| MolName | (5Z)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-2-sulfanylideneimidazolidin-4-one |
| MolecularFormula | C17H13N2O2FS |
| Smiles | O=C(/C(/N1)=C/c(cc2)ccc2OCc(cc2)ccc2F)NC1=S |
| InChI | InChI=1S/C17H13FN2O2S/c18-13-5-1-12(2-6-13)10-22-14-7-3-11(4-8-14)9-15-16(21)20-17(23)19-15/h1-9H,10H2,(H2,19,20,21,23) |
| InChIK | GRMRYUAXOXRQJX-UHFFFAOYSA-N |
| TotalMolweight | 328.366 |
| Molweight | 328.366 |
| MonoisotopicMass | 328.068176 |
| CLogP | 2.6777 |
| CLogS | -4.475 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 247.72 |
| Relative PSA | 0.29856 |
| PolarSurfaceArea | 82.45 |
| Druglikeness | 0.60195 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | thio-amide/urea |
| Shape Index | 0.69565 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - (5Z)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-2-sulfanylideneimidazolidin-4-one | 2 - (5Z)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-2-sulfanylideneimidazolidin-4-one