0 B13R1.3 COC1=CC=C(CCC(=O)O)C=C1 8251 [0,0,0,0,0,0|2,0,0]=2 1 B13R1.3 COC1=CC=C(\C=C\C(=O)Cl)C=C1 25637 [0,0,0,0,0,0|2,0,1]=3 2 B13R1.3 COC1=CC=C(\C=C\C(=O)O)C=C1 35169 [0,0,0,0,0,0|2,0,1]=3 3 B13R1.3 COC1=CC=C(\C=C\C(=O)O)C=C1 8248 [0,0,0,0,0,0|2,0,1]=3 4 B13R1.3 CSC1=CC=C(OCC(=O)O)C=C1 19218 [0,0,0,0,0,0|3,1,0]=4 5 B13R1.3 O=CC1=CC=C(CCC(=O)O)C=C1 27618 [0,0,0,0,0,0|4,0,0]=4 6 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 21102 [1,0,0,0,0,0|1,0,0]=2 7 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 8253 [1,0,0,0,0,0|2,0,1]=4 8 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 15217 [1,0,0,0,0,0|3,0,0]=4 9 B12R1.21 Cc1ccc(CCC(=O)O)cc1 3031 [1,0,0,0,0,0|2,0,0]=3 10 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 19769 [1,0,0,0,0,0|3,0,0]=4 11 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 12507 [1,0,0,0,0,0|3,0,0]=4 12 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 24323 [1,0,0,0,0,0|2,0,1]=4 13 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 8247 [1,0,0,0,0,0|2,0,1]=4 14 B12R1.71 CCNCC1=CC=C(OC)C=C1 26458 [1,0,0,0,0,0|1,0,1]=3 15 B12R1.71 COC1=CC=C(CCC=O)C=C1 10913 [1,0,0,0,0,0|1,0,0]=2 16 B12R1.71 COC1=CC=C(CCCN)C=C1 13994 [1,0,0,0,0,0|2,0,1]=4 17 B12R1.71 COC1=CC=C(CCCO)C=C1 14210 [1,0,0,0,0,0|1,0,2]=4 18 B12R1.71 COC1=CC=C(COCCl)C=C1 24122 [1,0,0,0,0,0|1,0,1]=3 19 B14R1.2 COC1=CC=C(C(N)CC(=O)O)C=C1 13902 [0,1,0,0,0,0|2,0,0]=3 20 B14R1.2 COC1=CC=C([C@@H](N)CC(=O)O)C=C1 24028 [0,1,0,0,0,0|2,0,0]=3 21 B14R1.2 COC1=CC=C([C@@H](N)CC(=O)O)C=C1 30247 [0,1,0,0,0,0|2,0,0]=3 22 B14R1.3 COC1=CC=C(C[C@@H](N)C(=O)O)C=C1 17346 [0,1,0,0,0,0|2,0,0]=3 23 B14R1.3 COC1=CC=C(C[C@@H](N)C(=O)O)C=C1 18019 [0,1,0,0,0,0|2,0,0]=3 24 B14R1.3 COC1=CC=C(C[C@@H](N)C(=O)O)C=C1 23307 [0,1,0,0,0,0|2,0,0]=3 25 B14R1.3 COC1=CC=C(C[C@H](N)C(=O)O)C=C1 13163 [0,1,0,0,0,0|2,0,0]=3 26 B14R1.103 COC1=CC(F)=C(\C=C\C(=O)O)C=C1 4349 [0,1,0,0,0,0|2,0,1]=4 27 B14R1.142 CCOC1=CC=C(\C=C\C(=O)O)C=C1 8239 [0,1,0,0,0,0|2,0,1]=4 28 B14R1.419 CC(=O)NCC1=CC=C(B(O)O)C=C1 14580 [0,1,0,0,0,0|3,0,0]=4 29 B14R1.419 O=C(Cl)OCC1=CC=C([N+](=O)[O-])C=C1 10974 [0,1,0,0,0,0|3,0,0]=4 30 B14R1.3653 COC1=C(F)C=C(\C=C\C(=O)O)C=C1 22612 [0,1,0,0,0,0|2,0,1]=4 31 B14R1.3653 COC1=C(O)C=C(CC[N+](=O)[O-])C=C1 19593 [0,1,0,0,0,0|3,0,0]=4 32 B14R1.3653 COC1=C(O)C=C(\C=C\C(=O)O)C=C1 