0 B19R2.8898 CC(=NN=C(C)C1=CC=CC=C1)C2=CC=CC=C2 CNP0063631.0 [0,0,0,0,0,0|4,0,0]=4 1 B19R2.8898 CC(NNC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0574540.0 [0,0,0,0,0,0|3,0,1]=4 2 B19R2.8898 O=C(C#CC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0102829.0 [0,0,0,0,0,0|2,0,0]=2 3 B19R2.8898 O=C(C=CC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0473559.0 [0,0,0,0,0,0|2,0,0]=2 4 B19R2.8898 O=C(CCC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0063028.0 [0,0,0,0,0,0|2,0,0]=2 5 B19R2.8898 O=C(CC[C@@H](O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0157373.2 [0,0,0,0,0,0|2,0,2]=4 6 B19R2.8898 O=C(CC[C@H](O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0157373.1 [0,0,0,0,0,0|2,0,2]=4 7 B19R2.8898 O=C(CNC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0117825.0 [0,0,0,0,0,0|2,0,0]=2 8 B19R2.8898 O=C(COC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0064696.0 [0,0,0,0,0,0|1,0,0]=1 9 B19R2.8898 O=C(N=NC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0056572.0 [0,0,0,0,0,0|2,0,0]=2 10 B19R2.8898 O=C(NC[C@@H](O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0105790.1 [0,0,0,0,0,0|2,0,2]=4 11 B19R2.8898 O=C(NC[C@H](O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0105790.2 [0,0,0,0,0,0|2,0,2]=4 12 B19R2.8898 O=C(OC[C@H](O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0108802.1 [0,0,0,0,0,0|1,0,2]=3 13 B19R2.8898 O=C(OOC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0090822.0 [0,0,0,0,0,0|0,0,0]=0 14 B18R2.7189 NC(=NOCC1=CC=CC=C1)C2=CC=CC=C2 CNP0037248.0 [1,0,0,0,0,0|2,0,1]=4 15 B18R2.7189 O=C(C=CNC1=CC=CC=C1)C2=CC=CC=C2 CNP0055957.0 [1,0,0,0,0,0|3,0,0]=4 16 B18R2.7189 O=C(NCCC1=CC=CC=C1)C2=CC=CC=C2 CNP0168016.0 [1,0,0,0,0,0|2,0,1]=4 17 B18R2.7189 O=C(NOCC1=CC=CC=C1)C2=CC=CC=C2 CNP0071190.0 [1,0,0,0,0,0|1,0,1]=3 18 B18R2.7189 O=C(OCCC1=CC=CC=C1)C2=CC=CC=C2 CNP0174611.0 [1,0,0,0,0,0|1,0,1]=3 19 B20R2.10843 O=C(C=CS(=O)(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0116537.0 [0,1,0,0,0,0|3,0,0]=4 20 B20R2.15243 CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2 CNP0088537.0 [0,1,0,0,0,0|1,0,0]=2 21 B20R2.15243 O=C(COC(=O)C1=CC=C(C=C1)Br)C2=CC=CC=C2 CNP0039205.0 [0,1,0,0,0,0|1,0,0]=2 22 B20R2.15243 O=C(COC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)Br CNP0038425.0 [0,1,0,0,0,0|1,0,0]=2 23 B20R2.15243 O=C(COC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)Cl CNP0212159.0 [0,1,0,0,0,0|1,0,0]=2 