0 B13R1.45 C\C(=N/NC(N)=O)C1=CC=CC=C1 OR15508 [0,1,0,0,0,0|1,0,0]=2 1 B13R2.10 CC1=CC(C2=CC=CC=C2)=NN1 OR15354 [0,0,0,1,0,0|2,0,0]=3 2 B13R2.10 CC1=COC(C2=CC=CC=C2)=N1 OR110144 [0,0,0,1,0,0|3,0,0]=4 3 B13R2.10 CC1=NC(C2=CC=CC=C2)=NO1 OR01541 [0,0,0,1,0,0|2,0,0]=3 4 B13R2.10 CC1=NC(C2=CC=NC=C2)=NO1 OR01543 [0,0,0,1,0,0|3,0,0]=4 5 B13R2.10 ClC1=NC(C2=CC=CN=C2)=NS1 OR346104 [0,0,0,1,0,0|3,0,0]=4 6 B13R2.10 NC1=CC(C2=CC=CC=C2)=NN1 OR3021 [0,0,0,1,0,0|1,0,0]=2 7 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 OR15239 [0,0,0,1,0,0|2,0,0]=3 8 B13R2.10 NC1=NC(C2=CC=CC=C2)=NN1 OR307244 [0,0,0,1,0,0|0,0,0]=1 9 B13R2.10 NC1=NC(C2=CC=CC=C2)=NS1 OR14852 [0,0,0,1,0,0|1,0,0]=2 10 B13R2.10 NC1=NC(C2=CC=NC=C2)=CS1 OR2532 [0,0,0,1,0,0|3,0,0]=4 11 B13R2.10 NC1=NC(C2=CC=NC=C2)=NS1 OR14853 [0,0,0,1,0,0|2,0,0]=3 12 B13R2.10 NC1=NC(C2=CN=CC=C2)=CS1 OR1300 [0,0,0,1,0,0|3,0,0]=4 13 B13R2.10 NC1=NC(C2=CN=CC=C2)=NS1 OR303744 [0,0,0,1,0,0|2,0,0]=3 14 B13R2.10 NC1=NN=C(C2=CC=CC=C2)O1 OR6135 [0,0,0,1,0,0|1,0,1]=3 15 B13R2.10 NC1=NN=C(C2=CC=CC=C2)S1 OR13738 [0,0,0,1,0,0|1,0,1]=3 16 B13R2.10 NC1=NN=C(C2=CC=NC=C2)S1 OR13740 [0,0,0,1,0,0|2,0,1]=4 17 B13R2.10 NC1=NNC(C2=CC=CC=C2)=C1 OR4440 [0,0,0,1,0,0|1,0,2]=4 18 B13R2.10 NC1=NOC(C2=CN=CC=C2)=N1 OR18583 [0,0,0,1,0,0|2,0,1]=4 19 B13R2.10 O=C1CC(C2=CC=CC=C2)=NO1 OR27082 [0,0,0,1,0,0|3,0,0]=4 20 B13R2.10 OC1=CSC(C2=CC=CC=C2)=N1 OR15120 [0,0,0,1,0,0|3,0,0]=4 21 B13R2.10 SC1=NN=C(C2=CC=CC=C2)O1 OR13743 [0,0,0,1,0,0|2,0,1]=4 22 B13R2.72 CC(=O)N1C=CC2=C1C=CC=C2 OR9676 [0,0,0,1,0,0|3,0,0]=4 23 B13R2.72 N=C(N)C1=CSC2=C1C=CC=C2 OR23181 [0,0,0,1,0,0|3,0,0]=4 24 B11R1.91 N=C(N)COC1=CC=CC=C1 OR29775 [0,0,0,0,1,0|2,0,0]=3 25 B11R1.91 N=C(N)CSC1=CC=CC=C1 OR29804 [0,0,0,0,1,0|2,0,0]=3 26 B11R1.91 NC(=O)NCC1=CC=CN=C1 OR61328 [0,0,0,0,1,0|2,0,1]=4 27 B11R1.91 NC(=O)OCC1=CC=CC=C1 OR40596 [0,0,0,0,1,0|2,0,1]=4 28 B11R1.91 NC(=S)NCC1=CC=CC=C1 OR4845 [0,0,0,0,1,0|1,0,1]=3 29 B11R1.91 NC(N)=NCC1=CC=CC=C1 OR61212 [0,0,0,0,1,0|0,0,2]=3 30 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 OR2364 [0,0,0,0,1,0|3,0,0]=4 