| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 0FWE72AF2P |
| EPA CompTox | DTXSID2027965 |
Structure
| InChI Key | DOGJSOZYUGJVKS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H10O4S1 |
| Molecular Weight | 166.03 |
| AlogP | -1.19 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 66.76 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 30618-84-9 |
| NORMAN SUSDAT | |
| FDA SRS | 0FWE72AF2P |
| PubChem | 3034372 |
| ChemSpider | 2298847.0 |
CONTENTS
