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Ligand

NameCHEMBL3718718
Molecular formulaC27H23N3O5
IUPAC name2-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-2-ylmethoxy)-9-(2-methoxyphenyl)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
Molecular weight469.497
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.9
SynonymsSCHEMBL15825887
Inchi KeyBLMJCZYOVGFZLV-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H23N3O5/c1-32-23-6-3-2-5-21(23)17-8-9-20-18(13-17)10-12-30-22(20)14-25(29-27(30)31)33-15-19-16-34-26-24(35-19)7-4-11-28-26/h2-9,11,13-14,19H,10,12,15-16H2,1H3
PubChem CID76684901
ChEMBLCHEMBL3718718
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
522371G-protein coupled receptor 84Q9NQS5GPR84Homo sapiens (Human)396

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