| Synonyms: | |
| Status: | Approved (2001) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | N06DA04 |
| UNII: | 1T835Z585R |
| InChI Key | ASUTZQLVASHGKV-JDFRZJQESA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C17H21NO3 |
| Molecular Weight | 287.36 |
| AlogP | 1.85 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 41.93 |
| Molecular species | BASE |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 21.0 |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Dementia | 4 | D003704 | ClinicalTrials |
| Autistic Disorder | 3 | D001321 | ClinicalTrials |
| Dementia, Vascular | 3 | D015140 | ClinicalTrials |
| Alzheimer Disease | 3 | D000544 | ClinicalTrials |
| Schizophrenia | 3 | D012559 | ClinicalTrials |
| Lewy Body Disease | 3 | D020961 | ClinicalTrials |
| Anxiety | 3 | D001007 | ClinicalTrials |
| Depressive Disorder | 3 | D003866 | ClinicalTrials |
| HIV Infections | 2 | D015658 | ClinicalTrials |
| Tobacco Use Disorder | 2 | D014029 | ClinicalTrials |
| Cocaine-Related Disorders | 2 | D019970 | ClinicalTrials |
| Psychotic Disorders | 2 | D011618 | ClinicalTrials |
| Hypotension, Orthostatic | 1 | D007024 | ClinicalTrials |
| Obesity | 1 | D009765 | ClinicalTrials |
| Subarachnoid Hemorrhage | 1 | D013345 | ClinicalTrials |
| Memory Disorders | 1 | D008569 | ClinicalTrials |
| Lecithin Cholesterol Acyltransferase Deficiency | 1 | D007863 | ClinicalTrials |
| Resources | Reference |
|---|---|
| CAS NUMBER | 357-70-0 |
| ChEBI | 42944 |
| ChEMBL | CHEMBL659 |
| DrugBank | DB00674 |
| DrugCentral | 1272 |
| EPA CompTox | DTXSID2045606 |
| FDA SRS | 1T835Z585R |
| Human Metabolome Database | HMDB0014812 |
| Guide to Pharmacology | 6693 |
| KEGG | C08526 |
| PDB | GNT |
| PharmGKB | PA449726 |
| PubChem | 9651 |
| SureChEMBL | SCHEMBL2577 |
| ZINC | ZINC000000491073 |