aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12341 | 3.2 | 248.29 | C12H16O2N4 | [N-]=[N+]=NCCCCCC(=O)Nc1ccc(O)cc1 |
|
AD12342 | 2.35 | 390.43 | C21H26O7 | CCCCOC12CC3(C)OC(O1)C1(COC(=O)c4ccc(O)cc4)C2CC31O |
|
AD12343 | 3.27 | 278.34 | C16H16N5 | C1=Nc2c(ncnc2NC2CCCCc3ccccc32)[N]1 |
|
AD12344 | 1.82 | 271.32 | C15H17O2N3 | CNCc1ccc(OCC(=O)Nc2ccccn2)cc1 |
|
AD12345 | 3.6 | 548.76 | C32H52O7 | CC(=O)OC1C(O)C(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CC(O)C21CO |
|
AD12346 | 0.78 | 255.28 | C13H13ON5 | Cc1ccccc1C[N+]1=C[N]c2nc(N)[nH]c(=O)c21 |
|
AD12347 | -7.07 | 857.97 | C35H63O12N13 | COCCNC(=O)CCC(NC(=O)C(CO)NC(=O)C1CCCN1C(=O)C(NC(=O)C(N)CCCNC(=N)N)C(C)C)C(=O)NC(CCC(N)=O)C(=O)NC(CO)C(N)=O |
|
AD12348 | -0.58 | 179.18 | C7H9ON5 | Nc1ncnc(N)c1C1=NCCO1 |
|
AD12349 | 2.29 | 242.31 | C13H16N5 | CCCCCCC#Cc1nc(N)c2c(n1)[N]C=N2 |
|
AD12350 | 2.74 | 230.31 | C15H18O2 | C=C(C)C1CCc2cc(O)c(=O)cc(C)c2C1 |