0 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.18 CC(=O)CC1=NC=CN=C1 Z1098219337 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.18 CC(=O)NC1=CN=CC=C1 Z31791378 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.18 CC(=O)NC1=NC=NC=C1 Z1216844375 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.18 CC(C)CC1=NC=CC=C1 Z1201621742 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.18 CC(C)NC1=CC=CC=C1 Z104475020 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [0,0,0,0,0,0|1,0,1]=2 11 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.18 CN(C)CC1=CN=CC=C1 Z140563088 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.18 CN(C)CC1=NC=CC=C1 Z4614651190 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.18 N=C(N)CC1=CC=NC=C1 Z2441004470 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.18 N=C(N)CC1=CN=CC=C1 Z2350941593 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [0,0,0,0,0,0|1,0,0]=1 19 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.18 NC(=O)CC1=CN=CN=C1 Z1203583458 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.18 NC(=O)NC1=NC=CC=C1 Z208358454 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [0,0,0,0,0,0|1,1,0]=2 24 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [0,0,0,0,0,0|2,1,0]=3 25 B10R1.18 NC(=S)NC1=NC=CC=C1 Z57106231 [0,0,0,0,0,0|3,1,0]=4 26 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [0,0,0,0,0,0|1,0,0]=1 27 B10R1.18 O=C(O)CC1=CCCCC1 Z1138835936 [0,0,0,0,0,0|0,0,4]=4 28 B10R1.18 O=C(O)CC1=CCOCC1 Z1205495477 [0,0,0,0,0,0|1,0,3]=4 29 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [0,0,0,0,0,0|1,0,0]=1 30 B10R1.18 O=C(O)CC1=CN=CN=C1 Z1889902548 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.18 O=C(O)CC1C=CCCC1 Z1198264430 [0,0,0,0,0,0|0,0,4]=4 32 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [0,0,0,0,0,0|1,0,0]=1 33 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [0,0,0,0,0,0|1,0,1]=2 34 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [0,0,0,0,0,0|1,0,1]=2 35 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [1,0,0,0,0,0|1,0,1]=3 36 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [1,0,0,0,0,0|2,0,1]=4 37 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [1,0,0,0,0,0|2,0,1]=4 38 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.8 N#CCC1=CN=CC=C1 Z239871646 [1,0,0,0,0,0|2,0,1]=4 42 B9R1.8 N#CCC1=NC=CC=C1 Z104476888 [1,0,0,0,0,0|2,0,1]=4 43 B9R1.8 N#COC1=CC=CC=C1 Z1198165353 [1,0,0,0,0,0|2,0,1]=4 44 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [1,0,0,0,0,0|2,0,1]=4 45 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [1,0,0,0,0,0|2,0,1]=4 46 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [1,0,0,0,0,0|2,0,0]=3 50 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [1,0,0,0,0,0|0,0,0]=1 51 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [1,0,0,0,0,0|0,0,1]=2 52 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [1,0,0,0,0,0|1,0,1]=3 53 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [1,0,0,0,0,0|1,0,1]=3 54 B9R1.8 OCCC1=NC=CN=C1 Z234895105 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.8 OCCC1=NC=NC=C1 Z1250886882 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.8 S=C=NC1=CC=CC=C1 Z56904678 [1,0,0,0,0,0|1,1,1]=4 57 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [0,1,0,0,0,0|1,0,0]=2 58 B11R1.20 CC(=O)NC1=CC=C(C=C1)C Z28134680 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl Z28161730 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.20 CC(=O)NC1=CC=C(C=C1)F Z27805821 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.20 CC(=O)NC1=CC=C(C=C1)I Z30316374 [0,1,0,0,0,0|2,0,0]=3 62 B11R1.20 CC(=O)NC1=CC=C(C=C1)N Z56926521 [0,1,0,0,0,0|2,0,0]=3 63 B11R1.20 CC(=O)NC1=CC=C(C=C1)O Z56946051 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.20 CC(=O)NC1=CC=C(C=C1)S Z104484984 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.20 CC(=O)NC1=NC=C(C=C1)Cl Z71484766 [0,1,0,0,0,0|3,0,0]=4 66 B11R1.20 CC(=O)OC1=CC=C(C=C1)O Z1198155166 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.20 CC(=S)NC1=CC=C(C=C1)F Z56756640 [0,1,0,0,0,0|2,1,0]=4 68 B11R1.20 CC(C)CC1=CC=C(C=C1)N Z1463350056 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [0,1,0,0,0,0|2,0,1]=4 70 B11R1.20 CC1=CC=C(C=C1)CC(=N)N Z3244909870 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [0,1,0,0,0,0|0,0,0]=1 72 B11R1.20 CC1=CC=C(C=C1)NC(=O)N Z56754677 [0,1,0,0,0,0|2,0,0]=3 73 B11R1.20 CC1=CC=C(C=C1)NC(=S)N Z57965505 [0,1,0,0,0,0|2,1,0]=4 74 B11R1.20 CC1=NC=C(C=C1)CC(=O)O Z424795892 [0,1,0,0,0,0|1,0,0]=2 75 B11R1.20 CN(C)CC1=CC=C(C=C1)N Z228584348 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br Z1518844582 [0,1,0,0,0,0|2,0,0]=3 77 B11R1.20 N=C(N)CC1=CC=C(C=C1)F Z415636754 [0,1,0,0,0,0|2,0,0]=3 78 B11R1.20 N=C(N)NC1=CC=C(C=C1)Br Z5099116935 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.20 N=C(N)NC1=CC=C(C=C1)Cl Z2931635778 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.20 N=C(N)NC1=CC=C(C=C1)N Z2471157136 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [0,1,0,0,0,0|1,0,0]=2 82 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [0,1,0,0,0,0|1,0,0]=2 83 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [0,1,0,0,0,0|1,0,0]=2 84 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [0,1,0,0,0,0|1,0,0]=2 85 B11R1.20 NC(=O)NC1=CC=C(C=C1)Br Z89283357 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl Z56754682 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.20 NC(=O)NC1=CC=C(C=C1)F Z166687094 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.20 NC(=O)NC1=CC=C(C=C1)I Z56754684 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.20 NC(=O)NC1=CC=C(C=C1)N Z239123648 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.20 NC(=S)CC1=CC=C(C=C1)F Z285131734 [0,1,0,0,0,0|1,1,0]=3 91 B11R1.20 NC(=S)NC1=CC=C(C=C1)Cl Z56939186 [0,1,0,0,0,0|2,1,0]=4 92 B11R1.20 NC(=S)NC1=CC=C(C=C1)F Z57455239 [0,1,0,0,0,0|2,1,0]=4 93 B11R1.20 NC1=CC=C(C=C1)CC(=O)O Z104481066 [0,1,0,0,0,0|0,0,0]=1 94 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl Z217293314 [0,1,0,0,0,0|1,0,0]=2 95 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br Z90121253 [0,1,0,0,0,0|0,0,0]=1 96 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [0,1,0,0,0,0|0,0,0]=1 97 B11R1.20 O=C(O)CC1=CC=C(C=C1)F Z104477312 [0,1,0,0,0,0|0,0,0]=1 98 B11R1.20 O=C(O)CC1=CN=C(C=C1)Cl Z1165304038 [0,1,0,0,0,0|1,0,0]=2 99 B11R1.20 O=C(O)CC1=CNC(=O)C=C1 Z1198338224 [0,1,0,0,0,0|1,0,0]=2 100 B11R1.20 O=C(O)CC1=NC=C(C=C1)F Z1945984141 [0,1,0,0,0,0|1,0,0]=2 101 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 Z1201618094 [0,1,0,0,0,0|0,0,1]=2 102 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 Z1255485389 [0,1,0,0,0,0|1,0,1]=3 103 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 Z1255383314 [0,1,0,0,0,0|1,0,0]=2 104 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Z3234810419 [0,1,0,0,0,0|1,0,0]=2 105 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 Z31506242 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.36 CC(=O)N(C)C1=CC=NC=C1 Z1889797965 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.36 CC(=O)N(C)C1=CN=CC=C1 Z1203252645 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.36 CC(=O)N(C)C1=NC=CC=C1 Z223364322 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 Z1255506457 [0,1,0,0,0,0|1,0,0]=2 110 B11R1.36 CC(C(=O)O)C1=CN=CC=C1 Z792377268 [0,1,0,0,0,0|1,0,0]=2 111 B11R1.36 CC(C(=O)O)C1=CN=CN=C1 Z1860991554 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.36 CC(C(=O)[O-])C1=CC=NC=C1 Z2408359395 [0,1,0,0,0,0|1,0,1]=3 113 B11R1.36 CC(C(=O)[O-])C1=NC=CC=N1 Z2216711550 [0,1,0,0,0,0|2,0,1]=4 114 B11R1.36 CC(N)C(C)C1=CC=CC=C1 Z1203578901 [0,1,0,0,0,0|2,0,1]=4 115 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Z2588063686 [0,1,0,0,0,0|1,0,1]=3 116 B11R1.36 CN(C(=N)N)C1=CC=CC=C1 Z1269638527 [0,1,0,0,0,0|3,0,0]=4 117 B11R1.36 CN(C(=O)N)C1=CN=CC=C1 Z1188339188 [0,1,0,0,0,0|3,0,0]=4 118 B11R1.36 CN(O)C(=O)C1=CC=CC=C1 Z1416187404 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.36 C[C@@H](C(=O)O)C1=CN=CC=C1 Z5462337230 [0,1,0,0,0,0|1,0,0]=2 120 B11R1.36 C[C@H](C(=O)O)C1=CN=CC=C1 Z5462556304 [0,1,0,0,0,0|1,0,0]=2 121 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 Z57069256 [0,1,0,0,0,0|1,0,0]=2 122 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 Z57204607 [0,1,0,0,0,0|1,0,0]=2 123 B11R1.36 NC(=O)C(N)C1=NC=CC=C1 Z1251358507 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 Z147647142 [0,1,0,0,0,0|0,0,0]=1 125 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 Z815264186 [0,1,0,0,0,0|1,0,0]=2 126 B11R1.36 NC(C1=CC=CC=C1)C(F)F Z2211231766 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 Z278101784 [0,1,0,0,0,0|0,0,0]=1 128 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 Z957336528 [0,1,0,0,0,0|0,0,0]=1 129 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 Z381360894 [0,1,0,0,0,0|0,0,1]=2 130 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 Z104495824 [0,1,0,0,0,0|0,0,0]=1 131 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 Z1203161992 [0,1,0,0,0,0|0,0,0]=1 132 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 Z104473974 [0,1,0,0,0,0|0,0,0]=1 133 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 Z808230894 [0,1,0,0,0,0|0,0,0]=1 134 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 Z1201618616 [0,1,0,0,0,0|0,0,0]=1 135 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 Z1255390767 [0,1,0,0,0,0|0,0,0]=1 136 B11R1.36 O=C([O-])C(O)C1=NC=CC=C1 Z2357023524 [0,1,0,0,0,0|1,0,1]=3 137 B11R1.40 C#CC(=O)CC1=CC=CC=C1 Z1266856334 [0,1,0,0,0,0|1,0,0]=2 138 B11R1.40 C#CC(N)CC1=CC=CC=C1 Z4167757719 [0,1,0,0,0,0|2,0,1]=4 139 B11R1.40 C/C(=C\C1=CC=CC=C1)/C=O Z3219847417 [0,1,0,0,0,0|1,0,1]=3 140 B11R1.40 C=CC(=O)NC1=CC=CC=C1 Z440633536 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.40 C=CC(=O)NC1=CN=CC=C1 Z440633590 [0,1,0,0,0,0|3,0,0]=4 142 B11R1.40 C=CC(=O)NC1=NC=CC=C1 Z440633578 [0,1,0,0,0,0|3,0,0]=4 143 B11R1.40 CC(C=O)CC1=CC=CC=C1 Z1198150055 [0,1,0,0,0,0|1,0,1]=3 144 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [0,1,0,0,0,0|2,0,1]=4 145 B11R1.40 CCC(=O)CC1=CN=CC=C1 Z992407884 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.40 CCC(O)CC1=CC=CC=C1 Z513749284 [0,1,0,0,0,0|1,0,1]=3 148 B11R1.40 CCC(O)CC1=CC=NC=C1 Z992409862 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 Z1262397064 [0,1,0,0,0,0|1,0,1]=3 150 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 Z1262397065 [0,1,0,0,0,0|1,0,1]=3 151 B11R1.40 CN(C#N)CC1=CC=CC=C1 Z1255506511 [0,1,0,0,0,0|3,0,0]=4 152 B11R1.40 CN(CC1=CC=CC=C1)N=O Z1198147495 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.40 CNC(=O)NC1=CC=CC=C1 Z55293754 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.40 CNC(=S)NC1=CC=CC=C1 Z45796176 [0,1,0,0,0,0|2,1,0]=4 155 B11R1.40 COC(=O)CC1=CC=NC=C1 Z331473808 [0,1,0,0,0,0|1,0,0]=2 156 B11R1.40 COC(=O)CC1=CN=CN=C1 Z2176326087 [0,1,0,0,0,0|2,0,0]=3 157 B11R1.40 COC(=O)CC1=NC=CC=C1 Z147652450 [0,1,0,0,0,0|1,0,0]=2 158 B11R1.40 COC(=O)CC1=NC=CC=N1 Z1255420534 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.40 CS/C(=N/C1=CC=CC=C1)/N Z107728768 [0,1,0,0,0,0|2,1,0]=4 160 B11R1.40 N/C(=N\O)/CC1=NC=CC=C1 Z285132826 [0,1,0,0,0,0|2,0,0]=3 161 B11R1.40 N=C(NN)NC1=CC=CC=C1 Z2768171754 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [0,1,0,0,0,0|1,0,1]=3 163 B11R1.40 NC(CO)CC1=CC=NC=C1 Z1824511267 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [0,1,0,0,0,0|1,0,0]=2 165 B11R1.40 NCC(=O)NC1=CC=CC=C1 Z594413794 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.40 NCC(=O)NC1=CC=NC=C1 Z1459449301 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.40 NCC(=O)NC1=NC=CC=C1 Z1459449767 [0,1,0,0,0,0|3,0,0]=4 168 B11R1.40 NCC(F)CC1=CC=CC=C1 Z2740416678 [0,1,0,0,0,0|2,0,1]=4 169 B11R1.40 NCC(N)CC1=CC=CC=C1 Z425861056 [0,1,0,0,0,0|2,0,1]=4 170 B11R1.40 NCC(O)CC1=CC=CC=C1 Z419084966 [0,1,0,0,0,0|1,0,1]=3 171 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [0,1,0,0,0,0|1,0,0]=2 172 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 Z90123523 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.40 NNC(=O)NC1=CC=CC=C1 Z56855648 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.40 NNC(=O)NC1=NC=CC=C1 Z1171220858 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.40 NNC(=S)NC1=CC=CC=C1 Z56836896 [0,1,0,0,0,0|2,1,0]=4 176 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [0,1,0,0,0,0|1,0,1]=3 177 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [0,1,0,0,0,0|1,0,1]=3 178 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [0,1,0,0,0,0|1,0,0]=2 179 B11R1.40 O=C(CCl)NC1=CC=CC=C1 Z56889119 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.40 O=C(CCl)NC1=CC=NC=C1 Z2238905122 [0,1,0,0,0,0|3,0,0]=4 181 B11R1.40 O=C(CCl)NC1=CN=CC=C1 Z1558574655 [0,1,0,0,0,0|3,0,0]=4 182 B11R1.40 O=C(CCl)NC1=NC=CC=C1 Z2753743270 [0,1,0,0,0,0|3,0,0]=4 183 B11R1.40 O=C(CO)NC1=CC=CC=C1 Z228585444 [0,1,0,0,0,0|1,0,0]=2 184 B11R1.40 O=C/C(=C/C1=CC=CC=C1)/Br Z2312942099 [0,1,0,0,0,0|1,0,1]=3 185 B11R1.40 O=C/C(=C/C1=CC=CC=C1)/Cl Z104475950 [0,1,0,0,0,0|1,0,1]=3 186 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [0,1,0,0,0,0|1,0,0]=2 187 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [0,1,0,0,0,0|1,0,0]=2 188 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [0,1,0,0,0,0|1,0,0]=2 189 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [0,1,0,0,0,0|1,0,0]=2 190 B11R1.86 CC(=O)CC1=C(C=NC=C1)C Z4958080575 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.86 CC(=O)CN1C=CC=CC1=O Z1881599491 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.86 CC(=O)NC1=C(C=CC=C1)N Z239120544 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.86 CC(=O)NC1=C(C=CC=C1)O Z57040482 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.86 CC(=O)NC1=C(C=CC=N1)N Z1216821214 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.86 CC(=O)NC1=C(C=NC=C1)C Z1148747945 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.86 CC(=O)NC1=[N+](C=CC=C1)C Z56872112 [0,1,0,0,0,0|3,0,0]=4 197 B11R1.86 CC(=O)OC1=C(C=CC=C1)O Z1513803522 [0,1,0,0,0,0|2,0,0]=3 198 B11R1.86 CC(C)CC1=C(C=CC=C1)N Z1171158156 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.86 CC(N)CC1=C(C=CC=C1)Br Z1416200939 [0,1,0,0,0,0|2,0,1]=4 200 B11R1.86 CC(N)CC1=C(C=CC=C1)Cl Z415728108 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.86 CC1=C(C=CC=C1)CC(=N)N Z1374778803 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.86 CC1=C(C=CC=C1)CC(=O)O Z104503424 [0,1,0,0,0,0|0,0,0]=1 204 B11R1.86 CC1=C(C=CC=C1)CC(C)N Z594038086 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.86 CC1=C(C=CC=C1)NC(=S)N Z199467218 [0,1,0,0,0,0|2,1,0]=4 206 B11R1.86 CC1=C(C=CC=N1)CC(=O)O Z2050687800 [0,1,0,0,0,0|1,0,0]=2 207 B11R1.86 CC1=C(C=NC=C1)CC(=O)O Z1198264460 [0,1,0,0,0,0|1,0,0]=2 208 B11R1.86 CN(C)CC1=C(C=CC=C1)Cl Z54750062 [0,1,0,0,0,0|3,0,0]=4 209 B11R1.86 CN(C)CC1=C(C=CC=C1)N Z285162890 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.86 CS(=O)CC1=C(C=CC=C1)N Z802580910 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.86 N=C(N)CC1=C(C=CC=C1)Br Z1742055055 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.86 N=C(N)CC1=C(C=CC=C1)F Z1695738915 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [0,1,0,0,0,0|1,0,0]=2 214 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [0,1,0,0,0,0|1,0,0]=2 215 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [0,1,0,0,0,0|1,0,0]=2 216 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.86 NC(=O)NC1=C(C=CC=C1)Br Z247615996 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.86 NC(=O)NC1=C(C=CC=C1)Cl Z56754680 [0,1,0,0,0,0|2,0,0]=3 219 B11R1.86 NC(=O)NC1=C(C=CC=C1)F Z57028527 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.86 NC(=S)NC1=C(C=CC=C1)F Z199467164 [0,1,0,0,0,0|2,1,0]=4 221 B11R1.86 NC1=C(C=CC=N1)CC(=O)O Z1889710265 [0,1,0,0,0,0|1,0,0]=2 222 B11R1.86 O=C(O)CC1=C(C=CC=C1)Br Z285184626 [0,1,0,0,0,0|0,0,0]=1 223 B11R1.86 O=C(O)CC1=C(C=CC=C1)Cl Z56911957 [0,1,0,0,0,0|0,0,0]=1 224 B11R1.86 O=C(O)CC1=C(C=CC=C1)F Z104495526 [0,1,0,0,0,0|0,0,0]=1 225 B11R1.86 O=C(O)CC1=C(C=CC=C1)I Z1269196288 [0,1,0,0,0,0|0,0,0]=1 226 B11R1.86 O=C(O)CC1=C(C=CC=C1)O Z608061328 [0,1,0,0,0,0|0,0,0]=1 227 B11R1.86 O=C(O)CC1=C(C=CN=C1)Cl Z2096659743 [0,1,0,0,0,0|1,0,0]=2 228 B11R1.86 O=C(O)CC1=C(C=CN=C1)O Z1255444750 [0,1,0,0,0,0|1,0,0]=2 229 B11R1.86 O=C(O)CC1=C(N=CC=C1)Br Z1269238080 [0,1,0,0,0,0|1,0,0]=2 230 B11R1.86 O=C(O)CC1=C(N=CC=N1)Cl Z1255421013 [0,1,0,0,0,0|2,0,0]=3 231 B11R1.86 O=C(O)CC1=CN=CNC1=O Z4990166200 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.86 O=C(O)CN1C=CC=CC1=O Z57985357 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.86 O=C(O)CN1C=CC=NC1=O Z245435552 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.86 O=C(O)CN1C=NC=CC1=O Z1154745738 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.86 O=C([O-])CC1=C(C=NC=N1)Br Z2216720843 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.86 O=C([O-])CC1=C(C=NC=N1)Cl Z2160914960 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.86 O=[N+]([O-])CC1=C(C=CC=C1)F Z2182028452 [0,1,0,0,0,0|1,0,1]=3 238 B11R1.86 OB(O)CC1=C(C=CC=C1)Cl Z1147227737 [0,1,0,0,0,0|1,0,1]=3 239 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [0,1,0,0,0,0|1,0,0]=2 240 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [0,1,0,0,0,0|1,0,0]=2 241 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [0,1,0,0,0,0|1,0,0]=2 242 B11R1.157 CC(=O)NC1=CC(=CC=C1)Br Z27788933 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.157 CC(=O)NC1=CC(=CC=C1)I Z26432839 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.157 CC(=O)NC1=CC(=CC=C1)N Z56926524 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.157 CC(=O)NC1=CC(=CC=C1)O Z31717082 [0,1,0,0,0,0|2,0,0]=3 246 B11R1.157 CC(=O)NC1=CC(=NC=C1)Cl Z1201619919 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.157 CC(=O)NC1=C[N+](=CC=C1)C Z56760720 [0,1,0,0,0,0|3,0,0]=4 248 B11R1.157 CC(=O)NC1=NC(=CC=C1)C Z183992496 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [0,1,0,0,0,0|2,0,1]=4 250 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [0,1,0,0,0,0|1,0,1]=3 254 B11R1.157 CC1=CC(=CC=C1)NC(=N)N Z979503154 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.157 CC1=CC(=CC=C1)NC(=S)N Z56921365 [0,1,0,0,0,0|2,1,0]=4 256 B11R1.157 CC1=CC(=CN=C1)CC(=O)O Z1889997399 [0,1,0,0,0,0|1,0,0]=2 257 B11R1.157 CN(C)CC1=CC(=CC=C1)N Z285162888 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.157 CS(=O)CC1=CC(=CC=C1)N Z802580778 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.157 C[N+]1=CC(=CC=C1)NC(=O)N Z56791760 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [0,1,0,0,0,0|2,0,0]=3 261 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.157 N=C(N)NC1=CC(=CC=C1)Cl Z979503082 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [0,1,0,0,0,0|1,0,0]=2 264 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [0,1,0,0,0,0|1,0,0]=2 265 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [0,1,0,0,0,0|1,0,0]=2 266 B11R1.157 NC(=O)NC1=CC(=CC=C1)Br Z198194688 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.157 NC(=O)NC1=CC(=CC=C1)Cl Z166687084 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.157 NC(=O)NC1=CC(=CC=C1)I Z198194890 [0,1,0,0,0,0|2,0,0]=3 269 B11R1.157 NC(=O)NC1=CC(=CC=C1)N Z235352405 [0,1,0,0,0,0|2,0,0]=3 270 B11R1.157 NC(=O)NC1=CC(=CC=C1)O Z335810106 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.157 NC(=S)NC1=CC(=CC=C1)Br Z111871258 [0,1,0,0,0,0|2,1,0]=4 272 B11R1.157 NC(=S)NC1=CC(=CC=C1)Cl Z199466968 [0,1,0,0,0,0|2,1,0]=4 273 B11R1.157 NC(=S)NC1=CC(=CC=C1)O Z199466960 [0,1,0,0,0,0|2,1,0]=4 274 B11R1.157 NC1=CC(=CC=C1)CC(=O)O Z992267406 [0,1,0,0,0,0|0,0,0]=1 275 B11R1.157 NC1=CC(=CC=C1)CC(F)F Z4075414750 [0,1,0,0,0,0|2,0,1]=4 276 B11R1.157 NC1=NC=CC(=C1)CC(=O)O Z1197888454 [0,1,0,0,0,0|1,0,0]=2 277 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br