(5Z)-5-[(2,4-difluorophenyl)methylidene]-1,3-thiazolidine-2,4-dione
Formula:C10H5NO2F2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5Z)-5-[(2,4-difluorophenyl)methylidene]-1,3-thiazolidine-2,4-dione is a drug-like molecule.
| MolName | (5Z)-5-[(2,4-difluorophenyl)methylidene]-1,3-thiazolidine-2,4-dione |
| MolecularFormula | C10H5NO2F2S |
| Smiles | O=C(/C(/S1)=C/c(ccc(F)c2)c2F)NC1=O |
| InChI | InChI=1S/C10H5F2NO2S/c11-6-2-1-5(7(12)4-6)3-8-9(14)13-10(15)16-8/h1-4H,(H,13,14,15) |
| InChIK | NQPOASFVPDVMMW-UHFFFAOYSA-N |
| TotalMolweight | 241.217 |
| Molweight | 241.217 |
| MonoisotopicMass | 241.000905 |
| CLogP | 1.691 |
| CLogS | -3.777 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 161.62 |
| Relative PSA | 0.34049 |
| PolarSurfaceArea | 71.47 |
| Druglikeness | 1.6701 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | limit! methylene-thiazolidine-2,4-dione |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 1 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| Amides | 1 |
| StereoCon |
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