Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LE98SF
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| Ligand Name |
Vimirogant
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| Synonyms |
Vimirogant; 1802706-04-2; (S)-N-((5-(ethylsulfonyl)pyridin-2-yl)methyl)-7-isopropyl-6-(((1r,4S)-4-(trifluoromethyl)cyclohexyl)methyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide; Vimirogant [INN]; Q4D8POE1IP; (7S)-N-((5-(Ethylsulfonyl)pyridin-2-yl)methyl)-7-isopropyl-6-(((trans)-4-(trifluoromethyl)cyclohexyl)methyl)-6,7-dihydro-5H-pyrrolo(3,4-b)pyridine-3-carboxamide; (S)-N-((5-(ethylsulfonyl)pyridin-2-yl)methyl)-7-isopropyl-6-((trans-4-(trifluoromethyl)cyclohexyl)methyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide; 5H-Pyrrolo(3,4-b)pyridine-3-carboxamide, N-((5-(ethylsulfonyl)-2-pyridinyl)methyl)-6,7-dihydro-7-(1-methylethyl)-6-((trans-4-(trifluoromethyl)cyclohexyl)methyl)-, (7S)-; UNII-Q4D8POE1IP; ROR; A-IN-1; CHEMBL4172726; SCHEMBL16968647; SCHEMBL16968648; SCHEMBL17538566; US10399976, Compound 2; BDBM412666; ZINC521838134; CS-7819; CS-W000519; HY-103637; A16935; (7S)-N-[(5-ethylsulfonylpyridin-2-yl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)cyclohexyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide; 98N
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| Structure |
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Download2D MOL |
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| Formula |
C27H35F3N4O3S
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| Canonical SMILES |
CCS(=O)(=O)C1=CN=C(C=C1)CNC(=O)C2=CC3=C(C(N(C3)CC4CCC(CC4)C(F)(F)F)C(C)C)N=C2
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| InChI |
1S/C27H35F3N4O3S/c1-4-38(36,37)23-10-9-22(31-14-23)13-33-26(35)19-11-20-16-34(25(17(2)3)24(20)32-12-19)15-18-5-7-21(8-6-18)27(28,29)30/h9-12,14,17-18,21,25H,4-8,13,15-16H2,1-3H3,(H,33,35)/t18?,21?,25-/m0/s1
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| InChIKey |
XUYMIRYNRKXKOR-JUWHTYBZSA-N
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| PubChem Compound ID | ||||
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