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Ligand

NameCHEMBL275793
Molecular formulaC17H14N4O2
IUPAC name1,3-dimethyl-8-naphthalen-2-yl-7H-purine-2,6-dione
Molecular weight306.325
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.4
Synonyms1,3-Dimethyl-8-naphthalen-2-yl-3,7-dihydro-purine-2,6-dione
1,3-Dimethyl-8-(2-naphthyl)xanthine
BDBM50021007
Inchi KeyCYJBMSTXLBXFAZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H14N4O2/c1-20-15-13(16(22)21(2)17(20)23)18-14(19-15)12-8-7-10-5-3-4-6-11(10)9-12/h3-9H,1-2H3,(H,18,19)
PubChem CID11779897
ChEMBLCHEMBL275793
IUPHARN/A
BindingDB50021007
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
53557Adenosine receptor A1P28190ADORA1Bos taurus (Bovine)326

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