0 B14R2.68 CC1=CC=C(C=C1)C2=CC=CC=C2 CNP0412652.0 [0,0,0,0,0,0|0,0,0]=0 1 B14R2.68 CC1=CC=C(C=C1)C2=CC=CN=C2 CNP0557031.0 [0,0,0,0,0,0|1,0,0]=1 2 B14R2.68 CC1=CC=C(C=N1)C2=CC=CC=C2 CNP0003442.0 [0,0,0,0,0,0|1,0,0]=1 3 B14R2.68 CC1=CC=C(N=C1)C2=CC=CN=C2 CNP0221569.0 [0,0,0,0,0,0|2,0,0]=2 4 B14R2.68 CN1CC=C(CC1)C2=CC=CC=C2 CNP0026190.0 [0,0,0,0,0,0|1,0,3]=4 5 B14R2.68 ClC1=CN=C(N=C1)C2=CC=CC=C2 CNP0450193.0 [0,0,0,0,0,0|3,0,0]=3 6 B14R2.68 NC1=CC=C(C=C1)C2=CC=CC=C2 CNP0320497.0 [0,0,0,0,0,0|1,0,0]=1 7 B14R2.68 NC1=NC=C(N=N1)C2=CC=CC=C2 CNP0080993.0 [0,0,0,0,0,0|4,0,0]=4 8 B14R2.68 OC1=CC=C(C=C1)C2=CC=CC=C2 CNP0113293.0 [0,0,0,0,0,0|1,0,0]=1 9 B14R2.68 [O-][N+]1=CC=C(C=C1)C2=CC=CC=C2 CNP0484104.0 [0,0,0,0,0,0|2,0,0]=2 10 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=C2 CNP0153903.0 [1,0,0,0,0,0|0,0,0]=1 11 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=N2 CNP0153884.0 [1,0,0,0,0,0|1,0,0]=2 12 B13R2.3 C1=CC=C(C=C1)C2=CC=CN=C2 CNP0398040.0 [1,0,0,0,0,0|1,0,0]=2 13 B13R2.3 C1=CC=C(C=C1)C2=CC=NC=C2 CNP0303887.0 [1,0,0,0,0,0|1,0,0]=2 14 B13R2.3 C1=CC=C(N=C1)C2=CC=CC=N2 CNP0275446.0 [1,0,0,0,0,0|2,0,0]=3 15 B13R2.3 C1=CC=C(N=C1)C2=CC=CN=C2 CNP0161777.0 [1,0,0,0,0,0|2,0,0]=3 16 B13R2.3 C1=NC=CC(=C1)C2=CC=NC=C2 CNP0236600.0 [1,0,0,0,0,0|2,0,0]=3 17 B15R2.1 COC1=CC=C(C=C1)C2=CC=CC=C2 CNP0009048.0 [0,1,0,0,0,0|0,0,0]=1 18 B15R2.1 O=CC1=CC=C(C=C1)C2=CC=CC=C2 CNP0081471.0 [0,1,0,0,0,0|0,0,1]=2 19 B15R2.3 CC1=CC=C(C=C1)C2=CC=C(C=C2)C CNP0175106.0 [0,1,0,0,0,0|0,0,0]=1 20 B15R2.3 CC1=CC=C(N=C1)C2=CC=C(C=N2)C CNP0492519.0 [0,1,0,0,0,0|2,0,0]=3 21 B15R2.3 C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C CNP0489675.0 [0,1,0,0,0,0|2,0,0]=3 22 B15R2.3 C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C CNP0583804.0 [0,1,0,0,0,0|2,0,0]=3 23 B15R2.3 ClC1=CC=C(C=C1)C2=CC=C(C=C2)Cl CNP0030639.0 [0,1,0,0,0,0|1,0,0]=2 24 B15R2.3 IC1=CC=C(C=C1)C2=CC=C(C=C2)I CNP0446751.0 [0,1,0,0,0,0|1,0,0]=2 25 B15R2.3 NC1=CC=C(C=C1)C2=CC=C(C=C2)N CNP0080057.0 [0,1,0,0,0,0|1,0,0]=2 26 B15R2.3 NC1=CC=C(C=C1)C2=CC=C(C=C2)O CNP0501070.0 [0,1,0,0,0,0|1,0,0]=2 27 B15R2.3 OC1=CC=C(C=C1)C2=CC=C(C=C2)Cl CNP0345541.0 [0,1,0,0,0,0|1,0,0]=2 28 B15R2.3 