| Synonyms: | |
| Status: | Approved (1961) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| ATC: | N05AB07 |
| UNII: | 8620H6K4QH |
Structure
| InChI Key | WNTYBHLDCKXEOT-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C23H29N3O2S |
| Molecular Weight | 411.57 |
| AlogP | 3.49 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 47.02 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 29.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Transcription factor
Nuclear receptor
Nuclear hormone receptor subfamily 3
Nuclear hormone receptor subfamily 3 group C
Nuclear hormone receptor subfamily 3 group C member 4
|
- | - | - | 800 | - |
Indications
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 2401 |
| ChEMBL | CHEMBL1085 |
| DrugBank | DB01063 |
| DrugCentral | 59 |
| EPA CompTox | DTXSID2022547 |
| FDA SRS | 8620H6K4QH |
| Human Metabolome Database | HMDB0015196 |
| PubChem | 17676 |
| SureChEMBL | SCHEMBL94266 |
| ZINC | ZINC000022446634 |
CONTENTS