0 B8R1.7 CC(=O)C1=CSC=C1 BB57-0215 [0,0,0,0,0,0|2,0,0]=2 1 B8R1.7 CC(N)C1=CC=CO1 BB01-4826 [0,0,0,0,0,0|1,0,1]=2 2 B8R1.7 CC(N)C1=CC=CS1 BB01-4334 [0,0,0,0,0,0|1,1,1]=3 3 B8R1.7 N=C(N)N1C=CC=N1 BB20-2492 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.7 NC(=O)C1=CC=CS1 BB01-2734 [0,0,0,0,0,0|1,1,0]=2 5 B8R1.7 O=C(O)C1=CNC=N1 BB57-6654 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.7 O=C(O)C1=COC=C1 BB57-0214 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.7 O=C(O)C1=CSC=C1 BB53-1742 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.7 O=C(O)C1=CSC=N1 BB01-8351 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.7 O=C(O)C1=CSN=N1 BB58-0324 [0,0,0,0,0,0|4,0,0]=4 10 B8R1.7 O=C(O)C1=NNC=C1 BB53-1765 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.7 O=C(O)C1CC=CC1 BB01-7889 [0,0,0,0,0,0|2,0,2]=4 12 B8R1.7 O=[N+]([O-])C1=CC=CS1 BB17-0786 [0,0,0,0,0,0|2,1,0]=3 13 B8R1.7 OB(O)C1=CC=CS1 BB01-0981 [0,0,0,0,0,0|2,1,1]=4 14 B7R1.1 CCN1C=CC=N1 BB01-5044 [1,0,0,0,0,0|2,0,1]=4 15 B7R1.1 N#CC1=CC=CS1 BB01-2767 [1,0,0,0,0,0|1,1,1]=4 16 B7R1.1 NCC1=CC=CS1 BB01-5532 [1,0,0,0,0,0|1,1,1]=4 17 B7R1.1 O=CC1=CSC=C1 BB01-6172 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.11 CCC(=O)C1=CC=CS1 BB01-4952 [0,1,0,0,0,0|0,1,0]=2 19 B9R1.11 CCC(N)C1=CC=CS1 BB01-4366 [0,1,0,0,0,0|1,1,1]=4 20 B9R1.11 CNC(=O)C1=CC=CN1 BB20-0004 [0,1,0,0,0,0|1,0,0]=2 21 B9R1.11 CNC(=O)C1=NNC=C1 BB05-4951 [0,1,0,0,0,0|2,0,0]=3 22 B9R1.11 COC(=O)C1=CC=NN1 BB05-1598 [0,1,0,0,0,0|2,0,0]=3 23 B9R1.11 NNC(=O)C1=CC=CS1 BB01-3610 [0,1,0,0,0,0|1,1,0]=3 24 B9R1.11 NNC(=O)C1=CSC=C1 BB01-5015 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.11 O=C(CBr)C1=CC=CO1 BB01-4998 [0,1,0,0,0,0|0,0,0]=1 26 B9R1.11 O=C(CBr)C1=CC=CS1 BB20-0496 [0,1,0,0,0,0|0,1,0]=2 27 B9R1.19 O=S(=O)(Cl)C1=CC=CS1 BB55-0685 [0,1,0,0,0,0|2,1,0]=4 28 B9R1.35 CC(=O)C1=CC=C(Br)S1 BB01-7781 [0,1,0,0,0,0|0,1,0]=2 29 B9R1.35 CC(=O)C1=CC=C(C)O1 BB55-2250 [0,1,0,0,0,0|0,0,0]=1 30 B9R1.35 CC(=O)C1=CC=C(C)S1 BB17-2349 [0,1,0,0,0,0|0,1,0]=2 31 B9R1.35 CC(=O)C1=CC=C(Cl)S1 BB17-2354 [0,1,0,0,0,0|0,1,0]=2 32 B9R1.35 CC1=CC(C(=O)Cl)=NO1 BB55-5177 [0,1,0,0,0,0|3,0,0]=4 33 B9R1.35 CC1=CC(C(=O)O)=NN1 BB01-2577 [0,1,0,0,0,0|3,0,0]=4 34 B9R1.35 CC1=CC(C(=O)O)=NO1 BB01-4962 [0,1,0,0,0,0|3,0,0]=4 35 B9R1.35 CC1=CC(C(=O)O)=NO1 BB05-1141 [0,1,0,0,0,0|3,0,0]=4 36 B9R1.35 CC1=CC=C(B(O)O)O1 BB01-7929 [0,1,0,0,0,0|2,0,1]=4 37 B9R1.35 CC1=CC=C(C(=O)Cl)O1 BB58-1944 [0,1,0,0,0,0|1,0,0]=2 38 B9R1.35 CC1=CC=C(C(=O)Cl)S1 BB20-1586 [0,1,0,0,0,0|1,1,0]=3 39 B9R1.35 CC1=CC=C(C(=O)O)O1 BB58-0337 [0,1,0,0,0,0|1,0,0]=2 40 B9R1.35 CC1=CC=C(C(=O)O)S1 BB55-0510 [0,1,0,0,0,0|1,1,0]=3 41 B9R1.35 CC1=NNC(C(=O)O)=C1 BB01-2833 [0,1,0,0,0,0|3,0,0]=4 42 B9R1.35 CN1C=CC(C(=O)O)=N1 BB05-0012 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 BB55-5570 [0,1,0,0,0,0|1,1,0]=3 44 B9R1.35 O=C(O)C1=CC=C(Br)S1 BB55-0508 [0,1,0,0,0,0|1,1,0]=3 45 B9R1.35 O=C(O)C1=CC=C(Cl)S1 BB55-0509 [0,1,0,0,0,0|1,1,0]=3 46 B9R1.41 CC1=C(C(=O)O)C=CO1 BB57-4813 [0,1,0,0,0,0|3,0,0]=4 47 B9R1.41 CC1=C(C(=O)O)OC=N1 BB01-8336 [0,1,0,0,0,0|2,0,0]=3 48 B9R1.41 CC1=C(C(=O)O)SC=C1 BB01-0916 [0,1,0,0,0,0|1,1,0]=3 49 B9R1.41 CN1C=CC=C1C(=O)O BB01-1072 [0,1,0,0,0,0|2,0,0]=3 50 B9R1.41 CN1C=CN=C1C(=O)O BB57-7197 [0,1,0,0,0,0|3,0,0]=4 51 B9R1.41 CN1C=NC=C1C(=O)O BB55-8119 [0,1,0,0,0,0|3,0,0]=4 52 B9R1.41 CN1N=CC=C1C(=O)O BB01-4745 [0,1,0,0,0,0|3,0,0]=4 53 B9R1.41 CN1N=CC=C1C(=O)O BB05-0013 [0,1,0,0,0,0|3,0,0]=4 54 B9R1.41 NC(=O)C1=C(N)NC=N1 BB01-8343 [0,1,0,0,0,0|3,0,0]=4 55 B9R1.41 NC1=C(C(=O)[O-])SC=C1 BB58-0066 [0,1,0,0,0,0|1,1,0]=3 56 B9R1.6 CC(=O)C1=NC=CN=C1 BB01-0984 [0,0,0,0,0,1|1,0,0]=2 57 B9R1.6 CC(N)C1=CC=CC=N1 BB01-4954 [0,0,0,0,0,1|2,0,1]=4 58 B9R1.6 CC(N)C1=CC=NC=C1 BB01-4967 [0,0,0,0,0,1|2,0,1]=4 59 B9R1.6 CC(N)C1=CN=CC=C1 BB01-4888 [0,0,0,0,0,1|2,0,1]=4 60 B9R1.6 N=C(N)C1=CC=CC=C1 BB01-6195 [0,0,0,0,0,1|3,0,0]=4 61 B9R1.6 N=C(N)C1=CC=NC=C1 BB58-4248 [0,0,0,0,0,1|3,0,0]=4 62 B9R1.6 NC(=O)C1=CC=CC=C1 BB01-2129 [0,0,0,0,0,1|2,0,0]=3 63 B9R1.6 NC(=O)C1=CC=CC=N1 BB01-5863 [0,0,0,0,0,1|2,0,0]=3 64 B9R1.6 NC(=S)C1=CC=CN=C1 BB05-2712 [0,0,0,0,0,1|2,1,0]=4 65 B9R1.6 NN(C)C1=CC=CC=C1 BB01-7902 [0,0,0,0,0,1|3,0,0]=4 66 B9R1.6 O=C(O)C1=CN=CN=C1 BB01-7914 [0,0,0,0,0,1|3,0,0]=4 67 B9R1.6 