| MolName | 2-[(E)-2-(3-fluorophenyl)ethenyl]quinolin-8-ol |
| MolecularFormula | C17H12NOF |
| Smiles | Oc1c2nc(/C=C/c3cccc(F)c3)ccc2ccc1 |
| InChI | InChI=1S/C17H12FNO/c18-14-5-1-3-12(11-14)7-9-15-10-8-13-4-2-6-16(20)17(13)19-15/h1-11,20H |
| InChIK | SZKQDIDKTUDYEC-UHFFFAOYSA-N |
| TotalMolweight | 265.286 |
| Molweight | 265.286 |
| MonoisotopicMass | 265.090292 |
| CLogP | 3.9917 |
| CLogS | -4.5 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 205.58 |
| Relative PSA | 0.11708 |
| PolarSurfaceArea | 33.12 |
| Druglikeness | -2.739 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - 2-[(E)-2-(3-fluorophenyl)ethenyl]quinolin-8-ol | 2 - 2-[(E)-2-(3-fluorophenyl)ethenyl]quinolin-8-ol