0 B12R2.1081 BrC1=CC=CC2=C1C=CN=N2 1774AB [0,0,0,0,0,0|4,0,0]=4 1 B12R2.1081 BrC1=CC=NC2=NC=CC=C12 7902AB [0,0,0,0,0,0|4,0,0]=4 2 B12R2.1081 CC1=CC=CC2=C1C=CN=C2 9523AB [0,0,0,0,0,0|3,0,0]=3 3 B12R2.1081 CC1=CN=NC2=C1C=CC=C2 7316AA [0,0,0,0,0,0|4,0,0]=4 4 B12R2.1081 ClC1=CC=CC2=C1N=CN=C2 1743AC [0,0,0,0,0,0|2,0,0]=2 5 B12R2.1081 NC1=C2N=CC=NC2=CC=C1 8405AA [0,0,0,0,0,0|2,0,0]=2 6 B12R2.1081 NC1=CC=CC2=C1C=CN=C2 V3480 [0,0,0,0,0,0|3,0,0]=3 7 B12R2.1081 OC1=CC=CC2=C1OCCN2 0912AC [0,0,0,0,0,0|2,0,2]=4 8 B13R2.32 BrC1=C(Br)C2=CC=CC=C2C=N1 X5541 [0,1,0,0,0,0|3,0,0]=4 9 B13R2.32 CN1C(=S)C=CC2=CC=CC=C21 4164AE [0,1,0,0,0,0|3,0,0]=4 10 B13R2.32 ClC1=C(Br)C=CC2=C1C=CN=C2 3468AJ [0,1,0,0,0,0|3,0,0]=4 11 B13R2.162 ClC1=CC=CC2=CN=C(Cl)N=C12 Z5015 [0,1,0,0,0,0|2,0,0]=3 12 B13R2.328 CC1=CC(=O)C2=C(C=CC=N2)N1 1779AJ [0,1,0,0,0,0|1,0,1]=3 13 B13R2.328 CC1=NC2=CC=CN=C2C(Cl)=C1 2761AJ [0,1,0,0,0,0|2,0,0]=3 14 B13R2.328 CC1=NC2=CC=CN=C2C(O)=C1 1778AJ [0,1,0,0,0,0|1,0,0]=2 15 B13R2.328 NC1=CC(=O)OC2=C1C=CC=C2 8125AJ [0,1,0,0,0,0|3,0,0]=4 16 B13R2.328 NC1=CC(O)=CC2=C1C=CC=C2 V7872 [0,1,0,0,0,0|2,0,0]=3 17 B13R2.328 [O-]C1=C2C=CC=CC2=NC(O)=C1 5307AL [0,1,0,0,0,0|2,0,1]=4 18 B13R2.342 NC1=C2C=CC=C(F)C2=NC=C1 4568AD [0,1,0,0,0,0|1,0,0]=2 19 B13R2.371 ClC1=CC=C(Cl)C2=C1C=CC=C2 X4606 [0,1,0,0,0,0|2,0,0]=3 20 B13R2.371 O=C1NC=C(Br)C2=C1C=CC=N2 W3379 [0,1,0,0,0,0|2,0,0]=3 21 B13R2.1613 BrCC1=C2C=CC=CC2=CN=C1 Y4364 [0,1,0,0,0,0|3,0,0]=4 22 B13R2.1613 Br[Mg]C1=C2C=CC=CC2=CC=C1 7725AJ [0,1,0,0,0,0|2,0,0]=3 23 B13R2.1613 NCC1=C2C=CC=CC2=CC=N1 W6115 [0,1,0,0,0,0|3,0,0]=4 24 B13R2.1613 NCC1=C2C=CC=CC2=NC=C1 Y9481 [0,1,0,0,0,0|3,0,0]=4 25 B13R2.4818 ClC1=C2C(I)=CC=CC2=NC=C1 Y7534 [0,1,0,0,0,0|3,0,0]=4 26 B13R2.4818 FC1=CC=CC2=CC=CC(Br)=C12 Y8769 [0,1,0,0,0,0|2,0,0]=3 27 B13R2.4818 O=C1C=COC2=C1C(O)=CC=C2 Y8984 [0,1,0,0,0,0|2,0,0]=3 28 B13R2.5179 CC1=C2C=CC(Br)=CC2=CN=C1 Y4855 [0,1,0,0,0,0|3,0,0]=4 29 B13R2.5179 ClC1=C2C=NC(Br)=CC2=CC=C1 Y3036 [0,1,0,0,0,0|3,0,0]=4 30 B13R2.5179 NC1=C2C=CC(Br)=CC2=NC=C1 W7666 [0,1,0,0,0,0|3,0,0]=4 31 