0 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [0,0,0,0,0,0|1,0,0]=1 2 B9R1.8 CCCC1=NN=CC=C1 Z1486025396 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.8 CCNC1=NN=CC=C1 Z991530898 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.8 CCSC1=CC=NC=C1 Z1376454759 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.8 CNCC1=NC=CC=N1 Z2310727788 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.8 CNCC1=NC=CN=C1 Z385447136 [0,0,0,0,0,0|1,0,0]=1 12 B9R1.8 CNCC1=NC=NC=C1 Z2871313713 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.8 N#CCC1=CN=CC=C1 Z239871646 [0,0,0,0,0,0|2,0,1]=3 15 B9R1.8 N#CCC1=NC=CC=C1 Z104476888 [0,0,0,0,0,0|2,0,1]=3 16 B9R1.8 N#CCC1=NC=CN=C1 Z1098233793 [0,0,0,0,0,0|1,0,1]=2 17 B9R1.8 N#CCC1=NC=NC=C1 Z1098233919 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.8 NCCC1=CN=NC=C1 Z3070743015 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.8 NCCC1=NC=NC=C1 Z2935002210 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [0,0,0,0,0,0|3,0,1]=4 28 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.8 OCCC1=NC=CN=C1 Z234895105 [0,0,0,0,0,0|1,0,0]=1 32 B9R1.8 OCCC1=NC=NC=C1 Z1250886882 [0,0,0,0,0,0|3,0,0]=3 33 B8R1.2 C=CC1=NC=CC=C1 Z104495554 [1,0,0,0,0,0|1,0,2]=4 34 B8R1.2 CCC1=CC=CC=C1 Z104473632 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.2 CCC1=CC=NC=C1 Z1251171246 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.2 CCC1=CN=CC=C1 Z104476778 [1,0,0,0,0,0|1,0,0]=2 37 B8R1.2 CCC1=NC=CC=C1 Z113558650 [1,0,0,0,0,0|1,0,0]=2 38 B8R1.2 CCC1=NC=CC=N1 Z1198725952 [1,0,0,0,0,0|2,0,0]=3 39 B8R1.2 CCC1=NC=NC=C1 Z1198725956 [1,0,0,0,0,0|2,0,0]=3 40 B8R1.2 CCC1=NN=CC=C1 Z1222425026 [1,0,0,0,0,0|2,0,0]=3 41 B8R1.2 CNC1=CC=CC=C1 Z104472478 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.2 CNC1=CN=CC=C1 Z1082871080 [1,0,0,0,0,0|2,0,0]=3 43 B8R1.2 CNC1=NC=CC=N1 Z54628578 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.2 CNC1=NC=NC=C1 Z800212728 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.2 CNC1=NN=CC=C1 Z991530894 [1,0,0,0,0,0|3,0,0]=4 46 B8R1.2 CNC1=NN=CC=N1 Z1198323671 [1,0,0,0,0,0|2,0,0]=3 47 B8R1.2 COC1=CC=CC=C1 Z53833865 [1,0,0,0,0,0|3,0,0]=4 48 B8R1.2 CSC1=NC=CN=C1 Z1203162104 [1,0,0,0,0,0|1,0,0]=2 49 B8R1.2 N#CC1=CN=CC=C1 Z57899719 [1,0,0,0,0,0|2,0,1]=4 50 B8R1.2 N#CC1=NC=CN=C1 Z448103898 [1,0,0,0,0,0|1,0,1]=3 51 B8R1.2 NCC1=CC=CC=C1 Z54748260 [1,0,0,0,0,0|3,0,0]=4 52 B8R1.2 NCC1=CN=CC=C1 Z104474366 [1,0,0,0,0,0|2,0,0]=3 53 B8R1.2 NCC1=CN=CN=C1 Z3244401628 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.2 NCC1=NC=CC=C1 Z104474352 [1,0,0,0,0,0|2,0,0]=3 55 B8R1.2 NCC1=NC=CC=N1 Z1463350843 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.2 NCC1=NC=CN=C1 Z241059702 [1,0,0,0,0,0|1,0,0]=2 57 B8R1.2 NCC1=NC=NC=C1 Z254526552 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.2 NCC1=NN=CC=C1 Z1198165902 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.2 NNC1=NC=CC=C1 Z56887722 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.2 O=CC1=CN=CC=C1 Z104472124 [1,0,0,0,0,0|2,0,1]=4 61 B8R1.2 O=CC1=NC=CC=C1 Z104472152 [1,0,0,0,0,0|2,0,1]=4 62 B8R1.2 O=CC1=NC=CN=C1 Z1013412214 [1,0,0,0,0,0|1,0,1]=3 63 B8R1.2 OCC1=CC=CC=C1 Z104476418 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.2 OCC1=CN=CC=C1 Z104495622 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.2 OCC1=NC=CC=C1 Z57921252 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [0,1,0,0,0,0|3,0,0]=4 67 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [0,1,0,0,0,0|3,0,0]=4 68 B10R1.1 CC1=NC=C(C=C1)CCN Z600584220 [0,1,0,0,0,0|2,0,0]=3 69 B10R1.1 CC1=NC=C(N=C1)CCO Z1504684184 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.1 CCCC1=CC=C(C=C1)Br Z299596168 [0,1,0,0,0,0|2,0,0]=3 71 B10R1.1 CCCC1=CC=C(C=C1)N Z104492166 [0,1,0,0,0,0|2,0,0]=3 72 B10R1.1 CCNC1=CC=C(C=C1)Br Z286365048 [0,1,0,0,0,0|3,0,0]=4 73 B10R1.1 CCNC1=CC=C(C=C1)Cl Z2902298062 [0,1,0,0,0,0|3,0,0]=4 74 B10R1.1 CCNC1=CC=C(C=C1)F Z89270849 [0,1,0,0,0,0|3,0,0]=4 75 B10R1.1 CCNC1=CC=C(C=C1)N Z359511474 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.1 CCNC1=CC=C(C=C1)O Z1823256830 [0,1,0,0,0,0|3,0,0]=4 77 B10R1.1 CCNC1=CNC(=O)C=C1 Z5871830340 [0,1,0,0,0,0|2,0,1]=4 78 B10R1.1 CCNC1=NC=C(C=C1)Br Z359297778 [0,1,0,0,0,0|2,0,0]=3 79 B10R1.1 CCNC1=NC=C(C=C1)I Z2233927789 [0,1,0,0,0,0|2,0,0]=3 80 B10R1.1 CCNC1=NN=C(C=C1)C Z802821712 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.1 CCOC1=CC=C(C=C1)C Z53834228 [0,1,0,0,0,0|3,0,0]=4 82 B10R1.1 CCOC1=CC=C(C=C1)N Z57127438 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.1 CCOC1=CC=C(C=C1)S Z166646982 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.1 CCOC1=NC=C(C=C1)N Z240084310 [0,1,0,0,0,0|2,0,0]=3 85 B10R1.1 CCOC1=NC=C(C=N1)Cl Z1222423631 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.1 CCOC1=NN=C(C=C1)Cl Z291235530 [0,1,0,0,0,0|3,0,0]=4 87 B10R1.1 CCSC1=NC=C(C=C1)Br Z742922262 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.1 CCSC1=NC=C(C=C1)N Z332377604 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.1 CNCC1=CC=C(C=C1)Br Z56175269 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.1 CNCC1=CC=C(C=C1)Cl Z56956070 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.1 CNCC1=CC=C(C=C1)F Z56963340 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.1 CNCC1=CC=C(C=C1)I Z4242747560 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.1 CNCC1=CN=C(C=C1)Cl Z265498862 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.1 CNCC1=CN=C(C=C1)F Z1745074466 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.1 CNCC1=CN=C(C=C1)N Z1255388567 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.1 CNCC1=NC=C(C=C1)Br Z5436471179 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.1 CNCC1=NC=C(C=C1)C Z1255425232 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.1 CNCC1=NC=C(C=N1)Br Z2865349750 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.1 CNCC1=NC=C(N=C1)C Z2310677427 [0,1,0,0,0,0|1,0,0]=2 101 B10R1.1 COCC1=CC=C(C=C1)N Z240084568 [0,1,0,0,0,0|3,0,0]=4 102 B10R1.1 COCC1=NC=C(C=N1)N Z825741952 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.1 CSCC1=CC=C(C=C1)Br Z19854469 [0,1,0,0,0,0|3,0,0]=4 104 B10R1.1 CSCC1=CC=C(C=C1)N Z732207336 [0,1,0,0,0,0|3,0,0]=4 105 B10R1.1 CSCC1=CN=C(C=C1)Cl Z732206922 [0,1,0,0,0,0|2,0,0]=3 106 B10R1.1 N#CCC1=NC=C(C=C1)F Z1098233918 [0,1,0,0,0,0|2,0,1]=4 107 B10R1.1 NC1=CC=C(C=C1)CCO Z276600190 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.1 NC1=CN=C(C=C1)CCO Z1898597735 [0,1,0,0,0,0|2,0,0]=3 109 B10R1.1 NCCC1=CC=C(C=C1)Br Z285143750 [0,1,0,0,0,0|3,0,0]=4 110 B10R1.1 NCCC1=CC=C(C=C1)Cl Z57051065 [0,1,0,0,0,0|3,0,0]=4 111 B10R1.1 NCCC1=CC=C(C=C1)F Z90122126 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.1 NCCC1=CC=C(C=C1)I Z2515133713 [0,1,0,0,0,0|3,0,0]=4 113 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.1 NCCC1=CN=C(C=C1)Cl Z1198178633 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.1 NCCC1=CN=C(N=C1)O Z2725055726 [0,1,0,0,0,0|3,0,0]=4 116 B10R1.1 NCCC1=NC=C(C=C1)F Z2238508662 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.1 NCCC1=NC=C(C=C1)O Z2350909287 [0,1,0,0,0,0|2,0,0]=3 118 B10R1.1 NCCC1=NC=C(C=N1)Br Z4752114140 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.1 O=C1N=CC(=CN1)CCO Z2096659590 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.1 OCCC1=CC=C(C=C1)Br Z397587340 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.1 OCCC1=CC=C(C=C1)F Z397587326 [0,1,0,0,0,0|3,0,0]=4 122 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.4 CC1=C(C=CC=N1)CC#N Z1198263560 [0,1,0,0,0,0|2,0,1]=4 124 B10R1.4 CC1=C(C=NC=C1)CCN Z1198264124 [0,1,0,0,0,0|2,0,0]=3 125 B10R1.4 CC1=C(N=CC=C1)CCN Z1098234132 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.4 CC1=C(N=CC=C1)CCO Z1198169041 [0,1,0,0,0,0|2,0,0]=3 127 B10R1.4 CC1=C(N=CC=N1)CCO Z1198163945 [0,1,0,0,0,0|1,0,0]=2 128 B10R1.4 CCCC1=C(C=CC=C1)Br Z1479686725 [0,1,0,0,0,0|2,0,0]=3 129 B10R1.4 CCCC1=C(C=CC=C1)I Z821158622 [0,1,0,0,0,0|2,0,0]=3 130 B10R1.4 CCCC1=C(C=CC=C1)N Z336087926 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.4 CCCC1=C(N=CC=N1)Cl Z1504680268 [0,1,0,0,0,0|0,0,0]=1 132 B10R1.4 CCNC1=C(C=CC=C1)C Z104477886 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.4 CCNC1=C(C=CC=C1)F Z286518592 [0,1,0,0,0,0|3,0,0]=4 134 B10R1.4 CCNC1=C(C=CC=C1)I Z4405452872 [0,1,0,0,0,0|3,0,0]=4 135 B10R1.4 CCNC1=C(C=CC=C1)N Z359511482 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.4 CCNC1=C(C=CC=C1)O Z5185414820 [0,1,0,0,0,0|3,0,0]=4 137 B10R1.4 CCNC1=C(C=CC=N1)C Z968907586 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.4 CCNC1=C(C=CC=N1)N Z803145254 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.4 CCNC1=C(C=CN=C1)C Z1946684572 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.4 CCOC1=C(C=CC=C1)Br Z153728256 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.4 CCOC1=C(C=CC=C1)I Z406416174 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.4 CCOC1=C(C=CC=C1)N Z104478442 [0,1,0,0,0,0|3,0,0]=4 143 B10R1.4 CCOC1=C(C=CC=C1)O Z104480244 [0,1,0,0,0,0|3,0,0]=4 144 B10R1.4 CCOC1=C(C=CC=N1)N Z240084312 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.4 CCOC1=C(N=CC=C1)N Z362783900 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.4 CCSC1=C(C=CC=C1)Br Z149386616 [0,1,0,0,0,0|3,0,0]=4 147 B10R1.4 CCSC1=C(C=CC=C1)N Z316174690 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.4 CCSC1=C(C=CC=C1)O Z905204460 [0,1,0,0,0,0|3,0,0]=4 149 B10R1.4 CCSC1=CC=CNC1=O Z1509297963 [0,1,0,0,0,0|2,0,1]=4 150 B10R1.4 CCSC1=[N+](C=CC=C1)[O-] Z18546433 [0,1,0,0,0,0|2,0,1]=4 151 B10R1.4 CNCC1=C(C=CC=C1)C Z56948272 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.4 CNCC1=C(C=CC=C1)Cl Z56955956 [0,1,0,0,0,0|3,0,0]=4 153 B10R1.4 CNCC1=C(C=CC=C1)F Z56953087 [0,1,0,0,0,0|3,0,0]=4 154 B10R1.4 CNCC1=C(C=CC=C1)N Z764242576 [0,1,0,0,0,0|3,0,0]=4 155 B10R1.4 CNCC1=C(C=CC=C1)O Z398513608 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.4 CNCC1=C(C=CC=N1)Cl Z5392638231 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.4 COCC1=C(C=CC=C1)I Z821093342 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.4 COCC1=C(C=CC=C1)O Z821093528 [0,1,0,0,0,0|3,0,0]=4 159 B10R1.4 COCC1=C(N=CC=C1)N Z991490684 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.4 CSCC1=C(C=CC=C1)N Z732207148 [0,1,0,0,0,0|3,0,0]=4 161 B10R1.4 ClCCC1=C(N=CN=C1)Cl Z1262489672 [0,1,0,0,0,0|3,0,0]=4 162 B10R1.4 N#CCC1=C(N=CC=C1)Cl Z1198263561 [0,1,0,0,0,0|2,0,1]=4 163 B10R1.4 N#CCC1=C(N=CC=N1)Cl