0 B14R2.101 C1=CC=C(NCC2=CC=CS2)C=C1 SBB073108 [0,0,0,0,0,0|2,0,0]=2 1 B14R2.101 C1=CC=C(NCC2=CC=CS2)N=C1 SBB073089 [0,0,0,0,0,0|3,0,0]=3 2 B14R2.101 C1=CN=C(NCC2=CC=CO2)C=C1 SBB073086 [0,0,0,0,0,0|3,0,0]=3 3 B15R2.55 CN1N=CC=C1CNC2=CC=CC=C2 SBB021585 [0,1,0,0,0,0|2,0,1]=4 4 B15R2.100 CC1=CC=C(NCC2=CC=CO2)C=C1 SBB043915 [0,1,0,0,0,0|2,0,0]=3 5 B15R2.100 CC1=CC=C(NCC2=CC=CS2)C=C1 SBB073076 [0,1,0,0,0,0|2,0,0]=3 6 B15R2.100 ClC1=CC=C(CSC2=NNC=N2)C=C1 SBB040436 [0,1,0,0,0,0|3,0,0]=4 7 B15R2.100 ClC1=CC=C(NCC2=CC=CS2)C=C1 SBB073078 [0,1,0,0,0,0|2,0,0]=3 8 B15R2.100 FC1=CC=C(NCC2=CC=CS2)C=C1 SBB073079 [0,1,0,0,0,0|2,0,0]=3 9 B15R2.100 NC1=CC=C(OCC2=CC=CO2)C=C1 SBB009582 [0,1,0,0,0,0|3,0,0]=4 10 B15R2.100 NC1=CC=C(SCC2=CC=CO2)C=C1 SBB014076 [0,1,0,0,0,0|3,0,0]=4 11 B15R2.100 OC1=CC=C(NCC2=CC=CO2)C=C1 SBB010799 [0,1,0,0,0,0|2,0,0]=3 12 B15R2.100 OC1=CC=C(NCC2=CC=CS2)C=C1 SBB011122 [0,1,0,0,0,0|2,0,0]=3 13 B15R2.283 BrC1=CC=C(CNC2=NC=CC=C2)O1 SBB077699 [0,1,0,0,0,0|3,0,0]=4 14 B15R2.283 CC1=CC=C(CNC2=NC=CC=C2)O1 SBB073083 [0,1,0,0,0,0|3,0,0]=4 15 B15R2.283 CN1C=C(CNC2=CC=CC=C2)C=N1 SBB021570 [0,1,0,0,0,0|2,0,0]=3 16 B15R2.283 CN1C=CC(CNC2=CC=CC=C2)=N1 SBB021581 [0,1,0,0,0,0|2,0,0]=3 17 B15R2.283 NC1=NC(CCC2=CC=CC=C2)=NN1 SBB083277 [0,1,0,0,0,0|2,0,0]=3 18 B15R2.283 NC1=NC(COC2=CC=CC=C2)=NN1 SBB083278 [0,1,0,0,0,0|2,0,0]=3 19 B15R2.283 NC1=NC(SCC2=CC=CC=C2)=NN1 SBB082492 [0,1,0,0,0,0|3,0,0]=4 20 B15R2.562 CC1=CC=CN=C1NCC2=CC=CS2 SBB073085 [0,1,0,0,0,0|3,0,0]=4 21 B15R2.562 ClC1=CC=CC=C1NCC2=CC=CS2 SBB073112 [0,1,0,0,0,0|2,0,0]=3 22 B15R2.562 FC1=CC=CC=C1NCC2=CC=CS2 SBB072510 [0,1,0,0,0,0|2,0,0]=3 23 B15R2.562 NC1=CC=CC=C1OCC2=CC=CO2 SBB009581 [0,1,0,0,0,0|3,0,0]=4 24 B15R2.1117 CC1=CC(CSC2=NNC=N2)=CC=C1 SBB016319 [0,1,0,0,0,0|3,0,0]=4 25 