0 B9R1.6 CC(=O)C1=CC=CN=C1 OR5046 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.6 CC(=O)C1=CN=CN=C1 OR30703 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.6 CC(=O)C1=NC=CC=C1 OR5045 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.6 CC(=O)C1=NC=CC=N1 OR16083 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.6 CC(=O)C1=NC=CN=C1 OR5593 [0,0,0,0,0,0|1,0,1]=2 5 B9R1.6 CC(Br)C1=CC=CC=C1 OR315258 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 CC(Br)C1=CC=CN=C1 OR46058 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 CC(Cl)C1=CC=CC=C1 OR9525 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.6 CC(N)C1=CC=NC=C1 OR01563 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.6 CC(N)C1=CN=CC=C1 OR01562 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.6 CC(N)C1=NC=CC=C1 OR01560 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.6 CC(O)C1=CC=CC=N1 OR01623 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.6 CC(O)C1=CC=CN=C1 OR01622 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.6 CC(O)C1=CC=NC=C1 OR01620 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.6 CN(C)C1=CC=CC=C1 OR61405 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.6 CN(C)C1=CC=NC=C1 OR28827 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.6 CN(C)C1=NC=CC=C1 OR13607 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.6 CN(N)C1=CC=CC=C1 OR55581 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.6 CS(=O)C1=CC=CC=C1 OR30635 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.6 C[C@@H](N)C1=CC=CC=C1 OR5862 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.6 C[C@@H](N)C1=NC=CC=C1 OR70108 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.6 C[C@@H](O)C1=CC=CC=C1 OR315316 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.6 C[C@H](N)C1=CC=CC=C1 OR28829 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.6 C[C@H](N)C1=NC=CC=C1 OR46602 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.6 N=C(N)C1=CC=CN=C1 OR9026 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.6 N=C(N)C1=NC=CC=C1 OR1303 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.6 N=C(N)C1=NC=CN=C1 OR3402 [0,0,0,0,0,0|2,0,1]=3 27 B9R1.6 NC(=O)C1=NC=CN=C1 OR9043 [0,0,0,0,0,0|2,0,1]=3 28 B9R1.6 NC(=S)C1=NC=CN=C1 OR29190 [0,0,0,0,0,0|2,0,1]=3 29 B9R1.6 O=C(Cl)C1=CC=CN=C1 OR46575 [0,0,0,0,0,0|3,0,1]=4 30 B9R1.6 O=C(Cl)C1=NC=CC=C1 OR20043 [0,0,0,0,0,0|3,0,1]=4 31 B9R1.6 O=C(Cl)C1=NC=CC=C1 OR6370 [0,0,0,0,0,0|3,0,1]=4 32 B9R1.6 O=C(O)C1=NC=CC=C1 OR23054 [0,0,0,0,0,0|3,0,1]=4 33 B9R1.6 O=C(O)C1=NC=CN=C1 OR11036 [0,0,0,0,0,0|2,0,1]=3 34 B9R1.6 O=C([O-])C1=NC=CN=N1 OR45150 [0,0,0,0,0,0|3,0,1]=4 35 B9R1.6 O=[N+]([O-])C1=CC=CC=N1 OR16075 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.6 O=[N+]([O-])C1=CN=CC=C1 OR345060 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.6 OB(O)C1=CC=CN=C1 OR4119 [0,0,0,0,0,0|4,0,0]=4 38 B8R1.2 BrCC1=CC=CC=C1 OR12905 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.2 BrCC1=CC=CN=C1 OR46547 [1,0,0,0,0,0|2,0,0]=3 40 B8R1.2 BrCC1=CC=CN=N1 OR30652 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.2 BrCC1=NC=CN=C1 OR40084 [1,0,0,0,0,0|1,0,0]=2 42 B8R1.2 BrCC1=NC=CN=C1 OR46239 [1,0,0,0,0,0|1,0,0]=2 43 B8R1.2 C#CC1=NC=CC=C1 OR18606 [1,0,0,0,0,0|1,0,2]=4 44 B8R1.2 C#CC1=NC=CN=C1 OR53022 [1,0,0,0,0,0|0,0,2]=3 45 B8R1.2 C=CC1=CC=CN=C1 OR8894 [1,0,0,0,0,0|1,0,2]=4 46 B8R1.2 C=CC1=NC=CC=C1 OR3144 [1,0,0,0,0,0|1,0,2]=4 47 B8R1.2 CCC1=CC=CC=C1 OR14988 [1,0,0,0,0,0|2,0,0]=3 48 B8R1.2 CCC1=CC=NC=C1 OR345107 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.2 CNC1=CN=CN=C1 OR305382 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.2 COC1=CC=CN=C1 OR4691 [1,0,0,0,0,0|2,0,0]=3 51 B8R1.2 COC1=CCC=CC1 OR17014 [1,0,0,0,0,0|3,0,0]=4 52 B8R1.2 COC1=NC=CC=C1 OR13608 [1,0,0,0,0,0|2,0,0]=3 53 B8R1.2 CSC1=CC=CC=C1 OR2490 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.2 CSC1=NC=CC=N1 OR15527 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.2 ClCC1=CC=CC=C1 OR16493 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.2 ClCC1=CC=CN=C1 OR0262 [1,0,0,0,0,0|2,0,0]=3 57 B8R1.2 ClCC1=NC=CC=C1 OR8686 [1,0,0,0,0,0|2,0,0]=3 58 B8R1.2 ClCC1=NC=CN=C1 OR40082 [1,0,0,0,0,0|1,0,0]=2 59 B8R1.2 ClCC1=NC=CN=C1 OR61057 [1,0,0,0,0,0|1,0,0]=2 60 B8R1.2 N#CC1=NC=CN=C1 OR28727 [1,0,0,0,0,0|1,0,1]=3 61 B8R1.2 NCC1=CC=CC=C1 OR16591 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.2 NCC1=CC=CC=C1 OR27725 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.2 NCC1=CC=CN=C1 OR23063 [1,0,0,0,0,0|2,0,0]=3 64 B8R1.2 NCC1=NC=CC=C1 OR5031 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.2 NCC1=NC=CC=N1 OR12993 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.2 NCC1=NC=CC=N1 OR48262 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.2 NCC1=NC=CN=C1 OR40048 [1,0,0,0,0,0|1,0,0]=2 68 B8R1.2 NCC1=NN=CC=C1 OR8924 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.2 NNC1=CC=CN=C1 OR306302 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.2 NNC1=CN=CC=N1 OR16081 [1,0,0,0,0,0|2,0,0]=3 71 B8R1.2 NNC1=NC=CC=C1 OR61068 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.2 O=CC1=CC=CN=C1 OR23059 [1,0,0,0,0,0|2,0,1]=4 73 B8R1.2 O=CC1=NC=CC=C1 OR5051 [1,0,0,0,0,0|2,0,1]=4 74 B8R1.2 O=CC1=NC=CN=C1 OR1854 [1,0,0,0,0,0|1,0,1]=3 75 B8R1.2 OCC1=CC=CC=C1 OR923999 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.2 OCC1=CC=CN=C1 OR23061 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.2 OCC1=CC=CN=N1 OR6428 [1,0,0,0,0,0|3,0,0]=4 78 B8R1.2 OCC1=CN=CN=C1 OR17898 [1,0,0,0,0,0|3,0,0]=4 79 B8R1.2 OCC1=NC=CC=C1 OR23056 [1,0,0,0,0,0|2,0,0]=3 80 B8R1.2 OCC1=NC=CC=N1 OR42130 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.2 OCC1=NC=CN=C1 OR12341 [1,0,0,0,0,0|1,0,0]=2 82 B8R1.2 OCC1=NC=NC=C1 OR42131 [1,0,0,0,0,0|3,0,0]=4 83 B8R1.2 SCC1=CC=CN=C1 OR305406 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.13 CC(=O)C1=CC=C(C)N=C1 OR345083 [0,1,0,0,0,0|2,0,1]=4 85 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 OR25927 [0,1,0,0,0,0|2,0,1]=4 86 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 OR14930 [0,1,0,0,0,0|2,0,1]=4 87 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 OR51752 [0,1,0,0,0,0|2,0,1]=4 88 B10R1.13 CC(Br)C1=CC=C(Cl)C=C1 OR321021 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.13 CC(C)C1=CC=C(I)C=C1 OR11205 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.13 CC(C)C1=CC=C(N)C=C1 OR4957 [0,1,0,0,0,0|2,0,0]=3 91 B10R1.13 CC(C)C1=CC=C(O)C=C1 OR18281 [0,1,0,0,0,0|2,0,0]=3 92 B10R1.13 CC(C)C1=CC=C(S)C=C1 OR0781 [0,1,0,0,0,0|2,0,0]=3 93 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 OR17821 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.13 CC(N)C1=CC=C(N)C=C1 OR01680 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.13 CC(O)C1=CC=C(Br)C=C1 OR17616 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 OR2973 [0,1,0,0,0,0|3,0,0]=4 97 B10R1.13 CC1=NC=C(C(=O)O)N=C1 OR28728 [0,1,0,0,0,0|2,0,1]=4 98 B10R1.13 CC1=NC=C(C(N)=O)N=C1 OR40050 [0,1,0,0,0,0|2,0,1]=4 99 B10R1.13 CN(C)C1=CC=C(Br)C=C1 OR11136 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 OR17922 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.13 CN(C)C1=CC=C(N)C=C1 OR14326 [0,1,0,0,0,0|3,0,0]=4 102 B10R1.13 CN(C)C1=CC=C(N)C=C1 OR5247 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.13 CN(C)C1=CC=C(N)C=C1 OR5307 [0,1,0,0,0,0|3,0,0]=4 104 B10R1.13 CN(C)C1=CN=C(Cl)C=N1 OR42255 [0,1,0,0,0,0|1,0,0]=2 105 B10R1.13 CN(C)C1=NC=C(Br)C=C1 OR7730 [0,1,0,0,0,0|2,0,0]=3 106 B10R1.13 CN(C)C1=NC=C(Br)C=N1 OR7769 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 OR48265 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 OR322311 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 OR48261 [0,1,0,0,0,0|3,0,0]=4 110 B10R1.13 ClC1=NC=C(C(Cl)Cl)C=C1 OR40427 [0,1,0,0,0,0|3,0,0]=4 111 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 OR59462 [0,1,0,0,0,0|2,0,1]=4 112 B10R1.13 O=C(O)C1=CN=C(O)C=N1 OR40051 [0,1,0,0,0,0|2,0,1]=4 113 B10R1.13 OB(O)C1=CN=C(Cl)C=N1 OR40070 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.15 CC(CN)C1=CC=CC=C1 OR6734 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.15 CCC(Br)C1=CC=CC=C1 OR55292 [0,1,0,0,0,0|3,0,0]=4 116 B10R1.15 CCC(O)C1=CC=CC=C1 OR10953 [0,1,0,0,0,0|3,0,0]=4 117 B10R1.15 CC[C@H](N)C1=CC=CC=C1 OR52676 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.15 COC(=O)C1=NC=CC=C1 OR22699 [0,1,0,0,0,0|2,0,1]=4 119 B10R1.15 COC(=O)C1=NC=CN=C1 OR6399 [0,1,0,0,0,0|1,0,1]=3 120 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 OR3244 [0,1,0,0,0,0|2,0,0]=3 121 B10R1.15 C\C(=N/O)C1=NC=CC=C1 OR25030 [0,1,0,0,0,0|2,0,1]=4 122 B10R1.15 NC(CO)C1=CC=CC=C1 OR17907 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.15 NCC(O)C1=CC=CC=C1 OR52511 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.15 NCC(O)C1=CC=CC=C1 OR9824 [0,1,0,0,0,0|3,0,0]=4 125 B10R1.15 NCC(O)C1=CN=CC=C1 OR12818 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.15 NCC(O)C1=NC=CC=C1 OR12817 [0,1,0,0,0,0|2,0,0]=3 127 B10R1.15 NCC(O)C1=NC=CC=C1 OR60079 [0,1,0,0,0,0|2,0,0]=3 128 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 OR3013 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.15 NC[C@H](O)C1=CC=CC=C1 OR3011 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 OR19518 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.15 N[C@H](CO)C1=CC=CC=C1 OR8743 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.15 N\C(=N/O)C1=NC=CN=C1 OR3401 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.15 O=C(CBr)C1=CC=CN=C1 OR10712 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.15 O=C(CBr)C1=NC=CC=C1 OR1299 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 OR3005 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.15 OC[C@H](O)C1=CC=CC=C1 OR3006 [0,1,0,0,0,0|3,0,0]=4 137 B10R1.15 O[C@H](CCl)C1=CC=CC=C1 OR55062 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 OR8742 [0,1,0,0,0,0|3,0,0]=4 139 B10R1.28 CC(C)(C)C1=CC=CC=C1 OR10947 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.28 CC(C)(Cl)C1=CC=CC=C1 OR9372 [0,1,0,0,0,0|2,0,0]=3 141 B10R1.28 CC(C)(N)C1=CC=CC=N1 OR470173 [0,1,0,0,0,0|1,0,0]=2 142 B10R1.28 CC(C)(O)C1=CC=CC=C1 OR18323 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.28 CC(C)(O)C1=CC=CN=C1 OR42205 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.28 CC(C)(O)C1=NC=CC=C1 OR25562 [0,1,0,0,0,0|1,0,0]=2 145 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 OR904742 [0,1,0,0,0,0|3,0,0]=4 146 B10R1.28 C[Si](C)(C)C1=CC=CC=C1 OR303371 [0,1,0,0,0,0|2,1,0]=4 147 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 OR22666 [0,1,0,0,0,0|2,1,0]=4 148 B10R1.61 CC(=O)C1=C(O)N=CC=C1 OR345384 [0,1,0,0,0,0|2,0,1]=4 149 B10R1.61 CC(=O)C1=CC=CN=C1Br OR18830 [0,1,0,0,0,0|2,0,1]=4 150 B10R1.61 CC(=O)C1=CC=CN=C1Cl OR61610 [0,1,0,0,0,0|2,0,1]=4 151 B10R1.61 CC(=O)C1=CC=CN=C1N OR15249 [0,1,0,0,0,0|2,0,1]=4 152 B10R1.61 CC(=O)C1=CN=CC=C1N OR53152 [0,1,0,0,0,0|2,0,1]=4 153 B10R1.61 CC(=O)C1=NC=CC=C1C OR40729 [0,1,0,0,0,0|2,0,1]=4 154 B10R1.61 CC(=O)C1=NC=CC=C1Cl OR302156 [0,1,0,0,0,0|2,0,1]=4 155 B10R1.61 CC(C)C1=C(Br)C=NC=N1 OR11585 [0,1,0,0,0,0|2,0,0]=3 156 B10R1.61 CC(C)C1=C(I)C=CC=C1 OR11375 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.61 CC(C)C1=C(N)C=CC=C1 OR28577 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.61 CC(C)C1=CC=CC=C1O OR322047 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.61 CC(O)C1=C(Br)C=CC=C1 OR2162 [0,1,0,0,0,0|3,0,0]=4 160 B10R1.61 CC1=NC=CN=C1C(=O)O OR59825 [0,1,0,0,0,0|2,0,1]=4 161 B10R1.61 CN(C)C1=C(N)C=CC=C1 OR60254 [0,1,0,0,0,0|3,0,0]=4 162 B10R1.61 NC1=NC=CN=C1C(=O)O OR18277 [0,1,0,0,0,0|2,0,1]=4 163 B10R1.61 O=C(O)C1=NC=CN=C1Cl OR322467 [0,1,0,0,0,0|2,0,1]=4 164 B10R1.61 O=C(O)C1=NC=CN=C1I OR16959 [0,1,0,0,0,0|2,0,1]=4 165 B10R1.61 O=C(O)C1=NC=CN=C1O OR40047 [0,1,0,0,0,0|2,0,1]=4 166 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 OR12051 [0,1,0,0,0,0|2,0,1]=4 167 B10R1.113 CC(=O)C1=CC=CC(C)=N1 OR13601 [0,1,0,0,0,0|2,0,1]=4 168 B10R1.113 CC(C)C1=CC=CC(Br)=C1 OR2897 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.113 CC(C)C1=CC=CC(N)=C1 OR0560 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.113 CC(C)C1=NC(Cl)=NC=C1 OR11532 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.113 CC(N)C1=CC=CC(N)=C1 