(Z)-3-[2-(2-phenoxyethoxy)phenyl]-2-phenylprop-2-enenitrile
Formula:C23H19NO2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
(Z)-3-[2-(2-phenoxyethoxy)phenyl]-2-phenylprop-2-enenitrile is a drug-like molecule.
| MolName | (Z)-3-[2-(2-phenoxyethoxy)phenyl]-2-phenylprop-2-enenitrile |
| MolecularFormula | C23H19NO2 |
| Smiles | N#C/C(/c1ccccc1)=C\c(cccc1)c1OCCOc1ccccc1 |
| InChI | InChI=1S/C23H19NO2/c24-18-21(19-9-3-1-4-10-19)17-20-11-7-8-14-23(20)26-16-15-25-22-12-5-2-6-13-22/h1-14,17H,15-16H2 |
| InChIK | VOVLUBXLVPNPBV-UHFFFAOYSA-N |
| TotalMolweight | 341.409 |
| Molweight | 341.409 |
| MonoisotopicMass | 341.141579 |
| CLogP | 4.6876 |
| CLogS | -4.897 |
| H Acceptors | 3 |
| TotalSurfaceArea | 286.72 |
| Relative PSA | 0.11705 |
| PolarSurfaceArea | 42.25 |
| Druglikeness | -12.162 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61538 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| StereoCon |
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