0 B13R2.435 CC(=O)C1=CC2=CC=CC=C2O1 OR28532 [0,0,0,0,0,0|2,0,0]=2 1 B13R2.435 CC(=O)C1=CN2C=CC=CC2=N1 OR305147 [0,0,0,0,0,0|2,0,1]=3 2 B13R2.435 CC(C)C1=NC2=C(C=CC=C2)N1 OR3278 [0,0,0,0,0,0|3,0,1]=4 3 B13R2.435 CC(N)C1=NC2=C(C=CC=C2)N1 OR51973 [0,0,0,0,0,0|3,0,1]=4 4 B13R2.435 CC(N)C1=NC2=CC=CC=C2N1 OR200025 [0,0,0,0,0,0|3,0,1]=4 5 B13R2.435 NC(=O)C1=CC2=CC=CC=C2N1 OR110958 [0,0,0,0,0,0|1,0,0]=1 6 B13R2.435 O=C(Cl)C1=CC2=CC=CC=C2O1 OR23094 [0,0,0,0,0,0|2,0,0]=2 7 B13R2.435 O=C(Cl)C1=CC2=CC=CC=C2S1 OR23167 [0,0,0,0,0,0|2,0,0]=2 8 B13R2.435 O=C(Cl)C1=NC2=CC=CC=C2S1 OR23087 [0,0,0,0,0,0|2,0,1]=3 9 B13R2.435 O=C(Cl)C1CC2=CC=CC=C2O1 OR346204 [0,0,0,0,0,0|2,0,2]=4 10 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 OR6305 [0,0,0,0,0,0|1,0,0]=1 11 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 OR7075 [0,0,0,0,0,0|1,0,0]=1 12 B13R2.435 O=C(O)C1=CC2=C(N=CC=N2)S1 OR6789 [0,0,0,0,0,0|3,0,0]=3 13 B13R2.435 O=C(O)C1=CC2=CC=CC=C2N1 OR11262 [0,0,0,0,0,0|0,0,0]=0 14 B13R2.435 O=C(O)C1=CC2=CC=CN=C2N1 OR46104 [0,0,0,0,0,0|1,0,0]=1 15 B13R2.435 O=C(O)C1=CC2=CC=CN=C2S1 OR15126 [0,0,0,0,0,0|2,0,0]=2 16 B13R2.435 O=C(O)C1=CC2=CC=NC=C2N1 OR46105 [0,0,0,0,0,0|1,0,0]=1 17 B13R2.435 O=C(O)C1=CC2=CC=NC=C2O1 OR302052 [0,0,0,0,0,0|2,0,0]=2 18 B13R2.435 O=C(O)C1=CC2=CN=CC=C2N1 OR302114 [0,0,0,0,0,0|1,0,0]=1 19 B13R2.435 O=C(O)C1=CC2=NC=CC=C2N1 OR41130 [0,0,0,0,0,0|1,0,0]=1 20 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 OR9880 [0,0,0,0,0,0|1,0,1]=2 21 B13R2.435 O=C(O)C1=CN2C=CC=NC2=N1 OR6351 [0,0,0,0,0,0|2,0,1]=3 22 B13R2.435 O=C(O)C1=CN2C=NC=CC2=N1 OR6360 [0,0,0,0,0,0|2,0,1]=3 23 B13R2.435 O=C(O)C1=CN2N=CC=CC2=N1 OR6356 [0,0,0,0,0,0|2,0,1]=3 24 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)N1 OR23116 [0,0,0,0,0,0|1,0,0]=1 25 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)S1 OR23086 [0,0,0,0,0,0|1,0,1]=2 26 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 OR7662 [0,0,0,0,0,0|1,0,0]=1 27 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 OR1408 [0,0,0,0,0,0|1,0,1]=2 28 B13R2.435 O=C(O)C1=NN2C=CC=NC2=N1 OR13444 [0,0,0,0,0,0|3,0,1]=4 29 B13R2.435 O=C(O)C1CC2=CC=CC=C2C1 OR10885 [0,0,0,0,0,0|1,0,2]=3 30 B13R2.435 O=C(O)C1CC2=CC=CC=C2N1 OR59374 [0,0,0,0,0,0|0,0,2]=2 31 B13R2.435 O=C(O)C1CC2=CC=CC=C2O1 OR23376 [0,0,0,0,0,0|1,0,2]=3 32 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)N1 OR0737 [0,0,0,0,0,0|0,0,2]=2 33 B13R2.435 OB(O)C1=CC2=C(C=CC=C2)S1 OR0093 [0,0,0,0,0,0|2,0,1]=3 34 B13R2.435 OB(O)C1=CC2=CC=CC=C2O1 OR23097 [0,0,0,0,0,0|2,0,1]=3 35 B13R2.435 OB(O)C1=NC2=C(C=CC=C2)S1 OR360586 [0,0,0,0,0,0|2,0,2]=4 36 B12R2.32 ClCC1=NC2=C(C=CC=C2)N1 OR9012 [1,0,0,0,0,0|2,0,1]=4 37 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 OR5660 [1,0,0,0,0,0|1,0,1]=3 38 B12R2.32 NCC1=CC2=C(C=CC=C2)S1 OR23170 [1,0,0,0,0,0|2,0,1]=4 39 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 OR17701 [1,0,0,0,0,0|2,0,1]=4 40 B12R2.32 NNC1=NC2=CC=CC=C2N1 OR14212 [1,0,0,0,0,0|3,0,0]=4 41 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 OR5662 [1,0,0,0,0,0|0,0,0]=1 42 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 OR101115 [1,0,0,0,0,0|1,0,0]=2 43 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 OR8022 [1,0,0,0,0,0|1,0,0]=2 44 B12R2.32 O=CC1=CC2=C(N=CC=C2)S1 OR6738 [1,0,0,0,0,0|2,0,0]=3 45 B12R2.32 O=CC1=NC2=C(C=CC=C2)O1 OR315301 [1,0,0,0,0,0|1,0,1]=3 46 B12R2.32 O=CC1=NC2=CC=CC=C2N1 OR1856 [1,0,0,0,0,0|1,0,0]=2 47 B12R2.32 O=CC1=NC2=CC=CC=C2S1 OR23088 [1,0,0,0,0,0|1,0,1]=3 48 B12R2.32 OCC1=CC2=C(C=CC=C2)N1 OR20024 [1,0,0,0,0,0|0,0,1]=2 49 B12R2.32 OCC1=CC2=C(C=CC=C2)S1 OR23169 [1,0,0,0,0,0|1,0,1]=3 50 B12R2.32 OCC1=CC2=C(C=CC=N2)N1 OR43672 [1,0,0,0,0,0|1,0,1]=3 51 B12R2.32 OCC1=CC2=CC=CC=C2O1 OR23095 [1,0,0,0,0,0|1,0,1]=3 52 B12R2.32 OCC1=CC2=CC=NC=C2N1 OR43671 [1,0,0,0,0,0|1,0,1]=3 53 B12R2.32 