0 B11R1.20 C/[N+](=C/C1=CC=C(C=C1)Br)/[O-] Z57107891 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.20 C/[N+](=C/C1=CC=C(C=C1)Cl)/[O-] Z57107890 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.20 CC(=O)NC1=CC=C(C=C1)C Z28134680 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl Z28161730 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.20 CC(=O)NC1=CC=C(C=C1)F Z27805821 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.20 CC(=O)NC1=CC=C(C=C1)I Z30316374 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.20 CC(=O)NC1=CC=C(C=C1)N Z56926521 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.20 CC(=O)NC1=CC=C(C=C1)O Z56946051 [0,0,0,0,0,0|2,0,1]=3 9 B11R1.20 CC(=O)NC1=CC=C(C=C1)S Z104484984 [0,0,0,0,0,0|2,1,1]=4 10 B11R1.20 CC(=O)OC1=CC=C(C=C1)O Z1198155166 [0,0,0,0,0,0|2,0,1]=3 11 B11R1.20 CC(=S)NC1=CC=C(C=C1)F Z56756640 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.20 CC(C)CC1=CC=C(C=C1)N Z1463350056 [0,0,0,0,0,0|2,0,0]=2 13 B11R1.20 CC(C)CC1=NC=C(C=C1)Br Z1269179231 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.20 CC(C)CC1=NC=C(C=N1)N Z381402572 [0,0,0,0,0,0|4,0,0]=4 15 B11R1.20 CC(C)NC1=CC=C(C=C1)Cl Z993967140 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.20 CC(C)NC1=CC=C(C=C1)F Z266481896 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.20 CC(C)NC1=NC=C(C=C1)Br Z359297038 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.20 CC(C)OC1=CC=C(C=C1)Br Z53834735 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.20 CC(C)OC1=CC=C(C=C1)I Z54181200 [0,0,0,0,0,0|3,0,0]=3 20 B11R1.20 CC(C)OC1=NC=C(C=C1)Br Z808608768 [0,0,0,0,0,0|4,0,0]=4 21 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [0,0,0,0,0,0|0,0,0]=0 22 B11R1.20 CC1=CC=C(C=C1)CC(=N)N Z3244909870 [0,0,0,0,0,0|2,0,1]=3 23 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.20 CC1=CC=C(C=C1)NC(=O)N Z56754677 [0,0,0,0,0,0|3,0,1]=4 25 B11R1.20 CC1=CC=C(C=C1)NC(=S)N Z57965505 [0,0,0,0,0,0|3,0,1]=4 26 B11R1.20 CC1=CC=C(C=C1)NC(C)C Z992717194 [0,0,0,0,0,0|3,0,0]=3 27 B11R1.20 CC1=CC=C(C=C1)OC(C)C Z53834229 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.20 CN(C)CC1=CC=C(C=C1)N Z228584348 [0,0,0,0,0,0|3,0,0]=3 29 B11R1.20 CN(C)CC1=CN=C(C=C1)N Z1723849137 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.20 FC(F)SC1=CC=C(C=C1)Cl Z55625938 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.20 FC1=CC=C(C=C1)OC(F)F Z55671914 [0,0,0,0,0,0|4,0,0]=4 32 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br Z1518844582 [0,0,0,0,0,0|2,0,1]=3 33 B11R1.20 N=C(N)CC1=CC=C(C=C1)F Z415636754 [0,0,0,0,0,0|2,0,1]=3 34 B11R1.20 N=C(N)NC1=CC=C(C=C1)Br Z5099116935 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.20 N=C(N)NC1=CC=C(C=C1)Cl Z2931635778 [0,0,0,0,0,0|3,0,1]=4 36 B11R1.20 N=C(N)NC1=CC=C(C=C1)N Z2471157136 [0,0,0,0,0,0|3,0,1]=4 37 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [0,0,0,0,0,0|2,0,1]=3 38 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [0,0,0,0,0,0|2,0,1]=3 39 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [0,0,0,0,0,0|2,0,1]=3 40 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [0,0,0,0,0,0|2,0,1]=3 41 B11R1.20 NC(=O)NC1=CC=C(C=C1)Br Z89283357 [0,0,0,0,0,0|3,0,1]=4 42 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl Z56754682 [0,0,0,0,0,0|3,0,1]=4 43 B11R1.20 NC(=O)NC1=CC=C(C=C1)F Z166687094 [0,0,0,0,0,0|3,0,1]=4 44 B11R1.20 NC(=O)NC1=CC=C(C=C1)I Z56754684 [0,0,0,0,0,0|3,0,1]=4 45 B11R1.20 NC(=O)NC1=CC=C(C=C1)N Z239123648 [0,0,0,0,0,0|3,0,1]=4 46 B11R1.20 NC(=S)CC1=CC=C(C=C1)F Z285131734 [0,0,0,0,0,0|2,0,1]=3 47 B11R1.20 NC(=S)NC1=CC=C(C=C1)Cl Z56939186 [0,0,0,0,0,0|3,0,1]=4 48 B11R1.20 NC(=S)NC1=CC=C(C=C1)F Z57455239 [0,0,0,0,0,0|3,0,1]=4 49 B11R1.20 NC1=CC=C(C=C1)CC(=O)O Z104481066 [0,0,0,0,0,0|3,0,1]=4 50 B11R1.20 NC1=CC=C(C=C1)OC(F)F Z56899041 [0,0,0,0,0,0|4,0,0]=4 51 B11R1.20 NC1=CC=C(C=C1)SC(F)F Z335451374 [0,0,0,0,0,0|4,0,0]=4 52 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl Z217293314 [0,0,0,0,0,0|3,0,1]=4 53 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br Z90121253 [0,0,0,0,0,0|3,0,1]=4 54 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [0,0,0,0,0,0|3,0,1]=4 55 B11R1.20 O=C(O)CC1=CC=C(C=C1)F Z104477312 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.1 CC1=CC=C(C=C1)CC#N Z285131444 [1,0,0,0,0,0|1,0,2]=4 57 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [1,0,0,0,0,0|1,0,0]=2 59 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.1 CC1=NC=C(C=C1)CCN Z600584220 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.1 CCCC1=CC=C(C=C1)Br Z299596168 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.1 CCCC1=CC=C(C=C1)N Z104492166 [1,0,0,0,0,0|1,0,0]=2 63 B10R1.1 CCNC1=CC=C(C=C1)Br Z286365048 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.1 CCNC1=CC=C(C=C1)Cl Z2902298062 [1,0,0,0,0,0|2,0,0]=3 65 B10R1.1 CCNC1=CC=C(C=C1)F Z89270849 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.1 CCNC1=CC=C(C=C1)N Z359511474 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.1 CCNC1=CC=C(C=C1)O Z1823256830 [1,0,0,0,0,0|1,0,0]=2 68 B10R1.1 CCNC1=CNC(=O)C=C1 Z5871830340 [1,0,0,0,0,0|2,0,1]=4 69 B10R1.1 CCNC1=NC=C(C=C1)Br Z359297778 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.1 CCNC1=NC=C(C=C1)I Z2233927789 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.1 CCOC1=CC=C(C=C1)C Z53834228 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.1 CCOC1=CC=C(C=C1)N Z57127438 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.1 CCOC1=CC=C(C=C1)S Z166646982 [1,0,0,0,0,0|1,1,0]=3 74 B10R1.1 CCOC1=NC=C(C=C1)N Z240084310 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.1 CCSC1=NC=C(C=C1)Br Z742922262 [1,0,0,0,0,0|3,0,0]=4 76 B10R1.1 CCSC1=NC=C(C=C1)N Z332377604 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.1 CNCC1=CC=C(C=C1)Br Z56175269 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [1,0,0,0,0,0|2,0,0]=3 79 B10R1.1 CNCC1=CC=C(C=C1)Cl Z56956070 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.1 CNCC1=CC=C(C=C1)F Z56963340 [1,0,0,0,0,0|2,0,0]=3 81 B10R1.1 CNCC1=CC=C(C=C1)I Z4242747560 [1,0,0,0,0,0|2,0,0]=3 82 B10R1.1 CNCC1=CN=C(C=C1)Cl Z265498862 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.1 CNCC1=CN=C(C=C1)F Z1745074466 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.1 CNCC1=CN=C(C=C1)N Z1255388567 [1,0,0,0,0,0|3,0,0]=4 85 B10R1.1 CNCC1=NC=C(C=C1)Br Z5436471179 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.1 CNCC1=NC=C(C=C1)C Z1255425232 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.1 COCC1=CC=C(C=C1)N Z240084568 [1,0,0,0,0,0|2,0,0]=3 88 B10R1.1 CSCC1=CC=C(C=C1)Br Z19854469 [1,0,0,0,0,0|2,0,0]=3 89 B10R1.1 CSCC1=CC=C(C=C1)N Z732207336 [1,0,0,0,0,0|2,0,0]=3 90 B10R1.1 CSCC1=CN=C(C=C1)Cl Z732206922 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.1 N#CCC1=CC=C(C=C1)F Z89283961 [1,0,0,0,0,0|1,0,2]=4 92 B10R1.1 N#CCC1=CC=C(C=C1)N Z90122117 [1,0,0,0,0,0|1,0,2]=4 93 B10R1.1 N#CCC1=CC=C(C=C1)O Z90120144 [1,0,0,0,0,0|0,0,2]=3 94 B10R1.1 NC1=CC=C(C=C1)CCO Z276600190 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.1 NC1=CN=C(C=C1)CCO Z1898597735 [1,0,0,0,0,0|3,0,0]=4 96 B10R1.1 NCCC1=CC=C(C=C1)Br Z285143750 [1,0,0,0,0,0|1,0,0]=2 97 B10R1.1 NCCC1=CC=C(C=C1)Cl Z57051065 [1,0,0,0,0,0|1,0,0]=2 98 B10R1.1 NCCC1=CC=C(C=C1)F Z90122126 [1,0,0,0,0,0|1,0,0]=2 99 B10R1.1 NCCC1=CC=C(C=C1)I Z2515133713 [1,0,0,0,0,0|1,0,0]=2 100 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [1,0,0,0,0,0|0,0,0]=1 101 B10R1.1 NCCC1=CN=C(C=C1)Cl Z1198178633 [1,0,0,0,0,0|2,0,0]=3 102 B10R1.1 NCCC1=CN=C(N=C1)O Z2725055726 [1,0,0,0,0,0|2,0,0]=3 103 B10R1.1 NCCC1=NC=C(C=C1)F Z2238508662 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.1 NCCC1=NC=C(C=C1)O Z2350909287 [1,0,0,0,0,0|1,0,0]=2 105 B10R1.1 NCCC1=NC=C(C=N1)Br Z4752114140 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.1 NOCC1=CC=C(C=C1)Cl Z1198164677 [1,0,0,0,0,0|2,0,0]=3 107 B10R1.1 O/N=C/C1=CC=C(C=C1)O Z49568314 [1,0,0,0,0,0|2,0,1]=4 108 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [1,0,0,0,0,0|2,0,1]=4 109 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [1,0,0,0,0,0|2,0,1]=4 110 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [1,0,0,0,0,0|2,0,1]=4 111 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [1,0,0,0,0,0|2,0,1]=4 112 B10R1.1 OCCC1=CC=C(C=C1)Br Z397587340 [1,0,0,0,0,0|2,0,0]=3 113 B10R1.1 OCCC1=CC=C(C=C1)F Z397587326 [1,0,0,0,0,0|2,0,0]=3 114 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [1,0,0,0,0,0|1,0,0]=2 115 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [1,0,0,0,0,0|2,0,1]=4 116 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [1,0,0,0,0,0|2,0,1]=4 117 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [1,0,0,0,0,0|1,0,0]=2 118 B10R1.18 CC(C)CC1=NC=CC=C1 Z1201621742 [1,0,0,0,0,0|2,0,0]=3 119 B10R1.18 CC(C)NC1=CC=CC=C1 Z104475020 [1,0,0,0,0,0|2,0,0]=3 120 B10R1.18 CC(C)NC1=CN=CC=C1 Z334882282 [1,0,0,0,0,0|3,0,0]=4 121 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [1,0,0,0,0,0|2,0,0]=3 122 B10R1.18 CC(C)OC1=CC=NC=C1 Z1140308716 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [1,0,0,0,0,0|1,0,0]=2 124 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [1,0,0,0,0,0|1,0,0]=2 125 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [1,0,0,0,0,0|2,0,0]=3 126 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [1,0,0,0,0,0|2,0,0]=3 127 B10R1.18 CN(C)CC1=CN=CC=C1 Z140563088 [1,0,0,0,0,0|3,0,0]=4 128 B10R1.18 CN(C)CC1=NC=CC=C1 Z4614651190 [1,0,0,0,0,0|3,0,0]=4 129 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [1,0,0,0,0,0|1,0,1]=3 130 B10R1.18 N=C(N)CC1=CC=NC=C1 Z2441004470 [1,0,0,0,0,0|2,0,1]=4 131 B10R1.18 N=C(N)CC1=CN=CC=C1 Z2350941593 [1,0,0,0,0,0|2,0,1]=4 132 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [1,0,0,0,0,0|1,0,1]=3 133 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [1,0,0,0,0,0|2,0,1]=4 134 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [1,0,0,0,0,0|2,0,1]=4 135 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [1,0,0,0,0,0|1,0,1]=3 136 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [1,0,0,0,0,0|2,0,1]=4 137 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [1,0,0,0,0,0|3,0,0]=4 138 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [1,0,0,0,0,0|3,0,0]=4 139 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [1,0,0,0,0,0|3,0,0]=4 140 B12R1.4 C#CC1=CC=C(C=C1)OC(C)C Z1080385566 [0,1,0,0,0,0|3,0,0]=4 141 B12R1.4 CC(=O)NC1=CC=C(C=C1)CO Z228585230 [0,1,0,0,0,0|2,0,1]=4 142 B12R1.4 CC(C)CC1=CC=C(C=C1)C=O Z385369920 [0,1,0,0,0,0|1,0,1]=3 143 B12R1.4 CC(C)CC1=CC=C(C=C1)CO Z385370338 [0,1,0,0,0,0|1,0,0]=2 144 B12R1.4 CC(C)CC1=NC=C(C=C1)C=O Z2732484016 [0,1,0,0,0,0|2,0,1]=4 145 B12R1.4 CC(C)NC1=CC=C(C=C1)CN Z4905251594 [0,1,0,0,0,0|3,0,0]=4 146 B12R1.4 CC(C)OC1=CC=C(C=C1)C#N Z53834533 [0,1,0,0,0,0|3,0,0]=4 147 B12R1.4 CC(C)OC1=CC=C(C=C1)C=O Z53833127 [0,1,0,0,0,0|2,0,1]=4 148 B12R1.4 CC(C)OC1=CC=C(C=C1)CO Z54549633 [0,1,0,0,0,0|2,0,0]=3 149 B12R1.4 CC(C)SC1=CC=C(C=C1)CO Z1157828975 [0,1,0,0,0,0|2,0,0]=3 150 B12R1.4 CC(O)CC1=CC=C(C=C1)C=O Z1511913303 [0,1,0,0,0,0|1,0,1]=3 151 B12R1.4 CCC1=CC=C(C=C1)NC(C)C Z266668684 [0,1,0,0,0,0|3,0,0]=4 152 B12R1.4 CN(C)CC1=CC=C(C=C1)C#N Z54750053 [0,1,0,0,0,0|3,0,0]=4 153 B12R1.4 CN(C)CC1=CC=C(C=C1)C=O Z1065726000 [0,1,0,0,0,0|2,0,1]=4 154 B12R1.4 CN(C)CC1=CC=C(C=C1)CO Z336081024 [0,1,0,0,0,0|2,0,0]=3 155 B12R1.4 CNC1=CC=C(C=C1)OC(C)C Z1889917384 [0,1,0,0,0,0|3,0,0]=4 156 B12R1.4 COC1=CC=C(C=C1)CC(=O)N Z33546648 [0,1,0,0,0,0|1,0,1]=3 157 B12R1.4 COC1=CC=C(C=C1)CC(=O)O Z104476074 [0,1,0,0,0,0|2,0,1]=4 158 B12R1.4 