chembl_id
stringlengths 7
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stringlengths 3
6.7k
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CHEMBL4288272
|
[N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][N][C][S][C][=Branch1][C][=S][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2]
|
CHEMBL4288273
|
[F][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][#C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2]
|
CHEMBL4288274
|
[C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][O][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N][C][Branch1][=N][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][C][=C][Branch1][=C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][Branch2][=O][N][Ring2][Ring2][=Branch1]
|
CHEMBL4288275
|
[C][C][=N][N][Branch1][#Branch2][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][Branch1][C][N][=C][Ring1][O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2]
|
CHEMBL4288276
|
[C][O][C][=C][C][=C][Branch2][Ring1][=C][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring1][#Branch2][C][O][C][Ring1][#C][=O][C][=C][Ring2][Ring1][=Branch1]
|
CHEMBL4288350
|
[C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][=C][Branch2][Ring1][O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][=C][Ring1][N][C][=C][Ring2][Ring1][O][Ring2][Ring2][C]
|
CHEMBL4288351
|
[C][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][N][O][C][=C][Branch1][N][C][=C][C][=C][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][Ring1][=C][C][=C][C][Branch1][C][Br][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][O]
|
CHEMBL4288352
|
[C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][Branch2][Ring1][#Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][C][=C][Ring2][Ring1][Branch1][Ring2][Ring1][N]
|
CHEMBL4288353
|
[O][=C][Branch2][Ring1][Ring1][N][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][S][Ring1][O][C][=C][N][=C][C][Branch1][C][Cl][=N][Ring1][#Branch1]
|
CHEMBL4288444
|
[O][=C][C][=C][Branch1][=N][S][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][NH1][C][=Branch1][C][=O][N][Ring1][#C][O]
|
CHEMBL4288445
|
[C][O][C][=C][C][=C][Branch2][Ring2][O][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][=N][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=Ring2][Ring1][Branch1][N][C][=C][Ring2][Ring1][N]
|
CHEMBL4288446
|
[C][C][C][O][C][=Branch1][C][=O][N][C][=N][C][=C][C][=C][Branch1][Branch1][S][C][C][C][C][=C][Ring1][#Branch2][S][Ring1][=N]
|
CHEMBL4288447
|
[C][N][C][=C][Branch2][Ring1][=C][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][Ring1][O][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][N]
|
CHEMBL4288533
|
[C][C][=C][C][=C][Branch2][Ring2][N][N][C][Branch2][Ring1][=Branch2][C][O][C][=C][C][=C][Branch1][=N][/C][=C][/S][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][C][=C][Ring1][=C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][#Branch2][=O][C][=C][Ring2][Ring1][P]
|
CHEMBL4288534
|
[O][=C][NH1][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=N][N][=C][Branch1][N][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][S][C][Ring1][#C][C][=C][Ring2][Ring1][Branch1][NH1][Ring2][Ring1][Branch2]
|
CHEMBL4288535
|
[C][=C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][C][=C][Ring2][Ring1][C]
|
CHEMBL4288536
|
[C][=C][C][O][C][=C][C][=C][Branch2][Ring2][=Branch1][C][=N][O][C][Branch2][Ring1][O][C][N][=N][N][Branch1][P][C][=C][C][=C][C][Branch1][#Branch1][/C][Branch1][C][C][=N][/O][=C][Ring1][#Branch2][C][=Ring1][#C][N][=N][Ring2][Ring1][Branch1][C][=C][Ring2][Ring1][O]
|
CHEMBL4288624
|
[O][=N+1][Branch1][C][O-1][C][=C][Branch1][P][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][=C][C][Branch1][C][Cl][=C][N][Ring2][Ring1][=C][Ring1][P]
|
CHEMBL4288625
|
[C][C][O][C][=N][C][=N][C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][=C][Ring1][=C][C][=Ring1][P][C][O]
|
CHEMBL4288626
|
[O][=C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][Branch1][C][O][Branch2][Ring1][#Branch2][C][N][C][=N][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][S][C][=Ring1][O][C][Ring1][#C][=O][C][C][Ring2][Ring1][Branch2]
|
CHEMBL4288627
|
[C][C][Branch1][C][C][C][O][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=N][C][O][C][=C][C][=C][C][=Branch1][C][=O][C][Branch2][Ring1][Ring2][C][=C][C][=C][Branch1][#Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][Ring1][O][=C][O][C][Ring2][Ring1][C][=C][Ring2][Ring1][=Branch1]
