aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17601 | 0.59 | 248.31 | C11H12ON4S | CCN1C(=O)C(=NNC(N)=S)c2ccccc21 |
|
AD17602 | 0.94 | 299.15 | C9H7ON4SBr | NC(=S)NN=C1C(=O)Nc2ccc(Br)cc21 |
|
AD17603 | 3.09 | 285.38 | C15H21N6 | C1=Nc2c(nc(NC3CCCC3)nc2NC2CCCC2)[N]1 |
|
AD17604 | 0.0 | 160.16 | C7H6N5 | Nc1cc(C2=CN=C[N]2)ncn1 |
|
AD17605 | 3.36 | 426.34 | C16H20O2N5SBr | Nc1nc(OCc2cc(Br)cs2)c2ncn(CCCCCCO)c2n1 |
|
AD17606 | 3.11 | 224.24 | C9H21O4P | CCCCCCCCOP(=O)(O)OC |
|
AD17607 | 4.58 | 250.38 | C16H26O2 | C=C(CCC=C(C)C)CCC=C(C)CC(=O)OC |
|
AD17608 | 10.28 | 588.91 | C37H64O5 | CCC=CCC=CCC=CCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC=CCCCCCC |
|
AD17609 | 4.66 | 488.71 | C30H48O5 | CC1C2OC(C)(C)C(O)C2(O)OC2CC3(C)C4CCC5C(C)(C)C(O)CCC56CC46CCC3(C)C21 |
|
AD17610 | 2.1 | 245.31 | C12H17N6 | Nc1nc2c(c(NC3CCCCCC3)n1)N=C[N]2 |