0 B10R1.10 CC1=CC(CC#N)=NN=C1 C92375 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.10 CC1=CC=CC(CC=O)=C1 74805 [0,0,0,0,0,0|1,0,1]=2 2 B10R1.10 CC1=CC=CC(CCBr)=N1 AC6969 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.10 CC1=CC=CC(CCN)=N1 P19093 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.10 CC1=NC=CC(CNN)=C1 F52070 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.10 CC1=NC=CC(CNN)=C1 F52466 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.10 CCCC1=CC=CC(F)=C1 36946 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.10 CCNC1=CC=CC(Cl)=C1 L10102 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.10 CCNC1=CC=CC(O)=C1 F16135 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.10 CCOC1=CC=CC(S)=C1 T73015 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.10 CCSC1=CC(N)=CC=C1 AT20857 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.10 CNCC1=CC(Cl)=NC=C1 AT26616 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.10 CNCC1=NC(C)=CC=C1 D87644 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.10 CNCC1=NC=CC(Cl)=C1 CS1254 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.10 COCC1=CC(N)=CC=C1 30379 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.10 CSCC1=CC(N)=CC=C1 AT15211 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.10 ClC1=CC=CC(C#CBr)=C1 55375 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.10 N#CCC1=CC(Cl)=CN=C1 93159 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.10 N#CCC1=CC(N)=NC=C1 AT18208 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.10 N#CCC1=CC=CC(Cl)=N1 O10491 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.10 NC1=CC(CCO)=NC=N1 AC8190 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.10 NCCC1=CC=CC(I)=C1 C78608 [0,0,0,0,0,0|1,0,0]=1 22 B10R1.10 NNCC1=CC(Br)=CN=C1 P11105 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.10 NNCC1=CC=CC(Cl)=C1 P15270 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.10 NNCC1=CC=CC(O)=C1 D87672 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.10 N\N=C\C1=CC=CC(O)=C1 F15561 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.10 O=CCC1=CC=CC(Cl)=C1 W16823 [0,0,0,0,0,0|2,0,1]=3 27 B9R1.2 C#CC1=CC(C)=CN=C1 AT12963 [1,0,0,0,0,0|1,0,2]=4 28 B9R1.2 CC1=CC(CBr)=CN=C1 43925 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.2 CC1=CC(CCl)=NC=N1 F52607 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.2 CC1=CC(CN)=NC=N1 AT18324 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.2 CC1=CC=NC(CCl)=N1 P10964 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.2 CC1=CC=NC(CN)=N1 P10960 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.2 CC1=CN=CC(CCl)=N1 O10514 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.2 CC1=CN=CC(CCl)=N1 Y10493 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.2 CC1=CN=CC(CO)=N1 O10143 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.2 CC1=CN=NC(CN)=C1 P13788 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.2 CC1=NC=CC(CCl)=N1 F53395 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.2 CC1=NC=CC(CN)=N1 F14224 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.2 CC1=NC=CC(NN)=C1 F16202 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.2 CCC1=CC(Cl)=NN=C1 S11387 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.2 CCC1=NC=CC(Cl)=N1 W12562 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.2 CNC1=NC=CC(N)=C1 F12690 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.2 COC1=CC(O)=NC=C1 F17762 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.2 COC1=CCC=C(C)C1 AC4015 [1,0,0,0,0,0|1,0,2]=4 45 B9R1.2 COC1=CN=CC(N)=C1 P11509 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.2 CSC1=CC(Cl)=CN=C1 AT19857 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.2 C\N=C1\C=C(C)C=CN1 W18359 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.2 ClC1=NC=CC(CBr)=C1 C16429 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.2 ClCC1=NC=CC(Cl)=C1 C13998 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.2 FC1=CC(CCl)=CN=C1 O10881 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.2 NCC1=CC(=O)NC=C1 37540 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.2 NCC1=CC(Br)=CN=C1 F19818 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.2 NCC1=CC(F)=NC=C1 W18404 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.2 NCC1=CC(N)=NC=C1 AC6477 [1,0,0,0,0,0|2,0,0]=3 55 B9R1.2 NCC1=CC=CC(Cl)=N1 C72946 [1,0,0,0,0,0|2,0,0]=3 56 B9R1.2 NCC1=CC=CC(I)=C1 CK2420 [1,0,0,0,0,0|1,0,0]=2 57 B9R1.2 NCC1=CC=CC(O)=N1 F10425 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.2 NCC1=NC=CC(Br)=C1 26892 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.2 NCC1=NC=CC(F)=C1 C71953 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.2 NCC1=NC=CC(N)=C1 77886 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.2 NNC1=NC(N)=CC=C1 C91519 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.2 [2H]CC1=CC=CC(F)=C1 D99661 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.2 [O-][N+]1=CC=CC(CCl)=C1 96310 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.8 BrCCC1=CN=CC=C1 C77647 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.8 C#C[I+]C1=CC=CC=C1 T71678 [1,0,0,0,0,0|2,0,1]=4 66 B9R1.8 CCCC1=CC=CN=C1 O11051 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.8 CCC[N+]1=CC=CC=C1 T72121 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.8 CNNC1=CC=CC=C1 C77159 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.8 FCCC1=CC=CC=C1 75534 [1,0,0,0,0,0|1,0,0]=2 70 B9R1.8 IC#CC1=CC=CC=C1 N11813 [1,0,0,0,0,0|1,0,2]=4 71 B9R1.8 NCCC1=CC=CC=C1 T71816 [1,0,0,0,0,0|0,0,0]=1 72 B9R1.8 NCCC1=CC=CC=C1 T72591 [1,0,0,0,0,0|0,0,0]=1 73 B9R1.8 NCCC1=NC=CC=N1 83201 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.8 NCCC1=NC=CC=N1 P10852 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.8 NCCC1=NC=CN=C1 AT22557 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.8 NCCC1=NC=NC=C1 P10950 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.8 NNCC1=NC=CC=C1 P10521 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.8 NNCC1=NC=CN=C1 D78817 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.8 NNCC1=NC=CN=C1 P19174 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.8 OCCC1=CC=NC=C1 T72404 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.8 OCCC1=NN=CC=C1 D77083 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.8 SCCC1=NC=CC=C1 F18309 [1,0,0,0,0,0|2,0,0]=3 83 B9R1.8 [C-]#[N+]CC1=CC=NC=C1 AC8779 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.8 [C-]#[N+]CC1=CN=CC=C1 F16136 [1,0,0,0,0,0|3,0,0]=4 85 B11R1.13 C=CCC1=C(O)C(C)=CC=C1 AC5932 [0,1,0,0,0,0|1,0,1]=3 86 B11R1.13 CC1=C(Cl)C=CC=C1CC#N C90793 [0,1,0,0,0,0|1,0,2]=4 87 B11R1.13 CCOC1=C(C)C(N)=CC=C1 F18648 [0,1,0,0,0,0|3,0,0]=4 88 B11R1.13 CN1C(=O)C=CN=C1CCN AT13879 [0,1,0,0,0,0|3,0,0]=4 89 B11R1.13 ClC1=CC=CC(CCBr)=C1Cl C78633 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.13 N#CCC1=CC=CC(Br)=C1Cl D96283 [0,1,0,0,0,0|1,0,2]=4 91 B11R1.13 N#CCC1=CC=CC(F)=C1Cl 94661 [0,1,0,0,0,0|1,0,2]=4 92 B11R1.13 O=CCC1=CC=CC(F)=C1F 22736 [0,1,0,0,0,0|2,0,1]=4 93 B11R1.13 OCCC1=NC=CC(Cl)=C1Br W11042 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.23 C#C[C@@H](O)C1=CC(C)=CC=C1 AC5841 [0,1,0,0,0,0|1,0,1]=3 95 B11R1.23 C#C[C@@H](O)C1=CC=CC(Br)=C1 AC5836 [0,1,0,0,0,0|2,0,1]=4 96 B11R1.23 C#C[C@@H](O)C1=CC=CC(Cl)=C1 AC5834 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15262 [0,1,0,0,0,0|1,0,1]=3 98 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15263 [0,1,0,0,0,0|1,0,1]=3 99 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15264 [0,1,0,0,0,0|1,0,1]=3 100 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15252 [0,1,0,0,0,0|2,0,1]=4 101 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15253 [0,1,0,0,0,0|2,0,1]=4 102 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15254 [0,1,0,0,0,0|2,0,1]=4 103 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15242 [0,1,0,0,0,0|2,0,1]=4 104 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15243 [0,1,0,0,0,0|2,0,1]=4 105 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15245 [0,1,0,0,0,0|2,0,1]=4 106 B11R1.23 C=C[C@H](N)C1=CC=CC(F)=C1 N15235 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.23 C=C[C@H](N)C1=CC=CC(F)=C1 N15236 [0,1,0,0,0,0|2,0,1]=4 108 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15295 [0,1,0,0,0,0|2,0,1]=4 109 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15296 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15297 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.23 CC1=CC=CC(C(=O)CO)=C1 AC3231 [0,1,0,0,0,0|1,0,1]=3 112 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13429 [0,1,0,0,0,0|0,0,0]=1 113 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13430 [0,1,0,0,0,0|0,0,0]=1 114 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13431 [0,1,0,0,0,0|0,0,0]=1 115 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13452 [0,1,0,0,0,0|0,0,0]=1 116 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13453 [0,1,0,0,0,0|0,0,0]=1 117 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13454 [0,1,0,0,0,0|0,0,0]=1 118 B11R1.23 CC1=CC=CC([C@@H](O)CN)=C1 C78286 [0,1,0,0,0,0|0,0,0]=1 119 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 34175 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.23 CC[C@H](O)C1=CC(C)=CC=C1 N14416 [0,1,0,0,0,0|1,0,0]=2 121 B11R1.23 CC[C@H](O)C1=CC=CC(Br)=C1 N12527 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.23 CC[C@H](O)C1=CC=CC(Cl)=C1 N12311 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 N12243 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.23 NCC(=O)C1=CC(O)=CC=C1 C77908 [0,1,0,0,0,0|1,0,1]=3 125 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13420 [0,1,0,0,0,0|1,0,0]=2 126 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13421 [0,1,0,0,0,0|1,0,0]=2 127 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13422 [0,1,0,0,0,0|1,0,0]=2 128 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13443 [0,1,0,0,0,0|1,0,0]=2 129 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13445 [0,1,0,0,0,0|1,0,0]=2 130 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13411 [0,1,0,0,0,0|1,0,0]=2 131 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13412 [0,1,0,0,0,0|1,0,0]=2 132 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13413 [0,1,0,0,0,0|1,0,0]=2 133 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13435 [0,1,0,0,0,0|1,0,0]=2 134 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13436 [0,1,0,0,0,0|1,0,0]=2 135 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13437 [0,1,0,0,0,0|1,0,0]=2 136 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13396 [0,1,0,0,0,0|1,0,0]=2 137 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13397 [0,1,0,0,0,0|1,0,0]=2 138 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13398 [0,1,0,0,0,0|1,0,0]=2 139 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13399 [0,1,0,0,0,0|1,0,0]=2 140 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13404 [0,1,0,0,0,0|1,0,0]=2 141 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13405 [0,1,0,0,0,0|1,0,0]=2 142 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 58439 [0,1,0,0,0,0|1,0,0]=2 143 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 71528 [0,1,0,0,0,0|1,0,0]=2 144 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 92116 [0,1,0,0,0,0|1,0,0]=2 145 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 58428 [0,1,0,0,0,0|1,0,0]=2 146 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 C78287 [0,1,0,0,0,0|1,0,0]=2 147 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 D77208 [0,1,0,0,0,0|1,0,0]=2 148 B11R1.23 N[C@@H](CF)C1=CC=CC(Br)=C1 N14613 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.23 N[C@@H](CO)C1=CC(F)=CN=C1 N14406 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.23 N[C@@H](CO)C1=CC(F)=CN=C1 N14407 [0,1,0,0,0,0|3,0,0]=4 151 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=N1 Y12117 [0,1,0,0,0,0|3,0,0]=4 152 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 N12818 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.23 N[C@@H](CO)C1=NC=CC(Cl)=C1 N14937 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.23 N[C@@H](CO)C1=NC=CC(Cl)=C1 N14938 [0,1,0,0,0,0|3,0,0]=4 155 B11R1.23 O=C(CO)C1=CC=CC(Br)=C1 AC6088 [0,1,0,0,0,0|2,0,1]=4 156 B11R1.23 O=C(CO)C1=CC=CC(F)=C1 AC5675 [0,1,0,0,0,0|2,0,1]=4 157 B11R1.23 O[C@@H](CCl)C1=CC=CC(Br)=C1 58437 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 58424 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 C72678 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.24 BrCCCC1=CC=CC(Br)=C1 C77758 [0,1,0,0,0,0|2,0,0]=3 161 B11R1.24 BrCCOC1=CC=CC(Br)=C1 98063 [0,1,0,0,0,0|2,0,0]=3 162 B11R1.24 CC1=CC(CCCN)=NC=C1 W10140 [0,1,0,0,0,0|1,0,0]=2 163 B11R1.24 CC1=CC=CC(CCC=O)=C1 C10532 [0,1,0,0,0,0|1,0,0]=2 164 B11R1.24 CC1=CC=CC(OCCO)=N1 N10107 [0,1,0,0,0,0|2,0,0]=3 165 B11R1.24 CCCC[N+]1=CC(C)=CC=C1 C93515 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.24 CCNCC1=CC(Br)=CN=C1 F19801 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.24 CCOCC1=CC=CC(Br)=C1 F17773 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.24 CNCCC1=CC=CC(Br)=C1 C78466 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.24 COCCC1=CC(N)=NC=C1 AT18204 [0,1,0,0,0,0|3,0,0]=4 170 B11R1.24 ClC1=CC=CC(CCCBr)=C1 C78574 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.24 ClCCNC1=CC(Cl)=NC=C1 98045 [0,1,0,0,0,0|3,0,0]=4 172 B11R1.24 N#CCCC1=CC=CC(F)=C1 97618 [0,1,0,0,0,0|1,0,1]=3 173 B11R1.24 N#CCOC1=CC(O)=CC=C1 C77746 [0,1,0,0,0,0|1,0,2]=4 174 B11R1.24 NC1=CC(CCCO)=NC=C1 AC5942 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.24 NC1=CC=CC(OCCO)=C1 C78268 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.24 NCCCC1=CC=CC(F)=C1 97619 [0,1,0,0,0,0|1,0,0]=2 177 B11R1.24 NCCCC1=CC=CC(N)=C1 C78147 [0,1,0,0,0,0|1,0,0]=2 178 B11R1.24 NCCCC1=CC=CC(O)=C1 C78310 [0,1,0,0,0,0|1,0,0]=2 179 B11R1.24 O=CCCC1=CC(O)=CC=C1 F19734 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.24 O=CNCC1=CC=CC(F)=C1 Y10034 [0,1,0,0,0,0|2,0,1]=4 181 B11R1.24 OCCNC1=CC(Cl)=NC=C1 98044 [0,1,0,0,0,0|3,0,0]=4 182 B11R1.24 OCCOC1=CC(Cl)=CN=C1 AT19859 [0,1,0,0,0,0|3,0,0]=4 183 B11R1.24 [C-]#[N+]CCC1=CC=CC(F)=C1 50335 [0,1,0,0,0,0|1,0,1]=3 184 B11R1.34 C=CCC1=CC(Br)=CC(F)=C1 C76836 [0,1,0,0,0,0|2,0,1]=4 185 B11R1.34 CCCC1=CC(Cl)=NC(C)=N1 76064 [0,1,0,0,0,0|3,0,0]=4 186 B11R1.34 CCOC1=CC(Br)=CC(Br)=C1 N11666 [0,1,0,0,0,0|3,0,0]=4 187 B11R1.34 COCC1=CC(Br)=CC(Br)=C1 AT26748 [0,1,0,0,0,0|3,0,0]=4 188 B11R1.34 COCC1=CC(Br)=CC(F)=C1 94138 [0,1,0,0,0,0|3,0,0]=4 189 B11R1.34 COCC1=CC(F)=CC(F)=C1 AT26699 [0,1,0,0,0,0|3,0,0]=4 190 B11R1.34 ClC1=CC(Cl)=CC(CCBr)=C1 C78597 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.34 N#CCC1=CC(Br)=CC(O)=C1 D96286 [0,1,0,0,0,0|1,0,2]=4 192 B11R1.34 NCCC1=CC(Cl)=CC(Cl)=C1 F12494 [0,1,0,0,0,0|1,0,0]=2 193 B11R1.34 NOCC1=CC(Cl)=CC(Cl)=C1 D74083 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.34 OCCC1=CC(Br)=CC(Br)=C1 AT19150 [0,1,0,0,0,0|2,0,0]=3 195 B11R1.34 OCCC1=CC(O)=CC(O)=C1 AT19148 [0,1,0,0,0,0|2,0,0]=3 196 B11R1.157 CC(=O)CC1=CC(C)=CC=C1 N12785 [0,1,0,0,0,0|1,0,1]=3 197 B11R1.157 CC(C)CC1=CC=CC(N)=C1 O11024 [0,1,0,0,0,0|2,0,0]=3 198 B11R1.157 CC(C)NC1=CC=CC(Br)=C1 C77831 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 C78133 [0,1,0,0,0,0|3,0,0]=4 200 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 AC5601 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.157 CC1=CC=CC(C[C@H](C)N)=C1 N11054 [0,1,0,0,0,0|0,0,0]=1 202 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 E72139 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 83690 [0,1,0,0,0,0|1,0,0]=2 204 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 N11066 [0,1,0,0,0,0|1,0,0]=2 205 B11R1.157 C[C@H](N)CC1=CC=CC(F)=C1 N10878 [0,1,0,0,0,0|1,0,0]=2 206 B11R1.157 C[S@](=O)CC1=CC(N)=CC=C1 AT15220 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.157 FC(F)OC1=CC=CC(Cl)=C1 F19087 [0,1,0,0,0,0|3,0,0]=4 208 B11R1.157 N=C(N)NC1=CC=CC(Cl)=C1 C12447 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.157 N=C(N)NC1=CC=CC(F)=C1 C16183 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.157 N=C(N)NC1=CC=CC(O)=C1 S11159 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.157 NC(=O)NC1=CC(N)=CC=C1 F19865 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.157 OB(O)CC1=CC=CC(F)=C1 D79888 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.182 CC1=C(CC#N)C=C(Cl)C=C1 AT13429 [0,1,0,0,0,0|1,0,2]=4 214 B11R1.182 CC1=C(CCN)C=C(Cl)C=C1 AT13431 [0,1,0,0,0,0|1,0,0]=2 215 B11R1.182 CC1=CC(CC#N)=C(Br)C=C1 D96277 [0,1,0,0,0,0|0,0,2]=3 216 B11R1.182 CCCC1=C(Br)C=CC(O)=C1 57995 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.182 CCCN1C=C(N)C=CC1=O AT19282 [0,1,0,0,0,0|3,0,0]=4 218 B11R1.182 CCOC1=C(F)C=CC(Br)=C1 H11056 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.182 CNCC1=C(Cl)C=CC(Cl)=C1 76693 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.182 CNCC1=C(F)C=CC(Br)=C1 36267 [0,1,0,0,0,0|3,0,0]=4 221 B11R1.182 COCC1=C(Br)C=CC(F)=C1 N11817 [0,1,0,0,0,0|3,0,0]=4 222 B11R1.182 ClC1=CC(CCBr)=C(Cl)C=C1 C78205 [0,1,0,0,0,0|2,0,0]=3 223 B11R1.182 NC1=CN(CCO)C(=O)C=C1 AT19231 [0,1,0,0,0,0|3,0,0]=4 224 B11R1.182 NCCC1=C(Br)C=CC(Cl)=C1 AT11063 [0,1,0,0,0,0|1,0,0]=2 225 B11R1.182 NCCC1=C(F)C=CC(Br)=C1 N12525 [0,1,0,0,0,0|1,0,0]=2 226 B11R1.182 NCCC1=C(F)C=CC(F)=C1 AT21560 [0,1,0,0,0,0|1,0,0]=2 227 B11R1.182 NCCN1C=C(Br)C=CC1=O AT19269 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.182 NNCC1=C(Br)C=CC(Cl)=C1 AC5350 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.182 NNCC1=C(Cl)C=CC(F)=C1 AC5377 [0,1,0,0,0,0|2,0,0]=3 230 B11R1.182 NNCC1=C(F)C=CC(Br)=C1 AC5379 [0,1,0,0,0,0|2,0,0]=3 231 B11R1.182 N\N=C\C1=C(F)C=CC(Br)=C1 36791 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.182 O=C1C=CC(Br)=CN1CCO AT13854 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.189 CCCC1=CC=CC(OC)=C1 AC9509 [0,1,0,0,0,0|1,0,0]=2 234 B11R1.189 CCOC1=CC(CN)=CC=C1 N12140 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.189 CCSC1=CC(C#N)=CC=C1 AT20900 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.189 COC1=NC=CC(CC#N)=C1 81696 [0,1,0,0,0,0|1,0,2]=4 237 B11R1.189 COC1=NC=CC(CCN)=C1 AT18209 [0,1,0,0,0,0|1,0,0]=2 238 B11R1.189 COCC1=CC(C#N)=CC=C1 O10889 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.189 COCC1=CC=CC(OC)=C1 N11528 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.189 N#CC1=CC(CCN)=CC=C1 72737 [0,1,0,0,0,0|0,0,1]=2 241 B11R1.192 CC1=C(Br)C=C(CC#N)C=C1 97483 [0,1,0,0,0,0|1,0,2]=4 242 B11R1.192 CC1=C(Cl)C=CC(CC#N)=C1 D96292 [0,1,0,0,0,0|0,0,2]=3 243 B11R1.192 CC1=CC(CC#N)=CN=C1Cl 97210 [0,1,0,0,0,0|1,0,2]=4 244 B11R1.192 CCCC1=CC(Br)=C(Cl)C=C1 F31327 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.192 CCOC1=CC(F)=C(O)C=C1 94989 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.192 CCOC1=CC(N)=C(N)C=C1 34477 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.192 CCOC1=NC(C)=C(N)C=C1 F51299 [0,1,0,0,0,0|3,0,0]=4 248 B11R1.192 CCSC1=CC(Cl)=C(Br)C=C1 89705 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.192 CNCC1=CC(F)=C(F)C=C1 N12835 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.192 ClC1=C(Cl)C=C(CCBr)C=C1 C78192 [0,1,0,0,0,0|2,0,0]=3 251 B11R1.192 FC1=C(Br)C=CC(CCBr)=C1 AC8493 [0,1,0,0,0,0|2,0,0]=3 252 B11R1.192 N#CCC1=CC(Br)=C(Cl)C=C1 D96285 [0,1,0,0,0,0|1,0,2]=4 253 B11R1.192 N#CCC1=CC(F)=C(O)C=C1 F13577 [0,1,0,0,0,0|1,0,2]=4 254 B11R1.192 NNCC1=CC(Br)=C(F)C=C1 E71963 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.192 NNCC1=CC(Cl)=C(Cl)C=C1 AC5360 [0,1,0,0,0,0|2,0,0]=3 256 B11R1.192 NNCC1=CC(F)=C(F)C=C1 AC5348 [0,1,0,0,0,0|2,0,0]=3 257 B11R1.192 O=CCC1=CC(Cl)=C(Cl)C=C1 25894 [0,1,0,0,0,0|2,0,1]=4 258 B11R2.35 CC1=CC(C2CC2)=NC=C1 AC9117 [0,0,0,1,0,0|2,0,0]=3 259 B11R2.35 CC1=CC(C2CC2)=NC=N1 96956 [0,0,0,1,0,0|3,0,0]=4 260 B11R2.35 CC1=CC=CC(C2CC2)=C1 AC9451 [0,0,0,1,0,0|1,0,0]=2 261 B11R2.35 CC1=CC=CC(C2CC2)=N1 AC9039 [0,0,0,1,0,0|2,0,0]=3 262 B11R2.35 ClC1=CC(C2CC2)=CC=C1 97830 [0,0,0,1,0,0|2,0,0]=3 263 B11R2.35 NC1=CC(C2CC2)=CN=C1 S11509 [0,0,0,1,0,0|3,0,0]=4 264 B11R2.35 NC1=CC(C2CC2)=NC=C1 F52584 [0,0,0,1,0,0|3,0,0]=4 265 B11R2.35 NC1=NC(C2CC2)=CC=C1 AT24911 [0,0,0,1,0,0|3,0,0]=4 266 B11R2.35 OC1=CC(C2CC2)=CC=C1 97835 [0,0,0,1,0,0|2,0,0]=3 267 B11R2.35 OC1=CC(C2CC2)=NC=C1 55360 [0,0,0,1,0,0|3,0,0]=4 268 B11R2.36 CC1=CC2=C(C=C1)CNC2 71833 [0,0,0,1,0,0|2,0,0]=3 269 B11R2.36 CC1=CC2=C(C=C1)CNC2 W10108 [0,0,0,1,0,0|2,0,0]=3 270 B11R2.36 CC1=CC2=NSN=C2C=C1 F52629 [0,0,0,1,0,0|2,0,1]=4 271 B11R2.36 CC1=NC=C2CNCC2=C1 F17653 [0,0,0,1,0,0|3,0,0]=4 