chembl_id
stringlengths 7
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CHEMBL1187512
|
[C][C][C][=C][C@@H1][C][C@][Branch1][#Branch1][C][=Branch1][C][=O][O][C][Branch2][Branch1][=C][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][N][Branch1][C][C][C@H1][C@@][Branch1][C][O][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@][Branch1][Ring1][C][C][C][=C][C][N][C][C][C@][Ring2][Ring1][=C][Ring2][Ring1][=Branch1][C@@H1][Ring1][Branch1][Ring1][O][C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][N+1][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C@@H1][Branch1][C][C][C][C][Branch1][Branch1][C][Ring2][=Branch1][=Branch2][C][Ring2][=Branch1][Branch2]
|
CHEMBL1094689
|
[C][/C][=C][Branch1][C][/C][C][=Branch1][C][=O][O][C@H1][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@@][Branch1][Ring1][C][O][C@@H1][Branch1][=Branch2][C][C][Ring1][N][Branch1][C][C][C][C][=C][C][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch2][Branch1][O][O][C@@H1][O][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C@@H1][Branch1][C][O][C@H1][Branch1][P][O][C@@H1][O][C@@H1][Branch1][Ring1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][Branch2][O][C@H1][Ring2][Ring1][Ring2][O][C@@H1][O][C@H1][Branch1][Ring1][C][O][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring2][Ring2][#Branch2][C][C][C@@][Ring2][Ring2][=C][Branch1][C][C][C@][Ring2][Branch1][Ring1][Branch1][C][C][C][C@H1][Ring2][Branch1][=C][O]
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CHEMBL4116154
|
[F][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][C][C][C][C][C][Ring1][=Branch1]
|
CHEMBL1207685
|
[C][C][Branch1][C][C][S][C@@H1][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][S][C@H1][Ring2][Ring1][Ring2][C][=Branch1][C][=O][O].[C][C][O][C][=Branch1][C][=O][C][=C][N][N][N][Ring1][Branch1][C][C@@][Branch1][C][C][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][C][C][Ring1][Branch1][S][Ring1][N][=Branch1][C][=O][=O]
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CHEMBL1172581
|
[C][O][C@H1][C@@H1][Branch2][Branch1][=Branch1][O][C@H1][C][C][C@][Branch1][Ring1][C][=O][C@H1][C][C][C@][Branch1][C][C][C@@H1][Branch1][O][C][=C][C][=Branch1][C][=O][O][C][Ring1][=Branch1][C][C][C@][Ring1][N][Branch1][C][O][C@@H1][Ring1][P][C][C][C@][Ring2][Ring1][#Branch1][Branch1][C][O][C][Ring2][Ring1][N][O][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@H1][Ring2][Ring2][Branch1][O]
|
CHEMBL1093000
|
[C][C][=C][N][Branch3][Ring2][Ring1][Ring1][C@@H1][O][C@][Branch3][Ring1][#C][Branch2][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@@H1][C@@H1][Branch3][Ring1][=N][Ring1][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@@H1][C@@H1][Branch3][Ring1][#Branch2][=Branch1][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@@H1][C@@H1][Branch3][Ring1][#Branch1][=Branch2][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@H1][C][C@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][O][C@@H1][Ring1][=C][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@@H1][C@@H1][Branch3][Ring1][Ring1][C][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@@H1][C@@H1][Branch2][S][#Branch2][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@@H1][C@@H1][Branch2][=C][=Branch1][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@@H1][C@@H1][Branch2][O][#Branch2][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@@H1][C@@H1][Branch2][=Branch2][C][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@H1][C][C@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][O][C@@H1][Ring1][=C][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@H1][C][C][C@@][Ring1][Ring2][Branch2][Ring2][=Branch2][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C@H1][C@H1][O][C][C@@][Ring1][Branch1][Branch1][Ring1][C][O][O][C@H1][Ring1][Branch2][N][C][=C][Branch1][C][C][C][Branch1][C][N][=N][C][Ring1][Branch2][=O][O][C@H1][Ring2][Ring1][=N][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][O][C@@H1][Branch1][P][N][C][=N][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring1][#Branch2][C@@H1][Ring2][=Branch1][S][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@@H1][Ring2][Branch2][#Branch1][O][O][C@@H1][Branch1][=N][N][C][=C][C][Branch1][C][N][=N][C][Ring1][#Branch1][=O][C@@H1][Ring2][=Branch2][O][O][O][C@@H1][Branch1][P][N][C][=N][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring1][#Branch2][C@@H1][Ring2][#Branch2][P][O][O][C@@H1][Branch1][=N][N][C][=C][C][Branch1][C][N][=N][C][Ring1][#Branch1][=O][C@@H1][Ring2][N][Branch1][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@@H1][Ring2][=C][S][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@@H1][Ring2][S][#Branch1][O][O][C@@H1][Branch1][=N][N][C][=C][C][Branch1][C][N][=N][C][Ring1][#Branch1][=O][C@@H1][Ring2][P][O][O][C][O][C@@H1][Ring3][Ring1][C][Branch2][C@@H1][Ring3][Ring1][C][#Branch1][O][P][Branch1][C][O][=Branch1][C][=S][O][C][C@@][C][C][Branch1][Branch1][C@@H1][Ring1][Ring2][O][C@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][O][Ring1][S][C][=Branch1][C][=O][N][=C][Ring3][Ring1][Ring2][=Branch1][N]
|
CHEMBL1097916
|
