5-bromo-2-hydroxy-N-[(Z)-[3-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]benzamide
Formula:C25H19N2O3Br
Mutagenic:low
Tumorigenic:high
Reproductive Effective:none
5-bromo-2-hydroxy-N-[(Z)-[3-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]benzamide is not a drug-like molecule.
| MolName | 5-bromo-2-hydroxy-N-[(Z)-[3-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]benzamide |
| MolecularFormula | C25H19N2O3Br |
| Smiles | Oc(ccc(Br)c1)c1C(N/N=C\c1cc(OCc2cccc3ccccc23)ccc1)=O |
| InChI | InChI=1S/C25H19BrN2O3/c26-20-11-12-24(29)23(14-20)25(30)28-27-15-17-5-3-9-21(13-17)31-16-19-8-4-7-18-6-1-2-10-22(18)19/h1-15,29H,16H2,(H,28,30) |
| InChIK | GFNJZUZHDWRERY-UHFFFAOYSA-N |
| TotalMolweight | 475.341 |
| Molweight | 475.341 |
| MonoisotopicMass | 474.057904 |
| CLogP | 6.1236 |
| CLogS | -7.206 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 330.09 |
| Relative PSA | 0.17907 |
| PolarSurfaceArea | 70.92 |
| Druglikeness | 2.2144 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.58065 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 3 |
| StereoCon |
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