| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 5S99GCU3PT |
| EPA CompTox | DTXSID20180015 |
Structure
| InChI Key | KWMBADTWRIGGGG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H12N1O3P1 |
| Molecular Weight | 177.06 |
| AlogP | 1.78 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 59.32 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2537-48-6 |
| NORMAN SUSDAT | |
| FDA SRS | 5S99GCU3PT |
| PubChem | 75676 |
| ChemSpider | 68195.0 |
CONTENTS
