| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20885154 |
| InChI Key | OUHPNBGKEMHUCQ-HNNXBMFYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C18H23N3O4 |
| Molecular Weight | 345.17 |
| AlogP | 2.66 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 96.94 |
| Heavy Atoms | 25.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 20898-44-6 |
| NORMAN SUSDAT | |
| PubChem | 6993429 |