0 B12R1.43 CC(Cl)C(=O)NC1=CC=CC=C1 4028874 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O 3001886 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.43 CC(SC1=NC=CC=C1)C(=O)O 4400386 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.43 CN(CC1=CC=CC=C1)C(=N)N 4015994 [0,0,0,0,0,0|4,0,0]=4 4 B12R1.43 CN(CC1=CC=CC=C1)C(=N)N 4090580 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.43 CN(CC1=CC=CC=C1)C(N)=S 4009975 [0,0,0,0,0,0|3,1,0]=4 6 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 4027804 [0,0,0,0,0,0|1,0,0]=1 7 B11R1.40 NNC(=O)CC1=CC=CC=C1 3002732 [1,0,0,0,0,0|2,0,0]=3 8 B11R1.40 NNC(=O)CC1=CC=NC=C1 4036772 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.40 NNC(=O)CC1=NC=CC=C1 4036750 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.40 O=C(CBr)NC1=CC=CC=C1 4023663 [1,0,0,0,0,0|2,0,1]=4 11 B11R1.40 O=C(CCl)NC1=CC=CC=C1 3002954 [1,0,0,0,0,0|2,0,1]=4 12 B11R1.91 N=C(N)CCC1=CC=CC=C1 4041259 [1,0,0,0,0,0|2,0,1]=4 13 B11R1.91 N=C(N)NCC1=CC=CC=C1 4032915 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.91 O=C(O)CCC1=CC=NC=C1 4004170 [1,0,0,0,0,0|1,0,1]=3 15 B11R1.91 O=C(O)CCC1=NC=CC=C1 4004241 [1,0,0,0,0,0|1,0,1]=3 16 B11R1.91 O=C(O)CCC1=NC=CN=C1 4003578 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.91 O=C(O)CNC1=CC=CN=C1 4110417 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.91 O=C(O)CSC1=NC=CC=C1 4400385 [1,0,0,0,0,0|2,0,1]=4 19 B13R1.133 CC1=CC=C(NC(=O)C(=O)O)C=C1 4031042 [0,1,0,0,0,0|1,0,0]=2 20 B13R1.133 CC1=CC=C(SC(C)C(=O)O)C=C1 4002685 [0,1,0,0,0,0|2,0,1]=4 21 B13R1.133 CN(C)C(=O)CC1=CC=C(Br)C=C1 6617565 [0,1,0,0,0,0|3,0,0]=4 22 B13R1.133 CN(C)C(=O)CC1=CC=C(N)C=C1 4032127 [0,1,0,0,0,0|3,0,0]=4 23 B13R1.133 O=C(O)C(=O)NC1=CC=C(F)C=C1 4027133 [0,1,0,0,0,0|1,0,0]=2 24 B13R1.148 CC(OC1=CC=CC(Br)=C1)C(=O)O 3013973 [0,1,0,0,0,0|2,0,1]=4 25 B13R1.148 CN(C)C(=O)CC1=CC=CC(N)=C1 4032498 [0,1,0,0,0,0|3,0,0]=4 26 B13R1.148 O=C(O)C(=O)NC1=CC(Cl)=CC=C1 4030253 [0,1,0,0,0,0|1,0,0]=2 27 B13R1.148 O=C(O)C(=O)NC1=CC=CC(F)=C1 4026865 [0,1,0,0,0,0|1,0,0]=2 28 B13R1.152 CN(C(=O)C(=O)O)C1=CC=CC=C1 4028185 [0,1,0,0,0,0|1,0,0]=2 29 B13R1.152 CN(C)C(=O)C(N)C1=CC=CC=C1 4033561 [0,1,0,0,0,0|3,0,0]=4 30 B13R1.202 CC(OC1=CC=CC=C1Br)C(=O)O 3013972 [0,1,0,0,0,0|2,0,1]=4 31 B13R1.202 CC1=CC=CC=C1NC(=O)C(=O)O 4027011 [0,1,0,0,0,0|1,0,0]=2 32 B13R1.202 CC1=CC=CC=C1OC(C)C(=O)O 3013838 [0,1,0,0,0,0|2,0,1]=4 33 B13R1.202 CN(C)C(=O)CC1=CC=CC=C1N 4032547 [0,1,0,0,0,0|3,0,0]=4 34 B13R1.202 O=C(O)C(=O)NC1=CC=CC=C1Cl 4030004 [0,1,0,0,0,0|1,0,0]=2 35 B13R1.202 O=C(O)C(=O)NC1=CC=CC=C1F 4027050 [0,1,0,0,0,0|1,0,0]=2 36 B13R1.1073 CC(C)(NC1=CC=CC=C1)C(=O)O 4140261 [0,1,0,0,0,0|2,0,1]=4 37 B13R1.1073 CC(C)(OC1=CC=CC=C1)C(=O)O 3013908 [0,1,0,0,0,0|2,0,1]=4 38 B13R2.369 OC1=NC2=CC=CC=C2C=C1Br 4032198 [0,0,0,1,0,0|2,0,1]=4 39 B13R2.435 CC(=O)C1=NC2=CC=CC=C2N1 4009570 [0,0,0,1,0,0|3,0,0]=4 40 B13R2.435 NC(=O)C1=CC2=CC=CC=C2S1 4045182 [0,0,0,1,0,0|1,1,1]=4 41 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 4088003 [0,0,0,1,0,0|2,0,1]=4 42 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 4089063 [0,0,0,1,0,0|2,0,1]=4 43 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 4401038 [0,0,0,1,0,0|2,0,1]=4 44 B13R2.435 O=C(O)C1=NC2=C(N=CC=C2)N1 4108215 [0,0,0,1,0,0|3,0,0]=4 45 B13R2.435 O=C(O)C1=NC2=CC=CC=C2S1 4400806 [0,0,0,1,0,0|1,1,0]=3 46 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 4400848 [0,0,0,1,0,0|1,0,2]=4 47 B11R1.35 NC(CC1=CC=CO1)C(=O)O 4141555 [0,0,0,0,1,0|2,0,1]=4 48 B11R1.35 O=C(O)C(=O)NC1=NC=CS1 4028501 [0,0,0,0,1,0|3,0,0]=4 49 B11R1.36 O=C(O)C(=O)C1=CC=CN=C1 4034823 [0,0,0,0,1,0|1,0,0]=2 50 B11R1.36 O=C(O)C(=O)C1=CC=CN=C1 4087936 [0,0,0,0,1,0|1,0,0]=2 51 B13R1.348 CC(=O)CC(=O)NC1=CN=CC=C1 6082222 [0,0,0,0,0,1|3,0,0]=4 52 B13R1.348 CN(CC(=O)O)CC1=CC=CC=C1 4110663 [0,0,0,0,0,1|2,0,0]=3 53 B13R1.348 CN(CC(=O)O)CC1=CC=NC=C1 4003361 [0,0,0,0,0,1|3,0,0]=4 54 B13R1.348 CN(CC(=O)O)CC1=CC=NC=C1 4088460 [0,0,0,0,0,1|3,0,0]=4 55 B13R1.348 CN(CC(=O)O)CC1=CN=CC=C1 4003359 [0,0,0,0,0,1|3,0,0]=4 56 B13R1.348 CN(CC(=O)O)CC1=CN=CC=C1 4090519 [0,0,0,0,0,1|3,0,0]=4 57 B13R1.348 CN(CC(=O)O)CC1=NC=CC=C1 4003360 [0,0,0,0,0,1|3,0,0]=4 58 B13R1.348 CN(CC(=O)O)CC1=NC=CC=C1 4088525 [0,0,0,0,0,1|3,0,0]=4 59 B13R1.348 O=C(O)CC(=O)NC1=CC=CC=C1 4027608 [0,0,0,0,0,1|1,0,0]=2 60 B13R1.351 CC(NCC1=CC=CC=C1)C(=O)O 6933119 [0,0,0,0,0,1|1,0,1]=3 61 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 4013598 [0,0,0,0,0,1|0,0,0]=1 62 B10R1.18 CC(=O)CC1=CC=CN=C1 4301933 [2,0,0,0,0,0|1,0,1]=4 63 B10R1.18 CC(=O)CC1=NC=CC=C1 4301932 [2,0,0,0,0,0|1,0,1]=4 64 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 4034385 [1,1,0,0,0,0|2,0,0]=4 65 B12R1.34 NNC(=O)C(O)C1=CC=CC=C1 3002604 [1,1,0,0,0,0|2,0,0]=4 66 B12R1.49 CNC(=O)CC1=CC=C(Br)C=C1 6230715 [1,1,0,0,0,0|2,0,0]=4 67 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 4032694 [1,1,0,0,0,0|2,0,0]=4 