chembl_id
stringlengths 7
13
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stringlengths 3
6.7k
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CHEMBL10770
|
[O][=C][O][C][Branch1][O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][I][=N][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch1][Ring1][#Branch2]
|
CHEMBL10771
|
[C][C][C][Branch1][C][O][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Branch1][C][O][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
CHEMBL10772
|
[O][=C][Branch1][C][O][C][C][C][/C][=C][/C][C@H1][C@H1][Branch1][N][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][O][Ring1][N]
|
CHEMBL10854
|
[C][O][C][=C][C][=C][Branch2][Branch1][#Branch2][C][Branch1][C][O][O][C][=Branch1][C][=O][C][Branch2][Ring1][Ring2][C][=C][C][Branch1][Ring1][O][C][=C][C][=Branch1][Ring2][=C][Ring1][Branch2][O][C][O][Ring1][=Branch1][=C][Ring2][Ring1][C][C][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][C][=C][Ring2][Ring2][Branch1][C]
|
CHEMBL10792
|
[C][O][C][=C][C][=C][Branch2][Branch1][Ring1][C][=C][C][=C][Branch2][Ring2][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][Branch2][Ring1][=Branch1][C][C][#C][C][=C][C][=C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][N][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][=N][C][=C][Ring2][Ring2][Ring1]
|
CHEMBL10793
|
[C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][=Branch1][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][C][N][Branch1][=Branch2][C][=N][S][N][=C][Ring1][Branch1][Cl][C][C][Ring1][N]
|
CHEMBL10794
|
[C][O][C][=C][C][=C][Branch2][Ring2][=C][C][Branch1][C][O][O][C][=Branch1][C][=O][C][Branch2][Ring1][Ring2][C][=C][C][Branch1][Ring1][O][C][=C][C][=Branch1][Ring2][=C][Ring1][Branch2][O][C][O][Ring1][=Branch1][=C][Ring2][Ring1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][#C]
|
CHEMBL10869
|
[C][S][C][=Branch1][C][=O][N][C][=C][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][Ring1][O][C][C][=Branch1][C][=O][N][C][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch2][=O]
|
CHEMBL10809
|
[C][O][C][C][#C][C][C][Branch2][Ring1][=C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=C][Ring1][=N][C][=Branch1][C][=O][O]
|
CHEMBL10810
|
[C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=N]
|
CHEMBL10811
|
[C][C][=C][C][Branch1][C][C][=C][Branch2][Branch1][Ring2][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@H1][Branch2][Ring2][Ring1][C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=C][C][=C][C][Branch1][N][N][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][=C][Ring1][=N][C][=C][Ring2][Ring1][Ring1][C][=Branch1][C][=O][O][C][Branch1][C][C][=C][Ring2][Ring2][Ring2]
|
CHEMBL10890
|
[C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@@H1][Branch1][C][O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL10582
|
[C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][C][O][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]
|
CHEMBL10583
|
[C][N][C][C][C][Branch1][#Branch2][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][N]
|
CHEMBL10584
|
[C][C][Branch1][C][C][N][C][C][C][Branch1][#Branch2][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][N]
|
CHEMBL10585
|
[C][=C][Branch1][=Branch2][C][=C][C][=N][N][=C][Ring1][=Branch1][C][C][C][C@H1][Branch1][Branch1][C][C][Ring1][=C][N][Ring1][#Branch1]
|
CHEMBL10586
|
[C][C][N][Branch1][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][Branch1][S][N][C][=Branch1][C][=O][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][C][O][C]
|
CHEMBL10587
|
[C][C][C][C][C][C][C][C][C][C][C][/C][=C][Branch1][C][C][/C][=C][/C][Branch1][C][O][=C][\C][=Branch1][C][=O][C][N][Branch1][C][C][C][Ring1][#Branch1][=O]
|
CHEMBL10855
|
[C][C][=Branch1][C][=O][N][C][C][C][=Branch2][Ring1][N][=C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][C][=C][C][=C][Branch1][C][C][N][=C][Ring1][#Branch1][Ring1][P][C][C][Ring2][Ring1][#Branch1]
