aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23141 | 5.45 | 1358.64 | C69H63O16N10Cl3 | 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(Cl)cc5)cc4)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD23142 | 1.14 | 1300.13 | C61H64O18N12Cl2 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NC(CCCNC(=N)N)C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD23143 | 3.13 | 1248.1 | C62H60O16N10Cl2 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NNCc4ccccc4)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD23144 | 1.17 | 177.19 | C8H9ON4 | CCCOc1ncnc2c1N=C[N]2 |
|
AD23145 | 3.64 | 294.12 | C13H7N6Cl2 | Clc1nc2c(c(NCc3ccccc3Cl)n1)N=N[N]2 |
|
AD23146 | 3.67 | 300.35 | C18H14N5 | C1=Nc2c(ncnc2NCc2ccc(-c3ccccc3)cc2)[N]1 |
|
AD23147 | 4.12 | 410.38 | C21H16O3N4F2 | CC(Oc1cc2cc(F)cc(F)c2nc1N)c1cc(C(=O)O)ccc1-n1cccn1 |
|
AD23148 | 1.76 | 295.4 | C12H25O5NS | CCCCCCCCCOCC(=O)NS(=O)(=O)OC |
|
AD23149 | 4.35 | 450.4 | C18H28O5NSBr | COS(=O)(=O)NC(=O)CCCCCCCCCCOc1ccc(Br)cc1 |
|
AD23150 | -0.34 | 112.18 | C6H12N2 | CN1CCC12CNC2 |