8187 [0,1,0,0,0,0|2,0,1]=4 33 B14R1.3653 COc1ccc(\C=C\C(=O)O)cc1Br 31619 [0,1,0,0,0,0|2,0,1]=4 34 B14R2.134 COC1=CC=C2CCC(=O)CC2=C1 18169 [0,0,0,1,0,0|1,0,0]=2 35 B14R2.134 COC1=CC=C2CC[C@H](N)CC2=C1 32029 [0,0,0,1,0,0|2,0,1]=4 36 B14R2.134 COC1=CC=C2OCC(=O)CC2=C1 33816 [0,0,0,1,0,0|2,0,0]=3 37 B12R1.4 C=CC1=CC=C(OC(C)=O)C=C1 16000 [0,0,0,0,1,0|1,0,1]=3 38 B12R1.4 CC(=O)NC1=CC=C(C#N)C=C1 13216 [0,0,0,0,1,0|3,0,0]=4 39 B12R1.4 CC(=O)Nc1ccc(C=O)cc1 7786 [0,0,0,0,1,0|3,0,0]=4 40 B12R1.4 CCC1=CC=C(CC(C)=O)C=C1 19953 [0,0,0,0,1,0|1,0,0]=2 41 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 19844 [0,0,0,0,1,0|1,0,0]=2 42 B12R1.4 COC1=CC=C(C[C@@H](C)N)C=C1 36095 [0,0,0,0,1,0|1,0,1]=3 43 B12R1.4 COC1=CC=C(NC(=N)N)C=C1 22162 [0,0,0,0,1,0|3,0,0]=4 44 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 3327 [0,0,0,0,1,0|1,0,0]=2 45 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 10785 [0,0,0,0,1,0|1,1,0]=3 46 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 19712 [0,0,0,0,1,0|3,0,0]=4 47 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 31939 [0,0,0,0,1,0|3,0,0]=4 48 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 16459 [0,0,0,0,1,0|3,0,0]=4 49 B12R1.4 O=C(O)CC1=CC=C(CO)C=C1 19630 [0,0,0,0,1,0|3,0,0]=4 50 B14R1.4 COC1=CC=C(CCCC(=O)O)C=C1 15207 [0,0,0,0,0,1|2,0,0]=3 51 B14R1.4 COC1=CC=C(CCCC(N)=O)C=C1 29039 [0,0,0,0,0,1|2,0,0]=3 52 B14R1.4 COC1=CC=C(OCCC(=O)O)C=C1 19220 [0,0,0,0,0,1|2,0,0]=3 53 B14R1.4 CSC1=CC=C(OCCC(=O)O)C=C1 19236 [0,0,0,0,0,1|2,1,0]=4 54 B11R1.1 CNCCC1=CC=C(O)C=C1 15214 [2,0,0,0,0,0|2,0,0]=4 55 B11R1.1 COCCc1ccc(O)cc1 27303 [2,0,0,0,0,0|2,0,0]=4 56 B11R1.1 O=CCCC1=CC=C(F)C=C1 31590 [2,0,0,0,0,0|2,0,0]=4 57 B11R1.1 O=CCCC1=CC=C(O)C=C1 13990 [2,0,0,0,0,0|1,0,0]=3 58 B11R1.91 CC(=O)COC1=CC=CC=C1 20265 [2,0,0,0,0,0|2,0,0]=4 59 B11R1.91 CC(=O)NCC1=CC=CC=C1 19722 [2,0,0,0,0,0|1,0,0]=3 60 B11R1.91 CC(=O)NCC1=CC=CN=C1 13219 [2,0,0,0,0,0|2,0,0]=4 61 B11R1.91 CC(=O)NNC1=CC=CC=C1 7620 [2,0,0,0,0,0|2,0,0]=4 62 B11R1.91 CC(=O)OCC1=CC=NC=C1 1302 [2,0,0,0,0,0|1,0,0]=3 63 B11R1.91 NC(=O)OCC1=CC=CC=C1 12421 [2,0,0,0,0,0|1,0,0]=3 64 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 9173 [2,0,0,0,0,0|2,0,0]=4 65 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 12079 [2,0,0,0,0,0|1,0,0]=3 66 B11R1.91 