0 B17R2.143 BrC(CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0029598.0 [0,0,0,0,0,0|1,0,1]=2 1 B17R2.143 ClB(OC1=CC=CC=C1)OC2=CC=CC=C2 CNP0166597.0 [0,0,0,0,0,0|4,0,0]=4 2 B17R2.143 N=C(NC1=CC=CC=C1)NC2=CC=CC=C2 CNP0461078.0 [0,0,0,0,0,0|3,0,0]=3 3 B17R2.143 NC(CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0440269.0 [0,0,0,0,0,0|1,0,1]=2 4 B17R2.143 O=C(CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0003188.0 [0,0,0,0,0,0|0,0,0]=0 5 B17R2.143 O=C(CC1=CC=CC=C1)NC2=CC=CC=C2 CNP0297444.0 [0,0,0,0,0,0|1,0,0]=1 6 B17R2.143 O=C(NC1=CC=CC=C1)NC2=CC=CC=C2 CNP0324035.0 [0,0,0,0,0,0|2,0,0]=2 7 B17R2.143 O=C(NC1=CC=CC=C1)NC2=NC=CC=N2 CNP0042995.0 [0,0,0,0,0,0|4,0,0]=4 8 B17R2.143 O=C(OC1=CC=CC=C1)OC2=CC=CC=C2 CNP0047945.0 [0,0,0,0,0,0|2,0,0]=2 9 B17R2.143 OC(CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0506428.0 [0,0,0,0,0,0|0,0,2]=2 10 B17R2.143 ON(CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0303270.0 [0,0,0,0,0,0|1,0,1]=2 11 B17R2.143 S=C(NC1=CC=CC=C1)NC2=CC=CC=C2 CNP0285310.0 [0,0,0,0,0,0|2,1,0]=3 12 B17R2.143 S=C(OC1=CC=CC=C1)OC2=CC=CC=C2 CNP0042325.0 [0,0,0,0,0,0|2,1,0]=3 13 B17R2.143 [O-][N+](=CC1=CC=CC=N1)CC2=CC=CC=C2 CNP0563415.0 [0,0,0,0,0,0|2,0,2]=4 14 B17R2.143 [O-][S+](CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0512086.0 [0,0,0,0,0,0|1,0,1]=2 15 B17R2.143 [O-][SH+](CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0529382.0 [0,0,0,0,0,0|1,0,1]=2 16 B16R2.2256 C(=CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0062446.0 [1,0,0,0,0,0|0,0,1]=2 17 B16R2.2256 C(=NCC1=CC=CC=C1)C2=CC=CC=C2 CNP0561622.0 [1,0,0,0,0,0|1,0,1]=3 18 B16R2.2256 C(=NNC1=CC=CC=C1)C2=CC=CC=C2 CNP0056293.0 [1,0,0,0,0,0|2,0,1]=4 19 B16R2.2256 C1=CC=C(C=C1)CCCC2=CC=CC=C2 CNP0253086.0 [1,0,0,0,0,0|0,0,1]=2 20 B16R2.2256 C1=CC=C(C=C1)CCCC2=CC=CC=N2 CNP0002935.0 [1,0,0,0,0,0|1,0,1]=3 21 B16R2.2256 C1=CC=C(C=C1)CNCC2=CC=CC=C2 CNP0440232.0 [1,0,0,0,0,0|1,0,0]=2 22 B16R2.2256 C1=CC=C(C=C1)COCC2=CC=CC=C2 CNP0366137.0 [1,0,0,0,0,0|1,0,0]=2 23 B16R2.2256 C1=CC=C(C=C1)CSCC2=CC=CC=C2 CNP0349220.0 [1,0,0,0,0,0|1,0,0]=2 24 B16R2.2256 C1=CC=C(C=C1)[Hg][OH+][Hg]C2=CC=CC=C2 CNP0589358.0 [1,0,0,0,0,0|3,0,0]=4 25 B18R2.266 CC1=CC=C(C=C1)OC(=O)CC2=CC=CC=C2 CNP0002399.0 [0,1,0,0,0,0|1,0,0]=2 26 B18R2.6478 CC1=CC=CC(=C1)OC(=O)CC2=CC=CC=C2 CNP0612136.0 [0,1,0,0,0,0|1,0,0]=2 27 B18R2.6478 O=C(NC1=CC=CC=C1)NC2=CC=NC(=C2)Cl CNP0363765.0 [0,1,0,0,0,0|3,0,0]=4 28 B18R2.7204 CN(C(=O)NC1=CC=CC=C1)C2=CC=CC=C2 CNP0167500.0 [0,1,0,0,0,0|2,0,0]=3 29 B18R2.7204 O=C(C(=S)NC1=CC=CC=C1)C2=CC=CC=C2 CNP0062120.0 [0,1,0,0,0,0|1,1,1]=4 30 B18R2.7204 O=C(CC1=CC=CC=C1)C(=O)C2=CC=CC=C2 