aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08221 | 1.06 | 148.16 | C8H8ON2 | OCc1nc2ccccc2[nH]1 |
|
AD08222 | 0.57 | 241.25 | C10H15O4N3 | CCCC(=O)c1c(NO)nc(OC)n(C)c1=O |
|
AD08223 | 0.76 | 206.2 | C10H10O3N2 | Cn1c(CO)nc2cc(C(=O)O)ccc21 |
|
AD08224 | 2.69 | 271.32 | C13H11ON4S | COc1ccc(CSc2ncnc3c2N=C[N]3)cc1 |
|
AD08225 | 3.66 | 422.5 | C19H39O6N2P | CCC(CC)COC(=O)C(C)NP(=O)(NC(C)C(=O)OCC(CC)CC)OC |
|
AD08226 | 5.82 | 1392.2 | C69H63O16N10F3Cl2 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NNCc4ccc(-c5ccc(C(F)(F)F)cc5)cc4)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD08227 | -0.19 | 152.11 | C5H3N5F | NC1=Nc2c(F)ncnc2[N]1 |
|
AD08228 | -0.75 | 425.52 | C17H27O4N7S | CC1(C)Nc2nc(N)[nH]c(=O)c2N=C1C(=O)NC1CCN(CCS(C)(=O)=O)CC1 |
|
AD08229 | -0.43 | 128.18 | C6H12ON2 | CN1CCCC1C(N)=O |
|
AD08230 | 2.03 | 531.73 | C28H53O8N | CC1CC(N(C)C)C(O)C(OC2C(C)CC(C)C(O)C(C)C(O)C(C)C(C)OC(=O)C(C)C(O)C2C)O1 |