Z285131530 [0,1,0,0,0,0|0,0,0]=1 278 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [0,1,0,0,0,0|0,0,0]=1 279 B11R1.157 O=C(O)CC1=CC(=CC=C1)F Z104486030 [0,1,0,0,0,0|0,0,0]=1 280 B11R1.157 O=C(O)CC1=CC(=CC=C1)I Z1269113140 [0,1,0,0,0,0|0,0,0]=1 281 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [0,1,0,0,0,0|0,0,0]=1 282 B11R1.157 O=C(O)CC1=CC(=CN=C1)Br Z1269198419 [0,1,0,0,0,0|1,0,0]=2 283 B11R1.157 O=C(O)CC1=CC(=CN=C1)O Z1255437243 [0,1,0,0,0,0|1,0,0]=2 284 B11R1.157 O=C(O)CC1=CC(=NC=C1)O Z5003228420 [0,1,0,0,0,0|1,0,0]=2 285 B11R1.157 O=[N+]([O-])CC1=CC(=CC=C1)F Z2181775549 [0,1,0,0,0,0|1,0,1]=3 286 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 Z89268868 [0,1,0,0,0,0|1,0,1]=3 287 B11R1.509 NS(=O)(=O)CC1=CN=CC=C1 Z385450900 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.509 NS(=O)(=O)CC1=NC=CC=C1 Z385450902 [0,1,0,0,0,0|2,0,1]=4 289 B11R1.509 NS(=O)(=O)NC1=CC=CC=C1 Z1425690842 [0,1,0,0,0,0|2,0,1]=4 290 B11R1.509 NS(=O)(=O)OC1=CC=CC=C1 Z1255360895 [0,1,0,0,0,0|2,0,1]=4 291 B11R1.509 O=P(O)(O)CC1=CN=CC=C1 Z1255418137 [0,1,0,0,0,0|2,0,0]=3 292 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 Z190630174 [0,1,0,0,0,0|1,0,1]=3 293 B11R1.509 O=S(=O)(F)CC1=CC=NC=C1 Z3768480283 [0,1,0,0,0,0|2,0,1]=4 294 B11R1.509 O=S(=O)([O-])CC1=CC=CC=C1 Z3206129658 [0,1,0,0,0,0|1,0,1]=3 295 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 Z2309888982 [0,0,0,1,0,0|2,0,1]=4 296 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 Z2296167800 [0,0,0,1,0,0|2,0,1]=4 297 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 Z2517097696 [0,0,0,1,0,0|2,0,1]=4 298 B11R2.10 BrC1=NC2=C(O1)C=CC=C2 Z733303132 [0,0,0,1,0,0|2,0,0]=3 299 B11R2.10 BrC1=NC2=C(S1)C=CC=C2 Z415645026 [0,0,0,1,0,0|2,1,0]=4 300 B11R2.10 CC1=CC2=C(O1)C=CC=C2 Z1255386706 [0,0,0,1,0,0|1,0,1]=3 301 B11R2.10 CC1=NC2=C(N1)C=CC=C2 Z55692894 [0,0,0,1,0,0|3,0,0]=4 302 B11R2.10 CC1=NC2=C(S1)C=CC=C2 Z2854344256 [0,0,0,1,0,0|2,1,0]=4 303 B11R2.10 CC1CC2=C(N1)C=CC=C2 Z104472410 [0,0,0,1,0,0|2,0,1]=4 304 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [0,0,0,1,0,0|1,0,1]=3 305 B11R2.10 ClC1=NC2=C(N1)C=CC=C2 Z276129254 [0,0,0,1,0,0|3,0,0]=4 306 B11R2.10 ClC1=NC2=C(O1)C=CC=C2 Z235343929 [0,0,0,1,0,0|2,0,0]=3 307 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [0,0,0,1,0,0|2,0,0]=3 308 B11R2.10 NC1=NC2=C(N1)C=CC=C2 Z104378302 [0,0,0,1,0,0|3,0,0]=4 309 B11R2.10 NC1=NC2=C(O1)C=CC=C2 Z57069972 [0,0,0,1,0,0|2,0,0]=3 310 B11R2.10 NC1=NC2=C(O1)C=CC=N2 Z1198313417 [0,0,0,1,0,0|3,0,0]=4 311 B11R2.10 NC1=NC2=C(O1)C=CN=C2 Z1255498597 [0,0,0,1,0,0|3,0,0]=4 312 B11R2.10 NC1=NC2=C(O1)N=CC=C2 Z1255498595 [0,0,0,1,0,0|3,0,0]=4 313 B11R2.10 NC1=NC2=C(S1)C=CC=C2 Z56912586 [0,0,0,1,0,0|2,1,0]=4 314 B11R2.10 NC1CC2=C(C1)C=CC=C2 Z1741971562 [0,0,0,1,0,0|2,0,1]=4 315 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [0,0,0,1,0,0|1,0,0]=2 316 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [0,0,0,1,0,0|1,0,0]=2 317 B11R2.10 O=C1CC2=C(N1)C=CC=N2 Z1198159859 [0,0,0,1,0,0|2,0,0]=3 318 B11R2.10 O=C1NC2=C(N1)C=CC=C2 Z56924489 [0,0,0,1,0,0|2,0,0]=3 319 B11R2.10 O=C1NC2=C(O1)C=CC=C2 Z56854468 [0,0,0,1,0,0|1,0,0]=2 320 B11R2.10 O=C1NC2=C(O1)C=CN=C2 Z1509173044 [0,0,0,1,0,0|2,0,0]=3 321 B11R2.10 O=C1NC2=C(S1)C=CC=C2 Z57728688 [0,0,0,1,0,0|1,1,0]=3 322 B11R2.10 OC1=CN2C=CC=CC2=N1 Z3305157547 [0,0,0,1,0,0|2,0,1]=4 323 B11R2.10 OC1=NN2C=CC=CC2=C1 Z1198235676 [0,0,0,1,0,0|2,0,1]=4 324 B11R2.10 S=C1SC2=C(S1)C=CC=C2 Z1198152357 [0,0,0,1,0,0|1,2,0]=4 325 B11R2.10 SC1=NC2=C(N1)C=CC=C2 Z203045044 [0,0,0,1,0,0|2,1,0]=4 326 B11R2.10 SC1=NC2=C(O1)C=CC=C2 Z104499134 [0,0,0,1,0,0|1,1,0]=3 327 B11R2.10 SC1=NC2=C(O1)C=CC=N2 Z1201620735 [0,0,0,1,0,0|2,1,0]=4 328 B11R2.10 SC1=NC2=C(S1)C=CC=C2 Z104499140 [0,0,0,1,0,0|1,2,0]=4 329 B11R2.238 C1=CC=C(C=C1)CC2CO2 Z1020680006 [0,0,0,1,0,0|1,0,1]=3 330 B11R2.238 C1=CC=C(C=C1)C[C@@H]2CO2 Z1617991494 [0,0,0,1,0,0|1,0,1]=3 331 B11R2.238 C1=CC=C(C=C1)C[C@H]2CO2 Z2216712384 [0,0,0,1,0,0|1,0,1]=3 332 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [0,0,0,0,1,0|1,0,0]=2 333 B9R1.6 CC(=O)C1=CN=CC=C1 Z104474436 [0,0,0,0,1,0|2,0,0]=3 334 B9R1.6 CC(=O)C1=CN=CN=C1 Z992240312 [0,0,0,0,1,0|3,0,0]=4 335 B9R1.6 CC(=O)C1=NC=CC=C1 Z104474432 [0,0,0,0,1,0|2,0,0]=3 336 B9R1.6 CC(=O)C1=NC=CC=N1 Z513735982 [0,0,0,0,1,0|3,0,0]=4 337 B9R1.6 CC(=O)C1=NC=CN=C1 Z513735920 [0,0,0,0,1,0|3,0,0]=4 338 B9R1.6 CC(=O)C1=NN=CC=C1 Z1255432788 [0,0,0,0,1,0|3,0,0]=4 339 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [0,0,0,0,1,0|2,0,1]=4 340 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [0,0,0,0,1,0|1,0,1]=3 341 B9R1.6 CC(O)C1=CC=NC=C1 Z335245082 [0,0,0,0,1,0|2,0,1]=4 342 B9R1.6 CC(O)C1=CN=CC=C1 Z335245084 [0,0,0,0,1,0|2,0,1]=4 343 B9R1.6 CC(O)C1=NC=CC=C1 Z335244914 [0,0,0,0,1,0|2,0,1]=4 344 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [0,0,0,0,1,0|3,0,0]=4 345 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [0,0,0,0,1,0|2,0,1]=4 346 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [0,0,0,0,1,0|1,0,1]=3 347 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [0,0,0,0,1,0|2,0,1]=4 348 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [0,0,0,0,1,0|1,0,1]=3 349 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [0,0,0,0,1,0|2,0,0]=3 350 B9R1.6 N=C(N)C1=CC=NC=C1 Z444349574 [0,0,0,0,1,0|3,0,0]=4 351 B9R1.6 N=C(N)C1=CN=CC=C1 Z444349586 [0,0,0,0,1,0|3,0,0]=4 352 B9R1.6 N=C(N)C1=NC=CC=C1 Z540728738 [0,0,0,0,1,0|3,0,0]=4 353 B9R1.6 NC(=O)C1=CN=CC=C1 Z33546463 [0,0,0,0,1,0|2,0,0]=3 354 B9R1.6 NC(=O)C1=CN=NC=C1 Z1203579431 [0,0,0,0,1,0|3,0,0]=4 355 B9R1.6 NC(=O)C1=NC=CC=C1 Z33546380 [0,0,0,0,1,0|2,0,0]=3 356 B9R1.6 NC(=O)C1=NC=CC=N1 Z1198151945 [0,0,0,0,1,0|3,0,0]=4 357 B9R1.6 NC(=O)C1=NC=CN=C1 Z33546644 [0,0,0,0,1,0|3,0,0]=4 358 B9R1.6 NC(=O)C1=NC=NC=C1 Z1203579432 [0,0,0,0,1,0|3,0,0]=4 359 B9R1.6 NC(=O)C1=NN=CC=C1 Z1203580134 [0,0,0,0,1,0|3,0,0]=4 360 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [0,0,0,0,1,0|1,1,0]=3 361 B9R1.6 NC(=S)C1=CC=NC=C1 Z317055504 [0,0,0,0,1,0|2,1,0]=4 362 B9R1.6 NC(=S)C1=CN=CC=C1 Z56960184 [0,0,0,0,1,0|2,1,0]=4 363 B9R1.6 NC(=S)C1=NC=CC=C1 Z56956073 [0,0,0,0,1,0|2,1,0]=4 364 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [0,0,0,0,1,0|0,0,0]=1 365 B9R1.6 O=C(O)C1=CC=NC=C1 Z104473016 [0,0,0,0,1,0|1,0,0]=2 366 B9R1.6 O=C(O)C1=CN=CC=C1 Z56755709 [0,0,0,0,1,0|1,0,0]=2 367 B9R1.6 O=C(O)C1=CN=CN=C1 Z336079948 [0,0,0,0,1,0|2,0,0]=3 368 B9R1.6 O=C(O)C1=CN=NC=C1 Z1182328443 [0,0,0,0,1,0|2,0,0]=3 369 B9R1.6 O=C(O)C1=NC=CC=C1 Z57968195 [0,0,0,0,1,0|1,0,0]=2 370 B9R1.6 O=C(O)C1=NC=CC=N1 Z1259341107 [0,0,0,0,1,0|2,0,0]=3 371 B9R1.6 O=C(O)C1=NC=CN=C1 Z104476002 [0,0,0,0,1,0|2,0,0]=3 372 B9R1.6 O=C(O)C1=NC=NC=C1 Z57064900 [0,0,0,0,1,0|2,0,0]=3 373 B9R1.6 O=C(O)C1=NN=CC=C1 Z1201621268 [0,0,0,0,1,0|2,0,0]=3 374 B9R1.6 O=[N+]([O-])C1=NC=CC=C1 Z361899950 [0,0,0,0,1,0|2,0,1]=4 375 B9R1.6 O=[S-](=O)C1=CC=CC=C1 Z104501326 [0,0,0,0,1,0|1,0,1]=3 376 B9R1.6 OB(O)C1=CC=CC=C1 Z111782400 [0,0,0,0,1,0|1,0,1]=3 377 B9R1.6 OB(O)C1=CC=NC=C1 Z285038904 [0,0,0,0,1,0|2,0,1]=4 378 B9R1.6 OB(O)C1=CN=CC=C1 Z608482642 [0,0,0,0,1,0|2,0,1]=4 379 B9R1.13 CC(=O)NC1=CC=CS1 Z1198150448 [0,0,0,0,1,0|3,0,0]=4 380 B9R1.13 N=C(N)CC1=CC=CS1 Z1526503402 [0,0,0,0,1,0|3,0,0]=4 381 B9R1.13 NC(=O)CC1=CC=CN1 Z1203579730 [0,0,0,0,1,0|2,0,0]=3 382 B9R1.13 NC(=O)CN1C=CC=N1 Z234897385 [0,0,0,0,1,0|3,0,0]=4 383 B9R1.13 O=C(O)CC1=CC=CO1 Z1179936226 [0,0,0,0,1,0|1,0,0]=2 384 B9R1.13 O=C(O)CC1=CC=CS1 Z104473344 [0,0,0,0,1,0|1,0,0]=2 385 B9R1.13 O=C(O)CC1=CC=NO1 Z1205495543 [0,0,0,0,1,0|2,0,0]=3 386 B9R1.13 O=C(O)CC1=CN=CN1 Z2738358143 [0,0,0,0,1,0|2,0,0]=3 387 B9R1.13 O=C(O)CC1=CN=CS1 Z1198176810 [0,0,0,0,1,0|2,0,0]=3 388 B9R1.13 O=C(O)CC1=CN=NS1 Z1205495547 [0,0,0,0,1,0|3,0,0]=4 389 B9R1.13 O=C(O)CC1=CNC=C1 Z1154253211 [0,0,0,0,1,0|1,0,0]=2 390 B9R1.13 O=C(O)CC1=CNN=C1 Z2692248932 [0,0,0,0,1,0|2,0,0]=3 391 B9R1.13 O=C(O)CC1=COC=C1 Z1179936188 [0,0,0,0,1,0|1,0,0]=2 392 B9R1.13 O=C(O)CC1=CON=C1 Z600429584 [0,0,0,0,1,0|2,0,0]=3 393 B9R1.13 O=C(O)CC1=CSC=C1 Z56922167 [0,0,0,0,1,0|1,0,0]=2 394 B9R1.13 O=C(O)CC1=CSC=N1 Z800222640 [0,0,0,0,1,0|2,0,0]=3 395 B9R1.13 O=C(O)CC1=CSN=N1 Z1205495044 [0,0,0,0,1,0|3,0,0]=4 396 B9R1.13 O=C(O)CC1=NC=CN1 Z2189284070 [0,0,0,0,1,0|2,0,0]=3 397 B9R1.13 O=C(O)CC1=NN=CN1 Z2372279646 [0,0,0,0,1,0|3,0,0]=4 398 B9R1.13 O=C(O)CC1=NOC=C1 Z1198279888 [0,0,0,0,1,0|2,0,0]=3 399 B9R1.13 O=C(O)CC1=NSC=C1 Z1198313566 [0,0,0,0,1,0|2,0,0]=3 400 B9R1.13 O=C(O)CC1C=CCC1 Z104507506 [0,0,0,0,1,0|0,0,3]=4 401 B9R1.13 O=C(O)CN1C=CC=C1 Z245326698 [0,0,0,0,1,0|1,0,0]=2 402 B9R1.13 O=C(O)CN1C=CC=N1 Z166653130 [0,0,0,0,1,0|2,0,0]=3 403 B9R1.13 O=C(O)CN1C=CN=C1 Z57396183 [0,0,0,0,1,0|2,0,0]=3 404 B9R1.13 O=C(O)CN1C=CN=N1 Z1198163409 [0,0,0,0,1,0|3,0,0]=4 405 B9R1.13 O=C(O)CN1C=NC=N1 Z56931716 [0,0,0,0,1,0|3,0,0]=4 406 B9R1.13 O=C(O)CN1C=NN=C1 Z970090372 [0,0,0,0,1,0|3,0,0]=4 407 B9R1.13 O=C(O)CN1CC=CC1 Z4606609133 [0,0,0,0,1,0|1,0,2]=4 408 B9R1.13 O=C(O)CN1N=CC=N1 Z1198163410 [0,0,0,0,1,0|3,0,0]=4 409 B9R1.13 O=C([O-])CC1=NC=CS1 Z2472857693 [0,0,0,0,1,0|2,0,1]=4 410 B11R1.91 CC(=O)/C=C/C1=CC=CC=C1 Z2582847786 [0,0,0,0,0,1|1,0,1]=3 411 B11R1.91 CC(=O)/C=C/C1=NC=CC=C1 Z2004564056 [0,0,0,0,0,1|2,0,1]=4 412 B11R1.91 CC(=O)CSC1=CC=CC=C1 Z19751394 [0,0,0,0,0,1|1,0,0]=2 413 B11R1.91 CC(=O)NCC1=CC=CC=C1 Z27749489 [0,0,0,0,0,1|1,0,0]=2 414 B11R1.91 CC(=O)NCC1=NC=CC=C1 Z324553036 [0,0,0,0,0,1|2,0,0]=3 415 B11R1.91 CC(=O)NNC1=CC=CC=C1 Z27767717 [0,0,0,0,0,1|2,0,0]=3 416 B11R1.91 CC(=O)OCC1=CC=CC=C1 Z19628364 [0,0,0,0,0,1|1,0,0]=2 417 B11R1.91 CC(C)CNC1=CC=CC=C1 Z2092369729 [0,0,0,0,0,1|2,0,1]=4 418 B11R1.91 CC(N)CCC1=CC=CC=C1 Z104476462 [0,0,0,0,0,1|2,0,1]=4 419 B11R1.91 CC(N)COC1=CC=CC=C1 Z600397650 [0,0,0,0,0,1|2,0,1]=4 420 B11R1.91 CC(O)CNC1=CC=CC=C1 Z234898271 [0,0,0,0,0,1|1,0,1]=3 421 B11R1.91 CN(C)CCC1=CC=CC=C1 Z168912026 [0,0,0,0,0,1|3,0,0]=4 422 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Z5044990030 [0,0,0,0,0,1|2,0,1]=4 423 B11R1.91 FC(F)SCC1=CC=CC=C1 Z55626056 [0,0,0,0,0,1|2,0,1]=4 424 B11R1.91 N=C(N)CCC1=CC=CC=C1 Z2092176896 [0,0,0,0,0,1|2,0,0]=3 425 B11R1.91 N=C(N)COC1=CC=CC=C1 Z1532540938 [0,0,0,0,0,1|2,0,0]=3 426 B11R1.91 N=C(N)CSC1=CC=CC=C1 Z1532718998 [0,0,0,0,0,1|2,0,0]=3 427 B11R1.91 N=C(N)NCC1=CC=NC=C1 Z2723680409 [0,0,0,0,0,1|3,0,0]=4 428 B11R1.91 N=C(N)NCC1=NC=CC=C1 Z911465258 [0,0,0,0,0,1|3,0,0]=4 429 B11R1.91 N=C(N)SCC1=CC=CC=C1 Z89242849 [0,0,0,0,0,1|2,0,0]=3 430 B11R1.91 NC(=O)/C=C/C1=CN=CC=C1 Z284112150 [0,0,0,0,0,1|2,0,1]=4 431 B11R1.91 NC(=O)CCC1=CC=CC=C1 Z33546514 [0,0,0,0,0,1|1,0,0]=2 432 B11R1.91 NC(=O)CCC1=CC=NC=C1 Z1095213378 [0,0,0,0,0,1|2,0,0]=3 433 B11R1.91 NC(=O)CNC1=CC=CC=C1 Z104583968 [0,0,0,0,0,1|1,0,0]=2 434 B11R1.91 NC(=O)COC1=CC=CC=C1 Z19735702 [0,0,0,0,0,1|1,0,0]=2 435 B11R1.91 NC(=O)COC1=CN=CC=C1 Z336080090 [0,0,0,0,0,1|2,0,0]=3 436 B11R1.91 NC(=O)CSC1=CC=CC=C1 Z19751390 [0,0,0,0,0,1|1,0,0]=2 437 B11R1.91 NC(=O)CSC1=CC=NC=C1 Z33546963 [0,0,0,0,0,1|2,0,0]=3 438 B11R1.91 NC(=O)NCC1=CC=CC=C1 Z104476310 [0,0,0,0,0,1|1,0,0]=2 439 B11R1.91 NC(=O)NCC1=CC=NC=C1 Z198194796 [0,0,0,0,0,1|2,0,0]=3 440 B11R1.91 NC(=O)NCC1=CN=CC=C1 Z57664442 [0,0,0,0,0,1|2,0,0]=3 441 B11R1.91 NC(=O)NCC1=NC=CC=C1 Z198194794 [0,0,0,0,0,1|2,0,0]=3 442 B11R1.91 NC(=O)OCC1=CC=CC=C1 Z33547079 [0,0,0,0,0,1|1,0,0]=2 443 B11R1.91 NC(=S)CCC1=CC=CC=C1 Z56824950 [0,0,0,0,0,1|1,1,0]=3 444 B11R1.91 NC(=S)COC1=CC=CC=C1 Z108595128 [0,0,0,0,0,1|1,1,0]=3 445 B11R1.91 NC(=S)NCC1=CC=CC=C1 Z56900892 [0,0,0,0,0,1|1,1,0]=3 446 B11R1.91 NC(=S)NNC1=CC=CC=C1 Z104483868 [0,0,0,0,0,1|2,1,0]=4 447 B11R1.91 O=C(O)/C=C/C1=CC=CC=C1 Z104474406 [0,0,0,0,0,1|0,0,1]=2 448 B11R1.91 O=C(O)/C=C/C1=CC=NC=C1 Z2315575398 [0,0,0,0,0,1|1,0,1]=3 449 B11R1.91 O=C(O)/C=C/C1=CN=CC=C1 Z2315575379 [0,0,0,0,0,1|1,0,1]=3 450 B11R1.91 O=C(O)/C=C/C1=NC=CC=C1 Z57069085 [0,0,0,0,0,1|1,0,1]=3 451 B11R1.91 O=C(O)/C=C/C1=NC=CN=C1 Z445220894 [0,0,0,0,0,1|2,0,1]=4 452 B11R1.91 O=C(O)/C=C/C1=NC=NC=C1 Z1184882069 [0,0,0,0,0,1|2,0,1]=4 453 B11R1.91 O=C(O)C#CC1=CC=CC=C1 Z271128592 [0,0,0,0,0,1|0,0,1]=2 454 B11R1.91 O=C(O)CCC1=CC=CC=C1 Z57127332 [0,0,0,0,0,1|0,0,0]=1 455 B11R1.91 O=C(O)CCC1=CC=NC=C1 Z317037982 [0,0,0,0,0,1|1,0,0]=2 456 B11R1.91 O=C(O)CCC1=CN=CC=C1 Z89264892 [0,0,0,0,0,1|1,0,0]=2 457 B11R1.91 O=C(O)CCC1=CN=CN=C1 Z1198279878 [0,0,0,0,0,1|2,0,0]=3 458 B11R1.91 O=C(O)CCC1=NC=CC=C1 Z317037998 [0,0,0,0,0,1|1,0,0]=2 459 B11R1.91 O=C(O)CCC1=NC=CC=N1 Z1255372831 [0,0,0,0,0,1|2,0,0]=3 460 B11R1.91 O=C(O)CCC1=NC=CN=C1 Z1198184629 [0,0,0,0,0,1|2,0,0]=3 461 B11R1.91 O=C(O)CCC1=NC=NC=C1 Z1184882132 [0,0,0,0,0,1|2,0,0]=3 462 B11R1.91 O=C(O)CNC1=CC=CC=C1 Z104496210 [0,0,0,0,0,1|0,0,0]=1 463 B11R1.91 O=C(O)CNC1=CC=NC=C1 Z2350906909 [0,0,0,0,0,1|1,0,0]=2 464 B11R1.91 O=C(O)CNC1=CN=CC=C1 Z3058782338 [0,0,0,0,0,1|1,0,0]=2 465 B11R1.91 O=C(O)CNC1=NC=CC=C1 Z2470036492 [0,0,0,0,0,1|1,0,0]=2 466 B11R1.91 O=C(O)CNC1=NC=CC=N1 Z228588498 [0,0,0,0,0,1|2,0,0]=3 467 B11R1.91 O=C(O)COC1=CC=CC=C1 Z57182011 [0,0,0,0,0,1|0,0,0]=1 468 B11R1.91 O=C(O)COC1=CN=CC=C1 Z1171978878 [0,0,0,0,0,1|1,0,0]=2 469 B11R1.91 O=C(O)CSC1=CC=CC=C1 Z104484982 [0,0,0,0,0,1|0,0,0]=1 470 B11R1.91 O=C(O)CSC1=CC=NC=C1 Z104479390 [0,0,0,0,0,1|1,0,0]=2 471 B11R1.91 O=C(O)CSC1=NC=CC=C1 Z31205663 [0,0,0,0,0,1|1,0,0]=2 472 B11R1.91 O=C(O)CSC1=NC=CC=N1 Z31205664 [0,0,0,0,0,1|2,0,0]=3 473 B11R1.91 O=C([O-])COC1=NC=CC=C1 Z2989350877 [0,0,0,0,0,1|1,0,1]=3 474 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 Z995234780 [0,0,0,0,0,1|1,0,1]=3 475 B11R1.91 O=[N+]([O-])CSC1=CC=CC=C1 Z1255375331 [0,0,0,0,0,1|1,0,1]=3 476 B11R1.91 OB(O)/C=C/C1=CC=CC=C1 Z2315575087 [0,0,0,0,0,1|1,0,2]=4 477 B11R1.91 OB(O)CCC1=CC=CC=C1 Z1147227790 [0,0,0,0,0,1|1,0,1]=3 478 B8R1.2 C=CC1=CC=CC=C1 Z104474664 [2,0,0,0,0,0|0,0,1]=3 479 B8R1.2 C=CC1=NC=CC=C1 Z104495554 [2,0,0,0,0,0|1,0,1]=4 480 B8R1.2 CCC1=CC=CC=C1 Z104473632 [2,0,0,0,0,0|0,0,1]=3 481 B8R1.2 CCC1=CC=NC=C1 Z1251171246 [2,0,0,0,0,0|1,0,1]=4 482 B8R1.2 CCC1=CN=CC=C1 Z104476778 [2,0,0,0,0,0|1,0,1]=4 483 B8R1.2 CCC1=NC=CC=C1 Z113558650 [2,0,0,0,0,0|1,0,1]=4 484 B8R1.2 CNC1=CC=CC=C1 Z104472478 [2,0,0,0,0,0|1,0,1]=4 485 B8R1.2 COC1=CC=CC=C1 Z53833865 [2,0,0,0,0,0|1,0,1]=4 486 B8R1.2 Cl[Se]C1=CC=CC=C1 Z1255485131 [2,0,0,0,0,0|2,0,0]=4 487 B8R1.2 N#CC1=CC=CC=C1 Z104473628 [2,0,0,0,0,0|1,0,1]=4 488 B8R1.2 NCC1=CC=CC=C1 Z54748260 [2,0,0,0,0,0|1,0,0]=3 489 B8R1.2 NCC1=CC=NC=C1 Z104474354 [2,0,0,0,0,0|2,0,0]=4 490 B8R1.2 NCC1=CN=CC=C1 Z104474366 [2,0,0,0,0,0|2,0,0]=4 491 B8R1.2 NCC1=NC=CC=C1 Z104474352 [2,0,0,0,0,0|2,0,0]=4 492 B8R1.2 NNC1=CC=CC=C1 Z104472442 [2,0,0,0,0,0|2,0,0]=4 493 B8R1.2 O=CC1=CC=NC=C1 Z57161993 [2,0,0,0,0,0|1,0,0]=3 494 B8R1.2 O=CC1=CN=CC=C1 Z104472124 [2,0,0,0,0,0|1,0,0]=3 495 B8R1.2 O=CC1=CN=CN=C1 Z1013450426 [2,0,0,0,0,0|2,0,0]=4 496 B8R1.2 O=CC1=CN=NC=C1 Z1255435509 [2,0,0,0,0,0|2,0,0]=4 497 B8R1.2 O=CC1=NC=CC=C1 Z104472152 [2,0,0,0,0,0|1,0,0]=3 498 B8R1.2 O=CC1=NC=CN=C1 Z1013412214 [2,0,0,0,0,0|2,0,0]=4 499 B8R1.2 O=CC1=NN=CC=C1 Z1198165301 [2,0,0,0,0,0|2,0,0]=4 500 B8R1.2 OCC1=CC=CC=C1 Z104476418 [2,0,0,0,0,0|0,0,0]=2 501 B8R1.2 OCC1=CC=NC=C1 Z335244866 [2,0,0,0,0,0|1,0,0]=3 502 B8R1.2 OCC1=CN=CC=C1 Z104495622 [2,0,0,0,0,0|1,0,0]=3 503 B8R1.2 OCC1=NC=CC=C1 Z57921252 [2,0,0,0,0,0|1,0,0]=3 504 B10R1.1 CC1=CC=C(C=C1)/C=N/O Z49568558 [1,1,0,0,0,0|1,0,1]=4 505 B10R1.1 CC1=CC=C(C=C1)CC#N Z285131444 [1,1,0,0,0,0|1,0,1]=4 506 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [1,1,0,0,0,0|0,0,0]=2 507 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [1,1,0,0,0,0|1,0,1]=4 508 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [1,1,0,0,0,0|0,0,1]=3 509 B10R1.1 CCCC1=CC=C(C=C1)Br Z299596168 [1,1,0,0,0,0|1,0,1]=4 510 B10R1.1 CCCC1=CC=C(C=C1)N Z104492166 [1,1,0,0,0,0|1,0,1]=4 511 B10R1.1 CNCC1=CC=C(C=C1)Br Z56175269 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.1 CNCC1=CC=C(C=C1)Cl Z56956070 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.1 CNCC1=CC=C(C=C1)F Z56963340 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.1 CNCC1=CC=C(C=C1)I Z4242747560 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.1 COCC1=CC=C(C=C1)N Z240084568 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.1 CSCC1=CC=C(C=C1)Br Z19854469 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.1 CSCC1=CC=C(C=C1)N Z732207336 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.1 N#CCC1=CC=C(C=C1)F Z89283961 [1,1,0,0,0,0|1,0,1]=4 520 B10R1.1 N#CCC1=CC=C(C=C1)N Z90122117 [1,1,0,0,0,0|1,0,1]=4 521 B10R1.1 N#CCC1=CC=C(C=C1)O Z90120144 [1,1,0,0,0,0|1,0,1]=4 522 B10R1.1 NC1=CC=C(C=C1)CCO Z276600190 [1,1,0,0,0,0|0,0,1]=3 523 B10R1.1 NC1=CN=C(C=C1)CCO Z1898597735 [1,1,0,0,0,0|1,0,1]=4 524 B10R1.1 NCCC1=CC=C(C=C1)Br Z285143750 [1,1,0,0,0,0|1,0,1]=4 525 B10R1.1 NCCC1=CC=C(C=C1)Cl Z57051065 [1,1,0,0,0,0|1,0,1]=4 526 B10R1.1 NCCC1=CC=C(C=C1)F Z90122126 [1,1,0,0,0,0|1,0,1]=4 527 B10R1.1 NCCC1=CC=C(C=C1)I Z2515133713 [1,1,0,0,0,0|1,0,1]=4 528 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [1,1,0,0,0,0|1,0,1]=4 529 B10R1.1 NOCC1=CC=C(C=C1)Cl Z1198164677 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.1 O/N=C/C1=CC=C(C=C1)Br Z49568330 [1,1,0,0,0,0|1,0,1]=4 531 B10R1.1 O/N=C/C1=CC=C(C=C1)Cl Z49568332 [1,1,0,0,0,0|1,0,1]=4 532 B10R1.1 O/N=C/C1=CC=C(C=C1)F Z49568341 [1,1,0,0,0,0|1,0,1]=4 533 B10R1.1 O/N=C/C1=CC=C(C=C1)O Z49568314 [1,1,0,0,0,0|1,0,1]=4 534 B10R1.1 O=C=NC1=CC=C(C=C1)Br Z316172584 [1,1,0,0,0,0|1,0,1]=4 535 B10R1.1 O=C=NC1=CC=C(C=C1)Cl Z104472166 [1,1,0,0,0,0|1,0,1]=4 536 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [1,1,0,0,0,0|0,0,0]=2 537 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [1,1,0,0,0,0|0,0,0]=2 538 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [1,1,0,0,0,0|0,0,0]=2 539 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.1 OCCC1=CC=C(C=C1)Br Z397587340 [1,1,0,0,0,0|0,0,1]=3 541 B10R1.1 OCCC1=CC=C(C=C1)F Z397587326 [1,1,0,0,0,0|0,0,1]=3 542 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [1,1,0,0,0,0|0,0,1]=3 543 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [1,1,0,0,0,0|1,0,0]=3 544 B10R1.4 CC1=C(C=CC=C1)/C=N/O Z49568554 [1,1,0,0,0,0|1,0,1]=4 545 B10R1.4 CC1=C(C=CC=C1)CC#N Z57039593 [1,1,0,0,0,0|1,0,1]=4 546 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [1,1,0,0,0,0|0,0,0]=2 547 B10R1.4 CC1=C(C=CC=C1)CNN Z336481586 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.4 CC1=C(N=CC=C1)CCO Z1198169041 [1,1,0,0,0,0|1,0,1]=4 549 B10R1.4 CCCC1=C(C=CC=C1)Br Z1479686725 [1,1,0,0,0,0|1,0,1]=4 550 B10R1.4 CCCC1=C(C=CC=C1)I Z821158622 [1,1,0,0,0,0|1,0,1]=4 551 B10R1.4 CCCC1=C(C=CC=C1)N Z336087926 [1,1,0,0,0,0|1,0,1]=4 552 B10R1.4 CNCC1=C(C=CC=C1)C Z56948272 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.4 CNCC1=C(C=CC=C1)Cl Z56955956 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.4 CNCC1=C(C=CC=C1)F Z56953087 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.4 CNCC1=C(C=CC=C1)N Z764242576 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.4 CNCC1=C(C=CC=C1)O Z398513608 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.4 COCC1=C(C=CC=C1)I Z821093342 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.4 COCC1=C(C=CC=C1)O Z821093528 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.4 CSCC1=C(C=CC=C1)N Z732207148 [1,1,0,0,0,0|2,0,0]=4 560 B10R1.4 N#CCC1=C(C=CC=C1)Cl Z56904744 [1,1,0,0,0,0|1,0,1]=4 561 B10R1.4 N#CCC1=C(C=CC=C1)F Z104477228 [1,1,0,0,0,0|1,0,1]=4 562 B10R1.4 NC1=C(C=CC=C1)CCO Z3417485770 [1,1,0,0,0,0|0,0,1]=3 563 B10R1.4 NCCC1=C(C=CC=C1)Br Z295382782 [1,1,0,0,0,0|1,0,1]=4 564 B10R1.4 NCCC1=C(C=CC=C1)Cl Z285143744 [1,1,0,0,0,0|1,0,1]=4 565 B10R1.4 NCCC1=C(C=CC=C1)F Z57051087 [1,1,0,0,0,0|1,0,1]=4 566 B10R1.4 NCCC1=C(C=CC=C1)O Z594038184 [1,1,0,0,0,0|1,0,1]=4 567 B10R1.4 O/N=C/C1=C(C=CC=C1)Br Z49568618 [1,1,0,0,0,0|1,0,1]=4 568 B10R1.4 O/N=C/C1=C(C=CC=C1)F Z49568531 [1,1,0,0,0,0|1,0,1]=4 569 B10R1.4 O/N=C/C1=C(C=CC=C1)O Z49568319 [1,1,0,0,0,0|1,0,1]=4 570 B10R1.4 O=C1C=CC=CN1CCO