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Ligand

NameCHEMBL143565
Molecular formulaC21H26N4O2
IUPAC name8-[cyclopropyl(phenyl)methyl]-1,3-dipropyl-7H-purine-2,6-dione
Molecular weight366.465
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.2
Synonyms8-(Cyclopropyl-phenyl-methyl)-1,3-dipropyl-3,7-dihydro-purine-2,6-dione
1,3-Dipropyl-8-(alpha-cyclopropylbenzyl)xanthine
BDBM50011217
SCHEMBL7268434
Inchi KeyBMHIGIYMTNDBBQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H26N4O2/c1-3-12-24-19-17(20(26)25(13-4-2)21(24)27)22-18(23-19)16(15-10-11-15)14-8-6-5-7-9-14/h5-9,15-16H,3-4,10-13H2,1-2H3,(H,22,23)
PubChem CID15010009
ChEMBLCHEMBL143565
IUPHARN/A
BindingDB50011217
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
27465Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326

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