0 B14R1.744 COC(=O)C1=CC=CC=C1CC(=O)O SC-91107 [0,0,0,0,0,0|2,0,0]=2 1 B13R1.589 CC(=O)NC1=CC=CC=C1C(C)=O SC-99892 [1,0,0,0,0,0|0,0,0]=1 2 B13R1.589 CC(=O)OC1=CC=CC=C1C(=O)O SC-15840 [1,0,0,0,0,0|1,0,0]=2 3 B13R1.589 CC(=O)OC1=CC=CC=C1C(=O)[O-] SC-52024 [1,0,0,0,0,0|1,0,1]=3 4 B13R1.589 CC(C)OC1=CC=CC=C1C(=O)O SC-48419 [1,0,0,0,0,0|2,0,1]=4 5 B13R1.589 O=C(O)CC1=C(C(=O)O)C=CC=C1 SC-62928 [1,0,0,0,0,0|2,0,0]=3 6 B15R1.3847 COC(=O)CC1=CC=CC=C1C(=O)OC SC-87210 [0,1,0,0,0,0|1,0,0]=2 7 B15R2.19309 COC(=O)C1=CC=CC2=C1CC(=O)N2 SC-07283 [0,0,0,1,0,0|2,0,0]=3 8 B15R2.19309 COC(=O)C1=CC=CC2=C1NC(=O)C2 SC-32080 [0,0,0,1,0,0|0,0,0]=1 9 B13R1.547 COC(=O)C1=C(C(=O)O)C=CN=C1 SC-34934 [0,0,0,0,1,0|2,0,0]=3 10 B13R1.547 COC(=O)C1=C(C(=O)O)C=NC=C1 SC-34248 [0,0,0,0,1,0|2,0,0]=3 11 B13R1.547 COC(=O)C1=CC=CC=C1B(O)O SC-27028 [0,0,0,0,1,0|2,0,1]=4 12 B13R1.547 COC(=O)C1=CC=CC=C1N(C)C SC-28708 [0,0,0,0,1,0|2,0,0]=3 13 B13R1.547 COC(=O)C1=CC=CN=C1C(=O)O SC-26366 [0,0,0,0,1,0|2,0,0]=3 14 B13R1.547 COC(=O)C1=CC=NC=C1[N+](=O)[O-] SC-92959 [0,0,0,0,1,0|3,0,0]=4 15 B13R1.547 O=C(O)C1=C(C(=O)CBr)C=CC=C1 SC-17114 [0,0,0,0,1,0|3,0,0]=4 16 B13R1.547 O=C(O)C1=CC=CC=C1C(=O)OO SC-69883 [0,0,0,0,1,0|2,0,0]=3 17 B13R1.547 O=C([O-])C1=CC=CC=C1C(=O)O[O-] SC-88060 [0,0,0,0,1,0|2,0,0]=3 18 B15R1.985 COC(=O)C1=CC=CC=C1CCC(=O)O SC-99891 [0,0,0,0,0,1|2,0,0]=3 19 B12R1.75 CC(=O)NC1=CC=CC=C1C=O SC-20821 [2,0,0,0,0,0|0,0,0]=2 20 B12R1.75 COC1=CC=CC=C1NC(C)=O SC-47661 [2,0,0,0,0,0|0,0,0]=2 21 B12R1.77 COC(=O)C1=C(C=O)C=CC=C1 SC-65394 [2,0,0,0,0,0|0,0,0]=2 22 B12R1.77 COC(=O)C1=C(OC)C=CN=C1 SC-66215 [2,0,0,0,0,0|2,0,0]=4 23 B12R1.77 COC(=O)C1=CC=CC=C1C#N SC-27895 [2,0,0,0,0,0|1,0,1]=4 24 B12R1.77 COC(=O)C1=CC=CC=C1CO SC-53546 [2,0,0,0,0,0|0,0,2]=4 25 B14R1.263 CCOC(=O)C1=CC=CC=C1OCC SC-75553 [1,1,0,0,0,0|1,0,1]=4 26 B14R1.746 COC(=O)C1=CC=CC=C1C(=O)OC SC-79614 [1,1,0,0,0,0|2,0,0]=4 27 B14R1.429 CC(=O)C1=CC=CC=C1[C@@H](O)C(=O)O SC-04925 [1,1,0,0,0,0|2,0,0]=4 28 B14R1.4926 O=C(O)NC1=CC=CC(Cl)=C1C(=O)O SC-16091 [1,1,0,0,0,0|1,0,0]=3 29 B14R1.623 CCOC(=O)C1=CC=CC=C1C(=O)O SC-13032 [0,1,0,0,1,0|1,0,0]=3 