0 B17R2.3417 CC1=CCC=CC1C(=O)Nc2ccccc2 WXVL_AG00183SB0380 [0,0,0,0,0,0|2,0,2]=4 1 B17R2.3417 CC1=CCC=CC1C(=O)Nc2ccccc2 WXVL_AG00183SB0380 [0,0,0,0,0,0|2,0,2]=4 2 B17R2.3417 CN1CCCC[C@@H]1C(=O)Nc2ccccc2 WXVL_AG00183SB4055 [0,0,0,0,0,0|3,0,1]=4 3 B17R2.3417 CN1CCCC[C@@H]1C(=O)Nc2ccccc2 WXVL_AG00183SB4055 [0,0,0,0,0,0|3,0,1]=4 4 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 WXVL_AG00183SD0037 [0,0,0,0,0,0|2,0,2]=4 5 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 WXVL_AG00183SD0037 [0,0,0,0,0,0|2,0,2]=4 6 B17R2.3417 Cc1cccnc1C(=O)Nc2ccccc2 WXVL_AG00183SC0008 [0,0,0,0,0,0|2,0,2]=4 7 B17R2.3417 Cc1cccnc1C(=O)Nc2ccccc2 WXVL_AG00183SC0008 [0,0,0,0,0,0|2,0,2]=4 8 B17R2.3417 Cc1ccncc1C(=O)Nc2ccccc2 WXVL_AG00183SC0301 [0,0,0,0,0,0|3,0,1]=4 9 B17R2.3417 Cc1ccncc1C(=O)Nc2ccccc2 WXVL_AG00183SC0301 [0,0,0,0,0,0|3,0,1]=4 10 B17R2.3417 Cc1cnncc1C(=O)Nc2ccccc2 WXVL_AG00183SC0973 [0,0,0,0,0,0|4,0,0]=4 11 B17R2.3417 Cc1cnncc1C(=O)Nc2ccccc2 WXVL_AG00183SC0973 [0,0,0,0,0,0|4,0,0]=4 12 B17R2.3417 Cc1ncccc1C(=O)Nc2ccccc2 WXVL_AG00183SC0065 [0,0,0,0,0,0|2,0,2]=4 13 B17R2.3417 Cc1ncccc1C(=O)Nc2ccccc2 WXVL_AG00183SC0065 [0,0,0,0,0,0|2,0,2]=4 14 B17R2.3417 Cc1ncncc1C(=O)Nc2ccccc2 WXVL_AG00183SC0515 [0,0,0,0,0,0|3,0,1]=4 15 B17R2.3417 Cc1ncncc1C(=O)Nc2ccccc2 WXVL_AG00183SC0515 [0,0,0,0,0,0|3,0,1]=4 16 B16R2.88 O=C(Nc1ccccc1)C2=CCCCO2 WXVL_AG00183SB4858 [1,0,0,0,0,0|1,1,0]=3 17 B16R2.88 O=C(Nc1ccccc1)C2=CCCCO2 WXVL_AG00183SB4858 [1,0,0,0,0,0|1,1,0]=3 18 B16R2.88 O=C(Nc1ccccc1)C2=COCCC2 WXVL_AG00183SB2928 [1,0,0,0,0,0|1,0,0]=2 19 B16R2.88 O=C(Nc1ccccc1)C2=COCCC2 WXVL_AG00183SB2928 [1,0,0,0,0,0|1,0,0]=2 20 B16R2.88 O=C(Nc1ccccn1)C2=CCCCO2 WXVL_AF00298SB4858 [1,0,0,0,0,0|2,1,0]=4 21 B16R2.88 O=C(Nc1ccccn1)C2=CCCCO2 WXVL_AF00298SB4858 [1,0,0,0,0,0|2,1,0]=4 22 B16R2.88 O=C(Nc1ccccn1)C2=COCCC2 WXVL_AF00298SB2928 [1,0,0,0,0,0|2,0,0]=3 23 B16R2.88 O=C(Nc1ccccn1)C2=COCCC2 WXVL_AF00298SB2928 [1,0,0,0,0,0|2,0,0]=3 24 B16R2.88 O=C(Nc1cccnn1)C2=COCCC2 WXVL_AF0151SB2928 [1,0,0,0,0,0|3,0,0]=4 25 B16R2.88 O=C(Nc1cccnn1)C2=COCCC2 WXVL_AF0151SB2928 [1,0,0,0,0,0|3,0,0]=4 26 B16R2.88 O=C(Nc1ccncn1)C2=COCCC2 WXVL_AF0139SB2928 [1,0,0,0,0,0|3,0,0]=4 27 B16R2.88 O=C(Nc1ccncn1)C2=COCCC2 WXVL_AF0139SB2928 [1,0,0,0,0,0|3,0,0]=4 28 B16R2.88 O=C(Nc1ccnnc1)C2=COCCC2 WXVL_AF0624SB2928 [1,0,0,0,0,0|3,0,0]=4 29 B16R2.88 O=C(Nc1ccnnc1)C2=COCCC2 WXVL_AF0624SB2928 [1,0,0,0,0,0|3,0,0]=4 30 B16R2.88 O=C(Nc1cnccn1)C2=COCCC2 WXVL_AF0120SB2928 [1,0,0,0,0,0|3,0,0]=4 31 B16R2.88 O=C(Nc1cnccn1)C2=COCCC2 WXVL_AF0120SB2928 [1,0,0,0,0,0|3,0,0]=4 32 B16R2.88 