0 B12R1.252 CC(=O)NCCC1=CC=CC=C1 SBB058213 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.252 CC(=O)\C=N\NC1=CC=CC=C1 SBB056716 [0,0,0,0,0,0|4,0,0]=4 2 B12R1.252 N=C(N)NCCC1=CC=CC=C1 SBB102430 [0,0,0,0,0,0|1,0,1]=2 3 B12R1.252 NC(=O)CCCC1=CC=CC=C1 SBB051450 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.252 NC(=O)N\N=C\C1=CC=CC=C1 SBB087692 [0,0,0,0,0,0|1,0,0]=1 5 B12R1.252 NC(=S)NCCC1=CC=CC=C1 SBB017394 [0,0,0,0,0,0|2,0,1]=3 6 B12R1.252 NC(=S)N\N=C\C1=CC=CC=C1 SBB041165 [0,0,0,0,0,0|1,0,0]=1 7 B12R1.252 NC(=S)N\N=C\C1=CC=CN=C1 SBB000221 [0,0,0,0,0,0|2,0,0]=2 8 B12R1.252 N\C(S)=N\N=C/C1=CC=CC=N1 SBB015422 [0,0,0,0,0,0|2,0,1]=3 9 B13R1.45 C\C(=N/NC(N)=S)C1=CC=CC=C1 SBB113194 [0,1,0,0,0,0|1,0,0]=2 10 B13R1.45 C\C(=N\NC(N)=O)C1=CC=CC=C1 SBB023883 [0,1,0,0,0,0|1,0,0]=2 11 B13R1.45 NC(=S)NNC(=O)C1=CC=CC=C1 SBB111868 [0,1,0,0,0,0|1,0,1]=3 12 B13R1.149 NC(=S)N\N=C\C1=CC(Cl)=CC=C1 SBB113141 [0,1,0,0,0,0|1,0,0]=2 13 B13R1.149 NC(=S)N\N=C\C1=CC=CC(O)=C1 SBB028671 [0,1,0,0,0,0|1,0,0]=2 14 B13R1.158 CC1=CC=CC=C1\C=N\NC(N)=S SBB000317 [0,1,0,0,0,0|1,0,0]=2 15 B13R1.158 N=C(N)N\N=C\C1=C(O)C=CC=C1 SBB112746 [0,1,0,0,0,0|0,0,0]=1 16 B13R1.158 NC(=O)N\N=C\C1=C(O)C=CC=C1 SBB112643 [0,1,0,0,0,0|1,0,0]=2 17 B13R1.158 NC(=S)N\N=C\C1=C(O)C=CC=C1 SBB112849 [0,1,0,0,0,0|1,0,0]=2 18 B13R1.158 NC(=S)N\N=C\C1=CC=CC=C1Cl SBB000540 [0,1,0,0,0,0|1,0,0]=2 19 B13R1.348 NC(=O)NC(=O)CC1=CC=CC=C1 SBB057962 [0,1,0,0,0,0|2,0,1]=4 20 B13R1.513 CC1=CC=C(\C=N/NC(N)=O)C=C1 SBB112667 [0,1,0,0,0,0|1,0,0]=2 21 B13R1.513 CC1=CC=C(\C=N\NC(N)=S)C=C1 SBB000316 [0,1,0,0,0,0|1,0,0]=2 22 B13R1.513 N=C(N)N\N=C/C1=CC=C(F)C=C1 SBB112778 [0,1,0,0,0,0|0,0,0]=1 23 B13R1.513 N=C(N)N\N=C\C1=CC=C(Cl)C=C1 SBB092067 [0,1,0,0,0,0|0,0,0]=1 24 B13R1.513 NC(=O)N\N=C/C1=CC=C(Br)C=C1 SBB112662 [0,1,0,0,0,0|1,0,0]=2 25 B13R1.513 NC(=O)N\N=C/C1=CC=C(F)C=C1 SBB112663 [0,1,0,0,0,0|1,0,0]=2 26 B13R1.513 NC(=O)N\N=C\C1=CC=C(Cl)C=C1 SBB028658 [0,1,0,0,0,0|1,0,0]=2 27 B13R1.513 NC(=O)N\N=C\C1=CC=C(O)C=C1 SBB028744 [0,1,0,0,0,0|1,0,0]=2 28 B13R1.513 NC(=S)N\N=C/C1=CC=C(Br)C=C1 SBB112859 [0,1,0,0,0,0|1,0,0]=2 29 B13R1.513 NC(=S)N\N=C/C1=CC=C(F)C=C1 SBB112860 [0,1,0,0,0,0|1,0,0]=2 30 B13R1.513 NC(=S)N\N=C\C1=CC=C(Cl)C=C1 SBB000539 [0,1,0,0,0,0|1,0,0]=2 31 B13R1.513 NC(=S)N\N=C\C1=CC=C(O)C=C1 SBB000343 [0,1,0,0,0,0|1,0,0]=2 32 B13R1.718 CSC(=S)N\N=C\C1=CC=CC=C1 SBB057463 [0,1,0,0,0,0|2,0,0]=3 33 B13R1.718 NNC(=S)NCCC1=CC=CC=C1 SBB017740 [0,1,0,0,0,0|2,0,1]=4 34 B13R2.10 BrC1=NC(C2=CC=CC=C2)=CS1 SBB077209 [0,0,0,1,0,0|3,0,0]=4 35 B13R2.10 CC1=CN=C(C2=CC=CC=C2)N1 SBB003991 [0,0,0,1,0,0|2,0,0]=3 36 B13R2.10 CC1=NC(C2=CC=CC=C2)=CS1 SBB089080 [0,0,0,1,0,0|3,0,0]=4 37 B13R2.10 CC1=NC(C2=CC=CC=C2)=NO1 SBB087440 [0,0,0,1,0,0|2,0,0]=3 38 B13R2.10 CC1=NC(C2=CC=NC=C2)=NN1 SBB074361 [0,0,0,1,0,0|2,0,0]=3 39 B13R2.10 CC1=NOC(C2=CC=CC=C2)=N1 