(E)-3-naphthalen-2-yl-1-phenylprop-2-en-1-one
Formula:C19H14O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-3-naphthalen-2-yl-1-phenylprop-2-en-1-one is a drug-like molecule.
| MolName | (E)-3-naphthalen-2-yl-1-phenylprop-2-en-1-one |
| MolecularFormula | C19H14O |
| Smiles | O=C(/C=C/c1cc2ccccc2cc1)c1ccccc1 |
| InChI | InChI=1S/C19H14O/c20-19(17-7-2-1-3-8-17)13-11-15-10-12-16-6-4-5-9-18(16)14-15/h1-14H |
| InChIK | PPOCACRLAHOHAW-UHFFFAOYSA-N |
| TotalMolweight | 258.319 |
| Molweight | 258.319 |
| MonoisotopicMass | 258.104465 |
| CLogP | 4.4982 |
| CLogS | -5.446 |
| H Acceptors | 1 |
| TotalSurfaceArea | 211.87 |
| Relative PSA | 0.061547 |
| PolarSurfaceArea | 17.07 |
| Druglikeness | 0.1125 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Symmetricatoms | 2 |
| StereoCon |
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