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Ligand

NameCHEMBL604223
Molecular formulaC16H25N5O5
IUPAC name(3S,4R,5S)-2-[6-amino-2-(4-methylpentoxy)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Molecular weight367.406
Hydrogen bond acceptor9
Hydrogen bond donor4
XlogP1.3
SynonymsBDBM50368263
Inchi KeyFFVMJGITPVUYTE-PHOHYCPASA-N
Inchi IDInChI=1S/C16H25N5O5/c1-8(2)4-3-5-25-16-19-13(17)10-14(20-16)21(7-18-10)15-12(24)11(23)9(6-22)26-15/h7-9,11-12,15,22-24H,3-6H2,1-2H3,(H2,17,19,20)/t9-,11-,12-,15?/m0/s1
PubChem CID46874431
ChEMBLCHEMBL604223
IUPHARN/A
BindingDB50368263
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
77443Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326

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