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Ligand

NameCHEMBL396031
Molecular formulaC27H34FN3O2
IUPAC name2-cyclohexyl-N-[1-[3-(2-fluoropyridin-3-yl)propanoyl]piperidin-4-yl]-2-phenylacetamide
Molecular weight451.586
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.2
SynonymsBDBM50423088
Inchi KeyCJZFPYIBTMCQPN-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H34FN3O2/c28-26-22(12-7-17-29-26)13-14-24(32)31-18-15-23(16-19-31)30-27(33)25(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1,3-4,7-9,12,17,21,23,25H,2,5-6,10-11,13-16,18-19H2,(H,30,33)
PubChem CID44430554
ChEMBLCHEMBL396031
IUPHARN/A
BindingDB50423088
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
43841C3a anaphylatoxin chemotactic receptorQ16581C3AR1Homo sapiens (Human)482

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