0 B10R1.15 C=C(C#N)C1=CC=CC=C1 MC106124 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.15 C=C(CBr)C1=CC=CC=C1 CS20091 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.15 C=CC(N)C1=CC=CC=C1 MC102512 [0,0,0,0,0,0|1,0,3]=4 3 B10R1.15 CC(CN)C1=CC=CC=C1 CS10909 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.15 CC(CN)c1ccccc1 MC110750 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.15 CC(NO)c1ccccc1 MC103844 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.15 CC(NO)c1ccccc1 MC103845 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.15 CCC(C)C1=CC=CC=C1 CS11947 [0,0,0,0,0,0|1,0,1]=2 8 B10R1.15 CCC(C)C1=CC=CC=C1 MC433489 [0,0,0,0,0,0|1,0,1]=2 9 B10R1.15 CCC(N)C1=CC=CC=C1 MC20337 [0,0,0,0,0,0|1,0,1]=2 10 B10R1.15 CCC(N)C1=NC=CN=C1 MC104764 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.15 CN(C=O)C1=CC=CC=C1 CS11793 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.15 COC(=N)C1=NC=CC=C1 MC106728 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.15 COC(=O)C1=CC=CC=C1 MC40065 [0,0,0,0,0,0|1,0,0]=1 14 B10R1.15 COC(=O)C1=CC=CN=N1 MC444561 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.15 COC(=O)C1=CC=NC=C1 CS18945 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.15 COC(=O)C1=CN=CC=C1 CS19425 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.15 COC(=O)C1=CN=CN=C1 MC444563 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.15 COC(=O)C1=CN=NC=C1 CS13474 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.15 COC(=O)C1=NC=CC=C1 CS19684 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.15 COC(=O)C1=NC=CC=N1 CS19792 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.15 COC(=O)C1=NC=NC=C1 MC444562 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.15 C\C(=C\Br)C1=CC=NC=C1 MC111870 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.15 FC(CBr)C1=CC=CC=C1 MC102769 [0,0,0,0,0,0|2,0,1]=3 24 B10R1.15 N#CC(N)C1=CC=CC=C1 MC31161 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.15 NC(CO)C1=CC=CC=C1 CS10553 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.15 NC(CO)C1=CC=CC=C1 CS10555 [0,0,0,0,0,0|2,0,1]=3 27 B10R1.15 NC(CO)C1=CC=CC=C1 CS15860 [0,0,0,0,0,0|2,0,1]=3 28 B10R1.15 NC(CO)C1=NC=CC=C1 MC111155 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.15 NCC(=O)C1=CC=CC=C1 CS10874 [0,0,0,0,0,0|1,0,0]=1 30 B10R1.15 NCC(=O)C1=NC=CC=C1 MC33498 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.15 NCC(O)C1=CC=CC=C1 CS20485 [0,0,0,0,0,0|1,0,2]=3 32 B10R1.15 NCC(O)C1=CC=CC=C1 MC444625 [0,0,0,0,0,0|1,0,2]=3 33 B10R1.15 NCC(O)C1=CC=CN=C1 MC103058 [0,0,0,0,0,0|2,0,2]=4 34 B10R1.15 NCC(O)C1=NC=CC=C1 MC33503 [0,0,0,0,0,0|2,0,2]=4 35 B10R1.15 NNC(=O)C1=CC=CC=C1 CS10971 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.15 NNC(=O)C1=CN=CC=C1 CS19488 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.15 NNC(=O)C1=NC=CN=C1 CS18472 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.15 NNC(=O)c1ccncc1 MC445177 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.15 O=C(CBr)C1=CC=CC=C1 CS19274 [0,0,0,0,0,0|1,0,0]=1 40 B10R1.15 O=C(CBr)C1=CC=CN=C1 MC42216 [0,0,0,0,0,0|2,0,0]=2 41 B10R1.15 O=C(CBr)C1=CC=NC=C1 CS20175 [0,0,0,0,0,0|2,0,0]=2 42 B10R1.15 O=C(CBr)C1=NC=CC=N1 MC115988 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.15 O=C(CBr)C1=NC=NC=C1 MC106959 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.15 O=C(CCl)C1=CC=CC=C1 MC20159 [0,0,0,0,0,0|1,0,0]=1 45 B10R1.15 O=C(CI)C1=CC=CC=C1 MC433244 [0,0,0,0,0,0|1,0,0]=1 46 B10R1.15 OC(CBr)C1=CC=CC=C1 CS18840 [0,0,0,0,0,0|1,0,2]=3 47 B10R1.15 OC(CCl)C1=CC=CN=C1 MC103059 [0,0,0,0,0,0|2,0,2]=4 48 B10R1.15 OCC(F)C1=CC=CC=C1 MC430923 [0,0,0,0,0,0|2,0,1]=3 49 B10R1.15 O\N=C(/Cl)C1=NC=CC=C1 CS14803 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.6 C=C(C)C1=CC=NC=C1 MC111872 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.6 C=C(F)C1=CC=CC=C1 MC102770 [1,0,0,0,0,0|1,0,1]=3 52 B9R1.6 CC(=O)C1=CC=CC=C1 MC41221 [1,0,0,0,0,0|0,0,0]=1 53 B9R1.6 CC(=O)C1=CC=CN=C1 CS18256 [1,0,0,0,0,0|1,0,0]=2 54 B9R1.6 CC(=O)C1=CC=CN=N1 MC444225 [1,0,0,0,0,0|2,0,0]=3 55 B9R1.6 CC(=O)C1=CC=NC=C1 CS22535 [1,0,0,0,0,0|1,0,0]=2 56 B9R1.6 CC(=O)C1=CN=CN=C1 MC444371 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.6 CC(=O)C1=CN=NC=C1 MC444309 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.6 CC(=O)C1=NC=CC=C1 CS18611 [1,0,0,0,0,0|1,0,0]=2 59 B9R1.6 CC(=O)C1=NC=CC=N1 MC444159 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.6 CC(=O)C1=NC=CN=C1 CS19346 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.6 CC(=O)C1=NC=NC=C1 MC442362 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.6 CC(Br)C1=CC=CC=C1 MC40570 [1,0,0,0,0,0|1,0,1]=3 63 B9R1.6 CC(C)C1=NC=CC=C1 CS21621 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.6 CC(N)C1=CC=CC=C1 CS10551 [1,0,0,0,0,0|1,0,1]=3 65 B9R1.6 CC(N)C1=CC=CC=C1 MC20344 [1,0,0,0,0,0|1,0,1]=3 66 B9R1.6 CC(N)C1=NC=CC=C1 CS15370 [1,0,0,0,0,0|2,0,1]=4 67 B9R1.6 CC(N)C1=NC=CC=C1 CS20271 [1,0,0,0,0,0|2,0,1]=4 68 B9R1.6 CC(O)C1=CC=CC=C1 MC20383 [1,0,0,0,0,0|0,0,2]=3 69 B9R1.6 CC(O)C1=NC=CC=C1 CS20801 [1,0,0,0,0,0|1,0,2]=4 70 B9R1.6 CC(O)C1=NC=CC=C1 MC20310 [1,0,0,0,0,0|1,0,2]=4 71 B9R1.6 CN(C)C1=CC=CC=C1 MC40906 [1,0,0,0,0,0|2,0,0]=3 72 B9R1.6 CN(C)C1=CC=NC=C1 CS13386 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.6 C[PH](=O)C1=CC=CC=C1 CS16386 [1,0,0,0,0,0|1,0,0]=2 74 B9R1.6 ClC(Cl)C1=CC=CC=C1 MC40608 [1,0,0,0,0,0|2,0,1]=4 75 B9R1.6 FC(F)C1=CC=CC=C1 MC41442 [1,0,0,0,0,0|2,0,1]=4 76 B9R1.6 N=C(N)C1=CC=CC=C1 CS14830 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.6 N=C(N)C1=CN=CC=C1 CS19487 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.6 N=C(N)C1=NC=CC=C1 CS19100 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.6 NC(=O)C1=CC=CC=C1 CS10962 [1,0,0,0,0,0|1,0,0]=2 80 B9R1.6 NC(=O)C1=CC=NC=C1 CS13721 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.6 NC(=O)C1=NC=CC=C1 CS11910 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.6 NC(=O)C1=NC=CN=C1 CS13379 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.6 NC(=O)C1=NC=CN=C1 MC427375 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.6 NC(=S)C1=CC=CC=C1 MC20863 [1,0,0,0,0,0|1,1,0]=3 85 B9R1.6 O=C(Cl)C1=CC=CC=C1 MC40435 [1,0,0,0,0,0|1,0,0]=2 86 B9R1.6 O=C(Cl)C1=NC=CC=C1 CS11857 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.6 O=C(O)C1=CC=CC=C1 MC40233 [1,0,0,0,0,0|1,0,0]=2 88 B9R1.6 O=C(O)C1=CC=CN=C1 MC41633 [1,0,0,0,0,0|2,0,0]=3 89 B9R1.6 O=C(O)C1=CC=CN=N1 CS19741 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.6 O=C(O)C1=CN=CN=C1 CS17525 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.6 O=C(O)C1=CN=NC=C1 MC41706 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.6 O=C(O)C1=NC=CC=C1 CS13384 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.6 O=C(O)C1=NC=CC=N1 CS18229 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.6 O=C(O)C1=NC=CN=C1 CS17531 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.6 O=C(O)C1=NC=NC=C1 CS14129 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 MC41586 [1,0,0,0,0,0|2,0,0]=3 97 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 CS22384 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.6 OB(O)C1=CC=CC=C1 CS19450 [1,0,0,0,0,0|2,0,1]=4 99 B9R1.8 BrCCC1=CC=CC=C1 MC40571 [1,0,0,0,0,0|1,0,1]=3 100 B9R1.8 Br[Zn]Cc1ccccc1 MC121333 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.8 CCCC1=CC=CN=C1 CS22402 [1,0,0,0,0,0|1,0,1]=3 102 B9R1.8 CCNC1=CC=CC=C1 MC40913 [1,0,0,0,0,0|1,0,0]=2 103 B9R1.8 CCOC1=NC=CC=C1 CS18732 [1,0,0,0,0,0|2,0,0]=3 104 B9R1.8 CCOC1=NC=CN=C1 CS21524 [1,0,0,0,0,0|3,0,0]=4 105 B9R1.8 CNCC1=CC=CC=C1 MC10559 [1,0,0,0,0,0|1,0,1]=3 106 B9R1.8 CNCC1=CC=CC=C1 MC20323 [1,0,0,0,0,0|1,0,1]=3 107 B9R1.8 CNCC1=CC=CC=C1 MC21006 [1,0,0,0,0,0|1,0,1]=3 108 B9R1.8 CNCC1=CC=CN=C1 CS18846 [1,0,0,0,0,0|2,0,1]=4 109 B9R1.8 COCC1=NC=CC=C1 CS20909 [1,0,0,0,0,0|2,0,1]=4 110 B9R1.8 ClCCC1=CC=CC=C1 MC40609 [1,0,0,0,0,0|1,0,1]=3 111 B9R1.8 ClCCC1=CC=NC=C1 CS17913 [1,0,0,0,0,0|2,0,1]=4 112 B9R1.8 FCCC1=CC=CC=C1 MC41557 [1,0,0,0,0,0|1,0,1]=3 113 B9R1.8 NCCC1=CC=CC=C1 MC40983 [1,0,0,0,0,0|1,0,1]=3 114 B9R1.8 NCCC1=CC=CN=C1 CS21892 [1,0,0,0,0,0|2,0,1]=4 115 B9R1.8 NCCC1=NC=CC=C1 CS14064 [1,0,0,0,0,0|2,0,1]=4 116 B9R1.8 NNCC1=CC=CC=C1 CS11006 [1,0,0,0,0,0|2,0,1]=4 117 B9R1.8 NNCC1=CC=CC=C1 CS12127 [1,0,0,0,0,0|2,0,1]=4 118 B9R1.8 NOCC1=CC=CC=C1 CS14063 [1,0,0,0,0,0|2,0,1]=4 119 B9R1.8 O=C=NC1=CC=CC=C1 MC41051 [1,0,0,0,0,0|2,0,1]=4 120 B9R1.8 O=CNC1=CC=CC=C1 MC40924 [1,0,0,0,0,0|2,0,1]=4 121 B9R1.8 O=COC1=CC=CC=C1 MC40136 [1,0,0,0,0,0|2,0,1]=4 122 B9R1.8 OCCC1=CC=CC=C1 MC40745 [1,0,0,0,0,0|1,0,1]=3 123 B9R1.8 ONCC1=CC=CC=C1 CS11753 [1,0,0,0,0,0|2,0,1]=4 124 B11R1.7 C=CS(=O)(=O)C1=CC=CC=C1 CS20936 [0,1,0,0,0,0|1,0,2]=4 125 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 MC106429 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.7 O=S(=O)(NF)C1=CC=CC=C1 MC426118 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.7 OCC(F)(F)C1=CC=CC=C1 MC430789 [0,1,0,0,0,0|2,0,1]=4 128 B11R1.12 CCB(CC)C1=CC=CN=C1 MC10329 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.12 CCP(CC)c1ccccc1 MC444851 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.12 CNC(CO)C1=CC=CC=C1 CS17955 [0,1,0,0,0,0|1,0,2]=4 131 B11R1.12 COC(OC)c1ccccc1 CS10959 [0,1,0,0,0,0|1,0,2]=4 132 B11R1.12 COP(OC)C1=CC=CC=C1 MC444856 [0,1,0,0,0,0|2,0,1]=4 133 B11R1.12 NCC(CO)C1=CC=CC=C1 MC105854 [0,1,0,0,0,0|1,0,2]=4 134 B11R1.12 NCC(CO)C1=CC=CC=C1 MC105855 [0,1,0,0,0,0|1,0,2]=4 135 B11R1.12 OCC(CO)C1=CC=CC=C1 CS21198 [0,1,0,0,0,0|1,0,2]=4 136 B11R1.16 CCCC(=O)C1=CC=CN=C1 MC443690 [0,1,0,0,0,0|1,0,0]=2 137 B11R1.16 CCOC(=O)C1=CC=NC=C1 MC41618 [0,1,0,0,0,0|1,0,0]=2 138 B11R1.16 CCOC(=O)C1=CN=CC=C1 CS19194 [0,1,0,0,0,0|1,0,0]=2 139 B11R1.16 CCOC(=O)C1=NC=CC=C1 CS14035 [0,1,0,0,0,0|1,0,0]=2 140 B11R1.16 CN(CCN)C1=CC=CC=C1 CS11704 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.16 CNCC(C)C1=CC=CC=C1 MC446681 [0,1,0,0,0,0|1,0,1]=3 142 B11R1.16 CNCC(O)C1=CC=CC=C1 MC446674 [0,1,0,0,0,0|0,0,2]=3 143 B11R1.16 N#CCC(=O)C1=CC=CC=C1 CS10995 [0,1,0,0,0,0|0,0,1]=2 144 B11R1.16 N#CCC(=O)C1=CC=CN=C1 MC425586 [0,1,0,0,0,0|1,0,1]=3 145 B11R1.16 NC(CCO)C1=CC=CC=C1 CS18735 [0,1,0,0,0,0|1,0,1]=3 146 B11R1.16 NC(CCO)C1=CC=CC=C1 CS21217 [0,1,0,0,0,0|1,0,1]=3 147 B11R1.16 O=C(CCCl)C1=CC=CC=C1 MC41279 [0,1,0,0,0,0|0,0,0]=1 148 B11R1.16 O=C(N=C=S)C1=CC=CC=C1 MC41078 [0,1,0,0,0,0|1,0,1]=3 149 B11R1.16 OC(CCCl)C1=CC=CC=C1 CS10897 [0,1,0,0,0,0|0,0,2]=3 150 B11R1.16 OC(CCCl)C1=CC=CC=C1 CS22197 [0,1,0,0,0,0|0,0,2]=3 151 B11R1.16 OC(CCCl)C1=CC=CC=C1 MC20313 [0,1,0,0,0,0|0,0,2]=3 152 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC103018 [0,1,0,0,0,0|2,0,1]=4 153 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC427281 [0,1,0,0,0,0|2,0,1]=4 154 B11R1.22 CC(CN)C1=CC=C(O)C=C1 MC116255 [0,1,0,0,0,0|2,0,1]=4 155 B11R1.22 CC1=CC=C(C(=O)CBr)C=N1 MC431197 [0,1,0,0,0,0|2,0,0]=3 156 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 CS22698 [0,1,0,0,0,0|0,0,0]=1 157 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 CS22795 [0,1,0,0,0,0|0,0,0]=1 158 B11R1.22 CCC(=O)C1=CC=C(Cl)N=C1 CS20436 [0,1,0,0,0,0|1,0,0]=2 159 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 CS22846 [0,1,0,0,0,0|0,0,0]=1 160 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 CS15690 [0,1,0,0,0,0|0,0,0]=1 161 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 CS18281 [0,1,0,0,0,0|1,0,1]=3 162 B11R1.22 CNC(=O)C1=CN=C(Cl)C=C1 MC33519 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 CS15303 [0,1,0,0,0,0|1,0,0]=2 164 B11R1.22 COC(=O)C1=CC=C(Br)N=N1 CS15397 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.22 COC(=O)C1=CC=C(C)C=C1 MC40114 [0,1,0,0,0,0|1,0,0]=2 166 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 CS11663 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.22 COC(=O)C1=CC=C(F)C=C1 CS20841 [0,1,0,0,0,0|1,0,0]=2 168 B11R1.22 COC(=O)C1=CC=C(I)C=C1 CS20853 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.22 COC(=O)C1=CC=C(N)C=C1 CS20990 [0,1,0,0,0,0|1,0,0]=2 170 B11R1.22 COC(=O)C1=CC=C(N)N=N1 MC444521 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.22 COC(=O)C1=CC=C(O)C=C1 CS19446 [0,1,0,0,0,0|1,0,0]=2 172 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 CS14052 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.22 COC(=O)C1=CN=C(Br)N=C1 MC442840 [0,1,0,0,0,0|3,0,0]=4 174 B11R1.22 COC(=O)C1=CN=C(C)C=C1 CS10875 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 CS11603 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.22 COC(=O)C1=CN=C(F)C=C1 CS13697 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.22 COC(=O)C1=CN=C(N)C=C1 CS14193 [0,1,0,0,0,0|2,0,0]=3 178 B11R1.22 COC(=O)C1=CN=C(N)N=C1 CS12441 [0,1,0,0,0,0|3,0,0]=4 179 B11R1.22 COC(=O)C1=CN=C(O)C=C1 CS19248 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.22 COC(=O)C1=CNC(=O)N=C1 MC443636 [0,1,0,0,0,0|3,0,0]=4 181 B11R1.22 COC(=O)C1=COC(=O)C=C1 CS19181 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 CS14099 [0,1,0,0,0,0|2,0,0]=3 183 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 CS12346 [0,1,0,0,0,0|3,0,0]=4 184 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 