| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20937844 |
Structure
| InChI Key | AGZXTDUDXXPCMJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H15NO6S |
| Molecular Weight | 253.06 |
| AlogP | -2.82 |
| Hydrogen Bond Acceptor | 7.0 |
| Hydrogen Bond Donor | 6.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 130.25 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 17087-36-4 |
| NORMAN SUSDAT |
CONTENTS
