CHEMBL2113702


SMILES Cn1cnc2c(NCc3cccc(I)c3)nc(Cl)nc21
InChIKey ATOXAERIKXFYQV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 399.0

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 4.29 4.29 4.29 ChEMBL
A2A AA2AR Rat Adenosine A pKi 5.57 5.57 5.57 ChEMBL
A1 AA1R Rat Adenosine A pKi 6.35 6.35 6.35 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database