| BioID | bio2136 |
|---|
| Name | ITAZIGREL |
|---|
| ChEMBL ID | CHEMBL277592 |
|---|
| Molecular Formula | C18H14F3NO2S |
|---|
| Molecular Weight | 365.38 |
|---|
| Molecular Weight (Monoisotopic) | 365.0697 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | ITAZIGREL|ITAZOGREL|U-53,059|U-53059 |
|---|
| Smiles | COc1ccc(-c2nc(C(F)(F)F)sc2-c2ccc(OC)cc2)cc1 |
|---|
| Inchi | InChI=1S/C18H14F3NO2S/c1-23-13-7-3-11(4-8-13)15-16(25-17(22-15)18(19,20)21)12-5-9-14(24-2)10-6-12/h3-10H,1-2H3 |
|---|
| Inchi Key | CIPBQTCSXVEDSG-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 6.0 |
|---|
| Bioactivities | 26.0 |
|---|
| Np Likeness Score | -0.8 |
|---|
| Records Key | ['itazigrel', 'ITAZIGREL', '16', 'COVC-3362084144'] |
|---|
| Records Name | ['4,5-Bis-(4-methoxy-phenyl)-2-trifluoromethyl-thiazole', 'ITAZIGREL', '4,5-Bis-(4-methoxy-phenyl)-2-trifluoromethyl-thiazole', 'ITAZIGREL'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