[C][O][C][C@H1][Branch1][C][O][C@@H1][O][C@@H1][Branch2][=Branch1][=C][O][C@H1][C@H1][Branch1][Branch2][C@@H1][Branch1][C][O][C][O][C][O][C@@H1][Branch2][Branch1][Branch2][O][C@@H1][C][C][=C][C@@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@H1][C][C@H1][Branch1][C][O][C][C][C@][Ring1][#Branch1][Branch1][C][C][C@H1][Ring1][=C][C][C][C@][Ring2][Ring1][C][Branch1][C][C][C@H1][Ring2][Ring1][=Branch1][C@H1][Branch1][C][C][C][C][C][C][Branch1][C][C][C][C@@H1][Ring2][Ring2][=Branch2][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring2][P][O]
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CHEMBL1097917
|
[C][=C][Branch2][#Branch1][=N][C][C][C@@H1][Branch1][C][C][C@H1][C@H1][Branch2][Ring2][N][O][C@@H1][O][C@@H1][Branch1][Branch2][C@@H1][Branch1][C][O][C][O][C][C@H1][Branch2][Ring1][=Branch1][O][C@@H1][O][C@@H1][Branch1][Branch2][C@@H1][Branch1][C][O][C][O][C][C@H1][Branch1][C][O][C@H1][Ring1][O][O][C@H1][Ring2][Ring1][#Branch1][O][C][C][=C][C@@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@H1][C][C@H1][Branch1][C][O][C][C][C@][Ring1][#Branch1][Branch1][C][C][C@H1][Ring1][=C][C][C][C@@][Ring2][Ring1][C][Ring2][Ring2][=C][C][C][Branch1][C][C][C]
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CHEMBL163871
|
[C][C@@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch2][Branch1][#Branch1][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@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][Branch1][C][N][=O]
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CHEMBL1222706
|
[O][=C][Branch1][O][N][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][C][=C][Branch2][Ring1][P][C][=C][N][=C][C][=C][C][Branch1][P][N][C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][=N][N][Ring2][Ring1][Ring1][Ring1][S][C][=C][Ring2][Ring1][=Branch2]
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CHEMBL1208637
|
[C][N][Branch3][Ring2][Ring1][Ring2][/N][=C][/C][=C][C][=C][Branch3][Ring2][C][Ring2][O][P][Branch2][Branch2][C][O][C][=C][C][=C][Branch2][#Branch1][Branch1][/C][=N][/N][Branch2][Ring2][Ring2][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1][P][Branch1][C][O][=Branch1][C][=S][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring1][=N][P][Branch2][Branch2][Ring1][O][C][=C][C][=C][Branch2][#Branch1][=Branch1][/C][=N][/N][Branch1][C][C][P][=Branch1][C][=S][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring2][Branch2][Branch2][Ring1][O][C][=C][C][=C][Branch2][#Branch1][=Branch1][/C][=N][/N][Branch1][C][C][P][=Branch1][C][=S][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1][O][C][=C][C][=C][C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring2][=N][P][Branch2][Branch2][Ring1][O][C][=C][C][=C][Branch2][#Branch1][=Branch1][/C][=N][/N][Branch1][C][C][P][=Branch1][C][=S][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring2][Branch2][Branch2][Ring1][O][C][=C][C][=C][Branch2][#Branch1][=Branch1][/C][=N][/N][Branch1][C][C][P][=Branch1][C][=S][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring2][=N][Ring3][Ring1][C][=C][C][=C][Ring3][Ring1][Ring1][Branch1][P][=Branch1][C][=S][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][Ring1]
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CHEMBL1075679
|
[O][=C][Branch2][Ring2][Ring1][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring1][O][N][C@@H1][Branch1][=Branch2][C][C][=C][NH1][C][=N][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F]
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CHEMBL1162197
|
[O][=C][Branch1][=N][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][C][C][=C][N][Branch2][#Branch1][Branch2][C@@H1][O][C@H1][Branch2][Branch1][=N][C][O][P][=Branch1][C][=O][Branch1][C][O][O][P][=Branch1][C][=O][Branch1][C][O][O][P][=Branch1][C][=O][Branch1][C][O][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@@H1][O][C@H1][Branch1][=N][N][C][=C][C][=Branch1][C][=O][NH1][C][Ring1][#Branch1][=O][C@@H1][Branch1][C][O][C@H1][Ring1][=C][O][C@H1][O][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C@H1][Ring1][N][Ring2][Ring2][P][C][=Branch1][C][=O][N][=Ring2][Branch1][Branch2]
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CHEMBL3347315
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[O-1][N+1][O][N][=C][C][=C][C][Branch2][Ring1][=C][C][O][C][=C][C][=C][Branch1][P][/C][=N][/N][C][=Branch1][C][=S][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][C][=C][C][Ring2][Ring1][#Branch2][=Ring2][Ring1][=N]
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CHEMBL4116155
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[C][C][C][C][C][=C][C][Branch2][Ring1][Branch2][O][C][C][C][N][Branch1][=N][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][C][Ring1][=C][=C][N][=C][C][=C][C][Ring1][=Branch1][=C][Ring2][Ring1][=Branch2]
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CHEMBL1187422
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[C][C][C@H1][Branch1][C][C][C@H1][Branch2][Branch1][=Branch1][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][=C][N][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][Branch3][Ring1][Ring1][O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][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][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=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][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][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][Branch2][S][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][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][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][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@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][Branch1][C][N][=O][C][Branch1][C][C][C][C][Branch1][C][C][C][C@@H1][Branch1][C][C][O]
