p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
COCc1nn2c(ncc3c(=O)n(NC(=O)c4ccccc4C)ccc32)c1-c1ccc(Cl)cc1 | C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N[C@](C)(CCO)C(=O)O | 0.595679 |
Cc1cc(C)c(C(=O)N2C[C@H](O)C[C@@H]2c2cccc(F)c2)[nH]1 | CCOC(=O)C1=C(COC(=O)c2ccc(C=O)cc2)NC(=O)N[C@@H]1c1cccs1 | 0.65567 |
COc1ccc(-c2cnc3n2C[C@@]2(CCN(C(=O)c4cccn4C)C2)OC3)cc1 | O=C(NC1CCN(C(=O)[C@@H]2CCc3ccccc32)CC1)c1ccncc1 | 0.555897 |
CCCOc1ccc2c(c1)c(CNC)c(C)n2C(C)C | Cn1cccc1[C@@H]1CCCN1CCN1C(=O)NC2(CCCC2)C1=O | 0.553326 |
CC(C)CN1CCn2c(nc3cc(NC(=O)CN4C(=O)c5ccccc5Oc5ncccc54)ccc32)C1 | COc1ccc(CN(C)C(=O)NCc2ccc(C)c(F)c2)c(OC)c1OC | 0.512716 |
CC(=O)NC1=NN(C(C)=O)[C@H](c2coc3ccccc3c2=O)S1 | C=CC[C@@]12C=C(OC)C(=O)[C@@H](C1=O)[C@H](c1cc(OC)c(OC)c(OC)c1)[C@H]2C | 0.644737 |
Cn1cc(-c2ccc3c(c2)NC(=O)CN2CCN(C(=O)c4cncnc4)C[C@H]2CO3)cn1 | CC(=O)CSc1nc2c(c(=O)[nH]c(=O)n2C)n1C[C@H](O)COc1ccccc1C | 0.645685 |
Cc1cc(C)n(CC(=O)N2CCC3(CC2)CNC(=O)c2ccccc2O3)n1 | CCCn1cc(/C=C2\C(=O)N(c3ccccc3C)C(=O)N=C2O)c2ccccc21 | 0.674797 |
CSc1ncccc1C(=O)Nc1ccccc1C(N)=O | CCN(CC)C(=O)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1 | 0.627168 |
Cc1ccc(C)c([C@H](NC(=O)CCN2CCN(C)CC2)c2cccnc2)c1 | Cc1ccc(N2C[C@H]3CCn4c(C(=O)NCc5ccco5)nnc4[C@@H]3C2)nn1 | 0.504175 |
CCc1nn(C)c(NC(=O)N2CCC[C@H](C(=O)c3cccs3)C2)c1C | Cc1cc(O)n2nc(NCc3c(Cl)cccc3Cl)nc2n1 | 0.53277 |
COC(=O)C1=C(C)N=c2s/c(=C\c3cccs3)c(=O)n2[C@@H]1c1ccc(C(C)(C)C)cc1 | CC(=O)[C@@H]1C[C@H](c2nc(-c3cnc4ccccn34)no2)C1(C)C | 0.712587 |
COc1ccc(-c2cc(NC(=O)COc3ccc(C(C)(C)C)cc3)n([C@H]3CCS(=O)(=O)C3)n2)cc1 | CCOC(=O)Cc1cnc2c(-c3ccccc3)c(C(F)(F)F)nn2c1C | 0.703061 |
N#Cc1c(=O)c2sc3cc(F)ccc3c2n2ccccc12 | O=C1NC(=O)[C@](c2ccccc2)(C2CC2)N1 | 0.573735 |
Cc1c(C(=O)N2CCC3(CC2)OCCC[C@H]3O)[nH]c2ccc(F)cc12 | O=C1C[C@@H]2c3ccccc3[C@@H]1[C@H]1C(=O)N(c3ccccc3F)C(=O)[C@@H]12 | 0.642487 |
CC[C@H](C)n1c(=O)c2ccccc2n(CC(=O)NCc2cccc(OC)c2OC)c1=O | CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NCc2ccc(CN3CCCC3)cc2)c1 | 0.591149 |
O=C(Nc1ccccc1-c1nc2ccccc2s1)c1cccnc1 | O=C(c1ccc(C(F)(F)F)cc1)N1CCc2cc(-c3ccncc3)ccc21 | 0.575964 |
