0 B12R1.71 CCOCC1=CC=C(OC)C=C1 BB32-2498 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.1 C=CCOC1=CC=C(C)C=C1 BB31-4230 [1,0,0,0,0,0|2,0,1]=4 2 B11R1.1 O=CCCC1=CC=C(Br)C=C1 BB31-6794 [1,0,0,0,0,0|1,0,2]=4 3 B11R1.1 O=C\C=C\C1=CC=C(O)C=C1 BB32-1043 [1,0,0,0,0,0|0,0,0]=1 4 B11R1.83 COC1=CC=C(CC=O)C=C1 BB32-2943 [1,0,0,0,0,0|0,0,1]=2 5 B11R1.83 COC1=CC=C(CNO)C=C1 BB32-2374 [1,0,0,0,0,0|1,0,2]=4 6 B13R1.3 COC1=CC=C(C#CC(=O)O)C=C1 BB32-1274 [0,1,0,0,0,0|0,0,2]=3 7 B13R1.3 COC1=CC=C(\C=C\B(O)O)C=C1 BB31-7336 [0,1,0,0,0,0|1,0,1]=3 8 B13R1.5 CCC(=O)NC1=CC=C(OC)C=C1 BB31-4450 [0,1,0,0,0,0|2,0,1]=4 9 B13R1.452 CCOC(=N)C1=CC=C(OC)C=C1 BB32-2511 [0,1,0,0,0,0|2,0,1]=4 10 B13R2.57 CNC1=CC2=CC=CC=C2C=C1 BB32-1489 [0,0,0,1,0,0|2,0,0]=3 11 B13R2.669 COC1=CC2=C(C=C1)NN=C2Br BB31-6462 [0,0,0,1,0,0|3,0,0]=4 12 B13R2.669 COC1=CC2=C(C=C1)NN=C2I BB31-4473 [0,0,0,1,0,0|3,0,0]=4 13 B13R2.669 COC1=CC2=C(N=C1)NC=C2Br BB31-8997 [0,0,0,1,0,0|3,0,0]=4 14 B13R2.669 COC1=CN2C(Br)=CN=C2C=C1 BB31-9053 [0,0,0,1,0,0|3,0,0]=4 15 B10R1.1 C=CCC1=CC=C(O)C=C1 BB31-5055 [2,0,0,0,0,0|0,0,1]=3 16 B12R1.21 CC1=CC=C(C#CC(=O)O)C=C1 BB31-7651 [1,1,0,0,0,0|0,0,2]=4 17 B12R1.21 CC1=CC=C(\C=C\B(O)O)C=C1 BB31-5385 [1,1,0,0,0,0|1,0,1]=4 18 B12R1.21 NC(=O)CCC1=CC=C(O)C=C1 BB31-8097 [1,1,0,0,0,0|0,0,2]=4 19 B12R1.21 O=C(O)\C=C\C1=NC=C(F)C=C1 BB31-7518 [1,1,0,0,0,0|2,0,0]=4 20 B12R1.4 COC1=CN=C(CC(=O)O)C=C1 BB32-0118 [1,1,0,0,0,0|1,0,1]=4 21 B14R1.3 C=C(C)C(=O)NC1=CC=C(OC)C=C1 BB31-7080 [0,2,0,0,0,0|2,0,0]=4 22 B14R1.5 COC(=O)C#CC1=CC=C(OC)C=C1 BB31-7091 [0,2,0,0,0,0|0,0,2]=4 23 B14R1.103 COC1=CC(F)=C(\C=C\C(=O)O)C=C1 BB31-7015 [0,2,0,0,0,0|0,0,0]=2 24 B14R1.142 CCOC1=CC=C(OCC(=O)Cl)C=C1 BB12-5426 [0,2,0,0,0,0|1,0,1]=4 25 B14R1.142 CCOC1=CC=C(OCC(=O)O)C=C1 BB12-5425 [0,2,0,0,0,0|1,0,1]=4 26 