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Ligand

NameCHEMBL2398481
Molecular formulaC12H16N8O
IUPAC name1-[6-amino-9-methyl-8-(triazol-2-yl)purin-2-yl]butan-2-ol
Molecular weight288.315
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP0.6
SynonymsN/A
Inchi KeyAHNTZNKPFIDJQY-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H16N8O/c1-3-7(21)6-8-16-10(13)9-11(17-8)19(2)12(18-9)20-14-4-5-15-20/h4-5,7,21H,3,6H2,1-2H3,(H2,13,16,17)
PubChem CID71745501
ChEMBLCHEMBL2398481
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5721Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412

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