O=S(=O)(c1c[nH]c2ncccc12)N1CCN(Cc2ccco2)CC1 | COc1cccc2sc(N(CCN(C)C)C(=O)c3ccc4ncsc4c3)nc12 | 0.591143 |
CCOC(=O)[C@]1(C(=O)O)CCCN(C(=O)OCC2c3ccccc3-c3ccccc32)C1 | CN(C)CCNc1oc(-c2ccc(S(=O)(=O)N3CCCC3)cc2)nc1C#N | 0.551687 |
COc1ccc(C)cc1NC(=O)Cn1c(=O)n(Cc2ccco2)c(=O)c2ccccc21 | CN(C)[C@H](CNC(=O)Nc1ccccc1-n1cccn1)c1ccsc1 | 0.613071 |
Cc1nccn1-c1cncc(N2CCC[C@H](c3nccs3)C2)n1 | C[C@H](C(=O)NCCC1=CCCCC1)N(C)Cc1nc2ccccc2s1 | 0.500551 |
COc1ccc2c(c1)C(=O)NC[C@]1(CCC(=O)N(CC(=O)NC[C@@H]3CCCO3)CC1)O2 | Cn1cnnc1CCNC(=O)[C@@H]1CCCCN1Cc1ccc(F)cc1 | 0.521587 |
CC(=O)c1sc(NC(=O)c2ccc(S(=O)(=O)N(C)Cc3ccco3)cc2)nc1-c1ccccc1 | C[C@]1(C(=O)N2CCOCC2)Oc2ccc(Cl)cc2NC1=O | 0.601246 |
CCOc1ccc2cc3c(N)c(C(=O)Nc4cccc(OC)c4)sc3nc2c1 | Cc1ccc(N2C[C@@H](C(=O)Oc3ccc4ccccc4c3)CC2=O)cc1[N+](=O)[O-] | 0.610097 |
CCc1ccc(C(=O)N2CCN(C(=O)c3cc(S(=O)(=O)N(C)C)ccc3Cl)CC2)cc1 | Cc1oc2c(F)c(F)c(F)c(F)c2c1C(=O)N1CC(O)C1 | 0.543359 |
COc1ccc(/C=C2\Oc3cc(OC(=O)c4c(OC)cccc4OC)ccc3C2=O)c(OC)c1OC | O=C(NCCc1ccccc1)c1cc(-c2ccccc2)nn1-c1ccccc1 | 0.574761 |
CCOC(=O)[C@@H]1[C@H](Oc2ccccc2)C(=O)N1c1ccccc1 | O=C(Nc1cnc(-c2ccccc2)nc1)c1cn(-c2ccccc2C(F)(F)F)nn1 | 0.579694 |
CC(=O)[C@H]1C(=O)C[C@](C)(O)[C@@H](C(C)=O)[C@@H]1c1ccc(F)cc1 | CN(Cc1ccccn1)C(=O)c1cc(-c2ccn(C3CCCC3)n2)n2ccccc12 | 0.508529 |
CCCN1c2cccnc2-n2cccc2[C@]12CCN(C(=O)C1CCC1)C2 | O=C(Nc1ccc(C(F)(F)F)oc1=O)c1ccccc1 | 0.507028 |
COC(=O)[C@H]1N[C@@H](C(=O)OC)[C@@H](c2ccccc2)S(=O)(=O)[C@@H]1c1ccccc1 | COc1ccc([C@@H](C)NC(=O)COc2ccc(Cl)cc2S(=O)(=O)N2CCCC2)cc1 | 0.526659 |
Cc1nc[nH]c1-c1nccn1[C@H](CO)c1ccc(F)cc1 | CN1/C(=C\C(=O)c2cc([N+](=O)[O-])ccc2Cl)C(C)(C)c2ccccc21 | 0.610759 |
CCOC(=O)[C@H]1CCCN(c2nc(C(F)(F)F)nc3ccccc23)C1 | O=C1[C@H]2C3c4ccccc4C([N+](=O)[O-])(c4ccccc43)[C@H]2C(=O)N1c1ccc2c(c1)OCO2 | 0.675703 |
O=C(O)C1CCC(N[C@H](c2c(Cl)cccc2Cl)C2CC2)CC1 | CCOC(=O)[C@]1(Cc2ccc(F)cc2)CCCN(C(=O)c2c(CC)noc2C)C1 | 0.508989 |
Cc1ccc(Cn2c(SCCN3CCOCC3)nc3c2c(=O)[nH]c(=O)n3C)cc1 | COc1ccc2[nH]cc(CCN3C(=O)N(c4ccccc4)C(=O)[C@H]3CC(=O)Nc3ccccc3)c2c1 | 0.706478 |
