(E)-3-(4-chlorophenyl)-1-[5-(2,4-difluorophenyl)furan-2-yl]prop-2-en-1-one
Formula:C19H11O2ClF2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-3-(4-chlorophenyl)-1-[5-(2,4-difluorophenyl)furan-2-yl]prop-2-en-1-one is not a drug-like molecule.
| MolName | (E)-3-(4-chlorophenyl)-1-[5-(2,4-difluorophenyl)furan-2-yl]prop-2-en-1-one |
| MolecularFormula | C19H11O2ClF2 |
| Smiles | O=C(/C=C/c(cc1)ccc1Cl)c1ccc(-c(ccc(F)c2)c2F)o1 |
| InChI | InChI=1S/C19H11ClF2O2/c20-13-4-1-12(2-5-13)3-8-17(23)19-10-9-18(24-19)15-7-6-14(21)11-16(15)22/h1-11H |
| InChIK | SBGOQLUTWYQDJZ-UHFFFAOYSA-N |
| TotalMolweight | 344.743 |
| Molweight | 344.743 |
| MonoisotopicMass | 344.041563 |
| CLogP | 5.0503 |
| CLogS | -6.664 |
| H Acceptors | 2 |
| TotalSurfaceArea | 254.84 |
| Relative PSA | 0.10654 |
| PolarSurfaceArea | 30.21 |
| Druglikeness | 0.77969 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Symmetricatoms | 2 |
| StereoCon |
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