chembl_id
stringlengths 7
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stringlengths 3
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CHEMBL4287744
|
[C][C][C][=C][C][=C][C][Branch1][#Branch2][C][=Branch1][C][=O][C][Branch1][C][Cl][Cl][=C][Ring1][O]
|
CHEMBL4287745
|
[C][C][Branch1][C][C][O][P][=Branch1][C][=O][Branch1][#Branch1][O][C][Branch1][C][C][C][C][Branch1][P][C][=C][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][=C][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch2][Ring1][#Branch1]
|
CHEMBL4287746
|
[C][N][Branch1][=C][C][=N][C][=N][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C@H1][C][N][Branch1][Branch2][C][=Branch1][C][=O][C][C][#N][C][C][Ring1][#Branch2][C][C][Ring1][Ring1].[Cl]
|
CHEMBL4287824
|
[N][#C][C][C][N][Branch1][=Branch2][C][C][=C][C][=C][S][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F]
|
CHEMBL4287825
|
[C][N][C][C][C@][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C@H1][Ring1][N][C@@][Ring1][#Branch2][C][C][N][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@][C][C][N][Branch1][C][C][C@@][Ring1][=N][Ring1][=Branch1][N][Branch1][=C][C][=C][Ring2][Ring1][Branch1][C][=C][C][=C][Ring1][=Branch1][Ring1][=N][C@@H1][Ring2][Ring1][#Branch1][Ring2][Ring2][Ring1]
|
CHEMBL4287826
|
[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch2][Ring1][=N][C][C][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][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Ring2][Ring1][=C][O]
|
CHEMBL4287827
|
[O][=C][Branch1][C][O][C][=C][C][=C][Branch2][Branch1][Ring1][N][Branch2][Ring1][Branch1][C][C][=C][C][=C][C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=N][C][=C][Ring2][Ring2][Branch1]
|
CHEMBL4287828
|
[C][O][C][=C][C][=C][N][=C][Branch2][Ring2][=Branch2][C][=C][C][=C][Branch2][Ring1][=N][N][/C][=C][\C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][Br][C][=C][Ring2][Ring1][Branch2][S][C][Ring2][Ring1][=N][=C][Ring2][Ring1][P]
|
CHEMBL4287829
|
[O][=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][N][Ring2][Ring1][=N][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4287830
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][Branch1][#Branch2][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][P][#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][#C][#Branch1][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@][Branch1][C][C][C][C][C][/C][=C][\C][C][C][C@][Branch1][C][C][Branch2][=Branch2][=Branch2][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][=O][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][S][C][N][C][Branch1][C][C][=O][C@@H1][Branch1][C][C][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@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][Ring2][=Branch2][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][Ring1][C][O][C][Branch1][C][N][=O]
|
CHEMBL4287831
|
[O][=C][/C][=Branch2][Ring2][#Branch1][=C][/C][=C][N][Branch2][Ring1][Branch1][C][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][C][=C][C][=C][C][=C][Ring2][Ring1][Branch1][Ring1][=Branch1][C][C][C@@H1][C@H1][C][C][C][N][C][C][C][C@H1][Branch1][Branch2][C][N][Ring2][Ring2][=Branch1][Ring1][N][C@@H1][Ring1][N][Ring1][Branch2]
|
CHEMBL4287913
|
[C][C][=C][C][=C][Branch2][Ring2][Branch1][C@][Branch1][C][O][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][Ring2][Ring1][C][C][=C][Ring2][Ring1][Branch2]
|
CHEMBL4287914
|
[F][C][Branch1][C][F][C][C][C@H1][Branch2][Ring2][S][N][C][=N][C][Branch1][#C][N][C@@H1][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][=N][C][Branch2][Ring1][Ring1][C][=C][N][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][#Branch2][=N][Ring2][Ring1][Branch2][C][Ring2][Ring1][#C]
|
CHEMBL4287915
|
[O][=C][/C][=Branch2][Ring1][=N][=C][/C][=C][C][=C][N][Ring1][Branch1][C][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][C][C][C@@H1][C@H1][C][C][C][N][C][C][C][C@H1][Branch1][Branch2][C][N][Ring2][Ring2][C][Ring1][N][C@@H1][Ring1][N][Ring1][Branch2]
|
CHEMBL4287916
|
[C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][#C][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][C][C][C][Ring1][=Branch1][=C][Ring1][=C]
|
CHEMBL4287917
|
[O][=C][Branch1][C][O][C][=C][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][O]
|
