S(N(CC2)CCC2Nc2nccs2)(=O)=O)c1N1)C1=O,0 F6754-7709,COc(cccc1)c1N(CC1)CCN1c1nccc2c1ccs2,1 F6559-6258,O=C1N(C(CCC2)CN2S(N2CCOCC2)(=O)=O)C=Nc2c1cccc2,1 SC15-0319,O=C(c1cnncc1)N1CCC(CN(CC(COc2ncccn2)C2)C2=O)CC1,1 F6478-2382,O=C(C1(CC(C2)C3)CC3CC2C1)N(CC1)CC1Oc1ncncc1,1 F3055-0550,CCc(c(OCC)c1)cc(-c2n[nH]c(C)c2-c2nc(C)cs2)c1O,1 F6159-0127,O=C(c(c(F)ccc1)c1Cl)N1CCC(COc2nc(cccc3)c3s2)CC1,1 Z3008667199,C[C@@H](C1CC1)NS(c(ccc(C(O)=O)c1)c1OC)(=O)=O,0 F6218-0266,O=C(Cc(cc1)ccc1F)Nc1cnc(-n2nccc2)nc1,0 S591-0784,CS(N(C(C1)CN1C(Cc1cc(F)ccc1)=O)C1CCOCC1)(=O)=O,1 Z852068184,Cc1cccc(C(N2CC(CCC(O)=O)CCC2)=O)c1O,0 F6502-1146,O=C(C1CCC1)NCCn1c(-c2nccnc2)ncc1,1 Z3290575165,COc1c(CCNS(C(C2)CC2(F)F)(=O)=O)cccc1,1 C301-7888,Cc1nc2nc(-c3ccccc3)nn2c(Nc(cc2)ccc2N2CCN(Cc(cccc3)c3F)CC2)c1,1 F0922-0748,O=C(CCN(C(c(cccc1)c1N1Cc(ccc(F)c2)c2Cl)=O)C1=O)NCc1ccco1,1 Z2967717880,CC(c1cccc(N2CCN(CC(N3CCCCC3)=O)CC2)n1)O,0 F6773-4765,Cc1cnc(C)c(OC(CC2)CCN2c2nc(OC)nc(OC)n2)n1,1 Z826467008,CS(N(CCC1)CC1NC(NCc(cc1)c(C(F)(F)F)cc1F)=O)(=O)=O,0 F6481-3996,CCOc(ccc(S(N(CC1)CCSC1c1ccco1)(=O)=O)c1)c1F,0 Y042-5922,O=C(C(CC1=O)CN1c1n[nH]c2c1cccc2)Nc1ccc(Cn2ncnc2)cc1,1 F6609-3671,O=C(COC(c(cc1)ccc1Br)=O)NCCc1ccccc1,0 F6125-1766,O=C(COc(cccc1)c1F)N(C1)CC1C(Nc1c(CCCC2)c2no1)=O,1 F6554-0607,Cn1nc(C(CCC2)CN2C(c2csc(-c3ccccc3)n2)=O)cc1,1 F6089-2931,O=C(c(cc1)ccc1-n1cccc1)Nc(cc1)cc(C2)c1NC2=O,1 F6525-3113,Cn(c(CNS(c1cccc2ccccc12)(=O)=O)c1)nc1-c1cnccc1,1 F6235-0031,O=C(c(cccc1)c1Cl)N(CC1)CCN1c(cc1)nnc1-n1cncc1,0 Z2410017125,CC(C)Oc(nccc1)c1C(N(C1)CC1n1nc(C)nc1C)=O,0 Z3989662839,O=C(c(cc(cc1)S(N2CCCCC2)(=O)=O)c1Cl)N(CCC1)C1C1COCCC1,1 F2738-0486,COc1cccc(C(N(Cc2ncccc2)c(sc2ccc3)nc2c3Cl)=O)c1OC,0 F6412-2168,O=C(c(c(F)ccc1)c1F)NCC#CCOc(cc1)cc2c1OCO2,0 F6482-5776,O=C(c1ccco1)NCc1cc(-c2ccncc2)ncc1,1 F5791-0794,O=C(c1ccc(Cn2cncc2)cc1)Nc1cccc(OC(F)F)c1,0 C301-3412,Cc(ccc1nsnc11)c1NS(c1ccc(C2CCCCC2)cc1)(=O)=O,1 F6562-7029,Cc1c(CCC(N(CC2)CCC2N(C(COC2)=O)C2=O)=O)scc1,1 S926-8036,COCCc1nc(COC(CCC2)CN2S(c2cc(CCC3)c3cc2)(=O)=O)no1,1 Z2933117057,CC(C)Oc(cc1)nc(C(NC[C@@H](CCC2)NC2=O)=O)c1Cl,1 S661-1279,CCN(C(C(C1)N2CC11CCN(Cc3cn(C(C)C)c(cc4)c3cc4OC)CC1)=O)C2=O,0 F6559-1566,CCOCCCNC(NC(CC1)CCC1(F)F)=O,0 V011-4608,CC(C)(C)CC(C)(C)Nc1c(-c2c(C)cccc2)nc2n1cccc2,0 Z1738348784,Cc1c(C(C(O)=O)NS(c2cc(CCC3)c3cc2)(=O)=O)c(C)nn1C,1 G526-0088,COc1cc(CCN(C2CC(O)=O)C(Nc3cccc(Cl)c3)=O)c2cc1OC,0 Z2899017080,COc1nc(CNC2C3(CCC3)NCC2)cnc1,1 SA49-0326,O=C(CC1COC(C2)(CN2S(c2cccs2)(=O)=O)C1)N1CCCC1,1 F6480-5428,O=C(c1cscc1)N(CCC1)CC1Oc1ncncc1,1 F1981-0006,OC(c1cc(-c2ncccc2)nc2ccccc12)=O,0 Z1559173658,CC(C)(C)S(CC(N(C1CC1)C(CC1)c2c1cccc2)=O)(=O)=O,1 Z2868861511,C[C@@H](C1)[C@@H](CO)CN1C(Nc(cc1)nn1-c(ccc(C#N)c1)c1Cl)=O,1 E957-2106,O=C(COc1ccccc1)Nc1c(C(N(CC2)CCC2N2CCCCC2)=O)oc2c1cccc2,1 SA05-0994,Cc1nnc2n1CCN(Cc1c[nH]nc1-c1cccs1)C2C(N(C)C)=O,1 Z2355494706,Cc1nc(NC([C@@H](C2)[C@H]2c(cccc2)c2OC)=O)nc(OC)c1,0 F5461-1110,O=C(CC(c1ccccc1)c1ccccc1)N1CCN(Cc2nc(C3CC3)cs2)CC1,1 F6480-0995,O=C(Nc(c(F)ccc1)c1F)N(CCC1)CC1Oc1ccncc1,1 F6353-7239,COc1cccc2c1oc(C(NCC(c1cscc1)N1CCC1)=O)c2,1 Z2044941549,O=C(Cc1cocc1)N1CCC(CC(F)(F)F)CC1,0 SA87-1061,O=C1N(CCc2ccccc2)CC(CNS(Cc(cc2)ccc2F)(=O)=O)OC1,0 F6786-5744,CC(C)(C)C(N1CC(COc2nnc(C)cc2)CC1)=O,1 E757-0107,CC(CC1)CCC1NC(c1ccc(CN(CC(N2C3CSC2)=O)C3=O)cc1)=O,1 J079-0837,CCc(cc1)cc(C(CN2CCN(Cc3c(C)oc(-c4ccc(C)cc4)n3)CC2)=C2)c1OC2=O,0 Z737683760,Cc1cccc(NS(c2csc(C(O)=O)c2)(=O)=O)c1,0 Z1552414370,O=C(C(C=C1)=NN(c(cccc2)c2F)C1=O)N(CCC1)C1c1c2OCCOc2ccc1,1 S985-0301,CCn1nc(C)c(CN(C[C@H]2CN(C3)C(C(C)C)=O)C[C@@]23C(N2CCCC2)=O)c1,0 Z1583428869,CCCN(C(CC1)=O)c(cc2)c1cc2NS(c(ccc(F)c1)c1F)(=O)=O,0 Z1460172795,CC(C)(C)c1nnc(CC2)n1CC2C(O)=O,0 F0755-0105,O=C(c1ccncc1)Nc(cc1)ccc1OCC(C(F)F)(F)F,0 F6464-0211,CCOc(cc1)ncc1C(N(CCCC1)CC1c(cc1)ccc1F)=O,0 F6416-9435,OC(CCNC(NCCOc1ccccc1)=O)c1cccc(Cl)c1,1 F5971-0089,CC(CNC(COc1c(C)cccc1)=O)(COC)O,0 SB20-0860,Cc1cn(CC(N2[C@H](Cn3nnc(C(N(CC4)Cc5c4cccc5)=O)c3)CCC2)=O)nc1,0 F6539-3205,O=C(c1c(C(F)(F)F)cccc1)NCc(cc1)ccc1-c1cocc1,0 Z3611651576,O=C(c1c(C2CC2)cn[nH]1)Nc(cc1)ccc1-c1n[nH]c2c1COCC2,1 Z3288920300,O=C(c(cc1)ncc1Oc1cccc(F)c1)N1CC(Cc(cc2)ccc2F)CC1,1 F2331-0060,Cc(cc1)cc(NC(CSc2ncc(-c3ccccc3)[nH]2)=O)c1OC,0 D226-0080,CC(CC1)CCN1c1nc(N(C)C(NC2=O)=O)c2n1CCSc1nc(C)cc(C)n1,1 Z3292537707,CC(CC1)CCN1C(CCn1c2ncccc2cc1)=O,1 F6760-2002,O=C(c(cc1)nn2c1ncc2)N(CCC1)CC1c1nc(cccc2)c2o1,1 F5832-0040,O=S(C1CC1)(NCC1(CCOCC1)c1cccs1)=O,1 Z3221676335,CCN(CC)CCNC(C1CCN(Cc2c(C)oc(-c(cc3)ccc3Cl)n2)CC1)=O,0 Z1667048309,CCCNC(CCC(N(CC1)CCC1c1nc(C)ccn1)=O)=O,0 Y032-4656,CN(C)C(N(CC1)CCC1C(Nc(cc1)ccc1S(N1CCOCC1)(=O)=O)=O)=O,0 F6502-0462,CC(C)n1nc(C)c(S(NCCn2c(-c3ncccc3)ncc2)(=O)=O)c1C,1 C498-0692,CN(c(cccc1)c1-c1c2cc(C(NCCN3CCN(Cc4ccccc4)CC3)=O)s1)C2=O,1 Z1264477093,CNC(c1cccc(C(NC(CC2=O)CN2c2cc(OC)ccc2)=O)c1)=O,0 S808-0212,CC(C)CCN(CC[C@H]1N(CCOC)S(CC2)(=O)=O)C[C@]12C(N1CCOCC1)=O,1 F5054-0052,CCOC(c(cccc1)c1NC(COc(cc1)ccc1-c1nnc(C)o1)=O)=O,0 Z1823890188,CC(COC)Oc(ccc(Cl)c1)c1S(NC(c1c(C)ncnc1)=O)(=O)=O,1 F6359-0612,O=C(c(ccc(F)c1)c1F)N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1,0 F976-0327,O=C(C=C1)N(c2ccccc2)N=C1N(CCC1)CCN1S(Cc1ccccc1)(=O)=O,1 F6261-4048,CC(C)OCc1ccc(C(NCc2c(C)nc(-c(cccc3)c3Cl)s2)=O)o1,1 Z1954753117,CC1(C)C(C)(C)C1CNC(c1cccc(NC(N(C)C)=O)c1)=O,0 F5882-4172,O=C(c(ccc(F)c1)c1F)NCC(CC1)CS1(=O)=O,0 8017-9096,COc(cc1)cc(C2(C3C(N4c(cc5)ccc5Cl)=O)N(CCC5)C5C3C4=O)c1NC2=O,0 T501-0385,CC(C)n1c(CC(CCC2)CN2S(Cc2ccccc2)(=O)=O)nnc1,0 SB99-0255,Cc1noc(C)c1CC(N(CC1)Cc2c1n(C)nc2CCC(N1CCOCC1)=O)=O,1 G702-4611,C1Cc2c(Nc(cc3)cc4c3OCCO4)n3nc(-c4ccccc4)nc3nc2CC1,1 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F6443-1013,COC(CC1)CN1c(cc1)ccc1C(NCCc(cc1)ccc1F)=O,1 F6488-2659,CN(C)c1cncc(OC(CC2)CN2C(c2c3OCCOc3ccc2)=O)n1,1 SD61-0353,COCC(N(C1)CC2(CCC2)C1C(NCc1ncccc1)=O)=O,0 F6274-0361,Cc(cccc1)c1OCC(OC(C1)CN1c1nc(ccc(F)c2)c2s1)=O,1 F6002-0212,CC1=CN=CN(CC(Nc(cccc2)c2OC(F)(F)F)=O)C1=O,0 S959-3345,CS(NC(CCN1CCNC(Cc2cccc(Cl)c2)=O)C1=O)(=O)=O,0 F6548-4598,COc1ccc(CNc2nc(SCC(N=C(C=C3)N4C=C3Cl)=CC4=O)nc3ccccc23)cc1,1 Z1673488595,CCCC(CCCC1)N1C(NCc1ccc(C(C)O)cc1)=O,0 Z453413524,COC(C(C=C1NC(CC(c2c3cccc2)=NNC3=O)=O)=CNC1=O)=O,0 T991-2074,COCCN(CCC1N(CCC2)CCN2C(Nc(ccc(F)c2)c2F)=O)C1=O,1 F1205-0015,Cc1nc(SCC(NCCc(cc2)cc(OC)c2OC)=O)nc(C)c1,1 Z2964449433,O=C(C(CCC1)c2c1[nH]nc2)Nc1c[nH]c2c1cccc2,1 F2972-0418,Cc(cc1)c2sc(N(CCCn3cncc3)C(c3ccco3)=O)nc2c1OC,0 Z2474422538,OC1(CC1)C(CC1)CCN1C(Nc(cccc1)c1Cl)=O,1 L923-0521,Cc1noc(-c2csc(S(N3CCN(CCOc(cc4)ccc4Cl)CC3)(=O)=O)c2)c1,1 F6708-8426,O=C(NCc(cc1)ccc1F)N1CC(C2)(CC2c2ccccc2)C1,1 F5596-0338,CC(C)c1nnc(C(CC2)CCN2C(CCc2ccccc2)=O)o1,1 F6543-5598,FC(C(C1)CN1c(nc1)ncc1Br)F,0 Z1233498315,O=C(c1cscn1)N1CC(Cc(cc2)ccc2F)CC1,1 F6443-1678,COC(CC1)CCN1c(cc1)ccc1C(N(CC1)CCN1c1ncccc1)=O,1 SA01-0811,CCS(N(CC1)CC1c1nc(N(C)C)ncc1C(N(C)C)=O)(=O)=O,0 F5317-0185,CN(C=C1OCc(cc2)ccc2F)C(C(NCCc(cc2)cc(OC)c2OC)=O)=CC1=O,1 Z1486682159,CC(C)(C)c(s1)ccc1S(NC1(CC(N)=O)CCC1)(=O)=O,0 F6573-2674,CS(N(CC1)CCC1C(NCCOCCn1nccc1)=O)(=O)=O,1 F6783-7163,Cc1nc(CCC2)c2c(N2CC(CN(C3)c4nnc(C(F)(F)F)cc4)C3C2)n1,1 F6515-1470,O=C(NCc1cc(-c2ccco2)ncc1)NC1CCOCC1,1 F0676-0291,CCOC(c(cccc1)c1NC(CSc1nn2c(-c(cc3)ccc3F)nnc2cc1)=O)=O,0 Z2757689955,C[C@@](CCC1)(C(O)=O)N1S(c1ccccc1)(=O)=O,0 Z4119962621,O=C([C@H](CC1)C[C@H]1NC(NCc1cccc(C(F)(F)F)c1)=O)N1CCCCC1,1 F6442-1043,COc(cc1)ccc1S(C(C1)CN1S(Cc1cc(C(F)(F)F)ccc1)(=O)=O)(=O)=O,0 F0600-0377,O=C(c(sc1c2cccc1)c2Cl)Nc1nc(c(F)ccc2)c2s1,1 Z1840304176,CCOc(c(CC(NC1Cn2nc(COC)nc2CC1)=O)ccc1)c1Cl,0 Z1702487793,Cc1ncc(C(NCc2nnc(C3CC3)n2C2CC2)=O)s1,1 Z994138292,CCc(cc1)ccc1C(N1CCC(CNC(c2cn(C)nc2)=O)CC1)=O,0 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J014-1158,O=C(C(C1)Oc(cccc2)c2N1S(c1ccccc1)(=O)=O)NCc1ccco1,0 F6476-1303,O=C(COc(cc1)ccc1Cl)N(CC1)CC1Oc(nccc1)c1Br,1 Z3278091177,C(C1)[C@@H](CNC2)[C@@]12c1nc(-c(cc2)ncc2N2CCCC2)no1,1 Z1022829334,CC(C(NCc1c(-n2cncc2)nccc1)=O)N(C(C1(CCCC1)N1)=O)C1=O,1 F6471-2824,O=C(c1cnc(C(F)(F)F)cc1)N1C2C=CCC1CC2,0 F5017-2798,COc(ccc(F)c1)c1S(NCC1CCN(Cc(cccc2)c2SC)CC1)(=O)=O,0 Z2325720237,COc(ccc(Cl)c1)c1C(N1C2(CCCCC2)COCC1)=O,1 6145-0174,O=C(C1CCCCC1)N(c(cc1)cc2c1oc1c2CCCC1)S(c(cc1)ccc1F)(=O)=O,0 S687-2167,O=S(c(cc1)cc2c1OCCO2)(N(CC1)CCC11OCCC(Cc2nc(-c3cnccc3)no2)C1)=O,1 V031-1474,Oc1c(CN(CCCn2c3ccc2)C3c2ccccc2)cccc1,0 F6521-7703,Cn(cc1)c2c1cc(C(CNC(NCc1cccs1)=O)O)cc2,1 Z3697024771,CC1(C)CN(CCNC(N(CC2)CCS2(=O)=O)=O)CCC1,1 V004-2688,CC(C)CC(Nc(cc1)cc(C(N2CCCCC2)=O)c1N(CCC1)CCN1C(NC(C)(C)C)=O)=O,1 Y020-1322,O=C(C(C1)n2ncnc2NC1=O)Nc(cc1)cc2c1OCCO2,1 Z1864324143,O=C(c(ncc(F)c1)c1F)Nc1cc(Oc2ccnc3ccccc23)ccc1,0 Z2157016826,CC(NC(C1CCCC1)c1nc(-c2cccc(N(CCC3)C3=O)c2)no1)=O,1 Z274591256,Cc1cccc(CS(Nc2cnccc2)(=O)=O)c1,0 F6454-2305,Cc1nccc(N2CCC(CNC(COCc3ccccc3)=O)CC2)c1,1 Z1870413695,OC(c1cc(C(NCc2cc(OC3CCOCC3)ncc2)=O)ccc1)=O,0 F6483-0458,O=C(NC(CC1)CCC1Oc1ncccc1)N(CCN1)C1=O,1 F6671-3349,Cc(n(C)nc1C)c1S(N(C(CC1)C2)C1CC2n1nnc(COC)c1)(=O)=O,1 F6194-0325,CC(Cc1ccco1)(CNS(c(cccc1)c1Br)(=O)=O)O,0 V030-2733,OC(CN(Cc(ccc(F)c1)c1F)C1CC1)COCc1ccccc1,0 V030-1838,CCN(CC)c(ncnc1N2CCC(C)CC2)c1N,0 Z1891545818,CC(c1nc(CC(NC(C)c(cc2)ccc2OC)=O)no1)c1c(C(F)(F)F)cccc1,1 S979-0216,CC(C)CC(N(C1)[C@@H](C)COc(cc2)c1cc2C(NCCOC)=O)=O,0 Z2460783053,OC(C(CC1)(CN1C(Cc(cc1)ccc1O)=O)c1ccccc1)=O,0 Z3063426837,O=C([C@H](C[C@@H]1OCC[C@H]11)N1C(c(cc1)ncc1Cl)=O)N1CCCC1,0 Z3135081244,NCC(CCC1)c2c1ccc(C(NC1CC(CC(N)=O)C1)=O)c2,0 SD12-0014,Cc1cc(C)nn1CCC(N(CCN1)C(Cc2nc(C)no2)C1=O)=O,1 Z5018089418,CC(CC1C)C(CN)CN1S(c1cccc2cnccc12)(=O)=O,0 F5062-0128,Cc(cc1)ccc1N(CC(C1)C(N(CC2)CCN2c2ncnc3c2nnn3C)=O)C1=O,1 F6556-6365,CC(C)(C(N(CCC1)CCN1C1CSCC1)=O)Oc(cc1)ccc1Cl,1 F6783-7318,Cc1nc(CCC2)c2c(N(C2)CC(C3)C2CN3S(c(cc2)cc(OC)c2OC)(=O)=O)n1,1 Z1376323219,CN(C=CC=C1C(NCCc2csc(-c3ccccc3)n2)=O)C1=O,1 S466-0069,Cc1cc(N=C(CCC2)N2C2=O)c2n1CC(Nc(ccc(F)c1)c1F)=O,0 Z2972605137,CCn1nnc2c1ncnc2NC(C)CC(NC)=O,0 F6617-4288,CC(C(C(OC)=O)=CN1CC(N2CCCC2)=O)=NS1(=O)=O,1 G289-0249,CC(c(cc1OC)c(CC2)cc1OC)N2C(c1nn(C)c-2c1CCc1c2ccs1)=O,1 F6556-5182,O=C(C1CCOCC1)N(CCC1)CCN1C1CCSCC1,1 G305-0302,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1OCCC1)Cc1ccco1,1 Z838094844,CC(C(NC1CCCC1)=O)Nc1ncc(C(F)(F)F)cc1,1 F454-0257,N#CC1=CC(C(CC(C2)c3ccco3)=O)=C2N(c(cc2)ccc2Cl)C1=O,1 Z644923116,Cc(cccc1)c1C(NC(CC1)CCN1C(C=NN(C)C1=O)=C1Cl)=O,0 F6550-6805,Cc(ccc(C(N(C1)CC1Nc1ncncc1)=O)c1)c1F,0 Z3569501786,OCC(CC1CCC1)NC(c1cc(Cc2ncccc2)ccc1)=O,1 S544-1224,CC(CC1)CCN1S(N(CC1)CCC1C(N1CC(CCOc(cc2)ccc2F)CC1)=O)(=O)=O,0 F6374-0136,COC(c(cccc1)c1C(N1CCC(CSc2ncccc2)CC1)=O)=O,0 F5822-0846,CCc1nccn1CC(CC1)CCN1C(Cc1coc2c1ccc(C)c2C)=O,1 F5033-1201,O=C(NCC1CCN(Cc2cscc2)CC1)NCc1cccs1,1 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Z1856597718,CC(C(N(CC1)CCN1C(Nc1cnns1)=O)=O)O,0 D718-0582,CC(O1)=CC(O)=C(c2c(C(NC(N3CCCCC3)=N3)=O)c3ncc2)C1=O,1 Z30242005,NC(c(cc1)ccc1NC(C(c1c2cccc1)=NNC2=O)=O)=O,1 F6514-9475,COCCNC(NCc1c(-c2cnccc2)nccc1)=O,0 F2227-1005,CC(C)Cc1nnc(-c2cc(cccc3)c3n2CC(Nc(cc(cc2)Cl)c2OC)=O)o1,1 Z3293999645,O=C(C1(CCC2)C2CCC1)NCC(c1cccs1)N1CCOCC1,1 Z3847061912,CC[C@H](c(cccc1)c1F)NCC(c1cccc(Cl)c1)O,0 F2751-0096,O=C(c1ccccc1)NCCS(NCc(cccc1)c1Cl)(=O)=O,0 G115-0416,O=C(C=C1)NN=C1c(s1)ccc1S(N(CC1)CCN1c(cc1)nnc1N1CCOCC1)(=O)=O,1 F6739-7733,CN(Cc(cc1)cc2c1OCCO2)c1nc(C#N)ccc1,0 D473-0829,O=C(c1ccco1)N(CC1)CCN1C(c(cc1)ccc1N(C(CC1)=O)S1(=O)=O)=O,0 Z2784082345,Cc1cn(CCC(NC2CN(Cc3cc(C)ccc3)CC2)=O)nc1,0 Z2946311504,OC(CN1CCOCCC1)(CCC1)CN1C(OCc1ccccc1)=O,1 F2147-0797,Brc1c(C2NCCN(Cc3ccccc3)C2)cccc1,0 Z335502112,CC(CC1)CCC1Nc1cccc(C(N)=O)c1,0 Z1455265832,CN(CCC(O)=O)C(c1c(cn[nH]2)c2ccc1)=O,0 F6435-9127,COC(CSC(CC1)CN1C(C1(CCCC1)c1cccs1)=O)=O,1 Z2991434164,Cc(c(-n1nnnc1)ccc1)c1NC(CC(CCC1)C1(F)F)=O,1 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Z2953015185,CC1(CNC(Nc2cc(Cl)cnc2)=O)CCN(C)CC1,0 Z2640796664,Cc(cccc1)c1-n1ncc(C(N2C(CC3)CN3CC2)=O)c1C(F)F,1 8576-1268,O=C1NC(CN2CCOCC2)=Nc2c1c(CCCC1)c1s2,1 8009-6421,CN(CCC1)CCN1C(CC(N1c(cc2)ccc2Br)=O)C1=O,1 SC98-0088,Cc1cnc(-c2nn(C)c(CC3)c2CN3S(c2cn(C)cn2)(=O)=O)o1,1 Z1335086815,Cc1c(C(N(CCC2)CCN2S(c2ccccc2)(=O)=O)=O)sc(Cl)n1,1 F5001-0994,Cc1cccnc1NC(Cc1noc(-c(cc2)ccc2OC)c1)=O,0 F6514-8953,O=C(NCc1cccs1)NCc1cc(-c2cnccc2)ncc1,1 F6451-1646,Cc1c(C(CNC(c(cc2)ccc2N(C)C)=O)OC)cccc1,0 S591-0433,O=C(CCc1c[nH]c2c1cccc2)N(C1)CC1N(Cc1ccccc1)C1CCOCC1,1 Z1330028708,O=C(c1cc(N(CCCN2)C2=O)ccc1)N1c2cccc(F)c2C2(CCCC2)C1,1 Z67701987,O=C(C(CCC1)N1S(c(cc1)ccc1F)(=O)=O)Nc1nc(cc2OCCCOc2c2)c2s1,1 G516-1382,Clc(cc1)ccc1-c1nc2ccccc2c(NC2CCN(Cc3ccccc3)CC2)n1,0 Z1638554895,Cc1cccc(S(N(CC2CC(O)=O)c3c2cccc3)(=O)=O)c1F,0 P074-4152,N#Cc(cc1)ccc1C(NC(c1nnc(N2CCOCC2)o1)c1ccccc1)=O,1 D074-0046,Oc(cccc1)c1-c1n[nH]c2c1C(c1ccccc1)N(Cc1ccco1)C2=O,0 Z3071539567,CC(CC1)(CN1C(Cc1c[nH]c2c1ccc(Cl)c2)=O)N(C)C,0 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M758-3814,Cc1noc(C)c1S(N(C1)CC1N(Cc1ccncc1)S(C)(=O)=O)(=O)=O,1 F3127-0029,Cc(cc(cc1)Br)c1NC(c(cccc1)c1C(O)=O)=O,0 V001-3155,CCC(C)c1nc(sc2c3CCCC2)c3c(N(CC2)CCN2S(CC)(=O)=O)n1,0 F5596-0053,CC(C)c1nnc(C(CC2)CCN2C(c(cccc2)c2Cl)=O)o1,0 Z3352199512,OC(CC(Nc1c[nH]nc1-c1ncccc1)=O)C1CC1,1 V024-5304,CC(C)Cn1c(S(Cc2ccccc2)(=O)=O)ncc1CN(CC1OCCC1)C(Nc1ccc(C)cc1)=O,0 F2599-0055,CCOC(N(CC1)CCN1C(CSc(n1C)nc(C(N2C)=O)c1N(C)C2=O)=O)=O,1 SA72-1073,Cc1cc(C)nn1CC(N(CC1)CCC1(CCOC)c1noc(C2CCOCC2)n1)=O,1 Y044-3200,N1(C(c2c(C1)cccc2)=O)[C@H](C(NCc1nc2c([nH]1)cccc2)=O)CC(C)C,0 Z1261987320,CN(C(CC1C(Nc2cc(NC(CC3)=O)c3cc2)=O)=O)c2c1cccc2,1 F6481-4520,Cc1noc(C)c1S(N(CC1)CCSC1c1cccs1)(=O)=O,1 F6525-0564,O=C(c1nc2ccccc2cc1)N1Cc2c(CCC3)c3nn2CC1,1 F6200-3094,Cn1c(cccc2)c2c(C(CNC(CSCc2ccccc2)=O)O)c1,1 Z441582694,CC(C)NC(Cc1c(C)n(-c(cc2)ccc2Cl)nc1C)=O,0 Z2755474934,CC(CC(O)=O)N(CC1)CCN1C(CC1=CCCCC1)=O,0 F5530-0563,CC(N1c(cc2)ccc2OC)=Nc(ccc(NC(CC2CCCC2)=O)c2)c2C1=O,1 F5875-0196,O=C(C(C=C1)=COC1=O)NCCCOc1cccc2cccnc12,1 F5069-0330,CCCOc1cn(-c(cc2)ccc2F)nc1C(NCc1cccs1)=O,1 F5493-0463,Cn(cc1C(N(CCC2)CC2c2nnc(-c(cccc3)c3F)s2)=O)nc1OC,1 Z963588066,O=C(CCC1CCNCC1)Nc(cc1)ccc1-n1nccc1,0 F6222-0428,O=C(Cc1c[nH]c2c1cccc2)Nc1cnc(N(CC2)CCN2c2ccccc2)nc1,1 Z1096993761,N#Cc1c(N(CCC2)C2C2CCC2)nccc1,1 Z1426026514,CCC(N(CC1)CC1Nc1nccc(C(F)(F)F)n1)=O,1 Z2105891520,O=C(Nc(cc1)ccc1-c1csc(N2CCOCC2)n1)N1CC(COC(F)F)CC1,1 F6541-3889,Cc1noc(CN(CC2)CCN2c(cccc2)c2F)c1,1 F6560-0764,O=C(Cn(cc1)c2c1cccc2)NC(C1CCOCC1)c1cccs1,1 F6483-0190,O=C(c1cccs1)NC(CC1)CCC1Oc1ncccc1,1 F6454-1045,COC(NCC(CC1)CCN1c(nc1)ncc1F)=O,0 Z86139119,C(c(cc1)ccc1-n1cncc1)NC1CC1,0 F6436-3141,Cc1cc(CNC(CCc(cccc2)c2Br)=O)c(C)o1,0 Z1555263653,CC(C)Cn1ncc(NC(N2CCC(C)(C)CCC2)=O)c1C,0 Z1673588694,CCCc1cnc(NCc2c(C)nc3n2cccc3)s1,1 Z4480730223,CC(C)(CCC1NC(CCc2cscn2)=O)CC1c1ccccc1,1 F6808-5426,CC(C)NC(C(C)N1CCN(Cc2nnc(C)o2)CC1)=O,0 F2617-0661,O=C(COC1=COC(CN(CC2)c3c2cccc3)=CC1=O)NCc1ccco1,1 Z1522205662,CC(c1c[nH]nc1)NC(N1CC(Cc(cc2)ccc2F)CC1)=O,0 Z1486342929,COCCn1ncc(S(Nc2cc(C(F)(F)F)ccc2)(=O)=O)c1,0 F6523-0601,CCOc(ccc(S(N(CC1)CCN1c1nc(C)nc(C(F)(F)F)c1)(=O)=O)c1)c1F,0 K786-8623,Cc1ccc(CCN(CC(C2)C(NCCCN3CCOCC3)=O)C2=O)cc1,1 Z4057124143,CCN(CC1)CCN1C(C)CN(CC(NC)=O)C(c1ccc(-c2ccc(C(C)(C)C)cc2)o1)=O,1 Z1754142816,Cc1nnc([C@@H](C[C@@H](C2)OC)N2C(c(sc2c3cccc2)c3Cl)=O)o1,0 Z2069639543,O=C(C1CC1)Nc1nccc(C(N2CC(c(cccc3)c3F)OCC2)=O)c1,1 Z4872929008,CCOC(c1c(C)nc(NC(N2C(C)COCC2)=O)s1)=O,1 J500-0359,CC(C)NC(C(C1)C2(CCCC2)CN1C(c(ccc(F)c1)c1F)=O)=O,0 SC08-0004,CS(N(CC1)CCC1c1noc(C(C2)CN2S(Cc2ccccc2)(=O)=O)n1)(=O)=O,1 F3407-3202,Cc(c(NC(c1cn(Cc(cc2)ccc2NC(c(cccc2)c2OC)=O)cn1)=O)ccc1)c1Cl,0 SA49-0399,O=C(CC1COC(C2)(CN2C(C2(CCCC2)c2ccccc2)=O)C1)N1CCOCC1,1 D073-0305,Cn1c(ccc(NC(NC2CCCCC2)=O)c2)c2nc1CCNC(c1ccco1)=O,1 V006-1626,Cc(cc1)cc(NC(N(CC2)CCN2C(c(cc2)ccc2F)c(cc2)ccc2F)=O)c1OC,0 Z1744329386,C[C@H](C(O)=O)NS(c1cn(CC2CC2)nc1)(=O)=O,0 Z2636216162,COC1(CNC(c(cc(cc2)-n3nncc3)c2F)=O)COCC1,0 Z1225466604,Cc1nc(N(CC2)CCC2(C(N)=O)c2ccccc2)nc(OC)c1,0 F6796-3416,CC(C)(C)c(nc1cc2)cn1nc2OCC1CN(Cc2n[nH]c3c2CCCC3)CC1,1 Z2409424039,CC(CN(C)S(c(cc1)cc(C)c1F)(=O)=O)(c1ccccc1)O,0 Z1985984807,Cn1c(ccc(C(NC2CC2)=O)c2)c2nc1C(F)F,0 F6481-0150,O=C(COc1ccccc1)N(CC1)CCSC1c1ccccc1,0 F6808-0021,COc1cccc(N(CC2)CCN2c(ccnc2)c2Br)c1,0 Z2187194615,CC(C1CC1)(C(N1CC(Nc2cccc(CN(CCN3)CC3=O)c2)=O)=O)NC1=O,1 Z913246170,OCC(CCC1)CN1C(NCc(cccc1)c1N1CCOCC1)=O,1 SC89-0213,O=C(Cc1cnccc1)N(C1)CC1(C(CN1CCCCC1)CC1)S1(=O)=O,1 F3382-7026,CC(C)c(cc1)ccc1NC(CSc(cc1)nnc1N1CCOCC1)=O,1 Z1517455460,CC(CC(N(CCC1)C1C(NC)=O)=O)(C1CC1)O,1 P297-4734,O=S(c(cc1)ccc1F)(N(CC1)CC1n1c2ncccc2nc1-c1cocc1)=O,0 Z2025168482,Cc1ccc(-c(n2CC3OCCC3)nnc2N(CC2)CC22COCC2)s1,1 Z2796388677,N#CC(C(N1)=O)=CN(CCC(N(CCC2)C2c(cc2)ccc2Cl)=O)C1=O,1 D430-2301,Cc1nc(N2CCCC2)cc(Nc(cc2)ccc2NS(c(ccc(F)c2)c2F)(=O)=O)n1,0 F6475-2935,CC(C)Oc1c(CNC(c2cc(OCCOC)ncc2)=O)cccn1,1 E612-1223,CS(CCC(C(NCCN1CCC(Cc2ccccc2)CC1)=O)N(Cc1c2cccc1)C2=O)(=O)=O,1 Z927436652,Cc(cc(cc1)Br)c1NC(CN(C)C(CNC(CN)=O)=O)=O,0 Z1393946690,OC(CCC1)CN1C(NC1=CC=CN(Cc2ccccc2)C1=O)=O,0 Z363643612,CCc(n(-c1ccccc1)nc1)c1C(NCc(cc1)cnc1-n1cncc1)=O,0 F3395-0210,COc1cccc(N(CC2)CCN2C(CC2)CCN2C(CCCC2)C2=O)c1,1 F6512-9142,Cc1c(CNC(c2cc(cccc3)c3s2)=O)cno1,1 J005-1043,CC(C)c1noc(C(CCC2)N2S(c2c(C)ccc(C)c2)(=O)=O)c1,0 D078-0150,C(/C=C/c1ccccc1)n1c(cccc2)c2nc1C1OCCC1,1 F6089-6059,O=C(c1noc(-c2ccco2)c1)NCC1(CC1)c(cc1)ccc1F,1 SC21-0235,CCCn1c(-c2nn(C)c(CC3)c2CN3S(c2c(C)onc2C)(=O)=O)ncc1C,1 Z4232601566,CCNC(C1CCN(Cc(cc(C(F)(F)F)cc2)c2Cl)CCC1)=O,0 SA05-1020,Cc1nnc(C2C(N(C)C)=O)n1CCN2C(NCc(cc1)ccc1OC(F)(F)F)=O,0 F6507-1184,OC(CCNC(c1cccc(Br)c1)=O)C1CCOCC1,0 F707-0054,Cc1nnc(cc2)n1nc2N(CC1)CCC1C(N(CC1)CCN1c1cccc(Cl)c1)=O,0 S594-0772,O=C(NC1CCCCC1)N(CC1)CCC1c1noc(COc2cnccc2)n1,1 Z1226098664,O=C(CNC(c1cccc(F)c1)=O)N(CCC1)C1C(NC1CC1)=O,1 Z740852840,Cc1c(C(N2C(CC3)CC3C2)=O)sc(-c2cccs2)n1,1 F6374-3619,O=C(CSc(cc1)ccc1F)N1CCC(CSC2=NCCS2)CC1,1 D437-0661,CC1Oc(ccc(-c2c(C)sc(NC(c(cc3)cc(OC)c3OC)=O)n2)c2)c2NC1=O,0 Z2935933443,CCC(N=C(C(C)C1CC1)N1)=CC1=O,0 Z808768882,O=C(C1CN(CC(F)(F)F)CCC1)Nc1cc(CCC2)c2cc1,1 F6510-1364,O=C(c1ccc(Cn2cncc2)cc1)NCCN(c(cccc1)c1N1C2CC2)S1(=O)=O,1 Z2004649387,CS(C(CC1)CN1C(c(cc1)ccc1OC1CCC1)=O)(=O)=O,1 Z1199874111,CC(C)CC(COCC1)N1C(c(nc1C)nn1-c1nnc[nH]1)=O,1 SA24-1495,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1c2ncccn2nc1)=O,1 7840-5243,NC(c1c(NC(c(cc2)ccc2C2=Cc(cccc3)c3OC2=O)=O)sc2c1CCC2)=O,1 F6786-6478,Cc1noc(CN2CC(COc(cc3)nnc3-c3cccc(F)c3)CC2)n1,1 Z1947729723,OC(CC(C1)c(cccc2)c2N1C(C(C=CN1)=CC1=O)=O)=O,0 Z2234870852,CC(C)(C1)OC(C)(C)C1NC(Nc1ncncc1OC)=O,0 F6573-4845,COc(ccc(C(NCc1cncc(C2CC2)c1)=O)c1OC)c1OC,0 Z2440805386,Cc1c(C(N(CC2CCC3)CC2C3N)=O)nnn1-c1cccc2cccnc12,1 Z1508694300,O=C(CN(C(C1C2CCCC1)=O)C2=O)NCC(NO1)=NC1=O,1 F5596-0800,O=C(c1cscc1)N(CC1)CCC1c1nnc(C2CC2)o1,1 Z1767655045,O=C(Cc1cscc1)N(CCC1)CCN1C(C1CC1)=O,1 F5484-0041,CN1N(CC(N(CC2)CCN2c2ccccc2)=O)c(nc(cc2)-c3cccs3)c2C1=O,1 Y041-4598,O=C(Cn(cc1)c(cc2)c1cc2Br)NC(CC1)CS1(=O)=O,0 F6445-6699,CSc1ccc(CCC(NCc(cccc2)c2-c2cscc2)=O)cc1,0 F0674-0100,O=C(CSc1ncnc2ccccc12)N(C(C1)c(cc2)ccc2F)N=C1c1cccs1,1 Z1284037400,O=C(NCc(cc1)cc(F)c1Oc(cccc1)c1F)N(CC1)CCC1N(CCN1)C1=O,1 Z4445382203,COC(C(Cc1ccccc1)NC(c1c(cn[nH]2)c2ccc1)=O)=O,0 Y206-8244,CCc1noc(C)c1C(Nc1c(C(N)=O)c(CCC(C)C2)c2s1)=O,0 F0674-0116,FC(c1cccc(CSc2ncnc3ccccc23)c1)(F)F,0 Z1739192682,CC(C(O)=O)N(CCNC(C)=O)S(c(cc(C(F)(F)F)cc1)c1Cl)(=O)=O,0 SB32-0111,Cc1n[nH]c([C@@H]2[C@@H](COC)CN(Cc3c[nH]nc3-c3ccc(C)cc3)C2)n1,0 Z3203820138,CC(C)N1N=C(C(N(C2)CC2C(N)=O)=O)c(cccc2)c2C1=O,1 Z1863721429,C#CCCCC(OC(Cn1cncc1)c(ccc(Cl)c1)c1Cl)=O,0 V022-8603,CCCC(CN(CCC(C)C)CC(N1)=Nc(scc2-c(cccc3)c3OC)c2C1=O)O,0 F6523-0271,Cc1nc(C(F)(F)F)cc(N(CC2)CCC2NS(Cc(cc2)ccc2Cl)(=O)=O)n1,1 S565-0879,Cn(c(CC1)c2CN1C(c1nn(C)c3c1cccc3)=O)nc2-c1nncn1CC1CC1,1 F5033-7508,COc(cccc1)c1NC(N1CCC(CNC(c2noc(-c3ccccc3)c2)=O)CC1)=O,1 S471-0626,CC(C(NC(CC1)CCN1c1cc(C(F)(F)F)nc(C)n1)=O)Oc1ccccc1,0 Z2370119380,CC(C)c(cc1)ccc1-c1noc(C(C)(C2CC2)O)n1,1 S985-0302,CC(C)C(N(C[C@@H]1CN(Cc2cn(C(C)C)nc2)C2)C[C@]12C(N1CCCC1)=O)=O,0 F6713-1832,Cc1c(CCC(N(CC2)CCC2N(C(C=C2)=O)N=C2n2nc(C)cc2C)=O)scc1,1 Z1603609487,CC(C(NC(C(O)=O)c(cc1)ccc1Cl)=O)c1c(C)n(C)nc1C,0 Z3173170481,CCCn1ncc(C(N(CC2C(O)=O)Cc3c2cccc3)=O)c1C,1 L507-1970,CC(c(cc1)ccc1NS(c1c(C)n(C)c(-c2nc(C)c(C(N3CCCC3)=O)s2)c1)(=O)=O)=O,0 F6764-1443,N#Cc(cccc1)c1S(N(CC1)CCC1c1nc2ncccc2cc1)(=O)=O,0 D455-0908,COc(cc1)ccc1-c1c(C(NCc2ccco2)=O)n(CCS2(=O)=O)c2n1,1 8012-6090,CCOc(cc1)ccc1N(C(CC1NCCc(cc2)cc(OCC)c2OCC)=O)C1=O,0 F6389-0392,O=C(c1nccc(-n2cccc2)c1)Nc1cnccc1,1 4241-0013,O=C1NC(c(cc2)ccc2Cl)Nc2c1c(CCCC1)c1s2,0 Z768794168,Cc1cc(C(N(CC2)CCC2NC(Cc2ccccc2)=O)=O)c(C(NN2C)=O)c2n1,1 Z2870853544,C=C(CC1)CCC1C(N(CC1)CCN1c(cc1)ncc1F)=O,1 Z3144719576,CC[C@@H](c1nnc(N(C2)C3C2CCC3)n1CC(C)=C)O,0 V024-3864,Cc(ccc(N(C1CCN(Cc(cccc2)c2OC)CC1)S(c(cc1)ccc1F)(=O)=O)c1)c1F,0 T990-3850,O=C(c(cc1)ccc1Br)N(CC1)CCN1C(CCN1Cc2ncccc2)C1=O,1 SB59-0626,Cc1noc(C)c1CCC(N(C1)CC1(CN(Cc1ccccc1)C1)C1c1nncn1C)=O,1 F6808-9082,CCc1cnc(N(CC2)CCN2S(C2CC2)(=O)=O)nc1,1 Z1348925379,CC(C)(CCC1)C1NC(c(o1)ccc1S(NC)(=O)=O)=O,0 F6433-0307,O=C(CSc1ccncc1)Nc1ncnc(-n(cc2)c3c2cccc3)c1,1 Z2648130812,CC(c1nccn1C)NC(c1c(C)n(Cc(cc2)ccc2OC)nn1)=O,1 F6619-5583,C(CN(CC1)c2ncnc3c2nc[nH]3)N1c1ncncc1,0 F6573-6458,Cc1nn(C)c(C(N(CC2)CCC2(C2)C2(F)F)=O)c1,0 F6573-4700,Cc1c(C(NCc2cncc(C3CC3)c2)=O)n(cccc2)c2n1,1 D627-0311,Cc(cc1)c(C)cc1-c1cc(C(N(CC2)c3c2cccc3)=O)nn1C(CC1)CS1(=O)=O,1 F6230-0364,COc(ccc(F)c1)c1S(NCc1c(cccc2)n2nc1)(=O)=O,0 F897-1084,CCn(cc1)nc1C(N(CC1)CCN1S(c1c(C)n(C(C)C)nc1C)(=O)=O)=O,1 F6363-0556,COCC(N(CC1)CCN1c(cc1)nnc1-n1cccc1)=O,0 F5857-1577,Cc1c(C(CNC(COc(cccc2)c2F)=O)O)scc1,0 F6658-5865,N#Cc1cc(Cl)c(N2CCC(COc3ncnc(C4CC4)c3)CC2)nc1,1 Z1379391089,CN(C)c1ncnc(OC)c1NC(C1CCOCC1)=O,1 F6822-4759,CN(CCn1nccn1)Cc(ccc(Cl)c1)c1Cl,1 S787-0911,O=C(CCc1ccc(CC(CC2)CCN2C(C2CCC2)=O)cc1)NC1CC1,1 Y042-2429,O=C(C(c(cccc1)c1N1)=CC1=O)NC(c1nc(cccc2)c2[nH]1)c1ccccc1,1 Z1907963694,COc(cc(cc1)NC(C2C3C2CCC3)=O)c1C(O)=O,1 G229-0563,COc(cc1)cc(N(CC(C2)c3nc(-c4ccncc4)no3)C2=O)c1OC,0 L702-0291,CCN(C(CN(C(C=C1)=O)N=C1C(N(C(C)C1)c2c1cccc2)=O)=O)c1ccccc1,0 F3237-0429,CCOc(cc(C)c(C)c1)c1S(n1c(C(C)C)ncc1)(=O)=O,0 Z2721909517,CC1(COC)OCCN(Cc2cccc(C(O)=O)c2Cl)C1,0 Z3059977068,CCn(nc1)nc1C(N(C(C)C1)c(cc2)c1cc2Cl)=O,0 8013-2437,Cc1c(CCN(C(C2C3C4C=CC2C4)=O)C3=O)c(cccc2)c2[nH]1,1 SA93-0562,Cn1nc(C(N(CCC2)CC2(CCOC)C(N)=O)=O)c2c1cccc2,0 Z1695663928,CS(c(cc1)cnc1N1CCOCC1)(=O)=O,0 Z1549758973,CC(CN(CC1)CCC1NC(C1=C(C)C(C)=NN(C)C1=O)=O)=C,1 F6553-7302,O=S(c(cccc1)c1Br)(N(CC1)Cc2c1sc(Cl)c2)=O,0 F1318-0203,CN(C)C(Oc1c(cccc2OC(N(C)C)=O)c2ccc1)=O,0 F6560-5825,Cn1nccc1-c1cc(CNC(c(cc(cc2)Cl)c2OC)=O)cnc1,0 F6604-0575,CN(Cc(cc1)ccc1C#N)C(C1)CN1c(cc1)nn2c1nnc2,1 F1250-0180,O=C1N(Cc(ccc(Cl)c2)c2Cl)c(cccc2)c2N1,1 SA95-0527,Cc1cnc(C(CCC2)N2C(N(C)C)=O)n1Cc1cnccc1,1 F3398-2890,Cc1cccc(N(CC2)CCN2c(cc2)nnc2SCC(Nc(ccc(OC)c2)c2OC)=O)c1,0 F1118-0366,Cc1ccc(CCC(Nc(cc2)ccc2SC(F)F)=O)o1,0 D757-0115,CS(c(cc1)cc2c1nc(NC([C@H]1CC[C@H](CN(Cc3c4cccc3)C4=O)CC1)=O)s2)(=O)=O,1 Z2903921935,OC([C@@H]1[C@H](C2)[C@@H]1CCN2C([C@@H]1[C@@H](CC2)C=C[C@@H]2C1)=O)=O,1 F6791-7639,O=C(CN1C(CC2)CCN2c(nc2)ncc2F)N(CC(F)(F)F)C1=O,0 F6209-0003,COC(NCCCn1c(-c2ccccc2)ncc1)=O,0 SA57-0345,O=C(c1cc(Br)cnc1)N(CC1)CCC1(C1)OCCC1Oc1nccnc1,0 F6556-0637,OC(CNC(C(Oc1c2cccc1)=CC2=O)=O)(CSC1)c2c1cccc2,1 F6560-5458,CC(N=CN1CC(NCc2cncc(-c3cn(C)nc3)c2)=O)=CC1=O,1 F2751-0884,CCN(CC)S(CCNC(c(cc1)cc2c1OCO2)=O)(=O)=O,0 F6559-5248,OC(C(C1)C2(CCC2)CN1c1c(C(F)(F)F)cccn1)=O,1 F6619-6381,Cc1cc(N(CC2)CCN2c2ncnc(N(C)C)c2)nc(C)n1,0 Z1838422645,Cc1noc(CN(C=NC(C)=C2C)C2=O)n1,0 F372-2137,Cc(cc1)ccc1N(C)S(c(cc1)cc(CC2)c1N2C(NC1CCCCC1)=O)(=O)=O,0 Z367795292,CCN(C(CC1)CS1(=O)=O)C(C(CCC1)CN1C(c1ccc(C)cc1)=O)=O,1 F6473-8159,CCOc1c(CCC(N(CC2)CCC2OC(C=C(C)O2)=CC2=O)=O)cccc1,0 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F1706-0098,CCOC(c1cccc(NC(CN(C(C)=C2)c(c(C)ccc3)c3C2=O)=O)c1)=O,0 F6549-5706,Cc(n(C)nc1C)c1S(N(CC1)CCC1c1cncn1C)(=O)=O,1 Z1272496641,Cc1c(C(C2)OCCN2c2nc(-c3ccncc3)nc(C)c2C)cccc1,0 S997-0654,CS(N(C1)C[C@]2(CO)[C@H]1CN(Cc1ccncc1)CC2)(=O)=O,0 S637-2513,Cc1nnc(CC2)n1CCC2NC(c1ncncc1)=O,1 F6257-1771,O=C(c(c(F)ccc1)c1Cl)Nc1ncnc(N2CCOCC2)c1,1 Z1317957178,CC(C)c1c(-c2ccccc2)nc(C2N(CC(NCC3CC3)=O)CCC2)o1,1 F6726-0500,Cc1cc(C)nn1-c1cc(OCC(CC2)CCN2S(c2cn(C)c(C)n2)(=O)=O)ncn1,1 F5222-0092,O=C(c1nccnc1)NCC1(CCCC1)c1cccs1,1 F6436-2574,O=C(Cc(c(F)ccc1)c1Cl)NCC(CC1)CCN1C(Oc1ccccc1)=O,0 Z2377632040,CC(Cc1cc2ccccc2cc1)NC(c1c[nH]nc1C1CNCCC1)=O,1 Y010-1324,Cc(cc1)cc(Br)c1N(C(CC1Cc(cc2)ccc2Cl)=O)C1=O,0 F6482-6172,O=C(NCc(cc1)cc2c1OCO2)NCc1cc(-c2ccncc2)ncc1,1 Y021-0690,CCc(c(-c(cc1)ccc1Cl)c1nc2)nn1c(C=CN1C3CC3)c2C1=O,0 Z1172222792,NC(C(CC1)CN1c(cc1)c(C(F)(F)F)cc1S(N)(=O)=O)=O,0 8012-6126,NC(CNC(C(CCC1)c2c1c(cc(cc1)Cl)c1[nH]2)=O)=O,0 F6597-0792,Cc1cccnc1OCC1CCN(Cc2nnco2)CC1,0 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Z1011682198,O=C(Nc(cc1OCCOc1c1)c1Sc1ccccc1)N1CCCC1,1 S699-0356,CN(CCc1noc(C(C2)CN2C(CCCc2ccccc2)=O)n1)C(C1CC1)=O,1 G373-2842,COc(ccc(NC(NCCn1nnc2c1ccc(S(N1CCCC1)(=O)=O)c2)=O)c1)c1OC,0 F6279-0033,CC(Cc1ccco1)NC(NC1(CC(C2)C3)CC3CC2C1)=O,1 F6496-1605,COc(cccc1)c1NC(NCc1ncnc(C2CC2)c1)=O,1 Z2926095501,Cc1c(cc(cc2)NC([C@@H](CCC3)NC3=O)=O)c2nc(C)c1,1 G802-1025,COc(cc1)cc2c1[nH]cc2C(CSc1nnc2n1C=CN(c(cc1)cc(F)c1F)C2=O)=O,0 Z2230723793,CCn1c(NC(c2cc(NC(C3CC3)=O)ncc2)=O)nc2c1nccc2,1 Z1559532691,C[C@@H](c(ccc(F)c1)c1OC(F)F)NC(c(cc1)cc2c1ncs2)=O,0 F258-1241,CN(CCc1noc(COc(cccc2)c2F)n1)S(c1cc(CCCC2)c2cc1)(=O)=O,1 S729-0255,OCCC(CC1)(CN1c1ncccn1)C(NCc(cc1)ccc1F)=O,0 Z852300940,O=C(C(CC1)CCN1C(C(CCC1)CN1C(c(cc1)ccc1F)=O)=O)N(CC1)c2c1cccc2,1 Z2975230413,CC(C)Cc1c(CNC(NC2C3(CCOCC3)OCC2)=O)cccc1,1 F6752-7577,CC(C)(C)NC(C(CC1)CN1c1ncc(C)s1)=O,0 F2679-0098,Cc1ccc(COc2cccc3c2CCNC3=O)cc1,1 F632-1265,O=C(C(CCC1)N1S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O)N(CC1)Cc2c1cccc2,1 C200-4823,Cc(cc1)cc2c1OCCN2C(CN(CCCN1Cc2ccccc2)S1(=O)=O)=O,0 Z2914990655,CN(C(CCC1)C(N(CC2)CCC2c2nccc(-c3cccc(F)c3)n2)=O)C1=O,1 F6523-1066,CN(C(C=C1)=O)N=C1C(N(CC1)CCN1c1nccn2nc(CCCC3)c3c12)=O,1 S904-1287,CC(C)C(N1Cc2nnc([C@H](C3)N(CC4CC4)C[C@H]3O)n2CC1)=O,1 1988-1142,O=C(C1Oc(cccc2)c2OC1)Nc(ccc(Cl)c1)c1C(c1ccccc1)=O,1 Z2177802042,COc(cccc1)c1C(NCC(N(CCCC1)C1c1nnc(C2CCC2)o1)=O)=O,1 S988-0468,CCS(N(C[C@@H]1CN(C2)C(c3cnccc3)=O)C[C@@]12c1nc(C)no1)(=O)=O,0 J015-0234,O=C(c(nc(cc1)-n2cnnc2)c1Br)Nc(cc(C(F)(F)F)cc1)c1N1CCOCC1,1 F5626-0068,CCNc1cc(NCCNC(c(o2)ccc2Br)=O)nc(C)n1,1 F6539-3330,Cc1cc(S(NCc(cc2)ccc2-c2cocc2)(=O)=O)c(C)cc1,0 F6546-1702,CC(C)(C)C(C=C1)=NN(Cc2nc(CCC3)c3s2)C1=O,1 8012-1894,CCOc(cc1)ccc1S(N(CC1)CC(C)N1S(c(cc1)ccc1OCC)(=O)=O)(=O)=O,0 F6668-2839,Cn(c(C(N1CCC(COc2ncccn2)CC1)=O)c1)nc1-c(cc1)ccc1F,1 S544-1217,O=C(C(CC1)CCN1S(N1CCOCC1)(=O)=O)N1CC(CCOc(cc2)ccc2F)CC1,0 Z509169724,CC(C1)OC(C)CN1c(cc1)ncc1C(Nc(cccn1)c1OC)=O,0 F6454-3003,O=C(C(Nc(cccc1)c1Cl)=O)NCC(CC1)CCN1C1CCSCC1,0 F6562-8901,O=C(Cc(ccc(F)c1)c1F)NCc1nccnc1-c1cscc1,0 SA17-0116,CC(C)CN([C@@H](C)[C@H](CC1)C(N(CC2)c3c2cccc3)=O)C1=O,0 J501-0139,Cc1noc(C)c1Cc1ccc(C(N(CC2)CCC2Nc2nccnc2OC)=O)o1,1 E864-0468,O=C(NC1CCCC1)N(CCc1c2[nH]c(cc3)c1cc3Cl)C2c(cc1)ccc1F,0 Z1129744663,O=C(Cc1c[nH]c2c1ccc(Cl)c2)NCC1(CCOCC1)N1CCCC1,0 Z2060698645,CC(C)(c1nc(C)no1)NC(c(ncc(F)c1)c1F)=O,0 P349-0427,CC(c1c(C)cc(C)cc1)NC(CCNc1c(C)nc2n1ccnc2)=O,1 T502-0766,CCOc1c(CN(CC2)CCC2(C(NC2CC2)=O)F)cccc1,0 F3230-0242,COc(cc1)ccc1NC(N(c1ccccc1)c1ccccc1)=O,0 F6475-2911,COCCOc1nccc(C(N(CCCC2)C2C(OC)=O)=O)c1,0 S740-0672,CC(C)CN(C([C@H](C[C@@H](C1)NC(c2nn(C)cc2)=O)N1CC1)=O)S1(=O)=O,0 Z1743898392,CCn1c(ncnc2Nc3nn(Cc(cc4)ccc4OC)cc3)c2nc1,1 Z2361647703,COc(cc1)cc(Cl)c1S(NCC(C(O)=O)O)(=O)=O,0 S614-0820,O=S(c(cc1)cc2c1OCCO2)(N(CCCC1)C1c1nc(CCOCC2CC2)no1)=O,1 F5857-5514,Cc(c(S(NCC(CC1)(c2c1cccc2)O)(=O)=O)ccc1)c1Cl,0 SB21-0173,CC(C)NC(c1cn(C[C@H](C[C@@H](C2)F)N2C(N2CCOCC2)=O)nn1)=O,0 F5097-2581,CC(C)(C(Nc1ccc(CC(NCC(F)(F)F)=O)cc1)=O)Oc(cc1)ccc1Cl,0 SC04-0426,CNC(N(CCC1)CC1OCCc1noc(C2CCOCC2)n1)=O,0 Z1155386104,Cc(nccc1)c1C(N(CC1)CCN1c1ncnc2c1cnn2C)=O,1 C597-0206,O=C(C(Cc1ccccc1)NS(c(cc1)cc(CC2)c1NC2=O)(=O)=O)NCC1Oc(cccc2)c2OC1,1 F6356-0220,O=C(c(cc1)ccc1OC(F)(F)F)NCCc1cocc1,0 F6573-2742,O=C(c1nn(-c2ccccc2)nc1)NCCOCCn1nccc1,1 Z2296071871,OC(c1cn(C(CC2)CCN2C(c2nccc3ccccc23)=O)nc1)=O,1 Z4028438393,COc1cc(C(CC2)CN2C(C(O)=O)c(ccc(F)c2)c2Cl)cc(F)c1F,0 F6658-5741,O=S(c(cc1)cc2c1OCC2)(N1CCC(COc2ncnc(C3CC3)c2)CC1)=O,1 Z3651347772,CC1(C)C(CC(N(CCC2)CC2(N2)OC(C)(C)C2=O)=O)OCC1,1 T955-1159,CC(C)NC(N(CCC1)CC1c1nc(CCOCC2CCOCC2)no1)=O,0 SC04-0848,COCc1nc(CCOC(CCC2)CN2S(c2cc(F)ccc2)(=O)=O)no1,0 Z4422584821,COc(ccc(-c1nc(CC(N2CC(CN)C2)=O)cs1)c1)c1OC,1 F6806-7571,O=C(C1CN(Cc2cncs2)CCC1)N(CC1)CCC1(F)F,1 F0007-0795,O=C(c1cc(Cl)cc(Cl)c1)Nc(ccc(F)c1)c1F,0 E684-0630,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(N(CC1)CCC1C(Nc(cc1)cc(C)c1Br)=O)(=O)=O,0 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S974-2191,C[C@@H]1N(Cc2cc([nH]cc3)c3cc2)C[C@H](C[C@@H](C2)N(C)C)N2C1=O,1 Z1602207343,C[C@@H](CN(CC1)C(c2cnns2)=O)N1S(C)(=O)=O,0 Z1134133852,CCOC(N(CC1)CCN1c1nc(-c2ccncc2)nc(C)c1C)=O,0 S988-0176,Cc1noc([C@@](CN(C2)C3CCOCC3)(C3)[C@@H]2CN3C(c2ccccc2)=O)n1,0 F6277-0367,O=C(NCc(cc1)ccc1F)N(CC1)CCN1c1nc(c(C(F)(F)F)ccc2)c2s1,0 F5831-1866,CC(Cc1ccco1)NC(CCCc1ccccc1)=O,1 F233-0036,CC(C1)N(C(C(C(OC)=C2)=NN(c3ccccc3)C2=O)=O)c2c1cccc2,0 F6451-1426,COC(CNC(C(NCc1ccco1)=O)=O)c1cccc(F)c1,0 Z2442605520,OC(c(nc1)cnc1C(N(CC1)CCC1c(cc1)ccc1F)=O)=O,0 M626-0052,O=C(Cc(cc1)ccc1Cl)NCc(cc1)cnc1N1CCCC1,1 F6556-5450,Cc(cccc1)c1OCC(N(CCC1)CCN1C1COCC1)=O,1 Z2044388526,COCC1(CCC1)C(Nc1ncc(C(F)(F)F)s1)=O,0 F2669-0139,CN(c(cccc1)c1C(OC)=O)S(c(cc1CCC2)cc(CC3)c1N2C3=O)(=O)=O,0 Y500-4621,Cc1nn(CC(N2CCCC2)=O)c2nc(C3CC3)cc(C(F)(F)F)c12,1 Z3363306927,CCCN(C)CC(Nc1nscc1)=O,0 Z1683758846,O=C(CCC1)N1c1cccc(-c2noc(C(CC3=O)CN3c(cccc3)c3Cl)n2)c1,1 F2713-0203,CC1=NN=C(Nc(cc(cc2)OC)c2OC)NC1=O,0 Z4142366170,COC(C(Nc(cc1)nn1-c(nccc1)c1Cl)=O)c(cccc1)c1OC,0 F6215-0249,CC(C)S(c1ccc(CC(NCCc2cc(C)no2)=O)cc1)(=O)=O,1 Z1569725890,Cc(nc1CN(CC(c2cccc(OC)c2)O)Cc2ccccc2)ccc1O,0 F6445-6868,COc(cccc1)c1-c1n[nH]c(C(NCc(cccc2)c2-c2cscc2)=O)c1,0 SB91-0196,O=C(C1CC1)N(CCN1CCCCC1)C(CC1)CN1C(C1CCCCC1)=O,1 Z3173685554,OC(C(C1)CN1C(C(CCCC1)C1c1nc(cccc2)c2s1)=O)=O,1 F6812-1360,Cn1ncc2c1ncnc2N(CC1)CCN1c1nc(-c2ncccc2)ccn1,1 Z3019400579,O=C([C@H]1NCCOC1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1,0 Z3134063377,O=C(C(C1)C2C1CCC2)Nc1cnc(N2CCNCC2)nc1,1 SB42-1148,CC(C)C[C@@H](C(N(CCOC)C[C@@H]1CN2CC(N(CC3)CCS3(=O)=O)=O)=O)N1C2=O,1 V026-1646,CCC(C)N(Cc(cc(cc1)NC(C2CCCC2)=O)c1N(C)C)C(c1cc(C)ccc1)=O,1 F6791-9179,CCc1nnc(C(CC2)CCN2c2nc(C(F)(F)F)ccn2)s1,0 Y031-7266,CC(C)(C)C(N(CCC1)CC1C(NC1CCCCC1)=O)=O,1 Z3687061528,CN(CC1)CCN1c1cccc(C(N[C@@H](CC(Cn2cncc2)C2)[C@H]2O)=O)n1,1 F6679-2546,Cc1noc(C)c1S(N(CC1)CC1Oc(ccnc1)c1Br)(=O)=O,1 F6561-5853,Cn1ncc(-c2nccc(CNC(c3noc(C4CC4)c3)=O)c2)c1,1 F6556-2743,OC1(CNC(CCc2ccc(C(F)(F)F)cc2)=O)COCC1,0 Z3951277772,N#Cc1ccc(C(CC2)CCN2C(c2cc(Cl)cc(Cl)c2)=O)cc1,0 F6526-1344,O=C(c1nn(-c2ccccc2)nc1)N(CCn(cc1)nc1-c1ccncc1)C1CCCC1,1 SA24-0132,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(CCc1c[nH]c2c1cccc2)=O,0 F6608-3067,NC(CCC1)C1Oc(cc1)ncc1Br,0 G632-2054,CC(C)CC(C(Nc1cc(Cl)c(C)cc1)=O)NS(c(cc1)cc(C=C2)c1NC2=O)(=O)=O,0 F6806-6889,O=C(C(C1)OCCN1c(ncc(C(F)(F)F)c1)c1Br)NC1CC1,0 SC10-0872,CS(N(CCCN1CCCC1)C(CC1)CN1C(c(cc1)ncc1F)=O)(=O)=O,1 F755-0186,CSc1ccc(CNC(c2ccc(CN(C3=O)c4ncccc4-n4c3ccc4)o2)=O)cc1,0 P890-2062,O=C(CCC1CCCC1)NC1(CCCCC1)c1nc(-c2cnccc2)no1,1 F2758-3022,O=C(NCC(c1c2cccc1)=NN(CCN1CCCC1)C2=O)Nc(c(F)ccc1)c1F,1 E760-0452,Cc1nc2cccnc2n1-c(cc1)ccc1C(NCCC1=CCCCC1)=O,1 Z1993909665,CC1(CNS(c(cc2)cc(F)c2OC)(=O)=O)CCNCC1,0 F6200-1449,OC(Cc1ccccc1)CNC(Nc(cc1)ccc1F)=O,0 Z4027483096,CCOc1ccc([C@@H](C)Nc(cc2)ncc2S(N(C)C)(=O)=O)cc1,0 8017-1298,O=C(COc(cc1)ccc1Cl)Nc(cc1)cc2c1n(CCN(Cc1ccco1)C1)c1n2,1 SB75-1289,CCS(N[C@H](C[C@H]1CN(C2)C(c3n[nH]cc3)=O)C[C@]12c1nc(C)no1)(=O)=O,1 F6609-5449,Cc(cc(cc1)-n2nnc(C(NCC3OCCC3)=O)c2)c1F,0 S654-0047,Cc1noc(C(C2)N(C)CC2(CC2)CCN2C(c2cscc2)=O)n1,1 F6783-6712,CCn1c(N2CC(CN(C3)C(c4noc(C)c4)=O)C3C2)nc2c1cccc2,1 F6200-3681,CS(NCC(C1CC1)(c1ccccc1)O)(=O)=O,0 Z226225328,O=C(c1n[nH]c(-c2ccccc2)c1)NCc(cc1)cnc1N1CCOCC1,1 F6560-8297,Cn1ncc(-c2ncc(CNC(N3CCCCC3)=O)cc2)c1,1 F6192-0979,COc(ccc(Cl)c1)c1NC(NCC(c1ccco1)c1cccs1)=O,0 F6436-0210,CC(N(CC1)Cc2c1ccc(NC(c1c(C)onc1)=O)c2)=O,1 E644-0117,CC(CCC1)C(C)C1NC(c(cc1)ccc1-n1c(CCCC2)c2cc1C)=O,1 Z970581214,Cc1c(C)oc(-c(cc2)ccc2NC(c2cc3cccnc3cc2)=O)n1,1 F6474-3845,O=C(Nc(cc1)cc(Cl)c1Cl)N(CC1)CCC1Oc1cccc2cccnc12,1 Z1579323341,CC(C(c(cc1)ccc1OC)OC)NC(NCc(cc1)cnc1-n1cncc1)=O,0 SA45-0183,CN(C)C(C1N(C)CCCC1(CC1)CCN1S(c1cccc2nsnc12)(=O)=O)=O,1 SB32-0695,CC(C)S(N(C[C@@H]1COC)C[C@@H]1c1nc(C2CC2)n[nH]1)(=O)=O,0 Z3043050068,Cn1nccc1[C@H](CN(C1)C(CNc2cccc(C(F)(F)F)c2)=O)[C@@H]1N,1 F6730-4471,O=C(c1ncnc2c1CCCC2)Nc1nc(-c2ncccc2)cs1,1 V028-2099,CC(CN(CC1)c2cc(Oc(ccc(F)c3)c3Cl)ncn2)N1C(CCC1CCCC1)=O,1 F6514-2848,O=C(c1cc(cc(cc2)F)c2s1)N(C1)CC1OCC(F)(F)F,0 F2036-0167,O=S(c1cc(CCCC2)c2cc1)(Nc(cc1)cc(N(CCC2)S2(=O)=O)c1Cl)=O,0 Z934009064,Cc1cc(CNC(N(C)CC2CCCC2)=O)no1,1 F6438-3060,COc1nc(CNC(Cc2cccc(C(F)(F)F)c2)=O)nc(OC)n1,0 Y042-3387,COc(ccc(CCN(CC(C1)C(Nc2n[nH]cn2)=O)C1=O)c1)c1OC,1 F6680-2930,O=C(CN(CC(CC1)CCS1(=O)=O)CC1)N1c1cc(C(F)(F)F)ncc1,0 Y031-1890,CCC(Nc(cc1)ccc1C(N1CC(C)CC(C)C1)=O)=O,0 Z3215989348,O=C([C@@H](C1)[C@H]1C(F)F)N(CC1)CCN1c1cc(-c2cnccc2)n[nH]1,1 Z2791735076,CC(C)C(C(C)(C)C(O)=O)NC(C1CC=CC1)=O,0 Z1906237951,CC(C)CC(CO)(CCC1)N1C(NCc(nccc1)c1S(C)(=O)=O)=O,0 Z2709480862,O=C([C@@H](C1)[C@H]1c1cscc1)N(CCC1)CC1OC(F)F,1 Z1252874914,CCC(c(cc(cc1)F)c1F)NC(NC(CC1)CCN1C(C1CC1)=O)=O,0 Z2735135852,COc(cc1)ccc1C(C1)=NOC1C(Nc(ccc(F)c1)c1F)=O,0 Z3212212246,[O-]C(c1nnc(Cc(cccc2)c2Cl)o1)=O,0 F6518-4342,O=C(c1cc(Br)cs1)N(CC1)CC1c(cc1)cc2c1OCO2,1 F6517-1580,Cc1cc(C(NCC(c2ccc(-c3ccco3)s2)O)=O)c(C)o1,1 Z505511524,CN1CCN(CCNC(c2cc(NC(C(C3)Oc4c3cccc4)=O)ccc2)=O)CC1,1 F763-0357,Cc(cc(cc1)NC(N(CCN2C)c3c2nccc3)=O)c1Br,0 F6519-5770,O=C(c(ccc(F)c1)c1Cl)NCC(c1ccco1)n1nccc1,0 Z2368579647,NCCC(CCC1)CN1c1nc(-c2ccccc2)ns1,0 Z2872704029,CC(C1)CC1C(NC(C)(C)c1ncccn1)=O,1 Z2849708494,Cc1cc(C(NCCc2ccns2)=O)cc(C)c1,0 F5501-0110,CN(C(C(CCC1)CN1S(C)(=O)=O)=NN1CC(N2CCCC2)=O)C1=O,1 F6562-1874,O=C(c1cc(cc(cc2)F)c2s1)NCc1cncc(N(CCC2)C2=O)c1,1 Z2193702492,Cc1c(C)ncn1-c(cc1)ccc1NC(C1=C(C)C=C(C)NC1=O)=O,0 Y600-2788,CN(c1c(C(N2C)=O)[nH]c(N(CC3)CCN3c3cccc(Cl)c3)n1)C2=O,0 F2773-0318,O=C(C=C1)N(Cc(cc(cc2)F)c2F)N=C1c1ccco1,1 V004-3486,CC(C)N(CCC(Nc(cc1)ccc1OC)=O)c1c(ccc(Cl)c2)c2nc(C2CC2)n1,1 T158-0771,CCNC(N(CC1)CC1c1ncc(C)n1C(C)C)=O,0 Z4990979320,C[C@H](CC1)CC[C@@H]1NC(c(cccc1)c1SCc1nn(C)cc1)=O,1 F3131-0001,Cc(ccc(C(Nc(cccc1)c1OC(F)F)=O)c1)c1S(N1CCCC1)(=O)=O,0 Z4898416143,CCOc(ccc(-c1cn(C(C2)CN2C(CC2CC2)=O)nn1)c1)c1F,1 Z1857135317,Cc(s1)ncc1S(NC(C1(CCCC1)OC)=O)(=O)=O,1 Z1944114340,CN(CC(CC1)NC(c(nccc2)c2Br)=O)C1=O,0 G801-0379,Cc1cc(N(CC2)CCN2S(c(cc2N3C)c(C)cc2N(C)C3=O)(=O)=O)c(C)cc1,0 F6438-2069,COc(nc(nc1)OC)c1NC(c1ncccc1)=O,0 F6515-1221,CSc1ccc(CCC(NCc2cc(-c3ccco3)ncc2)=O)cc1,0 F6436-1950,O=C(c(cc1)cc2c1ncs2)N(CCc1cccs1)C1CC1,1 F6729-7535,CN(Cc1c(CCC2)c2nn1C)C(C1)CN1c(cc1)nnc1-c(cc1)ccc1F,1 Z910155308,O=C(NCc(cccc1)c1N1CCOCC1)N1CCOCC1,1 F6764-1534,CC(C)c1noc(CN(CC2)CCC2c2ccc(cc(cn3)Cl)c3n2)n1,1 S993-1039,COc1ccc(C2(CC2)C(N(CCC2C(N(Cc3ccccc3)C3)=O)CCN2C3=O)=O)cc1,0 Z3313541359,CC(C)CN(CC1CCN(C)CC1)CC(c1c2cccc1)=CNC2=O,1 Z1942258677,CC(CCC1)(CN1C(NCC1CN(Cc2ccccc2)CC1)=O)O,1 F3411-7418,O=C(CN(C1=O)N=C2N1c(cccc1)c1N=C2N1CCOCC1)NCc(cc1)ccc1F,1 F6245-5305,COCCN1N=C(C(CCC2)CN2C(C2CC=CCC2)=O)N(C2CC2)C1=O,1 Z2595760538,OC([C@H](C1)C[C@@H]1NC(c1c(c(Cl)ccc2)n2nc1)=O)=O,1 S687-1182,O=C(C1(CC1)c1ccccc1)N(CC1)CCC11OCCC(Cc2nc(-c3ccncc3)no2)C1,1 F6734-0715,CN(C(C=C(N1)N2CC(CN(C3)c(cc4)ncc4Cl)C3C2)=O)C1=O,1 8563-0896,O=C(CC(C(NCC1)=O)N1C(c1ccco1)=O)N(CC1)CCN1c1ccccc1,1 F6658-6188,Cc1cc(OCC(CC2)CCN2C(Cn(cc2)c3c2cccc3)=O)ncn1,1 SC13-0630,CCn1nc(C)c(CN(CCC2)CC2N(Cc2cnccc2)S(C)(=O)=O)c1,1 SB70-0849,O=C(C1(CCCC1)c1ccccc1)N[C@@H](Cc1c2)Cn1nc2C(NCc1ccccc1)=O,1 F6523-4629,Cc1c(C(NC(CC2)CCN2c2nnc(CCCC3)c3c2)=O)sc(C)n1,1 F6042-0413,Cc1cnc(-n2nnc(C(N(CC3)CCN3c3cc(C(F)(F)F)ccc3)=O)c2C)s1,1 8602-0194,CC(C(C(C(F)(F)F)(C1=O)NC(CCc2ccccc2)=O)=C(C)N1c1ccc(C)cc1)=O,1 SD54-0262,O=C(C(CC1)CCc2c1c(OCC1CC1)nc(-c1ccccc1)n2)NCCC1CCOCC1,1 F6564-4655,CSc(cccc1)c1NC(C(CC1)CCN1c1nnc(C2CC2)cc1)=O,0 F6549-5466,Cn1c(C(CC2)CCN2C(CN2N=CC=CC2=O)=O)cnc1,1 L310-0464,CCc1nc(CN(C(COc2c3)=O)c2cc(Cl)c3S(N2CCC(C)CC2)(=O)=O)no1,1 F6753-1231,Cc1nc(CN2CC(C(N3CCOCC3)=O)OCC2)no1,1 Z1272570471,CCN(CC(F)(F)F)C(C(CCC1)CN1c1ncccc1C#N)=O,0 F6782-4773,Cc1cc(N(C(N(CC2COCCC2)c2c3cccc2)=O)S3(=O)=O)c(C)cc1,1 F2320-0029,O=C(c(cccc1)c1F)Nc(cc1)ccc1Nc(cc1)nnc1-n1nccc1,0 Z2762265888,CO[C@@H](C[C@H]1CNC(Cc2cc3ccncc3cc2)=O)CN1c1ncncc1,1 F3395-1067,Cc1c(C(N(CC2)CCC2N(CC2)CCN2c(ncc(C(F)(F)F)c2)c2Cl)=O)snn1,1 F5033-3421,COC(N1CCC(CNC(CSCc2ccccc2)=O)CC1)=O,0 F6617-2081,Fc1cccc(Cl)c1Cn1nnc(C2CC2)c1,0 Z2496862091,CCCN(CCC)C(NCc1noc2c1cccc2)=O,0 Z3410095765,CC(C)c1nc(cc(cc2)NC(c3cc(Oc4ncccc4)ccc3)=O)c2o1,1 Z1783861957,CC(c1noc(C(C2)(Cc3c2cccc3)O)n1)c(cc1)ccc1Br,0 Z2406087895,COC(CC1)(CCN1S(c1cocc1)(=O)=O)C(O)=O,0 Z3570509256,C[C@H](C1)O[C@@H](C[C@H]2C(O)=O)[C@H]1N2C(OC1CCCC1)=O,0 Z1563285044,Cc(cccc1)c1C(NC(CC1)CCN1C(c(nc1)nn1-c1ccccc1)=O)=O,1 Z3338192719,CC(C)(C)c(cc1)ncc1S(N(CCO)c1ccccc1)(=O)=O,0 Z1958773582,O=C(c(c1ccccc11)ccc1F)N(CC1)CC1(c(cccc1)c1N1)C1=O,0 F6806-6785,O=C(C(C1)OCCN1c(ncnc1)c1F)N(CC1)CCC1(F)F,0 F6734-1393,O=C(c1n[nH]c2c1cccc2)N(C1)CC(C2)C1CN2c(cc1)ncc1F,0 Z1097580964,NC(NCCC(N(CC1)CC1Nc1ccccc1)=O)=O,0 F5882-5372,COc(cc1)ccc1OCc1noc(CNC(c2c(C(F)(F)F)cccc2)=O)n1,0 Z4872562721,CC(C(Nc(cc(cc1)Oc2ccccc2)c1O)=O)N(C(C1(CCCC1)N1)=O)C1=O,1 Z2595629912,Cc1c(C)cc([C@@H](C2)[C@H]2C(N(CCC2)CC2n2nnc(C(O)=O)c2)=O)cc1,1 F3243-0125,Cn1c(cccc2)c2nc1C(CC1=O)CN1c(cc1)ccc1Cl,0 S649-1350,COC(C1)C2(CCOCC2)N1C(CC1)CCN1C(c1ccco1)=O,1 F6726-0622,Cc1cc(C)nn1-c1cc(OCC(CC2)CCN2C(c2cn(C)cn2)=O)ncn1,1 Z2914489907,CCC(C)(C1CC1)NC(c1cncc2c1[nH]c(C(F)(F)F)n2)=O,1 Z2374221018,Cc1cccc(S(NC(C2CC(C3)C3CC2)=O)(=O)=O)c1,0 F2645-0021,CSc(cccc1)c1-c1nnc(NC(c(ccc(Cl)c2)c2Cl)=O)o1,0 Z1421006566,CC(C)(CC1NC(c2csc(-c3cn(C)nc3)n2)=O)Oc2c1cccc2,1 Z1739066896,OC(c1ccc(CN(CC2)CCN2S(Cc2ccccc2)(=O)=O)cc1)=O,1 Z4579754247,O=C(c1ccccc1)N(CCC1)CC1c(cc1)ccc1F,0 Z2376774080,C1C(CC2)(CCN2c2c3sccc3ncc2)NC1,1 Z739440170,Cc1c(C(NCc2nc(C)ncc2)=O)sc(Cc2ccccc2)n1,0 Z3294676656,O=S(c(cc1)cc2c1OCC2)(N1c(ccnc2)c2N2CC1CC2)=O,1 F824-0096,CCc(cc1)ccc1NC(N(CC1)CCN1S(c(cc1)cc(N2)c1OC(C)C2=O)(=O)=O)=O,0 Y040-5967,O=C(c1cc(-c2ncccc2)nc2ccccc12)N(CC1)CCN1c1ncccc1,1 Z1422683538,Cn1ncc(C(Nc2cc(C(N(C)CC3)=O)c3cc2)=O)c1,0 F6562-0088,O=C(c1cc(C(F)(F)F)ccc1)NCc1cn(-c2cscc2)nn1,0 S582-0150,Cc(nc1)cnc1C(NCC(Cn1c2ccc1)N(C)C2=O)=O,0 F5834-2875,O=C(C1(CCOCC1)c1ccccc1)Nc1cc(CN(CC2)C(c3ccco3)=O)c2cc1,1 K410-0447,O=C(c(cc1)ccc1S(N1CCCCC1)(=O)=O)Nc1c(CS(C2)(=O)=O)c2nn1-c(cc1)ccc1Cl,1 Z1344108314,CCCOc(ccc(Cl)c1)c1C(NCCCC(NC)=O)=O,0 Z2982742448,O[C@H](Cn1nnc(CN(CCN2)CC2=O)c1)c(cc1)ccc1Cl,1 F6443-5045,COc1cccc2c1oc(C(N(CCC1)CC1(c1c3cccc1)OC3=O)=O)c2,1 F6609-4042,Cc(cc(cc1)OC)c1C(OCC(NCCc1ccccc1)=O)=O,0 Z1436303254,OC(C1(CCC1)NC(Cc(cc1)cc(F)c1F)=O)=O,0 Z2257007264,OC(CNC(CN(CC1)CCC1c1cccc2ccccc12)=O)=O,1 F3406-8933,CCOc(cccc1)c1NC(C(C(N(C)c1c2scc1)=O)=C2O)=O,0 SD61-0718,Cc1nccn1CC(N(C1)CC2(CCC2)C1C(NCC1CC1)=O)=O,1 S836-2989,COC[C@@H](CN(C1)C(Cc(cc2)ccc2OC)=O)[C@H]1C(N)=O,0 Z3388126598,CC1(CCC(N[C@@H](CN(C2)C([C@H](CC3)NC3=O)=O)[C@H]2c2cn(C)nc2)=O)CC1,1 F3385-3660,COc(cc1)cc(O)c1-c1n[nH]c(C(F)(F)F)c1-c(cc1)cc(OC)c1OC,0 Z1928251621,Cc1c(C)cc(C2(CNC(c3c[nH]nc3)=O)CCC2)cc1,1 G501-0034,CN(C)C(CNS(c1cc(CCCC2)c2cc1)(=O)=O)c(cc1)ccc1N(C)C,0 F070-1153,O=C(Nc(cccc1)c1Cl)N(CC1)CCN1c1nc2ccccc2nc1C(F)(F)F,0 Z3173245911,OC(c1c(C2CC2)nc(CNC([C@H](C[C@@H]23)C[C@@H]3C2(F)F)=O)cc1)=O,1 F6514-7056,CC(C)C(Cn1nccn1)NC(Cc(cc1)ccc1SC(C)C)=O,0 SB04-0612,Cc1ccc(CN(C)CCN(C(CC2)CN2C(N(C)C)=O)C2CCOCC2)s1,1 Z1518473985,Cc1ccnc(COC(c(cc2-c(cc3)ccc3OC)nn2-c2ccccc2)=O)n1,1 SB91-0595,Cc1cc(NC(N(CC2)CC2N(CCN2CCCC2)S(N(C)C)(=O)=O)=O)c(C)cc1,0 F6432-0210,COc(cc1)cc(C(Nc2ncnc(-n3ncnc3)c2)=O)c1Br,1 F5822-1078,O=C(COc(cccc1)c1F)N1CCC(Cn2c(-c3ccccc3)ncc2)CC1,1 Z4172627537,CCNS(c(cc1)nnc1NCCOCC)(=O)=O,0 Z1492364047,CC(CCC1)CN1C(C1Cc2cncn2CC1)=O,0 Z1944149022,Cc1cc(CC(Nc(cc2)cc3c2[nH]c(C(NC)=O)c3)=O)n[nH]1,1 F1616-0111,CCCc(c(C)c(c1nc(cccc2)c2n11)C#N)c1O,0 Z1620914118,CC(CN(C1)c2nc(OC)cc(C)n2)C1C(O)=O,0 F6808-2797,Cc1cccc(N(CC2)CCN2c(cc2)ccc2S(C)(=O)=O)c1C,0 F3406-0319,CCc1n[nH]c(S(Nc(cc2)cc(C)c2Br)(=O)=O)c1C(OC)=O,0 Z1317326404,CC(c(cc1)ccc1-c1ccncc1)NC(NCc1cc(-n2nccc2)ncc1)=O,1 F6559-1602,CC(C)n1nc(C)c(S(NC(CC2)CCC2(F)F)(=O)=O)c1C,0 F6435-7563,O=C(C1c(cccc2)c2Oc2c1cccc2)N(CC1)CC1S(Cc1ccco1)(=O)=O,1 F6448-0263,Cn(c(C(Nc1cn(CC2OCCCC2)nc1)=O)c1)nc1-c(cc1)ccc1F,1 Z2208129503,CN(CC1)CC1(CC1)CN1C(c1ccc(C2CC2)s1)=O,1 S509-1908,O=C1N(Cc2ccccc2)CCC(CC2)(CCN2S(c2cnccc2)(=O)=O)CC1,1 F6675-6802,Cc(cc1)cc(S(NC(C2)CN2c2nccc(C(F)(F)F)c2)(=O)=O)c1OC,1 D015-0186,CC(Nc(n1nc2C(F)(F)F)c2-c(cc2)ccc2Cl)=C(Cc2ccccc2)C1=O,1 SA46-0150,O=C(c1cc2cccnc2cc1)N(C1)CC1(C1)OCC1N1CCCC1,1 Z2000709807,CC(CC1)CN1C(N(CCC1)CC1C(N1CCCC1)=O)=O,0 Z2370678716,CCOC(C1)CN1S(c1c2OCCc2ccc1)(=O)=O,1 Z1539221486,CCc1ncnc(N(CC2)CCN2c2nccnc2)c1F,0 Z1177202534,COc1cccc(C(CNC(NCC2CN(Cc3ccccc3)CCC2)=O)O)c1,1 Z1602393482,CCC(CC)n(c(C)c1)nc1C(N(C)Cc1nnc[nH]1)=O,0 Z2370526270,CS(C(CC1)CN1c1nc(C2CCCCC2)ns1)(=O)=O,1 F6565-4975,C(C1)Cc2c1cc(N(CC1)CCN1c1ncccn1)nn2,1 G266-0540,CN(c(c(N1C)c2)cc(NC(Nc(cc3)cc(Cl)c3F)=O)c2N2CCOCC2)C1=O,0 Z1538690525,CCC1(CCOCC1)NC(c(cc(cc1)N(CCN2)C2=O)c1F)=O,1 M248-3587,O=C(Cc1cccs1)N1Cc(cc(cc2)C(N3CCOCC3)=O)c2OCC1,1 F6549-6726,COc(ccc(S(N1CC(Cn2nncc2)C1)(=O)=O)c1)c1F,0 F6796-3788,N#Cc1nc(N(CCC2)CCN2c(cc2)nn3c2ncc3)ncc1,1 Z2573693994,Oc1c(c(-c2ccccc2)cs2)c2nc(SCC(N2CCOCC2)=O)n1,1 Z1418679751,CC(C)(CN(CC1)CCN1C(NCC1CN(Cc2ccccc2)CCC1)=O)O,1 S981-0333,Cc1ccc(C(N(CC2)Cc3c2n(C)nc3NC(C2CC2)=O)=O)s1,0 Z3481136708,C#CCC[C@@H](C(O)=O)NS(c1cccs1)(=O)=O,0 Z2628362887,C(c1c(CCC2)n2nc1)N(CC1)CCC1c1ccco1,1 Z1733617441,O=C(Nc1ccnn1CC1CC1)N1CC(c(cc2)cc(Cl)c2Cl)OCC1,1 Z4280560127,O=C(Cc1csnc1)N(CC1)CCN1C1CC1,1 D568-0448,Cc(cc1)nc2c1oc(N(CC1)CCN1C(c(cc1)ccc1-c1noc(C3CC3)n1)=O)n2,1 F6482-3449,O=C(c1nccc2ccccc12)N(C1)CC1n1nccn1,1 Z2278284080,Cc(onc1N)c1S(N1Cc2cc(F)cc(Cl)c2CC1)(=O)=O,0 F6571-6152,OC1(CNC(c2cc(Br)cs2)=O)C=CCCC1,0 M445-0034,O=C(CCN(C1=O)C(N2CCCCC2)=Nc2c1scc2)N(CC1)CCN1C1CCCCC1,1 F6573-9021,O=C(CC1CC1)NCc1cncc(-c2cocc2)c1,1 Z1931215825,Cn1nc(C2COCCC2)cc1NC(N(CC1)CC1(F)F)=O,0 P734-2814,O=C(C(C(OCC1CC1)=C1)=C(CCCCC2)N2C1=O)NCCCn1nccc1,1 Z4261694533,CC(c1ccc(CNS(c(cc2)cc3c2OCCO3)(=O)=O)cc1)=O,0 F2236-0030,O=C(c(cccc1)c1Br)NCCN(C(C=C1)=O)N=C1c1ccccc1,0 Z4656798617,CC(c(c(Cl)c1OC)ccc1OC)N,0 F5083-0292,O=S(c(nc(-c1ccccc1)[nH]1)c1SCc1ncccc1)(c1ccccc1)=O,1 S976-1182,CCOc(cc1)ccc1NC(N(CCC1)CC1(C(NCC1CC1)=O)F)=O,1 Z3574374680,O=C(NCc(cc(cc1)Cl)c1Cl)N1Cc2nnc(C(F)(F)F)n2CC1,0 C259-1172,CCC(N(CCc1c2)c1cc(S(N(CCC1)CC1C(N(C(C)C1)c3c1cccc3)=O)(=O)=O)c2Br)=O,0 F6200-3619,OC(CNC(c(cccc1)c1Br)=O)(C1CC1)c1ccccc1,0 C276-1583,COc(cc1)cc(C(C2)CC(NC(CC3c4cc(O)ccc4)=O)=C3C2=O)c1OC,0 Z2217589783,O=C(c(scc1)c1F)N(CC1)CCN1C(CC1)CS1(=O)=O,0 Z1998403267,Cc(cc1)cc(S(NC(C2)CNC2=O)(=O)=O)c1OC,0 SC09-0394,C[C@@H](COc(cc1)c(C2)cc1-c1ccncc1)N2C(COc(cc1)ccc1F)=O,1 SC72-0593,O=S(c(ccc(F)c1)c1F)(N(C1)CC11OCc2c1cnc(-c1ccccc1)n2)=O,0 Y502-7518,CCn1nc(C)c(S(N(CC2)CCN2S(c2cn(C)nc2C)(=O)=O)(=O)=O)c1,0 SC54-0118,Cc1nnc([C@@](CN(C2)C3CCCC3)(CC3)[C@@H]2CN3C(c2ncncc2)=O)o1,1 Z905703534,CC(c1ncccc1)N(C)C(c1cc(Cl)nc(Cl)c1)=O,0 Z3016329002,CC(CN(CC1)CCN1S(c1cc(C#N)ccc1)(=O)=O)(F)F,0 F6810-0119,CN(c(ncnc1NCc(cc2)ccc2Cl)c1N1)C1=O,0 Z332906248,O=C(c1n[nH]c(C2CC2)c1)Nc1nncs1,1 F6548-2045,O=C(c1cccnc1N1Cc2cccc(Cl)c2)N(Cc(cc2)cc3c2OCO3)C1=O,1 F6677-1527,CCc1nccn1CC1CN(Cc2cccnc2)C1,1 Z434566678,COc(cccc1)c1-c1n[nH]c(C(NCC(F)(F)F)=O)c1,0 SB96-0127,CCn1ncc(C(N(CC2)CC2N(CCn2c(C)ncc2)S(C)(=O)=O)=O)c1,0 SA57-0281,CCOCC(N(CC1)CCC1(C1)OCCC1Oc1nccnc1)=O,1 F1915-2666,FC(Oc1cc(-c2ncccc2)ccc1)(F)F,0 SC65-0492,CC(C)CN(C[C@](C1)(C2)[C@H]1C(NCCc1cnccc1)=O)[C@@H]2C(NC)=O,1 Z2597401492,CC(C(O)=O)N(Cc1ncc(C)cc1)C1CCC1,1 Z1511070127,CC(C)(C1)OCCC1NC(C1=CN=C(C=CC(C)=C2)N2C1=O)=O,1 F6475-4189,CSc(cccc1)c1NC(c(cn1)cc(Cl)c1OC1CCOCC1)=O,0 Z4126488560,Cc1nc(-c(cc2)cc(F)c2Oc2ncc(C(OC)=O)nc2)cs1,0 F6445-5244,Cc(nc1)cnc1C(NCc(cc1)ccc1Oc1nccs1)=O,1 F6789-7922,Cc1noc(CN(CC2)CC2N(C)C(c2c3cccc2)=NS3(=O)=O)c1,1 F2725-1178,O=C(N(Cc1ccco1)C1=C2CCC1)N=C2SCc(c(F)ccc1)c1Cl,1 F6244-1043,CC(C)N(CC#CCNC(c1cc(N(C)C)ccc1)=O)C(C)C,0 F6215-0232,Cc1noc(CCNC(CSc(cc2)ccc2F)=O)c1,1 F6529-6871,Cc(cccc1)c1NC(N(CC1)CCC1N(CC(N1CCOC)=O)C1=O)=O,0 F6559-1727,Cn1cnc(S(N2CCN(CCF)CC2)(=O)=O)c1,0 F5503-0065,Cc(s1)ccc1S(N1CCN(CCN(C(C=C2)=O)N=C2c2ccccc2)CC1)(=O)=O,1 Z1171322107,CC(CCCC1)N1C(c1c(cccc2)n2nc1)=O,0 Z2483023072,CNC(CC1CCN(Cc(c(C(O)=O)ccc2)c2Cl)CC1)=O,0 L127-0535,CC(CN(CCS(N1CCNCC1)(=O)=O)S(c1cccs1)(=O)=O)c1ccccc1,1 F6744-6577,Cc1cnc(N(CC2)CCC2N(C)c2ncccc2)s1,0 SB27-0066,O=C(C1)NCC2(COCC2)N1C1CCN(Cc2ccc(C(F)(F)F)cc2)CC1,0 F6724-5389,Cn1ncc2c1ncnc2N(CC1)Cc2c1sc(Cl)c2,1 V029-2827,CN(C)c(cc1)c(CN(C2CCCCC2)C(c2ccco2)=O)cc1NC(C1CCC1)=O,1 D107-1041,CC(C)COc(cc1)ccc1C(Nc1c(CC(C)CC2)c2no1)=O,0 Z275546488,CCC(Nc1nc(cccc2)c2n1C)=O,0 S651-0697,CN(C)C(N1CCC(C2)(CN(C)C2C(N2CCOCC2)=O)CC1)=O,0 F6619-0788,OC(COC1)C1Oc(cc1)ccc1Br,1 F6497-0303,O=C(NCc(cc1)ccc1Cl)N1CC(Cc2nc(-c(cccc3)c3F)no2)CCC1,1 8020-4144,OC(C(C1)C(c(cc2)cc3c2OCCO3)OC1=O)=O,1 Z1971712207,Cc1cnc(CNCC(c(cccc2)c2F)O)o1,0 F2507-0698,FC(c1cccc(CSc2nnc(cc3)n2nc3-c2ncccc2)c1)(F)F,0 F6806-6690,N#Cc(cc1)ncc1N(CCC1)CC1NC(C1CC1)=O,1 Z3016339748,CC(C(C(OC)=O)Sc1nnc(-c2c(C)cccc2)n1C)=C,0 Z1449477177,Cc(cccc1)c1-c(n1CC=C)nnc1SCc1nccn1CC(F)(F)F,0 Z1689854168,CN(C(C(CCC1)N1C(Cc1ccccc1)=O)=O)c1nc(cccc2)c2n1C,1 Z2963063914,O=C(c1nn(CCn2nccc2)cc1)NC[C@@]1(C2)[C@H]2CCC1,1 F6660-0892,Cc(cc1)ccc1-c1cn(C)nc1N1CCOCC1,1 SA93-0383,NC(C1(CC2CC2)CN(Cc(cc2)cc3c2OCC3)CCC1)=O,1 Z2447456066,C[C@H]1OCCN[C@@H]1C(NCC(c1c[nH]c2c1cccc2)c(cc1)ccc1OC)=O,1 Z2912581456,OC(CNC(C1(CCCC1)C(O)=O)=O)c1cccc(C(F)(F)F)c1,0 Z2826189056,O=C(c(cc(C(F)(F)F)cc1)c1Cl)Nc1ncc(C2CCNCC2)s1,0 SB54-1066,CC(C)Oc1ccc(CN(C[C@@H]2COC)C[C@@H]2c2nnc(-c3ccccc3)o2)cc1,0 T599-3670,O=C(C1CC1)N(CCC1)c(cccc2)c2N1C(c1cocc1)=O,1 F6529-0871,CN(C(C(F)(F)F)=NN1C(CC2)CCN2C(c(cccc2)c2C(OC)=O)=O)C1=O,1 Z2483111001,OC(c1c(CN(CC2)C[C@@H]3[C@H]2OCC3)oc(-c2ccccc2)n1)=O,1 F5581-2534,Cc1cc(C)nn1CCN(C(c1ccco1)=O)c(sc1c2)nc1c(C)cc2Cl,1 F6617-4329,CCc(cc1)ccc1NC(CN(CC1)CCC1c1nc(-c2ccncc2)no1)=O,1 Z1610473876,O=C(c1c[nH]nc1-c(cccc1)c1F)NCC(N1)=CC=CC1=O,1 M026-1300,CCC(C)NS(c1ccc(/C=C\c(onc2C)c2NC(C2CC2)=O)cc1)(=O)=O,1 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F6400-0955,O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1C(CN2CCCCC2)CSCCC1,1 Y501-5405,O=C(c1nn(cccn2)c2c1)Nc(cc1)ccc1-n1nc(C(F)(F)F)cc1C1CC1,1 F6245-4488,CN1N=C(C(CC2)CCN2C(CCN(C=Nc2c3cccc2)C3=O)=O)N(C2CC2)C1=O,1 F630-0819,O=S(c1ccc(-c2nnc(C3CCC3)o2)s1)(NCc(cc1)ccc1Cl)=O,1 F3407-3802,O=C(c1ccc(CN(C(c(cccc2)c2N2)=O)C2=O)cc1)NCCSCc1ccccc1,1 Z1011056654,COc(cc1)c(C2N(Cc3nc(-c4ncccc4)no3)CCC2)cc1Br,1 P896-0182,CN(CC1)CCC1N(CC1)CCN1S(c1cn(CCCNC2=O)c2c1)(=O)=O,1 F6683-1217,CC(Nc(cc1)ccc1C(N1CCC(COc(ccnc2)c2Cl)CC1)=O)=O,0 F6497-0070,CCOC(CCC(N1CC(Cc2nc(-c(cccc3)c3F)no2)CCC1)=O)=O,0 F6497-0945,Cc(cccc1)c1-c1noc(CC(CCC2)CN2C(c2nc3ccccc3cc2)=O)n1,1 F6478-1510,O=C(COCc1ccccc1)N(CC1)CC1Oc(nc1)ncc1F,1 S607-0206,CC(C)CC(N(CCC1)C[C@H]1N(c(nccc1)c1N1CC2CC2)C1=O)=O,0 Z398826550,OC(CNC(CCc(ccc(Cl)c1)c1Cl)=O)=O,0 F6440-2531,Cc1noc(C)c1S(NCc1nn(C)c2c1CCCC2)(=O)=O,1 F6478-1585,COc1ccc(CNC(N(CC2)CC2Oc(nc2)ncc2F)=O)cc1,1 S951-5368,Cc1noc(C)c1CCC(N(CCN(C1)c(cc2)cc(C(F)(F)F)c2C#N)C1C(NC1CC1)=O)=O,1 D054-0171,CSc(nc1)nc(C(Nc2c(C(NCC3OCCC3)=O)c(CCCC3)c3s2)=O)c1Cl,1 F2740-0246,CCOC(C(CCC1)CN1C(Nc1cn(C)c2c1cccc2)=O)=O,0 Z4391319472,Cc1ccc(CNC(c2cccc(S(NC(c3cscc3)=O)(=O)=O)c2)=O)cc1,1 Z2966014802,CC(COCC1)(C2CC2)N1C(CCc1nnc(-c2cscc2)o1)=O,1 Z1416422727,Cc1cc(N(CCC2)CC2c2nc(cccc3)c3[nH]2)ncc1,0 Z4093802279,CON1CCC(CC(NS(c2cccc3cccnc23)(=O)=O)=O)CC1,1 F153-1313,CCc(ccc(C(C1=C2CCCC1)=NNC2=O)c1)c1S(Nc1cc(C)cc(C)c1)(=O)=O,0 Z749643434,CC(C(N(CC1)Cc2c1[nH]c(cc1)c2cc1Cl)=O)Oc(cc1)ccc1OC,1 Z2915517170,CC(C)(C1CC1)C(N(C1)CC1NS(N)(=O)=O)=O,1 D430-1243,Cc(c(OC)c1)cc(C)c1S(Nc(cc1)ccc1Nc1nc(C)nc(N2CCCC2)c1)(=O)=O,0 V020-4433,Cc(c1c2nc(Cc3ccccc3)nc1N(CCC1)CCN1S(C)(=O)=O)nn2-c1ccccc1,1 D437-0676,CC1Oc(ccc(-c2c(C)sc(NS(c3ccc(C)cc3)(=O)=O)n2)c2)c2NC1=O,1 S397-0258,O=C(c1nn(CC2CC2)c2c1COCC2)NCCc1nc(cccc2)c2[nH]1,1 F6438-1953,CCS(N(CC1)CCN1c1nncc(N2CCOCC2)c1)(=O)=O,1 Z5027823336,Cc1noc(CC(CCC2)CN2C(C(N=C(C2CC2)N2)=CC2=O)=O)n1,1 SC40-1041,Cc1noc(C)c1CC(N(CC1)CCC11OCc2c(COc3ccccc3)nnn2C1)=O,1 Z953541918,Cn(c(C(NCC1OCCN(C)C1)=O)c1)c(Cl)c1Cl,1 E746-0436,O=C(CN1c(cc(cc2)S(Nc3ccccc3)(=O)=O)c2OCC1=O)Nc1cccc(Cl)c1,1 4108-0786,C=CCn1c(NC(C2CCCCC2)=O)nc2c1cccc2,1 Z2358845793,Cc(cc1)cc(CN(C)S(c2c3OCCCn3nc2)(=O)=O)c1F,0 F3320-0959,O=C(Cn1c(cccc2)c2nc1/C=C/c1ccccc1)NCc1ccco1,1 E912-0244,COc(ccc(CN(C(c1c2nccc1)=O)C2=O)c1)c1S(NC1CCCCCC1)(=O)=O,1 F6436-0711,CC(CNC(CSC1CCCC1)=O)(COC)O,0 F6469-1301,O=C(CSC1CCCC1)Nc(cccc1)c1-c1csc(-c(cccc2)c2F)n1,1 8020-3642,O=C(C(C1)C(c(cc2)cc3c2OCCO3)OC1=O)NCC1OCCC1,1 F6390-3034,Cc1cccc(CC(N(Cc2cccs2)C2CCOCC2)=O)c1,0 F3314-0185,OC(CNC1CCCC1)COc(cccc1)c1-c1ccccc1,1 Z2282750199,O=C(c1c(CCCC2)c2ccc1)N1CC2(CC2)C1,1 Z1932221622,CC(CNC(CN(C=Cc1c2cccc1)C2=O)=O)C#N,0 L010-0339,O=C(c(cc1)ccc1-c1ncnc(N2CCOCC2)c1)Nc1ccccc1,0 Z4970359677,O=C(c1cscn1)Nc1c(ccs2)c2nc(-c2ncccc2)n1,0 F5598-0163,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CCC1c1nnc(-c2ccco2)o1,1 F6562-8854,O=C(COc(ccc(Cl)c1)c1Cl)NCc1nccnc1-c1cscc1,1 SB74-0496,CC(C)C(N(CC1)C[C@@]1(C[C@@H](C(N(CC1)CCN1c1c(C)c(C)ccc1)=O)N1)C1=O)=O,1 F6678-8578,Cc1nc(cccc2)c2n1C(C1)CN1S(c(cc1)ccc1N(C(CC1)=O)C1=O)(=O)=O,1 Z1095050644,Cc(cc1)ccc1C(N(CCC1)CC1C(Nc1nc(-c2nc3ccccc3cc2)n[nH]1)=O)=O,1 S810-0232,CC(C)S(N(CC1)CCC1(C1)C1c1noc(C)n1)(=O)=O,0 F6439-1207,CN(C=CC=C1C(NCCn2nc(C(F)(F)F)c3c2CCCC3)=O)C1=O,1 F3292-0432,Nc1nc(CCN(Cc2ccccc2)C2)c2c(-c(cccc2)c2Cl)c1C#N,1 Z1167135011,Cn1nnnc1-c1cccc(NC(C2=CC(CCCC3)=C3NC2=O)=O)c1,1 F6443-7751,O=C(CCc1ccc(C(F)(F)F)cc1)NCC(CCC1)N1c1ccccc1,0 Z1208975676,CC(C(C)(C)c1ccccc1)NC(Nc(cc1)cc2c1[nH]nc2)=O,1 Z1764262199,O=C(C(c1ccccc1)Sc1nnc(C(F)(F)F)s1)NC1CC1,0 Z1436302984,COc(ccc(CC(NC1(CCC1)C(O)=O)=O)c1)c1OC,0 Z2984500768,Cc1c(Cn2nnc(C(N(C)C)=O)c2)ccc(Cl)c1,0 Z1235252523,Cc1c(C(NCC(C2CCOCC2)O)=O)sc(-c2cccs2)n1,1 Z1167375210,CCS(N(CCC1)CC1C(NC1(CC1)c(cc1)ccc1OC)=O)(=O)=O,0 F6553-0624,Cc1noc(C)c1C(N(CC1)CC1c1cscc1)=O,1 F6471-5236,O=C(CCN(C=Nc1c2cccc1)C2=O)N(CC1)CC1n1nncc1,1 F6186-1084,CC(CCSC)(CNC(c(cccc1)c1SC)=O)O,0 Z3613795189,CCn1ncc(CC(N(CC2CCC3)CC2NC3=O)=O)c1,1 Z1151905559,Cc(cc1)ccc1C(N1CC(NCCN(CC2)CCN2c2c(C)c(C)ccc2)=O)=CSC1=O,1 Z300534354,COc(ccc(S(N(CCC1)CC1c1nnc2n1CCCCC2)(=O)=O)c1)c1Br,0 Z2996683572,OC(C1N(Cc2nnc3n2CCOC3)CCOc2c1cccc2)=O,1 Z1391360320,O=C(CCC1CC1)N(CC1)CC1c(cc1)ccc1F,0 SD68-0016,O=C(c1cccs1)N1CC(C(NCC2)=O)N2CCC1,0 Z740246082,OC(c1cc(S(NCc2cccs2)(=O)=O)c(CCC2)c2c1)=O,1 Z2950086704,COC(C1)(CN1C(Nc1nn(-c2ccccc2)nc1)=O)C(F)(F)F,1 D577-0237,Cc(cc1)ccc1Nc1nc(C)cc(Nc(cc2)ccc2NC(Nc2ccccc2)=O)n1,1 S694-0023,Cc1cnc(-c2ccccc2)n1C(CC1)CN1C(C1(CCCC1)c1ccccc1)=O,1 Z3071638736,OC1(CCCCC1)c1nc(-c2cccn3ncnc23)no1,1 F6414-3759,CC(CNC(Cc(c(F)ccc1)c1Cl)=O)(c1cc(cccc2)c2s1)O,1 F6451-2703,COC(CNC(c(cccc1)c1SC)=O)c(cccc1)c1Cl,0 F6525-8003,O=C(c1cc2nsnc2cc1)N(CCn1nc(C(F)(F)F)cc1)C1CCCC1,1 F6619-5154,C(C1)CC1c1cc(N(CC2)CCN2c2ccnc(N3CCOCC3)n2)ncn1,1 Z3609139373,CC(C)Cn1c(cccc2)c2c(C(Nc2nc(COC)n[nH]2)=O)c1,0 Z2289241005,Cc1c(C(NS(CCC2CCCC2)(=O)=O)=O)oc(C)n1,1 F6414-2504,CSc1ccc(C(CNC(Nc(cc2)cc(Cl)c2Cl)=O)O)cc1,0 Z3308873761,CC(C)c1ccc(CN(C)C(C2(C3)OCC3C2)=O)cc1,1 F6802-6333,CC(C)(C)C(N(C)C(CCC1)CN1c(ncc(Cl)c1)c1Cl)=O,0 Z2947594300,CN(C1CCN(Cc2cnc(-c3ccccc3)o2)CC1)S(C)(=O)=O,0 SD01-0294,O=C(CCn1cncc1)N(CC1)Cc2c1n(CC1CC1)nc2-c1cocn1,1 J011-0236,Cc1nnc2sc(-c3ccc(CNC(c4cc(cccc5)c5o4)=O)cc3)nn12,1 F5594-0215,CC(C)(C)c1csc(CN2CCN(CC(NC3CCCCC3)=O)CC2)n1,1 F6515-4081,COc(ccc(C(NCc1cncc(-c2cnccc2)c1)=O)c1)c1F,0 F6556-5262,O=S(c1cc(CCCC2)c2cc1)(N(CCC1)CCN1C1CCSCC1)=O,1 Z2275179254,CC(CCN(C1)C(C(C2)CC2(C)O)=O)C1OC,0 L575-0241,Cn1nc(C(N2CCCC2)=O)c(C2)c1CCN2C(CCC(NCc(cccc1)c1F)=O)=O,0 S904-0092,CC(C)N(C[C@H](C1)O)[C@@H]1c1nnc(C2)n1CCN2C(Cc(cc(cc1)OC)c1OC)=O,0 Z1100767700,CN(CCC1)CCN1S(c1cc(NC(NC(C2)CC2c2ccccc2)=O)ccc1)(=O)=O,1 8011-5969,O=C(c(cccc1)c1N=C1CSc2nccn2Cc2ccccc2)N1c(cccc1)c1Cl,1 Z2327194308,C(C1)C1c1cn(C2CCNCC2)nn1,1 Z1572354512,COc1cc(CNC(N2CC(Cn3nncc3)CCC2)=O)cc(F)c1,0 Z2439958012,CN(C1CCNCC1)C(COc1cccc(NC(c2ccco2)=O)c1)=O,1 Y042-6332,C1(N[C@@H](C(Nc2c1cccc2)=O)CC(N1CCN(CC1)c1ccccc1)=O)=O,1 Z2370914862,CCCN(CC(CNC(N(CC1)CCC1C(F)(F)F)=O)C1)C1=O,1 F1913-4405,OC(c1cc(OC(F)F)cc(OC(F)F)c1)=O,0 E975-1344,COc(cc1)cc(NS(c(cc2)cc3c2[nH]c2c3CCCCC2)(=O)=O)c1OC,0 Z1170796513,CC(C1)C1C(N(CC1)CCC1C(c(cc1)ccc1Cl)O)=O,0 SA50-0873,CC1(CC1)C(N(C1)Cc2c1c(-c1nc(C3CCOCC3)no1)nn2C)=O,1 Z1100823499,CC(C)(CCC1)N1C(NCc(cc1)ccc1C(N1CCCCC1)=O)=O,1 V001-8950,CC(c1ccccc1)NC(CCN(Cc1ccco1)c1nc(C2CC2)nc2ccccc12)=O,1 Z2959440146,CCn1nnc(C(N(CCC2)CC2(CO)c2ccccc2)=O)c1,1 Z1425912121,O=C(CCc1nc(C2CCCC2)no1)N(CCC1)C1C(Nc1nccs1)=O,1 F5897-0164,O=C(CSCc1ccccc1)Nc1cccc2ccc(-n3cncc3)nc12,1 F6747-5840,CC(C)c1nccn1CC(C1)CN1c1c(cc(cc2)OC)c2ncc1,0 Z2441150247,Cc1c(C(N(CCNC2)C2c2cnccc2)=O)nc(-c2cn(C)nc2)o1,1 F6513-1399,O=C(c1nn(CCCC2)c2c1)N(CC1)CCN1C(OCC(F)(F)F)=O,1 6809-0257,Cc1nc(Nc2nc(-c3ccccc3)c(cc(cc3)Cl)c3n2)nc2c1CCCC2,1 Z1208055975,CC(CC1)CCN1C(C1CCN(CC(NC(c2nccs2)c2ccccc2)=O)CC1)=O,1 SB91-0984,CCc(cccc1)c1S(N(CCN1CCCCC1)C1CNCC1)(=O)=O,0 SB21-1179,CN(C)S(N(C1)[C@H](Cn2nnc(C(N3CCCC3)=O)c2)C[C@@H]1F)(=O)=O,0 K784-9764,O=C(c(cnn1c(C(F)(F)F)c2)c1nc2-c1cccs1)NCC1OCCC1,0 Z2223695123,O=C(c(cc1)cc(CCC2)c1C2=O)N(CCN1)C(c2ccc(C(F)(F)F)cc2)C1=O,1 F5072-4239,O=C(NC1CCCCC1)N(CC1)CCN1c(cc1)nnc1-c1ccco1,1 Z3221661913,Cn(c1c2cc(C(NCCCN(CCC3)C3=O)=O)s1)nc2-c(cccc1)c1F,1 D051-0161,CC(C(N(Cc1ccc(C)o1)C(CC1)CS1(=O)=O)=O)Oc(cccc1)c1OC,0 S976-1467,O=C(C1(CN(Cc(cc2)cc3c2OCCO3)CCC1)F)NCc1ccncc1,1 Z4767388018,COc(ccnc1C(Nc2cccc(-c3nc(cccc4)c4s3)c2)=O)c1F,0 F6436-0978,O=S(CCOc1ccccc1)(N(CC1)CCC1c1cscc1)=O,1 F3007-0165,C=CCN1C(SCC(O)=O)=Nc(cccc2)c2C1=O,0 L413-0557,CC(N(CC1)c(cc2)c1cc2-c(cc1)ccc1C(NCCN1CCN(C)CC1)=O)=O,1 F5148-0371,COc(cc1)cc(S(NCCCN(C(C=C2)=O)N=C2c(cc2)ccc2F)(=O)=O)c1OC,0 L533-0364,Cc(cc1)cc(C)c1NC(c(cc1)ccc1-c1ncnc(Oc2cc(OC)ccc2)c1)=O,0 Y044-0090,Cc1cnc(NC(C(CC2=O)CN2c(cc2)cc(Cl)c2OC)=O)s1,0 F5882-0106,CC(C)Sc1ccc(CC(NCCN(CC2)CCN2C(OC)=O)=O)cc1,0 SB21-0033,CN(C)C(c1cn(C[C@H](C[C@@H](C2)F)N2C(CCc2nc(-c3ccccc3)no2)=O)nn1)=O,1 F6438-3351,CCn1nc(C)c(S(NCc2nc(OC)nc(N3CCCCC3)n2)(=O)=O)c1C,1 F6550-4975,O=C(C1(CC(C2)C3)CC3CC2C1)N(C1)CC1Nc1nccnc1,1 G668-0583,COc(cc1)cc(C2)c1OCC2C(NCCCN1CCCC1)=O,1 Z1863684984,CC1(CC(NCc2c(CS(N3CCOCC3)(=O)=O)cccc2)=O)CC1,1 Z1623214804,O=C(C1CCN(CC(F)(F)F)CC1)NC(C1)CNC1=O,1 SD25-0334,Cc1noc(C)c1C(N1CC2(CCCCC2)C(CCC(NC2CC2)=O)C1)=O,1 Z804573710,Cn1ncc(CNC(C2CCN(CC(F)(F)F)CC2)=O)c1,0 Z1902625318,CCn1ncc(C(Nc2cc(C(N3CCOCC3)=O)c(C)cc2)=O)c1,0 Z1129790144,CC(N1CCC(CNC(c2n[nH]c(-c(cccc3)c3Cl)c2)=O)CC1)=O,1 SA31-1027,CC1(C(NCc2cc(C)nn2C)=O)n2c(-c3ccccc3)nnc2COC1,1 Z3268542380,CC1(CNC(c(cc2)nc(Cl)c2Br)=O)COCC1,1 F6250-0518,Cc1csc(C(NC(CCC2)CC2OC(Nc(cc2)ccc2F)=O)=O)c1,0 CM4573-6348,COc1cccc(CNC(N(C2)[C@H](CN(CCC3)c4c3cccc4)CC2(F)F)=O)c1,1 Z1091454990,COCCC(N(CCC1)C1c1c(C(F)(F)F)cccc1)=O,0 Z1900295980,CC(CCC1)N1C(c1c(C(F)F)n(-c2ccncc2)nc1)=O,0 F6495-9580,O=C(c1noc2c1CCCC2)NCc1ncnc(-c2ccccc2)c1,1 Z3092240135,O=C(Cc1ccccc1)NCCC(N(CC1)OCCS1(=O)=O)=O,1 Z3481136860,C#CCC[C@@H](C(O)=O)NS(c1cc(CCC2)c2cc1)(=O)=O,0 F6246-0535,C(c1csc(-c2ccccc2)n1)N(CC1)CCC1c1nnc(-c2cscc2)o1,1 F5591-0384,CCc1nc(-c(cc2)cnc2N(CC2)CCN2C(c2cc(Br)cnc2)=O)no1,1 F1806-0015,CCSc1nnc(CSc2ncccn2)n1CCc1ccccc1,1 Y042-3413,O=C(C(C1)CN(Cc2ccco2)C1=O)Nc(cc1)cc(C=C2)c1OC2=O,1 Z1764479790,Cc(cc1)cc(-c2n[nH]c(NS(c(c3cccc4c33)ccc3N(C)C4=O)(=O)=O)c2)c1F,0 8006-1225,C1C(c2ccccc2)=Nc(cccc2)c2NC1c1ccccc1,1 F1741-0162,CCOC(COc1c(C(C2)N(C(C)=O)N=C2c(cc2)ccc2OC)cccc1)=O,0 F2496-3048,CCOc(nccc1)c1C(OCc1noc(-c(cccc2)c2F)c1)=O,0 Z2979953405,CN(c1cc(CNC(N[C@H](C2)C[C@H]2O)=O)ccc1)S(C)(=O)=O,0 P944-3559,O=C(Nc1cccc(Br)c1)N(CC1)CC1n1c(C2CC2)nnc1,0 Z356755284,O=C(CCc1nc(-c2ccco2)no1)NCc1c(-n2cncc2)nccc1,1 SC55-1038,C(c1ccccc1)N(C1)CC(C2)(CN2C2CCOCC2)C1c1nc(C2CC2)n[nH]1,1 D466-0027,CC(c1ccccc1)N1Cc2nc3cccc(Cl)c3n2CC1,0 F9995-4296,Cc1c(-c2nn(C)c(N)c2)sc(cc2)c1cc2Cl,1 F6564-7746,CC(C(Nc1cc(C)no1)=O)N1N=C(CCC2)C2=CC1=O,1 P315-0046,O=C(NC(CCN1c2ccccc2)C1=O)Nc(cccc1)c1Cl,0 Z4500949705,CC(CC1)(CN1C(c1n[nH]c(-c2ccccc2)c1)=O)c1cc(OC)ccc1,0 Z2194270128,OC(C(N1CCN(Cc2ccncc2)CC1)=O)c(ccc(Cl)c1)c1F,1 Z2438036085,Cn1nncc1S(NC(C(O)=O)c(cc1)cc(F)c1OC)(=O)=O,0 Z1265433102,CCOc(cccc1)c1C(Nc1ncc(C(C)C)s1)=O,0 F6439-2876,COc1cccc(N(CC(C2)C(NCCn(c(C3CC3)c3)nc3-c3ncccc3)=O)C2=O)c1,1 Z2368799396,Cc(ccnc1)c1S(NC(c1nn(C)c2c1CCCC2)=O)(=O)=O,1 F6783-6405,Cc1noc(C)c1C(N(C1)CC(C2)C1CN2c1nc(cccc2)c2n1C)=O,1 F6559-3315,CC(C)(C)OC(N(CCC1)C1C(NCc1nc(-c2cn(C)nc2)no1)=O)=O,1 F6796-3310,Fc(cc1)cc2c1nc(N1CC(COc(cc3)nn4c3ncc4)CC1)o2,1 Z3345983465,Cc1c(C(C(O)=O)N(C2)C[C@@H](C3)[C@H]2CC[C@@H]3O)ccc(F)c1,0 F6609-4434,COc1ccc(CN(c2c(C(N3c(cccc4)c4F)=O)scc2)C3=O)cc1,0 F6523-2615,O=C(c(cccc1)c1Cl)NCc1nnc(cc2)n1nc2-c1cscc1,1 Y502-4839,N#Cc1c(NC(CC2C(F)(F)Cl)c(cc3)ccc3F)n2nc1,0 G499-0086,O=C(C1CCCCC1)N(CC1)CCC11OCCN1S(c(cc1)ccc1F)(=O)=O,1 Z1306196777,CN(CCC1N(C)CCCC1)C(NC1c(cccc2)c2OC1)=O,1 Z3393345940,CN(CC(CF)O)Cc1cn(Cc2ccc(C(F)(F)F)cc2)nc1,0 8016-8526,Cc1c(CCNS(c(cc2)cc(C=C3)c2OC3=O)(=O)=O)c(cc(cc2)OC(F)(F)F)c2[nH]1,1 F6279-0295,O=S(Cc1ccc(C(F)(F)F)cc1)(N(Cc1ccco1)Cc1ncccc1)=O,1 L228-0576,O=S(c1ccc(-c2cnc(C3CC3)o2)s1)(Nc(cc1)ccc1OC(F)(F)F)=O,0 F5889-0472,CN(CC(N(CC1)CCN1c1ncccc1)=O)C(c1c[nH]c2c1cccc2)=O,1 Z2309897757,OC([C@H]1OCC[C@H]1c1ccccc1)=O,1 F3111-1261,CC(c1ccccc1)NC(CSc1nc(C(F)(F)F)cc(-c2cccs2)n1)=O,1 F6604-2176,CN(C(C1)CN1c(cc1)nn2c1nnc2C1CCC1)C(C1COCC1)=O,1 Z2169094938,OC(CC1)CCN1C(c1nc2ccccc2cc1Cl)=O,0 F3375-2528,Cc1cccc(OCc(occ2)c2C(N(C)Cc2cc(O)nc3ccccc23)=O)c1,1 SB99-0623,Cn1nc(CCC(N2CCCC2)=O)c(C2)c1CCN2C(Cn1nccc1)=O,1 Z3136644803,Oc1cc(CNC([C@]2(CC3)[C@@H]3CNC2)=O)cnc1,1 F6125-1880,O=C(COc(cccc1)c1F)N(C1)CC1C(NCc1ccco1)=O,1 SA49-0485,Cc1cn(CC(N(C2)CC22OCC(CC(N3CCOCC3)=O)C2)=O)nc1,1 Z3008133885,Cn1nc(C2CCCC2)c(S(NCCc2ccco2)(=O)=O)c1,1 F6519-3774,Cc1cc(C)nn1C(CNC(C(CC1)CCN1S(C)(=O)=O)=O)c1cccs1,1 SA44-1024,CN(CC(C1)(CN1C(C1CC1)=O)C1)C1c1nnc(-c2ccccc2)o1,1 F6673-4713,Cc(cc1)cc(S(N(CCC2)CC2N(C)c2ncc(C)cn2)(=O)=O)c1OC,0 SA93-0537,Cc1c(CN(CCC2)CC2(CCOC)C(N)=O)scn1,0 F6573-4925,CCOc(cc1)ncc1C(NCc1cncc(C2CC2)c1)=O,0 F1911-5827,CC(C)(C)OC(N1CCC(COc2ncnc(C3CCC3)c2)CC1)=O,1 SB71-0221,O=C(CCc1nc(cc(cc2)Cl)c2[nH]1)N1Cc2cc(C(N3CCOCC3)=O)nn2CC1,1 S534-0651,CC1CCN(CC(CCCCC2)N2C(c2cccn2C)=O)CC1,1 F911-1530,Cc(cc(cc1)Nc2nc(C(N(CC3)CCN3c3ncccn3)=O)cc3c2cco3)c1Br,1 F6293-0190,CN(C)S(c(cc1)ccc1C(NCc1nn(C)c(-c2ccco2)c1)=O)(=O)=O,0 F6795-3630,CC(C)(C)c(nc1cc2)cn1nc2N1CCN(Cc(cc2)ccc2C#N)CC1,1 F5875-0018,CN(C=CC=C1C(NCCCOc2cccc3cccnc23)=O)C1=O,1 Z2229674396,CC(C)(C(Nc1nn(C)c(C)n1)=O)c(ccc(Cl)c1)c1F,0 F5095-0167,CCn1c(N(CC2)CCN2C(COCC)=O)ncc1,0 Z2850040230,C(c1ccccc1)N(CCC1)CCN1c1ncnc(C2CC2)c1,1 2326-3226,CC(NC(CC(C1)c(cc2)ccc2Cl)=C(C2c(cccc3)c3F)C1=O)=C2C(OC)=O,0 Z300474660,CC(CC(C)C1)CN1S(N(CC1)CCC1N(c(cccc1)c1N1)C1=O)(=O)=O,0 F6200-4013,Cn(cc1C(NCC2(c(cccc3)c3OCC2)O)=O)nc1OC,1 V023-7254,O=C(C(CCN1c(cc2)ccc2Cl)C1=O)NCC1OCCC1,1 Z274633430,O=C(C1CCN(Cc2ccccc2)CC1)NCc(cc1)cc2c1OCO2,1 F1043-0617,Cc1c(C)sc2ncnc(SCC(c(cc3)ccc3OC)=O)c12,1 Z1317911882,Cc(cc1)ccc1-c1noc(CN(C)Cc2cc(O)ccc2)n1,0 Z757839936,CC(C(Nc1cn(CC(NC2CC2)=O)nc1)=O)Oc(cc1)ccc1F,0 Z2622443722,Cc1cc(NC(NCC=CCO)=O)nn1-c1ccc(C)cc1,0 G421-1053,CCCN(CC1)CCN1c1nc(CCN(Cc(cc2)cc(OC)c2OC)C2)c2cn1,0 Z2881640030,Cc1n[nH]c(N(CC2)CCN2C(c2cccn2Cc2ccccc2)=O)n1,1 F6471-6150,O=C(CCc(cccc1)c1Br)NCc1cncc(-c2cscc2)c1,0 Z1682670150,C(c1ccno1)c1noc(-c2cc3ccccc3cc2)n1,0 Z1983946768,CCC(C)CN(C)C(c1cnnn1C)=O,0 S555-1716,O=C(C1CC1)Nc(cc1)cc(C2)c1OCCN2S(c1cccs1)(=O)=O,1 F6734-0743,O=C1N(CC(F)(F)F)CCC1N(C1)CC(C2)C1CN2c(cc1)ncc1Cl,0 