aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39171 | -1.15 | 114.17 | C6H12ON | OC1CC2(CC[NH2+]2)C1 |
|
AD39172 | 1.58 | 300.75 | C11H11O2N5ClS | O=S(=O)(CC1CCC1)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD39173 | -0.91 | 116.18 | C6H14ON | CC1CCC(O)C[NH2+]1 |
|
AD39174 | -1.05 | 116.18 | C6H14ON | CC1C[NH2+]CCC1O |
|
AD39175 | -1.3 | 114.17 | C6H12ON | OC1CC2C[NH2+]C1C2 |
|
AD39176 | -1.3 | 114.17 | C6H12ON | OC1C2CCC1[NH2+]C2 |
|
AD39177 | -1.15 | 114.17 | C6H12ON | OC1CC2CCC1[NH2+]2 |
|
AD39178 | 1.51 | 269.35 | C10H11O2N3S2 | Cn1ccnc1S(=O)(=O)Nc1ccc(S)cc1 |
|
AD39179 | 0.45 | 297.69 | C10H9O5NFClS | O=C(O)c1cc(S(=O)(=O)NCCO)c(Cl)cc1F |
|
AD39180 | -0.12 | 293.33 | C12H13O3N4S | Cc1cccc(C)c1S(=O)(=O)NC1=C(C(N)=O)N=C[N]1 |