0 B11R1.182 CCOC1=C(Br)C=CC(N)=C1 LL2065 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.182 CCOC1=CC(Cl)=CC=C1I LT3170 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.182 CCOC1=CC(N)=CC=C1Br LL2988 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.182 NC1=CC=C(N)C(CCO)=C1 YH96767 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.182 OCCC1=CC(Cl)=CC=C1Cl YH42571 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.4 CC1=CC=CC=C1CC#N LT5660 [1,0,0,0,0,0|0,0,2]=3 6 B10R1.4 CC1=CC=CC=C1N=C=O HL0189 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.4 CC1=CC=CC=C1N=C=S HL0190 [1,0,0,0,0,0|2,0,1]=4 8 B10R1.4 CC1=NC=CC=C1CC#N RT8737 [1,0,0,0,0,0|1,0,2]=4 9 B10R1.4 CC1=NC=CC=C1CCO RT8739 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.4 CCCC1=CC=CC=C1O JZ4091 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.4 CCOC1=C(Br)C=CC=C1 XJ1001 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.4 CCOC1=C(Cl)C=CC=C1 HL0191 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.4 CCOC1=C(F)C=CC=C1 LT6548 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.4 CCOC1=C(O)C=CC=C1 LQ0245 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.4 N#CCC1=C(Br)C=CC=C1 XJ4518 [1,0,0,0,0,0|1,0,2]=4 16 B10R1.4 N#CCC1=C(F)C=CC=C1 HL1631 [1,0,0,0,0,0|1,0,2]=4 17 B10R1.4 N#CCC1=C(I)C=CC=C1 LQ5028 [1,0,0,0,0,0|1,0,2]=4 18 B10R1.4 N#CCC1=CC=CC=C1Br LT2296 [1,0,0,0,0,0|1,0,2]=4 19 B10R1.4 N#CCC1=CC=CC=C1N RT1593 [1,0,0,0,0,0|1,0,2]=4 20 B10R1.4 NC1=CC=CC=C1CCO YH05747 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.4 NCCC1=CC=CC=C1Br XJ6027 [1,0,0,0,0,0|1,0,0]=2 22 B10R1.4 NCCC1=CC=CC=C1O RT6527 [1,0,0,0,0,0|1,0,0]=2 23 B10R1.4 NCCN1C=CC=CC1=O YH56675 [1,0,0,0,0,0|2,0,0]=3 24 B10R1.4 N\N=C\C1=CC=CC=C1O XJ2447 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.4 O=CCC1=C(Cl)C=CC=C1 LQ2618 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.4 O=CCC1=CC=CC=C1F XJ6347 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.4 OCCC1=CC=CC=C1Br JZ4362 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.4 ONCC1=CC=CC=C1Cl JZ2761 [1,0,0,0,0,0|3,0,0]=4 29 B10R1.10 CC1=CC(NC=O)=CC=C1 HL2478 [1,0,0,0,0,0|2,0,1]=4 30 B10R1.10 CC1=CC=CC(CC#N)=C1 LT2624 [1,0,0,0,0,0|0,0,2]=3 31 B10R1.10 CC1=CC=CC(CCO)=N1 CJ3011 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.10 CCCC1=CC(N)=CC=C1 YH65505 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.10 CCCC1=CC(N)=NC=C1 HL4171 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.10 CCOC1=CC(Br)=CC=C1 XJ2220 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.10 CCOC1=CC(F)=CC=C1 HL1827 [1,0,0,0,0,0|3,0,0]=4 36 B10R1.10 CCOC1=CC=CC(O)=C1 JZ3968 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.10 CNCC1=CC(Br)=CC=C1 HL4336 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.10 N#CCC1=CC(I)=CC=C1 HL3403 [1,0,0,0,0,0|1,0,2]=4 39 B10R1.10 N#CCC1=CC=CC(Br)=C1 LT6740 [1,0,0,0,0,0|1,0,2]=4 40 B10R1.10 N#CCC1=CC=CC(Cl)=C1 LT2337 [1,0,0,0,0,0|1,0,2]=4 41 B10R1.10 N#CCC1=CC=CC(F)=C1 LQ3386 [1,0,0,0,0,0|1,0,2]=4 42 B10R1.10 NC1=CC(CCO)=CC=C1 XJ5592 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.10 NCCC1=CC(F)=CC=C1 YH59765 [1,0,0,0,0,0|1,0,0]=2 44 B10R1.10 NCCC1=CC=CC(Br)=C1 YH08740 [1,0,0,0,0,0|1,0,0]=2 45 B10R1.10 NCCC1=CC=CC(O)=C1 YH55865 [1,0,0,0,0,0|1,0,0]=2 46 B10R1.10 O=CCC1=CC(F)=CC=C1 YH17193 [1,0,0,0,0,0|2,0,1]=4 47 B10R1.10 OCCC1=CC(Br)=CC=C1 YH51734 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.10 OCCC1=CC=CC(O)=C1 YH66577 