OC1=CC=C(C=C1)C2=CC=C(C=C2)O CNP0049484.0 [0,1,0,0,0,0|1,0,0]=2 29 B15R2.3 SC1=CC=C(C=C1)C2=CC=C(C=C2)S CNP0187238.0 [0,1,0,0,0,0|1,0,0]=2 30 B15R2.28 CC1=CC=C(C=C1)C2=CC=CC(=C2)C CNP0140658.0 [0,1,0,0,0,0|0,0,0]=1 31 B15R2.28 CC1=CC=C(C=C1)C2=CC=CC(=O)O2 CNP0103601.0 [0,1,0,0,0,0|1,0,0]=2 32 B15R2.28 CC1=CC[Se]C(=N1)C2=CC=C(C=C2)C CNP0538640.0 [0,1,0,0,0,0|2,0,1]=4 33 B15R2.28 O=C1C=CC=C(O1)C2=CC=C(C=C2)Br CNP0057199.0 [0,1,0,0,0,0|2,0,0]=3 34 B15R2.28 O=C1C=COC(=C1)C2=CC=C(C=N2)O CNP0141938.0 [0,1,0,0,0,0|3,0,0]=4 35 B15R2.94 CN1C=C(C=NC1=O)C2=CC=CC=C2 CNP0028375.0 [0,1,0,0,0,0|3,0,0]=4 36 B15R2.94 NC1=CC(=CC=C1O)C2=CC=CC=C2 CNP0492238.0 [0,1,0,0,0,0|1,0,0]=2 37 B15R2.94 NC1=CC(=CN=C1O)C2=CC=NC=C2 CNP0341076.0 [0,1,0,0,0,0|3,0,0]=4 38 B15R2.94 NC1=CC(=CNC1=O)C2=CC=NC=C2 CNP0506437.0 [0,1,0,0,0,0|3,0,0]=4 39 B15R2.94 OC1=CC=C(C=C1Br)C2=CC=CC=C2 CNP0498117.0 [0,1,0,0,0,0|1,0,0]=2 40 B15R2.94 OC1=CC=C(C=C1Cl)C2=CC=CC=C2 CNP0221972.0 [0,1,0,0,0,0|1,0,0]=2 41 B15R2.94 OC1=CC=C(C=C1O)C2=CC=CC=C2 CNP0515285.0 [0,1,0,0,0,0|1,0,0]=2 42 B15R2.308 CC1=CC=C(C=C1)C2=CC=CC=C2C CNP0588004.0 [0,1,0,0,0,0|0,0,0]=1 43 B15R2.308 CC1=CC=C(C=C1)C2=NC=CC=C2O CNP0031896.0 [0,1,0,0,0,0|1,0,0]=2 44 B15R2.308 ClC1=CC=C(C=C1)C2=CC=CC=C2Cl CNP0377835.0 [0,1,0,0,0,0|1,0,0]=2 45 B15R2.308 NC1=CC=C(C=C1)C2=NC=CC=C2O CNP0028448.0 [0,1,0,0,0,0|2,0,0]=3 46 B15R2.308 OC1=CC=C(C=C1)C2=CC=CC=C2Cl CNP0229951.0 [0,1,0,0,0,0|1,0,0]=2 47 B15R2.308 OC1=CC=C(C=C1)C2=NC=CC=C2O CNP0340805.0 [0,1,0,0,0,0|2,0,0]=3 48 B15R2.389 O=C1NC=C(C(=O)N1)C2=CC=CC=C2 CNP0530376.0 [0,1,0,0,0,0|3,0,0]=4 49 B15R2.389 OC1=CC=C(C(=C1)Cl)C2=CC=CC=C2 CNP0038611.0 [0,1,0,0,0,0|1,0,0]=2 50 B13R1.45 C=C(COC(=O)C)C1=CC=CC=C1 CNP0111069.0 [0,0,1,0,0,0|2,0,1]=4 51 B13R1.45 CC(=O)OC=C(C)C1=CC=CC=C1 CNP0052211.0 [0,0,1,0,0,0|2,0,1]=4 52 B13R1.45 CN(C)C=CC(=O)C1=CC=CC=C1 CNP0043608.0 [0,0,1,0,0,0|2,0,1]=4 53 B13R1.45 O=C(O)C=CC(=O)C1=CC=CC=C1 CNP0009522.0 [0,0,1,0,0,0|3,0,0]=4 54 B13R2.10 BrC1=CN(N=C1)C2=CC=CC=C2 CNP0443676.0 [0,0,0,0,1,0|3,0,0]=4 55 B13R2.10 CN1C=NC(=C1)C2=CC=CC=C2 CNP0068270.0 [0,0,0,0,1,0|2,0,0]=3 56 B13R2.10 C[C@@H]1C=C(N=N1)C2=CC=CC=C2 CNP0053037.1 [0,0,0,0,1,0|2,0,1]=4 57 B13R2.10 