0 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 SC-50143 [0,0,0,0,0,0|1,0,0]=1 1 B13R2.435 CC(=O)C1=NC2=CC=CC=C2O1 SC-28166 [0,0,0,0,0,0|2,0,1]=3 2 B13R2.435 CC(=S)C1=CC2=CC=CC=C2S1 SC-42805 [0,0,0,0,0,0|2,1,0]=3 3 B13R2.435 CC(C)C1=NC2=CC=CC=C2N1 SC-27869 [0,0,0,0,0,0|3,0,1]=4 4 B13R2.435 CN(O)C1=NC2=CC=CC=C2S1 SC-21969 [0,0,0,0,0,0|3,0,1]=4 5 B13R2.435 FC(F)C1=NC2=C(C=CC=C2)N1 SC-28025 [0,0,0,0,0,0|3,0,1]=4 6 B13R2.435 N=C(N)C1=CC2=C(C=CC=C2)N1 SC-51729 [0,0,0,0,0,0|2,0,0]=2 7 B13R2.435 NC(=O)C1=CC2=CC=CC=C2N1 SC-50743 [0,0,0,0,0,0|1,0,0]=1 8 B13R2.435 NC(=O)C1=NC2=CC=CC=C2S1 SC-87688 [0,0,0,0,0,0|2,0,1]=3 9 B13R2.435 O=C(Cl)C1=CC2=C(C=CC=C2)N1 SC-62785 [0,0,0,0,0,0|1,0,0]=1 10 B13R2.435 O=C(Cl)C1=CC2=CC=CC=C2S1 SC-50625 [0,0,0,0,0,0|2,0,0]=2 11 B13R2.435 O=C(O)C1=CC2=CC=CC=C2S1 SC-13722 [0,0,0,0,0,0|1,0,0]=1 12 B13R2.435 O=C(O)C1=CC2=NC=CC=C2N1 SC-89324 [0,0,0,0,0,0|1,0,0]=1 13 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 SC-27740 [0,0,0,0,0,0|1,0,1]=2 14 B13R2.435 O=C(O)C1=CN2C=CN=CC2=N1 SC-44704 [0,0,0,0,0,0|2,0,1]=3 15 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 SC-03119 [0,0,0,0,0,0|1,0,0]=1 16 B13R2.435 O=C(O)C1=NC2=CC=CC=C2S1 SC-47323 [0,0,0,0,0,0|1,0,1]=2 17 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 SC-27377 [0,0,0,0,0,0|1,0,1]=2 18 B13R2.435 O=C(O)C1=NN2C=CC=NC2=C1 SC-68162 [0,0,0,0,0,0|2,0,1]=3 19 B13R2.435 O=C(O)C1CC2=C(C=CC=C2)C1 SC-50301 [0,0,0,0,0,0|1,0,2]=3 20 B13R2.435 O=C(O)C1CC2=C(C=CC=C2)N1 SC-46307 [0,0,0,0,0,0|0,0,2]=2 21 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 SC-21617 [0,0,0,0,0,0|1,0,2]=3 22 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 SC-A2997 [0,0,0,0,0,0|1,0,2]=3 23 B13R2.435 OB(O)C1=CC2=C(C=CC=C2)O1 SC-62369 [0,0,0,0,0,0|2,0,1]=3 24 B12R2.32 BrCC1=CC2=CC=CC=C2O1 SC-61094 [1,0,0,0,0,0|2,0,1]=4 25 B12R2.32 CCC1=CC2=CC=CC=C2O1 SC-46297 [1,0,0,0,0,0|2,0,1]=4 26 B12R2.32 CCC1=NC2=CC=CC=C2N1 SC-27730 [1,0,0,0,0,0|2,0,1]=4 27 B12R2.32 CNC1=NC2=CC=CC=C2N1 SC-A3818 [1,0,0,0,0,0|3,0,0]=4 28 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 SC-59132 [1,0,0,0,0,0|1,0,1]=3 29 B12R2.32 NCC1=CC2=CC=CC=C2O1 SC-12424 [1,0,0,0,0,0|2,0,1]=4 30 B12R2.32 NCC1=NC2=CC=CC=C2N1 SC-52714 [1,0,0,0,0,0|2,0,1]=4 31 B12R2.32 NCC1=NC2=CC=CC=C2N1 SC-95277 [1,0,0,0,0,0|2,0,1]=4 32 B12R2.32 NNC1=NC2=CC=CC=C2N1 SC-67316 [1,0,0,0,0,0|3,0,0]=4 33 B12R2.32 O=CC1=CC2=C(C=CN=C2)N1 SC-87209 [1,0,0,0,0,0|1,0,0]=2 34 B12R2.32 O=CC1=CC2=C(C=NC=C2)N1 SC-13529 [1,0,0,0,0,0|1,0,0]=2 35 B12R2.32 O=CC1=CC2=CC=CC=C2S1 SC-27762 [1,0,0,0,0,0|1,0,0]=2 36 B12R2.32 O=CC1=CN2C=CC=CC2=N1 SC-47756 [1,0,0,0,0,0|1,0,1]=3 37 B12R2.32 O=CC1=NC2=CC=CC=C2N1 SC-03537 [1,0,0,0,0,0|1,0,0]=2 38 B12R2.32 O=CC1=NC2=CC=CC=C2S1 SC-65177 [1,0,0,0,0,0|1,0,1]=3 39 B12R2.32 O=CC1=NN2C=CC=CC2=C1 SC-35983 [1,0,0,0,0,0|1,0,1]=3 40 B12R2.32 OCC1=CC2=C(C=CC=C2)N1 SC-62843 [1,0,0,0,0,0|0,0,1]=2 41 B12R2.32 OCC1=CC2=C(C=CC=C2)S1 SC-46532 [1,0,0,0,0,0|1,0,1]=3 42 B12R2.32 OCC1=NC2=C(C=CC=C2)S1 SC-17147 [1,0,0,0,0,0|1,0,2]=4 43 B14R2.450 CC(=O)C1=C(C)C2=CC=CC=C2O1 SC-33392 [0,1,0,0,0,0|2,0,0]=3 44 B14R2.450 CC(=O)C1=CC2=C(C=CC=C2)N1C SC-94269 [0,1,0,0,0,0|1,0,0]=2 45 B14R2.450 CC1=C(C(=O)Cl)OC2=CC=CC=C21 SC-50648 [0,1,0,0,0,0|2,0,0]=3 46 B14R2.450 CC1=C(C(=O)O)NC2=C1C=CC=C2 SC-A4121 [0,1,0,0,0,0|0,0,0]=1 47 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 SC-46132 [0,1,0,0,0,0|1,0,0]=2 48 B14R2.450 CN1C(B(O)O)=CC2=C1C=CC=C2 SC-A4055 [0,1,0,0,0,0|1,0,1]=3 49 B14R2.450 CN1C(C(=O)Cl)=CC2=C1C=CC=C2 SC-61043 [0,1,0,0,0,0|1,0,0]=2 50 B14R2.450 CN1C2=CC=CC=C2N=C1C(=O)O SC-13965 [0,1,0,0,0,0|1,0,0]=2 51 B14R2.450 O=C(O)C1=C(Br)C2=C(C=CC=C2)N1 SC-59877 [0,1,0,0,0,0|0,0,0]=1 52 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=NC=C2)S1 SC-39042 [0,1,0,0,0,0|2,0,0]=3 53 B14R2.450 O=C(O)C1=C(Cl)C2=CC=CC=C2S1 SC-78306 [0,1,0,0,0,0|1,0,0]=2 54 B14R2.450 O=C(O)C1=C(Cl)C2=NC=CC=C2S1 SC-38889 [0,1,0,0,0,0|2,0,0]=3 55 B14R2.450 O=C(O)C1=C(Cl)N2C=CC=CC2=N1 SC-22265 [0,1,0,0,0,0|1,0,1]=3 56 B14R2.450 O=C(O)C1=NN2C=CC=CC2=C1Br SC-32917 [0,1,0,0,0,0|1,0,1]=3 57 B14R2.789 NC1(C(=O)O)CC2=CC=CC=C2C1 SC-52220 [0,1,0,0,0,0|1,0,2]=4 58 B14R2.972 COC(=O)C1=CC2=CC=CN=C2N1 SC-27296 [0,1,0,0,0,0|1,0,0]=2 59 B14R2.972 COC(=O)C1=NC2=CC=CC=C2N1 SC-12508 [0,1,0,0,0,0|1,0,0]=2 60 B14R2.972 COC(=O)C1=NC2=CC=CC=C2S1 SC-87102 [0,1,0,0,0,0|1,0,1]=3 61 B14R2.972 NNC(=O)C1=CC2=CC=CC=C2N1 SC-39758 [0,1,0,0,0,0|1,0,0]=2 62 B14R2.972 O=C(CBr)C1=CC2=CC=CC=C2O1 SC-02709 [0,1,0,0,0,0|2,0,0]=3 63 B14R2.3129 FC(F)(F)C1=CC2=C(C=CC=C2)N1 SC-34128 [0,1,0,0,0,0|2,0,1]=4 64 B14R2.4529 CC(=O)C1=CC2=CC=C(Br)C=C2O1 SC-33838 [0,1,0,0,0,0|2,0,0]=3 65 B14R2.4529 CC1=CC=C2C=C(C(=O)O)NC2=C1 SC-20916 [0,1,0,0,0,0|0,0,0]=1 66 B14R2.4529 CC1=CC=C2C=C(C(=O)O)SC2=C1 SC-28171 [0,1,0,0,0,0|1,0,0]=2 67 B14R2.4529 CC1=CC=C2N=C(C(=O)O)SC2=C1 SC-33482 [0,1,0,0,0,0|1,0,1]=3 68 B14R2.4529 CC1=CC=C2NC(C(=O)O)=CC2=C1 SC-65659 [0,1,0,0,0,0|0,0,0]=1 69 B14R2.4529 CC1=CC=C2SC(C(=O)O)=NC2=C1 SC-33690 [0,1,0,0,0,0|1,0,1]=3 70 B14R2.4529 CC1=CN2C=C(C(=O)O)N=C2C=C1 SC-24149 [0,1,0,0,0,0|1,0,1]=3 71 B14R2.4529 NC1=CC2=C(C=C1)C=C(C(=O)O)N2 SC-44970 [0,1,0,0,0,0|0,0,0]=1 72 B14R2.4529 O=C(Cl)C1=CC2=C(C=C(Br)C=C2)N1 SC-61040 [0,1,0,0,0,0|1,0,0]=2 73 B14R2.4529 O=C(Cl)C1=CC2=C(C=C(Cl)C=C2)N1 SC-61035 [0,1,0,0,0,0|1,0,0]=2 74 B14R2.4529 O=C(Cl)C1=CC2=C(C=C(F)C=C2)N1 SC-61028 [0,1,0,0,0,0|1,0,0]=2 75 B14R2.4529 O=C(Cl)C1=CC2=C(C=CC(Br)=C2)N1 SC-61041 [0,1,0,0,0,0|1,0,0]=2 76 B14R2.4529 O=C(Cl)C1=CC2=C(C=CC(Cl)=C2)N1 SC-62786 [0,1,0,0,0,0|1,0,0]=2 77 B14R2.4529 O=C(Cl)C1=CC2=CC(F)=CC=C2N1 SC-61029 [0,1,0,0,0,0|1,0,0]=2 78 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)C=C2)N1 SC-01590 [0,1,0,0,0,0|0,0,0]=1 79 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)N=C2)N1 SC-91803 [0,1,0,0,0,0|1,0,0]=2 80 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)N1 SC-03312 [0,1,0,0,0,0|0,0,0]=1 81 B14R2.4529 O=C(O)C1=CC2=C(C=C(O)C=C2)N1 SC-21493 [0,1,0,0,0,0|0,0,0]=1 