| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | T30038QI8N |
Structure
| InChI Key | LCAFGJGYCUMTGS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H16N2O1 |
| Molecular Weight | 204.13 |
| AlogP | 0.99 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 46.33 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 116041-13-5 |
| NORMAN SUSDAT | |
| FDA SRS | T30038QI8N |
CONTENTS
