0 B12R2.1081 C1=C2=CC=NC(=O)C2=CN=C1 PB26746 [0,0,0,0,0,0|3,0,1]=4 1 B12R2.1081 C1=C2=CN=CC=C2C(=O)N=C1 AB29154 [0,0,0,0,0,0|3,0,1]=4 2 B12R2.1081 CC1c2ccccc2CCN1 AB07224 [0,0,0,0,0,0|1,0,3]=4 3 B12R2.1081 Cc1cccc2c1cncc2 MB06665 [0,0,0,0,0,0|1,0,0]=1 4 B12R2.1081 Cc1ccnc2c1cccn2 CB10327 [0,0,0,0,0,0|2,0,0]=2 5 B12R2.1081 c1cc(c2c(c1)nccn2)N AB09749 [0,0,0,0,0,0|3,0,0]=3 6 B12R2.1081 c1cc(c2cncnc2c1)N AB60734 [0,0,0,0,0,0|3,0,0]=3 7 B12R2.1081 c1cc2c(=O)[nH]cnc2nc1 PB19911 [0,0,0,0,0,0|4,0,0]=4 8 B12R2.1081 c1cc2c(c(=O)[nH]cn2)nc1 AB11918 [0,0,0,0,0,0|4,0,0]=4 9 B12R2.1081 c1cc2c(c(ccn2)Br)nc1 MB10238 [0,0,0,0,0,0|3,0,0]=3 10 B12R2.1081 c1cc2c(c(ncn2)Cl)nc1 PB22412 [0,0,0,0,0,0|4,0,0]=4 11 B12R2.1081 c1cc2c(cc[nH]c2=O)nc1 PB11849 [0,0,0,0,0,0|3,0,0]=3 12 B12R2.1081 c1cc2c(cccn2)c(c1)Br AB05240 [0,0,0,0,0,0|2,0,0]=2 13 B12R2.1081 c1cc2c(ccnc2Br)nc1 MB01013 [0,0,0,0,0,0|3,0,0]=3 14 B12R2.1081 c1cc2c(ccnc2Cl)nc1 PB32262 [0,0,0,0,0,0|3,0,0]=3 15 B12R2.1081 c1cc2c(ccnc2N)nc1 AB54489 [0,0,0,0,0,0|3,0,0]=3 16 B12R2.1081 c1cc2c(ccnc2nc1)Br AB64248 [0,0,0,0,0,0|3,0,0]=3 17 B12R2.1081 c1cc2c(ccnc2nc1)Cl MB05961 [0,0,0,0,0,0|3,0,0]=3 18 B12R2.1081 c1cc2c(ccnc2nc1)N AB22452 [0,0,0,0,0,0|3,0,0]=3 19 B12R2.1081 c1cc2c(cncn2)c(c1)Br PB25306 [0,0,0,0,0,0|3,0,0]=3 20 B12R2.1081 c1cc2c(cncn2)c(c1)O AB07778 [0,0,0,0,0,0|3,0,0]=3 21 B12R2.1081 c1cc2c(nc1)ncnc2Cl PB26181 [0,0,0,0,0,0|4,0,0]=4 22 B12R2.1081 c1cc2cc[nH]c(=O)c2nc1 AB64971 [0,0,0,0,0,0|3,0,0]=3 23 B12R2.1081 c1cc2cccnc2c(c1)Br AB04626 [0,0,0,0,0,0|2,0,0]=2 24 B12R2.1081 c1cc2ccnc(c2nc1)Br AB65459 [0,0,0,0,0,0|3,0,0]=3 25 B12R2.1081 c1cc2ccnc(c2nc1)Cl AB45031 [0,0,0,0,0,0|3,0,0]=3 26 B12R2.1081 c1cc2ccnc(c2nc1)N AB08899 [0,0,0,0,0,0|3,0,0]=3 27 B12R2.1081 c1cc2ccncc2c(c1)Br MB03403 [0,0,0,0,0,0|2,0,0]=2 28 B12R2.1081 c1cc2ccncc2c(c1)O AB06640 [0,0,0,0,0,0|2,0,0]=2 29 B12R2.1081 c1cc2cncc(c2nc1)Br PB12160 [0,0,0,0,0,0|3,0,0]=3 30 B12R2.1081 c1cc2cnccc2c(c1)Br AB09627 [0,0,0,0,0,0|2,0,0]=2 31 B12R2.1081 c1cc2cncnc2c(c1)N AB49290 [0,0,0,0,0,0|3,0,0]=3 32 B12R2.1081 c1cc2cncnc2c(c1)O AB07782 [0,0,0,0,0,0|3,0,0]=3 33 B12R2.1081 c1cc2cnncc2c(c1)Br MB09752 [0,0,0,0,0,0|3,0,0]=3 34 B12R2.1081 c1cc2cnncc2c(c1)N AB44290 [0,0,0,0,0,0|3,0,0]=3 35 B12R2.1081 c1ccc2c(c1)C(=O)CCN2 AB06711 [0,0,0,0,0,0|2,0,2]=4 36 B12R2.1081 c1ccc2c(c1)C(=O)CCO2 AB00814 [0,0,0,0,0,0|2,0,2]=4 37 B12R2.1081 c1ccc2c(c1)C(=O)CN=N2 MB06564 [0,0,0,0,0,0|3,0,1]=4 38 B12R2.1081 c1ccc2c(c1)CCNC2=O AB07451 [0,0,0,0,0,0|2,0,2]=4 39 B12R2.1081 c1ccc2c(c1)CCOC2=O MB01461 [0,0,0,0,0,0|2,0,2]=4 40 B12R2.1081 c1ccc2c(c1)CNCC2=O AB11544 [0,0,0,0,0,0|2,0,2]=4 41 B12R2.1081 c1ccc2c(c1)COCC2=O PB14717 [0,0,0,0,0,0|2,0,2]=4 42 B12R2.1081 c1ccc2c(c1)c(ccn2)Br AB42051 [0,0,0,0,0,0|2,0,0]=2 43 B12R2.1081 c1ccc2c(c1)c(ccn2)N AB06141 [0,0,0,0,0,0|2,0,0]=2 44 B12R2.1081 c1ccc2c(c1)c(ncn2)Cl AB04999 [0,0,0,0,0,0|3,0,0]=3 45 B12R2.1081 c1ccc2c(c1)c(ncn2)N AB03303 [0,0,0,0,0,0|3,0,0]=3 46 B12R2.1081 c1ccc2c(c1)ccnc2Cl AB01423 [0,0,0,0,0,0|2,0,0]=2 47 B12R2.1081 c1ccc2c(c1)ccnc2I AB05244 [0,0,0,0,0,0|2,0,0]=2 48 B12R2.1081 c1ccc2c(c1)cncc2Br AB00815 [0,0,0,0,0,0|2,0,0]=2 49 B12R2.1081 c1ccc2c(c1)cncc2O AB05248 [0,0,0,0,0,0|2,0,0]=2 50 B12R2.1081 c1ccc2c(c1)cnnc2Cl AB01425 [0,0,0,0,0,0|3,0,0]=3 51 B12R2.1081 c1ccc2c(c1)cnnc2O AB03574 [0,0,0,0,0,0|3,0,0]=3 52 B12R2.1081 c1cnc(c2c1cncc2)Br AB65462 [0,0,0,0,0,0|3,0,0]=3 53 B12R2.1081 c1cnc(c2c1cncc2)Cl AB09607 [0,0,0,0,0,0|3,0,0]=3 54 B12R2.1081 c1cnc(c2c1cncc2)N AB64136 [0,0,0,0,0,0|3,0,0]=3 55 B12R2.1081 c1cnc(c2c1nccn2)Cl AB48705 [0,0,0,0,0,0|4,0,0]=4 56 B12R2.1081 c1cnc(c2c1nccn2)N AB53421 [0,0,0,0,0,0|4,0,0]=4 57 B12R2.1081 c1cnc2ccncc2c1N AB09610 [0,0,0,0,0,0|3,0,0]=3 58 B12R2.1081 c1cncc2c1C(=O)CC=N2 PB16378 [0,0,0,0,0,0|3,0,1]=4 59 B12R2.1081 c1cncc2c1c(ccn2)Cl PB25673 [0,0,0,0,0,0|3,0,0]=3 60 B12R2.1081 c1cncc2c1c(cnc2)Br AB73848 [0,0,0,0,0,0|3,0,0]=3 61 B12R2.1081 c1cncc2c1c(ncn2)Cl PB19089 [0,0,0,0,0,0|4,0,0]=4 62 B12R2.1081 c1cncc2c1ccnc2Cl PB30637 [0,0,0,0,0,0|3,0,0]=3 63 B12R2.1081 c1cncc2c1nc[nH]c2=O PB21323 [0,0,0,0,0,0|4,0,0]=4 64 B12R2.1081 c1cncc2c1nccc2Cl PB28088 [0,0,0,0,0,0|3,0,0]=3 65 B12R2.1081 c1cncc2c1ncnc2Cl PB22331 [0,0,0,0,0,0|4,0,0]=4 66 B11R2.20 c1cc2c(cccn2)nc1 AB01787 [1,0,0,0,0,0|2,0,0]=3 67 B11R2.20 c1cc2cccnc2nc1 AB02373 [1,0,0,0,0,0|2,0,0]=3 68 B11R2.20 c1cc2cnccc2nc1 AB02371 [1,0,0,0,0,0|2,0,0]=3 69 B11R2.20 c1ccc2c(c1)CCN=C2 AB01545 [1,0,0,0,0,0|1,0,2]=4 70 B13R2.32 Cc1cnc2ccccc2c1Cl AB50477 [0,1,0,0,0,0|2,0,0]=3 71 B13R2.32 Cc1cnc2ccccc2c1O AB50475 [0,1,0,0,0,0|2,0,0]=3 72 B13R2.32 c1cc2ccc(c(c2nc1)F)F MB01680 [0,1,0,0,0,0|2,0,0]=3 73 B13R2.32 c1ccc2c(c1)ccc(c2Br)N MB00604 [0,1,0,0,0,0|1,0,0]=2 74 B13R2.32 c1ccc2c(c1)ccc(c2F)O MB69403 [0,1,0,0,0,0|1,0,0]=2 75 B13R2.32 c1ccc2c(c1)ccc(c2O)F MB04146 [0,1,0,0,0,0|1,0,0]=2 76 B13R2.32 c1ccc2c(c1)cnc(c2Br)N MB00823 [0,1,0,0,0,0|2,0,0]=3 77 B13R2.162 Cc1ccc2c(c1)c(ccn2)Cl AB12588 [0,1,0,0,0,0|2,0,0]=3 78 B13R2.162 Cc1ccc2c(c1)c(ccn2)N AB29077 [0,1,0,0,0,0|2,0,0]=3 79 B13R2.162 Cc1ccc2c(c1)c(ccn2)O AB05625 [0,1,0,0,0,0|2,0,0]=3 80 B13R2.162 Cc1ccc2c(c1)c(ncn2)Cl AB15706 [0,1,0,0,0,0|3,0,0]=4 81 B13R2.162 Cc1ccc2cc[nH]c(=O)c2c1 AB54694 [0,1,0,0,0,0|2,0,0]=3 82 B13R2.162 Cc1ccc2cc[nH]c(=O)c2n1 AB76636 [0,1,0,0,0,0|3,0,0]=4 83 B13R2.162 Cc1ccc2cccc(c2n1)Br AB20867 [0,1,0,0,0,0|2,0,0]=3 84 B13R2.162 Cc1ccc2ccnc(c2c1)Cl AB54695 [0,1,0,0,0,0|2,0,0]=3 85 B13R2.162 Cc1cccc2c1NC(=O)CC2 MB01240 [0,1,0,0,0,0|1,0,2]=4 86 B13R2.162 Cc1cccc2c1NC(=O)CO2 AB65924 [0,1,0,0,0,0|2,0,1]=4 87 B13R2.162 Cc1cccc2c1nc(cc2)C AB01019 [0,1,0,0,0,0|1,0,0]=2 88 B13R2.162 Cc1ccnc2c1cc(cc2)Br AB49783 [0,1,0,0,0,0|1,0,0]=2 89 B13R2.162 c1cc(cc2c1cc[nH]c2=O)Br AB10173 [0,1,0,0,0,0|2,0,0]=3 90 B13R2.162 c1cc(cc2c1cc[nH]c2=O)Cl AB42150 [0,1,0,0,0,0|2,0,0]=3 91 B13R2.162 c1cc(cc2c1ccnc2Br)Cl AB70047 [0,1,0,0,0,0|2,0,0]=3 92 B13R2.162 c1cc(cc2c1ccnc2Cl)Br AB17337 [0,1,0,0,0,0|2,0,0]=3 93 B13R2.162 c1cc(cc2c1ccnc2Cl)Cl AB64632 [0,1,0,0,0,0|2,0,0]=3 94 B13R2.162 c1cc(cc2c1ccnc2N)Br AB39362 [0,1,0,0,0,0|2,0,0]=3 95 B13R2.162 c1cc(cc2c1ccnc2N)Cl AB64630 [0,1,0,0,0,0|2,0,0]=3 96 B13R2.162 c1cc(nc2c1cc[nH]c2=O)Br AB85018 [0,1,0,0,0,0|3,0,0]=4 97 B13R2.162 c1cc(nc2c1ccnc2Cl)Br AB73782 [0,1,0,0,0,0|3,0,0]=4 98 B13R2.162 c1cc(nc2c1ccnc2Cl)Cl AB73789 [0,1,0,0,0,0|3,0,0]=4 99 B13R2.162 c1cc(nc2c1ccnc2O)Br AB73785 [0,1,0,0,0,0|3,0,0]=4 