2-(4-chlorophenyl)sulfonyl-N'-hydroxyethanimidamide
Formula:C8H9N2O3ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-(4-chlorophenyl)sulfonyl-N'-hydroxyethanimidamide is a drug-like molecule.
| MolName | 2-(4-chlorophenyl)sulfonyl-N'-hydroxyethanimidamide |
| MolecularFormula | C8H9N2O3ClS |
| Smiles | N/C(/CS(c(cc1)ccc1Cl)(=O)=O)=N/O |
| InChI | InChI=1S/C8H9ClN2O3S/c9-6-1-3-7(4-2-6)15(13,14)5-8(10)11-12/h1-4,12H,5H2,(H2,10,11) |
| InChIK | RJWJKIYKFMICDI-UHFFFAOYSA-N |
| TotalMolweight | 248.689 |
| Molweight | 248.689 |
| MonoisotopicMass | 248.00224 |
| CLogP | 0.7119 |
| CLogS | -2.927 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 168.86 |
| Relative PSA | 0.40542 |
| PolarSurfaceArea | 101.13 |
| Druglikeness | -2.9218 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 15 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 3 |
| Symmetricatoms | 3 |
| StereoCon |
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