Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LE6PW7
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| Ligand Name |
1-Cyclopentyl-N-[(2s,3r)-3-Hydroxy-1-Phenyl-4-{[3-(Trifluoromethyl)benzyl]amino}butan-2-Yl]-6-Oxo-5-(2-Oxopyrrolidin-1-Yl)-1,6-Dihydropyridine-3-Carboxamide
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| Synonyms |
CHEMBL2407494; 1-Cyclopentyl-N-[(2s,3r)-3-Hydroxy-1-Phenyl-4-{[3-(Trifluoromethyl)benzyl]amino}butan-2-Yl]-6-Oxo-5-(2-Oxopyrrolidin-1-Yl)-1,6-Dihydropyridine-3-Carboxamide; BDBM50437556; Q27452359; 1QU
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| Structure |
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Download2D MOL |
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| Formula |
C33H37F3N4O4
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| Canonical SMILES |
C1CCC(C1)N2C=C(C=C(C2=O)N3CCCC3=O)C(=O)NC(CC4=CC=CC=C4)C(CNCC5=CC(=CC=C5)C(F)(F)F)O
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| InChI |
1S/C33H37F3N4O4/c34-33(35,36)25-11-6-10-23(16-25)19-37-20-29(41)27(17-22-8-2-1-3-9-22)38-31(43)24-18-28(39-15-7-14-30(39)42)32(44)40(21-24)26-12-4-5-13-26/h1-3,6,8-11,16,18,21,26-27,29,37,41H,4-5,7,12-15,17,19-20H2,(H,38,43)/t27-,29+/m0/s1
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| InChIKey |
QKLJNYJRYSKKKP-LMSSTIIKSA-N
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| PubChem Compound ID | ||||
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