0 B14R2.101 C1=CC=C(NCC2=CC=CS2)C=C1 SBB073108 [0,0,0,0,0,0|3,0,0]=3 1 B14R2.101 C1=CC=C(NCC2=CC=CS2)N=C1 SBB073089 [0,0,0,0,0,0|4,0,0]=4 2 B14R2.101 C1=CN=C(NCC2=CC=CO2)C=C1 SBB073086 [0,0,0,0,0,0|4,0,0]=4 3 B15R2.55 NC1=NON=C1OCC2=CC=CC=C2 SBB002771 [0,1,0,0,0,0|2,0,1]=4 4 B15R2.55 OC1=NON=C1NCC2=CC=CC=C2 SBB002774 [0,1,0,0,0,0|2,0,1]=4 5 B15R2.64 O=C(CC1=CC=CC=C1)C2=CC=CS2 SBB021381 [0,1,0,0,0,0|2,0,1]=4 6 B15R2.100 CC1=CC=C(NCC2=CC=CO2)C=C1 SBB043915 [0,1,0,0,0,0|3,0,0]=4 7 B15R2.100 CC1=CC=C(NCC2=CC=CS2)C=C1 SBB073076 [0,1,0,0,0,0|3,0,0]=4 8 B15R2.100 ClC1=CC=C(CNC2=NC=NN2)C=C1 SBB000478 [0,1,0,0,0,0|2,0,1]=4 9 B15R2.100 ClC1=CC=C(CSC2=NNC=N2)C=C1 SBB040436 [0,1,0,0,0,0|2,0,0]=3 10 B15R2.100 ClC1=CC=C(NCC2=CC=CS2)C=C1 SBB073078 [0,1,0,0,0,0|3,0,0]=4 11 B15R2.100 FC1=CC=C(NCC2=CC=CS2)C=C1 SBB073079 [0,1,0,0,0,0|3,0,0]=4 12 B15R2.100 NC1=CC=C(CCC2=NN=NN2)C=C1 SBB027199 [0,1,0,0,0,0|2,0,1]=4 13 B15R2.100 NC1=CC=C(OCC2=CC=CO2)C=C1 SBB009582 [0,1,0,0,0,0|3,0,0]=4 14 B15R2.100 NC1=CC=C(SCC2=CC=CO2)C=C1 SBB014076 [0,1,0,0,0,0|3,0,0]=4 15 B15R2.100 OC1=CC=C(NCC2=CC=CO2)C=C1 SBB010799 [0,1,0,0,0,0|3,0,0]=4 16 B15R2.100 OC1=CC=C(NCC2=CC=CS2)C=C1 SBB011122 [0,1,0,0,0,0|3,0,0]=4 17 B15R2.283 CN1C=C(CNC2=CC=CC=C2)C=N1 SBB021570 [0,1,0,0,0,0|3,0,0]=4 18 B15R2.283 CN1C=CC(CNC2=CC=CC=C2)=N1 SBB021581 [0,1,0,0,0,0|3,0,0]=4 19 B15R2.283 CN1C=CC(NCC2=CC=CC=C2)=N1 SBB024372 [0,1,0,0,0,0|3,0,0]=4 20 B15R2.283 NC1=NC(CCC2=CC=CC=C2)=NN1 SBB083277 [0,1,0,0,0,0|1,0,0]=2 21 B15R2.283 NC1=NC(COC2=CC=CC=C2)=NN1 SBB083278 [0,1,0,0,0,0|2,0,0]=3 22 B15R2.283 NC1=NC(SCC2=CC=CC=C2)=NN1 SBB082492 [0,1,0,0,0,0|2,0,0]=3 23 B15R2.283 NC1=NC(SCC2=CC=CC=C2)=NS1 SBB027494 [0,1,0,0,0,0|3,0,0]=4 24 B15R2.283 NC1=NN=C(CCC2=CC=CC=C2)S1 SBB011124 [0,1,0,0,0,0|2,0,1]=4 25 B15R2.283 NC1=NSC(SCC2=CC=CC=C2)=N1 SBB059104 [0,1,0,0,0,0|2,0,1]=4 26 B15R2.283 OC1=NSC(SCC2=CC=CC=C2)=N1 SBB059106 [0,1,0,0,0,0|2,0,1]=4 27 B15R2.562 ClC1=CC=CC=C1NCC2=CC=CS2 SBB073112 [0,1,0,0,0,0|3,0,0]=4 28 B15R2.562 FC1=CC=CC=C1NCC2=CC=CS2 SBB072510 [0,1,0,0,0,0|3,0,0]=4 29 B15R2.562 NC1=CC=CC=C1OCC2=CC=CO2 SBB009581 [0,1,0,0,0,0|3,0,0]=4 30 B15R2.1117 CC1=CC(CSC2=NNC=N2)=CC=C1 SBB016319 [0,1,0,0,0,0|2,0,0]=3 31 B15R2.1117 ClC1=CC=CC(NCC2=CC=CS2)=C1 SBB073087 [0,1,0,0,0,0|3,0,0]=4 32 B15R2.1259 OC(CN1C=CC=C1)C2=CC=CC=C2 SBB013225 [0,1,0,0,0,0|3,0,0]=4 33 B13R2.64 C1=CC=C(CC2=NCCN2)C=C1 SBB000360 [0,0,0,0,1,0|2,0,1]=4 34 B13R2.64 C1=CC=C(CC2=NNN=N2)C=C1 SBB087446 [0,0,0,0,1,0|2,0,0]=3 35 B13R2.64 C1=CC=C(CN2C=CN=C2)C=C1 SBB003990 [0,0,0,0,1,0|2,0,1]=4 36 B13R2.64 C1=CC=C(NC2=NC=CS2)C=C1 SBB023787 [0,0,0,0,1,0|3,0,0]=4 37 B13R2.64 C1=CC=C(OC2=CSC=C2)C=C1 SBB056213 [0,0,0,0,1,0|3,0,0]=4 38 B13R2.64 C1=CC=C(SC2=CC=CS2)C=C1 SBB056212 [0,0,0,0,1,0|3,0,0]=4 39 B13R2.64 C1=CC=C(SC2=CSC=C2)C=C1 SBB091497 [0,0,0,0,1,0|3,0,0]=4 40 B13R2.64 N1CCN=C1CC2=CC=CC=C2 SBB003964 [0,0,0,0,1,0|2,0,1]=4 41 B15R2.2195 C1=CC(CCC2=CC=NC=C2)=CC=N1 SBB012385 [0,0,0,0,0,1|2,0,1]=4 42 B15R2.2195 C1=CC=C(CNC2=CC=CC=C2)C=C1 SBB058377 [0,0,0,0,0,1|3,0,0]=4 43 B15R2.2195 C1=CC=C(CNC2=CC=CC=N2)C=C1 SBB039207 [0,0,0,0,0,1|2,0,0]=3 44 B15R2.2195 C1=CC=C(COC2=CC=CC=C2)C=C1 SBB008247 [0,0,0,0,0,1|3,0,0]=4 45 B15R2.2195 C1=CC=C(NCC2=CC=CC=N2)C=C1 SBB301389 [0,0,0,0,0,1|2,0,0]=3 46 B15R2.2195 C1=CC=C(NCC2=CC=CN=C2)C=C1 SBB301390 [0,0,0,0,0,1|2,0,0]=3 47 B15R2.2195 C1=CC=C(NCC2=CC=NC=C2)C=C1 SBB301391 [0,0,0,0,0,1|2,0,1]=4 48 B15R2.2196 C1=CC=C(CNCC2=CC=CO2)C=C1 SBB007172 [0,0,0,0,0,1|2,0,0]=3 49 B15R2.2196 C1=CC=C(CNCC2=CC=CO2)N=C1 SBB007195 [0,0,0,0,0,1|3,0,0]=4 50 B15R2.2196 C1=CN=CC(CNCC2=CC=CO2)=C1 SBB007187 [0,0,0,0,0,1|3,0,0]=4 51 B15R2.2196 C1=CN=CC(CNCC2=CC=CS2)=C1 SBB027751 [0,0,0,0,0,1|3,0,0]=4 52 B15R2.2196 C1=COC(CNCC2=CC=NC=C2)=C1 SBB007196 [0,0,0,0,0,1|3,0,0]=4 53 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 SBB068279 [1,0,1,0,0,0|2,0,0]=4 54 B12R1.27 NNC(=O)CCC1=CC=CC=C1 SBB000151 [1,0,1,0,0,0|1,0,1]=4 55 B14R2.19 BrC1=CN(CC2=CC=CC=C2)N=C1 SBB098735 [0,1,0,0,1,0|2,0,0]=4 56 B14R2.19 IC1=CN(CC2=CC=CC=C2)N=C1 SBB054435 [0,1,0,0,1,0|2,0,0]=4 