aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD38821 | -0.13 | 284.34 | C12H16O4N2S | CC(=O)N1CCc2cc(S(=O)(=O)NCCO)ccc21 |
|
AD38822 | 1.11 | 266.12 | C7H8O3NSBr | COc1ccc(S(N)(=O)=O)cc1Br |
|
AD38823 | 0.6 | 299.24 | C11H10ON6F3 | O=C1CN(c2ncnc3c2N=C[N]3)CCN1CC(F)(F)F |
|
AD38824 | 0.0 | 306.38 | C12H16ON7S | S=C(NCCN1CCOCC1)Nc1ncnc2c1N=C[N]2 |
|
AD38825 | 0.32 | 305.39 | C13H17ON6S | S=C(NCCN1CCOCC1)Nc1ncnc2c1C=C[N]2 |
|
AD38826 | 0.76 | 311.32 | C11H12O2N6FS | CCOC(=O)CCNC(=S)Nc1nc(F)nc2c1N=C[N]2 |
|
AD38827 | 0.63 | 293.33 | C11H13O2N6S | CCOC(=O)CCNC(=S)Nc1ncnc2c1N=C[N]2 |
|
AD38828 | 0.94 | 283.09 | C6H6O2NSI | NS(=O)(=O)c1ccc(I)cc1 |
|
AD38829 | 0.42 | 316.39 | C15H22ON7 | CCC(C)NC(=O)CN1CCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD38830 | 0.58 | 313.35 | C14H17ON8 | O=c1n(CCCNc2ncnc3c2N=C[N]3)nc2n1CCCC2 |