0 B13R2.5190 CC1=CC2=C(C=CC(O)=C2)N1C BB31-8107 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.5190 CN1C(=O)NC2=C1C=CC(N)=C2 BB32-2874 [0,0,0,0,0,0|2,0,0]=2 2 B12R2.18 CN1C(=O)CC2=C1N=CC=C2 BB31-2974 [1,0,0,0,0,0|3,0,0]=4 3 B12R2.18 O=C1SC2=C(C=CC=C2)C1=O BB31-7685 [1,0,0,0,0,0|2,0,1]=4 4 B12R2.606 CC1=CC2=C(C=C(Cl)C=C2)N1 BB32-3138 [1,0,0,0,0,0|2,1,0]=4 5 B12R2.606 CC1=CC2=C(C=C(O)C=C2)N1 BB32-2243 [1,0,0,0,0,0|3,0,0]=4 6 B12R2.606 CC1=CC2=C(C=C1)C=C(C)N2 BB32-3305 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.606 CC1=CC2=C(C=C1)NC(=O)S2 BB32-2400 [1,0,0,0,0,0|2,0,0]=3 8 B12R2.606 CC1=CC2=C(CC(=O)N2)N=C1 BB31-0765 [1,0,0,0,0,0|3,0,0]=4 9 B12R2.606 CC1=NC2=CC(Cl)=CC=C2N1 BB12-5463 [1,0,0,0,0,0|1,1,1]=4 10 B12R2.606 CC1=NC2=CC=C(N)C=C2N1 BB52-1070 [1,0,0,0,0,0|2,0,1]=4 11 B12R2.606 CC1CC2=C(C=CC(F)=C2)N1 BB31-6748 [1,0,0,0,0,0|2,0,1]=4 12 B12R2.606 ClC1=NC2=C(C=CC(I)=C2)N1 BB32-0970 [1,0,0,0,0,0|1,1,1]=4 13 B12R2.606 FC1=CC2=C(C=C1)OC(Cl)=N2 BB31-9760 [1,0,0,0,0,0|2,0,1]=4 14 B12R2.606 FC1=CC=C2N=C(S)NC2=C1 BB52-8605 [1,0,0,0,0,0|0,1,1]=3 15 B12R2.606 NC1=CC2=C(C=C1)N=C(Cl)N2 BB31-3776 [1,0,0,0,0,0|2,0,1]=4 16 B12R2.606 NC1=CC2=C(C=C1)NC(=O)S2 BB31-4732 [1,0,0,0,0,0|2,0,0]=3 17 B12R2.606 NC1=NC2=C(C=C(F)C=C2)S1 BB52-4887 [1,0,0,0,0,0|2,0,1]=4 18 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)C1 BB31-4851 [1,0,0,0,0,0|2,1,0]=4 19 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)O1 BB31-3316 [1,0,0,0,0,0|2,1,0]=4 20 B12R2.606 O=C1CC2=C(C=CC(Br)=N2)N1 BB31-4794 [1,0,0,0,0,0|2,1,0]=4 21 B12R2.606 O=C1CC2=C(C=CC(Cl)=N2)N1 BB31-2042 [1,0,0,0,0,0|2,1,0]=4 22 B12R2.606 O=C1CC2=C(N=C(Br)C=C2)N1 BB31-0762 [1,0,0,0,0,0|2,1,0]=4 23 B12R2.606 O=C1CC2=CC(Br)=NC=C2N1 BB31-2201 [1,0,0,0,0,0|2,1,0]=4 24 B12R2.606 O=C1CC2=CC(Cl)=NC=C2N1 BB31-2040 [1,0,0,0,0,0|2,1,0]=4 25 B12R2.606 O=C1CC2=CN=C(Cl)C=C2N1 BB31-0014 [1,0,0,0,0,0|2,1,0]=4 26 B12R2.606 O=C1CC2=NC=C(Cl)C=C2N1 BB31-2041 [1,0,0,0,0,0|2,1,0]=4 27 B12R2.606 O=C1NC2=C(N=C(Cl)C=C2)N1 BB32-1504 [1,0,0,0,0,0|1,1,0]=3 28 