| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1961) |
| Entry Type: | Small molecule |
| Molecule Category: | Salt |
| UNII: | 4NRT660KJQ |
| InChI Key | PQMSFAORUFMASU-UHFFFAOYSA-M |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H11N2NaO4S |
| Molecular Weight | 254.24 |
| AlogP | 0.09 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 89.26 |
| Molecular species | ACID |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| ChEBI | 63858 |
| ChEMBL | CHEMBL1723241 |
| EPA CompTox | DTXSID50211129 |
| FDA SRS | 4NRT660KJQ |
| PubChem | 6419954 |