CHEMBL4287991
|
[C][O][C][=C][C][=C][Branch2][Ring2][Branch1][N][C][=C][Branch2][Ring1][#Branch2][C][C][C][=C][Branch1][Ring2][O][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][N][=O][N][=N][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][#Branch2]
|
CHEMBL4287992
|
[F][C][Branch1][C][F][C][C][C][Branch2][Ring2][P][N][C][=N][C][Branch1][#C][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][=N][C][Branch2][Ring1][Ring2][C][=C][C][=C][C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][O][=N][Ring2][Ring1][=Branch2][C][Ring2][Ring1][S]
|
CHEMBL4287993
|
[O][=C][Branch1][P][/C][=C][/C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2][N][C][C][O][C][C][O][C][C][O][C][C][O][C][C][N][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2]
|
CHEMBL4287994
|
[C][C][=C][C][=C][C][Branch2][Branch1][N][C][N][C][=Branch1][C][=O][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring2][Ring1][S][=C][Ring2][Ring2][#Branch1]
|
CHEMBL4287995
|
[N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][C][N][/N][=C][/C][=C][C][=C][Branch2][Ring1][Ring1][N][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][C][=C][Ring2][Ring1][C][C][=C][Ring2][Ring1][O]
|
CHEMBL4288080
|
[C][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=N][C][Branch2][Ring1][#Branch1][N][C][=C][C][=C][Branch1][N][O][C][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][#C][=N][C][=C][Ring2][Ring1][=Branch1][Cl]
|
CHEMBL4288081
|
[C][N][C][=Branch1][C][=O][N][C][S][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Branch1][S][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][=C][Ring2][Ring1][C][C][=Ring2][Ring1][Branch1][C][Branch1][C][N][=O]
|
CHEMBL4288082
|
[C][C][C][C][C][C][C][C][C][C][C][C][S][C][=C][Branch1][=C][S][C][C][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][Branch2][=N][O][C][C][=C][N][Branch2][N][#C][C][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][C][Ring2][=Branch2][O][=O]
|
CHEMBL4288083
|
[C][C][C][C][C][=C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Branch1][Ring1][O][C][C][=C][Ring1][S][C][=C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Ring1][#Branch2][Ring2][Ring1][N]
|
CHEMBL4288161
|
[C][C][Branch1][C][C][C][C][C][=C][Branch2][Ring2][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][=C][Branch1][#C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][NH1][C][Ring2][Ring1][#Branch1][=Ring1][#C][O][Ring2][Ring1][N]
|
CHEMBL4288162
|
[C][C][=C][C][=C][Branch1][P][N][C][=N][C][Branch1][#Branch1][C][C][Branch1][C][C][O][=N][S][Ring1][=Branch2][C][=C][Ring1][S]
|
CHEMBL4288163
|
[O][=C][Branch1][=C][N][C][=Branch1][C][=S][N][C][C][O][C][C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL4288164
|
[C][O][C][=C][C][=C][Branch2][Ring1][#C][C][=C][N][Branch1][C][C][N][=C][Ring1][=Branch1][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][C][=C][Ring2][Ring1][Branch2]
|
CHEMBL4288165
|
[C][C][N][C][C][C][Branch2][Branch1][#Branch2][C][=C][C][=C][Branch2][Ring2][=C][N][C][=N][C][=C][Branch1][C][F][C][Branch2][Ring1][=C][C][=C][C][Branch1][C][F][=C][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][Branch1][C][C][=N][Ring1][O][=N][Ring2][Ring1][=Branch1][N][=C][Ring2][Ring1][=N][C][C][Ring2][Ring2][Ring1]
|
CHEMBL4288166
|
[O][=C][Branch2][Ring1][Branch2][N][N][C][=Branch1][C][=O][C][S][C][Ring1][=Branch1][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=N][S][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1]
|
CHEMBL4288254
|
[C][C][C][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][=C][Branch1][C][N][N][Ring1][#Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1].[Cl]
|
CHEMBL4288255
|
[C][C][N][C][Branch1][=Branch2][C][=Branch1][C][=O][N][C][C][O][=C][C][=C][Ring1][O][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][=C][C][=C][Branch2][Ring1][C][O][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][=C][Ring2][Ring1][C]
|
CHEMBL4288256
|
[O][=S][=Branch1][C][=O][Branch2][Ring1][Ring2][C][=C][C][=C][C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][N][C][C][N][Branch2][Ring2][Ring2][C][=C][C][=C][Branch2][Ring1][Branch2][/C][=C][/C][=C][C][Branch1][C][Cl][=C][C][Branch1][=Branch2][C][N][C][=C][N][=C][Ring1][Branch1][=C][Ring1][=N][C][=C][Ring2][Ring1][Branch1][C][C][Ring2][Ring1][O]
