0 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SC-83281 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 SC-80359 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 SC-A2296 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.91 N=C(N)NCC1=CC=CC=C1 SC-A4867 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.91 NC(=O)OCC1=CC=CC=C1 SC-47828 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.91 N\C(S)=N/CC1=CC=CC=C1 SC-81144 [0,0,0,0,0,0|3,1,0]=4 6 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 SC-06047 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SC-13741 [0,0,0,0,0,0|1,0,1]=2 8 B11R1.91 O=C(O)CCC1=NC=CC=C1 SC-50767 [0,0,0,0,0,0|2,0,0]=2 9 B11R1.91 O=C(O)CCC1=NC=CC=N1 SC-22039 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.91 O=C(O)CNC1=CC=CC=C1 SC-75650 [0,0,0,0,0,0|1,0,0]=1 11 B11R1.91 O=C(O)CNC1=CC=CN=C1 SC-A2839 [0,0,0,0,0,0|2,0,0]=2 12 B11R1.91 O=C(O)COC1=CC=CN=C1 SC-47923 [0,0,0,0,0,0|1,0,0]=1 13 B11R1.91 O=C(O)CSC1=NC=CC=N1 SC-77923 [0,0,0,0,0,0|2,1,0]=3 14 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 SC-39613 [0,0,0,0,0,0|2,0,1]=3 15 B11R1.91 O=C(O)\C=C\C1=CN=CC=C1 SC-57973 [0,0,0,0,0,0|2,0,1]=3 16 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 SC-62388 [0,0,0,0,0,0|2,0,1]=3 17 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 SC-90388 [0,0,0,0,0,0|2,0,2]=4 18 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 SC-53253 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.17 C=CCSC1=CC=CC=C1 SC-A2865 [1,0,0,0,0,0|1,1,0]=3 20 B10R1.17 ICCCC1=CC=CC=C1 SC-54412 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.17 N#CCOC1=CC=CC=C1 SC-26904 [1,0,0,0,0,0|1,0,1]=3 22 B10R1.17 NCCOC1=CC=CC=C1 SC-25696 [1,0,0,0,0,0|1,0,1]=3 23 B10R1.17 NOCCC1=CC=CC=C1 SC-99889 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.17 O=C=NCC1=CC=CC=C1 SC-27328 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.17 O=CCCC1=CC=CC=C1 SC-79262 [1,0,0,0,0,0|1,0,0]=2 26 B10R1.17 O=CCCC1=CN=CC=C1 SC-14308 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.17 O=C\C=C\C1=CC=CC=C1 SC-19143 [1,0,0,0,0,0|1,0,1]=3 28 B10R1.17 OCCCC1=CC=CC=C1 SC-26828 [1,0,0,0,0,0|1,0,1]=3 29 B10R1.17 OCCCC1=CC=NC=C1 SC-19784 [1,0,0,0,0,0|2,0,1]=4 30 B10R1.17 OCCNC1=CC=CC=C1 SC-47141 [1,0,0,0,0,0|1,0,1]=3 31 B10R1.17 OCCSC1=CC=CC=C1 SC-46195 [1,0,0,0,0,0|0,1,1]=3 32 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 SC-51184 [1,0,0,0,0,0|3,0,0]=4 33 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 SC-01266 [0,1,0,0,0,0|1,0,0]=2 34 B12R1.21 N=C(N)CCC1=CC=C(Cl)C=C1 SC-54614 [0,1,0,0,0,0|3,0,0]=4 35 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 SC-65225 [0,1,0,0,0,0|1,0,1]=3 36 B12R1.21 O=C(Cl)COC1=CC=C(F)C=C1 SC-97746 [0,1,0,0,0,0|1,0,0]=2 37 B12R1.21 O=C(O)C#CC1=CC=C(Cl)C=C1 SC-14663 [0,1,0,0,0,0|1,0,1]=3 38 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 SC-26484 [0,1,0,0,0,0|1,0,0]=2 39 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 SC-16870 [0,1,0,0,0,0|1,0,0]=2 40 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 SC-45457 [0,1,0,0,0,0|1,0,0]=2 41 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 SC-13665 [0,1,0,0,0,0|1,0,0]=2 42 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 SC-48332 [0,1,0,0,0,0|1,0,0]=2 43 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 SC-25784 [0,1,0,0,0,0|1,0,0]=2 44 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 SC-17666 [0,1,0,0,0,0|0,0,0]=1 45 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 SC-00565 [0,1,0,0,0,0|1,0,1]=3 46 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 SC-01473 [0,1,0,0,0,0|1,0,1]=3 47 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 SC-28823 [0,1,0,0,0,0|1,0,1]=3 48 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 SC-25929 [0,1,0,0,0,0|1,0,1]=3 49 B12R1.21 O=C(O)\C=C\C1=CN=C(Cl)C=C1 SC-26343 [0,1,0,0,0,0|2,0,1]=4 50 B12R1.27 C#CC(=O)OCC1=CC=CC=C1 SC-36441 [0,1,0,0,0,0|3,0,0]=4 51 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 SC-21489 [0,1,0,0,0,0|3,0,0]=4 52 B12R1.27 CC(COC1=CC=CC=C1)NN SC-95788 [0,1,0,0,0,0|2,0,1]=4 53 B12R1.27 COC(=O)CCC1=CC=CC=C1 SC-15551 [0,1,0,0,0,0|1,0,0]=2 54 B12R1.27 COC(=O)COC1=CC=CC=C1 SC-95721 [0,1,0,0,0,0|0,0,0]=1 55 B12R1.27 COC(=O)\C=C\C1=CC=NC=C1 SC-44851 [0,1,0,0,0,0|2,0,1]=4 56 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SC-12034 [0,1,0,0,0,0|3,0,0]=4 57 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SC-21071 [0,1,0,0,0,0|3,0,0]=4 58 B12R1.27 NNC(=O)CCC1=CC=NC=C1 