0 B9R1.35 CC(=O)C1=CC=C(Br)O1 BB32-1375 [0,0,0,0,0,0|1,2,0]=3 1 B9R1.35 CC(=O)C1=CN=C(C)S1 BB32-2648 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.35 CC(=O)C1=CNC(C)=C1 BB32-3505 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.35 CC(=O)C1=CSC(Br)=C1 BB32-3092 [0,0,0,0,0,0|3,1,0]=4 4 B9R1.35 CC(=O)C1=NC(Br)=CS1 BB31-4111 [0,0,0,0,0,0|3,1,0]=4 5 B9R1.35 CC1=CC=C([N+](=O)[O-])O1 BB17-0710 [0,0,0,0,0,0|2,1,1]=4 6 B9R1.35 CC1=CNC(C(=O)O)=C1 BB31-4952 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.35 CC1=NC(C(=O)O)=CO1 BB52-2189 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.35 CC1=NC(C(=O)O)=NO1 BB31-5081 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.35 CC1=NC(C(N)=O)=CS1 BB32-1502 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.35 CC1=NC=C(C(=O)O)O1 BB31-2190 [0,0,0,0,0,0|2,1,0]=3 11 B9R1.35 NC(=O)C1=CC=C(Cl)S1 BB31-7647 [0,0,0,0,0,0|1,0,0]=1 12 B9R1.35 NC(=O)C1=COC(Cl)=N1 BB31-0325 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.35 NC(=O)C1=CSC(Br)=C1 BB31-4076 [0,0,0,0,0,0|3,1,0]=4 14 B9R1.35 NC(=O)C1=NC=C(Br)N1 BB31-3598 [0,0,0,0,0,0|3,1,0]=4 15 B9R1.35 O=C(O)C1=CC(Br)=CN1 BB52-8147 [0,0,0,0,0,0|2,1,0]=3 16 B9R1.35 O=C(O)C1=CC(O)=NO1 BB52-3965 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.35 O=C(O)C1=CC=C(F)S1 BB31-4908 [0,0,0,0,0,0|0,1,0]=1 18 B9R1.35 O=C(O)C1=CN=C(Cl)O1 BB31-2956 [0,0,0,0,0,0|1,1,0]=2 19 B9R1.35 O=C(O)C1=COC(Br)=N1 BB31-0470 [0,0,0,0,0,0|2,1,0]=3 20 B9R1.35 O=C(O)C1=NC=C(Br)N1 BB31-1468 [0,0,0,0,0,0|2,1,0]=3 21 B9R1.35 O=C1C=C(C(=O)O)NN1 BB52-5683 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.35 O=[N+]([O-])C1=CC=C(Br)O1 BB31-5669 [0,0,0,0,0,0|1,2,1]=4 23 B8R1.1 C#CC1=CC=C(Br)S1 BB31-8445 [1,0,0,0,0,0|1,1,1]=4 24 B8R1.1 C#CC1=CC=C(C)S1 BB31-6813 [1,0,0,0,0,0|2,0,1]=4 25 B8R1.1 C(=O)C1=CC=C(F)S1 BB05-4502 [1,0,0,0,0,0|0,1,0]=2 26 B8R1.1 CC1=NC(C=O)=CO1 BB52-2373 [1,0,0,0,0,0|3,0,0]=4 27 B8R1.1 CC1=NC=C(CO)S1 BB32-2642 [1,0,0,0,0,0|2,0,1]=4 28 B8R1.1 CC1=NN=C(C=O)S1 BB32-3387 [1,0,0,0,0,0|3,0,0]=4 29 B8R1.1 CN1C=CC(C=O)=C1 BB32-1972 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.1 N#CC1=CC=C(N)S1 BB32-2606 [1,0,0,0,0,0|2,0,1]=4 31 B8R1.1 NC1=NC(C=O)=CS1 BB31-7181 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.1 O=CC1=CC(Cl)=CS1 BB32-3153 [1,0,0,0,0,0|2,0,0]=3 33 B8R1.1 O=CC1=CC=C(Br)N1 BB31-7304 [1,0,0,0,0,0|1,1,0]=3 34 B8R1.1 O=CC1=NC=C(Cl)S1 BB31-4728 [1,0,0,0,0,0|1,0,0]=2 35 B8R1.1 OCC1=CC=C(F)S1 