0 B9R1.35 CC(=O)C1=CC(Br)=CS1 SBB022006 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.35 CC(=O)C1=CC(C)=CS1 SBB066532 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.35 CC(=O)C1=CC=C(Br)S1 SBB058398 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.35 CC(=O)C1=CC=C(C)O1 SBB046935 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.35 CC(=O)C1=CC=C(C)S1 SBB066533 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.35 CC(=O)C1=CC=C(Cl)S1 SBB066389 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.35 CC(=O)C1=CC=C(F)S1 SBB073293 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.35 CC(=O)C1=CC=C(I)S1 SBB101059 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.35 CC(=O)C1=CN(C)N=C1 SBB020594 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.35 CC(=O)C1=CN=C(N)O1 SBB072544 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.35 CC(=O)C1=CSC(C)=N1 SBB109134 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.35 CC(=O)C1=CSC(N)=N1 SBB066604 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.35 CC(=O)C1=NN(C)C=C1 SBB021677 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.35 CC1=CC(C(=O)Cl)=NO1 SBB005468 [0,0,0,0,0,0|2,1,0]=3 14 B9R1.35 CC1=CC(C(=O)O)=CS1 SBB009287 [0,0,0,0,0,0|0,0,0]=0 15 B9R1.35 CC1=CC(C(=O)O)=NN1 SBB019482 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.35 CC1=CC(C(=O)O)=NO1 SBB005437 [0,0,0,0,0,0|1,1,0]=2 17 B9R1.35 CC1=CC(C(N)=O)=NO1 SBB085636 [0,0,0,0,0,0|2,1,0]=3 18 B9R1.35 CC1=CC(C(N)=S)=NO1 SBB055818 [0,0,0,0,0,0|2,2,0]=4 19 B9R1.35 CC1=CC([N+](=O)[O-])=NN1 SBB000028 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.35 CC1=CC=C(B(O)O)O1 SBB004261 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.35 CC1=CC=C(B(O)O)S1 SBB004150 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.35 CC1=CC=C(C(=O)Cl)O1 SBB017922 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.35 CC1=CC=C(C(=O)Cl)S1 SBB087488 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.35 CC1=CC=C(C(=O)O)O1 SBB005609 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.35 CC1=CN=C(C(=O)O)S1 SBB053120 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.35 CC1=CSC(C(=O)O)=C1 SBB017915 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.35 CC1=CSC(C(=O)O)=N1 SBB053102 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.35 CC1=NC(C(=O)O)=CO1 SBB019457 [0,0,0,0,0,0|1,1,0]=2 29 B9R1.35 CC1=NC(C(=O)O)=CS1 SBB053121 [0,0,0,0,0,0|1,0,0]=1 30 B9R1.35 CC1=NC([N+](=O)[O-])=CN1 SBB056839 [0,0,0,0,0,0|3,0,1]=4 31 B9R1.35 CC1=NC=C(C(=O)O)S1 SBB053124 [0,0,0,0,0,0|2,0,0]=2 32 B9R1.35 CC1=NN(C(N)=O)C=C1 SBB006629 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.35 CC1=NNC(C(=O)O)=N1 SBB028126 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.35 CC1=NNC(C(N)=O)=C1 SBB085599 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.35 CC1=NOC(C(=O)O)=C1 SBB007337 [0,0,0,0,0,0|2,0,0]=2 36 B9R1.35 CC1=NOC(C(=O)O)C1 SBB050121 [0,0,0,0,0,0|2,0,2]=4 37 B9R1.35 CN1C=C(B(O)O)C=N1 SBB052585 [0,0,0,0,0,0|3,0,1]=4 38 B9R1.35 CN1C=C(C(=O)Cl)C=N1 SBB010302 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.35 CN1C=C(C(=O)O)C=N1 SBB000052 [0,0,0,0,0,0|2,0,0]=2 40 B9R1.35 CN1C=C(C(=O)O)N=N1 SBB027235 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.35 CN1C=C([N+](=O)[O-])C=N1 SBB019276 [0,0,0,0,0,0|3,0,1]=4 42 B9R1.35 CN1C=CC(C(=O)Cl)=N1 SBB020287 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.35 CN1C=CC(C(=O)O)=N1 SBB000008 [0,0,0,0,0,0|3,0,0]=3 44 B9R1.35 CN1C=CC(C(N)=O)=N1 SBB073475 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.35 CN1C=NC(C(=O)O)=C1 SBB013834 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.35 NC(=O)C1=CC=C(Br)O1 SBB050272 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.35 NC(=O)C1=CC=C(Br)S1 SBB050273 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.35 NC(=O)C1=CC=C(Cl)S1 SBB087552 [0,0,0,0,0,0|4,0,0]=4 49 B9R1.35 NC(=O)C1=CC=C(F)S1 SBB116495 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.35 NC(=O)C1=NNC(N)=C1 SBB073347 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.35 NC1=NC(C(=O)O)=CO1 SBB053190 [0,0,0,0,0,0|2,1,0]=3 52 B9R1.35 NC1=NC(C(=O)O)=CS1 SBB010300 [0,0,0,0,0,0|2,0,0]=2 53 B9R1.35 NC1=NC=C(C(=O)O)S1 SBB066572 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.35 NC1=NNC(C(=O)O)=C1 SBB006933 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.35 NC1=NNC(C(=O)O)=N1 SBB058397 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 SBB067945 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.35 O=C(Cl)C1=CC=C(F)S1 SBB116494 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.35 O=C(O)C1=CC(Br)=CS1 SBB020811 [0,0,0,0,0,0|3,0,0]=3 59 B9R1.35 O=C(O)C1=CC(Br)=NO1 SBB053167 [0,0,0,0,0,0|3,0,0]=3 60 B9R1.35 O=C(O)C1=CC(Cl)=NO1 SBB074354 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.35 O=C(O)C1=CC(O)=NO1 SBB027231 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.35 O=C(O)C1=CC=C(Br)O1 SBB003644 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.35 O=C(O)C1=CC=C(Br)S1 SBB053058 [0,0,0,0,0,0|3,0,0]=3 64 B9R1.35 O=C(O)C1=CC=C(F)S1 SBB023956 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.35 O=C(O)C1=CC=C(I)O1 SBB039298 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.35 O=C(O)C1=CN=C(Br)S1 SBB053123 [0,0,0,0,0,0|3,0,0]=3 67 B9R1.35 O=C(O)C1=CN=C(Cl)S1 SBB053137 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.35 O=C(O)C1=CNC(O)=N1 SBB017908 [0,0,0,0,0,0|3,0,0]=3 69 B9R1.35 O=C(O)C1=CSC(Br)=N1 SBB053103 [0,0,0,0,0,0|2,0,0]=2 70 B9R1.35 O=C(O)C1=NNC(O)=N1 SBB013694 [0,0,0,0,0,0|4,0,0]=4 71 B9R1.35 O=C(O)[C@@H]1CSC(=S)N1 SBB053161 [0,0,0,0,0,0|2,0,2]=4 72 B9R1.35 O=C1C=C(C(=O)O)NN1 SBB014633 [0,0,0,0,0,0|3,0,0]=3 73 B9R1.35 O=C1CC(C(=O)O)=NN1 SBB053199 [0,0,0,0,0,0|3,0,1]=4 74 B9R1.35 O=C1N=C(C(=O)O)NN1 SBB015008 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.35 O=C1NN=C(C(=O)O)N1 SBB046722 [0,0,0,0,0,0|4,0,0]=4 76 B9R1.35 O=C1N[C@H](C(=O)O)CS1 SBB004097 [0,0,0,0,0,0|2,0,2]=4 77 B9R1.35 OC(=O)C1=CC=C(C)S1 SBB004146 [0,0,0,0,0,0|2,0,0]=2 78 B9R1.35 OC(=O)C1=CC=C(Cl)S1 SBB003937 [0,0,0,0,0,0|3,0,0]=3 79 B9R1.35 OC(=O)C1=NC(N)=NN1 SBB057571 [0,0,0,0,0,0|4,0,0]=4 80 B8R1.1 C(=O)C1=CC(C)=NO1 SBB073327 [1,0,0,0,0,0|2,0,0]=3 81 B8R1.1 C(=O)C1=CC=C(C)S1 SBB004249 [1,0,0,0,0,0|2,0,0]=3 82 B8R1.1 C(=O)C1=CC=C(Cl)O1 SBB004223 [1,0,0,0,0,0|3,0,0]=4 83 B8R1.1 C(=O)C1=CC=C(Cl)S1 SBB004100 [1,0,0,0,0,0|3,0,0]=4 84 B8R1.1 C(=O)C1=CC=C(F)S1 SBB027017 [1,0,0,0,0,0|3,0,0]=4 85 B8R1.1 C(=O)C1=CN(C)N=C1 SBB000002 [1,0,0,0,0,0|2,0,0]=3 86 B8R1.1 CC1=CC(C=O)=NO1 SBB052294 [1,0,0,0,0,0|1,1,0]=3 87 B8R1.1 CC1=CC(CO)=CS1 SBB017457 [1,0,0,0,0,0|0,0,1]=2 88 B8R1.1 CC1=CC(CO)=NO1 SBB025974 [1,0,0,0,0,0|1,1,1]=4 89 B8R1.1 CC1=CC=C(C=O)O1 SBB040222 [1,0,0,0,0,0|2,0,0]=3 90 B8R1.1 CC1=CN=C(C=O)S1 SBB052287 [1,0,0,0,0,0|3,0,0]=4 91 B8R1.1 CC1=NC(C#N)=CS1 SBB085571 [1,0,0,0,0,0|2,0,1]=4 92 B8R1.1 CC1=NC(C=O)=CN1 SBB052314 [1,0,0,0,0,0|2,0,0]=3 93 B8R1.1 CC1=NC(C=O)=CS1 SBB085686 [1,0,0,0,0,0|1,0,0]=2 94 B8R1.1 CC1=NC(CCl)=CS1 SBB005574 [1,0,0,0,0,0|2,0,1]=4 95 B8R1.1 CC1=NC(CCl)=CS1 SBB054934 [1,0,0,0,0,0|2,0,1]=4 96 B8R1.1 CC1=NC(CN)=CS1 SBB052476 [1,0,0,0,0,0|2,0,1]=4 97 B8R1.1 CC1=NC=C(C=O)S1 SBB018895 [1,0,0,0,0,0|2,0,0]=3 98 B8R1.1 CC1=NNC(C=O)=C1 SBB020823 [1,0,0,0,0,0|2,0,0]=3 99 B8R1.1 CC1=NNC(CO)=C1 SBB080476 [1,0,0,0,0,0|2,0,1]=4 100 B8R1.1 CC1=NOC(CO)=C1 SBB025975 [1,0,0,0,0,0|2,0,1]=4 101 B8R1.1 CN1C=C(CO)C=N1 SBB022156 [1,0,0,0,0,0|2,0,1]=4 102 B8R1.1 CN1C=CC(C=O)=N1 SBB020577 [1,0,0,0,0,0|3,0,0]=4 103 B8R1.1 NC1=NC(CO)=CS1 SBB014800 [1,0,0,0,0,0|2,0,1]=4 104 B8R1.1 NC1=NC=C(C=O)S1 SBB049043 [1,0,0,0,0,0|3,0,0]=4 105 B8R1.1 O=CC1=CC(Br)=CO1 SBB069420 [1,0,0,0,0,0|3,0,0]=4 106 B8R1.1 O=CC1=CC(Br)=CS1 SBB000293 [1,0,0,0,0,0|3,0,0]=4 107 B8R1.1 O=CC1=CC=C(Br)O1 SBB047477 [1,0,0,0,0,0|3,0,0]=4 108 B8R1.1 O=CC1=CC=C(Br)S1 SBB000294 [1,0,0,0,0,0|3,0,0]=4 109 B8R1.1 O=CC1=CC=C(I)O1 SBB039297 [1,0,0,0,0,0|3,0,0]=4 110 B8R1.1 O=CC1=CN=C(Cl)S1 SBB086559 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.1 O=CC1=CSC(Br)=N1 SBB091356 [1,0,0,0,0,0|2,0,0]=3 112 B8R1.7 CC(=O)C1=CC=CN1 SBB066752 [1,0,0,0,0,0|3,0,0]=4 113 B8R1.7 CC(=O)C1=CC=CO1 SBB040248 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.7 CC(=O)C1=CC=CS1 SBB038710 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.7 CC(=O)C1=CC=NN1 SBB086523 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.7 CC(=O)C1=CSC=C1 SBB048022 [1,0,0,0,0,0|1,0,0]=2 117 B8R1.7 CC(=O)N1C=CN=C1 SBB008874 [1,0,0,0,0,0|3,0,0]=4 118 B8R1.7 NC(=O)C1=CC=CO1 SBB028188 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.7 NC(=O)C1=CC=CS1 SBB028227 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.7 NC(=O)C1=CNC=N1 SBB055865 