CHEMBL506101


SMILES Nc1nc(-c2ccco2)c2nnn(Cc3ccsc3)c2n1
InChIKey CPCWPQDPUNDLNA-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 298.1

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
A2B AA2BR Human Adenosine A pKi 6.79 6.79 6.79 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.72 8.72 8.72 ChEMBL
A1 AA1R Human Adenosine A pKi 7.11 7.11 7.11 ChEMBL
A3 AA3R Human Adenosine A pKi 6.87 6.87 6.87 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database