chembl_id
stringlengths 7
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stringlengths 3
6.7k
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CHEMBL4286356
|
[C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][O][C][C][C][O][P][=Branch1][C][=O][Branch1][C][O-1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][O].[Na+1]
|
CHEMBL4286357
|
[O][=C][O][C][Branch1][Ring1][C][O][Branch1][Ring1][C][O][C][Branch1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][=C][Ring1][S][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl]
|
CHEMBL4286444
|
[C][C][=C][C][=Branch1][C][=O][C][Branch1][C][O][=C][Branch2][Ring2][Branch2][C][Branch2][Ring1][Branch1][C][=C][C][=C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][C][O][C][Branch1][C][C][=C][C][=Branch1][C][=O][C][=Ring1][Branch2][O][O][Ring2][Ring1][S]
|
CHEMBL4286445
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][=Branch2][C][C][=C][C][=C][O][Ring1][Branch1][C][C][Branch1][C][O][C][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][Ring1][#C]
|
CHEMBL4286446
|
[N][#C][C][=C][C][=C][Branch2][Ring1][P][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][O][C][C][Ring1][=Branch1][C][=C][Ring2][Ring1][N]
|
CHEMBL4286447
|
[C][N][Branch2][Branch1][O][C][C][=C][C][=N][C][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][=C][Branch2][Ring1][O][C][N][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][#C][N][Ring2][Ring1][=N][C][=Ring2][Ring1][P][S][Branch1][C][C][=Branch1][C][=O][=O]
|
CHEMBL4286539
|
[O][=C][Branch1][C][O][C][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][N][=C][/C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F][S][C][Ring2][Ring1][=Branch2][=S]
|
CHEMBL4286540
|
[C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][S][S][C][=Branch1][C][=S][N][C][C][/C][=C][/S+1][Branch1][C][C][O-1][C][=C][Ring1][P]
|
CHEMBL4286541
|
[C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@@H1][O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][N][C][Branch1][C][C][=O]
|
CHEMBL4286542
|
[O][=C][Branch2][Ring1][S][C][C][C][C][C][=C][N][Branch2][Ring1][C][C][=C][C][=N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][O][Ring1][#Branch1][N][=N][Ring1][S][N][C][C][N][Branch2][Ring1][#Branch1][C][=C][C][=Branch1][N][=N][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][C][C][C][Ring1][=N][C][C][Ring2][Ring1][Ring2]
|
CHEMBL4286543
|
[C][=C][C][C][C@H1][C@@][Branch1][C][C][Branch1][#C][C][C][C@@H1][Branch1][C][O][C@@][Ring1][Branch2][Branch1][C][C][C][O][C@@H1][Ring1][#C][C][/C][=C][/C][=Branch1][C][=O][O][C][C@H1][Ring1][=Branch1][O][C][=Branch1][C][=O][C][C][C][S][C][=C][C][=C][C][=N][Ring1][=Branch1]
|
CHEMBL4286615
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][Branch2][=Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][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][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch2][O][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@H1][Branch2][Branch1][=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][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][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][C][C][N][C][Branch1][C][C][C][C@@H1][Branch1][C][C][O][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][S][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][=Branch1][#C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][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][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C@@H1][Branch1][C][C][O]
|
CHEMBL4286616
|
[C][O][C][=C][C][Branch1][C][Br][=C][C][Branch1][#C][/C][=C][/C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][P][O]
|
CHEMBL4286617
|
[C][C][=C][C][Branch1][C][C][=C][Branch1][C][C][C][Branch2][Ring1][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][C][=Branch1][C][=O][O][=C][Ring2][Ring1][Ring1][C]
|
CHEMBL4286618
|
[O][=C][S][/C][=Branch2][Ring1][Branch2][=C][\C][=C][C][=C][Branch1][=N][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][Ring1][=C][C][=Branch1][C][=O][N][Ring2][Ring1][Branch1][C][=C][C][=C][Branch2][Ring1][Branch1][O][C][C][C][N][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][C][Ring1][#Branch2][C][=C][Ring2][Ring1][Ring2]