COc1ccccc1Cc1nc(CCn2cncn2)n(-c2cccc(C)n2)n1 | CCOc1ccc(NC(=O)Cn2nc3n(c(=O)c2=O)CCN3c2ccc(OCC)cc2)cc1 | 0.691296 |
Cc1ncc(Cl)c(N[C@@H](C)c2ccc3c(c2)OCCCO3)n1 | CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc4c(c3)OCO4)c(=O)n2[C@@H]1c1ccccc1F | 0.61393 |
COc1ccc(/C(O)=C2\C(=O)C(=O)N(Cc3cccnc3)[C@H]2c2cccc(OC)c2OC)cc1 | Cc1c(C)c2c(c(C)c1O)CC[C@](C)(C(=O)N1[C@@H]3CC[C@H]1C[C@H](CO)C3)O2 | 0.70935 |
COc1cccc(CN2C[C@@H]3CC[C@@](O)(c4ccccn4)[C@@H]3C2)c1OC | CCN1C(=O)/C(=C/c2cc(C)n(C[C@H]3CCCO3)c2C)c2ccccc21 | 0.696088 |
Cc1ccccc1OCc1nc(C#N)c(N2CCN(c3cccc(Cl)c3)CC2)o1 | CN1CCN(C(=O)C[C@H]2CN(C(=O)c3cnc(C4CC4)nc3)CC[C@@H]2Oc2ccccc2)CC1 | 0.53125 |
Cc1cc2occ(CC(=O)Nc3cc(S(C)(=O)=O)ccc3Cl)c2cc1C | CC[C@@H](c1ccncc1)N(C)C(=O)Nc1ccnn1C1CCCCC1 | 0.512009 |
COc1ccc2c(c1)OCC/C(=C\c1ccc(OC)c(O)c1)C2=O | O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)N1CCC[C@@H](c2nc3ccccc3s2)C1 | 0.589304 |
N#Cc1ccccc1Cn1cc([C@H]2OCCN2Cc2ccccc2)nn1 | O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc(-n2cccn2)c(F)c1 | 0.519864 |
COc1ccc(/N=c2\sc(C(=O)Nc3ccccc3)cc(=O)n2-c2ccc(OC)cc2)cc1 | COC(=O)C1=CO[C@@H](O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)[C@H]2C(CO)=CC[C@H]12 | 0.5756 |
C=CCNC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O | CCOc1ccccc1/N=C/[C@@H]1C(=O)NC(=S)N(c2ccc(C)cc2)C1=O | 0.510297 |
COc1cccc(C(=O)C2=C(O)C(=O)N(CCCN(C)C)[C@@H]2c2cccs2)c1 | Cc1cc(C)n2nc(S[C@@H](C)c3nccc(N)n3)nc2n1 | 0.60102 |
COc1cc([C@H]2OC(=O)[C@H]3[C@@H]2C(=O)O[C@H]3c2ccc(OC(C)=O)c(OC)c2)ccc1OC(C)=O | COc1cc2nc(N3CCN([C@H](C)C(F)(F)F)CC3)nc(N)c2cc1OC | 0.528825 |
Cn1c(=O)c2c(ncn2CCC(=O)Nc2ccncc2F)n(C)c1=O | O=C(CN1CCN(c2ccc(C3CC3)nn2)CC1)Nc1ccc(F)cc1F | 0.507104 |
CCCCSc1nc(NCCOCCO)c2c3c(sc2n1)COC(C)(C)C3 | Cc1noc(C)c1C(=O)N1C[C@@H]2CN(c3cnc4ccccc4n3)C[C@]2(CO)C1 | 0.730382 |
c1ccc([C@@H](Cn2cncn2)Nc2ncnc3sccc23)cc1 | O=C(c1ccc2nc(CO)[nH]c2c1)N1CCC[C@@H]1Cn1cnc2ccccc21 | 0.566667 |
Cc1cc(/C=C2\C(=N)N3N=C(c4cccnc4)SC3=NC2=O)c(C)n1Cc1ccccc1 | Cc1cccc2nc(C(=O)N3CCN(S(=O)(=O)c4ccc5c(c4)OCCO5)CC3)cn12 | 0.733467 |
