| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4780H7U8LU |
| EPA CompTox | DTXSID10202316 |
Structure
| InChI Key | IOGXOCVLYRDXLW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H9N1O2 |
| Molecular Weight | 103.06 |
| AlogP | 1.48 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 38.66 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 540-80-7 |
| NORMAN SUSDAT | |
| FDA SRS | 4780H7U8LU |
| PubChem | 10906 |
| ChemSpider | 6170.0 |
CONTENTS