C[C@H]1C=C(N=N1)C2=CC=CC=C2 CNP0053037.2 [0,0,0,0,1,0|2,0,1]=4 58 B13R2.10 NC1=CC(=NO1)C2=CC=CC=C2 CNP0342622.0 [0,0,0,0,1,0|3,0,0]=4 59 B13R2.10 NC1=NC(=CS1)C2=CC=CC=C2 CNP0595332.0 [0,0,0,0,1,0|3,0,0]=4 60 B13R2.10 NC1=[NH+]C(=CS1)C2=CC=CC=C2 CNP0554759.0 [0,0,0,0,1,0|3,0,0]=4 61 B13R2.10 O=C1C=C(CO1)C2=CC=CC=C2 CNP0352665.0 [0,0,0,0,1,0|2,0,1]=4 62 B13R2.12 CC1=CN=C(C=N1)C2=CC=CO2 CNP0186297.0 [0,0,0,0,1,0|3,0,0]=4 63 B13R2.12 ClC1=CC=C(C=C1)C2=CN=CN2 CNP0509014.0 [0,0,0,0,1,0|3,0,0]=4 64 B13R2.12 OC1=CC=C(C=C1)N2C=CN=C2 CNP0569548.0 [0,0,0,0,1,0|3,0,0]=4 65 B15R2.29 CC1=CC=C(C=C1)CC2=CC=CC=C2 CNP0581638.0 [0,0,0,0,0,1|0,0,0]=1 66 B15R2.29 CC1=CC=C(C=C1)OC2=CC=CC=C2 CNP0282642.0 [0,0,0,0,0,1|0,0,0]=1 67 B15R2.29 CC1=CC=[N+](C=C1)CC2=CC=CC=C2 CNP0553866.0 [0,0,0,0,0,1|1,0,0]=2 68 B15R2.29 ClC1=CC=C(C=C1)C[N+]2=CC=CC=C2 CNP0541482.0 [0,0,0,0,0,1|2,0,0]=3 69 B15R2.29 N=C1C=CN(C=C1)CC2=CC=CC=C2 CNP0064022.0 [0,0,0,0,0,1|2,0,0]=3 70 B15R2.29 NC1=CC=C(C=C1)NC2=CC=CC=C2 CNP0350175.0 [0,0,0,0,0,1|1,0,0]=2 71 B15R2.29 NC1=CC=C(C=C1)NC2=NC=CC=N2 CNP0182281.0 [0,0,0,0,0,1|3,0,0]=4 72 B15R2.29 OC1=CC=C(C=C1)OC2=CC=CC=C2 CNP0103852.0 [0,0,0,0,0,1|1,0,0]=2 73 B12R1.8 CC=CC=CCC1=CC=CC=C1 CNP0076593.0 [1,0,1,0,0,0|0,0,2]=4 74 B12R1.8 O=CC=CC=CC1=CC=CC=C1 CNP0470167.0 [1,0,1,0,0,0|1,0,0]=3 75 B12R1.30 CCC=CC(=O)C1=CC=CC=C1 CNP0126866.0 [1,0,1,0,0,0|1,0,1]=4 76 B12R1.30 CNC=CC(=O)C1=CC=CC=C1 CNP0043967.0 [1,0,1,0,0,0|2,0,0]=4 77 B14R1.677 NC(=O)C=CC=CC1=CC=C(C=C1)N CNP0401788.0 [0,1,1,0,0,0|2,0,0]=4 78 B14R1.677 NC1=CC=C(C=C1)C=CC=CC(=O)O CNP0419257.0 [0,1,1,0,0,0|2,0,0]=4 79 B14R1.677 O=C(O)C=CC=CC1=CC=C(C=C1)O CNP0175962.0 [0,1,1,0,0,0|2,0,0]=4 80 B14R1.520 CC(=CC=CC1=CC=CC=C1)CCO CNP0170958.0 [0,1,1,0,0,0|0,0,2]=4 81 B14R1.6449 CC(=CC=CC1=CC=CC=C1)C(=O)O CNP0472457.0 [0,1,1,0,0,0|1,0,0]=3 82 B14R2.21 CC1=CC=CC(=C1)C2=CC=CC=C2 CNP0204278.0 [1,1,0,0,0,0|0,0,0]=2 83 B14R2.21 CC1=CC=NC(=C1)C2=CC=CN=C2 CNP0160514.0 [1,1,0,0,0,0|2,0,0]=4 84 B14R2.21 O=C1C=CC=C(O1)C2=CC=CC=C2 CNP0142954.0 [1,1,0,0,0,0|1,0,0]=3 85 B14R2.21 O=C1C=CC=C(O1)C2=CC=CN=C2 CNP0363614.0 [1,1,0,0,0,0|2,0,0]=4 86 B14R2.21 O=C1C=COC(=C1)C2=CC=CC=C2 CNP0351593.0 [1,1,0,0,0,0|1,0,0]=3 87 B14R2.21 