chembl_id
stringlengths 7
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stringlengths 3
6.7k
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CHEMBL4285120
|
[C][/C][=C][Branch1][C][/C][C][=Branch1][C][=O][O][C@H1][C@H1][Branch1][N][O][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C@@][Branch1][Ring1][C][O][C@@H1][Branch1][=Branch2][C][C][Ring1][#C][Branch1][C][C][C][C][=C][C][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch2][Branch1][=N][O][C@@H1][O][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C@@H1][Branch1][C][O][C@H1][Branch2][Ring2][Branch1][O][C@@H1][O][C][C@H1][Branch1][C][O][C@H1][Branch2][Ring1][Ring2][O][C@@H1][O][C@@H1][Branch1][C][C][C@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@H1][Ring1][=Branch2][O][C@H1][Ring2][Ring1][C][O][C@H1][Ring2][Ring1][=C][O][C@@][Branch1][C][C][Branch1][Ring1][C][O][C@@H1][Ring2][Ring2][#Branch2][C][C][C@@][Ring2][Ring2][=C][Branch1][C][C][C@][Ring2][Branch1][Ring1][Branch1][C][C][C@@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Ring2][=Branch1][C][O][C][Branch1][C][C][=O]
|
CHEMBL4285121
|
[Cl][C][=N][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][C][C][C][Branch2][Ring1][N][C][=N][N][C][Branch2][Ring1][C][C][N][C][=N][C][=C][Branch1][C][Cl][N][=C][N][=C][Ring1][#Branch1][Ring1][#Branch2][C][Ring1][S][=N][N][Ring2][Ring1][Branch1]
|
CHEMBL4285204
|
[Br][C][=C][C][=C][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=N][C][Ring1][S][=C][Ring2][Ring1][Ring2]
|
CHEMBL4285205
|
[O][=C][N][C][=Branch1][C][=O][/C][=Branch2][Ring2][N][=C][\C][=C][C][=C][Branch2][Ring1][#C][O][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][#Branch2][S][Ring2][Ring1][P]
|
CHEMBL4285206
|
[O][=C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][O]
|
CHEMBL4285207
|
[C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][Branch2][C][C][=C][O][C][=Ring1][Branch1][=C][Ring1][#C][C][Branch1][#Branch2][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O]
|
CHEMBL4285290
|
[F][C][=C][C][=C][C][Branch2][Ring2][N][C][O][C][=C][C][=C][Branch2][Ring1][=N][N][C][=N][C][=N][C][S][C][Branch1][N][C][#C][C][N][C][C][N][C][C][Ring1][=Branch1][=C][C][Ring2][Ring1][C][=Ring1][=C][C][=C][Ring2][Ring1][=Branch2][Cl][=C][Ring2][Ring2][C]
|
CHEMBL4285291
|
[O][=C][Branch1][C][O][C][C][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][=C][C][=C][C][=C][Ring1][O][Ring1][=Branch1]
|
CHEMBL4285292
|
[C][C][=Branch1][C][=O][N][C][=C][C][Branch2][Ring1][=Branch2][C][NH1][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][=C][C][=C][Branch1][C][C][C][=N][Ring1][#Branch1][=C][C][=N][Ring2][Ring1][=Branch1]
|
CHEMBL4285293
|
[C][O][C][=C][C][=C][NH1][C][=Branch1][C][=O][C][Branch1][=C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][=C][C][Ring1][S][=C][Ring2][Ring1][Ring2]
|
CHEMBL4285366
|
[C][N][Branch1][=C][C][=N][C][=N][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][Ring1][=N][C][C][Ring1][Ring1]
|
CHEMBL4285367
|
[C][C][C@@H1][N][C@][Branch1][C][C][C][C][C][C][C][Ring1][#Branch1][C][C][Ring1][O][C@@][Ring1][=Branch1][Branch1][C][C][N][C][Branch1][C][C][=O]
|
CHEMBL4285368
|
[C][O][C][=C][C][=C][Branch2][Ring2][#Branch2][C][C][=C][Branch2][Ring1][#C][C][S][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][O][N][=Ring2][Ring1][=Branch2][C][=C][Ring2][Ring1][#C][O][C]
|
CHEMBL4285369
|
[C][C][O][C][=C][C][=C][Branch2][Ring2][=Branch1][N][C][=Branch1][C][=O][/C][Branch1][Ring1][C][#N][=C][Branch2][Ring1][=Branch1][\N][C][C][C][C][C][Branch1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring1][#Branch2][S][C][C][=C][Ring2][Ring1][#Branch2]
|
CHEMBL4285370
|
