0 B12R1.252 c1ccc(cc1)CNCC(=O)O AB04524 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.252 c1ccc(cc1)COCC(=O)Cl CB10078 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.252 c1ccc(cc1)COCC(=O)O CB10355 [0,0,0,0,0,0|3,0,0]=3 3 B12R1.252 c1ccc(cc1)NCCC(=O)N MB02383 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.252 c1ccc(cc1)NCCC(=O)O MB00619 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.252 c1ccc(cc1)OCCC(=O)O AB00261 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.28 CNCCCc1ccccc1 AB10671 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.28 c1ccc(cc1)CCCCN AB00942 [1,0,0,0,0,0|2,0,1]=4 8 B11R1.28 c1ccc(cc1)CCCCN AB13248 [1,0,0,0,0,0|2,0,1]=4 9 B13R1.45 CN(C)CCC(c1ccccc1)O AB03278 [0,1,0,0,0,0|3,0,0]=4 10 B13R1.149 c1cc(cc(c1)Cl)OCCC(=O)O AB03979 [0,1,0,0,0,0|3,0,0]=4 11 B13R1.158 c1ccc(c(c1)NCCC(=O)O)Br AB52820 [0,1,0,0,0,0|3,0,0]=4 12 B13R1.158 c1ccc(c(c1)NCCC(=O)O)Cl AB07374 [0,1,0,0,0,0|3,0,0]=4 13 B13R1.158 c1ccc(c(c1)NCCC(=O)O)I AB44265 [0,1,0,0,0,0|3,0,0]=4 14 B13R1.351 c1cc(cnc1)CCC(C(=O)O)N AB21175 [0,1,0,0,0,0|3,0,0]=4 15 B13R1.351 c1cc(cnc1)CC[C@@H](C(=O)O)N AB34696 [0,1,0,0,0,0|3,0,0]=4 16 B13R1.351 c1cc(cnc1)CC[C@H](C(=O)O)N AB34692 [0,1,0,0,0,0|3,0,0]=4 17 B13R1.351 c1ccc(cc1)CCC(C(=O)O)N AB02512 [0,1,0,0,0,0|2,0,0]=3 18 B13R1.351 c1ccc(cc1)CC[C@@H](C(=O)O)N AB00246 [0,1,0,0,0,0|2,0,0]=3 19 B13R1.351 c1ccnc(c1)CCC(C(=O)O)N AB34675 [0,1,0,0,0,0|3,0,0]=4 20 B13R1.351 c1ccnc(c1)CC[C@@H](C(=O)O)N AB34679 [0,1,0,0,0,0|3,0,0]=4 21 B13R1.351 c1ccnc(c1)CC[C@H](C(=O)O)N AB34678 [0,1,0,0,0,0|3,0,0]=4 22 B13R1.351 c1cnccc1CCC(C(=O)O)N AB34710 [0,1,0,0,0,0|3,0,0]=4 23 B13R1.351 c1cnccc1CC[C@@H](C(=O)O)N AB34714 [0,1,0,0,0,0|3,0,0]=4 24 B13R1.351 c1cnccc1CC[C@H](C(=O)O)N AB34713 [0,1,0,0,0,0|3,0,0]=4 25 B13R1.513 CC(=O)OCCc1ccc(cc1)O AB51485 [0,1,0,0,0,0|0,0,0]=1 26 B13R1.513 c1cc(ccc1CCCC(=O)O)Br MB01227 [0,1,0,0,0,0|2,0,0]=3 27 B13R1.513 c1cc(ccc1NCCC(=O)O)Br AB51540 [0,1,0,0,0,0|3,0,0]=4 28 B13R1.513 c1cc(ccc1NCCC(=O)O)Cl AB07378 [0,1,0,0,0,0|3,0,0]=4 29 B13R1.513 c1cc(ccc1NCCC(=O)O)I AB52822 [0,1,0,0,0,0|3,0,0]=4 30 B13R1.718 COC(=O)COCc1ccccc1 AB63738 [0,1,0,0,0,0|2,0,0]=3 31 B13R1.718 COC(=O)NCCc1ccccc1 AB09088 [0,1,0,0,0,0|1,0,0]=2 32 B13R1.718 c1ccc(cc1)CONC(=O)CN AB24869 [0,1,0,0,0,0|2,0,0]=3 33 B13R1.3523 c1ccc(cc1)CCCS(=O)(=O)Cl AB28174 [0,1,0,0,0,0|3,0,0]=4 34 B13R2.10 c1ccc(cc1)C2CC(=O)NC2 AB09758 [0,0,0,1,0,0|1,0,0]=2 35 B13R2.10 c1ccc(cc1)C2CCC(=O)C2 AB03360 [0,0,0,1,0,0|1,0,0]=2 36 B13R2.10 c1ccc(cc1)[C@@H]2COC(=S)N2 CB10902 [0,0,0,1,0,0|1,1,0]=3 37 B13R2.72 CC(=O)C1=c2ccccc2=NC1 AB00460 [0,0,0,1,0,0|2,0,0]=3 38 B13R2.72 CC(=O)C1=c2cccnc2=NC1 PB29657 [0,0,0,1,0,0|3,0,0]=4 39 B13R2.72 CC(=O)n1c2ccccc2cn1 MB14951 [0,0,0,1,0,0|2,0,1]=4 40 B13R2.72 c1ccc2c(c1)C(CN2)C(=O)O AB16477 [0,0,0,1,0,0|3,0,0]=4 41 B13R2.72 c1ccc2c(c1)C(CO2)C(=O)O AB45862 [0,0,0,1,0,0|3,0,0]=4 42 B13R2.72 c1ccc2c(c1)CCC2C(=O)O AB01304 [0,0,0,1,0,0|2,0,0]=3 43 B13R2.72 c1ccc2c(c1)CNC2C(=O)O AB08706 [0,0,0,1,0,0|3,0,0]=4 44 B13R2.163 c1ccc2c(c1)CCNC(=O)C2 MB01179 [0,0,0,1,0,0|1,0,0]=2 45 B13R2.163 c1ccc2c(c1)CCNC(=O)N2 AB65832 [0,0,0,1,0,0|2,0,0]=3 46 B13R2.3122 CC1(c2ccccc2CCN1)C AB62583 [0,0,0,1,0,0|2,0,1]=4 47 B11R1.91 B(CCc1ccccc1)(O)O AB09361 [0,0,0,0,1,0|2,0,1]=4 48 B11R1.91 CC(=O)OCc1cccnc1 AB49310 [0,0,0,0,1,0|1,0,0]=2 49 B11R1.91 CC(=O)\C=C\c1ccccc1 CB10061 [0,0,0,0,1,0|0,0,2]=3 50 B11R1.91 c1ccc(cc1)CSC(=N)N AB01105 [0,0,0,0,1,0|2,1,0]=4 51 B11R1.172 CC(=O)NCCn1cccc1 AB04419 [0,0,0,0,1,0|2,0,0]=3 52 B13R1.337 c1ccc(cc1)NCCCC(=O)O AB55233 [0,0,0,0,0,1|2,0,0]=3 53 B10R1.17 CNCCc1cccnc1 AB10676 [2,0,0,0,0,0|2,0,0]=4 54 B10R1.17 CNCCc1ccncc1 AB02055 [2,0,0,0,0,0|2,0,0]=4 55 B10R1.17 c1c(cncn1)CCC=O AB57646 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.17 c1cc(cnc1)CCC=O AB57626 [2,0,0,0,0,0|1,0,0]=3 57 B10R1.17 c1ccc(cc1)CCC=O AB00823 [2,0,0,0,0,0|0,0,0]=2 58 B10R1.17 c1ccc(cc1)CCCN AB00940 [2,0,0,0,0,0|1,0,1]=4 59 B10R1.17 c1ccnc(c1)CCC=O AB57635 [2,0,0,0,0,0|1,0,0]=3 60 B10R1.17 c1cnc(cn1)CCC=O AB57652 [2,0,0,0,0,0|2,0,0]=4 61 B10R1.17 c1cnc(nc1)CCC=O AB57644 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.17 c1cnccc1CCC=O AB49299 [2,0,0,0,0,0|1,0,0]=3 63 B10R1.17 c1cncnc1CCC=O AB57649 [2,0,0,0,0,0|2,0,0]=4 64 B12R1.1 CNCCCc1ccc(cc1)Br AB38786 [1,1,0,0,0,0|2,0,0]=4 65 B12R1.1 CNCCCc1ccc(cc1)Cl AB38779 [1,1,0,0,0,0|2,0,0]=4 66 B12R1.1 CNCCCc1ccc(cc1)F AB38773 [1,1,0,0,0,0|2,0,0]=4 67 B12R1.1 Cc1ccc(cc1)CCCNC AB38761 [1,1,0,0,0,0|2,0,0]=4 68 B12R1.8 c1ccc(cc1)CCCCCN AB07613 [1,1,0,0,0,0|1,0,1]=4 69 B12R1.28 CNCCCc1cccc(c1)Br AB38785 [1,1,0,0,0,0|2,0,0]=4 70 B12R1.28 CNCCCc1cccc(c1)Cl AB38778 [1,1,0,0,0,0|2,0,0]=4 71 B12R1.28 CNCCCc1cccc(c1)F AB38769 [1,1,0,0,0,0|2,0,0]=4 72 B12R1.28 Cc1cccc(c1)CCCNC AB38759 [1,1,0,0,0,0|2,0,0]=4 73 B12R1.30 CNCCC(c1ccccc1)O AB06932 [1,1,0,0,0,0|2,0,0]=4 74 B12R1.267 CNCCCc1ccccc1Br AB38782 [1,1,0,0,0,0|2,0,0]=4 75 B12R1.267 CNCCCc1ccccc1Cl AB38777 [1,1,0,0,0,0|2,0,0]=4 76 B12R1.267 CNCCCc1ccccc1F AB38765 [1,1,0,0,0,0|2,0,0]=4 77 B12R1.267 Cc1ccccc1CCCNC AB38758 [1,1,0,0,0,0|2,0,0]=4 78 B12R1.21 CC(=O)COc1ccc(cc1)Br AB26100 [0,1,0,0,1,0|1,0,0]=3 79 B12R1.21 CC(=O)COc1ccc(cc1)Cl AB26096 [0,1,0,0,1,0|1,0,0]=3 80 B12R1.21 CC(=O)COc1ccc(cc1)F AB26104 [0,1,0,0,1,0|1,0,0]=3 81 B12R1.21 CC(=O)COc1ccc(cc1)I AB26107 [0,1,0,0,1,0|1,0,0]=3 82 B12R1.21 CN(C)CCc1ccc(cc1)N AB18473 [0,1,0,0,1,0|2,0,0]=4 83 B12R1.21 Cc1ccc(cc1)CCC(=O)O AB01198 [0,1,0,0,1,0|1,0,0]=3 84 B12R1.21 Cc1ccc(cc1)OCC(=O)C AB26110 [0,1,0,0,1,0|1,0,0]=3 85 B12R1.21 c1cc(ccc1CCC(=O)O)Br AB08447 [0,1,0,0,1,0|1,0,0]=3 86 B12R1.21 c1cc(ccc1CCC(=O)O)Cl AB01196 [0,1,0,0,1,0|1,0,0]=3 87 B12R1.21 c1cc(ccc1CCC(=O)O)F AB02388 [0,1,0,0,1,0|1,0,0]=3 88 B12R1.21 c1cc(ccc1CCC(=O)O)N AB01235 [0,1,0,0,1,0|1,0,0]=3 89 B12R1.21 c1cc(ccc1CCC(=O)O)O AB00269 [0,1,0,0,1,0|1,0,0]=3 90 B12R1.21 c1cc(ccc1OCC(=O)O)Cl AB00355 [0,1,0,0,1,0|2,0,0]=4 91 B12R1.43 c1cc(cnc1)CC(C(=O)O)N AB11720 [0,1,0,0,1,0|2,0,0]=4 92 B12R1.43 c1cc(cnc1)C[C@@H](C(=O)O)N AB03059 [0,1,0,0,1,0|2,0,0]=4 93 B12R1.43 c1cc(cnc1)C[C@H](C(=O)O)N AB03057 [0,1,0,0,1,0|2,0,0]=4 94 B12R1.43 c1cc(cnc1)C[C@H](C(=O)O)N AB13745 [0,1,0,0,1,0|2,0,0]=4 95 B12R1.43 c1ccc(cc1)CC(C(=O)O)N AB02573 [0,1,0,0,1,0|1,0,0]=3 96 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)N AB02575 [0,1,0,0,1,0|1,0,0]=3 97 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)Br AB04813 [0,1,0,0,1,0|1,0,0]=3 98 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)N AB00345 [0,1,0,0,1,0|1,0,0]=3 99 B12R1.43 c1ccnc(c1)CC(C(=O)O)N AB05436 [0,1,0,0,1,0|2,0,0]=4 100 B12R1.43 c1ccnc(c1)C[C@H](C(=O)O)N AB05414 [0,1,0,0,1,0|2,0,0]=4 101 B12R1.43 c1cnccc1CC(C(=O)O)N AB21677 [0,1,0,0,1,0|2,0,0]=4 102 B12R1.43 c1cnccc1C[C@H](C(=O)O)N AB10088 [0,1,0,0,1,0|2,0,0]=4 103 B12R1.107 c1cc(cnc1)C(CC(=O)O)N AB09204 [0,1,0,0,1,0|2,0,0]=4 104 B12R1.107 c1cc(cnc1)[C@@H](CC(=O)O)N AB17754 [0,1,0,0,1,0|2,0,0]=4 105 B12R1.107 c1cc(cnc1)[C@H](CC(=O)O)N AB17820 [0,1,0,0,1,0|2,0,0]=4 106 B12R1.107 c1ccc(cc1)C(CC(=O)O)N AB00922 [0,1,0,0,1,0|1,0,0]=3 107 B12R1.107 c1ccc(cc1)[C@@H](CC(=O)O)N AB08206 [0,1,0,0,1,0|1,0,0]=3 108 B12R1.107 c1ccnc(c1)C(CC(=O)O)N AB23245 [0,1,0,0,1,0|2,0,0]=4 109 B12R1.107 c1ccnc(c1)[C@@H](CC(=O)O)N AB29680 [0,1,0,0,1,0|2,0,0]=4 110 B12R1.107 c1ccnc(c1)[C@H](CC(=O)O)N AB29681 [0,1,0,0,1,0|2,0,0]=4 111 B12R1.107 c1cnccc1C(CC(=O)O)N AB09530 [0,1,0,0,1,0|2,0,0]=4 112 B12R1.107 c1cnccc1[C@@H](CC(=O)O)N AB36081 [0,1,0,0,1,0|2,0,0]=4 113 B12R1.107 c1cnccc1[C@H](CC(=O)O)N AB17832 [0,1,0,0,1,0|2,0,0]=4 114 B12R1.125 c1ccc(c(c1)CCC(=O)O)Br AB08440 [0,1,0,0,1,0|1,0,0]=3 115 B12R1.125 c1ccc(c(c1)CCC(=O)O)Cl AB01190 [0,1,0,0,1,0|1,0,0]=3 116 B12R1.125 c1ccc(c(c1)CCC(=O)O)F AB08452 [0,1,0,0,1,0|1,0,0]=3 117 B12R1.125 c1ccc(c(c1)CCC(=O)O)I MB00406 [0,1,0,0,1,0|1,0,0]=3 118 B12R1.125 c1ccc(c(c1)CCC(=O)O)O MB00231 [0,1,0,0,1,0|1,0,0]=3 119 B12R1.226 CC(=O)COc1cccc(c1)Br AB26134 [0,1,0,0,1,0|1,0,0]=3 120 B12R1.226 CC(=O)COc1cccc(c1)Cl AB26133 [0,1,0,0,1,0|1,0,0]=3 121 B12R1.226 CC(=O)COc1cccc(c1)F AB26135 [0,1,0,0,1,0|1,0,0]=3 122 B12R1.226 CC(=O)NCc1cc(cnc1)Br AB68529 [0,1,0,0,1,0|2,0,0]=4 123 B12R1.226 CC(=O)OCc1cc(ccn1)Br AB65591 [0,1,0,0,1,0|1,0,0]=3 124 B12R1.226 Cc1cccc(c1)CCC(=O)O AB02387 [0,1,0,0,1,0|1,0,0]=3 125 B12R1.226 Cc1cccc(c1)CCC(=O)[O-] AB72171 [0,1,0,0,1,0|1,0,0]=3 126 B12R1.226 Cc1cccc(c1)OCC(=O)C AB26138 [0,1,0,0,1,0|1,0,0]=3 127 B12R1.226 c1cc(cc(c1)Br)CCC(=O)N AB64468 [0,1,0,0,1,0|1,0,0]=3 128 B12R1.226 c1cc(cc(c1)Br)CCC(=O)O AB08444 [0,1,0,0,1,0|1,0,0]=3 129 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O AB08448 [0,1,0,0,1,0|1,0,0]=3 130 B12R1.226 c1cc(cc(c1)Cl)OCC(=O)O AB01185 [0,1,0,0,1,0|2,0,0]=4 131 B12R1.226 c1cc(cc(c1)F)CCC(=O)O AB08454 [0,1,0,0,1,0|1,0,0]=3 132 B12R1.891 CC(C)(CCc1ccccc1)N AB03652 [0,1,0,0,1,0|1,0,1]=4 133 B12R1.891 c1ccc(cc1)CCS(=O)(=O)Cl AB20716 [0,1,0,0,1,0|2,0,0]=4 134 B14R1.148 c1cc(cc(c1)Cl)OCCCC(=O)O AB18091 [0,1,0,0,0,1|2,0,0]=4 135 B14R1.818 c1ccc(cc1)CCC(CC(=O)O)N AB08760 [0,1,0,0,0,1|2,0,0]=4 136 B14R1.6449 c1ccc(cc1)CCC[C@H](C(=O)O)N AB16792 [0,1,0,0,0,1|2,0,0]=4 137 B14R1.160 CC(=O)ONC(=O)c1ccccc1O AB22745 [0,2,0,0,0,0|1,0,1]=4 138 B14R1.678 CC(=O)OCC(=O)c1ccc(cc1)F AB49706 [0,2,0,0,0,0|0,0,1]=3 139 B14R1.5956 Cc1cccc(c1)CCC(C(=O)O)N AB33758 [0,2,0,0,0,0|2,0,0]=4 140 B14R1.5956 Cc1cccc(c1)CC[C@@H](C(=O)O)N AB33764 [0,2,0,0,0,0|2,0,0]=4 141 B14R1.5956 Cc1cccc(c1)CC[C@H](C(=O)O)N AB33761 [0,2,0,0,0,0|2,0,0]=4 142 B14R1.5956 c1cc(cc(c1)Br)CCC(C(=O)O)N AB33961 [0,2,0,0,0,0|2,0,0]=4 143 B14R1.5956 c1cc(cc(c1)Br)CC[C@@H](C(=O)O)N AB33964 [0,2,0,0,0,0|2,0,0]=4 144 B14R1.5956 c1cc(cc(c1)Br)CC[C@H](C(=O)O)N AB33963 [0,2,0,0,0,0|2,0,0]=4 145 B14R1.5956 c1cc(cc(c1)Cl)CCC(C(=O)O)N AB33907 [0,2,0,0,0,0|2,0,0]=4 146 B14R1.5956 c1cc(cc(c1)Cl)CC[C@@H](C(=O)O)N AB33910 [0,2,0,0,0,0|2,0,0]=4 147 B14R1.5956 c1cc(cc(c1)Cl)CC[C@H](C(=O)O)N AB33908 [0,2,0,0,0,0|2,0,0]=4 148 B14R1.5956 c1cc(cc(c1)F)CCC(C(=O)O)N AB33866 [0,2,0,0,0,0|2,0,0]=4 149 B14R1.5956 c1cc(cc(c1)F)CC[C@@H](C(=O)O)N AB33870 [0,2,0,0,0,0|2,0,0]=4 150 B14R1.5956 c1cc(cc(c1)F)CC[C@H](C(=O)O)N AB33867 [0,2,0,0,0,0|2,0,0]=4 151 B14R1.5956 c1cc(cc(c1)O)CCC(C(=O)O)N AB34006 [0,2,0,0,0,0|2,0,0]=4 152 B14R1.5956 c1cc(cc(c1)O)CC[C@@H](C(=O)O)N AB34011 [0,2,0,0,0,0|2,0,0]=4 153 B14R1.5956 c1cc(cc(c1)O)CC[C@H](C(=O)O)N AB34008 [0,2,0,0,0,0|2,0,0]=4 154 B14R1.161 Cc1ccccc1CCC(C(=O)O)N AB33742 [0,2,0,0,0,0|2,0,0]=4 155 B14R1.161 Cc1ccccc1CC[C@@H](C(=O)O)N AB33748 [0,2,0,0,0,0|2,0,0]=4 156 B14R1.161 Cc1ccccc1CC[C@H](C(=O)O)N AB33744 [0,2,0,0,0,0|2,0,0]=4 157 B14R1.161 c1ccc(c(c1)CCC(C(=O)O)N)Br AB33943 [0,2,0,0,0,0|2,0,0]=4 158 B14R1.161 c1ccc(c(c1)CCC(C(=O)O)N)Cl AB33890 [0,2,0,0,0,0|2,0,0]=4 159 B14R1.161 c1ccc(c(c1)CCC(C(=O)O)N)F AB33850 [0,2,0,0,0,0|2,0,0]=4 160 B14R1.161 c1ccc(c(c1)CCC(C(=O)O)N)O AB33992 [0,2,0,0,0,0|2,0,0]=4 161 B14R1.161 c1ccc(c(c1)CC[C@@H](C(=O)O)N)Br AB33947 [0,2,0,0,0,0|2,0,0]=4 162 B14R1.161 c1ccc(c(c1)CC[C@@H](C(=O)O)N)Cl AB33895 [0,2,0,0,0,0|2,0,0]=4 163 B14R1.161 c1ccc(c(c1)CC[C@@H](C(=O)O)N)F AB33854 [0,2,0,0,0,0|2,0,0]=4 164 B14R1.161 c1ccc(c(c1)CC[C@@H](C(=O)O)N)O AB33996 [0,2,0,0,0,0|2,0,0]=4 165 B14R1.161 c1ccc(c(c1)CC[C@H](C(=O)O)N)Br AB33944 [0,2,0,0,0,0|2,0,0]=4 166 B14R1.161 c1ccc(c(c1)CC[C@H](C(=O)O)N)Cl AB33893 [0,2,0,0,0,0|2,0,0]=4 167 B14R1.161 c1ccc(c(c1)CC[C@H](C(=O)O)N)F AB33853 [0,2,0,0,0,0|2,0,0]=4 168 B14R1.161 c1ccc(c(c1)CC[C@H](C(=O)O)N)O AB33993 [0,2,0,0,0,0|2,0,0]=4 169 B14R1.425 c1ccc(cc1)C[C@@H]([C@@H](C(=O)O)O)N MB02945 [0,2,0,0,0,0|2,0,0]=4 170 B14R1.425 c1ccc(cc1)C[C@H]([C@@H](C(=O)O)O)N MB00533 [0,2,0,0,0,0|2,0,0]=4 171 B14R1.679 Cc1ccc(cc1)CCC(C(=O)O)N AB33782 [0,2,0,0,0,0|2,0,0]=4 172 B14R1.679 Cc1ccc(cc1)CC[C@@H](C(=O)O)N AB33785 [0,2,0,0,0,0|2,0,0]=4 173 B14R1.679 Cc1ccc(cc1)CC[C@H](C(=O)O)N AB33784 [0,2,0,0,0,0|2,0,0]=4 174 B14R1.679 c1cc(ccc1CCC(C(=O)O)N)Br AB33978 [0,2,0,0,0,0|2,0,0]=4 175 B14R1.679 c1cc(ccc1CCC(C(=O)O)N)Cl AB33922 [0,2,0,0,0,0|2,0,0]=4 176 B14R1.679 c1cc(ccc1CCC(C(=O)O)N)F AB33879 [0,2,0,0,0,0|2,0,0]=4 177 B14R1.679 c1cc(ccc1CCC(C(=O)O)N)O