aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23531 | 3.95 | 699.93 | C39H61O8N3 | CCC1OC(=O)CC(O)C(C)C(O)C(CC(C(=O)NC(C)(C)C)N(CCCCN)C(=O)c2ccccc2)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD23532 | 4.42 | 658.86 | C36H55O6N4F | NC1CC(N)C(O)C(OCCCCCCCCCCCCN2CCC(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4C3CC3)CC2)C1O |
|
AD23533 | 2.84 | 466.47 | C23H24O6N5 | CCOC(=O)C1=C(C)Oc2nc(C)n(CC3=C[N]N=N3)c(=O)c2C1c1ccc(OCC)c(O)c1 |
|
AD23534 | -0.97 | 255.29 | C8H17O6NS | COC(C(=O)NS(=O)(=O)OC)C(O)C(C)C |
|
AD23535 | 2.97 | 243.7 | C14H10N3Cl | Clc1ccccc1Cc1ccc2ncnn2c1 |
|
AD23536 | -0.66 | 233.25 | C10H13ON6 | Nc1ncnc2c1C(CN1CCOCC1)=N[N]2 |
|
AD23537 | 5.65 | 516.76 | C32H52O5 | CC(=O)OC1CC2(C)C(=CCC3C4(C)CCC(O)C(C)(C)C4CCC32C)C2CC(C)(C)CC(O)C12CO |
|
AD23538 | 1.54 | 756.86 | C40H48O9N6 | COc1ccc(CC2C(=O)NC(C)C(=O)N(C)C3Cc4cccc(c4)Oc4cc(ccc4O)CC(C(=O)NC(C)C(=O)NC(C)C(=O)N2C)N(C)C3=O)cc1 |
|
AD23539 | 2.84 | 466.47 | C23H24O6N5 | CCOC(=O)C1=C(C)Oc2nc(C)n(CC3=C[N]N=N3)c(=O)c2C1c1ccc(O)c(OCC)c1 |
|
AD23540 | -0.17 | 155.16 | C6H9O2N3 | Cn1cc(CCC(=O)O)nn1 |