| BioID | bio197708 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL109789 |
|---|
| Molecular Formula | C15H12N2OS2 |
|---|
| Molecular Weight | 300.41 |
|---|
| Molecular Weight (Monoisotopic) | 300.0391 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 4-(2-Benzoxazolylsulfanylmethyl)Benzothioamide |
|---|
| Smiles | NC(=S)c1ccc(CSc2nc3ccccc3o2)cc1 |
|---|
| Inchi | InChI=1S/C15H12N2OS2/c16-14(19)11-7-5-10(6-8-11)9-20-15-17-12-3-1-2-4-13(12)18-15/h1-8H,9H2,(H2,16,19) |
|---|
| Inchi Key | QTODCNQMWSGFGS-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 7.0 |
|---|
| Bioactivities | 33.0 |
|---|
| Np Likeness Score | -1.8 |
|---|
| Records Key | ['4i', '4a'] |
|---|
| Records Name | ['4-(Benzooxazol-2-ylsulfanylmethyl)-thiobenzamide', '4-(2-Benzoxazolylsulfanylmethyl)benzothioamide'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
