(5Z)-5-[(4-fluorophenyl)methylidene]-4-oxo-1,3-thiazol-2-olate
Formula:C10H5NO2FS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5Z)-5-[(4-fluorophenyl)methylidene]-4-oxo-1,3-thiazol-2-olate is a drug-like molecule.
| MolName | (5Z)-5-[(4-fluorophenyl)methylidene]-4-oxo-1,3-thiazol-2-olate |
| MolecularFormula | C10H5NO2FS |
| Smiles | [O-]C(S/C1=C\c(cc2)ccc2F)=NC1=O |
| InChI | InChI=1S/C10H6FNO2S/c11-7-3-1-6(2-4-7)5-8-9(13)12-10(14)15-8/h1-5H,(H,12,13,14)/p-1 |
| InChIK | XQEXVSOHLCLCFH-UHFFFAOYSA-M |
| TotalMolweight | 222.219 |
| Molweight | 222.219 |
| MonoisotopicMass | 222.002502 |
| CLogP | -0.5794 |
| CLogS | -3.527 |
| H Acceptors | 3 |
| TotalSurfaceArea | 156.56 |
| Relative PSA | 0.35973 |
| PolarSurfaceArea | 77.79 |
| Druglikeness | 0.86284 |
| 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 |
| StereoCon |
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1 - (5Z)-5-[(4-fluorophenyl)methylidene]-4-oxo-1,3-thiazol-2-olate | 2 - (5Z)-5-[(4-fluorophenyl)methylidene]-4-oxo-1,3-thiazol-2-olate
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