CHEMBL3963278


SMILES CCCNc1nc(N)c2nc(-c3ccco3)sc2n1
InChIKey CWZAIFYZEWXELS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 275.1

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 7.46 7.46 7.46 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.77 7.77 7.77 ChEMBL
A1 AA1R Human Adenosine A pKi 7.19 7.19 7.19 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2B AA2BR Human Adenosine A pIC50 6.49 6.49 6.49 ChEMBL