|
CHEMBL4288257
|
[N][C][O][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][N][=C][C][=C][Ring1][S][C][=Ring2][Ring1][Ring1][N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2]
|
CHEMBL4288258
|
[C][O][C][=N][C][=C][Branch2][Ring1][Branch1][C][C][=C][C][=N][C][=C][Branch1][C][Cl][C][=Branch1][C][=O][N][Ring1][Branch2][C][=Ring1][N][C][=C][Ring2][Ring1][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F]
|
CHEMBL4288333
|
[C][O][C][=C][C][=C][C][Branch1][=N][/C][=C][\N][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][=C][Ring1][=C][C][=C][C][=C][Branch1][#C][O][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][S]
|
CHEMBL4288334
|
[C][C][=C][C][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][=C][Branch2][Ring2][=Branch1][C][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch1][S][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][O][Ring1][P][C][=C][Ring2][Ring2][Ring1][C][Branch1][C][F][Branch1][C][F][F]
|
CHEMBL4288335
|
[C][N][C][C][N][Branch2][Ring1][=Branch2][C][=C][C][=C][Branch1][#C][C][#C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=C][Ring1][S][C][C][Ring2][Ring1][=Branch1]
|
CHEMBL4288336
|
[Cl].[O][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][#Branch2][C][C][C][C][N][C][C][N][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][C][Ring1][S]
|
CHEMBL4288337
|
[C][C][O][P][=Branch1][C][=O][Branch1][Ring2][O][C][C][C][Branch1][=N][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=C][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][NH1][C][Ring1][O][=O]
|
CHEMBL4288427
|
[C][C][Branch1][C][C][Branch1][C][C][N][C][C][N][Branch2][Ring2][#Branch1][C][C][N][C][C][C][N][Branch2][Ring1][Branch2][C][=C][C][=C][C][Branch1][=C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][=C][Ring1][#C][C][C][Ring2][Ring1][Branch1][C][C][Ring2][Ring1][=C]
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CHEMBL4288428
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[C][C][=Branch1][C][=O][C][C][C][=C][Branch1][C][C][C][C][C][=C][Branch1][C][C][C][C][C][=C][Branch1][C][C][C][C][C][=C][Branch1][C][C][C]
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CHEMBL4288429
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[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][=Branch2][C][N][C][=N][C][=C][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][=O][=C][Ring2][Ring1][=Branch1]
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CHEMBL4288430
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[C][C][O][C][=Branch1][C][=O][C][=C][N][=C][Branch1][Ring2][O][C][C][N][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][N][=C][Ring1][P][Ring1][#Branch2]
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CHEMBL4288510
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[Cl].[O][=C][Branch1][P][N][C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=C][C][=C][Branch1][#Branch2][O][C][C][C][N][C][C][Ring1][=Branch1][C][=C][C][=C][Ring1][=N][S][Ring1][S]
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CHEMBL4288511
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[O-1][S+1][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2]
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CHEMBL4288512
|
[O][=S][=Branch1][C][=O][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2]
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CHEMBL4288513
|
[O][=C][Branch1][C][O][C][C][C][O][C][=C][C][Branch2][Ring1][Branch2][O][C][C][C][O][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][=C][C][=C][Ring2][Ring1][#Branch1][Ring2][Ring1][#Branch2]
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CHEMBL4288514
|
[C][O][C][=Branch1][C][=O][C][N][C][C][O][C][C][Ring1][=Branch1]
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CHEMBL4288604
|
[C][N][C][C][N][Branch2][Ring2][#Branch1][C][=C][C][=C][Branch2][Ring1][O][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][N][N][=C][Ring1][#Branch1][C][=N][C][NH1][C][=C][C][Ring1][S][=Ring1][Branch1][C][=C][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][N]
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CHEMBL4288605
|
[C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Branch1][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][=C][Ring2][Ring1][Branch1]
