0 B9R1.8 BrCCC1=CC=CN=C1 4054467 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.8 BrCCC1=NC=CC=C1 4028495 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.8 BrCCC1=NC=CC=C1 4090022 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.8 CNCC1=CC=CC=N1 4004537 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.8 CNCC1=NC=NC=C1 4102726 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.8 NCCC1=CC=CN=C1 4005651 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.8 NCCC1=NC=CN=C1 4003591 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.8 NCCC1=NC=CN=C1 4091207 [0,0,0,0,0,0|3,0,1]=4 8 B8R1.2 BrCC1=CN=CC=C1 4034752 [1,0,0,0,0,0|2,0,0]=3 9 B8R1.2 ClCC1=NC=CC=N1 4009659 [1,0,0,0,0,0|3,0,0]=4 10 B8R1.2 NNC1=CC=CN=C1 4019584 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.2 NNC1=CC=NC=C1 4100548 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.1 CC1=CC=C(CNN)C=C1 4015023 [0,1,0,0,0,0|2,0,0]=3 13 B10R1.1 CC1=CC=C(CNN)C=C1 4088792 [0,1,0,0,0,0|2,0,0]=3 14 B10R1.1 CCSC1=CC=C(N)C=C1 4027323 [0,1,0,0,0,0|2,0,1]=4 15 B10R1.1 CCSC1=CC=C(N)C=C1 4088201 [0,1,0,0,0,0|2,0,1]=4 16 B10R1.1 CNCC1=CC=C(C)C=C1 4004536 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.1 CNCC1=CC=C(Cl)N=C1 4035407 [0,1,0,0,0,0|3,0,0]=4 18 B10R1.1 CSCC1=CC=C(Cl)N=C1 4039957 [0,1,0,0,0,0|3,0,0]=4 19 B10R1.1 N#CCC1=CC=C(Cl)N=C1 4108277 [0,1,0,0,0,0|2,0,1]=4 20 B10R1.1 NNCC1=CC=C(Cl)C=C1 4014992 [0,1,0,0,0,0|2,0,0]=3 21 B10R1.1 NNCC1=CC=C(Cl)C=C1 4108287 [0,1,0,0,0,0|2,0,0]=3 22 B10R1.1 NNCC1=CC=C(F)C=C1 4014991 [0,1,0,0,0,0|2,0,0]=3 23 B10R1.1 NOCC1=CC=C(Cl)C=C1 4004196 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.1 OCCC1=CC=C(Br)C=C1 4108291 [0,1,0,0,0,0|0,0,2]=3 25 B10R1.4 CC1=C(CNN)C=CC=C1 4015027 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.4 CC1=CC=CN=C1CCO 4040975 [0,1,0,0,0,0|1,0,2]=4 27 B10R1.4 CCSC1=CC=CC=C1N 4091232 [0,1,0,0,0,0|2,0,1]=4 28 B10R1.4 CCSC1=CC=CC=C1N 9071805 [0,1,0,0,0,0|2,0,1]=4 29 B10R1.4 CNCC1=C(C)C=NC=C1 4010336 [0,1,0,0,0,0|3,0,0]=4 30 B10R1.4 CNCC1=C(C)C=NC=C1 4089764 [0,1,0,0,0,0|3,0,0]=4 31 B10R1.4 CNCC1=CC=CC=C1C 4028163 [0,1,0,0,0,0|2,0,0]=3 32 B10R1.4 CNCC1=CC=CN=C1Cl 4019511 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.4 CNCC1=CC=CN=C1Cl 4090749 [0,1,0,0,0,0|3,0,0]=4 34 B10R1.4 CNCC1=NC=CC=C1C 4003220 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.4 