| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60887354 |
Structure
| InChI Key | ACERFIHBIWMFOR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H17NO5S |
| Molecular Weight | 227.08 |
| AlogP | -1.4 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 106.86 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 68399-79-1 |
| NORMAN SUSDAT |
CONTENTS
