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Ligand

NameCHEMBL3717795
Molecular formulaC23H26N2O4
IUPAC name2-(1,4-dioxan-2-ylmethoxy)-9-hex-1-ynyl-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
Molecular weight394.471
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.4
SynonymsSCHEMBL15050932
Inchi KeyFYDLWSDXHIOKMI-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H26N2O4/c1-2-3-4-5-6-17-7-8-20-18(13-17)9-10-25-21(20)14-22(24-23(25)26)29-16-19-15-27-11-12-28-19/h7-8,13-14,19H,2-4,9-12,15-16H2,1H3
PubChem CID71616164
ChEMBLCHEMBL3717795
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
524125G-protein coupled receptor 84Q9NQS5GPR84Homo sapiens (Human)396

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