SC-40186 [0,1,0,0,0,0|3,0,0]=4 59 B12R1.27 NNC(=O)OCC1=CC=CC=C1 SC-13650 [0,1,0,0,0,0|3,0,0]=4 60 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 SC-05223 [0,1,0,0,0,0|3,0,0]=4 61 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 SC-54022 [0,1,0,0,0,0|3,0,0]=4 62 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 SC-25618 [0,1,0,0,0,0|3,0,0]=4 63 B12R1.27 O=C(CO)OCC1=CC=CC=C1 SC-A2141 [0,1,0,0,0,0|2,0,0]=3 64 B12R1.27 O=C(NO)OCC1=CC=CC=C1 SC-31135 [0,1,0,0,0,0|2,0,0]=3 65 B12R1.27 OCC(O)COC1=CC=CC=C1 SC-16362 [0,1,0,0,0,0|0,0,2]=3 66 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 SC-09787 [0,1,0,0,0,0|2,0,0]=3 67 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O SC-01259 [0,1,0,0,0,0|1,0,0]=2 68 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O SC-09766 [0,1,0,0,0,0|1,0,0]=2 69 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SC-09765 [0,1,0,0,0,0|1,0,0]=2 70 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O SC-03978 [0,1,0,0,0,0|2,0,0]=3 71 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 SC-45736 [0,1,0,0,0,0|1,0,0]=2 72 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SC-96045 [0,1,0,0,0,0|1,0,0]=2 73 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 SC-02277 [0,1,0,0,0,0|1,0,0]=2 74 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 SC-06556 [0,1,0,0,0,0|1,0,0]=2 75 B12R1.43 [C@H](N)(CC1=CC=NC=C1)C(=O)O SC-19508 [0,1,0,0,0,0|2,0,0]=3 76 B12R1.107 CC(=O)CC(=O)C1=NC=CC=C1 SC-29302 [0,1,0,0,0,0|3,0,0]=4 77 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 SC-A2836 [0,1,0,0,0,0|1,0,0]=2 78 B12R1.107 NC(=O)CC(=O)C1=CC=CC=C1 SC-84768 [0,1,0,0,0,0|2,0,0]=3 79 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 SC-45519 [0,1,0,0,0,0|1,0,0]=2 80 B12R1.107 N[C@H](CC(=O)O)C1=CC=CN=C1 SC-82383 [0,1,0,0,0,0|2,0,0]=3 81 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 SC-19254 [0,1,0,0,0,0|1,0,0]=2 82 B12R1.125 CC1=CC=CC=C1CCC(=O)O SC-27982 [0,1,0,0,0,0|1,0,0]=2 83 B12R1.125 O=C(O)CCC1=CC=CC=C1Br SC-17877 [0,1,0,0,0,0|1,0,0]=2 84 B12R1.125 O=C(O)CNC1=CC=CC=C1F SC-92918 [0,1,0,0,0,0|1,0,0]=2 85 B12R1.125 O=C(O)COC1=CC=CC=C1F SC-50195 [0,1,0,0,0,0|0,0,0]=1 86 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br SC-81630 [0,1,0,0,0,0|1,0,1]=3 87 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl SC-03976 [0,1,0,0,0,0|1,0,1]=3 88 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 SC-13720 [0,1,0,0,0,0|1,0,0]=2 89 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 SC-84996 [0,1,0,0,0,0|0,0,0]=1 90 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 SC-92718 [0,1,0,0,0,0|1,0,1]=3 91 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 SC-02327 [0,1,0,0,0,0|1,0,1]=3 92 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 SC-35877 [0,0,0,1,0,0|2,0,0]=3 93 B12R2.24 CC1=CC2=C(C=CC=C2)CC1 SC-88943 [0,0,0,1,0,0|3,0,0]=4 94 B12R2.24 NC1COC2=CC=CC=C2C1 SC-61243 [0,0,0,1,0,0|2,0,1]=4 95 B12R2.24 N[C@H]1COC2=CC=CC=C2C1 SC-51777 [0,0,0,1,0,0|2,0,1]=4 96 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 SC-90927 [0,0,0,1,0,0|3,0,0]=4 97 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SC-16512 [0,0,0,1,0,0|3,0,0]=4 98 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 SC-17975 [0,0,0,1,0,0|2,0,0]=3 99 B12R2.24 O=C1CCC2=CC=CC=C2N1 SC-18489 [0,0,0,1,0,0|2,0,0]=3 100 B12R2.24 O=C1NCC2=C(C=CC=C2)N1 SC-24920 [0,0,0,1,0,0|3,0,0]=4 101 B12R2.24 OC1=CC2=C(C=CC=C2)C=N1 SC-27580 [0,0,0,1,0,0|3,0,0]=4 102 B12R2.24 OC1=CC2=CC=CC=C2N=C1 SC-47514 [0,0,0,1,0,0|2,0,1]=4 103 B12R2.3190 O=C(O)C1=CC2=CC=CC=C21 SC-19627 [0,0,0,1,0,0|1,0,1]=3 104 B10R1.18 BrC(Br)=CC1=CC=CC=C1 SC-04543 [0,0,0,0,1,0|2,0,1]=4 105 B10R1.18 CC(=O)CC1=NC=CC=C1 SC-85146 [0,0,0,0,1,0|2,0,0]=3 106 B10R1.18 N=C(N)CC1=CC=CC=C1 SC-12266 [0,0,0,0,1,0|2,0,0]=3 107 B10R1.18 N=C(N)CC1=CC=CC=C1 SC-17307 [0,0,0,0,1,0|2,0,0]=3 108 B10R1.18 N=C(N)NC1=CC=CC=C1 SC-43561 [0,0,0,0,1,0|3,0,0]=4 109 B10R1.18 N=C(N)NC1=CC=CC=C1 SC-51091 [0,0,0,0,1,0|3,0,0]=4 110 B10R1.18 N=C(N)NC1=CC=CC=C1 SC-93527 [0,0,0,0,1,0|3,0,0]=4 111 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 SC-78519 [0,0,0,0,1,0|2,0,0]=3 112 B10R1.18 NC(=S)NC1=CC=CC=C1 SC-22772 [0,0,0,0,1,0|2,1,0]=4 113 B10R1.18 O=C(Cl)OC1=CC=CC=C1 SC-18821 [0,0,0,0,1,0|1,0,0]=2 114 B10R1.18 O=C(O)CC1=CC=CN=C1 SC-12152 [0,0,0,0,1,0|1,0,0]=2 115 B10R1.18 O=C(O)CC1=CC=CN=C1 SC-16916 [0,0,0,0,1,0|1,0,0]=2 116 B10R1.18 O=C(O)CC1=CC=NC=C1 SC-80508 [0,0,0,0,1,0|1,0,0]=2 117 B10R1.18 O=C(O)CC1=CN=CN=C1 SC-47534 [0,0,0,0,1,0|2,0,0]=3 118 B10R1.18 O=C(O)CC1=NC=CC=C1 SC-20933 [0,0,0,0,1,0|1,0,0]=2 119 B10R1.18 O=C(O)CC1=NC=CC=C1 SC-26574 [0,0,0,0,1,0|1,0,0]=2 120 B10R1.18 O=C(O)CC1=NC=CC=N1 SC-21888 [0,0,0,0,1,0|2,0,0]=3 121 B10R1.18 O=C(O)CC1=NC=CN=C1 SC-25279 [0,0,0,0,1,0|2,0,0]=3 122 B10R1.18 OC(=S)CC1=CC=CC=C1 SC-46270 [0,0,0,0,1,0|0,1,0]=2 123 B10R1.66 O=C(O)CCC1=CC=CO1 SC-51380 [0,0,0,0,1,0|2,0,0]=3 124 B10R1.66 O=C(O)CCC1=CSC=C1 SC-48358 [0,0,0,0,1,0|2,0,0]=3 125 B10R1.66 O=C(O)CCN1C=CN=C1 SC-04130 [0,0,0,0,1,0|3,0,0]=4 126 B10R1.66 O=C(O)\C=C\C1=CC=CN1 SC-39811 [0,0,0,0,1,0|2,0,1]=4 127 B10R1.66 O=C(O)\C=C\C1=COC=C1 SC-84399 [0,0,0,0,1,0|2,0,1]=4 128 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 SC-71520 [0,0,0,0,0,1|2,0,0]=3 129 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 SC-20864 [0,0,0,0,0,1|1,0,0]=2 130 B12R1.252 O=C(O)CCCC1=CC=CC=C1 SC-22740 [0,0,0,0,0,1|1,0,0]=2 131 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SC-24828 [0,0,0,0,0,1|1,0,0]=2 132 B12R1.252 O=C(O)COCC1=CC=CC=C1 SC-11831 [0,0,0,0,0,1|0,0,0]=1 133 B9R1.8 C=C[CH-]C1=CC=CC=C1 SC-68388 [2,0,0,0,0,0|1,0,1]=4 134 B9R1.8 CCCC1=CC=CC=C1 SC-46265 [2,0,0,0,0,0|1,0,1]=4 135 B9R1.8 N#COC1=CC=CC=C1 SC-86277 [2,0,0,0,0,0|1,0,1]=4 136 B9R1.8 NNCC1=CC=CC=C1 SC-12386 [2,0,0,0,0,0|2,0,0]=4 137 B9R1.8 NNCC1=CC=CC=C1 SC-13294 [2,0,0,0,0,0|2,0,0]=4 138 B9R1.8 NNCC1=CC=CC=C1 SC-54871 [2,0,0,0,0,0|2,0,0]=4 139 B9R1.8 NOCC1=CC=CC=C1 SC-03026 [2,0,0,0,0,0|2,0,0]=4 140 B9R1.8 NOCC1=CC=CC=C1 SC-53752 [2,0,0,0,0,0|2,0,0]=4 141 B9R1.8 O=CCC1=CC=CC=C1 SC-19014 [2,0,0,0,0,0|0,0,0]=2 142 B9R1.8 O=CCC1=CC=CN=C1 SC-45710 [2,0,0,0,0,0|1,0,0]=3 143 B9R1.8 OCCC1=CC=CN=C1 SC-14117 [2,0,0,0,0,0|1,0,1]=4 144 B9R1.8 OCCC1=CC=NC=C1 SC-45381 [2,0,0,0,0,0|1,0,1]=4 145 B9R1.8 ONCC1=CC=CC=C1 SC-48362 [2,0,0,0,0,0|1,0,0]=3 146 B11R1.1 ClCCOC1=CC=C(Cl)C=C1 SC-78390 [1,1,0,0,0,0|1,0,1]=4 147 B11R1.1 N#CCOC1=CC=C(Cl)C=C1 SC-73140 [1,1,0,0,0,0|1,0,1]=4 148 B11R1.1 NC1=CC=C(OCCO)C=C1 SC-A3885 [1,1,0,0,0,0|0,0,1]=3 149 B11R1.1 NCCOC1=CC=C(Cl)C=C1 SC-93894 [1,1,0,0,0,0|1,0,1]=4 150 B11R1.1 O=C\C=C\C1=CC=C(Br)C=C1 SC-92326 [1,1,0,0,0,0|1,0,1]=4 151 B11R1.1 OCCCC1=CC=C(Br)C=C1 SC-02925 [1,1,0,0,0,0|1,0,1]=4 152 B11R1.1 OCCCC1=CC=C(Cl)C=C1 SC-46522 [1,1,0,0,0,0|1,0,1]=4 153 B11R1.1 OCCCC1=CC=C(F)C=C1 SC-13040 [1,1,0,0,0,0|1,0,1]=4 154 B11R1.1 OCCOC1=NC=C(Br)C=C1 SC-88310 [1,1,0,0,0,0|1,0,1]=4 155 B11R1.16 CN(CCO)C1=CC=CC=C1 SC-76538 [1,1,0,0,0,0|1,0,1]=4 156 B11R1.16 NC(CCO)C1=CC=CC=C1 SC-21156 [1,1,0,0,0,0|1,0,1]=4 157 B11R1.16 NC(CCO)C1=CC=CC=C1 SC-21837 [1,1,0,0,0,0|1,0,1]=4 158 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 SC-24748 [1,1,0,0,0,0|1,0,1]=4 159 B11R1.17 NC1=CC=CC=C1NCCO SC-28813 [1,1,0,0,0,0|1,0,1]=4 160 B11R1.17 NC1=CC=CC=C1OCCO SC-A2048 [1,1,0,0,0,0|0,0,1]=3 161 B11R1.17 O=CCCC1=CC=CC=C1F SC-35091 [1,1,0,0,0,0|1,0,0]=3 162 B11R1.17 O=C\C=C\C1=CC=CC=C1O SC-92694 [1,1,0,0,0,0|1,0,1]=4 163 B11R1.17 O=C\C=C\C1=CC=CC=C1O SC-92985 [1,1,0,0,0,0|1,0,1]=4 164 B11R1.17 OCCCC1=CC=CC=C1Br SC-24750 [1,1,0,0,0,0|1,0,1]=4 165 B11R1.24 O=CCCC1=CC=CC(Cl)=C1 SC-03691 [1,1,0,0,0,0|1,0,0]=3 166 B11R1.24 OCCCC1=CC=CC(F)=C1 SC-A3854 [1,1,0,0,0,0|1,0,1]=4 167 B11R1.28 BrCCCOC1=CC=CC=C1 SC-76960 [1,1,0,0,0,0|1,0,1]=4 168 B11R1.28 BrCCOCC1=CC=CC=C1 SC-57855 [1,1,0,0,0,0|1,0,1]=4 169 B11R1.28 C#CCOCC1=CC=CC=C1 SC-14312 [1,1,0,0,0,0|1,0,1]=4 170 B11R1.28 ClCCOCC1=CC=CC=C1 SC-12134 [1,1,0,0,0,0|1,0,1]=4 171 B11R1.28 ICCOCC1=CC=CC=C1 SC-A2944 [1,1,0,0,0,0|1,0,1]=4 172 B11R1.28 O=CCCCC1=CC=CC=C1 SC-59796 [1,1,0,0,0,0|1,0,0]=3 173 B11R1.28 O=CCOCC1=CC=CC=C1 SC-47403 [1,1,0,0,0,0|0,0,0]=2 174 B11R1.28 OCCCCC1=CC=CC=C1 SC-03572 [1,1,0,0,0,0|1,0,1]=4 175 B11R1.28 OCCNCC1=CC=CC=C1 SC-47199 [1,1,0,0,0,0|1,0,1]=4 176 B11R1.28 OCCOCC1=CC=CC=C1 SC-05822 [1,1,0,0,0,0|0,0,1]=3 177 B11R1.40 C=CC(=O)OC1=CC=CC=C1 SC-20325 [1,1,0,0,0,0|1,0,1]=4 178 B11R1.40 NC(CO)CC1=CC=CC=C1 SC-22471 [1,1,0,0,0,0|1,0,1]=4 179 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 SC-05056 [1,1,0,0,0,0|1,0,1]=4 180 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 SC-03394 [1,1,0,0,0,0|1,0,1]=4 181 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 SC-11518 [0,1,0,0,1,0|1,0,0]=3 182 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 SC-27103 [0,1,0,0,1,0|2,0,0]=4 183 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 SC-27289 [0,1,0,0,1,0|2,0,0]=4 184 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 SC-68858 [0,1,0,0,1,0|2,0,0]=4 185 