Selfies Roberta
Collection
Experimental for training BERT architecture model for drug discovery/
•
9 items
•
Updated
molecule_smiles
stringlengths 1
2.5k
| SELFIES
stringlengths 3
9.88k
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|---|---|
COCCC(C)(C(=O)O)N1C(=O)COCC1=O | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][O][C][C][Ring1][#Branch1][=O] |
COCC(C)(Nc1c(F)cccc1F)C(=O)O | [C][O][C][C][Branch1][C][C][Branch1][=C][N][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=Branch1][C][=O][O] |
COCC(C)(Nc1cccc(F)c1F)C(=O)O | [C][O][C][C][Branch1][C][C][Branch1][=C][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][F][C][=Branch1][C][=O][O] |
COCCC(C)(C(=O)O)n1c(C)csc1=O | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][Branch1][C][C][=C][S][C][Ring1][=Branch1][=O] |
COc1ccc(C(C)S(N)(=O)=O)c(OC)c1 | [C][O][C][=C][C][=C][Branch1][=N][C][Branch1][C][C][S][Branch1][C][N][=Branch1][C][=O][=O][C][Branch1][Ring1][O][C][=C][Ring1][=C] |
CCOc1cccc(CS(N)(=O)=O)c1OC | [C][C][O][C][=C][C][=C][C][Branch1][#Branch2][C][S][Branch1][C][N][=Branch1][C][=O][=O][=C][Ring1][O][O][C] |
COc1ccc(OC)c(C(C)S(N)(=O)=O)c1 | [C][O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][=N][C][Branch1][C][C][S][Branch1][C][N][=Branch1][C][=O][=O][=C][Ring1][=C] |
COCCC(C)(NC(C)C1CCCO1)C(=O)O | [C][O][C][C][C][Branch1][C][C][Branch1][=N][N][C][Branch1][C][C][C][C][C][C][O][Ring1][Branch1][C][=Branch1][C][=O][O] |
CCOc1ccc(CS(N)(=O)=O)cc1OC | [C][C][O][C][=C][C][=C][Branch1][#Branch2][C][S][Branch1][C][N][=Branch1][C][=O][=O][C][=C][Ring1][O][O][C] |
COCCOCCNC1(C(=O)O)CCCCC1 | [C][O][C][C][O][C][C][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C][C][C][Ring1][=Branch2] |
COCCC(C)(C(=O)O)N1CC(C)OC(C)C1 | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][C][Branch1][C][C][O][C][Branch1][C][C][C][Ring1][Branch2] |
COCCC(C)(NCC1CCCOC1)C(=O)O | [C][O][C][C][C][Branch1][C][C][Branch1][O][N][C][C][C][C][C][O][C][Ring1][=Branch1][C][=Branch1][C][=O][O] |
CCC1COCCN1C(C)(CCOC)C(=O)O | [C][C][C][C][O][C][C][N][Ring1][=Branch1][C][Branch1][C][C][Branch1][Branch1][C][C][O][C][C][=Branch1][C][=O][O] |
COCCC(C)(C(=O)O)N1CC(C)OCC1C | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][C][Branch1][C][C][O][C][C][Ring1][#Branch1][C] |
CCOc1cc(CS(N)(=O)=O)ccc1OC | [C][C][O][C][=C][C][Branch1][#Branch2][C][S][Branch1][C][N][=Branch1][C][=O][=O][=C][C][=C][Ring1][O][O][C] |
COCCC(C)(Sc1n[nH]c(C)n1)C(=O)O | [C][O][C][C][C][Branch1][C][C][Branch1][N][S][C][=N][NH1][C][Branch1][C][C][=N][Ring1][=Branch1][C][=Branch1][C][=O][O] |
COCCC(C)(C(=O)O)N1CCOC(C)(C)C1 | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch2] |
COCCC(C)(NCC1CCCCO1)C(=O)O | [C][O][C][C][C][Branch1][C][C][Branch1][O][N][C][C][C][C][C][C][O][Ring1][=Branch1][C][=Branch1][C][=O][O] |
CC1CCCC(NCCOCCO)(C(=O)O)C1 | [C][C][C][C][C][C][Branch1][Branch2][N][C][C][O][C][C][O][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Ring1][S] |
