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Ligand

NameCHEMBL605672
Molecular formulaC16H17N5O5
IUPAC name(3S,4R,5S)-2-(6-amino-2-phenoxypurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Molecular weight359.342
Hydrogen bond acceptor9
Hydrogen bond donor4
XlogP0.8
SynonymsBDBM50406498
Inchi KeyGCHOQLCPANZXCE-PHOHYCPASA-N
Inchi IDInChI=1S/C16H17N5O5/c17-13-10-14(20-16(19-13)25-8-4-2-1-3-5-8)21(7-18-10)15-12(24)11(23)9(6-22)26-15/h1-5,7,9,11-12,15,22-24H,6H2,(H2,17,19,20)/t9-,11-,12-,15?/m0/s1
PubChem CID46874351
ChEMBLCHEMBL605672
IUPHARN/A
BindingDB50406498
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
92945Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326

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