|
CHEMBL10857
|
[C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][#C][C][N][C][C][C][Branch1][C][O][C][Ring1][=Branch1]
|
CHEMBL10606
|
[O][=C][Branch1][C][O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][Ring1][N][=O]
|
CHEMBL10607
|
[C][O][C][=C][C][=C][Branch2][Ring2][N][C][Branch1][C][O][O][C][=Branch1][C][=O][C][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][=C][Ring1][S][C][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][=C][Ring2][Ring1][#C]
|
CHEMBL10870
|
[C][C][=C][Branch1][C][O][C][=C][C][=C][Ring1][#Branch1][C][C][C][=C][Branch1][C][C][C][Branch1][C][O][=C][C][Branch1][Ring1][C][O][=C][Ring1][#Branch2][Ring1][=C]
|
CHEMBL10871
|
[C][C][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring2][Branch1][C][=C][C][=C][Branch2][Ring1][=Branch2][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][N]
|
CHEMBL10872
|
[C][C][Branch1][C][C][C@@H1][Branch2][Ring1][=N][C][N][C][C][C@@][Branch1][C][C][Branch1][N][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C@@H1][Branch1][C][C][C][Ring1][#C][N][C][=Branch1][C][=O][C@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Ring1][#Branch2]
|
CHEMBL10873
|
[C][=C][C][N][C][=Branch1][C][=O][C][NH1][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=Ring1][O][N][Branch1][C][C][C][Ring1][P][=O]
|
CHEMBL10630
|
[C][O][C][=C][Branch1][C][Cl][C][Branch1][C][O][=C][Branch1][Ring1][C][=O][C][Branch1][Ring1][O][C][=C][Ring1][N][Cl]
|
CHEMBL10891
|
[C][C][O][C][=C][C][=C][Branch2][Ring1][#Branch1][N][C][=C][Branch1][C][Cl][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][N][=O][C][=C][Ring2][Ring1][Ring2]
|
CHEMBL10892
|
[C][C][/C][=Branch2][Ring1][N][=C][Branch1][=Branch2][\C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][Branch1][#Branch1][O][C][Branch1][C][C][=O][=C][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL10893
|
[O][=C][Branch1][S][/C][=C][/C][Branch1][C][Br][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch1][C][O][C][N][C][Ring1][=Branch1][=O]
|
CHEMBL10646
|
[C][O][C][=C][C][=C][Branch2][Ring2][Branch2][C][=C][C][=C][Branch2][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][Branch1][N][C][C][#C][C][N][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][#Branch1][C][=C][Ring2][Ring1][=N]
|
CHEMBL10647
|
[N][C][C][Branch1][C][F][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL10669
|
[C][C][C][C][C][C][C][C][=C][C][=Branch1][C][=O][C][=C][C][Ring1][#Branch1][Branch1][C][C][C@@][Ring1][N][Branch1][C][Cl][C][Branch1][C][Cl][C][C][Ring2][Ring1][C][Branch1][C][C][C@@][Ring2][Ring1][=Branch1][Branch1][=N][O][C][=Branch1][C][=O][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][C][O]
|
CHEMBL10670
|
[C][C][Branch1][O][C][N][Branch1][Ring2][C][C][O][C][C][O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL10671
|
[C][S][C][=C][C][=C][Branch2][Ring2][Branch2][C][=C][C][=C][Branch2][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][Branch1][N][C][C][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][#Branch1][C][=C][Ring2][Ring1][=N]
|
CHEMBL10672
|
[C][O][C][=C][C][=C][Branch2][Ring2][#Branch1][C][=C][C][=C][Branch2][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][Branch1][N][C][C][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][S][Ring2][Ring1][=Branch1][C][=C][Ring2][Ring1][N]
|
CHEMBL10609
|
[O][=C][Branch1][C][O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][=O]
|
CHEMBL10610
|
[O][=C][O][C][Branch1][=C][N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring2][Ring1][Ring2][Ring1][#Branch1]
|
CHEMBL10611
|
[C][C][C][Branch1][C][O][C][=Branch1][C][=O][O][C][C][=C][Ring1][Branch2][C][=C][N][Branch1][Branch1][C][Ring1][=Branch1][=O][C][C][=C][Ring1][#Branch1][N][=C][C][=C][C][Branch1][Ring2][C][C][#N][=C][C][Ring1][=Branch2][=C][Ring1][=N][C]
|
CHEMBL10612
|
