Bioactive Compound Details
| BioID | bio2020 |
|---|---|
| Name | NORACYMETHADOL |
| ChEMBL ID | CHEMBL2111032 |
| Molecular Formula | C22H29NO2 |
| Molecular Weight | 339.48 |
| Molecular Weight (Monoisotopic) | 339.2198 |
| Type | Small molecule |
| Max Phase | Unknown |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | ACETYLNORMETHADOL|IDS-NN-004|NORACETYLMETHADOL|NORACETYLMETHADONE|NORACIMETADOL|NORACYMETHADOL |
| Smiles | CCC(OC(C)=O)C(CC(C)NC)(c1ccccc1)c1ccccc1 |
| Inchi | InChI=1S/C22H29NO2/c1-5-21(25-18(3)24)22(16-17(2)23-4,19-12-8-6-9-13-19)20-14-10-7-11-15-20/h6-15,17,21,23H,5,16H2,1-4H3 |
| Inchi Key | VWCUGCYZZGRKEE-UHFFFAOYSA-N |
| Molecular Species | BASE |
| Targets | 1.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 0.31 |
| Records Key | ['COVC-3362063083'] |
| Records Name | ['NORACYMETHADOL'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
