molecule_smiles
stringlengths
1
1.15k
SELFIES
stringlengths
3
4.03k
CC(C#N)CC(F)(F)F
[C][C][Branch1][Ring1][C][#N][C][C][Branch1][C][F][Branch1][C][F][F]
O=C(CO)CC(F)(F)F
[O][=C][Branch1][Ring1][C][O][C][C][Branch1][C][F][Branch1][C][F][F]
CC(C=O)CC(F)(F)F
[C][C][Branch1][Ring1][C][=O][C][C][Branch1][C][F][Branch1][C][F][F]
CN(C=O)CC(F)(F)F
[C][N][Branch1][Ring1][C][=O][C][C][Branch1][C][F][Branch1][C][F][F]
CC(CC=O)C(F)(F)F
[C][C][Branch1][Ring2][C][C][=O][C][Branch1][C][F][Branch1][C][F][F]
CC(NC=O)C(F)(F)F
[C][C][Branch1][Ring2][N][C][=O][C][Branch1][C][F][Branch1][C][F][F]
CC(OC=N)C(F)(F)F
[C][C][Branch1][Ring2][O][C][=N][C][Branch1][C][F][Branch1][C][F][F]
CC(OC=O)C(F)(F)F
[C][C][Branch1][Ring2][O][C][=O][C][Branch1][C][F][Branch1][C][F][F]
OC1C(O)C1C(F)(F)F
[O][C][C][Branch1][C][O][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
CC1C(C)C1C(F)(F)F
[C][C][C][Branch1][C][C][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
CC1C(C(F)(F)F)N1C
[C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][Ring1][#Branch1][C]
CC1C(O)C1C(F)(F)F
[C][C][C][Branch1][C][O][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
OC1CC(C(F)(F)F)C1
[O][C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][Branch2]
CC1CC(C(F)(F)F)C1
[C][C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][Branch2]
CC1CC(C(F)(F)F)N1
[C][C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][Ring1][Branch2]
CC1CC(C(F)(F)F)O1
[C][C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][O][Ring1][Branch2]
CN1CC(C(F)(F)F)C1
[C][N][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][Branch2]
CC1(C(F)(F)F)CC1O
[C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#Branch1][O]
NC1(C(F)(F)F)CC1O
[N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#Branch1][O]
OC1CC1(O)C(F)(F)F
[O][C][C][C][Ring1][Ring1][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F]
CC1CC1(C)C(F)(F)F
[C][C][C][C][Ring1][Ring1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
CC1CC1(N)C(F)(F)F
[C][C][C][C][Ring1][Ring1][Branch1][C][N][C][Branch1][C][F][Branch1][C][F][F]
CC1CC1(O)C(F)(F)F
[C][C][C][C][Ring1][Ring1][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F]
CC1NC1(C)C(F)(F)F
[C][C][N][C][Ring1][Ring1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
CC1OC1(C)C(F)(F)F
[C][C][O][C][Ring1][Ring1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
CN1CC1(C)C(F)(F)F
[C][N][C][C][Ring1][Ring1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
OC1CC1CC(F)(F)F
[O][C][C][C][Ring1][Ring1][C][C][Branch1][C][F][Branch1][C][F][F]
CC1CC1CC(F)(F)F
[C][C][C][C][Ring1][Ring1][C][C][Branch1][C][F][Branch1][C][F][F]
CC1CN1CC(F)(F)F
[C][C][C][N][Ring1][Ring1][C][C][Branch1][C][F][Branch1][C][F][F]
CC1NC1CC(F)(F)F
[C][C][N][C][Ring1][Ring1][C][C][Branch1][C][F][Branch1][C][F][F]
CC1OC1CC(F)(F)F
[C][C][O][C][Ring1][Ring1][C][C][Branch1][C][F][Branch1][C][F][F]
CN1CC1CC(F)(F)F
[C][N][C][C][Ring1][Ring1][C][C][Branch1][C][F][Branch1][C][F][F]
OC1CCC1C(F)(F)F
[O][C][C][C][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
OC1CNC1C(F)(F)F
[O][C][C][N][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
OC1COC1C(F)(F)F
[O][C][C][O][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
CC1CCC1C(F)(F)F
[C][C][C][C][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
CC1CNC1C(F)(F)F
[C][C][C][N][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
CC1COC1C(F)(F)F
[C][C][C][O][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
CC1OCC1C(F)(F)F
[C][C][O][C][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
CN1CCC1C(F)(F)F
[C][N][C][C][C][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
CN=COCC(F)(F)F
[C][N][=C][O][C][C][Branch1][C][F][Branch1][C][F][F]
OCC#CCC(F)(F)F
[O][C][C][#C][C][C][Branch1][C][F][Branch1][C][F][F]
CCC#CCC(F)(F)F
[C][C][C][#C][C][C][Branch1][C][F][Branch1][C][F][F]
CCC(=O)CC(F)(F)F
[C][C][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][F]
CNC(=O)CC(F)(F)F
[C][N][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][F]
COC(=O)CC(F)(F)F
[C][O][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][F]
CN=C(NC)C(F)(F)F
[C][N][=C][Branch1][Ring1][N][C][C][Branch1][C][F][Branch1][C][F][F]
C#CC(CO)C(F)(F)F
[C][#C][C][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F]
N#CC(CO)C(F)(F)F
[N][#C][C][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F]
