aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35111 | -0.5 | 246.32 | C12H18N6 | CN(CC[NH+]1CCCC1)c1ncnc2c1N=C[N]2 |
|
AD35112 | -0.64 | 220.3 | C12H18ON3 | NC(=O)C1CC[NH+](Cc2ccncc2)CC1 |
|
AD35113 | -1.61 | 247.31 | C11H23O4N2 | C[NH2+]C(CC(=O)OC(C)(C)C)C(=O)NCCO |
|
AD35114 | -1.14 | 233.33 | C11H25O3N2 | C[NH2+]C(C(=O)NCCO)C(C)OC(C)(C)C |
|
AD35115 | -2.28 | 230.29 | C10H20O3N3 | [NH3+]C1CCCCN(CC(=O)NCCO)C1=O |
|
AD35116 | -1.39 | 231.32 | C11H23O3N2 | CC(C)(C)OC1C[NH2+]C(C(=O)NCCO)C1 |
|
AD35117 | -0.88 | 235.31 | C13H19O2N2 | [NH3+]C(C(=O)NCCO)C1Cc2ccccc2C1 |
|
AD35118 | -3.4 | 240.3 | C7H18O4N3S | CS(=O)(=O)N(CC[NH3+])CC(=O)NCCO |
|
AD35119 | -1.86 | 242.34 | C12H24O2N3 | O=C(NCCO)C1CCCN(C2CC[NH2+]C2)C1 |
|
AD35120 | -1.38 | 243.33 | C12H23O3N2 | O=C(NCCO)C1COC2(CCC[NH2+]CC2)C1 |