COC1=CC=C(C=C1)CC(C)O Z228586162 [0,1,0,0,0,0|1,0,0]=2 159 B12R1.4 COC1=CC=C(C=C1)NC(=N)N Z118438372 [0,1,0,0,0,0|2,0,1]=4 160 B12R1.4 COC1=CC=C(C=C1)NC(=O)C Z28138902 [0,1,0,0,0,0|2,0,1]=4 161 B12R1.4 COC1=CC=C(C=C1)NC(=O)N Z56754681 [0,1,0,0,0,0|2,0,1]=4 162 B12R1.4 COC1=CC=C(C=C1)NC(=S)N Z56921428 [0,1,0,0,0,0|2,0,1]=4 163 B12R1.4 COC1=CC=C(C=C1)OC(=O)C Z30195429 [0,1,0,0,0,0|2,0,1]=4 164 B12R1.4 COC1=NC=C(C=C1)CC(=O)C Z1216822629 [0,1,0,0,0,0|2,0,1]=4 165 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)N Z982774006 [0,1,0,0,0,0|2,0,1]=4 166 B12R1.4 OCC1=CC=C(C=C1)OC(F)F Z335244764 [0,1,0,0,0,0|3,0,0]=4 167 B12R1.19 CC(=O)CC1=CC(=C(C=C1)Br)F Z1269186824 [0,1,0,0,0,0|2,0,1]=4 168 B12R1.19 CC(=O)CC1=CC(=C(C=C1)O)Br Z1269192817 [0,1,0,0,0,0|1,0,1]=3 169 B12R1.19 CC(=O)NC1=CC(=C(C=C1)O)F Z1216844087 [0,1,0,0,0,0|2,0,1]=4 170 B12R1.19 CC(C)NC1=CC(=C(C=C1)Cl)Cl Z267194630 [0,1,0,0,0,0|3,0,0]=4 171 B12R1.19 CC(C)OC1=CC(=C(C=C1)N)Cl Z955172598 [0,1,0,0,0,0|3,0,0]=4 172 B12R1.19 CC(C)OC1=CC(=C(C=C1)N)F Z839157364 [0,1,0,0,0,0|3,0,0]=4 173 B12R1.19 CC(N)CC1=CC(=C(C=C1)F)Br Z285144030 [0,1,0,0,0,0|1,0,0]=2 174 B12R1.19 CC(N)CC1=CC(=C(C=C1)O)O Z1891776857 [0,1,0,0,0,0|0,0,0]=1 175 B12R1.19 CC(O)CC1=CC(=C(C=C1)Br)F Z1295686053 [0,1,0,0,0,0|2,0,0]=3 176 B12R1.19 CC1=C(C=C(C=C1)CC(C)N)F Z4098107054 [0,1,0,0,0,0|1,0,0]=2 177 B12R1.19 CC1=C(C=C(C=C1)CN(C)C)N Z335289232 [0,1,0,0,0,0|3,0,0]=4 178 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [0,1,0,0,0,0|2,0,1]=4 179 B12R1.19 CC1=C(C=CC(=C1)CN(C)C)N Z335289244 [0,1,0,0,0,0|3,0,0]=4 180 B12R1.19 CC1=C(C=CC(=C1)OC(C)C)N Z239604804 [0,1,0,0,0,0|3,0,0]=4 181 B12R1.19 CN(C)CC1=CC(=C(C=C1)N)F Z1097100932 [0,1,0,0,0,0|3,0,0]=4 182 B12R1.19 CN(C)CC1=CC(=C(C=C1)O)Cl Z1945695050 [0,1,0,0,0,0|2,0,0]=3 183 B12R1.19 CS(=O)CC1=CC(=C(C=C1)Cl)N Z802580892 [0,1,0,0,0,0|3,0,0]=4 184 B12R1.19 NC(=O)CC1=CC(=C(C=C1)Cl)Cl Z33546666 [0,1,0,0,0,0|2,0,1]=4 185 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl Z1205411134 [0,1,0,0,0,0|2,0,1]=4 186 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)F Z1255445925 [0,1,0,0,0,0|2,0,1]=4 187 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [0,1,0,0,0,0|2,0,1]=4 188 B12R1.20 C=C(C)C(=O)C1=CC=C(C=C1)O Z1513599636 [0,1,0,0,0,0|1,0,2]=4 189 B12R1.20 CC(=O)C(C)C1=CC=C(C=C1)Cl Z1276728135 [0,1,0,0,0,0|2,0,1]=4 190 B12R1.20 CC(=O)C(Cl)C1=CC=C(C=C1)F Z1255439681 [0,1,0,0,0,0|2,0,1]=4 191 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)O Z335806634 [0,1,0,0,0,0|2,0,1]=4 192 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)Cl Z385417200 [0,1,0,0,0,0|2,0,1]=4 193 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)N Z1198162397 [0,1,0,0,0,0|2,0,1]=4 194 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)O Z1198150713 [0,1,0,0,0,0|1,0,1]=3 195 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)Br Z3211605350 [0,1,0,0,0,0|2,0,0]=3 196 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)Cl Z221528970 [0,1,0,0,0,0|2,0,0]=3 197 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)F Z99598998 [0,1,0,0,0,0|2,0,0]=3 198 B12R1.20 CC(C)C(O)C1=CC=C(C=C1)Cl Z513748660 [0,1,0,0,0,0|2,0,0]=3 199 B12R1.20 CC(C)C(O)C1=NC=C(C=C1)Br Z1649738214 [0,1,0,0,0,0|3,0,0]=4 200 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)Br Z56928896 [0,1,0,0,0,0|2,0,1]=4 201 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)Cl Z85933873 [0,1,0,0,0,0|2,0,1]=4 202 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)F Z56968508 [0,1,0,0,0,0|2,0,1]=4 203 B12R1.20 CC(N)C(=O)C1=CC=C(C=C1)Cl Z3023980683 [0,1,0,0,0,0|1,0,1]=3 204 B12R1.20 CC(N)C(O)C1=CC=C(C=C1)Br Z336086694 [0,1,0,0,0,0|1,0,0]=2 205 B12R1.20 CC(N)C(O)C1=CC=C(C=C1)F Z336086696 [0,1,0,0,0,0|1,0,0]=2 206 B12R1.20 CC1=CC=C(C=C1)C(=O)C(C)Cl Z56921784 [0,1,0,0,0,0|2,0,1]=4 207 B12R1.20 CN(C(=O)N)C1=CC=C(C=C1)O Z285211056 [0,1,0,0,0,0|2,0,1]=4 208 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)O Z68247175 [0,1,0,0,0,0|2,0,1]=4 209 B12R1.20 NC(=O)C(Br)C1=CC=C(C=C1)F Z198750878 [0,1,0,0,0,0|2,0,1]=4 210 B12R1.20 NC(=O)C(Cl)C1=CC=C(C=C1)Br Z56791849 [0,1,0,0,0,0|2,0,1]=4 211 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Br Z57069227 [0,1,0,0,0,0|2,0,1]=4 212 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl Z1255523404 [0,1,0,0,0,0|2,0,1]=4 213 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)F Z220512688 [0,1,0,0,0,0|2,0,1]=4 214 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O Z1198149764 [0,1,0,0,0,0|2,0,1]=4 215 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O Z1255364887 [0,1,0,0,0,0|2,0,1]=4 216 B12R1.49 CC(C#N)SC1=CC=C(C=C1)Br Z18744283 [0,1,0,0,0,0|2,0,1]=4 217 B12R1.49 CC(C#N)SC1=CC=C(C=C1)Cl Z19728690 [0,1,0,0,0,0|2,0,1]=4 218 B12R1.49 CC(C#N)SC1=CC=C(C=C1)F Z16034530 [0,1,0,0,0,0|2,0,1]=4 219 B12R1.49 CC(CN)OC1=CC=C(C=C1)Br Z844632490 [0,1,0,0,0,0|2,0,0]=3 220 B12R1.49 CC(CN)OC1=CC=C(C=C1)Cl Z844632498 [0,1,0,0,0,0|2,0,0]=3 221 B12R1.49 CC(CN)OC1=CC=C(C=C1)F Z274779140 [0,1,0,0,0,0|2,0,0]=3 222 B12R1.49 CC(CN)SC1=CC=C(C=C1)Br Z1266854950 [0,1,0,0,0,0|2,0,0]=3 223 B12R1.49 CC1=CC=C(C=C1)CC(=O)CCl Z316174762 [0,1,0,0,0,0|2,0,1]=4 224 B12R1.49 CC1=CC=C(C=C1)CC(=O)NO Z90728587 [0,1,0,0,0,0|2,0,1]=4 225 B12R1.49 CC1=CC=C(C=C1)CC(Br)C#N Z85923462 [0,1,0,0,0,0|2,0,1]=4 226 B12R1.49 CC1=CC=C(C=C1)CC(Cl)C=O Z982126370 [0,1,0,0,0,0|2,0,1]=4 227 B12R1.49 CC1=CC=C(C=C1)CC(N)CO Z1800620539 [0,1,0,0,0,0|1,0,0]=2 228 B12R1.49 CC1=CC=C(C=C1)OC(C)CN Z844632044 [0,1,0,0,0,0|2,0,0]=3 229 B12R1.49 CC1=CC=C(C=C1)SC(C)C#N Z45224430 [0,1,0,0,0,0|2,0,1]=4 230 B12R1.49 CCC(=O)CC1=CC=C(C=C1)Br Z513733694 [0,1,0,0,0,0|2,0,1]=4 231 B12R1.49 CCC(=O)CC1=CC=C(C=C1)C Z513735300 [0,1,0,0,0,0|2,0,1]=4 232 B12R1.49 CCC(=O)NC1=CC=C(C=C1)O Z223656304 [0,1,0,0,0,0|2,0,1]=4 233 B12R1.49 CCC(C)OC1=CC=C(C=C1)Br Z336342658 [0,1,0,0,0,0|3,0,0]=4 234 B12R1.49 CCC(C)OC1=CC=C(C=C1)N Z274541874 [0,1,0,0,0,0|3,0,0]=4 235 B12R1.49 CCC(C)OC1=CC=C(C=C1)O Z381414944 [0,1,0,0,0,0|2,0,0]=3 236 B12R1.49 CCC(N)CC1=CC=C(C=C1)Br Z2582143601 [0,1,0,0,0,0|1,0,0]=2 237 B12R1.49 CCC(N)CC1=CC=C(C=C1)C Z431980102 [0,1,0,0,0,0|1,0,0]=2 238 B12R1.49 CCC(N)CC1=CC=C(C=C1)Cl Z2044769785 [0,1,0,0,0,0|1,0,0]=2 239 B12R1.49 CCC(N)CC1=CC=C(C=C1)F Z2492774579 [0,1,0,0,0,0|1,0,0]=2 240 B12R1.49 CCC(N)CC1=CC=C(C=C1)O Z1815149210 [0,1,0,0,0,0|0,0,0]=1 241 B12R1.49 CCC(O)CC1=CC=C(C=C1)C Z513751166 [0,1,0,0,0,0|2,0,0]=3 242 B12R1.49 CNC(=O)CC1=CC=C(C=C1)Br Z30272406 [0,1,0,0,0,0|2,0,1]=4 243 B12R1.49 CNC(=O)CC1=CC=C(C=C1)N Z239124750 [0,1,0,0,0,0|2,0,1]=4 244 B12R1.49 CNC(=O)CC1=CC=C(C=C1)O Z135505392 [0,1,0,0,0,0|1,0,1]=3 245 B12R1.49 COC(=O)CC1=CC=C(C=C1)Br Z18830099 [0,1,0,0,0,0|2,0,1]=4 246 B12R1.49 COC(=O)CC1=CC=C(C=C1)Cl Z18425668 [0,1,0,0,0,0|2,0,1]=4 247 B12R1.49 COC(=O)CC1=CC=C(C=C1)N Z285139238 [0,1,0,0,0,0|2,0,1]=4 248 B12R1.49 COC(=O)NC1=CC=C(C=C1)O Z335810072 [0,1,0,0,0,0|2,0,1]=4 249 B12R1.49 C[C@@H](CN)OC1=CC=C(C=C1)Cl Z1860991587 [0,1,0,0,0,0|2,0,0]=3 250 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl Z3244488892 [0,1,0,0,0,0|1,0,0]=2 251 B12R1.49 NC(CO)CC1=CC=C(C=C1)F Z1849004242 [0,1,0,0,0,0|1,0,0]=2 252 B12R1.49 NC(CO)CC1=CC=C(C=C1)I Z1263636488 [0,1,0,0,0,0|1,0,0]=2 253 B12R1.49 NC1=CC=C(C=C1)CC(F)CO Z4580450313 [0,1,0,0,0,0|2,0,0]=3 254 B12R1.49 NCC(=O)CC1=CC=C(C=C1)F Z1889902528 [0,1,0,0,0,0|2,0,1]=4 255 B12R1.49 NCC(=O)NC1=CC=C(C=C1)O Z1262237164 [0,1,0,0,0,0|2,0,1]=4 256 B12R1.49 NCC(O)CC1=CC=C(C=C1)Br Z4990293859 [0,1,0,0,0,0|2,0,0]=3 257 B12R1.49 NNC(=O)CC1=CC=C(C=C1)Cl Z56346881 [0,1,0,0,0,0|2,0,1]=4 258 B12R1.49 NNC(=O)CC1=CC=C(C=C1)F Z56347387 [0,1,0,0,0,0|2,0,1]=4 259 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O Z295456854 [0,1,0,0,0,0|0,0,0]=1 260 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O Z203038576 [0,1,0,0,0,0|0,0,0]=1 261 B12R1.49 O=C(CC1=CC=C(C=C1)Br)NO Z59182179 [0,1,0,0,0,0|2,0,1]=4 262 B12R1.49 O=C(CC1=CC=C(C=C1)Cl)NO Z59182084 [0,1,0,0,0,0|2,0,1]=4 263 B12R1.49 O=C(CC1=CC=C(C=C1)F)NO Z59182031 [0,1,0,0,0,0|2,0,1]=4 264 B12R1.49 O=C(CC1=CC=C(C=C1)O)NO Z135512374 [0,1,0,0,0,0|1,0,1]=3 265 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Br Z408178414 [0,1,0,0,0,0|2,0,1]=4 266 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Cl Z316174770 [0,1,0,0,0,0|2,0,1]=4 267 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)F Z316174768 [0,1,0,0,0,0|2,0,1]=4 268 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)O Z166646964 [0,1,0,0,0,0|2,0,1]=4 269 B12R1.49 O=C(CO)CC1=CC=C(C=C1)F Z906206828 [0,1,0,0,0,0|2,0,1]=4 270 B12R1.106 CC(C)(C)CC1=CC=C(C=C1)Br Z1681356955 [0,1,0,0,0,0|2,0,0]=3 271 B12R1.106 CC(C)(C)OC1=CC=C(C=C1)Br Z1203159865 [0,1,0,0,0,0|3,0,0]=4 272 B12R1.106 CC(C)(C)OC1=CC=C(C=C1)N Z362795876 [0,1,0,0,0,0|3,0,0]=4 273 B12R1.106 CC(C)(C)SC1=CC=C(C=C1)N Z332377642 [0,1,0,0,0,0|3,0,0]=4 274 B12R1.106 CC(C)(N)CC1=CC=C(C=C1)Br Z1263529603 [0,1,0,0,0,0|1,0,0]=2 275 B12R1.106 CC(C)(O)CC1=CC=C(C=C1)Br Z513707720 [0,1,0,0,0,0|2,0,0]=3 276 B12R1.106 CC1=CC=C(C=C1)CC(C)(C)N Z415658550 [0,1,0,0,0,0|1,0,0]=2 277 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)Br Z416908782 [0,1,0,0,0,0|3,0,0]=4 278 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)N Z732208132 [0,1,0,0,0,0|3,0,0]=4 279 B12R1.106 CS(=O)(=O)NC1=CC=C(C=C1)O Z45652935 [0,1,0,0,0,0|3,0,0]=4 280 B12R1.106 FC(F)(F)CC1=CC=C(C=C1)Br Z1269118370 [0,1,0,0,0,0|3,0,0]=4 281 B12R1.106 NC1=CC=C(C=C1)CC(F)(F)F Z1198165325 [0,1,0,0,0,0|3,0,0]=4 282 B12R1.106 NC1=CC=C(C=C1)CS(=O)(=O)N Z235340045 [0,1,0,0,0,0|3,0,0]=4 283 B12R1.106 NS(=O)(=O)CC1=CC=C(C=C1)Br Z274591724 [0,1,0,0,0,0|3,0,0]=4 284 B12R1.106 NS(=O)(=O)CC1=CC=C(C=C1)Cl Z274587950 [0,1,0,0,0,0|3,0,0]=4 285 B12R1.106 NS(=O)(=O)CC1=CC=C(C=C1)F Z241725866 [0,1,0,0,0,0|3,0,0]=4 286 B12R1.106 NS(=O)(=O)NC1=CC=C(C=C1)O Z335810542 [0,1,0,0,0,0|3,0,0]=4 287 B12R1.106 OC1=CC=C(C=C1)CC(F)(F)F Z1198278054 [0,1,0,0,0,0|2,0,0]=3 288 B12R1.106 OC1=CC=C(C=C1)SC(F)(F)F Z276151196 [0,1,0,0,0,0|3,0,0]=4 289 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Br)F Z992965764 [0,1,0,0,0,0|2,0,1]=4 290 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Cl)F Z1198331241 [0,1,0,0,0,0|2,0,1]=4 291 B12R1.233 CC(=O)CC1=C(C=C(C=C1)F)Br Z992965738 [0,1,0,0,0,0|2,0,1]=4 292 B12R1.233 CC(C)CC1=C(C=C(C=C1)O)O Z1513805538 [0,1,0,0,0,0|1,0,0]=2 293 B12R1.233 CC(C)NC1=C(C=C(C=C1)Cl)N Z359511184 [0,1,0,0,0,0|3,0,0]=4 294 B12R1.233 CC(C)NC1=C(C=C(C=C1)F)Cl Z267287236 [0,1,0,0,0,0|3,0,0]=4 295 B12R1.233 CC(C)NC1=C(C=C(C=C1)F)I Z4034733287 [0,1,0,0,0,0|3,0,0]=4 296 B12R1.233 CC(C)OC1=C(C=C(C=C1)Br)N Z330805102 [0,1,0,0,0,0|3,0,0]=4 297 B12R1.233 CC(C)OC1=C(C=C(C=C1)Cl)N Z274542066 [0,1,0,0,0,0|3,0,0]=4 298 B12R1.233 CC(C)OC1=C(C=C(C=C1)F)N Z332376424 [0,1,0,0,0,0|3,0,0]=4 299 B12R1.233 CC(C)OC1=C(C=C(C=C1)N)Cl Z239873346 [0,1,0,0,0,0|3,0,0]=4 300 B12R1.233 CC(C)SC1=C(C=C(C=C1)Cl)N Z319450618 [0,1,0,0,0,0|3,0,0]=4 301 B12R1.233 CC(N)CC1=C(C=C(C=C1)Br)F Z405046456 [0,1,0,0,0,0|1,0,0]=2 302 B12R1.233 CC(N)CC1=C(C=C(C=C1)Cl)Cl Z285143988 [0,1,0,0,0,0|1,0,0]=2 303 B12R1.233 CC(N)CC1=C(C=C(C=C1)F)F Z5002837134 [0,1,0,0,0,0|1,0,0]=2 304 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)N Z1617965385 [0,1,0,0,0,0|2,0,1]=4 305 B12R1.233 CC1=C(C=CC(=C1)N)OC(C)C Z385462788 [0,1,0,0,0,0|3,0,0]=4 306 B12R1.233 CC1=CC(=C(C=C1)CC(C)N)C Z285143886 [0,1,0,0,0,0|1,0,0]=2 307 B12R1.233 CC1=CC(=C(C=C1)NC(C)C)C Z1259341051 [0,1,0,0,0,0|3,0,0]=4 308 B12R1.233 CN(C)CC1=C(C=C(C=C1)N)Br Z489537698 [0,1,0,0,0,0|3,0,0]=4 309 B12R1.233 CN(C)CC1=C(C=C(C=C1)N)Cl Z905073032 [0,1,0,0,0,0|3,0,0]=4 310 B12R1.233 CN(C)CC1=C(C=C(C=C1)N)F