aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22591 | 1.43 | 253.29 | C13H13N6 | CN(Cc1ccccc1)C1=Nc2c(N)ncnc2[N]1 |
|
AD22592 | 5.29 | 472.71 | C30H48O4 | CC1(CO)CC(O)C2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD22593 | -5.93 | 1733.68 | C76H92O28N20 | O=C(Cn1cc(CCC(=O)NC2C3OCC4OC(OCC5OC(OCC6OC(OCC(O3)C(O)C2O)C(NC(=O)CCc2cn(CC(=O)Nc3ccc(O)cc3)nn2)C(O)C6O)C(NC(=O)CCc2cn(CC(=O)Nc3ccc(O)cc3)nn2)C(O)C5O)C(NC(=O)CCc2cn(CC(=O)Nc3ccc(O)cc3)nn2)C(O)C4O)nn1)Nc1ccc(O)cc1 |
|
AD22594 | 2.51 | 273.72 | C15H12ON3Cl | Cc1ccc2nn(Cc3ccccc3Cl)c(=O)n2c1 |
|
AD22595 | 1.51 | 264.37 | C15H24O2N2 | CNCc1ccc(OCCCN2CCOCC2)cc1 |
|
AD22596 | 2.21 | 1180.19 | C60H61O17N9 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(-c4cccc(CN)c4)c3)Oc3cc2cc(c3O)Oc2ccc(cc2)C1O |
|
AD22597 | -3.86 | 668.84 | C26H48O10N6S2 | CC(=O)NC1C(NC(=S)NCCCCCCCCNC(=S)NC2OC(CO)C(O)C(O)C2NC(C)=O)OC(CO)C(O)C1O |
|
AD22598 | -1.57 | 118.17 | C2H6N4S | S=C1NNCNN1 |
|
AD22599 | 2.12 | 177.25 | C11H15ON | COc1cccc(C2CCCN2)c1 |
|
AD22600 | 11.35 | 480.86 | C32H64O2 | CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)CC(=O)OC |