aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20951 | 0.62 | 266.3 | C13H18O4N2 | CN(CCC(N)C(=O)O)Cc1cccc(C(=O)O)c1 |
|
AD20952 | 2.36 | 264.31 | C15H14N5 | C1=Nc2c(ncnc2NC2CCc3ccccc3C2)[N]1 |
|
AD20953 | 10.23 | 672.06 | C40H78O5NF | CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)CCCCCCCCCCCCCCCCCCCC(=O)CF |
|
AD20954 | 1.06 | 210.22 | C11H8N5 | Nc1ncnc2c1C(c1ccccc1)=N[N]2 |
|
AD20955 | -0.21 | 545.54 | C27H31O11N | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(O)CO)CC3OC1CC(N)C(O)C(C)O1 |
|
AD20956 | 8.07 | 560.82 | C37H52O4 | CC1(C)CCC2(C(=O)OCc3ccccc3)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD20957 | -1.47 | 314.39 | C13H26O3N6 | N=C(N)NCCCC(NC(=O)CCCCCNC=O)C(N)=O |
|
AD20958 | 1.86 | 311.14 | C11H11O2N4Br | O=C(O)NCc1cn(Cc2ccc(Br)cc2)nn1 |
|
AD20959 | 3.86 | 267.33 | C17H17O2N | CCOc1ccc(Cc2c[nH]c3cccc(O)c23)cc1 |
|
AD20960 | 3.25 | 802.06 | C44H71O10N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)Cc2cccc3ccccc23)C(C)C(O)C1(C)O |