| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 5XGC17ZKUF |
| InChI Key | GKGRZLGAQZPEHO-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C21H20FN3O4 |
| Molecular Weight | 397.41 |
| AlogP | 2.68 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 95.41 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 29.0 |
| Action | Mechanism of Action | Reference |
|---|---|---|
| ANTAGONIST | Glutamate NMDA receptor; GRIN1/GRIN2B antagonist |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Ion channel
Ligand-gated ion channel
Ionotropic glutamate receptor
NMDA receptor
|
- | 4-70 | - | - | 5-10 |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Neuralgia | 2 | D009437 | ClinicalTrials |
| Spasms, Infantile | 2 | D013036 | ClinicalTrials |
| Resources | Reference |
|---|---|
| CAS NUMBER | 496054-87-6 |
| ChEMBL | CHEMBL182066 |
| DrugBank | DB12260 |
| FDA SRS | 5XGC17ZKUF |
| PubChem | 10200813 |
| SureChEMBL | SCHEMBL99256 |
| ZINC | ZINC000028363953 |