SBB087430 [0,0,0,1,0,0|2,0,1]=4 40 B13R2.10 ClC1=NC(C2=CC=CC=C2)=CS1 SBB077197 [0,0,0,1,0,0|3,0,0]=4 41 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 SBB016538 [0,0,0,1,0,0|2,0,0]=3 42 B13R2.10 NC1=NC(C2=CC=CC=C2)=CN1 SBB019172 [0,0,0,1,0,0|1,0,0]=2 43 B13R2.10 NC1=NC(C2=CC=CC=C2)=CS1 SBB003778 [0,0,0,1,0,0|2,0,0]=3 44 B13R2.10 NC1=NC(C2=CC=CC=C2)=NN1 SBB082826 [0,0,0,1,0,0|0,0,0]=1 45 B13R2.10 NC1=NC(C2=CC=CC=C2)=NS1 SBB005511 [0,0,0,1,0,0|1,0,0]=2 46 B13R2.10 NC1=NC(C2=CC=CC=N2)=CS1 SBB010613 [0,0,0,1,0,0|3,0,0]=4 47 B13R2.10 NC1=NC(C2=CC=CN=C2)=NN1 SBB002715 [0,0,0,1,0,0|1,0,0]=2 48 B13R2.10 NC1=NC(C2=CC=NC=C2)=CS1 SBB014558 [0,0,0,1,0,0|3,0,0]=4 49 B13R2.10 NC1=NC(C2=CC=NC=C2)=NN1 SBB013482 [0,0,0,1,0,0|1,0,0]=2 50 B13R2.10 NC1=NC(C2=CN=CC=C2)=CS1 SBB010098 [0,0,0,1,0,0|3,0,0]=4 51 B13R2.10 NC1=NN(C2=CC=CC=C2)CC1 SBB009983 [0,0,0,1,0,0|3,0,0]=4 52 B13R2.10 NC1=NN=C(C2=CC=CC=C2)O1 SBB000136 [0,0,0,1,0,0|1,0,1]=3 53 B13R2.10 NC1=NN=C(C2=CC=CC=C2)S1 SBB000199 [0,0,0,1,0,0|1,0,1]=3 54 B13R2.10 NC1=NN=C(C2=CC=CC=C2)S1 SBB005556 [0,0,0,1,0,0|1,0,1]=3 55 B13R2.10 NC1=NN=C(C2=CC=CN=C2)O1 SBB059529 [0,0,0,1,0,0|2,0,1]=4 56 B13R2.10 NC1=NN=C(C2=CC=NC=C2)O1 SBB111672 [0,0,0,1,0,0|2,0,1]=4 57 B13R2.10 NC1=NN=C(C2=CC=NC=C2)S1 SBB005512 [0,0,0,1,0,0|2,0,1]=4 58 B13R2.10 NC1=NN=C(C2=CC=NC=C2)S1 SBB006963 [0,0,0,1,0,0|2,0,1]=4 59 B13R2.10 NC1=NN=C(C2=CN=CC=C2)S1 SBB007060 [0,0,0,1,0,0|2,0,1]=4 60 B13R2.10 NC1=NN=C(C2=NC=CC=C2)O1 SBB005501 [0,0,0,1,0,0|2,0,1]=4 61 B13R2.10 NC1=NNC(C2=CC=CC=C2)=C1 SBB005555 [0,0,0,1,0,0|1,0,2]=4 62 B13R2.10 O=C1C=C(C2=CC=CC=C2)NN1 SBB023369 [0,0,0,1,0,0|2,0,1]=4 63 B13R2.10 O=C1CC(C2=CC=CC=C2)=NN1 SBB073209 [0,0,0,1,0,0|2,0,0]=3 64 B13R2.10 O=C1CN=C(C2=CC=CC=C2)O1 SBB068903 [0,0,0,1,0,0|3,0,0]=4 65 B13R2.10 O=C1NC(C2=CC=CC=C2)=NO1 SBB019418 [0,0,0,1,0,0|2,0,0]=3 66 B13R2.10 O=C1NC=C(C2=CC=CC=C2)N1 SBB072941 [0,0,0,1,0,0|2,0,0]=3 67 B13R2.10 OC1=CC(C2=CC=CC=C2)=NN1 SBB009415 [0,0,0,1,0,0|2,0,0]=3 68 B13R2.10 OC1=CC(C2=CC=CC=C2)=NO1 SBB023422 [0,0,0,1,0,0|3,0,0]=4 69 B13R2.10 OC1=NC(C2=CC=CC=C2)=CS1 SBB089280 [0,0,0,1,0,0|3,0,0]=4 70 B13R2.10 S=C1NN=C(C2=CC=CC=C2)O1 SBB043053 [0,0,0,1,0,0|2,0,0]=3 71 B13R2.10 S=C1NN=C(C2=CC=CN=C2)O1 SBB062591 [0,0,0,1,0,0|3,0,0]=4 72 B13R2.10 SC1=NC(C2=CC=CC=C2)=CS1 SBB008121 [0,0,0,1,0,0|3,0,0]=4 73 B13R2.10 SC1=NC(C2=CC=CN=C2)=NN1 SBB038871 [0,0,0,1,0,0|2,0,0]=3 74 B13R2.10 SC1=NC=C(C2=CC=CC=C2)N1 SBB072199 [0,0,0,1,0,0|2,0,1]=4 75 B13R2.10 SC1=NN=C(C2=CC=CC=C2)O1 SBB047469 [0,0,0,1,0,0|2,0,1]=4 76 B13R2.10 SC1=NN=C(C2=CC=NC=C2)N1 SBB039537 [0,0,0,1,0,0|2,0,1]=4 77 B13R2.10 SC1=NNC(C2=CC=CC=C2)=N1 SBB012376 [0,0,0,1,0,0|1,0,2]=4 78 B13R2.72 CC(=O)N1C=CC2=C1C=CC=C2 SBB071433 [0,0,0,1,0,0|3,0,0]=4 79 B11R1.91 CC(=O)NNC1=CC=CC=C1 SBB058004 [0,0,0,0,1,0|2,0,1]=4 80 B11R1.91 N=C(N)CSC1=CC=CC=C1 SBB055427 [0,0,0,0,1,0|2,0,0]=3 81 B11R1.91 NC(=O)CCC1=CC=CC=C1 SBB058119 [0,0,0,0,1,0|2,0,1]=4 82 B11R1.91 NC(=O)COC1=CC=CC=C1 SBB028296 [0,0,0,0,1,0|3,0,0]=4 83 B11R1.91 NC(=O)NCC1=CC=CC=C1 SBB058548 [0,0,0,0,1,0|1,0,1]=3 84 B11R1.91 NC(=O)OCC1=CC=CC=C1 SBB058407 [0,0,0,0,1,0|2,0,1]=4 85 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 SBB004096 [0,0,0,0,1,0|2,0,0]=3 86 B11R1.91 NC(=S)COC1=CC=CC=C1 SBB016514 [0,0,0,0,1,0|3,0,0]=4 87 B11R1.91 NC(=S)NCC1=CC=CC=C1 SBB088032 [0,0,0,0,1,0|1,0,1]=3 88 B11R1.91 NC(N)=NCC1=CC=CC=C1 SBB055108 [0,0,0,0,1,0|0,0,2]=3 89 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 SBB040621 [0,0,0,0,1,0|3,0,0]=4 90 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 SBB028745 [0,0,0,0,1,0|3,0,0]=4 91 B11R1.172 N=C(N)N\N=C/C1=CC=CS1 SBB112764 [0,0,0,0,1,0|1,0,0]=2 92 B11R1.172 NC(=O)N\N=C/C1=CC=CS1 SBB112655 [0,0,0,0,1,0|2,0,0]=3 93 B11R1.172 NC(=S)N\N=C\C1=CC=CO1 SBB028754 [0,0,0,0,1,0|2,0,0]=3 94 B11R1.172 NC(=S)N\N=C\C1=CC=CS1 SBB041169 [0,0,0,0,1,0|2,0,0]=3 95 B10R1.17 C(=O)NNC1=CC=CC=C1 SBB008261 [2,0,0,0,0,0|1,0,1]=4 96 B10R1.17 O=C\C=C\C1=CC=CC=C1 SBB028652 [2,0,0,0,0,0|2,0,0]=4 97 B12R1.21 CC1=CC=C(CNC(N)=S)C=C1 SBB017712 [0,1,0,0,1,0|1,0,1]=4 98 B12R1.21 CC1=CC=C(\C=C\C(N)=O)C=C1 SBB113392 [0,1,0,0,1,0|2,0,0]=4 99 B12R1.21 N=C(N)COC1=CC=C(Cl)C=C1 SBB055295 [0,1,0,0,1,0|2,0,0]=4 100 B12R1.21 NC(=O)NCC1=CC=C(F)C=C1 SBB088171 [0,1,0,0,1,0|1,0,1]=4 101 B12R1.21 NC(=O)NNC1=CC=C(F)C=C1 SBB058365 [0,1,0,0,1,0|1,0,1]=4 102 B12R1.21 NC(=O)\C=C\C1=CC=C(Cl)C=C1 SBB008061 [0,1,0,0,1,0|2,0,0]=4 103 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 SBB051565 [0,1,0,0,1,0|0,0,1]=3 104 B12R1.107 NC(=O)CC(=O)C1=CC=CC=C1 SBB035909 [0,1,0,0,1,0|2,0,0]=4 105 B12R1.107 NC(=O)NC(=O)C1=CC=CC=C1 SBB057900 [0,1,0,0,1,0|1,0,0]=3 106 B12R1.107 NC(=S)NC(=O)C1=CC=CC=C1 SBB058924 [0,1,0,0,1,0|1,0,0]=3 107 B12R1.125 N=C(N)COC1=CC=CC=C1Cl SBB055296 [0,1,0,0,1,0|2,0,0]=4 108 B12R1.226 NC(=O)NNC1=CC(F)=CC=C1 SBB088267 [0,1,0,0,1,0|1,0,1]=4 109 B12R1.54 C\C(=N/NC(N)=S)C1=CC=CO1 SBB000239 [0,1,0,0,1,0|2,0,0]=4 110 B12R1.54 C\C(=N/NC(N)=S)C1=CC=CS1 SBB000390 [0,1,0,0,1,0|2,0,0]=4 111 B12R1.105 CC1=CC=C(\C=N/NC(N)=S)O1 SBB112876 [0,1,0,0,1,0|2,0,0]=4 112 B12R1.105 CC1=CC=C(\C=N\NC(N)=O)O1 SBB080710 [0,1,0,0,1,0|2,0,0]=4 113 B12R1.105 CC1=CC=C(\C=N\NC(N)=S)S1 SBB113198 [0,1,0,0,1,0|2,0,0]=4 114 B12R1.105 NC(=S)N\N=C\C1=CC=C(Br)S1 SBB113178 [0,1,0,0,1,0|2,0,0]=4 115 B12R1.130 CN1C=CC=C1\C=N\NC(N)=O SBB088005 [0,1,0,0,1,0|2,0,0]=4 116 B14R1.149 C\C(=N/NC(N)=S)C1=CC(N)=CC=C1 SBB113114 [0,2,0,0,0,0|1,0,0]=3 117 B14R1.160 C\C(=N/NC(N)=S)C1=CC=CC=C1O SBB000487 [0,2,0,0,0,0|1,0,0]=3 118 B14R1.163 CSC(=S)N\N=C(/C)C1=CC=CC=C1 SBB057459 [0,2,0,0,0,0|2,0,0]=4 119 B14R1.163 N(C(=O)C1=CC=CC=C1)NC(=S)NC SBB094212 [0,2,0,0,0,0|1,0,1]=4 120 B14R1.678 CC1=CC=C(\C(C)=N\NC(N)=S)C=C1 