aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22021 | 5.64 | 572.78 | C34H52O7 | CC(=O)OC(CC(C)C1C(=O)C(OC(C)=O)C2(C)C3CCC4C(C)(C)C(O)CCC45CC35CCC12C)C1OC1(C)C |
|
AD22022 | 6.32 | 358.27 | C20H11N2Cl2S | Clc1cc2cc3c(cc2cc1Cl)N=C(SCc1ccccc1)[N]3 |
|
AD22023 | 4.76 | 320.21 | C14H10ONSBr | Brc1ccccc1Cc1ncc(-c2ccco2)s1 |
|
AD22024 | 4.25 | 342.43 | C21H20N5 | Cc1cccc(C)c1C(CNc1ncnc2c1N=C[N]2)c1ccccc1 |
|
AD22025 | -3.55 | 618.71 | C25H42O10N6S | COC(COS(=O)(=O)[O-])C(=O)NC(C(=O)N1C(C(=O)NCCC2=CC[N+](=C(N)N)C2)CC2CC(O)C(O)CC21)C(C)C |
|
AD22026 | 3.08 | 288.33 | C15H18O3N3 | CCOC(=O)CCCCOc1ccc(C2=C[N]N=N2)cc1 |
|
AD22027 | 2.06 | 310.33 | C14H14O6S | O=S(=O)(O)Oc1ccc(CCc2cc(O)cc(O)c2)cc1 |
|
AD22028 | 0.46 | 211.21 | C10H7N6 | Nc1ncnc2c1C(c1ccncc1)=N[N]2 |
|
AD22029 | -1.57 | 326.17 | C9H12O8N2FP | O=c1[nH]c(=O)n(C2CC(O)C(COP(=O)(O)O)O2)cc1F |
|
AD22030 | 4.77 | 271.41 | C15H13NS2 | Cc1ccccc1Cc1ccc(-c2cncs2)s1 |