chembl_id
stringlengths 7
13
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stringlengths 3
6.7k
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CHEMBL4284414
|
[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Branch1][#Branch2][C][N][Branch2][Ring1][#C][C][C][=C][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][=C][Ring1][#Branch2][C][=C][Ring1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][Branch1][C][C][C][=C][Ring1][Branch2][C][O][Ring2][Ring2][Ring2]
|
CHEMBL4284415
|
[C][C][=C][Branch1][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][C][Branch1][C][N][=N][N][Ring1][=C][C]
|
CHEMBL4284416
|
[C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][/C][=C][/C][=Branch1][C][=O][O]
|
CHEMBL4284417
|
[C][C][=C][Branch1][C][C][C][=C][Branch2][Ring1][P][C][Branch1][C][C][=C][Ring1][Branch2][O][C][C][=C][C][=C][Branch1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][#C][C][C][C][Branch1][C][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][O][Ring2][Ring2][O]
|
CHEMBL4284418
|
[C][N][Branch2][Branch1][=Branch1][C][C][=C][C][=N][C][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][=C][Branch2][Ring1][=Branch1][C][N][C][C][N][Branch1][O][C][=Branch1][C][=O][C][C][O][C][Ring1][Ring2][C][C][Ring1][N][N][Ring2][Ring1][#Branch2][C][=Ring2][Ring1][=C][S][Branch1][C][C][=Branch1][C][=O][=O]
|
CHEMBL4284500
|
[C][C@@H1][Branch1][C][O][C][C][C][/C][=C][/C][=C][/C@H1][Branch1][C][O][C][C@@H1][Branch1][C][O][C][/C][=C][\C][=C][\C@@H1][Branch1][C][O][C][/C][=C][/C][=C][\C][=Branch1][C][=O][O]
|
CHEMBL4284501
|
[C][C][N][C][=Branch1][C][=O][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][Branch1][C][C][C][C][Ring1][Ring2][=C][C][=C][Ring1][=C][Ring2][Ring1][Branch1]
|
CHEMBL4284502
|
[C][C][C][=C][C][=C][Branch1][C][O][C][Branch2][=Branch1][Ring2][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][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][N][C][=C][Ring2][Ring2][#Branch1][=C][Ring2][Branch1][C]
|
CHEMBL4284503
|
[C][C][C][C][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][NH1][C][Branch2][Ring1][O][/C][=C][\C][=Branch1][C][=O][N][C][=N][C][Branch1][C][C][=C][Branch1][C][O][C][Branch1][C][C][=C][Ring1][=Branch2][Ring1][=N][=C][Ring2][Ring1][Ring2][C]
|
CHEMBL4284504
|
[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][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][=C][Ring2][Ring1][=Branch1]
|
CHEMBL4284581
|
[C][C][=C][C][=C][NH1][C][=C][Branch2][Ring2][=Branch1][C][Branch1][P][C][=C][NH1][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch2][Ring1][#Branch1][P][=Branch1][C][=O][Branch1][#Branch1][O][C][Branch1][C][C][C][O][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch2][=C][Ring2][Ring1][=C]
|
CHEMBL4284582
|
[C][N][Branch1][C][C][C][C][C][C][N][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][Branch2][Ring1][=C][C][N][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][P][=O][=C][Ring2][Ring1][=Branch2]
|
CHEMBL4284583
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][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]
|
CHEMBL4284584
|
[N][C][O][C][=C][Branch2][Ring1][Ring2][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][C][=C][Ring2][Ring1][Ring1][C][=Ring2][Ring1][=Branch1][N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2]
|
CHEMBL4284585
|
[C][O][C][=C][C][=C][Branch2][Ring1][=Branch2][/C][=C][\C][C][C][/C][=Branch1][=N][=C][\C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][Ring1][=C][=O][C][=C][Ring2][Ring1][=Branch1][O][C]
|
CHEMBL4284667
|
[C][C][C][C][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Ring1]
|
CHEMBL4284668
|
[O][=C][Branch2][Branch1][P][N][C][C][C][C][N][C][=Branch1][C][=O][N][C][C][O][C][C][O][C][C][O][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][#Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch1][N][C][C][O][C][C][O][C][C][O][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][#Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch1]
|
CHEMBL4284669
|
