Binder Information
Binder General Information | Top | |||
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Binder ID |
B8HX3O
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Binder Name |
3-[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-dimethylpropanoic acid
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Synonyms |
CHEMBL1761531; BDBM50340415
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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 |
C40H50Cl2N2O7
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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)OCC(C)(C)C(=O)O)C5CC5)Cl
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InChI |
1S/C40H50Cl2N2O7/c1-26-18-35(41)37(36(42)19-26)50-17-16-49-31-11-7-29(8-12-31)33-13-14-43-23-34(33)38(45)44(30-9-10-30)24-28-20-27(6-5-15-48-4)21-32(22-28)51-25-40(2,3)39(46)47/h7-8,11-12,18-22,30,33-34,43H,5-6,9-10,13-17,23-25H2,1-4H3,(H,46,47)/t33-,34+/m1/s1
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InChIKey |
KVNPGGYBLPCJSE-NOCHOARKSA-N
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PubChem Compound ID |
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