[C][O][C][=C][C][Branch2][=Branch1][=Branch1][C@@H1][C][=C][C][=C][Branch2][Branch1][Branch2][C][=C][Ring1][=Branch1][C@@H1][Branch2][Ring2][Ring1][N][C][=Branch1][C][=O][C][N][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][N][=N][Ring1][#C][C@H1][C][O][C][=Branch1][C][=O][C@@H1][Ring1][=Branch1][Ring2][Ring1][P][O][C][O][Ring2][Ring1][P][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring2][N][O][C]
|
CHEMBL4285371
|
[C][C][=C][C][Branch2][Branch1][=Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][O][C][C@@H1][C][C][C][N][C][Ring1][=Branch1][=O][C@H1][Branch1][Ring1][C][#N][O][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][=N][O][Ring2][Ring2][=Branch2]
|
CHEMBL4285458
|
[O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][Branch2][N][C][=N][C][=N][Ring1][Branch1][C][C][C][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][C][Ring1][=C][C][Ring1][#Branch1]
|
CHEMBL4285459
|
[C][O][C][=C][C][=C][Branch2][Branch1][Ring1][C][N][C][=Branch1][C][=O][/C][=Branch1][P][=C][\C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][=Branch2][C][=C][C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][=C][C][=C][Ring1][=C][Ring2][Ring1][N][C][=C][Ring2][Ring2][Ring1]
|
CHEMBL4285460
|
[O][=C][Branch1][C][O][C][=N][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][O]
|
CHEMBL4285461
|
[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][Cl][Branch1][C][Cl][Cl][C][=C][Ring1][#Branch2][C][Ring2][Ring1][=Branch2][=C][Ring2][Ring1][=C]
|
CHEMBL4285462
|
[C][C][NH1][N][=C][Branch2][Ring1][P][N][C][=C][C][=N][C][=C][C][=C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][P][Ring1][=N][C][=Ring2][Ring1][#Branch1][C]
|
CHEMBL4285546
|
[C][C][S][=Branch1][C][=O][=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]
|
CHEMBL4285547
|
[C][O][C][Branch1][C][C][Branch1][C][C][C][C][C][C@@][Branch1][C][C][Branch1][C][O][C@H1][C][C][C@][Branch1][C][C][C@@H1][Ring1][=Branch1][C@H1][Branch1][C][O][C][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch1][Branch2][O][C][=Branch1][C][=O][C][Br][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][=C][C][C][C@][Ring2][Ring1][C][Ring2][Ring1][Branch2][C]
|
CHEMBL4285548
|
[C][=C][C][C][=C][C][=C][Branch1][=C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring2][C][C][=C][C][Branch1][Ring2][C][C][=C][=C][C][=C][Ring1][=Branch2][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][Ring2][Ring2][Ring2]
|
CHEMBL4285549
|
[C][C][C][Branch1][Ring1][C][C][O][C@@H1][C][=C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C][Ring1][Ring1][C][C@H1][Branch1][C][N][C@H1][Ring1][P][N][C][Branch1][C][C][=O]
|
CHEMBL4285550
|
[O][=C][Branch1][C][O][C][=C][C][=C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][/C][=Branch1][S][=C][/C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][S][C][Ring1][P][=S][C][=C][Ring2][Ring1][Branch2]
|
CHEMBL4285551
|
[C][C][C][C][C][C][C][C][C][=C][N][Branch2][Ring1][=Branch1][C][/C][=C][Branch1][C][/C][C][C][/C][=C][Branch1][C][\C][C][C][C][=C][Branch1][C][C][C][N][=N][Ring2][Ring1][Ring2]
|
CHEMBL4285624
|
[C][C][NH1][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=Ring1][#Branch2][C][C@H1][Branch1][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1].[Cl]
|
CHEMBL4285625
|
[C][C][C@H1][O][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][P][O][C@H1][C][C@@][Branch1][C][C][Branch1][Ring1][O][C][C@@H1][Branch1][O][O][C][C][C][N][C][Branch1][C][C][=O][C@H1][Branch1][C][C][O][Ring2][Ring1][C][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][C][=O][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@][Ring2][Branch1][#Branch1][Branch1][C][C][O]
|
CHEMBL4285626
|
