aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18671 | -1.78 | 102.09 | C3H6O2N2 | NC(=O)CNC=O |
|
AD18672 | 1.65 | 167.21 | C9H13O2N | CCC(=O)N(C)Cc1ccco1 |
|
AD18673 | 0.82 | 193.99 | CH5O6FP2 | COP(=O)(O)OP(=O)(O)F |
|
AD18674 | -1.04 | 316.36 | C13H24O5N4 | CC(=O)NCc1cn(CCOCCOCCOCCO)nn1 |
|
AD18675 | 1.66 | 256.27 | C11H6ON5S | O=c1c2c(nc3[nH]c(-c4cccs4)cn13)[N]C=N2 |
|
AD18676 | 6.75 | 2537.25 | C124H127O35N19Cl4 | 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)NCCCCc1cn(CCOCCOCCOCCNC(=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 |
|
AD18677 | 5.66 | 344.88 | C22H25O2Cl | Clc1ccccc1Cc1ccc(OCCOC2CCCCC2)cc1 |
|
AD18678 | 2.43 | 264.44 | C15H24N2S | CSCCCCNCC1Cc2ccccc2CN1 |
|
AD18679 | 1.36 | 291.33 | C13H13O3N3S | CC(=NNC(N)=S)c1c(C)c2ccc(O)cc2oc1=O |
|
AD18680 | 2.53 | 332.31 | C17H16O7 | COc1cc(O)c2c(c1)OC(c1cc(O)c(O)c(OC)c1)CC2=O |