AB14703 [0,2,0,0,0,0|2,0,0]=4 178 B14R1.679 c1cc(ccc1CC[C@@H](C(=O)O)N)Br AB33982 [0,2,0,0,0,0|2,0,0]=4 179 B14R1.679 c1cc(ccc1CC[C@@H](C(=O)O)N)Cl AB33926 [0,2,0,0,0,0|2,0,0]=4 180 B14R1.679 c1cc(ccc1CC[C@@H](C(=O)O)N)F AB33883 [0,2,0,0,0,0|2,0,0]=4 181 B14R1.679 c1cc(ccc1CC[C@@H](C(=O)O)N)O AB15550 [0,2,0,0,0,0|2,0,0]=4 182 B14R1.679 c1cc(ccc1CC[C@H](C(=O)O)N)Br AB33980 [0,2,0,0,0,0|2,0,0]=4 183 B14R1.679 c1cc(ccc1CC[C@H](C(=O)O)N)Cl AB33924 [0,2,0,0,0,0|2,0,0]=4 184 B14R1.679 c1cc(ccc1CC[C@H](C(=O)O)N)F AB33880 [0,2,0,0,0,0|2,0,0]=4 185 B14R1.679 c1cc(ccc1CC[C@H](C(=O)O)N)O AB34025 [0,2,0,0,0,0|2,0,0]=4 186 B14R1.756 CC(C(=O)OC)NCc1ccccc1 AB66346 [0,2,0,0,0,0|2,0,0]=4 187 B12R2.1 CNC1CCc2c1cccc2 AB49601 [1,0,0,1,0,0|2,0,0]=4 188 B12R2.2 c1ccc(cc1)C2CCNC2 AB09982 [1,0,0,1,0,0|1,0,1]=4 189 B12R2.2 c1ccc(cc1)[C@@H]2CCNC2 AB29529 [1,0,0,1,0,0|1,0,1]=4 190 B12R2.2 c1ccc(cc1)[C@H]2CCNC2 AB29532 [1,0,0,1,0,0|1,0,1]=4 191 B12R2.41 c1ccc2c(c1)CCCNC2 AB49623 [1,0,0,1,0,0|2,0,0]=4 192 B12R2.41 c1ccc2c(c1)CCNCC2 AB16913 [1,0,0,1,0,0|1,0,1]=4 193 B12R2.41 c1ccc2c(c1)CCNCC2 PB31022 [1,0,0,1,0,0|1,0,1]=4 194 B12R2.1081 CC1c2ccccc2CCN1 AB07224 [1,0,0,1,0,0|1,0,1]=4 195 B12R2.1081 c1cc2c(nc1)C(=O)CCC2 AB16309 [1,0,0,1,0,0|2,0,0]=4 196 B12R2.1081 c1cc2c(nc1)C(=O)NCC2 AB71451 [1,0,0,1,0,0|2,0,0]=4 197 B12R2.1081 c1cc2c(nc1)CCCC2=O PB30737 [1,0,0,1,0,0|2,0,0]=4 198 B12R2.1081 c1cc2c(nc1)CCNC2=O AB07692 [1,0,0,1,0,0|2,0,0]=4 199 B12R2.1081 c1ccc2c(c1)C(=O)CCN2 AB06711 [1,0,0,1,0,0|2,0,0]=4 200 B12R2.1081 c1ccc2c(c1)C(=O)CCO2 AB00814 [1,0,0,1,0,0|2,0,0]=4 201 B12R2.1081 c1ccc2c(c1)CCNC2=O AB07451 [1,0,0,1,0,0|1,0,0]=3 202 B12R2.1081 c1ccc2c(c1)CCOC2=O MB01461 [1,0,0,1,0,0|0,0,0]=2 203 B12R2.1081 c1ccc2c(c1)CNCC2=O AB11544 [1,0,0,1,0,0|2,0,0]=4 204 B12R2.1081 c1ccc2c(c1)COCC2=O PB14717 [1,0,0,1,0,0|2,0,0]=4 205 B12R2.1081 c1cncc2c1C(=O)CCC2 AB43737 [1,0,0,1,0,0|2,0,0]=4 206 B12R2.1081 c1cncc2c1C(=O)NCC2 AB66644 [1,0,0,1,0,0|2,0,0]=4 207 B12R2.1081 c1cncc2c1CCCC2=O MB04519 [1,0,0,1,0,0|2,0,0]=4 208 B12R2.1081 c1cncc2c1CCNC2=O AB66641 [1,0,0,1,0,0|2,0,0]=4 209 B12R2.22 c1ccc(cc1)C2CC(=O)C2 PB26115 [0,0,0,1,1,0|0,0,0]=2 210 B12R2.22 c1ccc(cc1)C2CC(=O)N2 AB10995 [0,0,0,1,1,0|1,0,0]=3 211 B12R2.22 c1ccc(cc1)C2CC(C2)N PB19234 [0,0,0,1,1,0|1,0,1]=4 212 B12R2.22 c1ccc(cc1)[C@H]2C[C@@H](C2)N PB38990 [0,0,0,1,1,0|1,0,1]=4 213 B12R2.22 c1ccc(cc1)[C@H]2C[C@H](C2)N PB38200 [0,0,0,1,1,0|1,0,1]=4 