aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10461 | 4.5 | 290.33 | C16H8ON3S | c1ccc2oc(-c3ncnc4c3-c3sccc3[N]4)cc2c1 |
|
AD10462 | 5.29 | 472.71 | C30H48O4 | CC1(C)CC(O)C2(CO)C(=O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD10463 | 1.03 | 324.36 | C17H18O2N5 | O=C(CNc1ncnc2c1C(c1ccccc1)=C[N]2)NCCCO |
|
AD10464 | 4.08 | 646.86 | C37H58O9 | CC=C(C)C(=O)OC1C(OC(C)=O)C2(CO)C(CC1(C)C)C1=CCC3C4(C)CCC(O)C(C)(CO)C4CCC3(C)C1(C)C(O)C2O |
|
AD10465 | 2.55 | 405.45 | C21H27O7N | CCCn1cc(C(=O)O)c(=O)c2cc(CCCOCCOCCC(=O)O)ccc21 |
|
AD10466 | -0.44 | 111.08 | C4H3O2N2 | O=C(O)C1=C[N]N=C1 |
|
AD10467 | 1.51 | 359.38 | C18H21O5N3 | O=C(O)CCNCCNc1ccc2c(=O)c(C(=O)O)cn(C3CC3)c2c1 |
|
AD10468 | 1.41 | 301.22 | C12H10O3N3F3 | O=C(O)C(O)Cn1cc(-c2cccc(C(F)(F)F)c2)nn1 |
|
AD10469 | 5.12 | 361.53 | C22H35O3N | CC(=CCCC1=CCN(CC(=O)O)C1=O)CCC=C(C)CCCC(C)C |
|
AD10470 | 1.11 | 336.35 | C12H21O5N2PS | COP(=O)(O)CC(=O)CCCCC1SCC2NC(=O)NC21 |