OCC1=CN2C=CC=CC2=N1 OR1430 [1,0,0,0,0,0|1,0,2]=4 54 B12R2.32 OCC1=NC2=C(C=CC=C2)N1 OR6550 [1,0,0,0,0,0|1,0,1]=3 55 B12R2.32 OCC1=NC2=CC=CC=C2S1 OR23091 [1,0,0,0,0,0|1,0,2]=4 56 B12R2.32 OCC1CC2=CC=CC=C2N1 OR14016 [1,0,0,0,0,0|0,0,3]=4 57 B14R2.450 CC(=O)C1=C(C)C2=C(C=CC=C2)S1 OR26002 [0,1,0,0,0,0|2,0,0]=3 58 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 OR17626 [0,1,0,0,0,0|1,0,0]=2 59 B14R2.450 CN1C(B(O)O)=CC2=CC=CC=C21 OR1923 [0,1,0,0,0,0|1,0,1]=3 60 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 OR5666 [0,1,0,0,0,0|0,0,0]=1 61 B14R2.450 CN1C2=CC=CC=C2N=C1C(=O)O OR1861 [0,1,0,0,0,0|1,0,0]=2 62 B14R2.450 NC1=C(C(=O)O)SC2=C1C=CC=C2 OR4781 [0,1,0,0,0,0|1,0,0]=2 63 B14R2.450 N[C@H]1C2=C(C=CC=C2)C[C@H]1C(=O)O OR307532 [0,1,0,0,0,0|1,0,2]=4 64 B14R2.450 O=C(Cl)C1=C(Cl)C2=C(C=CC=C2)S1 OR1275 [0,1,0,0,0,0|2,0,0]=3 65 B14R2.450 O=C(O)C1=C(Br)N2C=CC=CC2=N1 OR110747 [0,1,0,0,0,0|1,0,1]=3 66 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=CC=C2)S1 OR1273 [0,1,0,0,0,0|1,0,0]=2 67 B14R2.450 O=C(O)C1=C(Cl)N2C=CC=CC2=N1 OR01957 [0,1,0,0,0,0|1,0,1]=3 68 B14R2.450 O=C(O)C1=C(Cl)N2C=CC=CC2=N1 OR40684 [0,1,0,0,0,0|1,0,1]=3 69 B14R2.789 NC1(C(=O)O)CC2=CC=CC=C2C1 OR10822 [0,1,0,0,0,0|1,0,2]=4 70 B14R2.972 CNC(=O)C1=CC2=CC=CC=C2N1 OR110959 [0,1,0,0,0,0|1,0,0]=2 71 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)N1 OR10191 [0,1,0,0,0,0|0,0,0]=1 72 B14R2.972 COC(=O)C1=CC2=CC=CC=C2O1 OR303096 [0,1,0,0,0,0|1,0,0]=2 73 B14R2.972 COC(=O)C1=CC2=CC=CN=C2O1 OR41135 [0,1,0,0,0,0|2,0,0]=3 74 B14R2.972 COC(=O)C1=CC2=NC=CC=C2N1 OR41118 [0,1,0,0,0,0|1,0,0]=2 75 B14R2.972 NNC(=O)C1=CC2=C(C=CC=C2)N1 OR7963 [0,1,0,0,0,0|1,0,0]=2 76 B14R2.972 NNC(=O)C1=CC2=CC=CC=C2O1 OR0275 [0,1,0,0,0,0|2,0,0]=3 77 B14R2.972 NNC(=O)C1=CN2C=CC=CC2=N1 OR110423 [0,1,0,0,0,0|2,0,1]=4 78 B14R2.972 NNC(=O)C1=NC2=CC=CC=C2S1 OR110285 [0,1,0,0,0,0|2,0,1]=4 79 B14R2.972 O=C(CBr)C1=CC2=C(C=CC=C2)O1 OR8021 [0,1,0,0,0,0|2,0,0]=3 80 B14R2.972 O=C(CBr)C1=CC2=CC=CC=C2S1 OR0466 [0,1,0,0,0,0|2,0,0]=3 81 B14R2.972 O=C(CBr)C1=NC2=C(C=CC=C2)S1 OR23089 [0,1,0,0,0,0|2,0,1]=4 82 B14R2.3129 CC(C)(C)C1=CC2=C(C=CC=C2)N1 OR15275 [0,1,0,0,0,0|2,0,1]=4 83 B14R2.3129 O=S(=O)(Cl)C1=CC2=C(C=CC=C2)O1 OR346249 [0,1,0,0,0,0|2,0,1]=4 84 B14R2.3129 O=S(=O)(Cl)C1=CC2=C(C=CC=C2)S1 OR23168 [0,1,0,0,0,0|2,0,1]=4 85 B14R2.4529 CC(=O)N1C=C2C=C(Br)C=CC2=N1 OR61229 [0,1,0,0,0,0|2,0,1]=4 86 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)S2 OR3103 [0,1,0,0,0,0|1,0,0]=2 87 B14R2.4529 CC1=CC=C2SC(B(O)O)=CC2=C1 OR14304 [0,1,0,0,0,0|2,0,1]=4 88 B14R2.4529 NC1=CC2=C(C=C1)SC(C(=O)O)=C2 OR103017 [0,1,0,0,0,0|1,0,0]=2 89 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)N1 OR15252 [0,1,0,0,0,0|0,0,0]=1 90 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)S1 OR14032 [0,1,0,0,0,0|1,0,0]=2 91 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)C=C2)S1 OR14043 [0,1,0,0,0,0|1,0,0]=2 92 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 OR12042 [0,1,0,0,0,0|0,0,0]=1 93 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)N1 OR10933 [0,1,0,0,0,0|0,0,0]=1 94 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)O1 OR102841 [0,1,0,0,0,0|1,0,0]=2 95 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2O1 OR9879 [0,1,0,0,0,0|1,0,0]=2 96 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2S1 OR2826 [0,1,0,0,0,0|1,0,0]=2 97 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CC=C2S1 OR16860 [0,1,0,0,0,0|1,0,0]=2 98 B14R2.4529 O=C(O)C1=CC2=CC(I)=CC=C2S1 OR52089 [0,1,0,0,0,0|1,0,0]=2 99 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)N=C2N1 OR18603 [0,1,0,0,0,0|1,0,0]=2 100 B14R2.4529 O=C(O)C1=CN2C=C(Br)N=CC2=N1 OR2598 [0,1,0,0,0,0|2,0,1]=4 101 B14R2.4529 O=C(O)C1=CN2C=C(Cl)C=CC2=N1 OR41051 [0,1,0,0,0,0|1,0,1]=3 102 B14R2.4529 O=C(O)C1=CN2C=CC(Br)=CC2=N1 OR110102 [0,1,0,0,0,0|1,0,1]=3 