aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03671 | 0.34 | 174.14 | C7H4ON5 | Oc1c2c(nc3nccn13)[N]C=N2 |
|
AD03672 | 3.42 | 369.37 | C20H19O6N | CCCc1cc(C(=O)Nc2c(O)c3ccc(O)c(C)c3oc2=O)ccc1O |
|
AD03673 | 0.61 | 175.14 | C5H3N8 | [N-]=[N+]=NC1=Nc2c(N)ncnc2[N]1 |
|
AD03674 | 0.24 | 222.27 | C11H16O2N3 | CN(CCO)C1=NC(=O)C2=C(CCCC2)[N]1 |
|
AD03675 | 12.97 | 856.39 | C50H97O7NS | CCCCCCCCC=CCCCCCCCCOCC(COCCOCCOCCOCCNC(=O)CCS)OCCCCCCCCC=CCCCCCCCC |
|
AD03676 | 0.35 | 125.06 | C2H8O3NP | COP(N)(=O)OC |
|
AD03677 | 2.75 | 261.28 | C17H11O2N | Cn1c2c(c3ccccc3c1=O)C(=O)c1ccccc1-2 |
|
AD03678 | -1.55 | 138.13 | C6H6O2N2 | Nc1c[nH+]cc(C(=O)[O-])c1 |
|
AD03679 | 1.96 | 205.21 | C11H11O3N | COc1cc(OC)c2c(O)ccnc2c1 |
|
AD03680 | 1.56 | 294.21 | C13H7O2N3F3 | COC(=O)C1=N[N]C(C#Cc2ccc(C(F)(F)F)cc2)=N1 |