aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43131 | 2.23 | 273.32 | C13H17ON6 | O=C(Nc1ncnc2c1N=C[N]2)NC1CCCCCC1 |
|
AD43132 | 3.21 | 289.36 | C15H15O3NS | COCOc1ccc(C(=O)Nc2ccc(S)cc2)cc1 |
|
AD43133 | 2.65 | 320.37 | C15H16O4N2S | COc1cc(C(=O)Nc2ccc(S)cc2)c(OC)nc1OC |
|
AD43134 | 2.15 | 333.13 | C11H7ON7Br | O=C(Nc1ccccn1)Nc1ncnc2c1N=C(Br)[N]2 |
|
AD43135 | 1.68 | 328.43 | C15H24O4N2S | CC(C)(C)OC(=O)NC(CC(=O)NCCO)Cc1cccs1 |
|
AD43136 | 2.98 | 299.15 | C10H7O2N2SBr | O=C(Nc1ccc(S)cc1)c1cc(Br)no1 |
|
AD43137 | 0.57 | 137.14 | C6H7ON3 | NC(=O)Nc1ccccn1 |
|
AD43138 | 3.35 | 328.44 | C18H20O2N2S | O=C(Nc1ccc(S)cc1)C1(Cc2cccnc2)CCOCC1 |
|
AD43139 | 2.48 | 285.26 | C13H10ON6F | Cc1ccc(F)cc1NC(=O)Nc1ncnc2c1N=C[N]2 |
|
AD43140 | 2.94 | 310.35 | C18H18O3N2 | O=C1CCN(C(=O)c2ccc(Nc3ccc(O)cc3)cc2)CC1 |