| MolName | (5Z)-5-[[4-[(3-fluorophenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C17H12NO2FS2 |
| Smiles | O=C(/C(/S1)=C/c(cc2)ccc2OCc2cc(F)ccc2)NC1=S |
| InChI | InChI=1S/C17H12FNO2S2/c18-13-3-1-2-12(8-13)10-21-14-6-4-11(5-7-14)9-15-16(20)19-17(22)23-15/h1-9H,10H2,(H,19,20,22) |
| InChIK | RJMMPKUMSXDECB-UHFFFAOYSA-N |
| TotalMolweight | 345.417 |
| Molweight | 345.417 |
| MonoisotopicMass | 345.029347 |
| CLogP | 2.5931 |
| CLogS | -5.155 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 253.75 |
| Relative PSA | 0.31523 |
| PolarSurfaceArea | 95.72 |
| Druglikeness | 0.83204 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65217 |
| 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 | 4 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - (5Z)-5-[[4-[(3-fluorophenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[[4-[(3-fluorophenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one