aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34461 | 1.1 | 257.28 | C12H13ON6 | CC(=O)N1CCC(=Nc2ncnc3c2N=C[N]3)CC1 |
|
AD34462 | -0.99 | 248.27 | C11H14O2N5 | CC(=O)N1CC=C(NC2=C(C(N)=O)N=C[N]2)CC1 |
|
AD34463 | 0.2 | 237.28 | C10H11O2N3S | O=CN1CCC12CN(C(=O)c1ccns1)C2 |
|
AD34464 | 0.2 | 237.28 | C10H11O2N3S | O=CN1CC2CC(C1)N2C(=O)c1ccns1 |
|
AD34465 | 0.55 | 218.22 | C10H10O2N4 | NC(=O)CCc1nc(-c2cccnc2)no1 |
|
AD34466 | 0.06 | 237.28 | C10H11O2N3S | O=CN1CC2(C1)CN(C(=O)c1ccns1)C2 |
|
AD34467 | -0.3 | 251.29 | C12H17O3N3 | O=C(CCCNC(=O)c1cccnc1)NCCO |
|
AD34468 | -0.69 | 247.26 | C11H13O2N5 | O=C(Cc1ccc(-n2cnnn2)cc1)NCCO |
|
AD34469 | 1.52 | 218.18 | C9H9ON2F3 | NC(=O)CCc1ccc(C(F)(F)F)nc1 |
|
AD34470 | 0.05 | 233.32 | C7H11O2N3S2 | Cc1nnc(SCC(=O)NCCO)s1 |