214 B12R2.24 c1c2c(ncn1)CC(=O)CC2 AB61058 [0,0,0,1,1,0|2,0,0]=4 215 B12R2.24 c1c2c(ncn1)CCC(=O)C2 AB45338 [0,0,0,1,1,0|2,0,0]=4 216 B12R2.24 c1cc2c(nc1)CC(=O)NC2 AB77257 [0,0,0,1,1,0|2,0,0]=4 217 B12R2.24 c1cc2c(nc1)CCC(=O)C2 AB26260 [0,0,0,1,1,0|1,0,0]=3 218 B12R2.24 c1cc2c(nc1)NC(=O)CC2 PB12351 [0,0,0,1,1,0|2,0,0]=4 219 B12R2.24 c1cc2c(nc1)OCC(=O)C2 AB74015 [0,0,0,1,1,0|2,0,0]=4 220 B12R2.24 c1ccc2c(c1)CC(=O)NC2 AB15535 [0,0,0,1,1,0|1,0,0]=3 221 B12R2.24 c1ccc2c(c1)CCC(C2)N AB02010 [0,0,0,1,1,0|1,0,1]=4 222 B12R2.24 c1ccc2c(c1)CCN(C2)N MB00779 [0,0,0,1,1,0|2,0,0]=4 223 B12R2.24 c1ccc2c(c1)NC(=O)CO2 AB04166 [0,0,0,1,1,0|2,0,0]=4 224 B12R2.24 c1ccc2c(c1)NCC(=O)N2 AB04744 [0,0,0,1,1,0|2,0,0]=4 225 B12R2.24 c1cncc2c1CC(=O)NC2 AB64881 [0,0,0,1,1,0|2,0,0]=4 226 B12R2.24 c1cncc2c1CCC(=O)N2 MB05928 [0,0,0,1,1,0|2,0,0]=4 227 B12R2.24 c1cncc2c1CNC(=O)C2 AB68337 [0,0,0,1,1,0|2,0,0]=4 228 B12R2.24 c1cncc2c1NC(=O)CC2 MB05707 [0,0,0,1,1,0|2,0,0]=4 229 B14R2.2 CC(=O)OC1=c2ccccc2=NC1 AB01158 [0,0,0,1,0,1|0,0,1]=3 230 B14R2.19 c1ccc(cc1)CN2CCC(=O)C2 PB19844 [0,0,0,1,0,1|1,0,0]=3 231 B14R2.21 c1ccc(cc1)C2CCCC(=O)C2 AB04809 [0,0,0,1,0,1|1,0,0]=3 232 B14R2.21 c1ccc(cc1)C2CNCC(=O)N2 AB37355 [0,0,0,1,0,1|2,0,0]=4 233 B14R2.21 c1ccc(cc1)C2CNCC(=O)O2 AB72680 [0,0,0,1,0,1|2,0,0]=4 234 B14R2.21 c1ccc(cc1)C2COCC(=O)N2 AB72681 [0,0,0,1,0,1|1,0,0]=3 235 B14R2.21 c1ccc(cc1)[C@@H]2CNCC(=O)N2 AB37361 [0,0,0,1,0,1|2,0,0]=4 236 B14R2.21 c1ccc(cc1)[C@H]2CNCC(=O)N2 AB37359 [0,0,0,1,0,1|2,0,0]=4 237 B14R2.391 c1ccc2c(c1)CCCCC(=O)N2 AB01426 [0,0,0,1,0,1|2,0,0]=4 238 B14R2.436 c1ccc(cc1)COC2CC(=O)C2 PB10694 [0,0,0,1,0,1|1,0,0]=3 239 B14R2.31359 c1ccc2c(c1)CCCC2C(=O)O AB11024 [0,0,0,1,0,1|2,0,0]=4 240 B14R2.31359 c1ccc2c(c1)CCNC2C(=O)O AB08729 [0,0,0,1,0,1|2,0,0]=4 241 B14R2.31359 c1ccc2c(c1)CCN[C@@H]2C(=O)O AB14831 [0,0,0,1,0,1|2,0,0]=4 242 B14R2.31359 c1ccc2c(c1)CCN[C@H]2C(=O)O AB14827 [0,0,0,1,0,1|2,0,0]=4 243 B14R2.68 c1ccc(cc1)C2CNC(=O)CN2 AB37265 [0,1,0,1,0,0|1,0,0]=3 244 B14R2.68 c1ccc(cc1)C2CNC(=O)CO2 AB42561 [0,1,0,1,0,0|1,0,0]=3 245 B14R2.68 c1ccc(cc1)N2CCC(=O)CC2 AB31242 [0,1,0,1,0,0|2,0,0]=4 246 B14R2.68 c1ccc(cc1)[C@@H]2CNC(=O)CN2 AB37270 [0,1,0,1,0,0|1,0,0]=3 247 B14R2.68 c1ccc(cc1)[C@@H]2COC(=O)CN2 MB01107 [0,1,0,1,0,0|0,0,0]=2 248 B14R2.68 c1ccc(cc1)[C@H]2CNC(=O)CN2 AB37268 [0,1,0,1,0,0|1,0,0]=3 249 B14R2.68 c1ccc(cc1)[C@H]2COC(=O)CN2 AB05536 [0,1,0,1,0,0|0,0,0]=2 