molecule_smiles
stringlengths 1
1.15k
| SELFIES
stringlengths 3
4.03k
|
|---|---|
Cc1ncc(F)cc1F | [C][C][=N][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] |
Cc1ncc(F)nc1C | [C][C][=N][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][C] |
Cc1ncc(F)nc1F | [C][C][=N][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][F] |
Nc1cc(O)ccc1F | [N][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][F] |
Nc1cc(F)ccc1O | [N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][O] |
Nc1cc(F)ccc1F | [N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F] |
Nc1cc(F)cnc1N | [N][C][=C][C][Branch1][C][F][=C][N][=C][Ring1][#Branch1][N] |
Nc1cc(O)cnc1F | [N][C][=C][C][Branch1][C][O][=C][N][=C][Ring1][#Branch1][F] |
Nc1cc(F)c[nH]c1=O | [N][C][=C][C][Branch1][C][F][=C][NH1][C][Ring1][#Branch1][=O] |
Nc1cc(F)cnc1F | [N][C][=C][C][Branch1][C][F][=C][N][=C][Ring1][#Branch1][F] |
Nc1ccc(N)c(F)c1 | [N][C][=C][C][=C][Branch1][C][N][C][Branch1][C][F][=C][Ring1][Branch2] |
Nc1ccc(N)c(F)n1 | [N][C][=C][C][=C][Branch1][C][N][C][Branch1][C][F][=N][Ring1][Branch2] |
Nc1ccc(F)c(N)c1 | [N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][N][=C][Ring1][Branch2] |
Nc1ccc(F)c(N)n1 | [N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][N][=N][Ring1][Branch2] |
Nc1ccc(O)c(F)c1 | [N][C][=C][C][=C][Branch1][C][O][C][Branch1][C][F][=C][Ring1][Branch2] |
Nc1ccc(F)c(O)c1 | [N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][O][=C][Ring1][Branch2] |
Nc1ccc(F)c(F)c1 | [N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2] |
Nc1ccc(F)c(F)n1 | [N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=N][Ring1][Branch2] |
Nc1ccc(F)cc1N | [N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N] |
Nc1ccc(O)cc1F | [N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][F] |
Nc1ccc(F)cc1O | [N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O] |
Nc1ccc(F)nc1N | [N][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][N] |
Nc1ccc(F)nc1F | [N][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][F] |
Nc1cnc(N)c(F)c1 | [N][C][=C][N][=C][Branch1][C][N][C][Branch1][C][F][=C][Ring1][Branch2] |
Nc1cc(F)c(N)cn1 | [N][C][=C][C][Branch1][C][F][=C][Branch1][C][N][C][=N][Ring1][Branch2] |
Nc1cnc(F)c(N)c1 | [N][C][=C][N][=C][Branch1][C][F][C][Branch1][C][N][=C][Ring1][Branch2] |
Nc1c[nH]c(=O)c(F)c1 | [N][C][=C][NH1][C][=Branch1][C][=O][C][Branch1][C][F][=C][Ring1][Branch2] |
Nc1cnc(F)c(O)c1 | [N][C][=C][N][=C][Branch1][C][F][C][Branch1][C][O][=C][Ring1][Branch2] |
Nc1cnc(F)c(F)c1 | [N][C][=C][N][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2] |
Nc1c[nH]c(=O)c(F)n1 | [N][C][=C][NH1][C][=Branch1][C][=O][C][Branch1][C][F][=N][Ring1][Branch2] |
Nc1c[nH]c(=O)cc1F | [N][C][=C][NH1][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][F] |
Nc1cnc(F)cc1F | [N][C][=C][N][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] |
Nc1c[nH]c(=O)nc1F | [N][C][=C][NH1][C][=Branch1][C][=O][N][=C][Ring1][#Branch1][F] |
Nc1cnc(F)nc1F | [N][C][=C][N][=C][Branch1][C][F][N][=C][Ring1][#Branch1][F] |
Nc1nc(F)c[nH]c1=O | [N][C][=N][C][Branch1][C][F][=C][NH1][C][Ring1][#Branch1][=O] |
Nc1nc(F)ncc1O | [N][C][=N][C][Branch1][C][F][=N][C][=C][Ring1][#Branch1][O] |
Nc1cc(F)c(O)cn1 | [N][C][=C][C][Branch1][C][F][=C][Branch1][C][O][C][=N][Ring1][Branch2] |
Nc1cc(F)c(F)cn1 | [N][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=N][Ring1][Branch2] |
Nc1ncc(O)c(F)n1 | [N][C][=N][C][=C][Branch1][C][O][C][Branch1][C][F][=N][Ring1][Branch2] |
Nc1ncc(O)cc1F | [N][C][=N][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][F] |
Nc1ncc(F)cc1O | [N][C][=N][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O] |
Nc1ncc(F)cc1F | [N][C][=N][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] |
Nc1ncc(F)nc1N | [N][C][=N][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][N] |
Nc1ncc(F)nc1F | [N][C][=N][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][F] |
Oc1ccc(O)c(F)c1 | [O][C][=C][C][=C][Branch1][C][O][C][Branch1][C][F][=C][Ring1][Branch2] |
Oc1ccc(F)c(O)c1 | [O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][O][=C][Ring1][Branch2] |
Oc1ccc(F)c(F)c1 | [O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2] |
Oc1ccc(F)cc1O | [O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O] |
Oc1ccc(F)cc1F | [O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] |
Oc1cc(F)ccc1F | [O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F] |
