| MolName | (1E,4E)-1-(2-hydroxyphenyl)-5-phenylpenta-1,4-dien-3-one |
| MolecularFormula | C17H14O2 |
| Smiles | Oc1c(/C=C/C(/C=C/c2ccccc2)=O)cccc1 |
| InChI | InChI=1S/C17H14O2/c18-16(12-10-14-6-2-1-3-7-14)13-11-15-8-4-5-9-17(15)19/h1-13,19H |
| InChIK | FDFRSFSHWUDRTJ-UHFFFAOYSA-N |
| TotalMolweight | 250.296 |
| Molweight | 250.296 |
| MonoisotopicMass | 250.09938 |
| CLogP | 3.5789 |
| CLogS | -3.69 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 210.12 |
| Relative PSA | 0.12441 |
| PolarSurfaceArea | 37.3 |
| Druglikeness | 0.68383 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.68421 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - (1E,4E)-1-(2-hydroxyphenyl)-5-phenylpenta-1,4-dien-3-one | 2 - (1E,4E)-1-(2-hydroxyphenyl)-5-phenylpenta-1,4-dien-3-one