C[C@H](NC(=O)CS(=O)(=O)c1ncc(-c2ccccc2)n1C1CC1)c1ccc(F)cc1 | O=C(c1cccc(F)c1)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCC3)c2)CC1 | 0.559871 |
O=C(Cc1cc2c(cc1Cl)OCCO2)NCCc1nc2c(s1)CCC2 | CSCCCN1CCC[C@H]1c1ccc(C(=O)N(C)Cc2cc(C)[nH]n2)s1 | 0.527508 |
O=S1(=O)C[C@H]2NC(=S)N(c3ccc(F)c(Cl)c3)[C@H]2C1 | CNc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c(F)c1 | 0.534521 |
Cc1cc(NC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)[nH]n1 | Cc1cc(-n2cnnn2)cc(NC(=O)CCc2cc3n(n2)CCNC3)c1C | 0.601891 |
O=C(c1coc(-c2ccccc2Cl)n1)N1CC[C@@H](n2cccn2)C1 | C[C@](C#N)(NC(=O)CN1C(=O)N[C@@](C)(c2ccc(OC(F)(F)F)cc2)C1=O)C1CC1 | 0.615784 |
Cc1nc(O)cc([C@@H]2CCCN(C(=O)CN(C)Cc3ccccc3F)C2)n1 | CO[C@](C)(C(=O)O)C(=O)N[C@H]1CCN(Cc2ccc(F)cc2)C1=O | 0.554762 |
CO[C@@H]1C[C@@H](c2nc(C)nn2-c2cnn(C)c2)CC[C@H]1N | CCN(CC)C(=S)SCc1csc(N(C(C)=O)c2ccccc2)n1 | 0.50655 |
COc1ccc(C[C@@]2(CCC(=O)N3CCC[C@H](C(=O)Cc4ccccc4)C3)CCC(=O)N2)cc1 | COc1cc(C)c(NC(=O)CNC2=NS(=O)(=O)c3ccccc32)cc1OC | 0.527374 |
CSc1ccccc1NC(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl | Cc1c(C(=O)O)sc2nc(COc3ccccc3)nn12 | 0.503268 |
CCOc1ccccc1CCCNC(=O)[C@@H](C)Oc1cccc2c1CCCC2 | COc1ccc2c(c1)CCC[C@@H]2CC(=O)Nc1c(C)ccnc1C | 0.534371 |
Cc1ccc(CN2CCC[C@@H](c3nnc(-c4ccccn4)o3)C2)cc1 | CCOC(=O)C1=C(C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 | 0.553398 |
CCn1c(SCC(=O)Nc2cc(C)ccc2C)nnc1[C@@H](C)NC(=O)c1ccccc1F | CSc1ccccc1NC(=O)CN(C)Cc1coc(-c2ccc(F)cc2)n1 | 0.564464 |
COc1ccc(N(C(=O)[C@H]2CCc3nc(C)nn3C2)C(C)C)cc1F | O=C(CCN1C(=O)/C(=C\c2cccc3c2OCO3)SC1=S)Nc1ccccc1C(F)(F)F | 0.677755 |
CCN1CCC2(CC1)OC[C@H](C(=O)O)N2C(=O)Cc1ccccc1 | Cc1cc(=O)cc(C(=O)N2CCC(Oc3cccc(Cl)c3)CC2)n1C | 0.525714 |
O=C1[C@@H]2[C@H](C(=O)N1Cc1ccccc1)[C@H]1C=C[C@H]2C1=C1CCCC1 | CCN1CCN(CC(=O)Nc2c(C(=O)OC)n(C)c3ccc(C)cc23)CC1 | 0.521878 |
C[C@H]1Sc2ccc(C(=O)N3CCN(c4ncc(C(F)(F)F)cc4Cl)CC3)cc2NC1=O | O=C1NCC[C@H]2CCCN(Cc3ccc(cc3)OCc3cn(nn3)CCOc3cccc1c3)C2 | 0.568157 |
CCSc1ccccc1NC(=O)[C@H]1CN(S(C)(=O)=O)c2cc(Cl)ccc2O1 | COc1ccc(F)cc1S(=O)(=O)N1CCC(C(=O)NC(c2ccccc2)c2ccccc2)CC1 | 0.571579 |
