Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol12521 O=C(O)CSc1ccc(S)cc1 2 2
mol12522 O=C(O)CCCCC1CCSS1 2 2
mol12523 O=C(O)C(I)=Cc1ccccc1 2 2
mol12524 O=C(O)/C=C\c1cccc(Cl)c1 2 2
mol12525 O=C(O)/C=C\SC1CCCCC1 2 2
mol12526 O=C(O)/C=C/SC1CCCCC1 2 2
mol12527 O=C(O)C#CSc1ccccc1 2 2
mol12528 O=C(O)/C=C(\I)c1ccccc1 2 2
mol12529 C=C(SC1CCCCC1)C(=O)O 2 2
mol12530 O=C1C[C@H](C(=O)O)[C@@H](C(=O)O)O1 3 4
mol12531 O=C1C[C@@H](C(=O)O)[C@@H](C(=O)O)O1 3 4
mol12532 O=C1O[C@@H]([C@@H](O)CO)C(O)=C1O 4 8
mol12533 O=C1O[C@@H]([C@H](O)CO)C(O)=C1O 4 8
mol12534 CC(C)(C)Cc1ccc(O)cc1 2 2
mol12535 CCCc1cc(Cl)cc(Cl)c1O 2 2
mol12536 CCSC(=O)c1ccc(Cl)cc1 0 0
mol12537 CCSC(=O)c1cccc(Br)c1 0 0
mol12538 CCSC(=O)c1cccc(C)c1 0 0
mol12539 CCSC(=O)c1ccc(C)cc1 0 0
mol12540 C[S+](C)CC(=O)c1ccccc1 0 0