N'-hydroxy-2-[3-(trifluoromethyl)phenoxy]ethanimidamide
Formula:C9H9N2O2F3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-hydroxy-2-[3-(trifluoromethyl)phenoxy]ethanimidamide is a drug-like molecule.
| MolName | N'-hydroxy-2-[3-(trifluoromethyl)phenoxy]ethanimidamide |
| MolecularFormula | C9H9N2O2F3 |
| Smiles | N/C(/COc1cccc(C(F)(F)F)c1)=N/O |
| InChI | InChI=1S/C9H9F3N2O2/c10-9(11,12)6-2-1-3-7(4-6)16-5-8(13)14-15/h1-4,15H,5H2,(H2,13,14) |
| InChIK | SKUBUDPNDFNCOV-UHFFFAOYSA-N |
| TotalMolweight | 234.176 |
| Molweight | 234.176 |
| MonoisotopicMass | 234.061612 |
| CLogP | 1.7915 |
| CLogS | -2.638 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 164.32 |
| Relative PSA | 0.30355 |
| PolarSurfaceArea | 67.84 |
| Druglikeness | -8.9177 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| StereoCon |
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