chembl_id
stringlengths 7
13
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stringlengths 3
6.7k
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CHEMBL13503
|
[C][O][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Branch2][C][C][C][C@H1][Ring1][Ring2][N][C][=C][Ring1][=N][O][C]
|
CHEMBL13828
|
[O][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][C][C][N][C][C][N][Branch2][Ring1][Ring2][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Ring1]
|
CHEMBL13830
|
[O][=C][Branch1][#Branch2][N][N][C][C][N][C][C][Ring1][=Branch1][C][=C][C][=C][C][Branch2][Ring2][#Branch2][O][C][=N][C][=C][C][Branch2][Ring1][=N][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][=C][N][Ring1][N][C][C][C][N][C][C][Ring1][=Branch1][=N][Ring2][Ring1][Branch2][=C][Ring2][Ring1][#C]
|
CHEMBL13831
|
[C][C][C][C][N][C][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1].[Cl]
|
CHEMBL13525
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=O][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][Branch2][C][=C][Ring1][=Branch1][Ring2][Ring1][C][O][C][O][Ring1][#Branch1]
|
CHEMBL13561
|
[C][S+1][Branch1][C][O-1][C][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][C][=Branch1][Ring2][=C][Ring1][#Branch2][C][Branch1][C][C][Branch1][C][C][C][O][Ring1][Branch2]
|
CHEMBL13562
|
[C][C][N][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Cl].[Cl]
|
CHEMBL13563
|
[N][C][=N][C][Branch1][C][O][=C][N][=C][N][Branch1][=N][C][S+1][Branch1][C][O-1][C][Branch1][Ring1][C][O][C][O][C][Ring1][=N][=N][Ring2][Ring1][C]
|
CHEMBL13564
|
[C][C][N][Branch1][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][I][C][=C][Ring1][#Branch1]
|
CHEMBL13565
|
[C][C][=Branch1][C][=O][C@@][O][C][Branch1][C][C][Branch1][=C][C][=C][C][=C][Branch1][Ring2][N][=C][=S][C][=C][Ring1][=Branch2][O][C@@H1][Ring1][#C][C][C][C][C][C][C][=C][C][=Branch1][C][=O][C][C][C@][Ring1][#Branch1][Branch1][C][C][C][Ring1][N][C][C][C@@][Ring1][S][Ring2][Ring1][S][C]
|
CHEMBL13672
|
[C][C][=Branch1][C][=O][O][C][C][=C][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][#C][N][C][N][=C][C][=C][NH1][C][=C][Ring1][=Branch1][N][=Ring1][=Branch2][C][Ring1][#C][S][C][Ring2][Ring1][#Branch2]
|
CHEMBL1163482
|
[C][C][=C][C][Branch1][C][C][=C][Branch2][Ring1][#Branch2][N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][S][=O][C][Branch1][C][C][=C][Ring2][Ring1][=Branch2]
|
CHEMBL13588
|
[C][N][C][C@H1][Branch1][=N][C][N][C][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][C][C@@H1][C][=C][C][=C][C][NH1][C][=C][Branch1][=Branch1][C][Ring1][=Branch2][=Ring1][Branch1][C][C@H1][Ring1][N][Ring2][Ring1][Branch2]
|
CHEMBL13589
|
[N][C][=N][C][=N][C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring1][=N]
|
CHEMBL13590
|
[C][C][N][C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O].[Cl]
|
CHEMBL4543171
|
[C][C@H1][Branch1][C][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][C][Branch1][C][F][F]
|
CHEMBL4543172
|
[C][O][C][=C][C][Branch2][Ring1][S][N][C][=Branch1][C][=O][C][N][N][=C][C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=C][N][Ring1][=N][C][Ring1][S][=O][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][=N]
|
CHEMBL13591
|
[C][N][C][C][Branch1][Branch2][C][=N][C][C][N][Ring1][Branch1][O][C][=C][Ring1][O][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1]
|
CHEMBL13592
|
[C][N][Branch1][C][C][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][C][=Branch1][Ring2][=C][Ring1][#Branch2][C][Branch1][C][C][Branch1][C][C][C][O][Ring1][Branch2]
|
CHEMBL13690
|
[C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Branch1][C][C][=C][C][=C][Branch1][#Branch2][O][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring1][O][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL13504
