| BioID | bio1921 |
|---|
| Name | NETOGLITAZONE |
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| ChEMBL ID | CHEMBL93747 |
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| Molecular Formula | C21H16FNO3S |
|---|
| Molecular Weight | 381.43 |
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| Molecular Weight (Monoisotopic) | 381.0835 |
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| Type | Small molecule |
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| Max Phase | Phase 2 |
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| Target ID | Tar12 |
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| Target Name | Toll-like receptor 9 (TLR9) |
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| Synonyms | MCC 555|MCC-555|MCC555|NETOGLITAZONA|NETOGLITAZONE|Netoglitazone|PGX-510|RWJ-241947|netoglitazone |
|---|
| Smiles | O=C1NC(=O)C(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)S1 |
|---|
| Inchi | InChI=1S/C21H16FNO3S/c22-18-4-2-1-3-16(18)12-26-17-8-7-14-9-13(5-6-15(14)11-17)10-19-20(24)23-21(25)27-19/h1-9,11,19H,10,12H2,(H,23,24,25) |
|---|
| Inchi Key | PKWDZWYVIHVNKS-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
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| Targets | 4.0 |
|---|
| Bioactivities | 6.0 |
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| Np Likeness Score | -0.71 |
|---|
| Records Key | ['NETOGLITAZONE', 'MCC-555', 'NETOGLITAZONE', 'COVC-3898611959', '2; MCC-55'] |
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| Records Name | ['NETOGLITAZONE', '5-[6-(2-Fluoro-benzyloxy)-naphthalen-2-ylmethyl]-thiazolidine-2,4-dione', 'NETOGLITAZONE', 'NETOGLITAZONE', 'Netoglitazone'] |
|---|
| Withdrawn Flag | False |
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| Orphan | 0 |
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