82 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 SC-06533 [0,1,0,0,0,0|0,0,0]=1 83 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)O1 SC-43762 [0,1,0,0,0,0|1,0,0]=2 84 B14R2.4529 O=C(O)C1=CC2=C(C=CC(O)=C2)N1 SC-65534 [0,1,0,0,0,0|0,0,0]=1 85 B14R2.4529 O=C(O)C1=CC2=C(C=NC(Cl)=C2)N1 SC-24201 [0,1,0,0,0,0|1,0,0]=2 86 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2S1 SC-68638 [0,1,0,0,0,0|1,0,0]=2 87 B14R2.4529 O=C(O)C1=CC2=CC(F)=CC=C2N1 SC-46131 [0,1,0,0,0,0|0,0,0]=1 88 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2N1 SC-01587 [0,1,0,0,0,0|0,0,0]=1 89 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2S1 SC-90095 [0,1,0,0,0,0|1,0,0]=2 90 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)C=C2S1 SC-87191 [0,1,0,0,0,0|1,0,0]=2 91 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)N=C2N1 SC-35390 [0,1,0,0,0,0|1,0,0]=2 92 B14R2.4529 O=C(O)C1=CC2=CC=C(O)C=C2O1 SC-04138 [0,1,0,0,0,0|1,0,0]=2 93 B14R2.4529 O=C(O)C1=CC2=NC=C(Cl)C=C2N1 SC-B8121 [0,1,0,0,0,0|1,0,0]=2 94 B14R2.4529 O=C(O)C1=CN2C=C(Br)C=CC2=N1 SC-22430 [0,1,0,0,0,0|1,0,1]=3 95 B14R2.4529 O=C(O)C1=CN2C=NC(Cl)=CC2=N1 SC-95875 [0,1,0,0,0,0|2,0,1]=4 96 B14R2.4529 O=C(O)C1=CN2N=C(Cl)C=CC2=N1 SC-45206 [0,1,0,0,0,0|2,0,1]=4 97 B14R2.4529 O=C(O)C1=NC2=CC(Br)=CC=C2N1 SC-53633 [0,1,0,0,0,0|1,0,0]=2 98 B14R2.4529 O=C(O)C1=NC2=CC(Br)=CC=C2S1 SC-14719 [0,1,0,0,0,0|1,0,1]=3 99 B14R2.4529 O=C(O)C1=NC2=CC(Cl)=CC=C2N1 SC-11757 [0,1,0,0,0,0|1,0,0]=2 100 B14R2.4529 O=C(O)C1=NC2=CC(F)=CC=C2O1 SC-A2413 [0,1,0,0,0,0|1,0,1]=3 101 B14R2.4529 O=C(O)C1=NC2=CC=C(Br)C=C2S1 SC-34476 [0,1,0,0,0,0|1,0,1]=3 102 B14R2.4529 O=C(O)C1=NC2=CC=C(F)C=C2N1 SC-72734 [0,1,0,0,0,0|1,0,0]=2 103 B14R2.4529 O=C(O)C1=NC2=CC=C(F)C=C2S1 SC-14572 [0,1,0,0,0,0|1,0,1]=3 104 B14R2.4529 O=C(O)C1=NN2C=C(Br)C=CC2=C1 SC-A2726 [0,1,0,0,0,0|1,0,1]=3 105 B14R2.4529 O=C(O)C1=NN2C=CC(Br)=CC2=C1 SC-A2735 [0,1,0,0,0,0|1,0,1]=3 106 B14R2.4529 O=C(O)C1=NN2C=CC(Br)=CC2=N1 SC-65906 [0,1,0,0,0,0|2,0,1]=4 107 B14R2.4529 O=C(O)C1CC2=C(C=C(Br)C=C2)C1 SC-65934 [0,1,0,0,0,0|1,0,2]=4 108 B14R2.7969 CC(=O)C1=CC2=C(Cl)C=CC=C2O1 SC-32998 [0,1,0,0,0,0|2,0,0]=3 109 B14R2.7969 CC(=O)C1=CC2=CC=CC(Br)=C2O1 SC-33395 [0,1,0,0,0,0|2,0,0]=3 110 B14R2.7969 CC(=O)C1=NC2=C(C)C=CC=C2S1 SC-32757 [0,1,0,0,0,0|2,0,1]=4 111 B14R2.7969 CC(=O)C1=NC2=C(Cl)C=CC=C2S1 SC-33678 [0,1,0,0,0,0|2,0,1]=4 112 B14R2.7969 CC1=C2N=C(C(=O)O)SC2=CC=C1 SC-33412 [0,1,0,0,0,0|1,0,1]=3 113 B14R2.7969 CC1=CC=CC2=NC(C(=O)O)=CN12 SC-24150 [0,1,0,0,0,0|1,0,1]=3 114 B14R2.7969 NC1=CC=CC2=C1NC(C(=O)O)=C2 SC-70266 [0,1,0,0,0,0|0,0,0]=1 115 B14R2.7969 O=C(Cl)C1=CC2=C(C=CC=C2Cl)N1 SC-61033 [0,1,0,0,0,0|1,0,0]=2 116 B14R2.7969 O=C(Cl)C1=CC2=C(N1)C(Cl)=CC=C2 SC-61034 [0,1,0,0,0,0|1,0,0]=2 117 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Br)N1 SC-01586 [0,1,0,0,0,0|0,0,0]=1 118 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Cl)N1 SC-61032 [0,1,0,0,0,0|0,0,0]=1 119 B14R2.7969 O=C(O)C1=CC2=C(C=NC=C2Br)S1 SC-30987 [0,1,0,0,0,0|2,0,0]=3 120 B14R2.7969 O=C(O)C1=CC2=C(C=NC=C2Cl)S1 SC-31106 [0,1,0,0,0,0|2,0,0]=3 121 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CC=C2S1 SC-68640 [0,1,0,0,0,0|1,0,0]=2 122 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CN=C2S1 SC-29807 [0,1,0,0,0,0|2,0,0]=3 123 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2N1 SC-72341 [0,1,0,0,0,0|0,0,0]=1 124 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2S1 SC-28330 [0,1,0,0,0,0|1,0,0]=2 125 B14R2.7969 O=C(O)C1=CC2=C(N1)C(Br)=CC=C2 SC-23313 [0,1,0,0,0,0|0,0,0]=1 126 B14R2.7969 O=C(O)C1=CC2=C(N1)C(O)=CC=C2 SC-23210 [0,1,0,0,0,0|0,0,0]=1 127 B14R2.7969 O=C(O)C1=CC2=C(S1)C(F)=CC=C2 SC-51743 [0,1,0,0,0,0|1,0,0]=2 128 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2N1 SC-45731 [0,1,0,0,0,0|0,0,0]=1 129 B14R2.7969 O=C(O)C1=CC2=CC=CC(F)=C2N1 SC-52059 [0,1,0,0,0,0|0,0,0]=1 130 B14R2.7969 O=C(O)C1=CN2C(Br)=CC=CC2=N1 SC-31035 [0,1,0,0,0,0|1,0,1]=3 131 B14R2.7969 O=C(O)C1=NC2=C(Br)C=CC=C2S1 SC-34473 [0,1,0,0,0,0|1,0,1]=3 132 B14R2.7969 O=C(O)C1=NC2=C(C=CC=C2Cl)S1 SC-33430 [0,1,0,0,0,0|1,0,1]=3 133 B14R2.7969 O=C(O)C1=NC2=C(F)C=CC=C2S1 SC-34269 [0,1,0,0,0,0|1,0,1]=3 134 B14R2.7969 O=C(O)C1=NC2=CC=CC(Br)=C2S1 SC-82331 [0,1,0,0,0,0|1,0,1]=3 135 B14R2.7969 O=C(O)C1=NC2=CC=CC(Cl)=C2S1 SC-34419 [0,1,0,0,0,0|1,0,1]=3 136 B14R2.7969 O=C(O)C1=NC2=CC=CC(F)=C2S1 SC-34477 [0,1,0,0,0,0|1,0,1]=3 137 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SC-21936 [0,0,1,0,0,0|1,0,0]=2 138 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SC-22789 [0,0,1,0,0,0|1,0,0]=2 139 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SC-24697 [0,0,1,0,0,0|1,0,2]=4 140 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 SC-09787 [0,0,1,0,0,0|1,0,2]=4 141 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O SC-11174 [0,0,1,0,0,0|1,0,2]=4 142 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O SC-11171 [0,0,1,0,0,0|1,0,2]=4 143 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O SC-09766 [0,0,1,0,0,0|0,0,2]=3 144 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SC-09765 [0,0,1,0,0,0|0,0,2]=3 145 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SC-10967 [0,0,1,0,0,0|0,0,2]=3 146 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O SC-03978 [0,0,1,0,0,0|1,0,2]=4 147 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 SC-45736 [0,0,1,0,0,0|1,0,2]=4 148 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SC-96045 [0,0,1,0,0,0|1,0,2]=4 149 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 SC-02277 [0,0,1,0,0,0|1,0,2]=4 150 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 SC-06556 [0,0,1,0,0,0|1,0,2]=4 151 B12R1.43 O=C(O)\C(F)=C\C1=CC=CC=C1 SC-21162 [0,0,1,0,0,0|1,0,0]=2 152 B12R1.43 O=C([O-])C(=O)CC1=CC=CC=C1 SC-77590 [0,0,1,0,0,0|1,0,2]=4 153 B12R1.43 [C@H](N)(CC1=CC=NC=C1)C(=O)O SC-19508 [0,0,1,0,0,0|1,0,2]=4 154 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 SC-46433 [0,0,1,0,0,0|1,0,0]=2 155 B12R1.125 CC1=CC=CC=C1CCC(=O)O