31 B10R1.17 O=CC=CC1=CC=CC=C1 OR55404 [2,0,0,0,0,0|2,0,0]=4 32 B10R1.17 O=C\C=C\C1=CC=CC=C1 OR9517 [2,0,0,0,0,0|2,0,0]=4 33 B12R1.21 N=C(N)COC1=CC=C(Cl)C=C1 OR0272 [0,1,0,0,1,0|2,0,0]=4 34 B12R1.107 NC(=S)NC(=O)C1=CC=CC=C1 OR4861 [0,1,0,0,1,0|1,0,0]=3 35 B12R1.125 N=C(N)COC1=CC=CC=C1Cl OR29776 [0,1,0,0,1,0|2,0,0]=4 36 B12R1.226 N=C(N)NCC1=CC=CC(Br)=C1 OR6468 [0,1,0,0,1,0|0,0,1]=3 37 B12R1.226 N=C(N)NCC1=CC=CC(I)=C1 OR6467 [0,1,0,0,1,0|0,0,1]=3 38 B14R1.5978 N=C(N)NC(=N)NC1=CC(Cl)=CC=C1 OR0928 [0,2,0,0,0,0|2,0,0]=4 39 B14R1.337 N=C(N)NC(=N)NC1=C(Cl)C=CC=C1 OR3912 [0,2,0,0,0,0|2,0,0]=4 40 B14R1.4920 N=C(N)N\N=C\C1=C(Cl)C=CC=C1Cl OR51915 [0,2,0,0,0,0|0,0,0]=2 41 B14R1.698 N=C(N)NC(=N)NC1=CC=C(Cl)C=C1 OR1102 [0,2,0,0,0,0|2,0,0]=4 42 B12R2.2 C1=CC(C2=NNC=C2)=CC=N1 OR110289 [1,0,0,1,0,0|2,0,0]=4 43 B12R2.2 C1=CC=C(C2=CNC=N2)C=C1 OR29380 [1,0,0,1,0,0|1,0,0]=3 44 B12R2.2 C1=CC=C(C2=NC=CN2)C=C1 OR2902 [1,0,0,1,0,0|1,0,0]=3 45 B12R2.2 C1=CC=C(C2=NN=NN2)C=C1 OR26666 [1,0,0,1,0,0|1,0,1]=4 46 B12R2.2 C1=CC=C(C2=NNC=C2)C=C1 OR9451 [1,0,0,1,0,0|1,0,0]=3 47 B12R2.2 C1=CN=C(C2=NNC=C2)C=C1 OR29238 [1,0,0,1,0,0|2,0,0]=4 48 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 OR14319 [1,0,0,1,0,0|2,0,0]=4 49 B12R2.1081 ClC1=NN=CC2=CC=CC=C21 OR2278 [1,0,0,1,0,0|1,0,1]=4 50 B12R2.1081 NC1=CN=CC2=CC=CC=C12 OR2818 [1,0,0,1,0,0|1,0,0]=3 51 B12R2.1081 O=C1NN=CC2=CC=CC=C12 OR24078 [1,0,0,1,0,0|1,0,0]=3 52 B12R2.1081 O=C1NN=NC2=CC=CC=C12 OR28692 [1,0,0,1,0,0|2,0,0]=4 53 B12R2.1081 OC1=CN=CC2=CC=CC=C12 OR48080 [1,0,0,1,0,0|2,0,0]=4 54 B12R2.24 BrC1=CC2=CC=CC=C2C=N1 OR40221 [0,0,0,1,1,0|2,0,0]=4 55 B12R2.24 BrC1=NC2=C(C=CC=C2)N=C1 OR303938 [0,0,0,1,1,0|2,0,0]=4 56 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 OR17842 [0,0,0,1,1,0|2,0,0]=4 57 B12R2.24 ClC1=CC2=CC=CC=C2C=N1 OR6098 [0,0,0,1,1,0|2,0,0]=4 58 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 OR40446 [0,0,0,1,1,0|2,0,0]=4 59 B12R2.24 ClC1=NC2=CC=CC=C2C=N1 OR17301 [0,0,0,1,1,0|1,0,0]=3 60 B12R2.24 ClC1=NC2=CC=CC=C2N=C1 OR42187 [0,0,0,1,1,0|2,0,0]=4 61 B12R2.24 