0 B9R1.6 CC(=O)C1=CC=CC=N1 BB_SC-06522 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.6 CC(=O)C1=CC=NC=C1 BB_SC-12406 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 CC(=O)C1=NC=CN=C1 BB_SC-12418 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 CC(N)C1=CC=CC=C1 BB_SC-09414 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.6 CN(C)C1=CC=NC=C1 BB_SC-07248 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.6 C[C@@H](N)C1=CC=CC=C1 BB_NC-02297 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.6 C[C@H](N)C1=CC=CC=C1 BB_SC-10322 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.6 N=C(N)C1=CC=CC=C1 BB_SC-07183 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 N=C(N)C1=CC=CN=C1 BB_SC-07349 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.6 NC(=O)C1=CC=CN=C1 BB_NC-02290 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.6 NC(=O)C1=CC=NC=C1 BB_SC-06660 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.6 NC(=O)C1=CN=CC=N1 BB_SC-01250 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.6 NC(=S)C1=CN=CC=C1 BB_SC-05504 [0,0,0,0,0,0|2,1,0]=3 13 B9R1.6 O=C(Cl)C1=CN=CC=C1 BB_SC-06783 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 O=C(O)C1=CC=CN=C1 BB_SC-12613 [0,0,0,0,0,0|1,0,0]=1 15 B9R1.6 O=C(O)C1=CC=NC=C1 BB_SC-07270 [0,0,0,0,0,0|1,0,0]=1 16 B9R1.6 O=C(O)C1=CN=CC=N1 BB_SC-05383 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.6 O=C([O-])C1=NC=CC=C1 BB_SC-07257 [0,0,0,0,0,0|1,0,1]=2 18 B8R1.2 C=CC1=CC=CC=N1 BB_SC-05428 [1,0,0,0,0,0|2,0,0]=3 19 B8R1.2 C=CC1=CC=NC=C1 BB_SC-05441 [1,0,0,0,0,0|2,0,0]=3 20 B8R1.2 COC1=NC=CC=C1 BB_SC-07094 [1,0,0,0,0,0|3,0,0]=4 21 B8R1.2 ClCC1=CC=CC=N1 BB_SC-02985 [1,0,0,0,0,0|2,0,1]=4 22 B8R1.2 ClCC1=CC=CN=C1 BB_SC-03000 [1,0,0,0,0,0|2,0,1]=4 23 B8R1.2 ClCC1=CC=NC=C1 BB_SC-02999 [1,0,0,0,0,0|2,0,1]=4 24 B8R1.2 N#CC1=CC=CN=C1 BB_SC-12614 [1,0,0,0,0,0|2,0,1]=4 25 B8R1.2 N#CC1=CC=NC=C1 BB_SC-07019 [1,0,0,0,0,0|2,0,1]=4 26 B8R1.2 N#CC1=NC=CC=C1 BB_SC-08696 [1,0,0,0,0,0|2,0,1]=4 27 B8R1.2 NCC1=CC=CC=N1 BB_SC-05841 [1,0,0,0,0,0|2,0,1]=4 28 B8R1.2 NCC1=CN=CC=C1 BB_SC-12559 [1,0,0,0,0,0|2,0,1]=4 29 B8R1.2 NNC1=CC=CC=C1 BB_SC-06741 [1,0,0,0,0,0|2,0,0]=3 30 B8R1.2 NNC1=NC=CC=C1 BB_SC-07490 [1,0,0,0,0,0|3,0,0]=4 31 B8R1.2 O=CC1=CC=CC=N1 BB_SC-07272 [1,0,0,0,0,0|1,0,0]=2 32 B8R1.2 O=CC1=CC=NC=C1 BB_SC-06717 [1,0,0,0,0,0|1,0,0]=2 33 B8R1.2 O=CC1=CN=CC=C1 BB_SC-11212 [1,0,0,0,0,0|1,0,0]=2 34 B8R1.2 OCC1=CC=CC=C1 BB_SC-07027 [1,0,0,0,0,0|0,0,1]=2 35 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 BB_SC-06664 [0,1,0,0,0,0|1,0,0]=2 36 B10R1.13 CC(=O)C1=CC=C(C)C=C1 BB_SC-06635 [0,1,0,0,0,0|1,0,0]=2 37 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 BB_SC-06734 [0,1,0,0,0,0|1,0,0]=2 38 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB_SC-08802 [0,1,0,0,0,0|1,0,0]=2 39 B10R1.13 CC(=O)C1=CC=C(N)C=C1 BB_SC-10671 [0,1,0,0,0,0|1,0,0]=2 40 B10R1.13 CC(=O)C1=CC=C(O)C=C1 BB_SC-06720 [0,1,0,0,0,0|1,0,0]=2 41 B10R1.13 CC(C)C1=CC=C(N)C=C1 BB_SC-12018 [0,1,0,0,0,0|2,0,1]=4 42 B10R1.13 CC(C)C1=CC=C(O)C=C1 BB_SC-12725 [0,1,0,0,0,0|2,0,1]=4 43 B10R1.13 CC(N)C1=CC=C(Br)C=C1 BB_SC-11893 [0,1,0,0,0,0|2,0,1]=4 44 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 BB_SC-06932 [0,1,0,0,0,0|1,0,0]=2 45 B10R1.13 N=C(N)C1=CC=C(N)C=C1 BB_SC-07955 [0,1,0,0,0,0|2,0,0]=3 46 B10R1.13 NC(=O)C1=CC=C(N)C=C1 BB_SC-05091 [0,1,0,0,0,0|1,0,0]=2 47 B10R1.13 NC(=S)C1=CC=C(O)C=C1 BB_SC-03474 [0,1,0,0,0,0|1,1,0]=3 48 B10R1.13 NC1=CC=C(C(=O)O)C=N1 BB_SC-05191 [0,1,0,0,0,0|1,0,0]=2 49 B10R1.13 NC1=NC=C([N+](=O)[O-])C=C1 BB_SC-02982 [0,1,0,0,0,0|2,0,1]=4 50 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 BB_SC-06735 [0,1,0,0,0,0|1,0,0]=2 51 B10R1.13 O=C(O)C1=CC=C(F)C=C1 BB_SC-06507 [0,1,0,0,0,0|0,0,0]=1 52 B10R1.13 O=C(O)C1=CC=C(O)C=C1 BB_NC-02308 [0,1,0,0,0,0|0,0,0]=1 53 B10R1.13 O=C(O)C1=CC=[N+]([O-])C=C1 