CS11655 [0,1,0,0,0,0|3,0,0]=4 185 B11R1.22 COC(=O)C1=NC=C(C)C=C1 CS15553 [0,1,0,0,0,0|2,0,0]=3 186 B11R1.22 COC(=O)C1=NC=C(C)C=N1 MC115976 [0,1,0,0,0,0|3,0,0]=4 187 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 CS14158 [0,1,0,0,0,0|3,0,0]=4 188 B11R1.22 COC(=O)C1=NC=C(F)C=C1 CS16224 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.22 COC(=O)C1=NC=C(N)C=C1 CS21755 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.22 COC(=O)C1=NC=C(N)C=N1 MC103762 [0,1,0,0,0,0|3,0,0]=4 191 B11R1.22 COC(=O)C1=NC=C(N)C=N1 MC115672 [0,1,0,0,0,0|3,0,0]=4 192 B11R1.22 COC(=O)C1=NC=C(N)N=C1 MC444546 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.22 COC(=O)C1=NC=C(O)C=C1 CS10406 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.22 COC(=O)C1=NC=C(O)N=C1 CS19747 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.22 COC(=O)C1=NNC(=O)C=C1 CS13480 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.22 FC1=CC=C(C(Br)CBr)C=C1 MC430994 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 CS10839 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 CS20894 [0,1,0,0,0,0|1,0,0]=2 199 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 MC431262 [0,1,0,0,0,0|1,0,2]=4 200 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 MC33165 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 MC20179 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 MC41002 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 MC41004 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 MC41003 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.22 NNC(=O)C1=CNC(=O)C=C1 CS18702 [0,1,0,0,0,0|3,0,0]=4 206 B11R1.22 NNC(=O)C1=NC=C(F)C=C1 CS16150 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.22 N\C(=N/O)C1=CC=C(Br)C=C1 MC428196 [0,1,0,0,0,0|3,0,0]=4 208 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 MC41822 [0,1,0,0,0,0|3,0,0]=4 209 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 CS19445 [0,1,0,0,0,0|1,0,0]=2 210 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 MC433210 [0,1,0,0,0,0|1,0,0]=2 211 B11R1.22 O=C(CBr)C1=CC=C(Cl)N=N1 MC431152 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 CS20678 [0,1,0,0,0,0|1,0,0]=2 213 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 CS10771 [0,1,0,0,0,0|1,0,0]=2 214 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 CS14324 [0,1,0,0,0,0|1,0,0]=2 215 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 MC41236 [0,1,0,0,0,0|1,0,0]=2 216 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 CS15989 [0,1,0,0,0,0|1,0,1]=3 217 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 MC427408 [0,1,0,0,0,0|1,0,1]=3 218 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 CS20192 [0,1,0,0,0,0|1,0,1]=3 219 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 CS18120 [0,1,0,0,0,0|1,0,1]=3 220 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 MC442284 [0,1,0,0,0,0|1,0,2]=4 221 B11R1.23 CCC(=O)C1=CC(Br)=CC=C1 MC41278 [0,1,0,0,0,0|0,0,0]=1 222 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 MC41280 [0,1,0,0,0,0|0,0,0]=1 223 B11R1.23 CCC(=O)C1=CC(F)=CC=C1 MC41284 [0,1,0,0,0,0|0,0,0]=1 224 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 MC433258 [0,1,0,0,0,0|0,0,0]=1 225 B11R1.23 CCC(N)C1=CC(Br)=CN=C1 MC112156 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 CS18168 [0,1,0,0,0,0|2,0,0]=3 227 B11R1.23 COC(=O)C1=CC(=O)NC=C1 CS11585 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.23 COC(=O)C1=CC(Br)=CC=C1 CS20038 [0,1,0,0,0,0|1,0,0]=2 229 B11R1.23 COC(=O)C1=CC(C)=CC=C1 MC40113 [0,1,0,0,0,0|1,0,0]=2 230 B11R1.23 COC(=O)C1=CC(Cl)=CC=C1 CS11622 [0,1,0,0,0,0|1,0,0]=2 231 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 CS18382 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.23 COC(=O)C1=CC(F)=CC=C1 MC40102 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.23 COC(=O)C1=CC(I)=CC=C1 CS19204 [0,1,0,0,0,0|1,0,0]=2 234 B11R1.23 COC(=O)C1=CC(N)=CC=C1 MC40055 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.23 COC(=O)C1=CC(N)=NC=C1 CS19528 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.23 COC(=O)C1=CC(N)=NC=C1 MC442551 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.23 COC(=O)C1=CC(O)=CC=C1 CS13404 [0,1,0,0,0,0|1,0,0]=2 238 B11R1.23 COC(=O)C1=CC(S)=CC=C1 MC100369 [0,1,0,0,0,0|1,0,0]=2 239 B11R1.23 COC(=O)C1=CC(S)=NC=C1 MC430617 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.23 COC(=O)C1=CC=CC(=O)N1 CS15010 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 CS10403 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.23 COC(=O)C1=CN=CC(C)=C1 CS11660 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.23 COC(=O)C1=CN=CC(N)=C1 CS18261 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.23 COC(=O)C1=CN=CC(O)=C1 CS11658 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.23 COC(=O)C1=CN=NC(Cl)=C1 CS12304 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.23 COC(=O)C1=NC(Br)=CC=C1 CS18917 [0,1,0,0,0,0|2,0,0]=3 247 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 CS12870 [0,1,0,0,0,0|3,0,0]=4 248 B11R1.23 COC(=O)C1=NC(Br)=NC=C1 CS15709 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.23 COC(=O)C1=NC(C)=CC=C1 CS12275 [0,1,0,0,0,0|2,0,0]=3 250 B11R1.23 COC(=O)C1=NC(C)=CN=C1 MC110937 [0,1,0,0,0,0|3,0,0]=4 251 B11R1.23 COC(=O)C1=NC(C)=NC=C1 CS15096 [0,1,0,0,0,0|3,0,0]=4 252 B11R1.23 COC(=O)C1=NC(Cl)=CC=C1 CS10671 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.23 COC(=O)C1=NC(Cl)=CN=C1 CS12231 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 CS12287 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.23 COC(=O)C1=NC(N)=CC=C1 CS10610 [0,1,0,0,0,0|2,0,0]=3 256 B11R1.23 COC(=O)C1=NC(N)=NC=C1 CS15550 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 CS18223 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.23 COC(=O)C1=NC=CC(Br)=N1 MC431545 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.23 COC(=O)C1=NC=CC(C)=C1 MC431617 [0,1,0,0,0,0|2,0,0]=3 260 B11R1.23 COC(=O)C1=NC=CC(C)=N1 CS12268 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 CS14005 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.23 COC(=O)C1=NC=CC(Cl)=N1 MC431559 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.23 COC(=O)C1=NC=CC(F)=C1 MC430081 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.23 NC(CO)C1=CC(I)=CC=C1 MC103511 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.23 NCC(O)C1=CC(Br)=CC=C1 MC111476 [0,1,0,0,0,0|1,0,2]=4 266 B11R1.23 NNC(=O)C1=CC(F)=CC=C1 MC429588 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.23 O=C(CBr)C1=CC(Br)=CC=C1 MC41245 [0,1,0,0,0,0|1,0,0]=2 268 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 CS19056 [0,1,0,0,0,0|1,0,0]=2 269 B11R1.23 O=C(CBr)C1=CC(Cl)=NC=C1 MC431210 [0,1,0,0,0,0|2,0,0]=3 270 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 CS15383 [0,1,0,0,0,0|1,0,0]=2 271 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 MC433217 [0,1,0,0,0,0|1,0,0]=2 272 B11R1.23 O=C(CCl)C1=CC(Cl)=CC=C1 MC20163 [0,1,0,0,0,0|1,0,0]=2 273 B11R1.23 O=C(OO)C1=CC(Cl)=CC=C1 MC20584 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.23 OC(CBr)C1=CC(Br)=CC=C1 MC111475 [0,1,0,0,0,0|1,0,2]=4 275 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 CS19083 [0,1,0,0,0,0|2,0,1]=4 276 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 MC443670 [0,1,0,0,0,0|0,0,0]=1 277 B11R1.36 CC(C)C(=O)C1=CC=CN=C1 MC429968 [0,1,0,0,0,0|1,0,0]=2 278 B11R1.36 O=C(C1=NC=CC=C1)C(F)F MC442749 [0,1,0,0,0,0|2,0,0]=3 279 B11R1.222 CC(CO)C1=C(Cl)C=CC=C1 MC111290 [0,1,0,0,0,0|2,0,1]=4 280 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 CS15813 [0,1,0,0,0,0|0,0,0]=1 281 B11R1.222 CCC(=O)C1=C(N)C=CC=C1 MC430440 [0,1,0,0,0,0|0,0,0]=1 282 B11R1.222 CCC(=O)C1=CC=CN=C1N MC429975 [0,1,0,0,0,0|1,0,0]=2 283 B11R1.222 CCC(C)C1=C(N)C=CC=C1 CS21765 [0,1,0,0,0,0|1,0,1]=3 284 B11R1.222 CCC(N)C1=C(C)C=CC=C1 CS14530 [0,1,0,0,0,0|1,0,1]=3 285 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 CS20442 [0,1,0,0,0,0|1,0,0]=2 286 B11R1.222 CNC(=O)C1=C(S)C=CC=C1 MC42220 [0,1,0,0,0,0|1,0,0]=2 287 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 MC20192 [0,1,0,0,0,0|1,0,0]=2 288 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 CS22176 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.222 COC(=O)C1=C(C)C=NC=C1 MC121213 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.222 COC(=O)C1=C(C)N=CC=C1 CS21004 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.222 COC(=O)C1=C(Cl)N=CC=C1 CS20210 [0,1,0,0,0,0|2,0,0]=3 292 B11R1.222 COC(=O)C1=C(F)C=CC=C1 CS11605 [0,1,0,0,0,0|1,0,0]=2 293 B11R1.222 COC(=O)C1=C(F)N=CC=C1 CS14405 [0,1,0,0,0,0|2,0,0]=3 294 B11R1.222 COC(=O)C1=C(I)C=CC=C1 CS15277 [0,1,0,0,0,0|1,0,0]=2 295 B11R1.222 COC(=O)C1=C(I)C=NC=C1 CS22331 [0,1,0,0,0,0|2,0,0]=3 296 B11R1.222 COC(=O)C1=C(N)C=CC=C1 CS13618 [0,1,0,0,0,0|1,0,0]=2 297 B11R1.222 COC(=O)C1=C(O)C=NC=C1 CS11627 [0,1,0,0,0,0|2,0,0]=3 298 B11R1.222 COC(=O)C1=C(S)C=CC=C1 MC40110 [0,1,0,0,0,0|1,0,0]=2 299 B11R1.222 COC(=O)C1=CC=CN=C1N CS18010 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.222 COC(=O)C1=CC=NNC1=O MC104814 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.222 COC(=O)C1=CN=CC=C1C CS11648 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.222 COC(=O)C1=CN=CC=C1Cl CS15530 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.222 COC(=O)C1=CN=CC=C1Cl MC425389 [0,1,0,0,0,0|2,0,0]=3 304 B11R1.222 COC(=O)C1=CN=CC=C1N CS18774 [0,1,0,0,0,0|2,0,0]=3 305 B11R1.222 COC(=O)C1=CN=CN=C1N CS12825 [0,1,0,0,0,0|3,0,0]=4 306 B11R1.222 COC(=O)C1=CN=CNC1=O CS19080 [0,1,0,0,0,0|3,0,0]=4 307 B11R1.222 COC(=O)C1=CN=NC=C1C MC102128 [0,1,0,0,0,0|3,0,0]=4 308 B11R1.222 COC(=O)C1=NC=CC=C1Br CS12168 [0,1,0,0,0,0|2,0,0]=3 309 B11R1.222 COC(=O)C1=NC=CC=C1F CS19566 [0,1,0,0,0,0|2,0,0]=3 310 B11R1.222 COC(=O)C1=NC=CC=C1I MC431997 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.222 COC(=O)C1=NC=CC=C1N CS22111 [0,1,0,0,0,0|2,0,0]=3 312 B11R1.222 COC(=O)C1=NC=CC=C1O CS21936 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.222 COC(=O)C1=NC=CN=C1Br CS12415 [0,1,0,0,0,0|3,0,0]=4 314 B11R1.222 COC(=O)C1=NC=CN=C1Cl CS18208 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.222 COC(=O)C1=NC=CN=C1I MC103283 [0,1,0,0,0,0|3,0,0]=4 316 B11R1.222 COC(=O)C1=NC=CN=C1N CS21912 [0,1,0,0,0,0|3,0,0]=4 317 B11R1.222 COC(=O)C1=NC=CN=C1O CS11607 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.222 COC(=O)C1=NC=NC=C1Br CS12520 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 CS15388 [0,1,0,0,0,0|1,0,0]=2 320 B11R1.222 NCC(O)C1=C(F)C=CC=C1 MC431432 [0,1,0,0,0,0|1,0,2]=4 321 B11R1.222 NCC(O)C1=C(I)C=CC=C1 CS17962 [0,1,0,0,0,0|1,0,2]=4 322 B11R1.222 NNC(=O)C1=C(F)C=CC=C1 MC429401 [0,1,0,0,0,0|2,0,0]=3 323 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 CS14555 [0,1,0,0,0,0|1,0,0]=2 324 B11R1.222 O=C(CBr)C1=C(O)C=CC=C1 MC41230 [0,1,0,0,0,0|1,0,0]=2 325 B11R1.222 O=C(NO)C1=C(O)C=CC=C1 CS11942 [0,1,0,0,0,0|2,0,0]=3 326 B11R2.1 BrC1=COC2=C1C=CC=C2 CS20626 [0,0,0,1,0,0|2,0,1]=4 327 B11R2.1 BrC1=NNC2=CC=CC=C21 MC442207 [0,0,0,1,0,0|3,0,0]=4 328 B11R2.1 CC1=CCC2=CC=CC=C12 MC106180 [0,0,0,1,0,0|1,0,1]=3 329 B11R2.1 CC1=CNC2=CC=CC=C12 CS11030 [0,0,0,1,0,0|2,0,1]=4 330 B11R2.1 CC1=COC2=C1C=CC=C2 MC30270 [0,0,0,1,0,0|2,0,1]=4 331 B11R2.1 CC1=NNC2=CC=CC=C21 CS17372 [0,0,0,1,0,0|3,0,0]=4 332 B11R2.1 CC1=NOC2=C1C=CC=C2 CS22352 [0,0,0,1,0,0|3,0,0]=4 333 B11R2.1 ClC1=CNC2=CC=CC=C12 MC427199 [0,0,0,1,0,0|2,0,1]=4 334 B11R2.1 ClC1=COC2=C1C=CC=C2 MC114725 [0,0,0,1,0,0|2,0,1]=4 335 B11R2.1 ClC1=NOC2=C1C=CC=C2 CS19970 [0,0,0,1,0,0|3,0,0]=4 336 B11R2.1 IC1=CSC2=C1C=CC=C2 CS22329 [0,0,0,1,0,0|2,0,1]=4 337 B11R2.1 NC1=CSC2=C1C=CC=C2 CS13998 [0,0,0,1,0,0|2,0,1]=4 338 B11R2.1 NC1=NNC2=CC=CC=C21 CS20708 [0,0,0,1,0,0|3,0,0]=4 339 B11R2.1 NC1=NOC2=C1C=CC=C2 CS20240 [0,0,0,1,0,0|3,0,0]=4 340 B11R2.1 NC1=NSC2=C1C=CC=C2 CS13975 [0,0,0,1,0,0|3,0,0]=4 341 B11R2.1 NC1CCC2=CC=CC=C21 CS16005 [0,0,0,1,0,0|1,0,1]=3 342 B11R2.1 NC1CCC2=CC=CC=C21 CS19275 [0,0,0,1,0,0|1,0,1]=3 343 B11R2.1 NC1CCC2=CC=CC=C21 CS19803 [0,0,0,1,0,0|1,0,1]=3 344 B11R2.1 NC1CCC2=CC=CC=C21 CS20307 [0,0,0,1,0,0|1,0,1]=3 345 B11R2.1 NC1CCC2=CC=CC=C21 MC425841 [0,0,0,1,0,0|1,0,1]=3 346 B11R2.1 O=C1CCC2=CC=CC=C12 CS18668 [0,0,0,1,0,0|0,0,0]=1 347 B11R2.1 O=C1CCC2=CC=CN=C12 CS10816 [0,0,0,1,0,0|1,0,0]=2 348 B11R2.1 O=C1CCC2=NC=CC=C12 CS18212 [0,0,0,1,0,0|1,0,0]=2 349 B11R2.1 O=C1COC2=C1C=CC=C2 CS20787 [0,0,0,1,0,0|1,0,0]=2 350 B11R2.1 O=C1COC2=CC=CN=C12 MC103039 [0,0,0,1,0,0|2,0,0]=3 351 B11R2.1 O=C1COC2=NC=CC=C12 MC441318 [0,0,0,1,0,0|2,0,0]=3 352 B11R2.1 O=C1CSC2=C1C=CC=C2 CS20606 [0,0,0,1,0,0|1,0,0]=2 353 B11R2.1 O=C1NCC2=CC=CC=C12 CS11515 [0,0,0,1,0,0|1,0,0]=2 354 B11R2.1 O=C1NNC2=CC=CC=C12 MC441212 [0,0,0,1,0,0|2,0,0]=3 355 B11R2.1 O=C1NNC2=CC=CN=C12 CS16829 [0,0,0,1,0,0|3,0,0]=4 356 B11R2.1 O=C1NNC2=CN=CC=C12 MC33248 [0,0,0,1,0,0|3,0,0]=4 357 B11R2.1 O=C1NNC2=NC=CC=C12 CS13662 [0,0,0,1,0,0|3,0,0]=4 358 B11R2.1 O=C1NSC2=C1C=CC=C2 CS14057 [0,0,0,1,0,0|2,0,0]=3 359 B11R2.1 O=C1OCC2=CC=CC=C12 CS11853 [0,0,0,1,0,0|1,0,0]=2 360 B11R2.1 O=C1OCC2=NC=CC=C12 CS11423 [0,0,0,1,0,0|2,0,0]=3 361 B11R2.1 O=C1SSC2=C1C=CC=C2 MC428208 [0,0,0,1,0,0|2,0,0]=3 