CNP0296002.0 [0,1,0,0,0,0|0,0,1]=2 31 B18R2.7204 O[C@H](C1=CC=CC=C1)[C@@H](O)CC2=CC=CC=C2 CNP0246429.1 [0,1,0,0,0,0|0,0,2]=3 32 B18R2.32233 O=P(O)(OC1=CC=CC=C1)OC2=CC=CC=C2 CNP0293241.0 [0,1,0,0,0,0|3,0,0]=4 33 B18R2.32233 O=S(=O)(CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0090080.0 [0,1,0,0,0,0|1,0,0]=2 34 B18R3.182 CC1=C(C2=CC=CC=C2C1)C3=CC=CC=C3 CNP0052302.0 [0,0,0,1,0,0|1,0,1]=3 35 B18R3.182 CC1=C(C2=CC=CC=C2N1)C3=CC=CC=C3 CNP0428749.0 [0,0,0,1,0,0|2,0,1]=4 36 B18R3.182 O=C1CC2=CC=CC=C2N1C3=CC=CC=C3 CNP0032364.0 [0,0,0,1,0,0|1,0,0]=2 37 B18R3.2007 O=C1C(=C1C2=CC=CC=C2)C3=CC=CC=C3 CNP0338803.0 [0,0,0,1,0,0|0,0,2]=3 38 B18R3.12875 C1=CC=C(C=C1)CC2=NC3=CC=CC=C3N2 CNP0288387.0 [0,0,0,1,0,0|2,0,0]=3 39 B16R2.88 CC(=CC1=CC=CC=C1)C2=CC=CC=C2 CNP0304088.0 [0,0,0,0,1,0|1,0,1]=3 40 B16R2.88 CC(=NC1=CC=CC=C1)C2=CC=CC=C2 CNP0184062.0 [0,0,0,0,1,0|2,0,0]=3 41 B16R2.88 CC(CC1=CC=CC=C1)C2=CC=CC=C2 CNP0513188.0 [0,0,0,0,1,0|1,0,1]=3 42 B16R2.88 CN(CC1=CC=CC=C1)C2=CC=CC=N2 CNP0026027.0 [0,0,0,0,1,0|3,0,0]=4 43 B16R2.88 N[C@@H](CC1=CC=CC=N1)C2=CC=CC=C2 CNP0528451.1 [0,0,0,0,1,0|2,0,1]=4 44 B16R2.88 O=C(C[N+]1=CC=CC=C1)C2=CC=CC=C2 CNP0500863.0 [0,0,0,0,1,0|1,0,0]=2 45 B16R2.88 O=C(NC1=CC=CC=C1)C2=CC=CC=C2 CNP0026695.0 [0,0,0,0,1,0|1,0,0]=2 46 B16R2.88 O=C(OC1=CC=CC=C1)C2=CC=CC=C2 CNP0266183.0 [0,0,0,0,1,0|1,0,0]=2 47 B16R2.88 O=C(OC1=CC=CC=C1)C2=CC=CC=N2 CNP0325993.0 [0,0,0,0,1,0|2,0,0]=3 48 B16R2.88 O=C(OC1=CC=CC=C1)C2=CC=CN=C2 CNP0144946.0 [0,0,0,0,1,0|2,0,0]=3 49 B16R2.88 O=C(OC1=CC=CN=C1)C2=CC=CN=C2 CNP0568481.0 [0,0,0,0,1,0|3,0,0]=4 50 B16R2.88 S=C(NC1=CC=CC=C1)C2=CC=CC=C2 CNP0064437.0 [0,0,0,0,1,0|1,1,0]=3 51 B16R2.88 [O-][S+](SC1=CC=CC=C1)C2=CC=CC=C2 CNP0548640.0 [0,0,0,0,1,0|2,0,1]=4 52 B18R2.2429 CC(=NNC1=CC=CC=C1)CC2=CC=CC=C2 CNP0035016.0 [0,0,0,0,0,1|2,0,0]=3 53 B18R2.2429 O=C(C=CC1=CC=CC=C1)NC2=CC=CC=C2 CNP0487348.0 [0,0,0,0,0,1|1,0,1]=3 54 B18R2.2429 O=C(C=CC1=CC=CC=C1)OC2=CC=CC=C2 CNP0515763.0 [0,0,0,0,0,1|1,0,1]=3 55 B18R2.2429 O=C(C=CC1=CC=CC=C1)OC2=CC=CN=C2 CNP0536836.0 [0,0,0,0,0,1|2,0,1]=4 56 B18R2.2429 O=C(CC1=CC=CC=C1)NCC2=CC=CC=C2 CNP0510420.0 [0,0,0,0,0,1|0,0,0]=1 57 B18R2.2429 O=C(CC1=CC=CC=C1)NNC2=CC=CC=C2 CNP0182654.0 [0,0,0,0,0,1|1,0,0]=2 58 B18R2.2429 O=C(CC1=CC=CC=C1)OCC2=CC=CC=C2 CNP0071168.0 [0,0,0,0,0,1|0,0,0]=1 59 B18R2.2429 O=C(CCC1=CC=CC=C1)NC2=CC=CC=C2 CNP0071049.0 [0,0,0,0,0,1|1,0,0]=2 60 B18R2.2429 SC(=NNC1=CC=CC=C1)NC2=CC=CC=C2 CNP0102845.0 [0,0,0,0,0,1|2,1,0]=4 61 B18R2.2429 [O-][S@+](CC1=CC=CC=C1)SCC2=CC=CC=C2 CNP0498083.1 [0,0,0,0,0,1|1,0,1]=3 62 B18R2.2429 [O-][S@H+](CC1=CC=CC=C1)SCC2=CC=CC=C2 CNP0497214.1 [0,0,0,0,0,1|1,0,1]=3 63 B17R2.216 OC1=CC=C(C=C1)CC=CC2=CC=CC=C2 CNP0208649.0 [1,1,0,0,0,0|0,0,1]=3 64 B17R2.2342 C=C(CCC1=CC=CC=C1)C2=CC=CC=C2 CNP0355629.0 [1,1,0,0,0,0|0,0,2]=4 65 B17R2.2342 N=C(NCC1=CC=CC=C1)C2=CC=CC=C2 CNP0464680.0 [1,1,0,0,0,0|1,0,1]=4 66 B17R2.2342 O=C(C=CC1=CC=CC=C1)C2=CC=CC=C2 CNP0130067.0 [1,1,0,0,0,0|0,0,2]=4 67 B17R2.2342 O=C(CCC1=CC=CC=C1)C2=CC=CC=C2 CNP0110063.0 [1,1,0,0,0,0|0,0,2]=4 68 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=CC=CC=C2 CNP0158676.0 [1,1,0,0,0,0|1,0,1]=4 69 B17R2.2342 O=C(OCC1=CC=CC=C1)C2=CC=CC=C2 CNP0203743.0 [1,1,0,0,0,0|1,0,1]=4 70 B17R2.2342 ON(C=CC1=CC=CC=C1)C2=CC=CC=C2 CNP0045437.0 [1,1,0,0,0,0|1,0,1]=4 71 B17R2.2342 O[C@H](CCC1=CC=CC=C1)C2=CC=CC=C2 CNP0130502.1 [1,1,0,0,0,0|0,0,1]=3 72 B17R2.162 N#CC(=CC1=CC=CC=C1)C2=CC=CC=C2 CNP0297666.0 [0,1,0,0,1,0|1,0,1]=4 73 B17R2.162 O=CC(=CC1=CC=CC=C1)C2=CC=CC=C2 CNP0287078.0 [0,1,0,0,1,0|0,0,1]=3 74 B17R2.162 O=CC(OC1=CC=CC=C1)C2=CC=CC=C2 CNP0176169.0 [0,1,0,0,1,0|1,0,1]=4 75 B17R2.162 [C-]#[N+]C(CC1=CC=CC=C1)C2=CC=CC=C2 CNP0594920.0 [0,1,0,0,1,0|1,0,1]=4 76 B17R2.192 CC1=CC=C(C=C1)C(=O)C[N+]2=CC=CC=C2 CNP0528127.0 [0,1,0,0,1,0|1,0,0]=3 77 B17R2.192 CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2 CNP0317150.0 [0,1,0,0,1,0|1,0,0]=3 78 B17R2.192 CC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2 CNP0254956.0 [0,1,0,0,1,0|1,0,0]=3 79 B17R2.192 O=C(C[N+]1=CC=CC=C1)C2=CC=C(C=C2)Br CNP0505727.0 [0,1,0,0,1,0|1,0,0]=3 80 B17R2.192 O=C(C[N+]1=CC=CC=C1)C2=CC=C(C=C2)Cl CNP0548118.0 [0,1,0,0,1,0|1,0,0]=3 81 B17R2.192 O=C(C[N+]1=CC=CC=C1)C2=CC=C(C=C2)I CNP0551533.0 [0,1,0,0,1,0|1,0,0]=3 82 B17R2.192 O=C(OC1=CC=CC=C1)C2=COC(=O)C=C2 CNP0122508.0 [0,1,0,0,1,0|2,0,0]=4 83 B17R2.209 CC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2 CNP0220896.0 [0,1,0,0,1,0|1,0,0]=3 84 B17R2.209 CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2 CNP0295594.0 [0,1,0,0,1,0|1,0,0]=3 85 B17R2.209 CC1=CC=[N+](C=C1)CC(=O)C2=CC=CC=C2 CNP0602570.0 [0,1,0,0,1,0|1,0,0]=3 86 B17R2.209 C[N+]1=CC=C(C=C1)NC(=O)C2=CC=CC=C2 CNP0604541.0 [0,1,0,0,1,0|2,0,0]=4 87 B17R2.209 N=C1C=CN(C=C1)CC(=O)C2=CC=CC=C2 CNP0476080.0 [0,1,0,0,1,0|1,0,0]=3 88 B17R2.209 [N]=C1C=CN(C=C1)CC(=O)C2=CC=CC=C2 CNP0552425.0 [0,1,0,0,1,0|1,0,0]=3 89 B17R2.3417 NC1=CC=CC=C1C(=O)C[N+]2=CC=CC=C2 CNP0563596.0 [0,1,0,0,1,0|1,0,0]=3 90 B17R2.3417 O=C(NC1=CC=CC=C1)C2=CC=CC=C2O CNP0338858.0 [0,1,0,0,1,0|1,0,0]=3 91 B17R2.3417 O=C(NC1=CC=CC=N1)C2=CC=CC=C2Cl CNP0187145.0 [0,1,0,0,1,0|2,0,0]=4 92 B17R2.3417 O=C(OC1=CC=CC=C1)C2=CC=CC=C2Cl CNP0038821.0 [0,1,0,0,1,0|1,0,0]=3 93 B17R2.3417 O=C(OC1=CC=CC=C1)C2=CC=CC=C2O CNP0157997.0 [0,1,0,0,1,0|1,0,0]=3 94 B17R2.3426 CC1=CC=CC=[N+]1CC(=O)C2=CC=CC=C2 CNP0483384.0 [0,1,0,0,1,0|1,0,0]=3 95 B17R2.3426 NC1=CC=CC=C1NC(=O)C2=CC=CC=C2 CNP0043726.0 [0,1,0,0,1,0|1,0,0]=3 96 B17R2.3426 NC1=CC=CC=C1SC(=O)C2=CC=CC=C2 CNP0355932.0 [0,1,0,0,1,0|1,0,0]=3 97 B17R2.3426 NC1=CC=CC=[N+]1CC(=O)C2=CC=CC=C2 CNP0481595.0 [0,1,0,0,1,0|1,0,0]=3 98 B17R2.3426 O=C(C[N+]1=CC=CC=C1Br)C2=CC=CC=C2 CNP0575308.0 [0,1,0,0,1,0|1,0,0]=3 99 B17R2.3426 O=C(NC1=CC=CC=C1O)C2=CC=CC=C2 CNP0564301.0 [0,1,0,0,1,0|1,0,0]=3 100 B17R2.3426 O=C(NC1=CC=CN=C1Cl)C2=CC=CC=C2 CNP0029376.0 [0,1,0,0,1,0|2,0,0]=4 101 B17R2.3426 O=C(OC1=CC=CC=C1O)C2=CC=CC=C2 CNP0562867.0 [0,1,0,0,1,0|1,0,0]=3 102 B17R2.5273 CC1=CC=CC(=C1)C(=O)OC2=CC=CC=C2 CNP0415819.0 [0,1,0,0,1,0|1,0,0]=3 103 B17R2.5273 NC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2 CNP0398940.0 [0,1,0,0,1,0|1,0,0]=3 104 B17R2.5273 NC1=CC=CC(=C1)C(=O)OC2=CC=CC=C2 CNP0201430.0 [0,1,0,0,1,0|1,0,0]=3 105 B17R2.5293 CC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2 CNP0066007.0 [0,1,0,0,1,0|1,0,0]=3 106 B17R2.5293 CC1=CC=CC(=C1)OC(=O)C2=CC=CC=C2 CNP0555252.0 [0,1,0,0,1,0|1,0,0]=3 107 B17R2.5293 CC1=CC=C[N+](=C1)CC(=O)C2=CC=CC=C2 CNP0574104.0 [0,1,0,0,1,0|1,0,0]=3 108 B17R2.10205 BrC(=C(Br)C1=CC=CC=C1)C2=CC=CC=C2 CNP0257759.0 [0,1,0,0,1,0|1,0,1]=4 109 B17R2.10205 Br[C@H](C1=CC=CC=C1)[C@@H](Br)C2=CC=CC=C2 CNP0240344.1 [0,1,0,0,1,0|1,0,1]=4 110 B17R2.10205 CC(=C(C)C1=CC=CC=C1)C2=CC=CC=C2 CNP0074244.0 [0,1,0,0,1,0|1,0,1]=4 111 B17R2.10205 C[C@@H](C1=CC=CC=C1)[C@@H](C)C2=CC=CC=C2 CNP0065145.1 [0,1,0,0,1,0|1,0,1]=4 112 B17R2.10205 C[C@H](C1=CC=CC=C1)[C@@H](C)C2=CC=CC=C2 CNP0065145.2 [0,1,0,0,1,0|1,0,1]=4 113 B17R2.10205 C[C@H](C1=CC=CC=C1)[C@H](C)C2=CC=CC=C2 CNP0065145.3 [0,1,0,0,1,0|1,0,1]=4 114 B17R2.10205 NC(=C(N)C1=CC=CC=C1)C2=CC=CC=C2 CNP0066496.0 [0,1,0,0,1,0|1,0,1]=4 115 B17R2.10205 NC(C1=CC=CC=C1)C(Cl)C2=CC=CC=C2 CNP0045634.0 [0,1,0,0,1,0|1,0,1]=4 116 B17R2.10205 N[C@@H](C1=CC=CC=C1)[C@@H](O)C2=CC=CC=C2 CNP0445955.2 [0,1,0,0,1,0|0,0,2]=4 117 B17R2.10205 N[C@@H](C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 CNP0445955.3 [0,1,0,0,1,0|0,0,2]=4 118 B17R2.10205 N[C@H](C1=CC=CC=C1)[C@@H](O)C2=CC=CC=C2 CNP0445955.1 [0,1,0,0,1,0|0,0,2]=4 119 B17R2.10205 N[C@H](C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 CNP0445955.4 [0,1,0,0,1,0|0,0,2]=4 120 B17R2.10205 O=C(C(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0027448.0 [0,1,0,0,1,0|0,0,1]=3 121 B17R2.10205 O=C(C1=CC=CC=C1)[C@@H](O)C2=CC=CC=C2 CNP0304069.2 [0,1,0,0,1,0|0,0,0]=2 122 B17R2.10205 O=C(C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 CNP0304069.1 [0,1,0,0,1,0|0,0,0]=2 123 B17R2.10205 O[C@H](C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 CNP0038920.1 [0,1,0,0,1,0|0,0,2]=4 124 B17R2.20249 C[P@@](=O)(CC1=CC=CC=C1)C2=CC=CC=C2 CNP0052553.1 [0,1,0,0,1,0|1,0,0]=3 125 B17R2.20249 N[P@@](=O)(OC1=CC=CC=C1)C2=CC=CC=C2 CNP0276426.1 [0,1,0,0,1,0|2,0,0]=4 126 B17R2.20249 O=S(=O)(NC1=CC=CC=C1)C2=CC=CC=C2 CNP0025655.0 [0,1,0,0,1,0|2,0,0]=4 127 B19R2.286 CC1=CC=C(C=C1)NNC(=O)CC2=CC=CC=C2 CNP0386200.0 [0,1,0,0,0,1|1,0,0]=3 128 B19R2.286 O=C(CC1=CC=CC=C1)NNC2=CC=[N+](C=C2)[O-] CNP0592782.0 [0,1,0,0,0,1|2,0,0]=4 129 B19R2.3967 OCC(CC1=CC=CC=C1)NCC2=CC=CC=C2 CNP0340872.0 [0,1,0,0,0,1|0,0,2]=4 130 B19R2.4385 O=C(CC1=CC=CC(=C1)Cl)NNC2=CC=CC=C2 CNP0469913.0 [0,1,0,0,0,1|1,0,0]=3 131 B19R2.4482 CC1=CC=CC=C1CNC(=S)NC2=CC=CC=C2 CNP0025551.0 [0,1,0,0,0,1|1,1,0]=4 132 B19R2.4482 CC1=CC=CC=C1NNC(=O)CC2=CC=CC=C2 CNP0057311.0 [0,1,0,0,0,1|1,0,0]=3 133 B19R2.4482 NC1=CC=CC=C1C=CC(=O)OC2=CC=CC=C2 CNP0023306.0 [0,1,0,0,0,1|1,0,1]=4 134 B19R2.4482 O=C(CC1=CC=CC=C1)NNC2=CC=CC=C2Br CNP0246855.0 [0,1,0,0,0,1|1,0,0]=3 135 B19R2.4482 O=C(NCC1=CC=CC=C1O)NC2=CC=CC=C2 CNP0076619.0 [0,1,0,0,0,1|1,0,0]=3 136 B19R2.4485 O=C(C=CC1=CC=CC=C1)NC2=CC=CC=C2O CNP0492716.0 [0,1,0,0,0,1|1,0,1]=4 137 B19R2.7672 O=C(CC1=CC=CC=C1)NNC2=CC=CC(=C2)Cl CNP0407636.0 [0,1,0,0,0,1|1,0,0]=3 138 B19R2.8924 C[C@@H](CC1=CC=CC=C1)N(C)CC2=CC=CC=C2 CNP0487934.1 [0,1,0,0,0,1|1,0,1]=4 139 B19R2.8924 O=C(CC1=CC=CC=C1)C(=O)CC2=CC=CC=C2 CNP0254627.0 [0,1,0,0,0,1|0,0,0]=2 140 B19R2.8924 O=C(CC1=CC=CC=C1)C(=O)NC2=CC=CC=C2 CNP0017758.0 [0,1,0,0,0,1|0,0,1]=3 141 B19R2.8924 O=C(CC1=CC=CC=C1)C(O)CC2=CC=CC=C2 CNP0187028.0 [0,1,0,0,0,1|0,0,0]=2 142 B19R2.8924 O[C@@H](CC1=CC=CC=C1)[C@@H](O)CC2=CC=CC=C2 CNP0172838.1 [0,1,0,0,0,1|0,0,2]=4 143 B19R2.8924 O[C@H](CC1=CC=CC=C1)[C@@H](O)CC2=CC=CC=C2 CNP0172838.2 [0,1,0,0,0,1|0,0,2]=4 144 B19R2.8924 O[C@H](CC1=CC=CC=C1)[C@H](O)CC2=CC=CC=C2 CNP0172838.3 [0,1,0,0,0,1|0,0,2]=4 145 B19R2.8929 CN(NC(=O)CC1=CC=CC=C1)C2=CC=CC=C2 CNP0057805.0 [0,1,0,0,0,1|1,0,0]=3 146 B19R2.8929 C[C@H](CC1=CC=CC=C1)N[C@@H](C)C2=CC=CC=C2 CNP0424219.1 [0,1,0,0,0,1|1,0,1]=4 147 B19R2.8929 O=C(C[C@@H](O)C1=CC=CC=C1)OC2=CC=CC=C2 CNP0088956.1 [0,1,0,0,0,1|1,0,0]=3 148 B19R2.8929 O=C(C[C@@H](O)C1=CC=CC=C1)SC2=CC=CC=C2 CNP0052233.1 [0,1,0,0,0,1|1,0,0]=3 149 B19R2.8929 O=C(C[C@H](O)C1=CC=CC=C1)OC2=CC=CC=C2 CNP0088956.2 [0,1,0,0,0,1|1,0,0]=3 150 B19R2.8929 O=C(C[C@H](O)C1=CC=CC=C1)SC2=CC=CC=C2 CNP0052233.2 [0,1,0,0,0,1|1,0,0]=3 151 B19R2.11857 O=C(C=CC1=CC=CC=C1)OC2=CC=C(C=C2)Br CNP0591165.0 [0,1,0,0,0,1|1,0,1]=4 152 B19R2.11857 O=C(CNC1=CC=CC=C1)NC2=CC=C(C=C2)Br CNP0242286.0 [0,1,0,0,0,1|1,0,0]=3 153 B19R2.388 O=CNC(CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0043378.0 [0,2,0,0,0,0|0,0,1]=3 154 B19R2.4600 O=C(O)C(=CC1=CC=CC=C1)CC2=CC=CC=C2 CNP0453535.0 [0,2,0,0,0,0|0,0,1]=3 155 B19R2.291 CC1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)C CNP0217705.0 [0,2,0,0,0,0|1,0,0]=3 156 B19R2.291 CC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C CNP0259685.0 [0,2,0,0,0,0|2,0,0]=4 157 B19R2.291 O=C(NC1=CC=C(C=C1)Cl)NC2=CC=C(C=C2)Cl CNP0029133.0 [0,2,0,0,0,0|2,0,0]=4 158 B19R2.291 OC1=CC=C(C=C1)CC(O)CC2=CC=C(C=C2)O CNP0316812.0 [0,2,0,0,0,0|0,0,2]=4 159 B19R2.291 OC1=CC=C(C=C1)CN(O)CC2=CC=C(C=C2)O CNP0165330.0 [0,2,0,0,0,0|1,0,1]=4 160 B19R2.291 [O-][S+](CC1=CC=C(C=C1)O)CC2=CC=C(C=C2)O CNP0604742.0 [0,2,0,0,0,0|1,0,1]=4 161 B19R2.291 [O-][SH+](CC1=CC=C(C=C1)O)CC2=CC=C(C=C2)O CNP0564753.0 [0,2,0,0,0,0|1,0,1]=4 162 B19R2.3385 COC1=CC=CC=C1OC(=O)CC2=CC=CC=C2 CNP0161065.0 [0,2,0,0,0,0|1,0,0]=3 163 B19R2.4480 O=C(CC1=CC=CC=C1)C(=O)C2=CC=CC=C2O CNP0226162.0 [0,2,0,0,0,0|0,0,1]=3 164 B19R2.4384 O=C(NC1=CC=CC(=C1)Cl)NC2=CC=CC(=C2)Cl CNP0547828.0 [0,2,0,0,0,0|2,0,0]=4 165 B19R2.2265 CCN(C(=O)NC1=CC=CC=C1)C2=CC=CC=C2 CNP0228341.0 [0,2,0,0,0,0|2,0,0]=4 166 B19R2.2265 CC[C@@H](C(=O)NC1=CC=NC=C1)C2=CC=CC=C2 CNP0510766.1 [0,2,0,0,0,0|2,0,0]=4 167 B19R2.21040 CN(C(=O)N(C)C1=CC=CC=C1)C2=CC=CC=C2 CNP0315283.0 [0,2,0,0,0,0|2,0,0]=4 168 B17R3.8 C1=C(C2=CC=CC=C2C1)C3=CC=CC=C3 CNP0338133.0 [1,0,0,1,0,0|0,0,1]=3 169 B17R3.1939 C1=CC=C(C=C1)C[C@@H]2CC3=CC=CC=C23 CNP0132572.2 [1,0,0,1,0,0|0,0,1]=3 170 B17R3.1939 C1=CC=C(C=C1)C[C@H]2CC3=CC=CC=C23 CNP0132572.1 [1,0,0,1,0,0|0,0,1]=3 171 B17R3.3135 Cl[C@@]1(CC2=CC=CC=C12)C3=CC=CC=C3 CNP0036890.2 [0,0,0,1,1,0|1,0,1]=4 172 B17R3.3135 Cl[C@]1(CC2=CC=CC=C12)C3=CC=CC=C3 CNP0036890.1 [0,0,0,1,1,0|1,0,1]=4 173 B17R3.3135 O[C@@]1(CC2=CC=CC=C12)C3=CC=CC=C3 CNP0024441.2 [0,0,0,1,1,0|0,0,2]=4 174 B17R3.3135 O[C@]1(CC2=CC=CC=C12)C3=CC=CC=C3 CNP0024441.1 [0,0,0,1,1,0|0,0,2]=4 175 B17R3.8708 C1=C(CC2=CC=CC=C21)C3=CC=CC=C3 CNP0078609.0 [0,0,0,1,1,0|1,0,0]=3 176 B17R3.8708 C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2 CNP0453415.0 [0,0,0,1,1,0|1,0,1]=4 177 B17R3.8708 C1=CC=C(C=C1)[C@@H]2CC3=CC=CC=C3N2 CNP0158671.1 [0,0,0,1,1,0|1,0,1]=4 178 B17R3.8708 C1=CC=C(C=C1)[C@H]2CC3=CC=CC=C3N2 CNP0158671.2 [0,0,0,1,1,0|1,0,1]=4 179 B17R3.54615 CC1=CC2=CC=CC=C2C3=CC=CC=C13 CNP0156288.0 [0,0,0,1,1,0|1,0,1]=4 180 B17R3.54615 NC1=CC2=CC=CC=C2C3=CC=CC=C13 CNP0497814.0 [0,0,0,1,1,0|1,0,1]=4 181 B17R3.54615 O=C1NC2=CC=CC=C2C3=CC=CC=C13 CNP0348039.0 [0,0,0,1,1,0|1,0,0]=3 182 B17R3.54615 O=C1OC2=CC=CC=C2C3=CC=CC=C13 