aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34721 | 0.11 | 245.3 | C10H15O4NS | COc1cccc(CS(=O)(=O)NCCO)c1 |
|
AD34722 | 1.17 | 219.22 | C11H10ON3F | NC(=O)c1cnn(Cc2ccc(F)cc2)c1 |
|
AD34723 | 1.05 | 217.17 | C9H9O3NF2 | COCOc1ccc(F)c(C(N)=O)c1F |
|
AD34724 | 1.42 | 219.22 | C11H10ON3F | Cc1cc(C(N)=O)n(-c2ccccc2F)n1 |
|
AD34725 | -0.01 | 232.24 | C11H12O2N4 | O=C(NCCO)c1cnn(-c2cccnc2)c1 |
|
AD34726 | -0.17 | 240.26 | C11H16O4N2 | COCCOc1cccnc1C(=O)NCCO |
|
AD34727 | 1.28 | 221.26 | C12H15O3N | CCOC(=O)CCc1cccc(C(N)=O)c1 |
|
AD34728 | -0.17 | 240.26 | C11H16O4N2 | COCCOc1ncccc1C(=O)NCCO |
|
AD34729 | 0.05 | 246.27 | C12H14O2N4 | O=C(NCCO)c1cnn(Cc2cccnc2)c1 |
|
AD34730 | -1.39 | 241.25 | C10H15O4N3 | COCCn1cc(C(=O)NCCO)cnc1=O |