0 B9R1.8 CCNC1=NC=CC=C1 BB31-5587 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.8 CNCC1=CC=NC=C1 BB52-3970 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.8 N#CCC1=CC=CN=N1 BB20-2554 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.8 N#CCC1=CN=NC=C1 BB31-0399 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.8 N#CCC1=NC=CN=C1 BB32-2625 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.8 NNCC1=NC=CC=C1 BB32-1215 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.8 N\N=C\C1=CC=CC=C1 BB32-2520 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.8 OCCC1=CN=CN=C1 BB31-8537 [0,0,0,0,0,0|2,0,2]=4 8 B8R1.2 BrCC1=NN=CC=C1 BB31-2836 [1,0,0,0,0,0|3,0,0]=4 9 B8R1.2 NCC1=CC=NC=C1 BB32-3106 [1,0,0,0,0,0|2,0,0]=3 10 B8R1.2 NCC1=CN=NC=C1 BB31-7658 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.2 NNC1=NC=CC=C1 BB52-0908 [1,0,0,0,0,0|3,0,0]=4 12 B8R1.2 O=CC1=NC=CC=N1 BB31-5137 [1,0,0,0,0,0|2,0,0]=3 13 B8R1.2 O=CC1=NC=NC=C1 BB31-4750 [1,0,0,0,0,0|2,0,0]=3 14 B8R1.2 O=CC1=NN=CC=C1 BB52-3335 [1,0,0,0,0,0|2,0,0]=3 15 B8R1.2 OCC1=CN=NC=C1 BB32-2361 [1,0,0,0,0,0|2,0,1]=4 16 B8R1.2 OCC1=NC=NC=C1 BB32-1282 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.1 C=CCC1=CC=C(O)C=C1 BB31-5055 [0,1,0,0,0,0|1,0,0]=2 18 B10R1.1 CC1=CC=C(SCCl)C=C1 BB31-6111 [0,1,0,0,0,0|2,0,1]=4 19 B10R1.1 CC1=CN=C(CC#N)C=C1 BB32-2135 [0,1,0,0,0,0|2,0,1]=4 20 B10R1.1 CC1=NC=C(CCO)C=C1 BB31-0061 [0,1,0,0,0,0|1,0,2]=4 21 B10R1.1 CSCC1=CC=C(F)C=C1 BB32-3225 [0,1,0,0,0,0|2,0,0]=3 22 B10R1.1 N#CCC1=CN=C(Br)C=C1 BB31-2820 [0,1,0,0,0,0|2,0,1]=4 23 B10R1.1 OCCC1=CN=C(Cl)C=C1 BB31-8395 [0,1,0,0,0,0|1,0,2]=4 24 B10R1.1 OCCC1=NC=C(Br)C=C1 BB31-8160 [0,1,0,0,0,0|1,0,2]=4 25 B10R1.4 CC1=C(CON)C=CC=C1 BB31-8696 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.4 CCNC1=C(O)C=CC=C1 BB31-4887 [0,1,0,0,0,0|2,0,1]=4 27 B10R1.4 CNCC1=C(O)C=CC=C1 BB31-5689 [0,1,0,0,0,0|2,0,0]=3 28 B10R1.4 N#CCC1=C(Br)C=NC=C1 BB32-0210 [0,1,0,0,0,0|2,0,1]=4 29 B10R1.4 N#CCC1=C(Cl)C=CC=N1 BB32-0418 [0,1,0,0,0,0|2,0,1]=4 30 B10R1.4 NOCC1=C(Cl)C=CC=C1 BB32-2623 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.4 OCCC1=C(I)C=CC=C1 BB31-4375 [0,1,0,0,0,0|0,0,2]=3 32 B10R1.4 O\N=C\C1=C(F)C=CC=C1 BB31-4287 [0,1,0,0,0,0|1,0,2]=4 33 B10R1.10 CCCC1=CC=CC(Br)=C1 BB31-3877 [0,1,0,0,0,0|1,0,1]=3 34 B10R1.10 CCCC1=CC=CC(F)=C1 BB31-4486 [0,1,0,0,0,0|1,0,1]=3 35 B10R1.10 CCOC1=CC=CC(S)=C1 BB31-5788 [0,1,0,0,0,0|2,0,1]=4 36 B10R1.10 COCC1=CC(Br)=NC=C1 BB31-1862 [0,1,0,0,0,0|3,0,0]=4 37 B10R1.10 N#CCC1=CC=CC(Br)=N1 BB31-8916 [0,1,0,0,0,0|2,0,1]=4 38 B10R1.10 N#CCC1=NC=CC(Br)=C1 BB32-1067 [0,1,0,0,0,0|2,0,1]=4 39 B10R1.10 NOCC1=CC=CC(Cl)=C1 BB31-4564 [0,1,0,0,0,0|2,0,0]=3 40 B10R1.10 NOCC1=CC=CC(F)=C1 BB32-2410 [0,1,0,0,0,0|2,0,0]=3 41 B10R1.15 C=C(CC)C1=CC=CC=C1 BB31-3793 [0,1,0,0,0,0|1,0,2]=4 42 B10R1.15 CCC(N)C1=CC=CN=C1 BB31-0914 [0,1,0,0,0,0|2,0,1]=4 43 B10R1.15 COC(=N)C1=CC=CC=C1 BB31-6235 [0,1,0,0,0,0|2,0,1]=4 44 B10R1.15 C[C@@H](CO)C1=CC=CC=C1 BB31-4000 [0,1,0,0,0,0|0,0,2]=3 45 B10R1.15 C[C@H](CO)C1=CC=CC=C1 BB31-5425 [0,1,0,0,0,0|0,0,2]=3 46 B10R1.15 NC(CO)C1=NC=CC=C1 BB31-5647 [0,1,0,0,0,0|1,0,2]=4 47 B10R1.17 CCCCC1=CC=CN=C1 BB31-4701 [0,1,0,0,0,0|2,0,1]=4 48 B10R1.17 ClCCSC1=NC=CC=C1 BB52-9581 [0,1,0,0,0,0|2,0,1]=4 49 B10R1.17 NCCCC1=CC=CN=C1 BB31-5719 [0,1,0,0,0,0|2,0,1]=4 50 B10R1.17 NCCNC1=NC=CC=C1 BB52-8028 [0,1,0,0,0,0|2,0,1]=4 51 B10R1.17 NCCOC1=CC=NC=C1 BB32-2674 [0,1,0,0,0,0|2,0,1]=4 52 B10R1.17 NCCOC1=NC=CC=C1 BB31-4550 [0,1,0,0,0,0|2,0,1]=4 53 B10R1.17 NCCSC1=NC=CC=C1 BB52-8924 [0,1,0,0,0,0|2,0,1]=4 54 B10R1.17 OCCSC1=NC=CC=C1 BB52-9072 [0,1,0,0,0,0|1,0,2]=4 55 B10R1.17 OC\C=C\C1=CC=NC=C1 BB32-0874 [0,1,0,0,0,0|1,0,2]=4 56 B10R1.17 OC\C=C\C1=CN=CC=C1 BB31-9453 [0,1,0,0,0,0|1,0,2]=4 57 B10R1.17 OC\C=C\C1=NC=CC=C1 BB31-1899 [0,1,0,0,0,0|1,0,2]=4 58 B10R1.18 CC(=O)CC1=CN=CC=C1 BB32-2986 [0,1,0,0,0,0|1,0,0]=2 59 B10R1.18 CC(C)CC1=NC=CC=C1 BB31-5691 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.18 N=C(N)CC1=CC=CN=C1 BB52-5807 [0,1,0,0,0,0|2,0,0]=3 61 B10R1.18 N=C(N)CC1=NC=CC=C1 BB52-5801 [0,1,0,0,0,0|2,0,0]=3 62 B10R1.18 O=C(O)CC1=NC=CN=C1 BB31-2541 [0,1,0,0,0,0|2,0,0]=3 63 B10R2.7 C1=CC2=C(C=C1)SCS2 BB32-1488 [0,0,0,1,0,0|1,1,1]=4 64 B10R2.7 C1=CC2=C(C=N1)CCN2 BB31-4247 [0,0,0,1,0,0|2,0,1]=4 65 B10R2.7 C1=CC2=C(C=N1)CCN2 BB32-3376 [0,0,0,1,0,0|2,0,1]=4 66 B10R2.7 C1=CC2=C(C=N1)CNC2 BB32-2969 [0,0,0,1,0,0|3,0,0]=4 67 B10R2.7 C1=CC2=C(C=N1)N=CS2 BB31-6310 [0,0,0,1,0,0|2,1,0]=4 68 B10R2.7 C1=CC2=C(C=N1)NCC2 BB31-4675 [0,0,0,1,0,0|2,0,1]=4 69 B10R2.7 C1=CC2=C(N=C1)N=CS2 BB32-1269 [0,0,0,1,0,0|2,1,0]=4 70 B10R2.7 C1=CC2=CC=CN2C=C1 BB31-6185 [0,0,0,1,0,0|2,0,1]=4 71 B10R2.7 C1=CN=C2CCNC2=C1 BB31-9759 [0,0,0,1,0,0|2,0,1]=4 72 B10R2.7 C1=CN=C2CCNC2=C1 BB32-0564 [0,0,0,1,0,0|2,0,1]=4 73 B10R2.7 C1=CN=C2OC=NC2=C1 BB31-6281 [0,0,0,1,0,0|2,0,1]=4 74 B10R2.7 C1=CN=C2SC=NC2=C1 BB32-1268 [0,0,0,1,0,0|2,1,0]=4 75 B8R1.8 BrCCN1C=CC=C1 BB31-5450 [0,0,0,0,1,0|2,0,1]=4 76 B8R1.8 OCCC1=COC=C1 BB31-4913 [0,0,0,0,1,0|1,0,2]=4 77 B7R1.3 O=C1C=COC=C1 BB31-5938 [2,0,0,0,0,0|1,0,0]=3 78 B9R1.1 C#CC1=CC=C(O)C=C1 BB32-1037 [1,1,0,0,0,0|0,0,2]=4 79 B9R1.1 C=CC1=CC=C(I)C=C1 BB31-4240 [1,1,0,0,0,0|0,0,1]=3 80 B9R1.1 C=CC1=CN=C(F)C=C1 BB31-0349 [1,1,0,0,0,0|1,0,1]=4 81 B9R1.1 C=CC1=NC=C(C)C=C1 BB32-1317 [1,1,0,0,0,0|1,0,1]=4 82 B9R1.1 CC1=NC=C(C=O)C=N1 BB52-2214 [1,1,0,0,0,0|2,0,0]=4 83 B9R1.1 CCC1=CN=C(N)C=C1 BB31-3880 [1,1,0,0,0,0|1,0,1]=4 84 B9R1.1 ClCC1=CN=C(Br)C=C1 BB31-3358 [1,1,0,0,0,0|2,0,0]=4 85 B9R1.1 NC1=CN=C(CO)C=C1 BB31-5981 [1,1,0,0,0,0|1,0,1]=4 86 B9R1.1 NC1=NC=C(C=O)C=N1 BB52-2221 [1,1,0,0,0,0|2,0,0]=4 87 B9R1.1 NCC1=CN=C(Br)C=C1 BB31-1130 [1,1,0,0,0,0|2,0,0]=4 88 B9R1.1 NCC1=CN=C(N)C=C1 BB31-2999 [1,1,0,0,0,0|2,0,0]=4 89 B9R1.1 NCC1=NC=C(Br)C=C1 BB31-1026 [1,1,0,0,0,0|2,0,0]=4 90 B9R1.1 O=C1C=CC(CO)=CN1 BB31-8238 [1,1,0,0,0,0|1,0,1]=4 91 B9R1.1 O=CC1=CNC(=O)N=C1 BB31-3327 [1,1,0,0,0,0|2,0,0]=4 92 B9R1.1 O=CC1=NC=C(Br)C=N1 BB31-5037 [1,1,0,0,0,0|2,0,0]=4 93 B9R1.1 O=CC1=NN=C(Cl)C=C1 BB31-4584 [1,1,0,0,0,0|2,0,0]=4 94 B9R1.1 OCC1=NC=C(O)C=C1 BB31-5168 [1,1,0,0,0,0|1,0,1]=4 95 B9R1.2 C=CC1=CC=CC(N)=C1 BB31-5821 [1,1,0,0,0,0|0,0,1]=3 96 B9R1.2 C=CC1=NC=CC(Br)=C1 BB32-2820 [1,1,0,0,0,0|1,0,1]=4 97 B9R1.2 CC1=CC(CN)=NC=C1 BB31-1290 [1,1,0,0,0,0|2,0,0]=4 98 B9R1.2 CC1=CC(CO)=NC=C1 BB32-1316 [1,1,0,0,0,0|1,0,1]=4 99 B9R1.2 CC1=CC=CC(CN)=N1 BB31-6651 [1,1,0,0,0,0|2,0,0]=4 100 B9R1.2 CC1=CN=CC(C=O)=N1 BB31-0483 [1,1,0,0,0,0|2,0,0]=4 101 B9R1.2 CCC1=CC(Br)=CN=C1 BB31-9522 [1,1,0,0,0,0|1,0,1]=4 102 B9R1.2 CCC1=CC(Cl)=NC=C1 BB32-1661 [1,1,0,0,0,0|1,0,1]=4 103 B9R1.2 CCC1=CN=CC(N)=C1 BB31-9128 [1,1,0,0,0,0|1,0,1]=4 104 B9R1.2 CCC1=NC=CC(N)=C1 BB32-2549 [1,1,0,0,0,0|1,0,1]=4 105 B9R1.2 CNC1=CC=CC(I)=C1 BB32-3582 [1,1,0,0,0,0|1,0,1]=4 106 B9R1.2 CNC1=CC=CC(O)=C1 BB31-2612 [1,1,0,0,0,0|1,0,1]=4 107 B9R1.2 FC1=NC=CC(CBr)=C1 BB32-3508 [1,1,0,0,0,0|2,0,0]=4 108 B9R1.2 FC1=NC=CC(CCl)=C1 BB32-0849 [1,1,0,0,0,0|2,0,0]=4 109 B9R1.2 NC1=NC=CC(CO)=C1 BB52-8583 [1,1,0,0,0,0|1,0,1]=4 110 B9R1.2 NCC1=CC(Br)=NC=C1 BB31-6738 [1,1,0,0,0,0|2,0,0]=4 111 B9R1.2 NCC1=CC(F)=CN=C1 BB31-4246 [1,1,0,0,0,0|2,0,0]=4 112 B9R1.2 NCC1=CC=CC(Cl)=N1 BB31-2965 [1,1,0,0,0,0|2,0,0]=4 113 B9R1.2 NCC1=CC=CC(Cl)=N1 BB32-0593 [1,1,0,0,0,0|2,0,0]=4 114 B9R1.2 NCC1=CC=CC(F)=N1 BB31-1286 [1,1,0,0,0,0|2,0,0]=4 115 B9R1.2 NCC1=CC=CC(N)=N1 BB31-3343 [1,1,0,0,0,0|2,0,0]=4 116 B9R1.2 O=CC1=CC=CC(=O)N1 BB32-1723 [1,1,0,0,0,0|1,0,0]=3 117 B9R1.2 O=CC1=CN=CC(O)=C1 BB31-6018 [1,1,0,0,0,0|1,0,0]=3 118 B9R1.2 OCC1=CC(Br)=CN=C1 BB31-7619 [1,1,0,0,0,0|1,0,1]=4 119 B9R1.6 C=C(C)C1=CC=CN=C1 BB32-0833 [1,1,0,0,0,0|1,0,1]=4 120 B9R1.6 CC(=O)C1=NC=NC=C1 BB32-1309 [1,1,0,0,0,0|2,0,0]=4 121 B9R1.6 CC(=O)C1=NN=CC=C1 BB31-8246 [1,1,0,0,0,0|2,0,0]=4 122 B9R1.6 C[C@@H](N)C1=CC=NC=C1 BB31-0181 [1,1,0,0,0,0|1,0,1]=4 123 B9R1.6 C[C@@H](N)C1=NC=CC=C1 BB31-9751 [1,1,0,0,0,0|1,0,1]=4 124 B9R1.15 C=CC1=NC=CC=C1C BB32-1725 [1,1,0,0,0,0|1,0,1]=4 125 B9R1.15 CC1=C(CN)C=NC=C1 BB31-2786 [1,1,0,0,0,0|2,0,0]=4 126 B9R1.15 CC1=C(CO)C=CN=C1 BB32-1626 [1,1,0,0,0,0|1,0,1]=4 127 B9R1.15 CC1=NC=CN=C1C=O BB32-1077 [1,1,0,0,0,0|2,0,0]=4 128 B9R1.15 ClCC1=C(Cl)C=CC=N1 BB31-1049 [1,1,0,0,0,0|2,0,0]=4 129 B9R1.15 NC1=C(CO)C=CN=C1 BB31-8031 [1,1,0,0,0,0|1,0,1]=4 130 B9R1.15 NC1=CC=CN=C1C=O BB31-4893 [1,1,0,0,0,0|1,0,0]=3 131 B9R1.15 NC1=CC=CN=C1CO BB31-5760 [1,1,0,0,0,0|1,0,1]=4 132 B9R1.15 NC1=NC=CN=C1C=O