aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06811 | 2.32 | 196.29 | C12H20O2 | CC(O)CCC1C=CC(=O)CC1(C)C |
|
AD06812 | 3.52 | 518.39 | C26H14O12 | O=c1c2cc(O)c(O)cc2oc2c(-c3c(O)cc(O)c4c(=O)c5cc(O)c(O)cc5oc34)c(O)cc(O)c12 |
|
AD06813 | 5.15 | 320.89 | C18H21N2ClS | CC1CCC(Cc2nnc(Cc3ccccc3Cl)s2)CC1 |
|
AD06814 | 2.13 | 286.24 | C15H10O6 | O=C1C(=Cc2ccc(O)c(O)c2)Oc2c1ccc(O)c2O |
|
AD06815 | 0.25 | 272.37 | C11H20O2N4S | COCc1cc(CNC(=O)C(N)CCSC)n[nH]1 |
|
AD06816 | 1.61 | 208.63 | C9H7N5Cl | Clc1nc2c(c(NC3CC3)n1)N=C[N]2 |
|
AD06817 | -1.57 | 272.71 | C8H13O5N2ClS | COC(=O)CS(=O)(=O)NCCNC(=O)CCl |
|
AD06818 | 1.04 | 153.55 | C6H2N4Cl | Clc1ncc2c(n1)[N]C=N2 |
|
AD06819 | 0.5 | 164.16 | C8H8O2N2 | NC(=O)NC(=O)c1ccccc1 |
|
AD06820 | 0.84 | 189.17 | C9H7O2N3 | NC(=O)c1nnc(-c2ccccc2)o1 |