B15R2.1117 ClC1=CC=CC(NCC2=CC=CS2)=C1 SBB073087 [0,1,0,0,0,0|2,0,0]=3 26 B13R2.64 C1=CC=C(CC2=NCCN2)C=C1 SBB000360 [0,0,0,0,1,0|2,0,1]=4 27 B13R2.64 C1=CC=C(CC2=NNN=N2)C=C1 SBB087446 [0,0,0,0,1,0|2,0,0]=3 28 B13R2.64 C1=CC=C(CN2C=CN=C2)C=C1 SBB003990 [0,0,0,0,1,0|2,0,1]=4 29 B13R2.64 C1=CC=C(NC2=NC=CS2)C=C1 SBB023787 [0,0,0,0,1,0|2,0,0]=3 30 B13R2.64 C1=CC=C(NC2=NCCS2)C=C1 SBB079576 [0,0,0,0,1,0|2,0,1]=4 31 B13R2.64 C1=CC=C(OC2=CSC=C2)C=C1 SBB056213 [0,0,0,0,1,0|3,0,0]=4 32 B13R2.64 C1=CC=C(SC2=CC=CS2)C=C1 SBB056212 [0,0,0,0,1,0|3,0,0]=4 33 B13R2.64 C1=CC=C(SC2=CSC=C2)C=C1 SBB091497 [0,0,0,0,1,0|3,0,0]=4 34 B13R2.64 N1CCN=C1CC2=CC=CC=C2 SBB003964 [0,0,0,0,1,0|2,0,1]=4 35 B15R2.2195 C1=CC=C(CNC2=CC=CC=C2)C=C1 SBB058377 [0,0,0,0,0,1|2,0,0]=3 36 B15R2.2195 C1=CC=C(CNC2=CC=CC=N2)C=C1 SBB039207 [0,0,0,0,0,1|3,0,0]=4 37 B15R2.2195 C1=CC=C(COC2=CC=CC=C2)C=C1 SBB008247 [0,0,0,0,0,1|3,0,0]=4 38 B15R2.2195 C1=CC=C(NCC2=CC=CC=N2)C=C1 SBB301389 [0,0,0,0,0,1|1,0,0]=2 39 B15R2.2195 C1=CC=C(NCC2=CC=CN=C2)C=C1 SBB301390 [0,0,0,0,0,1|1,0,0]=2 40 B15R2.2195 C1=CC=C(NCC2=CC=NC=C2)C=C1 SBB301391 [0,0,0,0,0,1|1,0,1]=3 41 B15R2.2195 C1=CC=C(NNC2=CC=CC=C2)C=C1 SBB058764 [0,0,0,0,0,1|3,0,0]=4 42 B15R2.2196 C1=CC=C(CNCC2=CC=CO2)C=C1 SBB007172 [0,0,0,0,0,1|2,0,0]=3 43 B15R2.2196 C1=CC=C(CNCC2=CC=CO2)N=C1 SBB007195 [0,0,0,0,0,1|3,0,0]=4 44 B15R2.2196 C1=CN=CC(CNCC2=CC=CO2)=C1 SBB007187 [0,0,0,0,0,1|3,0,0]=4 45 B15R2.2196 C1=CN=CC(CNCC2=CC=CS2)=C1 SBB027751 [0,0,0,0,0,1|3,0,0]=4 46 B15R2.2196 C1=COC(CNCC2=CC=NC=C2)=C1 SBB007196 [0,0,0,0,0,1|3,0,0]=4 47 B12R1.27 NNC(=O)CNC1=CC=CC=C1 SBB019864 [1,0,1,0,0,0|1,0,1]=4 48 B14R2.19 BrC1=CN(CC2=CC=CC=C2)N=C1 SBB098735 [0,1,0,0,1,0|2,0,0]=4 49 B14R2.19 IC1=CN(CC2=CC=CC=C2)N=C1 SBB054435 [0,1,0,0,1,0|2,0,0]=4 50 B14R2.19 