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Ligand

NameSCHEMBL2518446
Molecular formulaC19H18N2O2
IUPAC name3-hydroxy-4,4-dimethyl-1-[5-(2-phenylethynyl)pyridin-2-yl]pyrrolidin-2-one
Molecular weight306.365
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.9
SynonymsUS9315498, 14
AJGDMXXEZHXEQN-UHFFFAOYSA-N
CHEMBL3916737
BDBM222727
(3RS)-3-hydroxy-4,4-dimethyl-1-(5-phenylethynyl-pyridin-2-yl)-pyrrolidin-2-one
Inchi KeyAJGDMXXEZHXEQN-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H18N2O2/c1-19(2)13-21(18(23)17(19)22)16-11-10-15(12-20-16)9-8-14-6-4-3-5-7-14/h3-7,10-12,17,22H,13H2,1-2H3
PubChem CID58464054
ChEMBLCHEMBL3916737
IUPHARN/A
BindingDBN/A
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
536112Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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