aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40731 | -2.48 | 125.17 | C2H9O2N2S | NS(=O)(=O)CC[NH3+] |
|
AD40732 | -1.15 | 144.17 | C6H12O2N2 | COC(=O)C1CC(N)CN1 |
|
AD40733 | 0.41 | 361.12 | C10H10O3N4I | COC(=O)C(O)CNc1ncnc2c1C(I)=C[N]2 |
|
AD40734 | 0.78 | 318.1 | C8H9ON5I | CC(O)CNc1nc(I)nc2c1N=C[N]2 |
|
AD40735 | -0.74 | 147.17 | C6H13O3N | CCOC(=O)CC(O)CN |
|
AD40736 | 2.13 | 224.04 | C7H4N4Br | Brc1ccc(C2=C[N]N=N2)cn1 |
|
AD40737 | 2.18 | 210.26 | C10H16O2N3 | CC(C)(C)OC(=O)C(C)(C)C1=C[N]N=N1 |
|
AD40738 | 2.15 | 216.22 | C11H10O2N3 | CCOC(=O)c1ccc(C2=C[N]N=N2)cc1 |
|
AD40739 | 2.13 | 224.04 | C7H4N4Br | Brc1ccc(C2=C[N]N=N2)nc1 |
|
AD40740 | 1.02 | 215.32 | C11H23O2N2 | CC(C)(C)OC(=O)N1CCCC([NH3+])CC1 |