| BioID | bio200520 |
|---|
| Name | POLMACOXIB |
|---|
| ChEMBL ID | CHEMBL166863 |
|---|
| Molecular Formula | C18H16FNO4S |
|---|
| Molecular Weight | 361.39 |
|---|
| Molecular Weight (Monoisotopic) | 361.0784 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 3 |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | CG-100649|CG100649|POLMACOXIB |
|---|
| Smiles | CC1(C)OC(c2ccc(S(N)(=O)=O)cc2)=C(c2cccc(F)c2)C1=O |
|---|
| Inchi | InChI=1S/C18H16FNO4S/c1-18(2)17(21)15(12-4-3-5-13(19)10-12)16(24-18)11-6-8-14(9-7-11)25(20,22)23/h3-10H,1-2H3,(H2,20,22,23) |
|---|
| Inchi Key | IJWPAFMIFNSIGD-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 5.0 |
|---|
| Bioactivities | 15.0 |
|---|
| Np Likeness Score | -0.41 |
|---|
| Records Key | ['20b', 'POLMACOXIB', '129', 'POLMACOXIB', '41', 'POLMACOXIB'] |
|---|
| Records Name | ['4-[3-(3-Fluoro-phenyl)-5,5-dimethyl-4-oxo-4,5-dihydro-furan-2-yl]-benzenesulfonamide', 'POLMACOXIB', '4-(3-(3-fluorophenyl)-5,5-dimethyl-4-oxo-4,5-dihydrofuran-2-yl)benzenesulfonamide', 'POLMACOXIB', '4-(3-(3-fluorophenyl)-5,5-dimethyl-4-oxo-4,5-dihydrofuran-2-yl)benzenesulfonamide', 'POLMACOXIB'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