103 B14R2.4529 O=C(O)C1=CN2C=CC(Cl)=CC2=N1 OR110231 [0,1,0,0,0,0|1,0,1]=3 104 B14R2.4529 O=C(O)C1=CN2N=C(Cl)C=CC2=N1 OR7936 [0,1,0,0,0,0|2,0,1]=4 105 B14R2.4529 O=C(O)C1=NC2=C(C=CC(Br)=C2)N1 OR40115 [0,1,0,0,0,0|1,0,0]=2 106 B14R2.4529 OB(O)C1=CC2=CC(Br)=CC=C2S1 OR7702 [0,1,0,0,0,0|2,0,1]=4 107 B14R2.7969 CC(=O)N1C=C2C(Cl)=CC=CC2=N1 OR61230 [0,1,0,0,0,0|2,0,1]=4 108 B14R2.7969 CC1=CC=CC2=C1NC(C(=O)O)=C2 OR5661 [0,1,0,0,0,0|0,0,0]=1 109 B14R2.7969 O=C(Cl)C1=CC2=C(C=CC=C2Br)S1 OR54345 [0,1,0,0,0,0|2,0,0]=3 110 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Br)S1 OR14031 [0,1,0,0,0,0|1,0,0]=2 111 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Cl)S1 OR14042 [0,1,0,0,0,0|1,0,0]=2 112 B14R2.7969 O=C(O)C1=CC2=C(S1)C(Cl)=NC=N2 OR53050 [0,1,0,0,0,0|3,0,0]=4 113 B14R2.7969 O=C(O)C1=CC2=CC=CC(Br)=C2S1 OR40543 [0,1,0,0,0,0|1,0,0]=2 114 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2S1 OR2843 [0,1,0,0,0,0|1,0,0]=2 115 B14R2.7969 O=C(O)C1=CN2C(Cl)=CC=CC2=N1 OR01956 [0,1,0,0,0,0|1,0,1]=3 116 B14R2.7969 OB(O)C1=CC2=CC=CC(Br)=C2N1 OR11948 [0,1,0,0,0,0|1,0,1]=3 117 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O OR18022 [0,0,1,0,0,0|1,0,0]=2 118 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O OR12736 [0,0,1,0,0,0|1,0,2]=4 119 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 OR964553 [0,0,1,0,0,0|1,0,2]=4 120 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O OR14725 [0,0,1,0,0,0|1,0,2]=4 121 B12R1.43 N[C@@H](CC1=CN=CC=C1)C(=O)O OR14723 [0,0,1,0,0,0|1,0,2]=4 122 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O OR14721 [0,0,1,0,0,0|1,0,2]=4 123 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O OR70012 [0,0,1,0,0,0|1,0,2]=4 124 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O OR0702 [0,0,1,0,0,0|0,0,2]=3 125 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O OR14726 [0,0,1,0,0,0|1,0,2]=4 126 B12R1.43 N[C@H](CC1=CN=CC=C1)C(=O)O OR14724 [0,0,1,0,0,0|1,0,2]=4 127 B12R1.43 N[C@H](CC1=CN=CC=C1)C(=O)O OR55414 [0,0,1,0,0,0|1,0,2]=4 128 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O OR14722 [0,0,1,0,0,0|1,0,2]=4 129 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 OR14807 [0,0,1,0,0,0|1,0,0]=2 130 B12R1.125 CC(=O)\C=C\C1=CC=CC=C1Cl OR25346 [0,0,1,0,0,0|2,0,0]=3 131 B12R1.125 O=C(Cl)C=CC1=C(Cl)C=CC=C1 OR0067 [0,0,1,0,0,0|2,0,0]=3 132 B12R1.125 O=C(O)C=CC1=C(Cl)C=CC=C1 OR0066 [0,0,1,0,0,0|1,0,0]=2 133 B12R1.125 O=C(O)C=CC1=C(O)C=CC=C1 OR40640 [0,0,1,0,0,0|1,0,0]=2 134 B12R1.125 O=C(O)CCC1=C(Br)C=CC=C1 OR3083 [0,0,1,0,0,0|1,0,2]=4 135 B12R1.125 O=C(O)CCC1=CC=CC=C1I OR6479 [0,0,1,0,0,0|1,0,2]=4 136 B12R2.252 O=C(O)C1=CC2=C(C=CO2)N1 OR346111 [0,0,0,0,1,0|1,0,0]=2 137 B12R2.252 O=C(O)C1=CC2=C(C=CS2)S1 OR0190 [0,0,0,0,1,0|2,0,0]=3 138 B12R2.252 O=C(O)C1=CN2C=CSC2=N1 OR0694 [0,0,0,0,1,0|2,0,1]=4 139 B12R2.252 O=C(O)C1=CN2NC=CC2=N1 OR6352 [0,0,0,0,1,0|2,0,1]=4 140 B14R2.768 N=C(N)NC1=NC2=C(C=CC=C2)N1 OR54411 [0,0,0,0,0,1|3,0,0]=4 141 B14R2.768 NC(=O)CC1=NC2=C(C=CC=C2)N1 OR13274 [0,0,0,0,0,1|2,0,0]=3 142 B14R2.768 O=C(O)CC1=CC2=C(C=CC=C2)N1 OR6306 [0,0,0,0,0,1|0,0,0]=1 143 B14R2.768 O=C(O)CC1=NC2=C(C=CC=C2)O1 OR103651 [0,0,0,0,0,1|1,0,1]=3 144 B14R2.768 O=C(O)CC1=NC2=C(C=CC=C2)S1 OR103650 [0,0,0,0,0,1|1,0,1]=3 145 B14R2.768 O=C(O)CC1CC2=CC=CC=C2C1 OR42111 [0,0,0,0,0,1|1,0,2]=4 146 B14R2.768 O=C([O-])CC1=CC2=C(C=CC=C2)N1 OR6306A [0,0,0,0,0,1|0,0,1]=2 147 B14R2.781 CC(=O)C1=CC2=C(C=CC=C2)C=C1 OR9969 [0,0,0,0,0,1|2,0,0]=3 148 B14R2.781 CC(=O)C1=CC2=NC=CC=C2C=C1 OR51814 [0,0,0,0,0,1|3,0,0]=4 149 B14R2.781 NC(=S)C1=CC2=CC=CC=C2OC1 OR23381 [0,0,0,0,0,1|2,1,0]=4 150 B14R2.781 O=C(Cl)C1=CC=C2C=CC=CC2=C1 OR16941 [0,0,0,0,0,1|2,0,0]=3 151 B14R2.781 O=C(Cl)C1=CN=C2C=CC=CC2=N1 OR59969 [0,0,0,0,0,1|1,0,1]=3 152 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=C1 OR52474 [0,0,0,0,0,1|1,0,0]=2 153 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 OR0571 [0,0,0,0,0,1|0,0,1]=2 154 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 OR16580 [0,0,0,0,0,1|0,0,1]=2 155 B14R2.781 O=C(O)C1=CC2=CC=CC=C2N=C1 OR6309 [0,0,0,0,0,1|0,0,1]=2 156 B14R2.781 O=C(O)C1=CC2=CC=CC=C2OC1 OR23377 [0,0,0,0,0,1|1,0,0]=2 157 B14R2.781 O=C(O)C1=CC2=NC=CC=C2C=C1 OR17564 [0,0,0,0,0,1|2,0,0]=3 158 B14R2.781 O=C(O)C1=CC2=NC=CN=C2C=C1 OR23160 [0,0,0,0,0,1|3,0,0]=4 159 B14R2.781 O=C(O)C1=CC=C2C=CN=CC2=C1 OR48110 [0,0,0,0,0,1|2,0,0]=3 160 B14R2.781 O=C(O)C1=CC=C2C=NC=CC2=C1 OR48100 [0,0,0,0,0,1|2,0,0]=3 161 B14R2.781 O=C(O)C1=CC=C2N=CC=CC2=C1 OR23075 [0,0,0,0,0,1|2,0,0]=3 162 B14R2.781 O=C(O)C1=CN=C2C=CN=CC2=C1 OR01633 [0,0,0,0,0,1|1,0,1]=3 163 B14R2.781 O=C(O)C1=NC2=C(C=C1)C=NC=C2 OR5998 [0,0,0,0,0,1|1,0,1]=3 164 B14R2.781 O=C(O)C1=NC2=C(C=CC=C2)C=C1 OR23072 [0,0,0,0,0,1|0,0,1]=2 165 B14R2.781 O=C(O)C1=NC2=C(C=CC=N2)C=C1 OR1008 [0,0,0,0,0,1|1,0,1]=3 166 B14R2.781 O=C(O)C1=NC2=CC=CC=C2C=N1 OR309393 [0,0,0,0,0,1|0,0,1]=2 167 B14R2.781 O=C(O)C1=NC2=CC=CC=C2N=C1 OR3738 [0,0,0,0,0,1|0,0,1]=2 168 B14R2.781 O=C(O)C1=NC2=CC=CN=C2C=C1 OR1027 [0,0,0,0,0,1|1,0,1]=3 169 B14R2.781 O=C(O)C1=NC2=CC=CN=C2N=C1 OR6353 [0,0,0,0,0,1|1,0,1]=3 170 B14R2.781 O=C(O)C1CC2=CC=CC=C2CN1 OR28891 [0,0,0,0,0,1|0,0,2]=3 171 B14R2.781 O=C(O)C1COC2=C(C=CC=C2)O1 OR3409 [0,0,0,0,0,1|1,0,2]=4 172 B14R2.781 O=C(O)[C@H]1CC2=C(C=CC=C2)CN1 OR14710 [0,0,0,0,0,1|0,0,2]=3 173 B14R2.781 OB(O)C1=CC2=C(C=CC=C2)C=C1 OR1779 [0,0,0,0,0,1|2,0,1]=4 174 B14R2.781 OB(O)C1=CC2=C(C=CC=C2)N=C1 OR1932 [0,0,0,0,0,1|1,0,2]=4 175 B14R2.781 OB(O)C1=CN=C2C=CC=CC2=C1 OR7263 [0,0,0,0,0,1|1,0,2]=4 176 B14R2.781 OB(O)C1=NC2=CC=CC=C2C=C1 OR8861 [0,0,0,0,0,1|1,0,2]=4 177 B11R1.40 CC(=CC1=CC=CC=C1)CO OR60256 [1,0,1,0,0,0|1,0,1]=4 178 B11R1.91 O=C(O)C=CC1=CC=CC=N1 OR6591 [1,0,1,0,0,0|1,0,0]=3 179 B11R1.91 O=C(O)CCC1=CC=CC=C1 OR10046 [1,0,1,0,0,0|0,0,2]=4 180 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 OR2364 [1,0,1,0,0,0|0,0,0]=2 181 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 OR30410 [1,0,1,0,0,0|1,0,0]=3 182 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 OR6984 [1,0,1,0,0,0|1,0,0]=3 183 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 OR51907 [1,0,1,0,0,0|1,0,1]=4 184 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 OR10578 [1,0,1,0,0,0|1,0,1]=4 185 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 OR23096 [2,0,0,0,0,0|2,0,0]=4 186 B11R2.10 BrC1=CC2=CC=CC=C2C1 OR1077 [2,0,0,0,0,0|2,0,0]=4 187 B11R2.10 BrC1=CC2=CC=CC=C2S1 OR9631 [2,0,0,0,0,0|2,0,0]=4 188 B11R2.10 BrC1=NC2=CC=CC=C2N1 OR23118 [2,0,0,0,0,0|2,0,0]=4 189 B11R2.10 CC1=CC2=C(C=CC=C2)N1 OR10174 [2,0,0,0,0,0|0,0,1]=3 190 B11R2.10 CC1=CC2=C(C=NC=C2)N1 OR313057 [2,0,0,0,0,0|1,0,1]=4 191 B11R2.10 CC1=CC2=C(N=CC=C2)N1 OR301214 [2,0,0,0,0,0|1,0,1]=4 192 B11R2.10 ClC1=NC2=CC=CC=C2N1 OR18361 [2,0,0,0,0,0|2,0,0]=4 193 B11R2.10 IC1=CC2=C(C=CC=C2)N1 OR305199 [2,0,0,0,0,0|1,0,0]=3 194 B11R2.10 NC1=NC2=C(C=CC=C2)N1 OR22305 [2,0,0,0,0,0|2,0,0]=4 195 B11R2.10 O=C1CC2=C(C=CC=C2)N1 OR30278 [2,0,0,0,0,0|0,0,1]=3 196 B11R2.10 O=C1CC2=CC=CC=C2C1 OR30508 [2,0,0,0,0,0|1,0,1]=4 197 B11R2.10 O=C1NC2=C(C=CC=C2)O1 OR22178 [2,0,0,0,0,0|1,0,0]=3 198 B11R2.10 O=C1NC2=C(C=CC=N2)O1 OR29854 [2,0,0,0,0,0|2,0,0]=4 199 B11R2.10 OC1=CC2=CC=CN=C2N1 OR305354 [2,0,0,0,0,0|1,0,0]=3 200 B11R2.10 OC1=NC2=C(C=CC=C2)N1 OR6552 [2,0,0,0,0,0|1,0,0]=3 201 B11R2.10 OC1=NC2=C(C=CC=C2)S1 OR16606 [2,0,0,0,0,0|1,0,1]=4 202 B11R2.10 S=C1CC2=C(C=CC=C2)N1 OR300726 [2,0,0,0,0,0|0,1,1]=4 203 B11R2.10 SC1=NC2=C(C=CC=C2)N1 OR9047 [2,0,0,0,0,0|1,1,0]=4 204 B13R1.133 CC1=CC=C(C[C@@H](N)C(=O)O)C=C1 OR14704 [0,1,1,0,0,0|0,0,2]=4 205 B13R1.133 CC1=CC=C(C[C@H](N)C(=O)O)C=C1 OR14703 [0,1,1,0,0,0|0,0,2]=4 206 B13R1.133 NC1=CC=C(C[C@H](N)C(=O)O)C=C1 