CHEMBL188958


SMILES Cn1cnc2c(NC3CCCCCC3)nc(Nc3ccccc3)nc21
InChIKey HXXOYJATCRBRHE-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 336.2

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
A3 AA3R Human Adenosine A pKi 6.02 6.02 6.02 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.53 5.53 5.53 ChEMBL
A1 AA1R Human Adenosine A pKi 5.71 5.71 5.71 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database