0 B13R2.13083 CC1=C(C=C2N=C(SC2=C1)N)F Z1198180698 [0,0,0,0,0,0|2,2,0]=4 1 B13R2.13083 CC1=C(C=C2N=C(SC2=C1)N)N Z277112732 [0,0,0,0,0,0|3,1,0]=4 2 B13R2.13083 CC1=C(C=C2NC(=NC2=C1)N)Br Z1551919234 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.13083 CC1=C(C=C2SC(=NC2=C1)N)C Z56772511 [0,0,0,0,0,0|3,1,0]=4 4 B13R2.13083 CC1=C(C=C2SC(=NC2=C1)N)F Z1681348700 [0,0,0,0,0,0|3,1,0]=4 5 B13R2.13083 CC1=CC2=C(C=C1C)SC(=N2)C Z56922109 [0,0,0,0,0,0|3,1,0]=4 6 B13R2.13083 CC1=NC2=C(N1)C=C(C(=C2)Br)F Z1336447277 [0,0,0,0,0,0|3,1,0]=4 7 B13R2.13083 CC1=NC2=C(S1)C=C(C(=C2)Cl)N Z1262629529 [0,0,0,0,0,0|2,1,0]=3 8 B13R2.13083 FC1=C(C=C2NC(=NC2=C1)S)F Z235346999 [0,0,0,0,0,0|2,2,0]=4 9 B13R2.13083 FC1=C(C=C2SC(=NC2=C1)S)Br Z3184890103 [0,0,0,0,0,0|1,3,0]=4 10 B13R2.13083 NC1=C(C=C2NC(=O)CC2=C1)Cl Z335455232 [0,0,0,0,0,0|2,0,2]=4 11 B13R2.13083 NC1=C(C=C2NC(=O)OC2=C1)F Z1262644575 [0,0,0,0,0,0|1,1,2]=4 12 B13R2.13083 NC1=C(C=C2SC(=O)OC2=C1)O Z1551917573 [0,0,0,0,0,0|2,1,1]=4 13 B13R2.13083 NC1=NC2=C(N1)C=C(C(=C2)Br)Br Z2310774047 [0,0,0,0,0,0|3,1,0]=4 14 B13R2.13083 NC1=NC2=C(N1)C=C(C(=C2)Br)F Z1270232707 [0,0,0,0,0,0|3,1,0]=4 15 B13R2.13083 NC1=NC2=C(N1)C=C(C(=C2)Cl)Cl Z1269161532 [0,0,0,0,0,0|3,0,0]=3 16 B13R2.13083 NC1=NC2=C(N1)C=C(C(=C2)F)Cl Z1255430307 [0,0,0,0,0,0|3,0,1]=4 17 B13R2.13083 NC1=NC2=C(N1)C=C(C(=C2)F)F Z995046372 [0,0,0,0,0,0|3,1,0]=4 18 B13R2.13083 NC1=NC2=C(S1)C=C(C(=C2)F)Br Z1629735523 [0,0,0,0,0,0|2,2,0]=4 19 B13R2.13083 NC1=NC2=C(S1)C=C(C(=C2)F)F Z1262246177 [0,0,0,0,0,0|2,2,0]=4 20 B13R2.13083 O=C1CC2=CC(=C(C=C2N1)Cl)Br Z425365108 [0,0,0,0,0,0|2,0,2]=4 21 B13R2.13083 O=C1CC2=CC(=C(C=C2N1)Cl)F Z1198234271 [0,0,0,0,0,0|2,0,2]=4 22 B13R2.13083 O=C1NC2=CC(=C(C=C2N1)Br)Cl Z1470894503 [0,0,0,0,0,0|2,0,2]=4 23 B13R2.13083 O=C1NC2=CC(=C(C=C2N1)Cl)F Z1255404205 [0,0,0,0,0,0|2,0,2]=4 24 B13R2.13083 O=C1NC2=CC(=C(C=C2O1)Br)F Z1416185624 [0,0,0,0,0,0|1,1,2]=4 25 B13R2.13083 O=C1NC2=CC(=C(C=C2O1)F)Br Z1495453869 [0,0,0,0,0,0|1,1,2]=4 26 B13R2.13083 O=C1OC2=CC(=C(C=C2S1)O)Cl Z1513833014 [0,0,0,0,0,0|1,1,1]=3 27 B13R2.13083 O=C1OC2=CC(=C(C=C2S1)O)I Z1551960387 [0,0,0,0,0,0|1,2,1]=4 28 B13R2.13083 O=C1OC2=CC(=C(C=C2S1)O)O Z1551923954 [0,0,0,0,0,0|2,0,1]=3 29 B13R2.13083 OC1=NC2=C(N1)C=C(C(=C2)Br)F Z1336447257 [0,0,0,0,0,0|2,1,0]=3 30 B12R2.100 BrC1=C(C=C2NC=NC2=C1)Br Z3234801863 [1,0,0,0,0,0|2,1,0]=4 31 B12R2.100 CC1=C(C=C2N=CSC2=C1)Br Z3300754374 [1,0,0,0,0,0|1,2,0]=4 32 B12R2.100 CC1=C(C=C2NC=NC2=C1)C Z55928828 [1,0,0,0,0,0|3,0,0]=4 33 B12R2.100 ClC1=C(C=C2C=CNC2=C1)Br Z1269179223 [1,0,0,0,0,0|2,0,1]=4 34 B12R2.100 ClC1=C(C=C2NC=CC2=C1)Br Z1269225967 [1,0,0,0,0,0|3,0,0]=4 35 B12R2.100 ClC1=C(C=C2NC=CC2=C1)Cl Z1201620800 [1,0,0,0,0,0|2,0,1]=4 36 B12R2.100 ClC1=C(C=C2NC=NC2=C1)Br Z1551930830 [1,0,0,0,0,0|2,0,0]=3 37 B12R2.100 ClC1=C(C=C2NC=NC2=C1)Cl Z2941518564 [1,0,0,0,0,0|2,0,0]=3 38 B12R2.100 ClC1=C(C=C2NN=NC2=C1)Cl Z1251354024 [1,0,0,0,0,0|3,0,0]=4 39 B12R2.100 ClC1=C(C=C2OC=CC2=C1)Br Z1681348707 [1,0,0,0,0,0|2,0,0]=3 40 B12R2.100 ClC1=C(C=C2OCCC2=C1)Br Z1551957154 [1,0,0,0,0,0|2,0,1]=4 41 B12R2.100 