aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD27621 | 0.01 | 165.2 | C8H11ON3 | Cn1nc2c(c1C(N)=O)CCC2 |
|
AD27622 | 0.67 | 175.19 | C9H9ON3 | Cn1cnc2c(C(N)=O)cccc21 |
|
AD27623 | 0.74 | 175.19 | C9H9ON3 | Cc1ccn2c(C(N)=O)cnc2c1 |
|
AD27624 | 1.11 | 177.2 | C10H11O2N | NC(=O)c1cccc2c1CCCO2 |
|
AD27625 | 0.74 | 175.19 | C9H9ON3 | Cc1cccn2ncc(C(N)=O)c12 |
|
AD27626 | 0.92 | 183.23 | C8H9O2NS | NC(=O)c1cc2c(s1)CCOC2 |
|
AD27627 | 0.14 | 176.18 | C8H8ON4 | Cc1ccc2nnc(C(N)=O)n2c1 |
|
AD27628 | 0.14 | 176.18 | C8H8ON4 | Cc1cccn2c(C(N)=O)nnc12 |
|
AD27629 | -0.03 | 180.14 | C7H5ON4F | NC(=O)c1nnc2c(F)cccn12 |
|
AD27630 | 0.79 | 179.2 | C7H5ON3S | NC(=O)c1ccc2ncsc2n1 |