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 SC-19146 [0,1,0,0,1,0|2,0,0]=4 186 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 SC-53062 [0,1,0,0,1,0|2,0,0]=4 187 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 SC-62258 [0,1,0,0,1,0|1,0,0]=3 188 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 SC-13885 [0,1,0,0,1,0|1,0,0]=3 189 B11R1.20 CC1=CC=C(OC(=O)Cl)C=C1 SC-96340 [0,1,0,0,1,0|1,0,0]=3 190 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 SC-17262 [0,1,0,0,1,0|1,0,0]=3 191 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 SC-16964 [0,1,0,0,1,0|1,0,0]=3 192 B11R1.20 O=C(Cl)OC1=CC=C(Br)C=C1 SC-72486 [0,1,0,0,1,0|1,0,0]=3 193 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 SC-02020 [0,1,0,0,1,0|0,0,0]=2 194 B11R1.20 O=C(O)CC1=CC=C(Br)N=C1 SC-86768 [0,1,0,0,1,0|1,0,0]=3 195 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 SC-17561 [0,1,0,0,1,0|0,0,0]=2 196 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 SC-13225 [0,1,0,0,1,0|1,0,0]=3 197 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 SC-33534 [0,1,0,0,1,0|1,0,0]=3 198 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 SC-51583 [0,1,0,0,1,0|1,0,0]=3 199 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 SC-19433 [0,1,0,0,1,0|0,0,1]=3 200 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 SC-81678 [0,1,0,0,1,0|1,0,1]=4 201 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 SC-15490 [0,1,0,0,1,0|0,0,0]=2 202 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 SC-06768 [0,1,0,0,1,0|0,0,0]=2 203 B11R1.36 C[C@@H](C(N)=O)C1=CC=CC=C1 SC-29036 [0,1,0,0,1,0|1,0,0]=3 204 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 SC-73565 [0,1,0,0,1,0|1,0,0]=3 205 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 SC-11836 [0,1,0,0,1,0|1,0,0]=3 206 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 SC-46253 [0,1,0,0,1,0|0,0,0]=2 207 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 SC-59447 [0,1,0,0,1,0|1,0,0]=3 208 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 SC-12537 [0,1,0,0,1,0|0,0,1]=3 209 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 SC-01673 [0,1,0,0,1,0|0,0,0]=2 210 B11R1.36 [C@@H](C)(C(=O)O)C1=CC=CC=C1 SC-06767 [0,1,0,0,1,0|0,0,0]=2 211 B11R1.86 CC(=O)CC1=CC=CC=C1Cl SC-44334 [0,1,0,0,1,0|1,0,0]=3 212 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 SC-05751 [0,1,0,0,1,0|2,0,0]=4 213 B11R1.86 CC(=O)NC1=CC=CC=C1N SC-67459 [0,1,0,0,1,0|2,0,0]=4 214 B11R1.86 CC1=CC=CC=C1CC(=O)Cl SC-40364 [0,1,0,0,1,0|1,0,0]=3 215 B11R1.86 NC(=O)CC1=CC=CC=C1Br SC-29203 [0,1,0,0,1,0|1,0,0]=3 216 B11R1.86 O=C(Cl)CC1=CC=CC=C1F SC-82872 [0,1,0,0,1,0|1,0,0]=3 217 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 SC-02004 [0,1,0,0,1,0|0,0,0]=2 218 B11R1.86 O=C(O)CC1=C(F)N=CC=C1 SC-33640 [0,1,0,0,1,0|1,0,0]=3 219 B11R1.86 O=C(O)CC1=CC=CC=C1Cl SC-15304 [0,1,0,0,1,0|0,0,0]=2 220 B11R1.86 O=C(O)CC1=CC=CC=C1F SC-04601 [0,1,0,0,1,0|0,0,0]=2 221 B11R1.86 O=C(O)CC1=CC=CC=C1I SC-02003 [0,1,0,0,1,0|0,0,0]=2 222 B11R1.86 O=C(O)CC1=CC=CC=C1O SC-22392 [0,1,0,0,1,0|0,0,0]=2 223 B11R1.86 O=C(O)CC1=CC=CN=C1Cl SC-33825 [0,1,0,0,1,0|1,0,0]=3 224 B11R1.86 O=C(O)CC1=NC=CC=C1Cl SC-65559 [0,1,0,0,1,0|1,0,0]=3 225 B11R1.86 O=C(O)CN1C=NC=CC1=O SC-91391 [0,1,0,0,1,0|2,0,0]=4 226 B11R1.157 CC(=O)CC1=CC(Cl)=CC=C1 SC-45436 [0,1,0,0,1,0|1,0,0]=3 227 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 SC-75485 [0,1,0,0,1,0|2,0,0]=4 228 B11R1.157 CC(=O)OC1=CC=CC(Br)=C1 SC-74017 [0,1,0,0,1,0|1,0,0]=3 229 B11R1.157 NC1=NC=CC(CC(=O)O)=C1 SC-91820 [0,1,0,0,1,0|1,0,0]=3 230 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 SC-02019 [0,1,0,0,1,0|0,0,0]=2 231 B11R1.157 O=C(O)CC1=CC(Br)=NC=C1 SC-35110 [0,1,0,0,1,0|1,0,0]=3 232 B11R1.157 O=C(O)CC1=CC(Cl)=NC=C1 SC-93605 [0,1,0,0,1,0|1,0,0]=3 233 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 SC-29854 [0,1,0,0,1,0|1,0,0]=3 234 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 SC-17427 [0,1,0,0,1,0|0,0,0]=2 235 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 SC-03533 [0,1,0,0,1,0|0,0,0]=2 236 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 SC-02021 [0,1,0,0,1,0|0,0,0]=2 237 B11R1.157 O=C(O)CC1=NC(Br)=CC=C1 SC-13240 [0,1,0,0,1,0|1,0,0]=3 238 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 SC-34399 [0,1,0,0,1,0|1,0,0]=3 239 B11R1.509 O=P(Cl)(Cl)OC1=CC=CC=C1 SC-46268 [0,1,0,0,1,0|2,0,0]=4 240 B11R1.509 O=S(=O)(Cl)CC1=CC=CC=C1 SC-02111 [0,1,0,0,1,0|1,0,1]=4 241 B11R1.35 C[C@H](NC1=CC=CO1)C(=O)O SC-91625 [0,1,0,0,1,0|2,0,0]=4 