NNCC1=C(Cl)C=CC=C1 4041333 [0,1,0,0,0,0|2,0,0]=3 36 B10R1.10 CC1=CC=CC(CCN)=N1 4002941 [0,1,0,0,0,0|2,0,1]=4 37 B10R1.10 CC1=CC=CC(CNN)=C1 4014990 [0,1,0,0,0,0|2,0,0]=3 38 B10R1.10 CC1=CC=CC(CNN)=C1 4089043 [0,1,0,0,0,0|2,0,0]=3 39 B10R1.10 CC1=NC(CCBr)=CC=C1 4030426 [0,1,0,0,0,0|2,0,1]=4 40 B10R1.10 CNCC1=CC=CC(O)=C1 4028180 [0,1,0,0,0,0|2,0,0]=3 41 B10R1.10 NC1=NC(CCO)=CC=C1 4078676 [0,1,0,0,0,0|1,0,2]=4 42 B10R1.10 NNCC1=CC=CC(Cl)=C1 4015030 [0,1,0,0,0,0|2,0,0]=3 43 B10R1.10 OCCC1=NC(Cl)=CC=C1 4110388 [0,1,0,0,0,0|1,0,2]=4 44 B10R1.15 CCC(N)C1=CC=CN=C1 4026589 [0,1,0,0,0,0|2,0,1]=4 45 B10R1.15 CCC(N)C1=CC=NC=C1 4011086 [0,1,0,0,0,0|2,0,1]=4 46 B10R1.15 CCC(N)C1=NC=CC=C1 4025877 [0,1,0,0,0,0|2,0,1]=4 47 B10R1.15 CNC(C)C1=CC=NC=C1 4087979 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.15 CNC(C)C1=CC=NC=C1 4089962 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.15 CNC(C)C1=CC=NC=C1 4102792 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.15 CNC(C)C1=CN=CC=C1 4089365 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.15 CNC(C)C1=CN=CC=C1 4102793 [0,1,0,0,0,0|3,0,0]=4 52 B10R1.15 CNC(C)C1=NC=CC=C1 4090171 [0,1,0,0,0,0|3,0,0]=4 53 B10R1.15 CNC(C)C1=NC=CC=C1 4102794 [0,1,0,0,0,0|3,0,0]=4 54 B10R1.15 NCC(O)C1=CN=CC=C1 4013988 [0,1,0,0,0,0|2,0,1]=4 55 B10R1.17 BrCCCC1=CC=CN=C1 4027035 [0,1,0,0,0,0|2,0,1]=4 56 B10R1.17 C=CCCC1=CC=CN=C1 4073007 [0,1,0,0,0,0|2,0,0]=3 57 B10R1.17 CCNCC1=NC=CC=C1 9070750 [0,1,0,0,0,0|2,0,1]=4 58 B10R1.17 CNCCC1=CC=NC=C1 4004718 [0,1,0,0,0,0|2,0,1]=4 59 B10R1.17 CNCCC1=CC=NC=C1 4087817 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.17 ICCOC1=CC=CC=C1 5101649 [0,1,0,0,0,0|1,0,1]=3 61 B10R1.17 N#CCCC1=NC=CC=C1 4027495 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.17 NCCCC1=CC=CN=C1 4003523 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.17 NCCCC1=CC=NC=C1 4003521 [0,1,0,0,0,0|2,0,1]=4 64 B10R1.17 NCCCC1=NC=CC=C1 4004571 [0,1,0,0,0,0|2,0,1]=4 65 B10R1.17 NCCNC1=CC=CN=C1 4019594 [0,1,0,0,0,0|2,0,1]=4 66 B10R1.17 NCCSC1=CC=CC=C1 4087772 [0,1,0,0,0,0|1,0,1]=3 67 B10R1.17 NCCSC1=NC=CC=C1 4004872 [0,1,0,0,0,0|2,0,1]=4 68 B10R1.17 NC\C=C\C1=CC=CC=C1 4027604 [0,1,0,0,0,0|1,0,1]=3 69 B10R1.17 OCCNC1=CC=CC=N1 5107563 [0,1,0,0,0,0|1,0,2]=4 70 B10R1.17 [N-]=[N+]=NCC1=CC=CC=N1 4035865 [0,1,0,0,0,0|3,0,0]=4 71 B10R1.17 [N-]=[N+]=NCC1=CN=CC=C1 4035868 [0,1,0,0,0,0|3,0,0]=4 72 B10R1.18 CC(=O)CC1=CC=CN=C1 4301933 [0,1,0,0,0,0|1,0,0]=2 73 B10R1.18 CC(=O)CC1=NC=CC=C1 4301932 [0,1,0,0,0,0|1,0,0]=2 74 B10R1.18 CC(=O)CC1=NC=CN=C1 4003592 [0,1,0,0,0,0|2,0,0]=3 75 B10R1.18 CC(N)CC1=CN=CC=C1 4002035 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.18 CC(O)CC1=NC=CC=C1 4041318 [0,1,0,0,0,0|1,0,2]=4 77 B10R1.18 N=C(N)CC1=CC=CN=C1 4031165 [0,1,0,0,0,0|2,0,0]=3 78 B10R1.18 N=C(N)CC1=NC=CC=C1 4029560 [0,1,0,0,0,0|2,0,0]=3 79 B10R2.7 C1=CC2=CC=NC=C2N1 4108319 [0,0,0,1,0,0|2,0,1]=4 80 B8R1.8 CNCC1=CC=CO1 2102243 [0,0,0,0,1,0|3,0,0]=4 81 B8R1.8 CNCC1=CC=CS1 4100657 [0,0,0,0,1,0|3,0,0]=4 82 B8R1.8 CNCC1=CSC=C1 4100799 [0,0,0,0,1,0|3,0,0]=4 83 B8R1.8 NCCC1=CC=CO1 4100671 [0,0,0,0,1,0|2,0,1]=4 84 B8R1.8 NCCN1C=CC=C1 4028584 [0,0,0,0,1,0|2,0,1]=4 85 B8R1.8 NNCC1=CC=CS1 4044222 [0,0,0,0,1,0|3,0,0]=4 86 B9R1.1 CC1=CN=C(C=O)C=N1 4039255 [1,1,0,0,0,0|2,0,0]=4 87 B9R1.1 CC1=NC=C(C=O)C=N1 4014571 [1,1,0,0,0,0|2,0,0]=4 88 B9R1.1 NC1=NC=C(C=O)C=N1 4006165 [1,1,0,0,0,0|2,0,0]=4 89 B9R1.2 C=CC1=CC=CC(O)=C1 4081750 [1,1,0,0,0,0|0,0,1]=3 90 B9R1.2 CC1=CC(CN)=NC=C1 4018186 [1,1,0,0,0,0|2,0,0]=4 91 B9R1.2 CC1=CC=CC(CCl)=N1 4006197 [1,1,0,0,0,0|2,0,0]=4 92 B9R1.2 CC1=CC=CC(CCl)=N1 4087831 [1,1,0,0,0,0|2,0,0]=4 93 B9R1.2 CC1=CC=CC(CN)=N1 4102566 [1,1,0,0,0,0|2,0,0]=4 94 B9R1.2 CC1=NC(C=O)=CC=N1 4086614 [1,1,0,0,0,0|2,0,0]=4 95 B9R1.2 CC1=NC=CC(CCl)=C1 4046381 [1,1,0,0,0,0|2,0,0]=4 96 B9R1.2 CC1=NC=CC(CN)=C1 4019509 [1,1,0,0,0,0|2,0,0]=4 97 B9R1.2 ClCC1=NC(Cl)=CC=C1 4036655 [1,1,0,0,0,0|2,0,0]=4 98 B9R1.2 NC1=CC(CO)=CC=N1 4027705 [1,1,0,0,0,0|1,0,1]=4 99 B9R1.2 NCC1=CC(Cl)=NC=C1 4033586 [1,1,0,0,0,0|2,0,0]=4 100 B9R1.2 O=CC1=CC(Br)=CN=C1 4011095 [1,1,0,0,0,0|1,0,0]=3 101 B9R1.2 OCC1=CC(Cl)=NC=C1 4031779 [1,1,0,0,0,0|1,0,1]=4 102 B9R1.2 OCC1=NC=CC(Cl)=C1 4014670 [1,1,0,0,0,0|1,0,1]=4 103 B9R1.6 NC(=S)C1=NC=CC=C1 4017339 [1,1,0,0,0,0|1,1,0]=4 104 B9R1.6 OB(O)C1=CC=CC=C1 4087996 [1,1,0,0,0,0|1,0,1]=4 105 B9R1.6 OB(O)C1=CC=CC=C1 4202242 [1,1,0,0,0,0|1,0,1]=4 106 B9R1.15 CC1=C(CBr)N=CC=C1 4061731 [1,1,0,0,0,0|2,0,0]=4 107 B9R1.15 CC1=C(CCl)C=CN=C1 4108233 [1,1,0,0,0,0|2,0,0]=4 108 B9R1.15 CC1=C(CCl)N=CC=C1 4002155 [1,1,0,0,0,0|2,0,0]=4 109 B9R1.15 CC1=C(CN)C=CN=C1 4010335 [1,1,0,0,0,0|2,0,0]=4 110 B9R1.15 CC1=NC=CC=C1CCl 4048084 [1,1,0,0,0,0|2,0,0]=4 111 B9R1.15 NCC1=CC=CC=C1Br 4108297 [1,1,0,0,0,0|1,0,0]=3 112 B9R1.15 NCC1=CC=CN=C1N 4037637 [1,1,0,0,0,0|2,0,0]=4 113 B9R1.15 NCC1=NC=CC=C1Cl 4038421 [1,1,0,0,0,0|2,0,0]=4 114 B9R1.15 O=C1NC=CC=C1CO 4021172 [1,1,0,0,0,0|1,0,1]=4 115 B9R1.15 O=CC1=CC=CN=C1Br 4003257 [1,1,0,0,0,0|1,0,0]=3 116 B9R1.12 O=C=NCC1=CC=CS1 4012287 [0,1,0,0,1,0|1,0,1]=4 117 B9R1.12 O=CCCN1C=CC=N1 4010920 [0,1,0,0,1,0|2,0,0]=4 118 B9R1.13 CC(=O)CC1=CC=CS1 4041410 [0,1,0,0,1,0|1,0,0]=3 119 B9R1.13 CC(=O)CN1C=CC=N1 4027130 [0,1,0,0,1,0|2,0,0]=4 120 B9R1.13 O=C(O)CC1=CC=NN1 4004807 [0,1,0,0,1,0|2,0,0]=4 121 B9R1.13 O=C(O)CC1=CSC=N1 2402341 [0,1,0,0,1,0|2,0,0]=4 122 B9R1.13 O=C(O)CN1C=CC=C1 4027952 [0,1,0,0,1,0|1,0,0]=3 123 B9R1.13 O=C(O)CN1C=CC=N1 2402291 [0,1,0,0,1,0|2,0,0]=4 124 B9R1.13 O=C(O)CN1C=CN=C1 4400175 [0,1,0,0,1,0|2,0,0]=4 125 B11R1.1 C#CCOC1=CC=C(N)C=C1 4039862 [0,2,0,0,0,0|1,0,1]=4 126 B11R1.1 C=CCOC1=CC=C(N)C=C1 4023587 [0,2,0,0,0,0|1,0,0]=3 127 B11R1.1 CC1=CC=C(CCCN)C=C1 4016876 [0,2,0,0,0,0|1,0,1]=4 128 B11R1.1 CC1=CC=C(CN=[N+]=[N-])C=C1 4041118 [0,2,0,0,0,0|2,0,0]=4 129 B11R1.1 CC1=CC=C(SCCN)C=C1 6873887 [0,2,0,0,0,0|1,0,1]=4 130 B11R1.1 CCCSC1=CC=C(N)C=C1 9071293 [0,2,0,0,0,0|1,0,1]=4 131 B11R1.1 CCNCC1=CC=C(Br)C=C1 4028726 [0,2,0,0,0,0|1,0,1]=4 132 B11R1.1 CCNCC1=CC=C(Br)C=C1 4090790 [0,2,0,0,0,0|1,0,1]=4 133 B11R1.1 CCNCC1=CC=C(Cl)C=C1 4024922 [0,2,0,0,0,0|1,0,1]=4 134 B11R1.1 CCNCC1=CC=C(Cl)C=C1 4091184 [0,2,0,0,0,0|1,0,1]=4 135 B11R1.1 CCNCC1=CC=C(F)C=C1 4090089 [0,2,0,0,0,0|1,0,1]=4 136 B11R1.1 CCNCC1=CC=C(F)C=C1 9072018 [0,2,0,0,0,0|1,0,1]=4 137 B11R1.1 N#CCOC1=CC=C(Br)C=C1 4029062 [0,2,0,0,0,0|1,0,1]=4 138 B11R1.1 NCCCC1=CC=C(Cl)C=C1 4101635 [0,2,0,0,0,0|1,0,1]=4 139 B11R1.1 NCCCC1=CC=C(F)C=C1 4016879 [0,2,0,0,0,0|1,0,1]=4 140 B11R1.1 NCCOC1=CC=C(Br)C=C1 4030874 [0,2,0,0,0,0|1,0,1]=4 141 B11R1.1 NCCOC1=CC=C(Cl)C=C1 4028889 [0,2,0,0,0,0|1,0,1]=4 142 B11R1.1 NCCOC1=CC=C(F)C=C1 4015013 [0,2,0,0,0,0|1,0,1]=4 143 B11R1.1 NCCOC1=CC=C(F)C=C1 4090877 [0,2,0,0,0,0|1,0,1]=4 144 B11R1.1 [N-]=[N+]=NCC1=CC=C(F)C=C1 4036355 [0,2,0,0,0,0|2,0,0]=4 145 B11R1.20 CC(=O)CC1=CC=C(C)C=N1 4002457 [0,2,0,0,0,0|1,0,0]=3 146 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 4006878 [0,2,0,0,0,0|0,0,0]=2 147 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 4033333 [0,2,0,0,0,0|0,0,0]=2 148 B11R1.20 