CHEMBL3597594


SMILES Cc1cccc(C#CC=C2CCN(c3ncccc3[N+](=O)[O-])CC2)n1
InChIKey WYDQDVYUIYFOCH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 2
Molecular weight (Da) 334.1

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
mGlu1 GRM1 Rat Metabotropic glutamate C pKi 6.74 6.74 6.74 ChEMBL
mGlu5 GRM5 Rat Metabotropic glutamate C pKi 10.52 10.52 10.52 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 6.35 6.35 6.35 ChEMBL
mGlu5 GRM5 Human Metabotropic glutamate C pIC50 9.1 9.1 9.1 ChEMBL