CHEMBL1935745


SMILES Nc1nc2cn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12
InChIKey RWFVLGJFYKITLB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 344.1

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
A1 AA1R Human Adenosine A pKi 8.37 8.37 8.37 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.41 8.41 8.41 ChEMBL
A3 AA3R Human Adenosine A pKi 6.91 6.91 6.91 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2B AA2BR Human Adenosine A pIC50 7.34 7.34 7.34 ChEMBL