(Z)-3-[5-(2-fluorophenyl)furan-2-yl]-2-phenylprop-2-enenitrile
Formula:C19H12NOF
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
(Z)-3-[5-(2-fluorophenyl)furan-2-yl]-2-phenylprop-2-enenitrile is a drug-like molecule.
| MolName | (Z)-3-[5-(2-fluorophenyl)furan-2-yl]-2-phenylprop-2-enenitrile |
| MolecularFormula | C19H12NOF |
| Smiles | N#C/C(/c1ccccc1)=C\c1ccc(-c(cccc2)c2F)o1 |
| InChI | InChI=1S/C19H12FNO/c20-18-9-5-4-8-17(18)19-11-10-16(22-19)12-15(13-21)14-6-2-1-3-7-14/h1-12H |
| InChIK | LSJIGGORHQDMNL-UHFFFAOYSA-N |
| TotalMolweight | 289.308 |
| Molweight | 289.308 |
| MonoisotopicMass | 289.090292 |
| CLogP | 4.3723 |
| CLogS | -5.403 |
| H Acceptors | 2 |
| TotalSurfaceArea | 235.24 |
| Relative PSA | 0.11762 |
| PolarSurfaceArea | 36.93 |
| Druglikeness | -4.9182 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59091 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Symmetricatoms | 2 |
| StereoCon |
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