0 B11R2.10 Cc1cn2ccccc2n1 CM10614 [0,0,0,0,0,0|2,0,0]=2 1 B11R2.10 c1ccc2c(c1)CN(C2)N CM10313 [0,0,0,0,0,0|3,0,1]=4 2 B11R2.10 c1cncc2c1sc(n2)N CM10620 [0,0,0,0,0,0|3,1,0]=4 3 B10R2.7 c1c[nH]c2c1ccnc2 CM14075 [1,0,0,0,0,0|2,0,0]=3 4 B10R2.7 c1c[nH]c2c1cncc2 CM10258 [1,0,0,0,0,0|2,0,0]=3 5 B10R2.7 c1cc2c(cc[nH]2)nc1 CM14073 [1,0,0,0,0,0|2,0,0]=3 6 B10R2.7 c1cc2cc[nH]c2nc1 CM14215 [1,0,0,0,0,0|2,0,0]=3 7 B10R2.7 c1cc2cn[nH]c2nc1 CM10820 [1,0,0,0,0,0|3,0,0]=4 8 B10R2.7 c1ccc2c(c1)CNC2 CM10320 [1,0,0,0,0,0|2,0,1]=4 9 B10R2.7 c1ccn2cccc2c1 CM10848 [1,0,0,0,0,0|2,0,0]=3 10 B12R2.18 Cn1c(=O)c2ccccc2[nH]1 CM10169 [0,1,0,0,0,0|2,0,0]=3 11 B12R2.18 Cn1c2ccccc2oc1=O CM14408 [0,1,0,0,0,0|2,0,0]=3 12 B12R2.32 c1ccc2c(c1)nc(s2)CCl CM14325 [0,1,0,0,0,0|1,1,0]=3 13 B12R2.95 c1ccc2c(c1)OC(O2)(F)F CM14007 [0,1,0,0,0,0|2,0,1]=4 14 B12R2.202 Cc1cn2c(n1)cccc2Br CM10609 [0,1,0,0,0,0|2,0,0]=3 15 B12R2.202 c1cc2c(c(c1)Br)CC(=O)N2 CM14303 [0,1,0,0,0,0|2,0,1]=4 16 B12R2.202 c1cc2c(c(c1)Br)NC(=O)C2 CM14308 [0,1,0,0,0,0|2,0,1]=4 17 B12R2.202 c1cc2c(c(c1)Cl)NC(=O)C2 CM14306 [0,1,0,0,0,0|2,0,1]=4 18 B12R2.202 c1cc2c(c(c1)F)NC(=O)C2 CM14365 [0,1,0,0,0,0|2,0,1]=4 19 B12R2.202 c1cc2c(c(c1)F)sc(n2)N CM13864 [0,1,0,0,0,0|2,1,0]=4 20 B12R2.606 Cc1cc2cc(ccc2[nH]1)Br CM13592 [0,1,0,0,0,0|1,0,0]=2 21 B12R2.606 Cc1cc2cc(ccc2[nH]1)F CM13612 [0,1,0,0,0,0|1,0,0]=2 22 B12R2.606 Cc1cc2ccc(cc2[nH]1)F CM13613 [0,1,0,0,0,0|1,0,0]=2 23 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 CM14289 [0,1,0,0,0,0|2,0,1]=4 24 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 CM14364 [0,1,0,0,0,0|2,0,1]=4 25 B12R2.606 c1cc2c(cc1Br)nc([nH]2)N CM10544 [0,1,0,0,0,0|3,0,0]=4 26 B12R2.606 c1cc2c(cc1Br)nc(o2)N CM10622 [0,1,0,0,0,0|2,0,0]=3 27 B12R2.606 c1cc2c(cc1Br)sc(n2)Cl CM14356 [0,1,0,0,0,0|2,1,0]=4 