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Ligand

NameCHEMBL176320
Molecular formulaC15H22N4O2
IUPAC name8-(cyclopropylmethyl)-1,3-dipropyl-7H-purine-2,6-dione
Molecular weight290.367
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.7
Synonyms8-Cyclopropylmethyl-1,3-dipropyl-3,7-dihydro-purine-2,6-dione
1,3-Dipropyl-8-cyclopropylmethylxanthine
BDBM50005381
Inchi KeyFDKJUHWDJCKHFD-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H22N4O2/c1-3-7-18-13-12(14(20)19(8-4-2)15(18)21)16-11(17-13)9-10-5-6-10/h10H,3-9H2,1-2H3,(H,16,17)
PubChem CID15750282
ChEMBLCHEMBL176320
IUPHARN/A
BindingDB50005381
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
75655Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326

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