active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD008421 | 0.32 | 417.45 | C18H19O5N5S | Cc1ccc(S(=O)(=O)C=C[C@@H]2O[C@H](n3cnc4c(N)ncnc43)[C@H](O)[C@H]2O)cc1 |
|
GD002686 | -0.06 | 342.15 | C11H12O3N5Br | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C=CBr)[C@H](O)[C@H]1O |
|
GD013103 | 3.52 | 1033.97 | C38H66O18N7P3S | CCCCCCCCCCCCCC[C@]1(C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]2O[C@H](n3cnc4c(N)cnnc43)[C@H](O)[C@H]2OP(=O)(O)O)CO1 |
|
GD030495 | 1.13 | 1021.87 | C35H58O20N7P3S | CCCCCCCC[C@@H]1OC(=O)C(CSCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]2O[C@H](n3cnc4c(N)cnnc43)[C@H](O)[C@H]2OP(=O)(O)O)[C@H]1C(=O)O |
|
GD004947 | 8.3 | 620.96 | C35H56O5S2 | CC(C)(Sc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)Sc1ccc(C(C)(C)C)c(OC[C@H](O)[C@H](O)CO)c1C(C)(C)C |
|
GD034168 | 1.46 | 1013.85 | C36H54O19N7P3S | CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1O[C@H](n2cnc3c(N)cnnc32)[C@H](O)[C@H]1OP(=O)(O)O)[C@H](O)C(=O)NCCC(=O)NCCSC(=O)C1(CCCCCCOc2ccccc2)CO1 |
|
GD023422 | 2.12 | 1048.29 | C37H53O19N7P3ClS | CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1O[C@H](n2cnc3c(N)cnnc32)[C@H](O)[C@H]1OP(=O)(O)O)[C@H](O)C(=O)NCCC(=O)NCCSC(=O)[C@@]1(CCCCCCOc2ccc(Cl)cc2)CO1 |
|
GD035633 | 1.34 | 1020.24 | C35H49O19N7P3ClS | CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1O[C@H](n2cnc3c(N)cnnc32)[C@H](O)[C@H]1OP(=O)(O)O)[C@H](O)C(=O)NCCC(=O)NCCSC(=O)C1(CCCCOc2cccc(Cl)c2)CO1 |
|
GD015920 | 1.48 | 1023.76 | C34H47O18N7F3P3S | CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1O[C@H](n2cnc3c(N)cnnc32)[C@H](O)[C@H]1OP(=O)(O)O)[C@H](O)C(=O)NCCC(=O)NCCSC(=O)C1(CCCc2cccc(C(F)(F)F)c2)CO1 |
|
GD030497 | 1.24 | 983.82 | C35H52O18N7P3S | CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1O[C@H](n2cnc3c(N)cnnc32)[C@H](O)[C@H]1OP(=O)(O)O)[C@H](O)C(=O)NCCC(=O)NCCSC(=O)C1(CCCCCc2ccccc2)CO1 |