(Z)-N-[(2,4-dichlorophenyl)methoxy]-1-[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methanimine
Formula:C20H13N2O2Cl2F3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-N-[(2,4-dichlorophenyl)methoxy]-1-[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methanimine is not a drug-like molecule.
| MolName | (Z)-N-[(2,4-dichlorophenyl)methoxy]-1-[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methanimine |
| MolecularFormula | C20H13N2O2Cl2F3 |
| Smiles | FC(c1cccc(Oc2ncc(/C=N\OCc(ccc(Cl)c3)c3Cl)cc2)c1)(F)F |
| InChI | InChI=1S/C20H13Cl2F3N2O2/c21-16-6-5-14(18(22)9-16)12-28-27-11-13-4-7-19(26-10-13)29-17-3-1-2-15(8-17)20(23,24)25/h1-11H,12H2 |
| InChIK | SGFPPAUJSVTUQR-UHFFFAOYSA-N |
| TotalMolweight | 441.235 |
| Molweight | 441.235 |
| MonoisotopicMass | 440.030616 |
| CLogP | 6.6421 |
| CLogS | -7.919 |
| H Acceptors | 4 |
| TotalSurfaceArea | 310.36 |
| Relative PSA | 0.13687 |
| PolarSurfaceArea | 43.71 |
| Druglikeness | -7.0831 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65517 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (Z)-N-[(2,4-dichlorophenyl)methoxy]-1-[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methanimine | 2 - (Z)-N-[(2,4-dichlorophenyl)methoxy]-1-[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methanimine
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