aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31011 | 0.81 | 223.3 | C10H13ON3S | O=CN1CC2CC(C1)N(c1nccs1)C2 |
|
AD31012 | -0.1 | 204.23 | C10H12ON4 | O=CN1CC2CC(C1)N2c1cncnc1 |
|
AD31013 | 0.5 | 203.25 | C11H13ON3 | O=CN1CC2CC(C1)N2c1cccnc1 |
|
AD31014 | -0.1 | 204.23 | C10H12ON4 | O=CN1CCC12CN(c1cncnc1)C2 |
|
AD31015 | -0.25 | 204.23 | C10H12ON4 | O=CN1CC2(C1)CN(c1cncnc1)C2 |
|
AD31016 | 0.36 | 203.25 | C11H13ON3 | O=CN1CC2(C1)CN(c1cccnc1)C2 |
|
AD31017 | 1.03 | 208.29 | C10H12ON2S | O=CN1CC2(C1)CN(c1ccsc1)C2 |
|
AD31018 | 0.5 | 203.25 | C11H13ON3 | O=CN1CCC12CN(c1cccnc1)C2 |
|
AD31019 | 1.41 | 222.31 | C11H14ON2S | O=CN1CC2CC(C1)N(c1ccsc1)C2 |
|
AD31020 | -0.3 | 206.25 | C10H14ON4 | Cn1ccc(N2CC3(CN(C=O)C3)C2)n1 |