30 B14R1.623 CCOC(=O)C1=CC=CC=C1C(C)=O SC-A2115 [0,1,0,0,1,0|0,0,0]=2 31 B14R1.707 COC(=O)C1=C([N+](=O)[O-])C=CC(Cl)=C1 SC-04944 [0,1,0,0,1,0|2,0,0]=4 32 B14R1.707 COC(=O)C1=CC(Br)=CC=C1[N+](=O)[O-] SC-21606 [0,1,0,0,1,0|2,0,0]=4 33 B14R1.707 COC(=O)C1=CC(F)=CC=C1[N+](=O)[O-] SC-47360 [0,1,0,0,1,0|2,0,0]=4 34 B14R1.745 COC(=O)C1=CC=CC=C1S(=O)(=O)Cl SC-86360 [0,1,0,0,1,0|2,0,0]=4 35 B14R1.1126 COC(=O)C1=CC=C(Br)C=C1[N+](=O)[O-] SC-02753 [0,1,0,0,1,0|2,0,0]=4 36 B14R1.1153 COC(=O)C1=C([N+](=O)[O-])C(C)=CC=C1 SC-17986 [0,1,0,0,1,0|2,0,0]=4 37 B14R1.1153 COC(=O)C1=CC=CC(F)=C1[N+](=O)[O-] SC-99800 [0,1,0,0,1,0|2,0,0]=4 38 B14R1.1153 COC(=O)C1=CC=CC(O)=C1[N+](=O)[O-] SC-25375 [0,1,0,0,1,0|2,0,0]=4 39 B14R1.1164 COC(=O)C1=C([N+](=O)[O-])C=CC=C1C SC-83397 [0,1,0,0,1,0|2,0,0]=4 40 B14R2.31359 CC(=O)N1CCCC2=C1C=CC=C2 SC-89441 [1,0,0,1,0,0|1,0,1]=4 41 B14R2.10782 COC(=O)C1=C2C=COC2=CC=C1 SC-91145 [1,0,0,1,0,0|1,0,1]=4 42 B14R2.712 O=C1CC2=C(C=CC=C2C(=O)O)N1 SC-95928 [1,0,0,1,0,0|2,0,0]=4 43 B14R2.712 O=C1CC2=C(N1)C([N+](=O)[O-])=CC=C2 SC-02900 [1,0,0,1,0,0|1,0,1]=4 44 B14R2.25733 CC(=O)N1CC(=O)C2=CC=CC=C21 SC-45806 [1,0,0,1,0,0|0,0,0]=2 45 B14R2.25733 O=C1OC(C(=O)O)C2=CC=CC=C12 SC-61440 [1,0,0,1,0,0|2,0,0]=4 46 B16R2.16076 CC(=O)NC1=CC=CC2=C1C(=O)OC2=O SC-26598 [0,1,0,1,0,0|0,0,1]=3 47 B12R1.261 CC(=O)C1=C(C(=O)O)C=CC=N1 SC-76584 [1,0,0,0,1,0|1,0,0]=3 48 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)O SC-43953 [1,0,0,0,1,0|0,0,0]=2 49 B12R1.261 CC(C)C1=CC=CC=C1C(=O)O SC-28788 [1,0,0,0,1,0|1,0,1]=4 50 B12R1.261 CN(C)C1=CC=CC=C1C(=O)O SC-73720 [1,0,0,0,1,0|2,0,0]=4 51 B12R1.261 O=C(Cl)C1=CC=CC=C1C(=O)Cl SC-74441 [1,0,0,0,1,0|2,0,0]=4 52 B12R1.261 O=C(O)C1=C(C(=O)O)C=NC=C1 SC-04791 [1,0,0,0,1,0|2,0,0]=4 53 B12R1.261 O=C(O)C1=CC=CC=C1C(=O)O SC-74953 [1,0,0,0,1,0|1,0,0]=3 54 B12R1.261 O=C(O)C1=CC=CC=C1I(=O)=O SC-25019 [1,0,0,0,1,0|2,0,0]=4 55 B12R1.261 O=C(O)C1=CC=CC=C1I(=O)=O SC-25465 [1,0,0,0,1,0|2,0,0]=4 56 B14R1.4522 CC(=O)C1=CC=CC=C1OCC(=O)O SC-20641 [1,0,0,0,0,1|2,0,0]=4 57 B14R1.733 CC(=O)NC1=CC(C(=O)CBr)=CC=C1 SC-97621 [0,0,0,0,1,1|2,0,0]=4