CHEMBL16774


SMILES O=c1n(-c2cccc(F)c2)nc2c(NC3CCCC3)nc3ccccc3n12
InChIKey VPJSDBCWKVHQQA-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 363.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A1 AA1R Bovine Adenosine A pKi 8.96 8.96 8.96 ChEMBL
A3 AA3R Human Adenosine A pKi 6.76 6.76 6.76 ChEMBL
A1 AA1R Human Adenosine A pKi 9.0 9.0 9.0 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database