0 B15R2.29 c1cc(cnc1)Nc2ccc(cn2)Br MB06611 [0,1,0,0,0,0|3,0,0]=4 1 B15R2.29 c1cc(cnc1)Nc2ccc(nc2)Br MB14038 [0,1,0,0,0,0|3,0,0]=4 2 B15R2.29 c1cc(ncc1Br)Nc2ccncc2 MB14013 [0,1,0,0,0,0|3,0,0]=4 3 B15R2.29 c1cc(ncc1Nc2ccncc2)Br MB14040 [0,1,0,0,0,0|3,0,0]=4 4 B15R2.29 c1ccc(cc1)Nc2ccc(cc2)Br AB42496 [0,1,0,0,0,0|1,0,0]=2 5 B15R2.29 c1ccc(cc1)Nc2ccc(cn2)Br MB11975 [0,1,0,0,0,0|2,0,0]=3 6 B15R2.29 c1ccc(cc1)Nc2ccc(nc2)Br MB14031 [0,1,0,0,0,0|2,0,0]=3 7 B15R2.29 c1ccc(cc1)Nc2ncc(cn2)Br AB15631 [0,1,0,0,0,0|3,0,0]=4 8 B15R2.29 c1ccc(cc1)Oc2ccc(cc2)S AB06090 [0,1,0,0,0,0|0,0,0]=1 9 B15R2.29 c1ccc(cc1)Oc2ccc(cn2)N AB09766 [0,1,0,0,0,0|1,0,0]=2 10 B15R2.29 c1ccc(cc1)Oc2ncc(cn2)Br AB15669 [0,1,0,0,0,0|2,0,0]=3 11 B15R2.29 c1ccc(cc1)Oc2ncc(cn2)O AB58602 [0,1,0,0,0,0|2,0,0]=3 12 B15R2.29 c1ccnc(c1)Nc2ccc(cn2)Br MB14009 [0,1,0,0,0,0|3,0,0]=4 13 B15R2.29 c1ccnc(c1)Nc2ccc(nc2)Br MB14034 [0,1,0,0,0,0|3,0,0]=4 14 B15R2.31 c1cc(cnc1)Nc2cc(ccn2)Br MB14005 [0,1,0,0,0,0|3,0,0]=4 15 B15R2.31 c1cc(cnc1)Nc2cc(cnc2)Br MB14025 [0,1,0,0,0,0|3,0,0]=4 16 B15R2.31 c1cc(cnc1)Nc2ccnc(c2)Br MB14046 [0,1,0,0,0,0|3,0,0]=4 17 B15R2.31 c1cc(nc(c1)Br)Nc2cccnc2 MB14017 [0,1,0,0,0,0|3,0,0]=4 18 B15R2.31 c1cc(nc(c1)Br)Nc2ccncc2 MB14019 [0,1,0,0,0,0|3,0,0]=4 19 B15R2.31 c1cc(nc(c1)Cl)Nc2cccnc2 MB14054 [0,1,0,0,0,0|3,0,0]=4 20 B15R2.31 c1cc(nc(c1)Cl)Nc2ccncc2 MB14057 [0,1,0,0,0,0|3,0,0]=4 21 B15R2.31 c1ccc(cc1)C[n+]2cccc(c2)O AB01082 [0,1,0,0,0,0|2,0,0]=3 22 B15R2.31 c1ccc(cc1)C[n+]2cccc(c2)O AB07926 [0,1,0,0,0,0|2,0,0]=3 23 B15R2.31 c1ccc(cc1)Nc2cc(ccn2)Br MB14002 [0,1,0,0,0,0|2,0,0]=3 24 B15R2.31 c1ccc(cc1)Nc2cc(cnc2)Br MB14020 [0,1,0,0,0,0|2,0,0]=3 25 B15R2.31 c1ccc(cc1)Nc2cccc(n2)Br MB01054 [0,1,0,0,0,0|2,0,0]=3 26 B15R2.31 c1ccc(cc1)Nc2cccc(n2)Cl MB13525 [0,1,0,0,0,0|2,0,0]=3 27 B15R2.31 c1ccc(cc1)Nc2ccnc(c2)Br MB14044 [0,1,0,0,0,0|2,0,0]=3 28 B15R2.31 c1ccc(cc1)Oc2cccc(n2)Br AB09566 [0,1,0,0,0,0|1,0,0]=2 29 B15R2.31 c1ccc(cc1)Oc2cncc(n2)Cl AB06236 [0,1,0,0,0,0|2,0,0]=3 30 B15R2.31 c1ccc(cc1)Sc2ccnc(n2)Cl MB14537 [0,1,0,0,0,0|2,1,0]=4 31 B15R2.31 c1ccnc(c1)Nc2cc(ccn2)Br MB14004 [0,1,0,0,0,0|3,0,0]=4 32 B15R2.31 c1ccnc(c1)Nc2cc(cnc2)Br MB14022 [0,1,0,0,0,0|3,0,0]=4 33 B15R2.31 c1ccnc(c1)Nc2cccc(n2)Br MB14014 [0,1,0,0,0,0|3,0,0]=4 34 B15R2.31 c1ccnc(c1)Nc2cccc(n2)Cl MB14051 [0,1,0,0,0,0|3,0,0]=4 35 B15R2.31 c1ccnc(c1)Nc2ccnc(c2)Br MB14045 [0,1,0,0,0,0|3,0,0]=4 36 B15R2.31 c1cnccc1Nc2cc(ccn2)Br MB14007 [0,1,0,0,0,0|3,0,0]=4 37 B15R2.31 c1cnccc1Nc2cc(cnc2)Br MB14027 [0,1,0,0,0,0|3,0,0]=4 38 B15R2.31 c1cnccc1Nc2ccnc(c2)Br MB14047 [0,1,0,0,0,0|3,0,0]=4 39 B15R2.2226 c1ccc(cc1)C(=N)c2ccccc2 PB24516 [0,1,0,0,0,0|1,0,0]=2 40 B15R2.2226 c1ccc(cc1)C(c2ccccc2)N PB10011 [0,1,0,0,0,0|1,0,0]=2 41 B15R2.2226 c1ccc(cc1)C(c2ccncc2)N AB25340 [0,1,0,0,0,0|2,0,0]=3 42 B15R2.2226 c1ccc(cc1)C(c2ncccn2)N AB65356 [0,1,0,0,0,0|3,0,0]=4 43 B15R2.2195 c1ccc(cc1)COc2ccncc2 AB43755 [0,0,0,0,0,1|1,0,0]=2 44 B14R2.21 c1cc(nc(c1)N)c2cccnc2 AB51554 [0,1,0,0,1,0|2,0,0]=4 45 B14R2.21 c1ccc(cc1)c2cc(ccn2)N AB09616 [0,1,0,0,1,0|1,0,0]=3 46 B14R2.21 c1ccc(cc1)c2cc(cnc2)N AB17997 [0,1,0,0,1,0|1,0,0]=3 47 B14R2.21 c1ccc(cc1)c2cc(ncn2)Br MB09518 [0,1,0,0,1,0|2,0,0]=4 48 B14R2.21 c1ccc(cc1)c2cccc(n2)Cl AB09567 [0,1,0,0,1,0|1,0,0]=3 49 B14R2.21 c1ccc(cc1)c2cccc(n2)N AB05274 [0,1,0,0,1,0|1,0,0]=3 50 B14R2.21 c1ccc(cc1)c2ccnc(c2)N AB03798 [0,1,0,0,1,0|1,0,0]=3 51 B14R2.21 c1ccc(cc1)c2ccnc(n2)Cl AB05259 [0,1,0,0,1,0|2,0,0]=4 52 B14R2.21 c1ccc(cc1)c2cncc(n2)Br AB64008 [0,1,0,0,1,0|2,0,0]=4 53 B14R2.21 c1ccc(cc1)c2cncc(n2)Cl AB16842 [0,1,0,0,1,0|2,0,0]=4 54 B14R2.21 c1ccc(cc1)c2cncc(n2)N AB60545 [0,1,0,0,1,0|2,0,0]=4 55 B14R2.21 