aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40571 | 0.63 | 313.38 | C13H19O4N3S | CCOC(=O)C1CCN(S(=O)(=O)c2cccnc2N)CC1 |
|
AD40572 | 0.6 | 299.4 | C13H21O3N3S | CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1N |
|
AD40573 | -1.39 | 212.21 | C8H12O3N4 | CNC(=O)C(C)Nc1c[nH]c(=O)[nH]c1=O |
|
AD40574 | -1.57 | 213.19 | C8H11O4N3 | O=C(CCO)CNc1c[nH]c(=O)[nH]c1=O |
|
AD40575 | -2.0 | 227.22 | C9H13O4N3 | O=c1[nH]cc(N2CC(O)CC2CO)c(=O)[nH]1 |
|
AD40576 | -0.91 | 152.16 | C6H8ON4 | NC(=O)Cc1ccc(N)nn1 |
|
AD40577 | -1.29 | 224.22 | C9H12O3N4 | CC(=O)N1CC(Nc2c[nH]c(=O)[nH]c2=O)C1 |
|
AD40578 | 1.72 | 283.09 | C6H6O2NSI | COC(=O)c1sc(I)cc1N |
|
AD40579 | 0.75 | 289.38 | C16H23O2N3 | O=C(NCCc1ccccn1)C1COC2CCNCC2C1 |
|
AD40580 | 1.67 | 296.37 | C17H20ON4 | NC(=O)c1ccc(-c2cnc3n2CCC32CCNCC2)cc1 |