OR01676 [0,1,0,0,0,0|3,0,0]=4 172 B10R1.113 CC1=CN=CC(C(=O)O)=N1 OR40068 [0,1,0,0,0,0|2,0,1]=4 173 B10R1.113 CN(C)C1=CC(Br)=CC=C1 OR3746 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.113 CN(C)C1=CC(N)=CC=C1 OR40391 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.113 CN(C)C1=CC=CC(O)=C1 OR14323 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.113 CN(C)C1=NC=CC(Br)=N1 OR302531 [0,1,0,0,0,0|3,0,0]=4 177 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 OR40053 [0,1,0,0,0,0|2,0,1]=4 178 B8R1.7 CC(=O)C1=CC=CN1 OR21519 [0,0,0,0,1,0|1,0,2]=4 179 B8R1.7 CC(=O)C1=CC=CO1 OR28745 [0,0,0,0,1,0|2,0,1]=4 180 B8R1.7 CC(=O)C1=CC=CS1 OR10140 [0,0,0,0,1,0|2,0,1]=4 181 B8R1.7 CC(=O)C1=CC=NN1 OR29765 [0,0,0,0,1,0|2,0,1]=4 182 B8R1.7 CC(=O)C1=CNC=C1 OR10314 [0,0,0,0,1,0|1,0,2]=4 183 B8R1.7 CC(=O)C1=COC=C1 OR16082 [0,0,0,0,1,0|2,0,1]=4 184 B8R1.7 CC(=O)C1=CSC=C1 OR5739 [0,0,0,0,1,0|2,0,1]=4 185 B8R1.7 CC(=O)C1=NC=CN1 OR313011 [0,0,0,0,1,0|1,0,2]=4 186 B8R1.7 CC(=O)C1=NC=CS1 OR4953 [0,0,0,0,1,0|2,0,1]=4 187 B8R1.7 CC(C)=C1C=CC=C1 OR52345 [0,0,0,0,1,0|1,0,1]=3 188 B8R1.7 CC(C)C1C=CC=C1 OR62075 [0,0,0,0,1,0|1,0,1]=3 189 B8R1.7 CC(N)C1=CC=CO1 OR01656 [0,0,0,0,1,0|2,0,0]=3 190 B8R1.7 CC(N)C1=CC=CS1 OR01764 [0,0,0,0,1,0|2,0,0]=3 191 B10R1.18 CC(=O)CC1=NC=CC=C1 OR302235 [0,0,0,0,0,1|2,0,1]=4 192 B10R1.18 CC(=O)NC1=CC=CN=C1 OR21124 [0,0,0,0,0,1|2,0,1]=4 193 B10R1.18 CC(Br)CC1=CC=CC=C1 OR323250 [0,0,0,0,0,1|3,0,0]=4 194 B10R1.18 CC(C)=CC1=CC=CC=C1 OR30976 [0,0,0,0,0,1|2,0,1]=4 195 B10R1.18 CC(C)CC1=CC=CC=C1 OR22170 [0,0,0,0,0,1|2,0,0]=3 196 B10R1.18 CC(C)SC1=CC=CC=C1 OR18312 [0,0,0,0,0,1|2,0,0]=3 197 B10R1.18 CC(N)CC1=NC=CC=C1 OR40277 [0,0,0,0,0,1|2,0,0]=3 198 B10R1.18 CC(O)CC1=CC=CC=C1 OR8956 [0,0,0,0,0,1|3,0,0]=4 199 B10R1.18 CN(C)CC1=CC=CC=C1 OR54497 [0,0,0,0,0,1|3,0,0]=4 200 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 OR150 [0,0,0,0,0,1|3,0,0]=4 201 B10R1.18 O=C(O)CC1=NC=CN=C1 OR313069 [0,0,0,0,0,1|2,0,1]=4 202 B7R0.1 CC\C=C\C=C\C=O OR6046 [1,0,1,0,0,0|2,0,0]=4 203 B7R1.3 BrC1=CC=CN=C1 OR23062 [2,0,0,0,0,0|2,0,0]=4 204 B7R1.3 BrC1=NC=CC=C1 OR23057 [2,0,0,0,0,0|2,0,0]=4 205 B7R1.3 BrC1=NC=CN=C1 OR61107 [2,0,0,0,0,0|1,0,0]=3 206 B7R1.3 CC1=CN=CN=C1 OR8286 [2,0,0,0,0,0|2,0,0]=4 207 B7R1.3 CC1=CN=NC=C1 OR25618 [2,0,0,0,0,0|2,0,0]=4 208 B7R1.3 CC1=NC=CN=C1 OR52198 [2,0,0,0,0,0|0,0,0]=2 209 B7R1.3 ClC1=CC=CN=C1 OR5865 [2,0,0,0,0,0|2,0,0]=4 210 B7R1.3 ClC1=CN=CC=N1 OR11035 [2,0,0,0,0,0|1,0,0]=3 211 B7R1.3 ClC1=NC=CC=C1 OR9447 [2,0,0,0,0,0|2,0,0]=4 212 B7R1.3 IC1=CC=CN=C1 OR13049 [2,0,0,0,0,0|2,0,0]=4 213 B7R1.3 IC1=NC=CC=C1 OR5750 [2,0,0,0,0,0|2,0,0]=4 214 B7R1.3 IC1=NC=CN=C1 OR3669 [2,0,0,0,0,0|1,0,0]=3 215 B7R1.3 NC1=CC=CN=C1 OR9548 [2,0,0,0,0,0|2,0,0]=4 216 B7R1.3 NC1=NC=CC=C1 OR0015 [2,0,0,0,0,0|2,0,0]=4 217 B7R1.3 NC1=NC=CN=C1 OR5470 [2,0,0,0,0,0|1,0,0]=3 218 B7R1.3 NC1=NC=CN=N1 OR17565 [2,0,0,0,0,0|2,0,0]=4 219 B7R1.3 OC1=CC=CN=C1 OR4752 [2,0,0,0,0,0|2,0,0]=4 220 B7R1.3 OC1=NC=CC=C1 OR11197 [2,0,0,0,0,0|2,0,0]=4 221 B7R1.3 OC1=NC=CN=C1 OR40046 [2,0,0,0,0,0|1,0,0]=3 222 B7R1.3 SC1=NC=CC=C1 OR9448 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.1 BrCC1=CC=C(Br)N=C1 OR315377 [1,1,0,0,0,0|2,0,0]=4 224 B9R1.1 C#CC1=NC=C(C)N=C1 OR53019 [1,1,0,0,0,0|0,0,2]=4 225 B9R1.1 CC1=CC=C(CCl)N=C1 OR310896 [1,1,0,0,0,0|2,0,0]=4 226 B9R1.1 CC1=CC=C(CO)C=N1 OR14843 [1,1,0,0,0,0|2,0,0]=4 227 B9R1.1 CC1=CN=C(C=O)C=N1 OR40083 [1,1,0,0,0,0|1,0,1]=4 228 B9R1.1 CC1=CN=C(CN)C=C1 OR306469 [1,1,0,0,0,0|2,0,0]=4 229 B9R1.1 CC1=CN=C(CN)C=N1 OR30690 [1,1,0,0,0,0|1,0,0]=3 230 B9R1.1 CC1=CN=C(NN)C=N1 OR60218 [1,1,0,0,0,0|2,0,0]=4 231 B9R1.1 CCC1=CC=C(Br)C=C1 OR13057 [1,1,0,0,0,0|2,0,0]=4 232 B9R1.1 CCC1=CC=C(I)C=C1 OR4537 [1,1,0,0,0,0|2,0,0]=4 233 B9R1.1 CCC1=CC=C(S)C=C1 OR11377 [1,1,0,0,0,0|2,0,0]=4 234 B9R1.1 CCC1=CN=C(C)C=C1 OR3152 [1,1,0,0,0,0|1,0,0]=3 235 B9R1.1 CCC1=CN=C(Cl)N=C1 OR2912 [1,1,0,0,0,0|2,0,0]=4 236 B9R1.1 COC1=CC=C(N)N=C1 OR40515 [1,1,0,0,0,0|2,0,0]=4 237 B9R1.1 COC1=CN=C(Br)C=C1 OR3574 [1,1,0,0,0,0|2,0,0]=4 238 B9R1.1 COC1=CN=C(Br)C=N1 OR61105 [1,1,0,0,0,0|1,0,0]=3 239 B9R1.1 