| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 62C8S706SP |
| EPA CompTox | DTXSID30239220 |
Structure
| InChI Key | ASLSUMISAQDOOB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H11N1O2 |
| Molecular Weight | 177.08 |
| AlogP | 1.77 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 42.25 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 93-17-4 |
| NORMAN SUSDAT | |
| FDA SRS | 62C8S706SP |
| PubChem | 66727 |
| ChemSpider | 60093.0 |
CONTENTS
