CHEMBL89494


SMILES CCOC(=O)C1=C(c2ccccc2)N=C(C)/C(=C(/O)OC(C)(C)C)C1C#Cc1ccccc1
InChIKey RGZOHEBUZCVHPO-SLEBQGDGSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 443.2

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
A1 AA1R Rat Adenosine A pKi 4.64 4.64 4.64 ChEMBL
A3 AA3R Human Adenosine A pKi 5.98 5.98 5.98 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database