Z234898059 [1,1,0,0,0,0|1,0,1]=4 571 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [1,1,0,0,0,0|0,0,0]=2 572 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [1,1,0,0,0,0|0,0,0]=2 573 B10R1.4 OCCC1=C(C=CC=C1)Br Z1183459188 [1,1,0,0,0,0|0,0,1]=3 574 B10R1.4 OCCC1=C(C=CC=C1)F Z397587382 [1,1,0,0,0,0|0,0,1]=3 575 B10R1.10 C=COC1=CC=CC(=C1)C Z1269547004 [1,1,0,0,0,0|2,0,0]=4 576 B10R1.10 CC1=CC(=CC=C1)CC#N Z285131450 [1,1,0,0,0,0|1,0,1]=4 577 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [1,1,0,0,0,0|1,0,1]=4 578 B10R1.10 CCCC1=CC(=CC=C1)Br Z1541586975 [1,1,0,0,0,0|1,0,1]=4 579 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.10 CNCC1=CC(=CC=C1)Cl Z56963343 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.10 CNCC1=CC(=CC=C1)F Z56946085 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.10 CNCC1=CC(=CC=C1)I Z3302798080 [1,1,0,0,0,0|2,0,0]=4 583 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.10 COCC1=CC(=CC=C1)N Z285163816 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [1,1,0,0,0,0|2,0,0]=4 586 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.10 N#CCC1=CC=CC(=C1)Cl Z57039594 [1,1,0,0,0,0|1,0,1]=4 589 B10R1.10 N#CCC1=CC=CC(=C1)F Z104477994 [1,1,0,0,0,0|1,0,1]=4 590 B10R1.10 N#CCC1=CC=CC(=C1)N Z90120426 [1,1,0,0,0,0|1,0,1]=4 591 B10R1.10 N#CCC1=CC=CC(=C1)O Z1198161712 [1,1,0,0,0,0|1,0,1]=4 592 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [1,1,0,0,0,0|0,0,1]=3 593 B10R1.10 NC1=CC(=CC=C1)NC=O Z1203578959 [1,1,0,0,0,0|1,0,0]=3 594 B10R1.10 NC1=NC=CC(=C1)CCO Z1197888440 [1,1,0,0,0,0|1,0,1]=4 595 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [1,1,0,0,0,0|1,0,1]=4 596 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [1,1,0,0,0,0|1,0,1]=4 597 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [1,1,0,0,0,0|1,0,1]=4 598 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [1,1,0,0,0,0|1,0,1]=4 599 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [1,1,0,0,0,0|1,0,1]=4 600 B10R1.10 NOCC1=CC(=CC=C1)Cl Z1198339567 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [1,1,0,0,0,0|0,0,0]=2 602 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [1,1,0,0,0,0|0,0,0]=2 603 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [1,1,0,0,0,0|1,0,0]=3 604 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [1,1,0,0,0,0|0,0,1]=3 605 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [1,1,0,0,0,0|0,0,1]=3 606 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [1,1,0,0,0,0|1,0,0]=3 607 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [1,1,0,0,0,0|0,0,0]=2 608 B10R1.15 CC(CBr)C1=CC=CC=C1 Z756118300 [1,1,0,0,0,0|1,0,1]=4 609 B10R1.15 CCC(N)C1=CC=CC=C1 Z1262252904 [1,1,0,0,0,0|1,0,1]=4 610 B10R1.15 CCC(O)C1=CC=CC=C1 Z335245178 [1,1,0,0,0,0|1,0,1]=4 611 B10R1.15 CN(N=O)C1=CC=CC=C1 Z87001980 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.15 CNC(C)C1=CC=CC=C1 Z85917524 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [1,1,0,0,0,0|1,0,1]=4 614 B10R1.15 N#CC(Br)C1=CC=CC=C1 Z1198157485 [1,1,0,0,0,0|1,0,1]=4 615 B10R1.15 N/C(=N\O)/C1=CC=CC=C1 Z56827052 [1,1,0,0,0,0|1,0,1]=4 616 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [1,1,0,0,0,0|0,0,1]=3 617 B10R1.15 NC(CO)C1=CN=CC=C1 Z2350903961 [1,1,0,0,0,0|1,0,1]=4 618 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [1,1,0,0,0,0|1,0,1]=4 619 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [1,1,0,0,0,0|1,0,1]=4 620 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [1,1,0,0,0,0|0,0,1]=3 621 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [1,1,0,0,0,0|0,0,1]=3 622 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [1,1,0,0,0,0|0,0,2]=4 623 B10R1.15 O=C(NO)C1=CC=CC=C1 Z56912029 [1,1,0,0,0,0|1,0,1]=4 624 B10R1.15 O=CC(=O)C1=CC=CC=C1 Z1954804411 [1,1,0,0,0,0|0,0,1]=3 625 B10R1.15 OCC(O)C1=CC=NC=C1 Z2736474279 [1,1,0,0,0,0|1,0,1]=4 626 B10R1.15 OCC(O)C1=NC=CC=C1 Z4985119178 [1,1,0,0,0,0|1,0,1]=4 627 B10R1.17 BrCCOC1=CC=CC=C1 Z56950513 [1,1,0,0,0,0|1,0,1]=4 628 B10R1.17 CCCCC1=CC=CC=C1 Z104492496 [1,1,0,0,0,0|1,0,1]=4 629 B10R1.17 CCNCC1=CC=CC=C1 Z57327176 [1,1,0,0,0,0|1,0,1]=4 630 B10R1.17 CNCCC1=CC=CC=C1 Z445226260 [1,1,0,0,0,0|1,0,1]=4 631 B10R1.17 COCCC1=CC=CC=C1 Z104494216 [1,1,0,0,0,0|0,0,1]=3 632 B10R1.17 N#CCCC1=CC=CC=C1 Z104507980 [1,1,0,0,0,0|1,0,1]=4 633 B10R1.17 N#CCNC1=CC=CC=C1 Z56347332 [1,1,0,0,0,0|1,0,1]=4 634 B10R1.17 N#CCOC1=CC=CC=C1 Z53792061 [1,1,0,0,0,0|1,0,1]=4 635 B10R1.17 N#CCSC1=CC=CC=C1 Z19751391 [1,1,0,0,0,0|1,0,1]=4 636 B10R1.17 NC/C=C/C1=CC=CC=C1 Z2953771905 [1,1,0,0,0,0|1,0,1]=4 637 B10R1.17 NCCCC1=CC=CC=C1 Z104478312 [1,1,0,0,0,0|1,0,1]=4 638 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [1,1,0,0,0,0|1,0,1]=4 639 B10R1.17 NCCSC1=CC=CC=C1 Z57970213 [1,1,0,0,0,0|1,0,1]=4 640 B10R1.17 NNCCC1=CC=CC=C1 Z927192062 [1,1,0,0,0,0|1,0,1]=4 641 B10R1.17 O=C/C=C/C1=CC=CC=C1 Z3219847383 [1,1,0,0,0,0|0,0,1]=3 642 B10R1.17 O=C/C=C/C1=CC=NC=C1 Z2417822722 [1,1,0,0,0,0|1,0,1]=4 643 B10R1.17 O=C/C=C/C1=NC=CC=C1 Z1255366309 [1,1,0,0,0,0|1,0,1]=4 644 B10R1.17 O=CC#CC1=CC=CC=C1 Z1255485337 [1,1,0,0,0,0|0,0,1]=3 645 B10R1.17 O=CCCC1=CC=CC=C1 Z87002472 [1,1,0,0,0,0|0,0,0]=2 646 B10R1.17 O=CCCC1=CC=NC=C1 Z1070006438 [1,1,0,0,0,0|1,0,0]=3 647 B10R1.17 O=CCCC1=CN=CC=C1 Z1198276578 [1,1,0,0,0,0|1,0,0]=3 648 B10R1.17 O=CCCC1=NC=CC=C1 Z1079158816 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.17 O=CCOC1=CC=CC=C1 Z854102570 [1,1,0,0,0,0|0,0,0]=2 650 B10R1.17 O=CCOC1=NC=CC=C1 Z1255434510 [1,1,0,0,0,0|1,0,0]=3 651 B10R1.17 O=CNCC1=CC=CC=C1 Z1203730748 [1,1,0,0,0,0|0,0,0]=2 652 B10R1.17 O=CNNC1=CC=CC=C1 Z1198148433 [1,1,0,0,0,0|1,0,0]=3 653 B10R1.17 OC/C=C/C1=CC=CC=C1 Z104473562 [1,1,0,0,0,0|0,0,1]=3 654 B10R1.17 OCCCC1=CC=CC=C1 Z104476660 [1,1,0,0,0,0|0,0,1]=3 655 B10R1.17 OCCCC1=CC=NC=C1 Z104475752 [1,1,0,0,0,0|1,0,1]=4 656 B10R1.17 OCCCC1=CN=CC=C1 Z104479004 [1,1,0,0,0,0|1,0,1]=4 657 B10R1.17 OCCNC1=CC=NC=C1 Z359301874 [1,1,0,0,0,0|1,0,1]=4 658 B10R1.17 OCCNC1=NC=CC=C1 Z31212159 [1,1,0,0,0,0|1,0,1]=4 659 B10R1.17 OCCOC1=CC=CC=C1 Z104473570 [1,1,0,0,0,0|0,0,1]=3 660 B10R1.17 OCCOC1=CN=CC=C1 Z1180078238 [1,1,0,0,0,0|1,0,1]=4 661 B10R1.17 OCCSC1=CC=CC=C1 Z149157348 [1,1,0,0,0,0|0,0,1]=3 662 B10R1.17 S=C=NCC1=CC=CC=C1 Z56869309 [1,1,0,0,0,0|0,1,1]=4 663 B10R1.13 CC(=O)C1=CC=C(C=C1)Br Z57127459 [0,1,0,0,1,0|1,0,0]=3 664 B10R1.13 CC(=O)C1=CC=C(C=C1)C Z57127458 [0,1,0,0,1,0|1,0,0]=3 665 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl Z57127462 [0,1,0,0,1,0|1,0,0]=3 666 B10R1.13 CC(=O)C1=CC=C(C=C1)F Z57127466 [0,1,0,0,1,0|1,0,0]=3 667 B10R1.13 CC(=O)C1=CC=C(C=C1)I Z57073725 [0,1,0,0,1,0|1,0,0]=3 668 B10R1.13 CC(=O)C1=CC=C(C=C1)N Z57127377 [0,1,0,0,1,0|1,0,0]=3 669 B10R1.13 CC(=O)C1=CC=C(C=C1)O Z57040434 [0,1,0,0,1,0|1,0,0]=3 670 B10R1.13 CC(=O)C1=CN=C(C=C1)Br Z1269224642 [0,1,0,0,1,0|2,0,0]=4 671 B10R1.13 CC(=O)C1=CN=C(C=C1)Cl Z1201622182 [0,1,0,0,1,0|2,0,0]=4 672 B10R1.13 CC(=O)C1=CN=C(C=C1)F Z1198173101 [0,1,0,0,1,0|2,0,0]=4 673 B10R1.13 CC(=O)C1=NC=C(C=C1)Br Z1945984212 [0,1,0,0,1,0|2,0,0]=4 674 B10R1.13 CC(=O)C1=NC=C(C=C1)Cl Z1198173098 [0,1,0,0,1,0|2,0,0]=4 675 B10R1.13 CC(=O)C1=NC=C(C=C1)F Z1575143877 [0,1,0,0,1,0|2,0,0]=4 676 B10R1.13 CC(O)C1=CC=C(C=C1)Br Z335244904 [0,1,0,0,1,0|1,0,1]=4 677 B10R1.13 CC(O)C1=CC=C(C=C1)Cl Z104479788 [0,1,0,0,1,0|1,0,1]=4 678 B10R1.13 CC(O)C1=CC=C(C=C1)F Z56347219 [0,1,0,0,1,0|1,0,1]=4 679 B10R1.13 CC(O)C1=CC=C(C=C1)I Z228586282 [0,1,0,0,1,0|1,0,1]=4 680 B10R1.13 CC1=CC=C(C=C1)B(O)O Z336079532 [0,1,0,0,1,0|1,0,1]=4 681 B10R1.13 CC1=CC=C(C=C1)C(=N)N Z1405445841 [0,1,0,0,1,0|2,0,0]=4 682 B10R1.13 CC1=CC=C(C=C1)C(=O)O Z57902424 [0,1,0,0,1,0|0,0,0]=2 683 B10R1.13 CC1=CC=C(C=C1)C(=S)N Z56939152 [0,1,0,0,1,0|1,1,0]=4 684 B10R1.13 CC1=CC=C(C=C1)[C@@H](C)O Z1127664396 [0,1,0,0,1,0|1,0,1]=4 685 B10R1.13 CC1=CC=C(C=C1)[C@H](C)O Z1127664278 [0,1,0,0,1,0|1,0,1]=4 686 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] Z104476692 [0,1,0,0,1,0|1,0,1]=4 687 B10R1.13 CC1=CC=C(C=C1)[S-](=O)=O Z104501328 [0,1,0,0,1,0|1,0,1]=4 688 B10R1.13 CC1=CN=C(C=C1)C(=O)O Z1511494596 [0,1,0,0,1,0|1,0,0]=3 689 B10R1.13 CC1=CN=C(N=C1)C(=O)O Z1198261922 [0,1,0,0,1,0|2,0,0]=4 690 B10R1.13 CC1=NC=C(C=C1)C(=O)N Z57493539 [0,1,0,0,1,0|2,0,0]=4 691 B10R1.13 CC1=NC=C(C=C1)C(=O)O Z235485476 [0,1,0,0,1,0|1,0,0]=3 692 B10R1.13 CC1=NC=C(N=C1)C(=O)O Z104478058 [0,1,0,0,1,0|2,0,0]=4 693 B10R1.13 CC1=NN=C(C=C1)C(=O)O Z1198232969 [0,1,0,0,1,0|2,0,0]=4 694 B10R1.13 CS(=O)C1=CC=C(C=C1)N Z609944508 [0,1,0,0,1,0|2,0,0]=4 695 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)Br Z850973968 [0,1,0,0,1,0|1,0,1]=4 696 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)I Z360055808 [0,1,0,0,1,0|1,0,1]=4 697 B10R1.13 C[C@H](O)C1=CC=C(C=C1)Br Z850973970 [0,1,0,0,1,0|1,0,1]=4 698 B10R1.13 C[C@H](O)C1=CC=C(C=C1)I Z360055806 [0,1,0,0,1,0|1,0,1]=4 699 B10R1.13 N=C(N)C1=CC=C(C=C1)Br Z1263602346 [0,1,0,0,1,0|2,0,0]=4 700 B10R1.13 N=C(N)C1=CC=C(C=C1)Cl Z56771179 [0,1,0,0,1,0|2,0,0]=4 701 B10R1.13 N=C(N)C1=CC=C(C=C1)F Z2289798423 [0,1,0,0,1,0|2,0,0]=4 702 B10R1.13 N=C(N)C1=CC=C(C=C1)I Z2574914411 [0,1,0,0,1,0|2,0,0]=4 703 B10R1.13 N=C(N)C1=CC=C(C=C1)O Z1262398570 [0,1,0,0,1,0|2,0,0]=4 704 B10R1.13 NC(=O)C1=CC=C(C=C1)Br Z33546526 [0,1,0,0,1,0|1,0,0]=3 705 B10R1.13 NC(=O)C1=CC=C(C=C1)F Z33546459 [0,1,0,0,1,0|1,0,0]=3 706 B10R1.13 NC(=O)C1=CC=C(C=C1)I Z33546486 [0,1,0,0,1,0|1,0,0]=3 707 B10R1.13 NC(=O)C1=CC=C(C=C1)N Z104474782 [0,1,0,0,1,0|1,0,0]=3 708 B10R1.13 NC(=O)C1=CC=C(C=C1)O Z104502228 [0,1,0,0,1,0|1,0,0]=3 709 B10R1.13 NC(=O)C1=CN=C(C=C1)Cl Z33546654 [0,1,0,0,1,0|2,0,0]=4 710 B10R1.13 NC(=O)C1=CN=C(C=C1)F Z1183725924 [0,1,0,0,1,0|2,0,0]=4 711 B10R1.13 NC(=O)C1=CN=C(C=C1)N Z959893184 [0,1,0,0,1,0|2,0,0]=4 712 B10R1.13 NC(=O)C1=CNC(=O)C=C1 Z220564282 [0,1,0,0,1,0|2,0,0]=4 713 B10R1.13 NC(=O)C1=NC=C(C=C1)Br Z1065600734 [0,1,0,0,1,0|2,0,0]=4 714 B10R1.13 NC(=O)C1=NC=C(C=C1)I Z1269145218 [0,1,0,0,1,0|2,0,0]=4 715 B10R1.13 NC(=O)C1=NC=C(C=C1)N Z1116403989 [0,1,0,0,1,0|2,0,0]=4 716 B10R1.13 NC(=S)C1=CC=C(C=C1)Br Z56964597 [0,1,0,0,1,0|1,1,0]=4 717 B10R1.13 NC(=S)C1=CC=C(C=C1)Cl Z57070431 [0,1,0,0,1,0|1,1,0]=4 718 B10R1.13 NC(=S)C1=CC=C(C=C1)N Z234895465 [0,1,0,0,1,0|1,1,0]=4 719 B10R1.13 NC(=S)C1=CC=C(C=C1)O Z90124534 [0,1,0,0,1,0|1,1,0]=4 720 B10R1.13 NC1=CC=C(C=C1)B(O)O Z1741970842 [0,1,0,0,1,0|1,0,1]=4 721 B10R1.13 NC1=CC=C(C=C1)C(=O)O Z57127446 [0,1,0,0,1,0|0,0,0]=2 722 B10R1.13 NC1=CC=C(C=C1)[N+](=O)[O-] Z275127984 [0,1,0,0,1,0|1,0,1]=4 723 B10R1.13 NC1=CN=C(C=C1)C(=O)O Z1649677869 [0,1,0,0,1,0|1,0,0]=3 724 B10R1.13 NC1=NC=C(C=C1)C(=O)O Z90122558 [0,1,0,0,1,0|1,0,0]=3 725 B10R1.13 NC1=NC=C(C=N1)C(=O)O Z274575484 [0,1,0,0,1,0|2,0,0]=4 726 B10R1.13 NC1=NN=C(C=C1)C(=O)O Z502337450 [0,1,0,0,1,0|2,0,0]=4 727 B10R1.13 O=C(Cl)C1=CN=C(C=C1)Cl Z1255461313 [0,1,0,0,1,0|2,0,0]=4 728 B10R1.13 O=C(F)C1=CN=C(C=C1)F Z2471610470 [0,1,0,0,1,0|2,0,0]=4 729 B10R1.13 O=C(O)C1=CC=C(C=C1)Br Z57127530 [0,1,0,0,1,0|0,0,0]=2 730 B10R1.13 O=C(O)C1=CC=C(C=C1)Cl Z104473324 [0,1,0,0,1,0|0,0,0]=2 731 B10R1.13 O=C(O)C1=CC=C(C=C1)F Z57367354 [0,1,0,0,1,0|0,0,0]=2 732 B10R1.13 O=C(O)C1=CC=C(C=C1)I Z57636572 [0,1,0,0,1,0|0,0,0]=2 733 B10R1.13 O=C(O)C1=CC=C(C=C1)O Z104498098 [0,1,0,0,1,0|0,0,0]=2 734 B10R1.13 O=C(O)C1=CC=C(C=C1)S Z223639246 [0,1,0,0,1,0|0,0,0]=2 735 B10R1.13 O=C(O)C1=CN=C(C=C1)Br Z1258919772 [0,1,0,0,1,0|1,0,0]=3 736 B10R1.13 O=C(O)C1=CN=C(C=C1)Cl Z104476110 [0,1,0,0,1,0|1,0,0]=3 737 B10R1.13 O=C(O)C1=CN=C(C=C1)F Z1182395505 [0,1,0,0,1,0|1,0,0]=3 738 B10R1.13 O=C(O)C1=CN=C(C=C1)O Z104500708 [0,1,0,0,1,0|1,0,0]=3 739 B10R1.13 O=C(O)C1=CN=C(N=C1)Br Z1721259410 [0,1,0,0,1,0|2,0,0]=4 740 B10R1.13 O=C(O)C1=CN=C(N=C1)Cl Z1143448915 [0,1,0,0,1,0|2,0,0]=4 741 B10R1.13 O=C(O)C1=CN=C(N=C1)S Z1255444934 [0,1,0,0,1,0|2,0,0]=4 742 B10R1.13 O=C(O)C1=NC=C(C=C1)Br Z972791012 [0,1,0,0,1,0|1,0,0]=3 743 B10R1.13 O=C(O)C1=NC=C(C=C1)Cl Z1201622823 [0,1,0,0,1,0|1,0,0]=3 744 B10R1.13 O=C(O)C1=NC=C(C=C1)I Z1069125846 [0,1,0,0,1,0|1,0,0]=3 745 B10R1.13 O=C(O)C1=NC=C(C=N1)F Z1255362185 [0,1,0,0,1,0|2,0,0]=4 746 B10R1.13 O=C(O)C1=NC=C(N=C1)Br Z1269171110 [0,1,0,0,1,0|2,0,0]=4 747 B10R1.13 O=C(O)C1=NC=C(N=C1)Cl Z1201624906 [0,1,0,0,1,0|2,0,0]=4 748 B10R1.13 O=C(O)C1=NN=C(C=C1)Br Z815272140 [0,1,0,0,1,0|2,0,0]=4 749 B10R1.13 O=C(O)C1=NN=C(C=C1)Cl Z589015292 [0,1,0,0,1,0|2,0,0]=4 750 B10R1.13 O=C1C=CC(=CO1)C(=O)O Z104472302 [0,1,0,0,1,0|1,0,0]=3 751 B10R1.13 O=C1C=CC(=NN1)C(=O)O Z56878668 [0,1,0,0,1,0|2,0,0]=4 752 B10R1.13 O=P(O)C1=CC=C(C=C1)Cl Z56798029 [0,1,0,0,1,0|1,0,0]=3 753 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)Br Z104474532 [0,1,0,0,1,0|1,0,1]=4 754 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)Cl Z104474568 [0,1,0,0,1,0|1,0,1]=4 755 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)I Z56924538 [0,1,0,0,1,0|1,0,1]=4 756 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)O Z57127483 [0,1,0,0,1,0|1,0,1]=4 757 B10R1.13 OB(O)C1=CC=C(C=C1)Br Z1169350731 [0,1,0,0,1,0|1,0,1]=4 758 B10R1.13 OB(O)C1=CC=C(C=C1)Cl Z295122658 [0,1,0,0,1,0|1,0,1]=4 759 B10R1.13 OB(O)C1=CC=C(C=C1)F Z381540956 [0,1,0,0,1,0|1,0,1]=4 760 B10R1.13 OB(O)C1=CC=C(C=C1)O Z336080006 [0,1,0,0,1,0|1,0,1]=4 761 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 Z45415554 [0,1,0,0,1,0|1,0,1]=4 762 B10R1.28 O=P(O)(O)C1=NC=CC=C1 Z1216814875 [0,1,0,0,1,0|2,0,0]=4 763 B10R1.28 O=S(=O)(F)C1=CC=CC=C1 Z1255364683 [0,1,0,0,1,0|1,0,1]=4 764 B10R1.28 O=S(=O)(O)C1=CN=CC=C1 Z104475570 [0,1,0,0,1,0|2,0,0]=4 765 B10R1.61 C=C(C)C1=C(C=CC=C1)Br Z1238836250 [0,1,0,0,1,0|2,0,0]=4 766 B10R1.61 CC(=O)C1=C(C=CC=C1)Br Z219997444 [0,1,0,0,1,0|1,0,0]=3 767 B10R1.61 CC(=O)C1=C(C=CC=C1)Cl Z104473116 [0,1,0,0,1,0|1,0,0]=3 768 B10R1.61 CC(=O)C1=C(C=CC=C1)F Z104475574 [0,1,0,0,1,0|1,0,0]=3 769 B10R1.61 CC(=O)C1=C(C=CC=C1)I Z1080378952 [0,1,0,0,1,0|1,0,0]=3 770 B10R1.61 CC(=O)C1=C(C=CC=C1)O Z57101014 [0,1,0,0,1,0|1,0,0]=3 771 B10R1.61 CC(=O)C1=C(C=CC=N1)O Z1198175942 [0,1,0,0,1,0|2,0,0]=4 772 B10R1.61 CC(=O)C1=C(C=CN=C1)C Z1198178359 [0,1,0,0,1,0|2,0,0]=4 773 B10R1.61 CC(=O)C1=C(C=CN=C1)N Z1192043585 [0,1,0,0,1,0|2,0,0]=4 774 B10R1.61 CC(=O)C1=C(C=NC=C1)O Z1255445560 [0,1,0,0,1,0|2,0,0]=4 775 B10R1.61 CC(=O)C1=C(N=CC=C1)Br Z1269140470 [0,1,0,0,1,0|2,0,0]=4 776 B10R1.61 CC(=O)C1=C(N=CC=C1)Cl Z1154360549 [0,1,0,0,1,0|2,0,0]=4 777 B10R1.61 CC(O)C1=C(C=CC=C1)Cl Z335244972 [0,1,0,0,1,0|1,0,1]=4 778 B10R1.61 CC(O)C1=C(C=CC=C1)N Z734526976 [0,1,0,0,1,0|1,0,1]=4 779 B10R1.61 CC1=C(C=CC=C1)B(O)O Z336079622 [0,1,0,0,1,0|1,0,1]=4 780 B10R1.61 CC1=C(C=CC=C1)C(=N)N Z1483957011 [0,1,0,0,1,0|2,0,0]=4 781 B10R1.61 CC1=C(C=CC=C1)C(=O)O Z104495626 [0,1,0,0,1,0|0,0,0]=2 782 B10R1.61 CC1=C(C=CC=C1)C(=S)N Z57046956 [0,1,0,0,1,0|1,1,0]=4 783 B10R1.61 CC1=C(C=CC=C1)C(C)O Z335245068 [0,1,0,0,1,0|1,0,1]=4 784 B10R1.61 CC1=C(C=CC=C1)[C@@H](C)O Z360055768 [0,1,0,0,1,0|1,0,1]=4 785 B10R1.61 CC1=C(C=CC=C1)[N+](=O)[O-] Z104473652 [0,1,0,0,1,0|1,0,1]=4 786 B10R1.61 CC1=C(C=CC=N1)C(=O)O Z1276602308 [0,1,0,0,1,0|1,0,0]=3 787 B10R1.61 CC1=C(C=CN=C1)C(=O)N Z1198162078 [0,1,0,0,1,0|2,0,0]=4 788 B10R1.61 CC1=C(C=CN=C1)C(=O)O Z1708090074 [0,1,0,0,1,0|1,0,0]=3 789 B10R1.61 CC1=C(C=CN=N1)C(=O)O Z1255447225 [0,1,0,0,1,0|2,0,0]=4 790 B10R1.61 CC1=C(C=NC=C1)C(=O)O Z199468010 [0,1,0,0,1,0|1,0,0]=3 791 B10R1.61 CC1=C(C=NC=N1)C(=O)O Z444878404 [0,1,0,0,1,0|2,0,0]=4 792 B10R1.61 CC1=C(C=NN=C1)C(=O)O Z4283386192 [0,1,0,0,1,0|2,0,0]=4 793 B10R1.61 CC1=C(N=CC=C1)C(=O)O Z976634736 [0,1,0,0,1,0|1,0,0]=3 794 B10R1.61 CC1=C(N=CC=N1)C(=O)O Z1205494130 [0,1,0,0,1,0|2,0,0]=4 795 B10R1.61 CC1=C(N=NC=C1)C(=O)O Z4426112684 [0,1,0,0,1,0|2,0,0]=4 796 B10R1.61 CS(=O)C1=C(C=CC=C1)N Z609980396 [0,1,0,0,1,0|2,0,0]=4 797 B10R1.61 C[C@@H](O)C1=C(C=CC=C1)Br Z1127664407 [0,1,0,0,1,0|1,0,1]=4 798 B10R1.61 C[C@@H](O)C1=C(C=CC=C1)Cl Z360055178 [0,1,0,0,1,0|1,0,1]=4 799 B10R1.61 C[C@H](O)C1=C(C=CC=C1)Br Z1127664292 [0,1,0,0,1,0|1,0,1]=4 800 B10R1.61 C[C@H](O)C1=C(C=CC=C1)Cl Z360055172 [0,1,0,0,1,0|1,0,1]=4 801 B10R1.61 N=C(N)C1=C(C=CC=C1)Br Z1266823189 [0,1,0,0,1,0|2,0,0]=4 802 B10R1.61 N=C(N)C1=C(C=CC=C1)Cl Z1695669929 [0,1,0,0,1,0|2,0,0]=4 803 B10R1.61 N=C(N)C1=C(C=CC=C1)F Z2442104317 [0,1,0,0,1,0|2,0,0]=4 804 B10R1.61 N=C(N)C1=C(C=CC=C1)N Z199055442 [0,1,0,0,1,0|2,0,0]=4 805 B10R1.61 N=C(N)C1=C(C=CC=C1)O Z1431002716 [0,1,0,0,1,0|2,0,0]=4 806 B10R1.61 NC(=O)C1=C(C=CC=C1)Cl Z33546379 [0,1,0,0,1,0|1,0,0]=3 807 B10R1.61 NC(=O)C1=C(C=CC=C1)F Z33546498 [0,1,0,0,1,0|1,0,0]=3 808 B10R1.61 NC(=O)C1=C(C=CC=C1)I Z33546623 [0,1,0,0,1,0|1,0,0]=3 809 B10R1.61 NC(=O)C1=C(C=CC=C1)N Z57036632 [0,1,0,0,1,0|1,0,0]=3 810 B10R1.61 NC(=O)C1=C(C=CC=C1)O Z68590124 [0,1,0,0,1,0|1,0,0]=3 811 B10R1.61 NC(=O)C1=C(C=CC=N1)N Z1083218598 [0,1,0,0,1,0|2,0,0]=4 812 B10R1.61 NC(=O)C1=C(C=CN=C1)Cl Z1198275382 [0,1,0,0,1,0|2,0,0]=4 813 B10R1.61 NC(=O)C1=C(C=CN=C1)O Z1198177193 [0,1,0,0,1,0|2,0,0]=4 814 B10R1.61 NC(=O)C1=C(C=NC=C1)Br Z1269114039 [0,1,0,0,1,0|2,0,0]=4 815 B10R1.61 NC(=O)C1=C(C=NC=C1)Cl Z1198237797 [0,1,0,0,1,0|2,0,0]=4 816 B10R1.61 NC(=O)C1=C(N=CC=C1)Cl Z33546502 [0,1,0,0,1,0|2,0,0]=4 817 B10R1.61 NC(=S)C1=C(C=CC=C1)N Z99601360 [0,1,0,0,1,0|1,1,0]=4 818 B10R1.61 NC1=C(C=CC=C1)B(O)O Z1201620794 [0,1,0,0,1,0|1,0,1]=4 819 B10R1.61 NC1=C(C=CC=C1)[N+](=O)[O-] Z56924541 [0,1,0,0,1,0|1,0,1]=4 820 B10R1.61 NC1=C(C=CC=N1)C(=O)O Z104475724 [0,1,0,0,1,0|1,0,0]=3 821 B10R1.61 NC1=C(C=CN=C1)C(=O)O Z414314668 [0,1,0,0,1,0|1,0,0]=3 822 B10R1.61 NC1=C(C=NC=C1)C(=O)O Z1167043563 [0,1,0,0,1,0|1,0,0]=3 823 B10R1.61 NC1=C(C=NC=N1)C(=O)O Z56755621 [0,1,0,0,1,0|2,0,0]=4 824 B10R1.61 NC1=C(N=CC=C1)C(=O)O Z1201619040 [0,1,0,0,1,0|1,0,0]=3 825 B10R1.61 NC1=C(N=CC=N1)C(=O)O Z56818526 [0,1,0,0,1,0|2,0,0]=4 826 B10R1.61 O=C(O)C1=C(C=CC=C1)Br Z57825381 [0,1,0,0,1,0|0,0,0]=2 827 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl Z57127537 [0,1,0,0,1,0|0,0,0]=2 828 B10R1.61 O=C(O)C1=C(C=CC=C1)F Z57914061 [0,1,0,0,1,0|0,0,0]=2 829 B10R1.61 O=C(O)C1=C(C=CC=C1)I Z57637028 [0,1,0,0,1,0|0,0,0]=2 830 B10R1.61 O=C(O)C1=C(C=CC=C1)O Z56757226 [0,1,0,0,1,0|0,0,0]=2 831 B10R1.61 O=C(O)C1=C(C=CC=C1)S Z104477754 [0,1,0,0,1,0|0,0,0]=2 832 B10R1.61 O=C(O)C1=C(C=CC=N1)Cl Z1203161828 [0,1,0,0,1,0|1,0,0]=3 833 B10R1.61 O=C(O)C1=C(C=CC=N1)O Z608353738 [0,1,0,0,1,0|1,0,0]=3 834 B10R1.61 O=C(O)C1=C(C=NC=C1)Br Z1238800040 [0,1,0,0,1,0|1,0,0]=3 835 B10R1.61 O=C(O)C1=C(C=NC=C1)Cl Z1255387391 [0,1,0,0,1,0|1,0,0]=3 836 B10R1.61 O=C(O)C1=C(C=NC=C1)F Z1270326283 [0,1,0,0,1,0|1,0,0]=3 837 B10R1.61 O=C(O)C1=C(C=NC=C1)I Z1269217659 [0,1,0,0,1,0|1,0,0]=3 838 B10R1.61 O=C(O)C1=C(C=NC=N1)Cl Z1198223598 [0,1,0,0,1,0|2,0,0]=4 839 B10R1.61 O=C(O)C1=C(N=CC=C1)Br Z926900218 [0,1,0,0,1,0|1,0,0]=3 840 B10R1.61 O=C(O)C1=C(N=CC=C1)Cl Z104474538 [0,1,0,0,1,0|1,0,0]=3 841 B10R1.61 O=C(O)C1=C(N=CC=C1)F Z1203161997 [0,1,0,0,1,0|1,0,0]=3 842 B10R1.61 O=C(O)C1=C(N=CC=C1)I Z1269167145 [0,1,0,0,1,0|1,0,0]=3 843 B10R1.61 O=C(O)C1=C(N=CC=C1)S Z203045100 [0,1,0,0,1,0|1,0,0]=3 844 B10R1.61 O=C(O)C1=C(N=CC=N1)Br Z1269173189 [0,1,0,0,1,0|2,0,0]=4 845 B10R1.61 O=C(O)C1=C(N=CC=N1)Cl Z1201620959 [0,1,0,0,1,0|2,0,0]=4 846 B10R1.61 O=C(O)C1=C(N=NC=C1)Cl Z1255436538 [0,1,0,0,1,0|2,0,0]=4 847 B10R1.61 O=C(O)C1=C(N=NC=C1)S Z1410944982 [0,1,0,0,1,0|2,0,0]=4 848 B10R1.61 O=C(O)C1=CC=CNC1=O Z57012260 [0,1,0,0,1,0|1,0,0]=3 849 B10R1.61 O=C(O)C1=CC=NNC1=O Z1198168921 [0,1,0,0,1,0|2,0,0]=4 850 B10R1.61 O=C(O)C1=CNC=CC1=O Z1869802012 [0,1,0,0,1,0|1,0,0]=3 851 B10R1.61 O=C(O)C1=CNC=NC1=O Z1350606493 [0,1,0,0,1,0|2,0,0]=4 852 B10R1.61 O=C(O)C1=CNN=CC1=O Z2510259337 [0,1,0,0,1,0|2,0,0]=4 853 B10R1.61 O=C(O)C1=NNC=CC1=O Z1205496521 [0,1,0,0,1,0|2,0,0]=4 854 B10R1.61 O=C(O)C1=[N+](C=CC=C1)[O-] Z147642478 [0,1,0,0,1,0|1,0,0]=3 855 B10R1.61 O=[N+]([O-])C1=C(C=CC=C1)Cl Z104473258 [0,1,0,0,1,0|1,0,1]=4 856 B10R1.61 O=[N+]([O-])C1=C(C=CC=C1)I Z56926515 [0,1,0,0,1,0|1,0,1]=4 857 B10R1.61 OB(O)C1=C(C=CC=C1)Br Z1269235915 [0,1,0,0,1,0|1,0,1]=4 858 B10R1.61 OB(O)C1=C(C=CC=C1)Cl Z381540900 [0,1,0,0,1,0|1,0,1]=4 859 B10R1.61 OB(O)C1=C(C=CC=C1)F