| Trade Names: | |
| Synonyms: | |
| Status: | Approved (2020) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 760I9WM792 |
Structure
| InChI Key | XEDHVZKDSYZQBF-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C19H18F3N3O2 |
| Molecular Weight | 377.37 |
| AlogP | 3.28 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 62.3 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 27.0 |
Pharmacology
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Migraine Disorders | 3 | D008881 | ClinicalTrials |
| Substance-Related Disorders | 1 | D019966 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 439239-90-4 |
| ChEMBL | CHEMBL3039520 |
| DrugBank | DB11732 |
| DrugCentral | 5351 |
| EPA CompTox | DTXSID40469435 |
| FDA SRS | 760I9WM792 |
| Guide to Pharmacology | 3928 |
| PDB | 05X |
| PubChem | 11610526 |
| SureChEMBL | SCHEMBL536057 |
| ZINC | ZINC000003818355 |
CONTENTS