| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | C667KS76K4 |
| EPA CompTox | DTXSID1065970 |
Structure
| InChI Key | WQPMYSHJKXVTME-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H8O4S1 |
| Molecular Weight | 140.01 |
| AlogP | -0.74 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 74.6 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 15909-83-8 |
| NORMAN SUSDAT | |
| FDA SRS | C667KS76K4 |
| PubChem | 85181 |
| ChemSpider | 76821.0 |
CONTENTS