57 B14R2.19 NC1=CN(CC2=CC=CC=C2)N=C1 SBB019593 [0,1,0,0,1,0|2,0,0]=4 58 B14R2.19 NC1=NC(NC2=CC=CC=C2)=NN1 SBB072099 [0,1,0,0,1,0|2,0,0]=4 59 B14R2.19 NC1=NC=C(CC2=CC=CC=C2)S1 SBB018009 [0,1,0,0,1,0|1,0,1]=4 60 B14R2.19 NC1=NN(CC2=CC=CC=C2)C=C1 SBB020876 [0,1,0,0,1,0|2,0,0]=4 61 B14R2.19 NC1=NN(CC2=CC=CC=C2)C=N1 SBB021816 [0,1,0,0,1,0|1,0,1]=4 62 B14R2.30 NC1=CC=NN1CC2=CC=CC=C2 SBB076420 [0,1,0,0,1,0|2,0,0]=4 63 B14R2.30 OC1=NSN=C1CC2=CC=CC=C2 SBB056170 [0,1,0,0,1,0|1,0,1]=4 64 B14R2.72 ClC1=CC=C(CC2=NNN=N2)C=C1 SBB022171 [0,1,0,0,1,0|2,0,0]=4 65 B14R2.72 NC1=CC=C(CN2C=CC=N2)C=C1 SBB009348 [0,1,0,0,1,0|2,0,0]=4 66 B14R2.72 NC1=CC=C(CN2C=NC=N2)C=C1 SBB012826 [0,1,0,0,1,0|1,0,1]=4 67 B14R2.72 OC1=CC=C(CN2C=NC=N2)C=C1 SBB051644 [0,1,0,0,1,0|1,0,1]=4 68 B14R2.716 ClC1=CC(CC2=NNN=N2)=CC=C1 SBB013380 [0,1,0,0,1,0|2,0,0]=4 69 B14R2.716 NC1=CC(CN2C=CC=N2)=CC=C1 SBB020883 [0,1,0,0,1,0|2,0,0]=4 70 B14R2.716 NC1=CC(CN2C=NC=N2)=CC=C1 SBB051792 [0,1,0,0,1,0|1,0,1]=4 71 B16R2.71 BrC1=CC=CN=C1OCC2=CC=CC=C2 SBB067331 [0,1,0,0,0,1|2,0,0]=4 72 B16R2.71 ClC1=C(CNC2=NC=CC=C2)C=CC=C1 SBB073122 [0,1,0,0,0,1|2,0,0]=4 73 B16R2.71 FC1=CC=CC=C1CNC2=NC=CC=C2 SBB073113 [0,1,0,0,0,1|2,0,0]=4 74 B16R2.71 NC1=C(CCC2=CC=CC=N2)C=CC=C1 SBB048198 [0,1,0,0,0,1|1,0,0]=3 75 B16R2.71 NC1=C(OCC2=CC=CC=N2)C=CC=C1 SBB013916 [0,1,0,0,0,1|2,0,0]=4 76 B16R2.71 NC1=C(OCC2=CN=CC=C2)C=CC=C1 SBB014250 [0,1,0,0,0,1|2,0,0]=4 77 B16R2.71 NC1=CC=CC=C1CCC2=CC=NC=C2 SBB013704 [0,1,0,0,0,1|1,0,1]=4 78 B16R2.71 NC1=NC=CC=C1OCC2=CC=CC=C2 SBB000394 [0,1,0,0,0,1|2,0,0]=4 79 B16R2.71 OC1=CC=CN=C1OCC2=CC=CC=C2 SBB067392 [0,1,0,0,0,1|2,0,0]=4 80 B16R2.88 CC(CC1=CC=CC=C1)C2=CC=CC=C2 SBB060404 [0,1,0,0,0,1|2,0,0]=4 81 B16R2.88 CC(NC1=CC=CC=C1)C2=CN=CC=C2 SBB010972 [0,1,0,0,0,1|2,0,0]=4 82 B16R2.88 CC(NC1=CC=CC=C1)C2=NC=CC=C2 SBB301387 [0,1,0,0,0,1|2,0,0]=4 83 B16R2.88 O=C(CC1=CC=NC=N1)C2=CC=CC=C2 SBB092303 [0,1,0,0,0,1|0,0,2]=4 84 B16R2.88 O=C(CC1=CN=CC=N1)C2=CC=CC=C2 SBB092299 [0,1,0,0,0,1|0,0,2]=4 85 B16R2.88 OC(CC1=NC=CN=C1)C2=CC=CC=C2 