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.7 NC(=O)C1=CNN=C1 SBB026422 [1,0,0,0,0,0|3,0,0]=4 122 B8R1.7 NC(=O)C1=NNC=C1 SBB027110 [1,0,0,0,0,0|3,0,0]=4 123 B8R1.7 NC(=S)C1=CSC=C1 SBB086301 [1,0,0,0,0,0|1,1,0]=3 124 B8R1.7 O=C(Cl)C1=CC=CO1 SBB004224 [1,0,0,0,0,0|3,0,0]=4 125 B8R1.7 O=C(Cl)C1=CC=CS1 SBB004099 [1,0,0,0,0,0|3,0,0]=4 126 B8R1.7 O=C(Cl)C1=CC=NO1 SBB005469 [1,0,0,0,0,0|3,0,0]=4 127 B8R1.7 O=C(Cl)C1=CNN=C1 SBB073791 [1,0,0,0,0,0|3,0,0]=4 128 B8R1.7 O=C(Cl)C1=CSC=C1 SBB053641 [1,0,0,0,0,0|1,0,0]=2 129 B8R1.7 O=C(Cl)C1=CSC=N1 SBB053647 [1,0,0,0,0,0|2,0,0]=3 130 B8R1.7 O=C(O)C1=CC=CN1 SBB004332 [1,0,0,0,0,0|2,0,0]=3 131 B8R1.7 O=C(O)C1=CC=CO1 SBB004324 [1,0,0,0,0,0|2,0,0]=3 132 B8R1.7 O=C(O)C1=CC=CS1 SBB004241 [1,0,0,0,0,0|2,0,0]=3 133 B8R1.7 O=C(O)C1=CC=NO1 SBB004319 [1,0,0,0,0,0|2,0,0]=3 134 B8R1.7 O=C(O)C1=CC=NS1 SBB013118 [1,0,0,0,0,0|2,0,0]=3 135 B8R1.7 O=C(O)C1=CN=CN1 SBB004323 [1,0,0,0,0,0|2,0,0]=3 136 B8R1.7 O=C(O)C1=CN=CO1 SBB053191 [1,0,0,0,0,0|2,0,0]=3 137 B8R1.7 O=C(O)C1=CN=CS1 SBB065748 [1,0,0,0,0,0|2,0,0]=3 138 B8R1.7 O=C(O)C1=CNN=C1 SBB017552 [1,0,0,0,0,0|2,0,0]=3 139 B8R1.7 O=C(O)C1=COC=C1 SBB004325 [1,0,0,0,0,0|0,1,0]=2 140 B8R1.7 O=C(O)C1=COC=N1 SBB053171 [1,0,0,0,0,0|1,1,0]=3 141 B8R1.7 O=C(O)C1=CON=C1 SBB053165 [1,0,0,0,0,0|1,1,0]=3 142 B8R1.7 O=C(O)C1=CSC=C1 SBB004240 [1,0,0,0,0,0|0,0,0]=1 143 B8R1.7 O=C(O)C1=CSC=N1 SBB010166 [1,0,0,0,0,0|1,0,0]=2 144 B8R1.7 O=C(O)C1=CSN=N1 SBB028456 [1,0,0,0,0,0|2,0,0]=3 145 B8R1.7 O=C(O)C1=NC=CN1 SBB010014 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.7 O=C(O)C1=NC=CS1 SBB053122 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.7 O=C(O)C1=NNC=C1 SBB000005 [1,0,0,0,0,0|2,0,0]=3 148 B8R1.7 O=C(O)C1=NNC=N1 SBB012750 [1,0,0,0,0,0|3,0,0]=4 149 B8R1.7 O=C(O)C1=NOC=C1 SBB065956 [1,0,0,0,0,0|1,1,0]=3 150 B8R1.7 O=C(O)C1=NON=C1 SBB002780 [1,0,0,0,0,0|2,1,0]=4 151 B8R1.7 O=C(O)C1=NSN=C1 SBB013143 [1,0,0,0,0,0|2,0,0]=3 152 B8R1.7 O=C(O)C1C=CCN1 SBB053088 [1,0,0,0,0,0|2,0,1]=4 153 B8R1.7 OB(O)C1=COC=C1 SBB004327 [1,0,0,0,0,0|1,1,1]=4 154 B8R1.7 OB(O)C1=CSC=C1 SBB004244 [1,0,0,0,0,0|1,0,1]=3 155 B10R1.14 CC1=CC(C(=O)NN)=NN1 SBB021111 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.14 CC1=CC(C(=O)NN)=NO1 SBB020617 [0,1,0,0,0,0|2,1,0]=4 157 B10R1.14 CC1=CC=C(C(=O)NN)S1 SBB017661 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.14 CC1=CC=C(\C(N)=N\O)S1 SBB076714 [0,1,0,0,0,0|3,0,0]=4 159 B10R1.14 CC1=NC(C(=O)NN)=CS1 SBB059506 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.14 CCC(=O)C1=CN(C)N=C1 SBB024992 [0,1,0,0,0,0|3,0,0]=4 161 B10R1.14 CN1C=C(C(=O)NN)C=N1 SBB022145 [0,1,0,0,0,0|3,0,0]=4 162 B10R1.14 CN1C=CC(C(=O)CCl)=C1 SBB302162 [0,1,0,0,0,0|3,0,0]=4 163 B10R1.14 COC(=O)C1=CC(Br)=CN1 SBB053897 [0,1,0,0,0,0|3,0,0]=4 164 B10R1.14 COC(=O)C1=CC(C)=NO1 SBB026808 [0,1,0,0,0,0|2,0,0]=3 165 B10R1.14 COC(=O)C1=CC=C(Br)O1 SBB041085 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.14 COC(=O)C1=CC=C(C)S1 SBB027056 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.14 COC(=O)C1=CC=C(N)S1 SBB014204 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.14 COC(=O)C1=CN(C)N=C1 SBB116497 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.14 COC(=O)C1=CN=C(Br)S1 SBB053907 [0,1,0,0,0,0|3,0,0]=4 170 B10R1.14 COC(=O)C1=CN=C(N)S1 SBB053918 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.14 COC(=O)C1=COC(C)=N1 SBB086182 [0,1,0,0,0,0|1,1,0]=3 172 B10R1.14 COC(=O)C1=CSC(Br)=N1 SBB067619 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.14 COC(=O)C1=CSC(Cl)=N1 SBB066589 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.14 COC(=O)C1=CSC(N)=N1 SBB053903 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.14 COC(=O)C1=NC=C(C)S1 SBB087214 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.14 COC(=O)C1=NN(C)C=C1 SBB021345 [0,1,0,0,0,0|3,0,0]=4 177 B10R1.14 COC(=O)C1=NNC(C)=C1 SBB022982 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.14 COC(=O)C1=NNC(N)=C1 SBB032975 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.14 COC(=O)C1=NOC(C)=C1 SBB053925 [0,1,0,0,0,0|1,1,0]=3 180 B10R1.31 C=CC1=NC(C(=O)O)=CS1 SBB053119 [0,1,0,0,0,0|1,0,1]=3 181 B10R1.31 CC(=O)C1=CC(CCl)=CS1 SBB002903 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.31 CC(=O)C1=CC(CO)=CS1 SBB002902 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.31 CCC1=CC(C(=O)O)=CS1 SBB010374 [0,1,0,0,0,0|0,0,0]=1 184 B10R1.31 CCC1=CC(C(=O)O)=NO1 SBB050978 [0,1,0,0,0,0|1,1,0]=3 185 B10R1.31 CCC1=CC=C(C(=O)O)O1 SBB085435 [0,1,0,0,0,0|2,0,0]=3 186 B10R1.31 CCC1=CC=C(C(=O)O)S1 SBB019480 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.31 CCC1=CC=C(C(C)=O)S1 SBB021979 [0,1,0,0,0,0|3,0,0]=4 188 B10R1.31 CCC1=NOC(C(=O)O)=C1 SBB025170 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.31 CCN1C=C(C(=O)Cl)C=N1 SBB020716 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.31 CCN1C=C(C(=O)O)C=N1 SBB006977 [0,1,0,0,0,0|2,0,0]=3 191 B10R1.31 CCN1C=C(C(C)=O)C=N1 SBB013503 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.31 CCN1C=CC(C(=O)O)=N1 SBB000010 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.31 COC1=CC=C(C(=O)O)S1 SBB023958 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.31 CSC1=CC=C(C(=O)O)S1 SBB002900 [0,1,0,0,0,0|2,0,0]=3 195 B10R1.31 CSC1=NC(C(=O)O)=CS1 SBB046415 [0,1,0,0,0,0|1,0,0]=2 196 B10R1.31 NC(=O)C1=NOC(CO)=C1 SBB014331 [0,1,0,0,0,0|2,1,0]=4 197 B10R1.31 NCC1=CC=C(C(=O)O)O1 SBB010282 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.31 O=C(O)C1=CC=C(CO)O1 SBB047405 [0,1,0,0,0,0|2,0,0]=3 199 B10R1.31 O=C(O)C1=NN(CO)C=C1 SBB022055 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.31 O=C(O)C1=NOC(CO)=C1 SBB014333 [0,1,0,0,0,0|1,1,0]=3 201 B10R1.31 O=CC1=CC(B(O)O)=CS1 SBB066383 [0,1,0,0,0,0|1,0,2]=4 202 B10R1.31 O=CC1=CC=C(C(=O)O)O1 SBB053087 [0,1,0,0,0,0|2,0,1]=4 203 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 SBB018976 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.58 CC1=C(C)SC(C(=O)O)=C1 SBB009532 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.58 CC1=CC(C(=O)Cl)=NN1C SBB053659 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.58 CC1=CC(C(=O)O)=NN1C SBB005424 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.58 CC1=CC(C(N)=O)=NN1C SBB073422 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.58 CN1N=C(C(=O)O)C=C1N SBB026484 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.58 O=C(O)C1=CC(Br)=C(Br)O1 SBB069102 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 SBB015874 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.59 CC(=O)C1=C(C)N=C(C)S1 SBB006624 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.59 CC(=O)C1=C(C)OC(C)=C1 SBB067074 [0,1,0,0,0,0|1,1,0]=3 213 B10R1.59 CC(=O)C1=C(C)SC(C)=C1 SBB067095 [0,1,0,0,0,0|1,0,0]=2 214 B10R1.59 CC(=O)C1=C(Cl)SC(Cl)=C1 SBB066369 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.59 CC(=O)C1=CC(C)=NN1C SBB021820 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.59 CC(=O)C1=CN(C)N=C1C SBB009284 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.59 CC1=C(C(=O)O)N=C(N)S1 SBB053127 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.59 CC1=C(C(=O)O)SC(Cl)=N1 SBB076311 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.59 CC1=C(C(=O)O)SC(N)=N1 SBB002141 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.59 CC1=CC(B(O)O)=C(C)S1 SBB111012 [0,1,0,0,0,0|1,0,1]=3 221 B10R1.59 CC1=CC(C(=O)Cl)=C(C)O1 SBB050603 [0,1,0,0,0,0|1,1,0]=3 222 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 SBB010130 [0,1,0,0,0,0|1,0,0]=2 223 B10R1.59 CC1=CC(C(=O)O)=C(C)O1 SBB004165 [0,1,0,0,0,0|0,1,0]=2 224 B10R1.59 CC1=CC(C(=O)O)=C(C)S1 SBB017936 [0,1,0,0,0,0|0,0,0]=1 225 B10R1.59 CC1=CC(C)=C(C(=O)O)S1 SBB302001 [0,1,0,0,0,0|2,0,0]=3 226 B10R1.59 CC1=NC(C(N)=O)=C(N)N1 SBB013300 [0,1,0,0,0,0|3,0,0]=4 227 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 SBB010283 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.59 CC1=NC(C)=C(C(=O)O)S1 SBB005433 [0,1,0,0,0,0|2,0,0]=3 229 B10R1.59 CC1=NC(C)=C(C(N)=O)S1 SBB059524 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.59 CC1=NN(C)C(C(=O)O)=C1 SBB005425 [0,1,0,0,0,0|2,0,0]=3 231 B10R1.59 CC1=NN(C)C=C1C(=O)Cl SBB010408 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.59 CC1=NN(C)C=C1C(=O)O SBB000079 [0,1,0,0,0,0|2,0,0]=3 233 B10R1.59 CN1C=C(Br)C(C(=O)O)=N1 SBB000441 [0,1,0,0,0,0|3,0,0]=4 234 B10R1.59 CN1C=C(Cl)C(C(=O)O)=N1 SBB000132 [0,1,0,0,0,0|3,0,0]=4 235 B10R1.59 CN1C=C(I)C(C(=O)O)=N1 SBB000912 [0,1,0,0,0,0|3,0,0]=4 236 B10R1.59 CN1N=C(N)C=C1C(=O)O SBB022937 [0,1,0,0,0,0|3,0,0]=4 237 B10R1.59 NC(=O)C1=C(N)SC(=S)N1 SBB012857 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.59 O=C(O)C1=C(Cl)SC(Cl)=C1 SBB063232 [0,1,0,0,0,0|1,0,0]=2 239 B10R1.194 CC(=O)C1=C(C)N(C)N=C1 