aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23201 | 5.22 | 452.6 | C27H36O4N2 | CCOc1cc(CC(=O)NC(CC(C)C)c2ccccc2N2CCCCC2)ccc1C(=O)O |
|
AD23202 | 3.56 | 281.76 | C14H12O2NClS | CCOC(=O)c1cnc(Cc2ccccc2Cl)s1 |
|
AD23203 | 0.59 | 131.18 | C6H13O2N | CCCCC(N)C(=O)O |
|
AD23204 | 0.45 | 155.2 | C8H13O2N | C#CC(C)CCC(N)C(=O)O |
|
AD23205 | 1.1 | 292.31 | C15H17O3N2F | CC(C#Cc1ccc(F)c(C(N)=O)c1)CCC(N)C(=O)O |
|
AD23206 | 5.12 | 291.83 | C15H10NClS2 | Clc1ccccc1Cc1ncc(-c2cccs2)s1 |
|
AD23207 | 4.28 | 1285.03 | C63H51O19N9Cl2 | NC1C(=O)NC2Cc3ccc(c(Cl)c3)Oc3cc4cc(c3O)Oc3ccc(cc3Cl)C(O)C3NC(=O)C(NC(=O)C4NC(=O)C(NC2=O)c2cc(O)cc(c2)Oc2cc1ccc2O)c1ccc(O)c(c1)-c1c(O)cc(O)cc1C(C(=O)NCCNC(=O)O)NC3=O |
|
AD23208 | 1.21 | 201.13 | C7H4N4F3 | Nc1ncnc2c1C(C(F)(F)F)=C[N]2 |
|
AD23209 | 7.67 | 444.74 | C30H52O2 | CC(CCCC(C)(C)O)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(O)C(C)(C)C1CC3 |
|
AD23210 | 0.64 | 157.21 | C8H15O2N | COCC1CCCN1C(C)=O |