aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04311 | 3.59 | 327.8 | C17H16N6Cl | Clc1nc2c(c(NN3CCCCC3c3ccccc3)n1)N=C[N]2 |
|
AD04312 | 1.73 | 159.19 | C10H9ON | OCc1ccc2ccccc2n1 |
|
AD04313 | 2.54 | 282.34 | C17H18O2N2 | CNC(=O)c1ccccc1C(=O)NC(C)c1ccccc1 |
|
AD04314 | 0.21 | 120.24 | C5H14NS | C[S+](C)CCCN |
|
AD04315 | 3.12 | 194.22 | C12H8N3 | C1=C(c2cccc3ccccc23)N=N[N]1 |
|
AD04316 | 4.39 | 464.55 | C24H24O4N4S | CCCS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3c(C(N)=O)cccc23)c(OC)c1 |
|
AD04317 | 2.43 | 271.71 | C15H10ON3Cl | Nn1c(-c2ccccc2Cl)nc2ccccc2c1=O |
|
AD04318 | 3.32 | 389.46 | C23H23O3N3 | CN(C)CCN1C(=O)c2cccc3cc(NCc4ccccc4O)cc(c23)C1=O |
|
AD04319 | 2.25 | 651.89 | C35H61O8N3 | CC1CC(N(C)C)C(O)C(OC2C(C)C(O)C(C)C(=O)OC(COCc3ccccc3)CN(C)CC(C)C(N)C(C)CC2(C)O)O1 |
|
AD04320 | 3.2 | 264.16 | C10H11O4F2P | COP1(=O)OCCC(c2cccc(F)c2F)O1 |