aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16921 | -1.7 | 762.92 | C31H46O7N12S2 | CSCCCCCCSCC(=O)NCCN(CC(=O)NCCN(CC(N)=O)C(=O)Cn1cnc2c(N)ncnc21)C(=O)Cn1cc(C)c(=O)[nH]c1=O |
|
AD16922 | 2.99 | 241.22 | C11H10N3F3 | Cc1nc(N)[nH]c1-c1ccc(C(F)(F)F)cc1 |
|
AD16923 | 5.46 | 1129.22 | C58H72O19N4 | CC(=O)OC1C(=O)C2(C)C(O)CC3OCC3(OC(C)=O)C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(OC(=O)N(C)CCN(C)C(=O)OCc3ccc(O)c(N)c3)C(NC(=O)OC(C)(C)C)c3ccccc3)C(C)=C1C2(C)C |
|
AD16924 | 3.98 | 303.43 | C17H21O2NS | CNC(=O)c1sccc1OCc1ccc(C(C)(C)C)cc1 |
|
AD16925 | 1.96 | 216.03 | C7H6O2NBr | ON=Cc1cc(Br)ccc1O |
|
AD16926 | 0.76 | 235.23 | C12H7N6 | Nc1nc(C#Cc2ccncc2)nc2c1N=C[N]2 |
|
AD16927 | 1.77 | 260.2 | C13H8O6 | O=c1c2c(O)cc(O)cc2oc2c(O)ccc(O)c12 |
|
AD16928 | 0.77 | 113.08 | C3H6NF3 | CNCC(F)(F)F |
|
AD16929 | 0.82 | 309.27 | C14H15O7N | CNC(=O)c1cc(OC(C)=O)c(OC(C)=O)c(OC(C)=O)c1 |
|
AD16930 | 2.35 | 204.06 | C10H7ONCl2 | CNC(=O)c1ccc(Cl)cc1Cl |