0 B14R2.8045 CC1=CC(=C2C=CC=C(C2=N1)Br)Br BBO000286 [0,0,0,0,0,0|3,0,0]=3 1 B14R2.8045 CC1=CC(=C2C=CC=C(C2=N1)C)Br CDS020781 [0,0,0,0,0,0|3,0,0]=3 2 B14R2.8045 CC1=CC(=C2C=CC=C(C2=N1)F)Br BBO000285 [0,0,0,0,0,0|3,0,0]=3 3 B14R2.8045 CC1=CC(=C2C=CC=C(C2=N1)N)C T327395 [0,0,0,0,0,0|3,0,0]=3 4 B14R2.8045 CC1=CC(=C2N=CC=C(C2=C1)O)C BBO000048 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.8045 CC1=CC(=C2N=CC=C(C2=C1)O)Cl BBO000037 [0,0,0,0,0,0|4,0,0]=4 6 B14R2.8045 CC1=CC(=NC2=C1C=CC=C2C)O S376183 [0,0,0,0,0,0|4,0,0]=4 7 B14R2.8045 CC1=CC=CC2=C1NC(=O)NC2=O T315990 [0,0,0,0,0,0|2,0,1]=3 8 B14R2.8045 CC1=CC=CC2=C1SC(CC2=O)C PH014870 [0,0,0,0,0,0|3,0,1]=4 9 B14R2.8045 CC1=CC=C[N+]2=C1N=C(C=C2C)C R606456 [0,0,0,0,0,0|4,0,0]=4 10 B14R2.8045 CC1=NC2=C(C=CC=C2C(=C1)Cl)Br BBO000020 [0,0,0,0,0,0|3,0,0]=3 11 B14R2.8045 CC1=NC2=C(C=CC=C2C(=C1)Cl)C BBO000026 [0,0,0,0,0,0|3,0,0]=3 12 B14R2.8045 CC1=NC2=C(C=CC=C2C(=C1)Cl)F BBO000175 [0,0,0,0,0,0|3,0,0]=3 13 B14R2.8045 CC1=NC2=C(C=CC=C2C(=C1)N)Br BBO000073 [0,0,0,0,0,0|3,0,0]=3 14 B14R2.8045 CC1=NC2=C(C=CC=C2C(=C1)N)C BBO000075 [0,0,0,0,0,0|3,0,0]=3 15 B14R2.8045 CC1=NC2=C(C=CC=C2C(=C1)N)F CBR01404 [0,0,0,0,0,0|3,0,0]=3 16 B14R2.8045 CC1=NC2=C(C=CC=C2C(=C1)O)Br BBO000223 [0,0,0,0,0,0|2,0,1]=3 17 B14R2.8045 CC1=NC2=C(C=CC=C2C(=C1)O)C BBO000042 [0,0,0,0,0,0|2,0,1]=3 18 B14R2.8045 CC1=NC2=C(C=CC=C2C(=C1)O)F BBO000053 [0,0,0,0,0,0|2,0,1]=3 19 B14R2.8045 CC1=NC2=C(C=CC=C2Cl)C(=C1)O BBO000698 [0,0,0,0,0,0|2,0,1]=3 20 B13R2.162 CC1=CC2=C(C=C1)N=CC=C2O BBO000008 [1,0,0,0,0,0|3,0,0]=4 21 B13R2.162 CC1=CC=C2C=CC=C(C2=N1)N CDS000034 [1,0,0,0,0,0|2,0,0]=3 22 B13R2.162 CC1=CC=CC2=C1N=C(C=C2)C R158348 [1,0,0,0,0,0|2,0,0]=3 23 B13R2.162 ClC1=NC2=C(C=CC=C2C=C1)Br KOB0136 [1,0,0,0,0,0|3,0,0]=4 24 B13R2.328 CC1=CC(=C2C=CC=NC2=N1)Cl MNO000097 [1,0,0,0,0,0|3,0,0]=4 25 B13R2.328 CC1=CC(=NC2=CC=CC=C12)N BBO000578 [1,0,0,0,0,0|3,0,0]=4 