Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B8SDZ1
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| Binder Name |
Methyl (E,4S)-4-[[2-[(3R)-3-[[4-chloro-2-(trifluoromethyl)phenyl]carbamoyloxymethyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetyl]amino]-6-methylhept-2-enoate
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| Synonyms |
CHEMBL1171803; BDBM50322341
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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 |
C35H34ClF3N4O6
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| Canonical SMILES |
CC(C)C[C@@H](/C=C/C(=O)OC)NC(=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=CC=C4
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| InChI |
1S/C35H34ClF3N4O6/c1-21(2)17-24(14-16-31(45)48-3)40-30(44)19-43-29-12-8-7-11-25(29)32(22-9-5-4-6-10-22)41-28(33(43)46)20-49-34(47)42-27-15-13-23(36)18-26(27)35(37,38)39/h4-16,18,21,24,28H,17,19-20H2,1-3H3,(H,40,44)(H,42,47)/b16-14+/t24-,28-/m1/s1
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| InChIKey |
MWWJVCKMVKBUFV-CMSSCCRCSA-N
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| PubChem Compound ID | ||||
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