O=C1C=CN(CC(=O)O)C=C1 4032466 [0,2,0,0,0,0|1,0,0]=3 149 B11R1.22 CCC(N)C1=CC=C(C)C=C1 4006321 [0,2,0,0,0,0|1,0,1]=4 150 B11R1.22 CCC(N)C1=CC=C(C)C=C1 4089191 [0,2,0,0,0,0|1,0,1]=4 151 B11R1.22 CCC(N)C1=CC=C(F)C=C1 4110680 [0,2,0,0,0,0|1,0,1]=4 152 B11R1.22 CCC(N)C1=CC=C(O)C=C1 4028779 [0,2,0,0,0,0|1,0,1]=4 153 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 5101702 [0,2,0,0,0,0|1,0,1]=4 154 B11R1.22 CC[C@@H](N)C1=CC=C(Cl)C=C1 4105606 [0,2,0,0,0,0|1,0,1]=4 155 B11R1.22 CC[C@@H](N)C1=CC=C(F)C=C1 4104518 [0,2,0,0,0,0|1,0,1]=4 156 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 4095607 [0,2,0,0,0,0|1,0,1]=4 157 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 4107200 [0,2,0,0,0,0|1,0,1]=4 158 B11R1.22 CNC(C)C1=CC=C(Cl)C=C1 5588069 [0,2,0,0,0,0|2,0,0]=4 159 B11R1.22 CNC(C)C1=CC=C(F)C=C1 4027169 [0,2,0,0,0,0|2,0,0]=4 160 B11R1.22 CNC(C)C1=CC=C(F)C=C1 4090293 [0,2,0,0,0,0|2,0,0]=4 161 B11R1.22 NC(CO)C1=CC=C(F)C=C1 4039922 [0,2,0,0,0,0|0,0,2]=4 162 B11R1.81 O=C=NC1=C(Cl)C=C(Br)C=C1 3002519 [0,2,0,0,0,0|1,0,1]=4 163 B11R1.83 CCC1=CC=C(CNC)C=C1 4004362 [0,2,0,0,0,0|2,0,0]=4 164 B11R1.83 CCC1=CC=C(CNC)C=C1 4090753 [0,2,0,0,0,0|2,0,0]=4 165 B11R1.83 CCC1=CC=C(CNN)C=C1 4015024 [0,2,0,0,0,0|2,0,0]=4 166 B11R1.83 CCC1=CC=C(N=C=O)C=C1 3002639 [0,2,0,0,0,0|1,0,1]=4 167 B11R1.83 COC1=CC=C(CNN)C=C1 4014995 [0,2,0,0,0,0|2,0,0]=4 168 B11R1.13 CNCC1=CC=CC(C)=C1C 4033515 [0,2,0,0,0,0|2,0,0]=4 169 B11R1.17 C#CCOC1=C(N)C=CC=C1 4041253 [0,2,0,0,0,0|1,0,1]=4 170 B11R1.17 C#CCOC1=C(N)C=CC=C1 4088026 [0,2,0,0,0,0|1,0,1]=4 171 B11R1.17 C=CCOC1=CC=CC=C1N 4023578 [0,2,0,0,0,0|1,0,0]=3 172 B11R1.17 C=CCOC1=CC=CN=C1N 4030134 [0,2,0,0,0,0|2,0,0]=4 173 B11R1.17 CC1=C(CN=[N+]=[N-])C=CC=C1 4041072 [0,2,0,0,0,0|2,0,0]=4 174 B11R1.17 CC1=C(OCCN)C=CC=C1 4030987 [0,2,0,0,0,0|1,0,1]=4 175 B11R1.17 CC1=C(OCCN)C=CC=C1 4089934 [0,2,0,0,0,0|1,0,1]=4 176 B11R1.17 CCCSC1=CC=CC=C1N 4088576 [0,2,0,0,0,0|1,0,1]=4 177 B11R1.17 CCCSC1=CC=CC=C1N 9070713 [0,2,0,0,0,0|1,0,1]=4 178 B11R1.17 CCNCC1=CC=CC=C1C 4028579 [0,2,0,0,0,0|1,0,1]=4 179 B11R1.17 CCNCC1=CC=CC=C1Cl 4024924 [0,2,0,0,0,0|1,0,1]=4 180 B11R1.17 CCNCC1=CC=CC=C1Cl 4089658 [0,2,0,0,0,0|1,0,1]=4 181 B11R1.17 COCOC1=CC=CC=C1Br 4003017 [0,2,0,0,0,0|2,0,0]=4 182 B11R1.17 NCCCC1=C(F)C=CC=C1 4019782 [0,2,0,0,0,0|1,0,1]=4 183 B11R1.17 NCCCC1=CC=CC=C1Cl 4087888 [0,2,0,0,0,0|1,0,1]=4 184 B11R1.17 NCCOC1=CC=CC=C1Cl 4026894 [0,2,0,0,0,0|1,0,1]=4 185 B11R1.17 NCCOC1=CC=CC=C1F 4015039 [0,2,0,0,0,0|1,0,1]=4 186 B11R1.17 NCCOC1=CC=CC=C1F 4090505 [0,2,0,0,0,0|1,0,1]=4 187 B11R1.17 [N-]=[N+]=NCC1=C(F)C=CC=C1 4035696 [0,2,0,0,0,0|2,0,0]=4 188 B11R1.41 CCC1=CC=CC=C1N=C=O 3001826 [0,2,0,0,0,0|1,0,1]=4 189 B11R1.41 COC1=CC=CC=C1CNN 4040117 [0,2,0,0,0,0|2,0,0]=4 190 B11R1.41 COC1=CC=CC=C1CNN 4090874 [0,2,0,0,0,0|2,0,0]=4 191 B11R1.86 CC(=O)CC1=C(C)C=CC=N1 4002455 [0,2,0,0,0,0|1,0,0]=3 192 B11R1.86 CC(=O)NC1=CC=CN=C1Cl 9070591 [0,2,0,0,0,0|2,0,0]=4 193 B11R1.86 CC(=O)NC1=NC=CC=C1O 4032188 [0,2,0,0,0,0|2,0,0]=4 194 B11R1.86 CC1=C(CC(=O)O)N=CC=C1 4081067 [0,2,0,0,0,0|1,0,0]=3 195 B11R1.86 CN(C)CC1=CC=CC=C1N 4016941 [0,2,0,0,0,0|2,0,0]=4 196 B11R1.86 CN(C)CC1=CC=CC=C1N 4089185 [0,2,0,0,0,0|2,0,0]=4 197 B11R1.86 O=C(O)CN1C=CC=CC1=O 4029932 [0,2,0,0,0,0|1,0,0]=3 198 B11R1.86 O=C(O)CN1C=CC=NC1=O 4028397 [0,2,0,0,0,0|2,0,0]=4 199 B11R1.182 O=C=NC1=CC(F)=CC=C1F 3002065 [0,2,0,0,0,0|1,0,1]=4 200 B11R1.24 C=CCOC1=CC=CC(N)=C1 4023582 [0,2,0,0,0,0|1,0,0]=3 201 B11R1.24 CC1=CC(CCCN)=CC=C1 4028384 [0,2,0,0,0,0|1,0,1]=4 202 B11R1.24 CC1=CC(OCCN)=CC=C1 4001815 [0,2,0,0,0,0|1,0,1]=4 203 B11R1.24 CCNCC1=CC=CC(Br)=C1 4027171 [0,2,0,0,0,0|1,0,1]=4 204 B11R1.24 CCNCC1=CC=CC(Br)=C1 4089307 [0,2,0,0,0,0|1,0,1]=4 205 B11R1.24 NC1=CC(OCCCl)=CC=C1 4028361 [0,2,0,0,0,0|1,0,1]=4 206 B11R1.24 NC1=CC(OCCCl)=CC=C1 4090880 [0,2,0,0,0,0|1,0,1]=4 207 B11R1.24 NC1=CC=CC(OCCO)=C1 4030762 [0,2,0,0,0,0|0,0,2]=4 208 B11R1.24 NCCCC1=CC(F)=CC=C1 4019785 [0,2,0,0,0,0|1,0,1]=4 209 B11R1.24 NCCOC1=CC(Cl)=CC=C1 4015036 [0,2,0,0,0,0|1,0,1]=4 210 B11R1.34 O=C=NC1=CC(F)=CC(F)=C1 3003020 [0,2,0,0,0,0|1,0,1]=4 211 B11R1.157 CC(=O)CC1=CC(C)=CC=N1 4002456 [0,2,0,0,0,0|1,0,0]=3 212 B11R1.157 CC(=O)CC1=CC=CC(C)=N1 4000002 [0,2,0,0,0,0|1,0,0]=3 213 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 5475603 [0,2,0,0,0,0|1,0,0]=3 214 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 4108227 [0,2,0,0,0,0|1,0,0]=3 215 B11R1.157 NC(=O)CC1=CC=CC(N)=C1 4033483 [0,2,0,0,0,0|0,0,0]=2 216 B11R1.189 CNCC1=CC(OC)=CC=C1 4004535 [0,2,0,0,0,0|2,0,0]=4 217 B11R1.189 CNCC1=CC(OC)=CC=C1 4087815 [0,2,0,0,0,0|2,0,0]=4 218 B11R1.189 CNCC1=CC(SC)=CC=C1 4002913 [0,2,0,0,0,0|2,0,0]=4 219 B11R1.189 COC1=CC(CNN)=CC=C1 4015018 [0,2,0,0,0,0|2,0,0]=4 