0 B11R2.10 CC1=NC2=CC=CC=C2O1 BB12-1505 [0,0,0,0,0,0|0,0,0]=0 1 B11R2.10 CC1=NC2=CC=CN=C2N1 BB12-2830 [0,0,0,0,0,0|2,0,0]=2 2 B11R2.10 NC1=NC2=C(N=CC=C2)S1 BB56-2479 [0,0,0,0,0,0|2,1,0]=3 3 B11R2.10 NC1=NN2C=CN=CC2=N1 BB12-1253 [0,0,0,0,0,0|4,0,0]=4 4 B11R2.10 O=C1NC2=CC=CC=C2N1 BB12-1666 [0,0,0,0,0,0|2,0,1]=3 5 B11R2.10 S=C1NC2=NC=CC=C2O1 BB12-2264 [0,0,0,0,0,0|2,0,1]=3 6 B11R2.10 SC1=NC2=NC=CC=C2O1 BB12-1574 [0,0,0,0,0,0|2,0,0]=2 7 B10R2.7 C1=CC2=C(C=C1)NN=N2 BB01-6327 [1,0,0,0,0,0|2,0,0]=3 8 B10R2.7 C1=CC2=C(N=C1)NC=C2 BB12-3415 [1,0,0,0,0,0|2,0,1]=4 9 B10R2.7 C1=CC2=NC=CN2C=C1 BB56-1794 [1,0,0,0,0,0|2,0,0]=3 10 B10R2.7 C1=CC2=NN=CN2C=C1 BB26-0431 [1,0,0,0,0,0|3,0,0]=4 11 B10R2.7 C1=CN2N=CN=C2N=C1 BB12-2234 [1,0,0,0,0,0|3,0,0]=4 12 B12R2.18 CC1CC2=CC=CC=C2C1=O BB12-2283 [0,1,0,0,0,0|2,0,1]=4 13 B12R2.18 CN1C2=CC=CC=C2N=C1Cl BB12-1469 [0,1,0,0,0,0|2,0,0]=3 14 B12R2.32 C=CC1=NC2=CC=CC=C2N1 BB12-1680 [0,1,0,0,0,0|1,0,1]=3 15 B12R2.32 CNC1CC2=CC=CC=C2C1 BB53-1624 [0,1,0,0,0,0|2,0,1]=4 16 B12R2.32 ClCC1=NN2C=CC=NC2=N1 BB12-1185 [0,1,0,0,0,0|3,0,0]=4 17 B12R2.32 N#CC1=NC2=CC=CC=C2S1 BB12-1731 [0,1,0,0,0,0|0,1,1]=3 18 B12R2.32 NCC1=CN2C=CC=CC2=N1 BB12-2946 [0,1,0,0,0,0|2,0,0]=3 19 B12R2.32 NCC1=NC2=CC=CC=C2N1 BB12-2371 [0,1,0,0,0,0|1,0,0]=2 20 B12R2.32 NCC1=NN2C=CC=NC2=N1 BB12-1234 [0,1,0,0,0,0|3,0,0]=4 21 B12R2.32 OCC1=NC2=CC=CN=C2N1 BB12-2963 [0,1,0,0,0,0|2,0,0]=3 22 B12R2.95 CC1(C)CC2=CC=CC=C2O1 BB12-2136 [0,1,0,0,0,0|1,0,1]=3 23 B12R2.202 CC1=C2N=C(S)OC2=CC=C1 BB12-1589 [0,1,0,0,0,0|1,0,0]=2 24 B12R2.202 CC1=C2OC(N)=NC2=CC=C1 BB17-0771 [0,1,0,0,0,0|1,0,0]=2 25 B12R2.202 CC1=CC2=CC=CC(N)=C2O1 BB12-1928 [0,1,0,0,0,0|1,0,0]=2 26 B12R2.202 SC1=NC2=C(O1)C(Cl)=CC=C2 BB12-1564 [0,1,0,0,0,0|1,0,0]=2 27 B12R2.606 CC1=CC2=C(C=C1)N=C(N)O2 BB12-2735 [0,1,0,0,0,0|1,0,0]=2 28 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 BB56-2371 [0,1,0,0,0,0|2,0,1]=4 29 B12R2.606 CC1=CC2=CC(N)=CC=C2O1 BB12-1929 [0,1,0,0,0,0|1,0,0]=2 30 B12R2.606 CC1=CC2=NC(C)=CN2C=C1 BB56-1792 [0,1,0,0,0,0|2,0,0]=3 31 B12R2.606 CC1=CC=C2NC(=O)NC2=C1 BB12-2964 [0,1,0,0,0,0|2,0,1]=4 