Bioactive Compound Details
| BioID | bio197746 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL2206135 |
| Molecular Formula | C12H14N2OS |
| Molecular Weight | 234.32 |
| Molecular Weight (Monoisotopic) | 234.0827 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-(3-Methyl)Butanoylaminobenzothiazole |
| Smiles | CC(C)CC(=O)Nc1nc2ccccc2s1 |
| Inchi | InChI=1S/C12H14N2OS/c1-8(2)7-11(15)14-12-13-9-5-3-4-6-10(9)16-12/h3-6,8H,7H2,1-2H3,(H,13,14,15) |
| Inchi Key | NBRMFMQFVLZHGS-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 9.0 |
| Bioactivities | 16.0 |
| Np Likeness Score | -2.26 |
| Records Key | ['3g'] |
| Records Name | ['2-(3-Methyl)butanoylaminobenzothiazole'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