SBB020596 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.194 CC1=C(Br)C(C(=O)O)=NO1 SBB073568 [0,1,0,0,0,0|1,1,0]=3 241 B10R1.194 CC1=C(C(=O)Cl)C=NN1C SBB009293 [0,1,0,0,0,0|3,0,0]=4 242 B10R1.194 CC1=C(C(=O)O)C=NN1C SBB000078 [0,1,0,0,0,0|2,0,0]=3 243 B10R1.194 CC1=C(C(=O)O)N=NN1C SBB000082 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 SBB027694 [0,1,0,0,0,0|0,0,0]=1 245 B10R1.194 CC1=C(C)C(C(=O)O)=NO1 SBB022659 [0,1,0,0,0,0|1,1,0]=3 246 B10R1.194 CC1=C(I)C(C(=O)O)=NN1 SBB073960 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.194 CC1=C(N)C(C(=O)O)=NN1 SBB116355 [0,1,0,0,0,0|2,0,0]=3 248 B10R1.194 CC1=C(N)C(C(N)=O)=NN1 SBB116395 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.194 CC1=NNC(C(=O)O)=C1Br SBB081389 [0,1,0,0,0,0|2,0,0]=3 250 B10R1.194 CC1=NOC(C(=O)O)=C1C SBB025198 [0,1,0,0,0,0|2,0,0]=3 251 B10R1.194 CN1N=CC(C(=O)O)=C1Cl SBB053204 [0,1,0,0,0,0|2,0,0]=3 252 B10R1.194 NC1=NNC(C(=O)O)=C1Cl SBB025053 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.194 NC1=NNC(C(=O)O)=C1I SBB073990 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.194 O=C(O)C1=C(Br)C(Br)=NN1 SBB020792 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.194 O=C(O)C1=NSC(Cl)=C1Cl SBB000369 [0,1,0,0,0,0|2,0,0]=3 256 B8R0.9 COC(=O)\C=C\C(=O)O SBB065854 [0,0,1,0,0,0|1,1,1]=4 257 B8R0.9 OC(=O)\C=C/C(=O)NC SBB005847 [0,0,1,0,0,0|2,0,1]=4 258 B8R0.23 C=C(NC(C)=O)C(=O)O SBB072716 [0,0,1,0,0,0|1,1,0]=3 259 B8R0.23 C\C(=C\C(=O)O)C(=O)O SBB065853 [0,0,1,0,0,0|1,1,1]=4 260 B8R0.28 CC(=O)\C=C\C=C(C)C SBB008066 [0,0,1,0,0,0|2,0,1]=4 261 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 SBB040244 [0,0,0,0,0,1|3,0,0]=4 262 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 SBB055637 [0,0,0,0,0,1|3,0,0]=4 263 B10R1.13 CC(=O)C1=CC=C(C)C=C1 SBB058845 [0,0,0,0,0,1|2,0,0]=3 264 B10R1.13 CC(=O)C1=CC=C(C)N=C1 SBB055610 [0,0,0,0,0,1|2,0,0]=3 265 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 SBB040243 [0,0,0,0,0,1|3,0,0]=4 266 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 SBB055593 [0,0,0,0,0,1|3,0,0]=4 267 B10R1.13 CC(=O)C1=CC=C(F)C=C1 SBB040257 [0,0,0,0,0,1|3,0,0]=4 268 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SBB058956 [0,0,0,0,0,1|3,0,0]=4 269 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SBB040278 [0,0,0,0,0,1|3,0,0]=4 270 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SBB040251 [0,0,0,0,0,1|3,0,0]=4 271 B10R1.13 CC1=CC=C(B(O)O)C=C1 SBB048068 [0,0,0,0,0,1|2,0,1]=4 272 B10R1.13 CC1=CC=C(B(O)O)C=N1 SBB052580 [0,0,0,0,0,1|2,0,1]=4 273 B10R1.13 CC1=CC=C(C(=N)N)C=C1 SBB088463 [0,0,0,0,0,1|3,0,0]=4 274 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 SBB058746 [0,0,0,0,0,1|2,0,0]=3 275 B10R1.13 CC1=CC=C(C(=O)O)C=C1 SBB040516 [0,0,0,0,0,1|1,0,0]=2 276 B10R1.13 CC1=CC=C(C(=O)O)C=N1 SBB006666 [0,0,0,0,0,1|1,0,0]=2 277 B10R1.13 CC1=CC=C(C(C)O)C=C1 SBB061733 [0,0,0,0,0,1|2,0,1]=4 278 B10R1.13 CC1=CC=C(C(N)=O)C=C1 SBB007862 [0,0,0,0,0,1|2,0,0]=3 279 B10R1.13 CC1=CC=C(C(N)=S)C=C1 SBB016502 [0,0,0,0,0,1|2,1,0]=4 280 B10R1.13 CC1=CC=C(C(N)=S)C=N1 SBB055742 [0,0,0,0,0,1|2,1,0]=4 281 B10R1.13 CC1=CN=C(B(O)O)C=C1 SBB071136 [0,0,0,0,0,1|2,0,1]=4 282 B10R1.13 CC1=CN=C(C(=O)O)C=C1 SBB052876 [0,0,0,0,0,1|1,0,0]=2 283 B10R1.13 CC1=NC=C(C(=O)O)C=N1 SBB053220 [0,0,0,0,0,1|1,0,0]=2 284 B10R1.13 CC1=NC=C(C(=O)O)N=C1 SBB006622 [0,0,0,0,0,1|1,0,0]=2 285 B10R1.13 CC1=NC=C(C(N)=O)C=C1 SBB028251 [0,0,0,0,0,1|2,0,0]=3 286 B10R1.13 NC(=O)C1=CC=C(F)C=C1 SBB086057 [0,0,0,0,0,1|3,0,0]=4 287 B10R1.13 NC(=O)C1=CC=C(N)C=C1 SBB028159 [0,0,0,0,0,1|3,0,0]=4 288 B10R1.13 NC(=O)C1=CC=C(N)N=C1 SBB051875 [0,0,0,0,0,1|3,0,0]=4 289 B10R1.13 NC(=O)C1=CC=C(O)C=C1 SBB058350 [0,0,0,0,0,1|3,0,0]=4 290 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 SBB028323 [0,0,0,0,0,1|3,0,0]=4 291 B10R1.13 NC1=CC=C(C(=O)O)C=C1 SBB058665 [0,0,0,0,0,1|2,0,0]=3 292 B10R1.13 NC1=CC=C(C(=O)O)C=N1 SBB004186 [0,0,0,0,0,1|2,0,0]=3 293 B10R1.13 NC1=CC=C(C(=O)O)N=C1 SBB028257 [0,0,0,0,0,1|2,0,0]=3 294 B10R1.13 NC1=CC=C(C(=O)O)N=N1 SBB053237 [0,0,0,0,0,1|3,0,0]=4 295 B10R1.13 NC1=CC=C(S(=O)O)C=C1 SBB072620 [0,0,0,0,0,1|3,0,0]=4 296 B10R1.13 NC1=NC=C(C(=O)O)C=N1 SBB053221 [0,0,0,0,0,1|2,0,0]=3 297 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 SBB058718 [0,0,0,0,0,1|3,0,0]=4 298 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 SBB058751 [0,0,0,0,0,1|3,0,0]=4 299 B10R1.13 O=C(Cl)C1=CC=C(Cl)N=C1 SBB053629 [0,0,0,0,0,1|3,0,0]=4 300 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 SBB040628 [0,0,0,0,0,1|3,0,0]=4 301 B10R1.13 O=C(Cl)C1=CN=C(F)C=C1 SBB087392 [0,0,0,0,0,1|3,0,0]=4 302 B10R1.13 O=C(Cl)C1=NC=C(Br)C=C1 SBB069729 [0,0,0,0,0,1|3,0,0]=4 303 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 SBB040519 [0,0,0,0,0,1|2,0,0]=3 304 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 SBB028529 [0,0,0,0,0,1|2,0,0]=3 305 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 SBB040517 [0,0,0,0,0,1|2,0,0]=3 306 B10R1.13 O=C(O)C1=CC=C(Cl)C=N1 SBB062819 [0,0,0,0,0,1|2,0,0]=3 307 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 SBB004004 [0,0,0,0,0,1|2,0,0]=3 308 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 SBB053231 [0,0,0,0,0,1|3,0,0]=4 309 B10R1.13 O=C(O)C1=CC=C(F)C=C1 SBB008568 [0,0,0,0,0,1|2,0,0]=3 310 B10R1.13 O=C(O)C1=CC=C(F)N=C1 SBB065228 [0,0,0,0,0,1|2,0,0]=3 311 B10R1.13 O=C(O)C1=CC=C(I)C=C1 SBB063146 [0,0,0,0,0,1|2,0,0]=3 312 B10R1.13 O=C(O)C1=CC=C(O)N=C1 SBB004181 [0,0,0,0,0,1|2,0,0]=3 313 B10R1.13 O=C(O)C1=CC=[N+]([O-])C=C1 SBB052968 [0,0,0,0,0,1|3,0,0]=4 314 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 SBB028530 [0,0,0,0,0,1|2,0,0]=3 315 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 SBB053223 [0,0,0,0,0,1|2,0,0]=3 316 B10R1.13 O=C(O)C1=CN=C(S)C=C1 SBB004027 [0,0,0,0,0,1|2,0,0]=3 317 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 SBB065695 [0,0,0,0,0,1|3,0,0]=4 318 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 SBB053217 [0,0,0,0,0,1|2,0,0]=3 319 B10R1.13 O=C(O)C1=NC=C(F)C=C1 SBB065401 [0,0,0,0,0,1|2,0,0]=3 320 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SBB052998 [0,0,0,0,0,1|2,0,0]=3 321 B10R1.13 O=C(O)C1=NC=C(O)N=C1 SBB047806 [0,0,0,0,0,1|2,0,0]=3 322 B10R1.13 O=C1C=CC(C(=O)Cl)=CO1 SBB053673 [0,0,0,0,0,1|2,1,0]=4 323 B10R1.13 O=C1C=CC(C(=O)O)=NN1 SBB007399 [0,0,0,0,0,1|3,0,0]=4 324 B10R1.13 O=C1C=CC(C(=O)O)=NN1 SBB053229 [0,0,0,0,0,1|3,0,0]=4 325 B10R1.13 OC(=O)C1=COC(=O)C=C1 SBB004170 [0,0,0,0,0,1|1,1,0]=3 326 B10R1.54 CC(=O)NC1=NOC(C)=C1 SBB113294 [0,0,0,0,0,1|2,1,0]=4 327 B10R1.54 CC1=CC(CC(=O)O)=NN1 SBB002789 [0,0,0,0,0,1|2,0,0]=3 328 B10R1.54 CC1=CN(CC(=O)O)N=C1 SBB009276 [0,0,0,0,0,1|3,0,0]=4 329 B10R1.54 CC1=NC(CC(=O)O)=CS1 SBB018923 [0,0,0,0,0,1|1,0,0]=2 330 B10R1.54 CC1=NC(CC(N)=O)=CS1 SBB059523 [0,0,0,0,0,1|2,0,0]=3 331 B10R1.54 CC1=NN(CC(=O)O)C=C1 SBB020235 [0,0,0,0,0,1|3,0,0]=4 332 B10R1.54 CC1=NOC(CC(=O)O)=C1 SBB053168 [0,0,0,0,0,1|2,0,0]=3 333 B10R1.54 CN1C=CC(CC(=O)O)=N1 SBB049500 [0,0,0,0,0,1|3,0,0]=4 334 B10R1.54 NC(=O)CC1=CSC(N)=N1 SBB047858 [0,0,0,0,0,1|3,0,0]=4 335 B10R1.54 NC1=NC(CC(=O)O)=CS1 SBB003994 [0,0,0,0,0,1|2,0,0]=3 336 B10R1.54 NC1=NC(CC(=O)O)=CS1 SBB067007 [0,0,0,0,0,1|2,0,0]=3 337 B10R1.54 O=C(O)CC1=CC(=O)NN1 SBB014632 [0,0,0,0,0,1|3,0,0]=4 338 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 SBB040258 [0,0,0,0,0,1|3,0,0]=4 339 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 SBB055121 [0,0,0,0,0,1|3,0,0]=4 340 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 SBB055594 [0,0,0,0,0,1|3,0,0]=4 341 B10R1.113 CC(=O)C1=CC=CC(C)=C1 SBB061772 [0,0,0,0,0,1|2,0,0]=3 342 B10R1.113 CC(=O)C1=CC=CC(C)=N1 SBB068974 [0,0,0,0,0,1|3,0,0]=4 343 B10R1.113 CC(=O)C1=CC=CC(F)=C1 SBB063564 [0,0,0,0,0,1|3,0,0]=4 344 B10R1.113 CC(=O)C1=CC=CC(N)=C1 SBB058713 [0,0,0,0,0,1|3,0,0]=4 345 B10R1.113 CC(=O)C1=CC=CC(O)=C1 SBB040280 [0,0,0,0,0,1|3,0,0]=4 346 B10R1.113 CC(=O)C1=CN=CC(Br)=C1 SBB054319 [0,0,0,0,0,1|3,0,0]=4 347 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 SBB055630 [0,0,0,0,0,1|3,0,0]=4 348 B10R1.113 CC1=CC(B(O)O)=CC=C1 SBB048058 [0,0,0,0,0,1|2,0,1]=4 349 B10R1.113 CC1=CC(C(=O)O)=CN=C1 SBB028459 [0,0,0,0,0,1|1,0,0]=2 350 B10R1.113 CC1=CC(C(=O)O)=NC=C1 SBB053015 [0,0,0,0,0,1|1,0,0]=2 351 B10R1.113 CC1=CC(C(N)=O)=CC=C1 SBB007861 [0,0,0,0,0,1|2,0,0]=3 352 B10R1.113 CC1=CC(C(N)=O)=CN=C1 SBB069884 [0,0,0,0,0,1|2,0,0]=3 353 B10R1.113 CC1=CC(C(N)=O)=NC=C1 SBB055569 [0,0,0,0,0,1|2,0,0]=3 354 B10R1.113 CC1=CC(C(N)=S)=NC=C1 SBB055720 [0,0,0,0,0,1|2,1,0]=4 355 B10R1.113 CC1=CC([N+](=O)[O-])=CN=C1 SBB065360 [0,0,0,0,0,1|2,0,1]=4 356 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 SBB058758 [0,0,0,0,0,1|2,0,0]=3 357 B10R1.113 CC1=CC=CC(C(=O)O)=C1 SBB040526 [0,0,0,0,0,1|1,0,0]=2 358 B10R1.113 