BB05-4736 [1,0,0,0,0,0|0,1,1]=3 36 B8R1.7 CC(=O)C1=CC=NO1 BB31-6420 [1,0,0,0,0,0|2,1,0]=4 37 B8R1.7 CC(=O)C1=CN=CO1 BB31-9843 [1,0,0,0,0,0|2,1,0]=4 38 B8R1.7 CC(N)C1=CC=CS1 BB32-0760 [1,0,0,0,0,0|2,0,1]=4 39 B8R1.7 C[C@@H](O)C1=NC=CS1 BB32-0283 [1,0,0,0,0,0|2,0,1]=4 40 B8R1.7 C[C@H](O)C1=NC=CS1 BB31-9911 [1,0,0,0,0,0|2,0,1]=4 41 B8R1.7 N=C(N)C1=CC=CO1 BB52-5806 [1,0,0,0,0,0|2,1,0]=4 42 B8R1.7 NC(=O)C1=COC=C1 BB32-3212 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.7 NC(=O)C1=NC=CN1 BB31-3274 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.7 NC(=O)C1=NC=CO1 BB31-8539 [1,0,0,0,0,0|2,1,0]=4 45 B8R1.7 NC(=S)C1=CC=CO1 BB31-3461 [1,0,0,0,0,0|1,2,0]=4 46 B8R1.7 O=C(O)C1=CC=NS1 BB54-5260 [1,0,0,0,0,0|1,0,0]=2 47 B8R1.7 O=C(O)C1=CN=CO1 BB52-2257 [1,0,0,0,0,0|1,1,0]=3 48 B8R1.7 O=C(O)C1=NON=C1 BB54-2722 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.7 O=C(O)[C@@H]1C=CCN1 BB31-3955 [1,0,0,0,0,0|1,0,2]=4 50 B8R1.7 O=C(O)[C@@H]1C=CCN1 BB31-5745 [1,0,0,0,0,0|1,0,2]=4 51 B8R1.7 O=C([O-])C1=NC=CO1 BB31-1161 [1,0,0,0,0,0|1,1,1]=4 52 B8R1.7 O=[N+]([O-])C1=CC=CN1 BB31-4901 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.14 COC(=O)C1=CC(C)=CN1 BB32-1368 [0,1,0,0,0,0|3,0,0]=4 54 B10R1.14 COC(=O)C1=CC(Cl)=CN1 BB31-0808 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.14 COC(=O)C1=CC=C(Cl)O1 BB31-6232 [0,1,0,0,0,0|0,1,0]=2 56 B10R1.14 COC(=O)C1=CNC(C)=C1 BB32-1910 [0,1,0,0,0,0|3,0,0]=4 57 B10R1.14 COC(=O)C1=CNC(C)=N1 BB31-7210 [0,1,0,0,0,0|3,0,0]=4 58 B10R1.14 COC(=O)C1=NC=C(C)O1 BB31-1107 [0,1,0,0,0,0|2,1,0]=4 59 B10R1.14 COC(=O)C1=NNC(Cl)=C1 BB31-3533 [0,1,0,0,0,0|3,0,0]=4 60 B10R1.31 CNC1=NC(C(=O)O)=CS1 BB52-6181 [0,1,0,0,0,0|3,0,0]=4 61 B10R1.31 COC1=CC=C(C(=O)O)S1 BB31-4536 [0,1,0,0,0,0|1,0,0]=2 62 B10R1.31 CSC1=CC=C(C(=O)O)S1 BB31-4118 [0,1,0,0,0,0|1,0,0]=2 63 B10R1.31 CSC1=NC(C(=O)O)=CS1 BB52-8387 [0,1,0,0,0,0|3,0,0]=4 64 B10R1.31 N#CC1=CC=C(C(=O)O)O1 BB32-1483 [0,1,0,0,0,0|1,1,0]=3 65 B10R1.31 N#CC1=CC=C(C(=O)O)S1 BB01-5623 [0,1,0,0,0,0|1,0,0]=2 66 B10R1.31 N#CC1=CNC(C(=O)O)=C1 BB31-7046 [0,1,0,0,0,0|3,0,0]=4 67 B10R1.31 N#CC1=CSC(C(=O)O)=C1 BB31-4756 [0,1,0,0,0,0|3,0,0]=4 68 B10R1.31 O=C(O)C1=CC(CO)=CS1 BB31-7624 [0,1,0,0,0,0|3,0,0]=4 69 B10R1.31 O=C(O)C1=CSC(CO)=N1 BB32-0905 [0,1,0,0,0,0|3,0,0]=4 70 B10R1.31 O=CC1=CC=C(C(=O)O)S1 BB51-1200 [0,1,0,0,0,0|1,0,0]=2 71 B10R1.58 CC(=O)C1=CC(C)=C(Br)S1 BB31-6726 [0,1,0,0,0,0|1,1,0]=3 72 B10R1.58 CC(=O)C1=CC(Cl)=C(Br)S1 BB31-0954 [0,1,0,0,0,0|1,1,0]=3 73 B10R1.58 CC1=C(Br)SC(B(O)O)=C1 BB31-2213 [0,1,0,0,0,0|1,1,1]=4 74 B10R1.58 CC1=C(C)SC(C(=O)O)=N1 BB31-8647 [0,1,0,0,0,0|2,0,0]=3 75 B10R1.58 CN1N=C(C(=O)O)C=C1Br BB31-2335 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.58 CN1N=C(C(=O)O)C=C1N BB05-4239 [0,1,0,0,0,0|3,0,0]=4 77 B10R1.58 O=C(O)C1=CC(Br)=C(Br)O1 BB31-7721 [0,1,0,0,0,0|0,2,0]=3 78 B10R1.58 OB(O)C1=CC(Br)=C(Cl)S1 BB31-0602 [0,1,0,0,0,0|1,0,1]=3 79 B10R1.59 CC1=C(C(=O)O)SC(N)=N1 BB52-1883 [0,1,0,0,0,0|2,0,0]=3 80 B10R1.59 CC1=C(C(=O)O)SC(O)=N1 BB31-6468 [0,1,0,0,0,0|2,0,0]=3 81 B10R1.59 CC1=CC(Br)=C(B(O)O)S1 BB31-8354 [0,1,0,0,0,0|2,0,1]=4 82 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 BB52-2375 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.59 CC1=CN(C)N=C1C(=O)O BB31-8505 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.59 CC1=NC(C(=O)O)=C(N)S1 BB32-2132 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.59 O=C(O)C1=C(Cl)N=C(Br)S1 BB31-2468 [0,1,0,0,0,0|1,1,0]=3 86 B10R1.59 O=C(O)C1=C(Cl)N=C(Cl)S1 BB32-3285 [0,1,0,0,0,0|1,0,0]=2 87 B10R1.194 CC1=CC=C(C(=O)O)N1C BB31-8717 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.194 CC1=CNC(C(=O)O)=C1C BB31-4790 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.194 CC1=CSC(C(=O)O)=C1C BB31-6323 [0,1,0,0,0,0|3,0,0]=4 90 B8R0.9 C=CC(=O)NCC(=O)O BB31-4277 [0,0,1,0,0,0|2,0,1]=4 91 B10R1.13 CC(=O)C1=CN=C(N)C=C1 BB31-3878 [0,0,0,0,0,1|3,0,0]=4 92 B10R1.13 CC(=O)C1=NC=C(O)C=C1 BB32-3774 [0,0,0,0,0,1|3,0,0]=4 93 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 BB31-5080 [0,0,0,0,0,1|2,0,0]=3 94 B10R1.13 CC(O)C1=CN=C(Cl)C=C1 BB32-1451 [0,0,0,0,0,1|2,0,1]=4 95 B10R1.13 CC1=NC=C(C(=O)O)C=N1 BB52-2338 [0,0,0,0,0,1|3,0,0]=4 96 B10R1.13 NC(=O)C1=NC=C(N)C=C1 BB31-2838 [0,0,0,0,0,1|3,0,0]=4 97 B10R1.13 NC1=CN=C(C(=O)O)N=C1 BB32-3215 [0,0,0,0,0,1|3,0,0]=4 98 B10R1.13 O=S(O)C1=CC=C(Br)C=C1 BB31-0817 [0,0,0,0,0,1|2,1,0]=4 99 B10R1.54 CC(=O)NC1=CC=C(Br)S1 BB31-7020 [0,0,0,0,0,1|1,1,0]=3 100 B10R1.54 CC1=NC(CC(=O)O)=CO1 BB54-4128 [0,0,0,0,0,1|3,0,0]=4 101 B10R1.54 NC1=NN=C(CC(=O)O)S1 BB54-4124 [0,0,0,0,0,1|3,0,0]=4 102 B10R1.54 O=C(O)CC1=CC=C(Br)S1 BB32-3837 [0,0,0,0,0,1|0,1,0]=2 103 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 BB31-8594 [0,0,0,0,0,1|2,1,0]=4 104 B10R1.113 CC(=O)C1=CC(F)=NC=C1 BB31-8727 [0,0,0,0,0,1|2,1,0]=4 105 B10R1.113 CC(=O)C1=CC=CC(Cl)=N1 BB32-0630 [0,0,0,0,0,1|2,0,0]=3 106 B10R1.113 CC(=O)C1=CC=CC(F)=N1 BB31-7596 [0,0,0,0,0,1|2,1,0]=4 107 B10R1.113 CC(=O)C1=CC=NC(Cl)=N1 BB31-1715 [0,0,0,0,0,1|2,0,0]=3 108 B10R1.113 CC(=O)C1=NC(=N)NC=C1 BB31-8729 [0,0,0,0,0,1|3,0,0]=4 109 B10R1.113 CC(=O)C1=NC(N)=CC=C1 BB31-9363 [0,0,0,0,0,1|3,0,0]=4 110 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 BB31-8955 [0,0,0,0,0,1|2,1,0]=4 111 B10R1.113 NC(=O)C1=CN=CC(Cl)=N1 BB32-1579 [0,0,0,0,0,1|2,0,0]=3 112 B10R1.113 NC(=O)C1=CN=CC(O)=C1 BB31-0206 [0,0,0,0,0,1|3,0,0]=4 113 B10R1.113 O=C(O)C1=CC(I)=CN=C1 BB32-0482 [0,0,0,0,0,1|1,1,0]=3 114 B10R1.113 O=C(O)C1=NC=CC(F)=C1 BB31-5136 [0,0,0,0,0,1|1,1,0]=3 115 B10R1.113 O=C1N=CC=C(C(=O)O)N1 BB31-7356 [0,0,0,0,0,1|2,0,0]=3 116 B10R1.113 OB(O)C1=CC=CC(Cl)=N1 BB31-5395 [0,0,0,0,0,1|2,0,1]=4 117 B10R1.113 OB(O)C1=NC=CC(Cl)=C1 BB31-6586 [0,0,0,0,0,1|2,0,1]=4 118 B7R1.1 O=CC1=CN=CO1 BB31-8199 [2,0,0,0,0,0|1,1,0]=4 119 B7R1.1 O=CC1=NC=CO1 BB31-4873 [2,0,0,0,0,0|1,1,0]=4 120 B7R1.2 ClC1=NC=C(Br)S1 BB31-4590 [2,0,0,0,0,0|2,0,0]=4 121 B7R1.2 N=C1NC=C(Cl)S1 BB32-1401 [2,0,0,0,0,0|2,0,0]=4 122 B9R1.21 C#CC1=CC=C(C=O)S1 BB31-4087 [1,1,0,0,0,0|1,0,0]=3 123 B9R1.21 N#CC1=CC=C(C=O)O1 BB32-1495 [1,1,0,0,0,0|1,1,0]=4 124 B9R1.21 O=CC1=CC=C(C=O)N1 BB32-1975 [1,1,0,0,0,0|2,0,0]=4 125 B9R1.22 NC1=NC(Cl)=C(C=O)S1 BB52-1748 [1,1,0,0,0,0|2,0,0]=4 126 B9R1.23 CN1C=C(C=O)SC1=O BB55-8422 [1,1,0,0,0,0|2,0,0]=4 127 B9R1.11 COC(=O)C1=NC=CO1 BB32-1812 [1,1,0,0,0,0|1,1,0]=4 128 B9R1.11 COC(=O)C1=NOC=C1 BB32-1155 [1,1,0,0,0,0|2,0,0]=4 129 B9R1.11 O=CC(=O)C1=CC=CO1 BB31-8251 [1,1,0,0,0,0|0,1,1]=4 130 B9R1.41 CC1=C(C(=O)O)ON=C1 BB31-4383 [1,1,0,0,0,0|1,1,0]=4 131 B9R1.41 CC1=C(C(=O)O)SN=N1 BB52-0951 [1,1,0,0,0,0|2,0,0]=4 132 B9R1.41 NC(=O)C1=C(Br)C=CS1 BB31-6931 [1,1,0,0,0,0|1,0,0]=3 133 B9R1.41 NC(=O)C1=CC=CN1N BB31-3190 [1,1,0,0,0,0|2,0,0]=4 134 B9R1.41 NC1=C(C(=O)O)C=CS1 BB32-3009 [1,1,0,0,0,0|2,0,0]=4 135 B9R1.41 O=C(O)C1=C(Br)C=CN1 BB31-2563 [1,1,0,0,0,0|1,0,0]=3 136 B9R1.41 O=C(O)C1=C(Br)OC=C1 BB31-3871 [1,1,0,0,0,0|2,0,0]=4 137 B11R1.3 C#CC1=CN=C(C(=O)O)C=C1 BB31-3691 [0,1,0,0,0,1|2,0,0]=4 138 B11R1.3 CNC1=NC=C(C(=O)O)C=C1 BB31-4402 [0,1,0,0,0,1|2,0,0]=4 139 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 BB31-5217 [0,1,0,0,0,1|2,0,0]=4 140 B11R1.21 CC(=O)C1=CN=C(Cl)C(C)=C1 BB31-1241 [0,1,0,0,0,1|2,0,0]=4 141 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=N1 BB31-0768 [0,1,0,0,0,1|2,0,0]=4 142 B11R1.21 CC1=C(C)N=C(C(=O)O)C=C1 BB31-6679 [0,1,0,0,0,1|2,0,0]=4 143 B11R1.21 CC1=CC(C(=O)O)=CN=C1C BB31-4837 [0,1,0,0,0,1|2,0,0]=4 144 B11R1.21 CC1=CC(C(=O)O)=CNC1=O BB31-7535 [0,1,0,0,0,1|2,0,0]=4 145 B11R1.21 CC1=NC=C(C(=O)O)C=C1N BB31-7301 [0,1,0,0,0,1|2,0,0]=4 146 B11R1.21 CN1C=C(C(=O)O)C=CC1=O BB52-8562 [0,1,0,0,0,1|2,0,0]=4 147 B11R1.21 NC1=C(S)C=C(C(=O)O)C=C1 BB31-2543 [0,1,0,0,0,1|2,0,0]=4 148 B11R1.21 NC1=CC(C(=O)O)=CN=C1Cl BB32-3665 [0,1,0,0,0,1|1,0,0]=3 149 B11R1.21 NC1=CC(C(=O)O)=CN=C1N BB32-1482 [0,1,0,0,0,1|2,0,0]=4 150 B11R1.21 O=C(O)C1=CC(Br)=C(F)N=C1 BB31-4538 [0,1,0,0,0,1|1,1,0]=4 151 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=N1 BB31-8280 [0,1,0,0,0,1|1,1,0]=4 152 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=N1 BB31-4757 [0,1,0,0,0,1|1,0,0]=3 153 B11R1.21 O=C(O)C1=CC(I)=C(I)C=C1 BB31-7853 [0,1,0,0,0,1|1,1,0]=4 154 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=N1 BB31-9203 [0,1,0,0,0,1|1,1,0]=4 155 B11R1.21 O=C(O)C1=CC=C(Cl)C(=O)N1 BB31-9052 [0,1,0,0,0,1|1,0,0]=3 156 B11R1.21 O=C(O)C1=CC=C(F)C(F)=N1 BB31-8597 [0,1,0,0,0,1|1,1,0]=4 157 B11R1.21 O=C(O)C1=CN=C(I)C(O)=C1 BB32-3137 [0,1,0,0,0,1|1,1,0]=4 158 B11R1.21 O=C(O)C1=NC(Cl)=C(Br)C=C1 BB31-7565 [0,1,0,0,0,1|1,1,0]=4 159 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 BB32-1297 [0,1,0,0,0,1|2,0,0]=4 160 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 BB32-3823 [0,1,0,0,0,1|2,0,0]=4 161 B11R1.22 COC(=O)C1=NN=C(C)C=C1 BB31-4747 [0,1,0,0,0,1|2,0,0]=4 162 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 BB31-2565 [0,1,0,0,0,1|2,0,0]=4 163 B11R1.22 O=C(CCl)C1=CN=C(Cl)C=C1 BB31-2020 [0,1,0,0,0,1|2,0,0]=4 164 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 BB32-1300 [0,1,0,0,0,1|1,1,0]=4 165 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=N1 BB31-2675 [0,1,0,0,0,1|2,0,0]=4 166 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 BB32-1815 [0,1,0,0,0,1|2,0,0]=4 167 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=N1 BB31-9078 [0,1,0,0,0,1|1,1,0]=4 168 B11R1.166 CC1=CC(Br)=NC=C1C(=O)O BB31-9293 [0,1,0,0,0,1|1,1,0]=4 169 B11R1.166 CC1=CC=C(C(=O)O)C(=O)N1 BB52-5680 [0,1,0,0,0,1|2,0,0]=4 170 B11R1.166 CC1=CN=C(C(=O)O)C(C)=C1 BB32-2407 [0,1,0,0,0,1|2,0,0]=4 171 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)C=N1 BB32-2608 [0,1,0,0,0,1|2,0,0]=4 172 B11R1.166 NC1=C(C(=O)O)C=CC(O)=C1 BB32-1819 [0,1,0,0,0,1|2,0,0]=4 173 B11R1.166 NC1=C(C(=O)O)N=CC(Cl)=N1 BB31-1452 [0,1,0,0,0,1|2,0,0]=4 174 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O BB32-2526 [0,1,0,0,0,1|1,0,0]=3 175 