chembl_id
stringlengths 7
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stringlengths 3
6.7k
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CHEMBL4285975
|
[C][C][O][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][O][C][=C][C][=N][C][Branch2][Ring1][Branch2][N][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][N][=N][Ring2][Ring1][Ring1]
|
CHEMBL4285976
|
[Br][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][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=Branch2]
|
CHEMBL4285977
|
[O][=C][Branch1][C][O][C][=C][C][=N][C][Branch1][P][N][N][=C][C][=C][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][C]
|
CHEMBL4285978
|
[O][=C][Branch1][O][C][C][N][C][C][O][C][C][Ring1][=Branch1][N][C][=C][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=C][O][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=N][C][Ring1][#Branch2][=C][Ring2][Ring1][Ring1]
|
CHEMBL4286051
|
[C][O][C][=C][C][=C][Branch2][Ring2][#Branch1][C][N][Branch1][#C][C][=Branch1][C][=O][C][S][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][C][=C][Ring2][Ring1][=C]
|
CHEMBL4286052
|
[C][C][C][=C][C][=C][Branch2][Ring2][Ring2][C@@H1][C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][C@@H1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][N][Ring2][Ring1][Ring2][Ring1][=Branch2][S][Ring2][Ring1][=Branch2]
|
CHEMBL4286053
|
[O][=C][Branch2][Ring1][Ring1][C][C][C][C][N][Se][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][=O][N][O]
|
CHEMBL4286054
|
[C][C][=Branch1][C][=O][O][C@@H1][C][C][C@@][Branch1][C][C][C@@H1][C][C][C@][Branch1][C][C][Branch1][C][O][C][C][=C][Ring1][=Branch2][C][C][C@@H1][Ring1][=C][C][Ring2][Ring1][C][Branch1][C][C][C]
|
CHEMBL4286055
|
[C][O][C][=C][C][Branch2][Ring2][N][C][=C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][=Branch1][O][C][C][C][C][N][C][Branch1][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][=C][Ring2][Ring1][Branch1][O][Ring2][Ring1][#Branch2][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring2][C][O][C]
|
CHEMBL4286135
|
[Cl][C][=C][C][=C][Branch2][Ring1][S][C][N][=C][C][=C][C][Branch1][Branch2][C][=N][C][=C][S][Ring1][Branch1][=C][N][Ring1][O][C][=Ring1][=C][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring2][Ring1][O]
|
CHEMBL4286136
|
[C][C][Branch1][C][C][=C][C][C][=C][Branch2][Ring1][#Branch1][O][C][C][=C][N][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][=N][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch2][=O]
|
CHEMBL4286137
|
[C][=C][C@@H1][Branch1][C][O][C][C][=N][S][C][Branch2][Ring1][Branch2][C][=C][C][C][S][C@][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][=N][Ring2][Ring1][Ring2]
|
CHEMBL4286138
|
[O][/N][=C][Branch1][=Branch2][\C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][=C][C][=C][Ring1][=N][O]
|
CHEMBL4286223
|
[N][#C][C][=C][N][=C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][N][=C][Ring1][=C][N][C][C@H1][C][C][C@H1][Branch1][Ring1][C][N][C][C][Ring1][Branch2]
|
CHEMBL4286224
|
[C][N][C][Branch1][S][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][=C][S][/C][Ring1][=C][=N][/N][=C][/C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2]
|
CHEMBL4286225
|
[C][C][N][C][=N][C][=C][Ring1][Branch1][C][=Branch1][C][=O][NH1][C][=Branch1][C][=O][N][Ring1][Branch2][C][C][=C][C][=C][Branch2][Ring1][=C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][C][=C][Ring2][Ring1][=Branch2]
|
CHEMBL4286226
|
[O][=C][Branch2][Ring1][P][C][O][C][=C][C][=C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][/C][=C][/C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=C][Ring2][Ring1][C][N][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1]
|
CHEMBL4286227
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][Branch1][N][C][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][=N][C][Branch2][Ring1][Branch1][N][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][C][C][=Branch1][C][=O][N][O][=N][C][Ring2][Ring2][Ring2][=C][Ring2][Ring2][Branch2]
|
CHEMBL4286228
|
[O][=C][Branch1][C][O][C][=C][N][=C][Branch2][Branch1][#Branch1][N][C][C][Branch1][C][O][Branch2][Ring2][#Branch2][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][C][C][Ring1][Ring1][C][=C][Ring2][Ring1][Branch2][Cl][C][Ring2][Ring1][=C][C][Branch1][C][F][=C][Ring2][Ring2][Branch1]
