0 B10R1.59 CC(=O)C1=C(C=C(N1)C)C PH014632 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.59 CC(=O)C1=C(N=C(S1)N)C S64638 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.59 CC(=O)C1=C(N=C(S1)N)C S948659 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.59 CC1=C(N=C(S1)Br)C(=O)O CDS023795 [0,0,0,0,0,0|3,1,0]=4 4 B10R1.59 CC1=C(SC(=O)N1)C(=O)O OTV000413 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.59 CC1=CC(=C(N1)C)C(=O)O PH010596 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.59 CC1=CC(=C(O1)C(=O)O)C PH014459 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.59 CC1=CC(=C(O1)C)C(=O)N S825395 [0,0,0,0,0,0|1,0,0]=1 8 B10R1.59 CC1=CC(=C(S1)C)B(O)O BCH00023 [0,0,0,0,0,0|2,1,1]=4 9 B10R1.59 CC1=CC(=C(S1)N)C(=O)N OTV000759 [0,0,0,0,0,0|2,1,0]=3 10 B10R1.59 CC1=CC(=C(S1)N)C(=O)O CBR00110 [0,0,0,0,0,0|2,1,0]=3 11 B10R1.59 CC1=NC(=C(O1)Br)C(=O)O CDS023266 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.59 CC1=NC(=C(O1)C(=O)O)C T324817 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.59 CC1=NC(=C(S1)C)C(=O)O CDS007381 [0,0,0,0,0,0|2,1,0]=3 14 B10R1.59 CC1=NC(=C(S1)C)C(C)N CBR00692 [0,0,0,0,0,0|2,1,1]=4 15 B10R1.59 CC1=NC(=C(S1)C)C(C)N PH018721 [0,0,0,0,0,0|2,1,1]=4 16 B10R1.59 CC1=NN(C=C1C(=O)O)C CBR00325 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.22 C(=O)C1=C(NC(=C1)C)C CDS008742 [1,0,0,0,0,0|1,0,0]=2 18 B9R1.22 C/C=C/1\N=C(OC1=O)C S739499 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.22 CC1=CC(=C(O1)C)CN CDS016961 [1,0,0,0,0,0|1,0,1]=3 20 B9R1.22 CC1=NN(C(=C1)C=O)C TMT00498 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.35 CC(=O)C1=CC=C(S1)C S552038 [1,0,0,0,0,0|2,0,0]=3 22 B9R1.35 CC(=O)C1=CN=C(O1)N CBR01750 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.35 CC(=O)C1=CNC(=N1)C PH000026 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.35 CC(=O)C1=CSC(=C1)Cl PHB00060 [1,0,0,0,0,0|1,1,0]=3 25 B9R1.35 CC1=CC(=CS1)C(=O)O SYX00379 [1,0,0,0,0,0|1,1,0]=3 26 B9R1.35 CC1=CC=C(O1)C(=O)[O-] R127981 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.35 CC1=NC(=NO1)C(=O)O CDS019560 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.35 