100 B13R2.162 c1cc(nc2c1ccnc2O)Cl AB73786 [0,1,0,0,0,0|3,0,0]=4 101 B13R2.162 c1cc(nc2c1nccc2Br)Br PB11778 [0,1,0,0,0,0|3,0,0]=4 102 B13R2.162 c1cc(nc2c1nccc2Cl)Cl PB27264 [0,1,0,0,0,0|3,0,0]=4 103 B13R2.162 c1cc2c(cc1Br)c(=O)[nH]cn2 AB21786 [0,1,0,0,0,0|3,0,0]=4 104 B13R2.162 c1cc2c(cc1Br)c(ccn2)Cl PB19880 [0,1,0,0,0,0|2,0,0]=3 105 B13R2.162 c1cc2c(cc1Br)c(ccn2)N AB14051 [0,1,0,0,0,0|2,0,0]=3 106 B13R2.162 c1cc2c(cc1Br)c(ccn2)O PB14171 [0,1,0,0,0,0|2,0,0]=3 107 B13R2.162 c1cc2c(cc1Br)c(ncn2)Cl PB32280 [0,1,0,0,0,0|3,0,0]=4 108 B13R2.162 c1cc2c(cc1Br)c(ncn2)N AB11598 [0,1,0,0,0,0|3,0,0]=4 109 B13R2.162 c1cc2c(cc1Cl)c(ccn2)Cl AB04150 [0,1,0,0,0,0|2,0,0]=3 110 B13R2.162 c1cc2c(cc1Cl)c(ccn2)N AB42116 [0,1,0,0,0,0|2,0,0]=3 111 B13R2.162 c1cc2c(cc1Cl)c(ccn2)O AB01413 [0,1,0,0,0,0|2,0,0]=3 112 B13R2.162 c1cc2c(cc1Cl)c(ncn2)Cl AB03250 [0,1,0,0,0,0|3,0,0]=4 113 B13R2.162 c1cc2c(cc1Cl)c(ncn2)N AB12133 [0,1,0,0,0,0|3,0,0]=4 114 B13R2.162 c1cc2c(cc1F)c(=O)[nH]cn2 CB11390 [0,1,0,0,0,0|3,0,0]=4 115 B13R2.162 c1cc2c(cc1F)c(ccn2)Cl AB05918 [0,1,0,0,0,0|2,0,0]=3 116 B13R2.162 c1cc2c(cc1F)c(ccn2)N AB22403 [0,1,0,0,0,0|2,0,0]=3 117 B13R2.162 c1cc2c(cc1F)c(ccn2)O AB05527 [0,1,0,0,0,0|2,0,0]=3 118 B13R2.162 c1cc2c(cc1F)c(ncn2)Cl AB42372 [0,1,0,0,0,0|3,0,0]=4 119 B13R2.162 c1cc2c(cc1F)c(ncn2)N CB11608 [0,1,0,0,0,0|3,0,0]=4 120 B13R2.162 c1cc2c(cc1I)C(=O)CC=N2 PB31146 [0,1,0,0,0,0|2,0,1]=4 121 B13R2.162 c1cc2c(cc1I)c(=O)[nH]cn2 PB18488 [0,1,0,0,0,0|3,0,0]=4 122 B13R2.162 c1cc2c(cc1I)c(ncn2)Cl PB19952 [0,1,0,0,0,0|3,0,0]=4 123 B13R2.162 c1cc2c(cc1O)c(=O)[nH]cn2 AB07313 [0,1,0,0,0,0|3,0,0]=4 124 B13R2.162 c1cc2c(cc1O)c(ncn2)Cl MB06082 [0,1,0,0,0,0|3,0,0]=4 125 B13R2.162 c1cc2ccc(=O)[nH]c2c(c1)Br MB06618 [0,1,0,0,0,0|2,0,0]=3 126 B13R2.162 c1cc2ccc(=O)[nH]c2c(c1)Cl MB10595 [0,1,0,0,0,0|2,0,0]=3 127 B13R2.162 c1cc2ccc(nc2c(c1)Br)Cl AB48778 [0,1,0,0,0,0|2,0,0]=3 128 B13R2.162 c1cc2ccc(nc2c(c1)Br)N MB05228 [0,1,0,0,0,0|2,0,0]=3 129 B13R2.162 c1cc2ccc(nc2c(c1)Cl)N AB44300 [0,1,0,0,0,0|2,0,0]=3 130 B13R2.162 c1cc2ccc(nc2c(c1)O)N AB04263 [0,1,0,0,0,0|2,0,0]=3 131 B13R2.162 c1cc2cnc(nc2c(c1)Br)Cl PB34557 [0,1,0,0,0,0|3,0,0]=4 132 B13R2.162 c1cc2cnnc(c2cc1Br)Cl AB69653 [0,1,0,0,0,0|3,0,0]=4 133 B13R2.162 c1cnc(c2c1ncc(c2)Br)Cl PB22921 [0,1,0,0,0,0|3,0,0]=4 134 B13R2.162 c1cnc(c2c1ncc(c2)N)Cl AB73820 [0,1,0,0,0,0|3,0,0]=4 135 B13R2.162 c1cnc(c2c1ncc(c2)N)O AB73821 [0,1,0,0,0,0|3,0,0]=4 136 B13R2.328 CC1=NC(=O)C2=C(=C1)C=CC=C2 MB02879 [0,1,0,0,0,0|2,0,1]=4 137 B13R2.328 CC1CC(=O)Nc2c1cccc2 MB08925 [0,1,0,0,0,0|1,0,2]=4 138 B13R2.328 CN1CC(=O)Nc2c1cccc2 MB12301 [0,1,0,0,0,0|2,0,1]=4 139 B13R2.328 Cc1cc(c2ccccc2n1)N AB00806 [0,1,0,0,0,0|2,0,0]=3 140 B13R2.328 Cc1cc(cc2c1nccn2)Br MB15073 [0,1,0,0,0,0|2,0,0]=3 141 B13R2.328 Cc1cc(nc2c1cccc2)N AB21178 [0,1,0,0,0,0|1,0,0]=2 142 B13R2.328 Cc1cc(nc2c1cccc2)N AB42119 [0,1,0,0,0,0|1,0,0]=2 143 B13R2.328 Cc1nc2ccccc2c(n1)N AB05254 [0,1,0,0,0,0|3,0,0]=4 144 B13R2.328 c1cc2c(cc(nc2Cl)Cl)nc1 PB34610 [0,1,0,0,0,0|3,0,0]=4 145 B13R2.328 c1ccc2=NC(=O)CC(=c2c1)Cl MB03587 [0,1,0,0,0,0|2,0,1]=4 146 B13R2.328 c1ccc2=NC(=O)CC(=c2c1)N MB03581 [0,1,0,0,0,0|2,0,1]=4 147 B13R2.328 c1ccc2c(c1)CC(=O)NC2=O AB05280 [0,1,0,0,0,0|2,0,1]=4 148 B13R2.328 c1ccc2c(c1)c(=O)[nH]c(n2)N AB10668 [0,1,0,0,0,0|3,0,0]=4 149 B13R2.328 c1ccc2c(c1)c(cc(=O)o2)N MB00371 [0,1,0,0,0,0|2,0,0]=3 150 B13R2.328 c1ccc2c(c1)c(cc(n2)Br)N MB06581 [0,1,0,0,0,0|2,0,0]=3 151 B13R2.328 c1ccc2c(c1)c(cc(n2)Cl)Br AB62586 [0,1,0,0,0,0|2,0,0]=3 152 B13R2.328 c1ccc2c(c1)c(cc(n2)Cl)Cl AB01396 [0,1,0,0,0,0|2,0,0]=3 153 B13R2.328 c1ccc2c(c1)c(cc(n2)Cl)N MB06583 [0,1,0,0,0,0|2,0,0]=3 154 B13R2.328 c1ccc2c(c1)c(cc(n2)N)Br MB01043 [0,1,0,0,0,0|2,0,0]=3 155 B13R2.328 c1ccc2c(c1)c(nc(n2)Br)Br MB08185 [0,1,0,0,0,0|3,0,0]=4 156 B13R2.328 c1ccc2c(c1)c(nc(n2)Cl)Cl AB03291 [0,1,0,0,0,0|3,0,0]=4 157 B13R2.328 c1ccc2c(c1)c(nc(n2)Cl)N AB43584 [0,1,0,0,0,0|3,0,0]=4 158 B13R2.328 c1ccc2c(c1)c(nc(n2)N)Cl AB60762 [0,1,0,0,0,0|3,0,0]=4 159 B13R2.328 c1ccc2c(c1)cc(nc2Br)N CB10230 [0,1,0,0,0,0|2,0,0]=3 160 B13R2.328 c1ccc2c(c1)cc(nc2Cl)Cl PB17073 [0,1,0,0,0,0|2,0,0]=3 161 B13R2.342 Cc1cccc2c1CCCC2=O MB05378 [0,1,0,0,0,0|0,0,3]=4 162 B13R2.342 Cc1cccc2c1ccnc2Cl MB09763 [0,1,0,0,0,0|1,0,0]=2 163 B13R2.342 Cc1cccc2c1ccnc2O AB70070 [0,1,0,0,0,0|1,0,0]=2 164 B13R2.342 Cc1cccc2c1nccc2Cl AB05597 [0,1,0,0,0,0|1,0,0]=2 165 B13R2.342 Cc1cccc2c1nccc2N AB42078 [0,1,0,0,0,0|1,0,0]=2 166 B13R2.342 Cc1cccc2c1nccc2O AB05626 [0,1,0,0,0,0|1,0,0]=2 167 B13R2.342 Cc1ccnc2c1cccc2Br CB11612 [0,1,0,0,0,0|1,0,0]=2 168 B13R2.342 c1cc2c(c(c1)Br)nc[nH]c2=O MB08801 [0,1,0,0,0,0|3,0,0]=4 169 B13R2.342 c1cc2c(c(c1)Cl)nc[nH]c2=O MB08808 [0,1,0,0,0,0|3,0,0]=4 170 B13R2.342 c1cc2c(cc[nH]c2=O)c(c1)Br AB64049 [0,1,0,0,0,0|2,0,0]=3 171 B13R2.342 c1cc2c(cc[nH]c2=O)c(c1)Cl AB64608 [0,1,0,0,0,0|2,0,0]=3 172 B13R2.342 c1cc2c(cc[nH]c2=O)c(c1)N PB32405 [0,1,0,0,0,0|2,0,0]=3 173 B13R2.342 c1cc2c(cc[nH]c2=O)c(c1)O MB01281 [0,1,0,0,0,0|2,0,0]=3 174 B13R2.342 c1cc2c(cccc2I)c(c1)O MB05554 [0,1,0,0,0,0|1,0,0]=2 175 B13R2.342 c1cc2c(ccnc2Cl)c(c1)Br AB48461 [0,1,0,0,0,0|2,0,0]=3 176 B13R2.342 c1cc2c(ccnc2Cl)c(c1)Cl AB64606 [0,1,0,0,0,0|2,0,0]=3 177 B13R2.342 c1cc2c(ccnc2N)c(c1)Br AB64053 [0,1,0,0,0,0|2,0,0]=3 178 B13R2.342 c1cc2c(ccnc2N)c(c1)Cl AB70043 [0,1,0,0,0,0|2,0,0]=3 179 B13R2.342 c1cc2c(ccnc2c(c1)Br)Cl AB10174 [0,1,0,0,0,0|2,0,0]=3 180 B13R2.342 c1cc2c(ccnc2c(c1)Br)N AB16996 [0,1,0,0,0,0|2,0,0]=3 181 B13R2.342 c1cc2c(ccnc2c(c1)Br)O AB05650 [0,1,0,0,0,0|2,0,0]=3 182 B13R2.342 c1cc2c(ccnc2c(c1)Cl)Br AB42130 [0,1,0,0,0,0|2,0,0]=3 183 B13R2.342 c1cc2c(ccnc2c(c1)Cl)N AB16995 [0,1,0,0,0,0|2,0,0]=3 184 B13R2.342 c1cc2c(ccnc2c(c1)Cl)O AB05649 [0,1,0,0,0,0|2,0,0]=3 185 B13R2.342 c1cc2c(ccnc2c(c1)F)Br AB42123 [0,1,0,0,0,0|2,0,0]=3 186 B13R2.342 c1cc2c(ccnc2c(c1)F)Cl AB05919 [0,1,0,0,0,0|2,0,0]=3 187 B13R2.342 c1cc2c(ccnc2c(c1)F)N AB16991 [0,1,0,0,0,0|2,0,0]=3 188 B13R2.342 c1cnc(c2c1c(ccn2)Br)Cl AB73792 [0,1,0,0,0,0|3,0,0]=4 189 B13R2.342 c1cnc(c2c1c(ccn2)Cl)Cl PB19645 [0,1,0,0,0,0|3,0,0]=4 190 B13R2.342 c1cnc(c2c1c(ccn2)N)Cl AB73793 [0,1,0,0,0,0|3,0,0]=4 191 B13R2.342 c1cnc(c2c1c(cnc2)Br)Cl AB73845 [0,1,0,0,0,0|3,0,0]=4 192 B13R2.342 c1cnc(c2c1c(ncc2)Br)Cl AB73851 [0,1,0,0,0,0|3,0,0]=4 193 B13R2.342 c1cnc(c2c1c(ncc2)Cl)Cl AB54479 [0,1,0,0,0,0|3,0,0]=4 194 B13R2.371 CC1CNC(=O)c2c1cccc2 AB19151 [0,1,0,0,0,0|1,0,2]=4 