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CHEMBL1186290
|
[C][C][=C][N][Branch2][Ring1][=Branch2][C@H1][C][O][C@@H1][Branch1][S][C][O][C][=Branch1][C][=O][C@H1][Branch1][C][N][C][Branch1][C][C][C][O][Ring1][=C][C][=Branch1][C][=O][NH1][C][Ring2][Ring1][Branch1][=O]
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CHEMBL1165801
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[C][O][C][=C][C][=C][Branch2][Ring1][=N][C][=C][O][C][=C][C][=C][C][Branch1][O][O][C][C][C][C][C][C][C][Ring1][=Branch1][=C][Ring1][=C][C][Ring2][Ring1][C][=O][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][O]
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CHEMBL162280
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[C][O][C][=C][C][=C][O][C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][=C][C][Ring1][=Branch2][=C][Ring1][=N]
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CHEMBL1214400
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[F][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][Branch2][Ring2][#Branch1][N][C][=C][C][=N][C][=N][C][Branch2][Ring1][Ring2][C][=N][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F][=C][N][=C][Ring2][Ring1][Branch1][Ring1][P][N][=C][Ring2][Ring1][N]
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CHEMBL1187911
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[C][N][C][C][C][C][=C][Branch1][O][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][O][C][Ring1][N]
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CHEMBL1170659
|
[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][NH1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Ring1][=C]
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CHEMBL1172041
|
[C][=C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][O][C][C][C][=C][C][=N][O][N][=C][Ring1][Branch1][C][=Ring1][=Branch2][C][C][C][N][Branch2][Ring1][P][C][C@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][C@][Ring1][N][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][#Branch2]
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CHEMBL1172056
|
[O][=S][=Branch1][C][=O][Branch2][Ring1][C][/C][=C][/S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=N][C][C][O][Ring1][Branch1]
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CHEMBL1213185
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=S][N][C][C][N][Branch2][Ring2][C][N][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=S][N][C][C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][=Branch2]
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CHEMBL1172222
|
[C][C][C][C][C][Branch2][Ring2][Ring1][S][C][=N][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring2][Ring1][=Branch1][C][=Branch1][C][=O][O]
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CHEMBL1076755
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][#Branch1][N][/N][=C][\C][=Branch1][C][=O][N][N][=C][Ring1][=Branch1][C][=C][N][=C][C][=C][Ring1][=Branch1][O][C][=C][Ring2][Ring1][=Branch1]
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CHEMBL1075878
|
[C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][C][=C][NH1][C][=N][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][N][Branch1][C][C][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1]
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CHEMBL1076047
|
[C][O][C][=C][C][=C][N][=C][C][=C][Branch1][C][Cl][C][=C][C][Ring1][#Branch1][=C][Branch2][Ring2][P][N][C][=C][C][=C][Branch2][Ring2][Ring2][N][C][=N][C][Branch1][#Branch2][N][C][C][C][N][Branch1][C][C][C][=N][C][Branch1][=N][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][Ring2][Ring1][Branch1][C][=C][Ring2][Ring1][N][C][Ring2][Ring2][Branch2][=C][Ring2][Ring2][N]
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CHEMBL606722
|
[C][C][C][C][C][C][C][=Branch1][C][=O][O][C][C@H1][O][C@H1][Branch2][=Branch2][#Branch2][O][C][=C][C][=C][Branch2][Branch2][=N][C][C@H1][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring2][C][C@@H1][Branch1][C][O][C@@H1][C][N][C][Branch1][C][N][N][Ring1][=Branch1][C@H1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][Ring1][#Branch2][O][N][C][=Branch1][C][=O][C@H1][Branch1][#C][C@@H1][Branch1][C][O][C@@H1][C][N][C][Branch1][C][N][N][Ring1][=Branch1][N][C][Ring2][Branch1][N][=O][C][=C][Ring2][=Branch1][Ring2][C@@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@@H1][Ring2][=Branch1][=N][O][C@H1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][Ring1][#Branch2][O]
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CHEMBL3347306
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][Ring1][=N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@@H1][Branch2][=N][#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][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch2][=Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][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@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][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][C][=O][C@@H1][Branch1][C][C][C][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][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@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][Branch1][C][N][=O]