SBB041166 [0,2,0,0,0,0|1,0,0]=3 121 B14R1.678 C\C(=N/NC(N)=S)C1=CC=C(Br)C=C1 SBB001069 [0,2,0,0,0,0|1,0,0]=3 122 B14R1.678 C\C(=N/NC(N)=S)C1=CC=C(Cl)C=C1 SBB003302 [0,2,0,0,0,0|1,0,0]=3 123 B14R1.678 C\C(=N/NC(N)=S)C1=CC=C(F)C=C1 SBB000513 [0,2,0,0,0,0|1,0,0]=3 124 B14R1.678 C\C(=N/NC(N)=S)C1=CC=C(O)C=C1 SBB113231 [0,2,0,0,0,0|1,0,0]=3 125 B14R1.678 NC(=S)NNC(=O)C1=CC=C(Cl)C=C1 SBB097511 [0,2,0,0,0,0|1,0,1]=4 126 B14R1.76 COC1=CC(\C=N\NC(N)=O)=CC=C1 SBB028661 [0,2,0,0,0,0|1,0,0]=3 127 B14R1.76 COC1=CC(\C=N\NC(N)=S)=CC=C1 SBB000488 [0,2,0,0,0,0|1,0,0]=3 128 B14R1.154 NC(=S)N\N=C\C1=CC=CC(Cl)=C1Cl SBB111952 [0,2,0,0,0,0|1,0,0]=3 129 B14R1.687 NC(=S)N\N=C\C1=CC(I)=C(O)C=C1 SBB001318 [0,2,0,0,0,0|1,0,0]=3 130 B14R1.5978 N=C(N)NC(=N)NC1=CC=CC(Cl)=C1 SBB100366 [0,2,0,0,0,0|2,0,0]=4 131 B14R1.6072 NC(=O)N\N=C/C1=C(O)C=CC(Br)=C1 SBB112632 [0,2,0,0,0,0|1,0,0]=3 132 B14R1.6072 NC(=S)N\N=C/C1=C(O)C=CC(Br)=C1 SBB112842 [0,2,0,0,0,0|1,0,0]=3 133 B14R1.96 COC1=CC=CC=C1\C=N\NC(N)=O SBB029655 [0,2,0,0,0,0|1,0,0]=3 134 B14R1.96 COC1=CC=CC=C1\C=N\NC(N)=S SBB000486 [0,2,0,0,0,0|1,0,0]=3 135 B14R1.337 CC1=C(NC(=N)NC(=N)N)C=CC=C1 SBB097214 [0,2,0,0,0,0|2,0,0]=4 136 B14R1.337 N=C(N)NC(=N)NC1=CC=CC=C1Cl SBB100365 [0,2,0,0,0,0|2,0,0]=4 137 B14R1.4464 NC(=O)N\N=C\C1=CC=C(Cl)C=C1Cl SBB028654 [0,2,0,0,0,0|1,0,0]=3 138 B14R1.4464 NC(=S)N\N=C\C1=CC=C(Cl)C=C1Cl SBB028655 [0,2,0,0,0,0|1,0,0]=3 139 B14R1.4464 NC(=S)N\N=C\C1=CC=C(O)C=C1O SBB000512 [0,2,0,0,0,0|1,0,0]=3 140 B14R1.4920 NC(=S)N\N=C\C1=C(Cl)C=CC=C1Cl SBB113188 [0,2,0,0,0,0|1,0,0]=3 141 B14R1.698 CC1=CC=C(NC(=N)NC(=N)N)C=C1 SBB097215 [0,2,0,0,0,0|2,0,0]=4 142 B14R1.698 N=C(N)NC(=N)NC1=CC=C(Cl)C=C1 SBB100367 [0,2,0,0,0,0|2,0,0]=4 143 B14R1.698 N=C(N)NC(=N)NC1=CC=C(F)C=C1 SBB097824 [0,2,0,0,0,0|2,0,0]=4 144 B14R1.756 NC(=N/O)\C(N)=N\NC1=CC=CC=C1 SBB056849 [0,2,0,0,0,0|2,0,0]=4 145 B14R1.4 CCC1=CC=C(\C=N\NC(N)=S)C=C1 SBB000468 [0,2,0,0,0,0|1,0,0]=3 146 B14R1.4 COC1=CC=C(\C=N/NC(=N)N)C=C1 SBB112748 [0,2,0,0,0,0|0,0,0]=2 147 B14R1.4 COC1=CC=C(\C=N/NC(N)=O)C=C1 SBB112644 [0,2,0,0,0,0|1,0,0]=3 148 B14R1.4 COC1=CC=C(\C=N\NC(N)=S)C=C1 SBB040073 [0,2,0,0,0,0|1,0,0]=3 149 B14R1.4 CSC1=CC=C(\C=N/NC(N)=S)C=C1 SBB112844 [0,2,0,0,0,0|1,0,0]=3 150 B14R1.13 CN\C(S)=N\N=C/C1=CC=C(Br)C=C1 SBB015405 [0,2,0,0,0,0|1,0,1]=4 151 B12R2.1 O=CN1N=NC2=CC=CC=C21 SBB069477 [1,0,0,1,0,0|2,0,0]=4 152 B12R2.2 C1=CC(C2=NC=CN2)=CN=C1 SBB019239 [1,0,0,1,0,0|2,0,0]=4 153 B12R2.2 C1=CC(C2=NNC=C2)=CC=N1 SBB027184 [1,0,0,1,0,0|2,0,0]=4 154 B12R2.2 C1=CC(C2=NNN=N2)=CC=N1 SBB013467 [1,0,0,1,0,0|2,0,0]=4 155 B12R2.2 C1=CC=C(C2=CNC=N2)C=C1 SBB086348 [1,0,0,1,0,0|1,0,0]=3 156 B12R2.2 C1=CC=C(C2=NC=CN2)C=C1 SBB004131 [1,0,0,1,0,0|1,0,0]=3 157 B12R2.2 C1=CC=C(C2=NCCN2)C=C1 SBB056523 [1,0,0,1,0,0|1,0,1]=4 158 B12R2.2 C1=CC=C(C2=NNC=C2)C=C1 SBB023350 [1,0,0,1,0,0|1,0,0]=3 159 B12R2.2 