chembl_id
stringlengths 7
13
| selfies
stringlengths 3
6.7k
|
|---|---|
CHEMBL4288526
|
[C][O][C][=C][C][=C][C][Branch2][Branch1][C][C][=N+1][C][=C][Ring1][=Branch1][C][=C][Branch1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][C][=Branch1][S][=C][C][=Branch1][#Branch1][=C][Ring1][=Branch1][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][#Branch1][O][C][O][Ring1][#Branch2][=C][Ring2][Ring1][P][O][C].[Br-1]
|
CHEMBL4288613
|
[O][=C][Branch1][C][O][C][=C][C][=N][C][Branch2][Ring1][P][N][N][=C][C][=C][Ring1][Branch1][O][C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][O][O][C][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][=N][=C][Ring2][Ring1][#Branch2]
|
CHEMBL4288614
|
[C][C@@H1][C][C][C@H1][C@@H1][Branch1][C][C][C@@H1][Branch2][#Branch1][Ring1][O][C][C][N][C][C][N][Branch2][=Branch1][Ring2][C][=C][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][O][N][C][C][C][C][O][C][C][Ring1][=Branch1][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][P][C][Branch1][#C][O][C][=C][N][=C][NH1][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][=C][Ring2][Ring2][#Branch1][C][C][Ring2][Ring2][=N][O][C@@H1][O][C@@][Branch1][C][C][C][C][C@@H1][Ring2][Branch1][#C][C@@][Ring2][Branch1][=N][Ring1][Branch2][O][O][Ring1][Branch2]
|
CHEMBL4288615
|
[O][=C][Branch2][Ring1][=Branch2][N][C][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][Cl][=C][Ring1][N][C][=C][C][=C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][N][=C][N][=C][Ring1][=Branch1][C][Branch1][C][F][=C][Ring1][P]
|
CHEMBL4288616
|
[C][C][S][C][Branch1][#C][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][N][=C][C][=Ring1][#C][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][C][Ring1][=Branch1]
|
CHEMBL4288617
|
[C][=C][C][C@@][Branch1][C][C][C@@H1][Branch2][Branch1][#C][C][C][C@][Branch1][C][C][C@@H1][Ring1][Branch2][C][C][=C][C@@H1][C@@H1][Branch1][C][C][C@H1][Branch1][C][C][C][C][C@][Ring1][Branch2][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][C@][Ring2][Ring1][O][Ring2][Ring1][S][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring2][N][=O]
|
CHEMBL4288618
|
[C][C][N][Branch1][Ring1][C][C][C][C][=C][C][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][O][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C][=C][C][=C][Branch1][=Branch2][C][N][Branch1][Ring1][C][C][C][C][C][Branch1][C][O][=C][Ring1][=N][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][O][C][C][Ring2][Ring2][Ring2]
|
CHEMBL4288697
|
[O][=C][C][=Branch1][C][=O][N][Branch2][Ring1][=N][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Ring2][Ring1][=N]
|
CHEMBL4288698
|
[C][C][S][C][Branch2][Ring1][=Branch2][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][Branch1][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][=C][C][=Ring2][Ring1][Ring1][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][C][Cl][S][Ring1][=Branch1]
|
CHEMBL4288699
|
[C][=C][C][=Branch1][C][=O][O][C@H1][C@H1][Ring1][=Branch1][C][C][/C][Branch2][Ring1][=C][C][N][C][=C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][O][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][N][=N][Ring1][P][=C][\C][C][C@@][Branch1][C][C][O][C@H1][Ring2][Ring1][=C][Ring1][Ring2]
|
CHEMBL4288700
|
[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][Branch2][C][=N][O][C][Branch1][#C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][=N][Ring1][=N][C][=C][Ring2][Ring1][Ring1]
|
CHEMBL4288701
|
[C][C][Branch1][C][C][=C][C][C][C@][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][O][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][NH1][C][=C][Branch1][P][C@@H1][C][=C][Branch1][C][C][C][C][C@H1][Ring1][#Branch1][C][Branch1][C][C][C][C][Branch1][C][O][=C][C][=C][Ring1][P][Ring2][Ring1][Ring2][O][Ring2][Ring1][=C]
|
CHEMBL4288702
|
