1-phenylmethoxy-4-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]benzene
Formula:C28H24O2
Mutagenic:low
Tumorigenic:none
Reproductive Effective:high
1-phenylmethoxy-4-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]benzene is not a drug-like molecule.
| MolName | 1-phenylmethoxy-4-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]benzene |
| MolecularFormula | C28H24O2 |
| Smiles | C(c1ccccc1)Oc1ccc(/C=C/c(cc2)ccc2OCc2ccccc2)cc1 |
| InChI | InChI=1S/C28H24O2/c1-3-7-25(8-4-1)21-29-27-17-13-23(14-18-27)11-12-24-15-19-28(20-16-24)30-22-26-9-5-2-6-10-26/h1-20H,21-22H2 |
| InChIK | ZFIGZWAXQLCRHF-UHFFFAOYSA-N |
| TotalMolweight | 392.497 |
| Molweight | 392.497 |
| MonoisotopicMass | 392.17763 |
| CLogP | 6.5628 |
| CLogS | -6.434 |
| H Acceptors | 2 |
| TotalSurfaceArea | 326.56 |
| Relative PSA | 0.061244 |
| PolarSurfaceArea | 18.46 |
| Druglikeness | -1.9351 |
| Mutagenic | low |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.73333 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 8 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 4 |
| Symmetricatoms | 19 |
| StereoCon |
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