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)N=C1 BB31-1269 [0,1,0,0,0,1|1,0,0]=3 176 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 BB17-0814 [0,1,0,0,0,1|2,0,0]=4 177 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=N1 BB31-1821 [0,1,0,0,0,1|1,1,0]=4 178 B11R1.166 O=C(O)C1=C(Cl)C=C(O)N=C1 BB31-7039 [0,1,0,0,0,1|2,0,0]=4 179 B11R1.166 O=C(O)C1=C(Cl)N=C(Br)C=C1 BB31-6039 [0,1,0,0,0,1|1,1,0]=4 180 B11R1.166 O=C(O)C1=C(I)C=C(Br)N=C1 BB31-1405 [0,1,0,0,0,1|1,1,0]=4 181 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Br BB31-7929 [0,1,0,0,0,1|1,0,0]=3 182 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl BB31-5224 [0,1,0,0,0,1|1,1,0]=4 183 B11R1.166 O=C(O)C1=NN=C(Cl)C=C1Cl BB31-8883 [0,1,0,0,0,1|1,0,0]=3 184 B11R1.645 CC1=NC(C)=C(CC(=O)O)S1 BB52-8234 [0,1,0,0,0,1|2,0,0]=4 185 B11R1.23 COC(=O)C1=CC=CC(I)=N1 BB31-6799 [0,1,0,0,0,1|1,1,0]=4 186 B11R1.23 COC(=O)C1=CC=NC(Br)=N1 BB31-8147 [0,1,0,0,0,1|1,1,0]=4 187 B11R1.23 COC(=O)C1=NC(C)=NC=C1 BB31-7159 [0,1,0,0,0,1|2,0,0]=4 188 B11R1.23 COC(=O)C1=NC=CC(F)=C1 BB31-6424 [0,1,0,0,0,1|1,1,0]=4 189 B11R1.74 CC(=O)C1=CC(Cl)=NC(Cl)=C1 BB32-0814 [0,1,0,0,0,1|2,0,0]=4 190 B11R1.74 CC1=CC(C(=O)O)=NC(N)=N1 BB52-2371 [0,1,0,0,0,1|2,0,0]=4 191 B11R1.74 CC1=NC(C(=O)O)=CC(=O)N1 BB52-2369 [0,1,0,0,0,1|2,0,0]=4 192 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=N1 BB31-8939 [0,1,0,0,0,1|1,0,0]=3 193 B11R1.74 O=C(O)C1=CC(Cl)=CC(Br)=N1 BB31-9335 [0,1,0,0,0,1|1,0,0]=3 194 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=N1 BB31-4870 [0,1,0,0,0,1|1,0,0]=3 195 B11R1.74 O=C1C=C(C(=O)O)C=C(Cl)N1 BB32-3351 [0,1,0,0,0,1|1,0,0]=3 196 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O BB31-7750 [0,1,0,0,0,1|1,1,0]=4 197 B11R1.159 CC1=C(C(=O)O)N=CN=C1Cl BB31-7446 [0,1,0,0,0,1|2,0,0]=4 198 B11R1.159 CN1C(=O)C=CC=C1C(=O)O BB32-3280 [0,1,0,0,0,1|2,0,0]=4 199 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=CC=N1 BB31-0329 [0,1,0,0,0,1|2,0,0]=4 200 B11R1.159 NC(=O)C1=CC=CC(Cl)=C1N BB32-0637 [0,1,0,0,0,1|2,0,0]=4 201 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O BB31-4895 [0,1,0,0,0,1|1,1,0]=4 202 B11R1.159 O=C(O)C1=C(F)C(I)=NC=C1 BB31-8024 [0,1,0,0,0,1|1,1,0]=4 203 B11R1.159 O=C(O)C1=CC=NC(Cl)=C1Br BB32-0268 [0,1,0,0,0,1|1,0,0]=3 204 B11R1.159 O=C(O)C1=CC=NC(F)=C1Cl BB31-6933 [0,1,0,0,0,1|1,1,0]=4 205 B11R1.159 O=C(O)C1=CN=CC(Br)=C1Cl BB31-1242 [0,1,0,0,0,1|1,1,0]=4 206 B11R1.159 O=C(O)C1=CN=CC(Br)=C1I BB31-5995 [0,1,0,0,0,1|1,1,0]=4 