aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31361 | 0.44 | 225.23 | C7H6N6FS | CNC(=S)Nc1nc(F)nc2c1N=C[N]2 |
|
AD31362 | 0.48 | 205.21 | C7H8O3NFS | COc1cc(S(N)(=O)=O)ccc1F |
|
AD31363 | 0.78 | 189.21 | C7H8O2NFS | Cc1cccc(S(N)(=O)=O)c1F |
|
AD31364 | 0.16 | 209.23 | C8H7O2N3S | Cc1cn2c(=O)c(C(N)=O)cnc2s1 |
|
AD31365 | 0.06 | 205.22 | C10H11O2N3 | O=C(NCCO)c1cc2cccn2cn1 |
|
AD31366 | 0.06 | 205.22 | C10H11O2N3 | O=C(NCCO)c1ccc2nccn2c1 |
|
AD31367 | -0.8 | 212.25 | C10H16O3N2 | O=CN1C2CCC1CN(C(=O)CCO)C2 |
|
AD31368 | -0.94 | 212.25 | C10H16O3N2 | O=CN1CC2CC(C1)N(C(=O)CCO)C2 |
|
AD31369 | 0.12 | 208.22 | C10H12O3N2 | O=C(NCCO)NC(=O)c1ccccc1 |
|
AD31370 | -0.8 | 212.25 | C10H16O3N2 | O=CN1CC2CCC(C1)N2C(=O)CCO |