Bioactive Compound Details
| BioID | bio198312 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1162486 |
| Molecular Formula | C8H16O2 |
| Molecular Weight | 144.21 |
| Molecular Weight (Monoisotopic) | 144.115 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | (S)-2-Ethylhexanoate |
| Smiles | CCCC[C@H](CC)C(=O)O |
| Inchi | InChI=1S/C8H16O2/c1-3-5-6-7(4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)/t7-/m0/s1 |
| Inchi Key | OBETXYAYXDNJHR-ZETCQYMHSA-N |
| Molecular Species | ACID |
| Targets | 3.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | 0.56 |
| Records Key | ['(S)-2-ethylhexanoate'] |
| Records Name | ['(S)-2-ethylhexanoate'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
