CHEMBL2113045


SMILES c1ccc(Oc2nc(NC3CC4CCC3C4)c3nc[nH]c3n2)cc1
InChIKey PNRSPEFTETXGNF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 321.2

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 Human Adenosine A pKi 7.13 7.13 7.13 ChEMBL
A1 AA1R Human Adenosine A pKi 5.83 5.83 5.83 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database