Ligand Data
Ligand
| 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 | |||