|
CHEMBL4286317
|
[C][C][N][C][=C][Branch1][P][C][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][NH1][Ring1][#Branch2][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][Ring1][P]
|
CHEMBL4286319
|
[C][O][C][=Branch1][C][=O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][N][=C][Branch1][=C][N][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][N][=C][Ring1][#C][O][C][=C][Branch1][C][C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][=Branch2][C]
|
CHEMBL4286320
|
[O][C][=C][C][=C][Branch1][C][Cl][C][Branch2][Ring1][N][N][C][=N][C][=N][C][=C][Ring1][=Branch1][C][=N][N][Ring1][Branch1][C][C][Branch1][C][Cl][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][#Branch2]
|
CHEMBL4286321
|
[C][O][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=S][N][/N][=C][/C][=C][C][=C][Branch1][=Branch1][N][Branch1][C][C][C][C][=C][Ring1][=Branch2][C][=C][Ring2][Ring1][Branch1]
|
CHEMBL4286410
|
[C][O][C][C@@H1][Branch1][C][C][N][C@H1][C][C][C@H1][Branch2][Ring2][Ring2][N][C][=C][C][Branch2][Ring1][Ring2][C][=C][S][C][Branch1][O][N][C][C][C][C][O][C][C][Ring1][=Branch1][=N][Ring1][=N][=C][Branch1][C][Cl][C][=N][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][O]
|
CHEMBL4286411
|
[C][S][C][C][C@H1][Branch2][=Branch1][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][#C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][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][Branch1][Branch1][C][C][Se][C][N][C][Branch1][C][C][=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][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O]
|
CHEMBL4286412
|
[C][O][C][=C][C][Branch2][Ring1][=Branch2][O][C][C][C][C][Branch1][=C][O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][Ring1][#C][=C][C][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][=C][Ring2][Ring1][=N][C][C][N][C][Branch1][C][C][=O]
|
CHEMBL4286413
|
[C][=C][C][=Branch1][C][=O][O][C@@H1][C][C@@][Branch1][C][C][C][C][C][=Branch1][C][=O][C][=Branch1][C][=C][C@@H1][Ring1][=Branch2][C][C@H1][Ring1][P][Ring1][=N]
|
CHEMBL4286414
|
[C][O][C][=C][C][Branch2][Ring2][Ring1][/C][=C][\C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch1][#C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][O][=C][N][Ring1][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][N][O][C]
|
CHEMBL4286415
|
[C][C@H1][Branch2][Ring2][Ring1][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][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Branch1][C][C@][Branch1][C][O][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4286502
|
[O][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][O][C][C][Branch2][Ring1][=Branch2][C][=C][N][Branch1][S][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][N][=N][Ring1][=C][O][Ring2][Ring1][Ring1]
|
CHEMBL4286503
|
[C][O][C][=C][C][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][O][C][C][C][=C][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]
|
CHEMBL4286504
|
[C][C][N][C][Branch1][#C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][C][C][O][=C][C][=C][Ring1][#C][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][=C][C][=C][Branch2][Ring1][C][O][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][=C][Ring2][Ring1][C]
|
CHEMBL4286505
|
[C][C][Branch1][C][C][C][C][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][=Branch1][C][=O][C][N][Branch1][O][C][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][C][N][Branch2][#Branch2][N][C][=Branch1][C][=O][C][N][Branch1][Branch2][C][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][N][Branch1][O][C][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][C][N][Branch2][#Branch1][=Branch1][C][=Branch1][C][=O][C][N][Branch1][Branch2][C][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][N][Branch1][O][C][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C][N][Branch1][Branch2][C][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][N][C][C][C][C][N][C][=Branch1][C][=N][N][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]
|
CHEMBL4286506
|
