aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03431 | 1.28 | 194.19 | C10H10O4 | COC(=O)C=Cc1ccc(O)c(O)c1 |
|
AD03432 | 1.75 | 436.9 | C21H25O5N4Cl | O=C(O)CNCCCNCCNc1cc2c(=O)c(C(=O)O)cn(C3CC3)c2cc1Cl |
|
AD03433 | 1.29 | 88.15 | C5H12O | COCC(C)C |
|
AD03434 | 1.98 | 1252.69 | C61H66O19N9Cl | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(OC3CC(C)(N)C(O)C(C)O3)c3ccc(cc3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD03435 | 1.86 | 341.32 | C18H15O6N | O=C(O)C1Cc2cc(O)c(O)cc2N1C(=O)C=Cc1ccc(O)cc1 |
|
AD03436 | 3.88 | 640.75 | C29H35O5N4F3S2 | CNC(=O)CCCCCOc1ccc2nc(C3(NC(=O)CC(N)Cc4cc(F)c(F)cc4F)CCS(=O)(=O)CC3)sc2c1 |
|
AD03437 | 3.66 | 322.39 | C18H20ON5 | CCCCOc1ccc2c(c1)CCC2Nc1ncnc2c1N=C[N]2 |
|
AD03438 | -1.17 | 181.21 | C5H11O4NS | CS(=O)(=O)CCC(N)C(=O)O |
|
AD03439 | -0.87 | 331.37 | C14H25O6N3 | O=C(NCCNCCNC(=O)OCC=CCO)OCC=CCO |
|
AD03440 | 6.6 | 978.28 | C56H86O10N2P | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(C(=O)CCCCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)C(C)C(O)C1(C)O |