0 B12R1.27 c1ccc(cc1)COC(=O)CN CB10135 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.28 CNCCCc1ccccc1 AB10671 [1,0,0,0,0,0|1,0,1]=3 2 B11R1.28 c1ccc(cc1)CCCCN AB00942 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.28 c1ccc(cc1)CCCCN AB13248 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.91 B(CCc1ccccc1)(O)O AB09361 [1,0,0,0,0,0|1,0,1]=3 5 B11R1.91 CC(=O)OCc1cccnc1 AB49310 [1,0,0,0,0,0|2,0,0]=3 6 B11R1.91 CC(=O)\C=C\c1ccccc1 CB10061 [1,0,0,0,0,0|0,0,2]=3 7 B11R1.91 c1ccc(cc1)CSC(=N)N AB01105 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.91 c1cnc(nc1)NCC(=O)O AB12962 [1,0,0,0,0,0|3,0,0]=4 9 B13R1.11 COC(=O)C[C@@H](c1ccccc1)N AB43040 [0,1,0,0,0,0|0,0,0]=1 10 B13R1.11 COC(=O)C[C@H](c1ccccc1)N AB43041 [0,1,0,0,0,0|0,0,0]=1 11 B13R1.14 COC(=O)CCc1ccc(cc1)Br AB55324 [0,1,0,0,0,0|0,0,0]=1 12 B13R1.14 COC(=O)\C=C\c1ccc(cc1)Br AB04162 [0,1,0,0,0,0|0,0,2]=3 13 B13R1.15 COC(=O)CCc1cccc(c1)Cl AB18124 [0,1,0,0,0,0|0,0,0]=1 14 B13R1.42 C=CNC(=O)OCc1ccccc1 AB17881 [0,1,0,0,0,0|2,0,1]=4 15 B13R1.135 COC(=O)C(Cc1ccccc1)N AB01980 [0,1,0,0,0,0|0,0,0]=1 16 B13R1.135 COC(=O)[C@H](Cc1ccccc1)N AB01100 [0,1,0,0,0,0|0,0,0]=1 17 B13R2.10 c1ccc(cc1)C2CC(=O)NC2 AB09758 [0,0,0,1,0,0|1,0,0]=2 18 B13R2.10 c1ccc(cc1)C2CCC(=O)C2 AB03360 [0,0,0,1,0,0|1,0,0]=2 19 B13R2.10 c1ccc(cc1)[C@@H]2COC(=S)N2 CB10902 [0,0,0,1,0,0|1,1,0]=3 20 B11R1.25 COC(=O)CCn1cncn1 AB31518 [0,0,0,0,1,0|3,0,0]=4 21 B11R1.40 COC(=N)Cc1ccccc1 AB01554 [0,0,0,0,1,0|1,0,0]=2 22 B11R1.40 COC(=O)Cc1ccccn1 PB18397 [0,0,0,0,1,0|1,0,0]=2 23 B11R1.40 COC(=O)Cc1cccnc1 PB30559 [0,0,0,0,1,0|1,0,0]=2 24 B11R1.40 COC(=O)Cc1cccnn1 PB10290 [0,0,0,0,1,0|2,0,0]=3 25 B11R1.40 COC(=O)Cc1ccncc1 PB12720 [0,0,0,0,1,0|1,0,0]=2 26 B11R1.40 COC(=O)Cc1ccncn1 PB21336 [0,0,0,0,1,0|2,0,0]=3 27 B11R1.40 COC(=O)Cc1ccnnc1 PB28638 [0,0,0,0,1,0|2,0,0]=3 28 B11R1.40 COC(=O)Cc1cnccn1 PB20098 [0,0,0,0,1,0|2,0,0]=3 29 B11R1.40 c1ccc(cc1)CC(=O)C=O AB50241 [0,0,0,0,1,0|2,0,0]=3 30 B13R1.718 COC(=O)COCc1ccccc1 AB63738 [0,0,0,0,0,1|0,0,0]=1 31 