195 B13R2.371 Cc1c2ccccc2c(=O)[nH]n1 MB00345 [0,1,0,0,0,0|2,0,0]=3 196 B13R2.371 c1c2c(cnn1)C(=O)C=CC2=O MB08782 [0,1,0,0,0,0|3,0,0]=4 197 B13R2.371 c1cc(c2ccncc2c1N)Br AB50046 [0,1,0,0,0,0|2,0,0]=3 198 B13R2.371 c1cc2c(ccc(c2nc1)Br)Br AB20865 [0,1,0,0,0,0|2,0,0]=3 199 B13R2.371 c1cc2c(ccc(c2nc1)N)Cl MB01218 [0,1,0,0,0,0|2,0,0]=3 200 B13R2.371 c1cc2c(cnc(c2nc1)Cl)Br PB20279 [0,1,0,0,0,0|3,0,0]=4 201 B13R2.371 c1cc2c(cnc(c2nc1)O)Br PB16196 [0,1,0,0,0,0|3,0,0]=4 202 B13R2.371 c1ccc2c(c1)c(cnc2Br)Br MB01038 [0,1,0,0,0,0|2,0,0]=3 203 B13R2.371 c1ccc2c(c1)c(cnc2Cl)Br MB01037 [0,1,0,0,0,0|2,0,0]=3 204 B13R2.371 c1ccc2c(c1)c(cnc2N)Br MB03465 [0,1,0,0,0,0|2,0,0]=3 205 B13R2.371 c1cncc2c1c(c[nH]c2=O)Br PB19545 [0,1,0,0,0,0|3,0,0]=4 206 B13R2.371 c1cncc2c1c(c[nH]c2=O)I PB15255 [0,1,0,0,0,0|3,0,0]=4 207 B13R2.371 c1cncc2c1c(cnc2Cl)I PB30185 [0,1,0,0,0,0|3,0,0]=4 208 B13R2.1613 C#Cc1cccc2c1cccn2 AB42083 [0,1,0,0,0,0|1,0,1]=3 209 B13R2.1613 C#Cc1ccnc2c1cccc2 AB48498 [0,1,0,0,0,0|1,0,1]=3 210 B13R2.1613 COC1=NCCc2c1cccc2 AB52999 [0,1,0,0,0,0|1,0,2]=4 211 B13R2.1613 COc1cccc2c1cncc2 AB49764 [0,1,0,0,0,0|1,0,0]=2 212 B13R2.1613 c1cc(c2c(c1)nccn2)C=O AB07315 [0,1,0,0,0,0|2,0,1]=4 213 B13R2.1613 c1cc(c2cccnc2c1)C=O AB07320 [0,1,0,0,0,0|1,0,1]=3 214 B13R2.1613 c1cc(c2cccnc2c1)CN AB28304 [0,1,0,0,0,0|1,0,0]=2 215 B13R2.1613 c1cc2c(ccnc2nc1)C=O CB10875 [0,1,0,0,0,0|2,0,1]=4 216 B13R2.1613 c1cc2c(ccnc2nc1)CN AB68438 [0,1,0,0,0,0|2,0,0]=3 217 B13R2.1613 c1cc2cccnc2c(c1)NN AB07874 [0,1,0,0,0,0|2,0,0]=3 218 B13R2.1613 c1cc2ccncc2c(c1)C=O AB23484 [0,1,0,0,0,0|1,0,1]=3 219 B13R2.1613 c1cc2ccncc2c(c1)CN AB28224 [0,1,0,0,0,0|1,0,0]=2 220 B13R2.1613 c1cc2ccncc2c(c1)CO MB10361 [0,1,0,0,0,0|1,0,0]=2 221 B13R2.1613 c1cc2cncc(c2nc1)C=O AB28388 [0,1,0,0,0,0|2,0,1]=4 222 B13R2.1613 c1cc2cnccc2c(c1)C#N AB13764 [0,1,0,0,0,0|1,0,1]=3 223 B13R2.1613 c1cc2cnccc2c(c1)C=O AB14397 [0,1,0,0,0,0|1,0,1]=3 224 B13R2.1613 c1cc2cnccc2c(c1)CN AB56494 [0,1,0,0,0,0|1,0,0]=2 225 B13R2.1613 c1ccc2c(c1)c(ccn2)CCl AB60119 [0,1,0,0,0,0|1,0,0]=2 226 B13R2.1613 c1ccc2c(c1)c(ccn2)CN AB11064 [0,1,0,0,0,0|1,0,0]=2 227 B13R2.1613 c1ccc2c(c1)c(ccn2)CO MB01636 [0,1,0,0,0,0|1,0,0]=2 228 B13R2.1613 c1ccc2c(c1)c(ccn2)NN AB05747 [0,1,0,0,0,0|2,0,0]=3 229 B13R2.1613 c1ccc2c(c1)c(ncn2)C#N AB60723 [0,1,0,0,0,0|2,0,1]=4 230 B13R2.1613 c1ccc2c(c1)c(ncn2)C=O AB59129 [0,1,0,0,0,0|2,0,1]=4 231 B13R2.1613 c1ccc2c(c1)c(ncn2)CN AB49444 [0,1,0,0,0,0|2,0,0]=3 232 B13R2.1613 c1ccc2c(c1)ccnc2C#N AB03726 [0,1,0,0,0,0|1,0,1]=3 233 B13R2.1613 c1ccc2c(c1)ccnc2C=O AB28067 [0,1,0,0,0,0|1,0,1]=3 234 B13R2.1613 c1ccc2c(c1)ccnc2CCl AB51017 [0,1,0,0,0,0|1,0,0]=2 235 B13R2.1613 c1ccc2c(c1)ccnc2CN AB23405 [0,1,0,0,0,0|1,0,0]=2 236 B13R2.1613 c1ccc2c(c1)ccnc2NN AB52996 [0,1,0,0,0,0|2,0,0]=3 237 B13R2.1613 c1ccc2c(c1)cncc2C#N AB07795 [0,1,0,0,0,0|1,0,1]=3 238 B13R2.1613 c1ccc2c(c1)cncc2C=O MB01497 [0,1,0,0,0,0|1,0,1]=3 239 B13R2.1613 c1ccc2c(c1)cncc2CN AB28215 [0,1,0,0,0,0|1,0,0]=2 240 B13R2.1613 c1cncc2c1c(cnc2)C=O CB11847 [0,1,0,0,0,0|2,0,1]=4 241 B13R2.4818 Cc1cccc2c1C(=O)CCN2 AB60322 [0,1,0,0,0,0|1,0,2]=4 242 B13R2.4818 Cc1cccc2c1c(=O)[nH]cn2 MB06116 [0,1,0,0,0,0|2,0,0]=3 243 B13R2.4818 Cc1cccc2c1c(ncc2)Cl MB13685 [0,1,0,0,0,0|1,0,0]=2 244 B13R2.4818 c1cc2c(c(c1)F)c(ccn2)Cl CB11066 [0,1,0,0,0,0|2,0,0]=3 245 B13R2.5179 Cc1cc2cc[nH]c(=O)c2cn1 AB64229 [0,1,0,0,0,0|3,0,0]=4 246 B13R2.5179 Cc1ccc2c(c1)ccnc2Cl AB63566 [0,1,0,0,0,0|2,0,0]=3 247 B13R2.5179 Cc1ccc2c(c1)ccnc2N AB63570 [0,1,0,0,0,0|2,0,0]=3 248 B13R2.5179 Cc1ccc2c(c1)ccnc2O AB70069 [0,1,0,0,0,0|2,0,0]=3 249 B13R2.5179 Cc1ccc2c(c1)nc[nH]c2=O MB08805 [0,1,0,0,0,0|3,0,0]=4 250 B13R2.5179 Cc1ccc2c(c1)ncnc2Cl AB59114 [0,1,0,0,0,0|3,0,0]=4 251 B13R2.5179 Cc1ccc2c(ccnc2c1)Cl AB51456 [0,1,0,0,0,0|2,0,0]=3 252 B13R2.5179 Cc1ccc2c(n1)cc[nH]c2=O AB85004 [0,1,0,0,0,0|3,0,0]=4 253 B13R2.5179 Cc1ccc2c(n1)cccc2Br AB68514 [0,1,0,0,0,0|2,0,0]=3 254 B13R2.5179 Cc1cccc2c1OCC(=O)N2 AB53068 [0,1,0,0,0,0|2,0,1]=4 255 B13R2.5179 c1cc(nc2c1c(=O)[nH]cc2)Br AB85000 [0,1,0,0,0,0|3,0,0]=4 256 B13R2.5179 c1cc(nc2c1c(=O)[nH]cc2)Cl AB85003 [0,1,0,0,0,0|3,0,0]=4 257 B13R2.5179 c1cc(nc2c1c(ncc2)Br)Cl AB85043 [0,1,0,0,0,0|3,0,0]=4 258 B13R2.5179 c1cc(nc2c1c(ncc2)Cl)Br AB73801 [0,1,0,0,0,0|3,0,0]=4 259 B13R2.5179 c1cc(nc2c1c(ncc2)Cl)Cl AB54491 [0,1,0,0,0,0|3,0,0]=4 260 B13R2.5179 c1cc(nc2c1c(ncc2)O)Br AB73798 [0,1,0,0,0,0|3,0,0]=4 261 B13R2.5179 c1cc(nc2c1c(ncc2)O)Cl AB73796 [0,1,0,0,0,0|3,0,0]=4 262 B13R2.5179 c1cc2c(c(c1)Br)ncc(n2)N MB10611 [0,1,0,0,0,0|3,0,0]=4 263 B13R2.5179 c1cc2c(cc1Br)cn[nH]c2=O PB34379 [0,1,0,0,0,0|3,0,0]=4 264 B13R2.5179 c1cc2c(cc1Br)cnnc2Cl PB14700 [0,1,0,0,0,0|3,0,0]=4 265 B13R2.5179 c1cc2c(cc1Br)nc[nH]c2=O PB29464 [0,1,0,0,0,0|3,0,0]=4 266 B13R2.5179 c1cc2c(cc1Br)ncnc2Cl PB17355 [0,1,0,0,0,0|3,0,0]=4 267 B13R2.5179 c1cc2c(cc1Cl)cn[nH]c2=O PB30105 [0,1,0,0,0,0|3,0,0]=4 268 B13R2.5179 c1cc2c(cc1Cl)cnnc2Cl PB19262 [0,1,0,0,0,0|3,0,0]=4 269 B13R2.5179 c1cc2c(cc1Cl)ncnc2Cl AB01392 [0,1,0,0,0,0|3,0,0]=4 270 B13R2.5179 c1cc2c(cc1F)nc[nH]c2=O PB18807 [0,1,0,0,0,0|3,0,0]=4 271 B13R2.5179 c1cc2c(cc1F)ncnc2Cl AB43869 [0,1,0,0,0,0|3,0,0]=4 272 B13R2.5179 c1cc2c(cc1F)ncnc2N CB11202 [0,1,0,0,0,0|3,0,0]=4 273 B13R2.5179 c1cc2c(cc[nH]c2=O)cc1Br AB39354 [0,1,0,0,0,0|2,0,0]=3 274 B13R2.5179 c1cc2c(cc[nH]c2=O)cc1Cl AB42154 [0,1,0,0,0,0|2,0,0]=3 275 B13R2.5179 c1cc2c(cc[nH]c2=O)cc1F AB55620 [0,1,0,0,0,0|2,0,0]=3 276 B13R2.5179 c1cc2c(cc[nH]c2=O)cc1N PB11021 [0,1,0,0,0,0|2,0,0]=3 277 B13R2.5179 c1cc2c(ccc(=O)[nH]2)c(c1)Br MB09288 [0,1,0,0,0,0|2,0,0]=3 278 B13R2.5179 c1cc2c(ccc(=O)[nH]2)c(c1)O MB02360 [0,1,0,0,0,0|2,0,0]=3 279 B13R2.5179 c1cc2c(ccc(n2)Cl)c(c1)Br AB45170 [0,1,0,0,0,0|2,0,0]=3 280 B13R2.5179 c1cc2c(ccc(n2)N)c(c1)Br MB09289 [0,1,0,0,0,0|2,0,0]=3 281 B13R2.5179 c1cc2c(ccnc2Br)cc1Cl AB70045 [0,1,0,0,0,0|2,0,0]=3 282 B13R2.5179 c1cc2c(ccnc2Br)cc1F AB70062 [0,1,0,0,0,0|2,0,0]=3 283 B13R2.5179 c1cc2c(ccnc2Cl)cc1Br AB27582 [0,1,0,0,0,0|2,0,0]=3 284 B13R2.5179 c1cc2c(ccnc2Cl)cc1Cl AB27580 [0,1,0,0,0,0|2,0,0]=3 285 B13R2.5179 c1cc2c(ccnc2Cl)cc1F AB55623 [0,1,0,0,0,0|2,0,0]=3 286 B13R2.5179 c1cc2c(ccnc2N)cc1Br AB39358 [0,1,0,0,0,0|2,0,0]=3 287 B13R2.5179 c1cc2c(ccnc2N)cc1Cl AB39360 [0,1,0,0,0,0|2,0,0]=3 288 B13R2.5179 c1cc2c(ccnc2N)cc1F AB69427 [0,1,0,0,0,0|2,0,0]=3 289 B13R2.5179 c1cc2c(ccnc2O)cc1Cl AB64993 [0,1,0,0,0,0|2,0,0]=3 290 