aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18081 | 3.55 | 285.49 | C9H12O4PCl3 | CCCOP(=O)(OC)OCC(Cl)(Cl)Cl |
|
AD18082 | 4.24 | 719.73 | C30H47O11N3P2S | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC1CCCCC1C(=O)CCCc1c[nH]c2ccccc12 |
|
AD18083 | 0.15 | 136.58 | C5H9ON2Cl | CNC(=O)NCCCl |
|
AD18084 | -0.4 | 103.08 | C2H5O2N3 | CNC(=O)NN=O |
|
AD18085 | -0.27 | 206.23 | C8H12N7 | NCCCNc1nc(N)nc2c1N=C[N]2 |
|
AD18086 | -5.88 | 728.84 | C30H60O14N6 | O=C(CN(CCOCCOCCN(CC(=O)NCCOCCO)CC(=O)NCCOCCO)CC(=O)NCCOCCO)NCCOCCO |
|
AD18087 | -3.71 | 604.7 | C26H48O10N6 | O=C(CC(NC(=O)CCCCC(=O)NC(CC(=O)NCCCO)C(=O)NCCCO)C(=O)NCCCO)NCCCO |
|
AD18088 | 3.52 | 378.54 | C20H30O3N2S | CN(C)c1cccc2c(S(=O)(=O)NCCCCCCCCO)cccc12 |
|
AD18089 | 0.49 | 212.19 | C10H6ON5 | O=c1[nH]cnc2c1N=C(c1cccnc1)[N]2 |
|
AD18090 | 4.19 | 631.85 | C30H49O9NS2 | CC(C=CC(C)C1CCC2C3CC(O)C4CC(OS(=O)(=O)O)CCC4(C)C3=CCC12C)C(C)C(=O)NCCS(=O)(=O)O |