|
CHEMBL4288628
|
[C][N][C][=C][Branch1][#C][C][=C][NH1][C][=Branch1][C][=O][C][Branch1][C][N][=C][Ring1][Branch2][C][=N][Ring1][=N]
|
CHEMBL4288709
|
[C][C][=C][C][=C][Branch2][Ring1][=Branch2][/C][=C][/C][N][Branch1][C][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][C][=C][Ring2][Ring1][=Branch1].[Cl]
|
CHEMBL4288710
|
[N][#C][C][NH1][N][=N][C][=Ring1][Branch1][C][=C][C][=N][C][Branch2][Ring1][Branch1][C][=C][N][Branch1][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=N][Ring1][=C][=C][Ring2][Ring1][Ring2]
|
CHEMBL4288711
|
[C][O][C][=C][C][=C][Branch2][Ring2][Branch1][C][N][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][=N][Ring2][Ring1][Branch1][C][=C][Ring2][Ring1][N][O][C]
|
CHEMBL4288712
|
[C][C][C][C][N][C][=N][C][Branch1][C][N][=N][C][=C][Ring1][#Branch1][C][N][Branch1][=N][C][=Branch1][C][=O][C][S][C][=N][C][=Ring1][Branch1][C][C][C][Ring1][=C]
|
CHEMBL4288713
|
[O][=C][Branch2][Ring2][=C][O][C][C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][O][C][=C][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Branch1][C][O][C][=C][Ring1][=Branch2][O][Ring1][=C][C][=C][Ring2][Ring1][Ring2][C][=C][C][=C][Branch1][#Branch2][N][Branch1][Ring2][C][C][Cl][C][C][Cl][C][=C][Ring1][=N]
|
CHEMBL4288797
|
[C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=N][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][Branch1][P][C][N][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][=Branch2][N][Ring2][Ring1][=Branch1][C][=Ring2][Ring1][#Branch2]
|
CHEMBL4288798
|
[C][N][Branch1][C][C][C][=C][C][=C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][Branch1][#C][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][C][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][O][C][=C][Ring1][#Branch2][=C][Ring2][Ring1][=C]
|
CHEMBL4288799
|
[C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch2][Ring1][=C][/C][=C][\C][C][C@@H1][C@H1][C][C][C][N][C][C][C][C@H1][Branch1][=Branch2][C][N][Ring1][N][C][Ring1][S][=O][C@@H1][Ring1][=C][Ring1][#Branch2][=C][N][Ring2][Ring1][=Branch2][C][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C]
|
CHEMBL4288800
|
[C][C][=C][C][=Branch1][C][=O][C][Branch1][C][O][=C][Branch2][Ring1][P][C][Branch1][C][O][C][=C][C][=C][Branch2][Ring1][C][O][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=C][Ring1][P][O][Ring2][Ring1][O]
|
CHEMBL4283396
|
[C][C@@H1][Branch2][Ring2][N][N][C][=N][C][Branch1][O][N][C][Branch1][C][C][Branch1][C][C][C][#N][=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][C][C][C][Ring1][Ring1]
|
CHEMBL4283397
|
[C][N][Branch2][Ring1][Branch2][C][=C][C][=C][Branch1][=C][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][O][N][=N][Ring1][#C][C][C][C][Branch1][C][C][Branch1][C][C][N][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch2]
|
CHEMBL4283398
|
[C][N][C][=Branch1][C][=O][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][C][=N][C][Branch1][O][C][N][S][Branch1][C][C][=Branch1][C][=O][=O][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=C][Ring2][Ring1][=Branch2][Ring1][#C]
|
CHEMBL4283399
|
[O][=C][Branch2][Ring1][N][N][C][C][=C][C][=C][Branch1][S][C][S][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][C][=C][Ring1][P][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
CHEMBL4283400
|
[C][C][N][Branch1][Ring1][C][C][C][C].[C][C][N][Branch1][Ring1][C][C][C][C].[O][=C][C][=C][N][Branch2][Ring2][Ring2][C@][C][C@H1][Ring1][Ring1][C@H1][Branch2][Ring1][Ring1][C][O][P][=Branch1][C][=O][Branch1][C][O][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][Branch1][C][O][C@H1][Ring1][P][O][C][=Branch1][C][=O][NH1][Ring2][Ring1][=Branch2]
|
CHEMBL4283401
|
[C][C][C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][/C][Branch1][Ring1][C][#N][=C][/C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][=C][C][=C][Branch1][N][O][C][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][#C]
|
CHEMBL4283402
|
[C][C][O][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring2][Ring2][C][=C][C][=C][Branch2][Ring1][Branch2][/C][=C][/C][=C][C][Branch1][C][F][=C][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=C][Ring1][=N][C][=C][Ring2][Ring1][Branch1][C][C][Ring2][Ring1][O]
|
CHEMBL4283482
|
[C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@@H1][O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][N][C][=Branch1][C][=O][C][C][C][C]