B12R2.606 OC1=NC2=CC=C(F)C=C2S1 BB17-0867 [1,0,0,0,0,0|1,0,2]=4 29 B12R2.606 SC1=NC2=CC=C(Cl)C=C2N1 BB52-8603 [1,0,0,0,0,0|0,2,1]=4 30 B12R2.612 CC1=NNC2=C1C=CC(F)=C2 BB31-3058 [1,0,0,0,0,0|3,0,0]=4 31 B12R2.612 CN1C=CC2=C1C=CC(O)=C2 BB31-8353 [1,0,0,0,0,0|3,0,0]=4 32 B12R2.612 CN1C=NC2=CC(N)=CC=C21 BB52-6130 [1,0,0,0,0,0|2,0,1]=4 33 B12R2.612 NC1=CC2=C(C=C1)C(O)=NN2 BB32-2957 [1,0,0,0,0,0|3,0,0]=4 34 B12R2.612 O=C1NNC2=C1C=CC(F)=C2 BB31-6674 [1,0,0,0,0,0|2,0,1]=4 35 B14R2.645 O=C1NC2=CC(Br)=C(Br)C=C2C1=O BB31-3664 [0,1,0,0,0,0|1,1,1]=4 36 B14R2.645 O=C1NC2=CC(Cl)=C(Br)C=C2C1=O BB32-1150 [0,1,0,0,0,0|1,1,1]=4 37 B14R2.645 O=C1NC2=CC(F)=C(Br)C=C2C1=O BB31-8835 [0,1,0,0,0,0|1,0,1]=3 38 B14R2.1095 CC1=CC=C2C(=C1)C=C(C=O)N2C BB52-6081 [0,1,0,0,0,0|3,0,0]=4 39 B14R2.1095 CN1C(C=O)=CC2=CC(F)=CC=C21 BB52-6113 [0,1,0,0,0,0|2,0,0]=3 40 B14R2.8716 CN1C(=O)C(=O)C2=C1C=C(F)C=C2 BB31-9960 [0,1,0,0,0,0|1,0,1]=3 41 B14R2.8737 CC1=CC=C2C(=O)C(=O)NC2=C1C BB52-1466 [0,1,0,0,0,0|2,0,1]=4 42 B14R2.8737 O=C1NC2=C(C=CC(F)=C2F)C1=O BB31-3043 [0,1,0,0,0,0|1,0,1]=3 43 B14R2.8737 O=C1NC2=C(Cl)C(Cl)=CC=C2C1=O BB52-1470 [0,1,0,0,0,0|1,1,1]=4 44 B14R2.27750 O=C1NC2=CC(Br)=CC(Br)=C2C1=O BB32-0420 [0,1,0,0,0,0|1,1,1]=4 45 B12R1.50 NNC(=O)NC1=CC=CC(F)=C1 BB31-0577 [0,0,1,0,0,0|1,0,0]=2 46 B14R2.8239 CC1=CC=C2N=C(C)C(=O)NC2=C1 BB51-0034 [0,0,0,0,0,1|3,0,0]=4 47 B14R2.8239 CC1=CC=C2OC(C)C(=O)NC2=C1 BB51-0721 [0,0,0,0,0,1|3,0,0]=4 48 B14R2.8239 CC1=NC2=CC=C(Cl)C=C2NC1=O BB51-0033 [0,0,0,0,0,1|2,1,0]=4 49 B14R2.8239 O=C1NC2=C(C=C(F)C=C2)NC1=O BB32-3579 [0,0,0,0,0,1|1,0,1]=3 50 B14R2.29365 CC1=CC=C2C(O)=CC(=O)NC2=N1 BB31-8938 [0,0,0,0,0,1|3,0,0]=4 51 B14R2.29365 O=C1C=C(O)C2=C(C=C(F)C=C2)O1 BB31-8180 [0,0,0,0,0,1|2,0,0]=3 52 B14R2.29365 O=C1NC2=CC(Cl)=CC=C2C(=O)O1 BB52-1464 [0,0,0,0,0,1|1,1,1]=4 53 B14R2.29369 CN1C(=O)C=CC2=C1C=CC(Br)=C2 BB31-3337 [0,0,0,0,0,1|2,1,0]=4 54 B14R2.29369 CN1C(=O)CCC2=C1C=CC(N)=C2 BB32-1233 [0,0,0,0,0,1|3,0,0]=4 55 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 BB32-3859 [1,0,1,0,0,0|2,0,0]=4 