Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B4A0SE
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| Binder Name |
4-(2-{2-[2-(4-Carboxy-2-isobutoxycarbonylamino-butyrylamino)-4-methyl-pentanoylamino]-4,4-difluoro-butyrylamino}-ethyl)-3-chloro-benzoic acid
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| Synonyms |
CHEMBL326818; BDBM50122891
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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 |
C29H41ClF2N4O9
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| Canonical SMILES |
CC(C)C[C@@H](C(=O)NC(CC(F)F)C(=O)NCCC1=C(C=C(C=C1)C(=O)O)Cl)NC(=O)C(CCC(=O)O)NC(=O)OCC(C)C
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| InChI |
1S/C29H41ClF2N4O9/c1-15(2)11-21(34-26(40)20(7-8-24(37)38)36-29(44)45-14-16(3)4)27(41)35-22(13-23(31)32)25(39)33-10-9-17-5-6-18(28(42)43)12-19(17)30/h5-6,12,15-16,20-23H,7-11,13-14H2,1-4H3,(H,33,39)(H,34,40)(H,35,41)(H,36,44)(H,37,38)(H,42,43)/t20?,21-,22?/m0/s1
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| InChIKey |
YXLKUMXBZZUGHU-ORFBVSJDSA-N
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| PubChem Compound ID | ||||
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