0 B8R1.2 C=CC1=CC=CN=C1 BCP12214 [0,0,0,0,0,0|2,0,1]=3 1 B8R1.2 NCC1=CC=CN=C1 BCP13872 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.2 NCC1=NC=CC=N1 BCP00118 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.2 NCC1=NN=CC=C1 BCP04627 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.2 OCC1=CC=CN=C1 BCP20084 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.2 OCC1=CN=CN=C1 BCP04747 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.2 [Na]SC1=CC=CC=C1 BCP14418 [0,0,0,0,0,0|3,1,0]=4 7 B7R1.3 CC1=CC=CC=C1 BCP16202 [1,0,0,0,0,0|2,0,0]=3 8 B7R1.3 ClC1=NC=NC=C1 BCP05785 [1,0,0,0,0,0|3,0,0]=4 9 B7R1.3 FC1=CN=CC=N1 BCP03206 [1,0,0,0,0,0|1,0,0]=2 10 B7R1.3 NC1=NC=CN=C1 BCP13854 [1,0,0,0,0,0|1,0,0]=2 11 B7R1.3 NC1=NC=CN=N1 BCP17595 [1,0,0,0,0,0|2,0,0]=3 12 B7R1.3 NC1=NC=NC=C1 BCP06825 [1,0,0,0,0,0|3,0,0]=4 13 B7R1.3 NC1=NN=CC=C1 BCP13988 [1,0,0,0,0,0|3,0,0]=4 14 B7R1.3 O=C1C=CC=NN1 BCP04620 [1,0,0,0,0,0|2,0,1]=4 15 B7R1.3 O=C1C=CNC=N1 BCP13987 [1,0,0,0,0,0|2,0,1]=4 16 B7R1.3 OC1=CC=NC=C1 BCP08909 [1,0,0,0,0,0|3,0,0]=4 17 B7R1.3 OC1=NC=CC=N1 BCP01070 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.1 BrC1=CN=C(N=C1)SC BCP16809 [0,1,0,0,0,0|2,1,0]=4 19 B9R1.1 C1=C(N=CC(=C1)Br)C#N BCP00485 [0,1,0,0,0,0|3,0,0]=4 20 B9R1.1 CC1=CC=C(C=N1)C=O BCP04829 [0,1,0,0,0,0|3,0,0]=4 21 B9R1.1 COC1=CN=C(Br)C=C1 BCP04838 [0,1,0,0,0,0|1,0,0]=2 22 B9R1.1 CSC1=CN=C(Br)C=N1 BCP07668 [0,1,0,0,0,0|0,1,0]=2 23 B9R1.1 ClC1=CC=C(CN)C=N1 BCP19252 [0,1,0,0,0,0|3,0,0]=4 24 B9R1.1 N#CC1=CC=C(N=C1)N BCP03163 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.1 N#CC1=CN=C(Cl)C=C1 BCP11416 [0,1,0,0,0,0|3,0,0]=4 26 B9R1.1 NCC1=NC=C(C)N=C1 BCP14024 [0,1,0,0,0,0|2,0,0]=3 27 B9R1.1 NNC1=NC=C(Cl)C=C1 BCP15596 [0,1,0,0,0,0|3,0,0]=4 28 B9R1.1 O=CC1=CN=C(C=C1)Br BCP04709 [0,1,0,0,0,0|3,0,0]=4 29 B9R1.1 O=CC1=NC=C(Br)C=C1 BCP14421 [0,1,0,0,0,0|3,0,0]=4 30 B9R1.1 O=CC1=NC=C(F)C=C1 BCP10413 [0,1,0,0,0,0|3,0,0]=4 31 B9R1.1 OCC1=CC=C(C)N=C1 BCP15437 [0,1,0,0,0,0|3,0,0]=4 32 B9R1.2 CC1=CN=CC(CCl)=C1 BCP15251 [0,1,0,0,0,0|3,0,0]=4 33 B9R1.2 CNC1=CC=CC(Cl)=N1 BCP10999 [0,1,0,0,0,0|2,0,0]=3 34 B9R1.2 COC1=CC=NC(Cl)=C1 BCP09377 [0,1,0,0,0,0|3,0,0]=4 35 B9R1.2 COC1=NC=CC(I)=C1 BCP10195 [0,1,0,0,0,0|1,0,0]=2 36 B9R1.2 COC1=NC=CC(N)=C1 BCP05654 [0,1,0,0,0,0|1,0,0]=2 37 B9R1.2 ClC1=CC(NC)=NC=N1 BCP10052 [0,1,0,0,0,0|3,0,0]=4 38 B9R1.2 FC1=CC=CC(CBr)=N1 BCP17087 [0,1,0,0,0,0|3,0,0]=4 39 B9R1.2 NC1=NC(=CN=C1)OC BCP09100 [0,1,0,0,0,0|0,0,0]=1 40 B9R1.2 O=C1C=C(OC)C=NN1 BCP20543 [0,1,0,0,0,0|2,0,0]=3 41 B9R1.2 O=CC1=CC=CC(N)=N1 BCP14417 [0,1,0,0,0,0|3,0,0]=4 42 B9R1.2 O=CC1=NC(Br)=CC=C1 BCP14423 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.2 OCC1=CC(C)=CN=C1 BCP16511 [0,1,0,0,0,0|3,0,0]=4 44 B9R1.6 NC(C1=CC=CN=C1)=O BCP07322 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.6 N[C](C)C1=CC=CC=C1 BCP13697 [0,1,0,0,0,0|3,0,0]=4 46 B9R1.6 O=C(O)C1=CN=CC=C1 BCP16301 [0,1,0,0,0,0|3,0,0]=4 47 B9R1.6 O[C](C)C1=NC=CC=C1 BCP18401 [0,1,0,0,0,0|2,0,0]=3 48 B9R1.8 BrCCC1=CC=CN=C1 BCP07727 [0,1,0,0,0,0|2,0,0]=3 49 B9R1.15 C1=CC=NC(=C1C)C#N BCP16112 [0,1,0,0,0,0|3,0,0]=4 50 B9R1.15 CNC1=CC=CC=C1N BCP19652 [0,1,0,0,0,0|3,0,0]=4 51 B9R1.15 ClC1=C(C=O)C=CC=N1 BCP08292 [0,1,0,0,0,0|3,0,0]=4 52 B9R1.15 ClC1=C(NN)N=CC=C1 BCP15445 [0,1,0,0,0,0|3,0,0]=4 53 B9R1.15 ClC1=NC=CC=C1C#N BCP03202 [0,1,0,0,0,0|3,0,0]=4 54 B9R1.15 FC1=CC=CN=C1CO BCP15521 [0,1,0,0,0,0|3,0,0]=4 55 B9R1.15 N#CC1=NC=CC=C1F BCP07099 [0,1,0,0,0,0|3,0,0]=4 56 B9R1.15 NC1=NC=CC=C1CC BCP11445 [0,1,0,0,0,0|2,0,0]=3 57 B9R1.15 NC1=NC=CC=C1OC BCP12904 [0,1,0,0,0,0|1,0,0]=2 58 B9R1.15 NCc1nccnc1Cl BCP20593 [0,1,0,0,0,0|2,0,0]=3 59 B9R1.15 OC1=CC=CN=C1CO BCP11425 [0,1,0,0,0,0|3,0,0]=4 60 B9R1.15 OCC1=NC=CC=C1O