362 B11R2.1 O=S1C=NC2=C1C=CC=C2 MC31232 [0,0,0,1,0,0|2,0,1]=4 363 B11R2.1 OC1=NOC2=C1C=CC=C2 MC442249 [0,0,0,1,0,0|2,0,1]=4 364 B11R2.1 OC1CCC2=CC=CN=C21 CS10573 [0,0,0,1,0,0|1,0,2]=4 365 B11R2.4 NC1CC1C2=CC=CC=C2 MC100890 [0,0,0,1,0,0|2,0,1]=4 366 B11R2.4 NC1CC1C2=CC=CC=C2 MC106461 [0,0,0,1,0,0|2,0,1]=4 367 B11R2.40 BrC1(C2=NC=CC=C2)CC1 MC431657 [0,0,0,1,0,0|2,0,1]=4 368 B11R2.40 NC1(C2=CC=CC=C2)CC1 MC425296 [0,0,0,1,0,0|1,0,1]=3 369 B11R2.40 NC1(C2=NC=CC=C2)CC1 MC115574 [0,0,0,1,0,0|2,0,1]=4 370 B9R1.11 COC(=O)C1=CC=CN1 CS17868 [0,0,0,0,1,0|2,0,0]=3 371 B9R1.11 COC(=O)C1=CC=CO1 CS11606 [0,0,0,0,1,0|2,0,0]=3 372 B9R1.11 COC(=O)C1=CC=NS1 MC106643 [0,0,0,0,1,0|3,0,0]=4 373 B9R1.11 COC(=O)C1=CNC=C1 CS20729 [0,0,0,0,1,0|2,0,0]=3 374 B9R1.11 COC(=O)C1=CNC=N1 CS18794 [0,0,0,0,1,0|3,0,0]=4 375 B9R1.11 COC(=O)C1=CNN=C1 MC425198 [0,0,0,0,1,0|3,0,0]=4 376 B9R1.11 COC(=O)C1=NC=CN1 CS15200 [0,0,0,0,1,0|3,0,0]=4 377 B9R1.11 COC(=O)C1=NNC=C1 CS11588 [0,0,0,0,1,0|3,0,0]=4 378 B9R1.11 O=C(CBr)C1=NC=CS1 CS21325 [0,0,0,0,1,0|3,0,0]=4 379 B11R1.40 CCC(=O)CC1=CC=CC=C1 MC41289 [0,0,0,0,0,1|0,0,0]=1 380 B11R1.40 COC(=O)CC1=CC=CN=N1 MC103761 [0,0,0,0,0,1|3,0,0]=4 381 B11R1.40 COC(=O)CC1=CN=NC=C1 MC101903 [0,0,0,0,0,1|3,0,0]=4 382 B11R1.40 COC(=O)CC1=NC=NC=C1 MC104059 [0,0,0,0,0,1|3,0,0]=4 383 B11R1.40 NC(CO)CC1=CC=CC=C1 CS21216 [0,0,0,0,0,1|2,0,1]=4 384 B11R1.40 NC(CO)CC1=CC=CC=C1 MC425862 [0,0,0,0,0,1|2,0,1]=4 385 B11R1.40 NNC(=O)CC1=CC=NC=C1 CS21751 [0,0,0,0,0,1|3,0,0]=4 386 B11R1.40 O=C(CO)CC1=CC=CC=C1 MC107738 [0,0,0,0,0,1|1,0,0]=2 387 B8R0.6 C\C=C\C=C\C(=O)OC MC446659 [1,0,1,0,0,0|1,0,1]=4 388 B8R1.2 BrCC1=CC=NC=C1 CS22459 [2,0,0,0,0,0|2,0,0]=4 389 B8R1.2 BrCC1=CC=NC=C1 MC111773 [2,0,0,0,0,0|2,0,0]=4 390 B8R1.2 C#CC1=CC=CC=C1 CS19127 [2,0,0,0,0,0|0,0,2]=4 391 B8R1.2 CCC1=CC=CC=C1 MC41556 [2,0,0,0,0,0|0,0,0]=2 392 B8R1.2 CCC1=CC=CN=C1 CS22277 [2,0,0,0,0,0|1,0,0]=3 393 B8R1.2 CCC1=NC=CN=C1 CS21534 [2,0,0,0,0,0|2,0,0]=4 394 B8R1.2 CNC1=CC=CC=C1 CS11792 [2,0,0,0,0,0|1,0,0]=3 395 B8R1.2 CNC1=CC=CN=C1 CS13856 [2,0,0,0,0,0|2,0,0]=4 396 B8R1.2 CNC1=CC=NC=C1 MC41620 [2,0,0,0,0,0|2,0,0]=4 397 B8R1.2 COC1=CC=CC=C1 MC41309 [2,0,0,0,0,0|1,0,0]=3 398 B8R1.2 COC1=CC=CN=C1 CS22348 [2,0,0,0,0,0|2,0,0]=4 399 B8R1.2 COC1=CC=NC=C1 CS19206 [2,0,0,0,0,0|2,0,0]=4 400 B8R1.2 COC1=NC=CC=C1 CS18780 [2,0,0,0,0,0|2,0,0]=4 401 B8R1.2 CSC1=CC=CC=C1 MC439137 [2,0,0,0,0,0|1,0,0]=3 402 B8R1.2 CSC1=NC=CC=C1 MC41628 [2,0,0,0,0,0|2,0,0]=4 403 B8R1.2 ClCC1=CC=CN=C1 CS19291 [2,0,0,0,0,0|2,0,0]=4 404 B8R1.2 ClCC1=NC=CC=C1 CS19289 [2,0,0,0,0,0|2,0,0]=4 405 B8R1.2 ICC1=CC=CC=C1 CS11000 [2,0,0,0,0,0|1,0,0]=3 406 B8R1.2 ICC1=CC=CN=C1 MC430640 [2,0,0,0,0,0|2,0,0]=4 407 B8R1.2 I[Zn]c1ccccc1 MC121332 [2,0,0,0,0,0|2,0,0]=4 408 B8R1.2 N#CC1=CC=CC=C1 MC40623 [2,0,0,0,0,0|1,0,1]=4 409 B8R1.2 N#Cc1ccccc1 CS13696 [2,0,0,0,0,0|1,0,1]=4 410 B8R1.2 NCC1=CC=CC=C1 MC40797 [2,0,0,0,0,0|1,0,0]=3 411 B8R1.2 NCC1=CC=CN=C1 CS14226 [2,0,0,0,0,0|2,0,0]=4 412 B8R1.2 NCC1=CC=NC=C1 CS11906 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.2 NCC1=CC=NC=C1 CS19023 [2,0,0,0,0,0|2,0,0]=4 414 B8R1.2 NNC1=CC=CC=C1 CS15210 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.2 NNC1=CC=CC=C1 MC427075 [2,0,0,0,0,0|2,0,0]=4 416 B8R1.2 O=CC1=CC=CN=N1 MC121079 [2,0,0,0,0,0|2,0,0]=4 417 B8R1.2 O=CC1=CN=CC=C1 CS19090 [2,0,0,0,0,0|1,0,0]=3 418 B8R1.2 O=CC1=CN=CN=C1 CS19643 [2,0,0,0,0,0|2,0,0]=4 419 B8R1.2 O=CC1=CN=NC=C1 MC444362 [2,0,0,0,0,0|2,0,0]=4 420 B8R1.2 O=CC1=NC=CC=C1 CS18610 [2,0,0,0,0,0|1,0,0]=3 421 B8R1.2 O=CC1=NC=CC=N1 MC444571 [2,0,0,0,0,0|2,0,0]=4 422 B8R1.2 O=CC1=NC=CN=C1 CS18375 [2,0,0,0,0,0|2,0,0]=4 423 B8R1.2 O=NC1=CC=CC=C1 MC33163 [2,0,0,0,0,0|1,0,0]=3 424 B8R1.2 OCC1=CC=CC=C1 MC40684 [2,0,0,0,0,0|1,0,0]=3 425 B8R1.2 OCC1=CC=CN=C1 CS22409 [2,0,0,0,0,0|2,0,0]=4 426 B8R1.2 OCC1=CC=NC=C1 CS19163 [2,0,0,0,0,0|2,0,0]=4 427 B8R1.2 OCC1=NC=CC=C1 CS19164 [2,0,0,0,0,0|2,0,0]=4 428 B10R1.13 C=C(C)C1=CC=C(O)C=C1 MC441020 [1,1,0,0,0,0|1,0,0]=3 429 B10R1.13 C=C(C)C1=CN=C(Cl)C=C1 MC107618 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 CS19447 [1,1,0,0,0,0|0,0,0]=2 431 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 CS17999 [1,1,0,0,0,0|1,0,0]=3 432 B10R1.13 CC(=O)C1=CC=C(C)C=C1 CS13558 [1,1,0,0,0,0|0,0,0]=2 433 B10R1.13 CC(=O)C1=CC=C(C)N=N1 MC112296 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 CS20014 [1,1,0,0,0,0|0,0,0]=2 435 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 CS19687 [1,1,0,0,0,0|1,0,0]=3 436 B10R1.13 CC(=O)C1=CC=C(Cl)N=N1 MC104987 [1,1,0,0,0,0|2,0,0]=4 437 B10R1.13 CC(=O)C1=CC=C(F)C=C1 CS14299 [1,1,0,0,0,0|0,0,0]=2 438 B10R1.13 CC(=O)C1=CC=C(F)N=C1 CS16982 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.13 CC(=O)C1=CC=C(N)C=C1 MC20162 [1,1,0,0,0,0|0,0,0]=2 440 B10R1.13 CC(=O)C1=CC=C(O)C=C1 CS22884 [1,1,0,0,0,0|0,0,0]=2 441 B10R1.13 CC(=O)C1=CC=C(O)N=C1 CS12692 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.13 CC(=O)C1=CN=C(C)C=C1 MC428167 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.13 CC(=O)C1=CN=C(C)N=C1 MC444074 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.13 CC(=O)C1=CN=C(N)N=C1 CS17494 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 CS16977 [1,1,0,0,0,0|1,0,0]=3 446 B10R1.13 CC(=O)C1=NC=C(Br)C=N1 CS17050 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.13 CC(=O)C1=NC=C(C)C=C1 MC443649 [1,1,0,0,0,0|1,0,0]=3 448 B10R1.13 CC(=O)C1=NC=C(C)N=C1 MC444078 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 CS16979 [1,1,0,0,0,0|1,0,0]=3 450 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 CS14519 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.13 CC(=O)C1=NC=C(F)C=C1 MC106404 [1,1,0,0,0,0|1,0,0]=3 452 B10R1.13 CC(=O)C1=NC=C(N)C=C1 MC442802 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.13 CC(=O)c1ccc(I)cc1 MC433245 [1,1,0,0,0,0|0,0,0]=2 454 B10R1.13 CC(Br)C1=CC=C(F)C=C1 CS16140 [1,1,0,0,0,0|1,0,1]=4 455 B10R1.13 CC(C)C1=CC=C(Br)C=C1 CS19162 [1,1,0,0,0,0|1,0,1]=4 456 B10R1.13 CC(C)C1=CC=C(N)C=C1 CS22915 [1,1,0,0,0,0|1,0,1]=4 457 B10R1.13 CC(N)C1=CC=C(Br)C=C1 CS10540 [1,1,0,0,0,0|1,0,1]=4 458 B10R1.13 CC(N)C1=CC=C(Br)C=C1 CS20256 [1,1,0,0,0,0|1,0,1]=4 459 B10R1.13 CC(N)C1=CC=C(F)C=C1 CS19253 [1,1,0,0,0,0|1,0,1]=4 460 B10R1.13 CC(N)C1=CC=C(F)C=C1 MC40832 [1,1,0,0,0,0|1,0,1]=4 461 B10R1.13 CC(N)C1=CC=C(F)C=C1 MC429424 [1,1,0,0,0,0|1,0,1]=4 462 B10R1.13 CC(N)C1=CC=C(I)C=C1 MC113505 [1,1,0,0,0,0|1,0,1]=4 463 B10R1.13 CC(N)C1=CC=C(N)C=C1 CS22422 [1,1,0,0,0,0|1,0,1]=4 464 B10R1.13 CC(N)c1ccc(Cl)cc1 MC433903 [1,1,0,0,0,0|1,0,1]=4 465 B10R1.13 CC(O)C1=CC=C(F)C=C1 MC33129 [1,1,0,0,0,0|0,0,2]=4 466 B10R1.13 CC(O)C1=CC=C(N)C=C1 MC40728 [1,1,0,0,0,0|0,0,2]=4 467 B10R1.13 CC1=CC=C(C(=N)N)C=C1 CS20439 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 MC40494 [1,1,0,0,0,0|1,0,0]=3 469 B10R1.13 CC1=CC=C(C(=O)O)C=C1 MC40304 [1,1,0,0,0,0|1,0,0]=3 470 B10R1.13 CC1=CC=C(C(N)=O)C=C1 CS11895 [1,1,0,0,0,0|1,0,0]=3 471 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 CS11896 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.13 CC1=CC=C(S(N)=O)C=C1 CS18822 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS10458 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS17310 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.13 CC1=NC=C(C(=O)O)C=C1 CS20324 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.13 CC1=NC=C(C(N)=O)C=C1 CS18427 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.13 CN(C)C1=CC=C(Br)C=C1 CS15132 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 MC20289 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.13 CN(C)C1=CC=C(I)C=C1 CS16430 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.13 CN(C)C1=CC=C(O)C=C1 CS16528 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.13 CN(C)C1=CC=C(O)C=C1 MC442505 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.13 Cc1ccc(C(C)C)cc1 MC444976 [1,1,0,0,0,0|1,0,1]=4 483 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 MC21022 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 CS20283 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.13 N=C(N)C1=CC=C(F)C=C1 CS18318 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.13 N=C(N)C1=CC=C(N)C=C1 CS21974 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.13 NC(=O)C1=CC=C(F)C=C1 CS10426 [1,1,0,0,0,0|1,0,0]=3 488 B10R1.13 NC(=O)C1=CN=C(N)C=C1 MC425266 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.13 NC(=O)C1=CNC(=O)C=C1 MC427340 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 MC41603 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 MC33351 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.13 NC(=O)C1=NC=C(F)C=C1 CS16336 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.13 NC(=O)C1=NC=C(N)C=C1 CS10223 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.13 NC(=S)C1=CC=C(O)C=C1 CS20343 [1,1,0,0,0,0|1,1,0]=4 495 B10R1.13 NC1=CC=C(C(=O)O)C=C1 MC40224 [1,1,0,0,0,0|1,0,0]=3 496 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 CS22580 [1,1,0,0,0,0|1,0,0]=3 497 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 MC40934 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.13 NC1=CN=C(C(=O)O)C=C1 CS19367 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.13 NC1=NC=C(C(=O)O)C=C1 CS19354 [1,1,0,0,0,0|2,0,0]=4 500 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 MC40440 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 MC40474 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 MC433701 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 CS20082 [1,1,0,0,0,0|1,0,0]=3 504 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 CS15821 [1,1,0,0,0,0|1,0,0]=3 505 B10R1.13 O=C(O)C1=CC=C(F)C=C1 MC40280 [1,1,0,0,0,0|1,0,0]=3 506 B10R1.13 O=C(O)C1=CC=C(I)C=C1 CS20135 [1,1,0,0,0,0|1,0,0]=3 507 B10R1.13 O=C(O)C1=CC=C(O)C=C1 CS22885 [1,1,0,0,0,0|1,0,0]=3 508 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 CS22092 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 CS22101 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.13 O=C(O)C1=CN=C(F)C=C1 CS18891 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.13 O=C(O)C1=CN=C(O)C=C1 CS19189 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 CS22033 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 CS19376 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.13 O=C(O)C1=NC=C(F)C=C1 CS10387 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.13 O=C(O)C1=NC=C(I)C=C1 CS10412 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.13 O=C(O)C1=NC=C(O)C=C1 CS22997 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.13 O=C([O-])C1=CC=C(Br)C=C1 MC40334 [1,1,0,0,0,0|1,0,0]=3 518 B10R1.13 O=C([O-])C1=CC=C(Cl)C=C1 MC40337 [1,1,0,0,0,0|1,0,0]=3 519 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 MC40351 [1,1,0,0,0,0|1,0,0]=3 520 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 CS18786 [1,1,0,0,0,0|2,0,0]=4 521 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 CS22843 [1,1,0,0,0,0|2,0,0]=4 522 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 CS19234 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 MC41207 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.13 O=[N+]([O-])c1ccc(Cl)cc1 MC41577 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.28 CC(C)(C)C1=CC=CC=C1 MC41559 [1,1,0,0,0,0|1,0,1]=4 526 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 MC100403 [1,1,0,0,0,0|1,0,0]=3 527 B10R1.28 CS(=O)(=O)C1=CC=NC=C1 MC33441 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 CS12052 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 CS11135 [1,1,0,0,0,0|1,1,0]=4 530 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 CS10507 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.28 O=P(Cl)(Cl)C1=CC=CC=C1 MC20369 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 CS19698 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 CS18866 [1,1,0,0,0,0|0,0,0]=2 534 B10R1.61 CC(=O)C1=C(C)C=CC=C1 CS19710 [1,1,0,0,0,0|0,0,0]=2 535 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 MC41234 [1,1,0,0,0,0|0,0,0]=2 536 B10R1.61 CC(=O)C1=C(F)C=CC=C1 CS15490 [1,1,0,0,0,0|0,0,0]=2 537 B10R1.61 CC(=O)C1=C(F)C=NC=C1 MC113260 [1,1,0,0,0,0|1,0,0]=3 538 B10R1.61 CC(=O)C1=C(N)C=CC=C1 CS19948 [1,1,0,0,0,0|0,0,0]=2 539 B10R1.61 CC(=O)C1=C(N)C=NC=C1 MC427146 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.61 CC(=O)C1=C(O)C=CC=C1 CS15026 [1,1,0,0,0,0|0,0,0]=2 541 B10R1.61 CC(=O)C1=C(O)C=NC=C1 MC427306 [1,1,0,0,0,0|1,0,0]=3 542 B10R1.61 CC(=O)C1=CC=CN=C1Br CS18506 [1,1,0,0,0,0|1,0,0]=3 543 B10R1.61 CC(=O)C1=CC=CN=C1Cl CS18365 [1,1,0,0,0,0|1,0,0]=3 544 B10R1.61 CC(=O)C1=CC=CN=C1O MC427454 [1,1,0,0,0,0|1,0,0]=3 545 B10R1.61 CC(=O)C1=CN=CN=C1C CS17792 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.61 CC(=O)C1=NC=CC=C1Br CS16209 [1,1,0,0,0,0|1,0,0]=3 547 B10R1.61 CC(=O)C1=NC=CC=C1Cl MC425055 [1,1,0,0,0,0|1,0,0]=3 548 B10R1.61 CC(=O)C1=NC=CC=C1F CS16198 [1,1,0,0,0,0|1,0,0]=3 549 B10R1.61 CC(=O)C1=NC=CC=C1O CS14450 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.61 CC(=O)C1=NC=CN=C1Cl MC444224 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.61 CC(=O)C1=NC=CN=C1N CS15534 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.61 