Z381540942 [0,1,0,0,1,0|1,0,1]=4 860 B10R1.61 OB(O)C1=C(C=CC=C1)O Z1201620791 [0,1,0,0,1,0|1,0,1]=4 861 B10R1.113 C=C(C)C1=CC(=CC=C1)N Z1203585283 [0,1,0,0,1,0|2,0,0]=4 862 B10R1.113 CC(=O)C1=CC(=CC=C1)Br Z104472956 [0,1,0,0,1,0|1,0,0]=3 863 B10R1.113 CC(=O)C1=CC(=CC=C1)C Z104482920 [0,1,0,0,1,0|1,0,0]=3 864 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl Z104477350 [0,1,0,0,1,0|1,0,0]=3 865 B10R1.113 CC(=O)C1=CC(=CC=C1)N Z57127443 [0,1,0,0,1,0|1,0,0]=3 866 B10R1.113 CC(=O)C1=CC(=CN=C1)C Z1198331406 [0,1,0,0,1,0|2,0,0]=4 867 B10R1.113 CC(=O)C1=CC(=CN=C1)Cl Z1255491584 [0,1,0,0,1,0|2,0,0]=4 868 B10R1.113 CC(=O)C1=CC(=NC=C1)Br Z3234972143 [0,1,0,0,1,0|2,0,0]=4 869 B10R1.113 CC(=O)C1=CC(=NC=C1)Cl Z1201624144 [0,1,0,0,1,0|2,0,0]=4 870 B10R1.113 CC(=O)C1=CC(=NC=C1)F Z1198219263 [0,1,0,0,1,0|2,0,0]=4 871 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Z1216849381 [0,1,0,0,1,0|2,0,0]=4 872 B10R1.113 CC(=O)C1=NC(=CC=C1)Br Z1269164937 [0,1,0,0,1,0|2,0,0]=4 873 B10R1.113 CC(=O)C1=NC(=CC=C1)Cl Z1198173097 [0,1,0,0,1,0|2,0,0]=4 874 B10R1.113 CC(=O)C1=NC(=CC=C1)F Z1198219245 [0,1,0,0,1,0|2,0,0]=4 875 B10R1.113 CC(=O)C1=NC=CC(=C1)Br Z1269133346 [0,1,0,0,1,0|2,0,0]=4 876 B10R1.113 CC(O)C1=CC(=CC=C1)Cl Z335244960 [0,1,0,0,1,0|1,0,1]=4 877 B10R1.113 CC(O)C1=CC(=CC=C1)F Z335245218 [0,1,0,0,1,0|1,0,1]=4 878 B10R1.113 CC(O)C1=CC(=CC=C1)O Z335245176 [0,1,0,0,1,0|1,0,1]=4 879 B10R1.113 CC1=CC(=CC=C1)B(O)O Z336079540 [0,1,0,0,1,0|1,0,1]=4 880 B10R1.113 CC1=CC(=CC=C1)C(=N)N Z2471262589 [0,1,0,0,1,0|2,0,0]=4 881 B10R1.113 CC1=CC(=CC=C1)C(=O)N Z33546925 [0,1,0,0,1,0|1,0,0]=3 882 B10R1.113 CC1=CC(=CC=C1)C(=O)O Z57913535 [0,1,0,0,1,0|0,0,0]=2 883 B10R1.113 CC1=CC(=CC=C1)C(=S)N Z90122768 [0,1,0,0,1,0|1,1,0]=4 884 B10R1.113 CC1=CC(=CC=C1)[N+](=O)[O-] Z104508722 [0,1,0,0,1,0|1,0,1]=4 885 B10R1.113 CC1=CC(=CN=C1)C(=O)N Z1203579033 [0,1,0,0,1,0|2,0,0]=4 886 B10R1.113 CC1=CC(=CN=C1)C(=O)O Z825019000 [0,1,0,0,1,0|1,0,0]=3 887 B10R1.113 CC1=CC=CC(=C1)C(C)O Z445987122 [0,1,0,0,1,0|1,0,1]=4 888 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)O Z1127664487 [0,1,0,0,1,0|1,0,1]=4 889 B10R1.113 CC1=CC=CC(=C1)[C@H](C)O Z1127664373 [0,1,0,0,1,0|1,0,1]=4 890 B10R1.113 CC1=NC(=CC=C1)C(=O)N Z287485516 [0,1,0,0,1,0|2,0,0]=4 891 B10R1.113 CC1=NC(=CC=C1)C(=O)O Z278017928 [0,1,0,0,1,0|1,0,0]=3 892 B10R1.113 CC1=NC(=CC=N1)C(=O)O Z489806966 [0,1,0,0,1,0|2,0,0]=4 893 B10R1.113 CC1=NC=CC(=C1)C(=O)N Z1203579723 [0,1,0,0,1,0|2,0,0]=4 894 B10R1.113 CC1=NC=CC(=C1)C(=O)O Z1205493663 [0,1,0,0,1,0|1,0,0]=3 895 B10R1.113 CC1=NN=CC(=C1)C(=O)O Z1205496420 [0,1,0,0,1,0|2,0,0]=4 896 B10R1.113 CS(=O)C1=CC(=CC=C1)N Z609980392 [0,1,0,0,1,0|2,0,0]=4 897 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)Br Z803153182 [0,1,0,0,1,0|1,0,1]=4 898 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)Cl Z360055382 [0,1,0,0,1,0|1,0,1]=4 899 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)O Z959151708 [0,1,0,0,1,0|1,0,1]=4 900 B10R1.113 C[C@H](O)C1=CC(=CC=C1)Br Z803153180 [0,1,0,0,1,0|1,0,1]=4 901 B10R1.113 C[C@H](O)C1=CC(=CC=C1)Cl Z360055386 [0,1,0,0,1,0|1,0,1]=4 902 B10R1.113 C[C@H](O)C1=CC(=CC=C1)O Z959151706 [0,1,0,0,1,0|1,0,1]=4 903 B10R1.113 N=C(N)C1=CC(=CC=C1)Br Z1741973354 [0,1,0,0,1,0|2,0,0]=4 904 B10R1.113 N=C(N)C1=CC(=CC=C1)Cl Z1362754541 [0,1,0,0,1,0|2,0,0]=4 905 B10R1.113 N=C(N)C1=CC(=CC=C1)F Z1263714076 [0,1,0,0,1,0|2,0,0]=4 906 B10R1.113 N=C(N)C1=CC(=CC=C1)O Z1592024758 [0,1,0,0,1,0|2,0,0]=4 907 B10R1.113 NC(=O)C1=CC(=CC=C1)Br Z33546517 [0,1,0,0,1,0|1,0,0]=3 908 B10R1.113 NC(=O)C1=CC(=CC=C1)Cl Z33546479 [0,1,0,0,1,0|1,0,0]=3 909 B10R1.113 NC(=O)C1=CC(=CC=C1)I Z33546647 [0,1,0,0,1,0|1,0,0]=3 910 B10R1.113 NC(=O)C1=CC(=CC=C1)N Z118530082 [0,1,0,0,1,0|1,0,0]=3 911 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [0,1,0,0,1,0|1,0,0]=3 912 B10R1.113 NC(=O)C1=CC(=CC=C1)S Z1255359534 [0,1,0,0,1,0|1,0,0]=3 913 B10R1.113 NC(=O)C1=CC(=CN=C1)Br Z33546660 [0,1,0,0,1,0|2,0,0]=4 914 B10R1.113 NC(=O)C1=CC(=CN=C1)N Z1198184520 [0,1,0,0,1,0|2,0,0]=4 915 B10R1.113 NC(=O)C1=CC(=CN=C1)O Z1160905298 [0,1,0,0,1,0|2,0,0]=4 916 B10R1.113 NC(=O)C1=CC(=NC=C1)Br Z1269224952 [0,1,0,0,1,0|2,0,0]=4 917 B10R1.113 NC(=O)C1=CC(=NC=C1)Cl Z147129672 [0,1,0,0,1,0|2,0,0]=4 918 B10R1.113 NC(=O)C1=CC(=NC=C1)F Z802658956 [0,1,0,0,1,0|2,0,0]=4 919 B10R1.113 NC(=O)C1=CC(=NC=C1)N Z733874990 [0,1,0,0,1,0|2,0,0]=4 920 B10R1.113 NC(=O)C1=NC(=CC=C1)Br Z1116315117 [0,1,0,0,1,0|2,0,0]=4 921 B10R1.113 NC(=O)C1=NC(=CC=C1)Cl Z969100498 [0,1,0,0,1,0|2,0,0]=4 922 B10R1.113 NC(=O)C1=NC(=CC=C1)N Z969101552 [0,1,0,0,1,0|2,0,0]=4 923 B10R1.113 NC(=O)C1=NC=CC(=C1)N Z425851730 [0,1,0,0,1,0|2,0,0]=4 924 B10R1.113 NC(=S)C1=CC(=CC=C1)Br Z56985752 [0,1,0,0,1,0|1,1,0]=4 925 B10R1.113 NC(=S)C1=CC(=CC=C1)Cl Z56979368 [0,1,0,0,1,0|1,1,0]=4 926 B10R1.113 NC(=S)C1=CC(=CC=C1)F Z56979300 [0,1,0,0,1,0|1,1,0]=4 927 B10R1.113 NC1=CC(=CC=C1)B(O)O Z1201617111 [0,1,0,0,1,0|1,0,1]=4 928 B10R1.113 NC1=CC(=CC=C1)C(=O)O Z57127542 [0,1,0,0,1,0|0,0,0]=2 929 B10R1.113 NC1=CC(=CC=C1)[N+](=O)[O-] Z56924547 [0,1,0,0,1,0|1,0,1]=4 930 B10R1.113 NC1=CC(=CN=C1)C(=O)O Z1095353978 [0,1,0,0,1,0|1,0,0]=3 931 B10R1.113 NC1=CC(=NC=C1)C(=O)O Z381413014 [0,1,0,0,1,0|1,0,0]=3 932 B10R1.113 NC1=NC(=CC=C1)C(=O)O Z220336222 [0,1,0,0,1,0|1,0,0]=3 933 B10R1.113 NC1=NC(=CN=C1)C(=O)O Z1198277982 [0,1,0,0,1,0|2,0,0]=4 934 B10R1.113 O=C(Cl)C1=CC(=NC=C1)Cl Z1255450413 [0,1,0,0,1,0|2,0,0]=4 935 B10R1.113 O=C(Cl)C1=CC(=NC=C1)F Z1198320906 [0,1,0,0,1,0|2,0,0]=4 936 B10R1.113 O=C(O)C1=CC(=CC=C1)Br Z104475790 [0,1,0,0,1,0|0,0,0]=2 937 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [0,1,0,0,1,0|0,0,0]=2 938 B10R1.113 O=C(O)C1=CC(=CC=C1)F Z104477304 [0,1,0,0,1,0|0,0,0]=2 939 B10R1.113 O=C(O)C1=CC(=CC=C1)I Z56924537 [0,1,0,0,1,0|0,0,0]=2 940 B10R1.113 O=C(O)C1=CC(=CC=C1)O Z56919254 [0,1,0,0,1,0|0,0,0]=2 941 B10R1.113 O=C(O)C1=CC(=CC=C1)S Z1201630948 [0,1,0,0,1,0|0,0,0]=2 942 B10R1.113 O=C(O)C1=CC(=CN=C1)Br Z104476582 [0,1,0,0,1,0|1,0,0]=3 943 B10R1.113 O=C(O)C1=CC(=CN=C1)Cl Z972756276 [0,1,0,0,1,0|1,0,0]=3 944 B10R1.113 O=C(O)C1=CC(=CN=C1)F Z1192357288 [0,1,0,0,1,0|1,0,0]=3 945 B10R1.113 O=C(O)C1=CC(=CN=C1)O Z57124104 [0,1,0,0,1,0|1,0,0]=3 946 B10R1.113 O=C(O)C1=CC(=CN=C1)S Z2238935068 [0,1,0,0,1,0|1,0,0]=3 947 B10R1.113 O=C(O)C1=CC(=NC=C1)Br Z1259086653 [0,1,0,0,1,0|1,0,0]=3 948 B10R1.113 O=C(O)C1=CC(=NC=C1)Cl Z135302154 [0,1,0,0,1,0|1,0,0]=3 949 B10R1.113 O=C(O)C1=CC(=NC=C1)F Z234896331 [0,1,0,0,1,0|1,0,0]=3 950 B10R1.113 O=C(O)C1=CC(=NC=C1)S Z800150220 [0,1,0,0,1,0|1,0,0]=3 951 B10R1.113 O=C(O)C1=CC(=NN=C1)Br Z2311135201 [0,1,0,0,1,0|2,0,0]=4 952 B10R1.113 O=C(O)C1=CC(=NN=C1)Cl Z1255498382 [0,1,0,0,1,0|2,0,0]=4 953 B10R1.113 O=C(O)C1=C[N+](=CC=C1)[O-] Z104477974 [0,1,0,0,1,0|1,0,0]=3 954 B10R1.113 O=C(O)C1=NC(=CC=C1)Br Z415628156 [0,1,0,0,1,0|1,0,0]=3 955 B10R1.113 O=C(O)C1=NC(=CC=C1)Cl Z56771183 [0,1,0,0,1,0|1,0,0]=3 956 B10R1.113 O=C(O)C1=NC(=CC=C1)F Z1203162000 [0,1,0,0,1,0|1,0,0]=3 957 B10R1.113 O=C(O)C1=NC(=CC=N1)Br Z1269120600 [0,1,0,0,1,0|2,0,0]=4 958 B10R1.113 O=C(O)C1=NC(=CC=N1)Cl Z1198272423 [0,1,0,0,1,0|2,0,0]=4 959 B10R1.113 O=C(O)C1=NC(=CN=C1)Br Z1269117178 [0,1,0,0,1,0|2,0,0]=4 960 B10R1.113 O=C(O)C1=NC(=CN=C1)Cl Z1198155331 [0,1,0,0,1,0|2,0,0]=4 961 B10R1.113 O=C(O)C1=NC(=CN=C1)F Z1551922856 [0,1,0,0,1,0|2,0,0]=4 962 B10R1.113 O=C(O)C1=NC(=NC=C1)Br Z1429420892 [0,1,0,0,1,0|2,0,0]=4 963 B10R1.113 O=C(O)C1=NC(=NC=C1)Cl Z1201623752 [0,1,0,0,1,0|2,0,0]=4 964 B10R1.113 O=C(O)C1=NC=CC(=C1)Br Z802558860 [0,1,0,0,1,0|1,0,0]=3 965 B10R1.113 O=C(O)C1=NC=CC(=C1)Cl Z57990012 [0,1,0,0,1,0|1,0,0]=3 966 B10R1.113 O=C(O)C1=NC=CC(=C1)O Z385458378 [0,1,0,0,1,0|1,0,0]=3 967 B10R1.113 O=C1C=C(C=CN1)C(=O)O Z1416200909 [0,1,0,0,1,0|1,0,0]=3 968 B10R1.113 O=C1C=C(C=NN1)C(=O)O Z1198177386 [0,1,0,0,1,0|2,0,0]=4 969 B10R1.113 O=C1C=C(N=CN1)C(=O)O Z2689031648 [0,1,0,0,1,0|2,0,0]=4 970 B10R1.113 O=C1C=CC=C(N1)C(=O)O Z359371306 [0,1,0,0,1,0|1,0,0]=3 971 B10R1.113 O=C1C=CC=C(O1)C(=O)O Z1198151696 [0,1,0,0,1,0|1,0,0]=3 972 B10R1.113 O=C1C=NC=C(N1)C(=O)O Z1821397992 [0,1,0,0,1,0|2,0,0]=4 973 B10R1.113 O=[N+]([O-])C1=CC=CC(=C1)O Z57160187 [0,1,0,0,1,0|1,0,1]=4 974 B10R1.113 OB(O)C1=CC(=CC=C1)Br Z1269164934 [0,1,0,0,1,0|1,0,1]=4 975 B10R1.113 OB(O)C1=CC(=CC=C1)Cl Z381540932 [0,1,0,0,1,0|1,0,1]=4 976 B10R1.113 OB(O)C1=CC(=CC=C1)F Z381540934 [0,1,0,0,1,0|1,0,1]=4 977 B10R1.113 OB(O)C1=CC(=CC=C1)O Z336080002 [0,1,0,0,1,0|1,0,1]=4 978 B10R1.23 CC(C(=O)O)C1=CC=CO1 Z792377294 [0,1,0,0,1,0|1,0,0]=3 979 B10R1.23 CC(C(=O)O)C1=CC=NN1 Z4751117307 [0,1,0,0,1,0|2,0,0]=4 980 B10R1.23 CC(C(=O)O)C1=CSC=C1 Z954552432 [0,1,0,0,1,0|1,0,0]=3 981 B10R1.23 CC(C(=O)O)N1C=CC=C1 Z223656256 [0,1,0,0,1,0|1,0,0]=3 982 B10R1.23 CC(C(=O)O)N1C=CC=N1 Z406680018 [0,1,0,0,1,0|2,0,0]=4 983 B10R1.23 CC(C(=O)O)N1C=CN=C1 Z415636668 [0,1,0,0,1,0|2,0,0]=4 984 B10R1.23 NC(C(=O)O)C1=CC=CS1 Z803154920 [0,1,0,0,1,0|1,0,0]=3 985 B10R1.23 NC(C(=O)O)C1=CSC=C1 Z1696871277 [0,1,0,0,1,0|1,0,0]=3 986 B10R1.23 NC(C(=O)O)C1=CSC=N1 Z3699161008 [0,1,0,0,1,0|2,0,0]=4 987 B10R1.23 O=C(O)C(F)N1C=CC=N1 Z1438068862 [0,1,0,0,1,0|2,0,0]=4 988 B10R1.23 O=C(O)C(O)C1=CNC=N1 Z2301534488 [0,1,0,0,1,0|2,0,0]=4 989 B10R1.23 O=C(O)C(O)C1=CSC=C1 Z788000616 [0,1,0,0,1,0|1,0,0]=3 990 B10R1.27 CCC(=O)CC1=CC=CS1 Z734152558 [0,1,0,0,1,0|2,0,0]=4 991 B10R1.27 COC(=O)CC1=CC=NN1 Z1143220304 [0,1,0,0,1,0|2,0,0]=4 992 B10R1.27 COC(=O)CC1=COC=C1 Z1725236488 [0,1,0,0,1,0|1,0,0]=3 993 B10R1.27 COC(=O)CC1=NC=CS1 Z803104020 [0,1,0,0,1,0|2,0,0]=4 994 B10R1.27 COC(=O)CN1C=CC=C1 Z55893022 [0,1,0,0,1,0|1,0,0]=3 995 B10R1.27 COC(=O)CN1C=CC=N1 Z210298648 [0,1,0,0,1,0|2,0,0]=4 996 B10R1.27 COC(=O)CN1C=CN=C1 Z361892774 [0,1,0,0,1,0|2,0,0]=4 997 B10R1.27 NNC(=O)CC1=CC=CS1 Z58981810 [0,1,0,0,1,0|2,0,0]=4 998 B10R1.27 O=C(CCl)CC1=CSC=C1 Z1255405236 [0,1,0,0,1,0|2,0,0]=4 999 B10R1.54 CC1=CC(=NO1)CC(=O)O Z1194052187 [0,1,0,0,1,0|2,0,0]=4 1000 B10R1.54 CC1=CC=C(O1)CC(=O)O Z978942572 [0,1,0,0,1,0|1,0,0]=3 1001 B10R1.54 CC1=CC=C(S1)CC(=O)O Z362118824 [0,1,0,0,1,0|1,0,0]=3 1002 B10R1.54 CC1=CN(N=C1)CC(=O)O Z600430806 [0,1,0,0,1,0|2,0,0]=4 1003 B10R1.54 CC1=CNC(=N1)CC(=O)O Z5208005916 [0,1,0,0,1,0|2,0,0]=4 1004 B10R1.54 CC1=CSC(=C1)CC(=O)O Z1255506269 [0,1,0,0,1,0|1,0,0]=3 1005 B10R1.54 CC1=NC(=CN1)CC(=O)O Z3492410978 [0,1,0,0,1,0|2,0,0]=4 1006 B10R1.54 CC1=NC(=CO1)CC(=O)O Z1198274800 [0,1,0,0,1,0|2,0,0]=4 1007 B10R1.54 CC1=NC(=CS1)CC(=O)O Z56946867 [0,1,0,0,1,0|2,0,0]=4 1008 B10R1.54 CC1=NC=C(O1)CC(=O)O Z1416193674 [0,1,0,0,1,0|2,0,0]=4 1009 B10R1.54 CC1=NC=C(S1)CC(=O)O Z275210998 [0,1,0,0,1,0|2,0,0]=4 1010 B10R1.54 CC1=NN(C=C1)CC(=O)O Z2234185636 [0,1,0,0,1,0|2,0,0]=4 1011 B10R1.54 CC1=NNC(=C1)CC(=O)O Z856210714 [0,1,0,0,1,0|2,0,0]=4 1012 B10R1.54 CC1=NOC(=C1)CC(=O)O Z1205493696 [0,1,0,0,1,0|2,0,0]=4 1013 B10R1.54 CC1=NSC(=C1)CC(=O)O Z1262515715 [0,1,0,0,1,0|2,0,0]=4 1014 B10R1.54 CN1C=C(C=N1)CC(=O)O Z382816606 [0,1,0,0,1,0|2,0,0]=4 1015 B10R1.54 CN1C=C[N+](=C1)CC(=O)O Z1255365415 [0,1,0,0,1,0|2,0,0]=4 1016 B10R1.54 NC1=CN(N=C1)CC(=O)O Z801633548 [0,1,0,0,1,0|2,0,0]=4 1017 B10R1.54 NC1=NC(=CS1)CC(=O)O Z2692095061 [0,1,0,0,1,0|2,0,0]=4 1018 B10R1.54 NC1=NNC(=C1)CC(=O)O Z1198267216 [0,1,0,0,1,0|2,0,0]=4 1019 B10R1.54 O=C(O)CC1=CC=C(S1)Cl Z285575844 [0,1,0,0,1,0|1,0,0]=3 1020 B10R1.54 O=C(O)CC1=CSC(=N1)S Z1198174162 [0,1,0,0,1,0|2,0,0]=4 1021 B10R1.54 O=C(O)CN1C=C(C=N1)Br Z558496828 [0,1,0,0,1,0|2,0,0]=4 1022 B10R1.54 O=C(O)CN1C=C(C=N1)Cl Z729827274 [0,1,0,0,1,0|2,0,0]=4 1023 B10R1.54 O=C(O)CN1C=C(C=N1)I Z1227758254 [0,1,0,0,1,0|2,0,0]=4 1024 B10R1.64 CC1=C(N=CN1)CC(=O)O Z1945696029 [0,1,0,0,1,0|2,0,0]=4 1025 B10R1.64 CC1=C(N=CO1)CC(=O)O Z2732451980 [0,1,0,0,1,0|2,0,0]=4 1026 B10R1.64 CC1=C(SC=C1)CC(=O)O Z978942584 [0,1,0,0,1,0|1,0,0]=3 1027 B10R1.64 CC1=CON=C1CC(=O)O Z1889709884 [0,1,0,0,1,0|2,0,0]=4 1028 B10R1.64 CC1=NC=CN1CC(=O)O Z1171978830 [0,1,0,0,1,0|2,0,0]=4 1029 B10R1.64 CC1=NNC=C1CC(=O)O Z1198264426 [0,1,0,0,1,0|2,0,0]=4 1030 B10R1.64 CC1=NOC=C1CC(=O)O Z1416193675 [0,1,0,0,1,0|2,0,0]=4 1031 B10R1.64 CC1=NSC=C1CC(=O)O Z1262515716 [0,1,0,0,1,0|2,0,0]=4 1032 B10R1.64 CN1C=CN=C1CC(=O)O Z2293606708 [0,1,0,0,1,0|2,0,0]=4 1033 B10R1.64 CN1C=NC=C1CC(=O)O Z1741785912 [0,1,0,0,1,0|2,0,0]=4 1034 B10R1.64 CN1N=CC=C1CC(=O)O Z1183445905 [0,1,0,0,1,0|2,0,0]=4 1035 B10R1.64 NC1=CC=NN1CC(=O)O Z2893890229 [0,1,0,0,1,0|2,0,0]=4 1036 B10R1.64 O=C(O)CC1=C(C=CS1)Br Z854068742 [0,1,0,0,1,0|1,0,0]=3 1037 B10R1.64 O=C(O)CC1=C(C=NN1)Br Z4618691651 [0,1,0,0,1,0|2,0,0]=4 1038 B10R1.64 O=C(O)CC1=C(SC=C1)Br Z1416196048 [0,1,0,0,1,0|1,0,0]=3 1039 B10R1.64 O=C(O)CC1=CNNC1=O Z1198173451 [0,1,0,0,1,0|2,0,0]=4 1040 B10R1.64 O=C(O)CC1=CSC=C1F Z2311011512 [0,1,0,0,1,0|1,0,0]=3 1041 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)F Z1201619760 [0,1,0,0,0,1|1,0,1]=4 1042 B12R1.21 CC(=O)CCC1=CC=C(C=C1)C Z406376788 [0,1,0,0,0,1|1,0,0]=3 1043 B12R1.21 CC(=O)CCC1=CC=C(C=C1)F Z406376784 [0,1,0,0,0,1|1,0,0]=3 1044 B12R1.21 CC(=O)CCC1=CC=C(C=C1)I Z1263632422 [0,1,0,0,0,1|1,0,0]=3 1045 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Br Z816034502 [0,1,0,0,0,1|1,0,0]=3 1046 B12R1.21 CC(=O)NCC1=CC=C(C=C1)N Z600391558 [0,1,0,0,0,1|1,0,0]=3 1047 B12R1.21 CC(=O)NNC1=CC=C(C=C1)F Z30877183 [0,1,0,0,0,1|2,0,0]=4 1048 B12R1.21 CC(O)CCC1=CC=C(C=C1)O Z57921369 [0,1,0,0,0,1|1,0,1]=4 1049 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)O Z2942851512 [0,1,0,0,0,1|0,0,1]=3 1050 B12R1.21 CC1=CC=C(C=C1)CCC(=O)N Z194976512 [0,1,0,0,0,1|1,0,0]=3 1051 B12R1.21 CC1=CC=C(C=C1)CCC(=O)O Z169855336 [0,1,0,0,0,1|0,0,0]=2 1052 B12R1.21 CC1=CC=C(C=C1)CNC(=N)N Z911465430 [0,1,0,0,0,1|2,0,0]=4 1053 B12R1.21 CC1=CC=C(C=C1)CNC(=O)N Z198194838 [0,1,0,0,0,1|1,0,0]=3 1054 B12R1.21 CC1=CC=C(C=C1)CNC(=S)N Z56915894 [0,1,0,0,0,1|1,1,0]=4 1055 B12R1.21 CC1=CC=C(C=C1)OCC(=O)N Z19732046 [0,1,0,0,0,1|1,0,0]=3 1056 B12R1.21 CC1=CC=C(C=C1)OCC(=O)O Z56812739 [0,1,0,0,0,1|0,0,0]=2 1057 B12R1.21 CC1=CC=C(C=C1)OCC(=S)N Z295396970 [0,1,0,0,0,1|1,1,0]=4 1058 B12R1.21 CC1=CC=C(C=C1)SCC(=O)N Z18770000 [0,1,0,0,0,1|1,0,0]=3 1059 B12R1.21 CC1=CC=C(C=C1)SCC(=O)O Z55903478 [0,1,0,0,0,1|0,0,0]=2 1060 B12R1.21 CC1=CC=C(C=C1)SC[N+](=O)[O-] Z2026405117 [0,1,0,0,0,1|1,0,1]=4 1061 B12R1.21 CC1=CN=C(C=C1)/C=C/C(=O)O Z1816507718 [0,1,0,0,0,1|1,0,1]=4 1062 B12R1.21 CC1=NC=C(C=C1)/C=C/C(=O)O Z1815157396 [0,1,0,0,0,1|1,0,1]=4 1063 B12R1.21 CC1=NC=C(C=C1)CCC(=O)O Z2310699273 [0,1,0,0,0,1|1,0,0]=3 1064 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Br Z48820389 [0,1,0,0,0,1|2,0,0]=4 1065 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Cl Z48820386 [0,1,0,0,0,1|2,0,0]=4 1066 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)Br Z33545605 [0,1,0,0,0,1|1,0,1]=4 1067 B12R1.21 NC(=O)CCC1=CC=C(C=C1)F Z87614992 [0,1,0,0,0,1|1,0,0]=3 1068 B12R1.21 NC(=O)CCC1=CC=C(C=C1)N Z414316852 [0,1,0,0,0,1|1,0,0]=3 1069 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Br Z104586672 [0,1,0,0,0,1|1,0,0]=3 1070 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Cl Z104647358 [0,1,0,0,0,1|1,0,0]=3 1071 B12R1.21 NC(=O)CNC1=CC=C(C=C1)I Z104728120 [0,1,0,0,0,1|1,0,0]=3 1072 B12R1.21 NC(=O)COC1=CC=C(C=C1)Br Z19725712 [0,1,0,0,0,1|1,0,0]=3 1073 B12R1.21 NC(=O)COC1=CC=C(C=C1)F Z19734788 [0,1,0,0,0,1|1,0,0]=3 1074 B12R1.21 NC(=O)COC1=CC=C(C=C1)I Z25086979 [0,1,0,0,0,1|1,0,0]=3 1075 B12R1.21 NC(=O)COC1=CC=C(C=C1)N Z239127428 [0,1,0,0,0,1|1,0,0]=3 1076 B12R1.21 NC(=O)COC1=CC=C(C=C1)O Z381414726 [0,1,0,0,0,1|1,0,0]=3 1077 B12R1.21 NC(=O)CSC1=CC=C(C=C1)Br Z18744574 [0,1,0,0,0,1|1,0,0]=3 1078 B12R1.21 NC(=O)CSC1=CC=C(C=C1)F Z16034821 [0,1,0,0,0,1|1,0,0]=3 1079 B12R1.21 NC(=O)NCC1=CC=C(C=C1)F Z198194834 [0,1,0,0,0,1|1,0,0]=3 1080 B12R1.21 NC(=O)NCC1=CC=C(C=C1)N Z600391988 [0,1,0,0,0,1|1,0,0]=3 1081 B12R1.21 NC(=S)COC1=CC=C(C=C1)Cl Z295395122 [0,1,0,0,0,1|1,1,0]=4 1082 B12R1.21 NC(=S)NCC1=CC=C(C=C1)F Z111411726 [0,1,0,0,0,1|1,1,0]=4 1083 B12R1.21 NC1=CC=C(C=C1)/C=C/C(=O)O Z56762319 [0,1,0,0,0,1|0,0,1]=3 1084 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O Z336079452 [0,1,0,0,0,1|0,0,0]=2 1085 B12R1.21 NC1=CC=C(C=C1)OCC(=O)O Z3241275736 [0,1,0,0,0,1|0,0,0]=2 1086 B12R1.21 NC1=NC=C(C=C1)/C=C/C(=O)O Z1374884316 [0,1,0,0,0,1|1,0,1]=4 1087 B12R1.21 NC1=NC=C(C=C1)CCC(=O)O Z1255384430 [0,1,0,0,0,1|1,0,0]=3 1088 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Br Z2237493681 [0,1,0,0,0,1|0,0,1]=3 1089 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Cl Z56989206 [0,1,0,0,0,1|0,0,1]=3 1090 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)F Z2942851074 [0,1,0,0,0,1|0,0,1]=3 1091 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)O Z56911963 [0,1,0,0,0,1|0,0,1]=3 1092 B12R1.21 O=C(O)/C=C/C1=CN=C(C=C1)Cl Z1962225677 [0,1,0,0,0,1|1,0,1]=4 1093 B12R1.21 O=C(O)/C=C/C1=CN=C(C=C1)F Z2949503127 [0,1,0,0,0,1|1,0,1]=4 1094 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Br Z118438622 [0,1,0,0,0,1|0,0,0]=2 1095 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Cl Z178961272 [0,1,0,0,0,1|0,0,0]=2 1096 B12R1.21 O=C(O)CCC1=CC=C(C=C1)F Z89264973 [0,1,0,0,0,1|0,0,0]=2 1097 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O Z317038012 [0,1,0,0,0,1|0,0,0]=2 1098 B12R1.21 O=C(O)CCC1=CN=C(C=C1)Cl Z1695923041 [0,1,0,0,0,1|1,0,0]=3 1099 B12R1.21 O=C(O)CCC1=CNC(=O)C=C1 Z1889997460 [0,1,0,0,0,1|1,0,0]=3 1100 B12R1.21 O=C(O)CCC1=NC=C(C=C1)Br Z1269216724 [0,1,0,0,0,1|1,0,0]=3 1101 B12R1.21 O=C(O)CCC1=NC=C(C=N1)F Z1347205920 [0,1,0,0,0,1|2,0,0]=4 1102 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Br Z274534708 [0,1,0,0,0,1|0,0,0]=2 1103 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl Z274534702 [0,1,0,0,0,1|0,0,0]=2 1104 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O Z57127481 [0,1,0,0,0,1|0,0,0]=2 1105 B12R1.21 O=C(O)COC1=CC=C(C=C1)Br Z56812736 [0,1,0,0,0,1|0,0,0]=2 1106 B12R1.21 O=C(O)COC1=CC=C(C=C1)Cl Z57181989 [0,1,0,0,0,1|0,0,0]=2 1107 B12R1.21 O=C(O)COC1=CC=C(C=C1)F Z56978034 [0,1,0,0,0,1|0,0,0]=2 1108 B12R1.21 O=C(O)COC1=CC=C(C=C1)I Z56943814 [0,1,0,0,0,1|0,0,0]=2 1109 B12R1.21 O=C(O)COC1=CC=C(C=C1)O Z1192367471 [0,1,0,0,0,1|0,0,0]=2 1110 B12R1.21 O=C(O)COC1=NC=C(C=C1)Br Z1269227587 [0,1,0,0,0,1|1,0,0]=3 1111 B12R1.21 O=C(O)COC1=NC=C(C=C1)F Z1723875084 [0,1,0,0,0,1|1,0,0]=3 1112 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Br Z55903477 [0,1,0,0,0,1|0,0,0]=2 1113 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Cl Z55179956 [0,1,0,0,0,1|0,0,0]=2 1114 B12R1.21 O=C(O)CSC1=CC=C(C=C1)F Z55903650 [0,1,0,0,0,1|0,0,0]=2 1115 B12R1.21 O=C(O)CSC1=CC=C(C=C1)O Z733878444 [0,1,0,0,0,1|0,0,0]=2 1116 B12R1.21 O=C([O-])COC1=NC=C(C=C1)Cl Z3445335054 [0,1,0,0,0,1|1,0,1]=4 1117 B12R1.27 C#CC(=O)CCC1=CC=CC=C1 Z1266856412 [0,1,0,0,0,1|1,0,0]=3 1118 B12R1.27 C#CC(=O)NCC1=CC=CC=C1 Z1509142729 [0,1,0,0,0,1|1,0,0]=3 1119 B12R1.27 C#CC(=O)OCC1=CC=CC=C1 Z1255365960 [0,1,0,0,0,1|1,0,0]=3 1120 B12R1.27 C=C(C=O)OCC1=CC=CC=C1 Z1198183530 [0,1,0,0,0,1|1,0,0]=3 1121 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 Z56757233 [0,1,0,0,0,1|1,0,0]=3 1122 B12R1.27 CC(C=O)CCC1=CC=CC=C1 Z1238838034 [0,1,0,0,0,1|1,0,1]=4 1123 B12R1.27 CC(CO)COC1=CC=CC=C1 Z1255385347 [0,1,0,0,0,1|1,0,1]=4 1124 B12R1.27 CC(CO)OCC1=CC=CC=C1 Z1492906786 [0,1,0,0,0,1|1,0,1]=4 1125 B12R1.27 CCC(O)CNC1=CC=CC=C1 Z600449702 [0,1,0,0,0,1|1,0,1]=4 1126 B12R1.27 CN(CCC1=CC=CC=C1)N=O Z3965372830 [0,1,0,0,0,1|2,0,0]=4 1127 B12R1.27 CNC(=O)CCC1=CC=CC=C1 Z32016418 [0,1,0,0,0,1|1,0,0]=3 1128 B12R1.27 CNC(=O)COC1=CC=CC=C1 Z19735428 [0,1,0,0,0,1|1,0,0]=3 1129 B12R1.27 CNC(=O)CSC1=CC=CC=C1 Z19750829 [0,1,0,0,0,1|1,0,0]=3 1130 B12R1.27 CNC(=O)CSC1=NC=CC=C1 Z18886255 [0,1,0,0,0,1|2,0,0]=4 1131 B12R1.27 CNC(=O)OCC1=CC=CC=C1 Z32016983 [0,1,0,0,0,1|1,0,0]=3 1132 B12R1.27 COC(=O)/C=C/C1=CC=CC=C1 Z19782655 [0,1,0,0,0,1|0,0,1]=3 1133 B12R1.27 COC(=O)/C=C/C1=CC=NC=C1 Z3226989482 [0,1,0,0,0,1|1,0,1]=4 1134 B12R1.27 COC(=O)CCC1=CC=CC=C1 Z18264384 [0,1,0,0,0,1|0,0,0]=2 1135 B12R1.27 COC(=O)CCC1=CC=NC=C1 Z1198171999 [0,1,0,0,0,1|1,0,0]=3 1136 B12R1.27 COC(=O)CCC1=CN=CC=C1 