Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4V0ES
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| Ligand Name |
(2s)-2-Cyclohexyl-2-[2-(2,6-Dimethoxypyridin-3-Yl)-5,6-Difluoro-1h-Benzimidazol-1-Yl]-N-(Trans-4-Hydroxycyclohexyl)acetamide
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| Synonyms |
(2s)-2-Cyclohexyl-2-[2-(2,6-Dimethoxypyridin-3-Yl)-5,6-Difluoro-1h-Benzimidazol-1-Yl]-N-(Trans-4-Hydroxycyclohexyl)acetamide; FXR_31; BDBM225941; 9NA
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| Structure |
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Download2D MOL |
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| Formula |
C28H34F2N4O4
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| Canonical SMILES |
COC1=NC(=C(C=C1)C2=NC3=CC(=C(C=C3N2C(C4CCCCC4)C(=O)NC5CCC(CC5)O)F)F)OC
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| InChI |
1S/C28H34F2N4O4/c1-37-24-13-12-19(28(33-24)38-2)26-32-22-14-20(29)21(30)15-23(22)34(26)25(16-6-4-3-5-7-16)27(36)31-17-8-10-18(35)11-9-17/h12-18,25,35H,3-11H2,1-2H3,(H,31,36)/t17?,18?,25-/m0/s1
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| InChIKey |
JBIUFHDYJMTSIW-KRFIBBNCSA-N
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| PubChem Compound ID | ||||
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