26 B13R2.328 CC1=CC(=NC2=CC=CC=[N+]12)C S29859 [1,0,0,0,0,0|3,0,0]=4 27 B13R2.328 CC1=CC(=O)N2=CC=CC=C2N1 OTV000974 [1,0,0,0,0,0|2,0,1]=4 28 B13R2.328 CC1=CC(=O)N2C=CC=CC2=N1 T320765 [1,0,0,0,0,0|2,0,0]=3 29 B13R2.328 CC1=NC2=CC=CC=C2C(=N1)Cl ANV00241 [1,0,0,0,0,0|1,0,1]=3 30 B13R2.328 NC1=NC(=C2C=CC=CC2=N1)N CDS001152 [1,0,0,0,0,0|2,0,1]=4 31 B13R2.328 NC1=NC2=C(C=CC=C2)C(=C1)O R240303 [1,0,0,0,0,0|2,0,1]=4 32 B13R2.328 NC1=NC2=CC=CC=C2C(=O)N1 CDS020257 [1,0,0,0,0,0|1,0,0]=2 33 B13R2.328 O=C1C=C(N=C2N1C=CC=C2)Cl R795666 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.328 O=C1NC(=S)N=C2N1C=CC=C2 PH007719 [1,0,0,0,0,0|2,0,0]=3 35 B13R2.328 O=C1SC(=NC2=C1C=CC=C2)S S275190 [1,0,0,0,0,0|2,0,0]=3 36 B13R2.328 [NH+]1=C(C2=C(C=CC=C2)N=C1C)O R663514 [1,0,0,0,0,0|0,0,2]=3 37 B13R2.342 BrC1=CC=CC2=C(C=CN=C12)Br BBO000590 [1,0,0,0,0,0|3,0,0]=4 38 B13R2.342 CC1=C2N=CC=C(C2=CC=C1)N BBO000078 [1,0,0,0,0,0|3,0,0]=4 39 B13R2.342 CC1=C2N=CC=C(C2=CC=C1)O PH002702 [1,0,0,0,0,0|2,0,1]=4 40 B13R2.342 CC1=CC=CC2=C(C=CN=C12)Cl BBO000712 [1,0,0,0,0,0|3,0,0]=4 41 B13R2.342 CC1=CC=CC2=C(N=CN=C12)Cl CDS005205 [1,0,0,0,0,0|2,0,1]=4 42 B13R2.342 ClC1=C2N=CC=C(C2=CC=C1)Br BBO000239 [1,0,0,0,0,0|3,0,0]=4 43 B13R2.342 ClC1=CC=CC2=C1N=CN=C2Cl CDS020951 [1,0,0,0,0,0|2,0,1]=4 44 B13R2.342 ClC1=CC=NC2=C(C=CC=C12)Br BBO000222 [1,0,0,0,0,0|3,0,0]=4 45 B13R2.342 FC1=C2N=CC=C(C2=CC=C1)Br BBO000240 [1,0,0,0,0,0|3,0,0]=4 46 B13R2.342 FC1=CC=CC2=C1N=CC=C2Cl BBO000703 [1,0,0,0,0,0|3,0,0]=4 47 B13R2.342 NC1=C2C=CC=C(C2=NC=C1)Br CBR00223 [1,0,0,0,0,0|3,0,0]=4 48 B13R2.342 NC1=CC=CC2=C1C=CC=C2O S706795 [1,0,0,0,0,0|3,0,0]=4 49 B13R2.342 NC1=CC=NC2=C(C=CC=C12)Cl BBO000570 [1,0,0,0,0,0|3,0,0]=4 50 B13R2.342 NC1=CC=NC2=C(C=CC=C12)F BBO000718 [1,0,0,0,0,0|3,0,0]=4 51 B13R2.342 OC1=CC=NC2=C(C=CC=C12)Br BBO000023 [1,0,0,0,0,0|2,0,1]=4 52 B13R2.342 OC1=CC=NC2=C(C=CC=C12)Cl BBO000039 [1,0,0,0,0,0|2,0,1]=4 53 B15R2.14648 CC1=CC=C(C2=C1N=C(C=C2O)C)Cl S647616 [0,1,0,0,0,0|2,0,1]=4 54 B15R2.14648 CC1=NC2=C(C=CC(=C2C(=C1)N)Cl)Cl BBO000084 [0,1,0,0,0,0|3,0,0]=4 55 B15R2.14648 CC1=NC2=C(C=CC(=C2C(=C1)O)C)C OTV000928 [0,1,0,0,0,0|2,0,1]=4 56 B15R2.20937 CCC1=C2N=C(C=C(C2=CC=C1)O)C BBO000046 [0,1,0,0,0,0|2,0,1]=4 57 B15R2.20937 COC1=C2N=C(C=C(C2=CC=C1)Br)C BBO000283 [0,1,0,0,0,0|2,0,0]=3 58 B15R2.20937 COC1=C2N=C(C=C(C2=CC=C1)C)Cl CBR00575 [0,1,0,0,0,0|3,0,0]=4 59 B15R2.20937 COC1=C2N=C(C=C(C2=CC=C1)Cl)C BBO000176 [0,1,0,0,0,0|2,0,0]=3 60 B15R2.20937 COC1=C2N=C(C=C(C2=CC=C1)O)C BBO000180 [0,1,0,0,0,0|1,0,1]=3 61 B15R2.59732 CC1=CC(=C2C=C(C=C(C2=N1)C)Br)Cl BBO000318 [0,1,0,0,0,0|3,0,0]=4 62 B15R2.59732 CC1=CC(=C2C=C(C=C(C2=N1)Cl)Cl)N BBO000740 [0,1,0,0,0,0|3,0,0]=4 63 B15R2.59732 CC1=CC(=C2C=C(C=C(C2=N1)F)F)Br BBO000317 [0,1,0,0,0,0|3,0,0]=4 64 B15R2.59732 CC1=CC(=C2C=C(C=C(C2=N1)F)F)Cl BBO000316 [0,1,0,0,0,0|3,0,0]=4 65 B15R2.59732 CC1=CC(=C2N=C(C=C(C2=C1)Cl)C)C BBO000162 [0,1,0,0,0,0|3,0,0]=4 66 B15R2.59732 CC1=CC(=C2N=C(C=C(C2=C1)Cl)C)Cl BBO000149 [0,1,0,0,0,0|3,0,0]=4 67 B15R2.59732 CC1=CC(=C2N=C(C=C(C2=C1)N)C)C BBO000151 [0,1,0,0,0,0|3,0,0]=4 68 B15R2.59732 CC1=CC(=C2N=C(C=C(C2=C1)O)C)C BBO000093 [0,1,0,0,0,0|2,0,1]=4 69 B15R2.59732 CC1=CC(=CC2=C1N=C(C=C2Cl)C)Cl PH004573 [0,1,0,0,0,0|3,0,0]=4 70 B15R2.59732 CC1=CC2=C(C=C(N=C2C(=C1)Br)C)Cl BBO000321 [0,1,0,0,0,0|3,0,0]=4 71 B15R2.59732 CC1=CC2=C(C=C(N=C2C(=C1)C)C)Br BBO000288 [0,1,0,0,0,0|3,0,0]=4 72 B15R2.59732 CC1=NC2=C(C=C(C=C2C(=C1)Cl)Br)Br BBO000024 [0,1,0,0,0,0|3,0,0]=4 73 B15R2.59732 CC1=NC2=C(C=C(C=C2C(=C1)Cl)Cl)Cl BBO000056 [0,1,0,0,0,0|3,0,0]=4 74 B15R2.59732 CC1=NC2=C(C=C(C=C2C(=C1)N)F)F BBO000299 [0,1,0,0,0,0|3,0,0]=4 75 B15R2.59732 CC1=NC2=C(C=C(C=C2C(=C1)O)Cl)Cl BBO000195 [0,1,0,0,0,0|2,0,1]=4 76 B15R2.63910 CC1=CC(=C2C=CC(=C(C2=N1)C)Br)Cl BBO000320 [0,1,0,0,0,0|3,0,0]=4 77 