272 B11R2.36 CC1=NC=C2CNCC2=C1 S11542 [0,0,0,1,0,0|3,0,0]=4 273 B11R2.36 FC1=CC2=C(C=C1)CCC2 36515 [0,0,0,1,0,0|2,0,0]=3 274 B11R2.36 IC1=CC2=C(C=C1)CCC2 C12643 [0,0,0,1,0,0|2,0,0]=3 275 B11R2.36 IC1=CC2=C(C=C1)CNC2 32000 [0,0,0,1,0,0|3,0,0]=4 276 B11R2.36 NC1=CC2=C(C=C1)CNC2 SC4171 [0,0,0,1,0,0|3,0,0]=4 277 B11R2.36 NC1=CC2=C(C=C1)OCC2 88994 [0,0,0,1,0,0|2,0,0]=3 278 B11R2.36 NC1=CN=C2CCCC2=C1 F30816 [0,0,0,1,0,0|3,0,0]=4 279 B11R2.36 OC1=CN=C2CCCC2=C1 F30817 [0,0,0,1,0,0|3,0,0]=4 280 B11R2.36 OC1=NC2=C(C=C1)CCC2 20278 [0,0,0,1,0,0|3,0,0]=4 281 B11R2.36 SC1=CC2=C(C=C1)NN=C2 F18088 [0,0,0,1,0,0|2,0,1]=4 282 B11R2.106 BrC1=C2CCCC2=NC=C1 F53407 [0,0,0,1,0,0|3,0,0]=4 283 B11R2.106 BrC1=C2CCOC2=CC=C1 F12556 [0,0,0,1,0,0|3,0,0]=4 284 B11R2.106 CC1=C2CCOC2=NC=C1 97225 [0,0,0,1,0,0|3,0,0]=4 285 B11R2.106 CC1=C2N=CNC2=CC=C1 31265 [0,0,0,1,0,0|1,0,2]=4 286 B11R2.106 CC1=C2SN=NC2=CC=C1 D87603 [0,0,0,1,0,0|3,0,0]=4 287 B11R2.106 CC1=CC=CC2=C1CNC2 W10109 [0,0,0,1,0,0|2,0,0]=3 288 B11R2.106 CC1=CC=CC2=C1N=CO2 F18678 [0,0,0,1,0,0|1,0,2]=4 289 B11R2.106 CC1=CC=CC2=C1N=NN2 C80091 [0,0,0,1,0,0|2,0,1]=4 290 B11R2.106 CC1=CC=CC2=C1N=N[N-]2 F20812 [0,0,0,1,0,0|2,0,1]=4 291 B11R2.106 CC1=NC=CC2=C1N=NC2 F17937 [0,0,0,1,0,0|2,0,1]=4 292 B11R2.106 ClC1=C2CCCC2=CC=C1 N13077 [0,0,0,1,0,0|2,0,0]=3 293 B11R2.106 ClC1=C2CNCC2=CC=C1 FD13081 [0,0,0,1,0,0|3,0,0]=4 294 B11R2.106 ClC1=C2OCCC2=CC=C1 F53809 [0,0,0,1,0,0|2,0,0]=3 295 B11R2.106 FC1=C2NCCC2=CC=C1 C73504 [0,0,0,1,0,0|1,0,0]=2 296 B11R2.106 IC1=C2CCOC2=CC=C1 E72245 [0,0,0,1,0,0|3,0,0]=4 297 B11R2.106 NC1=C2OCCC2=CC=N1 F53509 [0,0,0,1,0,0|3,0,0]=4 298 B9R1.7 CC1=CC(CON)=NO1 D74102 [0,0,0,0,1,0|3,0,0]=4 299 B9R1.7 CC1=CC=C(CCN)S1 31616 [0,0,0,0,1,0|1,0,0]=2 300 B9R1.7 CC1=CNC(CCN)=N1 F17871 [0,0,0,0,1,0|2,0,0]=3 301 B9R1.7 CC1=CSC(CCN)=C1 96997 [0,0,0,0,1,0|1,0,0]=2 302 B9R1.7 CC1=NC(CCN)=CO1 AT18664 [0,0,0,0,1,0|2,0,0]=3 303 B9R1.7 CC1=NN=C(CCN)N1 73391 [0,0,0,0,1,0|3,0,0]=4 304 B9R1.7 CC1=NN=C(CCN)S1 AT18987 [0,0,0,0,1,0|3,0,0]=4 305 B9R1.7 CC1=NNC(CCN)=N1 AT12330 [0,0,0,0,1,0|3,0,0]=4 306 B9R1.7 CN1C=CC(CCO)=N1 AT15991 [0,0,0,0,1,0|3,0,0]=4 307 B9R1.7 CN1C=NC(CCO)=C1 AT15589 [0,0,0,0,1,0|3,0,0]=4 308 B9R1.7 CNCC1=CC=C(C)S1 75578 [0,0,0,0,1,0|3,0,0]=4 309 B9R1.7 NCCC1=CN=C(O)S1 S10248 [0,0,0,0,1,0|3,0,0]=4 310 B9R1.7 NCCC1=NC=C(Br)S1 AT14710 [0,0,0,0,1,0|3,0,0]=4 311 B9R1.7 NCCN1C=C(Br)C=N1 AT16015 [0,0,0,0,1,0|3,0,0]=4 312 B9R1.7 NNCC1=CC=C(Cl)S1 P10520 [0,0,0,0,1,0|3,0,0]=4 313 B9R1.33 CC1=C(CCCl)SC=N1 T71110 [0,0,0,0,1,0|3,0,0]=4 314 B9R1.33 CC1=C(CCN)N=CN1 C15676 [0,0,0,0,1,0|2,0,0]=3 315 B9R1.33 CC1=C(CCN)N=CO1 AT18666 [0,0,0,0,1,0|2,0,0]=3 316 B9R1.33 CC1=C(CCN)SC=N1 D84303 [0,0,0,0,1,0|2,0,0]=3 317 B9R1.33 CCOC1=C(C)C=CS1 91672 [0,0,0,0,1,0|3,0,0]=4 318 B9R1.33 CN1C=CN=C1CCN AT24187 [0,0,0,0,1,0|2,0,0]=3 319 B9R1.33 CN1N=CC=C1CCO AT15967 [0,0,0,0,1,0|3,0,0]=4 320 B9R1.33 CN1N=CN=C1CCN AT12257 [0,0,0,0,1,0|3,0,0]=4 321 B8R1.2 NCC1=CC=CC=C1 T70846 [2,0,0,0,0,0|0,0,0]=2 322 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [2,0,0,0,0,0|2,0,0]=4 323 B8R1.4 CC1=CC(I)=NC=C1 D87895 [2,0,0,0,0,0|2,0,0]=4 324 B8R1.4 NC1=CC=CC(=S)N1 C15708 [2,0,0,0,0,0|2,0,0]=4 325 B8R1.4 [2H]C1=CC=CC([2H])=C1 D99674 [2,0,0,0,0,0|2,0,0]=4 326 B10R1.2 CC1=C(F)C=CC=C1CN N12172 [1,1,0,0,0,0|1,0,0]=3 327 B10R1.2 CC1=C(O)C=CC=C1CO 56654 [1,1,0,0,0,0|2,0,0]=4 328 B10R1.2 CC1=CC=CC(C#N)=C1S AT20894 [1,1,0,0,0,0|0,0,2]=4 329 B10R1.2 CC1=CC=CC(CN)=C1O N10504 [1,1,0,0,0,0|0,0,0]=2 330 B10R1.2 CCC1=C(Br)C(C)=CC=C1 D85933 [1,1,0,0,0,0|0,0,0]=2 331 B10R1.2 CCC1=CC=CC(Cl)=C1N W13802 [1,1,0,0,0,0|1,0,0]=3 332 B10R1.2 CCN1C=CC=C(N)C1=O AT19274 [1,1,0,0,0,0|2,0,0]=4 333 B10R1.2 CN1C=CC=C(CN)C1=O P11876 [1,1,0,0,0,0|1,0,0]=3 334 B10R1.2 CNC1=CC=CC(F)=C1N AC7422 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.2 COC1=C(N)C(N)=CC=C1 F52601 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.2 COC1=C(O)C(N)=CC=C1 O10655 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.2 COC1=CC=CC(Cl)=C1N CL9246 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.2 COC1=CC=CC(S)=C1N AT19649 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.2 CSC1=C(C)C(N)=CC=C1 AT20858 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.2 CSC1=CC=CC(Br)=C1C AC7030 [1,1,0,0,0,0|2,0,0]=4 341 B10R1.2 NCC1=CC=CC(F)=C1O N12979 [1,1,0,0,0,0|1,0,0]=3 342 B10R1.2 NCC1=CC=CC(I)=C1Cl C72087 [1,1,0,0,0,0|1,0,0]=3 343 B10R1.2 NNC1=CC=CC(Br)=C1F 53855 [1,1,0,0,0,0|2,0,0]=4 344 B10R1.2 OCC1=CC=CC(Cl)=C1F A12360 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.8 CC1=CC(C)=NC(CN)=N1 79538 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.8 CC1=CC(CCl)=CC(Cl)=N1 57849 [1,1,0,0,0,0|2,0,0]=4 347 B10R1.8 CC1=CC(CCl)=NC(C)=C1 O10512 [1,1,0,0,0,0|2,0,0]=4 348 B10R1.8 CC1=CC(CN)=CC(Cl)=N1 57851 [1,1,0,0,0,0|1,0,0]=3 349 B10R1.8 CCC1=CC(C)=CC(Br)=C1 C90915 [1,1,0,0,0,0|0,0,0]=2 350 B10R1.8 CCC1=CC(Cl)=NC(C)=N1 76084 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.8 CCC1=CC(N)=NC(C)=N1 CS1422 [1,1,0,0,0,0|2,0,0]=4 352 B10R1.8 CNC1=CC(C)=NC(C)=C1 78071 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.8 CNC1=CC(I)=CC(Br)=C1 F14267 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.8 COC1=CC(I)=CC(F)=C1 AT12533 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.8 FCC1=CC(Br)=CC(F)=C1 94378 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.8 FCC1=CC(I)=CC(F)=C1 94383 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.8 NCC1=CC(Cl)=CC(Cl)=N1 C91444 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.8 NCC1=CC(Cl)=CC(Cl)=N1 D81608 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.8 NNC1=CC(Cl)=CC(F)=C1 D88071 [1,1,0,0,0,0|2,0,0]=4 360 B10R1.8 OCC1=CC(I)=CC(F)=C1 94382 [1,1,0,0,0,0|2,0,0]=4 361 B10R1.8 OCC1=CC(S)=CC(S)=C1 F19554 [1,1,0,0,0,0|2,0,0]=4 362 B10R1.30 BrCC1=C(Br)C=CC(Br)=C1 68639 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.30 BrCC1=C(Br)C=CC(I)=C1 CL9154 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.30 BrCC1=C(I)C=CC(Br)=C1 CL9155 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.30 CC1=C(CBr)C=C(Cl)C=C1 73456 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.30 CC1=C(CO)C=C(O)C=C1 AC3540 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.30 CC1=CC(C#N)=C(S)C=C1 AT20893 [1,1,0,0,0,0|0,0,2]=4 368 B10R1.30 CC1=CC(CBr)=C(F)C=C1 98276 [1,1,0,0,0,0|1,0,0]=3 369 B10R1.30 CC1=CC(CO)=C(I)C=C1 H11526 [1,1,0,0,0,0|1,0,0]=3 370 B10R1.30 CC1=CN=C(Cl)C(CO)=C1 D85930 [1,1,0,0,0,0|2,0,0]=4 371 B10R1.30 CC1=NC(CO)=C(F)C=C1 C91534 [1,1,0,0,0,0|2,0,0]=4 372 B10R1.30 CC1=NNC(=O)C(CN)=C1 P13172 [1,1,0,0,0,0|2,0,0]=4 373 B10R1.30 CCC1=C(Br)C=NC(Cl)=C1 AT13829 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.30 CCC1=C(C)C=CC(C)=C1 T71937 [1,1,0,0,0,0|0,0,0]=2 375 B10R1.30 CCC1=CC(Br)=NC=C1N 51679 [1,1,0,0,0,0|2,0,0]=4 376 B10R1.30 CCN1C=C(N)C=CC1=O AT19278 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.30 CNC1=C(F)C=CC(Br)=C1 AC3023 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.30 CNC1=C(N)C=CC(Cl)=C1 C76710 [1,1,0,0,0,0|2,0,0]=4 379 B10R1.30 CNC1=C(O)C=CC(C)=C1 C16345 [1,1,0,0,0,0|1,0,0]=3 380 B10R1.30 CNC1=NC(C)=CC=C1N S10557 [1,1,0,0,0,0|2,0,0]=4 381 B10R1.30 COC1=C(C)C=CC(O)=C1 AT19376 [1,1,0,0,0,0|2,0,0]=4 382 B10R1.30 COC1=C(S)C=CC(N)=C1 D87749 [1,1,0,0,0,0|2,0,0]=4 383 B10R1.30 CSC1=C(Br)C=CC(Br)=C1 C13369 [1,1,0,0,0,0|2,0,0]=4 384 B10R1.30 CSC1=C(N)C=CC(C)=C1 AT20827 [1,1,0,0,0,0|1,0,0]=3 385 B10R1.30 NCC1=C(Br)C=CC(F)=C1 AC7757 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.30 NCC1=C(Br)C=CC(O)=C1 D88088 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.30 NCC1=C(F)C=CC(N)=C1 AC9197 [1,1,0,0,0,0|1,0,0]=3 388 B10R1.30 NCC1=C(I)C=CC(Br)=C1 67324 [1,1,0,0,0,0|1,0,0]=3 389 B10R1.30 NCC1=C(N)C=CC(Br)=C1 O10495 [1,1,0,0,0,0|1,0,0]=3 390 B10R1.30 NCC1=C(N)C=CC(F)=C1 CK2412 [1,1,0,0,0,0|1,0,0]=3 391 B10R1.30 NCC1=C(O)C=CC(Br)=C1 76231 [1,1,0,0,0,0|1,0,0]=3 392 B10R1.30 NCC1=CC(Br)=CN=C1F P12283 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.30 NCC1=CC(Br)=CN=C1N AC3840 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.30 NCC1=CC(Cl)=CN=C1O 79398 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.30 NNC1=C(Cl)C=CC(Br)=C1 E72103 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.30 NNC1=C(F)C=CC(Cl)=C1 A51221 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.113 C=C(C)C1=CC=CC(Br)=C1 AC1303 [1,1,0,0,0,0|1,0,1]=4 398 B10R1.113 CC(C)C1=CC(Cl)=NC=C1 D71924 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.113 CC1=CC(C(F)F)=NC=C1 C91253 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.113 CC1=CC=CC(C(=N)N)=N1 74734 [1,1,0,0,0,0|1,0,1]=4 401 B10R1.113 CC1=CC=CC(C(C)C)=C1 T71023 [1,1,0,0,0,0|0,0,0]=2 402 B10R1.113 CC1=CC=CC(N(C)C)=N1 N10110 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.113 CC1=CC=CC([C@H](C)N)=N1 N13137 [1,1,0,0,0,0|1,0,0]=3 404 B10R1.113 CC1=NC=CC(C(C)C)=N1 O11252 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.113 CC1=NC=CC([C@H](C)O)=C1 F13150 [1,1,0,0,0,0|1,0,0]=3 406 B10R1.113 C[C@H](Br)C1=CC(Cl)=CC=C1 55213 [1,1,0,0,0,0|1,0,0]=3 407 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=C1 55217 [1,1,0,0,0,0|1,0,0]=3 408 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=N1 55243 [1,1,0,0,0,0|2,0,0]=4 409 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 90822 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 AC3205 [1,1,0,0,0,0|2,0,0]=4 411 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 90825 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 N10537 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 N13087 [1,1,0,0,0,0|2,0,0]=4 414 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 90539 [1,1,0,0,0,0|2,0,0]=4 415 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 90540 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70883 [1,1,0,0,0,0|1,0,0]=3 417 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y11581 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.113 C[C@H](N)C1=CC=CC(N)=N1 D81409 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 F16880 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.113 C[C@H](N)C1=NC=CC(Br)=C1 90526 [1,1,0,0,0,0|2,0,0]=4 421 B10R1.113 C[C@H](N)C1=NC=CC(Cl)=C1 N14934 [1,1,0,0,0,0|2,0,0]=4 422 B10R1.113 C[C@H](N)C1=NC=CC(Cl)=C1 N14935 [1,1,0,0,0,0|2,0,0]=4 423 