| MolName | [(Z)-(2-fluorophenyl)methylideneamino]thiourea |
| MolecularFormula | C8H8N3FS |
| Smiles | NC(N/N=C\c(cccc1)c1F)=S |
| InChI | InChI=1S/C8H8FN3S/c9-7-4-2-1-3-6(7)5-11-12-8(10)13/h1-5H,(H3,10,12,13) |
| InChIK | AAVLMTXPFUGOSG-UHFFFAOYSA-N |
| TotalMolweight | 197.237 |
| Molweight | 197.237 |
| MonoisotopicMass | 197.042295 |
| CLogP | 1.6328 |
| CLogS | -3.212 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 157.06 |
| Relative PSA | 0.42175 |
| PolarSurfaceArea | 82.5 |
| Druglikeness | 0.93692 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde; thio-amide/urea |
| Shape Index | 0.69231 |
| Fragments | 1 |
| Non HAtoms | 13 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| StereoCon |
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1 - [(Z)-(2-fluorophenyl)methylideneamino]thiourea | 2 - [(Z)-(2-fluorophenyl)methylideneamino]thiourea