aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43471 | 2.78 | 303.39 | C15H17O2N3S | O=C(Nc1ccc(S)cc1)c1cnn(C2CCOCC2)c1 |
|
AD43472 | 3.33 | 315.39 | C17H17O3NS | COC(=O)c1ccccc1CCC(=O)Nc1ccc(S)cc1 |
|
AD43473 | 1.48 | 322.41 | C17H26O4N2 | CC(C)(C)OC(=O)NCC(Cc1ccccc1)C(=O)NCCO |
|
AD43474 | 2.87 | 310.38 | C16H14ON4S | O=C(Nc1ccc(S)cc1)c1ncn(Cc2ccccc2)n1 |
|
AD43475 | 2.94 | 301.37 | C16H15O3NS | COC(=O)c1ccccc1CC(=O)Nc1ccc(S)cc1 |
|
AD43476 | 3.34 | 334.38 | C20H18O3N2 | NC(=O)c1ncc(OCc2ccccc2)cc1OCc1ccccc1 |
|
AD43477 | 3.31 | 321.37 | C16H16O3NFS | COc1ccc(CC(=O)Nc2ccc(S)cc2)c(F)c1OC |
|
AD43478 | 1.51 | 344.36 | C16H22O4N2F2 | CC(C)(C)OC(=O)NC(Cc1cc(F)cc(F)c1)C(=O)NCCO |
|
AD43479 | 2.68 | 329.19 | C13H17O3N2Br | CC(C)(C)OC(=O)N(CC(N)=O)c1ccc(Br)cc1 |
|
AD43480 | 2.01 | 336.43 | C18H28O4N2 | CC(C)(C)OC(=O)NC(CCCc1ccccc1)C(=O)NCCO |