aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04041 | 0.82 | 604.45 | C20H30O10N8P2 | COP(=O)(O)OC1CC(n2cnc3c(N)ncnc32)OC1COP(=O)(O)OCCCNC(=O)CCc1c[nH]cn1 |
|
AD04042 | 3.83 | 306.28 | C16H9ON5F | Fc1ccc(-c2nc(C3=C[N]N=N3)oc2-c2ccncc2)cc1 |
|
AD04043 | 4.29 | 302.46 | C20H30O2 | C=CC1(C)CCC2C(=CCC3C(C)(CO)C(=O)CCC23C)C1 |
|
AD04044 | 3.27 | 212.25 | C14H12O2 | Oc1cc(O)cc(C=Cc2ccccc2)c1 |
|
AD04045 | 3.01 | 270.28 | C16H14O4 | COc1ccc2c(c1)OC1c3ccc(O)cc3OCC21 |
|
AD04046 | -1.81 | 476.52 | C20H30O5N9 | CC(O)C(=O)NC(C(=O)NC(CCC(=O)NCCNc1ncnc2c1N=C[N]2)C(N)=O)C(C)C |
|
AD04047 | 2.83 | 176.24 | C10H8OS | Oc1cccc2cccc(S)c12 |
|
AD04048 | -2.94 | 190.2 | C7H14O4N2 | CNC1=NC(CO)C(O)C(O)C1O |
|
AD04049 | 5.11 | 1295.11 | C66H57O17N9Cl2 | NC1C(=O)NC2Cc3ccc(c(Cl)c3)Oc3cc4cc(c3O)Oc3ccc(cc3Cl)C(O)C3NC(=O)C(NC(=O)C4NC(=O)C(NC2=O)c2cc(O)cc(c2)Oc2cc1ccc2O)c1ccc(O)c(c1)-c1c(O)cc(O)cc1C(C(=O)NCCN1CCCC1)NC3=O |
|
AD04050 | 4.94 | 484.68 | C30H44O5 | CC(CC(=O)C1OC1(C)C)C1C(=O)CC2(C)C3=CCC4C(O)(CCC(O)C4(C)C)CC3=CCC12C |