OC1=CC=C[N+](=C1)C2=CC=CC=C2 CNP0588071.0 [1,1,0,0,0,0|1,0,0]=3 88 B14R2.24 CC1=CC=CN=C1C2=CC=CN=C2 CNP0178185.0 [1,1,0,0,0,0|2,0,0]=4 89 B14R2.24 CC1=CC=NC=C1C2=CC=CN=C2 CNP0107607.0 [1,1,0,0,0,0|2,0,0]=4 90 B14R2.24 ClC1=CC=CC=C1C2=CC=CC=C2 CNP0454475.0 [1,1,0,0,0,0|0,0,0]=2 91 B14R2.24 ClC1=NC=NC=C1C2=CC=CC=C2 CNP0066379.0 [1,1,0,0,0,0|2,0,0]=4 92 B14R2.24 NC1=CC=CC=C1C2=CC=CC=C2 CNP0028939.0 [1,1,0,0,0,0|0,0,0]=2 93 B14R2.24 OC1=CC=CC=C1C2=CC=CC=C2 CNP0248677.0 [1,1,0,0,0,0|0,0,0]=2 94 B14R2.24 OC1=CC=CN=C1C2=CC=CC=C2 CNP0051586.0 [1,1,0,0,0,0|1,0,0]=3 95 B14R2.24 [O-]C1=CC=CC=C1C2=CC=CC=C2 CNP0565402.0 [1,1,0,0,0,0|0,0,0]=2 96 B14R2.24 [O-][N+]1=CC=CC=C1C2=CC=CC=N2 CNP0605305.0 [1,1,0,0,0,0|2,0,0]=4 97 B14R2.8 BrCC1=CC(=NO1)C2=CC=CC=C2 CNP0101676.0 [0,1,0,0,1,0|2,0,0]=4 98 B14R2.8 NCC1=CC=C(O1)C2=CC=CN=C2 CNP0566808.0 [0,1,0,0,1,0|2,0,0]=4 99 B14R2.598 CC1=CC(=O)N(N1)C2=CC=CC=C2 CNP0202291.0 [0,1,0,0,1,0|2,0,0]=4 100 B14R2.598 CC1=NN(C(=C1)C)C2=CC=CC=C2 CNP0405799.0 [0,1,0,0,1,0|2,0,0]=4 101 B14R2.598 CC1=NN(C(=C1)N)C2=CC=CC=C2 CNP0220292.0 [0,1,0,0,1,0|2,0,0]=4 102 B14R2.1 COC1=CC=C(C=C1)C2=COC=N2 CNP0299864.0 [0,1,0,0,1,0|2,0,0]=4 103 B14R2.1 NCC1=CC=C(C=C1)C2=CC=CS2 CNP0507297.0 [0,1,0,0,1,0|1,0,0]=3 104 B14R2.1 O=CC1=CC=C(C=C1)C2=COC=C2 CNP0321438.0 [0,1,0,0,1,0|1,0,1]=4 105 B16R2.2 CCC1=CC=[N+](C=C1)CC2=CC=CC=C2 CNP0549540.0 [0,1,0,0,0,1|1,0,0]=3 106 B16R2.33 CC1=CC=C(C=C1)NC2=CC=C(C=C2)O CNP0350026.0 [0,1,0,0,0,1|0,0,0]=2 107 B16R2.33 CC1=CC=[N+](C=C1)CC2=CC=C(C=C2)Cl CNP0532137.0 [0,1,0,0,0,1|1,0,0]=3 108 B16R2.33 IC1=CC=C(C=C1)OC2=CC=C(C=C2)I CNP0470826.0 [0,1,0,0,0,1|1,0,0]=3 109 B16R2.33 N=C1C=CN(C=C1)CC2=CC=C(C=C2)Cl CNP0449993.0 [0,1,0,0,0,1|2,0,0]=4 110 B16R2.33 NC1=CC=C(C=C1)CC2=CC=C(C=C2)N CNP0040598.0 [0,1,0,0,0,1|1,0,0]=3 111 B16R2.33 NC1=CC=C(C=C1)OC2=CC=C(C=C2)N CNP0058712.0 [0,1,0,0,0,1|1,0,0]=3 112 B16R2.33 OC1=CC=C(C=C1)CC2=CC=C(C=C2)O CNP0301621.0 [0,1,0,0,0,1|1,0,0]=3 113 B16R2.33 OC1=CC=C(C=C1)OC2=CC=C(C=C2)O CNP0585508.0 [0,1,0,0,0,1|1,0,0]=3 114 B16R2.33 [N]=C1C=CN(C=C1)CC2=CC=C(C=C2)Cl CNP0520838.0 [0,1,0,0,0,1|2,0,0]=4 115 B16R2.120 CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2 CNP0122693.0 [0,1,0,0,0,1|0,0,0]=2 116 B16R2.120 CC1=CC=C(C=C1)[C@@H](O)C2=CC=CC=C2 CNP0327069.2 [0,1,0,0,0,1|0,0,0]=2 117 B16R2.120 CC1=CC=C(C=C1)[C@H](O)C2=CC=CC=C2 CNP0327069.1 [0,1,0,0,0,1|0,0,0]=2 118 B16R2.120 O=C(C1=CC=CC=C1)C2=CC=C(C=C2)Br CNP0113887.0 [0,1,0,0,0,1|1,0,0]=3 119 B16R2.120 O=C(C1=CC=CC=C1)C2=CC=C(C=C2)Cl CNP0250765.0 [0,1,0,0,0,1|1,0,0]=3 120 B16R2.120 O=C(C1=CC=CC=C1)C2=CC=C(C=C2)O CNP0284593.0 [0,1,0,0,0,1|1,0,0]=3 121 B16R2.120 OC(C1=CC=CC=C1)C2=CC=C(C=C2)Cl CNP0117971.0 [0,1,0,0,0,1|1,0,0]=3 122 B16R2.120 O[C@@H](C1=CC=CC=C1)C2=CC=C(C=C2)Br CNP0221276.1 [0,1,0,0,0,1|1,0,0]=3 123 B16R2.120 O[C@H](C1=CC=CC=C1)C2=CC=C(C=C2)Br CNP0221276.2 [0,1,0,0,0,1|1,0,0]=3 124 B16R2.124 CC1=CC=[N+](C=C1C)CC2=CC=CC=C2 CNP0483105.0 [0,1,0,0,0,1|1,0,0]=3 125 B16R2.124 OC1=CC=C(C=C1Cl)CC2=CC=CC=C2 CNP0017996.0 [0,1,0,0,0,1|1,0,0]=3 126 B16R2.131 CC1=CC=C(C=C1)CC2=CN=CC(=C2)O CNP0192911.0 [0,1,0,0,0,1|1,0,0]=3 127 B16R2.131 CC1=CC=CC(=C1)CN2C=CC(=N)C=C2 CNP0447873.0 [0,1,0,0,0,1|2,0,0]=4 128 B16R2.131 CC1=CC=CC(=C1)CN2C=CC(=[N])C=C2 CNP0491594.0 [0,1,0,0,0,1|2,0,0]=4 129 B16R2.131 CC1=CC=CC(=C1)SC2=CC=C(C=C2)N CNP0045105.0 [0,1,0,0,0,1|1,0,0]=3 130 B16R2.131 CC1=CC=C[N+](=C1)CC2=CC=C(C=C2)Cl CNP0595792.0 [0,1,0,0,0,1|2,0,0]=4 131 B16R2.131 CC1=CC=[N+](C=C1)CC2=CC=CC(=C2)C CNP0551585.0 [0,1,0,0,0,1|1,0,0]=3 132 B16R2.131 CC1=CC=[N+](C=C1)CC2=CC=CC(=C2)Cl CNP0502490.0 [0,1,0,0,0,1|1,0,0]=3 133 B16R2.131 N=C1C=CN(C=C1)CC2=CC=CC(=C2)Cl CNP0459504.0 [0,1,0,0,0,1|2,0,0]=4 134 B16R2.131 NC1=CC=C(C=C1)CC2=CC=CC(=C2)N CNP0031063.0 [0,1,0,0,0,1|1,0,0]=3 135 B16R2.131 NC1=CC=C(C=C1)OC2=CC=CC(=C2)N CNP0028396.0 [0,1,0,0,0,1|1,0,0]=3 136 B16R2.131 [N]=C1C=CN(C=C1)CC2=CC=CC(=C2)Cl CNP0487277.0 [0,1,0,0,0,1|2,0,0]=4 137 B16R2.312 CC1=CC=[N+](C(=C1)C)CC2=CC=CC=C2 CNP0562076.0 [0,1,0,0,0,1|1,0,0]=3 138 B16R2.312 CC1=CC=[N+](C(=C1)N)CC2=CC=CC=C2 CNP0539798.0 [0,1,0,0,0,1|1,0,0]=3 139 B16R2.1129 CC1=CC=CC=C1CN2C=CC(=N)C=C2 CNP0450404.0 [0,1,0,0,0,1|2,0,0]=4 140 B16R2.1129 CC1=CC=CC=C1CN2C=CC(=[N])C=C2 CNP0593694.0 [0,1,0,0,0,1|2,0,0]=4 141 B16R2.1129 CC1=CC=CC=[N+]1CC2=CC=C(C=C2)Cl CNP0485221.0 [0,1,0,0,0,1|2,0,0]=4 142 B16R2.1129 CC1=CC=[N+](C=C1)CC2=CC=CC=C2C