| BioID | bio1942 |
|---|
| Name | LOBEGLITAZONE |
|---|
| ChEMBL ID | CHEMBL3585580 |
|---|
| Molecular Formula | C24H24N4O5S |
|---|
| Molecular Weight | 480.55 |
|---|
| Molecular Weight (Monoisotopic) | 480.1467 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 3 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | LOBEGLITAZONA|LOBEGLITAZONE|Lobeglitazone |
|---|
| Smiles | COc1ccc(Oc2cc(N(C)CCOc3ccc(CC4SC(=O)NC4=O)cc3)ncn2)cc1 |
|---|
| Inchi | InChI=1S/C24H24N4O5S/c1-28(21-14-22(26-15-25-21)33-19-9-7-17(31-2)8-10-19)11-12-32-18-5-3-16(4-6-18)13-20-23(29)27-24(30)34-20/h3-10,14-15,20H,11-13H2,1-2H3,(H,27,29,30) |
|---|
| Inchi Key | CHHXEZSCHQVSRE-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 4.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | -0.73 |
|---|
| Records Key | ['lobeglitazone', 'LOBEGLITAZONE', 'LOBEGLITAZONE', '37'] |
|---|
| Records Name | ['lobeglitazone', 'LOBEGLITAZONE', 'LOBEGLITAZONE', 'Lobeglitazone'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
