0 B10R2.7 B1Oc2ccccc2O1 ACT09441 [0,0,0,0,0,0|2,1,0]=3 1 B10R2.7 c1c[nH]c2c1ccnc2 ACT02479 [0,0,0,0,0,0|2,0,1]=3 2 B10R2.7 c1c[nH]c2c1cncc2 ACT02480 [0,0,0,0,0,0|2,0,1]=3 3 B10R2.7 c1cc2c(cc[nH]2)nc1 ACT02486 [0,0,0,0,0,0|2,0,1]=3 4 B10R2.7 c1cc2c(nc1)CCC2 ACT01400 [0,0,0,0,0,0|3,0,1]=4 5 B10R2.7 c1cc2cc[nH]c2nc1 ACT02468 [0,0,0,0,0,0|2,0,1]=3 6 B10R2.7 c1ccc2c(c1)[nH]cn2 ACT05819 [0,0,0,0,0,0|1,0,0]=1 7 B11R2.1 c1cc2c(c[nH]c2nc1)Br ACT06503 [0,1,0,0,0,0|2,0,1]=4 8 B11R2.1 c1ccc2c(c1)nnn2O ACT09417 [0,1,0,0,0,0|2,0,0]=3 9 B11R2.1 c1ccn2c(c1)c(cn2)Br ACT10408 [0,1,0,0,0,0|2,0,0]=3 10 B11R2.1 c1ccn2c(c1)n[nH]c2=O ACT03755 [0,1,0,0,0,0|3,0,0]=4 11 B11R2.1 c1ccn2c(c1)ncc2I ACT05230 [0,1,0,0,0,0|2,0,0]=3 12 B11R2.10 CC1Cc2ccccc2O1 ACT04628 [0,1,0,0,0,0|1,1,1]=4 13 B11R2.10 c1ccc2c(c1)CC(=C2)Br ACT10966 [0,1,0,0,0,0|2,0,0]=3 14 B11R2.36 Cc1ccc2c(c1)CCN2 ACT10010 [0,1,0,0,0,0|1,0,2]=4 15 B11R2.36 c1c[nH]c2c1cc(cn2)Br ACT02544 [0,1,0,0,0,0|2,0,1]=4 16 B11R2.36 c1cc(cc2c1cc[nH]2)Br ACT02481 [0,1,0,0,0,0|1,0,1]=3 17 B11R2.36 c1cc(nc2c1[nH]cc2)N ACT04889 [0,1,0,0,0,0|2,0,1]=4 18 B11R2.36 c1cc2c(cc1Br)cn[nH]2 ACT01779 [0,1,0,0,0,0|2,0,1]=4 19 B11R2.36 c1cc2c(cc1Cl)cn[nH]2 ACT10091 [0,1,0,0,0,0|2,0,1]=4 20 B11R2.36 c1cc2c(cc1F)CNC2 ACT10050 [0,1,0,0,0,0|3,0,0]=4 21 B11R2.36 c1cc2c(cc1N)nc[nH]2 ACT10631 [0,1,0,0,0,0|1,0,0]=2 22 B11R2.36 c1cc2c(cc1N)scn2 ACT02349 [0,1,0,0,0,0|0,0,0]=1 23 B11R2.36 c1cc2c(cc1O)CNC2 ACT07176 [0,1,0,0,0,0|3,0,0]=4 24 B11R2.36 c1cc2c(cco2)cc1Br ACT09333 [0,1,0,0,0,0|1,1,0]=3 25 B11R2.36 c1cc2cn[nH]c2cc1Br ACT06505 [0,1,0,0,0,0|2,0,1]=4 26 B11R2.36 c1csc2c1nc(nc2)Cl ACT07328 [0,1,0,0,0,0|3,0,0]=4 27 B11R2.106 c1c[nH]c2c1c(ccn2)Cl ACT03614 [0,1,0,0,0,0|2,0,1]=4 28 B11R2.106 c1c[nH]c2c1c(ccn2)O ACT06871 [0,1,0,0,0,0|2,0,1]=4 29 B11R2.106 c1cc(c2cc[nH]c2c1)N ACT02512 [0,1,0,0,0,0|1,0,1]=3 30 B11R2.106 c1cc(c2ccsc2c1)N ACT09121 [0,1,0,0,0,0|1,0,0]=2 31 B11R2.106 c1cc2c(c(c1)Br)CC=C2 ACT04572 [0,1,0,0,0,0|2,0,0]=3 32 B11R2.106 c1cc2c(c(c1)Br)nsn2 ACT11236 [0,1,0,0,0,0|2,0,0]=3 33 B11R2.106 c1cc2c(cc[nH]2)c(c1)F ACT02471 [0,1,0,0,0,0|1,0,1]=3 34 