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Ligand

NameCHEMBL3718482
Molecular formulaC23H19N5O4
IUPAC name2-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-2-ylmethoxy)-9-(1H-pyrazol-4-yl)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
Molecular weight429.436
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.2
SynonymsSCHEMBL15826023
Inchi KeyFTLBTSGOJLLTEL-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H19N5O4/c29-23-27-21(30-12-17-13-31-22-20(32-17)2-1-6-24-22)9-19-18-4-3-14(16-10-25-26-11-16)8-15(18)5-7-28(19)23/h1-4,6,8-11,17H,5,7,12-13H2,(H,25,26)
PubChem CID90242259
ChEMBLCHEMBL3718482
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
524039G-protein coupled receptor 84Q9NQS5GPR84Homo sapiens (Human)396

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