| MolName | (5E)-3-(2-fluorophenyl)-5-[(4-hydroxyphenyl)methylidene]-2-imino-1,3-thiazolidin-4-one |
| MolecularFormula | C16H11N2O2FS |
| Smiles | N=C(N(C1=O)c(cccc2)c2F)S/C1=C/c(cc1)ccc1O |
| InChI | InChI=1S/C16H11FN2O2S/c17-12-3-1-2-4-13(12)19-15(21)14(22-16(19)18)9-10-5-7-11(20)8-6-10/h1-9,18,20H |
| InChIK | FVNWCVLGKZCITN-UHFFFAOYSA-N |
| TotalMolweight | 314.339 |
| Molweight | 314.339 |
| MonoisotopicMass | 314.052526 |
| CLogP | 2.5936 |
| CLogS | -3.83 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 222.78 |
| Relative PSA | 0.2818 |
| PolarSurfaceArea | 89.69 |
| Druglikeness | 2.2018 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59091 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - (5E)-3-(2-fluorophenyl)-5-[(4-hydroxyphenyl)methylidene]-2-imino-1,3-thiazolidin-4-one | 2 - (5E)-3-(2-fluorophenyl)-5-[(4-hydroxyphenyl)methylidene]-2-imino-1,3-thiazolidin-4-one