0 B10R1.61 CC(N)C1=C(Cl)C=CC=C1 BB55-1646 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.61 CC(O)C1=CC=CN=C1Cl BB31-1901 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.61 CC1=CC=CC=C1C(C)N BB58-0605 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.61 CN(C)C1=C(N)C=CC=C1 BB12-1582 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.61 CN(C)C1=C(N)C=NC=C1 BB55-4944 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.61 CN(C)C1=NC=CC=C1N BB12-1642 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.61 NC(=O)C1=CC=CC=C1O BB01-7441 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.61 O=[N+]([O-])C1=CC=CN=C1O BB54-2950 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.61 O=[N+]([O-])C1=NC=CC=C1O BB01-6547 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.6 CC(N)C1=CC=NC=C1 BB05-0766 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.15 CC1=C(CBr)N=CC=C1 BB05-1496 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.15 CC1=NC=CC=C1CCl BB57-4147 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.15 CNC1=C(C)C=CC=C1 BB01-7286 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.15 CNC1=CC=CC=C1N BB12-2750 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.15 CNC1=CC=CN=C1N BB12-1643 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.15 CNC1=NC=CC=C1Cl BB12-1745 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.15 COC1=C(N)C=NC=C1 BB54-5707 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.15 COC1=CC=CN=C1C BB17-0165 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.15 CSC1=NC=CC=C1N BB58-0115 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.15 NCC1=CC=CN=C1Cl BB57-4137 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.15 NCC1=CC=CN=C1N BB12-1525 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.15 NNC1=CC=CC=C1I BB56-0829 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.15 O=CC1=C(O)C=CN=C1 BB31-4787 [1,0,0,0,0,0|2,0,1]=4 23 B9R1.15 OCC1=CC=CN=C1Cl BB12-3681 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.15 [C-]#[N+]C1=C(I)C=CC=C1 BB56-0362 [1,0,0,0,0,0|2,0,1]=4 25 B11R1.53 CC(C)C1=CC=CC=C1NN BB56-0329 [0,1,0,0,0,0|1,0,0]=2 26 B11R1.53 CN(C)C1=NC=CC=C1C#N BB53-1353 [0,1,0,0,0,0|3,0,0]=4 27 B11R1.53 CN(C)C1=NC=CC=C1C=O BB57-4155 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.53 CN(C)C1=NC=CC=C1CN