Ligand Data

Ligand

id 93045
Name CHEMBL2431168
SMILES CC(C)(O)CNC(=O)c1ccc(C#Cc2cccc(F)c2)cn1
InChIKey PMJDGBOMLSAHKE-UHFFFAOYSA-N
Type small-molecule
External Links

Structure

Properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight 312.1


Bioactivity

Receptor Affinity (nM) Potency (nM)
GTP Uniprot Species Family Class Min Avg Max Min Avg Max
mGlu5 GRM5 Rat Metabotropic glutamate C (Glutamate) 34.6 2017.6 4020.0