synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD046871 | -2.66 | 316.3 | C10H12O6N4S | Nc1nc2c(sc(=O)n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1 |
|
GD105706 | -5.02 | 750.47 | C21H35O17N7P3 | NC(=O)c1ccc[n+]([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O[PH](O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1 |
|
GD105754 | -4.43 | 668.47 | C21H32O14N7P2 | NC(=O)c1ccc[n+]([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1 |
|
GD093477 | -7.53 | 482.64 | C21H48O7N5 | C[NH2+][C@H](C)[C@@H]1CC[C@@H]([NH3+])[C@@H](O[C@H]2[C@@H]([NH3+])C[C@@H]([NH3+])[C@H](O[C@@H]3OC[C@](C)(O)[C@H]([NH2+]C)[C@H]3O)[C@H]2O)O1 |
|
GD105708 | -4.1 | 669.48 | C21H33O14N7P2 | NC(=O)C1=CN([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1 |
|
GD105707 | -4.69 | 751.47 | C21H36O17N7P3 | NC(=O)C1=CN([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O[PH](O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1 |
|
GD106106 | -3.78 | 773.59 | C21H42O16N7P3S | CC(C)(CO[PH](O)(O)O[PH](O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O[PH](O)(O)O)[C@H](O)C(=O)NCCC(=O)NCCS |
|
GD106073 | -3.84 | 789.59 | C27H37O15N9P2 | Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO[PH](O)(O)O[PH](O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)c2cc1C |
|
GD086263 | -3.16 | 445.22 | C10H17O11N5P2 | Nc1nc2c(ncn2[C@@H]2O[C@H](CO[PH](O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1 |
|
GD105632 | -3.33 | 512.2 | C10H19O14N4P3 | O=c1[nH]cnc2c1ncn2[C@@H]1O[C@H](CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O |