aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31231 | -0.15 | 218.2 | C9H12O2N2F2 | O=CN1CC2CC2(C(=O)NCC(F)F)C1 |
|
AD31232 | 0.24 | 210.28 | C11H18O2N2 | CN(C)C(=O)C1C2CCC(C2)C1NC=O |
|
AD31233 | -0.54 | 212.25 | C10H16O3N2 | CN(C)C(=O)C1CCC2(CN(C=O)C2)O1 |
|
AD31234 | -0.31 | 205.22 | C10H11O2N3 | NC(=O)c1ccc2c(n1)CCN(C=O)C2 |
|
AD31235 | -0.48 | 208.22 | C9H12O2N4 | CC1c2nc(C(N)=O)cn2CCN1C=O |
|
AD31236 | 0.01 | 206.24 | C11H14O2N2 | O=CN1CCC2CC21C(=O)N1CC=CC1 |
|
AD31237 | -0.73 | 208.22 | C9H12O2N4 | NC(=O)C1CCN(C=O)Cc2ccnn21 |
|
AD31238 | 0.51 | 182.27 | C10H18ON2 | CC(C)(C)NC(=O)C12CNCC1C2 |
|
AD31239 | -0.51 | 184.24 | C9H16O2N2 | NC(=O)C1CNCC2CCCOC21 |
|
AD31240 | -0.01 | 178.24 | C10H14ON2 | O=C(C1CC12CNC2)N1CC=CC1 |