|
[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=C][O][C][C][Branch1][C][O][C][N][C][Branch1][C][C][C][C][=C][Ring1][#C]
|
CHEMBL13505
|
[O][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][Branch1][Ring1][C][Cl][=C][C][=C][Ring1][Branch2][O][C][Ring1][N][=O]
|
CHEMBL13506
|
[C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][=O][=C][N][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S]
|
CHEMBL13612
|
[C][C][=Branch1][C][=O][O][C][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][=C][N][C][=N][C][=C][S][C][=C][Ring1][Branch1][NH1][Ring1][Branch2][C][Ring1][=C][S][C][Ring2][Ring2][C]
|
CHEMBL13613
|
[C][/N][=C][Branch1][Ring2][/N][C][#N][C][=C][C][Branch1][C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][Ring1][=C]
|
CHEMBL13526
|
[O][=C][Branch1][#Branch2][N][C][C][C][C][C][C][Ring1][=Branch1][N][C][C][C][C][C][Branch1][#C][N][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][C][Ring1][S]
|
CHEMBL13527
|
[C][C][C@@][Branch1][C][O][C][=Branch1][C][=O][O][C][C][=C][Ring1][Branch2][C][=C][N][Branch1][Branch1][C][Ring1][=Branch1][=O][C][C][=C][C][=C][C][=N+1][Branch1][C][O-1][C][=C][Ring1][#Branch1][N][=C][Ring1][O][Ring1][S]
|
CHEMBL13528
|
[C][C][Branch1][C][C][C][C][=C][Branch1][C][O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][C][=C][Branch1][P][C][=Branch1][C][=O][N][Branch1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch2][C][N][Ring1][=N][C][Ring2][Ring1][Branch2][=O]
|
CHEMBL4543211
|
[C][C][Branch1][C][C][C][C@H1][Branch2][Ring2][=Branch2][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][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][=N+1][=N-1][C][=Branch1][C][=O][N][C@H1][Branch1][O][/C][=C][/S][Branch1][C][C][=Branch1][C][=O][=O][C][C][=C][C][=C][Branch1][Ring1][C][N][C][=C][Ring1][Branch2]
|
CHEMBL4543212
|
[C][C][=C][C][=C][Branch2][Ring1][P][C][=C][N][Branch2][Ring1][=Branch1][C][C][=C][C][=C][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=C][Ring1][N][N][=N][Ring2][Ring1][C][C][=C][Ring2][Ring1][Branch2]
|
CHEMBL13530
|
[C][O][C][=C][C][Branch1][#Branch1][C][C][C][Ring1][Ring1][N][=C][Branch1][Ring1][O][C][C][=C][Ring1][N][C]
|
CHEMBL13531
|
[C][C][Branch1][C][C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][=N+1][Ring1][N][O-1]
|
CHEMBL3309507
|
[C][N][C][C][C@][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][O][C@H1][Ring1][#Branch2][C][=C][Branch2][Ring1][Ring1][C][C][C][=Branch1][C][=O][N][Ring1][#Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@@][Ring2][Ring1][#Branch2][Branch1][C][O][C@H1][Ring2][Ring1][#C][C][Ring2][Ring1][O]
|
CHEMBL13673
|
[C][O][C][=C][C][Branch1][=C][C][C][=C][N][=C][Branch1][C][N][N][=C][Ring1][#Branch1][N][=C][C][Branch1][O][O][C][C][C][C][C][=Branch1][C][=O][O][=C][Ring2][Ring1][#Branch1][O][C]
|
CHEMBL13674
|
[C][C][Branch1][C][C][C][C][N][C][Branch1][C][C][C][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][=Branch2][C][C][=C][C][=C][Branch1][=C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]
|
CHEMBL13757
|
[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring1][Branch1][Branch1][C][C][C]
|
CHEMBL1163485
|
[O][=C][Branch2][Ring1][=N][C][C][Branch1][P][N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
CHEMBL13758
|
[C][C][=Branch1][C][=O][O][C][C][=C][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][C][N][C][=N][C][=C][C][Branch1][C][N][=C][C][=C][Ring1][#Branch1][NH1][Ring1][#Branch2][C][Ring1][S][S][C][Ring2][Ring1][O]
|
CHEMBL13691
|