|
CHEMBL4286619
|
[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][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Ring2][Branch1][#C][C]
|
CHEMBL4286620
|
[C][C][=C][C][=C][Branch1][C][C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][N][C][=C][C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][=C][C][=C][Ring1][#Branch2][O][=C][Ring2][Ring1][=Branch1]
|
CHEMBL4286705
|
[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][Cl][=C][Ring1][Branch2]
|
CHEMBL4286706
|
[O][=C][Branch2][Ring1][=Branch1][N][/N][=C][/C@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][Branch1][C][O][C][O][C][=C][C][=C][S][Ring1][Branch1]
|
CHEMBL4286707
|
[C][O][C][=C][Branch1][C][Br][C][=C][Branch1][C][Br][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4286708
|
[C][O][C][=C][C][=C][Branch2][Ring2][C][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring2][Ring1][O][O][C]
|
CHEMBL4286709
|
[N][C][=C][C][=C][NH1][C][Ring1][=Branch1][=O]
|
CHEMBL4286710
|
[C][C][=C][N][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][C][=C][Ring1][#Branch2][Se][Ring1][#C]
|
CHEMBL4286785
|
[C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][Branch2][Ring1][#Branch1][O][C][C][C][C][Branch1][N][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][C][Ring1][#C][C][=C][Ring2][Ring1][=Branch1][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
CHEMBL4286786
|
[C][C][C][=N][C][=C][N][Ring1][Branch1][C][C@@][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][O][C][C@@H1][Branch2][Branch1][Branch1][C][O][C][=C][C][=C][Branch2][Ring2][#Branch1][N][C][C][N][Branch2][Ring1][O][C][=C][C][=C][Branch1][P][N][C][=N][N][Branch1][#Branch1][C][Branch1][C][C][C][C][C][Ring1][=Branch2][=O][C][=C][Ring1][S][C][C][Ring2][Ring1][=Branch1][C][=C][Ring2][Ring1][N][O][Ring2][Ring2][O]
|
CHEMBL4286787
|
[N][C][=N][NH1][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][O][C][=N][C][=C][Branch1][=C][C][=N][N][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][NH1][Ring1][S]
|
CHEMBL4286788
|
[C][C][Branch1][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][#Branch2][C@H1][Branch1][C][O][C][Branch1][C][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][=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][Ring2][#Branch1][=Branch1][=O]
|
CHEMBL4286789
|
[C][S+1][Branch1][C][O-1][C][C][C][C][N][C][=Branch1][C][=S][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4286790
|
[Cl][C][=C][C][=C][Branch2][Ring1][#C][C][O][C][=C][N][=C][C][Branch2][Ring1][C][C][C][=N][N][Branch1][=Branch2][C][C][C][N][C][C][Ring1][=Branch1][C][=Ring1][O][=C][Ring1][P][C][Branch1][C][Cl][=C][Ring2][Ring1][#Branch2]
|
CHEMBL4286856
|
[N][C][=N][C][=N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring2][Ring1][C][=C][C][=C][Branch2][Ring1][#Branch1][C@H1][C][C][C@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=C][C][=C][Ring2][Ring1][Ring2][C][C][O][Ring2][Ring1][N]
|
CHEMBL4286857
|
[C][C][=C][C][=Branch1][C][=O][NH1][C][=Branch1][C][=O][N][Ring1][Branch2][/C][=Branch1][Ring1][=N][\O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4286858
|
[C][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=C][C][Branch1][C][N][=N][N][Ring1][=Branch1][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2][C][=C][Ring2][Ring1][Branch1]
|
CHEMBL4286859
|
[C][C][O][C][=Branch1][C][=O][C][N+1][=C][C][=C][C][=C][C][Branch2][Ring2][S][O][P][=Branch1][C][=O][Branch1][C][O-1][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][F][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][=C][Ring2][Ring2][Ring1][Ring2][Ring2][#Branch1]
|
CHEMBL4286860
|
[C][C][C@H1][O][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch2][Ring2][#C][O][C@H1][C][C@@][Branch1][C][C][Branch1][Ring1][O][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][O][Ring2][Ring1][=Branch2][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][=C][Branch1][C][C][O]