B13R1.718 COC(=O)NCCc1ccccc1 AB09088 [0,0,0,0,0,1|0,0,0]=1 32 B13R1.718 c1ccc(cc1)CONC(=O)CN AB24869 [0,0,0,0,0,1|3,0,0]=4 33 B10R1.17 CNCCc1cccnc1 AB10676 [2,0,0,0,0,0|2,0,0]=4 34 B10R1.17 CNCCc1ccncc1 AB02055 [2,0,0,0,0,0|2,0,0]=4 35 B10R1.17 c1c(cncn1)CCC=O AB57646 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.17 c1cc(cnc1)CCC=O AB57626 [2,0,0,0,0,0|1,0,0]=3 37 B10R1.17 c1ccc(cc1)CCC=O AB00823 [2,0,0,0,0,0|0,0,0]=2 38 B10R1.17 c1ccc(cc1)CCCN AB00940 [2,0,0,0,0,0|1,0,1]=4 39 B10R1.17 c1ccnc(c1)CCC=O AB57635 [2,0,0,0,0,0|1,0,0]=3 40 B10R1.17 c1ccnc(c1)CCCO PB12987 [2,0,0,0,0,0|1,0,1]=4 41 B10R1.17 c1cnc(cn1)CCC=O AB57652 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.17 c1cnc(nc1)CCC=O AB57644 [2,0,0,0,0,0|2,0,0]=4 43 B10R1.17 c1cnccc1CCC=O AB49299 [2,0,0,0,0,0|1,0,0]=3 44 B10R1.17 c1cncnc1CCC=O AB57649 [2,0,0,0,0,0|2,0,0]=4 45 B12R1.1 CNCCCc1ccc(cc1)Br AB38786 [1,1,0,0,0,0|1,0,1]=4 46 B12R1.1 CNCCCc1ccc(cc1)Cl AB38779 [1,1,0,0,0,0|1,0,1]=4 47 B12R1.1 CNCCCc1ccc(cc1)F AB38773 [1,1,0,0,0,0|1,0,1]=4 48 B12R1.1 COCCOc1ccc(cc1)O AB19320 [1,1,0,0,0,0|1,0,1]=4 49 B12R1.1 Cc1ccc(cc1)CCCNC AB38761 [1,1,0,0,0,0|1,0,1]=4 50 B12R1.8 c1ccc(cc1)CCCCCN AB07613 [1,1,0,0,0,0|1,0,1]=4 51 B12R1.28 CNCCCc1cccc(c1)Br AB38785 [1,1,0,0,0,0|1,0,1]=4 52 B12R1.28 CNCCCc1cccc(c1)Cl AB38778 [1,1,0,0,0,0|1,0,1]=4 53 B12R1.28 CNCCCc1cccc(c1)F AB38769 [1,1,0,0,0,0|1,0,1]=4 54 B12R1.28 Cc1cccc(c1)CCCNC AB38759 [1,1,0,0,0,0|1,0,1]=4 55 B12R1.30 CNCCC(c1ccccc1)O AB06932 [1,1,0,0,0,0|1,0,1]=4 56 B12R1.267 CNCCCc1ccccc1Br AB38782 [1,1,0,0,0,0|1,0,1]=4 57 B12R1.267 CNCCCc1ccccc1Cl AB38777 [1,1,0,0,0,0|1,0,1]=4 58 B12R1.267 CNCCCc1ccccc1F AB38765 [1,1,0,0,0,0|1,0,1]=4 59 B12R1.267 Cc1ccccc1CCCNC AB38758 [1,1,0,0,0,0|1,0,1]=4 60 B12R1.21 CC(=O)COc1ccc(cc1)Br AB26100 [1,1,0,0,0,0|1,0,0]=3 61 B12R1.21 CC(=O)COc1ccc(cc1)Cl AB26096 [1,1,0,0,0,0|1,0,0]=3 62 B12R1.21 CC(=O)COc1ccc(cc1)F AB26104 [1,1,0,0,0,0|1,0,0]=3 63 B12R1.21 CC(=O)COc1ccc(cc1)I AB26107 [1,1,0,0,0,0|1,0,0]=3 64 B12R1.21 