BB_SC-12681 [0,1,0,0,0,0|1,0,0]=2 54 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 BB_SC-03259 [0,1,0,0,0,0|1,0,0]=2 55 B10R1.13 O=C1C=CC(C(=O)O)=CN1 BB_NC-01873 [0,1,0,0,0,0|1,0,0]=2 56 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BB_NC-02200 [0,1,0,0,0,0|1,0,0]=2 57 B10R1.13 O=C1C=CC(C(=O)O)=NN1 BB_SC-03396 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 BB_SC-06256 [0,1,0,0,0,0|1,0,1]=3 59 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 BB_SC-07099 [0,1,0,0,0,0|1,0,1]=3 60 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 BB_SC-05141 [0,1,0,0,0,0|1,0,1]=3 61 B10R1.13 O=[N+]([O-])C1=CC=[N+]([O-])C=C1 BB_SC-02997 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)C=C1 BB_SC-02984 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.15 CCC(=O)C1=CC=CC=C1 BB_SC-06910 [0,1,0,0,0,0|1,0,0]=2 64 B10R1.15 COC(=O)C1=CC=CC=C1 BB_SC-07167 [0,1,0,0,0,0|0,0,0]=1 65 B10R1.15 COC(=O)C1=CN=CC=C1 BB_SC-06260 [0,1,0,0,0,0|1,0,0]=2 66 B10R1.15 C\C(=N/O)C1=CN=CC=C1 BB_SC-12646 [0,1,0,0,0,0|2,0,0]=3 67 B10R1.15 NCC(=O)C1=CC=CC=C1 BB_NC-02945 [0,1,0,0,0,0|1,0,0]=2 68 B10R1.15 NNC(=O)C1=CC=NC=C1 BB_SC-06246 [0,1,0,0,0,0|2,0,0]=3 69 B10R1.15 N\C(=N/O)C1=CC=CC=C1 BB_SC-12259 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.15 N\C(=N/O)C1=CC=CN=C1 BB_SC-09054 [0,1,0,0,0,0|2,0,0]=3 71 B10R1.15 N\C(=N/O)C1=CC=NC=C1 BB_SC-09053 [0,1,0,0,0,0|2,0,0]=3 72 B10R1.15 N\C(=N/O)C1=NC=CC=C1 BB_SC-12253 [0,1,0,0,0,0|2,0,0]=3 73 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 BB_SC-07030 [0,1,0,0,0,0|1,0,1]=3 74 B10R1.28 O=S(=O)(Cl)C1=CC=CN=C1 BB_SC-04776 [0,1,0,0,0,0|2,0,1]=4 75 B10R1.61 CC(=O)C1=C(C)C=CC=C1 BB_SC-06871 [0,1,0,0,0,0|1,0,0]=2 76 B10R1.61 CC(=O)C1=C(O)C=CC=C1 BB_SC-06782 [0,1,0,0,0,0|1,0,0]=2 77 B10R1.61 CC(=O)C1=CC=CC=C1N BB_SC-09205 [0,1,0,0,0,0|1,0,0]=2 78 B10R1.61 CC1=C(C(=O)Cl)C=CC=C1 BB_SC-06956 [0,1,0,0,0,0|1,0,0]=2 79 B10R1.61 NC(=O)C1=C(O)C=CC=C1 BB_SC-00234 [0,1,0,0,0,0|1,0,0]=2 80 B10R1.61 NC(=O)C1=C(O)C=CC=N1 BB_SC-05523 [0,1,0,0,0,0|2,0,0]=3 81 B10R1.61 NC1=C(C(=O)O)C=CC=N1 BB_SC-03260 [0,1,0,0,0,0|1,0,0]=2 82 B10R1.61 NC1=C(C(=O)O)C=NC=N1 BB_NC-02406 [0,1,0,0,0,0|2,0,0]=3 83 B10R1.61 NC1=CC=CC=C1C(=O)O BB_NC-02812 [0,1,0,0,0,0|0,0,0]=1 84 B10R1.61 NC1=CC=CC=C1[N+](=O)[O-] BB_SC-10672 [0,1,0,0,0,0|1,0,1]=3 85 B10R1.61 O=C(Cl)C1=C(Cl)C=CC=C1 BB_SC-06826 [0,1,0,0,0,0|1,0,0]=2 86 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 BB_SC-06990 [0,1,0,0,0,0|1,0,0]=2 87 B10R1.61 O=C(Cl)C1=CC=CN=C1Cl BB_SC-08695 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.61 O=C(O)C1=C(I)C=CC=C1 BB_SC-06764 [0,1,0,0,0,0|0,0,0]=1 89 B10R1.61 O=C(O)C1=CC=CC=C1F BB_SC-09447 [0,1,0,0,0,0|0,0,0]=1 90 B10R1.61 O=C(O)C1=CC=CN=C1Cl BB_SC-05455 [0,1,0,0,0,0|1,0,0]=2 91 B10R1.61 O=C(O)C1=CC=CN=C1S BB_SC-06564 [0,1,0,0,0,0|1,0,0]=2 92 B10R1.61 O=C(O)C1=CC=CNC1=O BB_NC-02163 [0,1,0,0,0,0|1,0,0]=2 93 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CN=C1 BB_SC-04744 [0,1,0,0,0,0|2,0,1]=4 94 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Cl BB_SC-02086 [0,1,0,0,0,0|2,0,1]=4 95 B10R1.61 O=[N+]([O-])C1=CC=CN=C1O BB_SC-04742 [0,1,0,0,0,0|2,0,1]=4 96 B10R1.113 CC(=O)C1=CC(O)=CC=C1 BB_SC-07222 [0,1,0,0,0,0|1,0,0]=2 97 B10R1.113 CC(=O)C1=CC=CC(N)=C1 BB_SC-10669 [0,1,0,0,0,0|1,0,0]=2 98 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 BB_SC-09887 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.113 NC(=O)C1=CC=CC(N)=C1 BB_SC-07456 [0,1,0,0,0,0|1,0,0]=2 100 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 BB_SC-06272 [0,1,0,0,0,0|2,0,0]=3 101 B10R1.113 NC1=CC(C(=O)O)=CN=C1 BB_SC-04954 [0,1,0,0,0,0|1,0,0]=2 102 B10R1.113 NC1=CC=CC(C(=O)O)=C1 BB_SC-12388 [0,1,0,0,0,0|0,0,0]=1 103 B10R1.113 NC1=NC=CC(C(=O)O)=C1 BB_SC-05192 [0,1,0,0,0,0|1,0,0]=2 104 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 