|
CHEMBL4286861
|
[C][C][C][Branch1][Ring1][C][C][O][C@@H1][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Branch1][C][N][C@H1][Ring2][Ring1][Ring2][N][C][Branch1][C][C][=O]
|
CHEMBL4286862
|
[C][C][N][Branch1][C][C][C][=N][C][O][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][C][C][=Ring1][S][C][=C][Ring2][Ring1][Ring2][C][=C][C][=C][C][Branch1][=C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][=N]
|
CHEMBL4286941
|
[C][O][C][=C][C][=C][Branch2][Ring2][O][N][C][Branch2][Ring1][#C][C][=Branch1][C][=O][C][S][C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][N][=C][Ring2][Ring1][=Branch2][N][C][=C][Ring2][Ring1][S]
|
CHEMBL4286942
|
[C][C][C][C][S][C][=C][C][=C][N][=C][Branch1][=Branch2][N][C][=Branch1][C][=O][O][C][C][S][C][Ring1][O][=C][Ring1][#C]
|
CHEMBL4286943
|
[C][O][C][=C][C][Branch2][Ring1][#Branch1][C][N][=C][S][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][N][Ring1][O][N][=Ring1][=C][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][=Branch1][O][C]
|
CHEMBL4286944
|
[C][C][=C][S][C][Branch2][Ring1][O][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][N][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][=C][Ring1][#C][=N][Ring2][Ring1][#Branch1]
|
CHEMBL4287030
|
[C][O][C][=N][C][Branch1][N][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][=C][C][=C][Ring1][=N][N][C][=N][C][=C][Branch1][C][Cl][C][Branch1][S][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][Branch1][C][C][=O][=N][Ring2][Ring1][C]
|
CHEMBL4287031
|
[C][C][=C][C][=C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=S][N][/N][=C][/C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][C][=C][Ring2][Ring1][Ring2]
|
CHEMBL4287032
|
[C][N][Branch1][=N][C][/C][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1].[Cl]
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CHEMBL4287033
|
[C][/C][=Branch1][S][=N][\N][C][=Branch1][C][=S][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O]
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CHEMBL4287115
|
[N][C][=C][Branch1][P][C][=N][C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][=N][O][Ring1][#Branch2][N][=N][N][Ring1][#C][C][=C][C][=C][C][Branch1][Ring1][C][O][=C][Ring1][Branch2]
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CHEMBL4287116
|
[C][=C][C][=Branch1][C][=O][C@@][C@@H1][Branch1][=N][C@@H1][Branch1][C][O][C][C@@H1][Ring1][=Branch2][C@H1][Ring1][#Branch1][O][C@][C][C][C][C][Branch1][C][C][Branch1][C][C][C@H1][Ring1][Branch2][C][C@H1][Ring2][Ring1][C][O][C@@H1][Ring1][N][O][C][C][C][N][C][=C][Branch1][=N][C][N][C][=Branch1][C][=O][C][S][C][Ring1][=Branch1][=O][N][=N][Ring1][=N]
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CHEMBL4287117
|
[O][=C][Branch1][C][O][C@H1][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][Ring2][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1]
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CHEMBL4287118
|
[C][C@@H1][C][N][Branch2][Ring1][=Branch1][C][C][C][C][C@H1][C][N][C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][Branch1][=N][Ring1][O][C][=Branch1][C][=S][N][Ring2][Ring1][Branch1][C][C][C][C][C][C][C][C][C][Ring1][=Branch1]
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CHEMBL4287201
|
[C][C][=C][C][=C][Branch2][Ring1][N][O][C][C][=Branch1][C][=O][N][C][=N][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][S][Ring1][N][C][=C][Ring2][Ring1][#Branch1]
|
CHEMBL4287202
|
[C][C][O][C][=Branch1][C][=O][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][Ring1][C][#N][=C][Branch1][C][N][O][C][=C][Ring1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4287203
|
[C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C@H1][Branch1][=N][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@@H1][Ring2][Ring1][C][O]
|
CHEMBL4287204
|
[C][N][Branch2][Ring1][O][C][C][C][C][=N][N][Branch1][S][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2][C][=Ring1][=C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
CHEMBL4287286
|