[O][=C][Branch1][Ring1][N][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][Se][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Ring1][=N][=O][C][=C][Ring2][Ring1][Branch1]
|
CHEMBL4288787
|
[C][C][Branch1][C][C][C@@H1][C][C][C@@][Ring1][=Branch1][Branch1][C][C][/C][=Branch1][Branch2][=N][/N][C][Branch1][C][N][=S][C][Ring1][N]
|
CHEMBL4288788
|
[C][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][O][C][=N][C][=N][C][Branch1][=N][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][Ring2][Ring1][C][Ring1][=C]
|
CHEMBL4288789
|
[C][C][C][Branch1][Ring1][C][C][C@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C@@H1][C@H1][Branch2][Ring1][#C][O][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C@H1][Ring2][Ring1][N][N][C][=Branch1][C][=N][N]
|
CHEMBL4288790
|
[C][C][Branch1][C][C][O][C][=C][C][C][Branch1][S][N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][Branch1][C][N][O][C][=Ring1][#C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring2][Ring1][=Branch2]
|
CHEMBL4288791
|
[C][C][N][C][C][=Branch1][C][=O][N][C][C][=C][Branch2][Ring1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][O][C][=C][Ring1][#Branch2][C][C][Ring2][Ring1][Branch2][C][Ring2][Ring1][=N][=O]
|
CHEMBL4283387
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch2][Ring1][#Branch2][C][C][Branch1][C][O][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#Branch1]
|
CHEMBL4283388
|
[C][O][C][=Branch1][C][=O][C@][C][C][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Ring1][Branch2][C][=C][C][C@@H1][C@@][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][O][C][C][C@@][Ring1][#C][Branch1][C][C][C@][Ring2][Ring1][Ring2][Branch1][C][C][C][C][Ring2][Ring1][#C]
|
CHEMBL4283389
|
[C][C][=C][C][Branch1][O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][Ring1][=N][C]
|
CHEMBL4283390
|
[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch2][Ring1][=N][/C][=C][/C][=Branch1][C][=O][N][C][C][C][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Ring2][Ring1][=C][O]
|
CHEMBL4283391
|
[C][C][=C][C][Branch2][Ring1][=C][O][C][C][C][N][C][C][N][Branch1][S][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][C][Ring1][#C][=C][C][Branch1][C][C][=C][C][=Branch1][C][=O][O][C][Ring1][Branch2][=C][Ring2][Ring1][#C]
|
CHEMBL4283471
|
[O][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Ring1][C@@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][C][C][Ring1][S]
|
CHEMBL4283472
|
[C][C][=Branch1][C][=O][C][S][C][Branch2][Ring2][Ring1][N][/N][=C][/C][=C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][Ring2][Ring1][Ring2][=O][=N][C][=Ring2][Ring1][N][C]
|
CHEMBL4283473
|
[C][C][C][=C][C][=C][Branch2][Ring2][Ring2][C@H1][C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][C@H1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][N][Ring1][=Branch2][Ring2][Ring1][Ring2][S][Ring2][Ring1][=Branch2]
|
CHEMBL4283474
|
[O][=C][Branch2][Ring1][=C][N][C][=C][N][=C][C][Branch2][Ring1][C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][S][Ring1][O][=C][Ring1][P][C][=C][Branch1][C][F][C][=C][Branch1][C][F][C][=C][Ring1][Branch2][F]
|
CHEMBL4283558
|
[C][C][=N][N][Branch1][C][C][C][Branch1][=N][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][Ring1][=C][/C][=N][\O][C][C][=C][Branch1][C][Cl][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=N][N][Ring1][=N][C]
|
CHEMBL4283559
|
[N-1][=N+1][=N][C][C][O][C][C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][=C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][O][Ring1][N][C][=C][Ring2][Ring1][C]
|
CHEMBL4283560
|
[C][O][C][=C][C][Branch2][Ring1][O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][=C][C][=C][Ring2][Ring1][Ring2][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C@H1][C][=C][C][=Branch1][S][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][C][N][Ring1][N][C][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][C][=C][Ring1][#Branch2][C@H1][Branch1][Branch1][C][Ring2][Ring2][Branch1][N][Branch1][C][C][C][C][Ring1][Branch2]
