| BioID | bio199142 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL603528 |
|---|
| Molecular Formula | C16H22N4O9S2 |
|---|
| Molecular Weight | 478.51 |
|---|
| Molecular Weight (Monoisotopic) | 288.1211 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 1,1'-Oxybis(Methylene)Bis(2-((Hydroxyimino)Methyl)Pyridinium)Methanesulfonate |
|---|
| Smiles | CS(=O)(=O)[O-].CS(=O)(=O)[O-].O/N=C/c1cccc[n+]1COC[n+]1ccccc1/C=N/O |
|---|
| Inchi | InChI=1S/C14H14N4O3.2CH4O3S/c19-15-9-13-5-1-3-7-17(13)11-21-12-18-8-4-2-6-14(18)10-16-20;2*1-5(2,3)4/h1-10H,11-12H2;2*1H3,(H,2,3,4) |
|---|
| Inchi Key | UEICXGSZESYSEJ-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 7.0 |
|---|
| Np Likeness Score | -0.14 |
|---|
| Records Key | ['19'] |
|---|
| Records Name | [1,1'-oxybis(methylene)bis(2-((hydroxyimino)methyl)pyridinium)methanesulfonate"]" |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
