| BioID | bio2631 |
|---|
| Name | ELRAGLUSIB |
|---|
| ChEMBL ID | CHEMBL483465 |
|---|
| Molecular Formula | C22H13FN2O5 |
|---|
| Molecular Weight | 404.35 |
|---|
| Molecular Weight (Monoisotopic) | 404.0808 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | 9 ING 41|9-ING-41|ELRAGLUSIB |
|---|
| Smiles | Cn1cc(C2=C(c3coc4ccc(F)cc34)C(=O)NC2=O)c2cc3c(cc21)OCO3 |
|---|
| Inchi | InChI=1S/C22H13FN2O5/c1-25-7-13(11-5-17-18(6-15(11)25)30-9-29-17)19-20(22(27)24-21(19)26)14-8-28-16-3-2-10(23)4-12(14)16/h2-8H,9H2,1H3,(H,24,26,27) |
|---|
| Inchi Key | FARXPFGGGGLENU-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 4.0 |
|---|
| Bioactivities | 7.0 |
|---|
| Np Likeness Score | -0.19 |
|---|
| Records Key | ['26', 'ELRAGLUSIB', 'ELRAGLUSIB'] |
|---|
| Records Name | ['3-(5-Fluorobenzofuran-3-yl)-4-(5-methyl-5H-[1,3]dioxolo[4,5-f]indol-7-yl)pyrrole-2,5-dione', 'ELRAGLUSIB', 'ELRAGLUSIB'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
