Bioactive Compound Details
| BioID | bio197785 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL146899 |
| Molecular Formula | C12H17NO4S |
| Molecular Weight | 271.34 |
| Molecular Weight (Monoisotopic) | 271.0878 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-Sulfamoyl-Benzoic Acid Pentyl Ester |
| Smiles | CCCCCOC(=O)c1ccccc1S(N)(=O)=O |
| Inchi | InChI=1S/C12H17NO4S/c1-2-3-6-9-17-12(14)10-7-4-5-8-11(10)18(13,15)16/h4-5,7-8H,2-3,6,9H2,1H3,(H2,13,15,16) |
| Inchi Key | NCRTWFXYVOSBJD-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 3.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | -0.96 |
| Records Key | ['29', '29 (table 1)'] |
| Records Name | ['2-Sulfamoyl-benzoic acid pentyl ester', '2-Sulfamoyl-benzoic acid pentyl ester'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
