aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11201 | 11.39 | 640.99 | C41H68O5 | CCCCCCCCC=CCCCCCCCC(=O)OC(CO)COC(=O)C=CC=CC=CC=CC=CCCCCCCCCC |
|
AD11202 | 2.27 | 388.31 | C13H14O2N3S2Br | O=C1C(=Cc2ccc(Br)s2)N=C(S)N1CN1CCOCC1 |
|
AD11203 | 3.43 | 437.88 | C22H24O7NCl | CC(C)OC(=O)c1cn(C2CC2)c2cc(Cl)c(OCCOCCC(=O)O)cc2c1=O |
|
AD11204 | 2.71 | 227.29 | C13H15N4 | CCCCCCC#Cc1ncnc2c1N=C[N]2 |
|
AD11205 | 1.83 | 219.16 | C9H8O2NF3 | O=CNCc1ccc(OC(F)(F)F)cc1 |
|
AD11206 | 0.57 | 109.13 | C6H7ON | OCc1ccncc1 |
|
AD11207 | 5.87 | 546.79 | C33H54O6 | CCCCCC(=O)OC1CC2C(CCC3(C)C2CC2OC4(CCC(C)CO4)C(C)C23)C2(C)CC(O)C(O)CC12 |
|
AD11208 | 1.34 | 616.75 | C30H52O11N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC3C2OC(=O)N3C)C(C)(OC)CC(C)C(=O)NC(C)C(O)C1(C)O |
|
AD11209 | 3.39 | 286.75 | C14H7N4ClS | N#Cc1c(N)[nH]c(=S)c(C#N)c1-c1cccc(Cl)c1 |
|
AD11210 | 0.26 | 188.23 | C8H16O3N2 | CC(C)(C)OC(=O)NCCNC=O |