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Ligand

NameCHEMBL574352
Molecular formulaC13H12N4O
IUPAC name5-methyl-2-(3-methylphenyl)-6H-pyrazolo[4,3-d]pyrimidin-7-one
Molecular weight240.266
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP1.4
Synonyms5-methyl-2-m-tolyl-2H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
BDBM50300685
Inchi KeyAHVDFDGMOOCNRJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H12N4O/c1-8-4-3-5-10(6-8)17-7-11-12(16-17)13(18)15-9(2)14-11/h3-7H,1-2H3,(H,14,15,18)
PubChem CID135911562
ChEMBLCHEMBL574352
IUPHARN/A
BindingDB50300685
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: 4
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GLASS IDNameUniProtGeneSpeciesLength
5906Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
5905Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
5907Adenosine receptor A2bP29275ADORA2BHomo sapiens (Human)332
5904Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318

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