[C][C][C][Branch1][Ring1][C][C][O][C@@H1][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C@H1][Branch1][Branch2][N][C][=Branch1][C][=O][C][F][C@H1][Ring1][=C][N][C][Branch1][C][C][=O]
|
CHEMBL4287287
|
[O][C][C][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][Ring1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][C][=Ring2][Ring1][Ring2][C][Branch1][=C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][=N][Ring2][Ring1][P]
|
CHEMBL4287288
|
[C][C][=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]
|
CHEMBL4287289
|
[C][O][C][=C][C][Branch1][Ring1][O][C][=C][S][C][Branch2][Ring2][=Branch1][C][=C][C][=C][Branch2][Ring1][#Branch1][N][/C][=C][\C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][C][F][=C][Ring1][=Branch2][C][Branch1][C][C][=C][Ring2][Ring1][Branch1][=N][C][Ring2][Ring1][#Branch2][=C][Ring2][Ring1][S]
|
CHEMBL4287290
|
[N][#C][C][=N][C][=C][C][C][Branch1][S][N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][Branch1][C][N][O][C][Ring2][Ring1][Ring1][=Ring1][#C]
|
CHEMBL4287364
|
[C][O][C][=C][C][=C][Branch2][Ring2][Ring2][C][C][Branch2][Ring1][Branch1][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][=N][N][Branch1][C][C][C][=Ring2][Ring1][C][N][C][=C][Ring2][Ring1][=Branch2][F]
|
CHEMBL4287365
|
[C][C][=C][O][C][=C][C][=C][C][=C][Branch2][Ring2][#Branch1][C][Ring1][=Branch1][=C][NH1][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][=N][C][Ring1][#C][=C][Ring2][Ring1][#Branch2][Ring2][Ring1][#Branch1][C][C][C][C][Ring2][Ring1][#Branch1][Branch1][C][C][C]
|
CHEMBL4287366
|
[O][=C][C][=C][C][=C][C][=C][Branch2][Ring1][Branch1][O][C][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch1][O][Ring2][Ring1][#Branch2]
|
CHEMBL4287367
|
[F][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=C][C][=C][NH1][C][=C][Branch2][Ring1][Ring2][C][=C][N][=C][C][Branch1][#Branch2][O][C@@H1][C][C][C][N][C][Ring1][=Branch1][=N][Ring1][=N][C][Ring2][Ring1][C][=C][Ring2][Ring1][=Branch1]
|
CHEMBL4287454
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][=C][C][Branch2][Ring1][=Branch2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][NH1][C][=Branch1][C][=O][O][C][Ring1][=Branch1][=C][Ring1][#Branch2][=C][C][=C][Ring2][Ring1][Ring2][Ring2][Ring1][#Branch1]
|
CHEMBL4287455
|
[C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][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][S]
|
CHEMBL4287456
|
[C][N][C][=Branch1][C][=O][N][C][S][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Branch1][=C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][C][C][C][=C][Ring1][S][C][=Ring2][Ring1][Ring1][C][Branch1][C][N][=O]
|
CHEMBL4287457
|
[C][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][=C][N][=C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring1][=N][C][Branch1][C][C][C]
|
CHEMBL4287531
|
[O][=C][Branch2][Ring2][=Branch1][/C][=C][/C][=C][C][=C][Branch1][N][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][Ring2][Ring1][Ring2][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2]
|
CHEMBL4287532
|
[C][#C][C@@][Branch1][C][O][C@@H1][Branch1][Ring1][C][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=C][Branch1][C][Br][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring1][O][C@@H1][Ring2][Ring1][Ring1][O]
|
CHEMBL4287533
|
[C][O][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][C@][Branch1][C][C][C@@H1][Ring1][Branch2][C][C][C@][C][C@][Branch1][C][C][Branch1][Branch2][C][C][C@@H1][Ring1][N][Ring1][#Branch1][C@@][Branch1][C][O][Branch2][Ring1][Branch1][C][=C][N][Branch1][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][=C][C][Ring2][Ring1][Branch2]
|
CHEMBL4287534
|
[C][O][C][=C][C][=C][NH1][C][=C][Branch2][Ring2][S][C][Branch2][Ring1][C][C][=C][NH1][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][O][Ring1][Branch2][P][=Branch1][C][=O][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring2][Ring1][=C][Ring2][Ring2][#Branch1]
|
CHEMBL4287535
|
[C][C][Branch1][C][C][O][C@@H1][C@H1][Branch1][Ring2][O][Ring1][=Branch1][C@H1][O][C][Branch1][C][C][Branch1][C][C][O][C@H1][Ring1][#Branch1][O][C@@H1][Ring1][N][C][N][C][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][=O]
