CHEMBL162666


SMILES CCCOC(=O)c1c(-c2ccccc2)nc(CC)c(C(=O)SCC)c1CCO
InChIKey FIPVETXTFOGZQH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 401.2

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
A2A AA2AR Rat Adenosine A pKi 7.99 7.99 7.99 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.04 5.04 5.04 ChEMBL
A3 AA3R Human Adenosine A pKi 6.58 6.58 6.58 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database