CHEMBL335334


SMILES CCOC(=O)c1sc(SC)c2c1CCCC2=O
InChIKey BHVLZDJJLSBOHJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 3
Molecular weight (Da) 270.0

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 Rat Adenosine A pKi 4.82 4.82 4.82 ChEMBL
A2A AA2AR Rat Adenosine A pKi 5.44 5.44 5.44 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.71 5.71 5.71 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NPS NPSR1 Human Neuropeptide S A Potency 4.9 4.9 4.9 ChEMBL