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Ligand

NameCHEMBL163247
Molecular formulaC22H19Cl2N3O2
IUPAC name7,9-dichloro-3-[2-(3,4-dihydro-1H-[1]benzofuro[3,2-c]pyridin-2-yl)ethyl]-2-methylpyrido[1,2-a]pyrimidin-4-one
Molecular weight428.313
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.0
SynonymsBDBM50403739
2-Methyl-3-[2-(1,2,3,4-tetrahydrobenzofuro[3,2-c]pyridine-2-yl)ethyl]-7,9-dichloro-4H-pyrido[1,2-a]pyrimidine-4-one
Inchi KeyAKZOIEBLVQLVTR-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H19Cl2N3O2/c1-13-15(22(28)27-11-14(23)10-18(24)21(27)25-13)6-8-26-9-7-20-17(12-26)16-4-2-3-5-19(16)29-20/h2-5,10-11H,6-9,12H2,1H3
PubChem CID44376993
ChEMBLCHEMBL163247
IUPHARN/A
BindingDB50403739
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
8052Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
8055Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
8053Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
8054Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462

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