CHEMBL477445


SMILES O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@@H]1O
InChIKey GWUOJELSUSGGDU-IDTAVKCVSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 4
Molecular weight (Da) 387.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2B AA2BR Human Adenosine A pKi 5.32 5.32 5.32 ChEMBL
A3 AA3R Human Adenosine A pKi 6.38 6.38 6.38 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.67 5.67 5.67 ChEMBL
A1 AA1R Human Adenosine A pKi 8.81 8.81 8.81 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database