0 B12R2.18 CC1=C(C)C2=CC=CN=C2N1 SY029402 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.18 CC1=CC2=C(C=CC=C2)N1C SY004658 [0,0,0,0,0,0|4,0,0]=4 2 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 SY042826 [0,0,0,0,0,0|3,0,0]=3 3 B12R2.18 CN1C(=O)NC2=CC=CC=C21 SY045893 [0,0,0,0,0,0|2,0,0]=2 4 B12R2.18 CN1C(Br)=CC2=C1C=CC=C2 SY247582 [0,0,0,0,0,0|4,0,0]=4 5 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O SY016747 [0,0,0,0,0,0|3,0,1]=4 6 B12R2.18 O=C1NC2=CC=CC=C2C1=O SY005277 [0,0,0,0,0,0|2,0,1]=3 7 B12R2.18 O=C1NC2=NC=CC=C2C1=O SY107993 [0,0,0,0,0,0|1,0,1]=2 8 B12R2.18 O=C1OC2=CC=CC=C2C1=O SY023499 [0,0,0,0,0,0|3,0,1]=4 9 B11R2.1 BrC1=CNC2=C1C=CC=N2 SY003833 [1,0,0,0,0,0|2,0,0]=3 10 B11R2.1 BrC1=CNC2=NC=NC=C12 SY006993 [1,0,0,0,0,0|3,0,0]=4 11 B11R2.1 BrC1=COC2=NC=CC=C12 SY059185 [1,0,0,0,0,0|3,0,0]=4 12 B11R2.1 BrC1=NNC2=NC=CC=C12 SY008436 [1,0,0,0,0,0|3,0,0]=4 13 B11R2.1 C1=CC2=C(C=C1)C=CN2C SY246326 [1,0,0,0,0,0|3,0,0]=4 14 B11R2.1 C1=CC2=C(C=C1)N(C)C=C2 SY246277 [1,0,0,0,0,0|3,0,0]=4 15 B11R2.1 C1=CC2=C(C=CC=C2)N1C SY246324 [1,0,0,0,0,0|3,0,0]=4 16 B11R2.1 C1=CC=CC2=C1C=CN2C SY246325 [1,0,0,0,0,0|3,0,0]=4 17 B11R2.1 C1=CC=CC2=C1N(C)C=C2 SY246327 [1,0,0,0,0,0|3,0,0]=4 18 B11R2.1 CC1=CNC2=C1C=CC=N2 SY067108 [1,0,0,0,0,0|2,0,0]=3 19 B11R2.1 CN1C=NC2=CC=CC=C21 SY042696 [1,0,0,0,0,0|2,0,1]=4 20 B11R2.1 CN1CNC2=CC=CC=C21 SY289611 [1,0,0,0,0,0|2,0,1]=4 21 B11R2.1 IC1=CNC2=C1C=CC=N2 SY019306 [1,0,0,0,0,0|2,0,0]=3 22 B11R2.1 NC1=CNC2=C1C=CC=C2 SY236577 [1,0,0,0,0,0|3,0,0]=4 23 B11R2.1 NC1=CNC2=C1C=CC=N2 SY065407 [1,0,0,0,0,0|2,0,0]=3 24 B11R2.1 NC1=NNC2=C1C=CC=N2 SY007922 [1,0,0,0,0,0|3,0,0]=4 25 B11R2.1 NN1C=CC2=C1C=CC=C2 SY024456 [1,0,0,0,0,0|3,0,0]=4 26 B11R2.1 ON1N=CC2=C1C=CC=C2 SY274261 [1,0,0,0,0,0|3,0,0]=4 27 B11R2.10 BrC1=NC2=CC=CC=C2N1 SY050717 [1,0,0,0,0,0|2,0,1]=4 28 B11R2.10 CC1=NC2=CC=CC=C2N1 SY015991 [1,0,0,0,0,0|2,0,1]=4 29 B11R2.10 CC1=NC2=CC=CN=C2O1 SY018740 [1,0,0,0,0,0|2,0,1]=4 30 B11R2.10 CC1=NC2=NC=CC=C2O1 SY018743 [1,0,0,0,0,0|2,0,1]=4 31 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 SY115626 [1,0,0,0,0,0|3,0,0]=4 32 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 SY004072 [1,0,0,0,0,0|2,0,1]=4 33 B11R2.10 ClC1=NC2=CC=CN=C2O1 