aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13071 | -4.27 | 324.33 | C11H18O8NS | CC(=O)NC1C(O)CC(S)(C(=O)[O-])OC1C(O)C(O)CO |
|
AD13072 | 0.8 | 522.53 | C24H31O8N4F | O=C(O)CNC(=O)CCNCCOCCOCCNc1cc2c(cc1F)c(=O)c(C(=O)O)cn2C1CC1 |
|
AD13073 | 1.28 | 450.88 | C21H23O6N4Cl | O=C(O)CNC(=O)CCNCCNc1cc2c(=O)c(C(=O)O)cn(C3CC3)c2cc1Cl |
|
AD13074 | 12.15 | 702.16 | C45H83O4N | CCCCCCCC=CC(C)=CCCC=CC(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCC=CCCCCCCCC |
|
AD13075 | 1.54 | 281.3 | C14H13ON6 | Nc1nc(NC(=O)CCc2ccccc2)nc2c1N=C[N]2 |
|
AD13076 | -0.29 | 138.13 | C6H6O2N2 | C=Cc1cc(=O)[nH]c(=O)[nH]1 |
|
AD13077 | 8.52 | 453.75 | C28H55O3N | CCCCCCCCCCCCCCCC(=O)N(C)CCCCCCCCCCC(=O)O |
|
AD13078 | -2.57 | 215.2 | C5H11O7S | O=S(=O)([O-])OCC(CO)(CO)CO |
|
AD13079 | 6.65 | 589.81 | C34H55O7N | CC1(C)CCC2(C(=O)OCCCCO[N+](=O)[O-])CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1 |
|
AD13080 | 1.37 | 222.2 | C11H10O5 | O=C(O)C=C(O)COC(=O)c1ccccc1 |