aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21181 | 2.61 | 214.22 | C13H10O3 | O=C(Oc1ccc(O)cc1)c1ccccc1 |
|
AD21182 | 2.01 | 188.23 | C11H12ON2 | Cc1[nH]nc(O)c1Cc1ccccc1 |
|
AD21183 | 3.27 | 371.42 | C21H19ON6 | O=C(NCc1ccc(Nc2ncnc3c2N=C[N]3)cc1)C1=CC2C=CC1CC2 |
|
AD21184 | 4.02 | 331.47 | C16H23N6S | S=C=NCCCCCCCCCCNc1ncnc2c1N=C[N]2 |
|
AD21185 | 1.08 | 178.23 | C5H6O3S2 | COS(=O)(=O)c1cccs1 |
|
AD21186 | 0.36 | 275.31 | C14H17O3N3 | CC(C#Cc1cc(C(N)=O)ccn1)CCC(N)C(=O)O |
|
AD21187 | 6.08 | 1523.27 | C75H65O24N9Cl2 | CC1(C)OC2OC(COCc3cn(C4C(=O)NC5Cc6ccc(c(Cl)c6)Oc6cc7cc(c6O)Oc6ccc(cc6Cl)C(O)C6NC(=O)C(NC(=O)C7NC(=O)C(NC5=O)c5cc(O)cc(c5)Oc5cc4ccc5O)c4ccc(O)c(c4)-c4c(O)cc(O)cc4C(C(=O)O)NC6=O)nn3)C3OC(C)(C)OC3C2O1 |
|
AD21188 | 1.36 | 219.22 | C11H10ON3F | Nc1nc(CO)cc(-c2cccc(F)c2)n1 |
|
AD21189 | 10.26 | 622.03 | C39H75O4N | CCCCCCCCCC=CCCC=CC(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCCCCC |
|
AD21190 | 1.37 | 224.25 | C12H10N5 | Cc1ccc(C2=N[N]c3ncnc(N)c32)cc1 |