Z1255498354 [0,1,0,0,0,0|1,0,1]=3 164 B10R1.4 NC1=C(C=CC=C1)CCO Z3417485770 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.4 NCCC1=C(C=CC=C1)Br Z295382782 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.4 NCCC1=C(C=CC=C1)Cl Z285143744 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.4 NCCC1=C(C=CC=C1)F Z57051087 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.4 NCCC1=C(C=CC=C1)O Z594038184 [0,1,0,0,0,0|3,0,0]=4 169 B10R1.4 NCCC1=C(N=CC=C1)O Z5862214540 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.4 NCCN1C=CC=NC1=O Z3038857671 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.4 NCCN1C=NC=CC1=O Z2379084242 [0,1,0,0,0,0|3,0,0]=4 172 B10R1.4 NCCN1N=CC=CC1=O Z1021422614 [0,1,0,0,0,0|3,0,0]=4 173 B10R1.4 O=C1C=CC=NN1CCO Z1021424276 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.4 O=C1C=CN=CN1CCO Z1154747269 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.4 OCCC1=C(C=CC=C1)Br Z1183459188 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.4 OCCC1=C(C=CC=C1)F Z397587382 [0,1,0,0,0,0|3,0,0]=4 177 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.10 CC1=NC(=CC=C1)CCN Z1098234194 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.10 CC1=NC(=NC=C1)CCO Z1255460290 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.10 CCCC1=CC(=CC=C1)Br Z1541586975 [0,1,0,0,0,0|2,0,0]=3 181 B10R1.10 CCCC1=CC(=NN=C1)Cl Z4580564381 [0,1,0,0,0,0|2,0,0]=3 182 B10R1.10 CCCC1=CC(=NN=C1)N Z4580562529 [0,1,0,0,0,0|2,0,0]=3 183 B10R1.10 CCCC1=CC(=O)NN=C1 Z1198341234 [0,1,0,0,0,0|2,0,0]=3 184 B10R1.10 CCCC1=NC(=CC=N1)N Z856211250 [0,1,0,0,0,0|2,0,0]=3 185 B10R1.10 CCNC1=CC(=CC=C1)Br Z1217910559 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.10 CCNC1=CC(=CC=C1)C Z56785946 [0,1,0,0,0,0|3,0,0]=4 187 B10R1.10 CCNC1=CC(=CC=C1)Cl Z286371690 [0,1,0,0,0,0|3,0,0]=4 188 B10R1.10 CCOC1=CC(=CC=C1)Br Z53833934 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.10 CCOC1=CC(=CC=C1)I Z54181578 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.10 CCOC1=NC(=CC=C1)C Z1198168604 [0,1,0,0,0,0|2,0,0]=3 191 B10R1.10 CCOC1=NC(=CC=C1)N Z1139188017 [0,1,0,0,0,0|2,0,0]=3 192 B10R1.10 CCOC1=NC(=CN=C1)Cl Z291235528 [0,1,0,0,0,0|1,0,0]=2 193 B10R1.10 CCOC1=NC(=CN=C1)N Z1198727889 [0,1,0,0,0,0|1,0,0]=2 194 B10R1.10 CCOC1=NC(=NC=C1)N Z1203581620 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.10 CCSC1=CC(=CC=C1)Br Z1090207966 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.10 CCSC1=CC(=CC=C1)N Z600393424 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.10 CCSC1=CC=CC(=O)N1 Z3004833863 [0,1,0,0,0,0|2,0,1]=4 198 B10R1.10 CCSC1=NC(=CN=C1)Cl Z408197356 [0,1,0,0,0,0|1,0,0]=2 199 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.10 CNCC1=CC(=CC=C1)Cl Z56963343 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.10 CNCC1=CC(=CC=C1)F Z56946085 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.10 CNCC1=CC(=CC=C1)I Z3302798080 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.10 CNCC1=CC(=CN=C1)Br Z5095377359 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.10 CNCC1=CC=CC(=O)N1 Z2895739022 [0,1,0,0,0,0|2,0,1]=4 206 B10R1.10 CNCC1=NC(=CC=C1)C Z1255523287 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.10 CNCC1=NC=CC(=C1)C Z5443664854 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.10 CNCC1=NC=CC(=C1)Cl Z3214695745 [0,1,0,0,0,0|2,0,0]=3 209 B10R1.10 COCC1=CC(=CC=C1)N Z285163816 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.10 COCC1=NC(=CC=N1)Cl Z825742010 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.10 COCC1=NC(=CC=N1)N Z960787432 [0,1,0,0,0,0|3,0,0]=4 213 B10R1.10 COCC1=NC(=NC=C1)N Z1203583301 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.10 COCC1=NC(=O)C=CN1 Z3023823655 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.10 COCC1=NC=NC(=C1)Cl Z975855190 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.10 COCC1=NC=NC(=C1)N Z975850638 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.10 COCC1=NC=NC(=C1)O Z1459946056 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.10 N#CCC1=CC=CC(=N1)N Z1255362030 [0,1,0,0,0,0|2,0,1]=4 221 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [0,1,0,0,0,0|3,0,0]=4 226 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [0,1,0,0,0,0|3,0,0]=4 227 B10R1.10 NCCC1=CC(=CN=C1)O Z1504671788 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.10 NCCC1=NC(=NC=C1)N Z5619121124 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.10 NCCC1=NC=NC(=C1)Br Z4513781102 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.10 NCCC1=NC=NC(=C1)O Z2310716008 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.15 C/N=C(\N)/C1=CN=CC=C1 Z2528328215 [0,1,0,0,0,0|2,0,1]=4 234 B10R1.15 CC(CBr)C1=CC=CC=C1 Z756118300 [0,1,0,0,0,0|3,0,0]=4 235 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [0,1,0,0,0,0|2,0,1]=4 236 B10R1.15 CCC(=O)C1=CN=CN=C1 Z992240310 [0,1,0,0,0,0|2,0,1]=4 237 B10R1.15 CCC(N)C1=CC=CC=C1 Z1262252904 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.15 CCC(N)C1=CC=NC=C1 Z228583312 [0,1,0,0,0,0|3,0,0]=4 239 B10R1.15 CCC(O)C1=CC=CC=C1 Z335245178 [0,1,0,0,0,0|2,0,0]=3 240 B10R1.15 CCC(O)C1=CC=NC=C1 Z513749638 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.15 CNC(=N)C1=NC=CC=C1 Z2735598147 [0,1,0,0,0,0|2,0,1]=4 242 B10R1.15 CNC(=O)C1=NC=CC=C1 Z32016284 [0,1,0,0,0,0|2,0,1]=4 243 B10R1.15 CNC(C)C1=CC=CC=C1 Z85917524 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.15 CNC(C)C1=CN=CC=C1 Z451350188 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.15 CNC(C)C1=NC=CC=C1 Z451350194 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.15 COC(=O)C1=CN=CC=C1 Z57036282 [0,1,0,0,0,0|2,0,1]=4 247 B10R1.15 COC(=O)C1=NC=CC=C1 Z19673259 [0,1,0,0,0,0|2,0,1]=4 248 B10R1.15 COC(=O)C1=NC=CN=C1 Z18351140 [0,1,0,0,0,0|1,0,1]=3 249 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [0,1,0,0,0,0|3,0,0]=4 250 B10R1.15 N#CC(N)C1=CN=CC=C1 Z4339467200 [0,1,0,0,0,0|2,0,1]=4 251 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.15 NC(CO)C1=CN=CC=C1 Z2350903961 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.15 NCC(O)C1=CN=CC=C1 Z336086578 [0,1,0,0,0,0|2,0,0]=3 256 B10R1.15 NCC(O)C1=NC=CC=C1 Z802671456 [0,1,0,0,0,0|2,0,0]=3 257 B10R1.15 NNC(=O)C1=NC=CN=C1 Z58981894 [0,1,0,0,0,0|2,0,1]=4 258 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.15 O=C(CCl)C1=CN=CC=C1 Z2768198137 [0,1,0,0,0,0|2,0,1]=4 261 B10R1.15 O=C(CCl)C1=NC=CC=C1 Z1205657985 [0,1,0,0,0,0|2,0,1]=4 262 B10R1.15 OCC(O)C1=NC=CC=C1 Z4985119178 [0,1,0,0,0,0|2,0,0]=3 263 B10R1.17 BrCCOC1=CC=CC=C1 Z56950513 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.17 CCCCC1=CC=CC=C1 Z104492496 [0,1,0,0,0,0|2,0,0]=3 265 B10R1.17 CCCNC1=CN=CC=C1 Z334882412 [0,1,0,0,0,0|1,0,0]=2 266 B10R1.17 CCCOC1=NC=CN=C1 Z2182020100 [0,1,0,0,0,0|0,0,0]=1 267 B10R1.17 CCCSC1=NC=CC=N1 Z18380759 [0,1,0,0,0,0|2,0,0]=3 268 B10R1.17 CCNCC1=CC=CC=C1 Z57327176 [0,1,0,0,0,0|2,0,0]=3 269 B10R1.17 CCNCC1=CC=NC=C1 Z57327181 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.17 CCNCC1=NC=CC=C1 Z90513146 [0,1,0,0,0,0|1,0,0]=2 271 B10R1.17 CCSCC1=NC=CC=C1 Z1607601848 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.17 CNCCC1=CC=CC=C1 Z445226260 [0,1,0,0,0,0|2,0,0]=3 273 B10R1.17 CNCCC1=CC=NC=C1 Z235580560 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.17 CNCCC1=CN=CC=C1 Z2418466818 [0,1,0,0,0,0|1,0,0]=2 275 B10R1.17 CNCCC1=NC=CC=C1 Z2238930991 [0,1,0,0,0,0|1,0,0]=2 276 B10R1.17 CNCCC1=NC=CC=N1 Z3023337072 [0,1,0,0,0,0|2,0,0]=3 277 B10R1.17 COCCC1=CC=CC=C1 Z104494216 [0,1,0,0,0,0|2,0,0]=3 278 B10R1.17 N#CCCC1=CC=CC=C1 Z104507980 [0,1,0,0,0,0|2,0,1]=4 279 B10R1.17 N#CCNC1=NC=CC=C1 Z1203732480 [0,1,0,0,0,0|2,0,1]=4 280 B10R1.17 N#CCSC1=NC=CC=C1 Z54336898 [0,1,0,0,0,0|2,0,1]=4 281 B10R1.17 NC/C=C/C1=CN=CC=C1 Z2216303151 [0,1,0,0,0,0|1,0,2]=4 282 B10R1.17 NCC#CC1=NC=CC=C1 Z1456201642 [0,1,0,0,0,0|1,0,2]=4 283 B10R1.17 NCCCC1=CC=CC=C1 Z104478312 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.17 NCCCC1=CN=CC=C1 Z3058301115 [0,1,0,0,0,0|1,0,0]=2 285 B10R1.17 NCCCC1=CN=NC=C1 Z3270187722 [0,1,0,0,0,0|2,0,0]=3 286 B10R1.17 NCCCC1=NC=CC=C1 Z600381818 [0,1,0,0,0,0|1,0,0]=2 287 B10R1.17 NCCCC1=NC=CN=C1 Z1474025943 [0,1,0,0,0,0|0,0,0]=1 288 B10R1.17 NCCNC1=NC=CC=C1 Z85923460 [0,1,0,0,0,0|2,0,0]=3 289 B10R1.17 NCCNC1=NC=CC=N1 Z381428982 [0,1,0,0,0,0|3,0,0]=4 290 B10R1.17 NCCNC1=NN=CC=C1 Z991530796 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [0,1,0,0,0,0|3,0,0]=4 292 B10R1.17 NCCOC1=CN=CC=C1 Z429662874 [0,1,0,0,0,0|2,0,0]=3 293 B10R1.17 NCCOC1=NC=CC=N1 Z4381809298 [0,1,0,0,0,0|3,0,0]=4 294 B10R1.17 NCCSC1=CC=CC=C1 Z57970213 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.17 NNCCC1=CC=CC=C1 Z927192062 [0,1,0,0,0,0|3,0,0]=4 296 B10R1.17 O=CCCC1=CC=CC=C1 Z87002472 [0,1,0,0,0,0|2,0,1]=4 297 B10R1.17 O=CCCC1=CN=CC=C1 Z1198276578 [0,1,0,0,0,0|1,0,1]=3 298 B10R1.17 O=CCCC1=NC=CC=C1 Z1079158816 [0,1,0,0,0,0|1,0,1]=3 299 B10R1.17 O=CCOC1=NC=CC=C1 Z1255434510 [0,1,0,0,0,0|2,0,1]=4 300 B10R1.17 OCC#CC1=NC=CC=C1 Z1143356057 [0,1,0,0,0,0|1,0,2]=4 301 B10R1.17 OCC#CC1=NC=CN=C1 Z1183457797 [0,1,0,0,0,0|0,0,2]=3 302 B10R1.17 OCCCC1=CC=CC=C1 Z104476660 [0,1,0,0,0,0|2,0,0]=3 303 B10R1.17 OCCCC1=CC=NC=C1 Z104475752 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.17 OCCCC1=CN=CC=C1 Z104479004 [0,1,0,0,0,0|1,0,0]=2 305 B10R1.17 OCCCC1=NC=NC=C1 Z2044799287 [0,1,0,0,0,0|2,0,0]=3 306 B10R1.17 OCCNC1=NC=CC=C1 Z31212159 [0,1,0,0,0,0|2,0,0]=3 307 B10R1.17 OCCNC1=NC=CC=N1 Z31212160 [0,1,0,0,0,0|3,0,0]=4 308 B10R1.17 OCCNC1=NC=CN=C1 Z31212301 [0,1,0,0,0,0|1,0,0]=2 309 B10R1.17 OCCNC1=NN=CC=C1 Z991531008 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.17 OCCOC1=CC=CC=C1 Z104473570 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.17 OCCOC1=CN=CC=C1 Z1180078238 [0,1,0,0,0,0|2,0,0]=3 312 B10R1.17 OCCSC1=CC=CC=C1 Z149157348 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.18 CC(=O)CC1=NC=CN=C1 Z1098219337 [0,1,0,0,0,0|0,0,1]=2 314 B10R1.18 CC(=O)NC1=CN=CC=C1 Z31791378 [0,1,0,0,0,0|2,0,1]=4 315 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [0,1,0,0,0,0|2,0,0]=3 316 B10R1.18 CC(C)CC1=NC=CC=C1 Z1201621742 [0,1,0,0,0,0|1,0,0]=2 317 B10R1.18 CC(C)NC1=CC=CC=C1 Z104475020 [0,1,0,0,0,0|3,0,0]=4 318 B10R1.18 CC(C)NC1=CN=CC=C1 Z334882282 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.18 CC(C)NC1=NC=CC=N1 Z31190928 [0,1,0,0,0,0|3,0,0]=4 320 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [0,1,0,0,0,0|3,0,0]=4 321 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [0,1,0,0,0,0|3,0,0]=4 