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Ligand

NameCHEMBL321507
Molecular formulaC19H26N4O2
IUPAC name1-methyl-3-(2-methylpropyl)-8-(3-tricyclo[3.3.1.03,7]nonanyl)-7H-purine-2,6-dione
Molecular weight342.443
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.5
Synonyms8-(Hexahydro-2,5-methano-pentalen-3a-yl)-3-isobutyl-1-methyl-3,7-dihydro-purine-2,6-dione
BDBM50004588
SCHEMBL7279878
Inchi KeyFVGRCQWVXKAUCG-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H26N4O2/c1-10(2)9-23-15-14(16(24)22(3)18(23)25)20-17(21-15)19-7-11-4-12(8-19)6-13(19)5-11/h10-13H,4-9H2,1-3H3,(H,20,21)
PubChem CID15667106
ChEMBLCHEMBL321507
IUPHARN/A
BindingDB50004588
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
88126Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326

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