aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01071 | 1.18 | 276.26 | C9H6O2N7S | Cn1cnc([N+](=O)[O-])c1Sc1ncnc2c1N=C[N]2 |
|
AD01072 | 0.64 | 151.17 | C5H3N4S | SC1=Nc2cncnc2[N]1 |
|
AD01073 | -0.9 | 164.15 | C6H6ON5 | Cn1c(=O)[nH]c2c(c1=N)N=C[N]2 |
|
AD01074 | 1.69 | 318.24 | C15H10O8 | O=c1c(O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12 |
|
AD01075 | -0.05 | 226.23 | C11H14O5 | COC(=O)C1=COC(O)C2C(CO)=CCC12 |
|
AD01076 | 0.67 | 162.26 | C6H14ON2S | CCNC(=O)NCCSC |
|
AD01077 | -0.05 | 149.16 | C6H7N5 | Cn1cnc2cnc(N)nc21 |
|
AD01078 | -0.73 | 253.26 | C10H15O3N5 | CC(=O)NCC1CN(Cc2cn(C)nn2)C(=O)O1 |
|
AD01079 | -0.54 | 114.1 | C5H6O3 | O=C1OCC=C1CO |
|
AD01080 | 5.43 | 430.67 | C28H46O3 | CC1CCC2(CC3CC4C5CCC6CC(O)C(O)CC6(C)C5CCC4(C)C3C2C)OC1 |