0 B13R1.382 CCOC1=C(C(=O)OC)C=CC=C1 2623-1-3P [1,0,0,0,0,0|1,0,1]=3 1 B13R1.382 COC(=O)C1=CC=CC=C1N=C=S 8668-1-17 [1,0,0,0,0,0|0,1,2]=4 2 B13R1.589 CC(=O)NC1=CC=CC=C1[N+](=O)[O-] 4654-1-4C [1,0,0,0,0,0|1,0,1]=3 3 B13R1.589 CC(=O)OC1=C(C(=O)Cl)C=CC=C1 2616-5-02 [1,0,0,0,0,0|2,0,0]=3 4 B15R2.19309 COC(=O)C1=CC=CC2=C1NC(=O)C2 4H48-1-J2 [0,0,0,1,0,0|0,0,0]=1 5 B15R2.19309 COC(=O)C1=CC=CC2=NN(C)C=C12 4H23-1-N1 [0,0,0,1,0,0|3,0,0]=4 6 B15R2.39201 CC(=O)N1C=C(C=O)C2=CC=CC=C21 4H48-1-K1 [0,0,0,1,0,0|3,0,0]=4 7 B13R1.547 COC(=O)C1=CC=CC=C1B(O)O 6660-1-V8 [0,0,0,0,1,0|2,0,1]=4 8 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)O 2623-1-97 [0,0,0,0,1,0|1,0,0]=2 9 B12R1.75 COC1=CC=CC=C1CC(=O)O 2621-1-W5 [2,0,0,0,0,0|2,0,0]=4 10 B12R1.75 COC1=CC=CC=C1NC(N)=S 8667-1-X3 [2,0,0,0,0,0|1,1,0]=4 11 B12R1.75 COC1=CC=CC=C1OC(C)=O 2623-1-06 [2,0,0,0,0,0|1,0,0]=3 12 B12R1.77 CNC1=CC=CC=C1C(=O)OC 4H56-1-5G [2,0,0,0,0,0|0,0,0]=2 13 B12R1.77 COC(=O)C1=CC=CC=C1CN 4658-5-X3 [2,0,0,0,0,0|1,0,1]=4 14 B12R1.77 COC(=O)C1=CC=CC=C1OC 2623-1-2G [2,0,0,0,0,0|1,0,0]=3 15 B12R1.77 COC(=O)C1=CC=CN=C1OC 4H58-1-602 [2,0,0,0,0,0|2,0,0]=4 16 B12R1.77 COC(=O)C1=CN=CC=C1OC 4H56-1-2C [2,0,0,0,0,0|2,0,0]=4 17 B12R1.283 CCOC1=CC=CC=C1C(=O)O 2621-1-Y5 [2,0,0,0,0,0|1,0,1]=4 18 B12R1.283 CCOC1=CC=CC=C1C(C)=O 2617-1-07 [2,0,0,0,0,0|1,0,1]=4 19 B14R1.263 CCOC(=O)C1=CC=CC=C1N=C=O 4649-1-07 [1,1,0,0,0,0|0,0,2]=4 20 B14R1.164 CC(=O)NC1=C(C(=O)O)C=CC(F)=C1 4658-3-24 [1,1,0,0,0,0|0,0,0]=2 21 B14R1.815 CC(=O)NC1=CC=CC=C1S(C)(=O)=O 8663-1-Y5 [1,1,0,0,0,0|1,0,0]=3 22 B14R1.3302 O=C(CCl)NC1=C([N+](=O)[O-])C=CC=C1 4655-5-Y6 [1,1,0,0,0,0|1,0,1]=4 23 B14R1.6074 CC(=O)NC1=C(C(=O)O)C=C(F)C=C1 4658-3-25 [1,1,0,0,0,0|0,0,0]=2 24 B14R1.6074 CC(=O)NC1=C([N+](=O)[O-])C=C(F)C=C1 4655-3-32 [1,1,0,0,0,0|1,0,1]=4 25 B14R1.6312 CS(=O)(=O)NC1=CC=CC=C1C(=O)O 8669-1-60 [1,1,0,0,0,0|1,0,0]=3 26 B14R1.623 CCOC(=O)C1=CC=CC=C1C(C)=O 2629-1-W0 [0,1,0,0,1,0|0,0,0]=2 27 B14R1.623 O=C(O)C1=CC=CC=C1C(=O)OO[O-] 9612-1-00 [0,1,0,0,1,0|2,0,0]=4 28 B14R1.707 COC(=O)C1=C([N+](=O)[O-])C=CC(F)=C1 4654-3-22 [0,1,0,0,1,0|2,0,0]=4 29 B14R1.707 COC(=O)C1=CC(Br)=CC=C1[N+](=O)[O-] 2654-9-01 [0,1,0,0,1,0|2,0,0]=4 30 B14R1.707 COC(=O)C1=CC(C)=CC=C1[N+](=O)[O-] 4754-1-Y5 [0,1,0,0,1,0|2,0,0]=4 31 B14R1.707 COC(=O)C1=CC(O)=CC=C1[N+](=O)[O-] 4654-1-BC [0,1,0,0,1,0|2,0,0]=4 32 B14R1.745 COC(=O)C1=CC=CC=C1S(=O)(=O)Cl 6662-5-Y8 [0,1,0,0,1,0|2,0,0]=4 33 B14R1.1126 COC(=O)C1=C([N+](=O)[O-])C=C(F)C=C1 4654-3-Y6 [0,1,0,0,1,0|2,0,0]=4 34 B14R1.1126 COC(=O)C1=CC=C(Br)C=C1[N+](=O)[O-] 4654-9-66 [0,1,0,0,1,0|2,0,0]=4 35 B14R1.1153 COC(=O)C1=C([N+](=O)[O-])C(F)=CC=C1 4H54-3-12 [0,1,0,0,1,0|2,0,0]=4 36 B14R1.1153 COC(=O)C1=CC=CC(C)=C1[N+](=O)[O-] 4654-1-W1 [0,1,0,0,1,0|2,0,0]=4 37 B14R1.1153 COC(=O)C1=CC=CC(O)=C1[N+](=O)[O-] 4654-1-Y2 [0,1,0,0,1,0|2,0,0]=4 38 B14R1.1164 COC(=O)C1=C(C)C=CC=C1[N+](=O)[O-] 4754-1-02 [0,1,0,0,1,0|2,0,0]=4 39 B14R2.738 CC1CC(=O)NC2=CC=CC=C2N1 4H17-1-84 [1,0,0,1,0,0|2,0,0]=4 40 B14R2.287 O=C1CNC(=O)C2=C(C=CC=C2)N1 4H31-1-02 [1,0,0,1,0,0|1,0,0]=3 41 B14R2.10782 COC(=O)C1=C2NC=CC2=CC=C1 P311-A-05 [1,0,0,1,0,0|0,0,1]=3 42 B14R2.10782 COC(=O)C1=C2NN=CC2=CC=C1 4H23-1-10 [1,0,0,1,0,0|1,0,1]=4 43 B14R2.10782 COC(=O)C1=C2OC=NC2=CC=C1 4H58-1-HK [1,0,0,1,0,0|2,0,0]=4 44 B14R2.712 CC1=NC2=CC=CC(C(=O)O)=C2O1 4H21-1-Z3 [1,0,0,1,0,0|2,0,0]=4 45 B14R2.7724 CC1=CC(=O)C2=CC=CC=C2C1=O 2918-1-X1 [0,0,0,1,1,0|1,0,1]=4 46 B16R2.400351 CC(=O)C1=CN(C(C)=O)C2=CC=CC=C12 4H18-1-21 [0,1,0,1,0,0|2,0,0]=4 47 B12R1.261 CC(=O)C1=CC=CC=C1B(O)O 6660-1-Z0 [1,0,0,0,1,0|1,0,1]=4 48 B12R1.261 CC(=O)C1=CC=CC=C1[N+](=O)[O-] 4654-1-Z6 [1,0,0,0,1,0|1,0,1]=4 49 B12R1.261 NC(=O)C1=CC=CC=C1C(=O)O 4648-1-18 [1,0,0,0,1,0|1,0,0]=3 50 B12R1.261 O=C(O)C1=C(C(=O)O)C=CC=C1 2621-1-12 [1,0,0,0,1,0|1,0,0]=3 51 B12R1.261 O=C(O)C1=C(C(=O)O)C=NC=C1 4H21-1-A4 [1,0,0,0,1,0|2,0,0]=4 52 B12R1.261 O=C(O)C1=CC=CN=C1C(=O)O 4H58-1-CQ [1,0,0,0,1,0|2,0,0]=4 53 B14R1.4522 O=C(O)\C=C\C1=CC=CC=C1C(=O)O 2621-1-2N [1,0,0,0,0,1|2,0,0]=4