Binder Information
Binder General Information | Top | |||
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Binder ID |
B1YN9J
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Binder Name |
2-[3-[(1R)-1-[(2S)-1-(1-Benzothiophen-2-ylsulfonyl)piperidine-2-carbonyl]oxy-3-(3,4-dimethoxyphenyl)propyl]phenoxy]acetic acid
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Synonyms |
CHEMBL2058226; SCHEMBL15069778; BDBM50388275
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL |
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Formula |
C33H35NO9S2
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Canonical SMILES |
COC1=C(C=C(C=C1)CC[C@H](C2=CC(=CC=C2)OCC(=O)O)OC(=O)[C@@H]3CCCCN3S(=O)(=O)C4=CC5=CC=CC=C5S4)OC
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InChI |
1S/C33H35NO9S2/c1-40-28-16-14-22(18-29(28)41-2)13-15-27(23-9-7-10-25(19-23)42-21-31(35)36)43-33(37)26-11-5-6-17-34(26)45(38,39)32-20-24-8-3-4-12-30(24)44-32/h3-4,7-10,12,14,16,18-20,26-27H,5-6,11,13,15,17,21H2,1-2H3,(H,35,36)/t26-,27+/m0/s1
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InChIKey |
WWHNQKFQSNLMJV-RRPNLBNLSA-N
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PubChem Compound ID |
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