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Ligand

NameCHEMBL605469
Molecular formulaC19H23N5O4
IUPAC name(2R,3S,4R)-2-(hydroxymethyl)-5-[6-(N-propan-2-ylanilino)purin-9-yl]oxolane-3,4-diol
Molecular weight385.424
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogP2.1
SynonymsBDBM50367678
Inchi KeyFOQCCKILBKXEHH-XAUNWSGPSA-N
Inchi IDInChI=1S/C19H23N5O4/c1-11(2)24(12-6-4-3-5-7-12)18-14-17(20-9-21-18)23(10-22-14)19-16(27)15(26)13(8-25)28-19/h3-7,9-11,13,15-16,19,25-27H,8H2,1-2H3/t13-,15-,16-,19?/m1/s1
PubChem CID46874457
ChEMBLCHEMBL605469
IUPHARN/A
BindingDB50367678
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
83490Adenosine receptor A1P25099Adora1Rattus norvegicus (Rat)326
83492Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326

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