CN(C)CCc1ccc(cc1)N AB18473 [1,1,0,0,0,0|2,0,0]=4 65 B12R1.21 Cc1ccc(cc1)CCC(=O)O AB01198 [1,1,0,0,0,0|0,0,0]=2 66 B12R1.21 Cc1ccc(cc1)OCC(=O)C AB26110 [1,1,0,0,0,0|1,0,0]=3 67 B12R1.21 c1c(ncc(n1)Cl)CCC(=O)O AB69916 [1,1,0,0,0,0|2,0,0]=4 68 B12R1.21 c1cc(ccc1CCC(=O)O)Br AB08447 [1,1,0,0,0,0|0,0,0]=2 69 B12R1.21 c1cc(ccc1CCC(=O)O)Cl AB01196 [1,1,0,0,0,0|0,0,0]=2 70 B12R1.21 c1cc(ccc1CCC(=O)O)F AB02388 [1,1,0,0,0,0|0,0,0]=2 71 B12R1.21 c1cc(ccc1CCC(=O)O)N AB01235 [1,1,0,0,0,0|0,0,0]=2 72 B12R1.21 c1cc(ccc1CCC(=O)O)O AB00269 [1,1,0,0,0,0|0,0,0]=2 73 B12R1.21 c1cc(ccc1OCC(=O)O)Cl AB00355 [1,1,0,0,0,0|1,0,0]=3 74 B12R1.21 c1cc(ccc1\C=C\C(=O)O)Br AB00374 [1,1,0,0,0,0|0,0,2]=4 75 B12R1.21 c1cc(ccc1\C=C\C(=O)O)Cl AB00377 [1,1,0,0,0,0|0,0,2]=4 76 B12R1.21 c1cc(ccc1\C=C\C(=O)O)F AB00375 [1,1,0,0,0,0|0,0,2]=4 77 B12R1.43 c1cc(cnc1)CC(C(=O)O)N AB11720 [1,1,0,0,0,0|1,0,0]=3 78 B12R1.43 c1cc(cnc1)C[C@@H](C(=O)O)N AB03059 [1,1,0,0,0,0|1,0,0]=3 79 B12R1.43 c1cc(cnc1)C[C@H](C(=O)O)N AB03057 [1,1,0,0,0,0|1,0,0]=3 80 B12R1.43 c1cc(cnc1)C[C@H](C(=O)O)N AB13745 [1,1,0,0,0,0|1,0,0]=3 81 B12R1.43 c1ccc(cc1)CC(C(=O)O)N AB02573 [1,1,0,0,0,0|0,0,0]=2 82 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)N AB02575 [1,1,0,0,0,0|0,0,0]=2 83 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)Br AB04813 [1,1,0,0,0,0|0,0,0]=2 84 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)N AB00345 [1,1,0,0,0,0|0,0,0]=2 85 B12R1.43 c1ccnc(c1)CC(C(=O)O)N AB05436 [1,1,0,0,0,0|1,0,0]=3 86 B12R1.43 c1ccnc(c1)C[C@H](C(=O)O)N AB05414 [1,1,0,0,0,0|1,0,0]=3 87 B12R1.43 c1cnccc1CC(C(=O)O)N AB21677 [1,1,0,0,0,0|1,0,0]=3 88 B12R1.43 c1cnccc1C[C@H](C(=O)O)N AB10088 [1,1,0,0,0,0|1,0,0]=3 89 B12R1.107 c1cc(cnc1)C(CC(=O)O)N AB09204 [1,1,0,0,0,0|1,0,0]=3 90 B12R1.107 c1cc(cnc1)[C@@H](CC(=O)O)N AB17754 [1,1,0,0,0,0|1,0,0]=3 91 B12R1.107 c1cc(cnc1)[C@H](CC(=O)O)N AB17820 [1,1,0,0,0,0|1,0,0]=3 92 B12R1.107 c1ccc(cc1)C(CC(=O)O)N AB00922 [1,1,0,0,0,0|0,0,0]=2 93 B12R1.107 c1ccc(cc1)[C@@H](CC(=O)O)N AB08206 [1,1,0,0,0,0|0,0,0]=2 94 