0 B14R2.5637 CC1=CC2=C(C=C1)NCCC[C@@H]2N 26894 [0,0,0,0,0,0|4,0,0]=4 1 B14R2.5637 C[C@H]1CNCCC2=C1C=C(Cl)C=C2 81223 [0,0,0,0,0,0|0,0,0]=0 2 B14R2.5637 O=C1CCCCC2=C1C=C(Br)C=C2 N12907 [0,0,0,0,0,0|2,1,1]=4 3 B13R2.3729 BrC1=CC2=C(C=C1)CCCCN2 C73896 [1,0,0,0,0,0|2,1,0]=4 4 B13R2.3729 BrC1=CC2=C(C=C1)CCCNC2 51213 [1,0,0,0,0,0|2,1,0]=4 5 B13R2.3729 ClC1=CC2=C(C=C1)NCCCC2 C15554 [1,0,0,0,0,0|2,0,0]=3 6 B13R2.3729 ClC1=CC2=C(C=C1)NCCNC2 57776 [1,0,0,0,0,0|3,0,0]=4 7 B13R2.5252 N[C@H]1CCCCC2=C1C=CC=C2 20645 [1,0,0,0,0,0|2,0,0]=3 8 B13R2.5252 N[C@H]1CCCOC2=C1C=CC=C2 Y10940 [1,0,0,0,0,0|3,0,0]=4 9 B13R2.5252 O[C@H]1CCCOC2=C1C=CC=C2 A12238 [1,0,0,0,0,0|3,0,0]=4 10 B13R1.9 ClC1=CC=C(OCCCCBr)C=C1 97806 [0,0,1,0,0,0|3,0,0]=4 11 B13R1.446 CCC[C@H](N)C1=C(C)C=CC(C)=C1 Y12444 [0,0,1,0,0,0|3,0,0]=4 12 B13R1.446 CCC[C@H](N)C1=C(C)C=CC(C)=C1 Y12445 [0,0,1,0,0,0|3,0,0]=4 13 B13R1.446 CCC[C@H](N)C1=C(C)C=CC(F)=C1 Y12605 [0,0,1,0,0,0|2,1,0]=4 14 B13R1.446 CCC[C@H](N)C1=C(C)C=CC(F)=C1 Y13328 [0,0,1,0,0,0|2,1,0]=4 15 B13R1.446 CCC[C@H](N)C1=C(C)C=CC(F)=C1 Y13334 [0,0,1,0,0,0|2,1,0]=4 16 B13R2.162 CC1=CC2=C(C=C1)CCC[C@@H]2N F16916 [0,0,0,0,1,0|2,0,0]=3 17 B13R2.162 CC1=CC2=C(C=C1)CCC[C@@H]2N I11947 [0,0,0,0,1,0|2,0,0]=3 18 B13R2.162 CC1=CC2=C(C=C1)CCC[C@@H]2N I11948 [0,0,0,0,1,0|2,0,0]=3 19 B13R2.162 CC1=CC2=C(C=C1)CCC[C@@H]2N N10490 [0,0,0,0,1,0|2,0,0]=3 20 B13R2.162 CC1=CC2=C(C=C1)CCC[C@@H]2N N13165 [0,0,0,0,1,0|2,0,0]=3 21 B13R2.162 CC1=CC2=C(C=C1)OCC[C@@H]2N F17001 [0,0,0,0,1,0|3,0,0]=4 22 B13R2.162 CC1=CC2=C(C=C1)OCC[C@@H]2N N12554 [0,0,0,0,1,0|3,0,0]=4 23 B13R2.162 CC1=CC2=C(C=C1)OCC[C@@H]2N Y10671 [0,0,0,0,1,0|3,0,0]=4 24 B13R2.162 CC1=CC2=C(C=C1)OCC[C@@H]2N Y11841 [0,0,0,0,1,0|3,0,0]=4 25 B13R2.162 CC1=CC2=C(C=C1)OCC[C@@H]2N Y12030 [0,0,0,0,1,0|3,0,0]=4 26 B13R2.162 CN1CCCC2=C1C=C(N)C=C2 26005 [0,0,0,0,1,0|2,0,0]=3 27 B13R2.162 CN1CCCC2=C1C=C(O)C=C2 D83822 [0,0,0,0,1,0|2,0,0]=3 28 B13R2.162 CN1CCOC2=C1C=C(N)C=C2 D70083 [0,0,0,0,1,0|3,0,0]=4 29 B13R2.162 C[C@@H]1NCCC2=C1C=C(Br)C=C2 F30913 [0,0,0,0,1,0|0,1,0]=2 30 B13R2.162 C[C@H]1CCNC2=C1C=C(Cl)C=C2 W16322 [0,0,0,0,1,0|1,0,0]=2 31 B13R2.162 