|
CHEMBL4283561
|
[C][#C][C][N][Branch1][Ring2][C][C][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4283562
|
[C][O][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring2][=Branch2][C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][=C][C][=C][C][Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][#N][=C][N][Ring2][Ring1][Branch2][Ring1][=C][C][C][Ring2][Ring1][#C]
|
CHEMBL4283563
|
[C][O][C][=C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][=C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][=C][C][=C][Ring1][#C][Ring2][Ring1][Ring2][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][=C][O][C]
|
CHEMBL4283649
|
[C][C][N][Branch1][Ring1][C][C][C][=C][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=N][N][Ring1][Branch2][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][Ring2][Ring1][=Branch2][=C][Ring2][Ring1][=N]
|
CHEMBL4283650
|
[O][=S][=Branch1][C][=O][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][N][C][C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O]
|
CHEMBL4283651
|
[O][=C][Branch1][#C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][N][C][C][C][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N]
|
CHEMBL4283652
|
[C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][C][C][C][N][=C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][S][C][=Ring2][Ring1][C][C][Ring2][Ring1][=Branch1]
|
CHEMBL4283653
|
[C][C][=Branch1][C][=O][O][C@H1][C][=Branch1][C][=O][C@][C][C@H1][Ring1][Ring1][C][C@H1][O][C][C@@][Ring1][Ring2][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Ring1][=N][C@H1][Branch1][P][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C@][Branch1][C][O][C][C@H1][Branch2][Ring2][Ring1][O][C][=Branch1][C][=O][C@H1][Branch1][C][O][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][=C][Ring2][Branch1][=Branch1][C][Ring2][Ring1][N][Branch1][C][C][C]
|
CHEMBL4283654
|
[C][O][C][=C][C][=C][Branch2][Ring2][Branch1][C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][C][C][C][C][C][Branch1][=C][C][C][Branch1][C][O][Branch1][Ring2][C][Ring1][#Branch1][C][Ring1][#Branch2][C][Ring1][O][S][Ring2][Ring1][C][C][=N][Ring2][Ring1][Branch2]
|
CHEMBL4283733
|
[C][C][N][Branch2][Ring1][#C][C][C][O][C][=C][C][=C][Branch1][P][/C][=C][\C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][=C][Ring2][Ring1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4283734
|
[C][C][C][C][C][C][C][C][O][C@@H1][C@@H1][Branch2][Ring1][Branch1][O][C@H1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][C@H1][Branch1][C][N][C][C@H1][Branch1][C][N][C@H1][Ring2][Ring1][Ring2][O][C@H1][O][C@H1][Branch1][Ring1][C][N][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][N]
|
CHEMBL4283735
|
[C][O][C][=C][C][Branch1][Ring1][O][C][=C][C][=Branch1][C][=O][C][Branch2][Ring1][P][O][C][C][C][O][C][=C][C][=C][Branch1][P][/C][=C][/C][=Branch1][C][=O][/C][=C][/C][S][C][=N][C][=Ring1][Branch1][C][C][=C][Ring2][Ring1][C][=C][Branch2][Ring1][Branch1][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][O][C][Ring2][Ring2][#Branch2][=C][Ring2][Ring2][S]
|
CHEMBL4283736
|
[C][=C][Branch1][C][C][C@@H1][C][C][C@][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C@][Branch1][C][C][C@H1][Branch2][=Branch1][#C][C][C][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch1][C][O][C@@][Branch1][C][C][Branch2][Ring2][=N][C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][Branch2][N][Branch1][Ring1][C][C][C][C][C][=C][Ring1][O][O][C][Ring1][#C][=O][C@@H1][Ring2][Ring2][#Branch1][C][C][C@][Ring2][Ring2][O][Ring2][Ring2][S][C][C@@H1][Ring2][Branch1][O][Ring2][Branch1][Branch2]
|
CHEMBL4283737
|
