CHEMBL4529321


SMILES Nc1nc(-c2cccc(O)c2)nc2sc(-c3ccco3)nc12
InChIKey IFAWCWLECSSPBT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 310.1

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 7.8 7.8 7.8 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.79 8.79 8.79 ChEMBL
A1 AA1R Human Adenosine A pKi 7.29 7.29 7.29 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2A AA2AR Human Adenosine A pIC50 6.12 6.12 6.12 ChEMBL