CC1=NC=C(S1)C(=O)O ANV00256 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.35 CC1=NOC(=C1)C(=O)O PH000227 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.35 O=C(O)C1=CSC(=C1)Br CDS013228 [1,0,0,0,0,0|2,1,0]=4 31 B9R1.41 CC(=O)C1=C(CCC1)C R426032 [1,0,0,0,0,0|1,0,2]=4 32 B9R1.41 CC(=O)C1=C(NN=C1)C CBR01622 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.41 CC(=O)C1=CNC=C1C L164399 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.41 CC1=C(C=CN1)C(=O)O CBR01791 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.41 CC1=C(C=CS1)C(=O)O PH005181 [1,0,0,0,0,0|1,1,0]=3 36 B9R1.41 CC1=C(C=NO1)C(=O)Cl SYX00343 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.41 CC1=C(N=CS1)C(=O)O CDS007674 [1,0,0,0,0,0|2,1,0]=4 38 B9R1.41 CC1=C(NC=C1)C(=O)O T325260 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.41 CC1=C(NC=N1)C(=O)O CDS007137 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.41 CC1=NSC=C1C(=O)O CVT00118 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.41 CN1C=CC=C1C(=O)Cl PH016725 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.41 NC(=O)C1=C(SC=C1)N CDS007582 [1,0,0,0,0,0|2,1,0]=4 43 B9R1.41 O=C(O)C1=C(OC=C1)Cl PH008831 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.50 CC1=C(C=C(O1)CO)C(=O)O CDS012935 [0,1,0,0,0,0|1,0,0]=2 45 B11R1.50 CC1=C(SC(=N1)CN)C(=O)O CDS024264 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.50 CCC1=CC(=C(S1)N)C(=O)N OTV000758 [0,1,0,0,0,0|2,1,0]=4 47 B11R1.50 CCC1=NC(=C(O1)C(=O)O)C CBR01098 [0,1,0,0,0,0|3,0,0]=4 48 B11R1.50 CCC1=NC(=C(S1)C(=O)O)C CBR00267 [0,1,0,0,0,0|3,0,0]=4 49 B11R1.50 COC1=NC(=C(S1)C(=O)O)C CDS009327 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.225 CC1=NN(C(=C1)C(=O)NN)C JRD0063 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.225 COC(=O)C1=C(N=C(S1)N)C L481033 [0,1,0,0,0,0|3,0,0]=4 52 B11R1.225 COC(=O)C1=C(SC(=C1)C)N CBR01148 [0,1,0,0,0,0|1,1,0]=3 53 B11R1.225 COC(=O)C1=C(SC(=N1)Br)C SYX00223 [0,1,0,0,0,0|2,1,0]=4 54 B11R1.225 COC(=O)C1=C(SC(=N1)N)C SYX00154 [0,1,0,0,0,0|2,1,0]=4 55 B11R1.225 COC(=O)C1=CC(=CN1C)Br ANV00082 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.225 