| MolName | (Z)-N-(3-fluorophenyl)-4-hydroxy-2-oxo-4-phenylbut-3-enamide |
| MolecularFormula | C16H12NO3F |
| Smiles | O/C(/c1ccccc1)=C\C(C(Nc1cccc(F)c1)=O)=O |
| InChI | InChI=1S/C16H12FNO3/c17-12-7-4-8-13(9-12)18-16(21)15(20)10-14(19)11-5-2-1-3-6-11/h1-10,19H,(H,18,21) |
| InChIK | RGXCJJQVCAXKAQ-UHFFFAOYSA-N |
| TotalMolweight | 285.273 |
| Molweight | 285.273 |
| MonoisotopicMass | 285.080122 |
| CLogP | 1.9334 |
| CLogS | -3.267 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 217.39 |
| Relative PSA | 0.23295 |
| PolarSurfaceArea | 66.4 |
| Druglikeness | -1.8153 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61905 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - (Z)-N-(3-fluorophenyl)-4-hydroxy-2-oxo-4-phenylbut-3-enamide | 2 - (Z)-N-(3-fluorophenyl)-4-hydroxy-2-oxo-4-phenylbut-3-enamide