SC-27982 [0,0,1,0,0,0|1,0,2]=4 156 B12R1.125 CC1=CC=CC=C1OCC(=O)O SC-73996 [0,0,1,0,0,0|1,0,2]=4 157 B12R1.125 O=C(O)CCC1=CC=CC=C1Br SC-17877 [0,0,1,0,0,0|1,0,2]=4 158 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl SC-49196 [0,0,1,0,0,0|1,0,2]=4 159 B12R1.125 O=C(O)CCC1=CC=CC=C1F SC-76672 [0,0,1,0,0,0|1,0,2]=4 160 B12R1.125 O=C(O)CNC1=CC=CC=C1F SC-92918 [0,0,1,0,0,0|1,0,1]=3 161 B12R1.125 O=C(O)COC1=CC=CC=C1F SC-50195 [0,0,1,0,0,0|2,0,1]=4 162 B12R1.125 O=C(O)\C=C\C1=C(Cl)N=CC=C1 SC-41254 [0,0,1,0,0,0|2,0,0]=3 163 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br SC-81630 [0,0,1,0,0,0|1,0,0]=2 164 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1I SC-41296 [0,0,1,0,0,0|1,0,0]=2 165 B12R2.252 NC(=O)C1=CC2=C(C=CO2)N1 SC-50041 [0,0,0,0,1,0|2,0,0]=3 166 B12R2.252 NC(=O)C1=CC2=C(C=CS2)N1 SC-50042 [0,0,0,0,1,0|2,0,0]=3 167 B12R2.252 O=C(O)C1=CC2=C(C=CS2)S1 SC-90437 [0,0,0,0,1,0|2,0,0]=3 168 B12R2.252 O=C(O)C1=CC2=C(C=NN2)S1 SC-51658 [0,0,0,0,1,0|3,0,0]=4 169 B12R2.3190 O=C(Cl)C1CC2=CC=CC=C21 SC-61000 [0,0,0,0,1,0|1,0,2]=4 170 B12R2.3190 O=C(O)C1=CC2=CC=CC=C21 SC-19627 [0,0,0,0,1,0|0,0,0]=1 171 B14R2.768 O=C(O)CC1=CC2=C(C=CC=C2)N1 SC-28729 [0,0,0,0,0,1|0,0,0]=1 172 B14R2.781 CC(=O)C1=CC2=C(C=CC=C2)C=N1 SC-34233 [0,0,0,0,0,1|1,0,1]=3 173 B14R2.781 CC(=O)C1=CC2=C(C=CN=C2)C=C1 SC-32969 [0,0,0,0,0,1|3,0,0]=4 174 B14R2.781 CC(=O)C1=CC2=CC=CC=C2N=C1 SC-30991 [0,0,0,0,0,1|1,0,1]=3 175 B14R2.781 CC(=O)C1=NC2=CC=CC=C2C=C1 SC-26507 [0,0,0,0,0,1|1,0,1]=3 176 B14R2.781 CC(=O)C1=NC2=CC=CC=C2N=C1 SC-27148 [0,0,0,0,0,1|1,0,1]=3 177 B14R2.781 CC(=O)C1=NC2=NC=CC=C2C=C1 SC-40261 [0,0,0,0,0,1|2,0,1]=4 178 B14R2.781 CC(=S)C1=CC2=CC=CC=C2C=C1 SC-42612 [0,0,0,0,0,1|2,1,0]=4 179 B14R2.781 C[C@@H](O)C1=CC2=CC=CC=C2C=C1 SC-49300 [0,0,0,0,0,1|2,0,1]=4 180 B14R2.781 N=C(N)C1=CC2=CC=CC=C2N=C1 SC-40721 [0,0,0,0,0,1|2,0,1]=4 181 B14R2.781 N=C(N)C1=CC=C2C=CC=CC2=C1 SC-41036 [0,0,0,0,0,1|3,0,0]=4 182 B14R2.781 NC(=O)C1=NC2=CC=CC=C2C=C1 SC-42415 [0,0,0,0,0,1|1,0,1]=3 183 B14R2.781 O=C(Cl)C1=CC2=CC=CC=C2N=C1 SC-61105 [0,0,0,0,0,1|1,0,1]=3 184 B14R2.781 O=C(Cl)C1=CC=C2N=CC=CC2=C1 SC-57427 [0,0,0,0,0,1|3,0,0]=4 185 B14R2.781 O=C(Cl)C1=CN=C2C=CC=CC2=N1 SC-19610 [0,0,0,0,0,1|1,0,1]=3 186 B14R2.781 O=C(O)C1=CC2=C(C=C1)C=NC=C2 SC-25332 [0,0,0,0,0,1|2,0,0]=3 187 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)C=C1 SC-07352 [0,0,0,0,0,1|1,0,0]=2 188 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)C=N1 SC-20930 [0,0,0,0,0,1|0,0,1]=2 189 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)C=N1 SC-73742 [0,0,0,0,0,1|0,0,1]=2 190 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)NC1 SC-69256 [0,0,0,0,0,1|0,0,0]=1 191 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)OC1 SC-52044 [0,0,0,0,0,1|1,0,0]=2 192 B14R2.781 O=C(O)C1=CC2=C(C=CN=C2)C=C1 SC-33697 [0,0,0,0,0,1|2,0,0]=3 193 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 SC-28351 [0,0,0,0,0,1|0,0,1]=2 194 B14R2.781 O=C(O)C1=CC2=CC=NC=C2N=C1 SC-49856 [0,0,0,0,0,1|1,0,1]=3 195 B14R2.781 O=C(O)C1=CC2=NC=CN=C2C=C1 SC-27045 [0,0,0,0,0,1|3,0,0]=4 196 B14R2.781 O=C(O)C1=CC=C2C=CC=NC2=C1 SC-19996 [0,0,0,0,0,1|2,0,0]=3 197 B14R2.781 O=C(O)C1=CC=C2N=CC=CC2=C1 SC-00145 [0,0,0,0,0,1|2,0,0]=3 198 B14R2.781 O=C(O)C1=NC2=CC=CC=C2C=C1 SC-07355 [0,0,0,0,0,1|0,0,1]=2 199 B14R2.781 O=C(O)C1=NC2=CC=CC=C2N=C1 SC-07133 [0,0,0,0,0,1|0,0,1]=2 200 B14R2.781 O=C(O)C1=NC2=CC=CN=C2C=C1 SC-87974 [0,0,0,0,0,1|1,0,1]=3 201 B14R2.781 O=C(O)C1=NC2=CC=NC=C2C=C1 SC-14083 [0,0,0,0,0,1|1,0,1]=3 202 B14R2.781 O=C(O)C1=NC2=NC=CC=C2C=C1 SC-49701 [0,0,0,0,0,1|1,0,1]=3 203 B14R2.781 O=C(O)C1CC2=C(C=CC=C2)CN1 SC-78444 [0,0,0,0,0,1|0,0,2]=3 204 B14R2.781 O=C(O)C1CC2=CC=CC=C2CN1 SC-44475 [0,0,0,0,0,1|0,0,2]=3 205 B14R2.781 O=C(O)C1CCC2=C(C=CC=C2)C1 SC-65318 [0,0,0,0,0,1|1,0,2]=4 206 B14R2.781 O=C(O)C1CCC2=C(C=CC=C2)N1 SC-A3399 [0,0,0,0,0,1|0,0,2]=3 207 B14R2.781 O=C(O)C1CCC2=CC=CC=C2N1 SC-49015 [0,0,0,0,0,1|0,0,2]=3 208 B14R2.781 O=C(O)C1CNC2=C(C=CC=C2)C1 SC-52232 [0,0,0,0,0,1|0,0,2]=3 209 B14R2.781 O=C(O)C1CNC2=CC=CC=C2O1 SC-92503 [0,0,0,0,0,1|1,0,1]=3 210 B14R2.781 O=C(O)C1COC2=CC=CC=C2C1 SC-65754 [0,0,0,0,0,1|1,0,2]=4 211 B14R2.781 O=C(O)C1COC2=CC=CC=C2N1 SC-87885 [0,0,0,0,0,1|0,0,2]=3 212 B14R2.781 O=C(O)C1COC2=CC=CC=C2N1 SC-A4963 [0,0,0,0,0,1|0,0,2]=3 213 B14R2.781 O=C(O)C1COC2=CC=CC=C2O1 SC-23379 [0,0,0,0,0,1|1,0,2]=4 214 B14R2.781 O=C(O)[C@@H]1CC2=C(C=CC=C2)CN1 SC-06593 [0,0,0,0,0,1|0,0,2]=3 215 B14R2.781 O=C(O)[C@@H]1COC2=CC=CC=C2O1 SC-93049 [0,0,0,0,0,1|1,0,2]=4 216 B14R2.781 O=C(O)[C@H]1CCC2=C(C=CC=C2)N1 SC-A2473 [0,0,0,0,0,1|0,0,2]=3 217 B14R2.781 O=C(O)[C@H]1CCC2=CC=CC=C2C1 SC-50071 [0,0,0,0,0,1|1,0,2]=4 218 B14R2.781 OB(O)C1=CC=C2C=CC=CC2=C1 SC-03456 [0,0,0,0,0,1|2,0,1]=4 219 B14R2.781 S=C(S)C1=CC=C2C=CC=CC2=C1 SC-49356 [0,0,0,0,0,1|1,2,0]=4 220 B11R1.40 N\C(CC1=CC=CC=C1)=N/O SC-56234 [1,0,1,0,0,0|1,0,1]=4 221 B11R1.40 N\C(CC1=CC=CC=C1)=N/O SC-98439 [1,0,1,0,0,0|1,0,1]=4 222 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 SC-80359 [1,0,1,0,0,0|1,0,0]=3 223 B11R1.91 CC(=O)\C=C\C1=NC=CC=C1 SC-32985 [1,0,1,0,0,0|2,0,0]=4 224 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 SC-26692 [1,0,1,0,0,0|1,0,0]=3 225 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SC-13741 [1,0,1,0,0,0|0,0,2]=4 226 B11R1.91 O=C(O)CNC1=CC=CC=C1 SC-75650 [1,0,1,0,0,0|0,0,1]=3 227 B11R1.91 O=C(O)CNC1=CC=CN=C1 SC-A2839 [1,0,1,0,0,0|1,0,1]=4 228 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 SC-24646 [1,0,1,0,0,0|0,0,0]=2 229 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 SC-05126 [1,0,1,0,0,0|1,0,0]=3 230 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 SC-39613 [1,0,1,0,0,0|1,0,0]=3 231 B11R1.91 O=C(O)\C=C\C1=CN=CC=C1 SC-57973 [1,0,1,0,0,0|1,0,0]=3 232 B11R1.91 O=C(O)\C=C\C1=CN=CN=C1 SC-40320 [1,0,1,0,0,0|2,0,0]=4 233 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 SC-62388 [1,0,1,0,0,0|1,0,0]=3 234 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 SC-53253 [1,0,1,0,0,0|1,0,1]=4 235 B11R1.17 O=C\C=C\C1=CC=CC=C1Br SC-51702 [1,0,1,0,0,0|1,0,0]=3 236 B11R1.17 O=C\C=C\C1=CC=CC=C1O SC-92694 [1,0,1,0,0,0|1,0,0]=3 237 B11R1.17 O=C\C=C\C1=CC=CC=C1O SC-92985 [1,0,1,0,0,0|1,0,0]=3 238 B11R1.17 OC\C=C\C1=CC=CC=C1Br SC-36429 [1,0,1,0,0,0|1,0,1]=4 239 B11R1.17 OC\C=C\C1=CC=CC=C1Cl SC-36300 [1,0,1,0,0,0|1,0,1]=4 240 B11R1.17 OC\C=C\C1=CC=CC=C1F SC-36222 [1,0,1,0,0,0|1,0,1]=4 241 B11R2.10 BrC1=CC2=C(C=NC=C2)N1 SC-89530 [2,0,0,0,0,0|2,0,0]=4 242 B11R2.10 BrC1=CC2=C(N=CC=C2)N1 SC-45484 [2,0,0,0,0,0|2,0,0]=4 243 B11R2.10 BrC1=CC2=CC=CC=C2C1 SC-29345 [2,0,0,0,0,0|2,0,0]=4 244 B11R2.10 BrC1=CC2=CC=CC=C2C1 SC-43900 [2,0,0,0,0,0|2,0,0]=4 245 B11R2.10 BrC1=CC2=CC=CC=C2O1 SC-20255 [2,0,0,0,0,0|2,0,0]=4 246 B11R2.10 BrC1=NC2=CC=CC=C2N1 SC-79489 [2,0,0,0,0,0|2,0,0]=4 247 B11R2.10 CC1=CC2=C(C=CC=C2)N1 SC-25318 [2,0,0,0,0,0|0,0,1]=3 248 B11R2.10 CC1=CC2=C(C=NC=C2)N1 SC-47738 [2,0,0,0,0,0|1,0,1]=4 249 B11R2.10 CC1=CC2=CC=CN=C2N1 SC-53400 [2,0,0,0,0,0|1,0,1]=4 250 B11R2.10 ClC1=NC2=CC=CC=C2N1 SC-04768 [2,0,0,0,0,0|2,0,0]=4 251 B11R2.10 IC1=CC2=CC=CC=C2S1 SC-67981 [2,0,0,0,0,0|2,0,0]=4 252 B11R2.10 NC1=CC2=C(C=CC=C2)N1 SC-66630 [2,0,0,0,0,0|1,0,0]=3 253 B11R2.10 NC1=CC2=C(C=CC=C2)N1 SC-A3342 [2,0,0,0,0,0|1,0,0]=3 254 B11R2.10 NC1=NC2=CC=CC=C2N1 SC-07373 [2,0,0,0,0,0|2,0,0]=4 255 B11R2.10 O=C1CC2=C(C=CC=C2)C1 SC-05757 [2,0,0,0,0,0|1,0,1]=4 256 B11R2.10 O=C1CC2=C(C=CC=C2)O1 SC-49068 [2,0,0,0,0,0|1,0,1]=4 257 B11R2.10 O=C1CC2=C(C=CC=N2)N1 SC-28965 [2,0,0,0,0,0|1,0,1]=4 258 B11R2.10 O=C1CC2=C(C=CN=C2)N1 SC-31829 [2,0,0,0,0,0|1,0,1]=4 259 B11R2.10 O=C1CC2=C(N=CC=C2)N1 SC-31954 [2,0,0,0,0,0|1,0,1]=4 260 B11R2.10 O=C1CC2=CC=NC=C2N1 SC-26037 [2,0,0,0,0,0|1,0,1]=4 261 B11R2.10 O=C1NC2=CC=CC=C2S1 SC-13471 [2,0,0,0,0,0|1,0,0]=3 262 B11R2.10 O=C1NC2=NC=CC=C2O1 SC-17102 [2,0,0,0,0,0|2,0,0]=4 263 B11R2.10 OC1=NC2=CC=CC=C2N1 SC-05759 [2,0,0,0,0,0|1,0,0]=3 264 B11R2.10 OC1=NN2C=CC=CC2=C1 SC-47910 [2,0,0,0,0,0|1,0,1]=4 265 B11R2.10 S=C1CC2=CC=CC=C2N1 SC-53242 [2,0,0,0,0,0|0,1,1]=4 266 B11R2.10 SC1=NC2=CC=CC=C2N1 SC-85290 [2,0,0,0,0,0|1,1,0]=4 267 B13R1.133 CC1=CC=C(CC(N)C(=O)O)C=C1 SC-10870 [0,1,1,0,0,0|0,0,2]=4 268 B13R1.133 CC1=CC=C(C[C@@H](N)C(=O)O)C=C1 SC-10869 [0,1,1,0,0,0|0,0,2]=4 269 B13R1.133 CC1=CC=C(C[C@H](N)C(=O)O)C=C1 SC-10868 [0,1,1,0,0,0|0,0,2]=4 270 B13R1.133 NC(CC1=CC=C(Br)C=C1)C(=O)O SC-10523 [0,1,1,0,0,0|0,0,2]=4 271 B13R1.133 NC(CC1=CC=C(Cl)C=C1)C(=O)O SC-10559 [0,1,1,0,0,0|0,0,2]=4 272 B13R1.133 NC(CC1=CC=C(I)C=C1)C(=O)O SC-10816 [0,1,1,0,0,0|0,0,2]=4 273 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O SC-09927 [0,1,1,0,0,0|0,0,2]=4 274 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O SC-10841 [0,1,1,0,0,0|0,0,2]=4 275 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O SC-47410 [0,1,1,0,0,0|0,0,2]=4 276 B13R1.133 NC1=CC=C(C[C@@H](N)C(=O)O)C=C1 SC-10500 [0,1,1,0,0,0|0,0,2]=4 277 B13R1.133 NC1=CC=C(C[C@H](N)C(=O)O)C=C1 SC-10501 [0,1,1,0,0,0|0,0,2]=4 278 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O SC-10521 [0,1,1,0,0,0|0,0,2]=4 279 B13R1.133 N[C@@H](CC1=CC=C(Cl)C=C1)C(=O)O SC-10557 [0,1,1,0,0,0|0,0,2]=4 280 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O SC-10780 [0,1,1,0,0,0|0,0,2]=4 281 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O SC-10782 [0,1,1,0,0,0|0,0,2]=4 282 B13R1.133 N[C@@H](CC1=CC=C(I)C=C1)C(=O)O SC-10814 [0,1,1,0,0,0|0,0,2]=4 283 B13R1.133 N[C@@H](CC1=CC=C(O)C=C1)C(=O)O SC-09926 [0,1,1,0,0,0|0,0,2]=4 284 B13R1.133 N[C@H](CC1=CC=C(Br)C=C1)C(=O)O SC-10522 [0,1,1,0,0,0|0,0,2]=4 285 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O SC-10558 [0,1,1,0,0,0|0,0,2]=4 286 B13R1.133 N[C@H](CC1=CC=C(F)C=C1)C(=O)O SC-10781 [0,1,1,0,0,0|0,0,2]=4 287 B13R1.133 [C@@H](N)(CC1=CC=C(I)C=C1)C(=O)O SC-10815 [0,1,1,0,0,0|0,0,2]=4 288 B13R1.133 [C@@H](N)(CC1=CC=C(O)C=C1)C(=O)O SC-09925 [0,1,1,0,0,0|0,0,2]=4 289 B13R1.135 C=C(CC1=CC=CC=C1)C(=O)OC SC-27010 [0,1,1,0,0,0|1,0,0]=3 290 B13R1.135 COC(=O)C(=O)CC1=CC=CC=C1 SC-21745 [0,1,1,0,0,0|1,0,1]=4 291 B13R1.135 [C@@H](N)(CC1=CC=CC=C1)C(=O)OC SC-09795 [0,1,1,0,0,0|0,0,2]=4 292 B13R1.148 CC1=CC(CC(N)C(=O)O)=CC=C1 SC-10861 [0,1,1,0,0,0|0,0,2]=4 293 B13R1.148 CC1=CC(C[C@@H](N)C(=O)O)=CC=C1 SC-10860 [0,1,1,0,0,0|0,0,2]=4 294 B13R1.148 CC1=CC(C[C@H](N)C(=O)O)=CC=C1 SC-10859 [0,1,1,0,0,0|0,0,2]=4 295 B13R1.148 NC(CC1=CC(O)=CC=C1)C(=O)O SC-10792 [0,1,1,0,0,0|0,0,2]=4 296 B13R1.148 NC(CC1=CC=CC(Br)=C1)C(=O)O SC-10514 [0,1,1,0,0,0|0,0,2]=4 297 B13R1.148 NC(CC1=CC=CC(F)=C1)C(=O)O SC-10773 [0,1,1,0,0,0|0,0,2]=4 298 B13R1.148 NC(CC1=CC=CC(I)=C1)C(=O)O SC-A4339 [0,1,1,0,0,0|0,0,2]=4 299 B13R1.148 N[C@@H](CC1=CC(O)=CC=C1)C(=O)O SC-10790 [0,1,1,0,0,0|0,0,2]=4 300 B13R1.148 N[C@@H](CC1=CC=CC(Br)=C1)C(=O)O SC-10512 [0,1,1,0,0,0|0,0,2]=4 301 B13R1.148 N[C@@H](CC1=CC=CC(Cl)=C1)C(=O)O SC-10548 [0,1,1,0,0,0|0,0,2]=4 302 B13R1.148 N[C@@H](CC1=CC=CC(F)=C1)C(=O)O SC-10771 [0,1,1,0,0,0|0,0,2]=4 303 B13R1.148 N[C@H](CC1=CC(F)=CC=C1)C(=O)O SC-10772 [0,1,1,0,0,0|0,0,2]=4 304 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)O SC-59523 [0,1,1,0,0,0|0,0,2]=4 305 B13R1.202 CC1=CC=CC=C1CC(N)C(=O)O SC-10852 [0,1,1,0,0,0|0,0,2]=4 306 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O SC-44239 [0,1,1,0,0,0|0,0,2]=4 307 B13R1.202 CC1=CC=CC=C1NC(=O)C(N)=O SC-57510 [0,1,1,0,0,0|2,0,0]=4 308 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O SC-10504 [0,1,1,0,0,0|0,0,2]=4 309 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O SC-10505 [0,1,1,0,0,0|0,0,2]=4 310 B13R1.202 NC(CC1=CC=CC=C1Cl)C(=O)O SC-10540 [0,1,1,0,0,0|0,0,2]=4 311 B13R1.202 NC(CC1=CC=CC=C1F)C(=O)O SC-10766 [0,1,1,0,0,0|0,0,2]=4 312 B13R1.202 N[C@@H](CC1=C(Br)C=CC=C1)C(=O)O SC-10503 [0,1,1,0,0,0|0,0,2]=4 313 B13R1.202 N[C@@H](CC1=C(F)C=CC=C1)C(=O)O SC-10764 [0,1,1,0,0,0|0,0,2]=4 314 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O SC-10539 [0,1,1,0,0,0|0,0,2]=4 315 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O SC-94203 [0,1,1,0,0,0|0,0,2]=4 