[C][C][N][Branch1][Ring1][C][C][C][C][N][Branch2][Ring1][#C][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][C][=C][Ring1][S][C][=Branch1][C][=O][C][N][C][=C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][=C][Ring1][=Branch2][S][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
CHEMBL10686
|
[C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][C][C][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][O][C][O][Ring1][=Branch2][C][=C][Ring2][Ring1][Ring2]
|
CHEMBL3310065
|
[N][C@@H1][Branch2][Ring1][S][C][C][=C][N][=C][Branch2][Ring1][Branch1][C][C][C][C][C][Branch1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring1][#Branch2][NH1][Ring1][#C][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][Ring1][S][C][C][=C][N][=C][Branch2][Ring1][Branch1][C][C][C][C][C][Branch1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring1][#Branch2][NH1][Ring1][#C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL10631
|
[C][C][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][C][O][Branch1][=Branch2][C][N][C][=N][N][=C][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]
|
CHEMBL10632
|
[O][=C][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][C][Branch1][C][O][Branch1][=Branch2][C][N][C][=N][N][=C][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
CHEMBL10633
|
[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][C][=C][C][Branch1][#Branch2][C][Branch1][C][C][C][=Branch1][C][=O][O][=C][C][=C][Ring1][O][S][Ring2][Ring1][C]
|
CHEMBL10634
|
[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][C][=C][C][Branch1][#Branch2][C][Branch1][C][C][C][=Branch1][C][=O][O][=C][C][=C][Ring1][O][O][Ring2][Ring1][C]
|
CHEMBL1163329
|
[O][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][N][Branch1][Ring2][C][C][O][C][=C][C][=C][C][Ring2][Ring1][C][=C][Ring1][N][Ring1][=Branch1]
|
CHEMBL10704
|
[Br][C][C][N][C][Branch1][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S]
|
CHEMBL10648
|
[C][O][C][=C][C][=C][Branch2][Ring2][Branch2][C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][Ring1][=N][Branch1][C][O][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][=C][Ring2][Ring1][=N]
|
CHEMBL10649
|
[C][C][Branch1][C][C][C@H1][O][C][=Branch1][C][=O][O][C@][Ring1][=Branch1][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]
|
CHEMBL10650
|
[N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O]
|
CHEMBL10651
|
[C][C][C][N][Branch2][Ring1][#Branch1][C][C][N][C][C][N][Branch1][O][C][C][N][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][=C][C][C][Ring2][Ring1][=Branch1]
|
CHEMBL10728
|
[C][C][C][C][=Branch1][C][=O][C][Branch1][C][O][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]
|
CHEMBL10729
|
[N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][O][C][C][C][=Branch1][C][=O][O]
|
CHEMBL10748
|
[O][=C][Branch1][C][O][C][O][C][/C][=C][\C][C@H1][C@H1][Branch2][Ring1][Ring2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][C][Ring1][S][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][O][Ring1][N]
|
CHEMBL10750
|
[O][=C][Branch1][C][O][C][=C][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring2][Ring1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL10752
|
[C][=C][Branch1][C][C][C@@H1][C][C][C@][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][O][C][C][C@][Branch1][C][C][C@H1][Branch2][Ring1][P][C][C][C][C@@][Branch1][C][C][C][C][C@@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][#Branch2][C][C][C@][Ring1][=C][Ring2][Ring1][Ring1][C][C@@H1][Ring2][Ring2][O][Ring2][Ring2][Branch2]
|
CHEMBL10753
|
[C][O][C][=C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][Branch1][C][Cl][C][=C][Ring2][Ring1][Ring1][C][=Branch1][C][=O][O]
|
CHEMBL10754
|
[C][O][C][=C][C][=C][Branch2][Ring1][=Branch1][C][Branch1][Ring1][C][N][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][C][=C][Ring2][Ring1][Ring1][O][C]
|
