N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]aniline
Formula:C17H19N3O
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]aniline is a drug-like molecule.
| MolName | N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]aniline |
| MolecularFormula | C17H19N3O |
| Smiles | C(COCC1)N1c1ccc(/C=N\Nc2ccccc2)cc1 |
| InChI | InChI=1S/C17H19N3O/c1-2-4-16(5-3-1)19-18-14-15-6-8-17(9-7-15)20-10-12-21-13-11-20/h1-9,14,19H,10-13H2 |
| InChIK | AOZBQCDCTRIVFT-UHFFFAOYSA-N |
| TotalMolweight | 281.358 |
| Molweight | 281.358 |
| MonoisotopicMass | 281.152812 |
| CLogP | 4.5099 |
| CLogS | -3.252 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 231.08 |
| Relative PSA | 0.15804 |
| PolarSurfaceArea | 36.86 |
| Druglikeness | 3.2985 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 6 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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