COC(=O)C1=CC(=CN1C)N ANV00044 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.225 COC(=O)C1=CC(=O)NN1C PH014316 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.646 CC1=CC(=C(S1)C)S(=O)(=O)[O-] S798843 [0,1,0,0,0,0|2,1,0]=4 59 B11R1.673 CC(=O)C1=C(NC(=C1C)C)C PH008921 [0,1,0,0,0,0|1,0,0]=2 60 B11R1.673 CC1=C(C(=C(N1)C)C(=O)O)C PH014755 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.673 CC1=NN(C(=C1C(=O)O)C)C S940313 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.74 CC1=CC(=CC(=C1)C(=O)Cl)C CDS000426 [0,0,0,0,0,1|2,0,0]=3 63 B11R1.74 CC1=CC(=CC(=C1)C(=O)O)Br S17907 [0,0,0,0,0,1|3,0,0]=4 64 B11R1.74 CC1=CC(=CC(=C1)C(C)C)C S369373 [0,0,0,0,0,1|2,0,1]=4 65 B11R1.74 CC1=CC(=CC(=N1)C)[N+](=O)[O-] PH009740 [0,0,0,0,0,1|3,0,0]=4 66 B11R1.74 CC1=CC(=O)C=C(N1)C(=O)O CBR02144 [0,0,0,0,0,1|3,0,0]=4 67 B11R1.74 CC1=CC(=O)C=C(O1)C(=O)O CBR01516 [0,0,0,0,0,1|3,0,0]=4 68 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)F SYX00307 [0,0,0,0,0,1|3,0,0]=4 69 B11R1.166 CC(=O)C1=CC=C(C=C1O)Br JRD0831 [0,0,0,0,0,1|3,0,0]=4 70 B11R1.166 CC(=O)C1=CC=C(C=C1O)N CDS015316 [0,0,0,0,0,1|3,0,0]=4 71 B11R1.166 CC(=O)C1=NC=C(C=C1F)Br ADE000139 [0,0,0,0,0,1|3,0,0]=4 72 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)F CDS003230 [0,0,0,0,0,1|3,0,0]=4 73 B11R1.166 CC1=CC(=C(C=N1)C(=O)O)C CDS011445 [0,0,0,0,0,1|2,0,0]=3 74 B11R1.166 CC1=CC(=C(C=N1)C(=O)O)O PH011699 [0,0,0,0,0,1|3,0,0]=4 75 B11R1.166 CC1=CC(=CN=C1C(=O)O)Br CDS022505 [0,0,0,0,0,1|3,0,0]=4 76 B11R1.166 CC1=CC=C(C(=C1)O)C(=O)N CDS013983 [0,0,0,0,0,1|3,0,0]=4 77 B11R1.166 CC1=CC=C(C(=N1)C)C(=O)O CDS013247 [0,0,0,0,0,1|2,0,0]=3 78 B11R1.166 CC1=NC=C(C(=N1)N)C(=O)N PH016867 [0,0,0,0,0,1|3,0,0]=4 79 B11R1.167 CC(=O)C1=CC(=CC=C1F)Br KOB0158 [0,0,0,0,0,1|3,0,0]=4 80 B11R1.167 CC(=O)C1=CC(=CN=C1Cl)Br ADE000790 [0,0,0,0,0,1|3,0,0]=4 81 B11R1.167 CC(=O)C1=CC(=CN=C1Cl)C ADE000737 [0,0,0,0,0,1|2,0,0]=3 82 B11R1.167 CC(=O)C1=CC(=CN=C1Cl)F ADE000775 [0,0,0,0,0,1|3,0,0]=4 83 B11R1.167 CC(=O)C1=CC(=CN=C1F)Br PHB00150 [0,0,0,0,0,1|3,0,0]=4 84 B11R1.167 CC1=CC(=C(C=C1)C)C(C)N CBR01396 [0,0,0,0,0,1|2,0,1]=4 85 B11R1.167 CC1=CC(=C(C=C1)N)C(=O)N CDS003330 [0,0,0,0,0,1|3,0,0]=4 86 B11R1.167 CC1=CC(=C(C=C1)O)C(=O)N PH010267 [0,0,0,0,0,1|3,0,0]=4 87 B11R1.167 CC1=CC=C(C(=C1)C(=O)O)I CDS002953 [0,0,0,0,0,1|3,0,0]=4 88 B11R1.167 CC1=CC=C(C(=C1)[N+](=O)[O-])C S380059 [0,0,0,0,0,1|3,0,0]=4 89 B11R1.167 CC1=CN=C(C(=C1)C(=O)O)Cl ADE000743 [0,0,0,0,0,1|3,0,0]=4 90 B11R1.167 CC1=CN=C(C(=C1)C(=O)O)N ADE000740 [0,0,0,0,0,1|3,0,0]=4 91 B11R1.167 CC1=NNC(=O)C(=C1)C(=O)O CDS005993 [0,0,0,0,0,1|3,0,0]=4 92 B8R0.5 CCO/C(=C/C(=O)O)/C S885061 [1,0,1,0,0,0|1,0,1]=4 93 B8R0.23 CC(=O)/C(=C/C(=O)O)/C S548960 [1,0,1,0,0,0|1,0,0]=3 94 B8R0.28 CC(=O)/C=C/C=C(C)C CDS001465 [1,0,1,0,0,0|1,0,1]=4 95 B8R1.1 CC1=NOC(=C1)C=O CDS014208 [2,0,0,0,0,0|2,0,0]=4 96 B8R1.11 CC1=C(C=CO1)CN CDS019848 [2,0,0,0,0,0|1,0,1]=4 97 B8R1.11 CC1=C(OC=C1)C=O CDS023087 [2,0,0,0,0,0|2,0,0]=4 98 B8R1.11 O=CC1=C(SC=C1)Br CDS015492 [2,0,0,0,0,0|1,1,0]=4 99 B8R1.18 CC1=C(OC(=O)O1)C TMT00459 [2,0,0,0,0,0|2,0,0]=4 100 B8R1.18 CC1=CC(=C(O1)C)S CDS013831 [2,0,0,0,0,0|0,1,0]=3 101 B8R1.18 CC1=CC(=O)C(O1)C CDS000654 [2,0,0,0,0,0|0,0,1]=3 102 B8R1.7 CC(=O)C1=CNC=C1 CDS015198 [2,0,0,0,0,0|1,0,0]=3 103 B8R1.7 O=C(O)C1=CON=C1 CDS009962 [2,0,0,0,0,0|2,0,0]=4 104 B10R0.30 CC/C=C(/C(=O)C)\C(=O)OC S125342 [0,1,1,0,0,0|0,0,2]=4 105 B10R0.32 CCOC(=O)/C(=C/C(=O)C)/[O-] S759791 [0,1,1,0,0,0|1,0,1]=4 106 B10R0.44 COC(=O)/C=C(\C)/OC(=O)C S600717 [0,1,1,0,0,0|1,0,0]=3 107 B10R1.34 CC1=CC(=C(N1C)C)C=O CBR01460 [1,1,0,0,0,0|1,0,0]=3 108 B10R1.256 CC1=NN(C(=C1C=O)C)C CDS017435 [1,1,0,0,0,0|2,0,0]=4 109 B10R1.14 CCC(=O)C1=CC=C(S1)C CBR00320 [1,1,0,0,0,0|2,0,0]=4 110 B10R1.14 COC(=O)C1=COC(=N1)Cl SYX00378 [1,1,0,0,0,0|2,0,0]=4 111 B10R1.14 COC(=O)C1=COC(=N1)N SYX00318 [1,1,0,0,0,0|2,0,0]=4 112 B10R1.14 COC(=O)C1=CSC(=N1)C SYX00285 [1,1,0,0,0,0|1,1,0]=4 113 B10R1.14 COC(=O)C1=NOC(=C1)C EME00018 [1,1,0,0,0,0|1,0,0]=3 114 B10R1.31 CC(=O)C1=CC(=CS1)CCl CBR01251 [1,1,0,0,0,0|2,0,0]=4 115 B10R1.31 CCC1=NC(=CO1)C(=O)O CDS009034 [1,1,0,0,0,0|2,0,0]=4 116 B10R1.194 CC1=C(C(=NO1)C(=O)O)Br CDS022825 [1,1,0,0,0,0|2,0,0]=4 117 B10R1.194 CC1=C(C(=NO1)C(=O)O)C CDS002734 [1,1,0,0,0,0|2,0,0]=4 118 B10R1.39 CCC1=CNC=C1C(=O)C L164054 