322 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [0,1,0,0,0,0|1,0,0]=2 325 B10R1.18 CN(C)CC1=CN=CC=C1 Z140563088 [0,1,0,0,0,0|2,0,0]=3 326 B10R1.18 CN(C)CC1=NC=CC=C1 Z4614651190 [0,1,0,0,0,0|2,0,0]=3 327 B10R1.18 FC(F)OC1=CN=CC=C1 Z808605476 [0,1,0,0,0,0|3,0,0]=4 328 B10R1.18 N=C(N)CC1=CN=CC=C1 Z2350941593 [0,1,0,0,0,0|2,0,1]=4 329 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [0,1,0,0,0,0|2,0,1]=4 330 B8R0.1 C=CCCC(=O)CCC Z406377524 [0,0,1,0,0,0|2,0,1]=4 331 B10R2.6 C1=CC(=CC=N1)C2CC2 Z3042074264 [0,0,0,1,0,0|3,0,0]=4 332 B10R2.6 C1=CC(=CN=C1)C2CO2 Z1187818722 [0,0,0,1,0,0|2,0,0]=3 333 B10R2.6 C1=CC=C(C=C1)C2CO2 Z104486008 [0,0,0,1,0,0|3,0,0]=4 334 B10R2.6 C1=CC=C(C=C1)[C@@H]2CO2 Z1255356265 [0,0,0,1,0,0|3,0,0]=4 335 B10R2.6 C1=CC=C(C=C1)[C@H]2CO2 Z1255390768 [0,0,0,1,0,0|3,0,0]=4 336 B10R2.6 C1=CN=C(C=C1)C2CO2 Z1187818707 [0,0,0,1,0,0|2,0,0]=3 337 B10R2.7 C1=CC2=C(C=C1)CNC2 Z1263820391 [0,0,0,1,0,0|3,0,0]=4 338 B10R2.7 C1=CC2=C(C=C1)COC2 Z839134770 [0,0,0,1,0,0|3,0,0]=4 339 B10R2.7 C1=CC2=C(C=C1)NCC2 Z104475582 [0,0,0,1,0,0|3,0,0]=4 340 B10R2.7 C1=CC2=C(C=C1)OCC2 Z104505448 [0,0,0,1,0,0|3,0,0]=4 341 B10R2.7 C1=CC2=C(C=N1)CCN2 Z1650168304 [0,0,0,1,0,0|2,0,0]=3 342 B10R2.7 C1=CC2=C(C=N1)CCO2 Z1681336163 [0,0,0,1,0,0|2,0,0]=3 343 B10R2.7 C1=CC2=C(C=N1)NCC2 Z1603826893 [0,0,0,1,0,0|2,0,0]=3 344 B10R2.7 C1=CC2=C(CCN2)N=C1 Z1203748137 [0,0,0,1,0,0|2,0,0]=3 345 B10R2.7 C1=CC2=C(CNC2)N=C1 Z1741974952 [0,0,0,1,0,0|2,0,0]=3 346 B10R2.7 C1=CC2=C(N1)N=CC=N2 Z1198233190 [0,0,0,1,0,0|1,0,2]=4 347 B10R2.7 C1=CC2=C(N=C1)NCC2 Z979438826 [0,0,0,1,0,0|2,0,0]=3 348 B10R2.7 C1=NC2=C(N=C1)NC=N2 Z1198180623 [0,0,0,1,0,0|2,0,1]=4 349 B10R2.7 C1=NC2=C(N=C1)SC=N2 Z2044801495 [0,0,0,1,0,0|2,0,1]=4 350 B10R2.7 C1=NC=NC2=C1CNC2 Z1741974398 [0,0,0,1,0,0|3,0,0]=4 351 B10R2.320 NC1CC2=C1C=CC=C2 Z1918018858 [0,0,0,1,0,0|3,0,0]=4 352 B8R1.8 C#CCN1C=CC=N1 Z804946014 [0,0,0,0,1,0|1,0,2]=4 353 B8R1.8 C#CCN1C=CN=C1 Z1258992451 [0,0,0,0,1,0|1,0,2]=4 354 B8R1.8 C=CCN1C=CN=C1 Z104477560 [0,0,0,0,1,0|1,0,2]=4 355 B8R1.8 CCCC1=CNN=C1 Z1263714332 [0,0,0,0,1,0|1,0,0]=2 356 B8R1.8 CCCC1=NC=CN1 Z1201043633 [0,0,0,0,1,0|0,0,1]=2 357 B8R1.8 CCCC1=NN=NN1 Z335295252 [0,0,0,0,1,0|2,0,0]=3 358 B8R1.8 CCCC1=NNC=N1 Z803077816 [0,0,0,0,1,0|1,0,0]=2 359 B8R1.8 CCNC1=NC=CN1 Z1463350447 [0,0,0,0,1,0|1,0,1]=3 360 B8R1.8 CCNC1=NC=CS1 Z86243266 [0,0,0,0,1,0|2,0,0]=3 361 B8R1.8 CCNC1=NC=NN1 Z1203735308 [0,0,0,0,1,0|2,0,0]=3 362 B8R1.8 CCNC1=NN=CO1 Z1823617731 [0,0,0,0,1,0|3,0,0]=4 363 B8R1.8 CCNC1=NN=CS1 Z1082872548 [0,0,0,0,1,0|3,0,0]=4 364 B8R1.8 CCOC1=CNN=C1 Z1726113833 [0,0,0,0,1,0|2,0,0]=3 365 B8R1.8 CCOC1=NNC=C1 Z1416187675 [0,0,0,0,1,0|2,0,0]=3 366 B8R1.8 CNCC1=CC=CN1 Z102767010 [0,0,0,0,1,0|1,0,1]=3 367 B8R1.8 CNCC1=CC=CO1 Z57051072 [0,0,0,0,1,0|2,0,0]=3 368 B8R1.8 CNCC1=CC=CS1 Z56948283 [0,0,0,0,1,0|2,0,0]=3 369 B8R1.8 CNCC1=CNN=C1 Z1267881670 [0,0,0,0,1,0|2,0,0]=3 370 B8R1.8 CNCC1=CNN=N1 Z2568737812 [0,0,0,0,1,0|2,0,1]=4 371 B8R1.8 CNCC1=COC=C1 Z385447092 [0,0,0,0,1,0|2,0,0]=3 372 B8R1.8 CNCC1=CSC=C1 Z57206125 [0,0,0,0,1,0|2,0,0]=3 373 B8R1.8 CNCC1=CSC=N1 Z138108610 [0,0,0,0,1,0|2,0,0]=3 374 B8R1.8 CNCC1=NC=CN1 Z445210554 [0,0,0,0,1,0|1,0,1]=3 375 B8R1.8 CNCC1=NC=CO1 Z5810628036 [0,0,0,0,1,0|2,0,0]=3 376 B8R1.8 CNCC1=NC=CS1 Z802607826 [0,0,0,0,1,0|2,0,0]=3 377 B8R1.8 CNCC1=NN=CN1 Z1575082063 [0,0,0,0,1,0|2,0,1]=4 378 B8R1.8 CNCC1=NN=CS1 Z4663887855 [0,0,0,0,1,0|3,0,0]=4 379 B8R1.8 CNCC1=NNC=C1 Z445185804 [0,0,0,0,1,0|2,0,0]=3 380 B8R1.8 CNCC1=NNN=N1 Z1250080922 [0,0,0,0,1,0|3,0,0]=4 381 B8R1.8 CNCC1=NOC=C1 Z802903302 [0,0,0,0,1,0|2,0,0]=3 382 B8R1.8 CNCC1=NOC=N1 Z2143572220 [0,0,0,0,1,0|2,0,0]=3 383 B8R1.8 COCC1=CNC=N1 Z1203733599 [0,0,0,0,1,0|1,0,1]=3 384 B8R1.8 COCC1=NC=CN1 Z1203733422 [0,0,0,0,1,0|1,0,1]=3 385 B8R1.8 COCC1=NN=NN1 Z1000888 [0,0,0,0,1,0|3,0,0]=4 386 B8R1.8 COCC1=NNC=C1 Z1270114780 [0,0,0,0,1,0|2,0,0]=3 387 B8R1.8 COCC1=NNC=N1 Z1201627056 [0,0,0,0,1,0|2,0,0]=3 388 B8R1.8 ClCCN1C=CN=C1 Z94599643 [0,0,0,0,1,0|2,0,0]=3 389 B8R1.8 N#CCC1=CC=CN1 Z810507734 [0,0,0,0,1,0|1,0,2]=4 390 B8R1.8 N#CCC1=CC=NO1 Z90662868 [0,0,0,0,1,0|2,0,1]=4 391 B8R1.8 N#CCC1=CN=CN1 Z1198166128 [0,0,0,0,1,0|1,0,2]=4 392 B8R1.8 N#CCC1=CNN=C1 Z875024638 [0,0,0,0,1,0|2,0,1]=4 393 B8R1.8 N#CCC1=CON=C1 Z600429582 [0,0,0,0,1,0|2,0,1]=4 394 B8R1.8 N#CCC1=CSC=C1 Z111869576 [0,0,0,0,1,0|2,0,1]=4 395 B8R1.8 N#CCC1=CSC=N1 Z164707272 [0,0,0,0,1,0|2,0,1]=4 396 B8R1.8 N#CCC1=NC=CN1 Z331689878 [0,0,0,0,1,0|1,0,2]=4 397 B8R1.8 N#CCC1=NOC=C1 Z1192378401 [0,0,0,0,1,0|2,0,1]=4 398 B8R1.8 N#CCN1C=CC=N1 Z295205174 [0,0,0,0,1,0|2,0,1]=4 399 B8R1.8 N#CCN1C=NC=N1 Z295205188 [0,0,0,0,1,0|2,0,1]=4 400 B8R1.8 NCCC1=CC=CN1 Z810507730 [0,0,0,0,1,0|1,0,1]=3 401 B8R1.8 NCCC1=CC=CO1 Z1694636467 [0,0,0,0,1,0|2,0,0]=3 402 B8R1.8 NCCC1=CC=CS1 Z90662945 [0,0,0,0,1,0|2,0,0]=3 403 B8R1.8 NCCC1=CC=NS1 Z2768432862 [0,0,0,0,1,0|2,0,0]=3 404 B8R1.8 NCCC1=CNC=N1 Z1267773750 [0,0,0,0,1,0|1,0,1]=3 405 B8R1.8 NCCC1=CNN=C1 Z336080532 [0,0,0,0,1,0|2,0,0]=3 406 B8R1.8 NCCC1=CNN=N1 Z3005762594 [0,0,0,0,1,0|2,0,1]=4 407 B8R1.8 NCCC1=COC=C1 Z2310701825 [0,0,0,0,1,0|2,0,0]=3 408 B8R1.8 NCCC1=NC=CO1 Z4925106850 [0,0,0,0,1,0|2,0,0]=3 409 B8R1.8 NCCC1=NC=CS1 Z2724334997 [0,0,0,0,1,0|2,0,0]=3 410 B8R1.8 NCCC1=NN=CN1 Z1687906395 [0,0,0,0,1,0|2,0,1]=4 411 B8R1.8 NCCC1=NN=CS1 Z3067374940 [0,0,0,0,1,0|3,0,0]=4 412 B8R1.8 NCCC1=NN=NN1 Z1160899439 [0,0,0,0,1,0|3,0,0]=4 413 B8R1.8 NCCC1=NNC=C1 Z2867120994 [0,0,0,0,1,0|2,0,0]=3 414 B8R1.8 NCCC1=NOC=N1 Z1262691677 [0,0,0,0,1,0|2,0,0]=3 415 B8R1.8 NCCN1C=CC=N1 Z271005714 [0,0,0,0,1,0|2,0,0]=3 416 B8R1.8 NCCN1C=CN=C1 Z147642864 [0,0,0,0,1,0|2,0,0]=3 417 B8R1.8 NCCN1C=CN=N1 Z2491107416 [0,0,0,0,1,0|3,0,0]=4 418 B8R1.8 NCCN1C=NC=N1 Z381061410 [0,0,0,0,1,0|2,0,0]=3 419 B8R1.8 NCCN1C=NN=N1 Z2065464306 [0,0,0,0,1,0|3,0,0]=4 420 B8R1.8 NCCN1N=CN=N1 Z2070537934 [0,0,0,0,1,0|3,0,0]=4 421 B8R1.8 O=CCC1=CC=CO1 Z1179944709 [0,0,0,0,1,0|2,0,1]=4 422 B8R1.8 O=CCC1=CC=CS1 Z993017816 [0,0,0,0,1,0|2,0,1]=4 423 B8R1.8 O=CCC1=CSC=C1 Z1079442684 [0,0,0,0,1,0|2,0,1]=4 424 B8R1.8 OCCC1=CC=CO1 Z1179944660 [0,0,0,0,1,0|2,0,0]=3 425 B8R1.8 OCCC1=CC=CS1 Z397587354 [0,0,0,0,1,0|2,0,0]=3 426 B8R1.8 OCCC1=CN=CS1 Z1198334159 [0,0,0,0,1,0|2,0,0]=3 427 B8R1.8 OCCC1=CNN=C1 Z1333876037 [0,0,0,0,1,0|2,0,0]=3 428 B8R1.8 OCCC1=CNN=N1 Z982120080 [0,0,0,0,1,0|2,0,1]=4 429 B8R1.8 OCCC1=COC=C1 Z1179944659 [0,0,0,0,1,0|2,0,0]=3 430 B8R1.8 OCCC1=CSC=C1 Z397587098 [0,0,0,0,1,0|2,0,0]=3 431 B8R1.8 OCCC1=CSC=N1 Z1263714384 [0,0,0,0,1,0|2,0,0]=3 432 B8R1.8 OCCN1C=CC=N1 Z425794824 [0,0,0,0,1,0|2,0,0]=3 433 B8R1.8 OCCN1C=NC=N1 Z234898253 [0,0,0,0,1,0|2,0,0]=3 434 B7R1.3 BrC1=NC=CN=C1 Z415645016 [2,0,0,0,0,0|1,0,0]=3 435 B7R1.3 CC1=CN=CC=C1 Z104475010 [2,0,0,0,0,0|1,0,0]=3 436 B7R1.3 CC1=CN=NC=C1 Z1255398931 [2,0,0,0,0,0|2,0,0]=4 437 B7R1.3 CC1=NC=CC=C1 Z104472800 [2,0,0,0,0,0|1,0,0]=3 438 B7R1.3 CC1=NC=CN=C1 Z415628164 [2,0,0,0,0,0|0,0,0]=2 439 B7R1.3 CC1=NN=CC=C1 Z1245648324 [2,0,0,0,0,0|2,0,0]=4 440 B7R1.3 ClC1=NC=CN=C1 Z104490192 [2,0,0,0,0,0|1,0,0]=3 441 B7R1.3 IC1=NC=CN=C1 Z1235940810 [2,0,0,0,0,0|1,0,0]=3 442 B7R1.3 NC1=CN=CC=C1 Z104494800 [2,0,0,0,0,0|2,0,0]=4 443 B7R1.3 NC1=NC=CC=C1 Z104472278 [2,0,0,0,0,0|2,0,0]=4 444 B7R1.3 NC1=NC=CN=C1 Z56899063 [2,0,0,0,0,0|1,0,0]=3 445 B7R1.3 NC1=NC=NN=C1 Z1203581736 [2,0,0,0,0,0|2,0,0]=4 446 B7R1.3 NC1=NN=CC=N1 Z104477884 [2,0,0,0,0,0|2,0,0]=4 447 B7R1.3 O=C1C=NC=CN1 Z3225868124 [2,0,0,0,0,0|1,0,1]=4 448 B7R1.3 OC1=CN=CC=C1 Z104476790 [2,0,0,0,0,0|2,0,0]=4 449 B7R1.3 SC1=NC=CC=C1 Z203045372 [2,0,0,0,0,0|2,0,0]=4 450 B7R1.3 SC1=NC=CN=C1 Z239089534 [2,0,0,0,0,0|1,0,0]=3 451 B9R1.1 BrCC1=NC=C(N=C1)Br Z3244822385 [1,1,0,0,0,0|1,0,0]=3 452 B9R1.1 C#CC1=CN=C(C=N1)Cl Z1255362190 [1,1,0,0,0,0|0,0,2]=4 453 B9R1.1 CC1=CN=C(C=C1)CO Z1198270889 [1,1,0,0,0,0|2,0,0]=4 454 B9R1.1 CC1=NC=C(C=C1)CN Z444349734 [1,1,0,0,0,0|2,0,0]=4 455 B9R1.1 CC1=NC=C(C=C1)CO Z397587474 [1,1,0,0,0,0|2,0,0]=4 456 B9R1.1 CC1=NC=C(N=C1)C#N Z1198164470 [1,1,0,0,0,0|1,0,1]=4 457 B9R1.1 CC1=NC=C(N=C1)C=O Z1079442402 [1,1,0,0,0,0|1,0,1]=4 458 B9R1.1 CC1=NC=C(N=C1)CN Z3271770568 [1,1,0,0,0,0|1,0,0]=3 459 B9R1.1 CC1=NC=C(N=C1)CO Z397587476 [1,1,0,0,0,0|1,0,0]=3 460 B9R1.1 CCC1=CC=C(C=C1)I Z381540768 [1,1,0,0,0,0|2,0,0]=4 461 B9R1.1 CCC1=CC=C(C=C1)N Z104477836 [1,1,0,0,0,0|2,0,0]=4 462 B9R1.1 CCC1=CC=C(C=C1)O Z104479728 [1,1,0,0,0,0|2,0,0]=4 463 B9R1.1 CCC1=CN=C(C=C1)N Z1198224278 [1,1,0,0,0,0|1,0,0]=3 464 B9R1.1 CCC1=CN=C(N=C1)Br Z1255367602 [1,1,0,0,0,0|2,0,0]=4 465 B9R1.1 CCC1=CN=C(N=C1)Cl Z1255423971 [1,1,0,0,0,0|2,0,0]=4 466 B9R1.1 CCC1=CN=C(N=C1)N Z1137168329 [1,1,0,0,0,0|2,0,0]=4 467 B9R1.1 CCC1=NC=C(C=N1)N Z381402598 [1,1,0,0,0,0|2,0,0]=4 468 B9R1.1 CCC1=NC=C(N=C1)Br Z1198319305 [1,1,0,0,0,0|0,0,0]=2 469 B9R1.1 CNC1=NC=C(C=C1)Br Z359297630 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.1 CNC1=NC=C(C=C1)C Z359297596 [1,1,0,0,0,0|2,0,0]=4 471 B9R1.1 CNC1=NC=C(C=C1)Cl Z359297632 [1,1,0,0,0,0|2,0,0]=4 472 B9R1.1 CNC1=NC=C(C=C1)F Z802823886 [1,1,0,0,0,0|2,0,0]=4 473 B9R1.1 COC1=CN=C(C=C1)C Z1198232754 [1,1,0,0,0,0|2,0,0]=4 474 B9R1.1 COC1=NC=C(C=C1)Br Z808608370 [1,1,0,0,0,0|2,0,0]=4 475 B9R1.1 COC1=NC=C(C=C1)Cl Z1094698482 [1,1,0,0,0,0|2,0,0]=4 476 B9R1.1 COC1=NC=C(C=C1)N Z56899049 [1,1,0,0,0,0|2,0,0]=4 477 B9R1.1 COC1=NC=C(C=C1)O Z1201623942 [1,1,0,0,0,0|2,0,0]=4 478 B9R1.1 CSC1=CN=C(C=C1)N Z412025068 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.1 CSC1=NC=C(C=C1)N Z412022842 [1,1,0,0,0,0|2,0,0]=4 480 B9R1.1 CSC1=NN=C(C=N1)C Z1255500736 [1,1,0,0,0,0|2,0,0]=4 481 B9R1.1 ClCC1=NC=C(N=C1)Cl Z1198277950 [1,1,0,0,0,0|1,0,0]=3 482 B9R1.1 N#CC1=CN=C(C=N1)Cl Z1095350204 [1,1,0,0,0,0|1,0,1]=4 483 B9R1.1 N#CC1=CN=C(C=N1)F Z1681360151 [1,1,0,0,0,0|1,0,1]=4 484 B9R1.1 NC1=NC=C(C=C1)CO Z960446254 [1,1,0,0,0,0|2,0,0]=4 485 B9R1.1 NC1=NC=C(N=C1)CO Z1203583050 [1,1,0,0,0,0|1,0,0]=3 486 B9R1.1 NCC1=CN=C(C=C1)Cl Z247612574 [1,1,0,0,0,0|2,0,0]=4 487 B9R1.1 NCC1=CN=C(C=C1)F Z1198311144 [1,1,0,0,0,0|2,0,0]=4 488 B9R1.1 NCC1=CN=C(C=C1)O Z1269638445 [1,1,0,0,0,0|2,0,0]=4 489 B9R1.1 NCC1=NC=C(C=C1)Br Z3241254216 [1,1,0,0,0,0|2,0,0]=4 490 B9R1.1 NCC1=NC=C(C=C1)Cl Z636367336 [1,1,0,0,0,0|2,0,0]=4 491 B9R1.1 NCC1=NC=C(C=C1)F Z1198277779 [1,1,0,0,0,0|2,0,0]=4 492 B9R1.1 NCC1=NC=C(C=C1)N Z3244746175 [1,1,0,0,0,0|2,0,0]=4 493 B9R1.1 NCC1=NC=C(C=C1)O Z3324887230 [1,1,0,0,0,0|2,0,0]=4 494 B9R1.1 NCC1=NC=C(N=C1)Br Z1416181963 [1,1,0,0,0,0|1,0,0]=3 495 B9R1.1 NCC1=NC=C(N=C1)Cl Z1198278893 [1,1,0,0,0,0|1,0,0]=3 496 B9R1.1 OCC1=NC=C(C=C1)Br Z1065600752 [1,1,0,0,0,0|2,0,0]=4 497 B9R1.1 OCC1=NC=C(C=C1)Cl Z1198272591 [1,1,0,0,0,0|2,0,0]=4 498 B9R1.1 OCC1=NC=C(C=C1)O Z1217915045 [1,1,0,0,0,0|2,0,0]=4 499 B9R1.1 OCC1=NC=C(N=C1)Br Z1255381074 [1,1,0,0,0,0|1,0,0]=3 500 B9R1.2 CC1=CC(=CN=C1)CN Z1198167984 [1,1,0,0,0,0|2,0,0]=4 501 B9R1.2 CC1=CC(=CN=C1)CO Z4562296729 [1,1,0,0,0,0|2,0,0]=4 502 B9R1.2 CC1=NC(=CC=C1)CN Z291234028 [1,1,0,0,0,0|2,0,0]=4 503 B9R1.2 CC1=NC(=CC=C1)CO Z397587486 [1,1,0,0,0,0|2,0,0]=4 504 B9R1.2 CC1=NC(=CN=C1)C#N Z1198181973 [1,1,0,0,0,0|1,0,1]=4 505 B9R1.2 CCC1=CC(=CC=C1)Br Z1201619408 [1,1,0,0,0,0|2,0,0]=4 506 B9R1.2 CCC1=CC(=CC=C1)N Z104478688 [1,1,0,0,0,0|2,0,0]=4 507 B9R1.2 CCC1=NC(=CC=C1)C Z1255485781 [1,1,0,0,0,0|1,0,0]=3 508 B9R1.2 CCC1=NC(=CC=N1)Cl Z445153086 [1,1,0,0,0,0|2,0,0]=4 509 B9R1.2 CCC1=NC(=NC=C1)Cl Z1198279743 [1,1,0,0,0,0|2,0,0]=4 510 B9R1.2 CCC1=NC(=NC=C1)N Z1203579436 [1,1,0,0,0,0|2,0,0]=4 511 B9R1.2 CCC1=NC=NC(=C1)Br Z798339806 [1,1,0,0,0,0|2,0,0]=4 512 B9R1.2 CCC1=NC=NC(=C1)Cl Z798251108 [1,1,0,0,0,0|2,0,0]=4 513 B9R1.2 CCC1=NC=NC(=C1)N Z798339040 [1,1,0,0,0,0|2,0,0]=4 514 B9R1.2 CCC1=NC=NC(=C1)O Z798251110 [1,1,0,0,0,0|2,0,0]=4 515 B9R1.2 CNC1=CC(=CN=C1)Br Z1255444030 [1,1,0,0,0,0|2,0,0]=4 516 B9R1.2 CNC1=NC(=CC=C1)C Z600403388 [1,1,0,0,0,0|2,0,0]=4 517 B9R1.2 COC1=NC(=CC=C1)O Z1198172138 [1,1,0,0,0,0|2,0,0]=4 518 B9R1.2 COC1=NC(=CN=C1)N Z1198261569 [1,1,0,0,0,0|1,0,0]=3 519 B9R1.2 COC1=NC=CC(=C1)Cl Z1201623697 [1,1,0,0,0,0|2,0,0]=4 520 B9R1.2 CSC1=CC(=CN=C1)N Z2239020735 [1,1,0,0,0,0|2,0,0]=4 521 B9R1.2 CSC1=NC(=CN=C1)Cl Z732207920 [1,1,0,0,0,0|1,0,0]=3 522 B9R1.2 CSC1=NC(=CN=N1)C Z1255426895 [1,1,0,0,0,0|2,0,0]=4 523 B9R1.2 CSC1=NC=CC(=C1)N Z851811592 [1,1,0,0,0,0|2,0,0]=4 524 B9R1.2 CSC1=NC=CC(=C1)O Z1255421960 [1,1,0,0,0,0|2,0,0]=4 525 B9R1.2 ClCC1=CC(=CN=C1)Br Z381037204 [1,1,0,0,0,0|2,0,0]=4 526 B9R1.2 ClCC1=NC(=CN=C1)Cl Z1255357868 [1,1,0,0,0,0|1,0,0]=3 527 B9R1.2 N#CC1=CN=CC(=N1)Br Z1165304242 [1,1,0,0,0,0|1,0,1]=4 528 B9R1.2 N#CC1=CN=CC(=N1)Cl Z1165304152 [1,1,0,0,0,0|1,0,1]=4 529 B9R1.2 N#CC1=CN=CC(=N1)F Z1681360134 [1,1,0,0,0,0|1,0,1]=4 530 B9R1.2 NC1=CC(=NC=C1)CO Z1198310848 [1,1,0,0,0,0|2,0,0]=4 531 B9R1.2 NC1=NC(=CC=C1)CO Z154209994 [1,1,0,0,0,0|2,0,0]=4 532 B9R1.2 NC1=NC(=CN=C1)CO Z1203641562 [1,1,0,0,0,0|1,0,0]=3 533 B9R1.2 NCC1=CC(=CN=C1)Br Z2692250391 [1,1,0,0,0,0|2,0,0]=4 534 B9R1.2 NCC1=CC(=CN=C1)Cl Z3244925674 [1,1,0,0,0,0|2,0,0]=4 535 B9R1.2 NCC1=CC(=CN=C1)O Z2310701794 [1,1,0,0,0,0|2,0,0]=4 536 B9R1.2 NCC1=NC(=CC=C1)N Z2310698959 [1,1,0,0,0,0|2,0,0]=4 537 B9R1.2 NCC1=NC(=CN=C1)Cl Z3235038825 [1,1,0,0,0,0|1,0,0]=3 538 B9R1.2 NCC1=NC=CC(=C1)Cl Z1198173013 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.2 NCC1=NC=CC(=C1)N Z2310678270 [1,1,0,0,0,0|2,0,0]=4 540 B9R1.2 NNC1=NC(=CN=C1)Cl Z319443864 [1,1,0,0,0,0|2,0,0]=4 541 B9R1.2 OCC1=CC(=CN=C1)Br Z381037198 [1,1,0,0,0,0|2,0,0]=4 542 B9R1.2 OCC1=NC(=CC=C1)O Z1198343459 [1,1,0,0,0,0|2,0,0]=4 543 B9R1.2 OCC1=NC=CC(=C1)Cl Z979714554 [1,1,0,0,0,0|2,0,0]=4 544 B9R1.6 CC(=O)C1=CN=CC=C1 Z104474436 [1,1,0,0,0,0|1,0,1]=4 545 B9R1.6 CC(=O)C1=NC=CC=C1 Z104474432 [1,1,0,0,0,0|1,0,1]=4 546 B9R1.6 CC(=O)C1=NC=CN=C1 Z513735920 [1,1,0,0,0,0|0,0,1]=3 547 B9R1.6 CC(C)C1=NC=CC=C1 Z1198148831 [1,1,0,0,0,0|1,0,0]=3 548 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [1,1,0,0,0,0|2,0,0]=4 549 B9R1.6 CC(N)C1=CN=CC=C1 Z85921957 [1,1,0,0,0,0|1,0,0]=3 550 B9R1.6 CC(N)C1=NC=CC=C1 Z56347059 [1,1,0,0,0,0|1,0,0]=3 551 B9R1.6 CC(N)C1=NC=CC=N1 Z2945456281 [1,1,0,0,0,0|2,0,0]=4 552 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.6 CC(O)C1=CN=CC=C1 Z335245084 [1,1,0,0,0,0|1,0,0]=3 554 B9R1.6 CC(O)C1=NC=CC=C1 Z335244914 [1,1,0,0,0,0|1,0,0]=3 555 B9R1.6 CC(O)C1=NC=CN=C1 Z513751834 [1,1,0,0,0,0|0,0,0]=2 556 B9R1.6 CN(C)C1=CN=CC=C1 Z1201619922 [1,1,0,0,0,0|2,0,0]=4 557 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [1,1,0,0,0,0|2,0,0]=4 561 B9R1.6 N=C(N)C1=NC=CN=C1 Z1741973428 [1,1,0,0,0,0|1,0,1]=4 562 B9R1.6 NC(=O)C1=NC=CN=C1 Z33546644 [1,1,0,0,0,0|1,0,1]=4 563 B9R1.6 NC(=S)C1=NC=CN=C1 Z234895463 [1,1,0,0,0,0|1,0,1]=4 564 B9R1.6 O=C(O)C1=NC=CN=C1 Z104476002 [1,1,0,0,0,0|1,0,1]=4 565 B9R1.15 C#CC1=C(N=CC=N1)Cl Z1258977238 [1,1,0,0,0,0|0,0,2]=4 566 B9R1.15 CC1=C(C=NC=C1)CO Z1198156922 [1,1,0,0,0,0|2,0,0]=4 567 B9R1.15 CC1=C(N=CC=C1)CO Z976637084 [1,1,0,0,0,0|2,0,0]=4 568 B9R1.15 CC1=C(N=CC=N1)C#N Z1198181979 [1,1,0,0,0,0|1,0,1]=4 569 B9R1.15 CC1=C(N=CC=N1)C=O Z1198233269 [1,1,0,0,0,0|1,0,1]=4 570 B9R1.15 CC1=C(N=CC=N1)CN Z3671696702 [1,1,0,0,0,0|1,0,0]=3 571 B9R1.15 CCC1=C(C=CC=C1)Br Z1255457372 [1,1,0,0,0,0|2,0,0]=4 572 B9R1.15 CCC1=C(C=CC=C1)O Z104477226 [1,1,0,0,0,0|2,0,0]=4 573 B9R1.15 CCC1=C(C=NC=N1)O Z1618133826 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.15 CCC1=C(N=CC=C1)N Z1192017773 [1,1,0,0,0,0|1,0,0]=3 575 B9R1.15 CCC1=C(N=CC=C1)O Z1198266674 [1,1,0,0,0,0|1,0,0]=3 576 B9R1.15 CCC1=C(N=CC=N1)Cl Z1198149374 [1,1,0,0,0,0|0,0,0]=2 577 B9R1.15 CCC1=C(N=CC=N1)N Z1203580180 [1,1,0,0,0,0|0,0,0]=2 578 B9R1.15 CCC1=CNC=CC1=N Z1525649973 [1,1,0,0,0,0|1,0,1]=4 579 B9R1.15 CCC1=NC=CNC1=O Z3274889193 [1,1,0,0,0,0|0,0,1]=3 580 B9R1.15 CCC1=NNC=NC1=O Z1201628993 [1,1,0,0,0,0|1,0,0]=3 581 B9R1.15 CNC1=C(C=CC=N1)Br Z808603280 [1,1,0,0,0,0|2,0,0]=4 582 B9R1.15 CNC1=C(C=CC=N1)C Z968907582 [1,1,0,0,0,0|2,0,0]=4 583 B9R1.15 CNC1=C(C=CC=N1)F Z997723632 [1,1,0,0,0,0|2,0,0]=4 584 B9R1.15 CNC1=C(C=CC=N1)N Z803145504 [1,1,0,0,0,0|2,0,0]=4 585 B9R1.15 CNC1=C(C=CN=C1)C Z1124504699 [1,1,0,0,0,0|2,0,0]=4 586 B9R1.15 CNC1=C(N=CC=C1)C Z1295808975 [1,1,0,0,0,0|2,0,0]=4 587 B9R1.15 CNC1=C(N=CC=C1)N Z1203578357 [1,1,0,0,0,0|2,0,0]=4 588 B9R1.15 CNC1=C(N=CC=N1)C Z2768516750 [1,1,0,0,0,0|1,0,0]=3 589 B9R1.15 COC1=C(C=CC=N1)N Z240084308 [1,1,0,0,0,0|2,0,0]=4 590 B9R1.15 COC1=C(C=CC=N1)O Z1255423921 [1,1,0,0,0,0|2,0,0]=4 591 B9R1.15 COC1=C(N=CC=C1)C Z1198150814 [1,1,0,0,0,0|2,0,0]=4 592 B9R1.15 COC1=C(N=CC=C1)N Z362783902 [1,1,0,0,0,0|2,0,0]=4 593 B9R1.15 COC1=C(N=CC=N1)N Z1198166025 [1,1,0,0,0,0|1,0,0]=3 594 B9R1.15 CSC1=C(C=CC=N1)Br Z808605456 [1,1,0,0,0,0|2,0,0]=4 595 B9R1.15 CSC1=C(N=CC=C1)N Z1203640622 [1,1,0,0,0,0|2,0,0]=4 596 B9R1.15 ClCC1=C(N=CC=N1)Cl Z934373154 [1,1,0,0,0,0|1,0,0]=3 597 B9R1.15 N#CC1=C(N=CC=N1)Br Z995020080 [1,1,0,0,0,0|1,0,1]=4 598 B9R1.15 N#CC1=C(N=CC=N1)Cl Z992759282 [1,1,0,0,0,0|1,0,1]=4 599 B9R1.15 N#CC1=C(N=CC=N1)N Z995018904 [1,1,0,0,0,0|1,0,1]=4 600 B9R1.15 N#CC1=C(N=CC=N1)O Z995023286 [1,1,0,0,0,0|1,0,1]=4 601 B9R1.15 NC1=C(N=CC=N1)CO Z1198237691 [1,1,0,0,0,0|1,0,0]=3 602 B9R1.15 NCC1=C(C=CC=N1)F Z1575304378 [1,1,0,0,0,0|2,0,0]=4 603 B9R1.15 NCC1=C(C=CC=N1)N Z1198181626 [1,1,0,0,0,0|2,0,0]=4 604 B9R1.15 NCC1=C(C=CC=N1)O Z1198156472 [1,1,0,0,0,0|2,0,0]=4 605 B9R1.15 NCC1=C(C=CN=C1)Cl Z3386909551 [1,1,0,0,0,0|2,0,0]=4 606 B9R1.15 NCC1=C(C=CN=C1)N Z1742055036 [1,1,0,0,0,0|2,0,0]=4 607 B9R1.15 NCC1=C(N=CC=N1)Cl Z2472857434 [1,1,0,0,0,0|1,0,0]=3 608 B9R1.15 OCC1=C(C=CN=C1)Cl Z1741982140 [1,1,0,0,0,0|2,0,0]=4 609 B9R1.15 OCC1=C(N=CC=C1)Cl Z979431808 [1,1,0,0,0,0|2,0,0]=4 610 B9R1.7 CC1=CC=C(S1)CCN Z3038322398 [0,1,0,0,1,0|2,0,0]=4 611 B9R1.7 CC1=CN(N=C1)CCN Z600430704 [0,1,0,0,1,0|2,0,0]=4 612 B9R1.7 CC1=CN=C(S1)CCN Z994267436 [0,1,0,0,1,0|2,0,0]=4 613 B9R1.7 CC1=NC(=CS1)CCN Z1744689874 [0,1,0,0,1,0|2,0,0]=4 614 B9R1.7 CC1=NC(=CS1)CCO Z1201624831 [0,1,0,0,1,0|2,0,0]=4 615 B9R1.7 CC1=NC(=NN1)CCN Z1263602348 [0,1,0,0,1,0|2,0,0]=4 616 B9R1.7 CC1=NC(=NO1)CCN Z1682072467 [0,1,0,0,1,0|2,0,0]=4 617 B9R1.7 CC1=NC=C(O1)CCN Z3251575034 [0,1,0,0,1,0|2,0,0]=4 618 B9R1.7 CC1=NC=C(S1)CCN Z1079164344 [0,1,0,0,1,0|2,0,0]=4 619 B9R1.7 CC1=NN(C=C1)CCN Z3248014730 [0,1,0,0,1,0|2,0,0]=4 620 B9R1.7 CC1=NN(C=C1)CCO Z3306020937 [0,1,0,0,1,0|2,0,0]=4 621 B9R1.7 CC1=NOC(=C1)CCN Z2092369291 [0,1,0,0,1,0|2,0,0]=4 622 B9R1.7 CC1=NOC(=N1)CCN Z969559798 [0,1,0,0,1,0|2,0,0]=4 623 B9R1.7 CCCC1=CC(=O)NN1 Z2583036240 [0,1,0,0,1,0|1,0,1]=4 624 B9R1.7 CCCC1=CN=C(S1)N Z1203578740 [0,1,0,0,1,0|1,0,0]=3 625 B9R1.7 CCCC1=CNC(=O)N1 Z1203732484 [0,1,0,0,1,0|0,0,2]=4 626 B9R1.7 CCCC1=CSC(=N1)N Z1582264042 [0,1,0,0,1,0|1,0,0]=3 627 B9R1.7 CCCC1=NC(=N)SN1 Z1262398408 [0,1,0,0,1,0|1,0,1]=4 628 B9R1.7 CCCC1=NC(=NN1)C Z385478576 [0,1,0,0,1,0|1,0,0]=3 629 B9R1.7 CCCC1=NN=C(N1)S Z56921538 [0,1,0,0,1,0|1,0,1]=4 630 B9R1.7 CCCC1=NN=C(O1)N Z285233902 [0,1,0,0,1,0|2,0,0]=4 631 B9R1.7 CCCC1=NN=C(S1)Br Z1136468837 [0,1,0,0,1,0|2,0,0]=4 632 B9R1.7 CCCC1=NN=C(S1)N Z56768598 [0,1,0,0,1,0|2,0,0]=4 633 B9R1.7 CCCC1=NNC(=C1)N Z1266854936 [0,1,0,0,1,0|1,0,0]=3 634 B9R1.7 CCCC1=NNC(=O)O1 Z1206172050 [0,1,0,0,1,0|2,0,0]=4 635 B9R1.7 CCCC1=NOC(=C1)N Z56979375 [0,1,0,0,1,0|1,0,0]=3 636 B9R1.7 CCCN1C=NC(=C1)N Z3210756298 [0,1,0,0,1,0|1,0,0]=3 637 B9R1.7 CCNC1=CN(N=C1)C Z431528348 [0,1,0,0,1,0|2,0,0]=4 638 B9R1.7 CCNC1=NC(=CS1)C Z48854598 [0,1,0,0,1,0|2,0,0]=4 639 B9R1.7 CCOC1=CC(=NN1)C Z1198153548 [0,1,0,0,1,0|2,0,0]=4 640 B9R1.7 CCOC1=NC(=CS1)Cl Z1581816962 [0,1,0,0,1,0|2,0,0]=4 641 B9R1.7 CCOC1=NC(=NN1)N Z1203590921 [0,1,0,0,1,0|2,0,0]=4 642 B9R1.7 CCOC1=NNC(=C1)N Z2755865748 [0,1,0,0,1,0|2,0,0]=4 643 B9R1.7 CN1C=C(C=N1)CCN Z335291636 [0,1,0,0,1,0|2,0,0]=4 644 B9R1.7 CN1C=C(C=N1)CCO Z992949632 [0,1,0,0,1,0|2,0,0]=4 645 B9R1.7 CN1C=CC(=N1)CCO Z1551881302 [0,1,0,0,1,0|2,0,0]=4 646 B9R1.7 CN1C=NC(=C1)CCN Z5632546328 [0,1,0,0,1,0|1,0,1]=4 647 B9R1.7 CN1C=NC(=N1)CCN Z1682072425 [0,1,0,0,1,0|2,0,0]=4 648 B9R1.7 CN1N=CC(=N1)CCO Z2179941262 [0,1,0,0,1,0|2,0,0]=4 649 B9R1.7 CNCC1=CC(=NO1)C Z3013892391 [0,1,0,0,1,0|2,0,0]=4 650 B9R1.7 CNCC1=CC=C(O1)Br Z102767192 [0,1,0,0,1,0|2,0,0]=4 651 B9R1.7 CNCC1=CC=C(O1)C Z56957484 [0,1,0,0,1,0|2,0,0]=4 652 B9R1.7 CNCC1=CC=C(S1)C Z198747904 [0,1,0,0,1,0|2,0,0]=4 653 B9R1.7 CNCC1=CC=C(S1)Cl Z57057714 [0,1,0,0,1,0|2,0,0]=4 654 B9R1.7 CNCC1=CN(N=C1)C Z102767934 [0,1,0,0,1,0|2,0,0]=4 655 B9R1.7 CNCC1=CN=C(S1)C Z432733330 [0,1,0,0,1,0|2,0,0]=4 656 B9R1.7 CNCC1=COC(=N1)C Z3098872713 [0,1,0,0,1,0|2,0,0]=4 657 B9R1.7 CNCC1=CSC(=C1)Br Z401703212 [0,1,0,0,1,0|2,0,0]=4 658 B9R1.7 CNCC1=CSC(=N1)C Z102767814 [0,1,0,0,1,0|2,0,0]=4 659 B9R1.7 CNCC1=NC(=NN1)C Z1250092411 [0,1,0,0,1,0|2,0,0]=4 660 B9R1.7 CNCC1=NN(C=N1)C Z3671702899 [0,1,0,0,1,0|2,0,0]=4 661 B9R1.7 CNCC1=NNC(=N1)N Z3767381039 [0,1,0,0,1,0|2,0,0]=4 662 B9R1.7 CNCC1=NOC(=C1)C Z138107414 [0,1,0,0,1,0|2,0,0]=4 663 B9R1.7 CNCC1=NOC(=N1)O Z2379448767 [0,1,0,0,1,0|2,0,0]=4 664 B9R1.7 COCC1=CSC(=N1)N Z381058668 [0,1,0,0,1,0|2,0,0]=4 665 B9R1.7 COCC1=NC(=NN1)C Z802558914 [0,1,0,0,1,0|2,0,0]=4 666 B9R1.7 COCC1=NOC(=N1)N Z991477832 [0,1,0,0,1,0|2,0,0]=4 667 B9R1.7 COCC1=NSC(=N1)N Z825741966 [0,1,0,0,1,0|2,0,0]=4 668 B9R1.7 COCN1C=C(C=N1)N Z1198164922 [0,1,0,0,1,0|2,0,0]=4 669 B9R1.7 CSCC1=NN(C=C1)C Z1578701131 [0,1,0,0,1,0|2,0,0]=4 670 B9R1.7 FCCN1C=C(C=N1)Br Z1272990808 [0,1,0,0,1,0|2,0,0]=4 671 B9R1.7 NC1=CN(N=C1)CCO Z802665932 [0,1,0,0,1,0|2,0,0]=4 672 B9R1.7 NC1=NC(=CS1)CCO Z1198266841 [0,1,0,0,1,0|2,0,0]=4 673 B9R1.7 NC1=NC=C(S1)CCO Z1203580148 [0,1,0,0,1,0|2,0,0]=4 674 B9R1.7 NC1=NN(C=C1)CCO Z451325036 [0,1,0,0,1,0|2,0,0]=4 675 B9R1.7 NC1=NN(C=N1)CCO Z600615284 [0,1,0,0,1,0|2,0,0]=4 676 B9R1.7 NCCC1=CC=C(O1)Br Z1442016604 [0,1,0,0,1,0|2,0,0]=4 677 B9R1.7 NCCC1=CC=C(S1)Cl Z432066930 [0,1,0,0,1,0|2,0,0]=4 678 B9R1.7 NCCC1=CC=C(S1)I Z1262398458 [0,1,0,0,1,0|2,0,0]=4 679 B9R1.7 NCCC1=CSC(=C1)Br Z4125344523 [0,1,0,0,1,0|2,0,0]=4 680 B9R1.7 NCCC1=CSC(=N1)N Z1901070719 [0,1,0,0,1,0|2,0,0]=4 681 B9R1.7 NCCC1=NC(=NN1)N Z2168541806 [0,1,0,0,1,0|2,0,0]=4 682 B9R1.7 NCCC1=NC(=NO1)N Z1259340155 [0,1,0,0,1,0|2,0,0]=4 683 B9R1.7 NCCN1C=C(C=N1)I Z3183972621 [0,1,0,0,1,0|2,0,0]=4 684 B9R1.7 OCCN1C=C(C=N1)Br Z337709454 [0,1,0,0,1,0|2,0,0]=4 685 B9R1.11 CC(CN)C1=CC=CS1 Z803101386 [0,1,0,0,1,0|2,0,0]=4 686 B9R1.11 CC(CN)C1=CN=CN1 Z2865711302 [0,1,0,0,1,0|1,0,1]=4 687 B9R1.11 CC(CN)C1=NC=CN1 Z3205686355 [0,1,0,0,1,0|1,0,1]=4 688 B9R1.11 CC(CN)C1=NC=CS1 Z994266314 [0,1,0,0,1,0|2,0,0]=4 689 B9R1.11 CC(CN)C1=NOC=N1 Z2899612303 [0,1,0,0,1,0|2,0,0]=4 690 B9R1.11 CCC(=O)C1=CC=CO1 Z274774438 [0,1,0,0,1,0|1,0,1]=4 691 B9R1.11 CCC(=O)C1=CSC=C1 Z513734000 [0,1,0,0,1,0|1,0,1]=4 692 B9R1.11 CCC(=O)C1=NC=CN1 Z1198180339 [0,1,0,0,1,0|0,0,2]=4 693 B9R1.11 CCC(=O)C1=NNC=C1 Z1513630191 [0,1,0,0,1,0|1,0,1]=4 694 B9R1.11 CCC(C)N1C=CN=C1 Z57842757 [0,1,0,0,1,0|1,0,0]=3 695 B9R1.11 CCC(N)C1=CC=CS1 Z744593088 [0,1,0,0,1,0|1,0,0]=3 696 B9R1.11 CCC(N)C1=COC=N1 Z3594983524 [0,1,0,0,1,0|1,0,0]=3 697 B9R1.11 CCC(N)C1=NC=CN1 Z1723549294 [0,1,0,0,1,0|0,0,1]=3 698 B9R1.11 CCC(N)C1=NC=CS1 Z803082570 [0,1,0,0,1,0|1,0,0]=3 699 B9R1.11 CCC(N)C1=NN=CN1 Z1255523392 [0,1,0,0,1,0|1,0,1]=4 700 B9R1.11 CCC(N)C1=NN=NN1 Z756918812 [0,1,0,0,1,0|2,0,0]=4 701 B9R1.11 CCC(O)C1=NC=CN1 Z1889917109 [0,1,0,0,1,0|0,0,1]=3 702 B9R1.11 CNC(C)C1=CC=CS1 Z57206120 [0,1,0,0,1,0|2,0,0]=4 703 B9R1.11 CNC(C)C1=NC=CS1 Z4945980708 [0,1,0,0,1,0|2,0,0]=4 704 B9R1.11 CNC(C)C1=NOC=N1 Z5017250727 [0,1,0,0,1,0|2,0,0]=4 705 B9R1.11 NC(CO)C1=CC=CO1 Z1255405023 [0,1,0,0,1,0|2,0,0]=4 706 B9R1.11 NC(CO)C1=CSC=N1 Z3813478275 [0,1,0,0,1,0|2,0,0]=4 707 B9R1.11 NCC(O)C1=CN=CS1 Z2310732372 [0,1,0,0,1,0|2,0,0]=4 708 B9R1.11 NCC(O)C1=CNC=N1 Z2310707384 [0,1,0,0,1,0|1,0,1]=4 709 B9R1.11 NCC(O)C1=COC=C1 Z1198261509 [0,1,0,0,1,0|2,0,0]=4 710 B9R1.11 NCC(O)C1=CSC=C1 Z330910460 [0,1,0,0,1,0|2,0,0]=4 711 B9R1.12 C#CCCN1C=NC=N1 Z4922335864 [0,1,0,0,1,0|1,0,1]=4 712 B9R1.12 CCCCC1=CN=CO1 Z2520746593 [0,1,0,0,1,0|1,0,0]=3 713 B9R1.12 CCNCC1=CC=CO1 Z90513169 [0,1,0,0,1,0|1,0,0]=3 714 B9R1.12 CCNCC1=CN=CS1 Z3268542028 [0,1,0,0,1,0|1,0,0]=3 715 B9R1.12 CCNCC1=COC=C1 Z385447452 [0,1,0,0,1,0|1,0,0]=3 716 B9R1.12 CCNCC1=NC=CS1 Z2186882255 [0,1,0,0,1,0|1,0,0]=3 717 B9R1.12 CCNCC1=NN=NN1 Z1263529662 [0,1,0,0,1,0|2,0,0]=4 718 B9R1.12 CCNCC1=NNC=C1 Z3300346845 [0,1,0,0,1,0|1,0,0]=3 719 B9R1.12 CCOCC1=NC=CN1 Z1203819044 [0,1,0,0,1,0|0,0,1]=3 720 B9R1.12 CNCCC1=CC=CS1 Z162416950 [0,1,0,0,1,0|1,0,0]=3 721 B9R1.12 CNCCC1=NNC=C1 Z2686452658 [0,1,0,0,1,0|1,0,0]=3 722 B9R1.12 CNCCC1=NNN=N1 Z2143575916 [0,1,0,0,1,0|2,0,0]=4 723 B9R1.12 CNCCC1=NOC=N1 Z2889975619 [0,1,0,0,1,0|1,0,0]=3 724 B9R1.12 CNCCN1C=CN=N1 Z4525811502 [0,1,0,0,1,0|2,0,0]=4 725 B9R1.12 CNCCN1C=NC=N1 Z1675167205 [0,1,0,0,1,0|1,0,0]=3 726 B9R1.12 CNCCN1C=NN=C1 Z994688662 [0,1,0,0,1,0|2,0,0]=4 727 B9R1.12 COCCN1C=CC=N1 Z1157794076 [0,1,0,0,1,0|1,0,0]=3 728 B9R1.12 COCCN1C=CN=C1 Z203976416 [0,1,0,0,1,0|1,0,0]=3 729 B9R1.12 FCCCC1=NN=NN1 Z1000709 [0,1,0,0,1,0|2,0,0]=4 730 B9R1.12 N#CCCC1=CC=CO1 Z1079179114 [0,1,0,0,1,0|1,0,1]=4 731 B9R1.12 N#CCCC1=CNC=N1 Z1795818466 [0,1,0,0,1,0|0,0,2]=4 732 B9R1.12 N#CCCN1C=CC=N1 Z239548814 [0,1,0,0,1,0|1,0,1]=4 733 B9R1.12 N#CCCN1C=CN=C1 Z53111124 [0,1,0,0,1,0|1,0,1]=4 734 B9R1.12 N#CCCN1N=CC=N1 Z238885214 [0,1,0,0,1,0|1,0,1]=4 735 B9R1.12 NCCCC1=CC=NN1 Z2895332060 [0,1,0,0,1,0|1,0,0]=3 736 B9R1.12 NCCCC1=CNC=N1 Z2574933947 [0,1,0,0,1,0|0,0,1]=3 737 B9R1.12 NCCCC1=CNN=C1 Z2106603664 [0,1,0,0,1,0|1,0,0]=3 738 B9R1.12 NCCCC1=CNN=N1 Z3379992373 [0,1,0,0,1,0|1,0,1]=4 739 B9R1.12 NCCCC1=CON=C1 Z3022047352 [0,1,0,0,1,0|1,0,0]=3 740 B9R1.12 NCCCC1=NC=CN1 Z3244743443 [0,1,0,0,1,0|0,0,1]=3 741 B9R1.12 NCCCC1=NC=CO1 Z4966451613 [0,1,0,0,1,0|1,0,0]=3 742 B9R1.12 NCCCC1=NC=CS1 Z1263529635 [0,1,0,0,1,0|1,0,0]=3 743 B9R1.12 NCCCC1=NC=NO1 Z1429378655 [0,1,0,0,1,0|1,0,0]=3 744 B9R1.12 NCCCC1=NN=CS1 Z4327155967 [0,1,0,0,1,0|2,0,0]=4 745 B9R1.12 NCCCC1=NNN=N1 Z1407007328 [0,1,0,0,1,0|2,0,0]=4 746 B9R1.12 NCCCN1C=CC=C1 Z600497510 [0,1,0,0,1,0|2,0,0]=4 747 B9R1.12 NCCCN1C=CC=N1 Z271005716 [0,1,0,0,1,0|1,0,0]=3 748 B9R1.12 NCCCN1C=CN=N1 Z1649880105 [0,1,0,0,1,0|2,0,0]=4 749 B9R1.12 NCCCN1C=NC=N1 Z2242062120 [0,1,0,0,1,0|1,0,0]=3 750 B9R1.12 NCCCN1C=NN=C1 Z2768235726 [0,1,0,0,1,0|2,0,0]=4 751 B9R1.12 NCCCN1C=NN=N1 Z2867580878 [0,1,0,0,1,0|2,0,0]=4 752 B9R1.12 O=CCCC1=CON=C1 Z2238235999 [0,1,0,0,1,0|1,0,1]=4 753 B9R1.12 O=CCCC1=CSC=C1 Z993017658 [0,1,0,0,1,0|1,0,1]=4 754 B9R1.12 O=CCCC1=NNC=N1 Z3271398040 [0,1,0,0,1,0|1,0,1]=4 755 B9R1.12 OCCCC1=CNC=N1 Z1142681983 [0,1,0,0,1,0|0,0,1]=3 756 B9R1.12 OCCCC1=CNN=C1 Z826006476 [0,1,0,0,1,0|1,0,0]=3 757 B9R1.12 OCCCC1=COC=C1 Z1198265634 [0,1,0,0,1,0|1,0,0]=3 758 B9R1.12 OCCCC1=CSC=C1 Z993012564 [0,1,0,0,1,0|1,0,0]=3 759 B9R1.12 OCCCC1=CSC=N1 Z1270133079 [0,1,0,0,1,0|1,0,0]=3 760 B9R1.12 OCCCC1=NC=CN1 Z2771661063 [0,1,0,0,1,0|0,0,1]=3 761 B9R1.12 OCCCC1=NC=NN1 Z5356836398 [0,1,0,0,1,0|1,0,0]=3 762 B9R1.12 OCCCN1C=CC=N1 Z425794826 [0,1,0,0,1,0|1,0,0]=3 763 B9R1.12 OCCCN1C=CN=C1 Z425794726 [0,1,0,0,1,0|1,0,0]=3 764 B9R1.13 CC(C)CN1C=CC=N1 Z431509688 [0,1,0,0,1,0|1,0,0]=3 765 B9R1.13 CC(C)OC1=CNN=C1 Z1618144071 [0,1,0,0,1,0|2,0,0]=4 766 B9R1.13 CC(C)SC1=NC=CN1 Z1203735020 [0,1,0,0,1,0|1,0,1]=4 767 B9R1.13 CC(N)CC1=CC=CO1 Z285143986 [0,1,0,0,1,0|1,0,0]=3 768 B9R1.13 CC(N)CC1=CC=CS1 Z1160899518 [0,1,0,0,1,0|1,0,0]=3 769 B9R1.13 CC(N)CC1=CNN=C1 Z5233405251 [0,1,0,0,1,0|1,0,0]=3 770 B9R1.13 CC(N)CC1=COC=C1 Z1098234443 [0,1,0,0,1,0|1,0,0]=3 771 B9R1.13 CC(N)CN1C=CC=N1 Z271011614 [0,1,0,0,1,0|1,0,0]=3 772 B9R1.13 CC(N)CN1C=CN=C1 Z271011862 [0,1,0,0,1,0|1,0,0]=3 773 B9R1.13 CC(N)CN1C=NC=N1 Z271011738 [0,1,0,0,1,0|1,0,0]=3 774 B9R1.13 CC(N)CN1C=NN=C1 Z1154270076 [0,1,0,0,1,0|2,0,0]=4 775 B9R1.13 CC(O)CN1C=CC=N1 Z600458296 [0,1,0,0,1,0|1,0,0]=3 776 B9R1.13 CC(O)CN1C=CN=C1 Z600458136 [0,1,0,0,1,0|1,0,0]=3 777 B9R1.13 CN(C)CC1=CC=CN1 Z810541778 [0,1,0,0,1,0|1,0,1]=4 778 B9R1.13 CN(C)CC1=CNN=C1 Z5148063728 [0,1,0,0,1,0|2,0,0]=4 779 B9R1.33 CC1=C(C=NO1)CCN Z2310699406 [0,1,0,0,1,0|2,0,0]=4 780 B9R1.33 CC1=C(N=CN1)CCN Z1682072469 [0,1,0,0,1,0|1,0,1]=4 781 B9R1.33 CC1=C(N=CO1)CCN Z4133751936 [0,1,0,0,1,0|2,0,0]=4 782 B9R1.33 CC1=C(SC=N1)CCCl Z945806150 [0,1,0,0,1,0|2,0,0]=4 783 B9R1.33 CC1=C(SC=N1)CCN Z945840330 [0,1,0,0,1,0|2,0,0]=4 784 B9R1.33 CC1=C(SC=N1)CCO Z104477768 [0,1,0,0,1,0|2,0,0]=4 785 B9R1.33 CC1=NC=CN1CCN Z271005730 [0,1,0,0,1,0|2,0,0]=4 786 B9R1.33 CC1=NC=CN1CCO Z425794744 [0,1,0,0,1,0|2,0,0]=4 787 B9R1.33 CC1=NC=CN1CCS Z820771758 [0,1,0,0,1,0|2,0,0]=4 788 B9R1.33 CC1=NNC=C1CCN Z4991178728 [0,1,0,0,1,0|2,0,0]=4 789 B9R1.33 CC1=NNN=C1CCN Z4526316913 [0,1,0,0,1,0|2,0,0]=4 790 B9R1.33 CCCC1=NON=C1N Z359374180 [0,1,0,0,1,0|1,0,0]=3 791 B9R1.33 CCCN1C=CN=C1S Z57043495 [0,1,0,0,1,0|1,0,0]=3 792 B9R1.33 CCCN1C=NN=C1N Z4858116505 [0,1,0,0,1,0|2,0,0]=4 793 B9R1.33 CCCN1C=NN=C1S Z367653296 [0,1,0,0,1,0|2,0,0]=4 794 B9R1.33 CCCN1N=NN=C1N Z57446086 [0,1,0,0,1,0|2,0,0]=4 795 B9R1.33 CCCN1N=NN=C1S Z126674092 [0,1,0,0,1,0|2,0,0]=4 796 B9R1.33 CCCN1NC=CC1=N Z1245633132 [0,1,0,0,1,0|1,0,1]=4 797 B9R1.33 CN1C=CN=C1CCN Z2805865782 [0,1,0,0,1,0|1,0,1]=4 798 B9R1.33 CN1C=CN=C1CCO Z1183455332 [0,1,0,0,1,0|1,0,1]=4 799 B9R1.33 CN1C=NC=C1CCN Z1198148027 [0,1,0,0,1,0|1,0,1]=4 800 B9R1.33 CN1N=CC=C1CCCl Z1824511155 [0,1,0,0,1,0|2,0,0]=4 801 B9R1.33 CN1N=CC=C1CCN Z1183446166 [0,1,0,0,1,0|2,0,0]=4 802 B9R1.33 CN1N=CC=C1CCO Z1183446153 [0,1,0,0,1,0|2,0,0]=4 803 B9R1.33 CN1N=CN=C1CCN Z1405445912 [0,1,0,0,1,0|2,0,0]=4 804 B9R1.33 CNCC1=C(C=CS1)Br Z1342208365 [0,1,0,0,1,0|2,0,0]=4 805 B9R1.33 CNCC1=C(C=CS1)C Z85956636 [0,1,0,0,1,0|2,0,0]=4 806 B9R1.33 CNCC1=C(N=CS1)C Z385446916 [0,1,0,0,1,0|2,0,0]=4 807 B9R1.33 CNCC1=C(OC=C1)C Z818732086 [0,1,0,0,1,0|2,0,0]=4 808 B9R1.33 CNCC1=CC=CN1C Z57778741 [0,1,0,0,1,0|1,0,1]=4 809 B9R1.33 CNCC1=CSN=C1C Z4996662980 [0,1,0,0,1,0|2,0,0]=4 810 B9R1.33 CNCC1=NC=CN1C Z94601315 [0,1,0,0,1,0|1,0,1]=4 811 B9R1.33 CNCC1=NC=NN1C Z995119858 [0,1,0,0,1,0|2,0,0]=4 812 B9R1.33 NCCC1=C(SC=C1)Cl Z4606142914 [0,1,0,0,1,0|2,0,0]=4 813 B9R1.33 NCCC1=CNN=C1O Z4623367325 [0,1,0,0,1,0|2,0,0]=4 814 B11R1.1 CC1=CC=C(C=C1)CCCN Z4639316723 [0,2,0,0,0,0|2,0,0]=4 815 B11R1.1 CC1=CN=C(C=C1)NCCN Z1695797833 [0,2,0,0,0,0|2,0,0]=4 816 B11R1.1 CC1=NC=C(C=C1)CCC=O Z1233208116 [0,2,0,0,0,0|1,0,1]=4 817 B11R1.1 CCCCC1=CC=C(C=C1)N Z104475500 [0,2,0,0,0,0|2,0,0]=4 818 B11R1.1 CCCCC1=CN=C(N=C1)N Z1137168332 [0,2,0,0,0,0|2,0,0]=4 819 B11R1.1 CCCCC1=NC=C(C=N1)N Z1318447164 [0,2,0,0,0,0|2,0,0]=4 820 B11R1.1 CCCNC1=CC=C(C=C1)Cl Z1266933829 [0,2,0,0,0,0|2,0,0]=4 821 B11R1.1 CCCOC1=CC=C(C=C1)N Z239604724 [0,2,0,0,0,0|2,0,0]=4 822 B11R1.1 CCNCC1=CC=C(C=C1)F Z3244655509 [0,2,0,0,0,0|2,0,0]=4 823 B11R1.1 CCOCC1=CC=C(C=C1)Br Z823854370 [0,2,0,0,0,0|2,0,0]=4 824 B11R1.1 CCOCC1=CC=C(C=C1)N Z240084570 [0,2,0,0,0,0|2,0,0]=4 825 B11R1.1 CCSCC1=CC=C(C=C1)N Z332378208 [0,2,0,0,0,0|2,0,0]=4 826 B11R1.1 CNCCC1=CC=C(C=C1)Br Z385447024 [0,2,0,0,0,0|2,0,0]=4 827 B11R1.1 CNCCC1=CC=C(C=C1)C Z5115849578 [0,2,0,0,0,0|2,0,0]=4 828 B11R1.1 CNCCC1=CC=C(C=C1)Cl Z1623872266 [0,2,0,0,0,0|2,0,0]=4 829 B11R1.1 CNCCC1=CC=C(C=C1)F Z138454998 [0,2,0,0,0,0|2,0,0]=4 830 B11R1.1 CNCCC1=NC=C(C=N1)Br Z3023504208 [0,2,0,0,0,0|2,0,0]=4 831 B11R1.1 COCCC1=CC=C(C=C1)Br Z299596190 [0,2,0,0,0,0|2,0,0]=4 832 B11R1.1 COCCC1=CC=C(C=C1)Cl Z1470894103 [0,2,0,0,0,0|2,0,0]=4 833 B11R1.1 COCCC1=CC=C(C=C1)O Z104485614 [0,2,0,0,0,0|2,0,0]=4 834 B11R1.1 CSCCC1=CC=C(C=C1)N Z732207426 [0,2,0,0,0,0|2,0,0]=4 835 B11R1.1 NCCCC1=CC=C(C=C1)Br Z3980240042 [0,2,0,0,0,0|2,0,0]=4 