Trade Names: | |
Synonyms: | |
Status: | Approved (1976) |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
ATC: | G03XA01 |
UNII: | N29QWW3BUO |
InChI Key | POZRVZJJTULAOH-LHZXLZLDSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C22H27NO2 |
Molecular Weight | 337.46 |
AlogP | 4.22 |
Hydrogen Bond Acceptor | 3.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 0.0 |
Polar Surface Area | 46.26 |
Molecular species | NEUTRAL |
Aromatic Rings | 1.0 |
Heavy Atoms | 25.0 |
Primary Target | |
---|---|
Androgen receptor |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Cytochrome P450
Cytochrome P450 family 2
Cytochrome P450 family 2C
Cytochrome P450 2C8
|
- | 1950 | - | - | - | |
Enzyme
Cytochrome P450
Cytochrome P450 family 2
Cytochrome P450 family 2C
Cytochrome P450 2C9
|
- | 1440 | - | - | - | |
Enzyme
Cytochrome P450
Cytochrome P450 family 2
Cytochrome P450 family 2D
Cytochrome P450 2D6
|
- | 2740 | - | - | - | |
Enzyme
Hydrolase
|
- | - | - | - | 30 | |
Enzyme
|
- | 12-77 | - | 20 | 30 | |
Secreted protein
|
- | - | 6 | - | - | |
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 81 | |
Transporter
Primary active transporter
ATP-binding cassette
ABCB subfamily
|
- | 18700-18700 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Fibrocystic Breast Disease | 4 | D005348 | ClinicalTrials |
Infertility | 3 | D007246 | ClinicalTrials |
Purpura, Thrombocytopenic, Idiopathic | 2 | D016553 | ClinicalTrials |
Purpura, Thrombocytopenic, Idiopathic | 2 | D016553 | ClinicalTrials |
Mastodynia | 2 | D059373 | ClinicalTrials |
Myelodysplastic Syndromes | 2 | D009190 | ClinicalTrials |
Endometrial Neoplasms | 2 | D016889 | ClinicalTrials |
Purpura, Thrombotic Thrombocytopenic | 2 | D011697 | ClinicalTrials |
Fanconi Anemia | 1 | D005199 | ClinicalTrials |
Dyskeratosis Congenita | 1 | D019871 | ClinicalTrials |
Anemia, Aplastic | 1 | D000741 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 17230-88-5 |
ChEBI | 4315 |
ChEMBL | CHEMBL1479 |
DrugBank | DB01406 |
DrugCentral | 779 |
EPA CompTox | DTXSID2022880 |
FDA SRS | N29QWW3BUO |
Human Metabolome Database | HMDB0002835 |
Guide to Pharmacology | 6942 |
KEGG | C06938 |
PDB | QA1 |
PharmGKB | PA164749056 |
PubChem | 28417 |
SureChEMBL | SCHEMBL21107 |
ZINC | ZINC000003881958 |