aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37051 | 0.01 | 244.32 | C13H18N5 | c1ccc(NCc2cnc3n2CC[NH2+]CC3)nc1 |
|
AD37052 | -0.96 | 239.34 | C12H23ON4 | C[NH+](C)CCOCc1ncn2c1CNCCC2 |
|
AD37053 | 0.77 | 229.31 | C13H17N4 | c1ccc2c(NC3CC[NH2+]CC3)ncnc2c1 |
|
AD37054 | 0.24 | 235.35 | C14H23ON2 | COc1ccc(CC[NH+]2CCC(N)CC2)cc1 |
|
AD37055 | 0.88 | 248.35 | C14H22ON3 | CC([NH3+])C1CCC(C(=O)N=c2cc[nH]cc2)CC1 |
|
AD37056 | -0.01 | 229.33 | C10H17O2N2S | CC(C)([NH3+])CNS(=O)(=O)c1ccccc1 |
|
AD37057 | 1.34 | 235.35 | C14H23ON2 | COc1cccc(CNC2CCC([NH3+])CC2)c1 |
|
AD37058 | 1.25 | 225.74 | C13H18N2Cl | [NH3+]C1(Cc2cccc(Cl)c2)CCNCC1 |
|
AD37059 | -1.81 | 239.3 | C11H19O2N4 | C[NH+](C)CCNC(=O)c1noc2c1CNCC2 |
|
AD37060 | 0.13 | 238.29 | C12H17ON3F | Fc1cccnc1NC1COC2(CC[NH2+]C2)C1 |