Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol13441 CC[C@]1(O)C[C@H](C)N[C@@H]2CCCC[C@H]21 2 2
mol13442 CC[C@]1(O)C[C@@H](C)N[C@@H]2CCCC[C@H]21 2 2
mol13443 CC[C@]1(O)C[C@@H](C)N[C@H]2CCCC[C@@H]21 2 2
mol13444 CCC[n+]1cccc2cc(O)ccc21 2 2
mol13445 CCC[n+]1cccc2c(O)cccc21 2 2
mol13446 Oc1ccc(Cl)cc1CN1CCCC1 3 4
mol13447 OCC[n+]1cc(Br)c2ccccc2c1 0 0
mol13448 O=C1NC(=O)C(c2ccccc2)C1=O 2 3
mol13449 COC(=O)[C@@H]1[C@@H](O)C[C@H]2CC[C@@H]1N2C 2 2
mol13450 COC(=O)[C@@H]1[C@H](O)C[C@@H]2CC[C@H]1N2C 2 2
mol13451 O=[N+]([O-])c1ccc2c(O)cccc2c1 2 2
mol13452 O=[N+]([O-])c1ccc2ccc(O)cc2c1 2 2
mol13453 O=C1CCc2ccc([N+](=O)[O-])cc2C1 0 0
mol13454 O=[N+]([O-])c1ccc2cc(O)ccc2c1 2 2
mol13455 O=C1CCc2cc([N+](=O)[O-])ccc2C1 0 0
mol13456 NC(Cc1ccccc1)c1nnn[nH]1 3 6
mol13457 COC(=O)Nc1ncnc2nc[nH]c12 4 6
mol13458 O=[N+]([O-])c1cccc(-c2nnn[nH]2)c1 3 5
mol13459 O=[N+]([O-])c1ccc(-c2nnn[nH]2)cc1 4 8
mol13460 O=[N+]([O-])c1ccc(-n2cnnn2)cc1 2 5