[C][O][C][=Branch1][C][=O][C@H1][Branch2][Ring2][=Branch1][N][C][=Branch1][C][=O][C][C][/C][Branch1][C][C][=C][/C][C][=C][Branch1][C][O][C][=C][Branch1][#Branch2][C][Branch1][C][C][=C][Ring1][Branch2][O][C][C][O][C][Ring1][#Branch2][=O][C][Branch1][C][C][O]
|
CHEMBL4284670
|
[C][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][N][=C][C][Branch1][C][O][=C][Branch1][C][Br][C][=C][Branch1][C][Br][C][Ring1][=Branch2][=C][Ring1][=C][C]
|
CHEMBL4284671
|
[C][O][C][C][N][Branch2][Ring1][S][C][C][Branch1][C][O][C][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Ring1][#C][S][Branch1][C][C][=Branch1][C][=O][=O]
|
CHEMBL4284760
|
[O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch2][Ring1][=N][C][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]
|
CHEMBL4284761
|
[C][C][N][C][=C][C][Branch2][Ring1][O][C][=C][C][=C][Branch1][S][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=C][Ring1][P][C][=C][C][=N][Ring2][Ring1][Branch2]
|
CHEMBL4284762
|
[C][C][C][C][C][N][C][C][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][N]
|
CHEMBL4284763
|
[C][C][Branch1][C][C][C][C][C][=C][Branch2][Ring1][P][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][NH1][C][Ring2][Ring1][Branch1][=Ring1][=N][O][Ring2][Ring1][#Branch2]
|
CHEMBL4284852
|
[Cl][C][=C][C][=C][Branch2][Ring1][Branch1][C][O][C][=C][N][=C][C][Branch1][=Branch2][C][=C][C][N][C][C][Ring1][=Branch1][=C][Ring1][N][C][Branch1][C][Cl][=C][Ring2][Ring1][Branch1]
|
CHEMBL4284853
|
[C][C][=C][C][NH1][C][=Branch1][C][=O][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=N][C][Branch1][C][C][=C][Ring2][Ring1][C][C][=C][C][=C][Branch1][#Branch2][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][=N]
|
CHEMBL4284854
|
[C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring1][#Branch2][C][C][C][=Branch1][C][=O][N][/N][=C][/C][=C][C][=C][Branch1][=Branch1][N][Branch1][C][C][C][C][=C][Ring1][=Branch2]
|
CHEMBL4284855
|
[O][=C][Branch1][C][O][C][=C][C][=N][C][Branch2][Ring1][Branch1][N][N][=C][C][=C][Ring1][Branch1][C][=C][C][=C][C][=N][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][=C][Ring2][Ring1][Ring2]
|
CHEMBL4284856
|
[C][C][C][=C][C][Branch1][#Branch1][/C][Branch1][C][N][=S+1][/O-1][=C][C][=N][Ring1][#Branch2]
|
CHEMBL4284934
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring2][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][O]
|
CHEMBL4284935
|
[C][C][C][C][C@@H1][Branch1][Ring2][C][C][O][N][C][=N][C][Branch1][C][N][=N][C][=C][Ring1][#Branch1][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][C][=N][Ring1][=Branch1][C][C][Ring1][=C]
|
CHEMBL4284936
|
[N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][C][N][N][=C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][C][=C][Ring1][#Branch2][C][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][O][C][=C][Ring2][Ring1][O]
|
CHEMBL4284937
|
[C][N][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][=C][C][C][=C][Branch1][N][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C@@H1][Ring1][=N][C][=C][C][=C][Branch1][C][Br][S][Ring1][=Branch1][C][Ring2][Ring1][Branch2][=O]
|
CHEMBL4285013
|
[N][C][=N][C][O][C][=C][C][=C][Branch1][#C][C][=C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][C][=C][Ring1][=C][C][=Branch1][C][=O][C][=Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][#Branch1][C][=Branch1][C][=O][O]
|
CHEMBL4285014
|
[C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][C][N][Branch1][C][C][C][=N][C][=N][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][C]
|
CHEMBL4285015
|
[C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Branch2][Ring1][=N][C][N][C][=N][C][Branch2][Ring1][C][C][=C][C][Branch1][Branch2][C][N][=N][NH1][N][=Ring1][Branch1][=C][C][=N][Ring1][O][=C][Ring1][S][C][Ring2][Ring1][#Branch1]
|
CHEMBL4285016
|
[C][C][C][C][C][Branch1][Ring1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][C][O][=C][Branch1][=Branch1][C][Branch1][C][C][=O][C][Ring1][#Branch2][C][=C][C][=C][O][Ring1][Branch1]
|
CHEMBL4285017
|
[O][=C][Branch2][Ring1][=Branch1][C][=C][C][=C][Branch1][C][Cl][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][C][Branch1][C][Cl][Cl]
