(E)-1,3-di(selenophen-2-yl)prop-2-en-1-one
Formula:C11H8OSe2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-1,3-di(selenophen-2-yl)prop-2-en-1-one is a drug-like molecule.
| MolName | (E)-1,3-di(selenophen-2-yl)prop-2-en-1-one |
| MolecularFormula | C11H8OSe2 |
| Smiles | O=C(/C=C/c1ccc[se]1)c1ccc[se]1 |
| InChI | InChI=1S/C11H8OSe2/c12-10(11-4-2-8-14-11)6-5-9-3-1-7-13-9/h1-8H |
| InChIK | CBKLRGOEUBSIOC-UHFFFAOYSA-N |
| TotalMolweight | 314.104 |
| Molweight | 314.104 |
| MonoisotopicMass | 315.890555 |
| CLogP | 2.407 |
| CLogS | -0.528 |
| H Acceptors | 1 |
| TotalSurfaceArea | 128.43 |
| Relative PSA | 0.10153 |
| PolarSurfaceArea | 17.07 |
| Druglikeness | -2.9153 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | unwanted atom |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| StereoCon |
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