(NE)-N-[(4R)-4-(3,4-dichlorophenyl)-3,4-dihydro-2H-naphthalen-1-ylidene]hydroxylamine
Formula:C16H13NOCl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-[(4R)-4-(3,4-dichlorophenyl)-3,4-dihydro-2H-naphthalen-1-ylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NE)-N-[(4R)-4-(3,4-dichlorophenyl)-3,4-dihydro-2H-naphthalen-1-ylidene]hydroxylamine |
| MolecularFormula | C16H13NOCl2 |
| Smiles | O/N=C(\CC[C@@H]1c(cc2)cc(Cl)c2Cl)/c2c1cccc2 |
| InChI | InChI=1S/C16H13Cl2NO/c17-14-7-5-10(9-15(14)18)11-6-8-16(19-20)13-4-2-1-3-12(11)13/h1-5,7,9,11,20H,6,8H2/t11-/m1/s1 |
| InChIK | CGIUOCJZIYTDRG-LLVKDONJSA-N |
| TotalMolweight | 306.191 |
| Molweight | 306.191 |
| MonoisotopicMass | 305.037418 |
| CLogP | 5.0428 |
| CLogS | -5.885 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 219.7 |
| Relative PSA | 0.11202 |
| PolarSurfaceArea | 32.59 |
| Druglikeness | -2.0812 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.55 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| StereoCenters | 1 |
| Rotatable Bond | 1 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| StereoCon | this enantiomer |
Click to Load Molecule:
1 - (NE)-N-[(4R)-4-(3,4-dichlorophenyl)-3,4-dihydro-2H-naphthalen-1-ylidene]hydroxylamine | 2 - (NE)-N-[(4R)-4-(3,4-dichlorophenyl)-3,4-dihydro-2H-naphthalen-1-ylidene]hydroxylamine
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