aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD07041 | 4.95 | 310.34 | C20H12ON3 | c1ccc(-c2ccc3c(c2)-c2c(ncnc2-c2ccco2)[N]3)cc1 |
|
AD07042 | -2.02 | 300.12 | C7H12O8NP2 | COP(=O)([O-])OC(C(=O)N1CCCC1)P(=O)([O-])[O-] |
|
AD07043 | 1.84 | 274.27 | C15H14O5 | Oc1ccc(C2Oc3cc(O)cc(O)c3CC2O)cc1 |
|
AD07044 | 3.08 | 347.44 | C18H21O4NS | CC(C)C(C(=O)O)N(C)S(=O)(=O)c1ccc(-c2ccccc2)cc1 |
|
AD07045 | 1.77 | 241.23 | C12H9O2N4 | COc1ccc(-c2nc(O)c3c(n2)[N]C=N3)cc1 |
|
AD07046 | 5.2 | 835.11 | C42H58O6N8S2 | CCSCCNC(=S)NCCOCCOCCOCCOCCOCCOc1ccc(-c2nc3cc(-c4nc5cc(N6CCN(C)CC6)ccc5[nH]4)ccc3[nH]2)cc1 |
|
AD07047 | -0.48 | 128.13 | C5H8O2N2 | CC1=CNC(=O)NC1O |
|
AD07048 | 0.87 | 333.43 | C16H31O6N | CCCCCCOC(CNC1(C)CC(O)OC(C)C1O)C(=O)O |
|
AD07049 | 2.0 | 226.71 | C12H15ON2Cl | CCc1ccc(C(=O)NCC(C)Cl)nc1 |
|
AD07050 | 2.22 | 282.31 | C13H8ON5S | N#Cc1ccc(CSC2=Nc3c(O)ncnc3[N]2)cc1 |