Z1069406844 [0,1,0,0,0,1|1,0,0]=3 1137 B12R1.27 COC(=O)CCC1=CN=CN=C1 Z1551943962 [0,1,0,0,0,1|2,0,0]=4 1138 B12R1.27 COC(=O)CNC1=CC=CC=C1 Z1250132387 [0,1,0,0,0,1|0,0,0]=2 1139 B12R1.27 COC(=O)NNC1=CC=CC=C1 Z56755853 [0,1,0,0,0,1|1,0,0]=3 1140 B12R1.27 C[C@H](CO)NCC1=CC=CC=C1 Z823499606 [0,1,0,0,0,1|1,0,1]=4 1141 B12R1.27 N/C(=N\O)/CCC1=CC=CC=C1 Z285132818 [0,1,0,0,0,1|1,0,0]=3 1142 B12R1.27 N/C(=N\O)/COC1=CC=CC=C1 Z104341168 [0,1,0,0,0,1|1,0,0]=3 1143 B12R1.27 NCC(=O)CCC1=CC=CC=C1 Z3719299469 [0,1,0,0,0,1|1,0,0]=3 1144 B12R1.27 NCC(=O)NCC1=CC=CC=C1 Z398557160 [0,1,0,0,0,1|1,0,0]=3 1145 B12R1.27 NCC(=O)NCC1=CC=NC=C1 Z1262246178 [0,1,0,0,0,1|2,0,0]=4 1146 B12R1.27 NCC(=O)OCC1=CC=CC=C1 Z56904671 [0,1,0,0,0,1|1,0,0]=3 1147 B12R1.27 NCC(O)COC1=CC=CC=C1 Z271072310 [0,1,0,0,0,1|1,0,1]=4 1148 B12R1.27 NNC(=O)CNC1=CC=CC=C1 Z56886393 [0,1,0,0,0,1|1,0,0]=3 1149 B12R1.27 NNC(=S)NCC1=CC=CC=C1 Z56828396 [0,1,0,0,0,1|1,1,0]=4 1150 B12R1.27 O=C(CCl)CCC1=CC=CC=C1 Z1255432257 [0,1,0,0,0,1|1,0,0]=3 1151 B12R1.27 O=C(CCl)COC1=CC=CC=C1 Z1255416714 [0,1,0,0,0,1|1,0,0]=3 1152 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 Z56896328 [0,1,0,0,0,1|1,0,0]=3 1153 B12R1.27 O=C(CCl)NCC1=CN=CC=C1 Z1787158603 [0,1,0,0,0,1|2,0,0]=4 1154 B12R1.27 O=C(CCl)NCC1=NC=CC=C1 Z1954802789 [0,1,0,0,0,1|2,0,0]=4 1155 B12R1.27 O=C(CO)NCC1=CC=CC=C1 Z228585446 [0,1,0,0,0,1|0,0,0]=2 1156 B12R1.27 OC[C@H](O)COC1=CC=CC=C1 Z1201626370 [0,1,0,0,0,1|0,0,2]=4 1157 B12R1.43 C/C(=C\C1=CC=CC=C1)/C(=O)O Z2980228149 [0,1,0,0,0,1|0,0,1]=3 1158 B12R1.43 C/C(=C\C1=CC=NC=C1)/C(=O)O Z2466682039 [0,1,0,0,0,1|1,0,1]=4 1159 B12R1.43 C/C(=C\C1=CN=CC=C1)/C(=O)O Z2467131746 [0,1,0,0,0,1|1,0,1]=4 1160 B12R1.43 C/C(=C\C1=NC=CC=C1)/C(=O)O Z2467234655 [0,1,0,0,0,1|1,0,1]=4 1161 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 Z90124995 [0,1,0,0,0,1|1,0,0]=3 1162 B12R1.43 CC(=O)N(C)CC1=CN=CC=C1 Z27006526 [0,1,0,0,0,1|2,0,0]=4 1163 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O Z513624710 [0,1,0,0,0,1|0,0,0]=2 1164 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O Z3477804988 [0,1,0,0,0,1|1,0,0]=3 1165 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O Z57982184 [0,1,0,0,0,1|0,0,0]=2 1166 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O Z57825333 [0,1,0,0,0,1|0,0,0]=2 1167 B12R1.43 CC(OC1=CN=CC=C1)C(=O)O Z336080820 [0,1,0,0,0,1|1,0,0]=3 1168 B12R1.43 CC(OC1=NC=CC=C1)C(=O)O Z360507460 [0,1,0,0,0,1|1,0,0]=3 1169 B12R1.43 CC(SC1=CC=CC=C1)C(=O)N Z19751098 [0,1,0,0,0,1|1,0,0]=3 1170 B12R1.43 CC(SC1=CC=CC=C1)C(=O)O Z90122656 [0,1,0,0,0,1|0,0,0]=2 1171 B12R1.43 CC(SC1=NC=CC=C1)C(=O)N Z18886410 [0,1,0,0,0,1|2,0,0]=4 1172 B12R1.43 CC(SC1=NC=CC=C1)C(=O)O Z31250551 [0,1,0,0,0,1|1,0,0]=3 1173 B12R1.43 CC(SC1=NC=CC=N1)C(=O)O Z31250552 [0,1,0,0,0,1|2,0,0]=4 1174 B12R1.43 CN(CC1=CC=CC=C1)C(=O)N Z198194348 [0,1,0,0,0,1|1,0,0]=3 1175 B12R1.43 CN(CC1=CC=CC=C1)C(=S)N Z228582754 [0,1,0,0,0,1|1,1,0]=4 1176 B12R1.43 CN(CC1=NC=CC=C1)C(=O)N Z431977624 [0,1,0,0,0,1|2,0,0]=4 1177 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O Z1262510261 [0,1,0,0,0,1|0,0,0]=2 1178 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 Z317075516 [0,1,0,0,0,1|1,0,0]=3 1179 B12R1.43 NC(=O)C(N)CC1=NC=CC=C1 Z4981909244 [0,1,0,0,0,1|2,0,0]=4 1180 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 Z760046820 [0,1,0,0,0,1|1,0,0]=3 1181 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 Z933616656 [0,1,0,0,0,1|1,0,0]=3 1182 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O Z57127433 [0,1,0,0,0,1|0,0,0]=2 1183 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O Z1675026076 [0,1,0,0,0,1|1,0,0]=3 1184 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O Z3235906342 [0,1,0,0,0,1|1,0,0]=3 1185 B12R1.43 NC(CC1=CN=CN=C1)C(=O)O Z3697694105 [0,1,0,0,0,1|2,0,0]=4 1186 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O Z3235025558 [0,1,0,0,0,1|1,0,0]=3 1187 B12R1.43 NC(CC1=NC=CC=N1)C(=O)O Z2432992279 [0,1,0,0,0,1|2,0,0]=4 1188 B12R1.43 NC(CC1=NC=NC=C1)C(=O)O Z2470415568 [0,1,0,0,0,1|2,0,0]=4 1189 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O Z756430566 [0,1,0,0,0,1|0,0,0]=2 1190 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O Z933646062 [0,1,0,0,0,1|0,0,0]=2 1191 B12R1.43 O=C(O)/C(=C/C1=CN=CC=C1)/F Z2081677235 [0,1,0,0,0,1|1,0,1]=4 1192 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 Z285151774 [0,1,0,0,0,1|0,0,0]=2 1193 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 Z362848468 [0,1,0,0,0,1|0,0,1]=3 1194 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 Z788000648 [0,1,0,0,0,1|0,0,0]=2 1195 B12R1.43 O=C(O)C(O)CC1=NC=CC=C1 Z3486862716 [0,1,0,0,0,1|1,0,0]=3 1196 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 Z1255386695 [0,1,0,0,0,1|0,0,0]=2 1197 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 Z1255364914 [0,1,0,0,0,1|0,0,0]=2 1198 B12R1.107 C/C(=C\C(=O)O)/C1=CC=CC=C1 Z352748396 [0,1,0,0,0,1|0,0,1]=3 1199 B12R1.107 C/C(=C\C(=O)O)/C1=CC=NC=C1 Z352748124 [0,1,0,0,0,1|1,0,1]=4 1200 B12R1.107 C/C(=C\C(=O)O)/C1=CN=CC=C1 Z352748104 [0,1,0,0,0,1|1,0,1]=4 1201 B12R1.107 C=C(C)CC(N)C1=CC=CC=C1 Z4497189696 [0,1,0,0,0,1|2,0,0]=4 1202 B12R1.107 CC(=O)CC(=O)C1=CC=NC=C1 Z359504772 [0,1,0,0,0,1|2,0,0]=4 1203 B12R1.107 CC(=O)CC(=O)C1=CN=CC=C1 Z57157128 [0,1,0,0,0,1|2,0,0]=4 1204 B12R1.107 CC(CC(=O)N)C1=CC=CC=C1 Z33546734 [0,1,0,0,0,1|1,0,0]=3 1205 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 Z56899204 [0,1,0,0,0,1|0,0,0]=2 1206 B12R1.107 CC(CC(=O)O)C1=CC=NC=C1 Z352782496 [0,1,0,0,0,1|1,0,0]=3 1207 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 Z1089996260 [0,1,0,0,0,1|2,0,0]=4 1208 B12R1.107 CC(NC(=O)N)C1=CC=CC=C1 Z198194342 [0,1,0,0,0,1|1,0,0]=3 1209 B12R1.107 CC(NC(=S)N)C1=CC=CC=C1 Z56913099 [0,1,0,0,0,1|1,1,0]=4 1210 B12R1.107 CN(CC(=O)N)C1=CC=CC=C1 Z54747686 [0,1,0,0,0,1|1,0,0]=3 1211 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 Z1162448842 [0,1,0,0,0,1|0,0,0]=2 1212 B12R1.107 CN(CC(=O)O)C1=CC=NC=C1 Z317257814 [0,1,0,0,0,1|1,0,0]=3 1213 B12R1.107 CN(CC(=O)O)C1=NC=CC=N1 Z275027154 [0,1,0,0,0,1|2,0,0]=4 1214 B12R1.107 CN(CC(=O)O)C1=NC=CN=C1 Z275027150 [0,1,0,0,0,1|2,0,0]=4 1215 B12R1.107 CS(=O)CC(N)C1=CC=CC=C1 Z1238793494 [0,1,0,0,0,1|2,0,0]=4 1216 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 Z94601171 [0,1,0,0,0,1|0,0,0]=2 1217 B12R1.107 NC(CC(=O)O)C1=CC=NC=C1 Z317027344 [0,1,0,0,0,1|1,0,0]=3 1218 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 Z756925772 [0,1,0,0,0,1|0,0,0]=2 1219 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 Z1696091779 [0,1,0,0,0,1|0,0,0]=2 1220 B12R1.107 O=C(O)/C=C(\F)/C1=CN=CC=C1 Z4602486084 [0,1,0,0,0,1|1,0,1]=4 1221 B12R1.107 O=C(O)/C=C(\I)/C1=CC=CC=C1 Z3379426714 [0,1,0,0,0,1|0,0,1]=3 1222 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 Z982132010 [0,1,0,0,0,1|0,0,0]=2 1223 B12R1.107 O=C(O)NC(=O)C1=CC=CC=C1 Z56928966 [0,1,0,0,0,1|0,0,1]=3 1224 B12R1.125 C=C(C)CNC1=C(C=CC=C1)Br Z297649770 [0,1,0,0,0,1|2,0,0]=4 1225 B12R1.125 CC(=O)/C=C/C1=C(C=CC=C1)F Z1217226767 [0,1,0,0,0,1|1,0,1]=4 1226 B12R1.125 CC(=O)CCC1=C(C=CC=C1)F Z406376954 [0,1,0,0,0,1|1,0,0]=3 1227 B12R1.125 CC(=O)CSC1=C(C=CC=N1)F Z2275418544 [0,1,0,0,0,1|2,0,0]=4 1228 B12R1.125 CC(=O)NCC1=C(C=CC=C1)F Z29857733 [0,1,0,0,0,1|1,0,0]=3 1229 B12R1.125 CC(=O)NCC1=C(C=CC=C1)N Z3711224127 [0,1,0,0,0,1|1,0,0]=3 1230 B12R1.125 CC1=C(C=CC=C1)/C=C/C(=O)O Z2417574586 [0,1,0,0,0,1|0,0,1]=3 1231 B12R1.125 CC1=C(C=CC=C1)CCC(=O)O Z317037960 [0,1,0,0,0,1|0,0,0]=2 1232 B12R1.125 CC1=C(C=CC=C1)NCC(=O)N Z104590676 [0,1,0,0,0,1|1,0,0]=3 1233 B12R1.125 CC1=C(C=CC=C1)OCC(=N)N Z823287452 [0,1,0,0,0,1|2,0,0]=4 1234 B12R1.125 CC1=C(C=CC=C1)OCC(=O)N Z19733874 [0,1,0,0,0,1|1,0,0]=3 1235 B12R1.125 CC1=C(C=CC=C1)OCC(=O)O Z56820406 [0,1,0,0,0,1|0,0,0]=2 1236 B12R1.125 CC1=C(C=CC=C1)SCC(=O)O Z56870728 [0,1,0,0,0,1|0,0,0]=2 1237 B12R1.125 CC1=C(C=CC=N1)/C=C/C(=O)O Z2235790871 [0,1,0,0,0,1|1,0,1]=4 1238 B12R1.125 CC1=C(C=CC=N1)CCC(=O)O Z3213741164 [0,1,0,0,0,1|1,0,0]=3 1239 B12R1.125 CC1=C(C=CN=C1)/C=C/C(=O)O Z2235790666 [0,1,0,0,0,1|1,0,1]=4 1240 B12R1.125 CC1=C(N=CC=C1)/C=C/C(=O)O Z2327040014 [0,1,0,0,0,1|1,0,1]=4 1241 B12R1.125 CC1=C(N=CC=C1)CCC(=O)O Z1198279885 [0,1,0,0,0,1|1,0,0]=3 1242 B12R1.125 N=C(N)NCC1=C(C=CC=C1)F Z3034959360 [0,1,0,0,0,1|2,0,0]=4 1243 B12R1.125 N=C(N)SCC1=C(C=CC=C1)Cl Z48820396 [0,1,0,0,0,1|2,0,0]=4 1244 B12R1.125 NC(=O)CCC1=C(C=CC=C1)Br Z741559968 [0,1,0,0,0,1|1,0,0]=3 1245 B12R1.125 NC(=O)CCC1=C(C=CC=C1)N Z414316848 [0,1,0,0,0,1|1,0,0]=3 1246 B12R1.125 NC(=O)CCC1=C(C=CC=C1)O Z371352778 [0,1,0,0,0,1|1,0,0]=3 1247 B12R1.125 NC(=O)CNC1=C(C=CC=C1)Br Z137588472 [0,1,0,0,0,1|1,0,0]=3 1248 B12R1.125 NC(=O)CNC1=C(C=CC=C1)Cl Z104528166 [0,1,0,0,0,1|1,0,0]=3 1249 B12R1.125 NC(=O)CNC1=C(C=CC=C1)I Z133437412 [0,1,0,0,0,1|1,0,0]=3 1250 B12R1.125 NC(=O)COC1=C(C=CC=C1)Br Z17829253 [0,1,0,0,0,1|1,0,0]=3 1251 B12R1.125 NC(=O)COC1=C(C=CC=C1)Cl Z19726626 [0,1,0,0,0,1|1,0,0]=3 1252 B12R1.125 NC(=O)COC1=C(C=CC=C1)F Z19724798 [0,1,0,0,0,1|1,0,0]=3 1253 B12R1.125 NC(=O)COC1=C(C=CC=C1)I Z406416164 [0,1,0,0,0,1|1,0,0]=3 1254 B12R1.125 NC(=O)CSC1=C(C=CC=C1)Br Z149386624 [0,1,0,0,0,1|1,0,0]=3 1255 B12R1.125 NC(=O)CSC1=C(C=CC=C1)Cl Z18459622 [0,1,0,0,0,1|1,0,0]=3 1256 B12R1.125 NC(=O)CSC1=C(C=CC=C1)N Z57332466 [0,1,0,0,0,1|1,0,0]=3 1257 B12R1.125 NC(=O)NCC1=C(C=CC=C1)Cl Z198194806 [0,1,0,0,0,1|1,0,0]=3 1258 B12R1.125 NC(=O)NCC1=C(C=CC=C1)F Z198194842 [0,1,0,0,0,1|1,0,0]=3 1259 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)Br Z2315575361 [0,1,0,0,0,1|0,0,1]=3 1260 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)Cl Z57264035 [0,1,0,0,0,1|0,0,1]=3 1261 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)F Z2573655240 [0,1,0,0,0,1|0,0,1]=3 1262 B12R1.125 O=C(O)/C=C/C1=C(N=CC=C1)Br Z1269170340 [0,1,0,0,0,1|1,0,1]=4 1263 B12R1.125 O=C(O)/C=C/C1=C(N=CC=C1)Cl Z1201624228 [0,1,0,0,0,1|1,0,1]=4 1264 B12R1.125 O=C(O)CCC1=C(C=CC=C1)Br Z406704244 [0,1,0,0,0,1|0,0,0]=2 1265 B12R1.125 O=C(O)CCC1=C(C=CC=C1)Cl Z56943366 [0,1,0,0,0,1|0,0,0]=2 1266 B12R1.125 O=C(O)CCC1=C(C=CC=C1)F Z57991059 [0,1,0,0,0,1|0,0,0]=2 1267 B12R1.125 O=C(O)CCC1=C(C=CC=C1)O Z56347225 [0,1,0,0,0,1|0,0,0]=2 1268 B12R1.125 O=C(O)CCN1C=CC=CC1=O Z240085344 [0,1,0,0,0,1|1,0,0]=3 1269 B12R1.125 O=C(O)CCN1C=CC=NC1=O Z432066996 [0,1,0,0,0,1|2,0,0]=4 1270 B12R1.125 O=C(O)CCN1C=NC=CC1=O Z1154745726 [0,1,0,0,0,1|2,0,0]=4 1271 B12R1.125 O=C(O)CCN1N=CC=CC1=O Z1021422926 [0,1,0,0,0,1|2,0,0]=4 1272 B12R1.125 O=C(O)CNC1=C(C=CC=C1)Cl Z274534698 [0,1,0,0,0,1|0,0,0]=2 1273 B12R1.125 O=C(O)COC1=C(C=CC=C1)Br Z111834298 [0,1,0,0,0,1|0,0,0]=2 1274 B12R1.125 O=C(O)COC1=C(C=CC=C1)Cl Z57042068 [0,1,0,0,0,1|0,0,0]=2 1275 B12R1.125 O=C(O)COC1=C(C=CC=C1)F Z56823442 [0,1,0,0,0,1|0,0,0]=2 1276 B12R1.125 O=C(O)COC1=C(C=CC=C1)O Z56869464 [0,1,0,0,0,1|0,0,0]=2 1277 B12R1.125 O=C(O)CSC1=C(C=CC=C1)Br Z56827233 [0,1,0,0,0,1|0,0,0]=2 1278 B12R1.125 O=C(O)CSC1=C(C=CC=C1)Cl Z55903470 [0,1,0,0,0,1|0,0,0]=2 1279 B12R1.125 O=C(O)CSC1=C(C=CC=C1)F Z55903942 [0,1,0,0,0,1|0,0,0]=2 1280 B12R1.125 O=C(O)CSC1=C(C=CC=C1)O Z905204160 [0,1,0,0,0,1|0,0,0]=2 1281 B12R1.125 O=C(O)CSC1=[N+](C=CC=C1)[O-] Z55903473 [0,1,0,0,0,1|1,0,0]=3 1282 B12R1.226 CC(=O)CCC1=CC(=CC=C1)C Z406376778 [0,1,0,0,0,1|1,0,0]=3 1283 B12R1.226 CC(=O)CCC1=CC(=CC=C1)F Z406376716 [0,1,0,0,0,1|1,0,0]=3 1284 B12R1.226 CC(=O)NCC1=CC(=CC=C1)Br Z340632658 [0,1,0,0,0,1|1,0,0]=3 1285 B12R1.226 CC(=O)NCC1=CC(=CC=C1)F Z340527618 [0,1,0,0,0,1|1,0,0]=3 1286 B12R1.226 CC(=O)NNC1=CC(=CC=C1)C Z30552180 [0,1,0,0,0,1|2,0,0]=4 1287 B12R1.226 CC(O)COC1=CC(=CC=C1)F Z854226860 [0,1,0,0,0,1|1,0,1]=4 1288 B12R1.226 CC1=CC(=CC=C1)/C=C/C(=O)O Z2942851787 [0,1,0,0,0,1|0,0,1]=3 1289 B12R1.226 CC1=CC(=CC=C1)CCC(=O)N Z194976514 [0,1,0,0,0,1|1,0,0]=3 1290 B12R1.226 CC1=CC(=CC=C1)CCC(=O)O Z169993866 [0,1,0,0,0,1|0,0,0]=2 1291 B12R1.226 CC1=CC(=CC=C1)CNC(=S)N Z847147370 [0,1,0,0,0,1|1,1,0]=4 1292 B12R1.226 CC1=CC(=CC=C1)CSC(=N)N Z57992123 [0,1,0,0,0,1|2,0,0]=4 1293 B12R1.226 CC1=CC(=CC=C1)NCC(=O)N Z104589324 [0,1,0,0,0,1|1,0,0]=3 1294 B12R1.226 CC1=CC(=CC=C1)OCC(=O)N Z19732960 [0,1,0,0,0,1|1,0,0]=3 1295 B12R1.226 CC1=CC(=CC=C1)OCC(=O)O Z56899056 [0,1,0,0,0,1|0,0,0]=2 1296 B12R1.226 CC1=CC(=CC=C1)SCC(=O)O Z778642574 [0,1,0,0,0,1|0,0,0]=2 1297 B12R1.226 CC1=CC(=CN=C1)/C=C/C(=O)O Z1473962891 [0,1,0,0,0,1|1,0,1]=4 1298 B12R1.226 CC1=NC(=NC=C1)SCC(=O)O Z55903468 [0,1,0,0,0,1|2,0,0]=4 1299 B12R1.226 CC1=NC=NC(=C1)NCC(=O)O Z314662014 [0,1,0,0,0,1|2,0,0]=4 1300 B12R1.226 N=C(N)SCC1=CC(=CC=C1)F Z48820172 [0,1,0,0,0,1|2,0,0]=4 1301 B12R1.226 NC(=O)CCC1=CC(=CC=C1)N Z414316850 [0,1,0,0,0,1|1,0,0]=3 1302 B12R1.226 NC(=O)CNC1=CC(=CC=C1)Br Z104587998 [0,1,0,0,0,1|1,0,0]=3 1303 B12R1.226 NC(=O)CNC1=CC(=CC=C1)F Z104640682 [0,1,0,0,0,1|1,0,0]=3 1304 B12R1.226 NC(=O)COC1=CC(=CC=C1)F Z19755608 [0,1,0,0,0,1|1,0,0]=3 1305 B12R1.226 NC(=O)COC1=CC(=CC=C1)I Z25076202 [0,1,0,0,0,1|1,0,0]=3 1306 B12R1.226 NC(=O)COC1=CC(=CC=C1)N Z235344273 [0,1,0,0,0,1|1,0,0]=3 1307 B12R1.226 NC(=O)COC1=CC(=CC=C1)O Z381415558 [0,1,0,0,0,1|1,0,0]=3 1308 B12R1.226 NC(=O)NCC1=CC(=CC=C1)F Z362629554 [0,1,0,0,0,1|1,0,0]=3 1309 B12R1.226 NC1=CC(=CC=C1)/C=C/C(=O)O Z2942853438 [0,1,0,0,0,1|0,0,1]=3 1310 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)Br Z2312942093 [0,1,0,0,0,1|0,0,1]=3 1311 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)Cl Z2573655238 [0,1,0,0,0,1|0,0,1]=3 1312 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)F Z2935925467 [0,1,0,0,0,1|0,0,1]=3 1313 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)O Z247613734 [0,1,0,0,0,1|0,0,1]=3 1314 B12R1.226 O=C(O)/C=C/C1=CC(=CN=C1)F Z2587702979 [0,1,0,0,0,1|1,0,1]=4 1315 B12R1.226 O=C(O)/C=C/C1=CC(=CN=C1)O Z1518653071 [0,1,0,0,0,1|1,0,1]=4 1316 B12R1.226 O=C(O)/C=C/C1=CC(=NC=C1)Br Z1269228386 [0,1,0,0,0,1|1,0,1]=4 1317 B12R1.226 O=C(O)/C=C/C1=CC(=NC=C1)Cl Z1255503510 [0,1,0,0,0,1|1,0,1]=4 1318 B12R1.226 O=C(O)/C=C/C1=CC(=NC=C1)O Z2633787192 [0,1,0,0,0,1|1,0,1]=4 1319 B12R1.226 O=C(O)/C=C/C1=NC(=CC=C1)Cl Z1255503511 [0,1,0,0,0,1|1,0,1]=4 1320 B12R1.226 O=C(O)C#CC1=CC(=CC=C1)Cl Z1143242523 [0,1,0,0,0,1|0,0,1]=3 1321 B12R1.226 O=C(O)CCC1=CC(=CC=C1)Br Z56943439 [0,1,0,0,0,1|0,0,0]=2 1322 B12R1.226 O=C(O)CCC1=CC(=CC=C1)F Z185153196 [0,1,0,0,0,1|0,0,0]=2 1323 B12R1.226 O=C(O)CCC1=CC(=CC=C1)O Z317038038 [0,1,0,0,0,1|0,0,0]=2 1324 B12R1.226 O=C(O)CCC1=CC(=CN=C1)F Z1262517660 [0,1,0,0,0,1|1,0,0]=3 1325 B12R1.226 O=C(O)CCC1=CC(=CN=C1)O Z1504676734 [0,1,0,0,0,1|1,0,0]=3 1326 B12R1.226 O=C(O)CNC1=CC(=CC=C1)Cl Z274534700 [0,1,0,0,0,1|0,0,0]=2 1327 B12R1.226 O=C(O)COC1=CC(=CC=C1)Br Z56812737 [0,1,0,0,0,1|0,0,0]=2 1328 B12R1.226 O=C(O)COC1=CC(=CC=C1)Cl Z57008935 [0,1,0,0,0,1|0,0,0]=2 1329 B12R1.226 O=C(O)COC1=CC(=CN=C1)Br Z1206892989 [0,1,0,0,0,1|1,0,0]=3 1330 B12R1.226 O=C(O)COC1=NC(=CN=C1)Cl Z1262560152 [0,1,0,0,0,1|2,0,0]=4 1331 B12R1.226 O=C(O)CSC1=CC(=CC=C1)Br Z255149890 [0,1,0,0,0,1|0,0,0]=2 1332 B12R1.226 O=C(O)CSC1=CC(=CC=C1)Cl Z994465872 [0,1,0,0,0,1|0,0,0]=2 1333 B12R1.226 O=C(O)CSC1=CC(=CC=C1)F Z1198220671 [0,1,0,0,0,1|0,0,0]=2 1334 B12R1.226 O=C(O)CSC1=CC(=CC=C1)O Z1262555002 [0,1,0,0,0,1|0,0,0]=2 1335 B12R1.891 CC(C)(O)CCC1=CC=CC=C1 Z513713254 [0,1,0,0,0,1|1,0,1]=4 1336 B12R1.891 CC(C)(O)COC1=CC=CC=C1 Z600459798 [0,1,0,0,0,1|1,0,1]=4 1337 B12R1.891 CS(=O)(=O)NCC1=CC=CC=C1 Z53825161 [0,1,0,0,0,1|1,0,1]=4 1338 B12R1.891 NS(=O)(=O)CCC1=CC=CC=C1 Z57965898 [0,1,0,0,0,1|1,0,1]=4 1339 B12R1.891 NS(=O)(=O)NCC1=CC=CC=C1 Z300098430 [0,1,0,0,0,1|1,0,1]=4 1340 B12R1.891 O=S(=O)(F)CCC1=CC=CC=C1 Z1258763618 [0,1,0,0,0,1|1,0,1]=4 1341 B12R1.4 C#CC1=CC=C(C=C1)NC(=O)C Z1509142033 [0,2,0,0,0,0|2,0,0]=4 1342 B12R1.4 CC(=O)NC1=CC=C(C=C1)C#N Z30612220 [0,2,0,0,0,0|2,0,0]=4 1343 B12R1.4 CC(=O)NC1=CC=C(C=C1)C=O Z104472864 [0,2,0,0,0,0|2,0,0]=4 1344 B12R1.4 CC(=O)NC1=CC=C(C=C1)CN Z235336571 [0,2,0,0,0,0|2,0,0]=4 1345 B12R1.4 CC(=O)NC1=CC=C(C=C1)CO Z228585230 [0,2,0,0,0,0|2,0,0]=4 1346 B12R1.4 CC(=O)OC1=CC=C(C=C1)C=O Z57887890 [0,2,0,0,0,0|2,0,0]=4 1347 B12R1.4 CC(=O)OC1=CC=C(C=C1)CCl Z1255365081 [0,2,0,0,0,0|2,0,0]=4 1348 B12R1.4 CC(=O)OC1=CC=C(C=C1)CN Z2216303143 [0,2,0,0,0,0|2,0,0]=4 1349 B12R1.4 CC(O)CC1=CC=C(C=C1)C=O Z1511913303 [0,2,0,0,0,0|1,0,1]=4 1350 B12R1.4 CCC1=CC=C(C=C1)CC(=O)O Z274782844 [0,2,0,0,0,0|0,0,0]=2 1351 B12R1.4 CCC1=CC=C(C=C1)NC(=O)C Z30917832 [0,2,0,0,0,0|2,0,0]=4 1352 B12R1.4 CNC1=CC=C(C=C1)NC(=O)C Z335252368 [0,2,0,0,0,0|2,0,0]=4 1353 B12R1.4 COC1=CC=C(C=C1)CC(=O)N Z33546648 [0,2,0,0,0,0|1,0,0]=3 1354 B12R1.4 COC1=CC=C(C=C1)CC(=O)O Z104476074 [0,2,0,0,0,0|0,0,0]=2 1355 B12R1.4 COC1=CC=C(C=C1)CC(C)O Z228586162 [0,2,0,0,0,0|1,0,1]=4 1356 B12R1.4 COC1=CC=C(C=C1)NC(=O)C Z28138902 [0,2,0,0,0,0|2,0,0]=4 1357 B12R1.4 COC1=CC=C(C=C1)NC(=O)N Z56754681 [0,2,0,0,0,0|2,0,0]=4 1358 B12R1.4 COC1=CC=C(C=C1)OC(=O)C Z30195429 [0,2,0,0,0,0|2,0,0]=4 1359 B12R1.4 COC1=CN=C(C=C1)CC(=O)O Z1913661249 [0,2,0,0,0,0|1,0,0]=3 1360 B12R1.4 COC1=NC=C(C=C1)CC(=O)C Z1216822629 [0,2,0,0,0,0|2,0,0]=4 1361 B12R1.4 CSC1=CC=C(C=C1)CC(=O)O Z1212966448 [0,2,0,0,0,0|0,0,0]=2 1362 B12R1.4 CSC1=CC=C(C=C1)NC(=O)C Z25066204 [0,2,0,0,0,0|2,0,0]=4 1363 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)N Z982774006 [0,2,0,0,0,0|1,0,0]=3 1364 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)O Z362118788 [0,2,0,0,0,0|0,0,0]=2 1365 B12R1.4 N#CC1=CC=C(C=C1)NC(=O)N Z220331754 [0,2,0,0,0,0|2,0,0]=4 1366 B12R1.4 N#CC1=NC=C(C=C1)CC(=O)O Z1255406002 [0,2,0,0,0,0|1,0,0]=3 1367 B12R1.4 NCC1=CC=C(C=C1)NC(=O)N Z228589054 [0,2,0,0,0,0|2,0,0]=4 1368 B12R1.4 NCC1=NC=C(C=C1)CC(=O)O Z5090941730 [0,2,0,0,0,0|1,0,0]=3 1369 B12R1.4 O=CC1=CC=C(C=C1)CC(=O)O Z1198269767 [0,2,0,0,0,0|0,0,0]=2 1370 B12R1.19 CC(=O)CC1=CC(=C(C=C1)Br)F Z1269186824 [0,2,0,0,0,0|1,0,0]=3 1371 B12R1.19 CC(=O)CC1=CC(=C(C=C1)O)Br Z1269192817 [0,2,0,0,0,0|1,0,0]=3 1372 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Br)C Z30826447 [0,2,0,0,0,0|2,0,0]=4 1373 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)Br Z296850122 [0,2,0,0,0,0|2,0,0]=4 1374 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)Cl Z28153679 [0,2,0,0,0,0|2,0,0]=4 1375 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)F Z30955086 [0,2,0,0,0,0|2,0,0]=4 1376 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)N Z274783012 [0,2,0,0,0,0|2,0,0]=4 1377 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Cl)Cl Z28128347 [0,2,0,0,0,0|2,0,0]=4 1378 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Cl)N Z239122040 [0,2,0,0,0,0|2,0,0]=4 1379 B12R1.19 CC(=O)NC1=CC(=C(C=C1)F)N Z235362917 [0,2,0,0,0,0|2,0,0]=4 1380 B12R1.19 CC(=O)NC1=CC(=C(C=C1)N)Cl Z425366400 [0,2,0,0,0,0|2,0,0]=4 1381 B12R1.19 CC(=O)NC1=CC(=C(C=C1)O)F Z1216844087 [0,2,0,0,0,0|2,0,0]=4 1382 B12R1.19 CC(O)CC1=CC(=C(C=C1)Br)F Z1295686053 [0,2,0,0,0,0|1,0,1]=4 1383 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Br Z1269160930 [0,2,0,0,0,0|0,0,0]=2 1384 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)C Z56923286 [0,2,0,0,0,0|0,0,0]=2 1385 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Cl Z1198264457 [0,2,0,0,0,0|0,0,0]=2 1386 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)O Z1198166108 [0,2,0,0,0,0|0,0,0]=2 1387 B12R1.19 CC1=C(C=C(C=C1)NC(=O)N)C Z107732966 [0,2,0,0,0,0|2,0,0]=4 1388 B12R1.19 CC1=C(C=C(C=C1)NC(=O)N)F Z198194884 [0,2,0,0,0,0|2,0,0]=4 1389 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)Br Z1269233833 [0,2,0,0,0,0|0,0,0]=2 1390 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [0,2,0,0,0,0|0,0,0]=2 1391 B12R1.19 CC1=C(C=CC(=C1)NC(=O)N)Br Z198194748 [0,2,0,0,0,0|2,0,0]=4 1392 B12R1.19 CC1=C(C=NC(=C1)CC(=O)O)Cl Z2677377810 [0,2,0,0,0,0|1,0,0]=3 1393 B12R1.19 CS(=O)CC1=CC(=C(C=C1)Cl)N Z802580892 [0,2,0,0,0,0|2,0,0]=4 1394 B12R1.19 NC(=O)CC1=CC(=C(C=C1)Cl)Cl Z33546666 [0,2,0,0,0,0|1,0,0]=3 1395 B12R1.19 NC(=O)NC1=CC(=C(C=C1)Br)F Z1263540637 [0,2,0,0,0,0|2,0,0]=4 1396 B12R1.19 NC(=O)NC1=CC(=C(C=C1)Cl)N Z239124000 [0,2,0,0,0,0|2,0,0]=4 1397 B12R1.19 NC(=O)NC1=CC(=C(C=C1)F)Cl Z198194754 [0,2,0,0,0,0|2,0,0]=4 1398 