|
CHEMBL4285096
|
[O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C][=C][N][Branch1][Branch1][N][=N][Ring1][Branch1][C][C][Ring2][Ring1][Ring1]
|
CHEMBL4285097
|
[C][N][Branch2][Ring2][N][C][C][=Branch1][C][=O][N][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][C][=C][Ring1][N][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][#Branch2][F]
|
CHEMBL4285098
|
[C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][C][=C][Branch1][#Branch2][C][N][C][C][C][C][C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S][C][=C][Ring2][Ring1][#Branch1]
|
CHEMBL4285099
|
[O][=C][Branch2][Ring1][=N][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][=N][C][=C][Ring1][=Branch1]
|
CHEMBL4285100
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=N][N][=C][C][=C][Branch2][Ring1][#Branch1][O][C][C][C][C][C][C][Branch1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring1][#Branch2][C][Branch1][C][Cl][=C][N][Ring2][Ring1][=Branch1][Ring2][Ring1][Ring1]
|
CHEMBL4285183
|
[C][C][C][C][N][Branch2][Ring2][Ring1][C][C][Branch1][C][C][Branch1][C][O][C][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Ring1][#C][S][Ring2][Ring1][=Branch2][=Branch1][C][=O][=O]
|
CHEMBL4285184
|
[C][C][=C][C][=C][Branch2][Ring2][=N][/N][=C][/N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=C][=C][/C][=C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring1][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][S][Ring2][Ring1][=Branch2][C][=C][Ring2][Ring1][S]
|
CHEMBL4285185
|
[C][O][C][=C][C][=C][Branch2][Ring1][Ring2][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][Ring1]
|
CHEMBL4285186
|
[N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C@H1][C][C][C][C@H1][Ring1][Branch1][C@@H1][Branch1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][N][Ring1][P]
|
CHEMBL4285269
|
[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][Branch2][Ring1][Ring2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][Branch1][C][F][=C][Ring2][Ring1][C]
|
CHEMBL4285270
|
[C][C][Branch1][C][C][Branch2][Ring1][O][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][C][N+1][Branch1][C][C][Branch1][C][C][C][C][C][C][C][C][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C][C][#C][C][O][C][=N][O][C][C][Ring1][Branch1].[Br-1].[Br-1]
|
CHEMBL4285271
|
[C][O][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring2][#Branch1][C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][C][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][Ring2][Ring1][=N]
|
CHEMBL4285272
|
[C][O][C][C][O][C][C][O][C][C][O][C][C][N][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][N][/C][=C][\C][C][/C][=Branch2][Ring1][#C][=C][\C][=C][C][=C][Branch2][Ring1][C][N][Branch1][C][C][C][C][O][C][C][O][C][C][O][C][C][O][C][C][=C][Ring2][Ring1][Branch1][C][Ring2][Ring1][O][=O][C][=C][Ring2][Ring2][Ring1]
|
CHEMBL4285273
|
[C][O][C][=C][C][=C][Branch2][#Branch1][N][N][C][C][N][Branch2][=Branch1][S][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][Branch2][Ring1][Branch2][C][N][C][C][N][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][C][Ring1][=C][C][Branch1][C][O][=C][Ring2][Ring1][=Branch1][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][O][C][C][Ring2][Ring2][=N][C][C][Ring2][Branch1][=Branch1][C][=C][Ring2][Branch1][N]
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CHEMBL4285274
|
[N][C][O][C][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][=C][C][=C][Ring1][N][C][=Ring1][#C][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1]
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CHEMBL4285275
|
