aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19381 | 2.34 | 197.24 | C13H11ON | NC(=O)C=Cc1ccc2ccccc2c1 |
|
AD19382 | 2.28 | 287.73 | C14H12N6Cl | Nc1nc(NCCc2cccc(Cl)c2)nc2c1N=C[N]2 |
|
AD19383 | 1.64 | 313.34 | C15H17O2N6 | COc1ccc(CCNc2nc(N)c3c(n2)[N]C=N3)cc1OC |
|
AD19384 | 2.35 | 286.69 | C16H9O3NCl | O=C([O-])c1ccc2c(ccn2-c2ccc(O)c(Cl)c2)c1 |
|
AD19385 | 2.5 | 1307.1 | C40H54O22N12P4S4 | COP(=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 |
|
AD19386 | 2.64 | 697.42 | C24H32O13N2P2Cl2S | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(CC(=O)c1ccc(Cl)cc1Cl)C(=O)O |
|
AD19387 | 2.6 | 293.35 | C16H17N6 | C1=Nc2c(nc(N3CCCC3)nc2NCc2ccccc2)[N]1 |
|
AD19388 | 3.03 | 290.71 | C14H10N5FCl | CC(Nc1nc(Cl)nc2c1C=N[N]2)c1cccc(F)c1 |
|
AD19389 | 1.55 | 396.58 | C21H40O3N4 | CCC(C)C(C=CC(=O)NC)N(C)C(=O)C(NC(=O)C(NC)C(C)C)C(C)C |
|
AD19390 | 2.7 | 893.07 | C44H76O18 | CCCCCC1CCCCCCCCCC(=O)OC2C(O)C(C)OC(OC3C(OC(COC(=O)C(C)C(C)O)C(O)C3O)OC3C(O1)OC(C)C(O)C3O)C2OC(=O)CC(C)C |