Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B9FIL0
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| Binder Name |
(2S)-N-[(3S,4S)-7-Cyano-1-[[1-(2-cyanophenyl)indazol-3-yl]methyl]-4-methyl-5-(2-methylsulfonylacetyl)-2-oxo-3,4-dihydro-1,5-benzodiazepin-3-yl]-2-(methylamino)propanamide
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| Synonyms |
CHEMBL3960618; SCHEMBL15629530; BDBM242824; US9422331, 53
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL |
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| Formula |
C33H32N8O5S
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| Canonical SMILES |
C[C@H]1[C@@H](C(=O)N(C2=C(N1C(=O)CS(=O)(=O)C)C=C(C=C2)C#N)CC3=NN(C4=CC=CC=C43)C5=CC=CC=C5C#N)NC(=O)[C@H](C)NC
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| InChI |
1S/C33H32N8O5S/c1-20(36-3)32(43)37-31-21(2)40(30(42)19-47(4,45)46)29-15-22(16-34)13-14-28(29)39(33(31)44)18-25-24-10-6-8-12-27(24)41(38-25)26-11-7-5-9-23(26)17-35/h5-15,20-21,31,36H,18-19H2,1-4H3,(H,37,43)/t20-,21-,31-/m0/s1
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| InChIKey |
VKAPUENCVUDUAS-IHPVIADISA-N
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| PubChem Compound ID | ||||
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