CCCn1c(=O)n(CC(=O)O[C@@H](C(=O)Nc2cccc(OC)c2)c2ccccc2)c2ccccc21 | O=C(CSc1nc2ncccc2c(=O)n1-c1ccccc1)NC[C@H]1CCCO1 | 0.654922 |
O=C(Cc1nc(O)n[nH]1)NCc1nc2c(s1)CCCC2 | CC(C)n1ccc2ccc(C(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc21 | 0.574132 |
Cn1ccc(C(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)n1 | Cn1c(=O)c2ccccc2n2c(COc3ccc(F)cc3Cl)nnc12 | 0.550429 |
CC(C)n1c(=O)sc2cc(S(=O)(=O)NCc3ccccc3)ccc21 | Cc1csc(N2CCN(Cc3nnnn3C3CC3)C[C@@H]2C)n1 | 0.502744 |
COc1ccccc1Cc1cnc([C@H]2CCCN(C(=O)COc3ccc(C)cc3)C2)o1 | COc1ccc(S(=O)(=O)N(C)c2cc(C(F)(F)F)ccc2Cl)cc1F | 0.533553 |
CC(=O)N1CCCC[C@H]1c1ccc(SC2CCCCC2)nc1 | C#CCOc1ccc([C@@H]2CC(O)=Nc3c2c(C)nn3-c2ccc(Cl)nn2)cc1 | 0.586242 |
CCOC(=O)[C@H](Cc1ccc(N)cc1)N1C(=O)c2ccccc2C1=O | C[C@H](NC(=O)c1cnc2ccccc2n1)c1ccc(-n2ccnc2)cc1 | 0.513285 |
O=C(CCn1cccn1)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 | CNc1cc(N2CCC[C@](O)(CNC(=O)c3ncccc3C)C2)ncn1 | 0.525785 |
COC[C@@H](C)n1c(COc2ccccc2F)nnc1S[C@H](C)C(=O)Nc1ccc(C(C)=O)cc1 | CCc1cccc(N2CCC(NC[C@H]3CNc4ccnn4C3)CC2)c1 | 0.538117 |
O=C1CC[C@@H](N2Cc3c(cccc3-n3cc(CO[C@@H]4CCCCO4)nn3)C2=O)C(=O)N1 | O=S(=O)(NC[C@@H](c1ccccc1)N1CCCCCCC1)c1ccc(Cl)s1 | 0.570084 |
C[C@H](NC(=O)N1CCc2sccc2C1)c1ccncc1 | O=C(NN1C(=O)/C(=C/c2cccn2-c2cccc([N+](=O)[O-])c2)SC1=S)c1ccccc1 | 0.515991 |
Cn1nccc1-c1ccc(CNC(=O)c2cccc(-n3cccn3)c2)cn1 | Cc1oc2c(C)c3oc(=O)c(CCC(=O)N4C[C@@H]5C[C@H](C4)c4cccc(=O)n4C5)c(C)c3cc2c1C | 0.663286 |
O=C(/C=C/c1ccccc1)N(Cc1ccc(-c2ccc(F)cc2)o1)[C@@H]1CCS(=O)(=O)C1 | COc1ccc(NC(=O)/C(C#N)=c2\s/c(=C/c3ccccc3Cl)c(=O)n2-c2ccccc2)cc1 | 0.661929 |
O=C(N[C@@H]1CCCc2c1cnn2-c1ccccn1)[C@@H]1C[C@@H]1c1ccccc1 | CCc1ccc(OC(=O)[C@H]2CC(=O)N(c3cccc(C)c3)C2)cc1 | 0.555319 |
COc1ccc(OC)c(NC(=O)[C@@H]2C[C@H](CCSC)N[C@]23C(=O)Nc2ccc(F)cc23)c1 | CCc1oc(C(=O)N2CCOCC[C@@H]2C)cc1C(=O)O | 0.658291 |
CC1=NN(C(=O)c2sc3cccc(Cl)c3c2Cl)[C@](O)(C(F)(F)F)C1 | CC(C)COc1ccc(C(=O)C2=C(O)C(=O)N(CCCN(C)C)[C@H]2c2ccncc2)cc1 | 0.754016 |
C[C@@H](NC(=O)CCn1ncc(=O)c2ccccc21)C12CC3CC(CC(C3)C1)C2 | CC1(C)C(O)=NC(=S)N2C(=O)C[C@@H](C(=O)Nc3ccccc3Cl)N21 | 0.556701 |