[C][C][C][N][Branch1][Ring2][C][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][Ring2][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][C][C@@H1][C][C][C@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=N]
|
CHEMBL4543222
|
[C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][N][C][C][Branch1][=C][O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][Ring1][=N]
|
CHEMBL4543223
|
[C][O][C][=C][C][=C][Branch2][Ring2][C][C][=C][O][C][=C][C][Branch1][#C][O][C][C][O][C][C][N][C][C][C][C][C][Ring1][=Branch1][=C][C][=C][Ring2][Ring1][C][C][Ring2][Ring1][=Branch1][=O][C][=C][Ring2][Ring1][=N]
|
CHEMBL4543224
|
[C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=C][C][=N][N][Ring2][Ring1][Branch1][C][=N][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][NH1][Ring1][#Branch2]
|
CHEMBL13692
|
[C][C][C][=C][C][=C][C][=C][C][=N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Ring1][Branch2][C][Ring1][N][=C][Ring1][S]
|
CHEMBL13693
|
[N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][=C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O][=C][Branch1][C][Br][C][=C][Ring2][Ring1][Ring2][Br]
|
CHEMBL13785
|
[C][C][Branch1][C][O][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][C][=Branch1][Ring2][=C][Ring1][#Branch2][C][Branch1][C][C][Branch1][C][C][C][O][Ring1][Branch2]
|
CHEMBL3309594
|
[C][N][C][C][N][Branch2][Ring2][O][C][=Branch1][C][=O][C][C@H1][Branch2][Ring1][Ring1][N][C][=C][C][=N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][O][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][C][Ring2][Ring1][#C]
|
CHEMBL13614
|
[N][S][=Branch1][C][=O][=Branch1][C][=O][C][=N][N][=C][Branch2][Ring1][P][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][#C][N][S][C][=Branch1][C][=S][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][S][S][Ring2][Ring1][=Branch2]
|
CHEMBL13615
|
[C][C][C][C][N][C][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2].[Cl]
|
CHEMBL13616
|
[C][=C][Branch1][C][C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][C][C@@H1][C][C][C@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][C][=C][Ring2][Ring1][=Branch1]
|
CHEMBL13714
|
[C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][=C][C][=N][C][Branch1][Branch2][C][N][=N][NH1][N][=Ring1][Branch1][=C][N][Ring1][#Branch2][Ring1][#C]
|
CHEMBL13715
|
[F][C][=C][C][=C][C][Branch1][Branch2][C][=N][C][C][N][Ring1][Branch1][=C][Ring1][O]
|
CHEMBL13716
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=O][N][C][Branch2][Ring1][Branch1][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][C][=C][C][=C][Branch1][Branch2][C][=C][Ring1][=Branch1][Ring2][Ring1][=Branch2][O][C][O][Ring1][#Branch1]
|
CHEMBL13640
|
[C][C][=C][C][=C][Branch2][Ring2][Branch1][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][C][C][Branch1][C][C][=C][Ring2][Ring1][=N]
|
CHEMBL13642
|
[O][C][C][C][N][Branch2][Ring1][O][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][Ring1][O][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][C][Ring2][Ring1][Branch2]
|
CHEMBL13643
|
[C][C][=Branch1][C][=O][O].[C][C][N][Branch1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=Branch1][C][=O][C][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][N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]
|
CHEMBL13644
|
[C][N][C][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][S][C][=C][C][=Ring1][Branch1][C][Ring1][=C][C][Ring2][Ring1][C]
|
CHEMBL13645
|
[C][N][C][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][=C][C][Ring2][Ring1][C]
|
CHEMBL13646
|
[N][C][C][C][=Branch1][C][=O][N][C][=N][N][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][S][Ring1][=Branch2]
|
CHEMBL3309547
|