56 B11R1.40 NNC(=O)OC1=CC=CC=C1 BB31-5306 [1,0,1,0,0,0|2,0,0]=4 57 B11R1.40 O=C(CO)NC1=CC=CC=C1 BB32-2558 [1,0,1,0,0,0|1,0,0]=3 58 B11R1.157 NC(=O)NC1=CC=CC(Br)=C1 BB31-5775 [1,0,1,0,0,0|0,1,0]=3 59 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 BB32-2011 [1,0,1,0,0,0|2,0,0]=4 60 B11R1.157 O=C(O)CC1=CC=CC(F)=N1 BB31-0031 [1,0,1,0,0,0|2,0,0]=4 61 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 BB31-1326 [1,0,1,0,0,0|2,0,0]=4 62 B11R1.166 NC1=C(C(=O)O)C=CC(O)=C1 BB32-1819 [1,0,1,0,0,0|2,0,0]=4 63 B11R1.222 CC1=C(N(C)C=O)C=CC=C1 BB31-1907 [1,0,1,0,0,0|2,0,0]=4 64 B11R2.1 ClC1=CNC2=C1C=CC=C2 BB31-3376 [2,0,0,0,0,0|2,0,0]=4 65 B11R2.1 NC1=CNC2=C1C=CC=C2 BB32-3019 [2,0,0,0,0,0|2,0,0]=4 66 B11R2.10 BrC1=CC2=C(C=CC=C2)N1 BB31-2458 [2,0,0,0,0,0|2,0,0]=4 67 B11R2.10 IC1=CC2=C(C=CC=C2)N1 BB31-4420 [2,0,0,0,0,0|2,0,0]=4 68 B11R2.10 O=C1CC2=C(C=CC=N2)N1 BB31-4947 [2,0,0,0,0,0|2,0,0]=4 69 B11R2.10 O=C1CC2=C(C=NC=C2)N1 BB32-2391 [2,0,0,0,0,0|2,0,0]=4 70 B11R2.10 O=C1NC2=C(C=NC=C2)O1 BB32-3787 [2,0,0,0,0,0|2,0,0]=4 71 B11R2.10 O=C1NC2=C(N=CC=N2)N1 BB31-3204 [2,0,0,0,0,0|2,0,0]=4 72 B11R2.10 S=C1CC2=C(C=CC=C2)N1 BB32-2281 [2,0,0,0,0,0|1,1,0]=4 73 B11R2.36 FC1=CN=C2C=CNC2=C1 BB31-0752 [2,0,0,0,0,0|2,0,0]=4 74 B11R2.36 FC1=NC2=C(C=C1)NC=C2 BB31-6465 [2,0,0,0,0,0|2,0,0]=4 75 B11R2.36 NC1=CC=C2N=CNC2=C1 BB52-1069 [2,0,0,0,0,0|1,0,1]=4 76 B13R1.2879 CNC(=O)NC1=CC(Cl)=C(Cl)C=C1 BB31-6266 [0,1,1,0,0,0|1,1,0]=4 77 B13R2.45 CC1=C(C=O)NC2=C1C=CC=C2 BB32-2202 [1,1,0,0,0,0|2,0,0]=4 78 B13R2.45 CN1C2=CC=CC=C2N=C1C=O BB52-0062 [1,1,0,0,0,0|1,0,1]=4 79 B13R2.3085 CN1C(=O)C(N)C2=C1C=CC=C2 BB31-3288 [1,1,0,0,0,0|2,0,0]=4 80 B13R2.4856 O=C1NC2=CC=CC(Cl)=C2C1=O BB52-1468 [1,1,0,0,0,0|1,0,1]=4 81 B13R2.43 CC1=CC2=C(C=C1)NC(C=O)=C2 BB31-2585 [1,1,0,0,0,0|2,0,0]=4 82 B13R2.43 FC1=CC=C2NC(CCl)=NC2=C1 BB52-8449 [1,1,0,0,0,0|1,0,1]=4 83 B13R2.43 O=CC1=CC2=C(C=CC(Cl)=C2)N1 BB32-2232 [1,1,0,0,0,0|1,1,0]=4 84 B13R2.43 O=CC1=CC2=CC(Br)=CC=C2N1 BB52-6080 [1,1,0,0,0,0|1,1,0]=4 85 B13R2.43 O=CC1=NC2=C(C=C(Br)C=C2)N1 