(NZ)-N-[(2E)-2-[(3,4-dichlorophenyl)methylidene]cyclohexylidene]hydroxylamine
Formula:C13H13NOCl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(2E)-2-[(3,4-dichlorophenyl)methylidene]cyclohexylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[(2E)-2-[(3,4-dichlorophenyl)methylidene]cyclohexylidene]hydroxylamine |
| MolecularFormula | C13H13NOCl2 |
| Smiles | O/N=C(/CCCC1)\C1=C\c(cc1)cc(Cl)c1Cl |
| InChI | InChI=1S/C13H13Cl2NO/c14-11-6-5-9(8-12(11)15)7-10-3-1-2-4-13(10)16-17/h5-8,17H,1-4H2 |
| InChIK | OCGCTULPNOXNKZ-UHFFFAOYSA-N |
| TotalMolweight | 270.158 |
| Molweight | 270.158 |
| MonoisotopicMass | 269.037418 |
| CLogP | 4.9242 |
| CLogS | -5.043 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 199.67 |
| Relative PSA | 0.12325 |
| PolarSurfaceArea | 32.59 |
| Druglikeness | -5.2423 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.58824 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 1 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 5 |
| StereoCon |
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1 - (NZ)-N-[(2E)-2-[(3,4-dichlorophenyl)methylidene]cyclohexylidene]hydroxylamine | 2 - (NZ)-N-[(2E)-2-[(3,4-dichlorophenyl)methylidene]cyclohexylidene]hydroxylamine
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