aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34471 | 0.44 | 218.05 | C6H8ON3Br | Cc1nn(CC(N)=O)cc1Br |
|
AD34472 | -0.25 | 248.08 | C7H10O2N3Br | O=C(Cn1cc(Br)cn1)NCCO |
|
AD34473 | -0.92 | 221.26 | C10H15ON5 | NC(=O)CN1CCN(c2ncccn2)CC1 |
|
AD34474 | 0.55 | 218.22 | C10H10O2N4 | NC(=O)CCc1nc(-c2ccccn2)no1 |
|
AD34475 | -0.2 | 250.3 | C12H18O2N4 | O=C(NCCO)C1CCN(c2ncccn2)CC1 |
|
AD34476 | 0.91 | 220.27 | C12H16O2N2 | NC(=O)C1(Cc2cccnc2)CCOCC1 |
|
AD34477 | -0.63 | 244.28 | C8H12O3N4S | O=C(CCC(=O)Nc1nncs1)NCCO |
|
AD34478 | 0.1 | 232.04 | C6H6O2N3Br | NC(=O)COc1ncc(Br)cn1 |
|
AD34479 | 0.49 | 220.28 | C11H16ON4 | Cc1cc(N2CCC(C(N)=O)CC2)ncn1 |
|
AD34480 | 0.09 | 219.24 | C11H13O2N3 | CN1C(=O)CC(C(N)=O)C1c1cccnc1 |