aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04641 | 0.35 | 434.47 | C14H14O8N2S3 | O=S(=O)([O-])CNc1ccc(S(=O)(=O)c2ccc(NCS(=O)(=O)[O-])cc2)cc1 |
|
AD04642 | 5.03 | 335.26 | C18H12N2Cl2S | Clc1ccc(Cc2nnc(Cc3ccccc3Cl)s2)cc1 |
|
AD04643 | -3.53 | 249.31 | C10H23O4N3 | NCCC(O)CNC1CC(N)C(O)C(O)C1O |
|
AD04644 | 3.17 | 220.06 | C10H7O2NCl2 | COC(=O)Nc1c(Cl)cccc1Cl |
|
AD04645 | 0.92 | 293.27 | C13H9ON8 | Nc1nc(-n2cc(-c3ccccc3O)nn2)nc2c1N=C[N]2 |
|
AD04646 | 6.46 | 414.67 | C28H46O2 | CC1CCC2(CC3CC4C5CCC6CC(O)CCC6(C)C5CCC4(C)C3C2C)OC1 |
|
AD04647 | 1.14 | 155.15 | C7H9O3N | COC(=O)NCc1ccco1 |
|
AD04648 | 1.05 | 141.13 | C6H7O3N | O=C(O)NCc1ccco1 |
|
AD04649 | -0.39 | 130.08 | C4H3O2N2F | O=c1nc(O)c(F)c[nH]1 |
|
AD04650 | 4.18 | 402.51 | C20H14N6S2 | Cc1nc(-n2ncc3c(S)ncnc32)c2c3c(sc2n1)CCc1ccccc1-3 |