C[C@H]1CNCC2=C1C=C(Cl)C=C2 AC8238 [0,0,0,0,1,0|0,0,0]=1 32 B13R2.162 N[C@H]1CCCC2=C1C=C(Br)C=C2 33471 [0,0,0,0,1,0|1,1,0]=3 33 B13R2.162 N[C@H]1CCCC2=C1C=C(Br)C=C2 F16987 [0,0,0,0,1,0|1,1,0]=3 34 B13R2.162 N[C@H]1CCCC2=C1C=C(Br)C=C2 I10660 [0,0,0,0,1,0|1,1,0]=3 35 B13R2.162 N[C@H]1CCCC2=C1C=C(Br)C=C2 N11010 [0,0,0,0,1,0|1,1,0]=3 36 B13R2.162 N[C@H]1CCCC2=C1C=C(Br)C=C2 Y10698 [0,0,0,0,1,0|1,1,0]=3 37 B13R2.162 N[C@H]1CCCC2=C1C=C(Br)C=C2 Y11204 [0,0,0,0,1,0|1,1,0]=3 38 B13R2.162 N[C@H]1CCCC2=C1C=C(Cl)C=C2 74742 [0,0,0,0,1,0|1,0,0]=2 39 B13R2.162 N[C@H]1CCCC2=C1C=C(Cl)C=C2 Y13381 [0,0,0,0,1,0|1,0,0]=2 40 B13R2.162 N[C@H]1CCCC2=C1C=C(F)C=C2 I11949 [0,0,0,0,1,0|1,1,0]=3 41 B13R2.162 N[C@H]1CCCC2=C1C=C(F)C=C2 N13163 [0,0,0,0,1,0|1,1,0]=3 42 B13R2.162 N[C@H]1CCOC2=C1C=C(Br)C=C2 I11374 [0,0,0,0,1,0|2,1,0]=4 43 B13R2.162 N[C@H]1CCOC2=C1C=C(Br)C=C2 N10963 [0,0,0,0,1,0|2,1,0]=4 44 B13R2.162 N[C@H]1CCOC2=C1C=C(Br)C=C2 W10435 [0,0,0,0,1,0|2,1,0]=4 45 B13R2.162 N[C@H]1CCOC2=C1C=C(Cl)C=C2 I11329 [0,0,0,0,1,0|2,0,0]=3 46 B13R2.162 N[C@H]1CCOC2=C1C=C(Cl)C=C2 I11332 [0,0,0,0,1,0|2,0,0]=3 47 B13R2.162 N[C@H]1CCOC2=C1C=C(Cl)C=C2 I11430 [0,0,0,0,1,0|2,0,0]=3 48 B13R2.162 N[C@H]1CCOC2=C1C=C(Cl)C=C2 I11940 [0,0,0,0,1,0|2,0,0]=3 49 B13R2.162 N[C@H]1CCOC2=C1C=C(F)C=C2 I11335 [0,0,0,0,1,0|2,1,0]=4 50 B13R2.162 N[C@H]1CCOC2=C1C=C(F)C=C2 Y10104 [0,0,0,0,1,0|2,1,0]=4 51 B13R2.162 N[C@H]1COCC2=C1C=C(Br)C=C2 SC2401 [0,0,0,0,1,0|2,1,0]=4 52 B13R2.162 O=C1CCCC2=C1C=C(I)C=C2 N14356 [0,0,0,0,1,0|1,1,1]=4 53 B13R2.162 O=C1CCCC2=C1N=C(Cl)C=C2 50032 [0,0,0,0,1,0|2,0,1]=4 54 B13R2.162 O=C1CCCC2=CN=C(Cl)C=C12 F31147 [0,0,0,0,1,0|2,0,1]=4 55 B13R2.162 O=C1CCCC2=NC=C(Cl)C=C12 C72148 [0,0,0,0,1,0|2,0,1]=4 56 B13R2.162 O=C1NCCC2=C1C=C(F)C=C2 55446 [0,0,0,0,1,0|1,1,1]=4 57 B13R2.162 O=C1NCCC2=C1C=C(O)C=C2 55444 [0,0,0,0,1,0|2,0,1]=4 58 B13R2.162 O[C@H]1CCOC2=C1C=C(Br)C=C2 72250 [0,0,0,0,1,0|2,1,0]=4 59 B12R1.1 CCCCCC1=CC=C(F)C=C1 A11207 [1,0,1,0,0,0|0,1,0]=3 60 B12R1.1 FC1=CC=C(CCCCCl)C=C1 C13856 [1,0,1,0,0,0|1,1,0]=4 61 B12R1.1 NCCCCC1=CC=C(Cl)C=C1 VT1079 [1,0,1,0,0,0|1,0,0]=3 62 B12R1.1 NCCCCC1=CC=C(O)C=C1 P16850 [1,0,1,0,0,0|2,0,0]=4 63 B12R1.1 OCCNCC1=CC=C(F)C=C1 C80019 [1,0,1,0,0,0|1,1,0]=4 64 B12R1.8 CCCCCCC1=CC=NC=C1 O11233 [1,0,1,0,0,0|2,0,0]=4 65 B12R1.8 CCCCCC[N+]1=CC=CC=C1 T72952 [1,0,1,0,0,0|2,0,0]=4 66 B12R1.8 CCCCCNC1=CC=CC=C1 T72196 [1,0,1,0,0,0|2,0,0]=4 67 B12R1.17 N[C@@H](CCO)C1=CC=CC(Cl)=C1 57811 [1,0,1,0,0,0|2,0,0]=4 68 B12R1.17 N[C@@H](CCO)C1=CC=CC(Cl)=C1 57812 [1,0,1,0,0,0|2,0,0]=4 69 B12R1.17 OCC[C@H](O)C1=CC=CC(Cl)=C1 AC8875 [1,0,1,0,0,0|2,0,0]=4 70 B12R1.28 CCCCCC1=CC=CC(F)=C1 36943 [1,0,1,0,0,0|1,1,0]=4 71 B12R1.46 COC1=C(C(C)C)C=C(N)C=C1 C77115 [1,0,1,0,0,0|2,0,0]=4 72 B12R1.308 CCC[C@H](N)C1=C(C)C=CC=C1 20117 [1,0,1,0,0,0|2,0,0]=4 73 B12R1.308 CCC[C@H](N)C1=C(C)C=CC=C1 20119 [1,0,1,0,0,0|2,0,0]=4 74 B12R1.308 CCC[C@H](N)C1=C(C)C=CC=C1 N13254 [1,0,1,0,0,0|2,0,0]=4 75 B12R1.354 CCC(=O)C1=C(C)C=CC(Cl)=C1 W17965 [1,0,1,0,0,0|1,0,1]=4 76 B12R1.354 CC[C@H](N)C1=C(C)C=CC(C)=C1 Y12442 [1,0,1,0,0,0|2,0,0]=4 77 B12R1.354 CC[C@H](N)C1=C(C)C=CC(C)=C1 Y12443 [1,0,1,0,0,0|2,0,0]=4 78 B12R1.354 CC[C@H](N)C1=C(C)C=CC(F)=C1 Y12600 [1,0,1,0,0,0|1,1,0]=4 79 B12R1.354 CC[C@H](N)C1=C(C)C=CC(F)=C1 Y13263 [1,0,1,0,0,0|1,1,0]=4 80 B12R1.354 CC[C@H](N)C1=C(C)C=CC(F)=C1 Y13286 [1,0,1,0,0,0|1,1,0]=4 81 B12R1.354 CC[C@H](O)C1=C(C)C=CC(Cl)=C1 W17964 [1,0,1,0,0,0|1,0,0]=3 82 B12R1.354 CN[C@@H](C)C1=C(C)C=CC(F)=C1 Y12196 [1,0,1,0,0,0|0,1,0]=3 83 B12R1.354 CN[C@@H](C)C1=C(C)C=CC(F)=C1 Y12197 [1,0,1,0,0,0|0,1,0]=3 84 B12R1.354 CN[C@@H](C)C1=C(C)C=CC(F)=C1 Y12607 [1,0,1,0,0,0|0,1,0]=3 85 B12R1.77 COC1=C([C@@H](O)CN)C=CC=C1 AR2903 [1,0,1,0,0,0|2,0,0]=4 86 B12R1.268 COC1=C(CCN)C=C(F)C=C1 I11946 [1,0,1,0,0,0|1,1,0]=4 87 B12R2.41 C1=CC2=C(C=C1)CCNCC2 52717 [2,0,0,0,0,0|0,0,0]=2 88 B12R2.41 C1=CC2=C(C=C1)NCCCC2 W18982 [2,0,0,0,0,0|2,0,0]=4 89 B14R1.19 CCCCCC(=O)C1=CC=C(Cl)C=C1 C76320 [0,1,1,0,0,0|1,0,1]=4 90 B14R1.502 CCOC(=O)CCC1=CC=C(Cl)C=C1 C10962 [0,1,1,0,0,0|2,0,0]=4 91 B14R2.2400 COC1=CC2=C(C=C1)CCNCC2 76418 [1,1,0,0,0,0|1,0,0]=3 92 B14R2.6126 ClC1=NC(Cl)=C2CCNCCC2=N1 73452 [1,1,0,0,0,0|2,0,0]=4 93 B14R2.8719 O=C1CCCCC2=C1C=CC(Cl)=C2 F13419 [1,1,0,0,0,0|1,0,1]=4 94 B14R2.279 NC1C2=C(C=CC=C2)CCCC1O F14464 [1,1,0,0,0,0|2,0,0]=4 95 B14R2.279 N[C@@H]1C(=O)NCCC2=C1C=CC=C2 C15419 [1,1,0,0,0,0|1,0,1]=4 96 B14R2.142 COC1=CC2=C(C=C1)CCC[C@@H]2N N11012 [0,1,0,0,1,0|2,0,0]=4 97 B14R2.4536 CC1(C)CCSC2=C1C=C(Br)C=C2 F21004 [0,1,0,0,1,0|1,1,0]=4 98 B14R2.4536 CC1(C)CNCC2=C1C=C(Br)C=C2 C71694 [0,1,0,0,1,0|0,1,0]=3 99 B14R2.8045 CC1=CC(Cl)=CC2=C1CCCC2=O Y11142 [0,1,0,0,1,0|1,0,1]=4 100 B14R2.8045 CC1=CC(Cl)=CC2=C1CCC[C@@H]2N Y12376 [0,1,0,0,1,0|1,0,0]=3 101 B14R2.8045 CC1=CC(Cl)=CC2=C1CCC[C@@H]2N Y13074 [0,1,0,0,1,0|1,0,0]=3 102 B14R2.8045 CC1=CC(Cl)=CC2=C1CCC[C@@H]2N Y13075 [0,1,0,0,1,0|1,0,0]=3 103 B14R2.8045 CC1=CC(Cl)=CC2=C1OCC[C@@H]2N Y12259 [0,1,0,0,1,0|2,0,0]=4 104 B14R2.8045 CC1=CC(Cl)=CC2=C1OCC[C@@H]2N Y12513 [0,1,0,0,1,0|2,0,0]=4 105 B14R2.8045 CC1=CC(Cl)=CC2=C1OCC[C@@H]2N Y12521 [0,1,0,0,1,0|2,0,0]=4 106 B14R2.8045 N[C@H]1CCCC2=C(Cl)C=C(Cl)C=C21 D83134 [0,1,0,0,1,0|1,0,0]=3 107 B14R2.8045 N[C@H]1CCCC2=C(Cl)C=C(Cl)C=C21 Y11832 [0,1,0,0,1,0|1,0,0]=3 108 B14R2.8045 N[C@H]1CCCC2=C(F)C=C(F)C=C21 Y10812 [0,1,0,0,1,0|1,1,0]=4 109 B14R2.8045 N[C@H]1CCOC2=C(Br)C=C(Cl)C=C21 Y12278 [0,1,0,0,1,0|2,0,0]=4 110 B14R2.8045 N[C@H]1CCOC2=C(Br)C=C(Cl)C=C21 Y12517 [0,1,0,0,1,0|2,0,0]=4 111 B14R2.8045 N[C@H]1CCOC2=C(Br)C=C(Cl)C=C21 Y12519 [0,1,0,0,1,0|2,0,0]=4 112 B14R2.8045 N[C@H]1CCOC2=C(Cl)C=C(Cl)C=C21 Y11855 [0,1,0,0,1,0|2,0,0]=4 113 B14R2.8045 N[C@H]1CCOC2=C(F)C=C(Cl)C=C21 Y12353 [0,1,0,0,1,0|2,0,0]=4 114 B14R2.8045 N[C@H]1CCOC2=C(F)C=C(Cl)C=C21 Y12354 [0,1,0,0,1,0|2,0,0]=4 115 B14R2.8045 N[C@H]1CCOC2=C(F)C=C(Cl)C=C21 Y12830 [0,1,0,0,1,0|2,0,0]=4 116 B14R2.8045 O=C1CCCC2=C(Cl)C=C(Cl)C=C12 N16929 [0,1,0,0,1,0|1,0,1]=4 117 B14R2.8235 C[C@H]1CC(=O)NC2=C1C=C(Cl)C=C2 P16869 [0,1,0,0,1,0|1,0,1]=4 118 B14R2.28472 N[C@H]1CCOC2=CC(Cl)=C(Cl)C=C21 N11015 [0,1,0,0,1,0|2,0,0]=4 119 B14R2.28472 N[C@H]1CCOC2=CC(Cl)=C(Cl)C=C21 N11016 [0,1,0,0,1,0|2,0,0]=4 120 B14R2.28472 N[C@H]1CCOC2=CC(Cl)=C(Cl)C=C21 Y11858 [0,1,0,0,1,0|2,0,0]=4 121 B14R2.28472 O=C1CCCC2=CC(Cl)=C(Cl)C=C12 Y11945 [0,1,0,0,1,0|1,0,1]=4 122 B14R2.28472 O=C1CCCC2=CC(F)=C(Cl)C=C12 Y12639 [0,1,0,0,1,0|1,0,1]=4 123 B14R2.68 BrC1=CC=C([C@@H]2CNCCO2)C=C1 