aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17371 | 2.64 | 212.33 | C13H24O2 | CC1=C(CCC(C)O)C(C)(C)CC(O)C1 |
|
AD17372 | -0.81 | 85.13 | C4H9N2 | C1CNCC[N]1 |
|
AD17373 | -2.42 | 267.31 | C7H17O4N5S | COS(=O)(=O)NC(=O)C(N)CCCNC(=N)N |
|
AD17374 | 1.99 | 268.07 | C10H6O3NBr | O=C(O)c1c[nH]c2cc(Br)ccc2c1=O |
|
AD17375 | -0.32 | 86.14 | C4H10N2 | CNC=CCN |
|
AD17376 | 2.78 | 438.54 | C21H24O2N7S | CN(C)c1cccc2c(S(=O)(=O)NCCCCNc3ncnc4c3N=C[N]4)cccc12 |
|
AD17377 | -1.74 | 688.76 | C28H44O12N6S | CC(O)C(=O)NC(C)C(=O)NC(CCC(=O)NC(CCCC(NC(=O)CCCCC1SCC2NC(=O)NC21)C(=O)O)C(=O)O)C(=O)O |
|
AD17378 | -1.2 | 644.75 | C27H44O10N6S | CC(O)C(=O)NC(C)C(=O)NC(CCC(=O)NC(CCCCNC(=O)CCCCC1SCC2NC(=O)NC21)C(=O)O)C(=O)O |
|
AD17379 | 2.91 | 150.22 | C10H14O | CCC(C)c1ccc(O)cc1 |
|
AD17380 | -0.53 | 93.07 | C3HN4 | N#CC1=N[N]C=N1 |