BB31-6398 [1,1,0,0,0,0|0,1,1]=4 86 B13R2.43 O=CC1=NC2=C(C=C(F)C=C2)N1 BB31-6397 [1,1,0,0,0,0|0,0,1]=3 87 B13R2.2121 COC1=CC2=C(C=C1)CC(=O)N2 BB31-6945 [1,1,0,0,0,0|2,0,0]=4 88 B13R2.2121 N#CC1=CC2=C(C=C1)CC(=O)N2 BB31-3899 [1,1,0,0,0,0|2,0,0]=4 89 B13R2.2121 O=CC1=CC2=C(C=C1)NC(=O)N2 BB31-5104 [1,1,0,0,0,0|1,0,0]=3 90 B13R2.3050 O=C1CC2=C(N=CC(F)=C2Cl)N1 BB31-0738 [1,1,0,0,0,0|2,0,0]=4 91 B13R2.5397 CC1=CC2=C(NC(=O)C2)C(C)=C1 BB31-7209 [1,1,0,0,0,0|2,0,0]=4 92 B13R2.5397 O=C1CC2=C(F)C=C(Br)C=C2N1 BB31-9886 [1,1,0,0,0,0|1,1,0]=4 93 B13R2.5397 O=C1CC2=CC(F)=CC(Cl)=C2N1 BB31-1505 [1,1,0,0,0,0|1,0,0]=3 94 B13R2.5397 O=C1CC2=CC(F)=CC(F)=C2N1 BB31-4297 [1,1,0,0,0,0|1,0,0]=3 95 B13R2.5397 O=C1NC2=C(N1)C(Cl)=NC(Cl)=C2 BB32-3902 [1,1,0,0,0,0|1,1,0]=4 96 B13R2.13083 CC1=C(Br)C=C2CC(=O)NC2=C1 BB32-2810 [1,1,0,0,0,0|1,1,0]=4 97 B13R2.13083 CC1=C(Br)C=C2NC(=O)NC2=N1 BB31-0420 [1,1,0,0,0,0|1,1,0]=4 98 B13R2.13083 O=C1CC2=CC(F)=C(Br)C=C2N1 BB31-4789 [1,1,0,0,0,0|1,0,0]=3 99 B13R2.13083 O=C1NC2=CC(Cl)=C(O)C=C2O1 BB31-3443 [1,1,0,0,0,0|1,1,0]=4 100 B13R2.13083 O=C1NC2=CC(F)=C(F)C=C2N1 BB32-0822 [1,1,0,0,0,0|0,0,0]=2 101 B15R2.961 CN1C(=O)NC2=C1C=CC(C(=O)O)=C2 BB31-3908 [0,2,0,0,0,0|2,0,0]=4 102 B15R2.961 CN1C(=O)NC2=C1C=CC([N+](=O)[O-])=C2 BB32-3701 [0,2,0,0,0,0|2,0,0]=4 103 B13R2.155 O=C1CCC2=C(C=C(F)C=C2)N1 BB32-2803 [0,0,1,1,0,0|2,0,0]=4 104 B13R2.5179 CC1=CC=CC2=C1OCC(=O)N2 BB31-0275 [0,0,1,1,0,0|2,0,0]=4 105 B13R2.5179 O=C1C=CC2=C(F)C=CC=C2N1 BB32-3348 [0,0,1,1,0,0|2,0,0]=4 106 B13R2.5179 O=C1COC2=C(Br)C=CC=C2N1 BB32-3834 [0,0,1,1,0,0|1,1,0]=4 107 B11R1.23 CNC(=O)C1=CC(O)=CC=C1 BB31-3025 [0,0,1,0,1,0|2,0,0]=4 108 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(F)C=C1 BB31-1106 [0,0,1,0,0,1|2,0,0]=4 109 B13R2.328 O=C1C=C(Br)C2=C(C=CC=C2)N1 BB31-7409 [1,0,0,0,0,1|2,0,0]=4 110 B13R2.328 O=C1C=C(O)C2=CC=CN=C2N1 BB32-3345 [1,0,0,0,0,1|2,0,0]=4 111 B13R2.3683 O=C1CSC2=C(C=CC(Br)=C2)N1 BB31-6065 [1,0,0,0,0,1|1,1,0]=4 112 B13R2.3683 O=C1N=CC2=C(C=CC(Br)=C2)N1 BB31-6835 [1,0,0,0,0,1|0,1,1]=4