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CHEMBL4288606
|
[C][C][Branch1][C][C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch1][#C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
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CHEMBL4288607
|
[N][C][O][C][=C][N][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][N][C][=C][C][=C][C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][=C][Ring1][N]
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CHEMBL4288608
|
[C][C][C][/N][=C][\S][/C][=Branch2][Ring1][C][=C][\C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][Ring1][P][C][=C][C][=C][C][=C][Ring1][=Branch1][C]
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CHEMBL4288689
|
[C][C][=C][C][=C][Branch2][Ring1][#C][C][=C][S][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F][=N][Ring2][Ring1][C][C][=C][Ring2][Ring1][Branch2]
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CHEMBL4288690
|
[C][C][C][N][C][=Branch1][C][=S][N][C][C][C][C][C][=C][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][C][Ring1][Branch2][=C][Ring1][N][Ring1][#C]
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CHEMBL4288691
|
[O][=S][=Branch1][C][=O][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][N][C][C][C@H1][Branch1][=N][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring1][=N]
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CHEMBL4288692
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][Branch2][N][C][=C][C][Branch1][=N][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=N][C][=N][Ring1][=C][=C][Ring2][Ring1][Branch1]
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CHEMBL4288777
|
[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][Branch1][#Branch2][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][O][C][Ring1][Branch1][=O]
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CHEMBL4288778
|
[O][=C][Branch2][Ring1][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][/C][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1]
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CHEMBL4288779
|
[N][#C][C][=C][C][=C][C][Branch2][Ring1][#Branch2][C][=N][C][=C][Branch1][Ring2][NH1][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O][=C][Ring2][Ring1][Branch1]
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CHEMBL4288780
|
[O][=C][NH1][C][=C][C][Branch2][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][NH1][N][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][=C][C][=C][Ring2][Ring1][Ring1][O][Ring2][Ring1][=Branch1]
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CHEMBL4288781
|
[O][=C][Branch1][#C][/C][=C][/C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
CHEMBL4283376
|
[N][C][=C][C][=C][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Branch1]
|
CHEMBL4283377
|
[C][O][C][=C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][O][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][Branch1][O][C]
|
CHEMBL4283378
|
[O][=C][C][=C][C][=C][Branch2][Branch1][P][O][C][C][C][C][C][=C][N][Branch2][Ring2][P][C][C][O][C][C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][N][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=Ring1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2][N][=N][Ring2][Ring2][#Branch1][C][=C][Ring2][Branch1][C]
|
CHEMBL4283379
|
[C][C@@H1][Branch1][C][O][C][C][C][/C][=C][/C][=C][/C@H1][Branch1][C][O][C][C@@H1][Branch1][C][O][C][/C][=C][\C][=C][\C][=Branch1][C][=O][O]
|
CHEMBL4283380
|
[O][=S][=Branch1][C][=O][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][N][C][C][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][Ring1][N]
|
CHEMBL4283464
|
[O][=P][Branch1][C][O][Branch1][C][O][C][Branch1][C][O][Branch1][=N][C][C][C][C][C][=N][C][=C][C][=N][Ring1][=Branch1][P][=Branch1][C][=O][Branch1][C][O][O]
|
CHEMBL4283465
|
[O][=C][C][=C][C][=C][C][=C][Branch1][#Branch1][O][C][C][C][C][Br][C][=C][Ring1][N][O][Ring1][S]
|
CHEMBL4283466
|
[C][S][C][=N][C][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][C][C][C][=C][N][=C][Branch1][=N][N][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][N][=C][Ring1][=C][Ring2][Ring1][Ring1]
|
CHEMBL4283467
|
