| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol25901 | O=C(c1ccccc1)n1ccnc1 | 2 | 3 |
| mol25902 | C[n+]1ccn(Cc2ccccc2)c1 | 0 | 0 |
| mol25903 | O=C(O)c1ccc(CS)s1 | 0 | 0 |
| mol25904 | CSc1ccc(C(=O)O)s1 | 2 | 2 |
| mol25905 | CSc1ccsc1C(=O)O | 2 | 2 |
| mol25906 | Cc1ccc(-c2nnn(C)n2)cc1 | 2 | 4 |
| mol25907 | Cc1ccccc1-c1nnn(C)n1 | 2 | 4 |
| mol25908 | Cc1ccc(-c2nnnn2C)cc1 | 2 | 4 |
| mol25909 | Cc1cccc(-c2nnnn2C)c1 | 2 | 4 |
| mol25910 | Cc1cccc(-c2nnn(C)n2)c1 | 2 | 4 |
| mol25911 | Cc1cccc(Nc2nnn[nH]2)c1 | 2 | 2 |
| mol25912 | Cc1ccc(Nc2nnn[nH]2)cc1 | 2 | 2 |
| mol25913 | c1ccc(CNc2nnn[nH]2)cc1 | 0 | 0 |
| mol25914 | Cc1ccccc1Nc1nnn[nH]1 | 2 | 2 |
| mol25915 | Cc1ccc(-n2nnnc2N)cc1 | 0 | 0 |
| mol25916 | Cc1ccc(-n2nn[nH]c2=O)cc1 | 0 | 0 |
| mol25917 | Nc1cccc(-n2nnnc2N)c1 | 0 | 0 |
| mol25918 | Nc1ccc(-n2nnnc2N)cc1 | 0 | 0 |
| mol25919 | Nc1cccc(Nc2nnn[nH]2)c1 | 0 | 0 |
| mol25920 | Nc1ccc(Nc2nnn[nH]2)cc1 | 0 | 0 |