| MolName | 2-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)oxy]-N'-hydroxyethanimidamide |
| MolecularFormula | C13H21N7O4 |
| Smiles | N/C(/COc1nc(N2CCOCC2)nc(N2CCOCC2)n1)=N/O |
| InChI | InChI=1S/C13H21N7O4/c14-10(18-21)9-24-13-16-11(19-1-5-22-6-2-19)15-12(17-13)20-3-7-23-8-4-20/h21H,1-9H2,(H2,14,18) |
| InChIK | MYNKILIADWZBKQ-UHFFFAOYSA-N |
| TotalMolweight | 339.355 |
| Molweight | 339.355 |
| MonoisotopicMass | 339.165503 |
| CLogP | -0.2972 |
| CLogS | -2.252 |
| H Acceptors | 11 |
| H Donors | 2 |
| TotalSurfaceArea | 254.82 |
| Relative PSA | 0.43125 |
| PolarSurfaceArea | 131.45 |
| Druglikeness | 0.93134 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 11 |
| Electronegative Atoms | 11 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 13 |
| Symmetricatoms | 10 |
| Aromatic Nitrogens | 3 |
| StereoCon |
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1 - 2-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)oxy]-N'-hydroxyethanimidamide | 2 - 2-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)oxy]-N'-hydroxyethanimidamide