836 B11R1.1 NCCCC1=CC=C(C=C1)Cl Z992716848 [0,2,0,0,0,0|2,0,0]=4 837 B11R1.1 NCCCC1=CC=C(C=C1)F Z3244753845 [0,2,0,0,0,0|2,0,0]=4 838 B11R1.1 NCCCC1=CC=C(C=C1)N Z5453008768 [0,2,0,0,0,0|2,0,0]=4 839 B11R1.1 NCCCC1=CC=C(C=C1)O Z1270210797 [0,2,0,0,0,0|2,0,0]=4 840 B11R1.1 NCCOC1=NC=C(C=C1)Cl Z1421528823 [0,2,0,0,0,0|2,0,0]=4 841 B11R1.1 OCCCC1=CC=C(C=C1)F Z992949550 [0,2,0,0,0,0|2,0,0]=4 842 B11R1.1 OCCNC1=NC=C(C=C1)I Z1269164771 [0,2,0,0,0,0|2,0,0]=4 843 B11R1.1 OCCOC1=NC=C(C=C1)Br Z808609020 [0,2,0,0,0,0|2,0,0]=4 844 B11R1.20 CC(C)CC1=CC=C(C=C1)N Z1463350056 [0,2,0,0,0,0|2,0,0]=4 845 B11R1.20 CC(C)CC1=NC=C(C=C1)Br Z1269179231 [0,2,0,0,0,0|1,0,0]=3 846 B11R1.20 CC(C)CC1=NC=C(C=N1)N Z381402572 [0,2,0,0,0,0|2,0,0]=4 847 B11R1.20 CC(C)NC1=NC=C(C=C1)Br Z359297038 [0,2,0,0,0,0|2,0,0]=4 848 B11R1.20 CC(C)OC1=NC=C(C=C1)Br Z808608768 [0,2,0,0,0,0|2,0,0]=4 849 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [0,2,0,0,0,0|2,0,0]=4 850 B11R1.20 CN(C)CC1=CN=C(C=C1)N Z1723849137 [0,2,0,0,0,0|2,0,0]=4 851 B11R1.22 CCC(=O)C1=CN=C(C=C1)F Z1216820526 [0,2,0,0,0,0|1,0,1]=4 852 B11R1.22 CCC(=O)C1=NC=C(C=C1)F Z1341677536 [0,2,0,0,0,0|1,0,1]=4 853 B11R1.22 CCC(C)C1=CC=C(C=C1)O Z104484172 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.22 CCC(C)C1=NC=C(C=N1)N Z975823596 [0,2,0,0,0,0|2,0,0]=4 855 B11R1.22 CCC(N)C1=CC=C(C=C1)Br Z90662172 [0,2,0,0,0,0|2,0,0]=4 856 B11R1.22 CCC(N)C1=CC=C(C=C1)C Z90662186 [0,2,0,0,0,0|2,0,0]=4 857 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl Z221421644 [0,2,0,0,0,0|2,0,0]=4 858 B11R1.22 CCC(O)C1=CC=C(C=C1)C Z228586316 [0,2,0,0,0,0|2,0,0]=4 859 B11R1.22 CCC(O)C1=CC=C(C=C1)Cl Z228586168 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.22 CCC(O)C1=CC=C(C=C1)F Z228586174 [0,2,0,0,0,0|2,0,0]=4 861 B11R1.22 CCC(O)C1=CC=C(C=C1)O Z228586170 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.22 CCC(O)C1=NC=C(C=C1)F Z1341678257 [0,2,0,0,0,0|1,0,0]=3 863 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)F Z1626921240 [0,2,0,0,0,0|2,0,0]=4 864 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)F Z1625822291 [0,2,0,0,0,0|2,0,0]=4 865 B11R1.22 CNC(=O)C1=NC=C(N=C1)Br Z1269162713 [0,2,0,0,0,0|1,0,1]=4 866 B11R1.22 CNC(=O)C1=NC=C(N=C1)Cl Z1454937018 [0,2,0,0,0,0|1,0,1]=4 867 B11R1.22 CNC(C)C1=NC=C(C=C1)Cl Z1392162358 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.22 COC(=O)C1=NC=C(N=C1)Cl Z1255427779 [0,2,0,0,0,0|1,0,1]=4 869 B11R1.22 COC(=O)C1=NC=C(N=C1)F Z1255432621 [0,2,0,0,0,0|1,0,1]=4 870 B11R1.22 COC(=O)C1=NC=C(N=C1)N Z1198223353 [0,2,0,0,0,0|1,0,1]=4 871 B11R1.22 O=C(CBr)C1=NC=C(N=C1)Br Z2418414162 [0,2,0,0,0,0|1,0,1]=4 872 B11R1.81 CC1=CC(=C(N=C1)CCO)C Z1504687585 [0,2,0,0,0,0|2,0,0]=4 873 B11R1.81 CCOC1=C(C=C(C=N1)C)N Z1270646056 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.81 CCOC1=C(N=C(C=C1)N)C Z2583036218 [0,2,0,0,0,0|2,0,0]=4 875 B11R1.81 CNCC1=C(C=C(C=N1)Cl)Cl Z3304519723 [0,2,0,0,0,0|2,0,0]=4 876 B11R1.81 COCC1=C(N=C(C=C1)N)C Z1262680326 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.81 NCCC1=C(C=C(C=N1)F)F Z3024735908 [0,2,0,0,0,0|2,0,0]=4 878 B11R1.83 C#CC1=CN=C(C=C1)OCC Z1255495748 [0,2,0,0,0,0|2,0,0]=4 879 B11R1.83 CCCC1=CC=C(C=C1)C=O Z147641436 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.83 CCNC1=CN=C(C=C1)OC Z334876678 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.83 CCNC1=NC=C(C=C1)C#N Z219104216 [0,2,0,0,0,0|2,0,0]=4 882 B11R1.83 CCOC1=CN=C(C=C1)C=O Z1255437994 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.83 CCOC1=NC=C(C=C1)C#N Z295203536 [0,2,0,0,0,0|2,0,0]=4 884 B11R1.83 CCOC1=NC=C(C=C1)C=O Z1198331588 [0,2,0,0,0,0|2,0,0]=4 885 B11R1.83 CCOC1=NC=C(N=C1)C#N Z1217201633 [0,2,0,0,0,0|1,0,0]=3 886 B11R1.83 CNCC1=CN=C(C=C1)OC Z2490025030 [0,2,0,0,0,0|2,0,0]=4 887 B11R1.83 CNCC1=NC=C(C=C1)OC Z1849014421 [0,2,0,0,0,0|2,0,0]=4 888 B11R1.192 COCC1=NC=C([N+](=C1)[O-])C Z1198157805 [0,2,0,0,0,0|1,0,1]=4 889 B11R1.17 CC1=C(C=CC=C1)CCCN Z424782962 [0,2,0,0,0,0|2,0,0]=4 890 B11R1.17 CC1=C(C=CC=C1)CCCO Z979436644 [0,2,0,0,0,0|2,0,0]=4 891 B11R1.17 CC1=C(C=NC=C1)CCC=O Z1270653786 [0,2,0,0,0,0|1,0,1]=4 892 B11R1.17 CC1=C(N=CC=C1)CCC#N Z1862003349 [0,2,0,0,0,0|1,0,1]=4 893 B11R1.17 CC1=C(N=CC=C1)CCCN Z1198262715 [0,2,0,0,0,0|1,0,0]=3 894 B11R1.17 CCCNC1=C(C=CC=C1)F Z334942896 [0,2,0,0,0,0|2,0,0]=4 895 B11R1.17 CCCNC1=C(C=CC=C1)N Z94601320 [0,2,0,0,0,0|2,0,0]=4 896 B11R1.17 CCCOC1=C(C=CC=C1)Br Z54722000 [0,2,0,0,0,0|2,0,0]=4 897 B11R1.17 CCCOC1=C(C=CC=C1)N Z56968930 [0,2,0,0,0,0|2,0,0]=4 898 B11R1.17 CCCOC1=C(C=CC=C1)O Z55993120 [0,2,0,0,0,0|2,0,0]=4 899 B11R1.17 CCCOC1=C(N=CC=N1)N Z1821324848 [0,2,0,0,0,0|0,0,0]=2 900 B11R1.17 CCNCC1=C(C=CC=C1)Br Z1982494002 [0,2,0,0,0,0|2,0,0]=4 901 B11R1.17 CCNCC1=C(C=CC=C1)C Z90513218 [0,2,0,0,0,0|2,0,0]=4 902 B11R1.17 CCNCC1=C(C=CC=C1)Cl Z90513164 [0,2,0,0,0,0|2,0,0]=4 903 B11R1.17 CCNCC1=C(C=CC=C1)F Z286282968 [0,2,0,0,0,0|2,0,0]=4 904 B11R1.17 CCNCC1=C(C=CC=C1)N Z2351947311 [0,2,0,0,0,0|2,0,0]=4 905 B11R1.17 CCOCC1=C(C=CC=C1)N Z285163822 [0,2,0,0,0,0|2,0,0]=4 906 B11R1.17 CCSCC1=C(N=CC=C1)N Z991493204 [0,2,0,0,0,0|1,0,0]=3 907 B11R1.17 CNCCC1=C(C=CC=C1)C Z2234185664 [0,2,0,0,0,0|2,0,0]=4 908 B11R1.17 CNCCC1=C(C=CC=C1)Cl Z4935566656 [0,2,0,0,0,0|2,0,0]=4 909 B11R1.17 CNCCC1=C(C=CC=C1)F Z163192604 [0,2,0,0,0,0|2,0,0]=4 910 B11R1.17 CNCCC1=C(C=CC=C1)O Z1665033474 [0,2,0,0,0,0|2,0,0]=4 911 B11R1.17 COCCC1=C(C=CC=C1)N Z992259832 [0,2,0,0,0,0|2,0,0]=4 912 B11R1.17 NC1=C(C=CC=C1)CCCO Z1198265858 [0,2,0,0,0,0|2,0,0]=4 913 B11R1.17 NCCCC1=C(C=CC=C1)Cl Z1695729033 [0,2,0,0,0,0|2,0,0]=4 914 B11R1.17 NCCCC1=C(C=CC=C1)F Z424783030 [0,2,0,0,0,0|2,0,0]=4 915 B11R1.17 NCCCN1C=CC=NC1=O Z1956828657 [0,2,0,0,0,0|2,0,0]=4 916 B11R1.17 NCCNC1=C(C=CC=N1)Br Z808603224 [0,2,0,0,0,0|2,0,0]=4 917 B11R1.17 NCCOC1=C(C=CC=N1)Cl Z1421528240 [0,2,0,0,0,0|2,0,0]=4 918 B11R1.17 O=C1C=CC=NN1CCCO Z1021424282 [0,2,0,0,0,0|2,0,0]=4 919 B11R1.17 O=C1C=CN=CN1CCCO Z1154747265 [0,2,0,0,0,0|2,0,0]=4 920 B11R1.17 OCCCC1=C(C=CC=C1)Br Z992949552 [0,2,0,0,0,0|2,0,0]=4 921 B11R1.17 OCCSC1=C(C=CC=N1)F Z997724398 [0,2,0,0,0,0|2,0,0]=4 922 B11R1.41 CCCC1=C(C=CC=C1)CN Z3241253417 [0,2,0,0,0,0|2,0,0]=4 923 B11R1.41 CCOC1=C(C=CC=N1)C#N Z295203538 [0,2,0,0,0,0|2,0,0]=4 924 B11R1.41 CCOC1=C(C=CC=N1)CN Z240084032 [0,2,0,0,0,0|2,0,0]=4 925 B11R1.41 CCSC1=C(N=CC=N1)C#N Z995023798 [0,2,0,0,0,0|1,0,0]=3 926 B11R1.41 COC1=C(C=CC=N1)CCO Z1504674309 [0,2,0,0,0,0|2,0,0]=4 927 B11R1.41 COC1=C(C=NC=C1)CCN Z2752229904 [0,2,0,0,0,0|2,0,0]=4 928 B11R1.86 CC(C)CC1=C(C=CC=C1)N Z1171158156 [0,2,0,0,0,0|2,0,0]=4 929 B11R1.86 CC(C)OC1=C(C=CC=N1)O Z1255389451 [0,2,0,0,0,0|2,0,0]=4 930 B11R1.86 CC(C)OC1=C(N=CC=C1)N Z1809367930 [0,2,0,0,0,0|2,0,0]=4 931 B11R1.86 CC(N)CC1=C(C=CC=C1)Br Z1416200939 [0,2,0,0,0,0|2,0,0]=4 932 B11R1.86 CC(N)CC1=C(C=CC=C1)Cl Z415728108 [0,2,0,0,0,0|2,0,0]=4 933 B11R1.86 CC1=C(C=CC=C1)CC(C)N Z594038086 [0,2,0,0,0,0|2,0,0]=4 934 B11R1.86 CN(C)CC1=C(C=CC=N1)O Z56957565 [0,2,0,0,0,0|2,0,0]=4 935 B11R1.86 O=C(O)CC1=C(N=CC=N1)Cl Z1255421013 [0,2,0,0,0,0|1,0,1]=4 936 B11R1.182 COCC1=C(C=CC(=N1)N)Cl Z5443664853 [0,2,0,0,0,0|2,0,0]=4 937 B11R1.182 CSCC1=C(C=CC(=N1)N)Cl Z1033293752 [0,2,0,0,0,0|2,0,0]=4 938 B11R1.222 CCC(=O)C1=C(C=CC=N1)C Z852750672 [0,2,0,0,0,0|1,0,1]=4 939 B11R1.222 CCC(N)C1=C(C=CC=C1)Br Z851790482 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.222 CCC(N)C1=C(C=CC=C1)O Z1266854970 [0,2,0,0,0,0|2,0,0]=4 941 B11R1.222 COC(=O)C1=C(N=CC=N1)Br Z1269220649 [0,2,0,0,0,0|1,0,1]=4 942 B11R1.222 COC(=O)C1=C(N=CC=N1)Cl Z1198161446 [0,2,0,0,0,0|1,0,1]=4 943 B11R1.222 COC(=O)C1=C(N=CC=N1)F Z1255382576 [0,2,0,0,0,0|1,0,1]=4 944 B11R1.222 COC(=O)C1=C(N=CC=N1)N Z104509600 [0,2,0,0,0,0|1,0,1]=4 945 B11R1.23 CCC(=O)C1=NC(=CC=C1)C Z1138558473 [0,2,0,0,0,0|1,0,1]=4 946 B11R1.23 CCC(C)C1=NC(=CC=N1)Cl Z975823852 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.23 CCC(N)C1=CC(=CC=C1)Cl Z239627026 [0,2,0,0,0,0|2,0,0]=4 948 B11R1.23 CCC(N)C1=CC(=CC=C1)O Z4164634595 [0,2,0,0,0,0|2,0,0]=4 949 B11R1.23 CCC(N)C1=NC(=CC=C1)C Z4457910024 [0,2,0,0,0,0|1,0,0]=3 950 B11R1.23 CCC(O)C1=CC(=CC=C1)Br Z228586280 [0,2,0,0,0,0|2,0,0]=4 951 B11R1.23 CCC(O)C1=CC(=CC=C1)Cl Z335245132 [0,2,0,0,0,0|2,0,0]=4 952 B11R1.23 CCC(O)C1=CC(=CC=C1)N Z1262626036 [0,2,0,0,0,0|2,0,0]=4 953 B11R1.23 CNC(=O)C1=NC(=CN=C1)Cl Z1504678181 [0,2,0,0,0,0|1,0,1]=4 954 B11R1.23 COC(=O)C1=NC(=CN=C1)Br Z1269199266 [0,2,0,0,0,0|1,0,1]=4 955 B11R1.23 COC(=O)C1=NC(=CN=C1)C Z1198181970 [0,2,0,0,0,0|1,0,1]=4 956 B11R1.23 COC(=O)C1=NC(=CN=C1)Cl Z1198275613 [0,2,0,0,0,0|1,0,1]=4 957 B11R1.23 COC(=O)C1=NC(=CN=C1)F Z2568988263 [0,2,0,0,0,0|1,0,1]=4 958 B11R1.23 COC(=O)C1=NC(=CN=C1)N Z1198277980 [0,2,0,0,0,0|1,0,1]=4 959 B11R1.24 CC1=CC(=CC=C1)CCCN Z4993130622 [0,2,0,0,0,0|2,0,0]=4 960 B11R1.24 CC1=CC(=CC=C1)CCCO Z979436642 [0,2,0,0,0,0|2,0,0]=4 961 B11R1.24 CC1=CC(=CN=C1)CCC=O Z1492427371 [0,2,0,0,0,0|1,0,1]=4 962 B11R1.24 CC1=CC(=CN=C1)CCCO Z1216820424 [0,2,0,0,0,0|1,0,0]=3 963 B11R1.24 CC1=CC(=NC=C1)NCCO Z1250080924 [0,2,0,0,0,0|2,0,0]=4 964 B11R1.24 CC1=NC(=CC=C1)CCCO Z104479712 [0,2,0,0,0,0|1,0,0]=3 965 B11R1.24 CC1=NC(=CC=C1)NCCN Z1267773738 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.24 CCCCC1=NC(=NC=C1)N Z1262627362 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.24 CCCCC1=NC=NC(=C1)Cl Z1201628792 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.24 CCCOC1=CC(=CC=C1)Br Z54848718 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.24 CCCOC1=CC(=CC=C1)N Z239604770 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.24 CCCOC1=CC(=CC=C1)O Z381415572 [0,2,0,0,0,0|2,0,0]=4 971 B11R1.24 CCNCC1=CC(=CC=C1)Br Z1138763375 [0,2,0,0,0,0|2,0,0]=4 972 B11R1.24 CCNCC1=CC(=CC=C1)C Z90513252 [0,2,0,0,0,0|2,0,0]=4 973 B11R1.24 CCNCC1=CC(=CC=C1)Cl Z90513201 [0,2,0,0,0,0|2,0,0]=4 974 B11R1.24 CCNCC1=CC(=CC=C1)F Z85935746 [0,2,0,0,0,0|2,0,0]=4 975 B11R1.24 CCNCC1=CC(=CN=C1)Br Z3244742192 [0,2,0,0,0,0|1,0,0]=3 976 B11R1.24 CCNCC1=NC(=CC=C1)C Z385447500 [0,2,0,0,0,0|1,0,0]=3 977 B11R1.24 CCOCC1=CC(=CC=C1)N Z285163820 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.24 CCSCC1=CC(=CC=C1)N Z332378038 [0,2,0,0,0,0|2,0,0]=4 979 B11R1.24 CNCCC1=CC(=CC=C1)Br Z2168282744 [0,2,0,0,0,0|2,0,0]=4 980 B11R1.24 CNCCC1=CC(=CC=C1)O Z4924737523 [0,2,0,0,0,0|2,0,0]=4 981 B11R1.24 CNCCC1=NC(=CC=N1)O Z3023572741 [0,2,0,0,0,0|2,0,0]=4 982 B11R1.24 COCCC1=CC(=CC=C1)O Z1513911027 [0,2,0,0,0,0|2,0,0]=4 983 B11R1.24 NC1=CC(=CC=C1)CCCO Z1198265859 [0,2,0,0,0,0|2,0,0]=4 984 B11R1.24 NCCCC1=CC(=CC=C1)Br