0 B14R2.203 CC1=CC=C2C=CC=CC2=C1CCl 5961AF [0,0,0,0,0,0|2,0,0]=2 1 B14R2.203 O=CC1=C(Cl)N=CC2=CC=CC=C21 X9414 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.203 O=CC1=C2C=CC=CC2=CC=C1Br 2457AB [0,0,0,0,0,0|2,0,1]=3 3 B13R2.32 CC1=C(Br)C2=C(C=C1)C=NC=C2 2405AA [1,0,0,0,0,0|3,0,0]=4 4 B13R2.32 CC1=C(Br)C2=CC=CC=C2C=N1 2705AJ [1,0,0,0,0,0|3,0,0]=4 5 B13R2.32 CC1=C(C)C2=NC=CC=C2C=C1 V4250 [1,0,0,0,0,0|2,0,0]=3 6 B13R2.32 CC1=C(Cl)C2=CC=CC=C2N=C1 9598AB [1,0,0,0,0,0|3,0,0]=4 7 B13R2.32 CC1=C(N)C2=CC=CN=C2C=C1 4399AE [1,0,0,0,0,0|2,0,0]=3 8 B13R2.32 CC1=C(N)C=NC2=CC=CC=C21 Y9270 [1,0,0,0,0,0|2,0,0]=3 9 B13R2.32 CC1=CC=C2C=CC=NC2=C1C Z8420 [1,0,0,0,0,0|2,0,0]=3 10 B13R2.32 CN1C=CC2=C(C=CC=C2)C1=O 6318AB [1,0,0,0,0,0|3,0,0]=4 11 B13R2.32 ClC1=C(Cl)C2=CN=CC=C2C=C1 W7379 [1,0,0,0,0,0|3,0,0]=4 12 B13R2.32 ClC1=C(Cl)C2=NC=CC=C2C=C1 V7389 [1,0,0,0,0,0|3,0,0]=4 13 B13R2.32 ClC1=C2C=CC=CC2=NC=C1Br 1586AC [1,0,0,0,0,0|3,0,0]=4 14 B13R2.32 FC1=C(Cl)C=CC2=CC=CN=C21 X9050 [1,0,0,0,0,0|3,0,0]=4 15 B13R2.32 NC1=C(Br)C=NC2=CC=CC=C21 W5793 [1,0,0,0,0,0|2,0,0]=3 16 B13R2.32 NC1=C(Br)N=CC2=CC=CC=C21 W6046 [1,0,0,0,0,0|2,0,0]=3 17 B13R2.32 NC1=C(Cl)C2=CC=NC=C2C=C1 8299AB [1,0,0,0,0,0|3,0,0]=4 18 B13R2.32 NC1=C(Cl)C=CC2=C1N=CC=C2 9652AB [1,0,0,0,0,0|2,0,0]=3 19 B13R2.32 NC1=C(Cl)N=CC2=CC=CC=C21 W5578 [1,0,0,0,0,0|2,0,0]=3 20 B13R2.32 NC1=C2C=CC=CC2=CC=C1O D097 [1,0,0,0,0,0|0,0,0]=1 21 B13R2.32 NC1=C2C=CN=CC2=CC=C1Br 3124AC [1,0,0,0,0,0|2,0,0]=3 22 B13R2.32 NC1=CC=C2C=NC=CC2=C1Br 8298AB [1,0,0,0,0,0|3,0,0]=4 23 B13R2.32 O=C1C(I)=COC2=CC=CC=C12 5346AH [1,0,0,0,0,0|3,0,0]=4 24 B13R2.32 OC1=C(Br)C2=CC=CC=C2C=N1 4705AB [1,0,0,0,0,0|2,0,0]=3 25 B13R2.32 OC1=C(Br)C=CC2=C1N=CC=C2 0939AQ [1,0,0,0,0,0|3,0,0]=4 26 B13R2.32 OC1=C2N=CC=CC2=CC=C1Cl 3933AC [1,0,0,0,0,0|3,0,0]=4 27 B13R2.32 OC1=C2N=CC=CC2=CC=C1F 4287AB [1,0,0,0,0,0|3,0,0]=4 28 B13R2.32 OC1=CC=C2C=CC=CC2=C1O 4452AL [1,0,0,0,0,0|1,0,0]=2 29 B13R2.1613 BrCC1=CC=CC2=C1C=CN=C2 Y7674 [1,0,0,0,0,0|2,0,0]=3 30 B13R2.1613 BrCC1=CC=CC2=C1C=CN=C2 Z4911 [1,0,0,0,0,0|2,0,0]=3 31 B13R2.1613 C=CC1=C2C=CC=CC2=CC=C1 Z5159 [1,0,0,0,0,0|1,0,1]=3 32 B13R2.1613 CCC1=NC=CC2=CC=CC=C21 1932AC [1,0,0,0,0,0|2,0,0]=3 33 B13R2.1613 COC1=C2C=CC=CC2=NC=C1 V6874 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.1613 COC1=C2C=CN=CC2=CC=C1 6377AJ [1,0,0,0,0,0|3,0,0]=4 35 B13R2.1613 COC1=C2C=NC=CC2=CC=C1 V3770 [1,0,0,0,0,0|3,0,0]=4 36 B13R2.1613 COC1=CC=CC2=C1C=CN=C2 W9338 [1,0,0,0,0,0|3,0,0]=4 37 B13R2.1613 ClCC1=C2C=CC=CC2=NC=C1 X5546 [1,0,0,0,0,0|2,0,0]=3 38 B13R2.1613 ClCC1=NC=CC2=CC=CC=C21 9522AH [1,0,0,0,0,0|2,0,0]=3 39 B13R2.1613 N#CC1=CC=CC2=C1C=CC=N2 Y9569 [1,0,0,0,0,0|1,0,2]=4 40 B13R2.1613 N#CC1=CC=NC2=CC=CC=C12 4487AJ [1,0,0,0,0,0|1,0,2]=4 41 B13R2.1613 NCC1=C2C=CC=CC2=CN=C1 Y9536 [1,0,0,0,0,0|1,0,0]=2 42 B13R2.1613 NCC1=C2C=CN=CC2=CC=C1 4160AJ [1,0,0,0,0,0|1,0,0]=2 43 B13R2.1613 NCC1=C2N=CC=CC2=CC=C1 4486AJ [1,0,0,0,0,0|1,0,0]=2 44 B13R2.1613 NCC1=CC=CC2=C1C=CC=N2 X9317 [1,0,0,0,0,0|1,0,0]=2 45 B13R2.1613 NCC1=CC=CC2=C1C=CC=N2 Y9537 [1,0,0,0,0,0|1,0,0]=2 46 B13R2.1613 NNC1=C2C=CC=CC2=CC=N1 Y7667 [1,0,0,0,0,0|2,0,0]=3 47 B13R2.1613 NNC1=CC=NC2=C1C=CC=C2 8119AE [1,0,0,0,0,0|2,0,0]=3 48 B13R2.1613 NNC1=NC=NC2=C1C=CC=C2 1602AE [1,0,0,0,0,0|3,0,0]=4 49 B13R2.1613 OCC1=CC=CC2=CC=CN=C21 8082AA [1,0,0,0,0,0|2,0,0]=3 50 B13R2.1613 OCC1=CC=NC2=CC=CC=C12 4485AJ [1,0,0,0,0,0|2,0,0]=3 51 B15R2.2115 COC1=C(CN)C2=CC=CC=C2C=C1 3970AD [0,1,0,0,0,0|0,0,0]=1 52 B15R2.2115 N#CC1=C(C#N)C2=C(C=CC=C2)C=C1 4472AL [0,1,0,0,0,0|1,0,2]=4 53 B15R3.1739 C1=CC=C2C(=C1)C=CC3=C2NC=C3 0713AQ [0,0,0,1,0,0|3,0,0]=4 54 B13R2.135 CC1=C(CN)N2C=CC=CC2=N1 4213AH [0,0,0,0,1,0|3,0,0]=4 55 B13R2.135 NCC1C(=O)NC2=C1C=CC=C2 3127AA [0,0,0,0,1,0|1,0,2]=4 56 B13R2.135 NCC1C(=O)NC2=C1C=CC=C2 5666AB [0,0,0,0,1,0|1,0,2]=4 57 B13R2.135 NNC1=C2C=CC=CC2=NC1=O 7999AD [0,0,0,0,1,0|2,0,1]=4 58 B12R1.478 NCC(C(=O)O)C1=CC=CC=C1 6032AB [1,0,1,0,0,0|1,0,1]=4 59 B12R1.478 