B13R2.5179 NC1=CC=NC2=C1C=CC(Cl)=C2 2372AA [0,1,0,0,0,0|3,0,0]=4 32 B13R2.5179 O=C1C=CC2=C(Br)C=CC=C2N1 3165AJ [0,1,0,0,0,0|3,0,0]=4 33 B11R1.17 CC1=CC=CC=C1\C=C\C=O 5900AC [0,0,1,0,0,0|3,0,0]=4 34 B11R1.17 O=C\C=C\C1=CC=CC=C1O W2100 [0,0,1,0,0,0|2,0,0]=3 35 B11R1.28 O\N=C\C=C\C1=CC=CC=C1 Y7433 [0,0,1,0,0,0|2,0,0]=3 36 B11R2.1 CC1C=CC2=C1C=CC=C2 1961AC [0,0,0,0,1,0|2,0,1]=4 37 B11R2.1 IC1=CNC2=C1C=CC=C2 2307AJ [0,0,0,0,1,0|3,0,0]=4 38 B11R2.1 NC1=CNC2=C1C=CC=C2 8737AE [0,0,0,0,1,0|3,0,0]=4 39 B11R2.1 OC1=CSC2=CC=CC=C12 Z5532 [0,0,0,0,1,0|2,0,0]=3 40 B11R2.106 BrC1=CC=CC2=NSN=C12 W4545 [0,0,0,0,1,0|3,0,0]=4 41 B11R2.106 CC1=CC=CC2=C1N=CS2 8174AJ [0,0,0,0,1,0|2,0,0]=3 42 B11R2.106 ClC1=CC=CC2=C1SC=N2 8294AJ [0,0,0,0,1,0|3,0,0]=4 43 B11R2.106 NC1=CC=CC2=NON=C12 Y4038 [0,0,0,0,1,0|3,0,0]=4 44 B11R2.106 NC1=NC=CC2=CC=NN21 4476AJ [0,0,0,0,1,0|3,0,0]=4 45 B11R2.106 OC1=CC=CC2=C1SC=N2 3829AJ [0,0,0,0,1,0|2,0,0]=3 46 B11R2.106 OC1=CC=CN2C=CN=C12 3471AL [0,0,0,0,1,0|1,0,0]=2 47 B11R2.106 [O-][N+]1=CC=CC2=C1NC=C2 3386AH [0,0,0,0,1,0|1,0,2]=4 48 B10R1.15 C=C=C(C)C1=NC=CC=C1 9561AF [1,0,1,0,0,0|1,0,1]=4 49 B10R1.17 C=C\C=C\C1=CC=CC=C1 1673AL [1,0,1,0,0,0|1,0,0]=3 50 B10R1.17 CC\C=C\C1=NC=CC=C1 Y6363 [1,0,1,0,0,0|0,0,2]=4 51 B10R1.17 CO\C=C\C1=CC=CC=C1 6472AB [1,0,1,0,0,0|2,0,0]=4 52 B10R1.245 C=CC1=C(C)C=CC=C1C Y8170 [1,0,1,0,0,0|1,0,1]=4 53 B12R1.382 COC1=CC=CC(\C=C\C=O)=C1 8277AB [0,1,1,0,0,0|1,0,0]=3 54 B12R1.27 CC(\C=C\C1=CC=CC=C1)=N/O 5660AF [0,1,1,0,0,0|2,0,0]=4 55 B12R2.24 CC1=CC2=C(C=C1)N=NC=C2 3487AB [1,1,0,0,0,0|1,0,0]=3 56 B12R2.24 CC1=CC=C2C=CN=CC2=C1 7738AB [1,1,0,0,0,0|2,0,0]=4 57 B12R2.24 ClC1=NN=C2C=CC=CC2=C1 5859AJ [1,1,0,0,0,0|1,0,0]=3 58 B12R2.24 FC1=CC2=C(C=CC=N2)N=C1 2273AJ [1,1,0,0,0,0|1,0,0]=3 59 B12R2.24 IC1=CC2=CC=CC=C2C=N1 Y5506 [1,1,0,0,0,0|2,0,0]=4 60 B12R2.24 NC1=CC2=C(C=CN=N2)C=C1 0380AA [1,1,0,0,0,0|1,0,0]=3 61 B12R2.24 OC1=CC2=C(C=CC=N2)C=C1 3083AL [1,1,0,0,0,0|0,0,0]=2 62 B12R2.24 OC1=CC2=CC=CC=C2C=N1 W8331 [1,1,0,0,0,0|2,0,0]=4 63 B12R2.1 OCC1=CNC2=CC=CC=C12 2717AD [0,1,0,0,1,0|2,0,0]=4 