Synonyms: | |
Status: | Approved (1979) |
Entry Type: | Small molecule |
Molecule Category: | Parent |
ATC: | A04AD01 |
UNII: | DL48G20X8X |
InChI Key | STECJAGHUSJQJN-ODICJLLRSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C17H21NO4 |
Molecular Weight | 303.36 |
AlogP | 0.92 |
Hydrogen Bond Acceptor | 5.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 4.0 |
Polar Surface Area | 62.3 |
Molecular species | NEUTRAL |
Aromatic Rings | 1.0 |
Heavy Atoms | 22.0 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Pain | 2 | D010146 | ClinicalTrials |
Depressive Disorder | 2 | D003866 | ClinicalTrials |
Amyotrophic Lateral Sclerosis | 2 | D000690 | ClinicalTrials |
Bipolar Disorder | 2 | D001714 | ClinicalTrials |
Depressive Disorder | 2 | D003866 | ClinicalTrials |
Depressive Disorder, Major | 1 | D003865 | ClinicalTrials |
Renal Colic | 1 | D056844 | ClinicalTrials |
Phobia, Social | 1 | D000072861 | ClinicalTrials |
Dementia | 1 | D003704 | ClinicalTrials |
Alzheimer Disease | 1 | D000544 | ClinicalTrials |
Resources | Reference |
---|---|
ChEBI | 16794 |
ChEMBL | CHEMBL569713 |
DrugBank | DB00747 |
EPA CompTox | DTXSID6023573 |
FDA SRS | DL48G20X8X |
Human Metabolome Database | HMDB0003573 |
Guide to Pharmacology | 330 |
SureChEMBL | SCHEMBL16226 |
ZINC | ZINC000100037020 |