SY047505 [1,0,0,0,0,0|2,0,1]=4 34 B11R2.10 ClC1=NC2=NC=CC=C2O1 SY130040 [1,0,0,0,0,0|2,0,1]=4 35 B11R2.10 ClC1=NC2=NC=NC=C2N1 SY273994 [1,0,0,0,0,0|2,0,1]=4 36 B11R2.10 NC1=NC2=CC=CC=C2N1 SY032901 [1,0,0,0,0,0|2,0,1]=4 37 B11R2.10 NC1=NC2=CC=CN=C2O1 SY130073 [1,0,0,0,0,0|2,0,1]=4 38 B11R2.10 NC1=NC2=NC=CC=C2N1 SY039624 [1,0,0,0,0,0|1,0,1]=3 39 B11R2.10 NC1=NC2=NC=CC=C2O1 SY130061 [1,0,0,0,0,0|2,0,1]=4 40 B11R2.10 NC1=NC2=NC=CC=C2S1 SY103526 [1,0,0,0,0,0|2,0,1]=4 41 B11R2.10 O=C1CC2=C(C=CC=C2)C1 SY001481 [1,0,0,0,0,0|3,0,0]=4 42 B11R2.10 O=C1CC2=C(C=CC=C2)O1 SY038967 [1,0,0,0,0,0|3,0,0]=4 43 B11R2.10 O=C1CC2=CC=CC=C2N1 SY004718 [1,0,0,0,0,0|2,0,0]=3 44 B11R2.10 O=C1CC2=CC=CN=C2N1 SY008090 [1,0,0,0,0,0|1,0,0]=2 45 B11R2.10 O=C1NC2=C(C=CC=C2)O1 SY007021 [1,0,0,0,0,0|2,0,0]=3 46 B11R2.10 O=C1NC2=C(C=CN=C2)O1 SY130167 [1,0,0,0,0,0|3,0,0]=4 47 B11R2.10 O=C1NC2=C(N=CC=C2)N1 SY007153 [1,0,0,0,0,0|0,0,0]=1 48 B11R2.10 O=C1NC2=CC=CN=C2O1 SY116296 [1,0,0,0,0,0|1,0,0]=2 49 B11R2.10 O=C1NC2=NC=CC=C2O1 SY007988 [1,0,0,0,0,0|1,0,0]=2 50 B11R2.10 OC1=NC2=CC=CC=C2N1 SY033248 [1,0,0,0,0,0|1,0,2]=4 51 B11R2.10 S=C1NC2=CC=CN=C2O1 SY130024 [1,0,0,0,0,0|1,1,0]=3 52 B11R2.10 S=C1NC2=NC=CC=C2O1 SY086794 [1,0,0,0,0,0|1,1,0]=3 53 B13R2.135 O=CC1C(=O)NC2=C1C=CC=C2 SY105270 [0,1,0,0,0,0|2,0,1]=4 54 B13R2.359 CC1(C)C(=O)NC2=C1C=CC=C2 SY107503 [0,1,0,0,0,0|3,0,0]=4 55 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 SY007230 [0,1,0,0,0,0|2,0,1]=4 56 B13R2.3028 CN1C(=O)CC2=C1C=C(N)C=C2 SY097175 [0,1,0,0,0,0|3,0,0]=4 57 B13R2.3028 CN1C(=O)NC2=CC=C(Br)C=C21 SY074812 [0,1,0,0,0,0|2,0,0]=3 58 B13R2.3028 CN1C(=O)NC2=CC=C(Cl)N=C21 SY036671 [0,1,0,0,0,0|3,0,0]=4 59 B13R2.3028 CN1C(=O)NC2=CC=C(N)C=C21 SY292247 [0,1,0,0,0,0|2,0,0]=3 60 B13R2.3028 CN1C(=O)NC2=NC=C(Br)C=C21 SY295198 [0,1,0,0,0,0|1,0,0]=2 61 B13R2.3028 CN1C(=O)SC2=CC=C(N)C=C21 SY223503 [0,1,0,0,0,0|3,0,0]=4 62 B13R2.3028 O=C1NC2=C(C=C(Cl)C=C2)C1=O SY001523 [0,1,0,0,0,0|2,0,1]=4 63 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O SY001816 [0,1,0,0,0,0|2,0,1]=4 64 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 SY048456 [0,1,0,0,0,0|2,0,1]=4 65 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 SY293688 [0,1,0,0,0,0|2,0,1]=4 