(NZ)-N-[(1-chloro-3,4-dihydronaphthalen-2-yl)methylidene]hydroxylamine
Formula:C11H10NOCl
Mutagenic:high
Tumorigenic:none
Reproductive Effective:high
(NZ)-N-[(1-chloro-3,4-dihydronaphthalen-2-yl)methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[(1-chloro-3,4-dihydronaphthalen-2-yl)methylidene]hydroxylamine |
| MolecularFormula | C11H10NOCl |
| Smiles | O/N=C\C(CCc1c2cccc1)=C2Cl |
| InChI | InChI=1S/C11H10ClNO/c12-11-9(7-13-14)6-5-8-3-1-2-4-10(8)11/h1-4,7,14H,5-6H2 |
| InChIK | UYDVSRSVBRFNCK-UHFFFAOYSA-N |
| TotalMolweight | 207.659 |
| Molweight | 207.659 |
| MonoisotopicMass | 207.045091 |
| CLogP | 3.1823 |
| CLogS | -2.199 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 156.73 |
| Relative PSA | 0.15702 |
| PolarSurfaceArea | 32.59 |
| Druglikeness | -0.98068 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | allyl/benzyl chloride |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 1 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 3 |
| StereoCon |
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1 - (NZ)-N-[(1-chloro-3,4-dihydronaphthalen-2-yl)methylidene]hydroxylamine | 2 - (NZ)-N-[(1-chloro-3,4-dihydronaphthalen-2-yl)methylidene]hydroxylamine
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