B15R2.63910 CC1=CC(=C2C=CC(=C(C2=N1)C)Br)O BBO000319 [0,1,0,0,0,0|2,0,1]=4 78 B15R2.63910 CC1=CC(=C2C=CC(=C(C2=N1)C)C)Br BBO000289 [0,1,0,0,0,0|3,0,0]=4 79 B15R2.63910 CC1=CC=C2C(=CC(=NC2=C1C)C)Cl BBO000163 [0,1,0,0,0,0|3,0,0]=4 80 B15R2.63910 CC1=CC=C2C(=CC(=NC2=C1C)C)O BBO000099 [0,1,0,0,0,0|2,0,1]=4 81 B15R2.63910 CC1=NC2=C(C(=CC=C2C(=C1)Cl)Cl)C BBO000147 [0,1,0,0,0,0|3,0,0]=4 82 B15R2.63910 CC1=NC2=C(C(=CC=C2C(=C1)Cl)Cl)Cl BBO000057 [0,1,0,0,0,0|3,0,0]=4 83 B15R2.63910 CC1=NC2=C(C(=CC=C2C(=C1)N)Cl)Cl BBO000082 [0,1,0,0,0,0|3,0,0]=4 84 B15R2.63910 CC1=NC2=C(C(=CC=C2C(=C1)O)Cl)C BBO000028 [0,1,0,0,0,0|2,0,1]=4 85 B13R1.147 CC(C)NC(=O)C1=CC=CC(=C1)N CBR01392 [0,0,1,0,0,0|2,0,1]=4 86 B13R1.147 CN(C)NC(=O)C1=CC=CC(=C1)Cl PH007551 [0,0,1,0,0,0|3,0,0]=4 87 B13R1.147 NC(=O)NC(=O)C1=CC=CC(=C1)Br PH009582 [0,0,1,0,0,0|2,0,1]=4 88 B13R2.4825 CC1=C2C=CC=C(C2=NN1C)Br PHB00049 [0,0,0,0,1,0|3,0,0]=4 89 B13R2.4825 CC1=CC=CC2=C1NC(=C2C)C CDS014194 [0,0,0,0,1,0|2,0,1]=4 90 B13R2.4825 CC1=CC=CC2=C1NC(=O)C2=O S639125 [0,0,0,0,1,0|2,0,1]=4 91 B13R2.4857 O=C1OC(=O)C2=C1C=CC=C2Cl S663077 [0,0,0,0,1,0|3,0,0]=4 92 B12R1.17 CCNC(=O)C1=CC(=CC=C1)O EME00412 [1,0,1,0,0,0|0,0,1]=3 93 B12R1.17 CCNC(=O)C1=CC=CC(=C1)N CBR00239 [1,0,1,0,0,0|1,0,1]=4 94 B12R1.24 COC(=O)C1=CC=CC(=C1O)O PH011302 [1,0,1,0,0,0|2,0,0]=4 95 B12R1.308 CCNC(=O)C1=C(C=CC=C1)C R467715 [1,0,1,0,0,0|1,0,1]=4 96 B12R1.308 CNNC(=O)C1=CC=CC=C1O PH008875 [1,0,1,0,0,0|2,0,0]=4 97 B12R1.107 N=C(N)NC(=O)C1=CC=CC=C1 S862614 [1,0,1,0,0,0|1,0,0]=3 98 B12R1.107 N=C(N)SC(=O)C1=CC=CC=C1 S187364 [1,0,1,0,0,0|2,0,0]=4 99 B12R1.107 NC(=O)NC(=O)C1=CC=CC=C1 S450545 [1,0,1,0,0,0|1,0,1]=4 100 B12R1.267 O=CN/N=C/C1=CC=CC=C1O L496960 [1,0,1,0,0,0|2,0,0]=4 101 B12R1.32 O=CNC(=O)CC1=CC=CC=C1 S909793 [1,0,1,0,0,0|2,0,0]=4 102 B12R1.32 O=CNC(=O)NC1=CC=CC=C1 S856495 [1,0,1,0,0,0|1,0,1]=4 103 B12R1.75 C(=O)C1=C(C=CC=C1)OC(=O)C R252476 [1,0,1,0,0,0|2,0,0]=4 104 B12R2.24 CC1=NC2=C(C=C1)C=NC=C2 PH008439 [2,0,0,0,0,0|2,0,0]=4 105 B12R2.24 CC1=NC2=CC=CC=C2SC1 PH013508 [2,0,0,0,0,0|2,0,0]=4 106 B12R2.24 CC1=NC2=NC=CC=C2C=C1 ADE000831 [2,0,0,0,0,0|2,0,0]=4 107 B12R2.24 ClC1=NC2=C(C=CC=C2)C=N1 UPL0037 [2,0,0,0,0,0|1,0,1]=4 108 B12R2.24 NC1=NC=C2C=CC=CC2=N1 CDS008332 [2,0,0,0,0,0|1,0,1]=4 109 B12R2.1081 ClC1=CC=CC2=CC=CN=C12 CDS004725 [2,0,0,0,0,0|2,0,0]=4 110 B12R2.1081 FC1=CC=CC2=CC=CN=C12 CDS006871 [2,0,0,0,0,0|2,0,0]=4 111 B12R2.1081 NC1=C2C=CC=CC2=NC=N1 CBR00181 [2,0,0,0,0,0|1,0,1]=4 112 B12R2.1081 NC1=CC=NC2=CC=CC=C12 BBO000743 [2,0,0,0,0,0|2,0,0]=4 113 B12R2.1081 NC1=CC=NC2=CC=CC=C12 CDS009704 [2,0,0,0,0,0|2,0,0]=4 114 B12R2.1081 O=C1C=CSC2=C1C=CC=C2 S849510 [2,0,0,0,0,0|2,0,0]=4 115 B12R2.1081 O=C1NOCC2=C1C=CC=C2 PH009154 [2,0,0,0,0,0|2,0,0]=4 116 B12R2.1081 OC1=CC=CC2=C1N=CC=C2 S440892 [2,0,0,0,0,0|1,0,0]=3 117 B14R1.6052 N=C(N)NC(=O)C1=CC(=CC=C1O)Cl R299936 [0,1,1,0,0,0|2,0,0]=4 118 B14R2.4513 CC1=CC=C2C=CC(=C(C2=N1)C)Br BBO000612 [1,1,0,0,0,0|2,0,0]=4 119 B14R2.8751 CC1=CC=C2C(=CC=C(C2=N1)O)Cl PH008835 [1,1,0,0,0,0|1,0,0]=3 120 B14R2.8751 CC1=NC2=C(C=CC(=C2C=C1)Cl)C BBO000188 [1,1,0,0,0,0|2,0,0]=4 121 B14R2.11684 CC1=CC=C2C=CC=C(C2=N1)NN PH018443 [1,1,0,0,0,0|2,0,0]=4 122 B14R2.11684 COC1=CC=CC2=C1N=C(C=C2)C S770345 [1,1,0,0,0,0|1,0,0]=3 123 B14R2.11684 COC1=CC=CC2=CC=C(N=C12)Cl CDS009012 [1,1,0,0,0,0|2,0,0]=4 124 B14R2.1019 CNC1=NC2=C(C=CC=C2)C(=O)O1 PH008463 [1,1,0,0,0,0|1,0,0]=3 125 B14R2.1019 ClCC1=NC2=CC=CC=C2C(=N1)Cl BBO000667 [1,1,0,0,0,0|1,0,1]=4 126 B14R2.1019 NCC1=NC(=C2C=CC=CC2=N1)O PH017876 [1,1,0,0,0,0|0,0,2]=4 127 B14R2.1019 NCC1=NC2=CC=CC=C2C(=O)N1 CBR01562 [1,1,0,0,0,0|0,0,0]=2 128 B14R2.7724 CC1C(=O)NC(=O)C2=C1C=CC=C2 T153575 [1,1,0,0,0,0|2,0,0]=4 129 B14R2.7724 CN1NC(=O)C2=C(C1=O)C=CC=C2 PH000404 [1,1,0,0,0,0|2,0,0]=4 130 B14R2.8188 CC1=CC2=C(C=CC=N2)C(=O)N1O