NC1=CC2=CC=CC=C2C=N1 OR22000 [0,0,0,1,1,0|1,0,0]=3 62 B12R2.24 NC1=CC2=CC=CC=C2N=C1 OR30967 [0,0,0,1,1,0|2,0,0]=4 63 B12R2.24 NC1=NC2=CC=CC=C2C=C1 OR22144 [0,0,0,1,1,0|1,0,0]=3 64 B12R2.24 NC1=NC2=CC=CC=C2C=N1 OR17300 [0,0,0,1,1,0|0,0,0]=2 65 B12R2.24 OC1=CC2=C(C=CC=C2)C=N1 OR1224 [0,0,0,1,1,0|2,0,0]=4 66 B12R2.24 OC1=NC2=CC=CC=C2C=C1 OR18280 [0,0,0,1,1,0|2,0,0]=4 67 B12R2.24 OC1=NC2=CC=CC=C2N=C1 OR11198 [0,0,0,1,1,0|2,0,0]=4 68 B12R2.6 NC1=CC(C2=CC=CO2)=NN1 OR3019 [0,0,0,1,1,0|2,0,0]=4 69 B12R2.6 NC1=CC(C2=CC=CS2)=NN1 OR3022 [0,0,0,1,1,0|2,0,0]=4 70 B14R2.19 ClC1=NC(CC2=CC=CC=C2)=NS1 OR52110 [0,0,0,1,0,1|2,0,0]=4 71 B14R2.19 NC1=NN=C(CC2=CC=CC=C2)N1 OR63030 [0,0,0,1,0,1|0,0,2]=4 72 B14R2.21 NC1=NC=CC(C2=CC=CC=C2)=N1 OR7650 [0,0,0,1,0,1|1,0,1]=4 73 B14R2.21 SC1=NC=NC(C2=CC=CC=C2)=N1 OR7661 [0,0,0,1,0,1|1,0,1]=4 74 B14R2.68 NC1=CC=C(C2=CC=CC=C2)N=C1 OR14233 [0,1,0,1,0,0|2,0,0]=4 75 B14R2.68 NC1=CC=C(C2=CC=CC=C2)N=N1 OR14968 [0,1,0,1,0,0|1,0,1]=4 76 B14R2.68 NC1=NC=C(C2=CC=CC=C2)N=C1 OR61038 [0,1,0,1,0,0|1,0,0]=3 77 B14R2.68 O=C1C=CC(C2=CC=CC=C2)=NN1 OR14974 [0,1,0,1,0,0|2,0,0]=4 78 B14R2.22 CC1=CC(C2=CC(Br)=CC=C2)=NN1 OR15313 [0,1,0,1,0,0|2,0,0]=4 79 B14R2.22 CC1=CC(C2=NOC(N)=C2)=CC=C1 OR345144 [0,1,0,1,0,0|2,0,0]=4 80 B14R2.22 CC1=CC(C2=NSC(Cl)=N2)=CC=C1 OR53087 [0,1,0,1,0,0|2,0,0]=4 81 B14R2.22 CC1=NC(C2=CC(Br)=CC=C2)=NO1 OR9178 [0,1,0,1,0,0|2,0,0]=4 82 B14R2.22 NC1=CC(C2=CC(Br)=CC=C2)=NN1 OR15137 [0,1,0,1,0,0|1,0,0]=3 83 B14R2.22 NC1=CC(C2=CC(Br)=CC=C2)=NO1 OR15142 [0,1,0,1,0,0|2,0,0]=4 84 B14R2.22 NC1=CC(C2=CC(Cl)=CC=C2)=NN1 OR15158 [0,1,0,1,0,0|1,0,0]=3 85 B14R2.22 NC1=CC(C2=CC(Cl)=CC=C2)=NO1 OR15155 [0,1,0,1,0,0|2,0,0]=4 86 B14R2.256 NC1=NC(C2=C(Cl)C=CC=C2)=CS1 OR30955 [0,1,0,1,0,0|2,0,0]=4 87 B14R2.768 N=C(N)NC1=NC2=C(C=CC=C2)N1 OR54411 [0,1,0,1,0,0|2,0,0]=4 88 B14R2.8032 CC(=O)N1N=CC2=C(Cl)C=CC=C21 OR59366 [0,1,0,1,0,0|2,0,0]=4 89 B14R2.598 CC1=C(C2=CC=CC=C2)N=C(N)S1 OR6123 [0,1,0,1,0,0|2,0,0]=4 90 B14R2.598 NC1=NN(C2=CC=CC=C2)C(=S)N1 OR13429 [0,1,0,1,0,0|2,0,0]=4 91 B14R2.260 CN1N=C(C2=CC=CC=C2)C=C1N OR3035 [0,1,0,1,0,0|1,0,0]=3 92 B14R2.20 CC1=CC(C2=CC=C(Br)C=C2)=NN1 OR15318 [0,1,0,1,0,0|2,0,0]=4 93 B14R2.20 CC1=CC=C(C2=NN=C(N)S2)C=C1 OR13741 [0,1,0,1,0,0|1,0,1]=4 94 B14R2.20 CC1=CC=C(C2=NNC(N)=C2)C=C1 OR3416 [0,1,0,1,0,0|1,0,0]=3 95 B14R2.20 CC1=CC=C(C2=NSC(Cl)=N2)C=C1 OR346147 [0,1,0,1,0,0|2,0,0]=4 96 B14R2.20 CC1=CC=C(C2=NSC(N)=N2)C=C1 OR14842 [0,1,0,1,0,0|1,0,0]=3 97 B14R2.20 CC1=NC(C2=CC=C(Br)C=C2)=NO1 OR0783 [0,1,0,1,0,0|2,0,0]=4 98 B14R2.20 CC1=NC(C2=CC=C(N)C=C2)=NO1 OR9660 [0,1,0,1,0,0|2,0,0]=4 99 B14R2.20 NC1=CC(C2=CC=C(Br)C=C2)=NN1 OR14269 [0,1,0,1,0,0|1,0,0]=3 100 B14R2.20 NC1=CC(C2=CC=C(Br)C=C2)=NO1 OR15271 [0,1,0,1,0,0|2,0,0]=4 101 B14R2.20 NC1=CC(C2=CC=C(Cl)C=C2)=NN1 OR4080 [0,1,0,1,0,0|1,0,0]=3 102 B14R2.20 NC1=CC(C2=CC=C(Cl)C=C2)=NO1 OR15282 [0,1,0,1,0,0|2,0,0]=4 103 B14R2.20 NC1=NC(C2=CC=C(Br)C=C2)=CS1 OR5603 [0,1,0,1,0,0|2,0,0]=4 104 B14R2.20 NC1=NC(C2=CC=C(Cl)C=C2)=CS1 OR5604 [0,1,0,1,0,0|2,0,0]=4 105 B14R2.20 NC1=NC(C2=CC=C(Cl)C=C2)=NS1 OR14818 [0,1,0,1,0,0|1,0,0]=3 106 B14R2.20 NC1=NN=C(C2=CC=C(Cl)C=C2)S1 OR13739 [0,1,0,1,0,0|1,0,1]=4 107 B14R2.20 NC1=NN=C(C2=CC=C(O)C=C2)O1 OR61259 [0,1,0,1,0,0|1,0,1]=4 108 B14R2.5816 CC(=O)N1N=CC2=CC=C(Cl)C=C21 OR59367 [0,1,0,1,0,0|2,0,0]=4 109 B14R2.8 ClCC1=NC(C2=CC=CC=C2)=NO1 OR27224 [0,1,0,1,0,0|2,0,0]=4 110 B14R2.8 NCC1=CC(C2=CC=CC=C2)=NO1 OR15367 [0,1,0,1,0,0|2,0,0]=4 111 B14R2.8 NCC1=CSC(C2=CC=CC=C2)=N1 OR23286 [0,1,0,1,0,0|2,0,0]=4 112 B14R2.8 NCC1=NC(C2=CC=CC=C2)=NO1 OR16557 [0,1,0,1,0,0|1,0,0]=3 113 B14R2.4514 CC1=C(N)C(C2=CC=CC=C2)=NO1 OR30303 [0,1,0,1,0,0|2,0,0]=4 114 B14R2.4514 NC1=C(Br)C(C2=CC=CC=C2)=NN1 OR3026 [0,1,0,1,0,0|1,0,0]=3 115 B10R1.18 CC(=S)NC1=CC=CC=C1 OR53074 [0,0,0,0,2,0|2,0,0]=4 116 B10R1.18 CC(C)=CC1=CC=CC=C1 OR30976 [0,0,0,0,2,0|2,0,0]=4 117 B10R1.18 NC(=O)CC1=CC=CC=C1 OR0700 [0,0,0,0,2,0|1,0,1]=4 118 B10R1.18 NC(=O)NC1=NC=CC=C1 OR0956 [0,0,0,0,2,0|2,0,0]=4 119 B10R1.18 NC(=S)NC1=CC=NC=C1 OR1315 [0,0,0,0,2,0|2,0,0]=4 120 B10R1.18 NC(=S)NC1=NC=CC=C1 OR6811 [0,0,0,0,2,0|2,0,0]=4 121 B10R1.18 NC(N)=NC1=CC=CC=C1 OR8070 [0,0,0,0,2,0|0,0,1]=3