Y030-9847,CCCCC(Nc(cc1)ccc1C(Nc1nnc(CC(C)(C)C)s1)=O)=O,0 F6519-4065,Cc1cc(C)nn1C(CNC(C(Nc1cc(C(F)(F)F)ccc1)=O)=O)c1cccs1,0 F5871-3559,Cc1noc(CNC(c(cc2)ccc2-n2cccc2)=O)n1,1 SA44-0309,CC(C)c1nnc(C2N(C)CC(C3)(CN3C(c3nn(C)c(C)c3)=O)C2)o1,0 SC04-0587,CC(C)Cc1nc(CCOC(CCC2)CN2C(c2nn(C)c(C)c2)=O)no1,0 F6525-5971,Cc(n(CCNC(c(cccc1)c1SC)=O)nc1C)c1-c1cccs1,0 F6525-4477,CN(CC(NCCn1ncc(-c2ccccc2)c1)=O)S(C)(=O)=O,0 D753-0092,Cc1c(C(N[C@H]2CC[C@H](CN(Cc3c4cccc3)C4=O)CC2)=O)sc(N=CN2)c1C2=O,1 F0777-2556,O=S(c(c1ccccc11)ccc1Cl)(N1CCCCCC1)=O,1 F6561-2633,O=C(N(CC1)CC1OCC1CC1)OCc1cnccc1,1 Z2974553913,COC(C1)(CN1C(NC(COC1)c2c1cccc2)=O)C(F)(F)F,1 Z1583423824,Fc1cnc(N(CC2)CC=C2c(cc2)cnc2Cl)nc1,0 V006-6163,CCC(C)(C)c(cc1)cc(N2CCCC(NC(Cc3ccccc3)c3ccccc3)=O)c1OCC2=O,1 S827-4090,CCc1noc([C@H](CC(C2)(F)F)N2C(c2cnco2)=O)n1,0 Z1419960160,Cc1c(C)nc(-c2ncccc2)nc1N1CC(c2cccs2)OCC1,1 F6439-7052,O=C(c(cccc1)c1Br)NCCn1c(-c2ncccn2)ncc1,0 C200-9621,CCCc1noc(CN(C=Nc2c3n(CC(NCC4OCCC4)=O)c4c2cc(C)cc4)C3=O)n1,1 F6658-1872,CN(C(C1)CN1c1nnc(C2CC2)cc1)S(c(cc1)ccc1-n1nccc1)(=O)=O,1 Z2755334619,OC(Cn(cc1)nc1NC(C1(CCC1)C(F)F)=O)=O,0 D665-0441,CN(C)CCNCc1ccc(-c(cc2)ccc2Br)o1,0 1611-1073,Cc(cc1)ccc1S(C(CS(C1)(=O)=O)C1S(c1ccc(C)cc1)(=O)=O)(=O)=O,1 6466-1089,CC(C1)OC(C)CN1C(CSc1nc(-c(cc2)cc(OC)c2OC)cc(C(F)(F)F)n1)=O,1 F6469-0514,CC(C(Nc(cccc1)c1-c1cn(CCS2)c2n1)=O)Oc1c(C)c(C)ccc1,1 Z1951852213,Cc1cccnc1CNC(C1(CCC1)S(C)(=O)=O)=O,0 F6730-4810,Cc1nc(-c2cc(NC(c3ncnc(C)c3C)=O)ccc2)cs1,1 Z4661810154,CN(C)[C@H](CC1)CC[C@H]1C(N(C1)CC1NC(c1c([nH]cc2)n2nc1)=O)=O,1 F5264-0553,CC(C)Oc(cc1)ccc1C(NCCN(CC1)CCN1c(cccc1)c1F)=O,0 Z2828443890,NCC(C1)(C2)CC12NC(c1c(C(F)(F)F)c2ccccc2nc1)=O,1 E587-0123,O=C(CSc1cn(CC(N2CCCC2)=O)c2c1cccc2)Nc(ccc(F)c1)c1F,0 F5882-6894,Cc1noc(-c(cc2)ccc2NC(Nc2c(C(F)(F)F)cccc2)=O)n1,1 Z2968881025,OCCC(C1)CC1NC(NCc(cc(cc1)F)c1Br)=O,0 Z1526924881,CCc1nc(NC(CC2)CCC2C(NC(N)=O)=O)c(ccs2)c2n1,1 Z1359788048,N#Cc(cc1)cc(F)c1N(CC1)CCN1C(CCC1COCC1)=O,1 SC19-0726,CCn1nc(CN2CCC(CNC(N3CCOCC3)=O)CC2)c2c1CCOC2,1 G801-0192,CN(c(ccc(S(NCC1OCCC1)(=O)=O)c1)c1N1C)C1=O,1 Z2975663920,O=C(NC[C@@]12C3(CCC3)OC[C@@H]1C2)NCc1noc2c1ccc(F)c2,1 F2977-0076,CCN(Cc1ccccc1)S(c(cc1)ccc1C(Nc1nc(C(C)C)cs1)=O)(=O)=O,1 G015-0030,O=C(c1cccn1-c1nnc(N2CCOCC2)s1)NC1CCCC1,1 8016-8821,O=C(CC(C1=O)N(CC2)CCC2Nc(cc2)ccc2F)N1c(cc1)ccc1F,0 Z1176787592,Cc1noc(C(CCC2)N2S(Cc2c(C)cccc2)(=O)=O)c1,0 F5490-1332,COCCNc(nc1)ncc1-c(cc1)cc(OC)c1OC,0 Z4253900324,C[C@H](c1n[nH]c(C)n1)NC(c1cc(ccc(C)c2)c2[nH]1)=O,0 Z5030906439,Cc1cc(C(N(C[C@@H]2[C@H]3CCC2)[C@@H]3C(OC)=O)=O)nn1-c1cccc(C(F)(F)F)c1,0 F6724-2378,CC(Cc1cscc1)(CNc(nc1)ncc1Br)O,0 Z3865977673,O=C(C(C1)C2C1CNC2)Nc(cc1)cc(C=CN2)c1C2=O,1 Z2606214293,OCCC(CC1)CCN1C(C1NCC11CCCC1)=O,1 Z1603734894,OC(C(c(cc1)cc(F)c1Cl)NC(Cn1nccc1)=O)=O,0 F6496-2005,CN(C)Cc1noc(cc2)c1cc2NC(c1cc2nccnc2cc1)=O,1 F6564-7852,CC(C(Nc1nc(-c2ncccc2)cs1)=O)N1N=C(CCC2)C2=CC1=O,1 Z2118670911,Oc1cc(OCCN(C2)C(NCC3(CC3)c(ccc(F)c3)c3Cl)=O)c2cc1,1 F3394-1320,COc(cc1)ccc1-c1nc2ccccc2c(N2CCCCC2)n1,0 F2205-0415,CC(C)(Cc1ccc2)Oc1c2OCc(cc1)ccc1C(Nc1nccs1)=O,1 Z4414971570,C(C1(CC2)CN2CC1)n1nnc(-c2cc([nH]nc3)c3cc2)c1,1 SC77-0848,CC(C)S(N(C[C@H]1C(NC2CCN(Cc3ccccc3)CC2)=O)C[C@@]11OCCNC1=O)(=O)=O,0 D163-0775,Cn1c(cccc2)c2c(/C=C/C(N2CCc3ccccc3)=Nc(cccc3)c3C2=O)c1,1 Z2997280974,OC(C1CCCCCCC1)c1nc(C2(CCC2)c2ccncc2)no1,1 S217-0284,CN(C1)C(CC2)(CCN2C(NCCc2ccccc2)=O)c2nccn2-c2c1cccc2,1 8019-9281,CN(c(cccc1)c1Oc(cc1)c2cc1S(N1CCOCC1)(=O)=O)C2=O,0 F6524-1084,O=C(C1Oc(cccc2)c2OC1)NCCN1N=Nc(ccc(F)c2)c2C1=O,1 Z3687013772,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(c1c(cccc2)n2nn1)=O,1 F6550-4712,O=C(N(C1)CC1Nc1ncccn1)OCC1CCC1,1 Z3042191890,CC(C)(CCC1)C1C(NC[C@@H](C1)[C@@H](c2c(C)n(C)nc2)N(C)C1=O)=O,1 Z3052902947,CCc(occ1)c1C(N(CCc1c2[nH]cn1)C2c1cnccc1)=O,1 Z4907149160,CN(C(NC(CC1)CN1c1nc(-c2ccncc2)nc(C(F)(F)F)c1)=O)c(cc1)ccc1F,0 Z4989107802,Cc1nsc(N=CN2Cc3cc4ccccc4cc3)c1C2=O,1 Z1942386111,Cc1cncn1CCCNC(C(C1)Oc(cc2)c1cc2Br)=O,0 F6573-1601,Cn1ncc(-c2nccnc2CNC(c(cccc2)c2SC)=O)c1,0 Z1445494076,CCCc1n[nH]c(C(Nc(cc2)ccc2C(N(CC2)CCC2C(O)=O)=O)=O)c1,0 F6033-0434,O=C(C1Oc(cccc2)c2OC1)N1CC(COCc2ccccc2)CCC1,1 F6454-1202,O=C(c1csc(-c2ccccc2)n1)NCC(CC1)CCN1c(nc1)ncc1F,1 Z1467221005,O=C(c1c[nH]nc1-c(cccc1)c1F)NCCc1cc(cccc2)c2[nH]1,1 F6515-1423,Cc1c(C(NCc2cc(-c3ccco3)ncc2)=O)scn1,1 Z2299434591,CC(CNC(c1ccc(-c(cc2)ccc2OC(F)(F)F)s1)=O)(CC1)NC1=O,1 SA71-0378,O=C(c1cscn1)N(CCC1)CC1(CC1CC1)c1noc(-c2cnccc2)n1,1 D044-0044,O=C(NC1CCCCC1)Nc(cc1)cc2c1n(CCN(C1)C3CCCCC3)c1n2,1 F2519-0153,COc(ccc(N(CC(C1)NC(NCC=C)=O)C1=O)c1)c1OC,0 E948-0977,Cc1c(C(NCCc(cc2)ccc2Cl)=O)c2c(N3CCCC3)nc(C)nc2o1,1 F6148-0025,CC(C1)N(C(C(CC2)CCN2c(cc2)nnc2-n2nccc2)=O)c2c1cccc2,1 Z2776501421,COCc(ccc(C(N[C@@H](CCO)CO)=O)c1)c1F,0 F6512-0870,O=C(c(cc(s1)Cl)c1Cl)Nc1cc2ccnn2cc1,1 Y042-2088,CC(C)S(N(CC1)CCN1C(CCC(C(N1c2ccccc2)=O)NC1=O)=O)(=O)=O,0 Z1870239336,OC(c1csc(NC(COC2CCCCC2)=O)c1)=O,1 C677-0064,Cn1c(Cc(n2CCc3ccccc3)nnc2SCC(NCC2OCCC2)=O)ccc1,1 D347-3025,CN(C(Cn1c(cccc2)c2nc1C(C1)CN(Cc2ccccc2)C1=O)=O)c1ccccc1,1 Z1541937232,Fc1c(C(C2)OCCN2c2nc(cccc3)c3[nH]2)cccc1,0 F6573-3107,O=C(c1cscc1)NCCOCCn1cncc1,1 Z3510126765,OC(CC(CCCC1)N1C(c1cc(-c(cccc2)c2F)n[nH]1)=O)=O,0 Z1101720522,CN(C)C(c1cc(C(Nc2c(CCC3)c3nn2C)=O)ccc1)=O,0 Z2860204842,CC1C(C(Nc2cnc(N3CCNCC3)nc2)=O)OC(C)C1,1 F1897-0277,CCOc(nccc1)c1C(Nc1cccc(-c2cn(c(C)cs3)c3n2)c1)=O,1 Z1562901587,O=C(C1CC1)NC1CCN(Cc2cc([nH]nc3)c3cc2)CC1,1 F6556-1868,Cn(cc1)c2c1cc(CCNS(CCC(F)(F)F)(=O)=O)cc2,0 F6561-2455,O=C(c(cc1)ccc1-c1cccs1)N(CC1)CC1OCC1CC1,1 Z935154624,O=C(C1CC1)N(CCC1)CC1C(NCc1cccc(Br)c1)=O,0 F6785-7398,CC(C)(C)c(nc1cc2)cn1nc2OCC(CC1)CCN1S(C1CC1)(=O)=O,1 Z1743382844,CC(C)(C)c1nsc(N(CC2)CCN2C(C2OCCC2)=O)n1,0 F2147-0237,Cc1ccc(Cn2c(cccc3)c3c(SCCN)c2)cc1,0 Z1699288974,OCC(CNc1c(c(CCC2)c2s2)c2ncn1)(F)F,0 F6192-1123,O=C(CSc(cc1)ccc1F)NCC(c1cscc1)c1ccco1,1 Z2296056873,CC(C(Cc1ccccc1)C(O)=O)NC(c(cccc1C)c1Cl)=O,0 F6252-1405,CCOC(CN(C=C(C=C1)c2nc(-c(cccc3)c3Cl)no2)C1=O)=O,1 Z806947132,Cn1ncc(CNC(c(cccc2)c2-c2ccc(C(F)(F)F)cc2)=O)c1,0 Z963587450,O=C(CCC1CCNCC1)Nc(cc1)cc(CC2)c1NC2=O,1 Z1138437848,O=C(c1cc2ccccc2cc1)NS(N(CC1)c2c1cccc2)(=O)=O,1 K263-0708,CCC(C(Nc1cc(OC)ccc1)=O)SC(N(CC1OCCC1)C1=O)=Nc2c1sc1c2cccc1,0 S248-3836,O=C(CCc1nc(cccc2)c2s1)N1CC(Cc2noc(C3CCOCC3)n2)CC1,1 Y041-0565,Cc1c(CCC(NC2CCCC2)=O)c(C)nn2c1nnc2,1 F6497-7967,O=C(COc(cc1)ccc1F)N(CC1)CCC1c1n[nH]c(C(NCC(F)(F)F)=O)c1,0 E912-0278,COc(ccc(CN(C(c1c2nccc1)=O)C2=O)c1)c1S(N(CC1)CCN1c1ccccc1)(=O)=O,1 Z4632756075,COC(C1NCCC2(CCCC2)C1)=O,1 F6560-2721,O=C(NCc1cn(-c2ccncc2)nn1)NC1CCCC1,1 F6403-1563,Cc1cc(C)nn1-c1nc(CCNC(c2cc(Br)cnc2)=O)cs1,1 Z3206631978,OC(CC1)(CCN1C(COc1cc(F)cc(F)c1)=O)C1COCC1,0 F6246-2543,CN(C1=O)N=C(C(CC2)CCN2S(c(cc(cc2)F)c2OC)(=O)=O)N1c1ccccc1,1 F6481-4040,O=C(CSC1CCCC1)N(CC1)CCSC1c1cccs1,1 F184-1279,O=C(C(CC1)CCN1S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O)NC1CC1,1 F6178-8018,N#Cc1nccnc1N1CCC(CNC(c2cc(cccc3)c3o2)=O)CC1,1 SA43-0845,CN(CC(C1)(CN1C(c1cccs1)=O)C1)C1c1nc(-c2ccncc2)no1,1 F5496-0103,O=C(c1ccco1)N(CC1)CCC1c1nnc(C2CC2)s1,1 F6416-8929,Cc1cc(C(CCNC(Nc(cc2)cc(Cl)c2Cl)=O)O)c(C)o1,0 F6089-8551,CC(C)(Cc1ccc2)Oc1c2OCC(NCC(CC1)CCN1C(c1cc(cccc2)c2o1)=O)=O,1 Z1274457384,NCc1nc(C(N(CC2)CCN2c(cc2)ccc2F)=O)cs1,0 Z1833413547,CC(C)(C(Nc1n[nH]c(C)n1)=O)c(ccc(Cl)c1)c1F,0 Z1985762080,Cc1nn(C)c2nc(C)c(CC(N(C)CCCSC)=O)c(C)c12,0 Y500-1509,Cc1nn(C)cc1-c1nc2cc(C(n3nccc3)=O)nn2c(C(F)(F)F)c1,0 F6802-7704,Cc1cnc(CN(CC2)CCC2C(N(CC2)CCC2(F)F)=O)c(C)c1OC,0 F6549-3420,O=C(c1csc(-c2ccccc2)n1)N1CC(Cn2ncnc2)C1,1 Z1734761718,OC[C@H](C[C@@H](C1)O)N1C(NCc1nccn1CCc1ccccc1)=O,1 Z1078669190,C=CCN(CC=C)C(N(CC1)CC1C(O)=O)=O,0 Z5009877845,CCCC(C)(C(Nc1cc(N2CCCC2)ccc1)=O)NC(CN(CCc1c2cccc1)C2=O)=O,1 F6378-0005,Cc1cc(C)nn1CCNC(C(COC1)N(Cc2cccs2)C1=O)=O,1 Z1767789716,O=C(C(CC1COC2)CC2C1=O)N(C1)CC1OC(F)F,1 F6359-1861,N#Cc1cccnc1OC(CC1)CCN1C(Cn1nccc1)=O,1 F6658-4627,CN(C(C=C(N1)N(CC2)CCN2c2nc(cccc3)c3o2)=O)C1=O,1 F2342-0166,CCSc(cccc1)c1C(NCCN(C(C=C1)=O)N=C1c1cccs1)=O,0 F6472-0686,O=C(c1cc(Oc(cc2)ccc2F)ccc1)NCCSC1CCOCC1,1 F6559-6101,O=C(c(s1)ccc1Br)N(CC1C2)C2CS1(=O)=O,1 F6436-0294,Cc(onc1)c1C(NCC1(CCOCC1)c(cccc1)c1OC)=O,1 F6783-6626,CC(C)n1c(N2CC(CN(C3)C(c4c[nH]nc4)=O)C3C2)nc2c1cccc2,0 Z1066513774,Cc1ccc(CNC(C(CC2)CCN2c2nc(cccc3)c3s2)=O)cc1,1 Z1587134966,O=C(C(N1CC(CC2COCC2)CCC1)=O)Nc1cccc2cccnc12,1 Z2950065725,O=C(Nc(ccnc1)c1F)N(CC12CCOCC2)C1c1ccccc1,0 Z3873357401,CCN(CC(Nc(cc1)cc(C(N)=O)c1F)=O)Cc(cccc1)c1Cl,0 Z1335937439,CCOc(cc1)c(C)cc1S(N(CCN1C2CC2)CC1=O)(=O)=O,0 Z2335545783,CSCc1c(C(NC(CC2)CN2c(cc2)ccc2F)=O)nccc1,0 Z1956741193,CC(C)n(cc1)nc1NS(c1cn(C)nc1)(=O)=O,0 G394-0242,CC1N(CCNC(c2c(C)c3c(N4CCN(C)CC4)ncnc3s2)=O)CCCC1,1 Z1577206012,CC(CC1)C2(CCC2)CN1C(c1ccc(CNC(C)=O)s1)=O,1 Z3077806920,Cc1cc(OC)nc(N(CC2)CCC2(c2nccn2C)O)n1,0 Z4418560988,O=C(Cn1nnnc1)N(CC1)C[C@H]1NC(c1cocn1)=O,1 F5078-0309,CCCOc(cc1)nnc1N(CC1)CCN1C(C1CCCCC1)=O,1 F393-0093,CN(C1=NCCN1c(cc1)c2cc1NC(c1n[nH]c-3c1CCc1c3ccc(OC)c1)=O)C2=O,1 G597-1053,O=C(CN(C=Nc1c2c(-c(cc3)ccc3Cl)no1)C2=O)N(CC1)c2c1cccc2,0 F6200-4090,OC1(CNC(c2c(C(F)(F)F)cccc2)=O)c(cccc2)c2OCC1,0 Y207-0576,CC(CCCC1)N1S(c(cc1)ccc1NC(C1CCC1)=O)(=O)=O,1 Z3609139058,COCCn1c(cccc2)c2c(C(Nc2nc(COC)n[nH]2)=O)c1,0 Z1239627249,O=C(CCCc1c[nH]c2c1cccc2)NC(Cc1ccccc1)C(NCc1ccccc1)=O,1 J004-1770,CC(C)c1noc(C(CCC2)N2C(c2noc(C3CC3)c2)=O)c1,0 F3382-4557,O=S(Cc(cc1)ccc1Cl)(c(cc1)nnc1N(CC1)CCN1c(cccc1)c1F)=O,1 F5016-0873,CSc1cccc(NC(C(NCC2CCN(Cc3cccs3)CC2)=O)=O)c1,0 Z2646124084,NC(c1csc(CNC(C2CCN(Cc3ccccc3)CC2)=O)n1)=O,1 Z2453610321,CN(C)C(Cn(cc1)c2c1ccc(NC(C1(CC1)F)=O)c2)=O,1 S972-0835,CC(C)CCNC(N([C@H](COc1cnccc1)CN1C)[C@@H](Cc2ccccc2)C1=O)=O,0 G501-0194,CN(C)c1ccc(C(CNS(c(cc2)cc3c2OCCO3)(=O)=O)N2CCN(C)CC2)cc1,1 F6752-2400,CC(C)(C)C(NC1CCN(Cc2nnc3n2CCC3)CC1)=O,1 Z2209097124,Cc(n(C)nc1)c1S(NC(C(C1)C1(Cl)Cl)=O)(=O)=O,0 F5854-4899,COCCN(Cc1cscc1)C(NCc1cccs1)=O,0 L285-2918,COc(ccc(-c(cc1)nnc1Nc(cc1)cc(F)c1F)c1)c1S(N1CCCC1)(=O)=O,0 G857-0460,O=C(CSC(C(CCC1)=C1N1Cc2cnccc2)=NC1=O)NC1CCCCC1,1 Z2178307858,CN(C)S(c1cc(C(Nc2nn(C)c(C3CC3)c2)=O)ccc1)(=O)=O,0 F2684-0021,COc1c(CCNC(CSC(C(CCCC2)=C2N2)=NC2=O)=O)cccc1,1 Z1154554003,CC(C)(CSc1nnc(N(C)C)s1)O,0 F6506-2654,OC(CNC(NCc1cccc2ccccc12)=O)(c1cscc1)c1cccs1,1 F640-0011,Cc1nnc(-c2cc(S(N(CC3)CCN3C(c(cc3)ccc3F)c(cc3)ccc3F)(=O)=O)c[nH]2)o1,0 F2774-1530,O=C(C=C1)N(Cc2cnccc2)N=C1c1cc2ccccc2cc1,1 Z1274560284,OCC(CC1)CN1C(C(C1)c2c1cccc2)=O,0 F2601-0023,CN(C)S(N(CC1)CCC1c1nc(cccc2)c2[nH]1)(=O)=O,0 F6811-1697,O=C(C=C1)N(Cc2ccccc2)N=C1N(CC1)CCN1C(N=C1N2C=CC=C1)=CC2=O,1 F6660-6444,O=C1N(Cc2cn(Cc(cccc3)c3F)nn2)C=CN(c(cc2)ccc2F)C1=O,1 F6739-7807,CN(Cc(cc1)cc2c1OCCO2)c(sc1ccc2)nc1c2S(C)(=O)=O,1 T500-1361,COc1ccc(CC2CC(CC3)(CCN3C(NCc(cc3)ccc3OC)=O)OCC2)cc1,1 F6246-1506,CCOC(N(CC1)CCN1C(CN1N=C(c2cccs2)N(C2CC2)C1=O)=O)=O,1 Z4444622205,CC(C(C)(C)O)n1ncc(C(O)=O)c1C,0 Z2482927251,Cc1noc(C(CCC2)CN2C(C(O)=O)c(ccc(Cl)c2)c2Cl)n1,0 F6573-7469,COc1c(CC(N(CCN2c3cnccc3)CC2=O)=O)cccc1,0 F6438-0083,Cc1nc(N2CCCC2)nc(C)c1NC(Cc(cc1)ccc1F)=O,0 Z2184040337,Cc1n[nH]c2nc(C)cc(C(N3C(C4CC4)C4(CCC4)C3)=O)c12,1 F1495-1604,O=C(c1cn(-c2ccccc2)nc1-c1cccc(Br)c1)N1CCOCC1,1 3336-2700,Cc1c(C(Nc(cc2)ccc2-c2cn(cccc3)c3n2)=O)sc(-c2ccccc2)n1,1 F6557-1999,CC(NC(CCSC)C(N(CCC1c(cccc2)c2Cl)CCS1(=O)=O)=O)=O,0 SC97-0832,O=C(NCc(cc1)ccc1F)N(CC1)CC1(CN(Cc1cccc(F)c1)CC1)NC1=O,0 Z2603485655,OCC1(CCN(Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1)O,0 F6448-2311,Cn1nnc(C(Nc2cn(CC3Oc(cccc4)c4OC3)nc2)=O)c1,1 E021-0405,CC(CCCC1)C1NC(C(C)(Cn1c2cc3c1ccs3)N(CCOC)C2=O)=O,0 Z4500949677,CC(CC1)(CN1C(c1n[nH]c(-c(cc2)ccc2F)c1)=O)c1cc(OC)ccc1,0 P894-0013,C(c1ccccc1)N(CC1)CCC1Nc1nnc(-c2nc(C3CC3)no2)c2ccccc12,1 SC45-0341,CC1n2nnc(CNC(c3c(C)nc(C)s3)=O)c2CN(C)C1=O,1 F3367-0045,Cc1cc(O)c(cc(cc2)C(Nc3ncccc3)=O)c2n1,1 Z4662119528,Fc1cc2ncccc2cc1-c1cnccc1,1 Z4898033659,CCN(c(ccc(C(NC1C(C)CCN(Cc2ccccc2)C1)=O)c1)c1NC1=O)C1=O,1 Y207-3684,Cc1cc(NC(CN2CC(CCC3)N3CC2)=O)cc(C)c1,0 Y501-2824,Cn(c1nc(C2CC2)c2)ncc1c2C(NC(CCC1)c2c1cccc2)=O,1 Z1656705349,CC(C(CC1)CN1C(Nc1cc(C(CCC2)=O)c2cc1)=O)O,1 Z1322691909,CC(CS(C)(=O)=O)C(NC1CCN(Cc2c(C)cccc2)CC1)=O,0 F0651-0181,Cc1cc(cc(CNC(c(c(F)ccc2)c2F)=O)cc2)c2n1C,0 Z1610754358,CC(C)(CN(CC1)C(N(C)C)=O)N1C(C1Cc2nccn2CC1)=O,0 Z2874297949,CNCCC(CC1)CCN1C(NCC(C1)NCc2c1cccc2)=O,0 S595-0555,O=C(C1(CC1)c1ccccc1)N(CCCC1)C1c1noc(COc(cc2)ccc2F)n1,1 F3385-6185,CC(Oc(cc(cc1)OC)c1C1=O)=C1Oc(cc1)ccc1C(Nc1nc(cccc2)c2[nH]1)=O,1 F6713-1860,Cc1cc(C)nn1C(C=C1)=NN(C(CC2)CCN2c2nc(cccc3)c3o2)C1=O,1 Z1744866028,O=C(CC1)Nc(cc2)c1cc2S(N(CC1)CCC1Nc1nccs1)(=O)=O,1 V021-6373,O=C(Nc1cccc(Cl)c1)N(CC1)CCN1C(N1)=NC(CN(CC2)CCN2c(cccc2)c2F)=CC1=O,1 Z2094654199,Cc1cc(Oc2c3sccc3ncn2)c(C)c(C)c1C#N,0 Z1160863749,Cc1cccc(C(c2nccc(C)c2)=O)c1,0 S823-2404,Cn1c(C(N[C@@H](C2)[C@@H](CO)CN2C2CCOCC2)=O)ncc1,1 F5831-2540,CCOc(c(C)c1)c(C)cc1S(NC(C)Cc1cccs1)(=O)=O,0 F6438-0100,CC(C)(C)C(Nc1c(C)nc(N2CCOCC2)nc1C)=O,0 F3305-0170,Cc1nn2c(SCC(N)=O)c(Cc3ccccc3)c(C)nc2c1-c1ccccc1,1 F6573-7026,O=C(c1cc(F)cnc1)N(CCN1c2ncccc2)CC1=O,0 Z1550678144,O=C(c(cccc1)c1-c1ccc(C(F)(F)F)cc1)NCc1noc(C2CC2)n1,1 Z2700772200,C(C(C12)C2c2nc(-c3nnc[nH]3)no2)c2c1cccc2,1 F6360-9419,Cc1noc(C)c1CC(N(C1)CC1Oc1cnccc1)=O,1 F6481-4266,Cn(cc1C(N(CC2)CCSC2c2cccs2)=O)nc1OC,0 Z2960057026,COC(C(C(N1C[C@@H](c(cc2)ccc2Cl)OCC1)=O)=CN1)=CC1=O,0 F821-0101,COc(cc1)cc(NC(C(CCC2)CN2S(c(cc2)cc(N3)c2OCC3=O)(=O)=O)=O)c1OC,0 F6573-8731,O=C(CN(CC1)S(c2c(C(F)(F)F)cccc2)(=O)=O)N1c(nc1)ncc1F,0 Z401144360,Cc1c(CN2CCN(CC(Nc3nccs3)=O)CCC2)cccc1,1 F455-0963,OC(C(N(Cc1ccncc1)C1c(cc2)ccc2Br)=O)=C1c1ccccc1,0 F6435-7010,CC(C)(C)S(C(CC1)CN1C(COc(cccc1)c1OC)=O)(=O)=O,0 F3407-4538,Cc1ncc2c(SCC(NCc3ccco3)=O)ncnc2n1,1 Z2297807768,CC(C)C(N(CCC1)CCc2c1cccc2)=O,0 F6497-7991,CCSc(cccc1)c1C(N(CC1)CCC1c1n[nH]c(C(NCC(F)(F)F)=O)c1)=O,0 Z1038543424,CN(C)CCn1ncc(NC(c2c(-n3cccc3)n(-c3cccc(C(F)(F)F)c3)nc2)=O)c1,1 F5971-0237,CC(CNC(C(NCc1ccc(C)cc1)=O)=O)(COC)O,0 Z1171482759,CCOC(C(Cc1ccccc1)N(C)S(c(cc1)cc(C(N2)=O)c1NC2=O)(=O)=O)=O,0 Z3584454264,OC1(COC1)c1cnc(NC(C(CC2)C3N2CCOC3)=O)s1,1 F6261-3879,Cc1c(CNC(C(CC2)CCN2S(C)(=O)=O)=O)sc(-c(cccc2)c2Cl)n1,1 Z3077780697,Cn1nncc1C(C1)(CN1c(nc1)ncc1Br)O,0 Z2410808933,O=C(C1C(CC2)CC2C1)NS(Cc1cc(COC2)c2cc1)(=O)=O,1 Z1416717436,CC(C1)(c2ccccc2)OCCN1C(NCc1c(C)n(C)nc1C)=O,0 F3225-3506,COCCNC(c(c1nc2ccccc2nc11)c(N)n1-c(cc1)ccc1Cl)=O,1 D347-3084,O=C(C1)N(Cc2ccccc2)CC1c1nc(cccc2)c2n1CCC1CCCCC1,1 SA46-1647,COc1cc(C(N(C2)CC2(C2)OCC2N2CCCCC2)=O)cc(OC)c1,0 F2205-0189,CC(C)(Cc1ccc2)Oc1c2OCC(Nc1nc(cccc2)c2s1)=O,1 V013-4099,CCc(cccc1)c1NC(NC(CCCC1)C1NC(c1csc(COc(cccc2)c2F)n1)=O)=O,0 F2602-0120,O=C(CN(CC1)CCC1c1nc(cccc2)c2[nH]1)Nc(ccc(F)c1)c1F,0 Z2182258262,CC1CN(CCNC(N(C2)CC2(c2ccccc2)O)=O)CCC1,0 F5354-0173,Cc1c(C(NCc2ccc(C)cc2)=O)c(C(F)(F)F)nn1C,0 F6253-3735,O=C(c1cc(c(OCc2ccccc2)ccc2)c2[nH]1)NCc1cccs1,1 Z4970359191,O=C(c(ncs1)c1Br)Nc1nc(-c2ncccc2)nc2c1ccs2,0 F6571-0695,CN(C)C(CNC(C1(CC1)c(cc1)ccc1F)=O)c1cc(cccc2)c2o1,0 F6809-5853,CC(c1c(CC2)cccc1)N2c1nc(OC)cc(OC)n1,0 F5262-0391,CN(C)C(CNC(C(Nc(cc1)ccc1C(OC)=O)=O)=O)c1cccn1C,0 F6482-6837,O=S(NCc(cc1)cnc1-c1ccco1)(N1CCOCC1)=O,1 SA99-0301,NC(C(CC1CC1)(CC1)CCN1C(Nc(cc1)cc2c1OCCO2)=O)=O,1 Z3101108925,COCCn(cc1)nc1NC(C(CC1)(c2c1c(OC)ccc2)N)=O,0 Z1751361680,CC(C)(C)c1ccc(Cn2nccc2NC(N2CC3(CCC3)COCC2)=O)cc1,1 G741-1164,O=C(CN(C(C1)=O)c(cccc2)c2N1C(Nc(cc1)ccc1F)=O)N1CCCC1,1 F6760-5074,Cc1cc(F)cnc1C(N(CC1)CCN1c1ncc(C(F)(F)F)cc1)=O,0 K938-0630,O=C(C1CCC(CNS(c(cc2)ccc2F)(=O)=O)CC1)NCC1OCCC1,1 F6512-7562,Cc([nH]nc1C)c1S(N(CCC1)CCN1C(Cc(cccc1)c1OC)=O)(=O)=O,0 F6604-7750,CC(C)(C)C(C=C1)=NN(CC(C2)CN2C(C2OCCc3c2cccc3)=O)C1=O,1 Z1496767285,OCC(CCC1)CN1S(c(cc1)ccc1N(CCC1)C1=O)(=O)=O,1 F5033-7991,COC(c(cc1)ccc1C(NCC(CC1)CCN1C(c(cccc1)c1F)=O)=O)=O,0 F1916-3110,N#Cc1cccc(C(c2cccc(C(F)(F)F)c2)=O)c1,0 V004-7263,Cc1ccc(C(c2c(CC3)ccc(OCc4nc(C(NC5CC5)=O)cs4)c2)N3C(C2CC2)=O)cc1,1 F6685-3725,O=S(Cc(cccc1)c1F)(NC(C1)CN1c1ncnc2c1scc2)=O,1 Z999729838,NC(c1cccnc1N(CC1)CCN1C(c1c(cn[nH]2)c2ccc1)=O)=O,0 SB04-0221,CS(N(CC1)CC1N(CCNC(CCn1nccc1)=O)C1CCOCC1)(=O)=O,0 Z2271412448,C(C1OCCCC1)Nc(cc1)nn2c1nnc2,1 5240-0009,CC(C(Cc1ccc(C)cc1)C(N1c(cc2)ccc2C(O)=O)=O)C1=O,0 Z3647481143,CNc1nc2ccccc2c(C(N[C@@H]2[C@@H](CCC3)[C@@H]3[C@H]2CO)=O)c1,1 D638-0017,Cc1nc(N2CCCC2)cc(Nc(cc2)ccc2NC(Nc(ccc(OC)c2)c2OC)=O)n1,0 Z1561898041,COc1cc(CN2CCCCCC2)cc(Cl)c1OCC(N)=O,0 Z1370789139,CC(C)c(cc1)ccc1C(Nc(scc1)c1C(N(CC1)CC(CN2)N1C2=O)=O)=O,1 Z1609243137,Cc1cc(C(N(CC2)CCC2C(c2ccccc2)=O)=O)cc(O)n1,1 Z2370552720,CC(CC1)CCN1C(c(cc1)cnc1N(CC1)CC1NC(C)=O)=O,1 F3407-0019,CC(c(cc1)ccc1F)NC(C(CC1)CCN1c1nc(-n2nc(C)cc2C)ccn1)=O,1 SA99-0832,Cc(c(NC(N(CC1)CCC1N(CC1)CCC1(CC1CC1)C(N)=O)=O)ccc1)c1F,0 F6539-3813,CS(NCCCc1cc(cccc2)c2o1)(=O)=O,0 F6481-2887,O=C(c1csc(-c2ccccc2)n1)N(CC1)CCSC1c(cc(cc1)F)c1F,1 F798-0620,O=C(CSc(n1-c2c3scc2)nnc1N(CC1OCCC1)C3=O)Nc1cc(CCC2)c2cc1,1 G008-1151,Cc1noc(-c2cc(S(N(CC3)CCN3c3cc(C(F)(F)F)ccc3)(=O)=O)c(C)cc2)c1,0 SD12-0042,Cc1noc(C)c1C(N(CCN1)C(Cc2nc(C)no2)C1=O)=O,1 E632-2280,O=C(Nc1c(CCCC2)c2ccc1)N1CC(CN(CC2)Cc3c2cccc3)CCC1,1 Z992354990,Cc(cc1)cc(C(N2C(CC3)CC3C2)=O)c1F,1 Z2237634535,CNc1nnc(SCC(CF)O)s1,0 F6482-6587,O=C(CN(C=Nc1c2cccc1)C2=O)NCc(cc1)cnc1-c1ccco1,1 Z1449216039,COCCC(N(CC1)CCC1NC(Cc1cscc1)=O)=O,1 F5382-0103,Cc(cc1)ccc1NC(Cc1csc(Nc2ccccc2)n1)=O,0 F6036-2495,O=C(NC(c1ccccc1)c1ccccc1)N(C1)CC1c1nc(Cc2cccs2)no1,1 SA68-0943,Cn1c(C(NCCN(C(CC2)CCN2C(C2CC2)=O)C2CCOCC2)=O)ncc1,1 Z145250190,OC(c(cc1)ccc1S(N(CC1)c(cc2)c1cc2S(N1CCOCC1)(=O)=O)(=O)=O)=O,1 Z2482883709,CC(NC1CN(Cc(c(C(O)=O)ccc2)c2Cl)CCC1)=O,0 L694-0121,Cc(cc(cc1)Cl)c1OCC(N(CC1)CCN1S(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O)=O,0 F6574-1588,O=C(c(s1)ccc1Cl)NCc1nccnc1-c1cccs1,1 Z3369019280,CC(c1nnc(C(F)(F)F)[nH]1)NC(c1c(Cc2ccccc2)n(C)nc1)=O,1 F6554-1100,Cn1nc(C(CCC2)CN2S(c2cccc3cccnc23)(=O)=O)cc1,1 Z3645641153,CC(C(NCc(cc1)c(C)nc1Cl)=O)n1nc(C(F)(F)F)cc1,0 Z2446456078,CCCN(CC(O)=O)C(Cc1cc(C)nn1C)=O,0 F3407-4980,CC(CCc1ccccc1)NC(Cc1nnc(-c2ccc(C)cc2)o1)=O,1 F2572-0109,O=C(C(Nc(cccc1)c1Cl)=O)NCC(c(cc1)cc2c1OCO2)N1CCOCC1,1 Z1324331417,Cn1ncc2cc(C(Nc3ccc(Cc4ccncc4)cc3)=O)cnc12,1 Z1907921977,CCCCc(cc1)ccc1N(CC(C1)C(Nc2cc(N(CC3)C(N)=O)c3cc2)=O)C1=O,0 S924-0090,Cc1noc(C)c1CN(C(CC1)(CC2)CCN2C(c2c(C)onc2C)=O)C1=O,0 7213-0370,CC(CCCC1C)N1C(CSc1nc(-c(cc2)cc(OC)c2OC)cc(C(F)(F)F)n1)=O,0 S233-1729,O=C(COCc1ccccc1)NC[C@](CCC1)(CC2)[C@@H]1N(CC1CCCCC1)C2=O,1 F6443-1530,COC(CC1)CCN1c(cc1)ccc1C(NCc1nc(cccc2)c2[nH]1)=O,1 F6178-6720,Cc(c(S(NCC(CC1)CCN1C(c1cocc1)=O)(=O)=O)ccc1)c1Cl,0 Z3803478213,Cc(cc1)cc2c1OCC(C(NC(CC1)(CC3)CCC13C(O)=O)=O)=C2,1 Z1546128461,CC(C)(C)C(C1)OCCC1NC(Nc1cn(CCN2CCOCC2)nc1)=O,1 F6442-5987,CN(C(C=C1)=O)N=C1C(N(CC1)CCC1N(CC1)CC1OC)=O,1 S689-0044,N#Cc(cc1)ccc1C(N(C1)CC1N(CC(C1)C(N2CCOCC2)=O)C1=O)=O,1 G395-1648,O=C(CCc1nnc(cc2)n1nc2NCCCN(CCC1)C1=O)NC1CCCCC1,1 SB95-0250,CS(N(CCN1CCCCC1)C(CCC1)CN1C(c(cc1)ncc1F)=O)(=O)=O,1 F6806-6692,O=C(C1CC1)NC(CCC1)CN1c1nc(cc2OCOc2c2)c2s1,1 L527-0127,O=S(c1cccc2nsnc12)(NCc(n1C2CCCCC2)nc2c1nccc2)=O,1 Z364616232,NC(c(cc(cc1)NC(C2(CCC2)c2cc(F)ccc2)=O)c1F)=O,0 F6617-4348,COc(ccc(CN(CCC1)CC1c1nc(C2CC2)no1)c1)c1F,0 T158-1062,Cc1cnc(C(CC2)CN2S(Cc2ccccc2)(=O)=O)n1CCCOC,0 S629-1692,Cc1c(C(N2Cc(cc(CCC(NC3CC3)=O)cc3)c3OCC2)=O)sc(C)n1,1 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D470-1752,O=S([C@@H](CS(C1)(=O)=O)[C@H]1N(CC1)Cc2c1cccc2)(c1ccccc1)=O,0 SB66-0853,COc1ccc(C2(CCCCC2)C(N(C[C@H]2CCC3)C[C@@H]2NC3=O)=O)cc1,1 Z2904995004,OC1CN(CC(CCC2)(CN2C(OCc2ccccc2)=O)O)CCC1,1 Z1620046768,O=C(CN(CC1)CCC1n1nc(C(F)(F)F)cc1)NCC1CCCCC1,1 SB59-0190,Cn1c(C(C2)C(C3)(CN3C(c3cccs3)=O)CN2S(C)(=O)=O)nnc1,0 F6437-0153,Cc1nsc(C(N(CC2)CCN2C(C2OCCC2)=O)=O)n1,1 F6561-9228,O=C(c1cc(cccc2)c2o1)NCc1cn(-c2cnccc2)nn1,1 8019-1540,OC(c(cc1)ccc1S(NC(C(F)(F)F)(C(N1C2CCCCC2)=O)NC1=O)(=O)=O)=O,1 F3386-2713,Cc(cc(c(S(NCc(cccc1)c1Cl)(=O)=O)c1)OC)c1Br,0 Z4607405943,CCCC(Oc(cc1)ccc1C(NC(C)(CC1)CS1(=O)=O)=O)=O,0 F6464-0967,COc1ccc(C(CCCC2)CN2C(c2cccc(C(F)(F)F)c2)=O)cc1,0 E852-3339,CC(Cn(c1c2)nc2C(NCc2ccc(C)o2)=O)(C(NCc2ccc(C)cc2)=O)N(C)C1=O,1 Z2911838697,CCCC(C)(C)C(NC1CC(C2)(CC2C(O)=O)OCC1)=O,1 Z3091769803,CCC(N(CCC1)CCN1S(C[C@@H]1[C@@H](C)CCC1)(=O)=O)=O,1 Z826084542,Cc1cc(CNC(c(cccc2)c2F)=O)no1,0 F6608-3900,CC(C)N1CCN(CC#CCOC(CC2)CCN2c2nccc3c2cco3)CC1,1 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L464-0463,CC(CCCC1)N1S(c1ccc(-c2c(C)c(C)no2)s1)(=O)=O,1 F6798-4266,Cc1cc(C)nn1-c1cc(N2CC(CN(C3)C(NCC4OCCC4)=O)C3C2)ncn1,1 F6386-0313,O=C(C(C1)CN(C2CCOCC2)C1=O)N1CCN(Cc2ccccc2)CC1,1 F5669-1427,O=C(CSc1nc(cccc2)c2o1)N(CC1)CCN1c1ncnc(N2CCCCC2)c1,1 F6809-4185,Cc1cc(NCc2cc(OC)cc(OC)c2)ncn1,0 F6544-1128,N#Cc(cc1)cnc1N1CCC(Cn2nccc2)CC1,1 Z2648491257,Cc1nnc(CN(C)C(Cc2csc(-c3nccnc3)n2)=O)s1,1 F6783-6382,Cc1noc(CN(C2)CC(C3)C2CN3c2nc(cccc3)c3n2C)c1,1 F6195-0930,O=C(C1CC1)Nc1nc(CCN(C2)C(NCc3cccc4ccccc34)=O)c2s1,1 Z1455319928,OC([C@@H](c1ccccc1)NC(C(CCC1)CN1C(Cc(cc1)ccc1F)=O)=O)=O,0 SB32-0135,Cc1n[nH]c([C@@H](C2)[C@@H](COC)CN2S(Cc2ccc(C)cc2)(=O)=O)n1,0 SA24-1720,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(Cc1cc(OC)ccc1)=O,0 SC76-0761,CCN(C(C)C)C(CN(C([C@]1(COCc2ccccc2)[C@H]2C1)=O)c1c2cccc1)=O,1 Z1901265057,CC(C)(CC1)OC1C(NC(CC1)C11CCCC1)=O,1 Z1404668720,Cc1cnc2c(S(N3C(CC(O)=O)COCC3)(=O)=O)cccc2c1,0 Z1127030725,Cc1c(C(NN2C)=O)c2nc(C)c1CC(NCc(cccc1)c1Cl)=O,0 Z2949965342,C[C@](CN(C)C1)(C2)[C@H]1CN2C(Nc(cc1)nn1-c(nccc1)c1F)=O,1 F6479-2599,CC(NC(CCSC)C(N(CC1)CCC1Oc1ccncc1)=O)=O,0 Z2920001662,NC(CN(C1CCOCC1)C(C(c1nccs1)(F)F)=O)=O,1 F1407-0004,CC1N(CC(CN(c(cccc2)c2OC)S(c2ccccc2)(=O)=O)O)C(C)CCC1,1 F3255-0159,CC(c1c(C)n(CC(CN2CCNCC2)O)cc1C)=O,1 Z3611960708,N#Cc(cc1)cc(F)c1N(CC1)CCC1C(NCCNC(C1CCC1)=O)=O,1 C879-1502,Cc1c(CNCC2OCCC2)c(C(O)=O)c(C)n1Cc1cccc(Cl)c1,0 Z963142868,OCC(CCC1)CN1C(NCCc1nccs1)=O,1 Z2827246786,OC1(CNCCC1)C(NCC1=CC=CNC1=O)=O,1 Z2439171613,Cc1cccc(C2(CCC2)NC(Nc2c(C(F)F)n(C)nc2)=O)c1,1 F6415-0139,COCCN(Cc1cocc1)C(c1c(C(F)(F)F)cccc1)=O,0 SA55-3957,Cn1nc(CCNC(CN(c(ccc(Cl)c2)c2O2)C2=O)=O)c2c1CCOC2,1 S759-0370,CCC(N(CC1)CCC1[C@H]([C@@H](C1)Oc2ccccc2)N1C(C)C)=O,0 V023-7225,CC(C)C(C)N(Cc(cc(cc1)NC(C2CCCC2)=O)c1N(C)C)C(Nc1cccc(F)c1)=O,1 Z1885584128,Cn1c(C(CCC2)CN2C(c2cc(-c3c(C(F)(F)F)cccc3)n[nH]2)=O)ncc1,1 F6560-4261,CC(C)C(Cn1ncnc1)NC(COc(ccc(Cl)c1)c1Cl)=O,1 Z1334112872,CC(C(CC1)CCN1C(Cc1coc2c1c1ccccc1cc2)=O)(C(N1)=O)NC1=O,1 E781-0729,CC(CC(C)C1)CN1c1nc(n(C)nc2)c2c(Nc2cccc(OC)c2)n1,0 SD25-0413,COc1cc(C(N2CC3(CCCCC3)C(CCC(N3CCCC3)=O)C2)=O)cc(OC)c1,1 Z2221093848,O=C(c(cn1)cc(Cl)c1OC1CCCCC1)NCc1nnn[nH]1,1 Z253853810,Cc1cc(C)c(C(N2CCN(CC(NC3CC3)=O)CC2)=O)c(C)c1,1 Z925744964,Cc1nc(CCC(C2)NC(NC(Cc3ccccc3)Cc3ccccc3)=O)c2cn1,1 Z2945928647,COc1cccc(N(CC2)CCN2C(c2cc3cccn3cn2)=O)c1,1 Y043-5877,CC(C)c(cc1)ccc1N(C(C(CC(NCC1Oc(cccc2)c2OC1)=O)N1)=O)C1=O,1 F9995-0144,Oc1cc2nccc(-c3c(CCC4)n4nc3-c3ncccc3)c2cc1,1 F6515-4518,O=C(CSC1CCCC1)NCc1cc(-c2cccs2)cnc1,1 G229-0073,O=C(CC(C1)c2nc(-c3ccc(C(F)(F)F)cc3)no2)N1c(cc1)ccc1Cl,0 Z1680787376,Oc1ccc(CCC(NC(CC2)CCN2C2CCCC2)=O)cc1,0 F6675-9561,Cc1cccnc1OCC(CC1)CCN1C(Nc(cccc1)c1Cl)=O,1 F6454-1027,O=C(NCC1CCN(CC(F)(F)F)CC1)NC1(CC(C2)C3)CC3CC2C1,1 Z2179551255,CCN(c1nc(C2CC2)cc(C(NC(C(O)=O)c2ccc(C)cc2)=O)c1C(N1)=O)C1=O,1 E958-1001,C(c1cccn1-c1nnc(N(CC2)CCN2C2CCCCC2)s1)NC1CCCCC1,1 F3095-0662,CC(C)(C)c(cc1)ccc1C(N1CCCCCC1)=O,0 F993-0391,Cc(ccc(Cl)c1)c1N(CC1)CCN1C(c1cc(C(N(C)C(N2C)=O)=O)c2s1)=O,0 F6518-4458,O=S(c1cc(C(F)(F)F)ccc1)(N(CC1)CC1c(cc1)cc2c1OCO2)=O,0 SB35-0094,Cc1n[nH]c([C@H](CC(C2)(F)F)N2C(c2nc3ccccc3cc2)=O)n1,0 F5857-6040,CC(CNC(Nc1cccc(Cl)c1)=O)(C1CC1)O,0 F6381-4336,O=C(CCC1)N(CCS(N(CCCC2)CC2c(cc2)ccc2F)(=O)=O)C1=O,1 S591-0285,COc(ccc(NC(N(C1)CC1N(CC1CC1)C1CCOCC1)=O)c1)c1OC,0 K810-0040,CN(Cc1ccccc1)c1c(c(CCCC2)c2s2)c2nc(Cc2ccccc2)n1,0 P664-1760,CCCc1cc(N(CC2)CCN2C(COc(cc2)ccc2Cl)=O)nc2nnc(C)n12,0 F792-0433,O=C(c1nnc(C(CCC2)N2C(c2cccs2)=O)s1)Nc(cc1)ccc1F,0 Z2982755889,O=C1NCCN(Cc2cn(CCN3CCCC3)nn2)C1,1 D473-1744,CC(C)(CS(N1c2cccc(C(N(CC3)CCN3c3cccc(Cl)c3)=O)c2)(=O)=O)C1=O,1 Z1783796131,Cc(cc1)cc(Cc2noc(C(C3)(Cc4c3cccc4)O)n2)c1OC,0 F6559-3621,O=C(C1Oc(cccc2)c2OC1)NCc1nc(C(CC2)CCC2(F)F)no1,1 F1143-0420,Cc1c(C)sc2ncnc(SCC(Nc(c(F)ccc3)c3F)=O)c12,0 Z2056091534,CN(C[C@H]([C@H]1CCC2)N2C(c2csc(Cc(cccc3)c3F)n2)=O)C1=O,1 Z3687050342,Cc1nc(ccc(C(N[C@@H](CC(Cn2ncc(Cl)c2)C2)[C@H]2O)=O)c2)c2n1C,1 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F5448-0234,CCOC(N(CC1)CCN1C(c1csc(Nc2cccc(Cl)c2)n1)=O)=O,1 Z2218746093,NC(C1(CCCCC1)NC(c1c(C2CC2)ocn1)=O)=O,0 F5496-0108,O=C(c(cc1)cc2c1OCO2)N(CC1)CCC1c1nnc(C2CC2)s1,1 F6525-2046,Cn(c(CNC(c(cccc1)c1S(C(F)F)(=O)=O)=O)c1)nc1-c1nccnc1,0 SB54-0721,COC[C@@H](CN(C1)C(c2cc(Br)cnc2)=O)[C@H]1c1nnc(-c2ccccc2)o1,0 Z2951830884,CC(c1nnnn1C)N(CC1)CCC1c1ncco1,1 S607-0343,COCCN(c1cccnc1N1[C@@H](CCC2)CN2S(c(cc2)ccc2F)(=O)=O)C1=O,1 P073-0637,O=C(C1OCCC1)NCCN(c(nccc1)c1N1Cc(cc2)ccc2F)C1=O,1 Z1432208511,CC(C)(C)c1ccc(C(N(CCC2=NN3C)CC2=CC3=O)=O)s1,0 F6676-2638,CN(C(CC1)CCN1C(c(cccn1)c1OC)=O)c1ncccc1,0 F6520-1053,O=C(c1cccs1)NCCc1ccc(-c2cscc2)s1,1 C470-0292,CC1CN(Cc2nc(N(C)C(N(C)C3=O)=O)c3n2Cc2c(C)ccc(C)c2)CCC1,0 Y020-3471,O=C1N(CC2OCCC2)C=Cc2c1cnc(N1CCOCC1)n2,1 Z1726968130,Cn1ncc(C(NCc2nc(N3CCOCC3)ccc2)=O)c1,1 Z1495992366,Cc1cc(C(NCC2(CCCCC2)C(O)=O)=O)n[nH]1,0 F6507-5470,CC(CNS(c1cccc2ccccc12)(=O)=O)(COC)OC,0 SB75-0977,Cc1noc([C@@](C[C@@H](C2)NS(Cc3ccccc3)(=O)=O)(C3)[C@@H]2CN3S(C)(=O)=O)n1,1 Z899898642,O=C(CN(c(cccc1)c1N1)C1=O)N(CC1)CCN1C1CC1,1 F5821-0115,O=C(Nc(cc1)ccc1F)N1CCN(Cc2nc(cccc3)c3n2Cc2ccccc2)CC1,1 C260-2401,Cc1cc(NC(CN(c(cccc2)c2C(N2CC(CC3)CCC3C(NC3CCCC3)=O)=O)C2=O)=O)n[nH]1,1 Z1999934576,CC(CN(C1)C(NCCc2cc(C(NC)=O)ccc2)=O)N(C)C1=O,0 L872-0023,Cc1c(CSC(N2)=NC(CCN(CCOC)C3)=C3C2=O)nc(-c(cc2)cc(OC)c2OC)o1,0 Z2954729113,O=C(c1cc(C(CCC2)=O)c2nc1)NCC(C1)Cc2c1cccc2,1 Y041-6028,Cc1nc(N(CCC2)CC2C(NCC2C(CCCC3)N3CCC2)=O)nc(C)c1,1 Z2766154363,Cn1nccc1C(N[C@@H](CCC1)[C@@H]1Oc1c[nH]nc1)=O,1 L309-1346,O=C1N(Cc2noc(C3CCC3)n2)c(cc(cc2)S(Nc(cc3)cc(F)c3F)(=O)=O)c2OC1,0 8015-0411,Cc(c(C)c1)cc2c1ncn2C(CC(N1c(cc2)ccc2Cl)=O)C1=O,0 F6743-8019,CC(C)(C)C(N(C)C(CCC1)CN1c1nc(C)ns1)=O,0 F6480-1435,O=C(Cc(cccc1)c1F)N(CCC1)CC1Oc(ccnc1)c1Cl,1 F5033-2863,Cc(cccc1)c1OCC(NCC(CC1)CCN1S(C)(=O)=O)=O,0 SC60-1037,CC(C)(CN(C(C1)C(N2CCOC)=O)C2=O)CN1C(c1nccc2ccccc12)=O,1 8013-3564,Cc1cc(NC(C(C2)C(c3ccccc3)OC2=O)=O)no1,1 F5939-3004,O=C(NCc(cc1)ccc1Cl)N(CC1)CCC1Oc1nc(c(F)ccc2)c2s1,1 Z1558644832,CN(CC1CCOCC1)C(NCc1ccc(CN(CCC2)C2=O)cc1)=O,1 Z4082405889,CC(C(N1C(C2)C2CC1)=O)Nc1ncc(C(F)(F)F)cc1,0 F6529-1352,CN(C(C(F)(F)F)=NN1C(CC2)CCN2S(CCOc2ccccc2)(=O)=O)C1=O,1 F6438-3784,CN(C)c1nc(CNS(Cc2ccccc2)(=O)=O)nc(N2CCOCC2)n1,1 T368-3349,Cc1noc(C)c1S(N(CC1)CC1n1c(-c(cc2)ccc2F)nc2cccnc12)(=O)=O,1 Z1478173377,Cc1cccc(S(Cc2noc(C3CCCCC3)n2)(=O)=O)c1,0 SB36-0662,O=C(c1cn(C[C@H](C2)N(Cc3cccs3)CC2(F)F)nn1)N1CCOCC1,0 F5791-0975,CC(C)(C)c1noc(NC(C2(CCCC2)c2cccs2)=O)c1,1 Z1426011531,CC(C1CCOCC1)NC(C=NN(C)C1=O)=C1Br,0 F6556-1144,O=C(c(o1)ccc1Br)NCC1(CCSCC1)N1CCOCC1,1 F6477-0474,O=C(CSC1CCCC1)N(CC1)CCN1c1nc(-c2cscc2)cs1,1 Z1286844273,CN1c(cc(cc2)NC(C3CN(CC(F)(F)F)CCC3)=O)c2OCC1=O,1 F3296-0372,Cc1cnnn1-c(cc1)ccc1C(Nc(cc(cc1)Cl)c1Cl)=O,0 SA23-1283,Cc(nc1)cnc1C(N(C1)CC1N(C1)[C@H](CN(C)C)CC1(F)F)=O,0 Z1973500408,N#Cc(s1)ccc1S(NCC(NCC(O)=O)=O)(=O)=O,0 E589-5256,O=C(C(CCC1)CN1S(c(cc1)cc(C=C2)c1NC2=O)(=O)=O)Nc(cc1)cc(Cl)c1F,0 Z2352632031,CC(C(O)=O)c1cc(NC(CC2(CCC2)OC)=O)ccc1,0 F1562-0175,OC(CN(CC1)CCN1c1ncccc1)COCCOc(cc1)ccc1Br,1 F2758-0743,O=C(c1cc(-c2ccco2)n[nH]1)NCC(c1c2cccc1)=NN(C1CCCC1)C2=O,1 F2370-1337,O=C(c1ccco1)NCC(C1)CN(Cc(cc2)ccc2F)C1=O,1 F6359-1574,CC(C)S(N(CC1)CCC1Oc(cc1)ncc1Cl)(=O)=O,0 F6523-2296,CCOC(CCNC(N(CC1)CCC1N(C(c(cc(cc1)F)c1N1)=O)C1=O)=O)=O,1 F6512-6591,O=C(c(cccc1)c1OC(F)(F)F)N(CCC1)CCN1S(c1c[nH]cn1)(=O)=O,0 F6477-0310,O=C(c(cc1)ccc1OC(F)(F)F)N(CC1)CCN1c1nc(-c2cscc2)cs1,0 Z1265656295,CCn1nc(C)c(NS(c2ccnn2C)(=O)=O)c1C,0 Z1531826232,CCc(onc1C)c1NC([C@@H]1C(C)(C)C1)=O,1 Z1443860322,O=C(NCc(cc1)cnc1-n1cncc1)N(CC1)CCN1C1CCCCC1,1 F6359-1866,COc1cc([nH]c(C(N(CC2)CCC2Oc2ncccc2C#N)=O)c2)c2cc1,1 C548-3181,O=C(C(CCC1)N1S(c1cccc2nsnc12)(=O)=O)Nc1nc(ccc(Cl)c2)c2s1,0 F6525-4816,Cc(n(CCNC(c1c(C)nns1)=O)nc1C)c1-c1ccccc1,1 Z3357001786,CN(C(CCC1NC(Cc2nc(C(F)(F)F)cs2)=O)=O)C1=O,1 F6805-9845,Cc1csc(NC(CN2CC(COc(nccc3)c3Cl)CCC2)=O)n1,1 Z1608256169,CC(C)c1noc2nc(C3CC3)cc(C(N(CC3)CC3(c(cc3)ccc3F)O)=O)c12,0 Z2465401118,CCc1ccc(C(CNCC2)N2C(c2cnc(C(F)(F)F)cc2)=O)cc1,0 C470-0272,CC1CN(Cc2nc(N(C)C(N(C)C3=O)=O)c3n2Cc(cccc2)c2Cl)CC(C)C1,0 T473-0254,O=C(c1cccs1)N(CC1)CCN1c1cc2nnc(C3CC3)n2nc1,1 Z2764167166,Cc1nnc(C2C(C3)(CN3C(C(C3(CCC3)O)(F)F)=O)CN(C)C2)[nH]1,1 SC15-0374,COCC(C1)CN(CC(CC2)CCN2C(C2(CCCC2)c2ccccc2)=O)C1=O,1 Z1416997984,COc1cccc2c1CCC2NS(N1CCOCC1)(=O)=O,0 Z85886785,OC(CNC(c(cc1)cnc1Cl)=O)=O,0 F6359-2955,COc(ccc(CC(N(CC1)CCC1Oc1nccnc1)=O)c1)c1OC,1 F6211-0013,O=C(c1nn(CCCO2)c2c1)Nc1c(CCCC2)c2no1,1 F6445-7197,CN(C=C(C(NCc1nc(cccc2)c2[nH]1)=O)C(OC)=C1)C1=O,1 V006-5173,CCOCCn1c(cccc2)c2c(C(CC2)CCN2S(c2cccc(Cl)c2C)(=O)=O)c1,0 SD03-0403,CCC(CC)NC(CN(CC(C1)(CC2)CCN2S(C)(=O)=O)C1c1nc(C)no1)=O,0 F6286-0486,O=C(C1(CC(C2)C3)CC3CC2C1)NCCc1nc(C2CC2)cc(C(F)(F)F)n1,1 Z2352634412,CC(C(O)=O)c1cc(NC(Cn2ncc(C)c2)=O)ccc1,0 F6796-9161,CCc1ncnc(N(C)CC(CC2)CCN2c2nccn3nccc23)c1F,1 F6244-2168,O=C(c1ccco1)NCC#CCN1CCCCCC1,1 S556-0474,O=C(COc1ccccc1)N(C1)CC1Oc(cc1)ccc1-c1noc(C2CC2)n1,1 F6353-6422,O=S(c(cccc1)c1OC(F)(F)F)(NCC(c1ccco1)N1CCSCC1)=O,1 Y205-6097,Cc1cc(-c(n2CC3OCCC3)nnc2SCC(Nc2nnc(C)s2)=O)cs1,1 Z849707444,CCOc1ccc(C2(CNC(c(cccc3)c3N(CCC3)C3=O)=O)CCOCC2)cc1,0 F2135-0860,CCSc1nc(N2CCOCC2)c(cnn2CCN)c2n1,1 F6444-0898,O=C(NCc(cc1)ccc1Cl)N(CC1)CCC1N1C(COCc2ccccc2)CCC1,1 Z2848379861,Cc([nH]nc1NC(C2c3ccnn3CCC2)=O)c1-c(cc1)ccc1Cl,1 F6564-3775,CC(C(N(CC1)CCN1c1cccc(Cl)c1Cl)=O)N1N=C(C2CC2)C=CC1=O,0 J026-3623,Cc1c(CN(C(c2c(N3C)nc(C)cc2C)=O)C3=O)nc(-c(cc(cc2)Br)c2OC)o1,1 Z2958645853,Cc1noc([C@@H](C[C@@H](C2)OC)N2C(c2cn(cccc3C)c3c2)=O)n1,1 Z4105195158,CCn1nc([C@H](C)O[C@H](C)C2)c2c1C(N(CC1)Cc2c1nc(N)nc2)=O,0 G794-2480,Cc1c(C(NCCCN2CCOCC2)=O)c(-c(cc2)ccc2Br)no1,1 Z1926993945,Cc1nccc(C(N(CCC2)CC2c2nncn2C2CC2)=O)c1,1 M597-0121,O=C(c(cc1)ccc1-c1nc(N2CCCC2)ncc1)NCCCN1CCCCC1,1 F6465-0192,Cc1c(C(NCC(CN(C=CC=C2)C2=O)O)=O)c(-c(cccc2)c2Cl)no1,1 SB03-0356,Cc1c(CN(C)CCN(C2CCOCC2)C(CCC2)CN2C(C2CC2)=O)scn1,1 Y043-3706,O=C(C(CC1=O)CN1c1n[nH]c2c1cccc2)NCCc1nccs1,0 F6125-0259,O=C(C(C1)CN1C(c1cccs1)=O)N(CC1)CCN1c(cccc1)c1Cl,0 F6782-7702,O=C1N(CC2COCCC2)C=CN(c(cc2)cc(Cl)c2F)C1=O,1 Z2299099620,Cc1coc(C)c1C(N(CC1)CCN1c(cc1)ncc1OC)=O,1 F1904-9840,CC(C)(C)OC(N1CCC(COc(cc2)nn3c2nc(C)c3)CC1)=O,0 F5286-0537,COc1cccc(COC2=COC(C(N(CC3)CCN3c3ncccn3)=O)=CC2=O)c1,1 F6356-0566,CC(Cc1cocc1)NC(CN(C(CC1)=O)C1=O)=O,1 Z2993321419,CN(C)C(c1c(NCc2ccns2)[nH]nc1)=O,0 E773-0175,Cc1c(COc2ccccc2)nc(-c(cc2)ccc2C(NCCN2CCCC2)=O)o1,1 F6512-9014,Cc1c(CNC(c(o2)ccc2Br)=O)cno1,1 SA93-0603,CCc(cc1)ccc1-c1n[nH]c(C(N(CCC2)CC2(CCOC)C(N)=O)=O)c1,0 F6472-0785,O=C(c1nc2ccccc2cc1)NCCSC1CCOCC1,1 Z189246124,CN(Cc(cc1)ccc1Cl)C(C(C=C1)=CN(Cc(cccc2)c2Cl)C1=O)=O,0 F6561-7750,Cc1nn(C)c(C(NC2CN(Cc3cscc3)CC2)=O)c1,1 Z1470622190,CCC(CCCC1)N1C(Cn1nnc(Cc2c(C)cccc2)n1)=O,0 SC04-0615,COCC(N(CCC1)CC1OCCc1noc(C2CC2)n1)=O,1 F1808-0228,COC(COc1cccc2c1C=CN(CC(NC1CCCC1)=O)C2=O)=O,1 SC60-0691,CC(C)(CN(C(C1)C(N2CCOC)=O)C2=O)CN1C(c1cc(Br)cnc1)=O,0 F6574-0100,CC(C)Sc1ccc(CC(NCc2nccnc2-c2cocc2)=O)cc1,0 F6442-2206,O=C(C1(CCCC1)c(cc1)ccc1Cl)N(C1)CC1S(Cc1ccco1)(=O)=O,1 C136-0050,Cc(ccc(NC(C1Oc(cccc2)c2OC1)=O)c1)c1F,0 E714-0325,O=C(CN(C=Nc1c2nc3n1CCCCC3)C2=O)N(CC1)CCN1C1CCCCC1,1 Z2856649345,CC1CCN(Cc2cn(CCc3cccnc3)nn2)CC1,1 F6524-1901,O=C(C1(CC1)c1ccccc1)N(CC1)CC1c1nocn1,1 F5831-2682,CCCCOc(cc1)ccc1NC(NC(C)Cc1cccs1)=O,0 8188-1187,Cc(c(NC(c1cc(C2=Cc(cccc3)c3OC2=O)ccc1)=O)ccc1)c1-c1nc(cccc2)c2s1,0 F5821-0110,Cn1c(cccc2)c2nc1CN(CC1)CCN1C(NCCOC)=O,0 F6057-0026,CC(Nc(cc1)ccc1C(N1CCN(CCn2nccc2)CC1)=O)=O,0 F6660-1447,CC#CCN(c1c(C(N2CC=C)=O)scc1)C2=O,1 SD03-0365,Cc1noc(C(C2)N(CC(N(CC3)CCC3N3CCCC3)=O)CC2(CC2)CCN2S(C)(=O)=O)n1,0 L923-0751,CCc1noc(-c2csc(S(N(CC3)CC=C3c3ccccc3)(=O)=O)c2)c1,1 F1194-0041,Cc(c(C)c1C#N)c(C)nc1SCc1ccccc1,0 Z1610993290,Cn1nccc1CNc1nnc(C2CC2)o1,0 F6519-3734,CCSc(cccc1)c1C(NCC(c1cccs1)n1nc(C)cc1C)=O,0 Z3133985655,O=C(C1=CC=CN(CC(F)(F)F)C1=O)NC1(CCC2)C2NCC1,1 Z1697808282,Cc(oc(C(NCCC1=CCCCCC1)=O)c1)c1S(N)(=O)=O,1 F6514-2815,O=C(CCc(cccc1)c1Br)N(C1)CC1OCC(F)(F)F,0 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S836-4714,Cc1cc(C(N(C[C@@H]2CO)C[C@@H]2C(NC)=O)=O)cc(C)c1,0 Z2874299201,O=C(NCC(C1)NCc2c1cccc2)N(C1)CC1C1CC1,1 V028-5082,Cc1ccc(CN(Cc(cc2)ccc2F)C(CN(C2CC2)C(C2CCC2)=O)=O)s1,1 Z1907554705,Cc1nc(C(Nc2cc(C(N3CCOCC3)=O)c(C)cc2)=O)c[nH]1,1 F228-0810,Cc1c(C)oc2c1c(N(CC1)CCC1C(NC(CC1)CS1(=O)=O)=O)nc(C)n2,1 F6469-3397,Cc1cccn2c1nc(-c(cccc1)c1NC(NC1CCCC1)=O)c2,1 C470-0481,CC1CN(Cc2nc(N(C)C(N(C)C3=O)=O)c3n2CC(c2ccccc2)=O)CCC1,0 Y042-6877,O=C(CC(c(cc1)ccc1Cl)n1cccc1)Nc1nc(CCC2)c2s1,1 SA59-0517,O=S(c1cc(CCC2)c2cc1)(N(CCN1CCCCC1)C1CCOCC1)=O,1 F6438-6753,FC(COC1)C1NCc(cccc1)c1Br,0 S615-0219,Cc(cccc1)c1S(N(CC1)CC1c1nc(CCOc(cc2)ccc2F)no1)(=O)=O,0 G856-1213,O=C(CSC(N(c1cccc(Cl)c1)C1=O)=Nc2c1[nH]c1c2cccc1)NCc1ccco1,1 Z335722224,CC(C(O)=O)n1nnc(-c2cccc(C(F)(F)F)c2)n1,0 Z1432909929,O=C(CC1OCCCC1)N(CC1)CC1Oc1ncccc1,1 F6556-6546,O=S(CCC(F)(F)F)(N(CCC1)CCN1C1CSCC1)=O,0 F6734-1016,O=S(CCc1ccccc1)(N1CC(CN(C2)c3ncc(C(F)(F)F)cc3)C2C1)=O,1 F6473-3623,O=C(c(cc1)ccc1-c1cscc1)N(C1)CC1N(C(CC1)=O)C1=O,1 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Z3009554185,CC1(CC=CC1)C(N[C@H](C1)[C@@H](C2)[C@H]1CC2C(O)=O)=O,1 F1243-0074,Cc1ccc(cccc2OC(N3CCCCCC3)=O)c2n1,1 V011-7765,CCC(C)C(N(c1ccccc1)c(cc1)c2cc1NC(C(C)C)=O)=NS2(=O)=O,1 Z1401860316,CC(CN(C)C1)C1NC(c1cc(-c(cc2)ccc2Br)n[nH]1)=O,1 Z1262950060,CC1CCN(CC(CCC2)CN2C(C(N)=O)c(cc2)ccc2F)CC1,1 F3407-0891,COc(ccc(-c([nH]c(-c1ccccc1)n1)c1SCC(NCc1ccco1)=O)c1)c1OC,1 Z2896991327,CCN(CC(O)=O)Cc1cn(Cc(cccc2)c2Cl)nc1,0 Z1444336906,OC(CN(C1CC1)C(CSc1cc2ccccc2cc1)=O)=O,1 F6443-6211,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)NCC(CCC1)N1c1nc(cccc2)c2o1,1 F5033-5477,CSc1c(CN2CCC(CNC(C(Oc3c4cccc3)=CC4=O)=O)CC2)cccc1,1 L834-1062,CCCN1c(cc(cc2)-c3noc(C(CC4=O)CN4c4ccc(C)cc4)n3)c2OCC1=O,0 5408-0814,COc(cc1)c([C@H]([C@H]2[C@@H]3C=CC2)Nc(cc2)c3cc2Cl)cc1Br,0 SB57-1449,CCS(N(C1)CC(C2)(CN2S(c2c(C)onc2C)(=O)=O)C1c1nc(C)no1)(=O)=O,1 Z3002323327,COC(C1)CC1C(N(C1)CC2(CCC2)C1N)=O,1 Z3063556470,Cc(nc(cc1)NCCc(nc[nH]2)c2Br)c1C#N,0 F6573-7273,O=C(c(ccc(F)c1)c1Cl)N(CCN1c2cnccc2)CC1=O,0 F6734-1415,N#Cc1nccnc1N1CC(CN(C2)c(cc3)ncc3F)C2C1,1 F6454-0572,Cc1cc(C(NCC2CCN(CC(F)(F)F)CC2)=O)c(C)cc1,0 Z4911889673,CC(C)CC(N(CCC1)CCN1S(c([nH]nc1)c1C(OC)=O)(=O)=O)=O,1 F6037-0317,CCc(s1)ccc1S(N(C1)CC1c1nc(cccc2)c2[nH]1)(=O)=O,1 F6100-0267,Cn1nnc(C(NCC(Cc2cccc(F)c2)N(CCC2)C2=O)=O)c1,1 T505-2823,O=C(c1cn(CCC(CCCC2)N2C(NC2CCCCC2)=O)nn1)NCC1CC1,1 Z1445770563,CC(CCC1)(CN1C(NC(CCC1)c2c1cn[nH]2)=O)c1ccccc1,1 F6656-2869,CC(C)(C)c(cc1)nnc1OCC(CC1)CCN1S(c1cn(C)c(C)n1)(=O)=O,1 F6200-3929,OC(CNC(Nc(c(F)ccc1)c1F)=O)(C1CC1)c1ccccc1,0 G266-0618,CN(c(cc(c(N1CCCC1)c1)NC(Nc2cc(OC)cc(OC)c2)=O)c1N1C)C1=O,0 T501-0539,O=S(c(cc1)ccc1F)(N1CC(Cc2nncn2CC2CC2)CCC1)=O,0 G015-0028,O=C(c1cccn1-c1nnc(N2CCOCC2)s1)N(CC1)CCN1c(cc1)ccc1Cl,1 Z2264930986,C[C@H](C1CC1)NCc1c(cccc2)n2nc1,1 S787-0967,Cn1c(C(N2CCC(Cc3ccc(CCC(NC4CC4)=O)cc3)CC2)=O)ccc1,1 F6476-6173,O=C(Nc1cccs1)N(CC1)CC1Oc(ccnc1)c1Cl,1 Z991560114,CC(C(O)=O)(c1ccccc1)NC(OC)=O,0 Z1362565509,CCN1CC(CC2)N(CC(Nc3cc(CCC4)c4cc3)=O)C2CC1,1 Z2479546210,COC[C@H](C[C@H](C1)O)N1c(oc1ccc2)nc1c2F,0 Z1192045347,CCC(CCCC1)N1c1nc(C)nc2c1cnn2C,0 F3358-0311,CSc1nc(C(F)(F)F)cc(-c2cccs2)n1,1 T787-4804,CN(C)C(C(CN(C1)C(c2cccc(Cl)c2)=O)C11CCOCC1)=O,0 Z999954294,CC(C(N1CC(N(CCCC2)C2c2ncc[nH]2)=O)=O)(c(cc2)ccc2F)NC1=O,1 SA92-0781,CCOc(cc1)ccc1S(N(CCC1)CC1(c1nc(C2CC2)no1)F)(=O)=O,0 F1721-0009,O=C1Sc(cccc2)c2N1Cc1nnc(-c2ccccc2)o1,1 S613-1184,O=C(c1cc2cccnc2cc1)N(CCC1)C1c1nc(CCOCC2CCOCC2)no1,1 3338-5670,O=C(c1ccccc1)c(cc(cc1)Br)c1NC(c(cc1)ccc1S(N(CC1)c2c1cccc2)(=O)=O)=O,1 Z199961344,O=C(COc1ccccc1)Nc(cc1)ccc1SCc1cnccc1,0 Z4946392106,CC(C(NCC(c1cc2ccccc2cc1)O)=O)n1c2ncnc(N)c2nc1,1 F5855-0875,O=C(C(C1)C1c1cccs1)N(CC1)CCN1C(C(Oc1c2cccc1)=CC2=O)=O,1 SC04-0361,Cc(occ1)c1C(N(CCC1)CC1OCCc1noc(C2CCOCC2)n1)=O,1 Z3138317090,Cc1c(C(NC(C2)C3(CCC3)C2N)=O)c(C(F)(F)F)co1,0 Z2212291894,Cc(cc(C)s1)c1S(NCCc(cccc1)c1C(O)=O)(=O)=O,0 Z2188250046,C[C@H](CN(C)C(CN(CCC1)C1=O)=O)O,0 Z1508733312,CC(CC(NC(C(Nc1c[nH]nc1)=O)c1ccccc1)=O)c1ccc(C(F)(F)F)cc1,0 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Z3091863722,Cc(cc1)cc(F)c1-c1noc([C@H]2N(C)CCC2)n1,0 F5033-6991,O=C(c1c(C(F)(F)F)cccc1)NCC(CC1)CCN1S(C1CC1)(=O)=O,0 F6512-5722,CCc(s1)ccc1S(N(CCC1)CCN1S(c1cn(C)c(C)n1)(=O)=O)(=O)=O,1 Z3009327082,O=S(c1ccco1)(N(CCC1)CC11Oc(cccc2)c2C=C1)=O,1 Z1138558495,Cc(cc1)ccc1C(c1nc(C)ccc1)=O,0 Z32018643,CN(C)CCCNC(C(C=C1)=NNC1=O)=O,0 Z2831973974,CC1(C)COC(CCN(C(CN2)=O)C2=O)C1,1 F6806-8077,CC(C)(C)NC(C(CC1)CN1c1nc(cccc2)c2[nH]1)=O,0 V017-1039,O=C(C(C1)C(CN(CC2)c3ccccc3)N2c2c1cccc2)NCCCN1CCOCC1,0 F3386-2669,CCOc(c1ccccc11)ccc1S(Nc1cccc2cccnc12)(=O)=O,1 F2699-0135,CCOC(C(C(OCC(Nc1c(C(F)(F)F)cccc1)=O)=C1)=NN(c2ccc(C)cc2)C1=O)=O,0 F6676-4557,CCOCC(N(CCC1)CC1N(C)c1c(C(F)(F)F)cccn1)=O,1 Z742301612,CC(C(N(CC1)CCN1C(C)=O)=O)NCC1(CCCCC1)c1cc(C)ccc1,1 F6475-2194,N#Cc(ccc(Cl)c1)c1NC(c(cc1)cnc1OCC1OCCC1)=O,1 F3284-8485,CCOC(c(cc1)ccc1NC(c1ccc(CSc2ncccn2)cc1)=O)=O,0 F6608-0580,NC(COC1)C1Oc(c(F)c1)ncc1Br,0 Z3652239474,CC(CC1C2CCCC1)CN2C(CCCc(cc1)cc(C2)c1NC2=O)=O,1 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Z1223222828,O=C(Nc1ccncc1)N(CCCCC1)C1c(cc1)ccc1Cl,0 F6507-8879,CCCc1c(C(NCC2(CCSCC2)OC)=O)snn1,0 Z1334996622,CN(CC1CCCC1)C(c(cc1)ccc1-c1nc(C2CC2)n[nH]1)=O,1 Z1870040797,OC(c(cc1)cnc1C(N(CCc1ccccc1)c1ccccc1)=O)=O,1 L567-0391,CCOc(cc1)ccc1S(N(CCC1)CC1(C)C(NCc1ccc(C)cc1)=O)(=O)=O,0 CM4582-2399,O=C(Nc(cc1)ccc1F)N(CC1)CCC1N(C1)[C@H](COCC2CC2)CC1(F)F,0 F6445-0617,O=C(c(cc1)ccc1Oc1nccs1)NCCCN(CCC1)C1=O,1 Y500-3275,O=C(Cn1nc(C(F)(F)F)cc1C1CC1)Nc(c1nonc11)ccc1N1CCOCC1,1 F6556-3514,O=C(NCC(CC1)CCN1C1COCC1)NCc(cc1)ccc1F,1 S649-1345,COC(C1)C2(CCOCC2)N1C(CC1)CCN1C(CC1CCCC1)=O,1 L110-0327,Cc1cc(N(C(c(cccc2)c2N2Cc3nc(-c4cccc(C(F)(F)F)c4)no3)=O)C2=O)c(C)cc1,0 Z608081588,N#Cc1ccc(CNc2nccnc2)cc1,0 F6573-5358,Cc(nc1)cnc1C(NCc1cnc(C2CC2)cc1)=O,1 Z2437855773,CC(CC(O)=O)(COC)NS(c1c(C)cc(C)s1)(=O)=O,0 F6512-0496,O=S(CCOc1ccccc1)(N1Cc2ccnn2CC1)=O,1 V007-1478,Cc(cc1)cc2c1[nH]cc2C(CC1)CCN1S(c1cccc(Cl)c1C)(=O)=O,0 Y042-2706,Cn(cc1)c2c1ccc(C(NC(CC1)c(cc3OC)c1cc3OC)=O)c2,1 F6356-0351,O=C(C(NCc1ccco1)=O)NCCc1cocc1,1 F6245-3136,Cc1nnc(C(CC2)CCN2C(c2cc3nccnc3cc2)=O)s1,1 F6523-3904,Cn1c(cccc2)c2c(CC(N(CC2)CC3=C2N=C(C=CC(F)=C2)N2C3=O)=O)c1,1 F5097-2625,O=C(Cc(cc1)ccc1NC(Nc(cccc1)c1F)=O)NCC(F)(F)F,0 F6559-1537,O=C(CCc(cc1)cc(Cl)c1F)NC(CC1)CCC1(F)F,0 SC19-0551,CCn1nc(CN2CCN(Cc3c[nH]nc3-c3cc(C)c(C)cc3)CC2)c2c1CCOC2,1 SD12-1451,Cc1noc(C)c1CN(CCN1)C(Cc2nc(C)no2)C1=O,1 P619-0262,CN(c(nccc1)c1Oc(cc1)c2cc1S(Nc(ccc(F)c1)c1F)(=O)=O)C2=O,0 F6235-0472,Cc1nccn1-c(cc1)nnc1N(CC1)CCN1C(c1cc(cccc2)c2o1)=O,1 F6559-0686,Cn1nc(C(N(CC2)CCC2N(C=Nc2c3cccn2)C3=O)=O)c2c1cccc2,1 F5832-8874,COc1ccc(CCNC(NCCc2csc(-c(cc3)ccc3Cl)n2)=O)cc1,1 J005-0636,Cc(cc1)c(C)cc1S(N(CCCCC1)C1c(cc1)ccc1OC)(=O)=O,0 2142-0271,Cc(cc1)ccc1NC(C(NCCN1CCNCC1)=O)=O,1 Y041-5790,O=C(c1csc(NC2CC2)n1)N(CC1)CCN1c1ncc(C(F)(F)F)cc1,1 K978-0304,O=C(CCN(C(C1C2C3C=CC1C3)=O)C2=O)NC1CCCCC1,1 Z4954982180,Cn1ncc(-c2ccc(C(Nc([nH]nc3)c3-c(cc3)ccc3F)=O)o2)c1,0 F6475-7828,CS(N(CC1)CCN1C(c(cccn1)c1OC1CSCC1)=O)(=O)=O,1 Z2795227007,OC(C(C1CC1)N(CC1)CCN1C(COc(cc1)ccc1Br)=O)=O,0 Z1269449553,Cc1nn(C)c(N(CCC2NC(c3c(N(C)C)nccc3)=O)C2=O)c1,1 SA41-0860,CN1C(COCc2ccccc2)CC(C2)(CN2C(Cc2cccc(Cl)c2)=O)C1,0 F2496-1524,O=C(Cc1cccs1)OCc1noc(-c2cc(cccc3)c3o2)c1,1 V020-3301,Cc1ccc(Cc2nc(onc3-c4cnccc4)c3c(N(CC3)CCN3C(Nc(ccc(F)c3)c3F)=O)n2)cc1,1 P315-0048,O=C(NC(CCN1c2ccccc2)C1=O)Nc1c(C(F)(F)F)cccc1,0 Z2295241152,OC(CNC(CN(CC1)CCN1c1ccc(C(F)(F)F)cc1)=O)=O,0 SB04-0180,CN(CCN(C(CC1)CN1S(C)(=O)=O)C1CCOCC1)C(c1nccn1C)=O,0 Z1270412450,CC(CNC(CCNC(c1cscc1)=O)=O)(C(O)=O)O,0 T990-2865,CN(CCC1N(CC2)CCN2S(c(cccc2)c2Cl)(=O)=O)C1=O,0 F6550-4627,O=C(CNC(OCc1ccccc1)=O)N(C1)CC1Nc1ncccn1,1 F6543-1559,Cn1nc(C(CC2)CCN2C(N2CCOCC2)=O)cc1,1 Z1341310542,CC(C)CCC(C)NC(Nc(cc1)ccc1Oc(cccc1)c1C(N)=O)=O,0 D011-3187,CC(c1ccccc1)n1c(cccc2)c2nc1C(CC1=O)CN1c1cccc(C(F)(F)F)c1,0 Z1748046874,OC(C1)C2(CC2)CN1C(c1nccc(-n2nccc2)c1)=O,1 F6089-6675,O=C(c1nc2ccccc2nc1)NCC1(CCOCC1)c(cc1)ccc1F,1 Z3063556413,FC(c1cc(CN(CC2)c3cncc(Cl)n3)c2nc1)(F)F,1 F6484-0360,O=C(c(cc1)ccc1N1CCOCC1)NC(CC1)CCC1Oc1nccnc1,1 F2740-0823,COCCn1c(cccc2)c2c(NC(Nc(cc(cc2)F)c2F)=O)c1,0 Z1548848073,CCN(CC1)CCC1NC([C@H](c1ccccc1)O)=O,0 SB91-0413,Cn1nc(C(N(CC2)CC2N(CCN2CCOCC2)S(C)(=O)=O)=O)c2c1cccc2,1 Z2788543821,Cc1noc(N=CN2Cc3nc(CCCC4)c4o3)c1C2=O,1 SA01-0806,CN(C)C(c1c(C(CC2)CN2C(C2CCCCC2)=O)nc(N(C)C)nc1)=O,1 Z2908155586,CN(C(CCC1)C(NCc(c(N2CCCC2)ccc2)c2F)=O)C1=O,1 S614-0773,CC(C)NC(N(CCCC1)C1c1nc(CCOCC2CC2)no1)=O,0 Y041-9949,C\1(=C(\c2c(OC1=O)cc1c(c(co1)c1ccc(cc1)C)c2)/C)/CC(N[C@@H](C(=O)O)C(C)C)=O,0 Z2275377089,Cc(sc(C(O)=O)c1)c1S(N(CC1CO)c2c1cccc2)(=O)=O,0 Z1311050766,CC(C(CC1)CCN1C(C(C1)ON=C1c(cc(cc1)F)c1F)=O)(C(N1)=O)NC1=O,0 Z1496579955,CNC(c1cccc(CNS(Cc(cccc2)c2C(OC)=O)(=O)=O)c1)=O,0 Z1721040777,O=C(C1(CCCCC1)c1cccc(Br)c1)N1Cc2ncnn2CC1,1 F6560-8230,Cn1ncc(-c2ncc(CNC(c3cscn3)=O)cc2)c1,1 S713-3026,Cc1ccc(C(N(CC2)CCC2c2nc(-c3cccn3C)no2)=O)s1,1 F6549-3599,O=S(c1cc(CCCC2)c2cc1)(N1CC(Cn2ncnc2)C1)=O,1 Z88897743,N#Cc1cccc(S(N(C2)c(cccc3)c3OC2C(O)=O)(=O)=O)c1,0 Z4658334521,OC(C(c1cccc2ccccc12)NC(C(CC1)C1c1ccccc1)=O)=O,1 V022-8921,Cc(c(CN(CC(Cc1ccccc1)O)CC1CC1)c1Oc2cccc(F)c2)nn1-c1ccccc1,0 SB41-0112,C[C@@H](C(N(C)C[C@H]1CN2CC(NCCCc3ccccc3)=O)=O)N1C2=O,0 D437-0630,CC1Oc(ccc(-c2c(C)sc(NC(CCc3ccccc3)=O)n2)c2)c2NC1=O,0 G317-0131,CCOC(C(C1=O)=O)=C1Nc1cccc(SC)c1,0 SD12-1023,Cc1noc(CC2N(Cc3cccc(Cl)c3)CCN(Cc3ccccc3)C2=O)n1,0 F6514-6566,COc1cc(OC)c(CCC(NC(Cn2nccn2)c2ccccc2)=O)cc1,0 F6554-8886,O=C(c(o1)ccc1Br)N(CC1C2)C2CS1(=O)=O,1 F6619-6828,Cc1c(CN(CC2)CCN2c2nc(C)nc(-n3nccc3)c2)cno1,1 F2879-4954,O=C(C(Nc1ccc(C(F)(F)F)cc1)=O)NCCC1=CCCCC1,0 SD15-0427,CN(CC(N(C)[C@@H]1[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C1)=O)C2=O,1 T159-0137,Cc1cc(C(N2CC(Cc3ncc(C)n3CCOC)CCC2)=O)nn1C,1 Z3398342001,CC(NC1(CNC(Nc2cc(NC(C)=O)ccc2)=O)C2CC(C3)CC1CC3C2)=O,0 F6521-9495,COC(CNC(Cc1cscc1)=O)(C1)Cc2c1cccc2,1 P896-0217,O=C1NCCCn2c1cc(S(NCc(cc1)ccc1N1CCOCC1)(=O)=O)c2,1 F6804-8555,Cc1cnc(C)c(N(CC2)CCC2C(F)(F)F)n1,0 S985-1156,CNC(N(C[C@@H]1CN(Cc2ccccc2)C2)C[C@@]12C(N(C)C)=O)=O,0 Z1991673414,CC(Cc1cc(C)cc(C)c1)NC(c(nc1)cnc1C(O)=O)=O,0 F6574-1999,O=S(Cc(cccc1)c1Cl)(NCc1nccnc1-c1cccs1)=O,1 F6555-0810,O=C(c1cocc1)N(CC1)CC1n1nnc(C2CC2)c1,1 F6473-6082,CC(O1)=CC(OC(C2)CN2C(CSc(cc2)ccc2F)=O)=CC1=O,1 Z2605836140,O=C(C[C@@H]1CNCC1)N(CC1CCOCC1)Cc1ccccc1,1 F6252-7920,O=C(c1c(-c2cc(Cl)ccc2)nn[nH]1)NCc(cc1)cc(Cl)c1F,0 F6561-4820,C=C(CC1CC2)CC2N1C(c1cc2nccnc2cc1)=O,1 Z2483031780,CCC(CC1)(CCN1C(C(O)=O)c1cscc1)O,0 Z1334524048,Cc1cc(NC(CNc(c(C)ccc2)c2C(N)=O)=O)no1,0 F5860-4619,COC(CC1)CCN1S(c(cccc1)c1F)(=O)=O,0 P909-2290,Cc1c(CN(CC2)CC2c2nc(-c3ccccc3)no2)scn1,1 Z997826010,O=C(c(cc1)ccc1S(Nc1cc(F)cc(N2CCOCC2)c1)(=O)=O)N1CCOCC1,1 Z1443603833,Cc1cc(OC(F)F)c(C(N(CC2)CCC2C(O)=O)=O)s1,0 Z1506929942,CC(C)(CN(CC1)CCN1C(c(cc1)cc2c1n(C)cn2)=O)O,0 Z3980176266,OC(C(CCCC1)C1C1CCNCC1)=O,0 G597-1001,Cc1c(CN(C=Nc2c3c(-c(cc4)ccc4Cl)no2)C3=O)nc(-c(ccc(OC)c2)c2OC)o1,0 V014-2215,Cc1cccc(CN(CCN2CCOCC2)CC(COc(cc2)ccc2Cl)O)c1,0 Z1892978776,CCC(NC(C)C(N(CCn1c2ccc3)Cc1cc2c3Cl)=O)=O,0 F6562-0934,CC(C)(C)OC(N1CCC(CC(N(CC2c3cn(C)nc3)Cc3c2cccc3)=O)CC1)=O,1 F2036-0324,COc(ccc(N(CCC1)S1(=O)=O)c1)c1NC(Cc(cc1)ccc1F)=O,0 F6782-5972,CCOc1c(CN(CC(C2)C(OC)=O)C2=O)cccc1,0 F5452-0102,O=C(c1c(CCC2)c2nn1C(CC1)CS1(=O)=O)N(CCC1)CC1c1nc(cccc2)c2o1,1 Z1875126157,CC(C1)(CN1C(c1cnc2[nH]nnc2c1)=O)O,0 Y042-4669,COc(cc1)ncc1NC(C(CC1=O)CN1c1ccccc1)=O,0 SB24-0526,CC(C)CNC(c1cn(C(CC2)C2(CC2)CCN2C(c2noc(C)c2)=O)nn1)=O,0 P209-0589,CC(C)CC(Nc1cnc(N2CCCCCC2)nc1)=O,0 F0784-0278,CCNc(n12)nc(NCC)nc2nnc1SCC(OCC)=O,1 SA99-1279,CCOc(cc1)ccc1S(N(C1)CC1N(CC1)CCC1(CCOC)C(N)=O)(=O)=O,0 F5017-2788,CC(c1cccc(S(NCC2CCN(Cc(cccc3)c3SC)CC2)(=O)=O)c1)=O,0 F6464-0580,CC(NCC(N(CCCC1)CC1c(cc1)ccc1Cl)=O)=O,0 F2744-1217,COC(c(cccc1)c1NC(C(C=C1)=CN(Cc2cccc(C(F)(F)F)c2)C1=O)=O)=O,0 F2202-1489,O=C(Cc1csc(NC(C2CC2)=O)n1)Nc(cc1)ccc1Br,1 Z734256088,N#Cc1c(N(CCC2)C2C2CCCC2)nccc1,0 SA24-0215,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(C(c1c2cccc1)=NNC2=O)=O,1 F3277-0102,C(c1ccco1)Nc1c2oc(cccc3)c3c2ncn1,1 Z4121064351,CN(C)[C@@H]1[C@@H](CNC(Nc(cc2)ccc2-n2ncc3c2cccc3)=O)COC1,1 Z1755995388,CN(C[C@H]1[C@H](c2cn(C)nc2)N(C)CCC1)C(Nc1nnc(C2CC2)cc1)=O,1 Z2619488914,CCOc1ccc(C(CCC2)N2C(c2nc(cncc3)c3s2)=O)cc1,1 Z1372689847,CC(Cc1cc(OC)ccc1)NC(NC1CC(C)C1)=O,0 Z2016502348,Cc(cc1)cc2c1n(C)c(CNC(Nc1ccc(CCN3CCCCC3)cc1)=O)n2,1 F6549-4905,Cn1ncc(C(CCC2)CN2C(c2cc3c(-c4ccccc4)onc3cc2)=O)c1,1 Z3077814293,CC(C)(C)c1nccc(N(C2)CC2(c2cnnn2C)OC)n1,0 5340-2243,COc(ccc(C(c1c(C2=O)[nH]nc1-c(cc1)ccc1Br)N2c1ccccc1)c1)c1OC,0 F6554-1155,Cn1nc(C(CCC2)CN2S(c(cc2)cc(N3C)c2OC3=O)(=O)=O)cc1,1 F6805-3730,CC(N1CC2CCN(Cc3cncs3)CC2)=Nc(cccc2)c2C1=O,1 F6750-6534,Cc1c(CN(CC2)CCN2c2nc(-c3cn(C)nc3)cnc2)sc(C)n1,1 F6670-5979,CC(N1CC(CC2)CCN2C(c2nn(-c3ccccc3)nc2)=O)=Nc(cccc2)c2C1=O,1 F6680-9242,CSc(cc1)ccc1C(N1CC(COc2ccncc2)CCC1)=O,0 F5248-0533,O=C(CCCSc(cc1)nnc1NC(C1CC1)=O)NC1CCCCCC1,1 Z2182274999,CCCC(Nc1ccc(CNC(N2Cc3cncn3CC2)=O)cc1)=O,1 Z1129794489,Cc1cc(N(C(c(cc2)c3cc2C(N(CC2)CC2c2cccc(F)c2)=O)=O)C3=O)c(C)cc1,0 SA87-1026,O=C1N(CCc2ccccc2)CC(CNS(c(cc2)cc(F)c2F)(=O)=O)OC1,1 Z1416772930,O=C(C(C1)C11CCC1)Nc1nn(Cc2ncccc2)cc1,1 Z1602758252,O=C(C(CCC1)N1S(c1ccccc1)(=O)=O)N1CC(Cc2ccccc2)OCC1,1 F6808-6037,Cc1cccc(NC(CN(CC2)CCC2(c2ccccc2)C#N)=O)c1,0 Z2223155619,CC(C)C(Nc1nccc(C(N(CC2)CCC2N(CCCC2)C2=O)=O)c1)=O,1 F6438-0875,Cc1nc(CNC(c(c(F)ccc2)c2F)=O)nc(N2CCOCC2)c1,0 F6806-6792,Cc1cc(ncnc2N3CC(C(N(CC4)CCC4(F)F)=O)OCC3)c2[nH]1,1 Z1355106576,CC(C)CCN1CCC(CNC(C2CCN(Cc3nccn3C)CC2)=O)CC1,1 T853-0391,CCN(CCNC(C1(CCC(N2C3CCCC3)=O)C2=CCCC1)=O)Cc1ccccc1,1 F5596-1162,COc(cccc1)c1NC(CN(CC1)CCC1c1nnc(-c2ccco2)o1)=O,0 F6660-4519,CC(C(C(OC)=O)=CN1Cc(cc2)ccc2Cl)=NS1(=O)=O,1 Z1978278401,OC(Cc1ccncc1)(CC1)CCN1C(COc(cccc1)c1F)=O,0 SA93-0257,CCC(CCC1)(CN1C(c1cc(-c2cccc(Cl)c2)n[nH]1)=O)C(N)=O,0 S624-0307,COc(cc1)cc2c1[nH]c1c2CCNC1(CC1)CCN1C(c(ccc(OC)c1)c1OC)=O,1 G729-1298,O=C(CCc1nc(CS(c(cc2)ccc2F)(=O)=O)no1)NC(CCC1)c2c1cccc2,1 F6806-4848,Cc1cnc(CN(CC2)CCN2c2nc(-c3cn(C)nc3)cnc2)c(C)c1OC,1 F6353-6069,COC(NCC(c1ccco1)N1CCSCC1)=O,1 F6752-4303,O=C(C1OCCN(Cc(cccc2)c2Br)C1)NC1CC1,0 F6573-6421,O=C(c1cc(-c2cccs2)n[nH]1)N(CC1)CCC1(C1)C1(F)F,1 V003-2649,CCN(CC)S(c(cc1)cc2c1n(CC1OCCC1)c(SCc1nccc(OC)c1OC)n2)(=O)=O,1 F6529-3810,O=C(c1cc(cccc2)c2s1)N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O,1 E699-1433,CC(C1)N(C(C2CCC2)=O)c(cc2)c1cc2S(NC1C(C)CCCC1)(=O)=O,1 SB68-0654,CC1(CC1)C(N[C@@H]1Cn2ncc(C(NCc3cnccc3)=O)c2C1)=O,1 F6445-7763,COC(C(C(N(CC1)CCN1c1ncccn1)=O)=CN1c2ccccc2)=CC1=O,1 F6151-0145,CSc(cccc1)c1NC(C(CCC1)CN1c(cc1)nnc1-n1cncc1)=O,0 Z3863609606,Cc1nsc(N(C2)CC(C3)C2CCC3N)c1C#N,1 F6764-1315,O=C(C(CC1=O)CN1c1ccccc1)N(CC1)CCC1c1nc2ncccc2cc1,1 Z2410469867,CC(CCCC1)C1C(NS(c(c(C)c1)cc(Cl)c1OC)(=O)=O)=O,0 C858-0694,CC(CC1)CCC1NC(c(cc1)cc2c1nc(N1CCCCC1)s2)=O,0 Z2226649540,COCC1(CCC1)NC(C(CC1)Cn2c1nnc2)=O,1 M867-1187,CC(c1cccc(NC(CN(c2csnc2C(N2C3CC3)=O)C2=O)=O)c1)=O,0 S651-0542,Cc1ccc(C(N2CCC(C3)(CN(C)C3C(N3CCOCC3)=O)CC2)=O)s1,1 F6573-7292,O=C(CSc(cc1)ccc1F)N(CCN1c2cnccc2)CC1=O,1 F6571-2672,COc1ccc(CCNC(NCC2(CCCC2)OCCO)=O)cc1,0 M331-0736,Cc1noc(/C=C/c(s2)ccc2S(Nc(cc(cc2)OC)c2OC)(=O)=O)c1NC(C1CC1)=O,0 F6543-4937,O=S(N1CCCC1)(N1Cc(cccc2)c2OCC1)=O,1 F2320-0112,Cc(cc1)nn1-c(cc1)nnc1Nc(cc1)ccc1NC(c(cccc1)c1Cl)=O,0 F6194-0398,CC(Cc1ccco1)(CNC(C(Nc1cccc(Cl)c1C)=O)=O)O,0 Z1259188326,Nc1nc(ccc(C(NCCc2cnccc2)=O)c2)c2s1,1 Z3357280172,O=C([C@@H]1[C@H]2[C@H](CC3)C[C@H]3[C@@H]12)NS(c1cn(C2COCC2)nc1)(=O)=O,1 D399-1635,COc1ccc(C2N(Cc(cc3)cc(OC)c3O)CCC2)cc1,0 F6523-2207,O=C(c(cccc1)c1N1)N(C(CC2)CCN2S(C2CC2)(=O)=O)C1=O,1 Z2793753862,C[C@@H](CN(CC1)c(ncc(C(O)=O)c2)c2Cl)S1(=O)=O,1 F2020-0565,COc(cc1)cc2c1sc(Nc(cc1)cc3c1OCCO3)n2,1 F6469-0350,O=C(CN(C=NC(c(cc1)ccc1F)=C1)C1=O)Nc(cccc1)c1-c1cn(ccs2)c2n1,1 C561-0742,Cc1nn2c(C)c(CCC(Nc(cc3)cc(O4)c3C(C)=CC4=O)=O)c(C)nc2c1-c(cc1)ccc1F,1 F6788-3140,Cc1cc(CN(CC2)CCN2c2nc(C3CC3)nc(C3CCC3)c2)no1,1 Z1315510635,CC1(C)C2OCCCC2C1NC(C1(CN(Cc2ccccc2)CC1)O)=O,1 F6524-6163,O=C(c1c[nH]c2c1cccc2)N(CC1)CCN1C(CC1)CCS1(=O)=O,1 Z3138319399,NC(C1)C2(CCC2)C1NC(c1nc(-c2ncccc2)ncc1)=O,1 F6443-5562,COc(ccc(Cl)c1)c1C(NCc1cc(Oc2ncccc2)ccc1)=O,0 F6573-9079,O=C(NCc1cncc(-c2cocc2)c1)OCC1CCC1,1 F6415-1323,O=C(CN(c(cccc1)c1O1)C1=O)N(CCc1cccs1)Cc1cocc1,1 Z1468353594,OCCOC(CCC1)CN1C(c(cccc1)c1-n1nccc1)=O,0 F6253-2377,O=C(c1cc(c(OCc2ccccc2)ccc2)c2[nH]1)N1CCSCC1,1 Z2445912633,Cn1nnc2c1N=CN(CC1(CCC1)O)C2=O,0 Z1699097053,OCc1ccnc(NCC(c2ccc(C(F)(F)F)cc2)N2CCOCC2)n1,0 F2541-0195,CCCS(NC(CC1=O)CN1c(cc1)ccc1Cl)(=O)=O,0 Y206-5784,CC1OC(C)CN(CC(Nc2nnc(C3CCCCC3)s2)=O)C1,1 F6515-0399,O=C(NCc1cccnc1-c1cscc1)Nc(c(F)ccc1)c1F,0 Z362007408,CN(C)C(NC1C(C2)C(CCC3)C3C2C1)=O,1 F6508-1238,CC(C)(C(NCC(c1ccco1)c1cccs1)=O)OC(C)=O,0 CM2843-2338,O=S(c(cccc1)c1Cl)(N(CCC1)C1c1nncn1C1CCCC1)=O,1 Z3008581874,COCCN(C1COCC1)S(c(cc1)ccc1C(O)=O)(=O)=O,0 F6731-1062,CC(C)c(ncnc1N(C)C(CCC2)CN2S(c(cc2)ccc2C#N)(=O)=O)c1F,1 Z3630065119,CCNC(N(CC1)CCC1(C(C)(C)N1)OC1=O)=O,1 F1736-0180,CCOc(cccc1)c1NC(c1csc2c1CCCC2)=O,0 Z31231977,O=C1N(c2ccccc2)N=CC(NCc(cccc2)c2Cl)=C1Cl,1 F3386-2591,OC(Cn1cncc1)Cn1c(cccc2)c2c2c1cccc2,0 Z1983027028,CC(CC1)(CNC1=O)C(NCCc1ccccc1)=O,0 L383-0136,O=C(CSc(cc1)nnc1N(CC1)CCN1c(cc1)ccc1F)Nc(cc1)cc2c1OCCO2,0 F1021-0280,Cc(cc1)cc(CC=C)c1OCC(Cn1c(cccc2)c2nc1)O,0 V017-7655,CN(CC1)CCN1C(CCCN1c(cc(cc2)C(COc3cccc(Cl)c3)=O)c2OCC1=O)=O,1 F6606-5217,O=C1N(CC2CCN(CCc(cc3)cc4c3OCC4)CC2)C=NC=C1,1 F6497-0001,O=C(c1ccno1)N1CC(Cc2nc(-c(cccc3)c3F)no2)CCC1,1 Z2957914078,Cn1ncc([C@H]2OCC[C@@H]2C(NOCc2cnccc2)=O)c1,1 F6523-3797,Cn1nnc(C(N(CC2)CC3=C2N=C(C=CC(Cl)=C2)N2C3=O)=O)c1,1 Z3155129059,CCc1c(CNC(c(cc2)ccc2F)c2cccc(S(C)(=O)=O)c2)c(C)no1,0 SB75-1282,CCS(N[C@H](C[C@H]1CN(C2)C(c3cnc(C)cc3)=O)C[C@]12c1nc(C)no1)(=O)=O,0 Z2091961372,Cc1c(C(N2Cc(ccc(O)c3)c3OCC2)=O)sc(NC(c2cc(F)ccc2)=O)c1,0 F2880-1830,O=C(C(Nc(cc(cc1)F)c1F)=O)NCC(c1cccs1)N1CCOCC1,1 F5759-0547,COc(cc1)ccc1-c1ncnc(N2CCN(C/C=C/c3ccccc3)CC2)c1,1 Z5006162087,O=C1N(Cc2cn(-c3ccccc3)nn2)C=CC(Cl)=C1,0 F6510-2699,CC(C)Sc1ccc(CC(Nc(cc2)cc(N3C)c2N(C)S3(=O)=O)=O)cc1,0 F6482-2352,O=C(c(cc1)cc2c1ncs2)NC1CC2OCCOC2CC1,1 F6614-1348,Cn1ncc(C(N(CC2)CCC2C(F)(F)F)=O)c1,0 T619-4816,O=C(c1nccnc1)N(CCCC1)C1c1nc(-c2ccncc2)no1,1 Z3383541465,NCC(C1)(C2)CC12NC(c(cc1)cc2c1nc(-c1ccccc1)[nH]2)=O,1 F2493-1387,O=C(c1cccs1)NCc1noc(-c(ccc(F)c2)c2F)c1,1 Z2351752804,CC(COC)(CC1)CN1S(c(cc1)ccc1C(NCC(O)=O)=O)(=O)=O,0 C470-0511,CC1OC(C)CN(Cc2nc(N(C)C(N(C)C3=O)=O)c3n2CC(N)=O)C1,0 Z369327358,O=S(c(cccc1)c1Br)(NCc1cc(F)ccc1)=O,0 Z1071831146,O=C(CSCC1OCCCC1)Nc(cc1)ccc1-n1ncc2c1N=CNC2=O,1 F6200-0250,OC1(CNS(CCc2ccccc2)(=O)=O)CSCCSC1,1 S204-0061,Cn1nc(C(CC2)CCN2C(CC2CCCC2)=O)c2c1CCOC2,1 Z1416551765,OC(c1cccc(NS(Cc(cc(cc2)Cl)c2F)(=O)=O)c1)=O,0 Z2982737443,CC(N(C)Cc1cn(Cc(s2)ccc2Cl)nn1)=O,0 S661-1114,CCN(C(C(C1)N2CC1(CC1)CCN1C(c1ccc(C)s1)=O)=O)C2=O,0 F817-0151,O=C(C(CC1)CCN1S(c1cc(C(N2CCCC2)=O)cs1)(=O)=O)Nc(cc1)cc2c1OCCO2,1 Y044-0984,CN(C(C(C(NCC(NCCOC)=O)=O)c1c2cccc1)c1ccccc1)C2=O,0 Z3290436454,CCCN(C)C(N(C1)CC1N(C=C(C(N1)=O)C#N)C1=O)=O,1 Z1274073090,O=C(c1c(Cn2ncnc2)cccc1)NCC1CN(CCc2ccccc2)CC1,1 Y501-3841,Cc1noc2c1c(C(Nc(cc1)cc(O3)c1C(C)=CC3=O)=O)cc(-c1cccs1)n2,1 SC15-0329,CCCNC(N1CCC(CN(CC(COc2ncccn2)C2)C2=O)CC1)=O,0 F6680-3221,COc1nccc(N(CCN(C2)C(NC3CCCCC3)=O)C2=O)c1,1 Z1681675913,CN(CCC1)C1(CC1)CCN1C(C(CCC1)N1C(c(cc(cc1)Cl)c1OC)=O)=O,1 Z1278380976,CC(C)c1cc(NC(NCc2nc(C(C)(C)C)cs2)=O)no1,0 F6359-4247,Cn1nnc(C(N(CC2)CCC2Oc2nc3ccccc3nc2)=O)c1,1 Z1386751804,O=C(Nc1cc(Cn2nccc2)ccc1)N(C1)C2C1CCC2,1 F2879-0171,COc1c(CCNC(C(NC2CCCC2)=O)=O)cccc1,0 Z1603694774,OC(CC(c1cccc(Cl)c1)NC(C(C1)c2c1cccc2)=O)=O,0 Z2506635925,CC(CCC1)CN1c1cc(N(C2)Cc3c2ccc(OC)c3)ncn1,1 F6666-4085,Cc(ccnc1)c1NC(CCc(cccc1)c1F)=O,1 SB21-1569,COCCNC(c1cn(C[C@H](C[C@@H](C2)F)N2C(c2n[nH]c3c2cccc3)=O)nn1)=O,0 F5852-0558,CC(C)OCCCNC(C(NCCc1ccccc1)=O)=O,0 F5308-0257,O=S(c(cccc1)c1Cl)(NCCCN(CC1)CCN1c1ccccc1)=O,0 K783-0591,Cc1nc(cc(cc2)C(N(CC3)c4c3cccc4)=O)c2n1-c(cc1)ccc1Br,1 G666-0072,Cn1c(NC(NCC2OCCC2)=O)ncc1-c1ccccc1,0 SC55-0046,CN(C1)CC(C2)(CN2C(NC2CCCCC2)=O)C1c1nc(-c2ccccc2)n[nH]1,1 Z1713732674,OC(CCN(Cc1cnccc1)C(c1cccs1)=O)=O,1 Z2772222235,O=C(c(nc1-c2ccccc2)nn1-c(cc1)ccc1F)N(CCC12)CC2C1(F)F,1 Z3503849948,O=C([C@@H]1[C@H](C2)[C@H]2CC1)NS(Cc1ncccc1)(=O)=O,1 F6564-3093,Cc1nc(cc(cc2)NC(CN3N=C(C4CC4)C=CC3=O)=O)c2s1,1 F6015-0282,Cc1ccc(C)n1CCCC(N1c2nc(cccc3)c3n2CC1)=O,1 L923-0574,Cc1noc(-c2csc(S(NCC3CCN(Cc(cc4)ccc4Cl)CC3)(=O)=O)c2)c1,1 F6495-5102,CSc(cccc1)c1NC(C(C1)CN1c1ncnc(-n2ncnc2)c1)=O,0 F6490-0934,Cc(cc1)nnc1OC(CCC1)CN1C(COCc1ccccc1)=O,1 SA43-1008,CN(CC(C1)(CN1C(c1ccccc1)=O)C1)C1c1nc(-c2cnccc2)no1,0 Z3889887027,COc(cc1)cc(OC)c1-c1c(CCC(N[C@H](COC2)[C@H]2O)=O)c(cccc2)c2[nH]1,1 F3394-0994,COc1cccc(S(NCC(N2CCCC2)=O)(=O)=O)c1,0 M626-0956,O=C(c(ccc(F)c1)c1Cl)NCc(cc1)cnc1N1CCOCC1,1 F6559-1991,O=C(COc(cccc1)c1F)NCc1nc(C2CCSCC2)no1,1 Y042-8768,CCC(C(N(CC1)CC(CCCC2)C12O)=O)Oc(cc1)cc(O2)c1C(CCCC1)=C1C2=O,0 F2493-3177,O=C(c1ncccc1)NCc1noc(-c2cccs2)c1,1 Z394599144,O=C(C1CC1)NC(CC1)CCN1C(c(cc1)ccc1OC(F)(F)F)=O,1 T159-1431,Cc1cnc(CC2CN(Cc3ccncc3)CCC2)n1Cc(cc1)ccc1F,1 CM4579-4660,O=C(c1ncncc1)N(C1)[C@H](COc2cc(CCC3)c3cc2)CC1(F)F,1 F6658-5653,CC(C=C1)=NN(CC(N2CCC(COc3ncnc(C)c3C)CC2)=O)C1=O,1 Z1892034646,O=C(C(c1cnccc1)NC1=O)N1c1cc(-c(cc2)cc3c2OCC3)ccc1,1 Z3341637893,COc1cccc(Cn2nnc(C3(C(F)(F)F)NCCC3)n2)n1,1 8014-2177,OC(CC1)C(CCCC2)C2N1C(c1ccccc1)=O,1 G856-4930,O=S(c(cc(cc1)F)c1F)(NCC(c1ccco1)N(CC1)CCN1c1ccccc1)=O,0 Z1618232388,CC(C)c1nccc(N(CC2)CCN2C(C(C=C2)=CNC2=O)=O)n1,0 Z1865419744,O=C(NC(C1)CC1(F)F)N(C1CC2)C2c2c1cccc2,1 V026-6051,CCc1c(Cc2ccc(C)cc2)c(N2CCN(CC(C(C)C)O)CC2)nc(C)n1,0 F6473-4350,O=C(Nc(cc1)ccc1F)N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O,0 Z1144930638,CC(CN1CCN(C)CC1)NC(c1n[nH]cc1)=O,1 V004-3096,Cc(cc(cc1)F)c1S(N(CC1CN2CCC(Cc3ccccc3)CC2)CC1c1ccccc1)(=O)=O,1 T159-0252,Cc1cnc(CC(CCC2)CN2S(c2cn(C)cn2)(=O)=O)n1CCOC,1 F6788-7393,Cc1c(N(C2)CC(C3)C2CN3S(Cc2ccccc2)(=O)=O)n2ncnc2nc1C,1 F6561-9498,O=C(C1(CC1)c(cc1)ccc1F)NCc1cn(-c2cnccc2)nn1,1 F6549-8620,O=C(c(cccc1)c1Br)N(C(CC1)C2)C1CC2Oc1cnccc1,1 F2323-2736,Cc1c(CN(C=Nc2c3cnn2CCNC(Cn2c(cccc4)c4nc2)=O)C3=O)cccc1,1 F5893-0190,Cc1c(C(Nc(c2n3)cccc2ccc3OC)=O)c(-c(cccc2)c2Cl)no1,1 F5857-6541,OC1(CNC(c2noc(-c3ccccc3)c2)=O)C=CCCC1,1 F6237-4005,O=C(c1nn(-c(cc2)ccc2Br)nn1)NCC1OCCC1,1 Z3297003931,O=C(C1CCC2(CCC2)CC1)N(CC1)CCC1c1nncn1C1CC1,1 8015-9176,CN(C(CN1CCCO)=C(C(c(cc2)ccc2O)N2)C1=O)C2=O,0 Z3686439772,Cc1cc(C)c(C=CCN(C[C@@H]2CC(NC)=O)C[C@@H]2O)cc1C,0 SB74-0582,CN(CCCNC([C@H](C[C@]1(CC2)CN2C(c2ccccc2)=O)NC1=O)=O)c1ccccc1,1 F6795-5301,Cc(c(C)nc(SC)n1)c1OCC1CCN(Cc2nnc(C(F)(F)F)o2)CC1,0 F6660-8232,CCCCCCCCN(C=Nc1c2cnn1C)C2=O,0 Z2827787504,NC[C@H](CC1)CC[C@@H]1NC(c(cc1)ccc1S(C1CCCC1)(=O)=O)=O,0 F531-0923,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CCN1c(cc1)ccc1-c1noc(C2CCC2)n1,1 Z1603345663,OC(C(C1)(Cc2c1cccc2)NC(Cc(cc1)cc2c1OCO2)=O)=O,1 Z1616793686,CCc1n[nH]c(C(NC(C)c2nocn2)=O)c1,0 F892-0711,Cc(sc(-c1noc(C2CCC2)n1)c1)c1NC(CN1c(cc(cc2)Cl)c2OCC1=O)=O,1 D337-0884,O=C(c1noc(-c(cc2)ccc2Cl)c1)Nc1c(C(NCC2OCCC2)=O)c(CCC2)c2s1,0 G856-4931,O=S(c(cc1)ccc1F)(NCC(c1ccco1)N(CC1)CCN1c1ccccc1)=O,0 Z4439098572,CC(C)(CNc1c(C)c(Cl)nc(-c2ncccn2)n1)CN1CCCC1,1 F6813-7813,Fc1c(CN(CC2)CCN2c2c(ccs3)c3ncn2)ccnc1,1 SC04-0652,O=S(c1cccs1)(N(CCC1)CC1OCCc1noc(C2CC2)n1)=O,1 F6481-4394,Cc1c(C(N(CC2)CCSC2c2cccs2)=O)c(C)n[nH]1,0 Z2960705983,C[C@@H](CN(C1)C(c2nc(OC)ncc2)=O)[C@H]1C(N1CCOCC1)=O,1 F6412-2093,O=C(CCN(C=Nc1c2cccc1)C2=O)NCC#CCOc(cc1)cc2c1OCO2,1 Z2958616924,CC(CCNC(c1cn(-c(cc2)ccc2OC)nn1)=O)(c1ccccc1)O,0 T159-0255,Cc1cnc(CC(CCC2)CN2S(c2cc(OC)ccc2)(=O)=O)n1CCOC,0 F6235-0490,Cc1nccn1-c(cc1)nnc1N(CC1)CCN1C(c1csc(-c2ccccc2)n1)=O,1 M513-1869,CCn1c(nccc2)c2c(CCN(CC2)CCN2S(c(cc2)ccc2F)(=O)=O)c1,0 Z1782381295,CC(c1nccnc1C)NCc1cccc2c1OCCCO2,1 Z2362285722,OC(C(C1)OCCN1C(Nc1cc(OCC(F)(F)F)ncc1)=O)=O,1 Z3687067382,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NC(c1c(cccc2)n2nn1)=O,1 Z1672868176,CCCN(CC(O)=O)C(c1cn(cccn2)c2n1)=O,1 Z3775106448,Cc1cc(cc(CNC(N2CCCC2)=O)cc2)c2n1C,1 F6507-8910,COC1(CNC(CSc(cc2)ccc2F)=O)CCSCC1,1 S787-0105,NC(CCc1ccc(CC(CC2)CCN2C(c2ccco2)=O)cc1)=O,0 Z4069292479,OC([C@H](C1)C[C@H]1NC(C1[C@@H](CC2)[C@@H]2C1)=O)=O,1 F5834-5236,Cc(cccc1)c1NC(Nc1ccc(CC(NCCOC)=O)cc1)=O,0 Z364351360,OC(C1(CCCC1)NC(Cc1cc(CCC2)c2cc1)=O)=O,1 F6383-0641,COCCc1noc(C(CC2)CCN2C(c2ncccc2)=O)n1,1 Z1366566785,[O-][N+](c1cc(-c2noc(CN(C[C@@H](C3)O)C[C@H]3O)n2)ccc1)=O,0 Z4474323496,CN(CC1)CCC1C(Nc1cn(Cc2ccc(C(F)(F)F)cc2)nn1)=O,0 Z1986189331,Cn1ncc(CC2)c1CC2C(N(CCC1)CCN1C(c1cccc(F)c1)=O)=O,1 F5452-0124,O=C(c1c(CCC2)c2nn1C(CC1)CS1(=O)=O)NCc1ccco1,1 F6608-3743,C(C#CCOC(CC1)CCN1C1CCOCC1)N(CC1)CCN1c1ccccc1,1 F6438-2298,COc(nc1)nc(N2CCCC2)c1NC(C1CCCC1)=O,1 F3237-0154,COc(c(S(NCCN1CCOCC1)(=O)=O)c1)cc(Br)c1OC,0 F6550-6609,O=C(CSCc1ccccc1)N(C1)CC1Nc1ncncc1,1 F2829-0699,CCS(c1ccc(CC(Nc(ccc(F)c2)c2F)=O)cc1)(=O)=O,0 Z2228772040,CN(CC1)CCN1C(c1ccc(CNC(c2c(Nc3ccccc3)scn2)=O)cc1)=O,1 D470-2131,Cc(cc(cc1)S([C@@H](CS(C2)(=O)=O)[C@H]2NCCc(cc2)cc(OC)c2OC)(=O)=O)c1F,0 Z1994351732,CCn1ncc2cc(C(N(CC3)CC33CCOCC3)=O)c(C)nc12,1 Z1014332704,O=S(c1c[nH]nc1)(N(CC12CCC2)c2c1c(F)ccc2)=O,1 SD60-0280,O=C(c(cc(cc1)Cl)c1F)N(C1)CC11OCC(CCOCc(cccc2)c2F)C1,0 F6436-3508,CC(Cc1cocc1)NS(c1cn(C)nc1)(=O)=O,0 8016-9304,O=C(C(C1)C2(CCCCC2)OC1=O)Nc(cc1)ccc1C(NC1CCCCC1)=O,1 F6658-6153,Cc1cc(OCC2CCN(Cc3nnc(C4CC4)o3)CC2)ncn1,1 F6524-5434,O=C(NCc1nnc(cc2)n1nc2N1CCCC1)N1CCOCC1,1 Z1838769942,CCc(cc(cc1)O)c1NS(c1cc(cc(cc2)Cl)c2s1)(=O)=O,0 F6236-0002,CCS(N(CC1)CCN1c(cc1)nnc1-n1cncc1)(=O)=O,1 F6752-4388,Cc1nccnc1N1CC(C(N2CCSCC2)=O)OCC1,1 F6452-0028,CC(CNC(c1cscc1)=O)(c(cccc1)c1F)OC,0 Z2952781597,CCOc(cc1)c(C)nc1NC(N[C@@H]([C@H](CC1)O)c2c1cccc2)=O,0 F1132-0332,CCc(cccc1)c1NS(c(cc1)ccc1Br)(=O)=O,0 Z2931990565,Cc1ccc(C(N[C@H](Cc2c3cccc2)[C@@H]3N)=O)o1,0 Z1013935628,Cc(nc(cc1)-c2cscc2)c1C(Nc1cc(C(N)=O)ccc1)=O,0 Y042-1347,c1(n2c(nn1)cccc2)[C@@H](NC(c1c2c(onc2C)nc(c1)C)=O)CC(C)C,1 Z758204716,Cc1c(C(N2Cc(cccc3)c3OCC2)=O)sc(NC(c2cc(F)ccc2)=O)c1,0 Z1119154610,Cc1c(C(NCc2cc(-n3cncc3)ncc2)=O)nnn1-c(cccc1)c1Cl,0 Z1341817952,NC(C(CCCC1)C1NC(CN(CCCCC1)C1=O)=O)=O,1 F5772-6100,CC(C)(C)NC(NCCCS(N(CC1)CCN1c1ccccc1)(=O)=O)=O,0 Y044-4842,C([C@@H](n1cccc1)CC(C)C)(Nc1cc2c(NC(=O)CO2)cc1)=O,1 T854-0634,COCCN([C@@H](CCCC1)[C@]1(CC1)C(NCCc2cnccc2)=O)C1=O,0 F3320-0888,COc(cc1)cc2c1[nH]c(C(c1ccccc1)O)n2,0 Z1744744787,CCc(cccc1)c1S(N(C)C(C)CS(C)=O)(=O)=O,0 Z250-0368,O=C1NC(N(CC2)Cc3c2cccc3)=Nc2c1scc2-c(cc1)ccc1F,0 F5834-3451,O=C(c1ccccc1)N(CC1)Cc2c1ccc(NC(Nc(c(F)ccc1)c1F)=O)c2,0 L606-0334,Cc(ccc(NC(NC1=NC=CN(c2cc(CCC3)c3cc2)C1=O)=O)c1)c1F,1 Z2597403785,OC[C@H](CN(Cc(cc1)ccc1C(O)=O)C1)[C@@H]1c1cscc1,0 F6357-1967,CC(C)(CNC(Nc(c(F)ccc1)c1F)=O)c1cscc1,0 Z1618026657,Cc(cc(c1nc(O)c2)F)cc1c2C(NCCCN1CCCCC1)=O,1 Z2483023241,CNC(CC(CC1)CCN1C(C(O)=O)c1cc(Cl)cc(Cl)c1)=O,0 P244-0422,CC1N(CCNC(CC(c(nccc2)c2C2=O)N2c2ccc(C)cc2)=O)CCCC1,1 F6678-9277,CC(C)c1nc(cccc2)c2n1C(C1)CN1c1nncs1,1 Z947159522,O=C(NC1c(cccc2)c2OC1)Nc1cn(CC2OCCC2)nc1,1 SA96-1053,CC(C)CNC(C1C(C2)(CN2C(c2cocc2)=O)CN(Cc2ccccc2)C1)=O,1 SB58-0710,CN(C)CC1C(C2)(CN2C(c2nccc3ccccc23)=O)CN(Cc2ccccc2)C1,0 F3407-5089,Cc1cccc(Cn(cc2)c3c2C=CN(CC(Nc(cccc2)c2C(OC)=O)=O)C3=O)c1,1 V021-2260,CCOc(cc1)ccc1N(CC(C1)C(NCCCN2CCOCC2)=O)C1=O,0 Z3132725786,O[C@@H](CNC1)[C@@H]1NC(c1cccc(OCc2cscn2)c1)=O,1 F1800-0078,CC(C(N1CC(NCc2ccco2)=O)=O)SC(C)C1=O,1 Z1334219440,CNC(N(CC1)CCN1C(c1cc(scc2)c2s1)=O)=O,0 F3406-3525,CCc1c(C(NCc(cc2)cc(Cl)c2F)=O)sc(-n2cccc2)n1,0 Z73230289,O=C(Cn1nnc2c1cccc2)Nc1cccc(Cl)c1,0 Z729071420,Cc(cc12)ccc2ncnc1NCc1nc(C)ccc1,0 Z4135141534,CC(c1noc(C(C)(C)C#N)n1)Oc(ccc(Br)c1)c1Cl,0 SC45-1030,CC1n2nnc(CNC(NC)=O)c2CN(Cc2ccccc2)C1=O,0 Y042-1324,c1(n2c(nn1)cccc2)[C@@H](NC(c1c2ccn(c2ccc1)CCOC)=O)CC(C)C,1 F6502-9201,Cc1cc(CCNC(NCc2cccs2)=O)nn1C,1 Z1140077448,COc1c(C(NC2CN(Cc3ccccc3)CCC2)=O)scc1,0 