220 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 4031581 [0,2,0,0,0,0|1,0,1]=4 221 B11R1.12 CCC(NC)C1=CC=CC=C1 4088018 [0,2,0,0,0,0|1,0,1]=4 222 B11R1.12 CCC(NC)C1=CC=CC=C1 6871471 [0,2,0,0,0,0|1,0,1]=4 223 B11R1.12 O=CC(C=O)C1=CC=CC=N1 4034743 [0,2,0,0,0,0|1,0,0]=3 224 B11R1.12 O=CC(C=O)C1=CC=NC=N1 4034744 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.12 O=CC(C=O)C1=CN=CC=N1 4034745 [0,2,0,0,0,0|2,0,0]=4 226 B11R1.16 CC(CCN)C1=CC=CC=C1 4004088 [0,2,0,0,0,0|1,0,1]=4 227 B11R1.16 CC(N=C=O)C1=CC=CC=C1 4040282 [0,2,0,0,0,0|0,0,1]=3 228 B11R1.16 CCCC(N)C1=CC=CC=C1 4006320 [0,2,0,0,0,0|1,0,1]=4 229 B11R1.16 CCC[C@@H](N)C1=CC=CC=C1 4096885 [0,2,0,0,0,0|1,0,1]=4 230 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 4091353 [0,2,0,0,0,0|1,0,1]=4 231 B11R1.16 CCNC(C)C1=CC=CC=C1 6592586 [0,2,0,0,0,0|1,0,1]=4 232 B11R1.16 CN(CCN)C1=CC=CC=C1 4027439 [0,2,0,0,0,0|1,0,1]=4 233 B11R1.36 CC(C)C(N)C1=CC=CC=C1 4043717 [0,2,0,0,0,0|1,0,1]=4 234 B11R1.36 CC(C)C(N)C1=CC=CC=C1 4108973 [0,2,0,0,0,0|1,0,1]=4 235 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 4100427 [0,2,0,0,0,0|1,0,1]=4 236 B11R1.36 N=C(N)C(O)C1=CC=CC=C1 4012626 [0,2,0,0,0,0|1,0,0]=3 237 B11R1.36 N=C(N)C(O)C1=CC=CC=C1 4088244 [0,2,0,0,0,0|1,0,0]=3 238 B11R1.36 O=C(O)C(=O)C1=CC=CN=C1 4034823 [0,2,0,0,0,0|1,0,1]=4 239 B11R1.36 O=C(O)C(=O)C1=CC=CN=C1 4087936 [0,2,0,0,0,0|1,0,1]=4 240 B11R1.28 C#CCNCC1=CC=CC=C1 4001797 [0,2,0,0,0,0|1,0,1]=4 241 B11R1.28 C=CCNCC1=CC=CC=C1 4090793 [0,2,0,0,0,0|1,0,0]=3 242 B11R1.28 C=CCNCC1=CC=CC=C1 9070780 [0,2,0,0,0,0|1,0,0]=3 243 B11R1.28 C=CCNCC1=CC=CN=C1 9071233 [0,2,0,0,0,0|2,0,0]=4 244 B11R1.28 C=CCNCC1=CC=NC=C1 9071732 [0,2,0,0,0,0|2,0,0]=4 245 B11R1.28 CNCCOC1=CC=CC=C1 4013938 [0,2,0,0,0,0|1,0,1]=4 246 B11R1.28 NCCCOC1=CC=CC=C1 4018151 [0,2,0,0,0,0|1,0,1]=4 247 B11R1.28 NCCCSC1=CC=CC=C1 4026933 [0,2,0,0,0,0|1,0,1]=4 248 B11R1.28 NCCCSC1=CC=CC=C1 4110622 [0,2,0,0,0,0|1,0,1]=4 249 B11R1.28 NCCOCC1=CC=CC=C1 4028211 [0,2,0,0,0,0|1,0,1]=4 250 B11R1.28 NCCOCC1=CC=CC=C1 4088899 [0,2,0,0,0,0|1,0,1]=4 251 B11R1.28 NCCSCC1=CC=CC=C1 4040201 [0,2,0,0,0,0|1,0,1]=4 252 B11R1.28 NCCSCC1=CC=CC=C1 4089858 [0,2,0,0,0,0|1,0,1]=4 253 B11R1.40 NNC(=O)CC1=CC=CC=C1 3002732 [0,2,0,0,0,0|0,0,0]=2 254 B11R1.40 NNC(=O)CC1=CC=NC=C1 4036772 [0,2,0,0,0,0|1,0,0]=3 255 B11R1.40 NNC(=O)CC1=NC=CC=C1 4036750 [0,2,0,0,0,0|1,0,0]=3 256 B11R1.40 O=C(CBr)NC1=CC=CC=C1 4023663 [0,2,0,0,0,0|1,0,0]=3 257 B11R1.40 O=C(CCl)NC1=CC=CC=C1 3002954 [0,2,0,0,0,0|1,0,0]=3 258 B11R1.91 N=C(N)CCC1=CC=CC=C1 4041259 [0,2,0,0,0,0|1,0,0]=3 259 B11R1.91 N=C(N)NCC1=CC=CC=C1 4032915 [0,2,0,0,0,0|1,0,0]=3 260 B11R1.91 N=C(N)NCC1=CC=CN=C1 4015988 [0,2,0,0,0,0|2,0,0]=4 261 B11R1.91 N=C(N)NCC1=CC=CN=C1 4088063 [0,2,0,0,0,0|2,0,0]=4 262 B11R1.91 N=C(N)NCC1=CC=NC=C1 4015990 [0,2,0,0,0,0|2,0,0]=4 263 B11R1.91 N=C(N)NCC1=CC=NC=C1 4089065 [0,2,0,0,0,0|2,0,0]=4 264 B11R1.91 O=C(O)CCC1=CC=NC=C1 4004170 [0,2,0,0,0,0|1,0,0]=3 265 B11R1.91 O=C(O)CCC1=NC=CC=C1 4004241 [0,2,0,0,0,0|1,0,0]=3 266 B11R1.91 O=C(O)CCC1=NC=CN=C1 4003578 [0,2,0,0,0,0|2,0,0]=4 267 B11R1.91 O=C(O)CNC1=CC=CN=C1 4110417 [0,2,0,0,0,0|1,0,0]=3 268 B11R1.91 O=C(O)CSC1=NC=CC=C1 4400385 [0,2,0,0,0,0|1,0,0]=3 269 B11R2.34 BrC1=CC=C(C2CC2)C=C1 4022408 [0,1,0,1,0,0|1,0,1]=4 270 B11R2.36 BrC1=CC2=C(C=C1)CCO2 4070587 [0,1,0,1,0,0|0,0,2]=4 271 B11R2.36 BrC1=CC=C2N=CNC2=C1 4016418 [0,1,0,1,0,0|2,0,0]=4 272 B11R2.36 NC1=CC2=C(C=C1)COC2 4100713 [0,1,0,1,0,0|2,0,0]=4 273 B11R2.36 NC1=CC2=C(C=C1)SC=N2 4087786 [0,1,0,1,0,0|1,1,0]=4 274 B11R2.36 NC1=CC=C2SC=NC2=C1 4003348 [0,1,0,1,0,0|1,1,0]=4 275 B11R2.36 OC1=CC=C2NC=NC2=C1 5939992 [0,1,0,1,0,0|2,0,0]=4 276 B11R2.10 NC1=NC2=C(C=CC=C2)O1 4030771 [0,1,0,1,0,0|1,0,1]=4 277 B11R2.20 C1=CC2=C(C=C1)OCCN2 4005008 [0,1,0,1,0,0|0,0,2]=4 278 B11R2.106 BrC1=C2SC=CC2=CC=C1 4029546 [0,1,0,1,0,0|0,1,1]=4 279 B11R2.106 BrC1=CC=CC2=C1CCO2 4072546 [0,1,0,1,0,0|0,0,2]=4 280 B11R2.106 CC1=C2C=CNC2=CC=C1 4036770 [0,1,0,1,0,0|1,0,1]=4 281 B11R2.106 CC1=CC=CC2=C1C=CN2 3020087 [0,1,0,1,0,0|1,0,1]=4 282 B11R2.106 NC1=C2CCOC2=CC=C1 4088054 [0,1,0,1,0,0|0,0,2]=4 283 B11R2.106 OC1=C2N=COC2=CC=C1 4032023 [0,1,0,1,0,0|1,0,1]=4 284 B11R2.1 CC1=NNC2=CC=CC=C21 4041962 [0,1,0,1,0,0|2,0,0]=4 285 B11R2.1 IC1=NNC2=CC=CC=C21 4027330 [0,1,0,1,0,0|2,0,0]=4 286 B11R2.1 NC1COC2=CC=CC=C21 4018205 [0,1,0,1,0,0|0,0,2]=4 287 B11R2.1 O=C1NCC2=CC=CC=C12 4041876 [0,1,0,1,0,0|0,0,0]=2 288 B11R2.1 O=C1NCC2=CC=CN=C12 4037457 [0,1,0,1,0,0|1,0,0]=3 289 B11R2.40 NC1(C2=CC=CC=C2)CC1 4087975 [0,1,0,1,0,0|1,0,1]=4 290 B11R2.40 NC1(C2=CC=CC=C2)CC1 4102430 [0,1,0,1,0,0|1,0,1]=4 291 B7R1.1 NCC1=CSC=C1 4089439 [1,0,0,0,1,0|2,0,0]=4 292 B7R1.1 NCC1=CSC=C1 4100798 [1,0,0,0,1,0|2,0,0]=4