B12R1.107 c1ccnc(c1)C(CC(=O)O)N AB23245 [1,1,0,0,0,0|1,0,0]=3 95 B12R1.107 c1ccnc(c1)[C@@H](CC(=O)O)N AB29680 [1,1,0,0,0,0|1,0,0]=3 96 B12R1.107 c1ccnc(c1)[C@H](CC(=O)O)N AB29681 [1,1,0,0,0,0|1,0,0]=3 97 B12R1.107 c1cnccc1C(CC(=O)O)N AB09530 [1,1,0,0,0,0|1,0,0]=3 98 B12R1.107 c1cnccc1[C@@H](CC(=O)O)N AB36081 [1,1,0,0,0,0|1,0,0]=3 99 B12R1.107 c1cnccc1[C@H](CC(=O)O)N AB17832 [1,1,0,0,0,0|1,0,0]=3 100 B12R1.125 c1ccc(c(c1)CCC(=O)O)Br AB08440 [1,1,0,0,0,0|0,0,0]=2 101 B12R1.125 c1ccc(c(c1)CCC(=O)O)Cl AB01190 [1,1,0,0,0,0|0,0,0]=2 102 B12R1.125 c1ccc(c(c1)CCC(=O)O)F AB08452 [1,1,0,0,0,0|0,0,0]=2 103 B12R1.125 c1ccc(c(c1)CCC(=O)O)I MB00406 [1,1,0,0,0,0|0,0,0]=2 104 B12R1.125 c1ccc(c(c1)CCC(=O)O)O MB00231 [1,1,0,0,0,0|0,0,0]=2 105 B12R1.226 CC(=O)COc1cccc(c1)Br AB26134 [1,1,0,0,0,0|1,0,0]=3 106 B12R1.226 CC(=O)COc1cccc(c1)Cl AB26133 [1,1,0,0,0,0|1,0,0]=3 107 B12R1.226 CC(=O)COc1cccc(c1)F AB26135 [1,1,0,0,0,0|1,0,0]=3 108 B12R1.226 CC(=O)NCc1cc(cnc1)Br AB68529 [1,1,0,0,0,0|2,0,0]=4 109 B12R1.226 CC(=O)OCc1cc(ccn1)Br AB65591 [1,1,0,0,0,0|2,0,0]=4 110 B12R1.226 Cc1cccc(c1)CCC(=O)O AB02387 [1,1,0,0,0,0|0,0,0]=2 111 B12R1.226 Cc1cccc(c1)CCC(=O)[O-] AB72171 [1,1,0,0,0,0|0,0,1]=3 112 B12R1.226 Cc1cccc(c1)OCC(=O)C AB26138 [1,1,0,0,0,0|1,0,0]=3 113 B12R1.226 c1cc(cc(c1)Br)CCC(=O)N AB64468 [1,1,0,0,0,0|1,0,0]=3 114 B12R1.226 c1cc(cc(c1)Br)CCC(=O)O AB08444 [1,1,0,0,0,0|0,0,0]=2 115 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O AB08448 [1,1,0,0,0,0|0,0,0]=2 116 B12R1.226 c1cc(cc(c1)Cl)OCC(=O)O AB01185 [1,1,0,0,0,0|1,0,0]=3 117 B12R1.226 c1cc(cc(c1)Cl)\C=C\C(=O)O AB00370 [1,1,0,0,0,0|0,0,2]=4 118 B12R1.226 c1cc(cc(c1)F)CCC(=O)O AB08454 [1,1,0,0,0,0|0,0,0]=2 119 B12R1.891 CC(C)(CCc1ccccc1)N AB03652 [1,1,0,0,0,0|1,0,1]=4 120 B12R1.891 c1ccc(cc1)CCS(=O)(=O)Cl AB20716 [1,1,0,0,0,0|1,0,1]=4 121 B12R1.34 COC(=O)C(c1ccccn1)N CB11313 [0,1,0,0,1,0|1,0,0]=3 122 B12R1.34 COC(=O)[C@@H](c1ccccc1)Br AB70356 [0,1,0,0,1,0|0,0,0]=2 123 B12R1.49 COC(=N)Cc1ccc(cc1)Br AB60928 [0,1,0,0,1,0|1,0,0]=3 