(NZ)-N-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]hydroxylamine
Formula:C14H10NO2BrCl2
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NZ)-N-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]hydroxylamine |
| MolecularFormula | C14H10NO2BrCl2 |
| Smiles | O/N=C\c(cc(cc1)Br)c1OCc(ccc(Cl)c1)c1Cl |
| InChI | InChI=1S/C14H10BrCl2NO2/c15-11-2-4-14(10(5-11)7-18-19)20-8-9-1-3-12(16)6-13(9)17/h1-7,19H,8H2 |
| InChIK | XWUJKIWEJJFRCN-UHFFFAOYSA-N |
| TotalMolweight | 375.048 |
| Molweight | 375.048 |
| MonoisotopicMass | 372.927194 |
| CLogP | 5.4996 |
| CLogS | -5.962 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 237.36 |
| Relative PSA | 0.14581 |
| PolarSurfaceArea | 41.82 |
| Druglikeness | -2.9222 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| StereoCon |
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1 - (NZ)-N-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]hydroxylamine | 2 - (NZ)-N-[[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]hydroxylamine
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