| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol14141 | NCCCCc1ccncc1 | 3 | 3 |
| mol14142 | NCCCCc1cccnc1 | 3 | 3 |
| mol14143 | NCCCCc1ccccn1 | 3 | 3 |
| mol14144 | CCc1c(C)nnc(C)c1C | 2 | 3 |
| mol14145 | NNCCCc1ccccc1 | 2 | 3 |
| mol14146 | CN(C)/C=N/c1ccccc1 | 2 | 2 |
| mol14147 | CCCCCCn1ccnc1 | 2 | 2 |
| mol14148 | NC(=S)Nc1cccc(Cl)c1 | 2 | 3 |
| mol14149 | NC(=S)Nc1ccc(Cl)cc1 | 2 | 3 |
| mol14150 | NC(=S)Nc1ccc(Br)cc1 | 2 | 3 |
| mol14151 | NC(=S)NCc1ccccc1 | 2 | 2 |
| mol14152 | CSC(=N)Nc1ccccc1 | 2 | 2 |
| mol14153 | O=C(O)c1nc[nH]c1C(=O)O | 5 | 8 |
| mol14154 | CC(=O)c1cc(C(C)=O)[nH]n1 | 2 | 2 |
| mol14155 | NC(=O)c1ccc(N)cc1O | 2 | 2 |
| mol14156 | O=NCC(=O)c1cccnc1 | 0 | 0 |
| mol14157 | O=NCC(=O)c1ccncc1 | 0 | 0 |
| mol14158 | ON=C1CCCCC/C1=N\O | 3 | 3 |
| mol14159 | O=N/C(=N/O)c1ccccc1 | 2 | 2 |
| mol14160 | ON=C(NO)c1ccccc1 | 3 | 4 |