aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19061 | 2.57 | 302.32 | C16H12N7 | Nc1nc(NN=Cc2ccc3ccccc3c2)nc2c1N=C[N]2 |
|
AD19062 | 0.22 | 112.08 | C3H6O2F2 | OCOCC(F)F |
|
AD19063 | 4.2 | 373.52 | C21H27O3NS | CCCCC1(CC)CS(=O)(=O)c2cc(O)ccc2C(c2ccccc2)N1 |
|
AD19064 | 5.11 | 364.44 | C23H24O4 | COCCCCOc1ccc2c3c(oc2c1)C(C)(C)c1ccccc1C3=O |
|
AD19065 | 5.05 | 425.56 | C26H29N6 | C1=Nc2c(nc(CNC3CCCCC3)nc2NCC(c2ccccc2)c2ccccc2)[N]1 |
|
AD19066 | -0.88 | 198.14 | C6H6O4N4 | NC(=O)c1c[nH]c([N+](=O)[O-])c1C(N)=O |
|
AD19067 | 1.23 | 286.29 | C15H14O4N2 | NC(=O)CN(C(=O)c1ccc(O)cc1)c1ccc(O)cc1 |
|
AD19068 | 2.72 | 457.62 | C25H39O3N5 | CC(C)c1[nH]nc(O)c1Cc1ccc(CCCC(=O)NC(C)(C)C(=O)NCCN(C)C)cc1 |
|
AD19069 | 2.68 | 373.34 | C16H24O7NP | CCOC(=O)CCC(NP(=O)(OC)Oc1ccccc1)C(=O)OCC |
|
AD19070 | 4.65 | 490.73 | C30H50O5 | CC(CCC(O)C(C)(C)O)C1CCC2(C)C3C(=O)C=C4C(CCC(O)C4(C)C)C3(C)C(O)CC12C |