NC[C@H](C(=O)O)C1=CC=CC=C1 0283AA [1,0,1,0,0,0|1,0,1]=4 60 B12R2.24 ClC1=CC=C2N=CC=CC2=C1 V6583 [2,0,0,0,0,0|2,0,0]=4 61 B12R2.24 FC1=CC2=CN=CC=C2C=C1 Y5168 [2,0,0,0,0,0|2,0,0]=4 62 B12R2.24 FC1=CC=C2C=CC=CC2=C1 Z3465 [2,0,0,0,0,0|1,0,0]=3 63 B12R2.24 FC1=CC=C2N=CC=CC2=C1 V5066 [2,0,0,0,0,0|2,0,0]=4 64 B12R2.24 IC1=CC=C2C=NC=CC2=C1 Y4007 [2,0,0,0,0,0|2,0,0]=4 65 B12R2.24 NC1=CC2=NC=CC=C2C=C1 6474AJ [2,0,0,0,0,0|2,0,0]=4 66 B12R2.24 S=C1C=CC2=CC=CC=C2N1 0779AQ [2,0,0,0,0,0|1,1,0]=4 67 B12R2.1081 BrC1=C2C=CC=CC2=CC=N1 W3339 [2,0,0,0,0,0|2,0,0]=4 68 B12R2.1081 CC1=C2C=NC=CC2=CC=C1 9522AB [2,0,0,0,0,0|1,0,0]=3 69 B12R2.1081 CC1=CC=CC2=C1N=NC=C2 7445AB [2,0,0,0,0,0|2,0,0]=4 70 B12R2.1081 FC1=C2N=CC=CC2=CC=C1 V5067 [2,0,0,0,0,0|2,0,0]=4 71 B12R2.1081 FC1=CC=NC2=CC=CC=C12 2411AE [2,0,0,0,0,0|2,0,0]=4 72 B12R2.1081 FC1=CC=NC2=CC=CC=C12 3029AD [2,0,0,0,0,0|2,0,0]=4 73 B12R2.1081 IC1=C2C=CC=CC2=CC=N1 Y5331 [2,0,0,0,0,0|2,0,0]=4 74 B12R2.1081 NC1=C2C=NC=CC2=NC=C1 9646AH [2,0,0,0,0,0|2,0,0]=4 75 B12R2.1081 NC1=C2C=NC=CC2=NC=C1 9647AH [2,0,0,0,0,0|2,0,0]=4 76 B12R2.1081 NC1=CC=CC2=C1C=NC=C2 4162AJ [2,0,0,0,0,0|1,0,0]=3 77 B12R2.1081 NC1=CC=CC2=CN=CN=C12 0383AA [2,0,0,0,0,0|2,0,0]=4 78 B12R2.1081 NC1=NC=CC2=C1C=NC=C2 2546AB [2,0,0,0,0,0|2,0,0]=4 79 B12R2.1081 NC1=NC=CC2=CC=CN=C21 9270AH [2,0,0,0,0,0|2,0,0]=4 80 B12R2.1081 NC1=NC=CC2=NC=CC=C12 8112AB [2,0,0,0,0,0|2,0,0]=4 81 B12R2.1081 O=C1NC=CC2=CC=CC=C12 6656AB [2,0,0,0,0,0|2,0,0]=4 82 B12R2.1081 OC1=CN=CC2=C1C=CC=C2 7709AA [2,0,0,0,0,0|2,0,0]=4 83 B12R2.1081 SC1=CC=CC2=C1N=CC=C2 F630 [2,0,0,0,0,0|2,0,0]=4 84 B14R2.92 COC1=C(F)C2=C(C=C1)N=CC=C2 4088AC [1,1,0,0,0,0|2,0,0]=4 85 B14R2.92 COC1=C(I)C2=CC=CC=C2C=C1 3687AB [1,1,0,0,0,0|1,0,0]=3 86 B14R2.92 NC1=C2N=CC=CC2=CC=C1C=O 7974AA [1,1,0,0,0,0|1,0,1]=4 87 B14R2.4513 O=C1C=CC2=C(O1)C(O)=C(O)C=C2 V0328 [1,1,0,0,0,0|2,0,0]=4 88 B14R2.7724 CN1C(=O)C=C(Br)C2=CC=CC=C21 6064AC [1,1,0,0,0,0|1,0,1]=4 89 B14R2.7724 OC1=C2C=CC=CC2=C(Br)C=C1Br 