CHEMBL556083


SMILES COc1ccccc1CNC(=O)c1cc(-c2ccco2)nc(N)n1
InChIKey DFRSOCIMNLONDQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 324.1

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
A3 AA3R Human Adenosine A pKi 6.4 6.4 6.4 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.46 8.46 8.46 ChEMBL
A1 AA1R Human Adenosine A pKi 7.46 7.46 7.46 ChEMBL
A2B AA2BR Human Adenosine A pKi 6.81 6.81 6.81 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database