ClC1=C(C=C2OCOC2=C1)Br Z1278926390 [1,0,0,0,0,0|2,0,1]=4 42 B12R2.100 ClC1=C(C=C2OCOC2=C1)Cl Z1198169249 [1,0,0,0,0,0|2,0,1]=4 43 B12R2.100 FC1=C(C=C2C=CNC2=C1)Cl Z1201620785 [1,0,0,0,0,0|3,0,0]=4 44 B12R2.100 FC1=C(C=C2C=COC2=C1)Br Z1681355433 [1,0,0,0,0,0|2,1,0]=4 45 B12R2.100 FC1=C(C=C2OC=CC2=C1)Br Z1551956538 [1,0,0,0,0,0|2,1,0]=4 46 B12R2.100 NC1=C(C=C2N=CNC2=C1)F Z3670392749 [1,0,0,0,0,0|2,1,0]=4 47 B12R2.100 NC1=C(C=C2OCOC2=C1)Cl Z168827492 [1,0,0,0,0,0|2,0,1]=4 48 B12R2.100 OC1=C(C=C2OCOC2=C1)Cl Z1416158322 [1,0,0,0,0,0|1,0,1]=3 49 B12R2.606 CC1=CC2=C(C=C1)N=C(N2)N Z995046368 [1,0,0,0,0,0|3,0,0]=4 50 B12R2.606 CC1=CC2=C(C=C1)N=C(O2)N Z979487656 [1,0,0,0,0,0|2,0,0]=3 51 B12R2.606 CC1=CC2=C(C=C1)N=C(S2)N Z57069881 [1,0,0,0,0,0|2,1,0]=4 52 B12R2.606 CC1=CC2=C(C=C1)NC(=N2)C Z57370047 [1,0,0,0,0,0|3,0,0]=4 53 B12R2.606 CC1=CC2=C(C=C1)NC(=N2)S Z57298378 [1,0,0,0,0,0|2,1,0]=4 54 B12R2.606 CC1=CC2=C(C=C1)OC(=N2)S Z56864608 [1,0,0,0,0,0|1,1,0]=3 55 B12R2.606 CC1=CC2=C(C=C1)OC(=O)N2 Z274568258 [1,0,0,0,0,0|1,0,2]=4 56 B12R2.606 CC1=CC2=C(C=C1)SC(=N2)S Z1198307587 [1,0,0,0,0,0|1,2,0]=4 57 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)O Z1198147837 [1,0,0,0,0,0|2,0,1]=4 58 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)Br Z1269240413 [1,0,0,0,0,0|2,1,0]=4 59 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)I Z1269130980 [1,0,0,0,0,0|2,1,0]=4 60 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)N Z2106607528 [1,0,0,0,0,0|3,0,0]=4 61 B12R2.606 CC1=NC2=C(C=C1)OC(=N2)S Z1198309540 [1,0,0,0,0,0|2,1,0]=4 62 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)Br Z382823070 [1,0,0,0,0,0|2,1,0]=4 63 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)O Z1255462447 [1,0,0,0,0,0|2,0,1]=4 64 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)N Z235353833 [1,0,0,0,0,0|2,0,0]=3 65 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)O Z1201620245 [1,0,0,0,0,0|1,0,0]=2 66 B12R2.606 CC1=NC2=C(O1)C=C(C=N2)Br Z1269209286 [1,0,0,0,0,0|3,0,0]=4 67 B12R2.606 CC1=NC2=C(O1)C=CC(=C2)Br Z1203159513 [1,0,0,0,0,0|1,1,0]=3 68 B12R2.606 CC1=NC2=C(O1)C=CC(=C2)Cl Z104486454 [1,0,0,0,0,0|1,0,0]=2 69 B12R2.606 CC1=NC2=C(O1)C=CC(=N2)Br Z1269241013 [1,0,0,0,0,0|2,1,0]=4 70 B12R2.606 CC1=NC2=C(O1)N=CC(=C2)Br Z1269238277 [1,0,0,0,0,0|2,1,0]=4 71 B12R2.606 CC1=NC2=C(S1)C=C(C=C2)N Z56896242 [1,0,0,0,0,0|2,1,0]=4 72 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)Cl Z104493618 [1,0,0,0,0,0|1,1,0]=3 73 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)N Z2901974823 [1,0,0,0,0,0|2,1,0]=4 74 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)O Z1203159861 [1,0,0,0,0,0|2,1,0]=4 75 B12R2.606 CN1C=C2C=C(C=CC2=N1)O Z1198343475 [1,0,0,0,0,0|3,0,0]=4 76 B12R2.606 ClC1=CC2=C(C=C1)C=C(S2)Br Z3300737228 [1,0,0,0,0,0|3,0,0]=4 77 B12R2.606 FC1=CC2=C(C=C1)N=C(O2)S Z1147226283 [1,0,0,0,0,0|1,1,0]=3 78 B12R2.606 FC1=CC2=C(C=C1)N=C(S2)S Z1201620440 [1,0,0,0,0,0|1,2,0]=4 79 B12R2.606 FC1=CC2=C(C=C1)SC(=N2)S Z1201621686 [1,0,0,0,0,0|0,3,0]=4 80 B12R2.606 N=C1OC2=C(S1)C=C(C=C2)O Z1513863695 [1,0,0,0,0,0|2,1,0]=4 81 B12R2.606 