| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1992) |
| Entry Type: | Small molecule |
| Molecule Category: | Salt |
| UNII: | 012C11ZU6G |
| Parent Compound: | TERBINAFINE |
Structure
| InChI Key | BWMISRWJRUSYEX-SZKNIZGXSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C21H26ClN |
| Molecular Weight | 327.9 |
| AlogP | 4.88 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 3.24 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 22.0 |
Pharmacology
| Action | Mechanism of Action | Reference |
|---|---|---|
| INHIBITOR | Squalene monooxygenase inhibitor |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Transferase
|
- | - | - | - | 6.375 | |
|
Other cytosolic protein
|
2591 | - | - | - | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Tinea Pedis | 3 | D014008 | ClinicalTrials |
| Onychomycosis | 3 | D014009 | ClinicalTrials |
Related Entries
Scaffolds
Adverse Reactions
System Organ Classification (SOC)
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 77614 |
| ChEMBL | CHEMBL1200832 |
| EPA CompTox | DTXSID90229223 |
| FDA SRS | 012C11ZU6G |
| KEGG | C08079 |
| PubChem | 11324905 |
| SureChEMBL | SCHEMBL36793 |
| ZINC | ZINC01530981 |
CONTENTS