| BioID | bio199859 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL394373 |
|---|
| Molecular Formula | C15H17F3O2 |
|---|
| Molecular Weight | 286.29 |
|---|
| Molecular Weight (Monoisotopic) | 286.1181 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar81 |
|---|
| Target Name | None |
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| Synonyms | Methyl 2-(4-(Trifluoromethyl)Phenyl)Cyclohexanecarboxylate |
|---|
| Smiles | COC(=O)[C@@H]1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 |
|---|
| Inchi | InChI=1S/C15H17F3O2/c1-20-14(19)13-5-3-2-4-12(13)10-6-8-11(9-7-10)15(16,17)18/h6-9,12-13H,2-5H2,1H3/t12-,13-/m1/s1 |
|---|
| Inchi Key | RILPYESNVZTTIN-CHWSQXEVSA-N |
|---|
| Molecular Species | None |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 3.0 |
|---|
| Np Likeness Score | -0.19 |
|---|
| Records Key | ['21n'] |
|---|
| Records Name | ['methyl 2-(4-(trifluoromethyl)phenyl)cyclohexanecarboxylate'] |
|---|
| Withdrawn Flag | False |
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| Orphan | -1 |
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