[C][C@H1][Branch1][C][O][C][N][C][=N][C][=C][C][Branch2][Ring2][=Branch2][N][C][=C][N][=C][Ring1][Branch1][C][C][=C][C][=C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][Ring2][Ring1][C][=N][Ring2][Ring1][=C]
|
CHEMBL4543244
|
[O][=S][=Branch1][C][=O][Branch1][O][C][C][N][C][C][C][C][C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4543245
|
[O][=C][Branch2][Ring2][Branch2][C][S][C][=N][N][=C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][S][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][N][Ring1][S][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4543246
|
[Cl][C][=C][C][=C][Branch1][#Branch2][C][N][C][C][O][C][C][Ring1][=Branch1][C][Branch1][C][Cl][=C][Ring1][=C]
|
CHEMBL13759
|
[O][=C][Branch1][C][O][C][=C][N][C][Branch1][=N][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][=N][Ring1][=N]
|
CHEMBL13760
|
[C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][=C][Branch1][P][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][C@@H1][Ring1][P][O]
|
CHEMBL13761
|
[C][C][Branch1][C][C][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=N+1][Ring1][N][O-1]
|
CHEMBL13854
|
[F][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][Branch1][Branch2][C][=N][C][C][N][Ring1][Branch1][C][=C][Ring1][O]
|
CHEMBL13855
|
[O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][N][=C][Branch2][Ring1][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring2][Ring1][Ring1][O]
|
CHEMBL13856
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch2][Ring1][P][C][C][N][C][=Branch1][C][=O][NH1][C][S][C][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][=Ring1][N][C][Ring1][P][=O][C][C][Ring2][Ring1][#Branch2]
|
CHEMBL13876
|
[O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch2][Ring1][Ring2][C][NH1][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][C][=Ring1][=N][Ring1][=Branch2][C][=C][Ring2][Ring1][Ring1]
|
CHEMBL13877
|
[C][O][C][=Branch1][C][=O][C][C][C][C][O][C][=C][C][Branch1][=C][C][C][=C][N][=C][Branch1][C][N][N][=C][Ring1][#Branch1][N][=C][C][Branch1][Ring1][O][C][=C][Ring1][P][O][C]
|
CHEMBL13878
|
[C][#C][C][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Branch1][C][O][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][#C]
|
CHEMBL13879
|
[F][C][=C][C][=C][Branch1][Branch2][C][=N][C][C][N][Ring1][Branch1][C][=C][Ring1][O][Cl]
|
CHEMBL13586
|
[C][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][#C][N][C][=N][C][Branch1][C][C][C][Branch1][C][C][N][Ring1][#Branch1][C][Ring1][=N][S][C][Ring2][Ring1][P]
|
CHEMBL13717
|
[C][C][C][C][C][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1].[Cl]
|
CHEMBL13718
|
[C][C][C][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1].[Cl]
|
CHEMBL13719
|
[C][C][N][C][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2].[Cl]
|
CHEMBL13720
|
[C][O][C][=C][C][=C][Branch2][Branch1][#Branch1][C][C@H1][N][C][=Branch1][C][=O][/C][=C][/C][C@@H1][Branch1][N][C][C][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][O][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][C][Ring2][Ring1][P][=O][C][=C][Ring2][Ring2][=Branch2]
|
CHEMBL13721
|
[C][C][C][C][Branch1][Branch2][C][=N][C][C][N][Ring1][Branch1][C][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][S]
|
CHEMBL13813
|
[C][C][C][S][C][=N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][N][=C][Ring1][#Branch1][N][Ring1][=N][C][C][=C][C][=C][Branch1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][=N][NH1][N][=Ring1][Branch1][C][=C][Ring1][P]
|
CHEMBL13814
|
[C][C][C][N][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2].[Cl]
|
CHEMBL13815
|
[C][O][C][C][O][C][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][C][=Branch1][Ring2][=C][Ring1][#Branch2][C][Branch1][C][C][Branch1][C][C][C][O][Ring1][Branch2]