64 B12R2.1 OCC1=CSC2=CC=CC=C12 Y9385 [0,1,0,0,1,0|2,0,0]=4 65 B12R2.82 CC1=C(C)C2=C(C=C1)SC=N2 8113AJ [0,1,0,0,1,0|2,0,0]=4 66 B12R2.202 CC1=CC2=C(O1)C(N)=CC=C2 8732AD [0,1,0,0,1,0|2,0,0]=4 67 B12R2.202 CC1=CN2C=CC=C(N)C2=N1 N046 [0,1,0,0,1,0|2,0,0]=4 68 B12R2.202 NC1=NC2=C(C=CC=C2Cl)S1 7832AF [0,1,0,0,1,0|2,0,0]=4 69 B12R2.221 FC1=C2N=CSC2=C(F)C=C1 8120AJ [0,1,0,0,1,0|2,0,0]=4 70 B12R2.246 CC1=C2NC=CC2=CC(N)=C1 Y1634 [0,1,0,0,1,0|1,0,1]=4 71 B12R2.246 CC1=CC(C)=C2N=CSC2=C1 8118AJ [0,1,0,0,1,0|2,0,0]=4 72 B12R2.246 ClC1=CC2=C(N=CS2)C(Cl)=C1 8114AJ [0,1,0,0,1,0|2,0,0]=4 73 B12R2.246 FC1=CC(F)=C2N=CSC2=C1 8116AJ [0,1,0,0,1,0|2,0,0]=4 74 B12R2.246 OC1=CC(Cl)=CN2C=CN=C12 9725AL [0,1,0,0,1,0|1,0,0]=3 75 B12R2.315 NCC1=CC=CC2=C1C=CS2 5989AJ [0,1,0,0,1,0|2,0,0]=4 76 B14R2.7724 CC1=CC(N)=C2C=CC=CC2=C1O 5856AF [0,2,0,0,0,0|1,0,0]=3 77 B14R2.7724 O=C1C=C(Br)C(=O)C2=C1C=CC=C2 Y1207 [0,2,0,0,0,0|1,0,1]=4 78 B14R2.8188 O=C1NC2=CC=CC=C2C(O)=C1Cl 9463AJ [0,2,0,0,0,0|2,0,0]=4 79 B14R2.28523 CN1C(=O)C=CC2=CC=CC(Br)=C21 3760AJ [0,2,0,0,0,0|1,0,1]=4 80 B14R2.29369 OC1=CC=C2C=C(Br)C=CC2=C1Cl Y3537 [0,2,0,0,0,0|2,0,0]=4 81 B14R2.142 N#CC1=CC=C2C=CC=C(O)C2=N1 X6963 [0,2,0,0,0,0|0,0,0]=2 82 B14R2.8751 CC1=CC=C(Br)C2=C1N=C(O)C=C2 6975AC [0,2,0,0,0,0|1,0,0]=3 83 B14R2.28472 CC1=CC2=C(N=C1Cl)C(C)=CC=C2 2035AL [0,2,0,0,0,0|1,0,0]=3 84 B14R2.1146 COC1=C2C=CC=CC2=CC(Cl)=N1 Y8424 [0,2,0,0,0,0|2,0,0]=4 85 B14R2.29365 NC1=CC(Cl)=C2N=CC(Br)=CC2=C1 2576AC [0,2,0,0,0,0|1,0,0]=3 86 B14R2.31359 FC(F)C1=CC=CC2=CC=CC=C21 5179AE [0,2,0,0,0,0|2,0,0]=4 87 B14R2.31359 N=C(N)C1=C2C=CC=CC2=CC=C1 4386AJ [0,2,0,0,0,0|2,0,0]=4 88 B14R2.31359 OB(O)C1=NC=CC2=CC=CC=C21 4149AA [0,2,0,0,0,0|2,0,0]=4 89 B12R2.2 C1=CC=C(C2=COC=N2)N=C1 0490AC [0,0,1,1,0,0|2,0,0]=4 90 B10R1.39 C=CN1C=CC=C1C(=O)O 1021AE [0,0,1,0,1,0|2,0,0]=4 91 B10R2.7 C1=CC2=C(CC=C2)N=C1 2529AB [1,0,0,0,1,0|0,0,1]=3 92 B10R2.7 C1=CC2=CNC=C2C=C1 0763AP [1,0,0,0,1,0|1,0,0]=3 93 B10R2.7 C1=CN=C2NC=CC2=C1 7845AF [1,0,0,0,1,0|1,0,0]=3 94 B10R2.7 C1=CN=C2OC=CC2=C1 Y8520 [1,0,0,0,1,0|1,0,0]=3