CHEMBL85410


SMILES C=CCO/C(O)=C1\C(C)=NC(c2ccccc2)=C(C(=O)OCC)C1/C=C/c1ccc([N+](=O)[O-])cc1
InChIKey NBYCGOUEQOTOSO-SXCHPFRQSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 474.2

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
A3 AA3R Human Adenosine A pKi 6.53 6.53 6.53 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database