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Ligand

NameCHEMBL234731
Molecular formulaC28H33FN2O2
IUPAC name2-cyclohexyl-N-[1-[(E)-3-(2-fluorophenyl)prop-2-enoyl]piperidin-4-yl]-2-phenylacetamide
Molecular weight448.582
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP6.1
SynonymsBDBM50423082
Inchi KeyFKHZOLZMEFNZBC-FOCLMDBBSA-N
Inchi IDInChI=1S/C28H33FN2O2/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/h1,3-4,7-11,14-16,23-24,27H,2,5-6,12-13,17-20H2,(H,30,33)/b16-15+
PubChem CID44430560
ChEMBLCHEMBL234731
IUPHARN/A
BindingDB50423082
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
80472C3a anaphylatoxin chemotactic receptorQ16581C3AR1Homo sapiens (Human)482

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