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Ligand

NameCHEMBL252941
Molecular formulaC21H21N3O
IUPAC name2-(2,3-dihydro-1H-inden-2-ylamino)-7,7-dimethyl-5-oxo-6,8-dihydroquinoline-3-carbonitrile
Molecular weight331.419
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.5
SynonymsBDBM50231735
SCHEMBL4433327
2-(indan-2-ylamino)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Inchi KeyDBPDEKJWCOJTEQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H21N3O/c1-21(2)10-18-17(19(25)11-21)9-15(12-22)20(24-18)23-16-7-13-5-3-4-6-14(13)8-16/h3-6,9,16H,7-8,10-11H2,1-2H3,(H,23,24)
PubChem CID24777694
ChEMBLCHEMBL252941
IUPHARN/A
BindingDB50231735
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
55888Metabotropic glutamate receptor 1P23385Grm1Rattus norvegicus (Rat)1199

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