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Ligand

NameCHEMBL396262
Molecular formulaC28H35FN2O2
IUPAC name2-cyclohexyl-N-[1-[3-(2-fluorophenyl)propanoyl]piperidin-4-yl]-2-phenylacetamide
Molecular weight450.598
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP6.0
SynonymsBDBM50423080
Inchi KeyFFBSHMPPTOAKJD-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H35FN2O2/c29-25-14-8-7-9-21(25)15-16-26(32)31-19-17-24(18-20-31)30-28(33)27(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1,3-4,7-11,14,23-24,27H,2,5-6,12-13,15-20H2,(H,30,33)
PubChem CID44430558
ChEMBLCHEMBL396262
IUPHARN/A
BindingDB50423080
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
76848C3a anaphylatoxin chemotactic receptorQ16581C3AR1Homo sapiens (Human)482

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