(NZ)-N-[(2R)-6,8-dichloro-2-phenyl-2,3-dihydrochromen-4-ylidene]hydroxylamine
Formula:C15H11NO2Cl2
Mutagenic:none
Tumorigenic:high
Reproductive Effective:high
(NZ)-N-[(2R)-6,8-dichloro-2-phenyl-2,3-dihydrochromen-4-ylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NZ)-N-[(2R)-6,8-dichloro-2-phenyl-2,3-dihydrochromen-4-ylidene]hydroxylamine |
| MolecularFormula | C15H11NO2Cl2 |
| Smiles | O/N=C(/C1)\c2cc(Cl)cc(Cl)c2O[C@H]1c1ccccc1 |
| InChI | InChI=1S/C15H11Cl2NO2/c16-10-6-11-13(18-19)8-14(9-4-2-1-3-5-9)20-15(11)12(17)7-10/h1-7,14,19H,8H2/t14-/m1/s1 |
| InChIK | UEXCNFZLBCZQAR-CQSZACIVSA-N |
| TotalMolweight | 308.163 |
| Molweight | 308.163 |
| MonoisotopicMass | 307.016683 |
| CLogP | 5.0262 |
| CLogS | -5.375 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 215.94 |
| Relative PSA | 0.16028 |
| PolarSurfaceArea | 41.82 |
| Druglikeness | -0.49347 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.55 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| StereoCenters | 1 |
| Rotatable Bond | 1 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| StereoCon | this enantiomer |
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1 - (NZ)-N-[(2R)-6,8-dichloro-2-phenyl-2,3-dihydrochromen-4-ylidene]hydroxylamine | 2 - (NZ)-N-[(2R)-6,8-dichloro-2-phenyl-2,3-dihydrochromen-4-ylidene]hydroxylamine
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