CHEMBL2113700


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

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 380.0

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 4.4 4.4 4.4 ChEMBL
A2A AA2AR Rat Adenosine A pKi 5.49 5.49 5.49 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.25 5.25 5.25 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database