aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10061 | 2.13 | 210.22 | C11H8N5 | C1=Nc2c(ncnc2Nc2ccccc2)[N]1 |
|
AD10062 | -0.47 | 146.19 | C6H14O2N2 | NCCCCC(N)C(=O)O |
|
AD10063 | -1.78 | 1217.36 | C59H92O26 | CC1OC2OC3C(OCC(O)C3O)OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(CO)C(O)C(O)C7OC7OC(COC(=O)CC(C)(O)CC(=O)OC1C(O)C2O)C(O)C(O)C7O)C(C)(CO)C6CCC5(C)C3(C)CC4 |
|
AD10064 | 3.93 | 1355.21 | C68H65O17N11Cl2 | NCCCNCCNCCCNC(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C4NC(=O)C(Cc5ccc(c(Cl)c5)Oc5cc3cc(c5O)Oc3ccc(cc3Cl)C2O)NC(=O)C(N)c2ccc(O)c(c2)Oc2cc(O)cc4c2)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD10065 | 3.56 | 240.33 | C14H12N2S | c1ccc(C2=NN(c3ccccc3)CS2)cc1 |
|
AD10066 | 1.39 | 486.34 | C17H25O2N7I | CN(CCCCN(C)c1ncnc2c1N=C[N]2)C(=O)CCCNC(=O)CI |
|
AD10067 | 2.09 | 157.26 | C9H19ON | CCCCCCCCNC=O |
|
AD10068 | 5.98 | 456.71 | C30H48O3 | CC1CCC23COC4(C=CC5C6(C)CCC(O)C(C)(C)C6CCC5(C)C4(C)CC2O)C3C1C |
|
AD10069 | 0.55 | 300.14 | C8H17O2N2I | CN(CCI)CCCC(N)C(=O)O |
|
AD10070 | 2.07 | 242.29 | C11H8N5S | C1=Nc2c(CSc3ccccn3)ncnc2[N]1 |