NC1=CC2=C(C=C1)N=C(O2)S Z1198180819 [1,0,0,0,0,0|1,1,0]=3 82 B12R2.606 NC1=CC2=C(C=C1)N=C(S2)Cl Z57160346 [1,0,0,0,0,0|2,1,0]=4 83 B12R2.606 NC1=CC2=C(C=C1)N=C(S2)N Z2289761601 [1,0,0,0,0,0|2,1,0]=4 84 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 Z56944506 [1,0,0,0,0,0|1,0,2]=4 85 B12R2.606 NC1=CC2=C(C=C1)SC(=N2)S Z1255404077 [1,0,0,0,0,0|1,2,0]=4 86 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Br Z1270207960 [1,0,0,0,0,0|2,1,0]=4 87 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Cl Z995046354 [1,0,0,0,0,0|2,0,0]=3 88 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)I Z1269176820 [1,0,0,0,0,0|2,1,0]=4 89 B12R2.606 NC1=NC2=C(N1)N=CC(=C2)Cl Z4459684100 [1,0,0,0,0,0|3,0,0]=4 90 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)Br Z1269173847 [1,0,0,0,0,0|2,0,0]=3 91 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)F Z1147226282 [1,0,0,0,0,0|2,0,0]=3 92 B12R2.606 NC1=NC2=C(O1)C=C(C=N2)Br Z2733008466 [1,0,0,0,0,0|3,0,0]=4 93 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Br Z359373114 [1,0,0,0,0,0|1,1,0]=3 94 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Cl Z89267039 [1,0,0,0,0,0|1,0,0]=2 95 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)F Z979487600 [1,0,0,0,0,0|1,1,0]=3 96 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)Br Z56858257 [1,0,0,0,0,0|2,1,0]=4 97 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)Cl Z56896352 [1,0,0,0,0,0|2,1,0]=4 98 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)F Z56899125 [1,0,0,0,0,0|2,1,0]=4 99 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)I Z1741785969 [1,0,0,0,0,0|2,1,0]=4 100 B12R2.606 NC1=NC2=C(S1)C=CC(=C2)Cl Z228584306 [1,0,0,0,0,0|1,1,0]=3 101 B12R2.606 NC1=NC2=C(S1)C=CC(=C2)O Z1198155943 [1,0,0,0,0,0|2,1,0]=4 102 B12R2.606 NC1=NC2=C(S1)N=C(C=C2)O Z3324768322 [1,0,0,0,0,0|2,1,0]=4 103 B12R2.606 NC1=NN2C=C(C=CC2=N1)Cl Z1255424560 [1,0,0,0,0,0|3,0,0]=4 104 B12R2.606 NC1=NN2C=CC(=CC2=N1)Cl Z1217131082 [1,0,0,0,0,0|3,0,0]=4 105 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Cl Z56922083 [1,0,0,0,0,0|1,0,2]=4 106 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Cl Z104477028 [1,0,0,0,0,0|2,0,1]=4 107 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [1,0,0,0,0,0|1,0,2]=4 108 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Br Z381351238 [1,0,0,0,0,0|1,0,2]=4 109 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Cl Z99599674 [1,0,0,0,0,0|1,0,2]=4 110 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)I Z1269166325 [1,0,0,0,0,0|1,0,2]=4 111 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Br Z979488024 [1,0,0,0,0,0|0,1,2]=4 112 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Cl Z57183224 [1,0,0,0,0,0|0,0,2]=3 113 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)F Z979487984 [1,0,0,0,0,0|0,1,2]=4 114 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)O Z1198314975 [1,0,0,0,0,0|1,0,2]=4 115 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)Br Z1269212344 [1,0,0,0,0,0|1,1,1]=4 116 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)O Z1198726972 [1,0,0,0,0,0|1,0,1]=3 117 B12R2.606 O=C1OC2=C(S1)C=C(C=C2)O Z56801267 [1,0,0,0,0,0|1,1,1]=4 118 B12R2.606 O=C1OC2=C(S1)C=CC(=C2)O Z104483034 [1,0,0,0,0,0|1,0,1]=3 119 B12R2.606 OC1=CC2=C(C=C1)CC(C2)O Z1198729229 [1,0,0,0,0,0|2,0,1]=4 120 B12R2.606 OC1=CN2C=C(C=CC2=N1)Br Z1813175670 [1,0,0,0,0,0|3,0,0]=4 121 B12R2.606 OC1=NC2=C(N1)N=CC(=C2)Br Z1154253159 [1,0,0,0,0,0|2,1,0]=4 122 B12R2.606 OC1CC2=C(C1)C=C(C=C2)Cl Z1489210921 [1,0,0,0,0,0|2,0,1]=4 123 B12R2.606 SC1=NC2=C(N1)C=C(C=C2)Cl Z56921384 [1,0,0,0,0,0|1,1,1]=4 124 B12R2.606 SC1=NC2=C(N1)C=CC(=C2)I Z3235033507 [1,0,0,0,0,0|1,2,0]=4 125 B12R2.606 SC1=NC2=C(N1)N=CC(=C2)Cl Z55928993 [1,0,0,0,0,0|2,1,0]=4 126 B12R2.606 SC1=NC2=C(O1)C=C(C=C2)Cl Z56969312 [1,0,0,0,0,0|1,1,0]=3 127 B12R2.606 SC1=NC2=C(O1)C=C(C=N2)Cl Z1688656989 [1,0,0,0,0,0|2,1,0]=4 128 B12R2.606 SC1=NC2=C(O1)C=CC(=C2)Cl Z56824483 [1,0,0,0,0,0|0,1,0]=2 129 B12R2.606 SC1=NC2=C(S1)C=CC(=C2)Cl Z104497390 [1,0,0,0,0,0|0,2,0]=3 130 B14R2.645 CN1C(=NC2=C1C=C(C(=C2)Cl)Cl)N Z57069735 [0,1,0,0,0,0|3,0,0]=4 131 B14R2.645 O=C1NC2=CC(=C(C=C2C1=O)Cl)O Z1509203613 [0,1,0,0,0,0|2,0,1]=4 132 B14R2.1197 COC1=C(C=C2N=C(SC2=C1)N)Cl Z57075508 [0,1,0,0,0,0|1,1,0]=3 133 B14R2.2925 FC1=C(C(=C2N=C(OC2=C1)S)F)F Z3400108722 [0,1,0,0,0,0|1,2,0]=4 134 B14R2.38360 NCC1=NC2=C(N1)C=C(C(=C2)Cl)F Z4201877722 [0,1,0,0,0,0|3,0,0]=4 135 B14R2.38360 OCC1=CC2=C(N1)C=C(C(=C2)Cl)Cl Z360053570 [0,1,0,0,0,0|2,0,1]=4 136 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Cl Z1198264457 [0,0,1,0,0,0|2,0,1]=4 137 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)O Z1198166108 [0,0,1,0,0,0|3,0,0]=4 138 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [0,0,1,0,0,0|2,0,1]=4 139 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Cl Z1269109822 [0,0,1,0,0,0|2,0,1]=4 140 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Br Z1269184545 [0,0,1,0,0,0|3,0,0]=4 141 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Cl Z104476066 [0,0,1,0,0,0|2,0,1]=4 142 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Cl Z362118814 [0,0,1,0,0,0|2,0,1]=4 143 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl Z1205411134 [0,0,1,0,0,0|1,0,1]=3 144 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)F Z1255445925 [0,0,1,0,0,0|1,1,1]=4 145 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [0,0,1,0,0,0|2,0,1]=4 146 B14R2.8239 ClC1=CC2=C(C=C1Cl)N=C(C=N2)Cl Z1269188384 [0,0,0,0,0,1|3,0,0]=4 147 B14R2.8239 NC1=C(C=C2NC(=O)COC2=C1)Cl Z228586422 [0,0,0,0,0,1|1,0,2]=4 148 B14R2.8239 NC1=NC2=C(C=N1)C=C(C(=C2)Cl)Cl Z1509420407 [0,0,0,0,0,1|3,0,0]=4 149 B14R2.8239 O=C1COC2=CC(=C(C=C2N1)Cl)Br Z382716784 [0,0,0,0,0,1|1,0,2]=4 150 B14R2.8239 OC1=NC2=C(C=C(C(=C2)Cl)Cl)N=C1 Z1269175622 [0,0,0,0,0,1|2,0,0]=3 151 B11R1.20 N=C(N)NC1=CC=C(C=C1)Cl Z2931635778 [1,0,1,0,0,0|2,0,0]=4 152 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [1,0,1,0,0,0|2,0,0]=4 153 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [1,0,1,0,0,0|1,0,1]=4 154 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [1,0,1,0,0,0|2,0,0]=4 155 B11R1.192 OCCC1=CC(=C(C=C1)O)Cl Z1250886915 [1,0,1,0,0,0|1,0,1]=4 156 B11R1.81 OCCC1=C(C=C(C=C1)O)O Z1513827466 [1,0,1,0,0,0|1,0,1]=4 157 B11R1.277 CC1=C(C=C(C(=C1)O)C=O)Cl Z1201622054 [1,0,1,0,0,0|1,0,1]=4 158 B11R1.277 O=CC1=C(C=C(C(=C1)Cl)Br)O Z1269235654 [1,0,1,0,0,0|1,0,1]=4 159 B11R1.277 O=CC1=C(C=C(C(=C1)Cl)F)O Z1511755432 [1,0,1,0,0,0|1,0,1]=4 160 B11R1.277 O=CC1=CC(=C(C=C1Br)Cl)O Z2755932888 [1,0,1,0,0,0|1,0,1]=4 161 B11R1.277 O=CC1=CC(=C(C=C1Cl)O)Cl Z1255427969 [1,0,1,0,0,0|1,0,1]=4 162 B11R1.277 O=CC1=CC(=C(C=C1F)O)Cl Z1416192980 [1,0,1,0,0,0|1,0,1]=4 163 B11R1.277 O=CC1=CC(=C(C=C1O)O)F Z1511905315 [1,0,1,0,0,0|0,1,1]=4 164 B11R2.36 BrC1=CC2=C(C=C1)N=CO2 Z1198161423 [2,0,0,0,0,0|1,0,0]=3 165 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 Z382822766 [2,0,0,0,0,0|1,1,0]=4 166 B11R2.36 BrC1=CC2=C(C=C1)SC=N2 Z1269222968 [2,0,0,0,0,0|0,2,0]=4 167 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 Z1198180633 [2,0,0,0,0,0|2,0,0]=4 168 B11R2.36 CC1=CC2=C(C=C1)N=CN2 Z3234957798 [2,0,0,0,0,0|2,0,0]=4 169 B11R2.36 CC1=CC2=C(C=C1)N=CS2 Z1198156828 [2,0,0,0,0,0|1,1,0]=4 170 B11R2.36 CC1=CC2=C(C=C1)OC=C2 Z1198151070 [2,0,0,0,0,0|2,0,0]=4 171 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 Z1095352660 [2,0,0,0,0,0|2,0,0]=4 172 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 Z382723678 [2,0,0,0,0,0|1,0,1]=4 173 B11R2.36 ClC1=CC2=C(N=C1)OC=C2 Z1862012743 [2,0,0,0,0,0|2,0,0]=4 174 B11R2.36 ClC1=CC2=NC=CN2C=C1 Z1198176971 [2,0,0,0,0,0|2,0,0]=4 175 B11R2.36 IC1=CC2=C(C=C1)N=CN2 Z2757552913 [2,0,0,0,0,0|2,0,0]=4 176 B11R2.36 NC1=CC2=C(C=C1)N=CO2 Z385373514 [2,0,0,0,0,0|1,0,0]=3 177 B11R2.36 NC1=CC2=C(C=C1)NC=N2 Z1741960823 [2,0,0,0,0,0|2,0,0]=4 178 B11R2.36 NC1=CC2=C(C=C1)SC=N2 Z425486860 [2,0,0,0,0,0|1,1,0]=4 179 B11R2.36 NC1=CC2=C(C=CO2)C=C1 Z1198313503 [2,0,0,0,0,0|2,0,0]=4 180 B11R2.36 OC1=CC2=C(C=C1)NC=C2 Z1203162319 [2,0,0,0,0,0|1,0,1]=4 181 B11R2.36 OC1=CC2=C(C=C1)NC=N2 Z1042386518 [2,0,0,0,0,0|1,0,1]=4 182 B11R2.36 OC1=CC2=C(C=C1)OC=N2 Z1198313500 [2,0,0,0,0,0|1,0,0]=3 183 B11R2.36 OC1=CC2=C(C=C1)OCO2 Z104473678 [2,0,0,0,0,0|1,0,1]=4 184 B11R2.36 OC1=CC2=C(C=C1)SC=C2 Z1255397714 [2,0,0,0,0,0|2,0,0]=4 185 B11R2.36 OC1=CC2=C(C=CN2)C=C1 Z1203162244 [2,0,0,0,0,0|2,0,0]=4 186 B11R2.36 OC1=CC2=CC=NN2C=C1 Z1198176729 [2,0,0,0,0,0|2,0,0]=4 187 B11R2.10 BrC1=NC2=C(O1)C=CC=C2 Z733303132 [2,0,0,0,0,0|1,0,0]=3 188 B11R2.10 BrC1=NC2=C(S1)C=CC=C2 Z415645026 [2,0,0,0,0,0|1,1,0]=4 189 B11R2.10 CC1=CC2=C(O1)C=CC=C2 Z1255386706 [2,0,0,0,0,0|2,0,0]=4 190 B11R2.10 CC1=NC2=C(N1)C=CC=C2 Z55692894 [2,0,0,0,0,0|2,0,0]=4 191 B11R2.10 CC1=NC2=C(S1)C=CC=C2 Z2854344256 [2,0,0,0,0,0|1,1,0]=4 192 B11R2.10 ClC1=NC2=C(N1)C=CC=C2 Z276129254 [2,0,0,0,0,0|2,0,0]=4 193 B11R2.10 ClC1=NC2=C(O1)C=CC=C2 Z235343929 [2,0,0,0,0,0|1,0,0]=3 194 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [2,0,0,0,0,0|2,0,0]=4 195 B11R2.10 NC1=NC2=C(N1)C=CC=C2 Z104378302 [2,0,0,0,0,0|2,0,0]=4 196 B11R2.10 NC1=NC2=C(O1)C=CC=C2 Z57069972 [2,0,0,0,0,0|1,0,0]=3 197 B11R2.10 NC1=NC2=C(O1)C=CC=N2 Z1198313417 [2,0,0,0,0,0|2,0,0]=4 198 B11R2.10 NC1=NC2=C(O1)C=CN=C2 Z1255498597 [2,0,0,0,0,0|2,0,0]=4 199 B11R2.10 NC1=NC2=C(O1)N=CC=C2 Z1255498595 [2,0,0,0,0,0|2,0,0]=4 200 B11R2.10 NC1=NC2=C(S1)C=CC=C2 Z56912586 [2,0,0,0,0,0|1,1,0]=4 201 B11R2.10 O=C1NC2=C(O1)C=CC=C2 Z56854468 [2,0,0,0,0,0|0,0,2]=4 202 B11R2.10 OC1=CN2C=CC=CC2=N1 Z3305157547 [2,0,0,0,0,0|2,0,0]=4 203 B11R2.10 OC1=NN2C=CC=CC2=C1 Z1198235676 [2,0,0,0,0,0|2,0,0]=4 204 B11R2.10 SC1=NC2=C(N1)C=CC=C2 Z203045044 [2,0,0,0,0,0|1,1,0]=4 205 B11R2.10 SC1=NC2=C(O1)C=CC=C2 Z104499134 [2,0,0,0,0,0|0,1,0]=3 206 B11R2.10 SC1=NC2=C(O1)C=CC=N2 Z1201620735 [2,0,0,0,0,0|1,1,0]=4 207 B11R2.10 SC1=NC2=C(S1)C=CC=C2 Z104499140 [2,0,0,0,0,0|0,2,0]=4 208 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)Cl Z1205414415 [0,1,1,0,0,0|1,0,1]=4 209 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)Cl Z1269148038 [0,1,1,0,0,0|2,0,0]=4 210 B13R2.599 COC1=C(C=C2C=CNC2=C1)Cl Z1198165185 [1,1,0,0,0,0|2,0,0]=4 211 B13R2.599 COC1=C(C=C2N=CSC2=C1)N Z3243456329 [1,1,0,0,0,0|1,1,0]=4 212 B13R2.599 COC1=C(C=C2NC=CC2=C1)Cl Z1255373562 [1,1,0,0,0,0|1,0,1]=4 213 B13R2.599 OCC1=C(C=C2OCOC2=C1)Cl Z274630072 [1,1,0,0,0,0|1,0,1]=4 214 B13R2.43 CC1=CC2=C(C=C1)NC(=N2)CO Z57370049 [1,1,0,0,0,0|2,0,0]=4 215 B13R2.43 CC1=CC2=C(C=C1)SC(=N2)CO Z1255393536 [1,1,0,0,0,0|1,1,0]=4 216 B13R2.43 COC1=NC2=C(N1)C=CC(=C2)N Z1375686437 [1,1,0,0,0,0|2,0,0]=4 217 B13R2.43 CSC1=NC2=C(S1)C=CC(=C2)Cl Z18552842 [1,1,0,0,0,0|0,2,0]=4 218 B13R2.43 N#CC1=NC2=C(O1)C=CC(=C2)Cl Z1618169752 [1,1,0,0,0,0|1,0,0]=3 219 B13R2.43 NC1=CC2=C(C=C1)OC(=C2)CO Z1262684953 [1,1,0,0,0,0|2,0,0]=4 220 B13R2.43 NCC1=CC2=C(O1)C=CC(=C2)Cl Z2583434933 [1,1,0,0,0,0|2,0,0]=4 221 B13R2.43 NCC1=NC2=C(N1)C=CC(=C2)Cl Z1266933905 [1,1,0,0,0,0|2,0,0]=4 222 B13R2.43 NCC1=NC2=C(O1)C=C(C=C2)Br Z2217033071 [1,1,0,0,0,0|2,0,0]=4 223 B13R2.43 NCC1=NC2=C(O1)C=CC(=C2)Br Z2096088220 [1,1,0,0,0,0|1,1,0]=4 224 B13R2.43 NCC1=NC2=C(S1)C=CC(=C2)Cl Z319450042 [1,1,0,0,0,0|1,1,0]=4 225 B13R2.43 NNC1=NC2=C(S1)C=CC(=C2)Cl Z255150100 [1,1,0,0,0,0|1,1,0]=4 226 B13R2.43 O=CC1=CC2=C(O1)C=CC(=C2)Cl Z1198335266 [1,1,0,0,0,0|1,0,1]=4 227 B13R2.43 O=CC1=NC2=C(O1)C=C(C=C2)F Z1198182539 [1,1,0,0,0,0|1,0,1]=4 228 B13R2.43 O=CC1=NC2=C(O1)C=CC(=C2)Br Z1269206620 [1,1,0,0,0,0|0,1,1]=4 229 B13R2.43 O=CC1=NC2=C(O1)C=CC(=C2)F Z1198182537 [1,1,0,0,0,0|0,1,1]=4 230 B13R2.43 OCC1=NC2=C(N1)C=CC(=C2)Br Z1642061114 [1,1,0,0,0,0|1,1,0]=4 231 B13R2.43 OCC1=NC2=C(O1)C=C(C=C2)F Z1416203144 [1,1,0,0,0,0|1,0,0]=3 232 B13R2.43 OCC1=NC2=C(S1)C=CC(=C2)Cl Z228584310 [1,1,0,0,0,0|0,1,0]=3 233 B13R2.2121 CC1=NC2=C(O1)C=C(C=C2)C=O Z1322794612 [1,1,0,0,0,0|1,0,1]=4 234 B13R2.2121 CC1=NC2=C(O1)C=CC(=C2)C=O Z1251362210 [1,1,0,0,0,0|2,0,0]=4 235 B13R2.2121 CC1=NC2=C(S1)C=C(C=C2)CO Z56823516 [1,1,0,0,0,0|1,1,0]=4 236 B13R2.2121 CCC1=CC2=C(C=C1)N=C(N2)O Z1766245361 [1,1,0,0,0,0|2,0,0]=4 237 B13R2.2121 COC1=CC2=C(C=C1)N=C(S2)C Z90123542 [1,1,0,0,0,0|1,1,0]=4 238 B13R2.2121 COC1=CC2=C(C=C1)N=C(S2)N Z56756338 [1,1,0,0,0,0|1,1,0]=4 239 B13R2.2121 COC1=CC2=C(C=C1)OC(=N2)N Z1255435333 [1,1,0,0,0,0|2,0,0]=4 240 B13R2.2121 N#CC1=CC2=C(C=C1)N=C(O2)N Z1862023191 [1,1,0,0,0,0|2,0,0]=4 