[(Z)-benzylideneamino]-phenylcyanamide
Formula:C14H11N3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-benzylideneamino]-phenylcyanamide is a drug-like molecule.
| MolName | [(Z)-benzylideneamino]-phenylcyanamide |
| MolecularFormula | C14H11N3 |
| Smiles | N#CN(c1ccccc1)/N=C\c1ccccc1 |
| InChI | InChI=1S/C14H11N3/c15-12-17(14-9-5-2-6-10-14)16-11-13-7-3-1-4-8-13/h1-11H |
| InChIK | WJWJUAWRXXHDFL-UHFFFAOYSA-N |
| TotalMolweight | 221.262 |
| Molweight | 221.262 |
| MonoisotopicMass | 221.095297 |
| CLogP | 3.2171 |
| CLogS | -3.313 |
| H Acceptors | 3 |
| TotalSurfaceArea | 189.79 |
| Relative PSA | 0.1508 |
| PolarSurfaceArea | 39.39 |
| Druglikeness | 1.0729 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.64706 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 4 |
| StereoCon |
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1 - [(Z)-benzylideneamino]-phenylcyanamide | 2 - [(Z)-benzylideneamino]-phenylcyanamide
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