OR14730 [0,1,1,0,0,0|0,0,2]=4 207 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O OR14695 [0,1,1,0,0,0|0,0,2]=4 208 B13R1.133 N[C@@H](CC1=CC=C(Cl)C=C1)C(=O)O OR14691 [0,1,1,0,0,0|0,0,2]=4 209 B13R1.133 N[C@@H](CC1=CC=C(I)C=C1)C(=O)O OR9515 [0,1,1,0,0,0|0,0,2]=4 210 B13R1.133 N[C@H](CC1=CC=C(Br)C=C1)C(=O)O OR14696 [0,1,1,0,0,0|0,0,2]=4 211 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O OR14692 [0,1,1,0,0,0|0,0,2]=4 212 B13R1.133 N[C@H](CC1=CC=C(I)C=C1)C(=O)O OR14729 [0,1,1,0,0,0|0,0,2]=4 213 B13R1.148 CC1=CC=CC(C[C@@H](N)C(=O)O)=C1 OR14702 [0,1,1,0,0,0|0,0,2]=4 214 B13R1.148 CC1=CC=CC(C[C@H](N)C(=O)O)=C1 OR14701 [0,1,1,0,0,0|0,0,2]=4 215 B13R1.148 NC(CC1=CC(O)=CC=C1)C(=O)O OR8975 [0,1,1,0,0,0|0,0,2]=4 216 B13R1.148 N[C@@H](CC1=CC(Cl)=CC=C1)C(=O)O OR14689 [0,1,1,0,0,0|0,0,2]=4 217 B13R1.148 N[C@H](CC1=CC(Cl)=CC=C1)C(=O)O OR14690 [0,1,1,0,0,0|0,0,2]=4 218 B13R1.152 N[C@@H](C(=O)O)[C@@H](O)C1=CC=CC=C1 OR52324 [0,1,1,0,0,0|0,0,2]=4 219 B13R1.202 CC1=C(C[C@@H](N)C(=O)O)C=CC=C1 OR14700 [0,1,1,0,0,0|0,0,2]=4 220 B13R1.202 CC1=C(C[C@H](N)C(=O)O)C=CC=C1 OR14699 [0,1,1,0,0,0|0,0,2]=4 221 B13R1.202 N[C@@H](CC1=C(Br)C=CC=C1)C(=O)O OR14693 [0,1,1,0,0,0|0,0,2]=4 222 B13R1.202 N[C@@H](CC1=C(Cl)C=CC=C1)C(=O)O OR14687 [0,1,1,0,0,0|0,0,2]=4 223 B13R1.202 N[C@H](CC1=C(Br)C=CC=C1)C(=O)O OR14694 [0,1,1,0,0,0|0,0,2]=4 224 B13R1.202 N[C@H](CC1=C(Cl)C=CC=C1)C(=O)O OR14688 [0,1,1,0,0,0|0,0,2]=4 225 B13R1.418 N#C\C(=C/C1=CN=CC=C1)C(=O)O OR14205 [0,1,1,0,0,0|1,0,1]=4 226 B13R1.90 COC1=C(C=CC(=O)O)C=CC=C1 OR21169 [0,1,1,0,0,0|1,0,0]=3 227 B13R1.90 O=CC1=C(\C=C\C(=O)O)C=CC=C1 OR4818 [0,1,1,0,0,0|1,0,0]=3 228 B13R1.150 O=C(O)\C=C\C1=CC=CC(Cl)=C1Cl OR14432 [0,1,1,0,0,0|1,0,0]=3 229 B13R1.164 CC1=CC(C)=C(C=CC(=O)O)C=C1 OR14481 [0,1,1,0,0,0|1,0,0]=3 230 B13R1.164 O=C(O)\C=C\C1=C(Cl)C=C(Cl)C=C1 OR8283 [0,1,1,0,0,0|1,0,0]=3 231 B13R1.893 O=C(O)\C=C\C1=C(Cl)C=CC(Cl)=C1 OR12077 [0,1,1,0,0,0|1,0,0]=3 232 B13R2.43 CC1=CC2=C(C=C1)SC(C=O)=C2 OR101620 [1,1,0,0,0,0|1,0,0]=3 233 B13R2.43 N#CC1=CC2=CC=C(Br)C=C2N1 OR303143 [1,1,0,0,0,0|1,0,1]=4 234 B13R2.43 O=CC1=CC2=CC(Br)=CC=C2O1 OR0646 [1,1,0,0,0,0|1,0,0]=3 235 B13R2.43 O=CC1=CC2=CC=C(Br)C=C2N1 OR16855 [1,1,0,0,0,0|0,0,0]=2 236 B13R2.43 OCC1=CC2=C(C=CC(Br)=C2)N1 OR12043 [1,1,0,0,0,0|0,0,1]=3 237 B13R2.43 OCC1=CC2=CC=C(Br)C=C2N1 OR16856 [1,1,0,0,0,0|0,0,1]=3 238 B13R2.45 CC1=C(C=O)OC2=C1C=CC=C2 OR55307 [1,1,0,0,0,0|1,0,0]=3 239 B13R2.45 CC1=C(C=O)SC2=C1C=CC=C2 OR7692 [1,1,0,0,0,0|1,0,0]=3 240 B13R2.45 CN1C(C#N)=CC2=CC=CC=C21 OR111023 [1,1,0,0,0,0|1,0,1]=4 241 B13R2.45 CN1C(C=O)=NC2=C1C=CC=C2 OR6737 [1,1,0,0,0,0|1,0,0]=3 242 B13R2.45 CN1C(CN)=CC2=C1C=CC=C2 OR5663 [1,1,0,0,0,0|1,0,1]=4 243 B13R2.45 O=CC1=C(I)C2=CC=CC=C2N1 OR61363 [1,1,0,0,0,0|0,0,0]=2 244 B13R2.54 O=CC1=CC2=C(C=CC=C2Br)S1 OR54346 [1,1,0,0,0,0|1,0,0]=3 245 B13R2.54 OCC1=CC2=C(Br)C=CC=C2S1 OR54348 [1,1,0,0,0,0|1,0,1]=4 246 B13R2.54 OCC1=CC2=CC=CC(Br)=C2S1 OR43532 [1,1,0,0,0,0|1,0,1]=4 247 B13R2.531 COC(=O)C1=CC2=C(C=CO2)N1 OR1443 [0,1,0,0,1,0|1,0,0]=3 248 B13R2.531 COC(=O)C1=CC2=C(C=CS2)N1 OR1442 [0,1,0,0,1,0|1,0,0]=3 249 B13R2.531 COC(=O)C1=CC2=C(C=CS2)S1 OR8520 [0,1,0,0,1,0|2,0,0]=4 250 B13R2.531 COC(=O)C1=CC2=C(N1)OC=C2 OR346110 [0,1,0,0,1,0|1,0,0]=3 251 B13R2.531 COC(=O)C1=CC2=C(N1)SC=C2 OR42104 [0,1,0,0,1,0|1,0,0]=3 252 B13R2.2334 CN1C(C(=O)O)=CC2=C1C=CO2 OR3798 [0,1,0,0,1,0|1,0,0]=3 253 B13R2.2334 CN1C(C(=O)O)=CC2=C1C=CS2 OR6747 [0,1,0,0,1,0|1,0,0]=3 254 B13R2.2334 O=C(O)C1=C(Cl)C2=C(SC=C2)S1 OR12265 [0,1,0,0,1,0|2,0,0]=4 255 B15R2.629 O=C(O)CN1CC2=CC=CC=C2C1=O OR110884 [0,1,0,0,0,1|2,0,0]=4 256 B15R2.7252 O=C(O)CC1=NC2=CC(Br)=CC=C2N1 OR43531 [0,1,0,0,0,1|1,0,0]=3 257 B15R2.627 O=C(O)C1=C(O)C2=NC=CC=C2C=C1 OR51895 [0,1,0,0,0,1|2,0,0]=4 258 B15R2.627 O=C(O)C1=CC=C2C=CC=CC2=C1O OR60129 [0,1,0,0,0,1|1,0,0]=3 259 