(NE)-N-[(3,4-dichlorophenyl)methylidene]hydroxylamine
Formula:C7H5NOCl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-[(3,4-dichlorophenyl)methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NE)-N-[(3,4-dichlorophenyl)methylidene]hydroxylamine |
| MolecularFormula | C7H5NOCl2 |
| Smiles | O/N=C/c(cc1)cc(Cl)c1Cl |
| InChI | InChI=1S/C7H5Cl2NO/c8-6-2-1-5(4-10-11)3-7(6)9/h1-4,11H |
| InChIK | ROBIUDOANJUDHD-UHFFFAOYSA-N |
| TotalMolweight | 190.029 |
| Molweight | 190.029 |
| MonoisotopicMass | 188.974818 |
| CLogP | 3.4263 |
| CLogS | -3.787 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 135.21 |
| Relative PSA | 0.18201 |
| PolarSurfaceArea | 32.59 |
| Druglikeness | -0.84388 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.72727 |
| Fragments | 1 |
| Non HAtoms | 11 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| StereoCon |
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1 - (NE)-N-[(3,4-dichlorophenyl)methylidene]hydroxylamine | 2 - (NE)-N-[(3,4-dichlorophenyl)methylidene]hydroxylamine
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