28 B12R2.606 c1cc2c(cc1F)NC(=O)C2 CM14302 [0,1,0,0,0,0|2,0,1]=4 29 B12R2.606 c1cc2c(cc1F)nc(s2)N CM13863 [0,1,0,0,0,0|2,1,0]=4 30 B10R1.4 CCOc1cnccc1N CM10330 [0,0,1,0,0,0|2,0,1]=4 31 B10R1.4 c1ccc(c(c1)C=NO)F CM12025 [0,0,1,0,0,0|3,0,0]=4 32 B12R2.24 c1cc(=O)[nH]c2c1cncc2 CM10284 [0,0,0,0,0,1|3,0,0]=4 33 B12R2.24 c1cc(cc2c1ccnc2)O CM10593 [0,0,0,0,0,1|3,0,0]=4 34 B12R2.24 c1cc2c(ccc(n2)O)nc1 CM10314 [0,0,0,0,0,1|3,0,0]=4 35 B12R2.24 c1cc2cc(ccc2nc1)I CM13892 [0,0,0,0,0,1|3,0,0]=4 36 B12R2.24 c1cc2cnccc2cc1F CM10586 [0,0,0,0,0,1|3,0,0]=4 37 B12R2.24 c1ccc2c(c1)[nH]c(=O)cn2 CM14099 [0,0,0,0,0,1|2,0,0]=3 38 B9R1.8 c1ccc(cc1)CNO CM10002 [1,0,1,0,0,0|1,0,1]=4 39 B9R1.15 COc1cccnc1Br CM14120 [1,0,1,0,0,0|2,0,0]=4 40 B9R1.15 COc1cccnc1N CM10903 [1,0,1,0,0,0|2,0,0]=4 41 B9R1.15 COc1cnccc1N CM10329 [1,0,1,0,0,0|2,0,0]=4 42 B9R1.15 CSc1ccccc1I CM11822 [1,0,1,0,0,0|1,1,0]=4 43 B9R1.15 c1ccc(c(c1)C=O)I CM11995 [1,0,1,0,0,0|2,0,0]=4 44 B11R1.41 CCOc1ccccc1OC CM11747 [0,1,1,0,0,0|0,0,2]=4 45 B11R1.86 CC(=O)Cc1ccccc1Cl CM10944 [0,1,1,0,0,0|1,0,1]=4 46 B11R1.86 CC(=O)Cc1ccccc1F CM10960 [0,1,1,0,0,0|1,0,1]=4 47 B11R1.20 CC(=O)Cc1ccc(cc1)Cl CM10951 [0,1,1,0,0,0|0,0,2]=4 48 B11R1.20 CC(=O)Cc1ccc(cc1)F CM10927 [0,1,1,0,0,0|0,0,2]=4 49 B11R1.20 CC(=O)Oc1ccc(cc1)F CM12027 [0,1,1,0,0,0|1,0,0]=3 50 B11R1.20 CC(C)Oc1ccc(cc1)N CM11503 [0,1,1,0,0,0|0,0,2]=4 51 B11R1.20 c1cc(ccc1CC(=O)O)F CM13704 [0,1,1,0,0,0|1,0,1]=4 52 B11R1.157 Cc1cccc(c1)CC(=O)O CM13725 [0,1,1,0,0,0|1,0,1]=4 53 B11R1.157 c1cc(cc(c1)F)CC(=O)O CM13703 [0,1,1,0,0,0|1,0,1]=4 54 B11R1.157 c1cc(cc(c1)I)CC(=O)O CM13719 [0,1,1,0,0,0|1,0,1]=4 55 B11R2.1 Cc1c2ccccc2[nH]n1 CM10785 [1,1,0,0,0,0|2,0,0]=4 56 B11R2.1 c1ccc2c(c1)CNC2=O CM10840 [1,1,0,0,0,0|2,0,0]=4 57 B11R2.1 c1ccc2c(c1)c(=O)[nH][nH]2 CM10841 [1,1,0,0,0,0|2,0,0]=4 