C1=CC=C(C2=NNC=N2)C=C1 SBB111873 [1,0,0,1,0,0|0,0,0]=2 160 B12R2.2 C1=CC=C(C2=NNN=N2)C=C1 SBB030492 [1,0,0,1,0,0|1,0,0]=3 161 B12R2.2 C1=CN=C(C2=NNC=C2)C=C1 SBB083357 [1,0,0,1,0,0|2,0,0]=4 162 B12R2.2 C1=CN=C(C2=NNN=N2)C=C1 SBB013379 [1,0,0,1,0,0|2,0,0]=4 163 B12R2.2 C1=CN=CC(C2=NNN=N2)=C1 SBB013381 [1,0,0,1,0,0|2,0,0]=4 164 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 SBB054598 [1,0,0,1,0,0|2,0,0]=4 165 B12R2.1081 ClC1=NN=CC2=CC=CC=C21 SBB038718 [1,0,0,1,0,0|1,0,1]=4 166 B12R2.1081 NC1=C2C=CC=CC2=CC=C1 SBB040451 [1,0,0,1,0,0|2,0,0]=4 167 B12R2.1081 NC1=CN=CC2=CC=CC=C12 SBB051995 [1,0,0,1,0,0|1,0,0]=3 168 B12R2.1081 NC1=NC=CC2=C1C=CC=C2 SBB004129 [1,0,0,1,0,0|1,0,1]=4 169 B12R2.1081 O=C1NN=CC2=CC=CC=C12 SBB080598 [1,0,0,1,0,0|1,0,0]=3 170 B12R2.1081 O=C1NN=NC2=C1C=CC=C2 SBB078073 [1,0,0,1,0,0|2,0,0]=4 171 B12R2.1081 S=C1NN=CC2=CC=CC=C12 SBB043889 [1,0,0,1,0,0|1,0,0]=3 172 B12R2.1081 SC1=C2C=CC=CC2=CN=N1 SBB038539 [1,0,0,1,0,0|1,0,1]=4 173 B12R2.24 BrC1=CC=C2C=CC=CC2=N1 SBB093967 [0,0,0,1,1,0|2,0,0]=4 174 B12R2.24 BrC1=NC=C2C=CC=CC2=C1 SBB093966 [0,0,0,1,1,0|2,0,0]=4 175 B12R2.24 CC1=NC2=C(C=CC=C2)C=C1 SBB008939 [0,0,0,1,1,0|2,0,0]=4 176 B12R2.24 ClC1=CC=C2C=CC=CC2=N1 SBB056975 [0,0,0,1,1,0|2,0,0]=4 177 B12R2.24 ClC1=NC2=CC=CC=C2N=C1 SBB054606 [0,0,0,1,1,0|2,0,0]=4 178 B12R2.24 NC1=CC2=C(C=CC=C2)N=C1 SBB004125 [0,0,0,1,1,0|2,0,0]=4 179 B12R2.24 NC1=CC2=C(C=CC=C2)N=C1 SBB004128 [0,0,0,1,1,0|2,0,0]=4 180 B12R2.24 NC1=CC2=CC=CC=C2C=N1 SBB051996 [0,0,0,1,1,0|1,0,0]=3 181 B12R2.24 NC1=CC=C2C=CC=CC2=C1 SBB057506 [0,0,0,1,1,0|2,0,0]=4 182 B12R2.24 NC1=NC2=C(C=C1)N=CC=C2 SBB086414 [0,0,0,1,1,0|2,0,0]=4 183 B12R2.24 NC1=NC2=CC=CC=C2C=C1 SBB051994 [0,0,0,1,1,0|1,0,0]=3 184 B12R2.24 NC1=NC2=NC=CC=C2C=C1 SBB081929 [0,0,0,1,1,0|2,0,0]=4 185 B12R2.24 O=C1C=CC2=CC=CC=C2N1 SBB004119 [0,0,0,1,1,0|2,0,0]=4 186 B12R2.24 OC1=NC2=CC=CC=C2N=C1 SBB056025 [0,0,0,1,1,0|2,0,0]=4 187 B12R2.24 SC1=CN=C2C=CC=CC2=N1 SBB059750 [0,0,0,1,1,0|2,0,0]=4 188 B12R2.6 NC1=CC(C2=CC=CO2)=NN1 SBB005496 [0,0,0,1,1,0|2,0,0]=4 189 B12R2.6 NC1=CC(C2=CC=CS2)=NN1 SBB005504 [0,0,0,1,1,0|2,0,0]=4 190 B12R2.6 NC1=NC(C2=CC=CO2)=NN1 SBB083279 [0,0,0,1,1,0|1,0,0]=3 191 B12R2.6 NC1=NC(C2=CSC=C2)=NS1 SBB073194 [0,0,0,1,1,0|2,0,0]=4 192 B14R2.19 N1C(N)=NN=C1CC2=CC=CC=C2 SBB059508 [0,0,0,1,0,1|0,0,2]=4 193 B14R2.19 NC1=NC(NC2=CC=CC=C2)=NN1 SBB072099 [0,0,0,1,0,1|0,0,0]=2 194 B14R2.19 NC1=NC(SC2=CC=CC=C2)=NS1 SBB073158 [0,0,0,1,0,1|1,0,0]=3 195 B14R2.19 NC1=NN=C(CC2=CC=CC=C2)O1 SBB059513 [0,0,0,1,0,1|1,0,1]=4 196 B14R2.19 NC1=NN=C(CC2=CC=CC=C2)S1 SBB049877 [0,0,0,1,0,1|1,0,1]=4 197 B14R2.19 SC1=NN=C(CC2=CC=CC=C2)N1 SBB040434 [0,0,0,1,0,1|1,0,1]=4 198 B14R2.21 NC1=NC(C2=CC=CC=C2)=CC=N1 SBB082802 [0,0,0,1,0,1|1,0,1]=4 199 B14R2.21 SC1=NC(C2=CC=CC=C2)=NC=N1 SBB056176 [0,0,0,1,0,1|1,0,1]=4 200 B14R2.21 