B10R1.113 C[C@H](O)C1=CC(F)=CN=C1 AT10686 [1,1,0,0,0,0|2,0,0]=4 424 B10R1.113 C[C@H](O)C1=CC(N)=NC=C1 CS1317 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1245 [1,1,0,0,0,0|1,0,0]=3 426 B10R1.113 C[C@H](O)C1=CC=CC(F)=N1 AT10689 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.113 C[C@H](O)C1=CC=CC(O)=C1 59959 [1,1,0,0,0,0|1,0,0]=3 428 B10R1.113 C[C@H](O)C1=NC=CC(F)=C1 AT10691 [1,1,0,0,0,0|2,0,0]=4 429 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50248 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50315 [1,1,0,0,0,0|2,0,0]=4 431 B10R1.113 FC(F)C1=CC=CC(S)=C1 97706 [1,1,0,0,0,0|2,0,0]=4 432 B10R1.113 NC(=S)C1=CC=CC(I)=C1 A10482 [1,1,0,0,0,0|1,0,1]=4 433 B10R1.172 BrCC1=CC=CC(CBr)=N1 AC6696 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.172 BrCC1=CN=CC(CBr)=C1 C11061 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.172 BrCC1=CN=CC(CBr)=C1 F30548 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.172 CCC1=CC=CC(C#N)=N1 87882 [1,1,0,0,0,0|1,0,1]=4 437 B10R1.172 CCC1=CC=CC(CO)=C1 D85939 [1,1,0,0,0,0|0,0,0]=2 438 B10R1.172 CCC1=NC=CC(CN)=C1 57083 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.172 CNC1=CC=CC(CO)=C1 AT21037 [1,1,0,0,0,0|1,0,0]=3 440 B10R1.172 CNC1=CC=CC(SC)=C1 AT20859 [1,1,0,0,0,0|1,0,0]=3 441 B10R1.172 CNC1=NC=CC(CO)=C1 AT18191 [1,1,0,0,0,0|2,0,0]=4 442 B10R1.172 COC1=CC(CCl)=CN=C1 81942 [1,1,0,0,0,0|2,0,0]=4 443 B10R1.172 COC1=CC=CC(CCl)=N1 81766 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.172 COC1=NC(CN)=CC=C1 79028 [1,1,0,0,0,0|1,0,0]=3 445 B10R1.172 COC1=NC(NN)=CC=C1 F16103 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.172 COC1=NC=CC(CCl)=C1 P17364 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.172 COC1=NC=CC(SC)=C1 F50801 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.172 COC1=NC=NC(CN)=C1 P12885 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.172 CSC1=CC(CN)=CC=C1 N14326 [1,1,0,0,0,0|0,0,0]=2 450 B10R1.172 CSC1=CN=CC(SC)=C1 H11054 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.172 NCC1=CC=CC(CO)=C1 C75075 [1,1,0,0,0,0|0,0,0]=2 452 B10R1.172 OCC1=CN=CC(CO)=C1 61754 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.176 BrCC1=CC(Br)=C(I)C=C1 AT26690 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.176 BrCC1=CC(I)=C(Br)C=C1 97476 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.176 C#CC1=CC(C)=C(Br)C=C1 C91264 [1,1,0,0,0,0|0,0,2]=4 456 B10R1.176 CC1=C(Br)C=CC(CCl)=C1 D87322 [1,1,0,0,0,0|1,0,0]=3 457 B10R1.176 CC1=C(Br)C=CC(NN)=N1 80859 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.176 CC1=C(Br)C=NC(CN)=C1 AC7093 [1,1,0,0,0,0|1,0,0]=3 459 B10R1.176 CC1=C(Br)C=NC(CO)=C1 C72572 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.176 CC1=C(F)C=CC(CO)=N1 O10128 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.176 CC1=C(I)C=C(CO)C=C1 D75885 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.176 CC1=C(N)C=CC(CO)=C1 F15978 [1,1,0,0,0,0|1,0,0]=3 463 B10R1.176 CC1=C(O)C=CC(CN)=C1 N14330 [1,1,0,0,0,0|0,0,0]=2 464 B10R1.176 CC1=CC(CCl)=CN=C1Cl 97209 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.176 CC1=CC(CO)=CN=C1C F53420 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.176 CCC1=CC(N)=C(Br)C=N1 C14681 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.176 CCC1=CC(N)=C(C)C=C1 F21363 [1,1,0,0,0,0|1,0,0]=3 468 B10R1.176 CCC1=CC(O)=C(F)C=C1 F30470 [1,1,0,0,0,0|1,0,0]=3 469 B10R1.176 CCC1=CC(O)=C(O)C=C1 70407 [1,1,0,0,0,0|1,0,0]=3 470 B10R1.176 CCC1=NC(C)=C(O)C=C1 76361 [1,1,0,0,0,0|1,0,0]=3 471 B10R1.176 CN1C=C(CN)C=CC1=O P11875 [1,1,0,0,0,0|1,0,0]=3 472 B10R1.176 CNC1=CC(Cl)=C(Br)C=C1 AC3296 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.176 CNC1=CC(Cl)=C(C)C=C1 C77674 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.176 CNC1=CC(F)=C(Br)C=C1 S10823 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.176 COC1=CC(C)=[N+]([O-])C=C1 F18022 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.176 COC1=CC(N)=C(I)C=C1 O10806 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.176 COC1=CC(N)=C(S)C=C1 AT19646 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.176 COC1=CC(N)=C(S)C=C1 AT19647 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.176 COC1=CC(S)=C(N)C=C1 C90511 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.176 CSC1=CC(C)=C(Br)C=C1 AT14181 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.176 CSC1=CC(C)=C(Br)C=N1 AT14153 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.176 CSC1=CC(C)=C(O)C=C1 AT20904 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.176 CSC1=CC(N)=C(C)C=C1 AT20856 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.176 CSC1=NC(C)=C(Br)C=C1 AT14158 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.176 FC1=C(Br)C=C(CCl)C=C1 W16546 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.176 FC1=C(Br)C=CC(CCl)=C1 96328 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.176 FC1=C(Cl)C=CC(CCl)=C1 CK1006 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.176 NCC1=CC(O)=C(N)C=C1 F13360 [1,1,0,0,0,0|1,0,0]=3 489 B10R1.176 NCC1=CC=C(Cl)C(Cl)=N1 D97054 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.176 NCC1=CN=C(Br)C(Cl)=C1 Y11680 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.176 NNC1=CC(Br)=C(F)C=C1 54717 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.176 OCC1=CC(I)=C(Br)C=C1 97475 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.1 CC1=CC=C(CNN)C=C1 O10110 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.1 CC1=CN=C(CCN)N=C1 AT18271 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.1 CC1=NC=C(CNN)C=C1 F15210 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.1 COCC1=CC=C(S)C=C1 AT20980 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.1 CSCC1=CC=C(Cl)C=C1 W18700 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.1 NC1=CC=C(OCF)C=C1 68782 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.1 NCCC1=CC=C(I)C=C1 C78427 [1,1,0,0,0,0|0,0,0]=2 500 B10R1.1 NCCC1=NC=C(Br)C=C1 P10593 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.1 NNCC1=CC=C(Br)C=C1 AC3503 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.1 NNCC1=CC=C(Cl)C=C1 37006 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.1 N\N=C\C1=CC=C(O)C=C1 F15571 [1,1,0,0,0,0|1,0,1]=4 504 B10R1.1 OCCC1=CN=C(Br)C=C1 AC9473 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.1 OCCC1=CN=C(F)C=C1 AC9525 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.4 CC1=C(CC=O)C=CC=C1 W16821 [1,1,0,0,0,0|1,0,1]=4 507 B10R1.4 CC1=C(CON)C=CC=C1 D77271 [1,1,0,0,0,0|1,0,0]=3 508 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [1,1,0,0,0,0|1,0,0]=3 509 B10R1.4 CCNC1=C(F)C=CC=C1 D87863 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.4 CCSC1=C(Br)C=CC=C1 AT20838 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.4 CCSC1=C(O)C=CC=C1 AT20889 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.4 CNCC1=C(N)C=CC=C1 F13330 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.4 NC1=C(CCF)C=NC=C1 P14647 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.4 NCCN1C=CC=CC1=O F15207 [1,1,0,0,0,0|1,0,0]=3 515 B10R1.4 NCCN1C=CC=NC1=O AT13871 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.4 NCCN1C=NC=CC1=O AT13878 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.4 NNCC1=C(Cl)C=CC=C1 W12211 [1,1,0,0,0,0|1,0,0]=3 518 B10R1.4 O=C1C=CC=CN1CCBr AT19229 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.4 O=CCC1=C(Cl)C=CC=C1 W16822 [1,1,0,0,0,0|1,0,1]=4 520 B10R1.15 C=C(CO)C1=CC=CC=C1 A11577 [1,1,0,0,0,0|1,0,1]=4 521 B10R1.15 CC[C@H](N)C1=CC=CC=C1 N12648 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10611 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 L10186 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1146 [1,1,0,0,0,0|1,0,1]=4 525 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1167 [1,1,0,0,0,0|1,0,1]=4 526 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10550 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10551 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14528 [1,1,0,0,0,0|1,0,0]=3 529 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14530 [1,1,0,0,0,0|1,0,0]=3 530 B10R1.15 NCC(=O)C1=CN=CC=C1 D87739 [1,1,0,0,0,0|1,0,1]=4 531 B10R1.15 NCC(=O)C1=CN=CC=C1 F13353 [1,1,0,0,0,0|1,0,1]=4 532 B10R1.15 NC[C@H](O)C1=CC=NC=C1 C78562 [1,1,0,0,0,0|1,0,0]=3 533 B10R1.15 NC[C@H](O)C1=CN=CC=C1 33361 [1,1,0,0,0,0|1,0,0]=3 534 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11546 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12429 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12120 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12118 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12119 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12430 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.15 O[C@@H](CCl)C1=CN=CC=C1 Y10944 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.17 BrCCSC1=CC=NC=C1 AT18153 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.17 CNCCC1=CC=CN=C1 C73747 [1,1,0,0,0,0|1,0,0]=3 543 B10R1.17 CNCCC1=CC=NC=C1 AR1715 [1,1,0,0,0,0|1,0,0]=3 544 B10R1.17 CNNCC1=NC=CC=C1 30190 [1,1,0,0,0,0|2,0,0]=4 545 B10R1.17 FCCNC1=CC=CC=C1 D77931 [1,1,0,0,0,0|1,0,0]=3 546 B10R1.17 NCCNC1=NC=CC=C1 O12009 [1,1,0,0,0,0|1,0,0]=3 547 B10R1.17 NCCNC1=NC=CC=N1 AT18241 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.17 NCCOC1=NC=CC=N1 AT18221 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.17 NC\C=C\C1=CC=CC=C1 A12523 [1,1,0,0,0,0|0,0,1]=3 550 B10R1.17 NNCCC1=CC=CC=C1 AC4670 [1,1,0,0,0,0|0,0,0]=2 551 B10R1.17 NOCCC1=CC=CC=C1 C10179 [1,1,0,0,0,0|0,0,0]=2 552 B10R1.17 O=CCCC1=NC=CC=C1 P20552 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.17 O=CCOC1=CC=CC=C1 C15303 [1,1,0,0,0,0|1,0,1]=4 554 B10R1.17 OCCCC1=CN=CC=C1 AC5531 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.17 OCCOC1=NC=CC=C1 C90307 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.17 SCCCC1=CN=CC=C1 F18019 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.17 SCCCC1=NC=CC=C1 F18728 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.18 CC(C)CC1=CC=NC=C1 AC2809 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.18 C[C@H](N)CC1=CC=NC=C1 F11581 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.18 C[C@H](N)CC1=NC=CC=C1 F13183 [1,1,0,0,0,0|1,0,0]=3 561 