(E)-1-(4-phenylphenyl)-3-selenophen-2-ylprop-2-en-1-one
Formula:C19H14OSe
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-1-(4-phenylphenyl)-3-selenophen-2-ylprop-2-en-1-one is a drug-like molecule.
| MolName | (E)-1-(4-phenylphenyl)-3-selenophen-2-ylprop-2-en-1-one |
| MolecularFormula | C19H14OSe |
| Smiles | O=C(/C=C/c1ccc[se]1)c(cc1)ccc1-c1ccccc1 |
| InChI | InChI=1S/C19H14OSe/c20-19(13-12-18-7-4-14-21-18)17-10-8-16(9-11-17)15-5-2-1-3-6-15/h1-14H |
| InChIK | DSNNERBAPSIUKR-UHFFFAOYSA-N |
| TotalMolweight | 337.279 |
| Molweight | 337.279 |
| MonoisotopicMass | 338.020985 |
| CLogP | 4.5146 |
| CLogS | -4.27 |
| H Acceptors | 1 |
| TotalSurfaceArea | 212.61 |
| Relative PSA | 0.061333 |
| PolarSurfaceArea | 17.07 |
| Druglikeness | -3.0725 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | unwanted atom |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Symmetricatoms | 4 |
| StereoCon |
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