active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD015437 | 2.22 | 520.56 | C24H28O9N2S | CC(=O)OCC1OC(n2c3c(cc(C#N)c2=S)CCCC3)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
|
GD030325 | -1.03 | 421.48 | C18H23O5N5S | CC(C)(O)C#Cc1ccc(CNC[C@@H]2O[C@H](n3cnc(C(N)=O)n3)[C@H](O)[C@H]2O)s1 |
|
GD035753 | -1.05 | 384.41 | C15H20O6N4S | Cc1cc(NC(=O)c2csc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)n2)n(C)n1 |
|
GD006147 | 0.57 | 418.49 | C21H30O5N4 | Nc1ccn([C@@H]2O[C@H](C(=O)N(CCC3=CCCCC3)CC3CC3)[C@H](O)[C@H]2O)c(=O)n1 |
|
GD000333 | -1.69 | 610.52 | C27H30O16 | C[C@@H]1O[C@H](OC[C@@H]2O[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O |
|
GD004259 | 5.6 | 886.13 | C49H75O13N | CC[C@H](C)[C@@H]1O[C@@]2(C=C[C@H]1C)C[C@@H]1C[C@H](CC=C(C)[C@H](O[C@@H]3C[C@H](OC)[C@H](O[C@@H]4C[C@H](OC)[C@H](NC)[C@H](C)O4)[C@H](C)O3)[C@H](C)C=CC=C3CO[C@@H]4[C@H](O)C(C)=C[C@H](C(=O)O1)[C@]34O)O2 |
|
GD018307 | 1.8 | 583.58 | C27H25O10N3S | CC(=O)OCC1OC(n2c(S)c(C#N)c(-c3ccccc3)c(C#N)c2=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
|
GD023424 | -1.59 | 418.41 | C17H22O5N8 | CCNC(=O)c1cnn(-c2nc(NC)c3ncn(C4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1 |
|
GD013655 | 1.12 | 481.51 | C23H27O5N7 | CCCNc1nc(-n2cc(-c3ccc(OC)cc3)cn2)nc2c1ncn2C1O[C@H](CO)[C@H](O)[C@H]1O |
|
GD022768 | -0.1 | 552.62 | C20H20O7N6S3 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](CNS(=O)(=O)c2cc(S(=O)(=O)c3ccccc3)cs2)[C@H](O)[C@H]1O |