242 B11R1.35 C[C@H](NC1=CC=CO1)C(=O)O SC-91972 [0,1,0,0,1,0|2,0,0]=4 243 B11R1.35 C[C@H](NC1=CSC=C1)C(=O)O SC-91971 [0,1,0,0,1,0|2,0,0]=4 244 B11R1.35 NC(CC1=CSC=C1)C(=O)O SC-20710 [0,1,0,0,1,0|2,0,0]=4 245 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O SC-11219 [0,1,0,0,1,0|2,0,0]=4 246 B11R1.77 NC(CC(=O)O)C1=CC=CS1 SC-59316 [0,1,0,0,1,0|2,0,0]=4 247 B13R1.45 O=C(O)\C=C\C(=O)C1=CC=CC=C1 SC-14183 [0,1,0,0,0,1|1,0,1]=4 248 B13R1.45 O=C([O-])CNC(=O)C1=CC=CC=C1 SC-40764 [0,1,0,0,0,1|1,0,1]=4 249 B13R1.158 O=C(O)CCCC1=CC=CC=C1F SC-11471 [0,1,0,0,0,1|1,0,0]=3 250 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-46101 [0,1,0,0,0,1|1,0,0]=3 251 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SC-48872 [0,1,0,0,0,1|1,0,0]=3 252 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SC-77068 [0,1,0,0,0,1|1,0,0]=3 253 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 SC-46102 [0,1,0,0,0,1|1,0,0]=3 254 B13R1.351 CC(=O)C(=O)OCC1=CC=CC=C1 SC-A3376 [0,1,0,0,0,1|1,0,1]=4 255 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O SC-10977 [0,1,0,0,0,1|1,0,0]=3 256 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O SC-10979 [0,1,0,0,0,1|1,0,0]=3 257 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O SC-78855 [0,1,0,0,0,1|1,0,0]=3 258 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O SC-76550 [0,1,0,0,0,1|0,1,0]=3 259 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 SC-44640 [0,1,0,0,0,1|1,0,0]=3 260 B13R1.351 [C@@H](N)(CCC1=CC=CC=C1)C(=O)O SC-10978 [0,1,0,0,0,1|1,0,0]=3 261 B13R1.513 CC(=O)NCCC1=CC=C(O)C=C1 SC-83302 [0,1,0,0,0,1|2,0,0]=4 262 B13R1.513 CC1=CC=C(CCCC(=O)O)C=C1 SC-68300 [0,1,0,0,0,1|1,0,0]=3 263 B13R1.513 O=C(O)CCCC1=CC=C(Br)C=C1 SC-49268 [0,1,0,0,0,1|1,0,0]=3 264 B13R1.718 COC(=O)CNCC1=CC=CC=C1 SC-73836 [0,1,0,0,0,1|1,0,0]=3 265 B13R1.3 COC1=CC=C(\C=C\C(=O)O)C=C1 SC-50019 [0,2,0,0,0,0|1,0,1]=4 266 B13R1.3 N#CC1=CC=C(NCC(=O)O)C=C1 SC-44574 [0,2,0,0,0,0|1,0,0]=3 267 B13R1.3 N#CC1=CC=C(\C=C\C(=O)O)C=C1 SC-13934 [0,2,0,0,0,0|1,0,1]=4 268 B13R1.3 O=CC1=CC=C(OCC(=O)O)C=C1 SC-92866 [0,2,0,0,0,0|0,0,0]=2 269 B13R1.3 O=CC1=CC=C(\C=C\C(=O)O)C=C1 SC-54284 [0,2,0,0,0,0|1,0,1]=4 270 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 SC-26053 [0,2,0,0,0,0|1,0,0]=3 271 B13R1.14 COC(=O)CNC1=CC=C(O)C=C1 SC-10466 [0,2,0,0,0,0|1,0,0]=3 272 B13R1.14 COC(=O)CNC1=CC=C(O)C=C1 SC-47943 [0,2,0,0,0,0|1,0,0]=3 273 B13R1.14 COC(=O)\C=C\C1=CC=C(Br)C=C1 SC-23792 [0,2,0,0,0,0|1,0,1]=4 274 B13R1.14 COC(=O)\C=C\C1=CC=C(Cl)C=C1 SC-68661 [0,2,0,0,0,0|1,0,1]=4 275 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(Br)C=C1 SC-65571 [0,2,0,0,0,0|1,0,0]=3 276 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(Cl)C=C1 SC-21367 [0,2,0,0,0,0|1,0,0]=3 277 B13R1.133 CC(OC1=CC=C(Br)C=C1)C(=O)O SC-A3075 [0,2,0,0,0,0|0,0,0]=2 278 B13R1.133 CC(OC1=CC=C(O)C=C1)C(=O)O SC-17749 [0,2,0,0,0,0|0,0,0]=2 279 B13R1.133 CC1=CC=C(C[C@@H](N)C(=O)O)C=C1 SC-10869 [0,2,0,0,0,0|1,0,0]=3 280 B13R1.133 CC1=CC=C(C[C@H](N)C(=O)O)C=C1 SC-10868 [0,2,0,0,0,0|1,0,0]=3 281 B13R1.133 NC(CC1=CC=C(Cl)C=C1)C(=O)O SC-10559 [0,2,0,0,0,0|1,0,0]=3 282 B13R1.133 NC(CC1=CC=C(I)C=C1)C(=O)O SC-10816 [0,2,0,0,0,0|1,0,0]=3 283 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O SC-09926 [0,2,0,0,0,0|1,0,0]=3 284 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O SC-10841 [0,2,0,0,0,0|1,0,0]=3 285 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O SC-47410 [0,2,0,0,0,0|1,0,0]=3 286 B13R1.133 NC1=CC=C(C[C@@H](N)C(=O)O)C=C1 SC-10500 [0,2,0,0,0,0|1,0,0]=3 287 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O SC-10521 [0,2,0,0,0,0|1,0,0]=3 288 B13R1.133 N[C@@H](CC1=CC=C(Cl)C=C1)C(=O)O SC-10557 [0,2,0,0,0,0|1,0,0]=3 289 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O SC-10780 [0,2,0,0,0,0|1,0,0]=3 290 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O SC-10782 [0,2,0,0,0,0|1,0,0]=3 291 B13R1.133 N[C@H](CC1=CC=C(Br)C=C1)C(=O)O SC-10522 [0,2,0,0,0,0|1,0,0]=3 292 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O SC-10558 [0,2,0,0,0,0|1,0,0]=3 293 B13R1.133 N[C@H](CC1=CC=C(F)C=C1)C(=O)O SC-10781 [0,2,0,0,0,0|1,0,0]=3 294 B13R1.133 [C@@H](N)(CC1=CC=C(I)C=C1)C(=O)O SC-10815 [0,2,0,0,0,0|1,0,0]=3 295 B13R1.133 [C@@H](N)(CC1=CC=C(O)C=C1)C(=O)O SC-09925 [0,2,0,0,0,0|1,0,0]=3 296 B13R1.164 CC1=CC=C(OCC(=O)O)C(C)=C1 SC-95680 [0,2,0,0,0,0|0,0,0]=2 297 B13R1.164 O=C(O)CCC1=CC=C(Cl)C=C1Cl SC-62399 [0,2,0,0,0,0|1,0,0]=3 298 B13R1.164 O=C(O)CCC1=CC=C(F)C=C1F SC-11447 [0,2,0,0,0,0|1,0,0]=3 299 B13R1.164 