(E)-1-(furan-3-yl)-3-naphthalen-2-ylprop-2-en-1-one
Formula:C17H12O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-1-(furan-3-yl)-3-naphthalen-2-ylprop-2-en-1-one is a drug-like molecule.
| MolName | (E)-1-(furan-3-yl)-3-naphthalen-2-ylprop-2-en-1-one |
| MolecularFormula | C17H12O2 |
| Smiles | O=C(/C=C/c1cc2ccccc2cc1)c1cocc1 |
| InChI | InChI=1S/C17H12O2/c18-17(16-9-10-19-12-16)8-6-13-5-7-14-3-1-2-4-15(14)11-13/h1-12H |
| InChIK | GVRRNXHKGSQJBT-UHFFFAOYSA-N |
| TotalMolweight | 248.28 |
| Molweight | 248.28 |
| MonoisotopicMass | 248.08373 |
| CLogP | 3.6329 |
| CLogS | -5.104 |
| H Acceptors | 2 |
| TotalSurfaceArea | 201.56 |
| Relative PSA | 0.1347 |
| PolarSurfaceArea | 30.21 |
| Druglikeness | 0.60619 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.63158 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| StereoCon |
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