| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9A8XF4GA0X |
| EPA CompTox | DTXSID80189564 |
Structure
| InChI Key | WNCUVUUEJZEATP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H15N1O2 |
| Molecular Weight | 181.11 |
| AlogP | 1.21 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 44.48 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3600-86-0 |
| NORMAN SUSDAT | |
| FDA SRS | 9A8XF4GA0X |
| PubChem | 76632 |
| ChemSpider | 69096.0 |
CONTENTS
