aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43591 | 2.81 | 296.36 | C15H12ON4S | O=C(Nc1ccc(S)cc1)c1cn(-c2ccccn2)cn1 |
|
AD43592 | 2.65 | 304.37 | C15H16O3N2S | COCCOc1ccncc1C(=O)Nc1ccc(S)cc1 |
|
AD43593 | 2.65 | 304.37 | C15H16O3N2S | COCCOc1ccnc(C(=O)Nc2ccc(S)cc2)c1 |
|
AD43594 | 1.59 | 306.36 | C16H22O4N2 | CC(C)(C)OC(=O)N1Cc2ccccc2C1C(=O)NCCO |
|
AD43595 | 3.28 | 294.76 | C14H11O2N2ClS | COc1cnc(Cl)c(C(=O)Nc2ccc(S)cc2)c1 |
|
AD43596 | 1.64 | 350.42 | C18H26O5N2 | COc1ccc2c(c1)CCN(C(=O)OC(C)(C)C)C2C(=O)NCCO |
|
AD43597 | 2.46 | 315.4 | C16H17O2N3S | O=C(Nc1ccc(S)cc1)c1cncc(N2CCOCC2)c1 |
|
AD43598 | 3.26 | 315.39 | C17H17O3NS | CC(=O)OCC(C(=O)Nc1ccc(S)cc1)c1ccccc1 |
|
AD43599 | 2.47 | 309.35 | C15H11ON5S | O=C(Nc1ccc(S)cc1)c1cnc(-c2cnccn2)nc1 |
|
AD43600 | 3.22 | 296.3 | C13H10O2N2F2S | O=C(Nc1ccc(S)cc1)c1cccc(OC(F)F)n1 |