(Z)-2-(2,4-difluorophenyl)-3-phenylprop-2-enenitrile
Formula:C15H9NF2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
(Z)-2-(2,4-difluorophenyl)-3-phenylprop-2-enenitrile is a drug-like molecule.
| MolName | (Z)-2-(2,4-difluorophenyl)-3-phenylprop-2-enenitrile |
| MolecularFormula | C15H9NF2 |
| Smiles | N#C/C(/c(ccc(F)c1)c1F)=C\c1ccccc1 |
| InChI | InChI=1S/C15H9F2N/c16-13-6-7-14(15(17)9-13)12(10-18)8-11-4-2-1-3-5-11/h1-9H |
| InChIK | TVRQEWMHECDWQN-UHFFFAOYSA-N |
| TotalMolweight | 241.239 |
| Molweight | 241.239 |
| MonoisotopicMass | 241.070305 |
| CLogP | 3.5342 |
| CLogS | -4.257 |
| H Acceptors | 1 |
| TotalSurfaceArea | 192.14 |
| Relative PSA | 0.070574 |
| PolarSurfaceArea | 23.79 |
| Druglikeness | -6.4198 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61111 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 2 |
| StereoCon |
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