COCCC(C)(C(=O)O)N(C)C1CCOCC1 | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Branch1][C][C][C][C][C][O][C][C][Ring1][=Branch1] |
COCCC(C)(NC1CCCC1OC)C(=O)O | [C][O][C][C][C][Branch1][C][C][Branch1][O][N][C][C][C][C][C][Ring1][Branch1][O][C][C][=Branch1][C][=O][O] |
O=C1NCCCC1Nc1c(O)[nH]c2ccccc12 | [O][=C][N][C][C][C][C][Ring1][=Branch1][N][C][=C][Branch1][C][O][NH1][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1] |
COCCC(C)(NCCC1CCCO1)C(=O)O | [C][O][C][C][C][Branch1][C][C][Branch1][O][N][C][C][C][C][C][C][O][Ring1][Branch1][C][=Branch1][C][=O][O] |
COCCC(C)(Sc1nncn1C)C(=O)O | [C][O][C][C][C][Branch1][C][C][Branch1][#Branch2][S][C][=N][N][=C][N][Ring1][Branch1][C][C][=Branch1][C][=O][O] |
COCCC(C)(C(=O)O)N1CCOCC1(C)C | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][C][O][C][C][Ring1][=Branch1][Branch1][C][C][C] |
O=C(O)C1(NCCOCCO)CCCCCC1 | [O][=C][Branch1][C][O][C][Branch1][Branch2][N][C][C][O][C][C][O][C][C][C][C][C][C][Ring1][=C] |
COCCC(C)(C(=O)O)N(C)CC1CCCO1 | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Branch1][C][C][C][C][C][C][C][O][Ring1][Branch1] |
CCC1CN(C(C)(CCOC)C(=O)O)CCO1 | [C][C][C][C][N][Branch1][S][C][Branch1][C][C][Branch1][Branch1][C][C][O][C][C][=Branch1][C][=O][O][C][C][O][Ring1][#C] |
CCNC(C1=CCCC1)c1ccc2c(c1)OCO2 | [C][C][N][C][Branch1][Branch2][C][=C][C][C][C][Ring1][Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1] |
CC1CCCCC1(NCCOCCO)C(=O)O | [C][C][C][C][C][C][C][Ring1][=Branch1][Branch1][Branch2][N][C][C][O][C][C][O][C][=Branch1][C][=O][O] |
CCC(CC)(CO)NC1(C(=O)O)CCOCC1 | [C][C][C][Branch1][Ring1][C][C][Branch1][Ring1][C][O][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][O][C][C][Ring1][=Branch2] |
Cc1cn2c(CS(N)(=O)=O)c(C)nc2s1 | [C][C][=C][N][C][Branch1][#Branch2][C][S][Branch1][C][N][=Branch1][C][=O][=O][=C][Branch1][C][C][N][=C][Ring1][O][S][Ring1][=C] |
O=C(O)C1(NC2CC2c2ccccc2)CCCC1 | [O][=C][Branch1][C][O][C][Branch1][#C][N][C][C][C][Ring1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][Ring1][#C] |
COCc1[nH]c(C(N)Cc2ccccc2)nc1C | [C][O][C][C][NH1][C][Branch1][=C][C][Branch1][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=Ring1][=C][C] |
COCCC(C)(C(=O)O)N1CCC(OC)CC1 | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][C][C][Branch1][Ring1][O][C][C][C][Ring1][Branch2] |
CNC(C1=CCCCC1)c1ccc2c(c1)OCO2 | [C][N][C][Branch1][=Branch2][C][=C][C][C][C][C][Ring1][=Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1] |
CC1(C)CC1NC1(C(=O)O)Cc2ccccc2C1 | [C][C][Branch1][C][C][C][C][Ring1][Ring2][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N] |
NC(C1=CCCCCC1)c1ccc2c(c1)OCO2 | [N][C][Branch1][#Branch2][C][=C][C][C][C][C][C][Ring1][#Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1] |
CC(NC1CC1c1ccccc1)(C(=O)O)C1CC1 | [C][C][Branch1][#C][N][C][C][C][Ring1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C][Ring1][Ring1] |
NCC1CCCCN1c1c(O)[nH]c2ccccc12 | [N][C][C][C][C][C][C][N][Ring1][=Branch1][C][=C][Branch1][C][O][NH1][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1] |
