aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34321 | 0.81 | 237.33 | C11H15ON3S | O=CN1CCC2(C1)CN(Cc1ccns1)C2 |
|
AD34322 | 0.95 | 237.33 | C11H15ON3S | O=CN1CC2CCC(C1)N2Cc1ccns1 |
|
AD34323 | 0.87 | 237.33 | C11H15ON3S | Cc1scnc1CN1CC2(CCN2C=O)C1 |
|
AD34324 | 0.95 | 237.33 | C11H15ON3S | O=CN1CC2CCC(C1)N2Cc1cnsc1 |
|
AD34325 | 0.73 | 237.33 | C11H15ON3S | Cc1scnc1CN1CC2(CN(C=O)C2)C1 |
|
AD34326 | 0.26 | 238.32 | C10H14ON4S | Cc1nnc(CN2CC3(CCN3C=O)C2)s1 |
|
AD34327 | 0.12 | 238.32 | C10H14ON4S | Cc1nnc(CN2CC3(CN(C=O)C3)C2)s1 |
|
AD34328 | 0.81 | 237.33 | C11H15ON3S | O=CN1CCC2(C1)CN(Cc1cnsc1)C2 |
|
AD34329 | 0.0 | 238.32 | C10H14ON4S | Nc1ncc(CN2CC3(CN(C=O)C3)C2)s1 |
|
AD34330 | 0.19 | 238.31 | C11H14O2N2S | O=CN1CCC12CN(CC1OC=CC1=S)C2 |