aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37071 | -0.55 | 278.39 | C12H18N6S | CSC1CN(c2ncnc3c2N=C[N]3)CC1[NH+](C)C |
|
AD37072 | 1.25 | 284.32 | C15H16O2N4 | CCc1cc2nc3c(=O)[nH]c(=O)nc-3n(C)c2cc1CC |
|
AD37073 | 1.34 | 290.71 | C14H11O2N4Cl | CCc1cc2nc3c(=O)[nH]c(=O)nc-3n(C)c2cc1Cl |
|
AD37074 | 1.34 | 290.71 | C14H11O2N4Cl | CCc1cc2c(cc1Cl)nc1c(=O)[nH]c(=O)nc-1n2C |
|
AD37075 | 0.77 | 262.66 | C12H7O2N4Cl | Cn1c2nc(=O)[nH]c(=O)c-2nc2cc(Cl)ccc21 |
|
AD37076 | 0.58 | 169.14 | C6H7O3N3 | COc1cnc(N)c([N+](=O)[O-])c1 |
|
AD37077 | 0.8 | 246.61 | C8H7O4N4Cl | CCOC(=O)c1nc(Cl)nc(N)c1[N+](=O)[O-] |
|
AD37078 | 0.81 | 252.29 | C12H18O3N3 | COc1cc(N2CCC([NH3+])CC2)ccc1[N+](=O)[O-] |
|
AD37079 | 0.25 | 249.2 | C11H8O3N3F | NC=C1C(=O)NC(=O)N(c2ccc(F)cc2)C1=O |
|
AD37080 | 1.06 | 220.27 | C12H16O2N2 | CC(=O)N1CCN(c2ccc(O)cc2)CC1 |