aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40441 | -1.53 | 169.14 | C6H7O3N3 | Cn1c(=O)[nH]c(N)c(C=O)c1=O |
|
AD40442 | -0.68 | 166.12 | C5H4O2N5 | Cn1c(=O)[nH]c2c(c1=O)N=N[N]2 |
|
AD40443 | -1.75 | 150.2 | C6H16O3N | [NH3+]CCOCCOCCO |
|
AD40444 | -5.96 | 293.41 | C12H31O3N5 | NC1C(O)C([NH3+])CC([NH3+])C1OC1OC(C[NH3+])CCC1[NH3+] |
|
AD40445 | 1.73 | 214.31 | C11H22O2N2 | CC1CCC(N)CN1C(=O)OC(C)(C)C |
|
AD40446 | 1.36 | 208.26 | C11H16O2N2 | NC(=O)c1ccc(CN2CCCCC2)o1 |
|
AD40447 | 0.68 | 366.16 | C8H9O2N5SI | CN(C)S(=O)(=O)Nc1ncnc2c1C(I)=C[N]2 |
|
AD40448 | 1.73 | 214.31 | C11H22O2N2 | CC(C)(C)OC(=O)N1CCCCC(N)C1 |
|
AD40449 | 0.07 | 338.11 | C6H5O2N5SI | NS(=O)(=O)Nc1ncnc2c1C(I)=C[N]2 |
|
AD40450 | 0.86 | 301.41 | C13H23O3N3S | CC(C)(C)OC(=O)N1CC(N)CC1C(=O)N1CCSC1 |