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Ligand

NameCHEMBL3714952
Molecular formulaC24H23FN2O4
IUPAC name9-[(4-fluorophenyl)methoxy]-2-(oxolan-2-ylmethoxy)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
Molecular weight422.456
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.5
SynonymsSCHEMBL15825809
Inchi KeyCEVGGJKJTXISSK-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H23FN2O4/c25-18-5-3-16(4-6-18)14-30-19-7-8-21-17(12-19)9-10-27-22(21)13-23(26-24(27)28)31-15-20-2-1-11-29-20/h3-8,12-13,20H,1-2,9-11,14-15H2
PubChem CID76684763
ChEMBLCHEMBL3714952
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
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GLASS IDNameUniProtGeneSpeciesLength
522740G-protein coupled receptor 84Q9NQS5GPR84Homo sapiens (Human)396

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