aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13041 | 0.5 | 115.13 | C5H9O2N | COC(=O)NC1CC1 |
|
AD13042 | 2.19 | 284.27 | C16H12O5 | COc1c(O)c(C)cc2c1C(=O)c1c(O)cccc1C2=O |
|
AD13043 | 4.35 | 381.46 | C23H21N6 | Cc1ccc(Cn2cc(CCNc3ncnc4c3N=C[N]4)c3ccccc32)cc1 |
|
AD13044 | 0.25 | 202.2 | C9H8ON5 | Cc1cn2c(=O)c3c(n(C)c2n1)[N]C=N3 |
|
AD13045 | -0.6 | 177.16 | C8H7O2N3 | Nn1c(=O)[nH]c2ccccc2c1=O |
|
AD13046 | 1.62 | 543.7 | C28H49O9N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(NC)C2O)C2(C)CC(C)=C(O2)C(C)C(O)C1(C)O |
|
AD13047 | 2.36 | 287.32 | C13H11O2N4S | COc1ccc(CSC2=Nc3c(O)ncnc3[N]2)cc1 |
|
AD13048 | 3.45 | 237.07 | C12H4N3Cl2 | Clc1cc2cc3c(nc2cc1Cl)N=C[N]3 |
|
AD13049 | 2.62 | 785.11 | C36H60O7N6S3 | O=C(CCS)NCCCCC(NC(=O)CCS)C(=O)NC(CCCCNC(=O)CCS)C(=O)NCCCCCCNC(=O)CCc1ccc(O)cc1 |
|
AD13050 | 1.21 | 305.27 | C11H20O5N3P | CNc1nc(O)nc(O)c1CCCCCCP(=O)(O)O |