N-[(Z)-[4-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]-2-naphthalen-1-ylacetamide
Formula:C26H21N2O2F
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-[4-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]-2-naphthalen-1-ylacetamide is not a drug-like molecule.
| MolName | N-[(Z)-[4-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]-2-naphthalen-1-ylacetamide |
| MolecularFormula | C26H21N2O2F |
| Smiles | O=C(Cc1cccc2ccccc12)N/N=C\c(cc1)ccc1OCc(cc1)ccc1F |
| InChI | InChI=1S/C26H21FN2O2/c27-23-12-8-20(9-13-23)18-31-24-14-10-19(11-15-24)17-28-29-26(30)16-22-6-3-5-21-4-1-2-7-25(21)22/h1-15,17H,16,18H2,(H,29,30) |
| InChIK | MYOQPVLIPHXYPK-UHFFFAOYSA-N |
| TotalMolweight | 412.463 |
| Molweight | 412.463 |
| MonoisotopicMass | 412.158706 |
| CLogP | 5.843 |
| CLogS | -6.947 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 325.22 |
| Relative PSA | 0.14147 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 2.6686 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.67742 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| StereoCon |
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