CHEMBL2113345


SMILES CCCCn1c(=O)[nH]c2nc(-c3ccc(CC(=O)O)cc3)[nH]c2c1=O
InChIKey AEGGQHBFSYNDCU-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 6
Molecular weight (Da) 342.1

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 5.23 5.23 5.23 ChEMBL
A1 AA1R Rat Adenosine A pKi 6.68 6.68 6.68 ChEMBL
A2B AA2BR Human Adenosine A pKi 7.82 7.82 7.82 ChEMBL
A3 AA3R Human Adenosine A pKi 5.54 5.54 5.54 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database