chembl_id
stringlengths 7
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stringlengths 3
6.7k
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CHEMBL16656
|
[O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl]
|
CHEMBL16657
|
[C][C][C][N][Branch1][Ring2][C][C][C][C][C][C][=C][C][Branch1][C][O][=C][C][Branch1][C][O][=C][Ring1][Branch2][C][Ring1][O]
|
CHEMBL16658
|
[C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C@@H1][Ring2][Ring1][=Branch2][O]
|
CHEMBL16505
|
[C][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][C@@H1][Branch1][C][O][C][S][C][Branch1][C][C][Branch1][C][C][C]
|
CHEMBL16583
|
[C][N][Branch1][C][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][N][=C][N][Ring1][Branch1][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring1][#Branch2][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][Ring2][Ring1][Branch1]
|
CHEMBL16584
|
[O][=C][C][=C][Branch2][Ring1][=Branch2][O][C][Branch1][C][O][=C][Ring1][#Branch1][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1][C][C][C][C][C][C][Ring2][Ring1][=Branch1]
|
CHEMBL16585
|
[C][C][C][C][=Branch1][C][=O][N][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL16342
|
[O][=C][Branch1][C][O][C@@H1][C][C@H1][C][C@@H1][Branch1][#C][C][C][=C][S][C][=Ring1][Branch1][C][N][=N][NH1][N][=Ring1][Branch1][C][C][C@H1][Ring1][S][C][N][Ring2][Ring1][Ring2]
|
CHEMBL16064
|
[O][=C][C][=C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Branch1][C][Cl][O][Ring1][=C]
|
CHEMBL16065
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][C][C@@H1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][O][=C][Ring1][P]
|
CHEMBL3309431
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][S][C][=C][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O][C][=Branch1][C][=O][O][C]
|
CHEMBL16627
|
[O][=C][C][=C][Branch2][Branch1][C][O][C][Branch1][C][O][=C][Ring1][#Branch1][C][Branch2][Ring1][P][C][=C][C][=C][C][Branch2][Ring1][Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=C][Ring2][Ring1][C][C][C][C][Ring1][Ring1][C][C][C][C][C][C][Ring2][Ring2][C]
|
CHEMBL16628
|
[C][C][=C][Branch1][=N][S][C][=C][C][=C][C][Branch1][C][I][=C][Ring1][#Branch1][N][Branch1][=Branch1][C][O][C][C][O][C][=Branch1][C][=O][NH1][C][Ring2][Ring1][Ring2][=O]
|
CHEMBL16629
|
[C][O][C][=C][C][=C][Branch2][Branch1][Ring2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring1][S][C][Branch2][Ring1][#Branch1][C][=C][Branch1][C][O][C][=C][Branch1][=Branch1][O][C][Ring1][#Branch1][=O][C][C][C][C][C][C][Ring1][O][C][C][C][Ring1][Ring1][=C][Ring2][Ring1][Branch2][C][=C][Ring2][Ring2][C]
|
CHEMBL16742
|
[N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][C][S][S][C][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][N][C][Ring2][Ring1][Ring2][=O]
|
CHEMBL16743
|
[C][N][Branch1][Ring1][C][=O][C@H1][C][C][C][C][C][C][C@H1][N][C][=Branch1][C][=O][C][C][C@][Ring1][#Branch1][Branch1][C][C][C][Ring1][N][C][C][C@@][Ring1][S][Ring2][Ring1][Ring1][C]
|
CHEMBL16744
|
[C][C][=C][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][C][=Branch1][C][=O][O][C][Branch1][C][O][=C][Ring2][Ring1][Ring2]
|
CHEMBL16745
|
[C][C][S][C][=C][C][=C][Branch2][Branch1][#Branch2][C][N][C][C][C][=C][Branch2][Ring2][=N][C][=Branch1][C][=O][N][Branch1][P][C][C][N][Branch1][C][C][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring2][Ring1][Ring2][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][Ring2][Ring1][P][C][=C][Ring2][Ring2][Branch2]
|
CHEMBL16747
|
[C][C@H1][Branch2][Ring1][#Branch2][N][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][C][=C][C][=C][C][=C][Ring1][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL1784105
