Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol20541 CCCCCCCOc1cc(N)ccc1C(=O)O 2 3
mol20542 CCCCCCCCOc1cc(N)ccc1C(=O)O 2 3
mol20543 C=CCOc1cc(N)ccc1C(=O)O 2 3
mol20544 Nc1ccc(C(=O)O)cc1F 2 2
mol20545 Nc1ccc(C(=O)O)cc1Cl 2 2
mol20546 Nc1ccc(C(=O)O)cc1I 2 2
mol20547 Nc1ccc(C(=O)O)cc1O 2 3
mol20548 Nc1ccc(C(=O)O)cc1[N+](=O)[O-] 3 3
mol20549 N#CSc1cc(C(=O)O)ccc1N 2 2
mol20550 CCCCCCOc1cc(C(=O)O)ccc1N 2 3
mol20551 Nc1ccc(C(=O)O)cc1C(=O)c1ccccc1 2 2
mol20552 N#Cc1ccc(C(=O)Nc2ccc(F)c([C@@]3(CF)N=C(N)OCC3(F)F)c2)nc1 2 3
mol20553 C[C@]1(c2cc(NC(=O)c3ccc(C#N)cn3)ccc2F)N=C(N)O[C@@H](C(F)(F)F)[C@@H]1F 2 2
mol20554 C[C@]1(c2cc(NC(=O)c3ccc(C#N)cn3)ccc2F)N=C(N)O[C@H](C(F)(F)F)[C@@H]1F 2 2
mol20555 N#Cc1ccc(C(=O)Nc2ccc(F)c([C@]3(CF)C[C@@H](C(F)(F)F)OC(N)=N3)c2)nc1 2 2
mol20556 N#Cc1ccc(C(=O)Nc2ccc(F)c([C@@]3(CF)N=C(N)OC[C@@H]3F)c2)nc1 2 2
mol20557 C[C@@]1(c2cc(NC(=O)c3ccc(C#N)cn3)ccc2F)C[C@@H](C(F)(F)F)OC(N)=N1 2 2
mol20558 C[C@@]1(c2cc(NC(=O)c3ccc(C#N)cn3)ccc2F)C[C@H](C(F)(F)F)OC(N)=N1 2 2
mol20559 N#Cc1ccc(C(=O)Nc2ccc(F)c([C@]3(C(F)F)CCOC(N)=N3)c2)nc1 2 2
mol20560 C[C@]1(c2cc(NC(=O)c3ccc(C#N)cn3)ccc2F)N=C(N)OC[C@H]1F 2 2