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Ligand

NameCHEMBL3717805
Molecular formulaC26H27N3O6
IUPAC name2-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-2-ylmethoxy)-9-(oxan-2-ylmethoxy)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
Molecular weight477.517
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP3.0
SynonymsSCHEMBL15826098
Inchi KeyGSXUEMWYKVVFRW-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H27N3O6/c30-26-28-24(33-15-20-16-34-25-23(35-20)5-3-9-27-25)13-22-21-7-6-18(12-17(21)8-10-29(22)26)32-14-19-4-1-2-11-31-19/h3,5-7,9,12-13,19-20H,1-2,4,8,10-11,14-16H2
PubChem CID90242313
ChEMBLCHEMBL3717805
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
524565G-protein coupled receptor 84Q9NQS5GPR84Homo sapiens (Human)396

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