aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16941 | 1.57 | 722.84 | C36H50O8N8 | CN(C)CCCN1C(=O)c2ccc3c4c(c(NCCCn5cc(COCCOCCOCCO)nn5)cc(c24)C1=O)C(=O)N(CCCN(C)C)C3=O |
|
AD16942 | 3.82 | 250.34 | C15H22O3 | CCCCCCCOc1ccc(C(=O)OC)cc1 |
|
AD16943 | 11.46 | 1013.61 | C32H38O4NF27 | CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
|
AD16944 | 0.15 | 608.66 | C29H36O7N8 | NC(=O)C(CCC(=O)NCCNCCNc1c2ccccc2nc2cccc([N+](=O)[O-])c12)NC(=O)C1CCCN1C(=O)CO |
|
AD16945 | 1.79 | 127.23 | C8H17N | CNCC1CCCCC1 |
|
AD16946 | 10.03 | 1513.45 | C76H71O20N7Cl2S2 | CCCCCCSC1=C(SCCCCCC)C(=O)N(C2C(=O)NC3Cc4ccc(c(Cl)c4)Oc4cc5cc(c4O)Oc4ccc(cc4Cl)C(O)C4NC(=O)C(NC(O)C5NC(=O)C(NC3=O)c3cc(O)cc(c3)Oc3cc2ccc3O)c2ccc(O)c(c2)-c2c(O)cc(O)cc2C(C(=O)O)NC4=O)C1=O |
|
AD16947 | 10.96 | 1507.45 | C79H81O19N9Cl2 | CCCCCCCCCCCCCCCCOCc1cn(C2C(=O)NC3Cc4ccc(c(Cl)c4)Oc4cc5cc(c4O)Oc4ccc(cc4Cl)C(O)C4NC(=O)C(NC(O)C5NC(=O)C(NC3=O)c3cc(O)cc(c3)Oc3cc2ccc3O)c2ccc(O)c(c2)-c2c(O)cc(O)cc2C(C(=O)O)NC4=O)nn1 |
|
AD16948 | 1.01 | 231.34 | C12H25O3N | CCCCCNC1(C)CC(O)OC(C)C1O |
|
AD16949 | 3.2 | 341.18 | C12H14N4I | IC1=C[N]c2ncnc(NC3CCCCC3)c21 |
|
AD16950 | 8.5 | 640.95 | C40H64O6 | C=CC(C)(O)CCCC(C)C(=O)OC1CC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2CC1(C)C |