Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L70DHW
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| Ligand Name |
6-{[(3r,5r,6s)-1-[(1s)-2-(Tert-Butylsulfonyl)-1-Cyclopropylethyl]-5-(3-Chlorophenyl)-6-(4-Chlorophenyl)-3-Methyl-2-Oxopiperidin-3-Yl]methyl}pyridine-3-Carboxylic Acid
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| Synonyms |
CHEMBL3236356; 6-{[(3r,5r,6s)-1-[(1s)-2-(Tert-Butylsulfonyl)-1-Cyclopropylethyl]-5-(3-Chlorophenyl)-6-(4-Chlorophenyl)-3-Methyl-2-Oxopiperidin-3-Yl]methyl}pyridine-3-Carboxylic Acid; 4ogn; BDBM50008749; Q27453280; 2U5
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| Structure |
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Download2D MOL |
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| Formula |
C34H38Cl2N2O5S
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| Canonical SMILES |
CC1(CC(C(N(C1=O)C(CS(=O)(=O)C(C)(C)C)C2CC2)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)Cl)CC5=NC=C(C=C5)C(=O)O
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| InChI |
1S/C34H38Cl2N2O5S/c1-33(2,3)44(42,43)20-29(21-8-9-21)38-30(22-10-13-25(35)14-11-22)28(23-6-5-7-26(36)16-23)18-34(4,32(38)41)17-27-15-12-24(19-37-27)31(39)40/h5-7,10-16,19,21,28-30H,8-9,17-18,20H2,1-4H3,(H,39,40)/t28-,29-,30-,34+/m1/s1
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| InChIKey |
PNBIDSMJDDJULQ-JCUDBWTNSA-N
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| PubChem Compound ID | ||||
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