(4E)-2-naphthalen-1-yl-4-(naphthalen-2-ylmethylidene)-1,3-oxazol-5-one
Formula:C24H15NO2
Mutagenic:low
Tumorigenic:high
Reproductive Effective:none
(4E)-2-naphthalen-1-yl-4-(naphthalen-2-ylmethylidene)-1,3-oxazol-5-one is a drug-like molecule.
| MolName | (4E)-2-naphthalen-1-yl-4-(naphthalen-2-ylmethylidene)-1,3-oxazol-5-one |
| MolecularFormula | C24H15NO2 |
| Smiles | O=C1OC(c2cccc3ccccc23)=N/C1=C/c1cc2ccccc2cc1 |
| InChI | InChI=1S/C24H15NO2/c26-24-22(15-16-12-13-17-6-1-2-8-19(17)14-16)25-23(27-24)21-11-5-9-18-7-3-4-10-20(18)21/h1-15H |
| InChIK | FWLRXGAXJGOFRJ-UHFFFAOYSA-N |
| TotalMolweight | 349.388 |
| Molweight | 349.388 |
| MonoisotopicMass | 349.110279 |
| CLogP | 4.9806 |
| CLogS | -7.131 |
| H Acceptors | 3 |
| TotalSurfaceArea | 264.15 |
| Relative PSA | 0.1308 |
| PolarSurfaceArea | 38.66 |
| Druglikeness | 0.83709 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.55556 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 2 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 20 |
| Sp3Atoms | 1 |
| StereoCon |
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