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Ligand

NameCHEMBL611115
Molecular formulaC16H23N5O4
IUPAC name(2R,3S,4R)-5-[6-(cyclopentylamino)purin-9-yl]-2-(hydroxymethyl)-3-methyloxolane-3,4-diol
Molecular weight349.391
Hydrogen bond acceptor8
Hydrogen bond donor4
XlogP0.2
SynonymsBDBM50370620
Inchi KeyBSUJYKOQGOFUAN-HVDRINOTSA-N
Inchi IDInChI=1S/C16H23N5O4/c1-16(24)10(6-22)25-15(12(16)23)21-8-19-11-13(17-7-18-14(11)21)20-9-4-2-3-5-9/h7-10,12,15,22-24H,2-6H2,1H3,(H,17,18,20)/t10-,12+,15?,16-/m1/s1
PubChem CID46877359
ChEMBLCHEMBL611115
IUPHARN/A
BindingDB50370620
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
32003Adenosine receptor A1P28190ADORA1Bos taurus (Bovine)326
32004Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
442914Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318

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