Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B96BFN
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| Binder Name |
(2S)-2-[[(2S)-2-Amino-3-phenylpropanoyl]amino]-N-[(1R,2S)-3-cyclohexyl-1-hydroxy-1-(1,3-thiazol-2-yl)propan-2-yl]-4-methylpentanamide
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| Synonyms |
CHEMBL67412; BDBM50039009
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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 |
C27H40N4O3S
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| Canonical SMILES |
CC(C)C[C@@H](C(=O)N[C@@H](CC1CCCCC1)[C@H](C2=NC=CS2)O)NC(=O)[C@H](CC3=CC=CC=C3)N
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| InChI |
1S/C27H40N4O3S/c1-18(2)15-23(31-25(33)21(28)16-19-9-5-3-6-10-19)26(34)30-22(17-20-11-7-4-8-12-20)24(32)27-29-13-14-35-27/h3,5-6,9-10,13-14,18,20-24,32H,4,7-8,11-12,15-17,28H2,1-2H3,(H,30,34)(H,31,33)/t21-,22-,23-,24+/m0/s1
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| InChIKey |
XRDBUUNOOLWBAO-NEWJYFPISA-N
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| PubChem Compound ID | ||||
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