[C][=C][C][C][C@H1][C@@][Branch1][C][C][Branch2][Ring1][Ring2][C][C][C@H1][O][C][Branch1][C][C][Branch1][C][C][O][C][C@@][Ring1][=N][Ring1][Branch2][C][C@@H1][Ring2][Ring1][C][C][C@H1][Branch1][=Branch2][S][C][=C][C][=C][S][Ring1][Branch1][C][=C][C][O][C][Ring1][Branch1][=O]
|
CHEMBL4286507
|
[O][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][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][Ring2][Ring1][=N]
|
CHEMBL4286508
|
[O][=C][Branch2][Ring1][Ring2][N][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=C][C][=C][Branch2][Ring1][Ring2][S][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=C][Ring1][P]
|
CHEMBL4286585
|
[C][C@H1][Branch2][Ring2][N][N][C][=C][C][Branch1][O][N][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][=N][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][#Branch2][=N][Ring2][Ring1][=Branch1][C][C][C][Ring1][Ring1]
|
CHEMBL4286586
|
[C][P][=Branch1][C][=O][Branch1][C][O-1][N][C@H1][C@H1][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Ring2][Ring1][Branch2][O].[Na+1]
|
CHEMBL4286587
|
[C][C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Branch1][Ring1][C][#N][=C][Branch1][C][N][O][Ring1][S]
|
CHEMBL4286588
|
[C][O][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C@][Branch1][C][C][C][C][C@][Branch1][C][C][C][=Branch2][Branch1][#Branch1][=C][C][=Branch1][C][=O][C@@H1][C@@][Branch1][C][C][C][C][=C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][C][N][C][C][Ring1][=Branch1][N][=C][Ring1][=C][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring2][Ring1][Branch1][C][C][C@][Ring2][Ring1][=Branch2][Ring2][Ring1][#C][C][C@H1][Ring2][Ring2][Branch1][C][Ring2][Ring2][#Branch2]
|
CHEMBL4286589
|
[N][C][=N][C][=C][C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][=C][Ring1][=N][S][Ring1][S]
|
CHEMBL4286667
|
[C][C][Branch1][Branch2][C][O][C][Branch1][C][C][C][N][C][=N][C][Branch1][O][N][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][=N][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][#Branch2][=N][Ring2][Ring1][=Branch1]
|
CHEMBL4286668
|
[N][=C][Branch1][C][N][N][C][C][C][C@H1][Branch2][Branch1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Ring2][C][C][N][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][C][N][C][=Branch1][C][=O][C][Branch1][C][N][C][C][C][C][N][=C][Branch1][C][N][N][C][=Branch1][C][=O][O]
|
CHEMBL4286669
|
[O][=C][C][=Branch1][C][=O][N][Branch2][Ring1][N][C][C][C][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][Ring1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][Ring2][Ring1][N]
|
CHEMBL4286670
|
[C][O][C][=Branch1][C][=O][/C][Branch1][Ring1][C][#N][=C][\S][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2]
|
CHEMBL4286671
|
[C][C][C@H1][O][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][Branch2][O][C][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=N][N][Branch1][C][C][C][=Ring1][#Branch1][Cl][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][C][C][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@][Ring2][Branch1][Ring1][Branch1][C][C][O]
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CHEMBL4286672
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[C][C][Branch1][C][C][C][N][C][=Branch1][C][=N][N][C][C][C@H1][Branch2][Branch1][#Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O]
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CHEMBL4286673
|
[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][#Branch1][Branch1][C][=Branch1][C][=O][O][C][C][C][N][C][=C][Branch2][=Branch1][C][C][O][C][=Branch1][C][=O][C@][C][C][C@@H1][Branch1][C][C][C@H1][Branch1][C][C][C@@H1][Ring1][Branch2][C][=C][C][C@H1][C@][Branch1][C][C][Branch2][Ring1][#Branch1][C][C][C@H1][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch1][C][O][C][C][C@@][Ring1][=Branch2][Ring1][=C][C][C@][Ring2][Ring1][Ring1][Branch1][C][C][C][C][Ring2][Ring1][=C][C][=N][Ring2][Ring2][#Branch1][C][C][C@H1][Ring2][=Branch1][=Branch2][C]
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CHEMBL4286674
|
[O][=C][Branch1][C][O][C][=C][C][=N][C][Branch2][Ring1][C][C][=C][N][Branch1][=Branch2][C][C][C][C][C][N][Ring1][Branch1][C][=N][Ring1][O][=C][Ring1][P]
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CHEMBL4286750
|
