aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33881 | -0.67 | 206.31 | C8H18O2N2S | CS(=O)(=O)CCCN1CCNCC1 |
|
AD33882 | 0.97 | 202.26 | C11H14N4 | c1cc2n[nH]cc2cc1N1CCNCC1 |
|
AD33883 | 1.65 | 199.26 | C12H13N3 | c1ccc(-c2cn3c(n2)CNCC3)cc1 |
|
AD33884 | 1.4 | 220.25 | C12H13ON2F | O=C1Nc2c(F)cccc2C12CCNCC2 |
|
AD33885 | 2.08 | 220.1 | C11H11ONCl2 | OCCNCc1ccc(Cl)c(Cl)c1 |
|
AD33886 | 0.74 | 220.27 | C12H16O2N2 | COc1ccc(C(=O)N2CCNCC2)cc1 |
|
AD33887 | 2.07 | 221.3 | C13H19O2N | COc1cccc(OCC2CCNCC2)c1 |
|
AD33888 | 1.4 | 199.28 | C9H13O2NS | CCOC(=O)CNCc1ccsc1 |
|
AD33889 | 0.75 | 202.05 | C6H8N3Br | Brc1cnc2n1CCNC2 |
|
AD33890 | 0.5 | 216.28 | C10H20O3N2 | CC(C)(C)OC(=O)NCC1CNCCO1 |