O=C(Nc1cncnc1)C2=COCCC2 WXVL_AF0085SB2928 [1,0,0,0,0,0|3,0,0]=4 33 B16R2.88 O=C(Nc1cncnc1)C2=COCCC2 WXVL_AF0085SB2928 [1,0,0,0,0,0|3,0,0]=4 34 B16R1.693 CCCCC/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB3331 [0,0,1,0,0,0|2,0,1]=4 35 B16R1.693 CCCCC/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB3331 [0,0,1,0,0,0|2,0,1]=4 36 B18R3.47120 CC1=C(CCCC1)c2nc3ccccc3[nH]2 WXVL_LR0645BT5146 [0,0,0,1,0,0|3,0,0]=4 37 B16R2.3005 CC1=C(CCO1)C(=O)Nc2ccccc2 WXVL_AG00183SC00025 [0,0,0,0,1,0|0,0,0]=1 38 B16R2.3005 CC1=C(CCO1)C(=O)Nc2ccccc2 WXVL_AG00183SC00025 [0,0,0,0,1,0|0,0,0]=1 39 B16R2.3005 CC1=C(CCO1)C(=O)Nc2ccccn2 WXVL_AF00298SC00025 [0,0,0,0,1,0|1,0,0]=2 40 B16R2.3005 CC1=C(CCO1)C(=O)Nc2ccccn2 WXVL_AF00298SC00025 [0,0,0,0,1,0|1,0,0]=2 41 B16R2.3005 CC1=C(CCO1)C(=O)Nc2cccnn2 WXVL_AF0151SC00025 [0,0,0,0,1,0|2,0,0]=3 42 B16R2.3005 CC1=C(CCO1)C(=O)Nc2cccnn2 WXVL_AF0151SC00025 [0,0,0,0,1,0|2,0,0]=3 43 B16R2.3005 CC1=C(CCO1)C(=O)Nc2ccncn2 WXVL_AF0139SC00025 [0,0,0,0,1,0|2,0,0]=3 44 B16R2.3005 CC1=C(CCO1)C(=O)Nc2ccncn2 WXVL_AF0139SC00025 [0,0,0,0,1,0|2,0,0]=3 45 B16R2.3005 CC1=C(CCO1)C(=O)Nc2ccnnc2 WXVL_AF0624SC00025 [0,0,0,0,1,0|2,0,0]=3 46 B16R2.3005 CC1=C(CCO1)C(=O)Nc2ccnnc2 WXVL_AF0624SC00025 [0,0,0,0,1,0|2,0,0]=3 47 B16R2.3005 CC1=C(CCO1)C(=O)Nc2cnccn2 WXVL_AF0120SC00025 [0,0,0,0,1,0|2,0,0]=3 48 B16R2.3005 CC1=C(CCO1)C(=O)Nc2cnccn2 WXVL_AF0120SC00025 [0,0,0,0,1,0|2,0,0]=3 49 B16R2.3005 CC1=C(CCO1)C(=O)Nc2cncnc2 WXVL_AF0085SC00025 [0,0,0,0,1,0|2,0,0]=3 50 B16R2.3005 CC1=C(CCO1)C(=O)Nc2cncnc2 WXVL_AF0085SC00025 [0,0,0,0,1,0|2,0,0]=3 51 B16R2.3005 CC1CCCC1C(=O)Nc2ccccc2 WXVL_AG00183SB0904 [0,0,0,0,1,0|1,0,2]=4 52 B16R2.3005 CC1CCCC1C(=O)Nc2ccccc2 WXVL_AG00183SB0904 [0,0,0,0,1,0|1,0,2]=4 53 B16R2.3005 CN1CCC[C@H]1C(=O)Nc2ccccc2 WXVL_AG00183SB1197 [0,0,0,0,1,0|2,0,1]=4 54 B16R2.3005 CN1CCC[C@H]1C(=O)Nc2ccccc2 WXVL_AG00183SB1197 [0,0,0,0,1,0|2,0,1]=4 55 B16R2.3005 Cc1c[nH]cc1C(=O)Nc2ccccc2 WXVL_AG00183SC0251 [0,0,0,0,1,0|2,0,1]=4 56 B16R2.3005 Cc1c[nH]cc1C(=O)Nc2ccccc2 WXVL_AG00183SC0251 [0,0,0,0,1,0|2,0,1]=4 57 B16R2.3005 Cc1cc[nH]c1C(=O)Nc2ccccc2 WXVL_AG00183SC1315 [0,0,0,0,1,0|1,0,2]=4 58 B16R2.3005 Cc1cc[nH]c1C(=O)Nc2ccccc2 WXVL_AG00183SC1315 [0,0,0,0,1,0|1,0,2]=4 59 B16R2.3005 Cc1ccoc1C(=O)Nc2ccccc2 WXVL_AG00183SC0230 [0,0,0,0,1,0|0,1,2]=4 60 B16R2.3005 Cc1ccoc1C(=O)Nc2ccccc2 WXVL_AG00183SC0230 [0,0,0,0,1,0|0,1,2]=4 61 B16R2.3005 Cc1ccsc1C(=O)Nc2ccccc2 WXVL_AG00183SC0052 [0,0,0,0,1,0|0,0,2]=3 62 B16R2.3005 Cc1ccsc1C(=O)Nc2ccccc2 WXVL_AG00183SC0052 [0,0,0,0,1,0|0,0,2]=3 63 B16R2.3005 Cc1ccsc1C(=O)Nc2ccccn2 