Z1250077979 [0,1,0,0,0,0|3,0,0]=4 311 B12R1.233 N=C(N)CC1=C(C=C(C=C1)F)F Z1642389901 [0,1,0,0,0,0|2,0,1]=4 312 B12R1.233 NC(=O)CC1=C(C=C(C=C1)Br)Cl Z2692246846 [0,1,0,0,0,0|2,0,1]=4 313 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)Cl Z1198307592 [0,1,0,0,0,0|2,0,1]=4 314 B12R2.79 CC1=CC=C(C=C1)[C@@H]2C[C@H]2N Z2380468351 [0,0,0,1,0,0|1,0,0]=2 315 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)Cl Z3074487523 [0,0,0,1,0,0|2,0,0]=3 316 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)F Z2527567177 [0,0,0,1,0,0|2,0,0]=3 317 B12R2.79 NC1CC1C2=CC=C(C=C2)F Z1266823169 [0,0,0,1,0,0|1,0,0]=2 318 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Br Z2298098036 [0,0,0,1,0,0|1,0,0]=2 319 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl Z2298098012 [0,0,0,1,0,0|1,0,0]=2 320 B12R2.294 BrC1=CC=C(C=C1)CC2CO2 Z2523466484 [0,0,0,1,0,0|2,0,0]=3 321 B12R2.294 FC1=CC=C(C=C1)CC2CO2 Z1495386285 [0,0,0,1,0,0|2,0,0]=3 322 B12R2.294 OC1=CC=C(C=C1)OC2CC2 Z1255401633 [0,0,0,1,0,0|2,0,0]=3 323 B12R2.606 CC1=CC2=C(N1)C=C(C=C2)Br Z1269196919 [0,0,0,1,0,0|1,0,2]=4 324 B12R2.606 CC1=CC2=C(N1)C=C(C=C2)F Z1201624894 [0,0,0,1,0,0|1,0,2]=4 325 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)O Z1198147837 [0,0,0,1,0,0|2,0,1]=4 326 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)O Z1255462447 [0,0,0,1,0,0|1,0,2]=4 327 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)O Z1201620245 [0,0,0,1,0,0|2,0,1]=4 328 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)O Z1203159861 [0,0,0,1,0,0|1,0,2]=4 329 B12R2.606 CC1CC2=C(N1)C=CC(=C2)Br Z5212090742 [0,0,0,1,0,0|3,0,0]=4 330 B12R2.606 CC1CC2=C(O1)C=CC(=C2)Br Z409451514 [0,0,0,1,0,0|3,0,0]=4 331 B12R2.606 CC1CC2=C(O1)C=CC(=C2)N Z2888802910 [0,0,0,1,0,0|3,0,0]=4 332 B12R2.606 CC1CC2=C(O1)C=CC(=C2)O Z1513815985 [0,0,0,1,0,0|2,0,0]=3 333 B12R2.606 CN1C=C2C=C(C=CC2=N1)O Z1198343475 [0,0,0,1,0,0|3,0,0]=4 334 B12R2.606 CN1CC2=C(C1)C=C(C=C2)N Z406357890 [0,0,0,1,0,0|3,0,0]=4 335 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 Z2805701617 [0,0,0,1,0,0|2,0,1]=4 336 B12R2.606 NC1=CC2=C(C=C1)CC(C2)O Z1203581059 [0,0,0,1,0,0|2,0,0]=3 337 B12R2.606 NC1=NC2=C(S1)C=CC(=C2)O Z1198155943 [0,0,0,1,0,0|2,0,1]=4 338 B12R2.606 NC1CC2=C(C1)C=C(C=C2)Br Z1741978324 [0,0,0,1,0,0|1,0,0]=2 339 B12R2.606 NC1CC2=C(C1)N=CC(=C2)Br Z3466011318 [0,0,0,1,0,0|2,0,0]=3 340 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Cl Z56922083 [0,0,0,1,0,0|2,0,1]=4 341 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [0,0,0,1,0,0|2,0,1]=4 342 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)O Z1198314975 [0,0,0,1,0,0|2,0,1]=4 343 B12R2.606 OC1=CC2=C(C=C1)CC(C2)O Z1198729229 [0,0,0,1,0,0|1,0,0]=2 344 B12R2.606 OC1CC2=C(C1)C=C(C=C2)Cl Z1489210921 [0,0,0,1,0,0|2,0,0]=3 345 B12R2.606 OC1CC2=C(C1)C=C(C=C2)F Z1862026143 [0,0,0,1,0,0|2,0,0]=3 346 B10R1.13 CC(=O)C1=CC=C(C=C1)Br Z57127459 [0,0,0,0,1,0|2,0,1]=4 347 B10R1.13 CC(=O)C1=CC=C(C=C1)C Z57127458 [0,0,0,0,1,0|2,0,1]=4 348 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl Z57127462 [0,0,0,0,1,0|2,0,1]=4 349 B10R1.13 CC(=O)C1=CC=C(C=C1)F Z57127466 [0,0,0,0,1,0|2,0,1]=4 350 B10R1.13 CC(=O)C1=CC=C(C=C1)I Z57073725 [0,0,0,0,1,0|2,0,1]=4 351 B10R1.13 CC(=O)C1=CC=C(C=C1)N Z57127377 [0,0,0,0,1,0|2,0,1]=4 352 B10R1.13 CC(=O)C1=CC=C(C=C1)O Z57040434 [0,0,0,0,1,0|1,0,1]=3 353 B10R1.13 CC(C)C1=CC=C(C=C1)Br Z732229746 [0,0,0,0,1,0|2,0,0]=3 354 B10R1.13 CC(C)C1=CC=C(C=C1)Cl Z1255372793 [0,0,0,0,1,0|2,0,0]=3 355 B10R1.13 CC(C)C1=CC=C(C=C1)N Z104476320 [0,0,0,0,1,0|2,0,0]=3 356 B10R1.13 CC(C)C1=CC=C(C=C1)O Z56347200 [0,0,0,0,1,0|1,0,0]=2 357 B10R1.13 CC(N)C1=CC=C(C=C1)Br Z56347162 [0,0,0,0,1,0|1,0,0]=2 358 B10R1.13 CC(N)C1=CC=C(C=C1)Cl Z56347112 [0,0,0,0,1,0|1,0,0]=2 359 B10R1.13 CC(N)C1=CC=C(C=C1)O Z1741968989 [0,0,0,0,1,0|0,0,0]=1 360 B10R1.13 CC(N)C1=CN=C(C=C1)O Z4423361180 [0,0,0,0,1,0|1,0,0]=2 361 B10R1.13 CC(N)C1=NC=C(C=N1)Br Z3297614825 [0,0,0,0,1,0|3,0,0]=4 362 B10R1.13 CC(N)C1=NC=C(N=C1)Cl Z4188952637 [0,0,0,0,1,0|3,0,0]=4 363 B10R1.13 CC(O)C1=CC=C(C=C1)Br Z335244904 [0,0,0,0,1,0|2,0,0]=3 364 B10R1.13 CC(O)C1=CC=C(C=C1)Cl Z104479788 [0,0,0,0,1,0|2,0,0]=3 365 B10R1.13 CC(O)C1=CC=C(C=C1)F Z56347219 [0,0,0,0,1,0|2,0,0]=3 366 B10R1.13 CC(O)C1=CC=C(C=C1)I Z228586282 [0,0,0,0,1,0|2,0,0]=3 367 B10R1.13 CC(O)C1=NC=C(C=C1)F Z1255406174 [0,0,0,0,1,0|3,0,0]=4 368 B10R1.13 CC1=CC=C(C=C1)C(=N)N Z1405445841 [0,0,0,0,1,0|2,0,1]=4 369 B10R1.13 CC1=CC=C(C=C1)C(=S)N Z56939152 [0,0,0,0,1,0|2,0,1]=4 370 B10R1.13 CC1=CC=C(C=C1)C(C)C Z104497772 [0,0,0,0,1,0|2,0,0]=3 371 B10R1.13 CC1=CC=C(C=C1)[C@@H](C)O Z1127664396 [0,0,0,0,1,0|2,0,0]=3 372 B10R1.13 CC1=CC=C(C=C1)[C@H](C)O Z1127664278 [0,0,0,0,1,0|2,0,0]=3 373 B10R1.13 CN(C)C1=CC=C(C=C1)O Z137981254 [0,0,0,0,1,0|2,0,0]=3 374 B10R1.13 CS(=O)C1=CC=C(C=C1)N Z609944508 [0,0,0,0,1,0|3,0,0]=4 375 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)Br Z850973968 [0,0,0,0,1,0|2,0,0]=3 376 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)I Z360055808 [0,0,0,0,1,0|2,0,0]=3 377 B10R1.13 C[C@H](N)C1=CC=C(C=C1)Br Z1869802525 [0,0,0,0,1,0|1,0,0]=2 378 B10R1.13 C[C@H](N)C1=CC=C(C=C1)I Z1696091699 [0,0,0,0,1,0|1,0,0]=2 379 B10R1.13 C[C@H](N)C1=CC=C(C=C1)O Z3183546879 [0,0,0,0,1,0|0,0,0]=1 380 B10R1.13 C[C@H](N)C1=NC=C(C=C1)Cl Z1753033020 [0,0,0,0,1,0|2,0,0]=3 381 B10R1.13 C[C@H](O)C1=CC=C(C=C1)Br Z850973970 [0,0,0,0,1,0|2,0,0]=3 382 B10R1.13 C[C@H](O)C1=CC=C(C=C1)I Z360055806 [0,0,0,0,1,0|2,0,0]=3 383 B10R1.13 N=C(N)C1=CC=C(C=C1)Br Z1263602346 [0,0,0,0,1,0|2,0,1]=4 384 B10R1.13 N=C(N)C1=CC=C(C=C1)Cl Z56771179 [0,0,0,0,1,0|2,0,1]=4 385 B10R1.13 N=C(N)C1=CC=C(C=C1)F Z2289798423 [0,0,0,0,1,0|2,0,1]=4 386 B10R1.13 N=C(N)C1=CC=C(C=C1)I Z2574914411 [0,0,0,0,1,0|2,0,1]=4 387 B10R1.13 N=C(N)C1=CC=C(C=C1)O Z1262398570 [0,0,0,0,1,0|1,0,1]=3 388 B10R1.13 NC(=O)C1=CC=C(C=C1)Br Z33546526 [0,0,0,0,1,0|2,0,1]=4 389 B10R1.13 NC(=O)C1=CC=C(C=C1)F Z33546459 [0,0,0,0,1,0|2,0,1]=4 390 B10R1.13 NC(=O)C1=CC=C(C=C1)I Z33546486 [0,0,0,0,1,0|2,0,1]=4 391 B10R1.13 NC(=O)C1=CC=C(C=C1)N Z104474782 [0,0,0,0,1,0|2,0,1]=4 392 B10R1.13 NC(=O)C1=CC=C(C=C1)O Z104502228 [0,0,0,0,1,0|1,0,1]=3 393 B10R1.13 NC(=S)C1=CC=C(C=C1)Br Z56964597 [0,0,0,0,1,0|2,0,1]=4 394 B10R1.13 NC(=S)C1=CC=C(C=C1)Cl Z57070431 [0,0,0,0,1,0|2,0,1]=4 395 B10R1.13 NC(=S)C1=CC=C(C=C1)N Z234895465 [0,0,0,0,1,0|2,0,1]=4 396 B10R1.13 NC(=S)C1=CC=C(C=C1)O Z90124534 [0,0,0,0,1,0|1,0,1]=3 397 B10R1.13 NC1=CC=C(C=C1)C(F)F Z2900188029 [0,0,0,0,1,0|3,0,0]=4 398 B10R1.13 O=C(O)C1=CC=C(C=C1)O Z104498098 [0,0,0,0,1,0|2,0,1]=4 399 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)O Z57127483 [0,0,0,0,1,0|3,0,0]=4 400 B10R1.13 OB(O)C1=CC=C(C=C1)O Z336080006 [0,0,0,0,1,0|3,0,0]=4 401 B10R1.13 OC1=NC=C(C=C1)C(F)F Z1726130896 [0,0,0,0,1,0|3,0,0]=4 402 B10R1.54 CC1=CC=C(S1)CC(C)N Z381678020 [0,0,0,0,1,0|2,0,0]=3 403 B10R1.54 CC1=NNC(=C1)CC(C)N Z1446874472 [0,0,0,0,1,0|3,0,0]=4 404 B12R1.21 CC(=O)CCC1=CC=C(C=C1)C Z406376788 [0,0,0,0,0,1|2,0,1]=4 405 B12R1.21 CC(=O)CCC1=CC=C(C=C1)F Z406376784 [0,0,0,0,0,1|2,0,1]=4 406 B12R1.21 CC(=O)CCC1=CC=C(C=C1)I Z1263632422 [0,0,0,0,0,1|2,0,1]=4 407 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Br Z816034502 [0,0,0,0,0,1|2,0,1]=4 408 B12R1.21 CC(=O)NCC1=CC=C(C=C1)N Z600391558 [0,0,0,0,0,1|2,0,1]=4 409 B12R1.21 CC(C)CCC1=CC=C(C=C1)N Z424736042 [0,0,0,0,0,1|2,0,0]=3 410 B12R1.21 CC(C)CNC1=CC=C(C=C1)Cl Z1695729058 [0,0,0,0,0,1|2,0,0]=3 411 B12R1.21 CC(C)CNC1=NC=C(C=C1)F Z802823880 [0,0,0,0,0,1|3,0,0]=4 412 B12R1.21 CC(C)COC1=CC=C(C=C1)O Z381414742 [0,0,0,0,0,1|1,0,0]=2 413 B12R1.21 CC(C)COC1=NC=C(C=C1)N Z285175576 [0,0,0,0,0,1|3,0,0]=4 414 B12R1.21 CC(C)NCC1=CC=C(C=C1)Br Z86129856 [0,0,0,0,0,1|2,0,0]=3 415 B12R1.21 CC(C)NCC1=CC=C(C=C1)F Z86129862 [0,0,0,0,0,1|2,0,0]=3 416 B12R1.21 CC(C)OCC1=CC=C(C=C1)Br Z823855528 [0,0,0,0,0,1|2,0,0]=3 417 B12R1.21 CC(C)OCC1=CC=C(C=C1)N Z285178068 [0,0,0,0,0,1|2,0,0]=3 418 B12R1.21 CC(C)SCC1=CC=C(C=C1)Br Z54548572 [0,0,0,0,0,1|2,0,0]=3 419 B12R1.21 CC(N)CCC1=CC=C(C=C1)Br Z235361851 [0,0,0,0,0,1|1,0,0]=2 420 B12R1.21 CC(N)CCC1=CC=C(C=C1)I Z1947443961 [0,0,0,0,0,1|1,0,0]=2 421 B12R1.21 CC(N)CCC1=CC=C(C=C1)O Z220327456 [0,0,0,0,0,1|0,0,0]=1 422 B12R1.21 CC(N)COC1=CC=C(C=C1)F Z271017038 [0,0,0,0,0,1|1,0,0]=2 423 B12R1.21 CC(O)CCC1=CC=C(C=C1)O Z57921369 [0,0,0,0,0,1|1,0,0]=2 424 B12R1.21 CC1=CC=C(C=C1)CCC(=O)N Z194976512 [0,0,0,0,0,1|2,0,1]=4 425 B12R1.21 CC1=CC=C(C=C1)CNC(=N)N Z911465430 [0,0,0,0,0,1|2,0,1]=4 426 B12R1.21 CC1=CC=C(C=C1)CNC(=O)N Z198194838 [0,0,0,0,0,1|2,0,1]=4 427 B12R1.21 CC1=CC=C(C=C1)CNC(=S)N Z56915894 [0,0,0,0,0,1|2,0,1]=4 428 B12R1.21 CC1=CC=C(C=C1)NCC(C)C Z334955606 [0,0,0,0,0,1|2,0,0]=3 429 B12R1.21 CC1=CC=C(C=C1)OCC(=O)N Z19732046 [0,0,0,0,0,1|2,0,1]=4 430 B12R1.21 CC1=CC=C(C=C1)OCC(=S)N Z295396970 [0,0,0,0,0,1|2,0,1]=4 431 B12R1.21 CC1=CC=C(C=C1)OCC(C)N Z285166960 [0,0,0,0,0,1|1,0,0]=2 432 B12R1.21 CC1=CC=C(C=C1)SCC(=O)N Z18770000 [0,0,0,0,0,1|2,0,1]=4 433 B12R1.21 CC1=CC=C(C=C1)SCC(C)N Z1238717325 [0,0,0,0,0,1|1,0,0]=2 434 B12R1.21 CN(C)CCC1=CC=C(C=C1)Br Z2335774813 [0,0,0,0,0,1|3,0,0]=4 435 B12R1.21 CN(C)CCC1=CC=C(C=C1)N Z335289246 [0,0,0,0,0,1|3,0,0]=4 436 B12R1.21 C[C@@H](O)CNC1=NC=C(C=C1)Br Z1564028158 [0,0,0,0,0,1|3,0,0]=4 437 B12R1.21 C[C@H](O)CNC1=NC=C(C=C1)Br Z1564015843 [0,0,0,0,0,1|3,0,0]=4 438 B12R1.21 FC1=CC=C(C=C1)NCC(F)F Z608352362 [0,0,0,0,0,1|3,0,0]=4 439 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Br Z48820389 [0,0,0,0,0,1|2,0,1]=4 440 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Cl Z48820386 [0,0,0,0,0,1|2,0,1]=4 441 B12R1.21 NC(=O)CCC1=CC=C(C=C1)F Z87614992 [0,0,0,0,0,1|2,0,1]=4 442 B12R1.21 NC(=O)CCC1=CC=C(C=C1)N Z414316852 [0,0,0,0,0,1|2,0,1]=4 443 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Br Z104586672 [0,0,0,0,0,1|2,0,1]=4 444 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Cl Z104647358 [0,0,0,0,0,1|2,0,1]=4 445 B12R1.21 NC(=O)CNC1=CC=C(C=C1)I Z104728120 [0,0,0,0,0,1|2,0,1]=4 446 B12R1.21 NC(=O)COC1=CC=C(C=C1)Br Z19725712 [0,0,0,0,0,1|2,0,1]=4 447 B12R1.21 NC(=O)COC1=CC=C(C=C1)F Z19734788 [0,0,0,0,0,1|2,0,1]=4 448 B12R1.21 NC(=O)COC1=CC=C(C=C1)I Z25086979 [0,0,0,0,0,1|2,0,1]=4 449 B12R1.21 NC(=O)COC1=CC=C(C=C1)N Z239127428 [0,0,0,0,0,1|2,0,1]=4 450 B12R1.21 NC(=O)COC1=CC=C(C=C1)O Z381414726 [0,0,0,0,0,1|1,0,1]=3 451 B12R1.21 NC(=O)CSC1=CC=C(C=C1)Br Z18744574 [0,0,0,0,0,1|2,0,1]=4 452 B12R1.21 NC(=O)CSC1=CC=C(C=C1)F Z16034821 [0,0,0,0,0,1|2,0,1]=4 453 B12R1.21 NC(=O)NCC1=CC=C(C=C1)F Z198194834 [0,0,0,0,0,1|2,0,1]=4 454 B12R1.21 NC(=O)NCC1=CC=C(C=C1)N Z600391988 [0,0,0,0,0,1|2,0,1]=4 455 B12R1.21 NC(=S)COC1=CC=C(C=C1)Cl Z295395122 [0,0,0,0,0,1|2,0,1]=4 456 B12R1.21 NC(=S)NCC1=CC=C(C=C1)F Z111411726 [0,0,0,0,0,1|2,0,1]=4 457 B12R1.21 NC1=CC=C(C=C1)OCC(F)F Z608351552 [0,0,0,0,0,1|3,0,0]=4 458 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O Z317038012 [0,0,0,0,0,1|2,0,1]=4 459 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O Z57127481 [0,0,0,0,0,1|2,0,1]=4 460 B12R1.21 O=C(O)COC1=CC=C(C=C1)O Z1192367471 [0,0,0,0,0,1|2,0,1]=4 461 B12R1.21 O=C(O)CSC1=CC=C(C=C1)O Z733878444 [0,0,0,0,0,1|2,0,1]=4 462 B9R1.1 CC1=CC=C(C=C1)NN Z56911942 [2,0,0,0,0,0|2,0,0]=4 463 B9R1.1 CC1=NC=C(C=C1)CN Z444349734 [2,0,0,0,0,0|2,0,0]=4 464 B9R1.1 CCC1=CC=C(C=C1)I Z381540768 [2,0,0,0,0,0|1,0,0]=3 465 B9R1.1 CCC1=CC=C(C=C1)N Z104477836 [2,0,0,0,0,0|1,0,0]=3 466 B9R1.1 CCC1=CC=C(C=C1)O Z104479728 [2,0,0,0,0,0|0,0,0]=2 467 B9R1.1 CCC1=CN=C(C=C1)N Z1198224278 [2,0,0,0,0,0|2,0,0]=4 468 B9R1.1 CNC1=CC=C(C=C1)I Z744582716 [2,0,0,0,0,0|2,0,0]=4 469 B9R1.1 CNC1=CC=C(C=C1)O Z940713298 [2,0,0,0,0,0|1,0,0]=3 470 B9R1.1 