aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17951 | 0.13 | 112.09 | CH5O2PS | CO[PH](O)=S |
|
AD17952 | 0.71 | 234.21 | C10H10O3N4 | O=[N+]([O-])c1ccc(-n2cc(CCO)nn2)cc1 |
|
AD17953 | 1.85 | 288.26 | C15H12O6 | CC1=C2OC(C)(C)c3cc(O)c(C(=O)O)c(c32)C(=O)C1=O |
|
AD17954 | 3.07 | 200.24 | C13H12O2 | COc1cccc(-c2ccc(O)cc2)c1 |
|
AD17955 | 0.24 | 196.6 | C7H5N6Cl | Nc1nc(Cl)nc2c(N)ncnc12 |
|
AD17956 | 1.14 | 468.65 | C26H40O2N6 | CN(C)CCC(N)C(=O)NCc1cccc(-c2cccc(CNC(=O)C(N)CCN(C)C)c2)c1 |
|
AD17957 | 5.21 | 300.83 | C20H21OCl | CCCc1ccc(Cc2ccc3c(c2Cl)CC(C)O3)cc1 |
|
AD17958 | 13.46 | 678.18 | C44H87O3N | CCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC |
|
AD17959 | 0.83 | 208.29 | C9H12N4S | CC(=NNC(N)=S)c1cccc(N)c1 |
|
AD17960 | 0.38 | 324.51 | C13H28O3N2S2 | CSCCCCCCSC1OC(CN)C(O)C(O)C1N |