CHEMBL4530682


SMILES Nc1nc(-c2cccc(CO)c2)nc2sc(-c3ccco3)nc12
InChIKey PXBABKDQVWUESV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 324.1

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 9.05 9.05 9.05 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.68 8.68 8.68 ChEMBL
A1 AA1R Human Adenosine A pKi 7.55 7.55 7.55 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database