aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15731 | 1.95 | 207.28 | C9H11N4S | CCCCSc1ncnc2c1C=N[N]2 |
|
AD15732 | 1.94 | 736.03 | C36H69O10N3S | CCNC(=S)NCCOC1C(C)CC(C)(O)C(OC2OC(C)CC(N(C)C(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C1C |
|
AD15733 | 2.35 | 298.29 | C17H14O5 | O=C1C=C(c2ccc(O)cc2O)OC1Cc1ccc(O)cc1 |
|
AD15734 | 1.28 | 194.19 | C10H10O4 | COC(=O)C=Cc1cc(O)cc(O)c1 |
|
AD15735 | -2.17 | 181.08 | C4H8O5NP | COP(=O)([O-])NCCC(=O)[O-] |
|
AD15736 | 1.89 | 120.15 | C8H8O | CC(=O)c1ccccc1 |
|
AD15737 | 0.83 | 311.33 | C14H15ON8 | Nc1nc(-n2cc(C(=O)NC3CCCC3)cn2)nc2c1N=C[N]2 |
|
AD15738 | 1.66 | 218.3 | C13H18ON2 | CN(C=O)Cc1ccc2c(c1)CCCN2C |
|
AD15739 | 4.93 | 529.51 | C30H19O5N5 | O=C1c2c(c3c4ccc(O)cc4n(O)c3c3[nH]c4cc(O)ccc4c23)C(=O)N1NCc1cnc2ccccc2c1 |
|
AD15740 | 4.29 | 523.46 | C27H17O7N5 | O=C1c2c(c3c4ccc(O)cc4n(O)c3c3[nH]c4cc(O)ccc4c23)C(=O)N1NCc1ccc([N+](=O)[O-])cc1 |