aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19951 | 0.0 | 70.09 | C4H6O | C#CCCO |
|
AD19952 | -0.54 | 98.09 | C2H4N5 | CNC1=NN=N[N]1 |
|
AD19953 | -2.65 | 840.08 | C38H73O8N13 | CCC(C)C(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)CNCCCCCN(C)CCC(N)C(=O)O)C(=O)NC(C)C(N)=O |
|
AD19954 | 2.69 | 247.34 | C14H21ON3 | CC(CCN1CCCc2nc(C)c(C)cc21)=NO |
|
AD19955 | 3.36 | 347.81 | C16H12O2N4ClS | O=S(=O)(c1ccccc1)N(CC1=C[N]N=N1)c1ccc(Cl)cc1 |
|
AD19956 | 2.74 | 277.35 | C14H15O3NS | Cc1cccc(O)c1-c1cccc(NS(C)(=O)=O)c1 |
|
AD19957 | 1.68 | 291.3 | C14H11N8 | CNc1nc(-n2cc(-c3ccncc3)cn2)nc2c1N=C[N]2 |
|
AD19958 | 3.6 | 420.55 | C24H36O6 | C=CCCC=CC=CC1CC(C)=CC(OC)CC2OC(O)(CC(=O)O1)CC(O)C2C |
|
AD19959 | -1.36 | 274.0 | CH9O10P3 | O=P(O)(CO)OP(=O)(O)O[PH](O)(O)O |
|
AD19960 | -2.22 | 364.49 | C18H32O2N6 | CN(C)CCC(N)C(=O)NCC#CC#CCNC(=O)C(N)CCN(C)C |