|
CHEMBL13737
|
[C][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][S][N][C][=N][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][N][Ring1][Branch2][C][Ring1][=C][S][C][Ring2][Ring2][C]
|
CHEMBL13738
|
[C][N][C][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2].[Cl]
|
CHEMBL533
|
[C][C][C][C][C][C][C][N][Branch1][Ring1][C][C][C][C][C][C][Branch1][C][O][C][=C][C][=C][Branch1][#Branch2][N][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring1][O]
|
CHEMBL13739
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=O][N][=C][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][=C][C][=C][Branch1][Branch2][C][=C][Ring1][=Branch1][Ring2][Ring1][Ring2][O][C][O][Ring1][#Branch1]
|
CHEMBL13740
|
[C][C][Branch1][C][C][C][Branch2][Ring2][#C][N][C][=Branch1][C][=O][C][N][C][=C][C][C][=Branch1][C][=O][N][Branch1][S][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][NH1][C][=Ring2][Ring1][Ring1][C][Ring2][Ring1][#Branch1][=O][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F]
|
CHEMBL3309548
|
[C][C@H1][Branch1][C][O][C][N][C][=N][C][=C][C][Branch2][Ring2][Branch1][N][C][=C][N][=C][Ring1][Branch1][C][C][=C][C][=C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][=C][Ring1][P][=N][Ring2][Ring1][=N]
|
CHEMBL13857
|
[C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][C][C][C][C][C][C][S][C][Branch2][Ring1][=Branch1][C][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2]
|
CHEMBL13858
|
[C][O][C][=C][C][=Branch1][C][=O][N][C][=C][Branch1][=Branch2][C][=C][C][=C][Ring1][O][Ring1][=Branch1][O][C][Branch1][Branch2][C][=N][C][C][N][Ring1][Branch1][C][Ring1][#C]
|
CHEMBL13859
|
[C][O][C][=C][C][=C][C][Branch1][Ring1][C][=O][=C][Ring1][Branch2][O]
|
CHEMBL13860
|
[C][C][N][C][=N][N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][=C][Ring1][O][C][=C][C][=C][C][=C][Ring2][Ring1][Ring1][Ring1][=Branch1]
|
CHEMBL13566
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Ring1][Branch2][C][=C][C][=C][C][=C][Ring1][S][Ring1][=Branch1]
|
CHEMBL13567
|
[C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Ring1][Branch2][C][=C][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][Ring2][Ring1][Ring1]
|
CHEMBL13568
|
[C][C][=Branch1][C][=O][N][C@@H1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][Ring1][O][C][C][=C][C][=C][Branch1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][=N][NH1][N][=Ring1][Branch1][C][=C][Ring1][P][C][Ring2][Ring1][=N][=O]
|
CHEMBL13119
|
[C][C][C][C][C@@][Branch1][Branch1][O][C][Ring1][=Branch1][O][C][C][C][C][C][C][=C][C][C@@H1][Branch1][C][O][C][C][C@][Ring1][#Branch1][Branch1][C][C][C][Ring1][N][C][C][C@][Ring1][S][Branch1][C][C][C@@][Ring2][Ring1][Ring2][Branch1][C][O][C@@H1][Ring2][Ring1][#Branch2][C]
|
CHEMBL13120
|
[F][C][=C][C][=C][NH1][C][=C][Branch1][#Branch1][C][Ring1][Branch1][=C][Ring1][=Branch2][C][C][N][Branch2][Ring1][Ring1][C][C][C][C][C][=C][C][=N][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][Ring2][Ring1][=Branch1]
|
CHEMBL13121
|
[O][=N][N][Branch1][Ring2][C][C][F][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][C][C][C][C][C][Ring1][N]
|
CHEMBL13215
|
[C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][=C][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][C]
|
CHEMBL13217
|
[C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][O][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][Branch1][C][O][C][N][C][C][C@@H1][Branch1][O][S][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C@H1][Ring1][=C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C]
|
CHEMBL13218
|
[N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
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