250 B14R2.287 c1ccc2c(c1)C(CCC(=O)N2)N AB62341 [0,1,0,1,0,0|2,0,0]=4 251 B14R2.29285 CC1(c2ccccc2C(CO1)N)C AB70309 [0,1,0,1,0,0|1,0,1]=4 252 B14R2.300 CC(=O)N1CCc2c1ccc(c2)Br AB02296 [0,1,0,1,0,0|1,0,0]=3 253 B14R2.300 CC(=O)N1CCc2c1ccc(c2)I MB00317 [0,1,0,1,0,0|1,0,0]=3 254 B14R2.300 c1cc2c(cc1Cl)CCC2C(=O)O AB60830 [0,1,0,1,0,0|2,0,0]=4 255 B14R2.7974 c1cc2c(cc1N)CCCC(=O)N2 PB29619 [0,1,0,1,0,0|2,0,0]=4 256 B14R2.768 CC(=O)OC1Cc2ccccc2C1 AB66196 [0,1,0,1,0,0|0,0,0]=2 257 B14R2.768 c1ccc2c(c1)CC(C2)CC(=O)O AB03118 [0,1,0,1,0,0|2,0,0]=4 258 B14R2.781 CC(=O)C1COc2ccccc2O1 MB01186 [0,1,0,1,0,0|2,0,0]=4 259 B14R2.781 c1ccc2c(c1)CCC(C2)C(=O)N AB72029 [0,1,0,1,0,0|2,0,0]=4 260 B14R2.781 c1ccc2c(c1)CCC(N2)C(=O)O AB10523 [0,1,0,1,0,0|2,0,0]=4 261 B14R2.781 c1ccc2c(c1)CCC(O2)C(=O)O AB01988 [0,1,0,1,0,0|2,0,0]=4 262 B14R2.781 c1ccc2c(c1)CC[C@@H](N2)C(=O)O AB19849 [0,1,0,1,0,0|2,0,0]=4 263 B14R2.781 c1ccc2c(c1)CC[C@H](N2)C(=O)O AB17671 [0,1,0,1,0,0|2,0,0]=4 264 B14R2.741 c1ccc2c(c1)CCC(C(=O)N2)N AB11692 [0,1,0,1,0,0|2,0,0]=4 265 B14R2.9535 c1ccc2c(c1)CCC2(C(=O)O)N AB07290 [0,1,0,1,0,0|2,0,0]=4 266 B14R2.9535 c1ccc2c(c1)CC[C@@]2(C(=O)O)N AB33347 [0,1,0,1,0,0|2,0,0]=4 267 B14R2.9535 c1ccc2c(c1)CC[C@]2(C(=O)O)N AB33343 [0,1,0,1,0,0|2,0,0]=4 268 B14R2.20 Cc1ccc(cc1)C2CCC(=O)C2 AB26347 [0,1,0,1,0,0|1,0,0]=3 269 B14R2.20 c1cc(ccc1C2CCC(=O)C2)Br AB26346 [0,1,0,1,0,0|1,0,0]=3 270 B14R2.20 c1cc(ccc1C2CCC(=O)C2)Cl AB26349 [0,1,0,1,0,0|1,0,0]=3 271 B14R2.20 c1cc(ccc1C2CCC(=O)C2)F AB26352 [0,1,0,1,0,0|1,0,0]=3 272 B14R2.20 c1cc(ccc1C2CCC(=O)N2)Cl CB11852 [0,1,0,1,0,0|2,0,0]=4 273 B14R2.380 c1cc2c(cc1N)NC(=O)CCC2 PB20088 [0,1,0,1,0,0|2,0,0]=4 274 B14R2.5816 c1cc2c(cc1Br)C(CC2)C(=O)O AB60826 [0,1,0,1,0,0|2,0,0]=4 275 B14R2.95 COC(=O)C1CCc2c1cccc2 AB07839 [0,1,0,1,0,0|1,0,0]=3 276 B14R2.4514 CN1[C@@H](CCC1=O)c2cccnc2 PB32127 [0,1,0,1,0,0|2,0,0]=4 277 B10R1.18 CC(=O)Cc1ccccn1 AB03323 [0,0,0,0,2,0|1,0,0]=3 278 B10R1.18 CC(=O)Cc1cccnc1 AB29343 [0,0,0,0,2,0|1,0,0]=3 279 B10R1.18 CC(=O)Cc1cccnc1 AB45525 [0,0,0,0,2,0|1,0,0]=3 280 B10R1.18 CC(=O)Cc1ncccn1 MB07248 [0,0,0,0,2,0|2,0,0]=4 281 B10R1.18 CC(=O)Nc1ccncc1 AB06982 [0,0,0,0,2,0|2,0,0]=4 282 B10R1.18 C[C@@H](Cc1ccccc1)N AB03711 [0,0,0,0,2,0|1,0,1]=4 283 B10R1.18 C[C@H](Cc1ccccc1)N AB07478 [0,0,0,0,2,0|1,0,1]=4 284 B10R1.18 c1cc(cnc1)CC(=O)O AB01106 [0,0,0,0,2,0|2,0,0]=4 285 B10R1.18 c1ccc(cc1)CC(=N)N AB29087 [0,0,0,0,2,0|2,0,0]=4