CC(=O)C1=NC=NC=C1Br MC115898 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.61 CC(C)C1=C(Br)C=CC=C1 CS19988 [1,1,0,0,0,0|1,0,1]=4 554 B10R1.61 CC(N)C1=C(Br)C=CC=C1 CS20301 [1,1,0,0,0,0|1,0,1]=4 555 B10R1.61 CC(N)C1=C(F)C=CC=C1 CS20318 [1,1,0,0,0,0|1,0,1]=4 556 B10R1.61 CC(N)C1=C(F)C=CC=C1 MC429423 [1,1,0,0,0,0|1,0,1]=4 557 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 CS13547 [1,1,0,0,0,0|0,0,2]=4 558 B10R1.61 CC(O)C1=C(F)C=CC=C1 CS15513 [1,1,0,0,0,0|0,0,2]=4 559 B10R1.61 CC(O)C1=C(F)C=CC=C1 MC33138 [1,1,0,0,0,0|0,0,2]=4 560 B10R1.61 CC1=C(C(=O)O)C=CC=C1 CS19823 [1,1,0,0,0,0|1,0,0]=3 561 B10R1.61 CC1=C(C(=O)O)C=CC=N1 CS18975 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.61 CC1=C(C(=O)O)C=CN=C1 CS22360 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.61 CC1=C(C(N)=O)C=CC=N1 CS22408 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.61 CC1=C(C(N)=O)C=NC=C1 MC33526 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.61 CC1=C([N+](=O)[O-])C=CC=C1 MC41522 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.61 CC1=CC=CN=C1C(=O)O CS19680 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.61 CC1=CC=NC=C1C(=O)O CS22976 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.61 CC1=CC=NC=C1C(=O)O CS22977 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.61 CN(C)C1=C(Br)C=CC=C1 MC20183 [1,1,0,0,0,0|2,0,0]=4 570 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 MC20288 [1,1,0,0,0,0|2,0,0]=4 571 B10R1.61 CN(C)C1=C(F)C=CC=C1 MC20285 [1,1,0,0,0,0|2,0,0]=4 572 B10R1.61 CN(C)C1=C(O)C=CC=C1 CS14782 [1,1,0,0,0,0|2,0,0]=4 573 B10R1.61 CN(C)C1=CC=CC=C1N CS14204 [1,1,0,0,0,0|2,0,0]=4 574 B10R1.61 Cc1ccccc1C(C)Br MC106119 [1,1,0,0,0,0|1,0,1]=4 575 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 CS20174 [1,1,0,0,0,0|1,0,0]=3 576 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 CS12247 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.61 NC(=O)C1=C(Br)N=CC=C1 CS21404 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.61 NC(=O)C1=C(F)C=CC=C1 MC41021 [1,1,0,0,0,0|1,0,0]=3 579 B10R1.61 NC(=O)C1=C(I)C=CC=C1 MC433808 [1,1,0,0,0,0|1,0,0]=3 580 B10R1.61 NC(=O)C1=C(N)C=NC=C1 CS22071 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.61 NC(=O)C1=C(N)N=CC=C1 CS22407 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.61 NC(=O)C1=C(O)C=CC=C1 CS11941 [1,1,0,0,0,0|1,0,0]=3 583 B10R1.61 NC(=O)C1=CC=CN=C1Cl CS19049 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.61 NC(=O)C1=CN=CC=C1Cl CS22796 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.61 NC(=O)C1=NC=CC=C1N CS18340 [1,1,0,0,0,0|2,0,0]=4 586 B10R1.61 NC1=C(C(=O)O)C=CC=N1 CS21827 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.61 NC1=C(C(=O)O)C=CN=C1 CS17968 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.61 NC1=C(C(=O)O)C=CN=C1 CS21908 [1,1,0,0,0,0|2,0,0]=4 589 B10R1.61 NC1=C([N+](=O)[O-])C=CC=C1 MC40933 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.61 NC1=CC=CN=C1C(=O)O CS17409 [1,1,0,0,0,0|2,0,0]=4 591 B10R1.61 NC1=CC=CN=C1C(=O)O CS19360 [1,1,0,0,0,0|2,0,0]=4 592 B10R1.61 NC1=CC=NC=C1C(=O)O CS21982 [1,1,0,0,0,0|2,0,0]=4 593 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 MC40438 [1,1,0,0,0,0|1,0,0]=3 594 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 MC40472 [1,1,0,0,0,0|1,0,0]=3 595 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 CS19188 [1,1,0,0,0,0|1,0,0]=3 596 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 CS16216 [1,1,0,0,0,0|1,0,0]=3 597 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 CS22916 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.61 O=C(O)C1=C(Br)N=CC=C1 CS22912 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 CS16220 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 CS18848 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.61 O=C(O)C1=C(F)C=CC=C1 CS10366 [1,1,0,0,0,0|1,0,0]=3 602 B10R1.61 O=C(O)C1=C(F)C=NC=C1 CS19033 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.61 O=C(O)C1=C(F)N=CC=C1 CS18890 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.61 O=C(O)C1=C(I)C=CC=C1 CS20137 [1,1,0,0,0,0|1,0,0]=3 605 B10R1.61 O=C(O)C1=C(I)N=CC=C1 MC443233 [1,1,0,0,0,0|2,0,0]=4 606 B10R1.61 O=C(O)C1=C(O)C=CC=C1 MC40289 [1,1,0,0,0,0|1,0,0]=3 607 B10R1.61 O=C(O)C1=C(O)C=NC=C1 CS22995 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.61 O=C(O)C1=C(S)C=CC=C1 MC40297 [1,1,0,0,0,0|1,0,0]=3 609 B10R1.61 O=C(O)C1=CC=CNC1=O CS19183 [1,1,0,0,0,0|2,0,0]=4 610 B10R1.61 O=C(O)C1=CN=CC=C1Br MC10387 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.61 O=C(O)C1=CN=CC=C1Cl CS18850 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.61 O=C(O)C1=CN=CC=C1I MC442349 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.61 O=C(O)C1=CN=CC=C1O CS15271 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.61 O=C(O)C1=NC=CC=C1Br CS22914 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.61 O=C(O)C1=NC=CC=C1Cl CS15072 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.61 O=C(O)C1=NC=CC=C1F CS18754 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.61 O=C(O)C1=NC=CC=C1I CS12162 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.61 O=C(O)C1=NC=CC=C1O CS22996 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.61 O=C([O-])C1=C(Cl)C=CC=C1 MC40335 [1,1,0,0,0,0|1,0,0]=3 620 B10R1.61 O=C([O-])C1=C(F)C=CC=C1 MC40349 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 CS22913 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 CS21724 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.61 O=[N+]([O-])c1ccccc1F MC41584 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.61 O=[N+]([O-])c1ccccc1F MC433531 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.61 O=[N+]([O-])c1ccccc1I MC41585 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 CS14839 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 MC113271 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 CS18865 [1,1,0,0,0,0|0,0,0]=2 629 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 CS18282 [1,1,0,0,0,0|1,0,0]=3 630 B10R1.113 CC(=O)C1=CC(C)=CN=C1 CS16656 [1,1,0,0,0,0|1,0,0]=3 631 B10R1.113 CC(=O)C1=CC(C)=NC=C1 CS18206 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 CS19798 [1,1,0,0,0,0|0,0,0]=2 633 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 MC116273 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.113 CC(=O)C1=CC(F)=CC=C1 CS19067 [1,1,0,0,0,0|0,0,0]=2 635 B10R1.113 CC(=O)C1=CC(F)=CN=C1 MC443199 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.113 CC(=O)C1=CC(I)=CC=C1 MC33049 [1,1,0,0,0,0|0,0,0]=2 637 B10R1.113 CC(=O)C1=CC(N)=CC=C1 CS19441 [1,1,0,0,0,0|0,0,0]=2 638 B10R1.113 CC(=O)C1=CC(O)=CC=C1 CS18681 [1,1,0,0,0,0|0,0,0]=2 639 B10R1.113 CC(=O)C1=CC=CC(C)=C1 CS19159 [1,1,0,0,0,0|0,0,0]=2 640 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 CS17202 [1,1,0,0,0,0|1,0,0]=3 641 B10R1.113 CC(=O)C1=NC(C)=CC=C1 CS18426 [1,1,0,0,0,0|1,0,0]=3 642 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 MC441210 [1,1,0,0,0,0|1,0,0]=3 643 B10R1.113 CC(=O)C1=NC=CC(F)=C1 MC430529 [1,1,0,0,0,0|1,0,0]=3 644 B10R1.113 CC(=O)C1=NC=CC(O)=N1 MC430457 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.113 CC(C)c1cccc(Br)c1 MC433484 [1,1,0,0,0,0|1,0,1]=4 646 B10R1.113 CC(N)C1=CC(F)=CC=C1 CS19312 [1,1,0,0,0,0|1,0,1]=4 647 B10R1.113 CC(N)C1=CC(F)=CC=C1 CS19671 [1,1,0,0,0,0|1,0,1]=4 648 B10R1.113 CC(N)C1=CC(F)=CC=C1 CS20262 [1,1,0,0,0,0|1,0,1]=4 649 B10R1.113 CC(N)C1=CC(F)=CC=C1 MC429421 [1,1,0,0,0,0|1,0,1]=4 650 B10R1.113 CC(N)C1=CC=CC(N)=C1 MC116025 [1,1,0,0,0,0|1,0,1]=4 651 B10R1.113 CC(N)C1=CC=CC(O)=C1 MC431437 [1,1,0,0,0,0|1,0,1]=4 652 B10R1.113 CC(O)C1=CC(Br)=CC=C1 MC40729 [1,1,0,0,0,0|0,0,2]=4 653 B10R1.113 CC(O)C1=CC(F)=CC=C1 MC433887 [1,1,0,0,0,0|0,0,2]=4 654 B10R1.113 CC(O)C1=CC(N)=CC=C1 CS21787 [1,1,0,0,0,0|0,0,2]=4 655 B10R1.113 CC1=CC(C(=O)O)=CN=C1 CS20319 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.113 CC1=CC(C(=O)O)=NC=C1 CS22984 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.113 CC1=CC(C(C)N)=CC=C1 CS17345 [1,1,0,0,0,0|1,0,1]=4 658 B10R1.113 CC1=CC(C(N)=O)=CN=C1 MC33520 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.113 CC1=CC=CC(C(=N)N)=C1 CS20438 [1,1,0,0,0,0|2,0,0]=4 660 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 MC20748 [1,1,0,0,0,0|1,0,0]=3 661 B10R1.113 CC1=CC=CC(C(=O)O)=C1 CS19799 [1,1,0,0,0,0|1,0,0]=3 662 B10R1.113 CC1=CC=CC(C(=O)O)=N1 CS16317 [1,1,0,0,0,0|2,0,0]=4 663 B10R1.113 CC1=CC=CC(C(O)=S)=C1 MC433710 [1,1,0,0,0,0|1,0,1]=4 664 B10R1.113 CC1=NC=CC(C(=O)O)=C1 CS19546 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.113 CN(C)C1=CC(Br)=CC=C1 MC40867 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.113 CN(C)C1=CC(Cl)=CC=C1 MC40885 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.113 N=C(N)C1=CC(Br)=CC=C1 CS20273 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 CS22167 [1,1,0,0,0,0|1,0,0]=3 669 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 CS17785 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.113 NC(=O)C1=CC(N)=CC=C1 MC433795 [1,1,0,0,0,0|1,0,0]=3 671 B10R1.113 NC(=O)C1=CC(N)=CN=C1 CS15231 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.113 NC(=O)C1=CC(N)=NC=C1 MC425286 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 CS19001 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 MC427450 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 MC20489 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.113 NC(=O)C1=NC=CC(N)=C1 MC116216 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.113 NC1=CC(C(=O)O)=CN=C1 CS22022 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.113 NC1=CC(C(=O)O)=NC=C1 CS15431 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 CS22379 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.113 NC1=CC=CC(C(=O)O)=C1 CS13396 [1,1,0,0,0,0|1,0,0]=3 681 B10R1.113 NC1=CC=CC(C(=O)O)=N1 CS19355 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.113 NC1=NC=CC(C(=O)O)=C1 CS23021 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 MC40439 [1,1,0,0,0,0|1,0,0]=3 684 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 MC40449 [1,1,0,0,0,0|1,0,0]=3 685 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 MC40473 [1,1,0,0,0,0|1,0,0]=3 686 B10R1.113 O=C(Cl)C1=NC=CC(O)=C1 MC106015 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 CS15122 [1,1,0,0,0,0|1,0,0]=3 688 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 MC20488 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 CS14882 [1,1,0,0,0,0|1,0,0]=3 690 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 CS18845 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.113 O=C(O)C1=CC(F)=CC=C1 CS10368 [1,1,0,0,0,0|1,0,0]=3 692 B10R1.113 O=C(O)C1=CC(F)=NC=C1 CS18886 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.113 O=C(O)C1=CC(I)=CC=C1 CS10375 [1,1,0,0,0,0|1,0,0]=3 694 B10R1.113 O=C(O)C1=CC(O)=CC=C1 CS19800 [1,1,0,0,0,0|1,0,0]=3 695 B10R1.113 O=C(O)C1=CC(S)=CC=C1 MC20304 [1,1,0,0,0,0|1,0,0]=3 696 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 CS22040 [1,1,0,0,0,0|2,0,0]=4 697 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 CS18852 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.113 O=C(O)C1=CN=CC(F)=C1 CS22934 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.113 O=C(O)C1=CN=CC(O)=C1 CS22067 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 CS22087 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 CS21854 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.113 O=C(O)C1=NC(F)=CC=C1 CS14295 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.113 O=C(O)C1=NC(O)=CC=C1 CS22114 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 CS14122 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 CS14963 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.113 O=C(O)C1=NC=CC(F)=C1 CS17501 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.113 O=C(O)C1=NC=CC(I)=C1 CS17506 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.113 O=C(O)C1=NC=CC(O)=C1 CS22894 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.113 O=C([O-])C1=CC(Cl)=CC=C1 MC40336 [1,1,0,0,0,0|1,0,0]=3 710 B10R1.113 O=C([O-])C1=CC(F)=CC=C1 MC40350 [1,1,0,0,0,0|1,0,0]=3 711 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 MC430296 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 CS20650 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=C1 CS20664 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 CS20684 [1,1,0,0,0,0|2,0,0]=4 715 B10R1.113 O=[N+]([O-])C1=CC=CC(I)=C1 CS19240 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 CS22383 [1,1,0,0,0,0|2,0,0]=4 717 B10R1.1 CC1=CC=C(CCBr)C=C1 CS19977 [1,1,0,0,0,0|1,0,1]=4 718 B10R1.1 CC1=CC=C(CCN)C=C1 CS18979 [1,1,0,0,0,0|1,0,1]=4 719 B10R1.1 CC1=CC=C(CCO)C=C1 MC40744 [1,1,0,0,0,0|1,0,1]=4 720 B10R1.1 CCCC1=CC=C(Br)C=C1 CS10896 [1,1,0,0,0,0|0,0,1]=3 721 B10R1.1 CCOC1=CC=C(Br)C=C1 MC446797 [1,1,0,0,0,0|1,0,0]=3 722 B10R1.1 CCOC1=CC=C(I)C=C1 CS22907 [1,1,0,0,0,0|1,0,0]=3 723 B10R1.1 CCOC1=CC=C(N)C=C1 CS11879 [1,1,0,0,0,0|1,0,0]=3 724 B10R1.1 CCOC1=CN=C(N)C=C1 CS15063 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.1 CCOC1=NC=C(Br)C=C1 CS22026 