CHEMBL210585


SMILES Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)NCCc4ccccc4)cc3)[nH]c2n(C)c1=O
InChIKey BQORHOPXTSANCX-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 439.1

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
A2A AA2AR Rat Adenosine A pKi 6.95 6.95 6.95 ChEMBL
A1 AA1R Rat Adenosine A pKi 7.92 7.92 7.92 ChEMBL
A2B AA2BR Human Adenosine A pKi 8.35 8.35 8.35 ChEMBL
A3 AA3R Human Adenosine A pKi 5.96 5.96 5.96 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.49 7.49 7.49 ChEMBL
A1 AA1R Human Adenosine A pKi 6.73 6.73 6.73 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database