| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 23G806JP9G |
| EPA CompTox | DTXSID6073281 |
Structure
| InChI Key | LFLBHTZRLVHUQC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H12O3S1 |
| Molecular Weight | 152.05 |
| AlogP | 0.76 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 43.37 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1912-32-9 |
| NORMAN SUSDAT | |
| FDA SRS | 23G806JP9G |
| PubChem | 15953 |
| ChemSpider | 15159.0 |
CONTENTS
