CHEMBL4286593


SMILES CNc1ncc(C(=O)OCc2cccc(C)c2)c2nc(-c3ccco3)nn12
InChIKey DBMSSTATMGSYKN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 363.1

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 7.97 7.97 7.97 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.68 7.68 7.68 ChEMBL
A1 AA1R Human Adenosine A pKi 7.1 7.1 7.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database