c1ccc(cc1)c2nccc(n2)Br MB01047 [0,1,0,0,1,0|2,0,0]=4 56 B14R2.21 c1ccc(cc1)c2nccc(n2)Cl PB24644 [0,1,0,0,1,0|2,0,0]=4 57 B14R2.21 c1ccc(cc1)c2nccc(n2)O AB05266 [0,1,0,0,1,0|2,0,0]=4 58 B14R2.24 c1ccc(c(c1)c2ccccn2)I AB69253 [0,1,0,0,1,0|1,0,0]=3 59 B14R2.24 c1ccc(c(c1)c2ccccn2)N AB14825 [0,1,0,0,1,0|1,0,0]=3 60 B14R2.24 c1ccc(c(c1)c2ccncc2)N AB27693 [0,1,0,0,1,0|1,0,0]=3 61 B14R2.24 c1ccc(cc1)c2c(cccn2)N AB16242 [0,1,0,0,1,0|1,0,0]=3 62 B14R2.24 c1ccc(cc1)c2c(cccn2)N AB17894 [0,1,0,0,1,0|1,0,0]=3 63 B14R2.24 c1ccc(cc1)c2c(cccn2)O AB06999 [0,1,0,0,1,0|1,0,0]=3 64 B14R2.24 c1ccc(cc1)c2ccccc2I AB01776 [0,1,0,0,1,0|0,0,0]=2 65 B14R2.24 c1ccc(cc1)c2cccnc2N AB17897 [0,1,0,0,1,0|1,0,0]=3 66 B14R2.24 c1ccc(cc1)c2ccncc2N AB18035 [0,1,0,0,1,0|1,0,0]=3 67 B14R2.24 c1ccnc(c1)c2cccc[n+]2[O-] MB00516 [0,1,0,0,1,0|2,0,0]=4 68 B14R2.68 c1cc(ccc1c2ccncc2)Cl AB07793 [0,1,0,0,1,0|1,0,0]=3 69 B14R2.68 c1cc(cnc1)c2ccc(nc2)N AB65318 [0,1,0,0,1,0|2,0,0]=4 70 B14R2.68 c1cc(ncc1c2ccncc2)N AB65321 [0,1,0,0,1,0|2,0,0]=4 71 B14R2.68 c1ccc(cc1)c2ccc(cc2)F AB01065 [0,1,0,0,1,0|0,0,0]=2 72 B14R2.68 c1ccc(cc1)c2ccc(cn2)Br AB17945 [0,1,0,0,1,0|1,0,0]=3 73 B14R2.68 c1ccc(cc1)c2ccc(cn2)F AB62930 [0,1,0,0,1,0|1,0,0]=3 74 B14R2.68 c1ccc(cc1)c2ccc(cn2)N AB17970 [0,1,0,0,1,0|1,0,0]=3 75 B14R2.68 c1ccc(cc1)c2ccc(nc2)Br AB17966 [0,1,0,0,1,0|1,0,0]=3 76 B14R2.68 c1ccc(cc1)c2ccc(nc2)N AB09769 [0,1,0,0,1,0|1,0,0]=3 77 B14R2.68 c1ccc(cc1)c2cnc(cn2)Br AB63082 [0,1,0,0,1,0|2,0,0]=4 78 B14R2.68 c1ccc(cc1)c2cnc(cn2)N AB09615 [0,1,0,0,1,0|2,0,0]=4 79 B14R2.68 c1ccc(cc1)c2cnc(nc2)Cl AB16943 [0,1,0,0,1,0|2,0,0]=4 80 B14R2.68 c1ccc(cc1)c2cnc(nc2)N AB09623 [0,1,0,0,1,0|2,0,0]=4 81 B14R2.68 c1ccc(cc1)c2ncc(cn2)Br AB55842 [0,1,0,0,1,0|2,0,0]=4 82 B14R2.68 c1ccc(cc1)c2ncc(cn2)O AB56445 [0,1,0,0,1,0|2,0,0]=4 83 B14R2.68 c1ccnc(c1)c2ccc(nc2)N