| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| ATC: | N02BE04 |
| UNII: | 1Z23WB033I |
Structure
| InChI Key | LIAWQASKBFCRNR-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H17NO3 |
| Molecular Weight | 223.27 |
| AlogP | 1.79 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 58.56 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 16.0 |
Indications
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 31311 |
| ChEMBL | CHEMBL1697856 |
| DrugBank | DB13278 |
| DrugCentral | 413 |
| EPA CompTox | DTXSID6020721 |
| FDA SRS | 1Z23WB033I |
| PubChem | 14130 |
| SureChEMBL | SCHEMBL25373 |
CONTENTS