| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20145068 |
Structure
| InChI Key | FNHPXOZSWXLMGI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H7N1O2 |
| Molecular Weight | 125.05 |
| AlogP | -0.19 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 47.17 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 10242-36-1 |
| NORMAN SUSDAT | |
| PubChem | 82488 |
| ChemSpider | 74444.0 |
CONTENTS
