aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39601 | 1.88 | 301.37 | C15H21ON6 | CC(C)NC(=O)C1CCCC(Nc2ncnc3c2N=C[N]3)C1 |
|
AD39602 | 1.61 | 298.31 | C14H13N7F | Fc1cccnc1N1CCC(Nc2ncnc3c2N=C[N]3)C1 |
|
AD39603 | 1.81 | 296.31 | C15H14O2N5 | COc1ccc2c(c1)OCC(Nc1ncnc3c1N=C[N]3)C2 |
|
AD39604 | 1.67 | 300.26 | C12H13ON5F3 | OC1(C(F)(F)F)CCCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD39605 | 1.48 | 300.37 | C13H14N7S | Cc1cnc(N2CCN(c3ncnc4c3N=C[N]4)CC2)s1 |
|
AD39606 | 1.93 | 292.33 | C15H14N7 | Cn1nc(CCNc2ncnc3c2N=C[N]3)c2ccccc21 |
|
AD39607 | 1.73 | 293.31 | C15H13ON6 | O=C1CC(c2cccc(Nc3ncnc4c3N=C[N]4)c2)CN1 |
|
AD39608 | 1.2 | 301.36 | C13H13ON6S | CN(CC(=O)NCc1cccs1)c1ncnc2c1N=C[N]2 |
|
AD39609 | 1.79 | 312.31 | C15H14O3N5 | COC(=O)c1ccc(CNc2ncnc3c2N=C[N]3)cc1OC |
|
AD39610 | 1.75 | 296.24 | C11H9N7F3 | Cn1cc(CNc2ncnc3c2N=C[N]3)c(C(F)(F)F)n1 |