COC1=CC=C(C=C1)C Z53834227 [2,0,0,0,0,0|2,0,0]=4 471 B9R1.1 COC1=CC=C(C=C1)F Z53834743 [2,0,0,0,0,0|2,0,0]=4 472 B9R1.1 COC1=CC=C(C=C1)N Z56938150 [2,0,0,0,0,0|2,0,0]=4 473 B9R1.1 COC1=CC=C(C=C1)O Z104474598 [2,0,0,0,0,0|1,0,0]=3 474 B9R1.1 COC1=NC=C(C=C1)O Z1201623942 [2,0,0,0,0,0|2,0,0]=4 475 B9R1.1 CSC1=CC=C(C=C1)N Z104511114 [2,0,0,0,0,0|2,0,0]=4 476 B9R1.1 FC1=CC=C(C=C1)CBr Z89269613 [2,0,0,0,0,0|2,0,0]=4 477 B9R1.1 N#CC1=CC=C(C=C1)O Z104473840 [2,0,0,0,0,0|0,0,2]=4 478 B9R1.1 NCC1=CC=C(C=C1)F Z54748266 [2,0,0,0,0,0|1,0,0]=3 479 B9R1.1 NCC1=CC=C(C=C1)O Z235348101 [2,0,0,0,0,0|0,0,0]=2 480 B9R1.1 NCC1=CN=C(C=C1)Cl Z247612574 [2,0,0,0,0,0|2,0,0]=4 481 B9R1.1 NCC1=CN=C(C=C1)F Z1198311144 [2,0,0,0,0,0|2,0,0]=4 482 B9R1.1 NCC1=CN=C(C=C1)O Z1269638445 [2,0,0,0,0,0|1,0,0]=3 483 B9R1.1 NCC1=NC=C(C=C1)Br Z3241254216 [2,0,0,0,0,0|2,0,0]=4 484 B9R1.1 NCC1=NC=C(C=C1)Cl Z636367336 [2,0,0,0,0,0|2,0,0]=4 485 B9R1.1 NCC1=NC=C(C=C1)F Z1198277779 [2,0,0,0,0,0|2,0,0]=4 486 B9R1.1 NCC1=NC=C(C=C1)N Z3244746175 [2,0,0,0,0,0|2,0,0]=4 487 B9R1.1 NCC1=NC=C(C=C1)O Z3324887230 [2,0,0,0,0,0|1,0,0]=3 488 B9R1.1 NNC1=CC=C(C=C1)Cl Z56776889 [2,0,0,0,0,0|2,0,0]=4 489 B9R1.1 O=CC1=CC=C(C=C1)O Z57127520 [2,0,0,0,0,0|1,0,1]=4 490 B9R1.1 OCC1=CC=C(C=C1)Br Z335244742 [2,0,0,0,0,0|2,0,0]=4 491 B9R1.1 OCC1=CC=C(C=C1)Cl Z104478032 [2,0,0,0,0,0|2,0,0]=4 492 B9R1.1 OCC1=CC=C(C=C1)F Z104477460 [2,0,0,0,0,0|2,0,0]=4 493 B9R1.1 OCC1=CC=C(C=C1)I Z385370342 [2,0,0,0,0,0|2,0,0]=4 494 B9R1.1 OCC1=NC=C(C=C1)O Z1217915045 [2,0,0,0,0,0|2,0,0]=4 495 B9R1.1 SCC1=CC=C(C=C1)Cl Z55948216 [2,0,0,0,0,0|2,0,0]=4 496 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [2,0,0,0,0,0|0,0,0]=2 497 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [2,0,0,0,0,0|1,0,0]=3 498 B9R1.8 CCCC1=NN=CC=C1 Z1486025396 [2,0,0,0,0,0|2,0,0]=4 499 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [2,0,0,0,0,0|1,0,0]=3 500 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [2,0,0,0,0,0|2,0,0]=4 501 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [2,0,0,0,0,0|2,0,0]=4 502 B9R1.8 CCSC1=CC=NC=C1 Z1376454759 [2,0,0,0,0,0|2,0,0]=4 503 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [2,0,0,0,0,0|2,0,0]=4 504 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [2,0,0,0,0,0|2,0,0]=4 505 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [2,0,0,0,0,0|2,0,0]=4 506 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [2,0,0,0,0,0|1,0,0]=3 507 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [2,0,0,0,0,0|1,0,0]=3 508 B9R1.8 NCCC1=CN=NC=C1 Z3070743015 [2,0,0,0,0,0|2,0,0]=4 509 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [2,0,0,0,0,0|1,0,0]=3 510 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [2,0,0,0,0,0|2,0,0]=4 511 B9R1.8 NCCC1=NC=NC=C1 Z2935002210 [2,0,0,0,0,0|2,0,0]=4 512 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [2,0,0,0,0,0|1,0,0]=3 513 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [2,0,0,0,0,0|2,0,0]=4 514 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [2,0,0,0,0,0|1,0,0]=3 515 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [2,0,0,0,0,0|1,0,1]=4 516 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [2,0,0,0,0,0|1,0,0]=3 517 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [2,0,0,0,0,0|2,0,0]=4 518 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [2,0,0,0,0,0|2,0,0]=4 519 B11R1.1 BrCCOC1=CC=C(C=C1)Br Z56887702 [1,1,0,0,0,0|2,0,0]=4 520 B11R1.1 C=CCOC1=CC=C(C=C1)O Z381414818 [1,1,0,0,0,0|0,0,2]=4 521 B11R1.1 CC1=CC=C(C=C1)CCCN Z4639316723 [1,1,0,0,0,0|1,0,0]=3 522 B11R1.1 CC1=CC=C(C=C1)OCCBr Z56886357 [1,1,0,0,0,0|2,0,0]=4 523 B11R1.1 CC1=CC=C(C=C1)OCCN Z54747869 [1,1,0,0,0,0|1,0,0]=3 524 B11R1.1 CC1=CC=C(C=C1)SCCCl Z90122598 [1,1,0,0,0,0|2,0,0]=4 525 B11R1.1 CC1=CC=C(C=C1)SCCO Z149178580 [1,1,0,0,0,0|2,0,0]=4 526 B11R1.1 CC1=CN=C(C=C1)NCCN Z1695797833 [1,1,0,0,0,0|2,0,0]=4 527 B11R1.1 CCCCC1=CC=C(C=C1)N Z104475500 [1,1,0,0,0,0|1,0,0]=3 528 B11R1.1 CCCNC1=CC=C(C=C1)Cl Z1266933829 [1,1,0,0,0,0|1,0,0]=3 529 B11R1.1 CCCOC1=CC=C(C=C1)N Z239604724 [1,1,0,0,0,0|1,0,0]=3 530 B11R1.1 CCNCC1=CC=C(C=C1)F Z3244655509 [1,1,0,0,0,0|1,0,0]=3 531 B11R1.1 CCOCC1=CC=C(C=C1)Br Z823854370 [1,1,0,0,0,0|1,0,0]=3 532 B11R1.1 CCOCC1=CC=C(C=C1)N Z240084570 [1,1,0,0,0,0|1,0,0]=3 533 B11R1.1 CCSCC1=CC=C(C=C1)N Z332378208 [1,1,0,0,0,0|1,0,0]=3 534 B11R1.1 CNCCC1=CC=C(C=C1)Br Z385447024 [1,1,0,0,0,0|1,0,0]=3 535 B11R1.1 CNCCC1=CC=C(C=C1)C Z5115849578 [1,1,0,0,0,0|1,0,0]=3 536 B11R1.1 CNCCC1=CC=C(C=C1)Cl Z1623872266 [1,1,0,0,0,0|1,0,0]=3 537 B11R1.1 CNCCC1=CC=C(C=C1)F Z138454998 [1,1,0,0,0,0|1,0,0]=3 538 B11R1.1 COCCC1=CC=C(C=C1)Br Z299596190 [1,1,0,0,0,0|1,0,0]=3 539 B11R1.1 COCCC1=CC=C(C=C1)Cl Z1470894103 [1,1,0,0,0,0|1,0,0]=3 540 B11R1.1 COCCC1=CC=C(C=C1)O Z104485614 [1,1,0,0,0,0|0,0,0]=2 541 B11R1.1 COCOC1=CC=C(C=C1)N Z1259226853 [1,1,0,0,0,0|2,0,0]=4 542 B11R1.1 CSCCC1=CC=C(C=C1)N Z732207426 [1,1,0,0,0,0|1,0,0]=3 543 B11R1.1 ClC1=CC=C(C=C1)OCCBr Z56926557 [1,1,0,0,0,0|2,0,0]=4 544 B11R1.1 ClCCSC1=CC=C(C=C1)Cl Z55993025 [1,1,0,0,0,0|2,0,0]=4 545 B11R1.1 FCCOC1=CC=C(C=C1)Br Z1269166672 [1,1,0,0,0,0|2,0,0]=4 546 B11R1.1 N#CCCC1=CC=C(C=C1)N Z4750298565 [1,1,0,0,0,0|1,0,1]=4 547 B11R1.1 NC/C=C/C1=CC=C(C=C1)Br Z2235681463 [1,1,0,0,0,0|1,0,1]=4 548 B11R1.1 NC1=CC=C(C=C1)OCCF Z1262631146 [1,1,0,0,0,0|2,0,0]=4 549 B11R1.1 NC1=CC=C(C=C1)OCCO Z332379386 [1,1,0,0,0,0|2,0,0]=4 550 B11R1.1 NCC#CC1=CC=C(C=C1)I Z4775597113 [1,1,0,0,0,0|1,0,1]=4 551 B11R1.1 NCCCC1=CC=C(C=C1)Br Z3980240042 [1,1,0,0,0,0|1,0,0]=3 552 B11R1.1 NCCCC1=CC=C(C=C1)Cl Z992716848 [1,1,0,0,0,0|1,0,0]=3 553 B11R1.1 NCCCC1=CC=C(C=C1)F Z3244753845 [1,1,0,0,0,0|1,0,0]=3 554 B11R1.1 NCCCC1=CC=C(C=C1)N Z5453008768 [1,1,0,0,0,0|1,0,0]=3 555 B11R1.1 NCCCC1=CC=C(C=C1)O Z1270210797 [1,1,0,0,0,0|0,0,0]=2 556 B11R1.1 NCCNC1=CC=C(C=C1)O Z3386315806 [1,1,0,0,0,0|0,0,0]=2 557 B11R1.1 NCCOC1=CC=C(C=C1)Br Z1262237188 [1,1,0,0,0,0|1,0,0]=3 558 B11R1.1 NCCOC1=CC=C(C=C1)Cl Z85957193 [1,1,0,0,0,0|1,0,0]=3 559 B11R1.1 NCCOC1=CC=C(C=C1)F Z87000937 [1,1,0,0,0,0|1,0,0]=3 560 B11R1.1 NCCOC1=CC=C(C=C1)I Z381428104 [1,1,0,0,0,0|1,0,0]=3 561 B11R1.1 NCCOC1=NC=C(C=C1)Cl Z1421528823 [1,1,0,0,0,0|2,0,0]=4 562 B11R1.1 NCCSC1=CC=C(C=C1)Br Z262221984 [1,1,0,0,0,0|1,0,0]=3 563 B11R1.1 NCCSC1=CC=C(C=C1)Cl Z54751093 [1,1,0,0,0,0|1,0,0]=3 564 B11R1.1 NCCSC1=CC=C(C=C1)F Z1267773811 [1,1,0,0,0,0|1,0,0]=3 565 B11R1.1 O=CCCC1=CC=C(C=C1)Br Z993017756 [1,1,0,0,0,0|1,0,1]=4 566 B11R1.1 O=CCCC1=CC=C(C=C1)Cl Z993017742 [1,1,0,0,0,0|1,0,1]=4 567 B11R1.1 O=CCCC1=CC=C(C=C1)F Z993017748 [1,1,0,0,0,0|1,0,1]=4 568 B11R1.1 OC/C=C/C1=CC=C(C=C1)O Z2235811101 [1,1,0,0,0,0|0,0,2]=4 569 B11R1.1 OCCCC1=CC=C(C=C1)F Z992949550 [1,1,0,0,0,0|1,0,0]=3 570 B11R1.1 OCCNC1=CC=C(C=C1)Br Z335275406 [1,1,0,0,0,0|2,0,0]=4 571 B11R1.1 OCCOC1=CC=C(C=C1)Br Z335092354 [1,1,0,0,0,0|2,0,0]=4 572 B11R1.1 OCCOC1=CC=C(C=C1)O Z381414946 [1,1,0,0,0,0|1,0,0]=3 573 B11R1.1 OCCSC1=CC=C(C=C1)Br Z149190682 [1,1,0,0,0,0|2,0,0]=4 574 B11R1.1 OCCSC1=CC=C(C=C1)Cl Z149162370 [1,1,0,0,0,0|2,0,0]=4 575 B11R1.22 CC(CN)C1=CC=C(C=C1)Br Z2906280360 [1,1,0,0,0,0|1,0,0]=3 576 B11R1.22 CC(CN)C1=CC=C(C=C1)F Z415654954 [1,1,0,0,0,0|1,0,0]=3 577 B11R1.22 CC(CO)C1=CC=C(C=C1)F Z1255440783 [1,1,0,0,0,0|2,0,0]=4 578 B11R1.22 CC1=CC=C(C=C1)C(=O)CN Z275368898 [1,1,0,0,0,0|1,0,1]=4 579 B11R1.22 CC1=CC=C(C=C1)C(C)CN Z415654970 [1,1,0,0,0,0|1,0,0]=3 580 B11R1.22 CC1=CC=C(C=C1)C(N)CF Z2474474695 [1,1,0,0,0,0|2,0,0]=4 581 B11R1.22 CC1=CC=C(C=C1)C(N)CO Z5087131901 [1,1,0,0,0,0|2,0,0]=4 582 B11R1.22 CC1=CC=C(C=C1)C(O)CN Z336086536 [1,1,0,0,0,0|1,0,0]=3 583 B11R1.22 CC1=CC=C(C=C1)[C@@H](O)CN Z1895741843 [1,1,0,0,0,0|1,0,0]=3 584 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br Z104485724 [1,1,0,0,0,0|1,0,1]=4 585 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl Z104477486 [1,1,0,0,0,0|1,0,1]=4 586 B11R1.22 CCC(=O)C1=CC=C(C=C1)F Z104477898 [1,1,0,0,0,0|1,0,1]=4 587 B11R1.22 CCC(=O)C1=CC=C(C=C1)I Z285137052 [1,1,0,0,0,0|1,0,1]=4 588 B11R1.22 CCC(=O)C1=CC=C(C=C1)N Z1203578051 [1,1,0,0,0,0|1,0,1]=4 589 B11R1.22 CCC(=O)C1=CC=C(C=C1)O Z104499156 [1,1,0,0,0,0|0,0,1]=3 590 B11R1.22 CCC(C)C1=CC=C(C=C1)O Z104484172 [1,1,0,0,0,0|0,0,0]=2 591 B11R1.22 CCC(N)C1=CC=C(C=C1)Br Z90662172 [1,1,0,0,0,0|1,0,0]=3 592 B11R1.22 CCC(N)C1=CC=C(C=C1)C Z90662186 [1,1,0,0,0,0|1,0,0]=3 593 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl Z221421644 [1,1,0,0,0,0|1,0,0]=3 594 B11R1.22 CCC(O)C1=CC=C(C=C1)C Z228586316 [1,1,0,0,0,0|1,0,0]=3 595 B11R1.22 CCC(O)C1=CC=C(C=C1)Cl Z228586168 [1,1,0,0,0,0|1,0,0]=3 596 B11R1.22 CCC(O)C1=CC=C(C=C1)F Z228586174 [1,1,0,0,0,0|1,0,0]=3 597 B11R1.22 CCC(O)C1=CC=C(C=C1)O Z228586170 [1,1,0,0,0,0|0,0,0]=2 598 B11R1.22 CCC(O)C1=NC=C(C=C1)F Z1341678257 [1,1,0,0,0,0|2,0,0]=4 599 B11R1.22 CCS(=O)C1=CC=C(C=C1)F Z1154828228 [1,1,0,0,0,0|2,0,0]=4 600 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)F Z1626921240 [1,1,0,0,0,0|1,0,0]=3 601 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)F Z1625822291 [1,1,0,0,0,0|1,0,0]=3 602 B11R1.22 CNC(=O)C1=CC=C(C=C1)O Z183855140 [1,1,0,0,0,0|1,0,1]=4 603 B11R1.22 CNC(C)C1=CC=C(C=C1)C Z239628686 [1,1,0,0,0,0|2,0,0]=4 604 B11R1.22 CNC(C)C1=CC=C(C=C1)Cl Z159528172 [1,1,0,0,0,0|2,0,0]=4 605 B11R1.22 CNC(C)C1=CC=C(C=C1)F Z166605480 [1,1,0,0,0,0|2,0,0]=4 606 B11R1.22 CNC(C)C1=CC=C(C=C1)O Z316170374 [1,1,0,0,0,0|1,0,0]=3 607 B11R1.22 COC(=O)C1=CC=C(C=C1)O Z19674820 [1,1,0,0,0,0|1,0,1]=4 608 B11R1.22 NC(CF)C1=CC=C(C=C1)Cl Z1510155807 [1,1,0,0,0,0|2,0,0]=4 609 B11R1.22 NC(CO)C1=CC=C(C=C1)Br Z2188171600 [1,1,0,0,0,0|2,0,0]=4 610 B11R1.22 NC(CO)C1=CC=C(C=C1)F Z1268152327 [1,1,0,0,0,0|2,0,0]=4 611 B11R1.22 NCC(=O)C1=CC=C(C=C1)Br Z1741980207 [1,1,0,0,0,0|1,0,1]=4 612 B11R1.22 NCC(=O)C1=CC=C(C=C1)Cl Z56928681 [1,1,0,0,0,0|1,0,1]=4 613 B11R1.22 NCC(=O)C1=CC=C(C=C1)F Z275365838 [1,1,0,0,0,0|1,0,1]=4 614 B11R1.22 NCC(=O)C1=CC=C(C=C1)O Z1198177329 [1,1,0,0,0,0|0,0,1]=3 615 B11R1.22 NCC(O)C1=CC=C(C=C1)Cl Z295878600 [1,1,0,0,0,0|1,0,0]=3 616 B11R1.22 NNC(=O)C1=CC=C(C=C1)O Z57036327 [1,1,0,0,0,0|1,0,1]=4 617 B11R1.22 O=C(CCl)C1=CC=C(C=C1)O Z104378296 [1,1,0,0,0,0|1,0,1]=4 618 B11R1.81 CC1=C(C=CC(=C1)F)CCN Z959351734 [1,1,0,0,0,0|1,0,0]=3 619 B11R1.81 CC1=CC(=C(C=C1)CCN)Br Z4658970056 [1,1,0,0,0,0|1,0,0]=3 620 B11R1.81 CC1=CC(=C(C=C1)CCN)C Z285143724 [1,1,0,0,0,0|1,0,0]=3 621 B11R1.81 CC1=CC(=C(C=C1)CCN)Cl Z5010254329 [1,1,0,0,0,0|1,0,0]=3 622 B11R1.81 CCNC1=C(C=C(C=C1)C)C Z744754524 [1,1,0,0,0,0|2,0,0]=4 623 B11R1.81 CCNC1=C(C=C(C=C1)C)N Z394649004 [1,1,0,0,0,0|2,0,0]=4 624 B11R1.81 CCNC1=C(C=C(C=C1)Cl)Cl Z4201362307 [1,1,0,0,0,0|2,0,0]=4 625 B11R1.81 CCNC1=C(C=C(C=C1)F)N Z359511462 [1,1,0,0,0,0|2,0,0]=4 626 B11R1.81 CCOC1=C(C=C(C=C1)Br)N Z330803642 [1,1,0,0,0,0|2,0,0]=4 627 B11R1.81 CCOC1=C(C=C(C=C1)Cl)N Z234894877 [1,1,0,0,0,0|2,0,0]=4 628 B11R1.81 CCOC1=C(C=C(C=C1)F)Br Z55027547 [1,1,0,0,0,0|2,0,0]=4 629 B11R1.81 CCOC1=C(C=C(C=C1)F)N Z332375936 [1,1,0,0,0,0|2,0,0]=4 630 B11R1.81 CCOC1=C(C=C(C=C1)N)C Z385462628 [1,1,0,0,0,0|2,0,0]=4 631 B11R1.81 CCOC1=C(C=C(C=C1)N)Cl Z239873338 [1,1,0,0,0,0|2,0,0]=4 632 B11R1.81 CCOC1=C(C=C(C=C1)N)F Z362635048 [1,1,0,0,0,0|2,0,0]=4 633 B11R1.81 CCSC1=C(C=C(C=C1)Cl)N Z319450478 [1,1,0,0,0,0|2,0,0]=4 634 B11R1.81 CNCC1=C(C=C(C=C1)Br)Cl Z448247304 [1,1,0,0,0,0|2,0,0]=4 635 B11R1.81 CNCC1=C(C=C(C=C1)C)Br Z5345778789 [1,1,0,0,0,0|2,0,0]=4 636 B11R1.81 CNCC1=C(C=C(C=C1)C)C Z89283370 [1,1,0,0,0,0|2,0,0]=4 637 B11R1.81 CNCC1=C(C=C(C=C1)C)Cl Z5465034350 [1,1,0,0,0,0|2,0,0]=4 638 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Br Z5214955384 [1,1,0,0,0,0|2,0,0]=4 639 