0 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 B52541 [0,0,0,0,0,0|1,0,2]=3 1 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 B52417 [0,0,0,0,0,0|0,0,2]=2 2 B12R1.27 COC(=O)C#CC1=CC=CC=C1 M53792 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.27 COC(=O)CCC1=CC=CC=C1 M39604 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.27 COC(=O)COC1=CC=CC=C1 M37813 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.27 COC(=O)NCC1=CC=CC=C1 M50032 [0,0,0,0,0,0|2,0,0]=2 6 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 B53141 [0,0,0,0,0,0|3,0,1]=4 7 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 B67328 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 B53085 [0,0,0,0,0,0|2,0,1]=3 9 B12R1.27 C[C@H](CO)NCC1=CC=CC=C1 B53140 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.27 NCC(=O)OCC1=CC=CC=C1 B67680 [0,0,0,0,0,0|1,0,0]=1 11 B12R1.27 NNC(=O)OCC1=CC=CC=C1 B68841 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.27 O=C(CBr)CCC1=CC=CC=C1 B52666 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 B68284 [0,0,0,0,0,0|1,0,0]=1 14 B12R1.27 O=C(CO)OCC1=CC=CC=C1 B22937 [0,0,0,0,0,0|1,0,0]=1 15 B11R1.28 BrCCCCC1=CC=CC=C1 B52867 [1,0,0,0,0,0|2,0,1]=4 16 B11R1.28 BrCCOCC1=CC=CC=C1 B19978 [1,0,0,0,0,0|1,0,1]=3 17 B11R1.28 C#CCOCC1=CC=CC=C1 P52414 [1,0,0,0,0,0|0,0,3]=4 18 B11R1.28 C=CCOCC1=CC=CC=C1 A52780 [1,0,0,0,0,0|0,0,3]=4 19 B11R1.28 CCCCCC1=CC=CN=C1 P53110 [1,0,0,0,0,0|2,0,1]=4 20 B11R1.28 CCCCCC1=NC=CC=C1 P53109 [1,0,0,0,0,0|2,0,1]=4 21 B11R1.28 CCCNCC1=CC=CC=C1 B22211 [1,0,0,0,0,0|1,0,1]=3 22 B11R1.28 CCOC=NC1=CC=CC=C1 E50019 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.28 CCOCCC1=NC=CC=C1 E69081 [1,0,0,0,0,0|3,0,0]=4 24 B11R1.28 NCCOCC1=CC=CC=C1 B50339 [1,0,0,0,0,0|1,0,1]=3 25 B11R1.28 NCCOCC1=CC=CC=C1 B52169 [1,0,0,0,0,0|1,0,1]=3 26 B11R1.28 O=CCOCC1=CC=CC=C1 B24494 [1,0,0,0,0,0|1,0,2]=4 27 B11R1.28 OCCCCC1=CC=CC=C1 P69087 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.28 OCCOCC1=CC=CC=C1 B24595 [1,0,0,0,0,0|1,0,1]=3 29 B11R1.91 CC(=O)NNC1=CC=CC=C1 P69088 [1,0,0,0,0,0|2,0,0]=3 30 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 P68564 [1,0,0,0,0,0|1,0,1]=3 31 B11R1.91 NC(=O)CSC1=CC=CC=C1 P10024 [1,0,0,0,0,0|3,0,0]=4 32 B11R1.91 NC(=O)OCC1=CC=CC=C1 B37832 [1,0,0,0,0,0|1,0,0]=2 33 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 C61979 [1,0,0,0,0,0|2,0,1]=4 34 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 H52037 [1,0,0,0,0,0|2,0,0]=3 35 B11R1.91 O=C(O)C#CC1=CC=CC=C1 P67832 [1,0,0,0,0,0|2,0,1]=4 36 B11R1.91 O=C(O)CCC1=NC=CC=C1 P49281 [1,0,0,0,0,0|3,0,0]=4 37 B11R1.91 O=C(O)CNC1=CC=CC=C1 P68874 [1,0,0,0,0,0|3,0,0]=4 38 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 C37831 [1,0,0,0,0,0|2,0,1]=4 39 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 N69452 [1,0,0,0,0,0|3,0,0]=4 40 B13R1.11 COC(=O)CC(=O)C1=CC=CC=C1 M52457 [0,1,0,0,0,0|2,0,1]=4 41 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 M54166 [0,1,0,0,0,0|2,0,0]=3 42 B13R1.11 COC(=O)C[C@H](N)C1=NC=CC=C1 M52253 [0,1,0,0,0,0|3,0,0]=4 43 B13R1.14 COC(=O)C=CC1=CC=C(Br)C=C1 M53987 [0,1,0,0,0,0|2,0,1]=4 44 B13R1.14 COC(=O)C=CC1=CC=C(C)C=C1 M54553 [0,1,0,0,0,0|2,0,1]=4 45 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 M52626 [0,1,0,0,0,0|2,0,0]=3 46 B13R1.14 COC(=O)CCC1=CC=C(I)C=C1 