[C][O][C][=C][C][=C][Branch2][Ring2][=Branch1][C][N][C][=C][C][=C][Ring1][Branch1][/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][=C][Ring2][Ring1][#C]
|
CHEMBL4285627
|
[C][=C][C][C@][C][C@@][Ring1][Branch1][Branch1][C][O][C][C][C@H1][Ring1][#Branch1][C@@][C][=C][C@H1][Branch1][C][O][C@][Branch1][C][C][Branch1][Branch2][C][=Branch1][C][=O][O][Ring1][#Branch2][C@H1][Ring1][O][C@@H1][Ring2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
CHEMBL4285628
|
[C][O][C][=Branch1][C][=O][C][=C][Branch1][C][N][O][C][=C][Branch1][Ring1][O][C][C][=C][C][=C][Ring1][Branch2][C][Ring1][=N][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
CHEMBL4285629
|
[N][#C][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=C][N][=C][C][Branch1][#C][O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][=C][Ring1][S][S][Ring2][Ring1][Branch1]
|
CHEMBL4285630
|
[C][O][C][=C][C][Branch2][Ring1][=C][C][C][Branch1][Ring1][C][#N][=C][Branch1][C][N][O][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][Ring1][=N][O][C][C][N][Ring1][Branch2][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][=Branch2][O][C]
|
CHEMBL4285631
|
[C][O][C][=C][C][=C][Branch2][Ring2][=N][C][N][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][C][=C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring1][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][=N][Ring2][Ring1][=Branch2][C][=C][Ring2][Ring1][S][O][C]
|
CHEMBL4285632
|
[C][C][C][C][N+1][=N][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][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][=O].[O][=S][=Branch1][C][=O][Branch1][C][O-1][C][Branch1][C][F][Branch1][C][F][F]
|
CHEMBL4285704
|
[C][C][O][C][=Branch1][C][=O][C][C][Branch1][C][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2]
|
CHEMBL4285705
|
[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][Branch1][C][Cl][C][Branch1][C][F][=C][Ring1][Branch2]
|
CHEMBL4285706
|
[C][C][Branch2][Ring1][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=Branch1][C][=O][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2]
|
CHEMBL4285707
|
[O][=N+1][Branch1][C][O-1][C][=C][C][=C][NH1][C][Branch2][Ring1][#Branch1][C][N][C][C][N][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][=N][=N][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][#Branch1]
|
CHEMBL4285791
|
[C][O][C][=C][C][=C][Branch2][Ring1][=C][C][=C][C][=C][Branch2][Ring1][Ring1][S][C][=C][C][=Branch1][C][=O][N][Branch1][C][O][C][=Branch1][C][=O][NH1][Ring1][=Branch2][C][=C][Ring1][S][C][=C][Ring2][Ring1][=Branch1]
|
CHEMBL4285792
|
[C][C][C][Branch1][S][O][C][C][Branch1][C][O][C][N][C][C][O][C][C][Ring1][=Branch1][=C][N][N][=C][N][=C][Branch2][Ring2][O][O][C][=C][C][=C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][=N][C][=C][Ring2][Ring1][=Branch1][F][C][=Ring2][Ring2][N][Ring2][Ring1][=C]
|
CHEMBL4285793
|
[C][O][C][=C][C][=C][Branch2][Ring1][N][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][N][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][=N][Ring1][P][C][=C][Ring2][Ring1][#Branch1]
|
CHEMBL4285794
|
[C][C][Branch1][C][C][C][C@@H1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][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][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][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][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][Ring2][=Branch1][S][=O]
|
CHEMBL4285795
|
[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][#Branch2][N][S][Branch1][C][C][=Branch1][C][=O][=O][=C][N][Ring2][Ring1][Branch1][Ring1][O][C][C][Ring2][Ring1][N]
|
CHEMBL4285796
|
[F][C][=C][C][=C][C][Branch2][Ring2][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch2][Ring1][Ring1][C][C][C][=C][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][C][Ring2][Ring1][C][=C][Ring2][Ring1][=C]