207 B11R1.159 O=C(O)C1=CN=CC(Br)=C1O BB31-8460 [0,1,0,0,0,1|1,1,0]=4 208 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 BB31-9291 [0,1,0,0,0,1|1,1,0]=4 209 B11R1.167 CC1=C(C(=O)O)N=C(Cl)N=C1 BB31-7285 [0,1,0,0,0,1|1,0,0]=3 210 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 BB31-6434 [0,1,0,0,0,1|2,0,0]=4 211 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 BB32-2207 [0,1,0,0,0,1|2,0,0]=4 212 B11R1.167 CC1=CC=C(C)C(C(=O)O)=N1 BB31-6680 [0,1,0,0,0,1|2,0,0]=4 213 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 BB31-9003 [0,1,0,0,0,1|2,0,0]=4 214 B11R1.167 CC1=CNC(=O)C(C(=O)O)=C1 BB32-1929 [0,1,0,0,0,1|2,0,0]=4 215 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 BB31-4824 [0,1,0,0,0,1|2,0,0]=4 216 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=N1 BB31-6881 [0,1,0,0,0,1|2,0,0]=4 217 B11R1.167 NC(=O)C1=NC(Cl)=CN=C1Cl BB31-0314 [0,1,0,0,0,1|2,0,0]=4 218 B11R1.167 NC1=CC(C(=O)O)=C(N)C=C1 BB31-0664 [0,1,0,0,0,1|2,0,0]=4 219 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 BB31-7675 [0,1,0,0,0,1|2,0,0]=4 220 B11R1.167 NC1=NC(C(=O)O)=C(Cl)C=N1 BB32-2403 [0,1,0,0,0,1|2,0,0]=4 221 B11R1.167 NC1=NC=C(F)C=C1C(=O)O BB31-1355 [0,1,0,0,0,1|1,1,0]=4 222 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=N1 BB31-5086 [0,1,0,0,0,1|1,1,0]=4 223 B11R1.167 O=C(O)C1=C(Br)C=NC(O)=C1 BB31-7503 [0,1,0,0,0,1|2,0,0]=4 224 B11R1.167 O=C(O)C1=C(I)C=CC(O)=C1 BB32-3325 [0,1,0,0,0,1|2,0,0]=4 225 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=N1 BB31-4987 [0,1,0,0,0,1|1,1,0]=4 226 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F BB31-6005 [0,1,0,0,0,1|1,0,0]=3 227 B11R1.167 O=C(O)C1=CC(Cl)=NN=C1O BB32-2578 [0,1,0,0,0,1|2,0,0]=4 228 B11R1.167 O=C(O)C1=CC(F)=CN=C1O BB31-6534 [0,1,0,0,0,1|1,1,0]=4 229 B11R1.167 O=C(O)C1=CC(I)=CN=C1Cl BB32-3008 [0,1,0,0,0,1|1,1,0]=4 230 B11R1.167 O=C(O)C1=CC(O)=CN=C1Cl BB32-1940 [0,1,0,0,0,1|2,0,0]=4 231 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Cl BB32-2151 [0,1,0,0,0,1|1,0,0]=3 232 B11R1.266 CCC1=CC=CC(C(=O)O)=C1 BB32-3000 [0,1,0,0,0,1|2,0,0]=4 233 B11R1.266 CNC1=CC=CC(C(=O)O)=C1 BB31-5735 [0,1,0,0,0,1|2,0,0]=4 234 B11R1.266 COC1=NC=CC(C(=O)O)=C1 BB52-3918 [0,1,0,0,0,1|2,0,0]=4 235 B11R1.266 O=CC1=CC(C(=O)O)=CN=C1 BB31-6334 [0,1,0,0,0,1|2,0,0]=4 236 B11R1.15 CCOC(=O)C1=NC=C(Br)S1 BB31-9033 [0,2,0,0,0,0|1,1,0]=4 237 B11R1.44 COC(=O)C1=CC=C(C=O)O1 BB31-4904 [0,2,0,0,0,0|1,1,0]=4 238 B11R1.44 COC(=O)C1=CC=C(CN)S1 BB31-8693 [0,2,0,0,0,0|1,0,0]=3 239 B11R1.44 COC(=O)C1=CN=C(C=O)S1 BB31-2522 [0,2,0,0,0,0|2,0,0]=4 240 B11R1.44 N#CC1=CC=C(C(=O)CBr)S1 BB31-7649 [0,2,0,0,0,0|2,0,0]=4 241 B11R1.225 COC(=O)C1=C(Br)C=C(C)S1 BB31-1289 [0,2,0,0,0,0|1,0,0]=3 242 B11R1.225 COC(=O)C1=C(Br)SC(Cl)=N1 BB31-3674 [0,2,0,0,0,0|2,0,0]=4 243 B11R1.225 COC(=O)C1=C(C)C=C(Br)S1 BB31-6231 [0,2,0,0,0,0|0,1,0]=3 244 B11R1.225 COC(=O)C1=C(C)SC(Cl)=N1 BB31-9967 [0,2,0,0,0,0|2,0,0]=4 245 B11R1.225 COC(=O)C1=C(N)SC(Cl)=C1 BB32-2921 [0,2,0,0,0,0|2,0,0]=4 246 B11R1.226 COC(=O)C1=CC(N)=C(C)S1 BB32-2812 [0,2,0,0,0,0|1,0,0]=3 247 B11R1.226 COC(=O)C1=CC(N)=C(Cl)S1 BB31-8495 [0,2,0,0,0,0|0,0,0]=2 248 B11R1.865 COC(=O)C1=CC=C(Br)N1C BB31-1335 [0,2,0,0,0,0|1,1,0]=4 249 B11R1.48 CC1=C(C=O)SC(C(=O)O)=C1 BB51-1201 [0,2,0,0,0,0|1,0,0]=3 250 B11R1.50 CNC1=NC(C)=C(C(=O)O)S1 BB52-1884 [0,2,0,0,0,0|2,0,0]=4 251 B11R1.50 COC1=NC(C)=C(C(=O)O)S1 BB52-3925 [0,2,0,0,0,0|2,0,0]=4 252 B11R1.124 CCSC1=CC=C(C(=O)O)S1 BB05-3105 [0,2,0,0,0,0|1,0,0]=3 253 B11R1.175 CC(=O)C1=NC=C(C(=O)O)S1 BB31-8801 [0,2,0,0,0,0|2,0,0]=4 254 B11R1.175 O=C(O)C1=CC=C(C(F)F)S1 BB32-0699 [0,2,0,0,0,0|0,1,0]=3 255 B11R1.473 CN1C(C=O)=CC=C1C(=O)O BB32-1264 [0,2,0,0,0,0|2,0,0]=4 256 B11R1.79 NS(=O)(=O)C1=CC(Cl)=C(Cl)S1 BB31-5612 [0,2,0,0,0,0|1,0,1]=4 257 B11R1.672 O=C(O)C1=C(Br)C(Br)=C(Br)S1 BB31-4959 [0,2,0,0,0,0|0,1,0]=3 258 B11R1.672 O=C(O)C1=C(Cl)C(Cl)=C(Cl)S1 BB31-5744 [0,2,0,0,0,0|0,0,0]=2 259 B9R1.69 O=C1NC(Cl)=CC=C1F BB31-2050 [0,0,1,1,0,0|2,0,0]=4 260 B7R1.18 O=C(O)C1=CCC1 BB32-1171 [1,0,0,0,1,0|0,0,2]=4 261 B9R1.2 CC1=CN=CC(C=O)=N1 BB31-0483 [1,0,0,0,0,1|2,0,0]=4 262 B9R1.2 O=CC1=CC=CC(=O)N1 BB32-1723 [1,0,0,0,0,1|2,0,0]=4 263 B9R1.2 O=CC1=CN=CC(O)=C1 BB31-6018 [1,0,0,0,0,1|2,0,0]=4 264 B9R1.13 O=C(O)CC1=NC=CS1 BB31-4063 [1,0,0,0,0,1|1,0,0]=3 265 B9R1.13 O=C(O)CC1=NNC=C1 BB31-0343 [1,0,0,0,0,1|2,0,0]=4 266 B9R1.13 O=C(O)CN1C=CC=N1 BB52-7773 [1,0,0,0,0,1|2,0,0]=4 267 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 BB31-0029 [0,0,0,0,0,2|1,0,0]=3 268 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 BB31-0032 [0,0,0,0,0,2|1,1,0]=4 269 B11R1.157 CC(=O)OC1=CC=CC(Cl)=C1 BB31-1635 [0,0,0,0,0,2|2,0,0]=4 270 B11R1.157 O=C(O)CC1=CC(Br)=CN=C1 BB31-4723 [0,0,0,0,0,2|1,1,0]=4 271 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 BB32-2011 [0,0,0,0,0,2|1,1,0]=4 272 B11R1.157 O=C(O)CC1=CC=CC(Cl)=N1 BB31-6394 [0,0,0,0,0,2|1,0,0]=3 273 B11R1.157 O=C(O)CC1=CC=CC(F)=N1 BB31-0031 [0,0,0,0,0,2|1,1,0]=4