316 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O SC-10765 [0,1,1,0,0,0|0,0,2]=4 317 B13R1.418 C=C[C@@H](CC1=CC=CC=C1)C(=O)O SC-30807 [0,1,1,0,0,0|1,0,1]=4 318 B13R1.418 C=C[C@H](CC1=CC=CC=C1)C(=O)O SC-30746 [0,1,1,0,0,0|1,0,1]=4 319 B13R1.418 N#C\C(=C/C1=CC=CN=C1)C(=O)O SC-62495 [0,1,1,0,0,0|1,0,1]=4 320 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O SC-27561 [0,1,1,0,0,0|0,0,2]=4 321 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)O SC-25000 [0,1,1,0,0,0|0,0,2]=4 322 B13R1.1073 C[C@@](N)(CC1=CC=CC=C1)C(=O)O SC-46109 [0,1,1,0,0,0|0,0,2]=4 323 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O SC-14196 [0,1,1,0,0,0|0,0,2]=4 324 B13R1.90 CCC1=CC=CC=C1\C=C\C(=O)O SC-40849 [0,1,1,0,0,0|1,0,0]=3 325 B13R1.90 CSC1=CC=CC=C1\C=C\C(=O)O SC-39528 [0,1,1,0,0,0|1,0,0]=3 326 B13R1.90 N#CC1=CC=CC=C1\C=C\C(=O)O SC-39180 [0,1,1,0,0,0|0,0,1]=3 327 B13R1.150 CC1=C(O)C(\C=C\C(=O)O)=CC=C1 SC-40078 [0,1,1,0,0,0|1,0,0]=3 328 B13R1.150 CC1=CC=CC(\C=C\C(=O)O)=C1C SC-40659 [0,1,1,0,0,0|1,0,0]=3 329 B13R1.150 O=C(O)\C=C\C1=CC=CC(Cl)=C1Cl SC-39449 [0,1,1,0,0,0|1,0,0]=3 330 B13R1.150 O=C(O)\C=C\C1=CC=CC(F)=C1O SC-41395 [0,1,1,0,0,0|1,0,0]=3 331 B13R1.150 O=C(O)\C=C\C1=CC=CC(O)=C1O SC-41392 [0,1,1,0,0,0|1,0,0]=3 332 B13R1.164 CC1=C(\C=C\C(=O)O)C=CC(O)=C1 SC-41351 [0,1,1,0,0,0|1,0,0]=3 333 B13R1.164 CC1=CC=C(\C=C\C(=O)O)C(Br)=C1 SC-39457 [0,1,1,0,0,0|1,0,0]=3 334 B13R1.164 CC1=CC=C(\C=C\C(=O)O)C(C)=C1 SC-42151 [0,1,1,0,0,0|1,0,0]=3 335 B13R1.164 CC1=CC=C(\C=C\C(=O)O)C(F)=C1 SC-39436 [0,1,1,0,0,0|1,0,0]=3 336 B13R1.164 CC1=CC=C(\C=C\C(=O)O)C(O)=C1 SC-39712 [0,1,1,0,0,0|1,0,0]=3 337 B13R1.164 O=C(O)\C=C\C1=C(Cl)C=C(Br)C=C1 SC-28764 [0,1,1,0,0,0|1,0,0]=3 338 B13R1.164 O=C(O)\C=C\C1=CC=C(Cl)C=C1Cl SC-44535 [0,1,1,0,0,0|1,0,0]=3 339 B13R1.164 O=C(O)\C=C\C1=CC=C(Cl)C=C1F SC-02270 [0,1,1,0,0,0|1,0,0]=3 340 B13R1.164 O=C(O)\C=C\C1=CC=C(F)C=C1Cl SC-20650 [0,1,1,0,0,0|1,0,0]=3 341 B13R1.164 O=C(O)\C=C\C1=CC=C(F)C=C1F SC-57959 [0,1,1,0,0,0|1,0,0]=3 342 B13R1.164 O=C(O)\C=C\C1=CC=C(O)C=C1Cl SC-41438 [0,1,1,0,0,0|1,0,0]=3 343 B13R1.164 O=C(O)\C=C\C1=CC=C(O)C=C1F SC-38854 [0,1,1,0,0,0|1,0,0]=3 344 B13R1.528 COC(=O)CNC1=CC=CC=C1Cl SC-01026 [0,1,1,0,0,0|1,0,1]=4 345 B13R1.893 CC1=CC(\C=C\C(=O)O)=C(C)C=C1 SC-41729 [0,1,1,0,0,0|1,0,0]=3 346 B13R1.893 CC1=CC=C(F)C(\C=C\C(=O)O)=C1 SC-42379 [0,1,1,0,0,0|1,0,0]=3 347 B13R1.893 CC1=CC=C(F)C=C1\C=C\C(=O)O SC-39275 [0,1,1,0,0,0|1,0,0]=3 348 B13R1.893 CC1=CC=C(O)C(\C=C\C(=O)O)=C1 SC-39145 [0,1,1,0,0,0|1,0,0]=3 349 B13R1.893 NC1=CC=C(Cl)C=C1\C=C\C(=O)O SC-38855 [0,1,1,0,0,0|0,0,0]=2 350 B13R1.893 O=C(O)\C=C\C1=CC(Br)=CC=C1I SC-42441 [0,1,1,0,0,0|1,0,0]=3 351 B13R1.893 O=C(O)\C=C\C1=CC(Br)=CC=C1O SC-40882 [0,1,1,0,0,0|1,0,0]=3 352 B13R1.893 O=C(O)\C=C\C1=CC(Cl)=CC=C1Br SC-41582 [0,1,1,0,0,0|1,0,0]=3 353 B13R1.893 O=C(O)\C=C\C1=CC(Cl)=CC=C1Cl SC-41153 [0,1,1,0,0,0|1,0,0]=3 354 B13R1.893 O=C(O)\C=C\C1=CC(Cl)=CC=C1F SC-41295 [0,1,1,0,0,0|1,0,0]=3 355 B13R1.893 O=C(O)\C=C\C1=CC(Cl)=CC=C1O SC-38778 [0,1,1,0,0,0|1,0,0]=3 356 B13R1.893 O=C(O)\C=C\C1=CC(F)=CC=C1Cl SC-41211 [0,1,1,0,0,0|1,0,0]=3 357 B13R1.893 O=C(O)\C=C\C1=CC(F)=CC=C1F SC-46689 [0,1,1,0,0,0|1,0,0]=3 358 B13R1.893 O=C(O)\C=C\C1=CC(F)=CC=C1O SC-41112 [0,1,1,0,0,0|1,0,0]=3 359 B13R1.893 O=C(O)\C=C\C1=CC(I)=CC=C1F SC-39433 [0,1,1,0,0,0|1,0,0]=3 360 B13R1.3787 CC1=C(\C=C\C(=O)O)C(Cl)=CC=C1 SC-39893 [0,1,1,0,0,0|1,0,0]=3 361 B13R1.3787 CC1=CC=CC(C)=C1\C=C\C(=O)O SC-41487 [0,1,1,0,0,0|1,0,0]=3 362 B13R1.3787 O=C(O)\C=C\C1=C(F)C=CC=C1Br SC-42282 [0,1,1,0,0,0|1,0,0]=3 363 B13R1.3787 O=C(O)\C=C\C1=C(O)C=CC=C1F SC-39317 [0,1,1,0,0,0|1,0,0]=3 364 B13R2.26 COCC1=NC2=CC=CC=C2N1 SC-64934 [1,1,0,0,0,0|1,0,1]=4 365 B13R2.43 CC1=CC2=C(C=C1)NC(CO)=C2 SC-42624 [1,1,0,0,0,0|0,0,1]=3 366 B13R2.43 CC1=CC=C2N=C(C=O)SC2=C1 SC-33663 [1,1,0,0,0,0|1,0,1]=4 367 B13R2.43 CC1=CC=C2SC(C=O)=NC2=C1 SC-33359 [1,1,0,0,0,0|1,0,1]=4 368 B13R2.43 NCC1=CC2=C(C=CC(Cl)=C2)N1 SC-27878 [1,1,0,0,0,0|1,0,1]=4 369 B13R2.43 O=CC1=CC2=C(C=C(Br)C=C2)N1 SC-72142 [1,1,0,0,0,0|0,0,0]=2 370 B13R2.43 O=CC1=CC2=C(C=C(Cl)C=C2)N1 SC-72145 [1,1,0,0,0,0|0,0,0]=2 371 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)N1 SC-62682 [1,1,0,0,0,0|0,0,0]=2 372 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)S1 SC-50235 [1,1,0,0,0,0|1,0,0]=3 373 B13R2.43 O=CC1=CC2=C(C=CC(Cl)=C2)N1 SC-72139 [1,1,0,0,0,0|0,0,0]=2 374 B13R2.43 O=CC1=CC2=CC=C(Br)C=C2S1 SC-50239 [1,1,0,0,0,0|1,0,0]=3 375 B13R2.43 O=CC1=NC2=CC=C(Cl)C=C2S1 SC-33169 [1,1,0,0,0,0|1,0,1]=4 376 B13R2.43 OCC1=CC2=C(C=C(Br)C=C2)N1 SC-72135 [1,1,0,0,0,0|0,0,1]=3 377 B13R2.43 OCC1=CC2=C(C=C(Cl)C=C2)N1 SC-72138 [1,1,0,0,0,0|0,0,1]=3 378 B13R2.43 OCC1=CC2=C(C=CC(Br)=C2)N1 SC-42155 [1,1,0,0,0,0|0,0,1]=3 379 B13R2.43 OCC1=CC2=C(C=CC(Cl)=C2)N1 SC-72133 [1,1,0,0,0,0|0,0,1]=3 380 B13R2.43 OCC1=CC2=CC=C(Cl)C=C2S1 SC-83434 [1,1,0,0,0,0|1,0,1]=4 381 B13R2.43 OCC1=NC2=CC=C(Br)C=C2N1 SC-83430 [1,1,0,0,0,0|1,0,1]=4 382 B13R2.45 CN1C2=CC=CC=C2N=C1C=O SC-84456 [1,1,0,0,0,0|1,0,0]=3 383 B13R2.45 O=CC1=C(Cl)C2=CC=CC=C2S1 SC-39056 [1,1,0,0,0,0|1,0,0]=3 384 B13R2.45 O=CC1=C(Cl)N2C=CC=CC2=N1 SC-22259 [1,1,0,0,0,0|1,0,1]=4 385 B13R2.45 OCC1=C(Cl)C2=CC=CC=C2S1 SC-38901 [1,1,0,0,0,0|1,0,1]=4 386 B13R2.54 CC1=C2N=C(C=O)SC2=CC=C1 SC-33550 [1,1,0,0,0,0|1,0,1]=4 387 B13R2.54 NCC1=CC2=C(C=CC=C2F)N1 SC-55445 [1,1,0,0,0,0|1,0,1]=4 388 B13R2.54 O=CC1=NC2=C(Cl)C=CC=C2S1 SC-33092 [1,1,0,0,0,0|1,0,1]=4 389 B13R2.54 O=CC1=NC2=CC=CC(Br)=C2O1 SC-94377 [1,1,0,0,0,0|1,0,1]=4 390 B13R2.2334 O=C(O)C1=C(Cl)C2=C(C=CO2)S1 SC-39040 [0,1,0,0,1,0|2,0,0]=4 391 B13R2.3678 O=C(O)C1=CC2=C(N1)C(Br)=CS2 SC-35247 [0,1,0,0,1,0|1,0,0]=3 392 B15R2.1569 COC(=O)CC1=NC2=CC=CC=C2O1 SC-91053 [0,1,0,0,0,1|1,0,1]=4 393 B15R2.4244 NC(C(=O)O)C1=CC2=CC=CC=C2O1 SC-59435 [0,1,0,0,0,1|1,0,0]=3 394 B15R2.7252 O=C(O)CC1=CC2=C(C=CC(Br)=C2)N1 SC-59885 [0,1,0,0,0,1|0,0,0]=2 395 B15R2.627 CC(=O)C1=CC=C2C=CC=CC2=C1O SC-22278 [0,1,0,0,0,1|2,0,0]=4 396 B15R2.627 NC1=C2C=CC=CC2=CC=C1C(=O)O