|
CHEMBL4287536
|
[C][O][C][=C][C][=N][C][Branch1][#C][N][C][C][Branch1][C][C][C][C][Branch1][C][C][C][Ring1][Branch2][=N][C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][Branch1][C][=C][Ring2][Ring1][=Branch2][O][C]
|
CHEMBL4287537
|
[C][C][Branch1][C][C][=C][C][C][=C][O][C@H1][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][O][C][C][C@][Branch1][C][C][C@@H1][Branch1][Branch2][C][C][=C][Branch1][C][C][C][C][C@][Branch1][C][C][Branch1][=Branch1][C][Ring2][Ring1][=Branch1][=O][C][=Branch1][C][=O][C@][Ring2][Ring1][=Branch2][Ring1][S][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4287627
|
[C][C][C][C][C][C][C][C][C][=C][N][Branch1][#C][C][/C][=C][Branch1][C][\C][C][C][C][=C][Branch1][C][C][C][N][=N][Ring1][#C]
|
CHEMBL4287628
|
[C][O][C][=Branch1][C][=O][/C][=C][\C][=Branch1][C][=O][C][=C][C][C][C][C][C][Branch1][=C][C][C][C][Ring1][=Branch1][Branch1][C][C][N][Ring1][O][Ring1][#C][C][Ring1][O][Branch1][C][C][N][C][Branch1][C][C][=O]
|
CHEMBL4287629
|
[O][=C][Branch1][C][O][C][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][=N][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=N][C][=N][Ring1][=C]
|
CHEMBL4287630
|
[C][O][C][=N][C][Branch2][Ring2][C][N][C][=N][C][Branch1][C][N][=N][C][=C][Ring1][#Branch1][C][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][=N][C][Branch1][#C][O][C][=Branch1][C][=O][C][Branch1][C][N][C][Branch1][C][C][C][=N][Ring2][Ring2][Ring1]
|
CHEMBL4287631
|
[C][C][=N][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring2][#Branch2][C][=C][N][Branch1][C][C][C][=N][C][=C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][C][Branch1][C][C][=C][Ring2][Ring1][=Branch1][Ring2][Ring1][C][C][C][Ring2][Ring1][N]
|
CHEMBL4287632
|
[C][C][C][O][C][=C][C][=C][Branch2][Ring1][P][C][=C][C][Branch2][Ring1][=Branch1][C][O][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][Ring1][#Branch2][F][=N][O][Ring2][Ring1][C][C][=C][Ring2][Ring1][Branch2]
|
CHEMBL4287633
|
[N][C][C@H1][O][C@H1][Branch2][Ring2][#Branch2][O][C@@H1][C@@H1][Branch1][C][O][C@H1][Branch1][C][N][C][C@H1][Branch1][C][N][C@H1][Ring1][=Branch2][O][C@H1][O][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][O][N][C@H1][Branch1][C][O][C@@H1][Ring2][Ring1][=N][O].[O][=S][=Branch1][C][=O][Branch1][C][O][O]
|
CHEMBL4287716
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][Branch1][N][C][=C][Branch1][P][/C][=C][/C][=Branch1][C][=O][N][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=N][Ring2][Ring1][#Branch1][C][=C][Ring2][Ring1][=N]
|
CHEMBL4287717
|
[C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=Branch1][=C][=C][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][Ring2][Ring1][C]
|
CHEMBL4287718
|
[C][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][C][=Branch1][C][=O][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][Branch1]
|
CHEMBL4287719
|
[C][C][C][C][C][C][O][C][C][=C][N][Branch2][N][#C][C@H1][C][=Branch1][C][=O][N][C@@H1][C][C][=C][C][=C][Branch1][Branch2][C][Branch1][C][Cl][=C][Ring1][#Branch1][O][C][=C][C][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][O][O][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][Cl][C@@H1][Branch2][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][N][C][Branch1][C][C][=O][C@H1][N][C][=Branch1][C][=O][C@H1][Branch2][Branch1][C][N][C][Branch1][C][O][C@@H1][Ring2][Ring2][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][N][C][Ring2][Branch1][Branch2][=O][C][=C][C][Branch1][C][O][=C][C][=Branch1][Ring2][=C][Ring1][#Branch1][O][C][=C][C][Ring2][=Branch1][Branch2][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][Ring1][Branch2][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][Ring2][Branch1][Ring2][=O][N][=N][Ring2][Branch2][#Branch1]
|
CHEMBL4287720
|
[O][=C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2][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]
|
CHEMBL4287721
|
