aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42111 | -1.55 | 237.28 | C11H17O2N4 | O=c1[nH]cc(NC2CCC3C[NH2+]CC32)c(=O)[nH]1 |
|
AD42112 | -1.23 | 204.24 | C9H12N6 | C[NH2+]C1CN(c2ncnc3c2N=C[N]3)C1 |
|
AD42113 | -0.98 | 206.25 | C9H14N6 | C[NH2+]CCN(C)c1ncnc2c1N=C[N]2 |
|
AD42114 | -1.28 | 218.26 | C10H14N6 | C[NH+](C)C1CN(c2ncnc3c2N=C[N]3)C1 |
|
AD42115 | -1.7 | 222.23 | C9H12O2N5 | Cc1cc(C[NH3+])nn1-c1c[nH]c(=O)[nH]c1=O |
|
AD42116 | -1.99 | 213.26 | C9H17O2N4 | CC(C[NH+](C)C)Nc1c[nH]c(=O)[nH]c1=O |
|
AD42117 | -1.09 | 227.29 | C10H19O2N4 | CC(C)N(CCC[NH3+])c1c[nH]c(=O)[nH]c1=O |
|
AD42118 | -0.79 | 216.25 | C10H12N6 | [NH3+]C12CC1CN(c1ncnc3c1N=C[N]3)C2 |
|
AD42119 | -0.94 | 216.25 | C10H12N6 | [NH3+]C1C2CN(c3ncnc4c3N=C[N]4)CC12 |
|
AD42120 | -1.23 | 204.24 | C9H12N6 | CN(c1ncnc2c1N=C[N]2)C1C[NH2+]C1 |