| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 4RTO57VG65 |
Structure
| InChI Key | XBRWELTXMQSEIN-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H18O4 |
| Molecular Weight | 226.27 |
| AlogP | 1.64 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 52.6 |
| Molecular species | None |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 16.0 |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Herpes Labialis | 2 | D006560 | ClinicalTrials |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2892-62-8 |
| ChEBI | 53612 |
| ChEMBL | CHEMBL2435707 |
| DrugBank | DB12223 |
| EPA CompTox | DTXSID30183113 |
| FDA SRS | 4RTO57VG65 |
| PubChem | 65108 |
| SureChEMBL | SCHEMBL56180 |
| ZINC | ZINC000001704225 |
CONTENTS