0 B14R1.1019 CC/C(=C\C(=O)O)/C1=CC=C(C=C1)C Z352747448 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.1019 CCC(CC(=O)O)C1=CC=C(C=C1)C Z352782040 [0,0,0,0,0,0|2,0,0]=2 2 B14R1.1019 CCC(NC(=O)C)C1=CC=C(C=C1)Cl Z254491600 [0,0,0,0,0,0|3,0,0]=3 3 B14R1.1019 CN(C)CC(CN)C1=CC=C(C=C1)Cl Z2065464279 [0,0,0,0,0,0|3,0,0]=3 4 B14R1.1019 NCC(CC(=O)O)C1=CC=C(C=C1)Cl Z2569257770 [0,0,0,0,0,0|0,0,0]=0 5 B14R1.1019 NCC(CC(=O)O)C1=CC=C(C=C1)F Z2471610998 [0,0,0,0,0,0|0,1,0]=1 6 B13R1.132 C/C(=C\C(=O)O)/C1=CC=C(C=C1)F Z352747294 [1,0,0,0,0,0|0,1,2]=4 7 B13R1.132 CC(=O)CC(=O)C1=CC=C(C=C1)Cl Z56876401 [1,0,0,0,0,0|2,0,1]=4 8 B13R1.132 CC(=O)NC(C)C1=CC=C(C=C1)Br Z28030902 [1,0,0,0,0,0|2,1,0]=4 9 B13R1.132 CC(C)CC(N)C1=CC=C(C=C1)Cl Z291232734 [1,0,0,0,0,0|2,0,1]=4 10 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)Br Z1269234118 [1,0,0,0,0,0|0,1,0]=2 11 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)F Z352782250 [1,0,0,0,0,0|0,1,0]=2 12 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)N Z1262514048 [1,0,0,0,0,0|1,0,0]=2 13 B13R1.132 CC1=CC=C(C=C1)C(C)CC(=O)O Z352782406 [1,0,0,0,0,0|1,0,0]=2 14 B13R1.132 CC1=CC=C(C=C1)C(N)CC(=O)O Z56912034 [1,0,0,0,0,0|1,0,0]=2 15 B13R1.132 CN(C)CC(N)C1=CC=C(C=C1)Cl Z1198218742 [1,0,0,0,0,0|3,0,0]=4 16 B13R1.132 CN(CC(=O)O)C1=NC=C(C=C1)Cl Z275027142 [1,0,0,0,0,0|2,0,0]=3 17 B13R1.132 CN(CC(=O)O)C1=NC=C(C=N1)Cl Z2060348505 [1,0,0,0,0,0|3,0,0]=4 18 B13R1.132 CN(CC(=O)O)C1=NN=C(C=C1)Cl Z285167314 [1,0,0,0,0,0|3,0,0]=4 19 B13R1.132 NC(=O)C[C@@H](N)C1=CC=C(C=C1)Cl Z1346385388 [1,0,0,0,0,0|1,0,0]=2 20 B13R1.132 NC(=O)C[C@@H](N)C1=CC=C(C=C1)F Z1696091886 [1,0,0,0,0,0|1,1,0]=3 21 B13R1.132 NC(=O)C[C@H](N)C1=CC=C(C=C1)Cl Z756926884 [1,0,0,0,0,0|1,0,0]=2 22 B13R1.132 NC(=O)C[C@H](N)C1=CC=C(C=C1)F Z1696290104 [1,0,0,0,0,0|1,1,0]=3 23 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br Z147647162 [1,0,0,0,0,0|0,1,0]=2 24 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Cl Z56899122 [1,0,0,0,0,0|0,0,0]=1 25 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)F Z56921163 [1,0,0,0,0,0|0,1,0]=2 26 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br Z1696824108 [1,0,0,0,0,0|0,1,0]=2 27 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)F Z4935533100 [1,0,0,0,0,0|0,1,0]=2 28 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)Cl Z982132070 [1,0,0,0,0,0|1,0,0]=2 29 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)F Z982132094 [1,0,0,0,0,0|1,1,0]=3 30 B13R1.132 O=C(O)CS(=O)C1=CC=C(C=C1)Cl Z802568764 [1,0,0,0,0,0|2,0,0]=3 31 B13R1.713 C=CC(CC(=O)O)C1=CC=CC=C1 Z1262511239 [1,0,0,0,0,0|1,0,1]=3 32 B13R1.713 CC(=O)NC(CO)C1=CC=CC=C1 Z1097082934 [1,0,0,0,0,0|3,0,0]=4 33 B13R1.713 CC(O)CC(CN)C1=CC=CC=C1 Z1410955907 [1,0,0,0,0,0|1,0,1]=3 34 B13R1.713 CC/C(=C\C(=O)O)/C1=CC=CC=C1 Z352748324 [1,0,0,0,0,0|1,0,2]=4 35 B13R1.713 CCC(CC(=O)O)C1=CC=CC=C1 Z352782018 [1,0,0,0,0,0|1,0,0]=2 36 B13R1.713 