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.39 CCN1C=CC=C1C(=O)C CDS003863 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.39 COC1=C(OC=C1)C(=O)C T285056 [1,1,0,0,0,0|2,0,0]=4 121 B10R1.149 CC1=C(C=CO1)C(=O)NN CDS005915 [1,1,0,0,0,0|1,0,0]=3 122 B10R1.149 CCC(=O)C1=CC=NN1C CBR01985 [1,1,0,0,0,0|2,0,0]=4 123 B10R1.149 COC(=O)C1=C(ON=C1)N CBR01090 [1,1,0,0,0,0|2,0,0]=4 124 B10R1.149 COC(=O)C1=C(SC=N1)C SYX00155 [1,1,0,0,0,0|1,1,0]=4 125 B10R1.149 COC(=O)C1=COC=C1C T208701 [1,1,0,0,0,0|2,0,0]=4 126 B10R1.192 CC1=CNC(=C1C(=O)O)C CDS005420 [1,1,0,0,0,0|2,0,0]=4 127 B12R1.358 COC(=O)C1=CC(=CC(=O)O1)C T310018 [0,1,0,0,0,1|2,0,0]=4 128 B12R1.358 COC(=O)C1=NC(=NC(=C1)C)O JRD0865 [0,1,0,0,0,1|2,0,0]=4 129 B12R1.511 CC(=O)C1=CC(=CC(=C1O)C)C IDF00002 [0,1,0,0,0,1|1,0,0]=3 130 B12R1.511 CC1=CC(=C(C(=C1)C(=O)O)O)C R179574 [0,1,0,0,0,1|2,0,0]=4 131 B12R1.1005 CC1=CC(=CC(=C1Br)C)C(=O)N CDS019647 [0,1,0,0,0,1|2,0,0]=4 132 B12R1.1005 CC1=CC(=CC(=C1O)C)C(=O)O PH000053 [0,1,0,0,0,1|2,0,0]=4 133 B12R1.57 COC1=CC(=CC=C1C(=O)C)Br JRD0836 [0,1,0,0,0,1|2,0,0]=4 134 B12R1.232 CC(=O)C1=C(C=C(C(=C1)C)C)C S413607 [0,1,0,0,0,1|1,0,0]=3 135 B12R1.232 CC(=O)C1=C(C=C(C(=C1)C)O)C S946222 [0,1,0,0,0,1|2,0,0]=4 136 B12R1.232 CC(=O)C1=C(OC(=O)C(=C1)Cl)C S894265 [0,1,0,0,0,1|1,0,0]=3 137 B12R1.232 CC(=O)C1=CC(=C(C=C1C)C)N S764752 [0,1,0,0,0,1|1,0,0]=3 138 B12R1.232 CC(=O)C1=CC(=C(C=C1O)C)C PH010635 [0,1,0,0,0,1|2,0,0]=4 139 B12R1.232 CC(=O)C1=CC(=C(C=C1O)C)O R151963 [0,1,0,0,0,1|2,0,0]=4 140 B12R1.452 COC1=CC(=C(C=C1)C(=O)C)C T277045 [0,1,0,0,0,1|1,0,0]=3 141 B12R1.452 CSC1=NC(=C(C=N1)C(=O)C)C S216089 [0,1,0,0,0,1|1,0,0]=3 142 B12R1.452 CSC1=NC=C(C(=N1)N)C(=O)C PHB00309 [0,1,0,0,0,1|2,0,0]=4 143 B12R1.1000 CC(=O)C1=C(C=C(C=C1C)O)C S991066 [0,1,0,0,0,1|2,0,0]=4 144 B12R1.1000 CC(=O)C1=C(C=C(C=C1O)C)C S462284 [0,1,0,0,0,1|1,0,0]=3 145 B12R1.1000 CC(=O)C1=C(C=C(C=C1O)O)C S763225 [0,1,0,0,0,1|2,0,0]=4 146 B12R1.1000 CC1=CC(=C(C(=C1)C)C(=O)N)C S356611 [0,1,0,0,0,1|2,0,0]=4 147 B12R1.1000 CC1=CC(=C(C(=N1)C)C(=O)N)O R439762 [0,1,0,0,0,1|2,0,0]=4 148 B12R1.1000 CC1=CC(=C(C(=O)O1)C(=O)O)C T321648 [0,1,0,0,0,1|2,0,0]=4 149 B12R1.1000 CC1=CC(=O)OC(=C1C(=O)O)C