0 B8R1.4 BrC1=CC(I)=CC=N1 B050026 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.4 BrC1=CC=NC(Br)=C1 B050031 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.4 ClC1=CC=NC(Cl)=C1 B050033 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.4 FC1=CC=NC(Cl)=C1 B050032 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.2 CC1=NC=CC(CN)=N1 B059729 [0,1,0,0,0,0|1,0,0]=2 5 B9R1.2 NC1=NC=CC(CO)=C1 B039501 [0,1,0,0,0,0|3,0,0]=4 6 B9R1.3 NC1=CC=CC(N)=C1N B050139 [0,1,0,0,0,0|3,0,0]=4 7 B9R1.34 CC1=CC(O)=CC(=O)O1 B048736 [0,1,0,0,0,0|2,0,0]=3 8 B9R1.69 CC1=C(Cl)N=CC(Br)=C1 B049974 [0,1,0,0,0,0|3,0,0]=4 9 B9R1.69 CC1=C(O)N=CC(Br)=C1 B049976 [0,1,0,0,0,0|3,0,0]=4 10 B9R1.69 CC1=NC(C)=C(N)C=C1 B049993 [0,1,0,0,0,0|0,0,0]=1 11 B9R1.69 CC1=NC(C)=C(O)C=C1 B049973 [0,1,0,0,0,0|0,0,0]=1 12 B9R1.69 CC1=NC(N)=CC=C1I B049349 [0,1,0,0,0,0|1,0,0]=2 13 B9R1.69 NC1=CC(Br)=C(F)C=C1 B049228 [0,1,0,0,0,0|3,0,0]=4 14 B9R1.69 NC1=CC(N)=C(N)C=C1 B050159 [0,1,0,0,0,0|3,0,0]=4 15 B7R1.2 CC1=CN(C)C=N1 B046338 [0,0,0,0,1,0|3,0,0]=4 16 B7R1.2 CC1=CN(C)N=C1 B046181 [0,0,0,0,1,0|3,0,0]=4 17 B7R1.2 CC1=NN(C)C=C1 B006757 [0,0,0,0,1,0|1,0,0]=2 18 B7R1.2 CN1C=CC(Br)=N1 B047103 [0,0,0,0,1,0|2,0,0]=3 19 B7R1.2 CN1C=CC(I)=N1 B050971 [0,0,0,0,1,0|2,0,0]=3 20 B7R1.2 CN1C=CC(N)=N1 B014443 [0,0,0,0,1,0|2,0,0]=3 21 B7R1.2 CN1C=NC(Br)=N1 B051474 [0,0,0,0,1,0|3,0,0]=4 22 B7R1.2 CN1C=NC(N)=N1 B046208 [0,0,0,0,1,0|3,0,0]=4 23 B7R1.2 FC1=CC=C(Br)S1 B052433 [0,0,0,0,1,0|3,0,0]=4 24 B7R1.2 FC1=CC=C(I)S1 B052477 [0,0,0,0,1,0|3,0,0]=4 25 B7R1.4 CC1=CC=NN1C B006758 [0,0,0,0,1,0|2,0,0]=3 26 B7R1.4 CC1=CN=CN1C B051897 [0,0,0,0,1,0|2,0,0]=3 27 B7R1.4 CC1=CNN=C1N B007334 [0,0,0,0,1,0|3,0,0]=4 28 B7R1.4 CC1=CNN=C1N B039349 [0,0,0,0,1,0|3,0,0]=4 29 B7R1.4 CC1=NC=CN1C B046339 [0,0,0,0,1,0|2,0,0]=3 30 B7R1.4 CC1=NNC=C1Br B030262 [0,0,0,0,1,0|3,0,0]=4 31 B7R1.4 CC1=NNC=C1Cl B020772 [0,0,0,0,1,0|3,0,0]=4 32 B7R1.4 CC1=NNC=C1I B047689 [0,0,0,0,1,0|3,0,0]=4 