aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16471 | 1.42 | 192.2 | C12H6N3 | N#CC1=C(C#Cc2ccccc2)[N]C=N1 |
|
AD16472 | 7.66 | 696.97 | C42H64O8 | CC=C(C)C(=O)OC1C(OC(=O)C(C)=CC)C2(CO)C(OC(C)=O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2CC1(C)C |
|
AD16473 | -1.81 | 310.36 | C13H22O3N6 | CNC(=O)C(N)CCCCNC(=O)Cn1ccc(N)nc1=O |
|
AD16474 | 3.77 | 701.94 | C37H67O11N | CCCCCCCC(=O)OC1C(C)C(=O)C(C)CC(C)(O)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C1(C)O |
|
AD16475 | -0.5 | 149.13 | C6H5ON4 | Nc1cc2n(c(=O)n1)C=C[N]2 |
|
AD16476 | 5.57 | 651.89 | C39H57O7N | COC(=O)C1(C)CCC2(C(=O)NCc3ccc(OC)cc3)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1 |
|
AD16477 | 1.97 | 263.32 | C13H13O3NS | CNS(=O)(=O)c1cccc(-c2ccc(O)cc2)c1 |
|
AD16478 | 14.5 | 695.21 | C45H90O4 | CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCCCC)C(O)C(O)CC |
|
AD16479 | 2.27 | 428.57 | C22H40O6N2 | CCCCCCCCCCCCCCNC(=O)C1=CC(O)C(O)C(OCC(N)=O)O1 |
|
AD16480 | 2.24 | 218.33 | C12H14N2S | NCCc1nc(Cc2ccccc2)cs1 |