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Ligand

NameCHEMBL27969
Molecular formulaC12H16N4O3
IUPAC name1-methyl-7-(2-oxopropyl)-3-propylpurine-2,6-dione
Molecular weight264.285
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP0.3
Synonyms139093-27-9
DTXSID90440077
ACMC-20myhy
1H-Purine-2,6-dione, 3,7-dihydro-1-methyl-7-(2-oxopropyl)-3-propyl-
XT-136
[ Show all ]
Inchi KeyCZVWOWZGTGEKDQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H16N4O3/c1-4-5-16-10-9(11(18)14(3)12(16)19)15(7-13-10)6-8(2)17/h7H,4-6H2,1-3H3
PubChem CID10445504
ChEMBLCHEMBL27969
IUPHARN/A
BindingDB50047225
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
54714Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326

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