24 B20R2.15243 O=C(COC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)I CNP0036991.0 [0,1,0,0,0,0|1,0,0]=2 25 B20R2.29394 C[C@@H](NC(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2 CNP0158755.1 [0,1,0,0,0,0|2,0,0]=3 26 B20R2.29394 C[C@H](NC(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2 CNP0158755.2 [0,1,0,0,0,0|2,0,0]=3 27 B20R3.3470519 O=C(C1=CC=CC=C1)N2C=C(C3=CC=CC=C23)O CNP0301548.0 [0,0,0,1,0,0|2,0,1]=4 28 B18R2.3634 CC(=CC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0611668.0 [0,0,0,0,1,0|2,0,0]=3 29 B18R2.3634 CC(OC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0213435.0 [0,0,0,0,1,0|1,0,1]=3 30 B18R2.3634 C[C@@H](NC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0027324.1 [0,0,0,0,1,0|2,0,1]=4 31 B18R2.3634 NC(=CC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0249827.0 [0,0,0,0,1,0|2,0,0]=3 32 B18R2.3634 O=C(CC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0180871.0 [0,0,0,0,1,0|1,0,0]=2 33 B18R2.3634 O=C(OC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0123116.0 [0,0,0,0,1,0|0,0,0]=1 34 B20R2.10809 NC(=NC1=CC=CC=C1)SCC(=O)C2=CC=CC=C2 CNP0060333.0 [0,0,0,0,0,1|2,1,0]=4 35 B20R2.10809 O=C(NNC(=O)C1=CC=NC=C1)NC2=CC=CC=C2 CNP0032477.0 [0,0,0,0,0,1|3,0,0]=4 36 B17R2.2382 C(=CC1=CC=CC=C1)C=CC2=CC=CC=C2 CNP0390064.0 [2,0,0,0,0,0|2,0,0]=4 37 B19R2.5666 NC1=CC=CC=C1C(=O)OCCC2=CC=CC=C2 CNP0071222.0 [1,1,0,0,0,0|1,0,1]=4 38 B19R2.5666 O=C(OCCC1=CC=CC=C1)C2=CC=CC=C2O CNP0175615.0 [1,1,0,0,0,0|1,0,1]=4 39 B19R2.11850 O=C(NC=CC1=CC=C(C=C1)O)C2=CC=CC=C2 CNP0136129.0 [1,1,0,0,0,0|2,0,0]=4 40 B19R2.201 COC(OC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0486249.0 [0,1,0,0,1,0|0,0,2]=4 41 B19R2.201 N#C[C@@H](OC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0135312.2 [0,1,0,0,1,0|1,0,1]=4 42 B19R2.201 N#C[C@H](OC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0135312.1 [0,1,0,0,1,0|1,0,1]=4 43 B19R2.201 NCC(OC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0160976.0 [0,1,0,0,1,0|1,0,1]=4 44 B19R2.201 NC[C@H](OC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0160976.1 [0,1,0,0,1,0|1,0,1]=4 45 B19R2.5647 O=C(C=C(O)C1=CC=CC=C1)C2=CC=CC=C2O CNP0341631.0 [0,1,0,0,1,0|1,0,1]=4 46 B19R2.5647 O=C(CC(=O)C1=CC=CC=C1O)C2=CC=CC=C2 CNP0350193.0 [0,1,0,0,1,0|1,0,0]=3 47 B21R2.13129 O=C(CC(=O)C1=CC=CC=C1)C(=O)NC2=CC=CC=C2 CNP0535566.0 [0,1,0,0,0,1|2,0,0]=4 48 B21R2.19002 CC1=CC=C(C=C1)C(=NOC(=O)OC2=CC=CC=C2)N