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Cl Z56959746 [1,1,0,0,0,0|2,0,0]=4 640 B11R1.81 CNCC1=C(C=C(C=C1)Cl)F Z385446922 [1,1,0,0,0,0|2,0,0]=4 641 B11R1.81 CNCC1=C(C=C(C=C1)F)Br Z1836652109 [1,1,0,0,0,0|2,0,0]=4 642 B11R1.81 CNCC1=C(C=C(C=C1)F)C Z4189742481 [1,1,0,0,0,0|2,0,0]=4 643 B11R1.81 CNCC1=C(C=C(C=C1)F)Cl Z138105392 [1,1,0,0,0,0|2,0,0]=4 644 B11R1.81 CNCC1=C(C=C(C=C1)F)F Z102767946 [1,1,0,0,0,0|2,0,0]=4 645 B11R1.81 COCC1=C(C=C(C=C1)Br)F Z823854350 [1,1,0,0,0,0|2,0,0]=4 646 B11R1.81 COCC1=C(C=C(C=C1)O)F Z1551937213 [1,1,0,0,0,0|1,0,0]=3 647 B11R1.81 NC1=CC(=C(C=C1)CCO)F Z1255436579 [1,1,0,0,0,0|2,0,0]=4 648 B11R1.81 NCCC1=C(C=C(C=C1)Br)Cl Z4668045321 [1,1,0,0,0,0|1,0,0]=3 649 B11R1.81 NCCC1=C(C=C(C=C1)Br)F Z405046450 [1,1,0,0,0,0|1,0,0]=3 650 B11R1.81 NCCC1=C(C=C(C=C1)Cl)Br Z2941505410 [1,1,0,0,0,0|1,0,0]=3 651 B11R1.81 NCCC1=C(C=C(C=C1)F)Cl Z1267881686 [1,1,0,0,0,0|1,0,0]=3 652 B11R1.81 NCCC1=C(C=C(C=C1)F)F Z285143768 [1,1,0,0,0,0|1,0,0]=3 653 B11R1.81 NCCC1=C(C=C(C=C1)O)O Z1166113553 [1,1,0,0,0,0|0,0,0]=2 654 B11R1.81 NCCC1=C(C=C(C=N1)F)F Z3024735908 [1,1,0,0,0,0|2,0,0]=4 655 B11R1.81 NNCC1=C(C=C(C=C1)Cl)Cl Z367452298 [1,1,0,0,0,0|2,0,0]=4 656 B11R1.81 NOCC1=C(C=C(C=C1)F)Br Z1318533831 [1,1,0,0,0,0|2,0,0]=4 657 B11R1.81 OCCC1=C(C=C(C=C1)F)F Z1020790240 [1,1,0,0,0,0|2,0,0]=4 658 B11R1.81 OCCC1=C(C=C(C=C1)O)O Z1513827466 [1,1,0,0,0,0|1,0,0]=3 659 B11R1.83 C#CC1=CC=C(C=C1)CCN Z4634952920 [1,1,0,0,0,0|1,0,0]=3 660 B11R1.83 C#CC1=CC=C(C=C1)OCC Z1080385490 [1,1,0,0,0,0|2,0,0]=4 661 B11R1.83 C/C=C/C1=CC=C(C=C1)OC Z2315575049 [1,1,0,0,0,0|0,0,2]=4 662 B11R1.83 CCC1=CC=C(C=C1)CCN Z285143808 [1,1,0,0,0,0|1,0,0]=3 663 B11R1.83 CCC1=CC=C(C=C1)CCO Z992949606 [1,1,0,0,0,0|2,0,0]=4 664 B11R1.83 CCCC1=CC=C(C=C1)C=O Z147641436 [1,1,0,0,0,0|0,0,1]=3 665 B11R1.83 CCNC1=CC=C(C=C1)C#N Z126933712 [1,1,0,0,0,0|2,0,0]=4 666 B11R1.83 CCNC1=CC=C(C=C1)CC Z286410160 [1,1,0,0,0,0|2,0,0]=4 667 B11R1.83 CCNC1=CC=C(C=C1)CN Z954985480 [1,1,0,0,0,0|2,0,0]=4 668 B11R1.83 CCNC1=CC=C(C=C1)OC Z286371004 [1,1,0,0,0,0|1,0,0]=3 669 B11R1.83 CCNC1=CN=C(C=C1)OC Z334876678 [1,1,0,0,0,0|2,0,0]=4 670 B11R1.83 CCOC1=CC=C(C=C1)C#N Z53834532 [1,1,0,0,0,0|2,0,0]=4 671 B11R1.83 CCOC1=CC=C(C=C1)C=O Z53833126 [1,1,0,0,0,0|1,0,1]=4 672 B11R1.83 CCOC1=CC=C(C=C1)NC Z335255846 [1,1,0,0,0,0|2,0,0]=4 673 B11R1.83 CCSC1=CC=C(C=C1)C#N Z332378580 [1,1,0,0,0,0|2,0,0]=4 674 B11R1.83 CNCC1=CC=C(C=C1)C#N Z123857104 [1,1,0,0,0,0|2,0,0]=4 675 B11R1.83 CNCC1=CC=C(C=C1)CO Z5435726703 [1,1,0,0,0,0|1,0,0]=3 676 B11R1.83 CNCC1=CC=C(C=C1)OC Z56928625 [1,1,0,0,0,0|1,0,0]=3 677 B11R1.83 CNCC1=CC=C(C=C1)SC Z56960262 [1,1,0,0,0,0|1,1,0]=4 678 B11R1.83 CNCC1=CN=C(C=C1)OC Z2490025030 [1,1,0,0,0,0|2,0,0]=4 679 B11R1.83 CNCC1=NC=C(C=C1)OC Z1849014421 [1,1,0,0,0,0|2,0,0]=4 680 B11R1.83 COC1=CC=C(C=C1)CC#N Z104476452 [1,1,0,0,0,0|0,0,2]=4 681 B11R1.83 COC1=CC=C(C=C1)CC=O Z993017620 [1,1,0,0,0,0|1,0,1]=4 682 B11R1.83 COC1=CC=C(C=C1)CCN Z104476454 [1,1,0,0,0,0|0,0,0]=2 683 B11R1.83 COCC1=CC=C(C=C1)C#N Z295205408 [1,1,0,0,0,0|2,0,0]=4 684 B11R1.83 COCC1=CC=C(C=C1)C=O Z1198331617 [1,1,0,0,0,0|1,0,1]=4 685 B11R1.83 COCC1=CC=C(C=C1)CN Z240084734 [1,1,0,0,0,0|2,0,0]=4 686 B11R1.83 COCC1=CC=C(C=C1)CO Z1255394253 [1,1,0,0,0,0|1,0,0]=3 687 B11R1.83 CSCC1=CC=C(C=C1)C#N Z432419878 [1,1,0,0,0,0|2,0,0]=4 688 B11R1.83 CSCC1=CC=C(C=C1)C=O Z2216784275 [1,1,0,0,0,0|1,0,1]=4 689 B11R1.83 CSCC1=CC=C(C=C1)SC Z599630492 [1,1,0,0,0,0|1,1,0]=4 690 B11R1.83 N#CC1=CC=C(C=C1)CCN Z1741971794 [1,1,0,0,0,0|1,0,0]=3 691 B11R1.83 N#CC1=CC=C(C=C1)CCO Z964982550 [1,1,0,0,0,0|2,0,0]=4 692 B11R1.83 NCCC1=CC=C(C=C1)CO Z3243654196 [1,1,0,0,0,0|0,0,0]=2 693 B11R1.83 O=CC1=CC=C(C=C1)CCF Z1813165432 [1,1,0,0,0,0|1,0,1]=4 694 B11R1.192 CC1=C(C=C(C=C1)CCN)C Z2526366647 [1,1,0,0,0,0|1,0,0]=3 695 B11R1.192 CC1=C(C=C(C=C1)CCN)Cl Z4330614334 [1,1,0,0,0,0|1,0,0]=3 696 B11R1.192 CC1=C(C=CC(=C1)CC#N)O Z1255368240 [1,1,0,0,0,0|0,0,2]=4 697 B11R1.192 CC1=C(C=CC(=C1)CCN)Br Z1269233616 [1,1,0,0,0,0|1,0,0]=3 698 B11R1.192 CC1=C(C=CC(=C1)CCN)Cl Z1198178622 [1,1,0,0,0,0|1,0,0]=3 699 B11R1.192 CC1=C(C=CC(=C1)CCN)F Z1682072426 [1,1,0,0,0,0|1,0,0]=3 700 B11R1.192 CCNC1=CC(=C(C=C1)C)C Z5214919889 [1,1,0,0,0,0|2,0,0]=4 701 B11R1.192 CCNC1=CC(=C(C=C1)C)F Z2306658828 [1,1,0,0,0,0|2,0,0]=4 702 B11R1.192 CCNC1=CC(=C(C=C1)F)C Z2756154226 [1,1,0,0,0,0|2,0,0]=4 703 B11R1.192 CCNC1=CC(=C(C=C1)F)Cl Z286408112 [1,1,0,0,0,0|2,0,0]=4 704 B11R1.192 CCNC1=CC(=C(C=C1)F)F Z334934070 [1,1,0,0,0,0|2,0,0]=4 705 B11R1.192 CCOC1=CC(=C(C=C1)Br)F Z1185888453 [1,1,0,0,0,0|2,0,0]=4 706 B11R1.192 CCOC1=CC(=C(C=C1)Cl)N Z1255357315 [1,1,0,0,0,0|2,0,0]=4 707 B11R1.192 CCOC1=CC(=C(C=C1)N)F Z2327883785 [1,1,0,0,0,0|2,0,0]=4 708 B11R1.192 CNCC1=CC(=C(C=C1)Br)Br Z6011701708 [1,1,0,0,0,0|2,0,0]=4 709 B11R1.192 CNCC1=CC(=C(C=C1)Br)Cl Z5321384345 [1,1,0,0,0,0|2,0,0]=4 710 B11R1.192 CNCC1=CC(=C(C=C1)C)C Z2238897979 [1,1,0,0,0,0|2,0,0]=4 711 B11R1.192 CNCC1=CC(=C(C=C1)C)Cl Z5390415454 [1,1,0,0,0,0|2,0,0]=4 712 B11R1.192 CNCC1=CC(=C(C=C1)C)F Z385447006 [1,1,0,0,0,0|2,0,0]=4 713 B11R1.192 CNCC1=CC(=C(C=C1)Cl)Cl Z56963342 [1,1,0,0,0,0|2,0,0]=4 714 B11R1.192 CNCC1=CC(=C(C=C1)F)C Z1873867371 [1,1,0,0,0,0|2,0,0]=4 715 B11R1.192 CNCC1=CC(=C(C=C1)F)F Z102767736 [1,1,0,0,0,0|2,0,0]=4 716 B11R1.192 CSCC1=CC(=C(C=C1)Cl)N Z732207352 [1,1,0,0,0,0|2,0,0]=4 717 B11R1.192 NCCC1=CC(=C(C=C1)Br)Cl Z5222342336 [1,1,0,0,0,0|1,0,0]=3 718 B11R1.192 NCCC1=CC(=C(C=C1)Cl)Cl Z285143770 [1,1,0,0,0,0|1,0,0]=3 719 B11R1.192 NCCC1=CC(=C(C=C1)Cl)F Z2681241887 [1,1,0,0,0,0|1,0,0]=3 720 B11R1.192 NCCC1=CC(=C(C=C1)F)Br Z752370708 [1,1,0,0,0,0|1,0,0]=3 721 B11R1.192 NCCC1=CC(=C(C=C1)F)Cl Z4607148848 [1,1,0,0,0,0|1,0,0]=3 722 B11R1.192 NCCC1=CC(=C(C=C1)F)F Z1695670002 [1,1,0,0,0,0|1,0,0]=3 723 B11R1.192 NCCC1=CC(=C(C=C1)O)O Z104474032 [1,1,0,0,0,0|0,0,0]=2 724 B11R1.192 OCCC1=CC(=C(C=C1)Br)F Z1450935429 [1,1,0,0,0,0|2,0,0]=4 725 B11R1.192 OCCC1=CC(=C(C=C1)F)F Z1020788674 [1,1,0,0,0,0|2,0,0]=4 726 B11R1.192 OCCC1=CC(=C(C=C1)O)Cl Z1250886915 [1,1,0,0,0,0|1,0,0]=3 727 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 Z1255383314 [1,1,0,0,0,0|1,0,1]=4 728 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Z3234810419 [1,1,0,0,0,0|1,0,1]=4 729 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 Z1255506457 [1,1,0,0,0,0|1,0,1]=4 730 B11R1.36 CC(C)C(N)C1=CC=NC=C1 Z513796098 [1,1,0,0,0,0|2,0,0]=4 731 B11R1.36 CC(C)C(N)C1=NC=CC=C1 Z513795924 [1,1,0,0,0,0|2,0,0]=4 732 B11R1.36 CC(C)C(O)C1=NC=CC=C1 Z513749462 [1,1,0,0,0,0|2,0,0]=4 733 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 Z199509008 [1,1,0,0,0,0|1,0,1]=4 734 B11R1.36 CC(N)C(C)C1=CC=CC=C1 Z1203578901 [1,1,0,0,0,0|0,0,0]=2 735 B11R1.36 CC(N)C(O)C1=CC=NC=C1 Z1263602353 [1,1,0,0,0,0|1,0,0]=3 736 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Z2588063686 [1,1,0,0,0,0|1,0,0]=3 737 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 Z57069256 [1,1,0,0,0,0|1,0,1]=4 738 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 Z57204607 [1,1,0,0,0,0|1,0,1]=4 739 B11R1.36 NC(C1=CC=CC=C1)C(F)F Z2211231766 [1,1,0,0,0,0|2,0,0]=4 740 B11R1.40 C#CC(N)CC1=CC=CC=C1 Z4167757719 [1,1,0,0,0,0|0,0,1]=3 741 B11R1.40 CC(C#N)OC1=CC=CC=C1 Z54191740 [1,1,0,0,0,0|1,0,1]=4 742 B11R1.40 CC(C=O)CC1=CC=CC=C1 Z1198150055 [1,1,0,0,0,0|1,0,0]=3 743 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [1,1,0,0,0,0|0,0,0]=2 744 B11R1.40 CC(CN)NC1=CC=CC=C1 Z1198235985 [1,1,0,0,0,0|1,0,0]=3 745 B11R1.40 CC(CN)OC1=CC=CC=C1 Z1245635737 [1,1,0,0,0,0|1,0,0]=3 746 B11R1.40 CC(CN)SC1=CC=CC=C1 Z844632804 [1,1,0,0,0,0|1,0,0]=3 747 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [1,1,0,0,0,0|0,0,0]=2 748 B11R1.40 CCC(O)CC1=CC=CC=C1 Z513749284 [1,1,0,0,0,0|1,0,0]=3 749 B11R1.40 CCC(O)CC1=CC=NC=C1 Z992409862 [1,1,0,0,0,0|2,0,0]=4 750 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 Z1262397064 [1,1,0,0,0,0|1,0,0]=3 751 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 Z1262397065 [1,1,0,0,0,0|1,0,0]=3 752 B11R1.40 CN(C#N)CC1=CC=CC=C1 Z1255506511 [1,1,0,0,0,0|1,0,1]=4 753 B11R1.40 CN(CC1=CC=CC=C1)N=O Z1198147495 [1,1,0,0,0,0|1,0,1]=4 754 B11R1.40 CS/C(=N/C1=CC=CC=C1)/N Z107728768 [1,1,0,0,0,0|1,0,1]=4 755 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [1,1,0,0,0,0|0,0,0]=2 756 B11R1.40 NC(CO)CC1=CC=NC=C1 Z1824511267 [1,1,0,0,0,0|1,0,0]=3 757 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [1,1,0,0,0,0|1,0,1]=4 758 B11R1.40 NCC(F)CC1=CC=CC=C1 Z2740416678 [1,1,0,0,0,0|1,0,0]=3 759 B11R1.40 NCC(N)CC1=CC=CC=C1 Z425861056 [1,1,0,0,0,0|0,0,0]=2 760 B11R1.40 NCC(O)CC1=CC=CC=C1 Z419084966 [1,1,0,0,0,0|1,0,0]=3 761 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [1,1,0,0,0,0|1,0,1]=4 762 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [1,1,0,0,0,0|0,0,0]=2 763 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [1,1,0,0,0,0|0,0,0]=2 764 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [1,1,0,0,0,0|1,0,1]=4 765 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [1,1,0,0,0,0|1,0,1]=4 766 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [1,1,0,0,0,0|1,0,1]=4 767 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [1,1,0,0,0,0|1,0,1]=4 768 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [1,1,0,0,0,0|1,0,1]=4 769 B11R1.86 CC(C)CC1=C(C=CC=C1)N Z1171158156 [1,1,0,0,0,0|1,0,0]=3 770 B11R1.86 CC(C)NC1=C(C=CC=C1)Br Z334939134 [1,1,0,0,0,0|2,0,0]=4 771 B11R1.86 CC(C)NC1=C(C=CC=C1)I Z362774390 [1,1,0,0,0,0|2,0,0]=4 772 B11R1.86 CC(C)OC1=C(C=CC=C1)Br Z54690481 [1,1,0,0,0,0|2,0,0]=4 773 B11R1.86 CC(C)OC1=C(C=CC=C1)Cl Z53833775 [1,1,0,0,0,0|2,0,0]=4 774 B11R1.86 CC(C)OC1=C(C=CC=C1)N Z239604736 [1,1,0,0,0,0|2,0,0]=4 775 B11R1.86 CC(C)SC1=C(C=CC=C1)N Z316174692 [1,1,0,0,0,0|2,0,0]=4 776 B11R1.86 CC(N)CC1=C(C=CC=C1)Br Z1416200939 [1,1,0,0,0,0|0,0,0]=2 777 B11R1.86 CC(N)CC1=C(C=CC=C1)Cl Z415728108 [1,1,0,0,0,0|0,0,0]=2 778 B11R1.86 CC1=C(C=CC=C1)CC(=N)N Z1374778803 [1,1,0,0,0,0|1,0,1]=4 779 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [1,1,0,0,0,0|1,0,1]=4 780 B11R1.86 CC1=C(C=CC=C1)CC(C)N Z594038086 [1,1,0,0,0,0|0,0,0]=2 781 B11R1.86 CC1=C(C=CC=C1)NC(C)C Z267168760 [1,1,0,0,0,0|2,0,0]=4 782 B11R1.86 CC1=C(C=CN=C1)CC(C)N Z4926043046 [1,1,0,0,0,0|1,0,0]=3 783 B11R1.86 CN(C)CC1=C(C=CC=C1)Cl Z54750062 [1,1,0,0,0,0|2,0,0]=4 784 B11R1.86 CN(C)CC1=C(C=CC=C1)N Z285162890 [1,1,0,0,0,0|2,0,0]=4 785 B11R1.86 CS(=O)CC1=C(C=CC=C1)N Z802580910 [1,1,0,0,0,0|2,0,0]=4 786 B11R1.86 N=C(N)CC1=C(C=CC=C1)Br Z1742055055 [1,1,0,0,0,0|1,0,1]=4 787 B11R1.86 N=C(N)CC1=C(C=CC=C1)F Z1695738915 [1,1,0,0,0,0|1,0,1]=4 788 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [1,1,0,0,0,0|1,0,1]=4 789 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [1,1,0,0,0,0|1,0,1]=4 790 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [1,1,0,0,0,0|1,0,1]=4 791 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [1,1,0,0,0,0|1,0,1]=4 792 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [1,1,0,0,0,0|1,0,1]=4 793 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [1,1,0,0,0,0|1,0,1]=4 794 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [1,1,0,0,0,0|1,0,1]=4 795 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [1,1,0,0,0,0|1,0,0]=3 796 B11R1.157 CC(C)CC1=CC(=NC=C1)N Z1197889925 [1,1,0,0,0,0|2,0,0]=4 797 B11R1.157 CC(C)NC1=CC(=CC=C1)Br Z266469772 [1,1,0,0,0,0|2,0,0]=4 798 B11R1.157 CC(C)NC1=CC(=CC=C1)F Z266497380 [1,1,0,0,0,0|2,0,0]=4 799 B11R1.157 CC(C)NC1=CC(=CC=C1)O Z335562192 [1,1,0,0,0,0|2,0,0]=4 800 B11R1.157 CC(C)OC1=CC(=CC=C1)Br Z53833977 [1,1,0,0,0,0|2,0,0]=4 801 B11R1.157 CC(C)OC1=CC(=CC=C1)N Z239604760 [1,1,0,0,0,0|2,0,0]=4 802 B11R1.157 CC(C)OC1=CC(=CC=C1)O Z381415570 [1,1,0,0,0,0|2,0,0]=4 803 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [1,1,0,0,0,0|0,0,0]=2 804 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [1,1,0,0,0,0|0,0,0]=2 805 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [1,1,0,0,0,0|0,0,0]=2 806 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [1,1,0,0,0,0|1,0,0]=3 807 B11R1.157 CN(C)CC1=CC(=CC=C1)N Z285162888 [1,1,0,0,0,0|2,0,0]=4 808 B11R1.157 CS(=O)CC1=CC(=CC=C1)N Z802580778 [1,1,0,0,0,0|2,0,0]=4 809 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [1,1,0,0,0,0|1,0,1]=4 810 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [1,1,0,0,0,0|1,0,1]=4 811 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [1,1,0,0,0,0|1,0,1]=4 812 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [1,1,0,0,0,0|1,0,1]=4 813 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [1,1,0,0,0,0|1,0,1]=4 814 B11R1.157 NC1=CC(=CC=C1)CC(F)F Z4075414750 [1,1,0,0,0,0|2,0,0]=4 815 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 Z89268868 [1,1,0,0,0,0|2,0,0]=4 816 B11R1.3 CC(C)C1=CC=C(C=C1)C#N Z56964596 [0,1,0,0,1,0|2,0,0]=4 817 B11R1.3 CC(C)C1=CC=C(C=C1)C=O Z104476006 [0,1,0,0,1,0|1,0,1]=4 818 B11R1.3 CC(C)C1=CC=C(C=C1)CN Z54845985 [0,1,0,0,1,0|2,0,0]=4 819 B11R1.3 CC(C)C1=CC=C(C=C1)CO Z56347221 [0,1,0,0,1,0|1,0,0]=3 820 B11R1.3 CC(N)C1=CC=C(C=C1)C#N Z381061562 [0,1,0,0,1,0|1,0,0]=3 821 B11R1.3 CC(N)C1=CC=C(C=C1)CN Z2063791526 [0,1,0,0,1,0|1,0,0]=3 822 B11R1.3 CC(O)C1=CC=C(C=C1)C#N Z335245074 [0,1,0,0,1,0|2,0,0]=4 823 B11R1.3 CCC1=CC=C(C=C1)C(C)N Z56347251 [0,1,0,0,1,0|1,0,0]=3 824 B11R1.3 CCC1=CC=C(C=C1)[C@H](C)N Z1536943321 [0,1,0,0,1,0|1,0,0]=3 825 B11R1.3 CN(C)C1=CC=C(C=C1)CO Z228585234 [0,1,0,0,1,0|2,0,0]=4 826 B11R1.3 CNC1=CC=C(C=C1)C(C)C Z1431904364 [0,1,0,0,1,0|2,0,0]=4 827 B11R1.3 COC1=CC=C(C=C1)C(=N)N Z228583094 [0,1,0,0,1,0|1,0,1]=4 828 B11R1.3 COC1=CC=C(C=C1)C(=O)C Z53832960 [0,1,0,0,1,0|1,0,1]=4 829 B11R1.3 COC1=CC=C(C=C1)C(=O)N Z33546492 [0,1,0,0,1,0|1,0,1]=4 830 B11R1.3 COC1=CC=C(C=C1)C(=S)N Z56964598 [0,1,0,0,1,0|1,0,1]=4 831 B11R1.3 COC1=CC=C(C=C1)C(C)O Z335245134 [0,1,0,0,1,0|1,0,0]=3 832 B11R1.3 COC1=CC=C(C=C1)N(C)C Z57243982 [0,1,0,0,1,0|2,0,0]=4 833 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)O Z360055358 [0,1,0,0,1,0|1,0,0]=3 834 B11R1.3 COC1=CC=C(C=C1)[C@H](C)O Z360055354 [0,1,0,0,1,0|1,0,0]=3 835 B11R1.3 COC1=NC=C(C=C1)C(C)N Z3083124760 [0,1,0,0,1,0|1,0,0]=3 836 B11R1.3 CSC1=CC=C(C=C1)C(C)N Z425449608 [0,1,0,0,1,0|0,1,0]=3 837 B11R1.3 NC(=O)C1=CC=C(C=C1)CO Z33545420 [0,1,0,0,1,0|1,0,1]=4 838 B11R1.19 CC(C)(C)C1=CC=C(C=C1)Br Z299596150 [0,1,0,0,1,0|2,0,0]=4 839 B11R1.19 CC(C)(C)C1=CC=C(C=C1)N Z104473848 [0,1,0,0,1,0|2,0,0]=4 840 B11R1.19 CC(C)(C)C1=CC=C(C=C1)O Z57127886 [0,1,0,0,1,0|1,0,0]=3 841 B11R1.19 CC(C)(N)C1=CC=C(C=C1)Br Z406678874 [0,1,0,0,1,0|1,0,0]=3 842 B11R1.19 CC(C)(N)C1=CC=C(C=C1)Cl Z449374202 [0,1,0,0,1,0|1,0,0]=3 843 B11R1.19 CC(C)(N)C1=CC=C(C=C1)F Z449374056 [0,1,0,0,1,0|1,0,0]=3 844 B11R1.19 CC(C)(N)C1=CC=C(C=C1)I Z5225137620 [0,1,0,0,1,0|1,0,0]=3 845 B11R1.19 CC(C)(O)C1=CC=C(C=C1)Br Z449374220 [0,1,0,0,1,0|2,0,0]=4 846 B11R1.19 CC(C)(O)C1=CC=C(C=C1)O Z1198750150 [0,1,0,0,1,0|1,0,0]=3 847 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)O Z147646800 [0,1,0,0,1,0|2,0,0]=4 848 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)O Z360053740 [0,1,0,0,1,0|2,0,0]=4 849 B11R1.19 OC1=CC=C(C=C1)C(F)(F)F Z56347220 [0,1,0,0,1,0|2,0,0]=4 850 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Br Z1037557930 [0,1,0,0,1,0|1,0,1]=4 851 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)C Z57221419 [0,1,0,0,1,0|1,0,1]=4 852 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Cl Z57905816 [0,1,0,0,1,0|1,0,1]=4 853 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)F Z385458772 [0,1,0,0,1,0|1,0,1]=4 854 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)N Z1664347745 [0,1,0,0,1,0|1,0,1]=4 855 B11R1.21 CC(Br)C1=CC(=C(C=C1)Cl)Cl Z381392948 [0,1,0,0,1,0|2,0,0]=4 856 B11R1.21 CC(Br)C1=CC(=C(C=C1)F)Cl Z381393046 [0,1,0,0,1,0|2,0,0]=4 857 B11R1.21 CC(C)C1=CC(=C(C=C1)F)N Z4722235861 [0,1,0,0,1,0|2,0,0]=4 858 B11R1.21 CC(C)C1=CC(=C(C=C1)N)Cl Z1262643307 [0,1,0,0,1,0|2,0,0]=4 859 B11R1.21 CC(C)C1=CC(=C(C=C1)N)N Z1198154332 [0,1,0,0,1,0|2,0,0]=4 860 B11R1.21 CC(C)C1=CC(=C(C=C1)O)N Z57441596 [0,1,0,0,1,0|1,0,0]=3 861 B11R1.21 CC(N)C1=CC(=C(C=C1)Br)F Z3213740225 [0,1,0,0,1,0|1,0,0]=3 862 B11R1.21 CC(N)C1=CC(=C(C=C1)Br)O Z1551939587 [0,1,0,0,1,0|1,0,0]=3 863 B11R1.21 CC(N)C1=CC(=C(C=C1)Cl)Cl Z56347253 [0,1,0,0,1,0|1,0,0]=3 864 B11R1.21 CC(N)C1=CC(=C(C=C1)Cl)F Z1198724032 [0,1,0,0,1,0|1,0,0]=3 865 B11R1.21 CC(N)C1=CC(=C(C=C1)F)Cl Z335437988 [0,1,0,0,1,0|1,0,0]=3 866 B11R1.21 CC(N)C1=CC(=C(C=C1)O)O Z4958589100 [0,1,0,0,1,0|0,0,0]=2 867 B11R1.21 CC(O)C1=CC(=C(C=C1)Br)F Z1436188584 [0,1,0,0,1,0|2,0,0]=4 868 B11R1.21 CC(O)C1=CC(=C(C=C1)Cl)Cl Z335245002 [0,1,0,0,1,0|2,0,0]=4 869 B11R1.21 CC(O)C1=CC(=C(C=C1)F)Cl Z335438560 [0,1,0,0,1,0|2,0,0]=4 870 B11R1.21 CC(O)C1=CC(=C(C=C1)F)F Z228586306 [0,1,0,0,1,0|2,0,0]=4 871 B11R1.21 CC1=C(C=C(C=C1)C(C)C)O Z104496566 [0,1,0,0,1,0|2,0,0]=4 872 B11R1.21 CC1=C(C=C(C=C1)C(C)N)C Z285186052 [0,1,0,0,1,0|1,0,0]=3 873 B11R1.21 CC1=C(C=C(C=C1)C(C)N)F Z363990474 [0,1,0,0,1,0|1,0,0]=3 874 B11R1.21 CC1=C(C=C(C=C1)[C@@H](C)O)C Z360055396 [0,1,0,0,1,0|2,0,0]=4 875 B11R1.21 CC1=C(C=C(C=C1)[C@H](C)O)C Z360055400 [0,1,0,0,1,0|2,0,0]=4 876 B11R1.21 CC1=C(C=CC(=C1)C(C)N)F Z1359429587 [0,1,0,0,1,0|1,0,0]=3 877 B11R1.21 CC1=C(C=CC(=C1)N(C)C)O Z4988450441 [0,1,0,0,1,0|2,0,0]=4 878 B11R1.21 C[C@@H](N)C1=CC(=C(C=C1)F)Br Z1696091701 [0,1,0,0,1,0|1,0,0]=3 879 B11R1.21 C[C@@H](N)C1=CC(=C(C=C1)F)Cl Z1127664214 [0,1,0,0,1,0|1,0,0]=3 880 B11R1.21 C[C@@H](O)C1=CC(=C(C=C1)Cl)Cl Z360055342 [0,1,0,0,1,0|2,0,0]=4 881 B11R1.21 C[C@@H](O)C1=CC(=C(C=C1)F)Cl Z1127664454 [0,1,0,0,1,0|2,0,0]=4 882 B11R1.21 C[C@@H](O)C1=CC(=C(C=C1)F)F Z360055916 [0,1,0,0,1,0|2,0,0]=4 883 B11R1.21 C[C@H](N)C1=CC(=C(C=C1)Cl)Cl Z1962166972 [0,1,0,0,1,0|1,0,0]=3 884 B11R1.21 C[C@H](N)C1=CC(=C(C=C1)F)Br Z360056272 [0,1,0,0,1,0|1,0,0]=3 885 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)Cl)Cl Z360055344 [0,1,0,0,1,0|2,0,0]=4 886 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)F)Br Z360056260 [0,1,0,0,1,0|2,0,0]=4 887 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)F)Cl Z1127664340 [0,1,0,0,1,0|2,0,0]=4 888 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)F)F Z360055912 [0,1,0,0,1,0|2,0,0]=4 889 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)Cl Z68591301 [0,1,0,0,1,0|1,0,1]=4 890 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)F Z1255448698 [0,1,0,0,1,0|1,0,1]=4 891 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)O Z1198152898 [0,1,0,0,1,0|1,0,1]=4 892 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)C Z1255386683 [0,1,0,0,1,0|1,0,1]=4 893 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)Cl Z1222422341 [0,1,0,0,1,0|1,0,1]=4 894 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)F Z1123826135 [0,1,0,0,1,0|1,0,1]=4 895 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)O Z57101026 [0,1,0,0,1,0|1,0,1]=4 896 B11R1.166 CC(C)C1=C(C=C(C=C1)Br)F Z1486025406 [0,1,0,0,1,0|2,0,0]=4 897 B11R1.166 CC(C)C1=C(C=C(C=C1)F)N Z4697442277 [0,1,0,0,1,0|2,0,0]=4 898 B11R1.166 CC(C)C1=C(C=C(C=C1)N)F Z1262668944 [0,1,0,0,1,0|2,0,0]=4 899 B11R1.166 CC(C)C1=C(C=C(C=C1)N)N Z1198148869 [0,1,0,0,1,0|2,0,0]=4 900 B11R1.166 CC(N)C1=C(C=C(C=C1)Br)F Z1269138850 [0,1,0,0,1,0|1,0,0]=3 901 B11R1.166 CC(N)C1=C(C=C(C=C1)Cl)Cl Z55928863 [0,1,0,0,1,0|1,0,0]=3 902 B11R1.166 CC(N)C1=C(C=C(C=C1)Cl)F Z4502817384 [0,1,0,0,1,0|1,0,0]=3 903 B11R1.166 CC(N)C1=C(C=C(C=C1)F)Cl Z446021018 [0,1,0,0,1,0|1,0,0]=3 904 B11R1.166 CC(N)C1=C(C=C(C=C1)F)F Z56347428 [0,1,0,0,1,0|1,0,0]=3 905 B11R1.166 CC(N)C1=C(C=C(C=N1)Cl)Cl Z5261443325 [0,1,0,0,1,0|2,0,0]=4 906 B11R1.166 CC(O)C1=C(C=C(C=C1)Br)F Z1171210737 [0,1,0,0,1,0|2,0,0]=4 907 B11R1.166 CC(O)C1=C(C=C(C=C1)Cl)Cl Z335245158 [0,1,0,0,1,0|2,0,0]=4 908 B11R1.166 CC(O)C1=C(C=C(C=C1)F)F Z228586308 [0,1,0,0,1,0|2,0,0]=4 909 B11R1.166 CC1=C(C=CC(=C1)Br)C(C)C Z1861997013 [0,1,0,0,1,0|2,0,0]=4 910 B11R1.166 CC1=C(C=CC(=C1)O)C(=O)N Z1255467737 [0,1,0,0,1,0|1,0,1]=4 911 B11R1.166 CC1=C(C=CC(=C1)O)C(C)C Z104476618 [0,1,0,0,1,0|1,0,0]=3 912 B11R1.166 CC1=CC(=C(C=C1)C(C)C)O Z57127464 [0,1,0,0,1,0|2,0,0]=4 913 B11R1.166 CC1=CC(=C(C=C1)[C@@H](C)O)C Z360055782 [0,1,0,0,1,0|2,0,0]=4 914 B11R1.166 CC1=CC(=C(C=C1)[C@H](C)N)C Z1217910494 [0,1,0,0,1,0|1,0,0]=3 915 B11R1.166 CC1=CC(=C(C=C1)[C@H](C)O)C Z360055778 [0,1,0,0,1,0|2,0,0]=4 916 B11R1.166 C[C@@H](N)C1=C(C=C(C=C1)Cl)Cl Z1889710318 [0,1,0,0,1,0|1,0,0]=3 917 B11R1.166 C[C@@H](N)C1=C(C=C(C=C1)F)Cl Z360056252 [0,1,0,0,1,0|1,0,0]=3 918 B11R1.166 C[C@@H](N)C1=C(C=C(C=C1)F)F Z1366975561 [0,1,0,0,1,0|1,0,0]=3 919 B11R1.166 C[C@@H](O)C1=C(C=C(C=C1)F)Cl Z360056250 [0,1,0,0,1,0|2,0,0]=4 920 B11R1.166 C[C@@H](O)C1=C(C=C(C=C1)F)F Z360055930 [0,1,0,0,1,0|2,0,0]=4 921 B11R1.166 C[C@H](N)C1=C(C=C(C=C1)F)F Z1366975537 [0,1,0,0,1,0|1,0,0]=3 922 B11R1.166 C[C@H](O)C1=C(C=C(C=C1)F)Cl Z360056244 [0,1,0,0,1,0|2,0,0]=4 923 B11R1.166 C[C@H](O)C1=C(C=C(C=C1)F)F Z360055924 [0,1,0,0,1,0|2,0,0]=4 924 B13R1.3 CC(C)CNC1=CC=C(C=C1)C#N Z168802628 [0,1,0,0,0,1|2,0,0]=4 925 B13R1.3 CC(C)COC1=CC=C(C=C1)C=O Z53833129 [0,1,0,0,0,1|1,0,1]=4 926 B13R1.3 CC(C)COC1=CC=C(C=C1)CN Z57102877 [0,1,0,0,0,1|2,0,0]=4 927 B13R1.3 CC(C)COC1=CC=C(C=C1)CO Z54649982 [0,1,0,0,0,1|1,0,0]=3 928 B13R1.3 CC(C)CSC1=CC=C(C=C1)C=O Z336080426 [0,1,0,0,0,1|1,0,1]=4 929 B13R1.3 CC(C)CSC1=CC=C(C=C1)CO Z1157828032 [0,1,0,0,0,1|1,0,0]=3 930 B13R1.3 CC(C)NCC1=CC=C(C=C1)C#N Z1262398475 [0,1,0,0,0,1|2,0,0]=4 931 B13R1.3 CC(C)OCC1=CC=C(C=C1)CN Z285179136 [0,1,0,0,0,1|2,0,0]=4 932 B13R1.3 CCC1=CC=C(C=C1)NCC(C)C Z334947802 [0,1,0,0,0,1|2,0,0]=4 933 B13R1.3 COC1=CC=C(C=C1)CCC(=O)N Z33545386 [0,1,0,0,0,1|1,0,1]=4 934 B13R1.3 COC1=CC=C(C=C1)CCC(C)N Z278080480 [0,1,0,0,0,1|0,0,0]=2 935 B13R1.3 COC1=CC=C(C=C1)CCN(C)C Z168912118 [0,1,0,0,0,1|2,0,0]=4 936 B13R1.3 COC1=CC=C(C=C1)CNC(=O)N Z198194812 [0,1,0,0,0,1|1,0,1]=4 937 B13R1.3 COC1=CC=C(C=C1)NCC(C)C Z2327691573 [0,1,0,0,0,1|1,0,0]=3 938 B13R1.3 COC1=CC=C(C=C1)OCC(=S)N Z295395794 [0,1,0,0,0,1|1,0,1]=4 939 B13R1.3 COC1=CC=C(C=C1)SCC(=O)N Z51312064 [0,1,0,0,0,1|1,0,1]=4 940 B13R1.14 CNC(=O)COC1=CC=C(C=C1)O Z381414890 [0,1,0,0,0,1|1,0,1]=4 941 B13R1.14 CNC(C)CCC1=CC=C(C=C1)O Z3215375352 [0,1,0,0,0,1|0,0,0]=2 942 B13R1.14 COC(=O)CCC1=CC=C(C=C1)O Z796576156 [0,1,0,0,0,1|1,0,1]=4 943 B13R1.14 COC(=O)COC1=CC=C(C=C1)O Z1190318463 [0,1,0,0,0,1|1,0,1]=4 944 B13R1.14 COC(C)CNC1=CC=C(C=C1)C Z1647435249 [0,1,0,0,0,1|2,0,0]=4 945 B13R1.14 NCC(O)COC1=CC=C(C=C1)F Z271072308 [0,1,0,0,0,1|2,0,0]=4 946 B13R1.14 NCC(O)COC1=CC=C(C=C1)I Z381428032 [0,1,0,0,0,1|2,0,0]=4 947 B13R1.14 OCC(O)COC1=CC=C(C=C1)Cl Z995094004 [0,1,0,0,0,1|2,0,0]=4 948 B13R1.132 CC(C)CC(=O)C1=CC=C(C=C1)Cl Z385417372 [0,1,0,0,0,1|2,0,0]=4 949 B13R1.132 CC(C)CC(N)C1=CC=C(C=C1)Cl Z291232734 [0,1,0,0,0,1|2,0,0]=4 950 B13R1.132 CC(C)OC(=O)C1=CC=C(C=C1)O Z53833637 [0,1,0,0,0,1|1,0,1]=4 951 B13R1.132 CC(N)CC(=O)C1=CC=C(C=C1)F Z1431002692 [0,1,0,0,0,1|1,0,0]=3 952 B13R1.132 CC(N)CC(O)C1=CC=C(C=C1)F Z1424669539 [0,1,0,0,0,1|1,0,0]=3 953 B13R1.133 CC(C)C(=O)CC1=CC=C(C=C1)Br Z513733696 [0,1,0,0,0,1|2,0,0]=4 954 B13R1.133 CC(C)C(=O)CC1=CC=C(C=C1)Cl Z513734254 [0,1,0,0,0,1|2,0,0]=4 955 B13R1.133 CC(C)C(=O)CC1=CC=C(C=C1)F Z513734502 [0,1,0,0,0,1|2,0,0]=4 956 B13R1.133 CC(C)C(=O)NC1=CC=C(C=C1)O Z335807310 [0,1,0,0,0,1|1,0,1]=4 