CHEMBL4452898


SMILES COc1ccc(-c2nc(N)c3nc(-c4ccco4)sc3n2)cc1
InChIKey SRTHZUKKFVRLLA-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
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 8.33 8.33 8.33 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.95 7.95 7.95 ChEMBL
A1 AA1R Human Adenosine A pKi 7.32 7.32 7.32 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database