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Ligand

NameCHEMBL233675
Molecular formulaC27H34ClN3O2
IUPAC name2-(4-chlorophenyl)-2-cyclohexyl-N-[1-(3-pyridin-3-ylpropanoyl)piperidin-4-yl]acetamide
Molecular weight468.038
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.4
SynonymsBDBM50423084
Inchi KeyMVZBPBBWVBYVKZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H34ClN3O2/c28-23-11-9-22(10-12-23)26(21-6-2-1-3-7-21)27(33)30-24-14-17-31(18-15-24)25(32)13-8-20-5-4-16-29-19-20/h4-5,9-12,16,19,21,24,26H,1-3,6-8,13-15,17-18H2,(H,30,33)
PubChem CID44430541
ChEMBLCHEMBL233675
IUPHARN/A
BindingDB50423084
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
215618C3a anaphylatoxin chemotactic receptorQ16581C3AR1Homo sapiens (Human)482

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