Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BW85AO
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| Binder Name |
5-{(S)-2-((S)-1-Carbamoyl-3-methyl-butylcarbamoyl)-2-[(S)-4-carboxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)-butyrylamino]-ethyl}-2-carboxymethoxy-benzoic acid
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| Synonyms |
CHEMBL431992; BDBM50131096
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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 |
C38H42N4O12
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| Canonical SMILES |
CC(C)C[C@@H](C(=O)N)NC(=O)[C@H](CC1=CC(=C(C=C1)OCC(=O)O)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
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| InChI |
1S/C38H42N4O12/c1-20(2)15-29(34(39)47)40-36(49)30(17-21-11-13-31(53-19-33(45)46)26(16-21)37(50)51)41-35(48)28(12-14-32(43)44)42-38(52)54-18-27-24-9-5-3-7-22(24)23-8-4-6-10-25(23)27/h3-11,13,16,20,27-30H,12,14-15,17-19H2,1-2H3,(H2,39,47)(H,40,49)(H,41,48)(H,42,52)(H,43,44)(H,45,46)(H,50,51)/t28-,29-,30-/m0/s1
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| InChIKey |
LPBSXLOIMPVMCG-DTXPUJKBSA-N
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| PubChem Compound ID | ||||
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