CHEMBL3403741


SMILES CCOC(=O)c1c(NC(=O)c2sc(Nc3ccc(C)cc3)nc2N(C)C)sc(C(=O)OC)c1C
InChIKey FCBHDSLDRNWTJS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 2
Rotatable bonds 8
Molecular weight (Da) 502.1

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
A2A AA2AR Human Adenosine A pKi 4.58 4.58 4.58 ChEMBL
A1 AA1R Human Adenosine A pKi 4.72 4.72 4.72 ChEMBL
A3 AA3R Human Adenosine A pKi 5.41 5.41 5.41 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database