(NZ)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)hydroxylamine
Formula:C9H9NO3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)hydroxylamine |
| MolecularFormula | C9H9NO3 |
| Smiles | O/N=C\c(cc1)cc2c1OCCO2 |
| InChI | InChI=1S/C9H9NO3/c11-10-6-7-1-2-8-9(5-7)13-4-3-12-8/h1-2,5-6,11H,3-4H2 |
| InChIK | MQTBKHWWMQAHAF-UHFFFAOYSA-N |
| TotalMolweight | 179.174 |
| Molweight | 179.174 |
| MonoisotopicMass | 179.058244 |
| CLogP | 2.1931 |
| CLogS | -2.497 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 138.39 |
| Relative PSA | 0.32235 |
| PolarSurfaceArea | 51.05 |
| Druglikeness | -8.1468 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.69231 |
| Fragments | 1 |
| Non HAtoms | 13 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 1 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 5 |
| StereoCon |
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1 - (NZ)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)hydroxylamine | 2 - (NZ)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)hydroxylamine
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