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CHEMBL1162542
|
[C][C][=C][N][Branch3][Ring1][P][Ring2][C@H1][C][C@H1][Branch3][Ring1][Branch2][=Branch1][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][=N][N][C][=C][C][Branch1][C][N][=N][C][Ring1][#Branch1][=O][C][C@@H1][Ring1][=N][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][PH1][Branch1][C][O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][Branch1][Ring1][C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=N][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][=C][NH1][Ring1][P][C][=C][Ring2][Ring1][#Branch1][C@@H1][Branch2][=Branch2][#C][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][C][C@H1][Branch1][=N][N][C][=C][C][Branch1][C][N][=N][C][Ring1][#Branch1][=O][O][C@@H1][Ring1][=N][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][C][C@H1][Branch1][=N][N][C][=C][C][Branch1][C][N][=N][C][Ring1][#Branch1][=O][O][C@@H1][Ring1][=N][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][C][C@H1][Branch1][=N][N][C][=C][C][Branch1][C][N][=N][C][Ring1][#Branch1][=O][O][C@@H1][Ring1][=N][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][C][C@H1][Branch1][=N][N][C][=C][C][Branch1][C][N][=N][C][Ring1][#Branch1][=O][O][C@@H1][Ring1][=N][C][O][O][Ring3][Ring1][Ring2][Branch2][C][=Branch1][C][=O][NH1][C][Ring3][Ring1][Ring2][#C][=O]
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CHEMBL180233
|
[C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][Branch1][C][O][C][C][C][#C][C][=C][C][=C][Branch2][Ring2][O][O][C][C][C][C][N][C][C][N][Branch2][Ring1][#Branch2][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring2][Ring1][Branch1][C][=C][Ring2][Ring1][S]
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CHEMBL1164326
|
[C][C][C][C@@H1][Branch2][N][#Branch2][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][N][=O][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch1][C][O][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch1][C][O][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch1][C][O][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1]
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CHEMBL4116133
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[N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
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CHEMBL4116134
|
[C][O][C][=C][C][=C][C][Branch1][=N][C][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][=C][N+1][=Branch2][Ring1][Branch1][=C][C][Ring1][=C][=C][Ring2][Ring1][C][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][=C][C][=C][Branch1][Branch2][C][=C][Ring1][=Branch1][Ring2][Ring1][#Branch1][O][C][O][Ring1][#Branch1]
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CHEMBL4116135
|
[C][N+1][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Branch1][N][N][C][C][N][C][C][O][C][C][Ring1][=Branch1][C][O][C][=C][C][=C][Branch1][=N][O][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][=C][C][=Ring1][P][Ring2][Ring2][C]
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CHEMBL1160541
|
[C][C][=C][C][Branch1][=N][C][N][C][=Branch1][C][=N][/N][=C][Branch1][C][/N][S][=C][Branch1][C][C][C][=C][Ring1][#C][C][N][C][=Branch1][C][=N][C][C][=Branch1][C][=N][S]
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CHEMBL1161048
|
[C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][C][C][N][Branch1][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][C][C][C][Ring1][S][N][Ring2][Ring1][=Branch1][C].[O][=C][Branch1][C][O][C][C][C][=Branch1][C][=O][O]
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CHEMBL1170828
|
[O][=C][Branch1][C][O][C][=C][C][=C][C][Branch2][Ring2][Ring1][O][C][=N][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][Ring2][Ring1][#Branch2]
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CHEMBL1188238
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[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][N][C][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][Ring1][#C][=O]
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CHEMBL1183203
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[C][C@H1][C][N][Branch2][Ring2][Ring2][C][=N][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][F][C][=Branch1][C][=O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Ring1][=N][C][Branch1][C][C][Branch1][C][C][C][C][C@@H1][Ring2][Ring1][Branch2][N]
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CHEMBL1200510
|
[C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][O].[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][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@][Ring2][Ring2][#C][Branch1][C][C][O]
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CHEMBL1075666
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[C][O][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][N][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring1][#Branch2][C][=C][N][C][=C][N][=C][Ring1][Branch1][C][Branch1][O][N][C][C][=C][C][=N][C][=C][Ring1][=Branch1][=N][Ring1][P][=C][Ring2][Ring1][#Branch1]
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CHEMBL1221884