WXVL_AF00298SC0052 [0,0,0,0,1,0|1,0,2]=4 64 B16R2.3005 Cc1ccsc1C(=O)Nc2ccccn2 WXVL_AF00298SC0052 [0,0,0,0,1,0|1,0,2]=4 65 B16R2.3005 Cc1cnoc1C(=O)Nc2ccccc2 WXVL_AG00183SC0912 [0,0,0,0,1,0|1,1,1]=4 66 B16R2.3005 Cc1cnoc1C(=O)Nc2ccccc2 WXVL_AG00183SC0912 [0,0,0,0,1,0|1,1,1]=4 67 B16R2.3005 Cc1cscc1C(=O)Nc2ccccc2 WXVL_AG00183SC0257 [0,0,0,0,1,0|2,0,1]=4 68 B16R2.3005 Cc1cscc1C(=O)Nc2ccccc2 WXVL_AG00183SC0257 [0,0,0,0,1,0|2,0,1]=4 69 B16R2.3005 Cc1n[nH]cc1C(=O)Nc2ccccc2 WXVL_AG00183SC2225 [0,0,0,0,1,0|2,0,1]=4 70 B16R2.3005 Cc1n[nH]cc1C(=O)Nc2ccccc2 WXVL_AG00183SC2225 [0,0,0,0,1,0|2,0,1]=4 71 B16R2.3005 Cc1n[nH]nc1C(=O)Nc2ccccc2 WXVL_AG00183SC00036 [0,0,0,0,1,0|3,0,0]=4 72 B16R2.3005 Cc1n[nH]nc1C(=O)Nc2ccccc2 WXVL_AG00183SC00036 [0,0,0,0,1,0|3,0,0]=4 73 B16R2.3005 Cc1nc[nH]c1C(=O)Nc2ccccc2 WXVL_AG00183SC0269 [0,0,0,0,1,0|2,0,1]=4 74 B16R2.3005 Cc1nc[nH]c1C(=O)Nc2ccccc2 WXVL_AG00183SC0269 [0,0,0,0,1,0|2,0,1]=4 75 B16R2.3005 Cc1ncoc1C(=O)Nc2ccccc2 WXVL_AG00183SC0103 [0,0,0,0,1,0|1,1,1]=4 76 B16R2.3005 Cc1ncoc1C(=O)Nc2ccccc2 WXVL_AG00183SC0103 [0,0,0,0,1,0|1,1,1]=4 77 B16R2.3005 Cc1ncsc1C(=O)Nc2ccccc2 WXVL_AG00183SC0093 [0,0,0,0,1,0|1,0,1]=3 78 B16R2.3005 Cc1ncsc1C(=O)Nc2ccccc2 WXVL_AG00183SC0093 [0,0,0,0,1,0|1,0,1]=3 79 B16R2.3005 Cc1ncsc1C(=O)Nc2ccccn2 WXVL_AF00298SC0093 [0,0,0,0,1,0|2,0,1]=4 80 B16R2.3005 Cc1ncsc1C(=O)Nc2ccccn2 WXVL_AF00298SC0093 [0,0,0,0,1,0|2,0,1]=4 81 B16R2.3005 Cc1nnsc1C(=O)Nc2ccccc2 WXVL_AG00183SC0262 [0,0,0,0,1,0|2,0,0]=3 82 B16R2.3005 Cc1nnsc1C(=O)Nc2ccccc2 WXVL_AG00183SC0262 [0,0,0,0,1,0|2,0,0]=3 83 B16R2.3005 Cc1nnsc1C(=O)Nc2ccccn2 WXVL_AF00298SC0262 [0,0,0,0,1,0|3,0,0]=4 84 B16R2.3005 Cc1nnsc1C(=O)Nc2ccccn2 WXVL_AF00298SC0262 [0,0,0,0,1,0|3,0,0]=4 85 B16R2.3005 Cc1nocc1C(=O)Nc2ccccc2 WXVL_AG00183SC0100 [0,0,0,0,1,0|2,0,1]=4 86 B16R2.3005 Cc1nocc1C(=O)Nc2ccccc2 WXVL_AG00183SC0100 [0,0,0,0,1,0|2,0,1]=4 87 B16R2.3005 Cc1nscc1C(=O)Nc2ccccc2 WXVL_AG00183SC2175 [0,0,0,0,1,0|2,0,1]=4 88 B16R2.3005 Cc1nscc1C(=O)Nc2ccccc2 WXVL_AG00183SC2175 [0,0,0,0,1,0|2,0,1]=4 89 B16R2.3005 Cc1ocnc1C(=O)Nc2ccccc2 WXVL_AG00183SC0732 [0,0,0,0,1,0|1,0,1]=3 90 B16R2.3005 Cc1ocnc1C(=O)Nc2ccccc2 WXVL_AG00183SC0732 [0,0,0,0,1,0|1,0,1]=3 91 B16R2.3005 Cc1ocnc1C(=O)Nc2ccccn2 WXVL_AF00298SC0732 [0,0,0,0,1,0|2,0,1]=4 92 B16R2.3005 Cc1ocnc1C(=O)Nc2ccccn2 WXVL_AF00298SC0732 [0,0,0,0,1,0|2,0,1]=4 93 B16R2.3005 Cc1sccc1C(=O)Nc2ccccc2 WXVL_AG00183SC1037 [0,0,0,0,1,0|0,1,2]=4 94 B16R2.3005 Cc1sccc1C(=O)Nc2ccccc2 WXVL_AG00183SC1037 [0,0,0,0,1,0|0,1,2]=4 95 B16R2.3005 Cc1scnc1C(=O)Nc2ccccc2 WXVL_AG00183SC0722 [0,0,0,0,1,0|1,1,1]=4 96 B16R2.3005 Cc1scnc1C(=O)Nc2ccccc2 WXVL_AG00183SC0722 [0,0,0,0,1,0|1,1,1]=4 97 B16R2.3005 O=C(Nc1ccccc1)c2sccc2Br WXVL_AG00183SC0364 [0,0,0,0,1,0|1,0,2]=4 98 B16R2.3005 O=C(Nc1ccccc1)c2sccc2Br WXVL_AG00183SC0364 [0,0,0,0,1,0|1,0,2]=4 99 B16R2.3005 O=C(Nc1ccccc1)c2sccc2Cl WXVL_AG00183SC0756 [0,0,0,0,1,0|1,0,2]=4 100 B16R2.3005 O=C(Nc1ccccc1)c2sccc2Cl WXVL_AG00183SC0756 [0,0,0,0,1,0|1,0,2]=4 101 B16R2.3005 O=C(Nc1ccccc1)c2sccc2F WXVL_AG00183SC0017 [0,0,0,0,1,0|1,0,2]=4 102 B16R2.3005 O=C(Nc1ccccc1)c2sccc2F WXVL_AG00183SC0017 [0,0,0,0,1,0|1,0,2]=4 103 B16R2.3005 O=C(Nc1ccccc1)c2sccc2I WXVL_AG00183SC1579 [0,0,0,0,1,0|1,0,2]=4 104 B16R2.3005 O=C(Nc1ccccc1)c2sccc2I WXVL_AG00183SC1579 [0,0,0,0,1,0|1,0,2]=4 105 B15R1.83 COCCOCC(=O)Nc1ccccc1 WXVL_AG00183SB0159 [1,0,1,0,0,0|0,1,1]=4 106 B15R1.83 COCCOCC(=O)Nc1ccccc1 WXVL_AG00183SB0159 [1,0,1,0,0,0|0,1,1]=4 107 B15R1.809 CCOC(=O)CC(=O)Nc1ccccc1 WXVL_AG00183SB3094 [1,0,1,0,0,0|1,0,1]=4 108 B15R1.809 CCOC(=O)CC(=O)Nc1ccccc1 WXVL_AG00183SB3094 [1,0,1,0,0,0|1,0,1]=4 109 B15R1.973 COC(=O)C(C)C(=O)Nc1ccccc1 WXVL_AG00183SB5708 [1,0,1,0,0,0|1,0,1]=4 110 B15R1.973 COC(=O)C(C)C(=O)Nc1ccccc1 WXVL_AG00183SB5708 [1,0,1,0,0,0|1,0,1]=4 111 B17R2.209 Cc1ccc(cn1)NC(=O)C2=COCCC2 WXVL_AF0076SB2928 [1,1,0,0,0,0|2,0,0]=4 112 B17R2.209 Cc1ccc(cn1)NC(=O)C2=COCCC2 WXVL_AF0076SB2928 [1,1,0,0,0,0|2,0,0]=4 113 B17R2.209 Cc1ccc(nc1)NC(=O)C2=COCCC2 WXVL_AF0018SB2928 [1,1,0,0,0,0|2,0,0]=4 114 B17R2.209 Cc1ccc(nc1)NC(=O)C2=COCCC2 WXVL_AF0018SB2928 [1,1,0,0,0,0|2,0,0]=4 115 B17R2.209 O=C(Nc1ccc(cc1)Cl)C2=CCCCO2 WXVL_AG0062SB4858 [1,1,0,0,0,0|1,1,0]=4 116 B17R2.209 O=C(Nc1ccc(cc1)Cl)C2=CCCCO2 WXVL_AG0062SB4858 [1,1,0,0,0,0|1,1,0]=4 117 B17R2.209 O=C(Nc1ccc(cc1)Cl)C2=COCCC2 WXVL_AG0062SB2928 [1,1,0,0,0,0|1,0,0]=3 118 B17R2.209 O=C(Nc1ccc(cc1)Cl)C2=COCCC2 WXVL_AG0062SB2928 [1,1,0,0,0,0|1,0,0]=3 119 B17R2.209 O=C(Nc1ccc(cc1)I)C2=CCCCO2 WXVL_AG1742SB4858 [1,1,0,0,0,0|1,1,0]=4 120 B17R2.209 O=C(Nc1ccc(cc1)I)C2=CCCCO2 WXVL_AG1742SB4858 [1,1,0,0,0,0|1,1,0]=4 121 B17R2.209 O=C(Nc1ccc(cc1)I)C2=COCCC2 WXVL_AG1742SB2928 [1,1,0,0,0,0|1,0,0]=3 122 B17R2.209 O=C(Nc1ccc(cc1)I)C2=COCCC2 WXVL_AG1742SB2928 [1,1,0,0,0,0|1,0,0]=3 123 B17R2.209 O=C(Nc1ccc(cn1)Cl)C2=COCCC2 WXVL_AF0017SB2928 [1,1,0,0,0,0|2,0,0]=4 124 B17R2.209 O=C(Nc1ccc(cn1)Cl)C2=COCCC2 WXVL_AF0017SB2928 [1,1,0,0,0,0|2,0,0]=4 125 B17R2.209 O=C(Nc1ccc(cn1)O)C2=COCCC2 WXVL_AF3250SB2928 [1,1,0,0,0,0|2,0,0]=4 126 B17R2.209 O=C(Nc1ccc(cn1)O)C2=COCCC2 WXVL_AF3250SB2928 [1,1,0,0,0,0|2,0,0]=4 127 B17R2.209 O=C(Nc1ccc(nc1)Br)C2=COCCC2 WXVL_AF0320SB2928 [1,1,0,0,0,0|2,0,0]=4 128 B17R2.209 O=C(Nc1ccc(nc1)Br)C2=COCCC2 WXVL_AF0320SB2928 [1,1,0,0,0,0|2,0,0]=4 129 B17R2.209 O=C(Nc1ccc(nc1)Cl)C2=COCCC2 WXVL_AF0323SB2928 [1,1,0,0,0,0|2,0,0]=4 130 B17R2.209 O=C(Nc1ccc(nc1)Cl)C2=COCCC2 WXVL_AF0323SB2928 [1,1,0,0,0,0|2,0,0]=4 131 B17R2.209 O=C(Nc1ccc(nc1)F)C2=COCCC2 WXVL_AF0400SB2928 [1,1,0,0,0,0|2,0,0]=4 132 B17R2.209 O=C(Nc1ccc(nc1)F)C2=COCCC2 WXVL_AF0400SB2928 [1,1,0,0,0,0|2,0,0]=4 133 B17R2.209 O=C(Nc1ccc(nc1)I)C2=COCCC2 WXVL_AF1228SB2928 [1,1,0,0,0,0|2,0,0]=4 134 B17R2.209 O=C(Nc1ccc(nc1)I)C2=COCCC2 WXVL_AF1228SB2928 [1,1,0,0,0,0|2,0,0]=4 135 B17R2.209 O=C(Nc1ccc(nc1)O)C2=COCCC2 WXVL_AF0322SB2928 [1,1,0,0,0,0|2,0,0]=4 136 B17R2.209 O=C(Nc1ccc(nc1)O)C2=COCCC2 WXVL_AF0322SB2928 [1,1,0,0,0,0|2,0,0]=4 137 B17R2.5293 Cc1cccc(c1)NC(=O)C2=CCCCO2 WXVL_AG0052SB4858 [1,1,0,0,0,0|1,1,0]=4 138 B17R2.5293 Cc1cccc(c1)NC(=O)C2=CCCCO2 WXVL_AG0052SB4858 [1,1,0,0,0,0|1,1,0]=4 139 B17R2.5293 Cc1cccc(c1)NC(=O)C2=COCCC2 WXVL_AG0052SB2928 [1,1,0,0,0,0|1,0,0]=3 140 B17R2.5293 Cc1cccc(c1)NC(=O)C2=COCCC2 WXVL_AG0052SB2928 [1,1,0,0,0,0|1,0,0]=3 141 B17R2.5293 Cc1cccc(n1)NC(=O)C2=COCCC2 WXVL_AF0019SB2928 [1,1,0,0,0,0|2,0,0]=4 142 B17R2.5293 Cc1cccc(n1)NC(=O)C2=COCCC2 WXVL_AF0019SB2928 [1,1,0,0,0,0|2,0,0]=4 143 B17R2.5293 Cc1cncc(c1)NC(=O)C2=COCCC2 WXVL_AF0136SB2928 [1,1,0,0,0,0|2,0,0]=4 144 B17R2.5293 Cc1cncc(c1)NC(=O)C2=COCCC2 WXVL_AF0136SB2928 [1,1,0,0,0,0|2,0,0]=4 145 B17R2.5293 O=C(Nc1cc(ccn1)Cl)C2=COCCC2 WXVL_AF3296SB2928 [1,1,0,0,0,0|2,0,0]=4 146 B17R2.5293 O=C(Nc1cc(ccn1)Cl)C2=COCCC2 WXVL_AF3296SB2928 [1,1,0,0,0,0|2,0,0]=4 147 B17R2.5293 O=C(Nc1cc(ccn1)F)C2=COCCC2 WXVL_AF0152SB2928 [1,1,0,0,0,0|2,0,0]=4 148 B17R2.5293 O=C(Nc1cc(ccn1)F)C2=COCCC2 WXVL_AF0152SB2928 [1,1,0,0,0,0|2,0,0]=4 149 B17R2.5293 O=C(Nc1cc(ccn1)O)C2=COCCC2 WXVL_AF3303SB2928 [1,1,0,0,0,0|2,0,0]=4 150 B17R2.5293 O=C(Nc1cc(ccn1)O)C2=COCCC2 WXVL_AF3303SB2928 [1,1,0,0,0,0|2,0,0]=4 151 B17R2.5293 O=C(Nc1cc[nH]c(=O)c1)C2=COCCC2 WXVL_AK8414SB2928 [1,1,0,0,0,0|2,0,0]=4 152 B17R2.5293 O=C(Nc1cc[nH]c(=O)c1)C2=COCCC2 WXVL_AK8414SB2928 [1,1,0,0,0,0|2,0,0]=4 153 B17R2.5293 O=C(Nc1cccc(c1)I)C2=CCCCO2 WXVL_AG0649SB4858 [1,1,0,0,0,0|1,1,0]=4 154 B17R2.5293 O=C(Nc1cccc(c1)I)C2=CCCCO2 WXVL_AG0649SB4858 [1,1,0,0,0,0|1,1,0]=4 155 B17R2.5293 O=C(Nc1cccc(c1)I)C2=COCCC2 WXVL_AG0649SB2928 [1,1,0,0,0,0|1,0,0]=3 156 B17R2.5293 O=C(Nc1cccc(c1)I)C2=COCCC2 WXVL_AG0649SB2928 [1,1,0,0,0,0|1,0,0]=3 157 B17R2.5293 O=C(Nc1cccc(c1)O)C2=CCCCO2 WXVL_AG00200SB4858 [1,1,0,0,0,0|1,1,0]=4 158 B17R2.5293 O=C(Nc1cccc(c1)O)C2=CCCCO2 WXVL_AG00200SB4858 [1,1,0,0,0,0|1,1,0]=4 159 B17R2.5293 O=C(Nc1cccc(c1)O)C2=COCCC2 WXVL_AG00200SB2928 [1,1,0,0,0,0|1,0,0]=3 160 B17R2.5293 O=C(Nc1cccc(c1)O)C2=COCCC2 WXVL_AG00200SB2928 [1,1,0,0,0,0|1,0,0]=3 161 B17R2.5293 O=C(Nc1cccc(n1)Br)C2=COCCC2 WXVL_AF0038SB2928 [1,1,0,0,0,0|2,0,0]=4 162 B17R2.5293 O=C(Nc1cccc(n1)Br)C2=COCCC2 WXVL_AF0038SB2928 [1,1,0,0,0,0|2,0,0]=4 163 B17R2.5293 O=C(Nc1cccc(n1)Cl)C2=COCCC2 WXVL_AF0312SB2928 [1,1,0,0,0,0|2,0,0]=4 164 B17R2.5293 O=C(Nc1cccc(n1)Cl)C2=COCCC2 WXVL_AF0312SB2928 [1,1,0,0,0,0|2,0,0]=4 165 B17R2.5293 O=C(Nc1cccc(n1)F)C2=COCCC2 WXVL_AF0307SB2928 [1,1,0,0,0,0|2,0,0]=4 166 B17R2.5293 O=C(Nc1cccc(n1)F)C2=COCCC2 WXVL_AF0307SB2928 [1,1,0,0,0,0|2,0,0]=4 167 B17R2.5293 O=C(Nc1cccc(n1)I)C2=COCCC2 WXVL_AF0430SB2928 [1,1,0,0,0,0|2,0,0]=4 168 B17R2.5293 O=C(Nc1cccc(n1)I)C2=COCCC2 WXVL_AF0430SB2928 [1,1,0,0,0,0|2,0,0]=4 169 B17R2.5293 O=C(Nc1cccc(n1)O)C2=COCCC2 WXVL_AF2469SB2928 [1,1,0,0,0,0|2,0,0]=4 170 B17R2.5293 O=C(Nc1cccc(n1)O)C2=COCCC2 WXVL_AF2469SB2928 [1,1,0,0,0,0|2,0,0]=4 171 B17R2.5293 O=C(Nc1ccnc(c1)Br)C2=COCCC2 WXVL_AF0395SB2928 [1,1,0,0,0,0|2,0,0]=4 172 B17R2.5293 O=C(Nc1ccnc(c1)Br)C2=COCCC2 WXVL_AF0395SB2928 [1,1,0,0,0,0|2,0,0]=4 173 B17R2.5293 O=C(Nc1ccnc(c1)Cl)C2=COCCC2 WXVL_AF0319SB2928 [1,1,0,0,0,0|2,0,0]=4 174 B17R2.5293 O=C(Nc1ccnc(c1)Cl)C2=COCCC2 WXVL_AF0319SB2928 [1,1,0,0,0,0|2,0,0]=4 175 B17R2.5293 O=C(Nc1ccnc(c1)F)C2=COCCC2 WXVL_AF0676SB2928 [1,1,0,0,0,0|2,0,0]=4 176 B17R2.5293 O=C(Nc1ccnc(c1)F)C2=COCCC2 WXVL_AF0676SB2928 [1,1,0,0,0,0|2,0,0]=4 177 B17R2.5293 O=C(Nc1ccnc(c1)O)C2=COCCC2 WXVL_AF0326SB2928 [1,1,0,0,0,0|2,0,0]=4 178 B17R2.5293 O=C(Nc1ccnc(c1)O)C2=COCCC2 WXVL_AF0326SB2928 [1,1,0,0,0,0|2,0,0]=4 179 B17R2.5293 O=C(Nc1cncc(c1)Br)C2=COCCC2 WXVL_AF0318SB2928 [1,1,0,0,0,0|2,0,0]=4 180 B17R2.5293 O=C(Nc1cncc(c1)Br)C2=COCCC2 WXVL_AF0318SB2928 [1,1,0,0,0,0|2,0,0]=4 181 B17R2.5293 O=C(Nc1cncc(c1)Cl)C2=COCCC2 WXVL_AF0629SB2928 [1,1,0,0,0,0|2,0,0]=4 182 B17R2.5293 O=C(Nc1cncc(c1)Cl)C2=COCCC2 WXVL_AF0629SB2928 [1,1,0,0,0,0|2,0,0]=4 183 B17R2.5293 O=C(Nc1cncc(c1)F)C2=COCCC2 WXVL_AF0342SB2928 [1,1,0,0,0,0|2,0,0]=4 184 B17R2.5293 O=C(Nc1cncc(c1)F)C2=COCCC2 WXVL_AF0342SB2928 [1,1,0,0,0,0|2,0,0]=4 185 B17R2.5293 O=C(Nc1cncc(c1)O)C2=COCCC2 WXVL_AF0659SB2928 [1,1,0,0,0,0|2,0,0]=4 186 B17R2.5293 O=C(Nc1cncc(c1)O)C2=COCCC2 WXVL_AF0659SB2928 [1,1,0,0,0,0|2,0,0]=4 187 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(cc2)Cl WXVL_AG0062SC00025 [0,1,0,0,1,0|0,0,0]=2 188 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(cc2)Cl WXVL_AG0062SC00025 [0,1,0,0,1,0|0,0,0]=2 