BB31-5072 [1,1,0,0,0,0|2,0,0]=4 133 B9R1.15 NCC1=C(F)C=CC=N1 BB32-1717 [1,1,0,0,0,0|2,0,0]=4 134 B9R1.15 NCC1=C(F)C=NC=C1 BB31-8560 [1,1,0,0,0,0|2,0,0]=4 135 B9R1.15 NCC1=CC=CN=C1Br BB31-3840 [1,1,0,0,0,0|2,0,0]=4 136 B9R1.15 NCC1=CC=CN=C1F BB31-3839 [1,1,0,0,0,0|2,0,0]=4 137 B9R1.15 NCC1=CC=CN=C1F BB31-6576 [1,1,0,0,0,0|2,0,0]=4 138 B9R1.15 NCC1=CC=CNC1=O BB31-8567 [1,1,0,0,0,0|2,0,0]=4 139 B9R1.15 NNC1=C(I)C=CC=C1 BB32-3554 [1,1,0,0,0,0|2,0,0]=4 140 B9R1.15 O=C1NC=CC=C1CO BB32-1653 [1,1,0,0,0,0|1,0,1]=4 141 B9R1.15 OCC1=C(Cl)C=NC=C1 BB31-5373 [1,1,0,0,0,0|1,0,1]=4 142 B9R1.15 OCC1=C(O)C=NC=C1 BB32-1573 [1,1,0,0,0,0|1,0,1]=4 143 B9R1.11 O=CC(=O)C1=CC=CO1 BB31-8251 [0,1,0,0,1,0|1,0,1]=4 144 B9R1.13 CC(=O)CN1C=CN=C1 BB52-8511 [0,1,0,0,1,0|2,0,0]=4 145 B9R1.13 O=C(O)CC1=NC=CS1 BB31-4063 [0,1,0,0,1,0|2,0,0]=4 146 B9R1.13 O=C(O)CC1=NNC=C1 BB31-0343 [0,1,0,0,1,0|2,0,0]=4 147 B9R1.13 O=C(O)CN1C=CC=N1 BB52-7773 [0,1,0,0,1,0|2,0,0]=4 148 B11R1.1 C#CCOC1=CC=C(Cl)C=C1 BB31-8208 [0,2,0,0,0,0|1,0,1]=4 149 B11R1.1 C#CCOC1=CC=C(F)C=C1 BB31-1095 [0,2,0,0,0,0|1,0,1]=4 150 B11R1.1 C=CCOC1=CC=C(C)C=C1 BB31-4230 [0,2,0,0,0,0|1,0,0]=3 151 B11R1.1 CC1=CC=C(OCCBr)C=C1 BB31-4045 [0,2,0,0,0,0|1,0,1]=4 152 B11R1.1 CCNCC1=CC=C(O)C=C1 BB31-5883 [0,2,0,0,0,0|1,0,1]=4 153 B11R1.1 ClCCCC1=CC=C(Br)C=C1 BB31-4830 [0,2,0,0,0,0|1,0,1]=4 154 B11R1.1 O=CCCC1=CC=C(Br)C=C1 BB31-6794 [0,2,0,0,0,0|0,0,0]=2 155 B11R1.1 O=C\C=C\C1=CC=C(O)C=C1 BB32-1043 [0,2,0,0,0,0|0,0,1]=3 156 B11R1.1 OCCCC1=CC=C(F)C=C1 BB31-7183 [0,2,0,0,0,0|0,0,2]=4 157 B11R1.20 CC(=O)NC1=NC=C(I)C=C1 BB32-3681 [0,2,0,0,0,0|2,0,0]=4 158 B11R1.20 CC(C)CC1=CC=C(N)C=C1 BB32-1078 [0,2,0,0,0,0|1,0,1]=4 159 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 BB32-3859 [0,2,0,0,0,0|0,0,0]=2 160 B11R1.20 NC(=O)CC1=NC=C(Br)C=C1 BB31-9657 [0,2,0,0,0,0|1,0,0]=3 161 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 BB31-0029 [0,2,0,0,0,0|1,0,0]=3 162 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 BB31-0032 [0,2,0,0,0,0|1,0,0]=3 163 B11R1.22 CC[C@@H](N)C1=CC=C(F)C=C1 BB31-0492 [0,2,0,0,0,0|1,0,1]=4 164 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 BB31-0570 [0,2,0,0,0,0|1,0,1]=4 165 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 BB31-4005 [0,2,0,0,0,0|0,0,2]=4 166 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 BB32-2415 [0,2,0,0,0,0|0,0,1]=3 167 B11R1.22 OC(CCl)C1=CC=C(Cl)C=C1 BB32-3014 [0,2,0,0,0,0|1,0,1]=4 168 B11R1.81 O=CNC1=C(Br)C=C(Br)C=N1 BB32-2813 [0,2,0,0,0,0|2,0,0]=4 169 B11R1.83 COC1=CC=C(CC=O)C=C1 BB32-2943 [0,2,0,0,0,0|0,0,0]=2 170 B11R1.83 COC1=CC=C(CNO)C=C1 BB32-2374 [0,2,0,0,0,0|1,0,1]=4 171 B11R1.83 N#CCC1=CC=C(CO)C=C1 BB31-2817 [0,2,0,0,0,0|1,0,1]=4 172 B11R1.192 FC1=C(Cl)C=C(CCBr)C=C1 BB31-1487 [0,2,0,0,0,0|1,0,1]=4 173 B11R1.192 OCCC1=CC(F)=C(Cl)C=C1 BB31-4082 [0,2,0,0,0,0|0,0,2]=4 174 B11R1.13 CC1=C(I)C=CC=C1CC#N BB31-1517 [0,2,0,0,0,0|1,0,1]=4 175 B11R1.17 C#CCOC1=C(O)C=CC=C1 BB31-2647 [0,2,0,0,0,0|1,0,1]=4 176 B11R1.17 CC1=C(CCCO)C=CC=C1 BB32-0475 [0,2,0,0,0,0|0,0,2]=4 177 B11R1.17 CCCOC1=C(N)C=CC=C1 BB31-5710 [0,2,0,0,0,0|1,0,1]=4 178 B11R1.17 CCNCC1=C(O)C=CC=C1 BB31-9257 [0,2,0,0,0,0|1,0,1]=4 179 B11R1.17 COCCC1=C(O)C=CC=C1 BB32-1663 [0,2,0,0,0,0|0,0,2]=4 180 B11R1.17 COCOC1=C(N)C=CC=C1 BB31-6383 [0,2,0,0,0,0|2,0,0]=4 181 B11R1.17 NCCCC1=C(Br)C=CC=C1 BB31-5716 [0,2,0,0,0,0|1,0,1]=4 182 B11R1.17 OCCCC1=C(Cl)C=CC=C1 BB32-3226 [0,2,0,0,0,0|0,0,2]=4 183 B11R1.17 OCCCC1=C(F)C=CC=C1 BB31-8703 [0,2,0,0,0,0|0,0,2]=4 184 B11R1.41 C=CCC1=C(OC)C=CC=C1 BB31-5643 [0,2,0,0,0,0|1,0,0]=3 185 B11R1.41 CCC1=C(CC#N)C=CC=C1 BB31-6896 [0,2,0,0,0,0|1,0,1]=4 186 B11R1.41 CNCC1=C(CO)C=CC=C1 BB31-5635 [0,2,0,0,0,0|2,0,0]=4 187 B11R1.41 COC1=C(CC=O)C=CC=C1 BB31-5558 [0,2,0,0,0,0|0,0,0]=2 188 B11R1.41 COC1=C(CCBr)C=CC=C1 BB32-1701 [0,2,0,0,0,0|1,0,1]=4 189 B11R1.41 N#CC1=C(CCO)C=CC=C1 BB31-7734 [0,2,0,0,0,0|0,0,2]=4 190 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 BB31-8198 [0,2,0,0,0,0|1,0,0]=3 191 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 BB12-7660 [0,2,0,0,0,0|1,0,0]=3 192 B11R1.86 CC(C)CC1=C(N)C=CC=C1 BB31-7006 [0,2,0,0,0,0|1,0,1]=4 193 B11R1.86 O=C(O)CC1=C(Cl)C=CC=N1 BB31-5786 [0,2,0,0,0,0|1,0,0]=3 194 B11R1.86 O=C(O)CC1=C(F)C=CC=N1 BB31-0028 [0,2,0,0,0,0|1,0,0]=3 195 B11R1.86 O=C(O)CN1C=CC=CC1=O BB52-8012 [0,2,0,0,0,0|1,0,0]=3 196 B11R1.86 O=C(O)CN1N=CC=CC1=O BB54-2728 [0,2,0,0,0,0|2,0,0]=4 197 B11R1.182 CNCC1=C(O)C=CC(F)=C1 BB31-1974 [0,2,0,0,0,0|2,0,0]=4 198 B11R1.222 CC1=C(C(=O)C=O)C=CC=C1 BB32-3322 [0,2,0,0,0,0|0,0,1]=3 199 B11R1.222 CC1=C(N(C)C=O)C=CC=C1 BB31-1907 [0,2,0,0,0,0|1,0,0]=3 200 B11R1.222 N[C@H](CO)C1=C(F)C=CC=C1 BB31-1755 [0,2,0,0,0,0|0,0,2]=4 201 B11R1.605 C=CCC1=C(I)C=CN=C1F BB32-1649 [0,2,0,0,0,0|2,0,0]=4 202 B11R1.605 CCCC1=C(O)C=CC=C1O BB31-2128 [0,2,0,0,0,0|1,0,1]=4 203 B11R1.605 NOCC1=C(Cl)C=CC=C1Cl BB31-4056 [0,2,0,0,0,0|2,0,0]=4 204 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 BB31-3734 [0,2,0,0,0,0|0,0,2]=4 205 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 BB31-9590 [0,2,0,0,0,0|0,0,2]=4 206 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 BB31-4154 [0,2,0,0,0,0|0,0,2]=4 207 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 BB32-0148 [0,2,0,0,0,0|0,0,2]=4 208 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 BB32-1793 [0,2,0,0,0,0|0,0,2]=4 209 B11R1.24 CC1=CC=CC(NCCO)=C1 BB17-0632 [0,2,0,0,0,0|0,0,2]=4 210 B11R1.24 COCCC1=CC(O)=CC=C1 BB32-1678 [0,2,0,0,0,0|0,0,2]=4 211 B11R1.24 N#CCCC1=CC=CC(F)=C1 BB32-0937 [0,2,0,0,0,0|1,0,1]=4 212 B11R1.24 NCCCC1=CC=CC(Br)=C1 BB31-3431 [0,2,0,0,0,0|1,0,1]=4 213 B11R1.24 