Fc1ccc(F)c(F)c1 | [F][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2] |
O=c1[nH]c(O)ccc1F | [O][=C][NH1][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][F] |
O=c1ccc(F)c(F)[nH]1 | [O][=C][C][=C][C][Branch1][C][F][=C][Branch1][C][F][NH1][Ring1][Branch2] |
O=c1[nH]c(F)ccc1O | [O][=C][NH1][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][O] |
Oc1ccc(F)nc1F | [O][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][F] |
O=c1[nH]c(F)ccc1F | [O][=C][NH1][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F] |
Fc1ccc(F)c(F)n1 | [F][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=N][Ring1][Branch2] |
O=c1[nH]cc(O)cc1F | [O][=C][NH1][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][F] |
Oc1cnc(F)c(O)c1 | [O][C][=C][N][=C][Branch1][C][F][C][Branch1][C][O][=C][Ring1][Branch2] |
Oc1cnc(F)c(F)c1 | [O][C][=C][N][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2] |
O=c1[nH]cc(F)cc1O | [O][=C][NH1][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O] |
O=c1[nH]cc(F)cc1F | [O][=C][NH1][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] |
Fc1cnc(F)c(F)c1 | [F][C][=C][N][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2] |
O=c1[nH]cc(O)nc1F | [O][=C][NH1][C][=C][Branch1][C][O][N][=C][Ring1][#Branch1][F] |
O=c1[nH]c(O)cnc1F | [O][=C][NH1][C][Branch1][C][O][=C][N][=C][Ring1][#Branch1][F] |
O=c1cnc(F)c(F)[nH]1 | [O][=C][C][=N][C][Branch1][C][F][=C][Branch1][C][F][NH1][Ring1][Branch2] |
O=c1[nH]cc(F)[nH]c1=O | [O][=C][NH1][C][=C][Branch1][C][F][NH1][C][Ring1][#Branch1][=O] |
O=c1[nH]cc(F)nc1F | [O][=C][NH1][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][F] |
O=c1[nH]c(F)cnc1F | [O][=C][NH1][C][Branch1][C][F][=C][N][=C][Ring1][#Branch1][F] |
Fc1cnc(F)c(F)n1 | [F][C][=C][N][=C][Branch1][C][F][C][Branch1][C][F][=N][Ring1][Branch2] |
O=c1cc(F)c(O)c[nH]1 | [O][=C][C][=C][Branch1][C][F][C][Branch1][C][O][=C][NH1][Ring1][Branch2] |
Oc1cnc(F)cc1F | [O][C][=C][N][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] |
O=c1cc(O)[nH]cc1F | [O][=C][C][=C][Branch1][C][O][NH1][C][=C][Ring1][#Branch1][F] |
O=c1cc(F)c(F)c[nH]1 | [O][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][NH1][Ring1][Branch2] |
O=c1cc(F)[nH]cc1F | [O][=C][C][=C][Branch1][C][F][NH1][C][=C][Ring1][#Branch1][F] |
Fc1cc(F)c(F)cn1 | [F][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=N][Ring1][Branch2] |
O=c1nc(F)c(O)c[nH]1 | [O][=C][N][=C][Branch1][C][F][C][Branch1][C][O][=C][NH1][Ring1][Branch2] |
O=c1[nH]c(F)ncc1O | [O][=C][NH1][C][Branch1][C][F][=N][C][=C][Ring1][#Branch1][O] |
O=c1nc(F)c(F)c[nH]1 | [O][=C][N][=C][Branch1][C][F][C][Branch1][C][F][=C][NH1][Ring1][Branch2] |
O=c1[nH]c(F)ncc1F | [O][=C][NH1][C][Branch1][C][F][=N][C][=C][Ring1][#Branch1][F] |
Fc1ncc(F)c(F)n1 | [F][C][=N][C][=C][Branch1][C][F][C][Branch1][C][F][=N][Ring1][Branch2] |
O=Cc1ccc(F)cn1 | [O][=C][C][=C][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1] |
O=Cc1cnc(F)cn1 | [O][=C][C][=C][N][=C][Branch1][C][F][C][=N][Ring1][#Branch1] |
O=Cc1ncc(F)cn1 | [O][=C][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1] |
O=Cc1ccc(F)nc1 | [O][=C][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1] |
O=Cc1cnc(F)nc1 | [O][=C][C][=C][N][=C][Branch1][C][F][N][=C][Ring1][#Branch1] |
C#Cc1ccc(F)cc1 | [C][#C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] |
N#Cc1ccc(F)cc1 | [N][#C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] |
C#Cc1ccc(F)cn1 | [C][#C][C][=C][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1] |
N#Cc1ccc(F)cn1 | [N][#C][C][=C][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1] |
C#Cc1cnc(F)cn1 | [C][#C][C][=C][N][=C][Branch1][C][F][C][=N][Ring1][#Branch1] |
N#Cc1cnc(F)cn1 | [N][#C][C][=C][N][=C][Branch1][C][F][C][=N][Ring1][#Branch1] |
C#Cc1ncc(F)cn1 | [C][#C][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1] |
N#Cc1ncc(F)cn1 | [N][#C][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1] |
C#Cc1ccc(F)nc1 | [C][#C][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1] |
N#Cc1ccc(F)nc1 | [N][#C][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1] |
C#Cc1cnc(F)nc1 | [C][#C][C][=C][N][=C][Branch1][C][F][N][=C][Ring1][#Branch1] |
N#Cc1cnc(F)nc1 | [N][#C][C][=C][N][=C][Branch1][C][F][N][=C][Ring1][#Branch1] |
Cc1cccc(F)c1C | [C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C] |
Cc1nccc(F)c1C | [C][C][=N][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C] |