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Ligand

NameCHEMBL446264
Molecular formulaC8H10BrN5
IUPAC name8-bromo-9-propan-2-ylpurin-6-amine
Molecular weight256.107
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP1.4
SynonymsAKOS024116282
BDBM50256895
D06KYP
8-Bromo-9-isopropyl-9H-adenine
Inchi KeyAFKIJCJUVRTHPD-UHFFFAOYSA-N
Inchi IDInChI=1S/C8H10BrN5/c1-4(2)14-7-5(13-8(14)9)6(10)11-3-12-7/h3-4H,1-2H3,(H2,10,11,12)
PubChem CID44572292
ChEMBLCHEMBL446264
IUPHARN/A
BindingDB50256895
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4239Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
4238Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
4240Adenosine receptor A2bP29275ADORA2BHomo sapiens (Human)332
441881Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318

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