aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13021 | 0.75 | 647.82 | C30H41O7N5S2 | NC(=O)C(CCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS |
|
AD13022 | 2.36 | 281.34 | C15H17N6 | CC(C)(CNc1nc(N)c2c(n1)[N]C=N2)c1ccccc1 |
|
AD13023 | 2.88 | 694.95 | C38H66O9N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(NCCCc2ccccc2)C(C)C(O)C1(C)O |
|
AD13024 | 0.85 | 167.58 | C7H4N4Cl | Nc1ncnc2c1C(Cl)=C[N]2 |
|
AD13025 | 0.11 | 553.3 | C16H22O11N5P3 | Nc1ncnc2c1ncn2C1CC(OP(=O)(O)O)C(CO[PH](O)(O)OP(=O)(O)c2ccccc2)O1 |
|
AD13026 | 0.05 | 238.25 | C10H14O3N4 | COc1nc(N)c(N=C(C)C(C)=O)c(=O)n1C |
|
AD13027 | 0.78 | 231.26 | C12H13O2N3 | O=c1[nH]ccc(=NOCCc2ccccc2)[nH]1 |
|
AD13028 | 2.37 | 282.33 | C14H10ON4S | COc1ccc(-c2c(C#N)c(N)nc(S)c2C#N)cc1 |
|
AD13029 | 4.53 | 877.14 | C48H72O9N6 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(Cc2ccc(-c3cn(CCc4c[nH]c5ccccc45)nn3)cc2)C(C)C(O)C1(C)O |
|
AD13030 | 4.46 | 877.14 | C48H72O9N6 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(Cc2ccc(-c3cn(CCn4ccc5ccccc54)nn3)cc2)C(C)C(O)C1(C)O |