aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39481 | 0.82 | 284.11 | C10H10O2N3Br | O=C(NCCO)c1cn2c(Br)ccc2cn1 |
|
AD39482 | 0.82 | 284.11 | C10H10O2N3Br | O=C(NCCO)c1ncn2cc(Br)ccc12 |
|
AD39483 | 1.16 | 296.31 | C14H14ON7 | Cc1ccnc(NC(=O)CN(C)c2ncnc3c2N=C[N]3)c1 |
|
AD39484 | 1.61 | 301.37 | C15H21ON6 | CN(CC(=O)N(C)C1CCCCC1)c1ncnc2c1N=C[N]2 |
|
AD39485 | 1.27 | 295.33 | C15H15ON6 | NC(=O)CCN(Cc1ccccc1)c1ncnc2c1N=C[N]2 |
|
AD39486 | 1.73 | 299.36 | C15H19ON6 | O=C1C(Nc2ncnc3c2N=C[N]3)CCN1C1CCCCC1 |
|
AD39487 | 1.35 | 313.26 | C12H12ON6F3 | O=C1C(Nc2ncnc3c2N=C[N]3)CCCN1CC(F)(F)F |
|
AD39488 | 1.59 | 299.36 | C15H19ON6 | O=C(C1CCCC1)N1CCC(Nc2ncnc3c2N=C[N]3)C1 |
|
AD39489 | 1.24 | 293.31 | C15H13ON6 | O=C1CN(c2ncnc3c2N=C[N]3)CCN1c1ccccc1 |
|
AD39490 | 1.79 | 316.37 | C14H14O2N5S | CCS(=O)(=O)c1ccc(CNc2ncnc3c2N=C[N]3)cc1 |