aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12111 | 2.82 | 192.26 | C12H16O2 | CCCCc1ccc(C(=O)OC)cc1 |
|
AD12112 | -1.04 | 219.26 | C8H13O4NS | CC1=NC2C(OC(CO)C(O)C2O)S1 |
|
AD12113 | -1.51 | 308.33 | C13H24O8 | CC(C)(O)COCC1(O)CCC(O)C(OCC(=O)O)C1O |
|
AD12114 | 1.5 | 194.19 | C10H10O4 | COc1ccc(C=CC(=O)O)cc1O |
|
AD12115 | 1.72 | 225.26 | C12H11N5 | c1ccc(Cn2cnc(-c3ncc[nH]3)n2)cc1 |
|
AD12116 | 1.25 | 254.33 | C14H22O4 | CC(C)=CC1(O)C(=O)C(C)(C)C(=O)C(C)(C)C1O |
|
AD12117 | 1.3 | 152.15 | C8H8O3 | CC(=O)c1cc(O)cc(O)c1 |
|
AD12118 | 4.04 | 276.75 | C14H9ON2ClS | Clc1ccccc1Cc1nnc(-c2ccoc2)s1 |
|
AD12119 | 4.35 | 290.78 | C15H11ON2ClS | Cc1ccoc1-c1nnc(Cc2ccccc2Cl)s1 |
|
AD12120 | 4.51 | 292.82 | C14H9N2ClS2 | Clc1ccccc1Cc1nnc(-c2ccsc2)s1 |