C#CC(CC)C(F)(F)F
[C][#C][C][Branch1][Ring1][C][C][C][Branch1][C][F][Branch1][C][F][F]
CCC(C#N)C(F)(F)F
[C][C][C][Branch1][Ring1][C][#N][C][Branch1][C][F][Branch1][C][F][F]
C#CC(NC)C(F)(F)F
[C][#C][C][Branch1][Ring1][N][C][C][Branch1][C][F][Branch1][C][F][F]
CNC(C#N)C(F)(F)F
[C][N][C][Branch1][Ring1][C][#N][C][Branch1][C][F][Branch1][C][F][F]
C#CC(OC)C(F)(F)F
[C][#C][C][Branch1][Ring1][O][C][C][Branch1][C][F][Branch1][C][F][F]
COC(C#N)C(F)(F)F
[C][O][C][Branch1][Ring1][C][#N][C][Branch1][C][F][Branch1][C][F][F]
CC(C)(CO)C(F)(F)F
[C][C][Branch1][C][C][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F]
CC(N)(CO)C(F)(F)F
[C][C][Branch1][C][N][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F]
CC(O)(CO)C(F)(F)F
[C][C][Branch1][C][O][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F]
CCC(C)(C)C(F)(F)F
[C][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
CCC(C)(N)C(F)(F)F
[C][C][C][Branch1][C][C][Branch1][C][N][C][Branch1][C][F][Branch1][C][F][F]
CCC(C)(O)C(F)(F)F
[C][C][C][Branch1][C][C][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F]
CNC(C)(C)C(F)(F)F
[C][N][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
COC(C)(C)C(F)(F)F
[C][O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
OCC(O)CC(F)(F)F
[O][C][C][Branch1][C][O][C][C][Branch1][C][F][Branch1][C][F][F]
CC(CO)CC(F)(F)F
[C][C][Branch1][Ring1][C][O][C][C][Branch1][C][F][Branch1][C][F][F]
CCC(C)CC(F)(F)F
[C][C][C][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F]
CCC(O)CC(F)(F)F
[C][C][C][Branch1][C][O][C][C][Branch1][C][F][Branch1][C][F][F]
CCN(C)CC(F)(F)F
[C][C][N][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F]
COC(C)CC(F)(F)F
[C][O][C][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F]
CCC(C=O)C(F)(F)F
[C][C][C][Branch1][Ring1][C][=O][C][Branch1][C][F][Branch1][C][F][F]
CNC(C=O)C(F)(F)F
[C][N][C][Branch1][Ring1][C][=O][C][Branch1][C][F][Branch1][C][F][F]
COC(C=O)C(F)(F)F
[C][O][C][Branch1][Ring1][C][=O][C][Branch1][C][F][Branch1][C][F][F]
OCC(CO)C(F)(F)F
[O][C][C][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F]
CCC(CC)C(F)(F)F
[C][C][C][Branch1][Ring1][C][C][C][Branch1][C][F][Branch1][C][F][F]
CCC(CO)C(F)(F)F
[C][C][C][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F]
CCC(NC)C(F)(F)F
[C][C][C][Branch1][Ring1][N][C][C][Branch1][C][F][Branch1][C][F][F]
CCC(OC)C(F)(F)F
[C][C][C][Branch1][Ring1][O][C][C][Branch1][C][F][Branch1][C][F][F]
CNC(CO)C(F)(F)F
[C][N][C][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F]
COC(CO)C(F)(F)F
[C][O][C][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F]
OCC1(C(F)(F)F)CC1
[O][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#Branch1]
OCC1(C(F)(F)F)CN1
[O][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][N][Ring1][#Branch1]
OCC1(C(F)(F)F)CO1
[O][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][O][Ring1][#Branch1]
CCC1(C(F)(F)F)CC1
[C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#Branch1]
CCC1(C(F)(F)F)CN1
[C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][N][Ring1][#Branch1]
CCC1(C(F)(F)F)CO1
[C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][O][Ring1][#Branch1]
CNC1(C(F)(F)F)CC1
[C][N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#Branch1]
COC1(C(F)(F)F)CC1
[C][O][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#Branch1]
OCC1CC1C(F)(F)F
[O][C][C][C][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F]
OCC1NC1C(F)(F)F
[O][C][C][N][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F]
OCC1OC1C(F)(F)F
[O][C][C][O][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F]
CCC1CC1C(F)(F)F
[C][C][C][C][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F]
CCC1NC1C(F)(F)F
[C][C][C][N][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F]
CCC1OC1C(F)(F)F
[C][C][C][O][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F]
CCN1CC1C(F)(F)F
[C][C][N][C][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F]
COC1CC1C(F)(F)F
[C][O][C][C][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F]
CCN=C(N)C(F)(F)F
[C][C][N][=C][Branch1][C][N][C][Branch1][C][F][Branch1][C][F][F]
COC=NCC(F)(F)F
[C][O][C][=N][C][C][Branch1][C][F][Branch1][C][F][F]
OCCC#CC(F)(F)F
[O][C][C][C][#C][C][Branch1][C][F][Branch1][C][F][F]
CCCC#CC(F)(F)F
[C][C][C][C][#C][C][Branch1][C][F][Branch1][C][F][F]
COCC#CC(F)(F)F
[C][O][C][C][#C][C][Branch1][C][F][Branch1][C][F][F]