aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08111 | 3.81 | 661.83 | C36H55O10N | CCC(=O)OC1CC(=O)OC(C)CC(O)C(N(C)CCCCc2ccccc2)C=CC(OC(C)=O)C(C)CC(CC=O)C(O)C1OC |
|
AD08112 | -1.3 | 193.27 | C6H15O2N3S | CNS(=O)(=O)N1CCN(C)CC1 |
|
AD08113 | 2.76 | 693.93 | C36H63O8N5 | O=C(CN(CC(=O)NCCCCCCO)C(CCCCNC(=O)OCc1ccccc1)C(=O)NCCCCCCO)NCCCCCCO |
|
AD08114 | 3.23 | 263.51 | C12H5ON2Cl3 | NC(=O)c1c(Cl)[nH]c2cc(Cl)c(Cl)cc12 |
|
AD08115 | 2.24 | 238.09 | C9H8N3Br | Cn1cc(-c2ccccc2Br)nn1 |
|
AD08116 | 4.47 | 792.02 | C43H69O12N | CCC1C=C(C)CC(C)CC(OC)C2OC(O)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C)=CC3CCC(O)C(OC)C3)C(C)C(O)CC1=O)C(C)CC2OC |
|
AD08117 | 2.54 | 227.27 | C11H7N4S | C1=Nc2c(ncnc2Sc2ccccc2)[N]1 |
|
AD08118 | 4.87 | 312.82 | C18H13N2ClS | Clc1ccccc1Cc1ccc(Sc2ccccc2)nn1 |
|
AD08119 | 2.69 | 271.33 | C13H11ON4S | COc1ccc(SCc2ncnc3c2N=C[N]3)cc1 |
|
AD08120 | -2.25 | 135.11 | C4H3N6 | Nc1ncnc2c1=N[N]N=2 |