66 B13R2.3085 CN1C(=O)C(N)C2=C1C=CC=C2 SY059152 [0,1,0,0,0,0|3,0,0]=4 67 B13R2.3085 CN1C(=O)N(C)C2=CC=CC=C21 SY045942 [0,1,0,0,0,0|2,0,0]=3 68 B13R2.4825 CC1=CC=CC2=C1NC(=O)C2=O SY081570 [0,1,0,0,0,0|2,0,1]=4 69 B13R2.4825 CN1C(=O)CC2=C1C=CC=C2N SY263286 [0,1,0,0,0,0|3,0,0]=4 70 B13R2.4825 NC1=CC=CC2=C1NC(=O)C2=O SY058415 [0,1,0,0,0,0|2,0,1]=4 71 B13R2.4825 O=C1NC2=C(C=CC=C2Br)C1=O SY002925 [0,1,0,0,0,0|2,0,1]=4 72 B13R2.4825 O=C1NC2=C(C=CC=C2Cl)C1=O SY008499 [0,1,0,0,0,0|2,0,1]=4 73 B13R2.4825 O=C1NC2=C(C=CC=C2F)C1=O SY009282 [0,1,0,0,0,0|2,0,1]=4 74 B13R2.4825 O=C1NC2=C(C=CC=C2I)C1=O SY033891 [0,1,0,0,0,0|2,0,1]=4 75 B13R2.4825 O=C1NC2=C(C=CC=C2O)C1=O SY058417 [0,1,0,0,0,0|2,0,1]=4 76 B13R2.4856 CC1=CC=CC2=C1C(=O)C(=O)N2 SY015146 [0,1,0,0,0,0|2,0,1]=4 77 B13R2.4856 CC1C(=O)NC2=NC=NC(Cl)=C21 SY037580 [0,1,0,0,0,0|3,0,0]=4 78 B13R2.4856 CN1C(=O)NC2=NC=NC(Cl)=C21 SY036669 [0,1,0,0,0,0|2,0,0]=3 79 B13R2.4856 O=C1NC2=C(C1=O)C(Cl)=CC=C2 SY005279 [0,1,0,0,0,0|2,0,1]=4 80 B13R2.4856 O=C1NC2=C(C1=O)C(I)=CC=C2 SY033894 [0,1,0,0,0,0|2,0,1]=4 81 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O SY004146 [0,1,0,0,0,0|2,0,1]=4 82 B13R2.5190 CC1=CC=C2C(=O)C(=O)NC2=C1 SY016308 [0,1,0,0,0,0|2,0,1]=4 83 B13R2.5190 CN1C(=O)CC2=C1C=CC(N)=C2 SY006674 [0,1,0,0,0,0|3,0,0]=4 84 B13R2.5190 CN1C(=O)NC2=CC(Cl)=CN=C21 SY036673 [0,1,0,0,0,0|3,0,0]=4 85 B13R2.5190 CN1C(=O)NC2=CC(N)=CC=C21 SY292248 [0,1,0,0,0,0|2,0,0]=3 86 B13R2.5190 CN1C(=O)NC2=NC(Cl)=CC=C21 SY036666 [0,1,0,0,0,0|1,0,0]=2 87 B13R2.5190 CN1C(=O)NC2=NC(Cl)=NC=C21 SY041874 [0,1,0,0,0,0|2,0,0]=3 88 B13R2.5190 O=C1NC2=C(C=CC(Cl)=C2)C1=O SY015997 [0,1,0,0,0,0|2,0,1]=4 89 B13R2.5190 O=C1NC2=C(C=CC(F)=C2)C1=O SY009562 [0,1,0,0,0,0|2,0,1]=4 90 B13R2.5190 O=C1NC2=CC(Br)=CC=C2C1=O SY004824 [0,1,0,0,0,0|2,0,1]=4 91 B13R2.5190 O=C1NC2=CC(I)=CC=C2C1=O SY059763 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.36 CC(=O)C(O)C1=CC=CC=C1 SY028287 [0,0,1,0,0,0|3,0,0]=4 93 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 SY053096 [0,0,1,0,0,0|3,0,0]=4 94 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 SY009237 [0,0,1,0,0,0|3,0,0]=4 95 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 SY015083 [0,0,1,0,0,0|3,0,0]=4 96 