| BioID | bio2966 |
|---|
| Name | ROBALZOTAN |
|---|
| ChEMBL ID | CHEMBL1628569 |
|---|
| Molecular Formula | C18H23FN2O2 |
|---|
| Molecular Weight | 318.39 |
|---|
| Molecular Weight (Monoisotopic) | 318.1744 |
|---|
| Type | Small molecule |
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| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | AZD-7371|NAD-299|ROBALZOTAN|Robalzotan |
|---|
| Smiles | NC(=O)c1ccc(F)c2c1C[C@@H](N(C1CCC1)C1CCC1)CO2 |
|---|
| Inchi | InChI=1S/C18H23FN2O2/c19-16-8-7-14(18(20)22)15-9-13(10-23-17(15)16)21(11-3-1-4-11)12-5-2-6-12/h7-8,11-13H,1-6,9-10H2,(H2,20,22)/t13-/m1/s1 |
|---|
| Inchi Key | MQTUXRKNJYPMCG-CYBMUJFWSA-N |
|---|
| Molecular Species | BASE |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 6.0 |
|---|
| Np Likeness Score | -0.47 |
|---|
| Records Key | ['ROBALZOTAN', 'ROBALZOTAN', 'ROBALZOTAN', 'robalzotan', 'robalzotan', 'robalzotan'] |
|---|
| Records Name | ['ROBALZOTAN', 'ROBALZOTAN', 'ROBALZOTAN', 'robalzotan', 'robalzotan', 'robalzotan'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