[O][=C][Branch1][=C][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][N][C][=N][C][=N][C][=C][Ring1][=Branch1][C][=N][N][Ring1][Branch1][C][C][N][C][C][C][C][C][Ring1][=Branch1]
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CHEMBL4286751
|
[O][=C][Branch1][C][O][C][C][C@H1][Branch2][Ring2][Ring2][N][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O]
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CHEMBL4286752
|
[C][N][C][=N][C][Branch2][Ring1][#Branch1][O][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][#Branch2][F][=N][C][Branch1][P][N][Branch1][C][C][C@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring2][Ring1][N]
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CHEMBL4286753
|
[C][C][C][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][Ring1][Branch2][O][C][=C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][C][Ring1][#Branch2][Branch1][C][C][C][C][Ring1][S][C][C][Branch1][C][C][C]
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CHEMBL4286754
|
[O][=C][NH1][C][Branch1][=C][S][C][C][=C][C][=C][C][Branch1][C][I][=C][Ring1][#Branch1][=N][C][=C][C][=C][C][=C][Ring2][Ring1][Ring1][Ring1][=Branch1]
|
CHEMBL4286755
|
[C][O][C][=C][C][=C][Branch2][Branch1][=C][C][=Branch1][C][=O][C][=C][N][Branch1][#Branch2][C][C][C][C][O][C][C][Ring1][=Branch1][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][C][=C][Ring2][Ring2][C][Ring2][Ring1][Branch2][C][=C][Ring2][Ring2][#Branch2]
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CHEMBL4286756
|
[C][C][N][C][Branch1][=C][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][Ring1][=C][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][=C][C][=C][Branch2][Ring1][C][O][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][=C][Ring2][Ring1][C]
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CHEMBL4286833
|
[O][=C][Branch1][C][O][C][=C][C][=C][Branch2][Branch1][C][N][C][C][Branch2][Ring2][=Branch1][C][C][N][Branch2][Ring1][O][C][C][=C][C][Branch1][C][Cl][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][Cl][=C][Ring1][=N][C][C][Ring2][Ring1][Ring2][O][C][Ring2][Ring1][Branch2][=O][C][=C][Ring2][Ring1][#C]
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CHEMBL4286834
|
[C][#C][C][N][C][=C][C][=C][C][=C][Branch1][=N][O][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C][C][=C][Ring1][=C][Ring1][P]
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CHEMBL4286835
|
[O][=C][C][C][C][=C][C][Branch2][Ring1][O][C][C][C][C][N][C][C][N][Branch1][=N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][C][C][Ring1][=C][=C][C][=C][Ring2][Ring1][Branch2][N][Ring2][Ring1][N][C][C][C][Ring1][=Branch1]
|
CHEMBL4286836
|
[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][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][=C]
|
CHEMBL4286907
|
[C][O][C][=C][C][=C][Branch2][Ring2][#C][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][/C][=C][/C][=C][C][Branch1][Ring1][O][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][=C][C][=C][C][=C][N][Ring2][Ring1][Branch2][Ring1][Branch1][C][=C][Ring2][Ring1][S]
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CHEMBL4286908
|
[C][O][C][C][C][O][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][C][=C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Ring1][#Branch2][C][Branch1][#Branch2][C][Branch1][C][C][Branch1][C][C][C][O][C][Ring2][Ring1][#Branch1]
|
CHEMBL4286909
|
[C][C][C][C][O][C][=C][C][=C][C][Branch1][=C][C][C][N][C][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][Ring1][#C].[Cl]
|
CHEMBL4286910
|
[F][C][=C][C][Branch2][Ring1][=N][/C][=C][/C][=C][C][=C][Branch1][P][N][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][C][Ring1][#Branch2][C][=C][Ring1][S][=C][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][=C]
|
CHEMBL4286911
|
[C][C][=Branch1][C][=O][O][C@H1][C@@H1][Branch1][C][O][C@H1][Branch2][Branch1][Branch2][O][C][=C][C][=C][C][Branch1][C][O][=C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][Branch1][C][O][C][Branch1][Branch2][C][C][=C][Branch1][C][C][C][=C][Ring1][=N][C][=Branch1][C][=O][O][C][Ring2][Ring1][Branch2][=C][Ring2][Ring1][N][C][O][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring2][Ring2][#Branch1][O]
|
CHEMBL4286912
|
