aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12001 | 6.66 | 484.72 | C31H48O4 | C=C(C(=O)CC(C)C1CCC2(C)C3CCC4C(C)(C(=O)O)C(O)CCC45CC35CCC12C)C(C)C |
|
AD12002 | 0.26 | 141.17 | C6H11ON3 | CCC(O)c1cn(C)nn1 |
|
AD12003 | 2.0 | 314.35 | C14H12O2N5S | Nc1nc(SCCc2ccc(C(=O)O)cc2)nc2c1N=C[N]2 |
|
AD12004 | 1.96 | 214.86 | C5N2Cl2Br | ClC1=C(Cl)N=C(Br)[N]1 |
|
AD12005 | 9.09 | 641.94 | C41H59O3N3 | Cc1ccc(-n2cc(COC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(O)C(C)(C)C6CCC5(C)C3(C)CC4)nn2)c(C)c1 |
|
AD12006 | 2.99 | 216.65 | C12H7N3Cl | Cc1ncnc2c1-c1cc(Cl)ccc1[N]2 |
|
AD12007 | 1.24 | 201.21 | C10H9ON4 | O=C(NCC1=C[N]N=N1)c1ccccc1 |
|
AD12008 | 6.34 | 507.95 | C21H42O8P2Cl | CCCCCCCCCCCCCCCCOCC(Cl)COP(=O)([O-])OP(=O)(O)OC |
|
AD12009 | 1.78 | 604.78 | C30H56O10N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OC)CC(C)C(=NO)C(C)C(O)C1(C)O |
|
AD12010 | 2.39 | 424.51 | C20H22O2N7S | CN(C)c1cccc2c(S(=O)(=O)NCCCNc3ncnc4c3N=C[N]4)cccc12 |