aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08491 | -0.21 | 178.18 | C7H8ON5 | OCCNc1ncnc2c1N=C[N]2 |
|
AD08492 | 1.75 | 296.36 | C16H24O5 | C=C1C(O)CC2C(CO)=COC(OC(=O)CC(C)C)C12C |
|
AD08493 | -1.1 | 629.81 | C26H43O7N7S2 | CSCCCCCCSCC(=O)NCCN(CC(=O)NCCN(CC(N)=O)C(=O)Cn1cc(C)c(=O)[nH]c1=O)C(C)=O |
|
AD08494 | 1.09 | 210.22 | C11H8N5 | Nc1ncnc2c1C(c1ccccn1)=C[N]2 |
|
AD08495 | 4.35 | 302.8 | C19H19O2Cl | CC1(COc2ccc(Cc3ccccc3Cl)cc2)COC1 |
|
AD08496 | 3.66 | 411.2 | C13H8O2N4SI | O=[N+]([O-])c1ccc(CSc2ncnc3c2C(I)=C[N]3)cc1 |
|
AD08497 | 0.57 | 366.43 | C12H14O2N8S2 | CSc1nc(N)c(N=CC=Nc2c(N)nc(SC)[nH]c2=O)c(=O)[nH]1 |
|
AD08498 | 0.43 | 172.17 | C8H6N5 | C#CCNc1ncnc2c1N=C[N]2 |
|
AD08499 | 3.49 | 270.36 | C15H20N5 | CC(C)=CCCC(C)=CCNc1ncnc2c1N=C[N]2 |
|
AD08500 | 2.59 | 289.32 | C16H13N6 | C1=Nc2c(ncnc2NCCc2cnc3ccccc3c2)[N]1 |