M52652 [0,1,0,0,0,0|2,0,0]=3 47 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 M38944 [0,1,0,0,0,0|2,0,0]=3 48 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 M54163 [0,1,0,0,0,0|2,0,0]=3 49 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 M68976 [0,1,0,0,0,0|2,0,0]=3 50 B13R1.14 COC(=O)COC1=CC=C(Cl)C=C1 M51987 [0,1,0,0,0,0|3,0,0]=4 51 B13R1.15 COC(=O)CCC1=CC(O)=CC=C1 M52841 [0,1,0,0,0,0|2,0,0]=3 52 B13R1.15 COC(=O)CCC1=CC=CC(Br)=C1 M38076 [0,1,0,0,0,0|2,0,0]=3 53 B13R1.15 COC(=O)\C=C\C1=CC(N)=CC=C1 M52568 [0,1,0,0,0,0|2,0,1]=4 54 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 P56074 [0,1,0,0,0,0|1,0,0]=2 55 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 E62302 [0,1,0,0,0,0|1,0,1]=3 56 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 P52940 [0,1,0,0,0,0|2,0,0]=3 57 B13R1.42 CCOC(=O)COC1=CN=CC=C1 E50088 [0,1,0,0,0,0|3,0,0]=4 58 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 E69409 [0,1,0,0,0,0|1,0,1]=3 59 B13R1.42 CNCC(=O)OCC1=CC=CC=C1 B62459 [0,1,0,0,0,0|0,0,0]=1 60 B13R1.42 N#CCC(=O)NCC1=CC=CC=C1 B52289 [0,1,0,0,0,0|1,0,1]=3 61 B13R1.42 N#CCC(=O)OCC1=CC=CC=C1 B53915 [0,1,0,0,0,0|0,0,1]=2 62 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 B68220 [0,1,0,0,0,0|0,0,0]=1 63 B13R1.135 CNC(=O)[C@H](N)CC1=CC=CC=C1 A53040 [0,1,0,0,0,0|2,0,0]=3 64 B13R1.135 COC(=O)[C@@H](Br)CC1=CC=CC=C1 M52623 [0,1,0,0,0,0|2,0,0]=3 65 B13R1.135 COC(=O)[C@@H](Cl)CC1=CC=CC=C1 M22031 [0,1,0,0,0,0|2,0,0]=3 66 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 M69265 [0,1,0,0,0,0|2,0,0]=3 67 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 M37251 [0,1,0,0,0,0|2,0,0]=3 68 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 M52845 [0,1,0,0,0,0|2,0,0]=3 69 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 M52844 [0,1,0,0,0,0|2,0,0]=3 70 B13R1.351 CN(N)C(=O)OCC1=CC=CC=C1 B50180 [0,1,0,0,0,0|1,0,0]=2 71 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 A68459 [0,1,0,0,0,0|0,0,0]=1 72 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 A69426 [0,1,0,0,0,0|0,0,0]=1 73 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 X52456 [0,1,0,0,0,0|2,0,1]=4 74 B13R1.417 BrCC(CBr)OCC1=CC=CC=C1 D67115 [0,1,0,0,0,0|2,0,1]=4 75 B13R1.528 COC(=O)C=CC1=C(N)C=CC=C1 M52562 [0,1,0,0,0,0|2,0,1]=4 76 B13R1.528 COC(=O)CCC1=C(Br)C=CC=C1 M52625 [0,1,0,0,0,0|2,0,0]=3 77 B13R2.10 C[C@H]1CCC(C2=CC=CC=C2)N1 M30077 [0,0,0,1,0,0|2,0,1]=4 78 B13R2.10 O=C1CN=C(C2=CC=CC=C2)O1 P37550 [0,0,0,1,0,0|1,0,1]=3 79 B13R2.10 O=C1C[C@H](C2=CC=CC=C2)CN1 P32385 [0,0,0,1,0,0|2,0,0]=3 80 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 P61078 [0,0,0,1,0,0|2,0,0]=3 81 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CS1 P11961 [0,0,0,1,0,0|2,0,0]=3 82 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CS1 P51871 [0,0,0,1,0,0|2,1,0]=4 83 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CS1 P16573 [0,0,0,1,0,0|2,1,0]=4 84 B13R2.33 O=C1CCC2=C(C=CC=C2)CC1 D54551 [0,0,0,1,0,0|1,0,0]=2 85 B13R2.373 O=C1N[C@@H](C2=CC=CC=C2)[C@H]1O H51786 [0,0,0,1,0,0|2,0,0]=3 86 B13R2.2383 C1=CC=C(COC2CNC2)C=C1 B67749 [0,0,0,1,0,0|2,0,1]=4 87 B13R2.15272 COC(=O)[C@@H]1CC2=C1C=CC=C2 M52443 [0,0,0,1,0,0|2,0,0]=3 88 B11R1.25 COC(=O)CCC1=CC=CN1 M32114 [0,0,0,0,1,0|3,0,0]=4 89 B11R1.40 C=CC(=O)NC1=CC=CC=C1 P38034 [0,0,0,0,1,0|1,0,2]=4 90 