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Ligand

NameCHEMBL3718012
Molecular formulaC21H21N3O6
IUPAC name2-(1,4-dioxan-2-ylmethoxy)-9-(1,3-oxazol-2-ylmethoxy)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
Molecular weight411.414
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP1.0
SynonymsSCHEMBL15051618
Inchi KeyFUKDWBZBOLZEPO-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H21N3O6/c25-21-23-19(30-12-16-11-26-7-8-27-16)10-18-17-2-1-15(9-14(17)3-5-24(18)21)29-13-20-22-4-6-28-20/h1-2,4,6,9-10,16H,3,5,7-8,11-13H2
PubChem CID71616973
ChEMBLCHEMBL3718012
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
524059G-protein coupled receptor 84Q9NQS5GPR84Homo sapiens (Human)396

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