aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31581 | 1.04 | 195.25 | C8H9ON3S | Cc1nn(C)c2sc(C(N)=O)cc12 |
|
AD31582 | 1.47 | 190.18 | C10H7ON2F | NC(=O)c1ccc2cc(F)ccc2n1 |
|
AD31583 | 0.4 | 195.22 | C9H13O2N3 | CC1(C)COc2c(C(N)=O)cnn2C1 |
|
AD31584 | 0.37 | 190.2 | C10H10O2N2 | CN1Cc2cccc(C(N)=O)c2C1=O |
|
AD31585 | 0.06 | 205.22 | C10H11O2N3 | O=C(NCCO)c1cc2cccnn2c1 |
|
AD31586 | 0.23 | 197.26 | C8H11ON3S | CN1CCc2nc(C(N)=O)sc2C1 |
|
AD31587 | 0.88 | 193.18 | C9H8ON3F | Cc1nc2ccc(F)cn2c1C(N)=O |
|
AD31588 | 0.06 | 205.22 | C10H11O2N3 | O=C(NCCO)c1cccc2nccn12 |
|
AD31589 | 0.48 | 196.6 | C8H5ON4Cl | NC(=O)c1cnn2ccc(Cl)nc12 |
|
AD31590 | -0.37 | 209.25 | C10H15O2N3 | Cn1nc2c(c1C(=O)NCCO)CCC2 |