Bioactive Compound Details
| BioID | bio2001 |
|---|---|
| Name | AXOMADOL |
| ChEMBL ID | CHEMBL3989680 |
| Molecular Formula | C16H25NO3 |
| Molecular Weight | 279.38 |
| Molecular Weight (Monoisotopic) | 279.1834 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | AXOMADOL|Axomadol|BN-110 FREE BASE|BN110 BASE|BN110 FREE BASE|EN3324|GRT-151 FREE BASE|GRT0151Y|GRT151 Base|GRT151 FREE BASE |
| Smiles | COc1cccc(C2(O)CC(O)CCC2CN(C)C)c1 |
| Inchi | InChI=1S/C16H25NO3/c1-17(2)11-13-7-8-14(18)10-16(13,19)12-5-4-6-15(9-12)20-3/h4-6,9,13-14,18-19H,7-8,10-11H2,1-3H3 |
| Inchi Key | LQJLLAOISDVBJM-UHFFFAOYSA-N |
| Molecular Species | BASE |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | 0.84 |
| Records Key | ['AXOMADOL', 'AXOMADOL'] |
| Records Name | ['AXOMADOL', 'AXOMADOL'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