O=CCCC1=CC=CC(Br)=C1 BB31-4155 [0,2,0,0,0,0|0,0,0]=2 214 B11R1.24 OCCCC1=CC=CC(Br)=C1 BB32-3048 [0,2,0,0,0,0|0,0,2]=4 215 B11R1.24 OCCCC1=CC=CC(Cl)=C1 BB31-4195 [0,2,0,0,0,0|0,0,2]=4 216 B11R1.24 OCCCC1=CC=CC(F)=C1 BB31-2996 [0,2,0,0,0,0|0,0,2]=4 217 B11R1.34 CCCC1=CC(O)=CC(O)=C1 BB31-7608 [0,2,0,0,0,0|1,0,1]=4 218 B11R1.34 NNCC1=CC(F)=CC(F)=C1 BB32-0514 [0,2,0,0,0,0|2,0,0]=4 219 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 BB31-0336 [0,2,0,0,0,0|2,0,0]=4 220 B11R1.157 CC(=O)NC1=NC=CC(I)=C1 BB31-6635 [0,2,0,0,0,0|2,0,0]=4 221 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 BB31-5028 [0,2,0,0,0,0|2,0,0]=4 222 B11R1.157 CC(=O)OC1=CC=CC(Cl)=C1 BB31-1635 [0,2,0,0,0,0|1,0,0]=3 223 B11R1.157 NC(=O)NC1=CC=CC(Br)=C1 BB31-5775 [0,2,0,0,0,0|1,0,0]=3 224 B11R1.157 O=C(O)CC1=CC(Br)=CN=C1 BB31-4723 [0,2,0,0,0,0|1,0,0]=3 225 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 BB32-2011 [0,2,0,0,0,0|1,0,0]=3 226 B11R1.157 O=C(O)CC1=CC=CC(Cl)=N1 BB31-6394 [0,2,0,0,0,0|1,0,0]=3 227 B11R1.157 O=C(O)CC1=CC=CC(F)=N1 BB31-0031 [0,2,0,0,0,0|1,0,0]=3 228 B11R1.189 COC1=CC=CC(CC=O)=C1 BB32-3005 [0,2,0,0,0,0|0,0,0]=2 229 B11R1.189 COC1=CC=CC(CON)=C1 BB32-1643 [0,2,0,0,0,0|2,0,0]=4 230 B11R1.12 CCC(C=O)C1=CC=CC=C1 BB31-7584 [0,2,0,0,0,0|0,0,0]=2 231 B11R1.16 COCC(=O)C1=CC=CC=C1 BB31-5695 [0,2,0,0,0,0|2,0,0]=4 232 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 BB31-7522 [0,2,0,0,0,0|0,0,2]=4 233 B11R1.16 COC[C@H](N)C1=CC=CC=C1 BB32-3222 [0,2,0,0,0,0|0,0,2]=4 234 B11R1.16 N#CCC(O)C1=CC=CC=C1 BB31-7914 [0,2,0,0,0,0|1,0,1]=4 235 B11R1.16 OCCC(O)C1=CC=CC=C1 BB32-2523 [0,2,0,0,0,0|0,0,2]=4 236 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 BB32-1369 [0,2,0,0,0,0|0,0,0]=2 237 B11R1.36 CC(C)C(C)C1=CC=CC=C1 BB31-5345 [0,2,0,0,0,0|1,0,1]=4 238 B11R1.36 CC(C)[C@@H](N)C1=CC=CC=C1 BB31-5054 [0,2,0,0,0,0|1,0,1]=4 239 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 BB31-7042 [0,2,0,0,0,0|1,0,1]=4 240 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 BB31-5646 [0,2,0,0,0,0|1,0,0]=3 241 B11R1.28 C#CCNCC1=CC=CC=C1 BB31-1370 [0,2,0,0,0,0|1,0,1]=4 242 B11R1.28 CCCC#CC1=CC=CC=C1 BB31-3592 [0,2,0,0,0,0|1,0,1]=4 243 B11R1.28 NCCCOC1=CC=CC=C1 BB31-8683 [0,2,0,0,0,0|1,0,1]=4 244 B11R1.28 OCCC#CC1=CC=CC=C1 BB31-0301 [0,2,0,0,0,0|0,0,2]=4 245 B11R1.40 CC(C#N)NC1=CC=CC=C1 BB32-1220 [0,2,0,0,0,0|1,0,1]=4 246 B11R1.40 NCC(=O)CC1=CC=CC=C1 BB31-4674 [0,2,0,0,0,0|0,0,0]=2 247 B11R1.40 NCC(O)CC1=CC=CC=C1 BB32-2349 [0,2,0,0,0,0|0,0,2]=4 248 B11R1.40 NNC(=O)OC1=CC=CC=C1 BB31-5306 [0,2,0,0,0,0|1,0,0]=3 249 B11R1.40 O=C(CO)NC1=CC=CC=C1 BB32-2558 [0,2,0,0,0,0|1,0,0]=3 250 B11R1.91 NC(=O)CCC1=CN=CC=C1 BB31-6760 [0,2,0,0,0,0|1,0,0]=3 251 B11R1.91 NC(=O)CNC1=CC=CC=C1 BB32-1447 [0,2,0,0,0,0|0,0,0]=2 252 B11R1.91 O=C(O)C#CC1=CC=NC=C1 BB31-5726 [0,2,0,0,0,0|1,0,1]=4 