B13R2.5179 c1cc2c(ccnc2cc1Br)Cl AB12594 [0,1,0,0,0,0|2,0,0]=3 291 B13R2.5179 c1cc2c(ccnc2cc1Br)N AB25141 [0,1,0,0,0,0|2,0,0]=3 292 B13R2.5179 c1cc2c(ccnc2cc1Br)O AB25905 [0,1,0,0,0,0|2,0,0]=3 293 B13R2.5179 c1cc2c(ccnc2cc1Cl)Br AB42126 [0,1,0,0,0,0|2,0,0]=3 294 B13R2.5179 c1cc2c(ccnc2cc1Cl)N AB07356 [0,1,0,0,0,0|2,0,0]=3 295 B13R2.5179 c1cc2c(ccnc2cc1F)Cl AB04073 [0,1,0,0,0,0|2,0,0]=3 296 B13R2.5179 c1cc2c(ccnc2cc1F)N AB43465 [0,1,0,0,0,0|2,0,0]=3 297 B13R2.5179 c1cc2c(ccnc2cc1F)O AB05529 [0,1,0,0,0,0|2,0,0]=3 298 B13R2.5179 c1cc2c(cnc(n2)Cl)c(c1)Br PB32901 [0,1,0,0,0,0|3,0,0]=4 299 B13R2.5179 c1cc2cc(cnc2c(c1)Br)I MB07196 [0,1,0,0,0,0|2,0,0]=3 300 B13R2.5179 c1cnc(c2c1cc(cn2)Br)Cl AB73781 [0,1,0,0,0,0|3,0,0]=4 301 B13R2.5179 c1cnc(c2c1cc(cn2)Cl)Cl AB73790 [0,1,0,0,0,0|3,0,0]=4 302 B13R2.5179 c1cnc(c2c1cc(cn2)F)Cl AB76841 [0,1,0,0,0,0|3,0,0]=4 303 B13R2.5179 c1cnc(c2c1cc(nc2)Br)Cl AB73836 [0,1,0,0,0,0|3,0,0]=4 304 B13R2.5179 c1cnc2cc(cnc2c1Br)Br PB19818 [0,1,0,0,0,0|3,0,0]=4 305 B13R2.5179 c1cnc2cc(cnc2c1Cl)Br PB26720 [0,1,0,0,0,0|3,0,0]=4 306 B13R2.5179 c1cnc2cc(cnc2c1Cl)Cl PB28975 [0,1,0,0,0,0|3,0,0]=4 307 B11R1.13 C=CCc1cccc(c1O)N MB13698 [0,0,1,0,0,0|2,0,1]=4 308 B11R1.17 Cc1ccccc1CCC=O AB42260 [0,0,1,0,0,0|1,0,2]=4 309 B11R1.24 Cc1cccc(c1)CCC=O AB42263 [0,0,1,0,0,0|1,0,2]=4 310 B11R1.41 COc1ccccc1CC=O AB02842 [0,0,1,0,0,0|2,0,1]=4 311 B11R1.53 B(c1ccccc1C=C)(O)O AB08106 [0,0,1,0,0,0|3,0,0]=4 312 B11R1.222 C\C(=N/N)\c1ccccc1O AB84931 [0,0,1,0,0,0|3,0,0]=4 313 B11R1.222 c1ccc(c(c1)C(=O)C=O)Cl AB55316 [0,0,1,0,0,0|3,0,0]=4 314 B11R1.222 c1ccc(c(c1)C(=O)C=O)F AB49795 [0,0,1,0,0,0|3,0,0]=4 315 B11R1.265 Cc1cccc(c1C=O)OC MB05932 [0,0,1,0,0,0|2,0,1]=4 316 B11R1.265 c1cc(c(c(c1)O)C=O)C=O MB35004 [0,0,1,0,0,0|3,0,0]=4 317 B11R2.1 C1=CC2C(=NC=C2Br)C=C1 PB10416 [0,0,0,0,1,0|2,0,1]=4 318 B11R2.1 C1=CC2C(=NC=C2O)C=C1 AB12538 [0,0,0,0,1,0|2,0,1]=4 319 B11R2.1 CC1=NN=C2=C1C=CC=C2 PB32213 [0,0,0,0,1,0|2,0,1]=4 320 B11R2.1 CC1=c2cccnc2=NC1 PB29501 [0,0,0,0,1,0|2,0,1]=4 321 B11R2.1 CN1CCc2c1cccc2 MB02030 [0,0,0,0,1,0|1,0,2]=4 322 B11R2.1 Cn1c2ccccc2cn1 PB18505 [0,0,0,0,1,0|2,0,0]=3 323 B11R2.1 Cn1ccc2c1nccc2 AB51139 [0,0,0,0,1,0|2,0,0]=3 324 B11R2.1 c1cc2c(c(cs2)Br)nc1 PB28335 [0,0,0,0,1,0|3,0,0]=4 325 B11R2.1 c1ccc2c(c1)C(=O)CO2 AB02144 [0,0,0,0,1,0|2,0,1]=4 326 B11R2.1 c1ccc2c(c1)C(=O)N=N2 MB00163 [0,0,0,0,1,0|3,0,0]=4 327 B11R2.1 c1ccc2c(c1)CNC2=O AB13096 [0,0,0,0,1,0|2,0,1]=4 328 B11R2.1 c1ccc2c(c1)c(co2)Br MB01644 [0,0,0,0,1,0|2,0,0]=3 329 B11R2.1 c1ccc2c(c1)c(no2)Cl MB02698 [0,0,0,0,1,0|3,0,0]=4 330 B11R2.1 c1ccc2c(c1)cnn2N MB08196 [0,0,0,0,1,0|3,0,0]=4 331 B11R2.1 c1ccn2c(c1)c(cn2)Br AB26764 [0,0,0,0,1,0|3,0,0]=4 332 B11R2.1 c1ccn2c(c1)c(cn2)N AB28918 [0,0,0,0,1,0|3,0,0]=4 333 B11R2.1 c1ccn2c(c1)ncc2Br PB14077 [0,0,0,0,1,0|3,0,0]=4 334 B11R2.1 c1ccn2c(c1)ncc2I AB28899 [0,0,0,0,1,0|3,0,0]=4 335 B11R2.1 c1ccn2c(c1)ncc2N AB26722 [0,0,0,0,1,0|3,0,0]=4 336 B11R2.106 C1C=CC(=C2C1=NC=C2)Br PB10160 [0,0,0,0,1,0|2,0,1]=4 337 B11R2.106 C1C=CC(=C2C1=NC=C2)Cl AB00468 [0,0,0,0,1,0|2,0,1]=4 338 B11R2.106 C1C=CC(=C2C1=NC=C2)F PB20892 [0,0,0,0,1,0|2,0,1]=4 339 B11R2.106 C1C=CC(=C2C1=NC=C2)O AB00472 [0,0,0,0,1,0|2,0,1]=4 340 B11R2.106 CC1=C2C(=CC=N2)C=CC1 AB00504 [0,0,0,0,1,0|1,0,1]=3 341 B11R2.106 CC1=C2C(=CC=N2)N=CC1 PB26696 [0,0,0,0,1,0|2,0,1]=4 342 B11R2.106 CC1=C2C(=CN=N2)C=CC1 MB03490 [0,0,0,0,1,0|2,0,1]=4 343 B11R2.106 CC1=C2C=CN=C2C=CC1 AB00476 [0,0,0,0,1,0|1,0,1]=3 344 B11R2.106 CC1=C2C=CN=C2N=CC1 PB19900 [0,0,0,0,1,0|2,0,1]=4 345 B11R2.106 CC1=C2C=NN=C2C=CC1 MB03676 [0,0,0,0,1,0|2,0,1]=4 346 B11R2.106 Cc1c2cccn2ccn1 AB52834 [0,0,0,0,1,0|2,0,0]=3 347 B11R2.106 Cc1cccc2c1CCN2 MB06155 [0,0,0,0,1,0|1,0,2]=4 348 B11R2.106 Cc1cccc2c1CNC2 MB06843 [0,0,0,0,1,0|1,0,2]=4 349 B11R2.106 Cc1cccc2c1NCC2 MB04566 [0,0,0,0,1,0|1,0,2]=4 350 B11R2.106 Cc1cccc2c1occ2 MB00742 [0,0,0,0,1,0|1,0,0]=2 351 B11R2.106 c1cc(c2ccoc2c1)N MB06879 [0,0,0,0,1,0|2,0,0]=3 352 B11R2.106 c1cc(c2ccoc2c1)O MB07641 [0,0,0,0,1,0|2,0,0]=3 353 B11R2.106 c1cc(c2nccn2c1)Br PB14615 [0,0,0,0,1,0|3,0,0]=4 354 B11R2.106 c1cc(c2nccn2c1)Br PB38167 [0,0,0,0,1,0|3,0,0]=4 355 B11R2.106 c1cc(c2nccn2c1)N PB32476 [0,0,0,0,1,0|3,0,0]=4 356 B11R2.106 c1cc(n2ccnc2c1)N PB21879 [0,0,0,0,1,0|3,0,0]=4 357 B11R2.106 c1cc2c(=O)[nH]ccn2c1 PB13162 [0,0,0,0,1,0|3,0,0]=4 358 B11R2.106 c1cc2c(c(c1)Br)ocn2 MB05566 [0,0,0,0,1,0|3,0,0]=4 359 B11R2.106 c1cc2c(c(c1)Br)scn2 PB17880 [0,0,0,0,1,0|3,0,0]=4 360 B11R2.106 c1cc2c(c(c1)Cl)ncs2 MB09046 [0,0,0,0,1,0|3,0,0]=4 361 B11R2.106 c1cc2c(c(c1)Cl)ocn2 MB20023 [0,0,0,0,1,0|3,0,0]=4 362 B11R2.106 c1cc2c(ccnn2c1)N PB18284 [0,0,0,0,1,0|3,0,0]=4 363 B11R2.106 c1cc2c(cco2)[n+](c1)[O-] CB11844 [0,0,0,0,1,0|3,0,0]=4 364 B11R2.106 c1cc2c(cco2)c(c1)Br PB17600 [0,0,0,0,1,0|2,0,0]=3 365 B11R2.106 c1cc2c(cco2)c(c1)F MB08828 [0,0,0,0,1,0|2,0,0]=3 366 B11R2.106 c1cc2c(ccs2)c(c1)Br PB20282 [0,0,0,0,1,0|2,0,0]=3 367 B11R2.106 c1cc2c(nccn2c1)Cl PB10727 [0,0,0,0,1,0|3,0,0]=4 368 B11R2.106 c1cc2ccnc(n2c1)Cl AB53391 [0,0,0,0,1,0|3,0,0]=4 369 B11R2.106 c1cc2ccnn2c(c1)Br AB28896 [0,0,0,0,1,0|3,0,0]=4 370 B11R2.106 c1cc2ccnn2c(c1)I AB48943 [0,0,0,0,1,0|3,0,0]=4 371 B11R2.106 c1cc2ccoc2c(c1)Br MB06925 [0,0,0,0,1,0|2,0,0]=3 372 B11R2.106 c1cc2ccoc2c(c1)N MB10414 [0,0,0,0,1,0|2,0,0]=3 373 B11R2.106 c1cc2ccsc2c(c1)Br AB25661 [0,0,0,0,1,0|2,0,0]=3 374 B11R2.106 c1cc2cncn2c(c1)Br AB28894 [0,0,0,0,1,0|3,0,0]=4 375 B11R2.106 c1cc2cncn2c(c1)I AB68521 [0,0,0,0,1,0|3,0,0]=4 376 B11R2.106 c1cc2nccn2c(c1)Br PB32607 [0,0,0,0,1,0|3,0,0]=4 377 B11R2.106 c1cc2nccn2c(c1)Cl AB61232 [0,0,0,0,1,0|3,0,0]=4 378 B11R2.106 c1cnc(c2c1cco2)Cl PB14748 [0,0,0,0,1,0|3,0,0]=4 379 B11R2.106 c1cnc(c2c1cco2)N AB52921 [0,0,0,0,1,0|3,0,0]=4 380 B11R2.106 c1cnc(c2c1ccs2)Cl PB10318 [0,0,0,0,1,0|3,0,0]=4 381 B11R2.106 c1cnc(c2c1ccs2)N PB25207 [0,0,0,0,1,0|3,0,0]=4 382 B11R2.106 c1cnc(c2c1occ2)N AB52908 [0,0,0,0,1,0|3,0,0]=4 383 B11R2.106 c1cnc(c2c1scc2)Cl PB27550 [0,0,0,0,1,0|3,0,0]=4 384 B11R2.106 c1cnc2c(c1Cl)cco2 PB22970 [0,0,0,0,1,0|3,0,0]=4 385 B11R2.106 c1cnc2ccoc2c1Cl PB22739 [0,0,0,0,1,0|3,0,0]=4 386 B11R2.106 c1cnc2ccsc2c1Cl PB17528 [0,0,0,0,1,0|3,0,0]=4 387 B11R2.106 c1cnc2ccsc2c1N MB06918 [0,0,0,0,1,0|3,0,0]=4 388 B11R2.106 c1cnc2ccsc2c1O PB32284 [0,0,0,0,1,0|3,0,0]=4 389 B11R2.106 c1csc2c1c(cnc2)Cl MB08838 [0,0,0,0,1,0|3,0,0]=4 390 B10R1.4 Cc1ccccc1CC=O AB11813 [1,0,1,0,0,0|1,0,1]=4 