CHEMBL1672612


SMILES CC(=O)Nc1cnc(-c2ccncc2)c(-c2ccco2)n1
InChIKey IYMUBQAVDWGMOK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 280.1

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
A2B AA2BR Human Adenosine A pKi 8.22 8.22 8.22 ChEMBL
A3 AA3R Human Adenosine A pKi 5.81 5.81 5.81 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.14 6.14 6.14 ChEMBL
A1 AA1R Human Adenosine A pKi 6.34 6.34 6.34 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database