| BioID | bio3180 |
|---|
| Name | VERCIRNON SODIUM |
|---|
| ChEMBL ID | CHEMBL3039505 |
|---|
| Molecular Formula | C22H20ClN2NaO4S |
|---|
| Molecular Weight | 466.92 |
|---|
| Molecular Weight (Monoisotopic) | 444.0911 |
|---|
| Type | Small molecule |
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| Max Phase | Phase 3 |
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| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | GSK-1605786A|GSK1605786A|VERCIRNON SODIUM |
|---|
| Smiles | CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)c2cc[n+]([O-])cc2)cc1.[Na+] |
|---|
| Inchi | InChI=1S/C22H21ClN2O4S.Na/c1-22(2,3)16-4-7-18(8-5-16)30(28,29)24-20-9-6-17(23)14-19(20)21(26)15-10-12-25(27)13-11-15;/h4-14H,1-3H3,(H,24,26);/q;+1/p-1 |
|---|
| Inchi Key | RWWYDQSZJIFTES-UHFFFAOYSA-M |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | None |
|---|
| Bioactivities | None |
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| Np Likeness Score | -1.69 |
|---|
| Records Key | ['VERCIRNON SODIUM', 'VERCIRNON SODIUM'] |
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| Records Name | ['VERCIRNON SODIUM', 'VERCIRNON SODIUM'] |
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| Withdrawn Flag | False |
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| Orphan | 0 |
|---|
