aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06551 | 3.16 | 341.38 | C15H13O2N6S | O=[N+]([O-])c1ccc(CSc2nc(NC3CC3)nc3c2N=C[N]3)cc1 |
|
AD06552 | 3.02 | 329.37 | C14H13O2N6S | CCNc1nc2c(c(SCc3ccc([N+](=O)[O-])cc3)n1)N=C[N]2 |
|
AD06553 | 2.0 | 150.22 | C10H14O | OCCCCc1ccccc1 |
|
AD06554 | 2.59 | 330.29 | C17H14O7 | COc1cc(-c2coc3cc(O)c(OC)c(O)c3c2=O)ccc1O |
|
AD06555 | -2.97 | 163.17 | C6H13O4N | OCC1NC(CO)C(O)C1O |
|
AD06556 | 9.4 | 410.73 | C27H54O2 | CCCCCCCCCCCCC(CCCCCCCCCCCC)C(=O)OC |
|
AD06557 | 2.58 | 793.02 | C46H60O6N6 | CC(C)C(NC(=O)C(N)Cc1ccccc1)C(=O)NC(Cc1ccccc1)C(O)C(O)C(Cc1ccccc1)NC(=O)C(NC(=O)C(N)Cc1ccccc1)C(C)C |
|
AD06558 | 2.99 | 334.46 | C20H30O4 | C=C1CCC2C(C)(CO)C(O)CCC2(C)C1CCC1=CCOC1=O |
|
AD06559 | -1.51 | 242.23 | C10H14O5N2 | Cc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O |
|
AD06560 | 1.5 | 322.1 | C10H6O2N6Br | O=C(NNc1ncnc2c1N=C[N]2)c1ccc(Br)o1 |