COc1ccc(S(=O)(=O)N2CCC[C@H](c3nc(-c4cccs4)no3)C2)cc1 | Cc1ccc(C)c(NC(=O)COc2ccc(N3C[C@H](C(=O)NCCCn4ccnc4)CC3=O)cc2)c1 | 0.580541 |
Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@@H]2C=C[C@@H]3C2=C2CCCCC2)cc1C | CN(CCCc1cn(-c2cncc(C(=O)O)c2)nn1)C(=O)c1cc2cc(F)ccc2oc1=O | 0.56875 |
Cc1nn(CC(=O)Nc2ccccn2)c(C)c1[N+](=O)[O-] | COc1ccc(C[C@]2(c3ccc(F)cc3)NC(N)=NC2=O)cc1 | 0.515419 |
CC[C@H](C)OCC(=O)N1CCCc2c(NC(C)=O)ccc(C)c21 | O=C(NCc1ccco1)[C@H]1CCCN(S(=O)(=O)c2cccc3nsnc23)C1 | 0.525918 |
COc1ccccc1C1(C(=O)Nc2ccc3c(c2)C(=O)NCC3)CCOCC1 | C=CCOc1ccc(CN2CCC(O)(Cn3ccnc3)CC2)c(OCC=C)c1 | 0.51693 |
COc1cccc(N2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)NCCc3c[nH]c5ccccc35)[C@@H]4C2=O)c1 | Cc1nc(C)c(C(=O)N2[C@@H]3CCC[C@H]2C[C@@H](O)C3)s1 | 0.562307 |
COc1ccc(NC(=O)CSc2nnc(-c3cccc([N+](=O)[O-])c3)n2C)c([N+](=O)[O-])c1 | COc1ccc(CNC(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 | 0.528139 |
Cc1cc(C(=O)Nc2nnc(-c3cc(Cl)sc3Cl)o2)on1 | Cc1nc(N2CCC[C@@H](c3n[nH]c(C)n3)C2)c2ccsc2n1 | 0.599792 |
CN(Cc1ccccn1)Cc1cnc(S(=O)(=O)CC2CC2)n1C[C@H]1CCCO1 | Cc1cc(C)c(C#N)c(N2CCN(S(=O)(=O)c3ccccc3F)CC2)n1 | 0.620725 |
CCOc1ccc2[nH]c3nc(SCC(=O)NC[C@@H]4CCCO4)nnc3c2c1 | CCc1cccc(CC)c1NC(=O)COC(=O)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1 | 0.545655 |
CN1C(=O)C(=C(Nc2ccc(F)cc2)SCCOc2ccccc2Cl)C(=O)N(C)C1=O | CCOc1ccc(S(=O)(=O)N(C)CC(=O)NCCCOC)cc1Cl | 0.503695 |
Cc1ccc([C@H]2/C(=C(\O)c3ccccc3)C(=O)C(=O)N2CCN2CCOCC2)o1 | CCN1CCN(S(=O)(=O)c2ccc(OC)c(NC(=O)c3ccccc3)c2)CC1 | 0.587576 |
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCC[C@@H](O)c3ccccc32)c1C | Cc1ccc(-c2cc(C(=O)NCC3CC3)[nH]n2)o1 | 0.548017 |
C[C@@H](NC(=O)c1csc(Nc2ccccn2)n1)c1ccc(N2CCCNC2=O)cc1 | CCOc1cc(N2C(=O)C[C@H]3CS(=O)(=O)C[C@@H]32)c(OCC)cc1NC(=O)c1ccccc1 | 0.667014 |
Cn1cnnc1CCNC(=O)c1cc(Cl)c(Cl)n1C | O=c1[nH]n(C2CCCCC2)c2c1[C@@H](c1ccccc1)SCC(O)=N2 | 0.548554 |
Cn1cc(CCC(=O)N[C@H]2CCN(c3ncccc3F)C2)c2ccccc21 | CC(C)C(=O)/N=C1/S[C@H]2CS(=O)(=O)C[C@@H]2N1[C@@H]1C[C@@H]2CC[C@@H]1C2 | 0.577943 |