[C][C][C@H1][O][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][Ring1][O][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][Branch1][O][C@@H1][O][C@H1][Branch1][C][C][C][C@H1][Branch1][=Branch1][N][Branch1][C][C][C][C@H1][Ring1][#Branch2][O][C@][Branch1][C][C][Branch1][Ring1][O][C][C][C@@H1][Branch1][C][C][/C][=Branch1][=N][=N][/O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@][Ring2][Branch1][=Branch2][Branch1][C][C][O]
|
CHEMBL4283738
|
[O][=S][=Branch1][C][=O][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][N][Branch1][=Branch2][C][C][=C][C][=C][O][Ring1][Branch1][C][C][Branch1][C][O][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N]
|
CHEMBL4283739
|
[C][O][C][=C][C][Branch1][C][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][C][=C][Ring1][O][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][=N][C][=N][N][=C][N][Ring1][Branch1][C][Branch1][C][C][C][=N][Ring1][=C]
|
CHEMBL4283740
|
[O][=C][Branch2][Ring1][Branch1][N][/N][=C][/C][=C][C][=C][N][Ring1][Branch1][C][C][C][N][C][C][C][C][Ring1][Branch1][N][C][=C][C][=C][Branch1][#C][O][C][=C][C][=N][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C][Branch1][C][F][=C][Ring1][P]
|
CHEMBL4283741
|
[C][/C][=C][Branch1][C][/C][C][=Branch1][C][=O][O][C][C][Branch1][C][C][C@@H1][C][C@@H1][Branch1][C][C][C@@][C][=C][Branch1][C][C][C@H1][Branch1][N][O][C][=Branch1][C][=O][/C][Branch1][C][C][=C][\C][C@@][Ring1][=N][Branch1][C][O][C@H1][Branch1][C][O][C][Branch1][Branch2][C][O][C][Branch1][C][C][=O][=C][C@H1][Branch1][=Branch1][C][Ring2][Ring1][=Branch2][=O][C@@H1][Ring2][Ring1][#C][Ring2][Ring1][P]
|
CHEMBL4283742
|
[N][=C][Branch1][C][N][N][C][=N][C][Branch2][=Branch2][O][C][=C][C][=C][Branch2][Branch2][#C][N][C][C][N][Branch2][Branch2][Ring1][C][C][O][C][C][O][C][C][O][C][C][N][C][=Branch1][C][=O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][C][=Branch1][C][=O][N][C][C][O][C][C][O][C][C][O][C][C][N][C][C][N][Branch2][Ring2][=Branch1][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=C][Branch1][C][Cl][C][=C][C][=N][C][Branch1][#Branch1][N][C][=Branch1][C][=N][N][=N][C][=C][Ring1][#C][Ring1][#Branch2][C][=C][Ring2][Ring1][Branch1][C][C][Ring2][Ring1][O][C][C][Ring2][=Branch1][=C][C][=C][Ring2][#Branch1][Ring2][=C][C][=C][Branch1][C][Cl][C][=C][C][Ring1][#Branch1][=N][Ring2][#Branch1][#C]
|
CHEMBL4283826
|
[C][N][C][=N][C][=C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][=N][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=N][N][Ring2][Ring1][#Branch2][Ring1][#Branch2]
|
CHEMBL4283827
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][Ring1][Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch2][O][C][N][C][=Branch1][C][=O][C@@H1][Branch2][#Branch2][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][=C][N][=C][NH1][Ring1][Branch1][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][#C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][#Branch1][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@H1][Branch2][Branch1][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C]
|
CHEMBL4283828
|
[C][O][C][=Branch1][C][=O][N][C@H1][C][C@@H1][C][C][C@@H1][Branch1][C][C][C@@][Branch1][C][O][Branch1][Ring2][O][Ring1][Branch2][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][O][C@H1][Branch2][Ring1][Branch1][C@H1][Branch1][C][C][C][C@@H1][C][C][C@@H1][Branch1][C][O][C@H1][Branch1][Ring1][O][C][C][Ring1][=Branch2][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][/C][=C][Branch1][C][\C][C@@H1][Branch1][C][O][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C@H1][Branch1][C][C][/C][=C][/C][=C][/C][=C][-/Ring2][Branch1][=C][C]
|
CHEMBL4283829
|
[C][C][Branch1][C][F][Branch1][C][F][C][=C][S][C][Branch2][Ring2][N][C][=N][C][Branch1][S][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][=N][C][Branch1][S][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][=N][Ring2][Ring1][Branch2][=N][Ring2][Ring1][=N]
|
CHEMBL4283830
|
