2-[(Z)-benzylideneamino]oxyacetate
Formula:C9H8NO3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(Z)-benzylideneamino]oxyacetate is a drug-like molecule.
| MolName | 2-[(Z)-benzylideneamino]oxyacetate |
| MolecularFormula | C9H8NO3 |
| Smiles | [O-]C(CO/N=C\c1ccccc1)=O |
| InChI | InChI=1S/C9H9NO3/c11-9(12)7-13-10-6-8-4-2-1-3-5-8/h1-6H,7H2,(H,11,12)/p-1 |
| InChIK | LJKLAUKCFUAGQZ-UHFFFAOYSA-M |
| TotalMolweight | 178.167 |
| Molweight | 178.167 |
| MonoisotopicMass | 178.050419 |
| CLogP | -0.5284 |
| CLogS | -2.094 |
| H Acceptors | 4 |
| TotalSurfaceArea | 147.06 |
| Relative PSA | 0.33204 |
| PolarSurfaceArea | 61.72 |
| Druglikeness | 0.62376 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.76923 |
| Fragments | 1 |
| Non HAtoms | 13 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| AcidicOxygens | 1 |
| StereoCon |
Click to Load Molecule:
1 - 2-[(Z)-benzylideneamino]oxyacetate | 2 - 2-[(Z)-benzylideneamino]oxyacetate
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off