BB58-4329 [0,1,0,0,0,0|3,0,0]=4 29 B11R1.53 COC1=CC=CC=C1C(C)N BB58-0606 [0,1,0,0,0,0|1,0,0]=2 30 B11R1.87 CC(C)(O)C1=CC=CC=C1N BB57-1301 [0,1,0,0,0,0|1,0,0]=2 31 B11R1.159 NC1=C(O)C(C(=O)O)=CC=C1 BB54-0431 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 BB12-4608 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 BB12-4662 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 BB12-2243 [0,1,0,0,0,0|2,0,1]=4 35 B11R1.166 CC(C)C1=C(O)C=C(O)C=C1 BB55-8755 [0,1,0,0,0,0|0,0,0]=1 36 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 BB05-0996 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.166 CN(C)C1=CC=C(Br)C=C1N BB12-2661 [0,1,0,0,0,0|2,0,0]=3 38 B11R1.166 O=[N+]([O-])C1=C(O)C=C(O)C=C1 BB55-7325 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 BB53-1900 [0,1,0,0,0,0|1,0,1]=3 40 B11R1.167 CC(=O)C1=CC(F)=CC=C1O BB01-7439 [0,1,0,0,0,0|1,0,1]=3 41 B11R1.167 CC(O)C1=C(O)C=CC(Br)=C1 BB53-1844 [0,1,0,0,0,0|1,0,0]=2 42 B11R1.167 CC1=C(C(C)C)N=C(Cl)N=C1 BB12-3687 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.167 CC1=CC([N+](=O)[O-])=C(O)C=C1 BB01-7555 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.167 CC1=CC=C(C)C(C(C)N)=C1 BB55-1055 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.222 C#CC(O)C1=C(Cl)C=CC=C1 BB31-3996 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.222 CCC(N)C1=CC=CC=C1C BB58-0612 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.222 COC(=O)C1=C(S)C=CC=C1 BB12-1508 [0,1,0,0,0,0|1,1,1]=4 48 B11R1.222 COC(=O)C1=NC=CC=C1O BB17-0205 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.222 NC(CO)C1=CC=CC=C1F BB56-2224 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.222 NCC(O)C1=C(F)C=CC=C1 BB31-5644 [0,1,0,0,0,0|2,0,0]=3 51 B11R2.55 ClC1=C(C2CO2)C=CC=C1 BB32-3052 [0,0,0,1,0,0|2,0,0]=3 52 B9R1.41 CC(C)C1=C(Br)C=NN1 BB12-3685 [0,0,0,0,1,0|3,0,0]=4 53 B9R1.41 CC(C)N1N=CC=C1Br BB58-1976 [0,0,0,0,1,0|3,0,0]=4 54 B9R1.41 CC(C)N1N=CC=C1N BB53-1799 [0,0,0,0,1,0|3,0,0]=4 55 B11R1.86 CC(=O)NC1=CC=CC=C1S BB12-2835 [0,0,0,0,0,1|1,1,1]=4 56 B11R1.86 CC(C)NC1=C(N)C=CC=C1 BB32-3847 [0,0,0,0,0,1|1,0,0]=2 57 B11R1.86 CC(C)OC1=CC=CC=C1N BB57-2916 [0,0,0,0,0,1|1,0,0]=2 58 B11R1.86 CC1=CC=CN=C1CC(C)O BB55-7546 [0,0,0,0,0,1|3,0,0]=4 59 B11R1.86 CN(C)CC1=C(Br)C=CC=C1 BB58-0486 [0,0,0,0,0,1|2,0,0]=3 60 B11R1.86 NC1=CC=CC=C1OC(F)F BB55-0112 [0,0,0,0,0,1|3,0,0]=4 61 B8R1.2 ClCC1=CC=CN=C1 BB60-7973 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.5 CC1=C(N)C=CN=C1 BB54-4818 [2,0,0,0,0,0|2,0,0]=4 63 B8R1.5 CC1=NC=CC=C1O BB17-0195 [2,0,0,0,0,0|1,0,0]=3 64 B8R1.5 C[N+]1=C(Cl)C=CC=C1 BB57-2946 [2,0,0,0,0,0|2,0,0]=4 65 B8R1.5 NC1=C(O)N=CC=C1 BB12-2900 [2,0,0,0,0,0|2,0,0]=4 66 B8R1.5 OC1=C(I)C=CN=C1 BB20-3208 [2,0,0,0,0,0|2,0,0]=4 67 B8R1.5 OC1=CC=CN=C1Br BB12-1811 [2,0,0,0,0,0|2,0,0]=4 68 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [1,1,0,0,0,0|1,0,1]=4 69 B10R1.13 CC(C)C1=CN=C(Cl)N=C1 BB57-2410 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.13 CC(C)C1=CN=C(O)N=C1 BB57-2411 [1,1,0,0,0,0|2,0,0]=4 71 B10R1.13 CC(O)C1=CC=C(N)C=C1 BB12-2291 [1,1,0,0,0,0|1,0,0]=3 72 B10R1.15 CC(C=O)C1=CC=CC=C1 BB17-2274 [1,1,0,0,0,0|0,0,1]=3 73 B10R1.15 CC(NN)C1=CC=CN=C1 BB57-2140 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.15 CC(NN)C1=CC=NC=C1 BB57-2139 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.15 CCC(N)C1=CC=CC=C1 BB05-0915 [1,1,0,0,0,0|1,0,0]=3 76 B10R1.15 CCC(N)C1=CC=CC=C1 BB55-1056 [1,1,0,0,0,0|1,0,0]=3 77 B10R1.15 CNC(C)C1=CC=CC=C1 BB12-1671 [1,1,0,0,0,0|0,0,0]=2 78 B10R1.15 NC(CO)C1=CC=CC=C1 BB01-6618 [1,1,0,0,0,0|1,0,0]=3 79 B10R1.15 NCC(=O)C1=CC=CC=C1 BB26-0680 [1,1,0,0,0,0|1,0,1]=4 80 B10R1.15 [C-]#[N+]C(C)C1=CC=NC=C1 BB56-1680 [1,1,0,0,0,0|1,0,1]=4 81 B10R1.113 CC(C)C1=CC=NC(N)=N1 BB12-3696 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.113 CC(C)C1=CC=NC(O)=N1 BB12-3691 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.113 CC(C)C1=NC=CC(N)=N1 BB20-0510 [1,1,0,0,0,0|2,0,0]=4 84 B10R1.113 CC(N)C1=CC(Br)=CC=C1 BB53-1527 [1,1,0,0,0,0|1,0,0]=3 85 B10R1.113 CC(N)C1=CC(Cl)=CC=C1 BB55-1702 [1,1,0,0,0,0|1,0,0]=3 86 B10R1.113 CC(N)C1=CC=CC(O)=C1 BB57-2921 [1,1,0,0,0,0|1,0,0]=3 87 B10R1.113 CC1=CC=CC(C(C)N)=C1 BB55-1697 [1,1,0,0,0,0|1,0,0]=3 88 B10R1.113 CC1=CC=CC(C(C)N)=N1 BB31-9154 [1,1,0,0,0,0|2,0,0]=4 89 B10R1.2 COC1=C(C)C(C)=CC=C1 BB12-4726 [1,1,0,0,0,0|2,0,0]=4 90 B10R1.2 O=CC1=CC=CC(F)=C1O BB01-7911 [1,1,0,0,0,0|1,0,1]=4 91 B10R1.4 CC1=CC=CC=C1CCN BB12-2271 [1,1,0,0,0,0|1,0,0]=3 92 B10R1.4 CC1=CC=CC=C1CNN BB55-6543 [1,1,0,0,0,0|2,0,0]=4 93 B10R1.4 CCNC1=CC=CC=C1N BB12-3022 [1,1,0,0,0,0|1,0,0]=3 94 B10R1.4 CCOC1=C(N)N=CC=C1 BB54-3639 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.4 