aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06361 | -2.1 | 194.17 | C7H8O2N5 | Nc1nc2c(c(=O)[n-]1)[N+](CCO)=C[N]2 |
|
AD06362 | 3.18 | 498.66 | C27H46O8 | CCOC(CC1CC(C)C(=O)C=CC(C)=CC(CO)C(CC)OC(=O)CC(O)C(C)C1O)OCC |
|
AD06363 | -0.28 | 574.2 | C12H22O16N2P4 | COP(=O)(O)OP(=O)(O)OP(=O)(O)CP(=O)(O)OCC1OC(n2cc(C)c(=O)[nH]c2=O)CC1O |
|
AD06364 | -1.5 | 344.46 | C16H32O4N4 | CC(C)(C)NCC1=CCC(N)C(OC2C(N)CC(N)C(O)C2O)O1 |
|
AD06365 | 1.37 | 248.67 | C12H9ON4Cl | C=NN=C1NC(=O)C(=Cc2ccc(Cl)cc2)N1 |
|
AD06366 | 1.95 | 343.28 | C14H11O5N6 | O=C(CCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)OCC1=C[N]N=N1 |
|
AD06367 | 1.75 | 276.08 | C6H3N3SI | Sc1ncnc2c1C(I)=C[N]2 |
|
AD06368 | -0.44 | 206.19 | C8H8O2N5 | O=C(O)CNCc1ncnc2c1N=C[N]2 |
|
AD06369 | 3.06 | 272.3 | C16H16O4 | COC(=O)c1ccc(OC)cc1OCc1ccccc1 |
|
AD06370 | -6.53 | 696.89 | C30H64O10N8 | CN(CCCCN(C)CC(O)COC1C(O)C(N)CC(N)C1OC1OC(CN)C(O)CC1N)CC(O)COC1C(O)C(N)CC(N)C1O |