[C][C][O][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch2][Ring1][=Branch2][C][O][C][=C][C][=C][N][=C][Branch1][Branch2][N][C][=Branch1][C][=O][O][C][S][C][Ring1][#Branch2][=C][Ring1][=C][O][Ring2][Ring1][Branch1]
|
CHEMBL4283916
|
[C][C][=Branch1][C][=O][N][C][=N][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][Branch1][#Branch2][C][C][C][C][C][C][C][Ring1][Branch2][S][Ring1][#C]
|
CHEMBL4283917
|
[C][=C][C][=C][Branch2][Ring1][S][C][C][C][C][N][Branch2][Ring1][Ring1][C][C][C][O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][C][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][O]
|
CHEMBL4283918
|
[C][N][Branch2][Ring1][O][C][C][N][C][=N][C][Branch1][S][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2][=C][Ring1][=C][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2]
|
CHEMBL4283920
|
[C][#C][C][N][C][=C][Branch1][#Branch2][C][N][C][C][C][C][C][Ring1][=Branch1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring1][P]
|
CHEMBL4283993
|
[O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch2][Ring2][#Branch2][C][=N][N][Branch1][=C][C][=Branch1][C][=S][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][P][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][C][Ring2][Ring1][Branch2][C][=C][Ring2][Ring1][=C]
|
CHEMBL4283994
|
[C][C][O][C][=Branch1][C][=O][C][C@H1][C][C][C][=Branch1][C][=O][/C][Ring1][=Branch1][=C][/C][C][C][C][C][C][Ring1][=Branch1]
|
CHEMBL4283995
|
[C][O][C][=C][C][Branch2][Ring1][=Branch2][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][Branch1][C][O][C][=C][Ring1][Branch2][O][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][=Branch1][O][C]
|
CHEMBL4283996
|
[C][O][C][=C][C][Branch1][Ring1][O][C][=C][S][C][Branch2][Ring2][#Branch1][C][=C][C][=C][Branch2][Ring1][O][N][/C][=C][\C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][O][C][=C][Ring2][Ring1][=Branch1][=N][C][Ring2][Ring1][O][=C][Ring2][Ring1][P]
|
CHEMBL4283997
|
[C][C][=Branch1][C][=O][O][C@H1][C][C@H1][C@H1][Branch2][Ring1][=C][C][C][C@][Branch1][C][C][C@@H1][Branch1][=N][C@H1][Branch1][C][C][C][C][C][C][Branch1][C][C][C][C][C][C@H1][Ring2][Ring1][C][Ring1][=C][C@@][Branch1][C][C][C][C][C][C@@H1][Branch1][C][O][C@][Ring2][Ring1][N][Ring1][Branch2][O]
|
CHEMBL4283998
|
[C][N][Branch2][Ring1][O][C][C][N][C][=N][C][Branch1][S][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2][=C][Ring1][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4284078
|
[C][C][C][=N][C][=C][Branch2][Ring2][#Branch2][O][C][=C][C][=C][Branch2][Ring1][N][N][C][=Branch1][C][=O][C][=C][C][=C][N][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring1][=N][=O][C][=C][Ring2][Ring1][#Branch1][F][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][N][=C][Ring2][Ring2][Branch1][NH1][Ring2][Ring2][Branch2]
|
CHEMBL4284079
|
[C][N][C][=C][N][=C][Ring1][Branch1][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][NH1][C][=Branch1][C][=O][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=C][Ring1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
CHEMBL4284080
|
[C][=C][C][C][C@H1][C@@][Branch1][C][C][Branch2][Ring1][O][C][C][C@@H1][Branch1][C][O][C@@][Ring1][Branch2][Branch1][C][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Ring2][Ring1][#Branch1][C][/C][=C][\C][=C][O][C][Ring1][Branch1][=O]
|
CHEMBL4284081
|
[O][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][#Branch2][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][=C][C@H1][C][C@H1][Branch1][N][C][N][C][C][C][C][C@H1][Ring1][#Branch2][Ring1][=Branch1][C@@H1][Ring1][=N][Ring1][P]
|
CHEMBL4284082
|
[C][=C][C][C][=C][C][=C][Branch1][Branch2][O][C][=Branch1][C][=O][C][=C][C][Branch2][Ring1][Branch1][C][=C][C][Branch1][Ring2][C][C][=C][=C][C][=C][Ring1][=Branch2][O][C][=Branch1][C][=O][C][=C][=C][Ring2][Ring1][=Branch2]
|
CHEMBL4284083
|
