0 B8R1.8 CCNC1=NN=CS1 OR5353 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.8 CCOC1=NC=CS1 OR350164 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.8 CNCC1=CC=CO1 OR110977 [0,0,0,0,0,0|2,1,0]=3 3 B8R1.8 CNCC1=COC=C1 OR110085 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.8 N#CCC1=CC=CN1 OR471598 [0,0,0,0,0,0|1,0,2]=3 5 B8R1.8 NCCC1=CN=CN1 OR310729 [0,0,0,0,0,0|2,0,0]=2 6 B8R1.8 NCCC1=NN=NN1 OR345113 [0,0,0,0,0,0|4,0,0]=4 7 B8R1.8 NCCC1=NNC=C1 OR471576 [0,0,0,0,0,0|2,0,0]=2 8 B8R1.8 NCCN1C=CN=N1 OR350494 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.8 O\N=C\C1=NC=CS1 OR110119 [0,0,0,0,0,0|3,0,1]=4 10 B7R1.1 COC1=NC=CS1 OR350279 [1,0,0,0,0,0|2,0,0]=3 11 B7R1.1 ClCC1=NC=CS1 OR471060 [1,0,0,0,0,0|2,0,0]=3 12 B7R1.1 NCC1=CNC=N1 OR471298 [1,0,0,0,0,0|2,0,0]=3 13 B7R1.1 NCC1=CNN=C1 OR350493 [1,0,0,0,0,0|3,0,0]=4 14 B7R1.1 NCC1=CNN=N1 OR015019 [1,0,0,0,0,0|3,0,0]=4 15 B7R1.1 NCC1=NN=CO1 OR480234 [1,0,0,0,0,0|2,1,0]=4 16 B7R1.1 NCC1=NNC=N1 OR471295 [1,0,0,0,0,0|3,0,0]=4 17 B7R1.1 OCC1=NNC=C1 OR315534 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.7 CC1=CC=C(CCN)S1 OR322779 [0,1,0,0,0,0|0,0,0]=1 19 B9R1.7 CC1=CN=C(CCN)N1 OR305181 [0,1,0,0,0,0|2,0,0]=3 20 B9R1.7 CC1=CSC(CC#N)=N1 OR28979 [0,1,0,0,0,0|1,0,2]=4 21 B9R1.7 CCCC1=CC(N)=NN1 OR480246 [0,1,0,0,0,0|3,0,0]=4 22 B9R1.7 CCCC1=CC=C(Br)S1 OR305587 [0,1,0,0,0,0|1,0,0]=2 23 B9R1.7 N#CCC1=CC(Br)=CS1 OR3716 [0,1,0,0,0,0|0,0,2]=3 24 B9R1.7 O\N=C\C1=CC=C(Br)S1 OR322321 [0,1,0,0,0,0|2,0,1]=4 25 B9R1.11 CCC(=O)C1=CC=CS1 OR23928 [0,1,0,0,0,0|1,0,1]=3 26 B9R1.11 COC(=N)C1=CC=CS1 OR300533 [0,1,0,0,0,0|2,0,1]=4 27 B9R1.11 N#CC(=O)C1=CC=CS1 OR24183 [0,1,0,0,0,0|0,0,3]=4 28 B9R1.11 NNC(=O)C1=CC=CN1 OR27344 [0,1,0,0,0,0|2,0,1]=4 29 B9R1.11 NNC(=O)C1=CC=CO1 OR21603 [0,1,0,0,0,0|1,1,1]=4 30 B9R1.11 N\C(=N/O)C1=CC=CS1 OR300735 [0,1,0,0,0,0|2,0,1]=4 31 B9R1.12 C#CCCC1=CNC=N1 OR350421 [0,1,0,0,0,0|3,0,0]=4 32 B9R1.12 NCCCN1C=CC=N1 OR322536 [0,1,0,0,0,0|2,0,0]=3 33 B9R1.13 CC(N)CC1=CC=CS1 OR322493 [0,1,0,0,0,0|0,0,0]=1 34 B9R1.13 CC(N)CN1C=NC=N1 OR322553 [0,1,0,0,0,0|3,0,0]=4 35 B9R1.13 