Binder Information
Binder General Information | Top | |||
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Binder ID |
BD39JV
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Binder Name |
(2S)-1-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Acetamido-3-methylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]propanoyl]amino]acetyl]-N-[(2S,3S)-1-(benzhydrylamino)-3-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide
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Synonyms |
CHEMBL1790325; BDBM50369807
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C42H57N9O7
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Canonical SMILES |
CC[C@H](C)[C@@H](C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)NC(=O)[C@@H]3CCCN3C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC4=CN=CN4)NC(=O)[C@H](C(C)C)NC(=O)C
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InChI |
1S/C42H57N9O7/c1-7-26(4)36(42(58)50-37(29-15-10-8-11-16-29)30-17-12-9-13-18-30)49-40(56)33-19-14-20-51(33)34(53)23-44-38(54)27(5)46-39(55)32(21-31-22-43-24-45-31)48-41(57)35(25(2)3)47-28(6)52/h8-13,15-18,22,24-27,32-33,35-37H,7,14,19-21,23H2,1-6H3,(H,43,45)(H,44,54)(H,46,55)(H,47,52)(H,48,57)(H,49,56)(H,50,58)/t26-,27-,32-,33-,35-,36-/m0/s1
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InChIKey |
HOFFUBRNVIEKLB-YVIQSYOBSA-N
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PubChem Compound ID |
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