(NE)-N-[(5,7-dibromo-1-benzofuran-2-yl)-phenylmethylidene]hydroxylamine
Formula:C15H9NO2Br2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
(NE)-N-[(5,7-dibromo-1-benzofuran-2-yl)-phenylmethylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NE)-N-[(5,7-dibromo-1-benzofuran-2-yl)-phenylmethylidene]hydroxylamine |
| MolecularFormula | C15H9NO2Br2 |
| Smiles | O/N=C(/c1cc2cc(Br)cc(Br)c2o1)\c1ccccc1 |
| InChI | InChI=1S/C15H9Br2NO2/c16-11-6-10-7-13(20-15(10)12(17)8-11)14(18-19)9-4-2-1-3-5-9/h1-8,19H |
| InChIK | UXGYUCGKZIMRGV-UHFFFAOYSA-N |
| TotalMolweight | 395.049 |
| Molweight | 395.049 |
| MonoisotopicMass | 392.900001 |
| CLogP | 5.367 |
| CLogS | -6.942 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 223.89 |
| Relative PSA | 0.17294 |
| PolarSurfaceArea | 45.73 |
| Druglikeness | -2.3872 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.55 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - (NE)-N-[(5,7-dibromo-1-benzofuran-2-yl)-phenylmethylidene]hydroxylamine | 2 - (NE)-N-[(5,7-dibromo-1-benzofuran-2-yl)-phenylmethylidene]hydroxylamine
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