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[C][C][C@H1][Branch1][C][C][C@H1][Branch2][#Branch1][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][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][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][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][=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][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch2][O][Ring1][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][Branch2][Branch2][#C][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch1][C][C][S][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][Ring1][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][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][C][C@@H1][Branch1][C][C][C][C]
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CHEMBL1189068
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[N][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch2][=Branch1][Branch2][N][C][=Branch1][C][=O][C][=N][C][Branch2][Branch1][Branch2][N][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][O][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][Cl][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][Ring1][N][=C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][#Branch1][=C][NH1][Ring2][Ring2][Branch1][=C][NH1][Ring2][Ring2][=N]
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CHEMBL1165737
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[O][=C][Branch2][Ring2][=Branch1][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][Ring1][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N]
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CHEMBL1182846
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[C][N+1][Branch1][Ring2][C][C][Cl][Branch1][Ring2][C][C][Cl][C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][N]
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CHEMBL1186168
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=N][C][=C][C][=C][N][=C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][Ring1][=C][=C][Ring2][Ring1][C]
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CHEMBL1214058
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[C][C][=N][C][=C][Branch2][Ring2][=N][O][C][=C][C][=C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][F][C][=C][C][=C][C][=C][Ring2][Ring1][=Branch2][Ring1][=Branch1][C][=C][N][=C][Ring2][Ring1][S][NH1][C][Ring2][Ring2][Ring2][=O]
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CHEMBL3347297
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][Ring1][=N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@@H1][Branch2][=N][#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][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch2][=Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][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@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][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][C][=O][C@@H1][Branch1][C][C][C][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][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][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][Branch1][C][N][=O]
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CHEMBL3347298
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[C][C][NH1][C][=Branch1][C][=O][C][Branch1][C][Br][=C][Branch1][P][O][C][=C][C][Branch1][C][Cl][=C][C][Branch1][Ring1][C][#N][=C][Ring1][=Branch2][C][=Ring2][Ring1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
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CHEMBL1076477
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[C][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=C][Ring2][Ring1][Ring1][N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][=C][C][Branch1][#C][N][C][C][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][=N][C][=N][Ring1][S]
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CHEMBL586649
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[C][N][Branch1][C][C][C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][=C][Ring1][N][N][Ring1][#C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1].[Cl]
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CHEMBL1099016
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[C][C][Branch1][C][C][/N][=C][\S][/C][=Branch1][S][=C][\C][=C][C][=C][Branch1][C][O][C][Branch1][C][Cl][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Ring1][#C][C][C][C][=Branch1][C][=O][O]
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CHEMBL1213203
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[C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][Ring1][#C][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][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@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][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][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][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][=O][O][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][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch2][Branch1][=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][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][C][N][C][C][C][N][C][=Branch1][C][=N][N][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][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][Ring1][C][S][C][=Branch1][C][=O][O]