391 B10R1.10 Cc1cccc(c1)CC=O AB11815 [1,0,1,0,0,0|1,0,1]=4 392 B10R1.10 c1cc(cc(c1)Br)\C=C\Br AB73510 [1,0,1,0,0,0|2,0,0]=4 393 B10R1.15 c1ccc(cc1)C(=O)C=O AB00817 [1,0,1,0,0,0|2,0,0]=4 394 B10R1.15 c1ccc(cc1)C(=O)C=O AB03966 [1,0,1,0,0,0|2,0,0]=4 395 B10R1.20 COc1ccccc1C=O AB00311 [1,0,1,0,0,0|2,0,0]=4 396 B10R1.245 Cc1cccc(c1C=O)O MB14829 [1,0,1,0,0,0|2,0,0]=4 397 B12R1.226 c1cc(cc(c1)Cl)\C=C\C(=O)O AB00370 [0,1,1,0,0,0|2,0,0]=4 398 B12R1.77 COc1ccccc1C(=O)C=O AB29979 [0,1,1,0,0,0|2,0,0]=4 399 B12R2.24 Cc1ccc2c(n1)cccn2 PB12466 [1,1,0,0,0,0|2,0,0]=4 400 B12R2.24 Cc1ccc2cccnc2n1 AB17502 [1,1,0,0,0,0|2,0,0]=4 401 B12R2.24 Cc1cnc2ccccc2n1 CB10047 [1,1,0,0,0,0|2,0,0]=4 402 B12R2.24 c1cc(cc2c1ccnc2)Br PB34202 [1,1,0,0,0,0|1,0,0]=3 403 B12R2.24 c1cc(cc2c1ccnc2)Cl MB00648 [1,1,0,0,0,0|1,0,0]=3 404 B12R2.24 c1cc(cc2c1ccnc2)F MB09751 [1,1,0,0,0,0|1,0,0]=3 405 B12R2.24 c1cc(cc2c1ccnc2)I MB09748 [1,1,0,0,0,0|1,0,0]=3 406 B12R2.24 c1cc(cc2c1ccnc2)N MB06457 [1,1,0,0,0,0|1,0,0]=3 407 B12R2.24 c1cc(cc2c1ccnc2)O MB01177 [1,1,0,0,0,0|1,0,0]=3 408 B12R2.24 c1cc(nc2c1cncc2)Br MB04110 [1,1,0,0,0,0|2,0,0]=4 409 B12R2.24 c1cc(nc2c1cncc2)Cl MB09141 [1,1,0,0,0,0|2,0,0]=4 410 B12R2.24 c1cc(nc2c1cncc2)N MB01025 [1,1,0,0,0,0|2,0,0]=4 411 B12R2.24 c1cc2c(cc(cn2)Br)nc1 AB64897 [1,1,0,0,0,0|2,0,0]=4 412 B12R2.24 c1cc2c(cc(cn2)N)nc1 AB68450 [1,1,0,0,0,0|2,0,0]=4 413 B12R2.24 c1cc2c(cc1Br)C=CCO2 AB56471 [1,1,0,0,0,0|1,0,1]=4 414 B12R2.24 c1cc2c(cc1Br)cncn2 PB12515 [1,1,0,0,0,0|2,0,0]=4 415 B12R2.24 c1cc2c(cc1Br)nccn2 AB07430 [1,1,0,0,0,0|2,0,0]=4 416 B12R2.24 c1cc2c(cc1Cl)cncn2 MB09911 [1,1,0,0,0,0|2,0,0]=4 417 B12R2.24 c1cc2c(cc1I)cncn2 MB07778 [1,1,0,0,0,0|2,0,0]=4 418 B12R2.24 c1cc2c(cc1N)cncn2 AB60729 [1,1,0,0,0,0|2,0,0]=4 419 B12R2.24 c1cc2c(cc1N)nccn2 AB06131 [1,1,0,0,0,0|2,0,0]=4 420 B12R2.24 c1cc2c(cc1O)cncn2 MB01173 [1,1,0,0,0,0|2,0,0]=4 421 B12R2.24 c1cc2c(ccc(n2)Br)nc1 AB05219 [1,1,0,0,0,0|2,0,0]=4 422 B12R2.24 c1cc2c(ccc(n2)Cl)nc1 PB18055 [1,1,0,0,0,0|2,0,0]=4 423 B12R2.24 c1cc2c(ccc(n2)N)nc1 AB08278 [1,1,0,0,0,0|2,0,0]=4 424 B12R2.24 c1cc2cc(ccc2nc1)Br AB01417 [1,1,0,0,0,0|1,0,0]=3 425 B12R2.24 c1cc2cc(cnc2nc1)Br AB17834 [1,1,0,0,0,0|2,0,0]=4 426 B12R2.24 c1cc2ccc(=O)[nH]c2nc1 PB26329 [1,1,0,0,0,0|2,0,0]=4 427 B12R2.24 c1cc2ccc(cc2nc1)Br AB15717 [1,1,0,0,0,0|1,0,0]=3 428 B12R2.24 c1cc2ccc(nc2nc1)Br AB05221 [1,1,0,0,0,0|2,0,0]=4 429 B12R2.24 c1cc2ccc(nc2nc1)Cl AB05225 [1,1,0,0,0,0|2,0,0]=4 430 B12R2.24 c1cc2ccc(nc2nc1)N AB08428 [1,1,0,0,0,0|2,0,0]=4 431 B12R2.24 c1cc2cnccc2cc1Br PB29336 [1,1,0,0,0,0|1,0,0]=3 432 B12R2.24 c1cc2cnccc2cc1Cl MB08350 [1,1,0,0,0,0|1,0,0]=3 433 B12R2.24 c1cc2cnccc2cc1F MB09677 [1,1,0,0,0,0|1,0,0]=3 434 B12R2.24 c1cc2cnccc2cc1I MB09307 [1,1,0,0,0,0|1,0,0]=3 435 B12R2.24 c1cc2cnccc2cc1N AB19123 [1,1,0,0,0,0|1,0,0]=3 436 B12R2.24 c1cc2cnccc2cc1O AB19117 [1,1,0,0,0,0|1,0,0]=3 437 B12R2.24 c1cc2cncnc2cc1Br PB23522 [1,1,0,0,0,0|2,0,0]=4 438 B12R2.24 c1cc2cncnc2cc1Cl MB00894 [1,1,0,0,0,0|2,0,0]=4 439 B12R2.24 c1cc2cncnc2cc1N AB60731 [1,1,0,0,0,0|2,0,0]=4 440 B12R2.24 c1cc2cncnc2cc1O AB60737 [1,1,0,0,0,0|2,0,0]=4 441 B12R2.24 c1cc2cnncc2cc1Br PB16069 [1,1,0,0,0,0|2,0,0]=4 442 B12R2.24 c1ccc2c(c1)c[nH]c(=O)n2 MB05981 [1,1,0,0,0,0|2,0,0]=4 443 B12R2.24 c1ccc2c(c1)cc(cn2)Br AB00810 [1,1,0,0,0,0|1,0,0]=3 444 B12R2.24 c1ccc2c(c1)ccc(n2)Br MB01039 [1,1,0,0,0,0|1,0,0]=3 445 B12R2.24 c1ccc2c(c1)ccc(n2)Cl AB00798 [1,1,0,0,0,0|1,0,0]=3 446 B12R2.24 c1ccc2c(c1)cnc(n2)Cl AB55617 [1,1,0,0,0,0|2,0,0]=4 447 B12R2.24 c1ccc2c(c1)cnc(n2)N AB07784 [1,1,0,0,0,0|2,0,0]=4 448 B12R2.24 c1ccc2c(c1)ncc(n2)Br AB31889 [1,1,0,0,0,0|2,0,0]=4 449 B12R2.24 c1ccc2c(c1)ncc(n2)N MB00639 [1,1,0,0,0,0|2,0,0]=4 450 B12R2.24 c1ccc2cnc(cc2c1)Br PB12162 [1,1,0,0,0,0|1,0,0]=3 451 B12R2.24 c1ccc2cnc(cc2c1)Cl PB18703 [1,1,0,0,0,0|1,0,0]=3 452 B12R2.24 c1ccc2cnc(cc2c1)N AB03416 [1,1,0,0,0,0|1,0,0]=3 453 B12R2.24 c1ccc2cnc(cc2c1)O PB24595 [1,1,0,0,0,0|1,0,0]=3 454 B12R2.1 C1=CC2C(=NC=C2CN)C=C1 AB09355 [0,1,0,0,1,0|1,0,1]=4 455 B12R2.1 c1ccc2c(c1)c(co2)C=O MB02776 [0,1,0,0,1,0|1,0,1]=4 456 B12R2.1 c1ccn2c(c1)c(cn2)CN AB28979 [0,1,0,0,1,0|2,0,0]=4 457 B12R2.1 c1ccn2c(c1)ccc2C=O AB60669 [0,1,0,0,1,0|1,0,1]=4 458 B12R2.1 c1ccn2c(c1)ncc2CCl AB23751 [0,1,0,0,1,0|2,0,0]=4 459 B12R2.1 c1ccn2c(c1)ncc2CN AB28479 [0,1,0,0,1,0|2,0,0]=4 460 B12R2.1 c1ccn2cnc(c2c1)CN AB28978 [0,1,0,0,1,0|2,0,0]=4 461 B12R2.18 Cn1c2ccccc2nc1Cl AB07066 [0,1,0,0,1,0|2,0,0]=4 462 B12R2.132 CC1=c2cc(ccc2=NC1)Br AB17162 [0,1,0,0,1,0|1,0,1]=4 463 B12R2.132 Cc1c2cc(ccc2on1)Br MB06428 [0,1,0,0,1,0|2,0,0]=4 464 B12R2.132 Cc1coc2c1cc(cc2)Br MB07839 [0,1,0,0,1,0|1,0,0]=3 465 B12R2.132 Cn1c2cc(ccc2cn1)Br PB22316 [0,1,0,0,1,0|2,0,0]=4 466 B12R2.132 Cn1c2cc(ccc2cn1)Cl MB11448 [0,1,0,0,1,0|2,0,0]=4 467 B12R2.132 Cn1c2cc(ccc2cn1)F MB11451 [0,1,0,0,1,0|2,0,0]=4 468 B12R2.132 Cn1c2cc(ccc2cn1)I MB11454 [0,1,0,0,1,0|2,0,0]=4 469 B12R2.132 Cn1c2cc(ccc2cn1)N PB21697 [0,1,0,0,1,0|2,0,0]=4 470 B12R2.132 Cn1c2cc(ccc2cn1)O MB01167 [0,1,0,0,1,0|2,0,0]=4 471 B12R2.132 Cn1ccc2c1cc(cc2)N AB55988 [0,1,0,0,1,0|1,0,0]=3 472 B12R2.132 c1cc2c(cc1Cl)c(co2)Br AB65773 [0,1,0,0,1,0|2,0,0]=4 473 B12R2.132 c1cc2c(cc1Cl)c(cs2)Br MB14444 [0,1,0,0,1,0|2,0,0]=4 474 B12R2.196 CC1=c2cccc(c2=NC1)Cl AB44105 [0,1,0,0,1,0|1,0,1]=4 475 B12R2.196 Cc1csc2c1ccnc2Cl AB63934 [0,1,0,0,1,0|2,0,0]=4 476 B12R2.196 Cc1csc2c1ccnc2O AB63938 [0,1,0,0,1,0|2,0,0]=4 477 B12R2.196 Cc1csc2c1nccc2Cl PB28684 [0,1,0,0,1,0|2,0,0]=4 478 B12R2.196 Cn1c2cccc(c2cn1)Br PB23714 [0,1,0,0,1,0|2,0,0]=4 479 B12R2.196 Cn1c2cccc(c2cn1)F MB09182 [0,1,0,0,1,0|2,0,0]=4 480 B12R2.196 Cn1c2cccc(c2cn1)I PB34667 [0,1,0,0,1,0|2,0,0]=4 481 B12R2.196 Cn1c2cccc(c2cn1)N PB22298 [0,1,0,0,1,0|2,0,0]=4 482 B12R2.196 Cn1c2cccc(c2cn1)O MB10366 [0,1,0,0,1,0|2,0,0]=4 483 B12R2.196 Cn1ccc2c1cccc2N AB43235 [0,1,0,0,1,0|1,0,0]=3 484 B12R2.196 Cn1ccc2c1nccc2Br PB15126 [0,1,0,0,1,0|2,0,0]=4 485 B12R2.196 Cn1ccc2c1nccc2Cl PB20579 [0,1,0,0,1,0|2,0,0]=4 486 B12R2.203 Cn1c2c(cccc2Br)cn1 PB34460 [0,1,0,0,1,0|2,0,0]=4 487 B12R2.203 Cn1c2c(cccc2F)cn1 MB11997 [0,1,0,0,1,0|2,0,0]=4 488 B12R2.203 Cn1c2c(cccc2N)cn1 PB13181 [0,1,0,0,1,0|2,0,0]=4 489 B12R2.612 Cc1c2ccc(cc2sn1)Cl MB04108 [0,1,0,0,1,0|2,0,0]=4 490 B12R2.612 Cn1c2ccc(cc2cn1)Br PB22315 [0,1,0,0,1,0|2,0,0]=4 491 B12R2.612 Cn1c2ccc(cc2cn1)I MB11460 [0,1,0,0,1,0|2,0,0]=4 492 B12R2.612 Cn1c2ccc(cc2cn1)N PB29249 [0,1,0,0,1,0|2,0,0]=4 493 B12R2.612 Cn1c2ccc(cc2cn1)S MB69216 [0,1,0,0,1,0|2,0,0]=4 494 B12R2.612 Cn1ccc2c1ncc(c2)Br PB24178 [0,1,0,0,1,0|2,0,0]=4 495 B12R2.612 Cn1ccc2c1ncc(c2)N PB19323 [0,1,0,0,1,0|2,0,0]=4 496 B12R2.612 Cn1ccc2c1ncc(c2)O AB48843 [0,1,0,0,1,0|2,0,0]=4 497 B12R2.2028 Cc1c2ccccc2n(n1)N MB14907 [0,1,0,0,1,0|2,0,0]=4 498 B12R2.2028 Cn1c2ccccc2c(n1)Br PB19317 [0,1,0,0,1,0|2,0,0]=4 499 B12R2.2028 Cn1c2ccccc2c(n1)I PB31461 [0,1,0,0,1,0|2,0,0]=4 500 B12R2.2028 Cn1cc(c2c1cccc2)Br MB09274 [0,1,0,0,1,0|1,0,0]=3 501 B12R2.2028 Cn1cc(c2c1nccc2)Br AB51141 [0,1,0,0,1,0|2,0,0]=4 502 B12R2.82 c1cc(c(c2c1cco2)Br)F MB06990 [0,1,0,0,1,0|2,0,0]=4 503 B12R2.202 Cc1c2cc(cn2ccn1)Cl AB52886 [0,1,0,0,1,0|2,0,0]=4 504 B12R2.202 Cc1cccc2=NC(=O)N=c12 AB44499 [0,1,0,0,1,0|2,0,0]=4 505 B12R2.202 Cc1cccc2c1nc(o2)S AB64565 [0,1,0,0,1,0|2,0,0]=4 506 B12R2.202 Cc1cccc2c1nc(s2)Br AB16505 [0,1,0,0,1,0|2,0,0]=4 507 B12R2.202 Cc1cccc2c1nc(s2)Cl AB16506 [0,1,0,0,1,0|2,0,0]=4 508 B12R2.202 Cc1cccc2c1nc(s2)O AB16509 [0,1,0,0,1,0|2,0,0]=4 509 B12R2.202 Cc1cccc2c1nc(s2)S AB62961 [0,1,0,0,1,0|2,0,0]=4 510 B12R2.202 Cc1cccc2c1oc(n2)S AB66120 [0,1,0,0,1,0|2,0,0]=4 511 B12R2.202 Cc1cccc2c1sc(n2)S AB66145 [0,1,0,0,1,0|2,0,0]=4 512 B12R2.202 Cc1cccn2c1nc(c2)C AB63390 [0,1,0,0,1,0|2,0,0]=4 513 B12R2.202 c1cc2c(cc(s2)N)c(c1)Br PB35935 [0,1,0,0,1,0|2,0,0]=4 514 B12R2.202 c1cc2cc(sc2c(c1)Br)N PB11619 [0,1,0,0,1,0|2,0,0]=4 515 B12R2.221 c1cc(c2c(c1F)cco2)Br MB06970 [0,1,0,0,1,0|2,0,0]=4 516 B12R2.221 c1cc(c2ccoc2c1Cl)Br MB10392 [0,1,0,0,1,0|2,0,0]=4 517 B12R2.221 c1cc(c2ccoc2c1F)Br MB10389 [0,1,0,0,1,0|2,0,0]=4 518 B12R2.221 c1cc(c2ccoc2c1N)Br MB08877 [0,1,0,0,1,0|2,0,0]=4 519 B12R2.246 Cc1cc(c2c(c1)N=CC2)C AB31499 [0,1,0,0,1,0|1,0,1]=4 520 B12R2.246 Cc1cc(cc2c1occ2)Br MB10399 [0,1,0,0,1,0|1,0,0]=3 521 B12R2.246 Cc1cc(nc2c1csc2)Cl AB56184 [0,1,0,0,1,0|2,0,0]=4 522 B12R2.246 Cc1cc2ccoc2c(c1)Br MB10395 [0,1,0,0,1,0|2,0,0]=4 523 B12R2.246 c1coc2c1cc(cc2Br)Br MB10026 [0,1,0,0,1,0|2,0,0]=4 524 B12R2.246 c1coc2c1cc(cc2Br)Cl MB06992 [0,1,0,0,1,0|2,0,0]=4 525 B12R2.246 c1coc2c1cc(cc2Br)F MB06968 [0,1,0,0,1,0|2,0,0]=4 526 B12R2.246 c1coc2c1cc(cc2Br)O MB10400 [0,1,0,0,1,0|2,0,0]=4 527 B12R2.246 c1coc2c1cc(cc2Cl)Br MB10408 [0,1,0,0,1,0|2,0,0]=4 528 B12R2.246 c1coc2c1cc(cc2F)Br MB06987 [0,1,0,0,1,0|2,0,0]=4 529 B12R2.246 c1coc2c1cc(cc2N)Br MB10410 [0,1,0,0,1,0|2,0,0]=4 530 B12R2.246 c1coc2c1cc(cc2O)F AB31653 [0,1,0,0,1,0|2,0,0]=4 531 B12R2.315 COC1=C2C(=CC=N2)C=CC1 AB02030 [0,1,0,0,1,0|1,0,1]=4 532 B12R2.315 COC1=C2C=CN=C2C=CC1 PB19861 [0,1,0,0,1,0|1,0,1]=4 533 B12R2.315 COc1c2c(ccn1)cco2 PB29696 [0,1,0,0,1,0|2,0,0]=4 534 B12R2.315 c1cc(c2c(c1)N=CC2)CN AB21262 [0,1,0,0,1,0|1,0,1]=4 535 B12R2.315 c1cc(c2c(c1)N=CC2)CO AB09515 [0,1,0,0,1,0|1,0,1]=4 536 B12R2.315 c1cc(c2ccoc2c1)C#N MB08822 [0,1,0,0,1,0|1,0,1]=4 537 B12R2.315 c1cc(c2ccoc2c1)C=O MB08826 [0,1,0,0,1,0|1,0,1]=4 538 B12R2.315 c1cc(c2ccoc2c1)CO MB08830 [0,1,0,0,1,0|1,0,0]=3 539 B12R2.315 c1cc(c2nccn2c1)CN AB61210 [0,1,0,0,1,0|2,0,0]=4 540 B12R2.315 c1cc(c2nccn2c1)CO PB25508 [0,1,0,0,1,0|2,0,0]=4 541 B12R2.315 c1cc(n2ccnc2c1)CCl AB66625 [0,1,0,0,1,0|2,0,0]=4 542 B12R2.315 c1cc(n2ccnc2c1)CN AB61224 [0,1,0,0,1,0|2,0,0]=4 543 B12R2.315 c1cc2c(nccn2c1)CO PB37821 [0,1,0,0,1,0|2,0,0]=4 544 B12R2.315 c1cc2ccnn2c(c1)CN AB28982 [0,1,0,0,1,0|2,0,0]=4 545 B12R2.315 c1cc2ccnn2c(c1)CO AB28976 [0,1,0,0,1,0|2,0,0]=4 546 B12R2.315 c1cc2ccsc2c(c1)C=O MB06402 [0,1,0,0,1,0|1,0,1]=4 547 B14R2.287 c1cc2c(ccc(=O)nc2nc1)O AB43870 [0,1,0,0,0,1|2,0,0]=4 548 B14R2.92 c1cc2ccc(c(c2nc1)N)C=O CB11487 [0,2,0,0,0,0|2,0,0]=4 549 B14R2.92 c1ccc2c(c1)c(=O)c(co2)C=O CB10095 [0,2,0,0,0,0|2,0,0]=4 550 B14R2.203 c1ccc2c(c1)ccc(c2CN)O AB09123 [0,2,0,0,0,0|0,0,0]=2 551 B14R2.203 c1ccc2c(c1)ccc(c2CN)O AB42933 [0,2,0,0,0,0|0,0,0]=2 552 B14R2.4513 Cc1ccc2ccc(c(c2n1)C)Cl AB52384 [0,2,0,0,0,0|1,0,0]=3 553 B14R2.4513 Cc1ccc2ccc(nc2c1C)C AB45157 [0,2,0,0,0,0|1,0,0]=3 554 B14R2.4513 Cn1c2cc(ccc2ncc1=O)Br AB56064 [0,2,0,0,0,0|2,0,0]=4 555 B14R2.4513 c1cc(c(c2c1ccc(=O)o2)O)O PB17055 [0,2,0,0,0,0|2,0,0]=4 556 B14R2.8038 Cc1c(ccc2c1nccc2Cl)Cl AB12565 [0,2,0,0,0,0|1,0,0]=3 557 B14R2.8038 Cc1c(ccc2c1nccc2N)Cl AB52078 [0,2,0,0,0,0|1,0,0]=3 558 B14R2.8038 Cc1c(ccc2c1nccc2O)Cl AB05696 [0,2,0,0,0,0|1,0,0]=3 559 B14R2.8038 Cc1ccc2c(ccnc2c1C)Cl AB42065 [0,2,0,0,0,0|1,0,0]=3 560 B14R2.8038 Cc1ccc2c(ccnc2c1C)N AB52076 [0,2,0,0,0,0|1,0,0]=3 561 B14R2.8038 Cc1ccc2c(ccnc2c1C)O AB05733 [0,2,0,0,0,0|1,0,0]=3 562 B14R2.8038 c1cc(c(c2c1c(ccn2)Cl)Cl)Cl AB52012 [0,2,0,0,0,0|2,0,0]=4 563 B14R2.8038 c1cc(c(c2c1c(ccn2)N)Cl)Cl AB52073 [0,2,0,0,0,0|2,0,0]=4 564 B14R2.8038 c1cc(c(c2c1c(ccn2)O)Cl)Cl AB05718 [0,2,0,0,0,0|2,0,0]=4 565 B14R2.8188 Cc1c(nc2ccccc2c1Cl)C AB50456 [0,2,0,0,0,0|2,0,0]=4 566 B14R2.8188 Cc1c(nc2ccccc2c1O)C AB50455 [0,2,0,0,0,0|2,0,0]=4 567 B14R2.8188 c1cc2c(cc(c(c2F)Br)F)nc1 PB31669 [0,2,0,0,0,0|2,0,0]=4 568 B14R2.28523 Cn1c(=O)ccc2c1c(ccc2)Br MB10242 [0,2,0,0,0,0|1,0,0]=3 569 B14R2.29369 Cc1ccc2c(c1)ccc(=O)n2C MB01954 [0,2,0,0,0,0|1,0,0]=3 570 B14R2.29369 Cn1c2ccc(cc2ccc1=O)Br MB10578 [0,2,0,0,0,0|1,0,0]=3 571 B14R2.142 CCc1ccc2c(c1)c(ccn2)Cl AB52108 [0,2,0,0,0,0|2,0,0]=4 572 B14R2.142 CCc1ccc2c(c1)c(ccn2)N AB52071 [0,2,0,0,0,0|2,0,0]=4 573 B14R2.142 CCc1ccc2c(c1)c(ccn2)O AB11881 [0,2,0,0,0,0|2,0,0]=4 574 B14R2.142 COc1ccc2c(c1)c(ccn2)Br AB45030 [0,2,0,0,0,0|2,0,0]=4 575 B14R2.142 COc1ccc2c(c1)c(ccn2)Cl AB01409 [0,2,0,0,0,0|2,0,0]=4 576 B14R2.142 COc1ccc2c(c1)c(ccn2)N AB06274 [0,2,0,0,0,0|2,0,0]=4 577 B14R2.142 COc1ccc2c(c1)c(ccn2)O AB01174 [0,2,0,0,0,0|2,0,0]=4 578 B14R2.142 COc1ccc2cc[nH]c(=O)c2c1 AB62719 [0,2,0,0,0,0|2,0,0]=4 579 B14R2.142 COc1ccc2cccc(c2c1)Cl AB44054 [0,2,0,0,0,0|1,0,0]=3 580 B14R2.142 COc1ccc2cccc(c2c1)N AB44293 [0,2,0,0,0,0|1,0,0]=3 581 B14R2.142 COc1ccc2cccc(c2n1)Br MB10603 [0,2,0,0,0,0|2,0,0]=4 582 B14R2.142 COc1ccc2ccnc(c2c1)Br AB70051 [0,2,0,0,0,0|2,0,0]=4 583 B14R2.142 COc1ccc2ccnc(c2c1)Cl AB69421 [0,2,0,0,0,0|2,0,0]=4 584 B14R2.142 COc1ccc2ccnc(c2c1)N AB69424 [0,2,0,0,0,0|2,0,0]=4 585 B14R2.142 c1cc(cc2c1ccnc2Cl)C=O AB53309 [0,2,0,0,0,0|2,0,0]=4 586 B14R2.142 c1cc(cc2c1ccnc2Cl)CBr AB53340 [0,2,0,0,0,0|2,0,0]=4 587 B14R2.142 c1cc2c(cc1C#N)c(ccn2)O CB11067 [0,2,0,0,0,0|2,0,0]=4 588 B14R2.142 c1cc2c(cc1CBr)c(ccn2)Cl AB63940 [0,2,0,0,0,0|2,0,0]=4 589 B14R2.142 c1cc2ccc(nc2c(c1)Br)CBr AB65964 [0,2,0,0,0,0|2,0,0]=4 590 