124 B12R1.49 COC(=N)Cc1ccc(cc1)Cl AB60925 [0,1,0,0,1,0|1,0,0]=3 125 B12R1.49 COC(=N)Cc1ccc(cc1)F AB60924 [0,1,0,0,1,0|1,0,0]=3 126 B12R1.49 COC(=O)Cc1ccc(cc1)Br PB24610 [0,1,0,0,1,0|0,0,0]=2 127 B12R1.49 COC(=O)Cc1ncc(cn1)Br PB24257 [0,1,0,0,1,0|2,0,0]=4 128 B12R1.49 COC(=O)Nc1ccc(cn1)Br MB01437 [0,1,0,0,1,0|2,0,0]=4 129 B12R1.49 COC(=O)Nc1ccc(nc1)Br MB14348 [0,1,0,0,1,0|2,0,0]=4 130 B12R1.49 Cc1ccc(cc1)CC(=N)OC AB60933 [0,1,0,0,1,0|1,0,0]=3 131 B12R1.50 COC(=N)Cc1cccc(c1)Br AB60935 [0,1,0,0,1,0|1,0,0]=3 132 B12R1.50 COC(=N)Cc1cccc(c1)F AB60943 [0,1,0,0,1,0|1,0,0]=3 133 B12R1.50 COC(=O)Cc1cccc(c1)F CB10636 [0,1,0,0,1,0|0,0,0]=2 134 B12R1.50 COC(=O)Nc1cc(cnc1)Br MB14337 [0,1,0,0,1,0|2,0,0]=4 135 B12R1.50 COC(=O)Nc1cccc(n1)Br MB11682 [0,1,0,0,1,0|2,0,0]=4 136 B12R1.50 COC(=O)Nc1ccnc(c1)Br MB14322 [0,1,0,0,1,0|2,0,0]=4 137 B12R1.50 Cc1cccc(c1)CC(=N)OC AB60932 [0,1,0,0,1,0|1,0,0]=3 138 B12R1.371 COC(=N)Cc1ccccc1Cl AB60946 [0,1,0,0,1,0|1,0,0]=3 139 B12R1.371 COC(=O)Cc1c(cccn1)Br PB23028 [0,1,0,0,1,0|1,0,0]=3 140 B12R1.371 COC(=O)Cc1ccccc1Br AB42488 [0,1,0,0,1,0|0,0,0]=2 141 B12R1.371 COC(=O)Cc1ccccc1N AB21308 [0,1,0,0,1,0|0,0,0]=2 142 B12R1.371 COC(=O)Cc1cccnc1Cl AB76392 [0,1,0,0,1,0|1,0,0]=3 143 B12R1.371 COC(=O)Cc1ccncc1N AB63978 [0,1,0,0,1,0|1,0,0]=3 144 B14R1.520 CCOC(=O)C\N=C\c1ccccc1 AB04772 [0,1,0,0,0,1|0,0,1]=3 145 B14R1.756 CC(C(=O)OC)NCc1ccccc1 AB66346 [0,1,0,0,0,1|0,0,0]=2 146 B14R1.29 CCOC(=O)CC(=O)c1cccnc1 PB14133 [0,2,0,0,0,0|1,0,1]=4 147 B14R1.29 CCOC(=O)CC(=O)c1ccncc1 PB13020 [0,2,0,0,0,0|1,0,1]=4 148 B14R1.134 COC(=O)C(Cc1ccc(cc1)Br)Br AB18059 [0,2,0,0,0,0|0,0,0]=2 149 B14R1.134 COC(=O)[C@@H](Cc1ccc(cc1)N)N AB25031 [0,2,0,0,0,0|0,0,0]=2 150 B14R1.502 CCOC(=O)CCc1ccc(cc1)N MB04702 [0,2,0,0,0,0|0,0,0]=2 151 B14R1.502 CCOC(=O)COc1ccc(cc1)Br AB06130 [0,2,0,0,0,0|1,0,0]=3 152 B14R1.502 CCOC(=O)COc1ccc(cc1)C AB04789 [0,2,0,0,0,0|1,0,0]=3 153 B14R1.502 CCOC(=O)COc1ccc(cc1)Cl AB07801 [0,2,0,0,0,0|1,0,0]=3 154 B14R1.502 CCOC(=O)COc1ccc(cc1)F AB14478 [0,2,0,0,0,0|1,0,0]=3 