aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD30731 | 1.05 | 189.22 | C10H11ON3 | Cc1cc(C)n2ccc(C(N)=O)c2n1 |
|
AD30732 | 0.12 | 118.22 | C5H12NS | [NH3+]C1CCSCC1 |
|
AD30733 | -0.56 | 219.23 | C9H11ON6 | Cc1cc(NC2=C(C(N)=O)N=C[N]2)n(C)n1 |
|
AD30734 | -0.16 | 213.24 | C9H15O3N3 | CC(C)c1nc(CC(=O)NCCO)no1 |
|
AD30735 | 1.46 | 199.27 | C9H13O2NS | CC(C)c1ccc(S(N)(=O)=O)cc1 |
|
AD30736 | 1.29 | 199.27 | C9H13O2NS | CCCc1ccc(S(N)(=O)=O)cc1 |
|
AD30737 | 0.55 | 208.24 | C9H8O2N2S | NC(=O)Cn1ccc2sccc2c1=O |
|
AD30738 | 0.19 | 130.21 | C7H16ON | COC1CCC([NH3+])CC1 |
|
AD30739 | -0.14 | 238.25 | C8H8O2N5S | COc1ncc(NC2=C(C(N)=O)N=C[N]2)s1 |
|
AD30740 | -0.11 | 215.28 | C8H13O2N3S | Cc1nnc(CCC(=O)NCCO)s1 |