| Molecule ID | SMILES | Charge States | Microspecies |
|---|---|---|---|
| mol2381 | CCC(N)(CC)CC | 2 | 2 |
| mol2382 | CC(C)(C)CC(C)(C)N | 2 | 2 |
| mol2383 | NCCCCCCO | 2 | 2 |
| mol2384 | CCCCCCCN | 2 | 2 |
| mol2385 | CN[C@@H]1CCC[C@H]1O | 2 | 2 |
| mol2386 | CCCOc1cccc(C(=O)O)c1 | 2 | 2 |
| mol2387 | C[C@H]1CC[C@@H](O)[C@@H](N)C1 | 2 | 2 |
| mol2388 | CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1N | 2 | 2 |
| mol2389 | C[C@@H]1CCC[C@@H](N)C1 | 2 | 2 |
| mol2390 | CN(C)C1CCCCC1 | 2 | 2 |
| mol2391 | Cc1cc(Br)cc(C)c1N(C)C | 2 | 2 |
| mol2392 | CCN(c1ccccc1)C(C)(C)C | 2 | 2 |
| mol2393 | CCCCN(C)c1ccccc1 | 2 | 2 |
| mol2394 | Cc1ccccc1NC1CCCCC1 | 2 | 2 |
| mol2395 | c1ccc(NC2CCCC2)cc1 | 2 | 2 |
| mol2396 | Cc1c(Br)cc(N)cc1Br | 2 | 2 |
| mol2397 | CCN(CC)c1ccccc1C | 2 | 2 |
| mol2398 | CCN(CC)c1cccc(C)c1 | 2 | 2 |
| mol2399 | COc1cc(N)cc(OC)c1 | 2 | 2 |
| mol2400 | CNc1ccccc1C | 2 | 2 |