SC1=NN=CC(C2=CC=CC=C2)=N1 SBB059747 [0,0,0,1,0,1|1,0,1]=4 201 B14R2.68 NC1=NN=C(C2=CC=CC=C2)CS1 SBB080862 [0,1,0,1,0,0|1,0,1]=4 202 B14R2.68 O=C1CCC(C2=CC=CC=C2)=NN1 SBB003803 [0,1,0,1,0,0|2,0,0]=4 203 B14R2.22 CC1=CC(C2=NC(N)=NO2)=CC=C1 SBB076114 [0,1,0,1,0,0|1,0,1]=4 204 B14R2.22 CC1=CC=CC(C2=NN=C(N)O2)=C1 SBB051582 [0,1,0,1,0,0|1,0,1]=4 205 B14R2.22 CC1=CC=CC(C2=NNC(N)=C2)=C1 SBB027651 [0,1,0,1,0,0|1,0,0]=3 206 B14R2.22 CC1=CC=CC(C2=NNC(S)=N2)=C1 SBB038867 [0,1,0,1,0,0|1,0,0]=3 207 B14R2.22 CC1=CC=CC(C2=NOC(N)=C2)=C1 SBB048000 [0,1,0,1,0,0|2,0,0]=4 208 B14R2.22 NC1=CC(C2=CC(Cl)=CC=C2)=NN1 SBB018024 [0,1,0,1,0,0|1,0,0]=3 209 B14R2.22 NC1=NC(C2=CC(Cl)=CC=C2)=CS1 SBB094415 [0,1,0,1,0,0|2,0,0]=4 210 B14R2.22 NC1=NC(C2=CC(Cl)=CC=C2)=NN1 SBB019270 [0,1,0,1,0,0|0,0,0]=2 211 B14R2.22 NC1=NC(C2=CC(F)=CC=C2)=CS1 SBB091752 [0,1,0,1,0,0|2,0,0]=4 212 B14R2.22 NC1=NC(C2=CC(F)=CC=C2)=NN1 SBB051551 [0,1,0,1,0,0|0,0,0]=2 213 B14R2.22 NC1=NC(C2=CC(O)=CC=C2)=CS1 SBB010872 [0,1,0,1,0,0|2,0,0]=4 214 B14R2.22 NC1=NC(C2=CC=CC(Br)=C2)=CS1 SBB019526 [0,1,0,1,0,0|2,0,0]=4 215 B14R2.22 NC1=NC(C2=CC=CC(O)=C2)=NS1 SBB073176 [0,1,0,1,0,0|1,0,0]=3 216 B14R2.22 NC1=NN=C(C2=CC=CC(F)=C2)O1 SBB046615 [0,1,0,1,0,0|1,0,1]=4 217 B14R2.22 NC1=NN=C(C2=CC=CC(O)=C2)S1 SBB073186 [0,1,0,1,0,0|1,0,1]=4 218 B14R2.22 NC1=NOC(C2=CC=CC(Cl)=C2)=N1 SBB076729 [0,1,0,1,0,0|1,0,1]=4 219 B14R2.22 S=C1NN=C(C2=CC(Cl)=CC=C2)O1 SBB062610 [0,1,0,1,0,0|2,0,0]=4 220 B14R2.256 CC1=C(C2=NC(N)=NO2)C=CC=C1 SBB076115 [0,1,0,1,0,0|1,0,1]=4 221 B14R2.256 CC1=CC=CC=C1C2=NNC(N)=C2 SBB017974 [0,1,0,1,0,0|1,0,0]=3 222 B14R2.256 CC1=CC=CC=C1C2=NNC(N)=N2 SBB083026 [0,1,0,1,0,0|0,0,0]=2 223 B14R2.256 NC1=CC(C2=CC=CC=C2Cl)=NN1 SBB018025 [0,1,0,1,0,0|1,0,0]=3 224 B14R2.256 NC1=CC(C2=CC=CC=C2F)=NN1 SBB017980 [0,1,0,1,0,0|1,0,0]=3 225 B14R2.256 NC1=CC(C2=CC=CC=C2F)=NO1 SBB025110 [0,1,0,1,0,0|2,0,0]=4 226 B14R2.256 NC1=NC(C2=C(N)C=CC=C2)=NN1 SBB014287 [0,1,0,1,0,0|0,0,0]=2 227 B14R2.256 NC1=NC(C2=C(O)C=CC=C2)=CS1 SBB018016 [0,1,0,1,0,0|2,0,0]=4 228 B14R2.256 NC1=NC(C2=CC=CC=C2Br)=NN1 SBB012797 [0,1,0,1,0,0|0,0,0]=2 229 B14R2.256 NC1=NC(C2=CC=CC=C2Cl)=CS1 SBB019525 [0,1,0,1,0,0|2,0,0]=4 230 B14R2.256 NC1=NC(C2=CC=CC=C2F)=CS1 SBB014844 [0,1,0,1,0,0|2,0,0]=4 231 B14R2.256 NC1=NC(C2=CC=CC=C2I)=NN1 SBB012796 [0,1,0,1,0,0|0,0,0]=2 232 B14R2.256 NC1=NN=C(C2=C(F)C=CC=C2)S1 SBB010926 [0,1,0,1,0,0|1,0,1]=4 233 B14R2.256 NC1=NN=C(C2=CC=CC=C2Br)O1 SBB014813 [0,1,0,1,0,0|1,0,1]=4 234 B14R2.256 NC1=NN=C(C2=CC=CC=C2Cl)S1 SBB073184 [0,1,0,1,0,0|1,0,1]=4 235 B14R2.256 NC1=NN=C(C2=CC=CC=C2F)O1 SBB046600 [0,1,0,1,0,0|1,0,1]=4 236 B14R2.256 O=C1CC(C2=CC=CC=C2Cl)=NN1 SBB083123 [0,1,0,1,0,0|2,0,0]=4 237 B14R2.256 OC1=C(C2=NN=C(S)N2)C=CC=C1 SBB007265 [0,1,0,1,0,0|1,0,1]=4 238 B14R2.256 OC1=C(C2=NNC(=S)O2)C=CC=C1 SBB043057 [0,1,0,1,0,0|2,0,0]=4 239 B14R2.768 N=C(/N)NC1=NC2=C(C=CC=C2)N1 