aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34851 | 0.2 | 237.28 | C10H11O2N3S | O=CN1CC2CC(C1)N2C(=O)c1cscn1 |
|
AD34852 | 0.06 | 237.28 | C10H11O2N3S | O=CN1CC2(C1)CN(C(=O)c1cscn1)C2 |
|
AD34853 | 0.2 | 237.28 | C10H11O2N3S | O=CN1CCC12CN(C(=O)c1cscn1)C2 |
|
AD34854 | 0.52 | 261.31 | C12H17ON6 | CC1CN(CCNc2ncnc3c2N=C[N]3)CCO1 |
|
AD34855 | 0.43 | 242.34 | C11H18O2N2S | CSCC(=O)N1CCCC2(CN(C=O)C2)C1 |
|
AD34856 | 0.04 | 228.32 | C10H16O2N2S | CSCC(=O)N1CCC2CN(C=O)CC21 |
|
AD34857 | 0.18 | 228.32 | C10H16O2N2S | CSCC(=O)N1CC2CCC(C1)N2C=O |
|
AD34858 | 0.18 | 228.32 | C10H16O2N2S | CSCC(=O)N1CCC2C1CCN2C=O |
|
AD34859 | -0.58 | 244.32 | C10H16O3N2S | CSCC(=O)N1CC2COCC(C1)N2C=O |
|
AD34860 | 0.04 | 228.32 | C10H16O2N2S | CSCC(=O)N1CC2(CCN(C=O)C2)C1 |