CHEMBL10755
|
[C][C][Branch1][C][C][C][Branch1][C][O][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][C][Branch1][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
CHEMBL10687
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch2][Ring2][N][C][O][C][C][=C][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch1][C][C][S][C][C][=Branch1][C][=O][O-1][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Branch2][O][Ring2][Ring1][S].[Li+1]
|
CHEMBL10688
|
[C][N][C][C][N][Branch1][#C][C][C][C][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][C][Ring1][S]
|
CHEMBL1163332
|
[C][N][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O].[O][=C][Branch1][C][O][C][=Branch1][C][=O][O]
|
CHEMBL10689
|
[O][=C][C][C][N][Ring1][Ring2][C][O]
|
CHEMBL10690
|
[O][=C][Branch2][Ring2][#Branch1][N][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CHEMBL10773
|
[O][=C][Branch1][C][O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][Ring1][=C]
|
CHEMBL10705
|
[C][O][C][C][N][C][Branch1][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S]
|
CHEMBL10707
|
[C][C][C][C][C][C][=C][C][Branch1][#Branch1][O][C][Branch1][C][C][=O][=C][C][=Branch1][Ring2][=C][Ring1][#Branch2][O][C][Branch1][C][C][Branch1][C][C][C@@H1][C][C][C][Branch1][Branch2][C][O][C][Branch1][C][C][=O][C][C][Ring2][Ring1][C][Ring1][O]
|
CHEMBL10708
|
[C][C][C][Branch1][C][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring2][=C][C][=C][C][=C][Branch2][Ring2][C][C][C@H1][Branch2][Ring1][Branch2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][Branch1][C][C][C][=C][Ring1][Branch2][C][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][Branch2][=C][Ring2][Ring1][=C]
|
CHEMBL10795
|
[C][C][Branch1][C][C][C][C][Branch1][C][O][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
CHEMBL10731
|
[C][N+1][Branch1][C][C][C][C][O][C][Branch1][C][O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=C]
|
CHEMBL10732
|
[C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][C@@][Branch1][S][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][S][Ring1][=Branch1][C][Branch1][C][C][C][C][C][C][C][C][=C][C][=Branch1][C][=O][C][=C][C][Ring1][#Branch1][Branch1][C][C][C@@][Ring1][N][Branch1][C][Cl][C][Branch1][C][Cl][C][C][Ring2][Ring1][C][Ring2][Ring1][#C][C]
|
CHEMBL10812
|
[C][S][C][C][C@H1][Branch2][Branch1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][O][C][O][C][C][=C][C][=C][Branch1][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][F][=C][Ring1][Branch2][O][Ring1][=N][C][=C][Ring2][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][O-1].[Li+1]
|
CHEMBL10833
|
[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][C][=C][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][=C][C][=C][Ring1][#Branch2][O][Ring1][P]
|
CHEMBL10834
|
[C][O][C][=C][C][=C][Branch2][Ring2][Branch2][C][Branch1][C][O][O][C][=Branch1][C][=O][C][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][=C][Ring1][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][#C]
|
CHEMBL10835
|
[O][=C][Branch1][S][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2]
|
CHEMBL10836
|
[O][=C][Branch1][C][O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Branch2][Ring1][#Branch2][C][C][=Branch1][C][=O][N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][#Branch1]
|
CHEMBL10837
|
[C][C][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring1][=C][C][=C][C][=C][Branch2][Ring1][Ring1][C][C@H1][Branch1][#Branch2][N][S][Branch1][C][C][=Branch1][C][=O][=O][C][=Branch1][C][=O][O][C][=C][Ring1][S][=C][Ring2][Ring1][=Branch1]
|
CHEMBL10775
|
[C][O][C][=C][C][Branch2][Ring2][Ring1][C@@H1][C][NH1][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][C][=Ring1][=N][C][C@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][Ring2][Ring1][Branch1][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][=N][O]
|
CHEMBL10776
|