CNP0543048.0 [0,1,0,0,0,1|1,0,0]=3 143 B16R2.1129 N=C1C=CN(C=C1)CC2=CC=CC=C2Cl CNP0473396.0 [0,1,0,0,0,1|2,0,0]=4 144 B16R2.1129 NC1=CC=CC=[N+]1CC2=CC=C(C=C2)Cl CNP0535040.0 [0,1,0,0,0,1|2,0,0]=4 145 B16R2.1129 OC1=CC=C(C=C1)CC2=CC=CC=C2O CNP0163060.0 [0,1,0,0,0,1|1,0,0]=3 146 B16R2.1129 OC1=CC=CC=C1OC2=CC=C(C=C2)Br CNP0340177.0 [0,1,0,0,0,1|1,0,0]=3 147 B16R2.1129 [N]=C1C=CN(C=C1)CC2=CC=CC=C2Cl CNP0563174.0 [0,1,0,0,0,1|2,0,0]=4 148 B16R2.1 COC1=CC=C(C=C1)C2=CC=CC(=O)O2 CNP0272626.0 [0,2,0,0,0,0|1,0,0]=3 149 B16R2.7 CCCC1=CC=C(C=N1)C2=CC=CC=C2 CNP0146900.0 [0,2,0,0,0,0|1,0,0]=3 150 B16R2.13 N#CC1=CC=C(C=C1)C2=CC=C(C=C2)O CNP0555817.0 [0,2,0,0,0,0|0,0,1]=3 151 B16R2.47 CCC1=CC=C(C=C1)C2=NC=CC=C2O CNP0033502.0 [0,2,0,0,0,0|1,0,0]=3 152 B16R2.47 COC1=CC=C(C=C1)C2=NC=CC=C2O CNP0564504.0 [0,2,0,0,0,0|1,0,0]=3 153 B16R2.47 COC1=CC=C(C=C1)C2=[NH+]C=CC=C2O CNP0546487.0 [0,2,0,0,0,0|1,0,0]=3 154 B16R2.85 CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2 CNP0298268.0 [0,2,0,0,0,0|0,0,0]=2 155 B16R2.85 CN(C)C1=CC=C(C=C1)C2=CC=NC=C2 CNP0393909.0 [0,2,0,0,0,0|1,0,0]=3 156 B16R2.85 O=C(O)C1=CC=C(C=C1)C2=CC=CC=C2 CNP0609043.0 [0,2,0,0,0,0|0,0,1]=3 157 B16R2.85 O=[N+]([O-])C1=CC=C(C=C1)C2=CC=CC=C2 CNP0597840.0 [0,2,0,0,0,0|1,0,0]=3 158 B16R2.85 O=[N+]([O-])C1=CC=C(C=C1)C2=CC=NC=C2 CNP0488457.0 [0,2,0,0,0,0|2,0,0]=4 159 B16R2.2279 COC1=CC=C(C=C1N)C2=CC=CC=C2 CNP0046583.0 [0,2,0,0,0,0|0,0,0]=2 160 B16R2.2857 OC1=CC=C(C=C1)C2=CC=C(C=C2Cl)O CNP0335673.0 [0,2,0,0,0,0|1,0,0]=3 161 B16R2.2864 CN1C=CC(=CC1=O)C2=CC=[N+](C=C2)C CNP0561218.0 [0,2,0,0,0,0|2,0,0]=4 162 B16R2.2859 CC1=CC=C(C=C1)C2=CC(=O)C=CC2=O CNP0542249.0 [0,2,0,0,0,0|0,0,0]=2 163 B16R2.2859 CC1=CC=C(C=C1)C2=NC(=CC=C2O)I CNP0066963.0 [0,2,0,0,0,0|1,0,0]=3 164 B16R2.2859 CC1=CC=C(C=C1)N2N=C(C=CC2=O)O CNP0472622.0 [0,2,0,0,0,0|2,0,0]=4 165 B16R2.2859 O=C1C=CC(=O)C(=C1)C2=CC=C(C=C2)Br CNP0531106.0 [0,2,0,0,0,0|1,0,0]=3 166 B16R2.2859 OC1=CC=C(C=C1)C2=CC(=CC=C2Cl)Cl CNP0199827.0 [0,2,0,0,0,0|1,0,0]=3 167 B16R2.2859 OC1=CC=C(N=C1C2=CC=C(C=C2)Cl)I CNP0505223.0 [0,2,0,0,0,0|2,0,0]=4 168 B16R2.2917 O=C1C=COC(=C1)C2=CC=C(C(=C2)O)O CNP0217777.0 [0,2,0,0,0,0|2,0,0]=4 169 B16R2.79341 