AB65317 [0,1,0,0,1,0|2,0,0]=4 84 B14R2.114 c1ccc(cc1)C(=O)c2ccco2 MB00628 [0,1,0,0,1,0|2,0,0]=4 85 B14R2.114 c1ccc(cc1)C(=O)c2ccoc2 MB02020 [0,1,0,0,1,0|2,0,0]=4 86 B14R2.114 c1ccc(cc1)C(=O)c2ccsc2 MB00688 [0,1,0,0,1,0|2,0,0]=4 87 B16R2.71 c1ccc(cc1)COc2c(nccn2)N AB53392 [0,1,0,0,0,1|2,0,0]=4 88 B16R2.71 c1ccc(cc1)COc2ccncc2Br MB09820 [0,1,0,0,0,1|1,0,0]=3 89 B16R2.71 c1ccc(cc1)NCc2ccccc2O MB00415 [0,1,0,0,0,1|1,0,0]=3 90 B16R2.88 c1ccc(cc1)CC(=O)c2ccccn2 AB01371 [0,1,0,0,0,1|2,0,0]=4 91 B16R2.88 c1ccc(cc1)CC(=O)c2cccnc2 AB07823 [0,1,0,0,0,1|2,0,0]=4 92 B16R2.88 c1ccc(cc1)NC(=O)c2cccnc2 MB00323 [0,1,0,0,0,1|2,0,0]=4 93 B16R2.132 Cc1ccc(nc1)OCc2ccccc2 CB11659 [0,1,0,0,0,1|1,0,0]=3 94 B16R2.132 c1ccc(cc1)CNc2ccc(cn2)Br MB03370 [0,1,0,0,0,1|2,0,0]=4 95 B16R2.132 c1ccc(cc1)CNc2ccc(nc2)Br MB14414 [0,1,0,0,0,1|2,0,0]=4 96 B16R2.132 c1ccc(cc1)COc2ccc(nc2)Br MB10387 [0,1,0,0,0,1|1,0,0]=3 97 B16R2.132 c1ccc(cc1)COc2ccc(nn2)Cl MB01120 [0,1,0,0,0,1|2,0,0]=4 98 B16R2.132 c1ccc(cc1)COc2cnc(nc2)Br MB14230 [0,1,0,0,0,1|2,0,0]=4 99 B16R2.132 c1ccc(cc1)COc2cnc(nc2)N AB60174 [0,1,0,0,0,1|2,0,0]=4 100 B16R2.132 c1ccc(cc1)COc2ncc(cn2)Br AB41273 [0,1,0,0,0,1|2,0,0]=4 101 B16R2.132 c1ccnc(c1)COc2ccc(cc2)N CB10817 [0,1,0,0,0,1|1,0,0]=3 102 B16R2.252 c1ccc(cc1)CNc2cc(ccn2)Br MB13924 [0,1,0,0,0,1|2,0,0]=4 103 B16R2.252 c1ccc(cc1)CNc2cc(ccn2)Cl MB10106 [0,1,0,0,0,1|2,0,0]=4 104 B16R2.252 c1ccc(cc1)CNc2cc(cnc2)Br MB13420 [0,1,0,0,0,1|2,0,0]=4 105 B16R2.252 c1ccc(cc1)CNc2cccc(n2)Br MB11430 [0,1,0,0,0,1|2,0,0]=4 106 B16R2.252 c1ccc(cc1)CNc2ccnc(c2)Cl MB13827 [0,1,0,0,0,1|2,0,0]=4 107 B16R2.252 c1ccc(cc1)COc2cc(ccn2)Cl MB13428 [0,1,0,0,0,1|1,0,0]=3 108 B16R2.252 c1ccc(cc1)COc2cc(cnc2)Br AB40925 [0,1,0,0,0,1|1,0,0]=3 109 B16R2.252 c1ccc(cc1)COc2cc(cnc2)N AB59740 [0,1,0,0,0,1|1,0,0]=3 110 B16R2.252 c1ccc(cc1)COc2cc(ncn2)Br