CCN(CC(=O)O)C1=CC=CC=C1 Z763029850 [1,0,0,0,0,0|2,0,0]=3 37 B13R1.713 CN(C)CC(CN)C1=CC=CC=C1 Z431512726 [1,0,0,0,0,0|3,0,0]=4 38 B13R1.713 CNC(CC(=O)N)C1=CC=CC=C1 Z1973465546 [1,0,0,0,0,0|3,0,0]=4 39 B13R1.713 NCC(CC(=O)O)C1=CC=CC=C1 Z1255487817 [1,0,0,0,0,0|0,0,0]=1 40 B13R1.713 NCC(CC(=O)O)C1=CC=NC=C1 Z2901973961 [1,0,0,0,0,0|1,0,0]=2 41 B15R1.2 CCC(CC(=O)O)C1=CC=C(C=C1)OC Z352783198 [0,1,0,0,0,0|2,0,0]=3 42 B15R1.922 CC(=O)NC(C1=CC=C(C=C1)Cl)C(C)C Z226856880 [0,1,0,0,0,0|3,0,0]=4 43 B15R1.922 CC(C)N(CC(=O)O)C1=CC=C(C=C1)F Z1459989807 [0,1,0,0,0,0|2,1,0]=4 44 B15R1.922 CC1=CC=C(C=C1)C(CC(=O)O)C(=O)O Z1508923866 [0,1,0,0,0,0|2,0,1]=4 45 B15R1.922 O=C(O)CC(C(=O)O)C1=CC=C(C=C1)Cl Z1509470023 [0,1,0,0,0,0|1,0,1]=3 46 B15R1.922 O=C(O)CC(C1=CC=C(C=C1)F)C(F)F Z2733077694 [0,1,0,0,0,0|1,1,0]=3 47 B15R1.3826 C=CC(=O)N[C@@H](CO)C1=CC=C(C=C1)Cl Z3766088100 [0,1,0,0,0,0|3,0,0]=4 48 B15R1.3826 C=CC(=O)N[C@H](CO)C1=CC=C(C=C1)Cl Z3766093029 [0,1,0,0,0,0|3,0,0]=4 49 B15R1.3826 CCC(NC(=O)CCl)C1=CC=C(C=C1)Cl Z258588390 [0,1,0,0,0,0|3,0,0]=4 50 B15R2.309 O=C1CC(C(=O)N1)C2=CC=C(C=C2)Cl Z1269155425 [0,0,0,1,0,0|2,0,1]=4 51 B15R2.377 CC1=CC2=C(C=C1)C(=CN2)CC(=O)O Z940713560 [0,0,0,1,0,0|1,0,2]=4 52 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)Br Z978942580 [0,0,0,1,0,0|0,1,2]=4 53 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)Cl Z940713564 [0,0,0,1,0,0|0,0,2]=3 54 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)F Z927291412 [0,0,0,1,0,0|0,1,2]=4 55 B15R2.377 O=C(O)CC1=COC2=C1C=CC(=C2)Cl Z1269129100 [0,0,0,1,0,0|1,0,2]=4 56 B15R2.377 O=C(O)CC1=CSC2=C1C=CC(=C2)Cl Z2733267599 [0,0,0,1,0,0|1,0,2]=4 57 B15R2.377 O=C(O)CC1CCC2=C1C=CC(=C2)Br Z1269123210 [0,0,0,1,0,0|1,1,0]=3 58 B15R2.377 O=C(O)CC1COC2=C1C=CC(=C2)O Z1255374187 [0,0,0,1,0,0|2,0,0]=3 59 B15R2.22666 O=C1CC(C2=C(N1)C=C(C=C2)F)CO Z2751252776 [0,0,0,1,0,0|2,1,0]=4 60 B13R1.706 CC(=O)C(C#N)C1=CC=C(C=C1)Cl Z56985774 [0,0,0,0,1,0|1,0,2]=4 61 B13R1.706 CC(C)C(CN)C1=CC=C(C=C1)Cl Z1198338118 [0,0,0,0,1,0|2,0,1]=4 62 B13R1.706 CCC(C(=O)O)C1=CC=C(C=C1)Cl Z982129852 [0,0,0,0,1,0|1,0,0]=2 63 B13R1.706 CCC(C(=O)O)C1=CC=C(C=C1)F Z792377316 [0,0,0,0,1,0|1,1,0]=3 64 B13R1.706 CNC(C(=O)N)C1=CC=C(C=C1)Cl Z450953536 [0,0,0,0,1,0|3,0,0]=4 65 B13R1.706 CNC(C(=O)O)C1=CC=C(C=C1)F Z446011670 [0,0,0,0,1,0|2,1,0]=4 66 B13R1.706 COC(C(=O)O)C1=CC=C(C=C1)O Z1262556696 [0,0,0,0,1,0|3,0,0]=4 67 B13R1.706 NCC(C(=O)O)C1=CC=C(C=C1)Cl Z3244719959 [0,0,0,0,1,0|0,0,0]=1 68 B13R1.706 NCC(C(=O)O)C1=CC=C(C=C1)F Z3244719948 [0,0,0,0,1,0|0,1,0]=2 69 B13R1.706 O=C(O)C(CO)C1=CC=C(C=C1)Cl Z1508925263 [0,0,0,0,1,0|1,0,0]=2 70 B13R1.712 NCC(CC(=O)O)C1=CC(=CS1)Br Z2938030450 [0,0,0,0,1,0|1,1,0]=3 71 B15R1.656 CCN(CC(=O)O)CC1=CC=C(C=C1)Cl Z1259335829 [0,0,0,0,0,1|2,0,0]=3 72 B12R1.3 NCC(CCO)C1=CC=CC=C1 Z1198177199 [2,0,0,0,0,0|0,0,1]=3 73 B12R1.12 CCC(CN)C1=CC=C(C=C1)Cl Z1198306661 [2,0,0,0,0,0|0,0,1]=3 74 