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CHEMBL164857
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[C][C][=N][C][=C][N][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Ring1][#Branch2][C][C][Ring2][Ring1][=C]
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CHEMBL1214854
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[O][=C][Branch1][C][O][C][C][C][=C][Branch2][Ring1][Branch1][/C][=C][\C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][Ring1][O][NH1][C][=C][Ring1][P][C][=Branch1][C][=O][C][C][C][Ring1][#Branch1]
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CHEMBL1198796
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[N][=C][Branch1][C][N][N][C][=C][C][=C][Branch2][Ring1][Ring2][S][C][=C][C][=C][Branch1][=Branch2][N][=C][N][C][C][N][Ring1][Branch1][C][=C][Ring1][N][C][=C][Ring2][Ring1][Ring1]
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CHEMBL4116142
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[N][C][C][O][B][Branch1][C][O][C][=C][Branch1][Branch1][O][C][C][F][C][=C][C][Branch1][C][Br][=C][Ring1][O][Ring1][#C]
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CHEMBL1201295
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[C][C][=C][C][=C][Branch2][Ring2][=C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][#C][C][Branch1][C][O][C][N][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][=C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][P]
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CHEMBL1215485
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[N][#C][C][=C][C][=C][Branch2][Ring2][C][N][N][=C][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][C][C@@H1][Ring1][=N][C@@H1][Ring1][S][C][C][C][C][C][Ring1][Branch1][C][=C][Ring2][Ring1][O]
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CHEMBL1222580
|
[C][O][C][=C][C][=C][Branch2][=Branch1][C][C@H1][C][C][=Branch1][C][=O][O][C@@H1][Branch1][C][C][C][C@@H1][Branch1][C][C][/C][=C][Branch1][C][\C][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][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring2][Ring2][=Branch1][C][=C][Ring2][Ring2][N]
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CHEMBL1184214
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[C][#C][C][N@+1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][O][C][C][=C][C][N@+1][Branch1][Ring2][C][C][#C][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][Ring1][P][C][O][C][C][=C][Branch1][Branch1][C][Ring2][Ring2][Branch1][C][Branch1][=Branch2][C][C][Ring2][Ring2][Branch1][Ring2][Ring2][Branch2][C][Ring1][#Branch2][C][Ring2][Ring1][S][Ring2][Ring2][#Branch1][C][Ring2][Ring1][Ring2][C][Ring2][Ring1][P][C][Ring2][Ring1][=C][C][C][Ring2][Ring1][Branch2][Ring2][Ring1][=C]
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CHEMBL1184294
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[C][N+1][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][N+1][Branch1][C][C][C][C][O][C][C][Ring1][#Branch1]
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CHEMBL1185086
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[C][=C][C][N+1][Branch1][S][C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][C][C@][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C@H1][Ring1][=Branch2][C@@H1][Branch1][N][C@H1][Ring2][Ring1][O][C][C@@H1][Ring1][=N][Ring2][Ring1][O][C@@H1][Branch1][=Branch1][O][C][Ring2][Ring1][P][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][C@H1][C][C][N+1][Branch1][S][C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][C][=C][C][O][C@@H1][Ring2][Ring2][=Branch1][C@@H1][Ring2][Ring1][#Branch1][C@H1][Ring1][#Branch1][C][C@@H1][Ring2][Ring1][=Branch2][Ring2][Ring1][=Branch1]
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CHEMBL1185426
|
[C][C][C][C][C][C][C][C][C][C][C][C@H1][Branch2][=Branch2][O][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][O][C][Branch2][Branch2][C][C][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][#Branch2][O][P][=Branch1][C][=O][Branch1][C][O][O][C][Branch2][Ring2][Ring1][O][C][=Branch1][C][=O][C][C@@H1][Branch1][N][C][C][C][C][C][C][C][C][C][C][C][O][C][=Branch1][C][=O][C][C][C][C][C][C][C][C][C][C][Ring2][Ring2][=Branch2][N][C][=Branch1][C][=O][C][C@@H1][Branch1][N][C][C][C][C][C][C][C][C][C][C][C][O][C][=Branch1][C][=O][C][C][C][C][C][C][C][C][C][C][Branch1][C][O][C][Ring2][=Branch1][#C][O][O][C][=Branch1][C][=O][C][C][C][C][C][C][C][C][C]
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CHEMBL1163095
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[N][C][=N][C][Branch1][C][O][=C][N][=C][N][Branch2][Ring2][#Branch2][C][O][C@H1][Branch2][Ring1][O][C][O][P][=Branch1][C][=S][Branch1][C][S][O][P][=Branch1][C][=O][Branch1][C][O][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][Branch1][C][O][C@H1][Ring2][Ring1][Ring2][O][C][Ring2][Ring1][#Branch2][=N][Ring2][Ring1][#C]
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CHEMBL4116144
|
[C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][C][Ring1][Ring1][C][N][C][C][C][=C][S][C][=Ring1][Branch1][O][C]
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CHEMBL4116145
|
[C][C][C][C][C][=Branch1][C][=O][O][C][Branch2][Ring2][#Branch2][C@H1][Branch1][#Branch2][C][C@@H1][C][C][N][C][Ring1][Branch1][=O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][O]
