0 B13R1.464 CCOC(=O)C1=C(C#N)N=CC=C1 OR301301 [1,0,0,0,0,0|2,0,1]=4 1 B13R1.464 CCOC(=O)C1=C(CN)N=CC=C1 OR301303 [1,0,0,0,0,0|2,0,1]=4 2 B13R1.464 CCOC(=O)C1=NC=CC=C1C=O OR303904 [1,0,0,0,0,0|1,0,0]=2 3 B13R1.547 CCS(=O)C1=C(B(O)O)C=CC=C1 OR360406 [1,0,0,0,0,0|2,0,1]=4 4 B13R1.547 CNC(=O)C1=C(B(O)O)C=CC=C1 OR361431 [1,0,0,0,0,0|2,0,1]=4 5 B13R1.547 COC(=O)C1=CC=CC=C1C(C)C OR470473 [1,0,0,0,0,0|2,0,1]=4 6 B13R1.547 COC(=O)C1=CC=CC=C1C(F)F PC520720 [1,0,0,0,0,0|2,0,1]=4 7 B13R1.547 COC(=O)C1=CC=CC=C1C(N)=O OR470151 [1,0,0,0,0,0|1,0,0]=2 8 B13R1.547 COC(=O)C1=NC=CC=C1[N+](=O)[O-] OR470250 [1,0,0,0,0,0|2,0,1]=4 9 B13R1.547 O=C(O)C1=C(C(=O)CBr)C=CC=C1 OR400155 [1,0,0,0,0,0|1,0,0]=2 10 B13R1.572 CCCOC1=CC=CC=C1C(=O)O OR350317 [1,0,0,0,0,0|2,0,0]=3 11 B13R1.572 CCOCC1=C(B(O)O)C=CC=C1 OR361200 [1,0,0,0,0,0|1,0,2]=4 12 B15R1.765 CCOC(=O)C1=C(B(O)O)C=CC(F)=C1 PC412392 [0,1,0,0,0,0|1,0,1]=3 13 B15R1.765 CCOC(=O)C1=CC(C)=CC=C1[N+](=O)[O-] OR21122 [0,1,0,0,0,0|1,0,1]=3 14 B15R1.811 CCOC(=O)C1=C(C(F)(F)F)C=CC=C1 PC3286 [0,1,0,0,0,0|2,0,1]=4 15 B15R1.811 CCOC(=O)C1=C(S(C)(=O)=O)N=CC=C1 OR470054 [0,1,0,0,0,0|2,0,1]=4 16 B15R1.811 CCOC(=O)C1=CC=CC=C1[B-](F)(F)F PC1768 [0,1,0,0,0,0|3,0,0]=4 17 B15R1.811 CCOC(=O)C1=NC=CC=C1S(C)(=O)=O OR470164 [0,1,0,0,0,0|2,0,1]=4 18 B15R1.10569 CCOC(=O)C1=CC=C(F)C=C1B(O)O PC3438 [0,1,0,0,0,0|1,0,1]=3 19 B15R1.10602 CCOC(=O)C1=C([N+](=O)[O-])C(C)=CC=C1 OR110352 [0,1,0,0,0,0|1,0,1]=3 20 B13R1.467 CCOC(=O)C1=C(B(O)O)C=CO1 OR360402 [0,0,0,0,1,0|2,0,1]=4 21 B12R1.77 C#CC1=CC=CC=C1C(=O)OC OR400248 [2,0,0,0,0,0|1,0,1]=4 22 B12R1.77 CNC(=O)C1=C(CO)C=CC=C1 OR470601 [2,0,0,0,0,0|1,0,1]=4 23 B12R1.77 COC(=O)C1=NC=CC=C1C=O OR302202 [2,0,0,0,0,0|1,0,0]=3 24 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 PC3210 [2,0,0,0,0,0|1,0,0]=3 25 B12R1.308 CCOC(=O)C1=NC=CC=C1Br OR470685 [2,0,0,0,0,0|2,0,0]=4 26 B12R1.308 CCOC(=O)C1=NC=CC=C1Cl OR303770 [2,0,0,0,0,0|2,0,0]=4 27 B12R1.308 CCOC(=O)C1=NC=CC=C1F PC200030 [2,0,0,0,0,0|2,0,0]=4 28 B12R1.261 CN(C)C1=C(C(=O)O)C=CC=C1 OR400613 [2,0,0,0,0,0|2,0,0]=4 29 B12R1.261 NC(=O)C1=CC=CC=C1C(=O)O OR200083 [2,0,0,0,0,0|1,0,0]=3 30 B12R1.283 CCSC1=NC=CC=C1C(=O)O OR21410 [2,0,0,0,0,0|1,1,0]=4 31 B14R1.263 CCOC(=O)C1=CC=CC=C1N=C=O OR322234 [1,1,0,0,0,0|0,0,1]=3 32 B14R1.263 CCOC(=O)C1=CC=CC=C1N=C=S OR315248 [1,1,0,0,0,0|0,1,1]=4 33 B14R1.707 COC(=O)C1=C(B(O)O)C=CC(C)=C1 OR361343 [1,1,0,0,0,0|1,0,1]=4 34 B14R1.707 COC(=O)C1=C(B(O)O)C=CC(F)=C1 PC1615 [1,1,0,0,0,0|1,0,1]=4 35 B14R1.707 COC(=O)C1=C([N+](=O)[O-])C=CC(F)=C1 PC7145 [1,1,0,0,0,0|1,0,1]=4 36 B14R1.707 COC(=O)C1=CC(Cl)=CC=C1[N+](=O)[O-] OR27522 [1,1,0,0,0,0|1,0,1]=4 37 B14R1.746 COC(=N)C1=CC=CC=C1C(=O)OC OR470982 [1,1,0,0,0,0|1,0,0]=3 38 B14R1.746 COC(=O)C1=CC=CN=C1C(=O)OC OR323254 [1,1,0,0,0,0|1,0,0]=3 39 B14R1.1126 COC(=O)C1=C([N+](=O)[O-])C=C(F)C=C1 PC8106 [1,1,0,0,0,0|1,0,1]=4 40 B14R1.1126 COC(=O)C1=CC=C(F)C=C1B(O)O PC1662 [1,1,0,0,0,0|1,0,1]=4 41 B14R1.1153 COC(=O)C1=C([N+](=O)[O-])C(Br)=CC=C1 OR52718 [1,1,0,0,0,0|1,0,1]=4 42 B14R1.1153 COC(=O)C1=C([N+](=O)[O-])C(Cl)=CC=C1 OR401016 [1,1,0,0,0,0|1,0,1]=4 43 B14R1.1153 COC(=O)C1=CC=CC(F)=C1[N+](=O)[O-] PC400724 [1,1,0,0,0,0|1,0,1]=4 44 B14R1.1164 COC(=O)C1=C(B(O)O)C=CC=C1C OR361342 [1,1,0,0,0,0|1,0,1]=4 45 B14R1.1164 COC(=O)C1=C(B(O)O)C=CC=C1F PC412507 [1,1,0,0,0,0|1,0,1]=4 46 B14R1.1164 COC(=O)C1=C(Cl)C=CC=C1[N+](=O)[O-] OR401011 [1,1,0,0,0,0|1,0,1]=4 47 B14R1.1164 COC(=O)C1=C(F)C=CC=C1[N+](=O)[O-] PC502597 [1,1,0,0,0,0|1,0,1]=4 48 B16R1.70638 CCOC(=O)C1=CC(F)=C(F)C=C1[N+](=O)[O-] PC510023 [0,2,0,0,0,0|1,0,1]=4 49 B16R1.4547 CC(C)COC(=O)C1=C(B(O)O)C=CC=C1 OR361282 [0,2,0,0,0,0|1,0,1]=4 50 B16R1.12475 CC(C)(C)OC(=O)C1=CC=CC=C1C(=O)O OR346339 [0,2,0,0,0,0|0,0,0]=2 51 B14R2.1131 COC1=CC=C(O)C2=CC=CC=C12 OR30514 [1,0,0,1,0,0|2,0,0]=4 52 B16R2.27521 O=C(O)C1=CC=CC=C1NC(=O)C2CC2 OR470307 [0,0,0,1,0,1|1,0,0]=3 53 B16R2.154585 CCOC(=O)N1C=C(Br)C2=C1C=CC=C2 OR470492 [0,0,0,1,0,1|2,0,0]=4