MB14175 [0,1,0,0,0,1|2,0,0]=4 111 B16R2.252 c1ccc(cc1)COc2cccc(n2)Br MB01055 [0,1,0,0,0,1|1,0,0]=3 112 B16R2.252 c1ccc(cc1)COc2ccnc(c2)Cl MB10107 [0,1,0,0,0,1|1,0,0]=3 113 B16R2.252 c1ccc(cc1)COc2ccnc(n2)Br MB14171 [0,1,0,0,0,1|2,0,0]=4 114 B16R2.252 c1ccc(cc1)COc2cncc(n2)Cl AB48357 [0,1,0,0,0,1|2,0,0]=4 115 B16R2.252 c1ccc(cc1)COc2cncc(n2)N AB60528 [0,1,0,0,0,1|2,0,0]=4 116 B16R2.252 c1ccc(cc1)COc2nccc(n2)Br MB14068 [0,1,0,0,0,1|2,0,0]=4 117 B16R2.252 c1ccc(cc1)CSc2ccnc(c2)Cl AB64099 [0,1,0,0,0,1|1,1,0]=4 118 B16R2.2 c1cc(cnc1)Oc2ccc(cc2)C=O AB16393 [0,2,0,0,0,0|1,0,0]=3 119 B16R2.2 c1ccc(cc1)Oc2ccc(cc2)NN AB14755 [0,2,0,0,0,0|0,0,0]=2 120 B16R2.2 c1ccc(cc1)Oc2ccc(cn2)C#N AB04770 [0,2,0,0,0,0|1,0,0]=3 121 B16R2.2 c1ccc(cc1)Oc2ncc(cn2)C=O AB58470 [0,2,0,0,0,0|2,0,0]=4 122 B16R2.2 c1ccc(cc1)Oc2ncc(cn2)CN AB58544 [0,2,0,0,0,0|2,0,0]=4 123 B16R2.33 c1cc(ccc1Oc2ccc(cc2)Cl)S AB18101 [0,2,0,0,0,0|0,0,0]=2 124 B16R2.33 c1cc(ccc1Oc2ccc(cc2)S)F AB18103 [0,2,0,0,0,0|0,0,0]=2 125 B16R2.120 c1ccc(cc1)C(c2ccc(cc2)Cl)N CB10161 [0,2,0,0,0,0|1,0,0]=3 126 B16R2.23 CNc1cccc(c1)Oc2ccccc2 AB27892 [0,2,0,0,0,0|0,0,0]=2 127 B16R2.23 c1ccc(cc1)Oc2cccc(c2)NN AB27889 [0,2,0,0,0,0|0,0,0]=2 128 B16R2.23 c1ccc(cc1)Oc2ccnc(n2)CN AB63201 [0,2,0,0,0,0|2,0,0]=4 129 B16R2.236 c1ccc(cc1)C(c2cccc(c2)Cl)O CB10862 [0,2,0,0,0,0|1,0,0]=3 130 B16R2.172 c1ccc(cc1)Oc2ccccc2NN AB20850 [0,2,0,0,0,0|0,0,0]=2 131 B16R2.3896 c1ccc(cc1)C(=O)c2cccnc2Cl AB13818 [0,2,0,0,0,0|2,0,0]=4 132 B16R3.9 c1ccc-2c(c1)CNc3c2cccc3 AB65411 [0,0,0,1,0,1|1,0,0]=3 133 B16R3.2583 c1ccc2=NC3=C(=c2c1)C=C(C=C3)Br AB04973 [0,1,0,1,0,0|1,0,1]=4 134 B16R3.2583 c1ccc2=NC3=C(=c2c1)C=C(C=C3)O AB09191 [0,1,0,1,0,0|1,0,1]=4 135 B16R3.20606 Cn1c2ccccc2c3c1cncc3 CB12106 [0,1,0,1,0,0|2,0,0]=4 136 B12R2.2 c1ccc(cc1)n2cccn2 AB00291 [0,0,0,0,2,0|2,0,0]=4