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Br Z1269150510 [0,2,0,0,0,0|0,0,0]=2 1399 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Cl Z1269109822 [0,2,0,0,0,0|0,0,0]=2 1400 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)F Z1269111454 [0,2,0,0,0,0|0,0,0]=2 1401 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Br Z1269184545 [0,2,0,0,0,0|0,0,0]=2 1402 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Cl Z104476066 [0,2,0,0,0,0|0,0,0]=2 1403 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Br Z285131564 [0,2,0,0,0,0|0,0,0]=2 1404 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Cl Z362118814 [0,2,0,0,0,0|0,0,0]=2 1405 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)F Z362118708 [0,2,0,0,0,0|0,0,0]=2 1406 B12R1.19 O=C(O)CC1=CC(=C(C=C1)I)Br Z1269147843 [0,2,0,0,0,0|0,0,0]=2 1407 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl Z1205411134 [0,2,0,0,0,0|0,0,0]=2 1408 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)F Z1255445925 [0,2,0,0,0,0|0,0,0]=2 1409 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [0,2,0,0,0,0|0,0,0]=2 1410 B12R1.20 C=C(C(=O)O)C1=CC=C(C=C1)Cl Z1255421681 [0,2,0,0,0,0|0,0,1]=3 1411 B12R1.20 CC(=O)C(C)C1=CC=C(C=C1)Cl Z1276728135 [0,2,0,0,0,0|1,0,0]=3 1412 B12R1.20 CC(=O)C(Cl)C1=CC=C(C=C1)F Z1255439681 [0,2,0,0,0,0|1,0,0]=3 1413 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)N Z147641478 [0,2,0,0,0,0|2,0,0]=4 1414 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)O Z335806634 [0,2,0,0,0,0|2,0,0]=4 1415 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Br Z1259342200 [0,2,0,0,0,0|0,0,0]=2 1416 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Cl Z982129848 [0,2,0,0,0,0|0,0,0]=2 1417 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)F Z792377290 [0,2,0,0,0,0|0,0,0]=2 1418 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)I Z1269218602 [0,2,0,0,0,0|0,0,0]=2 1419 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N Z2935001159 [0,2,0,0,0,0|0,0,0]=2 1420 B12R1.20 CC1=CC=C(C=C1)C(=O)C(=O)O Z118430526 [0,2,0,0,0,0|0,0,1]=3 1421 B12R1.20 CC1=CC=C(C=C1)C(C)C(=O)O Z792377274 [0,2,0,0,0,0|0,0,0]=2 1422 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)O Z317024662 [0,2,0,0,0,0|0,0,0]=2 1423 B12R1.20 CN(C(=O)N)C1=CC=C(C=C1)O Z285211056 [0,2,0,0,0,0|2,0,0]=4 1424 B12R1.20 NC(=O)C(Br)C1=CC=C(C=C1)F Z198750878 [0,2,0,0,0,0|1,0,0]=3 1425 B12R1.20 NC(=O)C(Cl)C1=CC=C(C=C1)Br Z56791849 [0,2,0,0,0,0|1,0,0]=3 1426 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Br Z57069227 [0,2,0,0,0,0|1,0,0]=3 1427 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl Z1255523404 [0,2,0,0,0,0|1,0,0]=3 1428 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)F Z220512688 [0,2,0,0,0,0|1,0,0]=3 1429 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br Z317024668 [0,2,0,0,0,0|0,0,0]=2 1430 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl Z317024646 [0,2,0,0,0,0|0,0,0]=2 1431 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F Z317024670 [0,2,0,0,0,0|0,0,0]=2 1432 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O Z1198149764 [0,2,0,0,0,0|0,0,0]=2 1433 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F Z1255390982 [0,2,0,0,0,0|0,0,0]=2 1434 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O Z1255364887 [0,2,0,0,0,0|0,0,0]=2 1435 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)Cl Z381360896 [0,2,0,0,0,0|0,0,1]=3 1436 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)F Z381360860 [0,2,0,0,0,0|0,0,1]=3 1437 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)O Z2472464309 [0,2,0,0,0,0|0,0,1]=3 1438 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)F Z1318255176 [0,2,0,0,0,0|0,0,0]=2 1439 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Br Z788000726 [0,2,0,0,0,0|0,0,0]=2 1440 B12R1.49 C/C(=C\C1=CC=C(C=C1)Cl)/C=O Z1251359146 [0,2,0,0,0,0|1,0,1]=4 1441 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)Br Z381016676 [0,2,0,0,0,0|2,0,0]=4 1442 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)C Z440633654 [0,2,0,0,0,0|2,0,0]=4 1443 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)Cl Z440633664 [0,2,0,0,0,0|2,0,0]=4 1444 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)F Z424770410 [0,2,0,0,0,0|2,0,0]=4 1445 B12R1.49 CC1=CC=C(C=C1)CC(=O)CCl Z316174762 [0,2,0,0,0,0|1,0,0]=3 1446 B12R1.49 CC1=CC=C(C=C1)CC(=O)NO Z90728587 [0,2,0,0,0,0|0,0,0]=2 1447 B12R1.49 CC1=CC=C(C=C1)CC(Cl)C=O Z982126370 [0,2,0,0,0,0|1,0,1]=4 1448 B12R1.49 CC1=CC=C(C=C1)CC(N)CO Z1800620539 [0,2,0,0,0,0|1,0,1]=4 1449 B12R1.49 CC1=CC=C(C=C1)NC(=O)CCl Z56862730 [0,2,0,0,0,0|2,0,0]=4 1450 B12R1.49 CC1=CC=C(C=C1)NC(=O)CO Z228585410 [0,2,0,0,0,0|1,0,0]=3 1451 B12R1.49 CCC(=O)CC1=CC=C(C=C1)Br Z513733694 [0,2,0,0,0,0|1,0,0]=3 1452 B12R1.49 CCC(=O)CC1=CC=C(C=C1)C Z513735300 [0,2,0,0,0,0|1,0,0]=3 1453 B12R1.49 CCC(=O)NC1=CC=C(C=C1)F Z27805867 [0,2,0,0,0,0|2,0,0]=4 1454 B12R1.49 CCC(=O)NC1=CC=C(C=C1)I Z30316420 [0,2,0,0,0,0|2,0,0]=4 1455 B12R1.49 CCC(=O)NC1=CC=C(C=C1)N Z432066898 [0,2,0,0,0,0|2,0,0]=4 1456 B12R1.49 CCC(=O)NC1=CC=C(C=C1)O Z223656304 [0,2,0,0,0,0|2,0,0]=4 1457 B12R1.49 CCC(O)CC1=CC=C(C=C1)C Z513751166 [0,2,0,0,0,0|1,0,1]=4 1458 B12R1.49 CNC(=O)CC1=CC=C(C=C1)Br Z30272406 [0,2,0,0,0,0|1,0,0]=3 1459 B12R1.49 CNC(=O)CC1=CC=C(C=C1)N Z239124750 [0,2,0,0,0,0|1,0,0]=3 1460 B12R1.49 CNC(=O)CC1=CC=C(C=C1)O Z135505392 [0,2,0,0,0,0|1,0,0]=3 1461 B12R1.49 CNC(=O)NC1=CC=C(C=C1)Cl Z55293750 [0,2,0,0,0,0|2,0,0]=4 1462 B12R1.49 CNC(=O)NC1=CC=C(C=C1)F Z55293762 [0,2,0,0,0,0|2,0,0]=4 1463 B12R1.49 CNC(=O)NC1=CC=C(C=C1)N Z246671880 [0,2,0,0,0,0|2,0,0]=4 1464 B12R1.49 COC(=O)CC1=CC=C(C=C1)Br Z18830099 [0,2,0,0,0,0|0,0,0]=2 1465 B12R1.49 COC(=O)CC1=CC=C(C=C1)Cl Z18425668 [0,2,0,0,0,0|0,0,0]=2 1466 B12R1.49 COC(=O)CC1=CC=C(C=C1)N Z285139238 [0,2,0,0,0,0|0,0,0]=2 1467 B12R1.49 COC(=O)NC1=CC=C(C=C1)Br Z56758690 [0,2,0,0,0,0|1,0,0]=3 1468 B12R1.49 COC(=O)NC1=CC=C(C=C1)N Z319610150 [0,2,0,0,0,0|1,0,0]=3 1469 B12R1.49 COC(=O)NC1=CC=C(C=C1)O Z335810072 [0,2,0,0,0,0|1,0,0]=3 1470 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl Z3244488892 [0,2,0,0,0,0|1,0,1]=4 1471 B12R1.49 NC(CO)CC1=CC=C(C=C1)F Z1849004242 [0,2,0,0,0,0|1,0,1]=4 1472 B12R1.49 NC(CO)CC1=CC=C(C=C1)I Z1263636488 [0,2,0,0,0,0|1,0,1]=4 1473 B12R1.49 NC1=CC=C(C=C1)CC(F)CO Z4580450313 [0,2,0,0,0,0|1,0,1]=4 1474 B12R1.49 NCC(=O)CC1=CC=C(C=C1)F Z1889902528 [0,2,0,0,0,0|1,0,0]=3 1475 B12R1.49 NCC(=O)NC1=CC=C(C=C1)Br Z594272012 [0,2,0,0,0,0|2,0,0]=4 1476 B12R1.49 NCC(=O)NC1=CC=C(C=C1)Cl Z803145238 [0,2,0,0,0,0|2,0,0]=4 1477 B12R1.49 NCC(=O)NC1=CC=C(C=C1)N Z2895972079 [0,2,0,0,0,0|2,0,0]=4 1478 B12R1.49 NCC(=O)NC1=CC=C(C=C1)O Z1262237164 [0,2,0,0,0,0|2,0,0]=4 1479 B12R1.49 NCC(O)CC1=CC=C(C=C1)Br Z4990293859 [0,2,0,0,0,0|1,0,1]=4 1480 B12R1.49 NNC(=O)CC1=CC=C(C=C1)Cl Z56346881 [0,2,0,0,0,0|1,0,0]=3 1481 B12R1.49 NNC(=O)CC1=CC=C(C=C1)F Z56347387 [0,2,0,0,0,0|1,0,0]=3 1482 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O Z295456854 [0,2,0,0,0,0|1,0,1]=4 1483 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O Z203038576 [0,2,0,0,0,0|1,0,1]=4 1484 B12R1.49 O=C(CC1=CC=C(C=C1)Br)NO Z59182179 [0,2,0,0,0,0|0,0,0]=2 1485 B12R1.49 O=C(CC1=CC=C(C=C1)Cl)NO Z59182084 [0,2,0,0,0,0|0,0,0]=2 1486 B12R1.49 O=C(CC1=CC=C(C=C1)F)NO Z59182031 [0,2,0,0,0,0|0,0,0]=2 1487 B12R1.49 O=C(CC1=CC=C(C=C1)O)NO Z135512374 [0,2,0,0,0,0|0,0,0]=2 1488 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Br Z408178414 [0,2,0,0,0,0|1,0,0]=3 1489 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Cl Z316174770 [0,2,0,0,0,0|1,0,0]=3 1490 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)F Z316174768 [0,2,0,0,0,0|1,0,0]=3 1491 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)Br Z56899212 [0,2,0,0,0,0|2,0,0]=4 1492 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)Cl Z56867253 [0,2,0,0,0,0|2,0,0]=4 1493 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)F Z56755193 [0,2,0,0,0,0|2,0,0]=4 1494 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)I Z56869425 [0,2,0,0,0,0|2,0,0]=4 1495 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)O Z166646964 [0,2,0,0,0,0|2,0,0]=4 1496 B12R1.49 O=C(CO)CC1=CC=C(C=C1)F Z906206828 [0,2,0,0,0,0|0,0,0]=2 1497 B12R1.49 O=C(CO)NC1=CC=C(C=C1)Cl Z228585484 [0,2,0,0,0,0|1,0,0]=3 1498 B12R1.106 CC(C)(O)CC1=CC=C(C=C1)Br Z513707720 [0,2,0,0,0,0|1,0,1]=4 1499 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)Br Z416908782 [0,2,0,0,0,0|1,0,1]=4 1500 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)N Z732208132 [0,2,0,0,0,0|1,0,1]=4 1501 B12R1.106 NC1=CC=C(C=C1)CS(=O)(=O)N Z235340045 [0,2,0,0,0,0|1,0,1]=4 1502 B12R1.106 NS(=O)(=O)CC1=CC=C(C=C1)Br Z274591724 [0,2,0,0,0,0|1,0,1]=4 1503 B12R1.106 NS(=O)(=O)CC1=CC=C(C=C1)Cl Z274587950 [0,2,0,0,0,0|1,0,1]=4 1504 B12R1.106 NS(=O)(=O)CC1=CC=C(C=C1)F Z241725866 [0,2,0,0,0,0|1,0,1]=4 1505 B12R1.106 O=S(=O)(F)CC1=CC=C(C=C1)Br Z2733515136 [0,2,0,0,0,0|1,0,1]=4 1506 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Br)F Z992965764 [0,2,0,0,0,0|1,0,0]=3 1507 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Cl)F Z1198331241 [0,2,0,0,0,0|1,0,0]=3 1508 B12R1.233 CC(=O)CC1=C(C=C(C=C1)F)Br Z992965738 [0,2,0,0,0,0|1,0,0]=3 1509 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)C Z26621747 [0,2,0,0,0,0|2,0,0]=4 1510 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)Cl Z29819536 [0,2,0,0,0,0|2,0,0]=4 1511 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)F Z30824336 [0,2,0,0,0,0|2,0,0]=4 1512 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)N Z362832080 [0,2,0,0,0,0|2,0,0]=4 1513 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)Br Z26522737 [0,2,0,0,0,0|2,0,0]=4 1514 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)C Z27801599 [0,2,0,0,0,0|2,0,0]=4 1515 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)N Z274782976 [0,2,0,0,0,0|2,0,0]=4 1516 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)O Z33451994 [0,2,0,0,0,0|2,0,0]=4 1517 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Cl)N Z239120680 [0,2,0,0,0,0|2,0,0]=4 1518 B12R1.233 CC(=O)NC1=C(C=C(C=C1)F)Br Z361888984 [0,2,0,0,0,0|2,0,0]=4 1519 B12R1.233 CC(=O)NC1=C(C=C(C=C1)F)C Z29827980 [0,2,0,0,0,0|2,0,0]=4 1520 B12R1.233 CC(=O)NC1=C(C=C(C=C1)F)F Z30802596 [0,2,0,0,0,0|2,0,0]=4 1521 B12R1.233 CC(=O)NC1=C(C=C(C=C1)I)C Z30179236 [0,2,0,0,0,0|2,0,0]=4 1522 B12R1.233 CC(=O)NC1=C(C=C(C=C1)I)Cl Z394383940 [0,2,0,0,0,0|2,0,0]=4 1523 B12R1.233 CC(=O)NC1=C(C=C(C=C1)N)C Z239121088 [0,2,0,0,0,0|2,0,0]=4 1524 B12R1.233 CC(=O)NC1=C(C=C(C=C1)N)Cl Z223844400 [0,2,0,0,0,0|2,0,0]=4 1525 B12R1.233 CC(=O)OC1=C(C=C(C=C1)Br)C Z1516170019 [0,2,0,0,0,0|2,0,0]=4 1526 B12R1.233 CC(=O)OC1=C(C=C(C=C1)Br)Cl Z26745892 [0,2,0,0,0,0|2,0,0]=4 1527 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)N Z1617965385 [0,2,0,0,0,0|1,0,0]=3 1528 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)O Z1269213926 [0,2,0,0,0,0|0,0,0]=2 1529 B12R1.233 CC1=C(C=CC(=C1)F)CC(=O)O Z982130478 [0,2,0,0,0,0|0,0,0]=2 1530 B12R1.233 CC1=C(C=CC(=N1)Cl)CC(=O)O Z1198264658 [0,2,0,0,0,0|1,0,0]=3 1531 B12R1.233 CC1=CC(=C(C=C1)CC(=O)O)Br Z1269232519 [0,2,0,0,0,0|0,0,0]=2 1532 B12R1.233 CC1=CC(=C(C=C1)NC(=O)N)C Z56754685 [0,2,0,0,0,0|2,0,0]=4 1533 B12R1.233 CC1=CC(=C(C=C1)NC(=O)N)F Z359376242 [0,2,0,0,0,0|2,0,0]=4 1534 B12R1.233 CC1=CC(=O)C=CN1CC(=O)O Z1262520984 [0,2,0,0,0,0|1,0,0]=3 1535 B12R1.233 N=C(N)CC1=C(C=C(C=C1)F)F Z1642389901 [0,2,0,0,0,0|2,0,0]=4 1536 B12R1.233 NC(=O)CC1=C(C=C(C=C1)Br)Cl Z2692246846 [0,2,0,0,0,0|1,0,0]=3 1537 B12R1.233 NC(=O)NC1=C(C=C(C=C1)I)Br Z1352765519 [0,2,0,0,0,0|2,0,0]=4 1538 B12R1.233 NC1=CC(=C(C=C1)CC(=O)O)F Z1198183551 [0,2,0,0,0,0|0,0,0]=2 1539 B12R1.233 NC1=NC=C(C(=O)N1)CC(=O)O Z5087129668 [0,2,0,0,0,0|2,0,0]=4 1540 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)Cl Z1269137680 [0,2,0,0,0,0|0,0,0]=2 1541 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)I Z1269231484 [0,2,0,0,0,0|0,0,0]=2 1542 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)O Z1269204929 [0,2,0,0,0,0|0,0,0]=2 1543 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Br Z1187934893 [0,2,0,0,0,0|0,0,0]=2 1544 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Cl Z104477206 [0,2,0,0,0,0|0,0,0]=2 1545 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Br Z285184632 [0,2,0,0,0,0|0,0,0]=2 1546 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Cl Z285184620 [0,2,0,0,0,0|0,0,0]=2 1547 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)F Z362118706 [0,2,0,0,0,0|0,0,0]=2 1548 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)Cl Z1198307592 [0,2,0,0,0,0|0,0,0]=2 1549 B12R1.233 O=C(O)CC1=C(C=C(C=N1)F)F Z1198264626 [0,2,0,0,0,0|1,0,0]=3 1550 B12R1.233 O=C(O)CC1=CNC(=NC1=O)S Z2732606553 [0,2,0,0,0,0|2,0,0]=4 1551 B12R1.233 O=C(O)CN1C=CC(=CC1=O)Br Z2689726361 [0,2,0,0,0,0|1,0,0]=3 1552 B12R1.233 O=C(O)CN1C=CC(=O)NC1=O Z104502076 [0,2,0,0,0,0|2,0,0]=4 1553 B12R1.233 O=C([O-])CC1=C(C=C(C=N1)Cl)Cl Z2731857588 [0,2,0,0,0,0|1,0,1]=4 1554 B12R1.34 C=C(C#N)C(O)C1=CC=CC=C1 Z320966940 [0,2,0,0,0,0|2,0,0]=4 1555 B12R1.34 C=CC(=O)N(C)C1=CC=CC=C1 Z440633576 [0,2,0,0,0,0|2,0,0]=4 1556 B12R1.34 CC(C1=CC=CC=C1)C(N)CO Z1262398547 [0,2,0,0,0,0|1,0,1]=4 1557 B12R1.34 CCC(=O)C(=O)C1=CC=CC=C1 Z1251352835 [0,2,0,0,0,0|1,0,1]=4 1558 B12R1.34 CCC(=O)N(C)C1=CC=CC=C1 Z58322425 [0,2,0,0,0,0|2,0,0]=4 1559 B12R1.34 CN(C(=O)CCl)C1=CC=CC=C1 Z56896212 [0,2,0,0,0,0|2,0,0]=4 1560 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 Z594038166 [0,2,0,0,0,0|1,0,0]=3 1561 B12R1.34 CNC(=O)C(O)C1=CC=CC=C1 Z1203869997 [0,2,0,0,0,0|1,0,0]=3 1562 B12R1.34 COC(=O)C(C)C1=CC=NC=C1 Z1143360472 [0,2,0,0,0,0|1,0,0]=3 1563 B12R1.34 COC(=O)C(C)C1=CN=CC=C1 Z982129816 [0,2,0,0,0,0|1,0,0]=3 1564 B12R1.34 COC(=O)C(C)C1=NC=CC=C1 Z1143356350 [0,2,0,0,0,0|1,0,0]=3 1565 B12R1.34 COC(=O)C(C)C1=NC=CN=C1 Z1183458021 [0,2,0,0,0,0|2,0,0]=4 1566 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 Z57046237 [0,2,0,0,0,0|0,0,0]=2 1567 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 Z56757232 [0,2,0,0,0,0|0,0,0]=2 1568 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 Z19752945 [0,2,0,0,0,0|0,0,0]=2 1569 B12R1.34 COC(=O)C(O)C1=CN=CC=C1 Z1250100620 [0,2,0,0,0,0|1,0,0]=3 1570 B12R1.34 COC(=O)C(O)C1=NC=CC=C1 Z4130150180 [0,2,0,0,0,0|1,0,0]=3 1571 B12R1.124 C=C(C(=O)O)C1=C(C=CC=C1)F Z1255374937 [0,2,0,0,0,0|0,0,1]=3 1572 B12R1.124 CC(=O)C(N)C1=C(C=CC=C1)F Z2312540924 [0,2,0,0,0,0|1,0,0]=3 1573 B12R1.124 CC(C(=O)O)C1=C(C=CC=C1)Cl Z982130746 [0,2,0,0,0,0|0,0,0]=2 1574 B12R1.124 CC(C(=O)O)C1=C(C=CC=C1)F Z792377276 [0,2,0,0,0,0|0,0,0]=2 1575 B12R1.124 CC1=C(C=CC=C1)C(C)C(=O)O Z792377258 [0,2,0,0,0,0|0,0,0]=2 1576 B12R1.124 CC1=C(C=CC=C1)C(N)C(=O)O Z317024660 [0,2,0,0,0,0|0,0,0]=2 1577 B12R1.124 CC1=C(C=CN=C1)C(C)C(=O)O Z3545523789 [0,2,0,0,0,0|1,0,0]=3 1578 B12R1.124 CC1=C(N=CC=C1)C(O)C(=O)O Z1945984217 [0,2,0,0,0,0|1,0,0]=3 1579 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)Br Z317024716 [0,2,0,0,0,0|0,0,0]=2 1580 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)F Z317024726 [0,2,0,0,0,0|0,0,0]=2 1581 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)I Z2941400819 [0,2,0,0,0,0|0,0,0]=2 1582 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)Br Z788000812 [0,2,0,0,0,0|0,0,0]=2 1583 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)I Z1269111466 [0,2,0,0,0,0|0,0,0]=2 1584 B12R1.124 O=C(O)[C@H](O)C1=C(C=CC=C1)Cl Z1255488133 [0,2,0,0,0,0|0,0,0]=2 1585 B12R1.225 CC(=O)C(O)C1=CC(=CC=C1)Cl Z1255467340 [0,2,0,0,0,0|1,0,0]=3 1586 B12R1.225 CC(=O)N(C)C1=CC(=CC=C1)N Z802628524 [0,2,0,0,0,0|2,0,0]=4 1587 B12R1.225 CC(C(=O)O)C1=CC(=CC=C1)F Z792377330 [0,2,0,0,0,0|0,0,0]=2 1588 B12R1.225 CC1=CC(=CC=C1)C(=O)C(=O)O Z1255379743 [0,2,0,0,0,0|0,0,1]=3 1589 B12R1.225 CC1=CC(=CC=C1)C(N)C(=O)O Z317024596 [0,2,0,0,0,0|0,0,0]=2 1590 B12R1.225 CC1=CC(=CC=C1)C(O)C(=O)O Z788000614 [0,2,0,0,0,0|0,0,0]=2 1591 B12R1.225 CC1=CC=CC(=C1)C(C)C(=O)O Z802854000 [0,2,0,0,0,0|0,0,0]=2 1592 B12R1.225 CN(C(=O)N)C1=CC(=CC=C1)N Z802629090 [0,2,0,0,0,0|2,0,0]=4 1593 B12R1.225 NC(=O)C(N)C1=CC(=CC=C1)Br Z477338262 [0,2,0,0,0,0|1,0,0]=3 1594 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)Br Z317024672 [0,2,0,0,0,0|0,0,0]=2 1595 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)Cl Z317024654 [0,2,0,0,0,0|0,0,0]=2 1596 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)F Z317024592 [0,2,0,0,0,0|0,0,0]=2 1597 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)I Z3477438782 [0,2,0,0,0,0|0,0,0]=2 1598 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)O Z1532541074 [0,2,0,0,0,0|0,0,0]=2 1599 B12R1.225 NC1=CC(=CC=C1)C(O)C(=O)O Z1262512603 [0,2,0,0,0,0|0,0,0]=2 1600 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Br Z788000730 [0,2,0,0,0,0|0,0,0]=2 1601 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Cl Z788000712 [0,2,0,0,0,0|0,0,0]=2 1602 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)F Z788000610 [0,2,0,0,0,0|0,0,0]=2 1603 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)I Z1269151011 [0,2,0,0,0,0|0,0,0]=2 1604 B12R1.253 CC(=O)C(C)(C)C1=CC=CC=C1 Z406676998 [0,2,0,0,0,0|1,0,0]=3 1605 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 Z104493600 [0,2,0,0,0,0|0,0,0]=2 1606 B12R1.253 CC(C)(C(=O)O)C1=CN=CC=C1 Z1582263901 [0,2,0,0,0,0|1,0,0]=3 1607 B12R1.253 CC(C)(C(=O)[O-])C1=NC=CC=C1 Z2242071109 [0,2,0,0,0,0|1,0,1]=4 1608 B12R1.253 CC(N)(C(=O)N)C1=CC=CC=C1 Z1211228973 [0,2,0,0,0,0|1,0,0]=3 1609 B12R1.253 CC(N)(C(=O)O)C1=CC=CC=C1 Z600397716 [0,2,0,0,0,0|0,0,0]=2 1610 B12R1.253 CC(N)(C(=O)O)C1=CN=CC=C1 Z4079861885 [0,2,0,0,0,0|1,0,0]=3 1611 B12R1.253 CC(O)(C(=N)N)C1=CC=CC=C1 Z1723549308 [0,2,0,0,0,0|2,0,0]=4 1612 B12R1.253 CC(O)(C(=O)O)C1=CC=CC=C1 Z336127660 [0,2,0,0,0,0|0,0,0]=2 1613 B12R1.253 C[C@@](O)(C(=O)O)C1=CC=CC=C1 Z1154245575 [0,2,0,0,0,0|0,0,0]=2 1614 B12R1.253 C[C@](O)(C(=O)O)C1=CC=CC=C1 Z1119104455 [0,2,0,0,0,0|0,0,0]=2 1615 B12R1.253 NC(=O)C(F)(F)C1=CC=CC=C1 Z56757372 [0,2,0,0,0,0|1,0,0]=3 1616 B12R1.253 O=C(O)C(F)(F)C1=CC=CC=C1 Z56770330 [0,2,0,0,0,0|0,0,0]=2 1617 B12R1.253 O=C(O)C(F)(F)C1=NC=CN=C1 Z1183458026 [0,2,0,0,0,0|2,0,0]=4 1618 B12R1.478 CC(=O)C(C#N)C1=CN=CC=C1 Z1410957851 [0,2,0,0,0,0|2,0,0]=4 1619 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 Z104479150 [0,2,0,0,0,0|0,0,0]=2 1620 B12R1.478 CCC(C(=O)O)C1=CN=CC=C1 Z982129822 [0,2,0,0,0,0|1,0,0]=3 1621 B12R1.478 CCN(C(=O)C)C1=CC=CC=C1 Z58324632 [0,2,0,0,0,0|2,0,0]=4 1622 B12R1.478 CNC(C(=O)O)C1=CC=CC=C1 Z1259273212 [0,2,0,0,0,0|0,0,0]=2 1623 B12R1.478 COC(C(=O)C)C1=CC=CC=C1 Z1513595127 [0,2,0,0,0,0|1,0,0]=3 1624 B12R1.478 COC(C(=O)O)C1=CC=CC=C1 Z316258914 [0,2,0,0,0,0|0,0,0]=2 1625 B12R1.478 CSC(C(=O)O)C1=CC=CC=C1 Z732206604 [0,2,0,0,0,0|0,0,0]=2 1626 B12R1.478 NCC(C(=O)O)C1=CC=CC=C1 Z1913661007 [0,2,0,0,0,0|0,0,0]=2 1627 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 Z1080722424 [0,2,0,0,0,0|0,0,0]=2 1628 B12R1.478 O=C(O)[C@H](CO)C1=CC=CC=C1 Z1262510670 [0,2,0,0,0,0|0,0,0]=2 1629 B12R1.564 CC(C1=CC=CC=C1)C(C)(C)O Z2235789563 [0,2,0,0,0,0|1,0,1]=4 1630 B12R1.564 CC(C1=CC=CC=C1)S(=O)(=O)F Z1210120079 [0,2,0,0,0,0|1,0,1]=4 1631 B12R1.564 CC(C1=CC=CC=C1)S(=O)(=O)N Z954606652 [0,2,0,0,0,0|1,0,1]=4 1632 B12R1.564 NC(C1=CC=CC=C1)P(=O)(O)O Z55625577 [0,2,0,0,0,0|1,0,0]=3 1633 B12R1.32 CC#CC(=O)NC1=CC=CC=C1 Z1509183430 [0,2,0,0,0,0|2,0,0]=4 1634 B12R1.32 CCCC(=O)CC1=CC=CC=C1 Z513733628 [0,2,0,0,0,0|1,0,0]=3 1635 B12R1.32 CCNC(=O)NC1=CC=CC=C1 Z44586347 [0,2,0,0,0,0|2,0,0]=4 1636 B12R1.32 CCOC(=O)CC1=CN=CC=C1 Z982129808 [0,2,0,0,0,0|1,0,0]=3 1637 B12R1.32 CCOC(=O)NC1=CN=CC=C1 Z31791377 [0,2,0,0,0,0|2,0,0]=4 1638 B12R1.32 CN(CCO)CC1=CC=CC=C1 Z137706074 [0,2,0,0,0,0|2,0,0]=4 1639 B12R1.32 CNCC(=O)NC1=CC=CC=C1 Z380844554 [0,2,0,0,0,0|2,0,0]=4 1640 B12R1.32 COCC(=O)CC1=CC=CC=C1 Z447897954 [0,2,0,0,0,0|0,0,0]=2 1641 B12R1.32 COCC(=O)NC1=CC=CC=C1 Z31504642 [0,2,0,0,0,0|1,0,0]=3 1642 B12R1.32 COCC(N)CC1=CC=CC=C1 Z825742276 [0,2,0,0,0,0|1,0,1]=4 1643 B12R1.32 CSCC(=O)NC1=CC=CC=C1 Z27781929 [0,2,0,0,0,0|1,1,0]=4 1644 