CHEMBL181689


SMILES Nc1nc(C#CC(O)(c2ccccc2)C(F)(F)F)cn2nc(-c3ccco3)nc12
InChIKey LXMJVAXBNDITNB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 399.1

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
A2A AA2AR Rat Adenosine A pKi 7.13 7.13 7.13 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.66 5.66 5.66 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database