aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42091 | -1.23 | 216.25 | C10H12N6 | C1=Nc2c(ncnc2N2CC3C[NH2+]C3C2)[N]1 |
|
AD42092 | 0.42 | 342.14 | C10H11N6I | Ic1nc2c(c(N=C3CCC[NH2+]C3)n1)N=C[N]2 |
|
AD42093 | 0.42 | 342.14 | C10H11N6I | Ic1nc2c(c(N=C3CC[NH2+]CC3)n1)N=C[N]2 |
|
AD42094 | 0.67 | 356.17 | C11H13N6I | Ic1nc2c(c(N=CC3CC[NH2+]CC3)n1)N=C[N]2 |
|
AD42095 | 0.81 | 356.17 | C11H13N6I | Ic1nc2c(c(N=C3CCC[NH2+]CC3)n1)N=C[N]2 |
|
AD42096 | 1.34 | 366.17 | C12H11N6I | [NH3+]Cc1cnccc1Nc1ncnc2c1C(I)=C[N]2 |
|
AD42097 | 0.33 | 327.13 | C10H10N5I | IC1=C[N]c2ncnc(NC3=CC[NH2+]C3)c21 |
|
AD42098 | -1.32 | 151.19 | C7H11N4 | Nc1ncc2c(n1)CC[NH2+]C2 |
|
AD42099 | -1.28 | 165.22 | C8H13N4 | Nc1ncnc2c1CC[NH2+]CC2 |
|
AD42100 | -1.2 | 125.16 | C5H9N4 | Nc1cc(C[NH3+])ncn1 |