CC1=CC=CC(C(N)=S)=C1 SBB086796 [0,0,0,0,0,1|2,1,0]=4 359 B10R1.113 CC1=CN=CC(B(O)O)=C1 SBB071112 [0,0,0,0,0,1|2,0,1]=4 360 B10R1.113 CC1=NC(C(=O)O)=CC=C1 SBB028458 [0,0,0,0,0,1|2,0,0]=3 361 B10R1.113 CC1=NC=CC(C(=O)O)=C1 SBB052953 [0,0,0,0,0,1|1,0,0]=2 362 B10R1.113 CC1=NC=CC([N+](=O)[O-])=C1 SBB019157 [0,0,0,0,0,1|2,0,1]=4 363 B10R1.113 CN1CCC=C(C(=O)O)C1 SBB053325 [0,0,0,0,0,1|2,0,1]=4 364 B10R1.113 C[N+]1=CC(C(=O)O)=CC=C1 SBB000182 [0,0,0,0,0,1|2,0,0]=3 365 B10R1.113 C[N+]1=CC(C(=O)[O-])=CC=C1 SBB085963 [0,0,0,0,0,1|2,0,1]=4 366 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 SBB017264 [0,0,0,0,0,1|3,0,0]=4 367 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 SBB016898 [0,0,0,0,0,1|3,0,0]=4 368 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 SBB028413 [0,0,0,0,0,1|3,0,0]=4 369 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 SBB009893 [0,0,0,0,0,1|3,0,0]=4 370 B10R1.113 NC(=O)C1=CC=CC(F)=C1 SBB086055 [0,0,0,0,0,1|3,0,0]=4 371 B10R1.113 NC(=O)C1=CC=CC(N)=C1 SBB028153 [0,0,0,0,0,1|3,0,0]=4 372 B10R1.113 NC(=O)C1=CC=CC(O)=C1 SBB079277 [0,0,0,0,0,1|3,0,0]=4 373 B10R1.113 NC(=O)C1=CC=NC(Cl)=C1 SBB028324 [0,0,0,0,0,1|3,0,0]=4 374 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 SBB055711 [0,0,0,0,0,1|3,0,0]=4 375 B10R1.113 NC1=CC(C(=O)O)=CC=C1 SBB028148 [0,0,0,0,0,1|2,0,0]=3 376 B10R1.113 NC1=CC(C(=O)O)=NC=C1 SBB019433 [0,0,0,0,0,1|2,0,0]=3 377 B10R1.113 NC1=CC=CC(C(=O)O)=C1 SBB017556 [0,0,0,0,0,1|2,0,0]=3 378 B10R1.113 NC1=CC=CC(C(=O)O)=N1 SBB053020 [0,0,0,0,0,1|3,0,0]=4 379 B10R1.113 NC1=CN=CC(C(=O)O)=C1 SBB016179 [0,0,0,0,0,1|2,0,0]=3 380 B10R1.113 NC1=NC=CC(C(=O)O)=C1 SBB053016 [0,0,0,0,0,1|2,0,0]=3 381 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 SBB053636 [0,0,0,0,0,1|3,0,0]=4 382 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 SBB040625 [0,0,0,0,0,1|3,0,0]=4 383 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 SBB058871 [0,0,0,0,0,1|3,0,0]=4 384 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=C1 SBB005463 [0,0,0,0,0,1|3,0,0]=4 385 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 SBB053627 [0,0,0,0,0,1|3,0,0]=4 386 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 SBB003524 [0,0,0,0,0,1|2,0,0]=3 387 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 SBB028531 [0,0,0,0,0,1|2,0,0]=3 388 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 SBB040525 [0,0,0,0,0,1|2,0,0]=3 389 B10R1.113 O=C(O)C1=CC(Cl)=CC=N1 SBB027660 [0,0,0,0,0,1|2,0,0]=3 390 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 SBB004003 [0,0,0,0,0,1|2,0,0]=3 391 B10R1.113 O=C(O)C1=CC(F)=CC=C1 SBB052761 [0,0,0,0,0,1|2,0,0]=3 392 B10R1.113 O=C(O)C1=CC(F)=CN=C1 SBB053038 [0,0,0,0,0,1|2,0,0]=3 393 B10R1.113 O=C(O)C1=CC(I)=CC=C1 SBB052819 [0,0,0,0,0,1|2,0,0]=3 394 B10R1.113 O=C(O)C1=CC(I)=CC=N1 SBB042150 [0,0,0,0,0,1|2,0,0]=3 395 B10R1.113 O=C(O)C1=CC(O)=CC=C1 SBB058844 [0,0,0,0,0,1|2,0,0]=3 396 B10R1.113 O=C(O)C1=CC(O)=NC=C1 SBB052870 [0,0,0,0,0,1|2,0,0]=3 397 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 SBB058408 [0,0,0,0,0,1|2,0,0]=3 398 B10R1.113 O=C(O)C1=CC=CC(Br)=N1 SBB003525 [0,0,0,0,0,1|3,0,0]=4 399 B10R1.113 O=C(O)C1=CC=CC(F)=N1 SBB028461 [0,0,0,0,0,1|3,0,0]=4 400 B10R1.113 O=C(O)C1=CC=NC(F)=C1 SBB028462 [0,0,0,0,0,1|2,0,0]=3 401 B10R1.113 O=C(O)C1=CC=NC(I)=C1 SBB065665 [0,0,0,0,0,1|2,0,0]=3 402 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 SBB028476 [0,0,0,0,0,1|2,0,0]=3 403 B10R1.113 O=C(O)C1=CN=CC(O)=C1 SBB010273 [0,0,0,0,0,1|2,0,0]=3 404 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 SBB028473 [0,0,0,0,0,1|3,0,0]=4 405 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 SBB066005 [0,0,0,0,0,1|3,0,0]=4 406 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 SBB065688 [0,0,0,0,0,1|3,0,0]=4 407 B10R1.113 O=C(O)C1=NC(O)=CC=C1 SBB052861 [0,0,0,0,0,1|3,0,0]=4 408 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 SBB016176 [0,0,0,0,0,1|2,0,0]=3 409 B10R1.113 O=C(O)C1=NC=CC(O)=C1 SBB016174 [0,0,0,0,0,1|2,0,0]=3 410 B10R1.113 O=C(O)C1=NC=NC(O)=C1 SBB069034 [0,0,0,0,0,1|2,0,0]=3 411 B10R1.113 O=C1C=C(C(=O)O)C=NN1 SBB053238 [0,0,0,0,0,1|2,0,0]=3 412 B10R1.113 O=C1N=CC=C(C(=O)O)N1 SBB067353 [0,0,0,0,0,1|3,0,0]=4 413 B7R0.4 CCC\C=C\C(=O)O SBB009088 [1,0,1,0,0,0|1,0,1]=4 414 B7R0.4 C\C=C\C=C\C(=O)O SBB060282 [1,0,1,0,0,0|1,0,0]=3 415 B7R0.5 CC\C=C(/C)C(=O)O SBB069108 [1,0,1,0,0,0|0,0,2]=4 416 B7R0.6 CC(C)\C=C\C(=O)O SBB061966 [1,0,1,0,0,0|0,0,2]=4 417 B7R0.6 NC(=O)\C=C/C(=O)O SBB007773 [1,0,1,0,0,0|1,1,0]=4 418 B7R0.6 O=C(O)\C=C/C(=O)O SBB040567 [1,0,1,0,0,0|1,1,0]=4 419 B7R0.6 O=C(O)\C=C\C(=O)O SBB008547 [1,0,1,0,0,0|1,1,0]=4 420 B7R1.1 BrCC1=CSC=C1 SBB070721 [2,0,0,0,0,0|1,0,1]=4 421 B7R1.1 C#CC1=CSC=C1 SBB066455 [2,0,0,0,0,0|1,0,1]=4 422 B7R1.1 C(=O)C1=CN=CN1 SBB004381 [2,0,0,0,0,0|2,0,0]=4 423 B7R1.1 C(=O)C1=CN=CN1 SBB004382 [2,0,0,0,0,0|2,0,0]=4 424 B7R1.1 C(=O)C1=CSC=C1 SBB004320 [2,0,0,0,0,0|0,0,0]=2 425 B7R1.1 CSC1=CSC=C1 SBB055747 [2,0,0,0,0,0|2,0,0]=4 426 B7R1.1 N#CC1=CSC=C1 SBB047994 [2,0,0,0,0,0|1,0,1]=4 427 B7R1.1 NCC1=CSC=C1 SBB079179 [2,0,0,0,0,0|1,0,1]=4 428 B7R1.1 O=CC1=CC=CN1 SBB004389 [2,0,0,0,0,0|2,0,0]=4 429 B7R1.1 O=CC1=CC=CN1 SBB004390 [2,0,0,0,0,0|2,0,0]=4 430 B7R1.1 O=CC1=CC=CO1 SBB004386 [2,0,0,0,0,0|2,0,0]=4 431 B7R1.1 O=CC1=CC=CS1 SBB004321 [2,0,0,0,0,0|2,0,0]=4 432 B7R1.1 O=CC1=CN=CS1 SBB052293 [2,0,0,0,0,0|2,0,0]=4 433 B7R1.1 O=CC1=CNC=C1 SBB052279 [2,0,0,0,0,0|1,0,0]=3 434 B7R1.1 O=CC1=CNN=C1 SBB021198 [2,0,0,0,0,0|2,0,0]=4 435 B7R1.1 O=CC1=COC=C1 SBB004385 [2,0,0,0,0,0|0,1,0]=3 436 B7R1.1 O=CC1=COC=N1 SBB052299 [2,0,0,0,0,0|1,1,0]=4 437 B7R1.1 O=CC1=CSC=N1 SBB047478 [2,0,0,0,0,0|1,0,0]=3 438 B7R1.1 O=CC1=CSN=N1 SBB052333 [2,0,0,0,0,0|2,0,0]=4 439 B7R1.1 O=CC1=NNC=C1 SBB052310 [2,0,0,0,0,0|2,0,0]=4 440 B7R1.1 OCC1=CSC=C1 SBB004309 [2,0,0,0,0,0|0,0,1]=3 441 B7R1.1 OCC1=CSC=N1 SBB066562 [2,0,0,0,0,0|1,0,1]=4 442 B7R1.2 BrC1=CSC(Br)=C1 SBB099511 [2,0,0,0,0,0|2,0,0]=4 443 B7R1.2 CC1=CC(=O)NO1 SBB055813 [2,0,0,0,0,0|1,1,0]=4 444 B7R1.2 CC1=CNC(C)=C1 SBB059454 [2,0,0,0,0,0|1,0,1]=4 445 B9R1.7 CC1=CC=C(\C=N\O)O1 SBB085593 [1,1,0,0,0,0|2,0,0]=4 446 B9R1.7 CC1=CC=C(\C=N\O)S1 SBB086199 [1,1,0,0,0,0|2,0,0]=4 447 B9R1.7 CN1C=C(\C=N\O)C=N1 SBB019669 [1,1,0,0,0,0|2,0,0]=4 448 B9R1.21 C(=O)C1=CC(CC)=NO1 SBB073356 [1,1,0,0,0,0|2,0,0]=4 449 B9R1.21 C(=O)C1=CC=C(CO)O1 SBB004259 [1,1,0,0,0,0|2,0,0]=4 450 B9R1.21 C(=O)C1=CC=C(CO)O1 SBB004260 [1,1,0,0,0,0|2,0,0]=4 451 B9R1.21 C(=O)C1=CN(CC)N=C1 SBB000003 [1,1,0,0,0,0|2,0,0]=4 452 B9R1.21 CCC1=CC=C(C=O)O1 SBB010056 [1,1,0,0,0,0|2,0,0]=4 453 B9R1.21 CCC1=CC=C(C=O)S1 SBB028644 [1,1,0,0,0,0|2,0,0]=4 454 B9R1.21 CSC1=CC=C(C=O)S1 SBB087319 [1,1,0,0,0,0|2,0,0]=4 455 B9R1.21 O=CC1=CC(CCl)=CS1 SBB002904 [1,1,0,0,0,0|2,0,0]=4 456 B9R1.22 CC1=CC(C#N)=C(N)S1 SBB000075 [1,1,0,0,0,0|1,0,1]=4 457 B9R1.22 CC1=CC(C)=C(C=O)N1 SBB066755 [1,1,0,0,0,0|2,0,0]=4 458 B9R1.22 CC1=CC(C=O)=C(C)S1 SBB009464 [1,1,0,0,0,0|0,0,0]=2 459 B9R1.22 CC1=NC(C)=C(C=O)S1 SBB086201 [1,1,0,0,0,0|2,0,0]=4 460 B9R1.22 CC1=NN(C)C(C=O)=C1 SBB017345 [1,1,0,0,0,0|2,0,0]=4 461 B9R1.22 CC1=NN(C)C=C1C=O SBB000017 [1,1,0,0,0,0|2,0,0]=4 462 B9R1.23 C(=O)C1=CC(C)=C(C)S1 SBB005570 [1,1,0,0,0,0|2,0,0]=4 463 B9R1.23 CC1=C(Br)C=C(C=O)S1 SBB019870 [1,1,0,0,0,0|2,0,0]=4 464 B9R1.23 CC1=CC(C=O)=NN1C SBB021202 [1,1,0,0,0,0|2,0,0]=4 465 B9R1.132 CC1=C(C)C(CO)=CS1 SBB017430 [1,1,0,0,0,0|0,0,1]=3 466 B9R1.132 CC1=C(C=O)C=NN1C SBB000016 [1,1,0,0,0,0|2,0,0]=4 467 B9R1.132 CC1=NC=C(C=O)N1C SBB046710 [1,1,0,0,0,0|2,0,0]=4 468 B9R1.11 COC(=O)C1=CC=CN1 SBB013762 [1,1,0,0,0,0|2,0,0]=4 469 B9R1.11 COC(=O)C1=CC=CO1 SBB059585 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.11 COC(=O)C1=CC=CS1 SBB058305 [1,1,0,0,0,0|2,0,0]=4 471 B9R1.11 COC(=O)C1=CC=NO1 SBB019121 [1,1,0,0,0,0|2,0,0]=4 472 B9R1.11 COC(=O)C1=CNC=N1 SBB053938 [1,1,0,0,0,0|2,0,0]=4 473 B9R1.11 COC(=O)C1=CSC=C1 SBB066577 [1,1,0,0,0,0|0,0,0]=2 474 B9R1.11 COC(=O)C1=CSC=N1 SBB066586 [1,1,0,0,0,0|1,0,0]=3 475 B9R1.11 COC(=O)C1=NNC=C1 SBB000006 [1,1,0,0,0,0|2,0,0]=4 476 B9R1.11 N\C(=N/O)C1=CSC=C1 SBB086240 [1,1,0,0,0,0|1,0,0]=3 477 B9R1.19 O=S(=O)(Cl)C1=CSC=C1 SBB055026 [1,1,0,0,0,0|1,0,1]=4 478 B9R1.41 CC1=C(C(=O)Cl)C=CO1 SBB086364 [1,1,0,0,0,0|1,1,0]=4 479 B9R1.41 CC1=C(C(=O)O)C=CO1 SBB004258 [1,1,0,0,0,0|0,1,0]=3 480 B9R1.41 CC1=C(C(=O)O)C=CS1 SBB053075 [1,1,0,0,0,0|0,0,0]=2 481 B9R1.41 CC1=C(C(=O)O)C=NO1 SBB005909 [1,1,0,0,0,0|1,1,0]=4 482 B9R1.41 CC1=C(C(=O)O)N=CO1 SBB053173 [1,1,0,0,0,0|1,1,0]=4 483 B9R1.41 CC1=C(C(=O)O)N=CS1 SBB053128 [1,1,0,0,0,0|1,0,0]=3 484 B9R1.41 CC1=C(C(=O)O)OC=C1 SBB004257 [1,1,0,0,0,0|2,0,0]=4 485 B9R1.41 CC1=C(C(=O)O)OC=N1 SBB053169 [1,1,0,0,0,0|2,0,0]=4 486 B9R1.41 CC1=C(C(=O)O)ON=C1 SBB053162 [1,1,0,0,0,0|2,0,0]=4 487 B9R1.41 CC1=C(C(=O)O)SC=C1 