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Ligand

NameCHEMBL185333
Molecular formulaC23H19NO2
IUPAC name[3-[2-(6-methylpyridin-2-yl)ethynyl]phenyl] 3-phenylpropanoate
Molecular weight341.41
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP5.0
SynonymsBDBM50160649
3-Phenyl-propionic acid 3-(6-methyl-pyridin-2-ylethynyl)-phenyl ester
Inchi KeyAMDKVLILRAXWHO-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H19NO2/c1-18-7-5-11-21(24-18)15-13-20-10-6-12-22(17-20)26-23(25)16-14-19-8-3-2-4-9-19/h2-12,17H,14,16H2,1H3
PubChem CID44392440
ChEMBLCHEMBL185333
IUPHARN/A
BindingDB50160649
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
8768Metabotropic glutamate receptor 5P31424Grm5Rattus norvegicus (Rat)1203

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