CHEMBL74852


SMILES COc1cc(O)c2c(c1)OC(c1ccc(O)cc1)CC2=O
InChIKey DJOJDHGQRNZXQQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 286.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2A AA2AR Rat Adenosine A pKi 4.45 4.45 4.45 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.09 5.09 5.09 ChEMBL
A3 AA3R Human Adenosine A pKi 5.47 5.47 5.47 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database