957 B13R1.133 CC(C)C(N)CC1=CC=C(C=C1)Cl Z513796444 [0,1,0,0,0,1|2,0,0]=4 958 B13R1.133 CC(C)C(N)CC1=CC=C(C=C1)F Z513796714 [0,1,0,0,0,1|2,0,0]=4 959 B13R1.133 CC(C)C(O)CC1=CC=C(C=C1)F Z513750262 [0,1,0,0,0,1|2,0,0]=4 960 B13R1.133 CC(N)C(=O)NC1=CC=C(C=C1)Cl Z1449749895 [0,1,0,0,0,1|1,0,1]=4 961 B13R1.133 CC(OC1=CC=C(C=C1)O)C(=O)N Z381414584 [0,1,0,0,0,1|1,0,1]=4 962 B13R1.133 CC1=CC=C(C=C1)CC(=O)C(C)C Z513734840 [0,1,0,0,0,1|2,0,0]=4 963 B13R1.133 CC1=CC=C(C=C1)NC(=O)C(C)N Z1449748761 [0,1,0,0,0,1|1,0,1]=4 964 B13R1.133 NC(=O)[C@H](N)CC1=CC=C(C=C1)O Z3211890270 [0,1,0,0,0,1|1,0,1]=4 965 B13R1.164 CC(C)COC1=C(C=C(C=C1)N)Cl Z359419772 [0,1,0,0,0,1|2,0,0]=4 966 B13R1.164 CC(N)COC1=C(C=C(C=C1)F)F Z271013710 [0,1,0,0,0,1|1,0,0]=3 967 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)O)F Z1083021660 [0,1,0,0,0,1|1,0,1]=4 968 B13R1.511 CC(C)NCC1=CC(=C(C=C1)Cl)Cl Z86129869 [0,1,0,0,0,1|2,0,0]=4 969 B13R1.511 CC(N)CCC1=CC(=C(C=C1)F)F Z1123686389 [0,1,0,0,0,1|1,0,0]=3 970 B13R1.511 CN(C)CCC1=CC(=C(C=C1)O)O Z1501469796 [0,1,0,0,0,1|2,0,0]=4 971 B13R1.511 NC(=O)NCC1=CC(=C(C=C1)O)F Z1244088772 [0,1,0,0,0,1|1,0,1]=4 972 B13R1.512 CC(C)(C)NCC1=CC=C(C=C1)F Z56174013 [0,1,0,0,0,1|2,0,0]=4 973 B13R1.512 CC(C)(C)NCC1=CC=C(C=C1)O Z812516912 [0,1,0,0,0,1|1,0,0]=3 974 B13R1.512 CC(C)(C)OCC1=CC=C(C=C1)N Z362797126 [0,1,0,0,0,1|2,0,0]=4 975 B13R1.512 OC1=CC=C(C=C1)OCC(F)(F)F Z381414680 [0,1,0,0,0,1|2,0,0]=4 976 B13R1.4 CC(C)(N)CC1=CC=C(C=C1)C#N Z2855150945 [0,2,0,0,0,0|1,0,0]=3 977 B13R1.4 COC1=CC=C(C=C1)CC(C)(C)N Z1117893987 [0,2,0,0,0,0|0,0,0]=2 978 B13R1.4 NS(=O)(=O)CC1=CC=C(C=C1)CO Z1267897781 [0,2,0,0,0,0|2,0,0]=4 979 B13R1.4 OCC1=CC=C(C=C1)CC(F)(F)F Z1898594661 [0,2,0,0,0,0|2,0,0]=4 980 B13R1.5 COC1=CC=C(C=C1)C/C(=N/O)/N Z285225846 [0,2,0,0,0,0|1,0,1]=4 981 B13R1.5 COC1=CC=C(C=C1)CC(=O)NN Z56347401 [0,2,0,0,0,0|1,0,1]=4 982 B13R1.5 COC1=CC=C(C=C1)CC(=O)NO Z59182049 [0,2,0,0,0,0|1,0,1]=4 983 B13R1.5 COC1=CC=C(C=C1)CC(C)CN Z992310982 [0,2,0,0,0,0|0,0,0]=2 984 B13R1.5 COC1=CC=C(C=C1)OC(C)CN Z844632002 [0,2,0,0,0,0|1,0,0]=3 985 B13R1.35 CC(C)OC1=CC(=C(C=C1)CO)Cl Z1861997960 [0,2,0,0,0,0|2,0,0]=4 986 B13R1.35 COC1=C(C=C(C=C1)CC(=N)N)F Z1263602367 [0,2,0,0,0,0|1,0,1]=4 987 B13R1.35 COC1=C(C=C(C=C1)CC(C)N)O Z4574899614 [0,2,0,0,0,0|0,0,0]=2 988 B13R1.35 COC1=C(C=C(C=C1)NC(C)C)F Z1262254324 [0,2,0,0,0,0|2,0,0]=4 989 B13R1.36 CCC1=CC=C(C=C1)C(N)C(C)C Z90121786 [0,2,0,0,0,0|2,0,0]=4 990 B13R1.36 COC1=CC=C(C=C1)C(=O)C(C)Br Z325370254 [0,2,0,0,0,0|1,0,1]=4 991 B13R1.36 COC1=CC=C(C=C1)C(=O)C(C)C Z385418276 [0,2,0,0,0,0|1,0,1]=4 992 B13R1.36 COC1=CC=C(C=C1)C(=O)C(C)Cl Z56968902 [0,2,0,0,0,0|1,0,1]=4 993 B13R1.36 COC1=CC=C(C=C1)C(C)C(=O)C Z1276728136 [0,2,0,0,0,0|1,0,1]=4 994 B13R1.36 COC1=CC=C(C=C1)C(N)C(C)C Z99599002 [0,2,0,0,0,0|1,0,0]=3 995 B13R1.36 COC1=CC=C(C=C1)C(N)C(C)O Z3037763603 [0,2,0,0,0,0|1,0,0]=3 996 B13R1.36 COC1=CC=C(C=C1)C(N)C(F)F Z3377874365 [0,2,0,0,0,0|2,0,0]=4 997 B13R1.36 COC1=CC=C(C=C1)C(O)C(C)N Z1526453885 [0,2,0,0,0,0|0,0,0]=2 998 B13R1.142 CC(C)CC1=CC=C(C=C1)CCN Z3506600787 [0,2,0,0,0,0|2,0,0]=4 999 B13R1.142 CNCC1=CC=C(C=C1)CC(C)C Z5781254077 [0,2,0,0,0,0|2,0,0]=4 1000 B13R1.585 CC(=O)C1=CC=C(C=C1)CC(C)C Z104484764 [0,2,0,0,0,0|1,0,1]=4 1001 B13R1.585 CC(C)CC1=CC=C(C=C1)C(=O)O Z57052892 [0,2,0,0,0,0|1,0,0]=3 1002 B13R1.585 CC(C)CC1=CC=C(C=C1)C(C)N Z90122600 [0,2,0,0,0,0|2,0,0]=4 1003 B13R1.585 CC(C)CC1=CC=C(C=C1)C(C)O Z228586258 [0,2,0,0,0,0|1,0,0]=3 1004 B13R1.585 CC(C)NC1=CC=C(C=C1)C(=O)O Z381340356 [0,2,0,0,0,0|2,0,0]=4 1005 B13R1.585 CC(C)OC1=CC=C(C=C1)B(O)O Z381513180 [0,2,0,0,0,0|2,0,0]=4 1006 B13R1.585 CC(C)OC1=CC=C(C=C1)C(=O)O Z56862736 [0,2,0,0,0,0|2,0,0]=4 1007 B13R1.585 CC(C)SC1=CC=C(C=C1)C(=O)O Z228030824 [0,2,0,0,0,0|2,0,0]=4 1008 B13R1.585 CC(N)CC1=CC=C(C=C1)N(C)C Z969560732 [0,2,0,0,0,0|1,0,0]=3 1009 B13R1.585 CN(C)CC1=CC=C(C=C1)C(=O)O Z993967208 [0,2,0,0,0,0|2,0,0]=4 1010 B13R1.585 NC(=O)CC1=CC=C(C=C1)C(=O)O Z1255359559 [0,2,0,0,0,0|1,0,1]=4 1011 B13R1.653 CC(C)OC1=C(C=C(C=C1)CO)Cl Z839172854 [0,2,0,0,0,0|2,0,0]=4 1012 B13R1.653 COC1=CC(=C(C=C1)OC(C)C)N Z239604782 [0,2,0,0,0,0|2,0,0]=4 1013 B13R1.52 COC1=C(C=CC(=C1)CC(C)N)O Z4119887033 [0,2,0,0,0,0|0,0,0]=2 1014 B13R1.52 COC1=C(C=CC(=C1)CN(C)C)O Z2177030804 [0,2,0,0,0,0|2,0,0]=4 1015 B13R1.510 CC(C)C(N)C1=CC(=C(C=C1)F)F Z335235556 [0,2,0,0,0,0|2,0,0]=4 1016 B13R1.510 CC(N)C(O)C1=CC(=C(C=C1)F)F Z1342208384 [0,2,0,0,0,0|1,0,0]=3 1017 B13R1.510 CC1=C(C=CC(=C1)C(O)C(C)N)F Z4133752082 [0,2,0,0,0,0|1,0,0]=3 1018 B13R1.518 CC(C)(N)CC1=CC(=C(C=C1)F)O Z5336269159 [0,2,0,0,0,0|1,0,0]=3 1019 B13R1.518 CC(C)(O)CC1=CC(=C(C=C1)Br)F Z2756530158 [0,2,0,0,0,0|2,0,0]=4 1020 B13R1.518 CC1=C(C=CC(=C1)CC(C)(C)N)Br Z2182115428 [0,2,0,0,0,0|1,0,0]=3 1021 B13R1.518 CC1=C(C=CC(=C1)CC(F)(F)F)O Z1255403482 [0,2,0,0,0,0|2,0,0]=4 1022 B13R1.876 CC(N)CC1=C(C=C(C(=C1)F)F)F Z4092809107 [0,2,0,0,0,0|1,0,0]=3 1023 B13R1.2879 CC1=C(C=C(C=C1)CC(N)CO)C Z2255081939 [0,2,0,0,0,0|1,0,0]=3 1024 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)O)F Z1255453601 [0,2,0,0,0,0|1,0,1]=4 1025 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)O)N Z1201622979 [0,2,0,0,0,0|1,0,1]=4 1026 B13R1.21 CCC(C)C(N)C1=CC=C(C=C1)Cl Z291232760 [0,2,0,0,0,0|2,0,0]=4 1027 B13R1.21 CNC(C)C(C)C1=CC=C(C=C1)Cl Z1262590480 [0,2,0,0,0,0|1,0,0]=3 1028 B13R1.21 NC(CO)C(O)C1=CC=C(C=C1)Cl Z2670838766 [0,2,0,0,0,0|1,0,0]=3 1029 B13R1.163 CC(C)C(=O)C1=C(C=C(C=C1)O)F Z1255496103 [0,2,0,0,0,0|1,0,1]=4 1030 B13R1.163 CC(C)C(N)C1=C(C=C(C=C1)Cl)F Z1082849232 [0,2,0,0,0,0|2,0,0]=4 1031 B13R1.163 CC(C)C(N)C1=C(C=C(C=C1)F)F Z335236612 [0,2,0,0,0,0|2,0,0]=4 1032 B13R1.163 CC(N)C(=O)C1=C(C=C(C=C1)F)F Z3333649153 [0,2,0,0,0,0|1,0,1]=4 1033 B13R1.163 CC(N)C(O)C1=C(C=C(C=C1)Cl)Cl Z1695797889 [0,2,0,0,0,0|1,0,0]=3 1034 B13R1.525 CC(C)(C)C(N)C1=CC=C(C=C1)F Z234894925 [0,2,0,0,0,0|2,0,0]=4 1035 B13R1.706 CC(C)C(C#N)C1=CC=C(C=C1)Cl Z1198148456 [0,2,0,0,0,0|2,0,0]=4 1036 B13R1.706 CC(C)C(CN)C1=CC=C(C=C1)Cl Z1198338118 [0,2,0,0,0,0|2,0,0]=4 1037 B13R1.706 CNC(C1=CC=C(C=C1)F)C(C)C Z164181938 [0,2,0,0,0,0|2,0,0]=4 1038 B13R1.706 COC(C1=CC=C(C=C1)F)C(C)N Z1592042577 [0,2,0,0,0,0|1,0,0]=3 1039 B13R1.145 CCC(CC1=CC=C(C=C1)C)NC Z513804920 [0,2,0,0,0,0|1,0,0]=3 1040 B13R1.145 N#CC(CO)CC1=CC=C(C=C1)F Z851820868 [0,2,0,0,0,0|1,0,1]=4 1041 B13R1.145 NCC(CO)CC1=CC=C(C=C1)Br Z1860991556 [0,2,0,0,0,0|1,0,0]=3 1042 B13R1.145 NCC(CO)CC1=CC=C(C=C1)Cl Z1324055647 [0,2,0,0,0,0|1,0,0]=3 1043 B13R1.145 NCC(CO)CC1=CC=C(C=C1)F Z285055048 [0,2,0,0,0,0|1,0,0]=3 1044 B13R1.249 CC(C)(CN)SC1=CC=C(C=C1)Br Z1262327704 [0,2,0,0,0,0|2,0,0]=4 1045 B13R1.249 CC(N)(CO)CC1=CC=C(C=C1)Br Z2732858926 [0,2,0,0,0,0|1,0,0]=3 1046 B13R1.249 CC(N)(CO)CC1=CC=C(C=C1)Cl Z2738738577 [0,2,0,0,0,0|1,0,0]=3 1047 B13R1.249 CC(N)(CO)CC1=CC=C(C=C1)F Z2732860433 [0,2,0,0,0,0|1,0,0]=3 1048 B13R1.249 CC1=CC=C(C=C1)CC(C)(N)CO Z5060721709 [0,2,0,0,0,0|1,0,0]=3 1049 B13R1.2679 CC1=CC(=C(C=C1)CC(O)CN)C Z1255405058 [0,2,0,0,0,0|2,0,0]=4 1050 B13R1.2679 CCC(N)CC1=C(C=C(C=C1)Cl)Cl Z431980076 [0,2,0,0,0,0|1,0,0]=3 1051 B13R1.2679 NCC(O)CC1=C(C=C(C=C1)F)F Z1694636386 [0,2,0,0,0,0|2,0,0]=4 1052 B13R1.883 CC(C)(N)CC1=C(C=C(C=C1)Cl)Cl Z992953440 [0,2,0,0,0,0|1,0,0]=3 1053 B13R1.883 CC(C)(N)CC1=C(C=C(C=C1)F)F Z3026330622 [0,2,0,0,0,0|1,0,0]=3 1054 B11R1.167 CC(N)C1=C(C=CC(=C1)O)O Z4607148493 [0,0,1,1,0,0|1,0,1]=4 1055 B11R2.34 BrC1=CC=C(C=C1)C2CO2 Z278165164 [1,0,0,1,0,0|2,0,0]=4 1056 B11R2.34 BrC1=CC=C(C=C1)[C@@H]2CO2 Z1198177141 [1,0,0,1,0,0|2,0,0]=4 1057 B11R2.34 BrC1=CC=C(C=C1)[C@H]2CO2 Z1198177142 [1,0,0,1,0,0|2,0,0]=4 1058 B11R2.34 BrC1=CN=C(C=C1)C2CC2 Z2943484009 [1,0,0,1,0,0|2,0,0]=4 1059 B11R2.34 CC1=CC=C(C=C1)C2CO2 Z278165170 [1,0,0,1,0,0|2,0,0]=4 1060 B11R2.34 ClC1=CC=C(C=C1)C2CO2 Z274971352 [1,0,0,1,0,0|2,0,0]=4 1061 B11R2.34 ClC1=CC=C(C=C1)[C@@H]2CO2 Z1255450845 [1,0,0,1,0,0|2,0,0]=4 1062 B11R2.34 ClC1=CC=C(C=C1)[C@H]2CO2 Z1198173162 [1,0,0,1,0,0|2,0,0]=4 1063 B11R2.34 FC1=CC=C(C=C1)C2CO2 Z238878272 [1,0,0,1,0,0|2,0,0]=4 1064 B11R2.34 FC1=CC=C(C=C1)[C@@H]2CO2 Z1255365381 [1,0,0,1,0,0|2,0,0]=4 1065 B11R2.34 FC1=CC=C(C=C1)[C@H]2CO2 Z1255356921 [1,0,0,1,0,0|2,0,0]=4 1066 B11R2.34 OC1=CN=C(N=C1)C2CC2 Z1255433581 [1,0,0,1,0,0|2,0,0]=4 1067 B11R2.36 BrC1=CC2=C(C=C1)CCC2 Z359513410 [1,0,0,1,0,0|1,0,0]=3 1068 B11R2.36 BrC1=CC2=C(C=C1)CCN2 Z1267773746 [1,0,0,1,0,0|1,0,0]=3 1069 B11R2.36 BrC1=CC2=C(C=C1)CCO2 Z1198181832 [1,0,0,1,0,0|2,0,0]=4 1070 B11R2.36 BrC1=CC2=C(C=C1)CNC2 Z1694636353 [1,0,0,1,0,0|2,0,0]=4 1071 B11R2.36 BrC1=CC2=C(C=C1)COC2 Z1079162022 [1,0,0,1,0,0|2,0,0]=4 1072 B11R2.36 BrC1=CC2=C(C=C1)OCC2 Z299596228 [1,0,0,1,0,0|2,0,0]=4 1073 B11R2.36 BrC1=CC2=C(CCC2)N=C1 Z1198182024 [1,0,0,1,0,0|2,0,0]=4 1074 B11R2.36 CC1=CC2=C(C=C1)CCN2 Z1269638555 [1,0,0,1,0,0|1,0,0]=3 1075 B11R2.36 CC1=CC2=C(C=C1)CNC2 Z2238336530 [1,0,0,1,0,0|2,0,0]=4 1076 B11R2.36 CC1=CC2=C(C=C1)NCC2 Z235539062 [1,0,0,1,0,0|2,0,0]=4 1077 B11R2.36 CC1=NC=C2CCNC2=C1 Z2651710943 [1,0,0,1,0,0|2,0,0]=4 1078 B11R2.36 ClC1=CC2=C(C=C1)CCC2 Z1198234594 [1,0,0,1,0,0|1,0,0]=3 1079 B11R2.36 ClC1=CC2=C(C=C1)CCN2 Z926915320 [1,0,0,1,0,0|1,0,0]=3 1080 B11R2.36 ClC1=CC2=C(C=C1)CNC2 Z1198319382 [1,0,0,1,0,0|2,0,0]=4 1081 B11R2.36 ClC1=CC2=C(C=C1)NCC2 Z235537274 [1,0,0,1,0,0|2,0,0]=4 1082 B11R2.36 FC1=CC2=C(C=C1)CCN2 Z440803576 [1,0,0,1,0,0|1,0,0]=3 1083 B11R2.36 FC1=CC2=C(C=C1)CNC2 Z1094758928 [1,0,0,1,0,0|2,0,0]=4 1084 B11R2.36 FC1=CC2=C(CCN2)N=C1 Z5452930143 [1,0,0,1,0,0|2,0,0]=4 1085 B11R2.36 IC1=CC2=C(C=C1)CCC2 Z381540774 [1,0,0,1,0,0|1,0,0]=3 1086 B11R2.36 NC1=CC2=C(C=C1)CCO2 Z1203579091 [1,0,0,1,0,0|2,0,0]=4 1087 B11R2.36 NC1=CC2=C(C=C1)CCS2 Z1198181342 [1,0,0,1,0,0|2,0,0]=4 1088 B11R2.36 NC1=CC2=C(C=C1)CNC2 Z1192340875 [1,0,0,1,0,0|2,0,0]=4 1089 B11R2.36 NC1=CC2=C(C=C1)COC2 Z995041906 [1,0,0,1,0,0|2,0,0]=4 1090 B11R2.36 NC1=NC2=C(C=C1)CCC2 Z1198183883 [1,0,0,1,0,0|2,0,0]=4 1091 B11R2.36 O=C1C=C2CCCC2=CN1 Z1255494860 [1,0,0,1,0,0|1,0,1]=4 1092 B11R2.36 O=C1C=CC2=C(N1)CCC2 Z234895263 [1,0,0,1,0,0|1,0,1]=4 1093 B11R2.36 OC1=CC2=C(C=C1)C=NN2 Z1198147845 [1,0,0,1,0,0|1,0,1]=4 1094 B11R2.36 OC1=CC2=C(C=C1)CCN2 Z3241260546 [1,0,0,1,0,0|0,0,0]=2 1095 B11R2.36 OC1=CC2=C(C=C1)CNC2 Z2489383861 [1,0,0,1,0,0|1,0,0]=3 1096 B11R2.36 OC1=CC2=C(C=C1)OCC2 Z1198182902 [1,0,0,1,0,0|1,0,0]=3 1097 B11R2.36 OC1=CC2=C(C=C1)OCO2 Z104473678 [1,0,0,1,0,0|2,0,0]=4 1098 B11R2.36 OC1=CC2=C(C=CN2)C=C1 Z1203162244 [1,0,0,1,0,0|0,0,2]=4 1099 B11R2.36 OC1=CC2=C(CCC2)N=C1 Z1255498919 [1,0,0,1,0,0|1,0,0]=3 1100 B11R2.36 OC1=CC2=C(N=C1)NCC2 Z2310677431 [1,0,0,1,0,0|2,0,0]=4 1101 B11R2.36 OC1=NC2=C(C=C1)CCN2 Z5351512817 [1,0,0,1,0,0|1,0,0]=3 1102 B11R2.36 OC1=NC2=C(C=C1)CNC2 Z4913752558 [1,0,0,1,0,0|2,0,0]=4 1103 B11R2.36 SC1=CC2=C(C=C1)OCC2 Z361891428 [1,0,0,1,0,0|1,1,0]=4 1104 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 Z2309888982 [1,0,0,1,0,0|0,0,0]=2 1105 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 Z2296167800 [1,0,0,1,0,0|0,0,0]=2 1106 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 Z2517097696 [1,0,0,1,0,0|0,0,0]=2 1107 B11R2.10 CC1=NC2=C(N1)C=CC=C2 Z55692894 [1,0,0,1,0,0|1,0,1]=4 1108 B11R2.10 CC1CC2=C(N1)C=CC=C2 Z104472410 [1,0,0,1,0,0|0,0,0]=2 1109 B11R2.10 CC1CC2=C(N1)C=CN=C2 Z1203822742 [1,0,0,1,0,0|1,0,0]=3 1110 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [1,0,0,1,0,0|1,0,0]=3 1111 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [1,0,0,1,0,0|1,0,1]=4 1112 B11R2.10 NC1CC2=C(C1)C=CC=C2 Z1741971562 [1,0,0,1,0,0|0,0,0]=2 1113 B11R2.10 NC1CC2=C(C1)C=NC=C2 Z2238944796 [1,0,0,1,0,0|1,0,0]=3 1114 B11R2.10 NC1CC2=C(C1)N=CC=C2 Z3069017080 [1,0,0,1,0,0|1,0,0]=3 