CC1(C)CC1NC1(C(=O)O)CCc2ccccc21 | [C][C][Branch1][C][C][C][C][Ring1][Ring2][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N] |
NCC1CCN(c2c(O)[nH]c3ccccc23)CC1 | [N][C][C][C][C][N][Branch1][P][C][=C][Branch1][C][O][NH1][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][C][Ring1][S] |
Cc1ccc(C)c2c(N3CCC(N)C3)c(O)[nH]c12 | [C][C][=C][C][=C][Branch1][C][C][C][C][Branch1][O][N][C][C][C][Branch1][C][N][C][Ring1][=Branch1][=C][Branch1][C][O][NH1][C][Ring1][P][=Ring1][N] |
Cc1cc(C)c2[nH]c(O)c(N3CCC(N)C3)c2c1 | [C][C][=C][C][Branch1][C][C][=C][NH1][C][Branch1][C][O][=C][Branch1][O][N][C][C][C][Branch1][C][N][C][Ring1][=Branch1][C][Ring1][N][=C][Ring1][P] |
COC1CCCC1NC1(C(=O)O)CCSC1 | [C][O][C][C][C][C][C][Ring1][Branch1][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][S][C][Ring1][Branch2] |
NS(=O)(=O)C(c1cccs1)C1CCCC1 | [N][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][C][C][C][C][C][Ring1][Branch1] |
NCC1CCCN(c2c(O)[nH]c3ccccc23)C1 | [N][C][C][C][C][C][N][Branch1][P][C][=C][Branch1][C][O][NH1][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][Ring1][S] |
COCCCCNC(C)(CCC(C)C)C(=O)O | [C][O][C][C][C][C][N][C][Branch1][C][C][Branch1][Branch2][C][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
CCc1ccc2[nH]c(O)c(N3CCC(N)C3)c2c1 | [C][C][C][=C][C][=C][NH1][C][Branch1][C][O][=C][Branch1][O][N][C][C][C][Branch1][C][N][C][Ring1][=Branch1][C][Ring1][N][=C][Ring1][S] |
COCCC(C)(NC1(CO)CCCC1)C(=O)O | [C][O][C][C][C][Branch1][C][C][Branch1][=N][N][C][Branch1][Ring1][C][O][C][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][O] |
Cc1cccc2c(N3CCC(CN)C3)c(O)[nH]c12 | [C][C][=C][C][=C][C][C][Branch1][N][N][C][C][C][Branch1][Ring1][C][N][C][Ring1][#Branch1][=C][Branch1][C][O][NH1][C][Ring1][P][=Ring1][=N] |
CCOCC(C)NC(C)(CCC(C)C)C(=O)O | [C][C][O][C][C][Branch1][C][C][N][C][Branch1][C][C][Branch1][Branch2][C][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
Cc1ccc2c(N3CCC(N)C3)c(O)[nH]c2c1C | [C][C][=C][C][=C][C][Branch1][O][N][C][C][C][Branch1][C][N][C][Ring1][=Branch1][=C][Branch1][C][O][NH1][C][Ring1][N][=C][Ring1][S][C] |
COCCC(C)(C(=O)O)N(C)C(C)C(C)(C)C | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Branch1][C][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C] |
CCCC(CCC)(NC(C)COCC)C(=O)O | [C][C][C][C][Branch1][Ring2][C][C][C][Branch1][#Branch2][N][C][Branch1][C][C][C][O][C][C][C][=Branch1][C][=O][O] |
COCCC(C)(C(=O)O)N(C)C(C)CC(C)C | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Branch1][C][C][C][Branch1][C][C][C][C][Branch1][C][C][C] |
COCc1[nH]c(CC(N)c2ccccc2)nc1C | [C][O][C][C][NH1][C][Branch1][=C][C][C][Branch1][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=Ring1][=C][C] |
Cc1nc2scc(C)n2c1CS(N)(=O)=O | [C][C][N][=C][S][C][=C][Branch1][C][C][N][Ring1][=Branch1][C][=Ring1][=Branch2][C][S][Branch1][C][N][=Branch1][C][=O][=O] |
CC(CCNC1CC1)Oc1ccc2c(c1)CCC2 | [C][C][Branch1][=Branch2][C][C][N][C][C][C][Ring1][Ring1][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1] |
