| BioID | bio198888 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL412603 |
|---|
| Molecular Formula | C14H10N2O3S |
|---|
| Molecular Weight | 286.31 |
|---|
| Molecular Weight (Monoisotopic) | 286.0412 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-(4-Nitrobenzylsulfanyl)Benzoxazole |
|---|
| Smiles | O=[N+]([O-])c1ccc(CSc2nc3ccccc3o2)cc1 |
|---|
| Inchi | InChI=1S/C14H10N2O3S/c17-16(18)11-7-5-10(6-8-11)9-20-14-15-12-3-1-2-4-13(12)19-14/h1-8H,9H2 |
|---|
| Inchi Key | OWRFFBWURVTRDI-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 25.0 |
|---|
| Bioactivities | 48.0 |
|---|
| Np Likeness Score | -1.98 |
|---|
| Records Key | ['4b', '3n', 'SID17411688'] |
|---|
| Records Name | ['2-(4-Nitro-benzylsulfanyl)-benzooxazole', '2-(4-Nitrobenzylsulfanyl)benzoxazole', 'SID17411688'] |
|---|
| Withdrawn Flag | False |
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| Orphan | -1 |
|---|
