aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31611 | 0.44 | 191.19 | C9H9O2N3 | COc1ccc2nc(C(N)=O)cn2c1 |
|
AD31612 | 0.44 | 191.19 | C9H9O2N3 | COc1ccc2c(C(N)=O)cnn2c1 |
|
AD31613 | -1.46 | 211.22 | C9H13O3N3 | Nc1cccn(CC(=O)NCCO)c1=O |
|
AD31614 | 0.14 | 209.24 | C11H15O3N | Cc1ccccc1C(O)C(=O)NCCO |
|
AD31615 | -1.84 | 210.25 | C6H14O4N2S | NS(=O)(=O)CCCC(=O)NCCO |
|
AD31616 | -0.35 | 216.28 | C10H20O3N2 | CC(=O)NC(CC(C)C)C(=O)NCCO |
|
AD31617 | 1.77 | 177.25 | C11H15ON | COc1ccccc1C1CCNC1 |
|
AD31618 | 1.13 | 181.24 | C9H15ON3 | Cc1cnn(C2CCOCC2)c1N |
|
AD31619 | 0.43 | 201.61 | C8H8O2N3Cl | COC(=O)Cc1c(N)ncnc1Cl |
|
AD31620 | 1.45 | 193.58 | C7H6N3F2Cl | Cc1nc(Cl)cc(C(N)(F)F)n1 |