BCP14980 [0,1,0,0,0,0|3,0,0]=4 61 B7R1.1 BrCC1=CC=CS1 BCP05380 [0,0,0,0,1,0|3,0,0]=4 62 B7R1.1 BrCC1=CC=NO1 BCP11397 [0,0,0,0,1,0|3,0,0]=4 63 B7R1.1 CCC1=CC=CN1 BCP04114 [0,0,0,0,1,0|1,0,1]=3 64 B7R1.1 ClCC1=CN=CN1 BCP14266 [0,0,0,0,1,0|2,0,1]=4 65 B7R1.1 ClCC1=NC=CO1 BCP11468 [0,0,0,0,1,0|3,0,0]=4 66 B7R1.1 NCC1=CC=NO1 BCP11419 [0,0,0,0,1,0|3,0,0]=4 67 B7R1.1 NCC1=NC=CO1 BCP04231 [0,0,0,0,1,0|3,0,0]=4 68 B7R1.1 NCC1=NC=CO1 BCP16393 [0,0,0,0,1,0|3,0,0]=4 69 B7R1.1 NCC1=NC=CS1 BCP10504 [0,0,0,0,1,0|3,0,0]=4 70 B7R1.1 O=CC1=CC=CN1 BCP13856 [0,0,0,0,1,0|2,0,1]=4 71 B7R1.1 O=CC1=CNC=C1 BCP05260 [0,0,0,0,1,0|2,0,1]=4 72 B7R1.1 O=CC1=CNC=N1 BCP04813 [0,0,0,0,1,0|2,0,1]=4 73 B7R1.1 O=CC1=CSC=N1 BCP07009 [0,0,0,0,1,0|3,0,0]=4 74 B7R1.1 OCC1=CC=NO1 BCP11418 [0,0,0,0,1,0|3,0,0]=4 75 B7R1.1 OCc1cnco1 BCP16363 [0,0,0,0,1,0|3,0,0]=4 76 B6R1.1 C1=CC=CN=C1 BCP06413 [2,0,0,0,0,0|1,0,0]=3 77 B6R1.1 C1=NC=CC=C1 BCP10411 [2,0,0,0,0,0|1,0,0]=3 78 B8R1.3 BrC1=CN=C(Br)C=N1 BCP11180 [1,1,0,0,0,0|1,0,0]=3 79 B8R1.3 BrC1=CN=C(C)C=C1 BCP13752 [1,1,0,0,0,0|1,0,0]=3 80 B8R1.3 BrC1=CN=C(C)N=C1 BCP10084 [1,1,0,0,0,0|2,0,0]=4 81 B8R1.3 CC1=CC=C(Cl)N=C1 BCP19250 [1,1,0,0,0,0|1,0,0]=3 82 B8R1.3 CC1=CN=C(C)C=N1 BCP08618 [1,1,0,0,0,0|0,0,0]=2 83 B8R1.3 CC1=CN=C(Cl)C=N1 BCP18846 [1,1,0,0,0,0|0,0,0]=2 84 B8R1.3 ClC1=CN=C(C=C1)I BCP11362 [1,1,0,0,0,0|2,0,0]=4 85 B8R1.3 FC1=CC=C(C)N=C1 BCP05119 [1,1,0,0,0,0|1,0,0]=3 86 B8R1.3 NC1=CC=C(C)N=C1 BCP05413 [1,1,0,0,0,0|1,0,0]=3 87 B8R1.3 NC1=NC=C(Br)N=N1 BCP20604 [1,1,0,0,0,0|2,0,0]=4 88 B8R1.3 NC=1C=CC(=CN1)C BCP16835 [1,1,0,0,0,0|1,0,0]=3 89 B8R1.3 O=C1C=CC(C)=CN1 BCP20199 [1,1,0,0,0,0|1,0,1]=4 90 B8R1.3 O=C1C=NC(C)=CN1 BCP16191 [1,1,0,0,0,0|0,0,1]=3 91 B8R1.3 OC1=CC=C(Br)C=C1 BCP17755 [1,1,0,0,0,0|2,0,0]=4 92 B8R1.3 OC1=CC=C(I)C=C1 BCP14445 [1,1,0,0,0,0|2,0,0]=4 93 B8R1.4 BrC1=CC=NC(O)=C1 BCP01174 [1,1,0,0,0,0|1,0,0]=3 94 B8R1.4 BrC1=CN=CC(Br)=C1 BCP07788 [1,1,0,0,0,0|2,0,0]=4 95 B8R1.4 BrC1=NC=NC(=C1)C BCP06890 [1,1,0,0,0,0|2,0,0]=4 96 B8R1.4 C1=C(C=NC=C1Cl)O BCP10855 [1,1,0,0,0,0|1,0,0]=3 97 B8R1.4 CC1=CC=CC(N)=C1 BCP15285 [1,1,0,0,0,0|2,0,0]=4 98 B8R1.4 CC1=CN=CC(Cl)=N1 BCP04702 [1,1,0,0,0,0|0,0,0]=2 99 B8R1.4 Cc1ccnc(c1)N BCP05096 [1,1,0,0,0,0|2,0,0]=4 100 B8R1.4 ClC1=CN=CC(Br)=C1 BCP04458 [1,1,0,0,0,0|2,0,0]=4 101 B8R1.4 ClC1=CN=CC(Cl)=C1 BCP05054 [1,1,0,0,0,0|2,0,0]=4 102 B8R1.4 FC1=CC=NC(Cl)=C1 BCP05875 [1,1,0,0,0,0|2,0,0]=4 103 B8R1.4 FC1=CN=CC(Br)=C1 BCP04824 [1,1,0,0,0,0|2,0,0]=4 104 B8R1.4 Fc1cccc(n1)Br BCP14733 [1,1,0,0,0,0|2,0,0]=4 105 B8R1.4 IC1=CC(Br)=NC=C1 BCP10632 [1,1,0,0,0,0|2,0,0]=4 106 B8R1.4 IC1=CC(Cl)=NC=C1 BCP13110 [1,1,0,0,0,0|2,0,0]=4 107 B8R1.4 IC1=CC(F)=NC=C1 BCP01627 [1,1,0,0,0,0|2,0,0]=4 108 B8R1.4 NC1=CN=CC(Cl)=C1 BCP11400 [1,1,0,0,0,0|2,0,0]=4 109 B8R1.4 NC1=NC(N)=CN=C1 BCP04701 [1,1,0,0,0,0|1,0,0]=3 110 B8R1.4 OC1=CN=NC(S)=N1 BCP09312 [1,1,0,0,0,0|1,0,0]=3 111 B8R1.4 OC1=NC=NC(O)=C1 BCP00979 [1,1,0,0,0,0|2,0,0]=4 112 B8R1.5 Brc1cccnc1O BCP11402 [1,1,0,0,0,0|1,0,0]=3 113 B8R1.5 CC1=C(N)C=CC=C1 BCP17522 [1,1,0,0,0,0|2,0,0]=4 114 B8R1.5 CC1=NC=CC=C1F BCP04309 [1,1,0,0,0,0|1,0,0]=3 115 B8R1.5 CC1=NC=NC=C1Br BCP19479 [1,1,0,0,0,0|2,0,0]=4 116 B8R1.5 Cc1nccnc1N BCP04706 [1,1,0,0,0,0|0,0,0]=2 117 B8R1.5 ClC1=C(Br)C=NC=C1 BCP10659 [1,1,0,0,0,0|2,0,0]=4 118 B8R1.5 ClC1=CC=CN=C1I BCP04456 [1,1,0,0,0,0|2,0,0]=4 119 B8R1.5 IC1=CC=CN=C1Cl BCP03191 [1,1,0,0,0,0|2,0,0]=4 120 B8R1.5 NC1=CC=NC=C1Br BCP03800 [1,1,0,0,0,0|2,0,0]=4 121 B8R1.5 NC1=CC=NC=C1F BCP01703 [1,1,0,0,0,0|2,0,0]=4 122 B8R1.5 NC1=NC=CC=C1N BCP04951 [1,1,0,0,0,0|2,0,0]=4 123 B8R1.5 OC1=CC=CC=[N+]1[O-] BCP13006 [1,1,0,0,0,0|1,0,1]=4 124 B8R1.7 CC(=O)C1=CNN=C1 BCP18458 [0,1,0,0,1,0|2,0,0]=4 125 B8R1.8 CNCC1=NOC=C1 BCP11421 [0,1,0,0,1,0|2,0,0]=4 126 B8R1.8 NCCC1=CN=CN1 BCP16313 [0,1,0,0,1,0|1,0,1]=4 127 B8R1.11 CC1=C(SC)C=CO1 BCP11303 [0,1,0,0,1,0|1,1,0]=4 128 B10R1.3 NCC1=CC=C(OC)C=C1 BCP11229 [0,2,0,0,0,0|2,0,0]=4 129 B10R1.13 BrC1=CN=C(C=N1)C(=O)O BCP04439 [0,2,0,0,0,0|2,0,0]=4 130 B10R1.13 NC1=NC=C(C=C1)C(C)C BCP00188 [0,2,0,0,0,0|2,0,0]=4 131 B10R1.13 O=C(C)C1=CC=C(Cl)N=C1 BCP13928 [0,2,0,0,0,0|2,0,0]=4 132 B10R1.13 O=C(C1=NC=C(C)N=C1)O BCP04707 [0,2,0,0,0,0|2,0,0]=4 133 B10R1.25 N#CC1=NC=C(Cl)N=C1Cl BCP10045 [0,2,0,0,0,0|2,0,0]=4 134 B10R1.25 NC1=CC(F)=CC=C1OC BCP05920 [0,2,0,0,0,0|2,0,0]=4 135 B10R1.25 NC1=CC=C(OC)C(F)=C1 BCP05898 [0,2,0,0,0,0|2,0,0]=4 136 B10R1.25 OC1=CC(Br)=CC=C1OC BCP13373 [0,2,0,0,0,0|2,0,0]=4 137 B10R1.176 COC1=CC(N)=C(C)C=C1 BCP05922 [0,2,0,0,0,0|2,0,0]=4 138 B10R1.176 COC1=CC=C(Cl)C(O)=C1 BCP11272 [0,2,0,0,0,0|2,0,0]=4 139 B10R1.176 NC1=CC=C(N=C1C)OC BCP07731 [0,2,0,0,0,0|1,0,0]=3 140 B10R1.176 NC1=NC(OC)=NC=C1F BCP18960 [0,2,0,0,0,0|2,0,0]=4 141 B10R1.176 O=C1NC(OC)=NC=C1F BCP18961 [0,2,0,0,0,0|2,0,0]=4 142 B10R1.2 OC1=C(OC)C=CC=C1Br BCP04858 [0,2,0,0,0,0|2,0,0]=4 143 B10R1.8 NC1=CC(OC)=CC(Br)=C1 BCP20491 [0,2,0,0,0,0|2,0,0]=4 144 B10R1.30 BrC1=CC=C(N)C=C1OC BCP05908 [0,2,0,0,0,0|2,0,0]=4 145 B10R1.30 COC1=CC(Br)=CN=C1N BCP10187 [0,2,0,0,0,0|1,0,0]=3 146 B10R1.30 ClC=1C=CC(=CC1OC)N BCP15300 [0,2,0,0,0,0|2,0,0]=4 147 B10R1.30 FC=1C=CC(=CC1OC)O BCP10034 [0,2,0,0,0,0|2,0,0]=4 148 B10R1.30 NC1=CC=C(F)C=C1OC BCP11916 [0,2,0,0,0,0|2,0,0]=4 149 B10R1.30 OC=1C=CC(=CC1OC)C BCP19090 [0,2,0,0,0,0|2,0,0]=4 150 B10R1.30 OC=1C=CC(=NC1CC)C BCP13392 [0,2,0,0,0,0|2,0,0]=4 151 B10R1.30 OC=1C=CC(=NC1CC)C BCP13396 [0,2,0,0,0,0|2,0,0]=4 152 B10R1.30 OC=1C=CC(=NC1CC)C BCP13397 [0,2,0,0,0,0|2,0,0]=4 153 B10R1.113 O=C(C)C1=NC(C)=CC=C1 BCP06451 [0,2,0,0,0,0|2,0,0]=4 154 B10R1.113 O=C(C)C1=NC=CC(Cl)=C1 BCP06614 [0,2,0,0,0,0|2,0,0]=4 