253 B11R1.91 O=C(O)C#CC1=CN=CC=C1 BB32-3318 [0,2,0,0,0,0|1,0,1]=4 254 B11R1.91 O=C(O)CCC1=CC=NC=C1 BB52-8563 [0,2,0,0,0,0|1,0,0]=3 255 B11R1.91 O=C(O)CCC1=NC=CC=C1 BB52-8590 [0,2,0,0,0,0|1,0,0]=3 256 B11R1.91 O=C(O)COC1=CN=CC=C1 BB31-6546 [0,2,0,0,0,0|1,0,0]=3 257 B11R1.91 O=C(O)CSC1=NC=CC=C1 BB52-3334 [0,2,0,0,0,0|1,0,0]=3 258 B11R1.91 O=C(O)CSC1=NC=CC=N1 BB52-1566 [0,2,0,0,0,0|2,0,0]=4 259 B11R1.509 CS(=N)(=O)CC1=CC=CC=C1 BB31-7855 [0,2,0,0,0,0|1,0,0]=3 260 B11R1.509 NS(=O)(=O)CC1=CN=CC=C1 BB32-3972 [0,2,0,0,0,0|2,0,0]=4 261 B11R1.509 O=S(=O)([O-])OC1=CC=CC=C1 BB31-3395 [0,2,0,0,0,0|2,0,0]=4 262 B11R2.36 BrC1=CC2=C(C=C1)CC=C2 BB31-6902 [0,1,0,1,0,0|1,0,0]=3 263 B11R2.36 BrC1=CC2=C(C=C1)CCC2 BB32-3362 [0,1,0,1,0,0|1,0,1]=4 264 B11R2.36 BrC1=CC2=C(C=C1)COC2 BB32-1135 [0,1,0,1,0,0|2,0,0]=4 265 B11R2.36 BrC1=CC2=C(C=CC2)C=C1 BB31-4988 [0,1,0,1,0,0|1,0,0]=3 266 B11R2.36 CC1=CC2=C(C=C1)CCN2 BB31-6620 [0,1,0,1,0,0|1,0,1]=4 267 B11R2.36 CC1=CC2=C(C=C1)N=CS2 BB31-4548 [0,1,0,1,0,0|1,1,0]=4 268 B11R2.36 CC1=CC2=C(C=C1)SC=N2 BB31-4547 [0,1,0,1,0,0|1,1,0]=4 269 B11R2.36 ClC1=CC2=C(C=C1)CCN2 BB31-6044 [0,1,0,1,0,0|1,0,1]=4 270 B11R2.36 ClC1=CC2=C(C=C1)CCO2 BB31-4520 [0,1,0,1,0,0|0,0,2]=4 271 B11R2.36 ClC1=CC2=C(C=C1)OC=C2 BB31-4209 [0,1,0,1,0,0|0,0,2]=4 272 B11R2.36 IC1=CC2=C(C=C1)CCN2 BB31-0658 [0,1,0,1,0,0|1,0,1]=4 273 B11R2.36 NC1=CC2=C(C=C1)CCO2 BB32-3369 [0,1,0,1,0,0|0,0,2]=4 274 B11R2.36 NC1=CC2=C(C=CO2)C=C1 BB31-9315 [0,1,0,1,0,0|0,0,2]=4 275 B11R2.36 NC1=CC2=C(C=CS2)C=C1 BB32-2692 [0,1,0,1,0,0|0,1,1]=4 276 B11R2.36 NC1=CC=C2N=CNC2=C1 BB52-1069 [0,1,0,1,0,0|2,0,0]=4 277 B11R2.36 OC1=CC2=C(C=C1)CCN2 BB32-2364 [0,1,0,1,0,0|1,0,1]=4 278 B11R2.36 OC1=CC2=C(C=C1)CCO2 BB31-4258 [0,1,0,1,0,0|0,0,2]=4 279 B11R2.36 OC1=CC2=C(C=C1)OC=N2 BB32-0783 [0,1,0,1,0,0|1,0,1]=4 280 B11R2.36 OC1=CC2=C(C=C1)SC=C2 BB32-0598 [0,1,0,1,0,0|0,1,1]=4 281 B11R2.36 OC1=CC2=C(C=C1)SC=N2 BB31-4836 [0,1,0,1,0,0|1,1,0]=4 282 B11R2.36 OC1=CC2=C(C=CO2)C=C1 BB31-1913 [0,1,0,1,0,0|0,0,2]=4 283 B11R2.10 BrC1=CC2=C(C=CC=C2)N1 BB31-2458 [0,1,0,1,0,0|1,0,1]=4 284 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 BB32-2216 [0,1,0,1,0,0|0,0,2]=4 285 B11R2.10 BrC1CC2=C(C=CC=C2)C1 BB31-3617 [0,1,0,1,0,0|1,0,1]=4 286 B11R2.10 CC1CC2=C(C=CC=C2)C1 BB31-4827 [0,1,0,1,0,0|1,0,1]=4 287 B11R2.10 IC1=CC2=C(C=CC=C2)N1 BB31-4420 [0,1,0,1,0,0|1,0,1]=4 288 B11R2.10 IC1=CC2=C(C=CC=C2)S1 BB32-1612 [0,1,0,1,0,0|0,1,1]=4 289 B11R2.10 NC1=NC2=CC=CC=C2O1 BB52-8718 [0,1,0,1,0,0|1,0,1]=4 290 B11R2.10 O=C1CC2=C(C=CC=N2)N1 BB31-4947 [0,1,0,1,0,0|1,0,0]=3 291 B11R2.10 O=C1CC2=C(C=NC=C2)N1 BB32-2391 [0,1,0,1,0,0|1,0,0]=3 292 B11R2.10 O=C1CC2=C(N=CN=C2)N1 BB32-3551 [0,1,0,1,0,0|2,0,0]=4 293 B11R2.10 O=C1NC2=C(C=NC=C2)O1 BB32-3787 [0,1,0,1,0,0|2,0,0]=4 294 B11R2.10 O=C1O[N+]2=C(C=CC=C2)S1 