2-[(4-fluorophenyl)methylsulfonyl]-N'-hydroxyethanimidamide
Formula:C9H11N2O3FS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(4-fluorophenyl)methylsulfonyl]-N'-hydroxyethanimidamide is a drug-like molecule.
| MolName | 2-[(4-fluorophenyl)methylsulfonyl]-N'-hydroxyethanimidamide |
| MolecularFormula | C9H11N2O3FS |
| Smiles | N/C(/CS(Cc(cc1)ccc1F)(=O)=O)=N/O |
| InChI | InChI=1S/C9H11FN2O3S/c10-8-3-1-7(2-4-8)5-16(14,15)6-9(11)12-13/h1-4,13H,5-6H2,(H2,11,12) |
| InChIK | AVDGZDWBPJLTHN-UHFFFAOYSA-N |
| TotalMolweight | 246.261 |
| Molweight | 246.261 |
| MonoisotopicMass | 246.047441 |
| CLogP | 0.186 |
| CLogS | -2.623 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 173.55 |
| Relative PSA | 0.39447 |
| PolarSurfaceArea | 101.13 |
| Druglikeness | -4.5396 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6875 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 4 |
| Symmetricatoms | 3 |
| StereoCon |
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