| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol25261 | CCCn1ccnc1 | 2 | 2 |
| mol25262 | O=C(O)C1=NCC=C1 | 2 | 2 |
| mol25263 | CCn1cc[n+](C)c1 | 0 | 0 |
| mol25264 | O=C(O)n1cccn1 | 2 | 2 |
| mol25265 | COc1cc(C)n[nH]1 | 2 | 2 |
| mol25266 | Cc1cc(O)n(C)n1 | 3 | 3 |
| mol25267 | Cc1[nH]nc(O)c1C | 2 | 2 |
| mol25268 | Cc1cnn(C)c1O | 2 | 2 |
| mol25269 | O=[N+]([O-])n1cccn1 | 2 | 1 |
| mol25270 | O=[N+]([O-])c1cc[nH]n1 | 3 | 3 |
| mol25271 | C/N=C1\C=CSC1 | 2 | 2 |
| mol25272 | NC(=O)c1nnn[nH]1 | 2 | 2 |
| mol25273 | CC1=NOC(=O)C1C | 0 | 0 |
| mol25274 | Cn1nnnc1CN | 2 | 4 |
| mol25275 | C/[O+]=C1\C=CSC1 | 0 | 0 |
| mol25276 | O=[N+]([O-])c1nc[nH]n1 | 3 | 4 |
| mol25277 | O=[N+]([O-])c1c[nH]nn1 | 0 | 0 |
| mol25278 | N=C1CSC=C1N | 2 | 2 |
| mol25279 | CC1=NC(=N)SC1 | 2 | 3 |
| mol25280 | Cc1csc(N)n1 | 2 | 3 |