| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6L57Q44ZWW |
| EPA CompTox | DTXSID0048680 |
| InChI Key | NYPYHUZRZVSYKL-ZETCQYMHSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H9I2N1O3 |
| Molecular Weight | 432.87 |
| AlogP | 1.56 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 83.55 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 300-39-0 |
| NORMAN SUSDAT | |
| FDA SRS | 6L57Q44ZWW |
| PubChem | 7058163 |
| ChemSpider | 8946.0 |