|
CHEMBL4285879
|
[C][C@@H1][C@H1][C][=C][C][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][#Branch2][C][C][C@@][Ring1][=C][Branch1][C][C][C@][Ring2][Ring1][Ring1][Branch1][C][C][C][C][C@@][Ring2][Ring1][Branch2][Branch2][Ring1][C][C][=Branch1][C][=O][O][C][C][C][C][N][C][C][C][C][C][Ring1][=Branch1][C][C][C@H1][Ring2][Ring2][=Branch2][C]
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CHEMBL4285880
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[C][N][Branch2][Ring2][P][C][C][N][Branch1][C][C][C][C][=C][N][Branch2][Ring1][#C][C][C][O][C][=C][C][=C][O][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][=N][=C][Ring1][P][N][=N][Ring2][Ring1][=Branch2][C][C][=C][N][Branch2][Ring1][#C][C][C][O][C][=C][C][=C][C][=Branch1][C][=O][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Ring1][=N][=C][Ring1][P][N][=N][Ring2][Ring1][=Branch2]
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CHEMBL4285881
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[C][=C][C][=C][Branch2][Ring2][#C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch2][Ring1][=Branch1][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][Branch1][C][=C][Ring2][Ring2][Ring2]
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CHEMBL4285882
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[N][=C][Branch1][C][N][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N]
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CHEMBL4285883
|
[C][O][C@H1][C][C@H1][Branch2][Branch1][O][O][C@H1][C][C][C@][Branch1][C][C][C@H1][C][C][C@][Branch1][C][C][C@@H1][Branch1][O][C][=C][C][=Branch1][C][=O][O][C][Ring1][=Branch1][C@@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C][C@][Ring1][S][Branch1][C][O][C@@H1][Ring2][Ring1][Branch1][C][C][C@@H1][Ring2][Ring1][#Branch2][C][Ring2][Ring1][=C][O][C@@H1][Branch1][C][C][C@@H1][Ring2][Ring2][=Branch1][O]
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CHEMBL4285884
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[C][C][O][C][=C][Branch1][P][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring2][=O]
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CHEMBL4285885
|
[O][=C][Branch2][Ring2][N][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][P][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1]
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CHEMBL4285886
|
[C][O][C][=C][C][Branch1][Branch2][/C][=C][/C][Branch1][C][C][=O][=C][C][=C][Ring1][O][O][C][C][=C][N][Branch1][#C][C][=C][C][Branch1][C][F][=C][C][Branch1][C][Br][=C][Ring1][Branch2][N][=N][Ring1][=N]
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CHEMBL4285887
|
[C][C@@H1][O][C@@H1][Branch2][Branch2][#Branch2][O][C@H1][C@@H1][Branch1][C][O][C@@H1][Branch1][Ring1][C][O][O][C@@H1][Branch2][=Branch1][Ring1][O][C@H1][C][C][C@@][Branch1][C][C][C@@H1][Branch2][Ring2][#C][C][C][C@][Branch1][C][C][C@@H1][Ring1][Branch2][C][C][=Branch1][C][=O][C@@H1][C@@H1][Branch2][Ring1][Ring1][C@@][Branch1][C][C][Branch1][C][O][C][/C][=C][/C][Branch1][C][C][Branch1][C][C][O][C][C][C@][Ring1][#C][Ring2][Ring1][Branch1][C][C][Ring2][Ring1][#C][Branch1][C][C][C][C@@H1][Ring2][Ring2][O][O][C@@H1][O][C@@H1][Branch1][C][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][Branch1][#C][O]
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CHEMBL4285971
|
[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch1][C][Cl][=C][Branch1][=N][C][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][S][Ring1][S]
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CHEMBL4285972
|
