2-(naphthalen-2-ylamino)-N-[(Z)-naphthalen-1-ylmethylideneamino]acetamide
Formula:C23H19N3O
Mutagenic:low
Tumorigenic:high
Reproductive Effective:none
2-(naphthalen-2-ylamino)-N-[(Z)-naphthalen-1-ylmethylideneamino]acetamide is a drug-like molecule.
| MolName | 2-(naphthalen-2-ylamino)-N-[(Z)-naphthalen-1-ylmethylideneamino]acetamide |
| MolecularFormula | C23H19N3O |
| Smiles | O=C(CNc1cc2ccccc2cc1)N/N=C\c1cccc2ccccc12 |
| InChI | InChI=1S/C23H19N3O/c27-23(16-24-21-13-12-17-6-1-2-8-19(17)14-21)26-25-15-20-10-5-9-18-7-3-4-11-22(18)20/h1-15,24H,16H2,(H,26,27) |
| InChIK | FOHBDESOWJNBAU-UHFFFAOYSA-N |
| TotalMolweight | 353.424 |
| Molweight | 353.424 |
| MonoisotopicMass | 353.152812 |
| CLogP | 4.8823 |
| CLogS | -6.755 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 281.41 |
| Relative PSA | 0.16869 |
| PolarSurfaceArea | 53.49 |
| Druglikeness | 5.0301 |
| Mutagenic | low |
| 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 | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 20 |
| Sp3Atoms | 1 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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