aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD02761 | 0.78 | 220.26 | C9H8ON4S | C=NN=C1NC(=O)C(=Cc2cccs2)N1 |
|
AD02762 | 5.26 | 302.4 | C19H14N2S | Cc1ccc(-c2cc(-c3ccccc3)c(C#N)c(=S)[nH]2)cc1 |
|
AD02763 | 0.52 | 256.25 | C12H16O6 | CC=C1C(O)OC=C(C(=O)OC)C1CC(=O)OC |
|
AD02764 | -0.95 | 181.17 | C9H9O4 | O=C([O-])C(O)Cc1ccc(O)cc1 |
|
AD02765 | 3.13 | 751.93 | C42H53O6N7 | CCCCCCC(N)C(=O)NC(Cc1ccc(O)cc1)C(=O)N1CCCC1C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(Cc1ccccc1)C(N)=O |
|
AD02766 | 1.83 | 918.63 | C41H26O25 | O=C1OCC2OC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)c4c3C(=O)OC(C3Cc5c(O)c(O)c(O)c-4c5C(=O)O3)C2OC(=O)c2cc(O)c(O)c(O)c2-c2c1cc(O)c(O)c2O |
|
AD02767 | 0.05 | 117.15 | C5H11O2N | CC(C)C(N)C(=O)O |
|
AD02768 | 1.83 | 126.13 | C7H7OF | COc1ccc(F)cc1 |
|
AD02769 | 3.25 | 401.4 | C18H28O7NP | CCOC(=O)CCc1ccccc1OP(=O)(NC(C)C(=O)OC(C)C)OC |
|
AD02770 | 1.46 | 221.26 | C12H15O3N | O=C(NCc1ccccc1)OCC=CCO |