241 B13R2.2121 N#CC1=CC2=C(C=C1)OC(=N2)N Z1862023170 [1,1,0,0,0,0|2,0,0]=4 242 B13R2.2121 NC1=NC2=C(O1)C=C(C=C2)CO Z1262682792 [1,1,0,0,0,0|1,0,0]=3 243 B13R2.3050 CC1=C2N=C(SC2=CC=C1Cl)N Z1741967087 [1,1,0,0,0,0|1,1,0]=4 244 B13R2.3050 CC1=NC2=C(S1)C=CC(=C2N)Cl Z1262646775 [1,1,0,0,0,0|1,1,0]=4 245 B13R2.3050 NC1=NC2=C(S1)C=CC(=C2Cl)Cl Z57603637 [1,1,0,0,0,0|1,1,0]=4 246 B13R2.3050 NC1=NC2=C(S1)C=CC(=C2F)Cl Z1601562526 [1,1,0,0,0,0|1,1,0]=4 247 B13R2.5190 CN1C(=NC2=C1C=CC(=C2)Cl)N Z234896367 [1,1,0,0,0,0|2,0,0]=4 248 B13R2.5190 CN1C(=NC2=C1C=CC(=C2)Cl)S Z445165604 [1,1,0,0,0,0|1,1,0]=4 249 B13R2.5397 CC1=C2OC(=NC2=CC(=C1)Cl)N Z979487604 [1,1,0,0,0,0|1,0,0]=3 250 B13R2.5397 CC1=C2OC(=NC2=CC(=C1)Cl)S Z979487684 [1,1,0,0,0,0|0,1,0]=3 251 B13R2.5397 CC1=C2OC(=O)NC2=CC(=C1)Cl Z979487988 [1,1,0,0,0,0|0,0,2]=4 252 B13R2.5397 CC1=C2SC(=O)OC2=CC(=C1)O Z1513830609 [1,1,0,0,0,0|1,0,1]=4 253 B13R2.5397 CC1=CC2=C(OC(=N2)N)C(=C1)C Z979487632 [1,1,0,0,0,0|2,0,0]=4 254 B13R2.5397 CC1=NC2=C(O1)C(=CC(=C2)Br)Cl Z1269194800 [1,1,0,0,0,0|1,1,0]=4 255 B13R2.5397 CC1=NC2=C(O1)C(=CC(=C2)Br)N Z1269213869 [1,1,0,0,0,0|1,1,0]=4 256 B13R2.5397 CC1=NC2=C(O1)C(=CC(=C2)Cl)Br Z1269168710 [1,1,0,0,0,0|1,0,0]=3 257 B13R2.5397 FC1=CC2=C(OC(=N2)S)C(=C1)Cl Z979487672 [1,1,0,0,0,0|0,2,0]=4 258 B13R2.5397 NC1=NC2=C(O1)C(=CC(=C2)Br)Cl Z979487612 [1,1,0,0,0,0|1,1,0]=4 259 B13R2.5397 NC1=NC2=C(O1)C(=CC(=C2)Cl)Br Z979487636 [1,1,0,0,0,0|1,0,0]=3 260 B13R2.5397 NC1=NC2=C(O1)C(=CC(=C2)Cl)Cl Z979487618 [1,1,0,0,0,0|1,0,0]=3 261 B13R2.5397 O=C1OC2=C(S1)C(=CC(=C2)O)O Z1513858138 [1,1,0,0,0,0|1,0,1]=4 262 B13R2.5397 SC1=NC2=C(N1)C(=CC(=C2)Cl)Cl Z55928998 [1,1,0,0,0,0|1,1,0]=4 263 B15R2.59733 CC1=CC(=O)OC2=C1C=C(C(=C2)O)Cl Z57000606 [0,1,0,0,0,1|1,0,1]=4 264 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Cl Z57905816 [0,0,1,0,1,0|1,0,1]=4 265 B11R1.21 CC1=C(C=C(C=C1)B(O)O)Cl Z381540904 [0,0,1,0,1,0|2,0,0]=4 266 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Cl Z1097117588 [0,0,1,0,1,0|1,0,1]=4 267 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)O Z166652050 [0,0,1,0,1,0|2,0,0]=4 268 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Cl Z1201618086 [0,0,1,0,1,0|2,0,0]=4 269 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)O Z995149794 [0,0,1,0,1,0|1,0,1]=4 270 B11R1.21 N=C(N)C1=CC(=C(C=C1)Cl)Cl Z1416282440 [0,0,1,0,1,0|2,0,0]=4 271 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)Cl Z68591301 [0,0,1,0,1,0|1,0,1]=4 272 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)Cl Z1082868852 [0,0,1,0,1,0|1,0,1]=4 273 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)O Z431554234 [0,0,1,0,1,0|2,0,0]=4 274 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)Cl Z104478358 [0,0,1,0,1,0|2,0,0]=4 275 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)Cl Z1269111039 [0,0,1,0,1,0|1,0,1]=4 276 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)O Z1269234103 [0,0,1,0,1,0|1,1,0]=4 277 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)Br Z1269180540 [0,0,1,0,1,0|2,0,0]=4 278 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)Cl