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.10 OCCC1=NC=CC(Cl)=C1 RT9226 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.30 C#CC1=CC(N)=CC=C1C RT2895 [1,0,0,0,0,0|1,0,2]=4 51 B10R1.30 C(=O)C1=C(C)C=CC(F)=C1 JZ5501 [1,0,0,0,0,0|2,0,1]=4 52 B10R1.30 C(=O)C1=CC(Br)=CC=C1C YH94258 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.30 CC1=C(NN)C=C(Br)C=C1 LL2620 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.30 CC1=CC(C#N)=C(F)C=C1 HL4251 [1,0,0,0,0,0|1,0,2]=4 55 B10R1.30 CC1=CC(CCl)=C(C)C=C1 LQ1489 [1,0,0,0,0,0|1,0,0]=2 56 B10R1.30 CC1=CC(CN)=C(C)C=C1 HL1221 [1,0,0,0,0,0|0,0,0]=1 57 B10R1.30 CC1=CC=C(Br)C(C=O)=C1 YH94345 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.30 CC1=CC=C(C)C(CO)=C1 LQ5315 [1,0,0,0,0,0|1,0,0]=2 59 B10R1.30 CCC1=C(Cl)C=CC(O)=C1 JZ4874 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.30 CCC1=C(I)C=CC(Br)=C1 LL2449 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.30 CCC1=CC(Br)=CC=C1O RT11159 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.30 CCC1=CC(O)=CC=C1I YH37192 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.30 CCC1=NC(C)=CC=C1O RT9719 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 YH40244 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 CJ2812 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.30 COC1=C(F)C=CC(F)=C1 YH17327 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.30 COC1=C(F)C=CC(N)=C1 LL1071 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.30 COC1=CC(Br)=CC=C1N LX2103 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.30 COC1=CC(N)=CC=C1Br JZ5281 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.30 COC1=CC(N)=CC=C1O RT1602 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.30 COC1=CC(O)=CC=C1Br HL3101 [1,0,0,0,0,0|3,0,0]=4 72 B10R1.30 COC1=CC(O)=CC=C1O LQ1490 [1,0,0,0,0,0|3,0,0]=4 73 B10R1.30 COC1=NC(C)=CC=C1F CJ2127 [1,0,0,0,0,0|3,0,0]=4 74 B10R1.30 COC1=NC(C)=CC=C1N YH42396 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.30 ClC1=C(CBr)C=C(I)C=C1 LX2601 [1,0,0,0,0,0|3,0,0]=4 76 B10R1.30 ClC1=CC=C(Br)C(CBr)=C1 RT11956 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.30 ClC1=CC=C(Cl)C(CBr)=C1 HL4774 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.30 ClCC1=C(Cl)C=CC(Cl)=C1 XJ2300 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.30 ClCC1=CC(I)=CC=C1Cl CJ2768 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.30 FC1=C(CBr)C=C(Br)C=C1 XJ6718 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.30 FC1=CC(CCl)=C(F)C=C1 LL0894 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.30 FC1=CC=C(F)C(CBr)=C1 HL4746 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.30 NC1=CC=C(Cl)C(CO)=C1 YH94191 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 LQ3465 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.30 NCC1=C(F)C=CC(F)=C1 HL4753 [1,0,0,0,0,0|2,0,0]=3 86 B10R1.30 NCC1=CC(Cl)=CC=C1F LL2672 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.30 NNC1=C(F)C=CC(F)=C1 LQ5195 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.30 NNC1=CC(F)=CC=C1F HL3701 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.30 OCC1=C(Br)C=CC(F)=C1 YH44611 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.30 OCC1=C(F)C=CC(Br)=C1 XJ6719 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.30 OCC1=CC(F)=CC=C1O LT3858 [1,0,0,0,0,0|3,0,0]=4 92 B12R1.127 CC1=CC(CC(=O)O)=C(C)C=C1 JZ3784 [0,1,0,0,0,0|1,0,1]=3 93 B12R1.268 COC1=CC=C(C)C=C1N=C=S HL3808 [0,1,0,0,0,0|2,0,1]=4 94 B12R1.374 CCNCC1=CC(N)=CC=C1O