| Synonyms: | |
| Status: | Phase 3 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | C7VOZ162LV |
| InChI Key | GCQYYIHYQMVWLT-HQNLTJAPSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H13BrN2O6 |
| Molecular Weight | 349.14 |
| AlogP | -1.49 |
| Hydrogen Bond Acceptor | 7.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 124.78 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 20.0 |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Transferase
|
- | 28000 | - | 10400 | - |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Herpes Zoster | 2 | D006562 | ClinicalTrials |
| Neuralgia, Postherpetic | 2 | D051474 | ClinicalTrials |
| Resources | Reference |
|---|---|
| CAS NUMBER | 77181-69-2 |
| ChEBI | 32152 |
| ChEMBL | CHEMBL70046 |
| DrugBank | DB11998 |
| DrugCentral | 2463 |
| FDA SRS | C7VOZ162LV |
| PubChem | 5282192 |
| SureChEMBL | SCHEMBL82640 |
| ZINC | ZINC000003653374 |