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CHEMBL1179555
|
[C][C][Branch1][C][C][Branch1][C][C][O][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][C][C][C][C][C][C][C][C][C][C][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
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CHEMBL1179567
|
[C][C][Branch2][Ring1][#Branch1][C][Branch1][C][N][C][=Branch1][C][=O][N][C][Branch1][Ring1][C][#N][C][C@@H1][C][C@@H1][Ring1][Ring1][Ring1][Branch2][C][C][C][C][Ring1][P]
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CHEMBL1186000
|
[C][=C][C][=C][Branch2][Branch2][#Branch2][C][C][=C][C][=C][N+1][Branch2][#Branch1][=N][C][C][C][C][C][C][=C][C][Branch2][Ring1][=Branch2][C][C][C][C][C][N+1][=C][C][=C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=N][=C][Branch2][Ring1][=Branch2][C][C][C][C][C][N+1][=C][C][=C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=N][C][=C][Ring2][Ring2][#Branch2][C][C][C][C][C][N+1][=C][C][=C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=N][=C][Ring2][=Branch1][#Branch1][C][=C][Ring2][=Branch1][=C]
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CHEMBL1186325
|
[C][N][C][C][=N][N][=C][Branch1][C][S][O][Ring1][=Branch1]
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CHEMBL1186041
|
[C][N+1][=C][S][C][Branch2][Ring1][P][C][O][C][=C][C][=C][Branch2][Ring1][Ring1][/C][=N][/N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][C][=C][Ring2][Ring1][=Branch2]
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CHEMBL1184967
|
[C][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][N][Branch1][#Branch1][C][C][Branch1][C][C][C][C][C][C][N][C][C][Ring1][=Branch1][=C][Ring2][Ring1][C]
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CHEMBL3347302
|
[C][C][N][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C][=C][N][Branch1][#Branch2][C][C][C][C][C][C][C][Ring1][=Branch1][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][P][Ring1][#Branch1][C][C][Ring2][Ring1][=Branch2].[Cl]
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CHEMBL1205595
|
[C][O][C][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][Branch2][#Branch1][C][O][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch2][Branch1][#Branch2][O][C][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][Branch2][Ring1][Branch2][O][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][Branch1][C][C][C][Branch1][C][O][C][Ring1][O][O][O][C][Branch1][Ring1][C][O][C][Ring2][Ring1][=Branch2][O][S][=Branch1][C][=O][=Branch1][C][=O][O][C][Branch1][C][O][C][Ring2][Ring2][=Branch2][O][O][C][Branch1][Ring1][C][O][C][Ring2][Branch1][#Branch1][O][S][=Branch1][C][=O][=Branch1][C][=O][O]
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CHEMBL1094711
|
[Cl][C][=C][C][=C][Branch2][Ring1][=Branch1][C][Branch1][O][O][N][=C][C][C][C][C][C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Branch1]
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CHEMBL1163140
|
[C][C][Branch1][C][C][C][=Branch1][C][=O][C][C][C@@H1][Branch1][C][C][C@H1][C@@H1][Branch1][C][O][C][C@@][Branch1][C][C][C@@H1][C][C][C@H1][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch2][Ring2][#Branch2][O][C@@H1][O][C@H1][Branch2][Ring1][=Branch1][C][O][C@@H1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring1][Branch1][O][C][C][C@@][Ring2][Ring1][#C][C][C@@][Ring2][Ring2][Ring2][Ring1][Ring1][C][C@H1][Branch1][C][O][C@][Ring2][Ring2][=C][Ring2][Ring2][#Branch2][C]
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CHEMBL607038
|
[C][C][C][=C][Branch1][=C][C@@H1][C][C][C@H1][C][C][C][Ring1][#Branch1][N][Ring1][Branch1][C][O][N][=Ring1][=C].[O][=C][Branch1][C][O][C][=Branch1][C][=O][O]
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CHEMBL1096654
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch2][Branch2][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][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][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][=Branch2][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@H1][Branch2][#Branch1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O][C@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][O][C][Branch1][C][C][C]
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CHEMBL1096673
|
[N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][Branch2][Ring1][Ring1][O][C][C][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][S][Ring1][#Branch2][=C][Ring2][Ring1][Ring1][F]
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CHEMBL1169618
|
[C][N][C][C][C][C][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][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]
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CHEMBL1170815
|
[O][=C][Branch2][Ring1][C][N][C][=N][NH1][C][=N][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F]
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CHEMBL1172569
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=Branch1][#Branch1][=C][C][=C][Ring1][=Branch1][O][C][C@H1][C][=C][Branch2][Ring2][Branch2][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C@H1][Ring2][Ring1][S][N][Branch1][C][C][C][C][Ring2][Ring2][Branch1][C][C][N][Ring2][Ring1][O][C]
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CHEMBL1214443
