aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD02121 | 8.05 | 642.93 | C40H58O3N4 | COc1ccccc1-n1cc(CNC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C2(C)CC3)nn1 |
|
AD02122 | 2.3 | 135.19 | C7H5NS | c1ccc2scnc2c1 |
|
AD02123 | 4.36 | 294.35 | C19H18O3 | CC(C)Cc1ccc(-c2oc3ccccc3c(=O)c2O)cc1 |
|
AD02124 | 1.96 | 330.34 | C18H18O6 | COc1ccc(CC2(O)COc3cc(OC)cc(O)c3C2=O)cc1 |
|
AD02125 | 2.71 | 223.7 | C13H14ONCl | NC(=O)CC(c1ccc(Cl)cc1)C1CC1 |
|
AD02126 | 3.6 | 412.47 | C20H20O4N4S | CSc1nc2c(c(=O)[nH]1)C(c1ccc([N+](=O)[O-])cc1)C1=C(CC(C)(C)CC1=O)N2 |
|
AD02127 | 3.3 | 293.14 | C14H8N5Cl2 | Clc1cc(Cl)cc(CNc2ncnc3c2N=C[N]3)c1 |
|
AD02128 | 3.17 | 832.09 | C44H73O10N5 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2OCCCNC(=O)CNc2ccnc3ccccc23)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O |
|
AD02129 | 3.72 | 450.66 | C27H46O5 | CC(CO)CCC1(O)OC2CC3C4CC(O)C5CC(O)CCC5(C)C4CCC3(C)C2C1C |
|
AD02130 | 6.17 | 656.95 | C42H60O4N2 | CC12CC(O)C3C(CCC4Cc5nc6c(nc5CC43C)CC3CCC4C5CCC(=CCO)C5(C)CC(O)C4C3(C)C6)C1CCC2=CCO |