aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06941 | 4.17 | 210.32 | C16H18 | Cc1cccc(CCCc2ccccc2)c1 |
|
AD06942 | -2.16 | 170.08 | C4H2O4N4 | O=c1[nH]c(=O)c2c(no[n+]2[O-])[nH]1 |
|
AD06943 | 4.3 | 434.66 | C27H46O4 | CC(C)CCC(O)C(C)C1C(O)CC2C3CC=C4CC(O)CC(O)C4(C)C3CCC21C |
|
AD06944 | 4.25 | 308.36 | C17H12O2N2S | Oc1c(Cc2nnc(-c3ccco3)s2)ccc2ccccc12 |
|
AD06945 | 5.81 | 594.39 | C21H21O2N3F13 | CC(C)(C[NH])[N+]([O-])=Cc1ccc(CNC(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1 |
|
AD06946 | 1.53 | 462.42 | C23H18O7N4 | O=C1c2c(c3c4cc(O)cc(O)c4[nH]c3c3[nH]c4cc(O)ccc4c23)C(=O)N1NC(CO)CO |
|
AD06947 | -6.0 | 644.54 | C23H36O19N2 | CC(=O)NC1C(O)CC(OC(C(O)CO)C2OC(O)(C(=O)O)CC(O)C2NC(=O)O)(C(=O)O)OC1C(O)C(O)COC(C)=O |
|
AD06948 | 11.12 | 594.02 | C38H75O3N | CCCCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CCCCCCCCCCCCCCCCC |
|
AD06949 | 5.23 | 485.61 | C28H33O2N6 | CC(C)(C)c1cc(C(=O)NCc2ccc(CNc3ncnc4c3N=C[N]4)cc2)cc(C(C)(C)C)c1O |
|
AD06950 | 5.0 | 472.71 | C30H48O4 | CC1(C)CCC2(CO)C(O)CC3(C)C(=CC=C4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1 |