| BioID | bio200446 |
|---|
| Name | PARECOXIB |
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| ChEMBL ID | CHEMBL1206690 |
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| Molecular Formula | C19H18N2O4S |
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| Molecular Weight | 370.43 |
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| Molecular Weight (Monoisotopic) | 370.0987 |
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| Type | Small molecule |
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| Max Phase | Phase 4 |
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| Target ID | Tar81 |
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| Target Name | None |
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| Synonyms | PARECOXIB|RAYZON|SC-69124|XAPIT |
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| Smiles | CCC(=O)NS(=O)(=O)c1ccc(-c2c(-c3ccccc3)noc2C)cc1 |
|---|
| Inchi | InChI=1S/C19H18N2O4S/c1-3-17(22)21-26(23,24)16-11-9-14(10-12-16)18-13(2)25-20-19(18)15-7-5-4-6-8-15/h4-12H,3H2,1-2H3,(H,21,22) |
|---|
| Inchi Key | TZRHLKRLEZJVIJ-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 9.0 |
|---|
| Bioactivities | 38.0 |
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| Np Likeness Score | -1.18 |
|---|
| Records Key | ['PARECOXIB', 'Parecoxib', 'PARECOXIB', 'Parecoxib', 'PARECOXIB', 'PARECOXIB', 'Parecoxib', 'Parecoxib', 'PARECOXIB', 'Parecoxib', 'Parecoxib sodium脢', 'Parecoxib sodium脗', 'Parecoxib', 'Parecoxib', 'COVC-2835171900', 'Parecoxib', 'Parecoxib'] |
|---|
| Records Name | ['PARECOXIB', 'Parecoxib', 'PARECOXIB', 'Parecoxib', 'PARECOXIB', 'PARECOXIB', 'Parecoxib', 'Parecoxib', 'PARECOXIB', 'Parecoxib', 'Parecoxib sodium脢', 'Parecoxib sodium脗', 'Parecoxib', 'Parecoxib', 'PARECOXIB SODIUM', 'Parecoxib', 'Parecoxib'] |
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| Withdrawn Flag | False |
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| Orphan | 0 |
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