| Trade Names | |
| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| ATC | G04BX03 |
| UNII | 4RZ82L2GY5 |
| EPA CompTox | DTXSID7022546 |
| InChI Key | RRUDCFGSUDOHDG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C2H5NO2 |
| Molecular Weight | 75.07 |
| AlogP | -0.49 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 49.33 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 5.0 |
| Mechanism of Action | Action | Reference |
|---|---|---|
| Bacterial urease inhibitor | INHIBITOR | DailyMed |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Hydrolase
|
- | - | - | - | 85.21-94.3 | |
|
Enzyme
Oxidoreductase
|
- | - | - | - | -97--2 | |
|
Enzyme
Protease
Metallo protease
Metallo protease MAE clan
Metallo protease M34 family
|
- | - | - | - | 25 | |
|
Enzyme
Protease
Metallo protease
Metallo protease MAM clan
Metallo protease M10A subfamily
|
- | - | - | - | -12-10 | |
|
Enzyme
|
- | - | - | - | -12-10 | |
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 91.26-100.94 |
| Resources | Reference |
|---|---|
| ChEBI | 49029 |
| ChEMBL | CHEMBL734 |
| DrugBank | DB00551 |
| DrugCentral | 58 |
| FDA SRS | 4RZ82L2GY5 |
| Human Metabolome Database | HMDB0014691 |
| KEGG | C06808 |
| PDB | HAE |
| PharmGKB | PA164749213 |
| PubChem | 1990 |
| SureChEMBL | SCHEMBL14492 |
| ZINC | ZINC000004658603 |