B11R1.40 C=CC(=O)OC1=CC=CC=C1 P32241 [0,0,0,0,1,0|0,0,2]=3 91 B11R1.40 CNC(=O)CC1=CN=CC=C1 M46657 [0,0,0,0,1,0|2,0,0]=3 92 B11R1.40 COC(=O)CC1=CC=NC=C1 M22906 [0,0,0,0,1,0|2,0,0]=3 93 B11R1.40 COC(=O)CC1=CN=CC=C1 M12485 [0,0,0,0,1,0|2,0,0]=3 94 B11R1.40 COC(=O)CC1=CN=NC=C1 M10235 [0,0,0,0,1,0|3,0,0]=4 95 B11R1.40 COC(=O)CC1=NC=CC=C1 M12486 [0,0,0,0,1,0|2,0,0]=3 96 B11R1.40 COC(=O)CC1=NC=CC=N1 M46001 [0,0,0,0,1,0|3,0,0]=4 97 B11R1.40 COC(=O)CC1=NC=CN=C1 M12293 [0,0,0,0,1,0|3,0,0]=4 98 B11R1.40 COC(=O)CC1=NC=NC=C1 M12914 [0,0,0,0,1,0|3,0,0]=4 99 B11R1.40 COC(=O)CC1=NN=CC=C1 M10253 [0,0,0,0,1,0|3,0,0]=4 100 B11R1.40 COC(=O)OC1=CC=CC=C1 M37596 [0,0,0,0,1,0|1,0,0]=2 101 B11R1.40 NNC(=O)CC1=CC=NC=C1 P9939 [0,0,0,0,1,0|3,0,0]=4 102 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 P69082 [0,0,0,0,1,0|2,0,1]=4 103 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 A38136 [0,0,0,0,1,0|2,0,1]=4 104 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 P64903 [0,0,0,0,1,0|2,0,1]=4 105 B11R1.40 O=C(CBr)NC1=CC=CC=C1 B49021 [0,0,0,0,1,0|2,0,0]=3 106 B11R1.40 O=C(CBr)NC1=CC=CC=C1 B64861 [0,0,0,0,1,0|2,0,0]=3 107 B11R1.40 O=C(CBr)OC1=CC=CC=C1 P48564 [0,0,0,0,1,0|1,0,0]=2 108 B11R1.40 O=C(CCl)NC1=CC=CC=C1 C38641 [0,0,0,0,1,0|2,0,0]=3 109 B11R1.40 OC[C@@H](Br)CC1=CC=CC=C1 B50151 [0,0,0,0,1,0|2,0,1]=4 110 B11R1.40 OC[C@@H](Cl)CC1=CC=CC=C1 C50161 [0,0,0,0,1,0|2,0,1]=4 111 B13R1.718 CCC(=O)COCC1=CC=CC=C1 B54766 [0,0,0,0,0,1|0,0,0]=1 112 B13R1.718 COC(=O)CCNC1=CC=CC=C1 M52952 [0,0,0,0,0,1|2,0,0]=3 113 B13R1.718 COC(=O)CNCC1=CC=CC=C1 M52944 [0,0,0,0,0,1|2,0,0]=3 114 B13R1.718 C[C@H](CBr)COCC1=CC=CC=C1 B54911 [0,0,0,0,0,1|2,0,1]=4 115 B13R1.718 N[C@H](CO)COCC1=CC=CC=C1 A54199 [0,0,0,0,0,1|2,0,1]=4 116 B13R1.718 OC[C@H](O)COCC1=CC=CC=C1 B53094 [0,0,0,0,0,1|1,0,2]=4 117 B13R1.718 O[C@H](CCl)COCC1=CC=CC=C1 C60793 [0,0,0,0,0,1|1,0,2]=4 118 B10R1.17 BrCCCC1=CC=CC=C1 B49960 [2,0,0,0,0,0|1,0,1]=4 119 B10R1.17 BrCCOC1=CC=CC=C1 B68804 [2,0,0,0,0,0|1,0,1]=4 120 B10R1.17 C=COCC1=CC=CC=C1 B26636 [2,0,0,0,0,0|0,0,1]=3 121 B10R1.17 CCCCC1=CC=NC=C1 B50306 [2,0,0,0,0,0|1,0,1]=4 122 B10R1.17 CCCC[N+]1=CC=CC=C1 B52268 [2,0,0,0,0,0|1,0,1]=4 123 B10R1.17 CCCOC1=CC=CC=C1 P50263 [2,0,0,0,0,0|0,0,1]=3 124 B10R1.17 CCNCC1=CC=CC=C1 B39547 [2,0,0,0,0,0|1,0,0]=3 125 B10R1.17 CCNCC1=NC=CC=C1 P46970 [2,0,0,0,0,0|2,0,0]=4 126 B10R1.17 CCOCC1=CC=CC=C1 E50267 [2,0,0,0,0,0|0,0,0]=2 127 B10R1.17 ClCCOC1=CC=CC=C1 C39521 [2,0,0,0,0,0|1,0,1]=4 128 B10R1.17 NCCOC1=CC=CC=C1 P46889 [2,0,0,0,0,0|1,0,1]=4 129 B10R1.17 O=CC#CC1=CC=CC=C1 P68152 [2,0,0,0,0,0|1,0,1]=4 130 B10R1.17 [Mg+]CCCC1=CC=CC=C1 P31712 [2,0,0,0,0,0|1,0,1]=4 131 B12R1.1 CCCCCC1=CC=C(Br)C=C1 B4837 [1,1,0,0,0,0|1,0,1]=4 132 B12R1.1 CCCCCC1=CC=C([Mg+])C=C1 P31797 [1,1,0,0,0,0|1,0,1]=4 133 B12R1.8 BrCCCOCC1=CC=CC=C1 B53016 [1,1,0,0,0,0|0,0,1]=3 134 B12R1.8 NCCCNCC1=CC=CC=C1 B53178 [1,1,0,0,0,0|1,0,1]=4 135 B12R1.8 NCCCOCC1=CC=CC=C1 B53135 [1,1,0,0,0,0|0,0,1]=3 136 B12R1.8 O=CCCOCC1=CC=CC=C1 B1995 [1,1,0,0,0,0|0,0,2]=4 137 B12R1.8 OCCCNCC1=CC=CC=C1 B53134 [1,1,0,0,0,0|1,0,1]=4 138 B12R1.8 OCCCOCC1=CC=CC=C1 B53086 [1,1,0,0,0,0|0,0,1]=3 139 B12R1.30 CCOC[C@H](N)C1=CC=CC=C1 E62365 [1,1,0,0,0,0|2,0,0]=4 140 B12R1.32 CCCC(=O)CC1=CC=CC=C1 P54754 [1,1,0,0,0,0|1,0,1]=4 141 B12R1.252 CC(=O)COCC1=CC=CC=C1 B22478 [1,1,0,0,0,0|0,0,2]=4 142 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 B37631 [1,1,0,0,0,0|0,0,1]=3 143 B12R1.267 COCOCC1=C(Br)C=CC=C1 B65130 [1,1,0,0,0,0|1,0,1]=4 144 B12R1.21 CC(=O)NNC1=CC=C(Br)C=C1 B49191 [1,1,0,0,0,0|2,0,0]=4 145 B12R1.21 CC(=O)\C=C\C1=CC=C(O)C=C1 H64577 [1,1,0,0,0,0|1,0,1]=4 146 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 A50056 [1,1,0,0,0,0|2,0,0]=4 147 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 C51922 [1,1,0,0,0,0|2,0,0]=4 148 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 F51936 [1,1,0,0,0,0|2,0,0]=4 149 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 K51958 [1,1,0,0,0,0|2,0,0]=4 150 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O B39587 [1,1,0,0,0,0|2,0,0]=4 151 B12R1.43 CC(=O)[C@@H](C)CC1=CC=CC=C1 M54757 [1,1,0,0,0,0|1,0,0]=3 152 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 A67883 [1,1,0,0,0,0|2,0,0]=4 153 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O A52116 [1,1,0,0,0,0|2,0,0]=4 154 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O P69134 [1,1,0,0,0,0|2,0,0]=4 155 B12R1.43 O=C(Cl)[C@@H](Br)CC1=CC=CC=C1 B6285 [1,1,0,0,0,0|2,0,0]=4 156 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 B8639 [1,1,0,0,0,0|2,0,0]=4 157 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 H49929 [1,1,0,0,0,0|2,0,0]=4 158 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 H49928 [1,1,0,0,0,0|2,0,0]=4 159 B12R1.43 O=C([O-])N(O)CC1=CC=CC=C1 B49301 [1,1,0,0,0,0|2,0,0]=4 160 B12R1.107 C=C(NC(C)=O)C1=CC=CC=C1 P52545 [1,1,0,0,0,0|1,0,1]=4 161 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 P68692 [1,1,0,0,0,0|1,0,1]=4 162 B12R1.107 CC(=O)N[C@H](C)C1=CC=CC=C1 P65406 [1,1,0,0,0,0|1,0,0]=3 163 B12R1.107 CC(=O)O[C@@H](C)C1=CC=CC=C1 P38479 [1,1,0,0,0,0|0,0,0]=2 164 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 P69050 [1,1,0,0,0,0|2,0,0]=4 165 B12R1.107 C[C@@H](NC(N)=O)C1=CC=CC=C1 P65387 [1,1,0,0,0,0|2,0,0]=4 166 B12R1.107 C[C@H](NC(N)=O)C1=CC=CC=C1 P65388 [1,1,0,0,0,0|2,0,0]=4 167 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 A38671 [1,1,0,0,0,0|2,0,0]=4 168 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 A52121 [1,1,0,0,0,0|2,0,0]=4 169 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 A67450 [1,1,0,0,0,0|2,0,0]=4 170 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 A50069 [1,1,0,0,0,0|2,0,0]=4 171 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 A52115 [1,1,0,0,0,0|2,0,0]=4 172 B12R1.107 O=C(O)C[C@H](O)C1=CC=CC=C1 H69518 [1,1,0,0,0,0|2,0,0]=4 173 B12R1.125 CC(=O)NCC1=C(O)C=CC=C1 H50049 [1,1,0,0,0,0|1,0,0]=3 174 B12R1.125 CC1=C(CCC(=O)O)C=CC=C1 M52804 [1,1,0,0,0,0|2,0,0]=4 175 B12R1.125 O=C(O)CCC1=C(Br)C=CC=C1 B51888 [1,1,0,0,0,0|2,0,0]=4 176 B12R1.125 O=C(O)CCC1=C(Cl)C=CC=C1 C51920 [1,1,0,0,0,0|2,0,0]=4 177 B12R1.125 O=C(O)CCC1=C(F)C=CC=C1 F51934 [1,1,0,0,0,0|2,0,0]=4 178 B12R1.125 O=C(O)CCC1=C(I)C=CC=C1 K51957 [1,1,0,0,0,0|2,0,0]=4 179 B12R1.226 CC1=CC=CC(CCC(=O)O)=C1 M52805 [1,1,0,0,0,0|2,0,0]=4 180 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 H67695 [1,1,0,0,0,0|2,0,0]=4 181 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 B51889 [1,1,0,0,0,0|2,0,0]=4 182 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 C51921 [1,1,0,0,0,0|2,0,0]=4 183 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 