3-hydroxy-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]naphthalene-2-carboxamide
Formula:C25H20N2O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
3-hydroxy-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]naphthalene-2-carboxamide is not a drug-like molecule.
| MolName | 3-hydroxy-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]naphthalene-2-carboxamide |
| MolecularFormula | C25H20N2O3 |
| Smiles | Oc1cc2ccccc2cc1C(N/N=C\c(cc1)ccc1OCc1ccccc1)=O |
| InChI | InChI=1S/C25H20N2O3/c28-24-15-21-9-5-4-8-20(21)14-23(24)25(29)27-26-16-18-10-12-22(13-11-18)30-17-19-6-2-1-3-7-19/h1-16,28H,17H2,(H,27,29) |
| InChIK | FJCJWVMLRDZDBK-UHFFFAOYSA-N |
| TotalMolweight | 396.445 |
| Molweight | 396.445 |
| MonoisotopicMass | 396.147393 |
| CLogP | 5.3984 |
| CLogS | -6.372 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 311.46 |
| Relative PSA | 0.18978 |
| PolarSurfaceArea | 70.92 |
| Druglikeness | 4.0044 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| StereoCon |
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