CHEMBL5562579


SMILES CCCCC#Cc1nc2c(NCc3cccc(I)c3)nc(-c3cccs3)nc2[nH]1
InChIKey IZFMAMDDRPYNBC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 513.0

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 6.94 6.94 6.94 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.44 6.44 6.44 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database