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71821 [1,1,0,0,0,0|1,0,0]=3 562 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71861 [1,1,0,0,0,0|1,0,0]=3 563 B10R1.18 N=C(N)CC1=CC=CC=C1 C15976 [1,1,0,0,0,0|0,0,1]=3 564 B10R1.18 OB(O)CC1=CC=CC=C1 32975 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.14 CC1=CC=C([C@@H](N)CO)O1 N16761 [0,1,0,0,1,0|2,0,0]=4 566 B10R1.14 CC1=CC=C([C@@H](N)CO)O1 N16762 [0,1,0,0,1,0|2,0,0]=4 567 B10R1.14 CC1=CC=C([C@@H](N)CO)O1 N16763 [0,1,0,0,1,0|2,0,0]=4 568 B10R1.14 NC[C@H](N)C1=CC=C(Br)O1 N14886 [0,1,0,0,1,0|2,0,0]=4 569 B10R1.16 CC1=CC=C(CCCN)S1 W12103 [0,1,0,0,1,0|1,0,0]=3 570 B10R1.16 CC1=CN=C(CCCN)N1 F17811 [0,1,0,0,1,0|2,0,0]=4 571 B10R1.131 CC1=C(Br)C=C(CCO)S1 D86651 [0,1,0,0,1,0|2,0,0]=4 572 B10R1.5 BrCCC1=C(CBr)C=CS1 H11171 [0,1,0,0,1,0|2,0,0]=4 573 B10R1.5 NCCC1=C(CO)N=CO1 AT18733 [0,1,0,0,1,0|2,0,0]=4 574 B10R1.29 CNCCN1C=CN=C1C D75971 [0,1,0,0,1,0|2,0,0]=4 575 B10R1.149 CN1C=CN=C1[C@@H](O)CN F20265 [0,1,0,0,1,0|2,0,0]=4 576 B10R1.187 CC1=NNC(C)=C1CCN C80023 [0,1,0,0,1,0|2,0,0]=4 577 B10R1.187 CN1N=CC(Br)=C1CCN D79720 [0,1,0,0,1,0|2,0,0]=4 578 B10R1.187 NCCN1C(=O)C=CC1=O D73536 [0,1,0,0,1,0|2,0,0]=4 579 B12R1.24 C=C[C@H](N)C1=C(F)C(C)=CC=C1 N15328 [0,2,0,0,0,0|1,0,1]=4 580 B12R1.24 C=C[C@H](N)C1=C(F)C(C)=CC=C1 N15329 [0,2,0,0,0,0|1,0,1]=4 581 B12R1.24 CC1=CC=CC(C(=O)CCl)=C1O AC6764 [0,2,0,0,0,0|1,0,1]=4 582 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Br N13711 [0,2,0,0,0,0|0,0,0]=2 583 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Br N13712 [0,2,0,0,0,0|0,0,0]=2 584 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Br N13713 [0,2,0,0,0,0|0,0,0]=2 585 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1C N13748 [0,2,0,0,0,0|0,0,0]=2 586 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1C N13749 [0,2,0,0,0,0|0,0,0]=2 587 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1C N13750 [0,2,0,0,0,0|0,0,0]=2 588 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1C N13751 [0,2,0,0,0,0|0,0,0]=2 589 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1C N13752 [0,2,0,0,0,0|0,0,0]=2 590 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Cl N13574 [0,2,0,0,0,0|0,0,0]=2 591 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Cl N13575 [0,2,0,0,0,0|0,0,0]=2 592 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Cl N13576 [0,2,0,0,0,0|0,0,0]=2 593 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1F N13535 [0,2,0,0,0,0|0,0,0]=2 594 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1F N13536 [0,2,0,0,0,0|0,0,0]=2 595 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1F N13537 [0,2,0,0,0,0|0,0,0]=2 596 B12R1.24 CCC(=O)C1=C(C)C(C)=CC=C1 N14095 [0,2,0,0,0,0|1,0,1]=4 597 B12R1.24 CCC(=O)C1=C(Cl)C(C)=CC=C1 N14078 [0,2,0,0,0,0|1,0,1]=4 598 B12R1.24 CCC(=O)C1=C(F)C(C)=CC=C1 N14020 [0,2,0,0,0,0|1,0,1]=4 599 B12R1.24 CC[C@H](N)C1=C(C)C(C)=CC=C1 N11288 [0,2,0,0,0,0|1,0,0]=3 600 B12R1.24 CC[C@H](N)C1=CC=CC(F)=C1F N11377 [0,2,0,0,0,0|2,0,0]=4 601 B12R1.24 CC[C@H](O)C1=C(C)C(C)=CC=C1 N14424 [0,2,0,0,0,0|1,0,0]=3 602 B12R1.24 CC[C@H](O)C1=CC=CC(Cl)=C1Cl N14420 [0,2,0,0,0,0|2,0,0]=4 603 B12R1.24 CC[C@H](O)C1=CC=CC(F)=C1F N14417 [0,2,0,0,0,0|2,0,0]=4 604 B12R1.24 NC[C@H](N)C1=CC=CC(Br)=C1F N13532 [0,2,0,0,0,0|1,0,0]=3 605 B12R1.24 NC[C@H](N)C1=CC=CC(Br)=C1F N13533 [0,2,0,0,0,0|1,0,0]=3 606 B12R1.24 NC[C@H](N)C1=CC=CC(Br)=C1F N13534 [0,2,0,0,0,0|1,0,0]=3 607 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1Cl N13571 [0,2,0,0,0,0|1,0,0]=3 608 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1Cl N13572 [0,2,0,0,0,0|1,0,0]=3 609 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1Cl N13573 [0,2,0,0,0,0|1,0,0]=3 610 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1F N13525 [0,2,0,0,0,0|1,0,0]=3 611 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1F N13528 [0,2,0,0,0,0|1,0,0]=3 612 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1F N13529 [0,2,0,0,0,0|1,0,0]=3 613 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1F N13530 [0,2,0,0,0,0|1,0,0]=3 614 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1F N13531 [0,2,0,0,0,0|1,0,0]=3 615 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1Cl N13568 [0,2,0,0,0,0|1,0,0]=3 616 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1Cl N13569 [0,2,0,0,0,0|1,0,0]=3 617 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1Cl N13570 [0,2,0,0,0,0|1,0,0]=3 618 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1F N13522 [0,2,0,0,0,0|1,0,0]=3 619 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1F N13523 [0,2,0,0,0,0|1,0,0]=3 620 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1F N13524 [0,2,0,0,0,0|1,0,0]=3 621 B12R1.24 N[C@@H](CO)C1=CC=CC(Cl)=C1Cl N12765 [0,2,0,0,0,0|2,0,0]=4 622 B12R1.24 N[C@@H](CO)C1=CC=CC(Cl)=C1F N13062 [0,2,0,0,0,0|2,0,0]=4 623 B12R1.25 CCCOC1=C(C)C(N)=CC=C1 F17950 [0,2,0,0,0,0|2,0,0]=4 624 B12R1.224 CC1=CC=CC(OC(F)F)=C1N AT12956 [0,2,0,0,0,0|2,0,0]=4 625 B12R1.224 C[C@H](N)CC1=CC=CC(Cl)=C1Cl N11069 [0,2,0,0,0,0|1,0,0]=3 626 B12R1.224 NC(=O)CC1=CC=CC(Br)=C1F 92646 [0,2,0,0,0,0|1,0,1]=4 627 B12R1.280 COC1=C(O)C(CC#N)=CC=C1 S10158 [0,2,0,0,0,0|0,0,2]=4 628 B12R1.280 COC1=C(O)C(CCN)=CC=C1 F30665 [0,2,0,0,0,0|0,0,0]=2 629 B12R1.497 NC1=C(CCO)C(F)=C(F)C=C1 12119 [0,2,0,0,0,0|2,0,0]=4 630 B12R1.497 OCCC1=C(Cl)C=CC(F)=C1Cl W12045 [0,2,0,0,0,0|2,0,0]=4 631 B12R1.542 CCN1C(=O)C=CC=C1CCN F13866 [0,2,0,0,0,0|2,0,0]=4 632 B12R1.10 C[C@](N)(CO)C1=CC=CC(Cl)=C1 96139 [0,2,0,0,0,0|2,0,0]=4 633 B12R1.10 C[C@](N)(CO)C1=CC=CC(F)=C1 96101 [0,2,0,0,0,0|2,0,0]=4 634 B12R1.10 C[C@](N)(CO)C1=CC=CC(F)=C1 96103 [0,2,0,0,0,0|2,0,0]=4 635 B12R1.13 CN[C@@H](CO)C1=CC=CC(F)=C1 N12971 [0,2,0,0,0,0|2,0,0]=4 636 B12R1.13 OCC(CO)C1=CC=CC(Br)=C1 F30495 [0,2,0,0,0,0|2,0,0]=4 637 B12R1.17 C=CC[C@H](N)C1=CC=CC(Br)=C1 74253 [0,2,0,0,0,0|2,0,0]=4 638 B12R1.17 CCCC(=O)C1=CC(C)=CC=C1 N13969 [0,2,0,0,0,0|1,0,0]=3 639 B12R1.17 CCCC(=O)C1=CC=CC(Cl)=C1 N13955 [0,2,0,0,0,0|2,0,0]=4 640 B12R1.17 CCCC(=O)C1=CC=CC(F)=C1 N13952 [0,2,0,0,0,0|2,0,0]=4 641 B12R1.17 CN(CCBr)C1=CC(F)=CC=C1 72470 [0,2,0,0,0,0|2,0,0]=4 642 B12R1.17 COC[C@H](N)C1=CC=CC(Cl)=C1 N13031 [0,2,0,0,0,0|2,0,0]=4 643 B12R1.17 COC[C@H](N)C1=CC=CC(F)=C1 D81287 [0,2,0,0,0,0|2,0,0]=4 644 B12R1.17 N#CC[C@H](O)C1=CC=CC(O)=C1 D85736 [0,2,0,0,0,0|1,0,1]=4 645 B12R1.17 N[C@@H](CCO)C1=CC=CC(Cl)=C1 57810 [0,2,0,0,0,0|2,0,0]=4 646 B12R1.17 N[C@@H](CCO)C1=CC=CC(O)=C1 62481 [0,2,0,0,0,0|2,0,0]=4 647 B12R1.225 CC(O)C(N)C1=CC(N)=CC=C1 N16147 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.225 CC(O)C(N)C1=CC=CC(Br)=C1 N15614 [0,2,0,0,0,0|2,0,0]=4 649 B12R1.225 CC(O)C(N)C1=CC=CC(Cl)=C1 N15637 [0,2,0,0,0,0|2,0,0]=4 650 B12R1.225 CC(O)C(N)C1=CC=CC(F)=C1 N15640 [0,2,0,0,0,0|2,0,0]=4 651 B12R1.225 CC(O)C(N)C1=CC=CC(O)=C1 N15625 [0,2,0,0,0,0|2,0,0]=4 652 B12R1.225 CC(O)[C@H](N)C1=CC(N)=CC=C1 N16148 [0,2,0,0,0,0|2,0,0]=4 653 B12R1.225 CC(O)[C@H](N)C1=CC=CC(Br)=C1 N15615 [0,2,0,0,0,0|2,0,0]=4 654 B12R1.225 CC(O)[C@H](N)C1=CC=CC(Cl)=C1 N15636 [0,2,0,0,0,0|2,0,0]=4 655 B12R1.225 CC(O)[C@H](N)C1=CC=CC(F)=C1 N15641 [0,2,0,0,0,0|2,0,0]=4 656 B12R1.225 CC(O)[C@H](N)C1=CC=CC(O)=C1 N15624 [0,2,0,0,0,0|2,0,0]=4 657 B12R1.225 CC1=CC=CC([C@@H](F)C(=O)O)=C1 98550 [0,2,0,0,0,0|1,0,1]=4 658 B12R1.225 CC1=CC=CC([C@@H](N)C(=O)O)=C1 N12267 [0,2,0,0,0,0|1,0,1]=4 659 B12R1.225 CC1=CC=CC([C@@H](N)C(C)C)=C1 N13039 [0,2,0,0,0,0|1,0,0]=3 660 B12R1.225 C[C@@H](O)[C@H](N)C1=CC(N)=CC=C1 N16149 [0,2,0,0,0,0|2,0,0]=4 661 B12R1.225 C[C@@H](O)[C@H](N)C1=CC(N)=CC=C1 N16151 [0,2,0,0,0,0|2,0,0]=4 662 B12R1.225 C[C@@H](O)[C@H](N)C1=CC=CC(Br)=C1 N15617 [0,2,0,0,0,0|2,0,0]=4 663 B12R1.225 C[C@@H](O)[C@H](N)C1=CC=CC(Br)=C1 N15619 [0,2,0,0,0,0|2,0,0]=4 664 B12R1.225 C[C@@H](O)[C@H](N)C1=CC=CC(Cl)=C1 N15632 [0,2,0,0,0,0|2,0,0]=4 665 B12R1.225 C[C@@H](O)[C@H](N)C1=CC=CC(Cl)=C1 N15634 [0,2,0,0,0,0|2,0,0]=4 666 B12R1.225 C[C@@H](O)[C@H](N)C1=CC=CC(F)=C1 N15642 [0,2,0,0,0,0|2,0,0]=4 667 B12R1.225 C[C@@H](O)[C@H](N)C1=CC=CC(F)=C1 N15644 [0,2,0,0,0,0|2,0,0]=4 668 B12R1.225 C[C@@H](O)[C@H](N)C1=CC=CC(O)=C1 N15620 [0,2,0,0,0,0|2,0,0]=4 669 B12R1.225 C[C@@H](O)[C@H](N)C1=CC=CC(O)=C1 N15622 [0,2,0,0,0,0|2,0,0]=4 670 B12R1.225 C[C@H](N)C(=O)C1=CC(O)=CC=C1 A11727 [0,2,0,0,0,0|1,0,1]=4 671 B12R1.225 C[C@H](N)C(=O)C1=CC=CC(Cl)=C1 AC1513 [0,2,0,0,0,0|1,0,1]=4 672 B12R1.225 C[C@H](N)[C@H](O)C1=CC=CC(O)=C1 F18205 [0,2,0,0,0,0|1,0,0]=3 673 B12R1.225 C[C@H](O)[C@H](N)C1=CC(N)=CC=C1 N16150 [0,2,0,0,0,0|2,0,0]=4 674 B12R1.225 C[C@H](O)[C@H](N)C1=CC=CC(Cl)=C1 N15635 [0,2,0,0,0,0|2,0,0]=4 675 B12R1.225 C[C@H](O)[C@H](N)C1=CC=CC(F)=C1 N15643 [0,2,0,0,0,0|2,0,0]=4 676 B12R1.225 C[C@H](O)[C@H](N)C1=CC=CC(O)=C1 N15621 [0,2,0,0,0,0|2,0,0]=4 677 B12R1.225 N[C@H](C1=CC=CC(Br)=C1)C(F)F 94367 [0,2,0,0,0,0|2,0,0]=4 678 B12R1.225 N[C@H](C1=CC=CC(Cl)=C1)C(F)F 94368 [0,2,0,0,0,0|2,0,0]=4 679 B12R1.225 N[C@H](C1=CC=CC(F)=C1)C(F)F 94369 [0,2,0,0,0,0|2,0,0]=4 680 B12R1.354 CC1=CC(C(=O)NN)=C(C)C=C1 W15991 [0,2,0,0,0,0|1,0,1]=4 681 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13759 [0,2,0,0,0,0|0,0,0]=2 682 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13760 [0,2,0,0,0,0|0,0,0]=2 683 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13761 [0,2,0,0,0,0|0,0,0]=2 684 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13765 [0,2,0,0,0,0|0,0,0]=2 685 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13766 [0,2,0,0,0,0|0,0,0]=2 686 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13767 [0,2,0,0,0,0|0,0,0]=2 687 B12R1.354 CC1=CC([C@@H](N)CN)=C(Cl)C=C1 N13640 [0,2,0,0,0,0|0,0,0]=2 688 B12R1.354 CC1=CC([C@@H](N)CN)=C(Cl)C=C1 N13641 [0,2,0,0,0,0|0,0,0]=2 689 B12R1.354 CC1=CC([C@@H](N)CN)=C(Cl)C=C1 N13642 [0,2,0,0,0,0|0,0,0]=2 690 B12R1.354 CC1=CC([C@@H](N)CN)=C(F)C=C1 N13595 [0,2,0,0,0,0|0,0,0]=2 691 B12R1.354 CC1=CC([C@@H](N)CN)=C(F)C=C1 N13596 [0,2,0,0,0,0|0,0,0]=2 692 B12R1.354 CC1=CC([C@@H](N)CN)=C(F)C=C1 N13597 [0,2,0,0,0,0|0,0,0]=2 693 B12R1.354 CCC(=O)C1=C(F)C=CC(C)=C1 N14035 [0,2,0,0,0,0|1,0,1]=4 694 B12R1.354 CC[C@H](N)C1=C(F)C=CC(F)=C1 N11165 [0,2,0,0,0,0|2,0,0]=4 695 B12R1.354 CC[C@H](N)C1=C(F)C=CC(F)=C1 N12908 [0,2,0,0,0,0|2,0,0]=4 696 B12R1.354 CC[C@H](N)C1=C(O)C=CC(C)=C1 N14793 [0,2,0,0,0,0|1,0,0]=3 697 B12R1.354 CC[C@H](O)C1=C(C)C=CC(C)=C1 N14426 [0,2,0,0,0,0|1,0,0]=3 698 B12R1.354 CC[C@H](O)C1=C(F)C=CC(F)=C1 N14418 [0,2,0,0,0,0|2,0,0]=4 699 