58 B11R2.1 c1ccc2c(c1)c(co2)Br CM10750 [1,1,0,0,0,0|0,0,0]=2 59 B11R2.1 c1ccc2c(c1)c(n[nH]2)Br CM10098 [1,1,0,0,0,0|2,0,0]=4 60 B11R2.1 c1ccc2c(c1)c(no2)Cl CM10136 [1,1,0,0,0,0|1,0,0]=3 61 B11R2.1 c1ccc2c(c1)c(no2)O CM10137 [1,1,0,0,0,0|1,0,0]=3 62 B11R2.36 Cc1ccc2c(c1)cco2 CM10745 [1,1,0,0,0,0|0,0,0]=2 63 B11R2.36 Cc1ccc2ccsc2c1 CM10722 [1,1,0,0,0,0|0,1,0]=3 64 B11R2.36 c1c[nH]c2c1ncc(c2)Br CM14253 [1,1,0,0,0,0|2,0,0]=4 65 B11R2.36 c1cc(cc2c1cc[nH]2)F CM13607 [1,1,0,0,0,0|1,0,0]=3 66 B11R2.36 c1cc(cc2c1cco2)Br CM10729 [1,1,0,0,0,0|0,0,0]=2 67 B11R2.36 c1cc(cc2c1cco2)O CM10757 [1,1,0,0,0,0|0,0,0]=2 68 B11R2.36 c1cc(cc2c1ccs2)Br CM10504 [1,1,0,0,0,0|0,1,0]=3 69 B11R2.36 c1cc(nc2c1nco2)Br CM10094 [1,1,0,0,0,0|2,0,0]=4 70 B11R2.36 c1cc2c(cc1Br)CCO2 CM10336 [1,1,0,0,0,0|0,0,2]=4 71 B11R2.36 c1cc2c(cc1Br)OCC2 CM10763 [1,1,0,0,0,0|0,0,2]=4 72 B11R2.36 c1cc2c(cc1I)CCO2 CM10335 [1,1,0,0,0,0|0,0,2]=4 73 B11R2.36 c1cc2c(cc1I)cn[nH]2 CM10802 [1,1,0,0,0,0|2,0,0]=4 74 B11R2.36 c1cc2c(cc1N)CCO2 CM10334 [1,1,0,0,0,0|0,0,2]=4 75 B11R2.36 c1cc2c(cc1N)scn2 CM14358 [1,1,0,0,0,0|1,1,0]=4 76 B11R2.36 c1cc2c(cc[nH]2)cc1F CM13606 [1,1,0,0,0,0|1,0,0]=3 77 B11R2.36 c1cc2c(cco2)cc1Br CM10728 [1,1,0,0,0,0|0,0,0]=2 78 B11R2.36 c1cc2c(cco2)cc1Cl CM10740 [1,1,0,0,0,0|0,0,0]=2 79 B11R2.36 c1cc2c(cco2)cc1F CM10741 [1,1,0,0,0,0|0,0,0]=2 80 B11R2.36 c1cc2c(ccs2)cc1Br CM10617 [1,1,0,0,0,0|0,1,0]=3 81 B11R2.106 Cc1cccc2c1ccs2 CM10545 [1,1,0,0,0,0|0,1,0]=3 82 B11R2.106 Cc1cccc2c1occ2 CM10746 [1,1,0,0,0,0|0,0,0]=2 83 B11R2.106 c1c[nH]c2c1c(ccn2)Br CM14081 [1,1,0,0,0,0|2,0,0]=4 84 B11R2.106 c1c[nH]c2c1c(ccn2)Cl CM14082 [1,1,0,0,0,0|2,0,0]=4 85 B11R2.106 c1cc(c2c(c1)ocn2)N CM10312 [1,1,0,0,0,0|1,0,0]=3 86 B11R2.106 c1cc(c2ccoc2c1)O CM10739 [1,1,0,0,0,0|0,0,0]=2 87 B11R2.106 