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Ligand

NameCHEMBL27155
Molecular formulaC17H20N4O3
IUPAC name8-(4-hydroxyphenyl)-1,3-dipropyl-7H-purine-2,6-dione
Molecular weight328.372
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.0
Synonyms94781-76-7
SCHEMBL1948455
8-(4-Hydroxy-phenyl)-1,3-dipropyl-3,9-dihydro-purine-2,6-dione
PDSP1_001134
BDBM50227340
[ Show all ]
Inchi KeyGLDYYZLOHBXJBU-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H20N4O3/c1-3-9-20-15-13(16(23)21(10-4-2)17(20)24)18-14(19-15)11-5-7-12(22)8-6-11/h5-8,22H,3-4,9-10H2,1-2H3,(H,18,19)
PubChem CID135433923
ChEMBLCHEMBL27155
IUPHARN/A
BindingDB82010
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
560395Adenosine receptor A1P25099Adora1Rattus norvegicus (Rat)326
560397Adenosine receptor A1P28190ADORA1Bos taurus (Bovine)326
560394Adenosine receptor A2aP46616ADORA2ACavia porcellus (Guinea pig)409
560396Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412

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