|
[O][=C][Branch1][=Branch2][N][C@H1][C][O][C][Ring1][Ring2][=O][C][=C][C][=C][Branch1][=C][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#C]
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CHEMBL1161970
|
[O][=C][Branch2][Branch1][Ring1][N][C][=C][C][=C][C][Branch1][C][O][=C][Branch2][Ring1][C][/N][=N][/C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][=C][C][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][#Branch2][N][C][=C][C][=C][C][Branch1][C][O][=C][Branch2][Ring1][C][/N][=N][/C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][=C][C][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][#Branch2]
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CHEMBL156114
|
[N-1][=N+1][=N][C@H1][C][C@H1][Branch1][Ring1][C][O][S][C@H1][Ring1][#Branch1][N][C][=N][C][=C][Branch1][C][Cl][N][=C][N][=C][Ring1][#Branch1][Ring1][#Branch2]
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CHEMBL1189522
|
[C][N][C][=C][C][=C][Branch1][#C][O][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][S][C@][Branch1][C][C][C][C][N@@+1][Branch1][C][C][Branch1][C][O-1][C@H1][Ring2][Ring1][=Branch2][Ring1][Branch2]
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CHEMBL3347319
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][Ring1][=N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@@H1][Branch2][=N][#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][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch2][=Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][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@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][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][C][=O][C@@H1][Branch1][C][C][C][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][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][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][Branch1][C][N][=O]
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CHEMBL3347320
|
[C][C][N][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C][=C][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][Branch1][C][=C][Branch1][Ring1][O][C][C][=C][C][=C][Ring1][P][Ring1][Branch2][C][C][Ring2][Ring1][=Branch2].[Cl]
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CHEMBL1185710
|
[C][C][=C][N][Branch2][N][Ring2][C@H1][C][C@H1][Branch2][=Branch2][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][=C][Branch1][C][O][N][=C][Branch1][C][N][N][=C][Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][=C][Branch1][C][O][N][=C][Branch1][C][N][N][=C][Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][C@@H1][Branch2][Ring2][Branch1][C][O][C][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][=Branch1][O][Ring2][#Branch1][#C][C][=Branch1][C][=O][NH1][C][Ring2][Branch2][=Branch1][=O]
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CHEMBL1186057
|
[C][=C][C@][Branch1][C][C][C][C@@H1][Branch2][Branch1][#Branch1][O][C][=Branch1][C][=O][C][N][C][C][N][Branch2][Ring2][C][C][=Branch1][C][=O][C][C][N][C][=N][C][=C][Branch1][=N][N][C][C][C][Branch1][Ring2][C][N][C][C][Ring1][Branch2][N][=C][N][=C][Ring1][=C][Ring1][P][C@@H1][Branch1][C][C][C][Ring2][Ring1][N][C@@][Branch1][C][C][C@H1][C][=Branch1][C][=O][C][C][C@@][Ring1][=Branch1][Branch1][#Branch1][C][C][C@H1][Ring1][O][C][C@@H1][Branch1][C][C][C@@H1][Ring2][Branch1][Ring1][O]
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CHEMBL1229036
|
[Cl][C][=C][C][=C][Branch2][Ring1][#Branch1][C][N][C][=C][N+1][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][Ring1][=N][C][=C][Ring2][Ring1][Ring2]
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CHEMBL1229041
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[C][C][C@H1][Branch1][C][C][C@H1][Branch2][=Branch2][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][#C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][C][C][N][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][Branch1][=N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][Branch1][C][N][=O][C][Branch1][C][C][C][C][Branch1][C][C][C]
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CHEMBL1214724
|
[C][O][C][=C][C][C][Branch2][Ring1][Branch2][/C][=C][/C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][Ring1][N][=C][NH1][C][=Ring2][Ring1][C][C][=C][Ring2][Ring1][=Branch1][C]
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CHEMBL1189598
|
[O][=C][Branch2][Ring2][Ring2][N][C@H1][Branch1][N][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][C][C][C@H1][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch2][C][Ring1][Branch2]
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CHEMBL4116166
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[C][C][=C][C][=C][Branch2][Ring1][=C][N][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N+1][Branch1][C][C][C][=C][Ring1][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][=C][Ring2][Ring1][=Branch2][C]
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CHEMBL1199062
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[N][C][C][C][C][=C][Branch2][Ring2][#Branch2][C][=C][C][Branch1][#C][O][C][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][=C][C][=C][Ring1][S][N][Ring2][Ring1][Ring1][C][C][C][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring2][Ring2][C]
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