aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01991 | -2.48 | 1458.93 | C43H59O28N20P5 | Cn1c(N)nc2c(ncn2C2CC(OP(=O)(O)OCC3OC(n4cnc5c4N=CNC5N)CC3OP(=O)(O)OCC3OC(n4cnc5c(=O)[nH]c(N)nc54)CC3OP(=O)(O)OCCO)C(COP(=O)(O)OC3CC(n4cnc5c(=O)[nH]c(N)nc54)OC3COP(=O)(O)O)O2)c1=O |
|
AD01992 | 0.93 | 219.27 | C10H15N6 | NCCCCCNc1ncnc2c1N=C[N]2 |
|
AD01993 | 2.14 | 193.64 | C10H8N3Cl | Cn1cc(-c2cccc(Cl)c2)nn1 |
|
AD01994 | 0.8 | 230.22 | C8H8O5NS | COS(=O)(=O)[N-]C(=O)c1ccccc1O |
|
AD01995 | 3.65 | 1932.61 | C59H79O33N17P6S6 | COP(=O)(S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(S)OC1CC(n2ccc(N)nc2=O)OC1COP(=O)(S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(S)OC1CC(n2cnc3c(N)ncnc32)OC1COP(=O)(S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(S)OC1CC(n2ccc(N)nc2=O)OC1CO |
|
AD01996 | 4.59 | 3185.61 | C96H127O56N27P10S10 | Cc1cn(C2CC(O)C(COP(=O)(S)OC3CC(n4cnc5c(=O)[nH]c(N)nc54)OC3COP(=O)(S)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3COP(=O)(S)OC3CC(n4ccc(N)nc4=O)OC3COP(=O)(S)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3COP(=O)(S)OC3CC(n4ccc(N)nc4=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)(S)OC3CC(n4ccc(N)nc4=O)OC3COP(=O)(S)OC3CC(n4ccc(N)nc4=O)OC3COP(=O)(O)S)O2)c(=O)[nH]c1=O |
|
AD01997 | 4.97 | 430.63 | C27H42O4 | CC1CCC2(OC1)OC1CC3C4CCC5CC(O)CCC5(C)C4C(=O)CC3(C)C1C2C |
|
AD01998 | 2.51 | 250.28 | C14H12N5 | C(=Cc1ccccc1)CNc1ncnc2c1N=C[N]2 |
|
AD01999 | 1.92 | 299.36 | C15H19ON6 | CCCCCCC(=O)NC1=NN(C)c2ncnc3c2C1=C[N]3 |
|
AD02000 | 3.9 | 276.77 | C16H17ON2Cl | CCCCOc1ccc(Cc2ccccc2Cl)nn1 |