| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | EYK815W3Z8 |
Structure
| InChI Key | WTDWVLJJJOTABN-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C22H23FN2O5S |
| Molecular Weight | 446.5 |
| AlogP | 3.23 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 99.85 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 31.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Transferase
|
9-72 | 160 | - | - | - | |
|
Unclassified protein
|
5-24 | - | - | - | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Hepatitis C | 2 | D006526 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL1092581 |
| DrugBank | DB07238 |
| EPA CompTox | DTXSID90219225 |
| FDA SRS | EYK815W3Z8 |
| PDB | 79Z |
| PubChem | 11561383 |
| SureChEMBL | SCHEMBL2513096 |
| ZINC | ZINC000030691787 |
CONTENTS