Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol11721 COC(=O)CC(C)(C(=O)O)c1ccc([N+](=O)[O-])cc1 2 2
mol11722 CC(CC(=O)O)(Cc1ccc([N+](=O)[O-])cc1)C(=O)O 3 4
mol11723 Cc1cccc2[nH]cc(CC(N)C(=O)O)c12 2 2
mol11724 COc1ccc2c(CC(N)C(=O)O)c[nH]c2c1 2 2
mol11725 Cn1c(=S)[nH]c2cc3c(cc21)CCCC3 2 2
mol11726 CCC(C(C)=O)C(=O)Nc1ccccc1 0 0
mol11727 CCNc1nc(C)c2nc(C(=O)O)c(=O)n(CC)c2n1 0 0
mol11728 CCOC(=O)[C-](C(=O)OCC)[n+]1ccccc1 2 2
mol11729 O=C(O)CCCC(=O)NOCc1ccccc1 3 3
mol11730 COC(=O)[C@H](Cc1ccc(O)c([N+](=O)[O-])c1)NC(=O)CN 2 2
mol11731 CN1C(=O)NC(=O)C(C)(C2=CCCCC2)C1=O 2 2
mol11732 CCC1(C2=CCCCC2)C(=O)NC(=O)NC1=O 2 2
mol11733 CC(C)(C)c1ccc([S+]([O-])CC(=O)O)cc1 2 2
mol11734 Cc1ncc(CO)c(C=N[C@H](C(=O)O)[C@@H](C)O)c1O 2 2
mol11735 CCNc1nc(C)c2c(n1)N(CC)C(O)=C(C(=O)O)N2 0 0
mol11736 CN(C)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O 2 5
mol11737 CC(=O)NCC(=O)NCC(=O)NC(Cc1c[nH]cn1)C(=O)O 4 5
mol11738 CC(=O)NCC(=O)NC(Cc1c[nH]cn1)C(=O)NCC(=O)O 3 3
mol11739 C=CCC1(C(C)CCC)C(=O)NC(=O)NC1=O 4 5
mol11740 C=C(C)CC1(CC(C)C)C(=O)NC(=O)NC1=O 2 2