B12R1.12 CNC(CO)C1=CC=C(C=C1)Cl Z2235386839 [2,0,0,0,0,0|2,0,0]=4 75 B12R1.12 COC(CN)C1=CC=C(C=C1)Cl Z838184210 [2,0,0,0,0,0|1,0,1]=4 76 B12R1.12 NCC(CO)C1=CC=C(C=C1)Cl Z2130644164 [2,0,0,0,0,0|0,0,0]=2 77 B12R1.12 NCC(CO)C1=CC=C(C=C1)F Z1269131038 [2,0,0,0,0,0|0,1,0]=3 78 B12R1.12 OCC(CO)C1=CC=C(C=C1)Cl Z1198166557 [2,0,0,0,0,0|1,0,0]=3 79 B12R1.12 OCC(CO)C1=CC=C(C=C1)O Z1513899322 [2,0,0,0,0,0|2,0,0]=4 80 B12R1.16 CCCC(N)C1=CC=C(C=C1)Cl Z1416203204 [2,0,0,0,0,0|1,0,1]=4 81 B12R1.16 NC(CCO)C1=CC=C(C=C1)Br Z979743656 [2,0,0,0,0,0|0,1,1]=4 82 B12R1.16 NC(CCO)C1=CC=C(C=C1)F Z979743658 [2,0,0,0,0,0|0,1,1]=4 83 B12R1.21 CC(=O)CCC1=CC=C(C=C1)C Z406376788 [2,0,0,0,0,0|2,0,0]=4 84 B12R1.21 CC(=O)CCC1=CC=C(C=C1)F Z406376784 [2,0,0,0,0,0|1,1,0]=4 85 B12R1.21 CC(=O)CCC1=CC=C(C=C1)I Z1263632422 [2,0,0,0,0,0|1,1,0]=4 86 B12R1.21 CC1=CC=C(C=C1)CCC(=O)N Z194976512 [2,0,0,0,0,0|2,0,0]=4 87 B12R1.21 CC1=CC=C(C=C1)CCC(=O)O Z169855336 [2,0,0,0,0,0|1,0,0]=3 88 B12R1.21 CC1=CC=C(C=C1)OCC(=O)O Z56812739 [2,0,0,0,0,0|2,0,0]=4 89 B12R1.21 CC1=CC=C(C=C1)SCC(=O)O Z55903478 [2,0,0,0,0,0|2,0,0]=4 90 B12R1.21 CC1=NC=C(C=C1)CCC(=O)O Z2310699273 [2,0,0,0,0,0|2,0,0]=4 91 B12R1.21 NC(=O)CCC1=CC=C(C=C1)F Z87614992 [2,0,0,0,0,0|1,1,0]=4 92 B12R1.21 NC(=O)CCC1=CC=C(C=C1)N Z414316852 [2,0,0,0,0,0|2,0,0]=4 93 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Cl Z104647358 [2,0,0,0,0,0|2,0,0]=4 94 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O Z336079452 [2,0,0,0,0,0|1,0,0]=3 95 B12R1.21 NC1=CC=C(C=C1)OCC(=O)O Z3241275736 [2,0,0,0,0,0|2,0,0]=4 96 B12R1.21 NC1=NC=C(C=C1)CCC(=O)O Z1255384430 [2,0,0,0,0,0|2,0,0]=4 97 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Cl Z56989206 [2,0,0,0,0,0|0,0,2]=4 98 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Br Z118438622 [2,0,0,0,0,0|0,1,0]=3 99 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Cl Z178961272 [2,0,0,0,0,0|0,0,0]=2 100 B12R1.21 O=C(O)CCC1=CC=C(C=C1)F Z89264973 [2,0,0,0,0,0|0,1,0]=3 101 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O Z317038012 [2,0,0,0,0,0|1,0,0]=3 102 B12R1.21 O=C(O)CCC1=CN=C(C=C1)Cl Z1695923041 [2,0,0,0,0,0|1,0,0]=3 103 B12R1.21 O=C(O)CCC1=CNC(=O)C=C1 Z1889997460 [2,0,0,0,0,0|2,0,0]=4 104 B12R1.21 O=C(O)CCC1=NC=C(C=C1)Br Z1269216724 [2,0,0,0,0,0|1,1,0]=4 105 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Br Z274534708 [2,0,0,0,0,0|1,1,0]=4 106 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl Z274534702 [2,0,0,0,0,0|1,0,0]=3 107 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O Z57127481 [2,0,0,0,0,0|2,0,0]=4 108 B12R1.21 O=C(O)COC1=CC=C(C=C1)Br Z56812736 [2,0,0,0,0,0|1,1,0]=4 109 B12R1.21 O=C(O)COC1=CC=C(C=C1)Cl Z57181989 [2,0,0,0,0,0|1,0,0]=3 110 B12R1.21 O=C(O)COC1=CC=C(C=C1)F Z56978034 [2,0,0,0,0,0|1,1,0]=4 111 B12R1.21 O=C(O)COC1=CC=C(C=C1)I Z56943814 [2,0,0,0,0,0|1,1,0]=4 112 B12R1.21 O=C(O)COC1=CC=C(C=C1)O Z1192367471 [2,0,0,0,0,0|2,0,0]=4 