B15R2.627 O=C(O)C1=COC2=C(C=CC=C2)C1=O OR1307 [0,1,0,0,0,1|1,0,0]=3 260 B15R2.984 CC(=O)C1=CC2=C(C=CC=C2)OC1=O OR0090 [0,1,0,0,0,1|2,0,0]=4 261 B15R2.984 CC1=NC2=C(C=CC=C2)N=C1C(=O)O OR310133 [0,1,0,0,0,1|0,0,1]=3 262 B15R2.984 CC1=NC2=C(C=CC=N2)C=C1C(=O)O OR5003 [0,1,0,0,0,1|1,0,1]=4 263 B15R2.984 CC1=NC2=C(C=NC=C2)C=C1C(=O)O OR5224 [0,1,0,0,0,1|1,0,1]=4 264 B15R2.984 CC1=NC2=CC=CC=C2C=C1C(=O)O OR301188 [0,1,0,0,0,1|0,0,1]=3 265 B15R2.984 NC(=O)C1=C(N)N=C2C=CC=CC2=C1 OR346178 [0,1,0,0,0,1|1,0,1]=4 266 B15R2.984 O=C(O)C1=C(O)N=C2C=CC=CC2=N1 OR322298 [0,1,0,0,0,1|0,0,1]=3 267 B15R2.984 O=C(O)C1=CC2=CC=CC=C2C=C1O OR51927 [0,1,0,0,0,1|1,0,0]=3 268 B15R2.984 O=C(O)C1=CC2=CC=CC=C2N=C1Cl OR5757 [0,1,0,0,0,1|0,0,1]=3 269 B15R2.984 O=C(O)C1=CC2=CC=CC=C2N=C1O OR14004 [0,1,0,0,0,1|0,0,1]=3 270 B15R2.984 O=C(O)C1=CC2=CC=CC=C2OC1=O OR9923 [0,1,0,0,0,1|1,0,0]=3 271 B15R2.1601 COC(=O)C1=CC2=C(C=C1)N=CC=C2 OR3849 [0,1,0,0,0,1|2,0,0]=4 272 B15R2.1601 COC(=O)C1=CC2=C(C=CC=C2)C=C1 OR6584 [0,1,0,0,0,1|1,0,0]=3 273 B15R2.1601 COC(=O)C1=NC2=CC=NC=C2C=C1 OR7910 [0,1,0,0,0,1|1,0,1]=4 274 B15R2.1601 COC(=O)C1=NC=C2C=CC=CC2=C1 OR21830 [0,1,0,0,0,1|0,0,1]=3 275 B15R2.1601 COC(=O)C1CCC2=C(C=CC=C2)N1 OR8135 [0,1,0,0,0,1|0,0,2]=4 276 B15R2.1601 N\C(=N/O)C1=CC2=CC=CC=C2C=C1 OR14019 [0,1,0,0,0,1|2,0,0]=4 277 B15R2.4441 O=S(=O)(O)C1=CC2=CC=CC=C2C=C1 OR28837 [0,1,0,0,0,1|2,0,0]=4 278 B15R2.4441 O=S(=O)(O)C1=CC2=CC=CC=C2C=C1 OR30529 [0,1,0,0,0,1|2,0,0]=4 279 B15R2.7174 O=C(Cl)C1=CC2=C(C=CC(Cl)=C2)OC1 OR8052 [0,1,0,0,0,1|2,0,0]=4 280 B15R2.7174 O=C(O)C1=CC2=C(C=CC(Cl)=C2)OC1 OR1260 [0,1,0,0,0,1|1,0,0]=3 281 B15R2.7174 O=C(O)C1=CC2=CC(Br)=CC=C2N=C1 OR3615 [0,1,0,0,0,1|0,0,1]=3 282 B15R2.7174 O=C(O)C1=CC2=CC(Cl)=CC=C2N=C1 OR42243 [0,1,0,0,0,1|0,0,1]=3 283 B15R2.7174 O=C(O)C1=CC=C2C=NC(Cl)=CC2=C1 OR300082 [0,1,0,0,0,1|2,0,0]=4 284 B15R2.7180 CC1=CC=C2C=C(C(=O)O)C=CC2=N1 OR14488 [0,1,0,0,0,1|2,0,0]=4 285 B15R2.7180 NC1=CC=C2C=C(C(=O)O)C=CC2=C1 OR51725 [0,1,0,0,0,1|1,0,0]=3 286 B15R2.7180 O=C(O)C1=CC2=CC=C(Br)C=C2C=C1 OR70092 [0,1,0,0,0,1|1,0,0]=3 287 B15R2.7180 O=C(O)C1=CC2=CC=C(Br)C=C2N=C1 OR3616 [0,1,0,0,0,1|0,0,1]=3 288 B15R2.7180 O=C(O)C1=CC2=CC=C(O)C=C2C=C1 OR10498 [0,1,0,0,0,1|1,0,0]=3 289 B15R2.7180 O=C(O)C1=CC=C2C=C(Cl)N=CC2=C1 OR300083 [0,1,0,0,0,1|2,0,0]=4 290 B15R2.13598 O=C(O)C1=CC2=CC=CC(Br)=C2N=C1 OR42249 [0,1,0,0,0,1|0,0,1]=3 291 B15R2.13598 O=C(O)C1=CC2=CC=CC(Cl)=C2N=C1 OR307837 [0,1,0,0,0,1|0,0,1]=3 292 B15R2.13598 O=C(O)C1=CC=C2C(=C1)C=CN=C2Cl OR300061 [0,1,0,0,0,1|2,0,0]=4 293 B15R2.13598 O=C(O)C1=CC=C2C(=C1)C=CN=C2O OR300079 [0,1,0,0,0,1|2,0,0]=4 294 B15R2.13598 O=C(O)C1=NC2=CC=CC(Br)=C2C=C1 OR52061 [0,1,0,0,0,1|0,0,1]=3 295 B15R2.14951 CN1CC(C(=O)O)OC2=CC=CC=C21 OR30809 [0,1,0,0,0,1|1,0,1]=4 296 B15R2.14951 O=C(O)C1=CC(=O)C2=CC=CC=C2O1 OR4303 [0,1,0,0,0,1|1,0,0]=3 297 B15R2.14951 O=C(O)C1=NC2=CC=CC=C2C(O)=C1 OR12784 [0,1,0,0,0,1|0,0,1]=3 298 B15R2.61353 O=C(O)C1=CC=C2C=CN=C(O)C2=C1 OR300080 [0,1,0,0,0,1|2,0,0]=4 299 B15R2.61353 O=C(O)C1=CC=C2C=NC=C(Br)C2=N1 OR7824 [0,1,0,0,0,1|1,0,1]=4 300 B15R2.61353 O=C(O)C1=CC=C2N=CC=C(O)C2=C1 OR309340 [0,1,0,0,0,1|2,0,0]=4 301 B15R2.61353 O=C(O)C1=NC2=C(O)C=CC=C2C=C1 OR40470 [0,1,0,0,0,1|0,0,1]=3 302 B15R2.1592 CC1=C(C(=O)CBr)SC2=CC=CC=C21 OR26021 [0,2,0,0,0,0|2,0,0]=4 303 B15R2.1592 COC(=O)C1=C(Br)C2=C(C=CC=C2)S1 OR70214 [0,2,0,0,0,0|1,0,0]=3 304 B15R2.1592 COC(=O)C1=C(Cl)C2=CC=CC=C2N1 OR15103 [0,2,0,0,0,0|0,0,0]=2 305 B15R2.1592 COC(=O)C1=C(I)C2=CC=CC=C2N1 OR15108 [0,2,0,0,0,0|0,0,0]=2 306 B15R2.1592 COC(=O)C1=C(N)C2=C(C=CC=C2)S1 OR4639 [0,2,0,0,0,0|1,0,0]=3 307 B15R2.1592 COC(=O)C1=C(N)C2=CC=CN=C2S1 OR17991 [0,2,0,0,0,0|2,0,0]=4 308 B15R2.1592 COC(=O)C1=C(O)C2=C(C=CC=C2)S1 OR21316 [0,2,0,0,0,0|1,0,0]=3 309 B15R2.1592 COC(=O)C1=CC2=CC=CC=C2N1C OR110042 [0,2,0,0,0,0|0,0,0]=2 310 B15R2.1592 