aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13321 | 3.42 | 735.96 | C39H65O10N3 | C=COC1(C)CC(C)CN(C(=O)NCc2ccccc2)C(C)C(O)C(C)(O)C(CC)OC(=O)C(C)C(O)C(C)C1OC1OC(C)CC(N(C)C)C1O |
|
AD13322 | 1.76 | 618.85 | C32H62O9N2 | CCCN1CC(C)CC(C)(O)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C1C |
|
AD13323 | -0.69 | 255.06 | C7H5ON5Br | NC(=O)C1=C(Br)N=C2[N]C=NC(N)=C21 |
|
AD13324 | -0.6 | 213.19 | C8H11O4N3 | O=C(O)CCCON=c1cc[nH]c(=O)[nH]1 |
|
AD13325 | 7.17 | 598.87 | C37H58O6 | CC=C(C)C(=O)OC1CC(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC(OC(C)=O)C12CO |
|
AD13326 | 4.38 | 344.79 | C20H11N5Cl | N#Cc1ccc(Nc2ncnc3c2C(c2ccc(Cl)cc2)=C[N]3)cc1 |
|
AD13327 | -0.14 | 255.06 | C7H5ON5Br | NC(=O)C1=C(Br)[N]c2ncnc(N)c21 |
|
AD13328 | 3.25 | 357.33 | C20H11O4N3 | O=C1NC(=O)c2c1c1c3ccc(O)cc3[nH]c1c1[nH]c3cc(O)ccc3c21 |
|
AD13329 | 4.35 | 410.52 | C12H7ON2ClSBr2 | NC(=O)c1sc(-c2ccc(Cl)cc2)nc1C(Br)Br |
|
AD13330 | 0.79 | 199.2 | C9H7N6 | Cn1nccc1-c1ncnc2c1N=C[N]2 |