aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01311 | 0.54 | 205.25 | C9H13N6 | NCCCCNc1ncnc2c1N=C[N]2 |
|
AD01312 | 3.78 | 314.37 | C19H16N5 | C1=Nc2c(ncnc2NC(Cc2ccccc2)c2ccccc2)[N]1 |
|
AD01313 | 2.06 | 230.28 | C10H8N5S | C1=Nc2c(ncnc2NCc2ccsc2)[N]1 |
|
AD01314 | -0.65 | 407.42 | C19H25O7N3 | COc1ccc(CNCC(O)C2CC(O)C(n3ccc(=O)[nH]c3=O)O2)cc1OC |
|
AD01315 | 3.52 | 550.71 | C29H42O8S | CCC1OC(=O)CC(O)C(C)C(O)C(CCOS(=O)c2ccccc2)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD01316 | 1.12 | 135.12 | C7H5O2N | O=c1[nH]ccc2ccoc12 |
|
AD01317 | -0.79 | 150.12 | C5H4ON5 | Nc1c2c(nc[n+]1[O-])[N]C=N2 |
|
AD01318 | -2.38 | 357.36 | C15H23O7N3 | CC1CCCC(NC(=O)C2=CC(O)C(O)C(OCC(N)=O)O2)C(=O)N1 |
|
AD01319 | 3.29 | 226.28 | C15H14O2 | O=C(O)CC(c1ccccc1)c1ccccc1 |
|
AD01320 | 8.34 | 824.27 | C45H85O6N5S | CCCCCCCCCCCCCCCC(O)C(CO)NC(=O)CCCCCCCCCCNC(=O)CCCCCNC(=O)CCCCC1SCC2NC(=O)NC21 |