aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10421 | 1.63 | 283.31 | C14H15ON6 | COc1ccccc1CCNc1nc(N)c2c(n1)[N]C=N2 |
|
AD10422 | 3.71 | 318.42 | C15H14O2N2S2 | Cc1nc(NS(=O)(=O)c2ccc3ccccc3c2)sc1C |
|
AD10423 | 4.22 | 574.76 | C33H50O8 | CC1=CCC2CC(CC3(CCC(C)C(C(C)C)O3)O2)OC(=O)C2CC(C)C(O)C3OCC(=CC=CC(C)C1O)C23O |
|
AD10424 | 5.13 | 509.73 | C28H45O6S | C=C(CCC(C)(O)C1CCC2C3CC(O)C4CC(OS(=O)(=O)[O-])CCC4(C)C3=CCC21C)C(C)C |
|
AD10425 | -1.33 | 1729.4 | C51H70O33N10P6S6 | COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(O)=S |
|
AD10426 | -1.75 | 1395.11 | C40H55O27N8P5S5 | Cc1cn(C2CC(OP(O)(O)=S)C(COP(O)(=S)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3COP(O)(=S)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3COP(O)(=S)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3COP(O)(O)=S)O2)c(=O)[nH]c1=O |
|
AD10427 | 4.41 | 411.31 | C21H9O2N3F4 | Cn1c2cc(F)c(F)cc2c2c3c(c4c5cc(F)c(F)cc5[nH]c4c21)C(=O)NC3=O |
|
AD10428 | 4.08 | 304.47 | C20H32O2 | C=CC1(C)CCC2C(=CCC3C(C)(CO)C(O)CCC23C)C1 |
|
AD10429 | 0.12 | 220.26 | C9H14N7 | NCCCCNc1nc(N)nc2c1N=C[N]2 |
|
AD10430 | -0.33 | 205.2 | C8H9ON6 | NC(=O)CCNc1ncnc2c1N=C[N]2 |