(Z)-N-[(4-bromo-2-fluorophenyl)methoxy]-1-(4-phenylmethoxyphenyl)methanimine
Formula:C21H17NO2BrF
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-N-[(4-bromo-2-fluorophenyl)methoxy]-1-(4-phenylmethoxyphenyl)methanimine is not a drug-like molecule.
| MolName | (Z)-N-[(4-bromo-2-fluorophenyl)methoxy]-1-(4-phenylmethoxyphenyl)methanimine |
| MolecularFormula | C21H17NO2BrF |
| Smiles | Fc1c(CO/N=C\c(cc2)ccc2OCc2ccccc2)ccc(Br)c1 |
| InChI | InChI=1S/C21H17BrFNO2/c22-19-9-8-18(21(23)12-19)15-26-24-13-16-6-10-20(11-7-16)25-14-17-4-2-1-3-5-17/h1-13H,14-15H2 |
| InChIK | KYVVIXIDBVWIFD-UHFFFAOYSA-N |
| TotalMolweight | 414.273 |
| Molweight | 414.273 |
| MonoisotopicMass | 413.042668 |
| CLogP | 6.0098 |
| CLogS | -6.131 |
| H Acceptors | 3 |
| TotalSurfaceArea | 290.04 |
| Relative PSA | 0.10864 |
| PolarSurfaceArea | 30.82 |
| Druglikeness | -3.2316 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.73077 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| StereoCon |
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