S213-0098,O=C(Cc(cc1)ccc1Cl)N(CC1COCC1)C1CC1,1 Z3402984525,O[C@@H](C[C@H]1CC2)C[C@H]2N1C(Nc1nc(-c2cnccc2)cs1)=O,1 F6156-0179,O=C(c1cc(cccc2)c2o1)N1CC(COc2ccccc2)C1,1 F6492-0614,Cc1nc(CC(CC2)C(NCCC3=CCCCC3)=O)c2[nH]1,1 Z1472746286,Cn1c(-c2n[nH]c(NC(C(C3)c4c3cccc4)=O)c2)ncc1,1 Z2776234386,CSC1(CNC(Cc(cc2)ccc2-n2cncc2)=O)CCC1,1 F5652-2686,CC(C(Nc1ncc(C)s1)=O)N(C(C=C1)=O)N=C1c(cc1)ccc1F,1 Z1548289180,Cc1cc(C(F)(F)F)c(cc(C(N(C2)CN(Cc3ccccc3)C2=O)=O)o2)c2n1,1 Z68639787,CCC(Nc1nc(cccc2)c2n1CC)=O,0 Z4136002371,Cc1cc(Cn2c(-c3ncccc3)ncc2)cnc1Cl,0 Z364617058,NC(c(cc(cc1)NC(C(C=C2)=CN(Cc(cccc3)c3Cl)C2=O)=O)c1F)=O,0 Z431771342,CC(C)C(N=C(C1CCCCC1)N1)=CC1=O,1 Z1229932710,CC(C1)Cc2c(C(Nc3nnn[nH]3)=O)c3ccccc3nc2C1=Cc1ccccc1,1 Z2976508855,Cc1nc2ncnn2c(N(CCC2)CC22Oc(cccc3)c3C=C2)c1,1 F820-0535,CCc1nc(CN(c(ccc(S(Nc2ccc(C(C)C)cc2)(=O)=O)c2)c2O2)C2=O)no1,0 Z1755425164,Cc1nnc([C@@H](C2)N(Cc(cc(cc3)F)c3C#N)C[C@H]2OC)o1,0 Z1889900610,Clc1ccc(Cn2c(cccc3)c3nc2)c(Cl)n1,0 SB25-0401,O=C(C(CC1)CCC(N=C(c2ccccc2)N2)=C1C2=O)N(CC1)CCC1N1CCCCC1,1 Z734669386,CC(C1C(CC2)CC2C1)NC(CCn1ncc(Br)c1)=O,1 8009-3264,CC(C1)OC(C)CN1C(CC(N1c2ccccc2)=O)C1=O,0 F6814-6662,CC(C1)N(Cc(cc2)cnc2OC)CCN1c1nccc(C(F)(F)F)n1,0 S721-0974,N#Cc(cc1)ccc1C(N(C[C@H](C1)Oc2cnccc2)[C@@H]1C(NC1CC1)=O)=O,1 SD68-0734,Cc1noc(C)c1S(N1CC(C(N(Cc2cc(C)ccc2)CC2)=O)N2CCC1)(=O)=O,1 Z1994501653,C[C@@H](CN(CC1)C(c2cc(C3CC3)no2)=O)N1S(C)(=O)=O,1 Z2482094058,Cc1cc(C(N[C@@H](CC2)Cc3c2nc(N)s3)=O)cnn1,1 F6525-2114,Cn(c(CNC(c1noc(C2CC2)c1)=O)c1)nc1-c1nccnc1,1 F6244-2688,O=C(NCC#CCN1CCOCC1)Nc1c(C(F)(F)F)cccc1,0 F6619-7906,Cc1cc(C)nn1-c1ccc(N(CC2)CCN2c2nccnc2C)nn1,1 V018-7177,CCN(Cc(n1CC2OCCC2)cnc1S(Cc1ccccc1)(=O)=O)C(c(cc1)ccc1F)=O,0 Z1139864951,CC(Nc(cc1)c(C)cc1NC(c1c(C)n(-c2cccc(Br)c2)nc1)=O)=O,0 G730-0085,O=C(c(cc1)cc2c1n(CCCC1)c1n2)NC1CCCCCCC1,1 F6764-3317,Cc1nc(n(C)nc2)c2c(N2Cc3cc4cccnc4nc3CC2)n1,1 Z2407624021,CC(C1)(C1F)C(Nc1nc(cc2OCOc2c2)c2[nH]1)=O,1 E213-0680,CC(CC(C)C1)CN1C(c1c(C)c(C(N(CCCC2)C2=N2)=O)c2s1)=O,1 F6789-6308,Cc1nc(C(F)F)cc(Nc2cccc(Cl)c2)n1,0 Z3687118299,C[C@H]1N(C)[C@@](CNC(c2c(NCCC3)n3nc2)=O)(CO)COC1,1 Z1828001508,CCn1ncc(S(N(CC2)CCc3c2ccc(C(O)=O)c3)(=O)=O)c1,1 F6259-0651,Cc(cc1)cc(Br)c1NC(C(CC1)CCN1c1ncnc(C2CC2)c1)=O,1 Y042-3975,O=C(C(C1)CN(Cc2ccco2)C1=O)Nc1nnc(C2CC2)s1,1 F6573-7216,CC(C)(C)C(N(CCN1c2cnccc2)CC1=O)=O,0 Z1379389923,CN(C(C1(CCCC1)C#N)=O)c(cc1)nnc1-c1ccccc1,1 M575-0066,CCN(C(C(NCCC1=CCCCC1)=O)c1c(C2)cccc1)C2=O,1 Z2286019617,CC(C)(c1noc(CC(CC2)CNC2=O)n1)C1=CCCCC1,1 G514-0125,O=S(c(cc1)ccc1F)(Nc1cc(N(CCC2)S(c(cc3)ccc3F)(=O)=O)c2cc1)=O,0 Y206-4116,Cc1ccc(CNC(C(C2CC3CC2)C3C(O)=O)=O)cc1,0 SB27-0063,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CCC1N(C1)C2(COCC2)CNC1=O,1 T502-0871,Cc1noc(C)c1S(N(CC1)CCC1(C(NC1CC1)=O)F)(=O)=O,1 F6474-8004,O=C(C1CCC1)N(CC1)CC1N(C(CN1)=O)C1=O,1 Z3482516168,O=C(NC1)Nc2c1ccc(OCCc1cnccc1)c2,1 Z4339120264,C[C@@H](c1cc(cccc2)c2o1)NC(Nc1nn(CCN(CCN2)C2=O)cc1)=O,1 F6439-4527,O=S(c(cc1)ccc1OC(F)(F)F)(NCCn(cc1)nc1-c1ncccc1)=O,1 Z2127866132,Cc(nc1)nc(N)c1C(N(CC1)CCC1c(cc1)cc(F)c1F)=O,0 L840-0403,O=C(c1nnc(-c2csc(S(NCCC3=CCCCC3)(=O)=O)c2)o1)N1CCCCC1,1 SA31-0935,CC1(C(NCCCN(CCC2)C2=O)=O)n2c(-c3ccccc3)nnc2COC1,1 F5526-0166,O=C(c(c(F)ccc1)c1Cl)NCCOc(cc1)ccc1F,0 Z756915102,O=C(c1nsnc1)NC(CC1)CCN1C(c1ccncc1)=O,1 Z4185128534,C(CC1Nc2nn3c(-c4ncccc4)nnc3cc2)C2CC1NCC2,1 F3398-1340,Cc1c(c2ncnc(N(CC3)CCC3C(NCc(cc3)ccc3SC)=O)c2s2)c2nc(C)c1,1 F6539-2565,CN(C)S(N1CCC(CNC(Nc(cc2)cc(Cl)c2Cl)=O)CC1)(=O)=O,0 J500-0389,CC(C)NC(C(C1)C2(CCCC2)CN1C(c1cn(C)cn1)=O)=O,1 S787-0354,Cc1cccc(C(N2CCC(Cc3ccc(CCC(NC)=O)cc3)CC2)=O)c1,0 F6660-0343,COCC(N=C(N1CCCC1)N1Cc(cccc2)c2C#N)=CC1=O,0 Z3071538038,Oc1c(C(CC2)C(N(CCC3)CC3NCC(F)(F)F)=O)c2ccc1,0 T502-2041,CC(C)CNC(N(CC1)CCC1(C(NCCOC)=O)F)=O,0 L164-0727,CC(C)Cc(cc1)ccc1S(Nc1ccc(C2(CC2)C(NCCCc2ccccc2)=O)cc1)(=O)=O,0 C630-0389,Cn1c(cccc2)c2nc1C(CC1=O)CN1c(cc(cc1)OC)c1OC,0 F6799-8557,FC(c1nnc(C2)n1CCN2c1ncnc2c1CCC2)(F)F,1 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S690-2154,CCNC(N1CCC(Cc(cc2)ccc2C(N(C)Cc2cnccc2)=O)CC1)=O,1 S639-3419,CN(C)C[C@@H](CN(C1)S(C)(=O)=O)[C@H]1NC(c1cccn1C)=O,0 C880-1463,Cc1cc(Cn2c(C(N(CC(NCC3OCCC3)=O)N=C3)=O)c3c3c2cccc3)c(C)cc1,0 L822-0303,Cc1c(-c2noc(CN3c(cc(cc4)Cl)c4OCC3=O)n2)oc2c1cc(C)cc2,1 G369-0037,CCC(Nc(cc1)ccc1S(N(CC1)CCC1(N1)Oc(cccc2)c2C1=O)(=O)=O)=O,0 F536-0374,CC1Oc2cc(S(N(CC3)CCN3C(c3c(C)cc(C)cc3)=O)(=O)=O)c(C)cc2NC1=O,0 F3406-7241,O=C(CN(C=NC1=C2CCCC1)C2=O)Nc(cc(C(F)(F)F)cc1)c1Cl,0 S988-1079,CCS(N(C[C@@H]1CN(C2)C(Nc3cc(OC)ccc3)=O)C[C@@]12c1nc(C)no1)(=O)=O,0 F6608-5230,CN1CCN(CC#CCOC(CC2)CCN2C(c2cccc(F)c2)=O)CC1,1 Z1301121016,CCN(C)CC1CN(CC(Nc2nccs2)=O)CC1,1 Z2611661898,CN(C1CCN(Cc2ccccc2)CC1)c1nccnc1,0 F2267-0440,COc(cc1)ccc1S(N1C(CC(NCc2ncccc2)=O)CCCC1)(=O)=O,1 F6191-0471,OC1CCN(CCNC(Nc2cccc(Cl)c2)=O)CC1,0 F6443-5692,Cc1ccc(cccc2C(NCc3cc(Oc4ncccc4)ccc3)=O)c2n1,1 Z2763012492,CC(C)c(cc1)ccc1NC(C(C1)CN(C2CN(C)C2)C1=O)=O,1 SB91-0285,O=C(C1CC1)N(CCN1CCCCC1)C(CC1)CN1C(c1ncncc1)=O,1 Z2964086849,O[C@@H]1[C@H](CCNC(c2cn(cccc3)c3n2)=O)CCCC1,1 Z780243266,Cc1cccc(C)c1OCC(N(CCC1)CC1N1CCCC1)=O,1 Z3042255663,COCc1c(CNC([C@H](C2)N[C@@H]3[C@H]2OCC3)=O)cccc1,0 F537-0195,CC1Oc(ccc(S(N(CC2)CCN2C(CCC2CCCC2)=O)(=O)=O)c2)c2NC1=O,1 G408-0472,Cc1noc(-c(o2)ccc2S(N(CC2)CCN2C2CCCCC2)(=O)=O)c1,1 SC66-0505,CCCOc(cc1)ccc1S(N(C1)CC2(CCOCC2)C1c1nncn1C1CC1)(=O)=O,0 F6656-3190,N#Cc(cc1)cnc1N1CCC(COc2nnc(C3CC3)cc2)CC1,1 F3398-4410,COc(cccc1)c1N(C(N(Cc1cc(C#N)ccc1)c1c2cccc1)=O)S2(=O)=O,0 Z3602191610,CCn1nnc(NC(N2C[C@](C)(CC3)C(C)(C)[C@H]3C2)=O)c1,1 Z822048108,Cc(cc1NC(CN(CC2)CCC2NC(c2cscc2)=O)=O)nn1-c(cccc1)c1F,1 Z2625341335,Cc1noc(C(CC2)CN2C(Nc2c(N(C)C)nnc(C)c2)=O)n1,1 Z644406038,Cc1nc(n(-c2ccccc2)nc2)c2c(Nc2cccc(N(CCO3)C3=O)c2)n1,0 F6556-0664,OC(CNC(c1csc(-c2ccccc2)n1)=O)(CSC1)c2c1cccc2,1 CM3123-0494,O=C(CCc1c[nH]c2c1cccc2)NC(CC1)CN1C(C=C1)=NNC1=O,1 V014-9367,CCOC(c(cc1CCC(C)C)nn1-c(cc1)ccc1C(NCC(C)(C)C)=O)=O,0 8019-4893,OC(CC(c(cc1)ccc1-c1ccccc1)=O)(c(cccc1)c1N1Cc(cccc2)c2Cl)C1=O,1 Z2960455197,CC(C)Cc1ccc(C(N(CCC2)CC2n2nncc2)=O)s1,1 Z4273057553,CC(C)n1nc(C)c(CN2CC(c3c[nH]nc3)OCC2)c1,0 F6743-6296,Cc1nc2ncnn2c(N(CC2)CCC2N(C)S(C2CC2)(=O)=O)c1,1 SC44-0122,Cc1cc(C(N(CC2)CCC2(C2)OCCC2OCC(N(C)C)=O)=O)c(C)n1CCCOC,0 Z1258668007,CC(CN(C)Cc1cc(cccc2)c2o1)C(O)=O,0 Z3989662866,Cc1cc(N(C)CC(N2)=Nc(scc3-c4ccccc4)c3C2=O)n[nH]1,1 Z1726358586,COC([C@H](Cc1c[nH]c2c1cccc2)NC(C(C1)C1c(ccc(Cl)c1)c1Cl)=O)=O,0 T479-0946,CC(CC1)CCN1c1cncnc1-n1ncc(NC(NC2CCCCC2)=O)c1,1 F6751-4177,O=C(C1)N(Cc2ccccc2)CCN1c1nccn2nc(C3CC3)cc12,1 S993-1019,O=C(CN1Cc2ccccc2)N(CCN(CC2)S(c3cccc(Cl)c3)(=O)=O)C2C1=O,1 F0630-1290,CCC(N1C(SCc2cc(C(F)(F)F)ccc2)=NCC1)=O,0 Z1693132674,CC(c1nc(C)cs1)NS(c1ccnn1C)(=O)=O,0 Z3882173252,C=C1CC(CN(C(CN2CC3(C4)COC4C3)=O)C2=O)C1,1 F1899-2322,C(c1csc(-c2ccccc2)n1)Sc(cc1)nnc1-n1nccc1,1 Z4518074045,Cc1cc(Br)cc2c1CCNC2,0 Z2604076457,CN(CCN(CC(Nc(cc(cc1)F)c1F)=O)CC1)C1=O,0 F6796-3463,CC(C)(C)c(nc1cc2)cn1nc2OCC1CN(Cc2c(C)nc(C)s2)CC1,1 F6696-0155,Cc(cncc1)c1OC(CC1)CN1c(n1C)nc2c1nccc2,1 F6436-0347,Cn1c(CN(Cc2cccs2)C(CSC2CCCC2)=O)ccc1,1 F6444-0578,CCOc(cccc1)c1C(N(CC1)CCC1N1C(COCc2ccccc2)CCC1)=O,1 F6541-4560,OCC1N(Cc2cc(Br)cs2)CCC1,0 Z752454318,CCOc(ccc(NC(CC1=C(C)N=C(c2cnccc2)NC1=O)=O)c1)c1OC,0 Z748716746,COc(cc1)cc(C(NC(CCCCN2)C2=O)=O)c1OC,0 Z3132088511,Cc1c(CC(N2CCC3(CNC3)CC2)=O)nc(-c2cccs2)o1,1 SC04-0922,COCc1nc(CCOC(CCC2)CN2C(NC2CCCC2)=O)no1,1 F6057-0487,O=C(Nc(cc1)ccc1F)N1CCN(CCn2nccc2)CC1,1 Z2850273371,CCOc1noc(C(NCc(cc2)ccc2N2CCN(C)CC2)=O)c1,0 Z2232759465,CCOC(C1)CN1C(c(cc(C)cc1)c1N1CCCC1)=O,1 M952-0209,Cc([nH]c(C)c1S(NCCN(CC2)Cc3c2cccc3)(=O)=O)c1-c1nnc(C)o1,1 Z655070324,CC(c1n[nH]cc1)Nc1c(CO)cccc1,1 F5558-0406,Cc1cc(C)nn1-c1cc(N(CC2)CCN2C(Cc2cccs2)=O)nc(C)n1,1 Z2090517434,NS(c(cc1)cc(C(N(CC(c2ccccc2)O)Cc2ccccc2)=O)c1F)(=O)=O,0 Z1262979107,CCOc1cccc(CNC(CN(CC2)CCC2c2c[nH]c3c2cccn3)=O)c1,0 V012-3941,O=C(CCN(C1CCCCC1)c1nc(-c2cccs2)nc2ccccc12)N1CCCC1,1 L487-0839,COc(c1c2)cc(-c(cc3)ccc3Cl)nc1ccc2NC(NC1CCCCC1)=O,0 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Z2958014573,O=C(CC(CC(N1)=O)C1=O)N(CC1)C(Cc2ccccc2)c2c1cccc2,1 Y042-3415,CS(c(cc1)cc2c1nc(NC(C(C1)CN(Cc3ccco3)C1=O)=O)s2)(=O)=O,0 SA18-0259,CCN(CCn1c2nc(C(N3CCN(CCOc(cc4)ccc4Cl)CC3)=O)c1)C2=O,0 Z2438736514,CN(CC1)CCC1(C1)OCCN1C(Nc1cc(C(N2CCCC2)=O)ccc1)=O,1 Z1324395321,O=C(C(C1)C11CCCC1)NCc(cc1)cnc1OCC(F)(F)F,1 F5496-1710,Cc1nnc(C2CCN(CC(NCC3OCCC3)=O)CC2)s1,1 SC40-1055,O=C(C1OCCC1)N(CC1)CCC11OCc2c(COc3ccccc3)nnn2C1,1 Z3185122807,CCN(C1CC1)C(c1c(N[C@@H](C)C[C@H]2C(F)F)n2nc1)=O,1 Z2964722096,CC(C)c1c(C)sc(CC(NC2(COC2)c2ccccc2)=O)n1,1 D011-0835,COc(cc1)ccc1OCCn1c(cccc2)c2nc1C(CC1=O)CN1c(cccc1)c1Cl,0 F5649-0103,Cc(n(C(N1)=NC(C)=CC1=O)nc1)c1C(NCCC1=CCCCC1)=O,1 Z1204854590,O=C(Cc1ccccc1)N(CCC1)C1C(Nc1cc(-c2nnc[nH]2)ccc1)=O,1 F5937-0109,O=C(c(c(F)ccc1)c1Cl)NCCCn1cccc1,0 Z1444595806,CC(C(O)=O)N(C)C(CCN(c(cccc1)c1C(N1)=O)C1=O)=O,0 Z954616132,CCC(C(O)=O)NC(c(nc(C(C)C)nc1)c1Cl)=O,0 Z2982761643,C[C@@H](c(cc1)c(C)cc1F)n1nnc(Cn2nc(C)nc2C)c1,0 Z2804216345,O=C(c(sc(N1CCCC1)n1)c1Cl)N1CC(CS(C2)(=O)=O)C2CC1,1 F6524-0957,O=C(C1(CC1)c1ccccc1)NCCN1N=Nc(cccc2)c2C1=O,1 Z1653291374,CC1(C(C2CC2)OCC1)NS(c1cc(F)cc(C)c1)(=O)=O,1 F1016-0087,O=C(CSc1ncccn1)N(CC1)CCN1c1ccccc1,1 Z1747830539,CC(C)CN(CCN(C1C)C(c2cn(C)nc2)=O)C1=O,0 Z1328991440,CC(C)N(C1CCCC1)C(CN(C=Nc1cccc(F)c11)C1=O)=O,1 F6540-1028,C=C(CCC1)CN1C(C(CC1)Oc2c1cccc2)=O,1 F6573-8531,O=C(c1cc(-n2nccc2)ccc1)N(CCN1c(nc2)ncc2F)CC1=O,1 Z2723088926,COc1cc(-c2noc(NCCC(O)=O)n2)cc(F)c1,0 Z4690852526,CC(N=C(c1cc(NC(c2cn(CCN)nn2)=O)ccc1)N1)=CC1=O,0 Z2612504744,CC(CO)(CC1)CCN1c1ccnc(-c(cc2)ccc2OC)n1,0 F5016-1100,Cc1cc(CN2CCC(CNC(C(Nc(cc3)ccc3C(OC)=O)=O)=O)CC2)c(C)o1,0 F6539-4070,COc1ccc(CNC(NCCCc2cc(cccc3)c3o2)=O)cc1,1 F3406-4319,Cc1nc(-c(cc2)ccc2F)nc(OCC(Nc(cccc2)c2C(OC)=O)=O)c1,0 Z2607585148,CC(C)(C)C(C(NCc1nc(-c2ccncc2)no1)=O)C(O)=O,1 Z2434231775,NC(c1cc(-c2csc(NC(CCC3CNCC3)=O)n2)c[nH]1)=O,1 Z1559076589,Cn1c(C(CCC2)N2S(c(cc2F)cc(F)c2F)(=O)=O)nnc1,0 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F6559-3816,COC(c(cc1)ccc1C(NC(CC1)CCN1C(CC1)CS1(=O)=O)=O)=O,0 F6089-3224,CCN(c(ccc(NC(C(C=C1)=NN(C)C1=O)=O)c1)c1OCC1(C)C)C1=O,1 Z3000735136,CCc(n(C)nc1)c1C(N(CCOC1)C1c1ccc(COC)o1)=O,1 F3398-5439,Cc1cccc(C(Nc2c(C(NCCOC)=O)[nH]c3c2cccc3)=O)c1,1 F6517-0177,OC(CNC(COc(ccc(Cl)c1)c1Cl)=O)c1ccc(-c2ccco2)o1,1 V014-1787,CCCN(CC(N(CC1OCCC1)Cc1ccco1)=O)C(Cc(cc1)ccc1F)=O,0 Z1497664069,CC(CC(NC(CC1)CCS1(=O)=O)=O)c(ccc(F)c1)c1F,0 F6561-0765,COCc1cn(C(CC2)CN2C(Cn(cc2)c3c2cccc3)=O)nn1,1 F6521-3144,CC(c1ccc(CCNC(c(cc2)ccc2Cl)=O)s1)O,0 F5854-0505,O=C(NC1CCCCC1)N(CCc1ccccc1)Cc1ncccc1,1 V006-1585,CC(C)(C(NCC1OCCC1)=O)N(CC(N1C)=C2C(c3cc(C)ccc3)NC1=O)C2=O,0 L309-0113,Cc1nc(CN2c(cc(cc3)S(NCC4OCCC4)(=O)=O)c3OCC2=O)no1,1 F6557-2048,O=C(C1COCC1)N(CCC1c(cccc2)c2Cl)CCS1(=O)=O,1 F6225-0319,CN(CC(NCCC1=CCCCC1)=O)c1nc(c(OC)ccc2)c2s1,1 Z477255968,N#Cc1c(CS(NC(c2ncc(C(F)(F)F)cc2)=O)(=O)=O)cccc1,0 F6561-2466,O=C(COc(cc1)ccc1-c1ccccc1)N(CC1)CC1OCC1CC1,1 S691-1596,CC(C)n1c(CC(CC2)CN2S(c(cc2)cc3c2OCCO3)(=O)=O)ncc1C,0 Z1769679608,CS(N(CCC1)C1C(NOCc(ccc(F)c1)c1Br)=O)(=O)=O,0 Z600504616,OC(c1cccc(CNC(c(ccc(Cl)c2)c2F)=O)c1)=O,0 T408-1113,CN(CC1)CCN1C(C(CC1)Cc2c1sc(C(N1CCCCCC1)=O)c2)=O,1 Z394641286,CCOc(cc1)c(C)cc1S(NC(C1=O)=C(C)N(C)N1c1ccccc1)(=O)=O,0 F1609-0723,Cc(cc1)c(C)cc1NC(CN(C=C1C(c(cc2)ccc2F)=O)c(ccc(Cl)c2)c2C1=O)=O,1 D222-0207,COc(cc1)cc(C(CN(CC2)CCN2C(Nc2cccc(Cl)c2)=O)=C2)c1OC2=O,1 F6727-5849,Cn1ncc(C(N(CC2)CCC2N(C(C=C2)=O)N=C2c2ccccc2)=O)c1,1 F5498-0061,COc(ccc(Cl)c1)c1NC(N(CC1)CCC1c1nnc(C2CC2)s1)=O,0 F6802-9498,Brc(cncc1)c1N(CC1)CCC1Oc1nccs1,0 F6543-1146,O=C(c1cn(cccc2)c2c1)N(CC1)CCS1(=O)=O,1 Z2170655647,CCCCOc(ccc(C(C)NC(Cc1cncnc1)=O)c1)c1OC,1 V016-3173,CC(C)(C)NC(C(C1)CN(Cc(cc2)ccc2F)C1=O)=O,0 Z1271573337,CC(C)(CC(N1Cc2nc(C)no2)=O)C1=O,1 F3394-1262,O=C(CSc1nnc(-c2ccccc2)o1)Nc1c(C(F)(F)F)cccc1,1 F6252-2092,O=C(c1cccn1Cc1nc(-c2ccccc2)no1)NCc1ccco1,1 F6573-7287,COc(cccc1)c1OCC(N(CCN1c2cnccc2)CC1=O)=O,0 Z1632967220,Cc(c1c2)n[nH]c1ncc2NC([C@@H](c1ccccc1)OC)=O,1 SC58-0282,Cc1cc(C)nn1Cc1c(C)onc1C(N(C1)CC1(CN(C)C1)C1c1ncc(C)o1)=O,1 F6837-2760,Cc1cccc2c1nc(N1CC(COc3nnc(C)cc3)CC1)s2,1 Z241898570,NC(c([nH]c1ccc2)cc1c2OC(F)F)=O,0 F6564-2325,Cc1cc(OCC(NCCN2N=C(C3CC3)C=CC2=O)=O)cc(C)c1Cl,1 Z2620220121,OCC(C(N(Cc1ccccc1)C1CC1)=O)c1ccccc1,0 F1911-2942,CC(C)(C)OC(NCc1ncnc(-c2ccccc2)c1)=O,0 SC10-0934,Cc1noc(C)c1CN(CC1)CC1N(CCCN1CCCC1)S(C)(=O)=O,1 Z1124504173,Cc(ccnc1)c1NC(CC1CNCCC1)=O,1 F6524-6149,Cc(cccc1)c1OCC(N(CC1)CCN1C(CC1)CCS1(=O)=O)=O,0 SA63-0846,CCn1ncc(CN(CC2)CCC22OCCC(CCNS(C)(=O)=O)C2)c1C,0 Z2579433153,CC(C)N(CC1)CCN1C(CC1)CCN1S(N(CC1)CCC1OC)(=O)=O,0 SA04-0005,Cc1cc(C(N(CCC2)CC2c2nc(C)ncc2CO)=O)c(C)o1,0 F5027-0838,CCOc(cccc1)c1NC(N1CC(c2ccc(C(F)(F)F)cc2)OCC1)=O,0 M954-2367,CCn(c(C)c1-c2nc(C3CC3)no2)c(C)c1S(NCc1ccc(C)o1)(=O)=O,0 F6451-0157,COC(CNC(Cc(cc1)cc(OC)c1OC)=O)c(cccc1)c1OC,0 F6216-0315,Cc1noc(CCCNC(NCc(cc2)cc(OC)c2OC)=O)c1,1 Z1558697789,CC(C)COC(CC1)CCN1c1nnc(C(F)(F)F)cc1,0 G015-0329,O=C(c1cccn1-c1nnc(N2CCCC2)s1)N(CC1)CCN1C(c1ccco1)=O,1 Z3388126527,CC(N[C@H](CC1CCC1)C(NCC(COC)(CC1)CCN1C(C)=O)=O)=O,1 SB70-0871,CC1(CCCCC1)C(N[C@@H](Cc1c2)Cn1nc2C(NCc1ccccc1)=O)=O,1 Z2023074700,O=C(C(C1)=NNC1=O)NCC(CC1)CCN1c1ncccn1,1 F6795-5806,Cc1nccn1-c(cc1)nnc1N(CC1)CCN1c1nc(cccc2)c2o1,1 Z3216015216,C=CCOC(CC1)CN1c(c1c(cc2)[nH]nc1)c2[N+]([O-])=O,0 F3267-0013,Cc1cccc(NC(c2cc(-c3ncccc3)nc3ccccc23)=O)n1,1 Z905800982,CCC(C)NC(C(C)NC(C(CC1=O)CN1c(cccc1)c1F)=O)=O,0 T632-2584,CCCn1c(C(CC2)CCN2C(C2(CC2)c2ccccc2)=O)nnc1,0 Z284535562,CCOc(ccc(C(NCC(Nc(cc1)ccc1-n1cncc1)=O)=O)c1)c1OCC,0 Z737184646,Cc(cc1)c(C)c2c1c(CC(NC1(CCCCC1)C(N)=O)=O)co2,1 F5105-0070,CCOc(c(C)c1)c(C)cc1S(NCc1cscc1)(=O)=O,0 L831-0151,O=C(CC(COc(cccc1)c1N1)C1=O)Nc(cc1)cc2c1OCCO2,1 F5097-0229,CN(C)S(c(cc1)ccc1C(Nc1ccc(CC(N2CCOCC2)=O)cc1)=O)(=O)=O,0 Z2763544182,O=C(C1)Nc2c1cccc2-c1ccc(CN2CCOCC2)cc1,1 F6515-1923,O=C(C(CCC1)N1c1nc(cccc2)c2o1)NCc1c(-c2ccco2)nccc1,1 F1756-0340,CCOc(cc(cc1)S(NC(C)c2ccccc2)(=O)=O)c1Br,0 Z1585901467,CC(c1cc(cccc2)c2s1)NC(NCCC(CC1)CCN1c1ccncc1)=O,1 Z2965766304,CN(c(cccc1)c1N1CC(N(C[C@H]2CC3)C[C@@H]2S3(=O)=O)=O)C1=O,0 Z3416612952,CN=S(CC1)(CCC1(C1)OCCN1C([C@@H](C1)[C@H]1c1cc(F)ccc1)=O)=O,1 Z1263876081,CC(C)[C@H](C(O)=O)NC(c(cc1)cc(F)c1OC)=O,0 Z348743310,CC(C)CN(Cc(cc1)ccc1C#N)C(c(cc1)cnc1C(O)=O)=O,0 F6564-9003,Cc1nc(cc(cc2)NC(C(CC3)CCN3c3nnc(CCC4)c4c3)=O)c2s1,1 Z3046644119,CC(C)(C1)OCCN1C(N[C@H](Cc1c2cccc1)[C@@H]2N)=O,1 Z45686122,Cc1cc(NS(c(cccc2)c2[N+]([O-])=O)(=O)=O)cc(C)c1,0 Z1470676827,Cc1c(C)c(NCC(CC2)CCN2S(C)(=O)=O)nn2c1nnc2C(F)(F)F,1 S248-3693,O=C(NCc(cc1)ccc1F)N1CC(Cc2noc(-c3ccncc3)n2)CC1,1 F6802-7653,Cc1nc(n(C)nc2)c2c(N(CC2)CCC2C(N(CC2)CCC2(F)F)=O)n1,1 Z2801412718,CC(C)(CC1)C1NC(c1c(C)[nH]cn1)=O,1 Z1264054021,CC(C)(C)c1cc(C(N(CC2)CCN2c(cc2)ccc2F)=O)no1,0 F6808-5475,CC(C)NC(C(C)N1CCN(Cc2noc(C3CC3)c2)CC1)=O,1 J023-0043,CCSC(N1)=NC(NC(CC2C(Nc3cc(F)ccc3)=O)=O)=C2C1=O,0 Z1495910474,CCN(CC(N(CCCC1)C1c1nc(cccc2)c2o1)=O)C1CC1,1 Z3026724896,CCc(cccc1)c1-n1nnc(C(N[C@@H](CO)C(F)(F)F)=O)c1,0 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Z2966107350,Cc(c1cc(NC(C2(CCC2)OC)=O)cnc11)nn1-c1ccccc1,1 F6619-3532,CN(C)c1ccnc(N2CCN(Cc3cccc(Cl)c3)CC2)n1,0 F6469-2729,O=C(NCc(cc1)ccc1F)Nc(cccc1)c1-c1cn(ccs2)c2n1,1 T040-0019,Cc(cc1)ccc1NC(CCc1cc(N2CCCC2)ncc1)=O,0 C137-2397,O=C(C1CC1)N(CCc1c2)c1cc(S(NCCN(CC1)CCN1c1ccccc1)(=O)=O)c2Br,1 8011-5886,CCCCNC(C(Nc1ccc(C(C)(C)C)cc1)=O)=O,0 Z2763718160,CN(C[C@H]1c2cncn2C)C[C@H]1NC(C1(CC1)Oc(cccc1)c1F)=O,1 F6796-7801,CCn1c(ncnc2N3CCN(Cc4nnc(C(F)(F)F)o4)CC3)c2nc1,1 Z2719626648,CC(CC1)CN1c1nccc(C(N(CC2)CCC2(C)N2CCOCC2)=O)c1,1 Z1101709959,CC(C)(C)c1nnc(NC(c2cscn2)=O)s1,0 S606-1677,CN(c1cccnc1N1[C@H](CC2)CN2S(c2cc(F)cc(F)c2)(=O)=O)C1=O,0 SC44-0373,O=C(COC1CC(CC2)(CCN2S(C2CC2)(=O)=O)OCC1)N1CCOCC1,1 F6764-1547,Clc1cc2ccc(C3CCN(CC4OCCc5c4cccc5)CC3)nc2nc1,1 Z1225450162,Cc1cccc(C(N(CCC2)CCN2c2nc(OC)cc(C)n2)=O)c1,1 M099-2431,CC(CCC1)CN1c(cc1)nnc1-c1csc(S(N2CCCCC2)(=O)=O)c1,0 Z3468482602,O=C(C1(C2CCC1)C2(F)F)Nc(cc1)cc(C(NC2CC2)=O)c1Cl,1 SC10-0065,COc(cc1)ccc1NC(N(CC1)CC1N(CCCN1CCOCC1)S(C)(=O)=O)=O,0 F2147-1719,CC(C)(C)OC(N(CCOC1)C1c1nnn[nH]1)=O,1 SA50-0007,CC1(CC1)C(N(C1)Cc2c1c(-c1nc(C)no1)nn2C)=O,1 F5097-1170,COC(Nc1ccc(CC(NCc2cccs2)=O)cc1)=O,1 C604-0046,CSC(N(CCCC(NC1CCCC1)=O)C1=O)=Nc2c1sc1c2cccc1,1 Z2964917535,Cc1c(C(N(CC[C@@H]2CC3)[C@]23c2cnccc2)=O)nc[nH]1,1 Z2358890227,CC(C)n1ncnc1CNS(c1cc(C)c(C)s1)(=O)=O,0 F5660-0046,O=C(CC1)N(Cc2ccccc2)C1c1nc(-c2cccs2)no1,1 Z3800327110,CC(c1cc(cccc2)c2o1)NC(CN(C(CC1(CCC1)C1)=O)C1=O)=O,1 F707-3459,O=C(C(CC1)CCN1c(cc1)nn2c1nnc2)NCC1CCCCC1,1 SB24-0198,CCN(CC)C(c1cn(C(CC2)C2(CC2)CCN2C(c2nc3ccccc3cc2)=O)nn1)=O,1 F6798-4993,CC(N=C(NC1=O)N2CC(CN(C3)C(c4cc(Br)cnc4)=O)C3C2)=C1F,1 Z2188072595,Cc1c(C)ncn1-c(cc1)ccc1NC(C(N1)=CC=CC1=O)=O,1 F6791-9200,CCc1nnc(C(CC2)CCN2c2ncnc(C3CC3)c2)s1,1 F6192-1050,CN(C=CC=C1C(NCC(c2cscc2)c2ccco2)=O)C1=O,1 F2740-0263,Cn1c(cccc2)c2c(NC(N(CC2)CCN2c(cccc2)c2Cl)=O)c1,0 F6677-3899,Fc1cc(CN2CC(Cn3ncc(Br)c3)C2)cc(F)c1,0 SD07-0355,CCS(N(CC1)CC11OCc2c(CNC(c3cc(C)ccc3)=O)nnn2C1)(=O)=O,0 Z1754594605,C(C(C1)C11CCOCC1)NC1CCCCCC1,1 Z2972202764,CS(NCC(CC1)CCN1c1nccs1)(=O)=O,0 F6439-7660,Cc(onc1)c1C(NCCn1c2ccnn2cc1)=O,1 Y502-7609,CCn1nc(C)c(S(N(CC2)CCN2S(c2c(C)n(C)nc2)(=O)=O)(=O)=O)c1,0 Y041-6041,O=C(c(cc1)cc(N2)c1OCC2=O)NCC1C(CCCC2)N2CCC1,1 F6559-1450,COc(cc1)nc(OC)c1C(NC(CC1)CCC1(F)F)=O,0 F6495-2036,CS(c(cc1)ccc1NC(c1ncnc(N2CCCC2)c1)=O)(=O)=O,0 Z3992203376,O=C(c1c(-c2ccco2)[nH]nc1)Nc(cc1)ccc1Oc1cnccc1,1 F0654-0396,CC(C)c1nc(N(C)C(N(C)C2=O)=O)c2c(SCC=C)n1,1 F6526-0207,O=C(c1noc2c1CCCC2)N1Cc2cc(C3CC3)nn2CC1,1 F6246-0887,CCOc(cccc1)c1NC(CN1N=C(c2cnccc2)N(C2CC2)C1=O)=O,1 SA59-0130,Cc1cn(Cc2cc(C(N(CCN3CCCCC3)C3CCOCC3)=O)no2)nc1,1 Z3141936062,NC(C1)C1(C1)CC1NC(c1cc(C(F)(F)F)cnc1)=O,0 Z1297272097,O=C(c(c(F)cc(F)c1)c1F)Nc1ccnn1-c1ccccc1,0 Y020-3470,O=C1N(C2CCCC2)C=Cc2c1cnc(N1CCOCC1)n2,1 Z1565775375,CC(C)(C)c1nn(C)cc1C(N(C)Cc(cc1)ccc1O)=O,0 F3394-1103,O=C(c1ccccc1)Nc1nsc(-c2ccccc2)n1,1 F6696-0141,Cc(cncc1)c1OC(CC1)CN1c(cc1)nn2c1nnc2C(F)(F)F,0 F6489-0109,O=C(c(cc1)cc2c1OCO2)N(CC1)CC1Oc1nnccc1,1 F5527-1270,O=C(C(CCC1)CN1c(cc1)nnc1-c1ccco1)Nc(cc1)ccc1OC(F)(F)F,0 Z1322676963,CN(C)CC(N(CC1)CCN1C(C(C1)CC1OCc1ccccc1)=O)=O,1 F6496-1575,COc(cc1)ccc1C(N=CN1CC(NCc2ncnc(C3CC3)c2)=O)=CC1=O,1 F6524-2802,Cc1c(C(N(CC2)CC2c2noc(-c3ccccc3)n2)=O)c(C)n[nH]1,1 SA50-0692,Cn(c(C1)c2CN1S(c(ccc(F)c1)c1F)(=O)=O)nc2-c1nc(CCOC)no1,0 F6660-1217,CCCN1C(SCC2COCC2)=Nc(cccc2)c2C1=O,1 Z2720864567,O=C(c(cccc1)c1Nc1cccc(C(F)(F)F)c1)NCC1COC1,1 G856-6434,O=C(CSc1nnc(cc2)n1nc2-c1ccccc1)Nc(cc1)cc2c1OCCO2,0 Z1983658000,CN(CCCC(O)=O)S(c1cccc(Br)c1F)(=O)=O,0 S607-0478,O=C(NC1CCCCC1)N(CCC1)C[C@H]1N(c(nccc1)c1N1Cc2ccccc2)C1=O,1 F5017-0850,O=S(c(cccc1)c1Cl)(NCC1CCN(Cc2cccs2)CC1)=O,0 F6241-0009,O=C(C(COC1)N(Cc2ccccc2)C1=O)NCc1nc(cccc2)c2[nH]1,1 S932-1628,COCc1cn(C(CC2)CN2C(c2cccs2)=O)nn1,0 Z3305558949,Cc(cc1)cc(C(C2COCC3)N4)c1OC23N(Cc1cccs1)C4=O,1 T404-0419,O=C(c1cccs1)N(CC1)CCN1c1nnc2n1cc(C(F)(F)F)cc2,1 Z27719678,CCN(CC)CCNC(c(cccc1)c1SCC(Nc1ccc(C)cc1)=O)=O,0 Z1437523120,Cn1c(C(CCC2)CN2C(c2cc(-c3cc(OC)ccc3)n[nH]2)=O)nnc1,0 Z2953122589,CC1OCCN(CCNC(Nc2csc(C)c2)=O)C1,0 F6359-1242,O=C(CCN(C=Nc1c2cccc1)C2=O)N(CC1)CCC1Oc(cc1)ncc1Cl,1 Y031-7171,CCC(CCCC1)N1C(CCNC(c1ccccc1)=O)=O,1 F5001-2941,CC(C1)Oc(cc2)c1cc2-c1cc(CC(NCc2ccco2)=O)no1,1 F6523-0987,CN1N=C(CCC(C2)C(N3CCN(Cc(cc4)cc5c4OCO5)CC3)=O)C2=CC1=O,1 F6359-1808,Cc1c(C(N(CC2)CCC2Oc2ncccc2C#N)=O)sc(C)n1,1 E990-0039,Cc1noc2c1c(N(CC1)CCC1C(NC1CCCCCC1)=O)ncn2,1 F6805-9832,O=S(c1c2cccc1)(N=C2N1CC(COc(nccc2)c2Cl)CCC1)=O,1 F1652-0773,CN(C)S(c(cc1)ccc1NC(Nc(cc1)ccc1Cl)=O)(=O)=O,0 F6560-0898,O=C(NC(C1CCOCC1)c1cccs1)OCC(F)(F)F,1 Z2911811222,CCC(C(NC(CC(O)=O)C1CCCC1)=O)OC1CCCC1,1 Z2768783878,CCc(cccc1)c1OCc1nnc(CC2)n1CC2C(OC)=O,0 F6195-0344,CC(Nc1nc(CCN(CC(N(C)c2ccccc2)=O)C2)c2s1)=O,1 P432-0287,Cc1c(c(N2CCCC2)nc(C(NCCN2CCOCC2)=O)n2)c2nc(C)c1,1 Z3203844519,CNc(nc1)cnc1C(Nc1cccc(CN=S2(CCCC2)=O)c1)=O,0 F5493-0343,O=C(c1nc2ccccc2cc1)N(CCC1)CC1c1nnc(-c(cccc2)c2F)s1,1 F6608-0744,Cc1nc(C(F)(F)F)cc(OC2CSCC2)n1,1 Z1748811478,Cc1ccc(Cn(cc2C(N(CC3)CCC3(C(F)F)O)=O)nc2-c2ccc(C)cc2)cc1,0 Z1603714110,Cc(nc(-c1ccccc1)nc1)c1C(NC(CCCCCC1)C1C(O)=O)=O,1 Z1870114358,CC(C)(C(F)(F)F)c(cc1)ccc1NS(c1cn(CC(OC)=O)nc1)(=O)=O,0 Y020-0599,Cc1nc(SC(C(c2ccccc2)=O)c2ccccc2)nc2c1CCCC2,1 Z3510391716,O[C@@H]1[C@H](CNC(c2cc(Br)cc(C(O)=O)c2)=O)CCC1,0 Z3357226681,CC(C)N(CCC1)C1C(NS(c1c(C)ccs1)(=O)=O)=O,1 K292-0949,CCC(C)N(C1=O)C(SCc2ccc(C)cc2)=Nc2c1scc2,0 Z3325175382,Cc1nc(C(Nc(cc2)ccc2-c2nc(ccc(C)c3)c3s2)=O)co1,0 Z1307823443,CC(C(NC(C)(C)C)=O)NC(NCc(cc1)cc(F)c1Oc(cccc1)c1F)=O,0 Z1396827823,O=C(NC(CC1)CN1c(nccc1)c1F)N(CC1)CC1N1CCCC1,1 F6665-9882,Cc1cc(NCc2ccc(C(F)(F)F)cc2)no1,1 F6504-1136,Cc1c(CCNC(CSc(cc2)ccc2F)=O)c(C)nn1-c1ncccc1,1 F5855-0443,O=C(C(C1)C1c1ccccc1)N(CC1)CCN1C(c(cc1)ccc1-n1cccc1)=O,1 Z2335090615,O=C(CCc1cscn1)Nc1nnc(Cc2ccc(C(F)(F)F)cc2)s1,1 Z2474634204,Cc1c(C)oc(NC(N[C@H]2[C@H](CC3)O[C@H]3C2)=O)n1,1 F6543-1481,Cn1nc(C(CC2)CCN2C2=NC=CN(C)C2=O)cc1,1 F5761-0277,CC(C(Nc1c(C)c(C)ccc1)=O)N1N=CC=CC1=O,0 G856-4956,O=S(c(cc1)cc2c1OCCO2)(NCC(c1ccco1)N(CC1)CCN1c(cc1)ccc1F)=O,0 F6554-1035,Cn1nc(C(CCC2)CN2C(NCc2ccccc2)=O)cc1,1 M950-0571,Cc1c(-c2nnc(C3CC3)o2)[nH]c(C)c1S(Nc(cc1)cc(F)c1OC)(=O)=O,0 F6474-7124,CC(C)(C)c1cc(C(N(C2)CC2N(C(CN2)=O)C2=O)=O)cc(C(C)(C)C)c1,0 F6524-6154,O=C(c1ccco1)N(CC1)CCN1C(CC1)CCS1(=O)=O,1 Z774511744,O=C(c1noc2c1CCCC2)Nc1c(CN2CCOCC2)cccc1,1 Z1616771934,CC(C)Oc1cccc(C(N(CCC2)C2C(CCC2)C2=O)=O)n1,1 F6443-5936,CCOc(ccc(S(NCc1cc(Oc2ncccc2)ccc1)(=O)=O)c1)c1F,0 SA05-4235,CCc1ccc(CN2C(C(N(C)C)=O)c3nnc(C)n3CC2)o1,1 Z1765772760,CN1CCN(Cc2cccc(NS(c3cc(C(F)(F)F)ccc3)(=O)=O)c2)CC1,1 F3230-0016,CC(CC(Nc(cc(cc1)Cl)c1OC)=O)n1nc(C)c(C(C)=O)c1C,0 Z3050707429,CCc1cc(C(N(CC2)CCN2c2nc(C)cc(C)n2)=O)c(C)o1,0 Z1651030061,O=C(Cc1cc(NC(C2)=O)c2cc1)N1C(Cc2ccccc2)CCC1,1 G656-1261,Cc(cc1)c(C)cc1N(c1nc(-c(cc2)ccc2SC)nc(C(N)=O)c1N1C)C1=O,0 D430-2207,Cc1nc(N2CCCCC2)cc(Nc(cc2)ccc2NC(Nc2cccc(C(F)(F)F)c2)=O)n1,1 F6805-6118,O=S(c1c2cccc1)(N=C2NC(C1)CN1c1nccc(C(F)(F)F)c1)=O,1 J004-1113,Cc1noc(C(CCC2)N2C(c2c(C)onc2C)=O)c1,0 Z2332301737,CS(NC1C(CNC([C@@H](C2)[C@H]2c(cc2)ccc2Cl)=O)CCCC1)(=O)=O,0 F6796-8664,CC(C)c1c(CN(C2)CC(C3)C2CN3c2c(C(F)(F)F)cccn2)nco1,0 F6809-6032,O=C(c1ccccc1)N(CC1)CCN1c(nc1)ncc1Cl,0 Y501-3199,Cn1c(NC(c2c(cnn3C)c3nc(C3CC3)c2)=O)nc2c1cccc2,1 F6557-2033,O=C(Cc1cnccc1)N(CCC1c(cccc2)c2Cl)CCS1(=O)=O,1 D212-0140,O=C(C1)N(Cc2ccco2)CC1c1nc(cccc2)c2n1CCN1CCOCC1,1 Z2299437671,CC(CNC(CC1C=CCC1)=O)(CC1)NC1=O,1 Z2352639069,CC(N(CC1)c(cc2)c1cc2C(N[C@H](C1)C[C@H]1C(O)=O)=O)=O,0 F6482-7718,O=C(c1cc(-n2nccc2)ccc1)NCc1cccnc1-c1cccs1,1 Z2715144266,CCN(c(ccc(C(N(CC1)CCC1c1ncco1)=O)c1)c1N1)C1=O,1 F3385-0187,Cc(cc1)cc(C)c1NCC(c(cc1)ccc1OC)=O,1 SC60-0968,CC(C)CN(C(C(C1)N2CC(C)(C)CN1C(c(cc1)cnc1OC)=O)=O)C2=O,0 T828-1597,CCN(CC)c1nc(CCC(C2)C(NCCc3cccs3)=O)c2cn1,1 Z828517614,CC(C)N(C)S(c1ccc(CNC(c(cc2)cc(CC3)c2NC3=O)=O)cc1)(=O)=O,0 S592-0240,O=S(c(cc(cc1)F)c1F)(N(CC1)CC1c1noc(COCc2ccccc2)n1)=O,0 Z1527614631,Cc1c(C2(CNC(c(cc3)cc(CC4)c3N(C)C4=O)=O)CCOCC2)cccc1,0 SD22-0981,COC1(CC1)C(C1)(CN1C(Cc(cc1)ccc1F)=O)NC(c1ccccc1)=O,1 F6550-4441,O=C(CSc(cc1)ccc1F)N(C1)CC1Nc1ncccn1,1 F6413-2637,O=C(c1ccc(CNC(c(cccc2)c2Br)=O)s1)c1ccccc1,0 Z815206474,Cc1cc(CCC2NS(c3cc(C#N)ccc3)(=O)=O)c2cc1,0 S693-1618,Cc1cnc(C2CCC2)n1CC(CCC1)CN1C(C1CCCCC1)=O,1 F5871-3104,COc(cc1)cc(-c2n[nH]c(C(N(CC3)CCC3C(NCC(F)(F)F)=O)=O)c2)c1OC,0 S558-0447,Cc1c(CN(CC2)CC2Oc(cccc2)c2-c2nc(C3CCOCC3)no2)scc1,1 F6524-5769,Cn1c(C(NCc2nnc3n2ccc(C(F)(F)F)c3)=O)ccc1,1 S826-5683,COC[C@@H](CN(Cc(cc1)ccc1C#N)C1)[C@H]1c1nc(COC)no1,0 Z2773549377,CCN(CCS(C)(=O)=O)C(c1c(-c2ccco2)[nH]nc1)=O,0 F6514-3768,Cc1cc(C(N(C2)CC2n2nnc(COc3ccccc3)c2)=O)c(C)o1,1 F1915-2659,FC(c1cc(C(F)(F)F)cc(-c2ncccc2)c1)(F)F,0 SB68-0543,O=C(COCc1ccccc1)N[C@@H]1Cn2ncc(C(NCc3ccccc3)=O)c2C1,1 Z2348024375,CC(C)(C1)CC1N(C)c(cc1)ncc1S(C)(=O)=O,0 V004-3295,CCN(C(CN1C(CC(C)C)C(NCC2CC2)=O)=C(C(c2cc(Oc3ccccc3)ccc2)N2)C1=O)C2=O,1 Z511998124,O=C(CCC1OCCC1)N1C(Cc2cccc(F)c2)CCC1,1 Z2641018745,CCOC1(CCC1)C(N(CC1)CCN1c1cccc(F)n1)=O,0 SA73-0155,Cc1cc(C)nn1CCC(N(CC1)CCC1(CC1CC1)c1noc(C)n1)=O,0 L878-0345,COc1cc(NC(CN(c(cccc2)c2C(NC2CCCC2)=N2)C2=O)=O)cc(OC)c1,0 F6349-0106,CCOC(c1c(cc(cc2)NC(c(c(F)ccc3)c3Cl)=O)n2nc1)=O,0 S697-0357,Cc1cnc(C2CCOCC2)n1CC(CC1)CCN1C(CCC1CCCC1)=O,1 F6441-8998,COC(C(C(N(CC1)CCC1S(c1ccccc1)(=O)=O)=O)=CN1c2ccccc2)=CC1=O,1 Z1739117131,CN(C(C(O)=O)c1ccccc1)S(c(c(F)ccc1)c1F)(=O)=O,0 F2044-0031,CCOC(c(cccc1)c1NC(c(cc1)ccc1N(CCCC1)S1(=O)=O)=O)=O,0 G516-0154,COc(cc1)ccc1-c1nc2ccccc2c(NCCN(CC2)CCN2c(cc2)ccc2OC)n1,1 Z4327157107,CN(CCCC1)C1C(N(CCC1)CC1n1nnc(C2CC2)c1)=O,1 F6525-6801,O=C(c1ccncc1)NCCn1ncc(-c2ccco2)c1,1 Z2718680716,CC(N(C1CC1)C=C1C(NC(CCc2ccccc2)C(F)F)=O)=CC1=O,1 G856-0917,Cc(cc1)ccc1N(C1=O)C(SCc2ccc(C(F)(F)F)cc2)=Nc2c1[nH]c1c2cccc1,0 Z4120220747,CCN(CC)CC(N(CC1)CCN1c1c(cn[nH]2)c2ccc1)=O,0 F2984-0204,O=C(CCCS(Cc1ccccc1)(=O)=O)Nc1cccc(Cl)c1Cl,0 F5954-0135,CCOC(c(cc1)ccc1Nc1nnnc2c1cnn2-c1ccccc1)=O,0 F6514-8849,O=C(CNC(OCc1ccccc1)=O)NCc1cc(-c2cnccc2)ncc1,1 Z1408038054,CC(Cc(cccc1)c1F)NC(N(CC1)CC(CN2)N1C2=O)=O,0 F6749-0853,Cc(cc(C)nc1N2CCC(COc(nc3)ncc3Br)CC2)c1C#N,1 Z3687014662,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(c1cn2ncnc2cc1)=O,1 Z1685157457,CCOc1ccc(CCc2nc(C(CC3=O)CN3c3ccccc3)no2)cc1,0 Z3416614232,CCC(CC)n1nccc1C(N1CC(CC2)(CCS2(=NC)=O)OCC1)=O,0 C470-0662,CC(C)CCn1c(C(N(C)C(N2C)=O)=O)c2nc1CN(CC1)CCN1c1cccc(Cl)c1,0 SA01-0210,CN(C)c1ncc(C(NCCCN(CCC2)C2=O)=O)c(C(CC2)CN2S(C)(=O)=O)n1,1 S932-3350,O=C(c(cc1)cc2c1[nH]cn2)N(CC1)CC1n1nnc(COc2ccccc2)c1,1 Z2809007144,Cc(cc1)ccc1C(N(CC1)CCC1NC(NCCN(CC1)C[C@@H]1O)=O)=O,1 Z1815631487,CCNC(c1cc(NC(c2cn(CC(F)(F)F)nc2)=O)c(C)cc1)=O,0 V015-3040,CCc(c(CN(CC(COCc1ccccc1)O)C1CC1)c1Oc2cccc(F)c2)nn1-c1ccccc1,0 S726-0071,OCCC1CC(CC2)(CCN2C(C2CC=CC2)=O)OCC1,1 F5791-2384,COc(nccc1)c1C(NCc1nc(cccc2)c2[nH]1)=O,0 Y031-4192,O=C(C(C1)CN(CCc(cc2)ccc2F)C1=O)Nc(cc1)ncc1Cl,1 F632-0144,CCC(C)(C)NC(C(CCC1)N1S(c(cc1OC2)c(C)cc1NC2=O)(=O)=O)=O,1 SC99-0538,CS(N(CC1)Cc2c1n(Cc1ccccc1)nc2-c1ncc[nH]1)(=O)=O,1 Z2761388730,C([C@@H](CC1)O[C@@H]1c1ncn[nH]1)NCc1c2OCOc2ccc1,1 Z2086921539,O=C([C@@H](CCCC1)N1C1=O)N1c(cc1OCCCOc1c1)c1Cl,1 Z2863954046,CC(C)(CC1)Cn2c1nnc2CCc1ccccc1,0 F6523-2238,O=C(CSCc1ccccc1)N(CC1)CCC1N(C(c(cc(cc1)F)c1N1)=O)C1=O,1 F5017-0916,O=S(Cc(cccc1)c1F)(NCC1CCN(Cc2cccs2)CC1)=O,1 Z2311075698,CCO[C@H](C1)C[C@H]1NC(N(CCC1)CCN1c1nc(C)ns1)=O,1 SC02-0026,COCCC(CC1)(CN1C(c(ccc(F)c1)c1F)=O)NC(c(cc1)ccc1F)=O,0 F6188-0502,COCC(NCC1(CCOCC1)Sc1ccccc1)=O,1 F6442-0044,O=C(CN(C(CC1)=O)C1=O)N(C1)CC1S(c(cc1)ccc1F)(=O)=O,1 F6609-3491,COc1cccc(C(OCC(NCCC2=CCCCC2)=O)=O)c1OC,0 F6676-1016,Cc1nccc(OCC(CC2)CCN2C(c2cc(cccc3)c3o2)=O)c1,1 F6549-2673,O=C(CSCc1ccccc1)N(C(CC1)C2)C1CC2n1cncc1,1 8019-7996,COc(ccc(-c1csc(C(C2)c(cc3)ccc3OCc3cccc(Cl)c3)c1NC2=O)c1)c1OC,1 F6357-1472,CCOc(cc1)ccc1NC(NCC1(CC1)c1cscc1)=O,0 Z2607826783,CCc1c(C(N(CC2)C(C(O)=O)c3c2cccc3)=O)scn1,1 T835-2066,Cc1ccc(C(N2CC(Cc(n3CCOC)nc4c3nccc4)CC2)=O)s1,1 F6679-0016,O=C(Cc1cnccc1)N(C1)CC1n1c(cccc2)c2nc1C1CC1,1 S988-0630,Cc1noc([C@@](CN(C2)C(C3CC3)=O)(C3)[C@@H]2CN3C(C2CCOCC2)=O)n1,1 Z1538155494,Cc1cccc(Cl)c1NC(c1cnc(-c2cnccc2)s1)=O,1 F6733-1068,Cc1cccc(N(CC2)CCN2c(ncnc2C)c2F)c1C,0 Z2951728466,C[C@@H]1C[C@H](CO)N(C[C@@H](CO)O)CC1,0 SB75-0913,CCS(N[C@H](C[C@H]1CN(C2)C(NC3CCCCC3)=O)C[C@]12c1nc(C)no1)(=O)=O,1 F6818-1446,Cc1nc(C2CCC2)cc(N(CC2)CCN2C(N=CN2C)=CC2=O)n1,1 Z2731511492,Cc1n[nH]c(NC(C2Cc3cnc(C)n3CC2)=O)c1-c(cc1)ccc1F,0 Z3000833151,O=C(C1C2(CC2)C1)N(CC(Nc1c2)=O)c1cc(F)c2F,1 Z3501948677,CN(C)c(cc1)nc(OC)c1NC(N1CCCC1)=O,0 F6441-5417,CSC(CC1CC2)CC2N1C(C1(CCCC1)c1cccs1)=O,1 Z2311341133,COC(CC1)CCC1NC(N1CC(c2ccccc2)OCC1)=O,1 Z2079436406,O=C(C[C@@H](C(N1)=O)NC1=O)N1CCC(CC(F)(F)F)CC1,1 F2658-0025,O=C(c1cccc(F)c1)NCC(c1cnccc1)N(CC1)Cc2c1cccc2,1 F5860-1953,Cc(cc1)ccc1NC(N1CCN(CC(F)(F)F)CC1)=O,0 Z2897001807,CN(c1c2cccc1)C(C(NC1(CCCC1)C(O)=O)=O)=CC2=O,1 F5857-3538,CS(N(CC1)CCC1C(NCC(C(F)(F)F)(c1ccccc1)O)=O)(=O)=O,0 S233-1651,O=C(c1cccs1)NC[C@](CCC1)(CC2)[C@@H]1N(CC1CCCCC1)C2=O,1 F5860-2596,Cc1c(C(NCc2cnccc2)=O)oc2c1ccc(OC)c2,0 Z2474323249,CN(CC1CCOCC1)C(c1cnc(Nc2ccccc2)nc1C(F)(F)F)=O,1 F2261-0300,CC(C)(COc(cc(cc1)NC(Cc(cc2)cc(OC)c2OC)=O)c1N1CC=C)C1=O,1 4554-3074,CC(C)C(C(O)=O)NC(COc1ccccc1)=O,0 D470-1707,O=S([C@@H](CS(C1)(=O)=O)[C@H]1NC1CCCCCC1)(c1cccs1)=O,1 F5855-0845,O=C(C(C1)C1c1cccs1)N(CC1)CCN1C(c(cc1)cc2c1OCO2)=O,1 SA99-0362,COCCC(CC1)(CCN1C(CC1)CCN1C(c(ccc(OC)n1)c1OC)=O)C(N)=O,0 F5047-0164,O=C(C1OCCC1)N(CC1)CCC1(C(N1Cc(cc2)ccc2F)=O)NC1=O,1 F2775-1200,COc(cc1)cc(-c(cc2)nnc2SCC(NCC2OCCC2)=O)c1OC,1 Z2852730894,CC(CC(C1)C2)(CC1(C)C1)CC12C(N(CC1)Cc2c1ncnc2)=O,0 Z2773711652,CC1(CCOCC1)NS(c(cccn1)c1Oc(cc1)ccc1F)(=O)=O,1 F3398-5562,COc(ccc(N(C=CN=C1NC(Nc(cc2)ccc2F)=O)C1=O)c1)c1Cl,0 C137-2156,COc1cccc(N(CC2)CCN2S(c(cc(c(CC2)c3)N2C(C2CC2)=O)c3Br)(=O)=O)c1,1 Z1944054819,CCCc1c(C(N(CC2)CCC2OCC(OCC)=O)=O)nnn1-c1cc(C(C)C)ccc1,0 SD68-0725,Cc1cccc(CN(CCN(CCC2)C3CN2C(CC2CC2)=O)C3=O)c1,1 L294-0499,Cc(cc1)ccc1S(Nc(cc1)ccc1-c1noc(C2CC2)n1)(=O)=O,1 F6443-1425,COC(CC1)CCN1c(cc1)ccc1C(Nc1nc(cccc2)c2s1)=O,1 F5016-1696,O=C(COc1ccccc1)N1CCC(CNC(C(NCc(cc2)ccc2F)=O)=O)CC1,1 C325-0448,COc(ccc(Nc1c(-c(cc2)ccc2N2CCOCC2)nc2ncccn12)c1)c1OC,0 F6357-1983,CC(C)(CNC(Nc(cc(cc1)Cl)c1OC)=O)c1cscc1,0 Z2393248234,CN(C1CNCC1)C(c(cc1)cc(OC)c1OCc(cc1)ccc1Cl)=O,1 Z1676022156,Cc1nccc(N(CC2)CCN2C(C2(CCCC2)c2cc(OC)ccc2)=O)n1,0 F6521-8735,COc1cc(CCCC2(CNC(NCc3cccs3)=O)O)c2cc1,1 Z809747070,CCOc1ccc(C2(CNC(c3nn(C(C)(C)C)c(C4CC4)c3)=O)CCOCC2)cc1,1 Z1501057326,CC(CO)(CCC1)CN1C(c1cc(C)cc2c[nH]nc12)=O,0 4577-2587,Cc1cccc(C)c1NS(c(cc1)ccc1NS(c(cc1)cc2c1OCCO2)(=O)=O)(=O)=O,0 Z2482895178,OC(C(c1ccccc1)N(CC1)CCN1c1nccnc1)=O,0 F2240-0373,CN(C(C(CC1)(CCN1C(c(o1)ccc1Br)=O)N1)=O)C1=O,1 Z2800704563,CC(C)C(C1)CN1C(Cc1c(C(N(C2)CC2C(C)C)=O)c(C)co1)=O,1 F3406-6216,Cc1cccc(N(CC2)CCN2c(nc2)nc(N)c2C(NCc(cccc2)c2F)=O)c1,1 8018-8152,Cc1nnc2sc(-c(cccc3)c3NC(c(cc3)cc4c3OCCO4)=O)nn12,1 Z3019005812,COc1ccc(CNC([C@]2(CNC3)[C@@H]3CCOC2)=O)cc1,0 F2167-6976,Cc1c(Cn2ncc(Br)c2)sc(C)n1,1 CM3884-1244,CC(C)Oc(ccc(CN(CC1)CCC1(CC1)CCN(C)C1=O)c1)c1OC,0 Z2232244128,O=C(CNS(c1c[nH]c2c1cccn2)(=O)=O)N(C1)C(C2CC2)C11CCOCC1,1 SA44-0729,CN(CC(C1)(CN1C(c(cc1)cc(F)c1OC)=O)C1)C1c1nnc(-c2ccccc2)o1,0 F3216-0966,Cc(ccc(Cl)c1)c1NC(c1noc(-c(cc2)ccc2OC)c1)=O,0 SA58-0285,O=S(c(cccc1)c1F)(N1C(CCc2noc(-c3cnccc3)n2)CCC1)=O,0 F6806-7513,CCc1cnc(N(CCC2)CC2C(N(CC2)CCC2(F)F)=O)nc1,0 Z57611465,Cc(cc1)cc(C)c1NS(c(cc(C)cc1)c1OC)(=O)=O,0 C884-1596,CCC(C(NCCc1c[nH]c2c1cccc2)=O)n1c(C(N(C)N=C2)=O)c2c2c1cccc2,0 SB95-0210,CS(N(CCN1CCCCC1)C1CN(Cc2ccc(C(F)(F)F)cc2)CCC1)(=O)=O,1 F2113-0652,Nc1nc(cc(C(F)(F)F)cc2)c2n1Cc1ccco1,0 F6473-7788,CC(O1)=CC(OC(CC2)CN2C(COc(ccc(Cl)c2)c2Cl)=O)=CC1=O,1 F5860-0882,CCOC(N(CC1)CCC1NC(Cc1c(C)nc(-c2ccccc2)s1)=O)=O,1 SA69-0290,CC(CCC1)(CN1S(c1cccc2nsnc12)(=O)=O)c1noc(C2CCOCC2)n1,1 Z2453843192,COc(cncc1)c1N(CC1)CCN1C(C1CC2(CCC2)C1)=O,1 F3411-5061,CCC(C(Nc1c(C)ccc(C)c1)=O)Sc1nnc2n1C=CN(c1cc(OC)ccc1)C2=O,0 F6724-5555,CN(C)S(N1CCC(CNc2c(cc(cc3)Cl)c3ncn2)CC1)(=O)=O,0 Z2231494289,COC1(CCNC(c2cc(Br)cs2)=O)CCC1,1 F0696-3878,OC(CC1)CCN1C(c(cc1)nnc1N1CCCC1)=O,1 F6753-2767,Cc1nc(CN(CCC2)CC2C(N2CCOCC2)=O)no1,1 Z3103301785,Cc1nnc(CN(C)C(C(CC2)(c3c2c(OC)ccc3)N)=O)n1C,0 F6560-4372,CC(C)C(Cn1ncnc1)NC(c1cc(F)cnc1)=O,1 G856-8423,Cc1c(CCNS(c(cc(cc2)F)c2OC)(=O)=O)sc2nc(-c(cc3)ccc3F)nn12,1 F5823-0001,O=C(CSC1CCCC1)N1CCC(Cn2nccc2)CC1,1 F6619-5760,Cc1ccnc(N2CCN(CCc(cc3)ccc3OC)CC2)n1,0 V019-8961,O=C(C1CC1)N(CC1OCCC1)Cc(n1CC2OCCC2)cnc1S(Cc(cc1)ccc1F)(=O)=O,1 F6442-4587,Cc(nc1oc(-c2ccccc2)nc1c1)c1NC(Nc(cccc1OC)c1OC)=O,1 SC23-0544,CS(N(CCc1noc(C2CC2)n1)C1CN(Cc2ccc(C(F)(F)F)cc2)C1)(=O)=O,1 Z3009552531,Cn1ncc(-c2c(C(N[C@H](C3)[C@@H](C4)[C@H]3CC4C(O)=O)=O)occ2)c1,1 Z3899120598,COC(CC(CC1)CC2(CC2)N1C(c1ccccc1)=O)=O,1 Y204-6184,Cc1ccc(-c2nc3ccccc3c(C(N(CC3)CCN3c3ncccn3)=O)c2)o1,1 8018-4534,O=C(CC1)Nc(cc2)c1cc2S(N(C1)c(cccc2)c2NC1=O)(=O)=O,1 F2850-0287,Cc(cc1)ccc1SCC(N(CC(NCc(cccc1)c1Cl)=O)C=C1OC)=CC1=O,1 Z976204262,Cc1nc(CSc(cccc2)c2C(NC(Cc2ccccc2)C(N2CCCC2)=O)=O)cs1,1 C648-0238,CN(c(ccc(S(N(CCC1)CC1C(NCCCN1CCOCC1)=O)(=O)=O)c1)c1O1)C1=O,1 F6608-4055,CC(N1CCN(CC#CCOC(CC2)CCN2c2nccn3nc(C)cc23)CC1)=O,1 F6683-1382,CN(CCC1N2CCC(COc(ccnc3)c3Cl)CC2)C1=O,0 F6469-1321,O=C(c(cc1)cc2c1ncs2)Nc(cccc1)c1-c1csc(-c(cccc2)c2F)n1,1 S941-0193,COc(cc1)cc(OC)c1C(N1CC(Cc2nncn2C2CCCC2)C1)=O,1 Z2442857669,O=C1N(Cc2nc(-c(cc3)c(C(F)(F)F)cc3F)no2)CCNC1,0 V029-4641,O=C(C1CCC1)Nc(cc1)cc2c1n(Cc1ccc(C(F)(F)F)cc1)c(C(NCc1ccco1)=O)c2,1 F6241-0139,O=C(C(COC1)N(Cc2ccccc2)C1=O)NCCc1c[nH]c2c1cccc2,1 F6802-7325,C=CCNC(CN1CC(C(N2CCCC2)=O)OCC1)=O,1 Z1773384941,CC(N(CC1)CCN1c1cccc(NC(N(CC2)CC22CCCCC2)=O)c1)=O,1 SC89-0285,CCOc(ccc(CN(C1)CC1(C(CN1CCCCC1)CC1)S1(=O)=O)c1)c1OC,1 L880-0112,CCN(C1=O)C(SCC(N=C2N3C=CC=C2)=CC3=O)=Nc2c1n(C)c(cc1)c2cc1OC,1 F6523-3643,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1)CC2=C1N=C(C=CC=C1)N1C2=O,1 F2373-1768,CC(C)c(cc1)ccc1OCC(NCC(CN1c(cc2)cc(OC)c2OC)OC1=O)=O,1 L942-0094,CCC(C)NC(CCN(c(n1-c2c3cccc2)nnc1SCC(Nc(cccc1)c1F)=O)C3=O)=O,0 Z2798430175,C[C@H](c1cc(O)ccc1)NC(N(CC1)CC1(COC)C(O)=O)=O,0 SC89-0112,O=C(c1cc(Br)cnc1)N(C1)CC1(C(CN1CCCC1)CC1)S1(=O)=O,0 F6200-4083,OC1(CNC(CSc(cc2)ccc2F)=O)c(cccc2)c2OCC1,1 F5857-6587,OC1(CNC(C2c(cccc3)c3Oc3c2cccc3)=O)C=CCCC1,1 F6764-4598,O=C(C1CC=CCC1)N1Cc2cc3cccnc3nc2CC1,1 SB39-0416,CCS(N(CC1NC(c2ccc(C)s2)=O)CC2(CCCC2)NC1=O)(=O)=O,1 Z2607824657,OC(C(c1c(CC2)cccc1)N2C(CN(CCCC1)C1=O)=O)=O,1 F0894-0081,CCOC(C(C1c2cnccc2)=C(c2ccccc2)NC(SCC)=C1C#N)=O,1 E667-1295,CC(CC(NCc1ccc(C)cc1)=O)S(c(cc1OC2)c(C)cc1NC2=O)(=O)=O,0 M021-0199,Cc(sc(-c1nnc(C(N2CCCC2)=O)o1)c1)c1S(N1CCOCC1)(=O)=O,1 2767-0188,COc(cc1)ccc1N1C(SCC(c(cc2)ccc2Cl)=O)=Nc(sc2c3CCCC2)c3C1=O,0 SD68-0042,O=C(CCCc1ccccc1)N1CC(C(NCC2)=O)N2CCC1,1 Z253395830,O=C(C1OCCC1)NOCc1ccccc1,1 CM3852-5868,Cc(cc(CN1Cc(cccc2)c2OC2(CCN(CCOC)CC2)C1)cc1)c1OC,0 F6554-0842,Cn1nc(C(CCC2)CN2C(c2cc(-c(cc3)cc4c3OCO4)n[nH]2)=O)cc1,1 Z980411860,O=S(c(cc1)cc2c1OCC2)(Nc1conc1)=O,1 F6524-0923,O=C(CCN(C=Nc1c2cccc1)C2=O)NCCN1N=Nc(cccc2)c2C1=O,1 F5559-0028,Cc1nc(-n2nccc2)cc(NCCNC(c2cccc(F)c2)=O)n1,0 SC11-1006,O=S(Cc(cc1)ccc1Cl)(N(CCCN1CCOCC1)C1CNCCC1)=O,0 F3395-0143,FC(c(cc1)cnc1N(CC1)CCN1C1CCN(CC2CCOCC2)CC1)(F)F,0 F2571-0055,Cc(cc1)ccc1NC(NCCC(CCCC1)N1S(c1ccccc1)(=O)=O)=O,1 G121-0735,COc1cccc(C2)c1Oc(nccc1)c1N2c1ccc(C(NCCC2=CCCCC2)=O)s1,1 SB54-0176,Cc1nnc([C@@H](C2)[C@@H](COC)CN2S(c(cc(cc2)OC)c2OC)(=O)=O)o1,0 S904-1690,CCOc1c(CN(C[C@H](C2)O)[C@@H]2c2nnc3n2CCN(C)C3)cccc1,0 Z2991909423,CC(C)(c1nn(Cc2c(C)c(OC)ccc2)nn1)S(C)(=O)=O,0 Z3033850484,CCC(C1)OC(CC)CN1C(N)=NCC1(CCOCC)CC1,0 F5857-3136,CC(CNC(c(o1)ccc1Br)=O)(c(cc1)cc2c1OCO2)O,0 L310-2052,Cc1nc(CN(C(COc2c3)=O)c2cc(C)c3S(N(CCC2)c3c2cccc3)(=O)=O)no1,1 V022-1695,CC(C)CC(N(CC1)CCC1C(C(NC(C)C(C)C)=O)NC(c1c(C)cccc1)=O)=O,0 F0594-0579,O=C(CSc1nnc(Cc2ccccc2)o1)N(CC1)CCN1c1ccccc1,1 F2145-0283,FC(Oc(cc1)cc2c1nc(NCC1OCCC1)s2)(F)F,0 S737-0097,O=C(Cc1ccccc1)N(CC1)CC(C(N2C3CC3)=O)N1CCS2(=O)=O,0 Z2982762316,C[C@H](c(cc1)c(C)cc1F)n1nnc(CO)c1,0 SC91-0826,Cc1cccc([C@@](C[C@H]2CC3)(CN2C3=O)C(NCCn2nccc2)=O)c1,1 SB71-0794,O=C(Cc1cccs1)N1Cc2cc(C(NC3CCCC3)=O)nn2CC1,1 F6171-0841,CCc(cc1)ccc1OCCS(NCc(cc1)ccc1Cl)(=O)=O,1 Y043-4988,CC[C@H](C)[C@@H](c1nc(cccc2)c2[nH]1)NC(CCN(C(c1cccnc11)=O)C1=O)=O,0 S615-0207,O=C(NCc(cc1)ccc1F)N(CC1)CC1c1nc(CCOc(cc2)ccc2F)no1,1 Z2044903436,O=C(C(CCC1)CN1C(Nc1ccccc1)=O)NCc1nn(Cc2ccccc2)cc1,1 F6475-1493,Cc1cc(cccc2)c2n1CCNC(c1cc(OC2COCC2)ncc1)=O,1 F5777-0320,COc(ccc(CNC(Nc(cccc1)c1NC(c1cccc(Cl)c1)=O)=O)c1)c1OC,1 Z1567121906,CC(C)(C1)[C@H]1C(NC(C)(C1)Cc2c1cccc2)=O,1 Z2627897585,OC(c(cc1)ccc1C(N1CC2(CC2)COCC1)=O)=O,1 F6438-0539,CCCC(Nc(c(C)n1)c(C)nc1Oc1ccccc1)=O,0 Z2407822493,CN(CCC(CNC(c1c2OCCOc2ccc1)=O)C1)C1=O,1 SC88-1501,O=C(C1CCCCC1)N(C1)CC1(C(CC1)c2nc(-c3ncccc3)no2)S1(=O)=O,1 Z1655982310,O=C(c1cn(CCC(F)(F)F)nc1)N(CC1)CCC1c1nncn1C1CC1,1 Z4107630074,COC(C(C1)(Cc2c1cccc2)NC(c(cc1)cc(O)c1OC)=O)=O,0 Z1762845395,CC(C)(C(O)=O)c(cc1)ccc1NC(c1coc(C)c1)=O,0 Z2762239885,Cc(cc1)cc(C)c1C(NC[C@H](C[C@@H](C1)OC)N1c1ncnc(C)c1)=O,0 D727-0633,Cc1nc2ccccc2c(-c(s2)nn3c2nnc3-c(cc2)ccc2OC)c1,0 F6619-7846,Cc1cc(C)nn1-c(cc1)nnc1N1CCN(Cc2csc(-c3ccccc3)n2)CC1,1 F6806-6249,O=C(CN(CC1)CCC1NS(C1CC1)(=O)=O)Nc1cc(C(F)(F)F)ccc1,0 Z3300346216,CC1(CNCc2c3OCOc3ccc2OCOC)CCN(C)CC1,1 Z4970360075,Cc1ncc(C(Nc2c(ccs3)c3nc(-c3ncccc3)n2)=O)n1C,1 8018-1057,CC(C(c1ccccc1)OCC1)N1S(c(cc1)ccc1N(CCC1)C1=O)(=O)=O,1 F6617-2048,O=C(c(c(N1)ccc2)c2F)N(Cc2ncccc2)C1=O,1 L712-0741,CC(C)c1nc2cccnc2n1CCN(CC1)CCN1C(Nc(ccc(Br)c1)c1F)=O,0 G856-4855,O=C(COc(cc1)ccc1Cl)N(CC1)CCC11OCCN1S(c1cccs1)(=O)=O,1 Z2272781907,Cc1cc(F)c(CC(N(CC2)CCN2S(c2nnc[nH]2)(=O)=O)=O)cc1F,0 F1016-0399,O=C(CSC1CCCCC1)Nc(cc(C(F)(F)F)cc1)c1Cl,0 F6774-4089,COc(cn1)cnc1OC(CC1)CN1c1nc(C(F)(F)F)cs1,1 SC04-0335,Cc1c(CN(CCC2)CC2OCCc2noc(C3CCOCC3)n2)scc1,1 Z2263323417,CC(C)N([C@@H](CCN(Cc(cc1)cc2c1OCCCCO2)C1)[C@@H]1N1)C1=O,1 F067-1373,CC(C)CCN1C(SCC(c2ccccc2)=O)=Nc(cc(cc2)C(NCC3OCCC3)=O)c2C1=O,1 V017-1706,Cn(c(Oc(cccc1)c1F)c1CN(CC(CN2CCOCC2)O)CC2CC2)nc1-c1ccccc1,1 G672-0050,CN(C)S(c(cc1)cc(N2CC(NC3CCCCCC3)=O)c1N(CCCC1)C1C2=O)(=O)=O,0 Z2482979969,OC(C1CCN(Cc(c(C(O)=O)ccc2)c2Cl)CC1)c(cc1)ccc1Cl,0 S976-0042,O=C(C(CCC1)(CN1C(NCc1ccccc1)=O)F)N1CCCC1,1 F6773-4681,Cc1cnc(C)c(OC(CC2)CCN2c2nccnc2C#N)n1,1 F455-0434,Cc(cc1)ccc1C(C(c(cc1)ccc1C(O)=O)N(Cc(cc1)ccc1SC)C1=O)=C1O,0 Z2610279489,CC1(C(F)F)OCCN(CCOc(ccc(C(O)=O)c2)c2Cl)C1,0 Z1225460341,FC(c1nc(N(CCC2)C2c2c3OCCOc3ccc2)ccc1)(F)F,0 Z2494671816,CCc1c(C)sc(NC(NCC2OC3(CCCC3)CC2)=O)n1,1 F0575-0027,Cc([nH]c1c2cccc1)c2SCC(Nc(ccc(OC)c1)c1OC)=O,0 SD61-0066,CN(CCOC)C(C(C1)C2(CCC2)CN1c1ncccn1)=O,0 Y042-2562,Cn1c(cccc2)c2c(CCC(NC(CC2)c(cc3OC)c2cc3OC)=O)c1,1 F5831-3178,COc(ccc(Cl)c1)c1C(N(CC1)CC1c1ccccc1)=O,0 SB94-0316,O=C(C(C1)CN(CC(CC2)CCN2C(NC2CCCCC2)=O)C1=O)N1CCOCC1,1 Z2068062998,CCC(C(O)=O)(c1ccccc1)NC(c1c(C)onc1C)=O,0 Y043-8844,O=C(c(cc1)cc2c1[nH]cc2)NC(CCC1)c2c1c(cccc1)c1[nH]2,1 E852-3433,CCN(C(C)(Cn(c1c2)nc2C(NC2CC2)=O)C(NC2CCCC2)=O)C1=O,1 SB36-0825,O=C(Cn1cncc1)N(C1)[C@H](Cn2nnc(C(NCc3ccccc3)=O)c2)CC1(F)F,0 Z1228039277,O=C(c1cc(Cl)nc(Cl)c1)N(CCc1ccc2)Cc1c2Br,0 Z2270603094,CC(C)(C1CCC1)C(N(C1)CC1C(F)F)=O,1 2389-1354,NC(c(cccc1)c1NC(C(Cc1ccccc1)N(C(c1c2cccc1)=O)C2=O)=O)=O,0 J101-0290,COCc1n[nH]c(-c2cccc(NC(CC[C@H](C(Nc3c4cccc3)=O)NC4=O)=O)c2)n1,1 Z2953621454,Cc1nn2c(NC(N3CC(CC4CCOCC4)C3)=O)ccnc2c1,1 F5729-1179,CC(C(N1CCC(Cn2c(cc(C)c(C)c3)c3nc2)CC1)=O)Oc1ccccc1,0 F6203-1709,Cc1ccc(C(CNS(C2CC2)(=O)=O)OCCO)cc1,0 F6475-0866,Cc1nsc(NC(c(cccn2)c2OC2COCC2)=O)c1,1 F6497-3129,CC(C(N1CCC(CC(N2c3c(C)cccc3)=NNC2=O)CC1)=O)n1nccc1,1 F6562-0829,Cn1ncc(C(CN(C2)C(CN(C=Nc3c4cccc3)C4=O)=O)c3c2cccc3)c1,1 Z3254885712,CC(Cn1ncc2c1ccc(Br)n2)(C(F)(F)F)O,0 K788-9268,Cc1nn2c(N(CC3)CCN3c3ncccn3)cc(C)nc2c1-c(cccc1)c1OC,0 F3406-6916,O=C(CN(CC1)CCC1c1nc(-c2cccs2)no1)NCc(cc1)ccc1F,1 Z4135998405,CCCN(C(CC1)=O)c(cc2)c1cc2NS(c(cc1)cc(F)c1Cl)(=O)=O,0 F5479-0291,Cn1c(cccc2)c2c(CC(NCCCN2N=CC=CC2=O)=O)c1,1 F6480-4947,Cc1c(C(N(CCC2)CC2Oc(nc2)ncc2Cl)=O)scn1,1 Z2437241607,C=CCN(Cc1ccccc1)S(N(CC1)CCC1C(O)=O)(=O)=O,0 Z2482842992,CC(C)(C(N)=O)N(C)C(c1ccc(-c2cc(C)ccc2)n1C)=O,0 F2514-0350,Cc1cccc(-n2ncc3c2N=CN(CC(NCc(cc2)cc4c2OCO4)=O)C3=O)c1C,1 F6445-6551,N#Cc1cccc(C(NCc(cccc2)c2-c2cscc2)=O)c1,0 F0685-0249,O=S(c1ccccc1)(NCCc1csc(-c2ccc(C(F)(F)F)cc2)n1)=O,0 V018-9395,CN(C(CN1CCC(N2CCCC2)=O)=C(C(c2c(C(F)(F)F)cccc2)N2)C1=O)C2=O,0 F6510-0971,Cc(cc1)c(C)cc1N(CC(C1)C(NCCN(c(cccc2)c2N2C)S2(=O)=O)=O)C1=O,1 Z2270819480,O=C(CC1C(C2)C2CC1)NC(CC1)Cc2c1[nH]cn2,1 Z1414575384,Cc1c(C)nc2n1CCN(CCF)C2,0 F5148-0073,O=C(C=C1)N(CCCNS(Cc2ccccc2)(=O)=O)N=C1c1ccccc1,1 F5854-3048,CC(C)S(c1ccc(CC(N(Cc2cccn2C)Cc2cccs2)=O)cc1)(=O)=O,0 Z3048354549,O=C(c1c(N2CCCCC2)nccc1)Nc1n[nH]c(cc2)c1cc2F,1 G867-0230,Cc(cc(cc1)S(N(CC2)CCN2c2ncnc3c2nnn3Cc2ccccc2)(=O)=O)c1OC,0 K261-2271,COc1cc(N(C(N(Cc(ccc(Br)c2)c2F)c2c3cccc2)=O)S3(=O)=O)cc(OC)c1,0 S691-1044,CCS(N1CC(Cc2ncc(C)n2Cc2ccccc2)CC1)(=O)=O,1 Z2581511528,CC(C)(C)CN(CC(O)=O)C(Cc1cc(O)ccc1)=O,0 F6753-2043,O=C(C(CC1)CCN1c1c(ccs2)c2ncn1)N(CC1)CCC1(F)F,1 F6443-8331,O=C(C(CCC1)N1c1nc(cccc2)c2o1)NCCCN1N=CC=CC1=O,1 Z2627895766,CC1(COCCC1)NC(c(cc1C)cc(C)c1OCC(O)=O)=O,0 D072-0111,Cc(cc1)ccc1-c1nc(S(c2ccccc2)(=O)=O)c(N2CCCCC2)o1,0 Z608830426,COc1cccc(OCC(N(CC2)CCC2N(c(cccc2)c2N2)C2=O)=O)c1,0 F6743-8108,CC(C)c1noc(CN(CCC2)CC2N(C)C(C(C)(C)C)=O)n1,0 SC70-0210,O=C(Cc(cccc1)c1F)N(C1)CC2(CCC2)C1c1n[nH]c(C2CC2)n1,1 Z4656798296,O=C(CN1CC(CC2)(CN2C(c(cc2)cc(N3)c2OC3=O)=O)CCC1)N1CCC1,1 F6672-1973,Cc1c(CCC(N(C(CC2)C3)C2CC3=CC2CC2)=O)scc1,1 F5836-0123,O=C(c1cccs1)Nc(cccc1)c1NC(c1c(C(F)(F)F)cccc1)=O,1 SA16-0840,Cc1noc(C)c1C(N(CC1)CCC1c1nnc(CC(N2CCCC2)=O)o1)=O,1 F260-0213,CS(Nc1nc(ccc(NC(C(CCC2)CN2S(N2CCCC2)(=O)=O)=O)c2)c2s1)(=O)=O,1 Z1833311591,O=C(C1(CC1)c(cccc1)c1Br)NCCN(CC1)CCS1(=O)=O,0 Z1478432163,Nc(c(S(N(CC1)CC1Oc1ncccc1)(=O)=O)c1)ncc1Br,1 F6216-0303,Cc1noc(CCCNC(NCCc2ccccc2)=O)c1,1 F3395-0613,COc(cccc1)c1N(CC1)CCN1C1CCN(Cc2cc(cccc3)c3o2)CC1,1 Z4876187348,CC(C)C[C@H](C(N1CCC(Cc2cc(C)c(C)cc2)CC1)=O)NC(C)=O,0 F6571-5873,CC(Cc1csc2c1cccc2)NS(c1c(C)onc1C)(=O)=O,1 SC11-1007,O=S(Cc1cc(F)ccc1)(N(CCCN1CCOCC1)C1CNCCC1)=O,0 F6436-0374,Cn1cnc(S(N(CCc2cccs2)C2CC2)(=O)=O)c1,1 F6785-7036,Cc1c(C)nc(cc2)n1nc2OCC(CC1)CCN1C(c(c(F)ccc1)c1F)=O,0 Z1176745294,OC1CC(CC2)N(CC(Nc3nc(-c(cc4)ccc4F)cs3)=O)C2C1,1 Z3071567866,N#CC1(CCOCC1)OCCS(NCC1CCCCCC1)(=O)=O,1 F6246-1486,O=C(CN1N=C(c2cccs2)N(C2CC2)C1=O)N(CC1)c2c1cccc2,1 F6451-2069,Cc1c(C(CNC(NCCOc2ccccc2)=O)OC)cccc1,0 F5033-3559,CCOC(NCC(CC1)CCN1C(Oc1ccccc1)=O)=O,0 SA67-0766,O=S(c1ccccc1)(N1CC(CCc2noc(C3CCOCC3)n2)CC1)=O,1 Z3799775212,CC(Nc1ccc(C(N(CC[C@@H]2CC3)[C@]23c2nnc(COC)o2)=O)s1)=O,0 F2490-0263,COc(cc1)ccc1Nc1nc(NCCc2ccccc2)nc(N2CCOCC2)n1,1 F5725-0117,CSc(cccc1)c1NC(Cn1c(-c2nccnc2)nc2c1cccc2)=O,1 Z2936915916,CC(C(O)=O)(c1ccccc1)NC(OC1CCC1)=O,1 F6524-2584,CC(C)NC(N(CC1)CC1c1noc(-c2ccco2)n1)=O,0 F6442-1958,CC(C)CS(C(C1)CN1C(NCc(cc1)ccc1OC)=O)(=O)=O,0 F3083-0089,CC(CC(Nc1cc(Cl)c(C)cc1)=O)n1nc(C)c(Br)c1C,0 Z3519740043,CS(C(Cc1ccccc1)C(N(CC1)CCC1(CCC1)C1N)=O)(=O)=O,0 F6445-0278,CCOC(N(CC1)CCN1C(c1cc(Oc2ncccc2)ccc1)=O)=O,1 F6089-9709,CCCS(N(CC1)Cc2c1ccc(NC(NC1CCOCC1)=O)c2)(=O)=O,1 Z3027218495,Oc(c(CNC1CC(C2CC2)OCC1)ccc1)c1F,1 Z1993784853,O=C(c1c(-c2ccccc2)nc(N2CCOCC2)s1)NCc1cnccc1,1 Z2716346522,O=C(C(C1)c(cccc2)c2C1=O)Nc(cccc1)c1N(CCN1)CC1=O,1 Z543912462,O=C(NCc(s1)ccc1Br)N1CCC1,0 F6514-7736,O=C(c(o1)ccc1Br)NCCn1nccn1,1 F5852-1631,O=C(C(NCc(ccc(F)c1)c1F)=O)NCc(cc1)cc2c1OCO2,1 F0854-0107,Cc(cc1)ccc1NC(Cn1nc(cccc2)c2n1)=O,1 F9995-0933,COc(ccc(CCC(O)=O)c1)c1Br,0 SB24-0157,CCC(CC)C(N(CC1)CCC1(CC1)C1n1nnc(C(N(CC)CC)=O)c1)=O,0 Z2994024438,CCc1nc(Cn2ncc(C(c3ccccc3)O)c2)no1,0 Z1845659160,CC(CNC(Nc(ccnc1)c1Br)=O)(C1CCCCC1)O,0 Z2112957139,COc1nccc(NC(N2CC(c(cc3)cc(Cl)c3Cl)OCC2)=O)c1,0 F3225-0055,O=S(c1cccc(Cl)c1)(Nc1nc2ccccc2nc1NCC1OCCC1)=O,1 SA57-0263,O=C(CCCc1c[nH]c2c1cccc2)N(CC1)CCC1(C1)OCCC1Oc1nccnc1,1 Z1085051936,CC(c1cn(C)nc1C)NC(N1C(Cc2ccccc2)CCC1)=O,0 Z1252146061,CCOC(C1)C(C)(C)C1N(C)C(c(cc1)ccc1C(N)=O)=O,0 F6524-6248,O=C(CCc1c[nH]c2c1cccc2)N(CC1)CCN1C(CC1)CCS1(=O)=O,1 Z2227549817,CCOC(C)(CC1)CCN1C(C1(Cc2ccccc2)CC1)=O,1 SD60-0077,CCc(cc1)ccc1-c1n[nH]c(C(N(C2)CC22OCC(CCOC)C2)=O)c1,1 Y042-1204,c1(n[nH]c2c1CCC2)C(N[C@H](c1n2c(nn1)cccc2)C)=O,1 F6550-4373,Cc1cc(C(N(C2)CC2Nc2ncccn2)=O)no1,1 Z1646477487,Cc1ncc(C(CC2)CCN2c2nn3c(-c4ccccc4)nnc3cc2)cc1,1 S654-0122,CCn1nccc1C(N1CCC(C2)(CN(C)C2c2nc(C)no2)CC1)=O,1 F3215-0159,COc1ccc(Cc2nnc3sc(-c4cnccc4)nn23)cc1,1 Z1726197137,CN(CC(CC1)CCC1NC(C1(CCC1)O)=O)C(C1(CCC1)O)=O,1 Z1430528264,CCNC(N(CC1)CCN1c1cc(C(F)(F)F)nc2ncnn12)=O,0 F8887-2783,OC(C(C1)C=CC1NC(OCC1c(cccc2)c2-c2c1cccc2)=O)=O,1 C256-0593,CCC(N(CCc1c2)c1cc(S(N(CC1)CCC1C(N(CC)CC)=O)(=O)=O)c2Br)=O,1 Z2126690650,CC(C)(C1)OC2(COCC2)CN1C(c1ccnc(-c(cc2)ccc2Cl)n1)=O,0 F6525-5039,Cc(n(CCNS(c1c(C)onc1C)(=O)=O)nc1C)c1-c1ccccc1,1 Z2295859646,OC(Cc1cccc(C(Nc(cc2)cc3c2[nH]c(C2CCC2)n3)=O)c1)=O,0 Z1824569979,CC(c1n[nH]cn1)NC(C1(CCC1)c1c(C)cccc1)=O,0 Z1743246172,CCc(cccc1)c1S(N1c2ncnn2CCC1)(=O)=O,0 Z3686735482,CCN(C(C(C(CC1)C2CC2)N1C(c1cc(occ2)c2[nH]1)=O)=NN1)C1=O,1 F6676-2820,CN(C1CCN(Cc2ncccc2)CC1)c1ncccc1,0 Z2977604960,CN(C[C@@H]1CNC(N2Cc3cncn3CC2)=O)C[C@@H]1c1ccccc1,1 F6713-5752,Cc1c(C)ncnc1N(CC1)CCN1c1ncnc2c1nc[nH]2,0 SB52-0355,CC1(CC1)C(N1CCC(C2)(CN(C)C2c2noc(-c3ccccc3)n2)CC1)=O,1 F6619-7081,Cc1cc(C)nn1-c1cc(N2CCN(Cc3c(CCC4)c4nn3C)CC2)ncn1,1 F1897-0214,Cc1csc2nc(-c3cccc(NC(c(cccc4)c4Cl)=O)c3)cn12,1 F1565-0183,CN(C(c1c2c3ccc(C(c4ccccc4)=O)c2ccc1)=O)C3=O,1 Z1130349642,CC(C)(C1)N(Cc2ccccc2)CCN1S(c1cn(C)nc1)(=O)=O,0 E975-1193,CN(c(ccc(S(CCC(N(CC1)CCN1c(cccc1)c1F)=O)(=O)=O)c1)c1O1)C1=O,0 F6414-2174,CCOc1c(C(NCC(c(cc2)ccc2SC)O)=O)c2ccccc2cc1,0 S720-2568,CNC([C@H](C[C@@H](C1)Oc2ccccc2)N1C(CC1)CCN1S(c1cn(C)cn1)(=O)=O)=O,1 Z3367704058,Clc(cc1)cc(Cl)c1-c1noc(C2(COCC3)C3OCC2)n1,1 F6286-0606,Cc1noc(C)c1S(NCCc1nc(C(F)(F)F)cc(C2CC2)n1)(=O)=O,1 Z3389469212,Cc1c(C(N(C[C@@H]2[C@H]3C2)[C@@H]3C(O)=O)=O)sc2nc(C(F)(F)F)ccc12,1 Z2897784184,Cc1cc(C)c(CNCc2c(C(O)=O)occ2)c(C)c1,0 F6454-0484,O=C(NCC(CC1)CCN1c1cnccc1)Nc(cccc1)c1F,0 F6515-2667,O=S(Cc1noc2c1cccc2)(N1C(Cn2nccn2)CCC1)=O,1 F6792-0224,Cc(c(N1CCN(Cc2csc(C3CC3)n2)CC1)n1)c(C)nc1SC,1 SA95-0277,Cc1cnc(C(CCC2)N2C(NC2CCCC2)=O)n1Cc(cc1)ccc1OC,1 F6478-4296,Cc1cc(OC(CC2)CN2C(c(s2)ccc2Cl)=O)nc(C)n1,1 F6497-0710,CC(C(N1CC(Cc2nc(C3CC3)no2)CCC1)=O)n1nccc1,1 Z1218480069,CC(CC(NC(CC1)CCS1(=O)=O)=O)c1c(C)cccc1,0 S963-2749,CNC([C@@H](CN(Cc1ccccc1)C1)[C@H]1NC(c1nnccc1)=O)=O,1 F6473-1500,CC(C)n1cnc(S(N(CC2)CCC2N(CC2)Cc3c2scc3)(=O)=O)c1,1 Z1482987359,Cc1c(C)sc(C(NCC2(CO)COC2)=O)c1,0 D117-0002,CCOc1ccc(C(C(C)C)(C(CN2CCOCC2)c2ccccc2)O)cc1,0 F1403-0024,CC(C)(C1)CC(OC(CC(C)(C)C2)=C(C3c4ccc(C)o4)C2=O)=C3C1=O,1 F6681-3638,N#Cc(nccc1)c1N1CC(COc2cnccc2)C1,1 Z1738499461,Cc1c(C(O)=O)sc(CCNS(c2cc(F)cc(C)c2)(=O)=O)n1,0 F6806-6793,O=C(C(C1)OCCN1c1nc(ccc(F)c2)c2o1)N(CC1)CCC1(F)F,1 Z2622350809,Cc1cc(NC(C(CCN2)C2=O)=O)ncc1,0 F6442-2658,CN(C=CC=C1C(N(C2)CC2S(c(cc2)ccc2Cl)(=O)=O)=O)C1=O,1 V003-3412,CC(C(N(Cc(ccc(OC)c1)c1OC)C1)=O)Oc(cc2)c1cc2NS(c1cccc(Cl)c1)(=O)=O,0 L303-0892,O=C(C(CC1)CCN1S(c(cc1)ccc1-c1noc(C2CC2)n1)(=O)=O)NC1CC1,1 S700-0345,N#Cc(cc1)ccc1C(N(C1)CC1c1nc(CCOCC2CCCC2)no1)=O,1 F2318-0124,Cc(cc1)nn1-c(cc1)nnc1N(CC1)CCN1C(c(c(F)ccc1)c1Cl)=O,0 F5831-8940,O=C(c1nc2ccccc2nc1)NCCN(CC1)CCN1c(cccc1)c1F,1 F3168-1726,O=C1N2N=C(c3ccccc3)SC2=Nc2c1cccc2,1 F6515-0795,O=C(Cc1c[nH]c2c1cccc2)NCc1cc(-c2cccs2)ncc1,1 S923-0495,CS(N(CCCC1)C1c1nnc(CC2)n1CCN2C(c1cccs1)=O)(=O)=O,0 F1834-0047,CCOC(N1CCN(CC(Nc(cc2C)nc(-c(cccc3)c3O3)c2C3=O)=O)CC1)=O,1 Z1584590753,CC(C)c1cc(C(NCCC(CC2)CCN2c2ccncc2)=O)nn1-c1ccccc1,1 F6200-2437,OC(CNC(NCc1cccs1)=O)c1ccc(C(F)(F)F)cc1,0 F6726-4819,Cc1ncnc(N(CC2)CCN2C(Cc2cnccc2)=O)c1F,1 T408-1124,O=C(C(CC1)Cc2c1sc(C(N1CCCCCC1)=O)c2)Nc(cc1)cc2c1OCCO2,1 Z2915518420,NS(NC(C1)CN1C(c1cccn1Cc1ccccc1)=O)(=O)=O,1 F6666-9785,CSc1ncccc1C(Nc(cccc1F)c1F)=O,0 F2371-0148,O=C(CC(CNS(c1cc(C(F)(F)F)ccc1)(=O)=O)C1)N1c(cc1)ccc1F,0 F6806-4785,Cc1nn2c(N(CC3)CCN3c3nc(-c4cn(C)nc4)cnc3)cc(C)nc2c1,1 Z3307798201,CC(C(Nc1c2c(CCC3)c3s1)=O)N=C2c1ccncc1,0 Z425372990,CCOC(c1cc(c(OCC)ccc2)c2[nH]1)=O,0 F6604-9644,Cc1cc(ncnc2N3CC(CN(C(C=C4)=O)N=C4c4cnccc4)C3)c2[nH]1,1 F0919-4951,O=S(c1cccc2cccnc12)(N(CC1)CCN1C(c1ccccc1)c1ccccc1)=O,1 F6724-5083,CC(Cc(cc1)cc2c1OCC2)Nc(nc1)ncc1Br,0 G418-0330,O=C(NC(c1nnc(-c2ccccc2)o1)c1ccccc1)Nc(cc1)cc2c1OCCO2,0 Z1669424585,O=C(c1cnc2[nH]nnc2c1)N1C(CCCc2ccccc2)CCC1,1 F6553-1033,O=C(C1COCC1)N(CC1)CC1c(cc1)cc2c1OCC2,1 F6560-8731,O=C(COc(ccc(Cl)c1)c1Cl)N(C(CC1)C2)C1CC2=C1CC1,1 F976-0176,O=C(C=C1)N(c(cc2)ccc2F)N=C1N(CCC1)CCN1S(c(cc1)cc(F)c1F)(=O)=O,0 Z2143255651,CC(C(C)=NN1C)=C(C(N2COCCC2)=O)C1=O,1 Z1522897822,CC(C)n1nccc1C(NC(C)c1c[nH]nc1)=O,0 Z183858418,C[C@@H](C(NC)=O)NC(C1(CC(C2)C3)CC3CC2C1)=O,0 6062-0048,CC(C)CNC(C(CC1=O)CN1c(cc1)ccc1OCC(Nc(cc1)ccc1OC)=O)=O,0 Z2351323979,OC(C(C1)C1(CC1)CCN1S(c(cc(cc1)F)c1Cl)(=O)=O)=O,0 Z2656433096,CC(c1ncc(C(O)=O)s1)NC(c1c(C)n(C)nc1C)=O,0 F6497-1244,CCN(CCN(C(N1CC(Cc2nc(-c3c(C)cccc3)no2)CCC1)=O)C1=O)C1=O,1 SC58-0196,Cc1cnc(C2C(C3)(CN3C(c3cscc3)=O)CN(C)C2)o1,1 F6436-1540,COCCNC(Cc(cc1)ccc1NC(CCc(cccc1)c1F)=O)=O,0 Z1823889800,CC(COC)Oc(ccc(Cl)c1)c1S(NC(c1nc(C)ccc1)=O)(=O)=O,0 F6753-2722,O=C(C(CCC1)CN1c1ncc(cc(cc2)Br)c2n1)N1CCOCC1,1 E646-2713,CC(C)CCNC(C(C)(CN(C1)S(c2ccccc2)(=O)=O)N(CCc2cccs2)C1=O)=O,0 F1105-0112,CN(C(c1cccc(NC(C2Oc(cccc3)c3OC2)=O)c11)=O)C1=O,1 E646-0407,CC(CN(CC1=O)S(C)(=O)=O)(C(NC2CCCCCC2)=O)N1c(cc1)c(C)cc1Cl,0 Z1652543376,Cc1nccc(NCC2(CO)CCC2)n1,0 F2085-0042,O=C1NC(SCc(ccc(Cl)c2)c2Cl)=Nc2c1cnn2-c1ccccc1,0 D718-1317,O=C1N(C2CCCCCC2)C=Cc2c1cnc1nc(-c3ccncc3)nn12,1 Z1184083550,Cn1ncc(-c2ncc(C(NC(CC3)CCC3C(N)=O)=O)s2)c1,0 F6808-5850,Cc1c(C)ncnc1N(CC1)CCC1(c1ccccc1)C#N,0 G867-0232,COc(cc1)cc(S(N(CC2)CCN2c2ncnc3c2nnn3Cc2ccccc2)(=O)=O)c1OC,0 Z558221418,O=C(NCC1COCC1)N(CC1)CCN1c1c(ccs2)c2ncn1,1 Z2094739204,CCc1cc2c(N(CCC3)C3c3nc(C)no3)ncnc2s1,0 Z1883253394,CC(C)(C)C(C1)c(cccc2)c2N1C(c(cc1)ccc1N(CCC1)S1(=O)=O)=O,1 F6670-6645,Cc1noc(CN2CCC(CN(C(C)=Nc3c4ccc(F)c3)C4=O)CC2)c1,1 S570-0275,CN1C2=CCCCC2(CNC(c(cc2)ccc2F)=O)CCC1=O,0 Z4789005237,CC(CCNC(c1cccc2cc(O)ccc12)=O)(C1CCCCC1)O,1 Z1888626069,CC(c1nc(cccc2)c2[nH]1)NC(c1c(Cc2ccccc2)n(C)nc1)=O,0 Z1157853630,CC(C)(C)c1ccc(C(C)(C(N2Cc3noc4c3CCCC4)=O)NC2=O)cc1,1 Z3482423441,O=C(NC1)Nc2c1ccc(-c1ccncc1)c2,1 G346-0403,CCN(CC)C(C1CCC(CN(C(c(scc2)c2N2Cc(cc3)ccc3Cl)=O)C2=O)CC1)=O,0 Z2414596897,Cc1c(CN(C)C(NC2C3(CC3)C2)=O)occ1,1 F0550-0202,CCOC(N(CC1)CCN1C(C1=CN=C2SCCN2C1=O)=O)=O,1 F6481-4390,O=C(COCc1ccccc1)N(CC1)CCSC1c1cccs1,1 Z2755717268,Cc1cccc(C(CC(O)=O)NC(C(C2)c3c2cccc3)=O)c1,0 Z2965107878,CO[C@@H](CCOC1)[C@H]1NC(c1n[nH]c2c1CCC2)=O,1 Z2256352175,CC(C)C(C)(CC(O)=O)NC(c(cc(C)c(C)c1)c1Cl)=O,0 Z2143315365,Cc1nc(CC(CC2)NC(CC3=CCCCC3)=O)c2n1CCO,1 F6416-9293,CC(C)n1nc(C)c(S(NCCC(c2cccc(Cl)c2)O)(=O)=O)c1C,0 Z2982755433,O=C1NCCN(Cc2cn([C@H](CC3)c(cc4)c3cc4Cl)nn2)C1,1 SA58-0239,O=S(Cc1ccccc1)(N1C(CCc2noc(-c3cnccc3)n2)CCC1)=O,1 Y207-5527,CC(C)Oc1ccc(C(C2)CC(NC(CC3c(cccc4OC)c4OC)=O)=C3C2=O)cc1,0 SA31-1562,CC(C)c1nnc(COC2)n1C2(C)C(NCCCN(CC1)Cc2c1cccc2)=O,1 M026-1438,Cc1noc(/C=C\c(cc2)ccc2S(N(CC2)CCN2c2ncccn2)(=O)=O)c1NC(C1CC1)=O,1 F6360-9629,COC(c(cc1)ccc1S(N(C1)CC1Oc1cnccc1)(=O)=O)=O,0 F6526-0130,Cn(cc1C(N2Cc3cc(C4CC4)nn3CC2)=O)nc1OC,1 F6245-4040,CCN(C(C(CC1)CCN1C(c1nc(cccc2)c2s1)=O)=NN1CCOC)C1=O,1 Z1255939373,Cc1nn(C)cc1NC(CCn1c(C(N(C)C(N2C)=O)=O)c2nc1)=O,1 F3382-3069,Cc(cc1)ccc1-c1c(NC(CSc2ccccc2)=O)onc1,1 F5001-0653,Cc1cccc(NC(Cc2noc(-c(cc3)ccc3F)c2)=O)n1,0 F6194-1137,CC(Cc1cscc1)(CNC(c(ccc(Cl)c1)c1Cl)=O)O,0 Z1634930015,OC(C1(CC1)C(Nc1cc(Oc2ncccn2)ccc1)=O)=O,1 Z110140132,CN(Cc(cc(cc1)Cl)c1OC)C(Cn1nnc2c1cccc2)=O,0 SA02-0174,Cc1ncc(COC)c(C(CC2)CCN2C(CCc2cc(N3CCOCC3)ncc2)=O)n1,0 Z2367991593,CC(C)(C(N1[C@@H](Cc2c3cccc2)[C@@H]3OC)=O)NC1=O,0 V019-5415,COc(cc1)ccc1C(N(CC1OCCC1)Cc1noc(-c(cc(cc2)OC)c2OC)c1)=O,1 T955-0198,O=S(c1cccs1)(N(CCC1)CC1c1nc(CCOCc2ccccc2)no1)=O,1 S698-0584,Cc1cnc(C2CCOCC2)n1C(CC1)CCN1S(c(cc1)ccc1C#N)(=O)=O,1 F6446-1303,O=C(c(cc1)ccc1-n1cccc1)NCC(CCC1)CN1c1nccs1,1 L942-0070,CCC(C)NC(CCN(c(n1-c2c3cccc2)nnc1SCc1c(C)cccc1)C3=O)=O,1 Z4410120875,CCc1nccn1S(c(c(OC)c1)cc(OC)c1Br)(=O)=O,0 SB91-1258,CN(C)C(N(CCN1CCCCC1)C(CC1)CN1C(NCc1ccccc1)=O)=O,1 6016-3215,CC(C)NC(CCN1N=C(c(cc2)ccc2Cl)c(cccc2)c2C1=O)=O,0 F5086-0695,CC(C)n1nccc1C(Nc1nc(-c(cc2)cc(OC)c2OC)cs1)=O,0 F6445-6180,COc(ccc(CCC(N(CC1)Cc2c1ncnc2)=O)c1OC)c1OC,0 S693-2165,Cc1cnc(COC)n1CC(CCC1)CN1S(c1c(C)onc1C)(=O)=O,1 Y042-6504,CC(N1CCCC(Nc(cc2)cc3c2[nH]c(C2OCCC2)n3)=O)=CC(O)=CC1=O,1 F6356-0595,CC(Cc1cocc1)NC(Cc(cccc1)c1Cl)=O,0 Z1851757807,NC(c1ccc(CC(NCc2nnc(C3CC3)n2C2CC2)=O)cc1)=O,1 F5865-0332,Cc(cc1)nnc1N(CC1)CCN1C(c1ncccn1)=O,1 S692-1043,CCn1ncc(CN(CCC2)CC2n2c(-c3cccnc3)ncc2C)c1C,1 J038-2866,CCc(cc1)cc([C@H]2OCC[C@@H]22)c1NC2c(cc1)ccc1C(O)=O,0 Z1837783348,O=C(C(C1)(C2)CC12c1ccccc1)NCc1cnccc1,1 F6475-3302,O=C(c(cc1)cnc1OC1CCOCC1)N1CCN(CCc2ccccc2)CC1,1 F532-0192,CCCNC(Nc(cc1)ccc1-c1noc(-c(cc2)ccc2C#N)n1)=O,0 V004-7225,CN(C(CN1CC(N(CC2)CCN2c(cccc2)c2OC)=O)=C(C(c(cccc2OC)c2OC)N2)C1=O)C2=O,0 Z4873984211,Cc(nc1C(CC2)CN2c2ccccc2)nn1-c1cc(C)ccc1,1 F6262-2727,O=C(Cc(cc1)ccc1Br)Nc1ncnc(OCc(cc2)cc3c2OCO3)c1,1 Z1636687936,CCC(C)(CCC1)CN1C(NCCN(CCN1)CC1=O)=O,1 F6357-0567,O=C(c(c(F)ccc1)c1F)NCC1(CCCC1)c1cscc1,0 Z1274967755,O=C(c1cccnc1Oc1cccc(Br)c1)NCCC1CC1,1 G824-0095,Cc1cccc(C2(CC(c(cccc3)c3Br)=O)O)c1NC2=O,0 Z1455277839,CC(C)C[C@H](C(O)=O)NC(CNC(CCC1CCCC1)=O)=O,0 L470-0509,O=C(Cc1c[nH]c2c1cccc2)NCc(s1)ccc1S(N1CCOCC1)(=O)=O,1 Z5027903487,NC(NC1=NC(CN2Cc(cc(cc3)Cl)c3OCC2)=C2)=NN1C2=O,0 S694-0595,Cc1cnc(C2CCOCC2)n1C(CC1)CN1C(Cc1c(C)onc1C)=O,1 F6678-8156,CCc1ncnc(N(C2)CC2n2c(cccc3)c3nc2)c1F,0 F6529-3534,O=C(c1cc(-c2ccccc2)n[nH]1)N(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O,1 Z1591646780,CC(CC1)(CCN1C(c1nc(C(N2CCCC2)=O)ccc1)=O)OC,1 7472-0176,Cc1nc(N(CC2)CCN2C(CSc2nc3ccccc3nc2N2CCOCC2)=O)nc(C)c1,1 Z2996673597,OC(c1c2OCCN(CC(N3CCCCC3)=O)Cc2ccc1)=O,1 Z2958881499,CC(C)[C@H](CC(O)=O)NC(c1cc(c(C)nn2C)c2s1)=O,0 F2068-0623,COc(cccc1)c1N(CC1)CCN1S(CCNC(c1cccs1)=O)(=O)=O,1 Z3041609974,CN(C(CC1)(CCN1C(C1(CC1)c(cc1)ccc1Br)=O)OC1)C1=O,1 F6240-7263,Cc1noc(-c2cncnc2NCc(cc2)cc(Cl)c2F)n1,0 Z2216906385,O=C(c1csc(-c2cnccc2)n1)Nc(cccc1)c1OC(F)F,0 V006-9185,CN(CC1)CCN1C(c1ccc(CN2c(cc(cc3)C(COc(cc4)ccc4F)=O)c3OCC2=O)o1)=O,0 F510-0538,CCN(CC)C(c(cc1)cc(N2CC(NCCC3=CCCCC3)=O)c1SCC2=O)=O,1 SD62-0131,Cc1noc(C)c1C(N1CC2(CCC2)C(CCC(N2CCOCC2)=O)C1)=O,1 Z2950062127,COc1cc(C(NCC(N(CCC2)c3c2cccc3)=O)=O)ncn1,1 E203-0530,Cn1c(C(N2c3nc(cccc4)c4n3CC2)=O)cc(S(N2CCOCC2)(=O)=O)c1,1 F6230-0321,O=C(NCc1c(cccc2)n2nc1)Nc1c(C(F)(F)F)cccc1,0 Z3207835559,C[C@@H](CC[C@@H]1C)CN1C(c1c(C)c2c(N)nc(C)nc2s1)=O,1 P859-1304,Cc1c(C(Nc(cc2)ccc2OC(F)(F)F)=O)nc(C)n1C(CC1)CCN1C(NC)=O,1 Z728897746,OC(C(C1CCCCC1)NC(OCc1ccccc1)=O)=O,1 Z1502785273,Cn(cc12)nc2ncnc1NCc(cc1)cc(F)c1Oc(cccc1)c1F,1 F3277-0298,Cc(sc1ncn2)cc1c2SCC(N(CCC1)c2c1cccc2)=O,1 G229-0065,COc(cc1)ccc1-c1noc(C(CC2=O)CN2c(cc2)ccc2Cl)n1,0 Z3063545560,CN(C1CC1)C(c(cnn1c(C(F)F)c2)c1nc2-c1ccccc1)=O,0 Z4438426354,O=C(CN(C=Nc1c2c(-c3cccs3)cs1)C2=O)Nc1cnncc1,1 Z2201820552,Cn1ncc(Br)c1CNC[C@H](c(cc1)ccc1Cl)O,0 Z3907201194,Cc1nccn1-c1nc2ccccc2c(C(NCC(CC2)C22OCCC2)=O)c1,1 T990-2728,CN(CCC1N(CC2)CCN2S(c(cc2)ccc2F)(=O)=O)C1=O,0 S926-2306,Cn1cnc(S(N(CCC2)CC2OCc2noc(COC)n2)(=O)=O)c1,0 Z2414657020,CN(C(CCC1NC(N(CC2)CCN2c(cc2)ccc2F)=O)=O)C1=O,1 Z2656482220,O=C(CCC1CNCCC1)Nc1ncc(Cc(cc2)ccc2F)s1,1 Z2618382781,CCN(c(ccc(C(N(C)Cc1ccc(C)o1)=O)c1)c1N1)C1=O,0 F5001-0272,Cc(cc1)ccc1-c1cc(CC(Nc(cccc2)c2-c2ccccc2)=O)no1,1 E910-0026,O=C(CCN(C=Nc1c2c(-c(cc3)ccc3F)no1)C2=O)Nc(cc1)cc2c1OCCO2,1 F6573-8570,O=C(c(ccnc1)c1F)N(CCN1c(nc2)ncc2F)CC1=O,1 F2269-0150,CCN(c(cccc1)c1Oc(cc1)c2cc1NC(c1cccs1)=O)C2=O,1 SA69-0265,CC(CCC1)(CN1C(c1c(C)n(CCOC)c(C)c1)=O)c1noc(C2CCOCC2)n1,1 F6561-3175,O=C(c1noc(-c2cnccc2)c1)N(CC1)CCC1=C1CCC1,1 Z218-0109,CCn(c(-c1n[nH]c(NC(C2Oc(cccc3)c3OC2)=O)c1)c1)c2c1cccc2,1 F6560-1364,Cc1nc2ncnn2c(OC(C2)CN2C(c2ncc(C)nc2)=O)c1,1 D512-0093,Cc(cc1)c(C)cc1N([C@@H](CS(C1)(=O)=O)[C@@H]1N(CCc(cc(cc1)OC)c1OC)C1)C1=O,0 Z2962686665,CC(Cc(s1)ccc1Cl)(CCC1)N1C(CNC(NC)=O)=O,0 F6221-0166,Cc1nccn1-c(nc1)ncc1NC(Cn1c(cccc2)c2nc1)=O,1 Z1727488228,CCOc(cc1)cc2c1OCCC2NC(NC(CC1)CCN1c1nc(C)nc(C)c1)=O,0 F6503-2572,Cc1nn(ccn2CCNC(Cc3c(C)onc3C)=O)c2c1,1 Z1796527256,CC(C(N[C@H]1CC[C@H](C)CC1)=O)C(O)=O,0 SA24-0210,Cc1c(COc2ccccc2)c(C(N(C2)CC2N(C2)[C@H](COC)CC2(F)F)=O)no1,1 F1800-0052,O=C(CN(C(CSC1)=O)C1=O)Nc(cc1)cc(Cl)c1Cl,0 F6125-2876,COc1cc(CNC(C(C2)CN2S(C)(=O)=O)=O)cc(OC)c1OC,0 Z1451981455,O=C(Nc(cc1)nn1-c1c(C(F)(F)F)cccn1)N(CCC1)C1C1CC1,1 F6541-3887,CN(CCC1N(CC2)CCN2c(cccc2)c2F)C1=O,0 D294-5053,CCOCCc1nnc(NC(C(C2)CN(CCc3c[nH]c(cc4)c3cc4Cl)C2=O)=O)s1,0 Y040-4038,Cc(c1c2)c(C)oc1c(C)c(O1)c2C(C)=C(CC(N(CC2)CCC2C(O)=O)=O)C1=O,0 F5496-1660,Cc1nnc(C2CCN(Cc3cc(C(F)(F)F)ccc3)CC2)s1,0 Z3071558959,OC(C1)(CN1S(c1cn(C2CCCC2)nc1)(=O)=O)C(F)(F)F,1 L775-0864,Cn1nc(COc(cc2)ccc2F)c(C2)c1CCN2C(Nc(cc1)ccc1F)=O,0 Z1445210708,Cc(ccc(C(N(C)CC(N(CC1)CCC1C(O)=O)=O)=O)c1)c1F,0 SA67-0641,Cc1cc(C(N2CC(CCc3noc(C4CC4)n3)CC2)=O)nn1C,1 Z3184064198,COC(c(scc1)c1C(Nc(cc1)ccc1N1CCCCC1)=O)=O,1 F820-0518,CCc1nc(CN(c(ccc(S(N2CCC(Cc3ccccc3)CC2)(=O)=O)c2)c2O2)C2=O)no1,1 F5094-1964,CCOC(c(oc1c2cccc1)c2NC(c1nn(C)cc1C)=O)=O,1 Z2701301989,Cc1nnc(NC(CC2)CN2c(ccc(Cl)c2)c2F)o1,0 F6594-2817,O=C1N(CC(CC2)CCN2c2nccc(C(F)(F)F)n2)N=C(CCC2)C2=C1,1 S903-0301,CN(C)C(N(CC1)CCC1c1nnc(C2)n1CCN2S(c(cc1)ccc1OC)(=O)=O)=O,0 S724-0084,CN(C)C(c1cn(C(C2)CN2C(c2nn(C)c3c2cccc3)=O)nn1)=O,1 SA92-0646,O=C(Nc(cc1)cc2c1OCCO2)N(CCC1)CC1(c1nc(-c2cnccc2)no1)F,1 F6818-0175,Cc1cncnc1N1CCN(CC(N(CC2)CCN2c2ccccc2)=O)CC1,0 D038-0597,CCc(cc1)cc2c1occ2CC(N(Cc1ccc(C(C)C)cc1)C(CC1)CS1(=O)=O)=O,0 F6660-5281,O=C(c1cccs1)NCc1cn(Cc2cc(C(F)(F)F)ccc2)nn1,1 Z1699266672,CC(C)c1ccnc(N(CC2)CCN2c2ncnc(C)c2)n1,0 Z2059845460,CN(C=Cc(cc1)c2cc1NC(N1C(CCC3)C3CC1)=O)C2=O,1 Z1315135696,Cc1ccc(C(COCC2)N2C(c2nccn3c2ncc3)=O)o1,1 F6523-3787,CCSc(cccc1)c1C(N(CC1)CC2=C1N=C(C=CC(Cl)=C1)N1C2=O)=O,0 Z2482930903,OC(COCCN(CCC1)CCN1S(c1ccccc1)(=O)=O)=O,0 Z2958283192,Cc1nc(CN(C)C(c2cc(Br)cc(OC)c2)=O)no1,0 F6798-4375,COCCn1c(ncnc2N3CC(CN(C4)C(c(nccc5)c5F)=O)C4C3)c2nc1,1 D412-0556,O=C1n2nc(NCc3cccs3)nc2NC(CN(CC2)CCN2c2cc(C(F)(F)F)ccc2)=C1,0 Y044-4812,COCCn1c2cccc(OCC(N3Cc4nnc(C(F)(F)F)n4CC3)=O)c2cc1,1 F5857-6570,CS(N(CC1)CCC1C(NCC1(C=CCCC1)O)=O)(=O)=O,1 Z1603737101,OC(C(c(cc1)cc(F)c1Cl)NC(C1OCCCC1)=O)=O,1 F6791-9208,CCc1nnc(C(CC2)CCN2c2nc(C)ns2)s1,1 F3222-3427,COc1c(CN2C(SCc3nc(-c4cccs4)no3)=Nc(cccc3)c3C2=O)cccc1,1 Z1611147565,C(C1CC1)c1nnc(NCc2csc(C3CC3)n2)o1,1 F3366-5755,CC(CNc(cccc1)c1N1Cc(c(Cl)ccc2)c2Cl)C1=O,0 S693-0323,Cc1cnc(C2CCOCC2)n1CC(CCC1)CN1C(C1CCCC1)=O,1 F2605-0280,O=C(c(cccc1)c1Br)NCCSc1ncc(-c(cc2)ccc2Cl)[nH]1,0 F3406-1465,COc(ccc(Cl)c12)c2NC(CCN(CC(NCc(cc2)ccc2SC)=O)C2)=C2C1=O,1 F6554-8446,O=C(CCc1cccc(Cl)c1)N1C(C2)CSC2C1,1 F6516-0578,O=C(CN(C(CC1)=O)C1=O)NCc1ccc(-c2ccco2)o1,1 Z1765208374,CC[C@@H](CO)NCc(cc(cc1)F)c1Br,0 Z2581511259,CC(C)(C)CN(CC(O)=O)C(c1cnc(C)cc1)=O,0 F6806-6819,O=C(CN1CC(C(N(CC2)CCC2(F)F)=O)OCC1)N(CCC1)c2c1cccc2,1 Z1428038793,Cn(cc1NC(c2csc(-c3cccs3)n2)=O)nc1-c1ncccc1,0 F6471-5201,O=C(c(cc1)ccc1-c1cccs1)N(CC1)CC1n1nncc1,1 S296-4846,CCC(c1cccs1)N(C([C@H](C1)[C@@H]2CN1S(c1c(C)ccc(C)c1)(=O)=O)=O)C2=O,0 Z1954912781,CC(C)c(nc1)ncc1NC(C(CC1)CCC1NC(CC1CCCC1)=O)=O,1 F5896-0125,O=C(c(c(F)ccc1)c1Cl)Nc1cccc2ccc(-n3cccc3)nc12,0 Z1070605850,NC(c1ccc(CN2CC(c3cccc(F)c3)OCC2)cc1)=O,0 Z2617417746,OCC(CC1)(CCN1C(NCc(cc(C1CC1)cc1)c1F)=O)O,0 Z2949798476,CCS(N1C[C@@H](C)N(Cc2cnc(-c3ccccc3)o2)CC1)(=O)=O,0 F6524-5938,Cn(c(C(NCCN(C=Nc1c2ccs1)C2=O)=O)c1)nc1-c(cc1)ccc1F,1 D754-0082,O=C(CCn(cc1)c2c1ccc(Cl)c2)NC[C@@H](CN(Cc1c2cccc1)C2=O)c1ccccc1,0 F793-0209,COc(cc1)cc(OC)c1NC(N(CCC1)C1c1nnc(C(Nc(cc2)ccc2Cl)=O)s1)=O,0 Y020-3933,COc(cc1)ccc1N(C(CC1N(CC2)Cc3c2c(cc(cc2)Cl)c2[nH]3)=O)C1=O,0 F6442-0816,Cc1c(C(N(C2)CC2S(c(cc2)ccc2OC)(=O)=O)=O)sc(C)n1,1 E977-0751,CC(C)c(cc1)ccc1NC(C(CCC1)CN1S(c(cc1)cc(CCC2)c1NC2=O)(=O)=O)=O,0 Y020-5693,COc1cccc(N(CC2)CCN2C(CC(N2c3cccc(C(F)(F)F)c3)=O)C2=O)c1,0 Z1462817630,CC(C)N(Cc(cc1)ccc1NCc(c(F)ccc1)c1F)C(C)=O,0 Z1827222946,CC[C@H](C)[C@@H](C(O)=O)NC(c1nn(C)cc1)=O,0 F5584-0189,O=C(Nc1cccs1)N1CCN(Cc2nc(-c3ccco3)cs2)CC1,1 Z4359358205,CC1(CC1)C(N(CC1(C(F)(F)F)O)c2c1cccn2)=O,1 Z45631075,Cc1cccc(NS(c(cc(cc2)Br)c2OC)(=O)=O)c1C,0 Z1385366486,O=S(Cc(cc1)ccc1F)(c1nnc[nH]1)=O,0 F6680-8909,Cc1c(CN2CC(COc3cc(C)ncc3)CCC2)cno1,1 Z1204319773,CC(C(NC(CCCN1c2ccccc2)C1=O)=O)N(C(C1(CCCC1)N1)=O)C1=O,1 S696-0111,Cc1cnc(-c2ccccc2)n1CC(C1)CN1C(C1(CC1)c(cc1)ccc1OC)=O,1 Z1509524562,COC(c1cc2cccc(O)c2nc1)=O,0 Z1928175936,O=C(CCOc1cccc(Br)c1)NCCC(NO1)=NC1=O,0 F6473-2272,O=C(c1c[nH]c2c1cccc2)N(C1)CC1n1nncc1,1 F255-0520,Cc(cc1)cc2c1[nH]c(CCc(cc1)ccc1NC(C1CCC1)=O)n2,0 F5857-1094,Cn1c(C(CNC(C(Nc(cc2)ccc2OC(F)(F)F)=O)=O)O)ccc1,0 SB52-0302,CC(C)n1ncc(CN2CCC(C3)(CN(C)C3c3noc(-c4ccccc4)n3)CC2)c1,0 F6502-9127,CCOc(nccc1)c1C(NCCc1nn(C)c(C)c1)=O,0 F6563-0154,CC(Nc(cc1)ccc1C(N(CC1)CCC1Oc1cscc1)=O)=O,0 C732-1389,Cc1noc(/C=C/c2cccs2)c1S(N(CCC1)CC1C(N1CCOCC1)=O)(=O)=O,1 Z4914935778,Cc(cc(C)s1)c1S(NCC(c1cccc2ccccc12)O)(=O)=O,0 F3286-0050,OC(C(N(C1c(cc2)ccc2F)c2nccs2)=O)=C1C(c(cc1)ccc1Cl)=O,1 Z2482923659,CC(C(NCc(cc1)ccc1C(O)=O)=O)N1Cc(cccc2)c2OCC1,0 