SBB086237 [1,1,0,0,0,0|2,0,0]=4 488 B9R1.41 CC1=C(C(=O)O)SC=N1 SBB010167 [1,1,0,0,0,0|2,0,0]=4 489 B9R1.41 CC1=NNC=C1C(=O)O SBB013290 [1,1,0,0,0,0|2,0,0]=4 490 B9R1.41 CC1=NOC=C1C(=O)O SBB019198 [1,1,0,0,0,0|1,1,0]=4 491 B9R1.41 CN1C=CC=C1C(=O)O SBB004270 [1,1,0,0,0,0|2,0,0]=4 492 B9R1.41 CN1C=NC=C1C(=O)O SBB053206 [1,1,0,0,0,0|2,0,0]=4 493 B9R1.41 CN1N=CC=C1C(=O)O SBB000007 [1,1,0,0,0,0|2,0,0]=4 494 B9R1.41 NC(=O)C1=C(N)SC=C1 SBB007065 [1,1,0,0,0,0|1,0,0]=3 495 B9R1.41 NC(=O)C1=NSC=C1N SBB014179 [1,1,0,0,0,0|2,0,0]=4 496 B9R1.41 NC1=CNN=C1C(=O)O SBB051546 [1,1,0,0,0,0|2,0,0]=4 497 B9R1.41 NC1=CSN=C1C(=O)O SBB013478 [1,1,0,0,0,0|1,0,0]=3 498 B9R1.41 NC1=NNC=C1C(=O)O SBB001935 [1,1,0,0,0,0|2,0,0]=4 499 B9R1.41 NC1=NSN=C1C(=O)O SBB086401 [1,1,0,0,0,0|2,0,0]=4 500 B9R1.41 O=C(O)C1=C(Br)C=CS1 SBB053051 [1,1,0,0,0,0|2,0,0]=4 501 B9R1.41 O=C(O)C1=C(Br)OC=C1 SBB053084 [1,1,0,0,0,0|0,1,0]=3 502 B9R1.41 O=C(O)C1=C(Br)SC=N1 SBB067595 [1,1,0,0,0,0|1,0,0]=3 503 B9R1.41 O=C(O)C1=C(Cl)C=CS1 SBB003936 [1,1,0,0,0,0|2,0,0]=4 504 B9R1.41 O=C(O)C1=C(O)C=CS1 SBB053061 [1,1,0,0,0,0|2,0,0]=4 505 B9R1.41 O=C(O)C1=NNC=C1Br SBB000292 [1,1,0,0,0,0|2,0,0]=4 506 B9R1.41 O=C(O)C1=NNC=C1Cl SBB000096 [1,1,0,0,0,0|2,0,0]=4 507 B9R1.41 O=C(O)C1=NNC=C1I SBB000762 [1,1,0,0,0,0|2,0,0]=4 508 B9R1.41 O=[N+]([O-])C1=C(Cl)SC=C1 SBB066507 [1,1,0,0,0,0|1,0,1]=4 509 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 SBB006540 [0,1,0,0,0,1|2,0,0]=4 510 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 SBB037877 [0,1,0,0,0,1|1,0,0]=3 511 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 SBB040909 [0,1,0,0,0,1|2,0,0]=4 512 B11R1.3 CCC1=CC=C(C(N)=O)C=C1 SBB116864 [0,1,0,0,0,1|2,0,0]=4 513 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 SBB058256 [0,1,0,0,0,1|1,0,0]=3 514 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 SBB040620 [0,1,0,0,0,1|2,0,0]=4 515 B11R1.3 COC1=CC=C(C(=O)O)C=C1 SBB037872 [0,1,0,0,0,1|1,0,0]=3 516 B11R1.3 COC1=CC=C(C(=O)O)N=N1 SBB053240 [0,1,0,0,0,1|2,0,0]=4 517 B11R1.3 COC1=CC=C(C(C)=O)C=C1 SBB040242 [0,1,0,0,0,1|2,0,0]=4 518 B11R1.3 COC1=NC=C(C(=O)O)C=C1 SBB012818 [0,1,0,0,0,1|1,0,0]=3 519 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 SBB063176 [0,1,0,0,0,1|1,0,0]=3 520 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 SBB088031 [0,1,0,0,0,1|2,0,0]=4 521 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 SBB008570 [0,1,0,0,0,1|1,0,1]=4 522 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 SBB064074 [0,1,0,0,0,1|1,0,1]=4 523 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 SBB006704 [0,1,0,0,0,1|1,0,0]=3 524 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 SBB046616 [0,1,0,0,0,1|2,0,0]=4 525 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 SBB017160 [0,1,0,0,0,1|2,0,0]=4 526 B11R1.3 NNC1=CC=C(C(=O)O)C=N1 SBB052917 [0,1,0,0,0,1|2,0,0]=4 527 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 SBB042644 [0,1,0,0,0,1|1,0,0]=3 528 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 SBB040672 [0,1,0,0,0,1|1,0,0]=3 529 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 SBB052730 [0,1,0,0,0,1|1,0,0]=3 530 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 SBB040263 [0,1,0,0,0,1|1,0,1]=4 531 B11R1.3 OC(=O)C1=CC=C(C=C)C=C1 SBB006579 [0,1,0,0,0,1|1,0,1]=4 532 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 SBB060818 [0,1,0,0,0,1|2,0,0]=4 533 B11R1.21 CC(=O)C1=CC=C(C)C(C)=C1 SBB063673 [0,1,0,0,0,1|2,0,0]=4 534 B11R1.21 CC(=O)C1=CC=C(C)C(F)=C1 SBB086851 [0,1,0,0,0,1|2,0,0]=4 535 B11R1.21 CC1=C(C)C=C(C(=O)Cl)C=C1 SBB053625 [0,1,0,0,0,1|2,0,0]=4 536 B11R1.21 CC1=C(C)C=C(C(N)=O)C=C1 SBB086653 [0,1,0,0,0,1|2,0,0]=4 537 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 SBB064178 [0,1,0,0,0,1|1,0,0]=3 538 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 SBB004034 [0,1,0,0,0,1|1,0,0]=3 539 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 SBB064195 [0,1,0,0,0,1|2,0,0]=4 540 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 SBB003083 [0,1,0,0,0,1|1,0,0]=3 541 B11R1.21 CC1=C(N)C=C(C(N)=O)C=C1 SBB055440 [0,1,0,0,0,1|2,0,0]=4 542 B11R1.21 CC1=CC(C(=O)O)=CC=C1Br SBB063174 [0,1,0,0,0,1|2,0,0]=4 543 B11R1.21 CC1=CC(C(=O)O)=CC=C1Cl SBB063175 [0,1,0,0,0,1|2,0,0]=4 544 B11R1.21 CC1=CC(C(=O)O)=CC=C1I SBB064683 [0,1,0,0,0,1|2,0,0]=4 545 B11R1.21 CC1=CC(C(=O)O)=CC=C1N SBB063076 [0,1,0,0,0,1|2,0,0]=4 546 B11R1.21 CC1=CC(C(=O)O)=CC=C1O SBB017625 [0,1,0,0,0,1|2,0,0]=4 547 B11R1.21 CC1=CC=C(C(=O)Cl)C=C1F SBB088708 [0,1,0,0,0,1|2,0,0]=4 548 B11R1.21 CC1=CC=C(C(=O)O)C=C1Br SBB064706 [0,1,0,0,0,1|1,0,0]=3 549 B11R1.21 CC1=CC=C(C(=O)O)C=C1C SBB043550 [0,1,0,0,0,1|1,0,0]=3 550 B11R1.21 CC1=CC=C(C(=O)O)C=C1N SBB063163 [0,1,0,0,0,1|1,0,0]=3 551 B11R1.21 CC1=CC=C(C(=O)O)C=C1O SBB063353 [0,1,0,0,0,1|1,0,0]=3 552 B11R1.21 CC1=CC=C(C(N)=O)C=C1Br SBB080447 [0,1,0,0,0,1|2,0,0]=4 553 B11R1.21 CC1=CC=C(C(N)=O)C=C1F SBB086917 [0,1,0,0,0,1|2,0,0]=4 554 B11R1.21 CN1C=C(C(=O)O)C=CC1=O SBB017929 [0,1,0,0,0,1|2,0,0]=4 555 B11R1.21 CN1C=CC(C(=O)O)=CC1=O SBB019149 [0,1,0,0,0,1|2,0,0]=4 556 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=N1 SBB052993 [0,1,0,0,0,1|2,0,0]=4 557 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 SBB003842 [0,1,0,0,0,1|2,0,0]=4 558 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 SBB052606 [0,1,0,0,0,1|2,0,0]=4 559 B11R1.21 NC1=C(I)C=C(C(=O)O)C=N1 SBB052994 [0,1,0,0,0,1|2,0,0]=4 560 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 SBB052678 [0,1,0,0,0,1|2,0,0]=4 561 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 SBB006740 [0,1,0,0,0,1|2,0,0]=4 562 B11R1.21 NC1=CC(C(=O)O)=CC=C1Br SBB063465 [0,1,0,0,0,1|2,0,0]=4 563 B11R1.21 NC1=CC(C(=O)O)=CC=C1F SBB063433 [0,1,0,0,0,1|2,0,0]=4 564 B11R1.21 NC1=CC=C(C(=O)O)C=C1Br SBB051432 [0,1,0,0,0,1|2,0,0]=4 565 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl SBB063972 [0,1,0,0,0,1|2,0,0]=4 566 B11R1.21 NC1=CC=C(C(=O)O)C=C1F SBB028317 [0,1,0,0,0,1|2,0,0]=4 567 B11R1.21 NC1=CC=C(C(=O)O)C=C1N SBB000111 [0,1,0,0,0,1|2,0,0]=4 568 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 SBB017622 [0,1,0,0,0,1|2,0,0]=4 569 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)N=C1 SBB053028 [0,1,0,0,0,1|2,0,0]=4 570 B11R1.21 O=C(O)C1=CC(Br)=C(O)N=C1 SBB053030 [0,1,0,0,0,1|2,0,0]=4 571 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)N=C1 SBB003623 [0,1,0,0,0,1|2,0,0]=4 572 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 SBB003796 [0,1,0,0,0,1|2,0,0]=4 573 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 SBB052712 [0,1,0,0,0,1|2,0,0]=4 574 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 SBB006721 [0,1,0,0,0,1|2,0,0]=4 575 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 SBB063489 [0,1,0,0,0,1|2,0,0]=4 576 B11R1.21 O=C(O)C1=CC=C(Br)C(F)=C1 SBB063378 [0,1,0,0,0,1|2,0,0]=4 577 B11R1.21 O=C(O)C1=CC=C(Cl)C(Cl)=C1 SBB063116 [0,1,0,0,0,1|2,0,0]=4 578 B11R1.21 O=C(O)C1=CC=C(Cl)C(O)=C1 SBB008503 [0,1,0,0,0,1|2,0,0]=4 579 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 SBB063453 [0,1,0,0,0,1|2,0,0]=4 580 B11R1.21 O=C(O)C1=CC=C(F)C(O)=C1 SBB008505 [0,1,0,0,0,1|2,0,0]=4 581 B11R1.21 O=C(O)C1=CC=C(I)C(F)=C1 SBB064905 [0,1,0,0,0,1|2,0,0]=4 582 B11R1.21 O=C(O)C1=CC=C(I)C(O)=C1 SBB064163 [0,1,0,0,0,1|2,0,0]=4 583 B11R1.21 O=C(O)C1=CC=C(O)C(Br)=C1 SBB065089 [0,1,0,0,0,1|2,0,0]=4 584 B11R1.21 O=C(O)C1=CC=C(O)C(Cl)=C1 SBB008420 [0,1,0,0,0,1|2,0,0]=4 585 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 SBB064411 [0,1,0,0,0,1|2,0,0]=4 586 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 SBB061371 [0,1,0,0,0,1|2,0,0]=4 587 B11R1.21 O=C(O)C1=CN=C(O)C(Cl)=C1 SBB003814 [0,1,0,0,0,1|2,0,0]=4 588 B11R1.21 O=C(O)C1=CNC(=O)C(Br)=C1 SBB052964 [0,1,0,0,0,1|2,0,0]=4 589 B11R1.21 O=C(O)C1=CNC(=O)C(Cl)=C1 SBB003815 [0,1,0,0,0,1|2,0,0]=4 590 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 SBB038706 [0,1,0,0,0,1|2,0,0]=4 591 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 SBB028287 [0,1,0,0,0,1|2,0,0]=4 592 B11R1.22 CC1=CC=C(\C(N)=N\O)C=C1 SBB022612 [0,1,0,0,0,1|2,0,0]=4 593 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 SBB056753 [0,1,0,0,0,1|2,0,0]=4 594 B11R1.22 CNC(=O)C1=CC=C(C)C=C1 SBB008263 [0,1,0,0,0,1|2,0,0]=4 595 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 SBB063144 [0,1,0,0,0,1|2,0,0]=4 596 B11R1.22 COC(=O)C1=CC=C(Br)N=C1 SBB053855 [0,1,0,0,0,1|2,0,0]=4 597 B11R1.22 COC(=O)C1=CC=C(C)C=C1 SBB064103 [0,1,0,0,0,1|1,0,0]=3 598 B11R1.22 COC(=O)C1=CC=C(C)N=C1 SBB053798 [0,1,0,0,0,1|1,0,0]=3 599 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 SBB063826 [0,1,0,0,0,1|2,0,0]=4 600 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 SBB005815 [0,1,0,0,0,1|2,0,0]=4 601 B11R1.22 COC(=O)C1=CC=C(F)C=C1 SBB053694 [0,1,0,0,0,1|2,0,0]=4 602 B11R1.22 