B11R2.106 c1cc2c(cc[nH]2)c(c1)O ACT02464 [0,1,0,0,0,0|1,0,1]=3 35 B11R2.106 c1cc2cc[nH]c2c(c1)Br ACT02474 [0,1,0,0,0,0|1,0,1]=3 36 B11R2.106 c1cc2cc[nH]c2c(c1)Cl ACT02498 [0,1,0,0,0,0|1,0,1]=3 37 B11R2.106 c1cc2cc[nH]c2c(c1)F ACT02485 [0,1,0,0,0,0|1,0,1]=3 38 B11R2.106 c1cc2nccn2c(c1)Br ACT09892 [0,1,0,0,0,0|2,0,0]=3 39 B11R2.106 c1cnc-2[nH]cnc(c12)Cl ACT01623 [0,1,0,0,0,0|3,0,0]=4 40 B11R2.106 c1cnc-2[nH]cnc(c12)O ACT04515 [0,1,0,0,0,0|3,0,0]=4 41 B9R1.8 C=CCc1ccccc1 ACT11557 [0,0,1,0,0,0|2,0,0]=3 42 B9R1.8 CNCc1ccccc1 ACT05529 [0,0,1,0,0,0|3,0,0]=4 43 B9R1.8 CSSc1ccccc1 ACT06218 [0,0,1,0,0,0|2,0,0]=3 44 B9R1.8 c1ccc(cc1)CCBr ACT03430 [0,0,1,0,0,0|2,0,1]=4 45 B9R1.8 c1ccc(cc1)CCCl ACT03431 [0,0,1,0,0,0|2,0,1]=4 46 B9R1.8 c1ccc(cc1)CCS ACT06273 [0,0,1,0,0,0|1,0,1]=3 47 B9R1.12 c1cc(oc1)\C=C\C=O ACT01881 [0,0,1,0,0,0|2,1,0]=4 48 B9R1.14 c1csc(c1C=O)C=O ACT11579 [0,0,1,0,0,0|3,0,0]=4 49 B9R1.15 C#Cc1ccccc1F ACT10250 [0,0,1,0,0,0|2,0,1]=4 50 B9R1.15 COc1ccccc1Br ACT04851 [0,0,1,0,0,0|1,1,1]=4 51 B9R1.15 CSc1c(cccn1)Br ACT04436 [0,0,1,0,0,0|2,0,1]=4 52 B9R1.15 Cc1ccccc1C#C ACT10245 [0,0,1,0,0,0|2,0,1]=4 53 B9R1.15 Cc1ccccc1NN ACT08523 [0,0,1,0,0,0|2,0,1]=4 54 B9R1.15 c1ccc(c(c1)C#N)Cl ACT08962 [0,0,1,0,0,0|3,0,0]=4 55 B9R1.15 c1ccc(c(c1)C#N)I ACT12520 [0,0,1,0,0,0|3,0,0]=4 56 B9R1.15 c1ccc(c(c1)CBr)F ACT00245 [0,0,1,0,0,0|3,0,0]=4 57 B9R1.15 c1ccc(c(c1)CCl)I ACT05459 [0,0,1,0,0,0|3,0,0]=4 58 B9R1.15 c1ccc(c(c1)CN)N ACT09072 [0,0,1,0,0,0|2,0,1]=4 59 B9R1.15 c1ccc(c(c1)CO)I ACT05458 [0,0,1,0,0,0|3,0,0]=4 60 B9R1.15 c1ccc(c(c1)CO)N ACT09816 [0,0,1,0,0,0|2,0,1]=4 61 B9R1.15 c1ccc(c(c1)NN)Br ACT02736 [0,0,1,0,0,0|2,0,1]=4 62 B9R1.15 c1ccc(c(c1)NN)Cl ACT12543 [0,0,1,0,0,0|2,0,1]=4 63 B9R1.15 c1ccc(c(c1)NN)F ACT00607 [0,0,1,0,0,0|2,0,1]=4 64 B11R2.20 c1ccc2c(c1)NCCN2 ACT02791 [0,0,0,0,0,1|1,0,2]=4 65 B8R1.2 C#Cc1ccccc1 ACT08960 [1,0,1,0,0,0|1,0,1]=4 66 B8R1.2 c1cc(cnc1)C=O ACT04700 [1,0,1,0,0,0|1,1,0]=4 67 B8R1.2 c1ccc(cc1)CS ACT06261 [1,0,1,0,0,0|0,0,1]=3 68 B8R1.2 c1ccnc(c1)C=O ACT07081 [1,0,1,0,0,0|1,1,0]=4 69 B8R1.2 c1cnccc1C=O ACT05935 [1,0,1,0,0,0|1,1,0]=4 