| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1962) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | A14AA02 |
| UNII: | 4R1VB9P8V3 |
| InChI Key | LKAJKIOFIWVMDJ-IYRCEVNGSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C21H32N2O |
| Molecular Weight | 328.5 |
| AlogP | 4.12 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 0.0 |
| Polar Surface Area | 48.91 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 24.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 10418-03-8 |
| ChEBI | 9249 |
| ChEMBL | CHEMBL2079587 |
| DrugBank | DB06718 |
| DrugCentral | 2477 |
| EPA CompTox | DTXSID3044128 |
| FDA SRS | 4R1VB9P8V3 |
| Human Metabolome Database | HMDB0003116 |
| Guide to Pharmacology | 10369 |
| KEGG | C07311 |
| PubChem | 25249 |
| SureChEMBL | SCHEMBL44099 |
| ZINC | ZINC000004097376 |