33 B7R1.4 CC1=NNC=C1N B020740 [0,0,0,0,1,0|3,0,0]=4 34 B7R1.4 CC1=NNC=C1N B047500 [0,0,0,0,1,0|3,0,0]=4 35 B7R1.4 CN1N=CC=C1Br B051184 [0,0,0,0,1,0|3,0,0]=4 36 B7R1.4 CN1N=CC=C1F B052471 [0,0,0,0,1,0|3,0,0]=4 37 B7R1.4 CN1N=CC=C1I B051213 [0,0,0,0,1,0|3,0,0]=4 38 B7R1.4 CN1N=CC=C1N B024266 [0,0,0,0,1,0|3,0,0]=4 39 B7R1.4 CN1N=CC=C1N B029997 [0,0,0,0,1,0|3,0,0]=4 40 B8R1.2 NCC1=NC=CN=C1 B050555 [1,1,0,0,0,0|1,0,0]=3 41 B8R1.3 BrC1=CC=C(I)C=N1 B050029 [1,1,0,0,0,0|1,0,0]=3 42 B8R1.3 CC1=CN=C(O)N=C1 B038992 [1,1,0,0,0,0|2,0,0]=4 43 B8R1.3 CC1=CN=C(S)N=C1 B016326 [1,1,0,0,0,0|2,0,0]=4 44 B8R1.3 CC1=CN=C(S)N=C1 B029371 [1,1,0,0,0,0|2,0,0]=4 45 B8R1.3 ClC1=CC=C(Br)C=N1 B050028 [1,1,0,0,0,0|1,0,0]=3 46 B8R1.3 ClC1=CC=C(I)C=N1 B050030 [1,1,0,0,0,0|1,0,0]=3 47 B8R1.5 ClC1=C(I)C=CC=N1 B050034 [1,1,0,0,0,0|1,0,0]=3 48 B8R1.5 NC1=C(Br)C=CC=N1 B049992 [1,1,0,0,0,0|1,0,0]=3 49 B8R1.1 C#CC1=NN(C)C=C1 B050922 [0,1,0,0,1,0|1,0,1]=4 50 B8R1.1 CC1=CC=C(C=O)S1 B015983 [0,1,0,0,1,0|1,0,1]=4 51 B8R1.1 CC1=CC=C(CN)S1 B030516 [0,1,0,0,1,0|1,0,0]=3 52 B8R1.1 CC1=CSC(CCl)=N1 B059707 [0,1,0,0,1,0|1,0,0]=3 53 B8R1.1 CC1=CSC(CN)=N1 B030505 [0,1,0,0,1,0|1,0,0]=3 54 B8R1.1 CC1=NC(CCl)=NO1 B050364 [0,1,0,0,1,0|2,0,0]=4 55 B8R1.1 CC1=NNC(CN)=N1 B049336 [0,1,0,0,1,0|2,0,0]=4 56 B8R1.1 CC1=NOC(CCl)=N1 B050389 [0,1,0,0,1,0|2,0,0]=4 57 B8R1.1 CCN1C=CC(Br)=N1 B050957 [0,1,0,0,1,0|2,0,0]=4 58 B8R1.1 CCN1C=CC(C)=N1 B006751 [0,1,0,0,1,0|1,0,0]=3 59 B8R1.1 CCN1C=CC(I)=N1 B050972 [0,1,0,0,1,0|2,0,0]=4 60 B8R1.1 CCN1C=CC(N)=N1 B014445 [0,1,0,0,1,0|2,0,0]=4 61 B8R1.1 CCN1C=CC(N)=N1 B051587 [0,1,0,0,1,0|2,0,0]=4 62 B8R1.1 CN1C=CC(C#N)=N1 B019526 [0,1,0,0,1,0|1,0,1]=4 63 B8R1.1 CN1C=CC(C=O)=N1 B007390 [0,1,0,0,1,0|1,0,1]=4 64 B8R1.1 CN1C=CC(CCl)=N1 B047328 [0,1,0,0,1,0|1,0,0]=3 65 B8R1.1 CN1C=CC(CN)=N1 B007402 [0,1,0,0,1,0|1,0,0]=3 66 B8R1.1 CN1C=CC(CN)=N1 B016053 [0,1,0,0,1,0|1,0,0]=3 67 B8R1.1 CN1C=CC(CO)=N1 B047329 [0,1,0,0,1,0|1,0,0]=3 