(NZ)-N-[(4-chloro-3-nitrophenyl)methylidene]hydroxylamine
Formula:C7H5N2O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(4-chloro-3-nitrophenyl)methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[(4-chloro-3-nitrophenyl)methylidene]hydroxylamine |
| MolecularFormula | C7H5N2O3Cl |
| Smiles | [O-][N+](c(cc(/C=N\O)cc1)c1Cl)=O |
| InChI | InChI=1S/C7H5ClN2O3/c8-6-2-1-5(4-9-11)3-7(6)10(12)13/h1-4,11H |
| InChIK | ONIQTTDQIOTCLD-UHFFFAOYSA-N |
| TotalMolweight | 200.581 |
| Molweight | 200.581 |
| MonoisotopicMass | 199.99887 |
| CLogP | 1.8987 |
| CLogS | -3.511 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 143.46 |
| Relative PSA | 0.38359 |
| PolarSurfaceArea | 78.41 |
| Druglikeness | -6.0784 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | aromatic nitro |
| Shape Index | 0.61538 |
| Fragments | 1 |
| Non HAtoms | 13 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 2 |
| AcidicOxygens | 1 |
| StereoCon |
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1 - (NZ)-N-[(4-chloro-3-nitrophenyl)methylidene]hydroxylamine | 2 - (NZ)-N-[(4-chloro-3-nitrophenyl)methylidene]hydroxylamine
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