113 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Br Z55903477 [2,0,0,0,0,0|1,1,0]=4 114 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Cl Z55179956 [2,0,0,0,0,0|1,0,0]=3 115 B12R1.21 O=C(O)CSC1=CC=C(C=C1)F Z55903650 [2,0,0,0,0,0|1,1,0]=4 116 B12R1.21 O=C(O)CSC1=CC=C(C=C1)O Z733878444 [2,0,0,0,0,0|2,0,0]=4 117 B12R1.107 C/C(=C\C(=O)O)/C1=CC=CC=C1 Z352748396 [2,0,0,0,0,0|0,0,2]=4 118 B12R1.107 C=C(C)CC(N)C1=CC=CC=C1 Z4497189696 [2,0,0,0,0,0|2,0,0]=4 119 B12R1.107 CC(CC(=O)N)C1=CC=CC=C1 Z33546734 [2,0,0,0,0,0|1,0,0]=3 120 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 Z56899204 [2,0,0,0,0,0|0,0,0]=2 121 B12R1.107 CC(CC(=O)O)C1=CC=NC=C1 Z352782496 [2,0,0,0,0,0|1,0,0]=3 122 B12R1.107 CC(NC(=O)N)C1=CC=CC=C1 Z198194342 [2,0,0,0,0,0|2,0,0]=4 123 B12R1.107 CN(CC(=O)N)C1=CC=CC=C1 Z54747686 [2,0,0,0,0,0|2,0,0]=4 124 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 Z1162448842 [2,0,0,0,0,0|1,0,0]=3 125 B12R1.107 CN(CC(=O)O)C1=CC=NC=C1 Z317257814 [2,0,0,0,0,0|2,0,0]=4 126 B12R1.107 CS(=O)CC(N)C1=CC=CC=C1 Z1238793494 [2,0,0,0,0,0|2,0,0]=4 127 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 Z94601171 [2,0,0,0,0,0|0,0,0]=2 128 B12R1.107 NC(CC(=O)O)C1=CC=NC=C1 Z317027344 [2,0,0,0,0,0|1,0,0]=3 129 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 Z756925772 [2,0,0,0,0,0|0,0,0]=2 130 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 Z1696091779 [2,0,0,0,0,0|0,0,0]=2 131 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 Z982132010 [2,0,0,0,0,0|1,0,0]=3 132 B14R1.2 CCC1=CC=C(C=C1)C(C)CC(=O)O Z352782948 [1,1,0,0,0,0|1,0,0]=3 133 B14R1.2 COC1=CC=C(C=C1)C(C)CC(=O)O Z352782172 [1,1,0,0,0,0|1,0,0]=3 134 B14R1.2 COC1=CC=C(C=C1)C(N)CC(=O)O Z147647160 [1,1,0,0,0,0|1,0,0]=3 135 B14R1.10 C=CC(=O)N[C@H](C)C1=CC=C(C=C1)Cl Z1443644466 [1,1,0,0,0,0|2,0,0]=4 136 B14R1.10 CC(NC(=O)CCl)C1=CC=C(C=C1)Cl Z56347106 [1,1,0,0,0,0|2,0,0]=4 137 B14R1.10 COC(=O)CC(=O)C1=CC=C(C=C1)Cl Z317040222 [1,1,0,0,0,0|1,0,1]=4 138 B14R1.10 COC(=O)CC(C)C1=CC=C(C=C1)Br Z1269160571 [1,1,0,0,0,0|0,1,0]=3 139 B14R1.10 COC(=O)CC(C)C1=CC=C(C=C1)N Z1262631339 [1,1,0,0,0,0|1,0,0]=3 140 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)Br Z199409082 [1,1,0,0,0,0|0,1,0]=3 141 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)C Z235351531 [1,1,0,0,0,0|1,0,0]=3 142 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)Cl Z367450950 [1,1,0,0,0,0|0,0,0]=2 143 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)F Z366644130 [1,1,0,0,0,0|0,1,0]=3 144 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)Cl Z2768215215 [1,1,0,0,0,0|0,0,0]=2 145 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)Cl Z1331055684 [1,1,0,0,0,0|0,0,0]=2 146 B14R1.10 COC(=O)N[C@H](C)C1=NC=C(C=C1)Cl Z1943343567 [1,1,0,0,0,0|2,0,0]=4 147 B14R1.132 CC(C(=O)O)C(N)C1=CC=C(C=C1)Br Z1895583549 [1,1,0,0,0,0|0,1,0]=3 148 B14R1.132 CC1=CC=C(C=C1)C(C)C(O)C(=O)O Z1271904593 [1,1,0,0,0,0|1,0,0]=3 149 B14R1.685 CC(CC(=O)O)C1=CC(=C(C=C1)F)Br Z1813131228 [1,1,0,0,0,0|0,1,0]=3 150 B14R1.685 CC1=C(C=C(C=C1)C(N)CC(=O)O)C Z445853348 [1,1,0,0,0,0|1,0,0]=3 151 B14R1.694 CC(C)(CC(=O)O)C1=CC=C(C=C1)F Z1255380194 [1,1,0,0,0,0|0,1,0]=3 152 B14R1.694 CC(C)(CC(=O)O)C1=CC=C(C=C1)N Z1198223705 [1,1,0,0,0,0|1,0,0]=3 153 B14R1.694 CC1=CC=C(C=C1)C(C)(C)CC(=O)O Z56347157 [1,1,0,0,0,0|1,0,0]=3 154 B14R1.694 O=C(O)CS(=O)(=O)C1=CC=C(C=C1)Cl Z56852692 [1,1,0,0,0,0|2,0,0]=4 155 B14R1.6048 CC(CC(=O)O)C1=C(C=C(C=C1)F)F Z352783294 [1,1,0,0,0,0|0,1,0]=3 156 B14R1.6048 NC(CC(=O)O)C1=C(C=C(C=C1)F)F Z317027302 [1,1,0,0,0,0|0,1,0]=3 157 B14R1.6048 N[C@@H](CC(=O)O)C1=C(C=C(C=C1)F)F Z1696824148 [1,1,0,0,0,0|0,1,0]=3 158 B14R1.6048 N[C@H](CC(=O)O)C1=C(C=C(C=C1)F)F Z1696822760 [1,1,0,0,0,0|0,1,0]=3 159 B14R1.515 C#CCC(CC(=O)O)C1=CC=CC=C1 Z1262516818 [1,1,0,0,0,0|1,0,0]=3 160 B14R1.515 N#CCC(CC(=O)O)C1=CC=CC=C1 Z1262525162 [1,1,0,0,0,0|0,0,1]=3 161 B14R1.3642 CCC(O)(CC(=O)N)C1=CC=CC=C1 Z1198158614 [1,1,0,0,0,0|2,0,0]=4 162 B14R1.3642 CCC(O)(CC(=O)O)C1=CC=CC=C1 Z982131910 [1,1,0,0,0,0|1,0,0]=3 163 B14R1.6455 CC(C)C(CC(=O)O)C1=CC=CC=C1 Z337709416 [1,1,0,0,0,0|1,0,0]=3 164 B14R1.6455 O=C(O)CC(C(=O)O)C1=CC=CC=C1 Z104478578 [1,1,0,0,0,0|1,0,1]=4 165 B14R1.6455 O=C(O)CC(C1=CC=CC=C1)C(F)F Z1510051007 [1,1,0,0,0,0|1,0,0]=3 166 B14R1.8 CCC(C(=O)O)C1=CC=C(C=C1)OC Z792377198 [0,1,0,0,1,0|2,0,0]=4 167 B14R1.703 CC(C)C(C(=O)N)C1=CC=C(C=C1)Cl Z68590744 [0,1,0,0,1,0|2,0,0]=4 168 B14R1.703 CC(C)C(C(=O)O)C1=CC=C(C=C1)Cl Z56887655 [0,1,0,0,1,0|1,0,0]=3 169 B14R1.703 CC(C)C(C(=O)O)C1=CC=C(C=C1)F Z982130246 [0,1,0,0,1,0|1,1,0]=4 170 B14R1.703 CN(C)C(C(=O)O)C1=CC=C(C=C1)Cl Z270828822 [0,1,0,0,1,0|2,0,0]=4 171 B14R1.1032 CNC(C(=O)O)C1=CC(=C(C=C1)Cl)Cl Z446011628 [0,1,0,0,1,0|2,0,0]=4 172 B16R1.16564 CC(C)C(NCC(=O)N)C1=CC=C(C=C1)Cl Z225087990 [0,1,0,0,0,1|2,0,0]=4 173 B16R1.12 COCC1=CC=C(C=C1)C(CN)CC(=O)O Z2935001632 [0,2,0,0,0,0|1,0,0]=3 174 B16R1.234 COC1=CC=C(C=C1)C(CC(=O)O)C(F)F Z2733303367 [0,2,0,0,0,0|2,0,0]=4 175 B16R1.16567 CC(=O)NC(CC(=O)O)C1=CC=C(C=C1)Cl Z85902274 [0,2,0,0,0,0|1,0,1]=4 176 B16R1.16567 CC1=CC=C(C=C1)C(CC(=O)O)NC(=O)N Z221523590 [0,2,0,0,0,0|1,0,1]=4 177 B16R1.16567 CN(C)CC(NC(=O)N)C1=CC=C(C=C1)Cl Z2025668124 [0,2,0,0,0,0|2,0,0]=4 178 B16R1.16567 NC(=O)CC(CC(=O)O)C1=CC=C(C=C1)F Z2181831948 [0,2,0,0,0,0|0,1,0]=3 179 B16R1.16567 NC(=O)NC(CC(=O)O)C1=CC=C(C=C1)Br Z319610832 [0,2,0,0,0,0|0,1,1]=4 180 B16R1.16567 NC(=O)NC(CC(=O)O)C1=CC=C(C=C1)Cl Z56904725 [0,2,0,0,0,0|0,0,1]=3 181 B16R1.16567 O=C(O)CC(CC(=O)O)C1=CC=C(C=C1)Cl Z1268153943 [0,2,0,0,0,0|1,0,0]=3 182 B16R1.6923 CC(C)(N)C(CC(=O)O)C1=CC=C(C=C1)Cl Z2659547562 [0,2,0,0,0,0|0,0,0]=2 183 B16R1.7490 NC(=O)C(CC(=O)O)C1=C(C=C(C=C1)Cl)Cl Z2750885260 [0,2,0,0,0,0|0,0,1]=3 184 B16R1.7490 O=C(O)CC(C(=O)O)C1=C(C=C(C=C1)Cl)Cl Z57474969 [0,2,0,0,0,0|1,0,1]=4 185 B16R1.30401 