|
[C][C][=C][C][Branch1][C][O][=N][C][O][C][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][Branch1][C][N][C][Ring2][Ring1][Ring2][=Ring1][#C]
|
CHEMBL16681
|
[N][C][=N][C][=Branch1][C][=O][C][N][=C][Branch2][Ring2][C][C][C][=C][C][=C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][C][C][O][C][Ring2][Ring1][=Branch2][N][Ring2][Ring1][=C]
|
CHEMBL16682
|
[O][=C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][C][C][=C][NH1][C][=N][Ring1][Branch1]
|
CHEMBL16767
|
[N][#C][C][=C][C][=C][Branch2][Ring1][Branch2][O][C][C][=Branch1][C][=O][N][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch1]
|
CHEMBL16769
|
[N][C][C][O].[O][=C][Branch1][C][O][C][=Branch1][C][=O][N][C][=N][C][Branch1][#C][C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2][=C][S][Ring1][=N]
|
CHEMBL16770
|
[C][O][C][=C][C][Branch1][Ring1][O][C][=C][C][Branch2][Ring1][Ring2][C][=C][S][C][Branch1][O][N][C][=Branch1][C][=O][C][=Branch1][C][=O][O][=N][Ring1][O][=C][Ring2][Ring1][Ring1]
|
CHEMBL16067
|
[C][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][Ring1][#C][=O]
|
CHEMBL16068
|
[Br][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL16069
|
[O][=C][C][=C][Branch2][Branch1][#Branch2][O][C][Branch1][C][O][=C][Ring1][#Branch1][C][Branch2][Ring2][=Branch2][C][=C][C][=C][C][Branch2][Ring1][=N][N][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][Branch2][C][C][C][Ring1][Ring1][C][C][C][C][C][C][Ring2][Ring2][Branch2]
|
CHEMBL16162
|
[C][C][=C][Branch1][#C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][Ring2][Ring1][Branch2]
|
CHEMBL16163
|
[C][C@H1][Branch2][Ring1][Ring2][N][C@@H1][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#Branch2][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Ring1][N][C][=Branch1][C][=O][O]
|
CHEMBL16164
|
[C][C][=C][N][=C][C][=N][C][=N][C][Ring1][=Branch1][=N][Ring1][#Branch2]
|
CHEMBL3309472
|
[N][C][=N][C][=C][C][Branch2][Ring2][N][O][C][=C][C][=C][Branch2][Ring1][=C][N][C][=C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][C][Ring1][P][=O][C][=C][Ring2][Ring1][Branch2][F][=C][Ring2][Ring1][S][Cl]
|
CHEMBL4543458
|
[C][S][C][S][C][Branch1][Branch2][C][C][=C][O][N][=Ring1][Branch1][=C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][C][=Ring1][#C][C][#N]
|
CHEMBL4543459
|
[O][=C][Branch2][Ring1][Ring2][C][N][C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][N][C][=C][C][=N][N][Ring1][Branch1][C][C][C][C][C][Ring1][Branch1]
|
CHEMBL4543460
|
[C][N][C][=Branch1][C][=O][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][C][=C][C][Branch2][Ring1][O][N][C][=Branch1][C][=O][O][C][C][C][Ring1][#Branch1][C][=C][C][=C][Branch1][=Branch1][B][Branch1][C][O][O][C][=C][Ring1][=Branch2][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=C][Ring2][Ring2][Ring1][Ring2][Ring1][=Branch2]
|
CHEMBL4543461
|
[C][C][=C][C][=C][Branch2][Ring2][=C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][S][C][C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2][O][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2][C][=C][Ring2][Ring1][P]
|
CHEMBL4543462
|
[O][C][Branch2][Ring1][=Branch2][C][#C][C][Branch1][C][O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL16726
|
[O][=C][Branch1][C][O][C][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][I][C][=C][Ring1][#Branch1]
|
CHEMBL16727
|
[C][C][=C][Branch1][O][N][C][C][C@H1][Branch1][C][N][C][Ring1][=Branch1][C][Branch1][C][F][=C][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][Ring2][Ring1][Branch2][Ring1][=N]
|
CHEMBL16728
|