F6476-6104,O=C(c1cc(cccc2)c2s1)N(CC1)CC1Oc(ccnc1)c1Cl,1 Z1160844484,Cc1c(CN(C)Cc2c(C(O)=O)scc2)scn1,0 Z354760298,CC(c1nnc(-c2cc(C)ccc2)o1)N(C)Cc(cc1)ccc1C(NC1CC1)=O,1 F6225-0838,Cc1c2nc(N(C)CC(NCc(cccc3)c3OC)=O)sc2c(C)cc1,0 Z1445170614,OC(C(Cc1ccccc1)CNC(C1Oc(cccc2)c2OC1)=O)=O,1 Z3602276017,Cc1c(CC(N(CC2)CC2(c2ccc(C)cc2)O)=O)c(C)n[nH]1,0 Z4910993093,CCOc(ccc(S(N)(=O)=O)c1)c1-c1c(CN(C(CCC(N2)=O)C2=O)C2=O)c2ccc1,0 F792-0423,O=C(Cc(cc1)ccc1F)N(CCC1)C1c1nnc(C(Nc(cc2)ccc2F)=O)s1,1 CM4667-7700,CCOCC(CC1)OC1(CC1)CCN1S(c1cc(F)c(C)cc1)(=O)=O,0 Z2842875992,CC1(c2ccccc2)N(Cc2nccnc2C)CCC1,1 Z750910902,Cc(ccc(C(N(CC1)CCN1C(NCC1OCCC1)=O)=O)c1)c1F,0 Z1984018680,CCC(C1)OCCCN1C(NCc1cc(OC)cc(C)c1)=O,0 Z1021317642,CC(C)c(cc1)ccc1C(N1CCN(CC(O)=O)CCC1)=O,0 Z2205478083,OC([C@H](CN(C1)C(c2c(cccc3)n3nc2)=O)[C@@H]1c1ccccc1)=O,1 8012-3412,O=C(CSC(N1c2ccccc2)=Nc(sc2c3CCCC2)c3C1=O)NCCOc1ccccc1,1 Z1514347141,O=C(c(cc(cc1)-c2ncccc2)c1Cl)N1CC2(CCOCC2)OCC1,1 Z1102806548,CN(C1CCCCC1)C(CN(CC1)CCN1C(C(c1ccccc1)OC)=O)=O,1 F6211-0415,COC(C(Cc1c[nH]c2c1cccc2)NC(c1nn(CCCO2)c2c1)=O)=O,1 F6789-0763,CC(C)c1nccc(N(C)CCc2ccncc2)n1,0 Z4783026686,O=C(Cc1ccccc1)Nc1n[nH]cc1Br,0 F393-0122,CN(C1=NCCN1c(cc1)c2cc1NC(c1cc(-c3ccncc3)nc3ccccc13)=O)C2=O,1 F6573-5267,O=C(c(cc1)ccc1-c1cccc(Cl)c1)NCc1cnc(C2CC2)cc1,1 F6246-3229,CN(C)S(NCCN1N=C(c2ccco2)N(C2CC2)C1=O)(=O)=O,1 F6031-0168,OC(CN(CC1)CCN1C(C1(CCCC1)c(cc1)ccc1Cl)=O)c1cccs1,1 Z2897411887,CC(C)(C1(C)C)C1(C(Nc(cc1)cc(N2C)c1OCC2=O)=O)C(O)=O,1 Z2027248788,CNS(N(CC1)CCN1C(CC1OCCCC1)=O)(=O)=O,0 F6571-1864,OCCOC1(CNC(C2(CC2)c(cc2)ccc2F)=O)COCC1,1 S689-1261,O=C(CCc1ccccc1)N(C1)CC1N(CC(C1)C(NCc2ccccc2)=O)C1=O,1 F5857-0399,OC(CNC(Cc1cccs1)=O)(C1CC1)c1ccco1,1 Z3802536706,CC(C(N(CCC1)CC1(C1)C1C(O)=O)=O)c1c(C)n(CC(F)(F)F)nc1C,1 Z3689333013,O=C(CCn1c(cccc2)c2nc1)Nc1cnc2c(F)cccc2c1,0 F6789-0544,Cc1noc(CN(C)CCc(cc2)ccc2OC)n1,1 Y080-1272,CC(c1nc(cccc2)c2n1CCOc1ccccc1)N1CCOCC1,0 SD60-0205,O=C(CCc1ccccc1)N(C1)CC11OCC(CCOCc2cccc(F)c2)C1,1 E958-0367,O=C(C(CCC1)CN1c1nnc(-n2cccc2)s1)N1CCCCC1,0 Z2465873065,COCc1nc(OC)cc(N(CC2)CCC2C(O)=O)n1,0 V006-8838,CC(C)CCN(CC(COC)O)CC(N1)=Nc(scc2-c(cccc3)c3OC)c2C1=O,0 M086-1425,CCc(ccc(-c1noc(C(F)(F)F)c1)c1)c1S(N(CC1)CCN1c1ncccn1)(=O)=O,1 Z1601676561,CS(c(cc1)ncc1NC(NCC(N1CCOCC1)=O)=O)(=O)=O,0 SC11-0521,Cc1noc(C)c1CN(CCC1)CC1N(CCCN1CCOCC1)C(C1CC1)=O,1 F6793-6830,Cn1nnc(C(N2CCN(CC(F)(F)F)CC2)=O)c1,1 Z2846956092,CCC(NCc1cn(Cc2c(C)nc(C)cc2C)nn1)=O,1 F6522-1101,O=C(c(s1)ccc1Cl)NCc1cc(-c2cocc2)cs1,1 F5831-7535,CC(C)Sc1ccc(CC(NCc2cscc2)=O)cc1,0 F6519-8191,O=C(C(Nc1c(C(F)(F)F)cccc1)=O)NCC(c1cscc1)n1nccc1,0 Z1874133032,CC(C)(CNc1ncnc(C#N)c1)c(ccc(F)c1)c1Cl,0 F6287-0102,O=C(c(c(F)ccc1)c1Cl)NCCc1nc(-c2cccs2)c[nH]1,0 F6257-2568,O=C(Nc1cccc(Cl)c1)Nc1ncnc(N2CCCCC2)c1,0 Z3103993705,CCc1cc(CCN(C2)C(NCc3ncnn3C(C)(C)C)=O)c2cc1,0 F6349-0405,Cn(c(C(N(CC1)CCN1C(c1c(cccc2)n2nc1)=O)=O)c1)nc1-c1ccccc1,1 Z1521839916,CN(c(cccc1C(NCC2CCN(Cc3ccccc3)CC2)=O)c1O1)C1=O,1 S606-2049,CCn1ncc(CN(CC2)C[C@@H]2N(c(nccc2)c2N2CC3CCCCC3)C2=O)c1C,1 Z2331237640,O=C(c1cc(CN2CCCCC2)ccc1)Nc1cc(Cn2cnnc2)ccc1,1 F3395-0528,O=C(c1cc(cccc2)c2o1)N(CC1)CCC1N(CC1)CCN1c1cccc(C(F)(F)F)n1,1 Z3482424153,NC(CCNc1cc(NC(NC2)=O)c2cc1)=O,0 Z2358600455,CN(CC(O)=O)c1ncnc2c1ncn2C1CC1,0 Z2718673398,OC(CCC1)(CN1C(C(c1cccc(F)c1)N1CCOCC1)=O)c1ccccc1,1 CM4670-0047,Cc1nnc(C(CN(C)C2)C2(CC2)CCN2C(Nc(cc(cc2)OC)c2OC)=O)o1,0 Z1417707841,Cc(nc(cc1)OC)c1NC(N(CC1)CCN1C(C1OCCC1)=O)=O,0 Y207-3564,Cc1c(C(Nc2cccc(S(N3CCOCC3)(=O)=O)c2)=O)oc2c1cccc2,1 F3411-1448,Cn1ncc(N=C(N2Cc3ccccc3)SCC(Nc3c(C(F)(F)F)cccc3)=O)c1C2=O,1 Y042-9946,c1(nc2c(s1)cc(C(N[C@H](C(=O)NCCc1c3c([nH]c1)ccc(c3)F)C)=O)cc2)n1cccc1,1 C753-1168,Cc1c(Cn2c(C(O)=O)c(CNCCN(C)C3CCCCC3)c3c2cccc3)cccc1,1 Z3000298153,Cc1c(cccc2NC(CN3N=C(CCCC4)N4C3=O)=O)c2ccn1,1 F5260-0041,Cn1c(C(CNC(c2c(C(F)(F)F)cccc2)=O)N2CCCC2)ccc1,1 F5250-0090,CC(C)(C(N1CCN(Cc2nnnn2-c2ccccc2)CC1)=O)Oc(cc1)ccc1Cl,1 F5016-1662,CC(C)(C)NC(C(NCC(CC1)CCN1C(COc1ccccc1)=O)=O)=O,0 SA89-0256,Cc1c(C(N2CCC(CN(CCN3CCOCC3)C3CCOCC3)CC2)=O)ocn1,1 Z2488739675,O=C([C@]1(CNC2)[C@@H]2COC1)Nc1nn(CC(F)(F)F)cc1,1 F6681-3514,O=C(Cc1cnccc1)N1CC(COc2cnccc2)C1,1 Z1530713684,COc1cccc(CC(Nc2cncc3ccccc23)=O)c1,0 M416-1076,C(C1)CC1c1nc(-c(cc2)cc3c2oc(-c2ccccc2)n3)no1,1 Y501-3552,Cn1nc(C2CC2)cc1NC(Cn1nc(C(F)(F)F)c2c1CCC2)=O,0 Z3595439886,CN(C(C(N(CC1)CCC1C1(C(F)(F)F)N=N1)=O)=CN1)C1=O,1 Z1713768624,CC(C(O)=O)N(Cc(ccc(Cl)c1)c1Cl)C(C)=O,0 SC66-0224,CC(C)Cn1c(C(CN(C2)C(COc(cc3)ccc3F)=O)C22CCOCC2)nnc1,1 J107-0801,O=C(CCNC(c1nccnc1)=O)NC(CCC1)c2c1c(cc(cc1)Cl)c1[nH]2,1 Z1520076007,CC(C)COC(CC1)CN1C(c1cnncc1)=O,1 Z1974671835,O=C(CCN(CCC1)S1(=O)=O)N[C@H](C1)[C@@H]1c(cc1)ccc1Cl,1 SD07-0951,CCC(CC)C(N(CC1)CC11OCc2c(CNC(c3ccnn3CC)=O)nnn2C1)=O,0 Z2075337974,CC(C)[C@@H](C(C)(C)O)NC(c1c(C(C)C)[nH]cc1)=O,0 Z4010101769,Cn1nc(cccc2C(N[C@@H](C3)[C@@H]3[C@H](C3)[C@H]3C(O)=O)=O)c2c1,1 F6572-1404,Brc1ccc(CN2C(CC3)CC3C2)o1,1 SB74-0584,Cc1noc(C)c1CNC([C@H](C[C@]1(CC2)CN2C(c2ccccc2)=O)NC1=O)=O,1 F5097-0840,O=C(Cc(cc1)ccc1NC(C1(CCOCC1)c1ccccc1)=O)NC1CC1,1 F6438-6985,OC(CC1)C1N(C1CC1)c1nccc(C(F)(F)F)n1,1 G370-0354,O=C(C1=CSCCO1)Nc1cc(C(N2CCCC2)=O)ccc1,1 V011-3889,N#Cc1cccc(NC(N(CC2)CCN2c2c(c(CCCC3)c3s3)c3nc(Cc3ccccc3)n2)=O)c1,0 S664-4552,OC(CC1)C1(CC1)CCN1C(COc1ccccc1)=O,0 Z4108782522,CC(N(c1c(C(F)(F)F)cccc1)N=C1C(N(CC2)CC2(CN)C2CCOCC2)=O)=CC1=O,1 Z2835238893,CC(C)CCOc1cccc(NC(c2nn(C)nn2)=O)c1,0 Z1227957295,O=C(C(CCC1)N1C(c1ccccc1)=O)Nc1cn(CC(F)(F)F)nc1,1 Z2718683637,CC(C)c(c1c2)noc1ncc2C(Nc1cn(CCF)nc1)=O,1 F6472-0689,O=C(c1cc(cc(cc2)F)c2s1)NCCSC1CCOCC1,1 Z2295395990,Cc(c(NC(N1C(C2)C2CCC1)=O)cnc1)c1Cl,0 Z1609498376,CC(C1c2ccccc2)SCCN1C(CCc(cccc1)c1C(O)=O)=O,0 Z1665502623,CCC(C(O)=O)(c1ccccc1)NC(c(cccn1)c1OC)=O,0 D072-1265,Cc(cc1)ccc1S(c1c(NCCN2CCOCC2)oc(-c2cccs2)n1)(=O)=O,1 Z226220070,O=C(CC1(CC(C2)C3)CC3CC2C1)NCc(cc1)cnc1N1CCOCC1,1 F0317-0047,CC(CC1)Cc2c1sc(NC(C1CC1)=O)c2C#N,1 FF20-0708,O=C(N(Cc(cc1)ccc1Cl)CC1)N1C1CNCCC1,0 F6520-0603,Cc1noc(C)c1CCC(NCCc1ccc(-c2ccco2)s1)=O,1 S720-1085,Cc1nn(C)c(C(N(C[C@H](C2)Oc3ccccc3)[C@@H]2C(NC2CC2)=O)=O)c1,1 Z363143114,CCn1nc(C(C)C)cc1C(N(CC1)CCN1c1ncccc1)=O,1 F1065-0549,Cc(c(C)c1)cc(NC2CC(Nc(cccc3)c3SC)=O)c1NC2=O,0 Z1932294012,CC(CN(C=CC(C)=C1)C1=O)(C(NC(CC1)CCN1C1CCCCC1)=O)O,1 Z2019043391,Cc1ccc(C2(CCOCC2)C(NCc2nccn2-c2ccccc2)=O)cc1,1 Z223605592,CNC(C(C1)Oc(cccc2)c2N1C(C(C1)c(cccc2)c2N(C)C1=O)=O)=O,1 D271-0166,CCSC(N1)=NC(NC(CC2c(cccc3)c3OC(C)C)=O)=C2C1=O,1 SB59-0398,CC(C)C(N(C1)CC(C2)(CN2C(c(ccc(OC)c2)c2OC)=O)C1c1nncn1C)=O,0 Z1787045910,CC(C(CC1)CCN1C(c1cc(C(NC2CC2)=O)ccc1)=O)(C(N1)=O)NC1=O,1 F5854-3964,Cn1c(CN(C2CC2)S(c2cccc3cccnc23)(=O)=O)ccc1,1 SA46-1838,CC(C)CCC(N(C1)CC1(C1)OCC1N1CCN(C)CC1)=O,1 J005-0868,Cc1noc(C)c1S(N(CCCCC1)C1c(cc1)ccc1Cl)(=O)=O,1 SC04-0078,Cc1nc(CCOC(CCC2)CN2C(c2ncc(C)nc2)=O)no1,0 E589-1412,O=C(CN1c(cc(cc2)S(N3CCCCC3)(=O)=O)c2OCC1=O)N(CC1)CCN1C1CCCC1,1 Z1953394263,O=C(c(cc1)ncc1-n1cncc1)N1C2(CCC2)CCC1,1 Z1673972357,Cc(cc1)ccc1-n1ncc(S(NCc2cncs2)(=O)=O)c1,0 8015-5163,CCCOC(C(F)(F)F)(C(N1CCc2ccccc2)=O)NC1=O,0 Z986907822,COc1cccc(C(NCC(N(CC2)CCC2OC2CCCC2)=O)=O)c1,1 Z3063078400,CC(C)(C)n1ncc(C(N(C[C@H]2c3ccnn3C)C[C@H]2NC(C)=O)=O)c1C,1 Z3278088250,CN(C=Cn1c2nnc1CN(C1)CC3(CCC3)C1N)C2=O,1 Z2408218091,O[C@H](CC1)[C@@H](c(cc2)ccc2Cl)N1C(C(CCC1=O)n2c1ccc2)=O,1 Z2622878719,O=C([C@@H](CCCC1)[C@H]1C(F)(F)F)Nc1cc(Cn2ncnc2)ccc1,1 F6561-4914,CCOC(CCC(N(C(CC1)C2)C1CC2=C)=O)=O,0 F5528-1604,O=C(C(CC1)CCN1c(cc1)nnc1-c1cnccc1)NCc(cc1)cc2c1OCO2,1 Z2911451610,COc1cccc(CC(C(O)=O)NC(c2nn(C3CCCCC3)cc2)=O)c1,0 E216-5020,CC(C1)Oc(ccc(Cl)c2)c2N1C(Nc1cc(C)cc(C)c1)=O,0 F2068-0035,COc1cccc(C(NCCS(N(CC2)CCN2c2cccc(Cl)c2)(=O)=O)=O)c1OC,0 Z2605263122,OC(CS(CCN(CC1)CCN1c(ccc(Cl)c1)c1Cl)(=O)=O)=O,0 Z2218002664,Cc1nc([nH]cc2)c2c(N(CC2)CC22CN(C)CCC2)n1,1 Z1472226030,CC(C)CC(C(Nc1cc(-c2ccccc2)n[nH]1)=O)N(CCCC1)C1=O,1 V017-8115,O=C(C(C1)C(CN(CC2)c3ncccn3)N2c2c1cc(C(F)(F)F)cc2)NCC1OCCC1,1 C241-2164,O=C(CCN(C(c(scc1)c1N1CC(NCC2OCCC2)=O)=O)C1=O)NCCc(cc1)ccc1Cl,1 Z4480730195,C#Cc1ccc(C(CCC2)N2C(c2nccc(Cl)c2)=O)cc1,0 Z46359707,Cc1cc(NC(CN(C)Cc(cccc2)c2F)=O)no1,1 CM4582-6046,Cn1ncc(CN(CC2)CCC2N(C2)[C@H](COc3cnccc3)CC2(F)F)c1,0 F6412-1573,COc(cc1)cc(S(NCC#CCOc(cccc2)c2OC)(=O)=O)c1OC,0 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Z2072918509,O=C(c(scc1)c1Cl)N(CC1)CCC1N(CCCC1)C1=O,0 F6523-0155,Cc1nc(N(CC2)CCC2NC(c2ccc(Cn3cncc3)cc2)=O)cc(C(F)(F)F)n1,1 F6541-0794,OC(CCC1)CN1C1CCN(Cc2ccccc2)CC1,1 Z1675579892,CC1(Cn2nnc(C(Nc3cn(CC4OCCC4)nc3)=O)c2)COC1,1 F0682-1017,COc1cccc(-n2nnc3c2ncnc3SCC(N(CCC2)c3c2cccc3)=O)c1,1 Z2482990150,CN(CCn1nccc1)C(C(O)=O)c(cc1)ccc1F,0 F5882-6109,Cn(c(C(N(CC1)CCN1C(c1ccco1)=O)=O)c1)nc1-c1cc(OC)ccc1,0 Z3294790745,CC(C)n1nnc(NS(c2ccc(C(C)(C)C)cc2)(=O)=O)c1,0 S544-0400,O=C(NC1CCCC1)N1CC(CCOc(cc2)ccc2F)CC1,1 Z74735418,OCC(C(O)=O)NS(c1c(C(F)(F)F)cccc1)(=O)=O,0 Z1227711000,OC(CN(CC1CC1)C(c(cc1)ncc1Cl)=O)=O,0 F6656-2811,CC(C)(C)c(cc1)nnc1OCC(CC1)CCN1C(C1=CC=CNC1=O)=O,1 F6448-1844,O=C(c1cc2c(-c3ccccc3)onc2cc1)Nc1cn(C2CCOCC2)nc1,1 F6549-4720,Cc1cc(C(N(CCC2)CC2c2cn(C)nc2)=O)c(C)o1,1 Z3141935078,NC(C1)C1(C1)CC1NC(CC(CC1)CCC1C(F)(F)F)=O,1 Y200-4296,CCn1nc(C(NCC(C)C)=O)c(NC(CCC(O)=O)=O)c1,0 SC10-1152,CC(C)C(N(CCCN1CCCC1)C(CC1)CN1S(c1cccs1)(=O)=O)=O,0 Z2982879119,CC(C)CC(CC(O)=O)C(NC(CC1)c2c1cccc2)=O,0 F5528-1727,COc(ccc(Cl)c1)c1NC(C(CC1)CCN1c(cc1)nnc1-c1cnccc1)=O,0 V009-7309,CC(C)CC(C)NC(c1cc(CCc(cc2)c-3cc2OC)c3s1)=O,0 F6539-2792,CC(C)(C(NCC(CC1)CCN1C(N(C)C)=O)=O)OC(C)=O,0 F6562-2841,O=C(CCC1)N1c1nccc(CNS(Cc2cc(C(F)(F)F)ccc2)(=O)=O)c1,1 V017-7632,CC(C)CCN(CC(Cc1ccccc1)O)CC(N1)=Nc(sc(C)c2C)c2C1=O,1 Z1991817494,CCN(CC)C(C(CC1)CCN1C(Nc(cc1)cc(C2CC2)c1F)=O)=O,1 Z1553100453,CN(c(cc1)c(N2C)nc1NC(CCC(N(CC1)CC(CC3)N1C3=O)=O)=O)C2=O,1 Z1537762070,O=C(C(C=C1)=NN(Cc2ccccc2)C1=O)Nc1cc(-c2c[nH]nc2)ccc1,1 S720-1048,O=C(CN(c(cccc1)c1O1)C1=O)N(C[C@H](C1)Oc2ccccc2)[C@@H]1C(NC1CC1)=O,1 F6245-5721,CN(C(C(F)(F)F)=NN1CCNC(c2cc(Br)cnc2)=O)C1=O,1 Z1496002400,OC(C1(CNS(c2cccc(Br)c2)(=O)=O)CCOCC1)=O,0 Z2188760118,CCc(n(C)cc1)c1C(Nc1cccc2ncccc12)=O,1 8255-1149,CC(C)n1c(C(N(C)C(N2C)=O)=O)c2nc1CN(CC1)CCN1c(cc1)ccc1OC,0 Z2295945571,COCC(CC1)(CN1C(C(Cc1ccccc1)Cc1ccccc1)=O)C(O)=O,1 E475-0649,CCC(C)N(CCNC(c1noc-2c1COc1c2cc(C)cc1)=O)Cc1ccco1,1 F184-0094,Cc(cc(c(OC1)c2)NC1=O)c2S(N(CCC1)CC1C(N(C)C1CCCCC1)=O)(=O)=O,0 C301-7128,CCOc(cc1)ccc1Nc(nc(Nc(cc1)ccc1OCC)nc1C)c1NC(C1CCC(C)CC1)=O,1 SA92-0209,O=S(C1CC1)(N(CCC1)CC1(c1nc(-c2ccncc2)no1)F)=O,1 Z2910834190,OC(c(cc1)nn1-c1cccc(CNC(C2CC(CC3)SC3C2)=O)c1)=O,1 F6752-6257,O=C(C(CCC1)CN1c1nncs1)N(CC1)CCC1(F)F,1 V001-5116,CCC(C)CN(CC(N(CC1)C(COc(cc2)cc(C)c2Cl)c2c1scc2)=O)C(COC)=O,0 Z2698575646,Fc1c2oc(N3CCCC3)nc2ccc1,0 Y041-7828,N1(C(N[C@H](C1=O)CCC(=O)NCCc1nc2c(n1C)cccc2)=O)CCc1ccccc1,1 C519-0486,CN(C=C1C(NCc2cccs2)=O)c(ccc(S(N2CCOCC2)(=O)=O)c2)c2C1=O,1 Z392568218,O=C(C(C1)ON=C1c1ccccc1)NCc(cc1)cnc1-n1cncc1,1 S018-0540,O=C(C(CN(C1)S(c2cccs2)(=O)=O)C11CCCCC1)NCCN1CCOCC1,1 Z1521912917,CN(c1cccc(C(N2c3cccc(F)c3C3(CCCC3)C2)=O)c1O1)C1=O,1 G887-0859,CCc1cc2c(N(CCC3)CC3C(NCCN3CCC(C)CC3)=O)ncnc2s1,1 F6514-2739,O=C(c1nc2ccccc2nc1)N(C1)CC1OCC(F)(F)F,0 F6471-0489,O=S(c1cccc2cccnc12)(N(CC1)CC1n1nnc(-c2ccccc2)c1)=O,1 C592-3006,Cn1c(Cc(n2-c(cc3)ccc3Cl)nnc2SCC(NCC2OCCC2)=O)ccc1,1 SC98-0375,CC(C)Cn(c1c2CN(Cc(ccc(OC)c3)c3OC)CC1)nc2-c1ncc(C)o1,0 Z1433135484,O=C(c1cccc2cccnc12)Nc1cc(Cl)cc(F)c1,0 Z2996204580,O=S(c1ccnn1C1CCC1)(Nc1nc(CCCC2)c2cc1)=O,1 Y042-6063,O=C(CC1(CCCCC1)n1cccc1)Nc(cc1)ccc1N(CCC1)S1(=O)=O,1 Z1447731627,COc(cccc1)c1N(CC1)CCC1NC(NCCCF)=O,0 F2215-0051,CCOc1cc(C(Nc2cc(C)nn2C(N2)=NC(C)=CC2=O)=O)cc(OCC)c1OCC,0 F6512-0219,O=C(CN(c(cccc1)c1O1)C1=O)N1Cc2ccnn2CC1,1 F6557-1714,Cc1c(C(N(CCC2c(cccc3)c3Cl)CCS2(=O)=O)=O)sc(-n2cccc2)n1,1 Z1765000423,O=C(C1(CC1)c1ccc(C(F)(F)F)cc1)Nc1nn(CCc2ccncc2)cc1,0 P888-0299,COc(ccc(CCN(CC(C1)C(NCc(cc(cc2)F)c2F)=O)C1=O)c1)c1OC,0 F6594-1889,CC(C=C1)=NN(CC2CCN(Cc(cc(cc3)F)c3F)CC2)C1=O,1 F6619-6289,N#Cc(ccnc1)c1N(CC1)CCN1c1cc(N2CCOCC2)ncn1,1 Z3052272343,CC(COC)(CC1)CN1C(CN1N=CN(C)C1=O)=O,0 Z1548929216,O[C@@H](C(N(CC1)CCN1C(c(cccc1)c1OC(F)F)=O)=O)c1ccccc1,0 V003-1962,O=C(c1ccc(-c(cc2)cc3c2OCO3)s1)NCCCCc1ccccc1,1 V018-7025,Cc1cccc(CN(C(NCC=C)=O)c2ccc(CC(N3CCN(C)CC3)=O)cc2)c1,1 Z3590691321,C[C@@H](c1cnccc1)N(C)C(CC(C(C)=NC1=C2)=C(C)N1NC2=O)=O,1 T787-5000,Cc(ccc(Cl)c1)c1NC(N(C1)CC2(CCOCC2)C1C(N(C)C)=O)=O,0 Z2330748138,O=C(C(CC1)N(CC23CCOCC3)C2c2ccccc2)N1C1CC1,1 Z1763773009,CN(C)C(c1cn(C)nc1-c1cn(C)nc1)=O,0 E019-1016,CC(c1c2c(cccc3)c3s1)=NN(CCCC(NC(CCC1)c3c1cccc3)=O)C2=O,1 Y300-3652,CC(c(cccc1)c1OC)NC(C1CCCCC1)=O,0 Z3557789777,CC(C1)OCCN1c1nccc(CNc2ncc(C)c(SC)n2)c1,1 F6562-8966,O=C(C(CC1)Oc2c1cccc2)NCc1nccnc1-c1cscc1,1 SB14-0063,O=C(Cc(cc1)ccc1F)N(C(CC1)CN1C(C1CC1)=O)C1CCOCC1,1 SD64-0410,CNC([C@]1(C[C@H](C2)NC(NC3CCCCC3)=O)[C@@H]2CN(Cc2ccccc2)C1)=O,1 K936-0043,CCCNC(CN(C=Nc1c2c(C)c(C(NC3C(C)C(C)CCC3)=O)s1)C2=O)=O,1 F6284-0133,O=C(COc(cc1)ccc1Cl)NCCc1cncnc1,1 F6442-8713,CC(C)(C)c(cc1)ccc1C(N(CC1)CCC1N(CC1)CCC1Oc1nccs1)=O,0 Z1340596049,O=C(Cc(cc1)ccc1Br)NS(c1cn(Cc2ccccc2)nc1)(=O)=O,1 F3222-1620,Cc(ccc(NC(C(CC1)CCN1c1nc2ccccc2nc1)=O)c1)c1Cl,0 V020-6763,CCNC(N(Cc(n1CC2OCCC2)cnc1S(Cc(cccc1)c1F)(=O)=O)C(C)C)=O,0 F2004-0284,Cc1nc(CSc(cc2)nnc2-c2ccco2)cs1,1 Z2787883284,N#Cc(cc1)ncc1N(CC1)CCC1C(N1CCCC1)=O,1 Y503-1776,CC(C1C(CC2)CC2C1)NC(c1c2nc(C)cc(C)n2nc1)=O,1 F6482-5849,O=C(CSCc1ccccc1)NCc1cc(-c2ccncc2)ncc1,1 Z1590121339,Cc1c(C(CCC2)N2C(NCCc2c[nH]c3c2ccc(Cl)c3)=O)c(C)n[nH]1,0 Z1980551822,CC(C1)CN1C(Nc1nn(CCN(C)C)cc1)=O,0 Z1315223769,CC(C)c1nncn1CCNC(C1N(Cc2ccccc2)CCCC1)=O,1 E958-0101,O=C(C(CC1)CCN1c1nnc(-n2cccc2)s1)Nc(cc1)cc2c1OCCO2,1 F6237-2837,O=C(c1nn(-c2ccc(C(F)(F)F)cc2)nn1)NCCC1=CCCCC1,1 Z2032374317,COCc1c(C(N(CC2)CCC2c(cc2)ccc2O)=O)scn1,0 F6389-1262,O=C(c1nccc(-n2nccc2)c1)NCc1cnccc1,1 F6471-1980,COC(CC1CC2)CC2N1S(c(cc1)ccc1Br)(=O)=O,0 Z1767649168,CC(C)Oc1cccc(CC(N(CCC2)CCN2C(C2CC2)=O)=O)c1,0 Z1444697063,Cc(n(-c1cc(C)ccc1)nc1)c1C(N(CC1)C(C(O)=O)c2c1cccc2)=O,0 SD61-0236,O=C(C(C1)C2(CCC2)CN1C(C1(CC1)c1ccccc1)=O)NCc1cnccc1,1 F6796-4345,CCc(ncnc1OCC(CC2)CCN2C(N(C)C2=O)=Nc3c2scc3)c1F,1 V005-2678,CCc1c(Cc2c(C)ccc(C)c2)c(N(CC2)CCN2S(CC)(=O)=O)nc(C2CC2)n1,0 Z1370957393,CCN(Cc1ncccc1)C(Cn1c(cccc2)c2nc1)=O,1 F6416-9133,OC(CCNC(c1noc(C2CC2)c1)=O)c1cccc(Cl)c1,1 F5981-0122,Cn(cc1C(NCC(Nc(cccc2)c2C(OC)=O)=O)=O)nc1OC,0 S635-4439,COCC(CN(C1)C2CCC2)C1(CC1)CCN1S(C)(=O)=O,1 F6734-1206,COc1ccc(CCNC(N(C2)CC(C3)C2CN3c(cc2)ncc2Br)=O)cc1,1 F5546-0120,C=CCNC(Cn1c(-c2ncccc2)nc2c1cccc2)=O,0 Z1246117960,CC(C)C(Cc1ccccc1)C(NC(CCN1c2cn(C)nc2)C1=O)=O,1 F1656-0039,O=C(c(cccc1)c1Cl)N(C1)c(cccc2)c2NC1=O,0 SB49-1136,NC(C(C1(CCC2)CCOCC1)N2C(CCn1cncc1)=O)=O,1 F5069-0120,COc1cn(-c(cc2)ccc2F)nc1C(Nc1nccs1)=O,1 G702-0980,C(C(CC1)CCN1c1c(CCCC2)c2nc2ncnn12)c1ccccc1,1 F322-0543,Cc1noc(-c2c(C)sc(C)c2S(N(CC2)CCN2c(cc2)ccc2F)(=O)=O)c1,0 Z1193134446,CC(CCC1)(CN1C(c1c(C)oc(C)c1S(N)(=O)=O)=O)c1ccccc1,0 T629-0531,C(c1cscc1)N(CCC1)CC1c1nnc(-c2cnccc2)[nH]1,1 F6502-0943,CC(C)(Cc1ccc2)Oc1c2OCC(NCCn1c(-c2nccnc2)ncc1)=O,1 F5854-4172,CS(N(CC1)CCC1C(N(Cc1cscc1)C1CC1)=O)(=O)=O,1 F5854-4064,Cc1cc(C(N(Cc2cscc2)C2CC2)=O)c(C)o1,1 F5460-0535,CCn1nccc1C(Nc1cc(C)nn1-c1nc(ccc(F)c2)c2s1)=O,1 V003-1703,CCN(CC)S(c(cc1)cc(N(CC2)CCN2S(c(cc(cc2)OC)c2OC)(=O)=O)c1OC)(=O)=O,0 Z2027313795,Cc(cc1)ccc1C(N(CCC1)CC1C(NCc(cc1)cc2c1n(C)c(C1CC1)n2)=O)=O,1 Z1985687697,Cc1c(C(N(CC2)CC2c2ncccc2)=O)c(-c2ncccc2)no1,1 Z2770726626,CC(C(NC1CCN(Cc2cnccc2)CC1)=O)n1nc(C(F)(F)F)cc1,1 C300-0081,O=C(CCS(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O)N(CC1)c2c1cccc2,1 Z1634013883,COc1ncnc(OC)c1C(NCC(C1)CN(C2CC2)C1=O)=O,1 Z1987693994,Cc1c(C(N(CCC2)CC22CCN(C)CC2)=O)sc(NC(c2cc(F)ccc2)=O)c1,1 F6524-0021,Cn1c(cccc2)c2c(CC(NCCN(C(c2c(N3)nccc2)=O)C3=O)=O)c1,1 SA67-0409,O=S(c1cccs1)(N1CC(CCc2noc(C3CC3)n2)CC1)=O,1 S984-1611,CC(C)N(C[C@H]1CN(C2)S(N3CCOCC3)(=O)=O)C[C@]12C(N1CCCC1)=O,1 Z3205310987,O=C(c1cc(ccc(F)c2)c2s1)N1C(CCn2nncc2)CCCC1,1 F6506-2102,CC(C)NC(NCC(c1cocc1)(c1cccs1)O)=O,1 Z2200459953,Cc(n(C)nc1)c1S(NC(COC)c1ccco1)(=O)=O,0 Z1093049390,CC(CCC1)CC1N(C)C(c1cn(C)nc1-c1cnccc1)=O,1 F6561-5608,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CCC1S(Cc1ccccc1)(=O)=O,1 Z951377594,CCc1nc2ncnn2c(NC2CN(CC(F)(F)F)CC2)c1,1 Z2225604977,CC(C)n1nc(C)c(CC(N(CC2)CC(C)CS2(=O)=O)=O)c1C,0 S672-0518,CCN(CCC1)C2(CCOCC2)CN1C(NCc1ccccc1)=O,1 F6357-1403,O=C(C(Nc(cc1)cc(Cl)c1F)=O)NCC1(CC1)c1cscc1,1 F6805-3182,Cc1nc(cccc2)c2n1C(C1)CN1c1ccnc(SC)n1,0 S699-0372,CN(CCc1noc(C(C2)CN2C(C2CCOCC2)=O)n1)C(C1CC1)=O,1 F6562-1132,Cn1ncc(C(CN(C2)S(c(cc3)ccc3-n3nccc3)(=O)=O)c3c2cccc3)c1,1 S988-1021,CCS(N(C[C@H]1CN(C2)S(N(C)C)(=O)=O)C[C@]12c1nc(C)no1)(=O)=O,0 F6555-0289,O=C(c(cc1)ccc1Oc1nccs1)N(C1)CC1n1nnc(C2CC2)c1,1 Z1676030419,Cc1nccc(N(CC2)CCN2C(C2(CC2)c2cccc(F)c2)=O)n1,1 3336-0954,OC(CCCC(N(C(C1)c(cc2)ccc2Cl)N=C1c(cc1)ccc1Br)=O)=O,0 F6212-0329,CS(N(CC1)CCN1C(c1c2OCCCn2nc1)=O)(=O)=O,1 SD06-0872,COCC(N[C@@H](C[C@@H](COc1ccccc1)C1)[C@H]1C(N1CCCC1)=O)=O,1 F6502-6796,Cc1cc(-c2cccs2)nn1CCNC(c(cccc1)c1SC(F)F)=O,0 G373-2596,Cc1nc(cc(cc2)C(N(C)C)=O)c2n1C(CC1)CCN1S(c1cccc2nsnc12)(=O)=O,1 Z1563146757,Cc(cc1C(O)=O)cc(S(Nc2cc(COC3)c3cc2)(=O)=O)c1O,1 S831-2349,Cc1noc(C)c1C(N(C[C@@H]1CO)C[C@@H]1c1ncccc1)=O,0 F6057-0153,CN(C)S(c(cc1)ccc1C(N1CCN(CCn2nccc2)CC1)=O)(=O)=O,0 P681-0367,CN(C(C1(CC2)CN2C(c(cc2)ccc2C#N)=O)=O)c2c1cccc2,0 F6125-2002,CC(N(C1)CC1C(N(CC1)CCN1c1ncccc1)=O)=O,0 Z4525630626,Cc1cccc(Oc(cc2)cnc2C(NC2(CCCC2)C(NCC2CC2)=O)=O)c1,1 6481-5152,O=C(CSC(N1c2ccccc2)=Nc([nH]nc2)c2C1=O)Nc1nc(-c2ccccc2)ns1,1 F6438-1657,Cc1cc(CNC(COc2ncccn2)=O)nc(N2CCCCC2)n1,1 S932-7366,O=C(c1cc2cccnc2cc1)N(CC1)CC1n1nnc(COc2nccnc2)c1,1 F6237-0613,Cc(cc1)ccc1-n1nnc(C(Nc(ccc(Br)c2)c2F)=O)n1,0 F3225-5880,Cc(cc1)ccc1C(NCc1nc(cccc2)c2[nH]1)=O,0 F6502-2645,O=C(c1cc(Br)cs1)NCCn1c(C2CC2)ncc1,1 Y031-6069,CCCS(c(cccc1)c1C(NC1CCCC1)=O)(=O)=O,0 Z2439087566,CC(C)C(C1(CNC(C(C)(C)N)=O)CC1)O,0 SC67-1081,Cc1noc(C)c1CN(CC1)CCC1(CN(Cc1ccccc1)C1)C1c1nncn1C,1 F5937-0202,O=C(Cc(cccc1)c1Cl)NCCCn1cccc1,0 F6089-9784,Cc1cc(C)nn1CCNC(NC1CCOCC1)=O,1 F762-0316,CSc1ccc(C(c2c(CC3)c(cccc4)c4[nH]2)N3S(c(cccc2)c2F)(=O)=O)cc1,1 V007-1145,CCC(CC)CNC(c1noc(-c2ccc(C3CCCCC3)cc2)c1)=O,0 G267-0775,Cc1c(CCC(NCCN2CCOCC2)=O)c(C)nn1-c(cc1)nnc1N1CCCC1,1 L461-0309,COc(cc1)cc(S(N(CCC2)CCN2c2nc(cccn3)c3s2)(=O)=O)c1OC,0 F6357-0955,Cc(cccc1)c1NC(NCC1(CCCC1)c1cscc1)=O,1 Z4192256882,CCOC1(CNc2nn3c(-c4ccncc4)nnc3cc2)CCC1,1 Z1610367742,CC(C)(C(C)(C)O)NC(c1noc(-c2ccco2)c1)=O,0 Z1675509930,CC(C(N(C)C)=O)NC(c1c(C2CCCC2)ncs1)=O,1 F6523-0407,O=S(c(s1)ccc1Cl)(N(CC1)CCN1c1ncnc(C(F)(F)F)c1)=O,0 Z1131763609,OCc1cccc(CNC(c(cccc2)c2-c2ccc(C(F)(F)F)cc2)=O)c1,0 V009-0539,CCC(C(NCC1CC1)=O)Oc1cc(C(c2cccc(F)c2)N(CC2)C(C(C)(C)C)=O)c2cc1,0 S997-1057,CS(N(C1)C[C@@](CO)(CC2)[C@H]1CN2C1CCOCC1)(=O)=O,1 F6286-0412,O=C(Cc1cccs1)NCCc1nc(C(F)(F)F)cc(C2CC2)n1,1 F5283-0005,O=C(COc(ccc(Cl)c1)c1Cl)NCCN1N=CC=CC1=O,0 Z1022420170,CCN(Cc1c2OCOc2ccc1)C(C)=O,0 Z90314417,COc(c(NC(C(CCCC1)C1C(O)=O)=O)c1)cc(Cl)c1OC,0 G395-1707,O=C(CCc1nnc(cc2)n1nc2NCCCN(CCC1)C1=O)N(CC1)CCN1c1ncccc1,1 Z2798500211,CC(C)N(C(CC1)CC2)C1CN2C(NCc1cc(C(O)=O)ccc1)=O,1 F3167-1537,CCOC(c1cccc(NC(CN(c(cccc2)c2C(c2ccccc2)=N2)C2=O)=O)c1)=O,0 Z90754838,CCc1c(C(NCc(cc2)ccc2F)=O)snn1,0 F6471-5710,O=C(c(cccc1)c1Cl)N(CC1)CCC1n1nncc1,0 Z1240561344,O=C(c1c2nccc(-c3ccccc3)n2nc1)N(C1)C2C1CCC2,1 Z3644496264,CC1(CC=CC1)C(Nc1cc(C(N(C2)C(CCC(N3)=O)C3=O)=O)c2cc1)=O,1 Z1204415133,CC(CN(C)C(c1cc(COc2cnc(C)cc2)ccc1)=O)C#N,1 Y207-5572,CCN(CC)c1ccc(C(C2CCCC3)N(Cc(cccc4)c4Cl)CCC23O)cc1,0 F2879-0479,Cc1ccc(CNC(C(NCc2cnccc2)=O)=O)cc1,1 Z643222954,COC(CC1N(CC(N(CC2)CCN2C(C2CC2)=O)=O)CCc(cc2OC)c1cc2OC)=O,1 Z4444505338,CC(C)C(C1)=NOC1C(N[C@@H](CCC1)c2c1ccc(F)c2)=O,0 8019-8382,Cc1cc(C)nc2nc(S(NCC3OCCC3)(=O)=O)nn12,1 F6200-3141,Cn1c(cccc2)c2c(C(CNC(c(ccc(OC)c2OC)c2OC)=O)O)c1,0 Z3322472414,OC1CC2(CC2)N(Cc2nc(-c3ccc(C(F)(F)F)cc3)no2)CC1,1 F6525-7761,O=C(NCCn1ncc(-c2cocc2)c1)NCc(cc1)ccc1F,1 Z2434563393,CCN(C)C(C(CC1CCC2)CC2C1N)=O,1 Z1525026302,CCNC(c1c[nH]c2cccc(Br)c12)=O,0 C785-4423,CCc1cc(n(c2c3)C(CC)=NN(CCCC(NC4CCC(C)CC4)=O)C2=O)c3s1,0 F6474-8020,O=C(c(cccc1)c1F)N(CC1)CC1N(C(CN1)=O)C1=O,0 S954-5419,CN(C)C([C@@H](CN(C1)c(cc2)cc(C(F)(F)F)c2C#N)[C@H]1C(CC1)CCN1S(C)(=O)=O)=O,0 Z2790169956,OC(CCC(c(cc1)ccc1S(N(CC1)CCC1C1CC1)(=O)=O)=O)=O,1 Z978787798,CC(c1ccc(CNC(NCc2c(-n3cncc3)nccc2)=O)cc1)O,0 Y031-6358,CCCC(N(CC1)CCC1C(NCCN1CCOCC1)=O)=O,1 F5226-2249,CC(C)(C)C(Nc(cc1)ccc1C(NCCNC(Nc(cccc1)c1Cl)=O)=O)=O,1 Z2762261865,CO[C@@H](C[C@H]1CNC(c2coc3c2ccc(F)c3)=O)CN1c1ncncc1,1 T502-1165,O=C(C(CC1)(CCN1S(c1cnccc1)(=O)=O)F)NCC1CC1,1 F6573-7488,Cc1nn(C)c(C(N(CCN2c3cnccc3)CC2=O)=O)c1,1 F6524-1653,CC(N=C(N1)N(CC2)CCC2NC(c2cc(-c3ccccc3)nn2C)=O)=CC1=O,1 Z2483066733,CC(C)c1nc(C)c(C(C)N(C)Cc2c(C(O)=O)scc2)s1,0 F5855-0769,CS(N(CC1)CCC1C(N(CC1)CCN1C(C(C1)C1c(cc1)ccc1F)=O)=O)(=O)=O,1 F6554-0821,Cn1nc(C(CCC2)CN2C(c2nc3ccccc3nc2)=O)cc1,1 F372-1976,O=C(NC1CCCCC1)N(CC1)c(cc2)c1cc2S(Nc1cccc(Cl)c1)(=O)=O,0 Z5001810306,CCC(C)CC(NCC(CC1C2COC1)N2C(CC(C)(C)O)=O)=O,0 Z1431796618,O=S(c(s1)ccc1Cl)(Nc1cc(Cl)cc(F)c1)=O,0 SB32-0949,COC[C@@H](CN(C1)C(c2cocc2)=O)[C@H]1c1nc(-c2ccccc2)n[nH]1,0 D470-2005,COc(cc1)ccc1S([C@@H](CS(C1)(=O)=O)[C@H]1NCc1ccco1)(=O)=O,0 S233-1736,Cc1nccn1CC(NC[C@](CCC1)(CC2)[C@@H]1N(CC1CCCCC1)C2=O)=O,1 L337-0275,O=C(Cc1nnc(NC(Nc(cc2)cc3c2OCCO3)=O)s1)N1CCOCC1,1 F6255-0008,Cc(cc1)nnc1N(CCC1)CC1C(NCC1OCCC1)=O,1 F6436-1664,O=C(c(cccc1)c1SC(F)F)NCC1(CCCC1)c1cccs1,0 Z1323627780,COc(cc(cc1)NCc2cccs2)c1Br,0 Z1334513915,CS(Nc(cc1)ccc1-c1csc(Nc2cc(F)ccc2)n1)(=O)=O,0 F2372-0449,O=C(NCC(C1)CN(Cc(cc2)ccc2F)C1=O)Nc1cccs1,1 Z3892576255,Oc1cccc(CC(CC2)CCN2C(c(cc2C=C3)cc(F)c2NC3=O)=O)c1,0 8018-5567,COc1cccc(C2OC(CCCC3)C3c(cc3OC)c2cc3OC)c1OC,0 F2571-0210,Cc(cc1)ccc1S(N1C(CCNC(C(Nc2c(C)c(C)ccc2)=O)=O)CCCC1)(=O)=O,0 F5528-1223,O=C(C(CC1)CCN1c(cc1)nnc1-c1cccs1)Nc1cc2ccccc2nc1,1 Z1081884468,Cn1c(cccc2)c2c(C(N2C(CN3CCCCC3)CCC2)=O)c1,1 8019-6699,O=C(CC1c2ccc(C(F)(F)F)cc2)Nc2c1c(CCCC1)c1s2,0 Z902922896,CC(NCC(CCC1)CN1C(NCc1cn(cccc2)c2n1)=O)=O,0 F6564-2010,O=C(NCCN1N=C(CCCC2)C2=CC1=O)NC1CCOCC1,1 Z2489472418,Cc1nnc(C2)n1CC(C(O)=O)N2C(CC(C(F)(F)F)OC)=O,0 F5317-0368,CCOC(N(CC1)CCC1NC(C(N(C)C=C1OCc2cc(OC)ccc2)=CC1=O)=O)=O,1 F2986-0174,COc(cccc1)c1N(CC1)CCN1C(CS(c(s1)ccc1Cl)(=O)=O)=O,0 F5686-0112,COc1cccc(C(CSc2ncnc(N3CCOCC3)c2)=O)c1,1 Z2910515542,OC(C(Cc1cccc2ccccc12)CNC(CCc1c[nH]cn1)=O)=O,1 Z2437166104,CS(N(CCC1)CCN1S(c(cccc1)c1C(O)=O)(=O)=O)(=O)=O,0 Z2273497882,Cc1nccc(N2[C@H](COc3ccccc3)CCC2)n1,0 Z2966018770,CC(COCC1)(C2CC2)N1C(C(O1)=Cc(cccc2)c2C1=O)=O,1 F6479-3063,CN(C)S(c(cc1)ccc1C(N(CC1)CCC1Oc(ccnc1)c1Cl)=O)(=O)=O,0 F2862-0098,NC(C(C1)N(C(CSCc2ccccc2)=O)c2c1cccc2)=O,1 Z747120294,CN(C)C(CNC(N(CCCCC1)C1c1ccccc1)=O)=O,0 F6571-3421,OCCOC1(CNC(c2cnc(C(F)(F)F)cc2)=O)CSCC1,0 Z1609949471,CC(C(N1CCCC1)=O)N(CC1)CCN1C(c1cc(O)nc(C)c1)=O,1 Z1140296148,CN(C1CCN(CC(N2CCN(C)CC2)=O)CC1)C(C(c(cccc1)c1N1C)=CC1=O)=O,1 SB91-0783,CCOc(cc1)ccc1S(N(CCN1CCCC1)C1CNCC1)(=O)=O,0 F0349-0854,CC(c(c1c2ccc(O)c1)c(C)n2-c1ccccc1)=O,0 D578-0232,Cc1cc(Nc(cc2)ccc2NS(c(cc2)cc3c2OCCO3)(=O)=O)nc(N2CCCC2)n1,1 F5871-2256,CCOc(cccc1)c1NC(NCCN(CC1)CCN1C(c1cccs1)=O)=O,0 F6606-1851,CS(N1CCC(CN(C=NC(C2CC2)=C2)C2=O)CC1)(=O)=O,1 Z4879346844,Cc(cc(cc1)-n2ncnc2)c1C(Nc1cc(CNC)ccc1)=O,1 F6190-2447,OC(CCNC(Nc1cccc(Cl)c1)=O)c1cccc2ccccc12,0 G526-0115,COc1cc(CCN(C2CC(O)=O)C(Nc(ccc(Br)c3)c3F)=O)c2cc1OC,0 C226-1708,CC(CC1)Cc2c1c(C(N)=O)c(NC(c1noc(-c(cc(cc3)OC)c3OC)c1)=O)s2,1 S698-1604,Cc1cnc(C2CCC2)n1C(CC1)CCN1C(c1cccn1C)=O,1 F3348-0499,Cc1nn2c(-n3c(C)ncc3)cc(-c3ccccc3)nc2c1-c1ccccc1,1 G765-0441,COc(cc1)cc(C2)c1OCC2NC(NCCc(cc1)cc(OC)c1OC)=O,1 F6573-3199,O=C(c1noc(C2CC2)c1)NCCOCCn1cncc1,1 F5832-8553,CN(C)S(c(cc1)ccc1C(NCCc1csc(-c(cc2)ccc2F)n1)=O)(=O)=O,0 F6525-1255,CSc(cccc1)c1C(NCCn(cc1)nc1-c1nccnc1)=O,0 S579-0391,CC(C)N(C(CCCC1)C1=C1CC(N2CCN(Cc3ccc(C)cc3)CC2)=O)C1=O,1 G855-2265,O=C(C1CCC1)N(CCC1)c(cc2)c1cc2S(N(CC1)CCC1C(N1CCCCC1)=O)(=O)=O,1 F0911-4225,O=C(c(cccc1)c1Cl)NCC1(CCOCC1)c1ccccc1,0 F0848-0023,CC1(C(CC2)C3)C2(C)C3(C(Nc(cc2)ccc2F)=O)OC1,0 F6294-0734,COc1cccc(NC(NCc2nn(C3CCCC3)c(-c3cccs3)c2)=O)c1OC,1 F6043-0685,Cc(n(C(CC1)CS1(=O)=O)nc1C)c1N(CC1)CCN1C(c1cn(C)nc1OC)=O,1 F6786-7437,FC(c1nnc(cc2)n1nc2OCC(CC1)CN1c(ncnc1)c1F)(F)F,1 F3318-0315,Cc1cc(NS(c2c(C)cc(C)c(C)c2)(=O)=O)ncc1,0 Y042-3329,COc(cc1)cc(OC)c1N(CC(C1)C(Nc(cc2)cc3c2OCCO3)=O)C1=O,0 S776-0031,Cc1cnc(C2CC2)n1CCC(CC1)CCN1C(C1CCCCC1)=O,1 Z792377264,CC(C(O)=O)c(cc1)ccc1-c1ccccc1,0 F6573-5010,O=C(NCc1cncc(C2CC2)c1)Nc1cccs1,1 F6806-4817,Cn1ncc(-c2cncc(N3CCN(Cc(ccc(F)c4)c4F)CC3)n2)c1,1 F0303-0094,CC(C)C(C(O)=O)N(C(c1c2c3cccc2ccc1)=O)C3=O,0 Z5011049403,Cc(c(CN(CC1)CCN1c1ccc(C)cc1)c1N2)nn1-c(cccc1)c1C2=O,1 Z594967942,O=C(C(CCC1)CN1c1ncccc1)Nc(cccc1)c1Oc1ccccc1,1 Z3268826611,CC(C)Cc1nnc(-c2ccncc2)[nH]1,1 SC72-0148,Cc(n(C)c(-c1ccccc1)c1)c1C(N(C1)CC11OCc2c1cnc(C)n2)=O,1 Z2952189860,CC(c1nc(C)cc(O)n1)N(CC1)CCN1c1nc(C)n[nH]1,0 F6438-3613,CN(C)c1nc(CNC(c(cc(cc2)Cl)c2OC)=O)nc(N2CCCC2)n1,0 F6530-5999,COc(nc1)ncc1-c1nc(-c(cccc2)c2Cl)no1,0 Z2960117595,O=C(CN(Cc1c2cnn1-c1ccccc1)C2=O)N(CC1)C1C1CC1,1 G938-1566,CC(C)N(Cc1cccs1)C(CN(C)S(c(cc1OC2C)c(C)cc1NC2=O)(=O)=O)=O,1 Z1359908051,Cc(cc(cc1)Cl)c1S(NCCc1nnc[nH]1)(=O)=O,0 F6568-3433,Clc1ccc(CCNc2ncnc(-n3ncnc3)c2)cc1,1 Z45685553,O=S(c1ccccc1)(Nc(cc1)cc(Cl)c1F)=O,0 Y502-6625,CCn1nccc1C(C)NC(C(CCC1)CN1S(c1cn(C)nc1)(=O)=O)=O,0 F6476-1539,O=C(CN(CCN1c2ccccc2)C1=O)N(CC1)CC1Oc(nccc1)c1Br,0 F6573-1847,Cn1ncc(-c2nccnc2CNC(C2(CC2)c(cccc2)c2OC)=O)c1,1 Z63409439,CCOC(c1c(NC(Cc2c(C)onc2C)=O)sc(C(N(C)C)=O)c1C)=O,1 E642-0924,O=C(c1ccc(Cn2c(SCc3ccccc3)nc3c2nccc3)cc1)N(CC1)c2c1cccc2,1 Z2790841223,C[C@](CNC1)(C2)[C@H]1CN2C(C(N(CC1)CC1(C)C(F)(F)F)=O)=O,1 Z2708437529,O=C(c1cn(C2CC2)nn1)NC(CC1CCCC1)c1ccccc1,1 F6564-4314,O=C(C(CCC1)CN1c1nnc(C2CC2)cc1)NCc1c[nH]c2c1cccc2,1 6401-0087,Cc1cccc(-c(n2nc(C)cc(C)c2c2N(C)C(N3C)=O)c2C3=O)c1,0 Y031-4704,CCc(cc1)ccc1N(CC(C1)C(Nc(cc2)ccc2S(N2CCOCC2)(=O)=O)=O)C1=O,0 Z2454171347,CC(Cc1cccc(F)c1)(CCC1)N1C(CN(CCCC1)C1=O)=O,1 K407-0426,COc(cc1)ccc1OCC(c(cc1OC)c(CC2)cc1OC)N2C(CCC1CCCC1)=O,1 D473-1090,CC(C)(CS(N1c(cc2)ccc2C(NCC2OCCC2)=O)(=O)=O)C1=O,1 Y031-3237,CC(C1)N(C(c(ccc(SC)c2)c2OC)=O)c2c1cccc2,0 Z982117882,Cc(ccc(-n1nnc(CO)c1)c1)c1F,0 F3386-4554,Cc1cc(S(Nc2cccc3cccnc23)(=O)=O)c(C)cc1OC,0 Z4655554338,Cn1nc(C(F)(F)F)c(NC(c2nc(N)ccc2)=O)c1Cl,0 Z2597404227,CCCC(CO)(CC1)CN1C(C(O)=O)c(cc1)ccc1F,0 Z2077226398,CN(CC(CCC1)CN1C(C1CCCCCC1)=O)S(C)(=O)=O,0 F3237-0040,COc(cc(cc1)S(NCCC2=CCCCC2)(=O)=O)c1Br,0 SB23-0964,Cc1n[nH]c([C@@](CN(C2)C(C3CC3)=O)(CC3)[C@@H]2CN3C(Cc2cscc2)=O)n1,1 V020-3995,CCc1cccc(NC(Nc2cccc(C(C(C(OC(C)C)=O)=C(C)N3C)NC3=O)c2)=O)c1,1 Z1419790164,CC1(CC1)C(NCc1noc(-c2ccco2)n1)=O,0 S694-1264,CC1(CCCCC1)C(N(CC1)CC1n1c(-c2ccncc2)ncc1C)=O,1 F2616-1086,Cc(cc1)cc(C)c1NC(C(NCCCn1cncc1)=O)=O,0 Z364046146,OC(c(cc1)cc2c1[nH]c(CC1)c2CN1C(C(CCC1)CN1C(Cc1ccccc1)=O)=O)=O,1 F5254-0236,COc1c(CCNC(CCc2csc(NC(c(cc3)ccc3F)=O)n2)=O)cccc1,1 F3407-0374,O=S(c(cccc1)c1F)(N(CC1)CCN1c1cc(-c2ccncc2)n[nH]1)=O,0 Z30755695,CCN(CC(Nc1cc(OC)ccc1)=O)C(c1cc(Cl)nc(Cl)c1)=O,0 Z422343188,Cc1noc(CCCC(N2CCCC2)=O)n1,0 Y043-1941,CC(C)n(c1nc(C2CC2)c2)ncc1c2C(Nc1nnc(COC)s1)=O,1 Z4661830658,Cc(ccn1c2nnc1)c2NC(C1c(cc(cc2)Cl)c2OCC1)=O,1 Z2774096479,Cn1nncc1-c1nc(C2(CCC2)c2cccc(Cl)c2)no1,1 Z1420008858,O=C(C(CCN1)CC1=O)NCC1(CC1)c(cc1)ccc1Cl,1 F6403-1041,COc1cccc(NC(N(Cc2cnc3n2cccc3)c2ccccc2)=O)c1OC,1 Z1055454768,Cc1nn(CC(CC2)NC(NCc(cccc3)c3-n3cncc3)=O)c2n1,1 F6515-1178,COc(cc1)cc(C(NCc2cc(-c3ccco3)ncc2)=O)c1Br,0 G856-7023,O=C(C1Oc(cccc2)c2OC1)N(Cc1cnccc1)c(sc1ccc2)nc1c2Cl,0 F6672-1150,O=S(c(cc1)ccc1Br)(N(C(CC1)C2)C1CC2n1ncc(Cl)c1)=O,0 L390-1327,CCOc(cc1)ccc1-c(n1nc2)ccnc1c2C(NCCC1=CCCCC1)=O,0 C519-0488,CN(C=C1C(NCCC2=CCCCC2)=O)c(ccc(S(N2CCOCC2)(=O)=O)c2)c2C1=O,1 Z2773244362,O=S(Cc(cc1)ccc1Br)(N1CC(CC2)NC2C1)=O,0 Z284864108,Cc(c1ncccc11)ccc1NC(c(cc1)cc2c1OCCCO2)=O,1 V030-1761,CC(C(NCc1ncccc1)=O)N(c(cc(cc1)Cl)c1C(N1c(cc2)ccc2F)=O)C1=O,1 F2199-0363,O=C(C1CC1)N(C1)CC1c1nc(CN(C(c2c3cccc2)=O)C3=O)no1,1 Z1521794315,CC(C)(C1CCCC1)C(NC1CCN(Cc2ccncc2)CC1)=O,0 L775-0442,Cc1cc(NC(N(CC2)Cc3c2n(C)nc3COCc(cc2)ccc2Cl)=O)c(C)cc1,0 Z2956529606,CC(CC1)(CN1C(CN(C=NC(c1ccccc1)=C1)C1=O)=O)O,1 F6440-4592,Cn1cnc(S(NCc2nn(C3CCCC3)c(C3CC3)c2)(=O)=O)c1,1 Z2295904951,OC(C(CNC(c(o1)ccc1Br)=O)C1CCOCC1)=O,1 Z838880488,Cc1c(CNC(C(CCC2)N2C(c(cccc2)c2OC(F)F)=O)=O)oc(cc2)c1cc2F,0 F3406-9846,CC(CC1)CCN1c1cc(-n2cnc(C(NCc(cccc3)c3OC)=O)c2)ncn1,1 F6729-7055,Cc(cc1)nnc1N(C1)CC1N(C)C(Nc1cccc(Cl)c1)=O,0 C884-0534,CN(CCCNC(Cn1c(C(N(C)N=C2)=O)c2c2c1cccc2)=O)C1CCCCC1,1 F6125-3168,Cc1cccc(NC(C(C2)CN2S(C2CC2)(=O)=O)=O)n1,1 E787-0282,Cc1csc(NC(CC(c2cccs2)N(Cc2c3cccc2)C3=O)=O)n1,1 L629-0583,CC(C(CC1)CCN1S(c1cccs1)(=O)=O)C(NCCc1c[nH]c(cc2)c1cc2Cl)=O,1 Z2014973329,O=C(CN(C=Nc1c2cc(-c3ccccc3)s1)C2=O)N(CCOc1ccc2)Cc1c2F,0 F6473-8225,CC(O1)=CC(OC(CC2)CCN2C(c2cc(Br)cnc2)=O)=CC1=O,0 Z3346914812,CC(CC1)Cc2c1nc(-c(cccn1)c1F)s2,0 F5317-0367,CN(C=C1OCc2cc(OC)ccc2)C(C(N(CC2)CCN2c2ncccn2)=O)=CC1=O,1 F6540-2951,Cn1nccc1C(CCCC1)N1C(c1cocc1)=O,1 Z1239195147,O=C(C(c(cc(cc1)F)c1N1)=CC1=O)NC1CCOCC1,1 F6481-3802,O=C(c1cc(cccc2)c2s1)N(CC1)CCSC1c1ccco1,1 F6442-0131,O=C(c(cc1)ccc1-c1cscc1)N(C1)CC1S(c(cc1)ccc1F)(=O)=O,1 G118-1314,CCCNC(N(Cc(cccc1)c1-n1c2ccc1)C2c(cc1)ccc1OC)=O,0 F6514-6997,CC(C)C(Cn1nccn1)NC(c1cc(cccc2)c2o1)=O,1 G229-0063,O=C(CC(C1)c2nc(-c3ccncc3)no2)N1c(cc1)ccc1Cl,0 F6782-7256,O=C(c1cn(CC2CCCC2)nn1)NCC1OCCC1,1 S651-0675,CN(CC1(C2)CCN(Cc3c[nH]nc3-c3cccs3)CC1)C2C(N1CCOCC1)=O,1 F6517-3706,OC(CNC(c(c(F)ccc1)c1Cl)=O)c(cc1)ccc1-c1ccco1,0 Z2971830216,C(CN1CC=CCC1)Nc1nn2c(-c3ncccc3)nnc2cc1,1 Z4098749102,CC[C@H](C)[C@H](C(NCCc1cc(OC)ccc1)=O)O,0 Z1445127318,Cc(cc(cc1)OCC(O)=O)c1NC(c1c(C(F)F)n(C)nc1)=O,0 Z2957201281,CCc1nn(C)c(CC(N(C2)CC2O)=O)c1,0 SA59-1555,O=C(CCc1c[nH]c2c1cccc2)NCCN(C1CCOCC1)C(C1CC1)=O,1 Z2138676034,O=C([C@@H](CCC1)NC1=O)Nc(ccc(Cl)c1)c1OCC(F)F,0 T482-0430,CC(C)CC(Nc1cccn2nc(C3CC3)nc12)=O,1 D271-0352,COc(cc(C(CC(N1)=O)C(C(N2)=O)=C1N=C2SCc(cc1)ccc1F)cc1)c1OCC(N)=O,0 Z1280557455,CCN(CC1)CCN1c(cc1)ccc1C(Nc1cc(C2C(C)C2)n[nH]1)=O,1 F6783-6137,CCc1nnc(cc2)n1nc2N1CC(CN(Cc2c(C)onc2C)C2)C2C1,1 F6246-2819,CN1N=C(C(CC2)CCN2S(c2cc(OC)ccc2)(=O)=O)N(C2CC2)C1=O,0 Z4488765543,COc(c(C(NC1COC1)=O)ccc1Cl)c1Cl,0 F2879-5986,CC(COC)NC(C(Nc(cc1)ccc1C(OC)=O)=O)=O,0 F5777-0186,O=C(c1c(C(F)(F)F)cccc1)Nc(cccc1)c1NC(Nc(cccc1)c1Cl)=O,0 Z1410233144,Cc1cc(N(CC2)CCC2NC(c2cn3nnnc3cc2)=O)nc(C)n1,1 Z741019126,OC(c(cc1)ccc1S(N(CC1)C1c1ccccc1)(=O)=O)=O,1 C530-0318,CCN(c(cc(cc1)C(NC2CCCC2)=O)c1S(c1c2cccc1)(=O)=O)C2=O,1 F6764-3294,FC(c1c(CN2Cc3cc4cccnc4nc3CC2)cccc1)(F)F,0 SD07-0653,CCN(CC)C(NCc1c(COC2(CN(CC(C)C)CC2)C2)n2nn1)=O,0 F6473-4466,Cc(n(C)nc1C)c1S(N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O)(=O)=O,1 Z2378720128,O=C(Cn1ncc(Br)c1)N(CCNC1)C1c1ccccc1,1 CM4557-0150,CN(C1(CCOCC1)CN(Cc(cc1)ccc1OC(F)(F)F)C1)C1=O,0 F6549-3189,O=C(Cc(cccc1)c1Cl)N1CC(Cn2ncnc2)C1,1 G620-0013,CC(CC1)CCN1c(cc1)nnc1-c1cccc(NS(c(ccc(F)c2)c2F)(=O)=O)c1,0 F6514-3204,O=C(CCC1=O)N1c(cc1)ccc1S(N(C1)CC1OCC(F)(F)F)(=O)=O,1 F6125-2626,CS(N(C1)CC1C(NCCC1=CCCCC1)=O)(=O)=O,1 F6502-2796,O=S(c(cccc1)c1Br)(NCCn1c(C2CC2)ncc1)=O,0 Z2691676420,CC(N1C(CC(N2Cc3nc(N)ncc3CC2)=O)CCCC1)=O,1 Z2227470122,CN(C(CC1)CCC1(F)F)C(CC(CCC1)CS1(=O)=O)=O,1 F0840-0013,COc1cccc(OCC(CN2CCC(Cc3ccccc3)CC2)O)c1,1 C226-3529,Cc(n(Cc(cc1)ccc1Cl)nc1C)c1NC(c1noc2c1CCCCC2)=O,1 S655-0259,CN(CC(C1)(CC2)CCN2C(c2n[nH]c3c2cccc3)=O)C1c1nnc(COC)o1,1 D003-0007,CC(c(cc1)ccc1NC(c(cc1)cc2c1snn2)=O)=O,0 Z3132303108,CCn(cc1)nc1NC(C(CC1)(c2c1c(OC)ccc2)N)=O,0 Z1870828798,CC(CN(CC1)C(c(cc2)cc(N3)c2N(C2CCCC2)C3=O)=O)CS1(=O)=O,1 F3382-6217,Cc(ccc(Cl)c1)c1N(CC1)CCN1C(CCN(C=Nc1c2[nH]c(cc3)c1cc3F)C2=O)=O,1 L299-0435,Cc(c(-c1cc(S(NC2CCCC2)(=O)=O)c(C)cc1)c1NC(CC2)=O)nn1C2=O,0 F3288-0034,C/C=C/c(cc1)cc(OC)c1OCC(CN(CC1)CCN1c(cccc1)c1F)O,0 F6540-9149,Cc1c(CN(CC2)CCC2C(F)(F)F)sc(C)n1,0 Y041-4329,CC(C)CCN(C=C(C(N(CC1)CCN1C(CC1)CS1(=O)=O)=O)c1c2cccc1)C2=O,1 F5481-2338,CCOC(c(cccc1)c1NC(CSc1nnc(C)c2c1n(-c(cccc1)c1OC)nc2)=O)=O,0 G415-2983,Cc(nc(N1CCCC1)nc1)c1C(Nc(cccc1)c1OC)=O,1 Z1614955986,CCC(C)n(c(C)c1)nc1C(Nc1cn(C)nc1)=O,0 Z4341850173,OC1(CCCC1)c1cn(CC(Nc(cc2)ncc2F)=O)nn1,1 F6672-2243,CC1=C(C)N=CN(CC(N(C(CC2)C3)C2CC3=C2CCC2)=O)C1=O,1 Z1344090350,O=C(c(cc1)nn1-c(c(F)ccc1)c1F)NCc1nnn[nH]1,0 Z3799773860,CCc1c(C(N(CC[C@@H]2CC3)[C@]23c2nnc(COC)o2)=O)scc1,0 Z1583788841,Cc(cc1)cc(CC2)c1N2C(CCN(c(cccc1)c1C(N1)=O)C1=O)=O,0 Y050-2220,CCOc(ccc(S(N(CCC1)CC1C(NC(C)COC)=O)(=O)=O)c1)c1Cl,0 SD62-0304,O=C(CCC(C1)C2(CCC2)CN1C(c1cocc1)=O)N1CCCC1,1 Z1066488738,O=C(C(CC1)CCN1c1nc(cccc2)c2s1)NCC1CCCCC1,1 F6720-2089,O=S(Cc1ccccc1)(Nc(cc1)ccc1SC(F)(F)F)=O,0 SC65-0413,CC(C)CN(C[C@](C1)(C2)[C@H]1C(N(Cc1cccs1)C1CCCC1)=O)[C@@H]2C(NC)=O,1 SC02-0636,Cc1ccc(C(N(CC2)CC2(CCOC)NS(C)(=O)=O)=O)s1,0 Z1745458591,CCCN(CCN(C1(C)C)C(CC2=C(C)Nc3ccnn3C2=O)=O)C1=O,0 Z2897185277,OC(c(cc1)cc2c1[nH]c1c2CN(Cc2cnc(C3CC3)nc2)CC1)=O,1 Z1272649127,CC(c1cc(-n2cncc2)ccc1)Nc1cc(-n2cncc2)ncn1,1 F6245-6445,CN(C(c1ncccc1)=NN1CCNC(c2cc(ccc(OC)c3)c3[nH]2)=O)C1=O,1 Y043-3686,Cc1nc(N(CCC2)CC2C(Nc(cc2)cc3c2n(CCCN(C)C)cn3)=O)nc(C)c1,1 Z1785645778,Cn1nccc1C(N(CC1)CCC1c(cccc1)c1C(O)=O)=O,0 Z1441098227,CCn1ncc(C(Nc2cc(-c3ncco3)c(C)cc2)=O)c1,0 F2795-0453,O=C(C(Nc(cc1)cc(Cl)c1F)=O)NCc(cc1)cc2c1OCO2,0 F3088-2315,COc(cccc1)c1NC(c1ccc(COc(cc2)ccc2Cl)o1)=O,0 Z1097875404,CN(C)C(CC1)CN1C(NC1CCN(CCc2ccccc2)CC1)=O,1 G730-0904,CC(Cc1ccco1)NC(c(cc1)cc2c1n(CCCCC1)c1n2)=O,1 F6502-6306,Cc1cc(-c2ccncc2)nn1CCNC(c1cocc1)=O,1 Z2387481329,CN(Cc1cc(C2CCNCC2)no1)Cc(cc1)ccc1F,0 Z1882857589,CC(C(Cc(ccc(Cl)c1)c1F)Sc1nnc(NC)s1)=O,0 S997-1268,COC[C@](CN(C1)S(C)(=O)=O)(CC2)[C@H]1CN2S(c1cccc2nsnc12)(=O)=O,1 Z954490364,CC(c1nc(C)no1)NC(c(cc(C)cc1)c1O)=O,0 G008-3179,O=S(c1ccc(-c2noc(C(F)(F)F)c2)s1)(N1CN(Cc(cc2)ccc2F)CCC1)=O,1 SB91-0599,CN(C)S(N(CCN1CCCC1)C(CC1)CN1C(NCCc1ccccc1)=O)(=O)=O,1 Z1267820012,CCc1cc(NCCCC(O)=O)nc(C)n1,0 Z2965749883,O=C(c(cc1)ccc1-n1cnnc1)N1C[C@H](CCC2)[C@H]2C1,1 Z954440202,CC(CCC1)CN1c1nccc(C(N)=O)c1,0 F6192-0577,CN(C)c1cccc(C(NCC(c2ccco2)c2cccs2)=O)c1,0 F5125-0028,Cc(cc1NC(c2ccco2)=O)nn1-c1ccccc1,1 Z2964850656,Cn1ncc(C(N(C2)CC2N(CCC2)C2=O)=O)c1Cc1ccccc1,1 K284-0554,O=C1N(CCC2=CCCCC2)C(SCc2csc(cc3)c2cc3Cl)=Nc2c1cccc2,1 S692-0808,Cc1cnc(C2CC2)n1C(CCC1)CN1S(Cc1ccccc1)(=O)=O,1 Z2897740226,CC(C1)(CC1(F)F)C(N(C[C@H]1COC2)C[C@]12C(O)=O)=O,1 Z4662013103,CCCN(C1CCN(Cc2ccccc2)CC1)C(Nc1nccs1)=O,0 Z1331851853,CC(C)C(CNC(c1cc(-c2nnc(C)o2)ccc1)=O)Nc1ccccc1,1 F2814-1650,COc(cc1)ccc1S(CCCC(N(CC1)CCN1c1ccccc1)=O)(=O)=O,1 F6442-2834,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)N(C1)CC1S(c(cc1)ccc1Cl)(=O)=O,1 Z2327573908,OCC(CN(CC1)c(cc2)ncc2C(O)=O)C1O,0 SB42-0537,CN(C[C@H](CN1CCCOc(cc2)ccc2F)N([C@H]2Cc3ccccc3)C1=O)C2=O,1 Z2066031941,OC(C(CNS(c1cocc1)(=O)=O)Oc(cc1)ccc1F)=O,1 F6526-0154,CN(CC(N1Cc2cc(C3CC3)nn2CC1)=O)S(C)(=O)=O,0 D306-0421,Cc1nc(CCC2)c2c(SCC(Nc2nc(CCCC3)c3s2)=O)n1,1 F6559-0593,CC(C)n1cnc(S(N(CCC2)CC2N(C=Nc2c3cccc2)C3=O)(=O)=O)c1,1 Z1104770915,CC1CCN(CC(CCC2)CN2C(Nc2cnc(C(C)(C)C)nc2)=O)CC1,1 Z2951848009,CCN(C(CN1Cc2c[nH]nc2C(C)C1)=O)c1ccccc1,0 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F6550-1527,O=C(C1(CCOCC1)c1ccccc1)N(C(CC1)C2)C1CC2F,1 S904-1253,CC(C)C(N1Cc2nnc([C@H](C3)N(Cc(cc4)ccc4Cl)C[C@H]3O)n2CC1)=O,0 F6515-4483,O=C(C1OCCC1)NCc1cc(-c2cccs2)cnc1,1 F6727-5735,O=C(C=C1)N(C2CCN(CCn3nccn3)CC2)N=C1c1ccccc1,1 F6510-3173,CC(C)(C(Nc(cc(c(N1C)c2)N(C)S1(=O)=O)c2F)=O)Oc(cc1)ccc1Cl,0 Z4497727222,OC(CC1C(NCCN(Cc(cccc2)c2OC2)C2=O)=O)CN1C(Cc(cccc1)c1F)=O,1 F5097-2463,CN(C=CC=C1C(Nc2ccc(CC(NCC(F)(F)F)=O)cc2)=O)C1=O,0 C762-0251,Cc(cc1)cc-2c1OCc1c2n(CC(N(CC2)c3c2cccc3)=O)nc1,1 Y031-0705,O=C(C1OCCC1)N(CC1)CCN1C(c1ccco1)=O,1 Z1551901839,OC(CN(CC1CC1)C(c(cc1)cc(Cl)c1F)=O)=O,0 CM4556-7525,Cn1cnc(S(N2CC3(CCOCC3)N(Cc3cc(F)ccc3)CC2)(=O)=O)c1,1 F6562-4125,CN(C)c1nc(CCC(C2)NC(C3c(cccc4)c4Oc4c3cccc4)=O)c2cn1,1 S637-2524,Cc1nnc(CC2)n1CCC2NC(c1cnco1)=O,1 SA44-0657,CN(CC(C1)(CN1C(COc1ccccc1)=O)C1)C1c1nnc(C2CCOCC2)o1,1 Z1270794774,Cc1c(CN(C)S(c(ccc(Cl)c2)c2C#N)(=O)=O)cccc1,0 F2442-0665,Cc1c(C(N(CC2)CCN2c2nc(C)nc(OC)c2)=O)sc(C)n1,0 Z1675212728,OC(c1coc(C(Nc(cc2)ccc2C(N2CCCCCC2)=O)=O)c1)=O,1 F6515-1429,O=C(C1(CC1)c(cc1)ccc1F)NCc1cc(-c2ccco2)ncc1,1 F6451-3611,COC(CNC(Nc1cccs1)=O)c1ccco1,0 Z2140570831,O=C(C(c1c2cccc1)=CNC2=O)N(CC1CC(COC2)NC2=O)c2c1cccc2,1 SC10-1228,CC(C)C(N(CCCN1CCCC1)C(CC1)CN1C(Nc(cc(cc1)OC)c1OC)=O)=O,0 D470-1805,Cc(cc1)ccc1S([C@@H](CS(C1)(=O)=O)[C@H]1NC1CC1)(=O)=O,0 Z2962539650,Cn1ncc2c1N=CN(CC(N(CC1)CCC1(C1CCC1)O)=O)C2=O,1 Z2297191103,CN(C)C1(CCC1)C(N(CC1)CCN1c1cccc(F)n1)=O,0 F6553-0897,O=C(COc(cccc1)c1F)N(CC1)CC1c(cc1)cc2c1OCC2,1 L127-0298,CC(C)CCN(CCS(N1CCNCC1)(=O)=O)S(c1ccc(C2CCCCC2)cc1)(=O)=O,1 Z2897185324,OC(c(cc1)cc2c1[nH]c1c2CN(CC(C2)Cc3c2cccc3)CC1)=O,1 F2505-0180,Cc(cc1)c(C)cc1NC(C1(CCOCC1)c1cccs1)=O,1 F0596-0010,O=C(CSc1ncnc2c1oc1c2cccc1)N(CCC1)c2c1cccc2,1 Z1838188157,CCC(C(O)=O)N(CC1)CCN1C(C)c1nc(C)no1,0 Z2095852714,CC(Nc(s1)ncc1S(N(C)C1CCCC1)(=O)=O)=O,1 F5069-0261,CCOc1cn(-c(cc2)ccc2F)nc1C(NC1=NCCS1)=O,1 SC69-0730,COc(cc1)cc(C(N(C2)CC3(CCCC3)C2c2nncn2C2CC2)=O)c1Br,0 Z2482908961,CCCS(NC1CCN(Cc(cc(cc2)C(O)=O)c2Cl)CC1)(=O)=O,0 Z2965351977,Cc(cc1)cc(CC(N[C@@H]2c(cccc3)c3OC[C@@H]2CO)=O)c1OC,0 Z2331938604,CNc(cccc1)c1C(N(CCC1)CC1N(CCC1)S1(=O)=O)=O,0 Z2271014441,CN(C)c1nc(N2CCN(CCO)CC2)nc2ccccc12,0 D450-0757,Cc1cc(C)nc2nc(N(Cc(cc3)cc(OC)c3OC)S(c3ccccc3)(=O)=O)nn12,0 F6454-2300,Cc1nccc(N2CCC(CNC(C3CCOCC3)=O)CC2)c1,1 F6560-5133,CC(C)C(Cn1nncc1)NS(c1c(C(F)(F)F)cccc1)(=O)=O,0 F0777-2178,CC(c1ccccc1)NC(C(c1ccccc1)c1ccccc1)=O,0 F980-0680,CC1Oc(cccc2)c2N(CC(N(CC2)CCN2C(C=C2)=NN(c3ccccc3)C2=O)=O)C1=O,1 8017-8328,CN(C(C1)=O)c(cc2)c1cc2S(Nc(cc1)ccc1N1CCOCC1)(=O)=O,1 Y040-1260,O=C(COc(cc(c(C1=C2CCC1)c1)OC2=O)c1Cl)NCC1OCCC1,1 Z2638490542,Cc1c(CNC(CC(CC2)CCN2OC)=O)sc(cc2)c1cc2Cl,1 G870-0440,CCOc(cc1)ccc1-c(cc1)nnc1OCCNC(C1CCCC1)=O,1 Z2444671605,Clc(cc1)cc(CN2CCNCC2)c1OCc1cnccc1,0 L282-0587,CCCc(c(C)nc1ncnn11)c1Sc(cc1)ccc1NC(Nc(cc1)cc2c1OCCO2)=O,1 F1757-0091,O=C(N1CCOCC1)N(CCC1)CCN1C(N1CCOCC1)=O,1 F2774-0996,COc(cccc1)c1C(C=C1)=NN(Cc2ncccc2)C1=O,1 F2258-0248,CC(C)NC(Cn1c(SCC(Nc(ccc(F)c2)c2F)=O)ncc1CO)=O,0 Z1547475710,CC(c1cnccc1)N(CC1)CCN1C(C(CC1)CC(C)C1=O)=O,1 Z1857158151,CC1(CC1)C(NS(c1cccc(Cl)c1Br)(=O)=O)=O,0 SC09-0507,C[C@@H]1N(Cc(cc(cc2)Br)c2F)Cc(cc(cc2)-c3cnccc3)c2OC1,1 C259-1375,CCC(N(CCc1c2)c1cc(S(N(CCC1)CC1C(NCCN1C(C)CCCC1)=O)(=O)=O)c2Br)=O,1 C470-0179,Cc1c(Cn2c(C(N(C)C(N3C)=O)=O)c3nc2CN2CCN(C)CC2)cccc1,0 Z2254568688,CCOc1c(C(C)NC(c2cc(C(F)(F)F)nn2C)=O)cccc1,0 Z2976202935,Cc1nc(NC(CC2)CC3(CCC3)S2(=O)=O)nc(OC)c1,1 8004-8173,CCCCCN(CCC1)C1C(Nc1c(C)cc(C)cc1C)=O,0 SC08-0074,CS(N(CC1)CCC1c1noc(C(C2)CN2C(COc2ccccc2)=O)n1)(=O)=O,1 G869-1242,Cc1nc(Nc(cc2)ccc2NS(c(cc2)ccc2-c2ccccc2)(=O)=O)nc(N2CCCC2)c1,1 F6507-5396,CC(CNC(c1c(C)n(C)nc1C)=O)(COC)OC,0 F5017-3792,CS(NCC(CC1)CCN1C(c(cccc1)c1F)=O)(=O)=O,0 Z4025996140,OCC(CN(CC1)c2nn3c(-c4cnccc4)nnc3cc2)C1O,1 F6502-5934,O=C(Nc1cn2nccc2nc1)Nc(c(F)ccc1)c1F,0 F5857-3430,Cc1cc(C(NCC(C(F)(F)F)(c2ccccc2)O)=O)c(C)o1,0 S049-0534,COCc1nc(-c(cc2)ccc2OC(CC2)CN2S(c(cc2)ccc2OC)(=O)=O)no1,0 F6514-4083,O=C(c(cc1)cnc1OC1CCCC1)N(C1)CC1n1nnc(COc2ccccc2)c1,1 Z1167642921,Cc1c(CC(N(CC2)CCN2C(c2c[nH]cc2)=O)=O)cccc1,1 Z3060011743,Cc1n[nH]c(CC(Nc2nn(CC(F)F)c3c2cccc3)=O)n1,1 F6806-6766,O=C(C(C1)OCCN1c1ncnc2c1nc[nH]2)N(CC1)CCC1(F)F,1 Z1770880932,CC(C(N(CCC1)CC1C(N)=O)=O)N(C)CC1(CC1)c1ccccc1,1 Z4890206667,CC(C(Nc(cc1)cc2c1N=CN(C)C2=O)=O)c1cscc1,1 Z1417586329,Cc1cc(NC(N(CC2)CCc3c2cccc3)=O)cnc1Cl,0 F2738-0043,Cc1cccc2c1nc(N(Cc1ncccc1)C(c(s1)ccc1Cl)=O)s2,0 C200-3174,Cc(cc1)cc2c1n(C)c(C(N1Cc3ccccc3)=O)c2N(CC(NCc2ccco2)=O)C1=O,1 F6476-6067,O=C(c1cc2c(-c3ccccc3)onc2cc1)N(CC1)CC1Oc(ccnc1)c1Cl,1 Z1357399942,Cc(n(CCOC)nc1C)c1NS(c(ccc(C(O)=O)c1)c1F)(=O)=O,0 D389-0020,CN(c1c(C(N2CCN3CCOCC3)=O)n(CCCN3c4ccccc4)c3n1)C2=O,0 Z4767998488,NC(c(sc1c2cccn1)c2NC(c(cc1)ccc1Cl)=O)=O,1 SA49-0345,O=C(COc1ccccc1)N(C1)CC11OCC(CC(N2CCCC2)=O)C1,1 C301-9587,O=C1Oc(cccc2)c2C(NCC2CCCCC2)=C1NS(c1cccc2nsnc12)(=O)=O,1 F6451-0065,COC(CNC(c(cccc1)c1Cl)=O)c(cccc1)c1OC,0 Z2997521822,CC(C1CC1)(c1nc(-c2ccc(C3(CC3)S(C)(=O)=O)cc2)no1)O,1 Z3188069236,Cc1c(C(CC2)CN2C(Cc(cc2)c(C)cc2O)=O)cccc1,0 F6554-5926,COC(C(C1)C1(CC1)CCN1C(COc(cc1)ccc1Cl)=O)=O,0 F6775-2494,Brc1cc2cnc(N3CC(COc4nccnc4)CCC3)nc2cc1,1 F6230-0236,O=C(CN(c(cccc1)c1O1)C1=O)NCc1c(cccc2)n2nc1,1 F2879-7426,O=C(C(NCc(c(F)ccc1)c1F)=O)NCc(cccc1)c1Cl,0 Z3138316188,CCn1ncc(CC(NC(C2)C3(CCC3)C2N)=O)c1,1 Z1526806710,Cc1cnc(N(CC2)CCN2C(CN(C)C)=O)nc1,0 F5614-0201,CCOC(CCC(N1CCN(Cc2nc(cccc3)c3[nH]2)CC1)=O)=O,0 F6512-0626,CCCCOc(cc1)ccc1C(Nc1cc2ccnn2cc1)=O,0 F3406-9851,O=C(c(nc1)cn1-c1ncnc(N2CCOCC2)c1)Nc(cc1)cc2c1OCCO2,1 F6789-6545,Cc1nc(C2CCOCC2)cc(N(CC2)CCN2c(cccc2)c2Cl)n1,0 P114-1585,CC(C)n1c(nccc2)c2c(C(CC2)=CCN2C(Nc(cc2)cc(Cl)c2OC)=O)c1,0 Z1032586234,CN(C)C(c1cccc(NC(N[C@H]([C@@H](C2)O)c3c2cccc3)=O)c1)=O,0 S543-0618,CC(C)NC(N(C1CC1)C1CC(CC2)(CCN2C(c2ccco2)=O)OCC1)=O,1 Z2595768500,OC([C@H]([C@@H]1C[C@H]2CC1)[C@H]2NC(C(CC1)CCN1C(N1CCCC1)=O)=O)=O,0 L287-0063,Cc1nc(-c2csc(S(N(CC3)CCN3C(c3ccccc3)c3ccccc3)(=O)=O)c2)no1,1 F6681-8634,Cn(cc1C(N2CC(COc(nc3)ncc3Br)CCC2)=O)nc1OC,0 F6436-2764,CCCN(Cc1cscc1)C(Cc1cscc1)=O,1 F6656-1553,CC(C=C1)=NN(CC(C2)CN2C(c(cc2)ccc2N(C)C)=O)C1=O,0 Z2378372708,CC(C)C(CC1)CN1C(C(N(C1)[C@@H](COC2)[C@@H]2C11CCNCC1)=O)=O,1 Y041-3645,CC(c(cc(c(-c(cc1)cc2c1OCCO2)co1)c1c1C)c1O1)=CC1=O,1 F6411-2068,CCOC(C(CC1)CCN1C(N1CC(Nc(c(C)ccc2)c2Cl)=O)=NC(C)=CC1=O)=O,0 Z756450352,OC[C@@H](C(O)=O)NC(C1CC=CCC1)=O,0 Z1479360845,COCCC1(CC1)C(N1CCC(C2)(CNC2=O)CC1)=O,1 Z1323747769,Cc1nc(-c(cc2)ccc2S(NC(Cc2cn(C)nc2)=O)(=O)=O)co1,1 Z1601842182,C[C@@H](CN(CC1)C(NCC2COCCC2)=O)N1S(C)(=O)=O,1 F1673-5903,CCOc1cccc(C(C(C(c2ccco2)N(CCCN(C)C)C2=O)=C2O)=O)c1,1 Z1974735162,COCc1cc(C(N[C@H](C2)C[C@@H]2c2ccccc2)=O)no1,1 S689-1125,O=C(C(C1)CN(C(C2)CN2S(c2cccs2)(=O)=O)C1=O)NCC1CC1,1 F5526-0237,Cc1cc(OCCNC(COc(cc2)ccc2Cl)=O)cc(C)c1,0 F5530-0948,CC(N1c(cc2)ccc2Cl)=Nc(ccc(NC(c2ncccc2)=O)c2)c2C1=O,1 S994-0004,Cc1nc(S(N(CC2)CCN(CCN3)C2C3=O)(=O)=O)cn1C,1 D575-0038,Cc(cc1)ccc1Nc1nc(C)cc(N(CC2)CCN2S(c2ccc(C)cc2)(=O)=O)n1,0 Z1465945942,CC(C1)OC(C)CN1C(Cn1ncc(NC(c(cc2)c(C)cc2F)=O)c1)=O,0 M034-4781,O=C(Nc(cc1)cc(Cl)c1F)N(CC1)CCN1c1ncccc1-c1nnc(C2CC2)o1,1 Z1368918384,Cc1c(C(NC(CC2)CCC22CCOCC2)=O)nc(-c2cccs2)o1,1 F0840-0129,OC(CN(CC1)Cc2c1cccc2)COCc(cc1)ccc1Cl,0 Z4070342529,CC(C)(CNc1ncnc([nH]2)c1cc2Br)O,0 Z2358896633,CCOC(C)(CC1)CCN1S(c1c2OCCCn2nc1)(=O)=O,0 F3375-2769,COc(cc1)cc(NC(C2=Cc3cc(Cl)cc(OC)c3OC=C2)=O)c1OC,0 F6727-5051,Cc1nc(S(N2CCC(COc3ncnc(-c4ccccc4)c3)CC2)(=O)=O)cn1C,1 F6412-1824,O=C(c1ccco1)NCC#CCOc1cccc(C(F)(F)F)c1,0 L383-0914,Cc1cc(N(CC2)CCN2c(cc2)nnc2SCC(N2c(cc(C)cc3)c3OCC2)=O)c(C)cc1,1 Y043-3459,O=C(C(C1)CN(Cc2ccco2)C1=O)Nc(cc1)cc(CO2)c1C2=O,1 L381-0653,O=C(CSc(cc1)nnc1N(CC1)CCC1C(NC1CC1)=O)NCCc(cc1)ccc1Cl,1 D337-1076,CC(C1)Oc(cc2)c1cc2-c1cc(C(Nc(cccc2)c2C(c2ccccc2)=O)=O)no1,1 S740-0270,COCCCN(C([C@H](C[C@@H](C1)NC(COCc2ccccc2)=O)N1CC1)=O)S1(=O)=O,0 F6810-2297,CN(c1c(N2C)ncnc1N1CCSCC1)C2=O,1 D487-0031,Cc1c(-c(cc2)cc(N3)c2OCC3=O)nc(NC(c(cc2)ccc2S(N(C)C)(=O)=O)=O)s1,0 F0149-0068,O=C(COc(cc1)ccc1Oc1ccccc1)NCc1ccco1,1 Z2394616731,CC(CN)(CC1)CN1C(C(C(C=C1C)=O)=NN1c1cccc(C(F)(F)F)c1)=O,0 S664-0261,Cc1noc(C)c1S(N(CC1)CCC1(CC1)C1OC)(=O)=O,0 V001-2265,O=C(c1nn(CCN(Cc(cccc2)c2Cl)C2=O)c2c1)NC(Cc1ccccc1)c1ccccc1,1 T408-0063,CC(CC1)CCN1C(c1cc(CC(CC2)C(NCCOC)=O)c2s1)=O,0 Z2957962848,COC(C(N(CC1)Cc2c1cn[nH]2)=O)c1c(C(F)(F)F)cccc1,0 P666-2369,CCC(n1c2cc(S(N3CCC(Cc4ccccc4)CC3)(=O)=O)c1)=NN(C)C2=O,0 Z1391351756,Cc(cc1)nc2c1oc(C(N(C)CC(C1CC1)O)=O)c2,1 D503-0415,Cc(c(-c1ccc(C)cc1)nn12)c2nc(C)cc1N1CCN(Cc(cccc2)c2Cl)CC1,0 Z2204962343,COc(cc1)ccc1-c1n[nH]cc1C(N1C(C2CC2)C2(CCC2)C1)=O,1 Z1492963072,CC(CCC1)CCN1C(C1Cc2cncn2CC1)=O,1 F6616-1866,COc(cccc1CN(C(CC2)C3)C2CC3O)c1Cl,0 G411-0154,Cc1c(C(NC(C(Oc2c3cccc2)=O)=C3NC2CCCC2)=O)c(-c(cccc2)c2Cl)no1,1 F1907-0012,CC(C)(C)OC(N(CC(C1)(F)F)C1C(O)=O)=O,0 F6606-5343,O=C1N(CC(CC2)CCN2c2ncnc3c2cc[nH]3)C=NC=C1,1 F5832-2659,O=C(NCC(c1cccs1)N1CCOCC1)Nc1cccs1,1 Z1999542245,NS(C(CC1)CCN1C(NCCc1ccco1)=O)(=O)=O,1 Z1177410741,CC(c1cccs1)NC(c1c(C)oc(NC(N2c3ccccc3)=O)c1C2=O)=O,1 F6805-9831,NC(c1nccc(N2CC(COc(nccc3)c3Cl)CCC2)c1)=O,1 Z2214132724,N#CC(C1)CN1S(c(cc1)ccc1N(C1=O)N=CC(Cl)=C1Cl)(=O)=O,1 F5860-4401,COc1cc2cccnc2c(NC(NCC=C)=O)c1,0 F6438-0129,Cc1nc(N2CCOCC2)nc(C)c1NC(c1cnccc1)=O,1 F413-0350,Cc1c(CSC(N2Cc3ccco3)=Nc(cccc3)c3C2=O)nc(-c(cc(cc2)Br)c2OC)o1,0 F6764-1697,CC(C1)OC(C)CN1C(CN(CC1)CCC1c(ccc1c2)nc1ncc2-c1ccncc1)=O,1 S699-0885,CN(CCc1noc(C(C2)CN2C(C2CCC2)=O)n1)C(C1CCOCC1)=O,1 F6801-7965,Cc1nc(n(C)nc2)c2c(N(C)Cc(cc2)cc3c2OCCO3)n1,1 T655-0422,O=C(NCc1ccco1)N(C1)CC2(CCOCC2)C1c1nnc(-c2ccncc2)o1,1 Z2062775776,O=C(CCN(CC1)CCN1C(Cc1ccccc1)=O)N1c(cccc2)c2OCC1,1 F6748-8262,Cn(cc1)c2c1c(N1CC(COc(nccc3)c3Cl)CCC1)ncn2,1 F6190-0115,CC(C)Oc(cc1)ccc1C(NCCC(C1CC1)O)=O,0 F6561-7576,O=C(C1CC=CCC1)NC1CN(Cc2cscc2)CC1,1 F2539-1033,CN(C)S(c(cc1)ccc1C(NC(CC1=O)CN1c(cc1)ccc1Cl)=O)(=O)=O,0 Z1527574718,Cc1c(CCC(NCc2c(CN(C)C3CCCCC3)cccc2)=O)cnn1C,1 F6514-1964,CC(N1CCNC(C2(CC2)c(cc2)ccc2F)=O)=CC(OC)=CC1=O,1 F6481-3722,Cn1nnc(C(N(CC2)CCSC2c2ccco2)=O)c1,1 F1433-0016,Cn1c(SC(CCCC2)C2NS(c2ccccc2)(=O)=O)nnc1,1 F6435-1514,CS(C(CC1)CCN1C(C1Oc(cccc2)c2OC1)=O)(=O)=O,1 Z4882105511,O=C(C1CCOCC1)Nc1nnc(CC2CCCC2)o1,1 Z2607622416,CC(C)(C1)C1(C(NCc(cc(c(OC)c1)OC)c1Br)=O)C(O)=O,0 SB57-1566,Cc1noc(C)c1C(N(C1)CC1(CN(C1)S(C)(=O)=O)C1c1nc(C2CC2)no1)=O,1 L155-0284,Cc1ccnc(N(CC2)CCC2C(NCCCN(C)c2ccccc2)=O)n1,1 Z2903056449,O=C(Nc1cc(Br)c2)Nc1c2-c1nc(Cn2c(cccc3)c3nc2)no1,0 Z1784251394,Cc1nccc(N(CC2)CCN2C(C(C2CCCCC2)O)=O)n1,1 S932-7532,Cn1nc(C(N(CC2)CC2n2nnc(COCc3ccccc3)c2)=O)c2c1cccc2,1 D396-0161,CC(C)(Cc1c2C#N)OCc1c(N1CCOCC1)nc2SCC(NCc1ccco1)=O,1 Z1816610527,O=C(C(c1c2cccc1)=CNC2=O)NC(CCC1)CN1c1ncnc(N2CCOCC2)c1,1 F6474-3351,O=C(Nc1ccc(C(F)(F)F)cc1)N(CC1)CC1Oc1cccc2cccnc12,0 F6415-0188,COCCN(Cc1cocc1)C(C1c(cccc2)c2Oc2c1cccc2)=O,1 H030-0029,CN([C@]1(COCC1)C(N1c(cc2)cc(C(F)(F)F)c2C#N)=O)C1=O,0 F0674-0028,Cc1cccc(NC(CSc2ncnc3ccccc23)=O)c1C,0 Z1572375145,O=C(c1cc2ccccc2cc1)NC1CN(Cc2cncnc2)CCC1,1 G229-0169,COc(cc1)ccc1N(CC(C1)c2nc(-c(ccc(OC)c3)c3OC)no2)C1=O,0 F6807-7110,N#Cc(cc1)ccc1N(CC1)CCN1c(cccc1)c1F,0 Z5009675880,Cn1c(cc(cc2)NC(c3nc4ccccc4nc3)=O)c2nc1,1 F3088-3238,O=C(c(cc1OCCOc1c1)c1Br)Nc(cc1)cc(C(F)(F)F)c1Cl,0 F6416-6595,OC(CCNC(c(o1)ccc1Br)=O)c1cscc1,0 F6608-2754,Cc1cccc(CN(CC2)CCC2Oc(nc2)ncc2Br)c1,0 Z2910633449,CCC(CC)(CC(O)=O)NC(c1nnc(C)cc1)=O,0 F5251-0109,O=S(c1cc(CCCC2)c2cc1)(N1CCN(Cc2nnnn2-c(cc2)ccc2F)CC1)=O,1 F6452-1071,CC(CNC(c1cccs1)=O)(c1cccc(Cl)c1)OC,0 F6469-1690,CN(C(C=C1)=O)N=C1C(Nc(cccc1)c1-c1cn(cccc2)c2n1)=O,1 F632-0122,Cc1cc(NC(C(CCC2)N2S(c(cc2OC3)c(C)cc2NC3=O)(=O)=O)=O)cc(C)c1,0 Z1625180960,CC(C(C(N1CC(Cc2ccccc2)CC1)=O)NC(C1CC1)=O)O,0 F6472-2949,O=S(c(cccc1)c1Br)(N(C(CC1)C2)C1CC2n1nncc1)=O,0 F6619-6845,Cc1cc(CN(CC2)CCN2c2nc(C)nc(-n3nccc3)c2)no1,1 SA71-0964,Cc1nc(C(CC2CC2)(CCC2)CN2S(c2cc(CCC3)c3cc2)(=O)=O)no1,1 F5831-6951,O=C(CSc(cc1)ccc1F)NCC1CCN(Cc2cccs2)CC1,1 F6237-2235,O=C(c1nn(-c(cc2)ccc2Cl)nn1)NCc1ccncc1,1 F6559-0430,COc1cccc(-c2n[nH]c(C(N(CCC3)CC3N(C=Nc3c4cccc3)C4=O)=O)c2)c1,0 SD25-0573,O=C(CCC(CN(C1)C(c2cncnc2)=O)C11CCCCC1)N1CCOCC1,1 V030-6632,O=C(CCN(C1CC1)c1nc(-c2cccc(Br)c2)nc2ccccc12)N1CCCC1,1 Z3583911935,CC(CCC(NCC(C(F)F)n1nccc1)=O)(CC1)NC1=O,1 F6573-2458,COc(ccc(CNC(NCc1nccnc1-c1cnccc1)=O)c1)c1OC,1 L840-0506,O=C(c1nnc(-c2csc(S(NCC3OCCC3)(=O)=O)c2)o1)N1CCCCC1,1 Z1412159375,Cc1coc(-c2cccc(NC(CC(F)(F)F)=O)c2)n1,0 C880-0922,CC(CNC(CN(C1=O)N=Cc2c1n(Cc1c(C)cccc1)c1c2cccc1)=O)c1ccccc1,1 F6550-6812,O=C(c1cnc(C(F)(F)F)cc1)N(C1)CC1Nc1ncncc1,0 Z1149859746,O=C(C(c1ccccc1)Oc(cc1)cc(Cl)c1Cl)NCC(CC1)CN1C1CC1,1 S427-0049,Cn1cnc(S(N2CC(Cc3noc(C4CC4)n3)CCC2)(=O)=O)c1,1 F6151-0178,O=C(C(CCC1)CN1c(cc1)nnc1-n1cncc1)N(CC1)CCN1c1ncc(C(F)(F)F)cc1,1 Z737688642,Cc(cc1)ccc1NS(c(c1ccccc11)ccc1OC)(=O)=O,0 Z2482867323,OC(C(c(cccc1)c1F)N(CC1)CCC1c1c[nH]c2c1cccc2)=O,0 Z4135141320,CC(c1noc(Cn2nccn2)n1)Oc(ccc(Br)c1)c1Cl,1 F6441-5482,CSC(CC1CC2)CC2N1C(CCc(c(F)ccc1)c1Cl)=O,0 Z4774907327,OC([C@@H](C1)CNC[C@H]1C(F)(F)F)=O,0 F5381-0015,CC(c(cc1)ccc1N(CC1)CCN1S(CCN(C(CCC1)=O)C1=O)(=O)=O)=O,0 F5831-9126,O=C(CSCc1ccccc1)NCC1(CC1)c(cc1)ccc1F,1 Z1278749687,OC(c(cc1)cc(F)c1S(Nc(c(O)ccc1)c1F)(=O)=O)=O,0 F5772-7374,CC(C)n(cc1)nc1C(NCc1cn(cccc2)c2n1)=O,1 F5897-0242,O=C(c1cscc1)Nc1cccc2ccc(-n3cncc3)nc12,1 Z2311325627,CC(C)(C)c1nc(CNC(N(C)C2CC2)=O)n[nH]1,0 Z1522268796,COc1ccc(Cn2ncc(C(N[C@H]3CC[C@H](CO)CC3)=O)c2)cc1,1 S720-0748,Cc1ccc(C(N(C[C@H](C2)Oc3ccccc3)[C@@H]2C(N2CCCC2)=O)=O)s1,0 S722-0875,N#Cc(cc1)ccc1S(N1CCC(Cc2ccc(CN3CCOCC3)cc2)CC1)(=O)=O,0 F2487-0038,CC(C)(C(NCC1)=O)N1C(c(s1)ccc1Cl)=O,0 S986-0127,CN(C)C[C@](CN(Cc1ccccc1)C1)(C2)[C@H]1CN2C(c1nccnc1)=O,1 Y041-9034,O=C(CCC(C(Nc1c2cccc1)=O)NC2=O)NCc(c(F)ccc1)c1F,1 F6125-0040,COc(ccc(Cl)c1)c1NC(C(C1)CN1C(c1nccnc1)=O)=O,0 F6442-4285,Cc(nc1oc(-c2ccccc2)nc1c1)c1NC(c1c(C(F)(F)F)cccc1)=O,0 Z2256366522,CCn1ncc(C(NCC(C(O)=O)c(cc2)ccc2F)=O)c1,0 Z4025040806,O=C1NCc2nccc(N(CC3)CCC3c3ncc(-c(cc4)cc(F)c4F)[nH]3)c12,1 F3395-0281,FC(c1cc(N(CC2)CCN2C2CCN(Cc3nc(cccc4)c4o3)CC2)ccc1)(F)F,1 F6245-0050,O=C(Cn1cccc1)N(CC1)CCC1c1nnc(-c(cc2)ccc2F)o1,1 Z749650864,Cn1ncc(CCC(N(CC2)Cc3c2[nH]c(cc2)c3cc2Cl)=O)c1,1 Z3686126653,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NCc(cc1)ccc1Oc1nccnc1,1 Z2120399216,COC([C@H](CNC(c(cc1)ccc1-c1noc(C(F)F)n1)=O)O)=O,0 F6783-6063,CCc1nnc(cc2)n1nc2N(C1)CC(C2)C1CN2S(c1c(C)n(C)nc1C)(=O)=O,1 SC42-0330,Cc1ccc(C(N(CC2)CCC22OCCC(Cc3noc(C4CCC4)n3)C2)=O)s1,1 F6442-2260,O=C(CCc(cccc1)c1Br)N(C1)CC1S(Cc1ccco1)(=O)=O,0 F1917-5686,CC(C)(C)OC(N(CCCC1)C1c1cc(C(N)=O)ccc1)=O,0 Z2766729084,OC(CC1)CCN1c(cccc1)c1NC(C1Oc(cc(cc2)O)c2OC1)=O,1 S722-1994,CC(C)NC(N(Cc1ccc(CC(CC2)CCN2C(C)=O)cc1)C1CC1)=O,1 F6312-0266,O=C(C1(CCCC1)c1cccs1)NCCCn1c2ncccc2cc1,1 F6439-8136,O=C(COc(cccc1)c1F)NCCn1c2cc(-c3ccco3)nn2cc1,1 Z3002430617,O=C(c1c(C(F)(F)F)scn1)N[C@]1(C2)[C@@H]2CCC1,1 F6791-6725,Cc1cc(C)nn1-c1cc(Nc(cc2)ccc2OC(F)F)ncn1,0 F6783-8273,CC(C)C(N=C(NC1=O)N(CC2)CCN2C(C(C(OC)=C2)=CN(C)C2=O)=O)=C1F,1 Z2958885129,CC(C(Nc1c[nH]nn1)=O)NC(C1CCCC1)=O,1 F6812-1522,COCc1nsc(N(CC2)CCN2c2nc(-c3ncccc3)ccn2)n1,1 V030-6000,CC(C(N(CC1)c(cc(cc2)OC)c2OC)=O)N1C(Nc1ccc(C)cc1)=O,0 Z2178472814,CC(C(Nc(cc1)cc2c1OCCNC2)=O)S(C)(=O)=O,0 Z1746859698,CCn1ncc(-c2n[nH]cc2C(N(CCC2)CC2c2nc(C(C)C)cs2)=O)c1,0 SB92-0258,CCn1nc(C)c(C(N(C2)CC2N(CCN2CCOCC2)S(C)(=O)=O)=O)c1,1 J029-0185,O=C(C1(CCCC1)c1ccccc1)Nc(cc1)cc(C=C2)c1OC2=O,0 Z2439910406,O=C(c1cn(-c2ncc(C(F)(F)F)cc2)nn1)NC1CNCCC1,1 Z1211774145,CCN(C(c1n[nH]c(C)c1C)=O)c1cc(C)ccc1,0 S624-0046,Cc(nc1)cnc1C(N(CC1)CCC11NCCc2c1[nH]c1c2cccc1)=O,0 Z1522364518,COc(c(OC)c1)cc2c1N=C(CN1Cc3cccc(F)c3CC1)NC2=O,0 F2135-0560,CC(C1)Oc(cc2)c1cc2-c1cc(C(OC)=O)no1,1 SB55-0933,O=C(c(cc(cc1)F)c1F)N(C[C@@H]1CCC2)C[C@@]12c1noc(-c2ccccc2)n1,1 F6438-2120,CCOc(nc(nc1)OCC)c1NC(c(cccc1)c1F)=O,0 Z3390582601,CC(C(O)=O)c(cc1)ccc1-c(cccc1)c1Cl,0 F6454-0783,Cc1noc(C)c1S(NCC1CCN(CC(F)(F)F)CC1)(=O)=O,1 4383-0121,CC(NC(NC1c(cc2)cc(OC)c2OC)=O)=C1C(Nc(ccc(OC)c1)c1OC)=O,0 C301-6013,CN(c(c(N1C)c2)cc(NC(c(cc(cc3)OC)c3Br)=O)c2N2CCOCC2)C1=O,1 F6656-4563,CC(C)(C)C(C=C1)=NN(C(CC2)CCN2C(N=CN2C)=CC2=O)C1=O,1 Z1391607284,Cc(c1ccc2)c(C(N(CCC3)CC3NC(c3cc(cccc4)c4o3)=O)=O)oc1c2F,1 C607-0826,Cc(ccc(Cl)c1)c1N1CCN(CC(c(cc2)cc3c2NCC3)=O)CC1,0 SC72-0130,Cc1noc(C)c1CC(N(C1)CC11OCc2c1cnc(C)n2)=O,1 Z1613999179,Cc1cncc(C(N(CCN(C)C2)C2c2ccccc2)=O)c1O,0 J025-0396,COc(cc1)ccc1-c1csc(C(C2)c(ccc(OC)c3)c3OC)c1NC2=O,0 F6411-4393,Cn1nc(C(Nc(cc(C(F)(F)F)cc2)c2Cl)=O)c2c1cccc2,0 G669-0267,CN1CCN(CCNC(C2=Cc(cc(cc3)OC)c3OC2)=O)CC1,1 F6806-6851,O=C(C(C1)OCCN1c1nc(cccc2)c2[nH]1)NC1CC1,1 F6363-0222,O=C(c1cccc(Cl)c1)Nc(cn1)cnc1Oc1ccccc1,0 L464-0455,Cc1c(-c(s2)ccc2S(N(CC2)c3c2cccc3)(=O)=O)onc1C,0 F3398-4481,CCOc(ccc(-c1csc2c1N=CN(Cc1ncccc1)C2=O)c1)c1OCC,1 F6515-1280,O=C(c1cc(Br)cnc1)NCc1cc(-c2ccco2)ncc1,0 F3406-9740,CCC(N=C(N)N1CC(NCc(ccc(F)c2)c2F)=O)=C(C)C1=O,0 F6678-8480,Cc1nc(cccc2)c2n1C(C1)CN1C(c1cn(C)nn1)=O,1 Z7488730683,CC(C)N1CC(CN(CCC(N2)=O)C2=O)CC1,1 F0307-0134,Cc1cc(Sc2nnnn2-c2ccccc2)nc2cc(OC)ccc12,1 Z1408013922,COCCn(cc1)nc1NC(c1cncc(-c(cc2)ccc2OC)c1)=O,0 Z3869285613,CC(CCC1)CN1c1ncnc2c1ccn2C1CC1,1 F6436-3137,Cc1cc(CNC(c2cc(Br)cs2)=O)c(C)o1,0 F5140-0413,CC(c(cc1)ccc1NC(C(CCC1)CN1S(C)(=O)=O)=O)=O,0 Z1198916627,Cc1c(C(N(CCCC2)C2c2c[nH]nc2)=O)[nH]c(CCC2)c1C2=O,1 F5269-0003,CCOC(C(CCC1)CN1C(c1csc2nc(-c(cc3)ccc3F)cn12)=O)=O,1 F2738-0731,COc(cc1)cc2c1sc(N(Cc1ncccc1)C(CS(c1ccccc1)(=O)=O)=O)n2,1 Z5029833951,CC(COC)C(NCC1(CCC2CC1)N2c1ccnc2ncnn12)=O,1 E569-0286,Cc(cc1)cc2c1onc2CNC(NCCCN(CC1)CCN1c1c(C)ccc(Cl)c1)=O,1 Z2067039805,Cn(cc1C(N2CCN(Cc3ccccc3)CC2)=O)nc1OC,1 Z2627125700,CCN(C(c(cnn1C(C)(C)C)c1Br)=O)c1cnccc1,0 Z2911337238,CC(C)(C(C(N(C1)CC1(C)C(O)=O)=O)Oc1ccccc1)O,0 Z2719009449,CC(C)n(c1nc(C2CC2)c2)ncc1c2C(N(CCC1)[C@@H]1C(N(C)C)=O)=O,0 F3366-5625,CC(C)(C)N(CC(C1)c2nc(cccc3)c3n2CC(COc(cc2)ccc2OC)O)C1=O,1 S751-0277,Cc1cnc(C2CC2)n1CCNC(C(C1)CN(C2CCCCC2)C1=O)=O,1 Z3654401944,CCCN(CC(O)=O)C(c(cc1)ccc1-c1cnnn1C)=O,1 P894-0103,CCC(CC)N(CC1)CCN1c1nnc(-c2nc(C3CC3)no2)c2ccccc12,1 S564-0846,O=C(Nc1cccc(F)c1)N1CCC(Cc2nnc(-c3ccncc3)[nH]2)CC1,1 F6222-0532,O=C(c1nccnc1)Nc1cnc(N(CC2)CCN2c2ncccc2)nc1,1 Z1570371483,CCCCCNC(C(CC1)CCN1C(N[C@H](C)COC)=O)=O,0 Z1891073155,C(C1)C1c1nc(-c2cnc3n2cccc3)no1,1 F2204-0570,Cn(cc1C(N(CC2)CCN2C(c2ccco2)=O)=O)c(C(N2Cc3ccccc3)=O)c1NC2=O,1 S646-0180,CCn1ncc(CN(CC2)CCC2N(CC23CCCCC3)C2c2ccccc2)c1,1 F1773-0291,CCOC(C(CC1)CCN1S(c(cc1)c(C)c(C)c1OC)(=O)=O)=O,0 T500-2170,CCOc(cccc1)c1NC(N1CCC(CN(CC2)CCC22OCCCC2)CC1)=O,1 F6193-0175,CC(C)Sc1ccc(CC(Nc2cc(C(NCC3)=O)c3cc2)=O)cc1,0 F6519-5284,Cc1cc(C)nn1C(CNC(CSc(cc1)ccc1F)=O)c1ccco1,1 SA53-1056,Cc1noc(C)c1C(N(CCC1)CC(c2nc(C)n[nH]2)N1C(c1ccncc1)=O)=O,1 SC09-0339,C[C@@H](COc(cc1)c(C2)cc1-c1cncnc1)N2S(c1c(C)onc1C)(=O)=O,1 E002-0868,Cc1c(CN(c(cccc2)c2C(c2ccccc2)=NC2)C2=O)nc(-c(cc2)cc(OC)c2OC)o1,0 S700-0648,O=C(CCC1CCCC1)N(C1)CC1c1nc(CCOCC2CC2)no1,1 F6489-1737,CN(C)c(cc1)nnc1OC(CC1)CN1C(C(CC1)NC1=O)=O,1 G267-0974,Cc1c(CCC(NC2CCCC2)=O)c(C)nn1-c(cc1)nnc1N1CCOCC1,1 F6544-0867,CC(C)(C)NC(N(CC1)CCC1NC(C1CC1)=O)=O,0 F1142-3547,Cc1nc(NCc(cc2)cc3c2OCO3)c(c(CCC2)c2s2)c2n1,1 F6089-6190,CN(C=CC=C1C(NCC2(CCOCC2)c2ccccc2)=O)C1=O,1 Z2642285093,CCON(C)C(CNC(c(cc1)cc(N2C3CC3)c1NC2=O)=O)=O,0 F6539-2257,CN(C)S(N1CCC(CNC(C2(CC2)c(cccc2)c2OC)=O)CC1)(=O)=O,0 SC67-0882,CCCn1c(C(CN(C2)C(c3ccco3)=O)C2(CC2)CCN2C(C)C)nnc1,1 E699-1342,CC(C1)N(C(C2CCC2)=O)c(cc2)c1cc2S(NC1CCCC1)(=O)=O,1 F6476-4415,O=C(COc1cccc(C(F)(F)F)c1)N(CC1)CC1Oc1nc2ccccc2nc1,1 F5825-0221,O=S(c1c[nH]cn1)(N(CC1)CCN1c1nc(cccc2)c2n1Cc1ccccc1)=O,1 Z103711342,CN(Cc1nc(-c(cc2)ccc2OC)no1)Cc1ccccc1,0 F5013-0267,O=C(CCCN(C(C=C1)=O)N=C1c(cc1)ccc1Cl)Nc(cc(cc1)Cl)c1Cl,0 F6491-2599,CC(NC(CCSC)C(N(CCC1)CC1Oc1nccnc1N(C)C)=O)=O,0 F6561-7908,O=C(NCc1cccc2ccccc12)NC1CN(Cc2cscc2)CC1,1 SA65-1071,Cn1c(ccc(OC)c2)c2c(CN2CCC(CCc3noc(C4CC4)n3)CC2)c1,1 Z3268542365,Oc1cnc(CC(NCC2(CN3CCOCC3)CCCCC2)=O)cc1,1 Z2993510683,CCO[C@@H](COC1)[C@H]1n1nnc(C(N(C)c2ncccc2)=O)c1,1 F6683-1404,Clc(cncc1)c1OCC1CCN(CC2OCCC2)CC1,1 Z2112511400,Cc1nn(C)cc1S(NCC(C(O)=O)c1ccccc1)(=O)=O,0 F6752-3680,Cc1nc(CN(CCC2)CC2NC(C2CC2)=O)co1,1 F6734-0163,N#Cc1cc(COCC2)c2nc1N(C1)CC(C2)C1CN2c1nccc(C(F)(F)F)n1,1 Z261769664,O=C(C1CC1)Nc(cc1)cc2c1[nH]nc2,1 Z2297649235,O=C(c1cn(CCCC2)c2n1)NC(CC1)Cn2c1nc(-c(ccc(F)c1)c1F)c2,1 Z952032064,Cn1c(cccc2)c2c(CC(Nc2cccc(CN3CCSCC3)c2)=O)c1,1 Z1899855087,CC(S1)=NN(CC(N(CCCC2)C2C(N)=O)=O)C1=O,1 S923-0390,COCC(N(CCCC1)C1c1nnc(CC2)n1CCN2C(Cc1cscc1)=O)=O,1 S428-1220,CC(C)(C(N1CCC(N(CC2)CC2c2nc(C3CCOCC3)no2)=O)=O)NC1=O,1 F6761-7678,N#Cc1cc(F)c(CN(CC2)C(C3)C2CN3c2nccc(C(F)(F)F)c2)cc1,1 Z2093096310,CC(NC(C(C(NCC(c(cc1)ccc1Cl)(F)F)=O)=C1)=O)=C1c1ccccc1,1 S924-0009,Cc1cc(C(N(CC2)CCC2(CC2)N(Cc3c(C)onc3C)C2=O)=O)c(C)o1,0 Z1158441054,CN(CCN1CCOCC1)C(C(CCC1)CN1C(c1ccccc1)=O)=O,0 F6764-1503,O=C(CN(CCO1)C1=O)N(CC1)CCC1c1ccc(cc(cn2)Cl)c2n1,1 F6514-4385,O=C(C1(CCCC1)c(cc1)ccc1Cl)N(C1)CC1n1nnc(CN(CCC2)C2=O)c1,1 F6438-3802,CN(C)c1nc(CNC(c2cc(-c(cc3)ccc3F)nn2C)=O)nc(N2CCOCC2)n1,1 E864-0402,COc1ccc(C(c2c(CC3)c(cc(cc4)Cl)c4[nH]2)N3C(NCc2ccco2)=O)cc1,0 D399-3771,O=C(Nc(cc1)cc2c1OCCO2)N(CCC1)C1c(cccc1)c1Cl,1 Z2223227990,CC(CCNC(c1ccc(C(OC)=O)[nH]1)=O)S(C)=O,0 Z1301108925,CN1c(cc(cc2)F)c2N(Cc2nnnn2-c(cc2)ccc2OC(F)F)CC1,1 Z1693136495,CC(C)(C)c1csc(CNS(c2ccnn2C)(=O)=O)n1,0 Z2313185146,OC1(CC1)C1N(CC2OCCCC2)CCCC1,1 SA04-0001,Cc1ncc(CO)c(C(CCC2)CN2C(C2CCCCC2)=O)n1,0 Z4619797862,CC(CCCc1c2cccc1)C2NC(c1ccnc2nccnc12)=O,1 Z3055596982,O=C(c1cnncc1)Nc1nn(CCC2)c2c1,1 Z1618796740,COc1c(c(CC(NC2CCC2)=O)c[nH]2)c2ccc1,0 F3055-0060,O=C(c(cc1)ccc1-n1nc(C(F)(F)F)cc1-c1cccs1)NCC1OCCC1,1 F6708-8504,C(C(C1)c2ccccc2)C1(C1)CN1c1nc(cccc2)c2o1,1 F6502-2696,CCCCOc(cc1)ccc1NC(NCCn1c(C2CC2)ncc1)=O,0 Z1890818185,CC(C)CNC(N(CCC1)CC1c1nc(Cn2c(cccc3)c3nc2)no1)=O,1 F782-1500,O=C(C1CC1)Nc(cc1)cc2c1sc(NC(C1CCCCC1)=O)n2,1 F6442-2107,CC(C)(C)CC(N(C1)CC1S(Cc1ccco1)(=O)=O)=O,0 Z2438777476,O=C(CCc1ccccc1)N(CC1)CC1NC(C(C1)C11CCNCC1)=O,1 F5871-4295,Cc1cc(NC(C(CC2)CCN2C(NCC=C)=O)=O)no1,1 L712-0498,COc(ccc(NC(N1CCN(CCn2c(-c3ccncc3)nc3cccnc23)CC1)=O)c1)c1OC,0 Z31005933,CCc1cccc(CC)c1NC(CN(CC1)CCN1c(cc1)ccc1OC)=O,0 Z2409589043,OC(c(cccc1)c1-c(cccc1)c1C(N[C@@H](C1)[C@H]1C1CCC1)=O)=O,1 Z2218425858,Cn1nc(C(F)(F)F)c(S(NC(COC)c2ccco2)(=O)=O)c1,0 F6564-3781,CC(C(Nc1cn(C)nc1)=O)N1N=C(C2CC2)C=CC1=O,1 5340-0228,Cc(cc1)ccc1NC(C1=O)=C(CC(O)=O)C(c(cc2)ccc2OC)N1c1ccc(C)cc1,0 F6559-5395,OC(C(CN(C1)c2ncnc(C3CC3)c2)C11CCCCC1)=O,1 F5689-1120,CN(C(c1ncccc1)=NN1CCNC(C(CC2=O)CN2c2cccc(F)c2)=O)C1=O,1 T409-0455,CC(C)CCNC(C(CC1)Cc2c1nc(N(CC1)CCN1C(C1CCC1)=O)s2)=O,0 C732-0892,CC(CC(C)C1)CN1C(CN(c(ccc(S(N1CC(C)CC(C)C1)(=O)=O)c1)c1O1)C1=O)=O,0 Z1205520182,CNC(c1ccc(CNC(N(CCC2)CC22CC=CCC2)=O)cc1)=O,0 6319-1176,Cc1cc(OCC(NCCCN2CCOCC2)=O)cc(C)c1,1 S606-1355,COc1cccc(CN(CC2)C[C@@H]2N(c(nccc2)c2N2CC3CC3)C2=O)n1,1 F5062-0059,Cn1nnc2c1ncnc2N(CC1)CCN1C(c(cc(cc1)Cl)c1OC)=O,0 F6512-1596,O=C(c1nn(-c2ccccc2)nc1)NCc1nc(C2CCCCC2)cs1,1 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Z1677507692,CC(c1nc(-c(cc2)ccc2OC)no1)N1CC2(CCC2)COCC1,0 Z3686917769,CN(C)c1cc(N(C2)[C@@H](CNC(CCc3ncccc3)=O)C[C@H]2O)ncn1,1 Z2755408445,Cc(n(-c1cc(NC([C@]2(CCC3)[C@@H]3OCC2)=O)ccc1)nc1)c1C(O)=O,1 F2873-0060,CN(C(C=C1)=O)N=C1c1cccc(NS(c(cc(cc2)Cl)c2OC)(=O)=O)c1,1 Z3136595356,CC(CCC1)N1C(NCc1noc(COC)n1)=O,0 Z1752598886,N#Cc(cccc1)c1-c1ccc(CNC(N(CC2)CC2(c(cccc2)c2N2)C2=O)=O)cc1,1 F6564-8496,CS(c(cccc1)c1C(NCCN1N=C(CCC2)C2=CC1=O)=O)(=O)=O,0 F2984-0187,O=C(CCCS(Cc1ccccc1)(=O)=O)NCc1ccccc1,1 Z4439097389,Cc1cn(CC(N2CC(CN)OCCC2)=O)c2c1cccc2,1 SB06-1214,O=C(CCC1CCCC1)N(CC1)CCC11C(CC(N2CCOCC2)=O)CC1,1 F6805-5625,CN(C1CCN(CC(C2)CC2(F)F)CC1)c(nc1)ncc1Cl,1 Z2897943766,CC1(CN(Cc(cc2)ccc2OCC(O)=O)CCC1)c1ccccc1,0 F2890-0167,CS(c(cccc1)c1NC(c(s1)ccc1Br)=O)(=O)=O,0 F1318-0109,Cc(n(CC(COc(ccc1ccccc11)c1Cl)O)nc1C)c1Br,0 Z4661212617,O=C(c1c[nH]nc1)NC(C1)(CN1c1ncnn2c1ccc2)c1ccccc1,1 F5493-0060,Cc1nnc(C(CCC2)CN2C(c(cc2OC)cc(OC)c2OC)=O)s1,0 F6482-6120,O=C(c(cc1)ccc1N1CCOCC1)NCc1cc(-c2ccncc2)ncc1,1 F0147-0020,CC(c1cccc(NC(c2cccc(Br)c2)=O)c1)=O,0 Z4093676795,CC(C(NS(c(cccc1F)c1C#N)(=O)=O)=O)n1nc(C(F)(F)F)cc1,0 Y042-4453,O=C(CCC(N(CC1)CCN1c(cc1)ccc1F)=O)Nc1nnc(C2CC2)s1,1 SA44-0802,CN(CC(C1)(CN1C(CCn1nccc1)=O)C1)C1c1nnc(-c2ccccc2)o1,1 F6512-1573,O=S(NC1Cc2ccnn2CC1)(N1CCOCC1)=O,1 F6549-8635,O=C(c1cc(-c(cc2)ccc2F)n[nH]1)N(C(CC1)C2)C1CC2Oc1cnccc1,1 Z2385318543,Cc1cc(OC)nc(C)c1CNC[C@@H](CC1)O[C@@H]1c1nc(C2CC2)n[nH]1,1 F5773-0326,CSc1cccc2c1nc(N(CC1)CCN1C(Nc1cccs1)=O)s2,0 S661-1104,CCN(C(C(C1)N2CC1(CC1)CCN1C(c1cccs1)=O)=O)C2=O,0 Z2952187134,CC1OCCN(CCNC(Nc2cscc2Br)=O)C1,0 F3385-5545,O=C1C(c(cc2)ccc2Cl)=C(C(F)(F)F)Oc2c1ccc1c2CN(Cc2cnccc2)CO1,1 F2135-1695,Cc1nc(SCC(Nc(cc2)cc3c2OCO3)=O)nc(C)c1,0 Z2798009750,CCCCN(C1CCCCC1)C(CCN(C=C(C(N1)=O)C#N)C1=O)=O,1 S556-1019,Cn1cnc(S(N(C2)CC2Oc(cc2)ccc2-c2noc(C3CCOCC3)n2)(=O)=O)c1,1 S376-3105,Cc1nc(C(C(N2Cc3cccc(Br)c3)=O)=C(CCCCC3)N3C2=O)no1,0 F2884-0167,Cc(ccc(N(CC(C1)c2nc(-c3ccc(C(F)(F)F)cc3)no2)C1=O)c1)c1F,0 Z3052698271,CC(C)n(c(C)c1)nc1NC(C1(CC1)S(C)(=O)=O)=O,0 F6240-4751,Cc1noc(C2(CCCCC2)NC(C(C2)CN(Cc(cc3)ccc3OC)C2=O)=O)n1,1 Z745730892,COc1cccc(CC(CCC2)N2C(Nc(cc2)ccc2-n2nnnc2)=O)c1,1 F6441-1022,CCc(s1)ccc1S(N(CCC1)CC1S(c(cc1)ccc1F)(=O)=O)(=O)=O,1 F070-1158,Cc(ccc(NC(N(CC1)CCN1c1nc2ccccc2nc1C(F)(F)F)=O)c1)c1Cl,0 