CC(CN)(CC(=O)O)C1=CC(=C(C=C1)F)Br Z3828341334 [0,2,0,0,0,0|0,1,0]=3 186 B14R2.20 CC1=CC=C(C=C1)C2CNC(=O)C2 Z1251360848 [1,0,0,1,0,0|1,0,0]=3 187 B14R2.20 NC1=CC=C(C=C1)C2CNC(=O)C2 Z1255362676 [1,0,0,1,0,0|1,0,0]=3 188 B14R2.20 O=C1C=C(CN1)C2=CC=C(C=C2)Cl Z1509188622 [1,0,0,1,0,0|0,0,2]=4 189 B14R2.20 O=C1CC(CN1)C2=CC=C(C=C2)Br Z1269215863 [1,0,0,1,0,0|0,1,0]=3 190 B14R2.20 O=C1CC(CN1)C2=CC=C(C=C2)F Z1198162881 [1,0,0,1,0,0|0,1,0]=3 191 B14R2.157 NCC1(CCC1)C2=CC=C(C=C2)Cl Z361883828 [1,0,0,1,0,0|1,0,1]=4 192 B14R2.926 NC1CCCC1C2=CC=C(C=C2)Cl Z1696290149 [1,0,0,1,0,0|1,0,1]=4 193 B14R2.2854 NCC(C1=CC=C(C=C1)Cl)C2CC2 Z2186882985 [1,0,0,1,0,0|1,0,1]=4 194 B14R2.4402 CC(=O)C1CC1C2=CC=C(C=C2)F Z370707900 [1,0,0,1,0,0|1,1,0]=4 195 B14R2.4402 CC1=CC=C(C=C1)C2CC2C(=O)O Z450468392 [1,0,0,1,0,0|1,0,0]=3 196 B14R2.4402 NC1=CC=C(C=C1)[C@@H]2C[C@H]2C(=O)O Z2309896677 [1,0,0,1,0,0|1,0,0]=3 197 B14R2.4402 O=C(O)C1CC1C2=CC=C(C=C2)Br Z450468406 [1,0,0,1,0,0|0,1,0]=3 198 B14R2.4402 O=C(O)C1CC1C2=CC=C(C=C2)F Z203244232 [1,0,0,1,0,0|0,1,0]=3 199 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl Z2306910175 [1,0,0,1,0,0|0,0,0]=2 200 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)F Z2327124588 [1,0,0,1,0,0|0,1,0]=3 201 B14R2.29365 CC1CC(=O)OC2=C1C=CC(=C2)O Z1513808003 [1,0,0,1,0,0|1,0,0]=3 202 B14R2.29365 CN1CC(=O)NC2=C1C=CC(=C2)Cl Z1317798821 [1,0,0,1,0,0|2,0,0]=4 203 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=C2 Z56913182 [1,0,0,1,0,0|0,0,2]=4 204 B14R2.2 O=C(O)CC1=NNC2=C1C=CC=C2 Z335442472 [1,0,0,1,0,0|1,0,1]=4 205 B14R2.2 O=C(O)CC1CCC2=C1C=CC=C2 Z352782144 [1,0,0,1,0,0|1,0,0]=3 206 B14R2.2 O=C(O)CC1CNC2=C1C=CC=C2 Z1259339975 [1,0,0,1,0,0|0,0,0]=2 207 B14R2.2 O=C(O)CC1COC2=C1C=CC=C2 Z1198234596 [1,0,0,1,0,0|1,0,0]=3 208 B14R2.21 O=C1CCCC(C1)C2=CC=CC=C2 Z1198152074 [1,0,0,1,0,0|2,0,0]=4 209 B14R2.21 O=C1CNCC(N1)C2=CC=CC=C2 Z2867580643 [1,0,0,1,0,0|2,0,0]=4 210 B14R2.403 O=S1(=O)CC(CN1)C2=CC=CC=C2 Z1862025182 [1,0,0,1,0,0|1,0,1]=4 211 B14R2.598 O=C1CC(C(=O)O1)C2=CC=CC=C2 Z99601248 [1,0,0,1,0,0|1,0,1]=4 212 B14R2.780 O=C(O)[C@@H]1NC[C@H]1C2=CC=CC=C2 Z3026488112 [1,0,0,1,0,0|0,0,0]=2 213 B14R2.1014 O=C(O)CC1(CC1)C2=CC=CC=C2 Z1255374825 [1,0,0,1,0,0|1,0,0]=3 214 B14R2.1146 NCC1CC(=O)NC2=C1C=CC=C2 Z1170758560 [1,0,0,1,0,0|1,0,0]=3 215 B14R2.3449 NCC1(CC(=O)C1)C2=CC=CC=C2 Z1696861483 [1,0,0,1,0,0|1,0,0]=3 216 B14R2.4586 CC1C(C1C2=CC=CC=C2)C(=O)O Z1262523517 [1,0,0,1,0,0|1,0,0]=3 217 B14R2.45179 NCC1CS(=O)(=O)C2=C1C=CC=C2 Z425994408 [1,0,0,1,0,0|1,0,1]=4 218 B14R2.300 O=C(O)C1=CNC2=C1C=CC(=C2)Cl Z385446076 [0,0,0,1,1,0|0,0,2]=4 219 B14R2.300 O=C(O)C1CCC2=C1C=CC(=C2)Cl Z1198278140 [0,0,0,1,1,0|1,0,0]=3 220 B14R2.10595 CC1=CC=C(C=C1)C2(CC2)C(=O)O Z390130610 [0,0,0,1,1,0|2,0,0]=4 221 B14R2.10595 NC(=O)C1(CC1)C2=CC=C(C=C2)Cl Z68591097 [0,0,0,1,1,0|2,0,0]=4 222 B14R2.10595 NC1=CC=C(C=C1)C2(CC2)C(=O)O Z4965080259 [0,0,0,1,1,0|2,0,0]=4 223 B14R2.10595 