| MolName | 2-[(E)-2-(4-fluorophenyl)ethenyl]-5-phenyl-1,3,4-oxadiazole |
| MolecularFormula | C16H11N2OF |
| Smiles | Fc1ccc(/C=C/c2nnc(-c3ccccc3)o2)cc1 |
| InChI | InChI=1S/C16H11FN2O/c17-14-9-6-12(7-10-14)8-11-15-18-19-16(20-15)13-4-2-1-3-5-13/h1-11H |
| InChIK | ZFOXOACDULQWMY-UHFFFAOYSA-N |
| TotalMolweight | 266.274 |
| Molweight | 266.274 |
| MonoisotopicMass | 266.085541 |
| CLogP | 3.682 |
| CLogS | -5.079 |
| H Acceptors | 3 |
| TotalSurfaceArea | 212.84 |
| Relative PSA | 0.16938 |
| PolarSurfaceArea | 38.92 |
| Druglikeness | -1.0357 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - 2-[(E)-2-(4-fluorophenyl)ethenyl]-5-phenyl-1,3,4-oxadiazole | 2 - 2-[(E)-2-(4-fluorophenyl)ethenyl]-5-phenyl-1,3,4-oxadiazole