BB31-5543 [0,1,0,1,0,0|2,0,0]=4 295 B11R2.10 S=C1CC2=C(C=CC=C2)N1 BB32-2281 [0,1,0,1,0,0|0,1,0]=3 296 B11R2.20 C1=CC2=C(C=C1)CNNC2 BB31-5478 [0,1,0,1,0,0|2,0,0]=4 297 B11R2.20 C1=CC=C2OCCNC2=C1 BB51-1682 [0,1,0,1,0,0|0,0,2]=4 298 B11R2.20 C1=CC=C2SCC=NC2=C1 BB52-7621 [0,1,0,1,0,0|1,0,0]=3 299 B11R2.106 BrC1=C2C=COC2=CC=C1 BB31-1852 [0,1,0,1,0,0|0,0,2]=4 300 B11R2.106 BrC1=C2CCCC2=CC=C1 BB31-5049 [0,1,0,1,0,0|1,0,1]=4 301 B11R2.106 BrC1=C2N=COC2=CC=C1 BB31-7671 [0,1,0,1,0,0|1,0,1]=4 302 B11R2.106 BrC1=C2NCCC2=CC=C1 BB32-3116 [0,1,0,1,0,0|1,0,1]=4 303 B11R2.106 CC1=CC=CC2=C1C=CS2 BB31-8339 [0,1,0,1,0,0|0,1,1]=4 304 B11R2.106 CC1=CC=CC2=C1CCN2 BB31-5953 [0,1,0,1,0,0|1,0,1]=4 305 B11R2.106 CC1=CC=CC2=C1N=CS2 BB31-4601 [0,1,0,1,0,0|1,1,0]=4 306 B11R2.106 CC1=CC=CC2=C1NC=N2 BB31-2558 [0,1,0,1,0,0|2,0,0]=4 307 B11R2.106 ClC1=C2NC=NC2=CC=C1 BB52-4226 [0,1,0,1,0,0|2,0,0]=4 308 B11R2.106 FC1=C2NCCC2=CC=C1 BB31-6939 [0,1,0,1,0,0|1,0,1]=4 309 B11R2.106 IC1=C2C=CNC2=CC=C1 BB31-6853 [0,1,0,1,0,0|1,0,1]=4 310 B11R2.106 NC1=C2OC=CC2=CC=C1 BB31-6061 [0,1,0,1,0,0|0,0,2]=4 311 B11R2.106 NC1=C2OC=CC2=CC=C1 BB54-5249 [0,1,0,1,0,0|0,0,2]=4 312 B11R2.106 NC1=C2SC=NC2=CC=C1 BB31-7880 [0,1,0,1,0,0|1,1,0]=4 313 B11R2.106 NC1=CC=CC2=C1C=CS2 BB31-3417 [0,1,0,1,0,0|0,1,1]=4 314 B11R2.106 NC1=CC=CC2=C1CCN2 BB32-2884 [0,1,0,1,0,0|1,0,1]=4 315 B11R2.106 NC1=CC=CC2=C1COC2 BB31-5886 [0,1,0,1,0,0|2,0,0]=4 316 B11R2.106 NC1=CC=CC2=C1N=CS2 BB31-8933 [0,1,0,1,0,0|1,1,0]=4 317 B11R2.106 OC1=C2OC=CC2=CC=C1 BB32-2267 [0,1,0,1,0,0|0,0,2]=4 318 B11R2.106 OC1=CC=CC2=C1CCO2 BB31-2818 [0,1,0,1,0,0|0,0,2]=4 319 B11R2.106 OC1=CC=CC2=C1N=CO2 BB31-8021 [0,1,0,1,0,0|1,0,1]=4 320 B11R2.988 OCC1CC2=C1C=CC=C2 BB31-2934 [0,1,0,1,0,0|0,0,2]=4 321 B11R2.35 ClC1=CC([C@@H]2CO2)=CC=C1 BB31-5402 [0,1,0,1,0,0|0,0,2]=4 322 B11R2.35 OC1=CC(C2CC2)=CC=C1 BB31-4514 [0,1,0,1,0,0|1,0,1]=4 323 B11R2.1 CC1=NOC2=C1C=CC=C2 BB31-4705 [0,1,0,1,0,0|2,0,0]=4 324 B11R2.1 ClC1=CNC2=C1C=CC=C2 BB31-3376 [0,1,0,1,0,0|1,0,1]=4 325 B11R2.1 NC1=CNC2=C1C=CC=C2 BB32-3019 [0,1,0,1,0,0|1,0,1]=4 326 B11R2.1 O=C1CCC2=C1C=NC=C2 BB31-4897 [0,1,0,1,0,0|1,0,0]=3 327 B11R2.1 O=C1COC2=C1C=CN=C2 BB31-9000 [0,1,0,1,0,0|1,0,0]=3 328 B11R2.1 O=C1CSC2=C1C=CC=C2 BB31-1622 [0,1,0,1,0,0|0,0,0]=2 329 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 BB31-5413 [0,1,0,1,0,0|0,0,2]=4 330 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 BB31-4659 [0,1,0,1,0,0|0,0,2]=4 331 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 BB31-4761 [0,1,0,1,0,0|1,0,1]=4 332 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 BB31-5270 [0,1,0,1,0,0|1,0,1]=4 333 B11R2.239 C1=CC=C(C2CCN2)C=C1 BB31-8120 [0,1,0,1,0,0|1,0,1]=4 334 B7R1.1 O=CC1=CN=CO1 BB31-8199 [1,0,0,0,1,0|2,0,0]=4 335 B7R1.1 O=CC1=NC=CO1 BB31-4873 [1,0,0,0,1,0|2,0,0]=4