Z1266823414 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.24 NCCCC1=CC(=CC=C1)Cl Z1262246154 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.24 NCCCC1=CC(=CC=C1)F Z424782946 [0,2,0,0,0,0|2,0,0]=4 987 B11R1.24 NCCCC1=CC(=CC=C1)O Z1895582955 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.24 NCCCC1=CC(=CN=C1)F Z4446765955 [0,2,0,0,0,0|1,0,0]=3 989 B11R1.24 O=CCCC1=CN=CC(=C1)F Z1233207916 [0,2,0,0,0,0|1,0,1]=4 990 B11R1.24 OCCOC1=CC(=CN=C1)Br Z1206893175 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.24 OCCOC1=NC(=CN=C1)Cl Z332379880 [0,2,0,0,0,0|1,0,0]=3 992 B11R1.34 CCCC1=CC(=CC(=C1)O)O Z367653796 [0,2,0,0,0,0|2,0,0]=4 993 B11R1.34 CCCC1=CC(=O)NC(=N1)S Z56922173 [0,2,0,0,0,0|2,0,0]=4 994 B11R1.34 CCCC1=NC(=NC(=C1)Cl)Cl Z1216824384 [0,2,0,0,0,0|2,0,0]=4 995 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [0,2,0,0,0,0|2,0,0]=4 996 B11R1.157 CC(C)CC1=NC=NC(=C1)Cl Z1198234909 [0,2,0,0,0,0|2,0,0]=4 997 B11R1.157 CC(C)OC1=CC(=CN=C1)Br Z1206893743 [0,2,0,0,0,0|2,0,0]=4 998 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [0,2,0,0,0,0|2,0,0]=4 999 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [0,2,0,0,0,0|2,0,0]=4 1000 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [0,2,0,0,0,0|2,0,0]=4 1001 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [0,2,0,0,0,0|2,0,0]=4 1002 B11R1.157 CN(C)CC1=CC(=CN=C1)N Z2181809496 [0,2,0,0,0,0|2,0,0]=4 1003 B11R1.189 CCCC1=CC(=CC=C1)C=O Z1216844686 [0,2,0,0,0,0|2,0,0]=4 1004 B11R1.189 CCOC1=CC(=CN=C1)C=O Z1255363707 [0,2,0,0,0,0|2,0,0]=4 1005 B11R1.189 CCOC1=CC(=CN=C1)CO Z1522534006 [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.189 CCOC1=NC(=CC=C1)C=O Z1198307154 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.189 CCOC1=NC(=CC=C1)CN Z4625400793 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.189 CCOC1=NC(=CC=C1)CO Z969097698 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.189 CCOC1=NC=CC(=C1)C=O Z1255393446 [0,2,0,0,0,0|2,0,0]=4 1010 B11R1.189 CCOC1=NC=CC(=C1)CN Z240084028 [0,2,0,0,0,0|2,0,0]=4 1011 B11R1.189 CNCC1=CC(=CN=C1)OC Z1255362175 [0,2,0,0,0,0|2,0,0]=4 1012 B11R1.189 CNCC1=NC(=CC=C1)OC Z4595018713 [0,2,0,0,0,0|2,0,0]=4 1013 B11R1.189 COC1=NC(=CC=C1)CCN Z1139189688 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.189 N#CC1=CC=CC(=N1)CCN Z5211343009 [0,2,0,0,0,0|2,0,0]=4 1015 B11R1.7 CC(C)(CN)C1=CN=CC=C1 Z1255424681 [0,2,0,0,0,0|2,0,0]=4 1016 B11R1.7 CC(C)(CO)C1=NC=CC=C1 Z1216821531 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.7 CCC(C)(N)C1=CC=CC=C1 Z449373366 [0,2,0,0,0,0|2,0,0]=4 1018 B11R1.7 CCC(C)(O)C1=CC=CC=C1 Z449373348 [0,2,0,0,0,0|2,0,0]=4 1019 B11R1.7 NCC(F)(F)C1=NC=CC=C1 Z1198184449 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.12 CCC(C=O)C1=CC=CC=C1 Z1079132778 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.12 CCC(CN)C1=CC=CC=C1 Z85956799 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.12 CCC(CO)C1=CC=CC=C1 Z397587442 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.16 CCCC(=O)C1=CC=CC=C1 Z104477742 [0,2,0,0,0,0|2,0,0]=4 1024 B11R1.16 CCCC(=O)C1=CN=CC=C1 Z513733856 [0,2,0,0,0,0|1,0,0]=3 1025 B11R1.16 CCCC(=O)C1=NC=CC=C1 Z513733774 [0,2,0,0,0,0|1,0,0]=3 1026 B11R1.16 CCCC(N)C1=NC=CC=C1 Z513795928 [0,2,0,0,0,0|1,0,0]=3 1027 B11R1.16 CCCC(O)C1=CC=CC=C1 Z335244704 [0,2,0,0,0,0|2,0,0]=4 1028 B11R1.16 CCNC(C)C1=CN=CC=C1 Z163548568 [0,2,0,0,0,0|1,0,0]=3 1029 B11R1.16 CCOC(=O)C1=CN=CC=C1 Z104476924 [0,2,0,0,0,0|1,0,1]=4 1030 B11R1.16 CCOC(=O)C1=NC=CN=C1 Z53835886 [0,2,0,0,0,0|0,0,1]=3 1031 B11R1.16 CN(CCN)C1=NC=CC=C1 Z3026268353 [0,2,0,0,0,0|2,0,0]=4 1032 B11R1.16 CN(CCO)C1=NC=CC=C1 Z54633859 [0,2,0,0,0,0|2,0,0]=4 1033 B11R1.16 CNCC(C)C1=CC=CC=C1 Z57797325 [0,2,0,0,0,0|2,0,0]=4 1034 B11R1.16 COCC(N)C1=CC=CC=C1 Z271013088 [0,2,0,0,0,0|2,0,0]=4 1035 B11R1.16 CSCC(N)C1=CC=CC=C1 Z995116260 [0,2,0,0,0,0|2,0,0]=4 1036 B11R1.16 NC(CCO)C1=CC=CC=C1 Z382816560 [0,2,0,0,0,0|2,0,0]=4 1037 B11R1.16 NCCC(O)C1=CC=CC=C1 Z1020673398 [0,2,0,0,0,0|2,0,0]=4 1038 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 Z1255427232 [0,2,0,0,0,0|2,0,0]=4 1039 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 Z1255356297 [0,2,0,0,0,0|2,0,0]=4 1040 B11R1.36 CC(C)C(=O)C1=CN=CC=C1 Z513733850 [0,2,0,0,0,0|1,0,1]=4 1041 B11R1.36 CC(C)C(N)C1=NC=CC=C1 Z513795924 [0,2,0,0,0,0|1,0,0]=3 1042 B11R1.36 CC(C)C(O)C1=NC=CC=C1 Z513749462 [0,2,0,0,0,0|1,0,0]=3 1043 B11R1.36 CC(N)C(C)C1=CC=CC=C1 Z1203578901 [0,2,0,0,0,0|2,0,0]=4 1044 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Z2588063686 [0,2,0,0,0,0|2,0,0]=4 1045 B11R1.36 CN(C)C(=O)C1=NC=CN=C1 Z32014540 [0,2,0,0,0,0|1,0,1]=4 1046 B11R1.28 BrCCCOC1=CC=CC=C1 Z90122132 [0,2,0,0,0,0|2,0,0]=4 1047 B11R1.28 C#CCNCC1=CN=CC=C1 Z90560634 [0,2,0,0,0,0|1,0,1]=4 1048 B11R1.28 C#CCNCC1=NC=CN=C1 Z1013420586 [0,2,0,0,0,0|0,0,1]=3 1049 B11R1.28 CCCCCC1=CC=CC=C1 Z199507042 [0,2,0,0,0,0|2,0,0]=4 1050 B11R1.28 CCCCNC1=NC=CN=C1 Z31215149 [0,2,0,0,0,0|0,0,0]=2 1051 B11R1.28 CCCNCC1=CC=CC=C1 Z56946091 [0,2,0,0,0,0|2,0,0]=4 1052 B11R1.28 CCCNCC1=CN=CC=C1 Z3247723489 [0,2,0,0,0,0|1,0,0]=3 1053 B11R1.28 CCCNCC1=NC=CC=C1 Z4401052052 [0,2,0,0,0,0|1,0,0]=3 1054 B11R1.28 CCNCCC1=CC=CC=C1 Z444350074 [0,2,0,0,0,0|2,0,0]=4 1055 B11R1.28 CCNCCC1=NC=CC=C1 Z138534138 [0,2,0,0,0,0|1,0,0]=3 1056 B11R1.28 CCOCCC1=CC=CC=C1 Z1198150519 [0,2,0,0,0,0|2,0,0]=4 1057 B11R1.28 CNCCCC1=CC=CC=C1 Z102767020 [0,2,0,0,0,0|2,0,0]=4 1058 B11R1.28 CNCCNC1=NC=CC=C1 Z3033960688 [0,2,0,0,0,0|1,0,0]=3 1059 B11R1.28 CNCCOC1=CC=CC=C1 Z56945505 [0,2,0,0,0,0|2,0,0]=4 1060 B11R1.28 COCCNC1=CC=CC=C1 Z266463556 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.28 ClCCCOC1=CC=CC=C1 Z275020186 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.28 ClCCNCC1=CC=CC=C1 Z57158447 [0,2,0,0,0,0|2,0,0]=4 1063 B11R1.28 N#CCNCC1=NC=CC=C1 Z111725574 [0,2,0,0,0,0|1,0,1]=4 1064 B11R1.28 NCCCCC1=CC=CC=C1 Z2574929438 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.28 NCCCNC1=CC=CC=C1 Z756919512 [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.28 NCCCNC1=NC=CC=C1 Z234895141 [0,2,0,0,0,0|1,0,0]=3 1067 B11R1.28 NCCCNC1=NC=CC=N1 Z444311056 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.28 NCCCOC1=CC=CC=C1 Z234895129 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.28 NCCCOC1=NC=CC=N1 Z2467687631 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.28 NCCCSC1=CC=CC=C1 Z262222134 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.28 NCCCSC1=NC=CC=C1 Z2028214397 [0,2,0,0,0,0|1,0,0]=3 1072 B11R1.28 NCCNCC1=NC=CC=C1 Z600492946 [0,2,0,0,0,0|1,0,0]=3 1073 B11R1.28 NCCOCC1=CC=CC=C1 Z271005946 [0,2,0,0,0,0|2,0,0]=4 1074 B11R1.28 O=CCCCC1=CC=CC=C1 Z993017616 [0,2,0,0,0,0|2,0,0]=4 1075 B11R1.28 OCCCNC1=CC=CC=C1 Z104584292 [0,2,0,0,0,0|2,0,0]=4 1076 B11R1.28 OCCCNC1=NC=CC=C1 Z31220937 [0,2,0,0,0,0|1,0,0]=3 1077 B11R1.28 OCCCSC1=CC=CC=C1 Z104650330 [0,2,0,0,0,0|2,0,0]=4 1078 B11R1.28 OCCNCC1=CN=CC=C1 Z90504502 [0,2,0,0,0,0|1,0,0]=3 1079 B11R1.28 OCCOCC1=CC=CC=C1 Z854223062 [0,2,0,0,0,0|2,0,0]=4 1080 B11R1.40 CC(C=O)CC1=CC=CC=C1 Z1198150055 [0,2,0,0,0,0|2,0,0]=4 1081 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [0,2,0,0,0,0|2,0,0]=4 1082 B11R1.40 CCC(=O)CC1=CN=CC=C1 Z992407884 [0,2,0,0,0,0|1,0,0]=3 1083 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [0,2,0,0,0,0|2,0,0]=4 1084 B11R1.40 CCC(O)CC1=CC=CC=C1 Z513749284 [0,2,0,0,0,0|2,0,0]=4 1085 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 Z1262397064 [0,2,0,0,0,0|2,0,0]=4 1086 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 Z1262397065 [0,2,0,0,0,0|2,0,0]=4 1087 B11R1.40 COC(=O)CC1=NC=CC=C1 Z147652450 [0,2,0,0,0,0|1,0,1]=4 1088 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [0,2,0,0,0,0|2,0,0]=4 1089 B11R1.40 NCC(F)CC1=CC=CC=C1 Z2740416678 [0,2,0,0,0,0|2,0,0]=4 1090 B11R1.40 NCC(N)CC1=CC=CC=C1 Z425861056 [0,2,0,0,0,0|2,0,0]=4 1091 B11R1.40 NCC(O)CC1=CC=CC=C1 Z419084966 [0,2,0,0,0,0|2,0,0]=4 1092 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [0,2,0,0,0,0|2,0,0]=4 1093 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [0,2,0,0,0,0|2,0,0]=4 1094 B11R1.91 CC(=O)NCC1=NC=CC=C1 Z324553036 [0,2,0,0,0,0|1,0,1]=4 1095 B11R1.91 CC(C)CCC1=NC=CN=C1 Z1198147436 [0,2,0,0,0,0|0,0,0]=2 1096 B11R1.91 CC(C)CNC1=CC=CC=C1 Z2092369729 [0,2,0,0,0,0|2,0,0]=4 1097 B11R1.91 CC(C)COC1=CN=CC=C1 Z1606818727 [0,2,0,0,0,0|1,0,0]=3 1098 B11R1.91 CC(C)NCC1=CN=CC=C1 Z90502194 [0,2,0,0,0,0|1,0,0]=3 1099 B11R1.91 CC(C)NCC1=NC=CC=C1 Z90502192 [0,2,0,0,0,0|1,0,0]=3 1100 B11R1.91 CC(N)CCC1=CC=CC=C1 Z104476462 [0,2,0,0,0,0|2,0,0]=4 1101 B11R1.91 CC(N)COC1=CC=CC=C1 Z600397650 [0,2,0,0,0,0|2,0,0]=4 1102 B11R1.91 CC(O)CNC1=CC=CC=C1 Z234898271 [0,2,0,0,0,0|2,0,0]=4 1103 B11R1.91 CN(C)CCC1=CC=CC=C1 Z168912026 [0,2,0,0,0,0|2,0,0]=4 1104 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Z5044990030 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.91 O=C(O)CCC1=CN=CC=C1 Z89264892 [0,2,0,0,0,0|1,0,1]=4 1106 B11R1.91 O=C(O)CCC1=NC=CC=C1 Z317037998 [0,2,0,0,0,0|1,0,1]=4 1107 B11R1.91 O=C(O)CCC1=NC=CN=C1 Z1198184629 [0,2,0,0,0,0|0,0,1]=3 1108 B9R1.14 CCN1C=CN=C1C=O Z965810096 [0,0,1,1,0,0|2,0,0]=4 1109 B9R2.2 C1=C(N=NN1)C2CC2 Z2327568966 [0,0,0,1,1,0|1,0,1]=4 1110 B9R2.2 C1=CC(=CS1)C2CO2 Z954550900 [0,0,0,1,1,0|2,0,0]=4 1111 B9R2.2 C1=CC(=NN1)C2CC2 Z336080424 [0,0,0,1,1,0|1,0,0]=3 1112 B9R2.2 C1=NC=NN1C2CC2 Z5030705075 [0,0,0,1,1,0|1,0,0]=3 1113 B9R2.2 C1=NN=C(N1)C2CC2 Z2130641619 [0,0,0,1,1,0|1,0,1]=4 1114 B9R2.2 C1=NN=CN1C2CC2 Z1201626766 [0,0,0,1,1,0|2,0,0]=4 1115 B9R2.2 C1=NN=NN1C2CC2 Z1238571392 [0,0,0,1,1,0|2,0,0]=4 1116 B9R2.2 C1CC1C2=NNN=N2 Z763029980 [0,0,0,1,1,0|2,0,0]=4 1117 B9R2.3 C1=C2CNCC2=NN1 Z2335631780 [0,0,0,1,1,0|2,0,0]=4 1118 B9R2.3 C1=C2CNCC2=NO1 Z3247780507 [0,0,0,1,1,0|2,0,0]=4 1119 B9R2.3 C1=CN2CCCC2=N1 Z1255492142 [0,0,0,1,1,0|0,0,1]=3 1120 B9R2.3 C1=NC2=C(N1)CNC2 Z3244520038 [0,0,0,1,1,0|1,0,1]=4 1121 B9R2.3 C1=NC2=C(S1)CNC2 Z4459994874 [0,0,0,1,1,0|2,0,0]=4 1122 B9R2.3 C1=NN2CCNC2=C1 Z1203731545 [0,0,0,1,1,0|2,0,0]=4 1123 B9R2.3 C1=NNC2=C1CCC2 Z1198165735 [0,0,0,1,1,0|1,0,0]=3 1124 B11R2.34 BrC1=CN=C(C=C1)C2CC2 Z2943484009 [0,1,0,1,0,0|1,0,0]=3 1125 B11R2.34 BrC1=NC=C(C=N1)C2CC2 Z1255375372 [0,1,0,1,0,0|2,0,0]=4 1126 B11R2.34 BrC1=NC=C(N=C1)C2CC2 Z1198319306 [0,1,0,1,0,0|0,0,0]=2 1127 B11R2.34 CC1=NC=C(C=C1)C2CO2 Z1504684436 [0,1,0,1,0,0|2,0,0]=4 1128 B11R2.34 ClC1=NC=C(C=N1)C2CC2 Z1255437429 [0,1,0,1,0,0|2,0,0]=4 1129 B11R2.34 ClC1=NN=C(C=C1)C2CC2 Z1013743432 [0,1,0,1,0,0|2,0,0]=4 1130 B11R2.34 FC1=CN=C(C=C1)C2CO2 