[C][C@H1][Branch2][Branch1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][Branch2][Ring2][C][C][N][C][=N][C][=C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][C][O][C][=C][Ring1][Branch2][N][Branch1][C][C][N][=C][Ring1][=C][C][Ring2][Ring1][C][=O][C][C][Ring2][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4287722
|
[O][=C][Branch1][C][O][C][C][C][C][Branch1][C][O][C][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][Branch1][Ring2][C][Ring1][O][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][Branch1][Ring2][C][Ring1][#C][C][Ring2][Ring1][C]
|
CHEMBL4287723
|
[C][O][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch2][#Branch1][Ring1][O][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C@][Branch1][C][C][C][C][C@][Branch1][C][C][C][=Branch2][Branch1][C][=C][C][=Branch1][C][=O][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch1][=C][O][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][Se][C][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring2][Ring1][C][C][C][C@][Ring2][Ring1][=Branch1][Ring2][Ring1][N][C][C@H1][Ring2][Ring2][C][C][Ring2][Ring2][#Branch1][C][Branch1][Ring1][O][C][=C][Ring2][Branch1][C].[Cl]
|
CHEMBL4287724
|
[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][C][=C][C][=C][Ring1][=Branch1][=N][O][Ring2][Ring2][#Branch2]
|
CHEMBL4287804
|
[C][C][N][Branch1][Ring1][C][C][C][=C][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=N][N][Ring1][Branch2][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][Ring2][Ring1][=Branch2][=C][Ring2][Ring1][=N]
|
CHEMBL4287805
|
[C][C@][C][C][C@H1][Branch2][Ring1][Branch1][O][C][O][C@H1][Branch1][Ring1][C][O][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][C][C@H1][Ring2][Ring1][C][C][C][C@@H1][C@@H1][Ring2][Ring1][=Branch1][C][C@@H1][Branch1][C][O][C@][Branch1][C][C][C@@H1][Branch1][O][C][=C][C][=Branch1][C][=O][O][C][Ring1][=Branch1][C][C][C@][Ring1][P][Ring1][N][O]
|
CHEMBL4287806
|
[C][C][=C][C][=C][C][N][=C][Branch1][#C][N][/N][=C][\C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][S][C][Ring2][Ring1][Ring1][=Ring1][#C]
|
CHEMBL4287807
|
[C][O][C][=C][C][=C][Branch2][Ring2][P][C][=Branch1][C][=O][/C][=C][/C][C][=C][Branch1][P][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][N][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][O][N][=Ring2][Ring1][=Branch2][C][=C][Ring2][Ring2][Ring1][O][C]
|
CHEMBL4287808
|
[C][N][Branch1][C][C][C][C][#C][C][=C][C][=N][C][=N][C][Branch2][Ring1][N][N][C][=C][C][=C][Branch1][=C][O][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][Branch1][C][Cl][=C][Ring1][S][=C][Ring2][Ring1][#Branch1][S][Ring2][Ring1][#Branch2]
|
CHEMBL4287884
|
[C][C][C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][=N][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][S][Ring1][=C][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][=Branch2]
|
CHEMBL4287885
|
[C][C][C][C][Branch1][C][O][C][O][C][Branch1][C][C][=C][C][=Branch1][C][=O][C][=Ring1][Branch2][O]
|
CHEMBL4287886
|
[C][=C][C][C][=C][C][=C][Branch1][C][O][C][Branch2][Ring1][C][C][=C][C][Branch1][#Branch1][C][C][C][O][Ring1][Ring1][=C][C][=C][Ring1][#Branch2][O][=C][Ring2][Ring1][C]
|
CHEMBL4287887
|
[C][C][=C][C][=C][Branch2][Ring2][Branch1][C][O][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][O][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][=C][Ring2][Ring1][N]
|
CHEMBL4287968
|
[C][O][C][=C][C][=C][Branch2][Ring2][Branch2][C][Branch1][S][C][=N][N][=N][N][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][N][C][C][C][=C][Branch1][N][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][Ring1][=N][C][=C][Ring2][Ring1][=N]
|
CHEMBL4287969
|
[C][O][C][=C][C][=C][Branch1][#C][C][=C][Ring1][=Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Branch1][C][C][N][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=Branch1][C][=O][C][=C][Ring1][#Branch2][Ring2][Ring1][=Branch2]
|
CHEMBL4287970
|
[C][O][C][=C][C][O][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][C][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][=C][C][=Branch1][C][=O][C][=Ring2][Ring1][=Branch2][C][=C][Ring2][Ring1][=N][O][C]
|
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