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 |