[C][N][C][C][N][Branch2][Ring2][Branch1][C][C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][C][C][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][N]
|
CHEMBL4285973
|
[C][C][Branch1][C][C][=C][C][C][/C][Branch1][C][C][=C][/C][C][=C][Branch1][C][O][C][=C][C][Branch1][Ring1][C][=O][=C][Ring1][=Branch2][O]
|
CHEMBL4285974
|
[C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][#C][C][=C][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][C][Ring1][=C][=O][C][=Branch1][C][=O][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][S][=O]
|
CHEMBL4286045
|
[N][#C][C][=C][N][=C][Branch1][N][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][N][=C][Ring1][#C][N][C][C@@][C][C@H1][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][C@H1][Branch1][C][N][C@H1][Branch1][Ring2][C][Ring1][Branch2][C][Ring1][O]
|
CHEMBL4286046
|
[O][=C][Branch2][Ring1][=Branch1][N][C][=N][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][S][Ring1][N][C][=C][N][=C][C][=N][Ring1][=Branch1]
|
CHEMBL4286047
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][O][N][C][=Branch1][C][=O][C][C][C][N][C][=Branch1][C][=O][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][=O][C][=Branch1][C][=O][O]
|
CHEMBL4286048
|
[O][=C][Branch2][Ring2][C][C][C][C][C][P+1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][Branch2][Ring1][Ring2][C][=C][C][=C][Branch1][#Branch2][C][=Branch1][C][=O][C][Branch1][C][Cl][Cl][C][=C][Ring1][O][C][=C][Ring1][P][N+1][=Branch1][C][=O][O-1].[Br-1]
|
CHEMBL4286049
|
[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][Ring1][Branch2][C][C][C][O][C][=Branch1][C][=O][C][=C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=C][C][Branch2][Ring2][=Branch1][N][C][C][N][Branch2][Ring1][#Branch2][C][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][Ring1][N][C][C][Ring2][Ring1][Branch1][=C][Branch1][C][F][C][=C][Ring2][Ring1][N][C][Ring2][Ring2][Ring1][=O]
|
CHEMBL4286050
|
[C][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][Branch1]
|
CHEMBL4286131
|
[O][=C][Branch1][#Branch2][N][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][N][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=C][Ring1][#C]
|
CHEMBL4286132
|
[C][C][=C][C][Branch1][Branch2][N][C][=C][N][=C][Ring1][Branch1][=C][N][=C][Ring1][O][C][=C][C][=C][Branch1][Branch2][C][=N][N][=N][NH1][Ring1][Branch1][C][=C][Ring1][O]
|
CHEMBL4286133
|
[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][=C][Ring2][Ring1][=Branch1][Cl]
|
CHEMBL4286134
|
[C][N][C][C][N][Branch2][Ring2][#Branch1][C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][N][Ring2][Ring1][=Branch1][Ring1][N][C][C][C][Ring2][Ring1][=C][=O]
|
CHEMBL4286218
|
[C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][Branch2][Ring1][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][P]
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CHEMBL4286219
|
[C][=C][C][=Branch1][C][=O][N][C][C][C@@H1][O][C][C][N][Branch1][=C][C][=N][C][=N][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C@@H1][Ring1][#C][C][Ring2][Ring1][Ring1]
|
CHEMBL4286220
|
[C][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][P][C@H1][Branch2][Ring1][Branch2][O][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C@H1][Branch1][C][O][C][Branch1][C][C][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][#Branch1][C@@H1][Branch1][C][C][O][C][C][=Branch1][C][=O][O][C@@H1][Branch1][C][C][C@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=Branch1][C][=O][O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring2][=Branch1][C][C]
|
CHEMBL4286221
|
[Cl][C][=C][C][=C][Branch2][Ring1][S][C][N][=C][C][=C][C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][=C][N][Ring1][O][C][=Ring1][=C][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring2][Ring1][O]
