CHEMBL84583


SMILES CCO/C(O)=C1\C(C)=NC(c2ccccc2)=C(C(=O)SCC)C1C#Cc1ccccc1
InChIKey LTYFMANTRJNYFG-YYDJUVGSSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 431.2

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 4.28 4.28 4.28 ChEMBL
A3 AA3R Human Adenosine A pKi 6.25 6.25 6.25 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database