| Trade Names: | |
| Synonyms: | |
| Status: | Approved (2001) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN Prodrug |
| UNII: | 78THA212DH |
Structure
| InChI Key | AFZFFLVORLEPPO-UVYJNCLZSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C25H28N6O7S3 |
| Molecular Weight | 620.74 |
| AlogP | 2.3 |
| Hydrogen Bond Acceptor | 14.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 9.0 |
| Polar Surface Area | 175.4 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 41.0 |
Pharmacology
| 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
|
- | - | - | - | 64 |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Urinary Tract Infections | 3 | D014552 | ClinicalTrials |
Related Entries
MCS
Scaffolds
Adverse Reactions
System Organ Classification (SOC)
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 560555 |
| ChEMBL | CHEMBL454446 |
| DrugCentral | 534 |
| EPA CompTox | DTXSID2048743 |
| FDA SRS | 78THA212DH |
| PubChem | 6437877 |
| SureChEMBL | SCHEMBL182876 |
| ZINC | ZINC000003916973 |
CONTENTS