87846 [0,0,1,1,0,0|1,1,0]=4 124 B14R2.68 BrC1=CC=C([C@H]2CCCNC2)C=C1 C10436 [0,0,1,1,0,0|0,1,0]=3 125 B14R2.68 BrC1=CC=C([C@H]2CCCNC2)C=C1 I11346 [0,0,1,1,0,0|0,1,0]=3 126 B14R2.68 BrC1=CC=C([C@H]2CCCNC2)C=C1 W17645 [0,0,1,1,0,0|0,1,0]=3 127 B14R2.68 ClC1=CC=C(C2CCNCC2)C=C1 58243 [0,0,1,1,0,0|2,0,0]=4 128 B14R2.68 ClC1=CC=C([C@@H]2CCCCN2)C=C1 AR1022 [0,0,1,1,0,0|2,0,0]=4 129 B14R2.68 ClC1=CC=C([C@@H]2CCCCN2)C=C1 Y11885 [0,0,1,1,0,0|2,0,0]=4 130 B14R2.68 ClC1=CC=C([C@@H]2CCCCN2)C=C1 Y11886 [0,0,1,1,0,0|2,0,0]=4 131 B14R2.68 ClC1=CC=C([C@@H]2CNCCN2)C=C1 AR2675 [0,0,1,1,0,0|1,0,0]=3 132 B14R2.68 ClC1=CC=C([C@@H]2COCCN2)C=C1 AR1475 [0,0,1,1,0,0|2,0,0]=4 133 B14R2.68 FC1=CC=C([C@@H]2CNCCN2)C=C1 57829 [0,0,1,1,0,0|1,1,0]=4 134 B14R2.68 FC1=CC=C([C@@H]2CNCCS2)C=C1 AR1259 [0,0,1,1,0,0|1,1,0]=4 135 B14R2.68 FC1=CC=C([C@@H]2CNCCS2)C=C1 AR3917 [0,0,1,1,0,0|1,1,0]=4 136 B14R2.68 FC1=CC=C([C@H]2CCCNC2)C=C1 W17668 [0,0,1,1,0,0|0,1,0]=3 137 B14R2.68 NC1=CC=C([C@H]2CCCNC2)C=C1 31764 [0,0,1,1,0,0|1,0,0]=3 138 B14R2.68 NC1=CC=C([C@H]2CCCNC2)C=C1 67287 [0,0,1,1,0,0|1,0,0]=3 139 B14R2.72 ClC1=CC=C(C[C@H]2CCNC2)C=C1 AR1421 [0,0,1,1,0,0|2,0,0]=4 140 B14R2.21 BrC1=CC([C@@H]2CNCCO2)=CC=C1 D85578 [0,0,1,1,0,0|1,1,0]=4 141 B14R2.21 OC1=CC(C2CCCCC2)=CC=C1 97838 [0,0,1,1,0,0|2,0,0]=4 142 B14R3.2531 C1=CC2=C(C=C1)[C@@H]3CNC[C@H]2C3 N13356 [1,0,0,1,0,0|0,0,0]=2 143 B12R2.24 BrC1=CC2=C(C=C1)CCCO2 I11495 [1,0,0,0,1,0|1,1,0]=4 144 B12R2.24 BrC1=CC2=C(C=C1)CCOC2 O11641 [1,0,0,0,1,0|1,1,0]=4 145 B12R2.24 BrC1=CC2=C(C=C1)COCC2 72150 [1,0,0,0,1,0|1,1,0]=4 146 B12R2.24 BrC1=CN=C2CCNCC2=C1 21007 [1,0,0,0,1,0|1,1,0]=4 147 B12R2.24 BrC1=CN=C2CCNCC2=C1 P19234 [1,0,0,0,1,0|1,1,0]=4 148 B12R2.24 BrC1=CN=C2CCNCC2=C1 SC2711 [1,0,0,0,1,0|1,1,0]=4 149 B12R2.24 BrC1=NC2=C(C=C1)CCCC2 D82621 [1,0,0,0,1,0|1,1,0]=4 150 B12R2.24 CC1=CC2=C(C=C1)CCCC2 I10992 [1,0,0,0,1,0|1,0,0]=3 151 B12R2.24 CC1=CC2=C(C=C1)CCCN2 26368 [1,0,0,0,1,0|2,0,0]=4 152 B12R2.24 CC1=CC2=C(C=C1)CCCN2 H11139 [1,0,0,0,1,0|2,0,0]=4 153 B12R2.24 CC1=CC2=C(C=C1)CCCO2 Y13225 [1,0,0,0,1,0|2,0,0]=4 154 B12R2.24 CC1=CC2=C(C=C1)CCOC2 N14607 [1,0,0,0,1,0|2,0,0]=4 155 