c1cc(c2ccsc2c1)F CM10724 [1,1,0,0,0,0|0,1,0]=3 88 B11R2.106 c1cc2c(cc[nH]2)c(c1)F CM13604 [1,1,0,0,0,0|1,0,0]=3 89 B11R2.106 c1cc2c(ccs2)c(c1)Br CM10723 [1,1,0,0,0,0|0,1,0]=3 90 B11R2.106 c1cc2cc[nH]c2c(c1)F CM13609 [1,1,0,0,0,0|1,0,0]=3 91 B11R2.106 c1cc2ccoc2c(c1)Br CM10530 [1,1,0,0,0,0|0,0,0]=2 92 B11R2.106 c1cc2ccoc2c(c1)Cl CM10751 [1,1,0,0,0,0|0,0,0]=2 93 B11R2.106 c1cc2ccoc2c(c1)F CM10752 [1,1,0,0,0,0|0,0,0]=2 94 B11R2.106 c1cnc(c2c1occ2)Cl CM14121 [1,1,0,0,0,0|1,0,0]=3 95 B11R2.106 c1csc2c1c(cnc2)Br CM10775 [1,1,0,0,0,0|1,1,0]=4 96 B13R2.32 c1ccc2c(c1)ccc(c2O)Br CM11054 [0,1,0,0,0,1|2,0,0]=4 97 B13R2.32 c1ccc2c(c1)cnc(c2Br)N CM10321 [0,1,0,0,0,1|2,0,0]=4 98 B13R2.57 [C-]#[N+]c1ccc2ccccc2c1 CM14093 [0,1,0,0,0,1|1,0,1]=4 99 B13R2.57 c1ccc2cc(ccc2c1)CCl CM13877 [0,1,0,0,0,1|1,0,0]=3 100 B13R2.155 c1cc(cc2c1ccc(=O)[nH]2)O CM10300 [0,1,0,0,0,1|2,0,0]=4 101 B13R2.155 c1cc(cc2c1ccc(n2)Cl)Br CM10598 [0,1,0,0,0,1|2,0,0]=4 102 B13R2.155 c1cc2c(cc1Br)NC(=O)CO2 CM10241 [0,1,0,0,0,1|2,0,0]=4 103 B13R2.155 c1cc2c(cc1Cl)NC(=O)CO2 CM10219 [0,1,0,0,0,1|2,0,0]=4 104 B13R2.155 c1cc2c(cc1O)NC(=O)CO2 CM10579 [0,1,0,0,0,1|2,0,0]=4 105 B13R2.162 c1cc2c(c(c1)F)NC(=O)CO2 CM10140 [0,1,0,0,0,1|2,0,0]=4 106 B13R2.162 c1cc2ccc(=O)[nH]c2c(c1)Br CM10591 [0,1,0,0,0,1|2,0,0]=4 107 B13R2.162 c1cc2ccc(nc2c(c1)Br)N CM10275 [0,1,0,0,0,1|2,0,0]=4 108 B13R2.328 Cc1cc2ccccc2c(n1)O CM10269 [0,1,0,0,0,1|1,0,0]=3 109 B13R2.328 c1ccc2c(c1)c(=O)cc([nH]2)N CM10363 [0,1,0,0,0,1|2,0,0]=4 110 B13R2.328 c1ccc2c(c1)c(cc(n2)Br)N CM10156 [0,1,0,0,0,1|2,0,0]=4 111 B13R2.328 c1ccc2c(c1)c(cc(n2)N)Br CM10588 [0,1,0,0,0,1|2,0,0]=4 112 B13R2.328 c1ccc2c(c1)c(cc(n2)N)Cl CM10367 [0,1,0,0,0,1|2,0,0]=4 113 B13R2.328 c1ccc2c(c1)c(nc(n2)Cl)Cl CM14418 [0,1,0,0,0,1|2,0,0]=4 114 B13R2.328 c1ccc2c(c1)c(nc(n2)N)O