aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04441 | -0.97 | 198.19 | C5H4O2N5S | NS(=O)(=O)c1ncnc2c1N=C[N]2 |
|
AD04442 | 8.42 | 638.93 | C40H62O6 | C=CC(C)(O)CCC=C(C)C(=O)OC1CC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2CC1(C)C |
|
AD04443 | -4.61 | 925.96 | C43H51O11N13 | CC(c1ccccc1)C1NC(=O)CNC(=O)C(CO)NC(=O)C(C(O)C2CN=C(N)N2)NC(=O)C(C(O)C2CN=C(N)N2)NC(=O)C(Cc2ccc3nc(-c4ccccc4O)oc3c2)NC1=O |
|
AD04444 | 1.01 | 168.15 | C8H8O4 | CC(=O)c1cc(O)c(O)c(O)c1 |
|
AD04445 | 3.44 | 250.75 | C13H11N2ClS | CSc1cnc(Cc2ccccc2Cl)nc1 |
|
AD04446 | 1.68 | 245.31 | C12H17N6 | CCNC1=Nc2c(ncnc2NC2CCCC2)[N]1 |
|
AD04447 | 0.75 | 151.1 | C4H10O3NP | COP1(=O)NCCCO1 |
|
AD04448 | -1.31 | 160.1 | C5H5O3N2F | O=c1[nH]c(CO)c(F)c(=O)[nH]1 |
|
AD04449 | -0.63 | 118.12 | C6H4N3 | c1ccc2c(c1)=N[N]N=2 |
|
AD04450 | -1.28 | 157.22 | C7H15ON3 | CN1CCN(CC(N)=O)CC1 |