N-[(Z)-[2-[(4-chlorophenyl)methoxy]naphthalen-1-yl]methylideneamino]pyridine-3-carboxamide
Formula:C24H18N3O2Cl
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-[2-[(4-chlorophenyl)methoxy]naphthalen-1-yl]methylideneamino]pyridine-3-carboxamide is not a drug-like molecule.
| MolName | N-[(Z)-[2-[(4-chlorophenyl)methoxy]naphthalen-1-yl]methylideneamino]pyridine-3-carboxamide |
| MolecularFormula | C24H18N3O2Cl |
| Smiles | O=C(c1cnccc1)N/N=C\c(c1ccccc1cc1)c1OCc(cc1)ccc1Cl |
| InChI | InChI=1S/C24H18ClN3O2/c25-20-10-7-17(8-11-20)16-30-23-12-9-18-4-1-2-6-21(18)22(23)15-27-28-24(29)19-5-3-13-26-14-19/h1-15H,16H2,(H,28,29) |
| InChIK | RTWQWEZPHTUXEL-UHFFFAOYSA-N |
| TotalMolweight | 415.879 |
| Molweight | 415.879 |
| MonoisotopicMass | 415.108754 |
| CLogP | 5.3492 |
| CLogS | -6.609 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 319.29 |
| Relative PSA | 0.17846 |
| PolarSurfaceArea | 63.58 |
| Druglikeness | 4.0514 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.56667 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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