CHEMBL114745


SMILES Cn1c(=O)c2nc(CCCC(=O)O)[nH]c2n(C)c1=S
InChIKey HAHTZBMNUQFBCT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 282.1

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
A3 AA3R Rat Adenosine A pKi 5.03 5.03 5.03 ChEMBL
A2A AA2AR Rat Adenosine A pKi 4.17 4.17 4.17 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.24 5.24 5.24 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database