| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID90498376 |
| InChI Key | URDYTQYZXZKBQT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H4Cl1N3O3 |
| Molecular Weight | 224.99 |
| AlogP | 1.9 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 89.15 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 53449-14-2 |
| NORMAN SUSDAT | |
| PubChem | 12441237 |
| ChemSpider | 11106907.0 |