| Synonyms: | |
| Status: | Approved (1986) Withdrawn (1991) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| ATC: | C01BC08 |
| UNII: | SY3J0147NB |
Structure
| InChI Key | PJWPNDMDCLXCOM-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C22H28N2O2 |
| Molecular Weight | 352.48 |
| AlogP | 4.36 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 41.57 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 26.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Ion channel
Voltage-gated ion channel
Voltage-gated sodium channel
|
- | - | - | - | 55 |
Indications
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 66778-36-7 |
| ChEBI | 4788 |
| ChEMBL | CHEMBL315838 |
| DrugBank | DB01228 |
| DrugCentral | 1007 |
| EPA CompTox | DTXSID0022983 |
| FDA SRS | SY3J0147NB |
| Human Metabolome Database | HMDB15359 |
| KEGG | C06978 |
| PubChem | 48041 |
| SureChEMBL | SCHEMBL94346 |
CONTENTS