F6792-1098,CSc1nc(N(CC2)CCN2c2nc(C#N)ccn2)cc(C(F)F)n1,0 F6456-1028,O=C(C(CC1)CCN1c1ncnc(-n(cc2)c3c2cccc3)c1)NCCN1N=CC=CC1=O,1 Z3517510636,NC1CC(CC(Nc(cc2)ccc2Oc2nnccc2)=O)OCC1,1 F5051-0737,CCOc(cc1)nnc1-c1cc(NC(c2c(C)nc(C)s2)=O)c(C)cc1,1 F2507-0482,O=C(CSc1nnc(cc2)n1nc2-c1ccncc1)N(CC1)CCN1c1ccccc1,1 Z2961139161,C[C@@H]([C@@H](C(F)(F)F)OCC1)N1C(c1nccc2cccnc12)=O,0 F2553-0091,CN(C(c(cc1)c2cc1NC(c(cccc1)c1SC)=O)=O)C2=O,0 Z1619815733,OCc1ccc(CN(CC2)CCC2c2nc(-c3ccccc3)n[nH]2)cc1,1 F6438-2077,COc(c(NC(Nc(cnc(OC)n1)c1OC)=O)c1)cc(OC)c1Cl,0 F6521-3699,CC(CNC(c(ccc(F)c1)c1Cl)=O)(c1cc(cccc2)c2o1)O,0 Z1615256828,Cc(ccc1cccnc11)c1S(N(CCN1)C(c2ccc(C(F)(F)F)cc2)C1=O)(=O)=O,0 V017-2339,CN(CC1)CCN1c1nc(N2CCCC2)c(CN(CC2)C(c(ccc(F)c3)c3F)=O)c2n1,0 F5833-3295,CS(N(CCC1)c2c1ccc(NC(C1(CCCC1)c1cccs1)=O)c2)(=O)=O,1 Z2871933532,O=C(NCc1nc(Cc(cccc2)c2F)no1)N1CCCC1,0 F2024-2229,O=C(NCCc1c[nH]c2c1cccc2)NC(CC1=O)CN1c(cc1)ccc1Cl,1 Z3393292245,CC(CCC1)(c2ccc(C(F)(F)F)cc2)N1c1ccnc2ncnn12,0 Z2620388443,Cc1noc(C)c1NC(NC1(CCC1)c1cc(OC)ccc1)=O,1 SC55-1089,Cn1ncc(CN(C2)CC2(CN(Cc2ccccc2)C2)C2c2nc(C3CC3)n[nH]2)c1,0 Z3091864341,O=C(CCN(CCC1)[C@H]1c1nocc1)Nc1ccccc1,0 F6257-5284,Cc1cncnc1N(CC1)CCN1S(C1CC1)(=O)=O,0 F6724-1775,O=S(C1CC1)(N1CCC(CNc2nc(cccc3)c3o2)CC1)=O,1 Y043-7312,CC(C)C(C(Nc(cc1)cc(Cl)c1OC)=O)NC(NC(CC1)CS1(=O)=O)=O,0 Z4439749286,O=C(c(cc1)cc(N2)c1N=CC2=O)N1CCC(CC2CCCCC2)CC1,1 F536-0342,CC1Oc2cc(S(N(CC3)CCN3C(CCC3CCCC3)=O)(=O)=O)c(C)cc2NC1=O,1 D512-0169,CCc(cc1)ccc1N([C@@H](CS(C1)(=O)=O)[C@@H]1N(CCCc1ccccc1)C1)C1=O,1 S915-0056,Cc1cccc(OCC(N(C[C@H](C2)N3C[C@H]2OC)CC3=O)=O)c1,1 Z2938534068,FC(c1cc(Cn2nnnc2N2CCOCCC2)ccc1)(F)F,0 SB15-0818,Cc1noc(C)c1CC(N(CCC1)CC1N(C1CCOCC1)S(C)(=O)=O)=O,1 Z2959484427,C[C@@H](CO)N(C)C(c1cc2cc(Br)cnc2n1C)=O,0 S932-7547,O=C(c1cc2cccnc2cc1)N(CC1)CC1n1nnc(COCc2ccccc2)c1,1 Z3648339562,OCC(C1)CC1(C1)CC1NC(C(Cc1ccccc1)NC(c1cccs1)=O)=O,1 Z3615018222,NC(C(C1)(CC1C(F)F)NC(c1csc(-c(cc2)cc(F)c2F)n1)=O)=O,0 E019-0317,CC(C(N(CC1)CCN1c1c(C)ccc(Cl)c1)=O)N1N=C(C)c(sc2c3cccc2)c3C1=O,0 F5097-1394,COCCNC(Cc(cc1)ccc1NC(c(cc1)ccc1Br)=O)=O,0 F6252-1622,O=C(c1c(-c2ccncc2)n(Cc2ccccc2)nn1)NCc(ccc(F)c1)c1Cl,1 Z2527308509,Cc1nc(C)nn1Cc1cn(C(C(N)=O)c(cc2)ccc2F)nn1,0 Z1444203430,CC(CN(Cc1ccccc1)C(CCNC(c1cscc1)=O)=O)C(O)=O,1 Z2952397124,CC(C)C(c1cn(C)nc1)NC(Nc(cc1)cnc1N(C)C(C)=O)=O,0 Z1210154973,CC(C)Oc1cccc(CC(Nc2nnc(C)c(C)c2)=O)c1,0 SD67-0219,CC(C)CN(CC(N(CCC1)C2CN1S(c1cc(F)cc(F)c1)(=O)=O)=O)C2=O,1 F2707-0187,O=C(Nc1cccs1)N(CCn1c2ccc1)C2c(cc1)cc(F)c1F,1 Z2966681395,C[C@H](C1)N(CC(F)(F)F)[C@@H](C)CN1C(c1n[nH]c2c1cccc2)=O,0 Z3051718090,O=C([C@@H]1[C@@H](C2)CO[C@@H]2CC1)N(CC1)CCC1C(O1)=NNC1=O,1 C727-0154,O=C(c1cccc2c1nc(N(CCC1)c3c1cccc3)s2)NCCC1=CCCCC1,1 F9995-2535,O=C(c1c2cccc1)N(CCc1csc(N3CCOCC3)n1)C2=O,1 Z2972005189,C[C@@H](CO)N(C)c1cc(Oc(cccc2)c2Br)ncn1,0 Z3687113731,CCc1cc(C(NC[C@@]2(CO)N(C)[C@H](C)COC2)=O)cnc1,0 G008-4913,CCc(ccc(-c1cc(C)no1)c1)c1S(N(C)CC1Oc(cccc2)c2OC1)(=O)=O,0 Z1618363572,CC(C)NS(N(CCC1)C1c1cnccc1)(=O)=O,0 Z4662187594,CC(C)c(cccc1)c1NC(N(CC1(C2)CC2(OC)OC)C1c1ccccc1)=O,0 F2805-1287,CN(c1ncc(COC)c(SCC(Nc(cc2)ccc2OC(F)(F)F)=O)c1C(N1C)=O)C1=O,0 F5086-1913,Cc1c(C(Nc2nc(c(SC)ccc3)c3s2)=O)n(C)nc1,0 Z5027904308,CC(COC)N=C(NCC1OCCOC1(C)C)N(CC1)CCN1c1ncccc1,0 Z1560083238,Cc1cc(OCC(N(CC2)CCN2C(C2(CC2)NC(N)=O)=O)=O)cc(C)c1,0 F6286-0514,O=C(c(o1)ccc1Br)NCCc1nc(C(F)(F)F)cc(C2CC2)n1,1 F6523-0281,Cc(cccc1)c1-c1noc(CCC(N(CC2)CCN2c2cc(C(F)(F)F)ncn2)=O)n1,1 F5822-0970,CC(C)c1nccn1CC(CC1)CCN1C(CN(C(CC1)=O)C1=O)=O,1 Z635047094,C(c1c[nH]nc1-c(cc1)cc2c1OCO2)N1CCCC1,1 G702-0778,C1Cc2nc3ncnn3c(NC3CCCCCC3)c2C1,1 Z4094402209,NC(C(CC(NCC1)=O)N1C(c1cccc(C(F)(F)F)c1)=O)=O,1 V023-1247,CCC(C)N(Cc(cc(cc1)NC(Nc2cccc(Cl)c2)=O)c1OC1CC)C1=O,1 F6727-5845,O=C(COc1nnccc1)N(CC1)CCC1N(C(C=C1)=O)N=C1c1ccccc1,1 F6436-3466,O=C(c(cc1)cc2c1ncs2)NCCc1cocc1,1 F5857-6159,OC1(CNC(Cc2cccc3ccccc23)=O)CCCC1,1 Z3860914725,O[C@@H]([C@H](CC1)C2)[C@@H]1C[C@H]2NC(Nc1nccs1)=O,1 F6730-4557,O=C(c1ncnc2c1CCCC2)N(CC1)CCN1c1ccccc1,1 F6436-3646,COCCN(Cc1cocc1)C(c1cc(cccc2)c2[nH]1)=O,0 F6556-3019,OC1(CNC(NCc(cc2)ccc2Cl)=O)COCC1,1 F6521-7450,Cc1c(C(NCC(c(cc2)cc3c2n(C)cc3)O)=O)c(C)nn1C,0 F3394-0141,Cc1cccc(S(Nc(cc2)cc(C(F)(F)F)c2Cl)(=O)=O)c1,0 Z2074285015,Cc1c(C(N(CC2)c(cccc3)c3N2C2CC2)=O)nnn1Cc1ccncc1,1 SB66-0003,Cc(n(C)c(-c1ccccc1)c1)c1C(N(C[C@H]1CCC2)C[C@@H]1NC2=O)=O,1 F5584-0090,O=C(Nc1cccs1)N1CCN(Cc2nc(-c(cc3)ccc3Cl)cs2)CC1,1 F6720-1910,O=C(Nc(cc1)ccc1SC(F)(F)F)Oc1ccccc1,0 Z2641758194,CC(C)(C(N(CC1)C11COCC1)=O)Oc1ccc(C(F)(F)F)cc1,1 6212-0057,CN(c1c(C(N2C)=O)n(CC(CN3CCOCC3)O)cn1)C2=O,1 F5671-0223,CCC(C(N1CCN(CC(c2ccco2)=O)CC1)=O)c1ccccc1,1 Z900043886,CS(c(cccc1)c1C(NCC1CN(Cc2ccccc2)CCC1)=O)(=O)=O,1 F6502-1007,CCOC(CCC(NCCn1c(-c2nccnc2)ncc1)=O)=O,0 F6525-8025,O=C(c1nn(-c2ccccc2)nc1)N(CCn1nc(C(F)(F)F)cc1)C1CCCC1,1 Z2874262773,CC(C)c1ccc(CN(C)C(NCC(C2)CC2N)=O)cc1,0 Z2568659690,CC(C)(CN(C)c1c(c(C)c(C)s2)c2nc(-c2cnccc2)n1)N,1 Z1372465477,Cc1nn(CCN(C2)C(NCc(cc3)cc(F)c3Oc3cnccc3)=O)c2n1,1 F6724-3715,Cc1ccc(C(C2)OCCN2c2ncnc3ncccc23)cc1,1 F6529-3098,O=C(Cc1cnccc1)N(CC1)CCC1N(CC(N1C2CC2)=O)C1=O,1 S984-1141,CC(N(C[C@H]1CN(C2)C(Nc3cccc(Cl)c3F)=O)C[C@]12C(N1CCCC1)=O)=O,0 Z2500913375,CCN(C(c1c(C)nc(-c2nnc[nH]2)s1)=O)c1cn(C)nc1,1 F6502-7878,O=S(Cc(cc(cc1)F)c1F)(NCCn(cc1)nc1-c1cscc1)=O,1 F6734-2656,Clc1cnc(N2CC(CN(C3)c4nnc(C5CC5)cc4)C3C2)nc1,1 F6554-4167,O=C(c(cccc1)c1Br)N1Cc(cc(cc2)F)c2OCC1,0 SC02-0319,COCCC(CC1)(CN1S(c(cc1)ccc1F)(=O)=O)NS(c1ccccc1)(=O)=O,1 Z2255766320,CCC(c1nnn[nH]1)NC(c1cc(C(N(C)C(N2C)=O)=O)c2s1)=O,1 Z3052904800,O=C([C@@H](C1)[C@H]1c1ccco1)N(CCc1c2[nH]cn1)C2c1cnccc1,1 Z1497354166,CC(C)(C1)C1C(N(CC1)CCN1c1cccc(Cl)c1)=O,0 Z2963046926,O=C(c1nc(cncc2)c2s1)NCC1(c2ccccc2)OCCC1,1 F6676-2659,CN(C(CC1)CCN1C(C(CC1=O)CN1c1ccccc1)=O)c1ncccc1,1 F6785-6884,Cc1c(C)nc(cc2)n1nc2OCC(CC1)CCN1c1ncnc2c1ncn2C,0 Z2863073622,CC(CC1)Cc2c1nc(CNc1cc(C(CCC3)NC3=O)ccc1)s2,1 P936-3059,O=C(C1CCCCC1)N1CC(Cc2nncn2-c2ccccc2)CC1,1 Y030-9570,CCOCc1nnc(NC(CCC2CCCCC2)=O)s1,0 Z1739103411,CCc1ccc(CS(N(C)C(C)C(O)=O)(=O)=O)cc1,0 F6031-1750,OC(CN1CCN(CC(NCc2ccccc2)=O)CC1)c1cccs1,1 F3290-0101,CC(C1)N(C(c(nc(nc2)SC)c2Cl)=O)c2c1cccc2,0 Z2951074595,Cc1cccc(C)c1CN(C)C(Nc1cn(C)nc1OC)=O,0 F6395-3672,CCCc(cc1)ccc1C(N1CC(Cc2ccccc2)OCC1)=O,1 Z1556746224,CC(C)(C)OC([C@H](Cc1ccccc1)NC(c1c(cc(cc2)OC)n2nc1)=O)=O,0 Z1577751657,O=C(NCc(cc1)cc(F)c1-n1cncc1)NC1CC2(COCC2)OCC1,1 D470-1910,O=S([C@@H](CS(C1)(=O)=O)[C@H]1NCC1OCCC1)(c(cc1)ccc1F)=O,0 Z1278675594,OCCN(c1ccccc1)S(c(ccc(C(O)=O)c1)c1F)(=O)=O,0 F6713-3496,CN(C(C=C(N1)N(C2)CC(C3)C2CN3S(C2CC2)(=O)=O)=O)C1=O,1 F6816-3761,N#Cc(cc1)nnc1N(CCC1)CCN1c(ncc(C(F)(F)F)c1)c1F,0 S723-0900,CCC(C)NC(N1CCC(Cc2ccc(COc3ccncc3)cc2)CC1)=O,1 C593-1216,CC(CN(CC1)C(c2cc(C(Oc3c-4cc(C)cc3)=O)c4s2)=O)N1c1cc(C)ccc1,0 Y020-8865,O=C(CC(C(N1Cc2ncccc2)=O)n2c1nc1c2cccc1)Nc1cccc(Cl)c1,0 F2792-0241,CCn1nnc2c1ncnc2N1CCC(Cc2ccccc2)CC1,1 Z1330744844,CC(C)(CNC(NC1C(CO)CCCC1)=O)c1cccs1,0 M461-6355,Cn(cc1C(NCCC2=CCCCC2)=O)nc1S(N(CC1)CCN1c(cc1)ccc1Cl)(=O)=O,1 D731-0667,CC(Cc1c2cccc1)(C(Nc(cc1)ccc1N(C)C)=O)OC2=O,0 F6193-0195,COc(cc1)cc(C(Nc2cc(C(NCC3)=O)c3cc2)=O)c1Br,0 Z2804869079,CCC1=CC(C(N[C@H](C)c2cnc(C(F)(F)F)cc2)=O)=CN(C)C1=O,1 F6619-8043,COc1ncnc(N(CC2)CCN2c2ncnc(C3CC3)c2)c1,0 Z1974515432,CCOc1ccc([C@H](C2)[C@@H]2NC(c2c(cccc3)n3c(C)n2)=O)cc1,1 SB16-0982,CCS(N1[C@@H](CCN(C2)C(c3nccc4ccccc34)=O)[C@@H]2COCC1)(=O)=O,1 F6619-6307,FC(c1cc(N(CC2)CCN2c2ncnc(N3CCCC3)c2)ncc1)(F)F,0 Z71364650,CC(C1)(C2)CC(C)(C)CC1N2C(CNC(c(o1)ccc1Br)=O)=O,1 Z2763034231,O=C(c1nc(N2CCCC2)cnc1)NCc(cccc1)c1Cl,0 T501-0426,CC(C)n1c(CC(CCC2)CN2C(c2nc3ccccc3cc2)=O)nnc1,1 F6733-1919,COc1c(CNc(ncnc2C3CC3)c2F)cccn1,1 Z1263662800,CC(Cc(cccc1)c1OC)N(C)C(c(cc1)nc(C)c1C(O)=O)=O,0 Z4497727173,CCCOc1cccc(CCNC(C(CC(C2)O)N2C(Cc(cccc2)c2F)=O)=O)c1,0 F6524-1203,Cc1nnc2n1ccnc2N(CC1)CCN1C(C1Oc(cccc2)c2OC1)=O,1 F6482-4077,Cc(c(S(N(CC1)CCC1n1nccn1)(=O)=O)ccc1)c1Cl,0 Y070-0960,O=C(CC1N(C(COc(cc2)ccc2Cl)=O)c(cccc2)c2NC1=O)Nc1ccccc1,1 F6471-2035,CN(C=CC=C1C(N(C(CC2)C3)C2c2c3ncnc2)=O)C1=O,1 Z2454170825,CC(Cc1cccc(F)c1)(CCC1)N1C(c1noc(COC)c1)=O,1 F1967-1078,COc(ccc(-c1nc(CCN)cs1)c1)c1OC,0 K284-2597,O=C1N(Cc2ccccc2)C(SCc(cccc2)c2F)=Nc(cc2)c1cc2N1CCOCC1,0 F6573-6264,COc(ccc(Cl)c1)c1C(N(CC1)CCC1(C1)C1(F)F)=O,0 F0676-0696,COc(cc1)ccc1-c1nnc(cc2)n1nc2SCc1ncccc1,1 Y042-3247,Cc1cc(OC(C2=C3CCC2)=O)c3c(OCC(NCCN2CCOCC2)=O)c1,1 SD60-0162,O=C(c1nccc2ccccc12)N(C1)CC11OCC(CCOCc2cccc(F)c2)C1,1 L078-0599,Cn1cnc(S(N(CC2)CCC2c2nnc(C(Nc(ccc(F)c3)c3F)=O)s2)(=O)=O)c1,1 Z4928948735,O=C(C1ON=C(Cc2ccccc2)C1)Nc(cccc1)c1F,0 Z2172568948,Cc1c(NC(C(CC2)CN2c(cccc2)c2Cl)=O)n(CC2CC2)nc1,1 F2024-2217,Cc1cccnc1NC(NC(CC1=O)CN1c(cc1)ccc1Cl)=O,0 F5142-0173,CS(N(CCC1)C1C(Nc1nc(c(F)ccc2)c2s1)=O)(=O)=O,1 Z3390487493,COc(ccc(C(CC1)CN1C(C1(CC=CC1)C(O)=O)=O)c1)c1OC,0 F6359-3029,O=C(c1ncccc1)N(CC1)CCC1Oc1nccnc1,1 G702-7015,COc1cc(Nc2c(CCCC3)c3nc3nc(Cc(cc4)ccc4Cl)nn23)cc(OC)c1,0 Z2218883317,CC(C)(C1)C(CCC2)C2N1S(c1cc(Br)cnc1)(=O)=O,1 F6564-1783,O=C(c1cc2c(-c3ccccc3)onc2cc1)NCCN1N=C(CCCC2)C2=CC1=O,1 Z1625842385,CC(Nc1c[nH]nc1C(CCC1)CN1C(c1c(C)ccc(F)c1)=O)=O,0 F6721-9337,N#Cc(nccc1)c1N(CC1)CCN1c(cccc1)c1Cl,0 Z3100212668,CN(CCOc(cccc1)c1OC)C(C1NCc2c1cncn2)=O,0 F5857-6886,OC(CCNC(Cc(cccc1)c1Cl)=O)c1ccccc1,0 SD07-0404,COc(cc1)cc(OC)c1C(N(CC1)CC11OCc2c(CNC(C3CCOCC3)=O)nnn2C1)=O,0 F1905-0342,CC(N1CCC(CN(CC2)CCC2N(C)C)CC1)=O,0 C607-0878,OC(CN(CC1)CCN1c(cc1)ccc1Cl)c1cc([nH]cc2)c2cc1,1 F6573-7642,COc(cccc1)c1S(N(CCN1c2cnccc2)CC1=O)(=O)=O,0 S974-2472,C[C@@H]1N(Cc2cocc2)C[C@H](C[C@@H](C2)N(C)C)N2C1=O,1 F6525-7845,O=S(c(cccc1)c1OC(F)(F)F)(NCCn1ncc(-c2cocc2)c1)=O,0 Z4767057874,CC(C)CSc1nc(C)c(CC(N(C(C)C2CC2)C2CC2)=O)s1,1 F5098-0935,O=C(C1CC1)N(CC1)c2c1ccc(NC(c(cc1)cc3c1OCO3)=O)c2,1 Z1443602531,Cc1c(CC(N(CC2)CCC2C(O)=O)=O)c(C)nn1-c1ccccc1,1 H025-0227C,CN(CC1)Cc2c1n(CCc1ccncc1)c1c2cc(C(F)(F)F)cc1,1 C325-0316,Cc1cc(C)nc2nc(-c(cc3)ccc3SC)c(Nc(cc3)cc4c3OCCO4)n12,0 Z3805655504,CC(C)(C(NC1CC2(CCC2)N(Cc2ccccc2)CC1)=O)C(O)=O,1 D483-1216,CC(C=CC1=NC(C)=C2Cc(n3C)nnc3SCC(N(CC3)c4c3cccc4)=O)=CN1C2=O,1 Z1721034538,CN(C)C(C(CCC1)N1C(c1coc(C2CCOCC2)n1)=O)=O,1 D620-0907,O=C(C1CC1)N(CC1)CCN1c(oc(-c(cc1)ccc1F)n1)c1S(c(cc1)ccc1F)(=O)=O,0 Z2294902979,CC1(C)CC(CNC(NC(CCC2)CC2S(C)(=O)=O)=O)CCC1,0 V011-0374,CC(C)(C)c(cc1)ccc1C(Nc(cc1C)nn1-c1cccc(Cl)c1)=O,0 Y040-8409,C1(\C\2=C(/c3c(O1)cc(OCC(N[C@H](C(=O)O)Cc1ccc(cc1)O)=O)cc3)\CCCC2)=O,1 Z1681994182,Cc1cccc(CN(CC2)CCN2c2nc(C)ncc2)c1C,0 C255-0275,CC(CC1)(C(NCCc(cc2)cc(OC)c2OC)=O)N(Cc(ccc(OC)c2)c2OC)C1=O,0 Z1438237451,COc(cc1)ccc1S(NCc1c(CC(O)=O)cccc1)(=O)=O,0 Z1639221995,COc(ccc(C(N(CC1)CC11COCC1)=O)c1)c1-n1nnnc1,1 Y041-0540,c12c(/C(=C\C(O1)=O)/C)c(cc1c2CCC(O1)(C)C)OCC(N1CCCC1)=O,1 Z644922236,Cc(cccc1)c1C(NC(CC1)CCN1c1c(c(-c(cc2)ccc2OC)cs2)c2ncn1)=O,1 F5772-5018,CC(C)(C)c(cc1)ccc1NC(N(C1)c(cccc2)c2NC1=O)=O,0 F6482-7582,O=C(Cn1cccc1)NCc1cccnc1-c1cccs1,1 F6537-3105,CC#CC(NCc(cc1)ccc1S(N(C)C)(=O)=O)=O,0 Z1507431870,O[C@H](CC1)CC[C@@H]1NC(N(CC1)CCN1c(cc1)ncc1Cl)=O,0 SA93-0964,COCCC(CCC1)(CN1C(CC1)CCN1C(Nc(cc1)cc2c1OCCO2)=O)C(N)=O,1 Z2279208651,O=S(N1CCCC1)(N(CCC1)CCc2c1cccc2)=O,1 Z243218878,CSc(cccc1)c1NC(C(C1)c(ccc(F)c2)c2NC1=O)=O,0 Z2012698252,O=C([C@H]1OCCC1)N([C@H](CC1)C2)[C@@H]1C[C@H]2c1ccccc1,1 Z450579618,CN(C1CCCCCC1)C(c(nc(N1CCCC1)nc1)c1Cl)=O,1 F6514-9162,O=C(c1nc(cccc2)c2s1)NCc1c(-c2cnccc2)nccc1,1 Z1609735040,OC(CCC(CCC1)CN1C(CCn1cccc1)=O)=O,0 Z4761671441,O=C(c(c(Br)c1)nn1-c1ccccc1)NCc1cnccc1,0 Z940705666,CCC(C)NC(CN1C(Cc(cccc2)c2OC)CCC1)=O,0 Z3681568987,CC(C)CC(CC([O-])=O)C(N[C@H]1c2cccc(F)c2OCC1)=O,0 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Z1952377572,O=C(c(nccc1)c1Br)N(CCN1C2CC2)CC1=O,1 Z57683961,COc(cc1)ccc1-c1nc(-c2ccncc2)no1,0 S688-0302,CN(C)C(CCOC)(CC1)CCN1S(c(cc1)cc2c1OCCO2)(=O)=O,1 F6550-4633,O=C(Cc(cc1)cc2c1OCO2)N(C1)CC1Nc1ncccn1,1 Z1274798356,OC(CC(C1)OCCN1C(Cc1cn(cccc2)c2n1)=O)=O,1 F5855-0771,O=C(CN(C(c1c2cccc1)=O)C2=O)N(CC1)CCN1C(C(C1)C1c(cc1)ccc1F)=O,1 Z734620968,O=C(C1(CCOCC1)c1cccc(Br)c1)N1CCCC1,1 F6524-6294,O=S(c(cccc1)c1Cl)(N(CC1)CCN1C(CC1)CCS1(=O)=O)=O,0 E557-3833,CC(C)(c(cc(cc1)S(NCC(CC2)CCC2C(NC2CCCCCC2)=O)(=O)=O)c1N1C)C1=O,1 F6679-2843,Fc1cc(CN(CC2)CC2Oc(ccnc2)c2Br)cc(F)c1,0 Z102334186,Cn1c(cccc2)c2c(C(NCc2nc(cccc3)c3n2C)=O)c1,1 Z1715383568,CC(C)c(nc(C)nc1)c1C(NCC(C)(C(O)=O)O)=O,0 Z2301730482,CC(C)N(C)S(c(cc1)ccc1C(N1CC(CN)CCC1)=O)(=O)=O,0 F6709-4392,FC(c1nccc(OC(C2)CN2c(nc2)ncc2Br)c1)(F)F,0 F6454-1382,CCC(Nc(cc1)cc(C)c1S(NCC(CC1)CCN1c(nc1)ncc1F)(=O)=O)=O,0 F6752-8498,CC(C)(C)OC(N(CCC1)CC1N(C)S(C)(=O)=O)=O,0 Z2834922574,Cc1cc(C)nn1-c(ccc(NC(N1CC(OC)OCC1)=O)c1)c1F,1 Z2968008609,O=C(c1cc(NC(CC2)=O)c2cc1)NC1CCN(Cc2ccccc2)CC1,0 Z271908976,O=C(c1cc(-c(cc2)ccc2Br)n[nH]1)N1C2CCC1CC2,1 F6573-0406,Cn1nccc1-c1ncc(CNC(NCc(cc2)cc3c2OCO3)=O)cc1,1 Z1791112625,COc(cc(cc1)C(O)=O)c1S(N(CC=C)C1CC1)(=O)=O,0 S039-5204,N#Cc1ccc(CN(CC2)CCC(N=C(N3)N(CC4)Cc5c4cccc5)=C2C3=O)cc1,0 Z3049139132,CCc1c(C(NCC2(CC2)c(cccc2)c2Br)=O)ocn1,1 F6512-9195,Cc1c(CNC(Nc(c(F)ccc2)c2F)=O)cno1,0 F5481-0397,Cc(c1c2n(-c(cc3)ccc3F)nc1)nnc2SCC(Nc(cc(cc1)Cl)c1OC)=O,0 Z1433935888,OCCN(CC1)CCN1C(Nc1cn(-c2ncccn2)nc1)=O,0 F2670-0349,O=C(C1CC1)N(CCC1)c2c1ccc(NC(C(Nc(cccc1)c1Cl)=O)=O)c2,0 F6240-7764,CCOC(C(CCCC1)N1c(ncnc1)c1-c1nc(-c(cccc2)c2F)no1)=O,1 F6525-5009,Cc(n(CCNC(Nc1cccc(C(F)(F)F)c1)=O)nc1C)c1-c1ccccc1,1 S932-4573,O=C(c1cscn1)N(CC1)CC1n1nnc(COc2nccnc2)c1,1 Y503-3522,Cc(n(C)nc1)c1S(N(CCC1)CC1C(Nc1cn(CC(F)(F)F)nc1)=O)(=O)=O,0 Z2216900015,COc(cc1)ccc1NC(c1csc(-c2cnccc2)n1)=O,0 Z3008868914,OCC(CC1)N1S(c(ccc(C(O)=O)c1)c1Cl)(=O)=O,0 SA42-1023,CN(CC(C1)(CN1C(CCc1ccccc1)=O)C1)C1c1noc(-c2ncccc2)n1,1 S689-0545,CCn1ncc(S(N(C2)CC2N(CC(C2)C(N3CCCC3)=O)C2=O)(=O)=O)c1,1 F536-0481,CC(C(Nc1c2)=O)Oc1cc(S(N(CC1)CCN1C(c(cc1)cc(F)c1F)=O)(=O)=O)c2Cl,0 Z613168720,CCCC(NS(c1ccc(C)s1)(=O)=O)=O,0 Z1637314374,Cc1nc(CN(C)C(c2cncc(C)c2)=O)no1,0 Z1748811070,OC(CC1)(CCN1C(C(CCC1)CN1C(CCOc1ccccc1)=O)=O)C(F)F,0 Z1001826858,Cc1nn(C)c(C(NCCc2coc(-c(cc3)ccc3F)n2)=O)c1,0 F5033-7724,O=C(Cc(cccc1)c1Cl)NCC(CC1)CCN1C(Nc(cc1)ccc1F)=O,0 F6475-6427,COC(c(scc1)c1NC(c1cc(OCC2CC2)ncc1)=O)=O,1 F6436-2556,COC(N1CCC(CNC(N(CCN2)C2=O)=O)CC1)=O,0 F6745-1699,CSc(nc1)nc(N2CC(Cn3cncc3)C2)c1C#N,0 Z1432133005,CC(C)(C)c1ccc(C(N(C)CC(CC2)CS2(=O)=O)=O)s1,1 F6482-3159,O=C(c(ccc(F)c1)c1Cl)N(C1)CC1n1nccn1,0 F5831-2323,CC(Cc1cccs1)NC(Cc1cc(OC)ccc1)=O,0 Y043-1131,CS(c(cc1)cc2c1nc(NC(CN(C(C=C1)=O)N=C1c(cc1)ccc1F)=O)s2)(=O)=O,1 F6562-5478,O=C(c1cc(Br)cs1)NCCN(C=CC=N1)C1=O,1 F6445-6716,Cn1nc(cc(cc2)Br)c2c1C(NCc(cccc1)c1-c1cscc1)=O,1 Z4221422058,Cc(c1c2)nn(C)c1ncc2C(N[C@H]1CN(C)CCC1)=O,1 T636-2419,Cc1noc(C)c1CCC(N(CC1)CC1Nc1ncnc2c1CCC2)=O,1 F6773-2976,C(c1cnccc1)N(CC1)CCC1Oc1nccs1,1 F6471-2891,O=S(c1cnccc1)(N1C2C=CCC1CC2)=O,1 F3411-6121,Cc1nnc2n1-c(cccc1)c1N(CC(NCc(cccc1)c1Cl)=O)C2=O,1 F6436-0166,Cc(onc1)c1C(Nc1cc(N(CC2)C(C3CC3)=O)c2cc1)=O,1 F5828-0072,CC(C1)N(C(c2csc(-c3nccnc3)n2)=O)c2c1cccc2,1 S296-2528,COc1cc(OC)c(CN(C[C@H]2C(N3CCN(CC4)Cc5c4cccc5)=O)C[C@@H]2C3=O)cc1,0 E667-1057,CC(CC(Nc(c(OC)c1)cc(Cl)c1OC)=O)S(c(cc1)cc(N2)c1OCC2=O)(=O)=O,0 K261-1853,O=C(N(Cc1cc(C(F)(F)F)ccc1)c1c2cccc1)N(c1cccc(Cl)c1)S2(=O)=O,0 F6512-0319,O=C(COCc1ccccc1)N1Cc2ccnn2CC1,1 S963-2892,CNC([C@@H](CN(Cc1ccncc1)C1)[C@H]1NC(c(cc1)ncc1F)=O)=O,1 Z1245987199,CN(CCOc(cccc1)c1OC)C(C(c(ccc(F)c1)c1N1)=CC1=O)=O,0 F3278-0017,CC(C)(C(CC1)C2)C1(C)C2OCC(CN(CCO)Cc1ccccc1)O,1 F6188-0606,COC(c(cc1)ccc1C(NCC1(CCOCC1)Sc1ccccc1)=O)=O,0 F2373-0136,CSc(cccc1)c1C(NCC(CN1c2ccccc2)OC1=O)=O,0 SB36-0701,Cc1c(C(N(C2)[C@H](Cn3nnc(C(NCCOC)=O)c3)CC2(F)F)=O)scc1,1 F6089-2984,CN(C(C1)=O)c(cc2)c1cc2NC(c1cc(-c2ccccc2)n[nH]1)=O,1 Z3002243679,CC[C@@H](C(NCCC1)=O)N1C(C(C)(C)Oc(cc1)ccc1OC)=O,0 SA68-0911,O=C(C1CC1)N(CC1)CCC1N(CCNC(c1ncccn1)=O)C1CCOCC1,1 Z1276289039,CC(N1CC(N(CCOC2)C2c2ccccc2)=O)=C(C)SC1=O,1 Z2959172020,O=C([C@H](C1)[C@H]2O[C@@H]1[C@H]1[C@@H]2C1)NCCC(NO1)=NC1=O,1 Y031-2834,O=C(C(CC1=O)CN1c(cc1)ccc1F)NC1CCCC1,0 Z4095380524,CC(C1)(C2)OCCC12NC(c(nc(-c1ccccc1)nc1)c1Cl)=O,1 D470-1650,O=S([C@@H](CS(C1)(=O)=O)[C@H]1NCc(cccc1)c1Cl)(c1cccs1)=O,0 Z1559712314,O=C(c1cc(-c2ncn[nH]2)ccc1)N1CC(C(F)(F)F)OCC1,1 G852-0230,CC(CCc1ccco1)N(C)S(c(cc1)cc(C=C2)c1NC2=O)(=O)=O,1 Z2483023210,CNC(CC1CCN(Cc(cc2)cc3c2oc(C(O)=O)c3)CC1)=O,1 Z2376991584,CC(CC1)CCC1Oc1nccc(CNC(N2C(CC3)CNC3C2)=O)c1,1 Z3495725756,COc1ncc(Cc2noc(-c3cc(CCCC4N)c4cc3)n2)cc1,1 F6523-0371,O=C(CSc1c[nH]c2c1cccc2)N(CC1)CCN1c1ncnc(C(F)(F)F)c1,1 F6523-3119,O=C(Cc(cc1)ccc1Br)NCCN(Cc(cccc1)c1OC1)C1=O,0 Z1234300880,COCCN(CC1)CC1NC(NCc(cc1)cc2c1OCCCO2)=O,1 F6555-6442,O=C(N(c1ccccc1)c1ccccc1)N(C1)Cc2c1cccn2,1 Z2491038536,CC(N1c(cc2)ccc2C(N(CC2CC2)CC(O)=O)=O)=Nc(cccc2)c2C1=O,1 F6666-1053,O=C(c1cscc1)Nc1cc2cccnc2cc1,1 F6525-6511,Cc(n(CCNC(c1c(C)onc1-c(cccc1)c1Cl)=O)nc1C)c1-c1cscc1,1 L596-0145,CN(c(ccc(S(NC(CCC1)c2c1cccc2)(=O)=O)c1)c1C(N1CC(N2CCCC2)=O)=O)C1=O,1 Z2440084185,CCc(n(-c1ncccc1)nc1)c1C(NC(CC1)CCC1N)=O,1 F6619-5346,Cc1cc(ncnc2N(CC3)CCN3c3cc(C)nc(N4CCOCC4)n3)c2[nH]1,1 Z1591765338,CC1CCN(CC(N(CC2)CCN2c(cc2)ncc2F)=O)CC1,1 Z2900720818,CN(CCC1)C1(CC1)CN1S(c1c[nH]c(C(OC)=O)c1)(=O)=O,1 F6473-6323,CC(O1)=CC(OC(C2)CN2C(Cc2cscc2)=O)=CC1=O,1 K784-9542,CC(CC1)CCC1N(C(C(NC1CCCCC1)=O)c1c2cccc1)C2=O,0 F5855-0828,Cc(n(-c1ccccc1)nc1)c1C(N(CC1)CCN1C(C(C1)C1c1cccs1)=O)=O,1 SA50-0037,Cc1noc(-c2nn(C)c(C3)c2CN3S(c(cc2)cc(OC)c2OC)(=O)=O)n1,0 Z2333538083,O[C@H](C1)C[C@H]1NC(C(CC1=O)CN1c(cccc1)c1Cl)=O,1 Z3054887199,CN1N=C(C(N(CC[C@H]2OC)C[C@@H]2F)=O)c(cccc2)c2C1=O,0 SB16-0867,CCCNC(N1[C@@H](CCN(C2)C(c3c(C)ccs3)=O)[C@@H]2COCC1)=O,0 Y600-2872,CN(c1c(C(N2C)=O)[nH]c(N(CC3)CCN3C(C3CC3)=O)n1)C2=O,1 J079-0535,CCOc(cc1)cc(C(CN2CCN(CC(N3C(C)CCCC3)=O)CC2)=C2)c1OC2=O,0 F6446-1274,O=C(CSc1ccncc1)NCC(CCC1)CN1c1nccs1,1 E957-0130,CC(C(Nc1c(C(N(CC2)CCN2c(cccc2)c2F)=O)oc2c1cccc2)=O)Oc1ccccc1,0 F3375-0887,Nc1c(C(NC2CCCCC2)=O)nnn1-c1cccc(C(F)(F)F)c1,0 F6812-6624,COc1ncc(CN(CC2)CCN2c2c(ccc(F)c3)c3ncn2)cc1,1 Z1970671330,Cc1nc(-c(cccc2)c2NC(NC2CCN(C)CC2)=O)cs1,1 F2898-2851,CC(C)S(c(cc1)ccc1C(N(CC1OCCC1)c1nc(cc(C)cc2C)c2s1)=O)(=O)=O,0 SD60-0030,COCCC1COC(C2)(CN2C(Cc(cccc2)c2F)=O)C1,0 Z3687320323,CN(CC[C@@H]1NC(c2nn(C)c3c2N=CNC3=O)=O)[C@@H]1c(cc1)ccc1F,1 Z2959745200,CC1=C(C(N(CCC2)CC2Oc(cccc2)c2OC)=O)c(cccc2)c2NC1=O,1 F6479-3251,COc(ccc(C(N(CC1)CCC1Oc(ccnc1)c1Cl)=O)c1OC)c1OC,0 F6560-4835,CC(C)C(Cn1nncc1)NC(COc(ccc(Cl)c1)c1Cl)=O,1 F6573-3389,O=C(c1cc(Br)cs1)NCCOCCn1cncc1,1 SC04-0813,COCc1nc(CCOC(CCC2)CN2C(c2cccs2)=O)no1,0 F3227-2975,O=C(c(oc1c2cccc1)c2NC(c1ccco1)=O)c(cc1)cc2c1OCCO2,1 Z3296403114,CCn1nc(C(N2C(Cc3cc4ccccc4cc3)CCC2)=O)nc1,1 Y041-7437,COc(c(OC)c1)cc(C2)c1C=CN(CC(c(cc1)cc3c1OCCCO3)=O)C2=O,1 F2040-0176,O=C(C1(CC(C2)C3)CC3CC2C1)Nc(cc1)cc(CCC2)c1N2C(c1ccco1)=O,1 Y202-7483,Oc1ccc(C(Nc2c3c(CCC4)c4s2)NC3=O)cc1,0 Z453439770,CCN(CC)c(cc1)ncc1NC(CN(C(c(cc1)ccc1F)=C(C)S1)C1=O)=O,1 Z1238989986,Cc1ccnc(N(CCC2)CCS2(=O)=O)n1,0 E616-0511,CCc(cccc1C)c1NC(C(C1(CCN(CC)CC1)O1)=C(C)C1=O)=O,0 Z1443294866,Cn(c1c2cccc1)c(C(NC(C1)CN(C3CCCCC3)C1=O)=O)c2Cl,0 SC46-0507,CC(C)c1n[nH]c(C2C3(CCCC3)CN(Cc3cccn3C)C2)n1,1 Z1966500119,CCCN(CC(O)=O)S(c(ccc(Cl)c1)c1Cl)(=O)=O,0 Z2961282819,NC(c1cc(NC(CC(CCC2)C2(F)F)=O)cs1)=O,1 Z3101018988,CN(Cc1nn(C)cc1)C(NC(C1CCC1)c(cc1)ccc1F)=O,1 S555-0877,CCNC(Nc(cc1)cc(C2)c1OCCN2C(C1CCCC1)=O)=O,1 F2812-1636,COc(cc1)ccc1SCCCC(Nc(cc(cc1)Cl)c1Cl)=O,0 F6709-3718,O=S(C1CC1)(N(C1)CC1Oc1ccncc1)=O,1 F5597-0060,COc(cc1)cc(S(N(CC2)CCC2c2nnc(-c(cc3)ccc3F)o2)(=O)=O)c1OC,0 F6472-4863,CCOc(cc1)ccc1NC(NC(CC1CC2)CC2N1C1CCOCC1)=O,0 G369-0025,O=C1NC(CC2)(CCN2S(c2cccs2)(=O)=O)Oc2c1cccc2,1 SA99-0288,NC(C(CC1CC1)(CC1)CCN1C(CCc1nc(cccc2)c2s1)=O)=O,1 Z4335630622,CC(C)CCC(Nc1nc(C(F)(F)F)no1)=O,0 L680-0426,O=S(c1cccc(Cl)c1)(N1CCN(Cc(n2-c3cc(F)ccc3)nc3c2nccc3)CC1)=O,0 F6713-5207,Cc1nc(CN(CC2)CCN2c2ncnc(-c3ccccc3)c2)no1,1 E596-0792,CCCN(c1nnc(CCCC(NCCc2c[nH]c3c2cccc3)=O)n1-c1c2scc1)C2=O,0 SB66-0004,COc(cc1)ccc1S(N(C[C@H]1CCC2)C[C@@H]1NC2=O)(=O)=O,0 SB29-0527,CCOc(ccc(CN(C[C@H](C1)OCc2cc(C)ccc2)[C@@H]1c1n[nH]c(C)n1)c1)c1OC,0 S606-1181,CCN(c1cccnc1N1[C@H](CC2)CN2C(c2cccs2)=O)C1=O,1 Z3091706880,Cc1cc([nH]c(C(N(CC2)CCC2c2cnncc2)=O)c2)c2cc1,1 F6244-3066,O=C(NCC#CCN(CC1)Cc2c1cccc2)Nc1cccs1,1 Z745185158,Cc1c(C(NC)=O)c(S(N)(=O)=O)c(C)o1,0 F6506-1684,CN(C=CC=C1C(NCC(c2cocc2)(c2cccs2)O)=O)C1=O,1 S698-1737,Cc1cnc(C2CCC2)n1C(CC1)CCN1C(NCCCOC)=O,1 F6672-1186,O=C(NCc(cc1)ccc1F)N(C(CC1)C2)C1CC2n1ncc(Cl)c1,0 D437-0291,Cc1c(-c(cc2)cc(N3)c2OCC3=O)nc(NC(CCCN(C(c2c3cccc2)=O)C3=O)=O)s1,1 S952-0256,CNC(C(CN(C1)S(N(C)C)(=O)=O)C1(CC1)CCN1c(cc1)cc(C(F)(F)F)c1C#N)=O,0 Z2376923356,CC(CC(C1)C(O)=O)CN1C(c1cc(Cl)cc2cccnc12)=O,0 F6713-4578,O=C(C=C1)N(CC(CC2)CCN2c2nccs2)N=C1c(cc1)ccc1F,1 P315-0537,COc1cc(NC(NC(CCN2c(cc3)ccc3F)C2=O)=O)cc(OC)c1,0 G853-0103,O=C(CN(c(cc1)c(C=C2)cc1S(N1CCCC1)(=O)=O)C2=O)N(CC1)CCN1C(c1ccco1)=O,1 Z1623370784,Cc1nc(cc(cc2)C(N3C(CN4CCOCC4)CCCC3)=O)c2[nH]1,1 SB16-0948,CCS(N1[C@@H](CCN(C2)C(CCCc3ccccc3)=O)[C@@H]2COCC1)(=O)=O,1 F6502-6427,Cc1cc(-c2ccncc2)nn1CCNC(N1CCOCC1)=O,1 S515-0700,O=C(C(Cc1cnccc1)(CCCC1)NC1=O)Nc(cc1)cc2c1OCCO2,1 Z3008659579,COc(cc(cc1)C(O)=O)c1S(N(C1CC1)C1COC1)(=O)=O,1 Z1569475820,COc1ccc(CN(CC2)CC2Oc2ncccc2)cc1,1 F6443-5492,O=C(c1cscc1)NCc1cc(Oc2ncccc2)ccc1,1 Z1030537932,Cc(cc(cc1)-c2noc(CCC(N(CC3)CCC3C3OCCO3)=O)n2)c1F,1 Z33461912,COC(C(CC1)CCN1C(CNC(C1CCCCC1)=O)=O)=O,1 Z1815366081,CN(Cc(cccc1)c1NC(c1cn(CC(F)(F)F)nc1)=O)C1CCCCC1,0 F6577-0678,Cc(n(C)nc1C)c1S(Nc(cn1)cnc1OC)(=O)=O,1 Z1652934946,CC1OCCC(CCNC(C(CCC2)N2C(Cc2ccccc2)=O)=O)C1,0 F0575-0009,Cc([nH]c1c2cccc1)c2SCC(N(CCC1)c2c1cccc2)=O,1 L694-0412,CC(C)N(c(ccc(S(N(CC1)CCN1C(C1(CC1)c(cc1)ccc1OC)=O)(=O)=O)c1)c1O1)C1=O,0 F6540-6078,O=C(NC1CCOCC1)N(C(CC1)C2)C1CC2F,1 SA90-0071,O=C(CC(C1)OC(CC2)(CCN2c2ncccc2)c2c1cccc2)NC1CCCC1,1 F3406-7354,Cc1nnc2n1cccc2S(N(Cc1ccc(C(OC)=O)o1)c(cc1)ccc1F)(=O)=O,1 Z3132443070,CN(Cc1cn(C)nn1)C([C@@]1(CCCC2)[C@H]2NCC1)=O,0 Z432050014,CNC(C(CC1)CCN1C(c1c[nH]nc1)=O)=O,0 Z2950281893,CC(Cc1cnccc1)NC(Nc1cnc(CCOC2)c2c1)=O,1 G212-0448,O=C(CCC(N1c(cccc2)c2N(CCC2)C2C1)=O)NCCCN1CCCC1,1 SC68-1632,O=C(c(cc1)cc(F)c1F)N(C1)CC2(CCCCC2)C1c1nncn1CC1CC1,1 Z1401106939,OC(CN1CCC(CNC(Cc2c[nH]c3c2cccn3)=O)CC1)c1ccccc1,1 D125-2185,CCOc(cc1)ccc1N(CC(C1)c2nc(cccc3)c3n2C(C)C)C1=O,0 E769-1273,Cn1c(-c2cccs2)c(CNC(NCC2OCCC2)=O)c2c1cccc2,0 Z1901584283,CC(N1C)=CC=C(CNC(CN(C=Nc2c3c(-c4cccs4)cs2)C3=O)=O)C1=O,1 F6549-1737,O=C(c(c(F)ccc1)c1F)NC(CC1)CCN1c1nsnc1,0 F6515-3893,O=C(CCc(cccc1)c1F)NCc1cncc(-c2cnccc2)c1,0 Z1692501622,CC(C)(C)c1nn(ccnc2NCCc3cn(C)nc3)c2c1,1 Z2959763770,CC(C)(c1c(C)onc1C)NC(c(cc1)cc2c1OCCNC2=O)=O,1 Z1994837760,Cc1cc(Cl)ncc1NS(C(F)(F)F)(=O)=O,0 V027-0049,CCC(C(N(CC1CC1)Cc(cc(cc1)NC(C2CCC2)=O)c1N(C)C)=O)c1ccccc1,1 F6476-1611,CS(N(CC1)CC1Oc(nccc1)c1Br)(=O)=O,0 Z1714775224,CC(N(Cc1ccccc1)C(C1CC1)C(O)=O)=O,0 F5860-3734,O=C(CCN1N=Nc(cccc2)c2C1=O)Nc1cccc2ncccc12,1 D430-0173,Cc1nc(N2CCOCC2)cc(N(CC2)CCN2C(C2CCCCC2)=O)n1,1 Z1329726220,CC(c1nc(-c(o2)ccc2Br)no1)OCC1OCCCC1,1 Z1587746159,Cc1nc(-c2ncccc2)cc(NCC(CCC2)C2OC)n1,1 F990-0138,COc1cccc(N2N=C(c3nc(-c4cccc(C(F)(F)F)c4)no3)c(cccc3)c3C2=O)c1,0 Z2996426987,CC(C1)N(Cc2nn(C)cc2C)CC11CCNCC1,1 F6469-1685,O=C(c1ccc(Cn2cncc2)cc1)Nc(cccc1)c1-c1cn(cccc2)c2n1,1 S606-1723,CN(c1cccnc1N1[C@H](CC2)CN2S(c2cc(CCC3)c3cc2)(=O)=O)C1=O,1 C712-0109,CCC1N(CCCNC(c2cc(COc3c-4c(C)ccc3)c4s2)=O)CCCC1,0 S932-3244,O=C(C1CCC1)N(CC1)CC1n1nnc(COc2ccccc2)c1,1 F6222-0499,O=C(c1cccs1)Nc1cnc(N(CC2)CCN2c2ncccc2)nc1,1 Z1281870913,CCc1nc(cc(cc2)NC(CCN3c4ccc(C)cc4)C3=O)c2o1,0 F6519-6087,O=C(C(NCC(c1ccco1)n1nccc1)=O)NCCC1=CCCCC1,1 F3386-2568,COc(c(Cl)c1)cc(Cl)c1S(n1ncnc1)(=O)=O,0 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F6792-2239,Cc1nc(CCC2)c2c(N(CC2)CCN2c2nccn3nccc23)n1,1 F5834-0982,O=C(C1c(cccc2)c2Oc2c1cccc2)Nc1cc(N(CC2)C(c3cccs3)=O)c2cc1,1 Z237075088,CC(C(NC1CC1)=O)N(CC1)CCN1C(c1c(C)occ1)=O,1 S981-0397,CCn1nc(C)c(-c2cc(C(N(CC3)Cc4c3n(C)nc4NC(C3CC3)=O)=O)no2)c1C,1 Z3217386640,CN(C(CO)c(cc1)ccc1Cl)S(c1cccc2cnccc12)(=O)=O,0 F670-0324,CC(CCc1ccccc1)NC(CCN(c(cc(C)c(C)c1)c1N=C1C)C1=O)=O,1 Z434428798,O=C(c1cc(-c(cc2)cc3c2OCO3)n[nH]1)N(CCC1)CC1c1nnc2n1cccc2,1 3381-0506,CCn1c(ccc(CN2CCN(Cc(cc3)cc(Br)c3OC)CC2)c2)c2c2c1cccc2,0 S613-0714,Cn1nc(C(N(CCC2)C2c2nc(CCOCC3CC3)no2)=O)c2c1cccc2,1 F6680-3297,Cc1cc(C(N(CCN2c3cc(OC)ncc3)CC2=O)=O)nn1C,1 Y050-2088,CCOc(ccc(S(N(CCC1)CC1C(NC)=O)(=O)=O)c1)c1Cl,0 S511-2641,CS(N(CC1)CCC11OCCC(CC(N(CC2)c3c2cccc3)=O)C1)(=O)=O,1 F6107-0001,O=C(c1ccno1)NCC(Cc1cccc(F)c1)n1cccc1,1 SC03-0332,C(COC1CCN(Cc(cc2)cc3c2OCCO3)CC1)c1noc(C2CCOCC2)n1,1 Z4093676389,CC(C(NS(CCC1CCCC1)(=O)=O)=O)n1nc(C(F)(F)F)cc1,1 Z2033582757,CC(C)C(CC1)N1C(Cc(cccc1)c1S(C)(=O)=O)=O,0 SC19-0816,CCn1nc(CN2CCC(CNC(Cc3c(C)onc3C)=O)CC2)c2c1CCOC2,1 SA92-0688,Cc1ccc(CN(CCC2)CC2(c2nc(C3CC3)no2)F)o1,1 F2147-1754,COc(cccc1C#N)c1OCC(N1CCCCCC1)=O,0 F6110-2068,CCCCS(N1CCC(CN2C(C)CN(C)CC2)CC1)(=O)=O,0 Z1602378897,CCC(CC)n(c(C)c1)nc1C(N(C)Cc1cn(CC)nc1)=O,0 F3146-0091,OC(c(cc1)ccc1OCCOc1ccccc1)=O,0 F126-0965,CC1CN(CC(CC2)CCN2S(c(ccc(F)c2)c2F)(=O)=O)CCC1,0 F6573-8253,O=C(c1ncccc1)N(CCN1c(nc2)ncc2F)CC1=O,1 6466-0216,Cc1c(Cn2ncc(NC(CSc3nc(-c4c(CC5)cccc4)c5c(C(F)(F)F)n3)=O)c2)cccc1,0 F6244-1420,O=C(CSc(cc1)ccc1F)NCC#CCN1CCCC1,1 F2496-3022,Cc1nc(C(OCc2noc(-c(ccc(F)c3)c3F)c2)=O)cs1,1 Y041-7989,N1(C(N[C@H](C1=O)CC(=O)NCCc1nc[nH]c1)=O)Cc1c(Cl)cccc1,0 Z1869912044,OC(CC1)(CCN1C(c1cc(F)cc2cccnc12)=O)C(O)=O,0 Z3402832689,CCN(Cc1cc(F)ccc1)S(c1cc(OC)ns1)(=O)=O,0 L816-0871,Cc(ccc(Cl)c1)c1N(CC1)CCN1C(c(cc1)ccc1-n1cnc(NC(C2CC2)=O)c1)=O,1 Z1220242510,CC(C)N(C)C(C(CSC1)N1C(c1cc(c(C)cc(F)c2)c2[nH]1)=O)=O,0 SC96-0225,COc(cc1)cc(CC(N(CC2)CC3(COCC3)N(CC3CC3)C2=O)=O)c1OC,0 F6435-2137,O=C(NC1(CC(C2)C3)CC3CC2C1)N(C1)Cc2c1cncn2,1 Z4635073419,Cc1c(NC(NCc(c(C)c2)cnc2Br)=O)nnn1Cc(cccc1)c1F,0 Z4767388685,O=C(c(ccs1)c1Cl)Nc(cc1)ccc1-c1nc(ccnc2)c2[nH]1,0 Z1282700330,CC(C1)OCCN1c1ncc(CNC(N2CC3(CCCCC3)OCC2)=O)cc1,1 F6680-3292,COc1nccc(N(CCN(C2)C(c(ccnc3)c3F)=O)C2=O)c1,0 K786-5512,CCC(C(NCCN(CC)c1ccccc1)=O)N1c(cccc2)c2OCC1=O,0 F5257-0113,CC(C)(COC1)N1C(c(n1CCOC)cc(C(N2C)=O)c1N(C)C2=O)=O,1 Z1254397768,CS(Nc(cc1)ccc1NC(N1CCN(CC(N2CCCCC2)=O)CC1)=O)(=O)=O,1 P578-0144,CC(CC1)CCN1c1cc(-n2cnc(C(N(CC3)CCN3c3ncccn3)=O)c2)ncn1,1 F6677-1346,CCc1nccn1CC(C1)CN1C(Nc(c(F)ccc1)c1F)=O,0 SC10-0350,O=C(C1CCC1)N(CCCN1CCOCC1)C(CC1)CN1C1CCOCC1,1 Z2598898027,Cn1ncc(C(CC2)CCN2C(CCN2Cc(cc3)ccc3OC)C2=O)c1,1 C786-2651,CC(n(c1c2)c3c2c(OC)ccc3)=NN(CC(N(CC2)CCN2C(c2ccco2)=O)=O)C1=O,0 8018-3669,CC(CCCC1C)N1C(c(cccc1)c1NC(C1CCCC1)=O)=O,1 Z1557446419,O=S(c1cc(C(F)(F)F)ccc1)(Nc1cc(CN2CCCC2)ccc1)=O,0 Z3343818385,Cc(cc(Cn1nnc(C2(CCOCC2)O)c1)cc1)c1Cl,0 F2238-0008,CCOC(N(CC1)CCN1C(CSc(n1CC2)nnc1N2c1ccccc1)=O)=O,1 F5657-0050,O=C(CC1)c2c1ccc(OCc1cccc(C(F)(F)F)c1)c2,0 Y020-9697,O=C(CC1n2ncc(-c3ccccc3)c2NC1=O)Nc(cc1)cc2c1OCCO2,1 3346-2768,CN(c1c(C(N2C)=O)n(CC(COc(cc3)ccc3OC)O)c(NCCCn3cncc3)n1)C2=O,1 S689-1576,COCCNC(C(C1)CN(C2CN(Cc3ccc(C(F)(F)F)cc3)C2)C1=O)=O,1 G804-0646,COc(cc1OC)cc(Cl)c1NC(c1ncccc11)N(Cc2ccco2)C1=O,0 F5791-1859,COc(cc1)cc(-c2cc(C(N(CC3)CCN3c3ncccc3)=O)n[nH]2)c1OC,1 F5864-0029,Cc(cc1)nnc1Oc1cccc(C(NCc(cc2)ccc2F)=O)c1,1 Z2829109321,CC(C)(CN(CC1)CCC1NCc1nc([nH]cc2)c2cc1)O,1 F673-0003,CC(c1cccc(NC(N(CC2)CCN2C2=Nc3cccnc3N(Cc3ccccc3)C2=O)=O)c1)=O,0 Z1786049839,COCCn(cc1)nc1C(Nc1cc(N2CCOCC2)ccc1)=O,1 K610-0460,Cc1ccc(C(CC(C(F)(F)F)n2nc3)Nc2c3C(Nc(cc2)cc(Cl)c2OC)=O)cc1,0 Z1671376941,CC(C)(C)C(N(CCC1)C1C(NOCc(cc1)ccc1F)=O)=O,0 F6440-3869,Cn1nc(CNC(Cc2cccs2)=O)cc1C1CC1,1 F5295-0317,O=C(CN(CCc(cc1)ccc1F)C(C1)C2CS1(=O)=O)N2c(cc1)ccc1Cl,0 Z3214658792,CC(C1)(C2)OC3(CCOCC3)C12C(O)=O,1 S760-0379,CN([C@@H](COC)[C@H](CC1)C(NCCCN(CCC2)c3c2cccc3)=O)C1=O,0 Z1425983513,OC(CCC1)CN1C(Cn1nnc(-c2ccccc2)c1)=O,1 F1142-4621,Cc1noc(C)c1COc(cc1)ccc1OCc1c(C)onc1C,1 F6184-0185,CCOc1c(C(N(CC2)CCC2c2cccs2)=O)c2ccccc2cc1,1 SA43-0857,CCOCC(N(C1)CC1(C1)CN(C)C1c1nc(-c2ccncc2)no1)=O,0 Z2440610687,CC(CN)CNC(C(Cc1ccccc1)NC(c1cccs1)=O)=O,0 S398-0924,Cc1c(C(N(C2)Cc3c2c(C(N2CCOCC2)=O)nn3C)=O)sc(C)n1,1 Z3136120362,O=C(C1CCCC1)N(CC1)CCC1(CN(Cc1ccccc1)C1)Oc2c1cccc2,1 Z1002751986,N#Cc(cccc1)c1N1CCN(CC(N(CCc2c3ccs2)C3c2ccccc2)=O)CC1,1 F6473-8172,CC(O1)=CC(OC(CC2)CCN2C(CCc(cc2)cc(Cl)c2F)=O)=CC1=O,0 F6064-8380,O=C(c1nccnc1)N(C1)CC1c1nc(-c2ccco2)no1,1 Z4387718620,O=C(C1COCC1)NC(C1)CN1C(c1cc(NC(N2)=O)c2nc1)=O,1 SC03-0352,Clc1cc(CN(CC2)CCC2OCCc2noc(C3CCOCC3)n2)ccc1,1 Z2482883048,CCN(CC(C)(C(O)=O)O)Cc1cccc(Br)c1,0 F3116-0079,Cc1nc2ccccc2nc1SCC(Nc(ccc(Cl)c1)c1Cl)=O,0 Z4021125786,CCc1c(C(N2C(CC3OCCC3)COCC2)=O)nnn1-c1cccc(Cl)c1,1 F6754-7737,COc(cccc1)c1N(CC1)CCN1C1=NC=CN(C2CC2)C1=O,0 F2507-0374,CC(CC1)CCN1C(CSc1nnc(cc2)n1nc2-c1cnccc1)=O,1 F6604-7373,N#Cc1nccnc1N1CC(CN2N=C(C3CC3)C=CC2=O)C1,1 C753-0581,CCn1c(C(O)=O)c(CNCCC2=CCCCC2)c2c1cccc2,0 S530-0234,CC(C)N(CC1)CCC1(CNC1)Oc2c1cccc2,0 SA01-0753,CC(C)NC(c1c(C(CC2)CN2C(CC2CC2)=O)nc(N(C)C)nc1)=O,0 F6806-6718,Cc1cccc(NC(CN(CCC2)CC2NC(C2CC2)=O)=O)c1,1 F6556-5410,N#Cc1cccc(C(N(CCC2)CCN2C2COCC2)=O)c1,0 Z3588151061,Cc1noc(C(CO)NC(c2cc(C)cc(C)c2)=O)n1,0 Z794558814,CCOC(C(Cc1c(C2)cccc1)N2C(c1ccccc1)=O)=O,0 F2640-0016,CS(c1nc(cccc2)c2n1CC(N(CC1)c2c1cccc2)=O)(=O)=O,1 F6445-6101,O=C(C1(CCOCC1)c1ccccc1)N(CC1)Cc2c1ncnc2,1 F6671-3484,COCc1cn(C2CC(CC3)N(Cc4ccncc4)C3C2)nn1,1 S691-0321,Cc1cnc(CC(CC2)CN2C(CCc2c[nH]c3c2cccc3)=O)n1CC1CC1,1 Z1275693598,CCC(C)(CCC1)CN1C(c(cccc1)c1NS(C)(=O)=O)=O,0 Z243111676,CCc1c(C)cc(C(NC2(CCCC2)c2noc(C)n2)=O)s1,1 Z757038650,Cc(ccc(C(N(CC1)CCN1C(c1c[nH]nn1)=O)=O)c1)c1F,0 S971-0547,OC(CC1)C1(CC1)CCN1C(c1c(-c2cccc(C(F)(F)F)c2)ocn1)=O,1 Z1619829103,O=C(Cc1cccc(OC(F)(F)F)c1)N(CCOC1)C1c1nocn1,0 Z3071578397,CC(c1nc(C(F)(F)F)cs1)NCC(C1)CC1(OC)OC,1 F2744-1206,CCOc(cccc1)c1NC(C(C=C1)=CN(Cc2cccc(C(F)(F)F)c2)C1=O)=O,0 S827-3219,CNC(c1noc([C@H](CC(C2)(F)F)N2C(Cc2ccccc2)=O)n1)=O,0 Z1218337659,CC(C)(C)C(CCC1)CCN1C(Nc1cn(CCOC)nc1)=O,0 Z2959840368,CN(CC1)CCC1OCC(N1CCC(Cc2nc(cccc3)c3[nH]2)CC1)=O,1 F6515-4500,CC(N(CC1)CCC1C(NCc1cc(-c2cccs2)cnc1)=O)=O,1 F6789-0432,Cc1cc(CN(C2)CC3(CO)C2CCCC3)no1,1 8012-4888,CCOc1cc(CCNC2c(cc3)cc(OC)c3OC(C)C(O)=O)c2cc1OCC,0 Z2061181611,Cc1nnc(NC(c2nc(C)ccc2)=O)n1C1CC1,0 Z1281725674,COC(CCC1)CN1c1nccn2c1nnc2,0 T987-2368,Cc(nc1)cnc1C(N[C@@H](CCC1)[C@@H]1C(NCc1cccs1)=O)=O,1 Z1276817456,Cc1c(CNC(Nc(ccc(F)c2)c2F)=O)c(C)nn1C,0 Z2182370814,CCC(CC)N(CC)C(NC1CCN(Cc2ccncc2)CC1)=O,0 Y600-2828,CC(CCC1)CN1c1nc(N(C)C(N(C)C2=O)=O)c2n1Cc1ccc(C)cc1,0 V004-9163,O=C(c(cc1)ccc1Cl)Nc1c(C2CC2)[nH]nc1-c1ccc(C(F)(F)F)cc1,0 F5645-0005,Cc(cc1)nnc1Oc(cc1)ccc1N(C)C(Nc1cc(F)cc(F)c1)=O,0 P053-2948,C=CCNC(c1nc(C(N(CC2)CCN2c(cccc2)c2F)=O)cs1)=O,0 F6246-2942,Cc1noc(C)c1S(N(CCC1)CC1C(N1C2CC2)=NN(CCOC)C1=O)(=O)=O,1 Z4999841276,OC(CC(CCCC1)N1C(c1cc(C(N(C2)C(CCC(N3)=O)C3=O)=O)c2cc1)=O)=O,0 Z2440215819,O=C(c1cccc(NC(c2cnccc2)=O)c1)NCCC1CNCC1,1 V023-9513,O=C(Nc1ccc(C(F)(F)F)cc1)N(CC1)CCN1c1nc(-c2cnccc2)nc2ccccc12,0 Z30830034,O=C(c(cc1)cc(NC2=O)c1NC2=O)NCc1cccc(Cl)c1,0 SB18-0330,Cc1n[nH]c([C@H](C[C@@H](C2)NC(c3ccccc3)=O)N2C(c2cn(C)nc2)=O)n1,1 F6559-1451,O=C(Cc1cccc2ccccc12)NC(CC1)CCC1(F)F,1 SB39-0437,CCS(N(CC1NC(c2noc(C)c2)=O)CC2(CCCC2)NC1=O)(=O)=O,1 F6481-0793,Cc1cc(C(N(CC2)CCSC2c(cccc2)c2Cl)=O)c(C)o1,0 F6662-0552,Cc1cc(S(N(CC2)CCC2C(N)=O)(=O)=O)c(C)cc1,0 F6510-2226,CN(c(ccc(F)c1)c1N1CCNC(c(cc2)ccc2N2CCOCC2)=O)S1(=O)=O,1 8016-6273,O=C(C(CC(N1)=O)n2c1nnc2)Nc(cc1)ccc1F,1 S835-5109,COCC1(CC(CC2)(CCN2C(c2ccco2)=O)OCC1)O,1 F6064-4575,COc(cccc1)c1-c1noc(C(C2)CN2S(C2CC2)(=O)=O)n1,1 F2278-0112,CN(C(CC1)=O)c(cc2)c1cc2NS(c(cccc1)c1F)(=O)=O,0 F6478-3510,CCc1ncnc(OC(CC2)CN2C(c2c(C)n(-c3ccccc3)nc2)=O)c1F,1 F8889-8903,NC(C1CCN(Cc(o2)ccc2Br)CC1)=O,0 F6445-6474,COC(c(cc1)ccc1S(N(CC1)Cc2c1ncnc2)(=O)=O)=O,0 Z512638698,COc(cc1)cc(CNC(C2OCCOC2)=O)c1Br,0 Z3063556673,CN(CCc(nc1)ncc1Br)c1nc(Cl)cnc1,0 F6724-4857,Cn1c(ncnc2NCC(c3ccc(-c4ccco4)s3)O)c2nc1,1 C857-0194,O=C(C(CC1)CCN1c1nnc(-n2cccc2)s1)NCCCN(CC1)Cc2c1cccc2,1 F6481-0811,Cc1c(C(N(CC2)CCSC2c(cccc2)c2Cl)=O)n(cccc2)c2n1,1 F2799-0177,O=C(C(C=C1)=NNC1=O)N(Cc1ccccc1)c1ncccc1,1 F6475-1865,O=C(c(cn1)cc(Cl)c1OC1COCC1)Nc(cccc1)c1OC(F)(F)F,0 Z3911389847,NC([C@H]([C@@H](CCC1)[C@@H]1C1)N1C(c1c2sccc2ncn1)=O)=O,1 Z3440993123,CCC(c1c(C)onc1C)NC(N(C)Cc1ccc(Cn2cncc2)cc1)=O,1 C519-0480,CN(C=C1C(NCCCN(CCC2)C2=O)=O)c(ccc(S(N2CCOCC2)(=O)=O)c2)c2C1=O,1 SB20-1445,O=C(c1cn(C[C@H](CCC2)N2C(c2nccc3ccccc23)=O)nn1)NC1CCCC1,1 Z1510124522,Cc(c(C(NCC1(CCCCCC1)O)=O)ccc1)c1S(N)(=O)=O,0 F6445-6043,O=C(c1cc(cccc2)c2o1)N(CC1)Cc2c1ncnc2,1 Z1888960990,CC(Cc1c(C)cccc1)N(C)S(c(cccc1)c1OC)(=O)=O,0 F6481-0940,Cc1cc(C)nc2nc(C(N(CC3)CCSC3c(cccc3)c3Cl)=O)nn12,1 T634-0039,Cc1noc(C)c1S(N1Cc(cc(CN2CCOCC2)cc2)c2OCC1)(=O)=O,1 Z1953220128,CC(C)c(ncnc1)c1C(N(CC1)CCN1c1cncc2ccccc12)=O,1 Z1501164032,CCc1cccc(CC(NS(c(cc2)cc(Br)c2OCC)(=O)=O)=O)c1,0 Z2527336311,NS(CCc1cn(Cc2cn(cc(cc3)Cl)c3n2)nn1)(=O)=O,0 Z2997536925,CNc1cc(-c2noc(CN(CCC3)C3=O)n2)ncn1,1 F6482-3653,Cc1csc(C(N(CC2)CCC2n2nccn2)=O)c1,1 F6789-2109,CC(C)(C)c(nc1cc2)cn1nc2C(Nc1cc(C)nn1-c1ccccc1)=O,1 Z3295309544,Cc(nc(C1CC1)nc1)c1C(Nc1ccc(Cn2ncnc2)cc1)=O,1 Z737890566,CC(Nc1cccc(S(Nc2cccc3cccnc23)(=O)=O)c1)=O,0 F5857-5112,OC(CNS(c1cccc(Cl)c1)(=O)=O)C1CCCCC1,0 F5121-0871,Cc1nn(C(CC2)CS2(=O)=O)c2nc(-c3ccco3)cc(C(NCCc(cc3)ccc3F)=O)c12,1 F6549-3655,COC(c(cc1)cc(S(N2CC(Cn3ncnc3)C2)(=O)=O)c1OC)=O,0 Z4958833109,OCc1cn(Cc(cc2)ccc2C(N(CC2)CCN2C2COCC2)=O)nn1,1 F6223-0139,CCCS(Nc1cnc(N2CCOCC2)nc1)(=O)=O,0 F5882-3004,O=C(Nc(cc1)cc(Cl)c1Cl)N1CCN(Cc2cscc2)CC1,1 Z3410095682,Cc1c(C)oc(-c(cc2)ccc2NC(c2cc3cnccc3cc2)=O)n1,1 S976-0068,O=C(C1(CN(Cc2c[nH]nc2-c2ccccc2)CCC1)F)N1CCCC1,0 F6514-7586,CC(C)c(cc1)ccc1OCC(NCCn1nccn1)=O,0 G115-0216,CCC(C1)Oc(ccc(C)c2)c2N1S(c1c(C)ccc(-c2cc(C)no2)c1)(=O)=O,0 Z1066588008,Cn(cc1)nc1C(Nc1ccc(CC#N)cc1)=O,0 Z1838177542,CC(C)C(C(O)=O)N(CCC1NC(C2(C)CCOCC2)=O)C1=O,1 SA18-0508,O=C(c1cn(CCN(CC2CC2)C2=O)c2n1)NCCCN(CC1)Cc2c1cccc2,1 F6246-1543,CN(C(C(F)(F)F)=NN1Cc2csc(-c3ccccc3)n2)C1=O,1 S993-0627,CC(C)CN(CC(N(CC1)C2CCN1S(c(ccc(F)c1)c1F)(=O)=O)=O)C2=O,1 Z1101596534,CN(C)C(c1cc(C(NCCc2cn(-c3ccccc3)nc2)=O)ccc1)=O,0 K781-5989,O=S(c(cc1)cc2c1[nH]c1nc(SCc3cccc(Br)c3)nnc12)(N1CCOCC1)=O,1 Z2974347526,Cc1cccc(C2N(Cc3cnc4n3CCOC4)CCNC2=O)c1,1 F6559-5979,O=C(C1(CC1)c(cc1)ccc1F)N1C(C2)COC2C1,1 Z1674884951,CC(C)c(cc1)ccc1-c1nnc(NC(NC(C)c2nocc2)=O)s1,1 F6513-5466,Cc1c(C(NCc2c(CCCC3)n3nc2)=O)sc(-n2cccc2)n1,1 F6245-1842,O=C(CSc1ncccn1)N(CCC1)CC1c1nnc(C(F)(F)F)o1,1 SB52-0161,CC(C)c1nc(C(C2)N(C)CC22CCN(Cc3c(C)onc3C)CC2)no1,1 Z1497277659,CC(C)(C)C(CO)N(C)S(c1cnc(ccs2)c2c1)(=O)=O,0 Z3203550469,CC(C)CCC(CO)NC(c1nc(CCC2)c2cc1)=O,0 G802-0375,Cc1c(C(CSc2nnc3n2C=CN(c(cccc2)c2OC)C3=O)=O)c(cccc2)c2[nH]1,0 Z4690852463,CC(NCc(cc1)ccc1NC(c1ccc(C)[nH]1)=O)=O,0 Z1517923657,O=C(C1CC(CCCC2)C2CC1)N1CC(Cn2nncc2)CCC1,1 Z1128031596,CC(C)CCN(C)C(c1cocn1)=O,0 Z751116624,CCCCn1nccc1NC(Cn1nc(C)c(Cl)c1C)=O,0 F1827-0067,CCN(CCN(CC(Nc1c(C(OCC)=O)c(CCCCC2)c2s1)=O)C1=O)C1=O,1 F1016-0143,O=C(CSc1nc(cccc2)c2o1)N(CC1)c2c1cccc2,1 F1716-0221,O=C(c(cccc1)c1Br)Nc(cccc1)c1-n1cccc1,1 Z2295447061,Cn1nc(C2CCCCC2)c(NC(NC(CCC2)c3c2scc3)=O)c1,1 Z4633826894,CC(C)C(C(N(CC1)CC11CCN(Cc2nccn2C)CC1)=O)c1ccccc1,1 Z2897133754,CCn(cc1)nc1C(N(CC1)CCC1c(cccc1)c1C(O)=O)=O,0 V021-0588,CN(CC1)CCN1c1nc(CCN(C2)C(Nc3cc(OC)ccc3)=O)c2c(Oc(cc2)cc(F)c2F)n1,0 8013-5600,Fc(cccc1C2NCc(cccc3)c3-n3c2ccc3)c1F,0 Z2027232594,O=C(c1nc2ccccc2nc1)N(CC1)CCC1C(O1)=NNC1=O,1 F6395-4209,O=S(c1cc(CCCC2)c2cc1)(N1CC2(CCOCC2)OCC1)=O,1 Z2996162716,CCN(c1c(C)nccc1)S(c1cc(C2CC2)nn1C)(=O)=O,0 F5857-5420,OC(CNC(C1(CCCC1)c1cccs1)=O)(CC1)c2c1cccc2,1 Z3141454182,CC(C=C(C)N1)=C(CC(N(C[C@@H]2CC3)C[C@@]23N)=O)C1=O,1 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Z813314226,CN(CCc(cc1)ccc1F)C(NCc(cc1)cnc1-n1cncc1)=O,0 Z4989108191,N[C@H](C(NS(c1cc(Cl)cc2cccnc12)(=O)=O)=O)c1cccc(Br)c1,0 F6435-5742,COc1ccc(CNC(N(CC2)CC2SC)=O)cc1,0 V028-4483,COc1cccc(N(c2c(C(N3CC4CC4)=O)n(Cc4cccc(C(F)(F)F)c4)cn2)C3=O)c1,0 Z4497727209,CC(c(cc1)ccc1N(CCN1)C1=O)NC([C@H](C[C@H](C1)O)N1C(OCc1ccccc1)=O)=O,1 M034-4831,O=C(Nc1cc(CCC2)c2cc1)N(CC1)CCN1c1ncccc1-c1nnc(C2CC2)o1,1 S939-0051,CCn1ncc(S(N(C2)C(COc(cc3)ccc3OC)CC22CCCCC2)(=O)=O)c1,1 S570-0758,COc(ccc(C(NCC1(CCC(N2Cc3ccccc3)=O)C2=CCCC1)=O)c1)c1OC,1 SB52-1493,CC(C)c1nc(C(C2)N(C)CC2(CC2)CCN2S(N(C)C)(=O)=O)no1,0 F732-0092,CCN(c(cccc1)c1Oc(cc1)c2cc1NS(c(cc1)ccc1NC(C(C)C)=O)(=O)=O)C2=O,0 F6788-3825,Cc1nc(N(CC2)CCN2c2nccn3nccc23)cc(C(F)F)n1,1 F6349-0697,O=C(c1c(cccc2)n2nc1)N(CC1)CCN1S(c(cccc1)c1F)(=O)=O,0 Z1510315468,CC(C)(C1)OCCC1Nc(cc1)ncc1C#N,1 S988-1246,Cc1noc([C@@](CN(C2)C3CCOCC3)(C3)[C@@H]2CN3C(Cc(cc2)ccc2F)=O)n1,1 F6563-0110,Cc(cc1)c(C)cc1N(CC(C1)C(N(CC2)CCC2Oc2cscc2)=O)C1=O,1 Z3560110445,CC(C)N(CC1)CCN1C(C)(C)CNc(cc12)ncc2ncnc1O,1 E989-1019,Cn1c(cccc2)c2c(-c2nn(CCCN3C(CCC(NC4CC4)=O)=O)c3c2)c1,1 Z1408628234,CC(C)(C1)c(cccc2)c2N1C(COC)=O,0 J500-0873,Cc1c(COC)c(C(N(C2)CC3(CCCC3)C2C(N(C)C)=O)=O)no1,1 SC72-0613,C(c1cnccc1)N(C1)CC11OCc2c1cnc(-c1ccccc1)n2,1 F6520-0724,O=C(Cc(c(F)ccc1)c1Cl)NCCc1ccc(-c2ccco2)s1,1 F6550-3023,O=C(CCc(cc1)cc(Cl)c1F)N(CC1)CCC1=C1CC1,0 V019-0946,Cc1ccc(C2N(Cc(cc(C)cc3)c3O)CCCn3c2ccc3)cc1,0 F6418-0114,OC(c1cccs1)c1ccc(CNC(C2(CC(C3)C4)CC4CC3C2)=O)s1,1 F2973-0328,CN(Cc1nc(cccc2)c2[nH]1)C(OCc1ccccc1)=O,1 Z4444806879,Cc1nccn1S(c(cc1)cc(C=C2)c1OC2=O)(=O)=O,0 Z3497418012,CC(C)N(CC1)CCC1NC(Cn1nnc(-c2cncc(OC)c2)c1)=O,0 V011-3601,CN(C(CN1CC2OCCC2)=C(C(c(cc2)ccc2OC)N2)C1=O)C2=O,0 F1866-0296,CCOC(C(CC1)CCN1C(c(sc1nc(C)nn11)c1O)c(cccc1)c1F)=O,1 Z4126467543,Cc1c(NCc2cc3ccccc3nc2)[nH]nc1C,1 Z760049060,CC(C)Oc(cc1)ccc1NC([C@H](Cc1c[nH]c2c1cccc2)N)=O,0 F2446-0096,Cc1cc(C(Nc2nc(-c(ccc(OC)c3)c3OC)cs2)=O)nn1C,0 F6359-0481,CCOCC(N(CC1)CCC1Oc1ncc(C(F)(F)F)cc1)=O,0 J007-1293,CCc1noc(C(CCC2)N2C(Nc(cc2)ccc2Cl)=O)c1,0 F5854-2002,O=C(Nc1c(C(F)(F)F)cccc1)N(CCc1cccs1)Cc1cnccc1,1 Z2881707046,CCCC(N(CC1)CC1c1n[nH]c(O)c1)=O,0 Z1685152604,O=C(CC(C1)c2noc(C3CCN(CC(F)(F)F)CC3)n2)N1C1CC1,1 Z1431658204,Cc1nn(CC(F)(F)F)cc1C(NCc(cc1)cnc1-n1cncc1)=O,0 Z2351789025,COCC(CCC1)CCN1S(c(cc1)cc(CC(O)=O)c1OC)(=O)=O,0 F6441-3073,COCCNC(N(CC1)CCC1S(c(cc1)ccc1F)(=O)=O)=O,0 Z2439401477,COc1nccc(NC(N(CC2)CCN2c(c(F)ccc2)c2F)=O)c1,0 Z2360703993,O=C(Nc(cc1)cnc1F)N(CC1)CC1C1CCC1,0 S997-1311,Cc1nn(CC(N2C[C@@H](CN(C3)S(C)(=O)=O)[C@]3(COC)CC2)=O)cc1,1 S576-0550,CCCN(CC1CC1)C(C(CC1)CN1C(C=NN1Cc2ccccc2)=CC1=O)=O,1 K784-2219,O=C(CSC(N1c2cccc(Cl)c2)=Nc2n[nH]cc2C1=O)Nc1c(C(F)(F)F)cccc1,1 Z1296288933,Cc1nonc1NC(C1SCCC1)=O,1 C562-1211,CC(C)CC(C(Nc(cc1)cc2c1OCCO2)=O)NS(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,1 S740-0686,CC(C)CN(C([C@H](C[C@@H](C1)NC(NCCc2ccccc2)=O)N1CC1)=O)S1(=O)=O,0 Z2863938915,CCOC(C(CC1)CCC1NS(c1cc(OC)ns1)(=O)=O)=O,1 Z929588416,O=C(C(CCCC1)N1C(c1ccco1)=O)N1CCOCCC1,1 C301-2759,CC(CN(CC1)c2nc3ccc(C)cc3nc2-n2nc(C)cc2C)N1c1ccc(C)cc1,0 SD56-0023,COCCN(C(C(C1)N2CCCN1C(c(cccc1OC)c1OC)=O)=O)C2=O,0 V007-6182,CCC(CN(Cc(c(CC)nn1-c2ccccc2)c1Oc(cccc1)c1OC)C1CC1)O,0 S740-0770,COCCN(C([C@H](C[C@@H](C1)NC(Cc2cccs2)=O)N1CC1)=O)S1(=O)=O,1 S564-0504,CC(C)CNC(N1CCC(Cc2nnc(-c3ccccc3)[nH]2)CC1)=O,1 F6796-9004,Cc1nc(CN(C2)CC(C3)C2CN3c2ncccc2F)cs1,1 Z3234814260,NCC(CCC1)N1C(OCc1ccccc1)=O,0 Z3395796176,OCC(C1)C2(CCC2)CN1c1nc(-c2cnccc2)nc2ccccc12,1 F6556-1915,Cn(cc1)c2c1cc(CCNC(C(NCc(cc1)ccc1F)=O)=O)cc2,0 V031-1253,CCC(c1ccccc1)Nc1cc(-c(cc2)ccc2OC)nc2ncnn12,1 Y501-5502,COc(cc1)c(COc(cc2)ccc2Br)cc1C(Nc1c(C(N)=O)c(CCC2)c2s1)=O,1 F6553-0623,CC(C)(C(N(CC1)CC1c1cscc1)=O)OC(C)=O,0 SC15-0295,O=C(C1CCOCC1)N1CCC(CN(CC(COc2ncccn2)C2)C2=O)CC1,1 F6822-8761,CN(Cc(ccc(Cl)c1)c1Cl)c1ncnc(OC)c1,0 F6713-5865,Cc1nnc(N(CC2)CCN2c(cc2)nnc2-c2ncccc2)s1,1 F6439-8553,CCSc(cccc1)c1C(NCCn1c2cc(-c3cccs3)nn2cc1)=O,1 F6475-0452,Cc1cc(cc(CNC(c(cc2)cnc2OC2COCC2)=O)cc2)c2[nH]1,1 J004-1174,Cc1cc(C(CCC2)N2C(c(cnn2c(C(F)(F)F)c3)c2nc3-c2ccccc2)=O)no1,0 Z1603687064,CCn1nc(C)cc1C(Nc(cc1)cc(Cl)c1OCC(O)=O)=O,0 Z1402125208,CS(NC1C(CNC(c2c3nc[nH]c3cc(F)c2)=O)CCC1)(=O)=O,1 Z3019146155,CCCC(CCC1)N1C(NCc(cc1)ccc1S(C)(=O)=O)=O,0 Z3627441330,O=C(C(CC1)CC1(F)F)Nc(cc1)ccc1OCc1n[nH]cn1,1 F1596-0127,CC(C(N(C1)C(c2ccccc2)c(cc(C)cc2)c2NC1=O)=O)Oc1ccccc1,0 V008-9815,CC(CCCC1)N1C(c(cccc1)c1N(CC1)CCC1NC(C1CCC1)=O)=O,0 Z1336450401,CCc(cccc1C)c1NS(c1c(C)nc(C)s1)(=O)=O,0 S570-0150,Cc(nc1)cnc1C(NCC1(CCC(N2)=O)C2=CCCC1)=O,1 V004-4000,Cc(c(CN(CC(COCc1ccccc1)O)CC1CC1)c1Oc2ccc(C)cc2)nn1-c1ccccc1,0 Z3799775322,CCc1nnc([C@@]23N(Cc(c(F)ccc4C)c4F)CC[C@@H]2CC3)o1,0 Z2155691762,CC(C(N1)=O)(c(cc2)ccc2-c2noc(C(C3)C3c(cc3F)cc(F)c3F)n2)NC1=O,1 S637-0355,COCC(NC1CCn2c(C3CC3)nnc2CC1)=O,1 Z3107100737,CN(C[C@H](C1)NC(NCc(cc(cc2)F)c2OC(F)F)=O)C1=O,0 F6492-0825,Cc1nc(CC(CC2)C(NCCc(cc3)ccc3F)=O)c2[nH]1,1 Z1506467833,CC(C)(C1)[C@H]1C(N[C@H](CC1)CC[C@@H]1O)=O,0 F6524-1955,O=C(Cc(cccc1)c1Br)N(CC1)CC1c1nocn1,0 F6481-0930,COc(cc1)ncc1C(N(CC1)CCSC1c(cccc1)c1Cl)=O,0 F6608-3861,CC(C)N1CCN(CC#CCOC(CC2)CCN2c(nc2)ncc2F)CC1,0 Z1602798289,C[C@@H](CN(CC1)C(c2c(N)nc(C)nc2)=O)N1S(C)(=O)=O,0 F5317-0547,CN(C=C1OC)C(C(Nc2cccc(SC)c2)=O)=CC1=O,0 F6412-1575,CN(C)S(NCC#CCOc(cccc1)c1OC)(=O)=O,0 F6471-2342,O=C(N(CCN1)C1=O)N(C(CC1)C2)C1c1c2ncnc1,1 F6414-3783,CC(CNC(c1noc2c1CCCC2)=O)(c1cc(cccc2)c2s1)O,1 Z2912334001,OC(C1(CCCC1)C(Nc1cc(OCc2cnccc2)ccc1)=O)=O,1 F6529-3994,O=C(CN(CC1)CCC1N(CC(N1CC(F)(F)F)=O)C1=O)c1ccccc1,1 M569-0220,O=S(Cc(ccc(F)c1)c1Cl)(N(CC1)Cc2c1nc(-c(cc1)ccc1F)nc2)=O,0 G017-0306,CC(C)CCNC(C1CCC(CNS(c(cc2)cc(CCC3)c2NC3=O)(=O)=O)CC1)=O,1 Z1175846041,O=C(C1CC1)N(CCC1)C1c1nc(Cc(cc2)ccc2Br)no1,1 G501-0017,CN(C)C(CNS(c(cc1)cc2c1OCCO2)(=O)=O)c(cc1)ccc1N(C)C,0 G069-0420,CC(C)(c(cc(cc1)S(N(CC2)CCN2c2ncccc2)(=O)=O)c1N1C)C1=O,1 F6512-5588,Cc1nc(S(N(CCC2)CCN2C(Cc2cscc2)=O)(=O)=O)cn1C,1 F0777-1071,O=C(c1c2cccc1)N(CNc(cccc1)c1F)C2=O,1 K979-1170,Cc(cc(c(OC)c1)NC(C(c2c3cccc2)=NN(c2cc(OC)cc(OC)c2)C3=O)=O)c1Cl,0 F6482-5480,O=C(c(o1)ccc1Br)NCc1c(-c2ccncc2)nccc1,1 Z2811067766,CC(CC(C1)NC(N(CCC2)CC2(c2ccccc2)O)=O)N1C1CC1,1 Z4053375121,CC(c1ccc(CNC(C(Cc2c3ccc(C)c2)S3(=O)=O)=O)cc1)N,1 F6554-0946,Cc1c(C(N(CCC2)CC2c2nn(C)cc2)=O)c(C)nn1C,0 F6616-2283,Cc1nn2c(NCc3ncccc3)cc(C)nc2c1,1 F6471-2357,O=C(Nc1cccs1)N(C(CC1)C2)C1c1c2ncnc1,1 F2883-0309,COC(c(cc1)ccc1NC(CSc1ncc(CO)n1Cc(cc1)ccc1F)=O)=O,0 Z2995977123,O=S(c(c1c2)c[nH]c1ncc2Cl)(N(CC1)CC11NCCC1)=O,1 F6562-9474,O=C(C1COCC1)NCc1nccnc1-c1ccco1,1 Z2089203703,CS(NCC(CCCC1)N1c1nc(C(F)(F)F)ns1)(=O)=O,0 F6573-5276,CCCOc1ccc(CCC(NCc2cnc(C3CC3)cc2)=O)cc1,0 Z2485300432,CC(C)C(N1)=NC(C)=C(C(NOC(C)C=C)=O)C1=O,0 Z1367082211,CC(c1nncn1C)NC(N1CC(Cc(cc2)cc(F)c2F)C1)=O,1 SB66-0043,CCn1c(cccc2)c2c(CN(C[C@H]2CCC3)C[C@@H]2NC3=O)c1,1 V016-5178,CC(C)CN(CC(CN(Cc(cccc1)c1O)C1)C1c1cc(OC)ccc1)C(C(C)C)=O,0 F6660-4429,COC(c(nc1)cn1-c(cc1)ncc1-c1nc(C2CC2)no1)=O,1 Z1246399770,O=C(CCc1nc(C2CC2)no1)N1CCCC1,1 Z3552764275,N#Cc(cc1)ccc1-c1c(C(NCC(C2CCC2)O)=O)nco1,1 F1621-0012,O=C(CSc1nc2ccccc2nc1SCC(N1CCCC1)=O)N1CCCC1,1 Z2832186987,CCC(C)(CCO)NC(c1nc(S(N)(=O)=O)c2n1cccc2)=O,0 F6411-1007,CCc1cccc(NC(N2CC(Nc3cccc(SC)c3)=O)=NC(C)=CC2=O)c1,0 E002-2679,COc1noc(CCC(Nc2c(C(N(CC3)CCN3c3ncccn3)=O)oc3c2cccc3)=O)c1,1 F6475-4960,Cn1nc(cc(cc2)NC(c(cc3)cnc3OCC3CCOCC3)=O)c2c1,1 F6491-0418,O=C(NCCc1ccccc1)N(CCC1)CC1Oc1nccnc1,1 F6708-9979,Cc(cn1)cnc1OC1CCN(Cc2cnccc2)CC1,1 F6438-6854,CN(Cc(cccc1)c1Br)C(COC1)C1O,0 Z2607752454,CN(Cc(cc1)ccc1NC(c(cc1)ncc1C(O)=O)=O)C1CC1,1 V021-4086,CCCNC(c1noc(-c2ccc(C3CCCCC3)cc2)c1)=O,0 T655-0606,O=S(c(cccc1)c1F)(N(C1)CC2(CCOCC2)C1c1nnc(-c2ccncc2)o1)=O,0 8019-3807,CN(c(c(O1)c2)cc(Cl)c2S(NCCc2c[nH]c(cc3)c2cc3OC)(=O)=O)C1=O,1 F5876-0008,O=C(CCC(NCCOc1cccc2cccnc12)=O)c1ccccc1,1 Z1117053769,CC(C)(C)C(N(CC1)CCN1C(Nc1c(C)onc1C)=O)=O,0 F2276-0383,O=C(c(cccc1)c1Cl)Nc(cc1)cc2c1OCCNC2=O,0 Z1085054018,CC(c1cn(C)nc1C)NC(N(CC1)CCC1Oc(ccc(F)c1)c1F)=O,0 F2167-2684,O=C(NC1CNCC1)OCC1c(cccc2)c2-c2c1cccc2,1 Z2287883852,CC(C)n1cnc(S(NC(C(C)(C)C2CCC2)=O)(=O)=O)c1,1 SB18-1061,Cc1noc(C)c1C(N(C[C@H](C1)NC(c2ccccc2)=O)[C@@H]1c1nc(C)n[nH]1)=O,1 F6764-1498,O=C(CSc1ccncc1)N(CC1)CCC1c1ccc(cc(cn2)Cl)c2n1,1 Z3584703700,CC(C)(c1nnc[nH]1)NC(c1ncc(C)nc1)=O,0 Y044-4418,CN1N=C(C(Nc2nc(ccc(OC(F)(F)F)c3)c3s2)=O)c(cccc2)c2C1=O,1 8016-2087,CC(C)N(CC(N1C)=C2C(c(cc3)ccc3O)NC1=O)C2=O,0 F6619-6567,C(CN(CC1)c2ncnc(-n3nccc3)c2)N1C(c1ccccc1)c1ccccc1,1 F6805-5237,Cc1cnc(N(C)C(CCC2)CN2c2cc(C)c(C)nn2)nc1,1 S693-1028,Cc1cnc(-c2cnccc2)n1CC(CCC1)CN1S(c1cn(C)cn1)(=O)=O,1 F6670-4745,N#Cc(nccc1)c1N1CCC(CN(C=Nc2c3cccc2)C3=O)CC1,1 F707-3216,O=C(C(CC1)CCN1c1nn2c(-c3ccccc3)nnc2cc1)N1CCCCC1,0 Z2910793785,CC(C)([C@@]1(C)CC2)[C@@]2(C(NOCc2ncccc2)=O)OC1=O,1 Y041-7059,COCCn1c(cccc2)c2c(C(NC(CC2)CS2(=O)=O)=O)c1,1 Y501-2896,COc(ccc(-c1nc2cc(C(NCc3cc(cc(cc4)Cl)c4[nH]3)=O)nn2c(C(F)(F)F)c1)c1)c1OC,1 F1913-0026,CS(N(C1CC1)C1CCN(Cc2ccccc2)CC1)(=O)=O,0 F6485-0083,CCOCC(NC(CC1)CCC1Oc1ncccn1)=O,0 F6452-0282,CC(CNS(c(cccc1)c1Cl)(=O)=O)(c(cccc1)c1F)OC,0 Z2920798125,CCN1CCN(CC(C)(C)NCc2nccc3c2CCCC3)CC1,1 SB57-1279,Cc1noc(C(C2)C(C3)(CN3C(c(cc3)cc(F)c3F)=O)CN2C(COC)=O)n1,0 Z1709865960,O=C(Cc1noc2c1cccc2)N1CC2(COCC2)OCC1,0 Z4661510027,Cc1nc(C#N)cc(N(CC2)C[C@H]2NC(c2n[nH]c3c2cccc3)=O)n1,0 Z1874319229,Cc1cn2nc(N(CC3O)CC3O)sc2n1,0 F3407-2750,Cc1cccc(CN(c(cc(C)c(C)c2)c2N=C2C3CCC2)C3=O)c1,0 V015-4526,CCC(C)c(cc1)ccc1N(C(c(cc(C(F)(F)F)cc1)c1F)=Nc1c2cccc1)C2=O,0 F795-0177,COc(cc1)cc(OC)c1NC(CN(c1c(C(N2CC3OCCC3)=O)sc3ncccc13)C2=O)=O,0 F6554-4385,O=C(Cc(ccc(F)c1)c1F)N1Cc(cc(cc2)F)c2OCC1,0 F6727-8033,CN(C)S(c(cc1)ccc1C(N(C1)CC1N(C(C=C1)=O)N=C1c1ccccc1)=O)(=O)=O,0 V023-5955,CCC(C)N(CC(N(CC1)C(COc(cc2)ccc2Cl)c2c1scc2)=O)C(c1cccc(Br)c1)=O,0 Z2329407428,CC(C)CC(c(cccc1)c1OC)NCCC(O)=O,0 Z878779218,O=C(c(cc1)cnc1-n1ncnc1)N(CC1)CCN1c(cc1)ncc1Cl,1 F6658-2444,CN(Cc(c(F)ccc1)c1Cl)C(C1)CN1c(cc1)nn2c1nnc2C1CC1,1 Z1633839211,O=C(C(C1)ON=C1c(cc(cc1)F)c1F)NCC(C1)CN(CCOC2CCCC2)C1=O,1 Z1628123121,CC(C)N(CCN(C1)C(c2csc(C3OCCC3)n2)=O)C1=O,1 Y501-4855,CCn1nc(C)c(S(N2CCN(Cc3cc(C(F)(F)F)ccc3)CC2)(=O)=O)c1C,0 S511-0309,O=C(CC1CC(CC2)(CCN2C(Nc(cc2)cc3c2OCCO3)=O)OCC1)N1CCCC1,1 F6617-2007,CSC(N1Cc2ncccc2)=Nc(cccc2)c2C1=O,1 F6524-2518,O=C(C1(CC1)c1ccccc1)N(CC1)CC1c1noc(-c2ccco2)n1,1 Z1644465608,CC(C1)C(CCCC2)C2N1C(Cc1c[nH]c2c1cccn2)=O,1 S932-7515,C(c1cn(C2CN(Cc(cc3)cc4c3[nH]cc4)CC2)nn1)OCc1ccccc1,1 Z2182203684,OC(C1)(CN1C(NCc(cc1)cnc1-n1cncc1)=O)c1ccccc1,1 F6559-1828,Cn1nc(C(NCc2nc(C3CCOCC3)no2)=O)c2c1cccc2,1 8016-0754,CCC(N(C(C1C2OCC1)c1ccco1)c1c2cccc1)=O,0 F5268-0494,O=C(C(NCc(cccc1)c1Cl)=O)NCC1(CC1)c(cc1)ccc1F,0 F5028-0041,O=S(c(s1)ccc1Cl)(N1CC(c2ccccc2)OCC1)=O,0 F6435-1862,COc1cccc(CC(N(C2)Cc3c2cncn3)=O)c1,1 Z1443258908,Oc1cccc(C(C2)OCCN2C(c(cc2)ccc2N2CCOCC2)=O)c1,1 F0696-4685,O=C(c(cc1)nnc1N1CCOCC1)N(Cc1ccccc1)c1ncccc1,1 Z991885702,CC(CCC1)CN1C(C(CC1)CCN1C(c(cc1)ccc1-n1cnnc1)=O)=O,1 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F6258-2428,CC1=C(C)N=CN(CCNC(Nc(cc2)ccc2OC(F)(F)F)=O)C1=O,0 E957-1221,COCC(Nc1c(C(N(CC2)CCN2c(cccc2)c2F)=O)oc2c1cccc2)=O,0 F2879-6308,Cc1nc2ccccc2c(NC(C(NCc2cccs2)=O)=O)c1,1 F3099-0599,CC(C(Nc1cc(C)cc(C)c1)=O)Oc1cccc(Br)c1,0 T501-0053,Cn1c(CC(CCC2)CN2S(Cc2ccccc2)(=O)=O)nnc1,0 F5831-9951,O=C(c1cscc1)NCC1(CCOCC1)c1cccs1,1 Z2869139943,CC(C1)OC(C)CN1c(cc1)ncc1NC(c1cncc(C(C)=O)c1)=O,0 M459-1026,COc(cc1)ccc1N(CC1)CCN1c1ccnc(SCC(Nc(cc(cc2)OC)c2OC)=O)n1,0 F6678-8581,Cc1nc(cccc2)c2n1C(C1)CN1S(c1c(C(F)(F)F)cccc1)(=O)=O,0 F6413-2947,O=C(c1ccc(CNC(Nc2cccc(Cl)c2)=O)s1)c1ccccc1,1 S614-0976,O=C(Nc1ccccc1)N(CCCC1)C1c1nc(CCOCC2CCCC2)no1,1 Z3077656101,OCc1nnc(CNc2nc(C3CC3)nc3c2CCC3)[nH]1,1 Z4684534886,CCn1c(C(N2CC(c3ccccc3)=CC2)=O)ccc1,0 Z1609400217,CCC(CC)CS(NC(c(cc1)cc2c1n(C)cn2)=O)(=O)=O,0 Z1574527622,CCOC(C(CO)NC(c(cc1)cc(nc2C)c1n2-c1ccccc1)=O)=O,0 F6685-8723,FC(c1cccnc1OCC(CCC1)CN1c1nccs1)(F)F,0 F6751-4247,O=C1N(Cc2ccccc2)CCN(CC2COCC2)C1,1 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Z2143074363,O=C(c(cc(cc1)F)c1F)NCCc1nc(-c(cc2)ccc2Cl)n[nH]1,0 L289-0003,O=C(C1Oc(cccc2)c2NC1=O)Nc(cc(cc1)F)c1F,0 C799-0373,CC(C)CCNC(CN(C(C1=C(C)OCCS1)=O)c(cc1)ccc1Cl)=O,1 F5067-0171,CCOc1cccc2c1oc(C(Nc1cc(C)no1)=O)c2,1 Z1690530745,Cc1c(C(N(CC2)CCC2Nc2cnccc2)=O)[nH]nc1-c1ccccc1,1 Z3277847533,CC(C)(C1)c(cc(cc2)S(NCc3nc(C)n[nH]3)(=O)=O)c2NC1=O,1 F6471-9212,Cn1c(S(C(C2)CN2C(c2nn(-c3ccccc3)nc2)=O)(=O)=O)ncc1,1 Z3474715354,CC(C)n(cc1)nc1S(N(CC1)C(C)c(cc2OC)c1cc2OC)(=O)=O,1 Z1496903311,OC(CNS(c(s1)ccc1Cl)(=O)=O)c1c(C(F)(F)F)cccc1,0 F6356-1097,CC(Cc(cc1)cc2c1OCC2)NC(Cc(c(F)ccc1)c1Cl)=O,0 SA94-0147,O=C(C(CC1)(CN1C(Nc(cc1)cc2c1OCCO2)=O)F)NCc1ccccc1,1 F6755-5532,OCC(CC1)CCN1c1c(ccc(C(F)(F)F)c2)c2ncc1,0 Z1575468886,CC1OCCC1C(NCc(cc1)cnc1-n1cncc1)=O,1 F3398-5073,CC(CCC1)CN1c1nc(C)cc(OCC(Nc2c(C(F)(F)F)cccc2)=O)n1,0 F3411-7264,Cc1nnc2n1c(cccc1)c1nc2SCC(N(CC1)CCN1c(cccc1)c1F)=O,0 F2986-0300,O=C(CS(c(s1)ccc1Br)(=O)=O)N(CC1)CCN1c(cccc1)c1F,0 Z88901234,CC(CC(O)=O)NS(c1cc2ccccc2cc1)(=O)=O,0 Z381411892,OC(c1nccc(Oc(cc2)ccc2Br)c1)=O,0 Z4743304437,O=C(c1ncnc2c1cc[nH]2)N(CC1)CCN1c1ccnc2ccccc12,1 Z2276884110,CO[C@@H](CC1)CN1S(c1c2occc2ccc1)(=O)=O,0 Z1233923749,CC(C)c1noc(NCC(NC2CCCCC2)=O)n1,1 D073-0203,Cn1c(ccc(NC(NC2CCCCC2)=O)c2)c2nc1CCNC(c1ccccc1)=O,1 Z1313231204,CCN1CCN(CC(Nc2nc(C)c(Cc3ccccc3)s2)=O)CC1,1 L414-1542,CC(C(NCCc1ccco1)=O)SC(C=C1)=NN(c2cc(Cl)c(C)cc2)C1=O,1 F6353-6424,Cc(n(C)nc1C)c1S(NCC(c1ccco1)N1CCSCC1)(=O)=O,1 Z2963764374,O=C(c(scc1)c1F)NC1(CC1)C1OCCCC1,1 Z1315985577,Cc1c(C)sc(C(N(C)C2CN(Cc3ccccc3)CCC2)=O)c1,0 F6760-2475,CC(C)Oc1c(CNC(c2nnc(CCCC3)c3c2)=O)cccn1,1 Z1279955410,O=C(C(CCC1)CN1C(c1ncccn1)=O)Nc1nccs1,1 Z841061226,CC(C)C(C(O)=O)N(C(CC1N(CCC2)CC2NC(C)=O)=O)C1=O,1 F6125-0496,O=C(C(C1)CN1C(c1cccs1)=O)N(CC1)CCN1c1ncccc1,1 F6616-2661,O=C(c1cc2nccnc2cc1)N1CCSCC1,1 Y020-1532,CC(N=C(N1)N(CC2)CCN2c(cc2)ccc2OC)=C(Cc(cc2)ccc2Br)C1=O,1 F2040-0077,O=C(COc(ccc(Cl)c1)c1Cl)Nc(cc1)cc(CCC2)c1N2C(C1CC1)=O,1 Z1318251331,CC1(C)C(C)(C)C1CNC(c1c[nH]nc1)=O,0 Z2434227656,O=C(CC1CC(CC2)NC2C1)Nc(cc1)ncc1N1CCOCC1,1 F5614-0501,Cn1c(cccc2)c2nc1CN(CC1)CCN1C(c1nc(cccc2)c2s1)=O,1 F6561-2620,O=C(COCc1ccccc1)N(CC1)CC1OCC1CC1,1 F052-1726,O=S(c(cc1cc2)ccc1nc2Nc(cc1)cc(Cl)c1F)(N1CCOCC1)=O,0 F6451-3250,COC(CNC(C1(CC(C2)C3)CC3CC2C1)=O)c1ccco1,1 F3222-5490,Cc1nc2ccccc2c(OCC(Nc2cccc(C(F)(F)F)c2)=O)n1,0 Z2346929159,CC(C)(C1)[C@H]1NC(NCc(cc1)cnc1N1CCCC1)=O,1 Z2033474804,CC1(COCC1)NC(c1c(COC)ncs1)=O,1 F6619-7125,Cc1ccc(N(CC2)CCN2C(c2ccccc2)c2ccccc2)nn1,1 4262-0020,COc(cc1)cc(CN(CC2)CCN2C(CC2)CCC2c2ccccc2)c1OC,1 G801-0282,Cc(cc(c(N1)c2)NC1=O)c2S(N(CC1)CCN1C(c1ccco1)=O)(=O)=O,1 Z1560543439,Cc(cncc1)c1NC(NCc1c(N2CCN(C)CC2)nccc1)=O,1 SC04-0795,COCc1nc(CCOC(CCC2)CN2S(Cc2ccccc2)(=O)=O)no1,0 S694-1330,Cc1cnc(-c2ccncc2)n1C(CC1)CN1C(c1nccn1C)=O,1 Z2483017785,OC(c1c(CN2CCC(CN(CCCC3)C3=O)CC2)ccs1)=O,0 F6556-5336,Cc(cc1)ccc1NC(N(CCC1)CCN1C1CCSCC1)=O,1 Z1445763455,O=C(NC(CCC1)c2c1cn[nH]2)N1CCCCCCC1,1 F6261-3589,Cc1c(CNC(Nc(cc2)cc(Cl)c2F)=O)sc(C)n1,0 V026-3365,O=C(C1CCC1)NCCNC(c1cc(c(C(F)(F)F)nn2-c3ccccc3)c2s1)=O,1 Z4988559746,O=C(C1(C2)C2C1)NC(C1)Cc2c1cccc2,1 Z1609480796,OC(c1cc(CC(N(CC2)CCC2NC(C2CCCCC2)=O)=O)ccc1)=O,1 F1424-0124,COc1cc(-c2nnc(COc(ccc(Cl)c3)c3Cl)o2)cc(OC)c1OC,0 D753-0054,COc1cccc(C(C=C2)=NN(CC(N[C@H]3CC[C@H](CN(Cc4c5cccc4)C5=O)CC3)=O)C2=O)c1,0 F6360-9426,O=C(C1CC=CCC1)N(C1)CC1Oc1cnccc1,1 S683-0524,COC[C@H]([C@H]1c2ccccc2)OCCN1S(c1cc(OC)ccc1)(=O)=O,1 Z1287893495,CC(NC(Cc1c[nH]c2c1cccc2)C(Nc1ccc(CCO)cc1)=O)=O,0 Y041-4170,O=C(Cn(cc1)c2c1ccc(Br)c2)N(CC1)CCN1S(c(cc1)ccc1F)(=O)=O,0 F1885-0599,O=C(c1cc(C(F)(F)F)ccc1)NCc(o1)nnc1SCc(c(F)ccc1)c1Cl,0 Z3687118138,C[C@H]1N(C)[C@@](CNC(c2cn(CCOC3)c3c2)=O)(CO)COC1,1 F6752-2219,O=S(C1CC1)(NC1CCN(Cc(ccc(Cl)c2)c2Cl)CC1)=O,0 Z5011984925,CCOc(cc(cc1)C(N(CC2)C(C)c(cc3OC)c2cc3O)=O)c1OCc1ccncc1,1 F6525-5462,O=S(C1CCCCC1)(NCCn1ncc(-c2cnccc2)c1)=O,1 L112-0701,COc(cc1)cc(NC(CSc2nc(N(CC3)Cc4c3cccc4)nc3ccccc23)=O)c1OC,0 F6438-0531,Cc1nc(OC)nc(C)c1NS(c1cc(C(F)(F)F)ccc1)(=O)=O,0 K284-3873,O=C1N(C2CCCC2)C(SCc(ccc(F)c2)c2Cl)=Nc2c1cccc2,0 Z2410310879,CN(CCC1N(CC2)CCC2NC(c2csc(-c3cn(C)nc3)n2)=O)C1=O,1 F6619-5920,Cn1nc(CCCC2)c2c1CN(CC1)CCN1c1nccc(C(F)(F)F)n1,1 G239-0441,Cc1cc(C)nn1CCC(NC1CCCCCC1)=O,1 Z3079321113,CC(C)(C)n1nccc1NC(c1c(-c2ccccc2)[nH]nn1)=O,1 E213-0672,Cc1c(C(Nc(cc(cc2)OC)c2OC)=O)sc(N=C2N3CCCC2)c1C3=O,0 Z3204718619,CCCN([C@@H]([C@H](CC1)C(N(CC2)[C@@H]3[C@H]2CCN(C)C3)=O)c2cncn2C)C1=O,1 Z3018712352,Cc(cc1)c(cc(C(N(CC2)CC2NC)=O)o2)c2c1F,0 F6679-2788,Cc1c(N(CC2)CC2Oc(ccnc2)c2Br)n2ncnc2nc1C,1 S823-6937,OC[C@@H](CN(C1)C2CCC2)[C@H]1NC(c1nccnc1)=O,1 SA44-0634,CN(CC(C1)(CN1C(CCc(cc1)ccc1OC)=O)C1)C1c1nnc(C2CCOCC2)o1,1 F6619-3089,COc1cc(NC(CC2)CCN2C(c(ccc(F)c2)c2F)=O)ncn1,0 Z1869656249,O=C(NCc(cccc1)c1Cl)N(CC1)CCC1c1cccc2cnccc12,0 V018-9765,COc1cccc(CN(CCCn2c3ccc2)C3c(cc2)cc(F)c2F)c1O,0 C795-0309,CCC(c1ccc(C)n1CC1)N1C(Nc(cccc1)c1Cl)=O,0 F6687-6898,Cc1cccc(OCC(CCC2)CN2C(CN(C(c2c3cccc2)=O)C3=O)=O)n1,1 F5087-0339,CC(C)n1nc(C)cc1NC(C(CC1)CCN1S(c(cc1)ccc1OC)(=O)=O)=O,1 Z1407944581,O=C(NCc1c(-n2cncc2)nccc1)NC1c2cccc(Cl)c2OC1,1 F6514-7312,CC(C)C(Cn1nccn1)NC(C1CCOCC1)=O,1 F2147-1822,Cc1cc(C(C(NC2c3cc(C)cc(C)c3)=O)NC2=O)cc(C)c1,1 F6515-0353,Cc1c(C(NCc2c(-c3cscc3)nccc2)=O)scn1,1 S858-2043,CS(N(C1)C[C@@](CO)(C2)[C@H]1CCN2C(c1nccnc1)=O)(=O)=O,0 Z3019218939,CCN(Cc1cccc(F)c1)C(C1NCc2c1cncn2)=O,0 C604-0241,O=C(CCN(C1=O)C(SCc2cnccc2)=Nc2c1sc1c2cccc1)NCC1OCCC1,1 F6524-1972,O=C(NCc1cccc(F)c1)N(CC1)CC1c1nocn1,1 S551-0538,O=C(c1cnccc1)NCc1nnc2n1ccc(-c1nc(C3CC3)no1)c2,1 F2055-0243,Cc1cccc(CC(NCCc2csc(-c3cc(F)ccc3)n2)=O)c1,0 Z4783458155,CC(C)c1cc(C(NC(C)(CC2)CCN2C(C(C)(F)F)=O)=O)n[nH]1,0 F6795-0856,Cc1nn(ccnc2N(CCC3)CCN3C(c3c4cccc3)=NS4(=O)=O)c2c1,1 K405-3242,Cc(ccc(-n1ncc2c(N3CCN(C)CC3)ncnc12)c1)c1Cl,0 F2382-0521,COC(C(CC1)CCN1C(c1cn(Cc(cc2)ccc2F)nc1OCc(cc1)ccc1F)=O)=O,1 F6525-4719,Cc(n(CCNC(c1ccco1)=O)nc1C)c1-c1ccccc1,0 F3338-0719,Cc(cc1)ccc1-n1nnc(C(NC2CCCC2)=O)c1COC,0 V004-7344,O=C(Nc(cc1)cc(F)c1F)N1CCN(Cc2noc(-c3ccc(C(F)(F)F)cc3)n2)CC1,0 F6791-8085,Cn1c(ncnc2N(CC3)CCC3C(N3C4CC4)=NN(C)C3=O)c2nc1,1 Z2483068193,OC(c1cccnc1CN(CC1)CC1Oc(cccc1)c1Cl)=O,0 F6475-4913,O=C(c(cc1)cnc1OCC1CCOCC1)N(CC1)CCN1c1nsc2c1cccc2,1 Z1684424834,CC(N([C@@H](C1)c2nc(C(c(cc3)ccc3F)(F)F)no2)c2c1cccc2)=O,0 C082-0672,O=C(CN(c(cccc1)c1O1)C1=O)N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Cl,1 Z2150390653,O=C(Nc(cccc1)c1N(CCC1)C1=O)N(CCC1)CC1C1CC1,1 E717-0568,O=C(CN(C1=O)N=Cc2c1[nH]c1c2cccc1)NCCCN(Cc1ccco1)C1CCCC1,1 F6448-2083,O=C(Cc1noc2c1cccc2)Nc1cn(CC2Oc(cccc3)c3OC2)nc1,1 L309-1250,CC(CC1)CCN1S(c(cc1)cc(N2Cc3noc(C4CCC4)n3)c1OCC2=O)(=O)=O,1 Z1279487363,CC1OC(CCC(N(CCC2)CCN2C(c(cc2)ccc2F)=O)=O)CC1,1 E203-1477,CC(C)(c(cc(cc1)S(N(CCC2)CC2C(NC2CCCCCC2)=O)(=O)=O)c1N1C)C1=O,1 Z2783295035,CCC1(Cn2nnc(C(Nc3cn(C4CCN(C)CC4)nc3)=O)c2)COC1,1 V017-6669,Cc1cccc(C(C(C(NCc2ccco2)=O)c2c3cccc2)N(C2CC2)C3=O)c1,1 SA24-0158,COC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1cc2cccnc2cc1)=O,0 V024-2716,COCCn1c(S(Cc2ccccc2)(=O)=O)ncc1CN(C1CC1)S(c(cc1)ccc1OC)(=O)=O,0 Z1154774001,OC(c1cccc(CCNS(N2CCCCCC2)(=O)=O)c1)=O,1 SA85-0278,CC(C)CN(CC(CN(C1)C(c2noc(C)c2COC)=O)O)C1=O,1 F6541-1498,C(c1nnc2n1CCC2)N(CC1)Cc2c1cccc2,1 Z1282070911,CC(C)(C)NCCNC(c1cnc2n(Cc3ccccc3)ncc2c1)=O,0 F6564-8473,Cc(ccc(Br)c1)c1C(NCCN1N=C(CCC2)C2=CC1=O)=O,0 Z1432736425,COc(ccc(NC(CN(CC1)CCC1N(CCCC1)C1=O)=O)c1)c1Cl,1 F5958-0060,Cc1cc(C)nn1CCNS(Cc(cccc1)c1Cl)(=O)=O,0 Z3655932482,CC(CNC(NCCCNC(NC)=O)=O)N(C)c1ccccc1,0 Z2108200218,Cn1c(C(c(cccc2)c2OC)NC(NCC(c2ccc(C(F)(F)F)cc2)O)=O)ncc1,0 F6750-6593,Cn1ncc(-c2cncc(N(CC3)CCN3C(CCCN3)C3=O)n2)c1,1 F6563-0099,O=C(C1(CCCC1)c1cccs1)N(CC1)CCC1Oc1cscc1,1 F6482-3428,CSc1cc(C(N(C2)CC2n2nccn2)=O)ccc1,0 Z2213469974,COc(cc(cc1)N(CC2)CCN2C(C2C(CC3)CCC3C2)=O)c1F,1 F6523-0191,CC(C(NC(CC1)CCN1c1cc(C(F)(F)F)nc(C)n1)=O)NC(OC(C)(C)C)=O,0 Z2180618975,Nc1nc(-c(cc2)c(CC3)cc2Cl)c3s1,0 F3277-1117,Cc(sc1ncn2)cc1c2SCC(Nc(cccc1)c1OC)=O,0 Z1642633415,COc(cc1)ncc1NC(N1CC2(CC2)COCC1)=O,0 Z1628416017,COCc1nc(C(COCC2)N2C(C2C(C3)C=CC3C2)=O)no1,1 M954-0712,Cc([nH]c(C)c1S(Nc(cc2)cc(F)c2F)(=O)=O)c1-c1nc(C2CC2)no1,0 G856-6479,O=C(CSc1nnc(cc2)n1nc2-c(cc1)ccc1F)Nc(cc1)cc2c1OCCO2,0 F6792-0325,Cc(c(C)n1)c(N(CC2)CCN2c2ncnc(C)c2F)nc1SC,0 Z3216015633,CN(C)C(N(CC1)CCN1c1cc(-c2cnccc2)n[nH]1)=O,0 F6064-8406,O=C(c(s1)ccc1Cl)N(C1)CC1c1nc(-c2ccco2)no1,1 Z1643578323,CCOc(cc1)ccc1N(CC(C1)C(N2CC3(CC3)COCC2)=O)C1=O,1 F6481-3326,COc(ccc(Cl)c1)c1NC(N(CC1)CCSC1c(cc(cc1)F)c1F)=O,0 G702-5976,Cc(cc1)ccc1-c1nn2c(Nc3cc(Cl)c(C)cc3)c(CCCC3)c3nc2n1,1 F6549-4136,Cn1nccc1C(CCCC1)N1S(c(s1)ccc1Br)(=O)=O,1 Z367747742,O=C(c1cn(-c(cc2)ccc2Br)nn1)NCc1cnccc1,0 L831-0034,COc(c(NC(CC(COc(cccc1)c1N1)C1=O)=O)c1)cc(OC)c1Cl,1 S591-0046,CC(C)CN(C(C1)CN1C(Cc1c[nH]c2c1cccc2)=O)C1CCOCC1,0 Z4150811309,Cc(cc1)c(C)cc1N1NC(C(NC(CC2)(CC3)CC23OC)=O)=CC1=O,1 J500-0311,COCCNC(C(C1)C2(CCCC2)CN1C(Nc(cc1)cc(Cl)c1F)=O)=O,0 V030-1734,O=C(C(CCC1)N1C(c1csc(Nc(cc2)ccc2F)n1)=O)NCc1ccco1,1 V006-0987,Cc1ccc(Cc2nc(n(-c3ccccc3)nc3)c3c(N3CCN(Cc4cccs4)CCC3)n2)cc1,0 F6471-2542,O=C(c1cc(cccc2)c2o1)N1C2C=CCC1CC2,1 SC73-1318,Cc1noc(C)c1C(N(CC1)CCC1(C1)OCc2c1n(C)nc2C(N1CCCC1)=O)=O,1 F6788-8805,CC(N(C)C(CC1)CN1c(nc1)ncc1Br)=O,0 3209-1311,CC(c1cccc(NC(c2c(N[C@@H](C[C@@H]3C(F)(F)F)c4ccc(C)cc4)n3nc2)=O)c1)O,0 F5832-8531,O=C(C(Oc1c2cccc1)=CC2=O)NCCc1csc(-c(cc2)ccc2F)n1,1 F832-0310,CCC(C)NC(CCc1nnc(c2c3)n1ccn2nc3-c(cc1)ccc1Cl)=O,0 F6495-3965,Cc1cc(NC(C(C2)CN2c2ncnc(-c3ccccc3)c2)=O)no1,1 Z2655918235,C[C@](C1)([C@@H]1NC(c(cc1)ccc1OCC(O)=O)=O)OC,0 Z2953758740,Cc1conc1CN(CC1)CCN1c1cccc(N2)c1NC2=O,1 F6222-0406,COc1ccc(CC(Nc2cnc(N(CC3)CCN3c3ccccc3)nc2)=O)cc1,1 G856-7569,COc(cc1)ccc1C(NC(CC1=O)CN1c(cc1)cc2c1OCCO2)=O,0 Z3325175334,Fc(c(-c1nc(-c2cc(OCc3cnccc3)ccc2)no1)c1)cnc1Cl,1 Z2764453816,CCC(C)(C1)CN1c1cc(N(C2)[C@H](CN(C)C)C[C@@H]2OC)ncn1,0 SB20-1104,CN(C)S(N1[C@H](Cn2nnc(C(N(CC3)Cc4c3cccc4)=O)c2)CCC1)(=O)=O,1 F6522-1046,O=C(c1ccco1)NCc1cc(-c2cocc2)cs1,1 Z1609656536,CCCCCn1c(cccc2)c2c(C(NCCCc2nc(C)no2)=O)c1,1 Z2393616963,O=C(C(C1)Oc2c1cccc2)Nc1cccc(C(NC2CNCC2)=O)c1,1 F5001-1826,Cc1cccnc1NC(Cc1noc(-c2ccco2)c1)=O,1 F6760-2032,O=C(c(cc1)nn2c1ncc2)Nc(cc1)cc2c1OCCO2,1 Z1470540107,O=C1N(CCCC2)C2=NN1Cc1nnc(-c(cc2)ccc2Cl)o1,1 Y041-8232,Cc1nc(NCC(NC(CC2)CCN2C(c2cc(cccc3)c3[nH]2)=O)=O)nc(C)c1,1 F6123-0103,CC(CCOC)(CNC(C1(CC(C2)C3)CC3CC2C1)=O)O,0 F537-0029,O=C(C(CC1=O)CN1c1ccccc1)N(CC1)CCN1S(c(cc1)cc(N2)c1OCC2=O)(=O)=O,0 Z1506153383,CC(C)(C1)[C@H]1C(Nc1c(N(C)C)ncnc1)=O,0 8015-7283,Cc(c-1c2CCc3c1nc(-c1ccncc1)nc3)nn2-c1ncccc1,1 F6513-5757,O=C(Cc1cccc(C(F)(F)F)c1)NCc1c(CCCC2)n2nc1,1 S957-0410,N#Cc(cc1)c(C(F)(F)F)cc1N(CC1)CCC1(C1)C(COCC2CC2)CN1C(C1CC1)=O,1 Z1470674881,Cc1c(C)c(NC(CC2)CCN2c2cc(OC)ccc2)nn2c1nnc2C(F)(F)F,1 F6818-1409,CCc1c(C)nc(C)nc1N(CC1)CCN1C(N=CN1C)=CC1=O,1 F6727-8365,Cc1c(C(N(C2)CC2N(C(C=C2)=O)N=C2c2cc(F)ccc2)=O)scn1,1 Z2958090844,OC1(CN(CC2)CCC2NC(c2c[nH]cc2Cc2ccccc2)=O)CCCCC1,1 Z1562304961,COc1cccc(N2CCN(CC3c(cccc4)c4OCC3)CC2)c1,1 Z1725526371,CC(C(Nc(cncc1)c1O)=O)c1ccccc1,0 F6523-1158,COc(ccc(F)c1)c1S(N(CC1)CCN1c1nccn2nc(CCCC3)c3c12)(=O)=O,1 Z4421004506,CC(C)(CNC(Nc(cc1)ccc1Oc(cccc1)c1C(N)=O)=O)C1(CCOCC1)O,1 Z2975777085,CCN(CC)CC(CC1)CN1C(NCc1noc2c1CC(C)(C)CC2)=O,1 F6481-3466,O=C(CCC(N(CC1)CCSC1c1ccco1)=O)c1ccccc1,1 Y044-3765,O=C(CCC(C(Nc1c2cccc1)=O)NC2=O)N(CC1)Cc2c1[nH]c(cc1)c2cc1F,0 Z2606683335,CC(C)c(cccc1)c1C(N(CCC1)CC1N(CCNC1)C1=O)=O,1 Y031-1192,CN(C)C(NC(c1ccccc1)c1ccccc1)=O,0 F5490-1360,OC(CC1)CCN1c1ncc(/C=C/c2ccccc2)cn1,1 E958-0333,O=C(C(CCC1)CN1c1nnc(-n2cccc2)s1)N(CC1)CCN1C(c1ccco1)=O,1 Z2966541131,CC(C)(C1)[C@H](CCC2)[C@H]2N1C(CCc1c[nH]nn1)=O,1 F6452-1453,CC(CNC(C(NCc(cc1)ccc1F)=O)=O)(c1cccc(Cl)c1)OC,0 F6805-3084,CCc1nccn1CC(C1)CN1c(ccnc1)c1Br,0 F6491-2528,Cc1c(C(N(CCC2)CC2Oc2nccnc2N(C)C)=O)snn1,1 F5875-0122,O=C(c1ccc(C(F)(F)F)cc1)NCCCOc1cccc2cccnc12,0 F755-0114,O=C(c1ccc(CN(C2=O)c3ncccc3-n3c2ccc3)o1)N(CC1)CCN1c1ncccn1,1 F6523-3819,O=C(c1ncccn1)N(CC1)CC2=C1N=C(C=CC(Cl)=C1)N1C2=O,1 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Z2898203954,CC(C1)N(Cc(cc2)ccc2OCC(O)=O)CC1c1c(C)cccc1,0 Z2648320994,COc(nc1)ncc1C(N(CC1)CCC11Oc(cccc2)c2C=C1)=O,1 Z2313474221,Cc1cnc(CN(CC23CCCCC3)C2c2ccccc2)cn1,1 F3382-3515,CC(N(CC(Nc(ccc(OC)c1)c1OC)=O)C1=O)=Nc2c1sc1c2cccc1,1 Z1832704912,CCC(C1)Oc(cccc2)c2N1C(c1c(C)nc(CC(C)C)o1)=O,0 Z1522927195,CCC(c1c(C)onc1C)NC(c1cn(C)nc1)=O,0 F6727-7976,O=C(C=C1)N(C(C2)CN2c2ncnc(C3CC3)c2)N=C1c1ccccc1,1 V020-4654,CCC(CN(CC1)CCN1c1nc(C)nc(CC)c1Cc1ccc(C)cc1)O,0 8016-1938,O=C1OCCC1SC(N1Cc2ccccc2)=Nc(cccc2)c2C1=O,1 Z1711395340,CC(C)(C)c1nnc(cc2)n1cc2C(NCC(NC1CCCC1)=O)=O,1 F6471-7281,Cc(n(-c1ccccc1)nc1)c1C(NCCCc1conc1)=O,1 Z2701194238,COCCNC(c(cc1)cnc1N1Cc2c(C(F)(F)F)cccc2CC1)=O,0 F3227-1753,O=C(c1ccco1)Nc(cc1)cc(Oc(c2ccc3)c3Cl)c1C2=O,0 Z1851828050,C[C@H](c1cccc(Cl)c1)NC(C(C=C1)=NN(c2ccccc2)C1=O)=O,1 