|
CHEMBL4286222
|
[C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][N][C][=C][C][=N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][O][Ring1][#Branch1][N+1][Branch1][C][O-1][=C][C][=C][C][=C][C][Ring1][=Branch1][=N+1][Ring2][Ring1][N][O-1]
|
CHEMBL4286310
|
[C][C][=C][C][Branch2][Ring1][Branch2][C][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][O][C][C][C][S][C][=C][C][=Ring1][Branch1][Ring1][O][=C][Branch1][C][C][N][Ring2][Ring1][Branch1][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
CHEMBL4286311
|
[C][C@@H1][C][C][C@H1][C@@H1][Branch1][C][C][C@@H1][Branch2][#Branch1][C][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][Ring1][#Branch1]
|
CHEMBL4286312
|
[N][#C][C][=C][Branch1][C][N][O][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=C][Ring1][=Branch1][C][Ring1][O][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][=Branch2][C][C][N][Ring1][P]
|
CHEMBL4286313
|
[Cl][C][=C][C][=C][C][Branch2][Ring1][=C][N][C][C][N][Branch2][Ring1][C][C][C][O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][=Branch2]
|
CHEMBL4286314
|
[O][=C][Branch1][C][O][C][=C][C][=N][C][Branch1][P][C][=C][N][Branch1][Branch2][C][C][C][N][C][Ring1][Branch1][C][=N][Ring1][#Branch2][=C][Ring1][S]
|
CHEMBL4286315
|
[N][#C][/C][=C][/C][=C][C][Branch1][C][F][=C][Branch2][Ring2][Branch2][N][C][=N][C][Branch1][=N][N][C][C][C][N][C][C][O][C][C][Ring1][=Branch1][=N][C][Branch1][=C][N][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][=N][Ring2][Ring1][=Branch2][C][Branch1][C][F][=C][Ring2][Ring2][C]
|
CHEMBL4286316
|
[C][C][=C][Branch1][C][Br][C][Branch1][C][C][=N+1][C][Ring1][#Branch1][C][Branch2][Ring1][#C][C][C][Branch1][C][C][C][C][C][=C][Branch1][C][C][C][Branch1][C][O][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][#Branch2][O][Ring1][#C][C][=C][Branch1][C][C][C][Branch1][C][Br][=C][Branch1][C][C][N][Ring1][Branch2][B-1][Ring2][Ring1][N][Branch1][C][F][F]
|
CHEMBL4286318
|
[C][=C][=C][C][=Branch1][C][=O][N][C][=C][C][Branch2][Ring1][N][N][C][=N][C][=C][C][Branch1][P][C][=C][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][=N][Ring1][S][=C][Branch1][Ring1][O][C][C][=C][Ring2][Ring1][=Branch2][N][Branch1][C][C][C][C][N][Branch1][C][C][C]
|
CHEMBL4286403
|
[O][=C][NH1][C][Branch2][=Branch1][Branch1][C][=C][C][=C][Branch2][Branch1][=Branch2][O][C][C][C][C][=C][N][Branch2][Ring2][#Branch2][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][N][=N][Ring2][Ring1][S][C][=C][Ring2][Ring2][#Branch2][=N][C][=C][C][=C][C][=C][Ring2][Branch1][Ring2][Ring1][=Branch1]
|
CHEMBL4286404
|
[O][=C][Branch1][=C][N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][C][=C][Branch2][Ring2][Ring2][C][C][C][=Branch1][C][=O][N][Branch1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring2][Ring1][=Branch1][C][=C][Ring2][Ring1][N]
|
CHEMBL4286405
|
[C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Ring1][#Branch2][Ring2][Ring1][C]
|
CHEMBL4286406
|
[C][C][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][C][C][Branch1][Ring1][C][C][N][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=Branch1][C][=O][C][=C][Ring1][#Branch2][Ring2][Ring1][Ring2]
|
CHEMBL4286407
|
[C][C][=C][C][=C][Branch2][=Branch1][S][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch2][Branch1][=C][O][C][C][C][C][C][=C][N][Branch2][Ring2][=C][C][C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][N][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=Ring1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2][N][=N][Ring2][Ring2][Ring2][C][=C][Ring2][Ring2][#C][C][Branch1][C][O][=C][Ring2][Branch1][#Branch2]
|
CHEMBL4286408
|
[O][=C][Branch1][N][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