70 B8R1.5 Cc1ccccc1I ACT05468 [1,0,1,0,0,0|1,0,1]=4 71 B8R1.5 c1ccc(c(c1)Br)Br ACT07584 [1,0,1,0,0,0|2,0,0]=4 72 B8R1.5 c1ccc(c(c1)Br)I ACT05474 [1,0,1,0,0,0|2,0,0]=4 73 B8R1.5 c1ccc(c(c1)Cl)Br ACT03421 [1,0,1,0,0,0|2,0,0]=4 74 B8R1.5 c1ccc(c(c1)N)Br ACT07744 [1,0,1,0,0,0|1,0,1]=4 75 B8R1.5 c1ccc(c(c1)N)I ACT07811 [1,0,1,0,0,0|1,0,1]=4 76 B8R1.5 c1ccc(c(c1)O)I ACT05465 [1,0,1,0,0,0|1,1,0]=4 77 B8R1.5 c1ccc(c(c1)S)S ACT11907 [1,0,1,0,0,0|1,0,0]=3 78 B10R1.4 C=CCc1ccccc1O ACT04626 [0,1,1,0,0,0|2,0,0]=4 79 B10R1.17 C=CCOc1ccccc1 ACT11556 [0,1,1,0,0,0|1,1,0]=4 80 B10R1.17 C=C\C=C\c1ccccc1 ACT09093 [0,1,1,0,0,0|2,0,0]=4 81 B10R1.18 c1ccc(cc1)CC(=O)N ACT04844 [0,1,1,0,0,0|1,0,1]=4 82 B12R2.24 Cc1nc2ccccc2nn1 ACT09151 [0,1,0,0,0,1|1,0,0]=3 83 B12R2.24 c1cc2cc(ccc2nc1)Br ACT10708 [0,1,0,0,0,1|1,0,0]=3 84 B12R2.24 c1cc2cc(ccc2nc1)O ACT04277 [0,1,0,0,0,1|1,0,0]=3 85 B12R2.24 c1cc2cnccc2cc1Br ACT06105 [0,1,0,0,0,1|1,0,0]=3 86 B12R2.24 c1ccc2c(c1)cc(cn2)Br ACT07937 [0,1,0,0,0,1|1,0,0]=3 87 B12R2.24 c1ccc2c[n+](ccc2c1)[O-] ACT09349 [0,1,0,0,0,1|1,0,1]=4 88 B12R2.24 c1ccc2cc(ccc2c1)Br ACT02955 [0,1,0,0,0,1|2,0,0]=4 89 B12R2.24 c1ccc2cnc(cc2c1)N ACT01923 [0,1,0,0,0,1|1,0,0]=3 90 B12R2.1081 c1cc2cccnc2c(c1)Br ACT01910 [0,1,0,0,0,1|1,0,0]=3 91 B12R2.1081 c1cc2cccnc2c(c1)N ACT08349 [0,1,0,0,0,1|1,0,0]=3 92 B12R2.1081 c1cc2cccnc2c(c1)O ACT08881 [0,1,0,0,0,1|1,0,0]=3 93 B12R2.1081 c1cc2cccnc2c(c1)[O-] ACT04183 [0,1,0,0,0,1|1,0,0]=3 94 B12R2.1081 c1ccc2c(c1)c(ccn2)Cl ACT01954 [0,1,0,0,0,1|1,0,0]=3 95 B12R2.1081 c1ccc2c(c1)cccc2F ACT03550 [0,1,0,0,0,1|2,0,0]=4 96 B12R2.1081 c1ccc2c(c1)ccnc2Br ACT05993 [0,1,0,0,0,1|1,0,0]=3 97 B12R2.1081 c1ccc2c(c1)cncc2Br ACT01925 [0,1,0,0,0,1|1,0,0]=3 98 B12R2.1081 c1ccc2c(c1)cncc2F ACT10554 [0,1,0,0,0,1|1,0,0]=3 99 B12R2.1081 c1ccc2c(c1)cncc2O ACT01956 [0,1,0,0,0,1|1,0,0]=3 100 B12R2.132 Cc1c[nH]c2c1cc(cc2)F ACT02529 [0,2,0,0,0,0|1,0,1]=4 101 B12R2.196 Cc1c[nH]c2c1cccc2Br ACT10434 [0,2,0,0,0,0|1,0,1]=4 102 B12R2.32 c1ccc2c(c1)nc(s2)CCl ACT02342 [0,2,0,0,0,0|0,0,0]=2 103 B12R2.202 CC1=Cc2c(cccc2Br)C1 ACT04566 [0,2,0,0,0,0|2,0,0]=4 104 