O=C(O)CCC1=CC=CC=C1 8185 [2,0,0,0,0,0|2,0,0]=4 67 B11R1.83 CCOC1=CC=C(CC)C=C1 3172 [2,0,0,0,0,0|1,0,1]=4 68 B11R1.83 CNCC1=CC=C(OC)C=C1 10499 [2,0,0,0,0,0|1,0,0]=3 69 B11R1.83 COC1=CC=C(CC#N)C=C1 20331 [2,0,0,0,0,0|1,0,1]=4 70 B11R1.83 COC1=CC=C(CC=O)C=C1 25207 [2,0,0,0,0,0|0,0,0]=2 71 B11R1.83 COC1=CC=C(CCN)C=C1 4589 [2,0,0,0,0,0|1,0,1]=4 72 B11R1.83 COC1=CC=C(N=C=O)C=C1 1920 [2,0,0,0,0,0|1,0,1]=4 73 B11R1.83 COC1=CC=C(OC#N)C=C1 20087 [2,0,0,0,0,0|1,0,1]=4 74 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 35689 [2,0,0,0,0,0|0,0,1]=3 75 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 28884 [1,1,0,0,0,0|1,0,0]=3 76 B13R1.14 COC(=O)\C=C\C1=CC=C(O)C=C1 3126 [1,1,0,0,0,0|1,0,1]=4 77 B13R1.132 CC1=CC=C(C(N)CC(=O)O)C=C1 13897 [1,1,0,0,0,0|2,0,0]=4 78 B13R1.132 CC1=CC=C([C@@H](N)CC(=O)O)C=C1 24070 [1,1,0,0,0,0|2,0,0]=4 79 B13R1.132 CC1=CC=C([C@H](N)CC(=O)O)C=C1 14199 [1,1,0,0,0,0|2,0,0]=4 80 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(O)C=C1 24048 [1,1,0,0,0,0|2,0,0]=4 81 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(O)C=C1 13971 [1,1,0,0,0,0|2,0,0]=4 82 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(O)C=C1 24046 [1,1,0,0,0,0|2,0,0]=4 83 B13R1.133 CC1=CC=C(C[C@@H](N)C(=O)O)C=C1 29803 [1,1,0,0,0,0|2,0,0]=4 84 B13R1.133 CC1=CC=C(C[C@H](N)C(=O)O)C=C1 29802 [1,1,0,0,0,0|2,0,0]=4 85 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O 19059 [1,1,0,0,0,0|2,0,0]=4 86 B13R1.133 N[C@@H](CC1=CC=C(O)C=C1)C(=O)O 14347 [1,1,0,0,0,0|2,0,0]=4 87 B13R1.133 N[C@@H](CC1=CC=C(O)C=C1)C(=O)[O-] 35571 [1,1,0,0,0,0|2,0,0]=4 88 B13R1.133 N[C@H](CC1=CC=C(O)C=C1)C(=O)O 13030 [1,1,0,0,0,0|2,0,0]=4 89 B13R1.511 CC1=C(C)C=C(CCC(=O)Cl)C=C1 25725 [1,1,0,0,0,0|2,0,0]=4 90 B13R1.511 CC1=C(C)C=C(CCC(=O)O)C=C1 25724 [1,1,0,0,0,0|2,0,0]=4 91 B13R1.511 O=C(O)CCC1=CC(O)=C(O)C=C1 35050 [1,1,0,0,0,0|2,0,0]=4 92 B13R1.371 COC1=CC=C(CCCCN)C=C1 29036 [1,1,0,0,0,0|1,0,1]=4 93 B13R1.371 COC1=CC=C(CCCCO)C=C1 14350 [1,1,0,0,0,0|1,0,1]=4 94 B13R1.371 COC1=CC=C(CCCCO)C=C1 17512 [1,1,0,0,0,0|1,0,1]=4 95 B13R1.35 COC1=C(Br)C=C(CC(=O)O)C=C1 12491 [0,1,0,0,1,0|1,0,0]=3 96 B13R1.35 COC1=C(C)C=C(CC(=O)O)C=C1 4198 [0,1,0,0,1,0|1,0,0]=3 97 B13R1.35 COC1=C(C)C=C(CC(C)=O)C=C1 24859 [0,1,0,0,1,0|0,0,0]=2 98 B13R1.35 COC1=C(F)C=C(CC(=O)O)C=C1 4170 [0,1,0,0,1,0|1,0,0]=3 