O=C(O)\C=C\C1=C(Cl)C=C(Br)C=C1 SC-28764 [0,2,0,0,0,0|1,0,1]=4 300 B13R1.164 O=C(O)\C=C\C1=CC=C(Cl)C=C1Cl SC-44535 [0,2,0,0,0,0|1,0,1]=4 301 B13R1.164 O=C(O)\C=C\C1=CC=C(Cl)C=C1F SC-02270 [0,2,0,0,0,0|1,0,1]=4 302 B13R1.164 O=C(O)\C=C\C1=CC=C(F)C=C1Cl SC-20650 [0,2,0,0,0,0|1,0,1]=4 303 B13R1.164 O=C([O-])COC1=CC=C(Cl)C=C1Cl SC-47059 [0,2,0,0,0,0|0,0,1]=3 304 B13R1.511 O=C(O)CCC1=CC(O)=C(O)C=C1 SC-25524 [0,2,0,0,0,0|1,0,0]=3 305 B13R1.511 O=C(O)CCC1=CC=C(F)C(F)=C1 SC-78103 [0,2,0,0,0,0|1,0,0]=3 306 B13R1.511 O=C(O)\C=C\C1=CC=C(F)C(Cl)=C1 SC-01358 [0,2,0,0,0,0|1,0,1]=4 307 B13R1.511 O=C(O)\C=C\C1=CC=C(F)C(F)=C1 SC-00412 [0,2,0,0,0,0|1,0,1]=4 308 B13R1.511 O=C(O)\C=C\C1=CC=C(O)C(O)=C1 SC-B6225 [0,2,0,0,0,0|1,0,1]=4 309 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 SC-A3407 [0,2,0,0,0,0|1,0,0]=3 310 B13R1.15 COC(=O)CCC1=CC=CC(O)=C1 SC-73789 [0,2,0,0,0,0|1,0,0]=3 311 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 SC-75929 [0,2,0,0,0,0|2,0,0]=4 312 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 SC-25957 [0,2,0,0,0,0|1,0,0]=3 313 B13R1.42 CCOC(=O)CSC1=CC=CC=C1 SC-44787 [0,2,0,0,0,0|0,1,0]=3 314 B13R1.135 C=C(CC1=CC=CC=C1)C(=O)OC SC-27010 [0,2,0,0,0,0|1,0,1]=4 315 B13R1.135 [C@@H](N)(CC1=CC=CC=C1)C(=O)OC SC-09795 [0,2,0,0,0,0|1,0,0]=3 316 B13R1.148 CC1=CC(CC(N)C(=O)O)=CC=C1 SC-10861 [0,2,0,0,0,0|1,0,0]=3 317 B13R1.148 CC1=CC(C[C@@H](N)C(=O)O)=CC=C1 SC-10860 [0,2,0,0,0,0|1,0,0]=3 318 B13R1.148 CC1=CC(C[C@H](N)C(=O)O)=CC=C1 SC-10859 [0,2,0,0,0,0|1,0,0]=3 319 B13R1.148 NC(CC1=CC=CC(Br)=C1)C(=O)O SC-10514 [0,2,0,0,0,0|1,0,0]=3 320 B13R1.148 NC(CC1=CC=CC(I)=C1)C(=O)O SC-A4339 [0,2,0,0,0,0|1,0,0]=3 321 B13R1.148 N[C@@H](CC1=CC(O)=CC=C1)C(=O)O SC-10790 [0,2,0,0,0,0|1,0,0]=3 322 B13R1.148 N[C@@H](CC1=CC=CC(Br)=C1)C(=O)O SC-10512 [0,2,0,0,0,0|1,0,0]=3 323 B13R1.148 N[C@@H](CC1=CC=CC(Cl)=C1)C(=O)O SC-10548 [0,2,0,0,0,0|1,0,0]=3 324 B13R1.148 N[C@@H](CC1=CC=CC(F)=C1)C(=O)O SC-10771 [0,2,0,0,0,0|1,0,0]=3 325 B13R1.148 N[C@H](CC1=CC(F)=CC=C1)C(=O)O SC-10772 [0,2,0,0,0,0|1,0,0]=3 326 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O SC-20962 [0,2,0,0,0,0|1,0,0]=3 327 B13R1.202 CC1=CC=CC=C1CC(N)C(=O)O SC-10852 [0,2,0,0,0,0|1,0,0]=3 328 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O SC-44239 [0,2,0,0,0,0|1,0,0]=3 329 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O SC-10504 [0,2,0,0,0,0|1,0,0]=3 330 B13R1.202 NC(CC1=CC=CC=C1F)C(=O)O SC-10766 [0,2,0,0,0,0|1,0,0]=3 331 B13R1.202 N[C@@H](CC1=C(Br)C=CC=C1)C(=O)O SC-10503 [0,2,0,0,0,0|1,0,0]=3 332 B13R1.202 N[C@@H](CC1=C(F)C=CC=C1)C(=O)O SC-10764 [0,2,0,0,0,0|1,0,0]=3 333 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O SC-10539 [0,2,0,0,0,0|1,0,0]=3 334 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O SC-10787 [0,2,0,0,0,0|1,0,0]=3 335 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O SC-94203 [0,2,0,0,0,0|1,0,0]=3 336 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O SC-10765 [0,2,0,0,0,0|1,0,0]=3 337 B13R1.418 C=C[C@@H](CC1=CC=CC=C1)C(=O)O SC-30807 [0,2,0,0,0,0|1,0,0]=3 338 B13R1.418 C=C[C@H](CC1=CC=CC=C1)C(=O)O SC-30746 [0,2,0,0,0,0|1,0,0]=3 339 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O SC-27561 [0,2,0,0,0,0|1,0,0]=3 340 B13R1.1073 CC(C)(CC1=CC=CC=C1)C(=O)O SC-38070 [0,2,0,0,0,0|1,0,0]=3 341 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)O SC-25000 [0,2,0,0,0,0|1,0,0]=3 342 B13R1.1073 C[C@@](N)(CC1=CC=CC=C1)C(=O)O SC-46109 [0,2,0,0,0,0|1,0,0]=3 343 B13R1.147 N[C@@H](CC(=O)O)C1=CC=CC(Br)=C1 SC-53169 [0,2,0,0,0,0|1,0,0]=3 344 B13R1.147 N[C@H](CC(=O)O)C1=CC=CC(Br)=C1 SC-98915 [0,2,0,0,0,0|1,0,0]=3 345 B13R1.201 CC(CC(=O)O)C1=CC=CC=C1Cl SC-91278 [0,2,0,0,0,0|1,0,0]=3 346 B13R1.347 O=C(O)CS(=O)(=O)C1=CC=CC=C1 SC-A3030 [0,2,0,0,0,0|0,1,0]=3 347 B13R1.347 O=C(O)CS(=O)(=O)C1=NC=CC=C1 SC-38687 [0,2,0,0,0,0|1,1,0]=4 348 B13R1.90 COC1=CC=CC=C1CCC(=O)O SC-69693 [0,2,0,0,0,0|1,0,0]=3 349 B13R1.893 O=C(O)\C=C\C1=CC(F)=CC=C1F SC-46689 [0,2,0,0,0,0|1,0,1]=4 350 B13R1.643 COC1=CC(\C=C\C(=O)O)=CC=C1 SC-80812 [0,2,0,0,0,0|1,0,1]=4 351 B13R1.3420 O=C(O)CCC1=CC(Cl)=CC(Cl)=C1 SC-48866 [0,2,0,0,0,0|1,0,0]=3 352 B11R1.266 C=CC1=CC(C(=O)O)=CC=C1 SC-48202 [0,0,1,1,0,0|1,0,1]=4 353 B11R2.1 BrC1=COC2=CC=CC=C12 SC-A3452 [1,0,0,1,0,0|1,0,1]=4 354 B11R2.1 C=C1CCC2=C1C=CC=C2 SC-92149 [1,0,0,1,0,0|2,0,0]=4 355 B11R2.1 NC1=NOC2=CC=CC=C21 SC-17146 [1,0,0,1,0,0|2,0,0]=4 356 B11R2.1 N[C@H]1COC2=CC=CC=C21 SC-85124 [1,0,0,1,0,0|1,0,1]=4 357 B11R2.1 O=C1CCC2=C1C=CC=C2 SC-06902 [1,0,0,1,0,0|1,0,0]=3 