Z104474098 [0,0,1,0,1,0|1,0,1]=4 279 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)F Z636292752 [0,0,1,0,1,0|2,0,0]=4 280 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)I Z239685218 [0,0,1,0,1,0|2,0,0]=4 281 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)O Z1201619372 [0,0,1,0,1,0|1,0,0]=3 282 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)Cl Z1203161796 [0,0,1,0,1,0|1,0,1]=4 283 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)O Z1203161962 [0,0,1,0,1,0|1,1,0]=4 284 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)Cl Z1269153522 [0,0,1,0,1,0|1,0,1]=4 285 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)O Z1269202149 [0,0,1,0,1,0|1,1,0]=4 286 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)Br Z57985393 [0,0,1,0,1,0|0,1,1]=4 287 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)Cl Z104503564 [0,0,1,0,1,0|0,0,1]=3 288 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)F Z57073754 [0,0,1,0,1,0|0,1,1]=4 289 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)O Z104501142 [0,0,1,0,1,0|1,0,1]=4 290 B11R1.21 OB(O)C1=CC(=C(C=C1)Cl)Cl Z336080010 [0,0,1,0,1,0|2,0,0]=4 291 B11R1.21 OB(O)C1=CC(=C(C=C1)F)Cl Z381540890 [0,0,1,0,1,0|2,0,0]=4 292 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)O)Cl Z56823032 [0,0,1,0,0,1|2,0,0]=4 293 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)O)Cl Z839165388 [0,0,1,0,0,1|1,0,1]=4 294 B13R1.511 O=C(O)COC1=CC(=C(C=C1)Cl)Cl Z65558737 [0,0,1,0,0,1|2,0,0]=4 295 B13R1.511 O=C(O)COC1=CC(=C(C=C1)Cl)F Z1486018170 [0,0,1,0,0,1|2,0,0]=4 296 B13R2.155 CC1=CC2=C(C=C1)C=CC(=N2)O Z3300711621 [1,0,0,0,0,1|2,0,0]=4 297 B13R2.155 CC1=CC2=C(C=CC(=C2)O)N=C1 Z5038876053 [1,0,0,0,0,1|2,0,0]=4 298 B13R2.155 CC1=NC2=C(C=CC(=C2)Cl)C=C1 Z235542858 [1,0,0,0,0,1|2,0,0]=4 299 B13R2.155 CC1=NC=C2C=CC(=CC2=C1)O Z5244902488 [1,0,0,0,0,1|2,0,0]=4 300 B13R2.155 NC1=NC2=C(C=CC(=C2)Cl)C=C1 Z1255380140 [1,0,0,0,0,1|2,0,0]=4 301 B13R2.155 O=C1C=CC2=C(O1)C=C(C=C2)O Z57150899 [1,0,0,0,0,1|1,0,1]=4 302 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)Cl Z57515847 [1,0,0,0,0,1|0,0,2]=4 303 B13R2.155 O=C1NCC2=C(O1)C=C(C=C2)O Z2963142130 [1,0,0,0,0,1|0,0,2]=4 304 B13R2.155 OC1=CC2=C(C=C1)C=CC(=C2)O Z104495344 [1,0,0,0,0,1|2,0,0]=4 305 B13R2.155 OC1=CC2=C(C=C1)N=CC(=C2)Br Z1269182939 [1,0,0,0,0,1|2,0,0]=4 306 B13R2.155 OC1=CC2=C(C=C1)N=CC(=C2)I Z1269226225 [1,0,0,0,0,1|2,0,0]=4 307 B13R2.155 OC1=CC2=C(C=CC(=C2)Br)N=C1 Z1267861251 [1,0,0,0,0,1|2,0,0]=4 308 B13R2.155 OC1=CC2=C(C=CC(=C2)Cl)N=C1 Z1255461011 [1,0,0,0,0,1|2,0,0]=4 309 B13R2.155 OC1=CC2=C(C=CC(=C2)F)N=C1 Z1255366047 [1,0,0,0,0,1|2,0,0]=4 310 B13R2.3683 CC1=NC2=C(C=C1)C=C(C=C2)O Z1201618122 [1,0,0,0,0,1|2,0,0]=4 311 B13R2.3683 ClC1=CC2=C(C=C1)N=C(C=N2)Cl Z1255395545 [1,0,0,0,0,1|2,0,0]=4 312 B13R2.3683 FC1=NC2=C(C=C(C=C2)Cl)N=C1 Z1939441945 [1,0,0,0,0,1|2,0,0]=4 313 B13R2.3683 NC1=CC2=C(C=C1)N=C(C=C2)O Z424995464 [1,0,0,0,0,1|2,0,0]=4 314 B13R2.3683 O=C1C=NC2=C(N1)C=CC(=C2)Cl Z1198166471 [1,0,0,0,0,1|1,0,1]=4 315 B13R2.3683 OC1=CC2=C(C=C1)C=C(C=C2)O Z1255382953 [1,0,0,0,0,1|2,0,0]=4