(E)-1-(4-morpholin-4-ylphenyl)-3-(4-phenylphenyl)prop-2-en-1-one
Formula:C25H23NO2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-1-(4-morpholin-4-ylphenyl)-3-(4-phenylphenyl)prop-2-en-1-one is a drug-like molecule.
| MolName | (E)-1-(4-morpholin-4-ylphenyl)-3-(4-phenylphenyl)prop-2-en-1-one |
| MolecularFormula | C25H23NO2 |
| Smiles | O=C(/C=C/c(cc1)ccc1-c1ccccc1)c(cc1)ccc1N1CCOCC1 |
| InChI | InChI=1S/C25H23NO2/c27-25(23-11-13-24(14-12-23)26-16-18-28-19-17-26)15-8-20-6-9-22(10-7-20)21-4-2-1-3-5-21/h1-15H,16-19H2 |
| InChIK | JOHUPCVGNNTUCB-UHFFFAOYSA-N |
| TotalMolweight | 369.463 |
| Molweight | 369.463 |
| MonoisotopicMass | 369.172879 |
| CLogP | 4.632 |
| CLogS | -6.029 |
| H Acceptors | 3 |
| TotalSurfaceArea | 298.87 |
| Relative PSA | 0.088968 |
| PolarSurfaceArea | 29.54 |
| Druglikeness | 2.1759 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.67857 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 5 |
| Symmetricatoms | 8 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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