CHEMBL1650394


SMILES CCC(=O)Nc1cc(-c2ccsc2)nc(-c2ccsc2)n1
InChIKey UHXRXYHGDPUNGT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 315.1

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 6.78 6.78 6.78 ChEMBL
A3 AA3R Human Adenosine A pKi 7.19 7.19 7.19 ChEMBL
A1 AA1R Human Adenosine A pKi 7.41 7.41 7.41 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.2 7.2 7.2 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database