B12R1.32 N#CCC(=O)NC1=CC=CC=C1 Z56813510 [0,2,0,0,0,0|2,0,0]=4 1645 B12R1.32 NC(CCO)CC1=CC=CC=C1 Z1992316427 [0,2,0,0,0,0|1,0,1]=4 1646 B12R1.32 NCCC(=O)NC1=CC=CC=C1 Z241054028 [0,2,0,0,0,0|2,0,0]=4 1647 B12R1.32 NCCS(=O)CC1=CC=CC=C1 Z802568488 [0,2,0,0,0,0|2,0,0]=4 1648 B12R1.32 O=C(/C=N/O)NC1=CC=CC=C1 Z56871811 [0,2,0,0,0,0|1,0,0]=3 1649 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 Z217707130 [0,2,0,0,0,0|2,0,0]=4 1650 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)Br Z381016842 [0,2,0,0,0,0|2,0,0]=4 1651 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)C Z440633644 [0,2,0,0,0,0|2,0,0]=4 1652 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)Cl Z440633660 [0,2,0,0,0,0|2,0,0]=4 1653 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)F Z440633662 [0,2,0,0,0,0|2,0,0]=4 1654 B12R1.50 CC1=CC(=CC=C1)CC(=O)CCl Z276118998 [0,2,0,0,0,0|1,0,0]=3 1655 B12R1.50 CC1=CC(=CC=C1)CC(N)CO Z1801307645 [0,2,0,0,0,0|1,0,1]=4 1656 B12R1.50 CC1=CC(=CC=C1)NC(=O)CCl Z56862383 [0,2,0,0,0,0|2,0,0]=4 1657 B12R1.50 CC1=CC(=CC=C1)NC(=O)CO Z431952658 [0,2,0,0,0,0|1,0,0]=3 1658 B12R1.50 CCC(=O)NC1=CC(=CC=C1)Br Z27788979 [0,2,0,0,0,0|2,0,0]=4 1659 B12R1.50 CCC(=O)NC1=CC(=CC=C1)F Z28143170 [0,2,0,0,0,0|2,0,0]=4 1660 B12R1.50 CCC(=O)NC1=CC(=CC=C1)N Z57243699 [0,2,0,0,0,0|2,0,0]=4 1661 B12R1.50 CCS(=O)CC1=CC(=CC=C1)Br Z1618064713 [0,2,0,0,0,0|2,0,0]=4 1662 B12R1.50 CNC(=O)CC1=CC(=CC=C1)O Z816010790 [0,2,0,0,0,0|1,0,0]=3 1663 B12R1.50 CNC(=O)NC1=CC(=CC=C1)I Z177091564 [0,2,0,0,0,0|2,0,0]=4 1664 B12R1.50 CNC(=O)NC1=CC(=CC=C1)N Z254059098 [0,2,0,0,0,0|2,0,0]=4 1665 B12R1.50 CNC(=O)OC1=CC(=CC=C1)O Z1509352023 [0,2,0,0,0,0|2,0,0]=4 1666 B12R1.50 COC(=O)CC1=CC(=CC=C1)Br Z905185712 [0,2,0,0,0,0|0,0,0]=2 1667 B12R1.50 COC(=O)CC1=CC(=CC=C1)N Z1250132316 [0,2,0,0,0,0|0,0,0]=2 1668 B12R1.50 COC(=O)CC1=CC(=CC=C1)O Z816010254 [0,2,0,0,0,0|0,0,0]=2 1669 B12R1.50 COC(=O)CC1=CC(=CN=C1)Br Z1269220704 [0,2,0,0,0,0|1,0,0]=3 1670 B12R1.50 COC(=O)CC1=NC(=NC=C1)Cl Z1255440291 [0,2,0,0,0,0|2,0,0]=4 1671 B12R1.50 COC(=O)CC1=NC=NC(=C1)Cl Z1198330063 [0,2,0,0,0,0|2,0,0]=4 1672 B12R1.50 COC(=O)NC1=CC(=CC=C1)C Z371333120 [0,2,0,0,0,0|1,0,0]=3 1673 B12R1.50 COC(=O)NC1=CC(=CC=C1)Cl Z56754690 [0,2,0,0,0,0|1,0,0]=3 1674 B12R1.50 COC(=O)NC1=CC(=CC=C1)N Z319610162 [0,2,0,0,0,0|1,0,0]=3 1675 B12R1.50 COC(=O)NC1=CC(=CC=C1)O Z335810160 [0,2,0,0,0,0|1,0,0]=3 1676 B12R1.50 NC(CO)CC1=CC(=CC=C1)F Z1198222234 [0,2,0,0,0,0|1,0,1]=4 1677 B12R1.50 NC1=CC(=CC=C1)NC(=O)CO Z385458324 [0,2,0,0,0,0|1,0,0]=3 1678 B12R1.50 NCC(=O)CC1=CC(=CC=C1)Br Z1981870420 [0,2,0,0,0,0|1,0,0]=3 1679 B12R1.50 NCC(=O)NC1=CC(=CC=C1)Br Z46280185 [0,2,0,0,0,0|2,0,0]=4 1680 B12R1.50 NCC(=O)NC1=CC(=CC=C1)F Z46280394 [0,2,0,0,0,0|2,0,0]=4 1681 B12R1.50 NCC(O)CC1=CC(=CC=C1)Br Z4981222469 [0,2,0,0,0,0|1,0,1]=4 1682 B12R1.50 O=C(CC1=CC(=CC=C1)F)NO Z59182830 [0,2,0,0,0,0|0,0,0]=2 1683 B12R1.50 O=C(CC1=CC(=CC=C1)O)NO Z816010210 [0,2,0,0,0,0|0,0,0]=2 1684 B12R1.50 O=C(CCl)CC1=CC(=CC=C1)Br Z408178442 [0,2,0,0,0,0|1,0,0]=3 1685 B12R1.50 O=C(CCl)CC1=CC(=CC=C1)Cl Z316174772 [0,2,0,0,0,0|1,0,0]=3 1686 B12R1.50 O=C(CCl)CC1=CC=CC(=C1)F Z316174766 [0,2,0,0,0,0|1,0,0]=3 1687 B12R1.50 O=C(CCl)NC1=CC(=CC=C1)Br Z56896266 [0,2,0,0,0,0|2,0,0]=4 1688 B12R1.50 O=C(CCl)NC1=CC(=CC=C1)Cl Z56869410 [0,2,0,0,0,0|2,0,0]=4 1689 B12R1.50 O=C(CCl)NC1=CC(=CC=C1)I Z56824475 [0,2,0,0,0,0|2,0,0]=4 1690 B12R1.50 O=C(CCl)NC1=CC=CC(=C1)F Z56889137 [0,2,0,0,0,0|2,0,0]=4 1691 B12R1.118 CCN(CC1=CC=CC=C1)N=O Z1198158367 [0,2,0,0,0,0|2,0,0]=4 1692 B12R1.118 COC(C=O)CC1=CC=CC=C1 Z1511872212 [0,2,0,0,0,0|0,0,1]=3 1693 B12R1.118 COC(CO)CC1=CC=CC=C1 Z1896500221 [0,2,0,0,0,0|0,0,2]=4 1694 B12R1.118 N#CC(CO)CC1=CC=CC=C1 Z1098915220 [0,2,0,0,0,0|1,0,1]=4 1695 B12R1.118 NCC(CO)CC1=CC=CC=C1 Z234896807 [0,2,0,0,0,0|1,0,1]=4 1696 B12R1.118 OCC(CO)CC1=CC=CC=C1 Z1255372888 [0,2,0,0,0,0|0,0,2]=4 1697 B12R1.194 CC(C)(C=O)CC1=CC=CC=C1 Z1188488760 [0,2,0,0,0,0|1,0,1]=4 1698 B12R1.194 CNS(=O)(=O)CC1=CC=CC=C1 Z133621020 [0,2,0,0,0,0|1,0,1]=4 1699 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)C Z440633758 [0,2,0,0,0,0|2,0,0]=4 1700 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)Cl Z440633680 [0,2,0,0,0,0|2,0,0]=4 1701 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)F Z295390598 [0,2,0,0,0,0|2,0,0]=4 1702 B12R1.371 CC1=C(C=CC=C1)CC(N)CO Z1198274419 [0,2,0,0,0,0|1,0,1]=4 1703 B12R1.371 CC1=C(C=CC=C1)NC(=O)CCl Z56896310 [0,2,0,0,0,0|2,0,0]=4 1704 B12R1.371 CC1=C(C=CC=C1)NC(=O)CO Z228585408 [0,2,0,0,0,0|1,0,0]=3 1705 B12R1.371 CC1=C(C=CC=C1)NC(=O)NN Z381337818 [0,2,0,0,0,0|2,0,0]=4 1706 B12R1.371 CCC(=O)CC1=C(C=CC=C1)Br Z513735296 [0,2,0,0,0,0|1,0,0]=3 1707 B12R1.371 CCC(=O)NC1=C(C=CC=C1)Br Z27784757 [0,2,0,0,0,0|2,0,0]=4 1708 B12R1.371 CCC(=O)NC1=C(C=CC=C1)F Z28290312 [0,2,0,0,0,0|2,0,0]=4 1709 B12R1.371 CCC(=O)NC1=C(C=CC=C1)O Z68195027 [0,2,0,0,0,0|2,0,0]=4 1710 B12R1.371 CNC(=O)CC1=C(C=CC=C1)N Z234895127 [0,2,0,0,0,0|1,0,0]=3 1711 B12R1.371 CNC(=O)NC1=C(C=CC=C1)Br Z371866552 [0,2,0,0,0,0|2,0,0]=4 1712 B12R1.371 CNC(=O)NC1=C(C=CC=C1)F Z55293757 [0,2,0,0,0,0|2,0,0]=4 1713 B12R1.371 CNC(=O)NC1=C(C=CC=C1)I Z371866768 [0,2,0,0,0,0|2,0,0]=4 1714 B12R1.371 COC(=O)CC1=C(C=CC=C1)Cl Z24820310 [0,2,0,0,0,0|0,0,0]=2 1715 B12R1.371 COC(=O)CC1=C(C=CC=C1)I Z1269173309 [0,2,0,0,0,0|0,0,0]=2 1716 B12R1.371 COC(=O)CC1=C(C=CC=C1)N Z1333043515 [0,2,0,0,0,0|0,0,0]=2 1717 B12R1.371 COC(=O)CC1=C(C=CC=C1)O Z1010319062 [0,2,0,0,0,0|0,0,0]=2 1718 B12R1.371 COC(=O)CC1=C(N=CN=C1)Cl Z1255445852 [0,2,0,0,0,0|2,0,0]=4 1719 B12R1.371 COC(=O)NC1=C(C=CC=C1)O Z425822036 [0,2,0,0,0,0|1,0,0]=3 1720 B12R1.371 COC(=O)NC1=C(C=CN=C1)C Z1925930213 [0,2,0,0,0,0|2,0,0]=4 1721 B12R1.371 N/C(=N\O)/CC1=C(C=CC=C1)Cl Z451350216 [0,2,0,0,0,0|1,0,0]=3 1722 B12R1.371 N/C(=N\O)/CN1C=CC=CC1=O Z111872908 [0,2,0,0,0,0|2,0,0]=4 1723 B12R1.371 NCC(=O)NC1=C(C=CC=C1)Br Z56964583 [0,2,0,0,0,0|2,0,0]=4 1724 B12R1.371 NCC(=O)NC1=C(C=CC=C1)F Z1449752250 [0,2,0,0,0,0|2,0,0]=4 1725 B12R1.371 NNC(=O)CN1C=CC=CC1=O Z58983346 [0,2,0,0,0,0|2,0,0]=4 1726 B12R1.371 O=C(CC1=C(C=CC=C1)Cl)NO Z59182782 [0,2,0,0,0,0|0,0,0]=2 1727 B12R1.371 O=C(CCl)CC1=C(C=CC=C1)Br Z408178456 [0,2,0,0,0,0|1,0,0]=3 1728 B12R1.371 O=C(CCl)CC1=C(C=CC=C1)Cl Z408178450 [0,2,0,0,0,0|1,0,0]=3 1729 B12R1.371 O=C(CCl)CC1=C(C=CC=C1)F Z316174764 [0,2,0,0,0,0|1,0,0]=3 1730 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)Br Z56813048 [0,2,0,0,0,0|2,0,0]=4 1731 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)Cl Z56821911 [0,2,0,0,0,0|2,0,0]=4 1732 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)F Z56869396 [0,2,0,0,0,0|2,0,0]=4 1733 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)I Z55992882 [0,2,0,0,0,0|2,0,0]=4 1734 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)O Z57764509 [0,2,0,0,0,0|2,0,0]=4 1735 B12R1.371 O=C(CO)NC1=C(N=CC=C1)Cl Z198152806 [0,2,0,0,0,0|2,0,0]=4 1736 B12R1.371 O=CC(Cl)CC1=C(C=CC=C1)Cl Z982126354 [0,2,0,0,0,0|1,0,1]=4 1737 B12R1.75 C#CC1=C(C=CC=C1)CC(=O)N Z1262691146 [0,2,0,0,0,0|1,0,0]=3 1738 B12R1.75 CC(=O)NC1=C(C=CC=C1)C#N Z26489157 [0,2,0,0,0,0|2,0,0]=4 1739 B12R1.75 CC(=O)NC1=C(C=CC=C1)C=O Z1143235775 [0,2,0,0,0,0|2,0,0]=4 1740 B12R1.75 CCC1=C(C=CC=C1)CC(=O)O Z1198264425 [0,2,0,0,0,0|0,0,0]=2 1741 B12R1.75 COC1=C(C=CC=C1)CC(=O)N Z33545381 [0,2,0,0,0,0|1,0,0]=3 1742 B12R1.75 COC1=C(C=CC=C1)CC(=O)O Z104485032 [0,2,0,0,0,0|0,0,0]=2 1743 B12R1.75 COC1=C(C=CC=C1)CC(C)O Z445987128 [0,2,0,0,0,0|1,0,1]=4 1744 B12R1.75 COC1=C(C=CC=C1)NC(=O)C Z27797377 [0,2,0,0,0,0|2,0,0]=4 1745 B12R1.75 COC1=C(C=CC=C1)NC(=O)N Z56754689 [0,2,0,0,0,0|2,0,0]=4 1746 B12R1.75 COC1=C(C=NC=C1)CC(=O)O Z2609473538 [0,2,0,0,0,0|1,0,0]=3 1747 B12R1.75 CSC1=C(C=CC=C1)CC(=O)C Z1641983304 [0,2,0,0,0,0|1,0,0]=3 1748 B12R1.75 CSC1=C(C=CC=C1)CC(=O)O Z1255403889 [0,2,0,0,0,0|0,0,0]=2 1749 B12R1.75 CSC1=C(C=CC=C1)NC(=O)C Z26434950 [0,2,0,0,0,0|2,0,0]=4 1750 B12R1.75 N#CC1=C(C=CC=C1)NC(=O)N Z228365404 [0,2,0,0,0,0|2,0,0]=4 1751 B12R1.75 NCC1=C(C=CC=C1)CC(=O)O Z1198163910 [0,2,0,0,0,0|0,0,0]=2 1752 B12R1.75 O=C([O-])CC1=C(C=CC=C1)CO Z1762997367 [0,2,0,0,0,0|0,0,1]=3 1753 B12R1.127 CC(=O)CC1=C(C=CC(=C1)F)Br Z992965748 [0,2,0,0,0,0|1,0,0]=3 1754 B12R1.127 CC(=O)CN1C=C(C=CC1=O)Br Z1863617790 [0,2,0,0,0,0|2,0,0]=4 1755 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Br)C Z448251216 [0,2,0,0,0,0|2,0,0]=4 1756 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Br)Cl Z1037552282 [0,2,0,0,0,0|2,0,0]=4 1757 B12R1.127 CC(=O)NC1=C(C=CC(=C1)C)Br Z56827897 [0,2,0,0,0,0|2,0,0]=4 1758 B12R1.127 CC(=O)NC1=C(C=CC(=C1)C)Cl Z276567178 [0,2,0,0,0,0|2,0,0]=4 1759 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)C Z27065719 [0,2,0,0,0,0|2,0,0]=4 1760 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)Cl Z28136791 [0,2,0,0,0,0|2,0,0]=4 1761 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)N Z239121632 [0,2,0,0,0,0|2,0,0]=4 1762 B12R1.127 CC(=O)NC1=C(C=CC(=C1)F)C Z30904143 [0,2,0,0,0,0|2,0,0]=4 1763 B12R1.127 CC(=O)NC1=C(C=CC(=C1)I)Cl Z1408462342 [0,2,0,0,0,0|2,0,0]=4 1764 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)C Z239120816 [0,2,0,0,0,0|2,0,0]=4 1765 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)Cl Z431580096 [0,2,0,0,0,0|2,0,0]=4 1766 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)F Z235362233 [0,2,0,0,0,0|2,0,0]=4 1767 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)O Z1198342725 [0,2,0,0,0,0|2,0,0]=4 1768 B12R1.127 CC(O)CC1=C(C=CC(=C1)F)Br Z992976478 [0,2,0,0,0,0|1,0,1]=4 1769 B12R1.127 CC1=C(C=C(C=C1)Br)CC(=O)O Z1269235842 [0,2,0,0,0,0|0,0,0]=2 1770 B12R1.127 CC1=C(C=C(C=C1)Br)NC(=O)N Z448250040 [0,2,0,0,0,0|2,0,0]=4 1771 B12R1.127 CC1=C(C=C(C=N1)Cl)CC(=O)O Z1255468613 [0,2,0,0,0,0|1,0,0]=3 1772 B12R1.127 CC1=CC(=C(C=C1)Br)CC(=O)O Z1269198963 [0,2,0,0,0,0|0,0,0]=2 1773 B12R1.127 CC1=CC(=C(C=C1)C)CC(=O)O Z234894443 [0,2,0,0,0,0|0,0,0]=2 1774 B12R1.127 CC1=CC(=C(C=C1)C)NC(=O)N Z56754686 [0,2,0,0,0,0|2,0,0]=4 1775 B12R1.127 CC1=CC(=C(C=C1)F)CC(=O)O Z982130030 [0,2,0,0,0,0|0,0,0]=2 1776 B12R1.127 CC1=CN(C(=O)C=C1)CC(=O)O Z1255387472 [0,2,0,0,0,0|1,0,0]=3 1777 B12R1.127 CC1=NC(=C(C=C1)Br)CC(=O)O Z1269158290 [0,2,0,0,0,0|1,0,0]=3 1778 B12R1.127 CC1=NN(C(=O)C=C1)CC(=O)O Z1041127720 [0,2,0,0,0,0|2,0,0]=4 1779 B12R1.127 CS(=O)CC1=C(C=CC(=C1)N)Cl Z802580894 [0,2,0,0,0,0|2,0,0]=4 1780 B12R1.127 NC(=O)CN1C=C(C=CC1=O)Br Z26317437 [0,2,0,0,0,0|2,0,0]=4 1781 B12R1.127 NC(=O)CN1C=C(C=CC1=O)N Z285226490 [0,2,0,0,0,0|2,0,0]=4 1782 B12R1.127 NC(=O)NC1=C(C=CC(=C1)I)Cl Z1410208208 [0,2,0,0,0,0|2,0,0]=4 1783 B12R1.127 NC(=O)NC1=C(C=CC(=C1)N)F Z239123692 [0,2,0,0,0,0|2,0,0]=4 1784 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)Br Z1269185355 [0,2,0,0,0,0|0,0,0]=2 1785 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)Cl Z1269155132 [0,2,0,0,0,0|0,0,0]=2 1786 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)F Z285225836 [0,2,0,0,0,0|0,0,0]=2 1787 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Cl)Br Z1269132555 [0,2,0,0,0,0|0,0,0]=2 1788 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)Br Z285131566 [0,2,0,0,0,0|0,0,0]=2 1789 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)F Z362118692 [0,2,0,0,0,0|0,0,0]=2 1790 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)O Z1255403749 [0,2,0,0,0,0|0,0,0]=2 1791 B12R1.127 O=C(O)CC1=C(C=CC(=C1)I)Br Z1269158801 [0,2,0,0,0,0|0,0,0]=2 1792 B12R1.127 O=C(O)CC1=C(C=CC(=C1)O)Br Z1269121921 [0,2,0,0,0,0|0,0,0]=2 1793 B12R1.127 O=C(O)CN1C=C(C=CC1=O)Br Z285172048 [0,2,0,0,0,0|1,0,0]=3 1794 B12R1.127 O=C(O)CN1C=C(C=CC1=O)F Z1251354038 [0,2,0,0,0,0|1,0,0]=3 1795 B12R1.127 O=C(O)CN1C=C(C=CC1=O)I Z1343908366 [0,2,0,0,0,0|1,0,0]=3 1796 B12R1.151 CC(C)(O)CC1=C(C=CC=C1)Br Z513707712 [0,2,0,0,0,0|1,0,1]=4 1797 B12R1.151 CC(C)(O)CC1=C(C=CC=C1)Cl Z513707752 [0,2,0,0,0,0|1,0,1]=4 1798 B12R1.151 CC1=C(C=CC=C1)CS(=O)(=O)N Z274590394 [0,2,0,0,0,0|1,0,1]=4 1799 B12R1.151 CS(=O)(=O)CC1=C(C=CC=C1)Br Z416894838 [0,2,0,0,0,0|1,0,1]=4 1800 B12R1.151 CS(=O)(=O)CC1=C(C=CC=C1)N Z732207950 [0,2,0,0,0,0|1,0,1]=4 1801 B12R1.151 CS(=O)(=O)CC1=C(C=CC=C1)O Z1513868900 [0,2,0,0,0,0|1,0,1]=4 1802 B12R1.151 NC1=C(C=CC=C1)CS(=O)(=O)N Z2289799371 [0,2,0,0,0,0|1,0,1]=4 1803 B12R1.151 NS(=O)(=O)CC1=C(C=CC=C1)Br Z734461494 [0,2,0,0,0,0|1,0,1]=4 1804 B12R1.151 NS(=O)(=O)CC1=C(C=CC=C1)Cl Z274590786 [0,2,0,0,0,0|1,0,1]=4 1805 B12R1.151 NS(=O)(=O)CC1=C(C=CC=C1)F Z274594156 [0,2,0,0,0,0|1,0,1]=4 1806 B12R1.151 NS(=O)(=O)CC1=C(C=CC=C1)I Z3300771595 [0,2,0,0,0,0|1,0,1]=4 1807 B12R1.151 O=S(=O)(F)CC1=C(C=CC=C1)Cl Z1362758794 [0,2,0,0,0,0|1,0,1]=4 1808 B12R1.151 O=S(=O)(F)CC1=C(C=CC=C1)F Z991722582 [0,2,0,0,0,0|1,0,1]=4 1809 B12R1.224 CC(=O)NC1=C(C(=CC=C1)Br)Cl Z2017822392 [0,2,0,0,0,0|2,0,0]=4 1810 B12R1.224 CC(=O)NC1=C(C(=CC=C1)Cl)C Z28292377 [0,2,0,0,0,0|2,0,0]=4 1811 B12R1.224 CC(=O)NC1=C(C(=CC=C1)N)C Z239122448 [0,2,0,0,0,0|2,0,0]=4 1812 B12R1.224 CC(O)CC1=C(C(=CC=C1)F)Br Z1295677298 [0,2,0,0,0,0|1,0,1]=4 1813 B12R1.224 CC1=C(C(=CC=C1)CC(=O)O)Br Z1269227300 [0,2,0,0,0,0|0,0,0]=2 1814 B12R1.224 CC1=C(C(=CC=C1)CC(=O)O)Cl Z1198264659 [0,2,0,0,0,0|0,0,0]=2 1815 B12R1.224 CC1=C(C(=CC=C1)NC(=O)N)C Z107732968 [0,2,0,0,0,0|2,0,0]=4 1816 B12R1.224 CC1=C(C=CC=C1Br)CC(=O)O Z1269111906 [0,2,0,0,0,0|0,0,0]=2 1817 B12R1.224 CC1=C(C=CC=C1I)NC(=O)N Z1638019250 [0,2,0,0,0,0|2,0,0]=4 1818 B12R1.224 CC1=C(C=CC=C1N)CS(=O)C Z802581006 [0,2,0,0,0,0|2,0,0]=4 1819 B12R1.224 CC1=CC=CN(C1=O)CC(=O)O Z1096152374 [0,2,0,0,0,0|1,0,0]=3 1820 B12R1.224 NC(=O)CC1=C(C(=CC=C1)Cl)F Z2169650265 [0,2,0,0,0,0|1,0,0]=3 1821 B12R1.224 NC(=O)NC1=C(C(=CC=C1)Cl)Br Z1837227078 [0,2,0,0,0,0|2,0,0]=4 1822 B12R1.224 NC(=O)NC1=C(C(=CC=C1)F)Cl Z2114437375 [0,2,0,0,0,0|2,0,0]=4 1823 B12R1.224 NC1=C(C(=CC=C1)CC(=O)O)N Z1551954875 [0,2,0,0,0,0|0,0,0]=2 1824 B12R1.224 NC1=CC=CN(C1=O)CC(=O)O Z1536942821 [0,2,0,0,0,0|1,0,0]=3 1825 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Br)Cl Z1269150472 [0,2,0,0,0,0|0,0,0]=2 1826 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Br)I Z1269162570 [0,2,0,0,0,0|0,0,0]=2 1827 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Cl)Cl Z982129970 [0,2,0,0,0,0|0,0,0]=2 1828 B12R1.224 O=C(O)CC1=C(C(=CC=C1)F)F Z445167096 [0,2,0,0,0,0|0,0,0]=2 1829 B12R1.224 O=C(O)CC1=C(C(=CC=C1)O)F Z1198218753 [0,2,0,0,0,0|0,0,0]=2 1830 B12R1.224 O=C(O)CC1=C(C(=O)NC=C1)Br Z1889916989 [0,2,0,0,0,0|1,0,0]=3 1831 B12R1.224 O=C(O)CN1C=CC=C(C1=O)O Z1262513138 [0,2,0,0,0,0|1,0,0]=3 1832 B12R1.1009 CC(=O)CC1=C(C=CC=C1Cl)Cl Z858029228 [0,2,0,0,0,0|1,0,0]=3 1833 B12R1.1009 CC(O)CC1=C(C=CC=C1Cl)Cl Z858029386 [0,2,0,0,0,0|1,0,1]=4 1834 B12R1.1009 CC1=C(C(=CC=C1)Cl)CC(=O)O Z1255430731 [0,2,0,0,0,0|0,0,0]=2 1835 B12R1.1009 CC1=C(C(=CC=C1)F)CC(=O)O Z1255489762 [0,2,0,0,0,0|0,0,0]=2 1836 B12R1.1009 CC1=CC=CC(=C1CC(=O)O)C Z1198167156 [0,2,0,0,0,0|0,0,0]=2 1837 B12R1.1009 CC1=NC=NC(=C1CC(=O)O)C Z2489383750 [0,2,0,0,0,0|2,0,0]=4 1838 B12R1.1009 N=C(N)CC1=C(C=CC=C1Cl)Cl Z1708089988 [0,2,0,0,0,0|2,0,0]=4 1839 B12R1.1009 N=C(N)CC1=C(C=CC=C1F)Cl Z1695906722 [0,2,0,0,0,0|2,0,0]=4 1840 B12R1.1009 NC(=O)CC1=C(C=CC=C1Cl)Cl Z33546774 [0,2,0,0,0,0|1,0,0]=3 1841 B12R1.1009 NC(=O)CC1=C(C=CC=C1F)Cl Z33546661 [0,2,0,0,0,0|1,0,0]=3 1842 B12R1.1009 NC(=O)CC1=C(C=CC=C1F)F Z1389112660 [0,2,0,0,0,0|1,0,0]=3 1843 B12R1.1009 NC(=O)NC1=C(C=CC=C1Cl)Cl Z1263622729 [0,2,0,0,0,0|2,0,0]=4 1844 B12R1.1009 O=C(O)CC1=C(C=CC=C1Cl)Br Z1551916621 [0,2,0,0,0,0|0,0,0]=2 1845 B12R1.1009 O=C(O)CC1=C(C=CC=C1Cl)Cl Z104478552 [0,2,0,0,0,0|0,0,0]=2 1846 B12R1.1009 O=C(O)CC1=C(C=CC=C1F)Cl Z57044264 [0,2,0,0,0,0|0,0,0]=2 1847 B12R1.1009 O=C(O)CC1=C(C=CC=C1F)F Z362118786 [0,2,0,0,0,0|0,0,0]=2 1848 B12R1.1009 O=C(O)CC1=C(C=NC=C1F)Cl Z1255367200 [0,2,0,0,0,0|1,0,0]=3 1849 B12R1.1009 O=C(O)CC1=C(N=CN=C1Cl)Cl Z1267819980 [0,2,0,0,0,0|2,0,0]=4 1850 B12R1.1009 O=C(O)CC1=C(N=CN=C1O)O Z1258932597 [0,2,0,0,0,0|2,0,0]=4 1851 B12R1.101 CC(=O)NC1=CC(=CC(=C1)C)C Z30889668 [0,2,0,0,0,0|2,0,0]=4 1852 B12R1.101 CC(=O)NC1=CC(=CC(=C1)Cl)Cl Z30181347 [0,2,0,0,0,0|2,0,0]=4 1853 B12R1.101 CC(=O)NC1=CC(=CC(=C1)I)I Z2078739597 [0,2,0,0,0,0|2,0,0]=4 1854 B12R1.101 CC(O)CC1=CC(=CC(=C1)F)Br Z1295686052 [0,2,0,0,0,0|1,0,1]=4 1855 B12R1.101 CC1=CC(=CC(=C1)CC(=O)O)C Z274447882 [0,2,0,0,0,0|0,0,0]=2 1856 B12R1.101 CC1=CC(=CC(=C1)F)NC(=O)N Z1295850516 [0,2,0,0,0,0|2,0,0]=4 1857 B12R1.101 NC(=O)NC1=CC(=CC(=C1)F)F Z198195676 [0,2,0,0,0,0|2,0,0]=4 1858 B12R1.101 NC1=CC(=CC(=C1)Br)CC(=O)O Z2732612288 [0,2,0,0,0,0|0,0,0]=2 1859 B12R1.101 O=C(O)CC1=CC(=CC(=C1)Cl)Cl Z1269159102 [0,2,0,0,0,0|0,0,0]=2 1860 B12R1.101 O=C(O)CC1=CC(=CC(=C1)F)Br Z1269139128 [0,2,0,0,0,0|0,0,0]=2 1861 B12R1.101 O=C(O)CC1=CC(=CC(=C1)I)I Z1269132492 [0,2,0,0,0,0|0,0,0]=2 1862 B12R1.101 O=C(O)CC1=CC(=CC(=C1)O)Br Z1269195529 [0,2,0,0,0,0|0,0,0]=2 1863 B12R1.101 O=C(O)CC1=CC(=O)NC(=O)N1 Z57046946 [0,2,0,0,0,0|2,0,0]=4 1864 B12R1.119 CC1=CC(=CC=C1)CS(=O)(=O)Cl Z271034376 [0,2,0,0,0,0|1,0,1]=4 1865 B12R1.119 CC1=CC(=CC=C1)CS(=O)(=O)F Z991703086 [0,2,0,0,0,0|1,0,1]=4 1866 B12R1.119 CC1=CC(=CC=C1)CS(=O)(=O)N Z274590020 [0,2,0,0,0,0|1,0,1]=4 1867 B12R1.119 CS(=O)(=O)CC1=CC(=CC=C1)N Z732207952 [0,2,0,0,0,0|1,0,1]=4 1868 B12R1.119 NC1=CC(=CC=C1)CS(=O)(=O)F Z3018074913 [0,2,0,0,0,0|1,0,1]=4 1869 B12R1.119 NC1=CC(=CC=C1)CS(=O)(=O)N Z406717276 [0,2,0,0,0,0|1,0,1]=4 1870 B12R1.119 NS(=O)(=O)CC1=CC(=CC=C1)Br Z734461516 [0,2,0,0,0,0|1,0,1]=4 1871 B12R1.119 NS(=O)(=O)CC1=CC(=CC=C1)Cl Z274588496 [0,2,0,0,0,0|1,0,1]=4 1872 B12R1.119 NS(=O)(=O)CC1=CC(=CC=C1)F Z385450912 [0,2,0,0,0,0|1,0,1]=4 1873 B12R1.438 C#CC1=CC=CC(=C1)NC(=O)N Z316107698 [0,2,0,0,0,0|2,0,0]=4 1874 B12R1.438 CC(=O)NC1=CC(=CC=C1)C#N Z26548069 [0,2,0,0,0,0|2,0,0]=4 1875 B12R1.438 CC(=O)NC1=CC(=CC=C1)C=O Z1238570824 [0,2,0,0,0,0|2,0,0]=4 1876 B12R1.438 CC(=O)NC1=CC(=CC=C1)CN Z239097364 [0,2,0,0,0,0|2,0,0]=4 1877 B12R1.438 CC(=O)NC1=CC(=CC=C1)CO Z28913035 [0,2,0,0,0,0|2,0,0]=4 1878 B12R1.438 CCC1=CC(=CC=C1)CC(=O)O Z1198264513 [0,2,0,0,0,0|0,0,0]=2 1879 B12R1.438 COC1=CC(=CC=C1)CC(=N)N Z951367838 [0,2,0,0,0,0|2,0,0]=4 1880 B12R1.438 COC1=CC(=CC=C1)CC(=O)N Z33547068 [0,2,0,0,0,0|1,0,0]=3 1881 B12R1.438 COC1=CC(=CC=C1)CC(=O)O Z104478986 [0,2,0,0,0,0|0,0,0]=2 1882 B12R1.438 COC1=CC(=CC=C1)NC(=O)C Z27795266 [0,2,0,0,0,0|2,0,0]=4 1883 B12R1.438 COC1=NC=CC(=C1)CC(=O)O Z2186882871 [0,2,0,0,0,0|1,0,0]=3 1884 B12R1.438 N#CC1=CC=CC(=C1)CC(=O)O Z982130150 [0,2,0,0,0,0|0,0,0]=2 1885 B12R1.438 N#CC1=CN=CC(=C1)CC(=O)O Z1255398377 [0,2,0,0,0,0|1,0,0]=3 1886 B12R1.438 NCC1=CC(=CC=C1)NC(=O)N Z228589074 [0,2,0,0,0,0|2,0,0]=4 1887 B12R1.438 O=CC1=CC=CC(=C1)CC(=O)O Z1262512246 [0,2,0,0,0,0|0,0,0]=2 1888 B10R1.66 O=C(O)/C=C/C1=CC=CN1 Z1198166880 [0,0,1,1,0,0|1,0,1]=4 1889 B10R1.66 O=C(O)/C=C/C1=CC=CO1 Z2311574202 [0,0,1,1,0,0|1,0,1]=4 1890 B10R1.66 O=C(O)/C=C/C1=CC=CS1 Z56855126 [0,0,1,1,0,0|1,0,1]=4 1891 B10R1.66 O=C(O)/C=C/C1=CNC=C1 Z1203733427 [0,0,1,1,0,0|1,0,1]=4 1892 B10R1.66 O=C(O)/C=C/C1=CSC=C1 Z2417572197 [0,0,1,1,0,0|1,0,1]=4 1893 B10R1.66 O=C(O)CCC1=CC=CS1 Z57052863 [0,0,1,1,0,0|1,0,1]=4 1894 B10R1.66 O=C(O)CCC1=COC=C1 Z1098234501 [0,0,1,1,0,0|1,0,1]=4 1895 B10R1.66 O=C(O)CCC1=CSC=C1 Z85923469 [0,0,1,1,0,0|1,0,1]=4 1896 B10R1.66 O=C(O)CCN1C=CC=C1 Z245326706 [0,0,1,1,0,0|1,0,1]=4 1897 B10R1.66 O=C(O)COC1=CSC=C1 Z1262541445 [0,0,1,1,0,0|2,0,0]=4 1898 B10R2.6 C1=CC(=CC=N1)C2CO2 Z1187818726 [1,0,0,1,0,0|1,0,1]=4 1899 B10R2.6 C1=CC(=CN=C1)C2CO2 Z1187818722 [1,0,0,1,0,0|1,0,1]=4 1900 B10R2.6 C1=CC=C(C=C1)C2CO2 Z104486008 [1,0,0,1,0,0|0,0,1]=3 1901 B10R2.6 C1=CC=C(C=C1)[C@@H]2CO2 Z1255356265 [1,0,0,1,0,0|0,0,1]=3 1902 B10R2.6 C1=CC=C(C=C1)[C@H]2CO2 Z1255390768 [1,0,0,1,0,0|0,0,1]=3 1903 B10R2.6 C1=CN=C(C=C1)C2CO2 Z1187818707 [1,0,0,1,0,0|1,0,1]=4 1904 B10R2.7 C1=CC2=C(C=C1)CC=C2 Z104476162 [1,0,0,1,0,0|1,0,0]=3 1905 B10R2.7 C1=CC2=C(C=C1)CNC2 Z1263820391 [1,0,0,1,0,0|2,0,0]=4 1906 B10R2.7 C1=CC2=C(C=C1)COC2 Z839134770 [1,0,0,1,0,0|2,0,0]=4 1907 B10R2.7 C1=CC2=C(C=C1)NC=C2 Z57833933 [1,0,0,1,0,0|1,0,1]=4 1908 B10R2.7 C1=CC2=C(C=C1)NC=N2 Z57069879 [1,0,0,1,0,0|2,0,0]=4 1909 