[C][C][C][C][C][=Branch1][C][=O][C][Branch1][C][O][Branch1][=Branch2][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]
|
CHEMBL10777
|
[C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@@H1][Branch1][C][O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][O][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][N][S][Branch1][C][C][=Branch1][C][=O][=O]
|
CHEMBL3310067
|
[C][O][N][C][=Branch1][C][=O][C@H1][Branch1][S][C][C][=C][N][=C][Branch1][=Branch1][C][Branch1][C][C][C][NH1][Ring1][Branch2][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][S][C][C][=C][N][=C][Branch1][=Branch1][C][Branch1][C][C][C][NH1][Ring1][Branch2][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]
|
CHEMBL10796
|
[C][O][C][=N][S][N][=C][Ring1][Branch1][N][C][C][N][Branch2][Ring1][=C][C][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][=Branch1][C][C][Ring2][Ring1][=Branch2]
|
CHEMBL10797
|
[O][C][C][C][C][C][N][Branch1][S][C][C][C][N][C][C][C][C][Branch1][Ring1][C][O][C][Ring1][Branch2][C][Ring1][P]
|
CHEMBL10798
|
[O][=C][Branch1][C][O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=N]
|
CHEMBL10800
|
[C][C][C][C@@H1][C][C][C][=C][Branch1][C][C][N][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][N][N][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][C][=Ring2][Ring1][Branch1][N][C][Ring2][Ring1][=Branch2][=O]
|
CHEMBL10814
|
[C][O][C][=C][C][=C][Branch2][Ring1][S][C][C][N][C][C][Branch1][C][O][C][O][C][=C][C][=C][Branch1][N][C][=N][C][Branch1][Ring1][C][O][=C][NH1][Ring1][#Branch1][C][=C][Ring1][=N][C][=C][Ring2][Ring1][O][O][C]
|
CHEMBL10815
|
[C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][#Branch2][C][Ring1][=C][=O]
|
CHEMBL10816
|
[C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][C][Branch1][C][O][C][O][Ring1][#Branch1]
|
CHEMBL10894
|
[C][C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][Ring1][O][C]
|
CHEMBL10895
|
[C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=N][C][C][=Branch1][C][=O][N][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][=Ring1][#Branch2][NH1][Ring1][=N][C][=C][Ring2][Ring1][Ring1]
|
CHEMBL11158
|
[C][S][C][=C][N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][Ring1][=N][=C][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][=Branch2]
|
CHEMBL11159
|
[C][C][=Branch1][C][=O][N][C][C][C][=Branch2][Ring1][N][=C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][C][=C][C][Branch1][C][Cl][=C][N][=C][Ring1][#Branch1][Ring1][P][C][C][Ring2][Ring1][#Branch1]
|
CHEMBL11160
|
[O][=C][Branch1][C][O][C@H1][C][S][C][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][=N][Ring1][=N]
|
CHEMBL11161
|
[C][C][=C][C][=C][C][Branch2][Ring2][=Branch1][N][C][C][N][Branch2][Ring1][#Branch2][C][C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][=Branch2][=N][Ring2][Ring1][#C].[O][=C][Branch1][C][O][C][=Branch1][C][=O][O]
|
CHEMBL3310135
|
[O][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][O][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Ring1][N][C][=C][C][=N][C][=C][Ring1][=Branch1]
|
CHEMBL11092
|
[C][O][C][=C][C][=C][Branch2][Ring1][S][C][C][N][C][C][Branch1][C][O][C][O][C][=C][C][=C][Branch1][O][C][=N][C][Branch1][C][Br][=C][NH1][Ring1][=Branch1][C][=C][Ring1][N][Cl][C][=C][Ring2][Ring1][O][O][C]
|
CHEMBL11093
|
[C][C][O][C][C][=C][NH1][C][Branch2][Ring2][#Branch1][C][=C][C][=C][Branch2][Ring1][O][O][C][C][Branch1][C][O][C][N][C][C][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][C][=C][Ring2][Ring1][Branch2][=N][Ring2][Ring1][=N]
|
CHEMBL11094
|
[C][O][C][=C][C][Branch1][#C][C][C][Branch1][C][C][N][Branch1][C][C][C][Branch1][C][C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][S][I]
|
CHEMBL11095
|
[C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][#C][C][N][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][Ring1][=Branch2]
|
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