F2880-0196,CN(C)C(CNC(Cc(cc1)ccc1F)=O)c1cccs1,0 L104-0106,CCCN(C1=O)C(SCC(NC(C)CC)=O)=Nc2c1n(C)cc2-c1ccccc1,0 S545-0537,O=C(NC1CCCCC1)N(CCCCC1)C1c1nc(-c2cnccc2)no1,1 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Z1401042721,Cc1cccc(NC(CC2)CCN2C(Cc(c(OC)ccc2)c2OC)=O)c1,1 V024-2321,COCCN(Cc(n1CC2OCCC2)cnc1S(Cc(cc1)ccc1F)(=O)=O)C(C1CCCC1)=O,0 F6556-2928,OC1(CNC(C(NCCC2=CCCCC2)=O)=O)COCC1,1 S976-1085,Cc1cn(Cc2cc(C(N(CCC3)CC3(C(N3CCOCC3)=O)F)=O)no2)nc1,1 Z3584453564,OC1(COC1)c1cnc(NC([C@@H]2[C@H](C3)[C@H]3CC2)=O)s1,1 SB27-0011,COc(cc1)cc2c1[nH]c(C(N(CC1)CCC1N(C1)C3(COCC3)CNC1=O)=O)c2,1 SA01-0911,CN(C)C(c1c(C(CC2)CN2C(c2nn(C)cc2)=O)nc(N(C)C)nc1)=O,0 J500-0190,Cc1c(CN(C2)CC3(CCCC3)C2C(NCCOC)=O)scn1,1 Z285198312,CCOc(cc1)ccc1C(NC1CCNCC1)=O,0 T957-0147,O=C(C(C(OCC1CC1)=C1)=C(CCOCC2)N2C1=O)N(CC1)CCN1c1ccccc1,0 V025-4917,CCOc(cc1)ccc1NC(N(CC1)C(CNC(NC(C)C)=O)c(cc2OC)c1cc2OC)=O,0 C429-0489,O=C(c1c2cccc1)N(Cc(cccc1)c1Cl)C2Nc(cc1)ccc1-c1nc(cccc2)c2[nH]1,1 Z1699047045,CC(c(cc1)ccc1C#N)Nc1nccc(CO)n1,0 F3411-4202,Cc1c(CN(C=Cn(c2c3)nc3-c(cc3)ccc3F)C2=O)nc(-c(cc2)ccc2Cl)o1,0 F074-0725,CCC(C(NCc1ccc(C)cc1)=O)N(C=Nc1c2sc3ncccc13)C2=O,0 Y050-1898,CC(C)NC(c1c(C)ccc(S(NCC2OCCC2)(=O)=O)c1)=O,0 C361-1048,O=C(C1CCC1)N(CC1)c(cc2)c1cc2S(N(CCc1ccccc1)Cc1ccccc1)(=O)=O,1 Z1267509322,CN(CCC1N(C)CCCC1)C(C1c(cccc2)c2OC1)=O,1 Z2170796301,CC1(C)c(cc(cc2)C(N(CCO)Cc(cccc3)c3OC)=O)c2OC1,1 D347-2111,Cc(cc1)cc(C)c1OCCn1c(cccc2)c2nc1C(CC1=O)CN1c1c(C)cccc1,0 Z1729368724,CN(CCC1)C1C(Nc(cc1)cc(CN2C)c1NC2=O)=O,1 Z1813345099,OCc1cc(Br)cc2cccnc12,0 Z2370483201,CN(C)CC(N(CC1)CCN1c1nc(C2CCCC2)ns1)=O,0 F6556-5160,O=C(c1cocc1)N(CCC1)CCN1C1CCSCC1,1 F6312-0222,CCSc(cccc1)c1C(NCCCn1c2ncccc2cc1)=O,0 F6448-2249,Cc(cc1)c(C)cc1N(CC(C1)C(Nc2cn(CC3Oc(cccc4)c4OC3)nc2)=O)C1=O,1 Z1370991089,Cc(cccc1)c1C(N(CC(c1ccco1)O)Cc1ccccc1)=O,0 SB91-0051,O=C(c1nc2ccccc2cc1)N(CCN1CCOCC1)C1CNCC1,1 Z3203075325,CCCN([C@@H]([C@H](CC1)C(N(C2)C[C@@H]3[C@H]2CCN(C)C3)=O)c2cncn2C)C1=O,0 F6524-1185,Cc1nnc2n1ccnc2N(CC1)CCN1C(c1c2ncccn2nc1)=O,1 SA71-0886,Cc1c(C(N(CCC2)CC2(CC2CC2)c2noc(C)n2)=O)ocn1,1 SA85-0537,OC(CN(CCc1ccccc1)C(C1)=O)CN1C(Cc1c[nH]c2c1cccc2)=O,1 F946-0071,CC(CC1)CCN1S(c1c(C)ccc(C(C=C2)=NN(c3c(C)onc3C)C2=O)c1)(=O)=O,1 F6482-2695,CC(C)(C)c(cc1)ccc1S(NCCC(N(CCCC1)C1C(F)(F)F)=O)(=O)=O,0 Z2375089426,CC(CC(CO)C1)CN1C(NC(CC1)CC1c1cccc(F)c1)=O,0 Z1255600637,CCC(c1c(CC2)scc1)N2C(Nc1cn(CC(F)F)nc1)=O,0 Z994989574,CC(CNC(c1cc(CCC2)c2cc1)=O)C(O)=O,0 SA70-1207,Cc1noc(C)c1CCC(N(CCC1)CC1(CCOC)c1noc(C2CCOCC2)n1)=O,1 F6556-1142,O=C(C(Oc1c2cccc1)=CC2=O)NCC1(CCSCC1)N1CCOCC1,1 F6524-5555,COc(cc1)nn2c1nnc2CNC(CC1CC1)=O,1 Y020-4015,CC(CC1)CCN1c(nc1)nc(C)c1C(N=C(N1)N(CC2)Cc3c2cccc3)=CC1=O,1 F6521-9499,COC(CNC(c1cc(cccc2)c2s1)=O)(C1)Cc2c1cccc2,1 F6482-2383,O=C(C1(CC1)c(cc1)ccc1F)NC1CC2OCCOC2CC1,1 Y501-3500,CCC(C(Nc1nn(C2CCCC2)c(C)c1)=O)n1nc(C(F)(F)F)c2c1CCC2,1 F6521-1938,CC(c1ccc(C2(CNC(C(Nc(cc3)ccc3F)=O)=O)CCCC2)s1)O,0 F1967-0920,OC(C(CC1)CCN1c(cc1)nnc1-c(cc1)ccc1F)=O,0 8010-7032,O=C(C(CC=CC1)C1C1=O)N1c(cc1)ccc1Oc1ccccc1,0 Z4879346936,Cc1ccnc(-c(cc2)ccc2NC(CC(C2)Oc3c2cccc3)=O)n1,1 Z802638174,NC(CCC1)CN1c1ncc(C(F)(F)F)cc1,0 Z361118190,O=C1N(Cc2cnccc2)N=Cc2c1[nH]c1c2cccc1,1 D393-0282,Cc1cc(C)nn1-c(n1nc2C(F)(F)F)cc(C)nc1c2-c(cc1)ccc1Cl,0 Z1610024266,C[C@H](C1)O[C@@H](C)CN1C(c1cccc(OCC(F)F)n1)=O,0 Z2606240313,Cc1n[nH]c(CNC(c2cc(C(CN)CCC3)c3cc2)=O)c1,1 F6725-0325,COc1nc(N(CC2)CCC2N(CC2)CC2O)ncc1,0 F6713-3664,CN(C(C=C(N1)N(C2)CC(C3)C2CN3c(ncnc2)c2F)=O)C1=O,1 T787-5260,O=C(C(CN(C1)S(c(cccc2)c2Cl)(=O)=O)C11CCOCC1)NC1CCCCC1,0 Z2365901396,O=C(CC1)NC1c1cccc(NC(CCCN2Cc(ccc(F)c3)c3F)C2=O)c1,1 F6480-3326,Cc1nc(OC(CCC2)CN2C(Nc(cc(cc2)Cl)c2OC)=O)nc(C)c1,0 Z2332474835,Cc(c1ccc2)c(C(N(C3)CC33COCC3)=O)[nH]c1c2Cl,1 F6472-0516,O=C(c1cscc1)NCCSC1CCOCC1,1 F6783-5580,COc1cccc(OCC(N(C2)CC(C3)C2CN3c(cc2)nn3c2nnc3)=O)c1,1 C301-8768,Cn1c(Sc(cccc2)c2NC(Nc2cccc(Cl)c2)=O)nc(N(C)C(N2C)=O)c1C2=O,0 Z1367085720,O=C(C(CC1)NS(c2cnc(ccs3)c3c2)(=O)=O)N1c(cccc1)c1Cl,1 Z1259547574,CC(C)C(Nc(cc1)cc(C(Nc2cc(C)nn2-c2ccccc2)=O)c1Cl)=O,0 Z1417216418,O=C(Cc(cc1)ccc1-c1ccccc1)NS(c1nccs1)(=O)=O,1 F6356-0490,O=C(NCCc1cocc1)Nc1c(C(F)(F)F)cccc1,0 Z4662245255,CC(C)(C)c(cc1)ccc1S(N(C1)[C@@H]2[C@H]1CNCC2)(=O)=O,1 F5882-7654,Cn1nnc(C(NCCN(CC2)CCN2C(OC)=O)=O)c1,1 Z2066082914,OC(C(CN(CC1)S(c(s2)ccc2Cl)(=O)=O)C1(F)F)=O,0 SB04-0421,CN(C)C(N(CC1)CC1N(CCNC(CCCc1ccccc1)=O)C1CCOCC1)=O,0 F6178-2587,O=S(c(cccc1)c1Cl)(NCC(CC1)CCN1c1nc(cccc2)c2o1)=O,0 Z2826584508,Cc1cccc(OC2)c1CC2NC([C@H](CC1)CC[C@@H]1N)=O,1 Z3627494988,C[C@@H](c1ccncc1)ONC(C(C1)C1=C)=O,1 SC74-1398,CNC([C@H](C[C@H]1c2nc(-c3ccccc3)no2)C[C@@H]1NC(c1nccnc1)=O)=O,1 Z1385453137,CC(C)c1nc(CNc(ccc(Cl)c2)c2C(N)=O)no1,0 F052-1064,O=S(c1cc2ccc(NCCN(CC3)CCN3c(cccc3)c3F)nc2cc1)(N1CCCC1)=O,1 F0191-5128,Cc(cc1)ccc1C(COC(c(cccc1)c1O)=O)=O,0 F6475-3000,CN(Cc1nc(cccc2)c2[nH]1)C(c1cc(OCCOC)ncc1)=O,0 Z1947727146,CC(C)(C)[C@H](C(O)=O)NC([C@@H](CC1)NC1=O)=O,0 F3411-8185,COC(c(cc(c1c2)OCC(NCc(cc3)ccc3F)=O)nc1cc(OC)c2OC)=O,1 Z4907133346,COC([C@@H](CC[C@H]1C(NC2)=O)CN1C2=O)=O,1 F6516-1683,O=C(c1c(C(F)(F)F)cccc1)NCc1ccc(-c2cocc2)o1,0 Z1498862548,NC(NC(CN(CC1)CCN1c1ccc(C(F)(F)F)cc1)=O)=O,0 Z1204852585,Cc(n(-c1ccccc1)nc1)c1C(Nc1cc(-c2nnc[nH]2)ccc1)=O,1 F5856-0201,O=C(c1csc(-n2cccc2)n1)NCCN1N=CC=CC1=O,1 Z2960016134,COc1cc(C(N(CCC2C(F)(F)F)c3c2cccc3)=O)ncn1,0 S629-1625,CC(C(N1Cc(cc(CCC(NC2CC2)=O)cc2)c2OCC1)=O)Oc1ccccc1,1 Z1395654413,CCC1N(CCN(C(C2(CCCC2)N2)=O)C2=O)Cc(cccc2)c2N(C)C1,1 E157-0818,Cc(cc1)ccc1OCC(Nc(s1)nnc1S(NCC1OCCC1)(=O)=O)=O,1 F6495-4132,Oc1cccnc1NC(C(C1)CN1c1ncnc(-c2ccccc2)c1)=O,1 CM2944-3250,Cc1noc(C)c1CC(N(CCC1)CC1OCc1noc(C2CCOCC2)n1)=O,1 Z4620629070,CCN(C(C(C)N(C(c1c2cc(C)cc1)=O)C2=O)=O)c(cc1)cc2c1[nH]cc2,1 J103-0003,CC(C)C[C@@H](C(O)=O)NC(CN1N=C(CCCC2)C2=CC1=O)=O,0 Z1698167555,O=C(c(cc1)ccc1-c1ccccc1)N(C1)c2cccc3c2C1CCC3=O,1 F6356-0921,CC(Cc(cc1)cc2c1OCC2)NC(c1c(C)oc(C)c1)=O,0 Z1538891956,Cn1ncc(C(CC(CCC2)N2C(C(Cc2ccccc2)NC(N)=O)=O)=O)c1,1 Z3091715897,CS(NCCC(Nc(cc(C(F)(F)F)c(F)c1)c1O)=O)(=O)=O,0 Z1656854688,CC(C)N(CC(C1)C(N(CC2)CC(N=CN3)=C2C3=O)=O)C1=O,1 F6483-0279,CC1=C(C)N=CN(CC(NC(CC2)CCC2Oc2ncccc2)=O)C1=O,1 Z4304417369,C[C@@H](C1)[C@H]1NC(c1c(cc(cc2)OC)n2nc1)=O,1 F6522-0505,O=C(NCc1cc(-c2ccco2)cs1)NC1(CC(C2)C3)CC3CC2C1,1 S571-0089,COc1ccc(CCC(NCC2(CCC(N3)=O)C3=CCC2)=O)cc1,0 F6550-3234,O=C(NCc(cc1)ccc1Cl)N(CC1)CCC1=C1CC1,0 K263-0785,O=C1N(Cc2cnccc2)C(SCc(cccc2)c2F)=Nc2c1sc1c2cccc1,0 Z3700064423,O=C(c1cc(-c2ccco2)nc2ccccc12)N[C@@H]1[C@H](C2)CNC[C@H]2C1,1 F6471-5612,O=C(c1noc(C2CC2)c1)N(CC1)CCC1n1nncc1,1 Z2433633920,Cc1noc(CNC(N2CC(c(c(F)ccc3)c3Cl)OCC2)=O)c1,0 Z4668467716,Cc(cc1)ccc1C(N1CC(Nc2ccc(CN)cc2)=O)=CSC1=O,1 P315-0138,Cc(cc1)ccc1N(CCC1NC(Nc2cc(C)c(C)cc2)=O)C1=O,0 Z2456806879,O=C(C1CC1)N(CCC1)[C@@H]1C(NOC1CCC1)=O,1 SB39-0419,CCS(N(CC1NC(Cc(cc2)ccc2Cl)=O)CC2(CCCC2)NC1=O)(=O)=O,0 Z2300963890,CC(C(O)=O)N(C)S(c(cc1)cc(CCC2)c1C2=O)(=O)=O,0 F0745-0075,Cc1cc(NC(CSc2nnc3n2cccc3)=O)c(C)cc1,0 F6668-0753,Cn(cc1)nc1NC(c1cccc(OC(F)(F)F)c1)=O,0 Z2528668740,Cn1ncc2c1ncnc2NC[C@H](C1)OC[C@H]1c1ccccc1,1 Z4444735062,Cc(ccnc1)c1NC(Cc(cc1)cc2c1[nH]cn2)=O,1 SD48-0515,O=C(CCc1nn(CC2CC2)c2c1COCC2)N(CC1)CCC1N1CCCC1,1 F6734-0790,CC(C)OCc1ccc(C(N(C2)CC(C3)C2CN3c(cc2)ncc2Cl)=O)o1,1 V007-4842,O=C(c1csc(COc(cc2)ccc2Cl)n1)NC(CCCC1)C1NC(Nc(cc1)cc(F)c1F)=O,0 Z1321425837,CC(c1ccccc1)NC(N1CC(Cc2cn(C)nc2)CC1)=O,0 Z2959364911,CN(C(C1)CC1OC)C(c1cc2cc(Br)cnc2n1C)=O,1 Z1897758140,C[C@@H](c1cc(O)ccc1)NC(N(CCC1)CC1C(F)(F)F)=O,0 F5735-0188,Cc1nc(-c2cc(NC(C(C3)c(cccc4)c4C3=O)=O)ccc2)cs1,1 Z2970812796,CN(C)C(C1)CN1c1c(cnn2-c(cccc3)c3F)c2ncn1,1 F5865-0176,O=C(c1ncccn1)N(CC1)CCN1c1ncnc(-n2cncc2)c1,1 Y043-2522,c1([nH]c2c(c1)cccc2)C(N1CCN(C(N[C@H](C(=O)O)C(C)C)=O)CC1)=O,0 F0616-0053,CCCn1c(cccc2)c2c(SCC(Nc(ccc(F)c2)c2F)=O)c1,0 SB75-1362,CCS(N[C@H](C[C@H]1CN(C2)C(c3ccncc3)=O)C[C@]12c1nc(C)no1)(=O)=O,0 Z3992083828,CC(C)(CN(Cc1ccccc1)C(C(C=C1)=CN(CCOc(cccc2)c2Cl)C1=O)=O)O,1 G346-0022,CC(CNC(C1CCC(CN(C(c(scc2)c2N2)=O)C2=O)CC1)=O)c1ccccc1,1 E589-5274,O=C(C(CCC1)CN1S(c(cc1)cc(C=C2)c1NC2=O)(=O)=O)Nc(cc1)ccc1OC(F)(F)F,0 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Z3062023454,Cn1c([C@H]2[C@H](CNC(C3CC3)=O)CN(Cc3cccc(Cl)c3F)C2)cnc1,1 F0898-0181,O=C(c1ccccc1)NS(c(cc1)ccc1Br)(=O)=O,0 F6549-7652,O=C(c1cc(-n2nccc2)ccc1)N(C(CC1)C2)C1CC2n1ncnc1,1 F6734-1482,Fc(cc1)cnc1N1CC(CN(Cc2ncccc2)C2)C2C1,1 Z1614714345,COc(cc(cc1)NC(c2nc(-n3cncc3)ccc2)=O)c1Br,0 F6573-0007,Cn1nccc1-c1ncc(CNC(c2ccco2)=O)cc1,1 F5854-2786,O=S(Cc(cc1)ccc1F)(N(CCc1cccs1)Cc1ccco1)=O,1 Z4966605297,O=C(N[C@@H]1[C@@H]2[C@H]1CCC2)Nc(cc1)ccc1-c1csc(N2CCOCC2)n1,1 Z2238835693,CCn1c(C)nc(S(N(CC2)CC(C)(C)CC2O)(=O)=O)c1,0 F6604-1913,CN(CCn1nncc1)C(C1)CN1c(cc1)nn2c1nnc2C1CC1,1 F6477-5242,Cc1cc(-c2csc(Nc(cc3)cc4c3OCO4)n2)c(C)o1,1 Z4990112018,CCC(C)C(C)C(NC1(CC1)C(CCC1)N1C(c1coc(C#N)c1)=O)=O,1 Z2440782683,O=C(C(CC1)CCN1c1nc(cccc2)c2o1)N1C2CNCCC1CC2,1 Z3303899118,CC(C)C(CC1)CC1(C(O)=O)n1cncc1,1 Z1421517181,CN(CCc(cc1)c2cc1NC(c(nc(N1CCCC1)nc1)c1Cl)=O)C2=O,1 F6549-7750,O=C(Nc(cc1)cc2c1OCO2)N(C(CC1)C2)C1CC2n1ncnc1,1 V007-5482,CC(C)CC(Nc(cc1)cc(C(N2CCCC2)=O)c1N(CC1)CCN1C(c(cc1)ccc1Cl)=O)=O,1 F3382-4539,COc1c(CNc(cc2)nnc2S(Cc(cc2)ccc2Cl)(=O)=O)cccc1,1 S428-0510,Cc1cc(C(N(CCC2)C2c2nc(C3CCOCC3)no2)=O)c(C)n1CCCOC,1 Z2033140237,CC(C)c1c(C(N(CCC2)CCC2N2CCCC2)=O)occ1,1 Z1981984715,CCNC(N(CC1)CCN1C(c1nc2ccccc2nn1)=O)=O,1 F6788-7836,CN(CC(C1)CN1c(nc1)ncc1Cl)S(C)(=O)=O,0 F3225-7479,CC1=NN(c2ccccc2)C(NC(c2ccco2)=O)=C(c(cc2)ccc2OC)C1=O,1 Y040-2661,CC(C(O)=O)NC(C(C)Oc(cc1)cc(O2)c1C(CCCC1)=C1C2=O)=O,0 F5614-0152,COc(ccc(Cl)c1)c1C(N1CCN(Cc2nc(cccc3)c3[nH]2)CC1)=O,0 F6436-1578,O=C(c1ccco1)N(CC1)Cc2c1ccc(NC(c(cc1)ccc1-c1cscc1)=O)c2,1 F980-0306,Cc1cc(C)nn1Cc1ccc(C(N(CC2)CCN2C(C=C2)=NN(c(cc3)ccc3F)C2=O)=O)o1,1 Z16077185,CC(C(c(cc1)ccc1NC(C)=O)=O)Sc1nc(ccc(OC)c2)c2[nH]1,0 Z4368310531,CCOC(C(C)(C)CS(NC([C@@H](C1)[C@H]1C1CC1)=O)(=O)=O)=O,1 Z2088875971,N#Cc1cc(N(CCC2)CC2c2nc(cccc3)c3[nH]2)ncc1,0 F6523-1145,COc(ccc(CC(N(CC1)CCN1c1nccn2nc(CCCC3)c3c12)=O)c1)c1Cl,1 Z3493082128,Cn1nc(C(F)(F)F)cc1CC(N(CC1C2)CC12C(O)=O)=O,1 Z808566814,OC(CC(CCC1)N1C(c(cc1)cc2c1OCCCO2)=O)=O,1 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Z2705931000,NC(NC(CCN[C@@H](C1)[C@@H](C(F)(F)F)Oc2c1cccc2)=O)=O,0 Z4966620320,C[C@H](CO)N(C)S(C(C1)C1c(cc1)ccc1Br)(=O)=O,0 Y044-3767,CCN1C(CNC(CN(C(C)=Nc(cc2OC)c3cc2OC)C3=O)=O)CCC1,1 SB03-0040,CCn1nc(C)c(C(NCCN(C2CCOCC2)C(CCC2)CN2S(C)(=O)=O)=O)c1,0 Z3071630671,CC(C1)N(C)CCC1NCc(c(Cl)nc1c2)cc1ccc2F,1 C301-9589,COc(cc1)cc(S(NC(C(Oc2c3cccc2)=O)=C3NCC2CCCCC2)(=O)=O)c1OC,0 8020-5643,OC(c(c(NC(C1)=O)c2C1C(F)(F)F)cn2-c1cc(F)cc(F)c1)=O,1 S248-2798,O=C(c(cc(cc1)F)c1F)N1CC(Cc2noc(C3CC3)n2)CC1,1 F6791-9608,CN(CC1OCCOC1)c1nc(COC)ns1,1 Z2359001938,Cc(onc1N)c1S(N(CCc1ccc2)Cc1c2Cl)(=O)=O,0 Z2174415434,Cn1nnc(CC2)c1CC2C(N(CC1)CC1(F)F)=O,1 Z1890169787,COc(cccc1)c1-c1nc(-c2nocc2)no1,1 F6471-6327,O=C(CC1CC1)NCc1cc(-c2cscc2)cnc1,1 Z1252547814,CC1N(CCc2nc(-c3ccccc3)no2)CCNC1=O,1 Z1675698925,CC(C)c1nnc(C2)n1CCN2C(C1c(cc(cc2)Cl)c2OCC1)=O,1 J004-1302,CC(C)c1noc(C(N(CCC2)C2c2noc(C(C)C)c2)=O)c1,1 Z1411217973,COc1cc(N(CCC2)CCN2c2ncccc2)cc(OC)c1,0 F6441-6999,Cn1c(S(C(CC2)CCN2C(c(cc(cc2)OC)c2Br)=O)(=O)=O)nnc1,0 Z810640952,Cc1cc(C(NC2(CCCCC2)C(N)=O)=O)c(C)n1-c1nccs1,1 Z1274349382,NC(C(CC1)(CCN1C(CC1CCC1)=O)c1ccccc1)=O,1 Z1863754324,CC(CC(N(CC1)CCN1C(c1c(C)oc(C)c1)=O)=O)(F)F,1 S633-7542,CNC(N(CCC1)C1c1nc(C(C2)CN2C(c(ccc(OC)c2)c2OC)=O)no1)=O,1 F5679-0035,O=C(Cc1csc(-n2cccc2)n1)NCCOc(cc1)ccc1F,1 Z4521693395,O=C([C@@H]1[C@@H]2[C@H]1COC2)N(C1)C[C@@H](C2)[C@H]1CN2C(C(N1)=COC1=O)=O,1 D337-1304,O=C(c1noc(-c(cc2)cc3c2OCCO3)c1)Nc(cccc1)c1C(c1ccccc1)=O,1 Z3080585649,Cc1cc(C)nc(OC)c1CNC([C@@H](C1)[C@H]1c1ccncc1)=O,1 F5461-0019,CC(C)(C(N1CCN(Cc2nc(C)cs2)CC1)=O)Oc(cc1)ccc1Cl,0 Z4946618659,Cc1ccc(CC(CNC(c(cc2)cc3c2n(C)cc3)=O)C(O)=O)cc1,0 E984-0077,CCN(CC)CCCNC(C(C)N(c1cc(C)nn1CC1)C1=O)=O,1 M183-0163,O=C(CN(C(c1c2cccc1)=O)N=C2N1CCCC1)Nc(cc1)cc2c1OCCO2,1 Z4896679134,CC(C([O-])=O)N(C)C(Nc(ccc(-c1nc(cc(C)cc2)c2o1)c1)c1F)=O,0 Z3339869340,CCCc1nonc1NS(c1cnc(C(C)(C)C)cc1)(=O)=O,0 Z2004652459,CS(C(CC1)CN1C(CCc1cc(cccc2)c2o1)=O)(=O)=O,0 S606-2071,Cc1nc(S(N(CC2)C[C@@H]2N(c2ncccc2N2CCOC)C2=O)(=O)=O)cn1C,0 Z3582297445,CCNc(cc1)ncc1NC(C1(CC1)O)=O,0 F2722-0033,CC(N1c(cc2)cc(NC(c(cc3)cc4c3OCO4)=O)c2Cl)=Nc(cccc2)c2C1=O,1 F6559-0475,O=C(CSc(cc1)ccc1F)N(CCC1)CC1N(C=Nc1c2cccc1)C2=O,1 Z2897438109,OC(C1(CN(Cc2cc(ccnc3)c3s2)CC1)C(F)(F)F)=O,1 F6250-0066,O=C(c(c(F)ccc1)c1Cl)NC(CCC1)CC1OC(Nc1ccccc1)=O,0 Z4765682202,CC(CN(CC1)C(C(c(cccc2)c2N2)=CC2=O)=O)N1c1cccc(Cl)c1,0 Z2051096215,CCNC(N(C1)[C@H](COC)C[C@@H]1OC)=O,0 Z2996683842,OC(C1N(Cc2coc(C3CC3)n2)CCOc2c1cccc2)=O,1 Z4348196532,Oc1ccc(C(CC2)CN2C(C(NCCCN(C(C2(CCCCC2)N2)=O)C2=O)=O)=O)cc1,1 J097-0171,CN(c(ccc(C(Nc(cccc1)c1C(NCCOC)=O)=O)c1)c1-c1c2cccc1)S2(=O)=O,0 SC72-0883,CCCc1nc(COC2(C3)CN3C(CCc3c(C)onc3C)=O)c2cn1,1 F1757-0342,O=C(CN(CC1)CCN1c(cccc1)c1F)Nc(cc(cc1)Cl)c1Cl,0 D470-1765,O=S([C@@H](CS(C1)(=O)=O)[C@H]1NCCc1c[nH]c2c1cccc2)(c1ccccc1)=O,1 E756-0345,Cn(c(cc1)c2cc1OC)c(C(Nc(cc1)cc(OC)c1OC)=O)c2N(CCC1)C1=O,0 Z1755670720,Cc1nnc([C@@H](C[C@@H](C2)OC)N2C(Nc(cc2)cnc2OC)=O)o1,0 F432-0587,CN(c(c(N1C)c2)cc(NS(c(ccc(F)c3)c3F)(=O)=O)c2Sc(cc2)ccc2F)C1=O,0 F6562-8293,O=C(Cn1nnc2c1cccc2)NCC1c(cccc2)c2OC1,1 SA96-1151,CC1(CCCCC1)C(N(C1)CC1(CN(Cc1ccccc1)C1)C1C(NC)=O)=O,1 8009-1150,CC(C)NC(C(NCc(cccc1)c1Cl)=O)=O,0 SB33-1485,Cn1ncc(C(N(C[C@@H]2c3nc(-c4ccccc4)n[nH]3)C[C@@H]2NC(COC)=O)=O)c1,1 T505-1316,Cc1cc(C(N2C(CCn3nnc(C(NC4CC4)=O)c3)CCCC2)=O)nn1C,1 Z2668835951,CN(Cc1cc(O)ccc1)C(c1nc(cncc2)c2s1)=O,1 F1967-1312,CCOC(C(C)N(C(C=C1)=O)N=C1n1nccc1)=O,1 F5526-0609,CCCCOc(cc1)ccc1C(NCCOc(cc1)cc2c1OCO2)=O,0 Z2897344850,CC(CC1)(CCN1C(C(CC1)CCN1OC)=O)C(O)=O,0 Z367984054,CC(C1OCCC1)NC(C(CCC1)CN1C(c1ccc(C)cc1)=O)=O,1 SC21-0010,CCn(c(CC1)c2CN1C(NC1CCCCC1)=O)nc2-c1ncc(C)n1CC1CC1,1 G396-0603,Cc1c(CNCCOC)c(C(O)=O)c(C)n1Cc(cc1)ccc1Cl,0 Z2722708032,Cc1cc(NC(C(CC2=O)CN2c(ccc(OC)c2)c2OC)=O)cc(O)c1,0 Z3338742256,Cc1nscc1NS(c1c[nH]c(C(N2CCCC2)=O)c1)(=O)=O,1 F3375-2641,CCOc(cc1)ccc1-n1nnc(C(Nc2c(C(F)(F)F)cccc2)=O)c1N,0 Z2072186612,CC(C)c([nH]cc1)c1C(NC(CC(N)=O)C1CCCCC1)=O,0 F6438-1959,O=C(C1CCCC1)N(CC1)CCN1c1cnnc(N2CCOCC2)c1,1 V019-8082,O=C(C(C1)CN(Cc(cc2)ccc2F)C1=O)N1CCCC1,0 SA49-0148,COc1ccc(C2(CC2)C(N(C2)CC22OCC(CC(NCC3CC3)=O)C2)=O)cc1,1 E157-0906,CC(C(Nc(s1)nnc1S(N1CCCCC1)(=O)=O)=O)Oc1ccccc1,1 F0679-0662,CC(C)(C)n1ncc2c1N=CN(Cc1ccc(C(OC)=O)o1)C2=O,1 Z68214533,Cc1cccc(C(NCCCN2CCOCC2)=O)c1O,1 F0818-0004,COc(cc1)ccc1S(N1CCC(CN(C(c2c3c4cccc3ccc2)=O)C4=O)CC1)(=O)=O,1 F6672-0079,O=S1(CCC(CN(C(CC2)C3)C2CC3n2nccc2)CC1)=O,1 S951-5294,COCC(N(CCN(C1)c(cc2)cc(C(F)(F)F)c2C#N)C1C(NC1CC1)=O)=O,0 K292-0954,CCC(C)N(C1=O)C(SCc(ccc(F)c2)c2Cl)=Nc2c1scc2,0 L707-1417,CC(Cc1ccco1)NC(CN(c(cc1)c(CCC2)cc1S(N1CCOCC1)(=O)=O)C2=O)=O,1 Z3345606016,CC(CN[C@@H](Cc1ccccc1)C(O)=O)(C(F)(F)F)O,0 Y031-4069,CC(C)c(cccc1)c1NC(C(C1)CN(C2CCCC2)C1=O)=O,0 SA31-0324,CC1(C(NCCCc2ccccc2)=O)n2c(C3CC3)nnc2COC1,1 F6808-5800,Cc1nnc(N(CC2)CCC2(c2ccccc2)C#N)s1,0 Z2480758956,Cc(c(CNc(cc1)cc(CCC2)c1NC2=O)c1)nn1-c1cc(C)ccc1,0 G587-0566,CN1c(cc(cc2)C(NCCc3c[nH]c(cc4)c3cc4Cl)=O)c2N(CCCC2)C2C1=O,1 Z2445728773,CCN(CC(C1)C(N2)=Nc3cccc(F)c3C2=O)C1=O,0 SC73-1275,Cc(nc1)cnc1C(N(CC1)CCC1(C1)OCc2c1n(C)nc2C(N1CCCC1)=O)=O,1 F5857-3879,CC(Cc(cc1)ccc1OC)(CNC(COc(cccc1)c1OC)=O)O,1 SB91-0140,O=C(NCCc1ccccc1)N(CCN1CCOCC1)C1CNCC1,1 Y041-6411,CC(Nc1cccc2c1ccn2CC(NCC(C1)C2C=CC1C2)=O)=O,1 SC08-0109,Cc1noc(C)c1CN(C1)CC1c1nc(C(CC2)CCN2S(C)(=O)=O)no1,1 F6472-7951,O=S(c(cc1)ccc1OC(F)(F)F)(N(C1)CC1N(CC1)Cc2c1cccc2)=O,0 SB52-0274,CN(CC(C1)(CC2)CCN2C(NC2CCCC2)=O)C1c1noc(COC)n1,1 F6469-3352,Cc1cccn2c1nc(-c(cccc1)c1NS(c1cn(C)cn1)(=O)=O)c2,1 D531-0396,CN(c(ccc(NC(c1c2cccc1)=C(C(N)=O)S2(=O)=O)c1)c1N1C)C1=O,1 Z3016432705,NCCC(C1)CC1NC(c1cc2ccccc2cc1)=O,1 Z1433338023,CC(c1ccc(C(Nc2cc(-c3nc(C)co3)c(C)cc2)=O)s1)=O,0 F431-0100,CN(c(c(N1C)c2)cc(NC(c(cc(cc3)Cl)c3OC)=O)c2SC2CCCCC2)C1=O,0 F5141-0058,CS(N(CCCC1)C1C(Nc1nc(-c(cc2)ccc2F)cs1)=O)(=O)=O,1 V021-2473,CC(CC1)CCN1c1nc(Oc(cc2)ccc2OC)c(CN(Cc2c(C)ccs2)CC2)c2n1,0 Z3390537011,NC(C(CC1)CN1c(c(F)cnc1)c1Cl)=O,0 T409-0556,CCC(N(CC1)CCN1c1nc(CCC(C2)C(N(CC3)CCN3C(C)C)=O)c2s1)=O,1 Z2440858964,O=C(c1cc(CCc2c-3cccc2)c3s1)N(CCC1)CC1N(CCNC1)C1=O,1 Y205-7895,CC(CC(Nc1c(C(Nc(cccc2)c2OC)=O)c(CCC(C)C2)c2s1)=O)CC(O)=O,0 F6782-7659,CC#CCN(C=CN(c(cc1)ccc1Br)C1=O)C1=O,0 F5535-0025,COc1cccc(NC(Nc(cc2)cc(CCC3)c2N3S(c2ccccc2)(=O)=O)=O)c1OC,1 F6436-1461,O=C(CCc1ccc(C(F)(F)F)cc1)Nc1cc(N(CC2)C(C3CC3)=O)c2cc1,0 Z3416726875,CN(C)C(C(c1c(CC2)n(C)nc1)N2C(c1cnc(-c2ccccc2)nc1)=O)=O,1 C884-1651,CCC(C(NCCCN(CC)c1cc(C)ccc1)=O)n1c(C(N(C)N=C2)=O)c2c2c1cccc2,1 Y042-6937,O=C(CC(c1c2cccc1)NC2=O)NCCc1nc(cccc2)c2[nH]1,1 F1841-0048,COc(cc1)ccc1C(NCCc1cn(ccs2)c2n1)=O,1 Z2370554084,Cc1cc(N(C[C@@H]2C(F)(F)F)C[C@@H]2C(N)=O)nc(C2CC2)n1,0 L949-1341,O=C(NC1CCCC1)N(CCC1)C1c1nc(-c2cccc(Cl)c2)no1,0 F6400-1386,O=C(COc(cc1)ccc1F)N1C(CN2CCOCC2)CSCCC1,1 Z4784480697,CC(C)([C@H](C1)C(OC)=O)[C@@H]1NC(NCc(cc1)cc2c1n(C)c(C)c2)=O,1 M414-3198,CCCn1c(ccc(CNC(C2CCCC2)=O)c2)c2nc1,1 F3385-5747,Cc(cc(cc1O/C2=C\c3cn(C)c4c3cccc4)O)c1C2=O,1 F2590-1699,Cc1c(C)sc(NC(Cc(cccc2)c2Cl)=O)c1C(OC)=O,0 Z2974470094,CC(C)c1cc(N(C2)CC2c2n[nH]c(C)n2)ncn1,0 Z3686246380,Cc1nc(-c2ncccc2)cc(N[C@H](CC2)CN2C(N(C)C(N2C)=O)=CC2=O)n1,1 Z4107124371,CCc1c(CNC(c2c(C[C@@H](C)O[C@H]3C)c3nn2C)=O)c(C)no1,0 F6556-8814,O=C(c1cc(Br)cnc1)NC(c1cscc1)c1cccs1,0 Z1870084886,CC(C)Cc1c(C(N(CC2)CCC2(C)C(O)=O)=O)sc(C)n1,0 F6723-0194,Cc1nc(CN(CC2)CCN2c2ncc(C(F)(F)F)cc2)cs1,1 F6564-8190,CC(C(NCCN1N=C(CCC2)C2=CC1=O)=O)Oc(cccc1)c1F,1 Z992718842,Fc(cc1)cc(F)c1-c1csc(C2CCNCC2)n1,0 Z1748558314,CC1(CNC(Cc2nnc(NC)s2)=O)N(Cc2ccccc2)CCC1,1 F6353-5936,O=C(C(NCc1ccco1)=O)NCC(c1cocc1)N1CCSCC1,1 T502-1468,O=C(C(CC1)(CCN1S(c1cnccc1)(=O)=O)F)N1CCCC1,1 Z459863726,O=C(c1cc(Cn2cncc2)ccc1)NCCCN1CCCC1,1 Z1532852229,COC([C@H](Cc1c[nH]cn1)NC(CCN(c(cccc1)c1C(N1)=O)C1=O)=O)=O,1 T424-0202,O=C(C(CCC1)CN1C(C=NN1)=CC1=O)NCCCN(CCC1)c2c1cccc2,1 F6785-6287,O=C(c1c2OCCOc2ccc1)N1CCC(COc(cc2)nn3c2ncc3)CC1,1 F6452-0362,CC(CNS(c1c(C)n(C)nc1C)(=O)=O)(c(cccc1)c1F)OC,0 F6192-0146,O=C(c(o1)ccc1Br)NCC(c1ccco1)c1ccco1,1 Z2917206325,CNC(N1Cc2cc(C3CC3)nn2CC1)=O,0 F6672-2223,COc1ccc(CCNC(N(C(CC2)C3)C2CC3=C2CCC2)=O)cc1,1 F5655-0374,CCOC(N(CC1)CCN1C(c1csc(-c2cc(cccc3)c3n2C)n1)=O)=O,1 F6525-4424,Cc1cc(C(NCCn2ncc(-c3ccccc3)c2)=O)c(C)o1,1 V005-9043,COc1cccc(S(N(CC2)CCC2c2cn(Cc3ccc(C(F)(F)F)cc3)c3c2cccc3)(=O)=O)c1,0 Z2453284384,CCNC([C@H](CCC1)N1C(C1CC1)=O)=O,0 F6525-2943,Cn(c(CNC(C1COCC1)=O)c1)nc1-c1cnccc1,1 SA68-1072,Cc1cc(C(NCCN(C(CC2)CCN2S(C)(=O)=O)C2CCOCC2)=O)no1,1 F6734-2606,Cn1nccc1C(N(C1)CC(C2)C1CN2c1nnc(C2CC2)cc1)=O,1 Z3016313400,Oc(cccc1)c1C(NCCc1nc(CCOC2)c2s1)=O,1 Z993395112,CC(C)(C)OC(CN(C)C(Cn1c(cccc2)c2c(C)c1)=O)=O,0 Z208333742,CN(C)C(N(CC1)CCN1C(C=NN(c1ccccc1)C1=O)=C1Cl)=O,0 F3215-0168,Cc1cccc(OCc2nnc3sc(-c4ccccc4)nn23)c1,1 Z1744687219,Cn1c(ccc(Cl)c2)c2nc1CNC(C1(CCOCC1)c(cc1)ccc1F)=O,0 F6471-2340,O=C(c1csc(-c2ccccc2)n1)N(C(CC1)C2)C1c1c2ncnc1,1 Z4919116133,CCC(C1)C1C(N1CC(C2)(CN2C(C(C(C)C)F)=O)CC1)=O,1 Z3433760053,CC(C(CC1)c(cc2)cc(F)c2F)N1C(C)=O,0 F6480-3720,O=C(c(s1)ccc1Cl)N(CCC1)CC1Oc(nc1)ncc1F,0 Z5054602702,Cc1conc1CNC(c1c(-c(cc2)ccc2F)ocn1)=O,1 E793-3986,O=C(CSC(N(CCc(cc1)ccc1Cl)C1=O)=Nc2c1scc2)Nc(cc1)cc2c1OCCO2,1 SC88-1717,COc1ccc(Cc2noc(C(CC3)C(C4)(CN4C4CCCCCC4)S3(=O)=O)n2)cc1,1 T502-0552,O=C(C(CC1)(CCN1S(c1ccccc1)(=O)=O)F)N1CCOCC1,0 C607-0788,OC(CN1CCN(Cc2ccccc2)CC1)c1cc([nH]cc2)c2cc1,1 Z1655615799,CC(C(N(C1)C(C)CC1c(cc1)ccc1F)=O)c1c(C)[nH]nc1C,0 Z920801726,CC(C)N1CC(CNC(c2c(C)n(C)nc2C)=O)CCC1,1 D537-0502,CCCOc1nc2ccccc2nc1N(CCC1)CC1C(NC1C(C)CCCC1)=O,1 F6252-5847,Cc(cc1)cc2c1nc(NC(c(nnn1Cc3ccccc3)c1-n1cccc1)=O)s2,1 F6481-2315,Cc1c(C(CC2)SCCN2C(CNC(c2ccccc2)=O)=O)cccc1,1 F6670-6091,CC(N1CC(CC2)CCN2c2c3sccc3ncn2)=Nc(cccc2)c2C1=O,1 F6812-1657,C(CN(CC1)CCN1c1nc(-c2cnccc2)ccn1)n1nncc1,1 F6448-0745,Cn(cc1C(Nc2cn(C3COCC3)nc2)=O)nc1OC,1 Z2701214740,NC([C@@H](CC1)O[C@@H]1c1nc(C2(CCC2)c(cc2)ccc2F)no1)=O,1 S428-1135,CCn1nc(C)c(-c2cc(C(N(CCC3)CC3c3nc(C4CCOCC4)no3)=O)no2)c1C,1 Z2439166889,C[C@H](C1)NCCN1C(C(c1c2cccc1)=NN(Cc1ccccc1)C2=O)=O,1 Z2948151524,COCC1(CCN(CC(CC2(COCC2)O)O)CC1)O,1 Z2460782710,CCc(occ1)c1C(N(CC1)CC1(C(O)=O)c1ccccc1)=O,0 Z1842523813,CC(CN(CC1C)C(c2cn(-c3ccccc3)nc2C)=O)S1=O,1 F6438-2420,COc(nc1)nc(N2CCOCC2)c1NC(Nc(cc1)cc(Cl)c1F)=O,1 Z3686393723,CNC(C[C@@H](CN(C1)c(cc2)cc(Br)c2C#N)[C@H]1O)=O,0 SC77-0717,CC(C)CCNC([C@H](CN(C1)S(C)(=O)=O)[C@@]11OCCNC1=O)=O,0 F6522-0748,O=C(COCc1ccccc1)NCc1cc(-c2cscc2)cs1,1 F3407-4669,COc1cccc(-c2cn(CC(N(CC3)c4c3cccc4)=O)nc2N2CCOCC2)c1,1 L495-0376,CC(C)CNC(Nc(cc1)cc2c1sc(NC(C)=O)n2)=O,0 L078-0590,O=C(c1nnc(C(CC2)CCN2S(c(cc2)ccc2F)(=O)=O)s1)Nc(ccc(F)c1)c1F,1 F6514-6456,CN(C=CC=C1C(NC(Cn2nccn2)c2ccccc2)=O)C1=O,1 Z383439754,Cc(cc1)cc(OCC(N(CC2)CCC2c2nncn2C)=O)c1Cl,0 F5857-1861,Cc1c(C(CNC(Nc(cccc2)c2F)=O)O)scc1,0 F6666-3599,CS(c(cc1)ccc1NC(C(C1)CC1(F)F)=O)(=O)=O,0 Z2071063992,CCc([nH]cc1)c1C(N(CC1)CCN1C1CN(C)CCC1)=O,1 F1036-0010,O=S(c(cc1)ccc1Cl)(NC(CCCC1)C1NCc1ccco1)=O,1 F1915-2676,CC(C)(C)c1nccc(N(CC2)CCN2C(OC(C)(C)C)=O)n1,0 F6209-0399,O=C(C(NCc(cccc1)c1Cl)=O)NCCCn1c(-c2ccccc2)ncc1,0 F6752-3870,O=C(C(C1)OCCN1c1cc(C(F)(F)F)ncc1)N(CC1)CCC1(F)F,0 Z4662187589,CCOc1cccc(NC(N(CC2(C3)CC3(OC)OC)C2c2ccccc2)=O)c1,0 Z1619972228,O=C(CCC1OCCC1)N(CC1)CCC1n1nc(C(F)(F)F)cc1,1 F6372-2298,Cn1c(cccc2)c2c(CC(Nc2c(Cc3nc(-c4cccs4)no3)cccc2)=O)c1,1 F6445-6813,Cc1c(C(NCc(cccc2)c2-c2cscc2)=O)sc(C)n1,1 F0653-0826,O=C(CSc1nnc(-c2c[nH]c3c2cccc3)n1-c(cc1)ccc1F)NC1CCCCC1,1 F6438-3599,CN(C)c1nc(CNS(c(cccc2)c2Br)(=O)=O)nc(N(C)C)n1,0 S223-0293,CN(C)CC(CN(C1)S(c2cccs2)(=O)=O)C11CCOCC1,1 G346-0375,Cc1ccc(CN(c2c(C(N3CC(CC4)CCC4C(N4CCCC4)=O)=O)scc2)C3=O)cc1,0 F6247-1653,CCOC(CCN(C=C(C=C1)c2nc(C)no2)C1=O)=O,0 Z4967055255,CC(C)c1c(C(N(C)CC2CCCCC2)=O)nnn1Cc1ccccc1,1 Z2231371495,Cn1c(cccc2)c2c(C(N(CC2)Cc3c2n(CCOC)nn3)=O)c1,1 Z1505319084,CCOC(c1cc(cccc2C)c2[nH]1)=O,0 Z3016332403,Cc1c(CNCCOC2OCCCC2)cc(C)c(C2OCCO2)c1,1 SA69-0859,CC(CCC1)(CN1S(C)(=O)=O)c1noc(-c2ccncc2)n1,0 8020-1071,CC(CC(C)C1)CN1C(CSC(N1)=Nc(cccc2)c2C1=O)=O,1 S808-0352,CN(C)C([C@@](CC1)(CN(Cc(ccnc2)c2F)CC2)[C@@H]2N(C)S1(=O)=O)=O,1 Z1974707429,Cc(c1c2)nn(C)c1nc(C)c2C(N[C@H](C1)C[C@@H]1c1ccc(C(F)(F)F)cc1)=O,1 SB75-1466,Cc1noc([C@]2(C[C@@H](C3)NS(N4CCOCC4)(=O)=O)[C@@H]3CN(Cc3ccccc3)C2)n1,1 S343-0031,COc1cc(-c2nc(C(CC3=O)CN3c(cc3)ccc3Cl)no2)cc(OC)c1,0 F5005-0010,O=C(C1CC1)NCCS(N1CCN(Cc2ccccc2)CC1)(=O)=O,1 Y021-1044,CC1c2cc(-c3ccnc4nc(-c5ccncc5)nn34)c(C)cc2NC(C)(C)C1,1 SA50-0282,Cn(c(C1)c2CN1C(c1ccco1)=O)nc2-c1nc(C2CC2)no1,1 E456-0737,CCN(CC)CCCNC(C(C(c1cccs1)N1CC(C)C)c(cccc2)c2C1=O)=O,0 G353-0883,CC(CCc1ccccc1)NC(CN(c(cccc1)c1N=C(C1)c2c(C)cc(C)cc2)C1=O)=O,1 F825-1624,O=C(C(CCC1)CN1S(c1ccc(-c2ccn[nH]2)o1)(=O)=O)NC1CCCCC1,1 F6521-6279,OC(CNC(Cc(cccc1)c1Cl)=O)c(cc1)ccc1-n1nccc1,1 Z1703918132,O=C(c1cc(-c2cnccc2)nc2ccccc12)NCCc1c2[nH]ccc2ccc1,1 S988-0693,Cc1noc(C)c1C(N(C[C@@H]1CN(C2)C(C3CC3)=O)C[C@@]12c1nc(C)no1)=O,1 F6541-4851,Cc1nn(C)cc1CN(CC1)CCN1c1ncccc1,1 Z2844432848,OC(CNC(c1n[nH]c(C(F)F)c1)=O)C1OCCC1,1 Z2149553502,CC(C)CC(C(NCC1)=O)N1C(c1cc(C(F)(F)F)cnc1)=O,0 Z4518584129,CCN(CC)C(CC1)CN1C(c1cc(sc(C)c2)c2n1CC1CC1)=O,1 F2227-0106,Cc1nnc(-c2cc(cccc3)c3n2Cc2ccc(C(F)(F)F)cc2)o1,0 F5033-7783,O=C(c1cccc(Br)c1)NCC(CC1)CCN1C(Nc(cc1)ccc1F)=O,0 Z2964427436,O=C(c1cscc1)N[C@H](COC1)[C@H]1NC(c1cscc1)=O,1 Z1033401514,O=C(Cc1c[nH]c2c1cccc2)N(CC1)CC1Nc1ccccc1,1 P933-1520,OCC(Cc1ccccc1)(CCC1)N1C(Cc1cccs1)=O,1 F5911-0367,Cc1cc(Nc(cc2)ccc2NC(Cn2c(cccc3)c3nc2)=O)nc(N2CCCC2)n1,1 F6111-1375,O=C(c(cccc1)c1Br)N1CCC(COCc(cc2)ccc2Cl)CC1,0 F6574-0325,O=C(NCc1nccnc1-c1cocc1)OCc1ncccc1,1 Z1239561496,CN(C(CCN1C)C1=O)C(c(cc1)nn1-c(cc1)ccc1F)=O,1 Z2647709666,CCN(Cc1cn(CC)nc1)C(c(cc1)cc(N2C(C)C)c1NC2=O)=O,0 Z1185180802,COc1c(C2(CC2)C(NC(CCN2c(cccc3)c3F)C2=O)=O)cccc1,1 F6516-0236,O=C(c1cnc(C(F)(F)F)cc1)NCc1ccc(-c2cccs2)o1,1 Z2295960919,Cc1noc(C)c1C(N[C@H](CC(O)=O)c1cccc(Br)c1)=O,0 Z2075051002,NC(C(CC1)(CN1C(C(CCC1)c2c1[nH]nc2)=O)O)=O,0 F782-1609,O=C(C1CCCCC1)Nc1nc(cc(cc2)NC(c3cc(cc(cc4)Cl)c4[nH]3)=O)c2s1,1 Z1264954739,CC(C)CNC(N(CCC1)CC1C(N(C)c1cn(C)nc1)=O)=O,0 F3280-0016,CC(Nc(cc1)ccc1C(CC1c2ccco2)=NN1C(c1ccco1)=O)=O,1 F5017-3399,O=S(C1CC1)(N1CCC(CNS(c2cccc(Cl)c2)(=O)=O)CC1)=O,0 Z3889889922,CC(c(c(F)ccc1)c1Cl)NC(Nc1ccnc2cc(C)nn12)=O,0 F5478-0011,Cc1cc(NC(C(NCC(c2cn(C)c3c2cccc3)N(C)C)=O)=O)no1,1 Z4095389016,CC(C1)(C2)OCCC12NC(c1cc(C2CC2)nc2ccc(C)cc12)=O,1 Z2302612735,CN(C(CCN1C)C1=O)C(c(cc1)ncc1Oc1cccc(F)c1)=O,1 Z2028151193,CNS(N(CC1)CCN1C(C(CC1)Cc2c1cn[nH]2)=O)(=O)=O,1 C884-0595,CC(C(N(CC1)CCN1c1ccccc1)=O)n1c(C(N(C)N=C2)=O)c2c2c1cccc2,0 F6515-0916,O=C(NCc1cc(-c2cccs2)ncc1)NC1(CC(C2)C3)CC3CC2C1,1 F6192-0027,Cc1cc(C(NCC(c2ccco2)c2ccco2)=O)no1,1 Z3357095693,O=C([C@H](C1)[C@H]2O[C@@H]1[C@H]1[C@@H]2C1)NS(c1cc(COC2)c2cc1)(=O)=O,1 S975-0668,CC(C)CN(CCN([C@H]1CN([C@H]2C)C(CCc3nc(cccc4)c4s3)=O)C2=O)C1=O,1 Z2772951033,O=C(CN1[C@@H](C2)CN[C@@H]2C1)N1CCCC1,1 F6516-1848,Cc(c(S(NCc1ccc(-c2cocc2)o1)(=O)=O)ccc1)c1Cl,0 V005-8805,OC(CN(Cc1ccco1)Cc1c(N2CCOCC2)onc1-c1ccccc1)COCc1ccccc1,1 Z1527636082,CN(CCC1NC(NC2CCN(Cc3ccncc3)CC2)=O)C1c1ccccc1,1 Z253-0467,Cc1c(C(NCc2cccc(Cl)c2)=O)c(N=CN(C2CC2)C2=O)c2s1,1 G015-1141,O=C(c1cccn1-c1nnc(N2CCCCC2)s1)N(CC1)CCC1N1CCCCC1,1 F6471-6169,COc(ccc(CCC(NCc1cc(-c2cscc2)cnc1)=O)c1OC)c1OC,0 F784-0324,O=C(CN1c(cc(cc2)Cl)c2OCC1=O)Nc(cc1)cc2c1[nH]c(CCc1ccccc1)n2,0 F6793-6864,Cc(nc1)cnc1C(N1CCN(CC(F)(F)F)CC1)=O,0 F5855-0455,O=C(C(C1)C1c1ccccc1)N(CC1)CCN1C(c1noc(-c2ccco2)c1)=O,1 Z1470552286,O=C(C(CC1)(c(cc2)c1cc2Cl)N1)N(Cc2nnnn2C2CC2)C1=O,1 Z1996107309,Cc1cccc(N(CC2)CCN2C([C@@H](CCC2)NC2=O)=O)c1,0 Z1575453971,CC(c1ncc(C)o1)Sc1nc(cccc2)c2c2nc(C)nn12,1 Z1095060028,O=C(c1cc2ccccc2nc1N1CCCC1)NC1CC1,1 F6676-2752,Cc1nc(N(CC2)CCC2N(C)c2ncccc2)nc(C)c1,0 Z646437116,N#Cc(cc1)cnc1NCC1(CCOCC1)c1cccc(Br)c1,0 Z2372463315,O=C(c1ccc(C2CC2)s1)N(CC1)CC1C1CCCC1,1 F6445-1459,CSc1ccc(CCC(NC(CC2)CN2c2nccs2)=O)cc1,0 F6796-6765,O=C1NC(N2CCN(Cc3csc(C4CC4)n3)CC2)=NC(C(F)F)=C1,1 F6755-0167,Brc1cnc(N2CCN(CCc3ccccc3)CC2)nc1,0 F3386-4826,CC(C)(C)c(cc1)ccc1S(n1nnc2c1ccc(Cl)c2)(=O)=O,0 V030-3168,CCC(C)NC(C(CCC1c(cc2)ccc2F)CN1C(NC(C)C)=O)=O,0 Z4668469897,Cc([nH]c1cc(Cl)c2)nc1c2C(N[C@H](Cc1ccccc1)C(N(C)C)=O)=O,1 F6709-5047,Cc1nccc(OC2CN(Cc(cc3)cc(F)c3F)C2)c1,0 P935-1632,Fc1ccc(CN(CCCC2)C2c2nncn2CC2CC2)cc1,0 F6237-4187,COc(ccc(NC(c1nn(-c(cc2)ccc2Br)nn1)=O)c1)c1Cl,0 Z1732943230,Cc1cc([nH]c(CN(CCC2)CCC2N2CCCC2)c2)c2c(C)c1,1 Z3243746177,Cc(cc(cc1)Br)c1NS(c(cc(c(Cl)c1)OC)c1OC)(=O)=O,0 F1284-0095,COc(ccc(C(N1c2cccc(Cl)c2)=O)c2C1=O)c2OC,0 F5871-1947,Cc1noc(CNC(c2cc(Cl)cc(Cl)c2)=O)n1,0 SB04-0694,CN(C)C(N(CC1)CC1N(CCN(C)C(c1nn(C)cc1)=O)C1CCOCC1)=O,0 M026-1341,CC(CCCC1)N1S(c1ccc(/C=C\c(onc2C)c2NC(C2CC2)=O)cc1)(=O)=O,1 Z1119489766,CC(C(NC1CCCC1)=O)N(CC1)CCN1C(c1cn(C)nc1-c(cc1)ccc1[N+]([O-])=O)=O,1 Z2951378796,Cn(c1c2CCN(CC(NCc3cnccc3)=O)C1)nc2O,1 F6658-3275,O=S(c1c(C(F)(F)F)cccc1)(N(CCC1)CCN1c(cc1)nn2c1nnc2)=O,1 T368-1946,O=C(NCc1ccco1)N(CC1)CC1n1c2ncccc2nc1C1CCCC1,1 V002-4400,N#Cc1cccc(CN(Cc2cccn2Cc2cccc(C(F)(F)F)c2)C2CCCCC2)c1,1 SA94-0045,O=C(C(CC1)(CN1C(Nc(cccc1)c1F)=O)F)NCc1ccccc1,0 Z3134734920,CN(C)c1cc(CNC(C2NCCC3C2CCCC3)=O)ncc1,1 Z1797724261,CCC1(C)Oc(cc(cc2)NC(c3c(N4CCCC4)nccc3)=O)c2O1,1 Z2091703325,CS(NC1C(CNc2cc(C#N)ncc2)CCC1)(=O)=O,1 Z1589776129,CC(c1nccn1C)NCc(cc1)cnc1N1CC(C)OCC1,1 Z2644356910,COC(CS(C1)(=O)=O)C1NC(C(CC1)CCN1c(cc1)ncc1C#N)=O,0 Z2055214456,CO[C@@H](C[C@H]1C(N2CCCC2)=O)CN1C(c(cccc1)c1F)=O,1 F6469-0615,CCSc(cccc1)c1C(Nc(cccc1)c1-c1cn(CCS2)c2n1)=O,0 F6562-5470,O=C(c1cc(-n2nccc2)ccc1)NCCN(C=CC=N1)C1=O,1 F880-0513,CC(C=CC1=NC(CSc(cccc2)c2NC(CN(C(c2c3cccc2)=O)C3=O)=O)=C2)=CN1C2=O,1 F2865-0600,O=C(c(cccc1)c1SC(F)F)N(CC1)CCN1c1ncnc2c1nnn2-c1cc(F)ccc1,1 F6471-7161,COc1c(CCC(NCCCc2conc2)=O)c2ccccc2cc1,1 Y044-5695,Oc1c(ccc(Cl)c2)c2ncc1C(N(CC1)CCN1C(c1ccco1)=O)=O,1 Z1217981260,CN(CCC1NC2Cn3ncnc3CC2)C1=O,1 V028-4527,CC(CC1)CCN1c1nnc(C(N(CC2)Cc3c2cccc3)=O)c2ccccc12,1 F5614-0685,N#Cc1cccc(C(N2CCN(Cc3nc(cccc4)c4n3Cc3ccccc3)CC2)=O)c1,1 E542-2722,CC(CCCC1)C1NC(CCc1cn(Cc2c(C)cccc2)c2c1cccc2)=O,0 Z2974840180,CN1C(CNc2nc(C3CCOCC3)ns2)(CO)COCC1,1 F6594-1070,O=C(C=C1)N(CC(CC2)CCN2c(ccnc2)c2Cl)N=C1n1ncnc1,1 F5882-1014,CC(C)(C(NCC(CC1)CS1(=O)=O)=O)Oc(cc1)ccc1Cl,0 F6573-2837,O=C(Cc1cscc1)NCCOCCn1nccc1,1 Z1571198691,Cc1nn(C)cc1C(CCC1)N1C(c1cc(ccc(C(F)(F)F)c2)c2[nH]1)=O,0 F6549-4821,Cn1ncc(C(CCC2)CN2C(c(cc2)ccc2-c2cscc2)=O)c1,1 P681-0348,CN(C(C1(CC2)CN2C(Nc(ccc(OC)c2)c2OC)=O)=O)c2c1cccc2,0 Z2959776600,Cc(cc1)nc(C(NC[C@@H](Cc2ccccc2)O)=O)c1Br,0 Z1119708203,COc1ccnc(N(CC2)CCC2c2nc(-c3ccccc3)no2)n1,0 Z3771518734,CC(C)c1nc(C)c(C(N2c(cc(C(F)(F)F)cc3)c3OC(C)(C)C2)=O)o1,0 F2794-0080,COc(ccc(CC(Nc(cc1)ccc1N(CCCC1)S1(=O)=O)=O)c1)c1OC,1 SB11-0536,CCn1c(cccc2)c2c(CN(CC2)CCC2(Cn2nnc(C(NC3CCCC3)=O)c2)O)c1,1 Z1681198166,CC(Cc1nc(-c2ccccc2)no1)(c1ccccc1)O,1 F0630-0027,CSC1=NCCN1C(c(cc1)cc2c1OCO2)=O,1 Z1313025185,NC(c(cc(cc1)NC(CN(Cc2ccccc2)Cc2ccccc2)=O)c1F)=O,1 Z2963429413,O=C(CCc1n[nH]nn1)NC1(COC1)c(c(F)ccc1)c1F,1 D262-0656,CC(C(Nc(cc1)ccc1C(C)=O)=O)N(C(C1=C2CCCC1)=O)N=C2c1c(C)ccc(C)c1,1 S632-4977,Cc1c(C(N(CC2)CC2C(CC2)CCN2S(C)(=O)=O)=O)ocn1,1 Z2483105567,OC(c1cccc(Cl)c1CN(CCOC1)C1C1OCCC1)=O,0 Z1928152103,O=C(c(cc1)ccc1OC(F)(F)F)NCCC(NO1)=NC1=O,0 V014-9382,COc1cc(C(NC(CC2)Cc3c2[nH]c(cc2)c3cc2Br)=O)cc(OC)c1,1 F6685-8561,O=S(C1CC1)(N1CC(COc2ncccc2C(F)(F)F)CCC1)=O,0 8017-8574,O=S(c(cc1)cc2c1OCCO2)(NCC(C1CCCCC1)c1ccccc1)=O,1 F6571-5758,CC(Cc1csc2c1cccc2)NC(c(o1)ccc1Br)=O,1 Z2607461866,CC[C@H](C(NCC1(C(C)(C)C1)c1ccccc1)=O)N,0 SA71-0667,CC1(CC1)C(N(CCC1)CC1(CC1CC1)c1noc(C2CCOCC2)n1)=O,1 Z1687408533,CC(c1cccc(S(NC)(=O)=O)c1)NCC1(CN(C)CC1)O,1 F5871-3103,O=C(C(CC1)CCN1C(c1cc(-c2ccco2)n[nH]1)=O)NCC(F)(F)F,1 L895-0248,O=C(C(CCC1)CN1c1nccnc1Sc1ccccc1)N1CCCCCC1,1 S613-1286,O=C(NCc(cc1)ccc1F)N(CCC1)C1c1nc(CCOCC2CCOCC2)no1,1 Z4959687667,CC(CNC(C1OCCc2c1cccc2)=O)N(C)Cc(cc1)ccc1F,1 F6471-2868,Cc(cc1)c(C)cc1NC(N1C2C=CCC1CC2)=O,0 L904-3470,COc(cc1)cc2c1nc(-c(cc1)ccc1NS(c(cc1)cc3c1OCCO3)(=O)=O)s2,1 V024-9432,CCC(C)c1nc(n(-c2ccccc2)nc2)c2c(NCCNC(C2CCC2)=O)n1,1 F2580-2107,C=CCN(C=CN(c1cccc2ccccc12)C1=O)C1=O,1 Z3687048221,CC(C)n1nc(CC(N[C@@H](CC(Cn2ncc(Cl)c2)C2)[C@H]2O)=O)cc1,1 M428-0723,CCC(C)NC(CSc(cc1)nnc1-n1nc(CCC2)c2c1C)=O,1 F6436-1651,O=C(CCc(cccc1)c1F)NCCc1cscc1,0 F6359-3830,CC(C)Sc1ccc(CC(N(CC2)CCC2Oc2nnc(C)cc2)=O)cc1,1 G851-0755,O=C(C(CCC1)CN1c1ccc(cc(cc2)S(N3CCCC3)(=O)=O)c2n1)NC1CCCCC1,1 Z3600397314,CC(CO)(CC1)N1C(Cc(c(C(N1C(C)(CO)CC1)=O)ccc1)c1Cl)=O,0 Z1594541319,CCC(C)n(c(C)c1)nc1NC(c1cc(C(C)(C)C)nn1C)=O,0 Z2802857653,O=C(C1OCCCC1)N(CC1)CCC1c1nc(C2CCC2)no1,1 F0808-1026,O=C(Oc1ccccc1)Oc1cccc2ccccc12,1 F6151-0200,Cc1cc(NC(C(CCC2)CN2c(cc2)nnc2-n2cncc2)=O)ncc1,1 Z2497630662,OCC(CC1)CCN1C(c1cc(C2CC2)ccc1)=O,1 Z365464842,CC(N(C)CC(NC1CCN(Cc(cc2)ccc2Cl)CC1)=O)=O,0 Z3188129491,CC(C1)(Cc2c1cccc2)C(NCC(Nc1cnccc1)=O)=O,0 Z4638999423,CC(C)c1nc(C)c(C(NC2C(CNc3ncccn3)CCC2)=O)o1,1 Z1260482845,CC(Cc1c(C2)cccc1)N2C(CC(C(C)=NC1=C2)=C(C)N1NC2=O)=O,1 S700-0859,Cc1noc(C)c1S(N(C1)CC1c1nc(CCOCC2CC2)no1)(=O)=O,1 F6089-9685,CN(C(C1)=O)c(cc2)c1cc2NC(NC1CCOCC1)=O,1 Y205-4515,Cc1c(-c(cc2)ccc2F)nc(NC(C2OCCC2)=O)s1,0 Z3082224514,CCn1nc(C(NC(C)c2ncc(C)s2)=O)c(Br)c1,0 S713-3021,Cn1c(-c2noc(C(CC3)CCN3C(C3CCC3)=O)n2)ccc1,1 F6549-8863,O=S(c(cccc1)c1Br)(N(C(CC1)C2)C1CC2Oc1cnccc1)=O,0 Z2142703447,Cc1c2sc(C(Nc(cc3)cc(C(N4C)=O)c3C4=O)=O)cc2ccc1,0 S891-0311,O[C@@H](CC1)[C@H]2[C@@H]1CN(Cc1c[nH]nc1-c1cccs1)C2,1 F6279-0180,CNC(Cc(cc1)ccc1NS(Cc1ccc(C(F)(F)F)cc1)(=O)=O)=O,0 F3366-5376,Fc1cccc(Cl)c1Cn1c(cccc2)c2nc1CN1CCCC1,0 F6089-9799,Cc(cc1)nnc1N1CCC(CNC(NC2CCOCC2)=O)CC1,1 S615-0849,O=S(c1c[nH]cn1)(N(CC1)CC1c1nc(CCOCC2CCOCC2)no1)=O,1 Z600504360,OC(c1cccc(CNC(c2cccc(Cl)c2)=O)c1)=O,0 Z2184896377,OCC(C1CCCC1)NC(CN(c(cccc1)c1OCC1)C1=O)=O,1 F6513-1418,O=C(c1nn(CCCC2)c2c1)N(CC1)CCN1C(Nc1cccs1)=O,1 S247-0107,COCC(CN(C1)C(COc2ccccc2)=O)C11CCOCC1,0 F2075-0750,Cc1nc(N(CC2)CCN2C(c(cccc2OC)c2OC)=O)nc(N2CCOCC2)c1,0 Z3290588459,CCC(C1CCCCC1)NC(CC(CC(N1)=O)CC1=O)=O,1 F3407-4644,Cc(cccc1)c1-c1cn(CC(NCc(ccc(F)c2)c2F)=O)nc1N1CCOCC1,1 S957-5309,CN(C)S(N(CC1)CCC1(C1)C(COC)CN1c(cc1)cc(C(F)(F)F)c1C#N)(=O)=O,0 Z637705360,CN(C)S(c(cc1)cc2c1nc(-c(cc1)ccc1O)[nH]2)(=O)=O,0 F6482-7969,O=C(COc(cc1)ccc1F)NCc(cc1)cnc1-c1cnccc1,1 Z2370731517,Cc1cc(S(N(CC2)C3(CCC3)CC2O)(=O)=O)cc(F)c1,1 Z2482848403,Cc(nc1c(F)cccc1c1)c1C(N1CC2(CC2)C1)=O,1 Z1259038717,CC(C)(C(C)(C)N)C(Nc1nn(C)cc1)=O,0 Y205-6083,OC(C(C1CC2CC1)C2C(Nc1nn(Cc(cc2)ccc2F)cn1)=O)=O,1 C094-1518,CC(CCC1)CN1C(C(NC1CCCC1)=O)c(cc1)ccc1Cl,0 8008-2260,O=C1N(c(cc2)ccc2Cl)N=C(c(cccc2)c2N2Cc3ccccc3)C2=C1,0 Z2647483185,CN(C=CC(C(N(CC1)CCC1(CC1)Oc2c1cccc2)=O)=C1)C1=O,1 F6244-1553,O=S(c(cccc1)c1F)(NCC#CCN1CCCC1)=O,0 Z422564478,CN(C)CCCNC(C(CC1)CCN1C(c1cccc(F)c1)=O)=O,0 F6262-3442,COc1c(COc2cc(NC(c3nccnc3)=O)ncn2)cccc1,1 F6436-2774,O=C(Cc1cscc1)Nc1ccc(CC(NCC(F)(F)F)=O)cc1,0 G944-0611,CC(C)C(c1nc(-c(cc2)cc3c2n(C2CCCC2)nn3)no1)NS(c1ccc(C)cc1)(=O)=O,0 Z2916445861,C[C@@H](C(CC1)CCN1C(c1cncc2c1[nH]c(C(F)(F)F)n2)=O)O,0 SC60-1030,CC(C)(CN(C(C1)C(N2CCOC)=O)C2=O)CN1C(c(ccc(Cl)c1)c1OC)=O,0 F5596-1295,O=C(CN(CC1)CCC1c1nnc(C2CC2)o1)NCCc1ccccc1,1 S639-0497,CN(C)C[C@@H](CN(Cc1ccccc1)C1)[C@H]1NS(c1cccs1)(=O)=O,1 Z914354246,CS(N(CC1)CCC1NC(NCc(cccc1)c1Oc1ccccc1)=O)(=O)=O,0 Z1037870234,CC(C(N(C(CC1)C(Nc(cc2)ccc2F)=O)c2c1cccc2)=O)N(C(C1C2CC=CC1)=O)C2=O,0 F6031-0655,OC(CN(CC1)CCN1C(c1cc(cccc2)c2o1)=O)c1ccco1,1 SB21-1419,Cc1nccc(C(N(C2)[C@H](Cn3nnc(C(N(CC4)c5c4cccc5)=O)c3)C[C@@H]2F)=O)c1,1 Z3215989318,CN1C(CNC(c2n[nH]c(cc3)c2cc3[N+]([O-])=O)=O)(C2)CC2C1,1 D078-0195,COc(cc1)ccc1OCCn1c(cccc2)c2nc1C1OCCC1,0 S953-0147,Cc1noc(C)c1CC(N(CC(C1)(CC2)CCN2c(cc2)cc(C(F)(F)F)c2C#N)C1C(N)=O)=O,1 F2558-0222,CS(c(cc1)ccc1C(Nc1cccc(Cl)c1Cl)=O)(=O)=O,0 Y206-6743,COc(cc1)c(CN(CC2)CCN2C(Nc(cc2)cc3c2OCCO3)=O)cc1Cl,1 Z324594388,CC(C)c(cc1)ccc1NC(CSc1nnc(N)n1C)=O,0 S623-1247,CC(C)CN(C(C1)CN1C(C1(CC1)c(cc1)ccc1OC)=O)C1CCN(C)CC1,1 Z2968495770,CC(C)(CCN(C1)C(NCc2c[nH]nc2C)=O)C1c1ccccc1,1 Z511151794,CC1CCN(CCNC(N(CCC2)C2c2cnccc2)=O)CC1,1 F620-0025,O=C(CC(C1)c2nc(CN(c(cccc3)c3O3)C3=O)no2)N1c1cccc(Cl)c1,0 F6559-3659,O=C(CN1N=CC=CC1=O)NCc1nc(C(CC2)CCC2(F)F)no1,1 F6484-0109,O=C(c(cc1)cc2c1OCO2)NC(CC1)CCC1Oc1nccnc1,1 Z1219223976,CCc1nn(C)c(NC(N2C(Cc(cccc3)c3OC)CCC2)=O)c1,1 F1899-1059,O=C(CSc(cc1)nnc1-c(cc1)ccc1Br)NC1CCCCC1,1 F6796-3315,Cc1cnc(N2CC(COc(cc3)nn4c3ncc4)CC2)nc1,1 F6574-0778,O=C(c1cnc(C(F)(F)F)cc1)N(CC1)CCC1Oc1nncs1,0 F6415-0796,CCOCC(N(Cc1cocc1)Cc1cccs1)=O,0 G118-1507,COc(cc1)ccc1NC(N(Cc(cccc1)c1-n1c2ccc1)C2c(cc1)cc(OC)c1OC)=O,0 Z3600732832,Cc1nc(C(NCc2n[nH]c3c2COCC3)=O)c(-c2ccccc2)o1,0 8015-8771,Oc(cc1)cc(C(CCC2)=C3N2C(CN2C(CCCC4)C4CCC2)=O)c1OC3=O,1 F0649-0867,O=C(c(cccc1)c1F)N(CN(CCC1)C1=O)c1nc(cccc2)c2s1,1 F0715-0248,O=C(c(cc(s1)Cl)c1Cl)Nc(cc(C(F)(F)F)cc1)c1Cl,0 Z1542548589,CC(C1)N(CC(F)(F)F)CCN1C(CN(C=CC(N1)=O)C1=O)=O,0 F6356-0563,CC(Cc1cocc1)NC(c(cccc1)c1Cl)=O,0 Z1738714337,Cc1cc(S(NCc2ccc(C(O)=O)o2)(=O)=O)cc(F)c1,0 Z2003317309,CC1C(C(NCC(C2CCCCC2)O)=O)OC(C)C1,1 Z3402600103,CN(C1CCC1)S(NCCCSc1ccccc1)(=O)=O,1 F6523-1168,O=S(N1CCCC1)(N(CC1)CCN1c1nccn2nc(CCCC3)c3c12)=O,1 F510-0090,CSc1cccc(NC(CN2c(cc(cc3)C(N4CCCC4)=O)c3SCC2=O)=O)c1,0 Z1531586907,CN(CC(C1CC1)O)C(Nc1c(C(F)F)n(C)nc1)=O,1 Z4914935648,Cc1cccc(Cl)c1S(NCC(c1cccc2ccccc12)O)(=O)=O,0 F2289-0087,O=C(C1=COCCO1)Nc1nnc(C2CCCCC2)o1,1 F6245-7267,CSc(cccc1)c1C(NCCN(C1=O)N=C(C2CC2)N1c1ccccc1)=O,0 D294-5027,O=C(C(C1)CN(CCc2c[nH]c(cc3)c2cc3Cl)C1=O)Nc(cc1)cc2c1OCCO2,1 Z996790192,Cc1ccc(C(NC2(CCOCC2)c(cc2)ccc2Cl)=O)o1,0 F2233-0651,O=C(CN(c1c(C(N2Cc(cc3)ccc3F)=O)nccc1)C2=O)Nc(cc1)cc2c1OCCO2,1 Z1444183171,CS(CC(c1ccccc1)NC(c(cc1)ccc1C(O)=O)=O)=O,0 F6724-4855,OC(CNc1ncnc2cnccc12)c1ccc(-c2cccs2)o1,1 Z1498505931,Nc(c(S(N(CC1)C[C@@H]1O)(=O)=O)c1)ncc1Cl,0 F6475-7775,O=C(c1cccnc1OC1CSCC1)Nc1nocc1,1 K061-0813,O=C(c(cnn1c(C(F)(F)F)c2)c1nc2-c(cc1)ccc1Br)N1CCOCC1,1 Z2982459276,O=C(C1CC1)NCCS(c1cccc(Br)c1)(=O)=O,0 F6804-7479,Brc(cc1)cnc1N1CC(CCC2)C2C1,0 Z54786915,COC(CC1N(CC(N(CC2)c3c2cccc3)=O)CCc(cc2OC)c1cc2OC)=O,1 F6752-4141,O=C(C(C1)OCCN1c1nc(ccc(F)c2)c2s1)NC1CC1,0 Z2306487233,CC(CN(CC1)C2CC2)CN1C(NCCn1ncc(C)c1)=O,1 Z1171600085,CC1CCN(CC(CNC(c2n[nH]c3c2cccc3)=O)O)CC1,1 Z3138953823,NC(C1)C2(CCC2)CN1C(c1nccc(C(F)(F)F)c1)=O,0 Z1554267646,Brc1c(Cc2nn(Cc3nnc(-c4ccccc4)o3)nn2)cccc1,0 F6606-1907,N#Cc1ccc(CN2CCC(CN(C=NC(C3CC3)=C3)C3=O)CC2)cc1,1 F3407-4399,Cc(cc1)c(C)cc1-c(n1nc2)ccnc1c2C(NCc(cc1)ccc1F)=O,0 S726-0037,OCCC1CC(CC2)(CCN2C(c2cccs2)=O)OCC1,0 V018-5198,COCCn1c(S(Cc(cc2)ccc2F)(=O)=O)ncc1CN(C1CC1)C(c(cccc1)c1F)=O,0 Z2384675819,N#Cc1cccnc1NC[C@@H](CC1)O[C@@H]1c1nc(C2CC2)n[nH]1,0 J107-0780,O=C(C1(CCOCC1)c1ccccc1)NC(CCC1)c2c1c(cc(cc1)F)c1[nH]2,0 G804-0369,COc1cccc(N(C(c2c3cccn2)Nc(cc(cc2)OC)c2OC)C3=O)c1,0 F6724-4969,Cn1ncc2c1ncnc2NCc1cc(-c2ccco2)cs1,1 Z451412590,O=C(CN1N=C(CCCCC2)N2C1=O)Nc1ccnn1Cc1cccc(Br)c1,0 P316-0733,Cc(cc(cc1)N(CCC2NS(c(cc(cc3)F)c3F)(=O)=O)C2=O)c1F,0 G851-1179,CC(Cc1c2cccc1)N2S(c(cc1)cc2c1NCC2)(=O)=O,0 Z4089410145,Cn1nc(CNC(c2c(-c3cccs3)ocn2)=O)c2c1CCOC2,1 F6573-8474,O=C(CN1N=CC=CC1=O)N(CCN1c(nc2)ncc2F)CC1=O,1 Z1764417411,Cc(cc1)cnc1NC(C(CCC1)CN1C(C1(CC1)c1ccc(C(F)(F)F)cc1)=O)=O,0 F5053-0128,CC(C(NCC1)=O)N1C(CCCSc(cc1)ccc1Cl)=O,1 Z1885330095,CS(c(cc1)cc2c1OCCN2C(c1coc(C2CCOCC2)n1)=O)(=O)=O,1 E977-0752,CCc1cccc(NC(C(CCC2)CN2S(c(cc2)cc(CCC3)c2NC3=O)(=O)=O)=O)c1,0 F5598-0037,O=C(NCc(cc1)ccc1F)N(CC1)CCC1c1nnc(-c2ccco2)o1,1 F0326-1090,Cc1nnc(NC(c2cc(C(F)(F)F)ccc2)=O)s1,0 C682-1222,CCOc(cc1)ccc1S(C1=CN(Cc2c(C)ccc(C)c2)c(ccc(OCC)c2)c2C1=O)(=O)=O,0 F5477-0388,CN(C)C(CNS(C1CC1)(=O)=O)c1cn(C)c2c1cccc2,1 F0651-0394,Cc1cc(cc(CNS(c(cc2)ccc2Br)(=O)=O)cc2)c2n1C,0 T955-0960,C(COCC1CCCC1)c1noc(C2CN(Cc3ncccc3)CCC2)n1,1 F6089-5681,O=C(c(cc1)ccc1-n1cccc1)NCCc1cscc1,1 F6451-1425,COC(CNC(C(Nc1cnccc1)=O)=O)c1cccc(F)c1,0 F6495-3940,O=C(C(C1)CN1c1ncnc(-c2ccccc2)c1)Nc(cc1)cc2c1OCCO2,1 Z4635069253,CS(NC1(CNC(N(CC2)CC2C2CCCCC2)=O)CCCCC1)(=O)=O,1 Z1400552541,OCC1(CN(CC2)CCC2c2nc(-c3ccccc3)n[nH]2)COC1,1 Z2440109343,Cc1c(C(N(CCC2)CC2NC)=O)nnn1-c(cc1)ccc1OC(F)F,0 Z1455310954,OC([C@@H](Cc1ccccc1)NC(CCc1cccs1)=O)=O,0 F6559-0421,O=C(C(C=C1)=CNC1=O)N(CCC1)CC1N(C=Nc1c2cccc1)C2=O,1 E984-1262,Cc1nn(CCC(N2CCCC(NC3CCCCC3)=O)=O)c2c1,1 F6237-0343,O=C(c1nn(-c2ccccc2)nn1)Nc(cc1)cc(C2)c1-c1c2cccc1,1 M331-0681,Cc1noc(/C=C/c(s2)ccc2S(Nc2cc(OC)cc(OC)c2)(=O)=O)c1NC(C1CC1)=O,0 F3411-3134,Fc(cc1)ccc1-c1n[nH]c2c(cc(cc3)F)c3ncc12,0 F6656-2599,Cc(cc1)nnc1OCC1CCN(CCc2ccccc2)CC1,1 SD08-0058,Cn1cnc(C(N(CCC2)CC22OCc3c(CNC(c4ccccc4)=O)nnn3C2)=O)c1,1 G410-0105,Cc1cc(C)nn1-c(c1ccccc11)nnc1Nc(cc1)ccc1N1CCOCC1,1 F5857-2187,OC(CNC(C(NCCC1=CCCCC1)=O)=O)(C1CC1)c1cccs1,1 F6420-0257,Cc(cc(cc1)S(NCC(c2cscc2)OC)(=O)=O)c1F,0 V005-4858,CN(C(CN1Cc2cnccc2)=C(C(c(cc2)ccc2F)N2)C1=O)C2=O,0 F6357-0722,O=C(c1cocc1)NCC1(CCCC1)c1cscc1,1 Z1885901337,O=C(c1coc(C2CCOCC2)n1)N(CC12CC2)Cc2c1cccc2,1 M400-0160,Cc1c(CN2Cc(cc(cc3)C(NCc(cccc4)c4F)=O)c3OCC2)scn1,1 Z363076202,CC(C)NS(c(cc(cc1)C(N(C)Cc2ccccc2)=O)c1F)(=O)=O,0 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J100-0190,O=C(C[C@H](C(Nc1c2cccc1)=O)NC2=O)Nc1nnc(Cc2ccccc2)s1,1 Z1526721386,CNC(c1nc2ccccc2c(OCCOC)c1)=O,0 SC09-0310,C[C@H](COc(cc1)c(C2)cc1-c1cncnc1)N2C(c1cc(C)ncc1)=O,1 F6573-1627,Cn1ncc(-c2nccnc2CNC(CSc(cc2)ccc2F)=O)c1,1 Z2921444192,O=C(c(cc1)ccc1-c1cccc2cccnc12)N(CCCC1CCN2)C1C2=O,1 F2496-2121,Cc1cc(COC(Cn2c(C(N(C)C(N3C)=O)=O)c3nc2)=O)no1,1 F6178-7001,O=C(CN(C(CC1)=O)C1=O)NCC(CC1)CCN1C1CCOCC1,1 SA50-0287,Cn(c(C1)c2CN1C(CCc1ccccc1)=O)nc2-c1nc(C2CC2)no1,1 Z1499505768,CC(C)C(c1nc(-c2nnc[nH]2)no1)NC(Nc1cc(F)cc(N2CCCC2)c1)=O,1 F1132-0251,COc(c(S(NCc(cc1)cc2c1OCO2)(=O)=O)ccc1Cl)c1Cl,0 F6245-5908,CN(C(C(F)(F)F)=NN1CCNC(c(s2)ccc2Cl)=O)C1=O,1 F6549-2469,COc1ccc(CNC(N(C(CC2)C3)C2CC3n2nccc2)=O)cc1,0 E145-0105,CC(C(Nc(ccc(S(Nc(cc(cc1)OC)c1OC)(=O)=O)c1)c1N1)=O)C1=O,1 Z929890492,CC(C(NC1CCN(Cc2ccccc2)CC1)=O)N1CCOCCC1,1 Z3132918413,CCn1nc(CNC(C(C[C@H]2C3)C[C@@H]2[C@@H]3N)=O)cn1,0 F6775-2418,FC(c1csc(N2CC(COc3nccnc3)CCC2)n1)(F)F,1 Z2256953045,CCC(C(O)=O)N(CC1)CCN1C(COc(cc1)ccc1Cl)=O,0 F3406-4493,CC(CCC1)CN1C(c1c2cccc1)=NN(CC(Nc(cc1)cc3c1OCO3)=O)C2=O,1 L644-0041,O=C(c(cc1)ccc1Br)Nc(cc1)ccc1N(C=CC=C1C(NCC2OCCC2)=O)C1=O,1 F2135-1283,CCCc(cnc(SCC(c(cc1)ccc1Br)=O)n1)c1O,0 F6724-4355,C(C(c1ccco1)c1ccco1)Nc1nc(cccc2)c2o1,1 F5871-3457,Cc1nsc(NC(C2(CCOCC2)c2ccccc2)=O)c1,1 F2017-0372,O=C(Cn1c(cccc2)c2c(S(Cc2cc(C(F)(F)F)ccc2)(=O)=O)c1)N1CCOCC1,0 F6525-6814,CC(C)S(c1ccc(CC(NCCn2ncc(-c3ccco3)c2)=O)cc1)(=O)=O,0 F6503-5512,Cn1nc(CN(C2CCCC2)S(c2cccs2)(=O)=O)c2c1CCC2,1 Z4561574153,FC(c1cc(CN2CCC(CCCN3CCCC3)CC2)ccc1)F,1 F6089-8285,CC(C)C(N(CCC1)c2c1ccc(NC(C(NCC(CC1)CCN1C(OC)=O)=O)=O)c2)=O,1 Z2774350529,Cc1cn(C(CC2)CN2S(c2cccc(Cl)c2O)(=O)=O)nc1,0 F6554-0783,Cn1nc(C(CCC2)CN2C(c(cccc2)c2C(OC)=O)=O)cc1,0 Z1521997738,CC(C)(C1)OCCN1C1(CNC(C(N2C)=CC=CC2=O)=O)CCCCC1,1 D583-1767,CCn1c(SCC(c2c(C)n(C3CC3)c(C)c2)=O)nnc1CN(c1ccccc1)S(C)(=O)=O,0 SB24-0246,COCCNC(c1cn(C(CC2)C2(CC2)CCN2C(NC2CCCC2)=O)nn1)=O,1 Z1124097691,CC(Nc1ccnn11)=C(CC(NC2c(cccc3)c3OCCC2)=O)C1=O,1 V021-1581,CN(CC1)CCN1c1nc(CCN(Cc2cc(OC)ccc2)C2)c2c(N2CCOCC2)n1,0 S971-0414,CCCC(CC1)(C1(CC1)CCN1C(c(ccc(OC)n1)c1OC)=O)O,0 Z1870350656,COc1cccc(C(C2)=CCN2C(c2nn(CCCO3)c3c2)=O)c1,1 Y020-3613,COc(cc1)ccc1-c(n1ncnc1nc1C=CN2Cc3ncccc3)c1C2=O,0 Z408767156,O=C(COc(cccc1)c1F)NC(CC1)CCN1C(C1CCCCC1)=O,1 F5323-0137,CC(C)S(c(cc1)ccc1C(Nc1c(CCC2)c2nn1C)=O)(=O)=O,0 F1094-0232,O=C(C(C(c1cccs1)N1CCOCC1)N1CCOCC1)c1ccccc1,1 5042-0792,OC(CCCC(Nc(cc1)ccc1NC(c1ccco1)=O)=O)=O,0 F2874-0148,CN(C(C=C1)=O)N=C1c(cc1)ccc1NC(c1cccc2ccccc12)=O,1 S721-1983,NC([C@H](C[C@@H](C1)Oc2cnccc2)N1C(c1nc2ccccc2cc1)=O)=O,1 F6440-2325,Cn1nc(CNC(c2cscc2)=O)c2c1CCCC2,1 Z262439524,Nc1nnc(SCC(N(CCC2)C2c(cc2)ccc2F)=O)s1,1 Z3416603621,CC(C)c1cccc(CC(N2CC(CC3)(CCS3(=N)=O)OCC2)=O)c1,1 Z2204871504,N#Cc(ccc(S(Nc(ccc(C(O)=O)c1)c1O)(=O)=O)c1)c1F,0 Z2972544479,CCc1c[nH]c2c1c(N(CC1)CCC1(c1ncccc1)F)ncn2,0 CM0264-7672,Cc1noc(CN(CCN2C3CN(Cc(c(F)ccc4)c4Cl)CC3)C2=O)n1,0 S700-1581,CCC(C)NC(N(C1)CC1c1nc(CCOCc2ccccc2)no1)=O,1 J031-0453,O=C(c(cc1)cc2c1OCCCO2)Nc(cc1)cc(Br)c1N1CCOCC1,1 F6523-0153,Cc1nc(N(CC2)CCC2NC(C2=CC=CN(C)C2=O)=O)cc(C(F)(F)F)n1,1 Z2174653574,CC(N(CC1)C(CC(NCC2(CC2)c2cc(OC)ccc2)=O)c2c1cccc2)=O,0 F6225-1039,CN(CC(NCCSc1nncn1C)=O)c(sc1ccc2)nc1c2Cl,0 F6374-3520,O=C(c(c(F)ccc1)c1Cl)N1CCC(CSC2=NCCS2)CC1,0 Z1491095280,OCC1(CNCc2c[nH]nc2-c2cnccc2)CCCC1,1 SC13-0548,CS(N(Cc1cnccc1)C(CCC1)CN1S(c1cc(F)cc(F)c1)(=O)=O)(=O)=O,0 F6793-7193,CC(N=CN1CC(N2CCN(CC(F)(F)F)CC2)=O)=CC1=O,1 F5490-1323,Cc(cc(cc1)OC)c1-c1cnc(NCC(F)F)nc1,0 S902-1400,COCC(N(CCCC1)C1c1nnc(C2)n1CCN2C(Nc1ccccc1)=O)=O,1 F6438-0808,COc1ccc(CC(NCc2nc(N3CCOCC3)ccn2)=O)cc1,1 P797-0500,Cc1cc(-c2nn(C=CN(CC(c(cc3)cc(OC)c3OC)O)C3=O)c3c2)c(C)cc1,0 Z1616359378,CCC(C)n(c(C)c1)nc1C(N(CCC1)CCS1(=O)=O)=O,1 Z2040129034,CCCC(N(CCC1)CC1c1nc(-c(cc(cc2)OC(F)F)c2F)no1)=O,0 F6225-0506,Cc1noc(CNC(CN(C)c2nc(c(OC)ccc3)c3s2)=O)n1,0 Z2956104802,CC(C)C(C)(CNC(C(c(cccc1)c1N1)=C(C)C1=O)=O)O,0 Z928031658,CCOc1ccc(C(CCC2)N2S(c([nH]nc2)c2C(O)=O)(=O)=O)cc1,0 V005-2359,COc(cc1)cc(OC)c1NC(Nc1c(C2CC2)[nH]nc1-c1ccc(C(F)(F)F)cc1)=O,0 Z3799146218,O=C(c(nc1-c2ccccc2)nn1-c1ccccc1)N1CC(CCC2)NC2CC1,1 F6438-2629,CN(C)c(nc(N1CCOCC1)nc1)c1NC(Nc(cc1)cc(C(F)(F)F)c1Cl)=O,0 F2617-2054,CC(C1)N(CC(OC=C2OCC(c(cc3)ccc3Cl)=O)=CC2=O)c2c1cccc2,1 8012-8812,CC(CCC1C(N2C(CC(O)=O)c3ccco3)=O)CC1C2=O,1 Z4349657227,C[C@H](C1)N[C@@H](C)CN1c1nc(C(Nc2cc(F)ccc2)=O)cs1,1 F5823-0671,O=C(NCc1cccs1)N1CCC(Cn2nccc2)CC1,1 F2434-1286,CC(N(C)N(C1=O)c2ccccc2)=C1NC(c1ncc(-c(cc2)ccc2F)o1)=O,1 F6573-2642,COC(c(cc1)ccc1C(NCCOCCn1nccc1)=O)=O,0 Z2449957192,CC(C)(C1)c(cccc2)c2N1C([C@H]1N[C@H](C2)[C@H]2C1)=O,0 F6089-7233,O=C(C(Nc1cnccc1)=O)NCC1(CCOCC1)c1cccs1,1 Z1897168940,Cc(cc1)ncc1S(N(CC12CC2)Cc2c1cccc2)(=O)=O,1 SA71-0383,CN(C)S(N(CCC1)CC1(CC1CC1)c1noc(-c2cnccc2)n1)(=O)=O,1 SA67-1018,Cc1nc(CCC(CC2)CN2C(NC2CCCC2)=O)no1,1 F6506-5017,OC(CNC(c1cc(Br)cs1)=O)(C1CCOCC1)c1ccccc1,1 S988-1049,CCS(N(C[C@@H]1CN(CC2CC2)C2)C[C@@]12c1nc(C)no1)(=O)=O,1 F2442-0061,Cc1nc(OC)cc(N(CC2)CCN2C(c(cc(cc2)Cl)c2OC)=O)n1,0 F6557-1985,O=C(c1cc(-c(cc2)ccc2F)c[nH]1)N(CCC1c(cccc2)c2Cl)CCS1(=O)=O,1 C255-0312,CC(CC1)(C(NCc2cnccc2)=O)N(CCc2ccccc2)C1=O,0 F5241-0104,Cc(c(OC)c1)cc(C)c1S(N(CC1)CCN1c1nc(OC)nc(OC)c1)(=O)=O,0 T159-1285,Cc1cnc(CC(CCC2)CN2S(c2cn(C)cn2)(=O)=O)n1Cc1ccccc1,1 SB15-0797,Cc(nc1)ncc1C(N(CCC1)CC1N(C1CCOCC1)S(C)(=O)=O)=O,1 Y041-3278,Cc(c1c2)coc1cc(O1)c2C(C)=C(CC(N2CCN(CC(NCCN(C)C)=O)CC2)=O)C1=O,1 SA46-1622,O=C(CCc1c[nH]c2c1cccc2)N(C1)CC1(C1)OCC1N1CCCCC1,1 SC42-0126,Cc1cc(C(N(CC2)CCC22OCCC(Cc3noc(C)n3)C2)=O)c(C)n1CCCOC,1 Z1157065141,CC(C)(CNC(NC1CCN(Cc(cc2)ccc2F)CC1)=O)O,0 F6619-6528,FC(c1ncnc(N(CC2)CCN2c2ncnc3c2cn[nH]3)c1)(F)F,0 F3398-2896,COC(c(cc(c1c2)OCC(Nc(cc3)cc(Cl)c3OC)=O)nc1cc(OC)c2OC)=O,0 Z1171714237,CCn1c(cccc2)c2nc1CNC(CN1CCN(C)CC1)=O,0 Z1991757755,OC(c1cc(cc(cc2)NC(c3ccncc3)=O)c2o1)=O,1 V012-4352,O=C(C1CCCCC1)Nc1cccc(-c2cccc(-c(cc3)ccc3F)n2)c1,1 F6469-2943,Cc1nc(-c(cccc2)c2NS(C2CC2)(=O)=O)cs1,1 F6523-1670,Cc1cc(N(CC2)CCC2NC(c(s2)ccc2Cl)=O)n[nH]1,1 0200-5188,CCCC(CC1)CCC1c(cc1)ccc1C(Nc1noc(C)c1)=O,1 S556-0911,Cn1cnc(S(N(C2)CC2Oc(cc2)ccc2-c2noc(COC)n2)(=O)=O)c1,1 Z5009663800,CC(C(CNS(c1cc(cccc2)c2s1)(=O)=O)O)c1ccccc1,0 F2880-3919,CN(C)C(CNS(c(cc1)ccc1Br)(=O)=O)c(cc1)ccc1F,0 S976-0308,Cc1nc(S(N(CCC2)CC2(C(NCC2CC2)=O)F)(=O)=O)cn1C,0 Z2957239832,CCc(c(C)c1)nc(O)c1C(N(C)C1CCC(CO)CC1)=O,0 Y042-7877,CC(C(O)=O)NC(N(CC1)C(c(cc2)ccc2OC)c(cc2OC)c1cc2OC)=O,0 F6560-7521,Cn1c(cccc2)c2c(CC(NCc(cc2)cnc2-c2cocc2)=O)c1,1 F5857-6544,OC1(CNC(c2c(C(F)(F)F)cccc2)=O)C=CCCC1,0 F0550-0204,O=C(C1=CN=C2SCCN2C1=O)N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1Cl,1 SC02-0479,COCCC(CC1)(CN1C(CCCc1c[nH]c2c1cccc2)=O)NC(C1CCOCC1)=O,1 F6549-5572,Cn1c(C(CC2)CCN2C(c2cc(F)cnc2)=O)cnc1,1 Z803314894,O=C(Cn(cc1)c2c1ccc(Cl)c2)N1CCCC1,0 Z2225984738,COCc(cc1)ccc1C(N(CCC1)CC1C(NN1)=NC1=O)=O,0 Y080-1254,CC(c1nc(cccc2)c2n1CCOc1cc(OC)ccc1)N1CCCCC1,0 V002-1412,CCCN(Cc(cc(cc1)NC(C2CC2)=O)c1N(C)C)C(C(C)(C)C)=O,0 Z3303387773,CC(C)c1c(C(NC2(C)c(cccc3)c3OCC2)=O)[nH]c(C)c1C(C)=O,1 Z3393448061,OCC(C1)NCCN1c1cc(-c2ccccc2)nc2ncnn12,1 Z1842615753,Cc(ccc(CN(C)C(C(CC1)CCN1c(cc1)ncc1C#N)=O)c1)c1F,0 Z1507937360,CC(C1)C1c1n[nH]c(NC(c(cc2)cc3c2n(C)cn3)=O)c1,1 Z1230238952,CCN(Cc(c(F)ccc1)c1F)C(Cc1csc(NC(c2cc(O)ccc2)=O)n1)=O,1 F6559-6040,Cn1ncc(S(N2C(C3)CSC3C2)(=O)=O)c1,1 Z1650920916,CCCNC(C(C)NC(c(cccc1)c1Oc1c(C(C)C)cccc1)=O)=O,0 SB16-0865,CCCNC(N1[C@@H](CCN(C2)C(Cc3cccs3)=O)[C@@H]2COCC1)=O,1 F678-0130,CCN(c(cccc1)c1N=C1N(CC2)CCN2C(NCc2ccc(C)cc2)=O)C1=O,1 M713-0235,CCCNC(c1c(C)n(CCN2CCCC2)c(C)c1)=O,1 Z1787723499,CC(CCN(C1)C(CSCC(N2CCCCC2)=O)=O)C1OC,0 Z2372658224,CC(C1(CCOCC1)OC)NC(C(C)(C)C)=O,0 S826-6120,CC(C)N(C[C@@H]1COC)C[C@@H]1c1nc(C2CC2)no1,0 F3066-0001,Cc(cc1)ccc1S(c(nc(NCC1OCCC1)s1)c1Cl)(=O)=O,1 F3301-0009,COc(ccc(C(Nc(cccc1)c1-c(o1)nnc1SCC=C)=O)c1)c1OC,1 Y031-4081,CCc(cc1)ccc1NC(C(C1)CN(C2CCCC2)C1=O)=O,0 F6089-6614,COc1c(C2(CNC(C(NCc3ccco3)=O)=O)CCOCC2)cccc1,1 C562-1711,CC(C)C(C(Nc(cc(cc1)OC)c1OC)=O)NS(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,0 F3230-0271,CC(Nc(cc1)ccc1OCC(Cn1nccc1)O)=O,0 F6502-2955,Cn1nc(C2CC2)cc1N(CC1)CCN1C(Cc1cccs1)=O,1 J031-1347,O=C(Cn1c(cccc2)c2c(C(C2CC2)=O)c1)NCc(cc1)cc2c1OCCCO2,0 Z2900717513,CN(Cc1nnc2n1CCCC2C(F)(F)F)c(cc1)ncc1C#N,1 Z2237908931,CN(C)C(CCCNC(C1(CC1)C(O)=O)=O)=O,0 F6510-3308,CN(c(cc(c(F)c1)NC(Cc(cccc2)c2OC)=O)c1N1C)S1(=O)=O,0 Z2368616322,Cc1nc2ccccc2nc1N(CC1)CCC1C1CNCC1,1 Z2863954085,CCCN1N=C(c2nnc3n2CC(C)(C)CC3)c(cccc2)c2C1=O,0 Z2952014840,CC(C)Cn1c(NC(C2=CC=C(C(C)C)NC2=O)=O)ncc1,1 Z3992152352,FCCn1ncc(Nc2cc(Oc(cccc3)c3Br)ncn2)c1,0 F6786-5800,Cc(cc1)nnc1OCC(CC1)CN1C(CC(CSC1=NC(C)=C2)N1C2=O)=O,1 F6472-9030,Cc1cccc(CC(N(C2)CC2N(CCN2)CC2=O)=O)c1,1 E532-2268,CC1=C(C(Nc(cc2)ccc2C(NC2CCCCCCC2)=O)=O)SCCO1,1 F3374-0844,Fc(cc1)ccc1Nc1c(cc(cc2)F)c2ncc1,0 CM3034-4768,Cc(ccc(S(N1CC2(CCOCC2)C(COCC2CC2)C1)(=O)=O)c1)c1F,0 Y206-4047,OC(C(C1CC2CC1)C2C(Nc(cc1)ccc1Br)=O)=O,0 G266-0563,CN(c(cc(c(N1CCOCC1)c1)NC(Nc(ccc(OC)c2)c2OC)=O)c1N1C)C1=O,0 SA92-0493,Cc1cc(C(N(CCC2)CC2(c2nc(C)no2)F)=O)nn1C,1 Z2393861181,CC(C)(C)c(c(C(Nc1cnc(CCC(C2)N)c2c1)=O)c1)nn1-c1ccccc1,1 F6747-9491,Cc1csc2c1ncnc2N(CC1)CCC1N(C)c(nc1)ncc1Cl,1 Z3092240035,CC(C)C(N(CCC1)CC1C(N(CC1)OCCS1(=O)=O)=O)=O,1 Z407262724,CC(C1)C1C(N(CC1)CCC1NC(c1c(C)cccc1)=O)=O,0 F6473-8223,CC(O1)=CC(OC(CC2)CCN2C(Cc2cn(C)c3c2cccc3)=O)=CC1=O,1 F432-0160,CC(C)Sc(cc(c(N1C)c2)N(C)C1=O)c2NS(c1cc(CCCC2)c2cc1)(=O)=O,1 SD14-0030,CCOc(ccc(CN(CC[C@@H]1NC(CN2C)=O)C[C@H]1C2=O)c1)c1OC,0 Z2904472217,C(c1csc(C2CC2)n1)Nc1nnc(C2CCCC2)o1,1 S654-0034,Cc1noc(C(C2)N(C)CC2(CC2)CCN2C(c2nccnc2)=O)n1,1 F1736-0781,CCOc(cccc1)c1NC(C(Cc1c2cccc1)OC2=O)=O,0 F616-0110,CC(CCc1ccccc1)NC(c(cc1)ccc1N(C(C=C1)=O)N=C1Sc(cc1)ccc1F)=O,1 F6415-0335,COCCN(Cc1cocc1)S(Cc1ccc(C(F)(F)F)cc1)(=O)=O,0 S629-1943,O=C(CCc(cc1)cc(C2)c1OCCN2C(C1Oc(cccc2)c2OC1)=O)NCC1CC1,1 S779-2132,Cc1cnc(C2CCC2)n1CC(CC1)CN1C(COc(cc1)ccc1F)=O,1 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Z1703190200,CC(c1cccc(O)c1)NC1CN(Cc2ccccc2)CCC1,1 Z2761320955,OC([C@@H](CC1)O[C@@H]1C(CC1)CCN1C(CCN(CCC1)C1=O)=O)=O,1 F6495-4964,CCOC(C(CCC1)CN1C(C(C1)CN1c1ncnc(-n2ncnc2)c1)=O)=O,1 V021-8693,Cc1cc(n(Cc2cc(F)ccc2)c(C(NCCN2CCOCC2)=O)c2)c2s1,1 SB95-0234,Cc(occ1)c1C(N(CCC1)CC1N(CCN1CCCCC1)S(C)(=O)=O)=O,1 F6444-0642,O=C(C1CC=CCC1)N(CC1)CCC1N1C(COCc2ccccc2)CCC1,1 Z1908347996,CCOc(nccc1)c1C(N1Cc(cc(cc2)F)c2OCC1)=O,0 F6677-0696,CC(C)c1nccn1CC(C1)CN1C(c1noc(C2CC2)c1)=O,1 F6521-7355,Cn(cc1)c2c1cc(C(CNC(c(o1)ccc1Br)=O)O)cc2,1 SB13-0180,CC(C)CN([C@@H]([C@H](CC1)C(NC2CCCCCC2)=O)c2cnccc2)C1=O,1 Z3727394368,COC(C(CC1)CCC11CCNCC1)=O,0 3391-6766,Cc1nc(SC(CC(N2c(cc3)ccc3OC)=O)C2=O)nc2ccccc12,0 Z1603665428,OC(C(c(cccc1)c1F)NC(Cc(cc1)cc2c1OCCO2)=O)=O,1 G346-0406,CCN(CC)C(C1CCC(CN(C(c(scc2)c2N2Cc(cccc3)c3F)=O)C2=O)CC1)=O,0 Z3071621061,Cc(cc1)cc(O)c1C(N(CC1)CCC1c1c(C(O)=O)nco1)=O,0 Y040-5718,C1(N[C@@H](C(Nc2c1cccc2)=O)CCC(N1Cc2c(CC1)cccc2)=O)=O,1 L525-0050,Cc(cc1)ccc1S(N(CC1)c2c1ccc(NC(Nc(cc(cc1)F)c1F)=O)c2)(=O)=O,0 F6550-1812,Cc1cccc(NC(N(C(CC2)C3)C2CC3F)=O)c1,0 F6564-3813,CC(C(Nc(cc1)cc(C(F)(F)F)c1Cl)=O)N1N=C(C2CC2)C=CC1=O,0 Z955511436,O=C(CN(CC1)CCN1C(c1csc(C2CC2)n1)=O)NC1CC1,1 F6480-0716,O=C(c1ccc(C(F)(F)F)cc1)N(CCC1)CC1Oc1ccncc1,0 T408-1924,CN(C)C(c1cc(CC(CC2)C(NCc3ncccc3)=O)c2s1)=O,1 SB46-0854,CS(N(C[C@H](C[C@H](C1)C(NCc2cscc2)=O)[C@H]1N1)CC1=O)(=O)=O,1 F120-0589,O=C(NCCn1c(cccc2)c2nc1CCc1ccccc1)Nc(cc1)cc2c1OCCO2,1 M022-0982,Cc1c(C)sc(-c2csc(S(N(CC3)CCN3c(cc3)ccc3Cl)(=O)=O)c2)n1,0 Z3370973906,CC(c1nccnc1)NC(c(cccc1)c1OC1CCCCC1)=O,1 Z2798472932,CC(C)CC(N(CC1)CCN1C(NCc(cccc1)c1C(O)=O)=O)=O,0 L383-0831,Cc1cc(N(CC2)CCN2c(cc2)nnc2SCC(Nc2cc(OC)cc(OC)c2)=O)c(C)cc1,0 Y031-3695,CC(C)CCS(c(cccc1)c1C(N)=O)(=O)=O,0 F2543-0109,O=C(N(C=CC=C1)C1=N1)N=C1SCc1cc(C(F)(F)F)ccc1,0 F6200-3931,OC(CNC(Nc(cc1)cc2c1OCO2)=O)(C1CC1)c1ccccc1,1 Z2627180951,CCC(CCC1)N1C(c(cc1)nc(N2)c1OC2=O)=O,1 F1800-0129,CCC(C(N1CC(Nc(ccc(F)c2)c2F)=O)=O)SC(CC)C1=O,0 F3407-4119,Cc(cc1)nc(N(CC(NC2CCCCC2)=O)C=C2c3nc(-c4cccc(F)c4)no3)c1C2=O,1 8015-2422,O=C(C1CC1)Nc(cc1)cc2c1c(cc(cc1)S(N3CCCC3)(=O)=O)c1o2,1 F6722-1064,COc(cccc1)c1N(CC1)CCN1c(nc1)ncc1Br,0 S649-0922,O=C(Cc1ccccc1)N(CC1)CCC1N(C1)C2(CCOCC2)C1OCC1CC1,1 SC76-0007,Cc(cc1)cc2c1[nH]c(CCNC(CN(C([C@]1(CO)[C@H]3C1)=O)c1c3cccc1)=O)n2,1 F6479-3046,O=C(CSCc1ccccc1)N(CC1)CCC1Oc(ccnc1)c1Cl,1 F129-0331,O=C(Nc(cc1)cc2c1OCCO2)NC(C(Oc1c2cccc1)=O)=C2N1CCCC1,1 Z2910664314,OC(C(CC1)(CC2)CCC12C(NCC1C(c2ccccc2)OCCC1)=O)=O,1 F398-0487,O=S(c(ccc(F)c1)c1F)(N(CC1)Cc2c1nc(-c1ccccc1)s2)=O,0 F6484-2056,N#Cc1nccnc1OC(CC1)CCC1NC(c1nccc2ccccc12)=O,1 Z1084882278,CCCCNC(N(CCC1)C1c(cccc1)c1OC)=O,0 SD14-0761,CCOc(ccc(CN(CC[C@@H]1N(C)C(CN2Cc3ccccc3)=O)C[C@H]1C2=O)c1)c1OC,0 F6241-0345,O=C(C(COC1)N(Cc2ccccc2)C1=O)Nc1cccc2cccnc12,1 F6274-0501,CS(c1ccc(CC(OC(C2)CN2c2nc(ccc(F)c3)c3s2)=O)cc1)(=O)=O,1 G404-2891,CC(C)n1cnc(S(N(CCC2)CC2C(NCc2cccs2)=O)(=O)=O)c1,0 Z1444267359,CC(C)CN(CCC(O)=O)C(c1c(C)nc(Cc(cc2)ccc2F)s1)=O,0 Z2330067596,CCN(CCC1(CCC1)O)C(CCN1)C1=O,1 F6521-7919,CN(C)S(c(cc1)ccc1C(NCC(c(s1)ccc1Cl)OC)=O)(=O)=O,0 D007-0338,COc(c(OC)c1)cc2c1[nH]c1c2N=CN(CCN2CCC(Cc3ccccc3)CC2)C1=O,1 F6436-2966,O=C(c(cccc1)c1SC(F)F)NCC(CC1)CCN1S(c1cnccc1)(=O)=O,0 F5835-0477,O=C(c(cc1)ccc1-n1cccc1)N(CC(C1)CN23)CC1C3=CC=CC2=O,1 G757-0060,O=C1N(C=CC=C2)C2=NC(CN(CC2)CCN2S(c2ccccc2)(=O)=O)=C1,1 D207-0223,OC(C(CCC1)CN1S(c1cc(F)ccc1)(=O)=O)=O,0 F6529-3503,O=C(CN1C(CC2)CCN2S(c(cccc2)c2Br)(=O)=O)N(C2CC2)C1=O,0 Z1127362355,CC(C(N1)=O)(c2cc(NC(c(cc3)cc(C(N4)=O)c3C4=O)=O)ccc2)NC1=O,1 F6482-2231,Cn1c(cccc2)c2c(CC(NC2CC3OCCOC3CC2)=O)c1,1 SA63-0728,Cc1ccc(CN(CC2)CCC22OCCC(CCNS(C)(=O)=O)C2)o1,0 F3334-3709,CCN(C(c1c2[nH]nc1-c(cccc1)c1O)c1ccc(C(C)C)cc1)C2=O,0 Z3204297550,CCC(C)(CC)C(NCc1nnc2n1CCN(C)C2=O)=O,0 Z1699043895,FC(C1CCC(CNC(CC2)Cn3c2nc(-c2ccccc2)c3)CC1)(F)F,0 V017-8261,O=C(CN(C1CC1)C(c(cccc1)c1F)=O)N(CCC1)CCN1c(cc1)nnc1-c(cc1)ccc1F,0 F5033-7814,CN(C)S(c(cc1)ccc1C(NCC(CC1)CCN1C(Nc(cc1)ccc1F)=O)=O)(=O)=O,0 Z812705016,CC(N(C)CC(N(CCC1)CCN1C(c(cc1)ccc1Cl)=O)=O)=O,0 Z2090049957,COc(cc1)cc2c1occ2C(NC(CCC1)CN1C(N1CCCC1)=O)=O,1 F6284-0126,O=C(CSCc1ccccc1)NCCc1cncnc1,1 Z1672886762,CCC(C)(CCC1)CN1C(C1=CN(CC)c(ccc(Cl)c2)c2C1=O)=O,1 D293-0010,CC(C1CC1)n1nccc1NC(c(cc1)ccc1Cl)=O,1 Z3345596411,CCCN(CC(NC)=O)C(c(cc1)cc2c1nc(-c1ccccc1)[nH]2)=O,0 CM4297-2645,O=C(COc(cc1)ccc1F)N(C1)CC1n1c(C2CCOCC2)nnc1,1 Z2763078264,Cc(cc1)c(C)cc1S(Nc1ccc([C@@H](C2)[C@H]2C(O)=O)cc1)(=O)=O,0 Z2199639653,CCOC(C)(CC1)CCN1c1ncnc2ccccc12,0 Z2265785396,CCN(CC)C(N(CC1)CCN1C([C@@H](C1)[C@H]1c1cc(OC)ccc1)=O)=O,0 F6573-1310,O=C(Cc(ccc(F)c1)c1F)NCC(CCC1)N1c1ncccn1,1 Z2607608569,CC(C(N(CC1)CCN1C(c1c(C)c(cccc2)c2s1)=O)=O)(C(O)=O)OC,0 Z1727939336,C[C@@H](C(N(CC1)CC1Oc(cc1)cc(Cl)c1Cl)=O)NC(N)=O,0 Z2394140818,CN(C1CCNCCC1)C(C(C1)C1c1cc2ccccc2cc1)=O,1 Z2994263407,CC(c1cc(C2CC2)ccc1)NC(c1nnc(-c2ccns2)o1)=O,1 F6521-5304,COC(CCSC)CNC(c1cccc(Br)c1)=O,0 Z2365394051,COCc(cccc1)c1OCC(N(CC1)c2c1cccc2)=O,0 S986-0496,Cc1cn(Cc2c(C)onc2C(N2C[C@](CN(C)C)(CN(C3)C(COC)=O)[C@H]3C2)=O)nc1,1 Y041-1324,C1(\C\2=C(/c3c(O1)cc(OCC(N[C@H](C(NCC(=O)O)=O)CC(C)C)=O)cc3)\CCCC2)=O,0 G350-0102,CC(CC1)CCC1Nc1c(-c2cccc(F)c2)nc2ncccn12,1 Z1958946577,CC(C)NS(N(CC1)CCC1c1cccc(Cl)c1)(=O)=O,0 F6524-2734,Cc(cc(cc1)F)c1S(N(CC1)CC1c1noc(C(F)(F)F)n1)(=O)=O,0 SA63-0765,Cc(ccc(S(N(CC1)CCC11OCCC(CCNS(C)(=O)=O)C1)(=O)=O)c1)c1F,0 F6287-0522,Cn1c(CCNC(CN(c(cccc2)c2O2)C2=O)=O)nc(-c2cccs2)c1,1 D399-2252,Fc(cc1)ccc1-c1n[nH]cc1CN(CCC1)C1c1cccc(F)c1,1 F5835-0385,O=C(C1c(cccc2)c2Oc2c1cccc2)Nc1cc(-c2n[nH]cc2)ccc1,1 Z266004742,Cc(cccc1)c1N1CCN(CC(NCC2CC2)=O)CC1,1 F6571-3904,COc(ccc(C(NCC(c1cccs1)OCCO)=O)c1)c1F,0 Z329734226,OC(c1csc(cc2)c1cc2Br)=O,0 Z1974729043,O=C(c(cn1)ncc1OCc1ccccc1)N[C@H](C1)C[C@@H]1c(cccc1)c1F,1 Z223844898,Cc1c(C)sc2nc(CN3CCCC3)nc(N(CC3)CCN3C(N3CCCC3)=O)c12,1 F6353-7315,O=C(NCC(c1cscc1)N1CCC1)N(CCN1)C1=O,1 Y030-8693,O=C(C1OCCC1)Nc1nnc(COc(cc2)ccc2Cl)s1,1 F5857-3525,OC(CNC(C1(CCCC1)c1cccs1)=O)(C(F)(F)F)c1ccccc1,0 Z3216016193,COC(CS(N(CC12CCCC2)c2c1cccc2)(=O)=O)OC,0 F5860-2670,Cc1c(C(NCCN2N=CC=CC2=O)=O)oc2c1ccc(OC)c2,0 V008-4847,O=C(COc1cc(F)ccc1)c(cc1)cc(N2Cc3nc(C(N4CCCC4)=O)cs3)c1OCC2=O,1 Z2371359456,OCCC(CCC1)CCN1C(Nc1cn(Cc2ccccc2)nc1)=O,1 Z1942258869,O=C(NCC1CN(Cc2ccccc2)CC1)N(CCC1)CC1n1ncnc1,1 Z2678167641,NCC(CC(N(CC1)c2c1cccc2)=O)O,0 F6502-5738,CCOc1ccc(CC(Nc2cn3nccc3nc2)=O)cc1,0 Y502-6515,Cn1ncc(S(N(CCC2)CC2C(Nc(cc2)ccc2S(N2CCOCC2)(=O)=O)=O)(=O)=O)c1,1 Z1684651661,COCCc1nc(Cc2c[nH]c(cc3)c2cc3Br)no1,1 Z3344449835,Cn1ncc(CN(C2CC2)C(Nc2c(N3CCCC3)nccc2)=O)c1,1 Z1746909271,CN(CC1)c(cc2)c1cc2C(Nc1cn(Cc(cc2)ccc2Cl)nc1)=O,1 V028-7691,O=C(c(cc1)ccc1F)N(CC1)Cc2c1nc(N1CCOCC1)nc2Oc(cc1)cc(F)c1F,0 C612-1007,Cc(cc1)ccc1N(C(c1c2cccn1)Nc1c(C)cc(C)cc1)C2=O,0 Z3686734305,CNC(C[C@@H](CN(C1)C(NCc2ccc(COC)cc2)=O)[C@H]1O)=O,0 F6190-1053,CN(C=CC=C1C(NCCC(c2ccco2)O)=O)C1=O,1 SC12-0022,Cc1ccc(C(N(CCCN(CC2)Cc3c2cccc3)C2CCOCC2)=O)s1,1 Z4497187885,CN(CC[C@@H]1NC(N(CC2CC(COC3)NC3=O)c3c2cccc3)=O)[C@@H]1c1ccccc1,1 F5086-1159,CC(C)n1nccc1C(N(Cc1cnccc1)c1nc2c(C)ccc(C)c2s1)=O,1 Z2176543739,COCC1(CCOCC1)C(OCc1coc(-c2ccc(C(F)(F)F)cc2)n1)=O,1 F6436-3956,COC(N(CC1)Cc2c1ccc(NC(c(cccc1)c1SC(F)F)=O)c2)=O,0 Z1554690987,CC(C)(C)n1ncc2c1ncnc2NCC1(CCO)CCC1,0 8018-3864,O=C(c1cc(-c2ccccc2)nc2ccccc12)Nc1cccc2c1COC2=O,1 F6412-1252,Cc1nc(C(NCC#CCOc(cccc2)c2OC)=O)cs1,1 F1872-0815,O=C(CSc1nccn1Cc(cc1)ccc1Cl)Nc(cc1)cc2c1OCCO2,1 Z477230822,Cc1noc(C)c1S(NC(C1CC1)=O)(=O)=O,0 3238-0425,CN(c1c(C(N2C)=O)n(Cc3cccc(Br)c3)c(NCCc(cc3)cc(OC)c3OC)n1)C2=O,1 Z2311605104,Cn1c(CCN(CC2)CCN2C(c(cc2)cc(F)c2F)=O)cnc1,1 Z1936425273,CC(C(Nc1nnc(C)s1)=O)N(C=Cc1c2cccc1)C2=O,1 F6574-1073,O=C(c(s1)ccc1Cl)NC(CC1)CCC1n1nccc1,0 F6519-4307,O=C(C1c(cccc2)c2Oc2c1cccc2)NCC(c1cccs1)n1nccc1,1 V022-8457,CC(C)NC(C(C)Oc1cc(C(c2ccc(C)cc2)N(CC2)C(C3CC3)=O)c2cc1)=O,0 Y041-8974,COc1ccc(cc(cn2)NC(CC(c3c4cccc3)NC4=O)=O)c2c1,1 Z1434675762,NC(c(cc1)ncc1NC(N1CCOCC1)=O)=O,0 F6764-1508,Cc1c(C(N(CC2)CCC2c2ccc(cc(cn3)Cl)c3n2)=O)scn1,1 Y205-0541,CC(C)Oc(cccc1)c1-c1nc2ccccc2c(C(NC(C)C2C(CC3)CC3C2)=O)c1,0 SB97-0005,CN(C(CNS(c1ccccc1)(=O)=O)CCc1c2cccc1)C2=O,1 F0630-1740,O=C(c(cc1)ccc1S(N1CCCCC1)(=O)=O)N1C(SCc2cnccc2)=NCC1,1 Z1252640887,CN(CCN(CC(Nc(cc(cc1)OC)c1OC)=O)C1)C1=O,0 Z2071431607,O=C(c1nc2cccnc2s1)N(CCCC1)C1c1n[nH]cc1,1 F0582-0152,CCOc(cc1)ccc1C(NCCSc1c(C)[nH]c2c1cccc2)=O,0 S689-0944,COc(cc1)ncc1C(N(C1)CC1N(CC(C1)C(NCC2CC2)=O)C1=O)=O,1 F0696-5181,O=C(c(cc1)nnc1N1CCC(Cc2ccccc2)CC1)NCCc1c[nH]cn1,1 S976-1387,O=C(C1(CN(Cc(cc2)cc3c2OCC3)CCC1)F)N1CCCC1,1 C301-5679,O=C(c1c2cccc1)NN(c(cc1)ccc1S(N(CC1)CCN1c1ccccc1)(=O)=O)C2=O,0 G122-1731,O=C(c1ccc(N(CC2)c3c2cccc3)s1)NCCCN1CCN(Cc2ccccc2)CC1,1 SB68-0521,O=C(C1CC1)N[C@@H]1Cn2ncc(C(NCc3ccccc3)=O)c2C1,1 F343-0082,O=C(CC(CC1)CCN1S(c1ccccc1)(=O)=O)NCC1OCCC1,1 Z2210206704,CC(C)n1c(CN(C)C(c2ccc[nH]2)=O)nnc1,0 Z1995520696,CC(CCNC1=O)C1NC(Cc1cccc(Cl)c1)=O,1 E867-0415,COc(cccc1)c1NC(c1cccc(NC(N2c3cccnc3SCC2)=O)c1)=O,1 Z2951165902,O=C(NC1(CC1)C1OCCCC1)Nc1nccc(Br)c1,0 P222-0123,O=C(C1OCCC1)N(CC1)CCC1c1nn(CCCNC2=O)c2c1,1 S661-1330,CCN(C(C(C1)N2CC1(CC1)CCN1S(c1cn(C)cn1)(=O)=O)=O)C2=O,1 F6424-0925,CN(C(C=C1)=O)N=C1c(cccc1)c1NC(C(C(OC)=C1)=NN(c2ccccc2)C1=O)=O,1 V031-1554,O=C(C(C1)C(CN(CC2)c3ccccc3)N2c2c1cccc2)NCc1ccco1,0 F5686-0026,O=C(CSc1ncnc(N2CCOCC2)c1)c1cccs1,1 Z1192103729,Cc1ncnc(N2[C@@H](CO)CCC2)c1F,0 F6562-8179,O=C(CCc(cc1)cc(Cl)c1F)NCC1c(cccc2)c2OC1,0 F6427-0118,O=C(COc1cccc2ccccc12)NCCN(C(C=C1)=O)N=C1n1ncnc1,1 F6512-1599,O=C(Cn(cc1)c2c1cccc2)NCc1nc(C2CCCCC2)cs1,1 Y040-8585,N\1(C(c2c(\N=C1)cccc2)=O)C[C@H]1CC[C@H](C(N[C@H](C(=O)O)Cc2ccc(cc2)O)=O)CC1,0 Z4884575396,Cc1ccc(CC(NS(c2cc(Br)cnc2OC)(=O)=O)=O)cc1,0 L775-0119,Cc1c(COCc2nn(C)c(CC3)c2CN3C(Nc2cccc(C(F)(F)F)c2)=O)cccc1,0 Z2722622824,OC(CNC(CC1)CN1c(ccc(Cl)c1)c1F)c(cc1)ccc1F,1 Z982160298,COc(cc(cc1)Cl)c1-c1nnc2n1CCCC2,0 F6517-3713,OC(CNC(C1Oc(cccc2)c2OC1)=O)c(cc1)ccc1-c1ccco1,1 F6559-0670,O=C(C1(CCCC1)c1cccs1)N(CC1)CCC1N(C=Nc1c2cccn1)C2=O,1 Z4774171056,CC(CC1CCCCC1)NS(c1ccco1)(=O)=O,1 S595-0740,O=C(NCCc1ccccc1)N(CCCC1)C1c1noc(COCC2CC2)n1,1 2969-0195,O=C(CSC(N1Cc2ccccc2)=Nc(sc2c3CCC2)c3C1=O)c(cc1)ccc1Br,1 F2018-2737,CN(C)CCN(C(c(cc(s1)Cl)c1Cl)=O)c1nc(c(F)cc(F)c2)c2s1,0 Z383586010,Cc1cc(C)nn1-c(cc1)ncc1NC(c(cc1)cnc1OC)=O,0 Z2103004924,CCS(N1C[C@@H](C)N(Cc2nc(-c3ccc(C(C)C)cc3)no2)CC1)(=O)=O,0 Z3686930498,O[C@@H]1[C@@H](CC(NCc(ccc2ccccc22)c2F)=O)CNC1,0 F0439-0010,Cc1c(C)sc(N=C(N2)SC/C=C/c3ccccc3)c1C2=O,1 F850-1720,CN1c(cc(cc2)Cl)c2OCC1CC(N1CCCC1)=O,1 F5854-5786,COc(cc1)cc(C(N(CC(F)(F)F)Cc2cscc2)=O)c1Br,0 F6805-5583,CN(C(CC1)CCN1C(N(C)C1=O)=Nc2c1scc2)c(nc1)ncc1Cl,1 SB18-0257,Cc1cc(C(N(C[C@H](C2)NC(C3CCOCC3)=O)[C@@H]2c2nc(C)n[nH]2)=O)c(C)o1,0 Z2043235328,C[C@H](CO)N(C)S(c(cccc1)c1Br)(=O)=O,0 F3259-0354,CN(c1c(C(N2C)=O)n(Cc(cccc3)c3Cl)c(SCC(OCc3ccccc3)=O)n1)C2=O,1 Z2242023176,CC(C)(C1)CC1NC(c1cc(Cl)nc(Cl)c1)=O,0 SA72-0995,Cc1cc(C(N(CC2)CCC2(CCOC)c2noc(C3CCOCC3)n2)=O)no1,0 Z1430635361,OC[C@@H](c1ccccc1)NC(c(cc1)cc(N2)c1SCC2=O)=O,0 Z3079718978,C[C@H](c(ccc(OC)c1)c1OC)Nc1ncnc2c1cc[nH]2,0 S591-0908,Cn1nccc1C(N(C1)CC1N(C1CCOCC1)S(C)(=O)=O)=O,1 SB54-0782,Cc1noc(C)c1S(N(C[C@@H]1COC)C[C@@H]1c1nnc(-c2ccccc2)o1)(=O)=O,0 C066-3498,Cc(cc1)cc-2c1OCc1c2n(CC(NCCCN(Cc2ccco2)C2CCCC2)=O)nc1,0 S639-3433,Cc1cc(C)nn1CC(N[C@@H](C1)[C@@H](CN(C)C)CN1S(C)(=O)=O)=O,1 