32 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 BB12-1457 [0,1,0,0,0,0|1,0,1]=3 33 B12R2.606 CC1=CC=C2NC(Cl)=NC2=C1 BB12-3012 [0,1,0,0,0,0|2,0,0]=3 34 B12R2.606 CC1=CC=C2NC(N)=NC2=C1 BB12-2729 [0,1,0,0,0,0|2,0,0]=3 35 B12R2.606 CC1=CC=C2OC(=O)NC2=C1 BB12-1458 [0,1,0,0,0,0|1,0,1]=3 36 B12R2.606 CC1=CC=C2OC(S)=NC2=N1 BB12-1580 [0,1,0,0,0,0|2,0,0]=3 37 B12R2.606 CC1=NC2=CC(Br)=CN=C2N1 BB12-2968 [0,1,0,0,0,0|2,0,0]=3 38 B12R2.606 CC1=NC2=CC(N)=CC=C2N1 BB12-2007 [0,1,0,0,0,0|1,0,0]=2 39 B12R2.606 NC1=CC=C2N=C(N)SC2=C1 BB12-4725 [0,1,0,0,0,0|1,1,0]=3 40 B12R2.606 NC1=CC=C2NC(O)=NC2=C1 BB26-0788 [0,1,0,0,0,0|2,0,0]=3 41 B12R2.606 NC1=NC2=CC=C(Cl)C=C2O1 BB12-3087 [0,1,0,0,0,0|1,0,0]=2 42 B12R2.606 NC1=NC2=CC=C(F)C=C2O1 BB12-2723 [0,1,0,0,0,0|1,0,0]=2 43 B12R2.606 NC1=NC2=CC=C(O)C=C2S1 BB12-2129 [0,1,0,0,0,0|1,1,0]=3 44 B12R2.606 NC1=NC2=CC=C(S)C=C2S1 BB17-0784 [0,1,0,0,0,0|1,1,0]=3 45 B12R2.606 O=C1NC2=CC=C(F)C=C2O1 BB12-1459 [0,1,0,0,0,0|1,0,1]=3 46 B12R2.606 OC1=NC2=CC=C(F)C=C2N1 BB17-0211 [0,1,0,0,0,0|2,0,0]=3 47 B10R1.4 CCNC1=CC=CC=C1N BB12-3022 [0,0,1,0,0,0|1,0,2]=4 48 B10R1.16 CC1=CC=C(\C=C\C=O)O1 BB17-2261 [0,0,1,0,0,0|2,0,0]=3 49 B10R1.18 CC(=O)NC1=CC=CN=C1 BB12-1692 [0,0,1,0,0,0|1,0,2]=4 50 B12R2.24 FC1=CC2=CC=CC=C2C=C1 BB53-1916 [0,0,0,0,0,1|3,0,0]=4 51 B12R2.24 O=C1COC2=CC=CN=C2N1 BB12-2193 [0,0,0,0,0,1|2,0,1]=4 52 B12R2.24 O=C1CSC2=CC=CC=C2N1 BB20-4697 [0,0,0,0,0,1|1,1,1]=4 53 B12R2.24 S=C1COC2=CC=CC=C2N1 BB10-0259 [0,0,0,0,0,1|1,0,1]=3 54 B9R1.15 CNC1=C(C)C=CC=C1 BB01-7286 [1,0,1,0,0,0|1,0,1]=4 55 B9R1.15 CNC1=CC=CC=C1N BB12-2750 [1,0,1,0,0,0|1,0,1]=4 56 B9R1.15 COC1=CC=CN=C1C BB17-0165 [1,0,1,0,0,0|2,0,0]=4 57 B11R1.17 ClC1=C(OCCBr)C=CC=C1 BB17-1653 [0,1,1,0,0,0|1,0,1]=4 58 B11R1.41 CCOC1=CC=CC=C1NN BB56-0057 [0,1,1,0,0,0|0,0,2]=4 59 B11R1.81 CCOC1=C(N)C=C(C)C=C1 BB17-1893 [0,1,1,0,0,0|0,0,2]=4 60 B11R1.81 CCOC1=C(N)C=C(Cl)C=C1 BB17-1894 [0,1,1,0,0,0|0,0,2]=4 61 B11R1.86 CC(=O)NC1=CC=CC=C1S BB12-2835 [0,1,1,0,0,0|0,1,1]=4 62 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 BB12-3713 [0,1,1,0,0,0|0,0,2]=4 63 