68 B8R1.1 FC1=CC=C(CBr)S1 B058943 [0,1,0,0,1,0|2,0,0]=4 69 B8R1.1 FC1=CC=C(CCl)S1 B052448 [0,1,0,0,1,0|2,0,0]=4 70 B8R1.1 NC1=NC(CO)=CS1 B050737 [0,1,0,0,1,0|2,0,0]=4 71 B8R1.1 NCC1=CC=C(F)S1 B052432 [0,1,0,0,1,0|2,0,0]=4 72 B8R1.1 OCC1=CC=C(F)S1 B046290 [0,1,0,0,1,0|2,0,0]=4 73 B8R1.1 OCN1C=CC(Br)=N1 B062416 [0,1,0,0,1,0|2,0,0]=4 74 B8R1.1 OCN1C=CC(I)=N1 B062417 [0,1,0,0,1,0|2,0,0]=4 75 B8R1.18 CC1=CC(Br)=NN1C B050946 [0,1,0,0,1,0|2,0,0]=4 76 B8R1.18 CC1=CC(Cl)=NN1C B058980 [0,1,0,0,1,0|2,0,0]=4 77 B8R1.18 CC1=CC(I)=NN1C B050965 [0,1,0,0,1,0|2,0,0]=4 78 B8R1.18 CC1=CC(N)=NN1C B020972 [0,1,0,0,1,0|2,0,0]=4 79 B8R1.18 CC1=CC(N)=NN1C B039190 [0,1,0,0,1,0|2,0,0]=4 80 B8R1.18 CC1=CC(N)=NN1C B047156 [0,1,0,0,1,0|2,0,0]=4 81 B8R1.18 CC1=CN(C)N=C1N B039135 [0,1,0,0,1,0|2,0,0]=4 82 B8R1.18 CC1=CN(C)N=C1N B051832 [0,1,0,0,1,0|2,0,0]=4 83 B8R1.18 CC1=NN(C)C(F)=C1 B051212 [0,1,0,0,1,0|1,0,0]=3 84 B8R1.18 CC1=NN(C)C(N)=C1 B024294 [0,1,0,0,1,0|1,0,0]=3 85 B8R1.18 CC1=NN(C)C(N)=C1 B051584 [0,1,0,0,1,0|1,0,0]=3 86 B8R1.18 CC1=NN(C)C=C1Br B019512 [0,1,0,0,1,0|1,0,0]=3 87 B8R1.18 CC1=NN(C)C=C1Cl B039711 [0,1,0,0,1,0|1,0,0]=3 88 B8R1.18 CC1=NN(C)C=C1I B047730 [0,1,0,0,1,0|1,0,0]=3 89 B8R1.18 CC1=NN(C)C=C1N B006417 [0,1,0,0,1,0|1,0,0]=3 90 B8R1.18 CC1=NN(C)C=C1N B029435 [0,1,0,0,1,0|1,0,0]=3 91 B8R1.18 CN1C=C(Br)C(N)=N1 B024259 [0,1,0,0,1,0|2,0,0]=4 92 B8R1.18 CN1C=C(Cl)C(I)=N1 B062278 [0,1,0,0,1,0|2,0,0]=4 93 B8R1.18 CN1C=C(Cl)C(N)=N1 B020970 [0,1,0,0,1,0|2,0,0]=4 94 B8R1.18 CN1C=C(Cl)C(N)=N1 B030000 [0,1,0,0,1,0|2,0,0]=4 95 B8R1.18 CN1C=C(I)C(N)=N1 B047919 [0,1,0,0,1,0|2,0,0]=4 96 B8R1.18 CN1C=C(N)C(Br)=N1 B062304 [0,1,0,0,1,0|2,0,0]=4 97 B8R1.18 CN1C=C(N)C(N)=N1 B051139 [0,1,0,0,1,0|2,0,0]=4 98 B8R1.18 CN1N=C(Br)C=C1N B062308 [0,1,0,0,1,0|2,0,0]=4 99 B8R1.18 CN1N=C(I)C=C1N B062329 [0,1,0,0,1,0|2,0,0]=4 100 B8R1.18 CN1N=C(N)C=C1Br B062307 [0,1,0,0,1,0|2,0,0]=4 101 B8R1.18 CN1N=C(N)C=C1I B062365 [0,1,0,0,1,0|2,0,0]=4 102 B8R1.18 CN1N=C(N)C=C1N B047464 [0,1,0,0,1,0|2,0,0]=4 103 B8R1.11 CC1=C(CBr)SC=N1 B059808 [0,1,0,0,1,0|2,0,0]=4 104 B8R1.11 CC1=C(CO)N=CN1 B037486 [0,1,0,0,1,0|2,0,0]=4 105 B8R1.11 CC1=C(CO)SC=N1 B059809 [0,1,0,0,1,0|2,0,0]=4 106 B8R1.11 CC1=CNN=C1CO B058953 [0,1,0,0,1,0|2,0,0]=4 107 B8R1.11 CC1=NNC=C1CN B049608 [0,1,0,0,1,0|2,0,0]=4 108 B8R1.11 CCC1=CC=NN1C B037958 [0,1,0,0,1,0|2,0,0]=4 109 B8R1.11 CCN1C=NC=C1C B051962 [0,1,0,0,1,0|2,0,0]=4 110 B8R1.11 CCN1N=CC=C1C B006759 [0,1,0,0,1,0|2,0,0]=4 111 B8R1.11 CN1C=CN=C1CCl B049898 [0,1,0,0,1,0|2,0,0]=4 112 B8R1.11 CN1N=CC=C1CBr B052534 [0,1,0,0,1,0|2,0,0]=4 113 B8R1.11 CN1N=CC=C1CCl B036160 [0,1,0,0,1,0|2,0,0]=4 114 B8R1.11 CN1N=CC=C1CCl B062237 [0,1,0,0,1,0|2,0,0]=4 115 B8R1.11 CN1N=CC=C1CN B007404 [0,1,0,0,1,0|2,0,0]=4 116 B8R1.11 CN1N=CC=C1CN B016043 [0,1,0,0,1,0|2,0,0]=4 117 B8R1.11 CN1N=CC=C1CO B030040 [0,1,0,0,1,0|2,0,0]=4 118 B10R1.8 CC1=CC(C)=NC(NN)=N1 B036380 [0,2,0,0,0,0|2,0,0]=4 119 B10R1.10 CNCC1=CC(O)=CC=C1 B039552 [0,2,0,0,0,0|2,0,0]=4 120 B10R1.176 CCC1=CC=C(O)C(N)=C1 B037973 [0,2,0,0,0,0|2,0,0]=4 121 B10R1.22 CC1=CC(=O)N(N)C(C)=C1 B016034 [0,2,0,0,0,0|1,0,1]=4 122 B10R1.22 CC1=CC(Br)=CC(C)=C1N B048771 [0,2,0,0,0,0|1,0,0]=3 123 B10R1.22 CC1=CC(C)=C(N)C(=O)N1 B048546 [0,2,0,0,0,0|1,0,1]=4 124 B10R1.22 CC1=CC(C)=NC(Cl)=C1N B050629 [0,2,0,0,0,0|1,0,0]=3 125 B6R1.2 BrC1=NNC=C1 B050964 [1,0,0,0,1,0|2,0,0]=4 126 B6R1.2 CC1=CNN=C1 B014452 [1,0,0,0,1,0|2,0,0]=4 127 B6R1.2 CC1=NN=CN1 B037419 [1,0,0,0,1,0|2,0,0]=4 128 B6R1.2 CC1=NNC=C1 B022230 [1,0,0,0,1,0|1,0,0]=3 129 B6R1.2 CN1C=CC=N1 B006761 [1,0,0,0,1,0|1,0,0]=3 130 B6R1.2 CN1C=CN=C1 B039756 [1,0,0,0,1,0|2,0,0]=4 131 B6R1.2 CN1C=NC=N1 B051876 [1,0,0,0,1,0|2,0,0]=4 132 B6R1.2 FC1=CC=CS1 B039753 [1,0,0,0,1,0|2,0,0]=4 133 B6R1.2 IC1=NNC=C1 B050979 [1,0,0,0,1,0|2,0,0]=4 134 B6R1.2 NC1=NNC=C1 B007331 [1,0,0,0,1,0|2,0,0]=4 135 B6R1.2 NC1=NNC=C1 B037276 [1,0,0,0,1,0|2,0,0]=4