| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | H1U121C642 |
| EPA CompTox | DTXSID20213256 |
| InChI Key | GFFYOTUTUOQYLA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C16H27Cl2N5 |
| Molecular Weight | 359.16 |
| AlogP | 4.09 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 53.94 |
| Heavy Atoms | 23.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 63812-63-5 |
| NORMAN SUSDAT | |
| FDA SRS | H1U121C642 |
| PubChem | 6454726 |
| ChemSpider | 4957034.0 |