N'-hydroxy-2-(2-phenylsulfanylphenyl)ethanimidamide
Formula:C14H14N2OS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-hydroxy-2-(2-phenylsulfanylphenyl)ethanimidamide is a drug-like molecule.
| MolName | N'-hydroxy-2-(2-phenylsulfanylphenyl)ethanimidamide |
| MolecularFormula | C14H14N2OS |
| Smiles | N/C(/Cc(cccc1)c1Sc1ccccc1)=N\O |
| InChI | InChI=1S/C14H14N2OS/c15-14(16-17)10-11-6-4-5-9-13(11)18-12-7-2-1-3-8-12/h1-9,17H,10H2,(H2,15,16) |
| InChIK | JUOKZJXIEICRKB-UHFFFAOYSA-N |
| TotalMolweight | 258.344 |
| Molweight | 258.344 |
| MonoisotopicMass | 258.082683 |
| CLogP | 3.1875 |
| CLogS | -3.831 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 202.11 |
| Relative PSA | 0.28386 |
| PolarSurfaceArea | 83.91 |
| Druglikeness | -1.0625 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61111 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| StereoCon |
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