aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05171 | 3.71 | 320.42 | C19H16ON2S | O=c1[nH]cc(C2c3ccccc3CCc3ccccc32)c(=S)[nH]1 |
|
AD05172 | 4.87 | 682.91 | C40H54O4N6 | NC1CC(N)C(OCc2ccc3ccccc3c2)C(OCCCCCCNC(=O)CCCCN(Cc2ccccn2)Cc2ccccn2)C1O |
|
AD05173 | -0.1 | 271.26 | C11H11ON8 | CCNC(=O)c1cnn(-c2nc(N)c3c(n2)[N]C=N3)c1 |
|
AD05174 | 2.03 | 172.03 | C6H6NBr | Nc1cccc(Br)c1 |
|
AD05175 | -0.12 | 154.21 | C8H14ON2 | O=C1NCCC12CCNCC2 |
|
AD05176 | 8.93 | 670.8 | C32H64O10P2 | CCCCCCCCCCCCCCOCC(COP(=O)([O-])OP(=O)([O-])OC)OC(=O)CCCCCCCCCCCCC |
|
AD05177 | 2.81 | 246.26 | C14H14O4 | Cc1cc(O)c(C(=O)CCc2ccoc2)c(O)c1 |
|
AD05178 | 7.31 | 442.73 | C30H50O2 | C=C(CCC=C(C)C)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3CCC12C |
|
AD05179 | 5.57 | 490.73 | C30H50O5 | CC(CCC(O)C(C)(C)O)C1CCC2(C(=O)O)C3CCC4C(=CCC(O)C4(C)C)CC3CCC12C |
|
AD05180 | 1.23 | 647.73 | C33H41O7N7 | CC(C)C(NC(=O)CO)C(=O)NC(CCC(=O)NCCCCCC(=O)Nc1ccc2c(c1)CN1C(=O)c3ccccc3C1=N2)C(N)=O |