CN(C)CC1=CC=CN1 OR470434 [0,1,0,0,0,0|3,0,0]=4 36 B9R1.33 CC1=C(CCN)SC=C1 OR322669 [0,1,0,0,0,0|0,0,0]=1 37 B9R1.33 NC1=CC=NN1CCO OR306160 [0,1,0,0,0,0|3,0,0]=4 38 B9R2.3 C1=NC2=C(CNC2)S1 OR470645 [0,0,0,1,0,0|3,0,0]=4 39 B9R2.3 C1=NN2CCCC2=C1 OR350467 [0,0,0,1,0,0|3,0,0]=4 40 B9R1.8 BrCCC1=CC=CC=N1 OR322454 [0,0,0,0,0,1|2,0,0]=3 41 B9R1.8 Br[Mg]CC1=CC=CC=C1 OR320064 [0,0,0,0,0,1|3,0,0]=4 42 B9R1.8 Br[Mg]CC1=CC=CC=C1 OR320065 [0,0,0,0,0,1|3,0,0]=4 43 B9R1.8 CCCC1=NC=CC=C1 OR310652 [0,0,0,0,0,1|2,0,0]=3 44 B9R1.8 CCOC1=CN=CC=C1 OR345538 [0,0,0,0,0,1|3,0,0]=4 45 B9R1.8 CCOC1=NC=CN=C1 OR350173 [0,0,0,0,0,1|3,0,0]=4 46 B9R1.8 Cl[Mg]CC1=CC=CC=C1 OR320068 [0,0,0,0,0,1|3,0,0]=4 47 B9R1.8 Cl[Mg]CC1=CC=CC=C1 OR320069 [0,0,0,0,0,1|3,0,0]=4 48 B9R1.8 Cl[Mg]CC1=CC=CC=C1 OR320071 [0,0,0,0,0,1|3,0,0]=4 49 B9R1.8 NNCC1=CC=CC=C1 OR315732 [0,0,0,0,0,1|2,0,0]=3 50 B9R1.8 NNCC1=CC=CC=N1 OR306156 [0,0,0,0,0,1|2,0,0]=3 51 B9R1.8 NNCC1=CC=CN=C1 OR306139 [0,0,0,0,0,1|2,0,0]=3 52 B9R1.8 NNCC1=CC=NC=C1 OR306205 [0,0,0,0,0,1|2,0,0]=3 53 B9R1.8 NOCC1=CC=CN=C1 OR471001 [0,0,0,0,0,1|2,0,0]=3 54 B9R1.8 O=CCC1=CC=CN=C1 OR311265 [0,0,0,0,0,1|2,0,1]=4 55 B9R1.8 O=CCC1=CC=NC=C1 OR311262 [0,0,0,0,0,1|2,0,1]=4 56 B9R1.8 SCCC1=CC=CN=C1 OR305415 [0,0,0,0,0,1|2,0,0]=3 57 B9R1.8 SCCC1=CC=NC=C1 OR322470 [0,0,0,0,0,1|2,0,0]=3 58 B6R1.2 CC1=NC=CS1 OR350221 [2,0,0,0,0,0|1,0,0]=3 59 B6R1.2 CN1C=CC=N1 OR110194 [2,0,0,0,0,0|2,0,0]=4 60 B6R1.2 ClC1=CN=CS1 OR54494 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.1 CC1=CN=C(CN)S1 OR470664 [1,1,0,0,0,0|1,0,0]=3 62 B8R1.1 CC1=CNC(CO)=C1 OR0100 [1,1,0,0,0,0|2,0,0]=4 63 B8R1.1 CC1=NNC(CN)=C1 OR471517 [1,1,0,0,0,0|2,0,0]=4 64 B8R1.1 CCC1=NNC(N)=C1 OR480223 [1,1,0,0,0,0|2,0,0]=4 65 B8R1.1 CCN1C=CC(Br)=N1 OR200118 [1,1,0,0,0,0|2,0,0]=4 66 B8R1.1 CCN1C=CC(N)=N1 OR111552 [1,1,0,0,0,0|2,0,0]=4 67 B8R1.1 CNC1=NC(N)=CS1 OR302132 [1,1,0,0,0,0|2,0,0]=4 68 B8R1.1 ClCC1=CC=C(Cl)S1 OR350104 [1,1,0,0,0,0|1,0,0]=3 69 B8R1.1 NCC1=CC=C(Br)O1 OR471307 [1,1,0,0,0,0|0,1,0]=3 70 B8R1.1 NCC1=CC=C(Br)S1 OR322390 [1,1,0,0,0,0|0,0,0]=2 71 B8R1.1 NCC1=COC(N)=N1 OR471291 [1,1,0,0,0,0|2,0,0]=4 72 B8R1.1 NCC1=CSC(Br)=C1 OR321446 [1,1,0,0,0,0|2,0,0]=4 73 B8R1.7 CC(C)N1C=CC=N1 OR350203 [1,1,0,0,0,0|2,0,0]=4 74 B8R1.7 CC(O)C1=CC=CO1 OR28933 [1,1,0,0,0,0|0,1,0]=3 75 B8R1.7 FC(F)C1=CC=CS1 PC502396 [1,1,0,0,0,0|1,0,0]=3 76 B8R1.7 FC(F)C1=CN=CS1 PC520284 [1,1,0,0,0,0|2,0,0]=4 77 B8R1.7 FC(F)C1=NC=CS1 PC520261 [1,1,0,0,0,0|2,0,0]=4 78 B8R1.7 N=C(N)C1=CC=CN1 OR305631 [1,1,0,0,0,0|1,0,1]=4 79 B8R1.11 CC1=C(CN)SC=N1 OR471301 [1,1,0,0,0,0|1,0,0]=3 80 B10R1.1 FC1=CC=C(CCBr)C=C1 PC7166 [0,1,0,0,0,1|2,0,0]=4 81 B10R1.1 FC1=CC=C(CCCl)C=C1 PC1812J [0,1,0,0,0,1|2,0,0]=4 82 B10R1.1 NCCC1=CC=C(N)C=C1 OR350013 [0,1,0,0,0,1|1,0,0]=3 83 B10R1.1 NNCC1=CC=C(Br)C=C1 OR306142 [0,1,0,0,0,1|2,0,0]=4 84 B10R1.1 NNCC1=CC=C(F)C=C1 PC403065 [0,1,0,0,0,1|2,0,0]=4 85 B10R1.1 NNCC1=CC=C(F)C=C1 PC9518 [0,1,0,0,0,1|2,0,0]=4 86 B10R1.1 NOCC1=CC=C(F)C=C1 PC4627 [0,1,0,0,0,1|2,0,0]=4 87 B10R1.1 OCCC1=CC=C(F)C=C1 PC4067 [0,1,0,0,0,1|2,0,0]=4 88 B10R1.1 OCCC1=CC=C(I)C=C1 OR301185 [0,1,0,0,0,1|2,0,0]=4 89 B10R1.4 BrCCC1=C(Br)C=CC=C1 OR310964 [0,1,0,0,0,1|2,0,0]=4 90 B10R1.4 CC1=CC=CN=C1CCN OR322555 [0,1,0,0,0,1|1,0,0]=3 91 B10R1.4 FC1=CC=CC=C1CCCl PC510242 [0,1,0,0,0,1|2,0,0]=4 92 B10R1.4 FCCC1=CC=CC=C1I PC450003 [0,1,0,0,0,1|2,0,0]=4 93 B10R1.4 NNCC1=C(F)C=CC=C1 PC49334 [0,1,0,0,0,1|2,0,0]=4 94 B10R1.4 NNCC1=CC=CC=C1Br OR306140 [0,1,0,0,0,1|2,0,0]=4 95 B10R1.4 NNCC1=CC=CC=C1F PC403063 [0,1,0,0,0,1|2,0,0]=4 96 B10R1.4 NOCC1=CC=CC=C1F PC4625 [0,1,0,0,0,1|2,0,0]=4 97 B10R1.4 OCCC1=C(F)C=CC=C1 PC4066 [0,1,0,0,0,1|2,0,0]=4 98 B10R1.10 CC1=CC=CC(CCN)=N1 OR322859 [0,1,0,0,0,1|1,0,0]=3 99 B10R1.10 FC1=CC=CC(CCBr)=C1 PC4528 [0,1,0,0,0,1|2,0,0]=4 100 B10R1.10 NNCC1=CC=CC(Br)=C1 OR306141 [0,1,0,0,0,1|2,0,0]=4 101 B10R1.10 NNCC1=CC=CC(F)=C1 PC403064 [0,1,0,0,0,1|2,0,0]=4 102 B10R1.10 NOCC1=CC=CC(F)=C1 PC4626 [0,1,0,0,0,1|2,0,0]=4 103 B10R1.10 OCCC1=CC(F)=CC=C1 PC5701 [0,1,0,0,0,1|2,0,0]=4 104 B10R1.10 OCCC1=CC=CC(Br)=N1 OR471389 [0,1,0,0,0,1|2,0,0]=4 105 B10R1.15 BrCC(Br)C1=CC=CC=C1 OR4708 [0,1,0,0,0,1|2,0,0]=4 106 B10R1.15 FC(CBr)C1=CC=CC=C1 PC400563 [0,1,0,0,0,1|2,0,0]=4 107 