|
CHEMBL4283483
|
[O][=C][Branch2][Ring1][#Branch1][/C][=C][/C][=C][C][=C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1]
|
CHEMBL4283484
|
[O][=C][Branch1][C][O][C][=C][C][=C][Branch2][Ring1][S][C][=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][C][=C][Ring2][Ring1][=Branch2]
|
CHEMBL4283485
|
[C][S][C][C][C][Branch2][Ring1][#C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Branch1][C][C][O][Ring1][=Branch2][C][=Branch1][C][=O][O]
|
CHEMBL4283570
|
[F][C][=C][C][Branch2][Ring1][Branch1][/C][=C][/C][=C][C][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][Ring1][N][=C][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][#Branch2]
|
CHEMBL4283571
|
[C][C][Branch1][C][C][C][C@@H1][C][N][Branch2][Ring1][Branch1][C][C][C][C][C@H1][C][N][C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][=N][Ring1][#Branch2][C][=Branch1][C][=S][N][Ring2][Ring1][Ring2][C][C][C][C][C][C][C][C][Ring1][=Branch1]
|
CHEMBL4283572
|
[C][C][=C][N][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch1][#C][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][C][C][C][Ring1][=Branch1][=C][Ring1][=C][=C][Ring2][Ring1][Branch2]
|
CHEMBL4283573
|
[C][C][C][C][C][C][C][C][C][C][C][C][=C][Branch1][C][O][C][=Branch1][C][=O][C][=C][Branch2][Ring1][=N][O][C][Branch1][C][N][=C][Branch1][Ring1][C][#N][C][Ring1][=Branch2][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][Ring2][Ring1][Branch2][=O]
|
CHEMBL4283574
|
[O][=C][Branch2][Ring2][#Branch2][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][N][C][=N][O][N][=C][Ring1][Branch1][/C][=Branch1][Ring1][=N][/O][N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Br][=C][Ring1][Branch2][N][O]
|
CHEMBL4283662
|
[C][C][=N][C][=C][N][Ring1][Branch1][C][C][C][C][C][C][C][C][C][C][O][C][=C][C][=C][C][=C][C][=Branch1][C][=O][O][C][Ring1][#Branch1][=C][Ring1][O]
|
CHEMBL4283663
|
[C][O][C][=C][C][Branch1][Ring1][O][C][=C][S][C][Branch2][Ring2][=C][C][=C][C][=C][Branch2][Ring1][#C][N][/C][=C][\C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=N][C][Branch1][C][C][=C][Ring2][Ring1][=Branch2][=N][C][Ring2][Ring1][=C][=C][Ring2][Ring2][Ring2]
|
CHEMBL4283664
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][#Branch1][S][N][C][=Branch1][C][=O][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch2][S][Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C][C][C][C][N][Ring1][Branch1][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][#Branch1][C][C][Branch1][C][C][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][Branch2][#Branch2][S][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][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][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][#Branch1][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][Branch2][Branch1][Ring1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][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][C][N][C][C][=C][N][=C][NH1][Ring1][Branch1][C][Branch1][C][C][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][O][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][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][O]
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CHEMBL4283665
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[C][O][C][=C][C][Branch2][=Branch1][N][C@@H1][C][=C][C][=C][Branch2][Branch1][=C][C][=C][Ring1][=Branch1][C@@H1][Branch2][Ring2][=Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][N][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][Branch1][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][=N][Ring2][Ring1][Ring2][C@H1][C][O][C][=Branch1][C][=O][C@@H1][Ring1][=Branch1][Ring2][Ring2][Branch1][O][C][O][Ring2][Ring2][Branch1][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring2][S][O][C]
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CHEMBL4283666
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[C][O][C][=C][C][=C][C][Branch2][Ring1][=Branch1][/C][=C][/C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][Branch1][C][C][O][C][Ring1][Branch2][=O][=C][Ring2][Ring1][Ring1]
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CHEMBL4283667
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[O][=C][Branch1][#C][C][C][=N][S][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][N][N][C][=Branch1][C][=O][C][S][C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
