aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11421 | 2.59 | 323.38 | C17H19ON6 | C1=Nc2c(nc(NCc3ccccc3)nc2NCC2CCCO2)[N]1 |
|
AD11422 | 0.61 | 475.22 | C12H20O11N3P3 | COP(=O)(O)OP(=O)(O)OP(=O)(O)Nc1ccc(CC(NC(C)=O)C(N)=O)cc1 |
|
AD11423 | 0.76 | 242.28 | C10H18O3N4 | O=CNCCN(N=O)C(=O)NC1CCCCC1 |
|
AD11424 | 2.49 | 214.27 | C11H8N3S | Cc1ncnc2c1C(c1ccsc1)=C[N]2 |
|
AD11425 | 2.58 | 213.24 | C13H11O2N | NC(=O)c1ccccc1Oc1ccccc1 |
|
AD11426 | -2.3 | 488.63 | C22H44O6N6 | CC(C)CC(NC(=O)C(N)C(C)C)C(=O)NCC(=O)NC(CCCCN)C(=O)NC(CO)CO |
|
AD11427 | 1.29 | 375.4 | C19H22O4N3F | O=C(O)c1cn(C2CC2)c2cc(N3CCN(CCO)CC3)c(F)cc2c1=O |
|
AD11428 | 0.18 | 122.13 | C6H6ON2 | NC(=O)c1ccccn1 |
|
AD11429 | 2.15 | 326.31 | C16H14O4N4 | COc1ccc(-c2nc3cc(C(=O)NNC(=O)O)ccc3[nH]2)cc1 |
|
AD11430 | 7.31 | 840.27 | C45H85O7N5S | CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)CCCCCCCCCCNC(=O)CCCCCNC(=O)CCCCC1SCC2NC(=O)NC21 |