| Trade Names | |
| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| ATC | J01DD02 |
| UNII | DZR1ENT301 |
| EPA CompTox | DTXSID5022770 |
| InChI Key | ORFOPKXBNMVMKC-DWVKKRMSSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C22H22N6O7S2 |
| Molecular Weight | 546.59 |
| AlogP | -1.3 |
| Hydrogen Bond Acceptor | 11.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 9.0 |
| Polar Surface Area | 191.22 |
| Molecular species | ACID |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 37.0 |
| Mechanism of Action | Action | Reference |
|---|---|---|
| Bacterial penicillin-binding protein inhibitor | INHIBITOR | PubMed |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Unclassified protein
|
- | - | - | - | 100 |
| Resources | Reference |
|---|---|
| ChEBI | 3508 |
| ChEMBL | CHEMBL44354 |
| DrugBank | DB00438 |
| FDA SRS | DZR1ENT301 |
| Human Metabolome Database | HMDB0014582 |
| Guide to Pharmacology | 10762 |
| KEGG | C06889 |
| PharmGKB | PA448861 |
| PubChem | 6536864 |
| SureChEMBL | SCHEMBL36849 |
| ZINC | ZINC03871960 |