SBB003790 [0,1,0,1,0,0|2,0,0]=4 240 B14R2.768 N=C(N)NC1=NC2=C(C=CC=C2)S1 SBB041951 [0,1,0,1,0,0|2,0,0]=4 241 B14R2.768 N=C(N)NC1=NC2=CC=CC=C2O1 SBB040066 [0,1,0,1,0,0|2,0,0]=4 242 B14R2.598 CC1=C(C2=CC=CC=C2)N=C(N)S1 SBB009161 [0,1,0,1,0,0|2,0,0]=4 243 B14R2.598 NC1=NN(C2=CC=CC=C2)C(=S)N1 SBB001484 [0,1,0,1,0,0|2,0,0]=4 244 B14R2.260 CN1N=C(C2=CC=CC=C2)C=C1N SBB005507 [0,1,0,1,0,0|1,0,0]=3 245 B14R2.20 CC1=CC=C(C2=CSC(N)=N2)C=C1 SBB000288 [0,1,0,1,0,0|2,0,0]=4 246 B14R2.20 CC1=CC=C(C2=NN=C(N)O2)C=C1 SBB048204 [0,1,0,1,0,0|1,0,1]=4 247 B14R2.20 CC1=CC=C(C2=NN=C(N)S2)C=C1 SBB004448 [0,1,0,1,0,0|1,0,1]=4 248 B14R2.20 CC1=CC=C(C2=NN=C(S)N2)C=C1 SBB000300 [0,1,0,1,0,0|1,0,1]=4 249 B14R2.20 CC1=CC=C(C2=NNC(=S)O2)C=C1 SBB062598 [0,1,0,1,0,0|2,0,0]=4 250 B14R2.20 CC1=CC=C(C2=NNC(N)=C2)C=C1 SBB017973 [0,1,0,1,0,0|1,0,0]=3 251 B14R2.20 CC1=CC=C(C2=NNC(N)=N2)C=C1 SBB083027 [0,1,0,1,0,0|0,0,0]=2 252 B14R2.20 CC1=CC=C(C2=NOC(N)=C2)C=C1 SBB025111 [0,1,0,1,0,0|2,0,0]=4 253 B14R2.20 CC1=CC=C(C2=NSC(N)=N2)C=C1 SBB076369 [0,1,0,1,0,0|1,0,0]=3 254 B14R2.20 CC1=NC(C2=CC=C(Br)C=C2)=NO1 SBB099046 [0,1,0,1,0,0|2,0,0]=4 255 B14R2.20 N1N=C(C2=CC=C(Br)C=C2)C=C1C SBB098737 [0,1,0,1,0,0|2,0,0]=4 256 B14R2.20 N1N=C(C2=CC=C(Br)C=C2)C=C1N SBB098891 [0,1,0,1,0,0|1,0,0]=3 257 B14R2.20 NC1=CC(C2=CC=C(Br)C=C2)=NO1 SBB016621 [0,1,0,1,0,0|2,0,0]=4 258 B14R2.20 NC1=CC(C2=CC=C(Cl)C=C2)=NN1 SBB091643 [0,1,0,1,0,0|1,0,0]=3 259 B14R2.20 NC1=CC(C2=CC=C(Cl)C=C2)=NO1 SBB016692 [0,1,0,1,0,0|2,0,0]=4 260 B14R2.20 NC1=CC(C2=CC=C(F)C=C2)=NN1 SBB009542 [0,1,0,1,0,0|1,0,0]=3 261 B14R2.20 NC1=CC(C2=CC=C(F)C=C2)=NO1 SBB022240 [0,1,0,1,0,0|2,0,0]=4 262 B14R2.20 NC1=CC=C(C2=CSC(N)=N2)C=C1 SBB076651 [0,1,0,1,0,0|2,0,0]=4 263 B14R2.20 NC1=NC(C2=CC=C(Br)C=C2)=CN1 SBB019255 [0,1,0,1,0,0|1,0,0]=3 264 B14R2.20 NC1=NC(C2=CC=C(Br)C=C2)=CS1 SBB000941 [0,1,0,1,0,0|2,0,0]=4 265 B14R2.20 NC1=NC(C2=CC=C(Br)C=C2)=CS1 SBB006972 [0,1,0,1,0,0|2,0,0]=4 266 B14R2.20 NC1=NC(C2=CC=C(Br)C=C2)=CS1 SBB015220 [0,1,0,1,0,0|2,0,0]=4 267 B14R2.20 NC1=NC(C2=CC=C(Cl)C=C2)=CS1 SBB000503 [0,1,0,1,0,0|2,0,0]=4 268 B14R2.20 NC1=NC(C2=CC=C(Cl)C=C2)=CS1 SBB112052 [0,1,0,1,0,0|2,0,0]=4 269 B14R2.20 NC1=NC(C2=CC=C(Cl)C=C2)=NN1 SBB013659 [0,1,0,1,0,0|0,0,0]=2 270 B14R2.20 NC1=NC(C2=CC=C(F)C=C2)=CS1 SBB006979 [0,1,0,1,0,0|2,0,0]=4 271 B14R2.20 NC1=NC(C2=CC=C(F)C=C2)=NN1 SBB014288 [0,1,0,1,0,0|0,0,0]=2 272 B14R2.20 NC1=NC(C2=CC=C(F)C=C2)=NS1 SBB073155 [0,1,0,1,0,0|1,0,0]=3 273 B14R2.20 NC1=NC(C2=CC=C(O)C=C2)=CS1 SBB018017 [0,1,0,1,0,0|2,0,0]=4 274 B14R2.20 NC1=NC(C2=CC=C(O)C=C2)=NN1 SBB115971 [0,1,0,1,0,0|0,0,0]=2 275 B14R2.20 NC1=NC(C2=CC=C(O)C=C2)=NS1 SBB079010 [0,1,0,1,0,0|1,0,0]=3 276 B14R2.20 NC1=NN=C(C2=CC=C(Br)C=C2)S1 SBB004449 [0,1,0,1,0,0|1,0,1]=4 277 B14R2.20 NC1=NN=C(C2=CC=C(Cl)C=C2)O1 SBB048203 [0,1,0,1,0,0|1,0,1]=4 278 B14R2.20 