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 SY184594 [0,0,1,0,0,0|3,0,0]=4 97 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 SY001670 [0,0,1,0,0,0|3,0,0]=4 98 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 SY289327 [0,0,1,0,0,0|3,0,0]=4 99 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 SY001645 [0,0,1,0,0,0|3,0,0]=4 100 B11R1.40 C=CC(=O)NC1=CC=CC=C1 SY052499 [0,0,1,0,0,0|3,0,0]=4 101 B11R1.40 COC(=O)CC1=NC=CC=C1 SY030291 [0,0,1,0,0,0|3,0,0]=4 102 B11R1.40 NNC(=O)CC1=CC=CC=C1 SY032275 [0,0,1,0,0,0|3,0,0]=4 103 B11R1.40 NNC(=O)OC1=CC=CC=C1 SY262826 [0,0,1,0,0,0|3,0,0]=4 104 B11R1.40 O=C(CCl)NC1=NC=CC=C1 SY022508 [0,0,1,0,0,0|2,0,0]=3 105 B13R2.32 OC1=C(Br)C=NC2=NC=CC=C21 SY262295 [0,0,0,0,0,1|2,0,1]=4 106 B13R2.328 O=C1C=C(Br)C2=C(N=CC=C2)N1 SY224760 [0,0,0,0,0,1|2,0,0]=3 107 B13R2.328 O=C1C=C(Cl)C2=C(N=CC=C2)N1 SY033533 [0,0,0,0,0,1|2,0,0]=3 108 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)O1 SY001614 [0,0,0,0,0,1|3,0,0]=4 109 B13R2.328 O=C1NC(=O)C2=C(C=CC=C2)N1 SY003536 [0,0,0,0,0,1|2,0,1]=4 110 B13R2.328 O=C1NC(=O)C2=C(N=CC=C2)N1 SY016113 [0,0,0,0,0,1|1,0,1]=3 111 B13R2.328 OC1=CC(O)=NC2=NC=CC=C12 SY226655 [0,0,0,0,0,1|1,0,2]=4 112 B13R2.369 NC1=CC2=C(C=CC=C2)NC1=O SY254129 [0,0,0,0,0,1|3,0,0]=4 113 B10R1.18 CC(=O)CC1=NC=CC=C1 SY002438 [1,0,1,0,0,0|2,0,0]=4 114 B10R1.18 N=C(N)NC1=CC=CC=C1 SY059286 [1,0,1,0,0,0|2,0,0]=4 115 B10R1.18 NC(=O)CC1=CC=CC=C1 SY017094 [1,0,1,0,0,0|2,0,0]=4 116 B10R1.18 NC(=O)OC1=CC=CC=C1 SY109407 [1,0,1,0,0,0|2,0,0]=4 117 B10R1.18 NC(=S)NC1=NC=CC=C1 SY050007 [1,0,1,0,0,0|0,1,0]=3 118 B10R1.18 O=C(O)CC1=CC=CN=C1 SY001707 [1,0,1,0,0,0|2,0,0]=4 119 B10R1.18 O=C(O)CC1=NC=CC=C1 SY003293 [1,0,1,0,0,0|1,0,0]=3 120 B10R1.18 O=C(O)CC1=NC=CC=N1 SY004102 [1,0,1,0,0,0|2,0,0]=4 121 B10R1.18 O=C(O)CC1=NC=CN=C1 SY034525 [1,0,1,0,0,0|2,0,0]=4 122 B10R1.17 OC\C=C\C1=NC=CC=C1 SY022169 [1,0,1,0,0,0|2,0,0]=4 123 B10R1.4 CCNC1=NC=CC=C1N SY184449 [1,0,1,0,0,0|1,0,1]=4 124 B10R1.20 CNC1=NC=CC=C1CO SY030421 [1,0,1,0,0,0|1,0,1]=4 125 B10R1.61 CC(=O)C1=CC=CN=C1N SY040774 [1,0,1,0,0,0|2,0,0]=4 126 B10R1.61 CC1=NC=CC=C1C(=O)O SY007014 [1,0,1,0,0,0|2,0,0]=4 127 B10R1.61 NC(=O)C1=C(N)N=CC=C1 SY007086 [1,0,1,0,0,0|2,0,0]=4 128 