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Ligand

NameCHEMBL606510
Molecular formulaC13H19N5O5
IUPAC name(3S,4R,5S)-2-(6-amino-2-propoxypurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Molecular weight325.325
Hydrogen bond acceptor9
Hydrogen bond donor4
XlogP0.1
SynonymsBDBM50368260
Inchi KeyBOHZYKDFAJFENY-JASHMJCASA-N
Inchi IDInChI=1S/C13H19N5O5/c1-2-3-22-13-16-10(14)7-11(17-13)18(5-15-7)12-9(21)8(20)6(4-19)23-12/h5-6,8-9,12,19-21H,2-4H2,1H3,(H2,14,16,17)/t6-,8-,9-,12?/m0/s1
PubChem CID46874373
ChEMBLCHEMBL606510
IUPHARN/A
BindingDB50368260
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
28820Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326

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