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.1 CCOC1=NC=C(N)C=C1 CS14713 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.1 CNCC1=CC=C(Br)C=C1 CS19272 [1,1,0,0,0,0|1,0,1]=4 728 B10R1.1 CNCC1=CC=C(C)C=C1 CS11795 [1,1,0,0,0,0|1,0,1]=4 729 B10R1.1 ClC1=CC=C(CCBr)C=C1 CS10835 [1,1,0,0,0,0|1,0,1]=4 730 B10R1.1 ClCCC1=CC=C(Cl)C=C1 MC433885 [1,1,0,0,0,0|1,0,1]=4 731 B10R1.1 FC1=CC=C(CCBr)C=C1 CS10866 [1,1,0,0,0,0|1,0,1]=4 732 B10R1.1 NC1=CC=C(CCO)C=C1 CS13450 [1,1,0,0,0,0|1,0,1]=4 733 B10R1.1 NCCC1=CC=C(Br)C=C1 CS19296 [1,1,0,0,0,0|1,0,1]=4 734 B10R1.1 NCCC1=CC=C(Cl)C=C1 MC40975 [1,1,0,0,0,0|1,0,1]=4 735 B10R1.1 NCCC1=CC=C(F)C=C1 CS13766 [1,1,0,0,0,0|1,0,1]=4 736 B10R1.1 NCCC1=CC=C(N)C=C1 MC33045 [1,1,0,0,0,0|1,0,1]=4 737 B10R1.1 NCCC1=CC=C(O)C=C1 CS22315 [1,1,0,0,0,0|1,0,1]=4 738 B10R1.1 OCCC1=CC=C(Br)C=C1 CS14491 [1,1,0,0,0,0|1,0,1]=4 739 B10R1.1 OCCC1=CC=C(Cl)C=C1 CS22791 [1,1,0,0,0,0|1,0,1]=4 740 B10R1.1 OCCC1=CC=C(F)C=C1 MC33200 [1,1,0,0,0,0|1,0,1]=4 741 B10R1.1 OCCC1=CC=C(I)C=C1 CS12086 [1,1,0,0,0,0|1,0,1]=4 742 B10R1.1 OCCC1=CC=C(O)C=C1 CS20458 [1,1,0,0,0,0|1,0,1]=4 743 B10R1.4 CCOC1=C(Br)C=CC=C1 MC20149 [1,1,0,0,0,0|1,0,0]=3 744 B10R1.4 CCOC1=C(Br)C=NC=C1 MC443330 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.4 CCOC1=C(N)C=CC=C1 CS11823 [1,1,0,0,0,0|1,0,0]=3 746 B10R1.4 CCOC1=C(N)C=CN=C1 MC442472 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.4 CCOC1=C(O)C=CC=C1 MC41194 [1,1,0,0,0,0|1,0,0]=3 748 B10R1.4 CCOC1=CC=CN=C1C MC443397 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.4 CCOC1=CC=CN=C1O MC110935 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.4 CNCC1=C(F)C=CC=C1 MC40828 [1,1,0,0,0,0|1,0,1]=4 751 B10R1.4 COCC1=C(Br)C=CC=C1 MC41399 [1,1,0,0,0,0|1,0,1]=4 752 B10R1.4 NCCC1=C(Br)C=CC=C1 CS15138 [1,1,0,0,0,0|1,0,1]=4 753 B10R1.4 NCCC1=C(F)C=CC=C1 CS14793 [1,1,0,0,0,0|1,0,1]=4 754 B10R1.4 NCCC1=C(N)C=CC=C1 CS15970 [1,1,0,0,0,0|1,0,1]=4 755 B10R1.4 OC1=C(CCI)C=CC=C1 MC430321 [1,1,0,0,0,0|1,0,1]=4 756 B10R1.4 OCCC1=C(Br)C=CC=C1 CS21407 [1,1,0,0,0,0|1,0,1]=4 757 B10R1.4 OCCC1=C(Cl)C=CC=C1 MC40737 [1,1,0,0,0,0|1,0,1]=4 758 B10R1.4 OCCC1=C(F)C=CC=C1 MC33149 [1,1,0,0,0,0|1,0,1]=4 759 B10R1.4 O\N=C\C1=C(F)C=CC=C1 MC106948 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.4 O\N=C\C1=C(F)C=CC=C1 MC433456 [1,1,0,0,0,0|2,0,0]=4 761 B10R1.10 CC1=CC(CCO)=CC=C1 CS22372 [1,1,0,0,0,0|1,0,1]=4 762 B10R1.10 CCCc1cccc(F)c1 MC440476 [1,1,0,0,0,0|0,0,1]=3 763 B10R1.10 CCNC1=NC=CC(N)=C1 CS14774 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.10 CCOC1=CC(Br)=NC=C1 MC430483 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.10 CCOC1=CC(N)=NC=C1 MC20309 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.10 CCOC1=CC=CC(N)=N1 MC33459 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.10 CCOC1=CN=CC(Br)=C1 MC107004 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.10 CCOC1=CN=CC(Cl)=C1 MC443271 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.10 CCOC1=NC=CC(Cl)=C1 MC113277 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.10 FC1=CC=CC(CCBr)=C1 MC40572 [1,1,0,0,0,0|1,0,1]=4 771 B10R1.10 NC1=CC=CC(CCO)=C1 CS22105 [1,1,0,0,0,0|1,0,1]=4 772 B10R1.10 NCCC1=CC(Br)=CC=C1 CS15159 [1,1,0,0,0,0|1,0,1]=4 773 B10R1.10 NCCC1=CC(F)=CC=C1 MC40979 [1,1,0,0,0,0|1,0,1]=4 774 B10R1.10 OCCC1=CC(Br)=CC=C1 CS22186 [1,1,0,0,0,0|1,0,1]=4 775 B10R1.10 OCCC1=CC(Cl)=CC=C1 CS22241 [1,1,0,0,0,0|1,0,1]=4 776 B10R1.10 OCCC1=CC(F)=CC=C1 MC40743 [1,1,0,0,0,0|1,0,1]=4 777 B10R1.17 BrCCOC1=CC=CC=C1 MC20150 [1,1,0,0,0,0|1,0,0]=3 778 B10R1.17 Br[Zn]CCc1ccccc1 MC121341 [1,1,0,0,0,0|1,0,1]=4 779 B10R1.17 CNCCC1=CC=CC=C1 MC446670 [1,1,0,0,0,0|0,0,1]=3 780 B10R1.17 ClCCOC1=CC=CC=C1 MC33174 [1,1,0,0,0,0|1,0,0]=3 781 B10R1.17 ClC\C=C\C1=CC=CC=C1 MC41818 [1,1,0,0,0,0|0,0,1]=3 782 B10R1.17 NCCCC1=CC=NC=C1 MC425564 [1,1,0,0,0,0|1,0,1]=4 783 B10R1.17 NCCNC1=NC=CC=C1 CS11746 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.17 NCCOC1=CC=CC=C1 CS20484 [1,1,0,0,0,0|1,0,0]=3 785 B10R1.17 NCCOC1=CC=CN=C1 CS16368 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.17 OCCCC1=CC=NC=C1 CS22019 [1,1,0,0,0,0|1,0,1]=4 787 B10R1.17 OCCOC1=CC=CC=C1 MC41398 [1,1,0,0,0,0|1,0,0]=3 788 B10R1.18 BrC(Br)=CC1=CC=CC=C1 CS16193 [1,1,0,0,0,0|1,0,1]=4 789 B10R1.18 CC(=O)NC1=CC=CC=C1 MC34102 [1,1,0,0,0,0|1,0,1]=4 790 B10R1.18 CC(Br)CC1=CC=CC=C1 MC41813 [1,1,0,0,0,0|0,0,1]=3 791 B10R1.18 CC(C)NC1=CC=CC=C1 CS11787 [1,1,0,0,0,0|1,0,0]=3 792 B10R1.18 CC(C)OC1=CC=CC=C1 MC41360 [1,1,0,0,0,0|1,0,0]=3 793 B10R1.18 FC(F)OC1=CC=CC=C1 MC41385 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.18 FC(F)SC1=CC=CC=C1 MC428027 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.11 CCOC(=O)C1=CC=CN1 CS10538 [0,1,0,0,1,0|1,0,0]=3 796 B10R1.11 CCOC(=O)C1=CC=CO1 MC10319 [0,1,0,0,1,0|1,0,0]=3 797 B10R1.11 CCOC(=O)C1=CC=CS1 CS14077 [0,1,0,0,1,0|1,0,0]=3 798 B10R1.11 CCOC(=O)C1=CN=CO1 CS17742 [0,1,0,0,1,0|2,0,0]=4 799 B10R1.11 CCOC(=O)C1=CN=CS1 CS11320 [0,1,0,0,1,0|2,0,0]=4 800 B10R1.11 CCOC(=O)C1=CNC=C1 MC115913 [0,1,0,0,1,0|1,0,0]=3 801 B10R1.11 CCOC(=O)C1=CNC=N1 CS18895 [0,1,0,0,1,0|2,0,0]=4 802 B10R1.11 CCOC(=O)C1=CNN=C1 CS10111 [0,1,0,0,1,0|2,0,0]=4 803 B10R1.11 CCOC(=O)C1=COC=N1 CS18179 [0,1,0,0,1,0|2,0,0]=4 804 B10R1.11 CCOC(=O)C1=CSC=C1 CS10526 [0,1,0,0,1,0|1,0,0]=3 805 B10R1.11 CCOC(=O)C1=NC=CN1 CS18245 [0,1,0,0,1,0|2,0,0]=4 806 B10R1.11 CCOC(=O)C1=NNC=C1 CS20723 [0,1,0,0,1,0|2,0,0]=4 807 B10R1.14 CCC(=O)C1=CC=C(C)O1 MC41697 [0,1,0,0,1,0|1,0,0]=3 808 B10R1.14 COC(=O)C1=CC(Br)=CN1 CS16309 [0,1,0,0,1,0|2,0,0]=4 809 B10R1.14 COC(=O)C1=CC(Br)=CO1 CS11686 [0,1,0,0,1,0|2,0,0]=4 810 B10R1.14 COC(=O)C1=CC(Br)=CS1 CS11641 [0,1,0,0,1,0|2,0,0]=4 811 B10R1.14 COC(=O)C1=CC(F)=CN1 CS15647 [0,1,0,0,1,0|2,0,0]=4 812 B10R1.14 COC(=O)C1=CC=C(Br)N1 CS13213 [0,1,0,0,1,0|2,0,0]=4 813 B10R1.14 COC(=O)C1=CC=C(Br)O1 CS19025 [0,1,0,0,1,0|2,0,0]=4 814 B10R1.14 COC(=O)C1=CC=C(Br)S1 CS10309 [0,1,0,0,1,0|2,0,0]=4 815 B10R1.14 COC(=O)C1=CC=C(Cl)O1 MC41693 [0,1,0,0,1,0|2,0,0]=4 816 B10R1.14 COC(=O)C1=CC=C(Cl)S1 CS17193 [0,1,0,0,1,0|2,0,0]=4 817 B10R1.14 COC(=O)C1=CNC(Br)=C1 MC428134 [0,1,0,0,1,0|2,0,0]=4 818 B10R1.14 COC(=O)C1=CSC(Br)=C1 MC441052 [0,1,0,0,1,0|2,0,0]=4 819 B10R1.149 COC(=O)C1=C(Br)C=CS1 CS19022 [0,1,0,0,1,0|2,0,0]=4 820 B10R1.149 COC(=O)C1=C(Br)SC=C1 CS14695 [0,1,0,0,1,0|2,0,0]=4 821 B10R1.149 COC(=O)C1=C(C)C=CS1 MC20532 [0,1,0,0,1,0|2,0,0]=4 822 B10R1.149 COC(=O)C1=C(C)SC=C1 CS12807 [0,1,0,0,1,0|2,0,0]=4 823 B10R1.149 COC(=O)C1=C(Cl)C=CN1 MC102125 [0,1,0,0,1,0|2,0,0]=4 824 B10R1.149 COC(=O)C1=C(F)C=CS1 MC430932 [0,1,0,0,1,0|2,0,0]=4 825 B10R1.149 COC(=O)C1=C(I)C=CS1 MC431931 [0,1,0,0,1,0|2,0,0]=4 826 B10R1.149 COC(=O)C1=C(N)C=CO1 CS12425 [0,1,0,0,1,0|2,0,0]=4 827 B10R1.149 COC(=O)C1=C(N)C=CS1 CS18173 [0,1,0,0,1,0|2,0,0]=4 828 B10R1.149 COC(=O)C1=C(N)SC=C1 CS19504 [0,1,0,0,1,0|2,0,0]=4 829 B10R1.149 COC(=O)C1=C(O)C=CN1 MC106838 [0,1,0,0,1,0|2,0,0]=4 830 B10R1.149 COC(=O)C1=CC=CN1N CS15888 [0,1,0,0,1,0|2,0,0]=4 831 B10R1.149 COC(=O)C1=CSC=C1Br CS16469 [0,1,0,0,1,0|2,0,0]=4 832 B12R1.32 CCNC(=S)NC1=CC=CC=C1 MC427354 [0,1,0,0,0,1|0,1,0]=3 833 B12R1.32 CCOC(=O)CC1=NC=CC=C1 MC41619 [0,1,0,0,0,1|1,0,0]=3 834 B12R1.32 CCOC(=O)CC1=NC=CC=N1 CS12227 [0,1,0,0,0,1|2,0,0]=4 835 B12R1.32 CN(CCO)CC1=CC=CC=C1 CS11755 [0,1,0,0,0,1|2,0,0]=4 836 B12R1.32 N#CCC(=O)NC1=CC=CC=C1 MC40795 [0,1,0,0,0,1|0,0,1]=3 837 B12R1.34 CN(C(=O)CN)C1=CC=CC=C1 MC111794 [0,1,0,0,0,1|1,0,0]=3 838 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 MC20896 [0,1,0,0,0,1|1,0,0]=3 839 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 CS13901 [0,1,0,0,0,1|1,0,0]=3 840 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 CS21181 [0,1,0,0,0,1|1,0,0]=3 841 B12R1.34 COC(=O)C(N)C1=NC=CC=C1 CS17643 [0,1,0,0,0,1|2,0,0]=4 842 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 CS18861 [0,1,0,0,0,1|1,0,0]=3 843 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 CS21098 [0,1,0,0,0,1|1,0,0]=3 844 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 MC33263 [0,1,0,0,0,1|1,0,0]=3 845 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 MC40116 [0,1,0,0,0,1|1,0,0]=3 846 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 MC40088 [0,1,0,0,0,1|1,0,0]=3 847 B12R1.49 COC(=O)CC1=CC=C(F)N=C1 MC429489 [0,1,0,0,0,1|2,0,0]=4 848 B12R1.49 COC(=O)CC1=CC=C(N)N=C1 MC431366 [0,1,0,0,0,1|2,0,0]=4 849 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 CS21113 [0,1,0,0,0,1|1,0,0]=3 850 B12R1.50 C=CC(=O)NC1=CC(N)=CC=C1 MC107629 [0,1,0,0,0,1|0,0,2]=4 851 B12R1.50 CCC(=O)NC1=CC(Br)=CN=C1 MC103001 [0,1,0,0,0,1|1,0,0]=3 852 B12R1.50 CCC(=O)NC1=CC(N)=CC=C1 CS21194 [0,1,0,0,0,1|0,0,0]=2 853 B12R1.50 CCC(C)OC1=CC=CC(O)=C1 MC112599 [0,1,0,0,0,1|1,0,1]=4 854 B12R1.50 COC(=O)CC1=CC(Br)=CC=C1 CS20169 [0,1,0,0,0,1|1,0,0]=3 855 B12R1.50 COC(=O)CC1=CC(F)=CC=C1 MC433952 [0,1,0,0,0,1|1,0,0]=3 856 B12R1.50 COC(=O)CC1=CC(N)=CC=C1 CS15979 [0,1,0,0,0,1|1,0,0]=3 857 B12R1.50 COC(=O)CC1=CC(N)=CC=C1 MC40063 [0,1,0,0,0,1|1,0,0]=3 858 B12R1.50 COC(=O)CC1=CC(O)=CC=C1 CS22324 [0,1,0,0,0,1|1,0,0]=3 859 B12R1.50 NNC(=O)CC1=CC(Br)=CC=C1 MC111969 [0,1,0,0,0,1|2,0,0]=4 860 B12R1.371 COC(=O)CC1=C(Br)C=CC=C1 CS11591 [0,1,0,0,0,1|1,0,0]=3 861 B12R1.371 COC(=O)CC1=C(Cl)C=CC=C1 CS21677 [0,1,0,0,0,1|1,0,0]=3 862 B12R1.371 COC(=O)CC1=C(N)C=CC=C1 CS11582 [0,1,0,0,0,1|1,0,0]=3 863 B12R1.371 COC(=O)CC1=C(O)C=CC=C1 CS20138 [0,1,0,0,0,1|1,0,0]=3 864 B12R1.9 CCC(C)(C)C1=CC=C(O)C=C1 CS15993 [0,2,0,0,0,0|1,0,1]=4 865 B12R1.9 CCS(=O)(=O)C1=CC=C(Br)C=C1 MC429144 [0,2,0,0,0,0|1,0,0]=3 866 B12R1.9 CCS(=O)(=O)C1=CC=C(C)C=C1 MC111842 [0,2,0,0,0,0|1,0,0]=3 867 B12R1.9 CCS(=O)(=O)C1=CC=C(F)C=C1 MC112595 [0,2,0,0,0,0|1,0,0]=3 868 B12R1.9 CCS(=O)(=O)C1=CN=C(Br)C=C1 MC430458 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.9 CCS(=O)(=O)C1=CN=C(Cl)C=C1 CS16397 [0,2,0,0,0,0|2,0,0]=4 870 B12R1.9 CCS(=O)(=O)C1=NC=C(Cl)C=C1 MC31207 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.9 CNS(=O)(=O)C1=CC=C(N)C=C1 CS19588 [0,2,0,0,0,0|2,0,0]=4 872 B12R1.9 COS(=O)(=O)C1=CC=C(C)C=C1 MC445526 [0,2,0,0,0,0|2,0,0]=4 873 B12R1.10 CC[N+](C)(C)C1=CC(O)=CC=C1 CS11300 [0,2,0,0,0,0|2,0,0]=4 874 B12R1.478 CC(C)C(NO)C1=CC=CC=C1 MC107667 [0,2,0,0,0,0|0,0,2]=4 875 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 CS20312 [0,2,0,0,0,0|0,0,1]=3 876 B12R1.478 CCC(C1=CC=CC=C1)=C(Br)Br MC107155 [0,2,0,0,0,0|1,0,0]=3 877 B12R1.478 CNC(C(=O)O)c1ccccc1 MC437936 [0,2,0,0,0,0|1,0,1]=4 878 B12R1.478 CNC(C(=O)O)c1ccccc1 MC437937 [0,2,0,0,0,0|1,0,1]=4 879 B12R1.478 CNC(C(=O)O)c1ccccc1 MC437938 [0,2,0,0,0,0|1,0,1]=4 880 B12R1.478 COC(C(=O)O)c1ccccc1 MC428059 [0,2,0,0,0,0|1,0,1]=4 881 B12R1.478 NCC(C(=O)O)C1=CC=CC=C1 MC105852 [0,2,0,0,0,0|1,0,1]=4 882 B12R1.478 NCC(C(=O)O)C1=CC=CC=C1 MC105853 [0,2,0,0,0,0|1,0,1]=4 883 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 CS11362 [0,2,0,0,0,0|0,0,0]=2 884 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 CS11363 [0,2,0,0,0,0|0,0,0]=2 885 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=N1 CS12305 [0,2,0,0,0,0|2,0,0]=4 886 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 CS21694 [0,2,0,0,0,0|0,0,0]=2 887 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 CS19762 [0,2,0,0,0,0|0,0,0]=2 888 B12R1.16 CCOC(=O)C1=CC=C(N)N=N1 MC425265 [0,2,0,0,0,0|2,0,0]=4 889 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 CS18640 [0,2,0,0,0,0|0,0,0]=2 890 B12R1.16 CCOC(=O)C1=CN=C(Br)C=C1 CS12492 [0,2,0,0,0,0|1,0,0]=3 891 B12R1.16 CCOC(=O)C1=CN=C(C)N=C1 CS11397 [0,2,0,0,0,0|2,0,0]=4 892 B12R1.16 CCOC(=O)C1=CN=C(Cl)C=C1 CS20898 [0,2,0,0,0,0|1,0,0]=3 893 B12R1.16 CCOC(=O)C1=CN=C(Cl)N=C1 CS12296 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.16 CCOC(=O)C1=CN=C(N)N=C1 CS21311 [0,2,0,0,0,0|2,0,0]=4 895 B12R1.16 CCOC(=O)C1=CN=C(O)C=C1 CS18817 [0,2,0,0,0,0|1,0,0]=3 896 B12R1.16 CCOC(=O)C1=NC=C(Br)C=C1 CS19325 [0,2,0,0,0,0|1,0,0]=3 897 B12R1.16 CCOC(=O)C1=NC=C(Br)C=N1 CS12561 [0,2,0,0,0,0|2,0,0]=4 898 B12R1.16 CCOC(=O)C1=NC=C(Br)N=C1 CS12107 [0,2,0,0,0,0|2,0,0]=4 899 B12R1.16 CCOC(=O)C1=NC=C(C)C=C1 CS14696 [0,2,0,0,0,0|1,0,0]=3 900 B12R1.16 CCOC(=O)C1=NC=C(Cl)N=C1 CS16733 [0,2,0,0,0,0|2,0,0]=4 901 B12R1.16 CCOC(=O)C1=NC=C(N)C=C1 MC430639 [0,2,0,0,0,0|1,0,0]=3 902 B12R1.16 CCOC(=O)C1=NC=C(N)N=C1 MC425285 [0,2,0,0,0,0|2,0,0]=4 903 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 CS11969 [0,2,0,0,0,0|0,0,2]=4 904 B12R1.16 Cc1ccc(C(=O)CC#N)nc1 MC430269 [0,2,0,0,0,0|1,0,1]=4 905 B12R1.16 N#CCC(=O)C1=CC=C(Cl)C=C1 CS10944 [0,2,0,0,0,0|0,0,1]=3 906 B12R1.16 N#CCC(=O)C1=CC=C(F)C=C1 MC20625 [0,2,0,0,0,0|0,0,1]=3 907 B12R1.16 NC(CCO)C1=CC=C(Cl)C=C1 CS14753 [0,2,0,0,0,0|1,0,1]=4 908 B12R1.16 NC(CCO)C1=CC=C(F)C=C1 CS19558 [0,2,0,0,0,0|1,0,1]=4 909 B12R1.16 NC(CCO)C1=CC=C(F)C=C1 MC106616 [0,2,0,0,0,0|1,0,1]=4 910 B12R1.16 O=C(CCCl)C1=CC=C(Br)C=C1 MC41277 [0,2,0,0,0,0|0,0,0]=2 911 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 MC433259 [0,2,0,0,0,0|0,0,0]=2 912 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 CS14887 [0,2,0,0,0,0|0,0,0]=2 913 B12R1.17 CC1=CC=CC(C(=O)CC#N)=N1 MC20627 [0,2,0,0,0,0|1,0,1]=4 914 B12R1.17 CCOC(=O)C1=CC(=O)NC=N1 MC106697 [0,2,0,0,0,0|2,0,0]=4 915 B12R1.17 CCOC(=O)C1=CC(Br)=CC=C1 MC40031 [0,2,0,0,0,0|0,0,0]=2 916 B12R1.17 CCOC(=O)C1=CC(Br)=NC=C1 MC20736 [0,2,0,0,0,0|1,0,0]=3 917 B12R1.17 CCOC(=O)C1=CC(Cl)=NC=C1 CS14959 [0,2,0,0,0,0|1,0,0]=3 918 B12R1.17 CCOC(=O)C1=CC(I)=CC=C1 CS11354 [0,2,0,0,0,0|0,0,0]=2 919 B12R1.17 CCOC(=O)C1=CC(N)=CC=C1 MC40025 [0,2,0,0,0,0|0,0,0]=2 920 B12R1.17 CCOC(=O)C1=CC(N)=NC=C1 CS17963 [0,2,0,0,0,0|1,0,0]=3 921 B12R1.17 CCOC(=O)C1=CC(O)=CC=C1 CS11352 [0,2,0,0,0,0|0,0,0]=2 922 B12R1.17 CCOC(=O)C1=CN=CC(Br)=C1 CS22041 [0,2,0,0,0,0|1,0,0]=3 923 B12R1.17 CCOC(=O)C1=CN=CC(F)=C1 MC430707 [0,2,0,0,0,0|1,0,0]=3 924 B12R1.17 CCOC(=O)C1=NC(=O)NC=C1 MC441257 [0,2,0,0,0,0|2,0,0]=4 925 B12R1.17 CCOC(=O)C1=NC(Br)=CC=C1 CS13935 [0,2,0,0,0,0|1,0,0]=3 926 B12R1.17 CCOC(=O)C1=NC(Br)=NC=C1 MC442162 [0,2,0,0,0,0|2,0,0]=4 927 B12R1.17 CCOC(=O)C1=NC(Cl)=CC=C1 CS15548 [0,2,0,0,0,0|1,0,0]=3 928 B12R1.17 CCOC(=O)C1=NC(Cl)=NC=C1 MC441258 [0,2,0,0,0,0|2,0,0]=4 929 B12R1.17 CCOC(=O)C1=NC(N)=CC=C1 CS10611 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.17 CCOC(=O)C1=NC(N)=NC=C1 MC441256 [0,2,0,0,0,0|2,0,0]=4 931 B12R1.17 CCOC(=O)C1=NC=CC(N)=N1 CS12503 [0,2,0,0,0,0|2,0,0]=4 932 B12R1.17 CCOC(=O)C1=NC=NC(Cl)=C1 MC442159 [0,2,0,0,0,0|2,0,0]=4 933 B12R1.17 N#CCC(=O)C1=CC(Br)=CC=C1 MC40793 [0,2,0,0,0,0|0,0,1]=3 934 B12R1.17 N#CCC(=O)C1=CC(Cl)=CC=C1 CS21429 [0,2,0,0,0,0|0,0,1]=3 935 B12R1.17 N#CCC(=O)C1=CC(F)=CC=C1 MC429587 [0,2,0,0,0,0|0,0,1]=3 936 B12R1.17 NC(CCO)C1=CC(Cl)=CC=C1 CS19263 [0,2,0,0,0,0|1,0,1]=4 937 B12R1.30 CCCOC(=O)C1=CC=CC=C1 CS11887 [0,2,0,0,0,0|0,0,0]=2 938 B12R1.30 O=C(C#CCO)C1=CC=CC=C1 MC111021 [0,2,0,0,0,0|0,0,1]=3 939 B12R1.30 O=C(NCCO)C1=CN=CC=C1 CS11709 [0,2,0,0,0,0|1,0,0]=3 940 B12R1.30 O=C(OCCCl)C1=CC=CC=C1 MC40015 [0,2,0,0,0,0|0,0,0]=2 941 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 CS20784 [0,2,0,0,0,0|0,0,0]=2 942 B12R1.107 O=C([O-])CC(=O)C1=CC=CC=C1 CS17400 [0,2,0,0,0,0|0,0,1]=3 943 B12R1.308 CCCC(=O)C1=C(N)C=CC=C1 MC430441 [0,2,0,0,0,0|0,0,0]=2 944 B12R1.308 CCOC(=O)C1=C(Br)C=CC=C1 MC20191 [0,2,0,0,0,0|0,0,0]=2 945 B12R1.308 CCOC(=O)C1=C(Br)C=NC=C1 MC20829 [0,2,0,0,0,0|1,0,0]=3 946 B12R1.308 CCOC(=O)C1=C(Br)N=CC=C1 CS21405 [0,2,0,0,0,0|1,0,0]=3 947 B12R1.308 CCOC(=O)C1=C(C)C=CC=C1 MC40044 [0,2,0,0,0,0|0,0,0]=2 948 B12R1.308 CCOC(=O)C1=C(C)C=CN=N1 MC104552 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.308 CCOC(=O)C1=C(C)N=NC=C1 MC104788 [0,2,0,0,0,0|2,0,0]=4 950 B12R1.308 CCOC(=O)C1=C(Cl)N=CC=C1 CS20897 [0,2,0,0,0,0|1,0,0]=3 951 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 CS11340 [0,2,0,0,0,0|0,0,0]=2 952 B12R1.308 CCOC(=O)C1=C(N)N=CC=C1 CS13612 [0,2,0,0,0,0|1,0,0]=3 953 B12R1.308 CCOC(=O)C1=C(O)C=NC=C1 MC100279 [0,2,0,0,0,0|1,0,0]=3 954 B12R1.308 CCOC(=O)C1=CC=CC=C1O MC34575 [0,2,0,0,0,0|0,0,0]=2 955 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl CS18275 [0,2,0,0,0,0|1,0,0]=3 956 B12R1.308 CCOC(=O)C1=CN=CN=C1Cl CS18296 [0,2,0,0,0,0|2,0,0]=4 957 B12R1.308 CCOC(=O)C1=CN=CN=C1N MC444489 [0,2,0,0,0,0|2,0,0]=4 958 B12R1.308 CCOC(=O)C1=CN=CN=C1O CS18328 [0,2,0,0,0,0|2,0,0]=4 959 B12R1.308 CCOC(=O)C1=CN=CNC1=O CS17889 [0,2,0,0,0,0|2,0,0]=4 960 B12R1.308 CCOC(=O)C1=CN=NC=C1C MC104021 [0,2,0,0,0,0|2,0,0]=4 961 B12R1.308 CCOC(=O)C1=NC=CC=C1F MC432518 [0,2,0,0,0,0|1,0,0]=3 962 B12R1.308 CCOC(=O)C1=NC=CC=C1N CS22110 [0,2,0,0,0,0|1,0,0]=3 963 B12R1.308 CCOC(=O)C1=NC=CN=C1Cl MC444493 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.308 CCOC(=O)C1=NC=NC=C1Br CS13681 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.308 N#CCC(=O)C1=C(Cl)C=CC=C1 CS21428 [0,2,0,0,0,0|0,0,1]=3 966 B12R1.308 N#CCC(=O)C1=C(F)C=CC=C1 MC433794 [0,2,0,0,0,0|0,0,1]=3 967 B12R1.308 O=C(CCCl)C1=C(Cl)C=CC=C1 MC429389 [0,2,0,0,0,0|0,0,0]=2 968 B12R1.5 CCC(=O)C1=CC=C(CC)C=C1 MC433261 [0,2,0,0,0,0|0,0,0]=2 969 B12R1.5 CCC1=CC=C(C(=O)CBr)C=C1 MC442572 [0,2,0,0,0,0|1,0,0]=3 970 B12R1.5 COC(=O)C1=CC=C(C#N)C=C1 CS22286 [0,2,0,0,0,0|1,0,0]=3 971 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 CS21634 [0,2,0,0,0,0|1,0,0]=3 972 B12R1.5 COC(=O)C1=CC=C(CBr)C=C1 CS21991 [0,2,0,0,0,0|1,0,0]=3 973 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 CS18814 [0,2,0,0,0,0|1,0,0]=3 974 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 CS18683 [0,2,0,0,0,0|1,0,0]=3 975 B12R1.5 COC(=O)C1=CN=C(C=O)C=C1 CS11664 [0,2,0,0,0,0|2,0,0]=4 976 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 CS14996 [0,2,0,0,0,0|2,0,0]=4 977 B12R1.5 COC(=O)C1=CN=C(OC)C=C1 CS10880 [0,2,0,0,0,0|2,0,0]=4 978 B12R1.5 COC(=O)C1=NC=C(CO)C=C1 MC431233 [0,2,0,0,0,0|2,0,0]=4 979 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 MC41239 [0,2,0,0,0,0|1,0,0]=3 980 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 CS21179 [0,2,0,0,0,0|1,0,0]=3 981 B12R1.5 N#CC1=CC=C(C(=O)CBr)C=C1 MC426060 [0,2,0,0,0,0|1,0,0]=3 982 B12R1.5 N#CC1=CC=C(C(=O)NN)C=C1 MC443529 [0,2,0,0,0,0|2,0,0]=4 983 B12R1.20 CC(C)S(=O)C1=CC=C(Br)C=C1 CS16783 [0,2,0,0,0,0|1,0,0]=3 984 B12R1.20 CC1=CC=C(C(=O)C(Cl)Cl)C=C1 MC42255 [0,2,0,0,0,0|1,0,0]=3 985 B12R1.20 CN(C)C(=O)C1=NC=C(Br)C=C1 MC33515 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.20 O=C(C1=CC=C(F)C=C1)C(O)O MC33140 [0,2,0,0,0,0|1,0,0]=3 987 B12R1.20 O=C(O)C(=O)C1=CC=C(Cl)C=C1 CS15974 [0,2,0,0,0,0|1,0,1]=4 988 B12R1.367 CC1=C(Br)C=CC(C(=O)CBr)=C1 MC113998 [0,2,0,0,0,0|1,0,0]=3 989 B12R1.367 CCC(=O)C1=CC(F)=C(F)C=C1 MC41281 [0,2,0,0,0,0|0,0,0]=2 990 B12R1.367 CNC(=O)C1=NC(N)=C(Br)C=C1 MC111788 [0,2,0,0,0,0|2,0,0]=4 991 B12R1.367 COC(=O)C1=CC(Br)=C(C)C=C1 CS21663 [0,2,0,0,0,0|1,0,0]=3 992 B12R1.367 COC(=O)C1=CC(Br)=C(I)C=C1 CS22151 [0,2,0,0,0,0|1,0,0]=3 993 B12R1.367 COC(=O)C1=CC(Br)=C(N)C=C1 CS13492 [0,2,0,0,0,0|1,0,0]=3 994 B12R1.367 COC(=O)C1=CC(Br)=C(O)C=C1 CS13829 [0,2,0,0,0,0|1,0,0]=3 995 B12R1.367 COC(=O)C1=CC(C)=C(Br)C=C1 CS13733 [0,2,0,0,0,0|1,0,0]=3 996 B12R1.367 COC(=O)C1=CC(C)=C(Cl)C=C1 CS11642 [0,2,0,0,0,0|1,0,0]=3 997 B12R1.367 COC(=O)C1=CC(C)=C(F)C=C1 CS13467 [0,2,0,0,0,0|1,0,0]=3 998 B12R1.367 COC(=O)C1=CC(C)=C(I)C=C1 MC40109 [0,2,0,0,0,0|1,0,0]=3 999 B12R1.367 COC(=O)C1=CC(C)=C(N)C=C1 CS13862 [0,2,0,0,0,0|1,0,0]=3 1000 B12R1.367 COC(=O)C1=CC(Cl)=C(F)C=C1 CS14199 [0,2,0,0,0,0|1,0,0]=3 1001 B12R1.367 COC(=O)C1=CC(Cl)=C(O)C=C1 MC40083 [0,2,0,0,0,0|1,0,0]=3 1002 B12R1.367 COC(=O)C1=CC(F)=C(Br)C=C1 MC30260 [0,2,0,0,0,0|1,0,0]=3 1003 B12R1.367 COC(=O)C1=CC(F)=C(C)C=C1 CS14385 [0,2,0,0,0,0|1,0,0]=3 1004 B12R1.367 COC(=O)C1=CC(F)=C(Cl)C=C1 CS14421 [0,2,0,0,0,0|1,0,0]=3 1005 B12R1.367 COC(=O)C1=CC(F)=C(F)C=C1 MC40097 [0,2,0,0,0,0|1,0,0]=3 1006 B12R1.367 COC(=O)C1=CC(F)=C(F)N=C1 MC430145 [0,2,0,0,0,0|2,0,0]=4 1007 B12R1.367 COC(=O)C1=CC(F)=C(N)C=C1 CS14018 [0,2,0,0,0,0|1,0,0]=3 1008 B12R1.367 COC(=O)C1=CC(I)=C(C)C=C1 CS19409 [0,2,0,0,0,0|1,0,0]=3 1009 B12R1.367 COC(=O)C1=CC(I)=C(N)C=C1 CS18837 [0,2,0,0,0,0|1,0,0]=3 1010 B12R1.367 COC(=O)C1=CC(I)=C(O)C=C1 CS11645 [0,2,0,0,0,0|1,0,0]=3 1011 B12R1.367 COC(=O)C1=CC(N)=C(Br)C=C1 CS11615 [0,2,0,0,0,0|1,0,0]=3 1012 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 CS10899 [0,2,0,0,0,0|1,0,0]=3 1013 B12R1.367 COC(=O)C1=CC(N)=C(F)C=C1 CS11616 [0,2,0,0,0,0|1,0,0]=3 1014 B12R1.367 COC(=O)C1=CC(N)=C(I)C=C1 CS11618 [0,2,0,0,0,0|1,0,0]=3 1015 B12R1.367 COC(=O)C1=CC(N)=C(N)C=C1 CS20450 [0,2,0,0,0,0|1,0,0]=3 1016 B12R1.367 COC(=O)C1=CC(N)=C(O)C=C1 CS11617 [0,2,0,0,0,0|1,0,0]=3 1017 B12R1.367 COC(=O)C1=CC(O)=C(Br)C=C1 CS11639 [0,2,0,0,0,0|1,0,0]=3 1018 B12R1.367 COC(=O)C1=CC(O)=C(Cl)C=C1 CS15706 [0,2,0,0,0,0|1,0,0]=3 1019 B12R1.367 COC(=O)C1=CC(O)=C(I)C=C1 CS11687 [0,2,0,0,0,0|1,0,0]=3 1020 B12R1.367 COC(=O)C1=CC(O)=C(N)C=C1 CS21024 [0,2,0,0,0,0|1,0,0]=3 1021 B12R1.367 COC(=O)C1=CC(O)=C(O)C=C1 CS20955 [0,2,0,0,0,0|1,0,0]=3 1022 B12R1.367 COC(=O)C1=CC(S)=C(N)C=C1 MC427483 [0,2,0,0,0,0|1,0,0]=3 1023 B12R1.367 COC(=O)C1=CN=C(Br)C(C)=C1 MC443715 [0,2,0,0,0,0|2,0,0]=4 1024 B12R1.367 COC(=O)C1=CN=C(Br)C(F)=C1 MC430144 [0,2,0,0,0,0|2,0,0]=4 1025 B12R1.367 COC(=O)C1=CN=C(Cl)C(Br)=C1 CS15946 [0,2,0,0,0,0|2,0,0]=4 1026 B12R1.367 COC(=O)C1=CN=C(Cl)C(C)=C1 CS17661 [0,2,0,0,0,0|2,0,0]=4 1027 B12R1.367 COC(=O)C1=CN=C(Cl)C(F)=C1 MC429992 [0,2,0,0,0,0|2,0,0]=4 1028 B12R1.367 COC(=O)C1=CN=C(Cl)C(O)=C1 CS17660 [0,2,0,0,0,0|2,0,0]=4 1029 B12R1.367 COC(=O)C1=CN=C(N)C(C)=C1 MC431245 [0,2,0,0,0,0|2,0,0]=4 1030 B12R1.367 COC(=O)C1=COC(=O)C(Br)=C1 CS11621 [0,2,0,0,0,0|2,0,0]=4 1031 B12R1.367 COC(=O)C1=NC(Br)=C(C)C=C1 CS19533 [0,2,0,0,0,0|2,0,0]=4 1032 B12R1.367 COC(=O)C1=NC(C)=C(Br)C=C1 CS16719 [0,2,0,0,0,0|2,0,0]=4 1033 B12R1.367 COC(=O)C1=NC(Cl)=C(Br)C=C1 CS16862 [0,2,0,0,0,0|2,0,0]=4 1034 B12R1.367 COC(=O)C1=NC(Cl)=C(C)C=C1 CS16029 [0,2,0,0,0,0|2,0,0]=4 1035 B12R1.367 COC(=O)C1=NC(Cl)=C(Cl)C=C1 CS16003 [0,2,0,0,0,0|2,0,0]=4 1036 B12R1.367 COC(=O)C1=NC(N)=C(Br)C=C1 MC430945 [0,2,0,0,0,0|2,0,0]=4 1037 B12R1.367 COC(=O)C1=NC(N)=C(N)C=C1 MC112955 [0,2,0,0,0,0|2,0,0]=4 1038 B12R1.367 COC(=O)C1=NC(O)=C(C)C=C1 MC428183 [0,2,0,0,0,0|2,0,0]=4 1039 B12R1.367 COC(=O)C1=NC(O)=C(O)C=C1 MC102411 [0,2,0,0,0,0|2,0,0]=4 1040 B12R1.367 COC(=O)C1=NC=C(Br)C(C)=C1 CS17574 [0,2,0,0,0,0|2,0,0]=4 1041 B12R1.367 COC(=O)C1=NC=C(C)C(Br)=C1 MC432006 [0,2,0,0,0,0|2,0,0]=4 1042 B12R1.367 COC(=O)C1=NC=C(C)C(Cl)=C1 CS16028 [0,2,0,0,0,0|2,0,0]=4 1043 B12R1.367 COC(=O)C1=NC=C(Cl)C(Cl)=C1 CS17982 [0,2,0,0,0,0|2,0,0]=4 1044 B12R1.367 COC(=O)C1=NC=C(N)C(N)=C1 CS16611 [0,2,0,0,0,0|2,0,0]=4 1045 B12R1.367 COC(=O)C1=NC=C(O)C(O)=C1 MC102001 [0,2,0,0,0,0|2,0,0]=4 1046 B12R1.367 NCC(=O)C1=CC(F)=C(Br)C=C1 MC114806 [0,2,0,0,0,0|1,0,0]=3 1047 B12R1.367 O=C(CBr)C1=CC(Cl)=C(Cl)C=C1 MC41226 [0,2,0,0,0,0|1,0,0]=3 1048 B12R1.367 O=C(CBr)C1=CC(F)=C(Br)C=C1 MC114804 [0,2,0,0,0,0|1,0,0]=3 1049 B12R1.367 O=C(CBr)C1=CC(F)=C(F)C=C1 CS20625 [0,2,0,0,0,0|1,0,0]=3 1050 B12R1.367 O=C(CCl)C1=CC(F)=C(Br)C=C1 MC114805 [0,2,0,0,0,0|1,0,0]=3 1051 B12R1.367 O=C(CCl)c1ccc(F)c(F)c1 MC433220 [0,2,0,0,0,0|1,0,0]=3 1052 B12R1.1703 CCC(=O)C1=C(F)C=C(Br)C=C1 MC442253 [0,2,0,0,0,0|0,0,0]=2 1053 B12R1.1703 CNC(=O)C1=C(Br)C=C(F)C=C1 MC41012 [0,2,0,0,0,0|1,0,0]=3 1054 B12R1.1703 CNC(=O)C1=C(F)C=C(Br)C=C1 MC433813 [0,2,0,0,0,0|1,0,0]=3 1055 B12R1.1703 CNC(=O)C1=C(F)C=C(I)C=C1 MC433812 [0,2,0,0,0,0|1,0,0]=3 1056 B12R1.1703 CNC(=O)c1ccc(N)cc1F MC443851 [0,2,0,0,0,0|1,0,0]=3 1057 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)C=C1 CS14759 [0,2,0,0,0,0|1,0,0]=3 1058 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=C1 MC433602 [0,2,0,0,0,0|1,0,0]=3 1059 B12R1.1703 COC(=O)C1=C(Br)C=C(I)C=C1 MC103303 [0,2,0,0,0,0|1,0,0]=3 1060 B12R1.1703 COC(=O)C1=C(Br)N=C(C)C=C1 MC443365 [0,2,0,0,0,0|2,0,0]=4 1061 B12R1.1703 COC(=O)C1=C(C)C=C(Br)C=C1 CS12236 [0,2,0,0,0,0|1,0,0]=3 1062 B12R1.1703 COC(=O)C1=C(C)C=C(F)C=C1 CS15071 [0,2,0,0,0,0|1,0,0]=3 1063 B12R1.1703 COC(=O)C1=C(C)C=C(N)C=C1 CS22283 [0,2,0,0,0,0|1,0,0]=3 1064 B12R1.1703 COC(=O)C1=C(C)C=C(O)C=C1 CS13812 [0,2,0,0,0,0|1,0,0]=3 1065 B12R1.1703 COC(=O)C1=C(C)N=C(N)C=C1 CS16936 [0,2,0,0,0,0|2,0,0]=4 1066 B12R1.1703 COC(=O)C1=C(Cl)C=C(Br)C=C1 CS16949 [0,2,0,0,0,0|1,0,0]=3 1067 B12R1.1703 COC(=O)C1=C(Cl)C=C(F)C=C1 CS19781 [0,2,0,0,0,0|1,0,0]=3 1068 B12R1.1703 COC(=O)C1=C(Cl)C=C(N)C=C1 CS14483 [0,2,0,0,0,0|1,0,0]=3 1069 B12R1.1703 COC(=O)C1=C(Cl)C=C(O)C=C1 CS19702 [0,2,0,0,0,0|1,0,0]=3 1070 B12R1.1703 COC(=O)C1=C(Cl)N=C(Br)C=C1 MC431232 [0,2,0,0,0,0|2,0,0]=4 1071 B12R1.1703 COC(=O)C1=C(F)C=C(Br)C=C1 CS13466 [0,2,0,0,0,0|1,0,0]=3 1072 B12R1.1703 COC(=O)C1=C(F)C=C(C)C=C1 MC429625 [0,2,0,0,0,0|1,0,0]=3 1073 B12R1.1703 COC(=O)C1=C(F)C=C(F)C=C1 CS19771 [0,2,0,0,0,0|1,0,0]=3 1074 B12R1.1703 COC(=O)C1=C(F)C=C(I)C=C1 MC433679 [0,2,0,0,0,0|1,0,0]=3 1075 B12R1.1703 COC(=O)C1=C(F)C=C(N)C=C1 CS18453 [0,2,0,0,0,0|1,0,0]=3 1076 B12R1.1703 COC(=O)C1=C(F)C=C(O)C=C1 CS13813 [0,2,0,0,0,0|1,0,0]=3 1077 B12R1.1703 COC(=O)C1=C(F)N=C(Cl)C=C1 CS17031 [0,2,0,0,0,0|2,0,0]=4 1078 B12R1.1703 COC(=O)C1=C(N)C=C(Br)C=C1 CS13629 [0,2,0,0,0,0|1,0,0]=3 1079 B12R1.1703 COC(=O)C1=C(N)C=C(C)C=C1 CS12400 [0,2,0,0,0,0|1,0,0]=3 1080 B12R1.1703 COC(=O)C1=C(N)C=C(Cl)C=C1 MC20246 [0,2,0,0,0,0|1,0,0]=3 1081 B12R1.1703 COC(=O)C1=C(N)C=C(F)C=C1 MC429410 [0,2,0,0,0,0|1,0,0]=3 1082 B12R1.1703 COC(=O)C1=C(O)C=C(F)C=C1 MC433676 [0,2,0,0,0,0|1,0,0]=3 1083 B12R1.1703 COC(=O)C1=C(O)C=C(N)C=C1 CS21027 [0,2,0,0,0,0|1,0,0]=3 1084 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 CS11594 [0,2,0,0,0,0|1,0,0]=3 1085 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1O CS11643 [0,2,0,0,0,0|1,0,0]=3 1086 B12R1.1703 COC(=O)C1=CN=C(Br)C=C1Cl MC33266 [0,2,0,0,0,0|2,0,0]=4 1087 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1C MC431919 [0,2,0,0,0,0|2,0,0]=4 1088 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1Cl CS15535 [0,2,0,0,0,0|2,0,0]=4 1089 B12R1.1703 COC(=O)C1=CN=C(F)C=C1F MC431866 [0,2,0,0,0,0|2,0,0]=4 1090 B12R1.1703 COC(=O)C1=CN=C(O)C=C1O MC33270 [0,2,0,0,0,0|2,0,0]=4 1091 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C CS17567 [0,2,0,0,0,0|2,0,0]=4 1092 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1Cl CS17200 [0,2,0,0,0,0|2,0,0]=4 1093 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1O CS15641 [0,2,0,0,0,0|2,0,0]=4 1094 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1Br MC106512 [0,2,0,0,0,0|2,0,0]=4 1095 