CHEMBL402607


SMILES CNC(=O)[C@@]12C[C@@H]1[C@@H](n1cnc3c(NOC)nc(Cl)nc31)[C@H](O)[C@@H]2O
InChIKey IDFINWOKYJJUJZ-RGUAOFKASA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 4
Rotatable bonds 4
Molecular weight (Da) 368.1

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 Mouse Adenosine A pKi 6.06 6.06 6.06 ChEMBL
A3 AA3R Human Adenosine A pKi 6.83 6.83 6.83 ChEMBL
A1 AA1R Human Adenosine A pKi 6.58 6.58 6.58 ChEMBL
A1 AA1R Mouse Adenosine A pKi 5.94 5.94 5.94 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database