B12R2.24 ClC1=CC2=C(C=C1)CCCC2 N11405 [1,0,0,0,1,0|0,0,0]=2 156 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 C10821 [1,0,0,0,1,0|1,0,0]=3 157 B12R2.24 ClC1=CC2=C(C=C1)CCCO2 Y13230 [1,0,0,0,1,0|1,0,0]=3 158 B12R2.24 ClC1=CC2=C(C=C1)CCN=C2 F10402 [1,0,0,0,1,0|0,0,2]=4 159 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 28104 [1,0,0,0,1,0|0,0,0]=2 160 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 O11644 [1,0,0,0,1,0|0,0,0]=2 161 B12R2.24 ClC1=CC2=C(C=C1)CNCC2 83052 [1,0,0,0,1,0|0,0,0]=2 162 B12R2.24 ClC1=CC2=C(C=C1)NCCO2 27238 [1,0,0,0,1,0|2,0,0]=4 163 B12R2.24 ClC1=CC2=C(C=C1)OCCC2 N11282 [1,0,0,0,1,0|1,0,0]=3 164 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 VT1094 [1,0,0,0,1,0|2,0,0]=4 165 B12R2.24 ClC1=NC2=C(C=C1)CCCC2 51056 [1,0,0,0,1,0|1,0,0]=3 166 B12R2.24 ClC1=NC2=C(C=C1)CCCN2 C72207 [1,0,0,0,1,0|2,0,0]=4 167 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 F11138 [1,0,0,0,1,0|1,0,0]=3 168 B12R2.24 ClC1=NC2=C(C=N1)CCNC2 F50760 [1,0,0,0,1,0|2,0,0]=4 169 B12R2.24 ClC1=NC2=C(C=N1)CNCC2 83059 [1,0,0,0,1,0|2,0,0]=4 170 B12R2.24 ClC1=NC2=C(C=N1)CNCC2 P10751 [1,0,0,0,1,0|2,0,0]=4 171 B12R2.24 ClC1=NC2=C(CCCC2)N=C1 F50761 [1,0,0,0,1,0|2,0,0]=4 172 B12R2.24 ClC1=NN=C2CCNCC2=C1 FD7033 [1,0,0,0,1,0|2,0,0]=4 173 B12R2.24 FC1=CC2=C(C=C1)CCCC2 N10855 [1,0,0,0,1,0|0,1,0]=3 174 B12R2.24 FC1=CC2=C(C=C1)CCCN2 N12847 [1,0,0,0,1,0|1,1,0]=4 175 B12R2.24 FC1=CC2=C(C=C1)CCCO2 Y13024 [1,0,0,0,1,0|1,1,0]=4 176 B12R2.24 FC1=CC2=C(C=C1)OCCC2 Y11947 [1,0,0,0,1,0|1,1,0]=4 177 B12R2.24 IC1=CC2=C(C=C1)OCCC2 32826 [1,0,0,0,1,0|1,1,0]=4 178 B12R2.24 NC1=CC2=C(C=C1)CCCN2 F21389 [1,0,0,0,1,0|2,0,0]=4 179 B12R2.24 NC1=CC2=C(C=C1)CCCO2 Y13028 [1,0,0,0,1,0|2,0,0]=4 180 B12R2.24 NC1=CC2=C(C=C1)CCNC2 F19187 [1,0,0,0,1,0|1,0,0]=3 181 B12R2.24 NC1=CC2=C(C=C1)CNCC2 51458 [1,0,0,0,1,0|1,0,0]=3 182 B12R2.24 NC1=CC2=C(C=C1)CNCC2 52057 [1,0,0,0,1,0|1,0,0]=3 183 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Y12467 [1,0,0,0,1,0|2,0,0]=4 184 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Y13365 [1,0,0,0,1,0|2,0,0]=4 185 B12R2.24 NC1=CN=C2CCCCC2=C1 F30818 [1,0,0,0,1,0|2,0,0]=4 