aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD09031 | 2.16 | 270.29 | C15H14O3N2 | COc1ccc(C=NNC(=O)c2ccc(O)cc2)cc1 |
|
AD09032 | 1.68 | 316.49 | C17H36O3N2 | CCCCCCCCCCCOC1C(N)CC(N)C(O)C1O |
|
AD09033 | 3.79 | 253.75 | C13H12ONClS | CCOc1cnc(Cc2ccccc2Cl)s1 |
|
AD09034 | 4.33 | 282.39 | C15H10N2S2 | N#Cc1ccccc1Cc1ncc(-c2ccsc2)s1 |
|
AD09035 | 2.9 | 788.97 | C39H68O14N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2OC(C)=O)C(C)(O)CC(C)C(=O)C(C)C(OC(=O)CCNC(=O)OC(C)(C)C)C1(C)O |
|
AD09036 | 6.21 | 472.71 | C30H48O4 | C=C(CCC(C)C1CCC2C3CC=C4CC(O)CCC4(CO)C3CCC12C)C(C)(C)OC(C)=O |
|
AD09037 | 4.02 | 266.32 | C12H27O4P | CCCCCCCCCCCCOP(=O)(O)O |
|
AD09038 | 8.23 | 368.65 | C24H48O2 | CCCCCCCCCCC(CCCCCCCCCC)CC(=O)OC |
|
AD09039 | 2.13 | 368.34 | C15H14O3N9 | O=[N+]([O-])c1ccc(NCCCCNc2ncnc3c2N=C[N]3)c2nonc12 |
|
AD09040 | 0.53 | 101.15 | C5H11ON | CC(C)(C)NC=O |