Bioactive Compound Details
| BioID | bio199634 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL153458 |
| Molecular Formula | C13H11NS2 |
| Molecular Weight | 245.37 |
| Molecular Weight (Monoisotopic) | 245.0333 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-Benzyl-Benzo[1,3,2]Dithiazole |
| Smiles | c1ccc(CN2Sc3ccccc3S2)cc1 |
| Inchi | InChI=1S/C13H11NS2/c1-2-6-11(7-3-1)10-14-15-12-8-4-5-9-13(12)16-14/h1-9H,10H2 |
| Inchi Key | JGXDQRKLHJURIO-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | -0.62 |
| Records Key | ['39'] |
| Records Name | ['2-Benzyl-benzo[1,3,2]dithiazole'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