COC1=CN=C(N)C=N1 OR40076 [1,1,0,0,0,0|1,0,0]=3 240 B9R1.1 COC1=NC=C(Br)C=C1 OR1212 [1,1,0,0,0,0|2,0,0]=4 241 B9R1.1 COC1=NC=C(Cl)C=C1 OR3476 [1,1,0,0,0,0|2,0,0]=4 242 B9R1.1 COC1=NC=C(N)C=C1 OR4654 [1,1,0,0,0,0|2,0,0]=4 243 B9R1.1 COC1=NC=C(O)C=C1 OR3808 [1,1,0,0,0,0|2,0,0]=4 244 B9R1.1 CSC1=CC=C(Br)C=N1 OR15634 [1,1,0,0,0,0|2,0,0]=4 245 B9R1.1 ClCC1=CC=C(Cl)C=N1 OR303892 [1,1,0,0,0,0|2,0,0]=4 246 B9R1.1 ClCC1=CC=C(Cl)C=N1 OR54365 [1,1,0,0,0,0|2,0,0]=4 247 B9R1.1 ClCC1=CN=C(Cl)C=C1 OR11306 [1,1,0,0,0,0|2,0,0]=4 248 B9R1.1 N#CC1=CN=C(Br)C=N1 OR18105 [1,1,0,0,0,0|1,0,1]=4 249 B9R1.1 N#CC1=CN=C(N)C=N1 OR18000 [1,1,0,0,0,0|1,0,1]=4 250 B9R1.1 N#CC1=NC=C(Cl)N=C1 OR43502 [1,1,0,0,0,0|1,0,1]=4 251 B9R1.1 NC1=CC=C(CO)C=N1 OR14503 [1,1,0,0,0,0|2,0,0]=4 252 B9R1.1 NCC1=CN=C(Cl)C=C1 OR6199 [1,1,0,0,0,0|2,0,0]=4 253 B9R1.1 NCC1=CN=C(N)C=C1 OR41126 [1,1,0,0,0,0|2,0,0]=4 254 B9R1.1 NCC1=NC=C(Br)C=C1 OR52328 [1,1,0,0,0,0|2,0,0]=4 255 B9R1.1 NCC1=NC=C(Cl)C=C1 OR60126 [1,1,0,0,0,0|2,0,0]=4 256 B9R1.1 NCC1=NC=C(O)C=C1 OR51778 [1,1,0,0,0,0|2,0,0]=4 257 B9R1.1 NNC1=NC=C(Cl)N=C1 OR55438 [1,1,0,0,0,0|2,0,0]=4 258 B9R1.1 NNC1=NC=C(Cl)N=C1 OR60232 [1,1,0,0,0,0|2,0,0]=4 259 B9R1.1 OCC1=CN=C(Cl)C=C1 OR11307 [1,1,0,0,0,0|2,0,0]=4 260 B9R1.1 OCC1=NC=C(Br)C=C1 OR13061 [1,1,0,0,0,0|2,0,0]=4 261 B9R1.1 OCC1=NC=C(Cl)C=C1 OR16865 [1,1,0,0,0,0|2,0,0]=4 262 B9R1.1 OCC1=NC=C(Cl)N=C1 OR313042 [1,1,0,0,0,0|1,0,0]=3 263 B9R1.2 BrCC1=NC(Br)=CC=C1 OR303708 [1,1,0,0,0,0|2,0,0]=4 264 B9R1.2 C#CC1=CN=CC(Cl)=N1 OR53054 [1,1,0,0,0,0|0,0,2]=4 265 B9R1.2 C#CC1=NC(C)=CN=C1 OR53018 [1,1,0,0,0,0|0,0,2]=4 266 B9R1.2 CC1=CC(CN)=CN=C1 OR306426 [1,1,0,0,0,0|2,0,0]=4 267 B9R1.2 CC1=CC(CN)=NC=C1 OR40440 [1,1,0,0,0,0|2,0,0]=4 268 B9R1.2 CC1=CC(CN)=NC=C1 OR6198 [1,1,0,0,0,0|2,0,0]=4 269 B9R1.2 CC1=CC=CC(CO)=N1 OR0530 [1,1,0,0,0,0|2,0,0]=4 270 B9R1.2 CC1=CN=CC(CCl)=C1 OR13615 [1,1,0,0,0,0|2,0,0]=4 271 B9R1.2 CC1=CN=CC(NN)=N1 OR60229 [1,1,0,0,0,0|2,0,0]=4 272 B9R1.2 CC1=NC(CCl)=CC=C1 OR450025 [1,1,0,0,0,0|2,0,0]=4 273 B9R1.2 CCC1=CC=CC(Br)=C1 OR30209 [1,1,0,0,0,0|2,0,0]=4 274 B9R1.2 CCC1=CC=CC(N)=N1 OR22212 [1,1,0,0,0,0|1,0,0]=3 275 B9R1.2 CCC1=NC(Cl)=NC=C1 OR17114 [1,1,0,0,0,0|2,0,0]=4 276 B9R1.2 CNC1=NC(Cl)=CN=C1 OR59340 [1,1,0,0,0,0|1,0,0]=3 277 B9R1.2 COC1=CC(Br)=CN=C1 OR5842 [1,1,0,0,0,0|2,0,0]=4 278 B9R1.2 COC1=CC(Cl)=CC=N1 OR315215 [1,1,0,0,0,0|2,0,0]=4 279 B9R1.2 COC1=CC(N)=CC=N1 OR30557 [1,1,0,0,0,0|2,0,0]=4 280 B9R1.2 COC1=CC(O)=CN=C1 OR46115 [1,1,0,0,0,0|2,0,0]=4 281 B9R1.2 COC1=CC=CC(Br)=N1 OR2983 [1,1,0,0,0,0|2,0,0]=4 282 B9R1.2 COC1=CC=CC(C)=N1 OR9940 [1,1,0,0,0,0|2,0,0]=4 283 B9R1.2 COC1=CC=CC(N)=N1 OR5984 [1,1,0,0,0,0|2,0,0]=4 284 B9R1.2 COC1=CN=CC(Br)=N1 OR40079 [1,1,0,0,0,0|1,0,0]=3 285 B9R1.2 COC1=CN=CC(N)=C1 OR301042 [1,1,0,0,0,0|2,0,0]=4 286 B9R1.2 COC1=CN=CC(N)=N1 OR301157 [1,1,0,0,0,0|1,0,0]=3 287 B9R1.2 COC1=NC(Cl)=CC=C1 OR3143 [1,1,0,0,0,0|2,0,0]=4 288 B9R1.2 COC1=NC=CC(Br)=C1 OR11605 [1,1,0,0,0,0|2,0,0]=4 289 B9R1.2 CSC1=CC=CC(Br)=N1 OR15633 [1,1,0,0,0,0|2,0,0]=4 290 B9R1.2 CSC1=CN=CC(Br)=C1 OR3600 [1,1,0,0,0,0|2,0,0]=4 291 B9R1.2 CSC1=NC(=O)C=NN1 OR28167 [1,1,0,0,0,0|2,0,0]=4 292 B9R1.2 ClCC1=CN=CC(Br)=C1 OR14923 [1,1,0,0,0,0|2,0,0]=4 293 B9R1.2 ClCC1=CN=CC(Cl)=C1 OR40752 [1,1,0,0,0,0|2,0,0]=4 294 B9R1.2 ClCC1=NC(Cl)=CC=C1 OR303732 [1,1,0,0,0,0|2,0,0]=4 295 B9R1.2 N#CC1=NC(Cl)=CN=C1 OR18116 [1,1,0,0,0,0|1,0,1]=4 296 B9R1.2 NCC1=CC(Br)=CN=C1 OR14911 [1,1,0,0,0,0|2,0,0]=4 297 B9R1.2 NCC1=NC(O)=CC=C1 OR60161 [1,1,0,0,0,0|2,0,0]=4 298 B9R1.2 NCC1=NC=CC(Br)=C1 OR52531 [1,1,0,0,0,0|2,0,0]=4 299 B9R1.2 NNC1=NC(Cl)=CN=C1 OR60236 [1,1,0,0,0,0|2,0,0]=4 300 B9R1.2 OCC1=CC=CC(Br)=N1 OR3668 [1,1,0,0,0,0|2,0,0]=4 301 B9R1.2 OCC1=CC=CC(Cl)=N1 OR303659 [1,1,0,0,0,0|2,0,0]=4 302 B9R1.2 OCC1=CN=CC(Br)=C1 OR3285 [1,1,0,0,0,0|2,0,0]=4 303 B9R1.2 OCC1=NC=CC(Br)=C1 OR53132 [1,1,0,0,0,0|2,0,0]=4 304 B9R1.2 OCC1=NC=CC(Cl)=C1 OR3538 [1,1,0,0,0,0|2,0,0]=4 305 B9R1.8 BrCCC1=CC=CC=C1 OR46084 [1,1,0,0,0,0|2,0,0]=4 306 B9R1.8 CCNC1=CC=CC=C1 OR8988 [1,1,0,0,0,0|2,0,0]=4 307 B9R1.8 CCOC1=NC=CC=C1 OR40436 [1,1,0,0,0,0|1,0,0]=3 308 B9R1.8 