[C][C][=C][C][=C][Branch2][Ring2][=Branch1][N][C][Branch2][Ring1][Ring1][N][/N][=C][\C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1][=O][C][=C][Ring2][Ring1][=N]
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CHEMBL4283549
|
[C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=N][NH1][C][Branch2][Ring1][Branch1][/C][=C][\C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][Ring1][O][=C][Ring1][P][C][Ring2][Ring1][Branch1]
|
CHEMBL4283550
|
[C][O][C][=C][C][=C][Branch2][Ring1][Ring2][N][C][C][N][Branch1][#Branch2][C][=Branch1][C][=O][C][Branch1][C][C][C][C][C][Ring1][O][N][=C][Branch1][=Branch1][N][Branch1][C][C][C][N][=C][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][Branch2][O][C][C][C][N][C][C][C][C][Ring1][Branch1]
|
CHEMBL4283551
|
[C][O][C][=C][C][Branch2][Ring2][=Branch1][/C][=C][\C][C][C][C][=Branch2][Ring1][Branch2][=C][C][=C][C][=C][N][Ring1][Branch1][C][=Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Branch1][=O][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][#C]
|
CHEMBL4283638
|
[C][C][Branch2][Branch1][#Branch1][C][=C][C][=C][Branch2][Ring2][O][C][C][=N][C][=C][Branch2][Ring1][=Branch2][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][C][=C][C][=C][C][=C][Ring1][=C][Ring1][=Branch1][C][=N][N][Ring2][Ring1][Ring1][C][=Ring2][Ring1][#Branch1][C][=C][Ring2][Ring1][=N][N][C][C][C][C][Ring1][Branch1]
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CHEMBL4283639
|
[C][C][C][C][N][C][=N][C][Branch1][C][N][=N][C][=C][Ring1][#Branch1][C][N][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][C][Ring1][=C]
|
CHEMBL4283640
|
[C][N][C][=C][C][=C][Branch1][C][Br][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Ring2][Ring1][Ring1][=O]
|
CHEMBL4283641
|
[C][C][=N][C][Branch2][Ring1][=N][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][=C][C][Branch1][O][N][C][C][C@H1][Branch1][C][N][C][Ring1][=Branch1][=N][C][=N][N][Ring2][Ring1][#C][Ring1][N]
|
CHEMBL4283642
|
[O][=C][Branch1][#C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=C][N][Branch1][#Branch2][C][C][C][C][O][C][C][Ring1][=Branch1][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Branch2][Ring1][=C]
|
CHEMBL4283643
|
[C][/C][=Branch1][Ring1][=N][\O][C][=C][C][=C][Branch2][Ring1][N][N][C][=Branch1][C][=O][C][N][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][=C][Ring1][N][N][C][=C][Ring2][Ring1][#Branch1]
|
CHEMBL4283644
|
[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][C][C][C][Ring1][#C][C][Branch1][C][O][=C][Ring2][Ring1][#Branch1][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
CHEMBL4283722
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][O][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][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][/C][=C][/C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][=C][Branch1][Ring1][O][C][C@@H1][Ring1][Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
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CHEMBL4283723
|
[O][=C][Branch1][P][N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][N][C][=C][C][=C][C][Branch1][=C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2][=C][Ring1][#C]
|
CHEMBL4283724
|
[N][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][#Branch1][N][C][C][C][Ring1][Ring1][=C][C][Branch1][#Branch2][N][C][C][C][C][C][C][Ring1][=Branch1][=N][N][Ring2][Ring1][Ring2][Ring1][P]
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CHEMBL4283725
|
[C][C][=C][C@@H1][Branch2][Ring1][Branch2][O][/C][=C][/C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][Ring1][=Branch2][O][C][Ring2][Ring1][Ring2][=O]
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CHEMBL4283726
|
[O][=C][Branch1][Branch2][C][=C][S][C][=N][Ring1][Branch1][N][C][C][N][Branch2][Ring2][Branch1][C][C][=C][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][N][=C][C][=N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][N][Ring2][Ring1][Ring2][Ring1][=Branch2][C][C][Ring2][Ring1][O]
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CHEMBL4283727
|
[N][=C][Branch2][Ring2][Ring1][N][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=N][C][=C][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][=C][C][=C][Ring1][#Branch2][O][Ring1][=N][C][=C][Ring2][Ring1][Ring1][N][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=N][C][=C][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][=C][C][=C][Ring1][#Branch2][O][Ring1][=N][C][=C][Ring2][Ring1][Ring1]
