4-fluoro-N-[(E)-3-(4-fluorophenyl)iminoprop-1-enyl]aniline
Formula:C15H12N2F2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-fluoro-N-[(E)-3-(4-fluorophenyl)iminoprop-1-enyl]aniline is a drug-like molecule.
| MolName | 4-fluoro-N-[(E)-3-(4-fluorophenyl)iminoprop-1-enyl]aniline |
| MolecularFormula | C15H12N2F2 |
| Smiles | Fc(cc1)ccc1N/C=C/C=N/c(cc1)ccc1F |
| InChI | InChI=1S/C15H12F2N2/c16-12-2-6-14(7-3-12)18-10-1-11-19-15-8-4-13(17)5-9-15/h1-11,18H |
| InChIK | NAJOFPCAYQWTPJ-UHFFFAOYSA-N |
| TotalMolweight | 258.27 |
| Molweight | 258.27 |
| MonoisotopicMass | 258.096854 |
| CLogP | 2.424 |
| CLogS | -4.024 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 208.44 |
| Relative PSA | 0.1102 |
| PolarSurfaceArea | 24.39 |
| Druglikeness | -1.2308 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.78947 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 4 |
| StereoCon |
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1 - 4-fluoro-N-[(E)-3-(4-fluorophenyl)iminoprop-1-enyl]aniline | 2 - 4-fluoro-N-[(E)-3-(4-fluorophenyl)iminoprop-1-enyl]aniline
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