| Trade Names | |
| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| UNII | 8W8T17847W |
| EPA CompTox | DTXSID4021426 |
| InChI Key | XSQUKJJJFZCRTK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | CH4N2O |
| Molecular Weight | 60.06 |
| AlogP | -0.98 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 69.11 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 4.0 |
| 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
|
- | - | - | - | 87.46-105.91 |
| Resources | Reference |
|---|---|
| ChEBI | 16199 |
| ChEMBL | CHEMBL985 |
| DrugBank | DB03904 |
| DrugCentral | 4264 |
| FDA SRS | 8W8T17847W |
| Human Metabolome Database | HMDB0000294 |
| Guide to Pharmacology | 4539 |
| KEGG | C00086 |
| PDB | URE |
| PharmGKB | PA451831 |
| PubChem | 1176 |
| SureChEMBL | SCHEMBL4441 |
| ZINC | ZINC000008214514 |