CNCC1=CC=CC=C1 OR12500 [1,1,0,0,0,0|2,0,0]=4 309 B9R1.8 CNCC1=CC=CN=C1 OR30155 [1,1,0,0,0,0|1,0,0]=3 310 B9R1.8 CNCC1=NC=CC=C1 OR12501 [1,1,0,0,0,0|1,0,0]=3 311 B9R1.8 CNCC1=NC=CC=C1 OR51995 [1,1,0,0,0,0|1,0,0]=3 312 B9R1.8 COCC1=NC=CC=C1 OR13609 [1,1,0,0,0,0|1,0,0]=3 313 B9R1.8 ClCCC1=NC=CC=C1 OR303592 [1,1,0,0,0,0|1,0,0]=3 314 B9R1.8 N#CCC1=NC=CC=C1 OR28680 [1,1,0,0,0,0|1,0,1]=4 315 B9R1.8 NCCC1=NC=CC=C1 OR28599 [1,1,0,0,0,0|1,0,0]=3 316 B9R1.8 NCCC1=NC=CN=C1 OR1046 [1,1,0,0,0,0|0,0,0]=2 317 B9R1.8 OCCC1=CC=CN=C1 OR0520 [1,1,0,0,0,0|1,0,0]=3 318 B9R1.8 OCCC1=NC=CC=C1 OR13610 [1,1,0,0,0,0|1,0,0]=3 319 B9R1.8 SCCC1=NC=CC=C1 OR305591 [1,1,0,0,0,0|1,0,0]=3 320 B9R1.15 BrCC1=CC=CN=C1Br OR60069 [1,1,0,0,0,0|2,0,0]=4 321 B9R1.15 C#CC1=NC=CN=C1C OR53020 [1,1,0,0,0,0|0,0,2]=4 322 B9R1.15 C#CC1=NC=CN=C1Cl OR53015 [1,1,0,0,0,0|0,0,2]=4 323 B9R1.15 CC1=CC=CN=C1CN OR52052 [1,1,0,0,0,0|2,0,0]=4 324 B9R1.15 CC1=NC=CN=C1NN OR60215 [1,1,0,0,0,0|2,0,0]=4 325 B9R1.15 CCC1=C(Br)C=CC=C1 OR4187 [1,1,0,0,0,0|2,0,0]=4 326 B9R1.15 CCC1=C(Br)C=NC=N1 OR11580 [1,1,0,0,0,0|2,0,0]=4 327 B9R1.15 CCC1=C(O)C=CC=C1 OR16005 [1,1,0,0,0,0|2,0,0]=4 328 B9R1.15 CCC1=CC=CC=C1I OR30075 [1,1,0,0,0,0|2,0,0]=4 329 B9R1.15 COC1=C(N)C=CN=C1 OR46502 [1,1,0,0,0,0|2,0,0]=4 330 B9R1.15 COC1=C(O)N=CC=C1 OR20000 [1,1,0,0,0,0|2,0,0]=4 331 B9R1.15 COC1=CC=CN=C1Br OR7550 [1,1,0,0,0,0|2,0,0]=4 332 B9R1.15 COC1=CC=CN=C1Cl OR2800 [1,1,0,0,0,0|2,0,0]=4 333 B9R1.15 COC1=CC=CN=C1N OR8879 [1,1,0,0,0,0|2,0,0]=4 334 B9R1.15 COC1=CN=CC=C1O OR51777 [1,1,0,0,0,0|2,0,0]=4 335 B9R1.15 COC1=NC=CC=C1Br OR59385 [1,1,0,0,0,0|2,0,0]=4 336 B9R1.15 COC1=NC=CC=C1Cl OR8560 [1,1,0,0,0,0|2,0,0]=4 337 B9R1.15 COC1=NC=CC=C1N OR5833 [1,1,0,0,0,0|2,0,0]=4 338 B9R1.15 COC1=NC=CN=C1Cl OR61101 [1,1,0,0,0,0|1,0,0]=3 339 B9R1.15 COC1=NC=CN=C1N OR301247 [1,1,0,0,0,0|1,0,0]=3 340 B9R1.15 ClCC1=CC=CN=C1Cl OR346119 [1,1,0,0,0,0|2,0,0]=4 341 B9R1.15 N#CC1=NC=CN=C1Cl OR3400 [1,1,0,0,0,0|1,0,1]=4 342 B9R1.15 NC1=NC=CC=C1CO OR6117 [1,1,0,0,0,0|2,0,0]=4 343 B9R1.15 NCC1=NC=CC=C1Br OR307010 [1,1,0,0,0,0|2,0,0]=4 344 B9R1.15 NCC1=NC=CC=C1Br OR55277 [1,1,0,0,0,0|2,0,0]=4 345 B9R1.15 NCC1=NC=CN=C1Cl OR301313 [1,1,0,0,0,0|1,0,0]=3 346 B9R1.15 NCC1=NC=CN=C1Cl OR54357 [1,1,0,0,0,0|1,0,0]=3 347 B9R1.15 NCC1=NC=CN=C1Cl OR61103 [1,1,0,0,0,0|1,0,0]=3 348 B9R1.15 NNC1=NC=CN=C1Cl OR61106 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.15 OCC1=C(Cl)C=CN=C1 OR13855 [1,1,0,0,0,0|2,0,0]=4 350 B9R1.15 OCC1=CC=CN=C1Cl OR1462 [1,1,0,0,0,0|2,0,0]=4 351 B9R1.15 OCC1=NC=CC=C1Br OR60200 [1,1,0,0,0,0|2,0,0]=4 352 B9R1.15 OCC1=NC=CC=C1Cl OR303685 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.15 OCC1=NC=CC=C1O OR2259 [1,1,0,0,0,0|2,0,0]=4 354 B9R1.15 OCC1=NC=CN=C1Cl OR321372 [1,1,0,0,0,0|1,0,0]=3 355 B9R1.11 NCC(O)C1=CC=CO1 OR14028 [0,1,0,0,1,0|2,0,0]=4 356 B9R1.19 CC(C)(C)C1=NC=CN1 OR52331 [0,1,0,0,1,0|0,0,1]=3 357 B9R1.19 CC(C)(C)N1C=CN=C1 OR55585 [0,1,0,0,1,0|1,0,0]=3 358 B9R1.19 C[Si](C)(C)C1=NC=CS1 OR2997 [0,1,0,0,1,0|1,1,0]=4 359 B9R1.19 C[Si](C)(C)N1C=CN=C1 OR20023 [0,1,0,0,1,0|1,1,0]=4 360 B9R1.35 CC(C)C1=NC(Br)=CS1 OR15557 [0,1,0,0,1,0|1,0,0]=3 361 B9R1.35 CC(C)C1=NSC(N)=N1 OR14831 [0,1,0,0,1,0|1,0,0]=3 362 B9R1.35 CC(C)N1C=C(Br)C=N1 OR11985 [0,1,0,0,1,0|1,0,0]=3 363 B9R1.35 CC(C)N1C=NC(Br)=C1 OR302118 [0,1,0,0,1,0|1,0,0]=3 364 B9R1.35 CC(N)C1=NN(C)C=C1 OR12630 [0,1,0,0,1,0|2,0,0]=4 365 B9R1.35 CC(O)C1=NN(C)C=C1 OR12629 [0,1,0,0,1,0|2,0,0]=4 366 B9R1.41 CC(C)C1=CNN=C1N OR305561 [0,1,0,0,1,0|1,0,0]=3 367 B9R1.41 CC(C)N1C=CN=C1Cl OR17928 [0,1,0,0,1,0|1,0,0]=3 368 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 OR3204 [0,1,0,0,0,1|2,0,0]=4 369 B11R1.20 CC(C)NC1=NC=C(Br)C=N1 OR15515 [0,1,0,0,0,1|2,0,0]=4 370 B11R1.40 CC(CN)OC1=CC=CC=C1 OR12728 [0,1,0,0,0,1|2,0,0]=4 371 B11R1.86 CC(C)OC1=C(Br)C=CC=C1 OR4289 [0,1,0,0,0,1|2,0,0]=4 372 B11R1.157 CC(C)CC1=CC=CC(N)=C1 OR40688 [0,1,0,0,0,1|2,0,0]=4 373 B11R1.157 CC(C)NC1=CC(Cl)=NC=N1 OR59375 [0,1,0,0,0,1|2,0,0]=4 374 B11R1.157 CC(C)NC1=NC(Cl)=CN=C1 OR11635 [0,1,0,0,0,1|0,0,0]=2 375 B11R1.3 CC(C)C1=CC=C(C#N)C=C1 OR28694 [0,2,0,0,0,0|2,0,0]=4 