| MolName | (E)-1-[5-(4-fluorophenyl)furan-2-yl]-3-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-en-1-one |
| MolecularFormula | C24H14O3F4 |
| Smiles | O=C(/C=C/c1ccc(-c2cc(C(F)(F)F)ccc2)o1)c1ccc(-c(cc2)ccc2F)o1 |
| InChI | InChI=1S/C24H14F4O3/c25-18-6-4-15(5-7-18)21-12-13-23(31-21)20(29)10-8-19-9-11-22(30-19)16-2-1-3-17(14-16)24(26,27)28/h1-14H |
| InChIK | OFYDXLOUQCPNEP-UHFFFAOYSA-N |
| TotalMolweight | 426.364 |
| Molweight | 426.364 |
| MonoisotopicMass | 426.087907 |
| CLogP | 6.1307 |
| CLogS | -7.852 |
| H Acceptors | 3 |
| TotalSurfaceArea | 311.98 |
| Relative PSA | 0.13225 |
| PolarSurfaceArea | 43.35 |
| Druglikeness | -5.1395 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6129 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| StereoCon |
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1 - (E)-1-[5-(4-fluorophenyl)furan-2-yl]-3-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-en-1-one | 2 - (E)-1-[5-(4-fluorophenyl)furan-2-yl]-3-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-en-1-one