Cc1ccc2[nH]c(O)c(N3CCC(CN)C3)c2c1 | [C][C][=C][C][=C][NH1][C][Branch1][C][O][=C][Branch1][N][N][C][C][C][Branch1][Ring1][C][N][C][Ring1][#Branch1][C][Ring1][=N][=C][Ring1][P] |
COc1ccc(C(C)S(N)(=O)=O)cc1OC | [C][O][C][=C][C][=C][Branch1][=N][C][Branch1][C][C][S][Branch1][C][N][=Branch1][C][=O][=O][C][=C][Ring1][N][O][C] |
Cc1cc(C)c2c(N3CCC(N)C3)c(O)[nH]c2c1 | [C][C][=C][C][Branch1][C][C][=C][C][Branch1][O][N][C][C][C][Branch1][C][N][C][Ring1][=Branch1][=C][Branch1][C][O][NH1][C][Ring1][N][=C][Ring1][P] |
CCCCN(CCCC)C(C)(COC)C(=O)O | [C][C][C][C][N][Branch1][Branch1][C][C][C][C][C][Branch1][C][C][Branch1][Ring2][C][O][C][C][=Branch1][C][=O][O] |
FC(F)C(F)(F)COc1cnnc(Cl)n1 | [F][C][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][O][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1] |
CCCCC(C)NC1(C(=O)O)CCSCC1 | [C][C][C][C][C][Branch1][C][C][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][S][C][C][Ring1][=Branch2] |
CCCC(CCC)(NCCCCOC)C(=O)O | [C][C][C][C][Branch1][Ring2][C][C][C][Branch1][Branch2][N][C][C][C][C][O][C][C][=Branch1][C][=O][O] |
CC(CCNC1CC1)OCC=Cc1ccccc1 | [C][C][Branch1][=Branch2][C][C][N][C][C][C][Ring1][Ring1][O][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CCCc1c[nH]c(C(N)CCS(C)(=O)=O)n1 | [C][C][C][C][=C][NH1][C][Branch1][#C][C][Branch1][C][N][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][=N][Ring1][=N] |
CN(CC(C)(C)C)C1(C(=O)O)CCSCC1 | [C][N][Branch1][#Branch2][C][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][S][C][C][Ring1][=Branch2] |
CCCC(CC)NC1(C(=O)O)CCSCC1 | [C][C][C][C][Branch1][Ring1][C][C][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][S][C][C][Ring1][=Branch2] |
CCC(CC)(CO)NC(C)(CC(C)C)C(=O)O | [C][C][C][Branch1][Ring1][C][C][Branch1][Ring1][C][O][N][C][Branch1][C][C][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
COCCC(C)(C(=O)O)N(CC(C)C)C(C)C | [C][O][C][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Branch1][#Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][C] |
COCC(C)(C(=O)O)N(C)c1ccc(F)cc1 | [C][O][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Branch1][C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] |
COCC(C)(C(=O)O)N(C)c1ccccc1F | [C][O][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F] |
NC(CCOCC(F)(F)F)CC1CCCO1 | [N][C][Branch1][=N][C][C][O][C][C][Branch1][C][F][Branch1][C][F][F][C][C][C][C][C][O][Ring1][Branch1] |
CCCCCC(C)NC(C)(CCOC)C(=O)O | [C][C][C][C][C][C][Branch1][C][C][N][C][Branch1][C][C][Branch1][Branch1][C][C][O][C][C][=Branch1][C][=O][O] |
CCCNC1CC(C)Oc2cc(F)cc(F)c21 | [C][C][C][N][C][C][C][Branch1][C][C][O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][Ring1][=N] |
Cc1nnc(Sc2cnnc(Cl)n2)s1 | [C][C][=N][N][=C][Branch1][=N][S][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][S][Ring1][=N] |
COCC(C)(Nc1cccc(F)c1C)C(=O)O | [C][O][C][C][Branch1][C][C][Branch1][=C][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][O] |
N#CCC(Oc1ccccc1F)c1ccccc1 | [N][#C][C][C][Branch1][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=C][C][=C][C][=C][Ring1][=Branch1] |