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1N MC431192 [0,2,0,0,0,0|2,0,0]=4 1096 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1O MC102705 [0,2,0,0,0,0|2,0,0]=4 1097 B12R1.1703 COC(=O)C1=NC=C(F)C=C1C MC431705 [0,2,0,0,0,0|2,0,0]=4 1098 B12R1.1703 COC(=O)C1=NC=C(F)C=C1Cl MC432344 [0,2,0,0,0,0|2,0,0]=4 1099 B12R1.1703 O=C(CBr)C1=C(Cl)C=C(Cl)C=C1 MC41224 [0,2,0,0,0,0|1,0,0]=3 1100 B12R1.1703 O=C(CBr)C1=C(F)C=C(Br)C=C1 CS13247 [0,2,0,0,0,0|1,0,0]=3 1101 B12R1.1703 O=C(CBr)C1=C(F)C=C(F)C=C1 MC429429 [0,2,0,0,0,0|1,0,0]=3 1102 B12R1.1703 O=C(CCl)C1=C(F)C=C(F)C=C1 CS10678 [0,2,0,0,0,0|1,0,0]=3 1103 B12R1.1703 O=C(CF)C1=C(O)C=C(Br)C=C1 MC433215 [0,2,0,0,0,0|1,0,0]=3 1104 B12R1.24 CCC(=O)C1=C(Br)C(F)=CC=C1 MC443267 [0,2,0,0,0,0|0,0,0]=2 1105 B12R1.24 CNC(=O)C1=C(C)C(N)=CC=C1 MC442811 [0,2,0,0,0,0|1,0,0]=3 1106 B12R1.24 COC(=O)C1=C(Br)C(C)=CC=C1 CS13594 [0,2,0,0,0,0|1,0,0]=3 1107 B12R1.24 COC(=O)C1=C(C)C(Br)=CC=C1 CS22137 [0,2,0,0,0,0|1,0,0]=3 1108 B12R1.24 COC(=O)C1=C(C)C(C)=CC=C1 MC40100 [0,2,0,0,0,0|1,0,0]=3 1109 B12R1.24 COC(=O)C1=C(C)C(Cl)=NC=C1 MC113400 [0,2,0,0,0,0|2,0,0]=4 1110 B12R1.24 COC(=O)C1=C(C)C(N)=CC=C1 MC40061 [0,2,0,0,0,0|1,0,0]=3 1111 B12R1.24 COC(=O)C1=C(F)C(Br)=CC=C1 CS14449 [0,2,0,0,0,0|1,0,0]=3 1112 B12R1.24 COC(=O)C1=C(F)C(C)=CC=C1 MC433686 [0,2,0,0,0,0|1,0,0]=3 1113 B12R1.24 COC(=O)C1=C(F)C(Cl)=CC=C1 CS16697 [0,2,0,0,0,0|1,0,0]=3 1114 B12R1.24 COC(=O)C1=C(F)C(Cl)=NC=C1 CS20030 [0,2,0,0,0,0|2,0,0]=4 1115 B12R1.24 COC(=O)C1=C(F)C(F)=NC=C1 MC433053 [0,2,0,0,0,0|2,0,0]=4 1116 B12R1.24 COC(=O)C1=C(F)C(N)=CC=C1 MC20871 [0,2,0,0,0,0|1,0,0]=3 1117 B12R1.24 COC(=O)C1=C(N)C(Br)=CC=C1 CS15036 [0,2,0,0,0,0|1,0,0]=3 1118 B12R1.24 COC(=O)C1=C(N)C(C)=CC=C1 CS21163 [0,2,0,0,0,0|1,0,0]=3 1119 B12R1.24 COC(=O)C1=C(N)C(C)=NC=C1 MC104239 [0,2,0,0,0,0|2,0,0]=4 1120 B12R1.24 COC(=O)C1=C(N)C(Cl)=CC=C1 CS10850 [0,2,0,0,0,0|1,0,0]=3 1121 B12R1.24 COC(=O)C1=C(N)C(Cl)=NC=C1 CS18050 [0,2,0,0,0,0|2,0,0]=4 1122 B12R1.24 COC(=O)C1=C(N)C(F)=CC=C1 CS15337 [0,2,0,0,0,0|1,0,0]=3 1123 B12R1.24 COC(=O)C1=C(N)C(N)=CC=C1 MC40092 [0,2,0,0,0,0|1,0,0]=3 1124 B12R1.24 COC(=O)C1=C(N)C(O)=CC=C1 CS14773 [0,2,0,0,0,0|1,0,0]=3 1125 B12R1.24 COC(=O)C1=C(O)C(Br)=CC=C1 CS17379 [0,2,0,0,0,0|1,0,0]=3 1126 B12R1.24 COC(=O)C1=C(O)C(Cl)=CC=C1 CS12991 [0,2,0,0,0,0|1,0,0]=3 1127 B12R1.24 COC(=O)C1=C(O)C(Cl)=NC=C1 MC432365 [0,2,0,0,0,0|2,0,0]=4 1128 B12R1.24 COC(=O)C1=C(O)C(F)=CC=C1 MC433675 [0,2,0,0,0,0|1,0,0]=3 1129 B12R1.24 COC(=O)C1=CN=CC(Br)=C1Cl CS17481 [0,2,0,0,0,0|2,0,0]=4 1130 B12R1.24 COC(=O)C1=NC=CC(Cl)=C1C CS15774 [0,2,0,0,0,0|2,0,0]=4 1131 B12R1.24 COC(=O)C1=NC=CC(Cl)=C1F MC431620 [0,2,0,0,0,0|2,0,0]=4 1132 B12R1.24 NC1=C(C(=O)C=O)C=CC=C1F MC434029 [0,2,0,0,0,0|1,0,1]=4 1133 B12R1.225 CN(C)C(=O)C1=CC(S)=CC=C1 MC107153 [0,2,0,0,0,0|1,0,0]=3 1134 B12R1.354 CCC(=O)C1=C(N)C=CC(Br)=C1 MC443456 [0,2,0,0,0,0|0,0,0]=2 1135 B12R1.354 CCC(=O)C1=C(O)C=CC(F)=C1 MC41283 [0,2,0,0,0,0|0,0,0]=2 1136 B12R1.354 CCC(N)C1=C(F)C=CC(F)=C1 MC107000 [0,2,0,0,0,0|1,0,1]=4 1137 B12R1.354 COC(=O)C1=C(Br)C=CC(Br)=C1 MC30181 [0,2,0,0,0,0|1,0,0]=3 1138 B12R1.354 COC(=O)C1=C(Br)C=CC(Cl)=C1 MC20597 [0,2,0,0,0,0|1,0,0]=3 1139 B12R1.354 COC(=O)C1=C(Br)C=CC(F)=C1 MC433603 [0,2,0,0,0,0|1,0,0]=3 1140 B12R1.354 COC(=O)C1=C(Br)N=CC(Br)=C1 MC432376 [0,2,0,0,0,0|2,0,0]=4 1141 B12R1.354 COC(=O)C1=C(C)C=CC(Br)=C1 CS11654 [0,2,0,0,0,0|1,0,0]=3 1142 B12R1.354 COC(=O)C1=C(C)C=CC(I)=C1 MC425395 [0,2,0,0,0,0|1,0,0]=3 1143 B12R1.354 COC(=O)C1=C(C)C=CC(N)=C1 CS21166 [0,2,0,0,0,0|1,0,0]=3 1144 B12R1.354 COC(=O)C1=C(C)C=CC(O)=C1 MC433698 [0,2,0,0,0,0|1,0,0]=3 1145 B12R1.354 COC(=O)C1=C(C)N=CC(Br)=C1 CS16882 [0,2,0,0,0,0|2,0,0]=4 1146 B12R1.354 COC(=O)C1=C(Cl)C=CC(Br)=C1 MC40067 [0,2,0,0,0,0|1,0,0]=3 1147 B12R1.354 COC(=O)C1=C(Cl)C=CC(N)=C1 CS13095 [0,2,0,0,0,0|1,0,0]=3 1148 B12R1.354 COC(=O)C1=C(Cl)N=CC(Br)=C1 MC20660 [0,2,0,0,0,0|2,0,0]=4 1149 B12R1.354 COC(=O)C1=C(Cl)N=CC(Cl)=C1 CS11595 [0,2,0,0,0,0|2,0,0]=4 1150 B12R1.354 COC(=O)C1=C(Cl)N=CC(N)=C1 MC430594 [0,2,0,0,0,0|2,0,0]=4 1151 B12R1.354 COC(=O)C1=C(Cl)N=CC(O)=C1 MC441023 [0,2,0,0,0,0|2,0,0]=4 1152 B12R1.354 COC(=O)C1=C(F)C=CC(Br)=C1 CS16724 [0,2,0,0,0,0|1,0,0]=3 1153 B12R1.354 COC(=O)C1=C(F)C=CC(F)=C1 MC31131 [0,2,0,0,0,0|1,0,0]=3 1154 B12R1.354 COC(=O)C1=C(F)C=CC(I)=C1 MC433680 [0,2,0,0,0,0|1,0,0]=3 1155 B12R1.354 COC(=O)C1=C(F)C=CC(N)=C1 MC40058 [0,2,0,0,0,0|1,0,0]=3 1156 B12R1.354 COC(=O)C1=C(F)C=CC(O)=C1 MC429613 [0,2,0,0,0,0|1,0,0]=3 1157 B12R1.354 COC(=O)C1=C(F)N=CC(Br)=C1 CS12499 [0,2,0,0,0,0|2,0,0]=4 1158 B12R1.354 COC(=O)C1=C(I)C=CC(Br)=C1 CS12739 [0,2,0,0,0,0|1,0,0]=3 1159 B12R1.354 COC(=O)C1=C(N)C=CC(Br)=C1 CS10841 [0,2,0,0,0,0|1,0,0]=3 1160 B12R1.354 COC(=O)C1=C(N)C=CC(C)=C1 CS12341 [0,2,0,0,0,0|1,0,0]=3 1161 B12R1.354 COC(=O)C1=C(N)C=CC(Cl)=C1 CS20900 [0,2,0,0,0,0|1,0,0]=3 1162 B12R1.354 COC(=O)C1=C(N)C=CC(F)=C1 MC33104 [0,2,0,0,0,0|1,0,0]=3 1163 B12R1.354 COC(=O)C1=C(N)C=CC(I)=C1 CS19327 [0,2,0,0,0,0|1,0,0]=3 1164 B12R1.354 COC(=O)C1=C(N)N=CC(Br)=C1 CS19724 [0,2,0,0,0,0|2,0,0]=4 1165 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=C1 CS11656 [0,2,0,0,0,0|1,0,0]=3 1166 B12R1.354 COC(=O)C1=C(O)C=CC(Cl)=C1 MC427365 [0,2,0,0,0,0|1,0,0]=3 1167 B12R1.354 COC(=O)C1=C(O)C=CC(O)=C1 CS20958 [0,2,0,0,0,0|1,0,0]=3 1168 B12R1.354 COC(=O)C1=C(O)N=CC(C)=C1 MC432223 [0,2,0,0,0,0|2,0,0]=4 1169 B12R1.354 COC(=O)C1=CC(Br)=NC=C1N MC102353 [0,2,0,0,0,0|2,0,0]=4 1170 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1N CS17055 [0,2,0,0,0,0|2,0,0]=4 1171 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1O MC443384 [0,2,0,0,0,0|2,0,0]=4 1172 B12R1.354 COC(=O)C1=CC(N)=NC=C1Br CS12420 [0,2,0,0,0,0|2,0,0]=4 1173 B12R1.354 COC(=O)C1=CC(O)=NC=C1Br CS12235 [0,2,0,0,0,0|2,0,0]=4 1174 B12R1.354 COC(=O)C1=NC(Br)=CC=C1N CS15657 [0,2,0,0,0,0|2,0,0]=4 1175 B12R1.354 COC(=O)C1=NC(Br)=CC=C1O CS16597 [0,2,0,0,0,0|2,0,0]=4 1176 B12R1.354 COC(=O)C1=NC(C)=CC=C1O MC111036 [0,2,0,0,0,0|2,0,0]=4 1177 B12R1.354 COC(=O)C1=NC(Cl)=CC=C1C CS12796 [0,2,0,0,0,0|2,0,0]=4 1178 B12R1.354 COC(=O)C1=NC(Cl)=CC=C1N CS15661 [0,2,0,0,0,0|2,0,0]=4 1179 B12R1.354 COC(=O)C1=NC(F)=CC=C1F MC432234 [0,2,0,0,0,0|2,0,0]=4 1180 B12R1.354 NCC(=O)C1=C(F)C=CC(F)=C1 CS17892 [0,2,0,0,0,0|1,0,0]=3 1181 B12R1.354 O=C(CCl)c1cc(F)ccc1F MC433219 [0,2,0,0,0,0|1,0,0]=3 1182 B12R1.358 CCC(=O)c1cc(Cl)cc(Cl)c1 MC433260 [0,2,0,0,0,0|0,0,0]=2 1183 B12R1.358 COC(=O)C1=CC(Br)=CC(Br)=C1 CS20674 [0,2,0,0,0,0|1,0,0]=3 1184 B12R1.358 COC(=O)C1=CC(Br)=CC(C)=C1 CS14373 [0,2,0,0,0,0|1,0,0]=3 1185 B12R1.358 COC(=O)C1=CC(Br)=CC(I)=C1 MC433610 [0,2,0,0,0,0|1,0,0]=3 1186 B12R1.358 COC(=O)C1=CC(Br)=NC(Br)=C1 MC41621 [0,2,0,0,0,0|2,0,0]=4 1187 B12R1.358 COC(=O)C1=CC(Cl)=NC(C)=C1 CS14289 [0,2,0,0,0,0|2,0,0]=4 1188 B12R1.358 COC(=O)C1=CC(Cl)=NC(Cl)=C1 CS11596 [0,2,0,0,0,0|2,0,0]=4 1189 B12R1.358 COC(=O)C1=CC(F)=CC(F)=C1 MC40098 [0,2,0,0,0,0|1,0,0]=3 1190 B12R1.358 COC(=O)C1=CC(N)=CC(Br)=C1 CS22074 [0,2,0,0,0,0|1,0,0]=3 1191 B12R1.358 COC(=O)C1=CC(N)=CC(C)=C1 CS11619 [0,2,0,0,0,0|1,0,0]=3 1192 B12R1.358 COC(=O)C1=CC(N)=CC(Cl)=C1 CS12426 [0,2,0,0,0,0|1,0,0]=3 1193 B12R1.358 COC(=O)C1=CC(N)=CC(F)=C1 CS13225 [0,2,0,0,0,0|1,0,0]=3 1194 B12R1.358 COC(=O)C1=CC(O)=CC(O)=C1 CS20957 [0,2,0,0,0,0|1,0,0]=3 1195 B12R1.358 COC(=O)C1=NC(C)=CC(C)=C1 MC432026 [0,2,0,0,0,0|2,0,0]=4 1196 B12R1.358 COC(=O)C1=NC(Cl)=CC(Br)=C1 MC111115 [0,2,0,0,0,0|2,0,0]=4 1197 B12R1.358 COC(=O)C1=NC(Cl)=CC(Cl)=C1 CS14945 [0,2,0,0,0,0|2,0,0]=4 1198 B12R1.358 O=C(CBr)C1=CC(Cl)=CC(Cl)=C1 CS16723 [0,2,0,0,0,0|1,0,0]=3 1199 B12R1.358 O=C(CBr)C1=CC(F)=CC(F)=C1 MC31088 [0,2,0,0,0,0|1,0,0]=3 1200 B12R1.435 C#CC1=CC=CC(C(=O)OC)=C1 CS16050 [0,2,0,0,0,0|1,0,0]=3 1201 B12R1.435 C#CC1=CC=CC(C(=O)OC)=N1 MC105758 [0,2,0,0,0,0|2,0,0]=4 1202 B12R1.435 CCC(=O)C1=CC(OC)=CC=C1 CS22346 [0,2,0,0,0,0|0,0,0]=2 1203 B12R1.435 CNC(=O)C1=CC(CN)=CC=C1 MC100301 [0,2,0,0,0,0|1,0,0]=3 1204 B12R1.435 COC(=O)C1=CC(C#N)=CC=C1 CS18708 [0,2,0,0,0,0|1,0,0]=3 1205 B12R1.435 COC(=O)C1=CC(C#N)=NC=C1 CS21510 [0,2,0,0,0,0|2,0,0]=4 1206 B12R1.435 COC(=O)C1=CC(C=O)=CC=C1 CS21632 [0,2,0,0,0,0|1,0,0]=3 1207 B12R1.435 COC(=O)C1=CC(C=O)=NC=C1 CS16859 [0,2,0,0,0,0|2,0,0]=4 1208 B12R1.435 COC(=O)C1=CC(CBr)=CC=C1 CS21662 [0,2,0,0,0,0|1,0,0]=3 1209 B12R1.435 COC(=O)C1=CC(CBr)=NC=C1 CS17850 [0,2,0,0,0,0|2,0,0]=4 1210 B12R1.435 COC(=O)C1=CC(CBr)=NC=C1 MC430896 [0,2,0,0,0,0|2,0,0]=4 1211 B12R1.435 COC(=O)C1=CC(CN)=CC=C1 CS11610 [0,2,0,0,0,0|1,0,0]=3 1212 B12R1.435 COC(=O)C1=CC(CO)=NC=C1 MC105759 [0,2,0,0,0,0|2,0,0]=4 1213 B12R1.435 COC(=O)C1=CC(OC)=NC=C1 CS11608 [0,2,0,0,0,0|2,0,0]=4 1214 B12R1.435 COC(=O)C1=CN=CC(CO)=C1 CS10405 [0,2,0,0,0,0|2,0,0]=4 1215 B12R1.435 COC(=O)C1=NC(CBr)=CC=C1 CS21402 [0,2,0,0,0,0|2,0,0]=4 1216 B12R1.435 COC(=O)C1=NC(OC)=CC=C1 MC425550 [0,2,0,0,0,0|2,0,0]=4 1217 B12R1.435 COC(=O)C1=NC=CC(CBr)=C1 MC429714 [0,2,0,0,0,0|2,0,0]=4 1218 B12R1.435 COC(=O)C1=NC=CC(OC)=C1 CS21029 [0,2,0,0,0,0|2,0,0]=4 1219 B12R1.435 COC(=O)c1cccc(CO)n1 MC434008 [0,2,0,0,0,0|2,0,0]=4 1220 B12R1.435 COC(=O)c1cccc(SCl)c1 MC433971 [0,2,0,0,0,0|1,0,0]=3 1221 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 CS11021 [0,2,0,0,0,0|1,0,0]=3 1222 B12R1.435 COC1=CC=CC(C(=O)NN)=C1 MC41005 [0,2,0,0,0,0|2,0,0]=4 1223 B12R1.435 N#CC1=CC=CC(C(=O)CBr)=C1 CS21406 [0,2,0,0,0,0|1,0,0]=3 1224 B12R1.124 NC1=C(C(=O)C(=O)[O-])C=CC=C1 MC427207 [0,2,0,0,0,0|1,0,1]=4 1225 B12R1.124 O=C(Cl)C(=O)C1=C(Cl)C=CC=C1 MC105996 [0,2,0,0,0,0|1,0,1]=4 1226 B12R1.124 O=C(O)C(=O)C1=C(Br)C=CC=C1 CS16464 [0,2,0,0,0,0|1,0,1]=4 1227 B12R1.564 CC(C)(C)C(N)C1=CC=CC=C1 CS11465 [0,2,0,0,0,0|1,0,1]=4 1228 B12R1.564 CC(C)(O)C(=O)C1=CC=CC=C1 CS15837 [0,2,0,0,0,0|0,0,0]=2 1229 B12R1.564 O=C(C1=CC=CC=C1)C(F)(F)F MC41272 [0,2,0,0,0,0|1,0,0]=3 1230 B12R1.564 O=C(C1=CC=NC=C1)C(F)(F)F MC443231 [0,2,0,0,0,0|2,0,0]=4 1231 B12R1.77 C=CC1=C(C(=O)OC)C=CC=N1 MC429151 [0,2,0,0,0,0|2,0,0]=4 1232 B12R1.77 COC(=O)C1=C(C#N)C=CC=C1 MC40089 [0,2,0,0,0,0|1,0,0]=3 1233 B12R1.77 COC(=O)C1=C(C#N)N=CC=C1 MC33457 [0,2,0,0,0,0|2,0,0]=4 1234 B12R1.77 COC(=O)C1=C(C=O)C=CC=C1 CS21630 [0,2,0,0,0,0|1,0,0]=3 1235 B12R1.77 COC(=O)C1=C(C=O)N=CC=C1 MC431364 [0,2,0,0,0,0|2,0,0]=4 1236 B12R1.77 COC(=O)C1=C(CBr)C=CC=C1 CS18185 [0,2,0,0,0,0|1,0,0]=3 1237 B12R1.77 COC(=O)C1=C(OC)C=NC=C1 MC431681 [0,2,0,0,0,0|2,0,0]=4 1238 B12R1.77 COC(=O)C1=C(OC)N=CC=C1 CS13707 [0,2,0,0,0,0|2,0,0]=4 1239 B12R1.77 COC(=O)C1=CN=CC=C1OC MC425461 [0,2,0,0,0,0|2,0,0]=4 1240 B12R1.77 COC(=O)C1=NC=CC=C1C=O MC102694 [0,2,0,0,0,0|2,0,0]=4 1241 B12R1.77 COC(=O)C1=NC=CC=C1OC CS22344 [0,2,0,0,0,0|2,0,0]=4 1242 B12R1.77 COC1=C(C(=O)CBr)C=CC=C1 CS11020 [0,2,0,0,0,0|1,0,0]=3 1243 B12R1.77 N#CC1=C(C(=O)NN)C=CC=C1 CS16910 [0,2,0,0,0,0|2,0,0]=4 1244 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1C CS12101 [0,2,0,0,0,0|1,0,0]=3 1245 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1F MC433604 [0,2,0,0,0,0|1,0,0]=3 1246 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1C CS21485 [0,2,0,0,0,0|1,0,0]=3 1247 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1F CS16568 [0,2,0,0,0,0|1,0,0]=3 1248 B12R1.3441 COC(=O)C1=C(Cl)C=NC=C1C MC431812 [0,2,0,0,0,0|2,0,0]=4 1249 B12R1.3441 COC(=O)C1=C(Cl)N=CC=C1C MC106351 [0,2,0,0,0,0|2,0,0]=4 1250 B12R1.3441 COC(=O)C1=C(Cl)N=CC=C1Cl CS14126 [0,2,0,0,0,0|2,0,0]=4 1251 B12R1.3441 COC(=O)C1=C(Cl)N=CC=C1I CS18087 [0,2,0,0,0,0|2,0,0]=4 1252 B12R1.3441 COC(=O)C1=C(Cl)N=CC=C1N MC102408 [0,2,0,0,0,0|2,0,0]=4 1253 B12R1.3441 COC(=O)C1=C(F)C=CC=C1C MC31076 [0,2,0,0,0,0|1,0,0]=3 1254 B12R1.3441 COC(=O)C1=C(F)C=CC=C1F MC40096 [0,2,0,0,0,0|1,0,0]=3 1255 B12R1.3441 COC(=O)C1=C(F)C=CC=C1O MC433674 [0,2,0,0,0,0|1,0,0]=3 1256 B12R1.3441 COC(=O)C1=C(F)N=CC=C1I CS19542 [0,2,0,0,0,0|2,0,0]=4 1257 B12R1.3441 COC(=O)C1=C(N)C=CC=C1F MC114607 [0,2,0,0,0,0|1,0,0]=3 1258 B12R1.3441 COC(=O)C1=C(N)C=CC=C1O CS15549 [0,2,0,0,0,0|1,0,0]=3 1259 B12R1.3441 COC(=O)c1c(N)cccc1F MC30212 [0,2,0,0,0,0|1,0,0]=3 1260 B12R1.3441 NNC(=O)C1=C(F)C=CC=C1F MC41001 [0,2,0,0,0,0|2,0,0]=4 1261 B12R1.3441 O=C(CBr)C1=C(Cl)C=CC=C1Cl MC41225 [0,2,0,0,0,0|1,0,0]=3 1262 B12R1.3441 O=C(CBr)C1=C(Cl)C=CC=C1F CS15985 [0,2,0,0,0,0|1,0,0]=3 1263 B12R1.3441 O=C(CBr)C1=C(F)C=CC=C1F MC429635 [0,2,0,0,0,0|1,0,0]=3 1264 B12R1.3441 O=C(CCl)C1=C(F)C=CC=C1F MC431099 [0,2,0,0,0,0|1,0,0]=3 1265 B10R1.20 CCC1=C(C=O)C=CC=C1 MC20141 [0,0,1,1,0,0|2,0,0]=4 1266 B10R1.172 CCC1=CC=CC(C=O)=C1 CS11688 [0,0,1,1,0,0|2,0,0]=4 1267 B10R2.6 C1=CC=C(C2CO2)C=C1 MC20326 [1,0,0,1,0,0|0,0,2]=4 1268 B10R2.6 C1=CC=C(C2CO2)C=C1 MC445226 [1,0,0,1,0,0|0,0,2]=4 1269 B10R2.7 C1=CC2=C(C=C1)CSC2 MC114506 [1,0,0,1,0,0|1,0,1]=4 1270 B10R2.7 C1=CC2=C(C=C1)OCC2 CS20929 [1,0,0,1,0,0|1,0,0]=3 1271 B10R2.7 C1=CC2=C(C=C1)OCO2 CS20505 [1,0,0,1,0,0|2,0,0]=4 1272 B10R2.7 C1=CC2=C(C=C1)SC=C2 CS16362 [1,0,0,1,0,0|1,0,1]=4 1273 B10R2.7 C1=CC=C2CC=CC2=C1 MC20914 [1,0,0,1,0,0|0,0,1]=3 1274 B10R2.7 C1=CC=C2CNCC2=C1 CS11516 [1,0,0,1,0,0|1,0,1]=4 1275 B10R2.7 C1=CC=C2CNCC2=C1 MC442466 [1,0,0,1,0,0|1,0,1]=4 1276 B10R2.7 C1=CC=C2NC=CC2=C1 CS11496 [1,0,0,1,0,0|1,0,1]=4 1277 B10R2.7 C1=CC=C2NCCC2=C1 CS19084 [1,0,0,1,0,0|1,0,0]=3 1278 B10R2.7 C1=CC=C2NN=CC2=C1 CS11488 [1,0,0,1,0,0|2,0,0]=4 1279 B10R2.7 C1=CC=C2OC=CC2=C1 CS11169 [1,0,0,1,0,0|1,0,1]=4 