(Z)-1-(4-fluorophenyl)-3-(phenacylamino)prop-2-en-1-one
Formula:C17H14NO2F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-1-(4-fluorophenyl)-3-(phenacylamino)prop-2-en-1-one is a drug-like molecule.
| MolName | (Z)-1-(4-fluorophenyl)-3-(phenacylamino)prop-2-en-1-one |
| MolecularFormula | C17H14NO2F |
| Smiles | O=C(CN/C=C\C(c(cc1)ccc1F)=O)c1ccccc1 |
| InChI | InChI=1S/C17H14FNO2/c18-15-8-6-14(7-9-15)16(20)10-11-19-12-17(21)13-4-2-1-3-5-13/h1-11,19H,12H2 |
| InChIK | PRZDHRXJWNVQAG-UHFFFAOYSA-N |
| TotalMolweight | 283.301 |
| Molweight | 283.301 |
| MonoisotopicMass | 283.100857 |
| CLogP | 1.8265 |
| CLogS | -4.209 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 226.59 |
| Relative PSA | 0.16567 |
| PolarSurfaceArea | 46.17 |
| Druglikeness | 0.28078 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| 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 - (Z)-1-(4-fluorophenyl)-3-(phenacylamino)prop-2-en-1-one | 2 - (Z)-1-(4-fluorophenyl)-3-(phenacylamino)prop-2-en-1-one
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off