Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L12EAG
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| Ligand Name |
{(3r,5r,6s)-5-(3-Chlorophenyl)-6-(4-Chlorophenyl)-1-[(1s)-1-Cyclopropyl-2-(Pyrrolidin-1-Ylsulfonyl)ethyl]-3-Methyl-2-Oxopiperidin-3-Yl}acetic Acid
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| Synonyms |
CHEMBL3125521; {(3r,5r,6s)-5-(3-Chlorophenyl)-6-(4-Chlorophenyl)-1-[(1s)-1-Cyclopropyl-2-(Pyrrolidin-1-Ylsulfonyl)ethyl]-3-Methyl-2-Oxopiperidin-3-Yl}acetic Acid; SCHEMBL9992731; BDBM50448945; Q27453558; 35T
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| Structure |
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Download2D MOL |
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| Formula |
C29H34Cl2N2O5S
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| Canonical SMILES |
CC1(CC(C(N(C1=O)C(CS(=O)(=O)N2CCCC2)C3CC3)C4=CC=C(C=C4)Cl)C5=CC(=CC=C5)Cl)CC(=O)O
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| InChI |
1S/C29H34Cl2N2O5S/c1-29(17-26(34)35)16-24(21-5-4-6-23(31)15-21)27(20-9-11-22(30)12-10-20)33(28(29)36)25(19-7-8-19)18-39(37,38)32-13-2-3-14-32/h4-6,9-12,15,19,24-25,27H,2-3,7-8,13-14,16-18H2,1H3,(H,34,35)/t24-,25-,27-,29-/m1/s1
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| InChIKey |
JHVUPAFRBHMUAB-GCMXZSHTSA-N
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| PubChem Compound ID | ||||
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