CHEMBL164321


SMILES CCSC(=O)c1c(CC)nc(-c2ccccc2)c(C(=O)OCCF)c1CC
InChIKey ZHOWYLFZKMSPTC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 8
Molecular weight (Da) 389.1

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 Rat Adenosine A pKi 6.22 6.22 6.22 ChEMBL
A2A AA2AR Rat Adenosine A pKi 5.13 5.13 5.13 ChEMBL
A1 AA1R Rat Adenosine A pKi 4.94 4.94 4.94 ChEMBL
A3 AA3R Human Adenosine A pKi 8.38 8.38 8.38 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database