CNP0070165.0 [0,1,0,0,0,1|2,0,0]=4 49 B21R2.19161 O=C(NCOC(=O)C1=CC=C(C=C1)O)C2=CC=CC=C2 CNP0066541.0 [0,1,0,0,0,1|1,0,0]=3 50 B21R2.93772 O=C(NC(=O)C1=CC=CC=C1)NC(=O)C2=CC=CC=C2 CNP0071021.0 [0,1,0,0,0,1|2,0,0]=4 51 B21R2.3546 CCC1=CC=CC(=C1)C(=O)NNC(=O)C2=CC=CC=C2 CNP0310883.0 [0,2,0,0,0,0|2,0,0]=4 52 B21R2.4729 O=C(NNC(=O)C1=CC=CC(=C1)Cl)C2=CC=CC(=C2)Cl CNP0142368.0 [0,2,0,0,0,0|2,0,0]=4 53 B21R2.19359 O=C(COC(=O)C1=CC=CC=C1)C2=CC=C(C(=C2)Cl)Cl CNP0042344.0 [0,2,0,0,0,0|1,0,0]=3 54 B21R2.107532 O=C(NNC(=O)C1=CC=CC=C1Cl)C2=CC=CC=C2Cl CNP0278904.0 [0,2,0,0,0,0|2,0,0]=4 55 B21R2.359068 CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2O CNP0581884.0 [0,2,0,0,0,0|1,0,0]=3 56 B21R2.359068 O=C(COC(=O)C1=CC=CC=C1O)C2=CC=C(C=C2)Br CNP0583159.0 [0,2,0,0,0,0|1,0,0]=3 57 B21R2.80 CCC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=CC=C2 CNP0266565.0 [0,2,0,0,0,0|2,0,0]=4 58 B21R2.80 COC1=CC=C(C=C1)C(=O)CNC(=O)C2=CC=CC=C2 CNP0107503.0 [0,2,0,0,0,0|2,0,0]=4 59 B21R2.80 COC1=CC=C(C=C1)C(=O)ON=C(N)C2=CC=CC=C2 CNP0524200.0 [0,2,0,0,0,0|2,0,0]=4 60 B21R2.19154 O=C(CC(=O)C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)Br CNP0119762.0 [0,2,0,0,0,0|2,0,0]=4 61 B21R2.19158 O=C(CC(=O)C1=CC=C(C=C1)Br)C(=O)C2=CC=CC=C2 CNP0271153.0 [0,2,0,0,0,0|2,0,0]=4 62 B21R2.19410 CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)Br CNP0052746.0 [0,2,0,0,0,0|1,0,0]=3 63 B21R2.19410 O=C(COC(=O)C1=CC=C(C=C1)Br)C2=CC=C(C=C2)Br CNP0065364.0 [0,2,0,0,0,0|1,0,0]=3 64 B21R2.19410 O=C(COC(=O)C1=CC=C(C=C1)Br)C2=CC=C(C=C2)Cl CNP0045276.0 [0,2,0,0,0,0|1,0,0]=3 65 B21R2.19410 O=C(COC(=O)C1=CC=C(C=C1)Br)C2=CC=C(C=C2)I CNP0442068.0 [0,2,0,0,0,0|1,0,0]=3 66 B21R2.19410 O=C(NNC(=O)C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl CNP0044029.0 [0,2,0,0,0,0|2,0,0]=4 67 B21R2.40171 CN(C(=O)C1=CC=CC=C1)N(C)C(=O)C2=CC=CC=C2 CNP0392279.0 [0,2,0,0,0,0|2,0,0]=4 68 B19R3.2487 O=C(C1=CC=CC=C1)N2C=CC3=CC=CC=C23 CNP0360495.0 [1,0,0,1,0,0|2,0,0]=4 69 B19R3.17443 O=C1OC(=CC2=CC=CC=C2)C3=CC=CC=C13 CNP0597906.0 [1,0,0,1,0,0|1,0,0]=3 70 B19R3.17443 O=C1O[C@@H](C2=CC=CC=C12)SC3=CC=CC=C3 CNP0048873.2 [1,0,0,1,0,0|2,0,0]=4 71 B19R3.17443 O=C1O[C@H](C2=CC=CC=C12)SC3=CC=CC=C3 CNP0048873.1 [1,0,0,1,0,0|2,0,0]=4 72 B19R3.9171 O=C1C=C(OC2=CC=CC=C12)C3=CC=CC=C3 CNP0216699.0 [0,0,0,1,1,0|1,0,1]=4 73 B19R3.9171 O=C1NC(=NC2=CC=CC=C12)C3=CC=CC=C3 CNP0506712.0 [0,0,0,1,1,0|2,0,0]=4 74 B19R3.9171 O=C1OC(=CC2=CC=CC=C12)C3=CC=CC=C3 