NC1=NN=C(C2=CC=C(Cl)C=C2)S1 SBB000521 [0,1,0,1,0,0|1,0,1]=4 279 B14R2.20 NC1=NN=C(C2=CC=C(Cl)C=C2)S1 SBB006962 [0,1,0,1,0,0|1,0,1]=4 280 B14R2.20 NC1=NN=C(C2=CC=C(F)C=C2)O1 SBB046626 [0,1,0,1,0,0|1,0,1]=4 281 B14R2.20 NC1=NN=C(C2=CC=C(F)C=C2)S1 SBB004447 [0,1,0,1,0,0|1,0,1]=4 282 B14R2.20 NC1=NN=C(C2=CC=C(F)C=C2)S1 SBB006964 [0,1,0,1,0,0|1,0,1]=4 283 B14R2.20 NC1=NOC(C2=CC=C(F)C=C2)=N1 SBB076730 [0,1,0,1,0,0|1,0,1]=4 284 B14R2.20 O=C1CC(C2=CC=C(Cl)C=C2)=NN1 SBB083122 [0,1,0,1,0,0|2,0,0]=4 285 B14R2.20 OC1=CC=C(C2=NN=C(S)N2)C=C1 SBB000313 [0,1,0,1,0,0|1,0,1]=4 286 B14R2.20 S=C1NN=C(C2=CC=C(Br)C=C2)N1 SBB076256 [0,1,0,1,0,0|1,0,0]=3 287 B14R2.20 S=C1NN=C(C2=CC=C(Cl)C=C2)N1 SBB003428 [0,1,0,1,0,0|1,0,0]=3 288 B14R2.20 SC1=NN=C(C2=CC=C(Cl)C=C2)N1 SBB000522 [0,1,0,1,0,0|1,0,1]=4 289 B14R2.8 ClCC1=NC(C2=CC=CC=C2)=NO1 SBB078726 [0,1,0,1,0,0|2,0,0]=4 290 B14R2.8 NCC1=CC(C2=CC=CC=C2)=NO1 SBB014517 [0,1,0,1,0,0|2,0,0]=4 291 B14R2.8 NCC1=NC(C2=CC=CC=C2)=CS1 SBB111168 [0,1,0,1,0,0|2,0,0]=4 292 B14R2.8 NCC1=NC(C2=CC=CC=C2)=NO1 SBB012995 [0,1,0,1,0,0|1,0,0]=3 293 B14R2.8 NCC1=NC(C2=CC=CC=C2)=NO1 SBB094545 [0,1,0,1,0,0|1,0,0]=3 294 B14R2.8 NCC1=NN(C2=CC=CC=C2)N=C1 SBB046513 [0,1,0,1,0,0|2,0,0]=4 295 B14R2.8 NCC1=NN=C(C2=CC=CC=C2)O1 SBB014585 [0,1,0,1,0,0|1,0,1]=4 296 B14R2.8 NCC1=NOC(C2=CC=CC=C2)=N1 SBB018729 [0,1,0,1,0,0|1,0,1]=4 297 B14R2.8 NNC1=NC(C2=CC=CC=C2)=CS1 SBB017484 [0,1,0,1,0,0|2,0,0]=4 298 B14R2.8 NNC1=NC(C2=CC=CC=C2)=NO1 SBB022259 [0,1,0,1,0,0|1,0,0]=3 299 B14R2.8 O=CC1=CC(C2=CC=CC=C2)=NN1 SBB073655 [0,1,0,1,0,0|2,0,0]=4 300 B14R2.4514 CC1=C(N)NN=C1C2=CC=CC=C2 SBB028071 [0,1,0,1,0,0|1,0,0]=3 301 B14R2.4514 CN1C(=S)NN=C1C2=CC=CC=C2 SBB043254 [0,1,0,1,0,0|1,0,0]=3 302 B14R2.4514 CN1C(=S)NN=C1C2=CC=NC=C2 SBB043271 [0,1,0,1,0,0|2,0,0]=4 303 B14R2.4514 CN1C(S)=NN=C1C2=CC=CC=C2 SBB006407 [0,1,0,1,0,0|1,0,1]=4 304 B14R2.4514 NN1C(S)=NN=C1C2=CC=CC=C2 SBB040760 [0,1,0,1,0,0|1,0,1]=4 305 B10R1.18 CC(=O)NC1=CC=CC=C1 SBB040833 [0,0,0,0,2,0|2,0,0]=4 306 B10R1.18 CC(=S)NC1=CC=CC=C1 SBB086797 [0,0,0,0,2,0|2,0,0]=4 307 B10R1.18 N=C(N)CC1=CC=CC=N1 SBB019209 [0,0,0,0,2,0|1,0,1]=4 308 B10R1.18 N=C(N)CC1=CC=CN=C1 SBB019447 [0,0,0,0,2,0|1,0,1]=4 309 B10R1.18 NC(=O)CC1=CC=CC=C1 SBB017634 [0,0,0,0,2,0|1,0,1]=4 310 B10R1.18 NC(=O)NC1=CC=CC=C1 SBB058197 [0,0,0,0,2,0|1,0,0]=3 311 B10R1.18 NC(=S)CC1=CC=CC=C1 SBB016517 [0,0,0,0,2,0|1,0,1]=4 312 B10R1.18 NC(=S)NC1=CC=CC=C1 SBB036022 [0,0,0,0,2,0|1,0,0]=3 313 B10R1.18 NC(=S)NC1=CC=NC=C1 SBB028308 [0,0,0,0,2,0|2,0,0]=4 314 B10R1.18 NC(=S)NC1=CN=CC=C1 SBB028309 [0,0,0,0,2,0|2,0,0]=4 315 B10R1.18 NC(=S)NC1=NC=CC=C1 SBB017620 [0,0,0,0,2,0|2,0,0]=4 316 B10R1.18 NC(N)=NC1=CC=CC=C1 SBB055106 [0,0,0,0,2,0|0,0,1]=3 317 B14R1.422 NC(=O)N\N=C\C=C\C1=CC=CC=C1 SBB028653 [0,0,0,0,0,2|1,0,0]=3 318 B14R1.422 NC(=S)N\N=C\C=C\C1=CC=CC=C1 SBB055236 [0,0,0,0,0,2|1,0,0]=3