RT3657 [0,1,0,0,0,0|3,0,0]=4 95 B12R1.374 O=CCCC1=CC(Cl)=CC=C1Cl RT5982 [0,1,0,0,0,0|3,0,0]=4 96 B12R1.497 NC1=C(CCO)C(F)=C(F)C=C1 YH35145 [0,1,0,0,0,0|3,0,0]=4 97 B12R1.1123 NCCC1=C(F)C=C(O)C(O)=C1 YH65313 [0,1,0,0,0,0|2,0,0]=3 98 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 YH46471 [0,0,0,1,0,0|1,0,0]=2 99 B12R2.24 BrC1=CC=C2CCNCC2=C1 YH40784 [0,0,0,1,0,0|3,0,0]=4 100 B12R2.24 CC1=CC2=C(C=C1)NCCC2 XJ0199 [0,0,0,1,0,0|2,0,0]=3 101 B12R2.24 FC1=CC2=C(C=C1)OCCC2 RT8167 [0,0,0,1,0,0|3,0,0]=4 102 B12R2.24 NC1=CC2=C(C=C1)CCCN2 LT1147 [0,0,0,1,0,0|3,0,0]=4 103 B12R2.24 NC1=CC2=C(C=C1)CNCC2 YH15702 [0,0,0,1,0,0|1,0,0]=2 104 B12R2.24 NC1=CC=C2CCCNC2=C1 YH36668 [0,0,0,1,0,0|3,0,0]=4 105 B12R2.24 OC1=CC2=C(C=C1)CCCC2 LT3595 [0,0,0,1,0,0|2,0,0]=3 106 B12R2.24 OC1=CC2=C(C=C1)CCCO2 CJ2931 [0,0,0,1,0,0|3,0,0]=4 107 B12R2.24 OC1=CC2=C(C=C1)OCCC2 CJ2929 [0,0,0,1,0,0|3,0,0]=4 108 B12R2.24 OC1=CC=C2CCCNC2=C1 YH08365 [0,0,0,1,0,0|3,0,0]=4 109 B12R2.24 OC1=CC=C2NCCCC2=C1 LT6061 [0,0,0,1,0,0|3,0,0]=4 110 B12R2.221 CC1=CC=C(C)C2=C1C=CC2 YH14512 [0,0,0,1,0,0|1,0,1]=3 111 B12R2.606 CC1=CC=C2N=C(N)SC2=C1 LQ2216 [0,0,0,1,0,0|2,0,1]=4 112 B10R1.187 NCCN1C(=O)C=CC1=O HL3537 [0,0,0,0,1,0|3,0,0]=4 113 B9R1.8 BrCCC1=CC=CC=C1 LL0334 [2,0,0,0,0,0|1,0,0]=3 114 B9R1.8 BrCCC1=CC=NC=C1 CJ2885 [2,0,0,0,0,0|2,0,0]=4 115 B9R1.8 BrCCC1=NC=CC=C1 LX2681 [2,0,0,0,0,0|2,0,0]=4 116 B9R1.8 BrCCC1=NC=CC=C1 YH16042 [2,0,0,0,0,0|2,0,0]=4 117 B9R1.8 CCCC1=CC=NC=C1 LT3807 [2,0,0,0,0,0|2,0,0]=4 118 B9R1.8 CCSC1=CC=CC=C1 JZ4001 [2,0,0,0,0,0|2,0,0]=4 119 B9R1.8 CNCC1=CC=CC=C1 RT3204 [2,0,0,0,0,0|2,0,0]=4 120 B9R1.8 ClCCC1=CC=CC=C1 JZ3996 [2,0,0,0,0,0|1,0,0]=3 121 B9R1.8 ClCCC1=CC=CC=C1 JZ4528 [2,0,0,0,0,0|1,0,0]=3 122 B9R1.8 ClCCC1=CC=NC=C1 CJ2857 [2,0,0,0,0,0|2,0,0]=4 123 B9R1.8 NCCC1=CC=CN=C1 LQ4201 [2,0,0,0,0,0|1,0,0]=3 124 B9R1.8 NCCC1=CC=NC=C1 YH11719 [2,0,0,0,0,0|1,0,0]=3 125 B9R1.8 NNCC1=CC=CC=C1 LQ1000 [2,0,0,0,0,0|1,0,0]=3 126 B9R1.8 NNCC1=CC=CC=C1 LX3048 [2,0,0,0,0,0|1,0,0]=3 127 B9R1.8 NOCC1=CC=CC=C1 LT5864 [2,0,0,0,0,0|1,0,0]=3 128 B9R1.8 O=CCC1=CC=CC=C1 XJ0479 [2,0,0,0,0,0|1,0,1]=4 129 B9R1.8 OCCC1=CC=CC=C1 YH43593 [2,0,0,0,0,0|1,0,0]=3 130 B9R1.8 OCCC1=CC=NC=C1 XJ2857 [2,0,0,0,0,0|2,0,0]=4 131 B9R1.8 SCCC1=CC=NC=C1 RT10479 [2,0,0,0,0,0|2,0,0]=4 132 B9R1.8 SCCC1=NC=CC=C1 RT10478 [2,0,0,0,0,0|2,0,0]=4 133 B9R1.15 BrCC1=C(Br)C=CC=C1 LT0304 [2,0,0,0,0,0|2,0,0]=4 134 B9R1.15 BrCC1=C(I)C=CC=C1 LQ5027 [2,0,0,0,0,0|2,0,0]=4 135 B9R1.15 C#CC1=CC=CC=C1C SY0118 [2,0,0,0,0,0|0,0,2]=4 136 B9R1.15 C=CC1=CC=CC=C1C XJ1115 [2,0,0,0,0,0|0,0,2]=4 137 B9R1.15 CC1=C(C#N)C=CC=C1 LQ0969 [2,0,0,0,0,0|0,0,2]=4 138 B9R1.15 CC1=CC=CC=C1C=O LQ0970 [2,0,0,0,0,0|1,0,1]=4 139 B9R1.15 CC1=CC=CC=C1CN XJ0151 [2,0,0,0,0,0|0,0,0]=2 140 B9R1.15 CC1=CC=CN=C1CN LT3920 [2,0,0,0,0,0|1,0,0]=3 141 B9R1.15 CC1=CN=CN=C1CN RT2792 [2,0,0,0,0,0|2,0,0]=4 142 B9R1.15 CC1=NC=CC=C1CCl RT8738 [2,0,0,0,0,0|2,0,0]=4 143 B9R1.15 CCC1=C(Br)C=CC=C1 JZ1837 [2,0,0,0,0,0|1,0,0]=3 144 B9R1.15 CCC1=C(Br)C=NC=C1 LQ4988 [2,0,0,0,0,0|2,0,0]=4 145 B9R1.15 CCC1=C(C)C=CN=C1 LQ0971 [2,0,0,0,0,0|1,0,0]=3 146 B9R1.15 CCC1=C(F)N=CC=C1 LT3213 [2,0,0,0,0,0|2,0,0]=4 147 B9R1.15 CCC1=CC=CC=C1F RT10529 [2,0,0,0,0,0|1,0,0]=3 148 B9R1.15 CCC1=CC=CC=C1I XJ4411 [2,0,0,0,0,0|1,0,0]=3 149 B9R1.15 CCC1=CC=CC=C1S LT1736 [2,0,0,0,0,0|1,0,0]=3 150 B9R1.15 CCC1=CC=CC=[N+]1[O-] LT3942 [2,0,0,0,0,0|2,0,0]=4 151 B9R1.15 CCC1=CC=CN=C1N RT2490 [2,0,0,0,0,0|2,0,0]=4 152 B9R1.15 CCC1=NC=CN=C1C JZ1026 [2,0,0,0,0,0|2,0,0]=4 153 