O=C(O)C1(CC1)C2=CC=C(C=C2)Br Z235345065 [0,0,0,1,1,0|1,1,0]=4 224 B14R2.10595 O=C(O)C1(CC1)C2=CC=C(C=C2)Cl Z104485910 [0,0,0,1,1,0|1,0,0]=3 225 B14R2.10595 O=C(O)C1(CC1)C2=CC=C(C=C2)F Z228588556 [0,0,0,1,1,0|1,1,0]=4 226 B14R2.10595 O=C(O)C1(CC1)C2=CC=C(C=C2)I Z1269158983 [0,0,0,1,1,0|1,1,0]=4 227 B14R2.10595 O=C(O)C1(CC1)C2=CC=C(C=C2)O Z1251415590 [0,0,0,1,1,0|2,0,0]=4 228 B16R2.11564 O=C(O)CC1(CC1)OC2=CC=C(C=C2)Br Z3023342741 [0,0,0,1,0,1|1,1,0]=4 229 B16R2.2865 O=C(O)[C@@H]1CC[C@H](N1)C2=CC=C(C=C2)Cl Z2311241259 [0,0,0,1,0,1|1,0,0]=3 230 B16R2.2865 O=C(O)[C@@H]1CC[C@H](N1)C2=CC=C(C=C2)F Z2465620189 [0,0,0,1,0,1|1,1,0]=4 231 B16R2.2976 O=C(O)CCC1=CNC2=C1C=CC(=C2)Cl Z1509536927 [0,0,0,1,0,1|0,0,2]=4 232 B16R2.2482 COC1=CC2=C(C=C1)C(CO2)CC(=O)O Z1509003359 [0,1,0,1,0,0|2,0,0]=4 233 B16R2.2860 CC1=CC=C(C=C1)C2CCNC2C(=O)O Z2213888830 [0,1,0,1,0,0|1,0,0]=3 234 B16R2.2860 CC1=CC=C(C=C1)[C@@H]2CNC[C@H]2C(=O)O Z2306850802 [0,1,0,1,0,0|1,0,0]=3 235 B16R2.2860 O=C(O)C1CNCC1C2=CC=C(C=C2)O Z2210831717 [0,1,0,1,0,0|1,0,0]=3 236 B16R2.2860 O=C(O)[C@@H]1CCC[C@@H]1C2=CC=C(C=C2)F Z3271530886 [0,1,0,1,0,0|1,1,0]=4 237 B16R2.2860 O=C(O)[C@@H]1CCO[C@H]1C2=CC=C(C=C2)F Z3227736980 [0,1,0,1,0,0|1,1,0]=4 238 B16R2.2860 O=C(O)[C@@H]1CNC[C@H]1C2=CC=C(C=C2)Br Z2306842091 [0,1,0,1,0,0|0,1,0]=3 239 B16R2.2860 O=C(O)[C@@H]1CNC[C@H]1C2=CC=C(C=C2)Cl Z2306850691 [0,1,0,1,0,0|0,0,0]=2 240 B16R2.2860 O=C(O)[C@@H]1CNC[C@H]1C2=CC=C(C=C2)F Z2301665845 [0,1,0,1,0,0|0,1,0]=3 241 B16R2.2860 O=C(O)[C@H]1CNC[C@@H]1C2=CC=C(C=C2)O Z1509596873 [0,1,0,1,0,0|1,0,0]=3 242 B16R2.33398 O=C(O)CC(C1=CC=C(C=C1)O)C2CC2 Z1508963860 [0,1,0,1,0,0|2,0,0]=4 243 B16R2.79334 O=C(O)CC1(CNC1)C2=CC=C(C=C2)F Z4867131263 [0,1,0,1,0,0|0,1,0]=3 244 B16R2.79341 O=C1CC(CC(=O)N1)C2=CC=C(C=C2)Cl Z1095368841 [0,1,0,1,0,0|2,0,0]=4 245 B16R2.33106 CN1C(=O)CC(C1C2=CC=C(C=C2)Cl)N Z1587257390 [0,1,0,1,0,0|2,0,0]=4 246 B16R2.33216 O=C(O)C1CCC1C2=CC(=C(C=C2)Cl)Cl Z1434172904 [0,1,0,1,0,0|1,0,0]=3 247 B16R2.138106 O=C(O)C1CCC1C2=C(C=C(C=C2)Cl)F Z1434172933 [0,1,0,1,0,0|1,0,0]=3 248 B16R3.11423 O=C(O)C1C2C1C3=C(C2)C=C(C=C3)Cl Z2604081069 [0,0,0,2,0,0|1,0,0]=3 249 B12R1.20 C=C(C(=O)O)C1=CC=C(C=C1)Cl Z1255421681 [1,0,0,0,1,0|0,0,2]=4 250 B12R1.20 CC(=O)C(C)C1=CC=C(C=C1)Cl Z1276728135 [1,0,0,0,1,0|1,0,0]=3 251 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Br Z1259342200 [1,0,0,0,1,0|0,1,0]=3 252 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Cl Z982129848 [1,0,0,0,1,0|0,0,0]=2 253 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)F Z792377290 [1,0,0,0,1,0|0,1,0]=3 254 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)I Z1269218602 [1,0,0,0,1,0|0,1,0]=3 255 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N Z2935001159 [1,0,0,0,1,0|1,0,0]=3 256 B12R1.20 CC1=CC=C(C=C1)C(C)C(=O)O Z792377274 [1,0,0,0,1,0|1,0,0]=3 257 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)O Z317024662 [1,0,0,0,1,0|1,0,0]=3 258 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Br Z57069227 [1,0,0,0,1,0|1,1,0]=4 259 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl Z1255523404 [1,0,0,0,1,0|1,0,0]=3 260 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)F Z220512688 [1,0,0,0,1,0|1,1,0]=4 261 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br Z317024668 [1,0,0,0,1,0|0,1,0]=3 262 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl Z317024646 [1,0,0,0,1,0|0,0,0]=2 263 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F Z317024670 [1,0,0,0,1,0|0,1,0]=3 264 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O Z1198149764 [1,0,0,0,1,0|1,0,0]=3 265 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F Z1255390982 [1,0,0,0,1,0|0,1,0]=3 266 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O Z1255364887 [1,0,0,0,1,0|1,0,0]=3 267 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)Cl Z381360896 [1,0,0,0,1,0|1,0,1]=4 268 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)F Z1318255176 [1,0,0,0,1,0|1,1,0]=4 269 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Br Z788000726 [1,0,0,0,1,0|1,1,0]=4 270 B12R1.103 CC1=CC=C(O1)C(N)CC(=O)O Z317027374 [1,0,0,0,1,0|2,0,0]=4 271 B12R1.103 CC1=CC=C(O1)[C@@H](N)CC(=O)O Z1270400005 [1,0,0,0,1,0|2,0,0]=4 272 B12R1.103 NC(CC(=O)O)C1=CC(=CS1)Cl Z1269154374 [1,0,0,0,1,0|1,0,0]=3 273 B12R1.103 N[C@H](CC(=O)O)C1=CC=C(S1)Cl Z1696091894 [1,0,0,0,1,0|1,0,0]=3 274 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 Z104479150 [1,0,0,0,1,0|1,0,0]=3 275 B12R1.478 CCC(C(=O)O)C1=CN=CC=C1 Z982129822 [1,0,0,0,1,0|2,0,0]=4 276 B12R1.478 CNC(C(=O)O)C1=CC=CC=C1 Z1259273212 [1,0,0,0,1,0|2,0,0]=4 277 B12R1.478 COC(C(=O)O)C1=CC=CC=C1 Z316258914 [1,0,0,0,1,0|2,0,0]=4 278 B12R1.478 CSC(C(=O)O)C1=CC=CC=C1 Z732206604 [1,0,0,0,1,0|2,0,0]=4 279 B12R1.478 NCC(C(=O)O)C1=CC=CC=C1 Z1913661007 [1,0,0,0,1,0|0,0,0]=2 280 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 Z1080722424 [1,0,0,0,1,0|1,0,0]=3 281 B12R1.478 O=C(O)[C@H](CO)C1=CC=CC=C1 Z1262510670 [1,0,0,0,1,0|1,0,0]=3 282 B14R1.678 NC(CCC(=O)O)C1=CC=C(C=C1)Br Z2856158774 [1,0,0,0,0,1|0,1,0]=3 283 B14R1.678 O=C(O)CCC(=O)C1=CC=C(C=C1)Cl Z56860292 [1,0,0,0,0,1|1,0,1]=4 284 B14R1.678 O=C(O)CNC(=O)C1=CC=C(C=C1)Cl Z56840113 [1,0,0,0,0,1|1,0,1]=4 285 B14R1.698 CC(CC(=O)O)CC1=CC=C(C=C1)Cl Z1269212618 [1,0,0,0,0,1|0,0,0]=2 286 B14R1.698 CC1=CC=C(C=C1)CN(C)CC(=O)O Z1459900471 [1,0,0,0,0,1|2,0,0]=4 287 B14R1.549 CCC(CC(=O)O)CC1=CC=CC=C1 Z1262513310 [1,0,0,0,0,1|1,0,0]=3 288 B14R1.536 CC1=CC=C(C=C1)CC(CN)C(=O)O Z1478043848 [0,0,0,0,1,1|1,0,0]=3 289 B14R1.536 CCC(CC1=CC=C(C=C1)N)C(=O)O Z1262539468 [0,0,0,0,1,1|2,0,0]=4 290 B14R1.536 NCC(CC1=CC=C(C=C1)Cl)C(=O)O Z1222331429 [0,0,0,0,1,1|0,0,0]=2 291 B14R1.536 NCC(CC1=CC=C(C=C1)F)C(=O)N Z367446796 [0,0,0,0,1,1|1,1,0]=4 292 B14R1.536 NCC(OC1=CC=C(C=C1)F)C(=O)O Z1508667025 [0,0,0,0,1,1|0,1,0]=3