NNC(=O)C1=C(Br)C2=CC=CC=C2N1 OR15068 [0,2,0,0,0,0|1,0,0]=3 311 B15R2.1592 NNC(=O)C1=C(Cl)C2=CC=CC=C2N1 OR15075 [0,2,0,0,0,0|1,0,0]=3 312 B15R2.7203 CN1C(B(O)O)=CC2=CC=C(Cl)C=C21 OR59404 [0,2,0,0,0,0|1,0,1]=4 313 B15R2.13629 O=C(O)C1=C(Cl)N2C(Cl)=CC=CC2=N1 OR110723 [0,2,0,0,0,0|1,0,1]=4 314 B15R2.14758 CN1C(C(=O)O)=CC2=CC(Br)=CC=C21 OR60253 [0,2,0,0,0,0|0,0,0]=2 315 B15R2.1356 CCOC(=O)C1=CC2=C(C=CC=C2)N1 OR10188 [0,2,0,0,0,0|0,0,0]=2 316 B15R2.1356 CCOC(=O)C1=CC2=C(C=CN=C2)N1 OR321375 [0,2,0,0,0,0|1,0,0]=3 317 B15R2.1356 CCOC(=O)C1=CC2=C(N=CC=C2)N1 OR2140 [0,2,0,0,0,0|1,0,0]=3 318 B15R2.1356 CCOC(=O)C1=CC2=CC=CC=C2O1 OR10935 [0,2,0,0,0,0|1,0,0]=3 319 B15R2.1356 CCOC(=O)C1=CC2=CC=CN=C2S1 OR15760 [0,2,0,0,0,0|2,0,0]=4 320 B15R2.1356 CCOC(=O)C1=CN2C=CC=CC2=N1 OR1446 [0,2,0,0,0,0|1,0,1]=4 321 B15R2.1356 CCOC(=O)C1=NC2=C(C=CC=C2)S1 OR15441 [0,2,0,0,0,0|1,0,1]=4 322 B15R2.1356 CCOC(=O)C1=NC2=CC=CC=C2N1 OR18118 [0,2,0,0,0,0|1,0,0]=3 323 B15R2.1590 COC(=O)C1=CC2=C(C=C(Br)C=C2)S1 OR12202 [0,2,0,0,0,0|1,0,0]=3 324 B15R2.1590 COC(=O)C1=CC2=C(C=C(Cl)C=C2)S1 OR14067 [0,2,0,0,0,0|1,0,0]=3 325 B15R2.1590 COC(=O)C1=CC2=C(C=CC(Cl)=C2)S1 OR14068 [0,2,0,0,0,0|1,0,0]=3 326 B15R2.1590 COC(=O)C1=CC2=C(N=CC(N)=C2)N1 OR41114 [0,2,0,0,0,0|1,0,0]=3 327 B15R2.1590 COC(=O)C1=CC2=CC(Br)=CC=C2O1 OR303334 [0,2,0,0,0,0|1,0,0]=3 328 B15R2.1590 COC(=O)C1=CC2=CC(Br)=CN=C2O1 OR41136 [0,2,0,0,0,0|2,0,0]=4 329 B15R2.1590 COC(=O)C1=CC2=CC=C(Cl)N=C2N1 OR16876 [0,2,0,0,0,0|1,0,0]=3 330 B15R2.1590 COC(=O)C1=CC2=NC=C(Cl)C=C2N1 OR41122 [0,2,0,0,0,0|1,0,0]=3 331 B15R2.1590 COC(=O)C1=CC2=NC=C(N)C=C2N1 OR41121 [0,2,0,0,0,0|1,0,0]=3 332 B15R2.1590 O=C(CBr)C1=CC2=CC(Br)=CC=C2O1 OR9719 [0,2,0,0,0,0|2,0,0]=4 333 B15R2.1598 COC(=O)C1=CC2=C(Br)C=CC=C2N1 OR954166 [0,2,0,0,0,0|0,0,0]=2 334 B15R2.1598 COC(=O)C1=CC2=C(C=CC=C2Br)S1 OR14065 [0,2,0,0,0,0|1,0,0]=3 335 B15R2.1598 COC(=O)C1=CC2=C(C=CC=C2Cl)O1 OR303102 [0,2,0,0,0,0|1,0,0]=3 336 B15R2.1598 COC(=O)C1=CC2=C(Cl)C=CC=C2S1 OR15352 [0,2,0,0,0,0|1,0,0]=3 337 B15R2.1598 COC(=O)C1=CC2=C(Cl)N=CC=C2N1 OR16875 [0,2,0,0,0,0|1,0,0]=3 338 B15R2.1598 COC(=O)C1=CC2=C(S1)C(Br)=CC=C2 OR14066 [0,2,0,0,0,0|1,0,0]=3 339 B15R2.1598 COC(=O)C1=CC2=C(S1)C(Cl)=CC=C2 OR14069 [0,2,0,0,0,0|1,0,0]=3 340 B15R2.1598 COC(=O)C1=CC2=CC=CC(Br)=C2O1 OR303097 [0,2,0,0,0,0|1,0,0]=3 341 B15R2.1598 COC(=O)C1=CC2=NC=CC(Cl)=C2N1 OR41123 [0,2,0,0,0,0|1,0,0]=3 342 B15R2.1598 NNC(=O)C1=CC2=C(C=CC=C2Cl)S1 OR12457 [0,2,0,0,0,0|2,0,0]=4 343 B15R2.15633 O=C(O)C1=CN2C=C(Cl)C=C(Br)C2=N1 OR01966 [0,2,0,0,0,0|1,0,1]=4 344 B15R2.20824 COC1=C2N=C(C(=O)O)SC2=CC=C1 OR43593 [0,2,0,0,0,0|1,0,1]=4 345 B15R2.20824 COC1=CC=CC2=C1C=C(C(=O)O)N2 OR2657 [0,2,0,0,0,0|0,0,0]=2 346 B15R2.20824 COC1=CC=CC2=C1SC(C(=O)O)=C2 OR2844 [0,2,0,0,0,0|1,0,0]=3 347 B11R0.148 C\C=C\C=C\C=C\C=C\C(=O)O OR2255T [0,0,2,0,0,0|1,0,0]=3 348 B13R2.369 NC1=C(O)C=C2C=CC=CC2=C1 OR27856 [0,0,1,1,0,0|1,0,0]=3 349 B13R2.369 O=C1CC2=CC=CC=C2OC1=O OR9103 [0,0,1,1,0,0|1,0,1]=4 350 B13R2.5179 CC1=NC2=CC=CC(N)=C2C=C1 OR8260 [0,0,1,1,0,0|2,0,0]=4 351 B13R2.5179 NC1=C2C=NC(O)=CC2=CC=C1 OR43642 [0,0,1,1,0,0|2,0,0]=4 352 B13R2.5179 OC1=NC2=CC=CC(O)=C2C=C1 OR15208 [0,0,1,1,0,0|2,0,0]=4 353 B13R2.72 CC(=O)C1=CN=C2C=CC=CN12 OR305152 [0,0,1,1,0,0|2,0,0]=4 354 B13R2.72 O=C(O)C1=C2C=CC=CC2=NO1 OR8019 [0,0,1,1,0,0|2,0,0]=4 355 B13R2.72 O=C(O)C1=CC=C2N=CC=CN21 OR41133 [0,0,1,1,0,0|1,0,0]=3 356 B13R2.72 O=C(O)C1=CCC2=C1C=CC=C2 OR7859 [0,0,1,1,0,0|1,0,1]=4 357 B13R2.72 O=C(O)C1=CN=C2C=CC=CN12 OR9691 [0,0,1,1,0,0|1,0,0]=3 358 B13R2.72 O=C(O)C1=CN=C2N=CC=CN12 OR110222 [0,0,1,1,0,0|2,0,0]=4 359 B13R2.72 O=C(O)C1=CNC2=C1C=CC=C2 OR5873 [0,0,1,1,0,0|2,0,0]=4 360 B13R2.72 O=C(O)C1=COC2=C1C=CC=C2 OR16562 [0,0,1,1,0,0|2,0,0]=4 361 B13R2.72 O=C(O)C1=CSC2=C1C=CC=C2 OR23171 [0,0,1,1,0,0|2,0,0]=4 362 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 