B10R2.7 C1=CC2=C(C=C1)NCC2 Z104475582 [1,0,0,1,0,0|1,0,1]=4 1910 B10R2.7 C1=CC2=C(C=C1)OC=C2 Z56347207 [1,0,0,1,0,0|0,0,1]=3 1911 B10R2.7 C1=CC2=C(C=C1)OCC2 Z104505448 [1,0,0,1,0,0|0,0,1]=3 1912 B10R2.7 C1=CC2=C(C=C1)ON=C2 Z220335556 [1,0,0,1,0,0|1,0,1]=4 1913 B10R2.7 C1=CC2=C(C=C1)SC=C2 Z370711590 [1,0,0,1,0,0|0,1,1]=4 1914 B10R2.7 C1=CC2=C(C=C1)SC=N2 Z104472964 [1,0,0,1,0,0|1,1,0]=4 1915 B10R2.7 C1=CC2=C(C=CO2)N=C1 Z2831987589 [1,0,0,1,0,0|1,0,1]=4 1916 B10R2.7 C1=CC2=C(C=N1)CCO2 Z1681336163 [1,0,0,1,0,0|1,0,1]=4 1917 B10R2.320 NC1CC2=C1C=CC=C2 Z1918018858 [1,0,0,1,0,0|1,0,1]=4 1918 B12R2.22 O=C1CC(C1)C2=CC=CC=C2 Z336080338 [0,0,0,1,0,1|1,0,0]=3 1919 B12R2.22 O=C1CC(N1)C2=CC=CC=C2 Z367677412 [0,0,0,1,0,1|1,0,0]=3 1920 B12R2.22 OC1CC(C1)C2=CC=CC=C2 Z501748204 [0,0,0,1,0,1|1,0,1]=4 1921 B12R2.22 O[C@H]1C[C@H](C1)C2=CC=CC=C2 Z1504675336 [0,0,0,1,0,1|1,0,1]=4 1922 B12R2.24 CC1=NC2=C(C=CC=C2)SC1 Z2895174345 [0,0,0,1,0,1|2,0,0]=4 1923 B12R2.24 CC1CNC2=C(O1)C=CC=C2 Z1165160777 [0,0,0,1,0,1|1,0,1]=4 1924 B12R2.24 NC1=NC2=C(C=CC=C2)CS1 Z1198725303 [0,0,0,1,0,1|2,0,0]=4 1925 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Z1203731786 [0,0,0,1,0,1|1,0,1]=4 1926 B12R2.24 O=C1C=CC2=C(N1)C=CC=C2 Z57473020 [0,0,0,1,0,1|1,0,1]=4 1927 B12R2.24 O=C1C=CC2=C(O1)C=CC=C2 Z57169486 [0,0,0,1,0,1|0,0,1]=3 1928 B12R2.24 O=C1C=NC2=C(N1)C=CC=C2 Z56824051 [0,0,0,1,0,1|1,0,1]=4 1929 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 Z1201622353 [0,0,0,1,0,1|1,0,0]=3 1930 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 Z1255486033 [0,0,0,1,0,1|1,0,0]=3 1931 B12R2.24 O=C1CCC2=C(C1)C=CC=C2 Z104495562 [0,0,0,1,0,1|1,0,0]=3 1932 B12R2.24 O=C1CCC2=C(N1)C=CC=C2 Z85917566 [0,0,0,1,0,1|1,0,0]=3 1933 B12R2.24 O=C1CCC2=C(O1)C=CC=C2 Z586249466 [0,0,0,1,0,1|0,0,0]=2 1934 B12R2.24 O=C1CNC2=C(N1)C=CC=C2 Z56990723 [0,0,0,1,0,1|1,0,0]=3 1935 B12R2.24 O=C1CNC2=C(N1)C=CC=N2 Z1142668508 [0,0,0,1,0,1|2,0,0]=4 1936 B12R2.24 O=C1CNC2=C(N1)C=NC=C2 Z916962704 [0,0,0,1,0,1|2,0,0]=4 1937 B12R2.24 O=C1COC2=C(N1)C=CC=C2 Z56989567 [0,0,0,1,0,1|1,0,0]=3 1938 B12R2.24 O=C1COC2=C(N1)C=CC=N2 Z1198157043 [0,0,0,1,0,1|2,0,0]=4 1939 B12R2.24 O=C1COC2=C(N1)C=NC=C2 Z1198175968 [0,0,0,1,0,1|2,0,0]=4 1940 B12R2.24 O=C1COC2=C(N1)N=CC=C2 Z1255378941 [0,0,0,1,0,1|2,0,0]=4 1941 B12R2.24 O=C1CSC2=C(N1)C=CC=C2 Z55120717 [0,0,0,1,0,1|1,0,0]=3 1942 B12R2.24 O=C1CSC2=C(N1)C=NC=C2 Z1354601902 [0,0,0,1,0,1|2,0,0]=4 1943 B12R2.24 O=C1CSC2=C(N1)N=CC=C2 Z2872690909 [0,0,0,1,0,1|2,0,0]=4 1944 B12R2.24 O=C1N=CC2=C(N1)C=CC=C2 Z1198176626 [0,0,0,1,0,1|1,0,1]=4 1945 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 Z1198157416 [0,0,0,1,0,1|1,0,0]=3 1946 B12R2.24 O=C1NCC2=C(N1)C=NC=C2 Z4560521307 [0,0,0,1,0,1|2,0,0]=4 1947 B12R2.24 O=C1NCC2=C(O1)C=CC=C2 Z1198723657 [0,0,0,1,0,1|0,0,0]=2 1948 B12R2.24 OC1=CC2=C(C=CC=C2)C=C1 Z57127515 [0,0,0,1,0,1|1,0,1]=4 1949 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 Z1255419538 [0,0,0,1,0,1|1,0,1]=4 1950 B12R2.24 OC1CCC2=C(C1)C=CC=C2 Z445987178 [0,0,0,1,0,1|1,0,1]=4 1951 B12R2.24 OC1CNC2=C(C1)C=CC=C2 Z1198341064 [0,0,0,1,0,1|1,0,1]=4 1952 B12R2.24 S=C1NC2=C(C=CC=C2)CS1 Z367678726 [0,0,0,1,0,1|1,1,0]=4 1953 B12R2.2057 C1=CC=C(C=C1)CCC2CO2 Z1033258586 [0,0,0,1,0,1|1,0,1]=4 1954 B12R2.2057 C1=CC=C(C=C1)OCC2CO2 Z57358969 [0,0,0,1,0,1|1,0,1]=4 1955 B12R2.2057 C1=CC=C(C=C1)SCC2CO2 Z330820010 [0,0,0,1,0,1|1,0,1]=4 1956 B12R2.2403 CC1(CCC2=C1C=CC=C2)O Z449370928 [0,0,0,1,0,1|1,0,1]=4 1957 B12R2.2403 N=S1(=O)CCC2=C1C=CC=C2 Z2514148544 [0,0,0,1,0,1|2,0,0]=4 1958 B12R2.2403 O=S1(=O)NCC2=C1C=CC=C2 Z1198162686 [0,0,0,1,0,1|1,0,1]=4 1959 B12R2.3190 N=C(N)C1CC2=C1C=CC=C2 Z1613477992 [0,0,0,1,0,1|2,0,0]=4 1960 B12R2.1041 O=C1N=C2C=CC=CC=C2N1 Z1509141704 [0,0,0,1,0,1|2,0,0]=4 1961 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)Cl Z3074487523 [0,1,0,1,0,0|1,0,1]=4 1962 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)F Z2527567177 [0,1,0,1,0,0|1,0,1]=4 1963 B12R2.294 BrC1=CC=C(C=C1)CC2CO2 Z2523466484 [0,1,0,1,0,0|1,0,1]=4 1964 B12R2.294 FC1=CC=C(C=C1)CC2CO2 Z1495386285 [0,1,0,1,0,0|1,0,1]=4 1965 B12R2.606 CC1=CC2=C(C=C1)N=C(O2)N Z979487656 [0,1,0,1,0,0|2,0,0]=4 1966 B12R2.606 CC1=CC2=C(C=C1)NC(=N)C2 Z4603464626 [0,1,0,1,0,0|2,0,0]=4 1967 B12R2.606 CC1=CC2=C(C=C1)OC(=N2)S Z56864608 [0,1,0,1,0,0|1,1,0]=4 1968 B12R2.606 CC1=CC2=C(C=C1)OC(=O)N2 Z274568258 [0,1,0,1,0,0|1,0,0]=3 1969 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)Br Z1269240413 [0,1,0,1,0,0|1,0,1]=4 1970 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)I Z1269130980 [0,1,0,1,0,0|1,0,1]=4 1971 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)N Z2106607528 [0,1,0,1,0,0|1,0,1]=4 1972 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)N Z235353833 [0,1,0,1,0,0|2,0,0]=4 1973 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)O Z1201620245 [0,1,0,1,0,0|2,0,0]=4 1974 B12R2.606 CC1=NC2=C(O1)C=CC(=C2)Br Z1203159513 [0,1,0,1,0,0|2,0,0]=4 1975 B12R2.606 CC1=NC2=C(O1)C=CC(=C2)Cl Z104486454 [0,1,0,1,0,0|2,0,0]=4 1976 B12R2.606 CC1CC2=C(O1)C=CC(=C2)Br Z409451514 [0,1,0,1,0,0|1,0,1]=4 1977 B12R2.606 CC1CC2=C(O1)C=CC(=C2)N Z2888802910 [0,1,0,1,0,0|1,0,1]=4 1978 B12R2.606 CC1CC2=C(O1)C=CC(=C2)O Z1513815985 [0,1,0,1,0,0|1,0,1]=4 1979 B12R2.606 FC1=CC2=C(C=C1)N=C(O2)S Z1147226283 [0,1,0,1,0,0|1,1,0]=4 1980 B12R2.606 N=C1OC2=C(S1)C=C(C=C2)O Z1513863695 [0,1,0,1,0,0|2,0,0]=4 1981 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 Z2805701617 [0,1,0,1,0,0|1,0,0]=3 1982 B12R2.606 NC1=CC2=C(C=C1)CC(C2)O Z1203581059 [0,1,0,1,0,0|1,0,1]=4 1983 B12R2.606 NC1=CC2=C(C=C1)N=C(O2)S Z1198180819 [0,1,0,1,0,0|1,1,0]=4 1984 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 Z2768165443 [0,1,0,1,0,0|1,0,0]=3 1985 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 Z56793257 [0,1,0,1,0,0|2,0,0]=4 1986 B12R2.606 NC1=CC2=C(C=C1)NC(=O)S2 Z1270210776 [0,1,0,1,0,0|1,1,0]=4 1987 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 Z56944506 [0,1,0,1,0,0|1,0,0]=3 1988 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)Br Z1269173847 [0,1,0,1,0,0|2,0,0]=4 1989 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)F Z1147226282 [0,1,0,1,0,0|2,0,0]=4 1990 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Br Z359373114 [0,1,0,1,0,0|2,0,0]=4 1991 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Cl Z89267039 [0,1,0,1,0,0|2,0,0]=4 1992 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)F Z979487600 [0,1,0,1,0,0|2,0,0]=4 1993 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Cl Z56922083 [0,1,0,1,0,0|1,0,0]=3 1994 B12R2.606 O=C1CC2=C(N1)C=C(C=N2)Br Z1269225776 [0,1,0,1,0,0|2,0,0]=4 1995 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Br Z299596076 [0,1,0,1,0,0|1,0,0]=3 1996 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Cl Z104477028 [0,1,0,1,0,0|1,0,0]=3 1997 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)F Z1255450667 [0,1,0,1,0,0|1,0,0]=3 1998 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [0,1,0,1,0,0|1,0,0]=3 1999 B12R2.606 O=C1NC2=C(N1)C=C(C=C2)F Z1198165756 [0,1,0,1,0,0|2,0,0]=4 2000 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Br Z381351238 [0,1,0,1,0,0|1,0,0]=3 2001 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Cl Z99599674 [0,1,0,1,0,0|1,0,0]=3 2002 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)I Z1269166325 [0,1,0,1,0,0|1,0,0]=3 2003 B12R2.606 O=C1NC2=C(O1)C=C(C=N2)Br Z1269188809 [0,1,0,1,0,0|2,0,0]=4 2004 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Br Z979488024 [0,1,0,1,0,0|1,0,0]=3 2005 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Cl Z57183224 [0,1,0,1,0,0|1,0,0]=3 2006 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)F Z979487984 [0,1,0,1,0,0|1,0,0]=3 2007 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)O Z1198314975 [0,1,0,1,0,0|1,0,0]=3 2008 B12R2.606 O=C1NC2=C(S1)C=CC(=C2)F Z1198222395 [0,1,0,1,0,0|1,1,0]=4 2009 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)Br Z1269212344 [0,1,0,1,0,0|1,0,0]=3 2010 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)O Z1198726972 [0,1,0,1,0,0|1,0,0]=3 2011 B12R2.606 O=C1OC2=C(S1)C=C(C=C2)O Z56801267 [0,1,0,1,0,0|1,0,0]=3 2012 B12R2.606 O=C1OC2=C(S1)C=CC(=C2)O Z104483034 [0,1,0,1,0,0|1,0,0]=3 2013 B12R2.606 OC1=CC2=C(C=C1)CC(C2)O Z1198729229 [0,1,0,1,0,0|1,0,1]=4 2014 B12R2.606 OC1CC2=C(C1)C=C(C=C2)Cl Z1489210921 [0,1,0,1,0,0|1,0,1]=4 2015 B12R2.606 OC1CC2=C(C1)C=C(C=C2)F Z1862026143 [0,1,0,1,0,0|1,0,1]=4 2016 B12R2.606 SC1=NC2=C(O1)C=C(C=C2)Cl Z56969312 [0,1,0,1,0,0|1,1,0]=4 2017 B12R2.606 SC1=NC2=C(O1)C=CC(=C2)Cl Z56824483 [0,1,0,1,0,0|1,1,0]=4 2018 B12R2.18 CC1C(=O)NC2=C1C=CC=C2 Z425452744 [0,1,0,1,0,0|1,0,0]=3 2019 B12R2.18 CC1C2=C(C=CC=C2)CC1O Z1349231024 [0,1,0,1,0,0|1,0,1]=4 2020 B12R2.18 CC1CC2=C(C1=O)C=CC=C2 Z854042930 [0,1,0,1,0,0|1,0,1]=4 2021 B12R2.18 CC1OC2=C(C1N)C=CC=C2 Z2160887371 [0,1,0,1,0,0|1,0,1]=4 2022 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 Z56899025 [0,1,0,1,0,0|1,0,0]=3 2023 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 Z57070418 [0,1,0,1,0,0|2,0,0]=4 2024 B12R2.18 NC1CC2=C(C1=O)C=CC=C2 Z1551475987 [0,1,0,1,0,0|1,0,1]=4 2025 B12R2.18 NC1CC2=C(C1O)C=CC=C2 Z1431905060 [0,1,0,1,0,0|1,0,1]=4 2026 B12R2.18 NN1CC2=C(C1=O)C=CC=C2 Z1953500024 [0,1,0,1,0,0|2,0,0]=4 2027 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O Z784894996 [0,1,0,1,0,0|1,0,1]=4 2028 B12R2.18 N[C@@H]1CC2=C([C@H]1O)C=CC=C2 Z2307327484 [0,1,0,1,0,0|1,0,1]=4 2029 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@@H]1O Z4663003875 [0,1,0,1,0,0|1,0,1]=4 2030 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O Z803127638 [0,1,0,1,0,0|1,0,1]=4 2031 B12R2.18 O=C1C2=C(C=CC=C2)CC1Cl Z854067258 [0,1,0,1,0,0|1,0,1]=4 2032 B12R2.18 O=C1NC2=C(C1=O)C=CC=C2 Z57127903 [0,1,0,1,0,0|1,0,1]=4 2033 B12R2.18 O=C1NC2=C(C1O)C=CC=C2 Z335244966 [0,1,0,1,0,0|1,0,0]=3 2034 B12R2.18 O=C1NC2=C(N1O)C=CC=C2 Z1416184382 [0,1,0,1,0,0|1,0,0]=3 2035 B12R2.18 O=C1SC2=C(C1=O)C=CC=C2 Z1198153623 [0,1,0,1,0,0|0,1,1]=4 2036 B12R2.18 OC1C2=C(C=CC=C2)CC1Br Z104485720 [0,1,0,1,0,0|1,0,1]=4 2037 B12R2.18 OC1C2=C(C=CC=C2)CC1F Z1509011291 [0,1,0,1,0,0|1,0,1]=4 2038 B12R2.23 O=C1CCN1C2=CC=CC=C2 Z1198221109 [0,1,0,1,0,0|2,0,0]=4 2039 B12R2.2075 CC(C1=CC=CC=C1)C2CO2 Z1020679814 [0,1,0,1,0,0|1,0,1]=4 2040 B12R2.27 O=C[C@@H]1C[C@H]1C2=CC=CC=C2 Z2298064271 [0,1,0,1,0,0|1,0,1]=4 2041 B12R2.27 OCC1OC1C2=CC=CC=C2 Z1509054538 [0,1,0,1,0,0|0,0,2]=4 2042 B12R2.32 CNC1=NC2=C(O1)C=CC=C2 Z235341203 [0,1,0,1,0,0|2,0,0]=4 2043 B12R2.32 ClCC1CC2=C(O1)C=CC=C2 Z397587656 [0,1,0,1,0,0|1,0,1]=4 2044 B12R2.32 N#CC1=CC2=C(O1)C=CC=C2 Z381355152 [0,1,0,1,0,0|1,0,1]=4 2045 B12R2.32 N#CC1=NC2=C(O1)C=CC=C2 Z1198309541 [0,1,0,1,0,0|2,0,0]=4 2046 B12R2.32 NCC1=NC2=C(O1)C=CC=C2 Z2106602610 [0,1,0,1,0,0|2,0,0]=4 2047 B12R2.32 NCC1CC2=C(O1)C=CC=C2 Z291234246 [0,1,0,1,0,0|1,0,1]=4 2048 B12R2.32 NNC1=NC2=C(O1)C=CC=C2 Z56801289 [0,1,0,1,0,0|2,0,0]=4 2049 B12R2.32 O=CC1=CC2=C(N1)C=CC=C2 Z1203160203 [0,1,0,1,0,0|1,0,1]=4 2050 B12R2.32 O=CC1=CC2=C(O1)C=CC=C2 Z147641868 [0,1,0,1,0,0|0,0,1]=3 2051 B12R2.32 O=CC1=CC2=C(O1)C=CC=N2 Z1198330026 [0,1,0,1,0,0|1,0,1]=4 2052 B12R2.32 O=CC1=CC2=C(O1)C=CN=C2 Z1255417643 [0,1,0,1,0,0|1,0,1]=4 2053 B12R2.32 O=CC1=CC2=C(O1)N=CC=C2 Z1255505540 [0,1,0,1,0,0|1,0,1]=4 2054 B12R2.32 O=CC1=CC2=C(S1)C=CC=C2 Z1741961424 [0,1,0,1,0,0|0,1,1]=4 2055 B12R2.32 O=CC1=NC2=C(N1)C=CC=C2 Z57114985 [0,1,0,1,0,0|2,0,0]=4 2056 B12R2.32 O=CC1=NC2=C(O1)C=CC=C2 Z1198162173 [0,1,0,1,0,0|1,0,0]=3 2057 B12R2.32 O=CC1=NC2=C(S1)C=CC=C2 Z276151160 [0,1,0,1,0,0|1,1,0]=4 2058 B12R2.32 O=CC1CC2=C(C1)C=CC=C2 Z1255436588 [0,1,0,1,0,0|1,0,1]=4 2059 B12R2.32 O=CN1CC2=C(C1)C=CC=C2 Z1216818057 [0,1,0,1,0,0|2,0,0]=4 2060 B12R2.32 O=NN1CC2=C(C1)C=CC=C2 Z1726150542 [0,1,0,1,0,0|2,0,0]=4 2061 B12R2.32 OCC1=CC2=C(O1)C=CC=C2 Z164677912 [0,1,0,1,0,0|0,0,2]=4 2062 B12R2.32 OCC1=CC2=C(S1)C=CC=C2 Z816841922 [0,1,0,1,0,0|0,1,1]=4 2063 B12R2.32 OCC1=NC2=C(N1)C=CC=C2 Z56791635 [0,1,0,1,0,0|2,0,0]=4 2064 B12R2.32 OCC1=NC2=C(O1)C=CC=C2 Z431953250 [0,1,0,1,0,0|1,0,1]=4 2065 B12R2.32 OCC1=NC2=C(S1)C=CC=C2 Z56899191 [0,1,0,1,0,0|1,1,0]=4 2066 B12R2.32 OCC1CC2=C(C1)C=CC=C2 Z1198176601 [0,1,0,1,0,0|1,0,1]=4 2067 B12R2.32 OCC1CC2=C(O1)C=CC=C2 Z397587206 [0,1,0,1,0,0|0,0,2]=4 2068 B12R2.95 O=S1(=O)CC2=C(N1)C=CC=C2 Z1171481793 [0,1,0,1,0,0|1,0,1]=4 2069 B12R2.202 CC1=C2N=C(SC2=CC=C1)O Z1198163380 [0,1,0,1,0,0|1,1,0]=4 2070 B12R2.202 CC1=C2NC(=O)CC2=CC=C1 Z1198159857 [0,1,0,1,0,0|1,0,0]=3 2071 B12R2.202 CC1=C2NC(=O)NC2=CC=C1 Z1198176895 [0,1,0,1,0,0|2,0,0]=4 2072 B12R2.202 CC1=C2OC(=NC2=CC=C1)N Z1251362841 [0,1,0,1,0,0|2,0,0]=4 2073 B12R2.202 CC1=C2OC(=O)NC2=CC=C1 Z1255416550 [0,1,0,1,0,0|1,0,0]=3 2074 B12R2.202 CC1=C2SC(=O)NC2=CC=C1 Z1198222422 [0,1,0,1,0,0|1,1,0]=4 2075 B12R2.202 CC1=CC2=C(O1)C(=CC=C2)Br Z1269204422 [0,1,0,1,0,0|1,0,1]=4 2076 B12R2.202 CC1=NC2=C(O1)C=CC=C2N Z1201624543 [0,1,0,1,0,0|2,0,0]=4 2077 B12R2.202 CC1CC2=C(O1)C(=CC=C2)Cl Z803153168 [0,1,0,1,0,0|1,0,1]=4 2078 B12R2.202 FC1=C2N=C(OC2=CC=C1)S Z1869902596 [0,1,0,1,0,0|1,1,0]=4 2079 B12R2.202 NC1=C2NC(=O)CC2=CC=C1 Z1203579747 [0,1,0,1,0,0|1,0,0]=3 2080 B12R2.202 NC1=C2NC(=O)NC2=CC=C1 Z1741972722 [0,1,0,1,0,0|2,0,0]=4 2081 B12R2.202 NC1=C2OC(=O)NC2=CC=C1 Z1198223473 [0,1,0,1,0,0|1,0,0]=3 2082 B12R2.202 NC1=NC2=C(O1)C(=CC=C2)Br Z1269218339 [0,1,0,1,0,0|2,0,0]=4 2083 B12R2.202 NC1=NC2=C(O1)C=CC=C2O Z1258981820 [0,1,0,1,0,0|2,0,0]=4 2084 B12R2.202 O=C1CC2=C(C=CC=C2N1)Br Z1269158294 [0,1,0,1,0,0|1,0,0]=3 2085 B12R2.202 O=C1CC2=C(C=CC=C2N1)O Z1198161564 [0,1,0,1,0,0|1,0,0]=3 2086 B12R2.202 O=C1CC2=CC=CC(=C2N1)Br Z1269179204 [0,1,0,1,0,0|1,0,0]=3 2087 B12R2.202 O=C1CC2=CC=CC(=C2O1)Br Z2489234207 [0,1,0,1,0,0|0,0,0]=2 2088 B12R2.202 O=C1NC2=C(C=CC=C2O1)Br Z1509211819 [0,1,0,1,0,0|1,0,0]=3 2089 B12R2.202 O=C1NC2=CC=CC(=C2N1)Br Z1269197007 [0,1,0,1,0,0|2,0,0]=4 2090 B12R2.202 O=C1NC2=CC=CC(=C2N1)F Z1575308465 [0,1,0,1,0,0|2,0,0]=4 2091 B12R2.202 O=C1NC2=CC=CC(=C2N1)O Z1504677969 [0,1,0,1,0,0|2,0,0]=4 2092 B12R2.202 O=C1NC2=CC=CC(=C2O1)Br Z1269211846 [0,1,0,1,0,0|1,0,0]=3 2093 B12R2.202 O=C1NC2=CC=CC(=C2O1)F Z1255387806 [0,1,0,1,0,0|1,0,0]=3 2094 B12R2.202 O=C1NC2=CC=CC(=C2S1)F Z1198222418 [0,1,0,1,0,0|1,1,0]=4 2095 B12R2.202 OC1=C2N=C(OC2=CC=C1)S Z3235037659 [0,1,0,1,0,0|1,1,0]=4 2096 B12R2.202 OC1=CC=CC2=C1N=C(O2)O Z1322795564 [0,1,0,1,0,0|1,0,1]=4 2097 B12R2.202 OC1=NC2=C(N1)C=CC=C2Cl Z1245791555 [0,1,0,1,0,0|2,0,0]=4 2098 B12R2.202 SC1=NC2=C(O1)C(=CC=C2)Cl Z1720684812 [0,1,0,1,0,0|1,1,0]=4 2099 B12R2.225 BrC1=C(C=CC=C1)CC2CO2 Z1269241605 [0,1,0,1,0,0|1,0,1]=4 2100 B12R2.80 C[C@@H]1O[C@H]1C2=CC(=CC=C2)Cl Z2525216417 [0,1,0,1,0,0|1,0,1]=4 2101 B12R2.1286 ClC1=CC(=CC=C1)CC2CO2 Z1495386153 [0,1,0,1,0,0|1,0,1]=4 2102 B12R2.1286 FC1=CC(=CC=C1)CC2CO2 Z1495386186 [0,1,0,1,0,0|1,0,1]=4 2103 B12R3.12 C1=CC2=C(C=C1)C3OC3C2 Z278165226 [0,0,0,2,0,0|1,0,1]=4 2104 B8R1.8 O=CCC1=CC=CO1 Z1179944709 [1,0,0,0,1,0|1,0,0]=3 2105 B8R1.8 O=CCC1=CC=CS1 Z993017816 [1,0,0,0,1,0|1,0,0]=3 2106 B8R1.8 O=CCC1=CSC=C1 Z1079442684 [1,0,0,0,1,0|1,0,0]=3 2107 B8R1.8 OCCC1=CC=CO1 Z1179944660 [1,0,0,0,1,0|1,0,1]=4 2108 B8R1.8 OCCC1=CC=CS1 Z397587354 [1,0,0,0,1,0|1,0,1]=4 2109 B8R1.8 OCCC1=COC=C1 Z1179944659 [1,0,0,0,1,0|1,0,1]=4 2110 B8R1.8 OCCC1=CSC=C1 Z397587098 [1,0,0,0,1,0|1,0,1]=4 2111 B8R1.7 CC(=O)C1=CC=CN1 Z56899162 [0,0,0,0,2,0|2,0,0]=4 2112 B8R1.7 CC(=O)C1=CC=CS1 Z57127896 [0,0,0,0,2,0|2,0,0]=4 2113 B8R1.7 CC(=O)C1=CNC=C1 Z1154253452 [0,0,0,0,2,0|2,0,0]=4 2114 B8R1.7 CC(=O)C1=COC=C1 Z1137167495 [0,0,0,0,2,0|2,0,0]=4 2115 B8R1.7 CC(=O)C1=CSC=C1 Z513734012 [0,0,0,0,2,0|2,0,0]=4 2116 B8R1.7 NC(=O)C1=CC=CN1 Z135897752 [0,0,0,0,2,0|2,0,0]=4 2117 B8R1.7 NC(=O)C1=CC=CO1 Z33546471 [0,0,0,0,2,0|2,0,0]=4 2118 B8R1.7 NC(=O)C1=CC=CS1 Z33546758 [0,0,0,0,2,0|2,0,0]=4 2119 B8R1.7 NC(=O)C1=CNC=C1 Z1167406084 [0,0,0,0,2,0|2,0,0]=4 2120 B8R1.7 NC(=O)C1=COC=C1 Z168362720 [0,0,0,0,2,0|2,0,0]=4 2121 B8R1.7 NC(=O)C1=CSC=C1 Z82670330 [0,0,0,0,2,0|2,0,0]=4 2122 B8R1.7 O=C(Cl)C1=CC=CS1 Z168827498 [0,0,0,0,2,0|2,0,0]=4 2123 B8R1.7 O=C(O)C1=CC=CN1 Z94599900 [0,0,0,0,2,0|1,0,0]=3 2124 B8R1.7 O=C(O)C1=CC=CO1 Z104473462 [0,0,0,0,2,0|1,0,0]=3 2125 B8R1.7 O=C(O)C1=CC=NO1 Z56943419 [0,0,0,0,2,0|2,0,0]=4 2126 B8R1.7 O=C(O)C1=CC=NS1 Z1079264356 [0,0,0,0,2,0|2,0,0]=4 2127 B8R1.7 O=C(O)C1=CN=CN1 Z993967082 [0,0,0,0,2,0|2,0,0]=4 2128 B8R1.7 O=C(O)C1=CN=CO1 Z204020264 [0,0,0,0,2,0|2,0,0]=4 2129 B8R1.7 O=C(O)C1=CN=CS1 Z204146918 [0,0,0,0,2,0|2,0,0]=4 2130 B8R1.7 O=C(O)C1=CNC=C1 Z1154253207 [0,0,0,0,2,0|1,0,0]=3 2131 B8R1.7 O=C(O)C1=CNN=C1 Z275128380 [0,0,0,0,2,0|2,0,0]=4 2132 B8R1.7 O=C(O)C1=COC=C1 Z164706016 [0,0,0,0,2,0|1,0,0]=3 2133 B8R1.7 O=C(O)C1=COC=N1 Z1095349994 [0,0,0,0,2,0|2,0,0]=4 2134 B8R1.7 O=C(O)C1=CSC=C1 Z147647094 [0,0,0,0,2,0|1,0,0]=3 2135 B8R1.7 O=C(O)C1=CSC=N1 Z800222638 [0,0,0,0,2,0|2,0,0]=4 2136 B8R1.7 O=C(O)C1=CSN=C1 Z1198181914 [0,0,0,0,2,0|2,0,0]=4 2137 B8R1.7 O=C(O)C1=NNC=C1 Z381357668 [0,0,0,0,2,0|2,0,0]=4 2138 B8R1.7 O=C(O)C1=NOC=C1 Z147642256 [0,0,0,0,2,0|2,0,0]=4 2139 B8R1.7 O=C(O)C1=NSC=C1 Z1198233153 [0,0,0,0,2,0|2,0,0]=4 2140 B12R1.252 CC(=O)CCCC1=CN=CC=C1 Z1255405032 [0,0,0,0,0,2|2,0,0]=4 2141 B12R1.252 CC(=O)NCCC1=CC=CC=C1 Z27761567 [0,0,0,0,0,2|1,0,0]=3 2142 B12R1.252 CC(=O)NCCC1=CC=NC=C1 Z1198165525 [0,0,0,0,0,2|2,0,0]=4 2143 B12R1.252 CC(=O)NCCC1=NC=CC=C1 Z32445986 [0,0,0,0,0,2|2,0,0]=4 2144 B12R1.252 CC(=O)NNCC1=CC=CC=C1 Z1726022904 [0,0,0,0,0,2|1,0,0]=3 2145 B12R1.252 CC(O)CNCC1=CC=CC=C1 Z57326978 [0,0,0,0,0,2|1,0,1]=4 2146 B12R1.252 N=C(N)COCC1=CC=CC=C1 Z2574925846 [0,0,0,0,0,2|2,0,0]=4 2147 B12R1.252 N=C(N)CSCC1=CC=CC=C1 Z1795818268 [0,0,0,0,0,2|2,0,0]=4 2148 B12R1.252 NC(=O)CCNC1=CC=CC=C1 Z154666194 [0,0,0,0,0,2|1,0,0]=3 2149 B12R1.252 NC(=O)CCOC1=CC=CC=C1 Z33545291 [0,0,0,0,0,2|1,0,0]=3 2150 B12R1.252 NC(=O)CCSC1=CC=CC=C1 Z33547211 [0,0,0,0,0,2|1,0,0]=3 2151 B12R1.252 NC(=O)CNCC1=CC=CC=C1 Z90608463 [0,0,0,0,0,2|1,0,0]=3 2152 B12R1.252 NC(=O)CNCC1=CN=CC=C1 Z1695669950 [0,0,0,0,0,2|2,0,0]=4 2153 B12R1.252 NC(=O)COCC1=CC=CC=C1 Z52214418 [0,0,0,0,0,2|1,0,0]=3 2154 B12R1.252 NC(=O)NCCC1=CC=CC=C1 Z198194788 [0,0,0,0,0,2|1,0,0]=3 2155 B12R1.252 NC(=O)NCCC1=CN=CC=C1 Z432778234 [0,0,0,0,0,2|2,0,0]=4 2156 B12R1.252 NC(=O)NCCC1=NC=CC=C1 Z198194814 [0,0,0,0,0,2|2,0,0]=4 2157 B12R1.252 NC(=O)NOCC1=CC=CC=C1 Z56787772 [0,0,0,0,0,2|1,0,0]=3 2158 B12R1.252 NC(=S)NCCC1=CC=CC=C1 Z56933803 [0,0,0,0,0,2|1,1,0]=4 2159 B12R1.252 O=C(O)/C=C/SC1=CC=CC=C1 Z104378002 [0,0,0,0,0,2|0,0,1]=3 2160 B12R1.252 O=C(O)CC#CC1=CC=CC=C1 Z976639296 [0,0,0,0,0,2|0,0,0]=2 2161 B12R1.252 O=C(O)CCCC1=CC=CC=C1 Z234895119 [0,0,0,0,0,2|0,0,0]=2 2162 B12R1.252 O=C(O)CCCC1=CC=NC=C1 Z2106608658 [0,0,0,0,0,2|1,0,0]=3 2163 B12R1.252 O=C(O)CCCC1=NC=CC=C1 Z1259273117 [0,0,0,0,0,2|1,0,0]=3 2164 B12R1.252 O=C(O)CCCC1=NC=CN=C1 Z1262554933 [0,0,0,0,0,2|2,0,0]=4 2165 B12R1.252 O=C(O)CCNC1=CC=CC=C1 Z56899128 [0,0,0,0,0,2|0,0,0]=2 2166 B12R1.252 O=C(O)CCNC1=NC=CC=C1 Z285820166 [0,0,0,0,0,2|1,0,0]=3 2167 B12R1.252 O=C(O)CCNC1=NC=CC=N1 Z246310120 [0,0,0,0,0,2|2,0,0]=4 2168 B12R1.252 O=C(O)CCOC1=CC=CC=C1 Z56854475 [0,0,0,0,0,2|0,0,0]=2 2169 B12R1.252 O=C(O)CCOC1=CN=CC=C1 Z336080826 [0,0,0,0,0,2|1,0,0]=3 2170 B12R1.252 O=C(O)CCSC1=CC=CC=C1 Z56821538 [0,0,0,0,0,2|0,0,0]=2 2171 B12R1.252 O=C(O)CCSC1=NC=CC=C1 Z102927312 [0,0,0,0,0,2|1,0,0]=3 2172 B12R1.252 O=C(O)CCSC1=NC=CC=N1 Z102922408 [0,0,0,0,0,2|2,0,0]=4 2173 B12R1.252 O=C(O)CNCC1=CN=CC=C1 Z372854000 [0,0,0,0,0,2|1,0,0]=3 2174 B12R1.252 O=C(O)CNCC1=NC=CC=C1 Z1259041052 [0,0,0,0,0,2|1,0,0]=3 2175 B12R1.252 O=C(O)COCC1=CC=NC=C1 Z1262561205 [0,0,0,0,0,2|1,0,0]=3 2176 B12R1.252 O=C(O)COCC1=CN=CC=C1 Z1262555665 [0,0,0,0,0,2|1,0,0]=3 2177 B12R1.252 O=C(O)COCC1=NC=CC=C1 Z1262528420 [0,0,0,0,0,2|1,0,0]=3 2178 B12R1.252 O=C(O)CSCC1=CC=CC=C1 Z19691777 [0,0,0,0,0,2|0,0,0]=2 2179 B12R1.252 O=C(O)CSCC1=CC=NC=C1 Z228589362 [0,0,0,0,0,2|1,0,0]=3 2180 B12R1.252 O=C(O)CSCC1=CN=CC=C1 Z228589228 [0,0,0,0,0,2|1,0,0]=3 2181 B12R1.252 O=C(O)CSCC1=NC=CC=C1 Z228589018 [0,0,0,0,0,2|1,0,0]=3