| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 62DQ568XMD |
| EPA CompTox | DTXSID70183197 |
| InChI Key | IJVPILVRNBBRSO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H6N4O5 |
| Molecular Weight | 226.03 |
| AlogP | 0.68 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 144.89 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 2900-63-2 |
| NORMAN SUSDAT | |
| FDA SRS | 62DQ568XMD |
| PubChem | 3329932 |
| ChemSpider | 2577100.0 |