aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10941 | 2.98 | 220.36 | C13H18NS | C[S+](C)CCCc1c[nH]c2ccccc12 |
|
AD10942 | 1.44 | 162.15 | C8H6O2N2 | Oc1ccc(-c2ncon2)cc1 |
|
AD10943 | -2.73 | 470.58 | C19H38O4N10 | N=C(N)NCCCC(NC(=O)C(CCCNC(=N)N)NC(=O)CCCCCNC=O)C(N)=O |
|
AD10944 | 2.52 | 438.52 | C23H34O8 | O=C(O)C(CCCCOC1CCOC(COCCCCc2ccccc2)C1O)C(=O)O |
|
AD10945 | 2.51 | 548.72 | C30H48O7N2 | CCC(=O)OC1CC(=O)NCCCN(CCCCc2ccccc2)CC(O)C(C)CC(CC=O)C(O)C1OC |
|
AD10946 | 2.62 | 371.46 | C19H21O3N3S | CSC(Cc1ccc(OCc2nc3ccc(O)cc3n2C)cc1)C(N)=O |
|
AD10947 | 0.14 | 250.3 | C13H18O3N2 | CC(=O)N(CC(=O)NCCO)Cc1ccccc1 |
|
AD10948 | 2.32 | 584.64 | C25H27O5N4F3S2 | CNC(=O)COc1ccc2nc(C3(NC(=O)CC(N)Cc4cc(F)c(F)cc4F)CCS(=O)(=O)CC3)sc2c1 |
|
AD10949 | 2.42 | 154.23 | C8H10OS | COc1ccc(SC)cc1 |
|
AD10950 | 2.32 | 560.75 | C28H48O9S | CC(C)C(C=CC(C)C1CC(O)C2C1(C)CCC1C3(C)CCC(O)C(O)C3C(OS(=O)(=O)O)CC12O)CO |