F51935 [1,1,0,0,0,0|2,0,0]=4 184 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 M61037 [0,1,0,0,1,0|1,0,1]=4 185 B12R1.34 COC(=O)[C@@H](N)C1=CC=CC=C1 M52118 [0,1,0,0,1,0|1,0,0]=3 186 B12R1.34 COC(=O)[C@@H](O)C1=CC=CC=C1 M60693 [0,1,0,0,1,0|1,0,0]=3 187 B12R1.34 COC(=O)[C@H](C)C1=CC=CC=C1 M52797 [0,1,0,0,1,0|1,0,0]=3 188 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 M68802 [0,1,0,0,1,0|1,0,0]=3 189 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 M69157 [0,1,0,0,1,0|1,0,0]=3 190 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 M69044 [0,1,0,0,1,0|1,0,0]=3 191 B12R1.49 CCC(=O)OC1=CC=C(O)C=C1 H64154 [0,1,0,0,1,0|0,0,0]=2 192 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 M7569 [0,1,0,0,1,0|1,0,0]=3 193 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 M51915 [0,1,0,0,1,0|1,0,0]=3 194 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 M51939 [0,1,0,0,1,0|1,0,0]=3 195 B12R1.49 COC(=O)CC1=CC=C(I)C=C1 M63040 [0,1,0,0,1,0|1,0,0]=3 196 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 M23468 [0,1,0,0,1,0|1,0,0]=3 197 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 M67394 [0,1,0,0,1,0|1,0,0]=3 198 B12R1.49 COC(=O)CC1=CN=C(C)C=C1 M50074 [0,1,0,0,1,0|2,0,0]=4 199 B12R1.49 COC(=O)CC1=CN=C(Cl)C=C1 M25037 [0,1,0,0,1,0|2,0,0]=4 200 B12R1.49 COC(=O)CC1=NC=C(Br)C=C1 M10106 [0,1,0,0,1,0|2,0,0]=4 201 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 F49198 [0,1,0,0,1,0|2,0,0]=4 202 B12R1.49 O=C(CCl)NC1=CC=C(Br)C=C1 B62262 [0,1,0,0,1,0|2,0,0]=4 203 B12R1.50 COC(=O)CC1=CC(Br)=CN=C1 M37671 [0,1,0,0,1,0|2,0,0]=4 204 B12R1.50 COC(=O)CC1=CC(C)=CC=C1 M62750 [0,1,0,0,1,0|1,0,0]=3 205 B12R1.50 COC(=O)CC1=CC(Cl)=NC=C1 M62883 [0,1,0,0,1,0|2,0,0]=4 206 B12R1.50 COC(=O)CC1=CC(N)=CC=C1 M50058 [0,1,0,0,1,0|1,0,0]=3 207 B12R1.50 COC(=O)CC1=CC(N)=CC=C1 M52112 [0,1,0,0,1,0|1,0,0]=3 208 B12R1.50 COC(=O)CC1=CC(O)=CC=C1 M49922 [0,1,0,0,1,0|1,0,0]=3 209 B12R1.50 COC(=O)CC1=CC=CC(Br)=C1 M51891 [0,1,0,0,1,0|1,0,0]=3 210 B12R1.50 COC(=O)CC1=CC=CC(Cl)=C1 M51916 [0,1,0,0,1,0|1,0,0]=3 211 B12R1.50 COC(=O)CC1=CC=CC(Cl)=N1 M48959 [0,1,0,0,1,0|2,0,0]=4 212 B12R1.50 COC(=O)CC1=CC=CC(F)=C1 M51938 [0,1,0,0,1,0|1,0,0]=3 213 B12R1.50 COC(=O)CC1=CN=CC(C)=C1 M29585 [0,1,0,0,1,0|2,0,0]=4 214 B12R1.50 COC(=O)CC1=NC=CC(C)=C1 M50073 [0,1,0,0,1,0|2,0,0]=4 215 B12R1.50 O=C(CCl)NC1=CC(F)=CC=C1 C64587 [0,1,0,0,1,0|2,0,0]=4 216 B12R1.118 CCN(CC)CC1=CC=CC=C1 B60762 [0,1,0,0,1,0|2,0,0]=4 217 B12R1.371 COC(=O)CC1=C(Br)C=CC=C1 M51890 [0,1,0,0,1,0|1,0,0]=3 218 B12R1.371 COC(=O)CC1=C(Br)C=CC=N1 M1596 [0,1,0,0,1,0|2,0,0]=4 219 B12R1.371 COC(=O)CC1=C(Br)C=NC=C1 M63870 [0,1,0,0,1,0|2,0,0]=4 220 B12R1.371 COC(=O)CC1=C(C)C=CC=C1 M62751 [0,1,0,0,1,0|1,0,0]=3 221 B12R1.371 COC(=O)CC1=C(Cl)C=CC=C1 C61032 [0,1,0,0,1,0|1,0,0]=3 222 B12R1.371 COC(=O)CC1=C(N)C=CC=C1 M50057 [0,1,0,0,1,0|1,0,0]=3 223 B12R1.371 COC(=O)CC1=C(N)C=CC=C1 M52111 [0,1,0,0,1,0|1,0,0]=3 224 B12R1.371 COC(=O)CC1=C(O)C=CC=C1 M37939 [0,1,0,0,1,0|1,0,0]=3 225 B14R1.13 COC(=O)CCCC1=CC=C(N)C=C1 M67740 [0,1,0,0,0,1|2,0,0]=4 226 B14R1.520 CCOC(=O)CCNC1=NC=CC=C1 E53049 [0,1,0,0,0,1|2,0,0]=4 227 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 E65599 [0,1,0,0,0,1|1,0,0]=3 228 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 E68308 [0,1,0,0,0,1|1,0,0]=3 229 B14R1.520 