(2Z)-2-(benzenesulfonyl)-2-hydroxyiminoacetonitrile
Formula:C8H6N2O3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2Z)-2-(benzenesulfonyl)-2-hydroxyiminoacetonitrile is a drug-like molecule.
| MolName | (2Z)-2-(benzenesulfonyl)-2-hydroxyiminoacetonitrile |
| MolecularFormula | C8H6N2O3S |
| Smiles | N#C/C(/S(c1ccccc1)(=O)=O)=N/O |
| InChI | InChI=1S/C8H6N2O3S/c9-6-8(10-11)14(12,13)7-4-2-1-3-5-7/h1-5,11H |
| InChIK | WUECNENOORYKIB-UHFFFAOYSA-N |
| TotalMolweight | 210.213 |
| Molweight | 210.213 |
| MonoisotopicMass | 210.009913 |
| CLogP | -0.0981 |
| CLogS | -1.938 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 152.87 |
| Relative PSA | 0.43665 |
| PolarSurfaceArea | 98.9 |
| Druglikeness | -13.645 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 2 |
| Symmetricatoms | 3 |
| StereoCon |
Click to Load Molecule:
1 - (2Z)-2-(benzenesulfonyl)-2-hydroxyiminoacetonitrile | 2 - (2Z)-2-(benzenesulfonyl)-2-hydroxyiminoacetonitrile
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off