CHEMBL3314893


SMILES CCOC(=O)c1cnc(NC2CCCC2)n2nc(-c3ccco3)nc12
InChIKey KQHDLHPQSBPPHO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 341.1

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
A1 AA1R Human Adenosine A pKi 7.46 7.46 7.46 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.36 7.36 7.36 ChEMBL
A2B AA2BR Human Adenosine A pKi 5.33 5.33 5.33 ChEMBL
A3 AA3R Human Adenosine A pKi 7.46 7.46 7.46 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database