B9R1.15 CC[N+]1=CC=CC=C1Br HL0484 [2,0,0,0,0,0|2,0,0]=4 154 B9R1.15 CNC1=C(F)C=CC=C1 RT3629 [2,0,0,0,0,0|2,0,0]=4 155 B9R1.15 CNC1=CC=CC=C1C XJ1117 [2,0,0,0,0,0|1,0,0]=3 156 B9R1.15 COC1=C(Br)C=CC=C1 LT0298 [2,0,0,0,0,0|2,0,0]=4 157 B9R1.15 COC1=C(F)C=CC=C1 LT6544 [2,0,0,0,0,0|2,0,0]=4 158 B9R1.15 COC1=CC=CC=C1O LT7681 [2,0,0,0,0,0|2,0,0]=4 159 B9R1.15 COC1=CC=CN=C1C YH50584 [2,0,0,0,0,0|2,0,0]=4 160 B9R1.15 CSC1=C(Cl)C=CC=C1 JZ5186 [2,0,0,0,0,0|2,0,0]=4 161 B9R1.15 CSC1=C(F)C=CC=C1 XJ1257 [2,0,0,0,0,0|2,0,0]=4 162 B9R1.15 CSC1=CC=CC=C1C JZ4854 [2,0,0,0,0,0|1,0,0]=3 163 B9R1.15 CSC1=CC=CC=C1I LQ4804 [2,0,0,0,0,0|2,0,0]=4 164 B9R1.15 CSC1=CC=CC=C1O JZ4356 [2,0,0,0,0,0|2,0,0]=4 165 B9R1.15 ClC1=CC=CC=C1CBr XJ1116 [2,0,0,0,0,0|2,0,0]=4 166 B9R1.15 ClCC1=CC=CC=C1Br JZ3842 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.15 FC1=C(CBr)C=CC=C1 XJ0768 [2,0,0,0,0,0|2,0,0]=4 168 B9R1.15 FC1=CC=CC=C1CBr RT11192 [2,0,0,0,0,0|2,0,0]=4 169 B9R1.15 NC1=CC=CC=C1CO LT2291 [2,0,0,0,0,0|2,0,0]=4 170 B9R1.15 NCC1=C(I)C=CC=C1 YH59249 [2,0,0,0,0,0|1,0,0]=3 171 B9R1.15 NCC1=C(N)C=CC=C1 YH52512 [2,0,0,0,0,0|1,0,0]=3 172 B9R1.15 NCC1=C(O)C=CC=C1 LQ1562 [2,0,0,0,0,0|1,0,0]=3 173 B9R1.15 NCC1=CC=CC=C1Br LT0305 [2,0,0,0,0,0|1,0,0]=3 174 B9R1.15 NCC1=CC=CC=C1Cl LT6512 [2,0,0,0,0,0|1,0,0]=3 175 B9R1.15 NCC1=CC=CN=C1Cl YH66504 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.15 NCC1=CC=CNC1=O RT2213 [2,0,0,0,0,0|2,0,0]=4 177 B9R1.15 NNC1=C(F)C=CC=C1 JZ2154 [2,0,0,0,0,0|2,0,0]=4 178 B9R1.15 NNC1=CC=CC=C1Br XJ5550 [2,0,0,0,0,0|2,0,0]=4 179 B9R1.15 NNC1=CC=CC=C1F LT1512 [2,0,0,0,0,0|2,0,0]=4 180 B9R1.15 OCC1=C(Cl)C=CC=C1 LT1480 [2,0,0,0,0,0|2,0,0]=4 181 B9R1.15 OCC1=C(F)C=CC=C1 XJ0769 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.15 OCC1=C(I)C=CC=C1 LQ2821 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.15 OCC1=CC=CC=C1Br LQ4155 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.15 SCC1=C(Cl)C=CC=C1 XJ5403 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.2 BrCC1=CC(Br)=CC=C1 LT6733 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.2 C#CC1=CC(C)=CC=C1 XJ1365 [2,0,0,0,0,0|0,0,2]=4 187 B9R1.2 C=CC1=CC=CC(C)=C1 LQ4468 [2,0,0,0,0,0|0,0,2]=4 188 B9R1.2 CC1=CC(C#N)=CC=C1 LT7492 [2,0,0,0,0,0|0,0,2]=4 189 B9R1.2 CC1=CC(C=O)=CC=C1 JZ3952 [2,0,0,0,0,0|1,0,1]=4 190 B9R1.2 CC1=CC(CCl)=NC=C1 YH58257 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.2 CC1=CC(CN)=CC=C1 LQ0295 [2,0,0,0,0,0|0,0,0]=2 192 B9R1.2 CC1=CC(CO)=NC=C1 YH01119 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.2 CC1=CC(NN)=CC=C1 LL0975 [2,0,0,0,0,0|1,0,0]=3 194 B9R1.2 CC1=CC=CC(CO)=N1 HL0652 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.2 CC1=NC=CC(CCl)=C1 RT9279 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.2 CC1=NC=CC(CN)=C1 RT9263 [2,0,0,0,0,0|1,0,0]=3 197 B9R1.2 CCC1=CC(C)=CC=C1 JZ3949 [2,0,0,0,0,0|0,0,0]=2 198 B9R1.2 CCC1=CC(Cl)=NC=C1 LT3331 [2,0,0,0,0,0|2,0,0]=4 199 B9R1.2 CCC1=CC=CC(Br)=C1 XJ2282 [2,0,0,0,0,0|1,0,0]=3 200 B9R1.2 CCC1=CC=CC(N)=C1 XJ1048 [2,0,0,0,0,0|1,0,0]=3 201 B9R1.2 CCC1=CC=CC(O)=C1 YH10409 [2,0,0,0,0,0|1,0,0]=3 202 B9R1.2 CCC1=CC=NC(Br)=C1 LT3312 [2,0,0,0,0,0|2,0,0]=4 203 B9R1.2 CCC1=CC=NC(N)=C1 LT3293 [2,0,0,0,0,0|2,0,0]=4 204 B9R1.2 CNC1=CC=CC(C)=C1 LQ1364 [2,0,0,0,0,0|1,0,0]=3 205 B9R1.2 COC1=CC(Br)=CC=C1 JZ1081 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.2 COC1=CC(N)=CC=C1 RT2821 [2,0,0,0,0,0|2,0,0]=4 207 B9R1.2 COC1=CC=CC(O)=C1 LQ0600 [2,0,0,0,0,0|2,0,0]=4 208 B9R1.2 COC1=NC(C)=CC=C1 