S457507 [0,1,0,0,0,1|2,0,0]=4 150 B12R1.1000 CC1=CC(=O)OC(=C1C(=O)O)C S946400 [0,1,0,0,0,1|2,0,0]=4 151 B12R1.1703 CC1=CC(=C(C=C1)C(=O)CBr)C PH010309 [0,1,0,0,0,1|1,0,0]=3 152 B12R1.1703 CC1=CC(=CC=C1C(=O)CCl)O R738417 [0,1,0,0,0,1|2,0,0]=4 153 B12R1.1703 CC1=CC=C(C(=C1)C)C(=O)CCl OTV000341 [0,1,0,0,0,1|1,0,0]=3 154 B12R1.1703 COC(=O)C1=C(C=C(C=C1)C)C EME00062 [0,1,0,0,0,1|1,0,0]=3 155 B12R1.1703 COC(=O)C1=CC=C(C=C1O)C PH011099 [0,1,0,0,0,1|2,0,0]=4 156 B12R1.46 COC1=C(C=C(C=C1)O)C(=O)C IDF00003 [0,1,0,0,0,1|2,0,0]=4 157 B12R1.46 COC1=CC=C(C=C1C(=O)C)C S883360 [0,1,0,0,0,1|1,0,0]=3 158 B12R1.46 COC1=NC=C(C=C1C(=O)C)C ADE000759 [0,1,0,0,0,1|1,0,0]=3 159 B12R1.46 COC1=NC=C(C=C1C(=O)O)C ADE000767 [0,1,0,0,0,1|2,0,0]=4 160 B12R1.46 CSC1=C(C=C(C=C1)C)C(=O)C PH014774 [0,1,0,0,0,1|1,0,0]=3 161 B12R1.354 CC1=CC(=C(C=C1)C)C(=O)CBr PH015659 [0,1,0,0,0,1|1,0,0]=3 162 B12R1.354 CC1=CC=C(C(=C1)C(=O)CCl)C OTV000347 [0,1,0,0,0,1|1,0,0]=3 163 B12R1.354 COC(=O)C1=C(C=CC(=C1)C)N PH006897 [0,1,0,0,0,1|2,0,0]=4 164 B12R1.354 COC(=O)C1=C(C=CC(=C1)N)C PH011114 [0,1,0,0,0,1|2,0,0]=4 165 B12R1.354 COC(=O)C1=C(N=CC(=C1)C)N CDS022511 [0,1,0,0,0,1|2,0,0]=4 166 B12R1.354 COC(=O)C1=CC(=CN=C1Cl)C ADE000763 [0,1,0,0,0,1|2,0,0]=4 167 B12R1.894 CC(=O)C1=C(C=CC(=C1O)C)O S81532 [0,1,0,0,0,1|2,0,0]=4 168 B12R1.608 CCC1=CC(=C(S1)N)C(=O)OC PH000343 [0,2,0,0,0,0|1,1,0]=4 169 B12R1.1979 CCN1N=C(C(=C1C)C(=O)C)C PH014486 [0,2,0,0,0,0|2,0,0]=4 170 B12R1.313 CCOC(=O)C1=C(NC(=C1)C)C T326259 [0,2,0,0,0,0|1,0,0]=3 171 B12R1.313 CCOC(=O)C1=C(OC(=N1)C)C CDS015803 [0,2,0,0,0,0|1,0,0]=3 172 B12R1.313 CCOC(=O)C1=CC(=NN1C)C JRD0206 [0,2,0,0,0,0|2,0,0]=4 173 B12R1.362 COC(=O)C1=C(N(C(=C1)C)C)C EME00168 [0,2,0,0,0,0|1,0,0]=3 174 B12R1.3443 COC(=O)C1=C(SC(=C1C)C)N TMT00479 [0,2,0,0,0,0|1,1,0]=4 175 B12R1.800 CC1=C(C(=C(O1)C)C(=O)O)CN T321524 [0,2,0,0,0,0|1,0,0]=3 176 B10R1.22 CC1=C(C(=O)CC(=O)O1)C PH016843 [0,0,1,1,0,0|1,0,1]=4 177 B10R1.361 CC(=O)C1=C(CC1)C(=O)C S38831 [0,0,1,1,0,0|0,0,2]=4 178 B12R2.612 O=C1CCC2=C1C=CC(=C2)S T285463 [0,0,0,1,0,1|2,0,0]=4 179 B12R2.132 CC1=CC=C2CNC(=O)C2=C1 CBR02176 [0,0,0,1,0,1|2,0,0]=4 180 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 