[C][C][C@H1][Branch1][C][C][C@@H1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][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][#Branch1][C@@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][S][S][C][C@@H1][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][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@@H1][C][S][S][C][C@H1][Branch2][N][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@H1][Branch2][Ring2][=Branch1][C][S][S][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][N][C][Ring2][Branch2][=N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][Ring2][Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C@@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][N][=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][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][Ring2][#Branch2][=Branch2][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][Branch1][C][C][C][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@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][Ring2][=N][=Branch1]
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CHEMBL4285344
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][=Branch1][C][=O][N][C][=N][C][Branch1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][=C][S][Ring1][N]
|
CHEMBL4285345
|
[C][C][Branch1][C][C][C][C][C][C@@H1][Branch1][C][C][C@H1][C][C][C@H1][C@H1][C@H1][Branch1][=Branch2][C][C][C@@][Ring1][=Branch1][Ring1][=Branch2][C][C@@][Branch1][C][C][C][C][C][=Branch1][C][=O][C][=C][Ring1][Branch2][C][C@H1][Ring1][S][O]
|
CHEMBL4285346
|
[C][O][C][=C][C][=C][C][Branch2][Ring2][=N][C][N][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][N][Ring1][N][C][=Ring1][#C][C][N][C][C][N][Branch1][O][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][C][Ring1][N][=C][Ring2][Ring2][C]
|
CHEMBL4285347
|
[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][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][O]
|
CHEMBL4285348
|
[2H][C][Branch1][C][2H][Branch1][C][2H][C][=C][Branch1][C][C][C][Branch1][C][O][=C][Branch2][Ring1][S][C][C][C@][Branch1][C][C][Branch1][C][O][C][C][C][C@H1][Branch1][C][C][C][C][C][C@H1][Branch1][C][C][C][C][C][C][Branch1][C][C][C][C][Branch1][=Branch2][C][Branch1][C][2H][Branch1][C][2H][2H][=C][Ring2][Ring1][P][O]
|
CHEMBL4285349
|
[O][=C][C][=C][Branch2][=Branch1][C][C][=C][C][=C][Branch2][Branch1][=Branch1][O][C][C][O][C][C][N][C][=C][Branch2][Ring2][Branch1][C][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][O][C][=C][Ring2][Ring2][#Branch1][O][C][=C][C][=C][C][=C][Ring2][Ring2][P][Ring1][=Branch1]
|
CHEMBL4285433
|
[C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch2][Ring2][Ring1][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][=C][C][=N][Ring2][Ring1][=Branch2]
|
CHEMBL4285434
|
[O][=C][NH1][C][=N][C][=C][Ring1][=Branch1][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4285435
|
[Cl].[C][N][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][=N][C][=C][C][=C][C][Branch1][#Branch2][O][C][C][C][N][C][C][Ring1][=Branch1][=C][Ring1][=N][Ring2][Ring1][=C]
|
CHEMBL4285436
|
[C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][O][C][=C][C][=N][N][Ring1][Branch1][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2]
|
CHEMBL4285437
|
[C][C][C@H1][O][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][#Branch1][O][C@H1][C][C@@][Branch1][C][C][Branch1][Ring1][O][C][C@@H1][Branch1][C][O][C@H1][Branch1][C][C][O][Ring1][O][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][C][O][C][C@@H1][Branch1][C][C][C][N][Branch1][N][C][C][C][N][C][=Branch1][C][=O][C][O][C][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@][Ring2][Branch1][Branch2][Branch1][C][C][O]
|
CHEMBL4285526
|
[C][C][=Branch1][C][=O][C][S][C][Branch2][Ring2][=Branch2][N][/N][=C][/C][=C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][=N][C][Ring2][Ring1][=Branch1][=O][=N][C][=Ring2][Ring1][=C][C]
|
CHEMBL4285527
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][N][=C][Branch1][S][C@@H1][C][C][O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][C][Ring1][=Branch2][C][=C][Ring1][=C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
CHEMBL4285528
|
[C][C][Branch1][C][C][Branch1][C][C][N][N][=C][C][=C][Ring1][Branch1][C][=C][C][=C][Branch1][#C][O][C][=N][C][=C][C][O][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C][=C][Ring1][S]
|
CHEMBL4285529
|
[N][C][O][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][C][=C][Ring1][N][C][=Ring1][#C][N][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2]
