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Ligand

NameCHEMBL252531
Molecular formulaC18H17N3O
IUPAC name2-[benzyl(methyl)amino]-5-oxo-7,8-dihydro-6H-quinoline-3-carbonitrile
Molecular weight291.354
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP2.7
SynonymsSCHEMBL4421527
2-(benzyl-methyl-amino)-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile
BDBM50231745
Inchi KeyCUWTUWWWGLIZDH-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H17N3O/c1-21(12-13-6-3-2-4-7-13)18-14(11-19)10-15-16(20-18)8-5-9-17(15)22/h2-4,6-7,10H,5,8-9,12H2,1H3
PubChem CID24777578
ChEMBLCHEMBL252531
IUPHARN/A
BindingDB50231745
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
51217Metabotropic glutamate receptor 1P23385Grm1Rattus norvegicus (Rat)1199
51218Metabotropic glutamate receptor 5P31424Grm5Rattus norvegicus (Rat)1203

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