155 B14R1.502 CCOC(=O)COc1ccc(cc1)I AB26118 [0,2,0,0,0,0|1,0,0]=3 156 B14R1.32 CCOC(=O)COc1cccc(c1)Br AB16880 [0,2,0,0,0,0|1,0,0]=3 157 B14R1.32 CCOC(=O)COc1cccc(c1)C AB08349 [0,2,0,0,0,0|1,0,0]=3 158 B14R1.32 CCOC(=O)COc1cccc(c1)Cl AB22457 [0,2,0,0,0,0|1,0,0]=3 159 B14R1.32 CCOC(=O)COc1cccc(c1)F AB26126 [0,2,0,0,0,0|1,0,0]=3 160 B14R1.32 CCOC(=O)COc1cccc(c1)I AB26123 [0,2,0,0,0,0|1,0,0]=3 161 B14R1.60 CCOC(=O)C(Cc1ccccn1)N AB21681 [0,2,0,0,0,0|1,0,0]=3 162 B14R1.156 C#CCNC(=O)OCc1ccccc1 AB61413 [0,2,0,0,0,0|2,0,0]=4 163 B14R1.156 c1ccc(cc1)COC(=O)NCC#N AB01537 [0,2,0,0,0,0|2,0,0]=4 164 B14R1.156 c1ccc(cc1)COC(=O)NCCI AB55270 [0,2,0,0,0,0|2,0,0]=4 165 B14R1.1031 COC(=O)[C@@H](Cc1ccccc1)CN MB69440 [0,2,0,0,0,0|0,0,0]=2 166 B12R2.1 CNC1CCc2c1cccc2 AB49601 [1,0,0,1,0,0|1,0,1]=4 167 B12R2.2 c1ccc(cc1)C2CCNC2 AB09982 [1,0,0,1,0,0|1,0,1]=4 168 B12R2.2 c1ccc(cc1)[C@@H]2CCNC2 AB29529 [1,0,0,1,0,0|1,0,1]=4 169 B12R2.2 c1ccc(cc1)[C@H]2CCNC2 AB29532 [1,0,0,1,0,0|1,0,1]=4 170 B12R2.41 c1ccc2c(c1)CCCNC2 AB49623 [1,0,0,1,0,0|1,0,1]=4 171 B12R2.41 c1ccc2c(c1)CCNCC2 AB16913 [1,0,0,1,0,0|2,0,0]=4 172 B12R2.41 c1ccc2c(c1)CCNCC2 PB31022 [1,0,0,1,0,0|2,0,0]=4 173 B12R2.41 c1ccc2c(c1)COCCN2 AB62713 [1,0,0,1,0,0|1,0,1]=4 174 B12R2.1081 CC1c2ccccc2CCN1 AB07224 [1,0,0,1,0,0|2,0,0]=4 175 B12R2.22 c1ccc(cc1)C2CC(=O)C2 PB26115 [1,0,0,1,0,0|0,0,0]=2 176 B12R2.22 c1ccc(cc1)C2CC(=O)N2 AB10995 [1,0,0,1,0,0|1,0,0]=3 177 B12R2.22 c1ccc(cc1)C2CC(C2)N PB19234 [1,0,0,1,0,0|1,0,1]=4 178 B12R2.22 c1ccc(cc1)[C@H]2C[C@@H](C2)N PB38990 [1,0,0,1,0,0|1,0,1]=4 179 B12R2.22 c1ccc(cc1)[C@H]2C[C@H](C2)N PB38200 [1,0,0,1,0,0|1,0,1]=4 180 B12R2.24 c1c2c(ncn1)CC(=O)CC2 AB61058 [1,0,0,1,0,0|2,0,0]=4 181 B12R2.24 c1c2c(ncn1)CCC(=O)C2 AB45338 [1,0,0,1,0,0|2,0,0]=4 182 B12R2.24 c1cc2c(nc1)CC(=O)NC2 AB77257 [1,0,0,1,0,0|2,0,0]=4 183 B12R2.24 c1cc2c(nc1)CCC(=O)C2 AB26260 [1,0,0,1,0,0|1,0,0]=3 184 B12R2.24 c1cc2c(nc1)NC(=O)CC2 PB12351 [1,0,0,1,0,0|2,0,0]=4 185 B12R2.24 c1cc2c(nc1)OCC(=O)C2 AB74015 [1,0,0,1,0,0|2,0,0]=4 