(NZ)-N-[[3,5-dibromo-4-[(3,4-dichlorophenyl)methoxy]phenyl]methylidene]hydroxylamine
Formula:C14H9NO2Br2Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[[3,5-dibromo-4-[(3,4-dichlorophenyl)methoxy]phenyl]methylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NZ)-N-[[3,5-dibromo-4-[(3,4-dichlorophenyl)methoxy]phenyl]methylidene]hydroxylamine |
| MolecularFormula | C14H9NO2Br2Cl2 |
| Smiles | O/N=C\c(cc1Br)cc(Br)c1OCc(cc1)cc(Cl)c1Cl |
| InChI | InChI=1S/C14H9Br2Cl2NO2/c15-10-3-9(6-19-20)4-11(16)14(10)21-7-8-1-2-12(17)13(18)5-8/h1-6,20H,7H2 |
| InChIK | JZBWDWFVKKCRBV-UHFFFAOYSA-N |
| TotalMolweight | 453.944 |
| Molweight | 453.944 |
| MonoisotopicMass | 450.837705 |
| CLogP | 6.2248 |
| CLogS | -6.796 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 255.99 |
| Relative PSA | 0.1352 |
| PolarSurfaceArea | 41.82 |
| Druglikeness | -2.9222 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 3 |
| StereoCon |
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1 - (NZ)-N-[[3,5-dibromo-4-[(3,4-dichlorophenyl)methoxy]phenyl]methylidene]hydroxylamine | 2 - (NZ)-N-[[3,5-dibromo-4-[(3,4-dichlorophenyl)methoxy]phenyl]methylidene]hydroxylamine
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