4-amino-N-[(Z)-naphthalen-2-ylmethylideneamino]benzamide
Formula:C18H15N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-amino-N-[(Z)-naphthalen-2-ylmethylideneamino]benzamide is a drug-like molecule.
| MolName | 4-amino-N-[(Z)-naphthalen-2-ylmethylideneamino]benzamide |
| MolecularFormula | C18H15N3O |
| Smiles | Nc(cc1)ccc1C(N/N=C\c1cc2ccccc2cc1)=O |
| InChI | InChI=1S/C18H15N3O/c19-17-9-7-15(8-10-17)18(22)21-20-12-13-5-6-14-3-1-2-4-16(14)11-13/h1-12H,19H2,(H,21,22) |
| InChIK | UDMIYLGUPYQIGE-UHFFFAOYSA-N |
| TotalMolweight | 289.337 |
| Molweight | 289.337 |
| MonoisotopicMass | 289.121512 |
| CLogP | 3.7187 |
| CLogS | -5.403 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 230.11 |
| Relative PSA | 0.22285 |
| PolarSurfaceArea | 67.48 |
| Druglikeness | 4.3905 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.68182 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Symmetricatoms | 2 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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