aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12681 | 1.05 | 183.58 | C7H4ON4Cl | COc1nc(Cl)nc2c1N=C[N]2 |
|
AD12682 | 0.01 | 151.11 | C4H3ON6 | Nc1nc(O)c2c(n1)[N]N=N2 |
|
AD12683 | 11.6 | 2802.62 | C103H155O52N12P7S6 | COP(=O)(OCCSC(=O)C(C)(C)C)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(OCCSC(=O)C(C)(C)C)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(OCCSC(=O)C(C)(C)C)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(OCCSC(=O)C(C)(C)C)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(OCCSC(=O)C(C)(C)C)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(OCCSC(=O)C(C)(C)C)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)O |
|
AD12684 | 1.73 | 272.26 | C13H11ON5F | Nc1nc(OCCc2ccccc2F)nc2c1N=C[N]2 |
|
AD12685 | 3.7 | 376.49 | C22H32O5 | C=C1CC23CCC4C(C)(C(=O)OCC(=O)O)CCCC4(C)C2CCC1(O)C3 |
|
AD12686 | 4.37 | 726.86 | C38H42O7N6S | CCC1(OC(=O)C(NC(=O)C(CCCCN)N=C(S)Nc2ccc(O)cc2)C(C)C)C(=O)OCc2c1cc1n(c2=O)Cc2cc3ccccc3nc2-1 |
|
AD12687 | 2.18 | 267.32 | C14H15N6 | CC(CNc1nc(N)c2c(n1)[N]C=N2)c1ccccc1 |
|
AD12688 | 1.9 | 268.3 | C14H14ON5 | Cc1ccc(CCOc2nc(N)c3c(n2)[N]C=N3)cc1 |
|
AD12689 | 2.1 | 502.48 | C27H22O8N2 | CC(=NNC(=O)c1ccccc1)C1(O)Cc2c(O)c3c(c(O)c2C(O)C1)C(=O)c1c(O)cccc1C3=O |
|
AD12690 | 7.94 | 536.78 | C33H50O3N3 | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(OCC6=C[N]N=N6)C(C)(C)C5CCC43C)C12 |