[C][C][C][C][C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=N][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][S][Ring1][#Branch2][Branch1][#Branch1][C][C][C][Ring2][Ring1][Branch1][C][Ring2][Ring1][=Branch1]
|
CHEMBL4284165
|
[O][=C][Branch2][Ring1][Branch2][N][C][C][C][C][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][C][=C][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][O][Ring1][N]
|
CHEMBL4284166
|
[C][C][C][Branch1][C][C][N][N][=C][N][Branch2][Branch1][S][C][=C][C][=C][Branch2][Branch1][Ring2][N][C][C][N][Branch2][Ring2][Branch2][C][=C][C][=C][Branch2][Ring1][N][O][C][C@@H1][C][O][C@@][Branch1][Ring1][C][C][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][O][Ring1][#C][C][=C][Ring2][Ring1][#Branch1][C][C][Ring2][Ring1][=N][C][=C][Ring2][Ring2][Ring1][C][Ring2][Ring2][Branch2][=O]
|
CHEMBL4284167
|
[O][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][=C][O][C][=C][Branch1][C][O][C][Branch1][C][O][=C][C][=C][Ring2][Ring1][=Branch1][Ring1][Branch2]
|
CHEMBL4284168
|
[C][O][C][=C][C][=C][Branch2][Ring1][Ring1][/C][=C][/C][=C][C][=C][C][Branch1][#Branch1][C][=C][N][Ring1][Branch1][C][=C][Ring1][#Branch2][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][Ring2][O][C]
|
CHEMBL4284169
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][C][#C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch2][#Branch2][#C][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch2][P][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][=C][N][=C][NH1][Ring1][Branch1][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][#C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][#Branch1][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@H1][Branch2][Branch1][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C]
|
CHEMBL4284254
|
[Br][C][=C][C][=C][N][=C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][C][=N][N][=N][N][Ring1][Branch1][C][Ring1][#C][=C][Ring2][Ring1][Ring1]
|
CHEMBL4284255
|
[C][C][=C][C][=C][Branch2][Ring2][#Branch2][N][N][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][O][C][Ring1][=N][=O][C][=C][Ring2][Ring1][#C]
|
CHEMBL4284256
|
[N][C][=N][C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][=C][N][Ring1][#Branch2][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][S][Ring1][O]
|
CHEMBL4284257
|
[C][C][O][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][N+1][=Branch1][C][=O][O-1]
|
CHEMBL4284339
|
[C][N][Branch1][C][C][C][C][C][O][C][=C][C][=C][Branch1][P][/C][=C][\C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][=C][Ring2][Ring1][C]
|
CHEMBL4284340
|
[C][O][C][=C][C][=C][Branch2][Branch1][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][N][C@H1][Branch1][#Branch1][C][N][Branch1][C][C][C][C@H1][Branch2][Ring1][Branch1][C][=C][C][=C][Branch1][O][C][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][C@@H1][Ring2][Ring1][=Branch1][C][Ring2][Ring1][N][C][=C][Ring2][Ring2][Branch1]
|
CHEMBL4284341
|
[O][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C][Branch1][C][Cl][Cl]
|
CHEMBL4284342
|
[C][O][C][=C][C][=C][Branch1][S][S][C][=Branch1][C][=S][N][C][C][/C][=C][/S+1][Branch1][C][C][O-1][C][=C][Ring1][P]
|
CHEMBL4284343
|
[C][N+1][Branch1][C][C][Branch1][=N][C][C][#C][C][O][C][C][=C][O][N][=Ring1][Branch1][C][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O].[Br-1].[Br-1]
|
CHEMBL4284344
|
[C][O][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][C@@][Branch1][C][C][C@@H1][C][C][C@@][Branch1][C][C][C][C@@][Ring1][#Branch1][Branch2][Ring1][=Branch1][C][=C][Ring1][=Branch1][C][=C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][O][C][C][C@@H1][Ring2][Ring1][=Branch2][Ring2][Ring1][=C]
|
CHEMBL4284345
|
[O][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][Branch2][Ring1][=N][C][C][N][C][Branch1][Ring1][C][O][C][=C][C][=C][Branch1][C][O][C][NH1][C][=Branch1][C][=O][C][=C][C][Ring1][N][=Ring1][#Branch1][C][=C][Ring2][Ring1][Branch2]
|
CHEMBL4284346
|