B10R1.61 NC1=C(C(=O)O)C=CC=N1 SY001124 [1,0,1,0,0,0|1,0,0]=3 129 B10R1.61 NC1=C(C(=O)O)N=CC=N1 SY005247 [1,0,1,0,0,0|2,0,0]=4 130 B10R1.61 NC1=C([N+](=O)[O-])C=CC=N1 SY013759 [1,0,1,0,0,0|0,0,2]=4 131 B10R1.61 NC1=NC=NC=C1C(=O)O SY032667 [1,0,1,0,0,0|2,0,0]=4 132 B10R1.61 NC1=NN=CC=C1C(=O)O SY005535 [1,0,1,0,0,0|2,0,0]=4 133 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 SY001758 [1,0,1,0,0,0|2,0,0]=4 134 B10R1.61 O=C(O)C1=C(F)N=CC=C1 SY004382 [1,0,1,0,0,0|2,0,0]=4 135 B10R1.61 O=C(O)C1=C(O)N=CC=C1 SY003611 [1,0,1,0,0,0|2,0,0]=4 136 B10R1.61 O=C(O)C1=C(S)N=CC=C1 SY018289 [1,0,1,0,0,0|2,0,0]=4 137 B10R1.61 O=C(O)C1=CC=CN=C1Br SY013308 [1,0,1,0,0,0|2,0,0]=4 138 B10R2.7 C1=CC2=C(C=CN2)N=C1 SY019307 [2,0,0,0,0,0|1,0,0]=3 139 B10R2.7 C1=CC2=C(C=CS2)N=C1 SY008443 [2,0,0,0,0,0|2,0,0]=4 140 B10R2.7 C1=CC2=C(N=C1)NC=C2 SY001940 [2,0,0,0,0,0|1,0,0]=3 141 B10R2.7 C1=CC2=C(N=C1)NCC2 SY005307 [2,0,0,0,0,0|1,0,1]=4 142 B10R2.7 C1=CC2=C(N=C1)NN=C2 SY005396 [2,0,0,0,0,0|2,0,0]=4 143 B10R2.7 C1=CC2=C(N=C1)SC=C2 SY009137 [2,0,0,0,0,0|2,0,0]=4 144 B10R2.7 C1=CC2=C(N=CN=C2)N1 SY022555 [2,0,0,0,0,0|2,0,0]=4 145 B10R2.7 C1=CC=C2NC=NC2=C1 SY012765 [2,0,0,0,0,0|1,0,1]=4 146 B10R2.7 C1=CN=C2C=COC2=C1 SY097654 [2,0,0,0,0,0|2,0,0]=4 147 B10R2.7 C1=CN=C2C=NNC2=C1 SY008431 [2,0,0,0,0,0|2,0,0]=4 148 B10R2.7 C1=CN=C2CCNC2=C1 SY253170 [2,0,0,0,0,0|1,0,1]=4 149 B10R2.7 C1=CN=C2N=CNC2=C1 SY027512 [2,0,0,0,0,0|0,0,1]=3 150 B10R2.7 C1=CN=C2N=COC2=C1 SY018742 [2,0,0,0,0,0|1,0,1]=4 151 B10R2.7 C1=CN=C2NC=CC2=N1 SY023099 [2,0,0,0,0,0|2,0,0]=4 152 B10R2.7 C1=CN=C2NC=NC2=N1 SY025046 [2,0,0,0,0,0|1,0,1]=4 153 B10R2.7 C1=CN=C2OC=NC2=C1 SY018739 [2,0,0,0,0,0|1,0,1]=4 154 B10R2.7 C1=NC=C2NC=NC2=N1 SY064527 [2,0,0,0,0,0|1,0,1]=4 155 B12R1.34 NNC(=O)[C@H](O)C1=CC=CC=C1 SY017161 [0,1,1,0,0,0|2,0,0]=4 156 B12R1.75 CC(=O)NC1=CC=CC=C1CO SY011672 [0,1,1,0,0,0|2,0,0]=4 157 B12R2.1 O=CC1=CNC2=C1C=CC=N2 SY018104 [1,1,0,0,0,0|1,0,1]=4 158 B12R2.1 OCC1=CNC2=C1C=CC=C2 SY015976 [1,1,0,0,0,0|2,0,0]=4 159 B12R2.132 BrC1=CC2=C(N=C1)NC=C2I SY035579 [1,1,0,0,0,0|2,0,0]=4 160 B12R2.132 BrC1=CNC2=C1C=C(I)C=N2 SY097378 [1,1,0,0,0,0|2,0,0]=4 161 B12R2.132 ClC1=CN=C2NC=C(Br)C2=C1 SY029622 [1,1,0,0,0,0|2,0,0]=4 162 B12R2.132 