[C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][=O][C][Branch1][C][N][=C][Ring1][#Branch2][C][=Branch1][C][=O][O][Ring1][S]
|
CHEMBL16729
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring2][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][Ring1][=N][=O][C][=Branch1][C][=O][O]
|
CHEMBL16730
|
[O][=C][C][=C][Branch1][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][O][C][=C][C][=C][C][=C][Ring2][Ring1][C][Ring1][=Branch1]
|
CHEMBL16474
|
[C][C][C][C][C][C][C][C][Branch1][#Branch1][C][=Branch1][C][=O][C][S][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][C]
|
CHEMBL16475
|
[C][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][C][S][S][C][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][Ring2][Ring1][#Branch2][=O]
|
CHEMBL16476
|
[C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2]
|
CHEMBL16477
|
[N][#C][C][C][N][N][=C][Branch2][Ring1][Branch2][C][=C][C][=C][Branch1][=C][O][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=C][Ring1][#C][O][C][Ring2][Ring1][Ring2][=O]
|
CHEMBL16478
|
[C][O][C][=C][C][=C][C][=Branch1][C][=O][C][=C][Branch1][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][O][C][Ring1][#C][=C][Ring2][Ring1][Ring1]
|
CHEMBL16479
|
[O][=C][Branch1][C][O][C][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1]
|
CHEMBL16560
|
[C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][Ring2][C][=C][S][C][Branch1][O][N][C][=Branch1][C][=O][C][Branch1][C][N][=O][=N][Ring1][O][C][=C][Ring1][P]
|
CHEMBL16771
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][=N][C][O][C][=C][C][=C][Branch1][P][C][=N][N][Branch1][Branch1][C][C][C][#N][C][=Branch1][C][=O][O][Ring1][#Branch2][C][=C][Ring1][S][=C][Ring2][Ring1][Branch2]
|
CHEMBL16772
|
[C][N][C][C][N][Branch2][Ring1][Branch2][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][Ring1][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][Ring2][Ring1][#Branch1]
|
CHEMBL16499
|
[O][=C][Branch2][Ring1][C][N][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][C][Ring1][Branch1]
|
CHEMBL16500
|
[O][=C][C][=C][Branch1][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][O][C][=C][C][Branch1][C][O][=C][C][=C][Ring2][Ring1][Ring1][Ring1][#Branch1]
|
CHEMBL16501
|
[O][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][O][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL16502
|
[C][C][Branch1][C][C][Branch1][C][C][O]
|
CHEMBL16503
|
[O][=C][Branch1][C][O][C][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O]
|
CHEMBL16165
|
[C][C][C][C][C][=N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Ring1][N][C][C][=C][C][=C][Branch2][Ring1][C][O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][P]
|
CHEMBL16166
|
[C][C@H1][Branch1][Ring1][C][S][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=N][S][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C@H1][Ring1][=N][C][=Branch1][C][=O][O]
|
CHEMBL16252
|
[C][C][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][S][C][=Branch1][C][=O][N][C][C][C][C][C][N][Ring1][Branch1][C][C][=C][Ring2][Ring1][Branch1][O][C]
|
CHEMBL3309432
|
[C][O][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][S][C][=C][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O][C][Branch1][C][C][C]
|
CHEMBL4543534
|
[C][C][O][N][=C][C][C][C][Branch2][Branch1][Ring2][C][N][C][C][N][Branch2][Ring2][Ring2][C][=N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=N][S][Ring2][Ring1][C][C@H1][Branch1][C][C][C][Ring2][Ring1][=Branch2][C][C][Ring2][Ring1][S]
|
CHEMBL4543535
|
