CHEMBL5562028


SMILES CCCCC#Cc1nc(NC)c2nc(-c3cccs3)[nH]c2n1
InChIKey BWRGNCIORXEUCS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 311.1

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 8.43 8.43 8.43 ChEMBL
A1 AA1R Human Adenosine A pKi 6.67 6.67 6.67 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.18 7.18 7.18 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database