aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03001 | -0.92 | 166.14 | C7H6O3N2 | C#CCOc1c[nH]c(=O)[nH]c1=O |
|
AD03002 | 2.66 | 416.47 | C23H28O7 | C=CC1C(O)OC=C(C(=O)OC)C1CC1CC(=O)CC(CCc2ccc(O)cc2)O1 |
|
AD03003 | 1.18 | 132.15 | C7H6N3 | Nc1cccc2c1N=C[N]2 |
|
AD03004 | 1.01 | 231.34 | C12H25O3N | CCC(CC)NC1(C)CC(O)OC(C)C1O |
|
AD03005 | 1.04 | 100.12 | C5H8O2 | C=CCCC(=O)O |
|
AD03006 | -0.86 | 334.3 | C12H14O4N8 | COc1nc(N)c(N=CC=Nc2c(N)nc(OC)[nH]c2=O)c(=O)[nH]1 |
|
AD03007 | -2.29 | 289.29 | C11H19O6N3 | CCC(NC(=O)CO)C(=O)NC(CCC(=O)O)C(N)=O |
|
AD03008 | 5.73 | 283.5 | C18H37ON | CCCCCCCCCCCCCCCCCC(N)=O |
|
AD03009 | 8.28 | 852.26 | C47H89O8N5 | CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C(=O)NCCCCC(NC(=O)CCC(NC(=O)C(CC)NC(=O)CO)C(N)=O)C(=O)O |
|
AD03010 | 1.49 | 240.08 | C8H8N4Br | CN(C)c1ncnc2c1C(Br)=C[N]2 |