aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15191 | 0.67 | 420.44 | C20H25O5N4F | O=C(O)CCNCCNc1cc2c(cc1F)c(=O)c(C(=O)NCCO)cn2C1CC1 |
|
AD15192 | 2.51 | 406.3 | C19H19N8Cl2 | Nc1nc(NCCN2CCN(c3cc(Cl)cc(Cl)c3)CC2)nc2c1N=C[N]2 |
|
AD15193 | 1.29 | 294.34 | C15H16N7 | Nc1nc(N2CCN(c3ccccc3)CC2)nc2c1N=C[N]2 |
|
AD15194 | 2.35 | 331.31 | C14H22O6NP | CCOC(=O)C(NP(=O)(O)Oc1ccc(OC)cc1)C(C)C |
|
AD15195 | 2.6 | 257.3 | C11H9N6S | Nc1nc(SCc2ccccc2)nc2c1N=N[N]2 |
|
AD15196 | 0.06 | 177.19 | C8H9ON4 | CN(C)c1nc2c(c(=O)[nH]1)C=C[N]2 |
|
AD15197 | 4.05 | 218.32 | C13H14OS | CCCSc1cccc2c(O)cccc12 |
|
AD15198 | 0.38 | 283.33 | C13H21O4N3 | NC(C(=O)NCCCCCCO)c1ccc(C(=O)O)[nH]1 |
|
AD15199 | 0.03 | 177.19 | C8H9ON4 | CC(O)C1=C[N]c2ncnc(N)c21 |
|
AD15200 | 2.61 | 398.41 | C20H16ON9 | CCNC(=O)c1cnn(-c2nc3c(c(Nc4ccc5ccccc5n4)n2)N=C[N]3)c1 |