| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1971) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| UNII: | TJ2M0FR8ES |
| Parent Compound: | MEGESTROL |
| InChI Key | RQZAXGRLVPAYTJ-GQFGMJRRSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C24H32O4 |
| Molecular Weight | 384.52 |
| AlogP | 4.58 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 60.44 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 28.0 |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 51 | |
|
Transporter
Primary active transporter
ATP-binding cassette
ABCB subfamily
|
- | 17800 | - | - | - |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Neoplasms | 4 | D009369 | ClinicalTrials |
| Cachexia | 4 | D002100 | ClinicalTrials |
| Breast Neoplasms | 3 | D001943 | ClinicalTrials |
| Endometrial Hyperplasia | 3 | D004714 | ClinicalTrials |
| Hot Flashes | 3 | D019584 | ClinicalTrials |
| Liver Neoplasms | 3 | D008113 | ClinicalTrials |
| Breast Neoplasms | 3 | D001943 | ClinicalTrials |
| Endometrial Neoplasms | 3 | D016889 | ClinicalTrials |
| Endometrial Neoplasms | 3 | D016889 | ClinicalTrials |
| Endometrial Neoplasms | 3 | D016889 | ClinicalTrials |
| HIV Wasting Syndrome | 2 | D019247 | ClinicalTrials |
| Head and Neck Neoplasms | 2 | D006258 | ClinicalTrials |
| Dementia | 2 | D003704 | ClinicalTrials |
| Carcinoma in Situ | 2 | D002278 | ClinicalTrials |
| Pulmonary Disease, Chronic Obstructive | 2 | D029424 | ClinicalTrials |
| Uterine Neoplasms | 2 | D014594 | ClinicalTrials |
| Resources | Reference |
|---|---|
| CAS NUMBER | 595-33-5 |
| ChEBI | 6723 |
| ChEMBL | CHEMBL1201139 |
| DrugBank | DB00351 |
| DrugCentral | 1667 |
| EPA CompTox | DTXSID9040683 |
| FDA SRS | TJ2M0FR8ES |
| KEGG | C08151 |
| PubChem | 11683 |
| SureChEMBL | SCHEMBL745 |
| ZINC | ZINC000004097467 |