Bioactive Compound Details
| BioID | bio2023 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1163330 |
| Molecular Formula | C19H15NO5 |
| Molecular Weight | 337.33 |
| Molecular Weight (Monoisotopic) | 337.095 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | 9-Methoxyisomoschatoline |
| Smiles | COc1ccc2c(c1)C(=O)c1nccc3c(O)c(OC)c(OC)c-2c13 |
| Inchi | InChI=1S/C19H15NO5/c1-23-9-4-5-10-12(8-9)16(21)15-13-11(6-7-20-15)17(22)19(25-3)18(24-2)14(10)13/h4-8,22H,1-3H3 |
| Inchi Key | BPGFXFZVEKUBLI-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 1.09 |
| Records Key | ['2'] |
| Records Name | ['9-methoxyisomoschatoline'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