B14R2.8045 Cc1cc(c2c(c1)c(=O)[nH]cn2)C AB21790 [0,2,0,0,0,0|2,0,0]=4 591 B14R2.8045 Cc1cc(c2c(c1)c(ccn2)Cl)C AB03219 [0,2,0,0,0,0|1,0,0]=3 592 B14R2.8045 Cc1cc(c2c(c1)c(ccn2)N)C AB49057 [0,2,0,0,0,0|1,0,0]=3 593 B14R2.8045 Cc1cc(c2c(c1)c(ccn2)O)C AB05730 [0,2,0,0,0,0|1,0,0]=3 594 B14R2.8045 Cc1cc(c2c(c1)c(ncn2)Cl)C AB45616 [0,2,0,0,0,0|2,0,0]=4 595 B14R2.8045 Cc1cc(c2cccc(c2n1)Br)Cl AB05684 [0,2,0,0,0,0|2,0,0]=4 596 B14R2.8045 Cc1cc(c2cccc(c2n1)Br)N AB46032 [0,2,0,0,0,0|2,0,0]=4 597 B14R2.8045 Cc1cc(c2cccc(c2n1)Br)O AB06321 [0,2,0,0,0,0|2,0,0]=4 598 B14R2.8045 Cc1cc(c2cccc(c2n1)Cl)Cl AB05660 [0,2,0,0,0,0|2,0,0]=4 599 B14R2.8045 Cc1cc(c2cccc(c2n1)Cl)N AB10438 [0,2,0,0,0,0|2,0,0]=4 600 B14R2.8045 Cc1cc(c2cccc(c2n1)Cl)O AB03452 [0,2,0,0,0,0|2,0,0]=4 601 B14R2.8045 Cc1cc(c2cccc(c2n1)F)Cl AB05610 [0,2,0,0,0,0|2,0,0]=4 602 B14R2.8045 Cc1cc(c2cccc(c2n1)F)N AB52090 [0,2,0,0,0,0|2,0,0]=4 603 B14R2.8045 Cc1cc(c2cccc(c2n1)F)O AB05637 [0,2,0,0,0,0|2,0,0]=4 604 B14R2.8045 Cc1cc(cc2c1nccc2Br)Cl AB42132 [0,2,0,0,0,0|1,0,0]=3 605 B14R2.8045 Cc1cc(cc2c1nccc2Cl)Cl AB52009 [0,2,0,0,0,0|1,0,0]=3 606 B14R2.8045 Cc1cc(cc2c1nccc2N)Cl AB52063 [0,2,0,0,0,0|1,0,0]=3 607 B14R2.8045 Cc1cc(cc2c1nccc2O)Cl AB05694 [0,2,0,0,0,0|1,0,0]=3 608 B14R2.8045 Cc1cc2c(ccnc2c(c1)Cl)Cl AB52016 [0,2,0,0,0,0|2,0,0]=4 609 B14R2.8045 Cc1cc2c(ccnc2c(c1)Cl)N AB52086 [0,2,0,0,0,0|2,0,0]=4 610 B14R2.8045 Cc1cc2c(ccnc2c(c1)Cl)O AB05700 [0,2,0,0,0,0|2,0,0]=4 611 B14R2.8045 Cc1cccc2c1nc(cc2C)C AB05600 [0,2,0,0,0,0|1,0,0]=3 612 B14R2.8045 Cc1cccc2c1nc(cc2Cl)C AB05627 [0,2,0,0,0,0|1,0,0]=3 613 B14R2.8045 Cc1cccc2c1nc(cc2N)C AB46037 [0,2,0,0,0,0|1,0,0]=3 614 B14R2.8045 Cc1cccc2c1nc(cc2O)C AB03395 [0,2,0,0,0,0|1,0,0]=3 615 B14R2.8045 Cc1cccc2c1nc(nc2O)C AB63500 [0,2,0,0,0,0|2,0,0]=4 616 B14R2.8045 c1cnc2c(c1Cl)cc(cc2Cl)Cl AB43468 [0,2,0,0,0,0|2,0,0]=4 617 B14R2.8045 c1cnc2c(c1N)cc(cc2Cl)Cl AB43471 [0,2,0,0,0,0|2,0,0]=4 618 B14R2.8045 c1cnc2c(c1O)cc(cc2Cl)Cl AB05654 [0,2,0,0,0,0|2,0,0]=4 619 B14R2.8235 Cc1c2cc(ccc2nc(n1)Cl)Br PB25199 [0,2,0,0,0,0|2,0,0]=4 620 B14R2.8235 Cc1cc(c2cc(ccc2n1)Br)Cl AB05644 [0,2,0,0,0,0|2,0,0]=4 621 B14R2.8235 Cc1cc(c2cc(ccc2n1)Br)N AB07349 [0,2,0,0,0,0|2,0,0]=4 622 B14R2.8235 Cc1cc(c2cc(ccc2n1)Br)O AB06317 [0,2,0,0,0,0|2,0,0]=4 623 B14R2.8235 Cc1cc(c2cc(ccc2n1)Cl)Cl AB05640 [0,2,0,0,0,0|2,0,0]=4 624 B14R2.8235 Cc1cc(c2cc(ccc2n1)Cl)N AB52059 [0,2,0,0,0,0|2,0,0]=4 625 B14R2.8235 Cc1cc(c2cc(ccc2n1)F)Cl AB05604 [0,2,0,0,0,0|2,0,0]=4 626 B14R2.8235 Cc1cc(c2cc(ccc2n1)F)N AB23700 [0,2,0,0,0,0|2,0,0]=4 627 B14R2.8235 Cc1cc(cc2c1[nH]c(=O)cc2)Br MB09777 [0,2,0,0,0,0|1,0,0]=3 628 B14R2.8235 Cc1cc(nc2c1cc(cc2)Cl)Cl AB08526 [0,2,0,0,0,0|1,0,0]=3 629 B14R2.8235 Cc1cc(nc2c1cc(cc2)Cl)O AB07942 [0,2,0,0,0,0|1,0,0]=3 630 B14R2.8235 Cc1cc(nc2c1cc(cc2)F)Cl AB13083 [0,2,0,0,0,0|1,0,0]=3 631 B14R2.8235 Cc1cc(nc2c1cc(cc2)F)O AB55923 [0,2,0,0,0,0|1,0,0]=3 632 B14R2.8235 Cc1cc(nc2c1cc(cc2)O)Cl AB06491 [0,2,0,0,0,0|1,0,0]=3 633 B14R2.8235 Cc1cc(nc2c1cc(cc2)O)O AB45126 [0,2,0,0,0,0|1,0,0]=3 634 B14R2.8235 Cc1ccc2c(c1)c(cc(n2)C)Cl AB05657 [0,2,0,0,0,0|2,0,0]=4 635 B14R2.8235 Cc1ccc2c(c1)c(cc(n2)C)N AB10434 [0,2,0,0,0,0|2,0,0]=4 636 B14R2.8235 Cc1ccc2c(c1)c(cc(n2)C)O AB05586 [0,2,0,0,0,0|2,0,0]=4 637 B14R2.8235 Cc1ccc2c(c1)c(cc(n2)Cl)C AB06052 [0,2,0,0,0,0|1,0,0]=3 638 B14R2.8235 Cc1ccc2c(c1)c(cc(n2)O)C AB03192 [0,2,0,0,0,0|1,0,0]=3 639 B14R2.8235 Cc1ccc2cc(cc(c2n1)C)C AB51628 [0,2,0,0,0,0|1,0,0]=3 640 B14R2.8235 Cc1ccc2cc(cc(c2n1)C)Cl AB44505 [0,2,0,0,0,0|1,0,0]=3 641 B14R2.8235 c1cc(cc2c1cc(nc2Cl)Cl)Br PB34587 [0,2,0,0,0,0|2,0,0]=4 642 B14R2.8235 c1cc2c(cc1Cl)c(cc(n2)N)O MB05719 [0,2,0,0,0,0|2,0,0]=4 643 B14R2.8751 Cc1ccc(c2c1ccc(n2)C)C AB51613 [0,2,0,0,0,0|1,0,0]=3 644 B14R2.8751 Cc1ccc(c2c1nc(cc2)C)Cl AB52226 [0,2,0,0,0,0|1,0,0]=3 645 B14R2.11684 CCc1cccc2c1nc(cc2)C AB52468 [0,2,0,0,0,0|1,0,0]=3 646 B14R2.11684 Cc1ccc2c(c1)c(ccn2)NN AB52150 [0,2,0,0,0,0|2,0,0]=4 647 B14R2.11684 c1cc2c(cc1Br)c(ccn2)NN AB45093 [0,2,0,0,0,0|2,0,0]=4 648 B14R2.11684 c1cc2c(cc1Cl)c(ccn2)NN AB45094 [0,2,0,0,0,0|2,0,0]=4 649 B14R2.11684 c1cc2c(cc1F)c(ccn2)NN AB05760 [0,2,0,0,0,0|2,0,0]=4 650 B14R2.28472 Cc1cc2c(ccnc2cc1C)Cl AB52102 [0,2,0,0,0,0|2,0,0]=4 651 B14R2.28472 Cc1cc2c(ccnc2cc1C)N AB52053 [0,2,0,0,0,0|2,0,0]=4 652 B14R2.28472 Cc1cc2c(ccnc2cc1C)O AB05728 [0,2,0,0,0,0|2,0,0]=4 653 B14R2.28472 Cc1cccc2c1nc(c(c2)C)Cl AB42069 [0,2,0,0,0,0|1,0,0]=3 654 B14R2.28472 Cc1cccc2c1nc(c(c2)C)N AB05779 [0,2,0,0,0,0|1,0,0]=3 655 B14R2.28472 c1cnc2cc(c(cc2c1Cl)Cl)Cl AB43475 [0,2,0,0,0,0|2,0,0]=4 656 B14R2.28472 c1cnc2cc(c(cc2c1N)Cl)Cl AB43479 [0,2,0,0,0,0|2,0,0]=4 657 B14R2.28472 c1cnc2cc(c(cc2c1O)Cl)Cl AB05716 [0,2,0,0,0,0|2,0,0]=4 658 B14R2.1019 COc1cc2cccnc2c(c1)N CB10417 [0,2,0,0,0,0|2,0,0]=4 659 B14R2.1146 COc1c2ccccc2nc(n1)Cl AB03287 [0,2,0,0,0,0|2,0,0]=4 660 B14R2.1146 COc1cc(nc2c1cccc2)Cl AB55891 [0,2,0,0,0,0|1,0,0]=3 661 B14R2.1146 COc1cc(nc2c1cccc2)O AB09148 [0,2,0,0,0,0|1,0,0]=3 662 B14R2.1146 Cc1cc(c2ccccc2n1)C#N AB08233 [0,2,0,0,0,0|1,0,1]=4 663 B14R2.1146 Cc1cc(c2ccccc2n1)C=O AB43021 [0,2,0,0,0,0|1,0,1]=4 664 B14R2.1146 Cc1cc(c2ccccc2n1)CCl AB29712 [0,2,0,0,0,0|1,0,0]=3 665 B14R2.1146 Cc1cc(c2ccccc2n1)CN AB17861 [0,2,0,0,0,0|1,0,0]=3 666 B14R2.1146 Cc1cc(c2ccccc2n1)NN AB52136 [0,2,0,0,0,0|2,0,0]=4 667 B14R2.28480 Cc1cc(c2c(ccnc2c1)Cl)C AB42058 [0,2,0,0,0,0|1,0,0]=3 668 B14R2.28480 Cc1cc(c2c(ccnc2c1)N)C AB52037 [0,2,0,0,0,0|1,0,0]=3 669 B14R2.28480 Cc1cc(c2c(ccnc2c1)O)C AB05722 [0,2,0,0,0,0|1,0,0]=3 670 B14R2.28480 Cc1cccc2c1c(nc(n2)C)O AB63508 [0,2,0,0,0,0|2,0,0]=4 671 B14R2.28480 c1cnc2cc(cc(c2c1Cl)Cl)Cl AB43000 [0,2,0,0,0,0|2,0,0]=4 672 B14R2.28480 c1cnc2cc(cc(c2c1N)Cl)Cl AB52034 [0,2,0,0,0,0|2,0,0]=4 673 B14R2.28480 c1cnc2cc(cc(c2c1O)Cl)Cl AB04933 [0,2,0,0,0,0|2,0,0]=4 674 B14R2.29365 CC1=c2ccc(cc2=NC(=O)C1)N MB00725 [0,2,0,0,0,0|1,0,1]=4 675 B14R2.29365 Cc1cc(c2ccc(cc2n1)Br)Cl AB52376 [0,2,0,0,0,0|2,0,0]=4 676 B14R2.29365 Cc1cc(c2ccc(cc2n1)Br)N AB52077 [0,2,0,0,0,0|2,0,0]=4 677 B14R2.29365 Cc1cc(c2ccc(cc2n1)Cl)Cl AB05635 [0,2,0,0,0,0|2,0,0]=4 678 B14R2.29365 Cc1cc(c2ccc(cc2n1)Cl)N AB10426 [0,2,0,0,0,0|2,0,0]=4 679 B14R2.29365 Cc1cc(c2ccc(cc2n1)Cl)O AB05588 [0,2,0,0,0,0|2,0,0]=4 680 B14R2.29365 Cc1cc(c2ccc(cc2n1)F)Cl AB05606 [0,2,0,0,0,0|2,0,0]=4 681 B14R2.29365 Cc1cc(c2ccc(cc2n1)F)N AB52079 [0,2,0,0,0,0|2,0,0]=4 682 B14R2.29365 Cc1cc(c2ccc(cc2n1)F)O AB12584 [0,2,0,0,0,0|2,0,0]=4 683 B14R2.29365 Cc1cc(nc2c1ccc(c2)Cl)C AB05664 [0,2,0,0,0,0|1,0,0]=3 684 B14R2.29365 Cc1ccc2c(c1)nc(cc2Cl)C AB52100 [0,2,0,0,0,0|2,0,0]=4 685 B14R2.29365 Cc1ccc2c(c1)nc(cc2O)C AB09283 [0,2,0,0,0,0|2,0,0]=4 686 B14R2.29365 Cc1ccc2c(cc(cc2n1)C)C AB51599 [0,2,0,0,0,0|1,0,0]=3 687 B14R2.29365 Cc1ccc2c(cc(nc2c1)C)N AB10429 [0,2,0,0,0,0|2,0,0]=4 688 B14R2.29365 Cc1ccc2c(n1)cc(cc2Cl)Cl AB52171 [0,2,0,0,0,0|2,0,0]=4 689 B14R2.1078 CCc1cccc2c1nccc2Cl AB03222 [0,2,0,0,0,0|1,0,0]=3 690 B14R2.1078 CCc1cccc2c1nccc2N AB52089 [0,2,0,0,0,0|1,0,0]=3 691 B14R2.1078 CCc1cccc2c1nccc2O AB03226 [0,2,0,0,0,0|1,0,0]=3 692 B14R2.1078 COc1cccc2c1cc[nH]c2=O AB06974 [0,2,0,0,0,0|1,0,0]=3 693 B14R2.1078 COc1cccc2c1ccnc2Cl AB64602 [0,2,0,0,0,0|1,0,0]=3 694 B14R2.1078 COc1cccc2c1ccnc2N AB69444 [0,2,0,0,0,0|1,0,0]=3 695 B14R2.1078 COc1cccc2c1nccc2Cl AB01541 [0,2,0,0,0,0|1,0,0]=3 696 B14R2.1078 COc1cccc2c1nccc2N AB43466 [0,2,0,0,0,0|1,0,0]=3 697 B14R2.1078 COc1cccc2c1nccc2O AB12575 [0,2,0,0,0,0|1,0,0]=3 698 B14R2.1078 COc1ccnc2c1cc[nH]c2=O AB85038 [0,2,0,0,0,0|2,0,0]=4 699 B14R2.1078 Cc1cccc2c1nccc2NN AB05750 [0,2,0,0,0,0|1,0,0]=3 700 B14R2.1078 c1cc(c2ccnc(c2c1)Cl)C#N AB73869 [0,2,0,0,0,0|1,0,1]=4 701 B14R2.1078 c1cc2c(ccnc2c(c1)Br)C#N CB11610 [0,2,0,0,0,0|1,0,1]=4 702 B14R2.1078 c1cc2c(ccnc2c(c1)Br)C=O CB10968 [0,2,0,0,0,0|1,0,1]=4 703 B14R2.1078 c1cc2c(ccnc2c(c1)Br)CO CB11678 [0,2,0,0,0,0|1,0,0]=3 704 B14R2.1078 c1cc2c(ccnc2c(c1)Br)NN AB52460 [0,2,0,0,0,0|2,0,0]=4 705 B14R2.1078 c1cc2c(ccnc2c(c1)Cl)NN AB45098 [0,2,0,0,0,0|2,0,0]=4 706 B14R2.1078 c1cc2c(ccnc2c(c1)F)NN AB05761 [0,2,0,0,0,0|2,0,0]=4 707 B14R2.8051 Cc1ccc(c2c1c(ccn2)Cl)C AB42059 [0,2,0,0,0,0|1,0,0]=3 708 B14R2.8051 Cc1ccc(c2c1c(ccn2)N)C AB52043 [0,2,0,0,0,0|1,0,0]=3 709 B14R2.8051 Cc1ccc(c2c1c(ccn2)O)C AB05726 [0,2,0,0,0,0|1,0,0]=3 710 B14R2.8051 Cc1ccc(c2c1nccc2Cl)Cl AB52005 [0,2,0,0,0,0|1,0,0]=3 711 B14R2.8051 Cc1ccc(c2c1nccc2N)Cl AB52048 [0,2,0,0,0,0|1,0,0]=3 712 B14R2.8051 Cc1ccc(c2c1nccc2O)Cl AB05693 [0,2,0,0,0,0|1,0,0]=3 713 B14R2.8051 c1cc(c2c(c1Cl)c(ccn2)Cl)Cl AB52003 [0,2,0,0,0,0|2,0,0]=4 714 B14R2.8051 c1cc(c2c(c1Cl)c(ccn2)N)Cl AB52039 [0,2,0,0,0,0|2,0,0]=4 715 B14R2.8051 c1cc(c2c(c1Cl)c(ccn2)O)Cl AB05645 [0,2,0,0,0,0|2,0,0]=4 716 B14R2.1131 c1cc2c(ccc(c2nc1)C=O)Br AB43508 [0,2,0,0,0,0|1,0,1]=4 717 B14R2.1131 c1ccc2c(c1)c(ccc2Br)CBr AB30817 [0,2,0,0,0,0|0,0,0]=2 718 B14R2.1131 c1ccc2c(c1)c(ccc2Cl)NN AB27887 [0,2,0,0,0,0|1,0,0]=3 719 B14R2.1073 COc1cccc2c1ccc(=O)[nH]2 MB10591 [0,2,0,0,0,0|1,0,0]=3 720 B14R2.1073 COc1ccnc2c1ccc(c2)Cl MB01887 [0,2,0,0,0,0|1,0,0]=3 721 B14R2.1073 Cc1ccc2c(ccnc2c1)NN AB52155 [0,2,0,0,0,0|2,0,0]=4 722 B14R2.1073 c1cc(c2ccc(nc2c1)Cl)C=O AB72963 [0,2,0,0,0,0|1,0,1]=4 723 B14R2.1073 c1cc2c(ccnc2cc1Br)NN AB05762 [0,2,0,0,0,0|2,0,0]=4 724 B14R2.1073 c1cc2c(ccnc2cc1F)NN AB52490 [0,2,0,0,0,0|2,0,0]=4 725 B14R2.7150 CNCc1c2ccccc2ccn1 AB69251 [0,2,0,0,0,0|1,0,0]=3 726 B14R2.7150 CNCc1cccc2c1cccc2 AB01101 [0,2,0,0,0,0|0,0,0]=2 727 B14R2.7150 CNCc1cccc2c1cccc2 AB03923 [0,2,0,0,0,0|0,0,0]=2 728 B14R2.7150 CNCc1cccc2c1cccn2 AB42047 [0,2,0,0,0,0|1,0,0]=3 729 B14R2.7150 CNCc1cccc2c1nccc2 AB28130 [0,2,0,0,0,0|1,0,0]=3 730 B14R2.7150 c1ccc2c(c1)c(ccn2)N=C=O AB74227 [0,2,0,0,0,0|1,0,1]=4 731 B14R2.7150 c1ccc2c(c1)c(ncn2)CCN AB60726 [0,2,0,0,0,0|2,0,0]=4 732 B14R2.7150 c1ccc2c(c1)cccc2N=C=O AB00331 [0,2,0,0,0,0|0,0,1]=3 733 B14R2.11635 COc1cccc2c1c(ncn2)Cl AB50489 [0,2,0,0,0,0|2,0,0]=4 734 B14R2.11635 COc1cccc2c1c(ncn2)O AB50485 [0,2,0,0,0,0|2,0,0]=4 735 B14R2.31359 B(c1cccc2c1cccc2)(O)O AB01263 [0,2,0,0,0,0|1,0,0]=3 736 B14R2.31359 B(c1cccc2c1cccn2)(O)O AB13438 [0,2,0,0,0,0|2,0,0]=4 737 B14R2.31359 B(c1cccc2c1nccc2)(O)O AB08338 [0,2,0,0,0,0|2,0,0]=4 738 B14R2.31359 B(c1ccnc2c1cccc2)(O)O AB13541 [0,2,0,0,0,0|2,0,0]=4 739 B14R2.31359 B(c1cncc2c1cccc2)(O)O AB14365 [0,2,0,0,0,0|2,0,0]=4 740 B14R2.31359 B(c1cncc2c1cccc2)(O)O AB22278 [0,2,0,0,0,0|2,0,0]=4 741 B14R2.31359 CC(=O)c1c2ccccc2ccn1 AB43402 [0,2,0,0,0,0|1,0,0]=3 742 B14R2.31359 c1cc(c2cccnc2c1)C(=O)O AB02057 [0,2,0,0,0,0|1,0,1]=4 743 B14R2.31359 c1cc(c2cccnc2c1)C(=S)N AB28301 [0,2,0,0,0,0|1,0,1]=4 744 B14R2.31359 c1cc2ccncc2c(c1)C(=O)O AB28217 [0,2,0,0,0,0|1,0,1]=4 745 B14R2.31359 c1cc2ccncc2c(c1)C(=S)N AB28209 [0,2,0,0,0,0|1,0,1]=4 746 B14R2.31359 c1cc2cnccc2c(c1)C(=O)O AB16077 [0,2,0,0,0,0|1,0,1]=4 747 B14R2.31359 c1cc2cnccc2c(c1)C(=S)N AB28297 [0,2,0,0,0,0|1,0,1]=4 748 B14R2.31359 c1ccc2c(c1)c(ccn2)C(=N)N AB60894 [0,2,0,0,0,0|1,0,1]=4 749 B14R2.31359 c1ccc2c(c1)c(ccn2)C(=S)N AB11047 [0,2,0,0,0,0|1,0,1]=4 750 B14R2.31359 c1ccc2c(c1)cccc2C(=N)N AB18265 [0,2,0,0,0,0|0,0,1]=3 751 B14R2.31359 c1ccc2c(c1)ccnc2C(=S)N AB28167 [0,2,0,0,0,0|1,0,1]=4 752 B14R2.31359 c1ccc2c(c1)cncc2C(=O)O AB03356 [0,2,0,0,0,0|1,0,1]=4 753 B14R2.31359 c1ccc2c(c1)cncc2C(=S)N AB28152 [0,2,0,0,0,0|1,0,1]=4 754 B14R2.1801 COc1ccc2c(c1)cccc2Br MB03398 [0,2,0,0,0,0|1,0,0]=3 755 B14R2.1801 COc1ccc2c(c1)ccnc2Br AB70054 [0,2,0,0,0,0|2,0,0]=4 756 B14R2.1801 COc1ccc2c(c1)ccnc2Cl AB27579 [0,2,0,0,0,0|2,0,0]=4 757 B14R2.1801 COc1ccc2c(c1)ccnc2N AB69419 [0,2,0,0,0,0|2,0,0]=4 758 B14R2.1801 COc1ccc2c(c1)ccnc2O AB64610 [0,2,0,0,0,0|2,0,0]=4 759 B14R2.1801 COc1ccc2c(ccnc2c1)Cl PB12379 [0,2,0,0,0,0|2,0,0]=4 760 B14R2.1801 COc1ccc2c(ccnc2c1)N AB43461 [0,2,0,0,0,0|2,0,0]=4 761 B14R2.1801 COc1ccc2c(ccnc2c1)O AB04264 [0,2,0,0,0,0|2,0,0]=4 762 B14R2.1801 COc1ccc2c(n1)cccc2Br MB10596 [0,2,0,0,0,0|2,0,0]=4 763 B14R2.1801 c1cc2c(cc[nH]c2=O)cc1C=O AB65219 [0,2,0,0,0,0|2,0,0]=4 764 B14R2.1801 c1cc2c(ccnc2Cl)cc1C#N AB73872 [0,2,0,0,0,0|2,0,0]=4 765 B14R2.1801 c1cc2c(ccnc2Cl)cc1C=O AB70668 [0,2,0,0,0,0|2,0,0]=4 766 B14R2.1801 c1cc2c(ccnc2cc1C#N)Cl CB11064 [0,2,0,0,0,0|2,0,0]=4 767 B14R2.1801 c1cc2c(ccnc2cc1C#N)O CB11061 [0,2,0,0,0,0|2,0,0]=4 768 B12R2.2 c1ccc(cc1)C2=CN=NC2 AB06118 [0,0,1,1,0,0|2,0,0]=4 769 B12R2.2 c1ccc(cc1)n2cccn2 AB00291 [0,0,1,1,0,0|2,0,0]=4 770 B12R2.32 c1ccc2c(c1)cc(o2)C=O CB10104 [0,0,1,1,0,0|2,0,0]=4 771 B10R2.7 c1cc2c(cco2)nc1 PB26741 [1,0,0,0,1,0|2,0,0]=4 772 B10R2.7 c1cc2c(ccs2)nc1 PB25371 [1,0,0,0,1,0|2,0,0]=4 773 B10R2.7 c1cc2cnccn2c1 CB10529 [1,0,0,0,1,0|2,0,0]=4 774 B10R2.7 c1ccn2c(c1)ccn2 AB48944 [1,0,0,0,1,0|2,0,0]=4 775 B10R2.7 c1ccn2cccc2c1 AB01491 [1,0,0,0,1,0|1,0,0]=3 776 B10R2.7 c1ccn2cncc2c1 AB14043 [1,0,0,0,1,0|2,0,0]=4 777 B10R2.7 c1cncc2c1ccs2 MB02036 [1,0,0,0,1,0|2,0,0]=4