OC1=CC=C(C=C1)C2=CC(=CC(=C2)O)O CNP0203210.0 [0,2,0,0,0,0|1,0,0]=3 170 B16R2.311 CC1=C(C(=CNC1=O)C2=CC=CC=C2)O CNP0511646.0 [0,2,0,0,0,0|2,0,0]=4 171 B16R2.3269 CC1=CC=C(C=C1N)C2=NC=CC=C2O CNP0527003.0 [0,2,0,0,0,0|1,0,0]=3 172 B16R2.3269 OC1=CC=C(C=C1O)C2=NC=CC=C2O CNP0589071.0 [0,2,0,0,0,0|2,0,0]=4 173 B16R2.22304 CC1=C(C(=O)C=C(O1)C2=CC=CC=C2)O CNP0533597.0 [0,2,0,0,0,0|2,0,0]=4 174 B16R2.22304 OC1=C(C=C(C=C1Br)C2=CC=CC=C2)Br CNP0515455.0 [0,2,0,0,0,0|1,0,0]=3 175 B16R2.22304 OC1=C(C=C(C=C1Cl)C2=CC=CC=C2)Cl CNP0040931.0 [0,2,0,0,0,0|1,0,0]=3 176 B16R2.33107 OC1=CC=C(C=C1)C2=C(C=CC=C2Cl)Cl CNP0299427.0 [0,2,0,0,0,0|1,0,0]=3 177 B14R2.8751 CC1=CC=C2C(=O)C=CC(=O)C2=C1 CNP0102816.0 [0,0,1,1,0,0|2,0,0]=4 178 B14R3.2 C1=CC2=C3C=CC=CC3=C2C=C1 CNP0449545.0 [1,0,0,1,0,0|0,0,0]=2 179 B16R3.2583 BrC1=CC=C2NC3=CC=CC=C3C2=C1 CNP0530956.0 [0,0,0,1,0,1|1,0,0]=3 180 B16R3.2583 BrC1=CC=C2NC3=CN=CC=C3C2=C1 CNP0245042.0 [0,0,0,1,0,1|2,0,0]=4 181 B16R3.2583 CC1=CC2=C(C=N1)CC3=CC=CC=C23 CNP0257702.0 [0,0,0,1,0,1|1,0,0]=3 182 B16R3.2583 CC1=CC=C2CC3=CC=CC=C3C2=C1 CNP0331588.0 [0,0,0,1,0,1|0,0,0]=2 183 B16R3.2583 CC1=CC=C2NC3=CC=CC=C3C2=C1 CNP0154350.0 [0,0,0,1,0,1|0,0,0]=2 184 B16R3.2583 CC1=CC=C2OC3=CC=CC=C3C2=C1 CNP0210343.0 [0,0,0,1,0,1|0,0,0]=2 185 B16R3.2583 ClC1=CC=C2NC3=CC=CC=C3C2=C1 CNP0423980.0 [0,0,0,1,0,1|1,0,0]=3 186 B16R3.2583 OC1=CC=C2CC3=CC=CC=C3C2=C1 CNP0314999.0 [0,0,0,1,0,1|1,0,0]=3 187 B16R3.2583 OC1=CC=C2NC3=CC=CN=C3C2=C1 CNP0017973.0 [0,0,0,1,0,1|2,0,0]=4 188 B16R3.2583 OC1=CC=C2OC3=CC=CC=C3C2=C1 CNP0043026.0 [0,0,0,1,0,1|1,0,0]=3 189 B16R3.2637 BrC1=CC=C2C(=C1)CC3=CC=CC=C23 CNP0115405.0 [0,1,0,1,0,0|1,0,0]=3 190 B16R3.2637 BrC1=CC=C2C(=C1)NC3=CN=CC=C23 CNP0299571.0 [0,1,0,1,0,0|2,0,0]=4 191 B16R3.2637 CC1=CC=C2C(=C1)CC3=CC=CC=C23 CNP0179803.0 [0,1,0,1,0,0|0,0,0]=2 192 B16R3.2637 CC1=CC=C2C(=C1)NC3=CC=CC=C23 CNP0305090.0 [0,1,0,1,0,0|0,0,0]=2 193 B16R3.2637 CC1=CC=C2C(=C1)OC3=CC=CC=C23 CNP0151646.0 [0,1,0,1,0,0|0,0,0]=2 194 B16R3.2637 CN1C=CC2=C3C=CC=CC3=NC2=C1 CNP0502260.0 [0,1,0,1,0,0|1,0,0]=3 195 B16R3.2637 NC1=CC=C2C(=N1)NC3=CC=CC=C23 CNP0159353.0 [0,1,0,1,0,0|2,0,0]=4 196 B16R3.2637 OC1=CC=C2C(=C1)CC3=CC=CC=C23 CNP0203564.0 [0,1,0,1,0,0|1,0,0]=3 