CCOC(=O)COCC1=CC=CC=C1 E54787 [0,1,0,0,0,1|0,0,0]=2 230 B14R1.520 CCOC(=O)NCCC1=CC=CC=C1 E54861 [0,1,0,0,0,1|1,0,0]=3 231 B14R1.743 COC(=O)CC(=O)CC1=CC=CC=C1 M54573 [0,1,0,0,0,1|2,0,0]=4 232 B14R1.756 COC(=O)[C@@H](C)OCC1=CC=CC=C1 M67097 [0,1,0,0,0,1|1,0,0]=3 233 B14R1.837 COC(=O)CCCC1=C(O)C=CC=C1 M54799 [0,1,0,0,0,1|2,0,0]=4 234 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(Br)C=C1 M52758 [0,2,0,0,0,0|2,0,0]=4 235 B14R1.11 COC(=O)C[C@@H](N)C1=CC(O)=CC=C1 M54173 [0,2,0,0,0,0|2,0,0]=4 236 B14R1.11 COC(=O)C[C@@H](N)C1=CC=CC(Br)=C1 M52757 [0,2,0,0,0,0|2,0,0]=4 237 B14R1.29 CCOC(=O)C=C(C)C1=CC=CC=C1 E55917 [0,2,0,0,0,0|1,0,1]=4 238 B14R1.29 CCOC(=O)C[C@H](N)C1=CC=CC=C1 E55507 [0,2,0,0,0,0|1,0,0]=3 239 B14R1.29 CCOC(=O)C[C@H](N)C1=CN=CC=C1 E54240 [0,2,0,0,0,0|2,0,0]=4 240 B14R1.29 CCOC(=O)C[C@H](O)C1=CC=CC=C1 E54794 [0,2,0,0,0,0|1,0,0]=3 241 B14R1.85 COC(=O)[C@@H](O)[C@H](N)C1=CC=CC=C1 M11943 [0,2,0,0,0,0|2,0,0]=4 242 B14R1.85 COC(=O)[C@H](O)[C@H](N)C1=CC=CC=C1 M11942 [0,2,0,0,0,0|2,0,0]=4 243 B14R1.5 CCC(=O)C=CC1=CC=C(OC)C=C1 M55919 [0,2,0,0,0,0|1,0,1]=4 244 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(Br)C=C1 M67781 [0,2,0,0,0,0|2,0,0]=4 245 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(F)C=C1 M54134 [0,2,0,0,0,0|2,0,0]=4 246 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 M54169 [0,2,0,0,0,0|2,0,0]=4 247 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 M67908 [0,2,0,0,0,0|2,0,0]=4 248 B14R1.502 CCOC(=O)C#CC1=CC=C(Cl)C=C1 E55405 [0,2,0,0,0,0|1,0,1]=4 249 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 E38388 [0,2,0,0,0,0|1,0,0]=3 250 B14R1.502 CCOC(=O)CCC1=CC=C(Cl)C=C1 E66576 [0,2,0,0,0,0|1,0,0]=3 251 B14R1.502 CCOC(=O)CCC1=CC=C(F)C=C1 E54678 [0,2,0,0,0,0|1,0,0]=3 252 B14R1.502 CCOC(=O)CCC1=CC=C(O)C=C1 E54798 [0,2,0,0,0,0|1,0,0]=3 253 B14R1.502 CCOC(=O)COC1=CC=C(O)C=C1 E65342 [0,2,0,0,0,0|2,0,0]=4 254 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 E54450 [0,2,0,0,0,0|1,0,1]=4 255 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 E61841 [0,2,0,0,0,0|1,0,1]=4 256 B14R1.727 COC(=O)CCC1=C(O)C=C(O)C=C1 M52858 [0,2,0,0,0,0|2,0,0]=4 257 B14R1.32 CCOC(=O)CCC1=CC(C)=CC=C1 E66327 [0,2,0,0,0,0|1,0,0]=3 258 B14R1.32 CCOC(=O)CNC1=CC=CC(Br)=C1 E52756 [0,2,0,0,0,0|2,0,0]=4 259 B14R1.135 COC(=O)[C@@H](N)CC1=CC(O)=CC=C1 M32208 [0,2,0,0,0,0|2,0,0]=4 260 B14R1.135 COC(=O)[C@@H](O)CC1=CC(O)=CC=C1 M52860 [0,2,0,0,0,0|2,0,0]=4 261 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 E68535 [0,2,0,0,0,0|1,0,0]=3 262 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 B36901 [0,2,0,0,0,0|0,0,0]=2 263 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 B54180 [0,2,0,0,0,0|0,0,0]=2 264 B14R1.156 O=C(CCCBr)OCC1=CC=CC=C1 B54663 [0,2,0,0,0,0|0,0,0]=2 265 B14R1.156 O=C(CCCO)OCC1=CC=CC=C1 B61831 [0,2,0,0,0,0|0,0,0]=2 266 B14R1.156 O=C(NCCBr)OCC1=CC=CC=C1 B36632 [0,2,0,0,0,0|0,0,0]=2 267 B14R1.156 [N-]=[N+]=NCC(=O)OCC1=CC=CC=C1 B7849 [0,2,0,0,0,0|1,0,0]=3 268 B14R1.598 CCOC(=O)CCC1=C(Br)C=CC=C1 E54669 [0,2,0,0,0,0|1,0,0]=3 269 B14R1.598 CCOC(=O)COC1=C(O)C=CC=C1 E52853 [0,2,0,0,0,0|2,0,0]=4 270 B14R1.818 CC(=O)CC(=O)NCC1=CC=CC=C1 B68819 [0,2,0,0,0,0|1,0,0]=3 271 B14R1.1107 COC(=O)[C@@](C)(N)CC1=CC=CC=C1 M55508 [0,2,0,0,0,0|2,0,0]=4 272 B14R1.3099 CC(C)(N)C(=O)OCC1=CC=CC=C1 B63200 [0,2,0,0,0,0|0,0,0]=2 