COC(=O)C1=CC=C(I)C=C1 SBB063273 [0,1,0,0,0,1|2,0,0]=4 603 B11R1.22 COC(=O)C1=CC=C(N)N=C1 SBB015053 [0,1,0,0,0,1|2,0,0]=4 604 B11R1.22 COC(=O)C1=CC=C(O)C=C1 SBB040908 [0,1,0,0,0,1|2,0,0]=4 605 B11R1.22 COC(=O)C1=CC=[N+](C)C=C1 SBB086856 [0,1,0,0,0,1|2,0,0]=4 606 B11R1.22 COC(=O)C1=CN=C(F)C=C1 SBB065264 [0,1,0,0,0,1|2,0,0]=4 607 B11R1.22 COC(=O)C1=COC(=O)C=C1 SBB000117 [0,1,0,0,0,1|1,1,0]=4 608 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 SBB053856 [0,1,0,0,0,1|2,0,0]=4 609 B11R1.22 COC(=O)C1=NC=C(C)N=C1 SBB053940 [0,1,0,0,0,1|1,0,0]=3 610 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 SBB053941 [0,1,0,0,0,1|2,0,0]=4 611 B11R1.22 COC(=O)C1=NC=C(O)N=C1 SBB014253 [0,1,0,0,0,1|2,0,0]=4 612 B11R1.22 NC1=CC=C(C(=O)OC)C=C1 SBB004063 [0,1,0,0,0,1|2,0,0]=4 613 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 SBB086842 [0,1,0,0,0,1|2,0,0]=4 614 B11R1.166 CC(=O)C1=CC=C(C)C=C1C SBB058451 [0,1,0,0,0,1|2,0,0]=4 615 B11R1.166 CC1=C(C(=O)O)C=NC(N)=N1 SBB053219 [0,1,0,0,0,1|2,0,0]=4 616 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 SBB017616 [0,1,0,0,0,1|1,0,0]=3 617 B11R1.166 CC1=CC(Br)=CC=C1C(=O)O SBB064476 [0,1,0,0,0,1|2,0,0]=4 618 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O SBB052958 [0,1,0,0,0,1|2,0,0]=4 619 B11R1.166 CC1=CC(Cl)=CC=C1C(=O)O SBB052764 [0,1,0,0,0,1|2,0,0]=4 620 B11R1.166 CC1=CC(F)=C(C(=O)Cl)C=C1 SBB088707 [0,1,0,0,0,1|2,0,0]=4 621 B11R1.166 CC1=CC(F)=CC=C1C(=O)O SBB062990 [0,1,0,0,0,1|2,0,0]=4 622 B11R1.166 CC1=CC(N)=CC=C1C(=O)O SBB063412 [0,1,0,0,0,1|2,0,0]=4 623 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 SBB058803 [0,1,0,0,0,1|1,0,0]=3 624 B11R1.166 CC1=CC(O)=CC=C1C(=O)O SBB064774 [0,1,0,0,0,1|2,0,0]=4 625 B11R1.166 CC1=CC=C(C(=O)Cl)C(C)=C1 SBB088219 [0,1,0,0,0,1|2,0,0]=4 626 B11R1.166 CC1=CC=C(C(=O)O)C(=O)N1 SBB004049 [0,1,0,0,0,1|1,0,0]=3 627 B11R1.166 CC1=CC=C(C(=O)O)C(C)=C1 SBB052762 [0,1,0,0,0,1|1,0,0]=3 628 B11R1.166 CC1=CC=C(C(=O)O)C(C)=N1 SBB053040 [0,1,0,0,0,1|1,0,0]=3 629 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 SBB003843 [0,1,0,0,0,1|1,0,0]=3 630 B11R1.166 CC1=CC=C(C(=O)O)C(F)=C1 SBB063274 [0,1,0,0,0,1|1,0,0]=3 631 B11R1.166 CC1=CC=C(C(=O)O)C(N)=C1 SBB052651 [0,1,0,0,0,1|1,0,0]=3 632 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 SBB010333 [0,1,0,0,0,1|1,0,0]=3 633 B11R1.166 CC1=NC(N)=CC=C1C(=O)O SBB053045 [0,1,0,0,0,1|2,0,0]=4 634 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 SBB028469 [0,1,0,0,0,1|1,0,0]=3 635 B11R1.166 CC1=NC(O)=C(C(=O)O)C=N1 SBB302965 [0,1,0,0,0,1|1,0,0]=3 636 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 SBB028134 [0,1,0,0,0,1|2,0,0]=4 637 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 SBB006590 [0,1,0,0,0,1|2,0,0]=4 638 B11R1.166 NC1=CC(Br)=CC=C1C(=O)O SBB052622 [0,1,0,0,0,1|2,0,0]=4 639 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 SBB008581 [0,1,0,0,0,1|2,0,0]=4 640 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 SBB028315 [0,1,0,0,0,1|2,0,0]=4 641 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 SBB056794 [0,1,0,0,0,1|2,0,0]=4 642 B11R1.166 NC1=NC=C(C(=O)O)C(=O)N1 SBB051517 [0,1,0,0,0,1|2,0,0]=4 643 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 SBB052977 [0,1,0,0,0,1|2,0,0]=4 644 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 SBB003795 [0,1,0,0,0,1|2,0,0]=4 645 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 SBB003833 [0,1,0,0,0,1|2,0,0]=4 646 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 SBB003625 [0,1,0,0,0,1|2,0,0]=4 647 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 SBB003797 [0,1,0,0,0,1|2,0,0]=4 648 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 SBB051451 [0,1,0,0,0,1|2,0,0]=4 649 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 SBB058792 [0,1,0,0,0,1|2,0,0]=4 650 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 SBB058728 [0,1,0,0,0,1|2,0,0]=4 651 B11R1.166 O=C(O)C1=C(O)C=C(O)N=C1 SBB052975 [0,1,0,0,0,1|2,0,0]=4 652 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Br SBB052783 [0,1,0,0,0,1|2,0,0]=4 653 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Cl SBB052614 [0,1,0,0,0,1|2,0,0]=4 654 B11R1.166 O=C(O)C1=CC=C(Br)C=C1F SBB063037 [0,1,0,0,0,1|2,0,0]=4 655 B11R1.166 O=C(O)C1=CC=C(Cl)C=C1Br SBB063375 [0,1,0,0,0,1|2,0,0]=4 656 B11R1.166 O=C(O)C1=CC=C(Cl)C=C1Cl SBB040532 [0,1,0,0,0,1|2,0,0]=4 657 B11R1.166 O=C(O)C1=CC=C(F)C=C1Br SBB063576 [0,1,0,0,0,1|2,0,0]=4 658 B11R1.166 O=C(O)C1=CC=C(F)C=C1F SBB063446 [0,1,0,0,0,1|2,0,0]=4 659 B11R1.166 O=C(O)C1=CC=C(F)C=C1O SBB052701 [0,1,0,0,0,1|2,0,0]=4 660 B11R1.166 O=C(O)C1=CC=C(F)N=C1F SBB065592 [0,1,0,0,0,1|2,0,0]=4 661 B11R1.166 O=C(O)C1=CN=C(O)N=C1O SBB059503 [0,1,0,0,0,1|2,0,0]=4 662 B11R1.166 O=C(O)C1=CNC(=S)NC1=O SBB058139 [0,1,0,0,0,1|2,0,0]=4 663 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F SBB095869 [0,1,0,0,0,1|2,0,0]=4 664 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl SBB052940 [0,1,0,0,0,1|2,0,0]=4 665 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F SBB089091 [0,1,0,0,0,1|2,0,0]=4 666 B11R1.166 O=C(O)C1=NC=C(F)C=C1F SBB052885 [0,1,0,0,0,1|2,0,0]=4 667 B11R1.166 OC(=O)C1=C(O)N=C(O)N=C1 SBB005851 [0,1,0,0,0,1|2,0,0]=4 668 B11R1.39 CC1=NC(CC(=O)NN)=CS1 SBB059505 [0,1,0,0,0,1|2,0,0]=4 669 B11R1.39 COC(=O)CC1=CSC(N)=N1 SBB088659 [0,1,0,0,0,1|2,0,0]=4 670 B11R1.645 CC1=NC(C)=C(CC(=O)O)S1 SBB027445 [0,1,0,0,0,1|2,0,0]=4 671 B11R1.645 CC1=NN(C)C(CC(=O)O)=C1 SBB073674 [0,1,0,0,0,1|2,0,0]=4 672 B11R1.23 CC1=CC(C(=O)NN)=CC=C1 SBB005141 [0,1,0,0,0,1|2,0,0]=4 673 B11R1.23 CC1=CC(\C(N)=N/O)=CC=C1 SBB028288 [0,1,0,0,0,1|2,0,0]=4 674 B11R1.23 CC1=CC=CC(\C(N)=N\O)=C1 SBB055353 [0,1,0,0,0,1|2,0,0]=4 675 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 SBB053805 [0,1,0,0,0,1|2,0,0]=4 676 B11R1.23 COC(=O)C1=CC(N)=NC=C1 SBB053806 [0,1,0,0,0,1|2,0,0]=4 677 B11R1.23 COC(=O)C1=CC(O)=CC=C1 SBB040838 [0,1,0,0,0,1|2,0,0]=4 678 B11R1.23 COC(=O)C1=CC(O)=CN=C1 SBB053854 [0,1,0,0,0,1|2,0,0]=4 679 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 SBB063142 [0,1,0,0,0,1|2,0,0]=4 680 B11R1.23 COC(=O)C1=CC=CC(C)=C1 SBB063121 [0,1,0,0,0,1|1,0,0]=3 681 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 SBB063165 [0,1,0,0,0,1|2,0,0]=4 682 B11R1.23 COC(=O)C1=CC=CC(N)=C1 SBB028299 [0,1,0,0,0,1|2,0,0]=4 683 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 SBB065286 [0,1,0,0,0,1|2,0,0]=4 684 B11R1.23 COC(=O)C1=CN=CC(C)=C1 SBB065251 [0,1,0,0,0,1|1,0,0]=3 685 B11R1.23 COC(=O)C1=NC(C)=CC=C1 SBB116754 [0,1,0,0,0,1|2,0,0]=4 686 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 SBB053796 [0,1,0,0,0,1|2,0,0]=4 687 B11R1.23 NC1=CC(C(=O)O[K])=NC=N1 SBB081932 [0,1,0,0,0,1|2,0,0]=4 688 B11R1.74 CC(=O)C1=CC(C)=CC(F)=C1 SBB086843 [0,1,0,0,0,1|2,0,0]=4 689 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 SBB065386 [0,1,0,0,0,1|1,0,0]=3 690 B11R1.74 CC1=CC(C(=O)O)=CC(F)=C1 SBB052733 [0,1,0,0,0,1|1,0,0]=3 691 B11R1.74 CC1=CC(C(=O)O)=NC(N)=N1 SBB010338 [0,1,0,0,0,1|1,0,0]=3 692 B11R1.74 CC1=CC(C(=O)O)=NC(O)=N1 SBB079555 [0,1,0,0,0,1|1,0,0]=3 693 B11R1.74 CC1=CC(C)=CC(C(=O)Cl)=C1 SBB067894 [0,1,0,0,0,1|2,0,0]=4 694 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 SBB064102 [0,1,0,0,0,1|1,0,0]=3 695 B11R1.74 CC1=CC(Cl)=NC(C(=O)O)=C1 SBB065580 [0,1,0,0,0,1|1,0,0]=3 696 B11R1.74 CC1=CC(F)=CC(C(=O)Cl)=C1 SBB088717 [0,1,0,0,0,1|2,0,0]=4 697 B11R1.74 CC1=CC(F)=CC(C(N)=O)=C1 SBB086905 [0,1,0,0,0,1|2,0,0]=4 698 B11R1.74 CC1=NC(C(=O)O)=CC(O)=N1 SBB303355 [0,1,0,0,0,1|2,0,0]=4 699 B11R1.74 CC1=NC(Cl)=CC(C(=O)O)=C1 SBB005429 [0,1,0,0,0,1|1,0,0]=3 700 B11R1.74 CC1=NC(O)=CC(C(=O)O)=C1 SBB028470 [0,1,0,0,0,1|1,0,0]=3 701 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 SBB064175 [0,1,0,0,0,1|2,0,0]=4 702 B11R1.74 NC1=NC(C(=O)O)=CC(O)=N1 SBB300211 [0,1,0,0,0,1|2,0,0]=4 703 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 SBB052702 [0,1,0,0,0,1|2,0,0]=4 704 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 SBB056677 [0,1,0,0,0,1|2,0,0]=4 705 B11R1.74 O=C(O)C1=CC(Cl)=CC(O)=C1 SBB052708 [0,1,0,0,0,1|2,0,0]=4 706 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 SBB003621 [0,1,0,0,0,1|2,0,0]=4 707 B11R1.74 O=C(O)C1=CC(F)=CC(Br)=C1 SBB063441 [0,1,0,0,0,1|2,0,0]=4 708 B11R1.74 O=C(O)C1=CC(F)=CC(Cl)=C1 SBB064382 [0,1,0,0,0,1|2,0,0]=4 709 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 SBB006663 [0,1,0,0,0,1|2,0,0]=4 710 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 SBB063057 [0,1,0,0,0,1|2,0,0]=4 711 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 SBB058836 [0,1,0,0,0,1|2,0,0]=4 712 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 SBB013446 [0,1,0,0,0,1|2,0,0]=4 713 B11R1.74 O=C1C=C(C(=O)O)C=C(O)N1 SBB027267 [0,1,0,0,0,1|2,0,0]=4 714 B11R1.74 O=C1C=C(C(=O)O)NC(=S)N1 SBB013522 [0,1,0,0,0,1|2,0,0]=4 