68 B12R1.49 NNC(=O)CC1=CC=C(Br)C=C1 3014953 [1,1,0,0,0,0|2,0,0]=4 69 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 3014952 [1,1,0,0,0,0|2,0,0]=4 70 B12R1.49 NNC(=O)CC1=CC=C(O)C=C1 3015278 [1,1,0,0,0,0|2,0,0]=4 71 B12R1.49 NNC(=O)CC1=CC=C(O)C=C1 4045071 [1,1,0,0,0,0|2,0,0]=4 72 B12R1.50 CNC(=O)CC1=CC=CC(N)=C1 4032584 [1,1,0,0,0,0|2,0,0]=4 73 B12R1.50 COC(=O)CC1=CC=CC(N)=C1 4033474 [1,1,0,0,0,0|2,0,0]=4 74 B12R1.50 COC(=O)CC1=CC=CC(N)=C1 4090278 [1,1,0,0,0,0|2,0,0]=4 75 B12R1.371 CNC(=O)CC1=CC=CC=C1N 4032938 [1,1,0,0,0,0|2,0,0]=4 76 B12R1.371 NNC(=O)CC1=C(F)C=CC=C1 4045134 [1,1,0,0,0,0|2,0,0]=4 77 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 3005326 [1,1,0,0,0,0|0,0,1]=3 78 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 5368059 [1,1,0,0,0,0|1,0,1]=4 79 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 4026869 [1,1,0,0,0,0|1,0,1]=4 80 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 3005240 [1,1,0,0,0,0|0,0,1]=3 81 B12R1.27 NNC(=O)CCC1=CC=CC=C1 3017808 [1,1,0,0,0,0|1,0,1]=4 82 B12R1.27 NNC(=O)CCC1=CC=CC=C1 4045083 [1,1,0,0,0,0|1,0,1]=4 83 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 4023673 [1,1,0,0,0,0|2,0,0]=4 84 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 4026827 [1,1,0,0,0,0|1,0,1]=4 85 B12R1.125 CC1=C(SCC(=O)O)C=CC=C1 5232614 [1,1,0,0,0,0|1,0,1]=4 86 B12R1.125 O=C(O)CCN1C=CC=CC1=O 4043762 [1,1,0,0,0,0|1,0,1]=4 87 B12R1.125 O=C(O)CNC1=C(F)C=CC=C1 4028464 [1,1,0,0,0,0|1,0,1]=4 88 B12R1.125 O=C(O)COC1=CC=CC=C1Br 3013825 [1,1,0,0,0,0|1,0,1]=4 89 B12R1.125 O=C(O)COC1=CC=CC=C1F 3013975 [1,1,0,0,0,0|1,0,1]=4 90 B12R1.226 CC(=O)NCC1=CC(Br)=CC=C1 9070602 [1,1,0,0,0,0|2,0,0]=4 91 B12R1.226 CC1=CC(OCC(=O)O)=CC=C1 3001595 [1,1,0,0,0,0|1,0,1]=4 92 B12R1.226 NC1=CC(OCC(=O)O)=CC=C1 4027053 [1,1,0,0,0,0|1,0,1]=4 93 B12R1.226 NC1=CC=CC(\C=C\C(=O)O)=C1 5139503 [1,1,0,0,0,0|0,0,1]=3 94 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 3013974 [1,1,0,0,0,0|1,0,1]=4 95 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 5871696 [1,1,0,0,0,0|1,0,1]=4 96 B12R1.225 NC(C(=O)O)C1=CC=CC(O)=C1 4043672 [0,1,0,0,1,0|1,0,1]=4 97 B12R1.253 CC(N)(C(=O)O)C1=CC=CC=C1 4023843 [0,1,0,0,1,0|1,0,1]=4 98 B14R1.337 CC(=O)CC(=O)NC1=C(Br)C=CC=C1 6092451 [0,1,0,0,0,1|2,0,0]=4 99 B14R1.5978 CC1=CC=CC(NC(=O)CC(=O)O)=C1 4024703 [0,1,0,0,0,1|1,0,0]=3 100 B14R1.161 CC1=C(OCC(O)C(=O)O)C=CC=C1 9071636 [0,1,0,0,0,1|0,0,2]=4 101 B14R1.679 CC(SCC1=CC=C(Cl)C=C1)C(=O)O 