B12R1.354 NCC(=O)C1=C(F)C=CC(F)=C1 O10640 [0,2,0,0,0,0|1,0,1]=4 700 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Br)=C1 N13699 [0,2,0,0,0,0|1,0,0]=3 701 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Br)=C1 N13700 [0,2,0,0,0,0|1,0,0]=3 702 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Br)=C1 N13701 [0,2,0,0,0,0|1,0,0]=3 703 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13696 [0,2,0,0,0,0|1,0,0]=3 704 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13697 [0,2,0,0,0,0|1,0,0]=3 705 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13698 [0,2,0,0,0,0|1,0,0]=3 706 B12R1.354 NC[C@H](N)C1=C(F)C=CC(Br)=C1 N13593 [0,2,0,0,0,0|1,0,0]=3 707 B12R1.354 NC[C@H](N)C1=C(F)C=CC(Br)=C1 N13594 [0,2,0,0,0,0|1,0,0]=3 708 B12R1.354 NC[C@H](N)C1=C(F)C=CC(Cl)=C1 N13590 [0,2,0,0,0,0|1,0,0]=3 709 B12R1.354 NC[C@H](N)C1=C(F)C=CC(Cl)=C1 N13591 [0,2,0,0,0,0|1,0,0]=3 710 B12R1.354 NC[C@H](N)C1=C(F)C=CC(Cl)=C1 N13592 [0,2,0,0,0,0|1,0,0]=3 711 B12R1.354 NC[C@H](N)C1=C(F)C=CC(F)=C1 N13584 [0,2,0,0,0,0|1,0,0]=3 712 B12R1.354 NC[C@H](N)C1=C(F)C=CC(F)=C1 N13587 [0,2,0,0,0,0|1,0,0]=3 713 B12R1.354 NC[C@H](N)C1=C(F)C=CC(F)=C1 N13588 [0,2,0,0,0,0|1,0,0]=3 714 B12R1.354 NC[C@H](N)C1=C(F)C=CC(F)=C1 N13589 [0,2,0,0,0,0|1,0,0]=3 715 B12R1.354 NC[C@H](O)C1=C(F)C=CC(F)=C1 C77859 [0,2,0,0,0,0|1,0,0]=3 716 B12R1.354 N[C@@H](CO)C1=C(F)C=CC(F)=C1 N12983 [0,2,0,0,0,0|2,0,0]=4 717 B12R1.358 C=C[C@H](N)C1=CC(C)=CC(Br)=C1 N15433 [0,2,0,0,0,0|1,0,1]=4 718 B12R1.358 C=C[C@H](N)C1=CC(C)=CC(Br)=C1 N15434 [0,2,0,0,0,0|1,0,1]=4 719 B12R1.358 C=C[C@H](N)C1=CC(C)=CC(Br)=C1 N15435 [0,2,0,0,0,0|1,0,1]=4 720 B12R1.358 C=C[C@H](N)C1=CC(C)=CC(F)=C1 N15398 [0,2,0,0,0,0|1,0,1]=4 721 B12R1.358 C=C[C@H](N)C1=CC(C)=CC(F)=C1 N15399 [0,2,0,0,0,0|1,0,1]=4 722 B12R1.358 C=C[C@H](N)C1=CC(C)=CC(F)=C1 N15400 [0,2,0,0,0,0|1,0,1]=4 723 B12R1.358 CC1=CC(Br)=CC([C@@H](N)CN)=C1 N13739 [0,2,0,0,0,0|0,0,0]=2 724 B12R1.358 CC1=CC(Br)=CC([C@@H](N)CN)=C1 N13740 [0,2,0,0,0,0|0,0,0]=2 725 B12R1.358 CC1=CC(Br)=CC([C@@H](N)CN)=C1 N13741 [0,2,0,0,0,0|0,0,0]=2 726 B12R1.358 CC1=CC(F)=CC([C@@H](N)CN)=C1 N13687 [0,2,0,0,0,0|0,0,0]=2 727 B12R1.358 CC1=CC(F)=CC([C@@H](N)CN)=C1 N13688 [0,2,0,0,0,0|0,0,0]=2 728 B12R1.358 CC1=CC(F)=CC([C@@H](N)CN)=C1 N13689 [0,2,0,0,0,0|0,0,0]=2 729 B12R1.358 CCC(=O)C1=CC(C)=CC(F)=C1 N14070 [0,2,0,0,0,0|1,0,1]=4 730 B12R1.358 CC[C@H](N)C1=CC(C)=CC(F)=C1 N11122 [0,2,0,0,0,0|1,0,0]=3 731 B12R1.358 CC[C@H](N)C1=CC(C)=CC(F)=C1 N11368 [0,2,0,0,0,0|1,0,0]=3 732 B12R1.358 CC[C@H](N)C1=CC(Cl)=CC(Cl)=C1 N11379 [0,2,0,0,0,0|2,0,0]=4 733 B12R1.358 CC[C@H](O)C1=CC(C)=CC(C)=C1 N14429 [0,2,0,0,0,0|1,0,0]=3 734 B12R1.358 CC[C@H](O)C1=CC(Cl)=CC(Cl)=C1 N12949 [0,2,0,0,0,0|2,0,0]=4 735 B12R1.358 CC[C@H](O)C1=CC(F)=CC(F)=C1 N12170 [0,2,0,0,0,0|2,0,0]=4 736 B12R1.358 NC[C@H](N)C1=CC(Br)=CC(Br)=C1 N13735 [0,2,0,0,0,0|1,0,0]=3 737 B12R1.358 NC[C@H](N)C1=CC(Br)=CC(Br)=C1 N13736 [0,2,0,0,0,0|1,0,0]=3 738 B12R1.358 NC[C@H](N)C1=CC(Br)=CC(Br)=C1 N13737 [0,2,0,0,0,0|1,0,0]=3 739 B12R1.358 NC[C@H](N)C1=CC(Br)=CC(Br)=C1 N13738 [0,2,0,0,0,0|1,0,0]=3 740 B12R1.358 NC[C@H](N)C1=CC(Br)=CC(Cl)=C1 N13705 [0,2,0,0,0,0|1,0,0]=3 741 B12R1.358 NC[C@H](N)C1=CC(Br)=CC(Cl)=C1 N13706 [0,2,0,0,0,0|1,0,0]=3 742 B12R1.358 NC[C@H](N)C1=CC(Br)=CC(Cl)=C1 N13707 [0,2,0,0,0,0|1,0,0]=3 743 B12R1.358 NC[C@H](N)C1=CC(Br)=CC(F)=C1 N13684 [0,2,0,0,0,0|1,0,0]=3 744 B12R1.358 NC[C@H](N)C1=CC(Br)=CC(F)=C1 N13685 [0,2,0,0,0,0|1,0,0]=3 745 B12R1.358 NC[C@H](N)C1=CC(Br)=CC(F)=C1 N13686 [0,2,0,0,0,0|1,0,0]=3 746 B12R1.358 NC[C@H](N)C1=CC(Cl)=CC(Cl)=C1 N13702 [0,2,0,0,0,0|1,0,0]=3 747 B12R1.358 NC[C@H](N)C1=CC(Cl)=CC(Cl)=C1 N13703 [0,2,0,0,0,0|1,0,0]=3 748 B12R1.358 NC[C@H](N)C1=CC(Cl)=CC(Cl)=C1 N13704 [0,2,0,0,0,0|1,0,0]=3 749 B12R1.358 NC[C@H](N)C1=CC(Cl)=CC(F)=C1 N13681 [0,2,0,0,0,0|1,0,0]=3 750 B12R1.358 NC[C@H](N)C1=CC(Cl)=CC(F)=C1 N13682 [0,2,0,0,0,0|1,0,0]=3 751 B12R1.358 NC[C@H](N)C1=CC(Cl)=CC(F)=C1 N13683 [0,2,0,0,0,0|1,0,0]=3 752 B12R1.358 NC[C@H](N)C1=CC(F)=CC(F)=C1 N13676 [0,2,0,0,0,0|1,0,0]=3 753 B12R1.358 NC[C@H](N)C1=CC(F)=CC(F)=C1 N13677 [0,2,0,0,0,0|1,0,0]=3 754 B12R1.358 NC[C@H](N)C1=CC(F)=CC(F)=C1 N13678 [0,2,0,0,0,0|1,0,0]=3 755 B12R1.358 NC[C@H](N)C1=CC(F)=CC(F)=C1 N13679 [0,2,0,0,0,0|1,0,0]=3 756 B12R1.358 NC[C@H](N)C1=CC(F)=CC(F)=C1 N13680 [0,2,0,0,0,0|1,0,0]=3 757 B12R1.358 NC[C@H](O)C1=CC(F)=CC(F)=C1 C77860 [0,2,0,0,0,0|1,0,0]=3 758 B12R1.367 C=C[C@H](N)C1=CC(C)=C(C)C=C1 N15442 [0,2,0,0,0,0|1,0,1]=4 759 B12R1.367 C=C[C@H](N)C1=CC(C)=C(C)C=C1 N15443 [0,2,0,0,0,0|1,0,1]=4 760 B12R1.367 C=C[C@H](N)C1=CC(C)=C(C)C=C1 N15444 [0,2,0,0,0,0|1,0,1]=4 761 B12R1.367 CC1=C(Br)C=C([C@@H](N)CN)C=C1 N13729 [0,2,0,0,0,0|1,0,0]=3 762 B12R1.367 CC1=C(Br)C=C([C@@H](N)CN)C=C1 N13730 [0,2,0,0,0,0|1,0,0]=3 763 B12R1.367 CC1=C(Br)C=C([C@@H](N)CN)C=C1 N13731 [0,2,0,0,0,0|1,0,0]=3 764 B12R1.367 CC1=C(C)C=C([C@@H](N)CO)C=C1 N11079 [0,2,0,0,0,0|1,0,0]=3 765 B12R1.367 CC1=C(C)C=C([C@@H](O)CN)C=C1 C78470 [0,2,0,0,0,0|0,0,0]=2 766 B12R1.367 CC1=C(Cl)C=C([C@@H](N)CN)C=C1 N13720 [0,2,0,0,0,0|1,0,0]=3 767 B12R1.367 CC1=C(Cl)C=C([C@@H](N)CN)C=C1 N13721 [0,2,0,0,0,0|1,0,0]=3 768 B12R1.367 CC1=C(Cl)C=C([C@@H](N)CN)C=C1 N13722 [0,2,0,0,0,0|1,0,0]=3 769 B12R1.367 CC1=C(F)C=C([C@@H](N)CN)C=C1 N13664 [0,2,0,0,0,0|1,0,0]=3 770 B12R1.367 CC1=C(F)C=C([C@@H](N)CN)C=C1 N13665 [0,2,0,0,0,0|1,0,0]=3 771 B12R1.367 CC1=C(F)C=C([C@@H](N)CN)C=C1 N13666 [0,2,0,0,0,0|1,0,0]=3 772 B12R1.367 CC1=C(F)C=CC(C(=O)CO)=C1 AC3993 [0,2,0,0,0,0|1,0,1]=4 773 B12R1.367 CC[C@H](N)C1=CC(C)=C(C)C=C1 N12085 [0,2,0,0,0,0|1,0,0]=3 774 B12R1.367 CC[C@H](N)C1=CC(C)=C(F)C=C1 N11147 [0,2,0,0,0,0|1,0,0]=3 775 B12R1.367 CC[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N10954 [0,2,0,0,0,0|2,0,0]=4 776 B12R1.367 CC[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N11080 [0,2,0,0,0,0|2,0,0]=4 777 B12R1.367 CC[C@H](N)C1=CC(F)=C(C)C=C1 N11196 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.367 CC[C@H](N)C1=CC(F)=C(C)C=C1 N12917 [0,2,0,0,0,0|2,0,0]=4 779 B12R1.367 CC[C@H](N)C1=CC(F)=C(F)C=C1 N11160 [0,2,0,0,0,0|2,0,0]=4 780 B12R1.367 CC[C@H](O)C1=CC(C)=C(C)C=C1 N14428 [0,2,0,0,0,0|1,0,0]=3 781 B12R1.367 CC[C@H](O)C1=CC(Cl)=C(Br)C=C1 97338 [0,2,0,0,0,0|2,0,0]=4 782 B12R1.367 CC[C@H](O)C1=CC(Cl)=C(Cl)C=C1 N14421 [0,2,0,0,0,0|2,0,0]=4 783 B12R1.367 CC[C@H](O)C1=CC(F)=C(F)C=C1 N14423 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.367 NCC(=O)C1=CC(F)=C(F)C=C1 D76781 [0,2,0,0,0,0|1,0,1]=4 785 B12R1.367 NCC(=O)C1=CC(O)=C(O)C=C1 A10825 [0,2,0,0,0,0|1,0,1]=4 786 B12R1.367 NC[C@H](N)C1=CC(Cl)=C(Br)C=C1 N13717 [0,2,0,0,0,0|1,0,0]=3 787 B12R1.367 NC[C@H](N)C1=CC(Cl)=C(Br)C=C1 N13719 [0,2,0,0,0,0|1,0,0]=3 788 B12R1.367 NC[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N13714 [0,2,0,0,0,0|1,0,0]=3 789 B12R1.367 NC[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N13715 [0,2,0,0,0,0|1,0,0]=3 790 B12R1.367 NC[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N13716 [0,2,0,0,0,0|1,0,0]=3 791 B12R1.367 NC[C@H](N)C1=CC(F)=C(Br)C=C1 N13661 [0,2,0,0,0,0|1,0,0]=3 792 B12R1.367 NC[C@H](N)C1=CC(F)=C(Br)C=C1 N13662 [0,2,0,0,0,0|1,0,0]=3 793 B12R1.367 NC[C@H](N)C1=CC(F)=C(Br)C=C1 N13663 [0,2,0,0,0,0|1,0,0]=3 794 B12R1.367 NC[C@H](N)C1=CC(F)=C(Cl)C=C1 N13656 [0,2,0,0,0,0|1,0,0]=3 795 B12R1.367 NC[C@H](N)C1=CC(F)=C(Cl)C=C1 N13657 [0,2,0,0,0,0|1,0,0]=3 796 B12R1.367 NC[C@H](N)C1=CC(F)=C(Cl)C=C1 N13658 [0,2,0,0,0,0|1,0,0]=3 797 B12R1.367 NC[C@H](N)C1=CC(F)=C(Cl)C=C1 N13659 [0,2,0,0,0,0|1,0,0]=3 798 B12R1.367 NC[C@H](N)C1=CC(F)=C(Cl)C=C1 N13660 [0,2,0,0,0,0|1,0,0]=3 799 B12R1.367 NC[C@H](N)C1=CC(F)=C(F)C=C1 N13652 [0,2,0,0,0,0|1,0,0]=3 800 B12R1.367 NC[C@H](N)C1=CC(F)=C(F)C=C1 N13653 [0,2,0,0,0,0|1,0,0]=3 801 B12R1.367 NC[C@H](N)C1=CC(F)=C(F)C=C1 N13654 [0,2,0,0,0,0|1,0,0]=3 802 B12R1.367 NC[C@H](N)C1=CC(F)=C(F)C=C1 N13655 [0,2,0,0,0,0|1,0,0]=3 803 B12R1.367 NC[C@H](O)C1=CC(Cl)=C(Cl)C=C1 F50725 [0,2,0,0,0,0|1,0,0]=3 804 B12R1.367 NC[C@H](O)C1=CC(O)=C(O)C=C1 D97793 [0,2,0,0,0,0|1,0,0]=3 805 B12R1.367 N[C@@H](CO)C1=CC(Cl)=C(F)C=C1 96795 [0,2,0,0,0,0|2,0,0]=4 806 B12R1.367 N[C@@H](CO)C1=CC(Cl)=C(F)C=C1 N15879 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.367 N[C@@H](CO)C1=CC(F)=C(Br)C=C1 N13090 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.367 N[C@@H](CO)C1=CC(F)=C(F)C=C1 N11097 [0,2,0,0,0,0|2,0,0]=4 809 B12R1.367 N[C@@H](CO)C1=CC(F)=C(F)C=C1 N11182 [0,2,0,0,0,0|2,0,0]=4 810 B12R1.367 OC[C@H](O)C1=CC(F)=C(Cl)C=C1 89818 [0,2,0,0,0,0|2,0,0]=4 811 B12R1.435 C=C[C@H](N)C1=CC(CC)=CC=C1 N15271 [0,2,0,0,0,0|1,0,1]=4 812 B12R1.435 C=C[C@H](N)C1=CC(CC)=CC=C1 N15272 [0,2,0,0,0,0|1,0,1]=4 813 B12R1.435 C=C[C@H](N)C1=CC(CC)=CC=C1 N15273 [0,2,0,0,0,0|1,0,1]=4 814 B12R1.435 C=C[C@H](N)C1=CC=CC(OC)=C1 N15286 [0,2,0,0,0,0|1,0,1]=4 815 B12R1.435 C=C[C@H](N)C1=CC=CC(OC)=C1 N15287 [0,2,0,0,0,0|1,0,1]=4 816 B12R1.435 C=C[C@H](N)C1=CC=CC(OC)=C1 N15288 [0,2,0,0,0,0|1,0,1]=4 817 B12R1.435 CC[C@H](N)C1=CC=CC(OC)=C1 N11148 [0,2,0,0,0,0|1,0,0]=3 818 B12R1.435 CC[C@H](N)C1=CC=CC(OC)=N1 Y12866 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.435 CC[C@H](O)C1=CC=CC(OC)=C1 N12603 [0,2,0,0,0,0|1,0,0]=3 820 B12R1.435 COC1=CC([C@@H](C)CN)=CC=C1 W13097 [0,2,0,0,0,0|0,0,0]=2 821 B12R1.435 COC1=CC([C@@H](C)CN)=CC=C1 W19078 [0,2,0,0,0,0|0,0,0]=2 822 B12R1.435 COC1=CC([C@@H](N)CN)=CC=C1 N13477 [0,2,0,0,0,0|0,0,0]=2 823 B12R1.435 COC1=CC([C@@H](N)CN)=CC=C1 N13478 [0,2,0,0,0,0|0,0,0]=2 824 B12R1.435 COC1=CC([C@@H](N)CN)=CC=C1 N13479 [0,2,0,0,0,0|0,0,0]=2 825 B12R1.435 COC1=CC([C@@H](N)CN)=CC=C1 N13485 [0,2,0,0,0,0|0,0,0]=2 826 B12R1.435 COC1=CC([C@@H](N)CN)=CC=C1 N13486 [0,2,0,0,0,0|0,0,0]=2 827 B12R1.435 COC1=CC([C@@H](N)CN)=CC=C1 N13487 [0,2,0,0,0,0|0,0,0]=2 828 B12R1.435 COC1=CC([C@@H](O)CN)=CC=C1 C78115 [0,2,0,0,0,0|0,0,0]=2 829 B12R1.435 COC1=CC=CC(C(=O)CN)=C1 C78086 [0,2,0,0,0,0|0,0,1]=3 830 B12R1.435 COC1=CC=CC(C(=O)CO)=C1 AC7045 [0,2,0,0,0,0|1,0,1]=4 831 B12R1.435 COC1=NC([C@@H](N)CO)=CC=C1 Y12867 [0,2,0,0,0,0|2,0,0]=4 832 B12R1.435 COC1=NC=CC([C@@H](N)CO)=C1 F16967 [0,2,0,0,0,0|2,0,0]=4 833 B12R1.435 COC1=NC=CC([C@@H](N)CO)=C1 Y11227 [0,2,0,0,0,0|2,0,0]=4 834 B12R1.435 CSC1=CC([C@@H](N)CO)=CC=C1 N10545 [0,2,0,0,0,0|1,0,0]=3 835 B12R1.435 N#CC1=CC=CC([C@@H](N)CO)=C1 F16969 [0,2,0,0,0,0|1,0,1]=4 836 B12R1.435 N[C@@H](CO)C1=CC=CC(CO)=N1 N14928 [0,2,0,0,0,0|2,0,0]=4 837 B12R1.435 N[C@@H](CO)C1=NC=CC(CO)=C1 