B14R1.142 CCOC1=CC=C(OCC(N)=O)C=C1 BB12-5427 [0,2,0,0,0,0|1,0,1]=4 27 B14R1.419 CC(=O)\C=C\C1=CC=C([N+](=O)[O-])C=C1 BB32-1835 [0,2,0,0,0,0|2,0,0]=4 28 B14R1.419 NC(=O)\C=C\C1=CC=C([N+](=O)[O-])C=C1 BB12-5121 [0,2,0,0,0,0|2,0,0]=4 29 B14R1.419 O=C(Cl)\C=C\C1=CC=C([N+](=O)[O-])C=C1 BB12-5122 [0,2,0,0,0,0|2,0,0]=4 30 B14R1.419 O=C(O)\C=C\C1=CC=C([N+](=O)[O-])C=C1 BB12-5118 [0,2,0,0,0,0|2,0,0]=4 31 B14R1.3653 COC1=C(O)C=C(CCC(=O)O)C=C1 BB31-8944 [0,2,0,0,0,0|0,0,2]=4 32 B14R1.65 COC(=O)C1=CC=C(CCC=O)C=C1 BB31-7831 [0,2,0,0,0,0|0,0,2]=4 33 B12R2.132 CC1=CNC2=C1C=C(O)C=C2 BB31-7869 [1,0,0,1,0,0|2,0,0]=4 34 B12R2.132 O=C1N=CC2=C1C=C(I)C=C2 BB31-7444 [1,0,0,1,0,0|2,0,0]=4 35 B12R2.44 COC1=CC2=C(C=C1)OC=N2 BB31-1933 [1,0,0,1,0,0|2,0,0]=4 36 B12R2.44 COC1=CC2=C(C=C1)SC=C2 BB31-3820 [1,0,0,1,0,0|1,0,0]=3 37 B12R2.44 COC1=CC2=C(C=CS2)C=C1 BB31-7406 [1,0,0,1,0,0|0,1,0]=3 38 B12R2.44 COC1=NC2=C(C=CN2)C=C1 BB31-4734 [1,0,0,1,0,0|2,0,0]=4 39 B12R2.44 COC1=NC=C2C=CNC2=C1 BB31-6789 [1,0,0,1,0,0|2,0,0]=4 40 B14R2.134 COC1=CC2=C(C=C1)N=CC(=O)N2 BB32-2749 [0,1,0,1,0,0|1,0,0]=3 41 B14R2.134 COC1=CC2=NC(C)=CC=C2C=C1 BB32-0537 [0,1,0,1,0,0|1,0,0]=3 42 B14R2.134 COC1=CC=C2C=NC(Cl)=CC2=C1 BB31-6722 [0,1,0,1,0,0|2,0,0]=4 43 B14R2.134 COC1=CC=C2N=CC(F)=CC2=C1 BB32-1925 [0,1,0,1,0,0|2,0,0]=4 44 B14R2.2332 CCC1=CC=C2C=C(O)C=CC2=C1 BB31-3917 [0,1,0,1,0,0|2,0,0]=4 45 B14R2.2332 COC1=CC2=NC=C(N)C=C2C=C1 BB31-8565 [0,1,0,1,0,0|1,0,0]=3 46 B14R2.2332 COC1=CC=C2C=C(Br)C=NC2=C1 BB31-5036 [0,1,0,1,0,0|1,0,0]=3 47 B14R2.2332 COC1=CC=C2N=C(Cl)C=NC2=C1 BB32-2758 [0,1,0,1,0,0|2,0,0]=4 48 B14R2.3274 COC1=CC2=C(C=C1)NC(C)=C2C BB31-6660 [0,1,0,1,0,0|2,0,0]=4 49 B14R2.3304 COC1=CC2=C(C=C1)C=C(C=O)S2 BB31-9501 [0,1,0,1,0,0|0,0,0]=2 50 B14R2.3304 COC1=CC2=C(C=C1)NC(C=O)=C2 BB31-8142 [0,1,0,1,0,0|1,0,0]=3 51 B14R2.3304 COC1=CC2=C(C=C1)OC(C=O)=C2 BB31-4207 [0,1,0,1,0,0|1,0,0]=3 52 B14R2.3304 COC1=CC2=C(C=C1)SC(C=O)=C2 BB32-3355 [0,1,0,1,0,0|1,0,0]=3 53 B14R2.1019 COC1=CC2=CC=CC=C2C(O)=C1 BB32-3264 [0,1,0,1,0,0|1,0,0]=3 54 B14R2.1019 COC1=CC2=CC=CN=C2C(Br)=C1 BB31-7641 [0,1,0,1,0,0|2,0,0]=4 55 B14R2.1019 COC1=CC2=NC=CC=C2C(Br)=C1 BB31-8800 [0,1,0,1,0,0|1,0,0]=3 56 B14R2.1019 COC1=NC2=CC=CC=C2C(Cl)=C1 BB31-7676 [0,1,0,1,0,0|2,0,0]=4 57 B14R2.112 NCCC1=CC2=CC=CC=C2C=C1 BB31-3961 [0,1,0,1,0,0|2,0,0]=4 58 B14R2.1 COC1=CC=C(C2=CC=NO2)C=C1 BB32-1493 [0,1,0,1,0,0|0,0,1]=3 59 B14R2.1 COC1=CC=C(C2=CSN=N2)C=C1 BB31-3581 [0,1,0,1,0,0|2,0,0]=4 60 B14R2.1 COC1=CC=C(C2=NNC=C2)C=C1 BB52-7037 [0,1,0,1,0,0|1,0,0]=3 61 B14R2.1 CSC1=CC=C(C2=NNC=C2)C=C1 BB52-0573 [0,1,0,1,0,0|1,1,0]=4 62 B14R2.142 CCC1=CC=C2N=CC=C(O)C2=C1 BB31-4586 [0,1,0,1,0,0|1,0,1]=4 63 B14R2.142 COC1=CC2=C(C)C=CN=C2C=C1 BB31-5949 [0,1,0,1,0,0|1,0,0]=3 64 B14R2.142 COC1=CC2=C(O)C=CC=C2C=C1 BB32-3707 [0,1,0,1,0,0|0,0,1]=3 65 B14R2.142 COC1=CC=C2N=CC=C(Cl)C2=N1 BB31-4318 [0,1,0,1,0,0|2,0,0]=4 66 B14R2.2497 COC1=CC2=C(C=C1)NN=C2C=O BB32-0615 [0,1,0,1,0,0|1,0,0]=3 67 B14R2.1801 COC1=CC2=CC=NC(N)=C2C=C1 BB32-1487 [0,1,0,1,0,0|2,0,0]=4 68 B14R2.1801 COC1=CC=C2C(Br)=CC=NC2=C1 BB31-5912 [0,1,0,1,0,0|1,0,0]=3 69 B14R2.92 COC1=C(N)C2=CC=CC=C2C=C1 BB31-8125 [0,1,0,1,0,0|1,0,0]=3 70 B14R2.1128 COC1=CC2=CC=CC=C2C=C1O BB31-5802 [0,1,0,1,0,0|1,0,0]=3 71 B14R2.1128 COC1=CC2=NC=CC=C2C=C1Br BB32-0769 [0,1,0,1,0,0|1,0,0]=3 72 B14R2.2167 COC1=C(Cl)C=C2CCC(=O)C2=C1 BB31-6006 [0,1,0,1,0,0|0,0,2]=4 73 B14R2.2167 COC1=C(F)C=C2CCC(=O)C2=C1 BB31-6013 [0,1,0,1,0,0|0,0,2]=4 74 B14R2.2167 COC1=CC2=C(C=C1O)CCC2=O BB31-1784 [0,1,0,1,0,0|0,0,2]=4 75 B14R2.2495 COC1=C(F)C2=C(C=C1)CNC2=O BB31-0116 [0,1,0,1,0,0|1,0,1]=4