LT1773 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.2 CSC1=CC(Cl)=CC=C1 XJ2763 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.2 CSC1=CC(Cl)=CC=C1 XJ4867 [2,0,0,0,0,0|2,0,0]=4 211 B9R1.2 CSC1=CC(I)=CC=C1 YH31373 [2,0,0,0,0,0|2,0,0]=4 212 B9R1.2 CSC1=CC=CC(F)=C1 XJ1274 [2,0,0,0,0,0|2,0,0]=4 213 B9R1.2 CSC1=CC=CC(N)=C1 LT2494 [2,0,0,0,0,0|2,0,0]=4 214 B9R1.2 FC1=CC=CC(CCl)=C1 HL1820 [2,0,0,0,0,0|2,0,0]=4 215 B9R1.2 NCC1=CC(Br)=CC=C1 XJ3599 [2,0,0,0,0,0|1,0,0]=3 216 B9R1.2 NCC1=CC(I)=CC=C1 LQ1363 [2,0,0,0,0,0|1,0,0]=3 217 B9R1.2 NCC1=CC(N)=CC=C1 LT2553 [2,0,0,0,0,0|1,0,0]=3 218 B9R1.2 NCC1=CC=CC(Cl)=C1 LT6763 [2,0,0,0,0,0|1,0,0]=3 219 B9R1.2 NNC1=CC=CC(Cl)=C1 HL2219 [2,0,0,0,0,0|2,0,0]=4 220 B9R1.2 NNC1=CC=CC(F)=C1 JZ2155 [2,0,0,0,0,0|2,0,0]=4 221 B9R1.2 OC1=CC=CC(CCl)=C1 LT2488 [2,0,0,0,0,0|2,0,0]=4 222 B9R1.2 OCC1=CC(Cl)=CC=C1 XJ1427 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.2 OCC1=CC(F)=CC=C1 HL1821 [2,0,0,0,0,0|2,0,0]=4 224 B9R1.2 OCC1=CC(I)=CC=C1 XJ5829 [2,0,0,0,0,0|2,0,0]=4 225 B9R1.2 OCC1=CC=CC(Br)=C1 LT6732 [2,0,0,0,0,0|2,0,0]=4 226 B9R1.69 CC1=C(Br)C=C(Br)C=C1 LQ4730 [2,0,0,0,0,0|2,0,0]=4 227 B9R1.69 CC1=C(Br)C=C(Cl)C=C1 JZ5771 [2,0,0,0,0,0|2,0,0]=4 228 B9R1.69 CC1=C(Br)C=CC(F)=C1 XJ0793 [2,0,0,0,0,0|2,0,0]=4 229 B9R1.69 CC1=C(Br)C=CC(O)=C1 YH34913 [2,0,0,0,0,0|2,0,0]=4 230 B9R1.69 CC1=C(C)C=C(O)C=C1 LQ0281 [2,0,0,0,0,0|1,0,0]=3 231 B9R1.69 CC1=C(Cl)C=C(F)C=C1 LT6493 [2,0,0,0,0,0|2,0,0]=4 232 B9R1.69 CC1=C(Cl)C=C(N)C=C1 LT2581 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.69 CC1=C(F)C=C(Br)C=C1 LQ5173 [2,0,0,0,0,0|2,0,0]=4 234 B9R1.69 CC1=C(F)C=C(N)C=C1 XJ0801 [2,0,0,0,0,0|2,0,0]=4 235 B9R1.69 CC1=C(F)C=CC(N)=C1 XJ0797 [2,0,0,0,0,0|2,0,0]=4 236 B9R1.69 CC1=C(N)C=C(F)C=C1 XJ0672 [2,0,0,0,0,0|1,0,0]=3 237 B9R1.69 CC1=C(N)C=CC(O)=C1 LT2719 [2,0,0,0,0,0|2,0,0]=4 238 B9R1.69 CC1=C(O)C=C(Cl)C=C1 YH05518 [2,0,0,0,0,0|2,0,0]=4 239 B9R1.69 CC1=C(O)C=CC(Br)=C1 LQ2103 [2,0,0,0,0,0|2,0,0]=4 240 B9R1.69 CC1=C(O)C=CC(O)=C1 LQ0285 [2,0,0,0,0,0|2,0,0]=4 241 B9R1.69 CC1=CC(=O)C=CC1=O HL0031 [2,0,0,0,0,0|2,0,0]=4 242 B9R1.69 CC1=CC(Br)=C(N)C=C1 LT1676 [2,0,0,0,0,0|2,0,0]=4 243 B9R1.69 CC1=CC(Br)=C(O)C=C1 YH12652 [2,0,0,0,0,0|2,0,0]=4 244 B9R1.69 CC1=CC(Br)=CC=C1F LQ5174 [2,0,0,0,0,0|2,0,0]=4 245 B9R1.69 CC1=CC(Br)=CC=C1N JZ3670 [2,0,0,0,0,0|2,0,0]=4 246 B9R1.69 CC1=CC(Br)=CC=C1N LT6207 [2,0,0,0,0,0|2,0,0]=4 247 B9R1.69 CC1=CC(C)=C(S)C=C1 JZ4786 [2,0,0,0,0,0|1,0,0]=3 248 B9R1.69 CC1=CC(C)=NC=C1N YH27545 [2,0,0,0,0,0|2,0,0]=4 249 B9R1.69 CC1=CC(Cl)=C(I)C=C1 HL3311 [2,0,0,0,0,0|2,0,0]=4 250 B9R1.69 CC1=CC(Cl)=CC=C1Br LT1934 [2,0,0,0,0,0|2,0,0]=4 251 B9R1.69 CC1=CC(Cl)=CC=C1Cl XJ4478 [2,0,0,0,0,0|2,0,0]=4 252 B9R1.69 CC1=CC(Cl)=CC=C1N LT6087 [2,0,0,0,0,0|2,0,0]=4 253 B9R1.69 CC1=CC(F)=C(Cl)C=C1 CJ2460 [2,0,0,0,0,0|2,0,0]=4 254 B9R1.69 CC1=CC(I)=CC=C1F XJ0796 [2,0,0,0,0,0|2,0,0]=4 255 B9R1.69 CC1=CC(I)=CC=C1N JZ3669 [2,0,0,0,0,0|2,0,0]=4 256 B9R1.69 CC1=CC(N)=C(I)C=C1 YH31788 [2,0,0,0,0,0|1,0,0]=3 257 B9R1.69 CC1=CC(N)=CC=C1Cl RT6370 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.69 CC1=CC(N)=CC=C1N LQ0284 [2,0,0,0,0,0|2,0,0]=4 259 B9R1.69 CC1=CC(N)=CC=C1N LT1172 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.69 CC1=CC(N)=CC=C1O LT2718 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.69 CC1=CC(O)=C(C)C=C1 LQ0291 [2,0,0,0,0,0|1,0,0]=3 262 B9R1.69 CC1=CC(O)=C(O)C=C1 XJ0808 [2,0,0,0,0,0|2,0,0]=4 263 B9R1.69 CC1=CC(O)=CC=C1Cl YH09016 [2,0,0,0,0,0|2,0,0]=4 264 B9R1.69 