N14919 [0,2,0,0,0,0|2,0,0]=4 838 B12R1.28 BrCCCCC1=CC=CC(Br)=C1 AT22149 [0,2,0,0,0,0|2,0,0]=4 839 B12R1.28 BrCCCOC1=CC=CC(Br)=C1 97812 [0,2,0,0,0,0|2,0,0]=4 840 B12R1.28 CC1=CC=CC(OCCCO)=N1 N10106 [0,2,0,0,0,0|2,0,0]=4 841 B12R1.28 CCCNCC1=CC(C)=CC=C1 C77940 [0,2,0,0,0,0|1,0,0]=3 842 B12R1.28 CCCNCC1=CC=CC(Br)=C1 C78566 [0,2,0,0,0,0|2,0,0]=4 843 B12R1.28 CCCNCC1=CC=CC(Cl)=C1 C78191 [0,2,0,0,0,0|2,0,0]=4 844 B12R1.28 CCCNCC1=CC=CC(F)=C1 C78563 [0,2,0,0,0,0|2,0,0]=4 845 B12R1.28 ClC1=CC=CC(OCCCBr)=C1 97802 [0,2,0,0,0,0|2,0,0]=4 846 B12R1.28 N#CCCOC1=CC=CC(Br)=C1 F13495 [0,2,0,0,0,0|1,0,1]=4 847 B12R1.28 NC1=CC=CC(OCCCO)=C1 C77805 [0,2,0,0,0,0|2,0,0]=4 848 B12R1.28 OCCCCC1=CC=CC(Br)=C1 AT22147 [0,2,0,0,0,0|2,0,0]=4 849 B12R1.50 CC1=CC=CC(C[C@H](N)CO)=C1 C78461 [0,2,0,0,0,0|0,0,0]=2 850 B12R1.50 CCC(=O)CC1=CC=CC(Br)=C1 N14158 [0,2,0,0,0,0|2,0,0]=4 851 B12R1.50 CCC(=O)CC1=CC=CC(F)=C1 N14137 [0,2,0,0,0,0|2,0,0]=4 852 B12R1.50 CC[C@H](N)CC1=CC(C)=CC=C1 N14536 [0,2,0,0,0,0|0,0,0]=2 853 B12R1.50 CC[C@H](N)CC1=CC=CC(Br)=C1 N14532 [0,2,0,0,0,0|1,0,0]=3 854 B12R1.50 CC[C@H](N)CC1=CC=CC(Cl)=C1 N14527 [0,2,0,0,0,0|1,0,0]=3 855 B12R1.50 CC[C@H](N)CC1=CC=CC(F)=C1 N14524 [0,2,0,0,0,0|1,0,0]=3 856 B12R1.50 CNC(=O)CC1=CC(N)=CC=C1 N10567 [0,2,0,0,0,0|1,0,1]=4 857 B12R1.50 CN[C@@H](C)CC1=CC=CC(F)=C1 N12793 [0,2,0,0,0,0|1,0,0]=3 858 B12R1.50 N[C@H](CO)CC1=CC=CC(Br)=C1 C78100 [0,2,0,0,0,0|1,0,0]=3 859 B12R1.50 N[C@H](CO)CC1=CC=CC(Br)=C1 C78242 [0,2,0,0,0,0|1,0,0]=3 860 B12R1.50 N[C@H](CO)CC1=CC=CC(Cl)=C1 Y11238 [0,2,0,0,0,0|1,0,0]=3 861 B12R1.50 N[C@H](CO)CC1=CC=CC(F)=C1 N11307 [0,2,0,0,0,0|1,0,0]=3 862 B12R1.100 CC1=CC(C)=CC(CCCN)=C1 C77897 [0,2,0,0,0,0|0,0,0]=2 863 B12R1.100 FC1=CC(F)=CC(CCCBr)=C1 C78521 [0,2,0,0,0,0|2,0,0]=4 864 B12R1.100 NCCCC1=CC(F)=CC(F)=C1 C77734 [0,2,0,0,0,0|1,0,0]=3 865 B12R1.100 OCCCC1=CC(F)=CC(F)=C1 C77733 [0,2,0,0,0,0|2,0,0]=4 866 B12R1.100 OCCOC1=CC(Br)=CC(F)=C1 N11578 [0,2,0,0,0,0|2,0,0]=4 867 B12R1.226 CC(C)NCC1=CC=CC(Br)=C1 C77759 [0,2,0,0,0,0|2,0,0]=4 868 B12R1.226 CC(C)NCC1=CC=CC(Cl)=C1 C78565 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.226 CC(C)NCC1=CC=CC(F)=C1 C78564 [0,2,0,0,0,0|2,0,0]=4 870 B12R1.226 CC(C)OCC1=CC(N)=CC=C1 F20261 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.226 CC1=CC=CC(CNC(C)C)=C1 C78583 [0,2,0,0,0,0|1,0,0]=3 872 B12R1.226 CC1=CC=CC(OC[C@H](C)N)=C1 F50497 [0,2,0,0,0,0|0,0,0]=2 873 B12R1.226 CC1=CC=CC(SCC(=O)O)=C1 AT20929 [0,2,0,0,0,0|1,0,1]=4 874 B12R1.226 NC(=O)CCC1=CC=CC(Br)=C1 F20007 [0,2,0,0,0,0|1,0,0]=3 875 B12R1.226 NC(=O)CCC1=CC=CC(Cl)=C1 D87293 [0,2,0,0,0,0|1,0,0]=3 876 B12R1.374 CCOCC1=C(Br)C=CC(F)=C1 N10175 [0,2,0,0,0,0|2,0,0]=4 877 B12R1.374 CCOCC1=C(F)C=CC(Br)=C1 N10200 [0,2,0,0,0,0|2,0,0]=4 878 B12R1.374 ClC1=CC(OCCBr)=C(Br)C=C1 AT20088 [0,2,0,0,0,0|2,0,0]=4 879 B12R1.374 FC1=CC(CCCBr)=C(F)C=C1 C77741 [0,2,0,0,0,0|2,0,0]=4 880 B12R1.374 NCCCN1C=C(Br)C=CC1=O AT19270 [0,2,0,0,0,0|2,0,0]=4 881 B12R1.374 OCCCC1=C(F)C=CC(F)=C1 C78523 [0,2,0,0,0,0|2,0,0]=4 882 B12R1.382 C#CCCC1=CC=CC(C#N)=C1 D85889 [0,2,0,0,0,0|1,0,1]=4 883 B12R1.382 CCNCC1=CC=CC(OC)=C1 F16322 [0,2,0,0,0,0|1,0,0]=3 884 B12R1.382 COC1=CC(C#CCO)=CC=C1 A50685 [0,2,0,0,0,0|1,0,1]=4 885 B12R1.382 COC1=CC=CC(CCC=O)=C1 AC6075 [0,2,0,0,0,0|1,0,0]=3 886 B12R1.385 CC1=C(C)C=C(CCCN)C=C1 C77896 [0,2,0,0,0,0|0,0,0]=2 887 B12R1.385 CCCCC1=CC(N)=C(N)C=C1 F18184 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.385 CNCCC1=CC(Cl)=C(Cl)C=C1 C78278 [0,2,0,0,0,0|1,0,0]=3 889 B12R1.385 FC1=C(F)C=C(CCCBr)C=C1 C77742 [0,2,0,0,0,0|2,0,0]=4 890 B12R1.385 NCCCC1=CC(Cl)=C(Cl)C=C1 C78454 [0,2,0,0,0,0|1,0,0]=3 891 B12R1.385 NCCCC1=CC(F)=C(F)C=C1 C78171 [0,2,0,0,0,0|1,0,0]=3 892 B12R1.385 OCCCC1=CC(F)=C(F)C=C1 C78127 [0,2,0,0,0,0|2,0,0]=4 893 B12R1.44 CCCC1=CC(F)=C(O)C(F)=C1 36960 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.101 CC1=CC(Br)=CC(CN(C)C)=C1 N11538 [0,2,0,0,0,0|2,0,0]=4 895 B12R1.19 CC1=C(Cl)C=CC(CC(=O)O)=C1 D96291 [0,2,0,0,0,0|1,0,1]=4 896 B12R1.19 CC1=C(N)C=CC(OC(F)F)=C1 W16609 [0,2,0,0,0,0|2,0,0]=4 897 B12R1.19 C[C@H](N)CC1=CC(Cl)=C(Cl)C=C1 N10880 [0,2,0,0,0,0|1,0,0]=3 898 B12R1.19 C[C@H](N)CC1=CC(F)=C(F)C=C1 N11068 [0,2,0,0,0,0|1,0,0]=3 899 B12R1.19 C[C@H](N)CC1=CC(F)=C(F)C=C1 N14355 [0,2,0,0,0,0|1,0,0]=3 900 B12R1.19 N=C(N)CC1=CC(F)=C(F)C=C1 S11009 [0,2,0,0,0,0|1,0,1]=4 901 B12R1.119 CC(C)(O)CC1=CC=CC(Br)=C1 AT24484 [0,2,0,0,0,0|2,0,0]=4 902 B12R1.119 CC1=CC=CC(CS(=O)(=O)[O-])=C1 72525 [0,2,0,0,0,0|2,0,0]=4 903 B12R1.127 CC1=CC(CC(=O)O)=C(Cl)C=C1 D96279 [0,2,0,0,0,0|1,0,1]=4 904 B12R1.127 CC1=CC(OC(F)F)=C(N)C=C1 98228 [0,2,0,0,0,0|2,0,0]=4 905 B12R1.127 C[C@H](N)CC1=C(F)C=CC(F)=C1 N11067 [0,2,0,0,0,0|1,0,0]=3 906 B12R1.127 NC(=O)CC1=C(Br)C=CC(Cl)=C1 AT11065 [0,2,0,0,0,0|1,0,1]=4 907 B12R1.127 NC(=O)CC1=C(F)C=CC(Br)=C1 92705 [0,2,0,0,0,0|1,0,1]=4 908 B12R1.438 COC1=CC(CC(=N)N)=CC=C1 F13308 [0,2,0,0,0,0|0,0,1]=3 909 B12R1.438 COC1=CC(C[C@H](C)N)=CC=C1 N10869 [0,2,0,0,0,0|0,0,0]=2 910 B12R1.270 CCCC1=C(Br)C=CC(C=O)=C1 97132 [0,2,0,0,0,0|1,0,1]=4 911 B12R1.1123 FC1=CC(F)=C(CCBr)C=C1F 39118 [0,2,0,0,0,0|2,0,0]=4 912 B12R1.1123 NCCC1=CC(O)=C(O)C=C1O D87854 [0,2,0,0,0,0|1,0,0]=3 913 B12R1.278 OCCC1=CC=CC(CCO)=C1 28242 [0,2,0,0,0,0|1,0,0]=3 914 B12R1.279 CCOC1=CC([C@H](C)N)=CC=C1 N12264 [0,2,0,0,0,0|2,0,0]=4 915 B12R1.279 CN(C)C1=CC=CC(CC#N)=C1 F13003 [0,2,0,0,0,0|0,0,2]=4 916 B12R1.279 NCCC1=CC=CC(C(=O)O)=C1 D87884 [0,2,0,0,0,0|0,0,1]=3 917 B12R1.279 NNCC1=CC=CC([N+](=O)[O-])=C1 E70140 [0,2,0,0,0,0|2,0,0]=4 918 B12R1.286 CCCC1=CC(OC)=C(O)C=C1 C15472 [0,2,0,0,0,0|1,0,0]=3 919 B12R1.286 CCOC1=CC(OC)=C(N)C=C1 N14332 [0,2,0,0,0,0|2,0,0]=4 920 B12R1.286 COC1=C(Br)C=CC(CCN)=C1 63216 [0,2,0,0,0,0|0,0,0]=2 921 B12R1.288 COC1=C(F)C=C(CCN)C=C1 D87759 [0,2,0,0,0,0|1,0,0]=3 922 B10R1.25 CC1=CC(F)=C(CN)C=C1 A12837 [0,0,1,1,0,0|1,0,1]=4 923 B10R2.6 C1=CC(C2CC2)=CC=N1 59829 [1,0,0,1,0,0|2,0,0]=4 924 B10R2.7 C1=CC2=C(C=C1)SCO2 76474 [1,0,0,1,0,0|2,0,0]=4 925 B10R2.7 C1=CC2=C(C=C1)SCS2 D71935 [1,0,0,1,0,0|2,0,0]=4 926 B10R2.7 C1=CN=C2NCCC2=C1 C13729 [1,0,0,1,0,0|1,0,0]=3 927 B10R2.7 C1=CN=C2NCCC2=N1 P20982 [1,0,0,1,0,0|2,0,0]=4 928 B10R2.7 C1=NC=C2CCNC2=N1 93647 [1,0,0,1,0,0|2,0,0]=4 929 B10R2.7 C1=NC=C2CCNC2=N1 C90715 [1,0,0,1,0,0|2,0,0]=4 930 B10R2.320 N[C@H]1CC2=C1C=CC=C2 AT20398 [1,0,0,1,0,0|0,0,0]=2 931 B12R2.81 CC1=C(N)C(C2CC2)=NC=C1 60025 [0,1,0,1,0,0|2,0,0]=4 932 B12R2.81 FC1=C(Cl)C=CC=C1C2CC2 AC9620 [0,1,0,1,0,0|2,0,0]=4 933 B12R2.82 NC1=C(Br)C=CC2=C1CCC2 AT13423 [0,1,0,1,0,0|2,0,0]=4 934 B12R2.82 NC1=C(Br)C=CC2=C1CCC2 E72233 [0,1,0,1,0,0|2,0,0]=4 935 B12R2.202 CC1=CC=CC2=C1N=C(N)O2 AC7423 [0,1,0,1,0,0|1,0,1]=4 936 B12R2.202 CC1=CC=CC2=C1N=C(N)S2 F13741 [0,1,0,1,0,0|1,0,1]=4 937 B12R2.202 CC1=CC=CC2=C1NC(=O)O2 AC6817 [0,1,0,1,0,0|1,0,1]=4 938 B12R2.202 O=C1CC2=CC=CC(I)=C2N1 D76870 [0,1,0,1,0,0|1,0,1]=4 939 B12R2.1081 BrC1=C2OCCNC2=CC=C1 D96169 [0,1,0,1,0,0|2,0,0]=4 940 B12R2.1081 BrC1=C2SCCNC2=CC=C1 69222 [0,1,0,1,0,0|2,0,0]=4 941 B12R2.1081 CC1=C2CNCCC2=NC=N1 C16784 [0,1,0,1,0,0|2,0,0]=4 942 B12R2.1081 CC1=C2CNCCC2=NC=N1 SC2281 [0,1,0,1,0,0|2,0,0]=4 943 B12R2.1081 CC1=CC=CC2=C1CCOC2 N14603 [0,1,0,1,0,0|1,0,0]=3 944 B12R2.1081 CC1=CC=CC2=C1NCCO2 AC7135 [0,1,0,1,0,0|0,0,0]=2 945 B12R2.1081 CC1=CC=CC2=C1OCCO2 AC8962 [0,1,0,1,0,0|1,0,0]=3 946 B12R2.1081 ClC1=C2CCCNC2=CC=C1 N14207 [0,1,0,1,0,0|2,0,0]=4 947 B12R2.1081 ClC1=C2CCNCC2=CC=C1 24212 [0,1,0,1,0,0|2,0,0]=4 948 B12R2.1081 ClC1=C2CCOCC2=CC=C1 N14602 [0,1,0,1,0,0|2,0,0]=4 949 B12R2.1081 ClC1=C2NCCSC2=CC=C1 72679 [0,1,0,1,0,0|1,0,0]=3 950 B12R2.1081 ClC1=C2SCCNC2=CC=C1 72678 [0,1,0,1,0,0|2,0,0]=4 951 B12R2.1081 FC1=C2CCOCC2=CC=C1 N14601 [0,1,0,1,0,0|2,0,0]=4 952 B12R2.1081 FC1=C2NCCOC2=CC=C1 90425 [0,1,0,1,0,0|1,0,0]=3 953 B12R2.1081 NC1=C2CNCCC2=CC=C1 C10171 [0,1,0,1,0,0|1,0,0]=3 954 B12R2.1081 NC1=CC=CC2=C1NCCO2 80851 [0,1,0,1,0,0|1,0,0]=3 955 B12R2.1081 OC1=C2CCNCC2=CC=C1 20736 [0,1,0,1,0,0|2,0,0]=4 956 B12R2.1081 OC1=C2CNCCC2=CC=C1 AT24057 [0,1,0,1,0,0|1,0,0]=3 957 B12R2.1081 OC1=C2CNCCC2=CC=C1 C15586 [0,1,0,1,0,0|1,0,0]=3 958 B12R2.1081 OC1=C2OCCCC2=CC=C1 76490 [0,1,0,1,0,0|2,0,0]=4 959 B12R2.1081 OC1=NC=CC2=C1CNCC2 F53632 [0,1,0,1,0,0|2,0,0]=4 960 B12R2.80 NC1CC1C2=CC=CC(Cl)=C2 D86978 [0,1,0,1,0,0|1,0,0]=3 961 B12R2.80 N[C@H]1C[C@@H]1C2=CC=CC(Cl)=C2 AC1027 [0,1,0,1,0,0|1,0,0]=3 962 B12R2.80 N[C@H]1C[C@@H]1C2=CC=CC(F)=C2 E72638 [0,1,0,1,0,0|1,0,0]=3 963 B12R2.132 CC1=CC2=C(C=C1)CC[C@@H]2N N10962 [0,1,0,1,0,0|1,0,0]=3 964 B12R2.132 CC1=CC2=C(C=C1)CC[C@@H]2N W12236 [0,1,0,1,0,0|1,0,0]=3 965 B12R2.132 CC1=CC2=C(C=C1)NN=C2Br 71676 [0,1,0,1,0,0|1,0,1]=4 966 B12R2.132 CC1=CC2=C(C=C1)OC[C@@H]2N N16524 [0,1,0,1,0,0|1,0,0]=3 967 B12R2.132 CC1=CC2=C(C=C1)OC[C@@H]2N N16525 [0,1,0,1,0,0|1,0,0]=3 968 B12R2.132 CC1=CC2=C(C=C1)OC[C@@H]2N N16526 [0,1,0,1,0,0|1,0,0]=3 969 B12R2.132 NC1=CC2=C(C=C1)OC[C@@H]2N N14632 [0,1,0,1,0,0|2,0,0]=4 970 B12R2.132 NC1=CC2=C(C=C1)OC[C@@H]2N N14633 [0,1,0,1,0,0|2,0,0]=4 971 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 F16937 [0,1,0,1,0,0|2,0,0]=4 972 B12R2.132 N[C@H]1CCC2=C1C=C(O)C=C2 41007 [0,1,0,1,0,0|2,0,0]=4 973 B12R2.132 N[C@H]1COC2=C1C=C(Br)C=C2 N11239 [0,1,0,1,0,0|2,0,0]=4 974 B12R2.132 N[C@H]1COC2=C1C=C(Br)C=C2 N16518 [0,1,0,1,0,0|2,0,0]=4 975 B12R2.132 N[C@H]1COC2=C1C=C(Cl)C=C2 52525 [0,1,0,1,0,0|2,0,0]=4 976 B12R2.132 N[C@H]1COC2=C1C=C(Cl)C=C2 N16514 [0,1,0,1,0,0|2,0,0]=4 977 B12R2.132 N[C@H]1COC2=C1C=C(Cl)C=C2 N16515 [0,1,0,1,0,0|2,0,0]=4 978 B12R2.132 N[C@H]1COC2=C1C=C(F)C=C2 N11261 [0,1,0,1,0,0|2,0,0]=4 979 B12R2.132 O[C@H]1COC2=C1C=C(Br)C=C2 AT23850 [0,1,0,1,0,0|2,0,0]=4 980 B12R2.196 CC1=C2OC[C@H](N)C2=CC=C1 N11245 [0,1,0,1,0,0|1,0,0]=3 981 B12R2.196 CC1=C2OC[C@H](N)C2=CC=C1 N16519 [0,1,0,1,0,0|1,0,0]=3 982 B12R2.196 CC1=C2OC[C@H](N)C2=CC=C1 N16520 [0,1,0,1,0,0|1,0,0]=3 983 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N10987 [0,1,0,1,0,0|1,0,0]=3 984 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N10988 [0,1,0,1,0,0|1,0,0]=3 985 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N10989 [0,1,0,1,0,0|1,0,0]=3 986 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N12838 [0,1,0,1,0,0|1,0,0]=3 987 B12R2.196 CC1=CC=CC2=C1NN=C2O F18597 [0,1,0,1,0,0|1,0,1]=4 988 B12R2.196 CC1=CC=CC2=C1OCC2=O 32296 [0,1,0,1,0,0|1,0,1]=4 989 B12R2.196 N[C@H]1CCC2=C(Cl)C=CC=C21 Y11667 [0,1,0,1,0,0|2,0,0]=4 990 