B10R1.17 BrCCSC1=CC=CC=C1 OR322375 [0,1,0,0,0,1|2,0,0]=4 108 B10R1.17 CCNCC1=CC=CC=N1 OR315116 [0,1,0,0,0,1|2,0,0]=4 109 B10R1.17 CCNCC1=CC=CN=C1 OR318059 [0,1,0,0,0,1|2,0,0]=4 110 B10R1.17 CCNCC1=CC=NC=C1 OR315114 [0,1,0,0,0,1|2,0,0]=4 111 B10R1.17 CNCCC1=CN=CC=C1 OR12532 [0,1,0,0,0,1|1,0,0]=3 112 B10R1.17 NCCCC1=CC=NC=C1 OR303785 [0,1,0,0,0,1|1,0,0]=3 113 B10R1.17 OCCCC1=CC=CN=C1 OR303919 [0,1,0,0,0,1|2,0,0]=4 114 B10R1.17 OCCCC1=CC=NC=C1 OR350323 [0,1,0,0,0,1|2,0,0]=4 115 B10R1.17 SCCCC1=CC=CN=C1 OR305417 [0,1,0,0,0,1|2,0,0]=4 116 B10R1.17 SCCCC1=CC=NC=C1 OR305416 [0,1,0,0,0,1|2,0,0]=4 117 B10R1.17 SCCCC1=NC=CC=C1 OR305418 [0,1,0,0,0,1|2,0,0]=4 118 B10R1.18 CC(C)CC1=CC=NC=C1 OR470882 [0,1,0,0,0,1|2,0,0]=4 119 B10R1.18 CC(N)CC1=CC=CN=C1 OR322554 [0,1,0,0,0,1|1,0,0]=3 120 B10R1.18 C[C@H](O)CC1=CC=CC=C1 OR304049 [0,1,0,0,0,1|2,0,0]=4 121 B10R1.18 FC(F)CC1=CC=CC=C1 PC49564 [0,1,0,0,0,1|2,0,0]=4 122 B10R1.18 NC(=S)CC1=CC=CC=C1 OR346049 [0,1,0,0,0,1|1,0,1]=4 123 B10R1.14 CC1=CSC(C(=O)NN)=C1 OR111295 [0,2,0,0,0,0|1,0,1]=4 124 B10R1.16 CC1=CN=C(CCCN)N1 OR305180 [0,2,0,0,0,0|2,0,0]=4 125 B10R1.54 CN(C)CC1=CC(Br)=CS1 OR323226 [0,2,0,0,0,0|2,0,0]=4 126 B10R1.130 CC1=NC(C)=C(CCN)S1 OR350153 [0,2,0,0,0,0|1,0,0]=3 127 B10R1.9 COC(CN)C1=CC=CS1 OR322399 [0,2,0,0,0,0|0,0,0]=2 128 B10R1.11 CCOC(=N)C1=CC=CS1 OR111000 [0,2,0,0,0,0|1,0,1]=4 129 B10R1.11 N#CCC(=O)C1=CC=CS1 OR23646 [0,2,0,0,0,0|0,0,2]=4 130 B10R1.149 NNC(=O)C1=C(Br)C=CS1 OR110624 [0,2,0,0,0,0|1,0,1]=4 131 B10R1.29 CC1=C(CCCN)SC=N1 OR322651 [0,2,0,0,0,0|1,0,0]=3 132 B10R1.66 CC(=O)CSC1=CC=CS1 OR4064 [0,2,0,0,0,0|1,0,1]=4 133 B10R2.6 C1=CC=C(C2CC2)C=C1 OR24951 [0,0,0,1,0,1|2,0,0]=4 134 B10R2.6 [C@H]1(C2=CC=CC=C2)CO1 OR5172 [0,0,0,1,0,1|2,0,0]=4 135 B10R2.7 C1=CC2=C(N=C1)NCC2 OR345007 [0,0,0,1,0,1|1,0,0]=3 136 B10R2.7 C1=CN=C2CCNC2=C1 OR305602 [0,0,0,1,0,1|1,0,0]=3 137 B10R2.2 NC1=NC2=C(CCC2)S1 OR111480 [0,1,0,1,0,0|2,0,0]=4 138 B10R2.16 NC1(C2=CC=CO2)CC1 OR302305 [0,1,0,1,0,0|1,1,0]=4 139 B10R2.16 NC1(C2=CN=CS2)CC1 OR480101 [0,1,0,1,0,0|2,0,0]=4 140 B10R2.16 NC1(C2=NC=CS2)CC1 OR480102 [0,1,0,1,0,0|2,0,0]=4