715 B11R1.74 OC(=O)C1=CC(=O)NC(=O)N1 SBB004017 [0,1,0,0,0,1|2,0,0]=4 716 B11R1.159 CC1=C(Br)C(C(=O)O)=CC=C1 SBB052615 [0,1,0,0,0,1|1,0,0]=3 717 B11R1.159 CC1=C(Br)C=CC=C1C(=O)O SBB052610 [0,1,0,0,0,1|2,0,0]=4 718 B11R1.159 CC1=C(C(=O)O)C=CC=C1N SBB058583 [0,1,0,0,0,1|2,0,0]=4 719 B11R1.159 CC1=C(C)C(C(=O)Cl)=CC=C1 SBB053622 [0,1,0,0,0,1|2,0,0]=4 720 B11R1.159 CC1=C(C)C(C(=O)O)=CC=C1 SBB052600 [0,1,0,0,0,1|1,0,0]=3 721 B11R1.159 CC1=C(C)C(C(N)=O)=CC=C1 SBB062097 [0,1,0,0,0,1|2,0,0]=4 722 B11R1.159 CC1=C(Cl)C=CC=C1C(=O)O SBB063072 [0,1,0,0,0,1|2,0,0]=4 723 B11R1.159 CC1=C(F)C(C(=O)O)=CC=C1 SBB062991 [0,1,0,0,0,1|1,0,0]=3 724 B11R1.159 CC1=C(F)C=CC=C1C(=O)O SBB062992 [0,1,0,0,0,1|2,0,0]=4 725 B11R1.159 CC1=C(O)C(C(=O)O)=CC=C1 SBB040914 [0,1,0,0,0,1|1,0,0]=3 726 B11R1.159 CC1=C(O)C=CC=C1C(=O)O SBB063019 [0,1,0,0,0,1|2,0,0]=4 727 B11R1.159 CC1=CC=CC(C(=O)Cl)=C1F SBB088709 [0,1,0,0,0,1|2,0,0]=4 728 B11R1.159 CC1=CC=CC(C(=O)O)=C1I SBB102482 [0,1,0,0,0,1|1,0,0]=3 729 B11R1.159 CC1=CC=CC(C(=O)O)=C1N SBB028297 [0,1,0,0,0,1|1,0,0]=3 730 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O SBB052645 [0,1,0,0,0,1|2,0,0]=4 731 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl SBB003844 [0,1,0,0,0,1|2,0,0]=4 732 B11R1.159 NC1=C(C(=O)O)C=CC=C1O SBB072170 [0,1,0,0,0,1|2,0,0]=4 733 B11R1.159 NC1=C(Cl)C(C(=O)O)=CC=C1 SBB052697 [0,1,0,0,0,1|2,0,0]=4 734 B11R1.159 NC1=C(O)C(C(=O)O)=CC=C1 SBB001895 [0,1,0,0,0,1|2,0,0]=4 735 B11R1.159 NC1=CC=CC(C(=O)O)=C1N SBB014432 [0,1,0,0,0,1|2,0,0]=4 736 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=CC=C1 SBB003641 [0,1,0,0,0,1|2,0,0]=4 737 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 SBB065375 [0,1,0,0,0,1|2,0,0]=4 738 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 SBB028491 [0,1,0,0,0,1|2,0,0]=4 739 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 SBB006679 [0,1,0,0,0,1|2,0,0]=4 740 B11R1.159 O=C(O)C1=C(F)C(F)=NC=C1 SBB065267 [0,1,0,0,0,1|2,0,0]=4 741 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F SBB062988 [0,1,0,0,0,1|2,0,0]=4 742 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1F SBB063445 [0,1,0,0,0,1|2,0,0]=4 743 B11R1.159 O=C(O)C1=CC=CC(F)=C1Br SBB062989 [0,1,0,0,0,1|2,0,0]=4 744 B11R1.159 O=C(O)C1=CC=CC(F)=C1Cl SBB063452 [0,1,0,0,0,1|2,0,0]=4 745 B11R1.159 O=C(O)C1=CC=CC(F)=C1O SBB052734 [0,1,0,0,0,1|2,0,0]=4 746 B11R1.159 O=C(O)C1=CC=CC(O)=C1O SBB008367 [0,1,0,0,0,1|2,0,0]=4 747 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 SBB086848 [0,1,0,0,0,1|2,0,0]=4 748 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 SBB005399 [0,1,0,0,0,1|2,0,0]=4 749 B11R1.167 CC(=O)C1=CC(C)=CC=C1C SBB058819 [0,1,0,0,0,1|2,0,0]=4 750 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 SBB017684 [0,1,0,0,0,1|2,0,0]=4 751 B11R1.167 CC1=CC(C(=O)Cl)=C(F)C=C1 SBB088705 [0,1,0,0,0,1|2,0,0]=4 752 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 SBB008434 [0,1,0,0,0,1|1,0,0]=3 753 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 SBB064115 [0,1,0,0,0,1|1,0,0]=3 754 B11R1.167 CC1=CC=C(Br)C(C(=O)O)=C1 SBB064480 [0,1,0,0,0,1|1,0,0]=3 755 B11R1.167 CC1=CC=C(Br)C=C1C(=O)O SBB052620 [0,1,0,0,0,1|2,0,0]=4 756 B11R1.167 CC1=CC=C(F)C(C(=O)O)=C1 SBB062994 [0,1,0,0,0,1|1,0,0]=3 757 B11R1.167 CC1=CC=C(F)C=C1C(=O)O SBB064214 [0,1,0,0,0,1|2,0,0]=4 758 B11R1.167 CC1=CC=C(N)C(C(=O)O)=C1 SBB016389 [0,1,0,0,0,1|1,0,0]=3 759 B11R1.167 CC1=CC=C(N)C=C1C(=O)O SBB007566 [0,1,0,0,0,1|2,0,0]=4 760 B11R1.167 CC1=CC=C(O)C=C1C(=O)O SBB064773 [0,1,0,0,0,1|2,0,0]=4 761 B11R1.167 CC1=NC=C(Br)C(C(=O)O)=N1 SBB069047 [0,1,0,0,0,1|2,0,0]=4 762 B11R1.167 CC1=NN=C(Cl)C(C(=O)O)=C1 SBB053236 [0,1,0,0,0,1|1,0,0]=3 763 B11R1.167 CC1=NNC(=O)C(C(=O)O)=C1 SBB053235 [0,1,0,0,0,1|1,0,0]=3 764 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 SBB016392 [0,1,0,0,0,1|2,0,0]=4 765 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 SBB028318 [0,1,0,0,0,1|2,0,0]=4 766 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 SBB001006 [0,1,0,0,0,1|2,0,0]=4 767 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 SBB007820 [0,1,0,0,0,1|2,0,0]=4 768 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=C1 SBB059076 [0,1,0,0,0,1|2,0,0]=4 769 B11R1.167 NC1=CC(C(=O)O)=C(F)C=C1 SBB028316 [0,1,0,0,0,1|2,0,0]=4 770 B11R1.167 NC1=CC=C(Br)C=C1C(=O)O SBB052814 [0,1,0,0,0,1|2,0,0]=4 771 B11R1.167 NC1=CC=C(Cl)C(C(=O)O)=C1 SBB063085 [0,1,0,0,0,1|2,0,0]=4 772 B11R1.167 NC1=CC=C(O)C(C(=O)O)=C1 SBB052617 [0,1,0,0,0,1|2,0,0]=4 773 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O SBB052842 [0,1,0,0,0,1|2,0,0]=4 774 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O SBB003380 [0,1,0,0,0,1|2,0,0]=4 775 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 SBB058878 [0,1,0,0,0,1|2,0,0]=4 776 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 SBB064047 [0,1,0,0,0,1|2,0,0]=4 777 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 SBB065470 [0,1,0,0,0,1|2,0,0]=4 778 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 SBB051445 [0,1,0,0,0,1|2,0,0]=4 779 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=C1 SBB056761 [0,1,0,0,0,1|2,0,0]=4 780 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 SBB058777 [0,1,0,0,0,1|2,0,0]=4 781 B11R1.167 O=C(O)C1=C(O)N=CC(Cl)=C1 SBB028488 [0,1,0,0,0,1|2,0,0]=4 782 B11R1.167 O=C(O)C1=CC(Br)=CC=C1Cl SBB063089 [0,1,0,0,0,1|2,0,0]=4 783 B11R1.167 O=C(O)C1=CC(Br)=CC=C1F SBB063448 [0,1,0,0,0,1|2,0,0]=4 784 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl SBB053021 [0,1,0,0,0,1|2,0,0]=4 785 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O SBB053029 [0,1,0,0,0,1|2,0,0]=4 786 B11R1.167 O=C(O)C1=CC(Br)=CNC1=O SBB052959 [0,1,0,0,0,1|2,0,0]=4 787 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br SBB065031 [0,1,0,0,0,1|2,0,0]=4 788 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1Br SBB063438 [0,1,0,0,0,1|2,0,0]=4 789 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1F SBB063130 [0,1,0,0,0,1|2,0,0]=4 790 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1O SBB065767 [0,1,0,0,0,1|2,0,0]=4 791 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl SBB065260 [0,1,0,0,0,1|2,0,0]=4 792 B11R1.167 O=C(O)C1=CC(Cl)=NN=C1Cl SBB028516 [0,1,0,0,0,1|2,0,0]=4 793 B11R1.167 O=C(O)C1=CC(F)=CC=C1Br SBB063403 [0,1,0,0,0,1|2,0,0]=4 794 B11R1.167 O=C(O)C1=CC(F)=CC=C1Cl SBB063435 [0,1,0,0,0,1|2,0,0]=4 795 B11R1.167 O=C(O)C1=CC(F)=CC=C1F SBB063429 [0,1,0,0,0,1|2,0,0]=4 796 B11R1.167 O=C(O)C1=CC(F)=CC=C1I SBB064452 [0,1,0,0,0,1|2,0,0]=4 797 B11R1.167 O=C(O)C1=CC(F)=CC=C1O SBB066006 [0,1,0,0,0,1|2,0,0]=4 798 B11R1.167 O=C(O)C1=CC(I)=CC=C1Br SBB063432 [0,1,0,0,0,1|2,0,0]=4 799 B11R1.167 O=C(O)C1=CC(I)=CC=C1Cl SBB064075 [0,1,0,0,0,1|2,0,0]=4 800 B11R1.167 O=C(O)C1=CC(I)=CC=C1O SBB057928 [0,1,0,0,0,1|2,0,0]=4 801 B11R1.167 O=C(O)C1=CC(I)=CN=C1O SBB052946 [0,1,0,0,0,1|2,0,0]=4 802 B11R1.167 O=C(O)C1=CC(O)=CC=C1Cl SBB062886 [0,1,0,0,0,1|2,0,0]=4 803 B11R1.167 O=C(O)C1=CC(O)=CC=C1F SBB062887 [0,1,0,0,0,1|2,0,0]=4 804 B11R1.266 C(=O)C1=CC(C(=O)O)=CC=C1 SBB008438 [0,1,0,0,0,1|1,0,1]=4 805 B11R1.266 CNC1=NC=CC(C(=O)O)=C1 SBB052869 [0,1,0,0,0,1|1,0,0]=3 806 B11R1.266 COC1=CC(C(=O)Cl)=CC=C1 SBB058624 [0,1,0,0,0,1|2,0,0]=4 807 B11R1.266 COC1=CC(C(C)=O)=CC=C1 SBB040249 [0,1,0,0,0,1|2,0,0]=4 808 B11R1.266 COC1=CN=CC(C(=O)O)=C1 SBB052945 [0,1,0,0,0,1|1,0,0]=3 809 B11R1.266 COC1=NC=CC(C(=O)O)=C1 SBB018666 [0,1,0,0,0,1|1,0,0]=3 810 B11R1.266 CSC1=CC=CC(C(=O)O)=C1 SBB058990 [0,1,0,0,0,1|1,0,0]=3 811 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 SBB052736 [0,1,0,0,0,1|1,0,1]=4 812 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 SBB052654 [0,1,0,0,0,1|1,0,0]=3 813 B11R1.266 NNC1=CC(C(=O)O)=CC=C1 SBB047116 [0,1,0,0,0,1|2,0,0]=4 814 B11R1.266 NNC1=NC=CC(C(=O)O)=C1 SBB053017 [0,1,0,0,0,1|2,0,0]=4 815 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 SBB021962 [0,1,0,0,0,1|1,0,0]=3 816 B11R1.266 O=C(O)C1=NC(CO)=CC=C1 SBB052877 [0,1,0,0,0,1|2,0,0]=4 817 B11R1.266 OC(=O)C1=CC(OC)=CC=C1 SBB015065 [0,1,0,0,0,1|1,0,0]=3 818 B11R1.15 CCOC(=O)C1=CC(C)=NN1 SBB053932 [0,2,0,0,0,0|2,0,0]=4 819 B11R1.15 CCOC(=O)C1=CN(C)N=C1 SBB116499 [0,2,0,0,0,0|2,0,0]=4 820 B11R1.15 CCOC(=O)C1=CN=C(C)S1 SBB053908 [0,2,0,0,0,0|2,0,0]=4 821 B11R1.15 CCOC(=O)C1=COC(C)=N1 SBB053930 [0,2,0,0,0,0|1,1,0]=4 822 B11R1.15 CCOC(=O)C1=CSC(Br)=N1 SBB053905 [0,2,0,0,0,0|2,0,0]=4 823 B11R1.15 CCOC(=O)C1=CSC(C)=N1 SBB088520 [0,2,0,0,0,0|1,0,0]=3 824 B11R1.15 CCOC(=O)C1=CSC(N)=N1 SBB000178 [0,2,0,0,0,0|2,0,0]=4 825 B11R1.15 CCOC(=O)C1=NOC(C)=C1 SBB050105 [0,2,0,0,0,0|1,1,0]=4 826 B11R1.44 CCC1=CC(C(=O)NN)=CS1 SBB020619 [0,2,0,0,0,0|1,0,0]=3 827 B11R1.44 CCC1=CC(C(=O)OC)=CS1 SBB024663 [0,2,0,0,0,0|0,0,0]=2 828 B11R1.44 COC(=O)C1=CC=C(CBr)S1 SBB019100 [0,2,0,0,0,0|2,0,0]=4 829 B11R1.44 