aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31831 | 1.27 | 182.22 | C9H14O2N2 | CCOC(=O)c1c(N)ccn1CC |
|
AD31832 | 1.21 | 186.24 | C7H10O2N2S | CCOC(=O)c1c(C)nsc1N |
|
AD31833 | 1.73 | 182.53 | C6H2N2F3Cl | Nc1nc(F)c(F)c(Cl)c1F |
|
AD31834 | 1.94 | 187.63 | C9H10O2NCl | COc1cc(OC)c(Cl)cc1N |
|
AD31835 | 1.22 | 179.22 | C10H13O2N | Cc1cc2c(cc1CN)OCCO2 |
|
AD31836 | 0.46 | 182.27 | C10H18ON2 | CN(C)C(=O)C1CC12CCNCC2 |
|
AD31837 | 1.82 | 190.17 | C8H9N2F3 | CNCc1ncccc1C(F)(F)F |
|
AD31838 | 1.79 | 177.23 | C8H7N3S | Nc1csc(-c2ccncc2)n1 |
|
AD31839 | 0.9 | 188.28 | C5H8N4S2 | CSc1nnc(N)c(SC)n1 |
|
AD31840 | 0.76 | 176.02 | C4H6N3Br | Cn1nc(Br)cc1N |