SBB092624 [0,1,0,0,0,1|0,0,1]=3 86 B16R2.132 BrC1=CN=C(OCC2=CC=CC=C2)C=C1 SBB067332 [0,1,0,0,0,1|2,0,0]=4 87 B16R2.132 CC1=CC=C(CNC2=NC=CC=C2)C=C1 SBB073075 [0,1,0,0,0,1|2,0,0]=4 88 B16R2.132 ClC1=CC=C(CNC2=NC=CC=C2)C=C1 SBB073096 [0,1,0,0,0,1|2,0,0]=4 89 B16R2.132 FC1=CC=C(CNC2=NC=CC=C2)C=C1 SBB073084 [0,1,0,0,0,1|2,0,0]=4 90 B16R2.132 FC1=CC=C(NCC2=CN=CC=C2)C=C1 SBB011032 [0,1,0,0,0,1|2,0,0]=4 91 B16R2.132 NC1=CC=C(CCC2=CC=NC=C2)C=C1 SBB008708 [0,1,0,0,0,1|1,0,1]=4 92 B16R2.132 NC1=CC=C(CCC2=NC=CC=C2)C=C1 SBB018756 [0,1,0,0,0,1|1,0,0]=3 93 B16R2.132 NC1=CC=C(OCC2=CC=CC=N2)C=C1 SBB014075 [0,1,0,0,0,1|2,0,0]=4 94 B16R2.132 NC1=CC=C(OCC2=CC=CN=C2)C=C1 SBB022462 [0,1,0,0,0,1|2,0,0]=4 95 B16R2.252 CC1=CC(NCC2=CC=CC=C2)=NC=C1 SBB051870 [0,1,0,0,0,1|2,0,0]=4 96 B16R2.252 CC1=CC=CC(NCC2=CC=CC=C2)=N1 SBB048672 [0,1,0,0,0,1|2,0,0]=4 97 B16R2.252 ClC1=CC=CC(CNC2=NC=CC=C2)=C1 SBB073081 [0,1,0,0,0,1|2,0,0]=4 98 B16R2.252 FC1=CC(CNC2=NC=CC=C2)=CC=C1 SBB073119 [0,1,0,0,0,1|2,0,0]=4 99 B16R2.252 NC1=CC(CCC2=CC=CC=N2)=CC=C1 SBB010973 [0,1,0,0,0,1|1,0,0]=3 100 B16R2.252 NC1=CC(CCC2=CC=NC=C2)=CC=C1 SBB005660 [0,1,0,0,0,1|1,0,1]=4 101 B16R2.252 O=C1C=C(OCC2=CC=CC=C2)C=CN1 SBB055552 [0,1,0,0,0,1|2,0,0]=4 102 B16R2.252 OC1=CC=NC(SCC2=CC=CC=C2)=N1 SBB081946 [0,1,0,0,0,1|2,0,0]=4 103 B16R2.135 CC1=CC=C(CNCC2=CC=CO2)C=C1 SBB007190 [0,1,0,0,0,1|2,0,0]=4 104 B16R2.135 ClC1=CC=C(CNCC2=CC=CO2)C=C1 SBB007174 [0,1,0,0,0,1|2,0,0]=4 105 B16R2.135 FC1=CC=C(CNCC2=CC=CO2)C=C1 SBB007183 [0,1,0,0,0,1|2,0,0]=4 106 B16R2.255 CC1=CC(CNCC2=CC=CO2)=CC=C1 SBB007189 [0,1,0,0,0,1|2,0,0]=4 107 B16R2.255 ClC1=CC(CNCC2=CC=CO2)=CC=C1 SBB009617 [0,1,0,0,0,1|2,0,0]=4 108 B16R2.255 FC1=CC(CNCC2=CC=CO2)=CC=C1 SBB007193 [0,1,0,0,0,1|2,0,0]=4 109 B16R2.2832 CC1=CC=C(CNCC2=CC=CC=C2)O1 SBB109881 [0,1,0,0,0,1|2,0,0]=4 110 B16R2.2959 CC1=CC=CC=C1CNCC2=CC=CO2 SBB007188 [0,1,0,0,0,1|2,0,0]=4 111 B16R2.2959 ClC1=CC=CC=C1CNCC2=CC=CO2 SBB007173 [0,1,0,0,0,1|2,0,0]=4 112 B16R2.2959 FC1=CC=CC=C1CNCC2=CC=CO2 SBB007182 [0,1,0,0,0,1|2,0,0]=4 113 