| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1992) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN Prodrug |
| UNII: | 2TB00A1Z7N |
Structure
| InChI Key | LTINZAODLRIQIX-FBXRGJNPSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C21H27N5O9S2 |
| Molecular Weight | 557.61 |
| AlogP | 0.83 |
| Hydrogen Bond Acceptor | 14.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 10.0 |
| Polar Surface Area | 180.97 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 37.0 |
Pharmacology
| Action | Mechanism of Action | Reference |
|---|---|---|
| INHIBITOR | Bacterial penicillin-binding protein inhibitor | PubMed |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Transporter
Primary active transporter
ATP-binding cassette
ABCB subfamily
|
- | 81700 | - | - | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Osteomyelitis | 0 | D010019 | ClinicalTrials |
Related Entries
MCS
Scaffolds
Adverse Reactions
System Organ Classification (SOC)
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 3505 |
| ChEMBL | CHEMBL1201016 |
| DrugCentral | 555 |
| EPA CompTox | DTXSID1022766 |
| FDA SRS | 2TB00A1Z7N |
| KEGG | C08115 |
| PubChem | 6526396 |
| SureChEMBL | SCHEMBL27071 |
CONTENTS