(E)-3-phenyl-N-(4-phenylbutyl)prop-2-enamide
Formula:C19H21NO
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-3-phenyl-N-(4-phenylbutyl)prop-2-enamide is a drug-like molecule.
| MolName | (E)-3-phenyl-N-(4-phenylbutyl)prop-2-enamide |
| MolecularFormula | C19H21NO |
| Smiles | O=C(/C=C/c1ccccc1)NCCCCc1ccccc1 |
| InChI | InChI=1S/C19H21NO/c21-19(15-14-18-11-5-2-6-12-18)20-16-8-7-13-17-9-3-1-4-10-17/h1-6,9-12,14-15H,7-8,13,16H2,(H,20,21) |
| InChIK | POGCSVZYJQGNCG-UHFFFAOYSA-N |
| TotalMolweight | 279.382 |
| Molweight | 279.382 |
| MonoisotopicMass | 279.162314 |
| CLogP | 4.1846 |
| CLogS | -3.966 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 243.77 |
| Relative PSA | 0.1005 |
| PolarSurfaceArea | 29.1 |
| Druglikeness | -3.8911 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7619 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 7 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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