aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03951 | -0.83 | 167.17 | C6H9ON5 | CN1CNc2nc(N)[nH]c(=O)c21 |
|
AD03952 | 4.53 | 526.74 | C28H46O7S | CC(C)C(C)C1OC1C(C)(O)C1CCC2C3CC(O)C4CC(OS(=O)(=O)O)CCC4(C)C3=CCC21C |
|
AD03953 | 3.81 | 318.76 | C18H15O4Cl | CC(C)(Oc1ccc(C(=O)c2ccc(Cl)cc2)cc1)C(=O)O |
|
AD03954 | 0.39 | 481.54 | C22H29O3N10 | N=C(N)NCCCC(NC(=O)CCc1ccc(CCNc2nc(N)c3c(n2)[N]C=N3)cc1)C(=O)O |
|
AD03955 | 2.71 | 286.22 | C12H15O6P | COC(=O)c1cccc(C2CCOP(=O)(OC)O2)c1 |
|
AD03956 | 4.0 | 504.71 | C30H48O6 | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC43C)C12 |
|
AD03957 | 2.13 | 311.37 | C15H19N8 | CNc1nc(-n2cc(CC3CCCCC3)nn2)nc2c1N=C[N]2 |
|
AD03958 | 3.01 | 302.16 | C15H13O3NCl2 | C=C(CC)C(=O)c1ccc(OCC(N)=O)c(Cl)c1Cl |
|
AD03959 | 2.01 | 267.32 | C14H15N6 | Nc1nc2c(c(NCCCc3ccccc3)n1)N=C[N]2 |
|
AD03960 | -0.53 | 180.1 | C5H2O3N5 | O=NN1[N]c2ncnc(O)c2C1=O |