CC1=CC(O)=CC=C1I LX2207 [2,0,0,0,0,0|2,0,0]=4 265 B9R1.69 CC1=CC(S)=CC=C1O RT13148 [2,0,0,0,0,0|2,0,0]=4 266 B9R1.69 CC1=CC=C(Br)C(Br)=C1 JZ2179 [2,0,0,0,0,0|2,0,0]=4 267 B9R1.69 CC1=CC=C(Br)C=C1C XJ1013 [2,0,0,0,0,0|1,0,0]=3 268 B9R1.69 CC1=CC=C(Br)C=C1N XJ5349 [2,0,0,0,0,0|1,0,0]=3 269 B9R1.69 CC1=CC=C(C)C(Br)=C1 HL0030 [2,0,0,0,0,0|1,0,0]=3 270 B9R1.69 CC1=CC=C(C)C(C)=N1 LT3798 [2,0,0,0,0,0|1,0,0]=3 271 B9R1.69 CC1=CC=C(C)C(Cl)=C1 LT6510 [2,0,0,0,0,0|1,0,0]=3 272 B9R1.69 CC1=CC=C(Cl)C(C)=C1 LQ0282 [2,0,0,0,0,0|1,0,0]=3 273 B9R1.69 CC1=CC=C(Cl)C(O)=C1 LT2298 [2,0,0,0,0,0|2,0,0]=4 274 B9R1.69 CC1=CC=C(F)C(N)=C1 XJ0807 [2,0,0,0,0,0|1,0,0]=3 275 B9R1.69 CC1=CC=C(I)C(C)=C1 HL2726 [2,0,0,0,0,0|1,0,0]=3 276 B9R1.69 CC1=CC=C(N)C(C)=N1 LT6121 [2,0,0,0,0,0|2,0,0]=4 277 B9R1.69 CC1=CC=C(N)C(F)=C1 XJ0803 [2,0,0,0,0,0|2,0,0]=4 278 B9R1.69 CC1=CC=C(N)C=C1Br LT6727 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.69 CC1=CC=C(N)C=C1Cl JZ3196 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.69 CC1=CC=C(N)C=C1I LQ4886 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.69 CC1=CC=C(O)C(C)=N1 LT6321 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.69 CC1=CC=C(O)C(F)=C1 HL4211 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.69 CC1=CC=C(O)C=C1F XJ0802 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.69 CC1=CC=C([NH3+])C=C1[NH3+] XJ6043 [2,0,0,0,0,0|1,0,1]=4 285 B9R1.69 CC1=CN=C(Br)C(C)=C1 XJ6609 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.69 CC1=NC(N)=C(Br)C=C1 LQ5482 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.69 CC1=NC(N)=C(O)C=C1 YH44732 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.69 CC1=NC=C(Br)C=C1N LX2489 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 YH88167 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.69 NC1=C(Cl)C=CC(F)=C1 XJ0806 [2,0,0,0,0,0|2,0,0]=4 291 B9R1.69 NC1=C(Cl)C=CC(O)=C1 XJ4211 [2,0,0,0,0,0|2,0,0]=4 292 B9R1.69 NC1=C(F)C=CC(Cl)=C1 LQ2049 [2,0,0,0,0,0|2,0,0]=4 293 B9R1.69 NC1=C(F)C=CC(F)=C1 LT0148 [2,0,0,0,0,0|2,0,0]=4 294 B9R1.69 NC1=C(F)C=CC(O)=C1 M0400834 [2,0,0,0,0,0|2,0,0]=4 295 B9R1.69 NC1=C(N)C=C(Br)C=C1 LX3245 [2,0,0,0,0,0|2,0,0]=4 296 B9R1.69 NC1=C(N)C=C(Cl)C=C1 YH98156 [2,0,0,0,0,0|2,0,0]=4 297 B9R1.69 NC1=C(O)C=CC(Br)=C1 LT5832 [2,0,0,0,0,0|2,0,0]=4 298 B9R1.69 NC1=C(O)C=CC(Cl)=C1 LT0241 [2,0,0,0,0,0|2,0,0]=4 299 B9R1.69 NC1=C(O)C=CC(F)=C1 LQ0755 [2,0,0,0,0,0|2,0,0]=4 300 B9R1.69 NC1=CC(Cl)=CC=C1S HL0207 [2,0,0,0,0,0|2,0,0]=4 301 B9R1.69 NC1=CC(O)=CC=C1Br YH65969 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.69 NC1=CC=C(N)C(N)=C1 HL0206 [2,0,0,0,0,0|2,0,0]=4 303 B11R1.17 COCCC1=CC=CC=C1O RT11073 [1,1,0,0,0,0|2,0,0]=4 304 B11R1.17 FCCSC1=CC=CC=C1Br LT1460 [1,1,0,0,0,0|2,0,0]=4 305 B11R1.17 NCCOC1=CC=CC=C1O RT2926 [1,1,0,0,0,0|1,0,0]=3 306 B11R1.41 CCOC1=C(OC)C=CC=C1 YH65716 [1,1,0,0,0,0|2,0,0]=4 307 B11R1.41 CCOC1=CC=CC=C1CO XJ6252 [1,1,0,0,0,0|2,0,0]=4 308 B11R1.41 COC1=C(CC#N)C=CC=C1 XJ3232 [1,1,0,0,0,0|0,0,2]=4 309 B11R1.41 COC1=CC=CC=C1CC=O LQ4766 [1,1,0,0,0,0|1,0,1]=4 310 B11R1.41 O=CC1=C(CCBr)C=CC=C1 YH47917 [1,1,0,0,0,0|1,0,1]=4 311 B11R1.81 CCCC1=C(O)C=C(O)C=C1 LQ4152 [1,1,0,0,0,0|2,0,0]=4 312 B11R1.81 ClC1=CC(Br)=CC=C1CCI RT1162 [1,1,0,0,0,0|2,0,0]=4 313 B11R1.81 NOCC1=CC=C(Cl)C=C1Cl XJ5608 [1,1,0,0,0,0|2,0,0]=4 314 B11R1.81 OCCC1=CC=C(Br)C=C1Cl RT1161 [1,1,0,0,0,0|2,0,0]=4 315 B11R1.86 CC(N)CC1=CC=CC=C1F JZ4703 [1,1,0,0,0,0|1,0,0]=3 316 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 LT2142 [1,1,0,0,0,0|1,0,1]=4 