aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14721 | 2.75 | 278.42 | C20H24N | C[NH+](C)CCC=C1c2ccccc2CCc2ccccc21 |
|
AD14722 | 3.91 | 357.11 | C12H6N5F3Br | FC(F)(F)c1cc(Br)cc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD14723 | 3.43 | 275.29 | C17H11O2N2 | Cc1c(C2=Nc3ccccc3[N]2)c(=O)oc2ccccc12 |
|
AD14724 | 1.7 | 169.61 | C9H8ONCl | CNC(=O)c1ccc(Cl)cc1 |
|
AD14725 | 5.42 | 649.89 | C39H57O6N2 | CCC1CCCC(OC2CCC(N(C)CCC[n+]3ccccc3)C(C)O2)C(C)C(=O)C2=CC3C(C=CC4CC(O)CC43)C2CC(=O)O1 |
|
AD14726 | 3.52 | 301.78 | C15H10N4ClS | Clc1ccc(C=CCSc2ncnc3c2C=N[N]3)cc1 |
|
AD14727 | 3.33 | 428.52 | C25H26O2N5 | CC12CCC3c4ccc(O)cc4CCC3C1CCC2(O)C#CC1=Nc2c(N)ncnc2[N]1 |
|
AD14728 | 1.29 | 199.19 | C10H7ON4 | Nc1ncnc2c1C(c1ccoc1)=C[N]2 |
|
AD14729 | -1.05 | 218.3 | C10H22O3N2 | CCCCOC1C(N)CC(N)C(O)C1O |
|
AD14730 | 4.44 | 373.46 | C21H17ON4S | C(=Cc1ccc(OCc2ccccc2)cc1)CSc1ncnc2c1C=N[N]2 |