273 B14R1.3099 CC(C)(O)C(=O)OCC1=CC=CC=C1 B54797 [0,2,0,0,0,0|0,0,0]=2 274 B14R1.3099 N=C(OCC1=CC=CC=C1)C(Cl)(Cl)Cl B51533 [0,2,0,0,0,0|2,0,0]=4 275 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 P15957 [1,0,0,1,0,0|1,0,1]=4 276 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 P24436 [1,0,0,1,0,0|1,0,1]=4 277 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 P54138 [1,0,0,1,0,0|1,0,1]=4 278 B12R2.2 C1=CC=C([C@@H]2CCCO2)C=C1 P1193 [1,0,0,1,0,0|0,0,1]=3 279 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 P24304 [1,0,0,1,0,0|1,0,1]=4 280 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 P24713 [1,0,0,1,0,0|2,0,0]=4 281 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 P25684 [1,0,0,1,0,0|2,0,0]=4 282 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 P25740 [1,0,0,1,0,0|2,0,0]=4 283 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 P26657 [1,0,0,1,0,0|2,0,0]=4 284 B12R2.41 C1=CC2=C(C=C1)CCNCC2 T10517 [1,0,0,1,0,0|2,0,0]=4 285 B12R2.41 C1=CC2=C(C=C1)CNCCC2 T69161 [1,0,0,1,0,0|1,0,1]=4 286 B12R2.1081 C[C@@H]1NCCC2=C1C=CC=C2 M54143 [1,0,0,1,0,0|2,0,0]=4 287 B12R2.1081 C[C@@H]1NCCC2=C1C=CC=C2 M67524 [1,0,0,1,0,0|2,0,0]=4 288 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 M54144 [1,0,0,1,0,0|1,0,1]=4 289 B12R2.1081 N[C@H]1COCC2=C1C=CC=C2 C63239 [1,0,0,1,0,0|1,0,1]=4 290 B12R2.1081 N[C@H]1COCC2=C1C=CC=C2 D4046 [1,0,0,1,0,0|1,0,1]=4 291 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 P15205 [1,0,0,1,0,0|1,0,0]=3 292 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 C39572 [1,0,0,1,0,0|0,0,0]=2 293 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 D67464 [1,0,0,1,0,0|2,0,0]=4 294 B12R2.24 O=C1NCC2=C(C=CC=C2)N1 D48807 [1,0,0,1,0,0|2,0,0]=4 295 B12R2.18 CN1C(=O)CC2=C1N=CC=C2 M20444 [0,0,0,1,1,0|2,0,0]=4 296 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 M48815 [0,0,0,1,1,0|2,0,0]=4 297 B12R2.18 C[C@@H]1C(=O)NC2=C1C=CC=N2 M18676 [0,0,0,1,1,0|2,0,0]=4 298 B12R2.32 BrCC1=NC2=C(C=CC=C2)O1 B48072 [0,0,0,1,1,0|2,0,0]=4 299 B12R2.32 CCC1=CC2=C(C=CC=C2)N1 E52501 [0,0,0,1,1,0|1,0,1]=4 300 B12R2.32 CCC1=NC2=C(C=CC=C2)N1 E37955 [0,0,0,1,1,0|2,0,0]=4 301 B12R2.32 CCC1=NC2=C(C=CC=C2)O1 E51753 [0,0,0,1,1,0|1,0,0]=3 302 B12R2.32 CCC1=NC2=C(C=CC=N2)O1 E48800 [0,0,0,1,1,0|2,0,0]=4 303 B12R2.32 CSC1=NC2=C(C=CC=C2)O1 M48556 [0,0,0,1,1,0|2,0,0]=4 304 B12R2.32 ClCC1=NC2=C(C=CC=C2)O1 C48088 [0,0,0,1,1,0|2,0,0]=4 305 B12R2.32 OCC1=NC2=C(C=CC=C2)O1 B48459 [0,0,0,1,1,0|2,0,0]=4 306 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 B6949 [0,0,0,1,0,1|1,0,0]=3 307 B14R2.19 O=C1C[C@H](CC2=CC=CC=C2)CO1 B54554 [0,0,0,1,0,1|2,0,0]=4 308 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 B27980 [0,0,0,1,0,1|2,0,0]=4 309 B14R2.31 O=C1CC[C@@H]1OCC2=CC=CC=C2 B13430 [0,0,0,1,0,1|0,0,0]=2 310 B14R2.31 O[C@@H]1CC[C@@H]1OCC2=CC=CC=C2 B18932 [0,0,0,1,0,1|0,0,2]=4 311 B14R2.68 O=C1CCC(C2=CC=CC=C2)CC1 P39676 [0,0,0,1,0,1|1,0,0]=3 312 B14R2.68 O=C1CCN(C2=CC=CC=C2)CC1 P54629 [0,0,0,1,0,1|1,0,0]=3 313 B14R2.68 O=C1CCN(C2=CC=NC=C2)CC1 P52686 [0,0,0,1,0,1|2,0,0]=4 314 B14R2.68 O=C1CN[C@@H](C2=CC=CC=C2)CO1 P19914 [0,0,0,1,0,1|1,0,0]=3 315 B14R2.68 O=C1CN[C@@H](C2=CC=CC=C2)CO1 P54109 [0,0,0,1,0,1|1,0,0]=3 316 B14R2.68 O=C1COC(C2=CC=CC=C2)OC1 P52455 [0,0,0,1,0,1|1,0,0]=3 317 B14R2.21 