197 B16R3.2637 OC1=CC=C2C(=C1)NC3=CC=CC=C23 CNP0364503.0 [0,1,0,1,0,0|1,0,0]=3 198 B12R1.107 CC(=CC(=O)C1=CC=CC=C1)N CNP0032196.0 [0,0,1,0,1,0|2,0,0]=4 199 B12R1.27 CC(=NO)C=CC1=CC=CC=C1 CNP0073914.0 [0,0,1,0,1,0|2,0,0]=4 200 B12R2.2 C1=CC=C(C=C1)C2=CC=CO2 CNP0542507.0 [1,0,0,0,1,0|1,0,0]=3 201 B12R2.2 C1=CC=C(C=C1)C2=CN=CN2 CNP0534648.0 [1,0,0,0,1,0|2,0,0]=4 202 B12R2.2 C1=CC=C(C=C1)C2=CN=CS2 CNP0313698.0 [1,0,0,0,1,0|2,0,0]=4 203 B12R2.2 C1=CC=C(C=C1)C2=COC=C2 CNP0103654.0 [1,0,0,0,1,0|1,0,0]=3 204 B12R2.2 C1=CC=C(C=C1)C2=CON=C2 CNP0452957.0 [1,0,0,0,1,0|2,0,0]=4 205 B12R2.2 C1=CN=CC(=C1)C2=CC=CN2 CNP0403248.0 [1,0,0,0,1,0|2,0,0]=4 206 B12R2.6 CC1=CC=C(S1)C2=CC=CS2 CNP0424788.0 [0,0,0,0,2,0|2,0,0]=4 207 B14R1.716 CC(=NO)C=CC=CC1=CC=CC=C1 CNP0315084.0 [0,0,1,0,0,1|2,0,0]=4 208 B14R2.6 C1=CC=C(C=C1)CC2=CC=CN=C2 CNP0501844.0 [1,0,0,0,0,1|1,0,0]=3 209 B14R2.6 C1=CC=C(C=C1)CC2=CC=NC=C2 CNP0350032.0 [1,0,0,0,0,1|1,0,0]=3 210 B14R2.6 C1=CC=C(C=C1)C[N+]2=CC=CC=C2 CNP0595004.0 [1,0,0,0,0,1|1,0,0]=3 211 B14R2.6 C1=CC=C(C=C1)NC2=CC=CC=C2 CNP0314112.0 [1,0,0,0,0,1|0,0,0]=2 212 B14R2.6 C1=CC=C(C=C1)OC2=CC=CC=C2 CNP0246862.0 [1,0,0,0,0,1|0,0,0]=2 213 B14R2.6 C1=CC=C(C=C1)SC2=CC=CC=C2 CNP0079993.0 [1,0,0,0,0,1|0,0,0]=2 214 B16R2.132 BrC1=CC=C(C=C1)N=NC2=CC=CC=C2 CNP0467955.0 [0,0,0,0,0,2|1,0,0]=3 215 B16R2.132 CC1=CC=C(C=C1)C=CC2=CC=CC=C2 CNP0101065.0 [0,0,0,0,0,2|0,0,0]=2 216 B16R2.132 CC1=CC=C(C=C1)N=NC2=CC=CC=C2 CNP0446224.0 [0,0,0,0,0,2|0,0,0]=2 217 B16R2.132 ClC1=CC=C(C=C1)N=NC2=CC=CC=C2 CNP0458464.0 [0,0,0,0,0,2|1,0,0]=3 218 B16R2.132 IC1=CC=C(C=C1)C=NC2=CC=CC=C2 CNP0289468.0 [0,0,0,0,0,2|1,0,0]=3 219 B16R2.132 IC1=CC=C(C=C1)N=NC2=CC=CC=C2 CNP0445621.0 [0,0,0,0,0,2|1,0,0]=3 220 B16R2.132 NC1=CC=C(C=C1)C=CC2=CC=CC=C2 CNP0063960.0 [0,0,0,0,0,2|1,0,0]=3 221 B16R2.132 NC1=CC=C(C=N1)C=CC2=CC=CC=C2 CNP0045495.0 [0,0,0,0,0,2|2,0,0]=4 222 B16R2.132 OC1=CC=C(C=C1)C=CC2=CC=CC=C2 CNP0191657.0 [0,0,0,0,0,2|1,0,0]=3 223 B16R2.132 OC1=CC=C(C=C1)C=NC2=CC=CC=C2 CNP0452655.0 [0,0,0,0,0,2|1,0,0]=3 224 B16R2.132 OC1=CC=C(C=C1)CCC2=CC=CC=C2 CNP0032748.0 [0,0,0,0,0,2|1,0,0]=3 225 B16R2.132 OC1=CC=C(C=C1)OCC2=CC=CC=C2 CNP0039331.0 [0,0,0,0,0,2|1,0,0]=3