CDS003996 [0,0,0,1,0,1|2,0,0]=4 181 B12R2.202 CC1=CC2=C(O1)CCCC2=O CBR01359 [0,1,0,1,0,0|0,0,0]=2 182 B12R2.202 CC1=NC2=C(S1)C(=O)CCC2 PH014546 [0,1,0,1,0,0|2,0,0]=4 183 B10R1.8 C(=O)C1=CC(=NC(=C1)C)Cl JRD0371 [1,0,0,0,0,1|2,0,0]=4 184 B10R1.8 CC1=CC(=CC(=C1)C=O)F CDS010702 [1,0,0,0,0,1|2,0,0]=4 185 B10R1.8 COC1=CC(=[O+]C(=C1)C)C R251313 [1,0,0,0,0,1|1,0,1]=4 186 B10R1.8 COC1=CC(=[O+]C(=C1)C)C S242004 [1,0,0,0,0,1|1,0,1]=4 187 B10R1.8 COC1=CC(=[O+]C(=C1)C)C S272183 [1,0,0,0,0,1|1,0,1]=4 188 B10R1.8 CSC1=CC(=[O+]C(=C1)C)C S874264 [1,0,0,0,0,1|1,0,1]=4 189 B10R1.8 CSC1=CC(=[S+]C(=C1)C)C S874256 [1,0,0,0,0,1|1,1,0]=4 190 B10R1.25 CC1=CC(=CC=C1C=O)O CDS005358 [1,0,0,0,0,1|2,0,0]=4 191 B10R1.25 CC1=CN=C(C(=C1)F)C=O PH018817 [1,0,0,0,0,1|2,0,0]=4 192 B10R1.13 CC(=O)C1=CC=C(C=N1)C CBR02273 [1,0,0,0,0,1|1,0,0]=3 193 B10R1.13 CC(=O)C1=CC=C(N=C1)Cl CDS007858 [1,0,0,0,0,1|2,0,0]=4 194 B10R1.13 CC(=O)C1=CC=[N+](C=C1)C R228613 [1,0,0,0,0,1|2,0,0]=4 195 B10R1.13 CC1=CC=C(N=C1)C(=O)O CDS015362 [1,0,0,0,0,1|2,0,0]=4 196 B10R1.13 CC1=NC=C(C=N1)C(=O)O CBR01580 [1,0,0,0,0,1|2,0,0]=4 197 B12R1.101 CC(=O)OC1=CC(=CC(=C1)C)C S34860 [0,0,0,0,0,2|1,0,0]=3 198 B12R1.101 CC1=CC(=CC(=C1)CC(=O)O)C CDS003331 [0,0,0,0,0,2|2,0,0]=4 199 B12R1.233 CC(=O)CC1=CC=C(C=C1C)C R226734 [0,0,0,0,0,2|1,0,0]=3 200 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)C S507415 [0,0,0,0,0,2|2,0,0]=4 201 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Cl)C S744840 [0,0,0,0,0,2|2,0,0]=4 202 B12R1.233 CC(=O)NC1=C(C=C(C=C1)I)C L168092 [0,0,0,0,0,2|2,0,0]=4 203 B12R1.233 CC(=O)NC1=C(C=C(C=C1)O)C PH007046 [0,0,0,0,0,2|2,0,0]=4 204 B12R1.233 CC(=O)NC1=CC=C(C=C1Cl)C T331570 [0,0,0,0,0,2|2,0,0]=4 205 B12R1.233 CC1=CC=C(C(=C1)C)NC(=O)N S411590 [0,0,0,0,0,2|2,0,0]=4 206 B12R1.127 CC(=O)NC1=C(C=CC(=C1)C)O S571989 [0,0,0,0,0,2|2,0,0]=4 207 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)C S344311 [0,0,0,0,0,2|2,0,0]=4 208 B12R1.127 CC(=O)NC1=C(C=CC(=C1)F)C PH011772 [0,0,0,0,0,2|2,0,0]=4 209 B12R1.127 CC(=O)NC1=CC(=CC=C1C)Br CDS021152 [0,0,0,0,0,2|2,0,0]=4 210 B12R1.861 CC(=O)/C=C/C1=C(NC(=C1)C)C L164194 [0,0,0,0,0,2|1,0,0]=3