|
CHEMBL4285604
|
[N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][/N][=C][/C][=C][C][=C][Branch2][Ring1][Ring2][N][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][=C]
|
CHEMBL4285605
|
[C][O][/C][=Branch1][P][=C][\C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][C][O][=C][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N]
|
CHEMBL4285606
|
[C][C][=C][C][=C][Branch2][Branch1][=Branch2][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][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring2][Branch2]
|
CHEMBL4285607
|
[C][C][=C][C][=Branch1][C][=O][C][Branch1][C][O][=C][Branch2][Ring1][=Branch2][C][Branch1][C][O][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][O][Ring2][Ring1][Branch2]
|
CHEMBL4285686
|
[O][=C][NH1][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][C][=N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][NH1][Ring1][#Branch2][O][C][O][Ring2][Ring1][Ring1]
|
CHEMBL4285687
|
[C][C][Branch1][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=N][C][Branch1][S][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2][=C][Ring1][=C]
|
CHEMBL4285688
|
[N][#C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Branch2][Ring2][S][N][C][=N][C][Branch1][#C][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][=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][Branch2][C][Ring2][Ring1][#C]
|
CHEMBL4285689
|
[C][C][Branch1][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C@@H1][C@][Ring1][#Branch1][Branch1][C][C][C][C][C][C@@][Ring1][#Branch1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]
|
CHEMBL4285690
|
[O][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][Branch2][=Branch1][#Branch2][O][C][C][O][C][C][N][C][=C][Branch2][Branch1][=Branch2][C][=C][C][=C][C][Branch2][Ring2][=N][C][=C][N][Branch2][Ring2][C][C][C][O][C][C][O][C][=C][C][=C][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][=Branch1][C][=O][C][Ring1][=N][=C][Ring1][P][N][=N][Ring2][Ring1][N][=C][Ring2][Ring2][C][N][=N][Ring2][Ring2][#Branch1][=C][C][=C][Ring2][Branch1][=N][Ring2][Branch1][Ring1]
|
CHEMBL4285691
|
[O][=C][Branch1][O][C][C][P][=Branch1][C][=O][Branch1][C][O][O][N][C][C@@H1][Branch1][#C][O][C][C@H1][Branch1][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][Branch1][P][N][C][=N][C][=C][Branch1][C][O][N][=C][N][=C][Ring1][#Branch1][Ring1][#Branch2][C][Ring2][Ring1][#Branch1]
|
CHEMBL4285768
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=O][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][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][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][C][N][N][C][Ring2][#Branch1][Ring2][=O]
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CHEMBL4285769
|
[F][C][=C][C][=C][C][Branch2][Ring2][Ring1][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][=C][Ring2][Ring1][Ring2][Br][=C][Ring2][Ring1][O][F]
|
CHEMBL4285770
|
[C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][N][N][=N][C][Branch2][Ring2][O][C][=C][C][=N][C][Branch2][Ring1][#C][C][N][=C][N][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=Ring1][=N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][Ring2][Ring1][#Branch2][=N][Ring2][Ring1][#C]
|
CHEMBL4285771
|
[O][=C][Branch2][Ring1][Branch2][N][C][=C][C][Branch1][C][O][=C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=C][C][C][C][C][C][Ring1][Branch1]
|
CHEMBL4285772
|
[C][C][N+1][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][C][C][C][C][C][C][C][O][C][=C][C][=C][Branch1][O][/C][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C].[I-1]
|
CHEMBL4285773
|
[C][C][N][C][=C][Branch2][Ring1][C][C][=N][C][=C][C][=C][Branch1][Ring1][O][C][N][=C][Ring1][Branch2][NH1][Ring1][O][C][=C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][=C][C][=C][Ring2][Ring1][Ring2][Ring2][Ring2][C]
|
CHEMBL4285860
|
[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][Ring1][C][N][C][C][C][Branch1][Branch2][C][C][C][O][C][Ring1][=Branch1][C][C][Ring1][O][C][=C][Ring2][Ring1][C]
