CHEMBL3122212


SMILES Cc1ccncc1-c1nn(C)c2nc(OCc3ccccn3)cnc12
InChIKey RDLSKDOSNKLEAQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight (Da) 332.1

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
mGlu5 GRM5 Human Metabotropic glutamate C pKi 9.05 9.05 9.05 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.21 5.21 5.21 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
mGlu1 GRM1 Human Metabotropic glutamate C pIC50 4.52 4.52 4.52 ChEMBL
mGlu5 GRM5 Rat Metabotropic glutamate C pIC50 8.6 8.6 8.6 ChEMBL