aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21441 | 1.38 | 296.44 | C14H24ON4S | CSCCC(N)C(=O)NCc1cc(C2CCC2)n(C)n1 |
|
AD21442 | 1.74 | 465.54 | C21H23O2N9S | Cn1cc(CCC(=O)Nc2cccc(-c3csc(NC(=O)C(N)Cc4c[nH]cn4)n3)c2)nn1 |
|
AD21443 | 1.87 | 147.29 | C7H17NS | CSCCCCCCN |
|
AD21444 | 1.24 | 372.4 | C19H21O3N4F | CC(=O)N1CCN(c2cc3c(cc2F)c(=O)c(C(N)=O)cn3C2CC2)CC1 |
|
AD21445 | 5.45 | 763.02 | C43H70O11 | CCC(C=CC(O)C(C)C(O)C(C)C1OC(=O)C=CC=CC(C)C(C(C)C(O)C(C)C2(OC)CC(O)C(CC)C(C)O2)OC(=O)C=CC=CC1C)C(C)O |
|
AD21446 | -1.51 | 186.1 | C4H11O6P | COC(CO)(CO)P(=O)(O)O |
|
AD21447 | 2.32 | 502.56 | C26H28O4N7 | CC(C)(C)c1[nH]cnc1C=c1[nH]c(=O)c(=Cc2ccccc2)nc1OCOC(=O)CCCC1=C[N]N=N1 |
|
AD21448 | 3.06 | 279.34 | C17H17ON3 | COCc1cn(C(c2ccccc2)c2ccccc2)nn1 |
|
AD21449 | 2.41 | 265.32 | C16H15ON3 | OCc1cn(C(c2ccccc2)c2ccccc2)nn1 |
|
AD21450 | 0.02 | 135.13 | C6H5ON3 | O=c1[nH]cnn2cccc12 |