SC-95921 [0,1,0,0,0,1|1,0,0]=3 397 B15R2.627 NC1=C2C=CC=NC2=CC=C1C(=O)O SC-50985 [0,1,0,0,0,1|2,0,0]=4 398 B15R2.627 O=C(Cl)C1=CC=C2C=CC=CC2=C1O SC-62777 [0,1,0,0,0,1|2,0,0]=4 399 B15R2.627 O=C(O)C1=C(Cl)C2=CC=CC=C2N=C1 SC-44866 [0,1,0,0,0,1|0,0,1]=3 400 B15R2.627 O=C(O)C1=C(O)C2=C(C=CC=C2)N=C1 SC-27121 [0,1,0,0,0,1|0,0,1]=3 401 B15R2.627 O=C(O)C1=C(O)C2=NC=CC=C2N=C1 SC-23176 [0,1,0,0,0,1|1,0,1]=4 402 B15R2.627 O=C(O)C1=CC=C2C=CC=NC2=C1O SC-26084 [0,1,0,0,0,1|2,0,0]=4 403 B15R2.627 O=C(O)C1=CNC2=C(C=CC=C2)C1=O SC-89015 [0,1,0,0,0,1|0,0,0]=2 404 B15R2.627 O=C(O)C1=COC2=CC=CC=C2C1=O SC-58034 [0,1,0,0,0,1|1,0,0]=3 405 B15R2.984 O=C(Cl)C1=CC2=CC=CC=C2OC1=O SC-61110 [0,1,0,0,0,1|2,0,0]=4 406 B15R2.984 O=C(Cl)C1=NC2=C(C=CC=C2)NC1=O SC-61052 [0,1,0,0,0,1|1,0,1]=4 407 B15R2.984 O=C(Cl)C1=NC2=CC=CC=C2N=C1Cl SC-61053 [0,1,0,0,0,1|1,0,1]=4 408 B15R2.984 O=C(O)C1=CC2=C(C=CC=C2)N=C1Cl SC-32507 [0,1,0,0,0,1|0,0,1]=3 409 B15R2.984 O=C(O)C1=CC2=CC=CC=C2N=C1O SC-99178 [0,1,0,0,0,1|0,0,1]=3 410 B15R2.1601 COC(=O)C1=CC2=C(C=C1)N=CC=C2 SC-22943 [0,1,0,0,0,1|2,0,0]=4 411 B15R2.1601 COC(=O)C1=CC2=C(C=CC=C2)NC1 SC-69257 [0,1,0,0,0,1|0,0,0]=2 412 B15R2.1601 COC(=O)C1=CC2=C(C=CN=C2)C=C1 SC-33787 [0,1,0,0,0,1|2,0,0]=4 413 B15R2.1601 COC(=O)C1=CC2=CC=CC=C2C=N1 SC-22464 [0,1,0,0,0,1|0,0,1]=3 414 B15R2.1601 COC(=O)C1=CC2=CC=CC=C2N=C1 SC-65864 [0,1,0,0,0,1|0,0,1]=3 415 B15R2.1601 COC(=O)C1=CC=C2C=CC=NC2=C1 SC-90564 [0,1,0,0,0,1|2,0,0]=4 416 B15R2.1601 COC(=O)C1=NC2=CC=CC=C2C=C1 SC-59875 [0,1,0,0,0,1|0,0,1]=3 417 B15R2.1601 COC(=O)[C@@H]1CC2=C(C=CC=C2)CN1 SC-A2759 [0,1,0,0,0,1|0,0,2]=4 418 B15R2.1601 O=C(CCl)C1=CC2=C(C=CC=C2)C=N1 SC-34230 [0,1,0,0,0,1|1,0,1]=4 419 B15R2.1601 O=C(CCl)C1=CC2=CC=CC=C2N=C1 SC-32021 [0,1,0,0,0,1|1,0,1]=4 420 B15R2.7174 CC(=O)C1=NC2=CC(C)=CC=C2C=C1 SC-40014 [0,1,0,0,0,1|1,0,1]=4 421 B15R2.7174 NC1=CC2=C(C=C1)C=CC(C(=O)O)=N2 SC-68240 [0,1,0,0,0,1|0,0,1]=3 422 B15R2.7174 NC1=CC2=CC(C(=O)O)=CN=C2C=C1 SC-68629 [0,1,0,0,0,1|0,0,1]=3 423 B15R2.7174 O=C(O)C1=CC2=C(C=C1)C=NC(Br)=C2 SC-51019 [0,1,0,0,0,1|2,0,0]=4 424 B15R2.7174 O=C(O)C1=CC2=C(C=CC(Br)=C2)OC1 SC-A2268 [0,1,0,0,0,1|1,0,0]=3 425 B15R2.7174 O=C(O)C1=CC2=C(C=CC(Cl)=C2)OC1 SC-54332 [0,1,0,0,0,1|1,0,0]=3 426 B15R2.7174 O=C(O)C1=CC2=CC(Br)=CC=C2N=C1 SC-68887 [0,1,0,0,0,1|0,0,1]=3 427 B15R2.7174 O=C(O)C1=CC=C2C=CC(Br)=CC2=C1 SC-A5814 [0,1,0,0,0,1|1,0,0]=3 428 B15R2.7174 O=C(O)C1=CC=C2C=CC(O)=NC2=C1 SC-90805 [0,1,0,0,0,1|2,0,0]=4 429 B15R2.7174 O=C(O)C1=CC=C2N=CC(Br)=CC2=C1 SC-93411 [0,1,0,0,0,1|2,0,0]=4 430 B15R2.7174 O=C(O)C1=CC=C2N=CC(O)=CC2=C1 SC-91528 [0,1,0,0,0,1|2,0,0]=4 431 B15R2.7174 O=C(O)C1=CN=C2C=CC(Cl)=CC2=C1 SC-44669 [0,1,0,0,0,1|0,0,1]=3 432 B15R2.7174 O=C(O)C1=CN=C2C=CC(F)=CC2=C1 SC-68523 [0,1,0,0,0,1|0,0,1]=3 433 B15R2.7174 O=C(O)C1=CN=C2C=CC(O)=CC2=C1 SC-68626 [0,1,0,0,0,1|0,0,1]=3 434 B15R2.7174 O=C(O)C1=NC2=CC(Cl)=CC=C2C=C1 SC-31248 [0,1,0,0,0,1|0,0,1]=3 435 B15R2.7174 O=C(O)C1CC2=C(C=CC(O)=C2)CN1 SC-23733 [0,1,0,0,0,1|0,0,2]=4 436 B15R2.7180 CC(=O)C1=CC2=C(C=C1)C=C(O)C=C2 SC-45411 [0,1,0,0,0,1|2,0,0]=4 437 B15R2.7180 CC1=NC2=CC=C(C(=O)O)C=C2C=C1 SC-85045 [0,1,0,0,0,1|2,0,0]=4 438 B15R2.7180 NC1=CC2=C(C=N1)C=C(C(=O)O)C=C2 SC-89224 [0,1,0,0,0,1|2,0,0]=4 439 B15R2.7180 NC1=CC2=CC=C(C(=O)O)C=C2C=C1 SC-85080 [0,1,0,0,0,1|1,0,0]=3 440 B15R2.7180 NC1=CC=C2C=C(C(=O)O)C=NC2=C1 SC-68623 [0,1,0,0,0,1|0,0,1]=3 441 B15R2.7180 NC1=CC=C2N=C(C(=O)O)C=CC2=C1 SC-68622 [0,1,0,0,0,1|0,0,1]=3 442 B15R2.7180 O=C(O)C1=CC2=C(C=C1)C=C(Cl)C=C2 SC-35752 [0,1,0,0,0,1|1,0,0]=3 443 B15R2.7180 O=C(O)C1=CC2=C(C=N1)C=C(F)C=C2 SC-34018 [0,1,0,0,0,1|0,0,1]=3 444 B15R2.7180 O=C(O)C1=CC2=C(C=N1)C=C(F)C=C2 SC-98000 [0,1,0,0,0,1|0,0,1]=3 445 B15R2.7180 O=C(O)C1=CC2=CC=C(Br)C=C2N=C1 SC-68613 [0,1,0,0,0,1|0,0,1]=3 446 B15R2.7180 O=C(O)C1=CC2=CC=C(Cl)C=C2N=C1 SC-44861 [0,1,0,0,0,1|0,0,1]=3 447 B15R2.7180 O=C(O)C1=CC2=CC=C(F)C=C2N=C1 SC-68202 [0,1,0,0,0,1|0,0,1]=3 448 B15R2.7180 O=C(O)C1=CC=C2N=C(Cl)C=CC2=C1 SC-45058 [0,1,0,0,0,1|2,0,0]=4 449 B15R2.7180 O=C(O)C1=CC=C2N=C(O)C=CC2=C1 SC-71264 [0,1,0,0,0,1|2,0,0]=4 450 B15R2.7180 O=C(O)C1=NC2=C(C=C1)C=C(Br)C=C2 SC-36400 [0,1,0,0,0,1|0,0,1]=3 451 B15R2.7180 O=C(O)C1=NC2=CC=C(Cl)C=C2C=C1 SC-68521 [0,1,0,0,0,1|0,0,1]=3 452 B15R2.7180 O=C(O)C1=NC2=CC=C(F)C=C2C=C1 SC-68884 [0,1,0,0,0,1|0,0,1]=3 453 B15R2.7180 O=C(O)C1CC2=C(C=C(O)C=C2)CN1 SC-36241 [0,1,0,0,0,1|0,0,2]=4 454 B15R2.7180 O=C(O)[C@@H]1CC2=C(C=C(O)C=C2)CN1 SC-23683 [0,1,0,0,0,1|0,0,2]=4 455 B15R2.13598 NC1=C2C=CC(C(=O)O)=NC2=CC=C1 SC-68467 [0,1,0,0,0,1|0,0,1]=3 456 B15R2.13598 NC1=C2N=CC(C(=O)O)=CC2=CC=C1 SC-68477 [0,1,0,0,0,1|0,0,1]=3 457 B15R2.13598 O=C(O)C1=CC2=C(C=C1)C(=O)NC=C2 SC-48871 [0,1,0,0,0,1|2,0,0]=4 458 B15R2.13598 O=C(O)C1=CC2=C(C=C1)C(Cl)=NC=C2 SC-34868 [0,1,0,0,0,1|2,0,0]=4 459 B15R2.13598 O=C(O)C1=CC2=CC=CC(Br)=C2N=C1 SC-25270 [0,1,0,0,0,1|0,0,1]=3 460 B15R2.13598 O=C(O)C1=CC2=CC=CC(Cl)=C2N=C1 SC-28362 [0,1,0,0,0,1|0,0,1]=3 461 B15R2.13598 O=C(O)C1=CC2=CC=CC(O)=C2N=C1 SC-68484 [0,1,0,0,0,1|0,0,1]=3 462 B15R2.13598 O=C(O)C1=CC2=NC=CC(Cl)=C2C=C1 SC-26597 [0,1,0,0,0,1|2,0,0]=4 463 B15R2.13598 O=C(O)C1=CC=C2C(Br)=CC=CC2=C1 SC-44409 [0,1,0,0,0,1|1,0,0]=3 464 B15R2.13598 O=C(O)C1=CC=C2C(O)=CC=NC2=C1 SC-51756 [0,1,0,0,0,1|2,0,0]=4 465 B15R2.13598 O=C(O)C1=NC2=CC=CC(Br)=C2C=C1 SC-51016 [0,1,0,0,0,1|0,0,1]=3 466 B15R2.14951 NC1=CC(C(=O)O)=NC2=CC=CC=C12 SC-59876 [0,1,0,0,0,1|0,0,1]=3 467 B15R2.14951 O=C(Cl)C1=CC(=O)C2=CC=CC=C2O1 SC-61108 [0,1,0,0,0,1|2,0,0]=4 468 B15R2.14951 O=C(O)C1=CC2=C(C=CC=C2)C(Cl)=N1 SC-34250 [0,1,0,0,0,1|0,0,1]=3 469 B15R2.14951 O=C(O)C1=NC2=C(C=CC=C2)C(Cl)=C1 SC-61566 [0,1,0,0,0,1|0,0,1]=3 470 B15R2.14951 O=C(O)C1=NC2=CC=CC=C2C(Br)=C1 SC-12806 [0,1,0,0,0,1|0,0,1]=3 471 B15R2.14951 O=C1CC(C(=O)O)CC2=C1C=CC=C2 SC-34817 [0,1,0,0,0,1|1,0,1]=4 472 B15R2.61353 CC(=O)C1=NC2=C(Br)C=CC=C2C=C1 SC-40301 [0,1,0,0,0,1|1,0,1]=4 473 B15R2.61353 NC(=O)C1=NC2=C(O)C=CC=C2C=C1 SC-41078 [0,1,0,0,0,1|1,0,1]=4 474 B15R2.61353 NC1=C2C=C(C(=O)O)C=NC2=CC=C1 