aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD38081 | 1.67 | 283.27 | C13H11O2N6 | COc1ccc(CN=NC2=Nc3c(nc[nH]c3=O)[N]2)cc1 |
|
AD38082 | 1.67 | 283.27 | C13H11O2N6 | COc1ccccc1CN=NC1=Nc2c(nc[nH]c2=O)[N]1 |
|
AD38083 | 2.22 | 279.28 | C14H11ON6 | O=c1[nH]cnc2c1N=C(N=NC=CCc1ccccc1)[N]2 |
|
AD38084 | 1.63 | 242.33 | C9H10O2N2S2 | CC(C#N)S(=O)(=O)Nc1ccc(S)cc1 |
|
AD38085 | 2.27 | 240.35 | C13H24O2N2 | CC(C)(C)OC(=O)N1CCC(N)CC12CCC2 |
|
AD38086 | 2.38 | 255.16 | C11H15N2Br | NC1CCN(c2ccc(Br)cc2)CC1 |
|
AD38087 | 2.28 | 258.37 | C16H22ON2 | NC1CCC2CN(C(=O)c3ccccc3)CCC2C1 |
|
AD38088 | 1.8 | 257.24 | C11H13O2N3F2 | NC1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 |
|
AD38089 | 1.9 | 238.72 | C13H15ON2Cl | NC1CCN(C(=O)c2ccc(Cl)cc2)CC1 |
|
AD38090 | 2.04 | 256.71 | C13H14ON2FCl | NC1CCN(C(=O)c2ccc(F)c(Cl)c2)CC1 |