aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16211 | -0.65 | 135.11 | C5H3ON4 | O=c1[nH]cnc2c1C=N[N]2 |
|
AD16212 | -1.17 | 281.01 | C3H8O9P3 | COP(=O)([O-])CP(=O)([O-])OP(=O)([O-])OC |
|
AD16213 | 1.69 | 183.19 | C10H7N4 | C1=Cc2c(ncnc2-c2cc[nH]c2)[N]1 |
|
AD16214 | 1.13 | 275.7 | C13H10ON5Cl | Nc1nc2c(c(=O)[nH]1)[N+](Cc1ccc(Cl)cc1)=C[N]2 |
|
AD16215 | 2.5 | 301.28 | C13H20O5NP | CCOC(=O)C(C)NP(=O)(OC)OCc1ccccc1 |
|
AD16216 | -0.21 | 1411.96 | C44H62O30N11P5S | COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cnc3c(CCSC)nc(N)nc32)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)O |
|
AD16217 | 2.85 | 420.1 | C14H16O3N2Br2 | CCOC(=O)C1(Br)C(c2ccccc2)NC(=O)NC1(C)Br |
|
AD16218 | 2.47 | 274.32 | C16H18O4 | COc1cc(OC)cc(C(O)C(O)c2ccccc2)c1 |
|
AD16219 | -0.1 | 204.21 | C9H10ON5 | C1=N[N]c2ncnc(N3CCOCC3)c21 |
|
AD16220 | -0.63 | 706.43 | C21H33O17N4P3 | COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OCC(C)(COP(=O)(O)O)Cn1cc(C)c(=O)[nH]c1=O |