aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39791 | 1.42 | 254.23 | C11H8ON7 | O=C(Nc1ccccn1)Nc1ncnc2c1N=C[N]2 |
|
AD39792 | 1.39 | 296.11 | C9H8ON6Br | O=C(Nc1ncnc2c1N=C(Br)[N]2)NC1CC1 |
|
AD39793 | 1.03 | 294.17 | C9H12O3NSBr | Cc1cc(Br)cc(S(=O)(=O)NCCO)c1 |
|
AD39794 | 1.99 | 315.38 | C14H15ON6S | O=C(C1CC1)N1CC=C(Nc2[nH]c(=S)nc3c2N=C[N]3)CC1 |
|
AD39795 | 1.98 | 312.4 | C11H14O2N5S2 | O=S(=O)(CC1CCCC1)Nc1[nH]c(=S)nc2c1N=C[N]2 |
|
AD39796 | 0.7 | 299.08 | C9H6ON5FBr | NC(=O)C1=C(Nc2cc(Br)cnc2F)[N]C=N1 |
|
AD39797 | 0.01 | 292.32 | C13H18O3N5 | CC(C)(C)OC(=O)N1CC=C(NC2=C(C(N)=O)N=C[N]2)C1 |
|
AD39798 | 2.1 | 301.33 | C14H17O2N6 | CC(C)(C)OC(=O)N1CCC(=Nc2ncnc3c2N=C[N]3)C1 |
|
AD39799 | 0.34 | 303.3 | C14H15O4N4 | CCOC(=O)COc1ccc(NC2=C(C(N)=O)N=C[N]2)cc1 |
|
AD39800 | 0.94 | 292.34 | C12H14O2N5S | CCOC(=O)CCNC(=S)Nc1ncnc2c1C=C[N]2 |