CHEMBL3597584


SMILES O=C(C#Cc1ccccc1)N1CCN(c2ncccc2[N+](=O)[O-])CC1
InChIKey GBLQNGDWYYUAAX-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 2
Molecular weight (Da) 336.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
mGlu1 GRM1 Rat Metabotropic glutamate C pKi 7.01 7.01 7.01 ChEMBL
mGlu5 GRM5 Rat Metabotropic glutamate C pKi 9.22 9.22 9.22 ChEMBL
mGlu5 GRM5 Human Metabotropic glutamate C pKi 9.3 9.3 9.3 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
mGlu1 GRM1 Rat Metabotropic glutamate C pIC50 6.57 6.57 6.57 ChEMBL
mGlu5 GRM5 Human Metabotropic glutamate C pIC50 9.05 9.05 9.05 ChEMBL