| BioID | bio200579 |
|---|
| Name | APRICOXIB |
|---|
| ChEMBL ID | CHEMBL1835207 |
|---|
| Molecular Formula | C19H20N2O3S |
|---|
| Molecular Weight | 356.45 |
|---|
| Molecular Weight (Monoisotopic) | 356.1195 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | APRICOXIB|CS-706|R-109339|TG-01|TG01 |
|---|
| Smiles | CCOc1ccc(-c2cc(C)cn2-c2ccc(S(N)(=O)=O)cc2)cc1 |
|---|
| Inchi | InChI=1S/C19H20N2O3S/c1-3-24-17-8-4-15(5-9-17)19-12-14(2)13-21(19)16-6-10-18(11-7-16)25(20,22)23/h4-13H,3H2,1-2H3,(H2,20,22,23) |
|---|
| Inchi Key | JTMITOKKUMVWRT-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 9.0 |
|---|
| Np Likeness Score | -1.3 |
|---|
| Records Key | ['1, Apricoxib, CS-706', 'APRICOXIB', 'APRICOXIB'] |
|---|
| Records Name | ['2-(4-ethoxyphenyl)-4-methyl-1-(4-sulfamoylphenyl)-pyrrole', 'APRICOXIB', 'APRICOXIB'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