|
CHEMBL4283814
|
[C][C][=C][C][=C][Branch2][Ring1][S][N][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][C][=C][C][Branch1][Branch2][/C][=C][/C][=Branch1][C][=O][O][=C][C][=C][Ring1][O][O][Ring1][S][C][=C][Ring2][Ring1][=Branch2]
|
CHEMBL4283815
|
[O][C][=C][C][Branch1][=Branch2][C][N][C][C][C][C][Ring1][Branch1][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][S]
|
CHEMBL4283816
|
[C][O][C][=C][C][=C][Branch2][Ring1][#C][C][C][=C][Branch2][Ring1][Branch1][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][O][N][=Ring1][P][C][=C][Ring2][Ring1][#Branch1][O][C]
|
CHEMBL4283817
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[C][S][C][C][C@H1][Branch1][C][N][C][=Branch1][C][=O][N][C@H1][C][S][S][C][C@@H1][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@@H1][C][S][S][C][C@@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][S][S][C][C@H1][Branch1][#Branch1][N][C][Ring2][Branch1][O][=O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][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][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch2][=N][=Branch2][C][S][S][C][C@H1][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][S][C][N][C][Ring2][#Branch2][Branch2][=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@@H1][Branch1][C][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C@@H1][Branch1][C][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch1][C][C][S][C][C][=Branch1][C][=O][N][C@@H1][Branch1][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@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][Ring2][=C][Branch2][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][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][Ring2][=C][N]
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CHEMBL4283818
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[C][C@H1][C@H1][Branch1][C][C][C][C][C@][Branch1][C][C][C][C][C@][Branch1][C][C][C][=Branch2][Branch1][O][=C][C][=Branch1][C][=O][C@@H1][C@@][Branch1][C][C][C][/C][=Branch1][#Branch1][=C][\C][=Branch1][C][=O][O][C][=Branch1][C][=O][C@][Branch1][C][C][Branch1][#C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Ring2][Ring1][#Branch1][C][C][C@][Ring2][Ring1][O][Ring2][Ring1][P][C][C@H1][Ring2][Ring2][N][Ring2][Ring2][#Branch1]
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CHEMBL4283819
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[C][C][C][N][C][=Branch1][C][=O][O][C@@H1][C][C@H1][Branch2][Branch1][Ring2][O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][Branch1][C][O][C][N][Branch1][#Branch1][C][C][Branch1][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][C@@H1][Ring2][Ring2][Ring2][Ring2][Ring2][Branch2]
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CHEMBL4283906
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[C][C][C][C][N][C][Branch2][Ring1][C][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Ring2]
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CHEMBL4283907
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[N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=N][O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][=C][Ring1][=C]
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CHEMBL4283908
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[C][C][C][C][N][Branch2][Ring2][Branch2][C][=Branch1][C][=O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][Ring1][#Branch2][C][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][O][Ring2][Ring1][S]
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CHEMBL4283909
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[C][C][NH1][N][=C][Branch1][C][N][C][=Ring1][=Branch1][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2]
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CHEMBL4283984
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[O][=C][Branch2][Ring1][=C][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][=C][C][=C][C][=C][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=C][Ring1][S]
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