Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BCR80K
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| Binder Name |
Benzyl (2S,3S)-1-((R)-3-(benzylsulfonyl)-1-((S)-1-((S,E)-5-methyl-1-(methylsulfonyl)hex-1-en-3-ylamino)-1-oxopropan-2-ylamino)-1-oxopropan-2-ylamino)-3-methyl-1-oxopentan-2-ylcarbamate
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| Synonyms |
CHEMBL377123; BDBM50186723
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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 |
C35H50N4O9S2
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| Canonical SMILES |
CC[C@H](C)[C@@H](C(=O)N[C@@H](CS(=O)(=O)CC1=CC=CC=C1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)/C=C/S(=O)(=O)C)NC(=O)OCC2=CC=CC=C2
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| InChI |
1S/C35H50N4O9S2/c1-7-25(4)31(39-35(43)48-21-27-14-10-8-11-15-27)34(42)38-30(23-50(46,47)22-28-16-12-9-13-17-28)33(41)36-26(5)32(40)37-29(20-24(2)3)18-19-49(6,44)45/h8-19,24-26,29-31H,7,20-23H2,1-6H3,(H,36,41)(H,37,40)(H,38,42)(H,39,43)/b19-18+/t25-,26-,29+,30-,31-/m0/s1
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| InChIKey |
SKRPUDBVEVKBAT-WEBJDVROSA-N
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| PubChem Compound ID | ||||
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