Bioactive Compound Details
| BioID | bio198233 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL2315313 |
| Molecular Formula | C9H13NS2 |
| Molecular Weight | 199.34 |
| Molecular Weight (Monoisotopic) | 199.0489 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-(Sec-Butyldisulfanyl)Pyridine |
| Smiles | CCC(C)SSc1ccccn1 |
| Inchi | InChI=1S/C9H13NS2/c1-3-8(2)11-12-9-6-4-5-7-10-9/h4-8H,3H2,1-2H3 |
| Inchi Key | UYOBBBIZHVQHLV-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 11.0 |
| Bioactivities | 18.0 |
| Np Likeness Score | -0.4 |
| Records Key | ['3', '1k'] |
| Records Name | ['2-(sec-Butyldisulfanyl)pyridine', '2-(sec-butyldisulfanyl)pyridine'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
