Bioactive Compound Details
| BioID | bio199488 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL112427 |
| Molecular Formula | C14H11NOS |
| Molecular Weight | 241.31 |
| Molecular Weight (Monoisotopic) | 241.0561 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-Benzylsulfanyl-Benzooxazole|2-Benzylsulfanylbenzoxazole |
| Smiles | c1ccc(CSc2nc3ccccc3o2)cc1 |
| Inchi | InChI=1S/C14H11NOS/c1-2-6-11(7-3-1)10-17-14-15-12-8-4-5-9-13(12)16-14/h1-9H,10H2 |
| Inchi Key | CGOXJHMQMPSWCL-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 3.0 |
| Bioactivities | 20.0 |
| Np Likeness Score | -1.69 |
| Records Key | ['4a', '3a'] |
| Records Name | ['2-Benzylsulfanyl-benzooxazole', '2-Benzylsulfanylbenzoxazole'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