9012800 [0,1,0,0,0,1|1,0,1]=4 102 B14R1.6049 CC1=CC=C(NC(=O)C(=O)O)C(C)=C1 4026999 [0,2,0,0,0,0|1,0,0]=3 103 B14R1.6049 O=C(O)C(=O)NC1=CC=C(F)C=C1F 4029935 [0,2,0,0,0,0|1,0,0]=3 104 B14R1.153 CC1=C(C)C(NC(=O)C(=O)O)=CC=C1 4028016 [0,2,0,0,0,0|1,0,0]=3 105 B14R1.4257 CC1=CC(C)=CC(NC(=O)C(=O)O)=C1 4032030 [0,2,0,0,0,0|1,0,0]=3 106 B14R1.4257 O=C(O)C(=O)NC1=CC(F)=CC(F)=C1 4030483 [0,2,0,0,0,0|1,0,0]=3 107 B14R1.4474 CC1=CC=C(C)C(NC(=O)C(=O)O)=C1 4027228 [0,2,0,0,0,0|1,0,0]=3 108 B14R1.3135 CCC1=CC=CC=C1NC(=O)C(=O)O 4028048 [0,2,0,0,0,0|1,0,0]=3 109 B14R1.4513 CC(=O)C(CC1=CC=CC=C1)C(C)=O 5119789 [0,2,0,0,0,0|1,0,1]=4 110 B12R2.32 O=CC1=CC2=CC=CC=C2N1 4130840 [1,0,0,1,0,0|1,0,1]=4 111 B12R2.32 O=CC1=CC2=CC=CC=C2S1 4300821 [1,0,0,1,0,0|0,1,1]=4 112 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 4300303 [1,0,0,1,0,0|2,0,0]=4 113 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 4002962 [1,0,0,1,0,0|1,0,1]=4 114 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 4030655 [1,0,0,1,0,0|1,0,1]=4 115 B14R2.642 CC1=C(C(=O)O)C2=CC=CC=C2S1 4110419 [0,0,0,1,0,1|2,0,0]=4 116 B14R2.768 O=C(O)CC1=NC2=C(C=CC=C2)N1 4400292 [0,0,0,1,0,1|2,0,0]=4 117 B14R2.768 O=C(O)CN1CC2=CC=CC=C2C1 4003155 [0,0,0,1,0,1|2,0,0]=4 118 B14R2.4586 CC1=C(C2=CC=CC=C2)C1C(=O)O 5326629 [0,0,0,1,0,1|1,0,1]=4 119 B14R2.781 O=C(O)C1COC2=C(C=CC=C2)C1 4005920 [0,0,0,1,0,1|1,0,1]=4 120 B14R2.4529 CC1=CC2=C(C=C1)NC(C(=O)O)=N2 4012864 [0,1,0,1,0,0|2,0,0]=4 121 B14R2.4529 CC1=CC2=C(C=C1)NC(C(=O)O)C2 4004794 [0,1,0,1,0,0|1,0,1]=4 122 B14R2.4529 CC1=CC2=C(C=C1)OC(C(=O)O)=C2 4008763 [0,1,0,1,0,0|0,0,2]=4 123 B14R2.4529 O=C(O)C1CC2=CC(Cl)=CC=C2N1 4004896 [0,1,0,1,0,0|1,0,1]=4 124 B14R2.1128 O=CC1=CC2=CC=CC=C2NC1=O 4003194 [0,1,0,1,0,0|1,0,1]=4 125 B14R2.8188 CN1C(=O)C(=O)NC2=CC=CC=C21 4033761 [0,1,0,1,0,0|2,0,0]=4 126 B14R2.7969 CC1=CC=CC2=C1OC(C(=O)O)=C2 4041510 [0,1,0,1,0,0|0,0,2]=4 127 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Cl)N1 4402643 [0,1,0,1,0,0|1,0,1]=4 128 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2N1 4023476 [0,1,0,1,0,0|1,0,1]=4 129 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=CC=C2)S1 3003092 [0,1,0,1,0,0|0,1,1]=4 130 B14R2.450 O=C(O)C1=C(Cl)C2=CC=CC=C2N1 4042558 [0,1,0,1,0,0|1,0,1]=4 131 B10R1.66 O=C(O)CCC1=CSC=C1 4014842 [1,0,0,0,1,0|1,0,1]=4 132 B10R1.66 O=C(O)CCN1C=CC=C1 4027042 [1,0,0,0,1,0|1,0,1]=4 133 B10R1.66 O=C(O)\C=C\C1=CC=CS1 3002329 [1,0,0,0,1,0|1,0,1]=4