CHEMBL419002


SMILES Cc1ccccc1-n1cc2c(n1)c(NC1CCCC1)nc1ccccc12
InChIKey YXHTYDSOIVPINR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 342.2

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
A1 AA1R Bovine Adenosine A pKi 6.83 6.83 6.83 ChEMBL
A3 AA3R Human Adenosine A pKi 6.82 6.82 6.82 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.48 6.48 6.48 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database