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CHEMBL4283749
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[C][C][C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][=N][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][S][Ring1][O][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][=Branch1]
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CHEMBL4283750
|
[C][C][C][C][O][C][C][=C][Branch1][Branch2][/C][=C][/C][Branch1][C][C][=O][N][=C][Branch1][C][C][C][Branch1][C][O][=C][Ring1][=N][C][O][Ring2][Ring1][C]
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CHEMBL4283751
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[N][=C][N][C][=Branch1][C][=O][/C][=Branch1][P][=C][/C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][O][Ring1][=Branch1][S][Ring1][S]
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CHEMBL4283752
|
[C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring2][Branch1][O][C][=Branch1][C][=S][N][C][=C][C][=C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][Cl][Branch1][C][Cl][Cl][C][=C][Ring1][#Branch2][C][=C][Ring1][P][C][=C][Ring2][Ring1][O]
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CHEMBL4283753
|
[C][O][C][=C][C][=C][Branch3][Ring1][Ring1][#Branch2][C][N][Branch2][#C][=Branch1][C][C][=Branch1][C][=O][N][Branch2][=C][Branch1][C][C][=Branch1][C][=O][N][C][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C][Branch1][Branch1][C][C][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][Branch2][#Branch2][N][N][C][=Branch1][C][=O][C][Branch1][Branch1][C][C][S][C][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C][N][Branch1][=Branch2][C][C][=C][C][=C][S][Ring1][Branch1][C][=Branch1][C][=O][C][N][Branch1][=C][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][C][N][Branch2][Ring2][O][C][=Branch1][C][=O][C][N][Branch1][P][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][=Branch1][C][=O][C][N][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O][C][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][C][N][Branch2][Ring2][O][C][=Branch1][C][=O][C][N][Branch1][P][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][=Branch1][C][=O][C][N][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][=N][=Branch1]
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CHEMBL4283836
|
[F][C][=C][C][=C][C][Branch2][Ring2][N][C][O][C][=C][C][=C][Branch2][Ring1][=N][N][C][=N][C][=N][C][C][=C][Branch1][N][C][#C][C][=N][C][=C][C][=C][Ring1][=Branch1][F][S][C][Ring2][Ring1][C][=Ring1][=C][C][=C][Ring2][Ring1][=Branch2][Cl][=C][Ring2][Ring2][C]
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CHEMBL4283837
|
[C][C][N][Branch2][Ring1][C][C][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][O][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][N][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][Branch1][C][C][=N][Ring1][=C]
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CHEMBL4283838
|
[C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring2][#C][C][C][C][=C][C][Branch2][Ring1][=N][C][=C][C][=C][Branch2][Ring1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring1][P][=C][C][=C][Ring2][Ring1][#Branch1][O][Ring2][Ring1][O][C][C][Ring2][Ring1][S]
|
CHEMBL4283839
|
[O][C][=N][N][Branch1][=Branch2][C][C][C][N][C][C][Ring1][=Branch1][N][=C][Ring1][O][C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2]
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CHEMBL4283840
|
[C][C][C][C][C][C][C][=C][C][=C][Branch2][#Branch1][S][C][=C][C][=C][Branch2][#Branch1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch1][C][C][C][N][C][=Branch1][C][=O][N][C@H1][Branch2][Branch1][#Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][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][B][O][C][C][C@@H1][C][C@@H1][Branch1][Branch2][C][Ring1][Ring2][Branch1][C][C][C][C@][Ring1][=Branch2][Branch1][C][C][O][Ring1][=N][C@@H1][Branch1][C][C][O][C][=C][Ring2][Branch1][Ring2][C][=C][Ring2][Branch1][#Branch2]
|
CHEMBL4283841
|
[C][C][Branch1][C][C][C][C@@H1][N][C][=Branch1][C][=O][C][=C][C][=C][C][C][C][C][Ring1][Branch1][=C][C][=C][Branch1][P][S][C@][Ring1][Branch1][Branch1][C][C][C@@][Ring1][=N][Branch1][C][C][S][Ring1][P][C][=Branch1][C][=O][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][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][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][Ring2][Branch2][=Branch2][=O]
