(2Z)-2-(phenylhydrazinylidene)acetaldehyde
Formula:C8H8N2O
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
(2Z)-2-(phenylhydrazinylidene)acetaldehyde is a drug-like molecule.
| MolName | (2Z)-2-(phenylhydrazinylidene)acetaldehyde |
| MolecularFormula | C8H8N2O |
| Smiles | O=C/C=N\Nc1ccccc1 |
| InChI | InChI=1S/C8H8N2O/c11-7-6-9-10-8-4-2-1-3-5-8/h1-7,10H |
| InChIK | YJOTYSZYWLJWBH-UHFFFAOYSA-N |
| TotalMolweight | 148.165 |
| Molweight | 148.165 |
| MonoisotopicMass | 148.063663 |
| CLogP | 1.9472 |
| CLogS | -1.609 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 129.02 |
| Relative PSA | 0.2791 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | 0.046189 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.81818 |
| Fragments | 1 |
| Non HAtoms | 11 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - (2Z)-2-(phenylhydrazinylidene)acetaldehyde | 2 - (2Z)-2-(phenylhydrazinylidene)acetaldehyde
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