ClC1=CN=C2NC=C(I)C2=C1 SY096652 [1,1,0,0,0,0|2,0,0]=4 163 B12R2.132 FC1=CC2=C(N=C1)NC=C2Br SY036373 [1,1,0,0,0,0|2,0,0]=4 164 B12R2.203 BrC1=CC=NC2=C1C(Br)=CN2 SY124139 [1,1,0,0,0,0|2,0,0]=4 165 B12R2.203 CC1=CNC2=NC=CC(Br)=C12 SY097976 [1,1,0,0,0,0|2,0,0]=4 166 B12R2.203 ClC1=C2C(I)=CNC2=NC=C1 SY041330 [1,1,0,0,0,0|2,0,0]=4 167 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 SY042244 [1,1,0,0,0,0|2,0,0]=4 168 B12R2.32 O=CC1=CC2=C(N=CC=C2)N1 SY066930 [1,1,0,0,0,0|1,0,0]=3 169 B12R2.32 O=CC1=NC2=CC=CC=C2N1 SY025423 [1,1,0,0,0,0|1,0,1]=4 170 B12R2.202 BrC1=CC=NC2=C1C=C(I)N2 SY111827 [1,1,0,0,0,0|2,0,0]=4 171 B12R2.202 CC1=C2NC(=O)OC2=CC=C1 SY130158 [1,1,0,0,0,0|2,0,0]=4 172 B12R2.202 CC1=CC=CC2=C1CC(=O)N2 SY009386 [1,1,0,0,0,0|2,0,0]=4 173 B12R2.202 CC1=CC=CC2=C1NC(=O)C2 SY084752 [1,1,0,0,0,0|2,0,0]=4 174 B12R2.202 CC1=CC=NC2=C1NC(=O)N2 SY007154 [1,1,0,0,0,0|0,0,0]=2 175 B12R2.202 ClC1=C2C=C(I)NC2=NC=C1 SY097775 [1,1,0,0,0,0|2,0,0]=4 176 B12R2.202 NC1=C2NC(=O)OC2=CC=C1 SY130163 [1,1,0,0,0,0|2,0,0]=4 177 B12R2.202 NC1=C2OC(=O)NC2=CC=C1 SY055244 [1,1,0,0,0,0|2,0,0]=4 178 B12R2.202 NC1=CC=CC2=C1NC(=O)C2 SY248415 [1,1,0,0,0,0|2,0,0]=4 179 B12R2.202 O=C1CC2=C(Br)C=CN=C2N1 SY033197 [1,1,0,0,0,0|1,0,0]=3 180 B12R2.202 O=C1CC2=C(C=CC=C2Br)N1 SY003107 [1,1,0,0,0,0|2,0,0]=4 181 B12R2.202 O=C1CC2=C(C=CC=C2Cl)N1 SY009372 [1,1,0,0,0,0|2,0,0]=4 182 B12R2.202 O=C1CC2=C(C=CC=C2F)N1 SY105094 [1,1,0,0,0,0|2,0,0]=4 183 B12R2.202 O=C1CC2=C(C=CC=C2I)N1 SY224083 [1,1,0,0,0,0|2,0,0]=4 184 B12R2.202 O=C1CC2=C(C=CC=C2O)N1 SY036030 [1,1,0,0,0,0|2,0,0]=4 185 B12R2.202 O=C1CC2=C(Cl)N=CN=C2N1 SY013655 [1,1,0,0,0,0|2,0,0]=4 186 B12R2.202 O=C1CC2=C(N1)C(Br)=CC=C2 SY029304 [1,1,0,0,0,0|2,0,0]=4 187 B12R2.202 O=C1CC2=C(N1)C(F)=CC=C2 SY029301 [1,1,0,0,0,0|2,0,0]=4 188 B12R2.202 O=C1CC2=C(N=CC=C2Cl)N1 SY008984 [1,1,0,0,0,0|1,0,0]=3 189 B12R2.202 O=C1NC2=C(F)C=CC=C2O1 SY130173 [1,1,0,0,0,0|2,0,0]=4 190 B12R2.202 O=C1NC2=C(N1)C(Br)=CN=C2 SY029337 [1,1,0,0,0,0|2,0,0]=4 191 B12R2.202 O=C1NC2=CC=CC(Br)=C2O1 SY077887 [1,1,0,0,0,0|2,0,0]=4 192 B12R2.202 O=C1NC2=CC=CC(Cl)=C2O1 SY130170 [1,1,0,0,0,0|2,0,0]=4 193 B12R2.202 O=C1NC2=CC=CC(F)=C2O1 SY130165 [1,1,0,0,0,0|2,0,0]=4 194 B12R2.606 CC1=CC2=C(C=C1)CC(=O)N2 