SC-68889 [0,1,0,0,0,1|0,0,1]=3 475 B15R2.61353 NC1=CC=NC2=CC=C(C(=O)O)C=C12 SC-68506 [0,1,0,0,0,1|2,0,0]=4 476 B15R2.61353 O=C(O)C1=CC2=C(Br)C=CC=C2N=C1 SC-68533 [0,1,0,0,0,1|0,0,1]=3 477 B15R2.61353 O=C(O)C1=CC2=C(C=CN=C2Cl)C=C1 SC-34443 [0,1,0,0,0,1|2,0,0]=4 478 B15R2.61353 O=C(O)C1=CC2=C(C=CN=C2Cl)C=C1 SC-48874 [0,1,0,0,0,1|2,0,0]=4 479 B15R2.61353 O=C(O)C1=CC2=C(C=CNC2=O)C=C1 SC-48873 [0,1,0,0,0,1|2,0,0]=4 480 B15R2.61353 O=C(O)C1=CC2=C(Cl)C=CC=C2N=C1 SC-68890 [0,1,0,0,0,1|0,0,1]=3 481 B15R2.61353 O=C(O)C1=CC2=C(F)C=CC=C2N=C1 SC-68452 [0,1,0,0,0,1|0,0,1]=3 482 B15R2.61353 O=C(O)C1=CC2=C(O)C=CC=C2N=C1 SC-68535 [0,1,0,0,0,1|0,0,1]=3 483 B15R2.61353 O=C(O)C1=CC=C2N=CC=C(Br)C2=C1 SC-68223 [0,1,0,0,0,1|2,0,0]=4 484 B15R2.61353 O=C(O)C1=CC=C2N=CC=C(Cl)C2=C1 SC-68166 [0,1,0,0,0,1|2,0,0]=4 485 B15R2.61353 O=C(O)C1=NC2=C(Br)C=CC=C2C=C1 SC-48869 [0,1,0,0,0,1|0,0,1]=3 486 B15R2.61353 O=C(O)C1=NC2=C(C=CC=C2F)C=C1 SC-68869 [0,1,0,0,0,1|0,0,1]=3 487 B15R2.61353 O=C(O)C1=NC2=C(Cl)C=CC=C2C=C1 SC-68517 [0,1,0,0,0,1|0,0,1]=3 488 B15R2.630 NN1C2=CC=CC=C2N=C1S(=O)(=O)O SC-89770 [0,2,0,0,0,0|2,0,0]=4 489 B15R2.1592 CC1=C(C(=O)CBr)OC2=CC=CC=C21 SC-32378 [0,2,0,0,0,0|2,0,0]=4 490 B15R2.1592 CC1=C(C(=O)NN)OC2=C1C=CC=C2 SC-41658 [0,2,0,0,0,0|2,0,0]=4 491 B15R2.1592 COC(=O)C1=C(Br)C2=CC=CC=C2N1 SC-59893 [0,2,0,0,0,0|0,0,0]=2 492 B15R2.1592 COC(=O)C1=C(Br)C2=NC=CC=C2N1 SC-51678 [0,2,0,0,0,0|1,0,0]=3 493 B15R2.1592 COC(=O)C1=C(O)C2=C(C=CC=C2)N1 SC-49996 [0,2,0,0,0,0|0,0,0]=2 494 B15R2.4190 CCC1=C(C(C)=O)OC2=CC=CC=C21 SC-32741 [0,2,0,0,0,0|2,0,0]=4 495 B15R2.7203 CC(=O)C1=C(C)C2=CC(Br)=CC=C2O1 SC-32747 [0,2,0,0,0,0|2,0,0]=4 496 B15R2.7203 CC(=O)C1=C(C)C2=CC(C)=CC=C2O1 SC-32931 [0,2,0,0,0,0|2,0,0]=4 497 B15R2.7203 CC(=O)C1=C(C)C2=CC(Cl)=CC=C2O1 SC-32313 [0,2,0,0,0,0|2,0,0]=4 498 B15R2.7203 CC1=C(C(=O)O)SC2=CC=C(Cl)C=C21 SC-58438 [0,2,0,0,0,0|1,0,0]=3 499 B15R2.7203 CC1=C(C(=O)O)SC2=CC=C(F)C=C21 SC-19698 [0,2,0,0,0,0|1,0,0]=3 500 B15R2.13629 CC1=C(C(=O)O)N=C2C=CC=C(Cl)N21 SC-21442 [0,2,0,0,0,0|1,0,1]=4 501 B15R2.13629 CC1=CC=CC2=C1C(Cl)=C(C(=O)O)S2 SC-38815 [0,2,0,0,0,0|1,0,0]=3 502 B15R2.13629 O=C(O)C1=C(Cl)C2=C(C=CC=C2Br)S1 SC-41258 [0,2,0,0,0,0|1,0,0]=3 503 B15R2.13629 O=C(O)C1=C(Cl)C2=C(C=CC=C2Cl)S1 SC-41294 [0,2,0,0,0,0|1,0,0]=3 504 B15R2.13629 O=C(O)C1=C(Cl)C2=C(O)C=CC=C2S1 SC-39661 [0,2,0,0,0,0|1,0,0]=3 505 B15R2.14758 CC1=C(C(=O)O)N=C2C=C(Cl)C=CN21 SC-25092 [0,2,0,0,0,0|1,0,1]=4 506 B15R2.14758 O=C(Cl)C1=C(Cl)C2=C(C=C(Br)C=C2)S1 SC-72493 [0,2,0,0,0,0|2,0,0]=4 507 B15R2.14758 O=C(O)C1=C(Cl)C2=C(C=C(Br)C=C2)S1 SC-41349 [0,2,0,0,0,0|1,0,0]=3 508 B15R2.14758 O=C(O)C1=C(Cl)C2=C(C=C(F)C=C2)S1 SC-41256 [0,2,0,0,0,0|1,0,0]=3 509 B15R2.14758 O=C(O)C1=C(Cl)C2=CC=C(Cl)C=C2S1 SC-13116 [0,2,0,0,0,0|1,0,0]=3 510 B15R2.14758 O=C(O)C1=C(Cl)C2=CC=C(I)C=C2S1 SC-38888 [0,2,0,0,0,0|1,0,0]=3 511 B15R2.14758 O=C(O)C1=C(Cl)C2=CC=C(O)C=C2S1 SC-39754 [0,2,0,0,0,0|1,0,0]=3 512 B15R2.1356 CCOC(=O)C1=CC2=C(C=CN=C2)N1 SC-34319 [0,2,0,0,0,0|1,0,0]=3 513 B15R2.1356 CCOC(=O)C1=CC2=CC=CN=C2N1 SC-31545 [0,2,0,0,0,0|1,0,0]=3 514 B15R2.1356 CCOC(=O)C1=CN2C=CC=CC2=N1 SC-23502 [0,2,0,0,0,0|1,0,1]=4 515 B15R2.1356 CCOC(=O)C1=NC2=CC=CC=C2S1 SC-50065 [0,2,0,0,0,0|1,0,1]=4 516 B15R2.1356 CCOC(=O)C1CC2=C(C=CC=C2)N1 SC-41950 [0,2,0,0,0,0|0,0,2]=4 517 B15R2.1356 CCOC(=O)C1CC2=C(C=CC=C2)N1 SC-A5009 [0,2,0,0,0,0|0,0,2]=4 518 B15R2.1356 N#CCC(=O)C1=CC2=C(C=CC=C2)O1 SC-40598 [0,2,0,0,0,0|2,0,0]=4 519 B15R2.1590 COC(=O)C1=CC2=C(C=C(Br)C=C2)N1 SC-72347 [0,2,0,0,0,0|0,0,0]=2 520 B15R2.1590 COC(=O)C1=CC2=C(C=C(Br)C=C2)S1 SC-50240 [0,2,0,0,0,0|1,0,0]=3 521 B15R2.1590 COC(=O)C1=CC2=C(C=C(Cl)N=C2)N1 SC-B8134 [0,2,0,0,0,0|1,0,0]=3 522 B15R2.1590 COC(=O)C1=CC2=C(C=C(N)C=C2)N1 SC-99872 [0,2,0,0,0,0|0,0,0]=2 523 B15R2.1590 COC(=O)C1=CC2=C(C=CC(Cl)=C2)N1 SC-61031 [0,2,0,0,0,0|0,0,0]=2 524 B15R2.1590 COC(=O)C1=CC2=C(C=CC(F)=C2)N1 SC-61030 [0,2,0,0,0,0|0,0,0]=2 525 B15R2.1590 COC(=O)C1=CC2=C(C=CC(F)=C2)S1 SC-49405 [0,2,0,0,0,0|1,0,0]=3 526 B15R2.1590 COC(=O)C1=CC2=CC(Br)=CC=C2S1 SC-50236 [0,2,0,0,0,0|1,0,0]=3 527 B15R2.1590 COC(=O)C1=CC2=CC(Cl)=CN=C2N1 SC-35310 [0,2,0,0,0,0|1,0,0]=3 528 B15R2.1590 COC(=O)C1=CC2=CC(N)=CN=C2N1 SC-25256 [0,2,0,0,0,0|1,0,0]=3 529 B15R2.1590 COC(=O)C1=CC2=CC=C(F)C=C2N1 SC-61027 [0,2,0,0,0,0|0,0,0]=2 530 B15R2.1590 COC(=O)C1=NC2=CC(Br)=CC=C2O1 SC-72457 [0,2,0,0,0,0|1,0,1]=4 531 B15R2.1590 NNC(=O)C1=CC2=C(C=CC(Cl)=C2)N1 SC-39945 [0,2,0,0,0,0|1,0,0]=3 532 B15R2.1590 O=C(CBr)C1=CC2=CC(Br)=CC=C2O1 SC-33313 [0,2,0,0,0,0|2,0,0]=4 533 B15R2.1590 O=C(CBr)C1=CC2=CC(Cl)=CC=C2O1 SC-32580 [0,2,0,0,0,0|2,0,0]=4 534 B15R2.1590 O=C(CBr)C1=CC2=CC=C(Br)C=C2O1 SC-34736 [0,2,0,0,0,0|2,0,0]=4 535 B15R2.1598 COC(=O)C1=CC2=C(C=NC=C2Br)S1 SC-14315 [0,2,0,0,0,0|2,0,0]=4 536 B15R2.1598 COC(=O)C1=CC2=C(C=NC=C2Cl)S1 SC-30672 [0,2,0,0,0,0|2,0,0]=4 537 B15R2.1598 COC(=O)C1=CC2=C(N1)C(Br)=CC=C2 SC-22434 [0,2,0,0,0,0|0,0,0]=2 538 B15R2.1102 CC1=CC2=C(C=C1N)NC(C(=O)O)=C2 SC-70161 [0,2,0,0,0,0|0,0,0]=2 539 B15R2.1102 O=C(Cl)C1=CC2=C(C=C(F)C(F)=C2)N1 SC-61026 [0,2,0,0,0,0|1,0,0]=3 540 B15R2.1102 O=C(O)C1=CC2=CC(F)=C(F)C=C2N1 SC-01638 [0,2,0,0,0,0|0,0,0]=2 541 B15R2.4834 COC1=CC2=C(C=C1)C=C(C(=O)Cl)N2 SC-61036 [0,2,0,0,0,0|1,0,0]=3 542 B15R2.4834 COC1=CC2=C(C=C1)C=C(C(=O)O)N2 SC-01589 [0,2,0,0,0,0|0,0,0]=2 543 B15R2.4834 COC1=CC2=C(C=C1)C=C(C(=O)O)S2 SC-21996 [0,2,0,0,0,0|1,0,0]=3 544 B15R2.4834 COC1=CC2=C(C=C1)NC(C(=O)Cl)=C2 SC-62787 [0,2,0,0,0,0|1,0,0]=3 545 B15R2.4834 COC1=CC2=C(C=C1)NC(C(=O)O)=C2 SC-04495 [0,2,0,0,0,0|0,0,0]=2 546 B15R2.4834 COC1=CC2=C(C=C1)OC(C(=O)O)=C2 SC-58183 [0,2,0,0,0,0|1,0,0]=3 547 B15R2.4834 COC1=CC=C2C=C(C(C)=O)OC2=C1 SC-14488 [0,2,0,0,0,0|2,0,0]=4 548 B15R2.7254 O=C(O)C1=CC2=C(N1)C(Cl)=C(Cl)C=C2 SC-A3866 [0,2,0,0,0,0|0,0,0]=2 549 B15R2.15633 O=C(Cl)C1=CC2=C(Cl)C=C(Cl)C=C2N1 SC-54387 [0,2,0,0,0,0|1,0,0]=3 550 B15R2.15633 O=C(O)C1=CC2=C(C=C(Cl)C=C2Cl)N1 SC-00094 [0,2,0,0,0,0|0,0,0]=2 551 B15R2.15633 O=C(O)C1=CC2=C(C=C(F)C=C2F)N1 SC-02852 [0,2,0,0,0,0|0,0,0]=2 