CHEMBL85172


SMILES CCO/C(O)=C1\C(C)=NC(c2ccccc2)=C(C(=O)OC(C)(C)C)C1C#Cc1ccccc1
InChIKey VTVFRXLORHVHKL-WNAAXNPUSA-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
A3 AA3R Human Adenosine A pKi 5.51 5.51 5.51 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database