2-(4-chlorophenyl)sulfanyl-N'-hydroxyethanimidamide
Formula:C8H9N2OClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
2-(4-chlorophenyl)sulfanyl-N'-hydroxyethanimidamide is a drug-like molecule.
| MolName | 2-(4-chlorophenyl)sulfanyl-N'-hydroxyethanimidamide |
| MolecularFormula | C8H9N2OClS |
| Smiles | N/C(/CSc(cc1)ccc1Cl)=N\O |
| InChI | InChI=1S/C8H9ClN2OS/c9-6-1-3-7(4-2-6)13-5-8(10)11-12/h1-4,12H,5H2,(H2,10,11) |
| InChIK | QZQBWSKCYMEUSH-UHFFFAOYSA-N |
| TotalMolweight | 216.691 |
| Molweight | 216.691 |
| MonoisotopicMass | 216.01241 |
| CLogP | 2.1871 |
| CLogS | -3.358 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 157.77 |
| Relative PSA | 0.36363 |
| PolarSurfaceArea | 83.91 |
| Druglikeness | -0.7125 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.76923 |
| Fragments | 1 |
| Non HAtoms | 13 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| StereoCon |
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