Bioactive Compound Details
| BioID | bio2488 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1269414 |
| Molecular Formula | C16H28O2 |
| Molecular Weight | 252.4 |
| Molecular Weight (Monoisotopic) | 252.2089 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | 9-Hexadecynoic Acid |
| Smiles | CCCCCCC#CCCCCCCCC(=O)O |
| Inchi | InChI=1S/C16H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-6,9-15H2,1H3,(H,17,18) |
| Inchi Key | PUVMMVZJPHBIGN-UHFFFAOYSA-N |
| Molecular Species | ACID |
| Targets | 10.0 |
| Bioactivities | 12.0 |
| Np Likeness Score | 0.73 |
| Records Key | ['9-HDA'] |
| Records Name | ['9-Hexadecynoic acid'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
