| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol7901 | CCc1ncc2ccccc2n1 | 2 | 3 |
| mol7902 | CCc1ncnc2ccccc12 | 2 | 3 |
| mol7903 | CCC1NC=Nc2ccccc21 | 2 | 2 |
| mol7904 | CCC1=Nc2ccccc2C(O)N1 | 2 | 2 |
| mol7905 | CCSc1ccc2cncnc2c1 | 2 | 3 |
| mol7906 | CCSc1ccc2c(c1)N=CNC2O | 2 | 2 |
| mol7907 | Fc1cccc2ncncc12 | 2 | 3 |
| mol7908 | Fc1ccc2ncncc2c1 | 2 | 3 |
| mol7909 | Fc1ccc2cncnc2c1 | 2 | 3 |
| mol7910 | OC1NC=Nc2cccc(F)c21 | 2 | 2 |
| mol7911 | OC1NC=Nc2ccc(F)cc21 | 2 | 2 |
| mol7912 | OC1NC=Nc2cc(F)ccc21 | 2 | 2 |
| mol7913 | CC1=Nc2ccc(F)cc2C(O)N1 | 2 | 2 |
| mol7914 | CC(C)c1ncc2ccccc2n1 | 2 | 3 |
| mol7915 | CC(C)c1ncnc2ccccc12 | 2 | 3 |
| mol7916 | COc1nc(C)c2ccccc2n1 | 2 | 3 |
| mol7917 | COc1ccc2cncnc2c1C | 2 | 3 |
| mol7918 | CNc1ncc2cc(OC)ccc2n1 | 2 | 4 |
| mol7919 | CNc1ncc2ccccc2n1 | 2 | 4 |
| mol7920 | CNc1nc(C)c2ccccc2n1 | 2 | 4 |