O=C1COC[C@@H](C2=CC=CC=C2)N1 P52557 [0,1,0,1,0,0|1,0,0]=3 318 B14R2.20 O=C1CC[C@@H](C2=CC=C(Br)C=C2)N1 B52394 [0,1,0,1,0,0|1,0,0]=3 319 B14R2.20 O=C1CC[C@@H](C2=CC=C(O)C=C2)N1 H52567 [0,1,0,1,0,0|1,0,0]=3 320 B14R2.20 O=C1C[C@H](C2=CC=C(Cl)C=C2)CN1 C52398 [0,1,0,1,0,0|2,0,0]=4 321 B14R2.20 O=C1C[C@H](C2=CC=C(F)C=C2)CN1 F52400 [0,1,0,1,0,0|2,0,0]=4 322 B14R2.20 O=C1NC[C@@H](C2=CC=C(Br)C=C2)O1 B61250 [0,1,0,1,0,0|1,0,0]=3 323 B14R2.22 O=C1C[C@H](C2=CC=CC(Br)=C2)CN1 B5360 [0,1,0,1,0,0|2,0,0]=4 324 B14R2.29369 CN1C(=O)CCC2=C1C=CC(Br)=C2 B15177 [0,1,0,1,0,0|2,0,0]=4 325 B14R2.436 BrC1CC(OCC2=CC=CC=C2)C1 B19857 [0,1,0,1,0,0|1,0,1]=4 326 B14R2.436 N[C@H]1C[C@@H](OCC2=CC=CC=C2)C1 B11941 [0,1,0,1,0,0|1,0,1]=4 327 B14R2.436 N[C@H]1C[C@H](OCC2=CC=CC=C2)C1 B13219 [0,1,0,1,0,0|1,0,1]=4 328 B14R2.436 OC1CC(OCC2=CC=CC=C2)C1 B11665 [0,1,0,1,0,0|1,0,1]=4 329 B14R2.436 O[C@H]1C[C@@H](OCC2=CC=CC=C2)C1 B22528 [0,1,0,1,0,0|1,0,1]=4 330 B14R2.436 O[C@H]1C[C@H](OCC2=CC=CC=C2)C1 B19268 [0,1,0,1,0,0|1,0,1]=4 331 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 M52572 [0,1,0,1,0,0|0,0,0]=2 332 B14R2.972 COC(=O)[C@@H]1CC2=C(C=CC=C2)N1 M66075 [0,1,0,1,0,0|2,0,0]=4 333 B14R2.256 O=C1CC[C@H](C2=C(F)C=CC=C2)C1 F37688 [0,1,0,1,0,0|1,0,0]=3 334 B10R1.18 CC(=O)CC1=CC=NC=C1 P49256 [1,0,0,0,1,0|1,0,0]=3 335 B10R1.18 CC(=O)CC1=NC=CC=C1 P15826 [1,0,0,0,1,0|1,0,0]=3 336 B10R1.18 CC(=O)NC1=CC=CC=C1 A60649 [1,0,0,0,1,0|1,0,0]=3 337 B10R1.18 CC(=O)NC1=CN=CC=C1 P63567 [1,0,0,0,1,0|2,0,0]=4 338 B10R1.18 CC(C)=CC1=CC=CC=C1 M52675 [1,0,0,0,1,0|1,0,1]=4 339 B10R1.18 N=C(N)CC1=CC=CC=C1 P22633 [1,0,0,0,1,0|2,0,0]=4 340 B10R1.18 NC(=O)CC1=CC=CC=C1 P69172 [1,0,0,0,1,0|1,0,0]=3 341 B10R1.18 NC(=O)CC1=CN=CC=C1 P45977 [1,0,0,0,1,0|2,0,0]=4 342 B10R1.18 NC(=O)OC1=CC=CC=C1 P45812 [1,0,0,0,1,0|1,0,0]=3 343 B10R1.18 O=C(O)CC1=CC=NC=C1 P46551 [1,0,0,0,1,0|2,0,0]=4 344 B10R1.18 O=C(O)CC1=CN=CC=C1 P39426 [1,0,0,0,1,0|2,0,0]=4 345 B10R1.18 O=C(O)CC1=NC=CC=C1 P18563 [1,0,0,0,1,0|2,0,0]=4 346 B10R1.18 O=C(O)CC1=NC=CC=C1 P38331 [1,0,0,0,1,0|2,0,0]=4 347 B10R1.18 S=C(Cl)OC1=CC=CC=C1 P37341 [1,0,0,0,1,0|1,1,0]=4 348 B10R1.66 CC(=O)OCC1=CC=CO1 F39416 [1,0,0,0,1,0|1,0,0]=3 349 B10R1.66 CC(=S)OCC1=CC=CO1 F46246 [1,0,0,0,1,0|1,1,0]=4 350 B10R1.27 COC(=O)CC1=CSC=C1 M12831 [0,0,0,0,2,0|2,0,0]=4 351 B10R1.15 C=C(CC)C1=CC=CC=C1 B52673 [0,0,0,0,2,0|1,0,0]=3 352 B10R1.15 CCC(=O)C1=CN=CC=C1 P49262 [0,0,0,0,2,0|1,0,0]=3 353 B10R1.15 CCC(=O)C1=NC=CC=N1 P61892 [0,0,0,0,2,0|2,0,0]=4 354 B10R1.15 CCC(=O)C1=NC=CN=C1 P14589 [0,0,0,0,2,0|2,0,0]=4 355 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 P39004 [0,0,0,0,2,0|1,0,1]=4 356 B10R1.15 COC(=O)C1=CC=NC=C1 M64933 [0,0,0,0,2,0|2,0,0]=4 357 B10R1.15 COC(=O)C1=NC=CC=C1 M28469 [0,0,0,0,2,0|2,0,0]=4 358 B10R1.15 CO[S@@](=O)C1=CC=CC=C1 M46243 [0,0,0,0,2,0|2,0,0]=4 359 B10R1.15 NNC(=O)C1=CC=CC=C1 B69029 [0,0,0,0,2,0|2,0,0]=4 360 B10R1.15 O=C(CBr)C1=CN=CC=C1 B68250 [0,0,0,0,2,0|2,0,0]=4 361 B10R1.15 O=C(CBr)C1=NC=CC=C1 B45477 [0,0,0,0,2,0|2,0,0]=4 362 B10R1.15 O=C(CCl)C1=CN=CC=C1 C45489 [0,0,0,0,2,0|2,0,0]=4 363 B10R1.15 O=C(CO)C1=CC=CC=C1 H67472 [0,0,0,0,2,0|1,0,0]=3 364 B10R1.15 O=CC(=O)C1=CC=CC=C1 P48113 [0,0,0,0,2,0|1,0,1]=4 365 B14R1.716 COC(=O)CCNCC1=CC=CC=C1 M54865 [0,0,0,0,0,2|2,0,0]=4 366 B14R1.716 COC(=O)CCOCC1=CC=CC=C1 M54788 [0,0,0,0,0,2|1,0,0]=3