99 B13R1.35 COC1=C(N)C=C(NC(C)=O)C=C1 25482 [0,1,0,0,1,0|1,0,0]=3 100 B13R1.35 COC1=C(O)C=C(CC(=O)O)C=C1 3998 [0,1,0,0,1,0|1,0,0]=3 101 B13R1.36 COC1=CC=C([C@@H](O)C(=O)O)C=C1 15953 [0,1,0,0,1,0|1,0,0]=3 102 B13R1.36 COC1=CC=C([C@H](O)C(=O)O)C=C1 16007 [0,1,0,0,1,0|1,0,0]=3 103 B13R1.142 CCOC1=CC=C(NC(C)=O)C=C1 35817 [0,1,0,0,1,0|1,0,0]=3 104 B13R1.142 COCC1=CC=C(CC(=O)O)C=C1 31842 [0,1,0,0,1,0|1,0,0]=3 105 B13R1.585 CC(=O)CC1=CC=C([N+](=O)[O-])C=C1 18646 [0,1,0,0,1,0|2,0,0]=4 106 B13R1.585 CC(=O)NC1=CC=C(C(C)=O)C=C1 12559 [0,1,0,0,1,0|2,0,0]=4 107 B13R1.585 CC(=O)OC1=CC=C(B(O)O)C=C1 20170 [0,1,0,0,1,0|2,0,0]=4 108 B13R1.585 CC(=O)OC1=CC=C(C(=O)O)C=C1 13099 [0,1,0,0,1,0|2,0,0]=4 109 B13R1.585 CN(C)C1=CC=C(CC(=O)O)C=C1 36113 [0,1,0,0,1,0|2,0,0]=4 110 B13R1.653 COC1=CC(Br)=C(CC(=O)O)C=C1 3983 [0,1,0,0,1,0|1,0,0]=3 111 B13R1.653 COC1=CC(Br)=C(OC(C)=O)C=C1 5303 [0,1,0,0,1,0|0,0,0]=2 112 B13R1.653 COC1=CC(Cl)=C(CC(=O)O)C=C1 10958 [0,1,0,0,1,0|1,0,0]=3 113 B13R1.653 COC1=CC(F)=C(CC(=O)O)C=C1 4172 [0,1,0,0,1,0|1,0,0]=3 114 B15R1.1080 CC(=O)NCCC1=CC=C(C(C)=O)C=C1 12561 [0,1,0,0,0,1|2,0,0]=4 115 B15R1.2 COC1=CC=C([C@H](CN)CC(=O)O)C=C1 18297 [0,2,0,0,0,0|2,0,0]=4 116 B15R1.211 COC(=O)CC(=O)C1=CC=C(OC)C=C1 25484 [0,2,0,0,0,0|1,0,1]=4 117 B15R1.211 COC(=O)C[C@@H](N)C1=CC=C(OC)C=C1 23275 [0,2,0,0,0,0|1,0,0]=3 118 B15R1.211 COC(=O)C[C@H](N)C1=CC=C(OC)C=C1 23277 [0,2,0,0,0,0|1,0,0]=3 119 B15R1.3776 COC1=C(O)C=C([C@H](N)CC(=O)O)C=C1 14129 [0,2,0,0,0,0|2,0,0]=4 120 B15R1.16 CCOC1=CC=C(C[C@H](N)C(=O)O)C=C1 13162 [0,2,0,0,0,0|2,0,0]=4 121 B15R1.793 CCOC(=O)\C=C\C1=CC=C(OC)C=C1 8178 [0,2,0,0,0,0|1,0,1]=4 122 B15R1.499 CC(=O)CCC1=CC=C(OC(C)=O)C=C1 19488 [0,2,0,0,0,0|1,0,0]=3 123 B15R1.12854 COC1=C(OC)C=C(CCC(=O)O)C=C1 8272 [0,2,0,0,0,0|2,0,0]=4 124 B13R2.155 O=C1CCC2=CC=C(Br)C=C2C1 18150 [1,0,0,1,0,0|2,0,0]=4 125 B13R2.155 O=C1CCC2=CC=C(Cl)C=C2C1 18149 [1,0,0,1,0,0|2,0,0]=4 126 B13R2.155 O=C1CCC2=CC=C(F)C=C2C1 18147 [1,0,0,1,0,0|2,0,0]=4 127 B13R2.155 O=C1CCC2=CC=C(O)C=C2N1 14908 [1,0,0,1,0,0|2,0,0]=4 128 B13R2.57 COC1=CC=C2CCNCC2=C1 14721 [1,0,0,1,0,0|2,0,0]=4 129 B13R2.57 COC1=CC=C2CCNCC2=C1 25485 [1,0,0,1,0,0|2,0,0]=4 130 B13R2.57 COC1=CC=C2CNCCC2=C1 17141 [1,0,0,1,0,0|1,0,1]=4 131 B13R2.57 COC1=CC=C2CNCCC2=C1 23905 [1,0,0,1,0,0|1,0,1]=4 132 B13R2.669 