SY020777 [1,1,0,0,0,0|2,0,0]=4 195 B12R2.606 CC1=CC2=C(N=CC(Br)=C2)N1 SY041150 [1,1,0,0,0,0|2,0,0]=4 196 B12R2.606 CC1=CC=C2NC(=O)NC2=C1 SY045908 [1,1,0,0,0,0|1,0,0]=3 197 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 SY081557 [1,1,0,0,0,0|2,0,0]=4 198 B12R2.606 CC1=CC=C2NC(C)=CC2=N1 SY264678 [1,1,0,0,0,0|2,0,0]=4 199 B12R2.606 CC1=NC2=CC(N)=CN=C2N1 SY290079 [1,1,0,0,0,0|1,0,1]=4 200 B12R2.606 CC1=NC2=NC=C(Br)C=C2N1 SY042912 [1,1,0,0,0,0|1,0,1]=4 201 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 SY030708 [1,1,0,0,0,0|2,0,0]=4 202 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 SY031781 [1,1,0,0,0,0|2,0,0]=4 203 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 SY007179 [1,1,0,0,0,0|1,0,0]=3 204 B12R2.606 NC1=CC=C2NC(=O)OC2=C1 SY031786 [1,1,0,0,0,0|2,0,0]=4 205 B12R2.606 NC1=CC=C2NC(=O)SC2=C1 SY031792 [1,1,0,0,0,0|2,0,0]=4 206 B12R2.606 NC1=CC=C2OC(=O)NC2=C1 SY043261 [1,1,0,0,0,0|2,0,0]=4 207 B12R2.606 NC1=NC2=CC(Br)=CN=C2N1 SY039629 [1,1,0,0,0,0|1,0,1]=4 208 B12R2.606 NC1=NC2=CC(Br)=CN=C2N1 SY253555 [1,1,0,0,0,0|1,0,1]=4 209 B12R2.606 NC1=NC=C2SC(=O)NC2=N1 SY028954 [1,1,0,0,0,0|2,0,0]=4 210 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 SY002545 [1,1,0,0,0,0|2,0,0]=4 211 B12R2.606 O=C1CC2=C(C=C(F)C=C2)N1 SY028412 [1,1,0,0,0,0|2,0,0]=4 212 B12R2.606 O=C1CC2=C(C=C(O)C=C2)N1 SY023129 [1,1,0,0,0,0|2,0,0]=4 213 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 SY008441 [1,1,0,0,0,0|2,0,0]=4 214 B12R2.606 O=C1CC2=C(C=CC(F)=C2)N1 SY002547 [1,1,0,0,0,0|2,0,0]=4 215 B12R2.606 O=C1CC2=C(C=CC(I)=C2)N1 SY004828 [1,1,0,0,0,0|2,0,0]=4 216 B12R2.606 O=C1CC2=C(N=CC(Br)=C2)N1 SY005427 [1,1,0,0,0,0|1,0,0]=3 217 B12R2.606 O=C1CC2=CC=C(Br)C=C2N1 SY004439 [1,1,0,0,0,0|2,0,0]=4 218 B12R2.606 O=C1CC2=CC=C(Cl)N=C2N1 SY031668 [1,1,0,0,0,0|1,0,0]=3 219 B12R2.606 O=C1CC2=CN=C(Cl)N=C2N1 SY031663 [1,1,0,0,0,0|2,0,0]=4 220 B12R2.606 O=C1CC2=NC(Cl)=NC=C2N1 SY287529 [1,1,0,0,0,0|2,0,0]=4 221 B12R2.606 O=C1CC2=NC=C(Cl)C=C2N1 SY033632 [1,1,0,0,0,0|1,0,0]=3 222 B12R2.606 O=C1CC2=NC=C(Cl)N=C2N1 SY287527 [1,1,0,0,0,0|2,0,0]=4 223 B12R2.606 O=C1NC2=CC(Br)=CC=C2O1 SY038495 [1,1,0,0,0,0|2,0,0]=4 224 B12R2.606 O=C1NC2=CC(Br)=CN=C2N1 SY039604 [1,1,0,0,0,0|0,0,0]=2 225 