(NZ)-N-[1-(1,3-benzodioxol-5-yl)-2-phenylethylidene]hydroxylamine
Formula:C15H13NO3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[1-(1,3-benzodioxol-5-yl)-2-phenylethylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[1-(1,3-benzodioxol-5-yl)-2-phenylethylidene]hydroxylamine |
| MolecularFormula | C15H13NO3 |
| Smiles | O/N=C(/Cc1ccccc1)\c(cc1)cc2c1OCO2 |
| InChI | InChI=1S/C15H13NO3/c17-16-13(8-11-4-2-1-3-5-11)12-6-7-14-15(9-12)19-10-18-14/h1-7,9,17H,8,10H2 |
| InChIK | IMPCXJKAARCZFQ-UHFFFAOYSA-N |
| TotalMolweight | 255.272 |
| Molweight | 255.272 |
| MonoisotopicMass | 255.089544 |
| CLogP | 3.7055 |
| CLogS | -4.521 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 196.36 |
| Relative PSA | 0.22718 |
| PolarSurfaceArea | 51.05 |
| Druglikeness | -1.1172 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57895 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 2 |
| StereoCon |
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