CHEMBL113512


SMILES CCn1c(=O)c2c(nc3ccccn32)n(Cc2ccccc2)c1=O
InChIKey YEHUFKUQNJXVNS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 3
Molecular weight (Da) 320.1

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
A3 AA3R Human Adenosine A pKi 7.44 7.44 7.44 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.23 6.23 6.23 ChEMBL
A1 AA1R Human Adenosine A pKi 6.49 6.49 6.49 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database