| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol10521 | COc1cccc(O)c1C#N | 2 | 2 |
| mol10522 | O=C(C=NO)c1ccccc1 | 2 | 2 |
| mol10523 | CC(=O)Nc1nc(=O)c2nccnc2[nH]1 | 2 | 2 |
| mol10524 | Cc1cccc(C(=O)O)c1Cl | 2 | 2 |
| mol10525 | Cc1ccc(C(=O)O)c(Cl)c1 | 2 | 2 |
| mol10526 | Cc1ccc(Cl)c(C(=O)O)c1 | 2 | 2 |
| mol10527 | Cc1cccc(Cl)c1C(=O)O | 2 | 2 |
| mol10528 | Cc1c(Cl)cccc1C(=O)O | 2 | 2 |
| mol10529 | Cc1ccc(C(=O)O)cc1Cl | 2 | 2 |
| mol10530 | Cc1ccc(Cl)cc1C(=O)O | 2 | 2 |
| mol10531 | Cc1cc(Cl)ccc1C(=O)O | 2 | 2 |
| mol10532 | Cc1cc(C(=O)O)ccc1Cl | 2 | 2 |
| mol10533 | Cc1cccc(C(=O)O)c1Br | 2 | 2 |
| mol10534 | Cc1ccc(C(=O)O)c(Br)c1 | 2 | 2 |
| mol10535 | Cc1ccc(Br)c(C(=O)O)c1 | 2 | 2 |
| mol10536 | Cc1cccc(Br)c1C(=O)O | 2 | 2 |
| mol10537 | Cc1c(Br)cccc1C(=O)O | 2 | 2 |
| mol10538 | Cc1ccc(C(=O)O)cc1Br | 2 | 2 |
| mol10539 | Cc1ccc(Br)cc1C(=O)O | 2 | 2 |
| mol10540 | Cc1cc(C(=O)O)ccc1Br | 2 | 2 |