aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD44351 | 1.97 | 327.34 | C18H17O5N | O=C(NC(CO)C(=O)O)OCC1c2ccccc2-c2ccccc21 |
|
AD44352 | 1.78 | 262.05 | C7H7ON2I | NC(=O)Nc1ccccc1I |
|
AD44353 | 2.16 | 181.26 | C9H11ONS | COCN1CSc2ccccc21 |
|
AD44354 | 1.75 | 176.17 | C9H8O2N2 | Cc1noc(-c2ccccc2O)n1 |
|
AD44355 | 1.58 | 275.23 | C12H12O3NF3 | COC(=O)C(O)(c1ccc2c(c1)CCN2)C(F)(F)F |
|
AD44356 | 2.24 | 187.2 | C11H9O2N | Cc1cc(C(=O)O)c2ccccc2n1 |
|
AD44357 | 1.67 | 203.28 | C10H21O3N | CC(C)(C)OC(=O)NCCCCCO |
|
AD44358 | 1.92 | 193.25 | C11H15O2N | CCCCNC(=O)c1ccccc1O |
|
AD44359 | 2.1 | 231.12 | C7H7N2SBr | NC(=S)Nc1ccccc1Br |
|
AD44360 | 1.87 | 182.2 | C8H6O3S | Cc1c(O)ccc2oc(=O)sc12 |