Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BM8N4U
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| Binder Name |
Methyl (E)-4-[[2-[(3R)-5-(4-bromophenyl)-3-[[4-chloro-2-(trifluoromethyl)phenyl]carbamoyloxymethyl]-2-oxo-3H-1,4-benzodiazepin-1-yl]acetyl]amino]but-2-enoate
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| Synonyms |
CHEMBL1171633; BDBM50322343
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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 |
C31H25BrClF3N4O6
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| Canonical SMILES |
COC(=O)/C=C/CNC(=O)CN1C2=CC=CC=C2C(=N[C@@H](C1=O)COC(=O)NC3=C(C=C(C=C3)Cl)C(F)(F)F)C4=CC=C(C=C4)Br
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| InChI |
1S/C31H25BrClF3N4O6/c1-45-27(42)7-4-14-37-26(41)16-40-25-6-3-2-5-21(25)28(18-8-10-19(32)11-9-18)38-24(29(40)43)17-46-30(44)39-23-13-12-20(33)15-22(23)31(34,35)36/h2-13,15,24H,14,16-17H2,1H3,(H,37,41)(H,39,44)/b7-4+/t24-/m1/s1
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| InChIKey |
KHWXFDGUCDQAID-PTGVWUEVSA-N
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| PubChem Compound ID | ||||
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