NC1=CN(CC2=CC=CC=C2)N=C1 SBB019593 [0,1,0,0,1,0|2,0,0]=4 51 B14R2.19 NC1=NC(NC2=CC=CC=C2)=NN1 SBB072099 [0,1,0,0,1,0|1,0,0]=3 52 B14R2.19 NC1=NC=C(CC2=CC=CC=C2)S1 SBB018009 [0,1,0,0,1,0|1,0,1]=4 53 B14R2.19 NC1=NN(CC2=CC=CC=C2)C=C1 SBB020876 [0,1,0,0,1,0|2,0,0]=4 54 B14R2.19 NC1=NN(CC2=CC=CC=C2)C=N1 SBB021816 [0,1,0,0,1,0|1,0,1]=4 55 B14R2.30 NC1=CC=NN1CC2=CC=CC=C2 SBB076420 [0,1,0,0,1,0|2,0,0]=4 56 B14R2.30 OC1=NSN=C1CC2=CC=CC=C2 SBB056170 [0,1,0,0,1,0|1,0,1]=4 57 B14R2.72 ClC1=CC=C(CC2=NNN=N2)C=C1 SBB022171 [0,1,0,0,1,0|2,0,0]=4 58 B14R2.72 NC1=CC=C(CN2C=CC=N2)C=C1 SBB009348 [0,1,0,0,1,0|2,0,0]=4 59 B14R2.72 NC1=CC=C(CN2C=NC=N2)C=C1 SBB012826 [0,1,0,0,1,0|1,0,1]=4 60 B14R2.72 OC1=CC=C(CN2C=NC=N2)C=C1 SBB051644 [0,1,0,0,1,0|1,0,1]=4 61 B14R2.716 ClC1=CC(CC2=NNN=N2)=CC=C1 SBB013380 [0,1,0,0,1,0|2,0,0]=4 62 B14R2.716 FC1=CC=CC(NC2=NC=CS2)=C1 SBB091750 [0,1,0,0,1,0|2,0,0]=4 63 B14R2.716 NC1=CC(CN2C=CC=N2)=CC=C1 SBB020883 [0,1,0,0,1,0|2,0,0]=4 64 B14R2.716 NC1=CC(CN2C=NC=N2)=CC=C1 SBB051792 [0,1,0,0,1,0|1,0,1]=4 65 B16R2.71 FC1=C(NCC2=CC=CC=C2)C=CC=C1 SBB072333 [0,1,0,0,0,1|2,0,0]=4 66 B16R2.71 NC1=C(CCC2=CC=CC=N2)C=CC=C1 SBB048198 [0,1,0,0,0,1|2,0,0]=4 67 B16R2.71 NC1=C(OCC2=CC=CC=N2)C=CC=C1 SBB013916 [0,1,0,0,0,1|2,0,0]=4 68 B16R2.71 NC1=C(OCC2=CN=CC=C2)C=CC=C1 SBB014250 [0,1,0,0,0,1|2,0,0]=4 69 B16R2.71 NC1=CC=CC=C1NCC2=CC=CC=C2 SBB072495 [0,1,0,0,0,1|2,0,0]=4 70 B16R2.71 OC1=C(CNC2=CC=CC=C2)C=CC=C1 SBB007834 [0,1,0,0,0,1|2,0,0]=4 71 B16R2.88 CC(NC1=CC=CC=C1)C2=CC=NC=C2 SBB301388 [0,1,0,0,0,1|1,0,1]=4 72 B16R2.88 CC(NC1=CC=CC=C1)C2=CN=CC=C2 SBB010972 [0,1,0,0,0,1|1,0,0]=3 73 B16R2.88 CC(NC1=CC=CC=C1)C2=NC=CC=C2 SBB301387 [0,1,0,0,0,1|1,0,0]=3 74 B16R2.88 CN(CC1=CC=CC=C1)C2=CC=CC=C2 SBB061254 [0,1,0,0,0,1|2,0,0]=4 75 B16R2.88 