aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13791 | 3.45 | 340.51 | C19H36O3N2 | CCCCCCCCCCCCC(=O)OC1CCC(N)C(=O)NC1 |
|
AD13792 | 1.0 | 122.17 | C7H10N2 | CN(N)c1ccccc1 |
|
AD13793 | 0.19 | 150.12 | C5H4ON5 | ONc1ncnc2c1N=C[N]2 |
|
AD13794 | 1.38 | 141.19 | C6H7ONS | Cc1ccc(O)c(S)n1 |
|
AD13795 | 3.28 | 680.88 | C37H60O11 | COCC(O)CC1OC(O)(C2OC(=O)C(C)=CC(C)=CC(C)=CC(C)C(O)C=CC(C)=CCCC(O)C(OC)CC2O)C(C)C(O)C1C |
|
AD13796 | -0.68 | 258.0 | CH9O9P3 | CP(=O)(O)OP(=O)(O)O[PH](O)(O)O |
|
AD13797 | 9.12 | 474.84 | C31H54OS | CC(C)CCCC(C)C1CCC2C3CC=C4CC(OCCCCS)CCC4(C)C3CCC12C |
|
AD13798 | -5.59 | 931.02 | C44H58O11N12 | CC(c1ccccc1)C1NC(=O)CNC(=O)C(COC(=O)Cc2ccccc2)NC(=O)C(C(O)C2CNC(N)N2)NC(=O)C(C(O)C2CNC(N)N2)NC(=O)C(Cc2ccc(O)cc2)NC1=O |
|
AD13799 | -1.8 | 558.68 | C24H46O7N8 | CC(C)CC(NCC(NC(=O)NC(C(=O)O)C(C)C)C1CCNC(=N)N1)C(=O)NCCCNC(CO)C(=O)O |
|
AD13800 | -0.71 | 382.4 | C15H18O6N4S | O=CN1CCN(CCOc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)CC1 |