186 B12R2.24 c1ccc2c(c1)CC(=O)NC2 AB15535 [1,0,0,1,0,0|1,0,0]=3 187 B12R2.24 c1ccc2c(c1)CCC(C2)N AB02010 [1,0,0,1,0,0|1,0,1]=4 188 B12R2.24 c1ccc2c(c1)CCN(C2)N MB00779 [1,0,0,1,0,0|2,0,0]=4 189 B12R2.24 c1ccc2c(c1)NC(=O)CO2 AB04166 [1,0,0,1,0,0|2,0,0]=4 190 B12R2.24 c1ccc2c(c1)NCC(=O)N2 AB04744 [1,0,0,1,0,0|2,0,0]=4 191 B12R2.24 c1cncc2c1CC(=O)NC2 AB64881 [1,0,0,1,0,0|2,0,0]=4 192 B12R2.24 c1cncc2c1CCC(=O)N2 MB05928 [1,0,0,1,0,0|2,0,0]=4 193 B12R2.24 c1cncc2c1CNC(=O)C2 AB68337 [1,0,0,1,0,0|2,0,0]=4 194 B12R2.24 c1cncc2c1NC(=O)CC2 MB05707 [1,0,0,1,0,0|2,0,0]=4 195 B14R2.19 c1ccc(cc1)CN2CCC(=O)C2 PB19844 [0,0,0,1,0,1|1,0,0]=3 196 B14R2.68 c1ccc(cc1)C2CNC(=O)CN2 AB37265 [0,0,0,1,0,1|1,0,0]=3 197 B14R2.68 c1ccc(cc1)C2CNC(=O)CO2 AB42561 [0,0,0,1,0,1|1,0,0]=3 198 B14R2.68 c1ccc(cc1)N2CCC(=O)CC2 AB31242 [0,0,0,1,0,1|1,0,0]=3 199 B14R2.68 c1ccc(cc1)[C@@H]2CNC(=O)CN2 AB37270 [0,0,0,1,0,1|1,0,0]=3 200 B14R2.68 c1ccc(cc1)[C@@H]2COC(=O)CN2 MB01107 [0,0,0,1,0,1|0,0,0]=2 201 B14R2.68 c1ccc(cc1)[C@H]2CNC(=O)CN2 AB37268 [0,0,0,1,0,1|1,0,0]=3 202 B14R2.68 c1ccc(cc1)[C@H]2COC(=O)CN2 AB05536 [0,0,0,1,0,1|0,0,0]=2 203 B14R2.95 COC(=O)C1=c2cccnc2=NC1 PB14761 [0,0,0,1,0,1|1,0,1]=4 204 B14R2.95 COC(=O)C1CCc2c1cccc2 AB07839 [0,0,0,1,0,1|0,0,0]=2 205 B14R2.4514 CN1[C@@H](CCC1=O)c2cccnc2 PB32127 [0,0,0,1,0,1|2,0,0]=4 206 B14R2.21 c1ccc(cc1)C2CCCC(=O)C2 AB04809 [0,1,0,1,0,0|1,0,0]=3 207 B14R2.21 c1ccc(cc1)C2CNCC(=O)N2 AB37355 [0,1,0,1,0,0|2,0,0]=4 208 B14R2.21 c1ccc(cc1)C2CNCC(=O)O2 AB72680 [0,1,0,1,0,0|2,0,0]=4 209 B14R2.21 c1ccc(cc1)C2COCC(=O)N2 AB72681 [0,1,0,1,0,0|1,0,0]=3 210 B14R2.21 c1ccc(cc1)[C@@H]2CNCC(=O)N2 AB37361 [0,1,0,1,0,0|2,0,0]=4 211 B14R2.21 c1ccc(cc1)[C@H]2CNCC(=O)N2 AB37359 [0,1,0,1,0,0|2,0,0]=4 212 B14R2.20 Cc1ccc(cc1)C2CCC(=O)C2 AB26347 [0,1,0,1,0,0|1,0,0]=3 213 B14R2.20 c1cc(ccc1C2CCC(=O)C2)Br AB26346 [0,1,0,1,0,0|1,0,0]=3 214 B14R2.20 c1cc(ccc1C2CCC(=O)C2)Cl AB26349 [0,1,0,1,0,0|1,0,0]=3 215 B14R2.20 c1cc(ccc1C2CCC(=O)C2)F AB26352 [0,1,0,1,0,0|1,0,0]=3 216 B14R2.20 