O=C(CC1=CC=NC=N1)C2=CC=CC=C2 SBB092303 [0,1,0,0,0,1|1,0,1]=4 76 B16R2.88 O=C(CC1=CN=CC=N1)C2=CC=CC=C2 SBB092299 [0,1,0,0,0,1|1,0,1]=4 77 B16R2.88 O=C(NC1=CC=CC=C1)C2=CN=CC=C2 SBB056971 [0,1,0,0,0,1|1,0,1]=4 78 B16R2.88 OC(CC1=NC=CN=C1)C2=CC=CC=C2 SBB092624 [0,1,0,0,0,1|1,0,1]=4 79 B16R2.88 [NH3+]N(CC1=CC=CC=C1)C2=CC=CC=C2 SBB057083 [0,1,0,0,0,1|2,0,0]=4 80 B16R2.132 ClC1=CC=C(NCC2=CC=CC=C2)C=C1 SBB062909 [0,1,0,0,0,1|2,0,0]=4 81 B16R2.132 FC1=CC=C(NCC2=CC=NC=C2)C=C1 SBB018049 [0,1,0,0,0,1|1,0,1]=4 82 B16R2.132 FC1=CC=C(NCC2=CN=CC=C2)C=C1 SBB011032 [0,1,0,0,0,1|1,0,0]=3 83 B16R2.132 NC1=CC=C(CCC2=NC=CC=C2)C=C1 SBB018756 [0,1,0,0,0,1|2,0,0]=4 84 B16R2.132 NC1=CC=C(OCC2=CC=CC=N2)C=C1 SBB014075 [0,1,0,0,0,1|2,0,0]=4 85 B16R2.132 NC1=CC=C(OCC2=CC=CN=C2)C=C1 SBB022462 [0,1,0,0,0,1|2,0,0]=4 86 B16R2.252 NC1=CC(CCC2=CC=CC=N2)=CC=C1 SBB010973 [0,1,0,0,0,1|2,0,0]=4 87 B16R2.135 CC1=CC=C(CNCC2=CC=CO2)C=C1 SBB007190 [0,1,0,0,0,1|2,0,0]=4 88 B16R2.135 ClC1=CC=C(CNCC2=CC=CO2)C=C1 SBB007174 [0,1,0,0,0,1|2,0,0]=4 89 B16R2.135 FC1=CC=C(CNCC2=CC=CO2)C=C1 SBB007183 [0,1,0,0,0,1|2,0,0]=4 90 B16R2.255 CC1=CC(CNCC2=CC=CO2)=CC=C1 SBB007189 [0,1,0,0,0,1|2,0,0]=4 91 B16R2.255 ClC1=CC(CNCC2=CC=CO2)=CC=C1 SBB009617 [0,1,0,0,0,1|2,0,0]=4 92 B16R2.255 FC1=CC(CNCC2=CC=CO2)=CC=C1 SBB007193 [0,1,0,0,0,1|2,0,0]=4 93 B16R2.2832 CC1=CC=C(CNCC2=CC=CC=C2)O1 SBB109881 [0,1,0,0,0,1|2,0,0]=4 94 B16R2.2959 CC1=CC=CC=C1CNCC2=CC=CO2 SBB007188 [0,1,0,0,0,1|2,0,0]=4 95 B16R2.2959 ClC1=CC=CC=C1CNCC2=CC=CO2 SBB007173 [0,1,0,0,0,1|2,0,0]=4 96 B16R2.2959 FC1=CC=CC=C1CNCC2=CC=CO2 SBB007182 [0,1,0,0,0,1|2,0,0]=4 97 B16R2.3250 CN1C=CC=C1CNCC2=CC=CC=C2 SBB010992 [0,1,0,0,0,1|1,0,1]=4 98 B16R2.42 COC1=CC=C(NCC2=CC=CO2)C=C1 SBB011053 [0,2,0,0,0,0|2,0,0]=4 99 B16R2.42 COC1=CC=C(NCC2=CC=CS2)C=C1 SBB073077 [0,2,0,0,0,0|2,0,0]=4 100 B16R2.42 COC1=CC=C(NCC2=CSC=C2)C=C1 SBB011427 [0,2,0,0,0,0|2,0,0]=4 101 B16R2.137 CN1C=C(CNC2=CC=C(F)C=C2)C=N1 SBB021572 [0,2,0,0,0,0|2,0,0]=4 102 B16R2.1063 CC1=CC=C(NCC2=CC=CO2)C=C1C SBB073110 [0,2,0,0,0,0|2,0,0]=4 103 B16R2.1063 CC1=CC=C(NCC2=CC=CS2)C=C1C SBB076144 [0,2,0,0,0,0|2,0,0]=4 104 B16R2.1063 FC1=CC=C(NCC2=CC=CS2)C=C1Cl SBB303378 [0,2,0,0,0,0|2,0,0]=4 105 B16R2.11414 CN1C=C(CNC2=CC=CC=C2O)C=N1 SBB023944 [0,2,0,0,0,0|2,0,0]=4 106 B16R2.12623 ClC1=CC(NCC2=CC=CS2)=C(Cl)C=C1 SBB073105 [0,2,0,0,0,0|2,0,0]=4 107 B16R2.1973 COC1=CC(NCC2=CC=CS2)=CC=C1 SBB073103 [0,2,0,0,0,0|2,0,0]=4 108 B16R3.5925 C1=CC=C2NC(C3=CSC=N3)=NC2=C1 SBB007366 [0,1,0,1,0,0|1,0,1]=4 109 B12R2.2 C1=CC=C(C2=CNC=N2)C=C1 SBB086348 [0,0,0,0,2,0|0,0,0]=2 110 B12R2.2 C1=CC=C(C2=CSN=N2)C=C1 SBB087632 [0,0,0,0,2,0|2,0,0]=4 111 B12R2.2 C1=CC=C(C2=NC=CN2)C=C1 SBB004131 [0,0,0,0,2,0|2,0,0]=4 112 B12R2.2 C1=CC=C(C2=NNC=C2)C=C1 SBB023350 [0,0,0,0,2,0|2,0,0]=4 113 B12R2.2 C1=CC=C(C2=NNC=N2)C=C1 SBB111873 [0,0,0,0,2,0|1,0,0]=3 114 B12R2.2 C1=CC=C(C2=NNN=N2)C=C1 SBB030492 [0,0,0,0,2,0|2,0,0]=4 115 B12R2.2 C1=CC=C(N2C=CC=N2)C=C1 SBB036147 [0,0,0,0,2,0|2,0,0]=4 116 B16R2.2256 C1=CC=C(CCNC2=CC=CC=C2)C=C1 SBB085494 [0,0,0,0,0,2|2,0,0]=4 117 B16R2.2256 C1=CC=C(CNCC2=CC=CC=C2)C=C1 SBB058838 [0,0,0,0,0,2|2,0,0]=4 118 B16R2.2256 C1=CC=C(CNCC2=CC=CC=N2)C=C1 SBB027764 [0,0,0,0,0,2|1,0,0]=3 119 B16R2.2256 C1=CC=C(CNCC2=CC=NC=C2)C=C1 SBB018038 [0,0,0,0,0,2|1,0,1]=4 120 B16R2.2256 C1=CC=C(CNCC2=CN=CC=C2)C=C1 SBB092338 [0,0,0,0,0,2|1,0,0]=3 121 B16R2.2256 C1=CN=CC(CNCC2=CN=CC=C2)=C1 SBB014446 [0,0,0,0,0,2|2,0,0]=4 122 B16R2.2257 C1=CC=C(CCNCC2=CC=CO2)C=C1 SBB007234 [0,0,0,0,0,2|2,0,0]=4 123 B16R2.2257 C1=CC=C(CCNCC2=CC=CS2)C=C1 SBB018145 [0,0,0,0,0,2|2,0,0]=4