aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08391 | 3.26 | 269.69 | C15H8ON3Cl | N#Cc1cnc2c(ccn2-c2ccc(O)c(Cl)c2)c1 |
|
AD08392 | 9.95 | 564.89 | C35H64O5 | CCCCCCC=CCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC=CCCCCCC |
|
AD08393 | 2.26 | 197.21 | C8H7O3NS | CC(=O)C=Cc1ccc([N+](=O)[O-])s1 |
|
AD08394 | 3.02 | 845.14 | C45H76O9N6 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCCc2cn(CCN3CCc4ccccc43)nn2)C(C)C(O)C1(C)O |
|
AD08395 | 4.02 | 760.03 | C41H69O8N5 | CCCCc1ccc(-c2cn(CC3CN(C)CC(C)C(O)C(C)CC(C)(OC)C(OC4OC(C)CC(N(C)C)C4O)C(C)C(O)C(C)C(=O)O3)nn2)cc1 |
|
AD08396 | 0.97 | 352.47 | C20H32O5 | C=C1C2CCC3C(O)C2(CC(O)C2(O)C1CC(O)C2(C)C)CC3(C)O |
|
AD08397 | 3.54 | 373.44 | C21H21ON6 | CC(C)Oc1cc(-c2ccccc2)ccc1CNC1=Nc2c(N)ncnc2[N]1 |
|
AD08398 | 1.78 | 565.58 | C30H31O10N | COc1cc(O)c2c(O)c3c(c4c2c1C1(C4)C(C)=CCCC1(C)C)C(O)C1(O)CC(O)=C(C(N)=O)C(=O)C1(O)C3=O |
|
AD08399 | 2.46 | 299.26 | C13H18O5NP | COC(=O)C1CCCN1P(=O)(OC)Oc1ccccc1 |
|
AD08400 | 2.68 | 733.95 | C38H63O9N5 | COc1ccc(-c2cn(CC3COC(=O)C(C)C(O)C(C)C(OC4OC(C)CC(N(C)C)C4O)C(C)(OC)CC(C)C(O)C(C)CN3C)nn2)cc1 |