CHEMBL3896373


SMILES C#CCCCC(=O)Nc1nc2cccc(Cl)c2c2nc(-c3ccco3)nn12
InChIKey UBFZMKZYXVCALG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 379.1

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 7.47 7.47 7.47 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.29 7.29 7.29 ChEMBL
A1 AA1R Human Adenosine A pKi 6.77 6.77 6.77 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database