BB_SC-03258 [0,1,0,0,0,0|1,0,0]=2 105 B10R1.113 O=C(O)C1=CC(Cl)=CC=N1 BB_SC-02566 [0,1,0,0,0,0|1,0,0]=2 106 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 BB_SC-04632 [0,1,0,0,0,0|1,0,0]=2 107 B10R1.113 O=C(O)C1=CC(O)=CN=C1 BB_NC-01971 [0,1,0,0,0,0|1,0,0]=2 108 B10R1.113 O=C(O)C1=CC=CC(O)=C1 BB_SC-06483 [0,1,0,0,0,0|0,0,0]=1 109 B10R1.113 O=C(O)C1=C[N+]([O-])=CC=C1 BB_SC-06795 [0,1,0,0,0,0|1,0,0]=2 110 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 BB_SC-03441 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.113 O=C(O)C1=NC(O)=CC=C1 BB_SC-04741 [0,1,0,0,0,0|1,0,0]=2 112 B10R2.6 C1=CC=C(C2CO2)C=C1 BB_NC-02270 [0,0,0,1,0,0|1,0,1]=3 113 B8R1.7 CC(=O)C1=CC=CN1 BB_SC-04064 [0,0,0,0,1,0|2,0,0]=3 114 B8R1.7 CC(=O)C1=CC=CO1 BB_SC-06820 [0,0,0,0,1,0|2,0,0]=3 115 B8R1.7 CC(=O)C1=CSC=C1 BB_SC-04782 [0,0,0,0,1,0|2,0,0]=3 116 B8R1.7 O=C(Cl)C1=CC=CS1 BB_SC-06755 [0,0,0,0,1,0|2,0,0]=3 117 B8R1.7 O=C(O)C1=CC=CN1 BB_SC-10428 [0,0,0,0,1,0|1,0,0]=2 118 B8R1.7 O=C(O)C1=CC=CO1 BB_SC-06491 [0,0,0,0,1,0|1,0,0]=2 119 B8R1.7 O=C(O)C1=CSC=C1 BB_SC-09202 [0,0,0,0,1,0|1,0,0]=2 120 B8R1.7 O=C(O)C1=CSN=N1 BB_SC-04188 [0,0,0,0,1,0|3,0,0]=4 121 B8R1.7 O=C(O)C1=NC=NN1 BB_SC-10825 [0,0,0,0,1,0|3,0,0]=4 122 B8R1.7 O=C(O)C1=NNC=C1 BB_SC-00195 [0,0,0,0,1,0|2,0,0]=3 123 B10R1.18 CC(=O)CC1=CC=CC=C1 BB_SC-09450 [0,0,0,0,0,1|1,0,0]=2 124 B10R1.18 CC(=O)NC1=CN=CC=C1 BB_SC-09458 [0,0,0,0,0,1|2,0,0]=3 125 B10R1.18 N=C(N)CC1=CC=CC=C1 BB_SC-07552 [0,0,0,0,0,1|2,0,0]=3 126 B10R1.18 NC(=S)NC1=CC=CC=C1 BB_SC-06692 [0,0,0,0,0,1|1,1,0]=3 127 B10R1.18 O=C(Cl)CC1=CC=CC=C1 BB_SC-06754 [0,0,0,0,0,1|1,0,0]=2 128 B10R1.18 O=C(Cl)OC1=CC=CC=C1 BB_SC-06813 [0,0,0,0,0,1|1,0,0]=2 129 B7R0.4 C\C=C\C=C\C(=O)O BB_NC-00413 [1,0,1,0,0,0|0,0,1]=3 130 B7R1.3 BrC1=CC=CC=N1 BB_SC-04785 [2,0,0,0,0,0|2,0,0]=4 131 B7R1.3 BrC1=CC=NC=C1 BB_SC-02988 [2,0,0,0,0,0|2,0,0]=4 132 B7R1.3 BrC1=CN=CC=C1 BB_SC-04786 [2,0,0,0,0,0|2,0,0]=4 133 B7R1.3 CC1=CC=NC=C1 BB_SC-07024 [2,0,0,0,0,0|1,0,1]=4 134 B7R1.3 ClC1=CC=CC=N1 BB_SC-06726 [2,0,0,0,0,0|2,0,0]=4 135 B7R1.3 FC1=CC=CC=N1 BB_SC-03368 [2,0,0,0,0,0|2,0,0]=4 136 B7R1.3 IC1=CC=NC=C1 BB_SC-02996 [2,0,0,0,0,0|2,0,0]=4 137 B7R1.3 NC1=CC=CN=C1 BB_SC-06592 [2,0,0,0,0,0|2,0,0]=4 138 B7R1.3 NC1=CC=NC=C1 BB_SC-06974 [2,0,0,0,0,0|2,0,0]=4 139 B7R1.3 NC1=NC=CC=C1 BB_SC-06704 [2,0,0,0,0,0|2,0,0]=4 140 B7R1.3 OC1=CN=CC=C1 BB_SC-00238 [2,0,0,0,0,0|1,0,0]=3 141 B7R1.3 OC1=NC=CC=C1 BB_SC-07237 [2,0,0,0,0,0|1,0,0]=3 142 B9R0.55 O=C(O)\C=C\C=C\C(=O)O BB_SC-02887 [0,1,1,0,0,0|1,0,0]=3 143 B9R1.1 CC1=CC=C(CCl)C=C1 BB_SC-06960 [1,1,0,0,0,0|1,0,1]=4 144 B9R1.1 CCC1=CC=C(N)C=C1 BB_SC-07009 [1,1,0,0,0,0|1,0,1]=4 145 B9R1.1 CNC1=CC=C(O)C=C1 BB_SC-07044 [1,1,0,0,0,0|2,0,0]=4 146 B9R1.1 COC1=CC=C(S)C=C1 BB_SC-06511 [1,1,0,0,0,0|2,0,0]=4 147 B9R1.1 ClCC1=CC=C(Br)C=C1 BB_SC-04526 [1,1,0,0,0,0|1,0,1]=4 148 B9R1.1 FC1=CC=C(CCl)C=C1 BB_SC-06883 [1,1,0,0,0,0|1,0,1]=4 149 B9R1.1 N#CC1=CC=C(F)C=C1 BB_SC-04560 [1,1,0,0,0,0|1,0,1]=4 150 B9R1.1 N#CC1=CC=C(N)C=C1 BB_SC-12619 [1,1,0,0,0,0|1,0,1]=4 151 B9R1.1 NC1=CC=C(C=O)C=C1 BB_NC-02192 [1,1,0,0,0,0|0,0,0]=2 152 B9R1.1 NCC1=CC=C(Cl)C=C1 BB_SC-04583 [1,1,0,0,0,0|1,0,1]=4 153 B9R1.1 NCC1=CC=C(N)C=C1 BB_SC-08895 [1,1,0,0,0,0|1,0,1]=4 154 B9R1.1 NNC1=CC=C(Br)C=C1 BB_SC-06247 [1,1,0,0,0,0|2,0,0]=4 155 B9R1.1 NNC1=CC=C(Cl)C=C1 BB_SC-05223 [1,1,0,0,0,0|2,0,0]=4 156 B9R1.1 O=CC1=CC=C(F)C=C1 BB_SC-03254 [1,1,0,0,0,0|0,0,0]=2 157 B9R1.1 O=CC1=CC=C(O)C=C1 BB_NC-02207 [1,1,0,0,0,0|0,0,0]=2 158 B9R1.1 OCC1=CC=C(Cl)C=C1 BB_SC-06996 [1,1,0,0,0,0|0,0,1]=3 159 B9R1.1 OCC1=CC=C(F)C=C1 BB_SC-06738 [1,1,0,0,0,0|0,0,1]=3 160 B9R1.1 [O-][N+]1=CC=C(NO)C=C1 BB_SC-03072 [1,1,0,0,0,0|2,0,0]=4 161 B9R1.2 CC1=CC=CC(CCl)=C1 BB_SC-07069 [1,1,0,0,0,0|1,0,1]=4 162 B9R1.2 CC1=CC=CC(NN)=C1 BB_SC-06209 [1,1,0,0,0,0|2,0,0]=4 163 B9R1.2 COC1=CC=CC(N)=C1 BB_SC-07166 [1,1,0,0,0,0|2,0,0]=4 164 B9R1.2 COC1=CC=CC(O)=C1 BB_SC-06850 [1,1,0,0,0,0|2,0,0]=4 165 B9R1.2 CSC1=CC(N)=CC=C1 BB_SC-07267 [1,1,0,0,0,0|2,0,0]=4 166 B9R1.2 ClCC1=CC(Cl)=CC=C1 BB_SC-06965 [1,1,0,0,0,0|1,0,1]=4 167 B9R1.2 ClCC1=CC=CC(Br)=C1 BB_SC-09626 [1,1,0,0,0,0|1,0,1]=4 168 B9R1.2 NCC1=CC(Cl)=CC=C1 BB_SC-04584 [1,1,0,0,0,0|1,0,1]=4 169 B9R1.2 NCC1=CC(F)=CC=C1 BB_SC-04586 [1,1,0,0,0,0|1,0,1]=4 170 B9R1.2 NCC1=CC(N)=CC=C1 BB_SC-08894 [1,1,0,0,0,0|1,0,1]=4 171 B9R1.2 NNC1=CC=CC(F)=C1 BB_SC-06249 [1,1,0,0,0,0|2,0,0]=4 172 B9R1.2 O=CC1=CC(F)=CC=C1 BB_SC-03369 [1,1,0,0,0,0|0,0,0]=2 173 B9R1.2 O=CC1=NC(Br)=CC=C1 BB_SC-04737 [1,1,0,0,0,0|1,0,0]=3 174 B9R1.8 BrCCC1=CC=CC=C1 BB_SC-06958 [1,1,0,0,0,0|1,0,1]=4 175 B9R1.8 CCNC1=CC=CC=C1 BB_SC-06979 [1,1,0,0,0,0|1,0,1]=4 176 B9R1.8 CNCC1=CC=CC=C1 BB_SC-06901 [1,1,0,0,0,0|1,0,1]=4 177 B9R1.8 COCC1=CC=CC=C1 BB_SC-07026 [1,1,0,0,0,0|0,0,1]=3 178 B9R1.8 ClCCC1=CC=CC=C1 BB_SC-04527 [1,1,0,0,0,0|1,0,1]=4 179 B9R1.8 NCCC1=CC=CC=C1 BB_SC-12701 [1,1,0,0,0,0|1,0,1]=4 180 B9R1.8 NNCC1=CC=CC=C1 BB_SC-06489 [1,1,0,0,0,0|1,0,1]=4 181 B9R1.8 O=C=NC1=CC=CC=C1 BB_SC-06970 [1,1,0,0,0,0|0,0,1]=3 182 B9R1.8 OCCC1=CC=CC=C1 BB_NC-03339 [1,1,0,0,0,0|0,0,1]=3 183 B9R1.8 OCCC1=NC=CC=C1 BB_SC-11215 [1,1,0,0,0,0|1,0,1]=4 184 B9R1.8 S=C=NC1=CC=CC=C1 BB_SC-09412 [1,1,0,0,0,0|0,1,1]=4 185 B9R1.15 CC1=CC=CC=C1CCl BB_SC-07008 [1,1,0,0,0,0|1,0,1]=4 186 B9R1.15 CC1=CC=CC=C1NN BB_SC-06250 [1,1,0,0,0,0|2,0,0]=4 187 B9R1.15 ClCC1=C(Cl)C=CC=C1 BB_SC-06882 [1,1,0,0,0,0|1,0,1]=4 188 B9R1.15 N#CC1=C(F)C=CC=C1 BB_SC-03292 [1,1,0,0,0,0|1,0,1]=4 189 B9R1.15 N#CC1=C(N)C=CC=C1 BB_SC-04521 [1,1,0,0,0,0|1,0,1]=4 190 B9R1.15 N#CC1=C(O)C=CC=C1 BB_SC-04062 [1,1,0,0,0,0|1,0,1]=4 191 B9R1.15 N#CC1=CC=CC=C1Cl BB_SC-12389 [1,1,0,0,0,0|1,0,1]=4 192 B9R1.15 NC1=C(CO)C=CC=C1 BB_SC-05568 [1,1,0,0,0,0|0,0,1]=3 193 B9R1.15 NC1=NC=CC=C1C=O BB_SC-04877 [1,1,0,0,0,0|1,0,0]=3 194 B9R1.15 NCC1=C(Cl)C=CC=C1 BB_SC-06959 [1,1,0,0,0,0|1,0,1]=4 195 B9R1.15 NCC1=C(F)C=CC=C1 BB_SC-04585 [1,1,0,0,0,0|1,0,1]=4 196 B9R1.15 NNC1=C(Br)C=CC=C1 BB_SC-02803 [1,1,0,0,0,0|2,0,0]=4 197 B9R1.15 NNC1=CC=CC=C1F BB_SC-06248 [1,1,0,0,0,0|2,0,0]=4 198 B9R1.15 O=CC1=C(Cl)C=CC=C1 BB_SC-06736 [1,1,0,0,0,0|0,0,0]=2 199 B9R1.15 O=CC1=C(O)C=CC=C1 BB_SC-09449 [1,1,0,0,0,0|0,0,0]=2 200 B9R1.15 O=CC1=CC=CN=C1Cl BB_SC-09204 [1,1,0,0,0,0|1,0,0]=3 201 B9R1.11 COC(=O)C1=NNC=C1 BB_SC-04725 [0,1,0,0,1,0|2,0,0]=4 202 B9R1.11 N\C(=N/O)C1=CSC=C1 BB_SC-12250 [0,1,0,0,1,0|2,0,0]=4 203 B9R1.35 CC(=O)C1=CC=C(Br)S1 BB_SC-04749 [0,1,0,0,1,0|2,0,0]=4 204 B9R1.35 CC(=O)C1=CC=C(C)O1 BB_SC-05466 [0,1,0,0,1,0|2,0,0]=4 205 B9R1.35 CC1=CC(C(=O)O)=NO1 BB_SC-09038 [0,1,0,0,1,0|2,0,0]=4 206 B9R1.35 CC1=NC(C(=O)O)=CO1 BB_SC-07364 [0,1,0,0,1,0|2,0,0]=4 207 B9R1.35 CC1=NNC(C(=O)O)=C1 BB_SC-01241 [0,1,0,0,1,0|2,0,0]=4 208 B9R1.35 CC1=NOC(C(=O)O)=C1 BB_SC-09172 [0,1,0,0,1,0|2,0,0]=4 209 B9R1.35 CN1C=C(C(=O)O)C=N1 BB_SC-06364 [0,1,0,0,1,0|2,0,0]=4 210 B9R1.35 CN1C=CC(C(=O)O)=N1 BB_SC-06189 [0,1,0,0,1,0|2,0,0]=4 211 B9R1.35 O=C(O)C1=CC(Cl)=NO1 BB_SC-10605 [0,1,0,0,1,0|2,0,0]=4 212 B9R1.35 O=C(O)C1=CC=C(Br)O1 BB_SC-03350 [0,1,0,0,1,0|1,0,0]=3 213 B9R1.35 O=C(O)C1=CN=C(Br)S1 BB_SC-05194 [0,1,0,0,1,0|2,0,0]=4 214 B9R1.35 O=C(O)C1=CSC(Br)=N1 BB_SC-05193 [0,1,0,0,1,0|2,0,0]=4 215 B9R1.35 O=C1C=C(C(=O)O)NN1 BB_SC-04251 [0,1,0,0,1,0|2,0,0]=4 216 B9R1.41 CC1=C(C(=O)O)C=NN1 BB_SC-06431 [0,1,0,0,1,0|2,0,0]=4 217 B9R1.41 CN1N=CC=C1C(=O)O BB_SC-06188 [0,1,0,0,1,0|2,0,0]=4 218 B9R1.41 O=C(O)C1=C(Cl)C=NN1 BB_SC-08463 [0,1,0,0,1,0|2,0,0]=4 219 B9R1.41 O=C(O)C1=C(I)C=NN1 BB_SC-10159 [0,1,0,0,1,0|2,0,0]=4 220 B9R1.41 O=C(O)C1=NNC=C1Br BB_SC-03756 [0,1,0,0,1,0|2,0,0]=4 221 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 BB_SC-07000 [0,1,0,0,0,1|1,0,0]=3 222 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 BB_SC-07122 [0,1,0,0,0,1|1,0,0]=3 