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Ligand

NameCHEMBL25303
Molecular formulaC8H10N4O3
IUPAC name1-(2-hydroxyethyl)-3-methyl-7H-purine-2,6-dione
Molecular weight210.193
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP-0.7
Synonyms1-(2-Hydroxy-ethyl)-3-methyl-3,7-dihydro-purine-2,6-dione
AC1O4ZVL
1-(2-hydroxyethyl)-3-methyl-7H-purine-2,6-dione
BDBM50025572
SXRDFSLBAAYEPE-UHFFFAOYSA-N
Inchi KeySXRDFSLBAAYEPE-UHFFFAOYSA-N
Inchi IDInChI=1S/C8H10N4O3/c1-11-6-5(9-4-10-6)7(14)12(2-3-13)8(11)15/h4,13H,2-3H2,1H3,(H,9,10)
PubChem CID6424576
ChEMBLCHEMBL25303
IUPHARN/A
BindingDB50025572
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
325799Adenosine receptor A1P25099Adora1Rattus norvegicus (Rat)326
325800Adenosine receptor A2aP46616ADORA2ACavia porcellus (Guinea pig)409

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