| BioID | bio2390 |
|---|
| Name | MIPITROBAN |
|---|
| ChEMBL ID | CHEMBL18197 |
|---|
| Molecular Formula | C19H19Cl2N3O2 |
|---|
| Molecular Weight | 392.29 |
|---|
| Molecular Weight (Monoisotopic) | 391.0854 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | MIPITROBAN|Mipitroban |
|---|
| Smiles | CC(C)(CC(=O)O)Cc1nc2cc(Cl)cnc2n1Cc1ccc(Cl)cc1 |
|---|
| Inchi | InChI=1S/C19H19Cl2N3O2/c1-19(2,9-17(25)26)8-16-23-15-7-14(21)10-22-18(15)24(16)11-12-3-5-13(20)6-4-12/h3-7,10H,8-9,11H2,1-2H3,(H,25,26) |
|---|
| Inchi Key | NJDYXRUUHUXUDU-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | -1.21 |
|---|
| Records Key | ['23a (UP116-77)', 'MIPITROBAN'] |
|---|
| Records Name | ['4-[6-Chloro-3-(4-chloro-benzyl)-3H-imidazo[4,5-b]pyridin-2-yl]-3,3-dimethyl-butyric acid', 'MIPITROBAN'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
