| BioID | bio199854 |
|---|
| Name | METHYL 2-(2-((3-(3,4-DIMETHYLPHENYL)-1,4-DIMETHYL-1H-PYRAZOL-5-YLOXY)METHYL)PHENYL)-3-METHOXYACRYLATE |
|---|
| ChEMBL ID | CHEMBL2285955 |
|---|
| Molecular Formula | C25H28N2O4 |
|---|
| Molecular Weight | 420.51 |
|---|
| Molecular Weight (Monoisotopic) | 420.2049 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar81 |
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| Target Name | None |
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| Synonyms | None |
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| Smiles | CO/C=C(/C(=O)OC)c1ccccc1COc1c(C)c(-c2ccc(C)c(C)c2)nn1C |
|---|
| Inchi | InChI=1S/C25H28N2O4/c1-16-11-12-19(13-17(16)2)23-18(3)24(27(4)26-23)31-14-20-9-7-8-10-21(20)22(15-29-5)25(28)30-6/h7-13,15H,14H2,1-6H3/b22-15+ |
|---|
| Inchi Key | LZGAWDRWARLIGA-PXLXIMEGSA-N |
|---|
| Molecular Species | NEUTRAL |
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| Targets | 5.0 |
|---|
| Bioactivities | 12.0 |
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| Np Likeness Score | -0.53 |
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| Records Key | ['28'] |
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| Records Name | ['methyl 2-(2-((3-(3,4-dimethylphenyl)-1,4-dimethyl-1H-pyrazol-5-yloxy)methyl)phenyl)-3-methoxyacrylate'] |
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| Withdrawn Flag | False |
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| Orphan | -1 |
|---|
