| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | QT9D7W9SX6 |
| EPA CompTox | DTXSID40160319 |
Structure
| InChI Key | YYPNNBPPDFTQFX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H8OS |
| Molecular Weight | 128.03 |
| AlogP | 1.28 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 13781-67-4 |
| NORMAN SUSDAT | |
| FDA SRS | QT9D7W9SX6 |
| PubChem | 83731 |
CONTENTS