[C][C][C][C][C][C][=C][C][=C][Branch2][Branch1][=Branch2][C][=Branch1][C][=O][N][Branch2][Ring1][S][C][C][=C][C][=C][Branch2][Ring1][Ring1][N][C][=C][C][Branch1][C][C][=N][C][=C][C][=C][C][=C][Ring1][O][Ring1][=Branch1][C][=C][Ring2][Ring1][C][C][C][C][N][Branch1][Branch2][C][C][C][Branch1][C][C][C][C][C][Ring1][O][C][=C][Ring2][Ring2][#Branch1]
|
CHEMBL4543536
|
[C][O][C][C][N][C][C][C][=Branch1][C][=O][N][C][S][C][=C][Branch2][Ring1][N][C][=Ring1][Branch1][C][=N][C][=C][C][Branch1][#Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][C][=C][Ring1][=N][S][Ring1][S][C][C][N][C][Ring2][Ring1][#Branch1]
|
CHEMBL4543537
|
[C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][C][Ring1][=Branch1][C][Ring1][=Branch2][C][=N][N][Ring1][S][C][=N][N][C][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][NH1][Ring1][#Branch2]
|
CHEMBL4543538
|
[O][=C][Branch2][Ring1][Ring2][N][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][N][C][C][=N][N][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Ring1][N][C][Branch1][C][F][Branch1][C][F][F]
|
CHEMBL16731
|
[O][=C][Branch1][C][O][C][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
|
CHEMBL16453
|
[C][C][=C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Branch1][C][O][N][Branch1][C][O][C][Ring1][#C][=C][Ring2][Ring1][Ring1][=N][O][Ring2][Ring1][O]
|
CHEMBL16455
|
[C][#C][C][=C][C][=C][Branch2][Ring1][C][N][C][C@H1][Branch1][Branch2][C][N][C][Branch1][C][C][=O][O][C][Ring1][#Branch2][=O][C][Branch1][C][F][=C][Ring2][Ring1][C]
|
CHEMBL16456
|
[C][N][C][=Branch1][C][=O][C][C][C][=C][Ring1][#Branch1][C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring1][O]
|
CHEMBL16561
|
[C][C][O][C][=C][C][=C][Branch2][Ring1][Ring2][C][=C][S][C][Branch1][O][N][C][=Branch1][C][=O][C][=Branch1][C][=O][O][=N][Ring1][O][C][=C][Ring1][P].[N][C][C][O]
|
CHEMBL16562
|
[C][C][O][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][=N][C][Branch1][=C][C][=C][C][=C][Branch1][Ring2][O][C][C][C][=C][Ring1][=Branch2][=C][S][Ring1][=C]
|
CHEMBL16563
|
[C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][P][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][=O][C][=C][Ring1][=Branch2][F][C][=Branch1][C][=O][O][Ring1][S]
|
CHEMBL16564
|
[O][=C][C][=C][Branch2][Ring2][N][O][C][Branch1][C][O][=C][Ring1][#Branch1][C][Branch2][Ring1][O][C][=C][C][=C][C][Branch1][P][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][C][C][C][Ring1][=Branch1][=C][Ring1][S][C][C][C][Ring1][Ring1][C][C][C][C][C][C][Ring2][Ring1][S]
|
CHEMBL16659
|
[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch1][O][C][=N][N][=C][Branch1][C][S][S][Ring1][=Branch1][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][S][O]
|
CHEMBL16582
|
[C][C][C][C][C][C][C][C][C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1]
|
CHEMBL16678
|
[N][#C][/N][=C][\N][Branch2][Ring1][Ring1][C][C][C][C][C][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring2][Ring1][#Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1]
|
CHEMBL16679
|
[N][=C][Branch1][C][N][N][C][C][C][C@@H1][N][C][=Branch1][C][=O][N][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][N][=O]
|
CHEMBL16254
|
[O][=C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring2][Ring1][Ring2][Ring1][N]
|
CHEMBL16255
|
[C][=C][C][N][C][=Branch1][C][=O][N][C@H1][C][C][C@@][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Branch2]
|
CHEMBL16343
|
[C][C][O][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][=N][C][Branch2][Ring1][#Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][O][=C][S][Ring2][Ring1][Ring1]
|
CHEMBL16344
|
[C][C][C][C][C][C][C][C][/C][=C][\C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C]
|
CHEMBL3309469
|