1280 B10R2.7 C1=CN=C2CCCC2=C1 CS14838 [1,0,0,1,0,0|1,0,1]=4 1281 B10R2.7 C1=CN=C2CCNC2=C1 MC107728 [1,0,0,1,0,0|2,0,0]=4 1282 B10R2.7 C1=CN=C2NCCC2=C1 CS21039 [1,0,0,1,0,0|2,0,0]=4 1283 B10R2.32 O=C1CCC2=C1SC=C2 MC429082 [0,0,0,1,1,0|1,0,0]=3 1284 B12R2.18 CC1=CC2=CC=CC=C2N1C CS10010 [0,0,0,1,0,1|2,0,0]=4 1285 B12R2.18 CN1C(=O)NC2=CC=CN=C21 MC427257 [0,0,0,1,0,1|2,0,0]=4 1286 B12R2.18 CN1C(=O)OC2=C1C=CC=C2 MC10211 [0,0,0,1,0,1|1,0,0]=3 1287 B12R2.18 CN1C(N)=CC2=CC=CC=C21 MC106654 [0,0,0,1,0,1|2,0,0]=4 1288 B12R2.18 O=C1NC2=CC=CC=C2C1=O CS11506 [0,0,0,1,0,1|1,0,1]=4 1289 B12R2.23 O=C1CCC1C2=CC=CC=C2 MC104226 [0,0,0,1,0,1|0,0,0]=2 1290 B12R2.24 CN1CCC2=CC=CC=C2C1 CS16157 [0,0,0,1,0,1|2,0,0]=4 1291 B12R2.24 NC1CCC2=CC=CC=C2C1 CS18799 [0,0,0,1,0,1|1,0,1]=4 1292 B12R2.24 NC1CCC2=CC=CC=C2C1 MC106682 [0,0,0,1,0,1|1,0,1]=4 1293 B12R2.24 NC1CCC2=CC=CC=C2C1 MC106683 [0,0,0,1,0,1|1,0,1]=4 1294 B12R2.24 NN1CCC2=CC=CC=C2C1 MC442441 [0,0,0,1,0,1|2,0,0]=4 1295 B12R2.24 O=C1C=C2C=CC=CC2=NN1 CS16596 [0,0,0,1,0,1|2,0,0]=4 1296 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 MC440135 [0,0,0,1,0,1|0,0,0]=2 1297 B12R2.24 O=C1CCC2=CC=CC=C2N1 CS11038 [0,0,0,1,0,1|0,0,0]=2 1298 B12R2.24 O=C1CCC2=CC=CN=C2N1 MC113033 [0,0,0,1,0,1|1,0,0]=3 1299 B12R2.24 O=C1CCC2=CN=CC=C2N1 MC105357 [0,0,0,1,0,1|1,0,0]=3 1300 B12R2.24 O=C1CCc2ccccc2O1 MC41795 [0,0,0,1,0,1|0,0,0]=2 1301 B12R2.24 O=C1COC2=C(C=CC=C2)N1 CS21568 [0,0,0,1,0,1|1,0,0]=3 1302 B12R2.24 O=C1COC2=C(C=CN=C2)N1 MC425525 [0,0,0,1,0,1|2,0,0]=4 1303 B12R2.24 O=C1COC2=C(C=NC=C2)N1 MC425642 [0,0,0,1,0,1|2,0,0]=4 1304 B12R2.24 O=C1CSC2=CC=CC=C2C1 MC107174 [0,0,0,1,0,1|1,0,0]=3 1305 B12R2.32 BrCC1=NC2=C(C=CC=C2)O1 CS12836 [0,0,0,1,0,1|1,0,1]=4 1306 B12R2.32 BrCC1=NC2=C(C=CC=C2)S1 CS20692 [0,0,0,1,0,1|1,1,0]=4 1307 B12R2.32 CCC1=NC2=C(C=CC=C2)N1 CS18815 [0,0,0,1,0,1|1,0,0]=3 1308 B12R2.32 CSC1=NC2=C(C=CC=C2)O1 MC31049 [0,0,0,1,0,1|1,0,1]=4 1309 B12R2.32 CSC1=NC2=C(C=CC=C2)S1 MC31173 [0,0,0,1,0,1|1,1,0]=4 1310 B12R2.32 ClCC1=NC2=C(C=CC=C2)N1 CS20901 [0,0,0,1,0,1|2,0,0]=4 1311 B12R2.32 ClCC1=NC2=C(C=CC=C2)O1 MC442523 [0,0,0,1,0,1|1,0,1]=4 1312 B12R2.32 ClCC1=NC2=C(C=CC=C2)S1 CS20895 [0,0,0,1,0,1|1,1,0]=4 1313 B12R2.32 NCC1=CC2=C(C=CC=C2)O1 MC111185 [0,0,0,1,0,1|1,0,1]=4 1314 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 CS14446 [0,0,0,1,0,1|2,0,0]=4 1315 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 CS20888 [0,0,0,1,0,1|2,0,0]=4 1316 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 MC425570 [0,0,0,1,0,1|2,0,0]=4 1317 B12R2.32 OCC1=CC2=CC=CC=C2N1 CS20715 [0,0,0,1,0,1|2,0,0]=4 1318 B12R2.32 OCC1=NC2=C(C=CC=C2)N1 MC10493 [0,0,0,1,0,1|2,0,0]=4 1319 B12R2.94 ClC1(SC2=CC=CC=C2)CC1 MC121263 [0,0,0,1,0,1|1,0,1]=4 1320 B12R2.48 CNC1(C2=CC=CC=C2)CC1 MC431934 [0,1,0,1,0,0|1,0,1]=4 1321 B12R2.48 N#CC1(C2=CC=CC=C2)CC1 CS19424 [0,1,0,1,0,0|1,0,1]=4 1322 B12R2.48 O=CC1(C2=CC=CC=C2)CC1 MC115826 [0,1,0,1,0,0|0,0,1]=3 1323 B12R2.116 NC1(C2=CC=CC=C2)CCC1 CS20790 [0,1,0,1,0,0|1,0,1]=4 1324 B12R2.116 NC1(C2=CC=CC=C2)COC1 MC115717 [0,1,0,1,0,0|1,0,1]=4 1325 B12R2.1 BrCC1=CSC2=C1C=CC=C2 CS17544 [0,1,0,1,0,0|1,1,0]=4 1326 B12R2.1 CNC1CCC2=CC=CC=C21 MC431440 [0,1,0,1,0,0|1,0,1]=4 1327 B12R2.1 COC1=NNC2=CC=CC=C21 MC428325 [0,1,0,1,0,0|2,0,0]=4 1328 B12R2.1 N#CC1CCC2=CC=CC=C21 CS13197 [0,1,0,1,0,0|1,0,1]=4 1329 B12R2.1 NCC1=CNC2=CC=CC=C12 CS20093 [0,1,0,1,0,0|2,0,0]=4 1330 B12R2.1 NCC1=NNC2=CC=CC=C21 CS11089 [0,1,0,1,0,0|2,0,0]=4 1331 B12R2.1 O=CC1=CNC2=CC=CC=C12 CS21525 [0,1,0,1,0,0|1,0,1]=4 1332 B12R2.1 O=CC1=CSC2=C1C=CC=C2 CS21482 [0,1,0,1,0,0|1,0,1]=4 1333 B12R2.1 O=CC1=NNC2=CC=CC=C21 CS20713 [0,1,0,1,0,0|2,0,0]=4 1334 B12R2.1 OCC1=CNC2=C1C=CC=C2 MC20402 [0,1,0,1,0,0|2,0,0]=4 1335 B12R2.1 OCC1=NNC2=CC=CC=C21 MC444218 [0,1,0,1,0,0|2,0,0]=4 1336 B12R2.2 C1=CC(C2=NCCC2)=CC=N1 MC425128 [0,1,0,1,0,0|2,0,0]=4 1337 B12R2.2 C1=CC=C(C2CCCN2)C=C1 CS11140 [0,1,0,1,0,0|1,0,1]=4 1338 B12R2.2 C1=CC=C(C2CCCN2)C=C1 CS17953 [0,1,0,1,0,0|1,0,1]=4 1339 B12R2.2 C1=CC=C(C2CCCN2)C=C1 MC105777 [0,1,0,1,0,0|1,0,1]=4 1340 B12R2.2 C1=CC=C(C2CCNC2)C=C1 MC106676 [0,1,0,1,0,0|1,0,1]=4 1341 B12R2.2 C1=CN=C(C2=NCCN2)C=C1 CS15731 [0,1,0,1,0,0|2,0,0]=4 1342 B12R2.22 NC1CC(C2=CC=CC=C2)C1 MC103854 [0,1,0,1,0,0|1,0,1]=4 1343 B12R2.22 NC1CC(C2=CC=CC=C2)C1 MC103855 [0,1,0,1,0,0|1,0,1]=4 1344 B12R2.22 NC1CC(C2=CC=CC=C2)C1 MC105059 [0,1,0,1,0,0|1,0,1]=4 1345 B12R2.1081 CC1CCNC2=CC=CC=C21 CS17518 [0,1,0,1,0,0|1,0,1]=4 1346 B12R2.1081 CC1CNCC2=CC=CC=C21 CS17240 [0,1,0,1,0,0|1,0,1]=4 1347 B12R2.1081 CC1NCCC2=CC=CC=C21 CS12178 [0,1,0,1,0,0|1,0,1]=4 1348 B12R2.1081 CC1NCCC2=CC=CC=C21 CS15270 [0,1,0,1,0,0|1,0,1]=4 1349 B12R2.1081 CN1CCNC2=CC=CC=C21 CS19012 [0,1,0,1,0,0|2,0,0]=4 1350 B12R2.1081 NC1CCCC2=CC=CC=C21 CS13980 [0,1,0,1,0,0|1,0,1]=4 1351 B12R2.1081 NC1CCOC2=CC=CC=C21 CS18355 [0,1,0,1,0,0|1,0,1]=4 1352 B12R2.1081 NC1COCC2=CC=CC=C21 MC100130 [0,1,0,1,0,0|1,0,1]=4 1353 B12R2.1081 O=C1C=CNC2=CC=CC=C12 CS15452 [0,1,0,1,0,0|0,0,2]=4 1354 B12R2.1081 O=C1C=NNC2=CC=CC=C12 CS20704 [0,1,0,1,0,0|1,0,1]=4 1355 B12R2.1081 O=C1CCCC2=C1C=CC=N2 CS18351 [0,1,0,1,0,0|1,0,0]=3 1356 B12R2.1081 O=C1CCCC2=C1C=CN=C2 CS16479 [0,1,0,1,0,0|1,0,0]=3 1357 B12R2.1081 O=C1CCCC2=C1C=NC=C2 CS18873 [0,1,0,1,0,0|1,0,0]=3 1358 B12R2.1081 O=C1CCCC2=C1N=CC=C2 CS15049 [0,1,0,1,0,0|1,0,0]=3 1359 B12R2.1081 O=C1CCCC2=CC=CC=C12 CS14809 [0,1,0,1,0,0|0,0,0]=2 1360 B12R2.1081 O=C1CCNC2=CC=CC=C12 CS15321 [0,1,0,1,0,0|0,0,0]=2 1361 B12R2.1081 O=C1CCNC2=CC=CC=C12 MC441207 [0,1,0,1,0,0|0,0,0]=2 1362 B12R2.1081 O=C1CCOC2=CC=CC=C12 CS22800 [0,1,0,1,0,0|0,0,0]=2 1363 B12R2.1081 O=C1COCC2=C1C=CC=C2 MC41773 [0,1,0,1,0,0|0,0,0]=2 1364 B12R2.1081 O=C1NCCC2=CC=CC=C12 CS17872 [0,1,0,1,0,0|0,0,0]=2 1365 B12R2.1081 O=C1NCCC2=CC=NC=C12 MC104301 [0,1,0,1,0,0|1,0,0]=3 1366 B12R2.1081 O=C1NN=CC2=CC=CC=C12 CS19825 [0,1,0,1,0,0|1,0,1]=4 1367 B12R2.1081 O=C1NN=NC2=C1C=CC=C2 MC20712 [0,1,0,1,0,0|2,0,0]=4 1368 B12R2.1081 O=C1OCCC2=CC=CC=C12 CS12987 [0,1,0,1,0,0|0,0,0]=2 1369 B12R2.1081 OC1CNCC2=CC=CC=C21 MC111757 [0,1,0,1,0,0|0,0,2]=4 1370 B12R2.2028 CN1C=C(Br)C2=CC=CC=C21 MC441090 [0,1,0,1,0,0|1,0,1]=4 1371 B12R2.2028 O=C1CC(Br)C2=CC=CC=C12 CS22129 [0,1,0,1,0,0|0,0,0]=2 1372 B12R2.2028 O=C1NC(=O)C2=CC=CC=C12 MC41774 [0,1,0,1,0,0|1,0,1]=4 1373 B12R2.2028 O=C1OC(=O)C2=CC=CC=C12 MC41809 [0,1,0,1,0,0|1,0,1]=4 1374 B12R2.2028 O=C1O[IH2](O)C2=C1C=CC=C2 MC20691 [0,1,0,1,0,0|2,0,0]=4 1375 B12R2.2028 O=C1[N-]C(=O)C2=CC=CC=C12 CS11876 [0,1,0,1,0,0|1,0,1]=4 1376 B12R2.612 CC1=CC2=C(C=C1)C(=O)NO2 MC115929 [0,1,0,1,0,0|2,0,0]=4 1377 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 MC446693 [0,1,0,1,0,0|0,0,0]=2 1378 B12R2.612 ClC1CCC2=CC(Br)=CC=C21 CS16081 [0,1,0,1,0,0|1,0,1]=4 1379 B12R2.612 NC1=CC=C2C(=O)CCC2=C1 MC446737 [0,1,0,1,0,0|0,0,0]=2 1380 B12R2.612 NC1=CC=C2C(=O)NCC2=C1 MC100084 [0,1,0,1,0,0|1,0,0]=3 1381 B12R2.612 NC1CCC2=CC(F)=CC=C21 MC431475 [0,1,0,1,0,0|1,0,1]=4 1382 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 CS21498 [0,1,0,1,0,0|0,0,0]=2 1383 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 CS22043 [0,1,0,1,0,0|0,0,0]=2 1384 B12R2.612 O=C1CCC2=CC(F)=CC=C12 MC10164 [0,1,0,1,0,0|0,0,0]=2 1385 B12R2.612 O=C1CCC2=CC(O)=CC=C12 CS11017 [0,1,0,1,0,0|0,0,0]=2 1386 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 MC115907 [0,1,0,1,0,0|1,0,0]=3 1387 B12R2.612 O=C1COC2=C1C=CC(Cl)=C2 CS15082 [0,1,0,1,0,0|1,0,0]=3 1388 B12R2.612 O=C1COC2=C1C=CC(O)=C2 CS20793 [0,1,0,1,0,0|1,0,0]=3 1389 B12R2.612 O=C1NCC2=CC(Br)=CC=C12 CS12118 [0,1,0,1,0,0|1,0,0]=3 1390 B12R2.612 O=C1NCC2=CC(Br)=CN=C12 MC111565 [0,1,0,1,0,0|2,0,0]=4 1391 B12R2.612 O=C1NCC2=CC(Cl)=CC=C12 CS10349 [0,1,0,1,0,0|1,0,0]=3 1392 B12R2.612 O=C1NCC2=CC(F)=CC=C12 CS15892 [0,1,0,1,0,0|1,0,0]=3 1393 B12R2.612 O=C1NCC2=CC(O)=CC=C12 CS15015 [0,1,0,1,0,0|1,0,0]=3 1394 B12R2.612 O=C1NNC2=CC(F)=CC=C12 CS10702 [0,1,0,1,0,0|2,0,0]=4 1395 B12R2.612 O=C1NOC2=C1C=CC(F)=C2 CS16833 [0,1,0,1,0,0|2,0,0]=4 1396 B12R2.612 O=C1OCC2=C1C=NC(Cl)=C2 MC104939 [0,1,0,1,0,0|2,0,0]=4 1397 B12R2.612 O=C1OCC2=CC(Br)=CC=C12 CS10666 [0,1,0,1,0,0|1,0,0]=3 1398 B12R2.612 O=C1OCC2=CC(F)=CC=C12 MC113738 [0,1,0,1,0,0|1,0,0]=3 1399 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 MC446759 [0,1,0,1,0,0|0,0,0]=2 1400 B12R2.132 CC1=NC=C2OCC(=O)C2=C1 MC102724 [0,1,0,1,0,0|2,0,0]=4 1401 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 MC446750 [0,1,0,1,0,0|0,0,0]=2 1402 B12R2.132 NC1CCC2=CC=C(Br)C=C21 MC104166 [0,1,0,1,0,0|1,0,1]=4 1403 B12R2.132 NC1CCC2=CC=C(Br)C=C21 MC105332 [0,1,0,1,0,0|1,0,1]=4 1404 B12R2.132 NC1CCC2=CC=C(F)C=C21 MC431345 [0,1,0,1,0,0|1,0,1]=4 1405 B12R2.132 NC1CCC2=CC=C(O)C=C21 MC104168 [0,1,0,1,0,0|1,0,1]=4 1406 B12R2.132 NC1CCC2=CC=C(O)C=C21 MC105334 [0,1,0,1,0,0|1,0,1]=4 1407 B12R2.132 O=C1CCC2=CC=C(Br)C=C12 CS18733 [0,1,0,1,0,0|0,0,0]=2 1408 B12R2.132 O=C1CCC2=CC=C(Cl)C=C12 CS13722 [0,1,0,1,0,0|0,0,0]=2 1409 B12R2.132 O=C1CCC2=CC=C(F)C=C12 MC429567 [0,1,0,1,0,0|0,0,0]=2 1410 B12R2.132 O=C1CCC2=CC=C(I)C=C12 CS19840 [0,1,0,1,0,0|0,0,0]=2 1411 B12R2.132 O=C1CCC2=CC=C(O)C=C12 CS15371 [0,1,0,1,0,0|0,0,0]=2 1412 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 CS18239 [0,1,0,1,0,0|1,0,0]=3 1413 B12R2.132 O=C1COC2=C1C=C(Cl)C=C2 MC428126 [0,1,0,1,0,0|1,0,0]=3 1414 B12R2.132 O=C1COC2=C1C=C(F)C=C2 MC113784 [0,1,0,1,0,0|1,0,0]=3 1415 B12R2.132 O=C1COC2=C1C=C(I)C=C2 MC100482 [0,1,0,1,0,0|1,0,0]=3 1416 B12R2.132 O=C1NCC2=CC=C(Br)C=C12 CS14261 [0,1,0,1,0,0|1,0,0]=3 1417 B12R2.132 O=C1NCC2=NC=C(Br)C=C12 CS17280 [0,1,0,1,0,0|2,0,0]=4 1418 B12R2.132 O=C1NOC2=C1C=C(Br)C=C2 CS15251 [0,1,0,1,0,0|2,0,0]=4 1419 B12R2.132 O=C1NOC2=C1C=C(Cl)C=C2 MC427277 [0,1,0,1,0,0|2,0,0]=4 1420 B12R2.132 O=C1NOC2=C1C=C(F)C=C2 CS16834 [0,1,0,1,0,0|2,0,0]=4 1421 B12R2.132 O=C1OCC2=CC=C(Br)C=C12 CS12535 [0,1,0,1,0,0|1,0,0]=3 1422 B12R2.196 CC1=C2CCC(=O)C2=CC=C1 CS14012 [0,1,0,1,0,0|0,0,0]=2 1423 B12R2.196 NC1=C2CCC(=O)C2=CC=C1 MC446724 [0,1,0,1,0,0|0,0,0]=2 1424 B12R2.196 NC1=C2CNC(=O)C2=CC=C1 CS22586 [0,1,0,1,0,0|1,0,0]=3 1425 B12R2.196 NC1=C2COC(=O)C2=CC=C1 CS14004 [0,1,0,1,0,0|1,0,0]=3 1426 B12R2.196 NC1CCC2=C(Br)C=CC=C21 CS14533 [0,1,0,1,0,0|1,0,1]=4 1427 B12R2.196 NC1CCC2=C(Br)C=CC=C21 CS14534 [0,1,0,1,0,0|1,0,1]=4 1428 B12R2.196 NC1CCC2=C(F)C=CC=C21 CS18746 [0,1,0,1,0,0|1,0,1]=4 1429 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 CS10966 [0,1,0,1,0,0|0,0,0]=2 1430 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 CS18751 [0,1,0,1,0,0|0,0,0]=2 1431 B12R2.196 O=C1CCC2=C(F)C=CC=C12 MC442503 [0,1,0,1,0,0|0,0,0]=2 1432 B12R2.196 O=C1CCC2=C(O)C=CC=C12 CS19922 [0,1,0,1,0,0|0,0,0]=2 1433 B12R2.196 O=C1COC2=C1C=CC=C2F MC113785 [0,1,0,1,0,0|1,0,0]=3 1434 B12R2.196 O=C1COC2=C1C=CC=C2I MC114833 [0,1,0,1,0,0|1,0,0]=3 1435 B12R2.196 O=C1CSC2=C1C=CC=C2F MC107892 [0,1,0,1,0,0|1,0,0]=3 1436 B12R2.196 O=C1NCC2=C(O)C=CC=C12 CS14659 [0,1,0,1,0,0|1,0,0]=3 1437 B12R2.196 O=C1OCC2=C(Br)C=CC=C12 CS22636 [0,1,0,1,0,0|1,0,0]=3 1438 B12R2.1282 NC1(C2=CC(F)=CC=C2)CC1 MC106817 [0,1,0,1,0,0|1,0,1]=4 1439 B12R2.88 NC1(C2=C(Cl)C=CC=C2)CC1 MC115575 [0,1,0,1,0,0|1,0,1]=4 1440 B12R2.88 NC1(C2=C(F)C=CC=C2)CC1 MC443454 [0,1,0,1,0,0|1,0,1]=4 1441 B12R2.203 O=C1CCC2=CC=CC(Br)=C12 MC106557 [0,1,0,1,0,0|0,0,0]=2 1442 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 MC429388 [0,1,0,1,0,0|0,0,0]=2 1443 B12R2.203 O=C1CCC2=CC=CC(F)=C12 CS15500 [0,1,0,1,0,0|0,0,0]=2 1444 B12R2.203 O=C1CCC2=CC=CC(I)=C12 MC113777 [0,1,0,1,0,0|0,0,0]=2 1445 B12R2.203 O=C1CCC2=CC=CC(O)=C12 CS12591 [0,1,0,1,0,0|0,0,0]=2 1446 B12R2.203 O=C1COC2=C1C(F)=CC=C2 MC113791 [0,1,0,1,0,0|1,0,0]=3 1447 B12R2.203 O=C1NCC2=CC=CC(Br)=C12 CS14262 [0,1,0,1,0,0|1,0,0]=3 1448 B12R2.203 O=C1NCC2=CC=CC(I)=C12 MC100883 [0,1,0,1,0,0|1,0,0]=3 1449 B8R1.7 CC(=O)C1=CC=CO1 CS18634 [1,0,0,0,1,0|1,0,0]=3 1450 B8R1.7 CC(=O)C1=CC=CS1 CS19387 [1,0,0,0,1,0|1,0,0]=3 1451 B8R1.7 CC(=O)C1=CC=NO1 CS15344 [1,0,0,0,1,0|2,0,0]=4 1452 B8R1.7 CC(=O)C1=CNC=N1 CS20378 [1,0,0,0,1,0|2,0,0]=4 1453 B8R1.7 CC(=O)C1=CSC=C1 CS18739 [1,0,0,0,1,0|1,0,0]=3 1454 B8R1.7 CC(=O)C1=CSC=N1 CS13244 [1,0,0,0,1,0|2,0,0]=4 1455 B8R1.7 CC(=O)C1=NC=CO1 CS20443 [1,0,0,0,1,0|2,0,0]=4 1456 B8R1.7 CC(=O)C1=NC=CS1 CS22755 [1,0,0,0,1,0|2,0,0]=4 1457 B8R1.7 CC(=O)C1=NNC=C1 CS13441 [1,0,0,0,1,0|2,0,0]=4 1458 B8R1.7 CC(=O)C1=NOC=C1 MC116141 [1,0,0,0,1,0|2,0,0]=4 1459 B8R1.7 CC(=O)N1C=CN=C1 MC428372 [1,0,0,0,1,0|2,0,0]=4 1460 B8R1.7 O=C(O)C1=CC=CN1 CS17766 [1,0,0,0,1,0|2,0,0]=4 1461 B8R1.7 O=C(O)C1=CC=CO1 CS16202 [1,0,0,0,1,0|2,0,0]=4 1462 B8R1.7 O=C(O)C1=CC=CS1 MC41710 [1,0,0,0,1,0|2,0,0]=4 1463 B8R1.7 O=C(O)C1=CNC=C1 CS16294 [1,0,0,0,1,0|2,0,0]=4 1464 B8R1.7 O=C(O)C1=COC=C1 CS14540 [1,0,0,0,1,0|2,0,0]=4 1465 B8R1.7 O=C(O)C1=CSC=C1 CS22727 [1,0,0,0,1,0|2,0,0]=4 1466 B12R1.27 COC(=O)CCC1=CC=CC=C1 MC433965 [0,0,0,0,0,2|1,0,0]=3 1467 B12R1.27 NCC(=O)OCC1=CC=CC=C1 MC428105 [0,0,0,0,0,2|1,0,0]=3 1468 B12R1.27 NCC(=O)OCc1ccccc1 MC437714 [0,0,0,0,0,2|1,0,0]=3 1469 B12R1.27 NCC(=O)OCc1ccccc1 MC437715 [0,0,0,0,0,2|1,0,0]=3 1470 B12R1.27 NNC(=O)OCC1=CC=CC=C1 CS20449 [0,0,0,0,0,2|2,0,0]=4 1471 B12R1.27 NNC(=O)OCc1ccccc1 MC438484 [0,0,0,0,0,2|2,0,0]=4 1472 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 CS19947 [0,0,0,0,0,2|1,0,0]=3