CHEMBL107155


SMILES CCCO/C(O)=C1\C(C)=NC(c2ccccc2)=C(C(=O)OCC)C1C
InChIKey BJGGUDOLAARRLL-MNDPQUGUSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 343.2

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
A2A AA2AR Rat Adenosine A pKi 4.54 4.54 4.54 ChEMBL
A1 AA1R Rat Adenosine A pKi 4.76 4.76 4.76 ChEMBL
A3 AA3R Human Adenosine A pKi 5.68 5.68 5.68 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database