| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8V1MN6GB8I |
| EPA CompTox | DTXSID10166348 |
Structure
| InChI Key | IJVRPNIWWODHHA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H3N1O2 |
| Molecular Weight | 97.02 |
| AlogP | 0.15 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 61.09 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 15802-18-3 |
| NORMAN SUSDAT | |
| FDA SRS | 8V1MN6GB8I |
| PubChem | 27488 |
| ChemSpider | 25579.0 |
CONTENTS
