CHEMBL2180910


SMILES CC(O)CNc1nc2nn(C)cc2c2nc(-c3ccco3)nn12
InChIKey UNGUJUIOUVNWBB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 313.1

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 6.45 6.45 6.45 ChEMBL
A1 AA1R Human Adenosine A pKi 6.43 6.43 6.43 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.87 6.87 6.87 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database