[C][C][=N][N][Branch1][C][C][C][Branch2][Ring1][Branch1][O][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][=C][Ring2][Ring1][C][/C][=N][\O][C][C][=C][Branch1][C][Cl][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][N][Ring1][=N][C]
|
CHEMBL4286999
|
[N][#C][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O]
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CHEMBL4287000
|
[O][=C][C][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S]
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CHEMBL4287001
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch2][#Branch2][Branch2][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch2][#Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#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][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][Branch1][C][N][=O][C@@H1][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][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][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][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][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][Branch1][C][N][=O]
|
CHEMBL4287002
|
[C][O][C][=C][C][=C][C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][C][N][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=N][Ring1][N][O][C][Ring2][Ring2][Ring1][=Ring2][Ring1][#C]
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CHEMBL4287003
|
[C][C][O][C][=C][C][=C][Branch1][Ring2][O][C][C][C][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][N][C][=C][N][=C][Ring1][Branch1][=C][Ring2][Ring1][Branch1]
|
CHEMBL4287004
|
[C][O][C][C][N][C][C][C][Branch2][Ring2][C][O][C@@H1][C][C][N][Branch2][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][Ring1][P][C][C][Ring2][Ring1][Branch2]
|
CHEMBL4287005
|
[C][C][=Branch1][C][=O][O][C@H1][C][=Branch1][C][=O][C@][C][C@H1][Ring1][Ring1][C][C@H1][O][C][C@@][Ring1][Ring2][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Ring1][=N][C@H1][Branch2][Ring1][Branch2][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C@][Branch1][C][O][C][C@H1][Branch2][Ring2][Ring1][O][C][=Branch1][C][=O][C@H1][Branch1][C][O][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][=C][Ring2][Branch1][=Branch2][C][Ring2][Ring1][N][Branch1][C][C][C]
|
CHEMBL4287006
|
[O][=C][Branch1][N][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][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]
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CHEMBL4287082
|
[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]
|
CHEMBL4287083
|
[C][C][C][N][C][=C][Branch2][Ring1][#C][C][=C][S][C][Branch2][Ring1][Branch1][C][=C][N][=C][C][Branch1][O][N][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][=C][Ring1][N][=C][Ring1][P][C][=N][Ring2][Ring1][=Branch1]
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CHEMBL4287084
|
[O][=C][Branch1][C][O][C][C][=C][C][=C][O][C][Branch2][Branch1][Ring2][C][=C][C][=C][Branch2][Ring2][Branch2][N][C][=Branch1][C][=S][N][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=N][C][=C][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][=C][C][=C][Ring1][#Branch2][O][Ring1][=N][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][=N][=N][C][Ring2][Ring2][C][=C][Ring2][Ring2][=Branch1]
|
CHEMBL4287085
|
[C][C][=N][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][Branch1][C][C][=C][Ring1][#C][Cl]
|
CHEMBL4287086
|
[C][C][=C][C][=C][O][C][Branch2][=Branch1][C][C][=C][C][=C][Branch2][Branch1][=Branch1][O][C][C][C][C][C][=C][N][Branch2][Ring2][=Branch1][C][C][O][C][C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][C][C][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][O][C][=C][Ring1][P][N][=N][Ring2][Ring1][#C][C][=C][Ring2][Ring2][#Branch2][=C][C][=Branch1][C][=O][C][Ring2][Ring2][P][=C][Ring2][Branch1][Branch1]
|
CHEMBL4287087
|
[C][O][C][=C][C][=C][Branch2][Ring2][#Branch1][N][C][=N][C][Branch2][Ring1][O][C][C][Branch1][C][C][N][C][C][C][Branch1][C][C][Branch1][C][C][N][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch2][=N][S][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][#Branch2]
|
CHEMBL4287173
|
[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][N][C][C][N][Branch1][=Branch2][C][=C][N][=C][C][=N][Ring1][=Branch1][C][C][Ring1][N]