5796AF [1,1,0,0,0,0|2,0,0]=4 90 B14R2.8038 CC1=C(C)C2=C(C=C1)C(Cl)=CC=N2 2787AJ [1,1,0,0,0,0|2,0,0]=4 91 B14R2.8038 CC1=C(Cl)C=CC2=C(Cl)C=CN=C12 V7088 [1,1,0,0,0,0|2,0,0]=4 92 B14R2.8038 CC1=CC=C2C(N)=CC=NC2=C1C 2641AJ [1,1,0,0,0,0|2,0,0]=4 93 B14R2.8188 CC1=C(Br)C(=O)NC2=CC=CC=C21 1973AE [1,1,0,0,0,0|2,0,0]=4 94 B14R2.8188 CC1=C(Cl)C(=O)NC2=C1C=CC=C2 6864AB [1,1,0,0,0,0|2,0,0]=4 95 B14R2.8188 CC1=C(F)C(=O)NC2=C1C=CC=C2 0218AB [1,1,0,0,0,0|2,0,0]=4 96 B14R2.8188 CC1=C(O)C(Br)=C2C=CC=CC2=N1 X3328 [1,1,0,0,0,0|2,0,0]=4 97 B14R2.29369 NC1=C(Cl)C=CC2=NC(Cl)=CC=C21 W7317 [1,1,0,0,0,0|2,0,0]=4 98 B14R2.29369 OC1=C(F)C2=C(C=C1)C=C(Br)C=C2 6093AB [1,1,0,0,0,0|1,0,0]=3 99 B14R2.1078 CCC1=CC=CC2=C(Cl)C=CN=C12 2792AJ [1,1,0,0,0,0|2,0,0]=4 100 B14R2.1078 COC1=CC=CC2=C1C=CC=C2N 2937AL [1,1,0,0,0,0|2,0,0]=4 101 B14R2.1078 COC1=CC=CC2=C1C=CC=C2O 2938AL [1,1,0,0,0,0|2,0,0]=4 102 B14R2.1078 NCC1=CC=NC2=C(Br)C=CC=C12 X6491 [1,1,0,0,0,0|1,0,0]=3 103 B14R2.1078 OCC1=C2C=CC=C(Br)C2=NC=C1 X6493 [1,1,0,0,0,0|2,0,0]=4 104 B14R2.1131 COC1=C2C=CC=CC2=C(N)C=C1 V3648 [1,1,0,0,0,0|2,0,0]=4 105 B14R2.1131 FC1=CC=C(CCl)C2=CC=CC=C12 3026AH [1,1,0,0,0,0|1,0,0]=3 106 B14R2.1131 NCC1=C2C=CC=CC2=C(Br)C=C1 V6739 [1,1,0,0,0,0|0,0,0]=2 107 B14R2.1131 NNC1=C2C=CC=CC2=C(Br)C=C1 V4109 [1,1,0,0,0,0|1,0,0]=3 108 B14R2.1131 OC1=CC=C(CCl)C2=C1N=CC=C2 Y6794 [1,1,0,0,0,0|2,0,0]=4 109 B14R2.1131 OCC1=C2C=CC=CC2=C(Br)C=C1 V6624 [1,1,0,0,0,0|1,0,0]=3 110 B14R2.1146 CC1=NC2=CC=CC=C2C(CBr)=C1 3558AC [1,1,0,0,0,0|2,0,0]=4 111 B14R2.1146 CC1=NC2=CC=CC=C2C(CCl)=C1 2877AB [1,1,0,0,0,0|2,0,0]=4 112 B14R2.1146 CC1=NC2=CC=CC=C2C(NN)=C1 6724AB [1,1,0,0,0,0|2,0,0]=4 113 B14R2.7150 BrCCC1=CC=CC2=CC=CC=C21 0982AQ [1,1,0,0,0,0|1,0,0]=3 114 B14R2.7150 N#CCC1=C2N=CC=CC2=CC=C1 X1011 [1,1,0,0,0,0|1,0,1]=4 115 B14R2.7150 NCCC1=CC=CC2=CC=CC=C21 0447AQ [1,1,0,0,0,0|0,0,0]=2 116 B14R2.31359 CC(C)C1=C2C=CC=CC2=CC=C1 4889AL [1,1,0,0,0,0|1,0,0]=3 117 B14R2.31359 CC(C)C1=NC=CC2=CC=CC=C21 0695AB [1,1,0,0,0,0|2,0,0]=4 118 B14R2.31359 C[C@@H](O)C1=CC=CC2=CC=CC=C21 5815AB [1,1,0,0,0,0|1,0,0]=3 119 B14R2.31359 NC(=O)C1=C2C=CC=CC2=NC=C1 Y5433 [1,1,0,0,0,0|1,0,1]=4 120 B14R2.31359 NC(=O)C1=NC=CC2=C1C=CC=C2 9902AH [1,1,0,0,0,0|1,0,1]=4 121 B14R2.31359 NC(=S)C1=C2C=CC=CC2=NC=C1 Y5541 [1,1,0,0,0,0|1,0,1]=4 122 B14R2.31359 NC(=S)C1=C2N=CC=CC2=CC=C1 Y9640 [1,1,0,0,0,0|1,0,1]=4 123 B14R2.517 CC1=C(CCN)C2=C(C=CC=C2)N1 Z5204 [0,1,0,0,1,0|2,0,0]=4 124 B14R2.517 CC1=C(CCN)C2=CC=CC=C2N1 2757AB [0,1,0,0,1,0|2,0,0]=4 125 B14R2.517 CC1=CC2=C(C=CC=C2)N1CCN Y4469 [0,1,0,0,1,0|2,0,0]=4 126 B14R2.19306 CN1C(Cl)=C(CN)C2=C1C=CC=C2 8026AC [0,1,0,0,1,0|2,0,0]=4 127 B16R2.2073 COC1=CC=C2C=CC=CC2=C1C(=N)N 1770AJ [0,2,0,0,0,0|0,0,1]=3 128 B16R2.34040 NNC(=O)C1=C(O)C=CC2=C1C=CC=C2 8734AE [0,2,0,0,0,0|0,0,1]=3 129 B16R2.333 O=C(O)CC1=C2C=CC=CC2=CC=C1O 7990AC [0,2,0,0,0,0|1,0,0]=3 130 B16R2.30013 N#CCCC1=C(O)C=CC2=C1C=CC=C2 4271AD [0,2,0,0,0,0|0,0,1]=3 131 B14R2.112 NCCC1=CC2=C(C=CC=C2)C=C1 1063AJ [0,0,1,1,0,0|1,0,1]=4 132 B14R2.112 NCCC1=NC2=C(C=CC=C2)C=C1 0946AA [0,0,1,1,0,0|1,0,1]=4 133 B14R2.24 OC1=C(C2=CC=CC=C2)N=CC=C1 3776AB [0,0,1,1,0,0|2,0,0]=4 134 B12R2.18 CC1=C(C)C2=C(C=CC=C2)O1 4843AB [1,0,0,0,1,0|2,0,0]=4 135 B12R2.82 CC1=C2NC=CC2=CC=C1Br 0054AA [1,0,0,0,1,0|2,0,0]=4 136 B12R2.1 BrCC1=CSC2=C1C=CC=C2 2251AL [1,0,0,0,1,0|2,0,0]=4 137 B12R2.1 CCN1C=CC2=CC=CC=C21 1334AA [1,0,0,0,1,0|2,0,0]=4 138 B12R2.1 NCC1=C2C=CC=CN2N=C1 4337AH [1,0,0,0,1,0|2,0,0]=4 139 B12R2.1 NCC1=C2C=CC=CN2N=C1 4467AJ [1,0,0,0,1,0|2,0,0]=4 140 B12R2.1 NCC1=CN=C2C=CC=CN12 4075AB [1,0,0,0,1,0|2,0,0]=4 141 B12R2.1 NCC1=CSC2=CC=CC=C12 Y9464 [1,0,0,0,1,0|1,0,0]=3 142 B12R2.1 NCC1=NNC2=C1C=CC=C2 W8549 [1,0,0,0,1,0|2,0,0]=4 143 B12R2.1 NCC1=NNC2=CC=CC=C21 4191AH [1,0,0,0,1,0|2,0,0]=4 144 B12R2.1 OCC1=COC2=CC=CC=C12 6401AB [1,0,0,0,1,0|2,0,0]=4 145 B12R2.315 BrCC1=C2SC=CC2=CC=C1 Y6789 [1,0,0,0,1,0|2,0,0]=4 146 B12R2.315 NCC1=C2OC=NC2=CC=C1 0126AP [1,0,0,0,1,0|2,0,0]=4