Inchi | 1S/C19H35N3O8/c1-2-4-23-6-8-25-10-12-27-14-16-29-18-19-30-17-15-28-13-11-26-9-7-24-5-3-21-22-20/h1H,3-19H2 |
InChIKey | QDDPIAVPDQNYOJ-UHFFFAOYSA-N |
SMILES | O(C([H])([H])C([H])([H])OC([H])([H])C([H])([H])OC([H])([H])C([H])([H])OC([H])([H])C([H])([H])N=[N+]=[N-])C([H])([H])C([H])([H])OC([H])([H])C([H])([H])OC([H])([H])C([H])([H])OC([H])([H])C([H])([H])OC([H])([H])C#C[H] |
氢键供体数量 | 0 |
氢键受体数量 | 10 |
重原子数量 | 30 |
可旋转化学键数量 | 25 |
复杂度 | 441 |
疏水参数计算参考值(XlogP) | 0.1 |
拓扑分子极性表面积 | 88.2 |