aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35311 | 2.26 | 217.22 | C12H11O3N | CNC(=O)Oc1cccc2c(O)cccc12 |
|
AD35312 | 1.91 | 254.29 | C14H14ON4 | O=c1nc(NCCc2c[nH]c3ccccc23)cc[nH]1 |
|
AD35313 | 1.13 | 255.26 | C13H11O2N4 | COc1ccccc1-n1c(C)nc2c(c1=O)C=N[N]2 |
|
AD35314 | 1.13 | 255.26 | C13H11O2N4 | COc1ccc(-n2c(C)nc3c(c2=O)C=N[N]3)cc1 |
|
AD35315 | 1.11 | 178.23 | C10H14ON2 | CNC(=O)c1ccc(N(C)C)cc1 |
|
AD35316 | 1.66 | 248.31 | C12H12O2N2S | Cc1ccc(SCc2c[nH]c(=O)[nH]c2=O)cc1 |
|
AD35317 | 2.59 | 241.72 | C13H16O2NCl | CN(C)C(=O)C(C)(C)Oc1ccc(Cl)cc1 |
|
AD35318 | 0.5 | 80.11 | C5H6N | c1cc[nH+]cc1 |
|
AD35319 | 0.81 | 257.3 | C12H15N7 | Cc1[nH+]ccn1CCCNc1ncnc2c1N=C[N]2 |
|
AD35320 | 0.11 | 260.35 | C13H20N6 | CC1CCC[NH+](CCNc2ncnc3c2N=C[N]3)C1 |