|
CHEMBL4285861
|
[N][C][O][C][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][=C][C][=C][Ring1][N][C][=Ring1][#C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
|
CHEMBL4285862
|
[C][O][C][=C][C][=C][Branch2][Ring1][O][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][=Branch1]
|
CHEMBL4285863
|
[C][C][=C][C@][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][Ring2][C][=C][Branch1][C][C][C@@H1][Branch1][C][O][C@][Ring1][#Branch2][Branch1][C][O][C@H1][Ring1][=C][O][C@H1][C@@H1][Branch1][=Branch1][C][C@H1][Ring1][P][C][C][Ring1][=Branch1][Branch1][C][C][C]
|
CHEMBL4285864
|
[C][C][Branch1][C][C][C][C@@H1][C][N][Branch2][Ring1][#Branch2][C][C][C][C][C@H1][C][N][C][Branch1][=N][C][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring1][#C][C][=Branch1][C][=S][N][Ring2][Ring1][=Branch2][C][C][C][C][C][C][C][C][C][Ring1][=Branch1]
|
CHEMBL4285865
|
[C][C][C][C][C][N][C][C][=Branch1][C][=O][N][Branch2][=C][#Branch2][C][C][=Branch1][C][=O][N][Branch2][=N][Branch1][C][C][=Branch1][C][=O][N][Branch1][O][C][C][C][C][N][C][=Branch1][C][=N][N][C][C][=Branch1][C][=O][N][Branch2][#Branch2][=C][C][C][=Branch1][C][=O][N][Branch2][=Branch2][=Branch2][C][C][=Branch1][C][=O][N][Branch1][=Branch1][C][C][C][C][C][C][C][=Branch1][C][=O][N][Branch2][#Branch1][#Branch1][C][C][=Branch1][C][=O][N][Branch2][=Branch1][C][C][C][=Branch1][C][=O][N][Branch1][O][C][C][C][C][N][C][=Branch1][C][=N][N][C][C][=Branch1][C][=O][N][Branch2][Ring1][O][C][C][=Branch1][C][=O][N][Branch1][#Branch1][C][C][Branch1][C][N][=O][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
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CHEMBL4285947
|
[C][N][C][=N][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][C][=N][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=N][N][Ring2][Ring1][=C][Ring1][#Branch2]
|
CHEMBL4285948
|
[C][C][=N][O][C][Branch2][Ring1][#Branch1][C][N][N][=N][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][N][=C][N][Ring1][Branch2][C][Ring1][N][=O][=N][Ring2][Ring1][Ring1]
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CHEMBL4285949
|
[C][C][C][=C][C][Branch2][Ring1][Ring2][C][=N][N][Branch1][C][C][C][=N][C][=N][C][Branch1][C][N][=C][Ring1][O][Ring1][#Branch1][=C][C][=C][Ring1][P][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2]
|
CHEMBL4285950
|
[C][C][Branch1][C][C][O][B][Branch2][Ring2][S][C][=C][C][=C][Branch2][Ring2][Ring2][C][O][N][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][S][C][=C][Ring2][Ring1][=N][O][C][Ring2][Ring2][Ring1][Branch1][C][C][C]
|
CHEMBL4285951
|
[C][C][S][C][=C][C][=C][C][=Branch1][=Branch1][=C][C][Ring1][#Branch1][=O][C@@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][C][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][Ring2][Ring1][Branch2]
|
CHEMBL4285952
|
[C][C][C][Branch1][Branch2][O][C][C][Branch1][C][C][O][=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][=Branch1][Ring2][Ring1][=C]
|
CHEMBL4286024
|
[C][C][=N][C][Branch2][Ring2][Branch2][C][=N][C][Branch1][=C][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][=N][C][Branch1][=C][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][=N][Ring2][Ring1][Ring2][=C][O][Ring2][Ring1][=Branch2]
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CHEMBL4286025
|
[C][=C][C][C][=C][C][=C][Branch2][Ring2][#Branch2][O][C@@H1][O][C@H1][Branch1][Branch2][C][O][C][Branch1][C][C][=O][C@@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Ring2][Ring1][Ring1][O][C][Branch1][C][C][=O][C][Branch2][Branch1][#Branch1][C][=C][C][Branch1][Ring2][C][C][=C][=C][C][=C][Ring1][=Branch2][O][C@@H1][O][C@H1][Branch1][Branch2][C][O][C][Branch1][C][C][=O][C@@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Ring2][Ring1][Ring1][O][C][Branch1][C][C][=O][=C][Ring2][Branch1][#C]
|
CHEMBL4286026
|
[C][C][=C][C@@H1][Branch2][Ring1][Branch2][O][/C][=C][/C][=Branch1][C][=O][O][C@@H1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Ring1][=N][Ring1][=Branch2][O][C][Ring2][Ring1][Ring2][=O]
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