223 B11R1.20 CC1=CC=C(NC(=S)[S-])C=C1 BB_SC-09418 [0,1,0,0,0,1|0,2,0]=4 224 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 BB_NC-02327 [0,1,0,0,0,1|1,0,0]=3 225 B11R1.20 NC(=S)NC1=CC=C(O)C=C1 BB_SC-06050 [0,1,0,0,0,1|1,1,0]=4 226 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB_NC-00007 [0,1,0,0,0,1|0,0,0]=2 227 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 BB_SC-07389 [0,1,0,0,0,1|0,0,0]=2 228 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 BB_NC-02267 [0,1,0,0,0,1|0,0,0]=2 229 B11R1.36 NC(C(=O)Cl)C1=CC=CC=C1 BB_NC-00460 [0,1,0,0,0,1|1,0,0]=3 230 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 BB_NC-00505 [0,1,0,0,0,1|0,0,0]=2 231 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 BB_NC-02227 [0,1,0,0,0,1|0,0,0]=2 232 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 BB_NC-02315 [0,1,0,0,0,1|0,0,0]=2 233 B11R1.40 COC(=O)CC1=CC=CC=C1 BB_SC-07169 [0,1,0,0,0,1|0,0,0]=2 234 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 BB_NC-02262 [0,1,0,0,0,1|1,0,0]=3 235 B11R1.40 NCC(=O)NC1=CC=NC=C1 BB_SC-08973 [0,1,0,0,0,1|2,0,0]=4 236 B11R1.40 NCC(=O)NC1=NC=CC=C1 BB_SC-08972 [0,1,0,0,0,1|2,0,0]=4 237 B11R1.40 N\C(CC1=CC=CC=C1)=N/O BB_SC-09060 [0,1,0,0,0,1|1,0,0]=3 238 B11R1.40 O=C(CS)NC1=CC=CC=C1 BB_SC-00267 [0,1,0,0,0,1|0,1,0]=3 239 B11R1.40 [C@H](N)(CO)CC1=CC=CC=C1 BB_SC-02103 [0,1,0,0,0,1|1,0,1]=4 240 B11R1.86 NC(=S)NC1=CC=CC=C1O BB_SC-05847 [0,1,0,0,0,1|1,1,0]=4 241 B11R1.86 O=C(O)CN1C=CC=CC1=O BB_NC-01632 [0,1,0,0,0,1|1,0,0]=3 242 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 BB_SC-04170 [0,1,0,0,0,1|1,0,0]=3 243 B11R1.157 NC(=O)CC1=CC=CC(N)=C1 BB_SC-07736 [0,1,0,0,0,1|1,0,0]=3 244 B11R1.157 NC(=O)NC1=CC=CC(O)=C1 BB_SC-05538 [0,1,0,0,0,1|1,0,0]=3 245 B11R1.509 O=S(=O)(Cl)CC1=CC=CC=C1 BB_SC-06603 [0,1,0,0,0,1|1,0,1]=4 246 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 BB_SC-06916 [0,2,0,0,0,0|1,0,0]=3 247 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 BB_SC-06870 [0,2,0,0,0,0|0,0,0]=2 248 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 BB_SC-07129 [0,2,0,0,0,0|1,0,0]=3 249 B11R1.3 CN(O)C1=CC=C(C=O)C=C1 BB_SC-03089 [0,2,0,0,0,0|2,0,0]=4 250 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 BB_SC-06994 [0,2,0,0,0,0|1,0,0]=3 251 B11R1.3 COC1=CC=C(C(=O)O)C=N1 BB_SC-04906 [0,2,0,0,0,0|1,0,0]=3 252 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 BB_SC-02991 [0,2,0,0,0,0|1,0,0]=3 253 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 BB_NC-00019 [0,2,0,0,0,0|0,0,0]=2 254 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 BB_SC-05430 [0,2,0,0,0,0|0,0,0]=2 255 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 BB_SC-05597 [0,2,0,0,0,0|0,0,0]=2 256 B11R1.3 O=CC1=CC=C([N+](=O)[O-])C=C1 BB_SC-09446 [0,2,0,0,0,0|1,0,1]=4 257 B11R1.3 O=[N+]([O-])C1=CC=C(CCl)C=C1 BB_SC-06968 [0,2,0,0,0,0|1,0,1]=4 258 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 BB_SC-07049 [0,2,0,0,0,0|1,0,0]=3 259 B11R1.19 NC1=CC=C(S(N)(=O)=O)C=C1 BB_SC-01483 [0,2,0,0,0,0|1,0,1]=4 260 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)C=C1 BB_SC-06995 [0,2,0,0,0,0|1,0,1]=4 261 B11R1.19 O=S(=O)(Cl)C1=CC=C(Cl)C=C1 BB_SC-07004 [0,2,0,0,0,0|1,0,1]=4 262 B11R1.19 O=S(=O)(Cl)C1=CC=C(F)C=C1 BB_SC-06557 [0,2,0,0,0,0|1,0,1]=4 263 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 BB_SC-06208 [0,2,0,0,0,0|0,0,0]=2 264 B11R1.21 CC1=C(N)C=CC([N+](=O)[O-])=C1 BB_SC-06742 [0,2,0,0,0,0|1,0,1]=4 265 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1N BB_SC-06745 [0,2,0,0,0,0|1,0,1]=4 266 B11R1.21 CC1=CN=C(C(=O)O)C=[N+]1[O-] BB_SC-02776 [0,2,0,0,0,0|2,0,0]=4 267 B11R1.21 CN1N=C(C(=O)O)C=CC1=O BB_SC-05030 [0,2,0,0,0,0|2,0,0]=4 268 B11R1.21 NC(=O)C1=CC=C(Cl)C(N)=C1 BB_SC-07921 [0,2,0,0,0,0|1,0,0]=3 269 B11R1.21 NC(=O)C1=CC=C(F)C(N)=C1 BB_SC-10911 [0,2,0,0,0,0|1,0,0]=3 270 