[N][C][=N][C][=C][C][Branch2][Ring2][#Branch2][O][C][=C][C][=C][Branch2][Ring1][N][N][C][=C][C][=C][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring1][S][=O][C][=C][Ring2][Ring1][#Branch1][F][=C][Ring2][Ring1][#C][Cl]
|
CHEMBL16457
|
[O][=C][N][Branch1][C][O][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][O]
|
CHEMBL16541
|
[N][#C][C][C][N][N][=C][Branch2][Ring1][Branch1][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][O][C][C][Ring2][Ring1][Ring2][=S]
|
CHEMBL16542
|
[C][C][Branch1][C][C][Branch1][S][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL16543
|
[C][O][C][=C][C][=C][C][O][C][Branch1][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][C][=Branch1][C][=O][C][Ring2][Ring1][Ring1][=Ring1][#C]
|
CHEMBL1163491
|
[N][=C][Branch1][C][N][N][C][C@H1][O][C@@H1][Branch2][Ring1][=N][O][C][C@H1][O][C@@H1][Branch1][=C][C][N][C][=C][C][=Branch1][C][=O][NH1][C][Ring1][#Branch1][=O][C@@H1][Branch1][C][O][C@@H1][Ring1][#C][O][C@H1][Branch1][C][O][C@@H1][Ring2][Ring1][Branch2][O]
|
CHEMBL16544
|
[N][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][O][C][=N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][C][=C][Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Branch2]
|
CHEMBL16660
|
[C][O][C][=C][C][=C][Branch2][Ring1][=N][C][O][C][=C][C][=C][Branch1][P][C][=N][N][Branch1][Branch1][C][C][C][#N][C][=Branch1][C][=O][O][Ring1][#Branch2][C][=C][Ring1][S][C][=C][Ring2][Ring1][Branch2]
|
CHEMBL16663
|
[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][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][Branch2][C][=C][C][=N+1][Ring1][=Branch1][C][=C][Ring1][O]
|
CHEMBL16664
|
[C][C][C][C][C][C][C][C][Branch1][#Branch1][C][=Branch1][C][=O][C][S][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Branch2][C][C][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][C]
|
CHEMBL16406
|
[O][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch1][C][O][N][Branch1][C][O][C][=C][C][Branch1][S][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][=C][C][=C][Ring2][Ring1][Ring2][Ring1][#C]
|
CHEMBL16407
|
[O][=C][Branch1][#Branch2][N][C][C][C][C][C][C][Ring1][Branch1][O][C][C][C][C][=C][NH1][C][=N][Ring1][Branch1]
|
CHEMBL4543383
|
[C][C][C][=N][C][Branch2][Ring1][C][C][N][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][S][Ring1][S]
|
CHEMBL4543384
|
[C][C][C][C][N][C][=C][Branch2][Ring1][#Branch2][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][N][C][C][N][C][C][Ring1][=Branch1][C][Branch1][C][Cl][=C][Ring1][#C][N][C][=N][C][=C][Ring1][Branch1][C][Ring2][Ring1][Branch2][=O]
|
CHEMBL4543385
|
[C][C@][C][C][C@@][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Branch1][Ring2][O][Ring1][#C][C@H1][C][=C][C@H1][Branch1][=C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][Ring1][=C][Ring2][Ring1][=N]
|
CHEMBL4543386
|
[C][N][Branch1][C][C][C][/C][=C][/C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Branch1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][S][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][C][C][Ring2][Ring1][=Branch2][=C][Ring2][Ring2][C].[O][=C][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F]
|
CHEMBL16409
|
[C][C][C][N][Branch1][Ring2][C][C][C][C][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][Ring1][#Branch2]
|
CHEMBL16410
|
[C][C][C][N][Branch1][Ring2][C][C][C][C][C][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][#Branch2][C][Ring1][=N]
|
CHEMBL16346
|
[C][C][S][C][Branch1][O][N][C][=Branch1][C][=O][C][=Branch1][C][=O][O][=N][C][=Ring1][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1]
|
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