155 B10R1.172 CNC1=NC(OC)=CC=C1 BCP20247 [0,2,0,0,0,0|1,0,0]=3 156 B10R1.172 COC1=CC(CCl)=CC=C1 BCP18627 [0,2,0,0,0,0|2,0,0]=4 157 B10R1.172 COC1=CC(SC)=CC=C1 BCP17523 [0,2,0,0,0,0|2,0,0]=4 158 B10R1.172 COC1=CC=NC(OC)=C1 BCP10991 [0,2,0,0,0,0|1,0,0]=3 159 B10R1.172 COC1=NC=CC(=N1)C=O BCP10050 [0,2,0,0,0,0|2,0,0]=4 160 B10R1.172 NCC1=CC=CC(OC)=C1 BCP11237 [0,2,0,0,0,0|2,0,0]=4 161 B10R1.15 OC(CN)C1=CC=CN=C1 BCP11465 [0,2,0,0,0,0|2,0,0]=4 162 B10R1.61 CC(=O)c1cccnc1Cl BCP10419 [0,2,0,0,0,0|2,0,0]=4 163 B10R1.61 FC1=C(C(C)O)N=CC=C1 BCP06886 [0,2,0,0,0,0|2,0,0]=4 164 B10R1.61 IC1=NC=CN=C1C(=O)O BCP04704 [0,2,0,0,0,0|2,0,0]=4 165 B10R1.61 OC1=C(C(N)=O)N=CC=N1 BCP03021 [0,2,0,0,0,0|2,0,0]=4 166 B10R1.17 CNCCC1=CC=CC=N1 BCP13129 [0,2,0,0,0,0|2,0,0]=4 167 B10R1.17 CNCCC1=CC=CC=N1 BCP13779 [0,2,0,0,0,0|2,0,0]=4 168 B10R1.17 CNCCC1=NC=CC=C1 BCP16849 [0,2,0,0,0,0|2,0,0]=4 169 B10R1.20 COC1=C(CN)C=CC=C1 BCP11246 [0,2,0,0,0,0|2,0,0]=4 170 B10R1.20 OCC1=CC=CN=C1NC BCP15519 [0,2,0,0,0,0|2,0,0]=4 171 B10R1.245 O=C1C(OC)=C(C)NC=C1 BCP16936 [0,2,0,0,0,0|1,0,1]=4 172 B10R2.6 [C]1(C2=CC=CC=C2)OC1 BCP14534 [0,1,0,1,0,0|2,0,0]=4 173 B10R2.7 C=12C=CC=CC1OCO2 BCP11873 [0,1,0,1,0,0|2,0,0]=4 174 B10R2.7 C=12C=CC=NC1CNC2 BCP14712 [0,1,0,1,0,0|2,0,0]=4 175 B10R2.7 c1cnc2c(c1)CCC2 BCP01061 [0,1,0,1,0,0|2,0,0]=4 176 B6R1.2 BrC1=COC=C1 BCP10263 [1,0,0,0,1,0|2,0,0]=4 177 B6R1.2 BrC1=CSN=C1 BCP09718 [1,0,0,0,1,0|2,0,0]=4 178 B6R1.2 BrC1=NNC=C1 BCP00001 [1,0,0,0,1,0|2,0,0]=4 179 B6R1.2 BrC1=NNC=N1 BCP10343 [1,0,0,0,1,0|2,0,0]=4 180 B6R1.2 CC1=CC=NO1 BCP11243 [1,0,0,0,1,0|1,0,0]=3 181 B6R1.2 CC1=NNC=N1 BCP08231 [1,0,0,0,1,0|1,0,0]=3 182 B6R1.2 CN1N=CN=C1 BCP18633 [1,0,0,0,1,0|1,0,0]=3 183 B6R1.2 IC1=CON=C1 BCP07767 [1,0,0,0,1,0|2,0,0]=4 184 B6R1.2 Ic1cnc[nH]1 BCP09637 [1,0,0,0,1,0|1,0,1]=4 185 B6R1.2 NC1=CNC=N1 BCP05277 [1,0,0,0,1,0|1,0,1]=4