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 BB_SC-09640 [0,2,0,0,0,0|0,0,0]=2 271 B11R1.21 NC1=C(O)C=CC([N+](=O)[O-])=C1 BB_SC-01352 [0,2,0,0,0,0|1,0,1]=4 272 B11R1.21 NC1=CC(C(=O)O)=CC=C1F BB_SC-10660 [0,2,0,0,0,0|0,0,0]=2 273 B11R1.21 NC1=CC([N+](=O)[O-])=CC=C1Cl BB_SC-07018 [0,2,0,0,0,0|1,0,1]=4 274 B11R1.21 NC1=CC=C(C(=O)O)C=C1N BB_SC-02405 [0,2,0,0,0,0|0,0,0]=2 275 B11R1.21 NC1=CC=C(C(=O)O)C=C1S BB_SC-05037 [0,2,0,0,0,0|0,0,0]=2 276 B11R1.21 NC1=CC=C([N+](=O)[O-])C=C1Br BB_SC-02912 [0,2,0,0,0,0|1,0,1]=4 277 B11R1.21 NC1=CC=C([N+](=O)[O-])C=C1O BB_SC-06686 [0,2,0,0,0,0|1,0,1]=4 278 B11R1.21 O=C(Cl)C1=CC(F)=C(F)C=C1 BB_SC-10725 [0,2,0,0,0,0|1,0,0]=3 279 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 BB_SC-03271 [0,2,0,0,0,0|0,0,0]=2 280 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 BB_SC-03262 [0,2,0,0,0,0|0,0,0]=2 281 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 BB_SC-04580 [0,2,0,0,0,0|0,0,0]=2 282 B11R1.21 O=C(O)C1=CC=C(F)C(F)=C1 BB_SC-04572 [0,2,0,0,0,0|0,0,0]=2 283 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 BB_NC-02256 [0,2,0,0,0,0|0,0,0]=2 284 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 BB_SC-06931 [0,2,0,0,0,0|1,0,0]=3 285 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 BB_SC-06905 [0,2,0,0,0,0|1,0,0]=3 286 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 BB_SC-07445 [0,2,0,0,0,0|1,0,0]=3 287 B11R1.22 COC(=O)C1=CC=C(O)C=C1 BB_NC-02783 [0,2,0,0,0,0|0,0,0]=2 288 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 BB_SC-11368 [0,2,0,0,0,0|1,0,0]=3 289 B11R1.22 NCC(O)C1=CC=C(O)C=C1 BB_NC-01337 [0,2,0,0,0,0|1,0,1]=4 290 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 BB_SC-00086 [0,2,0,0,0,0|1,0,0]=3 291 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 BB_SC-06259 [0,2,0,0,0,0|1,0,0]=3 292 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 BB_SC-12258 [0,2,0,0,0,0|1,0,0]=3 293 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 BB_SC-07012 [0,2,0,0,0,0|1,0,0]=3 294 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 BB_SC-06991 [0,2,0,0,0,0|1,0,0]=3 295 B11R1.166 CC(=O)C1=CC=C(N)C=C1O BB_SC-08749 [0,2,0,0,0,0|1,0,0]=3 296 B11R1.166 CC(=O)C1=CC=C(O)C=C1O BB_SC-06691 [0,2,0,0,0,0|1,0,0]=3 297 B11R1.166 CC1=C([N+](=O)[O-])C=CC(O)=C1 BB_SC-07126 [0,2,0,0,0,0|1,0,1]=4 298 B11R1.166 CC1=CC=C(C(=O)O)C(=O)N1 BB_SC-10587 [0,2,0,0,0,0|1,0,0]=3 299 B11R1.166 CC1=CC=C(C(N)=O)C(Cl)=N1 BB_SC-11357 [0,2,0,0,0,0|2,0,0]=4 300 B11R1.166 CC1=NC(N)=NC=C1C(=O)O BB_SC-08707 [0,2,0,0,0,0|2,0,0]=4 301 B11R1.166 NC(=O)C1=CC=C(N)C=C1Cl BB_SC-07355 [0,2,0,0,0,0|1,0,0]=3 302 B11R1.166 NC1=NC(=O)NC=C1C(=O)O BB_NC-00362 [0,2,0,0,0,0|2,0,0]=4 303 B11R1.166 NC1=NC(S)=NC=C1C(=O)O BB_SC-08058 [0,2,0,0,0,0|2,0,0]=4 304 B11R1.166 NC1=NC=C(C(=O)O)C(=O)N1 BB_NC-02545 [0,2,0,0,0,0|2,0,0]=4 305 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 BB_SC-10701 [0,2,0,0,0,0|0,0,0]=2 306 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl BB_SC-03001 [0,2,0,0,0,0|1,0,0]=3 307 B11R1.166 O=C(O)C1=CC=C(O)C=C1O BB_NC-02190 [0,2,0,0,0,0|0,0,0]=2 308 B11R1.166 O=C(O)C1=CN=C(O)N=C1O BB_NC-02188 [0,2,0,0,0,0|2,0,0]=4 309 B11R1.166 O=[N+]([O-])C1=CC=C(F)C=C1O BB_SC-08901 [0,2,0,0,0,0|1,0,1]=4 310 B11R1.7 O=S(=O)([N-]Cl)C1=CC=CC=C1 BB_SC-06582 [0,2,0,0,0,0|1,0,1]=4 311 B11R1.16 CCCC(=O)C1=CC=CC=C1 BB_SC-06998 [0,2,0,0,0,0|1,0,0]=3 312 B11R1.16 CCOC(=O)C1=CC=CC=C1 BB_SC-07029 [0,2,0,0,0,0|0,0,0]=2 313 B11R1.16 CCOC(=O)C1=CC=NC=C1 BB_SC-06515 [0,2,0,0,0,0|1,0,0]=3 314 B11R1.16 CCOC(=O)C1=NC=CC=C1 BB_SC-12669 [0,2,0,0,0,0|1,0,0]=3 315 B11R1.16 N#CCC(=O)C1=CC=CC=C1 BB_SC-05743 [0,2,0,0,0,0|1,0,0]=3 316 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 BB_SC-06986 [0,2,0,0,0,0|1,0,0]=3 317 B11R1.23 CNC(=O)C1=CC(Cl)=NC=C1 BB_SC-09888 [0,2,0,0,0,0|2,0,0]=4 318 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 