CHEMBL4286409
|
[O][=C][Branch1][=C][N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
CHEMBL4286492
|
[C][C][C][C][S][C][=C][C][=C][N][=C][Branch1][#Branch2][N][C][=Branch1][C][=O][C][C][O][C][S][C][Ring1][N][=C][Ring1][S]
|
CHEMBL4286493
|
[C][C][C][C][C][C][C][C][C][C][C][C][C][=C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N+1][Ring1][N][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2].[Br-1]
|
CHEMBL4286494
|
[C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][C][=C][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][C][Ring1][Branch2][=C][Ring1][N][Ring1][#C]
|
CHEMBL4286495
|
[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][N][C][C][Branch1][C][F][Branch1][C][F][F][=C][Branch2][Ring1][P][C][=C][C][=C][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][Ring1][=Branch2][=C][Ring2][Ring1][C][C][=C][Ring2][Ring2][Branch2][Ring2][Ring1][=C]
|
CHEMBL4286496
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][N][N][C][=Branch1][C][=O][/C][=N][/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][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][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][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][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][Branch2][Branch1][Ring1][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@@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][Branch1][C][N][=O][C@@H1][Branch1][C][C][O]
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CHEMBL4286497
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[C][C][Branch1][C][C][C][C][C][C][C][Branch1][C][C][C][C][O][C@@H1][C@@H1][Branch1][Ring1][C][N][O][C@H1][Branch2][Ring1][Ring2][O][C@@H1][C@@H1][Branch1][C][N][C][C@@H1][Branch1][C][N][C@H1][Branch1][C][O][C@H1][Ring1][=Branch2][O][C@H1][Branch1][C][N][C@H1][Ring2][Ring1][Ring2][O][C][C][C][Branch1][C][C][C][C][C][C][C][Branch1][C][C][C]
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CHEMBL4286498
|
[C][C][=C][N][Branch2][Ring1][=C][C][C][C][C][C][C][C][C][O][C][=C][C][=C][C][Branch1][C][C][=C][C][=Branch1][C][=O][O][C][Ring1][Branch2][=C][Ring1][N][C][=N][Ring2][Ring1][#Branch2]
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CHEMBL4286499
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[Cl].[O][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][C][=C][Branch1][#Branch2][O][C][C][C][N][C][C][Ring1][=Branch1][C][=C][C][=C][Ring1][=N][O][Ring1][S]
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CHEMBL4286500
|
[C][C@][C][C@@][C][=C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][C][=O][C][=C][Ring1][Branch2][C][=Branch1][C][=O][C@@][Branch1][C][C][Branch2][Ring1][O][C][C][C][=Branch1][C][=O][N][C][=C][Branch1][C][O][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][O][C@@H1][Ring2][Ring1][S][C@H1][Branch1][#Branch2][C][C@H1][Ring2][Ring2][Branch1][C][Ring2][Ring2][Ring2][O][Ring2][Ring2][#Branch1]
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CHEMBL4286501
|
[C][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][Ring1][Branch2][C][=Branch1][C][=O][O][C][C@H1][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C@@H1][C@H1][Branch1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][C][N][C][O][C][=Branch1][C][=O][N][C@H1][Branch1][#C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][O][C][S][C][Ring2][Ring2][Branch1]
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CHEMBL4286581
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[C][O][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][=O][C][=C][Ring2][Ring1][=N]
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