c1cc(ccc1C2CCC(=O)N2)Cl CB11852 [0,1,0,1,0,0|2,0,0]=4 217 B14R2.29369 CN1c2ccc(cc2CCC1=O)Br PB13814 [0,1,0,1,0,0|1,0,0]=3 218 B14R2.30 c1ccc(cc1)CN2CCCC2=O AB00299 [0,1,0,1,0,0|2,0,0]=4 219 B14R2.93 c1ccc2c(c1)CCN(CC2)C=O AB50388 [0,1,0,1,0,0|2,0,0]=4 220 B14R3.630 c1ccc2c(c1)C[C@@H]3[C@H]2NC3=O AB49806 [0,0,0,2,0,0|1,0,0]=3 221 B10R1.18 B(Cc1ccccc1)(O)O AB08328 [1,0,0,0,1,0|1,0,1]=4 222 B10R1.18 CC(=O)Cc1ccccn1 AB03323 [1,0,0,0,1,0|1,0,0]=3 223 B10R1.18 CC(=O)Cc1cccnc1 AB29343 [1,0,0,0,1,0|1,0,0]=3 224 B10R1.18 CC(=O)Cc1cccnc1 AB45525 [1,0,0,0,1,0|1,0,0]=3 225 B10R1.18 CC(=O)Cc1ncccn1 MB07248 [1,0,0,0,1,0|2,0,0]=4 226 B10R1.18 CC(=O)Nc1ccncc1 AB06982 [1,0,0,0,1,0|2,0,0]=4 227 B10R1.18 C[C@@H](Cc1ccccc1)N AB03711 [1,0,0,0,1,0|1,0,1]=4 228 B10R1.18 C[C@H](Cc1ccccc1)N AB07478 [1,0,0,0,1,0|1,0,1]=4 229 B10R1.18 c1c(cncn1)CC(=O)O PB12648 [1,0,0,0,1,0|2,0,0]=4 230 B10R1.18 c1cc(cnc1)CC(=O)O AB01106 [1,0,0,0,1,0|1,0,0]=3 231 B10R1.18 c1cc(nnc1)CC(=O)O PB14847 [1,0,0,0,1,0|2,0,0]=4 232 B10R1.18 c1ccc(cc1)CC(=N)N AB29087 [1,0,0,0,1,0|2,0,0]=4 233 B10R1.18 c1cnc(cn1)CC(=O)O PB10382 [1,0,0,0,1,0|2,0,0]=4 234 B10R1.18 c1cnc(nc1)CC(=O)O PB34087 [1,0,0,0,1,0|2,0,0]=4 235 B10R1.18 c1cncnc1CC(=O)O PB21983 [1,0,0,0,1,0|2,0,0]=4 236 B10R1.18 c1cnncc1CC(=O)O PB31426 [1,0,0,0,1,0|2,0,0]=4 237 B10R1.66 C1C=CN=C1CCC(=O)O CB11077 [1,0,0,0,1,0|1,0,1]=4 238 B10R1.66 c1cn(cn1)CCC(=O)O AB12684 [1,0,0,0,1,0|2,0,0]=4 239 B10R1.27 COC(=O)Cc1ccsc1 PB15626 [0,0,0,0,2,0|1,0,0]=3 240 B10R1.15 CCC(=O)c1ccccn1 AB01373 [0,0,0,0,2,0|2,0,0]=4 241 B10R1.15 COC(=O)c1cccnn1 PB28168 [0,0,0,0,2,0|2,0,0]=4 242 B10R1.15 COC(=O)c1ccncn1 PB15680 [0,0,0,0,2,0|2,0,0]=4 243 B10R1.15 COC(=O)c1ccnnc1 PB31452 [0,0,0,0,2,0|2,0,0]=4 244 B10R1.15 COC(=O)c1cncnc1 PB15822 [0,0,0,0,2,0|2,0,0]=4 245 B10R1.15 COC(=O)c1ncccn1 PB20045 [0,0,0,0,2,0|2,0,0]=4 246 B10R1.15 c1ccc(cc1)C(=O)C=O AB00817 [0,0,0,0,2,0|2,0,0]=4 247 B10R1.15 c1ccc(cc1)C(=O)C=O AB03966 [0,0,0,0,2,0|2,0,0]=4 248 B10R1.15 c1ccc(cc1)C(=O)NN AB00887 [0,0,0,0,2,0|2,0,0]=4