aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43101 | 2.8 | 328.57 | C14H6N6Cl3 | N=c1nc2c(c(N)n1-c1cc(Cl)c(Cl)c(Cl)c1)N=C[N]2 |
|
AD43102 | 2.73 | 346.42 | C14H12O2N5S2 | O=S(=O)(Nc1[nH]c(=S)nc2c1N=C[N]2)c1ccc(C2CC2)cc1 |
|
AD43103 | 3.14 | 319.36 | C16H14O3NFS | O=C(Nc1ccc(S)cc1)c1ccc(OC2COC2)c(F)c1 |
|
AD43104 | 1.16 | 330.34 | C16H17O2N5F | NC(=O)C1=C(Nc2cc(C(=O)N3CCCCC3)ccc2F)[N]C=N1 |
|
AD43105 | 3.26 | 297.38 | C13H12O2NFS2 | CS(=O)(=O)c1ccc(Nc2ccc(S)cc2)cc1F |
|
AD43106 | 3.05 | 291.4 | C13H13ON3S2 | CSc1ncc(C(=O)Nc2ccc(S)cc2)c(C)n1 |
|
AD43107 | 3.07 | 289.36 | C15H15O3NS | O=S(=O)(Nc1ccc(O)cc1)c1ccc(C2CC2)cc1 |
|
AD43108 | 2.99 | 326.38 | C16H14O2N4S | O=C(CCc1nc(-c2cccnc2)no1)Nc1ccc(S)cc1 |
|
AD43109 | 2.38 | 358.16 | C11H13ON5I | CCCCNC(=O)Nc1ncnc2c1C(I)=C[N]2 |
|
AD43110 | 2.84 | 316.38 | C16H16O3N2S | CC1(c2cccc(C(=O)Nc3ccc(S)cc3)n2)OCCO1 |