(2Z)-2-[(4-phenylphenyl)methylidene]acenaphthylen-1-one
Formula:C25H16O
Mutagenic:high
Tumorigenic:high
Reproductive Effective:high
(2Z)-2-[(4-phenylphenyl)methylidene]acenaphthylen-1-one is not a drug-like molecule.
| MolName | (2Z)-2-[(4-phenylphenyl)methylidene]acenaphthylen-1-one |
| MolecularFormula | C25H16O |
| Smiles | O=C(/C1=C\c(cc2)ccc2-c2ccccc2)c2cccc3cccc1c23 |
| InChI | InChI=1S/C25H16O/c26-25-22-11-5-9-20-8-4-10-21(24(20)22)23(25)16-17-12-14-19(15-13-17)18-6-2-1-3-7-18/h1-16H |
| InChIK | UAJIQGFXSYNTFB-UHFFFAOYSA-N |
| TotalMolweight | 332.401 |
| Molweight | 332.401 |
| MonoisotopicMass | 332.120115 |
| CLogP | 5.932 |
| CLogS | -7.403 |
| H Acceptors | 1 |
| TotalSurfaceArea | 256.34 |
| Relative PSA | 0.05087 |
| PolarSurfaceArea | 17.07 |
| Druglikeness | 0.45162 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.53846 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Symmetricatoms | 4 |
| StereoCon |
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