aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17561 | 2.66 | 191.27 | C12H17ON | CCC(=O)NC(CC)c1ccccc1 |
|
AD17562 | 3.77 | 311.2 | C12H11ON2SBr | Cc1nc(NC(=O)c2ccc(Br)cc2)sc1C |
|
AD17563 | 4.74 | 514.41 | C27H25O3N5Cl2 | CN1CCCN(c2ccc(C(=O)Nc3c(O)cc(Cl)cc3C(=O)Nc3ccc(Cl)cn3)cc2)CC1 |
|
AD17564 | 2.71 | 224.64 | C12H9O3Cl | CCc1cc(=O)oc2cc(O)c(Cl)cc12 |
|
AD17565 | -0.61 | 286.38 | C13H26O3N4 | NCCCCC(NC(=O)CCCCCNC=O)C(N)=O |
|
AD17566 | 4.05 | 795.46 | C42H67O9N4Cl | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNc2ccnc3cc(Cl)ccc23)C(C)C(O)C1(C)O |
|
AD17567 | 3.37 | 368.39 | C21H20O6 | COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O |
|
AD17568 | 4.44 | 492.74 | C30H52O5 | CC(=CCCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC12C)CO |
|
AD17569 | 2.92 | 721.89 | C37H59O11N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC3C2OC(=Nc2ccc(OC)cc2)N3C)C(C)(OC)CC(C)C(=O)NC(C)C(O)C1(C)O |
|
AD17570 | 8.49 | 681.84 | C44H39ON7 | Nc1ccc(C2c3ccc([nH]3)C(c3ccc(N)cc3)c3ccc([nH]3)C(c3ccccc3O)c3ccc([nH]3)C(c3ccc(N)cc3)c3ccc2[nH]3)cc1 |