COC1=CC2=C(C=C1)OCC2=O 18008 [1,0,0,1,0,0|2,0,0]=4 133 B13R2.669 COC1=CC=C2CCC(=O)C2=C1 8832 [1,0,0,1,0,0|1,0,0]=3 134 B13R2.669 COC1=CC=C2COC(=O)C2=C1 22514 [1,0,0,1,0,0|0,0,0]=2 135 B13R2.2121 COC1=CC2=C(C=C1)N=C(C)N2 7665 [0,0,0,1,1,0|2,0,0]=4 136 B13R2.2121 COC1=CC2=C(C=C1)NC(=O)S2 21830 [0,0,0,1,1,0|2,0,0]=4 137 B13R2.2121 COC1=CC2=C(C=C1)OC(C)=N2 25985 [0,0,0,1,1,0|1,0,0]=3 138 B13R2.2121 COC1=CC2=C(C=C1)SC(=O)C2 17715 [0,0,0,1,1,0|0,1,0]=3 139 B13R2.2121 COC1=CC=C2C=C(C)NC2=C1 19946 [0,0,0,1,1,0|1,0,1]=4 140 B13R2.2121 COC1=CC=C2CC(=O)CC2=C1 18091 [0,0,0,1,1,0|0,0,0]=2 141 B13R2.2121 COC1=CC=C2CC(=O)NC2=C1 8303 [0,0,0,1,1,0|1,0,0]=3 142 B13R2.2121 COC1=CC=C2CC(N)CC2=C1 36162 [0,0,0,1,1,0|1,0,1]=4 143 B13R2.2121 COC1=CC=C2NC(=O)CC2=C1 8313 [0,0,0,1,1,0|1,0,0]=3 144 B13R2.2121 COC1=CC=C2NC(C)=CC2=C1 7236 [0,0,0,1,1,0|2,0,0]=4 145 B15R2.2880 COC1=CC2=C(C=C1)NCCC(=O)N2 31841 [0,0,0,1,0,1|2,0,0]=4 146 B15R2.2880 COC1=CC2=C(C=CNC(=O)C2)C=C1 22957 [0,0,0,1,0,1|1,0,1]=4 147 B15R2.3137 COC1=CC=C2NC=C(C(C)=O)C2=C1 8329 [0,0,0,1,0,1|1,0,1]=4 148 B15R2.7688 CC(=O)CCC1=CC2=C(C=C1)OCO2 15363 [0,1,0,1,0,0|1,0,0]=3 149 B15R2.7688 O=C(O)CCC1=CC2=C(C=C1)OCC2 14820 [0,1,0,1,0,0|2,0,0]=4 150 B15R2.7688 O=C(O)CCC1=CC2=C(C=C1)OCO2 25778 [0,1,0,1,0,0|2,0,0]=4 151 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 31604 [1,0,0,0,1,0|1,0,0]=3 152 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 28145 [1,0,0,0,1,0|1,0,0]=3 153 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 28133 [1,0,0,0,1,0|1,0,0]=3 154 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 35682 [1,0,0,0,1,0|0,0,0]=2 155 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 3342 [1,0,0,0,1,0|1,0,0]=3 156 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 26262 [1,0,0,0,1,0|2,0,0]=4 157 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 3293 [1,0,0,0,1,0|2,0,0]=4 158 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 17726 [1,0,0,0,1,0|1,0,0]=3 159 B11R1.20 CC(=O)NC1=CC=C(S)C=C1 6832 [1,0,0,0,1,0|1,1,0]=4 160 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 3061 [1,0,0,0,1,0|1,0,0]=3 161 B11R1.20 CC(C)OC1=CC=C(O)C=C1 34515 [1,0,0,0,1,0|1,0,1]=4 162 B11R1.20 CC1=CC=C(CC(O)=S)C=C1 10789 [1,0,0,0,1,0|1,0,1]=4 163 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 17532 [1,0,0,0,1,0|1,0,0]=3 164 B11R1.20 Nc1ccc(CC(=O)O)cc1 22147 [1,0,0,0,1,0|2,0,0]=4 165 B11R1.20 O=C(Cl)CC1=CC=C(Cl)C=C1 44721 [1,0,0,0,1,0|2,0,0]=4 166 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 17517 [1,0,0,0,1,0|2,0,0]=4 167 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 4246 [1,0,0,0,1,0|2,0,0]=4 168 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 4250 [1,0,0,0,1,0|2,0,0]=4 169 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 13432 [1,0,0,0,1,0|2,0,0]=4 170 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 19614 [1,0,0,0,1,0|2,0,0]=4 171 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 18835 [1,0,0,0,1,0|2,0,0]=4 172 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 22193 [1,0,0,0,1,0|1,0,0]=3 173 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 34915 [1,0,0,0,1,0|1,1,0]=4 174 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 20531 [0,0,0,0,2,0|1,0,0]=3 175 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 3305 [0,0,0,0,2,0|2,0,0]=4 176 B11R1.3 CC(=O)C1=CC=C(C=O)C=C1 23568 [0,0,0,0,2,0|2,0,0]=4 177 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 31192 [0,0,0,0,2,0|2,0,0]=4 178 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 31334 [0,0,0,0,2,0|2,0,0]=4 179 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 9725 [0,0,0,0,2,0|2,0,0]=4 180 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 15495 [0,0,0,0,2,0|1,0,0]=3 181 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 4517 [0,0,0,0,2,0|2,0,0]=4 182 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 9808 [0,0,0,0,2,0|1,0,0]=3 183 B11R1.3 COC1=CC=C(C(=O)O)C=C1 23856 [0,0,0,0,2,0|1,0,0]=3 184 B11R1.3 COC1=CC=C(C(C)=O)C=C1 3324 [0,0,0,0,2,0|0,0,0]=2 185 B11R1.3 COC1=CC=C(C(N)=S)C=C1 13558 [0,0,0,0,2,0|1,1,0]=4 186 B11R1.3 COC1=CC=C(N(C)C)C=C1 16956 [0,0,0,0,2,0|2,0,0]=4 187 B11R1.3 COC1=CN=C(C(=O)O)C=C1 15176 [0,0,0,0,2,0|2,0,0]=4 188 B11R1.3 COC1=NC=C(C(=O)O)C=C1 15177 [0,0,0,0,2,0|2,0,0]=4 189 B11R1.3 COC1=NC=C(C(C)=O)C=C1 16770 [0,0,0,0,2,0|1,0,0]=3 190 B11R1.3 COc1ccc([C@@H](C)N)cc1 9920 [0,0,0,0,2,0|1,0,1]=4 191 B11R1.3 COc1ccc([C@H](C)N)cc1 9919 [0,0,0,0,2,0|1,0,1]=4 192 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 3333 [0,0,0,0,2,0|0,1,0]=3 193 B15R1.4 COC1=CC=C(CCCCC(=O)O)C=C1 16864 [0,0,0,0,0,2|2,0,0]=4