OR5104 [0,0,1,1,0,0|1,0,1]=4 363 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=C2 OR10183 [0,0,1,1,0,0|2,0,0]=4 364 B13R2.430 O=C(O)C1=CC2=C(C=C1)OC=C2 OR23098 [0,0,1,1,0,0|2,0,0]=4 365 B13R2.430 O=C(O)C1=CC2=C(C=CN2)C=C1 OR3398 [0,0,1,1,0,0|2,0,0]=4 366 B13R2.430 O=C(O)C1=CC2=CC=CN2C=N1 OR15244 [0,0,1,1,0,0|1,0,1]=4 367 B13R2.5569 O=C(O)C1=CC=CC2=C1C=CN2 OR9584 [0,0,1,1,0,0|2,0,0]=4 368 B13R2.5569 O=C(O)C1=CC=CC2=C1NC=C2 OR2083 [0,0,1,1,0,0|2,0,0]=4 369 B13R2.5569 O=C(O)C1=CC=CC2=C1SC=C2 OR12294 [0,0,1,1,0,0|2,0,0]=4 370 B13R2.5569 O=C(O)C1=CC=CC2=NC=CN12 OR345351 [0,0,1,1,0,0|1,0,0]=3 371 B13R2.5569 O=C(O)C1=NC=CC2=C1NC=C2 OR310248 [0,0,1,1,0,0|1,0,1]=4 372 B11R1.36 C=C(B(O)O)C1=CC=CC=C1 OR4243 [0,0,1,0,1,0|1,0,1]=4 373 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 OR13658 [0,0,1,0,1,0|0,0,0]=2 374 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 OR2976 [0,0,1,0,1,0|0,0,2]=4 375 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 OR316044 [0,0,1,0,1,0|1,0,1]=4 376 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 OR316055 [0,0,1,0,1,0|1,0,1]=4 377 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 OR19581 [0,0,1,0,1,0|0,0,1]=3 378 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 OR350055 [0,0,1,0,1,0|1,0,0]=3 379 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 OR350067 [0,0,1,0,1,0|1,0,1]=4 380 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 OR5460 [0,0,1,0,1,0|1,0,1]=4 381 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 OR18332 [0,0,1,0,1,0|1,0,1]=4 382 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 OR4339 [0,0,1,0,1,0|2,0,0]=4 383 B11R1.86 CC(=O)NC1=C(C)C=CC=C1 OR4696 [0,0,1,0,1,0|1,0,1]=4 384 B11R1.86 CC(=O)NC1=C(Cl)C=CC=C1 OR7655 [0,0,1,0,1,0|2,0,0]=4 385 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 OR0008 [0,0,1,0,1,0|2,0,0]=4 386 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 OR3986 [0,0,1,0,1,0|0,0,2]=4 387 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 OR11296 [0,0,1,0,1,0|1,0,1]=4 388 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 OR3987 [0,0,1,0,1,0|1,0,1]=4 389 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 OR5987 [0,0,1,0,1,0|1,0,1]=4 390 B11R1.86 O=C(O)CC1=CC=CC=C1I OR26135 [0,0,1,0,1,0|1,0,1]=4 391 B11R2.15 O=CC1=CC2=C(C=CS2)S1 OR101767 [1,0,0,0,1,0|2,0,0]=4 392 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O OR14697 [0,0,1,0,0,1|0,0,2]=4 393 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O OR14698 [0,0,1,0,0,1|0,0,2]=4 394 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 OR9775 [0,0,1,0,0,1|1,0,1]=4 395 B13R1.351 O=C(O)C(=O)\C=C\C1=CC=CC=C1 OR28212 [0,0,1,0,0,1|1,0,0]=3 396 B13R2.57 C=CC1=CC2=C(C=CC=C2)C=C1 OR8644 [1,0,0,0,0,1|2,0,0]=4 397 B13R2.57 O=CC1=CC2=CC=CC=C2C=N1 OR40275 [1,0,0,0,0,1|0,0,1]=3 398 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 OR30994 [1,0,0,0,0,1|0,0,1]=3 399 B13R2.57 O=CC1=CC=C2C=CC=CC2=C1 OR350292 [1,0,0,0,0,1|1,0,0]=3 400 B13R2.57 O=CC1=CC=C2C=CN=CC2=C1 OR30561 [1,0,0,0,0,1|2,0,0]=4 401 B13R2.57 O=CC1=CC=C2C=NC=CC2=C1 OR30560 [1,0,0,0,0,1|2,0,0]=4 402 B13R2.57 O=CC1=CC=C2N=CC=CC2=C1 OR6184 [1,0,0,0,0,1|2,0,0]=4 403 B13R2.57 O=CC1=NC2=C(C=CC=C2)C=C1 OR23073 [1,0,0,0,0,1|0,0,1]=3 404 B13R2.57 O=CC1=NC2=CC=CC=C2N=C1 OR12342 [1,0,0,0,0,1|0,0,1]=3 405 B13R2.57 OCC1=CC2=CC=CC=C2C=C1 OR52473 [1,0,0,0,0,1|1,0,1]=4 406 B13R2.57 OCC1=NC2=C(C=CC=C2)C=C1 OR23074 [1,0,0,0,0,1|0,0,2]=4 407 B15R2.1660 O=C(O)CCC1=NC2=C(C=CC=C2)S1 OR2471 [0,0,0,0,0,2|1,0,1]=4 408 B15R2.1660 O=C(O)CSC1=NC2=C(C=CC=C2)N1 OR9697 [0,0,0,0,0,2|1,0,0]=3 409 B15R2.1660 O=C(O)CSC1=NC2=C(C=CC=C2)S1 OR102929 [0,0,0,0,0,2|1,0,1]=4 410 B15R2.1668 O=C(Cl)CC1=CC2=CC=CC=C2C=C1 OR8139 [0,0,0,0,0,2|2,0,0]=4 411 B15R2.1668 O=C(O)CC1=CC2=CC=CC=C2C=C1 OR8245 [0,0,0,0,0,2|1,0,0]=3