| BioID | bio199640 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL298919 |
|---|
| Molecular Formula | C11H14N2O4S3 |
|---|
| Molecular Weight | 334.44 |
|---|
| Molecular Weight (Monoisotopic) | 334.0116 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | S-[(Diethylamino)Carbonothioyl]2-Nitrobenzenesulfonothioate |
|---|
| Smiles | CCN(CC)C(=S)SS(=O)(=O)c1ccccc1[N+](=O)[O-] |
|---|
| Inchi | InChI=1S/C11H14N2O4S3/c1-3-12(4-2)11(18)19-20(16,17)10-8-6-5-7-9(10)13(14)15/h5-8H,3-4H2,1-2H3 |
|---|
| Inchi Key | GFRUXBKTCIYXAD-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 60.0 |
|---|
| Bioactivities | 108.0 |
|---|
| Np Likeness Score | -1.64 |
|---|
| Records Key | ['10i', 'SID526221'] |
|---|
| Records Name | ['S-[(diethylamino)carbonothioyl]2-nitrobenzenesulfonothioate', 'SID526221'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