317 B11R1.86 CC1=CC=CC=C1NC(N)=O HL0193 [1,1,0,0,0,0|1,0,1]=4 318 B11R1.222 CCC(C)C1=C(O)C=CC=C1 LL0208 [1,1,0,0,0,0|2,0,0]=4 319 B11R1.222 NCC(=O)C1=C(Br)C=CC=C1 YH08544 [1,1,0,0,0,0|1,0,1]=4 320 B11R1.222 NCC(=O)C1=C(Cl)C=CC=C1 HL4533 [1,1,0,0,0,0|1,0,1]=4 321 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 YH16342 [1,1,0,0,0,0|1,0,1]=4 322 B11R1.222 NCC(O)C1=CC=CC=C1F JZ2275 [1,1,0,0,0,0|1,0,0]=3 323 B11R1.605 OCCC1=C(F)C=CC=C1Cl LL2609 [1,1,0,0,0,0|2,0,0]=4 324 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 LQ3566 [1,1,0,0,0,0|1,0,1]=4 325 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 YH05716 [1,1,0,0,0,0|1,0,0]=3 326 B11R1.23 NCC(O)C1=CC(O)=CC=C1 RT2781 [1,1,0,0,0,0|1,0,0]=3 327 B11R1.24 COCCC1=CC(O)=CC=C1 RT10599 [1,1,0,0,0,0|2,0,0]=4 328 B11R1.24 FCCOC1=CC(Br)=CC=C1 LT1466 [1,1,0,0,0,0|2,0,0]=4 329 B11R1.24 OCCOC1=CC(O)=CC=C1 RT7314 [1,1,0,0,0,0|2,0,0]=4 330 B11R1.34 OCCC1=CC(Cl)=CC(Cl)=C1 YH96519 [1,1,0,0,0,0|2,0,0]=4 331 B11R1.157 CC(=O)CC1=CC=CC(C)=C1 LQ4107 [1,1,0,0,0,0|1,0,1]=4 332 B11R1.157 CC1=CC(CC(=O)O)=CC=C1 JZ3970 [1,1,0,0,0,0|1,0,1]=4 333 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 YH66558 [1,1,0,0,0,0|1,0,1]=4 334 B11R1.189 CCOC1=CC(CO)=CC=C1 XJ6249 [1,1,0,0,0,0|2,0,0]=4 335 B11R1.189 COC1=CC=CC(CC#N)=C1 LT3029 [1,1,0,0,0,0|0,0,2]=4 336 B11R1.189 COC1=CC=CC(CCN)=C1 XJ2033 [1,1,0,0,0,0|0,0,0]=2 337 B11R1.189 COC1=NC=CC(CCN)=C1 YH17803 [1,1,0,0,0,0|1,0,0]=3 338 B11R1.192 NCCC1=CC(O)=C(O)C=C1 XJ0012 [1,1,0,0,0,0|1,0,0]=3 339 B11R1.192 NCCC1=CC(S)=C(O)C=C1 RT16281 [1,1,0,0,0,0|1,0,0]=3 340 B11R1.192 OCCC1=CC=C(Cl)C(Cl)=C1 RT10962 [1,1,0,0,0,0|2,0,0]=4 341 B11R1.8 COC1=C(C)C(C)=CC(C)=C1 JZ5391 [1,1,0,0,0,0|1,0,0]=3 342 B11R1.8 NCC1=CC(F)=CC(F)=C1F HL3906 [1,1,0,0,0,0|2,0,0]=4 343 B11R1.37 CCC1=NC=C(C)N=C1CC JZ0972 [1,1,0,0,0,0|2,0,0]=4 344 B11R1.37 COC1=C(OC)C=C(F)C=C1 HL1782 [1,1,0,0,0,0|2,0,0]=4 345 B11R1.37 COC1=C(OC)C=C(N)C=C1 LT1835 [1,1,0,0,0,0|2,0,0]=4 346 B11R1.37 COC1=C(OC)C=C(O)C=C1 RT6475 [1,1,0,0,0,0|2,0,0]=4 347 B11R1.37 COC1=C(OC)C=C(S)C=C1 JZ4106 [1,1,0,0,0,0|2,0,0]=4 348 B11R1.37 COC1=CC(C)=CC=C1C=O YH07924 [1,1,0,0,0,0|1,0,1]=4 349 B11R1.72 COC1=C(F)C=CC(C)=C1F LL2714 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.72 NCC1=C(F)C=CC(F)=C1F YH48021 [1,1,0,0,0,0|2,0,0]=4 351 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 XJ0758 [1,1,0,0,0,0|1,0,1]=4 352 B11R1.167 CC(=O)C1=CC(C)=CC=C1O XJ1779 [1,1,0,0,0,0|1,0,1]=4 353 B11R1.167 CC1=CC(B(O)O)=C(C)C=C1 LT0159 [1,1,0,0,0,0|2,0,0]=4 354 B11R1.167 CC1=CC([C@H](C)N)=C(C)C=C1 YH65811 [1,1,0,0,0,0|0,0,0]=2 355 B11R1.167 CC1=CC=C(N)C(C(N)=O)=C1 YH00062 [1,1,0,0,0,0|1,0,1]=4 356 B11R1.167 CC1=CC=[N+](C)C=C1C(N)=O LL1890 [1,1,0,0,0,0|1,0,1]=4 357 B11R1.167 C[C@@H](N)C1=CC(Cl)=CC=C1O YH66241 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.167 C[C@H](N)C1=CC(Cl)=CC=C1O YH66579 [1,1,0,0,0,0|2,0,0]=4 359 B11R1.277 NCC1=CC(Cl)=C(F)C=C1F YH96019 [1,1,0,0,0,0|2,0,0]=4 360 B11R1.277 NCC1=CC(F)=C(F)C=C1F YH39099 [1,1,0,0,0,0|2,0,0]=4 361 B11R1.280 CCC1=CC(C#N)=CC=C1N YH39364 [1,1,0,0,0,0|1,0,1]=4 362 B11R1.280 CCC1=CC(OC)=CC=C1I YH98838 [1,1,0,0,0,0|1,0,0]=3 363 B11R1.280 COC1=C(Br)C=CC(CO)=C1 YH39531 [1,1,0,0,0,0|2,0,0]=4 364 B11R1.280 COC1=C(O)C=CC(CN)=C1 LT2726 [1,1,0,0,0,0|2,0,0]=4 365 B11R1.280 COC1=CC(CBr)=CC=C1F YH34087 [1,1,0,0,0,0|2,0,0]=4 366 B11R1.280 COC1=CC(OC)=C(I)C=C1 JZ5392 [1,1,0,0,0,0|2,0,0]=4 367 B11R1.280 COC1=CC=C(N)C(OC)=C1 XJ2288 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.230 