Binder Information
Binder General Information | Top | |||
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Binder ID |
BTID28
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Binder Name |
5-[3-[[Cyclopropyl-[(3R,4S)-4-[4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl]piperidine-3-carbonyl]amino]methyl]-5-(3-methoxypropyl)phenoxy]-2,2-dimethylpentanoic acid
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Synonyms |
CHEMBL1761533; BDBM50340417
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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 |
C42H54Cl2N2O7
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Canonical SMILES |
CC1=CC(=C(C(=C1)Cl)OCCOC2=CC=C(C=C2)[C@H]3CCNC[C@@H]3C(=O)N(CC4=CC(=CC(=C4)CCCOC)OCCCC(C)(C)C(=O)O)C5CC5)Cl
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InChI |
1S/C42H54Cl2N2O7/c1-28-21-37(43)39(38(44)22-28)53-20-19-52-33-12-8-31(9-13-33)35-14-16-45-26-36(35)40(47)46(32-10-11-32)27-30-23-29(7-5-17-50-4)24-34(25-30)51-18-6-15-42(2,3)41(48)49/h8-9,12-13,21-25,32,35-36,45H,5-7,10-11,14-20,26-27H2,1-4H3,(H,48,49)/t35-,36+/m1/s1
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InChIKey |
NASKVDWGYKOGBO-XDSPJLLDSA-N
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PubChem Compound ID |
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