CCOC1=NC=CC=C1N BB32-2785 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.4 NNCC1=C(F)C=CC=C1 BB57-4010 [1,1,0,0,0,0|2,0,0]=4 97 B10R1.4 NNCC1=CC=CC=C1Cl BB57-1614 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.20 CCC1=CC=CC=C1NN BB56-0047 [1,1,0,0,0,0|1,0,0]=3 99 B10R1.20 COC1=CC=CC=C1NN BB01-6123 [1,1,0,0,0,0|2,0,0]=4 100 B10R1.20 COC1=CC=CC=C1NN BB56-0061 [1,1,0,0,0,0|2,0,0]=4 101 B10R1.20 COC1=NC=CC=C1CN BB53-1722 [1,1,0,0,0,0|2,0,0]=4 102 B10R1.20 CSC1=CC=CC=C1NN BB56-0754 [1,1,0,0,0,0|2,0,0]=4 103 B10R1.20 [C-]#[N+]C1=C(CC)C=CC=C1 BB56-1771 [1,1,0,0,0,0|1,0,0]=3 104 B10R1.20 [C-]#[N+]C1=CC=CC=C1OC BB56-1195 [1,1,0,0,0,0|1,0,1]=4 105 B10R1.25 CNC1=C(C)C=C(Cl)C=C1 BB01-7288 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.25 COC1=C(I)C=C(N)C=C1 BB57-5849 [1,1,0,0,0,0|2,0,0]=4 107 B10R1.25 COC1=CN=C(Cl)C=C1O BB31-9319 [1,1,0,0,0,0|2,0,0]=4 108 B10R1.25 NCC1=CC=C(Br)C=C1F BB12-2272 [1,1,0,0,0,0|2,0,0]=4 109 B10R1.25 NCC1=CC=C(O)C=C1O BB12-1397 [1,1,0,0,0,0|1,0,0]=3 110 B10R1.25 O=CC1=C(O)C=C(F)C=C1 BB20-3279 [1,1,0,0,0,0|1,0,1]=4 111 B10R1.30 CC1=CC=C(O)C(CO)=N1 BB12-2201 [1,1,0,0,0,0|2,0,0]=4 112 B10R1.30 CCC1=C(N)C=CC(I)=C1 BB17-0313 [1,1,0,0,0,0|1,0,0]=3 113 B10R1.30 CCC1=C(O)C=CC(C)=N1 BB57-2944 [1,1,0,0,0,0|1,0,0]=3 114 B10R1.30 CNC1=C(C)C=CC(Cl)=C1 BB01-7292 [1,1,0,0,0,0|2,0,0]=4 115 B10R1.30 CNC1=C(Cl)C=CC(F)=C1 BB01-7287 [1,1,0,0,0,0|2,0,0]=4 116 B10R1.30 O=CC1=C(O)C=CC(Br)=C1 BB17-1585 [1,1,0,0,0,0|1,0,1]=4 117 B10R1.30 O=CC1=CC(I)=CC=C1O BB12-2260 [1,1,0,0,0,0|1,0,1]=4 118 B10R1.245 CCC1=C(O)N=CNC1=O BB58-3412 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.245 COC1=C(N)C=CC=C1Cl BB54-2443 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.245 CSC1=C(C)C=CC=C1O BB57-5597 [1,1,0,0,0,0|1,0,0]=3 121 B10R1.245 N#CC1=C(O)C=CC=C1F BB12-1060 [1,1,0,0,0,0|1,0,1]=4 122 B10R1.39 CC(C)N1C=NC=C1CO BB58-2833 [0,1,0,0,1,0|2,0,0]=4 123 B12R1.75 CC(C)NC1=NC=CC=C1CN BB58-5354 [0,1,0,0,0,1|2,0,0]=4 124 B12R1.75 CN(C)CC1=C(C=O)C=CC=C1 BB55-8247 [0,1,0,0,0,1|1,0,1]=4 125 B12R1.75 COC1=C(NC(C)=O)C=CC=C1 BB12-5051 [0,1,0,0,0,1|1,0,1]=4 126 B12R1.124 CC1=CC=CC=C1C(N)C(C)C BB58-0615 [0,1,0,0,0,1|1,0,0]=3 127 B12R1.127 CC(=O)NC1=CC(N)=CC=C1O BB17-2624 [0,1,0,0,0,1|1,0,1]=4 128 B12R1.233 CC(=O)NC1=CC=C(C)C=C1O BB12-2649 [0,1,0,0,0,1|1,0,1]=4 129 B12R1.46 