2-[(Z)-(benzylhydrazinylidene)methyl]benzaldehyde
Formula:C15H14N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
2-[(Z)-(benzylhydrazinylidene)methyl]benzaldehyde is a drug-like molecule.
| MolName | 2-[(Z)-(benzylhydrazinylidene)methyl]benzaldehyde |
| MolecularFormula | C15H14N2O |
| Smiles | O=Cc1c(/C=N\NCc2ccccc2)cccc1 |
| InChI | InChI=1S/C15H14N2O/c18-12-15-9-5-4-8-14(15)11-17-16-10-13-6-2-1-3-7-13/h1-9,11-12,16H,10H2 |
| InChIK | NIBGMUYSVDJKHE-UHFFFAOYSA-N |
| TotalMolweight | 238.289 |
| Molweight | 238.289 |
| MonoisotopicMass | 238.110613 |
| CLogP | 3.0525 |
| CLogS | -3.916 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 202.54 |
| Relative PSA | 0.17779 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | 0.65619 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | low |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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