aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11121 | 0.18 | 122.13 | C6H6ON2 | NC(=O)c1ccncc1 |
|
AD11122 | -0.19 | 191.02 | CH7O6NP2 | COP(=O)(O)OP(N)(=O)O |
|
AD11123 | 0.34 | 208.0 | CH6O8P2 | COP(=O)(O)OP(=O)(O)OO |
|
AD11124 | 2.06 | 194.23 | C11H14O3 | COCC=Cc1ccc(O)c(OC)c1 |
|
AD11125 | 3.58 | 820.99 | C40H67O10N4F3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)Nc2ccc(C(F)(F)F)cc2)C(C)C(O)C1(C)O |
|
AD11126 | 2.91 | 835.12 | C42H70O9N6S | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=S)Nc2ccc(-n3cccn3)cc2)C(C)C(O)C1(C)O |
|
AD11127 | 2.13 | 827.1 | C41H70O11N4S | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=S)NCc2ccc3c(c2)OCO3)C(C)C(O)C1(C)O |
|
AD11128 | 2.67 | 205.3 | C13H19ON | CCC(CC(N)=O)c1ccc(C)c(C)c1 |
|
AD11129 | 2.65 | 219.33 | C14H21ON | CC(Cc1ccc(C(C)(C)C)cc1)C(N)=O |
|
AD11130 | 2.76 | 250.34 | C15H22O3 | CC(=CO)C1CC2(C)C(=CC1=O)C(O)CCC2C |