F2880-3623,Cc1ccc(C(CNS(CCc2ccccc2)(=O)=O)N2CCOCC2)cc1,0 F6473-4302,O=C(CN(C=Nc1c2cccc1)C2=O)N(C1)CC1N(C(C1C2CC=CC1)=O)C2=O,1 CM4286-4822,CC(C)c(cc1)ccc1S(N(CC1)CC1(CC1)CN1c1cnccc1)(=O)=O,0 F5614-0103,CC(C)S(c1ccc(CC(N2CCN(Cc3nc(cccc4)c4[nH]3)CC2)=O)cc1)(=O)=O,0 Z245197204,OC(CC1)CCN1C(c(cc1)ccc1C#Cc1ccccc1)=O,0 S613-1166,O=C(C1CCCC1)N(CCC1)C1c1nc(CCOCC2CCOCC2)no1,1 SB01-0185,Cc1cc(OCc2nn(C)c(CC3)c2CN3C(C2(CC2)c(cc2)ccc2OC)=O)ncc1,0 F6458-0077,O=C(c1ncccc1)N(CC1)CCN1c(cc1)nnc1-n1ncnc1,1 Y042-1408,CC(C)n1c(cccc2)c2nc1CCNC(CN(C=Cc(cc1OC)c(C2)cc1OC)C2=O)=O,1 F6619-2088,CC(CC1)(C1NC(c1cn(C)nc1C(F)F)=O)O,1 Z1333653327,O=C(c1ccc(CNC(c(cccc2)c2OCC2CC2)=O)cc1)Nc1cnccc1,1 F6804-4821,CN(C(CC1)CCN1c(cc1)cnc1C#N)c1ncccc1,1 Z4009485080,Cc1c(C(N(C[C@@H](C2)OC)[C@@H]2C(O)=O)=O)sc2nc(C(F)(F)F)ccc12,0 F176-0518,Cc1noc(C)c1-c1cc(S(N2CCC(Cc3ccccc3)CC2)(=O)=O)c(C)cc1,1 F6475-2766,COCCOc1nccc(C(Nc2nccs2)=O)c1,1 F6727-5121,O=S(c1cnccc1)(N1CCC(COc2ncnc(-c3ccccc3)c2)CC1)=O,1 F5854-2677,O=C(C1Oc(cccc2)c2OC1)N(CCc1cccs1)Cc1ccco1,1 C880-0018,Cn1c(C(N(CC(N(CC2)CCN2C2CCCCC2)=O)N=C2)=O)c2c2c1cccc2,1 F6571-5756,CC(Cc1csc2c1cccc2)NC(C(Oc1c2cccc1)=CC2=O)=O,1 N106-1972,CCn1nccc1C(N(C[C@@H]1CCC2)[C@H](CCCC(NC)=O)[C@@H]3[C@H]1N2CCC3)=O,1 F6713-4764,N#Cc(cc1)cnc1N1CC(CN(C2)c3ccccc3)C2C1,1 F6525-8133,COc(cccc1)c1NC(N(CCn1nc(C(F)(F)F)cc1)C1CCCC1)=O,1 3209-1367,CN(CCc1ncccc1)C(c1nn(C(CC(c(cc2)ccc2Cl)N2)C(F)(F)F)c2c1)=O,1 SA68-1083,Cn1cnc(C(NCCN(C(CC2)CCN2S(C)(=O)=O)C2CCOCC2)=O)c1,1 Z743861336,COc(ccc(CNC(c1cncc2ccccc12)=O)c1)c1C(O)=O,1 F5831-3365,O=C(NCc1ccccc1)N(CC1)CC1c1ccccc1,0 Z1130324756,CC(Cc1c2cccc1)CN2S(c1cn(C)c(C(NC)=O)c1)(=O)=O,0 C989-0572,CN(Cc1ccco1)C(CN(c(ccc(S(N1CCCC1)(=O)=O)c1)c1O1)C1=O)=O,1 Z3071615716,CCOC(c1c(C)nc(C2CCN(CC3CCOCC3)CC2)[nH]1)=O,1 F2393-0050,CC(C)CS(NCC(c1cscc1)N(C)C)(=O)=O,0 F5857-2252,OC(CNC(Nc(c(F)ccc1)c1F)=O)(C1CC1)c1cccs1,1 Z928030494,Oc1cccc(CCNC(C2CC2)=O)c1,0 F6089-8139,CC(C)(C)NC(N1CCC(CNC(C2(CCOCC2)c(cccc2)c2OC)=O)CC1)=O,0 F5857-7128,COc1cccc(CNC(C(NCCC(c2ccccc2)O)=O)=O)c1,0 D430-1072,Cc1cc(S(N(CC2)CCN2c2nc(C)nc(N3CCCC3)c2)(=O)=O)c(C)cc1OC,0 E216-5272,CCC(C1)Oc(ccc(C)c2)c2N1C(NCc1ccc(C)cc1)=O,0 SA58-0501,COc(ccc(S(N1C(CCc2noc(C3CC3)n2)CCC1)(=O)=O)c1)c1OC,1 F6360-9444,CC(C(N(C1)CC1Oc1cnccc1)=O)NC(OC(C)(C)C)=O,0 F6529-2114,O=C(Cn1c(cccc2)c2nc1)N(CC1)CCC1N(CC(N1c2ccccc2)=O)C1=O,1 Z2953572953,OC[C@H](C1)C[C@@H]1NC(NC(C(F)F)c1cccc(Cl)c1)=O,0 F5527-0380,COC(c(cc1)ccc1NC(C(CCC1)CN1c(cc1)nnc1-c(cc1)ccc1Cl)=O)=O,0 F6064-3972,CNC(c1cccc(-c2noc(C(C3)CN3C(NC3CCCCC3)=O)n2)c1)=O,1 Z1550024884,Cc(cc1)ccc1-c1cnc(CNC([C@H](c2ccccc2)O)=O)o1,0 F1308-0035,Cn1c(SCCc2ccccc2)nnc1-c(cc1)cc2c1OCO2,1 Z1997405439,O=C([C@@H](CCC1)NC1=O)N1CC(c2cccc(Cl)c2)OCC1,0 Z2483025121,CCCC1C(CNC(C2CCn3nnnc3CC2)=O)CCCC1,1 V001-2970,COc(ccc(-c1c(CCC2)c2no1)c1)c1NC(c1cccc(OC(F)(F)F)c1)=O,1 SD68-0901,O=C1N(Cc(cc2)ccc2F)CCN(CCC2)C1CN2S(Cc1cc(F)ccc1)(=O)=O,1 F6515-3681,O=S(c(s1)ccc1Br)(N(CC1)CC1n1nccn1)=O,1 F6804-8544,N#Cc(ccnc1)c1N(CC1)CCC1C(F)(F)F,0 S700-1364,Cc1cccc(OCCc2noc(C(C3)CN3S(Cc(cccc3)c3F)(=O)=O)n2)c1,1 F2899-0092,O=C(C1Oc(cccc2)c2OC1)N(Cc1ccco1)c1nc(cccc2)c2s1,1 Z1609633505,Cc(cc1)cc(F)c1-n1nc(C(N(CC2)Cc3c2ccc(C(O)=O)c3)=O)c2c1CCC2,1 F5105-0011,O=S(c(cccc1)c1Cl)(NCc1cscc1)=O,0 Z1154604353,Cn1c(-c2nccnc2N)nc2c1nccc2,0 SD07-0167,CC(C)C(NCc1c(COC(CC2)(CN2S(c2ccccc2)(=O)=O)C2)n2nn1)=O,0 F5607-0059,Cc1nccn1-c1cc(NCCNC(c2c[nH]c3c2cccc3)=O)ncn1,1 F6524-1903,Cn(c(C(N(CC1)CC1c1nocn1)=O)c1)nc1-c(cc1)ccc1F,1 Z1597018227,O=C(C1COCCC1)NS(c1cc(COC2)c2cc1)(=O)=O,1 Z1389691873,Cc1c(CCNC(N(CCN2C3CC3)CC2=O)=O)ccc(F)c1,0 Z1254327412,CC(CN(Cc1ccccc1)CCC1)N1C(Nc1nn(CCOC)cc1)=O,1 F6793-6978,FC(CN(CC1)CCN1c1nc(C2CC2)ns1)(F)F,1 Z4461652158,CC(c1c[nH]nc1)Nc(cc1)ccc1-c1cn(cccc2)c2n1,0 V020-7526,CC(CC1)CCN1c1nc(CCN(Cc2cccn2C)C2)c2c(Oc(ccc(F)c2)c2F)n1,0 SD31-0203,O=C(c1nn(CCNC(Nc(cc(cc2)F)c2F)=O)c2c1COCC2)N1CCOCC1,1 F5382-0604,CCOc(cc1)ccc1NC(Cc1csc(Nc(cc2)ccc2F)n1)=O,0 Z1277986777,CN(C=CC=C1NC(NC2CN(Cc(c(F)ccc3)c3F)CCC2)=O)C1=O,1 S567-0317,Cc1noc(C)c1S(N1CCC(CC2)(CCC2(CN2CCCC2)O)CC1)(=O)=O,1 F2496-0263,O=C(C1CC1)OCc1noc(-c(cc2)ccc2Cl)c1,1 SB57-0236,Cc1ccc(CN(C2)CC2(CN(C2)C(COC)=O)C2c2nc(C)no2)s1,1 F6685-9132,Clc(cccn1)c1OCC1CN(CCn2nccn2)CCC1,0 Z2996790855,Cc(ccc(Cc1noc(C(N)=O)n1)c1)c1OC,0 S579-0539,O=C(CC1=C(CCCC2)C2N(Cc2ccccc2)C1=O)NCCc1ccccc1,1 F6451-3021,COC(CNC(C(NCCC1=CCCCC1)=O)=O)c(cccc1)c1Cl,0 F6752-3352,COc(cc1c(N(CCC2)CC2NS(C2CC2)(=O)=O)ncnc1c1)c1OC,1 F6559-1457,Cc(cc1)ncc1C(NC(CC1)CCC1(F)F)=O,0 SC46-0510,CC(C)c1n[nH]c(C(C2)C3(CCCC3)CN2C(c2cc3cccnc3cc2)=O)n1,1 F3055-0722,CCOC(c(cc1)ccc1NC(c1cc2nccnc2cc1)=O)=O,0 F6573-6878,O=C(c(cc1)ccc1-n1cccc1)N(CCN1c2ncccc2)CC1=O,1 F6512-0806,O=C(Cc(cc1)cc2c1OCO2)Nc1cc2ccnn2cc1,1 F6667-6327,Cc1cnc(N(CC2)CCN2c2cccc(Cl)c2)nc1,0 Z2440697878,NC(CNC(c1coc(-c2ccccc2)n1)=O)C1CC1,1 Z3071573297,COC(C1)(CC1NCc1c(C2CC2)n(-c2ccccc2)nn1)OC,1 Z4918243072,CC(CC(C([O-])=O)NC(C(C)(C)c1cccc(Cl)c1)=O)O,0 F6359-2966,O=C(CCCc1ccccc1)N(CC1)CCC1Oc1nccnc1,1 K402-1066,Cc(cc1)cc(C)c1-n1ncc2c1ncnc2N(CC1)CCN1c1c(C)ccc(C)c1,0 3578-0865,Cc1cccc(CC(CC(N2c3nc4ccccc4cc3)=O)C2=O)c1,0 Z1359500748,Cc1cccc(O)c1NS(CC1OCCCC1)(=O)=O,0 Z442302386,CC(CC1)(CS1(=O)=O)NC(c1n[nH]cc1)=O,0 F6597-2628,CN(C=CN=C1N2CCC(COc3cccc(C(F)(F)F)n3)CC2)C1=O,0 Z2852854388,CN(Cc(cc1)cc2c1OCCO2)C(N1CCCCCC1)=O,1 F6525-4589,CC(C)(C)NC(NCCn1ncc(-c2ccccc2)c1)=O,0 F6546-1033,Cc1cccc(CN(C2CC3)C3c3c2cccc3)n1,1 Z1866939364,O=C(c1c[nH]nc1-c(s1)ccc1Cl)NC(C1)C11CCCC1,1 F6525-2881,Cn(cc1C(NCc2cc(-c3cnccc3)nn2C)=O)nc1OC,1 F6619-7519,C(/C=C/c1ccccc1)N(CC1)CCN1c1ccc(-n2nccc2)nn1,1 Z3628530896,CC(C)c1cccc(-n2nc(C(N3CC(C4)(CN(C)C4=O)CCC3)=O)c(O)c2)c1,1 F6446-1332,O=C(Cc1noc2c1cccc2)NCC(CCC1)CN1c1nccs1,1 F6539-2116,CN(C)S(N1CCC(CNC(C2=CC=CN(C)C2=O)=O)CC1)(=O)=O,0 F2257-0261,CCOc1ccc(CC(Nc(cc2)cc(C3)c2NC3=O)=O)cc1,0 F2150-0044,CCOc(cc1)ccc1C(c(cc1)cc(N)c1Cl)=O,0 F5782-0216,Cc1cc(C(NCC(CC2)CCC2c2nc(cccc3)c3[nH]2)=O)no1,1 F6809-1110,Cc1nc(CCC2)c2c(N(CC2)CCC2(c(cc2)ccc2Cl)O)n1,1 F6523-3196,Cc1c(C(NCCN(Cc(cc(cc2)F)c2OC2)C2=O)=O)scn1,1 F6287-0108,O=C(C1Oc(cccc2)c2OC1)NCCc1nc(-c2cccs2)c[nH]1,1 Z433150808,CCCC(c1ccccc1)NC(NCC(c(cc1)ccc1OC)N1CCOCC1)=O,1 F6439-8327,O=S(c1cc(CCCC2)c2cc1)(NCCn1c2cc(-c3ccco3)nn2cc1)=O,1 8011-6109,O=S(c(cc1)ccc1-c1ccccc1)(Nc1cc(-c2cn(cccc3)c3n2)ccc1)=O,1 Z2181616810,O=C(NC(CC1)Cc2c1[nH]cn2)N1CCC2(CCC2)CC1,1 Z1083838766,Cc1ccc(-c2n[nH]c(C(N3Cc(cccc4)c4N(C)CC3)=O)c2)o1,1 G551-0208,O=C(Nc(ccc(Br)c1)c1F)N1C(Cc2ccccc2)c2cccn2CC1,0 S823-0307,OC[C@@H](CN(C1)c2ncncc2)[C@H]1NC(c1cc2cccnc2cc1)=O,1 J031-1740,N#Cc1ccc(CSc2nnc(-c(cc3)cc4c3OCCCO4)n2C2CC2)cc1,1 F2574-0563,Cc1cc(S(N2C(CNC(C(NCCC3=CCCCC3)=O)=O)CCC2)(=O)=O)c(C)cc1,1 F6510-4445,COc1cccc(CN(c(cccc2)c2N2C3CC3)S2(=O)=O)c1,1 SA24-1301,COc1c(CC(N(C2)CC2N(C2)[C@H](CO)CC2(F)F)=O)cccc1,0 Z4511283879,COCC1N(Cc2cc(F)cc(-c3n[nH]nn3)c2)CCOCC1,0 F5834-0984,COc(cc1)cc(C(Nc2cc(N(CC3)C(c4cccs4)=O)c3cc2)=O)c1Br,0 Z2475631375,COc1ccc(Cn2ncc(C(N(CCC3)CC3(F)F)=O)c2)cc1,1 F6562-8482,O=C(NCC1c(cccc2)c2OC1)NCc1cccc2ccccc12,1 Y044-4733,CC(C)CCn1c2cccc(OCC(NC(CC3)CS3(=O)=O)=O)c2cc1,0 F6178-7844,COc1c(CNC(C(NCC(CC2)CCN2C2CSCC2)=O)=O)cccc1,0 Z3192409223,CN(CC(C1CC1)O)C(c(cc1)cc(OC(F)(F)F)c1F)=O,0 Z3290578268,CC(C1)(CN1c(nc1)ncc1Br)N1CCOCC1,1 Z2042471665,CC(C)Oc(nccc1)c1C(NC(C)(CC1)CS1(=O)=O)=O,0 Z1319772535,O=C(c1ccccc1)NCC(CCCC1)N1C(C1=Cc(cccc2)c2NC1=O)=O,1 Z1232164055,OC1(CNC(c2cnns2)=O)CCCCCC1,1 F2261-0083,CC(C)(COc(cc(cc1)NC(c2cccc3ccccc23)=O)c1N1C)C1=O,1 C779-0448,CCn(c(C(N(CCC1)CC1C(NCCCN1CCN(CC)CC1)=O)=O)c1)c2c1scc2,1 SA58-0864,O=S(c1ccccc1)(N1C(CCc2noc(-c3ncccc3)n2)CCC1)=O,1 F5686-0913,O=C(CSc1ncnc(N(CC2)CCN2c(cccc2)c2F)c1)c1ccccc1,1 Z2916467353,OC1(CCCC1)C(C(N(CC1)CCC1c1n[nH]nn1)=O)(F)F,1 F6564-7892,CC(C(Nc(cc1)ccc1-c1ccn[nH]1)=O)N1N=C(CCC2)C2=CC1=O,1 SA05-0802,Cc1nnc2n1CCN(Cc1cccs1)C2C(NC1CC1)=O,1 F0580-0715,CSC(N(c(cc1)ccc1F)C1=O)=Nc2c1[nH]c1c2cccc1,0 F6724-4143,Cn1ncc2c1ncnc2NCC(c(cc1)ccc1SC)O,0 M121-1772,CC(C)CNC(c(cc1)cc(CC2)c1N(Cc1ccccc1)C2=O)=O,1 F6240-2733,Cn1c(C(N2CCN(Cc3nncn3-c(cccc3)c3F)CC2)=O)ccc1,1 Z2010310758,CC(C)(C)n1ncnc1CSc1ncc(-c2ccccc2)n1CC1OCCC1,1 F6475-1828,CS(N(CC1)CCN1C(c(cn1)cc(Cl)c1OC1COCC1)=O)(=O)=O,0 F6475-5949,O=C(c1cc(OC2CCCC2)ncc1)NC(C1)CN(C2CC2)C1=O,1 G008-3239,CN(CC1Oc(cccc2)c2OC1)S(c1ccc(-c2noc(C(F)(F)F)c2)s1)(=O)=O,1 S762-0168,CCN([C@@H](CCCC1)[C@]1(CC1)C(NCCc2cc(C)ccc2)=O)S1(=O)=O,1 F6412-1465,COc(cccc1)c1OCC#CCNC(c1nccnc1)=O,0 S779-2124,Cc1cnc(C2CCC2)n1CC(CC1)CN1C(Cc1c[nH]c2c1cccc2)=O,1 Z2589141676,CC(CO)(CO)CSc1nc(-c2ccc(C)o2)cc(C(F)(F)F)c1C#N,0 F6677-3128,CN(C=C(C(N1CC(Cn2ncc(Cl)c2)C1)=O)C(OC)=C1)C1=O,1 D337-1366,O=C(c1noc(-c(cc2)cc3c2OCCO3)c1)N(Cc1ccccc1)C(CC1)CS1(=O)=O,0 Z3688937581,Cc(ccn1nc2)cc1c2C(NC(CO)c1cnccc1)=O,0 Z3063545222,CCCNC(C(CC1)CCN1C(c(cccc1)c1-c1ncc[nH]1)=O)=O,1 F6702-2266,Fc(ccc(CN1CCC(COc2nccnc2)CC1)c1)c1F,0 F794-0926,Cn1cnc(S(N(CCC2)C2c2nnc(C(Nc(cc3)cc(F)c3F)=O)s2)(=O)=O)c1,0 D750-0313,COCCn1c2cccc(NC(CC3(CCOCC3)N(Cc3c4cccc3)C4=O)=O)c2cc1,1 Z1671085591,O=C(Nc1cn(Cc2ccccc2)nc1)N(CC1)CC2N1CCOC2,1 T368-2790,O=C(NC1CCCCC1)N(CC1)CC1n1c(nccc2)c2nc1-c1cscc1,1 Y031-4612,CCC(C)(C)c1nnc(NC(C(CC2)CCN2C(C(CC2=O)CN2c2ccc(C)cc2)=O)=O)s1,0 Y205-0499,OC(C(C1CC2CC1)C2C(NC(CCC1)c2c1cccc2)=O)=O,1 G433-0415,CN(c(c(N1C)c2)cc(NC(Nc(c(OC)c3)cc(Cl)c3OC)=O)c2Oc2ccccc2)C1=O,0 F5854-2407,O=C(c1c(C(F)(F)F)cccc1)N(Cc1cscc1)Cc1ccco1,0 F5833-4545,Cc(ccc(N(CCC1)S1(=O)=O)c1)c1NC(c1nc2ccccc2nc1)=O,1 F2135-1703,CN(C)C(CSc1nc(-c2ccccc2)cc(C(F)(F)F)n1)=O,0 M976-0640,O=C(C1CCC1)N(CC1)c(cc2)c1cc2N(CC(C1)C(NC2CCCC2)=O)C1=O,1 Z1521675525,Cc1ccc(C(CCC2)N2C(C(CC2)Cc3c2[nH]nc3)=O)cc1,0 S664-1963,Cc1n[nH]cc1C(N(CC1)CCC1(CC1)C1OC)=O,0 Z2465361414,O=C(c1c(C(F)(F)F)c2ccccc2nc1)N[C@H]1CNCCC1,1 F6441-5524,COCCOc(cc1)ccc1C(N(C(CC1)C2)C1CC2SC)=O,0 Z2168895250,O=C(c1cnnc(-c2ccccc2)c1)NCc1cnccc1,1 F3386-3145,CC(c1ccccc1)NCC(Cn1c(cccc2)c2c2c1cccc2)O,1 F6539-2166,CN(C)S(N1CCC(CNC(C2Oc(cccc3)c3OC2)=O)CC1)(=O)=O,0 S510-1264,CCNC(N(CCC1)C1c1noc(CCC(NCc2ccc(C)o2)=O)n1)=O,1 Z1414946475,CS(N1CCN(CC(NC2(CCC2)c2cc(C(F)(F)F)ccc2)=O)CC1)(=O)=O,1 Z1954557556,[O-][N+](c1cccc(C(N(CC2)CCC2c2cccc(Cl)c2)=O)c1)=O,0 V006-6635,O=C(c(cc1)ccc1Br)N(CCC1)CC1OCc1ccc(C(F)(F)F)cc1,1 Z1729671283,CC(CCCC1)CN1C(c1c(C)c2c(N)nc(C)nc2s1)=O,1 F5871-0672,CS(N1CCN(CCNC(c2cc(Cl)cc(Cl)c2)=O)CC1)(=O)=O,0 F782-0954,CCC(CC)C(Nc(cc1)cc2c1sc(NC(C)=O)n2)=O,0 S693-0485,Cc1cnc(C2CCOCC2)n1CC(CCC1)CN1S(Cc1ccccc1)(=O)=O,0 F6438-7069,CN(Cc1cccc(Br)c1)C(CC1)C1O,0 F6400-0248,CC(C)Sc1ccc(CC(N2C(CN(C)C)CSCCC2)=O)cc1,1 SA18-0172,CN(CCn1c2nc(C(N(CC3)Cc(c4ccc5)c3[nH]c4c5F)=O)c1)C2=O,1 F6578-6867,CN(C(C=C1)=O)N=C1C(NCc1nc(N2CCCC2)ccn1)=O,1 SD61-0474,CC(C)CC(N(C1)CC2(CCC2)C1C(NCc1ccncc1)=O)=O,1 SA72-0574,Cc1nc(C(CCOC)(CC2)CCN2C(CCCc2nc(cccc3)c3s2)=O)no1,1 F5832-2526,O=C(c1nccnc1)NCC(c1cccs1)N1CCOCC1,1 Z1972629219,CCC(C)(COCC1)N1C(C(O1)=Cc(cccc2)c2C1=O)=O,1 F1907-9528,NCc1cn(-c(cc2)c(C(F)(F)F)cc2Cl)nn1,0 Z1791221047,Cc(cc1)cc(C(N(CC2)Cc(cc3OC)c2cc3OC)=O)c1-n1cnnc1,1 F3393-0297,CCN(C=C1c2nc(-c(cc3)cc4c3OCO4)no2)c(cccc2)c2C1=O,1 Z2761560950,CC(C)c1cc(C(F)(F)F)c(N(C2)CC2(CN(C)C2)C2c2nnc(C)[nH]2)nn1,0 F6559-1361,Cc1nc(cccc2)c2n1C(CC1)CN1C(c1cc(C2CC2)n[nH]1)=O,1 P859-0147,Cc1c(C(NCCN(C)C2CCCCC2)=O)nc(C)n1C1CCN(C)CC1,1 SA24-0205,CCn1nc(C)c(-c2cc(C(N(C3)CC3N(C3)[C@H](COC)CC3(F)F)=O)no2)c1C,0 F1754-0009,OC(c1c(-c2ccccc2)[nH]c2c1cccc2)c1ccncc1,1 E856-2248,O=C(c1ccc(CN(c2cc(-c3ccccc3)nn2CC2)C2=O)cc1)NCc1cnccc1,1 J025-1120,O=C(CC1c(cc(cc2)F)c2F)Nc2c1scc2-c(cccc1)c1F,0 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S836-0319,COC[C@@H](CN(C1)c2ncccn2)[C@H]1C(N(CC1)Cc2c1cccc2)=O,1 Y502-7781,CCn1ncc(NC(C(CCC2)CN2S(C)(=O)=O)=O)c1C(Nc1c(C)n(C)nc1)=O,1 J007-0288,Cc1noc(C)c1C(CCC1)N1C(Nc(cc(cc1)OC)c1OC)=O,0 Z4074202118,Cc1c(C(N(CC2)CC2C2CC2)=O)sc2nc(C)nc(N)c12,1 Z2965495088,Cn1ncc(-c2c(NC(CC3=CCCCC3)=O)n(CCCC3)c3n2)c1,1 Z1499617498,NC(c1ccc(C(N2CC(Cn3nncc3)CCC2)=O)s1)=O,0 SC72-0434,COCCNC(N(C1)CC11OCc2c1cnc(C1CCCCC1)n2)=O,0 F6685-8733,Cc1nn(ccnc2N3CC(COc4c(C(F)(F)F)cccn4)CCC3)c2c1,1 F2158-0382,Cc(cc1)ccc1NC(Cn1c(NCCN2CCOCC2)nc2c1cccc2)=O,1 Z1510562381,O=C(CC1CCC1)N(CC1)CCC1c1ncccc1,1 SB56-0629,CC1(CC1)C(N(C[C@@H]1c2nc(-c3ccccc3)no2)C[C@@H]1c1cnccc1)=O,1 L299-2385,CCc(c(-c1cc(S(N(C)Cc2ccccc2)(=O)=O)c(C)cc1)c1NC(CC2)=O)nn1C2=O,0 V016-1769,CCC(C)c1nc(N(CC2)CCN2C(C2CCC2)=O)c(c(CCC(C)C2)c2s2)c2n1,1 F5860-3695,Cc1cc(C)nn1CC(N(CC1)CCN1c1ncc(C(F)(F)F)cc1)=O,1 F6478-1972,O=C(c1cscc1)N(CC1)CC1Oc(nc1)ncc1Br,1 S988-0627,Cc1noc([C@@](CN(C2)C(C3CC3)=O)(C3)[C@@H]2CN3S(c(cc2)cc(C)c2F)(=O)=O)n1,0 F6526-1534,O=S(Cc(cc(cc1)F)c1F)(N(CCn(cc1)nc1-c1ccncc1)C1CCCC1)=O,1 Z1470696738,CCC1(CNc(c(C)c2C)nn3c2nnc3C(F)(F)F)CC1,1 Y501-1958,Cc1nn(C)cc1C(CC(c1c2cccc1)OC2=O)=O,1 Z1001811576,O=C(CCNC(NC1(CC(C2)C3)CC3CC2C1)=O)N(CC1)CCN1C(c1c(cccc2)c2n[nH]1)=O,1 S724-0484,Cc1nn(C)c(C(N(C2)CC2n2nnc(C(N3CCCC3)=O)c2)=O)c1,1 V019-1892,CC(C)C(N(CC(N(CC1)C(COc2ccccc2)c2c1scc2)=O)C(C)C)=O,0 F1897-1064,COc1cccc2c1oc(C(Nc(cc1)ccc1-c1cn(CCS3)c3n1)=O)c2,1 F6730-2776,O=C(c1ncnc(C2CCOCC2)c1)Nc(ccc(Cl)c1)c1F,0 Z2296654508,CC(CC(C)(C)O)NC(c(cc1)cc(C#N)c1F)=O,0 Z384739776,CCN(Cc(cccc1)c1NC(c(cc1)cnc1C(O)=O)=O)C(C)=O,0 F5097-2754,CSc(cccc1)c1C(Nc1ccc(CC(N(CC2)CCC2O)=O)cc1)=O,0 Z736937162,Cc1noc(C)c1CC(N(CCC1)c(cc2)c1cc2S(C)(=O)=O)=O,1 Z1343518400,COC(C1)CN1S(c(cc1)cc2c1OCCCO2)(=O)=O,0 F6471-2981,O=S(c1c(C(F)(F)F)cccc1)(N1C2C=CCC1CC2)=O,0 Z1509694001,COc1cc(F)c2c(C(O)=O)n[nH]c2c1,0 Z4158194752,C([C@@H](CCC1)N1c(cc1)nnc1N1CCCC1)Oc1ccccc1,0 Z3686781038,CC(C)(C1)OCCCN1C(c1nc(N(CC2)C[C@@H]2N)c(C)c(C)n1)=O,0 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SB47-0522,Cc1cn(CC(N(C[C@@H]2CN(Cc3ccccc3)C3)C[C@@]23c2nc(C)n[nH]2)=O)nc1,1 Z200824352,CN(Cc1nnnn1-c1ccccc1)C1CCCCCC1,1 S554-0224,CC(C(NCc1nnc(cc2)n1nc2-c(cc1)ccc1Cl)=O)Oc1ccccc1,0 Z1538163666,CN(C)C(c1cccc(CN(CC2)CCN2c(nccc2)c2F)c1)=O,0 Z2965101190,CO[C@@H](CCOC1)[C@H]1NC(c1cnc2n1CCCCC2)=O,1 F6549-2697,CC(C)(Cc1ccc2)Oc1c2OCC(N(C(CC1)C2)C1CC2n1cncc1)=O,1 F6619-5011,Fc(cc1)cc(CN(CC2)CCN2c2nc(N3CCCC3)ncc2)c1F,1 Z1545037156,Cc(c(C(O)=O)cc(Cl)c1)c1S(Nc1cc(F)cc(N2CCOCC2)c1)(=O)=O,0 Z3091829649,CCn1c(C)nc(S(Nc2c(C)n(C)nc2C(OC)=O)(=O)=O)c1,0 Z1556747950,COc(ccn1nc2)cc1c2C(NCc1cn(CC(F)(F)F)nc1)=O,1 F3398-5427,CC(CC1)CCN1c1nc(C)cc(OCC(NCc(cccc2OC)c2OC)=O)n1,1 Z404847098,CCCCNC(C(CC1)CCN1C(c1cccc(F)c1)=O)=O,0 Z1956593164,CC(N1CC(CNC2C3CC(C4)CC2CC4C3)CCC1)=O,1 F2784-1443,O=C(CCCC1)N1c1cccc(NS(c(cccc2)c2F)(=O)=O)c1,1 Z1204852073,NC(Nc1cc(C(Nc2cc(-c3nnc[nH]3)ccc2)=O)ccc1)=O,0 Z2996392846,CCC(CC1)N(C(c2coc(CCCN3)c2C3=O)=O)c2c1cccc2,1 Z3414268912,CCc1ccc(CN(C)C(C(c2c(CC3)n(C)nc2)N3S(C)(=O)=O)=O)cc1,0 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S811-0029,O=C(NC1CCCCC1)N(CC1)CCC1OCc1noc(C2OCCC2)n1,1 Z2066029592,CCc(ccc(C(O)=O)c1)c1NS(c1cocc1)(=O)=O,0 L325-0253,O=C(C(CCC1)CN1c(nc1)ncc1-c(cc1)ccc1F)NCCCN1CCCCC1,1 F6524-1639,CC(N=C(N1)N(CC2)CCC2NC(c2cc(cccc3OC)c3o2)=O)=CC1=O,1 F6571-0724,CN(C)C(CNC(C1COCC1)=O)c1cc(cccc2)c2o1,0 S985-0175,CC(C)N(C[C@H]1CN(C2)C(CCc3c(C)onc3C)=O)C[C@@]12C(N1CCCC1)=O,0 SC72-2275,CCCc1nc(COC2(C3)CN3S(Cc(cc3)ccc3Cl)(=O)=O)c2cn1,0 SB75-1415,Cc1noc([C@]2(C[C@@H](C3)NC(Nc(cccc4)c4F)=O)[C@@H]3CN(Cc3ccccc3)C2)n1,0 F6606-2187,CN(C=NC(N1CCC(CN(C=NC(C2CC2)=C2)C2=O)CC1)=C1)C1=O,1 Z2010226156,Cc(c(C(O)=O)cc(Cl)c1)c1S(N(CCC1)CC1OCCOC)(=O)=O,0 6228-1789,OC(c1ccc(COc2cccc(Cl)c2)o1)=O,0 S951-5627,CN(C)C(C(CN(CC1)c(cc2)cc(C(F)(F)F)c2C#N)N1C(c1cn(C)cn1)=O)=O,0 F6435-9035,CC(C)(C)CC(N(CC1)CC1SCC(OC)=O)=O,0 Z3836003502,Cc(nc(C1CC1)nc1)c1C(Nc(cc1)ccc1-c1nncn1C)=O,1 Z1273118840,O=C(c1cc(-c2noc(C3CC3)n2)ccc1)NC1CC1,1 F6037-0222,O=C(c(s1)ccc1Cl)N(C1)CC1c1nc(cccc2)c2[nH]1,1 SB54-0718,COC[C@@H](CN(C1)C(N2CCOCC2)=O)[C@H]1c1nnc(-c2ccccc2)o1,1 Z2227726992,OCCC1(CC1)NC(c(cc1)cc2c1[nH]nn2)=O,1 F6439-7408,O=C(CSc(cc1)ccc1F)NCCn1c2ccnn2cc1,1 S923-0564,Cc1cc(C)nn1CC(N1CCn2c(C(CCCC3)N3S(C)(=O)=O)nnc2CC1)=O,1 F2639-0210,CC(N1c(cc2)ccc2NS(c2c(C(F)(F)F)cccc2)(=O)=O)=Nc(cccc2)c2C1=O,1 Z2376888561,C[C@@H](CN(C1)C(c2c(cn[nH]3)c3ccc2)=O)[C@H]1C(O)=O,1 F6785-7308,CC(C)(C)c(nc1cc2)cn1nc2OCC(CC1)CCN1S(c1nccn1C)(=O)=O,1 F6204-2763,CN(c(cc(cc1)S(NC2(CCCC2)c2cccs2)(=O)=O)c1O1)C1=O,1 D051-0271,CC(C)Oc(cc1)ccc1C(N(Cc1ccco1)C(CC1)CS1(=O)=O)=O,0 Z2910428512,CN(CCC(O)=O)C(c1ccc(C(F)F)cc1)=O,0 Y041-0424,OC(C(C1)CN1C(c1ccccc1)c1ccccc1)=O,0 F0655-0786,CCN(CC1)CCN1C(C(C)NS(c(cc1)ccc1Cl)(=O)=O)c1cccs1,1 V020-3215,O=C(C1CC1)N(CC1CC1)Cc(n1CC2OCCC2)cnc1S(Cc(cccc1)c1F)(=O)=O,1 SC89-0340,O=C(c1nccc2ccccc12)N(C1)CC1(C(CN1CCOCC1)CC1)S1(=O)=O,1 F6560-8085,Cn1ncc(-c2ncc(CNC(c(cc3)cc4c3[nH]cn4)=O)cc2)c1,1 Z1003192232,CNC(C(CC1)CCN1S(CC1OCCC1)(=O)=O)=O,1 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Z1580691057,CCc1nc(cccc2)c2n1C(CC1)CCN1C(c(cc1)ccc1N1CCOCC1)=O,1 D051-0188,CC(C)c(ccc(C)c1)c1OC(C)C(N(Cc1ccc(C)o1)C(CC1)CS1(=O)=O)=O,0 F6529-0665,CN(c(cccc1)c1N1C(CC2)CCN2S(CCC(F)(F)F)(=O)=O)S1(=O)=O,0 Z4107122641,C[C@H]1O[C@@H](C)c2nn(C)c(C(N(CC3)Cc4c3nc(N)nc4)=O)c2C1,0 F6286-0913,CS(N(CC1)CCC1C(NCCc1nc(C(F)(F)F)c(CCCC2)c2n1)=O)(=O)=O,1 F6184-0077,O=C(c(s1)ccc1Cl)N(CC1)CCC1c1cccs1,1 F5860-2479,O=C(CCc1cccc(Oc(cc2)ccc2F)c1)NCC1OCCC1,1 Z736741220,CC(C)N(Cc1cn(C)nc1)S(c(cc(c(CC1)c2)NC1=O)c2Cl)(=O)=O,1 F6244-2757,O=S(c1cccc(Cl)c1)(NCC#CCN1CCOCC1)=O,1 S722-0876,CCn1ncc(S(N2CCC(Cc3ccc(CN4CCOCC4)cc3)CC2)(=O)=O)c1,1 SB21-1015,CN(C)C(c1cn(C[C@H](C[C@@H](C2)F)N2C(Cc2c[nH]c3c2cccc3)=O)nn1)=O,0 Z3290442931,CC(C)N(CCCO)S(C(CC1)=Cc2c1cccc2)(=O)=O,0 F1967-1334,COc(cccc1)c1-c(cc1)nnc1N1CCNCC1,0 K786-7065,Cc1ccc(CSCC(NC2CCCCCC2)=O)cc1,1 F5882-5283,O=C(c(s1)ccc1Cl)N(CC1)CCN1S(C1CC1)(=O)=O,1 Z3502110111,CC(C)(c1nc(Cn2c(cccc3)c3nc2C)no1)O,0 Z730632028,CC(C1)C1C(Nc1cccc(C(NCc2cc(-n3cncc3)ncc2)=O)c1)=O,1 Z4890705770,COCC(CCC1)N1C(C(CC([O-])=O)CO)=O,0 P072-0855,O=C(CN(c1c(N2c3ccccc3)nccc1)C2=O)N(CC1)CCN1c1ncccc1,1 Z2440790664,CC1(CNC(c2c(C)n(-c3cccc4ncccc34)nn2)=O)CCNCC1,1 G498-0083,Cc(ccc(N(CCC1)S1(=O)=O)c1)c1NS(c(cc1)c(C)cc1F)(=O)=O,0 Z3079995612,O[C@@H](CNc1nc(-c2ncccc2)nc2c1CCC2)c1ccccc1,1 Z747471846,CCNC(c1ccc(CNC(N(CCC2)C2C2CCCC2)=O)cc1)=O,1 F6813-7831,CN(C=CC(CN1CCN(Cc(ccnc2)c2F)CC1)=C1)C1=O,1 Z1451000557,OC[C@H](CC1)CC[C@@H]1NC(c1csc(-c(s2)ccc2Cl)n1)=O,1 Z2606892005,O=C([C@H](C1)NC[C@@H]1F)NCc1noc2c1cccc2,1 8006-9351,O=C(c(cc1)cc(S(N2CCOCC2)(=O)=O)c1Br)Nc(cc1)cc2c1OCCO2,1 F6414-3554,CC(CNC(OC)=O)(c1cc(cccc2)c2s1)O,0 Z2215930801,CC(C)C(C(C)(C)C1)N1C(Nc(cc1)nn1-c1c(C(F)(F)F)cccn1)=O,1 S065-0106,CN(C)c1cc(N(CCC2)CC2NS(C2CC2)(=O)=O)ncn1,0 F5537-0034,Cc(ccc(N(CCC1)S1(=O)=O)c1)c1NC(Nc(cc1)cc(Cl)c1Cl)=O,0 S723-1414,O=C(c1ccc(Cn2ncnc2)o1)N1CCC(Cc2ccc(COCC3CC3)cc2)CC1,1 Z1190005640,CC(Cc1cc(OC)ccc1)NC(N1CCOCCC1)=O,0 J500-0712,CN(C)C(C(C1)C2(CCCC2)CN1C(c1cccs1)=O)=O,0 F3398-1492,CCC(C)NC(c(cc1)cc(N2C(N3CC=C)=NN(CC(NC(C)C)=O)C2=O)c1C3=O)=O,1 Z1839638829,OC(C(C1)CN(CCNS(c(ccc(C(F)(F)F)c2)c2F)(=O)=O)C1=O)=O,0 Z1347870850,CC(c1nc(-c(cc2)cc(CC3)c2N3S(C)(=O)=O)cs1)OC,1 F6752-2977,O=S(C1CC1)(N1CCN(Cc(cc2)ccc2OC(F)(F)F)CCC1)=O,0 Z1273911800,O=C(CCCc1ccccc1)N(CC1)CCN1C(C(CC1)Cc2c1cn[nH]2)=O,1 F6773-4667,Cc1nnc2n1ccnc2N(CC1)CCC1Oc1nc(C)cnc1C,1 Z1309398292,COc1ccc(C2CCN(Cc(cc3)ccc3C(N)=O)CC2)cc1,0 Z929597218,OC(CC(C(CC1)CCN1C(c1ccccc1)=O)c1ccccc1)=O,0 Z2768784625,Cc1ccc(-c2nnc3n2CCCCCC3)o1,1 S928-4618,O=C(CCC1CCCC1)N1CC(Cc2nnc(-c3ccccc3)o2)CC1,1 Z3795113195,NCCC(CC1)CC1NC(c(ccc1ncccc11)c1F)=O,0 Z2873538964,CC1NCCCC1NC(NCC(CO)c(cc1)ccc1Cl)=O,1 Y042-6659,C=1(/C(N[C@H](c2nc3c([nH]2)cccc3)C(C)C)=O)\c2c(C(N/C1)=O)cccc2,0 F6037-0558,Cc(cc1)cc2c1[nH]c(C(C1)CN1C(C(CC1)CCN1S(C)(=O)=O)=O)n2,1 F6442-0298,O=C(CSc1nc(cccc2)c2o1)N(C1)CC1S(c(cc1)ccc1F)(=O)=O,1 Y200-4977,CCc(cc1)ccc1-c1nc2ccc(C)cc2c(C(NCC2OCCC2)=O)c1,0 Z1489848656,Cc1cccc(C(CCC2)N2C(C2Cc3nccn3CC2)=O)c1C,1 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SB42-0148,CCN(Cc1ccccc1)C(CN(C[C@@H](CN1C)N2[C@@H](C)C1=O)C2=O)=O,0 S571-0423,O=C(c1nccnc1)NCC1(CCC(N2CC3CC3)=O)C2=CCC1,1 Z1211872847,Cc1c(C)[nH]nc1C(N(CCC1)CCN1C(c1cccc(Cl)c1)=O)=O,0 F6524-5380,COc1cc([nH]c(C(NCc2nnc(cc3)n2nc3N2CCCC2)=O)c2)c2cc1,1 F5140-0425,CS(N(CCC1)CC1C(N(CC1)CCN1c1ccccc1)=O)(=O)=O,1 Z1161032644,OC(c(cc1)ncc1C(Nc(cc1)cnc1NC(C1CC1)=O)=O)=O,1 Z1747809240,CC(C)(CCNC(c1c[nH]cc1-c1ccc(C)s1)=O)O,0 S858-0555,CC(C)N(C1)C[C@]2(CO)[C@H]1CCN(Cc1c(C)n(C)nc1)C2,0 Z1874696268,O=C(c1c2ncccn2nc1)NCC(CCCC1)N1C1CC1,1 F6672-1867,O=S(c(cccc1)c1F)(N(C(CC1)C2)C1CC2=CC1CC1)=O,1 SD08-0494,CN(C)C(NCc1c(COC(CCC2)(C3)CN2C(c(cc2)cnc2OC)=O)n3nn1)=O,0 Z994975624,OCC(CCC1)N1C(Cc1cnccc1)=O,1 Y206-8565,Cc(sc(NC(C1OCCC1)=O)c1C(N)=O)c1-c(cc1)ccc1F,1 D347-2959,O=C(C1)N(Cc(cc2)ccc2F)CC1c1nc(cccc2)c2n1Cc(cc1)ccc1Br,0 Y200-5959,CC(CC(Nc1c(C(NC2CCCCC2)=O)c(CCCCC2)c2s1)=O)CC(O)=O,0 F6782-6824,CC(N=CN1Cc(c(F)ccc2)c2Cl)=CC1=O,0 Z3016313396,CCc1cc(C(NCCc2nc(CCOC3)c3s2)=O)ncc1,0 Z27867187,COc(cc1)cc(OC)c1C(Nc(cccc1)c1C(NCCc1ccccc1)=O)=O,0 C066-1683,CN(C(C(C(O)=O)c1c2cccc1)c(cccc1)c1OC)C2=O,0 Z3345941356,OC(C(c(ccc(F)c1)c1Cl)N(CC1)CCC1OCc(cc1)ccc1F)=O,1 SB75-0002,Cc1noc([C@@](C[C@@H](C2)NC(c3ccco3)=O)(C3)[C@@H]2CN3C(COC)=O)n1,0 E783-0087,Cn1c(-c(cc(cc2)S(N(CC3)Cc4c3cccc4)(=O)=O)c2OC2=O)c2nc1,1 Z3040118884,Cc1c(C)cc(CS(N(C2)[C@H](COC3)[C@H]3C22CCNCC2)(=O)=O)cc1,0 Z1958931076,CC(CN(C1)c2nn3c(-c(cccc4)c4F)nnc3cc2)OC11COCCC1,1 Z1692573722,O=C(Cc1c2)N(CCC3)c1c3cc2S(Nc1cc(-c2ccccc2)n[nH]1)(=O)=O,0 F6694-7446,Cc1cc(C(N2CCC(COc3c(C(F)(F)F)cccn3)CC2)=O)no1,1 F1829-0128,CC(CC1)Cc2c1c(C(NC)=O)c(NC(C1=COCCO1)=O)s2,1 SB52-0031,Cc1nc(C(C2)N(C)CC2(CC2)CCN2C(c2cocn2)=O)no1,1 Z960207106,CCNc(ncc(C(NC(CC1)CCS1(=O)=O)=O)c1)c1Cl,1 Y031-1614,COCCSc(cccc1)c1C(Nc(cccc1)c1C(N(CC1)CCN1c1ccccc1)=O)=O,1 V008-8439,CC(C)n1c(S(Cc(cc2)ccc2F)(=O)=O)ncc1CN(C1CC1)C(c1cccs1)=O,1 F5860-4395,COc1cc2cccnc2c(NC(Nc2c(C(F)(F)F)cccc2)=O)c1,0 F6400-0450,O=C(CCC(N1C(CN2CCCC2)CSCCC1)=O)c(cc1)ccc1Cl,1 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Z2772042857,Cc1c(CO)cc(C(N(C)C2CN(Cc3ccccc3)CCC2)=O)o1,0 C241-1860,O=C(CN(C(c(scc1)c1N1CC(Nc2c(C(F)(F)F)cccc2)=O)=O)C1=O)NCc(cccc1)c1Cl,1 7591-0332,CC(C)CN(C(C(C(F)(F)F)(NC(c1cnccc1)=O)N1)=O)C1=O,1 Z3102351607,O=C([C@]1(CNC2)[C@@H]2CCOC1)NC(CC1)CCC11CCOCC1,1 F2215-0777,CCC(C(N1)=O)=C(C)N=C1n1nc(C)cc1NC(c1cc(cccc2)c2o1)=O,1 8007-0808,CC(C(C(c(cc1)ccc1Br)N1)=C(C)NC1=S)=O,0 F6448-1270,CC(C)Sc1ccc(CC(Nc2cn(CC3CCOCC3)nc2)=O)cc1,0 Z1625181159,CC(C(C(NC(CCCN1c(cccc2)c2Cl)C1=O)=O)NC(C1CC1)=O)O,1 Z2506376089,CCS(CCc1noc(-c(cccc2N3)c2NC3=O)n1)(=O)=O,0 SB30-0573,Cc1ccc(CN(CC2)CCC2N(C2(CN3CC4CC4)CCOCC2)C3=O)o1,1 Z1545209904,CCC(CO)(CC1)CCN1C(Nc1nc(C2CC2)cs1)=O,1 Z910213698,O=C(NC(CCN1Cc2ccccc2)C1=O)N1CCOCC1,1 Z2112412450,CC(C)(CCC1NC(N(CC2CC(COC3)NC3=O)c3c2cccc3)=O)c2c1cccc2,1 Z3091930608,NC(c1ccc(C(N2C3(COCC3)CCCC2)=O)s1)=O,1 SA73-0410,COCc1nc(C(CC2CC2)(CC2)CCN2C(NC2CCCC2)=O)no1,1 SB71-0360,COCCNC(c1nn(CCN(C2)C(c3cc(-c(cccc4)c4Cl)n[nH]3)=O)c2c1)=O,1 Z2718887937,CC(C)n(c(C)c1)nc1C(Nc1cn(C)nc1-c1ccco1)=O,1 C177-0088,Cc1ccc(-c2c(Nc(cc3)cc4c3OCCO4)n(cccc3)c3n2)o1,0 Z4497727179,CC(C)c1ccnc(N(CC2)CCN2C(C(CC(C2)O)N2C(Cc(cccc2)c2F)=O)=O)n1,1 E958-0412,CN(CCNC(C(CCC1)CN1c1nnc(-n2cccc2)s1)=O)C1CCCCC1,1 Y030-7406,O=C(c1cc(-c2ccccc2)nc2ccccc12)Nc1nnc(C2CCCCC2)s1,1 Z1665311745,OC(c1cccc(C2)c1CCN2C(c(cc1)ccc1F)=O)=O,0 Z2964317278,NC([C@@](CCC1)(C2)[C@@H]1CN2C(Cc1cc2ncccc2cc1)=O)=O,1 Z1424289640,Cc(nc(cc1)OC)c1NC(N1CCN(CC(NC)=O)CC1)=O,0 Z2298780097,Cc1c(CC(N2CCC(Cc3cccc(F)c3F)CC2)=O)c(C)n[nH]1,1 8640-0314,CCCSc1nc(N2CCOCC2)c(c(CC(C)(CC)OC2)c2s2)c2n1,1 Y502-7515,Cc1nn(C)cc1S(N(CC1)CCN1S(c1cccs1)(=O)=O)(=O)=O,0 Z1632747674,O=C(NCC(C1)CN(C2CC2)C1=O)N1CC(Cc2ccccc2)CC1,1 Z55118892,Cn1c(SCC(O)=O)nnc1-c1ccccc1,0 F3394-0064,COc(cccc1)c1NS(c(cc1)ccc1Oc(cccc1)c1OC)(=O)=O,0 Z2938337507,C[C@](CN(C)C1)(C2)[C@H]1CN2c1nnnn1C,1 F6381-4231,CN(C)c1cccc(C(N(CCCC2)CC2c(cc2)ccc2F)=O)c1,0 SA93-0371,NC(C(CC1CC1)(CCC1)CN1S(c1cccs1)(=O)=O)=O,1 S779-0317,Cc1cnc(C2CC2)n1CC(CC1)CN1C(c1cocc1)=O,1 S959-0548,Cc1c(COC)c(C(NCCN(CCC2N3CCCC3)C2=O)=O)no1,1 F6734-1531,Cc1c(CCC(N(C2)CC(C3)C2CN3c(cc2)ncc2F)=O)c(C)n[nH]1,1 Z1675557862,Cn1ncc(CNC(c2c(C3CCCC3)ncs2)=O)c1,1 F6514-9411,CN(C=C(C(NCc1c(-c2cnccc2)nccc1)=O)C(c1cccs1)=C1)C1=O,1 Z1683554637,Cc(cc1)ncc1-c1noc(C(CC2)CCN2C(OCc2ccccc2)=O)n1,1 Z4500949543,CN(C(c(cc1)cc(NC(N2c3ccccc3)=O)c1C2=O)=O)c(cc1)ncc1F,0 G718-0736,O=S(c1cc(CCCC2)c2cc1)(NCCc1n[nH]c(-c(cc2)ccc2Cl)n1)=O,1 F6245-4484,Cc1noc(C)c1CCC(N(CC1)CCC1C(N1C2CC2)=NN(C)C1=O)=O,1 Z2613564502,Cc1nc(N(C2)Cc3c2c(N)nn3C)c(c(CCC2)c2s2)c2n1,1 F6502-0159,O=C(Cc1cccs1)NCCn1c(-c2ncccc2)ncc1,1 F5303-0131,CCCCN(c1ccccc1)S(c1cn(C)nc1C)(=O)=O,0 Z2483050027,CC(C)(COC)N1CCN(Cc(c(C(O)=O)ccc2)c2Cl)CC1,0 Z2968536516,Cc1cccn2c1ncc2CC(NCc(cc1)ccc1C(N1CCOCC1)=O)=O,1 F0183-0003,FC(c1nc(cccc2)c2n1Cc(cc1)ccc1Cl)(F)F,0 F6680-3121,COc1nccc(N(CCN(C2)C(CCc(cccc3)c3F)=O)C2=O)c1,0 SC96-0236,Cc1ccc(CS(N(CC2)CC3(COCC3)N(CC3CC3)C2=O)(=O)=O)cc1,0 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C301-1595,Cc1cc(C)nn1-c1nc2ccccc2nc1N1CCN(Cc2ccccc2)CC1,1 D640-0018,Cc1nc(N2CCCC2)cc(Nc(cc2)ccc2NS(c(cc2)cc(Cl)c2OC)(=O)=O)n1,0 V014-2299,CCN(C(CN1CCC(N(CC2)CCC2C(OCC)=O)=O)=C(C(c(cccc2)c2Cl)N2)C1=O)C2=O,0 Z2433602229,O=C(C(C1)C11CNCC1)N1CCC(Cc2ccccc2)CC1,0 F6792-4359,Cc(nc(C)nc1OCC(CC2)CCN2c2nc(C(F)(F)F)cs2)c1F,0 F6491-0252,N#Cc(cc1)ccc1C(N(CCC1)CC1Oc1nccnc1)=O,0 F6564-7760,CC(C(Nc1nc(CCCC2)c2s1)=O)N1N=C(CCC2)C2=CC1=O,1 Z2001386148,CC(c(cc1)cc(Cl)c1F)OC(c1c2[nH]nnc2ccc1)=O,0 F6211-0018,O=C(c1nn(CCCO2)c2c1)N1c2nc(cccc3)c3n2CC1,1 CM3891-3546,CN1CCN(CC(CC2)(CCC2(CC2)CCN2C(c(ccc(OC)n2)c2OC)=O)O)CC1,1 F6549-6487,Cc(nc1)cnc1C(N1CC(Cn2nncc2)C1)=O,1 P664-1723,CCCc1cc(N(CC2)CCN2C(C(CC)c2ccccc2)=O)nc2nncn12,0 L474-1576,CC(C(Nc1nccs1)=O)NS(c(cc1)cc(CC2)c1N2C(N1CCCC1)=O)(=O)=O,1 Z758204758,O=C(COC1CCCCC1)N1Cc(cccc2)c2OCC1,1 Z4188807694,COCC(c1cc(C(F)(F)F)ccc1)NC(Nc1nnc(C2CCOCC2)s1)=O,0 F6677-1413,CCc1nccn1CC(C1)CN1C(C1OCCCC1)=O,1 F6286-0785,O=C(Cc1cccs1)NCCc1nc(C(F)(F)F)c(CCCC2)c2n1,1 Z1769565780,CCOC(C1)C(C)(C)C1(CO)NC(c(cc(cc1)F)c1Br)=O,0 Z2961832751,CCOc1nc(cc(cc2)C(NC[C@@]3(CCC4)[C@H]4OCC3)=O)c2[nH]1,1 Z2450098351,CC(C)(C)C(c1cn(C)nc1)NC(c1c(C(CN)CCC2)n2nc1)=O,1 F0650-0122,Cc1c(C(N(CC2)CCC2C(OC)=O)=O)sc2nc(-c(cc3)ccc3F)cn12,1 SA46-2122,CCOc(cc1)ccc1S(N(C1)CC1(C1)OCC1N1CCCC1)(=O)=O,1 Z1695839379,Cn1c(C(COCC2)N2C(c2cc(OC3CCCC3)ccc2)=O)ccc1,1 Z4132982258,CCNC(N(CCC1)c(cc2)c1c(Br)c2OC)=O,0 F2471-0513,CC(N(CC(Nc1c(C(F)(F)F)cccc1)=O)C=C1OCc2ccccc2)=CC1=O,1 F640-0063,Cc1nnc(-c2cc(S(N(CC3)CCN3C(c3ccccc3)c3ccccc3)(=O)=O)c[nH]2)o1,0 Z3376050674,CCc1c(C)nc(NC(c2cccn2Cc2ccncc2)=O)s1,0 F5621-0285,CCOC(N(CC1)CCN1C(CN1CCN(Cc2nc(cccc3)c3n2C)CC1)=O)=O,1 5664-0349,CC(C)(C1)OCCC1C(CC(O)=O)c(cccc1)c1OC,0 SB57-1358,CCn1nccc1C(N(C1)CC1(CN(C1)C(COC)=O)C1c1nc(C)no1)=O,0 V015-2351,CCCC(CN(CC(C)C)CC(N1)=Nc(scc2-c3cc(C)c(C)cc3)c2C1=O)O,0 F114-0333,O=C(Nc1cccc(Cl)c1)N(CC1)CCC1n1c2ncccc2nc1C(F)(F)F,0 F6753-2184,CC(c1ccccc1)N(CC1)CCC1C(N(CC1)CCC1(F)F)=O,0 L299-5946,CCCc(c(-c1cc(S(Nc2c(C)ccc(C)c2)(=O)=O)c(C)cc1)c1NC(CC2)=O)nn1C2=O,0 C779-1510,CC(c(cc1)cc2c1OCCO2)NC(C(CC1)CCN1C(c1cc(scc2)c2n1C)=O)=O,0 F6670-4659,O=C(c(ccnc1)c1F)N1CCC(CN(C=Nc2c3cccc2)C3=O)CC1,1 Z3364563401,C(c1cc(C2CCNCC2)no1)N1C(C2)CC2C1,1 G540-0047,Fc(cc1)ccc1-c1csc2ncnc(NCC3OCCC3)c12,1 V016-4326,CC(CC1)Cc2c1c(C(NC(CN(CCCOC)CC(c1ccccc1)O)=N1)=O)c1s2,0 S836-4416,Cc1cccc(OCC(N(C[C@@H]2CO)C[C@@H]2C(NC)=O)=O)c1,0 F5147-0231,COc(cc1)ccc1C(C=C1)=NN(CCCNC(c(c(F)ccc2)c2Cl)=O)C1=O,1 Z2205323046,CC(c1ncc(C)nc1)Nc1c(C)n(-c2c(C)ccc(C)c2)nc1,1 Z728923658,COc(cc(cc1C(O)=O)S(NCC2COCCC2)(=O)=O)c1OC,0 F2434-0685,CC(c(cc1)ccc1NC(c1ncc(-c(cc2)ccc2F)o1)=O)=O,0 F521-0078,O=C(CN(c1c(C(N2Cc3ccccc3)=O)nccc1)C2=O)Nc(cc(C(F)(F)F)cc1)c1Cl,1 Z4387752326,Cc1nc(cccc2)c2n1Cc1noc(-c(cc(cc2N3)Br)c2NC3=O)n1,0 S511-0248,O=C(CC1CC(CC2)(CCN2C(c2c[nH]c3c2cccc3)=O)OCC1)N1CCOCC1,1 F6186-1030,CC(CCSC)(CNC(c1cc(C)cs1)=O)O,0 F6439-7088,Cc(cc1)c(C)cc1N(CC(C1)C(NCCn2c(-c3ncccn3)ncc2)=O)C1=O,1 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Z2359067607,O=S(c(cc1)cc2c1OCCC2)(N1CC(C2CCC2)OCC1)=O,1 F6571-0199,CN(C)C(CNC(c1cocc1)=O)c1csc2c1cccc2,0 L287-1296,O=S(c1cc(-c2noc(C3CCC3)n2)cs1)(N(CC1)CC=C1c1ccccc1)=O,1 Z437848270,CN(C)C(CCNC(C(CC1)CCN1c1ncc(C(F)(F)F)cc1)=O)=O,0 Z4910259690,CC(CN(C)C(c1cc(-n2nnc(-c(cncc3)c3C(O)=O)c2)cnc1)=O)C(C)(C)C,1 F6796-8714,N#Cc(cc1)ncc1N(C1)CC(C2)C1CN2c1c(C(F)(F)F)cccn1,0 V020-3854,CC(CC1)CCN1C(C(C1CCCC1)N(CC1)CCN1C(c1cccs1)=O)=O,1 Z1458713800,NC(CCCCCC1)C1C(Nc1cccc(CS(N)(=O)=O)c1)=O,1 F6510-4314,O=C(CN(c(cccc1)c1N1C2CC2)S1(=O)=O)N1CCOCC1,1 Z651768866,CC(C(N(C)C)=O)NC(CSc1nnc(-c2ccncc2)n1-c1c(C)cccc1)=O,0 SD12-0355,O=C1NCCN(Cc2ccc(C(F)(F)F)cc2)C1Cc1nc(-c2ccncc2)no1,0 SD01-0242,O=C(c1cscn1)N(CC1)Cc2c1n(CC1CC1)nc2-c1cocn1,1 Z827870198,O=C(C1CC1)N(CC1)CCC1NC(NCC1(CCCCC1)c1cccc(F)c1)=O,1 C597-0345,CN(c(ccc(S(NC(C(NCCC1=CCCCC1)=O)c1ccccc1)(=O)=O)c1)c1C(N1C)=O)C1=O,1 Z278638782,O=C(c1cccnc1Sc1ccccc1)Nc1ccc(CN2CCOCC2)cc1,1 Z2448486574,CC(C1)c(cccc2)c2N1C([C@H]1N[C@H](C2)[C@H]2C1)=O,0 S997-1872,CCc(cc1)ccc1S(N1C[C@@H](CN(Cc2ccccc2)C2)[C@]2(CO)CC1)(=O)=O,0 Z1764415281,O=C(c1cn(-c2cccc(Cl)c2)nn1)NC1CCN(Cc2ccncc2)CC1,0 Z1229968133,Cc1n[nH]c(C(NCc(cc2)cnc2O)=O)c1,0 T151-0819,Cc1cnc(CCNC(C2CC=CC2)=O)n1C1CCCCCC1,1 Z2527321526,OC1(Cc2cn(C3CCOCC3)nn2)CCCCC1,1 SD60-0244,Cc1nn(C)c(C(N(C2)CC22OCC(CCOCc3cccc(F)c3)C2)=O)c1,1 F0686-0325,COc1ccc(CC(NCCc2csc(-c3ccc(C(F)(F)F)cc3)n2)=O)cc1,0 F5860-2180,Cc(c(S(N1CCN(CC(F)(F)F)CC1)(=O)=O)ccc1)c1Cl,0 F6199-0442,O=S(c1ccccc1)(N1CCN(CCn2cncc2)CC1)=O,0 SA49-0291,O=C(CC1COC(C2)(CN2C(COCc2ccccc2)=O)C1)NCc1ccncc1,1 F6441-2812,O=C(C1CC=CCC1)N(CC1)CCC1S(c(cc1)ccc1F)(=O)=O,1 G366-0595,CCC(N(C(C1)C(NCCN(CCc2ccccc2)Cc2ccco2)=O)c2c1cccc2)=O,1 Z3992203373,Cn1nc(-c(cc2)ccc2NC(c2c(-c3ccco3)[nH]nc2)=O)nc1,1 Z2016036550,COCCN(CN(C1)C(c(cco2)c2Cl)=O)C1=O,0 E947-0470,CC(C)CN(C=Nc1c2c(C(NCC3OCCC3)=O)c(C)o1)C2=O,1 Z1444546106,Cc1c(C)oc(CN2CCC(CNC(N3CCN(Cc4cccc(F)c4)CC3)=O)CC2)n1,1 SC09-0538,C[C@@H](COc(cc1)c(C2)cc1-c1cnccc1)N2C(c1cscn1)=O,1 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F6550-7730,O=C(CCCC(N(C1)CC1N(C(C1C2C1)=O)C2=O)=O)c1ccccc1,1 Z2900718963,C=CCC(C1)(CN1C(c1cc2cccc([N+]([O-])=O)c2[nH]1)=O)O,0 G756-1569,CC(C=CC1=NC(COc(cc2)ccc2NC(CN(C(c2c3cccc2)=O)C3=O)=O)=C2)=CN1C2=O,1 SB24-0460,Cc1c(CN(CC2)CCC2(CC2)C2n2nnc(C(N3CCOCC3)=O)c2)scn1,1 Z26576203,Cc1cc(C(N(C)Cc(cccc2)c2F)=O)no1,0 F6471-2872,COc1ccc(CNC(N2C3C=CCC2CC3)=O)cc1,1 SB54-1072,COC[C@@H](CN(C1)S(Cc(cc2)ccc2Cl)(=O)=O)[C@H]1c1nnc(-c2ccccc2)o1,0 Z2479077598,Cc1c(C)sc(S(NC([C@@H](C2)[C@H]2C2CCC2)=O)(=O)=O)c1,0 F6617-6376,CCc1nccn1Cc1nc(-c2ccc(C(F)(F)F)cc2)no1,0 Z2763292261,CN(Cc1cc(OC)ccc1)C(c1nc(N2CCCC2)cnc1)=O,0 F6523-3929,CC(C)S(c1ccc(CC(N(CC2)CC3=C2N=C(C=CC(F)=C2)N2C3=O)=O)cc1)(=O)=O,0 Z1219999529,CC(C)(c1cccs1)NC(c1cnc(-c(cc2)cc3c2OCO3)s1)=O,1 F2276-0019,CN(CCOc(cc1)c2cc1NC(C1OCCC1)=O)C2=O,1 F6494-1022,CCOc1cc(C(NCc2cc(N3CCCC3)ncc2)=O)ncn1,1 F6211-0114,O=C(c1nn(CCCO2)c2c1)NCCC1=CCCCC1,1 F3316-0114,CN(C)C(Oc1cccc(NS(N2CCOCC2)(=O)=O)c1)=O,0 Z3048146210,CS(c1cccc2c1CCCN2C(c(ncc(Cl)c1)c1Cl)=O)(=O)=O,0 Z4453183678,Cc(cc1)cc(CN(CCC2)CCN2C(c(ccc(OC)c2)c2OC)=O)c1OC,0 Z734612826,Cn(c(C(NC1(CC(C2)C3)CC3CC2C1)=O)c1)c2c1cccc2,1 Z1578346172,COCCn(cc1)c2c1ccc(NC(NC(CCC1)CN1c1ccccc1)=O)c2,1 Z2984466528,Cc1cc(C)nc(C)c1Cn1nnc(CNC(c2ccccc2)=O)c1,1 S428-1277,O=C(CNc1nn2c(-c3cnccc3)nnc2cc1)N(CC1)CC1c1nc(C2CCOCC2)no1,1 Z2897035490,CC[C@H](C(O)=O)NC(c1conc1C1CCCC1)=O,1 F5528-1260,COC(c(cc1)ccc1NC(C(CC1)CCN1c(cc1)nnc1-c1ccco1)=O)=O,0 Z813084278,CCN(CC1OCCC1)C(Nc1ccncc1)=O,0 F6454-2302,CC(C)(C(NCC(CC1)CCN1c1cc(C)ncc1)=O)OC(C)=O,0 F6089-6680,COC(c(cc1)ccc1C(NCC1(CCOCC1)c(cc1)ccc1F)=O)=O,0 Z1991328298,CSc1cc(NC(Nc2cncc(F)c2)=O)ccc1,0 Z1148169790,COC(CCNC(c(cc1)ccc1-c1noc(C(F)(F)F)n1)=O)=O,0 Z1785870502,COCCn(cc1)nc1C(Nc(cc1)ccc1C(NC1CC1)=O)=O,1 Z2482901596,Cc1cc(CN(C)C(C(O)=O)c(cc2)ccc2F)no1,0 SC02-0120,COCCC(CC1)(CN1C(Nc(cc1)cc2c1OCCO2)=O)NC(c(cc1)ccc1F)=O,1 Z752489652,CC(C)(CNC(Nc1cn(CC2OCCC2)nc1)=O)c1ccccc1,0 V004-5575,OC(C(C1)C(CCCC2)N2c2c1cc(C(F)(F)F)cc2)=O,1 Z2976354090,Cc1nc(n(C)nc2)c2c(NCc2cccc(Cl)c2OC)n1,0 SA99-0253,NC(C(CC1CC1)(CC1)CCN1C(c1c[nH]nc1)=O)=O,1 Z2755459570,OC(Cc(cc1)ccc1C(NC(C1CCCCC1)C(F)(F)F)=O)=O,0 Z2755432500,Cn(c(C1CC1)c1)nc1C(N(CC1)CCC1n1ncc(C(O)=O)c1)=O,1 Z4900320605,O=C(C(Cc1c(C2)cccc1)N2S(c1c(CCN2)c2ccc1)(=O)=O)N1CCCC1,1 S740-0173,O=C(Cc1cccs1)N[C@@H](C1)CN(CCS(N2C3CC3)(=O)=O)[C@@H]1C2=O,1 F6555-0290,CN(C=C(C(N(C1)CC1n1nnc(C2CC2)c1)=O)C(OC)=C1)C1=O,1 G404-2115,CC(C)n1cnc(S(N(CC2)CCC2C(N(CC2)CCN2C(c2ccco2)=O)=O)(=O)=O)c1,1 E596-0659,CCC(C)N(c1nnc(CCCC(N(CC2)CCN2c2ccccc2)=O)n1-c1c2scc1)C2=O,0 Z4601667795,NCc(c(cccc1)c1s1)c1Br,0 F6573-5361,O=C(c(o1)ccc1Br)NCc1cnc(C2CC2)cc1,1 Z2207550876,COC(C1(CN(CC(Cc2ccc(C(F)(F)F)cc2)O)CC1)c1ccccc1)=O,0 C764-0262,Cc(cc1)cc(C)c1NC(CSC(N(c1cc(C)cc(C)c1)C1=O)=Nc2c1oc1c2cccc1)=O,0 S248-3163,CC(C)NC(N1CC(Cc2noc(-c(cc3)ccc3OC)n2)CC1)=O,0 F6723-7404,O=C1N(CC(CC2C3)CN3c3nc(cccc4)c4o3)C2=CC=C1,1 D724-0922,CCCc1nc2c3c(C)cc(C)nc3nn2c(N(CC2)CCN2c2nc(C)cc(C)n2)c1,1 SB17-0169,O=C(Cc(cc1)ccc1Cl)N(CC[C@H]1NC(CC2)=O)C[C@]12C(N1CCCC1)=O,1 Z3305597661,CC(C1(CCNCC1)O)NC(c1cc(cccc2)c2o1)=O,0 Z1719574715,O=C(NC(C1CCCC1)c(cccc1)c1F)N1Cc2ncnn2CC1,1 Z2440083892,CN(c(nc(cc1)C(NC(CC2)CCC2N)=O)c1C(N1C)=O)C1=O,1 F6524-6642,CCOc(cc1)ncc1-c1noc(CNC(C2Oc(cccc3)c3OC2)=O)n1,1 F5042-0053,O=S(c1c(C(F)(F)F)cccc1)(N(CC1)CCN1c(cc1)nnc1-c1ccco1)=O,0 C782-1209,Cc(cc1C)cc2c1nc(N(CC1)CCC1C(NC1CC1)=O)s2,0 F6469-1103,Cc1nc(-c(cccc2)c2NC(C(CCC2)CN2C(C=C2)=NN(C)C2=O)=O)cs1,1 F6752-7908,O=C(C(C1)CN1c1cc(C(F)(F)F)ncn1)N1CCOCC1,0 Z3190670653,CC(C)C(CN(C)CC1)N1C(Cc1nnc(C2CCOCC2)[nH]1)=O,1 Z2298416751,OC1CCN(CCNC(c(c(C(c2ccccc2)=O)c2)cc(F)c2F)=O)CC1,1 Z2488914412,Cc(cc1)cc(Sc2ccccc2)c1C(NCCC1CCNCC1)=O,1 F6451-0478,COC(CNC(Nc1cccs1)=O)c(cccc1)c1OC,0 E515-2731,O=C(C(CCC1)CN1S(N1CCCCC1)(=O)=O)NCCCN(CC1)CCN1C1CCCCC1,1 P939-3469,COCCc1nncn1C(CC1)CCN1S(c1ccc(C(F)(F)F)cc1)(=O)=O,0 Z1686623996,CCc(cc1)ccc1C(NC(C1)Cc2c1cccc2)=O,0 Z1611059673,CC(C)c1nnc(NCc2ccnn2C)o1,0 F6517-3838,CC(C)(C(NCC(c(cc1)ccc1-c1ccco1)O)=O)OC(C)=O,0 F6445-1502,O=C(c(cc1)ccc1-c1cccs1)NC(CC1)CN1c1nccs1,1 Z2455052326,CC(CCn1nc2)Cc1c2C(Nc1c(C)[nH]nc1C)=O,1 G885-0063,O=S(c1ccc(C2CCCCC2)cc1)(N(CC1)CCC1c1ccncc1)=O,1 Z3268508675,CC(C)OCC(N(C[C@@H]1C(F)(F)F)C[C@@H]1S(N(C)C)(=O)=O)=O,0 F6478-3622,CCc(ncnc1OC(CC2)CN2C(CSCc2ccccc2)=O)c1F,1 Z220728916,CN(CC1)CCN1C(CN(CCC1)C1=O)=O,1 F5527-0552,O=C(C(CCC1)CN1c(cc1)nnc1-c(cc1)ccc1F)NCc1ncccc1,1 F6727-2186,CN(C(C1)CN1c1nn2c(-c3cnccc3)nnc2cc1)c(nc1)ncc1Br,1 Z2230215524,C[C@@H](C(NC)=O)NC(c(cc1)cc(NC(CN2)=O)c1C2=O)=O,1 S593-0239,Cc1cc(S(N(CCC2)C2c2noc(COCc3ccccc3)n2)(=O)=O)c(C)cc1,0 F6521-7876,COC(CNC(c1cc(cccc2OC)c2o1)=O)c(s1)ccc1Cl,1 F6516-4201,Cn1nccc1-c1ccc(CNC(c2cc(cccc3)c3o2)=O)o1,1 F6359-5082,O=C(NCc1cccs1)N(CC1)CCC1Oc(nccc1)c1Br,0 F6454-2720,O=C(c1cc(C(F)(F)F)ccc1)NCC(CC1)CCN1C1CCSCC1,0 SC85-0491,CN(CC1)C[C@@]1(CN(C1)C(c2ncncc2)=O)[C@@H]1c1nc(-c(cc2)ccc2F)no1,1 L309-1206,CN(Cc1ccccc1)S(c(cc1)cc(N2Cc3noc(C4CCC4)n3)c1OCC2=O)(=O)=O,0 SA99-0303,CN(C(C1)=O)c(cc2)c1cc2S(N(CC1)CCC1(CC1CC1)C(N)=O)(=O)=O,1 F6284-0348,O=C(NCCc1cncnc1)Nc(c(F)ccc1)c1F,0 Z1453853987,CC(C(N1C(CCC2CCCC2)CCC1)=O)NC(c(cccc1)c1Cl)=O,1 S836-0340,COC[C@@H](CN(C1)c2ncccn2)[C@H]1C(NCc1ccco1)=O,0 Z746963110,O=C(c1cscc1)N(CC1)CCN1C(NCc1cccc(Cl)c1)=O,1 Z2625633534,Nc(n(-c1ccccc1)nc1)c1C(NCC(NC1CCCC1)=O)=O,1 Z2331762072,CN(CCC(C1)NC([C@@H](C2)[C@H]2c2ccccc2)=O)C1=O,1 F0866-0221,CCOC(c1c(NC(C2CC2)=O)sc(C)c1C)=O,1 F6524-4011,Cc1noc(C(CN(C2)S(c(cccc3)c3F)(=O)=O)C2c2ccccc2)n1,1 S582-0073,CN(C(CNC(NC1CCCC1)=O)Cn1c2ccc1)C2=O,1 G221-0053,Fc1ccc(C(c2nnc(-c3ccccc3)o2)NC2CCN(Cc3ccccc3)CC2)cc1,0 Z4111508832,CCN(CCC1)C[C@@H]1NC(Nc1cc(-c2noc(C3CC3)n2)ccc1)=O,1 F6442-7836,OC(CC1)CN1C(CC1)CCN1S(c(cc1)ccc1Oc(cccc1)c1Cl)(=O)=O,1 Z2198086734,CC(C)(C)n1nc(C(NC(C)(C)C(C)(C)CO)=O)nc1,0 F6574-1601,CSc(cccc1)c1C(NCc1nccnc1-c1cccs1)=O,0 SB59-0597,Cc1ccc(CN(C2)CC2(CN(Cc2ccccc2)C2)C2c2nncn2C)o1,1 8207-0874,COc1ccc(C2NCCc3c2[nH]c(cc2)c3cc2OC)cc1,0 S826-6014,COC[C@@H](CN(C1)C(COc2ccccc2)=O)[C@H]1c1nc(C2CC2)no1,1 Y042-3658,O=C(C(CC1=O)CN1c(cc1)ccc1Br)N1CCN(CCc2ccncc2)CC1,1 F6525-5783,O=C(NCCn1ncc(-c2ccncc2)c1)Nc(c(F)ccc1)c1F,1 Y202-7484,Cc1c(-c(cc2)ccc2Cl)nc(NC(C(CCCC2)C2C(O)=O)=O)s1,0 F2024-2344,O=C(NCCC1=CCCCC1)NC(CC1=O)CN1c(cc1)cc2c1OCCO2,1 Z1217334975,COc1cc(C(N(CC2)CC2c2ccccc2)=O)ncc1,0 F0679-0618,CC(C)(C)n1ncc2c1N=CN(CC(Nc(ccc(OC)c1)c1OC)=O)C2=O,1 F6562-8724,O=C(C1CC=CCC1)NCc1nccnc1-c1cscc1,1 F3098-1788,CCc(cccc1)c1OCC(Nc(ccc(OC)c1)c1OC)=O,0 Z2874304309,CC(CC1)(CCN1C(NCC(C1)NCc2c1cccc2)=O)O,0 F3257-0394,Cc1cccc(OCCn2c(cccc3)c3nc2C2OCCC2)c1,0 Z1322795644,CC(C)S(Cc(cc1)ccc1Br)(=O)=O,0 F6670-5516,Cn1nc(C(F)F)c(C(N2CCC(CN(C=Nc3c4ccc(OC)c3)C4=O)CC2)=O)c1,1 F6215-0047,Cc1noc(CCNC(c(cc2)ccc2C(OC)=O)=O)c1,0 F6441-3466,CC(C)CS(C(CC1)CCN1C(Cc(cc1)ccc1Br)=O)(=O)=O,0 S223-2312,O=C(NCC(CN(C1)C(Nc2ccccc2)=O)C11CCOCC1)N1CCCC1,1 7591-0341,O=C(CCc1ccccc1)NC(C(F)(F)F)(C(N1Cc2ccco2)=O)NC1=O,1 C677-0190,Cn1c(Cc(n2-c(cc3)ccc3OC)nnc2SCC(Nc(cc2)cc3c2OCCO3)=O)ccc1,0 F1873-0733,CCCCC(C(O)=O)Sc1nc(C2CCCCC2)nc(N(C)C(N2C)=O)c1C2=O,1 V028-1628,CCC(CC)C(Nc(cc1)cc(S(N2CCN(C)CC2)(=O)=O)c1Oc1c(C)c(C(O)=O)nn1CC)=O,1 M090-0115,Cc1c(-c2noc(C(F)(F)F)c2)c(S(N(CC2)CC=C2c2ccccc2)(=O)=O)c(C)s1,1 F6656-2949,CC(C)(C)c(cc1)nnc1OCC(CC1)CCN1C(c1cc2nn(C)c(OC)c2cc1)=O,1 C700-1178,CC(CC(C)C1)CN1S(c(cc1)cc(N2CC(NCCC3=CCCCC3)=O)c1OCC2=O)(=O)=O,1 F5033-0309,CC(C)(C)C(NCC(CC1)CCN1C1CCCC1)=O,0 Y021-1093,CC1c2cc(-c3ccnc(N4CCCCC4)n3)c(C)cc2NC(C)(C)C1,1 F6438-1545,O=C(c1ncccc1)N(CC1)CCN1c1cnnc(N2CCCC2)c1,1 Z2982755599,OC1CCN(Cc2cn([C@@H](CCC3)c4c3ccc(Cl)c4)nn2)CC1,1 F0590-0237,O=C(CS(c1cn(Cc2cc(F)ccc2)c2c1cccc2)(=O)=O)NC1CCCCC1,1 F6677-1382,CCc1nccn1CC(C1)CN1C(CN(C=NC(C)=C1)C1=O)=O,1 SA93-0082,CC(CCC1)(CN1C(c1nc(C)ccc1)=O)C(N)=O,0 F6261-3878,Cc1cc(C(NCc2c(C)nc(-c(cccc3)c3Cl)s2)=O)c(C)o1,1 Z1528737318,Cc(n(C(CC1)CS1(=O)=O)nc1C)c1NC(c1cc2cc(F)ccc2nc1)=O,1 F6374-1404,Cn1c(SCC(CC2)CCN2C(c(cccc2)c2SC)=O)ncc1,0 3949-2503,O=C1NC(c(cc2)ccc2OCc(cccc2)c2F)=Nc2c1c(CCCC1)c1s2,1 K977-0337,O=C(c(cc1)cc(N2)c1NC(CS(Cc1cccc(Cl)c1)(=O)=O)C2=O)N(CC1)CCN1c1ncccc1,0 Z1814538278,CC(CNC)C(N(CCC1C)CC1OC)=O,0 S639-1348,CN(C)C[C@@H](CN(Cc1ncccc1)C1)[C@H]1NC(c1ccnn1C)=O,1 F6680-2775,Cc1nnc(N(CCN2c3cc(C(F)(F)F)ncc3)CC2=O)s1,1 F6559-0516,Oc1nc2ccccc2c(C(N(CCC2)CC2N(C=Nc2c3cccc2)C3=O)=O)c1,1 F6808-5949,COc1cc2c(N(CC3)CCC3(c3ccccc3)C#N)ncnc2cc1OC,0 Z1158340812,O=C(c1c(-n2nccc2)nccc1)NCC(CC1)CN1C1CC1,1 8016-8243,O=C(c1c(C2=O)nccn1)N2c(cc1)ccc1S(N1CCOCC1)(=O)=O,1 Z2648267971,NC(CC1(CNC(Cc2cc([nH]nc3)c3cc2)=O)CCCCC1)=O,1 SD60-0187,COc1cc(C(N(C2)CC22OCC(CCOCc3cccc(F)c3)C2)=O)cc(OC)c1,0 Z2346934870,COCC(CC1)CCC1NC(NCc1cc(OCC(F)(F)F)ncc1)=O,0 Z2482916919,CN(Cc1nc(C(O)=O)co1)Cc1cccc(C(F)(F)F)c1,0 F6523-1069,O=C(COc(cccc1)c1F)N(CC1)CCN1c1nccn2nc(CCCC3)c3c12,1 S928-4266,O=C(c1ccco1)N1CC(Cc2nnc(-c3ccccc3)o2)CC1,1 Z2605389224,CCc1nocc1CN(CC1)CC11CNCCC1,1 Z1273265998,NC(Cn1nnc(C(N2C(Cc3ccccc3)CCC2)=O)c1)=O,0 SD12-0345,O=C1NCCN(Cc2cocc2)C1Cc1nc(-c2ccncc2)no1,1 S994-0136,CCN(CCN(CC1)C2CCN1S(c1cccs1)(=O)=O)C2=O,1 F6550-4558,Cc1noc(C)c1CC(N(C1)CC1Nc1ncccn1)=O,1 F6480-0731,O=C(COc1cc2ccccc2cc1)N(CCC1)CC1Oc1ccncc1,1 Z2971828381,CS(C1CN(Cc2cc(Oc3ncccc3)ccc2)CCC1)(=O)=O,1 C190-0430,O=C(CCCN(C(c(cc(cc1)Br)c1N1)=O)C1=O)N(CC1)CCN1c(cc1)ccc1Cl,0 SA49-0342,O=C(Cc1ccncc1)N(C1)CC11OCC(CC(N2CCCC2)=O)C1,1 Z1574572280,CC(C(C)(C)NC(c1c(C)oc(C)c1)=O)O,0 F6521-7966,Cc1c(C(NCC(c(s2)ccc2Cl)OC)=O)c(C)nn1C,0 S064-0429,CCCOc1nccnc1N(CC1)CC1NC(c1ccco1)=O,0 Z1542325297,COc(cc1)nnc1C(N1CCC2(CN(Cc3ccccc3)CC2)CC1)=O,1 Z2732832538,Cc1ccc(-c2nnc3n2CCCC3)o1,1 V015-7876,CCN(CC1)CCN1c1c(CN(CCOC)S(c(cc2)ccc2F)(=O)=O)c(C)nn1-c1cc(F)ccc1,1 Z1971443589,CC(C)c1nn(C)cc1NC(NC1(CO)COCC1)=O,0 F2392-1649,O=C(NCC(c1cscc1)N1CCCC1)Nc(cc1)ccc1F,1 Z2568464663,Cc1cc(S(NC[C@H](C(O)=O)O)(=O)=O)c(C)s1,0 Y043-2165,O=C(CN1N=C(CCCCC2)C2=CC1=O)Nc1cccc(N(CCCC2)S2(=O)=O)c1,1 F6726-4471,CN(C)S(N(CC1)CCN1c1ncnc(-c2ccccc2)c1F)(=O)=O,0 F6284-0512,O=C(C(Oc1c2cccc1)=CC2=O)NCCc1cnc(-c2ccccc2)nc1,1 P765-0249,Cc1ccc(Cc2nc(-c3nn(CCN4CCOCC4)c4c3cccc4)no2)cc1,1 8013-1621,O=C(C1C2CCCC1)N(CCCn1cncc1)C2=O,1 F3316-0355,O=C(NCc(cc1)cc2c1OCO2)N(c1ccccc1)c1ccccc1,1 Z2291593755,CC(COC)(CC1)CN1C(Nc(cc1)ccc1Oc1cccc(F)c1)=O,1 SC19-0334,CCn1nc(CN(CCC2)CCN2S(c2cc(F)cc(F)c2)(=O)=O)c2c1CCOC2,1 Y200-0425,O=C(c1c(cc(cc2)Cl)c2nc(-c2cnccc2)c1)Nc1nc(CCCC2)c2s1,1 SC72-1078,O=C(Nc(cccc1)c1Br)N(C1)CC11OCc2c1cnc(C1CC1)n2,0 F667-0532,CC(N(c1ccccc1)C(N(C)C1=O)=O)=C1N(CC1)CCN1C(C1=Cc(cccc2)c2OC1=O)=O,1 S968-0288,CC(C)C(NC(C1)C1(CC1)CCN1C(c1ccc(Cc2c(C)onc2C)o1)=O)=O,0 F6349-0466,O=C(c1c(cccc2)n2nc1)N(CC1)CCN1C(c(c(F)ccc1)c1F)=O,0 S232-1819,O=S(c1cc(CCC2)c2cc1)(N1C[C@@H]2N(Cc3ccccc3)CCOC[C@@H]2CC1)=O,1 F5832-0167,CN(C)c1cccc(C(NCC2(CCCC2)c(cc2)ccc2OC)=O)c1,0 SB23-0966,Cc1n[nH]c([C@@](CN(C2)C(C3CC3)=O)(CC3)[C@@H]2CN3S(c2cn(C)cn2)(=O)=O)n1,1 Z4035451307,N#Cc(cccc1)c1N(CC1)CCN1C(NCC1C2C1CCOC2)=O,1 F6822-4714,CN(Cc1nc(cccc2)c2[nH]1)Cc(ccc(Cl)c1)c1Cl,0 E525-0682,CC(Cn1c2nc3c1cccc3)(C(NC1CCCC1)=O)N(CCc1ccccc1)C2=O,1 G511-0371,CCC(Nc1cc(N(CCC2)C(C(C)C)=O)c2cc1)=O,0 Z4414545061,CN[C@H](CC1)CC[C@H]1n1nnc(-c2cc([nH]nc3)c3cc2)c1,1 Z3136993367,Cc(nc1)nc(C2CC2)c1C(N[C@H](Cc1c2cccc1)[C@@H]2N)=O,1 F3406-4465,CCN(CC)S(c1cc2ncc(N3CCN(Cc(cc4)cc5c4OCO5)CC3)nc2cc1)(=O)=O,0 Z2959259315,O=C(c1c(c(Br)ccc2)n2nc1)N[C@@H]1[C@@H]2[C@H]1COC2,1 F6681-3566,C(C(C1)CN1c1nc(C2CC2)ncc1)Oc1cnccc1,1 F3366-5564,Cc(cccc1)c1N(CC(C1)c2nc(cccc3)c3n2CC(COc(cccc2)c2Cl)O)C1=O,0 Z1379380882,Cc1n[nH]cc1CNCCNc1ncc(C(F)(F)F)cc1,1 F5831-2055,CC(Cc1ccco1)NS(c1cccc(Cl)c1C)(=O)=O,0 F1888-0097,Fc1cccc(Oc2c(cnn3-c4cccc(Cl)c4)c3ncn2)c1,0 F6415-0108,COCCN(Cc1cocc1)C(c(cc1)ccc1C(OC)=O)=O,0 F6676-1053,Cc1nccc(OCC(CC2)CCN2C(C(CC2)CCN2S(C)(=O)=O)=O)c1,1 F6472-0800,O=C(c1cc(-c2ccco2)n[nH]1)NCCSC1CCOCC1,1 Z1127275328,Cc(ccc(F)c1)c1C(NCc1c(-n2c(cccc3)c3nc2)nccc1)=O,0 SB73-0867,CS(N(CC1)C[C@]1(C[C@@H](C(NCCCN(CC1)Cc2c1cccc2)=O)N1)C1=O)(=O)=O,0 S427-0833,Cn1cnc(S(N2CC(Cc3noc(-c4nccnc4)n3)CCC2)(=O)=O)c1,1 Z373358318,CNC(CN(CC1)CCC1Nc1nccnc1)=O,0 Z3409369439,COCc1cccc(NS(c(c2c3)c[nH]c2ncc3Cl)(=O)=O)c1,0 F1787-0952,Cc1c(C(Nc(cc(c(OC)c2)OC)c2C(OC)=O)=O)oc2c1cccc2,0 Y044-4716,O=C(Cc(cc1)ccc1Cl)Nc(cc1)cc2c1nc(C1OCCC1)[nH]2,1 8017-1640,Cn1c(SCCn2c(S(Cc3ccccc3)(=O)=O)nc3c2cccc3)nc(N(C)C(N2C)=O)c1C2=O,1 Z2296074445,CC(CC(N(C[C@H]1C(O)=O)C[C@@H]1c1ccccc1)=O)c1c(C)onc1C,0 E456-0592,CC(CC1)CCC1NC(C(C(c1cccs1)N1CCOC)c(cccc2)c2C1=O)=O,0 L575-0159,Cn1nc(C(N2CCCC2)=O)c(C2)c1CCN2C(CCC(NCCCN1CCOCC1)=O)=O,1 V025-3824,CCN(CC1)CCN1c1c(CN(CCOC)Cc2cc(OC)ccc2)c(C)nn1-c(cc1)ccc1F,0 Z383969250,CN(C(CC1)=O)N=C1C(Nc1cccc(OCC(F)(F)F)c1)=O,0 Z2795245776,OC([C@@H]1CN(Cc2cc(cccc3)c3o2)CCC1)=O,1 SC96-1363,O=C(Cc(cc1)ccc1F)N(CC1)CC2(COCC2)N(CC2CC2)C1=O,0 Z2979677117,CC([C@H]1OCC[C@H]1C(Nc1nc(-c(cccc2)c2F)co1)=O)=C,1 F6548-1977,O=C1N(C=C(C=C2)Cl)C2=NC(CN(c2ncccc2C(N2CCc3ccccc3)=O)C2=O)=C1,0 Z2950567659,Cc1nccc(NC(NCC[C@H](CCCC2)[C@H]2O)=O)n1,1 V009-1770,COc1cccc(C(C(C(NCCCc2ccccc2)=O)c2c3cccc2)N(C2CC2)C3=O)c1,1 F5860-4141,COC(C(CC(C1)C2)(CC1C1)CC12NC(C(CC1)CCN1S(C)(=O)=O)=O)=O,1 F6190-0139,COc(ccc(Cl)c1)c1C(NCCC(C1CC1)O)=O,0 F3296-0828,O=C(CCc1ccc(-c(cc2)ccc2F)o1)NC1CCCC1,1 S976-1432,Cc1noc(C)c1CN(CCC1)CC1(C(N1CCCC1)=O)F,1 Z3043654951,CN(C)C(C(C[C@@H]1OCC[C@H]11)N1C(Cc1ccncc1)=O)=O,1 Y041-5059,COc(cc1)ccc1S(N(CC1)C(CC(O)=O)c(cc2OC)c1cc2OC)(=O)=O,0 F6472-7255,Cc1nn2c(CCN(C3)C(c4c(C)nc(C)s4)=O)c3cnc2c1,1 Z2936867224,Cc1cc(C(N[C@H](C2)[C@@H](C3)[C@H]2CC3C(O)=O)=O)nc(C)c1,0 Z1269232045,Cc1nc2cc(Br)cnc2s1,0 F6597-2514,Cn(cc1C(N2CCC(COc3cccc(C(F)(F)F)n3)CC2)=O)nc1OC,0 Z3669273747,CC(C1)CN1C(c(cc1)cc2c1[nH]nc2C(OC)=O)=O,0 Z2274464035,Cc1nc2ccccc2c(NCCCC2COCC2)c1,1 S049-0160,Cc1cccc(CN(CC2)CC2Oc(cc2)ccc2-c2noc(C3CC3)n2)c1,0 Z2276798806,CCOC(c1noc(C(N(C2)C(C)CC2c2ccc(C)cc2)=O)c1)=O,1 Z1744278853,Cn1c(ccc(Cl)c2)c2nc1CNC(Cc1noc2c1cccc2)=O,0 Z2026764124,Cc(cccc1)c1C(Nc1ncc(OC)s1)=O,0 F6753-2114,COc(cc1c(N(CC2)CCC2C(N(CC2)CCC2(F)F)=O)ncnc1c1)c1OC,1 F6125-0257,CCOC(N(CC1)CCN1C(C(C1)CN1C(c1cccs1)=O)=O)=O,0 Z1517845003,CC(C)n1ncc(S(NC2(C)COCC2)(=O)=O)c1,0 Z1678309857,COC(CNC(N1CC2(CCC2)COCC1)=O)c1cccc(Cl)c1,0 F6014-0018,O=C(C(c1ccccc1)n1cccc1)N1c2nc(cccc3)c3n2CC1,1 Z2160389177,CCN(C=C(c1noc(C(C2)C22COCC2)n1)C(N1)=O)C1=O,1 Z2602480923,C[C@H](c(cc1)cc(C)c1F)NC(NC(CC1)CCC1(C1)C1(F)F)=O,1 Z1870253693,CC(Cc(cc1)ccc1NC(c1cc(cccc2)c2[nH]1)=O)C(O)=O,0 Z136987192,Nc1nc(ccc(C(NCCN2CCCC2)=O)c2)c2s1,1 Z1574898900,O=C(c(cc1)nc2c1nc[nH]2)N1CC(c(cc2)cc(F)c2F)OCC1,0 S836-3499,CNC([C@@H](C1)[C@@H](COC)CN1C(c1cc2cccnc2cc1)=O)=O,0 S689-2189,O=C(C(C1)CN(C(C2)CN2C(Nc(cccc2)c2F)=O)C1=O)NCc1ccncc1,1 S828-0138,Cc1cc(C(N(CC(C2)(F)F)[C@@H]2c2nnc(C)o2)=O)no1,1 V020-7479,Fc1ccc(CN(CC2)Cc3c2nc(N2CCOCC2)nc3Oc(ccc(F)c2)c2F)cc1,0 Z1666098808,CC(CC1c2cnccc2)CN1C(NCc(cc1)ccc1S(C)(=O)=O)=O,0 SD25-0516,CCC(CC)C(N1CC2(CCCCC2)C(CCC(N2CCOCC2)=O)C1)=O,0 SB36-0602,O=C(c1cn(C[C@H](CC(C2)(F)F)N2S(c2cccs2)(=O)=O)nn1)N1CCOCC1,1 Z4398904487,OC(c1cc(-n2nnc(CN(Cc(cc3)ccc3F)C(C3COCC3)=O)c2)cnc1)=O,1 F6438-1642,Cc1cc(CNC(C2CCCCC2)=O)nc(N2CCCCC2)n1,1 Z1240411115,Cc(cc1)cc(OCC(N(CC2)CCC2c2cn(C)nc2)=O)c1Cl,0 Z3670325680,CC(C)(C1)[C@H]1NC(CN(C(C1)=O)c(cc2)c1cc2F)=O,1 Z1444358697,CC(C(N(CC(O)=O)Cc1ccccc1)=O)OC,0 F5834-4790,O=C(Cc(cc1)ccc1NC(Nc1c(C(F)(F)F)cccc1)=O)NC1CC1,0 Y300-0568,CN(CC1)CCC1Oc(cc1)ccc1NC(COc(cccc1)c1F)=O,0 Z2300953968,CC(C)[C@H](C(O)=O)NS(c(c(OC)c1)cc(Cl)c1OC)(=O)=O,0 F5190-1771,O=C(Cc(cc1)ccc1NS(C1CC1)(=O)=O)NCC(F)(F)F,0 CM2897-4315,O=S(c1ccc(C(F)(F)F)cc1)(N(C1)CC1c1nc(-c2ccncc2)no1)=O,0 S831-3529,COC[C@@H](CN(C1)S(c2cccc3nsnc23)(=O)=O)[C@H]1c1ncccc1,1 S545-0699,O=C(NC1CCCC1)N(CCCCC1)C1c1nc(-c2ccncc2)no1,1 Z287847014,CC(C)(C)C(N1)=NC(C)=C(C(N2CCN(CCOC)CC2)=O)C1=O,1 Z2349805067,CN(Cc1c2cccc1NC(C1(CCCC1)C#N)=O)C2=O,1 F6806-4838,Cn1ncc(-c2cncc(N3CCN(Cc4noc(C5CCOCC5)n4)CC3)n2)c1,1 Z1560522946,Cc(cncc1)c1NC(N(CC1)CCC1=Cc(cccc1)c1F)=O,0 F6524-5433,CCn(cc1)nc1C(NCc1nnc(cc2)n1nc2N1CCCC1)=O,1 F6359-3297,O=C(c(cccc1)c1F)N(CC1)CCC1Oc1nnccc1,0 D315-1859,Cc(ccc(C(C1=C2CCCC1)=NNC2=O)c1)c1S(Nc1cc(OC)cc(OC)c1)(=O)=O,0 F6497-0722,O=C(c1nn(CCCO2)c2c1)N1CC(Cc2nc(C3CC3)no2)CCC1,1 S039-2509,CN(CC1)CCN1C(N1)=NC(CCN(Cc2cnccc2)CC2)=C2C1=O,1 F6713-5249,Cc1c(CN(CC2)CCN2c(cc2)nnc2-c2ccncc2)cno1,1 Z999781652,CC(c1nc(C)no1)NC(c1c[nH]nc1)=O,0 F6573-6956,O=C(Cc1cnccc1)N(CCN1c2ncccc2)CC1=O,1 Z1929868921,CCc(n(-c1c(C)cccc1)nc1)c1NCc1nc(-c(cc2)ccc2[N+]([O-])=O)no1,1 V028-7699,COc(cccc1)c1Oc1c(CN(Cc2ncccc2)CC2)c2nc(N2CCOCC2)n1,0 Z2256408122,OC([C@H](CCC1)[C@H]1NC(c1cc(OC2CCC2)ncc1)=O)=O,1 Z2295177146,CC(C)N(C(C)(C)CN(Cc(cc1)ccc1C(O)=O)C1)C1=O,0 L367-0065,O=C(c(cc1)ccc1-c1cnc(N2CCCC2)nc1)Nc(cc1)ccc1Br,0 F5033-5279,CC(C)(C(NCC(CC1)CCN1C(c1cc(cccc2)c2o1)=O)=O)Oc(cc1)ccc1Cl,0 F5558-0148,Cc1cc(C)nn1-c1cc(N(CC2)CCN2C(Cc2noc3c2cccc3)=O)nc(C)n1,1 Z5015110229,CN(C(C1=CNc(cccc2)c2C1=O)=O)c(ccc(C(F)(F)F)c1)c1Cl,0 F5016-0309,O=C(C(NCC(CC1)CCN1C1CCCC1)=O)NCCc1ccccc1,1 Z1952708983,Oc1cc(C(NC2CCOCCC2)=O)c(C(F)(F)F)cc1,0 Z2298858080,OC(CNC(c(cccc1)c1-c1ccc(C(F)(F)F)cc1)=O)C1CCC1,1 Z1192617439,CN(CCc(cc1)ccc1Cl)C(C(CC1)CS1(=O)=O)=O,0 Z398827790,Cc1c(CC(NCC(O)=O)=O)c(C)n[nH]1,0 F6476-5625,O=C(NCCCc1ccccc1)N(CC1)CC1Oc1ccncc1,1 L697-0669,O=S(c1cn(Cc2noc(-c3cc(cc(cc4)Cl)c4[nH]3)n2)cn1)(N1CCCCC1)=O,1 D718-1221,O=C1N(C2CCCCCC2)C=Cc2c1cnc1ncnn12,1 F6438-3347,COc1nc(N2CCCCC2)nc(CNS(c2cc(CCCC3)c3cc2)(=O)=O)n1,1 C696-0076,C(c1cnccc1)c(c1ccccc11)nnc1N1CCN(Cc2ccccc2)CC1,1 SD03-0390,CCCN(CC1CC1)C(CN(CC(C1)(CC2)CCN2S(C)(=O)=O)C1c1nc(C)no1)=O,1 F6559-1066,O=C(c(cccc1)c1Br)N(CC1)CC1n1c(cccc2)c2nc1,0 F2879-3945,CSc(cccc1)c1NC(C(N(CC1)CCN1c1cccc(Cl)c1)=O)=O,0 D562-0460,OC(c(sc(C(C1)c(cc(cc2)Cl)c2F)c2NC1=O)c2-c(cc1)ccc1F)=O,0 F1905-8915,CN(Cc1cn(-c(cc2)ccc2F)nc1)C1CCNCC1,0 E205-0087,CCn1c2nc(N(CC3)CCN3c3cccc(Cl)c3)nnc2c2c1cccc2,0 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M506-0484,N#Cc1c(CN(C(C2(c3cccc(Cl)c3)O)=O)c3c2cccc3)cccc1,0 Z1151853937,CC(N(CC1)CCN1C(CCNC(c1cc(C)c(C)s1)=O)=O)=O,1 Z1365965950,CO[C@@H](CC1)CN1C(Nc1c(N2CCCC2)nccc1)=O,1 F6539-2699,CN(C)C(N1CCC(CNC(c2c(C(F)(F)F)cccc2)=O)CC1)=O,0 F3385-5591,CC(Oc1c2ccc3c1CN(CCc1cccs1)CO3)=C(c(cc1)cc(OC)c1OC)C2=O,1 F6454-1270,CC(C)(C(NCC(CC1)CCN1c(nc1)ncc1F)=O)OC(C)=O,0 Z2433402575,O=C(c(cc1)c(C(F)(F)F)cc1Cl)N1CCNCC1,0 Y042-1179,COc(cc1)cc2c1[nH]cc2CCNC(C(CC1=O)CN1c1n[nH]c2c1cccc2)=O,0 J007-0968,Cc1cc(C(CCC2)N2C(Nc(cc2)cc3c2OCCO3)=O)no1,1 Z1419129118,CCCC(C)c1n[nH]c(NS(c(cc(C(F)(F)F)cc2)c2C(OC)=O)(=O)=O)c1,0 F2506-1456,Fc1cccc(Cl)c1CSc1nnc(cc2)n1nc2-c(cc1)cc2c1OCO2,1 F6472-2516,O=C(c1cscc1)N(C(CC1)C2)C1CC2n1nncc1,1 P223-0593,O=C(NC1CCCC1)N(CCC1)CC1c1nn(CCCNC2=O)c2c1,0 Z3303387593,Cc1c(cc(C(N(CCN2CCOCC2)CC2CC2)=O)s2)c2nc(C)c1,1 Z3042519090,CN(CC1)C2(COCC2)CN1c(nccc1)c1Br,0 Z2143150328,N#Cc1c(N(CC2)CCN2c2cncc3ccccc23)nc(CCC2)c2c1,1 Z432533784,CC(C(NCC1OCCC1)=O)S(c1c(C)ccc(C(C)(C)C)c1)(=O)=O,1 SB55-0923,Cn1ncc(C(N(C[C@@H]2CCC3)C[C@@]23c2noc(-c3ccccc3)n2)=O)c1,1 SA55-3838,O=C(CCCc1nc(cccc2)c2s1)NCCc1nn(CC2CC2)c2c1COCC2,1 F6353-5759,Cn1nnc(C(NCC(c2cocc2)N2CCSCC2)=O)c1,1 F5007-0099,Cc1nn(C(CC2)CS2(=O)=O)c(NC(COc(cccc2)c2F)=O)c1,1 Y043-6080,Cc1nnc(-c(cc(cc2)NC(CCC(C(Nc3c4cccc3)=O)NC4=O)=O)c2OC)o1,1 Z2982737709,C(c1ccno1)n1nnc(C2CCC2)c1,1 Z2351350195,C[C@@H]([C@@H](C(O)=O)NS(c(cc1)cc2c1OC(C)C2)(=O)=O)O,0 Z1479011867,O=C(c1n[nH]cn1)N(CC1)CCN1C(c1cccc(F)c1)=O,1 SB04-0650,Cc1cccc(C(N(C)CCN(C(CC2)CN2C(N(C)C)=O)C2CCOCC2)=O)n1,0 F6561-1350,O=C(Cn1c(cccc2)c2nc1)NCc1cncc(-c2ccco2)c1,1 F6619-6159,Cc1nc(N2CCN(Cc3nncn3C)CC2)cc(N2CCOCC2)n1,1 SD06-0832,COCC(N[C@@H](C[C@@H](COc1ccccc1)C1)[C@H]1C(NCCc1cccs1)=O)=O,1 F6510-1752,O=C(NCCN(c(cccc1)c1N1C2CC2)S1(=O)=O)Nc1c(C(F)(F)F)cccc1,1 F6438-1384,CN(C)c1ccnc(CNC(Nc(cc2)cc3c2OCCO3)=O)n1,1 F6497-1427,O=C(c1c(C(F)(F)F)cccc1)N1CC(Cc2nc(-c3nccnc3)no2)CCC1,0 S903-0714,CC(C)S(N(CC1)CCC1c1nnc(C2)n1CCN2C(C1(C)CC1)=O)(=O)=O,0 F6556-0502,O=C(NCC1(CCC1)N1CCOCC1)Nc(cc1)cc(Cl)c1Cl,1 L679-0085,CCOc(cc1)ccc1-n1c(nccc2)c2nc1CN(CC1)CCN1C(NC1CCCC1)=O,0 Z1832561197,Cn(cc1C(Nc2ccncc2)=O)nc1-c(s1)ccc1Cl,0 Z2372543940,CN(C)C(CC1)CCC1NC(c1cc2ccccc2nc1)=O,1 SB52-1107,CN(C)C(N1CCC(C2)(CN(C)C2c2noc(-c3ccccc3)n2)CC1)=O,0 F6573-7290,CCSc(cccc1)c1C(N(CCN1c2cnccc2)CC1=O)=O,0 Z2171192908,Cn1nc(C(N2C(Cc(cc3)ccc3Br)CCC2)=O)nc1,0 D754-0001,O=C(CN(C(c(cccc1)c1N1)=O)C1=O)NC[C@@H](CN(Cc1c2cccc1)C2=O)c1ccccc1,1 Z914336404,COc1ccc(CNC(NC2CCN(CC3CCCC3)CC2)=O)cc1,1 D473-1252,O=C(c(ccc(N(C(CC1)=O)S1(=O)=O)c1)c1Cl)N1CCOCC1,1 F3386-1028,Cc1c(C)c(S(n2nccc2)(=O)=O)c(C)c(C)c1,0 Z2660955534,OC(c1cc(S(NCCC(C2)C2(F)F)(=O)=O)cs1)=O,1 Z997834232,CS(CCOc1cccc(NS(c(cc2)cc(Cl)c2F)(=O)=O)c1)(=O)=O,0 4333-1501,CC(C[C@@H]1C(N2c3nc4ccccc4cc3)=O)=CC[C@H]1C2=O,1 F2423-0108,Cc1c(CC(N2CCN(Cc(cc3)cc4c3OCO4)CC2)=O)sc(-c2ccccc2)n1,1 Z3509955284,OC(C(Cc1cccc(Br)c1)NC(CCc1ncncc1)=O)=O,1 Z1526892360,CCc1nc(NCc2cc(-n3ncnc3)ccc2)c(ccs2)c2n1,0 Z2962676112,O=C(CCC(C(N1)=O)NC1=O)N(C[C@H](C1)C2CC2)[C@@H]1C1CC1,1 Z1416419182,Cc1cc(N(CCC2)C2c(ccc(OC)c2)c2OC)ncc1,0 Z1646656444,CCc1c(C(C)NCc2coc(-c(cc3)ccc3S(C)(=O)=O)n2)ccnc1,1 F069-1117,CCCCNC(C(C)N(c(cccc1)c1N=C1C(F)(F)F)C1=O)=O,0 Z1899416189,CN(C(C(CN1C)c(cccc2)c2C1=O)=O)c(cc1)ccc1F,0 Z2131959341,O=C(N[C@@H]1COCCC1)N(CC1)CCN1c1c(ccs2)c2ncn1,1 SC08-0127,CCc1ccc(CN(C2)CC2c2nc(C(CC3)CCN3S(C)(=O)=O)no2)cc1,0 S661-1187,CCN(C(C(C1)N2CC1(CC1)CCN1C(c1ccc(Cn3nc(C)cc3C)o1)=O)=O)C2=O,1 Z1140023278,Cc1c(C(NC2COCCC2)=O)nnn1-c(cccc1)c1Cl,0 V017-1900,Cc1cccc(C(C(C(NCC2OCCC2)=O)c2c3cccc2)N(C2CC2)C3=O)c1,1 Z1993809443,Cc(c(F)c(cc1)OC)c1S(N1C(CNC)CCC1)(=O)=O,0 Z2116183444,CC(C)(C1)N(CCO)CCN1C(NCc(cc1)cc(F)c1Oc(cccc1)c1F)=O,0 F2147-1831,O=C(CN1C2CC2)NC(c(cccc2)c2Br)C1=O,1 Z1899456599,CN(CC(C(NCC1(CCOCC1)c1cccc(Cl)c1)=O)c1c2cccc1)C2=O,1 D455-0656,Cc1nc(ccc(NC(c(n2CC3)c(-c(cc4)ccc4Cl)nc2S3(=O)=O)=O)c2)c2s1,1 Z3687066641,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NC(Cc(c1ncccc11)ccc1Cl)=O,1 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Z4875065668,CC(C)(CC(N(C(C1)c2ccco2)N=C1c(cc1)cc(OC)c1OC)=O)CC(O)=O,0 F5791-1016,O=C(Cc1noc2c1cccc2)N1c2nc(cccc3)c3n2CC1,1 Z2434053146,CC(CC(Nc(cc1)cc2c1nc(N1CCCC1)s2)=O)C1CCNCC1,1 C562-1321,CC(C)CC(C(NCc(cc1)ccc1Cl)=O)NS(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O,0 Z219378830,CS(c(cccc1)c1N(CC1)CCC1NC(c1ccccc1)=O)(=O)=O,0 Z3071580343,CCc1cc(C)nc(N(CC2)CCC2(C(C(OCC)=O)(F)F)O)n1,0 F6252-5844,CCOC(N(CC1)CCC1NC(c(nnn1Cc2ccccc2)c1-n1cccc1)=O)=O,1 V026-8781,O=C(c1ccco1)N(CC1)CCN1c1nc(C2CC2)nc2c1cnn2-c1ccccc1,1 F5001-1231,O=C(Cc1noc(-c2cccs2)c1)NCCN1CCOCC1,1 F6512-8952,Cc1c(CNC(c(c(F)ccc2)c2Cl)=O)cno1,0 SC66-0781,O=C(CC1CC1)N(C1)CC2(CCOCC2)C1c1nncn1CC1CC1,1 Z1439630262,Cc1nc(n(C)nc2)c2c(N2CC(c3cc(OC)ccc3)OCC2)n1,1 F6556-5309,O=S(c(cccc1)c1OC(F)(F)F)(N(CCC1)CCN1C1CCSCC1)=O,0 Z2605533689,C(C1CCC1)N(CCC1)CC1c1n[nH]c(N2CCNCC2)c1,1 8017-4989,O=C(C1(CCCCC1)NC(c1ncccc1)=O)Nc(cc1)cc2c1OCCO2,1 Z1869743107,COc1cc(C(N(CCC(O)=O)C2CCOCC2)=O)ncc1,0 SA58-1290,CN(C)S(N1C(CCc2noc(-c3ccccc3)n2)CCC1)(=O)=O,0 F2368-3072,CCSc1ccc(Cc2nnc(NC(COc(cccc3)c3F)=O)o2)cc1,0 E783-0043,Cn1c(-c(cc(cc2)S(N(CC(C3)CN45)CC3C5=CC=CC4=O)(=O)=O)c2OC2=O)c2nc1,1 S988-0172,Cc1cc(C)nn1CCC(N(C[C@@H]1CN(C2)C3CCOCC3)C[C@@]12c1nc(C)no1)=O,1 F6539-2743,CN(C)C(N1CCC(CNC(COc(ccc(Cl)c2)c2Cl)=O)CC1)=O,0 F5546-0013,COc(cc1)cc(OC)c1NC(Cn1c(-c2ncccc2)nc2c1cccc2)=O,1 Z1565106643,CN(CC1)CCC1(CCC1)N1C(C(CC1=O)CN1c(cccc1)c1OC)=O,1 F6529-0997,CN(C(C(F)(F)F)=NN1C(CC2)CCN2C(c2cc(cccc3)c3s2)=O)C1=O,1 D622-0119,FC(c1nc(cc2OCCOc2c2)c2n1Cc(cc1)ccc1Br)(F)F,0 Z5033002581,NC(CCC1)c(cc2)c1cc2-c1nc(-c2n[nH]c(-c3cccc(Br)c3)n2)no1,1 F6541-1441,Cc(nc1)cnc1C(N(CC1)Cc2c1cccc2)=O,1 E717-0271,CCCn1c(C(N(CC(N(CC2OCCC2)Cc2ccco2)=O)N=C2)=O)c2c2c1cccc2,1 F1775-0018,O=C(CSc1cccc2cccnc12)N(C1)c(cccc2)c2NC1=O,1 S396-0887,O=C(CC(CCC1)CN1C(C=NN1CC2CC2)=CC1=O)NC1CCCCC1,1 SC21-0360,CCCNC(N(CC1)Cc2c1n(C)nc2-c1ncc(C)n1CC1CC1)=O,0 V020-3791,CC(CC1)CCC11OCC(C(NCCCN2CCOCC2)=O)N1C(c(cc1)ccc1F)=O,1 Z2013502397,CC(C)CC1(CCC1)C(N(C1)CC1NC(NC)=O)=O,0 F3085-0001,O=C(c1cccs1)N(C(C1)c2nc(cccc3)c3[nH]2)N=C1c(cc1)ccc1Br,1 Z4666911586,CC(C)(C)OC([C@](C)(CC1)C(C)(C)[C@H]1C(N(CCN1)CC1=O)=O)=O,1 Z2001001934,CC(CC1)CN1C(N(C1)CN(C)C1=O)=O,1 F5854-4545,COc(ccc(F)c1)c1S(N(CCc1cccs1)C1CC1)(=O)=O,0 F2095-0383,COc(cc1)ccc1-c1c(C(Nc2nccs2)=O)c(cc(cc2)OC)c2o1,1 Z2897440715,OC(CN(C=CC=C1C(NCC(C2)COc3c2cccc3)=O)C1=O)=O,1 F6787-0853,Cn1ncc(C(N2CC(COc(nc3)ncc3F)(CCC3)C3C2)=O)c1,1 Z2993322595,CN(C)C(c1c(NCc2cc(Br)cnc2)[nH]nc1)=O,0 Z3058831065,CC(C1CSC1)NC(c1c[nH]nc1-c(s1)ccc1Cl)=O,1 S826-4542,Cn1c(CN(C[C@@H]2CO)C[C@@H]2c2nc(COC)no2)ccc1,1 SB95-1335,COc1cccc(CN(CCC2)CC2N(CCN2CCOCC2)S(C)(=O)=O)n1,0 Z126343016,CC(CC(C)C1)CN1C(CN(CC1)CCN1S(c(cc1)cc(N2)c1NC2=O)(=O)=O)=O,1 Z1390643732,CCN(CC)C(CCC(N(CC1)CCC1c1ccnn1C)=O)=O,1 S606-2092,COCCN(c1cccnc1N1[C@H](CC2)CN2S(c(cc2)cc(F)c2F)(=O)=O)C1=O,0 Z1927030047,CC(N(CCCCC1)C1C(CC1)CCN1C(Cc(cc1)ncc1OC)=O)=O,1 F5857-6813,OC1(CNC(NCc2cccc3ccccc23)=O)C=CCCC1,1 F6559-6652,CC(C)c1nc(S(NC(CC2)CCN2c2nc(C)nc(C(F)(F)F)c2)(=O)=O)cn1C,1 Z2127026237,CC(N(C1CC1)C=C1C(NCCN2CCC3(CCCCC3)CC2)=O)=CC1=O,1 Z1261447679,O=C(Cn1ncc(NC(c(cc2)ccc2OCC2CC2)=O)c1)N1CCOCC1,1 F2517-1280,O=C(Cc(cccc1)c1Cl)Nc1nnc(-c(cc2)ccc2OC(F)(F)F)o1,0 Y501-9194,N#Cc1c(NC(CC2C(F)(F)F)C3CC3)n2nc1,1 F5679-0083,O=C(Cc1csc(-n2cccc2)n1)N(CC1)CCC1c1nc(cccc2)c2o1,1 F6448-0738,O=C(c1noc(-c2ccccc2)c1)Nc1cn(C2COCC2)nc1,1 F0914-2631,O=S(Cc1ccccc1)(c1nc(cccc2)c2[nH]1)=O,1 P809-1094,COc(cc(cc1)Cl)c1C(NC(CC1)CN1c1cc(-c2cccs2)n[nH]1)=O,0 Z5001810226,NC(c1cc(C(N(CC2)CCN2S(c(cc2)ccc2Cl)(=O)=O)=O)cc(F)c1)=O,0 F6559-0655,O=C(C(Oc1c2cccc1)=CC2=O)N(CC1)CCC1N(C=Nc1c2cccn1)C2=O,1 F6619-7328,CN(C)c(cc1)nnc1N1CCN(Cc(cccc2)c2Br)CC1,0 Z3278107640,N[C@@H](C1)[C@@H](C2)[C@@H]2[C@@H]1c1nc(-c2cocc2)no1,1 Y021-1080,CC1c2cc(-c3ccnc4nc(-c(cc5)ccc5Cl)nn34)c(C)cc2NC(C)(C)C1,0 Z1355354923,CN(C)c(nccc1)c1N(C)C(c1ccccc1)=O,0 F6791-6746,Cc1cc(C)nn1-c1cc(N(CC2)CCS2(=O)=O)ncn1,1 Z2801149134,CN(C)CCN(c(cc(cc1)C(N(CC2)CCN2c2ncc[nH]2)=O)c1N1)C1=O,1 F6539-3374,O=S(c1cccc2cccnc12)(NCc(cc1)ccc1-c1cocc1)=O,1 Z748562882,COCc1cccc(C(Nc2cn(CC3OCCC3)nc2)=O)c1,0 SB04-0223,Cc1nn(C)cc1C(NCCN(C(CC1)CN1S(C)(=O)=O)C1CCOCC1)=O,0 F6560-5520,Cn1ncc(-c2cc(CNC(c3cc(F)cnc3)=O)cnc2)c1,0 SC55-0417,CN(C1)CC(C2)(CN2S(c2cc(OC)ccc2)(=O)=O)C1c1nc(CCOC)n[nH]1,1 F830-0850,O=C1N(Cc2nc(-c(cc3)cc(Br)c3F)no2)C=Nc2c1nnn2Cc(cc1)ccc1F,0 Z820095584,Cc1cc(CN(C)CCC(O)=O)c(C)cc1,0 Y040-3532,Cc(c(O1)c(cc2CN3CCCC3)C(c(cc3)ccc3OC)=CC1=O)c2O,1 F6178-7826,O=C(C(NCc(cc1)ccc1F)=O)NCC(CC1)CCN1C1CSCC1,0 SD12-0895,Cc1noc(CC(C(N(Cc2ccccc2)CC2)=O)N2C(NC2CCCC2)=O)n1,1 F2920-0028,O=C(C(C1)CN(CCN(CC2)CCN2S(c2ccccc2)(=O)=O)C1=O)NCc1ccccc1,1 Z1870832935,CCc1c(CC(N(CC2)CC(C)CS2(=O)=O)=O)c(CC)nn1C,0 Y043-5849,N12/C(/C3CN(Cc4c5OC(/C/6=C(\c5ccc4O)/CCCC6)=O)CC(C1)C3)=C\C=C/C2=O,1 F6608-1274,CC(C)(C)N(C1)CC1Oc1cc(C)nc2ccnn12,1 F6752-5406,O=C(C1CCN(Cc2csc(C3CCCC3)n2)CC1)NC1CC1,1 Z1540641830,Cn1ncc(C(NC(CC2)CCC2(F)F)=O)c1-n1cccc1,1 F6443-7897,O=C(CN1N=CC=CC1=O)NCC(CCC1)N1c1ccccc1,1 F6257-3624,COc(ccc(Cl)c1)c1NC(Nc1ncnc(N(CC2)CCN2c2ccccc2)c1)=O,1 F2740-0103,O=C(NCc(cc1)ccc1F)Nc1c[nH]c2c1cccc2,0 D074-0042,CC(C)c1ccc(C(c2c3[nH]nc2-c(cccc2)c2O)N(CC2OCCC2)C3=O)cc1,0 F6562-2800,Cc1c(C)c(S(NCc2cc(N(CCC3)C3=O)ncc2)(=O)=O)c(C)c(C)c1,0 Z1607635729,C[C@H](C1)O[C@@H](C)CN1C(NCC1(CCOCC1)c1cccc(Cl)c1)=O,0 Z4282857314,CNC(c1cc2cccc(OC(F)F)c2o1)=O,0 Z2144796983,O=C(c1cn(CCF)nc1)Nc(cc1)cc(C(NC2CC2)=O)c1Cl,0 SB75-1479,Cc1noc([C@]2(C[C@@H](C3)NC(CCn4cncc4)=O)[C@@H]3CN(Cc3ccccc3)C2)n1,1 A0062288,CCOc(cc1)ccc1-n1c(SCC(N(CC2)c3c2cccc3)=O)nnc1CNC(c1cccs1)=O,1 F5959-0137,Cc1nccn1CCNC(c(cc(cc1)Cl)c1OC)=O,0 SA93-0479,Cc1noc(C)c1CC(N(CCC1)CC1(CC1CC1)C(N)=O)=O,1 F6562-4478,CN(C)c1nc(CCC(C2)NS(c3cccs3)(=O)=O)c2cn1,1 F6561-6574,Cn1ncc(-c2c(CNC(c3cocc3)=O)cccn2)c1,1 L957-0222,CC(Cc1ccco1)NC(c1nnc(-c(cc2)ccc2S(N2CCCC2)(=O)=O)o1)=O,1 Z1335053781,CCc1cccc(CC)c1NC(C(C)Oc1cnccc1)=O,0 Z1839639280,CCc(nc(CNS(c1ccco1)(=O)=O)cc1)c1C(O)=O,1 F6529-3010,CS(N(CC1)CCC1C(N(CC1)CCC1N(CC(N1C2CC2)=O)C1=O)=O)(=O)=O,1 Z4129292913,OC(CN1)C(C2)(CN2C(c(c2n[nH]cc22)ccc2Br)=O)CC1=O,1 F6474-0337,CC(N1C)=CC(OC(CC2)CCN2C(C(CCC2)N2c2nc(cccc3)c3o2)=O)=CC1=O,1 SA85-0509,OC(CN(CCc1ccccc1)C(C1)=O)CN1C(CCS(c1ccccc1)(=O)=O)=O,1 Z3289740044,Oc1cccc(-c2cc(C(N(CCN3Cc4ccc(C(F)(F)F)cc4)CC3=O)=O)no2)c1,1 V014-3089,CCc1nc(SCc2cc(C(NCC3OCCC3)=O)ccc2)nc(N2CCCC2)c1,1 Z2168807830,O=C(c1c(C2CC2)nns1)NCc(cc1)ccc1F,1 Z1445118011,CC(C)(C)C(Nc1nn(CC(O)=O)cc1)=O,0 F6773-2800,C(CN(CC1)c2nccc3c2cco3)C1Oc1nccs1,1 E203-1591,CC(C)(c(cc(cc1)S(N(CC2)CCC2C(N2CCN(C)CC2)=O)(=O)=O)c1N1C)C1=O,1 SC73-0541,Cc1noc(C)c1CC(N(CC1)CCC1(C1)OCc2c1n(C)nc2C(NCC1CC1)=O)=O,1 Z2768785135,O=S(CC1)(CCn2c1nnc2CC1CCCC1)=O,1 F5539-0048,CN(C(C1)=O)c(cc2)c1cc2NC(Nc(cc(cc1)Cl)c1OC)=O,0 F1094-0285,CCN(c(c1c2cccc11)ccc1S(Nc1cccc(Cl)c1)(=O)=O)C2=O,0 F6184-1249,O=C(NCCN(CC1)CCC1c1cccs1)Nc(cccc1)c1Cl,0 Z4791768551,Cc1cc(Cl)cc(C(NC(C(CC2)c3c2cccc3)C(O)=O)=O)c1,0 T955-0362,CCN(CC)C(N(CCC1)CC1c1nc(CCOc(cc2)ccc2F)no1)=O,0 F6245-5686,CC(C)(Cc1ccc2)Oc1c2OCC(NCCN1N=C(C(F)(F)F)N(C)C1=O)=O,1 Z1334905606,CC(C(N1)=O)(c(cc2)ccc2C(N(CC2c3ccccc3)Cc3c2cccc3)=O)NC1=O,1 Z3175609435,Cc1nc(-c(cccc2)c2NC(N2C(CC3)CN3CC2)=O)cs1,1 D294-5044,CCCc1nnc(NC(C(C2)CN(CCc3c[nH]c(cc4)c3cc4Cl)C2=O)=O)s1,0 SA49-1425,CCC(CC)C(N(C1)CC11OCC(CC(N2CCOCC2)=O)C1)=O,1 F6475-2395,O=C(c(cc1)cnc1OCC1OCCC1)NCc1c(N2CCCC2)nccc1,1 F6414-0094,OC(CNC(COc(cccc1)c1F)=O)c(cc1)cc2c1OCC2,0 Z2460783427,CC(C(N(CC1)CC1(C(O)=O)c1ccccc1)=O)c1cccs1,1 V004-0024,CCC(c1ccccc1)N(Cc(cc(cc1)NS(c2cc(F)c(C)cc2)(=O)=O)c1OC1CC)C1=O,0 Z2899228804,COC1(Cc2nc(-c3nccc4c3CCCC4)no2)CCC1,1 Y041-4193,OC([C@H]1CC[C@H](CNC(CCn(c(-c2ccccc2)c2)c3c2cccc3)=O)CC1)=O,1 F0349-0613,CC(c(cc1)ccc1NC(CN1CCOCC1)=O)=O,0 Z1167445082,CCNC(N(CC1)CCN1C(C(c(cccc1)c1N1C)=CC1=O)=O)=O,1 F6507-5897,Cn1c(C(CCNC(c(cc2)cc(F)c2OC)=O)O)ccc1,0 F6805-9186,Cc(cncc1)c1OCC1CCN(Cc2cncs2)CC1,0 V015-7253,Cc1c(CN(CCc2nc(N3CCOCC3)n3)Cc2c3Oc2cc(F)ccc2)scc1,0 G852-0319,O=C(C=C1)Nc(cc2)c1cc2S(NCCN(Cc1ccco1)C1CCCC1)(=O)=O,1 F6436-0632,Cn1cnc(S(NCC2CCN(Cc(cccc3)c3SC)CC2)(=O)=O)c1,1 Z2033211660,CC(C)Cn1ncc(NC(c2c(C)occ2C)=O)c1,0 Z2269173683,CCc1cccc(C(NC(CCC2)CN2c2cc(OC)ccc2)=O)n1,0 Z2493061471,CC([C@H](C1)C(C)(C)[C@H]1C(O)=O)NC(Nc1nccc(Cl)c1)=O,1 SA73-0619,O=C(C1CCOCC1)N(CC1)CCC1(CC1CC1)c1noc(C2CCOCC2)n1,1 SB27-0632,COCCNC(N(CC1)CCC1N(C1)C2(COCC2)CN(Cc2ccccc2)C1=O)=O,0 F5461-0244,O=C(CSCc1ccccc1)N1CCN(Cc2nc(-c(cc3)ccc3F)cs2)CC1,1 