(E)-3-(phenacylamino)-1-phenylprop-2-en-1-one
Formula:C17H15NO2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-3-(phenacylamino)-1-phenylprop-2-en-1-one is a drug-like molecule.
| MolName | (E)-3-(phenacylamino)-1-phenylprop-2-en-1-one |
| MolecularFormula | C17H15NO2 |
| Smiles | O=C(CN/C=C/C(c1ccccc1)=O)c1ccccc1 |
| InChI | InChI=1S/C17H15NO2/c19-16(14-7-3-1-4-8-14)11-12-18-13-17(20)15-9-5-2-6-10-15/h1-12,18H,13H2 |
| InChIK | PEMFVEMHQGCMCZ-UHFFFAOYSA-N |
| TotalMolweight | 265.311 |
| Molweight | 265.311 |
| MonoisotopicMass | 265.110279 |
| CLogP | 1.7257 |
| CLogS | -3.895 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 220.24 |
| Relative PSA | 0.17045 |
| PolarSurfaceArea | 46.17 |
| Druglikeness | 1.6208 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| StereoCon |
Click to Load Molecule:
1 - (E)-3-(phenacylamino)-1-phenylprop-2-en-1-one | 2 - (E)-3-(phenacylamino)-1-phenylprop-2-en-1-one
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off