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Ligand

NameCHEMBL28684
Molecular formulaC12H17N5O3
IUPAC name3-(1-methyl-2,6-dioxo-3-propylpurin-7-yl)propanamide
Molecular weight279.3
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP-0.8
Synonyms3-(1-Methyl-2,6-dioxo-3-propyl-1,2,3,6-tetrahydro-purin-7-yl)-propionamide
BDBM50047251
3-[(1-Methyl-3-propyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin)-7-yl]propanamide
Inchi KeyGCVNXDOEXKIURX-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H17N5O3/c1-3-5-17-10-9(11(19)15(2)12(17)20)16(7-14-10)6-4-8(13)18/h7H,3-6H2,1-2H3,(H2,13,18)
PubChem CID10107643
ChEMBLCHEMBL28684
IUPHARN/A
BindingDB50047251
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
93308Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326

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