B12R2.202 CC1=Cc2cccc(c2C1)Br ACT04571 [0,2,0,0,0,0|2,0,0]=4 105 B12R2.202 c1cc(c2c(c1)sc(n2)N)O ACT10505 [0,2,0,0,0,0|0,0,0]=2 106 B12R2.202 c1cc2c(c(c1)Br)CC(=O)N2 ACT06658 [0,2,0,0,0,0|1,0,1]=4 107 B12R2.202 c1cc2c(c(c1)Br)NC(=O)C2 ACT06670 [0,2,0,0,0,0|1,0,1]=4 108 B12R2.202 c1cc2c(c(c1)Cl)NC(=O)C2 ACT06669 [0,2,0,0,0,0|1,0,1]=4 109 B12R2.202 c1cc2c(c(c1)F)NC(=O)C2 ACT02565 [0,2,0,0,0,0|1,0,1]=4 110 B12R2.606 Cc1[nH]c2c(n1)cc(cn2)Br ACT10822 [0,2,0,0,0,0|2,0,0]=4 111 B12R2.606 Cc1cc2cc(ccc2[nH]1)O ACT09227 [0,2,0,0,0,0|1,0,1]=4 112 B12R2.606 Cc1cc2cc(ccc2o1)O ACT10889 [0,2,0,0,0,0|1,1,0]=4 113 B12R2.606 Cc1cc2ccc(cc2o1)O ACT10846 [0,2,0,0,0,0|1,1,0]=4 114 B12R2.606 Cc1ccc2c(c1)cc([nH]2)C ACT05059 [0,2,0,0,0,0|1,0,1]=4 115 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 ACT02547 [0,2,0,0,0,0|1,0,1]=4 116 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 ACT02488 [0,2,0,0,0,0|1,0,1]=4 117 B12R2.606 c1cc2c(cc1Br)nc(o2)N ACT03458 [0,2,0,0,0,0|0,1,0]=3 118 B12R2.606 c1cc2c(cc1Br)sc(=O)[nH]2 ACT02311 [0,2,0,0,0,0|0,0,1]=3 119 B12R2.606 c1cc2c(cc1Br)sc(n2)Cl ACT02341 [0,2,0,0,0,0|0,0,0]=2 120 B12R2.606 c1cc2c(cc1Br)sc(n2)N ACT02307 [0,2,0,0,0,0|0,0,0]=2 121 B12R2.606 c1cc2c(cc1Cl)nc(o2)S ACT09314 [0,2,0,0,0,0|0,1,0]=3 122 B12R2.606 c1cc2c(cc1Cl)sc(n2)Cl ACT02328 [0,2,0,0,0,0|0,0,0]=2 123 B12R2.606 c1cc2c(cc1F)NC(=O)C2 ACT02554 [0,2,0,0,0,0|1,0,1]=4 124 B12R2.606 c1cc2c(cc1N)sc(n2)S ACT10157 [0,2,0,0,0,0|0,0,0]=2 125 B12R2.606 c1cc2nc(cn2cc1Br)Cl ACT11147 [0,2,0,0,0,0|2,0,0]=4 126 B12R2.44 COc1ccc2cc[nH]c2c1 ACT02555 [0,2,0,0,0,0|1,0,1]=4 127 B12R2.44 CSc1ccc2c(c1)cc[nH]2 ACT10265 [0,2,0,0,0,0|1,0,1]=4 128 B12R2.100 Cc1cc2c(cc1C)nc[nH]2 ACT05792 [0,2,0,0,0,0|1,0,0]=3 129 B12R2.246 c1cn2cc(cc(c2n1)N)Br ACT04532 [0,2,0,0,0,0|2,0,0]=4 130 B12R2.246 c1nc2c(nc(nc2s1)O)O ACT09794 [0,2,0,0,0,0|2,0,0]=4 131 B12R2.221 c1cc(c2c(c1Br)nsn2)Br ACT11537 [0,2,0,0,0,0|2,0,0]=4 132 B12R2.315 COc1cccc2c1[nH]cc2 ACT02567 [0,2,0,0,0,0|1,0,1]=4 133 B12R2.315 COc1cccc2c1cc[nH]2 ACT02514 [0,2,0,0,0,0|1,0,1]=4 134 B12R2.315 c1cc(c2c(c1)non2)CO ACT04523 [0,2,0,0,0,0|2,0,0]=4