aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03101 | -1.35 | 697.83 | C31H55O9N9 | CCCCCCN1C(=O)C(CO)N(CCCNC(=O)C(NC(=O)C(NC(=O)NC(C(=O)O)C(C)C)C2CCN=C(N)N2)C(O)C(C)C)C1=O |
|
AD03102 | 1.5 | 158.25 | C8H18ON2 | CCCCCCNC(=O)NC |
|
AD03103 | 1.13 | 268.32 | C14H16N6 | Cn1cc(Cc2cccc(Cc3cn(C)nn3)c2)nn1 |
|
AD03104 | 2.04 | 183.3 | C10H15OS | CO[S+](C)CCc1ccccc1 |
|
AD03105 | -0.15 | 220.19 | C9H8O3N4 | O=C(O)c1cncc(-n2cc(CO)nn2)c1 |
|
AD03106 | 5.53 | 1452.37 | C75H76O18N10Cl2 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NCc4ccc(-c5ccc(Cl)cc5)cc4)c4cc(O)cc(O)c4-c4cc3ccc4O)C(OC3CC(C)(N)C(O)C(C)O3)c3ccc(cc3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD03107 | 3.67 | 277.32 | C18H15O2N | Oc1ccc(C(c2ccc(O)cc2)c2ccccn2)cc1 |
|
AD03108 | -0.31 | 225.15 | C7H9O5NF2 | O=C(O)CCC(NC(=O)C(F)F)C(=O)O |
|
AD03109 | 5.54 | 449.66 | C23H52O3N3P | CCCCCCCCCCCCCCOP(=O)(CCN(CCCN)CCCN)OC |
|
AD03110 | 2.3 | 141.26 | C9H19N | CC(N)CC1CCCCC1 |