Bioactive Compound Details
| BioID | bio199201 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1762647 |
| Molecular Formula | C8H15NaO2 |
| Molecular Weight | 166.2 |
| Molecular Weight (Monoisotopic) | 144.115 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Sodium 2-Ethylhexanoate |
| Smiles | CCCCC(CC)C(=O)[O-].[Na+] |
| Inchi | InChI=1S/C8H16O2.Na/c1-3-5-6-7(4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10);/q;+1/p-1 |
| Inchi Key | VYPDUQYOLCLEGS-UHFFFAOYSA-M |
| Molecular Species | ACID |
| Targets | 3.0 |
| Bioactivities | 6.0 |
| Np Likeness Score | 0.56 |
| Records Key | ['8'] |
| Records Name | ['sodium 2-Ethylhexanoate'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