Z1575327880 [0,1,0,1,0,0|2,0,0]=4 1131 B11R2.34 NC1=CN=C(N=C1)C2CC2 Z381402574 [0,1,0,1,0,0|2,0,0]=4 1132 B11R2.34 NC1=NC=C(C=N1)C2CC2 Z1255436540 [0,1,0,1,0,0|2,0,0]=4 1133 B11R2.34 NC1=NN=C(C=C1)C2CC2 Z1013744036 [0,1,0,1,0,0|2,0,0]=4 1134 B11R2.34 O=C1C=CC(=NN1)C2CC2 Z1013742704 [0,1,0,1,0,0|2,0,0]=4 1135 B11R2.34 OC1=CN=C(N=C1)C2CC2 Z1255433581 [0,1,0,1,0,0|2,0,0]=4 1136 B11R2.36 BrC1=CC2=C(C=C1)CCC2 Z359513410 [0,1,0,1,0,0|2,0,0]=4 1137 B11R2.36 BrC1=CC2=C(CCC2)N=C1 Z1198182024 [0,1,0,1,0,0|1,0,0]=3 1138 B11R2.36 BrC1=CC2=C(CNC2)N=C1 Z3244825424 [0,1,0,1,0,0|2,0,0]=4 1139 B11R2.36 BrC1=CC2=C(COC2)N=C1 Z1269164644 [0,1,0,1,0,0|2,0,0]=4 1140 B11R2.36 BrC1=CC2=C(N=C1)NCC2 Z1198169618 [0,1,0,1,0,0|2,0,0]=4 1141 B11R2.36 BrC1=CC2=C(N=C1)OCC2 Z1269230252 [0,1,0,1,0,0|2,0,0]=4 1142 B11R2.36 BrC1=NC2=C(C=N1)CCC2 Z2311286011 [0,1,0,1,0,0|2,0,0]=4 1143 B11R2.36 BrC1=NN=C2CCCC2=C1 Z5348405692 [0,1,0,1,0,0|2,0,0]=4 1144 B11R2.36 CC1=CC2=C(CNC2)N=C1 Z4912525222 [0,1,0,1,0,0|2,0,0]=4 1145 B11R2.36 CC1=NC=C2CCNC2=C1 Z2651710943 [0,1,0,1,0,0|2,0,0]=4 1146 B11R2.36 ClC1=CC2=C(C=C1)CCC2 Z1198234594 [0,1,0,1,0,0|2,0,0]=4 1147 B11R2.36 ClC1=NC2=C(C=N1)CCC2 Z1255467563 [0,1,0,1,0,0|2,0,0]=4 1148 B11R2.36 ClC1=NN=C2CCCC2=C1 Z935132412 [0,1,0,1,0,0|2,0,0]=4 1149 B11R2.36 FC1=CC2=C(CCN2)N=C1 Z5452930143 [0,1,0,1,0,0|2,0,0]=4 1150 B11R2.36 FC1=CC2=C(N=C1)NCC2 Z2757597421 [0,1,0,1,0,0|2,0,0]=4 1151 B11R2.36 FC1=CC2=C(N=C1)OCC2 Z2732449946 [0,1,0,1,0,0|2,0,0]=4 1152 B11R2.36 IC1=CC2=C(C=C1)CCC2 Z381540774 [0,1,0,1,0,0|2,0,0]=4 1153 B11R2.36 NC1=NC2=C(C=C1)CCC2 Z1198183883 [0,1,0,1,0,0|1,0,0]=3 1154 B11R2.36 NC1=NC2=C(C=C1)OCC2 Z1203582734 [0,1,0,1,0,0|2,0,0]=4 1155 B11R2.36 NC1=NC2=C(C=N1)CCC2 Z1137168278 [0,1,0,1,0,0|2,0,0]=4 1156 B11R2.36 O=C1C=C2CCCC2=CN1 Z1255494860 [0,1,0,1,0,0|1,0,1]=4 1157 B11R2.36 O=C1C=C2CCCC2=NN1 Z935132918 [0,1,0,1,0,0|2,0,0]=4 1158 B11R2.36 O=C1C=CC2=C(N1)CCC2 Z234895263 [0,1,0,1,0,0|1,0,1]=4 1159 B11R2.36 OC1=CC2=C(CCC2)N=C1 Z1255498919 [0,1,0,1,0,0|1,0,0]=3 1160 B11R2.36 OC1=CC2=C(N=C1)NCC2 Z2310677431 [0,1,0,1,0,0|2,0,0]=4 1161 B11R2.36 OC1=NC2=C(C=C1)CCN2 Z5351512817 [0,1,0,1,0,0|2,0,0]=4 1162 B11R2.36 OC1=NC2=C(C=C1)CNC2 Z4913752558 [0,1,0,1,0,0|2,0,0]=4 1163 B11R2.10 CC1CC2=C(N1)C=CC=C2 Z104472410 [0,1,0,1,0,0|2,0,0]=4 1164 B11R2.10 CC1CC2=C(N1)C=CN=C2 Z1203822742 [0,1,0,1,0,0|1,0,0]=3 1165 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [0,1,0,1,0,0|2,0,0]=4 1166 B11R2.10 NC1CC2=C(C1)C=CC=C2 Z1741971562 [0,1,0,1,0,0|2,0,0]=4 1167 B11R2.10 NC1CC2=C(C1)C=NC=C2 Z2238944796 [0,1,0,1,0,0|1,0,0]=3 1168 B11R2.10 NC1CC2=C(C1)N=CC=C2 Z3069017080 [0,1,0,1,0,0|1,0,0]=3 1169 B11R2.10 NC1CC2=C(C1)N=CC=N2 Z4953585301 [0,1,0,1,0,0|0,0,0]=2 1170 B11R2.20 C1=CC2=C(C=C1)CNCC2 Z57834231 [0,1,0,1,0,0|2,0,0]=4 1171 B11R2.20 C1=CC2=C(C=C1)COCC2 Z756090080 [0,1,0,1,0,0|2,0,0]=4 1172 B11R2.20 C1=CC2=C(C=C1)OCCC2 Z728136016 [0,1,0,1,0,0|2,0,0]=4 1173 B11R2.20 C1=CC2=C(C=N1)CCCC2 Z104492180 [0,1,0,1,0,0|1,0,0]=3 1174 B11R2.20 C1=CC2=C(C=N1)CCNC2 Z3243651255 [0,1,0,1,0,0|1,0,0]=3 1175 B11R2.20 C1=CC2=C(C=N1)CNCC2 Z3058791291 [0,1,0,1,0,0|1,0,0]=3 1176 B11R2.20 C1=CC2=C(C=N1)COCC2 Z4394915129 [0,1,0,1,0,0|1,0,0]=3 1177 B11R2.20 C1=CC2=C(C=N1)NCCC2 Z3243651200 [0,1,0,1,0,0|1,0,0]=3 1178 B11R2.20 C1=CC2=C(C=N1)NCCN2 Z1203732990 [0,1,0,1,0,0|2,0,0]=4 1179 B11R2.20 C1=CC2=C(C=N1)NCCO2 Z2217033032 [0,1,0,1,0,0|2,0,0]=4 1180 B11R2.20 C1=CC2=C(CCCC2)N=C1 Z1201617100 [0,1,0,1,0,0|1,0,0]=3 1181 B11R2.20 C1=CC2=C(CCCN2)N=C1 Z212053854 [0,1,0,1,0,0|1,0,0]=3 1182 B11R2.20 C1=CC2=C(CCNC2)N=C1 Z2142036515 [0,1,0,1,0,0|1,0,0]=3 1183 B11R2.20 C1=CC2=C(CCNC2)N=N1 Z3487941028 [0,1,0,1,0,0|2,0,0]=4 1184 B11R2.20 C1=CC2=C(CCSC2)N=C1 Z3492694447 [0,1,0,1,0,0|1,0,0]=3 1185 B11R2.20 C1=CC2=C(N=C1)NCCC2 Z1198176448 [0,1,0,1,0,0|1,0,0]=3 1186 B11R2.20 C1=CC2=C(N=C1)NCCN2 Z1198175971 [0,1,0,1,0,0|2,0,0]=4 1187 B11R2.20 C1=CC2=C(N=C1)OCCN2 Z1201624799 [0,1,0,1,0,0|2,0,0]=4 1188 B11R2.20 C1=NC2=C(CNCC2)N=C1 Z5626910804 [0,1,0,1,0,0|0,0,0]=2 1189 B11R2.20 C1=NC=NC2=C1CCNC2 Z2724335023 [0,1,0,1,0,0|2,0,0]=4 1190 B11R2.55 NC1=C(C=CC=C1)C2CC2 Z336079888 [0,1,0,1,0,0|2,0,0]=4 1191 B11R2.55 NC1=C(C=CC=N1)C2CC2 Z4496948738 [0,1,0,1,0,0|1,0,0]=3 1192 B11R2.55 NC1=C(C=NC=C1)C2CC2 Z4521980438 [0,1,0,1,0,0|1,0,0]=3 1193 B11R2.55 NC1=C(N=CC=C1)C2CC2 Z1521319401 [0,1,0,1,0,0|1,0,0]=3 1194 B11R2.55 NC1=C(N=CC=N1)C2CC2 Z1203653375 [0,1,0,1,0,0|0,0,0]=2 1195 B11R2.106 BrC1=C2NCCC2=CN=C1 Z4898391975 [0,1,0,1,0,0|2,0,0]=4 1196 B11R2.106 CC1=C2CCNC2=NC=C1 Z1203731311 [0,1,0,1,0,0|2,0,0]=4 1197 B11R2.106 CC1=C2CNCC2=NC=C1 Z3595590454 [0,1,0,1,0,0|2,0,0]=4 1198 B11R2.106 ClC1=C2CCCC2=NC=N1 Z813019322 [0,1,0,1,0,0|2,0,0]=4 1199 B11R2.106 IC1=C2CCOC2=NC=C1 Z3247248061 [0,1,0,1,0,0|2,0,0]=4 1200 B11R2.106 NC1=C2CCCC2=CN=C1 Z3073119330 [0,1,0,1,0,0|1,0,0]=3 1201 B11R2.106 NC1=C2CCCC2=NC=N1 Z234796414 [0,1,0,1,0,0|2,0,0]=4 1202 B11R2.106 NC1=C2CCOC2=CC=N1 Z2732447796 [0,1,0,1,0,0|2,0,0]=4 1203 B11R2.106 NC1=C2CCOC2=NC=C1 Z1862023680 [0,1,0,1,0,0|2,0,0]=4 1204 B11R2.106 O=C1C=CC=C2N1CCC2 Z1258980489 [0,1,0,1,0,0|1,0,1]=4 1205 B11R2.106 O=C1NC=NC2=C1CCC2 Z813020070 [0,1,0,1,0,0|2,0,0]=4 1206 B11R2.106 OC1=C2CCCC2=CC=C1 Z1198149277 [0,1,0,1,0,0|2,0,0]=4 1207 B11R2.106 OC1=C2CCNC2=CC=N1 Z3033557931 [0,1,0,1,0,0|2,0,0]=4 1208 B11R2.106 OC1=C2CNCC2=NC=C1 Z4511420933 [0,1,0,1,0,0|2,0,0]=4 1209 B11R2.988 NCC1CC2=C1C=CC=C2 Z234895091 [0,1,0,1,0,0|2,0,0]=4 1210 B11R2.35 BrC1=NC=NC(=C1)C2CC2 Z1198319302 [0,1,0,1,0,0|2,0,0]=4 1211 B11R2.35 ClC1=CC(=NC=C1)C2CC2 Z4714470389 [0,1,0,1,0,0|1,0,0]=3 1212 B11R2.35 ClC1=NC(=CC=C1)C2CO2 Z3271515213 [0,1,0,1,0,0|2,0,0]=4 1213 B11R2.35 ClC1=NC(=CC=N1)C2CC2 Z1198234901 [0,1,0,1,0,0|2,0,0]=4 1214 B11R2.35 ClC1=NC(=NC=C1)C2CC2 Z445153110 [0,1,0,1,0,0|2,0,0]=4 1215 B11R2.35 ClC1=NC=NC(=C1)C2CC2 Z1124752380 [0,1,0,1,0,0|2,0,0]=4 1216 B11R2.35 NC1=CC(=CC=C1)C2CC2 Z992239700 [0,1,0,1,0,0|2,0,0]=4 1217 B11R2.35 NC1=CC(=CN=C1)C2CC2 Z4513216590 [0,1,0,1,0,0|1,0,0]=3 1218 B11R2.35 NC1=NC(=CC=N1)C2CC2 Z991536704 [0,1,0,1,0,0|2,0,0]=4 1219 B11R2.35 NC1=NC(=NC=C1)C2CC2 Z856211350 [0,1,0,1,0,0|2,0,0]=4 1220 B11R2.35 O=C1C=COC(=C1)C2CC2 Z4461966095 [0,1,0,1,0,0|2,0,0]=4 1221 B11R2.35 O=C1N=C(C=CN1)C2CC2 Z1203747698 [0,1,0,1,0,0|2,0,0]=4 1222 B11R2.35 OC1=CC(=CC=C1)C2CC2 Z1198170922 [0,1,0,1,0,0|2,0,0]=4 1223 B11R2.35 OC1=CC(=NC=C1)C2CC2 Z1255493056 [0,1,0,1,0,0|1,0,0]=3 1224 B11R2.35 OC1=NC(=NC=C1)C2CC2 Z1259335801 [0,1,0,1,0,0|2,0,0]=4 1225 B11R2.1 CC1CNC2=C1C=CC=C2 Z415739264 [0,1,0,1,0,0|2,0,0]=4 1226 B11R2.1 CC1CNC2=C1C=CN=C2 Z3400245703 [0,1,0,1,0,0|1,0,0]=3 1227 B11R2.1 CC1CNC2=C1N=CC=C2 Z3464420345 [0,1,0,1,0,0|1,0,0]=3 1228 B11R2.1 CC1NCC2=C1C=CC=C2 Z1203731964 [0,1,0,1,0,0|2,0,0]=4 1229 B11R2.1 NC1CCC2=C1C=CC=C2 Z168884748 [0,1,0,1,0,0|2,0,0]=4 1230 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 Z1741972748 [0,1,0,1,0,0|2,0,0]=4 1231 B11R2.1 O=C1CCC2=C1C=NC=C2 Z1198181243 [0,1,0,1,0,0|1,0,1]=4 1232 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 Z2309888982 [0,1,0,1,0,0|2,0,0]=4 1233 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 Z2296167800 [0,1,0,1,0,0|2,0,0]=4 1234 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 Z2517097696 [0,1,0,1,0,0|2,0,0]=4 1235 B11R2.40 NC1(CC1)C2=CC=CC=C2 Z1262398449 [0,1,0,1,0,0|2,0,0]=4 1236 B11R2.40 NC1(CC1)C2=CN=CC=C2 Z3241265434 [0,1,0,1,0,0|1,0,0]=3 1237 B11R2.40 NC1(CC1)C2=NC=CC=C2 Z995042286 [0,1,0,1,0,0|1,0,0]=3 1238 B11R2.40 NC1(CC1)C2=NC=CC=N2 Z3243412657 [0,1,0,1,0,0|2,0,0]=4 1239 B11R2.239 C1=CC(=NC=N1)C2CNC2 Z3244818217 [0,1,0,1,0,0|2,0,0]=4 1240 B11R2.239 C1=CC=C(C=C1)C2CCN2 Z359510120 [0,1,0,1,0,0|2,0,0]=4 1241 B11R2.238 C1=CC(=CN=C1)NC2CC2 Z1203747527 [0,1,0,1,0,0|1,0,0]=3 1242 B11R2.238 C1=CC=C(C=C1)CC2CO2 Z1020680006 [0,1,0,1,0,0|2,0,0]=4 1243 B11R2.238 C1=CC=C(C=C1)C[C@@H]2CO2 Z1617991494 [0,1,0,1,0,0|2,0,0]=4 1244 B11R2.238 C1=CC=C(C=C1)C[C@H]2CO2 Z2216712384 [0,1,0,1,0,0|2,0,0]=4 1245 B11R2.238 C1=CC=C(C=C1)NC2CC2 Z1203731288 [0,1,0,1,0,0|2,0,0]=4 1246 B7R1.1 CCC1=CC=CO1 Z640169748 [1,0,0,0,1,0|1,0,0]=3 1247 B7R1.1 CCC1=CNC=N1 Z1203731354 [1,0,0,0,1,0|0,0,1]=3 1248 B7R1.1 CCC1=CNN=C1 Z1139192482 [1,0,0,0,1,0|1,0,0]=3 1249 B7R1.1 CCC1=NC=CN1 Z803154382 [1,0,0,0,1,0|0,0,1]=3 1250 B7R1.1 CCC1=NN=CN1 Z2065464313 [1,0,0,0,1,0|1,0,1]=4 1251 B7R1.1 CCC1=NN=NN1 Z335291070 [1,0,0,0,1,0|2,0,0]=4 1252 B7R1.1 CCC1=NNC=C1 Z1238571110 [1,0,0,0,1,0|1,0,0]=3 1253 B7R1.1 CCN1C=CC=N1 Z600618624 [1,0,0,0,1,0|1,0,0]=3 1254 B7R1.1 CCN1C=CN=C1 Z286789018 [1,0,0,0,1,0|1,0,0]=3 1255 B7R1.1 CCN1C=CN=N1 Z4497103939 [1,0,0,0,1,0|2,0,0]=4 1256 B7R1.1 CNC1=CNN=C1 Z1313483441 [1,0,0,0,1,0|2,0,0]=4 1257 B7R1.1 CNC1=NC=CS1 Z336483296 [1,0,0,0,1,0|2,0,0]=4 1258 B7R1.1 CNC1=NOC=C1 Z2489381644 [1,0,0,0,1,0|2,0,0]=4 1259 B7R1.1 COC1=CNN=C1 Z2525138345 [1,0,0,0,1,0|2,0,0]=4 1260 B7R1.1 COC1=NNC=C1 Z2130657375 [1,0,0,0,1,0|2,0,0]=4 1261 B7R1.1 COC1=NSC=C1 Z1198333966 [1,0,0,0,1,0|2,0,0]=4 1262 B7R1.1 CSC1=NC=CN1 Z1203730949 [1,0,0,0,1,0|1,0,1]=4 1263 B7R1.1 NCC1=CC=CN1 Z976631692 [1,0,0,0,1,0|1,0,1]=4 1264 B7R1.1 NCC1=CC=CS1 Z104485908 [1,0,0,0,1,0|2,0,0]=4 1265 B7R1.1 NCC1=CC=NO1 Z1964347782 [1,0,0,0,1,0|2,0,0]=4 1266 B7R1.1 NCC1=CC=NS1 Z2310716170 [1,0,0,0,1,0|2,0,0]=4 1267 B7R1.1 NCC1=CN=CN1 Z1250100778 [1,0,0,0,1,0|1,0,1]=4 1268 B7R1.1 NCC1=CNC=C1 Z1203586194 [1,0,0,0,1,0|1,0,1]=4 1269 B7R1.1 NCC1=CNN=C1 Z1198394221 [1,0,0,0,1,0|2,0,0]=4 1270 B7R1.1 NCC1=COC=C1 Z406680098 [1,0,0,0,1,0|2,0,0]=4 1271 B7R1.1 NCC1=CSN=C1 Z2310727787 [1,0,0,0,1,0|2,0,0]=4 1272 B7R1.1 NCC1=NC=CN1 Z1962341939 [1,0,0,0,1,0|1,0,1]=4 1273 B7R1.1 NCC1=NC=CO1 Z4774639311 [1,0,0,0,1,0|2,0,0]=4 1274 B7R1.1 NCC1=NC=CS1 Z1198107502 [1,0,0,0,1,0|2,0,0]=4 1275 B7R1.1 NCC1=NC=NO1 Z2310727797 [1,0,0,0,1,0|2,0,0]=4 1276 B7R1.1 NCC1=NOC=C1 Z802903300 [1,0,0,0,1,0|2,0,0]=4 1277 B7R1.1 NCC1=NOC=N1 Z1266854926 [1,0,0,0,1,0|2,0,0]=4 1278 B7R1.1 NCC1=NON=C1 Z2944173400 [1,0,0,0,1,0|2,0,0]=4 1279 B7R1.1 OCC1=CC=CO1 Z104472794 [1,0,0,0,1,0|2,0,0]=4 1280 B7R1.1 OCC1=CC=CS1 Z104478586 [1,0,0,0,1,0|2,0,0]=4 1281 B7R1.1 OCC1=CNC=N1 Z234898057 [1,0,0,0,1,0|1,0,1]=4 1282 B7R1.1 OCC1=CNN=C1 Z812520032 [1,0,0,0,1,0|2,0,0]=4 1283 B7R1.1 OCC1=COC=C1 Z397587426 [1,0,0,0,1,0|2,0,0]=4 1284 B7R1.1 OCC1=NC=CN1 Z825761068 [1,0,0,0,1,0|1,0,1]=4 1285 B7R1.1 OCC1=NC=CS1 Z57161013 [1,0,0,0,1,0|2,0,0]=4 1286 B7R1.1 OCC1=NOC=C1 Z875021162 [1,0,0,0,1,0|2,0,0]=4 1287 B7R1.1 OCN1C=CC=N1 Z1198155714 [1,0,0,0,1,0|2,0,0]=4 1288 B7R1.1 OCN1C=NC=N1 Z57071658 [1,0,0,0,1,0|2,0,0]=4