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 F16929 [0,1,0,1,0,0|2,0,0]=4 991 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 N10489 [0,1,0,1,0,0|2,0,0]=4 992 B12R2.196 N[C@H]1COC2=C(Br)C=CC=C21 F16955 [0,1,0,1,0,0|2,0,0]=4 993 B12R2.196 N[C@H]1COC2=C(Br)C=CC=C21 F17000 [0,1,0,1,0,0|2,0,0]=4 994 B12R2.196 N[C@H]1COC2=C(Cl)C=CC=C21 59816 [0,1,0,1,0,0|2,0,0]=4 995 B12R2.196 N[C@H]1COC2=C(Cl)C=CC=C21 F16958 [0,1,0,1,0,0|2,0,0]=4 996 B12R2.196 N[C@H]1COC2=C(F)C=CC=C21 D81329 [0,1,0,1,0,0|2,0,0]=4 997 B12R2.1282 CC1=CC=CC(C2(N)CC2)=N1 59912 [0,1,0,1,0,0|2,0,0]=4 998 B12R2.1282 NC1(C2=CC=CC(Br)=C2)CC1 N12263 [0,1,0,1,0,0|2,0,0]=4 999 B12R2.2313 CC1=CC(C2CNC2)=NC=C1 90168 [0,1,0,1,0,0|1,0,0]=3 1000 B12R2.2313 CC1=CC=CC(C2CNC2)=C1 AT15442 [0,1,0,1,0,0|0,0,0]=2 1001 B12R2.2313 CC1=CC=CC(C2CNC2)=N1 90170 [0,1,0,1,0,0|1,0,0]=3 1002 B12R2.2313 CC1=CC=NC(C2CNC2)=N1 90177 [0,1,0,1,0,0|2,0,0]=4 1003 B12R2.2313 OC1=CC(C2CCC2)=CC=C1 97837 [0,1,0,1,0,0|2,0,0]=4 1004 B12R2.24 BrC1=CC2=C(C=C1)OCCN2 51779 [0,1,0,1,0,0|2,0,0]=4 1005 B12R2.24 BrC1=NC2=C(C=C1)CNCC2 C13599 [0,1,0,1,0,0|2,0,0]=4 1006 B12R2.24 BrC1=NC2=C(C=C1)NCCO2 88361 [0,1,0,1,0,0|2,0,0]=4 1007 B12R2.24 CC1=CC2=C(C=C1)CNCC2 C15799 [0,1,0,1,0,0|0,0,0]=2 1008 B12R2.24 CC1=CC2=C(C=C1)NCCO2 AC6673 [0,1,0,1,0,0|0,0,0]=2 1009 B12R2.24 CC1=CC2=C(C=C1)OCCN2 VT1288 [0,1,0,1,0,0|1,0,0]=3 1010 B12R2.24 CC1=CC2=C(C=C1)SCCN2 W10110 [0,1,0,1,0,0|1,0,0]=3 1011 B12R2.24 CC1=CC2=C(C=N1)NCCO2 D96756 [0,1,0,1,0,0|1,0,0]=3 1012 B12R2.24 ClC1=CC2=C(C=C1)CCCC2 Y10725 [0,1,0,1,0,0|2,0,0]=4 1013 B12R2.24 ClC1=CC2=C(C=C1)COCC2 N14606 [0,1,0,1,0,0|2,0,0]=4 1014 B12R2.24 ClC1=CC2=C(C=C1)SCCN2 AT25438 [0,1,0,1,0,0|2,0,0]=4 1015 B12R2.24 ClC1=CC2=C(C=C1)SCCN2 AT25439 [0,1,0,1,0,0|2,0,0]=4 1016 B12R2.24 FC1=CC2=C(C=C1)CCNC2 76409 [0,1,0,1,0,0|2,0,0]=4 1017 B12R2.24 FC1=CC2=C(C=C1)COCC2 N14605 [0,1,0,1,0,0|2,0,0]=4 1018 B12R2.24 NC1=CC2=C(C=C1)NCCO2 AC6390 [0,1,0,1,0,0|1,0,0]=3 1019 B12R2.24 NC1=CC2=C(C=C1)OCCN2 AC5752 [0,1,0,1,0,0|2,0,0]=4 1020 B12R2.24 OC1=CC2=C(C=C1)NCCO2 P20506 [0,1,0,1,0,0|1,0,0]=3 1021 B12R2.203 CC1=C2C(=O)NCC2=CC=C1 O11662 [0,1,0,1,0,0|1,0,1]=4 1022 B12R2.203 CC1=C2C(=O)OCC2=CC=C1 I11580 [0,1,0,1,0,0|1,0,1]=4 1023 B12R2.203 N[C@H]1CCC2=CC=CC(F)=C21 Y12096 [0,1,0,1,0,0|1,0,0]=3 1024 B12R2.203 N[C@H]1COC2=CC=CC(Br)=C21 N11252 [0,1,0,1,0,0|1,0,0]=3 1025 B12R2.203 N[C@H]1COC2=CC=CC(Br)=C21 N11253 [0,1,0,1,0,0|1,0,0]=3 1026 B12R2.203 N[C@H]1COC2=CC=CC(Cl)=C21 N11259 [0,1,0,1,0,0|1,0,0]=3 1027 B12R2.203 N[C@H]1COC2=CC=CC(Cl)=C21 N16516 [0,1,0,1,0,0|1,0,0]=3 1028 B12R2.203 O[C@H]1CSC2=CC=CC(Br)=C21 D76237 [0,1,0,1,0,0|2,0,0]=4 1029 B12R2.612 CC1=CC2=C(C=C1)C(=O)NC2 F21430 [0,1,0,1,0,0|1,0,1]=4 1030 B12R2.612 CC1=CC2=C(C=C1)C(N)=NN2 90926 [0,1,0,1,0,0|1,0,1]=4 1031 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CC2 N10840 [0,1,0,1,0,0|0,0,0]=2 1032 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N11326 [0,1,0,1,0,0|0,0,0]=2 1033 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N16521 [0,1,0,1,0,0|0,0,0]=2 1034 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N16523 [0,1,0,1,0,0|0,0,0]=2 1035 B12R2.612 ClC1=CC2=C(C=C1)[C@@H](Br)CC2 AT21847 [0,1,0,1,0,0|2,0,0]=4 1036 B12R2.612 Cl[C@H]1CCC2=C1C=CC(Br)=C2 O11349 [0,1,0,1,0,0|2,0,0]=4 1037 B12R2.612 NC1=CC2=C(C=C1)[C@@H](N)CO2 N14630 [0,1,0,1,0,0|1,0,0]=3 1038 B12R2.612 NC1=CC2=C(C=C1)[C@@H](N)CO2 N14631 [0,1,0,1,0,0|1,0,0]=3 1039 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 69968 [0,1,0,1,0,0|1,0,0]=3 1040 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 F16940 [0,1,0,1,0,0|1,0,0]=3 1041 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 Y11252 [0,1,0,1,0,0|1,0,0]=3 1042 B12R2.612 N[C@H]1COC2=C1C=CC(Br)=C2 N11256 [0,1,0,1,0,0|1,0,0]=3 1043 B12R2.612 O=C1CCC2=C1C=CC(S)=C2 79915 [0,1,0,1,0,0|2,0,0]=4 1044 B12R2.612 O[C@H]1COC2=C1C=CC(Cl)=C2 AT21520 [0,1,0,1,0,0|2,0,0]=4 1045 B12R2.246 CC1=CC(Cl)=NC2=C1CCC2 W18956 [0,1,0,1,0,0|2,0,0]=4 1046 B12R2.246 CC1=CC(F)=C2NC=CC2=C1 68932 [0,1,0,1,0,0|0,0,2]=4 1047 B12R2.246 FC1=CC(F)=C2OCCC2=C1 H10353 [0,1,0,1,0,0|2,0,0]=4 1048 B12R2.246 NC1=C2OCCC2=CC(F)=C1 88988 [0,1,0,1,0,0|2,0,0]=4 1049 B12R2.606 CC1=CC2=C(C=C1)NC(=O)O2 AC5672 [0,1,0,1,0,0|1,0,1]=4 1050 B12R2.606 NC1=CC2=C(C=C1)C[C@H](O)C2 94670 [0,1,0,1,0,0|2,0,0]=4 1051 B12R2.606 N[C@H]1CC2=C(C=C(Cl)C=C2)C1 C16302 [0,1,0,1,0,0|1,0,0]=3 1052 B12R2.606 N[C@H]1CC2=C(C=C(F)C=C2)C1 Y10225 [0,1,0,1,0,0|1,0,0]=3 1053 B12R2.606 N[C@H]1CC2=C(C=C(I)C=C2)C1 25202 [0,1,0,1,0,0|1,0,0]=3 1054 B12R2.606 N[C@H]1CC2=C(C=C(I)C=C2)C1 36607 [0,1,0,1,0,0|1,0,0]=3 1055 B12R2.606 OC1=CC2=C(C=C1)C[C@H](O)C2 F53501 [0,1,0,1,0,0|2,0,0]=4 1056 B12R2.221 CC1=C2C=CNC2=C(C)C=C1 I11443 [0,1,0,1,0,0|0,0,2]=4 1057 B12R2.221 CC1=C2NC=CC2=C(O)C=C1 F18320 [0,1,0,1,0,0|0,0,2]=4 1058 B12R2.221 NC1=C2CCCC2=C(Br)C=C1 93743 [0,1,0,1,0,0|2,0,0]=4 1059 B12R2.221 OC1=C2CCCC2=C(Br)C=C1 AT25822 [0,1,0,1,0,0|2,0,0]=4 1060 B12R2.221 OC1=C2CCCC2=C(F)C=C1 N14302 [0,1,0,1,0,0|2,0,0]=4 1061 B12R2.1316 CC1=C(C2CC2)C=C(N)C=C1 AC9568 [0,1,0,1,0,0|2,0,0]=4 1062 B12R2.1316 CC1=CC(C2CC2)=C(C)C=C1 AC9678 [0,1,0,1,0,0|1,0,0]=3 1063 B12R2.1316 FC1=C(C2CC2)C=C(Cl)C=C1 AC8512 [0,1,0,1,0,0|2,0,0]=4 1064 B12R2.1316 NC1=C(C2CC2)C=C(F)C=C1 AC3387 [0,1,0,1,0,0|2,0,0]=4 1065 B12R2.1316 OC1=C(C2CC2)C=C(Br)C=C1 97770 [0,1,0,1,0,0|2,0,0]=4 1066 B12R2.43 COC1=CC(C2CC2)=CC=C1 AC8808 [0,1,0,1,0,0|1,0,0]=3 1067 B12R2.43 N#CC1=CC(C2CC2)=CC=C1 AC8317 [0,1,0,1,0,0|1,0,1]=4 1068 B12R2.43 NCC1=CC(C2CC2)=CC=C1 O10081 [0,1,0,1,0,0|1,0,0]=3 1069 B12R2.43 SCC1=CC(C2CC2)=CC=C1 AT13697 [0,1,0,1,0,0|1,0,0]=3 1070 B12R2.44 BrCC1=CC2=C(C=C1)CCC2 71843 [0,1,0,1,0,0|1,0,0]=3 1071 B12R2.44 BrCC1=CC2=C(C=C1)NN=C2 78907 [0,1,0,1,0,0|1,0,1]=4 1072 B12R2.44 CNC1=CC2=C(C=C1)CCC2 F12591 [0,1,0,1,0,0|1,0,0]=3 1073 B12R2.44 COC1=CC2=C(C=CC2)C=C1 A10637 [0,1,0,1,0,0|1,0,1]=4 1074 B12R2.44 ClCC1=CC2=C(C=C1)CCC2 AT13426 [0,1,0,1,0,0|1,0,0]=3 1075 B12R2.44 NCC1=CC2=C(C=C1)CNC2 D87544 [0,1,0,1,0,0|2,0,0]=4 1076 B12R2.44 O=CC1=CN=C2NCCC2=C1 D78593 [0,1,0,1,0,0|1,0,1]=4 1077 B12R2.44 OCC1=CC2=C(C=C1)CCC2 AT13427 [0,1,0,1,0,0|1,0,0]=3 1078 B12R2.315 COC1=C2CCCC2=CC=C1 C15321 [0,1,0,1,0,0|1,0,0]=3 1079 B12R2.315 COC1=C2CCCC2=NC=C1 97220 [0,1,0,1,0,0|2,0,0]=4 1080 B12R2.315 COC1=C2NN=CC2=CC=C1 D78821 [0,1,0,1,0,0|1,0,1]=4 1081 B12R2.315 COC1=C2OCOC2=CC=C1 F51131 [0,1,0,1,0,0|2,0,0]=4 1082 B12R2.315 CSC1=C2NC=CC2=CC=C1 89387 [0,1,0,1,0,0|0,0,2]=4 1083 B12R2.315 N#CC1=C2CCCC2=CC=C1 AT17195 [0,1,0,1,0,0|1,0,1]=4 1084 B12R2.315 NCC1=CC=CC2=C1CCN2 F17823 [0,1,0,1,0,0|2,0,0]=4 1085 B12R2.315 O=CC1=C2CCCC2=CC=C1 N10682 [0,1,0,1,0,0|1,0,1]=4 1086 B12R2.315 O=CC1=C2CCCC2=CC=C1 Y10694 [0,1,0,1,0,0|1,0,1]=4 1087 B12R2.100 FC1=C(Cl)C=C2NCCC2=C1 A10638 [0,1,0,1,0,0|1,0,0]=3 1088 B12R2.100 NC1=C(Br)C=C2CCCC2=C1 AT13424 [0,1,0,1,0,0|2,0,0]=4 1089 B12R2.291 CC1=C(Br)C=NC(C2CC2)=C1 AT10174 [0,1,0,1,0,0|2,0,0]=4 1090 B12R2.291 CC1=C(Br)C=NC(C2CC2)=C1 C91348 [0,1,0,1,0,0|2,0,0]=4 1091 B12R2.291 CC1=C(N)C=C(C2CC2)C=C1 AC9034 [0,1,0,1,0,0|2,0,0]=4 1092 B12R2.291 ClC1=C(Cl)C=C(C2CC2)C=C1 AC8617 [0,1,0,1,0,0|2,0,0]=4 1093 B12R2.291 FC1=C(Br)C=CC(C2CC2)=C1 96637 [0,1,0,1,0,0|2,0,0]=4 1094 B12R2.291 FC1=C(Cl)C=C(C2CC2)C=C1 AC9177 [0,1,0,1,0,0|2,0,0]=4 1095 B12R2.291 NC1=C(Br)C=C(C2CC2)C=C1 AT10657 [0,1,0,1,0,0|2,0,0]=4 1096 B12R2.291 NC1=C(F)C=C(C2CC2)C=C1 96634 [0,1,0,1,0,0|2,0,0]=4 1097 B12R2.291 NC1=C(N)C=C(C2CC2)C=C1 AC8809 [0,1,0,1,0,0|2,0,0]=4 1098 B8R1.1 CC1=CC(CN)=CO1 AT17525 [1,0,0,0,1,0|1,0,0]=3 1099 B8R1.1 CC1=CC(CO)=CO1 AT17479 [1,0,0,0,1,0|2,0,0]=4 1100 B8R1.1 CC1=CC(CO)=CS1 AT16765 [1,0,0,0,1,0|2,0,0]=4 1101 B8R1.1 CC1=CN=C(CN)O1 P18975 [1,0,0,0,1,0|2,0,0]=4 1102 B8R1.1 CC1=CN=C(CN)S1 32702 [1,0,0,0,1,0|2,0,0]=4 1103 B8R1.1 CC1=COC(CO)=C1 AT17124 [1,0,0,0,1,0|2,0,0]=4 1104 B8R1.1 CC1=NC(CN)=CN1 AT15472 [1,0,0,0,1,0|2,0,0]=4 1105 B8R1.1 CC1=NC(CN)=CO1 C71257 [1,0,0,0,1,0|2,0,0]=4 1106 B8R1.1 CC1=NC(CN)=CO1 D83900 [1,0,0,0,1,0|2,0,0]=4 1107 B8R1.1 CC1=NC(CN)=CS1 D86402 [1,0,0,0,1,0|2,0,0]=4 1108 B8R1.1 CC1=NNC(CN)=C1 AC1083 [1,0,0,0,1,0|2,0,0]=4 1109 B8R1.1 CC1=NOC(CN)=C1 A10590 [1,0,0,0,1,0|2,0,0]=4 1110 B8R1.1 CC1=NSC(CN)=C1 AT21220 [1,0,0,0,1,0|2,0,0]=4 1111 B8R1.1 CCC1=CC=C(S)S1 AT16555 [1,0,0,0,1,0|2,0,0]=4 1112 B8R1.1 CCC1=NN(C)C=C1 C91459 [1,0,0,0,1,0|2,0,0]=4 1113 B8R1.1 CN1C=CC(CN)=C1 AT16243 [1,0,0,0,1,0|1,0,0]=3 1114 B8R1.1 NCC1=CC(Br)=CN1 AT16225 [1,0,0,0,1,0|2,0,0]=4 1115 B8R1.1 NCC1=CC(Cl)=CO1 50492 [1,0,0,0,1,0|2,0,0]=4 1116 B8R1.1 NCC1=CC=C(Br)O1 79914 [1,0,0,0,1,0|2,0,0]=4 1117 B8R1.1 NCC1=CC=C(Br)O1 94512 [1,0,0,0,1,0|2,0,0]=4 1118 B8R1.1 NCC1=CC=C(Cl)S1 P19111 [1,0,0,0,1,0|2,0,0]=4 1119 B8R1.1 NCC1=CSC(Br)=C1 AT16376 [1,0,0,0,1,0|2,0,0]=4 1120 B8R1.11 CC1=C(CN)C=CO1 AT17524 [1,0,0,0,1,0|1,0,0]=3 1121 B8R1.11 CC1=C(CN)C=CO1 AT17541 [1,0,0,0,1,0|1,0,0]=3 1122 B8R1.11 CC1=C(CN)C=CS1 AT16801 [1,0,0,0,1,0|1,0,0]=3 1123 B8R1.11 CC1=C(CN)C=NO1 72465 [1,0,0,0,1,0|2,0,0]=4 1124 B8R1.11 CC1=C(CN)C=NO1 W10068 [1,0,0,0,1,0|2,0,0]=4 1125 B8R1.11 CC1=C(CN)N=CN1 AT15470 [1,0,0,0,1,0|2,0,0]=4 1126 B8R1.11 CC1=C(CN)N=CO1 AT18605 [1,0,0,0,1,0|2,0,0]=4 1127 B8R1.11 CC1=C(CN)NC=N1 F19544 [1,0,0,0,1,0|2,0,0]=4 1128 B8R1.11 CC1=C(CN)OC=C1 AT17196 [1,0,0,0,1,0|1,0,0]=3 1129 B8R1.11 CC1=C(CN)OC=N1 AT18687 [1,0,0,0,1,0|2,0,0]=4 1130 B8R1.11 CC1=C(CN)SC=C1 71361 [1,0,0,0,1,0|1,0,0]=3 1131 B8R1.11 CC1=CSC=C1CN AT16790 [1,0,0,0,1,0|1,0,0]=3 1132 B8R1.11 CCN1C=CN=C1C F16031 [1,0,0,0,1,0|2,0,0]=4 1133 B8R1.11 CN1C=CN=C1CN AT15625 [1,0,0,0,1,0|2,0,0]=4 1134 B8R1.11 COC1=C(C)C=CS1 91670 [1,0,0,0,1,0|2,0,0]=4 1135 B8R1.11 C[S@H]1C=CC=C1CN AT17306 [1,0,0,0,1,0|1,0,0]=3 1136 B8R1.11 NCC1=C(Br)C=CS1 P10346 [1,0,0,0,1,0|2,0,0]=4 1137 B8R1.11 NCC1=CSC=C1Br AT16740 [1,0,0,0,1,0|2,0,0]=4 1138 B8R1.11 NCC1=CSC=C1Cl AT16880 [1,0,0,0,1,0|2,0,0]=4 1139 B8R1.8 BrCCC1=CC=CS1 F20027 [1,0,0,0,1,0|2,0,0]=4 1140 B8R1.8 NCCC1=CN=CN1 S10979 [1,0,0,0,1,0|2,0,0]=4 1141 B8R1.8 NCCC1=CNN=C1 AC1363 [1,0,0,0,1,0|2,0,0]=4 1142 B8R1.8 NCCC1=CNN=C1 D85886 [1,0,0,0,1,0|2,0,0]=4 1143 B8R1.8 NCCC1=COC=N1 AT18667 [1,0,0,0,1,0|2,0,0]=4 1144 B8R1.8 NCCC1=NC=CS1 F51904 [1,0,0,0,1,0|2,0,0]=4 1145 B8R1.8 NCCC1=NNC=C1 AC2815 [1,0,0,0,1,0|2,0,0]=4 1146 B8R1.8 NCCN1C=CC=N1 AT10968 [1,0,0,0,1,0|2,0,0]=4 1147 B8R1.8 NNCC1=CC=CS1 P10519 [1,0,0,0,1,0|2,0,0]=4 1148 B8R1.8 NNCC1=CSC=C1 P10771 [1,0,0,0,1,0|2,0,0]=4