Binder Information
Binder General Information | Top | |||
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Binder ID |
BF31GU
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Binder Name |
5-(4-{[(S)-1-(2-Tert-Butoxycarbonylamino-4-carboxy-butyryl)-pyrrolidine-2-carbonyl]-amino}-2,2-difluoro-3-oxo-5-phenyl-pentanoylamino)-thiophene-3-carboxylic acid
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Synonyms |
CHEMBL355132; BDBM50068917
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C31H36F2N4O10S
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Canonical SMILES |
CC(C)(C)OC(=O)NC(CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)NC(CC2=CC=CC=C2)C(=O)C(C(=O)NC3=CC(=CS3)C(=O)O)(F)F
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InChI |
1S/C31H36F2N4O10S/c1-30(2,3)47-29(46)35-19(11-12-23(38)39)26(42)37-13-7-10-21(37)25(41)34-20(14-17-8-5-4-6-9-17)24(40)31(32,33)28(45)36-22-15-18(16-48-22)27(43)44/h4-6,8-9,15-16,19-21H,7,10-14H2,1-3H3,(H,34,41)(H,35,46)(H,36,45)(H,38,39)(H,43,44)/t19?,20?,21-/m0/s1
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InChIKey |
FTHKDFFLXQKSKJ-CBNMVNINSA-N
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PubChem Compound ID |
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