| BioID | bio199752 |
|---|
| Name | METHYL 2-(2-((1,4-DIMETHYL-3-P-TOLYL-1H-PYRAZOL-5-YLOXY)METHYL)PHENYL)-3-METHOXYACRYLATE |
|---|
| ChEMBL ID | CHEMBL2285954 |
|---|
| Molecular Formula | C24H26N2O4 |
|---|
| Molecular Weight | 406.48 |
|---|
| Molecular Weight (Monoisotopic) | 406.1893 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | None |
|---|
| Smiles | CO/C=C(/C(=O)OC)c1ccccc1COc1c(C)c(-c2ccc(C)cc2)nn1C |
|---|
| Inchi | InChI=1S/C24H26N2O4/c1-16-10-12-18(13-11-16)22-17(2)23(26(3)25-22)30-14-19-8-6-7-9-20(19)21(15-28-4)24(27)29-5/h6-13,15H,14H2,1-5H3/b21-15+ |
|---|
| Inchi Key | HQUXDPLSULSMJN-RCCKNPSSSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 5.0 |
|---|
| Bioactivities | 12.0 |
|---|
| Np Likeness Score | -0.45 |
|---|
| Records Key | ['27'] |
|---|
| Records Name | ['methyl 2-(2-((1,4-dimethyl-3-p-tolyl-1H-pyrazol-5-yloxy)methyl)phenyl)-3-methoxyacrylate'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