B12R2.606 O=C1NC2=CC(Br)=CN=C2O1 SY059599 [1,1,0,0,0,0|1,0,0]=3 226 B12R2.606 O=C1NC2=CC(Cl)=CN=C2O1 SY130169 [1,1,0,0,0,0|1,0,0]=3 227 B12R2.606 O=C1NC2=CC(F)=CC=C2O1 SY101449 [1,1,0,0,0,0|2,0,0]=4 228 B12R2.606 O=C1NC2=CC(I)=CC=C2O1 SY268394 [1,1,0,0,0,0|2,0,0]=4 229 B12R2.606 O=C1NC2=CC=C(Br)C=C2N1 SY004487 [1,1,0,0,0,0|1,0,0]=3 230 B12R2.606 O=C1NC2=CC=C(Br)C=C2O1 SY038492 [1,1,0,0,0,0|2,0,0]=4 231 B12R2.606 O=C1NC2=CC=C(Br)C=C2S1 SY026443 [1,1,0,0,0,0|2,0,0]=4 232 B12R2.606 O=C1NC2=CC=C(Cl)N=C2N1 SY033540 [1,1,0,0,0,0|0,0,0]=2 233 B12R2.606 O=C1NC2=CC=C(F)C=C2N1 SY039596 [1,1,0,0,0,0|1,0,0]=3 234 B12R2.606 O=C1NC2=CC=C(O)C=C2S1 SY261696 [1,1,0,0,0,0|2,0,0]=4 235 B12R2.606 O=C1NC2=NC(Br)=CC=C2O1 SY059597 [1,1,0,0,0,0|1,0,0]=3 236 B12R2.606 O=C1NC2=NC=C(Br)C=C2O1 SY007993 [1,1,0,0,0,0|1,0,0]=3 237 B12R2.606 O=C1NC2=NC=C(Cl)C=C2O1 SY028333 [1,1,0,0,0,0|1,0,0]=3 238 B12R2.606 S=C1NC2=CC(Cl)=CN=C2O1 SY130036 [1,1,0,0,0,0|1,1,0]=4 239 B14R2.4513 CN1C(=O)COC2=NC=C(Br)C=C21 SY060524 [0,1,0,0,0,1|2,0,0]=4 240 B14R2.8188 CN1SC2=CC=CC=C2N(C)C1=O SY294330 [0,1,0,0,0,1|2,0,0]=4 241 B14R2.8235 O=C1C=C(O)C2=C(C=CC(Br)=C2)N1 SY108412 [0,1,0,0,0,1|2,0,0]=4 242 B14R2.8235 O=C1C=C(O)C2=C(C=CC(I)=C2)N1 SY020277 [0,1,0,0,0,1|2,0,0]=4 243 B14R2.639 CC1(C)OC2=CC=CN=C2NC1=O SY033899 [0,1,0,0,0,1|2,0,0]=4 244 B14R2.1128 CCN1SC2=CC=CC=C2NC1=O SY294329 [0,1,0,0,0,1|2,0,0]=4 245 B14R2.8239 NN1CC2=C(C=CC(Cl)=C2)NC1=O SY275818 [0,1,0,0,0,1|2,0,0]=4 246 B14R2.8239 NN1CC2=C(C=CC(F)=C2)NC1=O SY275976 [0,1,0,0,0,1|2,0,0]=4 247 B14R2.28472 CN1CC2=C(Cl)N=CN=C2NC1=O SY037666 [0,1,0,0,0,1|2,0,0]=4 248 B14R2.517 C#CCN1C(=O)NC2=C1C=CC=C2 SY296781 [0,2,0,0,0,0|2,0,0]=4 249 B14R2.642 C=C(C)N1C(=O)NC2=CC=CC=C21 SY037885 [0,2,0,0,0,0|2,0,0]=4 250 B14R2.4646 CC1(C)C(=O)NC2=NC(Cl)=CC=C21 SY251593 [0,2,0,0,0,0|2,0,0]=4 251 B14R2.8716 CN1C(=O)N(C)C2=CC(N)=CC=C21 SY031785 [0,2,0,0,0,0|2,0,0]=4 252 B12R2.24 O=C1C=CC2=C(N=CC=C2)N1 SY241058 [0,0,1,1,0,0|2,0,0]=4 253 B12R2.24 O=C1COC2=C(C=CC=C2)N1 SY007578 [0,0,1,1,0,0|2,0,0]=4 254 B12R2.24 O=C1COC2=C(N=CC=C2)N1 SY007983 [0,0,1,1,0,0|1,0,0]=3 255 B12R2.24 O=C1NC2=NC=CC=C2CO1 SY129220 [0,0,1,1,0,0|2,0,0]=4 256 B12R1.27 O=C(NO)OCC1=CC=CC=C1 SY024162 [0,0,1,0,0,1|2,0,0]=4