| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID30199895 |
| InChI Key | LOONXPZWUBCFHH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C18H14Br6N2O2 |
| Molecular Weight | 763.62 |
| AlogP | 9.7 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 65.18 |
| Heavy Atoms | 28.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 51937-18-9 |
| NORMAN SUSDAT | |
| PubChem | 104019 |
| ChemSpider | 93908.0 |