synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD107338 | 0.24 | 511.0 | C23H27O6N4ClS | O=C(C[C@@H]1O[C@H](CNS(=O)(=O)c2ccc(Cl)cc2)[C@@H](O)[C@H]1O)N1CCN(c2ccccn2)CC1 |
|
GD099934 | 0.35 | 454.53 | C24H30O5N4 | Cc1ccc(C(=O)NC[C@H]2O[C@@H](CC(=O)N3CCN(c4ccccn4)CC3)[C@H](O)[C@@H]2O)cc1 |
|
GD041794 | -2.61 | 231.27 | C10H19O4N2 | [NH3+]C[C@H]1O[C@@H](CC(=O)NC2CC2)[C@H](O)[C@@H]1O |
|
GD042328 | -3.14 | 229.26 | C10H17O4N2 | C#CCNC(=O)C[C@@H]1O[C@H](C[NH3+])[C@@H](O)[C@H]1O |
|
GD062949 | -1.55 | 362.37 | C16H20O5N5 | Cc1nc2c(c[n+]1C)CN1C(=O)N([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C=CC1=N2 |
|
GD062950 | -1.55 | 362.37 | C16H20O5N5 | Cc1nc2c(c[n+]1C)CN1C(=O)N([C@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C=CC1=N2 |
|
GD041475 | 0.71 | 160.21 | C8H16O3 | CC1(C)[C@@H](O)O[C@@H](O)C1(C)C |
|
GD076688 | -1.13 | 391.32 | C13H22O7N5P | CCCO[PH](O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O |
|
GD099523 | 0.49 | 472.25 | C16H18O7N5Br | CC(=O)OC[C@@H]1O[C@H](n2c(Br)nc3c(N)ncnc32)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD075958 | -1.74 | 399.38 | C15H17O8N3S | Cc1ccc(S(=O)(=O)O[C@H]2[C@@H](n3ncc(=O)[nH]c3=O)O[C@H](CO)[C@H]2O)cc1 |