| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol4881 | NN=Cc1ncnc2nc[nH]c12 | 3 | 7 |
| mol4882 | Oc1ncnc2nc[nH]c12 | 4 | 7 |
| mol4883 | Oc1nc2ncncc2[nH]1 | 4 | 7 |
| mol4884 | N=C(NO)c1ncnc2nc[nH]c12 | 4 | 8 |
| mol4885 | ONc1ncnc2nc[nH]c12 | 4 | 7 |
| mol4886 | Cn1cnc2cnc(O)nc21 | 2 | 2 |
| mol4887 | Cn1cnc2c(O)ncnc21 | 4 | 8 |
| mol4888 | Cn1c(O)nc2ncncc21 | 3 | 5 |
| mol4889 | OCc1nc2ncncc2[nH]1 | 3 | 5 |
| mol4890 | Cn1c(O)nc2cncnc21 | 0 | 0 |
| mol4891 | Oc1nc(C(F)(F)F)nc2nc[nH]c12 | 4 | 7 |
| mol4892 | Cn1c(S)nc2cncnc21 | 2 | 2 |
| mol4893 | COc1ncc2[nH]cnc2n1 | 3 | 5 |
| mol4894 | COc1ncnc2nc[nH]c12 | 3 | 5 |
| mol4895 | COc1nc2ncncc2[nH]1 | 3 | 5 |
| mol4896 | Cc1ncnc2nc[nH]c12 | 3 | 5 |
| mol4897 | Cn1cnc2ncncc21 | 2 | 4 |
| mol4898 | Cc1nc2ncncc2[nH]1 | 3 | 5 |
| mol4899 | Cn1cnc2cncnc21 | 2 | 4 |
| mol4900 | CNc1nc2ncncc2[nH]1 | 3 | 6 |