CHEMBL2113689


SMILES OCCn1cnc2c(NCc3cccc(I)c3)ncnc21
InChIKey DNQAXYGECDSJRS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 395.0

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 4.2 4.2 4.2 ChEMBL
A2A AA2AR Rat Adenosine A pKi 4.82 4.82 4.82 ChEMBL
A1 AA1R Rat Adenosine A pKi 4.64 4.64 4.64 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database