N-[(E)-(4-phenylphenyl)methylideneamino]naphthalene-1-carboxamide
Formula:C24H18N2O
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
N-[(E)-(4-phenylphenyl)methylideneamino]naphthalene-1-carboxamide is not a drug-like molecule.
| MolName | N-[(E)-(4-phenylphenyl)methylideneamino]naphthalene-1-carboxamide |
| MolecularFormula | C24H18N2O |
| Smiles | O=C(c1cccc2ccccc12)N/N=C/c(cc1)ccc1-c1ccccc1 |
| InChI | InChI=1S/C24H18N2O/c27-24(23-12-6-10-21-9-4-5-11-22(21)23)26-25-17-18-13-15-20(16-14-18)19-7-2-1-3-8-19/h1-17H,(H,26,27) |
| InChIK | WMLUYHNFXWEUFI-UHFFFAOYSA-N |
| TotalMolweight | 350.42 |
| Molweight | 350.42 |
| MonoisotopicMass | 350.141913 |
| CLogP | 6.0552 |
| CLogS | -7.413 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 281.35 |
| Relative PSA | 0.12799 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | 4.4687 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.62963 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Symmetricatoms | 4 |
| StereoCon |
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