| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6148QQN25T |
| EPA CompTox | DTXSID40196219 |
Structure
| InChI Key | MDIAKIHKBBNYHF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H10O2S1 |
| Molecular Weight | 134.04 |
| AlogP | 0.91 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4455-13-4 |
| NORMAN SUSDAT | |
| FDA SRS | 6148QQN25T |
| PubChem | 78199 |
| ChemSpider | 70575.0 |
CONTENTS
