aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39471 | 1.47 | 301.37 | C15H21ON6 | CCC(CC)C(=O)N1CCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD39472 | 0.44 | 285.1 | C9H9O2N4Br | O=C(NCCO)c1c[nH]c2ncc(Br)nc12 |
|
AD39473 | 0.82 | 284.11 | C10H10O2N3Br | O=C(NCCO)c1nc(Br)n2ccccc12 |
|
AD39474 | 0.21 | 285.1 | C9H9O2N4Br | O=C(NCCO)c1cnc2cnc(Br)cn12 |
|
AD39475 | 0.82 | 284.11 | C10H10O2N3Br | O=C(NCCO)c1cnn2ccc(Br)cc12 |
|
AD39476 | 2.4 | 265.11 | C11H9ON2Br | Cc1ccc2cc(Br)cc(C(N)=O)c2n1 |
|
AD39477 | 1.87 | 294.34 | C15H16N7 | Cc1nccc(C2CCCN(c3ncnc4c3N=C[N]4)C2)n1 |
|
AD39478 | 2.07 | 268.11 | C11H10O2NBr | NC(=O)c1cc(Br)cc2c1CCCC2=O |
|
AD39479 | 1.85 | 312.35 | C16H18O2N5 | Cc1cccc(C)c1OCC(O)CNc1ncnc2c1N=C[N]2 |
|
AD39480 | 0.45 | 299.13 | C10H11O2N4Br | Cn1nc(C(=O)NCCO)c2cc(Br)cnc21 |