| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | BQT642LWE1 |
| EPA CompTox | DTXSID8063044 |
| InChI Key | HOZRMSVNIKYCMB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H13N1O3 |
| Molecular Weight | 195.09 |
| AlogP | 2.31 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 51.05 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 3467-59-2 |
| NORMAN SUSDAT | |
| FDA SRS | BQT642LWE1 |
| PubChem | 77015 |
| ChemSpider | 69461.0 |