aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43361 | 2.09 | 334.42 | C18H26O4N2 | CC(C)(C)OC(=O)N1CCC(C(=O)NCCO)C1c1ccccc1 |
|
AD43362 | 1.33 | 323.97 | C8H8O2N2Br2 | O=C(NCCO)c1cncc(Br)c1Br |
|
AD43363 | 2.81 | 354.82 | C13H9O2N5ClS2 | Cc1cccc(Cl)c1S(=O)(=O)Nc1[nH]c(=S)nc2c1N=C[N]2 |
|
AD43364 | 1.42 | 307.34 | C16H15ON6 | N=c1nc2c(c(N)n1C(=O)c1cccc3c1CCCC3)N=C[N]2 |
|
AD43365 | 3.17 | 310.42 | C15H22O3N2S | CC(C(=O)Nc1ccc(S)cc1)N(C)C(=O)OC(C)(C)C |
|
AD43366 | 3.25 | 319.38 | C16H17O4NS | COc1ccc(C(=O)Nc2ccc(S)cc2)c(OC)c1OC |
|
AD43367 | 2.66 | 324.36 | C17H12O3N2S | O=C(Nc1ccc(S)cc1)c1ccc(N2C(=O)C=CC2=O)cc1 |
|
AD43368 | 2.01 | 345.4 | C19H23O5N | COc1cc(C(=O)NCCO)ccc1OCCOCc1ccccc1 |
|
AD43369 | 2.17 | 331.77 | C14H8ON6ClS | O=C(NC(=S)Nc1nc(Cl)nc2c1N=C[N]2)c1ccccc1 |
|
AD43370 | 2.62 | 292.96 | C8H7ONBr2 | Cc1cc(Br)c(C(N)=O)c(Br)c1 |