CM10369 [0,1,0,0,0,1|2,0,0]=4 115 B13R2.328 c1ccc2c(c1)c(nc(n2)O)O CM14472 [0,1,0,0,0,1|2,0,0]=4 116 B13R2.369 c1ccc2c(c1)nc(c(n2)Cl)Cl CM13920 [0,1,0,0,0,1|2,0,0]=4 117 B13R2.3683 c1cc(=O)[nH]c2c1cc(cc2)Br CM10592 [0,1,0,0,0,1|2,0,0]=4 118 B13R2.3683 c1cc(=O)[nH]c2c1cc(cc2)N CM10291 [0,1,0,0,0,1|2,0,0]=4 119 B13R2.3683 c1cc(cc2c1cc(cc2)Cl)O CM10628 [0,1,0,0,0,1|2,0,0]=4 120 B13R2.3683 c1cc(cc2c1cc(cc2)F)N CM10501 [0,1,0,0,0,1|2,0,0]=4 121 B13R2.3683 c1cc(cc2c1cc(cc2)F)O CM10502 [0,1,0,0,0,1|2,0,0]=4 122 B13R2.3683 c1cc2c(cc1Br)COC(=O)N2 CM14341 [0,1,0,0,0,1|2,0,0]=4 123 B13R2.3683 c1cc2c(cc1Br)OCC(=O)N2 CM10088 [0,1,0,0,0,1|2,0,0]=4 124 B13R2.3683 c1cc2c(cc1F)OCC(=O)N2 CM10308 [0,1,0,0,0,1|2,0,0]=4 125 B13R2.3683 c1cc2c(cc1O)OCC(=O)N2 CM10298 [0,1,0,0,0,1|2,0,0]=4 126 B13R2.5179 c1cc2c(c(c1)O)OCC(=O)N2 CM10584 [0,1,0,0,0,1|2,0,0]=4 127 B13R2.5179 c1cc2c(ccc(n2)N)c(c1)Br CM10587 [0,1,0,0,0,1|2,0,0]=4 128 B13R2.5179 c1cc2cc(cnc2c(c1)Br)I CM10183 [0,1,0,0,0,1|2,0,0]=4 129 B13R2.135 Cc1c(n2ccccc2n1)C=O CM10613 [0,2,0,0,0,0|2,0,0]=4 130 B13R2.3028 Cc1c(n2cc(ccc2n1)Br)C CM10615 [0,2,0,0,0,0|2,0,0]=4 131 B13R2.3028 c1cc2c(cc1F)C(=O)C(=O)N2 CM13627 [0,2,0,0,0,0|2,0,0]=4 132 B13R2.4825 c1cc2c(c(c1)Br)NC(=O)C2=O CM14323 [0,2,0,0,0,0|2,0,0]=4 133 B13R2.4825 c1cc2c(c(c1)Cl)NC(=O)C2=O CM14312 [0,2,0,0,0,0|2,0,0]=4 134 B13R2.4856 c1cc2c(c(c1)Br)C(=O)C(=O)N2 CM14355 [0,2,0,0,0,0|2,0,0]=4 135 B13R2.5190 c1cc2c(cc1Br)NC(=O)C2=O CM14357 [0,2,0,0,0,0|2,0,0]=4 136 B13R2.43 c1cc2c(cc1Br)cc(s2)C#N CM10430 [0,2,0,0,0,0|0,1,1]=4 137 B13R2.43 c1cc2c(cc1Br)cc(s2)C=O CM10618 [0,2,0,0,0,0|0,1,1]=4 138 B13R2.2121 Cc1cc2cc(ccc2[nH]1)OC CM13615 [0,2,0,0,0,0|1,0,0]=3 139 B11R2.20 c1ccc2cnccc2c1 CM14380 [0,0,1,1,0,0|2,0,0]=4 140 B11R1.91 CC(=O)COc1ccccc1 CM11227 [0,0,1,0,0,1|1,0,0]=3