aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21721 | 0.56 | 168.56 | C7H3ON3Cl | O=c1[nH]cnc2c1C(Cl)=C[N]2 |
|
AD21722 | 4.19 | 428.61 | C27H40O4 | CC1=C2C3(C)CCC4C(CC=C5CC(O)CCC54C)C3CC2(O)C(CC(C)CO)C1=O |
|
AD21723 | -0.95 | 300.19 | C9H11O6N2F3 | CC(C(=O)NCC(=O)O)N(CC(=O)O)C(=O)C(F)(F)F |
|
AD21724 | 2.47 | 205.3 | C13H19ON | CC(Cc1ccc(C(C)C)cc1)C(N)=O |
|
AD21725 | -1.17 | 396.4 | C18H24O8N2 | COc1ccc(CCNC(=O)C2=CC(O)C(O)C(OCC(N)=O)O2)cc1OC |
|
AD21726 | 5.09 | 373.22 | C20H12O2N3Cl2 | O=C(C=Cc1ccc(Cl)c(Cl)c1)c1ccc(OCC2=C[N]N=N2)cc1 |
|
AD21727 | 3.81 | 364.38 | C20H18O4N3 | COc1cc(C=CC(=O)c2ccc(OCC3=C[N]N=N3)cc2)cc(OC)c1 |
|
AD21728 | 1.09 | 131.17 | C6H13O2N | CCN(CC)C(=O)OC |
|
AD21729 | 2.51 | 692.7 | C26H50O13N2P2S | CCCCCCCCC1OC(=O)C(CSCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC)C1CO |
|
AD21730 | 1.59 | 269.68 | C13H6N6Cl | N#Cc1cc(C2=N[N]c3ncnc(N)c32)ccc1Cl |