(NE)-N-[1-phenyl-2-(tritylamino)ethylidene]hydroxylamine
Formula:C27H24N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-[1-phenyl-2-(tritylamino)ethylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NE)-N-[1-phenyl-2-(tritylamino)ethylidene]hydroxylamine |
| MolecularFormula | C27H24N2O |
| Smiles | O/N=C(/CNC(c1ccccc1)(c1ccccc1)c1ccccc1)\c1ccccc1 |
| InChI | InChI=1S/C27H24N2O/c30-29-26(22-13-5-1-6-14-22)21-28-27(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-20,28,30H,21H2 |
| InChIK | CVPWLSTUJJUXMV-UHFFFAOYSA-N |
| TotalMolweight | 392.501 |
| Molweight | 392.501 |
| MonoisotopicMass | 392.188863 |
| CLogP | 5.2599 |
| CLogS | -5.141 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 317.49 |
| Relative PSA | 0.11361 |
| PolarSurfaceArea | 44.62 |
| Druglikeness | 0.84391 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.4 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 4 |
| Symmetricatoms | 16 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - (NE)-N-[1-phenyl-2-(tritylamino)ethylidene]hydroxylamine | 2 - (NE)-N-[1-phenyl-2-(tritylamino)ethylidene]hydroxylamine
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