| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6R2DPA8D3Z |
Structure
| InChI Key | RVQMZGWUSHPUCC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H18N1O3P1S1 |
| Molecular Weight | 311.07 |
| AlogP | 4.22 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 40.58 |
| Heavy Atoms | 20.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 22439-40-3 |
| NORMAN SUSDAT | |
| FDA SRS | 6R2DPA8D3Z |
CONTENTS