[O][=C][C@H1][C@@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][Branch1][C@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][Ring1][O][C][C][C][C][N][C][C][N][Branch1][=C][C][=C][C][=C][C][S][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C][C][Ring1][#C]
|
CHEMBL4284428
|
[C][C][C][C][=C][C][=C][Branch2][Ring1][=N][N][C][C][N][Branch2][Ring1][C][C][=N][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][NH1][Ring1][=Branch2][C][C][Ring1][#C][N][=C][N][=C][Ring2][Ring1][Branch1][S][Ring2][Ring1][Branch2]
|
CHEMBL4284429
|
[O][=C][Branch1][C][O][C][=C][C][=N][C][Branch2][Ring1][Branch2][N][N][=C][C][=C][Ring1][Branch1][O][C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][Ring2][Ring1][Branch1]
|
CHEMBL4284430
|
[C][C][=N][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][=C][C][=C][N][=C][Branch1][P][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][N][=C][Branch1][=C][N][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][Ring2][Ring1][=Branch2][=C][Ring2][Ring1][=N]
|
CHEMBL4284431
|
[N][#C][C][Branch2][Branch1][#Branch2][C][=C][C][Branch2][Ring2][=C][N][C][=N][C][Branch1][=C][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][=N][C][Branch2][Ring1][C][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][=Branch2][=N][Ring2][Ring1][=Branch1][=C][C][=N][Ring2][Ring1][=N][C][C][Ring2][Ring1][S]
|
CHEMBL4284432
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][Branch2][Branch2][=N][C][O][C][=Branch1][C][=O][C@][C][C][C][Branch1][C][C][Branch1][C][C][C][C@H1][Ring1][Branch2][C][=C][C][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch2][Ring2][O][O][C@@H1][O][C@H1][Branch2][Ring1][C][C][O][C@@H1][O][C][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][Ring1][Branch2][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring1][Ring1][N][C][Branch1][C][C][=O][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring2][Ring1][P][C][C][C@@][Ring2][Ring2][Branch1][Branch1][C][C][C@][Ring2][Ring2][#Branch2][Branch1][C][C][C][C][Ring2][Branch1][Branch1][N][=N][Ring2][Branch1][=C]
|
CHEMBL4284433
|
[C][C][=N][C][Branch2][Ring1][Ring1][N][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][O][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring2][Ring1][Ring2][O]
|
CHEMBL4284513
|
[C][O][C][=C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][O][C][=C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][Branch1][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Br][C][=C][Ring1][=C][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][=N][N+1][=Branch1][C][=O][O-1]
|
CHEMBL4284514
|
[C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=N][N][=C][C][Branch1][C][C][=C][Ring1][#Branch2][O][C][C][C][C][C][O][C][=C][Branch1][C][C][C][=C][Branch1][=Branch1][C][=Branch1][C][=N][N][C][=C][Ring1][#Branch2][C].[Cl].[Cl]
|
CHEMBL4284515
|
[C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][C@@H1][Branch1][C][O][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C@H1][Ring1][#Branch2][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C][O]
|
CHEMBL4284516
|
[O][=C][Branch2][Ring1][N][/C][=C][/C][=C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring1][O][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
CHEMBL4284593
|
[C][O][C][=C][C][=C][Branch2][Ring2][Ring1][C][C][N][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][C][=C][Ring2][Ring1][N]
|
CHEMBL4284594
|
[C][O][C][C][O][C][C][Branch1][C][C][N][C][=N][C][Branch1][O][N][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][=N][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][#Branch2][=N][Ring2][Ring1][=Branch1]
|
CHEMBL4284595
|
[N][C][=C][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=C][O][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=N][C][Ring1][#Branch2][=C][Ring2][Ring1][Ring1]
|
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.