(E)-3-naphthalen-1-yl-1-(4-phenylphenyl)prop-2-en-1-one
Formula:C25H18O
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
(E)-3-naphthalen-1-yl-1-(4-phenylphenyl)prop-2-en-1-one is not a drug-like molecule.
| MolName | (E)-3-naphthalen-1-yl-1-(4-phenylphenyl)prop-2-en-1-one |
| MolecularFormula | C25H18O |
| Smiles | O=C(/C=C/c1cccc2ccccc12)c(cc1)ccc1-c1ccccc1 |
| InChI | InChI=1S/C25H18O/c26-25(18-17-22-11-6-10-21-9-4-5-12-24(21)22)23-15-13-20(14-16-23)19-7-2-1-3-8-19/h1-18H |
| InChIK | ZFZAYVVVWCCISH-UHFFFAOYSA-N |
| TotalMolweight | 334.417 |
| Molweight | 334.417 |
| MonoisotopicMass | 334.135765 |
| CLogP | 6.1574 |
| CLogS | -7.532 |
| H Acceptors | 1 |
| TotalSurfaceArea | 271.63 |
| Relative PSA | 0.048006 |
| PolarSurfaceArea | 17.07 |
| Druglikeness | 0.1125 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61538 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Symmetricatoms | 4 |
| StereoCon |
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