aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23191 | 4.08 | 425.57 | C19H21N8S2 | S=C=Nc1ccc(NC(=S)NCCCCCCNc2ncnc3c2N=C[N]3)cc1 |
|
AD23192 | 1.94 | 258.26 | C13H12O3N3 | CCOC(=O)C1=C(C(=O)c2ccc(C)cc2)[N]N=N1 |
|
AD23193 | 2.89 | 303.33 | C17H18O3NF | COc1cc(O)cc(-c2cccc(F)c2)c1CCNC(C)=O |
|
AD23194 | -0.01 | 530.67 | C24H46O7N6 | CC(C)CC(NC(=O)C(CCCCN)NC(=O)NC(C(=O)O)C(C)C)C(=O)NCCCNC(C)C(=O)O |
|
AD23195 | 1.47 | 203.25 | C11H13ON3 | COCc1cn(Cc2ccccc2)nn1 |
|
AD23196 | 1.18 | 291.31 | C14H17O4N3 | COCc1cn(CC(=O)OCc2cccc(OC)c2)nn1 |
|
AD23197 | 0.52 | 277.28 | C13H15O4N3 | COc1cccc(COC(=O)Cn2cc(CO)nn2)c1 |
|
AD23198 | 7.87 | 2447.17 | C121H121O32N19Cl4 | CNC(CC(C)C)C(=O)NC1Cc2ccc(c(Cl)c2)Oc2cc3cc(c2O)Oc2ccc(cc2Cl)C(O)C2NC(=O)C(NC(=O)C3NC(=O)C(CC(=O)O)NC1=O)c1ccc(O)c(c1)-c1c(O)cc(O)cc1C(C(=O)NCCCCCc1cn(CCCCNC(=O)C3NC(=O)C4NC(=O)C(NC(=O)C5NC(=O)C(CC(=O)O)NC(=O)C(NC(=O)C(CC(C)C)NC)Cc6ccc(c(Cl)c6)Oc6cc5cc(c6O)Oc5ccc(cc5Cl)C4O)c4ccc(O)c(c4)-c4c(O)cc(O)cc43)nn1)NC2=O |
|
AD23199 | 3.63 | 289.72 | C15H11N4FCl | CC(Nc1cc(Cl)nc2c1C=N[N]2)c1cccc(F)c1 |
|
AD23200 | 1.62 | 308.76 | C16H17O3N2Cl | CC(C#Cc1ccc(Cl)c(C(N)=O)c1)CCC(N)C(=O)O |