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Ligand

NameCHEMBL2204439
Molecular formulaC21H21NO3
IUPAC name(3-hydroxypiperidin-1-yl)-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]methanone
Molecular weight335.403
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.2
SynonymsBDBM50401088
VU0459808-1
Inchi KeyHHMDBQHJJWKOJO-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H21NO3/c1-25-20-12-8-17(9-13-20)5-4-16-6-10-18(11-7-16)21(24)22-14-2-3-19(23)15-22/h6-13,19,23H,2-3,14-15H2,1H3
PubChem CID53393854
ChEMBLCHEMBL2204439
IUPHARN/A
BindingDB50401088
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
115054Metabotropic glutamate receptor 2P31421Grm2Rattus norvegicus (Rat)872
115053Metabotropic glutamate receptor 3P31422Grm3Rattus norvegicus (Rat)879
115055Metabotropic glutamate receptor 3Q14832GRM3Homo sapiens (Human)879

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