(5Z)-5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Formula:C10H6NOIS2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5Z)-5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.
| MolName | (5Z)-5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C10H6NOIS2 |
| Smiles | O=C(/C(/S1)=C/c(cc2)ccc2I)NC1=S |
| InChI | InChI=1S/C10H6INOS2/c11-7-3-1-6(2-4-7)5-8-9(13)12-10(14)15-8/h1-5H,(H,12,13,14) |
| InChIK | LIRUBCDZKKWCPS-UHFFFAOYSA-N |
| TotalMolweight | 347.196 |
| Molweight | 347.196 |
| MonoisotopicMass | 346.893552 |
| CLogP | 1.5813 |
| CLogS | -4.516 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 190.16 |
| Relative PSA | 0.36806 |
| PolarSurfaceArea | 86.49 |
| Druglikeness | 2.8671 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 15 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 1 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - (5Z)-5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[(4-iodophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
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