|
CHEMBL4287174
|
[C][O][C][=C][C][=N][C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][=N][C][Branch2][Ring1][Branch2][N][C][C][C][N][Branch1][=N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][=C][=C][Ring2][Ring1][O][C][=C][Ring2][Ring1][#C][O][C]
|
CHEMBL4287175
|
[C][C][C][=C][Branch1][C][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1][O][Ring1][=C][N][=Ring2][Ring1][=Branch1]
|
CHEMBL4287176
|
[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][S][N][C][=C][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][Branch1][Branch2][C][=Branch1][C][=O][O][C][C][C][=C][Ring1][O][=N][C][=N][Ring2][Ring1][C][C][=C][Ring2][Ring1][=Branch2]
|
CHEMBL4287254
|
[C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=N][C][Branch1][Ring1][S][C][=N][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch1][O][C]
|
CHEMBL4287255
|
[C][#C][C][N][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][#N][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]
|
CHEMBL4287256
|
[O][=C][Branch2][Ring1][=C][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][=C][C][=N][O][N][=C][Ring1][Branch1][O]
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CHEMBL4287257
|
[C][O][C][=C][C][=C][Branch2][Ring2][Ring2][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][=C][Ring1][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][#Branch2]
|
CHEMBL4287337
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][N][/C][=C][\C][C][C][/C][=Branch1][S][=C][\C][=C][C][=C][Branch1][C][O][C][Branch1][C][Cl][=C][Ring1][Branch2][C][Ring1][#C][=O][=C][Ring2][Ring1][#Branch1][O][C]
|
CHEMBL4287338
|
[F][C][Branch1][C][F][Branch1][C][F][C][NH1][N][=N][C][=Ring1][Branch1][C][=C][C][=N][C][Branch2][Ring1][Ring2][C][=C][N][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=N][Ring1][=N][=C][Ring2][Ring1][Ring1]
|
CHEMBL4287339
|
[C][N][Branch2][Ring1][C][C][C][N][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][C][N][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2]
|
CHEMBL4287340
|
[C][C][N][C][C][N][Branch2][Ring2][Ring1][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1][=O][C][C][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][#Branch2]
|
CHEMBL4287418
|
[O][=C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][/C][Ring1][=Branch2][=N+1][Branch1][C][\O-1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4287419
|
[C][O][C][=C][C][=C][C][Branch2][#Branch1][=Branch1][C][O][C][=C][Branch2][Branch1][P][C][=C][C][=C][Branch2][Branch1][Branch1][O][C][C][O][C][C][N][C][=C][Branch2][Ring2][Ring2][C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][Ring1][/C][=C][/C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][C][=C][Ring2][Ring1][C][N][=N][Ring2][Ring1][N][C][=C][Ring2][Ring2][Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Branch1][C][=O][=C][Ring2][Branch1][O]
|
CHEMBL4287420
|
[O][=C][Branch1][N][N][C][C][C][=C][C][=C][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]
|
CHEMBL4287421
|
[C][N][Branch1][C][C][C][C@@H1][C][=Branch1][C][=O][O][C@@H1][C][C@@][Branch1][C][C][C][C][C@@H1][Branch1][C][O][C@][Branch1][Branch1][C][O][Ring1][Ring1][C@@H1][Ring1][#Branch2][C][C@@H1][Ring1][=C][Ring2][Ring1][C].[O][=C][Branch1][C][O][/C][=C][/C][=Branch1][C][=O][O]
|
CHEMBL4287422
|
[C][C][=C][C][Branch2][Ring2][N][N][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=C][C][Branch1][S][N][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][Ring1][=Branch2][=C][C][=C][Ring2][Ring1][=Branch2][Ring1][#C][=N][NH1][Ring2][Ring1][#C]
|
CHEMBL4287506
|
[C][C][Branch1][C][C][C][O][C][=C][C][=C][Branch2][Ring2][=Branch2][C][=C][N][Branch1][C][C][C][=C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1][=C][Branch1][C][F][C][=C][Ring2][Ring1][Ring2][Ring1][S][C][=N][Ring2][Ring1][#Branch2]
|
CHEMBL4287507
|
[O][=C][Branch1][C][O][C][=C][S][C][Branch1][C][Cl][=C][Ring1][=Branch1]
|
CHEMBL4287508
|
[O][C][=C][C][=C][Branch2][Ring2][Branch1][O][C][=Branch1][C][=S][N][C][=C][C][=C][Branch2][Ring1][Ring2][S][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][=C][Ring1][P][C][=C][Ring2][Ring1][O]
|
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