Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BXAF36
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| Binder Name |
(2S,3S)-N-[(2R)-1-(3-Chloro-4-methylanilino)-1-oxo-3-phenylpropan-2-yl]-3-methyl-2-[(3-nitrophenyl)carbamothioylamino]pentanamide
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| Synonyms |
CHEMBL4096708; BDBM50234632
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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 |
C29H32ClN5O4S
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| Canonical SMILES |
CC[C@H](C)[C@@H](C(=O)N[C@H](CC1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)C)Cl)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]
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| InChI |
1S/C29H32ClN5O4S/c1-4-18(2)26(34-29(40)32-21-11-8-12-23(16-21)35(38)39)28(37)33-25(15-20-9-6-5-7-10-20)27(36)31-22-14-13-19(3)24(30)17-22/h5-14,16-18,25-26H,4,15H2,1-3H3,(H,31,36)(H,33,37)(H2,32,34,40)/t18-,25+,26-/m0/s1
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| InChIKey |
HRPIFMFUVQUNRV-IMDCKVJKSA-N
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| PubChem Compound ID | ||||
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