CCCCC1=C(C)SC(C)=C1 LT0735 [0,1,0,0,1,0|2,0,0]=4 369 B13R1.876 CC1=CC(C)=C(C)C=C1CC(=O)O LT2309 [0,2,0,0,0,0|1,0,1]=4 370 B13R1.446 CNCC(O)C1=CC(O)=CC=C1Br RT3619 [0,2,0,0,0,0|2,0,0]=4 371 B13R1.446 CNC[C@H](O)C1=CC(O)=CC=C1Br RT1881 [0,2,0,0,0,0|2,0,0]=4 372 B13R1.656 CC1=CC=C(C)C(OCCCBr)=C1 RT6220 [0,2,0,0,0,0|1,0,0]=3 373 B11R2.10 C[C@@H]1CC2=C(C=CC=C2)N1 LT1106 [1,0,0,1,0,0|2,0,0]=4 374 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 LT1107 [1,0,0,1,0,0|2,0,0]=4 375 B11R2.10 NC1CC2=C(C=CC=C2)C1 HL2236 [1,0,0,1,0,0|0,0,0]=2 376 B11R2.10 NC1CC2=CC=CC=C2C1 XJ2313 [1,0,0,1,0,0|0,0,0]=2 377 B11R2.10 O=C1CC2=CC=CC=C2C1 JZ0697 [1,0,0,1,0,0|1,0,1]=4 378 B11R2.10 OC1CC2=CC=CC=C2C1 JZ0698 [1,0,0,1,0,0|1,0,0]=3 379 B11R2.20 C1=CC2=C(CNCC2)N=C1 YH32986 [1,0,0,1,0,0|1,0,0]=3 380 B11R2.20 C1=CN=C2CCCCC2=C1 LT0944 [1,0,0,1,0,0|2,0,0]=4 381 B11R2.20 C1=NC=C2CCCCC2=C1 LT0943 [1,0,0,1,0,0|2,0,0]=4 382 B11R2.20 C1=NC=C2CCNCC2=N1 YH18693 [1,0,0,1,0,0|2,0,0]=4 383 B11R2.20 C1=NC=C2CNCCC2=C1 YH24216 [1,0,0,1,0,0|1,0,0]=3 384 B11R2.20 C1=NC=C2CNCCC2=N1 YH43243 [1,0,0,1,0,0|2,0,0]=4 385 B11R2.55 ClC1=CC=CC=C1C2CO2 RT7261 [1,0,0,1,0,0|2,0,0]=4 386 B11R2.55 OC1=CC=CC=C1C2CO2 RT7911 [1,0,0,1,0,0|2,0,0]=4 387 B11R2.106 BrC1=CC=CC2=C1CCO2 RT9936 [1,0,0,1,0,0|2,0,0]=4 388 B11R2.106 CC1=C2N=CNC2=CC=C1 YH03213 [1,0,0,1,0,0|1,0,1]=4 389 B11R2.106 CC1=C2N=NNC2=CC=C1 RT8360 [1,0,0,1,0,0|2,0,0]=4 390 B11R2.106 CC1=CC=CC2=C1C=CN2 XJ4238 [1,0,0,1,0,0|0,0,2]=4 391 B11R2.106 FC1=CC=CC2=C1CCN2 YH65847 [1,0,0,1,0,0|1,0,0]=3 392 B11R2.106 OC1=C2CCOC2=CC=C1 YH34935 [1,0,0,1,0,0|2,0,0]=4 393 B11R2.35 ClC1=CC(C2CO2)=CC=C1 LQ5277 [1,0,0,1,0,0|2,0,0]=4 394 B11R2.35 ClC1=CC([C@@H]2CO2)=CC=C1 XJ5947 [1,0,0,1,0,0|2,0,0]=4 395 B11R2.36 BrC1=CC2=C(C=C1)NCC2 JZ5527 [1,0,0,1,0,0|1,0,0]=3 396 B11R2.36 CC1=CC2=C(C=C1)NCC2 YH12422 [1,0,0,1,0,0|0,0,0]=2 397 B11R2.36 CC1=CC2=C(C=C1)NN=N2 LL0574 [1,0,0,1,0,0|2,0,0]=4 398 B11R2.36 CC1=CC=C2NC=CC2=C1 HL0196 [1,0,0,1,0,0|0,0,2]=4 399 B11R2.36 ClC1=CC2=C(C=C1)NCC2 XJ4859 [1,0,0,1,0,0|1,0,0]=3 400 B11R2.36 FC1=CC2=C(C=C1)CCC2 RT10570 [1,0,0,1,0,0|2,0,0]=4 401 B11R2.36 FC1=CC=C2OCCC2=C1 HL3917 [1,0,0,1,0,0|2,0,0]=4 402 B11R2.36 NC1=CC2=C(C=C1)CCC2 YH49019 [1,0,0,1,0,0|2,0,0]=4 403 B13R2.5139 CC1=CC2=C(C1)C(C)=CC=C2C LX2147 [0,1,0,1,0,0|1,0,1]=4 404 B13R2.611 CC1=CC=C(C#N)C2=C1CCC2 RT15975 [0,1,0,1,0,0|1,0,1]=4 405 B13R2.5179 NC1=CC2=C(C=C1)C(=O)NCC2 RT2455 [0,1,0,1,0,0|1,0,1]=4 406 B13R2.5179 NC1CCCC2=C1C=CC(Br)=C2 YH66325 [0,1,0,1,0,0|2,0,0]=4 407 B13R2.5179 O=C1NCCC2=C1C=CC(F)=C2 YH66658 [0,1,0,1,0,0|1,0,1]=4 408 B13R2.5179 O=C1NCCC2=CC(Br)=CC=C12 RT2428 [0,1,0,1,0,0|1,0,1]=4 409 B13R2.2121 COC1=CC2=C(C=C1)NC(C)C2 RT8453 [0,1,0,1,0,0|2,0,0]=4 410 B13R2.162 NC1CCCC2=CC=C(Br)C=C21 YH90668 [0,1,0,1,0,0|2,0,0]=4 411 B13R2.162 OC1=CC2=C(C=C1)CNCC2O RT7840 [0,1,0,1,0,0|1,0,0]=3 412 B13R2.5151 CC1=CC=C(C)C2=C1CCC2=O LX2148 [0,1,0,1,0,0|1,0,0]=3 413 B13R2.371 FC1=CC=C(F)C2=C1CCNC2 YH66612 [0,1,0,1,0,0|2,0,0]=4 414 B13R2.3683 CC1CC2=CC=C(Br)C=C2CN1 YH89207 [0,1,0,1,0,0|2,0,0]=4 415 B13R2.3683 O=C1CCC2=CC(Br)=CC=C2C1 XJ2654 [0,1,0,1,0,0|2,0,0]=4 416 B13R2.32 OC1=C(Br)C2=C(C=C1)CNCC2 YH65455 [0,1,0,1,0,0|1,0,0]=3 417 B13R2.369 NC1=CC2=C(C=C1F)CNCC2 YH30072 [0,1,0,1,0,0|1,0,0]=3 418 B13R2.369 OC1=CC2=C(C=C1O)CNCC2 LT0754 [0,1,0,1,0,0|1,0,0]=3 419 B9R1.33 CN1C=NC=C1CCN RT4531 [1,0,0,0,1,0|2,0,0]=4 420 B9R1.22 CCN1N=C(C)C=C1C LQ4043 [1,0,0,0,1,0|2,0,0]=4 421 B9R1.27 CCC1=C(C)NC=C1C HL1948 [1,0,0,0,1,0|1,0,0]=3