| Trade Names: | |
| Synonyms: | |
| Status: | Approved (2010) |
| Entry Type: | Small molecule |
| Molecule Category: | Salt Prodrug |
| UNII: | OKG364O896 |
| Parent Compound: | ESTRADIOL |
Structure
| InChI Key | RSEPBGGWRJCQGY-RBRWEJTLSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C23H32O3 |
| Molecular Weight | 356.51 |
| AlogP | 5.35 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 46.53 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 26.0 |
Pharmacology
| Action | Mechanism of Action | Reference |
|---|---|---|
| AGONIST | Estrogen receptor alpha agonist | DailyMed |
| 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
|
- | - | - | - | 130 |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Menopause | 4 | D008593 | ClinicalTrials |
| Metrorrhagia | 3 | D008796 | ClinicalTrials |
| Atrophic Vaginitis | 3 | D059268 | ClinicalTrials |
| Dysmenorrhea | 3 | D004412 | ClinicalTrials |
| Infertility | 3 | D007246 | ClinicalTrials |
Related Entries
Adverse Reactions
System Organ Classification (SOC)
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 979-32-8 |
| ChEBI | 31561 |
| ChEMBL | CHEMBL1511 |
| DrugBank | DB13956 |
| DrugCentral | 1064 |
| EPA CompTox | DTXSID8023004 |
| FDA SRS | OKG364O896 |
| Guide to Pharmacology | 7655 |
| KEGG | C12859 |
| PubChem | 13791 |
| SureChEMBL | SCHEMBL40563 |
| ZINC | ZINC000003881556 |
CONTENTS