552 B15R2.15633 O=C(O)C1=CC2=C(N1)C(F)=CC(F)=C2 SC-91731 [0,2,0,0,0,0|0,0,0]=2 553 B15R2.15633 O=C(O)C1=CN2C=C(Cl)C=C(Br)C2=N1 SC-A2259 [0,2,0,0,0,0|1,0,1]=4 554 B15R2.15633 O=C(O)C1=NC2=C(Cl)C=C(Cl)C=C2S1 SC-34588 [0,2,0,0,0,0|1,0,1]=4 555 B15R2.15633 O=C(O)C1=NC2=C(F)C=C(F)C=C2S1 SC-34752 [0,2,0,0,0,0|1,0,1]=4 556 B15R2.20824 COC1=CC=CC2=C1C=C(C(=O)Cl)N2 SC-61038 [0,2,0,0,0,0|1,0,0]=3 557 B15R2.20824 COC1=CC=CC2=C1C=C(C(=O)O)N2 SC-00134 [0,2,0,0,0,0|0,0,0]=2 558 B15R2.20824 COC1=CC=CC2=C1NC(C(=O)O)=C2 SC-61039 [0,2,0,0,0,0|0,0,0]=2 559 B13R2.369 CC1=CC2=C(C=CC=C2)C=C1N SC-12982 [0,0,1,1,0,0|2,0,0]=4 560 B13R2.369 NC1=C(N)C=C2C=CC=CC2=C1 SC-26029 [0,0,1,1,0,0|2,0,0]=4 561 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1Br SC-50732 [0,0,1,1,0,0|2,0,0]=4 562 B13R2.369 O=C1OC2=CC=CC=C2N=C1Cl SC-51442 [0,0,1,1,0,0|1,0,1]=4 563 B13R2.5179 NC1=CC=CC2=CC(O)=CC=C12 SC-78794 [0,0,1,1,0,0|1,0,0]=3 564 B13R2.5179 OC1=CC=C2C(Br)=CC=CC2=C1 SC-A2310 [0,0,1,1,0,0|2,0,0]=4 565 B13R2.5179 OC1=NC2=CC=CC(Br)=C2C=C1 SC-05099 [0,0,1,1,0,0|2,0,0]=4 566 B13R2.72 O=C(O)C1=C2C=CC=CN2C=N1 SC-50557 [0,0,1,1,0,0|1,0,1]=4 567 B13R2.72 O=C(O)C1=CSC2=CC=CC=C21 SC-46218 [0,0,1,1,0,0|2,0,0]=4 568 B13R2.72 O=C(O)C1=NOC2=CC=CC=C21 SC-26583 [0,0,1,1,0,0|1,0,1]=4 569 B13R2.72 O=C(O)C1NCC2=C1C=CC=C2 SC-49419 [0,0,1,1,0,0|0,0,2]=4 570 B13R2.72 O=C(O)[C@H]1NCC2=C1C=CC=C2 SC-70901 [0,0,1,1,0,0|0,0,2]=4 571 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=C2 SC-01580 [0,0,1,1,0,0|2,0,0]=4 572 B13R2.430 O=C(O)C1=CC2=C(C=C1)OC=C2 SC-07269 [0,0,1,1,0,0|2,0,0]=4 573 B13R2.430 O=C(O)C1=CC=C2C=COC2=C1 SC-68712 [0,0,1,1,0,0|2,0,0]=4 574 B13R2.430 O=C(O)C1=CC=C2NC=CC2=N1 SC-B8103 [0,0,1,1,0,0|1,0,1]=4 575 B13R2.430 O=C(O)C1=CN2C=CC=C2C=C1 SC-50294 [0,0,1,1,0,0|2,0,0]=4 576 B13R2.430 O=C(O)C1=CN2C=CC=C2CN1 SC-A2254 [0,0,1,1,0,0|1,0,1]=4 577 B13R2.430 O=C(O)C1=NC2=C(C=CN2)C=C1 SC-12139 [0,0,1,1,0,0|1,0,1]=4 578 B13R2.5569 O=C(O)C1=C2C=CNC2=CC=C1 SC-02433 [0,0,1,1,0,0|2,0,0]=4 579 B13R2.5569 O=C(O)C1=C2C=COC2=CC=C1 SC-43739 [0,0,1,1,0,0|2,0,0]=4 580 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 SC-19433 [0,0,1,0,1,0|0,0,0]=2 581 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 SC-15490 [0,0,1,0,1,0|0,0,2]=4 582 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 SC-06768 [0,0,1,0,1,0|0,0,2]=4 583 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 SC-73565 [0,0,1,0,1,0|1,0,1]=4 584 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 SC-11836 [0,0,1,0,1,0|1,0,1]=4 585 B11R1.36 N[C@@H](C(=O)Cl)C1=CC=CC=C1 SC-44154 [0,0,1,0,1,0|1,0,1]=4 586 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 SC-12537 [0,0,1,0,1,0|1,0,0]=3 587 B11R1.36 O=C(O)C(=O)C1=CC=NC=C1 SC-48523 [0,0,1,0,1,0|2,0,0]=4 588 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 SC-45533 [0,0,1,0,1,0|1,0,1]=4 589 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 SC-57916 [0,0,1,0,1,0|1,0,1]=4 590 B11R1.36 [C@@H](C)(C(=O)O)C1=CC=CC=C1 SC-06767 [0,0,1,0,1,0|0,0,2]=4 591 B11R1.86 CC(=O)NC1=CC=CC=C1N SC-67459 [0,0,1,0,1,0|2,0,0]=4 592 B11R1.86 NC(=O)NC1=C(Br)C=CC=C1 SC-21573 [0,0,1,0,1,0|2,0,0]=4 593 B11R1.86 NC1=C(CC(=O)O)C=CC=N1 SC-29898 [0,0,1,0,1,0|1,0,1]=4 594 B11R1.86 NC1=C(CC(=O)O)C=CN=C1 SC-26477 [0,0,1,0,1,0|1,0,1]=4 595 B11R1.86 NC1=C(CC(=O)O)N=CC=C1 SC-30824 [0,0,1,0,1,0|1,0,1]=4 596 B11R1.86 NC1=CC=CC=C1CC(=O)O SC-79949 [0,0,1,0,1,0|0,0,1]=3 597 B11R1.86 O=C(O)CC1=CC=CC=C1Cl SC-15304 [0,0,1,0,1,0|1,0,1]=4 598 B11R1.86 O=C(O)CC1=CC=CC=C1I SC-02003 [0,0,1,0,1,0|1,0,1]=4 599 B11R1.86 O=C(O)CC1=CC=CC=C1O SC-22392 [0,0,1,0,1,0|1,0,1]=4 600 B11R1.90 CN1C=CC=C1\C=C\C(=O)O SC-41353 [0,0,1,0,1,0|2,0,0]=4 601 B11R1.90 O=C(O)\C=C\C1=C(Cl)C=CS1 SC-39131 [0,0,1,0,1,0|2,0,0]=4 602 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-12427 [0,0,1,0,0,1|0,0,2]=4 603 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-46101 [0,0,1,0,0,1|0,0,2]=4 604 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SC-48872 [0,0,1,0,0,1|0,0,2]=4 605 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SC-77068 [0,0,1,0,0,1|0,0,2]=4 606 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 SC-46102 [0,0,1,0,0,1|0,0,2]=4 607 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O SC-10977 [0,0,1,0,0,1|0,0,2]=4 608 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O SC-78855 [0,0,1,0,0,1|0,0,2]=4 609 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O SC-76550 [0,0,1,0,0,1|0,0,2]=4 610 B13R1.351 O=C(O)C(=O)OCC1=CC=CC=C1 SC-32761 [0,0,1,0,0,1|1,0,1]=4 611 B13R1.351 [C@@H](N)(CCC1=CC=CC=C1)C(=O)O SC-10978 [0,0,1,0,0,1|0,0,2]=4 612 B13R2.57 C=CC1=CC2=CC=CC=C2N=C1 SC-31487 [1,0,0,0,0,1|1,0,1]=4 613 B13R2.57 C=CC1=CC=C2C=CC=CC2=C1 SC-06880 [1,0,0,0,0,1|2,0,0]=4 614 B13R2.57 N\N=C1/C=CC2=C(C=CC=C2)N1 SC-54299 [1,0,0,0,0,1|2,0,0]=4 615 B13R2.57 O=CC1=CC2=C(C=CC=C2)C=N1 SC-34075 [1,0,0,0,0,1|0,0,1]=3 616 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 SC-23120 [1,0,0,0,0,1|0,0,1]=3 617 B13R2.57 O=CC1=CC2=CC=CN=C2C=C1 SC-49421 [1,0,0,0,0,1|2,0,0]=4 618 B13R2.57 O=CC1=CC=C2C=CC=NC2=C1 SC-45762 [1,0,0,0,0,1|2,0,0]=4 619 B13R2.57 O=CC1=NC2=C(C=CC=C2)C=C1 SC-05256 [1,0,0,0,0,1|0,0,1]=3 620 B13R2.57 OCC1=CC2=C(C=CC=C2)C=N1 SC-33868 [1,0,0,0,0,1|0,0,2]=4 621 B13R2.57 OCC1=NC2=CC=CC=C2C=C1 SC-42508 [1,0,0,0,0,1|0,0,2]=4 622 B13R2.57 OCC1=NC2=CC=CC=C2N=C1 SC-39048 [1,0,0,0,0,1|0,0,2]=4 623 B15R2.1660 O=C(O)CCC1=CN2C=CC=CC2=N1 SC-15066 [0,0,0,0,0,2|1,0,1]=4 624 B15R2.1660 O=C(O)\C=C\C1=CC2=CC=CC=C2O1 SC-26285 [0,0,0,0,0,2|1,0,0]=3 625 B15R2.1660 O=C(O)\C=C\C1=CC2=CC=CC=C2S1 SC-38905 [0,0,0,0,0,2|1,0,0]=3 626 B15R2.1668 CC(=O)CC1=NC2=C(C=CC=C2)C=C1 SC-34924 [0,0,0,0,0,2|1,0,1]=4 627 B15R2.1668 O=C(Cl)CC1=CC2=CC=CC=C2C=C1 SC-17089 [0,0,0,0,0,2|2,0,0]=4 628 B15R2.1668 O=C(O)CC1=CC2=C(C=C1)C=NC=C2 SC-34437 [0,0,0,0,0,2|2,0,0]=4 629 B15R2.1668 O=C(O)CC1=CC=C2N=CC=CC2=C1 SC-12802 [0,0,0,0,0,2|2,0,0]=4 630 B15R2.1668 O=C(O)CC1=NC2=CC=CC=C2C=C1 SC-13188 [0,0,0,0,0,2|0,0,1]=3