358 B11R2.1 O=C1CCC2=C1C=CN=C2 SC-14762 [1,0,0,1,0,0|2,0,0]=4 359 B11R2.1 O=C1CCC2=CC=CN=C12 SC-53183 [1,0,0,1,0,0|2,0,0]=4 360 B11R2.1 O=C1CNC2=C1C=CC=C2 SC-46098 [1,0,0,1,0,0|1,0,0]=3 361 B11R2.1 O=C1COC2=CC=CC=C12 SC-81625 [1,0,0,1,0,0|0,0,0]=2 362 B11R2.1 O=C1COC2=CC=CN=C12 SC-87703 [1,0,0,1,0,0|1,0,0]=3 363 B11R2.1 O=C1NCC2=CC=CC=C12 SC-14357 [1,0,0,1,0,0|2,0,0]=4 364 B11R2.1 O=C1SSC2=CC=CC=C12 SC-17774 [1,0,0,1,0,0|1,1,0]=4 365 B11R2.20 C1=CC2=C(C=C1)OCCN2 SC-47722 [1,0,0,1,0,0|1,0,1]=4 366 B11R2.20 C1=CC2=C(C=CCO2)N=C1 SC-89984 [1,0,0,1,0,0|2,0,0]=4 367 B11R2.20 C1=CN=C2OCCOC2=C1 SC-28239 [1,0,0,1,0,0|1,0,1]=4 368 B11R2.10 BrC1=CC2=CC=CC=C2C1 SC-29345 [0,0,0,1,1,0|2,0,0]=4 369 B11R2.10 BrC1=CC2=CC=CC=C2O1 SC-20255 [0,0,0,1,1,0|1,0,1]=4 370 B11R2.10 CC1=CC2=CC=CC=C2C1 SC-02499 [0,0,0,1,1,0|2,0,0]=4 371 B11R2.10 CC1=CC2=CC=CC=C2O1 SC-11786 [0,0,0,1,1,0|1,0,1]=4 372 B11R2.10 NC1=NC2=C(C=CC=C2)O1 SC-29464 [0,0,0,1,1,0|2,0,0]=4 373 B11R2.10 O=C1CC2=C(C=CC=C2)C1 SC-05757 [0,0,0,1,1,0|1,0,0]=3 374 B11R2.10 O=C1CC2=C(C=CC=C2)N1 SC-05596 [0,0,0,1,1,0|1,0,0]=3 375 B11R2.10 O=C1CC2=C(C=CC=C2)O1 SC-49068 [0,0,0,1,1,0|0,0,0]=2 376 B11R2.10 O=C1CC2=C(C=CC=N2)N1 SC-28965 [0,0,0,1,1,0|2,0,0]=4 377 B11R2.10 O=C1CC2=C(C=CN=C2)N1 SC-31829 [0,0,0,1,1,0|2,0,0]=4 378 B11R2.10 O=C1CC2=C(N=CC=C2)N1 SC-31954 [0,0,0,1,1,0|2,0,0]=4 379 B11R2.10 O=C1CC2=CC=NC=C2N1 SC-26037 [0,0,0,1,1,0|2,0,0]=4 380 B11R2.10 O=C1NC2=CC=CC=C2O1 SC-05599 [0,0,0,1,1,0|1,0,0]=3 381 B11R2.10 O=C1NC2=CC=CC=C2S1 SC-13471 [0,0,0,1,1,0|1,1,0]=4 382 B11R2.10 O=C1NC2=NC=CC=C2O1 SC-17102 [0,0,0,1,1,0|2,0,0]=4 383 B11R2.10 OC1=NC2=CC=CC=C2N1 SC-05759 [0,0,0,1,1,0|2,0,0]=4 384 B11R2.10 OC1CC2=C(C=CC=C2)C1 SC-75383 [0,0,0,1,1,0|1,0,1]=4 385 B11R2.10 SC1=NC2=CC=CC=C2O1 SC-77876 [0,0,0,1,1,0|1,1,0]=4 386 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 SC-A2649 [0,0,0,1,0,1|2,0,0]=4 387 B13R2.10 O=C1CN=C(C2=CC=CC=C2)O1 SC-21225 [0,0,0,1,0,1|1,0,0]=3 388 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 SC-07544 [0,0,0,1,0,1|2,0,0]=4 389 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 SC-07250 [0,0,0,1,0,1|2,0,0]=4 390 B13R2.72 CC(=O)N1CCC2=C1C=CC=C2 SC-01460 [0,0,0,1,0,1|2,0,0]=4 391 B13R2.72 NC(=O)C1=NOC2=CC=CC=C21 SC-47809 [0,0,0,1,0,1|1,0,1]=4 392 B13R2.72 O=C(O)C1=CNC2=C1C=CC=C2 SC-06727 [0,0,0,1,0,1|1,0,1]=4 393 B13R2.72 O=C(O)C1=CSC2=CC=CC=C21 SC-46218 [0,0,0,1,0,1|0,1,1]=4 394 B13R2.72 O=C(O)C1=NNC2=CC=CC=C21 SC-12540 [0,0,0,1,0,1|1,0,1]=4 395 B13R2.72 O=C(O)C1=NOC2=CC=CC=C21 SC-26583 [0,0,0,1,0,1|0,0,1]=3 396 B13R2.72 O=C(O)C1CCC2=C1C=CC=C2 SC-21633 [0,0,0,1,0,1|1,0,0]=3 397 B13R2.72 O=C(O)C1NCC2=C1C=CC=C2 SC-49419 [0,0,0,1,0,1|1,0,0]=3 398 B13R2.72 O=C(O)[C@H]1NCC2=C1C=CC=C2 SC-70901 [0,0,0,1,0,1|1,0,0]=3 399 B13R2.163 O=C1CC2=CC=CC=C2CCN1 SC-A3624 [0,0,0,1,0,1|2,0,0]=4 400 B13R2.163 O=C1CCCC2=CC=CC=C2C1 SC-48284 [0,0,0,1,0,1|2,0,0]=4 401 B13R2.163 O=C1NCCC2=CC=CC=C2N1 SC-49030 [0,0,0,1,0,1|2,0,0]=4 402 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 SC-71542 [0,0,0,1,0,1|1,0,0]=3 403 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 SC-52795 [0,0,0,1,0,1|1,0,0]=3 404 B13R2.2382 C1=CC=C(COCC2CO2)C=C1 SC-01157 [0,0,0,1,0,1|1,0,1]=4 405 B13R2.2382 C1=CC=C(COCC2CO2)C=C1 SC-82731 [0,0,0,1,0,1|1,0,1]=4 406 B13R2.2382 C1=CC=C(COC[C@@H]2CO2)C=C1 SC-01544 [0,0,0,1,0,1|1,0,1]=4 407 B13R2.155 CC1=CC2=C(C=C1)CCC(=O)C2 SC-A3865 [0,1,0,1,0,0|2,0,0]=4 408 B13R2.155 CC1=NC2=C(C=C1)OCC(=O)N2 SC-25286 [0,1,0,1,0,0|2,0,0]=4 409 B13R2.155 NC1=CC2=C(C=C1)CCC(=O)N2 SC-44955 [0,1,0,1,0,0|2,0,0]=4 410 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)N1 SC-48438 [0,1,0,1,0,0|2,0,0]=4 411 B13R2.155 O=C1CCC2=C(C=C(Cl)C=C2)C1 SC-29250 [0,1,0,1,0,0|2,0,0]=4 412 B13R2.155 O=C1CCC2=C(C=C(O)C=C2)N1 SC-15669 [0,1,0,1,0,0|2,0,0]=4 413 B13R2.155 O=C1CCC2=C(C=C(O)C=C2)O1 SC-95668 [0,1,0,1,0,0|1,0,0]=3 414 B13R2.155 O=C1COC2=CC=C(Br)C=C2N1 SC-47598 [0,1,0,1,0,0|1,0,0]=3 415 B13R2.155 O=C1COC2=CC=C(Br)N=C2N1 SC-34236 [0,1,0,1,0,0|2,0,0]=4 416 B13R2.155 O=C1COC2=CC=C(O)C=C2N1 SC-48969 [0,1,0,1,0,0|1,0,0]=3 417 B13R2.32 CC1C(=O)CCC2=C1C=CC=C2 SC-88952 [0,1,0,1,0,0|2,0,0]=4 418 B13R2.33 O=C1CCC2=CC=CC=C2CC1 SC-66203 [0,1,0,1,0,0|2,0,0]=4 419 B13R2.435 CC(=O)C1=NC2=CC=CC=C2O1 SC-28166 [0,1,0,1,0,0|1,0,1]=4 420 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 SC-04821 [0,1,0,1,0,0|0,0,1]=3 421 B13R2.435 O=C(O)C1=CC2=CC=CC=C2S1 SC-13722 [0,1,0,1,0,0|0,1,1]=4 422 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 SC-03119 [0,1,0,1,0,0|1,0,1]=4 423 B13R2.435 O=C(O)C1=NC2=CC=CC=C2S1 SC-47323 [0,1,0,1,0,0|0,1,1]=4 424 B13R2.435 O=C(O)C1CC2=C(C=CC=C2)C1 SC-50301 [0,1,0,1,0,0|1,0,0]=3 425 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)N1 SC-06816 [0,1,0,1,0,0|1,0,0]=3 426 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 SC-21617 [0,1,0,1,0,0|0,0,2]=4 427 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 SC-A2997 [0,1,0,1,0,0|0,0,2]=4 428 B13R2.328 NC1CC(=O)NC2=C1C=CC=C2 SC-50578 [0,1,0,1,0,0|2,0,0]=4 429 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)O1 SC-00282 [0,1,0,1,0,0|1,0,1]=4 430 B13R2.328 O=C1NC(=O)C2=CC=CC=C2O1 SC-73365 [0,1,0,1,0,0|2,0,0]=4 431 B13R2.5179 O=C1CCC2=C(C=CC=C2Br)C1 SC-37376 [0,1,0,1,0,0|2,0,0]=4 432 B13R2.5179 O=C1CCC2=C(C=CC=C2Br)N1 SC-34127 [0,1,0,1,0,0|2,0,0]=4 433 B13R2.5179 O=C1CCC2=C(C=CC=C2O)N1 SC-49117 [0,1,0,1,0,0|2,0,0]=4 434 B13R2.151 O=C1CC(C2=CC(Br)=CC=C2)C1 SC-35953 [0,1,0,1,0,0|2,0,0]=4 435 B13R2.162 CC1=C2NC(=O)COC2=CC=C1 SC-98119 [0,1,0,1,0,0|1,0,0]=3 436 B13R2.162 O=C1CCC2=C(C1)C(Br)=CC=C2 SC-12017 [0,1,0,1,0,0|2,0,0]=4 437 B13R2.162 O=C1CCC2=C(C1)C(F)=CC=C2 SC-A2169 [0,1,0,1,0,0|2,0,0]=4 438 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CC2 SC-69383 [0,1,0,1,0,0|2,0,0]=4 439 B13R2.3683 NC1=CC=C2NC(=O)COC2=C1 SC-43382 [0,1,0,1,0,0|1,0,0]=3 440 B13R2.3683 O=C1CCC2=C(C=CC(Br)=C2)N1 SC-47729 [0,1,0,1,0,0|2,0,0]=4 441 B13R2.3683 O=C1CCC2=C(C=CC(F)=C2)C1 SC-53524 [0,1,0,1,0,0|2,0,0]=4 442 B13R2.3683 O=C1CCC2=CC(O)=CC=C2N1 SC-25713 [0,1,0,1,0,0|2,0,0]=4 443 B13R2.3683 O=C1CNC2=C(C=CC(Br)=C2)N1 SC-37865 [0,1,0,1,0,0|2,0,0]=4 444 B13R2.3683 O=C1COC2=CC(Br)=CC=C2N1 SC-50680 [0,1,0,1,0,0|1,0,0]=3 445 B13R2.3683 O=C1COC2=CC(F)=CC=C2N1 SC-73086 [0,1,0,1,0,0|1,0,0]=3 446 B13R2.3683 O=C1COC2=CC(O)=CC=C2N1 SC-50678 [0,1,0,1,0,0|1,0,0]=3 447 B9R1.6 CC(=O)C1=CC=CC=C1 SC-18041 [0,0,0,0,2,0|1,0,0]=3 448 B9R1.6 CC(=O)C1=CC=CN=C1 SC-03719 [0,0,0,0,2,0|2,0,0]=4 449 B9R1.6 CC(=O)C1=CC=NC=C1 SC-00378 [0,0,0,0,2,0|2,0,0]=4 450 B9R1.6 CC(O)C1=CC=CC=C1 SC-01127 [0,0,0,0,2,0|1,0,1]=4 451 B9R1.6 CC(O)C1=CC=CC=C1 SC-01292 [0,0,0,0,2,0|1,0,1]=4 452 B9R1.6 N=C(N)C1=CC=CC=C1 SC-05937 [0,0,0,0,2,0|2,0,0]=4 453 B9R1.6 N=C(N)C1=CC=CC=C1 SC-19783 [0,0,0,0,2,0|2,0,0]=4 454 B9R1.6 NC(=O)C1=CC=CC=C1 SC-26846 [0,0,0,0,2,0|1,0,0]=3 455 B9R1.6 NC(=O)C1=CC=NC=C1 SC-46185 [0,0,0,0,2,0|2,0,0]=4 456 B9R1.6 NC(=O)C1=CN=CC=C1 SC-18039 [0,0,0,0,2,0|2,0,0]=4 457 B9R1.6 NC(=O)C1=NC=CC=C1 SC-85416 [0,0,0,0,2,0|2,0,0]=4 458 B9R1.6 NC(=S)C1=CC=CC=C1 SC-19687 [0,0,0,0,2,0|1,1,0]=4 459 B9R1.6 O=C(Cl)C1=CC=CN=C1 SC-24753 [0,0,0,0,2,0|2,0,0]=4 460 B9R1.6 O=C(Cl)C1=CC=NC=C1 SC-26199 [0,0,0,0,2,0|2,0,0]=4 461 B9R1.6 O=C(Cl)C1=CN=CC=C1 SC-49128 [0,0,0,0,2,0|2,0,0]=4 462 B9R1.6 O=C(Cl)C1=NC=CC=C1 SC-47359 [0,0,0,0,2,0|2,0,0]=4 463 B9R1.6 O=C(O)C1=CC=CC=C1 SC-46861 [0,0,0,0,2,0|0,0,0]=2 464 B9R1.6 O=C(O)C1=CC=CC=C1 SC-49982 [0,0,0,0,2,0|0,0,0]=2 465 B9R1.6 O=C(O)C1=CC=CN=N1 SC-14949 [0,0,0,0,2,0|2,0,0]=4 466 B9R1.6 O=C(O)C1=CC=NC=C1 SC-05283 [0,0,0,0,2,0|1,0,0]=3 467 B9R1.6 O=C(O)C1=CC=NC=N1 SC-03365 [0,0,0,0,2,0|2,0,0]=4 468 B9R1.6 O=C(O)C1=CC=NN=C1 SC-04901 [0,0,0,0,2,0|2,0,0]=4 469 B9R1.6 O=C(O)C1=NC=CC=C1 SC-07528 [0,0,0,0,2,0|1,0,0]=3 470 B9R1.6 O=C(O)C1=NC=CC=N1 SC-03370 [0,0,0,0,2,0|2,0,0]=4 471 B9R1.6 O=C(O)C1=NC=CN=C1 SC-07526 [0,0,0,0,2,0|2,0,0]=4 472 B9R1.6 O=C([O-])C1=CC=CC=C1 SC-27055 [0,0,0,0,2,0|0,0,1]=3 473 B9R1.6 O=I(=O)C1=CC=CC=C1 SC-90106 [0,0,0,0,2,0|1,0,1]=4 474 B9R1.6 O=S([O-])C1=CC=CC=C1 SC-15951 [0,0,0,0,2,0|1,0,1]=4 475 B9R1.6 OB(O)C1=CC=CC=C1 SC-07521 [0,0,0,0,2,0|1,0,1]=4 476 B9R1.13 O=C(Cl)CC1=CC=CS1 SC-04098 [0,0,0,0,2,0|2,0,0]=4 477 B9R1.13 O=C(O)CC1=CC=CS1 SC-02081 [0,0,0,0,2,0|1,0,0]=3 478 B9R1.13 O=C(O)CC1=CC=NN1 SC-21485 [0,0,0,0,2,0|2,0,0]=4 479 B9R1.13 O=C(O)CC1=CNC=N1 SC-13980 [0,0,0,0,2,0|2,0,0]=4 480 B9R1.13 O=C(O)CC1=CNC=N1 SC-65853 [0,0,0,0,2,0|2,0,0]=4 481 B9R1.13 O=C(O)CC1=CSC=C1 SC-46447 [0,0,0,0,2,0|1,0,0]=3 482 B9R1.13 O=C(O)CC1=NC=CN1 SC-22264 [0,0,0,0,2,0|2,0,0]=4 483 B9R1.13 O=C(O)CC1=NC=CS1 SC-65508 [0,0,0,0,2,0|2,0,0]=4 484 B9R1.13 O=C(O)CC1=NNC=C1 SC-19655 [0,0,0,0,2,0|2,0,0]=4 485 B9R1.13 O=C(O)CN1C=CN=C1 SC-02637 [0,0,0,0,2,0|2,0,0]=4 486 B13R1.337 CC(=O)CCCCC1=CC=CC=C1 SC-70636 [0,0,0,0,0,2|2,0,0]=4 487 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 SC-15647 [0,0,0,0,0,2|1,0,0]=3 488 B13R1.337 O=C(O)CCSSC1=NC=CC=C1 SC-95019 [0,0,0,0,0,2|1,1,0]=4 489 B13R1.337 O=C(O)\C=C\C=C\C1=CC=CC=C1 SC-A4073 [0,0,0,0,0,2|1,0,1]=4