Bioactive Compound Details
| BioID | bio198311 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL521486 |
| Molecular Formula | C15H13NOS |
| Molecular Weight | 255.34 |
| Molecular Weight (Monoisotopic) | 255.0718 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-(3-Methylbenzylsulfanyl)Benzoxazole |
| Smiles | Cc1cccc(CSc2nc3ccccc3o2)c1 |
| Inchi | InChI=1S/C15H13NOS/c1-11-5-4-6-12(9-11)10-18-15-16-13-7-2-3-8-14(13)17-15/h2-9H,10H2,1H3 |
| Inchi Key | GCADXFLAUMTVGK-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 3.0 |
| Bioactivities | 10.0 |
| Np Likeness Score | -1.96 |
| Records Key | ['3k'] |
| Records Name | ['2-(3-Methylbenzylsulfanyl)benzoxazole'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
