aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06761 | 1.9 | 330.29 | C17H14O7 | COc1c(O)cc2c(c1O)C(=O)c1c(cc(C)c(O)c1OC)C2=O |
|
AD06762 | 1.91 | 164.2 | C10H12O2 | CC(=O)CCc1ccc(O)cc1 |
|
AD06763 | 0.12 | 220.26 | C9H14N7 | NCCCCNc1nc(N)c2c(n1)[N]C=N2 |
|
AD06764 | 2.86 | 352.43 | C19H28O6 | CC=C1C(O)OC=C(C(=O)OC)C1CC(=O)OCCC1CCCCC1 |
|
AD06765 | 3.14 | 357.72 | C16H11O2N3F3Cl | O=c1n(Cc2ccccc2Cl)nc2cc(OCC(F)(F)F)ccn12 |
|
AD06766 | 3.16 | 308.17 | C16H11ON3Cl2 | Cc1cc2nn(Cc3ccccc3Cl)c(=O)n2cc1Cl |
|
AD06767 | 2.17 | 271.23 | C12H8ON6F | O=C(Nc1ccccc1F)Nc1ncnc2c1N=C[N]2 |
|
AD06768 | 6.16 | 887.12 | C44H56O7N9S2 | CC[N+]1=C(C=CC=CC=C2N(CCCCCC(=O)NCCCCCCNC3=Nc4c(N)ncnc4[N]3)c3ccc(S(=O)(=O)O)cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21 |
|
AD06769 | 1.38 | 218.26 | C12H14O2N2 | CNC(Cc1c[nH]c2ccccc12)C(=O)O |
|
AD06770 | 1.39 | 348.42 | C17H20O4N2S | COS(=O)(=O)NC(=O)C(Cc1ccccc1)NCc1ccccc1 |