| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol25321 | Cn1nnc(CO)c1N | 2 | 4 |
| mol25322 | Cn1nc(N)c(CO)n1 | 2 | 4 |
| mol25323 | Cn1nnc([N+](=O)[O-])n1 | 2 | 6 |
| mol25324 | Cn1nnnc1[N+](=O)[O-] | 0 | 0 |
| mol25325 | O=[N+]([O-])c1n[nH]c(O)n1 | 2 | 3 |
| mol25326 | Cn1c(O)n[n+](C)c1O | 2 | 3 |
| mol25327 | CN1NC=C(CO)N1N | 2 | 5 |
| mol25328 | N#Cc1nc(N)[nH]c1C#N | 2 | 2 |
| mol25329 | N#Cc1nc(F)[nH]c1C#N | 2 | 2 |
| mol25330 | FC(F)(F)c1c[nH]cn1 | 3 | 3 |
| mol25331 | Clc1n[nH]c(Cl)n1 | 2 | 2 |
| mol25332 | CC(=O)c1c(C)c[nH]c1C | 0 | 0 |
| mol25333 | Cc1[nH]c(C=O)c(C)c1C | 0 | 0 |
| mol25334 | CCCc1[nH]ccc1CC | 0 | 0 |
| mol25335 | n1n[nH]c(-c2nnn[nH]2)n1 | 7 | 32 |
| mol25336 | Cc1csc[n+]1CC#N | 0 | 0 |
| mol25337 | C1CN[C@H](c2nnn[nH]2)C1 | 3 | 3 |
| mol25338 | CCCCn1cc[n+](C)c1 | 0 | 0 |
| mol25339 | Cc1cc(C)n(C(=O)O)n1 | 2 | 2 |
| mol25340 | CCc1c[nH]nc1[N+](=O)[O-] | 2 | 2 |