|
CHEMBL4283925
|
[C][C][C][Branch1][Ring1][C][C][O][C@@H1][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C@H1][Branch1][Ring2][N][C][=O][C@H1][Ring1][N][N][C][Branch1][C][C][=O]
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CHEMBL4283926
|
[C][C][=C][C][=C][Branch2][Ring1][=Branch2][C][O][C][=C][C][=N][N][Ring1][Branch1][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][#Branch1]
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CHEMBL4283927
|
[C][C][=C][C][=C][Branch2][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][N][=N][N][Branch2][Ring1][#C][C][C][N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Ring1][P][=O][C][=Ring2][Ring1][=Branch2][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=C][Ring2][Ring2][O]
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CHEMBL4283928
|
[C][O][C][=C][C][=C][N][=C][Branch2][Ring2][#Branch2][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][Branch1][C][C][=C][Ring2][Ring1][#Branch1][S][C][Ring2][Ring1][N][=C][Ring2][Ring1][S]
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CHEMBL4283929
|
[C][O][C][=C][C][=C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=S][N][/N][=C][/C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][Ring1]
|
CHEMBL4283930
|
[C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch2][Branch1][Ring2][C][=C][C][=C][Branch2][Ring2][Branch1][C][=C][C][=C][Branch2][Ring1][=Branch2][/C][=N][/N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][N][C][=C][Ring2][Ring1][Ring2][C][Branch1][C][F][=C][Ring2][Ring1][O][C][=Branch1][C][=O][O][Ring2][Ring1][P]
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CHEMBL4283931
|
[C][C][C][N][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring2][N][C][C][=C][Branch2][Ring1][P][N][Branch2][Ring1][C][C][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][O][C][=C][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring2][Ring1][Ring2][Ring1][=Branch1][C@@H1][Ring2][Ring1][Branch2][C][C][Ring2][Ring1][=C][=O]
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CHEMBL4284002
|
[C][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][Ring1][Branch2][=C][Ring1][=N][O][C][C][C][C][N][C][C][N][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][Ring1][=N]
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CHEMBL4284003
|
[N][C][O][C][=C][N][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
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CHEMBL4284004
|
[C][C][Branch1][C][C][N][C][C@H1][O][C@@H1][Branch2][Ring1][=C][N][C][=N][C][=C][Branch1][=C][N][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][N][=C][N][=C][Ring1][#C][Ring2][Ring1][C][C@H1][Branch1][C][O][C@@H1][Ring2][Ring1][Branch2][O]
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CHEMBL4284005
|
[C][C][=Branch1][C][=O][C][C][C][C][C][C][C][C][C][C][C@H1][C][C][C@@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@@H1][Branch1][C][C][N][Ring1][O]
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CHEMBL4284006
|
[C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch2][Ring1][Branch2][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][NH1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][=N][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][Ring1][Branch1][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C]
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CHEMBL4284007
|
[C][C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=Branch1][C][=O][/C][=C][/C][=C][Branch1][C][Cl][N][=C][Branch1][Branch1][C][C][C][C][N][Ring1][#Branch2][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]
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CHEMBL4284090
|
[Cl].[Cl].[Cl].[N][C][C][C][N][C][C][C][C][N][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][C][Ring1][=C][=O]
|
CHEMBL4284091
|
[O][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][=C][S][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][=N][N][Ring2][Ring1][=Branch2][Ring1][P]
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CHEMBL4284092
|
[C][C][N][C][=C][C][=N][C][Branch1][C][C][=N][C][Branch1][P][N][Branch1][C][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][=C][Ring1][P][Ring2][Ring1][Ring2]
|
CHEMBL4284093
|