186 B12R2.24 NC1=CN=C2CCNCC2=C1 67454 [1,0,0,0,1,0|2,0,0]=4 187 B12R2.24 NC1=CN=C2CCNCC2=C1 FD7018 [1,0,0,0,1,0|2,0,0]=4 188 B12R2.24 NC1=NC=C2CCCCC2=C1 52994 [1,0,0,0,1,0|2,0,0]=4 189 B12R2.24 O=C1C=CC2=C(CCNC2)N1 89007 [1,0,0,0,1,0|2,0,0]=4 190 B12R2.24 O=C1C=CC2=C(CCNC2)N1 C76139 [1,0,0,0,1,0|2,0,0]=4 191 B12R2.24 OC1=CC2=C(C=C1)CCCO2 Y11632 [1,0,0,0,1,0|2,0,0]=4 192 B12R2.24 OC1=CC2=C(C=C1)CCNC2 S11181 [1,0,0,0,1,0|1,0,0]=3 193 B12R2.24 OC1=CC2=C(C=C1)CCOC2 Y13231 [1,0,0,0,1,0|2,0,0]=4 194 B12R2.24 OC1=CC2=C(C=C1)COCC2 N13209 [1,0,0,0,1,0|2,0,0]=4 195 B12R2.24 OC1=CC2=C(C=C1)OCCC2 N12986 [1,0,0,0,1,0|2,0,0]=4 196 B12R2.24 OC1=CN=C2CCNCC2=C1 S11487 [1,0,0,0,1,0|2,0,0]=4 197 B12R2.24 OC1=CN=C2CCNCC2=C1 SC1341 [1,0,0,0,1,0|2,0,0]=4 198 B12R2.1081 CN1CCOC2=C1C=CC=C2 W18821 [1,0,0,0,1,0|2,0,0]=4 199 B12R2.1081 C[C@H]1CCNC2=C1C=CC=C2 36617 [1,0,0,0,1,0|1,0,0]=3 200 B12R2.1081 C[C@H]1CCNC2=C1C=CC=C2 A10659 [1,0,0,0,1,0|1,0,0]=3 201 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 64901 [1,0,0,0,1,0|0,0,0]=2 202 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 72471 [1,0,0,0,1,0|0,0,0]=2 203 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 W10122 [1,0,0,0,1,0|0,0,0]=2 204 B12R2.1081 N[C@H]1CCCC2=C1C=CN=C2 85239 [1,0,0,0,1,0|2,0,0]=4 205 B12R2.1081 N[C@H]1CCCC2=C1C=NC=C2 82163 [1,0,0,0,1,0|2,0,0]=4 206 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 50212 [1,0,0,0,1,0|2,0,0]=4 207 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 50215 [1,0,0,0,1,0|2,0,0]=4 208 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 RB3334 [1,0,0,0,1,0|2,0,0]=4 209 B12R2.1081 N[C@H]1CCCC2=NC=CC=C21 39151 [1,0,0,0,1,0|2,0,0]=4 210 B12R2.1081 N[C@H]1CCNC2=C1C=CC=C2 C76564 [1,0,0,0,1,0|2,0,0]=4 211 B12R2.1081 N[C@H]1CCNC2=C1C=CC=C2 F53442 [1,0,0,0,1,0|2,0,0]=4 212 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 71737 [1,0,0,0,1,0|2,0,0]=4 213 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 87775 [1,0,0,0,1,0|2,0,0]=4 214 B12R2.1081 N[C@H]1CNCC2=C1C=CC=C2 52240 [1,0,0,0,1,0|1,0,0]=3 215 B12R2.1081 N[C@H]1COCC2=C1C=CC=C2 37330 [1,0,0,0,1,0|2,0,0]=4 216 B12R2.1081 