BB_SC-07457 [0,2,0,0,0,0|1,0,0]=3 319 B11R1.23 CNC(=O)C1=NC(Cl)=CC=C1 BB_SC-07528 [0,2,0,0,0,0|2,0,0]=4 320 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 BB_SC-09886 [0,2,0,0,0,0|1,0,0]=3 321 B11R1.23 COC(=O)C1=CC=CC(Cl)=N1 BB_SC-06671 [0,2,0,0,0,0|1,0,0]=3 322 B11R1.23 NC1=CC=CC(\C(N)=N\O)=C1 BB_SC-10559 [0,2,0,0,0,0|1,0,0]=3 323 B11R1.23 NCC(O)C1=CC(O)=CC=C1 BB_NC-02015 [0,2,0,0,0,0|1,0,1]=4 324 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 BB_SC-06886 [0,2,0,0,0,0|1,0,0]=3 325 B11R1.222 CNC(=O)C1=CC=CC=C1O BB_SC-00487 [0,2,0,0,0,0|1,0,0]=3 326 B11R1.222 COC(=O)C1=CC=CC=C1N BB_SC-02799 [0,2,0,0,0,0|0,0,0]=2 327 B11R1.222 COC(=O)C1=CC=CC=C1O BB_SC-07170 [0,2,0,0,0,0|0,0,0]=2 328 B11R1.222 COC(=O)C1=CC=CN=C1N BB_SC-05275 [0,2,0,0,0,0|1,0,0]=3 329 B11R1.222 COC(=O)C1=NC=CN=C1N BB_SC-03277 [0,2,0,0,0,0|2,0,0]=4 330 B11R1.222 NNC(=O)C1=C(O)C=CC=C1 BB_SC-00083 [0,2,0,0,0,0|1,0,0]=3 331 B11R1.222 N\C(=N/O)C1=C(Cl)C=CC=C1 BB_SC-12270 [0,2,0,0,0,0|1,0,0]=3 332 B11R1.222 N\C(=N/O)C1=C(F)C=CC=C1 BB_SC-12261 [0,2,0,0,0,0|1,0,0]=3 333 B11R1.87 O=S(=O)(Cl)C1=CC=CC=C1F BB_SC-09612 [0,2,0,0,0,0|1,0,1]=4 334 B11R1.155 NC1=CC=CC(S(N)(=O)=O)=C1 BB_SC-08464 [0,2,0,0,0,0|1,0,1]=4 335 B11R1.155 O=S(=O)(Cl)C1=CC=CC(F)=C1 BB_SC-07347 [0,2,0,0,0,0|1,0,1]=4 336 B11R1.53 CNC1=C(C(=O)O)C=CC=C1 BB_NC-02268 [0,2,0,0,0,0|0,0,0]=2 337 B11R1.53 COC1=C(C(=O)O)C=CC=C1 BB_SC-12471 [0,2,0,0,0,0|0,0,0]=2 338 B11R1.53 COC1=CC=CC=C1C(C)=O BB_SC-06447 [0,2,0,0,0,0|1,0,0]=3 339 B11R1.53 COC1=NC=CC=C1C(=O)O BB_NC-02512 [0,2,0,0,0,0|1,0,0]=3 340 B11R1.53 NNC1=C(C(=O)O)C=CC=C1 BB_SC-05512 [0,2,0,0,0,0|0,0,0]=2 341 B11R1.53 O=CC1=CC=CC=C1C(=O)O BB_SC-06206 [0,2,0,0,0,0|0,0,0]=2 342 B11R1.53 O=CC1=CC=CC=C1[N+](=O)[O-] BB_SC-07125 [0,2,0,0,0,0|1,0,1]=4 343 B11R1.156 O=C(Cl)C1=C(Cl)C=CC=C1Cl BB_SC-10723 [0,2,0,0,0,0|1,0,0]=3 344 B11R1.156 O=C(Cl)C1=C(F)C=CC=C1F BB_SC-04581 [0,2,0,0,0,0|1,0,0]=3 345 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl BB_SC-04569 [0,2,0,0,0,0|0,0,0]=2 346 B11R1.156 O=C(O)C1=C(F)C=CC=C1F BB_SC-00376 [0,2,0,0,0,0|0,0,0]=2 347 B11R1.156 O=C(O)C1=C(O)C=CC=C1O BB_SC-02393 [0,2,0,0,0,0|0,0,0]=2 348 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 BB_SC-10700 [0,2,0,0,0,0|0,0,0]=2 349 B11R1.159 O=C(O)C1=CC=NC(Cl)=C1F BB_SC-09568 [0,2,0,0,0,0|1,0,0]=3 350 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 BB_SC-06880 [0,2,0,0,0,0|1,0,0]=3 351 B11R1.167 CC(=O)C1=CC(N)=CC=C1O BB_NC-02592 [0,2,0,0,0,0|1,0,0]=3 352 B11R1.167 CC(=O)C1=CC(O)=CC=C1O BB_SC-06838 [0,2,0,0,0,0|1,0,0]=3 353 B11R1.167 NC(=O)C1=C(Cl)C=CC(N)=C1 BB_SC-07661 [0,2,0,0,0,0|1,0,0]=3 354 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl BB_SC-07846 [0,2,0,0,0,0|2,0,0]=4 355 B11R1.167 NC(=O)C1=CC(N)=CC=C1F BB_SC-10746 [0,2,0,0,0,0|1,0,0]=3 356 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 BB_SC-02770 [0,2,0,0,0,0|0,0,0]=2 357 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 BB_SC-05514 [0,2,0,0,0,0|0,0,0]=2 358 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 BB_SC-02782 [0,2,0,0,0,0|0,0,0]=2 359 B11R1.167 NC1=CC(C(=O)O)=C(O)C=C1 BB_NC-00015 [0,2,0,0,0,0|0,0,0]=2 360 B11R1.167 NC1=CC([N+](=O)[O-])=C(Cl)C=C1 BB_SC-06975 [0,2,0,0,0,0|1,0,1]=4 361 B11R1.167 NC1=CC=C(Br)C=C1C(=O)O BB_SC-02779 [0,2,0,0,0,0|0,0,0]=2 362 B11R1.167 NC1=CC=C(Cl)C(C(=O)O)=C1 BB_SC-10834 [0,2,0,0,0,0|0,0,0]=2 363 B11R1.167 NC1=CC=C(F)C(C(=O)O)=C1 BB_SC-10837 [0,2,0,0,0,0|0,0,0]=2 364 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 BB_SC-04571 [0,2,0,0,0,0|0,0,0]=2 365 B11R1.167 O=C(O)C1=C(Cl)C=CC(F)=C1 BB_SC-06258 [0,2,0,0,0,0|0,0,0]=2 366 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 BB_SC-04573 [0,2,0,0,0,0|0,0,0]=2 367 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 BB_NC-02255 [0,2,0,0,0,0|0,0,0]=2 368 B11R1.167 O=C(O)C1=CC(Br)=CC=C1O BB_SC-06654 [0,2,0,0,0,0|0,0,0]=2 369 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O BB_SC-04655 [0,2,0,0,0,0|1,0,0]=3 370 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Cl BB_SC-02559 [0,2,0,0,0,0|1,0,0]=3 371 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CC=C1F BB_SC-04596 [0,2,0,0,0,0|1,0,1]=4 372 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 BB_SC-06878 [0,2,0,0,0,0|1,0,0]=3 373 B11R1.74 CC1=CC(C(=O)O)=CC(=O)N1 BB_SC-09506 [0,2,0,0,0,0|1,0,0]=3 374 B11R1.74 CC1=NC(O)=NC(C(=O)O)=C1 BB_SC-10583 [0,2,0,0,0,0|2,0,0]=4 375 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 BB_SC-04570 [0,2,0,0,0,0|0,0,0]=2 376 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 BB_NC-02257 [0,2,0,0,0,0|0,0,0]=2 377 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 BB_NC-01990 [0,2,0,0,0,0|1,0,0]=3 378 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 BB_NC-02208 [0,2,0,0,0,0|2,0,0]=4 379 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 BB_NC-02936 [0,2,0,0,0,0|2,0,0]=4 380 B11R1.266 COC1=CC(C(C)=O)=CC=C1 BB_SC-06240 [0,2,0,0,0,0|1,0,0]=3 381 B11R1.266 COC1=NC=CC(C(=O)O)=C1 BB_SC-04908 [0,2,0,0,0,0|1,0,0]=3 382 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 BB_SC-03750 [0,2,0,0,0,0|0,0,0]=2 383 B11R1.266 O=CC1=CC([N+](=O)[O-])=CC=C1 BB_SC-09047 [0,2,0,0,0,0|1,0,1]=4 384 B9R1.13 O=C(O)CC1=CSC=C1 BB_SC-11479 [0,0,1,1,0,0|1,0,1]=4 385 B11R2.10 CC1=NC2=C(C=CC=C2)N1 BB_SC-06895 [0,0,0,1,0,1|2,0,0]=4 386 B11R2.10 ClC1=NC2=CC=CC=C2N1 BB_SC-01597 [0,0,0,1,0,1|2,0,0]=4 387 B11R2.10 NC1=NC2=C(C=CC=C2)S1 BB_SC-10670 [0,0,0,1,0,1|1,1,0]=4 388 B11R2.10 NC1=NC2=CC=CC=C2N1 BB_SC-03294 [0,0,0,1,0,1|2,0,0]=4 389 B11R2.10 O=C1CC2=C(C=CC=C2)N1 BB_SC-04787 [0,0,0,1,0,1|1,0,0]=3 390 B11R2.10 O=C1NC2=C(C=CC=C2)O1 BB_NC-02706 [0,0,0,1,0,1|0,0,0]=2 391 B11R2.10 O=C1NC2=C(N=CC=C2)N1 BB_SC-05250 [0,0,0,1,0,1|2,0,0]=4 392 B11R2.10 SC1=NC2=C(C=CC=C2)N1 BB_SC-06650 [0,0,0,1,0,1|1,1,0]=4 393 B11R2.10 SC1=NC2=C(C=CC=C2)O1 BB_SC-00261 [0,0,0,1,0,1|0,1,0]=3 394 B11R2.10 SC1=NC2=CC=CC=C2S1 BB_SC-05553 [0,0,0,1,0,1|0,2,0]=4 395 B11R2.1 ClC1=NSC2=C1C=CC=C2 BB_SC-01606 [0,1,0,1,0,0|1,1,0]=4 396 B11R2.1 NC1=C2C=CC=CC2=NS1 BB_SC-05820 [0,1,0,1,0,0|1,1,0]=4 397 B11R2.1 NC1=NCC2=C1C=CC=C2 BB_SC-00005 [0,1,0,1,0,0|2,0,0]=4 398 B11R2.1 NC1=NOC2=NC=CC=C12 BB_SC-09555 [0,1,0,1,0,0|2,0,0]=4 399 B11R2.1 O=C1OCC2=C1C=CC=C2 BB_SC-05507 [0,1,0,1,0,0|0,0,0]=2 400 B7R1.1 O=CC1=CC=CN1 BB_SC-04628 [1,0,0,0,1,0|1,0,0]=3 401 B7R1.1 O=CC1=CC=CS1 BB_SC-11213 [1,0,0,0,1,0|1,0,0]=3 402 B7R1.1 O=CC1=CNC=N1 BB_SC-12411 [1,0,0,0,1,0|2,0,0]=4 403 B7R1.1 O=CC1=CSC=C1 BB_SC-09203 [1,0,0,0,1,0|1,0,0]=3 404 B11R1.91 CC(=O)CCC1=CC=CC=C1 BB_SC-06936 [0,0,0,0,0,2|1,0,0]=3 405 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 BB_SC-12727 [0,0,0,0,0,2|1,0,0]=3 406 B11R1.91 CC(O)C#CC1=CC=CC=C1 BB_SC-02013 [0,0,0,0,0,2|1,0,1]=4 407 B11R1.91 NC(=O)NCC1=CC=CC=C1 BB_SC-06484 [0,0,0,0,0,2|1,0,0]=3 408 B11R1.91 NC(=S)NNC1=CC=CC=C1 BB_SC-06579 [0,0,0,0,0,2|1,1,0]=4 409 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 BB_SC-07201 [0,0,0,0,0,2|1,0,0]=3 410 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 BB_SC-06780 [0,0,0,0,0,2|1,0,0]=3 411 B11R1.91 O=C(O)C#CC1=CC=CC=C1 BB_SC-06586 [0,0,0,0,0,2|0,0,0]=2 412 B11R1.91 O=C(O)CCC1=CC=CC=C1 BB_NC-02055 [0,0,0,0,0,2|0,0,0]=2 413 B11R1.91 O=C(O)CNC1=CC=CC=C1 BB_NC-02642 [0,0,0,0,0,2|0,0,0]=2 414 B11R1.91 O=C(O)CNC1=NC=CC=N1 BB_NC-02112 [0,0,0,0,0,2|2,0,0]=4 415 B11R1.91 O=C(O)COC1=CC=CC=C1 BB_SC-06261 [0,0,0,0,0,2|0,0,0]=2 416 B11R1.91 O=C(O)COC1=CC=CN=C1 BB_SC-06065 [0,0,0,0,0,2|1,0,0]=3 417 B11R1.91 O=C(O)CSC1=NC=CC=N1 BB_SC-06233 [0,0,0,0,0,2|2,0,0]=4 418 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 BB_SC-12379 [0,0,0,0,0,2|0,0,0]=2 419 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 BB_SC-03070 [0,0,0,0,0,2|1,0,0]=3