aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39531 | 1.56 | 275.36 | C14H21ON5 | CCC1C(=O)N(C)c2cnc(N)nc2N1C1CCCC1 |
|
AD39532 | 1.92 | 269.3 | C15H15O2N3 | COc1ccc(Cn2cc3[nH]c(N)ccc-3c2=O)cc1 |
|
AD39533 | 1.68 | 266.73 | C14H15O2N2Cl | NC(=O)C1CCN(C(=O)c2ccccc2Cl)CC1 |
|
AD39534 | 0.96 | 290.36 | C16H22O3N2 | Cc1ccc(C(=O)N2CCC(C(=O)NCCO)CC2)cc1 |
|
AD39535 | 2.36 | 284.34 | C14H12ON4S | O=C(Cn1nc2ccccc2n1)Nc1ccc(S)cc1 |
|
AD39536 | 0.51 | 302.37 | C14H26O5N2 | CC(C)(C)OC(=O)N1CCC(OCC(=O)NCCO)CC1 |
|
AD39537 | 1.52 | 263.32 | C12H13O2N3S | CN1N=C(C(=O)Nc2ccc(S)cc2)CCC1=O |
|
AD39538 | 1.82 | 299.28 | C12H14N6F3 | FC(F)(F)CN1CCCC(Nc2ncnc3c2N=C[N]3)C1 |
|
AD39539 | 1.44 | 297.32 | C15H15O2N5 | Cc1ccc(CC(=O)Nc2ncnc3[nH]c(=O)[nH]c23)cc1C |
|
AD39540 | 0.17 | 284.7 | C13H13O4N2Cl | O=C(CN1C(=O)COc2ccc(Cl)cc21)NCCO |