1115 B11R2.10 NC1CC2=C(C1)N=CC=N2 Z4953585301 [1,0,0,1,0,0|2,0,0]=4 1116 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [1,0,0,1,0,0|1,0,1]=4 1117 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [1,0,0,1,0,0|1,0,1]=4 1118 B11R2.238 C1=CC=C(C=C1)CC2CO2 Z1020680006 [1,0,0,1,0,0|1,0,0]=3 1119 B11R2.238 C1=CC=C(C=C1)C[C@@H]2CO2 Z1617991494 [1,0,0,1,0,0|1,0,0]=3 1120 B11R2.238 C1=CC=C(C=C1)C[C@H]2CO2 Z2216712384 [1,0,0,1,0,0|1,0,0]=3 1121 B11R2.238 C1=CC=C(C=C1)NC2CC2 Z1203731288 [1,0,0,1,0,0|2,0,0]=4 1122 B13R2.147 NC1CC(C1)C2=CC=C(C=C2)Br Z1696091784 [0,0,0,1,0,1|1,0,0]=3 1123 B13R2.147 NC1CC(C1)C2=CC=C(C=C2)F Z1266854912 [0,0,0,1,0,1|1,0,0]=3 1124 B13R2.147 N[C@H]1C[C@@H](C1)C2=CC=C(C=C2)Cl Z1947189743 [0,0,0,1,0,1|1,0,0]=3 1125 B13R2.147 OC1CC(C1)C2=CC=C(C=C2)Br Z501748690 [0,0,0,1,0,1|2,0,0]=4 1126 B13R2.155 CC1=CC2=C(C=C1)NCC(O2)C Z1198339750 [0,0,0,1,0,1|2,0,0]=4 1127 B13R2.155 CC1CNC2=C(C1)C=C(C=C2)F Z5085288248 [0,0,0,1,0,1|2,0,0]=4 1128 B13R2.155 CC1CNC2=C(O1)C=C(C=C2)Br Z1269181301 [0,0,0,1,0,1|2,0,0]=4 1129 B13R2.155 CC1CNC2=C(O1)C=C(C=C2)F Z1258990936 [0,0,0,1,0,1|2,0,0]=4 1130 B13R2.155 NC1COC2=C(C1)C=C(C=C2)Br Z3225516948 [0,0,0,1,0,1|1,0,0]=3 1131 B13R2.155 NC1COC2=C(C1)C=C(C=C2)F Z2146513958 [0,0,0,1,0,1|1,0,0]=3 1132 B13R2.155 O=C1CCC2=C(N1)C=C(C=C2)O Z1255450792 [0,0,0,1,0,1|1,0,1]=4 1133 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)O Z1255458499 [0,0,0,1,0,1|1,0,1]=4 1134 B13R2.155 OC1=CC2=C(C=C1)CCC(C2)O Z1513811314 [0,0,0,1,0,1|1,0,0]=3 1135 B13R2.155 OC1CNC2=C(C1)C=C(C=C2)Br Z2733593416 [0,0,0,1,0,1|2,0,0]=4 1136 B13R2.155 OC1CNC2=C(C1)C=C(C=C2)F Z1813139692 [0,0,0,1,0,1|2,0,0]=4 1137 B13R2.527 BrC1=CC=C(C=C1)CNC2CC2 Z86138865 [0,0,0,1,0,1|2,0,0]=4 1138 B13R2.527 BrC1=CC=C(C=C1)NCC2CC2 Z4461698510 [0,0,0,1,0,1|2,0,0]=4 1139 B13R2.527 BrC1=CC=C(C=C1)OCC2CC2 Z431958470 [0,0,0,1,0,1|2,0,0]=4 1140 B13R2.527 BrC1=CC=C(C=C1)OCC2CO2 Z104492436 [0,0,0,1,0,1|2,0,0]=4 1141 B13R2.527 CC1=CC=C(C=C1)CNC2CC2 Z86138895 [0,0,0,1,0,1|2,0,0]=4 1142 B13R2.527 CC1=CC=C(C=C1)OCC2CO2 Z57046213 [0,0,0,1,0,1|2,0,0]=4 1143 B13R2.527 ClC1=CC=C(C=C1)CNC2CC2 Z86138866 [0,0,0,1,0,1|2,0,0]=4 1144 B13R2.527 ClC1=CC=C(C=C1)OCC2CO2 Z94602271 [0,0,0,1,0,1|2,0,0]=4 1145 B13R2.527 ClC1=CC=C(C=C1)OC[C@H]2CO2 Z1198182187 [0,0,0,1,0,1|2,0,0]=4 1146 B13R2.527 FC1=CC=C(C=C1)OCC2CO2 Z147642752 [0,0,0,1,0,1|2,0,0]=4 1147 B13R2.527 NC1=CC=C(C=C1)CNC2CC2 Z756920140 [0,0,0,1,0,1|2,0,0]=4 1148 B13R2.527 NC1=CC=C(C=C1)OCC2CC2 Z1267881654 [0,0,0,1,0,1|2,0,0]=4 1149 B13R2.527 OC1=CC=C(C=C1)CNC2CC2 Z425809384 [0,0,0,1,0,1|1,0,0]=3 1150 B13R2.527 OC1=CC=C(C=C1)OCC2CC2 Z431958964 [0,0,0,1,0,1|1,0,0]=3 1151 B13R2.2988 OC1=CC=C(C=C1)C2CC2(F)F Z1513871465 [0,0,0,1,0,1|2,0,0]=4 1152 B13R2.3791 CC1(CNC2=C1C=C(C=C2)Br)C Z2065464292 [0,0,0,1,0,1|2,0,0]=4 1153 B13R2.3791 CC1(COC2=C1C=C(C=C2)Br)C Z1269161489 [0,0,0,1,0,1|2,0,0]=4 1154 B13R2.3791 CC1(COC2=C1C=C(C=C2)O)C Z1513829476 [0,0,0,1,0,1|1,0,0]=3 1155 B13R2.16 COC1=CC=C(C=C1)C2OC2C Z278165290 [0,1,0,1,0,0|1,0,0]=3 1156 B13R2.16 COC1=CC=C(C=C1)[C@@H]2C[C@H]2N Z2298098001 [0,1,0,1,0,0|0,0,0]=2 1157 B13R2.16 COC1=CC=C(C=C1)[C@@H]2O[C@H]2C Z2527564242 [0,1,0,1,0,0|1,0,0]=3 1158 B13R2.184 NCC1=CC=C(C=C1)CC2CC2 Z3409173944 [0,1,0,1,0,0|2,0,0]=4 1159 B13R2.184 O=CC1=CC=C(C=C1)CC2CC2 Z1216844691 [0,1,0,1,0,0|1,0,1]=4 1160 B13R2.2121 CC1CC2=C(N1)C=C(C=C2)CN Z5644794909 [0,1,0,1,0,0|1,0,0]=3 1161 B13R2.2121 CC1CC2=C(O1)C=C(C=C2)C=O Z1813113716 [0,1,0,1,0,0|1,0,1]=4 1162 B13R2.2121 CC1CC2=C(O1)C=CC(=C2)CO Z274787916 [0,1,0,1,0,0|2,0,0]=4 1163 B13R2.2121 CN1CC2=C(C1)C=C(C=C2)CO Z1251354292 [0,1,0,1,0,0|2,0,0]=4 1164 B13R2.2121 COC1=CC2=C(C=C1)NC(C2)C Z1255421552 [0,1,0,1,0,0|2,0,0]=4 1165 B13R2.2121 N#CC1=CC2=C(C=C1)CC(C2)N Z1255451461 [0,1,0,1,0,0|1,0,0]=3 1166 B13R2.521 CC1=C(C=CC(=C1)CC2CO2)F Z1495386296 [0,1,0,1,0,0|2,0,0]=4 1167 B13R2.522 CC1=C(C=C(C=C1)C2CC2N)C Z234897043 [0,1,0,1,0,0|1,0,0]=3 1168 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)Cl)Cl Z2298098026 [0,1,0,1,0,0|1,0,0]=3 1169 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)Cl)F Z2298098037 [0,1,0,1,0,0|1,0,0]=3 1170 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)F)F Z2298098006 [0,1,0,1,0,0|1,0,0]=3 1171 B13R2.520 CC1=CC=C(C=C1)C(N)C2CC2 Z212051920 [0,1,0,1,0,0|2,0,0]=4 1172 B13R2.520 NC(C1=CC=C(C=C1)Cl)C2CC2 Z336481690 [0,1,0,1,0,0|2,0,0]=4 1173 B13R2.520 NC(C1=CC=C(C=C1)F)C2CC2 Z291232556 [0,1,0,1,0,0|2,0,0]=4 1174 B13R2.520 OC(C1=CC=C(C=C1)Br)C2CC2 Z756121470 [0,1,0,1,0,0|2,0,0]=4 1175 B13R2.2987 CC1(CC1N)C2=CC=C(C=C2)F Z1695926070 [0,1,0,1,0,0|1,0,0]=3 1176 B13R2.5190 CC1CC2=C(C1C)C=CC(=C2)O Z1513871470 [0,1,0,1,0,0|1,0,0]=3 1177 B13R2.5190 CC1CC2=C(C1N)C=CC(=C2)Br Z5129562645 [0,1,0,1,0,0|2,0,0]=4 1178 B13R2.5190 CC1OC2=C(C1N)C=CC(=C2)Br Z5090873656 [0,1,0,1,0,0|2,0,0]=4 1179 B13R2.42 NC[C@@H]1C[C@H]1C2=CC=C(C=C2)F Z2286737527 [0,1,0,1,0,0|1,0,0]=3 1180 B13R2.42 O=CC1CC1C2=CC=C(C=C2)F Z1255463273 [0,1,0,1,0,0|2,0,0]=4 1181 B13R2.42 O=C[C@@H]1C[C@H]1C2=CC=C(C=C2)F Z2307166680 [0,1,0,1,0,0|2,0,0]=4 1182 B13R2.43 CNC1CC2=C(C1)C=C(C=C2)C Z1509336365 [0,1,0,1,0,0|1,0,0]=3 1183 B13R2.43 NCC1CC2=C(O1)C=CC(=C2)Br Z1269117858 [0,1,0,1,0,0|2,0,0]=4 1184 B13R2.148 NC1(CC1)CC2=CC=C(C=C2)Cl Z3244909154 [0,1,0,1,0,0|1,0,0]=3 1185 B13R2.148 NC1(CC1)CC2=CC=C(C=C2)F Z2235812186 [0,1,0,1,0,0|1,0,0]=3 1186 B13R2.1069 ClC1=CC=C(C=C1)CC2CNC2 Z1333043513 [0,1,0,1,0,0|1,0,0]=3 1187 B13R2.1069 FC1=CC=C(C=C1)CC2CNC2 Z1274177347 [0,1,0,1,0,0|1,0,0]=3 1188 B13R2.1069 FC1=CC=C(C=C1)OC2CNC2 Z2941369391 [0,1,0,1,0,0|2,0,0]=4 1189 B13R2.1069 OC1=CC=C(C=C1)CC2CCC2 Z1513872159 [0,1,0,1,0,0|1,0,0]=3 1190 B13R2.1069 OC1=CC=C(C=C1)OC2CCC2 Z2515400422 [0,1,0,1,0,0|2,0,0]=4 1191 B13R2.3028 CC1=CC2=C(C=C1)CC(C2=O)C Z1255467363 [0,1,0,1,0,0|2,0,0]=4 1192 B13R2.3028 CC1=CC2=C(C=C1)CC(C2N)C Z1625822273 [0,1,0,1,0,0|1,0,0]=3 1193 B13R2.3028 CC1CC2=C(C1=O)C=C(C=C2)F Z1201617604 [0,1,0,1,0,0|2,0,0]=4 1194 B13R2.3028 CC1CC2=C(C1N)C=C(C=C2)F Z1398462002 [0,1,0,1,0,0|1,0,0]=3 1195 B13R2.3028 CN1CC2=C(C1=O)C=C(C=C2)O Z1486003470 [0,1,0,1,0,0|2,0,0]=4 1196 B13R2.3683 CC1=CC2=C(C=C1)OC(CN2)C Z1198339746 [0,1,0,1,0,0|2,0,0]=4 1197 B13R2.3683 CC1CC2=C(C=C(C=C2)F)CN1 Z979717396 [0,1,0,1,0,0|1,0,0]=3 1198 B13R2.3683 CC1CNC2=C(O1)C=CC(=C2)Br Z1269154407 [0,1,0,1,0,0|2,0,0]=4 1199 B13R2.3683 CC1CNC2=C(O1)C=CC(=C2)Cl Z1198339753 [0,1,0,1,0,0|2,0,0]=4 1200 B13R2.3683 OC1CCC2=C(C1)C=CC(=C2)Br Z449374978 [0,1,0,1,0,0|2,0,0]=4 1201 B13R2.3051 CC1(CC2=C(C1)C=C(C=C2)N)C Z2894245187 [0,1,0,1,0,0|2,0,0]=4 1202 B13R2.3051 CC1(CC2=C(C1)C=C(C=C2)O)C Z1513871406 [0,1,0,1,0,0|1,0,0]=3 1203 B13R2.5399 CC1=CC(=C(C=C1)[C@@H]2C[C@H]2N)Br Z4670281105 [0,1,0,1,0,0|1,0,0]=3 1204 B13R2.5399 N[C@@H]1C[C@H]1C2=C(C=C(C=C2)Cl)Cl Z2298098028 [0,1,0,1,0,0|1,0,0]=3 1205 B13R2.5399 N[C@@H]1C[C@H]1C2=C(C=C(C=C2)F)F Z2298098010 [0,1,0,1,0,0|1,0,0]=3 1206 B13R3.213 ClC1=CC2=C(C=C1)CC3C2O3 Z1198182425 [0,0,0,2,0,0|2,0,0]=4 1207 B9R1.7 CC1=CC=C(S1)CCN Z3038322398 [1,0,0,0,1,0|2,0,0]=4 1208 B9R1.7 NCCC1=CC=C(O1)Br Z1442016604 [1,0,0,0,1,0|2,0,0]=4 1209 B9R1.7 NCCC1=CC=C(S1)Cl Z432066930 [1,0,0,0,1,0|2,0,0]=4 1210 B9R1.7 NCCC1=CC=C(S1)I Z1262398458 [1,0,0,0,1,0|2,0,0]=4 1211 B9R1.7 NCCC1=CSC(=C1)Br Z4125344523 [1,0,0,0,1,0|2,0,0]=4 1212 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [1,0,0,0,1,0|1,0,1]=4 1213 B9R1.6 CC(C)C1=NC=CC=C1 Z1198148831 [1,0,0,0,1,0|2,0,0]=4 1214 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [1,0,0,0,1,0|0,0,0]=2 1215 B9R1.6 CC(N)C1=CN=CC=C1 Z85921957 [1,0,0,0,1,0|1,0,0]=3 1216 B9R1.6 CC(N)C1=NC=CC=C1 Z56347059 [1,0,0,0,1,0|1,0,0]=3 1217 B9R1.6 CC(N)C1=NC=CC=N1 Z2945456281 [1,0,0,0,1,0|2,0,0]=4 1218 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [1,0,0,0,1,0|1,0,0]=3 1219 B9R1.6 CC(O)C1=CC=NC=C1 Z335245082 [1,0,0,0,1,0|2,0,0]=4 1220 B9R1.6 CC(O)C1=CN=CC=C1 Z335245084 [1,0,0,0,1,0|2,0,0]=4 1221 B9R1.6 CC(O)C1=NC=CC=C1 Z335244914 [1,0,0,0,1,0|2,0,0]=4 1222 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [1,0,0,0,1,0|1,0,0]=3 1223 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [1,0,0,0,1,0|0,0,0]=2 1224 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Z1197994836 [1,0,0,0,1,0|1,0,0]=3 1225 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [1,0,0,0,1,0|1,0,0]=3 1226 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [1,0,0,0,1,0|0,0,0]=2 1227 B9R1.6 C[C@H](N)C1=CC=NC=C1 Z1492781304 [1,0,0,0,1,0|1,0,0]=3 1228 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [1,0,0,0,1,0|1,0,0]=3 1229 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [1,0,0,0,1,0|1,0,1]=4 1230 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [1,0,0,0,1,0|1,0,1]=4 1231 B9R1.13 CC(N)CC1=CC=CO1 Z285143986 [1,0,0,0,1,0|1,0,0]=3 1232 B9R1.13 CC(N)CC1=CC=CS1 Z1160899518 [1,0,0,0,1,0|1,0,0]=3 1233 B9R1.13 CC(N)CC1=CNN=C1 Z5233405251 [1,0,0,0,1,0|2,0,0]=4 1234 B9R1.13 CC(N)CC1=COC=C1 Z1098234443 [1,0,0,0,1,0|1,0,0]=3 1235 B9R1.13 CC(N)CN1C=CC=N1 Z271011614 [1,0,0,0,1,0|2,0,0]=4 1236 B9R1.13 CC(N)CN1C=CN=C1 Z271011862 [1,0,0,0,1,0|2,0,0]=4 1237 B9R1.35 CC(N)C1=CC(=CS1)Br Z3874998794 [0,0,0,0,2,0|2,0,0]=4 1238 B9R1.35 CC(N)C1=CN(C=C1)C Z1216817109 [0,0,0,0,2,0|2,0,0]=4 1239 B9R1.35 CC1=CC=C(O1)C(C)N Z119990422 [0,0,0,0,2,0|2,0,0]=4 1240 B9R1.35 CC1=CC=C(S1)C(C)N Z285186066 [0,0,0,0,2,0|2,0,0]=4 1241 B9R1.35 C[C@@H](N)C1=CC=C(S1)Cl Z1587257446 [0,0,0,0,2,0|2,0,0]=4 1242 B9R1.35 C[C@H](N)C1=CC=C(S1)Br Z1753032856 [0,0,0,0,2,0|2,0,0]=4 1243 B9R1.35 C[C@H](N)C1=CC=C(S1)Cl Z1583815700 [0,0,0,0,2,0|2,0,0]=4 1244 B11R1.91 CC(=O)CSC1=CC=CC=C1 Z19751394 [1,0,0,0,0,1|1,0,1]=4 1245 B11R1.91 CC(=O)NCC1=CC=CC=C1 Z27749489 [1,0,0,0,0,1|1,0,1]=4 1246 B11R1.91 CC(=O)OCC1=CC=CC=C1 Z19628364 [1,0,0,0,0,1|1,0,1]=4 1247 B11R1.91 CC(C)CNC1=CC=CC=C1 Z2092369729 [1,0,0,0,0,1|1,0,0]=3 1248 B11R1.91 CC(C)COC1=CN=CC=C1 Z1606818727 [1,0,0,0,0,1|2,0,0]=4 1249 B11R1.91 CC(C)NCC1=CN=CC=C1 Z90502194 [1,0,0,0,0,1|2,0,0]=4 1250 B11R1.91 CC(C)NCC1=NC=CC=C1 Z90502192 [1,0,0,0,0,1|2,0,0]=4 1251 B11R1.91 CC(N)CCC1=CC=CC=C1 Z104476462 [1,0,0,0,0,1|0,0,0]=2 1252 B11R1.91 CC(N)COC1=CC=CC=C1 Z600397650 [1,0,0,0,0,1|0,0,0]=2 1253 B11R1.91 CC(O)CNC1=CC=CC=C1 Z234898271 [1,0,0,0,0,1|1,0,0]=3 1254 B11R1.91 CN(C)CCC1=CC=CC=C1 Z168912026 [1,0,0,0,0,1|2,0,0]=4 1255 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Z5044990030 [1,0,0,0,0,1|0,0,0]=2 1256 B11R1.91 FC(F)SCC1=CC=CC=C1 Z55626056 [1,0,0,0,0,1|2,0,0]=4 1257 B11R1.91 N=C(N)CCC1=CC=CC=C1 Z2092176896 [1,0,0,0,0,1|1,0,1]=4 1258 B11R1.91 N=C(N)COC1=CC=CC=C1 Z1532540938 [1,0,0,0,0,1|1,0,1]=4 1259 B11R1.91 N=C(N)CSC1=CC=CC=C1 Z1532718998 [1,0,0,0,0,1|1,0,1]=4 1260 B11R1.91 N=C(N)SCC1=CC=CC=C1 Z89242849 [1,0,0,0,0,1|1,0,1]=4 1261 B11R1.91 NC(=O)CCC1=CC=CC=C1 Z33546514 [1,0,0,0,0,1|1,0,1]=4 1262 B11R1.91 NC(=O)CNC1=CC=CC=C1 Z104583968 [1,0,0,0,0,1|1,0,1]=4 1263 B11R1.91 NC(=O)COC1=CC=CC=C1 Z19735702 [1,0,0,0,0,1|1,0,1]=4 1264 B11R1.91 NC(=O)CSC1=CC=CC=C1 Z19751390 [1,0,0,0,0,1|1,0,1]=4 1265 B11R1.91 NC(=O)NCC1=CC=CC=C1 Z104476310 [1,0,0,0,0,1|1,0,1]=4 1266 B11R1.91 NC(=O)OCC1=CC=CC=C1 Z33547079 [1,0,0,0,0,1|1,0,1]=4 1267 B11R1.91 NC(=S)CCC1=CC=CC=C1 Z56824950 [1,0,0,0,0,1|1,0,1]=4 1268 B11R1.91 NC(=S)COC1=CC=CC=C1 Z108595128 [1,0,0,0,0,1|1,0,1]=4 1269 B11R1.91 NC(=S)NCC1=CC=CC=C1 Z56900892 [1,0,0,0,0,1|1,0,1]=4 1270 B13R1.513 CC(C)CCOC1=CC=C(C=C1)N Z239604712 [0,0,0,0,0,2|2,0,0]=4 1271 B13R1.513 CC(C)CNCC1=CC=C(C=C1)Cl Z3300708565 [0,0,0,0,0,2|2,0,0]=4 1272 B13R1.513 CC(C)NCCC1=CC=C(C=C1)F Z3950920670 [0,0,0,0,0,2|2,0,0]=4 1273 B13R1.513 CN(C)CCOC1=CC=C(C=C1)O Z3484324847 [0,0,0,0,0,2|2,0,0]=4