| MolName | (5E)-5-[2-(4-fluorophenyl)-2-oxoethylidene]-2-sulfanylideneimidazolidin-4-one |
| MolecularFormula | C11H7N2O2FS |
| Smiles | O=C(/C=C(\C(N1)=O)/NC1=S)c(cc1)ccc1F |
| InChI | InChI=1S/C11H7FN2O2S/c12-7-3-1-6(2-4-7)9(15)5-8-10(16)14-11(17)13-8/h1-5H,(H2,13,14,16,17) |
| InChIK | JNTHIBKMXYAUIX-UHFFFAOYSA-N |
| TotalMolweight | 250.253 |
| Molweight | 250.253 |
| MonoisotopicMass | 250.021226 |
| CLogP | 0.7668 |
| CLogS | -3.222 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 181.95 |
| Relative PSA | 0.42319 |
| PolarSurfaceArea | 90.29 |
| Druglikeness | 1.5936 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | thio-amide/urea |
| Shape Index | 0.64706 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - (5E)-5-[2-(4-fluorophenyl)-2-oxoethylidene]-2-sulfanylideneimidazolidin-4-one | 2 - (5E)-5-[2-(4-fluorophenyl)-2-oxoethylidene]-2-sulfanylideneimidazolidin-4-one