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Ligand

NameCHEMBL609233
Molecular formulaC19H25N7O3S
IUPAC name(3R,4S,5S)-2-[6-(cyclopentylamino)purin-9-yl]-5-[(1-methylimidazol-2-yl)sulfanylmethyl]oxolane-3,4-diol
Molecular weight431.515
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP1.6
SynonymsBDBM50452004
Inchi KeyCSGICLCLXOKRJK-PZGKNFOESA-N
Inchi IDInChI=1S/C19H25N7O3S/c1-25-7-6-20-19(25)30-8-12-14(27)15(28)18(29-12)26-10-23-13-16(21-9-22-17(13)26)24-11-4-2-3-5-11/h6-7,9-12,14-15,18,27-28H,2-5,8H2,1H3,(H,21,22,24)/t12-,14-,15-,18?/m1/s1
PubChem CID46876090
ChEMBLCHEMBL609233
IUPHARN/A
BindingDB50452004
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
49447Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326

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