V007-8760,CC(CC1)CCN1c1nc(CCN(Cc(cc2)ccc2OC)C2)c2c(Oc2ccc(C)cc2)n1,0 F6442-6214,COC(CC1)CN1C(CC1)CCN1S(c1cc(CCCC2)c2cc1)(=O)=O,1 Z1498909436,CCC1(CC)c(cccc2)c2N(CC(C=CN2C)=CC2=O)C1,1 Z1697054397,Cc1nn(C)c(Sc2ccccc2)c1C(NCC(C1CC1)C1CC1)=O,1 F6368-0052,Cn(c(C(N1CCN(CCn2c(-c3ccccc3)ncc2)CC1)=O)c1)nc1-c1ccccc1,1 Z1833302656,Oc1cccc2c1CCCC2C(NC1c2cccc(F)c2OCC1)=O,1 F5017-1395,O=S(c(s1)ccc1Cl)(NCC(CC1)CCN1c1ncccc1)=O,1 F726-0319,CCCCNC(C(CCC1)CN1c1ccnc(-c(cc2)ccc2F)n1)=O,0 V027-4324,CCC(C)NC(c1ccc(CN2c(cc(cc3)C(C)=O)c3OCC2=O)o1)=O,0 F6526-1564,CCn1nc(C)c(S(N(CCn(cc2)nc2-c2ccncc2)C2CCCC2)(=O)=O)c1C,1 Z2936914469,CC(C)(C)c1nccc(NCc(c(O)ccc2)c2O)n1,0 F6609-6718,COc(ccc(CCNc1c(cc(cc2)Cl)c2ncc1C(N1CCOCC1)=O)c1)c1OC,1 SC85-0507,CN(CC1)C[C@@]1(CN(C1)C(c2ccco2)=O)[C@@H]1c1nc(-c(cc2)ccc2F)no1,1 SA23-1350,CC(NC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1ccco1)=O)=O,1 F3225-6367,O=C1C(C(N(c2ccccc2)C(c2cccs2)=N2)=O)=C2Oc2c1cccc2,1 Z2193907285,CC(c1noc(-c(cc(C)c(F)c2)c2Cl)n1)NC(N)=O,0 8011-3400,OC(C(CCC1)c2c1c(cc(cc1)Br)c1[nH]2)=O,0 F6597-2789,O=S1(CCC(CN2CCC(COc3nc(C(F)(F)F)ccc3)CC2)CC1)=O,0 7399-0181,CCNC(N(C1CC(OCC)=O)C(CCCC2)C2NC1=O)=O,1 Z2453278830,O=C(C(CC1)Cc2c1ncnc2)Nc(cc1)ccc1C(N1CCCC1)=O,1 F2267-0048,O=C(CC(CCCC1)N1S(c1ccccc1)(=O)=O)NCCC1=CCCCC1,1 F6681-3614,C(C(C1)CN1c1ccnc2ccccc12)Oc1cnccc1,1 F1743-0060,C=CCn1c(SC/C=C/c2ccccc2)nnc1COc1cccc2cccnc12,1 F1873-1948,CN(c1c(C(N2C)=O)c(SCc3ncccc3)nc(-c(cccc3)c3OC)n1)C2=O,1 F2493-1852,CC(C)(C(NCc1noc(-c(cc2)cc3c2OCO3)c1)=O)Oc(cc1)ccc1Cl,1 Z250-0024,COc(cccc1)c1N(CC1)CCN1C(NC1=O)=Nc2c1scc2-c1ccccc1,0 Z4235670411,[O-]C([C@@H](Cc1c[nH]c2c1cccc2)NC(Nc1cccc2ccccc12)=O)=O,1 S606-1192,CCN(c1c(N2[C@H](CC3)CN3C(Cc3c[nH]c4c3cccc4)=O)nccc1)C2=O,0 Z4560504394,Cc1c(C(NCc2nnc(-c3ccncc3)[nH]2)=O)sc(Cc2ccccc2)n1,1 SA43-0918,CCn1ncc(C(N(C2)CC2(C2)CN(C)C2c2nc(-c3ccncc3)no2)=O)c1C,0 F6125-3019,O=C(C(C1)CN1S(C1CC1)(=O)=O)NCC1OCCC1,1 Z1443259140,Oc1cccc(C(C2)OCCN2C(c(cc2)cc3c2[nH]c2c3CCCC2)=O)c1,1 Y031-6921,CC(Nc1cccc(NC(CCC2CCCCC2)=O)c1)=O,0 V030-5102,Cc(cc1)ccc1Oc1c(CN(Cc2ccc(C(F)(F)F)cc2)CC2)c2nc(N2CCCCC2)n1,0 Z2297411470,CO[C@@H](CCC1)[C@H]1NC(Cc1noc2c1cccc2)=O,1 P207-8862,OC(C(CC1)Cc2c1nc(N(CC1)CCN1C(C1CCC1)=O)s2)=O,0 Z2629093324,CCSC(CCCC1)CN1C(c(nc1)c2n1ccc(C)c2)=O,1 Z3679626089,O=C(N[C@H]1[C@H](CC2)O[C@H]2C1)Nc1c[nH]nn1,1 F6481-1498,O=C(c1cc(cccc2)c2s1)N(CC1)CCSC1c(cccc1)c1F,1 F6554-6000,COC(C(C1)C1(CC1)CCN1C(C(CC1)CCN1S(C)(=O)=O)=O)=O,0 8014-9382,O=C(CCC1)C(C(CC2=O)c3cscc3)=C1N2c1ccc(C(F)(F)F)cc1,0 F6555-0269,O=C(CNC(OCc1ccccc1)=O)N(C1)CC1n1nnc(C2CC2)c1,1 SB57-1444,CCS(N(C1)CC(C2)(CN2C(Nc2c(C)cccc2)=O)C1c1nc(C)no1)(=O)=O,0 F6178-8016,N#Cc1nccnc1N1CCC(CNC(CSC2CCCC2)=O)CC1,1 SA31-0261,CC(C)c1nnc(COC2)n1C2(C)C(NCc1nc(cc(C)cc2)c2[nH]1)=O,1 F6433-0130,O=C(Cc1noc2c1cccc2)Nc1ncnc(-n(cc2)c3c2cccc3)c1,1 F3406-5189,CCOC(c(cccc1)c1NC(CN1N=C(C(Sc2ccccc2)=NC=C2)N2C1=O)=O)=O,1 Z992078732,Cc1cccc(C(N2CCN(Cc3nc(cccc4)c4[nH]3)CC2)=O)c1C,0 S259-0652,CCCNC(N1CCN(Cc2c(C)onc2C)CC1)=O,0 Z1625828606,Cc1c(C(COCC2)N2C(CC2(CCCCC2)O)=O)c(C)nn1Cc1ccccc1,1 S831-2359,Cc1nn(C)c(C(N(C[C@@H]2CO)C[C@@H]2c2ncccc2)=O)c1,0 Z2439087394,CC(C)C(C1(CNC(CNC)=O)CC1)O,0 SA85-0383,CN(C)S(N(CC(CN1CCc2ccccc2)O)CC1=O)(=O)=O,1 F6561-6870,Cn1ncc(-c2c(CNS(c(cc3)cc4c3OCC4)(=O)=O)cccn2)c1,1 F6525-6389,Cc1cc(C(NCCn2nc(C)c(-c3cscc3)c2C)=O)c(C)o1,1 Z1978396773,Cc1nn(cc(cc2)NC(c3cc(OCC4OCCC4)ccc3)=O)c2n1,1 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Y043-2184,O=C(CCn(cc1)c2c1ccc(OCc1ccccc1)c2)Nc1nnc(C2CC2)s1,1 F3294-0020,Cc(cc1)ccc1-c1nnc(CN(c(cc(C)cc2)c2O2)C2=O)o1,1 F6561-3519,C=C(CC1)CCC1NC(C1(CC(C2)C3)CC3CC2C1)=O,1 E786-2035,O=C(c1c2nccc1)N(Cc(s1)ccc1S(N1CCOCC1)(=O)=O)C2=O,1 SC39-0094,O=C(c1ccncc1)N(CC1)CC1(c1nc(C2CCOCC2)no1)F,1 F6411-3446,N#Cc1c(CSc2nnc(c3c4)n2ccn3nc4-c(cc2)ccc2Cl)cccc1,1 Z1729718733,CC(CC(N(CC1)CCC1(Cc(cc1)ccc1F)O)=O)c1ccccc1,0 F6476-6194,O=C(Nc1c(C(F)(F)F)cccc1)N(CC1)CC1Oc(ccnc1)c1Cl,0 F5893-0083,CCOC(CCC(Nc(c1n2)cccc1ccc2OC)=O)=O,0 F824-0085,CC1Oc(ccc(S(N(CC2)CCN2C(NC2CCCCC2)=O)(=O)=O)c2)c2NC1=O,1 F5261-0390,Cc(ccc(Cl)c1)c1S(NCC(c1cccn1C)N(C)C)(=O)=O,0 S629-2405,Cn1ncc(C(N2Cc(cc(CCC(N3CCCC3)=O)cc3)c3OCC2)=O)c1,1 6703-0621,CC1N(CCC(N)=O)CCc(cc2OC)c1cc2OC,0 F6806-6814,O=C(CN1CC(C(N(CC2)CCC2(F)F)=O)OCC1)NC1CCCCC1,1 Z3827932715,CC(C)c(cccc1)c1NC([C@@H]1C[C@H](C2)NC[C@H]2C1)=O,1 Z1230439087,CCC(CN1CCN(CC(Nc(cccc2)c2Oc2ccccc2)=O)CC1)O,0 Z2957324204,Cc1nc(CCCC2N(C)C(Nc3ccnn3C3CCC3)=O)c2s1,1 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Z1840076794,COc(cc1)nn2c1nnc2CNC1CCCC1,1 F1757-0268,Cc1nc(C)nn1CC(COc1cc2ccccc2cc1)O,1 Z3033469824,CC(c1csnc1OC)NCC(CC1)CCN1S(C)(=O)=O,1 Z1352160535,NC(c1c[nH]c(C(OCc2nc(cccc3)c3n2C2(CC(C3)C4)CC4CC3C2)=O)c1)=O,0 F6520-0731,O=C(CCC(F)(F)F)NCCc1ccc(-c2ccco2)s1,0 SA41-0188,Cc(n(C)c(-c(cc1)ccc1OC)c1)c1C(N(C1)CC11CN(C)C(COC)C1)=O,1 Z2004644138,CS(C(CC1)CN1C(c(cc1)ccc1N1CCCCC1)=O)(=O)=O,1 F0405-0036,c1cnc(ccc(-c2ccc3ncccc3c2)c2)c2c1,1 G672-0140,Cc1noc(C)c1CCNC(CN1c(cc(cc2)S(N(C)C)(=O)=O)c2N(CCCC2)C2C1=O)=O,1 Z1881625688,Cc1cccc(CN(CC2)CCN2C(Cc2ccnn2C)=O)c1,0 G282-6465,CCN(Cc1ccccc1)C(c1c(C(N(C2CC2)C(C)(C2)C(NCc3ccccc3)=O)=O)n2cn1)=O,1 F6476-3632,O=C(Cc1cccs1)N(CC1)CC1Oc1nc2ccccc2cc1,1 Z5027903248,NC(NC1=NC(CN(Cc2c(C3)cccc2)C3C(NCCc(cc2)ccc2F)=O)=C2)=NN1C2=O,1 F6481-3932,O=S(c1cnccc1)(N(CC1)CCSC1c1ccco1)=O,1 F5939-3487,CS(N(CC1)CCC1Oc(sc1ccc2)nc1c2Cl)(=O)=O,0 T505-0978,O=C(c1cn(CCC(CCCC2)N2C(c2ccco2)=O)nn1)N1CCOCC1,1 V014-2358,CCCNC(NC(C)C1N(Cc2ccccc2)CCc(cc2OC)c1cc2OC)=O,0 Y031-2501,CCc1nnc(NC(C(CC2=O)CN2c(cc2)ccc2OC)=O)s1,0 Z2605818260,NCCn1nnc(C(NC(CCC2)CN2C2CCCCC2)=O)c1,1 J046-1066,CC(C)C(NC1=CC(c2ccccc2)=NN(C(C)C(Nc(cc2)ccc2C(C)=O)=O)C1=O)=O,0 F6510-1655,COc(ccc(C(NCCN(c(cccc1)c1N1C2CC2)S1(=O)=O)=O)c1)c1F,0 Z2369513344,C(C1CCC1)N1[C@H](CNC2)[C@H]2CCC1,1 Z1551079760,CC(C1)ON=C1NC(c1c(C)oc(NC(N2c3ccccc3)=O)c1C2=O)=O,1 F3290-0078,CSc(nc1)nc(C(Nc(cc2)ncc2Cl)=O)c1Cl,0 Y207-5522,O=C(CC(C1)c(cccc2)c2Cl)C2=C1Nc(cccc1)c1NC2c1ccncc1,0 Z92754084,CC(C)n(c1nc(-c2ccco2)c2)ncc1c2C(OC)=O,0 F5017-3395,Cc(cc(cc1)F)c1S(NCC(CC1)CCN1S(C1CC1)(=O)=O)(=O)=O,0 Z2714481384,O=C(c1cc2ccccc2cc1)N(CC1)CCC1N1CCOCCC1,1 Z1028528618,CC(C(NC(C)(C)C)=O)NC(NCc1nccn1C(F)F)=O,0 F6785-7217,O=C(NC1CCOCC1)N1CCC(COc(cc2)nn3c2nc(C2CC2)c3)CC1,1 D754-0086,CC(c1cn(CCC(NC[C@@H](CN(Cc2c3cccc2)C3=O)c2ccccc2)=O)c2c1cccc2)=O,0 Z2135003386,Cn1c2nccc(C(N3CC4(COCCC4)OCC3)=O)c2nc1,1 Z329696844,OC(c(cc1)cc(Br)c1S(N(CCC1)c2c1cccc2)(=O)=O)=O,0 Z3016150413,CC(C)(C1)CC1C(Nc1cc(C(OC)=O)nn1C)=O,0 Z2277840850,CC(CC1)CN1S(N(C)C1(CO)CC1)(=O)=O,0 F6475-6511,CC(C)(C)c1noc(NC(c(cc2)cnc2OC2CSCC2)=O)c1,1 Z1324290457,Cc(ccc(F)c1)c1NC(c1cnc2n(C)ncc2c1)=O,0 F6178-4806,O=C(c1ccco1)NCC(CC1)CCN1c1nccnc1,1 F2270-0484,Cc(cc1)cc(N2C)c1Oc(ccc(NS(c(cccc1)c1Br)(=O)=O)c1)c1C2=O,0 T955-1040,Cc1ccc(C(N(CCC2)CC2c2nc(CCOCC3CCOCC3)no2)=O)s1,1 Z1137332540,O=C([C@@H](CC1)NC1=O)NOCc1ccccc1,1 F1016-0401,O=C(CSCc1ccco1)Nc(cc(C(F)(F)F)cc1)c1Cl,0 F6430-0248,O=C(CSCc1ccccc1)Nc1ncnc(-n2nccc2)c1,1 F2050-0325,O=C(c1ccccc1)N(CCC1)c2c1ccc(NS(Cc(cccc1)c1Cl)(=O)=O)c2,1 Z3043522299,CN(CC1)C2(COCC2)CN1C(c(ccc1c2)nc1ccc2OC)=O,1 Z3623413215,CC(C1)(C2)OC3(CCOCC3)C12NC(c1cc(Cn2nncc2)ccc1)=O,1 F2487-0146,CC(C)(C(NCC1)=O)N1C(CCCS(c(cc1)ccc1OC)(=O)=O)=O,1 F6573-8835,CCSc(cccc1)c1C(NCc1cncc(-c2cocc2)c1)=O,0 Z1603760490,OC(c1cccc(C(N(Cc(cccc2)c2F)C2CCC2)=O)n1)=O,1 SC10-0889,CS(N(CCCN1CCCC1)C(CC1)CN1S(C1CC1)(=O)=O)(=O)=O,1 Z3417378367,CC1(C(NCc2cc(C(N(C3)C(CCC(N4)=O)C4=O)=O)c3cc2)=O)OCCCC1,1 F5109-0023,O=C(c1ccccc1)Nc1c(CSC2)c2nn1C(CC1)CS1(=O)=O,1 G008-0755,CC(CC1)CCC1NC(C(CC1)CCN1S(c(cc1)cc2c1[nH]c1c2CCCCC1)(=O)=O)=O,1 F2617-1234,CCOC(COC1=COC(CN(CC2)CCN2c2cccc(Cl)c2)=CC1=O)=O,1 F6681-9380,Cc(cn1)cnc1OCC1CN(CCc2ccccc2)CCC1,1 Z2915929492,O[C@@H](CS(C1)(=O)=O)[C@H]1NC(CCc1c(-c2ccccc2)[nH]c2c1cccc2)=O,0 F6357-1966,CC(C)(CNC(Nc(cccc1)c1Cl)=O)c1cscc1,0 F6473-4022,Cc1cc(C(N(C2)CC2N(C(C2C3CC=CC2)=O)C3=O)=O)c(C)o1,1 Y043-8435,O=C(CC(c1cscc1)n1cccc1)Nc1nc(CCC2)c2s1,1 F6519-5837,CS(N(CC1)CCC1C(NCC(c1ccco1)n1nccc1)=O)(=O)=O,1 F6782-7707,CC#CCN(C=CN(c(cc1)cc(Cl)c1F)C1=O)C1=O,0 S633-7524,O=S(c(cc1)cc2c1OCCO2)(N(C1)CC1c1noc(C2N(CC3CC3)CCC2)n1)=O,1 Z3539871306,CC(CC1)(CCN1C(Cn(cc1)c(cc2)c1cc2F)=O)O,0 E786-2093,CN(Cc1ccccc1)S(c1c(CN(C(c2c3nccc2)=O)C3=O)ccc(F)c1)(=O)=O,1 F6818-0685,CC(C)(C)c(nc1C)nc(N(CC2)CCN2c2nnc(C(F)(F)F)cc2)c1F,0 F6169-0137,O=C(CN(C(C=C1)=O)N=C1n1nccc1)NCCc1c[nH]c2c1cccc2,1 L934-0097,O=C(c(cccc1)c1Br)Nc1nnc(C(CC2=O)CN2c2ccccc2)o1,0 Z2906225572,O=C(c1ccnn1C1CC1)NCCc1c[nH]c(cc2)c1cc2Cl,0 F6559-0979,O=C(c(cccc1)c1OC(F)(F)F)N(CC1)CCC1N(C1=O)N=Nc2c1scc2,0 SC04-0944,CCn1nccc1C(N(CCC1)CC1OCCc1noc(COC)n1)=O,1 F6561-1747,Cc1cc(C(N(C2)CC2OCC2COCC2)=O)c(C)o1,0 F6488-2587,CN(C)c1cncc(OC(CC2)CN2C(Cc(cccc2)c2F)=O)n1,0 F6480-5398,O=C(c(ccc(F)c1)c1F)N(CCC1)CC1Oc1ncncc1,0 S664-0221,Cc1ccc(CNC(N(CC2)CCC2(CC2)C2OC)=O)cc1,1 F5791-2197,COc(cccc1)c1-c1cc(C(Nc2cccc(OC(F)F)c2)=O)n[nH]1,0 Z2982471702,CCc1c(CS(c2nc(C)cc(C)c2)(=O)=O)c(C)no1,0 Z642518220,CC(C)(C)NC(NCc1cccc(CN(CCC2)C2=O)c1)=O,0 Y040-9166,CC(C)c1cc(C(NC2CC2)=O)c(c(C)nn2C)c2n1,1 E684-0743,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(N(CC1)CCC1C(NCCc1c(C)ccs1)=O)(=O)=O,1 F6064-3380,CCOC(c(cccc1)c1NC(CN(C1)CC1c1nc(-c2cccc(C(F)(F)F)c2)no1)=O)=O,1 Z1359848349,Cc(cc1NC(NC2(CO)CCCC2)=O)nn1-c1ncccc1,1 F3406-8077,CC(C)NC(CN(C1=O)N=C2N1C(c1ccc(C(F)(F)F)cc1)=NC(C)=C2)=O,1 F6445-2393,O=C(Cc(cccc1)c1Cl)N(CC1)c(cc2)c1cc2-c1ccncc1,1 L164-0591,CC(C)c(cc1)ccc1S(Nc1ccc(C2(CC2)C(NCCN2CCOCC2)=O)cc1)(=O)=O,0 SC55-0665,Cc1n[nH]c(C2C3(CN(Cc(ccnc4)c4F)C3)CN(Cc3ccccc3)C2)n1,1 Z1928118213,CCc(cccc1)c1N(CC(C1)C(N2c3c[nH]nc3CCC2)=O)C1=O,1 F6761-7585,Cc1nc2ccccc2nc1N(CC1)C(C2)C1CN2c(cc1)ncc1C#N,0 F5937-0184,O=C(C(CC1=O)CN1c(cc1)ccc1F)NCCCn1cccc1,1 Z2256304999,CN(C(Cc1ccccc1)C(O)=O)C(CCOC)=O,0 F6451-1246,CC(C)S(c1ccc(CC(NCC(c2cc(F)ccc2)OC)=O)cc1)(=O)=O,0 F2006-0203,Cc1c(-c(cc2)nnc2SCc(c(F)ccc2)c2Cl)sc(C)n1,1 5408-1115,Cc(cc1)c(C)cc1NS(c(cc1)cc([C@H]2C=CC[C@@H]22)c1N[C@@H]2c1cccc(Cl)c1)(=O)=O,0 Z1690235590,CS(C(CCC1)CN1C(CCN1c2cccc(Cl)c2)C1=O)(=O)=O,1 F6557-2020,O=C(c1noc2c1CCCC2)N(CCC1c(cccc2)c2Cl)CCS1(=O)=O,1 F6529-2022,CN(C(CN1C(CC2)CCN2S(c2ccc(C(F)(F)F)cc2)(=O)=O)=O)C1=O,0 Z1331724857,O=C(c1cccc(F)c1)N1C(Cc2ccccc2)CC1,0 Z982160462,CS(c1cc(-c2nnc3n2CCCC3)ccc1)(=O)=O,0 F6724-3978,Cc1nc2ncnn2c(NCC(c(cccc2)c2Cl)OC)c1,0 SC44-0410,Cc1noc(C)c1C(N(CC1)CCC1(C1)OCCC1OCC(N1CCOCC1)=O)=O,1 SB03-0400,CN(CCN(C1CCOCC1)C(CCC1)CN1C(C1CC1)=O)C(CCn1cncc1)=O,0 F2024-1639,O=C(NC(CC1=O)CN1c1cccc(F)c1)Nc1cc(C(F)(F)F)ccc1,0 F6571-6702,O=S(c(cc1)ccc1-n1nccc1)(NCC1CCN(CC(F)(F)F)CC1)=O,1 F6795-5081,Cc1nc(CN2CCC(COc3nc(C4CC4)nc(C)c3C)CC2)co1,1 F6523-0652,O=C(C1(CCCC1)c1cccs1)NC(CC1)CCN1c1ncnc2c1CCCC2,1 Z1928161319,Cc(n(-c(cc1)ccc1Br)nc1)c1C(NCCC(NO1)=NC1=O)=O,0 T853-0352,CC(C)N(CC1)CCN1C(C1(CCC(N2C3CCCC3)=O)C2=CCCC1)=O,1 SA55-2458,COCCn1nc(CCNC(C2(CC2)c(cc2)ccc2OC)=O)c2c1CCOC2,1 Z2055648667,CCc1csc(NC(N(CCC2)C2C2OCCC2)=O)n1,1 Z1247423054,Cc(cc(cc1)F)c1S(N(CC1)CCC1OC1CCOCC1)(=O)=O,1 Z4095556638,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(C(CN1)c(cccc2)c2C1=O)=O,1 F6805-5326,Cc1cc(CN(CCC2)CC2N(C)c2ncc(C)cn2)no1,1 F6445-0231,CC(c(cc1)ccc1NC(c1cc(Oc2ncccc2)ccc1)=O)=O,0 F6506-2222,CN(C)c1cccc(C(NCC(c2cscc2)(c2cccs2)O)=O)c1,0 F6554-9040,O=C(c(cccc1)c1OC(F)(F)F)N(CC1C2)C2CS1(=O)=O,0 F5600-0206,CC(C)(C(Nc(cc1)ccc1Nc1nnc(C)cc1)=O)Oc(cc1)ccc1Cl,1 Z2943425353,CC(CN)(C1CC1)NC(c1nn(C)c(C(F)F)c1)=O,0 F3406-5687,CC(CCC1)CN1C(C1=NN2CC(Nc(ccc(Br)c3)c3F)=O)=NC=CN1C2=O,1 S576-0107,Cn1c(cccc2)c2nc1CCNC(C(CC1)CN1C(C=NN1)=CC1=O)=O,1 Z2444602808,OC(c1cc(Cl)c(N(C2)CC2S(NC2CCCC2)(=O)=O)nc1)=O,1 F6485-2000,Cc1nc(OC(CC2)CCC2NC(CN(C)S(C)(=O)=O)=O)nc(C)c1,0 P053-3106,Cc(cccc1)c1N(CC1)CCN1C(c1csc(C(NC2CC2)=O)n1)=O,0 Z1129699670,Cc1cccnc1CNC(CCC(N1)=Nc(cccc2)c2C1=O)=O,0 Z3071533763,CN(CCC1)[C@@H]1C(Nc1cccc(CN=S2(CCCC2)=O)c1)=O,1 Z2959097900,Cc(c(C(NCC(C(N)=O)O)=O)c(cc1)F)c1Br,0 Z738438656,Cc1noc(C)c1S(Nc(cc(cc1)N(CCC2)C2=O)c1F)(=O)=O,0 F0913-1614,Cc1cc(Cl)cc(Cl)c1OCC(Nc1c(C)c(-c2nc(nccc3)c3o2)ccc1)=O,1 D676-5026,COc1ccc(C2(CC2)C(N2CCN(Cc3noc(-c4cccc(Cl)c4)n3)CC2)=O)cc1,0 SB03-0103,CC(C)n1ncc(CN(C)CCN(C2CCOCC2)C(CCC2)CN2S(C)(=O)=O)c1,0 F5033-7511,COc(cccc1)c1NC(N1CCC(CNC(c2c(C(F)(F)F)cccc2)=O)CC1)=O,0 F5831-6645,O=C(NCC1CCN(Cc2ccccc2)CC1)NC1CC1,1 Z1952852839,CC(c1nc(cc(cc2)OC)c2[nH]1)NC(c1c(Cc2ccccc2)n(C)nc1)=O,0 F6494-0511,COc1cc(C(NCCC(c2ccccc2)c2ccccc2)=O)ncn1,1 Z1983229160,FC(Cn1c(SCc2ncnn2-c2ccccc2)ncc1-c1ccccc1)(F)F,1 Y031-5196,Cc1cc(N(CC(C2)C(Nc(cc3)ncc3Cl)=O)C2=O)cc(C)c1,0 F6233-0160,CN(C1=O)N=NN1c(cc1)ccc1NC(Cc(cccc1)c1Cl)=O,0 Z1869871895,OC(C(C1)OCCN1C(c1cccc(OCC(F)(F)F)n1)=O)=O,0 SA44-0543,CC(C)Cc1nnc(C2N(C)CC(C3)(CN3C(c3ncc(C)nc3)=O)C2)o1,0 CM4582-2584,O=C(Nc(ccc(Cl)c1)c1F)N(CC1)CCC1N(C1)[C@H](COCC2CC2)CC1(F)F,0 G499-0074,O=C(c1ccco1)N(CC1)CCC11OCCN1S(c(cc1)ccc1F)(=O)=O,1 F6090-0013,COc(cc1)nnc1C(NCc(cc1)cc2c1OCO2)=O,1 Z1533752616,O=C(c(cc(cc1)N(CCC2)C2=O)c1Cl)N(CC1)CCC1N(CCC1)C1=O,1 G373-2848,O=C(NCCn1nnc2c1ccc(S(N1CCCC1)(=O)=O)c2)Nc(ccc(Br)c1)c1F,0 SA63-0777,CS(NCCC1CC(CC2)(CCN2C2CCC2)OCC1)(=O)=O,1 F6573-9286,O=C(c1cccs1)NCc1nccnc1-c1ccncc1,1 F6804-8579,FC(C1CCN(CCc(cc2)cc3c2OCC3)CC1)(F)F,0 C094-1600,CC(CCC1)CN1C(C(NC1CCCCC1)=O)c1ccc(C)cc1,1 Y040-1687,CCC1N(Cc(c(O)c2C)cc(-c3c4cccc3)c2OC4=O)CCCC1,1 Z1155867073,CC(C)NC1CCN(CC(NC2C3CC(C4)CC2CC4C3)=O)CC1,0 Z2768783906,CC(C)c(ccc(C)c1)c1OCc1nnc(CC2)n1CC2C(OC)=O,0 Z1134893179,CC(C)(C1)Oc2c1cc(C(C(C(Nc(cc(cc1)OC)c1OC)=O)=C(C)N1)NC1=O)cc2,1 F0326-1183,Cc(cccc1)c1-c1nnc(NC(COc(cc2)ccc2Cl)=O)s1,1 Y041-7123,O=C(C(CCC1)CN1c1ncccn1)NCCSc(cc1)ccc1Cl,1 F3406-2096,CCc1nc2ccccc2c(OCC(NCc(cc2)ccc2F)=O)n1,0 D294-3826,COc1ccc(CCC(Nc2nnc(C(CC3=O)CN3c(cc3)ccc3Cl)s2)=O)cc1,1 F6178-7855,O=C(C(Nc(cc1)cc(Cl)c1F)=O)NCC(CC1)CCN1C1CSCC1,0 F5075-4357,CC(N=C(C=CC=C1)N1C1=O)=C1NC(COc1cccc(C(F)(F)F)c1)=O,0 K786-2585,O=C(CN1c(cc(cc2)Cl)c2OCC1=O)NCCCN1CCOCC1,1 Z2718531265,O=C([C@@H](CCC1)NC1=O)NC(C1CCC1)c1ncccc1,1 F3342-0142,Cc1cc(C)nn1CC(CN(c(cc1)ccc1OC)S(c1ccc(C)cc1)(=O)=O)O,1 Z1686439271,O=S1(CC(Cc2nc(-c3nc(OCC(F)F)ccc3)no2)CC1)=O,1 SA58-0776,O=C(C1(CC1)c1ccccc1)N1C(CCc2noc(-c3ccncc3)n2)CCC1,1 Z1601865017,CC(c(ccc(F)c1)c1Cl)NC(NC1CCOCCC1)=O,0 F6512-1813,O=C(c1nc2ccccc2nc1)NCc1nc(C2CCCCC2)cs1,1 Z3215989148,CCC(CC)C(N(CCO)Cc1cc(Br)cnc1)=O,0 Z2607626294,COc1cc(CCCC2NC(C3(CCC3)C(O)=O)=O)c2cc1,0 F5832-0238,COc1ccc(C2(CNS(c3cnccc3)(=O)=O)CCCC2)cc1,1 F6539-2303,CN(C)S(N1CCC(CNS(c2ccccc2)(=O)=O)CC1)(=O)=O,0 D034-0216,O=C(CN(C(c1c2cccc1)=O)S2(=O)=O)Nc(cc1)ccc1S(N1CCOCC1)(=O)=O,1 Z237330814,Cc(ccc(S(Nc1c(C)cccc1)(=O)=O)c1)c1C(N(CC1)CCC1c(cc1)ccc1O)=O,1 S497-1282,COCCc1noc(-c(cccc2)c2OC(C2)CN2C(C2(CC2)c(cc2)ccc2OC)=O)n1,1 Z2274102979,O=S(CC1)(CC1(CCC1)CN1c1c(cc(cc2)Cl)c2ncc1)=O,0 SD25-0537,Cn1cnc(S(N2CC3(CCCCC3)C(CCC(N3CCOCC3)=O)C2)(=O)=O)c1,1 F6544-1429,Cn1c(N(CC2)CCN2C(NC2CCCC2)=O)ncc1,1 L127-0008,O=C1N(CCCN(CCS(N2CCNCC2)(=O)=O)S(c2cccs2)(=O)=O)CCC1,1 Z1560062900,O[C@@H](Cc1c2cccc1)[C@@H]2NC(c1cc(-c2ncn[nH]2)ccc1)=O,0 Z3004800544,O=C(C[C@@H]1NCCC1)Nc(c1cccnc11)ccc1Cl,1 F6404-4286,CCOC(C(CCC1)CN1C(c1cc(OC)no1)=O)=O,0 V030-9207,O=C(CN(c(cccc1)c1C(N1c(cc2)cc(Cl)c2F)=O)C1=O)NC1CC1,0 Z2437516756,OC(c(ccc(Cl)c1)c1S(N(CCC1)CC1n1nncc1)(=O)=O)=O,0 Z2950344975,C[C@](CN(C)C1)(C2)[C@H]1CN2C(Nc1cn(-c2ccccc2)nc1C)=O,1 8019-8848,O=C(NCC1Oc(cccc2)c2OC1)NC1CCCCC1,1 F5234-0203,Cc1cccc(Nc(cc2)nnc2N(CC2)CCN2C(Cc2cccs2)=O)n1,1 Z7987718969,O[C@@H](CC(Cn1cncc1)C1)[C@H]1NCc(cc1)ccc1OCc(cccc1)c1F,1 Z2973757633,C(C1(COCC2)N2CCOC1)Nc1nccnc1,1 F6262-3326,COc1c(COc2cc(NC(COc(cccc3)c3Cl)=O)ncn2)cccc1,1 Z2955026195,CC[C@@H]1N(Cc2nc(-c(cc3)cc(C)c3F)no2)CCCNC1=O,0 F6374-0105,O=C(CSCc1ccccc1)N1CCC(CSc2ncccc2)CC1,1 Z3184009285,CN(CCn1ncc(C(NCCc2ccccc2)=O)c11)S1(=O)=O,1 Z2034708268,Cc1nc(S(N(CC2)CCN2S(NC)(=O)=O)(=O)=O)cn1C,0 G115-0174,Cc1noc(-c2cc(S(N(CC3)CCN3c(cc3)nnc3N3CCOCC3)(=O)=O)c(C)cc2)c1,1 F6743-6383,Cc(nc1N(CC2)CCC2N(C)S(C2CC2)(=O)=O)ccc1C#N,0 F6658-6170,Cc1cc(OCC(CC2)CCN2C(c2c[nH]c3c2cccn3)=O)ncn1,1 F6514-8864,O=C(Cc1cscc1)NCc1cc(-c2cnccc2)ncc1,1 Z3344694658,Cc1nc(C(N(CC2)CCN2c2c3nc[nH]c3ccc2)=O)no1,1 E684-0610,CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(N(CC1)CCC1C(Nc(cc1)ccc1C(C)=O)=O)(=O)=O,0 Z4996441609,O=C(C(c1ncccc1)N(Cc1ccccc1)C(c1ccccc1)=O)NC1CCCC1,1 F6412-1657,CN(C=CC=C1C(NCC#CCOc2cccc(C(F)(F)F)c2)=O)C1=O,0 SA87-0683,CC(C)CCNC(NCC(CN1CC(C)C)OCC1=O)=O,0 Z1141330563,O=C(NCCc1cnccc1)N1CC(Cc2ccccc2)CCC1,1 Z1413723041,Cc1c(C(N(CC2CC(O)=O)c3c2cccc3)=O)c(C)nn1C,0 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F6481-2900,O=C(CSc1nc(cccc2)c2o1)N(CC1)CCSC1c(cc(cc1)F)c1F,1 F6374-1797,COc(cc1)ccc1SCC(CC1)CCN1C(NCc(cc1)ccc1F)=O,1 V006-5481,CC(C(C)(C)C)NC(c1cc(CCc(cc2)c-3cc2OC)c3s1)=O,0 Z1929656142,O=C(c(cc(cc1)N(CCN2)C2=O)c1Cl)N(C1)CN(CC2CC2)C1=O,1 Z1373155520,O=C(NCCN(c(cccc1)c1N1)C1=O)N1CCN(Cc(cc2)cc3c2OCCO3)CC1,1 Z1705192150,CSc1c(CC(N(CC2)CCN2S(c2nnc[nH]2)(=O)=O)=O)cccc1,0 Z729567782,CC(Nc1cccc2c1CCCN2C(Cc(cccc1)c1F)=O)=O,0 Z3504324952,CCCCC(C)C(NS(c1cncc(OC)c1)(=O)=O)=O,0 Z1360268086,NC(c1cc(OCCC(N(CC2)CCC2c2c[nH]c3c2cccn3)=O)ccc1)=O,1 SC73-0470,CC(C)NC(c1nn(C)c2c1COC(CC1)(CCN1C(c1cc(C)nn1C)=O)C2)=O,1 S963-3381,Cc1c(C(N[C@@H](CN(Cc2cnccc2)C2)[C@H]2C(NC)=O)=O)occ1,0 SD12-0069,Cc1noc(CC(C(NCC2)=O)N2C(CCC2CCCCC2)=O)n1,1 F6477-0251,O=C(Cc(cccc1)c1Cl)N(CC1)CCN1c1nc(-c2cscc2)cs1,1 Z1762707781,CN(CC(C1)OCCN1C(c(cc(cc1)Cl)c1Cl)=O)CC(O)=O,0 Y300-0555,CS(N(CCC1)CC1C(N(CCC1)c2c1cccc2)=O)(=O)=O,1 SC72-0476,Cn1cnc(S(N(C2)CC22OCc3c2cnc(C2CCCCC2)n3)(=O)=O)c1,1 F1317-0051,CC(C(N1)=O)=NN=C1SC/C=C/c1ccccc1,1 Z2482974285,OC(C(c(cc1)ccc1F)N(CCC1)CC1n1ncnc1)=O,0 Z3104068362,O=C(NCc1nn(Cc2ccccc2)cc1)N(CCC1)[C@@H]1C(F)F,0 F5097-2440,Cc1cc(C(Nc2ccc(CC(NCC(F)(F)F)=O)cc2)=O)c(C)o1,0 F3394-0238,O=S(c1cccc(Cl)c1)(NCc1ncccc1)=O,0 Z1607900990,CCS(c1ccc(CNC(N(CCC2)CC2c2nc(C)no2)=O)cc1)(=O)=O,0 F6497-8086,CC(C(N(CC1)CCC1c1n[nH]c(C(NCC(F)(F)F)=O)c1)=O)n1nccc1,1 F0818-0025,O=C(c1ccco1)N1CCN(CCN(C(c2c3c4cccc3ccc2)=O)C4=O)CC1,1 Y206-8366,CC(CC1)Cc2c1sc(C(Nc(cc1)cc3c1OCCO3)=O)c2,1 F5791-3504,Cn1nnc(C(NCc(cccc2)c2Cl)=O)c1,0 V016-8452,CC(C(N(Cc(cc1)ccc1F)C1)=O)Oc(cc2)c1cc2NS(c(cc1)ccc1F)(=O)=O,0 Z1304568107,CC(C(OCC(NC(N1)=O)=CC1=O)=O)c1c(C(F)(F)F)cccc1,0 SB99-0499,Cn1nc(CCC(N2CCCC2)=O)c(C2)c1CCN2C(c1nccnc1)=O,1 F6561-6732,Cn1ncc(-c2c(CNC(Nc3cccc(Cl)c3)=O)cccn2)c1,1 Z2898302775,O=C(c1nnc(-c2cscn2)o1)NC1CC1,1 F6679-2494,O=C(c1noc(-c2ccccc2)c1)N(CC1)CC1Oc(ccnc1)c1Br,1 F2024-0259,CC(c(cc1OC)c(CC2)cc1OC)N2C(NC(CC1=O)CN1c1ccccc1)=O,1 F6734-2554,O=C(c1ccncc1)N(C1)CC(C2)C1CN2c(cc1)nnc1-c1ccccc1,1 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F6796-3689,Fc1c(N(CC2)CCN2c(cc2)nn3c2ncc3)ncnc1,0 Z1132947899,CC(c(cc1)ccc1NC(N)=O)NC(NC(C)c1cccc(N(CCO2)C2=O)c1)=O,1 L661-0636,O=C(c1cccc(Oc2ccnc(-c(cc3)ccc3F)n2)c1)NCc(cc1)ccc1F,1 D051-0149,Cc1ccc(CN(C(CC2)CS2(=O)=O)C(COc2cc(C)ccc2)=O)o1,0 Z1126890179,Cn(c(C(N1CCC(CS(N)(=O)=O)CC1)=O)c1)c2c1cccc2,0 SD14-0009,CN(CC(N[C@@H]1[C@H]2CN(Cc3cc(OC)ccc3)CC1)=O)C2=O,0 Z2181825984,Clc1ccc([C@@H]2OCCN(Cc3ccccc3)C2)cc1,0 J046-0815,CC(C(Nc(cccc1)c1Cl)=O)N(C(C(NC(c1ccccc1)=O)=C1)=O)N=C1c1ccccc1,1 F2282-0110,O=C(C1(CCCC1)c(cc1)ccc1Cl)NCCS(N(CC1)Cc2c1cccc2)(=O)=O,1 Z2610924361,Cc1c(C(O)=O)oc(S(NCCOc2cc(C)ccc2)(=O)=O)c1,0 Z415741924,CC(C)(C)n(c(N)c1)nc1-c1ccccc1,0 Z1956079466,OC(c(cc1)nn1-c1cccc(CNC(C(CC2)CS2(=O)=O)=O)c1)=O,1 F6190-0097,CSc1ncccc1C(NCCC(C1CC1)O)=O,1 Y031-4595,CC(C)c1nnc(NC(C(CC2)CCN2C(C(CC2=O)CN2c2ccc(C)cc2)=O)=O)s1,0 Z1203965244,O=C([C@H]1[C@H](CC2)O[C@H]2C1)Nc1nncs1,0 F6200-0881,Cc(cc1)cc(NC(C(NCC2(CCOCC2)O)=O)=O)c1OC,0 Z3077990423,Cc1nc(N(C)Cc2cc(OC)ns2)nc(OC)c1,0 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Z1274442650,CC(CC(C1)c(cc2)ccc2OC)N1C(Cn1c(-c2c(C)ncs2)nc2c1cccc2)=O,1 F6443-6583,O=C(COc(cc1)ccc1F)NCC(CCC1)N1c1nccs1,1 L886-0239,Cn1c(SC)nnc1-c1nn(C)c(CC2)c1CN2C(c(c(F)ccc1)c1F)=O,0 3472-2243,OC(CCC1)c2c1c(cc(cc1)Cl)c1n2CCN(Cc1ccccc1)Cc1ccccc1,1 SA55-2592,COCCn1nc(CCNC(C2Oc(cccc3)c3OC2)=O)c2c1CCOC2,1 F0214-0113,O=C(c1ccco1)Nc1nc(-c2c(CC3)cccc2)c3s1,1 Z1781383362,O=C(NCCN(CC1)Cc2c1cccc2)NC(c1nnc[nH]1)c1cccc(C(F)(F)F)c1,1 J079-0941,CCc(cc1)cc(C(CN2CCN(CC(N3c(cc(C)cc4)c4OCC3)=O)CC2)=C2)c1OC2=O,1 SA58-0554,CC(C)C(N1C(CCc2noc(C3CC3)n2)CCC1)=O,1 F2871-0062,O=C(C(c1ccccc1)c1ccccc1)NCCOc(cc1)nnc1-c1ccco1,1 Z1444392181,OC(C(C1)(Cc2c1cccc2)NC(COc(cc(cc1)Cl)c1Cl)=O)=O,0 F1443-3602,CN(Cc1ccccc1)S(c(cc1)ccc1N(C(c1c2cccc1)=O)C2=O)(=O)=O,1 SA66-0609,COc1ccc(C2(CC2)C(N2CC(CCc3noc(-c4cnccc4)n3)CCC2)=O)cc1,1 F6195-6132,Cn1c(cccc2)c2c(CC(Nc2nc(CCN(C3)S(C4CC4)(=O)=O)c3s2)=O)c1,1 Z4947194610,CCOC(c1c(cc(cc2)NC(C(C)Oc(cccc3)c3Br)=O)n2nc1)=O,0 C260-2279,O=C(Cc(cc1)ccc1N(C(c(cccc1)c1N1CC(N=C2N3C=CC=C2)=CC3=O)=O)C1=O)NC1CCCC1,1 F6619-5678,Cc1ccnc(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)n1,0 Z2850086720,Cc1nn2c(N(CCC3)C3c(cc3)ccc3Cl)cc(C)nc2n1,0 Z1495967903,CCC(CC)(CNc1c2sccc2ncn1)C(O)=O,0 F6430-0865,Cc1cc(C)nn1-c1cc(NC(C2CC=CCC2)=O)ncn1,1 Z2700070075,N[C@@H](CN(C1)S(CCC(F)(F)F)(=O)=O)[C@H]1c(cccc1)c1F,0 Z4515318158,O=S(c(c(F)ccc1)c1F)(N(CC1)C[C@H]1Oc(cc1)ccc1F)=O,0 F2481-1038,O=C(CC(CSC1=Nc2c3cnn2-c2cccc(Cl)c2)N1C3=O)NCc1ccco1,1 Z3495650037,FC(C1CCNCC1)c1nc(-c(cc2)cc3c2OCO3)no1,1 F6111-0733,CC(c1cccc(S(N2CCC(COCc3cc(OC)cc(OC)c3)CC2)(=O)=O)c1)=O,0 Z3216001363,CC(C)n(c(C)c1)nc1NC(CS(CCC(F)(F)F)(=O)=O)=O,0 SB52-1210,Cc(cc1)c(C)cc1NC(N1CCC(C2)(CN(C)C2c2noc(C3CCC3)n2)CC1)=O,0 Z1223862953,CC(C)(C1)OCCCN1C(Nc1cc(C(NC)=O)ccc1)=O,1 F669-0040,CC(N(C)C(N(C)C1=O)=O)=C1N(CC1)CCN1S(c1cccc2nsnc12)(=O)=O,1 SD61-0677,O=C(C(C1)C2(CCC2)CN1C(c1ccncc1)=O)NCC1CC1,0 Z280322936,CCN(CC)S(c(cc1)cc(CC2)c1N2C(C(C1)c(ccc(F)c2)c2NC1=O)=O)(=O)=O,1 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SA93-0405,NC(C(CC1CC1)(CCC1)CN1S(c1cc(CCCC2)c2cc1)(=O)=O)=O,0 Z1944145935,CNC(c1cc(cc(cc2)NC(C(CCN3)CC3=O)=O)c2[nH]1)=O,0 F5005-0241,CCN(CC1)CCN1S(CCNC(CCc(cc1)ccc1OC)=O)(=O)=O,0 F6225-0079,CN(CC(NCc1cccs1)=O)c1nc(cccc2)c2s1,0 K505-0247,Cc(cc(cc1)N(C(/C=C/c2cc(C(F)(F)F)ccc2)=Nc2c3cccc2)C3=O)c1Br,0 Z838103880,CCc1nc2ncnn2c(NCC(COc2c(C)cccc2C)O)c1,0 SB73-0476,CCN(CCNC([C@H](C[C@@]1(CC2)CN2C(C(C)C)=O)NC1=O)=O)Cc1ccccc1,0 F6481-0353,O=C(c1cc(Br)cs1)N(CC1)CCSC1c1ccccc1,0 F6521-4057,CC(CNC(C(Nc1cccc(C(F)(F)F)c1)=O)=O)(c1cc(cccc2)c2o1)O,0 F6523-0444,O=C(c1cccc(OC(F)(F)F)c1)N(CC1)CCN1c1ncnc(C(F)(F)F)c1,0 F6713-6633,N#Cc(cc1)ncc1N(CC1)CCN1c1nnc(C2CC2)cc1,0 F6480-3740,CC(C)=CC(N(CCC1)CC1Oc(nc1)ncc1F)=O,0 SD62-0423,O=C(CCC(C1)C2(CCC2)CN1C(C1CCC1)=O)N1CCOCC1,0 Z1957309483,Cc1cc(-c2csc(NC(C(CC3)CC3(F)F)=O)n2)c(C)o1,0 M739-0650,CC(C)NC(c(cc1)ccc1OCC(CCC1)N1C(C1CCCCC1)=O)=O,0 Z2293152196,O=C(N[C@H](C1)C[C@@H]1c(cccc1)c1Cl)NC1CC(c2ccncc2)OCC1,0 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SC74-0524,CC(C)NC([C@H](C[C@H]1c2nc(-c3ccccc3)no2)C[C@@H]1NC(c1c(C)ccs1)=O)=O,0 S595-0708,O=S(c1cccc2nsnc12)(N(CCCC1)C1c1noc(COCC2CC2)n1)=O,0 Z1744189554,CCNS(c1cccc2c(C)ccnc12)(=O)=O,0 Z2998027461,C(CN[C@H]1CCCC2)[C@@]12c1nc(-c2ncncc2)no1,0 Z1950333948,CCC(CC1)CCN1C(c1csc(C(F)(F)F)n1)=O,0 F6064-5313,COc1c(Cc2noc(C(C3)CN3C(C(CC3)CCN3S(C)(=O)=O)=O)n2)cccc1,0 Z131516416,CC(c1nnc2n1cccc2)NC(c1cccc(C(F)(F)F)c1)=O,0 Y040-5875,O=C(c(cc1)cc2c1nc(NS(c(cc1)ccc1F)(=O)=O)s2)N(CCN1)CC1=O,0 S970-0441,COc(cc1)cc(CC(N(CC(C2)(F)F)[C@@H]2c2nncn2CC2CC2)=O)c1OC,0 Z2770801155,Cc1cc(C#N)cc(Oc2c3OCCCc3ccc2)n1,0 F6713-5673,CC(C)(C)c1cc(N(CC2)CCN2c(nc2)ncc2Cl)ncn1,0 G786-2319,CN(CC1)Cc2c1c(-c1nc(cccc3)c3s1)c(NC(c1cc(C(F)(F)F)ccc1)=O)s2,0 S687-1987,COc1ccc(C2(CC2)C(N(CC2)CCC22OCCC(Cc3nc(-c4cnccc4)no3)C2)=O)cc1,0 SD12-1186,O=C1NCCN(C2CCC2)C1Cc1nc(-c2ccccc2)no1,0 Z2222946623,O=C(c(cc(cc1)F)c1Cl)NCCc1nnc(-c2ccccc2)o1,0 F2517-1281,O=C(Cc(cccc1)c1Cl)Nc1nnc(COc2ccccc2)o1,0 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Z1316668022,CC(N(CCC1)c(cc2)c1cc2S(NC(C1)C=CC1C(O)=O)(=O)=O)=O,0 F5088-0564,CCOc1ccc(CC(N(CC2)CCN2c(cc2)nnc2-c(cc2)ccc2F)=O)cc1,0 Z2285653503,FCC1(CCOCC1)c1nc(-c2c(cc[nH]3)c3ccc2)no1,0 Y040-5744,C1(N[C@@H](C(Nc2c1cccc2)=O)CCC(=O)NCCc1c[nH]c2c1cccc2)=O,0 FF01-2381,OC(C(CCC1)N1c1nnc(N(CCC2)C2=O)s1)=O,0 Z856098638,Cc(cc1)cc(-n(cc2)nc2C(N(C)CC(Nc2cccc(Cl)c2)=O)=O)c1OC,0 Z3616598296,CC(C)(C)C(CC1)CNC1C(OC)=O,0 SD02-1385,CC(C)c1nnc(C(C2)N(CC(N3CCOCC3)=O)CC22CCN(Cc3c(C)ncs3)CC2)o1,0 Z1546218910,CC(CC(CC1)=O)C1C(NCc(cc1)cc(F)c1-n1cncc1)=O,0 F1905-8636,Cc(cc1)ccc1S(n1nc(C(F)(F)F)c2c1ccnc2)(=O)=O,0 SD01-0190,Cc1noc(C)c1C(N(CC1)Cc2c1n(CCOC)nc2-c1cocn1)=O,0 Z1613376529,CN(C1CC(CC2)N(Cc3cn4nccc4nc3)C2C1)C(c1ccccc1)=O,0 F154-0453,O=C(c1ccc(Cn2c(SCc(cc3)ccc3Cl)nc3c2cncc3)cc1)NCCC1=CCCCC1,0 SD08-0574,CN(C)C(NCc1c(COC(CCC2)(C3)CN2C(c2cscn2)=O)n3nn1)=O,0 V005-9963,CN(C)c(cc1)c(CN(CC2OCCC2)C(c2cccs2)=O)cc1NC(COCc1ccccc1)=O,0 F5860-2531,CS(N(CC1)CCN1C(CCc1cc(Oc(cc2)ccc2F)ccc1)=O)(=O)=O,0 F6786-6035,O=C(C1OCCCC1)N1CC(COc2nnc(C3CC3)cc2)CC1,0 Z4927219579,O=C(CC(CC(N1)=O)C1=O)N[C@H](Cc1c2cccc1)[C@@H]2NC(C1C2CC(C3)CC1CC3C2)=O,0 F3382-7535,Cc(cc1)cc2c1[nH]c1c2N=CN(CC(N(CC2)CCN2c2ncccc2)=O)C1=O,0 SA57-0261,O=C(Cc1cccs1)N(CC1)CCC1(C1)OCCC1Oc1nccnc1,0 D445-0323,Cc1cc(N(C(CC2)=O)S2(=O)=O)cc(C)c1S(NCc(cc1)ccc1Cl)(=O)=O,0 Z1974756731,Cc(ccn1nc2)nc1c2C(N[C@H](C1)C[C@@H]1c1cccc(Cl)c1)=O,0 S614-1165,O=C(NCCc1ccccc1)N(CCCC1)C1c1nc(CCOCC2CCOCC2)no1,0 F6682-6500,N#Cc1cc(OCC(CCC2)CN2c2ncc(C(F)(F)F)cc2)ncc1,0 S571-0371,Cc1noc(C)c1CC(NCC1(CCC(N2CC3CC3)=O)C2=CCC1)=O,0 Z738791810,CC1Oc(cccc2)c2OC1C(N(C)c(cc1)ccc1F)=O,0 Z1976632066,CC(C1OCCC1CNC(N(C)C(CCCN1c2ccccc2)C1=O)=O)=C,0 Z2311334275,CC(CCC1)CN1C(NCc1n[nH]c(C(C)(C)C)n1)=O,0 Z2965376161,CC(Cn1nccc1)(C(N)=O)NC(C1CCCCCC1)=O,0 F6443-9791,Cc(n(-c1ccccc1)nc1)c1C(NC(CC1)CN1c1ncc(C(F)(F)F)cc1)=O,0 Z1536817597,CNC(NCC(N(CCC1)CC1c1ncc[nH]1)=O)=O,0 Z2967627148,CCN(CC1)CCC1NC(N[C@@](C1)(CCCC2)[C@H]2NC1=O)=O,0 V013-4935,O=C(c(cc1)ccc1-c1cc(-c(ccc(Cl)c2)c2Cl)n[nH]1)NCc1ccccc1,0 F6472-8868,Cc(cc1)c(C)cc1NC(N(C1)CC1N(CC1)CCC1OC)=O,0 SB94-0332,O=C(COc(cc1)ccc1F)N1CCC(CN(CC(C2)C(N3CCOCC3)=O)C2=O)CC1,0 F5017-1124,Cc1cc(CN2CCC(CNS(c3cc(C(F)(F)F)ccc3)(=O)=O)CC2)c(C)o1,0 P930-1240,O=C(CC1CCCC1)N(CCC1)[C@@H]1c1nnc(-c2ccccc2)[nH]1,0 F6605-3343,Cc1cc(C)nn1-c1cc(N2CC(CN(Cc3c(C)onc3C)C3)C3C2)ncn1,0 F6571-3242,OCCOC1(CNC(Cc(cc2)ccc2F)=O)CSCC1,0 5408-3401,CC(C1)N(C(c(cc2)cc3c2snn3)=O)c2c1cccc2,0 F6523-0790,Cc1nc(CCCC2)c2c(N(CC2)CCC2NC(c2cc(cccc3)c3o2)=O)n1,0 Z1682983100,CC(C)Cc1nc(-c(cc2)ccc2Oc2ncccn2)no1,0 F6252-7779,O=C(c1c(-c(cc2)ccc2F)nn[nH]1)NCc1ncccc1,0 Z1447983996,O=C(Cc(ccc(F)c1)c1Cl)N1Cc2nnc(C(F)(F)F)n2CC1,0 Z1147589206,COC([C@@H](Cc1c[nH]c2c1cccc2)NC(C(C1)C1c(ccc(Cl)c1)c1Cl)=O)=O,0 Z2440451391,CC(C)(CNC(c(o1)ccc1Cl)=O)N,0 Z2226006360,CC(CC1)CCC1(CNC(C(CC1)Cn2c1nnc2)=O)OC,0 Z2331899370,Cc(cc1)nnc1C(N1C2(CCC2)CCC1)=O,0 F6752-5232,Cn1c(N(CC2)CCC2C(NC2CC2)=O)nc2c1nccc2,0 F6809-7511,NC(C1N(Cc(cc2)ccc2Cl)CCCC1)=O,0 SB52-0651,Cc1noc(C)c1S(N1CCC(C2)(CN(C)C2c2noc(C3CCC3)n2)CC1)(=O)=O,0 SD14-0764,CN([C@@H](CCN(Cc1nc2ccccc2cc1)C1)[C@@H]1C(N(Cc1ccccc1)C1)=O)C1=O,0 Z979673980,CC(C)(C)C(NCCNC(NC1CCN(Cc2ccncc2)CC1)=O)=O,0 V019-0460,O=C(C(C(CC1)CCN1C(C1CC1)=O)NC(c1cccs1)=O)N1CCCCC1,0 S372-1406,O=C(c1ccc(CN(C=Cn2nc(CCCC3)c3c22)C2=O)cc1)NC1CCCCC1,0 F6571-0203,CN(C)C(CNC(Cc(c(F)ccc1)c1Cl)=O)c1csc2c1cccc2,0 Z1182435470,CCc1noc(C(C)N(CC2)CCN2C(c(cccc2)c2OCC=C)=O)n1,0 K841-0250,Cc(cc1)cc(Nc2c(c(CCCC3)c3s3)c3nc(Cc3ccccc3)n2)c1OC,0 Z2304937863,CCOCC(CCCC1)N1C(Cn1nnc(-c2ccc(C)cc2)n1)=O,0 F1874-1012,Cc(cc1)cc(C)c1-n1ncc2c1ncnc2SCC(OC)=O,0 F6681-8924,Cc1noc(CN2CC(COc(nc3)ncc3Br)CCC2)n1,0 F6512-6594,O=C(Cc(ccc(F)c1)c1F)N(CCC1)CCN1S(c1c[nH]cn1)(=O)=O,0 Z3544606928,CC(C)COc1ccc(CCNC(CCCn2cccc2)=O)cc1,0 Z1263436637,OC(CN1CC(Cc2ccccc2)CC1)=O,0 Z2911172975,OC(c1nn(CC(N2[C@@H](Cc3ccccc3)COCC2)=O)cc1)=O,0 C260-3128,O=C(CN(c(cccc1)c1C(N1CCCS(C2CCCCC2)(=O)=O)=O)C1=O)NCCC1=CCCCC1,0 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F2783-1477,O=C(CCC1)N1c1cccc(NS(C2CCCCC2)(=O)=O)c1,0 6415-1038,Fc(cc1C2C=CCC22)cc(F)c1NC2c1cnccc1,0 Z1817654625,CC(CCC1)(C(O)=O)N1S(c(cc1)cc(Cl)c1C(OC)=O)(=O)=O,0 Z2217356754,CCn1nncc1C(NCc(cc1)ccc1OC)=O,0 Y031-0501,CC(C)(C)CC(C)(C)NC(CC(c1ccccc1)c1ccccc1)=O,0 Z1146572991,CCOc1cccc(N(CC2)CCN2C(Nc(ccc(F)c2)c2OC)=O)n1,0 Z2293026571,CCCc1nn(C)c(NC(N(CC2)CC(C)(C)CC2O)=O)c1,0 Z2936915995,OC(c1cnc(C(CC2)CCN2C(OC2COCC2)=O)o1)=O,0 Z2647212722,CCc1noc(CC(CC2)CCN2C(C2CC2)=O)n1,0 S558-0942,C(C1)C1c1noc(-c(cccc2)c2OC(CC2)CN2C2CCOCC2)n1,0 Z1429016132,CC(COCCNC(c([nH]c1ccc2)cc1c2F)=O)=C,0 Z4423019087,CCCCNc1nnc(-c2cccc(Br)c2)o1,0 Y020-9143,CC(C1)N(C(C2=CC(C(CC(C)(C)C3)=O)=C3NC2=O)=O)c2c1cccc2,0 Z3216015641,CCC(N(C)[C@H](C)c1cnccc1)=O,0 F5831-2683,CC(Cc1cccs1)NC(NCc(cc1)cc(OC)c1OC)=O,0 F6795-0621,Cc1c(-c(cc2)nnc2N(CC2)CCN2c2nc(cncc3)c3s2)sc(C)n1,0 F6031-2300,CC(CN(CC1)CCN1S(Cc1cc(F)ccc1)(=O)=O)O,0 F1913-5927,CC1OC2(CC(CC3)NC3C2)CN(Cc2ccccc2)C1=O,0 Z1715665388,CNC(c(cc1)ccc1S(Nc(c1ncccc11)ccc1OC)(=O)=O)=O,0 F6481-3871,O=C(Nc1cccs1)N(CC1)CCSC1c1ccco1,0 F6279-0621,OCC1(CNC(NCCOc2ccccc2)=O)CC1,0 S724-1862,CC(C(N(C1)CC1n1nnc(C(N(C)CCOC)=O)c1)=O)Oc1ccccc1,0 Z3384654673,Cc1ccc(-c2n[nH]c(C(N(C3)CC4(CN)C3CCCC4)=O)c2)o1,0 S069-4465,COc(cc1)ccc1S(N(CC1)CC1c1noc(-c2ccncc2)n1)(=O)=O,0 F6415-1163,O=C(NCc1cccc2ccccc12)N(Cc1cocc1)Cc1cccs1,0 F6261-1925,Cc1cc(C)nn1C(C=C1)=NN(CC(NCc2c(C)nc(-c3c(C)cccc3)s2)=O)C1=O,0 D074-0533,OCCN(C(c1c2[nH]nc1-c(cccc1)c1O)c(cc1)ccc1OCc1ccccc1)C2=O,0 Z1188576641,CCOc(cc1)cc(CCC2)c1N2C(c(cc1)cnc1Oc1ccccc1)=O,0 Z648314932,O=C(c(cc1)cc(CC(c2ccccc2)O2)c1C2=O)NC1CCN(CCc2ccccc2)CC1,0 S212-1208,COCC(N(CCC1)CC1OCc1nc(-c2nccnc2)no1)=O,0 S954-0028,NC([C@@H](CN(C1)C(C2CCC2)=O)[C@H]1C(CC1)CCN1c(cc1)cc(C(F)(F)F)c1C#N)=O,0 F6495-4134,O=C(C(C1)CN1c1ncnc(-c2ccccc2)c1)NC(CCC1)c2c1cccc2,0 Z1172100173,O=C(c(cc1)ncc1Br)NC(CCC1)CS1(=O)=O,0 F6475-2517,Cn1c(SCCNC(c2cc(OCCOC)ncc2)=O)nnc1,0 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F6443-5308,O=C(Nc(cc1)cc(Cl)c1Cl)N(CCC1)CC1(c1c2cccc1)OC2=O,0 G856-9116,O=C(CN(C(CC1)=O)C1=O)N(CC1)CCN1c1nc(c(F)ccc2)c2s1,0 S858-2525,CC1(CC1)C(N1C[C@](CO)(CN(Cc2ccccc2)C2)[C@H]2CC1)=O,0 F5269-0247,O=C(c1csc2nc(-c3ccccc3)cn12)NCc1ccco1,0 V029-5156,CCc1cccc2c1[nH]cc2C(CC(N1CCN(CC)CC1)=O)c(cccc1)c1F,0 Z3216017358,O=C(NC1CCC1)Nc(c(Br)n1)ccc1F,0 S651-0576,Cc1c(C(N2CCC(C3)(CN(C)C3C(N3CCOCC3)=O)CC2)=O)sc(C)n1,0 F5033-0135,CC(C)N1CCC(CNC(c2cccc(F)c2)=O)CC1,0 Z1251528503,CN(CCC1)c(ccc(F)c2)c2N1C(Cc1cc(F)ccc1)=O,0 F0636-0322,CC(N12)=CSC2=NC=C(C(Nc(cc(cc2)F)c2F)=O)C1=O,0 Z3086675075,CC(C)c1c(C(Nc2c(C)cncc2C)=O)nco1,0 Z1625635225,O=C(c([nH]c1c2cccc1)c2Cl)N1CC(c(cc2)ccc2F)=CC1,0 8017-6818,CC(c(cc1)ccc1-n1cncc1)N(C(C1C2CC(C)=CC1)=O)C2=O,0 Z4408190287,CC(C(NS(C)(=O)=O)=O)c(cc1)cc(F)c1-c1cc(Cl)cc(F)c1Cl,0 F6559-0459,O=C(c1ccco1)N(CCC1)CC1N(C=Nc1c2cccc1)C2=O,0 Z3019348565,NC(CCc(cc(cc1)C(NCC2(CC2)c2ccccc2)=O)c1N1)C1=O,0 SA66-1219,O=C(c1ccc(Cn2cncc2)o1)N1CC(CCc2noc(C3CCOCC3)n2)CCC1,0 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6353-0415,O=C(C1=Cc(cc(cc2)Br)c2OC1=O)Nc(cc1)ccc1S(N1CCOCC1)(=O)=O,0 Z1860379472,CC(CCC1)(C1NCc1cc(cc(C)c(C)c2)c2o1)C(O)=O,0 F6510-3935,CC(C)Oc(cc1)ncc1C(Nc(c(C)c1)cc(N2C)c1N(C)S2(=O)=O)=O,0 SC88-0436,O=C(Cc1cccs1)N(C1)CC1(C(CC1)c2nc(C3CCCC3)no2)S1(=O)=O,0 S039-3963,Cn1c(cccc2)c2c(CN(CC2)CCC(N=C(N3)N4CCN(C)CC4)=C2C3=O)c1,0 Z1983366961,CCC(C)NC(c1cccc(CNc(n(C)c2ccc3)nc2c3F)c1)=O,0 Z1621015797,CC(N(CCC1NCc2nc(N(C)C)ncc2)Cc2c1cccc2)=O,0 S812-2490,Cn1cnc(S(N2C(C3CCCC3)c3nccn3CCC2)(=O)=O)c1,0 F6808-5858,Cn1c(N(CC2)CCC2(c2ccccc2)C#N)nc2c1nccc2,0 SA58-0818,O=C(NCc1ccco1)N1C(CCc2noc(-c3ccncc3)n2)CCC1,0 S693-0498,Cc1cnc(C2CCOCC2)n1CC(CCC1)CN1S(c1c(C)onc1C)(=O)=O,0 F6400-0658,CN(C)c1cccc(C(N2C(CN3CCCC3)CSCCC2)=O)c1,0 F5860-0183,Cc1noc(C)c1CN(CC1)CCN1C(c(ccc(F)c1)c1Cl)=O,0 F5823-0760,COC(c(cc1)ccc1S(N1CCC(Cn2nccc2)CC1)(=O)=O)=O,0 F6660-2744,C=Cc1ccc(CN(C=Cn2nccc22)C2=O)cc1,0 Z2224253443,CC(C)(c(ccc(C(Nc1cc(C2CCCC2)nn1C)=O)c1)c1N1)C1=O,0 F6481-4033,O=C(c1ccno1)N(CC1)CCSC1c1cccs1,0 Y500-9594,CCCn(c1nc(-c2c(C)n(C)nc2)c2)nc(C)c1c2C(N1CCN(Cc2cn(C)nc2)CC1)=O,0 F2768-0427,CN(Cc1ccco1)S(c(cc1)ccc1C(Nc(cc1)ccc1Br)=O)(=O)=O,0 S990-0618,Cc1noc(C(CCN(CC2)S(c3ccccc3)(=O)=O)N2C(C2CCCC2)=O)n1,0 Z1553051690,CCC(C1)N(CC(F)F)CCN1C(c1coc2c1cccc2)=O,0 F6609-3808,O=C(COC(c(o1)ccc1Br)=O)Nc(ccc(F)c1)c1Cl,0 F6161-0610,O=C(c1nc2ccccc2cc1)NCCN(C=NC(c(cc1)ccc1F)=C1)C1=O,0 Z1549172147,CC(C(F)(F)F)N(CC1)CCN1c(cc1)ccc1S(C)(=O)=O,0 Y043-2883,N1(C([C@H]2N(C(c3c1cccc3)=O)CCC2)=O)CC(Nc1cc(ccc1O)Cl)=O,0 Z1067978938,Cc1ccc(cccc2NS(c3cc(OC)ccc3)(=O)=O)c2n1,0 Z109821744,CC(c(cc1)ccc1-c1ccc(C(N(C2)c(cccc3)c3OC2C(N2CCCCC2)=O)=O)o1)=O,0 F6734-1265,Brc(cc1)cnc1N1CC(CN(CCn2nccn2)C2)C2C1,0 Z3948536604,CC(C)c1ccc(CC(Nc2c(C)nn[nH]2)=O)cc1,0 F2553-0122,CSc(cccc1)c1C(Nc(cc1)cc2c1scc2)=O,0 Z1168189199,CCc1nnc(cc2)n1nc2NCC1(CCOCC1)c1cccc(Cl)c1,0 F6475-7907,O=C(c1cccnc1OC1CSCC1)N(CC1)CCC1C(F)(F)F,0 F6192-0196,COc(cc1)cc(C(NCC(c2ccco2)c2ccco2)=O)c1Br,0 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Y070-4510,CC(C(Nc1c(C(NC(CC2)CS2(=O)=O)=O)c(CCC(C)C2)c2s1)=O)Oc(cc1)ccc1F,0 F3348-0802,CC(C)(C)c(cc(-n1cncc1)n1nc2)nc1c2-c(cccc1)c1Cl,0 F6523-3170,CCSc(cccc1)c1C(NCCN(Cc(cc(cc1)F)c1OC1)C1=O)=O,0 F3250-0599,CCOC(c1c(N)n2nc(C)c(-c3ccccc3)c2nc1)=O,0 Z2966807322,Cc1cccc(C(CC2)=CCN2C(C2(CC3)CCCN3C2)=O)c1C,0 Y041-0542,Cc(cc1)cc(C)c1N(CC1)CCN1C(C1(CCOCC1)c(cc1)ccc1OC)=O,0 T619-5420,NC(CN(CCCC1)C1c1nc(-c2nccnc2)no1)=O,0 Z2848695112,CC(C(N(CC1)CCC1(CCN)O)=O)Oc1cccc(F)c1,0 Z2305493445,Cc(ccc(Cl)c1)c1N1CC(CNC(N(CCC2)CCC2O)=O)CC1,0 Z3009177317,Cc(nc(C)s1)c1S(N(CC1)CCN1c1n[nH]cn1)(=O)=O,0 F6199-0503,O=S(c(s1)ccc1Br)(N1CCN(CCn2cncc2)CC1)=O,0 Z2992309084,CCc1cccc(NS(c2ccnn2C)(=O)=O)c1O,0 SB23-0968,Cc1n[nH]c([C@]2(CN(C3)C(C4CC4)=O)[C@@H]3CN(CC3CC3)CC2)n1,0 Z2482827587,OC(C(c(cccc1)c1F)N(CC1)CCN1c1ncccn1)=O,0 F318-0305,CCC(C1)Oc(ccc(Cl)c2)c2N1S(c1c(C)sc(-c2noc(C)n2)c1)(=O)=O,0 F6451-2830,Cn(c(C(NCC(c(cccc1)c1Cl)OC)=O)c1)nc1-c(cc1)ccc1F,0 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S948-5575,CCOC[C@@]1(CN(C2)c(cc3)cc(C(F)(F)F)c3C#N)[C@H]2CNCC1,0 E157-2720,COc(cc1)ccc1OCC(Nc(s1)nnc1S(N(CCC1)c2c1cccc2)(=O)=O)=O,0 Z2609829168,Cc1c(C)sc2ncnc(NCC(CC3)(CCC3(F)F)O)c12,0 F6811-1471,CC(C)N(C(C=C1)=O)N=C1N(CC1)CCN1c1cc(C)nc2cc(C)nn12,0 F6296-1185,Cn(c(CNC(Nc1cc(C(F)(F)F)ccc1)=O)c1)nc1-c1cccs1,0 F2372-0051,O=C(NCC(CC1=O)CN1c1ccccc1)NC(c1ccccc1)c1ccccc1,0 F6788-1795,Cc1c(C)nc(C2CC2)nc1N(CC1)CCN1c1ncnc2c1cn[nH]2,0 Z3674961172,CCc1c(-c2csc(N3CCN(Cc4cn(CC(N)=O)nn4)CC3)n2)[nH]c(C)c1C(C)=O,0 F6608-1325,CN(C(CC1)C2)C1CC2Oc1cccc(C(F)(F)F)n1,0 F6516-0638,O=C(CSCc1ccccc1)NCc1ccc(-c2ccco2)o1,0 Z3339869347,CCCc1nonc1NS(c1c2n(C)ccc2ccc1)(=O)=O,0 T501-0231,CCn1c(CC(CCC2)CN2C(NC2CCCCC2)=O)nnc1,0 Z2143170715,[O-][N+](c(cncc1)c1N1CC2(CC2)CC1)=O,0 Z2481212337,CC(C1)OCC2(CCC2)N1S(CC1CCC1)(=O)=O,0 F6484-0554,O=S(CCOc1ccccc1)(NC(CC1)CCC1Oc1nccnc1)=O,0 Z3365506742,O=S(c(cc1)ncc1Br)(N1CC(CNCC2)C2CC1)=O,0 C700-1287,Cc1c(CS(CC(N(CC2)c3c2cccc3)=O)(=O)=O)nc(-c(cccc2)c2Cl)o1,0 F6549-3492,O=C(C(CC1)Oc2c1cccc2)N1CC(Cn2ncnc2)C1,0 SD61-0011,O=C(C(C1)C2(CCC2)CN1c1ncccn1)NCCc(cc1)ccc1F,0 Z3016313890,CCc1cc(C(N(CCC[C@@H]2C3)[C@]23C(N)=O)=O)ncc1,0 Z1503036151,O=C(NCc(cc(cc1)F)c1Br)N1CC(Cn2nncc2)CCC1,0 4451-0022,CCN(C(C1(CC(c(cc2)ccc2-c2ccccc2)=O)O)=O)c2c1cccc2,0 SB91-0509,Cc1cc(C(N(CC2)CC2N(CCN2CCCC2)S(N(C)C)(=O)=O)=O)no1,0 SA70-0138,COCCC(CCC1)(CN1C(c1cscc1)=O)c1noc(C2CC2)n1,0 7591-0298,O=C(c(cc1)ccc1F)NC(C(F)(F)F)(C(N1c(cc2)ccc2F)=O)NC1=O,0 F5669-1513,COc1cccc(-c2n[nH]c(C(N(CC3)CCN3c3ncnc(N4CCCCC4)c3)=O)c2)c1,0 Z2963170766,Cc1csc(CC(CC2)CN2C(c(cc2)cc3c2[nH]nn3)=O)n1,0 Z1416748045,CC1(CCN(CCCC(c(cc2)ccc2F)c(cc2)ccc2F)CC1)O,0 Z2003948542,COc(cc1)cc(C2)c1OCC2C(N1CC(c2cccc(F)c2)NCC1)=O,0 F6571-0832,CN(C)C(CNS(c(cccc1)c1Br)(=O)=O)c1cc(cccc2)c2o1,0 S693-0572,Cc1cnc(C2CC2)n1CC(CCC1)CN1C(C1CCOCC1)=O,0 Z2273618722,O=C(C1CCCC1)Nc1c[nH]nc1C1CN(CC2(CC3)CC3CC2)CCC1,0 F6548-3511,CCCCN(c1c2cccc1)C(SCCCC)=NS2(=O)=O,0 F6237-3049,O=C(C1OCCC1)N(CC1)CCN1C(c1nn(-c2ccc(C(F)(F)F)cc2)nn1)=O,0 Z3173417789,CC(CN(Cc1ccccc1)C(c(cc1)c(C)cc1C(O)=O)=O)O,0 C487-0558,O=C(c(cc1)cc(N(Cc(cccc2)c2Cl)C(N2Cc3ccco3)=O)c1C2=O)NC1CCCC1,0 D420-2012,Cc1nc(-c2cc3cc(C)ccc3nc2N(CC2)CCN2c(cc2)ccc2F)no1,0 F6525-0540,O=C(c(s1)ccc1Cl)N1Cc2c(CCC3)c3nn2CC1,0 Z3687016793,O[C@@H](CC(Cn1nccc1)C1)[C@H]1NC(c1c(COCC2)c2ccc1)=O,0 Z2482975324,COc1cc(C(C(O)=O)N(CC2)CCC2=C)cc(OC)c1,0 Z3077895064,Cc(cc1)c(C)c2c1sc(N(C1)CC1(CC(CN1)O)C1=O)n2,0 F1808-0152,CCOC(C(C)Oc1cccc2c1C=CN(CC(Nc(cc(cc1)Cl)c1OC)=O)C2=O)=O,0 F6523-2802,Cn1c(-c2noc(CNC(c(o3)ccc3Br)=O)n2)ccc1,0 F6244-1509,COc(ccc(Cl)c1)c1NC(NCC#CCN1CCCC1)=O,0 F6795-3635,CC(C)(C)c(nc1cc2)cn1nc2N1CCN(Cc2csc(C3CC3)n2)CC1,0 Z4626152584,C[C@@H](CNC(C)c(cc(C(F)(F)F)cc1)c1Br)O,0 P563-1011,O=C(C1=C(CCC2)N2c(ccc(F)c2)c2S1(=O)=O)NC1CCCCCC1,0 Z2143792593,O=C(CC1(CC(C2)C3)CC3CC2C1)NCCC(C=C1)=CNC1=O,0 Z2052664766,CC(C)c1nnc(N(C2)[C@H](CO)C[C@H]2OC)s1,0 F6416-8008,OC(CCNC(c(c(F)ccc1)c1F)=O)c1cocc1,0 Z2441163636,Cc(oc(S(NC)(=O)=O)c1)c1C(N(C[C@H]1c2ccccc2)C[C@H]1N)=O,0 F6560-4178,CC(C)C(Cn1ncnc1)NC(c1cc(-c2ccccc2)nn1C)=O,0 F6481-0874,O=C(CNC(OCc1ccccc1)=O)N(CC1)CCSC1c(cccc1)c1Cl,0 F6222-0067,Cc1c(C(Nc2cnc(N(C)C)nc2)=O)sc(C)n1,0 S759-0459,CC(C)NC(N(CC1)CCC1[C@H]([C@@H](C1)Oc2ccccc2)N1C(C)C)=O,0 Z1241695774,COc1c(CNCC(C2)(Cc3c2cccc3)O)c2ccccc2cc1,0 D074-0023,CC(C)CCOc(ccc(C(c1c2[nH]nc1-c(cccc1)c1O)N(CC1OCCC1)C2=O)c1)c1OC,0 Z3409369275,CN(C(Cc(cc1)nn1-c(cc1)ccc1F)=O)c(cc1)ccc1OC,0 F6764-1985,O=C(c(ccnc1)c1F)N(CC1)CCC1c1nc2ncc(C3CC3)cc2cc1,0 Z3653623829,COC1(CO)CN(Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1,0 F0508-1535,Cc1cccc(-n2c(SC)nnc2CNC(c2cccc3ccccc23)=O)c1,0 Z2772641037,O=S(CCc1noc2c1cccc2)(N1C(CCCC2)C2OCC1)=O,0 Z1538682834,CC(C)c1nn(C)cc1C(NC(CCO)c1cccs1)=O,0 S397-0278,O=C(c1nn(CC2CC2)c2c1COCC2)N(CC1)CCN1S(c1cccs1)(=O)=O,0 Z910616616,CN(C)C(C(NC1CCN(Cc2ccncc2)CC1)=O)c1ccccc1,0 F6200-3533,OC(CNC(c(s1)ccc1Cl)=O)(C1CC1)c1ccccc1,0 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Z4127315833,OCCCC(N(CC1)CCN1c1ccc(C(F)(F)F)cc1)=O,0 F6237-0311,O=C(c1nn(-c2ccccc2)nn1)N(CC1)CCN1c1ncccc1,0 7752-0441,CC(C)(C1)CC(NC(CC2C(Nc3cccc(Cl)c3C)=O)=O)=C2C1=O,0 Z1592693870,Cn(cc1CN(CCC2)CC2C(N)=O)nc1-c1cccs1,0 Z1840553517,CCC(CC)n1ncc(C(N(CC2)Cc3c2ccs3)=O)c1CC,0 E216-4999,CC(C1)Oc(ccc(C)c2)c2N1C(NCc1ccccc1)=O,0 Y043-8850,COc(cc1)cc(OC)c1N(CC(C1)C(NC(CCC2)c3c2c(cccc2)c2[nH]3)=O)C1=O,0 Z2296061930,Cc(n(C(CC1)CCN1C(CCc1cccc(F)c1F)=O)nc1)c1C(O)=O,0 T990-2010,Cc1ccc(C(N(CC2)CCN2C(CCN2CCOC)C2=O)=O)s1,0 F5246-0006,CSc(cc1)nnc1NC(Cc1ccccc1)=O,0 Z1374920683,CC(C)(C1)Oc(cc2)c1cc2S(Nc1c(C)n(C)nc1C)(=O)=O,0 F0700-0079,O=C(COc(ccc(Cl)c1)c1Cl)Nc(cccc1)c1-c1nc(cccc2)c2[nH]1,0 F6764-1602,O=S(N1CCCC1)(N(CC1)CCC1c1ccc(cc(cn2)Cl)c2n1)=O,0 Z3009380311,Cc1c(CNS(c2ccc(COC)cc2)(=O)=O)ocn1,0 Z1171706965,O=C(CN(CC(N1)=O)C1=O)NCc(cc1)cc(F)c1-n1cncc1,0 Y042-3960,NC(C(CC1)CCN1C(C(CC1=O)CN1c(cc1)cc(C(F)(F)F)c1Cl)=O)=O,0 F6178-5723,O=C(c1noc(-c2ccco2)c1)NCC(CC1)CCN1c1nc(cccc2)c2o1,0 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SC41-0202,Cn1cnc(C(N(CC2)CC2(c2noc(-c3ccncc3)n2)F)=O)c1,0 F6785-6147,Cn1c(cccc2)c2c(C(N2CCC(COc(cc3)nn4c3ncc4)CC2)=O)c1,0 F6414-1061,OC(CNC(CN(C(CC1)=O)C1=O)=O)(CC1)Cc2c1cccc2,0 Z2353329520,OC(c1c(C(CC2)CCN2C(NCc(cc2)cc(F)c2O)=O)cccc1)=O,0 Z998916266,Cc1cc(C(NCCc2nnc3n2CCC3)=O)c(cc(cc2)Br)c2n1,0 F5581-0429,COc(cc1)cc2c1nc(N(CCn1nccc1)C(c1cccs1)=O)s2,0 Z2933134016,Cc(cc1)c(C(F)(F)F)cc1C(NC[C@@H](CCC1)NC1=O)=O,0 SA49-0429,O=C(CC1COC(C2)(CN2C(c2cscc2)=O)C1)N1CCOCC1,0 G851-0293,CC(C)(c(cccc1)c1N1CC(N(CC2)CCN2c(cccc2)c2F)=O)C1=O,0 4386-0421,CCCSC(N1CCc2ccccc2)=Nc(sc2c3CC(C)(C)OC2)c3C1=O,0 F6244-0145,CN(C)CC#CCNC(c(cc1)ccc1-c1ccccc1)=O,0 SC04-0307,Cc1c(CN(CCC2)CC2OCCc2noc(-c3ccccc3)n2)cnn1C,0 Z917392646,Cc1c(C(Nc2cc(-c3n[nH]c(C)n3)ccc2)=O)nco1,0 Z3574566040,Cn(c(C(N1C(CC2)C(CO)CC2C1)=O)c1)nc1O,0 8020-0486,CC(C)(C1)OCc2c1c1c(NCCCO)nc(-n3nc(C)cc3C)nc1s2,0 T500-0182,Fc1ccc(CC2CC3(CCNCC3)OCC2)cc1,0 F6495-4052,COc(ccc(C(F)(F)F)c1)c1NC(C(C1)CN1c1ncnc(-c2ccccc2)c1)=O,0 Z2027569534,Nc(c(-c1ccccc1)ncc1)c1C(N(CCC1)C1C1CCC1)=O,0 SB16-0314,CC1(CC1)C(N(CC1)C[C@@H]2[C@H]1N(Cc1ccccc1)CCOC2)=O,0 K906-2122,O=C(C(CCC1)CN1S(c1cccc2cccnc12)(=O)=O)Nc(ccc(C(F)(F)F)c1)c1Cl,0 F5027-0802,O=C(C1(CC1)c(cc1)ccc1F)N1CC(c2ccc(C(F)(F)F)cc2)OCC1,0 Z1850786289,C[C@H](c(cccc1)c1Cl)NC[C@@H](c(cc1)ccc1Cl)O,0 Z2095411803,Cc1noc(C(CCC2)N2C(c2cc(c(C(F)F)nn3C)c3s2)=O)n1,0 C066-1677,CN(C(C(C(O)=O)c1c2cccc1)c(cccc1OC)c1OC)C2=O,0 F3321-0046,O=C(c1cccnc1-c1nc(cccc2)c2s1)Nc(cccc1)c1F,0 Z960362002,CNC(c(cc1)cc(-c2ccccc2)c1OC)=O,0 G119-1391,Cc1c(C)n(Cc(cc2)ccc2F)c(cc2)c1cc2C(NCCCN1CCCC1)=O,0 F6561-4786,CC(N(CC1)CCC1C(N(C(CC1)C2)C1CC2=C)=O)=O,0 F6619-7292,CN(C)c(cc1)nnc1N(CC1)CCN1c1c2sccc2ncn1,0 F5754-0745,Cc(c(C)c1)cc2c1ncn2CC1CCN(Cc2ncccc2)CC1,0 F6514-6708,O=C(c1cocc1)NC(Cn1nccn1)c1ccccc1,0 F5884-0193,O=C(C(CC1)CCN1C(NC1CC1)=O)Nc(cc1)cc(C(F)(F)F)c1F,0 F6506-5312,OC(CNC(NCc1cccc2ccccc12)=O)(C1CCOCC1)c1ccccc1,0 F6573-3420,O=C(c(ccnc1)c1F)NCCOCCn1cncc1,0 D345-0423,Cc1c(C(N(CC2)CCC2c2nc(cccc3)c3s2)=O)oc2c1ccc(Br)c2,0 F6440-4185,Cn1nc(CNC(NCc(cc2)ccc2Cl)=O)cc1C1CC1,0 SB94-0869,CCn1ncc(C(N2CCC(CN(CC(C3)C(NCC4CC4)=O)C3=O)CC2)=O)c1C,0 F6036-1809,O=C(Cn1nccc1)N(C1)CC1c1nc(Cc2ccccc2)no1,0 Z1728458538,Cc1nccc(N(CC2)CCN2C(C(CCN2C)C2=O)=O)n1,0 SB18-1075,Cc1ccc(CN(C[C@H](C2)NS(C)(=O)=O)[C@@H]2c2nc(-c3ccccc3)n[nH]2)o1,0 Z27654419,CC(Nc(cc1)ccc1NC(C1=Cc(cc(cc2)Br)c2OC1=O)=O)=O,0 F6658-5689,Cc1c(C)ncnc1OCC(CC1)CCN1S(c(cccc1)c1Cl)(=O)=O,0 F6685-8952,COc1cccc(NC(N2CC(COc(nccc3)c3Cl)CCC2)=O)c1,0 V008-0006,CCCN(CC(C)O)CC(N(CC1)C(COc(cc2)ccc2Cl)c2c1scc2)=O,0 Z1615167857,CC(C)C(C1)OCCN1c1ncnc2c1oc1c2cccc1,0 F6514-2661,O=S(c(cc1)ccc1-n1nccc1)(NC(C1CCOCC1)c1cnccc1)=O,0 F6178-4864,O=C(c(c(F)ccc1)c1F)NCC(CC1)CCN1c1nccnc1,0 D445-0009,CCC(C)NS(c(cc1)ccc1N(C(CC1)=O)S1(=O)=O)(=O)=O,0 SC15-0227,Cc1noc(C)c1CN1CCC(CN(CC(COc2nccc(C)c2)C2)C2=O)CC1,0 Z4220069402,Cc1ccnc(O)c1NC(C1c(cc(cc2)Cl)c2OCC1)=O,0 F2004-0112,CCOC(N(CC1)CCN1C(CSc(cc1)nnc1-c1ccco1)=O)=O,0 Z3278062168,Cn1nc(CNC2(CCC3)C3NCC2)cn1,0 Y043-4945,CC(C)N1N=C(CC(NC(CCC2)c3c2c(cc(cc2)OC)c2[nH]3)=O)c(cccc2)c2C1=O,0 SD62-0281,O=C(CCC(C1)C2(CCC2)CN1C(c1cc(-c2cccc(Cl)c2)n[nH]1)=O)N1CCCC1,0 S779-2137,Cc1cnc(C2CCC2)n1CC(CC1)CN1C(c1cc([nH]cc2)c2cc1)=O,0 D274-0045,Cc1nc2ncnn2c(N(CC2)CCC2NC(Nc(cc2)ccc2F)=O)c1,0 G336-0028,O=C(Nc(cccc1)c1Br)N(CC1)CCN1c1nc(cccn2)c2s1,0 M875-3558,Cc1nnc2n1cccc2S(N(Cc1cc(OC)ccc1)c1cc(F)cc(F)c1)(=O)=O,0 L007-0108,CN(c(ccc(S(Nc1cccc(-c2cc(cc(cc3)Cl)c3[nH]2)c1)(=O)=O)c1)c1O1)C1=O,0 F3053-0439,Cc1cccc(NC(C(CC2=O)CN2c(cccc2)c2F)=O)c1C,0 Z1682174239,OC(c(ccc(S(NCC1COCCC1)(=O)=O)c1)c1Br)=O,0 F0016-1441,Cc(cc1C)cc(C)c1NC(C1(CC(C2)C3)CC3CC2C1)=O,0 F186-1434,CCCCNC(Cc1csc(NC(C2CC2)=O)n1)=O,0 F3386-3602,CCOc(cccc1)c1N(CC1)CCN1S(c(cc1)cc(OC)c1Br)(=O)=O,0 Z1455355699,OC([C@@H](CCC1)N1C(C(CC1=O)CN1c(cccc1)c1Cl)=O)=O,0 Z254219592,O=C(C(CC1)CS1(=O)=O)N(CC1)CCN1C(c1cc(cccc2)c2[nH]1)=O,0 F6178-3293,O=C(c(o1)ccc1Br)NCC(CC1)CCN1C(c1ccncc1)=O,0 F6789-0553,CN(CCc(cc1)ccc1OC)c1nccn2nccc12,0 S689-0908,COc(cc1)ccc1C(N(C1)CC1N(CC(C1)C(NCC2CC2)=O)C1=O)=O,0 Z2755675185,OC([C@@](C1)(C2)[C@@H]1C[C@@H]2NC(Cc1cncnc1)=O)=O,0 V020-1532,O=C(c(cccc1)c1F)N(CC1OCCC1)Cc(n1CC2OCCC2)cnc1S(Cc(cccc1)c1F)(=O)=O,0 SC44-0202,Cc1c(CN(CC2)CCC2(C2)OCCC2OCC(N2CCCC2)=O)scn1,0 S895-0303,Cc1noc(C)c1CCC(N(CC1)CCC1(CC1)CCn2c1nnc2COC)=O,0 F2496-1000,O=C(CSCc1ccccc1)OCc1noc(-c2cccs2)c1,0 SB59-0396,CC(C)C(N(C1)CC(C2)(CN2C(COc(cc2)ccc2F)=O)C1c1nncn1C)=O,0 Z3132118612,N[C@H](C1)[C@@H](C2)[C@H]1CC2C(N(Cc1c2)Cc1cc(F)c2F)=O,0 F6559-3843,O=C(c1cocc1)NC(CC1)CCN1C(CC1)CS1(=O)=O,0 S607-0354,COCCN(c1c(N2[C@@H](CCC3)CN3C(C3CCC3)=O)nccc1)C2=O,0 Z1414400744,OC[C@H](CC1)CC[C@@H]1NCc(cc1)cc2c1[nH]cn2,0 F6660-2270,Cc1c(C(N2CCC2)=O)sc(N=CN2C)c1C2=O,0 F6481-3758,COc1c(CC(N(CC2)CCSC2c2ccco2)=O)cccc1,0 F5940-0359,O=C(c1cc(-c2ccccc2)n[nH]1)N1CCC(COCc2ccccc2)CC1,0 SA68-0072,CC(C)N(CC1)CCC1N(CCNC(C1(CC1)c1ccccc1)=O)C1CCOCC1,0 S971-0443,CCCC(CC1)(C1(CC1)CCN1C(c1c(C)nccc1)=O)O,0 F6574-1503,O=S(c(s1)ccc1Br)(NC(CC1)CCC1n1nccc1)=O,0 F6515-1137,O=C(c1nc(cccc2)c2s1)NCc1cc(-c2ccco2)ncc1,0 SC44-0123,Cc1noc(C)c1CC(N(CC1)CCC1(C1)OCCC1OCC(N(C)C)=O)=O,0 SD54-0342,CNC(CNC(C(CC1)CCc2c1c(OCC1CC1)nc(-c1ccccc1)n2)=O)=O,0 Z2790192910,CC(C(C)(C)O)N(C)S(c1cc(CC(O)=O)ccc1)(=O)=O,0 D072-0458,Cc(cc1)ccc1S(c1c(N2CCN(C)CC2)oc(-c2cc(C)ccc2)n1)(=O)=O,0 F6512-3105,Cc1c(CN(CC2)CCN2S(c2cccc(Cl)c2C)(=O)=O)cno1,0 F6773-2871,C(CN(CC1)c2nccn3nccc23)C1Oc1nccs1,0 F1739-0065,CC(C(C#N)=C1N2c(cccc3)c3N1CC(CNc(cc1)ccc1Br)O)=CC2=O,0 F6435-1558,COc(ccc(CC(N(CC1)CCC1S(C)(=O)=O)=O)c1)c1OC,0 Z3077923916,CC[C@@H](c1ncccc1)Nc(cc1)ncc1S(C)(=O)=O,0 F6444-1597,Cc1cc(C(N(CC(C2)Oc(cccc3)c3F)C2C(OC)=O)=O)c(C)o1,0 F0896-0484,Brc1ccc(CSc2nnc3sc(cccc4)c4n23)cc1,0 Z4497727207,O[C@H](C[C@H]1C(Nc2cccc(C(CC3)NC3=O)c2)=O)CN1C(OCc1ccccc1)=O,0 8015-2420,COc(ccc(F)c1)c1S(Nc(cc1)cc2c1c(cc(cc1)S(N3CCCC3)(=O)=O)c1o2)(=O)=O,0 S616-0084,O=C(CN(c(cccc1)c1O1)C1=O)N1C[C@@H]2N(Cc3ccccc3)C[C@@H]2CC1,0 Z4884575307,N#Cc1cc(Br)cc(S(NC(C2(CC2)c(cc(cc2)F)c2F)=O)(=O)=O)c1,0 F6485-1698,O=S(c(cc1)cc2c1OCC2)(NC(CC1)CCC1Oc(nc1)ncc1F)=O,0 F1260-1698,COC(CC(C(NCC1)=O)N1C(c(sc1c2cccc1)c2Cl)=O)=O,0 F5315-0046,O=C(c1ncccc1)NCCCS(N(CC1)CCN1c1ncccc1)(=O)=O,0 SA94-0175,O=C(C(CC1)(CN1S(Cc1cc(F)ccc1)(=O)=O)F)NCc1ccccc1,0 F3083-0337,CN(C)S(N1CCN(CC(COc2ccc(cc(cc3)Br)c3c2)O)CC1)(=O)=O,0 F5959-0062,Cc1nccn1CCNC(C1=CC=CN(C)C1=O)=O,0 S607-0309,O=C1N([C@@H](CCC2)CN2S(Cc2ccccc2)(=O)=O)c2ncccc2N1CC1CC1,0 Z2983814098,CC(C)(C)c(nc1)ncc1N(C(C(CC1)(c2c1cccc2)N1)=O)C1=O,0 Z1260608024,Cc(cc1)cc(OCC2)c1N2S(c1cn(C)c(C(NC)=O)c1)(=O)=O,0 C732-1369,CCCNC(C(CCC1)CN1S(c1c(/C=C/c2cccs2)onc1C)(=O)=O)=O,0 G944-0621,O=C(CC(C1)c2nc(-c(cc3)cc4c3n(C3CCCC3)nn4)no2)N1c1cccc(Cl)c1,0 Z933937642,Cc1noc(C(CCC2)CN2C(NCc2c(CN3CCOCC3)cccc2)=O)n1,0 V001-7932,O=C(Nc(cc1)ccc1Br)N(CCc1csc2nc(-c(cc3)ccc3Cl)cn12)Cc1ccco1,0 S779-0395,Cc1cnc(C2CC2)n1CC(CC1)CN1C(C1(CC1)c1ccccc1)=O,0 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P435-1039,CC(C)CCNC(N(CC1)CCC1c1nc(C(N(C)C)=O)c(C)o1)=O,0 Z1680995473,CCCc(n(-c1nccc(C)c1)nc1)c1NC(NCc(cc1)cc(OC)c1O)=O,0 V023-5909,CC(C)CC(N(CC1OCCC1)CC(N(CC1)C(COc(cccc2)c2F)c2c1scc2)=O)=O,0 Y043-8852,O=C(CC(C(N1CCc2ccccc2)=O)NC1=O)NC(CCC1)c2c1c(cccc1)c1[nH]2,0 F6444-1408,CCSCC(CCC1)N1C(CC1)CCN1C(Nc1ccccc1)=O,0 Z1739151744,OC(C(COCC1)N1S(c1c2OCCOc2ccc1)(=O)=O)=O,0 Z1955351756,CC(C)(CCC1)C(C(O)=O)N1C(c1cncc(C)c1)=O,0 Z1959635586,CCOc(cc1)ncc1S(N([C@H]1[C@@H]2CN(C)CC1)c1c2cc(C)cc1)(=O)=O,0 M410-0684,Cc(sc(-c1nnc(C2CC2)o1)c1)c1NC(c1nc2ccccc2cc1)=O,0 F0793-0013,COc1cccc(OCC(Nc(cc2)ccc2F)=O)c1,0 L367-0237,O=C(c(cc1)ccc1-c1cnc(N2CCCCC2)nc1)NCc1ccccc1,0 Z29187716,O=C(C1CC1)NCCNC(c(cccc1)c1Nc1cccc(C(F)(F)F)c1)=O,0 Z1527380501,CNS(c(cc1)cc2c1n(C)c(-c1cc(OC)ccc1)n2)(=O)=O,0 Y020-8450,O=C(c1c(C=C2)n3nc(C(F)(F)F)nc3nc1)N2c(cc1)cc(F)c1F,0 Z2440268817,Cc1nc(-c2c[nH]c(C(NCCC3CNCCC3)=O)c2)cs1,0 Z2795228791,CCn1c(CN(CC2)CCN2C(C2CC2)C(O)=O)ncc1,0 D094-0007,Fc(cc1)ccc1-c1cn(c(cccc2)c2n2CCN3CCCC3)c2n1,0 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Z3396344124,Cc1ncc(CC2)n1CC2C(NCCC(C1)c(cccc2)c2N1c1ncnc2c1cn[nH]2)=O,0 Z1654269155,CC(C1)C1C(Nc1cccc(C(NC2(C)C(C3CC3)OCC2)=O)c1)=O,0 C300-0092,CC(CC1)CCN1C(CCS(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O)=O,0 C389-0667,CN(CCCNC(c(cc1)ccc1N(CCC1)C1=O)=O)C1CCCCC1,0 F6560-2954,O=C(COc(cc1)ccc1Cl)NCc1cn(-c2cccs2)nn1,0 F6807-7100,Cc1nc2cnccc2c(N(CC2)CCN2c(cccc2)c2F)n1,0 F6571-5639,CC(Cc1csc2c1cccc2)NC(c1ccno1)=O,0 Z632-2623,Cc1ccc(C(N(CCC2)C2c2c(C)onc2C)=O)s1,0 F6178-4205,Cc(cccc1)c1NC(NCC(CC1)CCN1c1ccncc1)=O,0 F6514-4097,Cc1cc(C)nc2nc(C(N(C3)CC3n3nnc(COc4ccccc4)c3)=O)nn12,0 F6548-4331,COCCN1C(SCc(cccc2)c2F)=Nc(cc(cc2)C(OC)=O)c2C1=O,0 F2496-1430,O=C(C1CC1)OCc1noc(-c2cc(cccc3)c3o2)c1,0 F6483-0339,Cc1c(C(NC(CC2)CCC2Oc2ncccc2)=O)scn1,0 F2042-0009,COc1cccc(C(Nc(cc2)cc(CCC3)c2N3S(c2ccccc2)(=O)=O)=O)c1OC,0 F6250-0492,Cn(cc1C(NC(CCC2)CC2OC(Nc(cc2)ccc2F)=O)=O)nc1OC,0 F6539-3230,O=C(c1cc(Br)cnc1)NCc(cc1)ccc1-c1cocc1,0 SD08-0571,CN(C)C(NCc1c(COC(CCC2)(C3)CN2S(C2CC2)(=O)=O)n3nn1)=O,0 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F6415-0288,COCCN(Cc1cocc1)S(Cc(cccc1)c1Cl)(=O)=O,0 Z1075590860,CC(C1)OCCCN1C(NCc1cc(NC(NCc2ccncc2)=O)ccc1)=O,0 S687-0805,COCc1noc(CC2CC(CC3)(CCN3S(c3cccs3)(=O)=O)OCC2)n1,0 F0610-0036,CC(NC(CCS(C)(=O)=O)C(Nc1c(C)c(C)ccc1)=O)=O,0 F6442-5928,COC(CC1)CN1C(CC1)CCN1C(CCc(cccc1)c1Br)=O,0 J007-0036,Cc1noc(C)c1C(CCC1)N1C(Nc1ccccc1)=O,0 F6702-2197,Clc1cc(CN2CCC(COc3nccnc3)CC2)ccc1,0 F6561-1585,O=C(NCc1cccs1)NCc1cncc(-c2ccco2)c1,0 F2416-1159,COC(N(CC1)Cc2c1ccc(NC(NCc1cccs1)=O)c2)=O,0 F2323-2484,Cc1noc(C)c1CC(NCCn1ncc2c1N=CN(Cc(cc1)ccc1F)C2=O)=O,0 Z1979270212,Cc1ccc(-c2n[nH]c(NC(c3cccc(-c4noc(C(F)(F)F)n4)c3)=O)c2C)o1,0 S615-0557,Cc(cc1)c(C)cc1NC(N(CC1)CC1c1nc(CCOCC2CCCC2)no1)=O,0 S762-0128,CCN([C@@H](CCCC1)[C@]1(CC1)C(NCCc2nc(cccc3)c3n2C)=O)S1(=O)=O,0 F6609-6813,O=C(CN(C=C(C=C1)c2nc(-c3cccc(Br)c3)no2)C1=O)N(CC1)c2c1cccc2,0 Z1556296956,CCOc(ccc(CNC(N1C(CC(c2cn(C)nc2)O)CCC1)=O)c1)c1F,0 F6478-0874,Cc1nc(OC(CC2)CN2C(CNC(OCc2ccccc2)=O)=O)nc(C)c1,0 F6476-5529,CC(C)(C(N(CC1)CC1Oc1ccncc1)=O)OC(C)=O,0 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V011-2279,O=S(c1cc(OC(F)(F)F)ccc1)(N(CC1)CCN1c1c(CCCC2)c2nc2ncnn12)=O,0 F6708-8552,N#Cc1ncccc1N1CC(C2)(CC2c2ccccc2)C1,0 Y042-6268,C1(N[C@@H](C(Nc2c1cccc2)=O)CCC(Nc1c2c([nH]cc2)ccc1)=O)=O,0 Z1848780581,C(c1noc([C@@]2(CCC3)[C@H]3CNC2)n1)c1ccccc1,0 F5479-0161,Cc(c(NC(NCCCN1N=CC=CC1=O)=O)ccc1)c1Cl,0 C201-0637,CCc(cc(n1nc2Nc3ccc(C)cc3)O)nc1c2S(c1ccc(C)cc1)(=O)=O,0 Z1864909385,C[C@@H](CNC(N(CC1)CC(C)S1(=O)=O)=O)Oc(cc1)ccc1Cl,0 Z2186855453,CN(C[C@H](C1)N(C)C[C@H]1OC)C(c1noc(-c2c(C(F)(F)F)cccc2)c1)=O,0 Z2297674599,NC([C@@H](CCC1)N1C(Cc(cc1)ccc1OC(F)(F)F)=O)=O,0 V008-6947,COc(cccc1)c1N(CC1)CCN1c1nc(-c(ccc(F)c2)c2F)nc2ccccc12,0 F6230-0140,O=C(c1ccc(C(F)(F)F)cc1)NCc1c(cccc2)n2nc1,0 G115-0422,CN(CC1OCCC1)C(CC1)CCN1S(c1ccc(C(C=C2)=NNC2=O)s1)(=O)=O,0 SC98-0989,CCOCCn(c(CC1)c2CN1C(C1CCOCC1)=O)nc2-c1ncc(C)o1,0 Z1987090443,O=C(CC(C1)CC1c1ccccc1)N1CCC(C2)(CNC2=O)CC1,0 SC88-1298,Cc1nn(C)c(C(N(C2)CC2(C(CC2)c3nc(-c4ccccc4)no3)S2(=O)=O)=O)c1,0 F5860-3952,CS(N(CC1)CCN1C(Cn1nccc1)=O)(=O)=O,0 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F6529-2719,O=C(CN(C(CC1)CCN1S(C1CC1)(=O)=O)C1=O)N1c1ccccc1,0 C190-0354,O=C(c(cc1)cc(NC(N2CCc3ccccc3)=O)c1C2=O)NCCCN1CCCCC1,0 S957-5410,CCS(N(CC1)CCC1(C1)C(COCC2CC2)CN1c(cc1)cc(C(F)(F)F)c1C#N)(=O)=O,0 Z1052703120,O=C(CCNC(Cc1cn(-c2ccccc2)nc1-c(cc1)ccc1F)=O)Nc1cnccc1,0 F6526-0196,O=C(C1CCOCC1)N1Cc2cc(C3CC3)nn2CC1,0 Z1180933371,CNC(CCN(C)C(NCC1CCN(Cc(cccc2)c2Cl)CC1)=O)=O,0 F6561-9603,O=C(NCc1cn(-c2cnccc2)nn1)NCc(cc1)ccc1Cl,0 Z1869636949,Cc(cc(cc1)F)c1C(N(CCC(O)=O)CC1CC1)=O,0 C688-1225,O=C(CN(c1c(C(N2c(cc3)cc(Cl)c3F)=O)sc3c1cccc3)C2=O)NC1CCCC1,0 Z1455374814,OC([C@H](c1ccccc1)NC(C(CCC1)CN1C(Cc(cc1)ccc1F)=O)=O)=O,0 Z1531937969,Cc(cc(cc1)C#N)c1S(N(C)CC(O)=O)(=O)=O,0 F5570-0312,O=C(c(o1)ccc1S(N1CCCC1)(=O)=O)Nc1cc(C(F)(F)F)ccc1,0 F6734-1450,O=C(C1OCCc2c1cccc2)N(C1)CC(C2)C1CN2c(cc1)ncc1F,0 Z1558391743,O=C(COCC(F)(F)F)N(CCOC1)C1c1nocn1,0 F5490-1301,COc(nccc1)c1-c1cnc(NC2CCOCC2)nc1,0 F3351-0326,CCOC(c1cccc(NC(CCN2N=Nc(cccc3)c3C2=O)=O)c1)=O,0 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Z3075692000,CN(C(C=C(N1)N(CC2)CCC2NC(Nc2ccccc2)=O)=O)C1=O,0 F6525-6158,Cc(n(CCNC(N1CCOCC1)=O)nc1C)c1-c1cccs1,0 Z1673639778,COCCNc1ccc(CNC(N(CC2)CC3N2CCOC3)=O)cc1,0 F6573-2732,O=C(c(cc1)ccc1-c1cccs1)NCCOCCn1nccc1,0 Z749482136,CN(Cc1cc(C(F)(F)F)ccc1)C(C(Cc1ccccc1)NC(c1cccs1)=O)=O,0 Z1471667561,CCOC(c1c(C)[nH]c(C(Nc(cc2)ccc2Sc2ccncc2)=O)c1C)=O,0 Y020-0472,CCOc(cc1)ccc1N(C(CC1N(CC2)CCN2c(cccc2)c2F)=O)C1=O,0 Z2232100685,NC(C[C@H](c1ccccc1)NC(C(C1)C1c1ccc(C(F)(F)F)cc1)=O)=O,0 F6200-4142,CN(C)S(c(cc1)ccc1C(NCC1(c(cccc2)c2OCC1)O)=O)(=O)=O,0 F6560-5547,Cn1ncc(-c2cc(CNC(NCc(cccc3)c3F)=O)cnc2)c1,0 Z1919030028,C[C@H]1O[C@@H](C)CN(CCN(C)C(Nc(cc2)cnc2C(N)=O)=O)C1,0 C547-0582,CCN(c(cccc1)c1C(OCC(NCCCN1CC(C)CC(C)C1)=O)=C1)C1=O,0 F6550-5171,COc1cc([nH]c(C(N(C2)CC2Nc2nccnc2)=O)c2)c2cc1,0 Z1466309307,COc1cccc(NC(COc(cc2)ccc2C(N(CC2)Cc3c2ccc(F)c3)=O)=O)c1,0 Z991518972,Cc(ccc(C(NC)=O)c1)c1NC(C(CCOC)N)=O,0 F6418-2726,Cc(cc1)cc(C)c1S(NCc1ccc(C(c2ccccc2)O)s1)(=O)=O,0 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F6709-0286,CCc(cn1)cnc1OC(CC1)CCN1C(c(cc1)ccc1N(C(CC1)=O)C1=O)=O,0 F543-0722,O=C1N(C2CCCC2)c(ccc(-c2noc(/C=C/c3cccs3)n2)c2)c2N1,0 F6573-8364,O=C(CCc(cccc1)c1Br)N(CCN1c(nc2)ncc2F)CC1=O,0 Z1276202864,CN(C)c(cc1)ncc1C(N1C(CC(c2ccccc2)O)CCC1)=O,0 F6675-6592,CN(Cc(ccc(C#N)c1)c1F)C(C1)CN1c1ncccc1,0 F6559-3700,CC(C(NCc1nc(C(CC2)CCC2(F)F)no1)=O)n1nccc1,0 Z2374290764,CCc(n(C)nc1CC)c1S(NC(C1CC(C2)C2CC1)=O)(=O)=O,0 T841-1378,CC(C)N(c(cncc1)c1N=C1N(CC2)CCN2S(c2cccc(Cl)c2)(=O)=O)C1=O,0 F6514-2404,Cc(n(-c1ccccc1)nc1)c1C(NC(C1CCOCC1)c1cnccc1)=O,0 F1241-0028,CC(C)c(cc1)ccc1OCC(N(Cc1ccccc1)c1ncccc1)=O,0 Z2656178561,OC(C1(CNC(c2c(C(F)(F)F)scn2)=O)CC1)=O,0 V027-6270,CC(C)CCNC(C(CN(C1)C(C2CC2)=O)C1c1cccc(C(F)(F)F)c1)=O,0 F3244-0216,O=C(C1=Cc(cccc2)c2OC1)Nc1cccc(C(F)(F)F)c1,0 F2147-1421,Brc(cc1)cnc1OCC1CCNCC1,0 F6554-8466,O=C(c1noc(-c2cccs2)c1)N1C(C2)CSC2C1,0 F6218-0032,O=C(c(cccc1)c1Cl)Nc1cnc(-n2nccc2)nc1,0 Z3583347424,Cc1nn(C2CCC2)cc1C(Nc1nn(CCC2)c2c1)=O,0 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F6478-4021,CCc(ncnc1OC(CC2)CN2S(c2cn(C(C)C)cn2)(=O)=O)c1F,0 Z2228891755,CC(C)(C1)CN(C(C)=O)c2c1cccc2,0 F6549-2609,O=C(c1nccnc1)N(C(CC1)C2)C1CC2n1cncc1,0 F6658-6011,C(C(CC1)CCN1c1nc(C2CC2)ncc1)Oc1ncnc(C2CCC2)c1,0 Z1005746508,CN(Cc1cc(O)ccc1)C(c(cc(cc1)S(N(C)c2ccccc2)(=O)=O)c1Cl)=O,0 Z3027211141,Cc1c(C(OC)=O)nc(CCNS(c2cn(C)nc2)(=O)=O)s1,0 F2147-4282,CC(C)(C)OC(NC(CC(CC1)CCN1C(OC(C)(C)C)=O)C(O)=O)=O,0 F6734-1248,Cc1cc(N2CC(CN(C3)c(cc4)ncc4Br)C3C2)ncn1,0 F6436-2230,CC(Cc(cc1)ccc1OC)(CNC(c1cc(Br)cnc1)=O)O,0 F6752-3602,Cc1c(ccc(N(CCC2)CC2NC(C2CC2)=O)n2)c2nc(C)c1,0 F5883-0503,OCCn(c(NC(CSCc1ccccc1)=O)c1)nc1-c1ccccc1,0 F3083-0325,CC(Nc(cc1)ccc1S(n1nc(C)c(C)c1C)(=O)=O)=O,0 F6454-0589,O=C(CN(C(CC1)=O)C1=O)NCC1CCN(CC(F)(F)F)CC1,0 F6755-0547,Cc1c(ccc(OC)c2)c2nc(N(CC2)CCN2c2ncccn2)c1,0 F6524-4008,Cc1noc(C(CN(C2)S(N(C)C)(=O)=O)C2c2ccccc2)n1,0 F6454-0854,COC(c(scc1)c1S(NCC1CCN(CC(F)(F)F)CC1)(=O)=O)=O,0 G017-1689,O=C(CCC1)Nc(cc2)c1cc2S(N(CC1)CCN1c(cc1)nnc1N1CCOCC1)(=O)=O,0 Z772247894,COc1cccc(C(Nc(cc2)ccc2-c2cnco2)=O)c1OC,0 F6230-0059,O=C(c1cc(Br)cnc1)NCc1c(cccc2)n2nc1,0 L262-1083,CC(C)CCNC(N(CC1)CCN1c1cc(-c(cc(cc2)F)c2OC)ncn1)=O,0 Z1740458897,O=C(Cc1n[nH]c2c1CCCC2)NC1CN(Cc2ccccc2)CCC1,0 F8890-7842,CC(C)(C)OC(N1Cc2cc(C(O)=O)nn2CC1)=O,0 F6680-3067,COc1nccc(N(CCN(C2)C(c(c(F)ccc3)c3Cl)=O)C2=O)c1,0 Z1675674949,CC1(COCC1)NS(c(o1)ccc1Br)(=O)=O,0 F3161-0425,O=C(CC(c1c2cccc1)OC2=O)c(cc1)ccc1F,0 F5857-2228,COc(ccc(Cl)c1)c1NC(C(NCC(C1CC1)(c1cccs1)O)=O)=O,0 Z4060993440,O=C(CC1CCNCC1)N(CC1)c(cc2)c1cc2F,0 F6561-7759,CC(C(NC1CN(Cc2cscc2)CC1)=O)Oc(cccc1)c1F,0 Z324851690,CN(c(nc(cc1)C(NC2CC2)=O)c1C(N1C)=O)C1=O,0 P271-0692,O=C(C(CC1)CCN1c1cc2nccnc2nc1)N(CC1)CCN1C1CCCCC1,0 F5792-0388,COc(cccc1)c1C(N(CC1)CCN1C(SC1)=NN=C1c1ccccc1)=O,0 F6359-1511,O=C(NC(c1ccccc1)c1ccccc1)N(CC1)CCC1Oc(cc1)ncc1Cl,0 F6725-2765,N#Cc1cc(N(CC2)CC2N(CCO2)C2=O)nc2ccccc12,0 S694-0859,Cc1cnc(C2CC2)n1C(CC1)CN1S(c1cccc2nsnc12)(=O)=O,0 Z2781833704,OC[C@H](C1)C[C@H]1NC(c1cccc(S(Cc2ccccc2)(=O)=O)c1)=O,0 F6222-0172,O=C(c1nccnc1)Nc1cnc(N2CCCC2)nc1,0 F6359-1423,O=C(c1cnccc1)N(CC1)CCC1Oc(cc1)ncc1Cl,0 Z1154772058,Cc1cc(C(NCCc2cc(C(O)=O)ccc2)=O)c(C)s1,0 T853-0283,O=C(C1(CCC(N2C3CCCC3)=O)C2=CCCC1)NCCN1CCOCC1,0 Z5029892360,NC(C(CC1)CN1c1cc(C(N)=O)nc(C2CC2)n1)=O,0 S698-0447,Cc1cnc(C2CCOCC2)n1C(CC1)CCN1C(c1cc(C)nn1C)=O,0 F6446-0629,CS(N(CC1)CCC1C(NC(CC1)CCN1c1nccs1)=O)(=O)=O,0 F6241-0243,Oc(ccc(Cl)c1)c1NC(C(COC1)N(Cc2ccccc2)C1=O)=O,0 S582-0460,COCCN(C(CNC(C1(CC1)c(cc1)ccc1OC)=O)Cn1c2ccc1)C2=O,0 F0526-0284,CCOC(c1c(NC(c2ccco2)=O)sc(C2)c1CCN2C(C)C)=O,0 F3395-0206,COc1cccc(N(CC2)CCN2C2CCN(CC3Oc(cccc4)c4OC3)CC2)c1,0 F2135-1592,OC(c1cccnc1SCc1cc(C(F)(F)F)ccc1)=O,0 SC72-0182,Cc1nc(COC2(C3)CN3C(c3cscc3)=O)c2cn1,0 F6515-3288,COc(cccc1)c1OCC(N(CC1)CC1n1nccn1)=O,0 S439-0113,Clc1ccc(C2OCc3c(-c4noc(C5CCCC5)n4)nnn3C2)cc1,0 L949-3173,O=C(Nc1cccc(Br)c1)N(CCC1)C1c1nc(-c(ccc(F)c2)c2F)no1,0 Z2378680198,CC(C)(C)c(cc1)ccc1C(Nc1ncc(C2CCNCC2)s1)=O,0 F5614-0667,Cc1c(C(N2CCN(Cc3nc(cccc4)c4n3Cc3ccccc3)CC2)=O)snn1,0 Z2467505563,O=C(C1NCCc2c1cccc2)N(CC1)CCC1(F)F,0 F6516-0204,O=C(c1cocc1)NCc1ccc(-c2cccs2)o1,0 V010-5425,CC(CC(C)C1)CN1C(c1cc(N(C)C2CCCCC2)nc2ccccc12)=O,0 Z1634998587,Cc(n(C1CCCCC1)nc1)c1C(N(CCC1)C1C(N(C)C)=O)=O,0 F6619-7633,N#Cc1cc(COCC2)c2nc1N(CC1)CCN1c(cc1)nnc1-n1nccc1,0 Z2947460353,C[C@](CN(Cc1ccccc1)C1)([C@H]1C(NCC(N)=O)=O)c1ccccc1,0 F6660-1437,CCOc(cc1)ccc1-c1nn(C=CN(Cc2noc(C)n2)C2=O)c2c1,0 Y044-0657,COc1ccc(CC(Nc2nnc(C3OCCC3)s2)=O)cc1,0 F6451-3096,COC(CNC(NCc1cccs1)=O)c(cccc1)c1Cl,0 F6783-6432,Cn1c(N2CC(CN(C3)C(c4cc(OC)cc(OC)c4)=O)C3C2)nc2c1cccc2,0 Z2072650548,CCCC(CCC1)CN1C(CNS(c1c[nH]c2c1cccn2)(=O)=O)=O,0 F6521-1631,CC(c1ccc(C2(CNC(CCc3c(C)onc3C)=O)CCCC2)s1)O,0 F5857-1992,COc(ccc(Cl)c1)c1C(NCC(C1CC1)(c1cccs1)O)=O,0 Z1497696591,CC(C)(C1)C1C(NCc1ccc(C)s1)=O,0 Z2949816600,CCc(nc1)ncc1NC(NCc1nn(C)c(C2CC2)c1)=O,0 F5033-2671,CC(C)(C)NC(N1CCC(CNC(C2(CCCC2)c2cccs2)=O)CC1)=O,0 F6796-9023,Fc1cccnc1N1CC(CN(C2)c3c(ccs4)c4ncn3)C2C1,0 J004-1269,Cc1cc(C(CCC2)N2C(Cc(ccc(F)c2)c2Cl)=O)no1,0 S248-3494,O=C(C1CCC1)N1CC(Cc2noc(-c3ccncc3)n2)CC1,0 F6200-3989,Cc1cc(C(NCC2(c(cccc3)c3OCC2)O)=O)c(C)o1,0 F6279-0254,COc1c(C2(CNS(Cc3ccc(C(F)(F)F)cc3)(=O)=O)CCOCC2)cccc1,0 S957-0266,Cn1cnc(S(N2CC(CC3)(CCN3c(cc3)cc(C(F)(F)F)c3C#N)C(COC)C2)(=O)=O)c1,0 Z1958989155,CC(C)(C1)OC2(COCC2)CN1S(c1c(C)ccs1)(=O)=O,0 F2378-0369,CCOC(c(oc1c2cccc1)c2NC(C(CCC1)N1S(c(cc1)ccc1F)(=O)=O)=O)=O,0 Z3215989540,CC(C)(C(NC(CC1)CN1c1nc(Cl)nc(Cl)c1)=O)F,0 G008-2558,Cc1noc(-c2cc(S(NCCCN3CCN(Cc4ccccc4)CC3)(=O)=O)c(C)cc2)c1,0 Z4322124243,CC(CC(O)=O)C(CC1)CCN1C(c1cc(C)c(C)cc1)=O,0 Z1972228549,CC(C1C(N(C2)CC2n2ncnc2)=O)C1c1ccccc1,0 Z4884810433,CCn1nc(CC(NS(c2cc(C#N)cc(Br)c2)(=O)=O)=O)cc1,0 V015-1218,O=C(CN(CC1OCCC1)C(C1CCCC1)=O)N(CC1)C(COc(cc2)ccc2Cl)c2c1scc2,0 Z1285522866,O=C(c1ccc(CC(CC(N2)=O)C2=O)cc1)N(CC1)CCC1C1CCCC1,0 S663-0261,Cc1noc(C)c1S(N(CC1)CCC1(CC1)C1NC(COC)=O)(=O)=O,0 Z1518055186,CC(c1cn(Cc2ccccc2)nc1)NC(c(cc1)cc(N2)c1NC2=O)=O,0 Z1422181207,CC1(CC1)C(NS(c1cnccc1)(=O)=O)=O,0 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K784-9985,O=C(c(cnn1c(C(F)(F)F)c2)c1nc2-c1cccs1)NCC1Oc(cccc2)c2OC1,0 C430-5022,CCOc(cc1)ccc1N(C(c1c2cccc1)Nc(cc1)cc(OC)c1OC)C2=O,0 F1681-0088,CC(C)c(cc1)c(C)cc1OCC(CNC1CCCC1)O,0 S692-1402,Cc1cnc(C)n1C(CCC1)CN1C(C1CCCCC1)=O,0 Y031-4930,CCCCN(CC(C1)C(Nc2cccc(Cl)c2C)=O)C1=O,0 Z1745555030,Cc1c(C(NC(CC2CC2)c2cc(Br)cc(F)c2)=O)nnn1C,0 F3374-0053,O=C(c1cc(S(N2CCOCC2)(=O)=O)ccc1)Nc1c(cc(cc2)Cl)c2ncc1,0 F5591-1573,CC(C)c1nc(-c(cc2)cnc2N(CC2)CCN2C(CSc(cc2)ccc2F)=O)no1,0 Z168350786,CC(CCC1)C(C)C1NC(c1cc(Br)cn1C)=O,0 F6492-0499,O=C(C(CC1)Cc2c1[nH]cn2)NCC(CC1=O)CN1c1ccccc1,0 S639-8990,Cc1nn(C)cc1C(N[C@@H](C1)[C@@H](CN(C)C)CN1S(C)(=O)=O)=O,0 SA63-0733,CS(NCCC1CC2(CCN(Cc3nc4ccccc4cc3)CC2)OCC1)(=O)=O,0 Z2647908904,O=C(Cn1c(cccc2)c2nc1Cc1ccccc1)N1CC(CC2)CC2C1,0 L702-0914,O=C(CN(C(C=C1)=O)N=C1C(N(CC1)c2c1cccc2)=O)Nc(ccc(Cl)c1)c1F,0 F6562-3798,Cc1nn2c(CCC(C3)NC(c(ccnc4)c4F)=O)c3cnc2c1,0 Y600-3231,O=C(CC(C1=O)NCCc2c[nH]c(cc3)c2cc3Cl)N1c(cc1)cc2c1OCCO2,0 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G373-4050,COc1cccc(NC(N2CCN(Cc3nc(cc(cc4)-c5ccccc5)c4o3)CC2)=O)c1,0 F6492-0969,Cc1nc(CC(CC2)C(NC(CC3=O)CN3c3cc(OC)ccc3)=O)c2[nH]1,0 F6496-0233,Cc(c(S(NCc1ncnc(-c(cc2)ccc2OC)c1)(=O)=O)ccc1)c1Cl,0 Z1846692515,CC(C)c(n(-c(cccc1)c1Cl)nc1)c1NC(N(CC1)CCN1c1nccnc1)=O,0 Z3079945769,CC(C)(C)n1ncc2c1N=C(N[C@@H]1[C@@H](CO)C1)NC2=O,0 Y205-5149,CC(c(cc1)ccc1N(CC1)CCN1C(C(C1CC2CC1)C2C(O)=O)=O)=O,0 Z3503868009,Cc1c(CCS(NC([C@@H]2[C@H](C3)[C@H]3CC2)=O)(=O)=O)scn1,0 F6573-9642,COc1cccc(NC(NCc2nccnc2-c2ccncc2)=O)c1,0 F6724-1689,CC(C)(C)NC(N1CCC(CNc2c(cc(cc3)Cl)c3ncn2)CC1)=O,0 Z1082788220,CC1N(CC(Nc(cc2)cc(Cl)c2C#N)=O)CCNC1=O,0 F6439-4633,Cc1cc(C(NCCn2nc(C(F)(F)F)cc2)=O)c(C)o1,0 Z1975180206,CC(C1OCCC1CNC(NC(CC1)CN1c1cccc(Cl)c1)=O)=C,0 S511-1225,CCS(N(CC1)CCC11OCCC(CC(N2CCCC2)=O)C1)(=O)=O,0 Z4199550766,Cc1nc(Nc(cc2)cc(C(N(CC(N)=O)Cc3ccccc3)=O)c2Cl)nc(C)c1,0 Z2779786257,CC(CN(C1)C(NCc(cc2)ncc2Br)=O)Oc2c1cccc2,0 Z2449136722,O=C(CC1NCCC1)Nc(cc1)ccc1C(N(CC1)c2c1cccc2)=O,0 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