[C][O][C][=C][C][=C][Branch2][Branch1][Ring2][C][=N][N][=C][Branch2][Ring2][=Branch2][C][S][C][=C][C][Branch1][C][C][=N][C][Branch2][Ring1][Branch2][S][C][C][=N][N][=C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][S][Ring1][=N][=N][Ring2][Ring1][=Branch1][S][Ring2][Ring1][=N][C][=C][Ring2][Ring2][Ring1]
|
CHEMBL4284094
|
[C][C][#C][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch2][Ring1][N][O][C][C@H1][C][O][C][=C][C][=C][Branch1][#Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][Ring1][O][O][Ring1][#C][C][=C][Ring2][Ring1][#Branch1]
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CHEMBL4284177
|
[O][=C][C][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring2][Ring1][Branch1][Ring1][#Branch2]
|
CHEMBL4284178
|
[C][O][C][=C][C][=C][C][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][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][Ring2][Ring1][O]
|
CHEMBL4284179
|
[Br][C][=C][C][=C][Branch2][Ring1][N][C][O][C][=C][C][=C][C][Branch1][S][C][N][C@H1][C][C@@H1][Ring1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][P][C][=C][Ring2][Ring1][=Branch2]
|
CHEMBL4284180
|
[C][C][N][Branch2][Ring1][O][C][C@H1][O][C@@H1][Ring1][Ring1][C][C][C][C][C][Branch1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring1][#Branch2][C][C][O][Ring2][Ring1][Ring2].[Cl]
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CHEMBL4284181
|
[O][=C][Branch1][C][O][C][=C][S][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=N]
|
CHEMBL4284262
|
[C][S][C][=C][C][=C][Branch2][Ring2][C][C][C][Branch1][Ring1][C][#N][=C][Branch1][C][N][O][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][N][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2]
|
CHEMBL4284263
|
[C][N][C][=Branch1][C][=O][N][C][S][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Branch2][Ring1][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][S][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring1][C][=Ring2][Ring1][=Branch1][C][Branch1][C][N][=O]
|
CHEMBL4284264
|
[C][O][C][=C][C][=C][Branch2][Ring2][Branch1][C][N][=C][C][=C][C][=C][N][Ring1][=Branch1][C][=Ring1][=Branch2][C][=Branch1][C][=O][/C][=C][\N][C][=C][C][Branch1][Ring1][O][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][C][=C][Ring2][Ring1][=C]
|
CHEMBL4284265
|
[C][C][O][C][=Branch1][C][=O][C][=C][N][Branch1][#C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][C][=C][C][=C][Ring2][Ring1][Ring1][Ring1][=Branch1]
|
CHEMBL4284352
|
[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][S][N][C][=Branch1][C][=O][N][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][S][Ring2][Ring1][#Branch2]
|
CHEMBL4284353
|
[C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][N][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][C][=Branch1][C][=O][C][Ring2][Ring1][#Branch2][Ring2][Ring1][N]
|
CHEMBL4284354
|
[C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][Ring1][S][C][N][=C][Ring1][Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch1][O][C]
|
CHEMBL4284355
|
[C][C][=C][C][=C][Branch2][Ring2][Branch2][C][N][C][Branch2][Ring1][=Branch1][/C][=C][\S][C][=Branch1][C][=S][N][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][Ring1][O][=O][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][=Branch1][C][=C][Ring2][Ring1][=N]
|
CHEMBL4284356
|
[N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Branch1][=C][C][C][C][Branch2][Ring1][N][C][=C][C][=C][Branch1][C][F][C][Branch1][#C][C][=C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][=C][Ring1][#C][=N][N][Branch1][#C][C][=N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][S][Ring1][Branch2][C][=Ring2][Ring1][N][C][C][C][C][Ring1][Ring1][C][=C][Ring2][Ring2][#Branch1][F]
|
CHEMBL4284439
|
[C][C][Branch1][C][C][C][=N][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][Ring2][Ring1][Ring1][=Ring1][#C]
|
CHEMBL4284440
|
[C][C@H1][Branch2][Ring1][N][N][C][=N][C][=N][C][NH1][C][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][=C][C][Ring1][S][=Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4284441
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1]
|
CHEMBL4284442
|
[C][C][Branch1][C][C][C][C][O][C][=C][C][=C][Branch2][Ring2][=Branch1][C][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Branch1][S][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][Ring1][P][C][=C][Ring2][Ring1][O][Ring2][Ring1][S]
|
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