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Ligand

NameCHEMBL357346
Molecular formulaC16H24N4O3
IUPAC name8-cyclopentyl-3-(ethoxymethyl)-1-propyl-7H-purine-2,6-dione
Molecular weight320.393
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.4
SynonymsBDBM50062855
8-Cyclopentyl-3-ethoxymethyl-1-propyl-3,7-dihydro-purine-2,6-dione
Inchi KeyCKVKIGDVMJKZCT-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H24N4O3/c1-3-9-19-15(21)12-14(20(16(19)22)10-23-4-2)18-13(17-12)11-7-5-6-8-11/h11H,3-10H2,1-2H3,(H,17,18)
PubChem CID44368334
ChEMBLCHEMBL357346
IUPHARN/A
BindingDB50062855
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
44450Adenosine receptor A1P28190ADORA1Bos taurus (Bovine)326

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