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 BB12-3000 [0,1,1,0,0,0|0,0,2]=4 64 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [0,1,1,0,0,0|2,0,0]=4 65 B11R1.40 O=C(CS)NC1=CC=CC=C1 BB12-3947 [0,1,1,0,0,0|0,0,2]=4 66 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 BB12-2255 [0,1,1,0,0,0|1,0,0]=3 67 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 BB53-1496 [0,1,1,0,0,0|2,0,0]=4 68 B11R2.36 CC1=CC=C2N=CNC2=C1 BB12-4747 [1,1,0,0,0,0|1,0,0]=3 69 B11R2.36 CC1=CC=C2NN=NC2=C1 BB12-3006 [1,1,0,0,0,0|2,0,0]=4 70 B11R2.36 ClC1=CC=C2N=NNC2=C1 BB12-3008 [1,1,0,0,0,0|2,0,0]=4 71 B11R2.36 FC1=CC=C2NN=NC2=C1 BB12-3005 [1,1,0,0,0,0|2,0,0]=4 72 B11R2.36 NC1=CC2=NON=C2C=C1 BB01-4592 [1,1,0,0,0,0|2,0,0]=4 73 B11R2.106 BrC1=C2OC=NC2=NC=C1 BB26-0146 [1,1,0,0,0,0|1,0,0]=3 74 B11R2.106 CC1=C2N=NNC2=CC=C1 BB12-3009 [1,1,0,0,0,0|2,0,0]=4 75 B11R2.106 ClC1=NC=CC2=C1OC=C2 BB90-0078 [1,1,0,0,0,0|2,0,0]=4 76 B11R2.106 NC1=C2NC=NC2=CC=C1 BB12-1727 [1,1,0,0,0,0|1,0,0]=3 77 B11R2.106 O=C1NC=CC2=C1C=CO2 BB01-2448 [1,1,0,0,0,0|2,0,0]=4 78 B13R2.57 NNC1=NC2=CC=CC=C2N=C1 BB10-0313 [0,1,0,0,0,1|2,0,0]=4 79 B13R2.57 NNC1=NC2=CC=CC=C2OC1 BB10-0593 [0,1,0,0,0,1|1,0,0]=3 80 B13R2.57 OCC1COC2=CC=CC=C2O1 BB60-7971 [0,1,0,0,0,1|1,0,1]=4 81 B13R2.155 CC1=CC=C2OCC(=S)NC2=C1 BB10-0377 [0,1,0,0,0,1|1,0,1]=4 82 B13R2.162 CC1=NC2=C(Br)C=CC=C2C=C1 BB56-0660 [0,1,0,0,0,1|1,0,0]=3 83 B13R2.328 CC1=NC2=CC=CC=C2C(=O)N1 BB10-0253 [0,1,0,0,0,1|1,0,0]=3 84 B13R2.328 CC1=NC2=NC=CC=C2C(=O)N1 BB12-1115 [0,1,0,0,0,1|2,0,0]=4 85 B13R2.328 O=C1N=[N+]([O-])C2=CC=CC=C2N1 BB12-1595 [0,1,0,0,0,1|2,0,0]=4 86 B13R2.328 OC1=NC2=CC=CC=C2C(O)=N1 BB12-1549 [0,1,0,0,0,1|2,0,0]=4 87 B13R2.369 O=C1NC2=CC=CC=C2OC1=O BB12-1662 [0,1,0,0,0,1|1,0,1]=4 88 B13R2.3683 CC1=CC=C2NC(=O)COC2=C1 BB10-0258 [0,1,0,0,0,1|1,0,1]=4 89 B13R2.3683 CC1=CC=C2NC(=S)COC2=C1 BB10-0376 [0,1,0,0,0,1|1,0,1]=4 90 B13R2.3683 CC1=NC2=CC=C(N)C=C2C=C1 BB12-4988 [0,1,0,0,0,1|1,0,0]=3 91 B13R2.3683 O=C1COC2=CC(Cl)=CC=C2N1 BB10-0256 [0,1,0,0,0,1|1,0,1]=4 92 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=N1 BB17-0572 [0,1,0,0,0,1|1,0,0]=3 