aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19781 | -2.84 | 389.48 | C14H27O4N7S | CNC(=O)CCC(=O)NC(CCCNC(=N)N)C(=O)NC(CS)C(N)=O |
|
AD19782 | -0.48 | 170.1 | C4H11O5P | COC(C)(CO)P(=O)(O)O |
|
AD19783 | -4.02 | 306.36 | C12H26O5N4 | NCCOC1C(NC(=O)C(O)CCN)CC(N)C(O)C1O |
|
AD19784 | 4.15 | 200.31 | C13H12S | Cc1ccc(Sc2ccccc2)cc1 |
|
AD19785 | 8.83 | 1379.19 | C74H57O18N7Cl2 | CN(Cc1ccc(-c2ccccc2)cc1)C1C(=O)NC2Cc3ccc(cc3)Oc3cc4cc(c3O)Oc3ccc(cc3Cl)C(O)C3NC(=O)C(NC(=O)C4NC(=O)C(NC2=O)c2cc(cc(O)c2Cl)Oc2cc1ccc2O)c1ccc(O)c(c1)-c1c(O)cc(O)cc1C(C(=O)O)NC3=O |
|
AD19786 | 3.14 | 315.31 | C14H22O5NP | CCOP(=O)(NC(C)C(=O)OC(C)C)Oc1ccccc1 |
|
AD19787 | 0.5 | 246.28 | C9H8N7S | Cn1cc(SC2=N[N]c3ncnc(N)c32)cn1 |
|
AD19788 | 9.1 | 1418.22 | C76H58O18N8Cl2 | CN(Cc1cn(-c2ccccc2)c2ccccc12)C1C(=O)NC2Cc3ccc(cc3)Oc3cc4cc(c3O)Oc3ccc(cc3Cl)C(O)C3NC(=O)C(NC(=O)C4NC(=O)C(NC2=O)c2cc(cc(O)c2Cl)Oc2cc1ccc2O)c1ccc(O)c(c1)-c1c(O)cc(O)cc1C(C(=O)O)NC3=O |
|
AD19789 | 2.42 | 218.17 | C10H9O2F3 | COC(=O)Cc1ccccc1C(F)(F)F |
|
AD19790 | 0.8 | 324.3 | C14H12O2N8 | O=C(NCC1=C[N]N=N1)c1ccc(C(=O)NCC2=C[N]N=N2)cc1 |