| BioID | bio2031 |
|---|
| Name | DIAMFENETIDE |
|---|
| ChEMBL ID | CHEMBL2104259 |
|---|
| Molecular Formula | C20H24N2O5 |
|---|
| Molecular Weight | 372.42 |
|---|
| Molecular Weight (Monoisotopic) | 372.1685 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | COMPOUND 68-198|DIAMFENETIDA|DIAMFENETIDE|DIAMPHENETHIDE|NSC-291838 |
|---|
| Smiles | CC(=O)Nc1ccc(OCCOCCOc2ccc(NC(C)=O)cc2)cc1 |
|---|
| Inchi | InChI=1S/C20H24N2O5/c1-15(23)21-17-3-7-19(8-4-17)26-13-11-25-12-14-27-20-9-5-18(6-10-20)22-16(2)24/h3-10H,11-14H2,1-2H3,(H,21,23)(H,22,24) |
|---|
| Inchi Key | JNEZCZPNQCQCFK-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 7.0 |
|---|
| Np Likeness Score | -0.81 |
|---|
| Records Key | ['DIAMFENETIDE', 'SID170466181', 'SID144205451'] |
|---|
| Records Name | ['DIAMFENETIDE', 'SID170466181', 'SID144205451'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
