CHEMBL444550


SMILES C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NCc3cccc(I)c3)ncnc21
InChIKey FZQBZRYTXUBBLO-AXYPVASZSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 4
Rotatable bonds 5
Molecular weight (Da) 497.1

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
A3 AA3R Rat Adenosine A pKi 5.49 5.49 5.49 ChEMBL
A1 AA1R Bovine Adenosine A pKi 7.07 7.36 7.7 ChEMBL
A3 AA3R Human Adenosine A pKi 6.79 6.99 7.19 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.03 6.18 6.33 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database