Cc1ccc(C#N)cc1Nc1cnnc(Cl)n1 | [C][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][N][C][=C][N][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1] |
COCCN(C1CC1)C(C)(CCOC)C(=O)O | [C][O][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Branch1][C][C][Branch1][Branch1][C][C][O][C][C][=Branch1][C][=O][O] |
CCN(Cc1ccco1)C(C)(COC)C(=O)O | [C][C][N][Branch1][=Branch2][C][C][=C][C][=C][O][Ring1][Branch1][C][Branch1][C][C][Branch1][Ring2][C][O][C][C][=Branch1][C][=O][O] |
CC(C)NC1CC(C)Oc2cc(F)cc(F)c21 | [C][C][Branch1][C][C][N][C][C][C][Branch1][C][C][O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][Ring1][=N] |
CCNCCC(C)Oc1ccc(F)cc1Cl | [C][C][N][C][C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Cl] |
NCC1CCCCC1Oc1cc(F)cc(F)c1 | [N][C][C][C][C][C][C][C][Ring1][=Branch1][O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2] |
N#CCC(Oc1ccc(F)cc1)c1ccccc1 | [N][#C][C][C][Branch1][=N][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CCCNC1c2c(F)cc(F)cc2OCC1C | [C][C][C][N][C][C][=C][Branch1][C][F][C][=C][Branch1][C][F][C][=C][Ring1][Branch2][O][C][C][Ring1][N][C] |
N#CCC(Oc1cccc(F)c1)c1ccccc1 | [N][#C][C][C][Branch1][=N][O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] |
COCC(C)(C(=O)O)N(C)Cc1cnn(C)c1 | [C][O][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Branch1][C][C][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1] |
C=CCc1ccccc1OC(C)CCNC1CC1 | [C][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][C][C][N][C][C][C][Ring1][Ring1] |
CCC(C)C(C)(N)CCCOCC(F)(F)F | [C][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][N][C][C][C][O][C][C][Branch1][C][F][Branch1][C][F][F] |
CC(CCNC1CC1)Oc1cc(F)cc(F)c1 | [C][C][Branch1][=Branch2][C][C][N][C][C][C][Ring1][Ring1][O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2] |
COCC(C)(NC(C)Cn1cccn1)C(=O)O | [C][O][C][C][Branch1][C][C][Branch1][=C][N][C][Branch1][C][C][C][N][C][=C][C][=N][Ring1][Branch1][C][=Branch1][C][=O][O] |
COCC(C)(NC(C)Cn1ccnc1)C(=O)O | [C][O][C][C][Branch1][C][C][Branch1][=C][N][C][Branch1][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][=Branch1][C][=O][O] |
CCCCOCCC(CC(F)(F)F)NCC | [C][C][C][C][O][C][C][C][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][N][C][C] |
CCC(N)(CCCOCC(F)(F)F)C(C)C | [C][C][C][Branch1][C][N][Branch1][=C][C][C][C][O][C][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][C][C] |
CCOc1ccc(C)cc1C(=O)c1ccncc1 | [C][C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1] |
COCC(C)(C(=O)O)N(C)Cc1ccoc1C | [C][O][C][C][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Branch1][C][C][C][C][C][=C][O][C][=Ring1][Branch1][C] |
COCC(C)(Sc1ccc(N)cc1)C(=O)O | [C][O][C][C][Branch1][C][C][Branch1][=N][S][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O] |
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Size of downloaded dataset files:
7.06 GB
Size of the auto-converted Parquet files:
7.06 GB
Number of rows:
101,633,378