aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06831 | 4.03 | 274.26 | C16H8O2N3 | c1ccc2oc(-c3ncnc4c3-c3occc3[N]4)cc2c1 |
|
AD06832 | 3.63 | 214.26 | C14H14O2 | COCc1ccc(Oc2ccccc2)cc1 |
|
AD06833 | 6.05 | 512.44 | C27H24N6Br | Brc1ccc(CCNc2nc3c(c(NCC(c4ccccc4)c4ccccc4)n2)N=C[N]3)cc1 |
|
AD06834 | 0.38 | 286.25 | C12H10O3N6 | Nc1nc2c(c(=O)[nH]1)[N+](Cc1cccc([N+](=O)[O-])c1)=C[N]2 |
|
AD06835 | 0.4 | 209.16 | C8H7O4N3 | NC(=O)NC(=O)c1ccc([N+](=O)[O-])cc1 |
|
AD06836 | 1.46 | 742.95 | C37H66O11N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)c2ocnc2C)C(C)C(O)C1(C)O |
|
AD06837 | 1.42 | 694.68 | C24H48O13N4P2S | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSCC(=O)NCCCCCNC(=O)OC(C)(C)C |
|
AD06838 | 1.79 | 372.43 | C19H24O4N4 | COc1c(C)c2c(c(O)c1CC=C(C)CNCc1cn(C)nn1)C(=O)OC2 |
|
AD06839 | 3.0 | 197.28 | C14H15N | CNC(c1ccccc1)c1ccccc1 |
|
AD06840 | 2.66 | 217.27 | C13H15O2N | COC(=O)CCCc1c[nH]c2ccccc12 |