| BioID | bio199039 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL271677 |
|---|
| Molecular Formula | C11H22O4S2 |
|---|
| Molecular Weight | 282.43 |
|---|
| Molecular Weight (Monoisotopic) | 282.096 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-(Methylsulfonylthio)Ethyl 2-Propylpentanoate |
|---|
| Smiles | CCCC(CCC)C(=O)OCCSS(C)(=O)=O |
|---|
| Inchi | InChI=1S/C11H22O4S2/c1-4-6-10(7-5-2)11(12)15-8-9-16-17(3,13)14/h10H,4-9H2,1-3H3 |
|---|
| Inchi Key | ZHKBCGORMGLCBI-UHFFFAOYSA-N |
|---|
| Molecular Species | None |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 3.0 |
|---|
| Np Likeness Score | -0.51 |
|---|
| Records Key | ['ACS 33'] |
|---|
| Records Name | ['2-(methylsulfonylthio)ethyl 2-propylpentanoate'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
