aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD30741 | -0.26 | 210.23 | C10H14O3N2 | COc1ncccc1CC(=O)NCCO |
|
AD30742 | 0.19 | 130.21 | C7H16ON | CC1(C)CC([NH3+])CCO1 |
|
AD30743 | 0.0 | 220.21 | C9H10O2N5 | Cc1noc(C)c1NC1=C(C(N)=O)N=C[N]1 |
|
AD30744 | -0.07 | 220.19 | C9H7ON5F | NC(=O)C1=C(Nc2ccc(F)cn2)[N]C=N1 |
|
AD30745 | 1.2 | 190.12 | C7H5ON2F3 | NC(=O)c1cncc(C(F)(F)F)c1 |
|
AD30746 | 1.13 | 204.15 | C8H7ON2F3 | NC(=O)Cc1cccc(C(F)(F)F)n1 |
|
AD30747 | 0.1 | 219.24 | C8H10O3NFS | O=S(=O)(NCCO)c1ccccc1F |
|
AD30748 | -0.5 | 217.21 | C9H9ON6 | Cc1ncc(NC2=C(C(N)=O)N=C[N]2)cn1 |
|
AD30749 | 0.81 | 199.28 | C9H13O2NS | CC(N)CS(=O)(=O)c1ccccc1 |
|
AD30750 | 0.1 | 219.24 | C8H10O3NFS | O=S(=O)(NCCO)c1cccc(F)c1 |