COC(=O)C1=CC=C(CCl)O1 SBB003794 [0,2,0,0,0,0|2,0,0]=4 830 B11R1.44 COC(=O)C1=CC=C(CCl)S1 SBB000291 [0,2,0,0,0,0|2,0,0]=4 831 B11R1.44 COC(=O)C1=CN(CCl)N=C1 SBB022251 [0,2,0,0,0,0|2,0,0]=4 832 B11R1.44 COC(=O)C1=CN(CO)N=C1 SBB025354 [0,2,0,0,0,0|2,0,0]=4 833 B11R1.44 COC(=O)C1=COC(CCl)=N1 SBB089093 [0,2,0,0,0,0|1,1,0]=4 834 B11R1.225 CC1=CC(C(=O)CCl)=C(C)S1 SBB049516 [0,2,0,0,0,0|1,0,0]=3 835 B11R1.225 CC1=CC(C(=O)NN)=C(C)O1 SBB040705 [0,2,0,0,0,0|1,1,0]=4 836 B11R1.225 CC1=CC(C(=O)NN)=C(N)S1 SBB017464 [0,2,0,0,0,0|1,0,0]=3 837 B11R1.225 COC(=O)C1=C(Br)SC(N)=N1 SBB066417 [0,2,0,0,0,0|2,0,0]=4 838 B11R1.225 COC(=O)C1=C(C)NC(C)=C1 SBB086922 [0,2,0,0,0,0|1,0,0]=3 839 B11R1.225 COC(=O)C1=C(C)SC(N)=N1 SBB053910 [0,2,0,0,0,0|2,0,0]=4 840 B11R1.225 COC(=O)C1=C(Cl)SC(Cl)=C1 SBB103246 [0,2,0,0,0,0|1,0,0]=3 841 B11R1.225 COC(=O)C1=C(Cl)SC(N)=N1 SBB091503 [0,2,0,0,0,0|2,0,0]=4 842 B11R1.225 COC(=O)C1=C(N)C=C(C)S1 SBB088521 [0,2,0,0,0,0|2,0,0]=4 843 B11R1.225 COC(=O)C1=C(N)SC(C)=C1 SBB005987 [0,2,0,0,0,0|0,0,0]=2 844 B11R1.225 COC(=O)C1=C(O)C=C(C)S1 SBB015383 [0,2,0,0,0,0|2,0,0]=4 845 B11R1.225 COC(=O)C1=CC(C)=NN1C SBB024110 [0,2,0,0,0,0|2,0,0]=4 846 B11R1.225 COC(=O)C1=CN(C)N=C1C SBB024567 [0,2,0,0,0,0|2,0,0]=4 847 B11R1.226 COC(=O)C1=NN(C)C(C)=C1 SBB007598 [0,2,0,0,0,0|2,0,0]=4 848 B11R1.865 COC(=O)C1=C(C)N(C)N=C1 SBB024748 [0,2,0,0,0,0|2,0,0]=4 849 B11R1.865 COC(=O)C1=C(Cl)C(C)=CS1 SBB091202 [0,2,0,0,0,0|2,0,0]=4 850 B11R1.865 COC(=O)C1=C(N)C(C)=CS1 SBB028367 [0,2,0,0,0,0|2,0,0]=4 851 B11R1.865 COC(=O)C1=NNC(C)=C1N SBB116413 [0,2,0,0,0,0|2,0,0]=4 852 B11R1.45 CCC1=CC(S(=O)(=O)Cl)=CS1 SBB073403 [0,2,0,0,0,0|1,0,1]=4 853 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 SBB020812 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.48 CCC1=C(C)C=C(C(=O)O)S1 SBB085301 [0,2,0,0,0,0|2,0,0]=4 855 B11R1.48 CCN1N=C(C(=O)O)C=C1C SBB024781 [0,2,0,0,0,0|2,0,0]=4 856 B11R1.50 CCC1=NC(C)=C(C(=O)O)O1 SBB069306 [0,2,0,0,0,0|2,0,0]=4 857 B11R1.50 CCC1=NN(C)C(C(=O)O)=C1 SBB010349 [0,2,0,0,0,0|2,0,0]=4 858 B11R1.50 CCN1C=C(C(=O)O)C(C)=N1 SBB006975 [0,2,0,0,0,0|2,0,0]=4 859 B11R1.50 CNC1=NC(C)=C(C(=O)O)S1 SBB010541 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.124 CCCC1=CC(C(=O)O)=CS1 SBB020620 [0,2,0,0,0,0|0,0,0]=2 861 B11R1.124 CCCC1=CC(C(=O)O)=NO1 SBB010360 [0,2,0,0,0,0|1,1,0]=4 862 B11R1.124 CCCC1=CC=C(C(=O)O)S1 SBB009571 [0,2,0,0,0,0|2,0,0]=4 863 B11R1.124 CCCC1=NOC(C(=O)O)=C1 SBB025167 [0,2,0,0,0,0|2,0,0]=4 864 B11R1.124 CCCN1C=C(C(=O)O)C=N1 SBB010351 [0,2,0,0,0,0|2,0,0]=4 865 B11R1.124 CCSC1=CC=C(C(=O)O)S1 SBB023961 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.124 COCC1=CC=C(C(=O)O)O1 SBB081885 [0,2,0,0,0,0|2,0,0]=4 867 B11R1.124 COCC1=CC=C(C(=O)O)S1 SBB111602 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.124 NCCN1C=C(C(=O)O)C=N1 SBB033437 [0,2,0,0,0,0|2,0,0]=4 869 B11R1.124 O=C(O)C1=CN(CCCl)N=C1 SBB014944 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.124 O=C(O)C1=CN(CCO)N=C1 SBB033469 [0,2,0,0,0,0|2,0,0]=4 871 B11R1.175 CC(=O)C1=CC(C(=O)O)=NN1 SBB014975 [0,2,0,0,0,0|2,0,0]=4 872 B11R1.175 CC(=O)C1=CC=C(C(=O)O)S1 SBB057924 [0,2,0,0,0,0|2,0,0]=4 873 B11R1.175 CC(C)C1=CC(C(=O)O)=CS1 SBB017967 [0,2,0,0,0,0|0,0,0]=2 874 B11R1.175 CC(C)C1=CC(C(=O)O)=NO1 SBB010358 [0,2,0,0,0,0|1,1,0]=4 875 B11R1.175 CC(C)C1=CC=C(C(=O)O)S1 SBB023953 [0,2,0,0,0,0|2,0,0]=4 876 B11R1.175 CC(C)C1=NNC(C(=O)O)=C1 SBB010346 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.175 CC(C)C1=NOC(C(=O)O)=C1 SBB026009 [0,2,0,0,0,0|2,0,0]=4 878 B11R1.175 CC(C)N1C=C(C(=O)O)C=N1 SBB007276 [0,2,0,0,0,0|2,0,0]=4 879 B11R1.175 CC(N)C1=CC=C(C(=O)O)O1 SBB302058 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.175 O=C(O)C1=CC(C(F)F)=NN1 SBB073528 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.175 O=C(O)C1=CN(C(F)F)N=C1 SBB073555 [0,2,0,0,0,0|2,0,0]=4 882 B11R1.175 O=C(O)C1=CSC([N+](=O)[O-])=C1 SBB028484 [0,2,0,0,0,0|1,0,0]=3 883 B11R1.473 CCC1=NNC(C(=O)O)=C1C SBB301865 [0,2,0,0,0,0|2,0,0]=4 884 B11R1.473 CCN1N=CC(C(=O)O)=C1C SBB006976 [0,2,0,0,0,0|2,0,0]=4 885 B11R1.473 CCN1N=CC(C(=O)O)=C1F SBB116452 [0,2,0,0,0,0|2,0,0]=4 886 B11R1.672 CC1=C(Br)C(C(=O)O)=NN1C SBB019513 [0,2,0,0,0,0|2,0,0]=4 887 B11R1.672 CC1=C(Cl)C(C(=O)O)=NN1C SBB019662 [0,2,0,0,0,0|2,0,0]=4 888 B11R1.49 CCN1N=C(C)C=C1C(=O)O SBB005436 [0,2,0,0,0,0|2,0,0]=4 889 B11R1.673 CC1=C(C)C(C(N)=O)=C(N)S1 SBB000163 [0,2,0,0,0,0|1,0,0]=3 890 B11R1.673 CC1=NN(C)C(C(=O)O)=C1Br SBB019512 [0,2,0,0,0,0|2,0,0]=4 891 B11R1.673 CC1=NN(C)C(C(=O)O)=C1Cl SBB019485 [0,2,0,0,0,0|2,0,0]=4 892 B11R1.673 CC1=NN(C)C(C)=C1C(=O)O SBB020155 [0,2,0,0,0,0|2,0,0]=4 893 B11R1.673 CC1=NN(C)C(Cl)=C1C(=O)O SBB053203 [0,2,0,0,0,0|2,0,0]=4 894 B11R1.673 CC1=NN(C)C(F)=C1C(=O)O SBB116449 [0,2,0,0,0,0|2,0,0]=4 895 B11R1.64 CCC1=C(C)SC=C1C(=O)O SBB020618 [0,2,0,0,0,0|0,0,0]=2 896 B11R1.64 COC1=C(C(=O)O)SC=C1C SBB036128 [0,2,0,0,0,0|2,0,0]=4 897 B11R1.64 COC1=C(Cl)SC=C1C(=O)O SBB053076 [0,2,0,0,0,0|1,0,0]=3 898 B9R1.6 O=C(O)C1=CC=CC=C1 SBB040515 [0,0,1,1,0,0|1,0,1]=4 899 B9R1.6 O=C(O)C1=CC=CN=C1 SBB004279 [0,0,1,1,0,0|1,0,1]=4 900 B9R1.6 O=C(O)C1=CN=CN=C1 SBB053218 [0,0,1,1,0,0|2,0,0]=4 901 B9R1.2 C(=O)C1=CC=CC(C)=N1 SBB004287 [1,0,0,0,0,1|2,0,0]=4 902 B9R1.2 CC1=CC(C=O)=NC=C1 SBB052226 [1,0,0,0,0,1|1,0,0]=3 903 B9R1.2 CC1=CC=CC(CO)=C1 SBB064816 [1,0,0,0,0,1|1,0,1]=4 904 B9R1.2 O=CC1=CC(Br)=CN=C1 SBB052232 [1,0,0,0,0,1|2,0,0]=4 905 B9R1.2 O=CC1=CC(Br)=NC=C1 SBB052237 [1,0,0,0,0,1|2,0,0]=4 906 B9R1.2 O=CC1=CC(Cl)=NC=C1 SBB052242 [1,0,0,0,0,1|2,0,0]=4 907 B9R1.2 O=CC1=CC=CC(Br)=C1 SBB028648 [1,0,0,0,0,1|2,0,0]=4 908 B9R1.2 O=CC1=CC=CC(Cl)=C1 SBB040204 [1,0,0,0,0,1|2,0,0]=4 909 B9R1.2 O=CC1=CC=CC(F)=C1 SBB040273 [1,0,0,0,0,1|2,0,0]=4 910 B9R1.2 O=CC1=CC=CC(I)=C1 SBB064701 [1,0,0,0,0,1|2,0,0]=4 911 B9R1.2 O=CC1=CC=CC(O)=C1 SBB040208 [1,0,0,0,0,1|2,0,0]=4 912 B9R1.2 O=CC1=CN=CC(F)=C1 SBB065432 [1,0,0,0,0,1|2,0,0]=4 913 B9R1.13 O=C(O)CC1=CN=CN1 SBB003940 [1,0,0,0,0,1|2,0,0]=4 914 B9R1.13 O=C(O)CC1=CSC=N1 SBB018908 [1,0,0,0,0,1|1,0,0]=3 915 B9R1.13 O=C(O)CN1C=CN=C1 SBB010182 [1,0,0,0,0,1|2,0,0]=4 916 B9R1.13 OC(=O)CC1=CC=CS1 SBB004145 [1,0,0,0,0,1|2,0,0]=4 917 B9R1.13 OC(=O)CC1=CNC=N1 SBB005448 [1,0,0,0,0,1|2,0,0]=4 918 B9R1.13 OC(=O)CC1=CSC=C1 SBB004147 [1,0,0,0,0,1|0,0,0]=2 919 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 SBB059339 [0,0,0,0,0,2|2,0,0]=4 920 B11R1.20 CC(=O)NC1=CC=C(C)C=N1 SBB086721 [0,0,0,0,0,2|2,0,0]=4 921 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 SBB060032 [0,0,0,0,0,2|2,0,0]=4 922 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 SBB063734 [0,0,0,0,0,2|1,0,0]=3 923 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 SBB028290 [0,0,0,0,0,2|2,0,0]=4 924 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 SBB028301 [0,0,0,0,0,2|2,0,0]=4 925 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 SBB042842 [0,0,0,0,0,2|2,0,0]=4 926 B11R1.20 O=C(O)CC1=CC=C(Br)C=N1 SBB062888 [0,0,0,0,0,2|2,0,0]=4 927 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 SBB008374 [0,0,0,0,0,2|2,0,0]=4 928 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 SBB027117 [0,0,0,0,0,2|2,0,0]=4 929 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 SBB052671 [0,0,0,0,0,2|2,0,0]=4 930 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 SBB052672 [0,0,0,0,0,2|2,0,0]=4 931 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 SBB059600 [0,0,0,0,0,2|2,0,0]=4 932 B11R1.75 CC1=CC=C(CCC(=O)O)O1 SBB007451 [0,0,0,0,0,2|2,0,0]=4 933 B11R1.75 CC1=CC=C(\C=C\C(=O)O)O1 SBB005723 [0,0,0,0,0,2|2,0,0]=4 934 B11R1.75 CN1C=C(C#CC(=O)O)C=N1 SBB116277 [0,0,0,0,0,2|2,0,0]=4 935 B11R1.75 CN1C=C(CCC(=O)O)C=N1 SBB022169 [0,0,0,0,0,2|2,0,0]=4 936 B11R1.75 CN1C=C(\C=C\C(=O)O)C=N1 SBB019498 [0,0,0,0,0,2|2,0,0]=4 937 B11R1.75 NC1=NC(CCC(=O)O)=CS1 SBB010542 [0,0,0,0,0,2|2,0,0]=4 938 B11R1.157 CC(=O)CC1=CC(C)=CC=N1 SBB025632 [0,0,0,0,0,2|2,0,0]=4 939 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 SBB059218 [0,0,0,0,0,2|2,0,0]=4 940 B11R1.157 CC(=O)OC1=CC(C)=CC=C1 SBB060031 [0,0,0,0,0,2|2,0,0]=4 941 B11R1.157 CC1=CC(NC(N)=O)=CC=C1 SBB028291 [0,0,0,0,0,2|2,0,0]=4 942 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 SBB068547 [0,0,0,0,0,2|1,0,0]=3 943 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 SBB068772 [0,0,0,0,0,2|2,0,0]=4 944 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 SBB037935 [0,0,0,0,0,2|2,0,0]=4 945 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 SBB063159 [0,0,0,0,0,2|2,0,0]=4 946 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 SBB063367 [0,0,0,0,0,2|2,0,0]=4 947 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 SBB064349 [0,0,0,0,0,2|2,0,0]=4 948 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 SBB063147 [0,0,0,0,0,2|2,0,0]=4