active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD021626 | -2.21 | 591.52 | C21H21O10N9S | COC(=O)c1cn(-c2nc(N)c3ncn([C@@H]4O[C@H](COS(=O)(=O)NC(=O)c5ccccc5O)[C@H](O)[C@H]4O)c3n2)nn1 |
|
GD018237 | -0.02 | 623.61 | C26H25O8N9S | Cc1ccccc1-c1cn(-c2nc(N)c3ncn([C@@H]4O[C@H](COS(=O)(=O)NC(=O)c5ccccc5O)[C@H](O)[C@H]4O)c3n2)nn1 |
|
GD018258 | 0.09 | 542.53 | C23H22O8N6S | Nc1nc(-c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](COS(=O)(=O)NC(=O)c2ccccc2O)[C@H](O)[C@H]1O |
|
GD010492 | -0.59 | 434.26 | C10H16O11N2P2S | COP(=O)(O)OP(=O)(O)OC[C@@H]1O[C@H](n2ccc(=S)[nH]c2=O)[C@H](O)[C@H]1O |
|
GD007812 | -1.86 | 467.42 | C17H17O9N5S | O=C(NS(=O)(=O)OC[C@@H]1O[C@H](n2cnc3c(=O)[nH]cnc32)[C@H](O)[C@H]1O)c1ccccc1O |
|
GD004157 | -0.63 | 507.45 | C17H17O8N9S | [N-]=[N+]=Nc1nc2c(N)ncnc2n1[C@@H]1O[C@H](COS(=O)(=O)NC(=O)c2ccccc2O)[C@H](O)[C@H]1O |
|
GD010750 | -0.81 | 545.33 | C17H17O8N6SBr | Nc1ncnc2c1nc(Br)n2[C@@H]1O[C@H](COS(=O)(=O)NC(=O)c2ccccc2O)[C@H](O)[C@H]1O |
|
GD002721 | -3.84 | 541.2 | C10H18O15N5P3 | O=C1NNC(=O)C2C(N=CN2C2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@H]2O)N1 |
|
GD005400 | 0.05 | 615.63 | C25H29O8N9S | Nc1nc(-n2cc(C3CCCCC3)nn2)nc2c1ncn2[C@@H]1O[C@H](COS(=O)(=O)NC(=O)c2ccccc2O)[C@H](O)[C@H]1O |
|
GD005408 | -0.7 | 589.59 | C23H27O8N9S | CC(C)(C)c1cn(-c2nc(N)c3ncn([C@@H]4O[C@H](COS(=O)(=O)NC(=O)c5ccccc5O)[C@H](O)[C@H]4O)c3n2)nn1 |