PH009667 [1,1,0,0,0,0|2,0,0]=4 131 B14R2.8188 CC1=NC2=C(C=CC=C2)C(=O)N1C PH009348 [1,1,0,0,0,0|0,0,0]=2 132 B14R2.8188 CC1=NC2=CC=CC=C2C(=C1Br)Cl BBO000651 [1,1,0,0,0,0|2,0,0]=4 133 B14R2.8188 CC1=NC2=CC=CC=C2C(=C1Br)N CDS022707 [1,1,0,0,0,0|2,0,0]=4 134 B14R2.8188 CC1=NC2=CC=CC=C2C(=C1Cl)Br BBO000648 [1,1,0,0,0,0|2,0,0]=4 135 B14R2.8188 CC1=NC2=CC=CC=C2C(=O)N1O R245895 [1,1,0,0,0,0|0,0,0]=2 136 B14R2.8188 CC1NC2=C(C=CC=C2)C(=O)N1C PH008318 [1,1,0,0,0,0|0,0,2]=4 137 B14R2.8188 CN1C(=O)C2=C(C=CC=C2)NC1=S PH003631 [1,1,0,0,0,0|1,0,1]=4 138 B14R2.8188 CN1C(=O)NC2=CC=CC=C2C1=O TMT00237 [1,1,0,0,0,0|1,0,1]=4 139 B14R2.8188 CN1C(=O)OC2=C(C1=O)C=CC=C2 PH009096 [1,1,0,0,0,0|2,0,0]=4 140 B14R2.28480 CC1=CC(=O)C2=C(N1)C=CC=C2C R261815 [1,1,0,0,0,0|1,0,1]=4 141 B14R2.28480 CC1=CC(=O)N2C(=CC=CC2=N1)C T143529 [1,1,0,0,0,0|2,0,0]=4 142 B14R2.29365 CC1=CC(=NC2=CC(=CC=C12)Cl)C BBO000027 [1,1,0,0,0,0|2,0,0]=4 143 B14R2.29365 CC1=CC(=O)C2=C(N1)C=C(C=C2)Br R261793 [1,1,0,0,0,0|1,0,1]=4 144 B14R2.29365 CC1=NC2=C(C=CC(=C2)Cl)C(=C1)Cl BBO000700 [1,1,0,0,0,0|2,0,0]=4 145 B14R2.29365 CC1=NC2=C(C=CC(=C2)Cl)C(=O)N1 R101850 [1,1,0,0,0,0|0,0,0]=2 146 B14R2.29365 CC1=NC2=C(C=CC(=C2)Cl)C(=O)O1 PH009098 [1,1,0,0,0,0|1,0,0]=3 147 B14R2.29365 CC1=NC2=CC(=CC=C2C(=C1)Cl)Br BBO000214 [1,1,0,0,0,0|2,0,0]=4 148 B14R2.29365 CC1=NC2=CC(=CC=C2C(=C1)Cl)F BBO000171 [1,1,0,0,0,0|2,0,0]=4 149 B14R2.29365 CC1=NC2=CC(=CC=C2C(=C1)N)Br BBO000156 [1,1,0,0,0,0|2,0,0]=4 150 B14R2.29365 CC1=NC2=CC(=CC=C2C(=C1)N)Cl BBO000157 [1,1,0,0,0,0|2,0,0]=4 151 B14R2.29365 CC1=NC2=CC(=CC=C2C(=C1)O)Cl BBO000069 [1,1,0,0,0,0|1,0,1]=4 152 B14R2.29365 CC1=NC2=CC(=CC=C2C(=C1)O)F BBO000217 [1,1,0,0,0,0|1,0,1]=4 153 B14R2.29365 CC1=NC2=CC(=CC=C2C(=N1)Cl)F CDS021178 [1,1,0,0,0,0|1,0,1]=4 154 B14R2.29365 O=C1NC(=O)C2=CC=C(C=C2N1)Cl T309141 [1,1,0,0,0,0|1,0,1]=4 155 B14R2.29496 CC1(NC(=O)C2=CC=CC=C2O1)C PH001950 [1,1,0,0,0,0|1,0,1]=4 156 B14R2.1078 COC1=C2N=CC=C(C2=CC=C1)Cl BBO000177 [1,1,0,0,0,0|2,0,0]=4 157 B14R2.1078 COC1=CC=CC2=C(C=CN=C12)Br BBO000277 [1,1,0,0,0,0|2,0,0]=4 158 B14R2.1078 COC1=CC=CC2=C(C=CN=C12)O BBO000717 [1,1,0,0,0,0|1,0,1]=4 159 B14R2.1078 COC1=CC=CC2=C(C=CN=C12)O CDS005733 [1,1,0,0,0,0|1,0,1]=4 160 B14R2.4220 CC1=C2NC(=C(C2=CC=C1)C=O)C CBR01860 [0,1,0,0,1,0|1,0,1]=4 161 B14R2.11645 COC1=CC=CC2=C1NC(=O)C2=O R162574 [0,1,0,0,1,0|1,0,1]=4 162 B14R2.8667 CC1CC(=O)C2=C1C(=CC=C2O)O R152145 [0,1,0,0,1,0|1,0,1]=4 163 B16R2.26166 CC1=CC(=O)C2=CC=CC(=C2N1)C(=O)O T326224 [0,2,0,0,0,0|1,0,1]=4 164 B16R2.26166 CC1=NC2=C(C=CC=C2C(=O)O)C(=O)O1 PH007950 [0,2,0,0,0,0|1,0,0]=3 165 B16R2.36833 COC1=C2N=C(C=C(C2=CC=C1)NN)C PH018439 [0,2,0,0,0,0|2,0,0]=4 166 B16R2.22891 CC1=CC(=C2C=CC=C(C2=N1)C)C(=O)O CDS021516 [0,2,0,0,0,0|2,0,0]=4 167 B14R2.22 CC1=NN=C(N1)C2=CC=CC(=C2)N CBR02324 [0,0,1,1,0,0|2,0,0]=4 168 B14R2.111 C(=O)NC1=NC2=C(S1)C=CC=C2Cl R368369 [0,0,1,1,0,0|2,0,0]=4 169 B14R2.712 CC1=NC2=C(O1)C=CC=C2[N+](=O)[O-] CDS021008 [0,0,1,1,0,0|2,0,0]=4 170 B12R1.225 CC(=O)C(=O)C1=CC(=CC=C1)Cl MNO000201 [0,0,1,0,1,0|2,0,0]=4 171 B12R2.202 CC1=CC2=CC=CC(=C2O1)N CBR00813 [1,0,0,0,1,0|2,0,0]=4 172 B12R2.202 CN1C=C2C=CC=C(C2=N1)Br SYX00129 [1,0,0,0,1,0|2,0,0]=4 173 B12R2.202 NC1=NC2=C(C=CC=C2S1)O CDS003821 [1,0,0,0,1,0|2,0,0]=4 174 B12R2.18 CN1CC2=C(C1=O)C=CC=C2 S701564 [1,0,0,0,1,0|2,0,0]=4 175 B12R2.246 CC1=NC2=C(C=CS2)C(=O)N1 JRD0266 [1,0,0,0,1,0|1,0,0]=3 176 B12R2.246 O=C1NC(=NC2=C1C=CN2)S JRD0216 [1,0,0,0,1,0|2,0,0]=4 177 B12R2.2028 CC1OC(=O)C2=C1C=CC=C2 PH010378 [1,0,0,0,1,0|1,0,1]=4 178 B12R2.2028 O=C1NS(=O)C2=C1C=CC=C2 PH009216 [1,0,0,0,1,0|2,0,0]=4 179 B12R2.2028 O=C1SC(=O)C2=C1C=CC=C2 PH009710 [1,0,0,0,1,0|2,0,0]=4 180 B12R2.2028 O=C1[N-]C(=O)C2=C1C=CC=C2 R426687 [1,0,0,0,1,0|1,0,1]=4 181 B12R2.196 O=C1NC=NC2=C1SC=C2Br PHB00093 [1,0,0,0,1,0|2,0,0]=4