aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08551 | -0.65 | 212.22 | C10H8N6 | Cn1cc(C#CC#Cc2cn(C)nn2)nn1 |
|
AD08552 | 4.44 | 416.88 | C22H17O5ClS | O=C(O)CS(=O)(=O)c1ccc(OCc2cccc(-c3ccccc3Cl)c2)cc1 |
|
AD08553 | -8.69 | 1040.21 | C39H77O9N25 | N=C(N)NCCCC(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)CNC=O)C(=O)O |
|
AD08554 | -2.27 | 75.04 | C2H3O3 | O=C([O-])CO |
|
AD08555 | 0.14 | 140.14 | C6H8O2N2 | CNNC(=O)c1ccco1 |
|
AD08556 | 2.93 | 272.3 | C16H16O4 | Cc1ccc(CCC(=O)c2c(O)cc(O)cc2O)cc1 |
|
AD08557 | 3.64 | 218.68 | C14H11OCl | Oc1cccc(Cc2ccc(Cl)cc2)c1 |
|
AD08558 | 2.28 | 336.44 | C15H16O3N2S2 | CC(=O)NC(CSSc1ccc2cc(O)ccc2c1)C(N)=O |
|
AD08559 | 6.53 | 454.7 | C30H46O3 | CC1(C=O)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD08560 | 3.24 | 288.76 | C14H9N4ClS | Clc1ccccc1Cc1ccc(-c2nncs2)nn1 |