aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33001 | 2.08 | 193.29 | C12H19ON | NC(=O)CC12CC3CC(CC(C3)C1)C2 |
|
AD33002 | 1.62 | 228.28 | C12H14N5 | C1=Nc2c(ncnc2N2CC(C3CCC3)C2)[N]1 |
|
AD33003 | 1.55 | 234.31 | C10H12N5S | CC1CSCC1Nc1ncnc2c1N=C[N]2 |
|
AD33004 | 1.22 | 220.26 | C10H14ON5 | COCCC(C)Nc1ncnc2c1N=C[N]2 |
|
AD33005 | 0.98 | 218.24 | C10H12ON5 | COCC1(Nc2ncnc3c2N=C[N]3)CC1 |
|
AD33006 | 0.46 | 209.24 | C11H15O3N | CC(O)c1ccc(C(=O)NCCO)cc1 |
|
AD33007 | 0.98 | 218.24 | C10H12ON5 | C1=Nc2c(ncnc2NC2CCCOC2)[N]1 |
|
AD33008 | 1.7 | 192.24 | C9H8ON2S | Cc1ccc2nc(C(N)=O)sc2c1 |
|
AD33009 | 1.8 | 205.04 | C9H6ON2Cl2 | Cc1cc(Cl)nc(Cl)c1C(N)=O |
|
AD33010 | 1.61 | 206.06 | C5H4ONSBr | NC(=O)c1cc(Br)cs1 |