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Ligand

NameCHEMBL337001
Molecular formulaC10H14N4O2
IUPAC name7-ethyl-3-propylpurine-2,6-dione
Molecular weight222.248
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP0.4
Synonyms1H-Purine-2,6-dione, 7-ethyl-3,7-dihydro-3-propyl-
7-Ethyl-3-propyl-3,7-dihydro-purine-2,6-dione
3-Propyl-7-ethylxanthine
BDBM50001492
135462-20-3
Inchi KeyBYOGTVLYVWFFPC-UHFFFAOYSA-N
Inchi IDInChI=1S/C10H14N4O2/c1-3-5-14-8-7(9(15)12-10(14)16)13(4-2)6-11-8/h6H,3-5H2,1-2H3,(H,12,15,16)
PubChem CID10376254
ChEMBLCHEMBL337001
IUPHARN/A
BindingDB50001492
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
35941Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326
35942Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412

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