CNP0380905.0 [0,0,0,1,1,0|1,0,0]=3 183 B17R3.54615 OC1=CC2=CC=CC=C2C3=CC=CC=C13 CNP0210210.0 [0,0,0,1,1,0|0,0,2]=4 184 B19R3.288 NC1=NC2=CC=CC=C2N1CC3=CC=CC=C3 CNP0034781.0 [0,0,0,1,0,1|2,0,0]=4 185 B19R3.288 NC1=[N+](C2=CC=CC=C2S1)CC3=CC=CC=C3 CNP0591589.0 [0,0,0,1,0,1|2,0,0]=4 186 B19R3.288 O=C1CC2=CC=CC=C2N1CC3=CC=CC=C3 CNP0136478.0 [0,0,0,1,0,1|0,0,0]=2 187 B19R3.288 O=C1NC2=CC=CC=C2C1=CC3=CC=CC=C3 CNP0040865.0 [0,0,0,1,0,1|1,0,1]=4 188 B19R3.288 O=C1OC2=CC=CC=C2C1=CC3=CC=CC=C3 CNP0117304.0 [0,0,0,1,0,1|1,0,1]=4 189 B19R3.288 O=C1OC2=CC=CC=C2N1CC3=CC=CC=C3 CNP0530464.0 [0,0,0,1,0,1|1,0,0]=3 190 B19R3.288 S=C1SC2=CC=CC=C2N1CC3=CC=CC=C3 CNP0572202.0 [0,0,0,1,0,1|1,1,0]=4 191 B19R3.294 O=C1C=C(C2=CC=CC=C2N1)C3=CC=CC=C3 CNP0159514.0 [0,0,0,1,0,1|1,0,1]=4 192 B19R3.10796 O=C(NC1=CC=CC=C1)[C@@H]2CC3=CC=CC=C23 CNP0047236.2 [0,0,0,1,0,1|1,0,0]=3 193 B19R3.10796 O=C(NC1=CC=CC=C1)[C@H]2CC3=CC=CC=C23 CNP0047236.1 [0,0,0,1,0,1|1,0,0]=3 194 B19R3.19215 C1=CC=C(C=C1)CC2=CC3=CC=CC=C3C=N2 CNP0324731.0 [0,0,0,1,0,1|1,0,1]=4 195 B19R3.19215 C1=CC=C(C=C1)C[C@H]2COC3=CC=CC=C3C2 CNP0220014.1 [0,0,0,1,0,1|1,0,1]=4 196 B19R3.19255 C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3S2 CNP0040519.0 [0,0,0,1,0,1|1,1,0]=4 197 B19R3.182 O=C1C(=CC2=CC=CC=C2)CC3=CC=CC=C13 CNP0070865.0 [0,1,0,1,0,0|0,0,1]=3 198 B19R3.182 O=C1C(=NC2=CC=CC=C2)NC3=CC=CC=C13 CNP0124038.0 [0,1,0,1,0,0|2,0,0]=4 199 B19R3.291 O=C1OC2=CC=CC=C2C=C1C3=CC=CC=C3 CNP0131261.0 [0,1,0,1,0,0|1,0,1]=4 200 B19R3.291 O=C1OC2=CC=CC=C2CN1C3=CC=CC=C3 CNP0034277.0 [0,1,0,1,0,0|2,0,0]=4 201 B19R3.291 OC1CC2=CC=CC=C2OC1C3=CC=CC=C3 CNP0076017.0 [0,1,0,1,0,0|0,0,2]=4 202 B19R3.8766 CC1=NC2=CC=CC=C2[C@@]1(C)C3=CC=CC=C3 CNP0082829.2 [0,1,0,1,0,0|2,0,0]=4 203 B19R3.8766 CC1=NC2=CC=CC=C2[C@]1(C)C3=CC=CC=C3 CNP0082829.1 [0,1,0,1,0,0|2,0,0]=4 204 B19R3.8766 C[C@@H]1CC2=CC=CC=C2[C@@]1(O)C3=CC=CC=C3 CNP0152506.1 [0,1,0,1,0,0|1,0,1]=4 205 B19R3.8766 C[C@@H]1CC2=CC=CC=C2[C@]1(O)C3=CC=CC=C3 CNP0152506.2 [0,1,0,1,0,0|1,0,1]=4 206 B19R3.8766 C[C@H]1CC2=CC=CC=C2[C@@]1(O)C3=CC=CC=C3 CNP0152506.4 [0,1,0,1,0,0|1,0,1]=4 207 B19R3.8766 C[C@H]1CC2=CC=CC=C2[C@]1(O)C3=CC=CC=C3 CNP0152506.3 [0,1,0,1,0,0|1,0,1]=4 208 B19R3.17406 O=C1C(=O)N(C2=CC=CC=C12)C3=CC=CC=C3 CNP0504516.0 [0,1,0,1,0,0|1,0,1]=4 209 B15R2.2195 C(#CC1=CC=CC=C1)C2=CC=CC=C2 CNP0080044.0 [1,0,0,0,1,0|0,0,2]=4 210 B15R2.2195 C(=CC1=CC=CC=C1)C2=CC=CC=C2 CNP0176061.0 [1,0,0,0,1,0|0,0,1]=3 211 B15R2.2195 C(=NC1=CC=CC=C1)C2=CC=CC=C2 CNP0062050.0 [1,0,0,0,1,0|1,0,0]=3 212 B15R2.2195 C1=CC=C(C=C1)CCC2=CC=CC=C2 CNP0087769.0 [1,0,0,0,1,0|0,0,0]=2 213 B15R2.2195 C1=CC=C(C=C1)CNC2=CC=NC=C2 CNP0554080.0 [1,0,0,0,1,0|2,0,0]=4 214 B15R2.2195 C1=CC=C(C=C1)CNC2=CC=[NH+]C=C2 CNP0489364.0 [1,0,0,0,1,0|2,0,0]=4 215 B15R2.2195 C1=CC=C(C=C1)N=NC2=CC=CC=C2 CNP0296411.0 [1,0,0,0,1,0|2,0,0]=4 216 B15R2.2195 C1=CC=C(C=C1)NCC2=CC=CN=C2 CNP0573846.0 [1,0,0,0,1,0|2,0,0]=4 217 B15R2.2195 C1=CC=C(C=C1)SSC2=CC=CC=C2 CNP0156065.0 [1,0,0,0,1,0|2,0,0]=4 218 B15R2.2196 C1=CC=C(C=C1)CCCC2=CC=CO2 CNP0611697.0 [1,0,0,0,1,0|1,0,1]=4 219 B15R2.2226 C=C(C1=CC=CC=C1)C2=CC=CC=C2 CNP0097027.0 [0,0,0,0,2,0|1,0,0]=3 220 B15R2.2226 CN(C1=CC=CC=C1)C2=CC=CC=C2 CNP0182682.0 [0,0,0,0,2,0|2,0,0]=4 221 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=CC=C2 CNP0150241.0 [0,0,0,0,2,0|0,0,0]=2 222 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=CC=N2 CNP0223827.0 [0,0,0,0,2,0|1,0,0]=3 223 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=CN=C2 CNP0052635.0 [0,0,0,0,2,0|1,0,0]=3 224 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=NC=C2 CNP0051582.0 [0,0,0,0,2,0|1,0,0]=3 225 B15R2.2226 O=P(C1=CC=CC=C1)C2=CC=CC=C2 CNP0236022.0 [0,0,0,0,2,0|1,0,0]=3 226 B15R2.2226 [O-][S+](C1=CC=CC=C1)C2=CC=CC=C2 CNP0602314.0 [0,0,0,0,2,0|1,0,1]=4 227 B17R2.2382 C(=CC1=CC=CC=C1)C=CC2=CC=CC=C2 CNP0390064.0 [1,0,0,0,0,1|0,0,2]=4 228 B17R2.2382 C(=NCCC1=CC=CC=C1)C2=CC=CC=C2 CNP0519795.0 [1,0,0,0,0,1|0,0,2]=4 229 B17R2.2382 C1=CC=C(C=C1)CCNCC2=CC=CC=C2 CNP0503795.0 [1,0,0,0,0,1|0,0,1]=3 230 B17R2.2382 C1=CC=C(C=C1)CSSCC2=CC=CC=C2 CNP0296208.0 [1,0,0,0,0,1|1,0,0]=3 231 B17R2.2382 C1=CC=C(C=C1)NCCNC2=CC=CC=C2 CNP0041084.0 [1,0,0,0,0,1|1,0,1]=4 232 B19R2.8900 O=C(CC1=CC=CC=C1)OC=CC2=CC=CC=C2 CNP0209291.0 [0,0,0,0,0,2|0,0,1]=3 233 B19R2.8900 O=C(CC1=CC=CC=C1)OCCC2=CC=CC=C2 CNP0185180.0 [0,0,0,0,0,2|0,0,0]=2 234 B19R2.16162 O=C(C=CC1=CC=CC=C1)C=CC2=CC=CC=C2 CNP0336695.0 [0,0,0,0,0,2|0,0,2]=4 235 B19R2.16162 O=C(C=CC1=CC=CC=C1)NCC2=CC=CC=C2 CNP0242471.0 [0,0,0,0,0,2|0,0,1]=3 236 B19R2.16162 O=C(C=CC1=CC=CC=C1)NNC2=CC=CC=C2 CNP0062980.0 [0,0,0,0,0,2|1,0,1]=4 237 B19R2.16162 O=C(C=CC1=CC=CC=C1)OCC2=CC=CC=C2 CNP0218791.0 [0,0,0,0,0,2|0,0,1]=3 238 B19R2.16162 O=C(CCC1=CC=CC=C1)NNC2=CC=CC=C2 CNP0107626.0 [0,0,0,0,0,2|1,0,0]=3 239 B19R2.16162 O=C(N=NC1=CC=CC=C1)NNC2=CC=CC=C2 CNP0477507.0 [0,0,0,0,0,2|2,0,0]=4 240 B19R2.16162 O=C(NCC1=CC=CC=C1)NCC2=CC=CC=C2 CNP0571249.0 [0,0,0,0,0,2|0,0,0]=2 241 B19R2.16162 O=C(NNC1=CC=CC=C1)NNC2=CC=CC=C2 CNP0041216.0 [0,0,0,0,0,2|2,0,0]=4 242 B19R2.16162 OC(CCC1=CC=CC=C1)CCC2=CC=CC=C2 CNP0184652.0 [0,0,0,0,0,2|0,0,2]=4 243 B19R2.16162 S=C(NCC1=CC=CC=C1)NCC2=CC=CC=C2 CNP0277474.0 [0,0,0,0,0,2|0,1,0]=3 244 B19R2.16162 SC(=NCC1=CC=CC=C1)NCC2=CC=CC=C2 CNP0612135.0 [0,0,0,0,0,2|0,1,0]=3