aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD30711 | -1.77 | 217.23 | C6H9O3N4S | CCS(=O)(=O)NC1=C(C(N)=O)N=C[N]1 |
|
AD30712 | -0.54 | 207.17 | C4H8O3NF3S | O=S(=O)(CC(F)(F)F)NCCO |
|
AD30713 | 0.54 | 240.27 | C8H10O2N5S | CCCS(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD30714 | -1.38 | 231.26 | C7H11O3N4S | CCCS(=O)(=O)NC1=C(C(N)=O)N=C[N]1 |
|
AD30715 | 0.81 | 114.21 | C7H16N | CCC1CCC([NH3+])C1 |
|
AD30716 | 0.43 | 132.23 | C7H18ON | CC([NH3+])CCOC(C)C |
|
AD30717 | -0.2 | 116.18 | C6H14ON | CC1CC([NH3+])CCO1 |
|
AD30718 | 0.19 | 130.21 | C7H16ON | COC1CCCC([NH3+])C1 |
|
AD30719 | 0.04 | 118.2 | C6H16ON | CCOCCC(C)[NH3+] |
|
AD30720 | 0.12 | 210.23 | C10H14O3N2 | COc1nc(C)ccc1C(=O)NCCO |