Bioactive Compound Details
| BioID | bio2166 |
|---|---|
| Name | DROCLIDINIUM |
| ChEMBL ID | CHEMBL2110832 |
| Molecular Formula | C22H32NO3+ |
| Molecular Weight | 358.5 |
| Molecular Weight (Monoisotopic) | 358.2377 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | DROCLIDINIUM CATION|DROCLIDINIUM ION |
| Smiles | C[N+]12CCC(CC1)C(OC(=O)C(O)(c1ccccc1)C1CCCCC1)C2 |
| Inchi | InChI=1S/C22H32NO3/c1-23-14-12-17(13-15-23)20(16-23)26-21(24)22(25,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2,4-5,8-9,17,19-20,25H,3,6-7,10-16H2,1H3/q+1 |
| Inchi Key | UEJRWWYWBNGGBE-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | 0.5 |
| Records Key | None |
| Records Name | None |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
