aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22121 | 0.74 | 311.06 | C4H12O9NP3 | C=CCNP(=O)(O)OP(=O)(O)OP(=O)(O)OC |
|
AD22122 | 2.3 | 208.24 | C13H10N3 | Nc1ccnc2c1C(c1ccccc1)=C[N]2 |
|
AD22123 | 1.97 | 222.25 | C9H8O2N3S | CCOC(=O)C1=C(c2cccs2)[N]N=N1 |
|
AD22124 | 2.81 | 300.34 | C14H11N5FS | CCCNc1nc(C#Cc2ccc(F)s2)nc2c1N=C[N]2 |
|
AD22125 | 2.75 | 254.37 | C15H26O3 | CC(=O)CCC(CC1C(=O)CCC1C)C(C)(C)O |
|
AD22126 | 2.6 | 260.27 | C13H14O3N3 | O=C(O)CCCCOc1ccc(C2=C[N]N=N2)cc1 |
|
AD22127 | 6.14 | 608.04 | C33H28O5N3F2Cl | Cc1c(-c2ccc3c(c2)OCCO3)cccc1C(F)(F)Oc1cc(OCc2ccnc(C#N)c2)c(CNCCO)cc1Cl |
|
AD22128 | 0.46 | 211.21 | C10H7N6 | Nc1ncnc2c1C(c1ccccn1)=N[N]2 |
|
AD22129 | 2.32 | 202.26 | C12H14ON2 | Cc1ccc(Cc2c(O)n[nH]c2C)cc1 |
|
AD22130 | 2.55 | 298.12 | C13H6N4Br | Brc1ccc(C#Cc2ncnc3c2N=C[N]3)cc1 |