aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17271 | 4.33 | 411.37 | C20H14ON6F3 | O=C(Cc1ccc(Nc2ncnc3c2N=C[N]3)cc1)Nc1ccc(C(F)(F)F)cc1 |
|
AD17272 | 3.03 | 152.26 | C9H12S | CSc1c(C)cccc1C |
|
AD17273 | 3.05 | 321.24 | C13H8ON6F3 | O=C(Nc1ccc(C(F)(F)F)cc1)Nc1ncnc2c1N=C[N]2 |
|
AD17274 | 9.72 | 604.87 | C39H56O5 | CCC=CCC=CCC=CCC=CCC=CCC(=O)OCC(CO)OC(=O)CC=CCC=CCC=CCC=CCC=CCC |
|
AD17275 | 3.89 | 306.32 | C19H14O4 | COc1cc2c3c(ccc(-c4ccccc4)c3c1O)C(=O)OC2 |
|
AD17276 | 3.44 | 320.2 | C12H8N4SBr | Brc1ccccc1CSc1ncnc2c1N=C[N]2 |
|
AD17277 | 4.12 | 324.77 | C19H13O2N2Cl | Clc1ccccc1Cc1ccc(-c2ccc3c(c2)OCO3)nn1 |
|
AD17278 | -0.99 | 153.16 | C3H7O4NS | COS(=O)(=O)NC(C)=O |
|
AD17279 | 1.19 | 239.23 | C7H14O4NPS | COP(=S)(OCCC#N)OCCCO |
|
AD17280 | 1.59 | 224.3 | C13H20O3 | CC(=O)C=C=C1C(C)(C)CC(O)CC1(C)O |