N[C@H]1COCC2=C1C=CC=C2 SC2561 [1,0,0,0,1,0|2,0,0]=4 217 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 T72122 [1,0,0,0,1,0|1,0,0]=3 218 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 T72587 [1,0,0,0,1,0|1,0,0]=3 219 B12R2.1081 O[C@H]1CCCC2=C1C=CN=C2 53689 [1,0,0,0,1,0|2,0,0]=4 220 B12R2.1081 O[C@H]1CCNC2=C1C=CC=C2 75128 [1,0,0,0,1,0|2,0,0]=4 221 B12R2.1081 O[C@H]1CCOC2=C1C=CC=C2 A12066 [1,0,0,0,1,0|2,0,0]=4 222 B12R2.1081 O[C@H]1COCC2=C1C=CC=C2 N13051 [1,0,0,0,1,0|2,0,0]=4 223 B12R2.132 CC1=CC2=C(C=C1)CC[C@@H]2N N10991 [0,0,0,0,2,0|2,0,0]=4 224 B12R2.132 CC1=CC2=C(C=C1)CC[C@@H]2N Y12626 [0,0,0,0,2,0|2,0,0]=4 225 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 71649 [0,0,0,0,2,0|1,1,0]=4 226 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 N10744 [0,0,0,0,2,0|1,1,0]=4 227 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 P10462 [0,0,0,0,2,0|1,1,0]=4 228 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 P10463 [0,0,0,0,2,0|1,1,0]=4 229 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 Y11201 [0,0,0,0,2,0|1,1,0]=4 230 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 Y12017 [0,0,0,0,2,0|1,1,0]=4 231 B12R2.132 N[C@H]1CCC2=C1C=C(Cl)C=C2 N13065 [0,0,0,0,2,0|1,0,0]=3 232 B12R2.132 N[C@H]1CCC2=C1C=C(Cl)C=C2 Y11815 [0,0,0,0,2,0|1,0,0]=3 233 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 F16923 [0,0,0,0,2,0|1,1,0]=4 234 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 I11030 [0,0,0,0,2,0|1,1,0]=4 235 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 Y10106 [0,0,0,0,2,0|1,1,0]=4 236 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 Y10313 [0,0,0,0,2,0|1,1,0]=4 237 B12R2.132 N[C@H]1CCC2=C1C=C(O)C=C2 P15824 [0,0,0,0,2,0|2,0,0]=4 238 B12R2.132 N[C@H]1CCC2=C1C=C(O)C=C2 Y10912 [0,0,0,0,2,0|2,0,0]=4 239 B12R2.132 N[C@H]1COC2=C1C=C(Cl)C=C2 N10934 [0,0,0,0,2,0|2,0,0]=4 240 B12R2.132 O[C@H]1CCC2=C1C=C(Br)C=C2 N10435 [0,0,0,0,2,0|1,1,0]=4 241 B12R2.132 O[C@H]1CCC2=C1C=C(Cl)C=C2 53581 [0,0,0,0,2,0|1,0,0]=3 242 B12R2.132 O[C@H]1CCC2=C1C=C(F)C=C2 N13071 [0,0,0,0,2,0|1,1,0]=4 243 B12R2.132 O[C@H]1CCC2=C1N=C(Cl)C=C2 N11829 [0,0,0,0,2,0|2,0,0]=4