aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11911 | 2.64 | 362.41 | C20H20O2N5 | CC(C)(C)OC(=O)CCc1ccc(C#Cc2nc(N)c3c(n2)[N]C=N3)cc1 |
|
AD11912 | 5.53 | 1183.92 | C60H44O18N6Cl2 | O=C1Cc2ccc(O)c(c2)Oc2cc(O)cc(c2)C2NC(=O)C(Cc3ccc(c(Cl)c3)Oc3cc4cc(c3O)Oc3ccc(cc3Cl)C(O)C3NC(=O)C(NC(=O)C4NC2=O)c2ccc(O)c(c2)-c2c(O)cc(O)cc2C(C(=O)O)NC3=O)N1 |
|
AD11913 | 1.66 | 618.85 | C32H62O9N2 | CCCNC1C(C)CC(C)(O)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C1C |
|
AD11914 | 3.67 | 298.4 | C15H16N5S | CCSc1nc2c(c(NC(C)c3ccccc3)n1)N=C[N]2 |
|
AD11915 | 1.04 | 153.55 | C6H2N4Cl | Clc1ncnc2c1[N]C=N2 |
|
AD11916 | 0.54 | 108.14 | C6H8N2 | NCc1cccnc1 |
|
AD11917 | 4.6 | 538.01 | C25H16O4N5ClS2 | Cc1noc(NS(=O)(=O)c2ccc(-n3c(S)c(C#N)c(-c4ccc(Cl)cc4)c(C#N)c3=O)cc2)c1C |
|
AD11918 | 4.28 | 492.74 | C30H52O5 | CC(CCC(O)C(C)(C)O)C1C(O)CC2(C)C3CC(O)C4C(C)(C)C(O)CCC45CC35CCC12C |
|
AD11919 | 1.11 | 142.18 | C5H6ON2S | COC(=N)c1cscn1 |
|
AD11920 | 1.79 | 259.39 | C14H29O3N | CCCCCCCNC1(C)CC(O)OC(C)C1O |