aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12381 | 1.0 | 247.26 | C9H7ON6S | Nc1nc(OCc2nccs2)nc2c1N=C[N]2 |
|
AD12382 | 2.56 | 528.42 | C20H31O2N7I | CN(CCCCN(C)c1ncnc2c1N=C[N]2)C(=O)CCCCCCNC(=O)CI |
|
AD12383 | 2.85 | 301.23 | C12H13ONF6 | OCCNCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
|
AD12384 | 2.48 | 241.33 | C16H19ON | OCCNCCc1ccc(-c2ccccc2)cc1 |
|
AD12385 | 1.52 | 291.3 | C14H11N8 | Cc1ccc(-c2cn(-c3nc(N)c4c(n3)[N]C=N4)nn2)cc1 |
|
AD12386 | -1.46 | 322.21 | C10H15O8N2P | CC1C(CO)OC(n2ccc(=O)[nH]c2=O)C1OP(=O)(O)O |
|
AD12387 | -1.58 | 160.22 | C7H16O2N2 | NC1CC(CO)NCCC1O |
|
AD12388 | -1.05 | 354.33 | C16H19O6N2F | NC(=O)COC1OC(C(=O)NCCc2ccc(F)cc2)=CC(O)C1O |
|
AD12389 | 4.62 | 364.23 | C18H12N4Br | Brc1ccc(Nc2ncnc3c2C(c2ccccc2)=C[N]3)cc1 |
|
AD12390 | -0.83 | 177.17 | C6H7N7 | Nc1nc(N)c2ncnc(N)c2n1 |