93 B13R2.45 CN1C2=CC=CC=C2N=C1CCl BB12-3126 [0,2,0,0,0,0|1,0,0]=3 94 B13R2.135 CCN1C(C)=NC2=CC=CN=C21 BB20-4578 [0,2,0,0,0,0|2,0,0]=4 95 B13R2.135 CCN1C2=CC=CC=C2N=C1N BB53-1597 [0,2,0,0,0,0|2,0,0]=4 96 B13R2.5190 CC1=NC2=CC(N)=CC=C2N1C BB12-1088 [0,2,0,0,0,0|1,0,0]=3 97 B13R2.26 CCSC1=NC2=CC=CC=C2N1 BB10-1216 [0,2,0,0,0,0|1,0,0]=3 98 B13R2.26 ClCCC1=NC2=CC=CC=C2N1 BB12-1677 [0,2,0,0,0,0|1,0,0]=3 99 B13R2.26 NCCC1=CN2C=CC=CC2=N1 BB53-1850 [0,2,0,0,0,0|2,0,0]=4 100 B13R2.43 CC1=CC2=NC(CCl)=CN2C=C1 BB10-1042 [0,2,0,0,0,0|2,0,0]=4 101 B13R2.43 CC1=CN2C=C(CCl)N=C2C=C1 BB10-1043 [0,2,0,0,0,0|2,0,0]=4 102 B13R2.43 CCC1=NC2=CC(Br)=CN=C2N1 BB12-2969 [0,2,0,0,0,0|2,0,0]=4 103 B13R2.43 CSC1=NC2=NC(C)=CC=C2O1 BB12-1581 [0,2,0,0,0,0|1,0,0]=3 104 B13R2.43 ClCC1=CN2C=C(Cl)C=CC2=N1 BB10-0091 [0,2,0,0,0,0|2,0,0]=4 105 B13R2.43 NCC1=CN2C=C(F)C=CC2=N1 BB90-0055 [0,2,0,0,0,0|2,0,0]=4 106 B13R2.43 NCC1=NC2=CC(F)=CC=C2N1 BB12-3092 [0,2,0,0,0,0|1,0,0]=3 107 B13R2.43 NNC1=NC2=CC=C(Cl)C=C2O1 BB12-1462 [0,2,0,0,0,0|1,0,0]=3 108 B13R2.43 OCC1=NC2=CC=C(Br)C=C2N1 BB12-2645 [0,2,0,0,0,0|1,0,0]=3 109 B13R2.54 CC1=C2N=C(NN)NC2=CC=C1 BB12-1586 [0,2,0,0,0,0|2,0,0]=4 110 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 BB12-3811 [0,2,0,0,0,0|1,0,1]=4 111 B13R2.435 CC(C)C1=NC2=CC=CC=C2N1 BB12-1578 [0,2,0,0,0,0|1,0,0]=3 112 B13R2.435 CC(N)C1=CN2C=CC=CC2=N1 BB12-2941 [0,2,0,0,0,0|2,0,0]=4 113 B13R2.435 CC(N)C1=NC2=C(C=CC=C2)S1 BB12-2077 [0,2,0,0,0,0|0,1,0]=3 114 B13R2.435 O=C(O)C1=NC2=CC=CC=C2O1 BB12-1678 [0,2,0,0,0,0|0,0,1]=3 115 B13R2.5397 CC1=NC2=C(Br)C=C(Cl)C=C2N1 BB17-2734 [0,2,0,0,0,0|1,0,0]=3 116 B13R2.5397 CC1=NC2=CC(N)=CC(C)=C2O1 BB17-0979 [0,2,0,0,0,0|0,0,0]=2 117 B13R2.5397 NC1=NC2=C(F)C=C(F)C=C2S1 BB56-0199 [0,2,0,0,0,0|1,1,0]=4 118 B13R2.2121 CCC1=CC2=C(C=C1)N=C(N)S2 BB56-0460 [0,2,0,0,0,0|1,1,0]=4 119 B13R2.2121 CCC1=CC=C2N=C(N)NC2=C1 BB56-0498 [0,2,0,0,0,0|2,0,0]=4 120 B13R2.2121 COC1=CC=C2NC(S)=NC2=C1 BB12-1347 [0,2,0,0,0,0|2,0,0]=4 121 B11R1.91 NC(=S)COC1=CC=CC=C1 BB20-4704 [0,0,1,0,0,1|1,0,1]=4 122 B11R1.91 O=C(O)CNC1=CC=CC=C1 BB12-2585 [0,0,1,0,0,1|1,0,1]=4