COC1=C(C(C)=O)C=C(Cl)C=C1 BB54-3708 [0,2,0,0,0,0|1,0,1]=4 130 B12R1.46 COC1=CC=C(F)C=C1C(C)=O BB54-4582 [0,2,0,0,0,0|1,0,1]=4 131 B12R1.77 CCC(=O)C1=C(OC)C=CC=C1 BB54-5278 [0,2,0,0,0,0|1,0,1]=4 132 B12R1.77 COC1=CC=CC=C1C(N)CO BB56-2225 [0,2,0,0,0,0|1,0,0]=3 133 B12R1.77 [C-]#[N+]C1=C(C(C)CC)C=CC=C1 BB56-1667 [0,2,0,0,0,0|1,0,0]=3 134 B12R1.87 COC1=C(C(C)=O)C=CC=C1Cl BB54-3707 [0,2,0,0,0,0|1,0,1]=4 135 B12R1.261 CN(C)C1=NC=CC=C1C(=O)O BB12-3630 [0,2,0,0,0,0|2,0,0]=4 136 B12R1.283 CCOC1=C(C(C)N)C=CC=C1 BB55-1643 [0,2,0,0,0,0|1,0,0]=3 137 B12R1.1000 CC(C)N1C(=S)NC(=O)C=C1O BB05-3286 [0,2,0,0,0,0|2,0,0]=4 138 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1N BB05-1929 [0,2,0,0,0,0|0,0,0]=2 139 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1N BB54-0103 [0,2,0,0,0,0|0,0,0]=2 140 B12R1.452 CN(C)C1=CC=C(C=O)C=C1Br BB58-0145 [0,2,0,0,0,0|2,0,0]=4 141 B12R1.1703 CC1=CC=C(C(N)CO)C(C)=C1 BB56-2161 [0,2,0,0,0,0|2,0,0]=4 142 B12R1.1703 CCC(N)C1=C(C)C=C(C)C=C1 BB05-3119 [0,2,0,0,0,0|2,0,0]=4 143 B12R1.354 CC1=CC=C(O)C(C(=O)CCl)=C1 BB57-4973 [0,2,0,0,0,0|1,0,1]=4 144 B12R1.354 CCC(N)C1=C(Cl)C=CC(Cl)=C1 BB54-2534 [0,2,0,0,0,0|2,0,0]=4 145 B10R1.66 CC(=O)\C=C\C1=CC=CO1 BB12-2961 [0,0,1,1,0,0|1,0,1]=4 146 B12R2.24 NC1CCC2=C(C=CC=C2)C1 BB57-6610 [0,0,0,1,0,1|2,0,0]=4 147 B12R2.24 S=C1COC2=CC=CC=C2N1 BB10-0259 [0,0,0,1,0,1|1,0,1]=4 148 B12R2.95 CC1(C)CC2=CC=CC=C2O1 BB12-2136 [0,0,0,1,0,1|0,0,0]=2 149 B12R2.225 NC1=C(NC2CC2)C=CC=C1 BB31-9144 [0,0,0,1,0,1|1,0,0]=3 150 B12R2.1081 O=C1CCOC2=CC=CC=C12 BB01-2459 [0,1,0,1,0,0|1,0,1]=4 151 B12R2.612 CC1=NOC2=CC(O)=CC=C21 BB55-8637 [0,1,0,1,0,0|1,0,1]=4 152 B12R2.612 NC1CCC2=C1C=CC(Cl)=C2 BB31-1383 [0,1,0,1,0,0|2,0,0]=4 153 B12R2.612 O=C1COC2=CC(O)=CC=C12 BB26-0144 [0,1,0,1,0,0|1,0,1]=4 154 B12R2.1317 ClC1=CC(Cl)=C(C2CO2)C=C1 BB31-8358 [0,1,0,1,0,0|2,0,0]=4 155 B12R2.132 NC1=CC2=C(C=C1)OCC2=O BB54-5223 [0,1,0,1,0,0|1,0,1]=4 156 B12R2.132 NC1CCC2=C1C=C(F)C=C2 BB31-3383 [0,1,0,1,0,0|2,0,0]=4 157 B12R2.132 OC1CCC2=C1C=C(Cl)C=C2 BB32-2799 [0,1,0,1,0,0|2,0,0]=4 158 B12R2.1 O\N=C1/COC2=CC=CC=C21 BB12-2095 [0,1,0,1,0,0|1,0,1]=4 159 B12R2.18 CC1=NC2=CC=CC=C2N1C BB01-2782 [0,1,0,1,0,0|2,0,0]=4 160 B8R1.7 CC(C)C1=CC=NN1 BB12-3679 [1,0,0,0,1,0|2,0,0]=4 161 B8R1.7 CC(C)C1=CNN=C1 BB57-2409 [1,0,0,0,1,0|2,0,0]=4 162 B8R1.7 CC(N)C1=CSC=C1 BB57-3256 [1,0,0,0,1,0|2,0,0]=4