| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | G396OC7TFD |
| EPA CompTox | DTXSID00207633 |
Structure
| InChI Key | IIYSNNBEZBAQCQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H13N1 |
| Molecular Weight | 123.1 |
| AlogP | 2.29 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 4.93 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 589-33-3 |
| NORMAN SUSDAT | |
| FDA SRS | G396OC7TFD |
| PubChem | 68529 |
| ChemSpider | 61804.0 |
CONTENTS