CNP0192915.0 [0,0,0,1,1,0|1,0,0]=3 75 B19R3.9171 O=C1OC(=CC2=CC=NC=C12)C3=CC=CC=C3 CNP0000053.0 [0,0,0,1,1,0|2,0,0]=4 76 B19R3.9171 O=C1O[C@@H](CC2=CC=CC=C12)C3=CC=CC=C3 CNP0398432.1 [0,0,0,1,1,0|1,0,1]=4 77 B19R3.9171 O=C1O[C@H](CC2=CC=CC=C12)C3=CC=CC=C3 CNP0398432.2 [0,0,0,1,1,0|1,0,1]=4 78 B21R3.4959518 O=C(O[C@@H]1OC(=O)C2=CC=CC=C12)C3=CC=CC=C3 CNP0044979.2 [0,0,0,1,0,1|0,0,0]=2 79 B21R3.4959518 O=C(O[C@H]1OC(=O)C2=CC=CC=C12)C3=CC=CC=C3 CNP0044979.1 [0,0,0,1,0,1|0,0,0]=2 80 B17R2.2342 O=C(C=CC1=CC=CC=C1)C2=CC=CC=C2 CNP0130067.0 [1,0,0,0,1,0|1,0,0]=3 81 B17R2.2342 O=C(CCC1=CC=CC=C1)C2=CC=CC=C2 CNP0110063.0 [1,0,0,0,1,0|1,0,1]=4 82 B17R2.2342 O=C(COC1=CC=CC=C1)C2=CC=CC=C2 CNP0144344.0 [1,0,0,0,1,0|1,0,0]=3 83 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=CC=CC=C2 CNP0158676.0 [1,0,0,0,1,0|1,0,1]=4 84 B17R2.2342 O=C(NNC1=CC=CC=C1)C2=CC=CC=C2 CNP0062407.0 [1,0,0,0,1,0|2,0,0]=4 85 B17R2.2342 O=C(OCC1=CC=CC=C1)C2=CC=CC=C2 CNP0203743.0 [1,0,0,0,1,0|0,0,1]=3 86 B17R2.2342 O=C(OCC1=CC=CC=C1)C2=CC=CN=C2 CNP0104003.0 [1,0,0,0,1,0|1,0,1]=4 87 B17R2.10205 BrC(=C(Br)C1=CC=CC=C1)C2=CC=CC=C2 CNP0257759.0 [0,0,0,0,2,0|2,0,0]=4 88 B17R2.10205 CC(=C(C)C1=CC=CC=C1)C2=CC=CC=C2 CNP0074244.0 [0,0,0,0,2,0|2,0,0]=4 89 B17R2.10205 NC(=C(N)C1=CC=CC=C1)C2=CC=CC=C2 CNP0066496.0 [0,0,0,0,2,0|2,0,0]=4 90 B17R2.10205 O=C(C(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0027448.0 [0,0,0,0,2,0|0,0,0]=2 91 B17R2.10205 O=C(C1=CC=CC=C1)[C@@H](O)C2=CC=CC=C2 CNP0304069.2 [0,0,0,0,2,0|0,0,2]=4 92 B17R2.10205 O=C(C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 CNP0304069.1 [0,0,0,0,2,0|0,0,2]=4 93 B19R2.8899 O=C(OCC=CC1=CC=CC=C1)C2=CC=CC=C2 CNP0364935.0 [1,0,0,0,0,1|1,0,0]=3 94 B19R2.8900 O=C(CC1=CC=CC=C1)OC=CC2=CC=CC=C2 CNP0209291.0 [1,0,0,0,0,1|1,0,0]=3 95 B19R2.8900 O=C(CC1=CC=CC=C1)OCCC2=CC=CC=C2 CNP0185180.0 [1,0,0,0,0,1|1,0,1]=4 96 B21R2.13163 O=C(CC1=CC=CC=C1)SSC(=O)CC2=CC=CC=C2 CNP0027945.0 [0,0,0,0,0,2|0,2,0]=4 97 B21R2.13163 O=C(CCC(=O)OC1=CC=CC=C1)OC2=CC=CC=C2 CNP0134943.0 [0,0,0,0,0,2|2,0,0]=4 98 B21R2.13163 O=C(NNC(=O)OC1=CC=CC=C1)OC2=CC=CC=C2 CNP0565544.0 [0,0,0,0,0,2|2,0,0]=4 99 B21R2.13150 O=C(NC=CNC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0146500.0 [0,0,0,0,0,2|2,0,0]=4 100 B21R2.13150 O=C(NCCNC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0071055.0 [0,0,0,0,0,2|2,0,0]=4 101 B21R2.13150 O=C(NCCOC(=O)C1=CC=CC=C1)C2=CC=CC=C2 CNP0100245.0 [0,0,0,0,0,2|1,0,0]=3