B16R2.2959 NC1=CC=CC=C1OCCC2=CC=CS2 SBB024398 [0,1,0,0,0,1|2,0,0]=4 114 B16R2.2959 NC1=CC=CC=C1OCCN2C=CC=N2 SBB301892 [0,1,0,0,0,1|2,0,0]=4 115 B16R2.3250 CN1C=CC=C1CNCC2=CC=CC=C2 SBB010992 [0,1,0,0,0,1|1,0,1]=4 116 B16R2.5767 NC(CCN1C=NC=N1)C2=CC=CC=C2 SBB013881 [0,1,0,0,0,1|1,0,1]=4 117 B16R2.42 N1C=NC(SCC2=CC=C(OC)C=C2)=N1 SBB096171 [0,2,0,0,0,0|2,0,0]=4 118 B16R2.125 NC1=CC=C(C(O)CN2C=NC=N2)C=C1 SBB301980 [0,2,0,0,0,0|1,0,1]=4 119 B16R2.258 CC1=CC(CSC2=NNC(N)=N2)=CC=C1 SBB082494 [0,2,0,0,0,0|2,0,0]=4 120 B14R2.6 C1=CC=C(CC2=NC=CC=C2)C=C1 SBB058829 [0,0,1,1,0,0|1,0,1]=4 121 B16R3.335 NC1=NC2=C(CCC3=C2C=CC=C3)S1 SBB071781 [0,1,0,1,0,0|1,0,1]=4 122 B12R2.2 C1=CC=C(C2=CNC=N2)C=C1 SBB086348 [0,0,0,0,2,0|0,0,0]=2 123 B12R2.2 C1=CC=C(C2=CSN=N2)C=C1 SBB087632 [0,0,0,0,2,0|2,0,0]=4 124 B12R2.2 C1=CC=C(C2=NC=CN2)C=C1 SBB004131 [0,0,0,0,2,0|2,0,0]=4 125 B12R2.2 C1=CC=C(C2=NNC=C2)C=C1 SBB023350 [0,0,0,0,2,0|2,0,0]=4 126 B12R2.2 C1=CC=C(C2=NNC=N2)C=C1 SBB111873 [0,0,0,0,2,0|1,0,0]=3 127 B12R2.2 C1=CC=C(C2=NNN=N2)C=C1 SBB030492 [0,0,0,0,2,0|2,0,0]=4 128 B12R2.2 C1=CC=C(N2C=CC=N2)C=C1 SBB036147 [0,0,0,0,2,0|2,0,0]=4 129 B16R2.2256 C1=CC=C(CCCC2=CC=CC=C2)C=C1 SBB008143 [0,0,0,0,0,2|2,0,0]=4 130 B16R2.2256 C1=CC=C(CCNC2=CC=CC=C2)C=C1 SBB085494 [0,0,0,0,0,2|2,0,0]=4 131 B16R2.2256 C1=CC=C(CCOC2=CC=CC=C2)C=C1 SBB007896 [0,0,0,0,0,2|2,0,0]=4 132 B16R2.2256 C1=CC=C(CNCC2=CC=CC=C2)C=C1 SBB058838 [0,0,0,0,0,2|2,0,0]=4 133 B16R2.2256 C1=CC=C(CNCC2=CC=CC=N2)C=C1 SBB027764 [0,0,0,0,0,2|1,0,0]=3 134 B16R2.2256 C1=CC=C(CNCC2=CC=NC=C2)C=C1 SBB018038 [0,0,0,0,0,2|1,0,1]=4 135 B16R2.2256 C1=CC=C(CNCC2=CN=CC=C2)C=C1 SBB092338 [0,0,0,0,0,2|1,0,0]=3 136 B16R2.2256 C1=CC=C(COCC2=CC=CC=C2)C=C1 SBB060360 [0,0,0,0,0,2|2,0,0]=4 137 B16R2.2256 C1=CC=C(CSCC2=CC=CC=C2)C=C1 SBB058652 [0,0,0,0,0,2|2,0,0]=4 138 B16R2.2256 C1=CN=CC(CNCC2=CN=CC=C2)=C1 SBB014446 [0,0,0,0,0,2|2,0,0]=4 139 B16R2.2257 C1=CC=C(CCNCC2=CC=CO2)C=C1 SBB007234 [0,0,0,0,0,2|2,0,0]=4 140 B16R2.2257 C1=CC=C(CCNCC2=CC=CS2)C=C1 SBB018145 [0,0,0,0,0,2|2,0,0]=4