aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39891 | 2.39 | 265.31 | C12H12ON3FS | O=C(Nc1ccc(S)cc1)c1cncn1CCF |
|
AD39892 | 1.63 | 307.34 | C16H15ON6 | CN(c1ncnc2c1N=C[N]2)C1CCN(c2ccccc2)C1=O |
|
AD39893 | 1.92 | 313.32 | C13H9O2N6S | S=C(Nc1ccc2c(c1)OCO2)Nc1ncnc2c1N=C[N]2 |
|
AD39894 | 1.73 | 266.1 | C10H8ON3Br | NC(=O)c1cn(-c2ccccc2Br)cn1 |
|
AD39895 | 1.79 | 280.12 | C11H10ON3Br | NC(=O)c1cncn1Cc1cccc(Br)c1 |
|
AD39896 | 1.61 | 261.33 | C11H13N6S | S=C(Nc1ncnc2c1N=C[N]2)NC1CCCC1 |
|
AD39897 | 0.65 | 281.36 | C14H23O3N3 | Cc1nn(CC2CCOCC2)c(C)c1C(=O)NCCO |
|
AD39898 | 1.03 | 293.31 | C15H13ON6 | N=c1nc2c(c(N)n1C(=O)c1ccc3c(c1)CCC3)N=C[N]2 |
|
AD39899 | 1.39 | 295.3 | C15H13O2N5 | O=C(Nc1ncnc2[nH]c(=O)[nH]c12)c1ccc2c(c1)CCC2 |
|
AD39900 | 2.4 | 265.11 | C11H9ON2Br | Cc1cc(C(N)=O)c2cc(Br)ccc2n1 |