| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | GK8CPR334A |
| EPA CompTox | DTXSID10233721 |
| InChI Key | LSBYYJMCRRFQRA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H18Cl1N5 |
| Molecular Weight | 255.13 |
| AlogP | 1.55 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 69.19 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 84712-77-6 |
| NORMAN SUSDAT | |
| FDA SRS | GK8CPR334A |
| PubChem | 158453 |
| ChemSpider | 139394.0 |