376 B11R1.3 CC(C)C1=CC=C(CN)C=C1 OR51842 [0,2,0,0,0,0|2,0,0]=4 377 B11R1.3 CC(C)C1=CC=C(CO)C=C1 OR28718 [0,2,0,0,0,0|2,0,0]=4 378 B11R1.3 CC(C)C1=CC=C(NN)C=C1 OR9708 [0,2,0,0,0,0|2,0,0]=4 379 B11R1.3 CN(C)C1=CC=C(C#N)C=N1 OR12084 [0,2,0,0,0,0|2,0,0]=4 380 B11R1.3 CN(C)C1=CC=C(C=O)C=N1 OR46111 [0,2,0,0,0,0|2,0,0]=4 381 B11R1.3 COC1=CC=C(C(C)C)C=C1 OR6453 [0,2,0,0,0,0|2,0,0]=4 382 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 OR18318 [0,2,0,0,0,0|2,0,0]=4 383 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 OR9457 [0,2,0,0,0,0|2,0,0]=4 384 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 OR7218 [0,2,0,0,0,0|2,0,0]=4 385 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 OR4958 [0,2,0,0,0,0|2,0,0]=4 386 B11R1.19 CC(C)(C)C1=CC=C(S)C=C1 OR10686 [0,2,0,0,0,0|2,0,0]=4 387 B11R1.19 CC(C)(N)C1=CC=C(Cl)C=C1 OR6114 [0,2,0,0,0,0|2,0,0]=4 388 B11R1.19 CC(C)(O)C1=CC=C(Br)C=N1 OR302203 [0,2,0,0,0,0|1,0,0]=3 389 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 OR2820 [0,2,0,0,0,0|2,0,0]=4 390 B11R1.21 CC(C)C1=CC(Br)=C(N)C=C1 OR4598 [0,2,0,0,0,0|2,0,0]=4 391 B11R1.21 CC1=C(Br)C=NC([C@H](C)N)=C1 OR52306 [0,2,0,0,0,0|2,0,0]=4 392 B11R1.22 COC(=O)C1=CN=C(Br)C=N1 OR302107 [0,2,0,0,0,0|1,0,1]=4 393 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 OR59463 [0,2,0,0,0,0|1,0,1]=4 394 B11R1.22 COC(=O)C1=NC=C(O)N=C1 OR301122 [0,2,0,0,0,0|1,0,1]=4 395 B11R1.166 CC(C)C1=C(O)C=C(O)C=C1 OR70132 [0,2,0,0,0,0|2,0,0]=4 396 B11R1.166 CC1=C(C(C)C)C=CC(N)=C1 OR28929 [0,2,0,0,0,0|2,0,0]=4 397 B11R1.166 CC1=CC(C)=NC=C1[C@H](C)N OR52305 [0,2,0,0,0,0|2,0,0]=4 398 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 OR29220 [0,2,0,0,0,0|2,0,0]=4 399 B11R1.7 CC(C)(C#N)C1=NC=CC=C1 OR318112 [0,2,0,0,0,0|1,0,0]=3 400 B11R1.7 CC(C)(C#N)C1=NC=CN=C1 OR318117 [0,2,0,0,0,0|0,0,0]=2 401 B11R1.7 CC(C)(CN)C1=CC=CC=C1 OR16558 [0,2,0,0,0,0|2,0,0]=4 402 B11R1.7 CC(C)(CN)C1=NC=CN=C1 OR55001 [0,2,0,0,0,0|0,0,0]=2 403 B11R1.12 CCB(CC)C1=CC=CN=C1 OR315000 [0,2,0,0,0,0|2,0,0]=4 404 B11R1.12 COB(OC)C1=NC=CC=C1 OR4244 [0,2,0,0,0,0|2,0,0]=4 405 B11R1.12 COC(OC)C1=CC=CC=C1 OR3467 [0,2,0,0,0,0|2,0,0]=4 406 B11R1.12 O=CC(C=O)C1=NC=CN=C1 OR4778 [0,2,0,0,0,0|0,0,2]=4 407 B11R1.12 OCC(CO)C1=CC=CC=C1 OR52224 [0,2,0,0,0,0|2,0,0]=4 408 B11R1.16 CC(NC=O)C1=CC=CC=N1 OR01596 [0,2,0,0,0,0|1,0,1]=4 409 B11R1.16 CC(NC=O)C1=CC=CN=C1 OR01595 [0,2,0,0,0,0|1,0,1]=4 410 B11R1.16 CCCC(N)C1=CN=CC=C1 OR470277 [0,2,0,0,0,0|2,0,0]=4 411 B11R1.16 CN(CCO)C1=NC=CC=C1 OR17029 [0,2,0,0,0,0|2,0,0]=4 412 B11R1.23 COC(=O)C1=NC(Cl)=CN=C1 OR301016 [0,2,0,0,0,0|1,0,1]=4 413 B11R1.222 CCC(C)C1=C(Br)C=NC=N1 OR11574 [0,2,0,0,0,0|2,0,0]=4 414 B11R1.222 COC(=O)C1=NC=CN=C1I OR321370 [0,2,0,0,0,0|1,0,1]=4 415 B11R1.222 COC(=O)C1=NC=CN=C1N OR4812 [0,2,0,0,0,0|1,0,1]=4 416 B11R1.87 CC(C)(C)C1=CC=CC=C1S OR27931 [0,2,0,0,0,0|2,0,0]=4 417 B11R1.87 CC(C)(N)C1=C(Br)C=CC=C1 OR61238 [0,2,0,0,0,0|2,0,0]=4 418 B11R1.87 CC(C)(N)C1=C(Cl)C=CC=C1 OR61219 [0,2,0,0,0,0|2,0,0]=4 419 B11R1.87 CC(C)(O)C1=CC=CC=C1Br OR54591 [0,2,0,0,0,0|2,0,0]=4 420 B11R1.155 CC(C)(C)C1=CC(N)=NC=N1 OR4772 [0,2,0,0,0,0|2,0,0]=4 421 B11R1.155 CC(C)(C)C1=CC=CC(Br)=C1 OR1066 [0,2,0,0,0,0|2,0,0]=4 422 B11R1.155 CC(C)(C)C1=CC=CC(N)=C1 OR3212 [0,2,0,0,0,0|2,0,0]=4 423 B11R1.155 CC(C)(C)C1=CC=CC(N)=C1 OR4922 [0,2,0,0,0,0|2,0,0]=4 424 B11R1.155 CC(C)(C)C1=CC=NC(N)=N1 OR310038 [0,2,0,0,0,0|2,0,0]=4 425 B11R1.155 CC(C)(C)C1=NC=NC(Cl)=C1 OR61066 [0,2,0,0,0,0|2,0,0]=4 426 B11R1.155 CC(C)(N)C1=CC=CC(Cl)=C1 OR61224 [0,2,0,0,0,0|2,0,0]=4 427 B11R1.155 CC(C)(O)C1=CC=CC(I)=C1 OR52523 [0,2,0,0,0,0|2,0,0]=4 428 B11R1.155 CC(C)(O)C1=NC=CC(Br)=C1 OR350034 [0,2,0,0,0,0|1,0,0]=3 429 B11R1.53 CN(C)C1=C(C#N)C=CC=N1 OR12083 [0,2,0,0,0,0|2,0,0]=4 430 B11R1.53 CN(C)C1=NC=CC=C1C=O OR15489 [0,2,0,0,0,0|2,0,0]=4 431 B11R1.53 COC1=NC=CC=C1C(C)O OR302199 [0,2,0,0,0,0|2,0,0]=4 432 B11R1.159 CC1=C(N)C(C(C)C)=CC=C1 OR28768 [0,2,0,0,0,0|2,0,0]=4 433 B11R1.74 CC(C)C1=CC(Br)=CC(Br)=C1 OR1069 [0,2,0,0,0,0|2,0,0]=4 434 B11R1.74 CC(C)C1=NC(N)=NC(Cl)=C1 OR10626 [0,2,0,0,0,0|2,0,0]=4 435 B11R1.266 CC(C)C1=CC=CC(C=O)=C1 OR19548 [0,2,0,0,0,0|2,0,0]=4 436 B9R1.13 CC(C)CC1=NC=CS1 OR8109 [0,0,1,1,0,0|1,0,1]=4 437 B9R2.2 C1=CC(C2CC2)=NN1 OR303295 [0,0,0,1,1,0|1,0,0]=3 438 B11R2.10 CC1CC2=C(C=CC=C2)N1 OR10176 [0,0,0,1,0,1|2,0,0]=4 439 B11R2.238 C1=CC=C(SC2CC2)C=C1 OR18541 [0,0,0,1,0,1|2,0,0]=4 440 B11R2.34 BrC1=CC=C(C2CC2)C=C1 OR8621 [0,1,0,1,0,0|2,0,0]=4 441 B11R2.34 OC1=CC=C(C2CC2)C=C1 OR70008 [0,1,0,1,0,0|2,0,0]=4 442 B11R2.40 NC1(C2=CC=CC=C2)CC1 OR302455 [0,1,0,1,0,0|2,0,0]=4 443 B11R2.40 NC1(C2=CC=CC=C2)CC1 OR60203 [0,1,0,1,0,0|2,0,0]=4 444 B11R2.239 C1=CC=C(C2CNC2)N=C1 OR303854 [0,1,0,1,0,0|1,0,0]=3 445 B11R2.55 BrC1=C(C2CC2)C=CC=C1 OR307196 [0,1,0,1,0,0|2,0,0]=4 446 B11R2.55 NC1=NC=CN=C1C2CC2 OR300238 [0,1,0,1,0,0|0,0,0]=2 447 B11R2.55 OC1=C(C2CC2)C=CC=C1 OR70019 [0,1,0,1,0,0|2,0,0]=4 448 B11R2.35 BrC1=CC(C2CC2)=CC=C1 OR2979 [0,1,0,1,0,0|2,0,0]=4 449 B11R2.35 NC1=CC(C2CC2)=CC=C1 OR307256 [0,1,0,1,0,0|2,0,0]=4 450 B11R2.35 OC1=CC(C2CC2)=CC=C1 OR70007 [0,1,0,1,0,0|2,0,0]=4 451 B7R1.1 BrCC1=CN=CO1 OR59852 [1,0,0,0,1,0|2,0,0]=4 452 B7R1.1 BrCC1=COC=C1 OR400006 [1,0,0,0,1,0|2,0,0]=4 453 B7R1.1 BrCC1=COC=N1 OR59848 [1,0,0,0,1,0|2,0,0]=4 454 B7R1.1 BrCC1=CSC=C1 OR43653 [1,0,0,0,1,0|2,0,0]=4 455 B7R1.1 BrCC1=CSC=N1 OR400168 [1,0,0,0,1,0|2,0,0]=4 456 B7R1.1 CCC1=CC=CN1 OR42007 [1,0,0,0,1,0|0,0,1]=3 457 B7R1.1 CCC1=CC=CO1 OR6028 [1,0,0,0,1,0|1,0,0]=3 458 B7R1.1 CCC1=CC=CS1 OR7250 [1,0,0,0,1,0|1,0,0]=3 459 B7R1.1 CCC1=CSC=N1 OR303339 [1,0,0,0,1,0|1,0,0]=3 460 B7R1.1 CCC1=NC=CN1 OR2906 [1,0,0,0,1,0|0,0,1]=3 461 B7R1.1 CCN1C=CC=N1 OR61206 [1,0,0,0,1,0|1,0,0]=3 462 B7R1.1 CCN1C=CN=C1 OR2905 [1,0,0,0,1,0|1,0,0]=3 463 B7R1.1 COC1=CSC=C1 OR6628 [1,0,0,0,1,0|2,0,0]=4 464 B7R1.1 CSC1=CC=CS1 OR4091 [1,0,0,0,1,0|2,0,0]=4 465 B7R1.1 CSC1=CSC=C1 OR25457 [1,0,0,0,1,0|2,0,0]=4 466 B7R1.1 ClCC1=CC=CO1 OR310257 [1,0,0,0,1,0|2,0,0]=4 467 B7R1.1 ClCC1=CC=CS1 OR305427 [1,0,0,0,1,0|2,0,0]=4 468 B7R1.1 ClCC1=CNC=N1 OR15569 [1,0,0,0,1,0|1,0,1]=4 469 B7R1.1 ClCC1=CSC=C1 OR6634 [1,0,0,0,1,0|2,0,0]=4 470 B7R1.1 ClCC1=CSC=N1 OR15568 [1,0,0,0,1,0|2,0,0]=4 471 B7R1.1 ClCC1=NC=CN1 OR7713 [1,0,0,0,1,0|1,0,1]=4 472 B7R1.1 ClCC1=NC=CO1 OR301217 [1,0,0,0,1,0|2,0,0]=4 473 B7R1.1 ClCC1=NOC=N1 OR1286 [1,0,0,0,1,0|2,0,0]=4 474 B7R1.1 NCC1=CC=CO1 OR23026 [1,0,0,0,1,0|2,0,0]=4 475 B7R1.1 NCC1=CC=CS1 OR6799 [1,0,0,0,1,0|2,0,0]=4 476 B7R1.1 NCC1=CN=CO1 OR59854 [1,0,0,0,1,0|2,0,0]=4 477 B7R1.1 NCC1=CN=CS1 OR20040 [1,0,0,0,1,0|2,0,0]=4 478 B7R1.1 NCC1=CN=CS1 OR30800 [1,0,0,0,1,0|2,0,0]=4 479 B7R1.1 NCC1=COC=C1 OR12311 [1,0,0,0,1,0|2,0,0]=4 480 B7R1.1 NCC1=COC=C1 OR23031 [1,0,0,0,1,0|2,0,0]=4 481 B7R1.1 NCC1=COC=N1 OR17028 [1,0,0,0,1,0|2,0,0]=4 482 B7R1.1 NCC1=COC=N1 OR59850 [1,0,0,0,1,0|2,0,0]=4 483 B7R1.1 NCC1=CSC=C1 OR23203 [1,0,0,0,1,0|2,0,0]=4 484 B7R1.1 NCC1=NC=CN1 OR6209 [1,0,0,0,1,0|1,0,1]=4 485 B7R1.1 NCC1=NC=CO1 OR313058 [1,0,0,0,1,0|2,0,0]=4 486 B7R1.1 NCC1=NC=CS1 OR59828 [1,0,0,0,1,0|2,0,0]=4 487 B7R1.1 NCC1=NC=CS1 OR61043 [1,0,0,0,1,0|2,0,0]=4 488 B7R1.1 NCC1=NOC=N1 OR6210 [1,0,0,0,1,0|2,0,0]=4 489 B7R1.1 OCC1=CC=CO1 OR23024 [1,0,0,0,1,0|2,0,0]=4 490 B7R1.1 OCC1=CC=CS1 OR59889 [1,0,0,0,1,0|2,0,0]=4 491 B7R1.1 OCC1=CC=NS1 OR18560 [1,0,0,0,1,0|2,0,0]=4 492 B7R1.1 OCC1=CN=CO1 OR3790 [1,0,0,0,1,0|2,0,0]=4 493 B7R1.1 OCC1=CN=CS1 OR5597 [1,0,0,0,1,0|2,0,0]=4 494 B7R1.1 OCC1=CNC=N1 OR2014 [1,0,0,0,1,0|1,0,1]=4 495 B7R1.1 OCC1=CNC=N1 OR6427 [1,0,0,0,1,0|1,0,1]=4 496 B7R1.1 OCC1=CNN=C1 OR302030 [1,0,0,0,1,0|2,0,0]=4 497 B7R1.1 OCC1=COC=C1 OR23029 [1,0,0,0,1,0|2,0,0]=4 498 B7R1.1 OCC1=COC=N1 OR59847 [1,0,0,0,1,0|2,0,0]=4 499 B7R1.1 OCC1=CSC=C1 OR10141 [1,0,0,0,1,0|2,0,0]=4 500 B7R1.1 OCC1=CSC=N1 OR5598 [1,0,0,0,1,0|2,0,0]=4 501 B7R1.1 OCC1=NC=CN1 OR23115 [1,0,0,0,1,0|1,0,1]=4 502 B7R1.1 OCC1=NC=CN1 OR6415 [1,0,0,0,1,0|1,0,1]=4 503 B7R1.1 OCC1=NC=CO1 OR59845 [1,0,0,0,1,0|2,0,0]=4 504 B7R1.1 OCC1=NC=CS1 OR14307 [1,0,0,0,1,0|2,0,0]=4 505 B7R1.1 OCC1=NNC=C1 OR52395 [1,0,0,0,1,0|2,0,0]=4 506 B7R1.1 OCC1=NOC=C1 OR305308 [1,0,0,0,1,0|2,0,0]=4 507 B7R1.1 SCC1=CC=CS1 OR51965 [1,0,0,0,1,0|2,0,0]=4 508 B11R1.91 CN(C)CCC1=NC=CC=C1 OR28892 [0,0,0,0,0,2|2,0,0]=4