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Ligand

NameCHEMBL3717904
Molecular formulaC24H21N3O3
IUPAC name4-[4-oxo-2-(oxolan-2-ylmethoxy)-6,7-dihydropyrimido[6,1-a]isoquinolin-9-yl]benzonitrile
Molecular weight399.45
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.3
SynonymsSCHEMBL15825696
Inchi KeyBENLELSSEPLPQR-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H21N3O3/c25-14-16-3-5-17(6-4-16)18-7-8-21-19(12-18)9-10-27-22(21)13-23(26-24(27)28)30-15-20-2-1-11-29-20/h3-8,12-13,20H,1-2,9-11,15H2
PubChem CID90242017
ChEMBLCHEMBL3717904
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
522098G-protein coupled receptor 84Q9NQS5GPR84Homo sapiens (Human)396

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