O=C(O)C1=NC=CN=C1 BB01-7797 [0,0,0,0,0,1|2,0,0]=3 68 B9R1.13 O=C(O)CC1=CC=CS1 BB01-6099 [0,0,0,0,0,1|1,1,0]=3 69 B9R1.13 O=C(O)CC1=CSC=C1 BB01-0976 [0,0,0,0,0,1|3,0,0]=4 70 B9R1.13 O=C(O)CN1C=CC=N1 BB05-3145 [0,0,0,0,0,1|3,0,0]=4 71 B6R1.2 CC1=CC=NN1 BB01-4929 [2,0,0,0,0,0|2,0,0]=4 72 B6R1.2 CC1=NC=CN1 BB01-6021 [2,0,0,0,0,0|2,0,0]=4 73 B6R1.2 CN1C=CC=N1 BB01-6294 [2,0,0,0,0,0|2,0,0]=4 74 B8R1.1 CC1=CC=C(C=O)S1 BB17-2278 [1,1,0,0,0,0|0,1,0]=3 75 B8R1.1 CC1=CC=C(CN)O1 BB55-3608 [1,1,0,0,0,0|1,0,1]=4 76 B8R1.1 O=CC1=CC(Br)=CS1 BB17-2286 [1,1,0,0,0,0|0,1,0]=3 77 B8R1.1 O=CC1=CC=C(Br)O1 BB55-3487 [1,1,0,0,0,0|0,0,0]=2 78 B8R1.1 O=CC1=CC=C(Br)S1 BB01-8320 [1,1,0,0,0,0|0,1,0]=3 79 B8R1.1 O=CC1=CC=C(Cl)S1 BB17-2277 [1,1,0,0,0,0|0,1,0]=3 80 B8R1.1 O=CC1=CC=C(I)O1 BB17-1381 [1,1,0,0,0,0|0,0,0]=2 81 B8R1.8 CNCC1=CC=CO1 BB01-5301 [1,1,0,0,0,0|0,0,1]=3 82 B8R1.8 CNCC1=CC=CS1 BB55-3486 [1,1,0,0,0,0|0,1,1]=4 83 B8R1.8 NCCC1=CC=CS1 BB01-0963 [1,1,0,0,0,0|0,1,1]=4 84 B8R1.8 O\N=C\C1=CC=CS1 BB55-7187 [1,1,0,0,0,0|0,1,1]=4 85 B8R1.11 CC1=C(C=O)SC=C1 BB01-6101 [1,1,0,0,0,0|0,1,0]=3 86 B8R1.11 CC1=C(C=O)SC=N1 BB01-0956 [1,1,0,0,0,0|1,1,0]=4 87 B8R1.11 CN1C=CC=C1C=O BB17-2275 [1,1,0,0,0,0|1,0,0]=3 88 B8R1.11 CN1C=CN=C1C=O BB05-4354 [1,1,0,0,0,0|2,0,0]=4 89 B8R1.11 O=CC1=C(Cl)N=CS1 BB58-0524 [1,1,0,0,0,0|1,1,0]=4 90 B10R1.13 CC(=O)C1=CC=C(Br)C=N1 BB01-8350 [0,1,0,0,0,1|1,0,0]=3 91 B10R1.13 CC1=CC=C(C(=O)O)C=N1 BB01-0985 [0,1,0,0,0,1|2,0,0]=4 92 B10R1.13 CC1=CN=C(C(=O)O)C=N1 BB01-8333 [0,1,0,0,0,1|2,0,0]=4 93 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 BB01-2753 [0,1,0,0,0,1|2,0,0]=4 94 B10R1.13 NC(=O)C1=CC=C(Cl)N=C1 BB57-5130 [0,1,0,0,0,1|2,0,0]=4 95 B10R1.13 NC(=O)C1=CC=C(F)C=C1 BB20-1199 [0,1,0,0,0,1|2,0,0]=4 96 B10R1.13 NC1=CN=C(C(=O)O)C=C1 BB20-3104 [0,1,0,0,0,1|2,0,0]=4 97 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 BB01-6056 [0,1,0,0,0,1|2,0,0]=4 98 B10R1.13 O=C(O)C1=CN=C(O)C=C1 BB01-5933 [0,1,0,0,0,1|2,0,0]=4 99 B10R1.15 COC(=O)C1=CC=CC=N1 BB01-7838 [0,1,0,0,0,1|1,0,0]=3 100 B10R1.15 C\C(=N/O)C1=CC=NC=C1 BB05-0881 [0,1,0,0,0,1|1,0,1]=4 101 B10R1.15 NNC(=O)C1=CC=CC=N1 BB55-0722 [0,1,0,0,0,1|2,0,0]=4 102 B10R1.15 NNC(=O)C1=CC=CN=C1 BB01-6330 [0,1,0,0,0,1|2,0,0]=4 103 B10R1.15 NNC(=O)C1=CC=NC=C1 BB01-2496 [0,1,0,0,0,1|2,0,0]=4 104 B10R1.15 NNC(=O)C1=NC=CN=C1 BB01-6293 [0,1,0,0,0,1|2,0,0]=4 105 B10R1.61 CC1=CN=CC=C1C(=O)O BB58-4632 [0,1,0,0,0,1|2,0,0]=4 106 B10R1.61 NC(=O)C1=CC=CN=C1N BB20-3408 [0,1,0,0,0,1|2,0,0]=4 107 B10R1.61 NC1=CC=CN=C1C(=O)O BB01-8355 [0,1,0,0,0,1|2,0,0]=4 108 B10R1.61 NC1=NC=CC=C1C(=O)O BB17-0064 [0,1,0,0,0,1|2,0,0]=4 109 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl BB01-5906 [0,1,0,0,0,1|2,0,0]=4 110 B10R1.61 O=C(O)C1=CC=CN=C1S BB01-6184 [0,1,0,0,0,1|2,0,0]=4 111 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 BB57-1536 [0,1,0,0,0,1|2,0,0]=4 112 B10R1.113 NC(=O)C1=CC(F)=CC=C1 BB17-0563 [0,1,0,0,0,1|2,0,0]=4 113 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 BB17-0501 [0,1,0,0,0,1|2,0,0]=4 114 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 BB57-3761 [0,1,0,0,0,1|2,0,0]=4 115 B10R1.113 NC1=CC(C(=O)O)=CN=C1 BB17-0500 [0,1,0,0,0,1|2,0,0]=4 116 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=C1 BB58-1947 [0,1,0,0,0,1|2,0,0]=4 117 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 BB01-8309 [0,1,0,0,0,1|2,0,0]=4 118 B10R1.113 O=C(O)C1=CC(O)=NC=C1 BB01-7894 [0,1,0,0,0,1|2,0,0]=4 119 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 BB01-8307 [0,1,0,0,0,1|2,0,0]=4 120 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 BB57-3857 [0,1,0,0,0,1|2,0,0]=4 121 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 BB57-2098 [0,1,0,0,0,1|2,0,0]=4 122 B10R1.27 NNC(=O)CC1=CC=CS1 BB55-1939 [0,1,0,0,0,1|1,1,0]=4 123 B10R1.27 O=C(CCl)NC1=NC=CS1 BB01-5548 [0,1,0,0,0,1|1,1,0]=4 124 B10R1.11 CCCC(=O)C1=CC=CS1 BB55-2280 [0,2,0,0,0,0|0,1,0]=3 125 B10R1.11 CCOC(=O)C1=CC=CO1 BB17-0864 [0,2,0,0,0,0|0,0,0]=2 126 B10R1.11 CCOC(=O)C1=CC=NN1 BB05-1622 [0,2,0,0,0,0|2,0,0]=4 127 B10R1.14 CCC(=O)C1=CC=C(Br)S1 BB55-2283 [0,2,0,0,0,0|0,1,0]=3 128 B10R1.14 CCC(=O)C1=CC=C(Cl)S1 BB55-2282 [0,2,0,0,0,0|0,1,0]=3 129 B10R1.14 COC(=O)C1=CC=C(Br)O1 BB58-0015 [0,2,0,0,0,0|0,0,0]=2 130 B10R1.14 COC(=O)C1=CC=C(C)O1 BB58-0346 [0,2,0,0,0,0|0,0,0]=2 131 B10R1.14 COC(=O)C1=CC=C(C)S1 BB57-2096 [0,2,0,0,0,0|0,1,0]=3 132 B10R1.14 COC(=O)C1=CSC(N)=N1 BB01-7865 [0,2,0,0,0,0|2,0,0]=4 133 B10R1.14 COC(=O)C1=NOC(C)=C1 BB20-2295 [0,2,0,0,0,0|2,0,0]=4 134 B10R1.14 NNC(=O)C1=CC=C(Br)O1 BB55-1918 [0,2,0,0,0,0|1,0,0]=3 135 B10R1.14 O=C(CBr)C1=CC=C(Cl)S1 BB20-0488 [0,2,0,0,0,0|0,1,0]=3 136 B10R1.149 CC1=C(C(=O)NN)SC=C1 BB01-6383 [0,2,0,0,0,0|1,1,0]=4 137 B10R1.149 COC(=O)C1=C(N)C=CS1 BB01-7784 [0,2,0,0,0,0|0,1,0]=3 138 B10R1.149 COC(=O)C1=C(O)C=CS1 BB05-3066 [0,2,0,0,0,0|0,1,0]=3 139 B10R1.149 COC(=O)C1=CC=NN1C BB05-1631 [0,2,0,0,0,0|2,0,0]=4 140 B10R1.31 O=CC1=CC=C([N+](=O)[O-])O1 BB01-8279 [0,2,0,0,0,0|2,0,0]=4 141 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 BB05-1235 [0,2,0,0,0,0|1,1,0]=4 142 B10R1.59 CC(=O)C1=C(C)N=C(C)S1 BB58-4768 [0,2,0,0,0,0|1,1,0]=4 143 B10R1.59 CC(=O)C1=C(C)N=C(N)S1 BB58-0013 [0,2,0,0,0,0|1,1,0]=4 144 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 BB58-5434 [0,2,0,0,0,0|2,0,0]=4 145 B8R1.4 CC1=CC=CC(Br)=N1 BB01-7946 [0,0,1,1,0,0|2,0,0]=4 146 B8R1.4 CC1=CC=CC(Cl)=N1 BB57-0227 [0,0,1,1,0,0|2,0,0]=4 147 B8R1.4 CC1=CC=CC(I)=C1 BB17-2143 [0,0,1,1,0,0|2,0,0]=4 148 B8R1.4 CC1=CC=CC(N)=N1 BB01-6006 [0,0,1,1,0,0|2,0,0]=4 149 B8R1.4 C[N+]1=CC(O)=CC=C1 BB57-3006 [0,0,1,1,0,0|2,0,0]=4 150 B8R1.5 NC1=C(O)C=CC=N1 BB01-4519 [0,0,1,1,0,0|2,0,0]=4 151 B8R1.2 C=CC1=CC=NC=C1 BB01-6325 [1,0,0,0,0,1|1,0,1]=4 152 B8R1.2 C=CC1=NC=CC=C1 BB01-6206 [1,0,0,0,0,1|1,0,1]=4 153 B8R1.2 CNC1=NC=CC=N1 BB58-4634 [1,0,0,0,0,1|2,0,0]=4 154 B10R1.18 CC(=O)NC1=NC=CC=C1 BB20-1257 [0,0,0,0,0,2|1,0,0]=3 155 B10R1.18 CC(=O)OC1=CC=CN=C1 BB57-3384 [0,0,0,0,0,2|1,0,0]=3 156 B10R1.18 O=C(O)CC1=CC=CN=C1 BB01-8322 [0,0,0,0,0,2|2,0,0]=4 157 B10R1.66 CC(N)CCC1=CC=CO1 BB01-4327 [0,0,0,0,0,2|1,0,1]=4 158 B10R1.66 O=C(Cl)\C=C\C1=CC=CO1 BB55-6083 [0,0,0,0,0,2|1,0,0]=3 159 B10R1.66 O=C(Cl)\C=C\C1=CC=CS1 BB55-6084 [0,0,0,0,0,2|1,1,0]=4 160 B10R1.66 O=C(O)\C=C\C1=CC=CO1 BB55-6068 [0,0,0,0,0,2|1,0,0]=3 161 B10R1.66 O=C(O)\C=C\C1=CC=CS1 BB01-2450 [0,0,0,0,0,2|1,1,0]=4 162 B10R1.66 O=[N+]([O-])\C=C\C1=CC=CO1 BB01-5589 [0,0,0,0,0,2|2,0,0]=4