189 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(cc2)I WXVL_AG1742SC00025 [0,1,0,0,1,0|0,0,0]=2 190 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(cc2)I WXVL_AG1742SC00025 [0,1,0,0,1,0|0,0,0]=2 191 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(cn2)C WXVL_AF0018SC00025 [0,1,0,0,1,0|1,0,0]=3 192 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(cn2)C WXVL_AF0018SC00025 [0,1,0,0,1,0|1,0,0]=3 193 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(cn2)Cl WXVL_AF0017SC00025 [0,1,0,0,1,0|1,0,0]=3 194 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(cn2)Cl WXVL_AF0017SC00025 [0,1,0,0,1,0|1,0,0]=3 195 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(cn2)O WXVL_AF3250SC00025 [0,1,0,0,1,0|1,0,0]=3 196 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(cn2)O WXVL_AF3250SC00025 [0,1,0,0,1,0|1,0,0]=3 197 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)Br WXVL_AF0320SC00025 [0,1,0,0,1,0|1,0,0]=3 198 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)Br WXVL_AF0320SC00025 [0,1,0,0,1,0|1,0,0]=3 199 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)C WXVL_AF0076SC00025 [0,1,0,0,1,0|1,0,0]=3 200 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)C WXVL_AF0076SC00025 [0,1,0,0,1,0|1,0,0]=3 201 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)Cl WXVL_AF0323SC00025 [0,1,0,0,1,0|1,0,0]=3 202 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)Cl WXVL_AF0323SC00025 [0,1,0,0,1,0|1,0,0]=3 203 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)F WXVL_AF0400SC00025 [0,1,0,0,1,0|1,0,0]=3 204 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)F WXVL_AF0400SC00025 [0,1,0,0,1,0|1,0,0]=3 205 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)I WXVL_AF1228SC00025 [0,1,0,0,1,0|1,0,0]=3 206 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)I WXVL_AF1228SC00025 [0,1,0,0,1,0|1,0,0]=3 207 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)O WXVL_AF0322SC00025 [0,1,0,0,1,0|1,0,0]=3 208 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nc2)O WXVL_AF0322SC00025 [0,1,0,0,1,0|1,0,0]=3 209 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nn2)Cl WXVL_AF0134SC00025 [0,1,0,0,1,0|2,0,0]=4 210 B17R2.484 CC1=C(CCO1)C(=O)Nc2ccc(nn2)Cl WXVL_AF0134SC00025 [0,1,0,0,1,0|2,0,0]=4 211 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(cn2)Br WXVL_AF1109SC00025 [0,1,0,0,1,0|2,0,0]=4 212 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(cn2)Br WXVL_AF1109SC00025 [0,1,0,0,1,0|2,0,0]=4 213 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(cn2)C WXVL_AF0099SC00025 [0,1,0,0,1,0|2,0,0]=4 214 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(cn2)C WXVL_AF0099SC00025 [0,1,0,0,1,0|2,0,0]=4 215 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(cn2)Cl WXVL_AF0338SC00025 [0,1,0,0,1,0|2,0,0]=4 216 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(cn2)Cl WXVL_AF0338SC00025 [0,1,0,0,1,0|2,0,0]=4 217 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(cn2)I WXVL_AF0666SC00025 [0,1,0,0,1,0|2,0,0]=4 218 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(cn2)I WXVL_AF0666SC00025 [0,1,0,0,1,0|2,0,0]=4 219 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(nc2)Br WXVL_AF0628SC00025 [0,1,0,0,1,0|2,0,0]=4 220 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(nc2)Br WXVL_AF0628SC00025 [0,1,0,0,1,0|2,0,0]=4 221 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(nc2)C WXVL_AF0697SC00025 [0,1,0,0,1,0|2,0,0]=4 222 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(nc2)C WXVL_AF0697SC00025 [0,1,0,0,1,0|2,0,0]=4 223 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(nc2)Cl WXVL_AF0236SC00025 [0,1,0,0,1,0|2,0,0]=4 224 B17R2.484 CC1=C(CCO1)C(=O)Nc2cnc(nc2)Cl WXVL_AF0236SC00025 [0,1,0,0,1,0|2,0,0]=4 225 B17R2.484 CC1=C(CCO1)C(=O)Nc2ncc(cn2)F WXVL_AF4152SC00025 [0,1,0,0,1,0|2,0,0]=4 226 B17R2.484 CC1=C(CCO1)C(=O)Nc2ncc(cn2)F WXVL_AF4152SC00025 [0,1,0,0,1,0|2,0,0]=4 227 B17R2.484 Cc1ccsc1C(=O)Nc2ccc(cc2)Cl WXVL_AG0062SC0052 [0,1,0,0,1,0|0,0,2]=4 228 B17R2.484 Cc1ccsc1C(=O)Nc2ccc(cc2)Cl WXVL_AG0062SC0052 [0,1,0,0,1,0|0,0,2]=4 229 B17R2.484 Cc1ccsc1C(=O)Nc2ccc(cc2)I WXVL_AG1742SC0052 [0,1,0,0,1,0|0,0,2]=4 230 B17R2.484 Cc1ccsc1C(=O)Nc2ccc(cc2)I WXVL_AG1742SC0052 [0,1,0,0,1,0|0,0,2]=4 231 B17R2.484 Cc1ncsc1C(=O)Nc2ccc(cc2)Cl WXVL_AG0062SC0093 [0,1,0,0,1,0|1,0,1]=4 232 B17R2.484 Cc1ncsc1C(=O)Nc2ccc(cc2)Cl WXVL_AG0062SC0093 [0,1,0,0,1,0|1,0,1]=4 233 B17R2.484 Cc1ncsc1C(=O)Nc2ccc(cc2)I WXVL_AG1742SC0093 [0,1,0,0,1,0|1,0,1]=4 234 B17R2.484 Cc1ncsc1C(=O)Nc2ccc(cc2)I WXVL_AG1742SC0093 [0,1,0,0,1,0|1,0,1]=4 235 B17R2.484 Cc1nnsc1C(=O)Nc2ccc(cc2)Cl WXVL_AG0062SC0262 [0,1,0,0,1,0|2,0,0]=4 236 B17R2.484 Cc1nnsc1C(=O)Nc2ccc(cc2)Cl WXVL_AG0062SC0262 [0,1,0,0,1,0|2,0,0]=4 237 B17R2.484 Cc1nnsc1C(=O)Nc2ccc(cc2)I WXVL_AG1742SC0262 [0,1,0,0,1,0|2,0,0]=4 238 B17R2.484 Cc1nnsc1C(=O)Nc2ccc(cc2)I WXVL_AG1742SC0262 [0,1,0,0,1,0|2,0,0]=4 239 B17R2.484 Cc1ocnc1C(=O)Nc2ccc(cc2)Cl WXVL_AG0062SC0732 [0,1,0,0,1,0|1,0,1]=4 240 B17R2.484 Cc1ocnc1C(=O)Nc2ccc(cc2)Cl WXVL_AG0062SC0732 [0,1,0,0,1,0|1,0,1]=4 241 B17R2.484 Cc1ocnc1C(=O)Nc2ccc(cc2)I WXVL_AG1742SC0732 [0,1,0,0,1,0|1,0,1]=4 242 B17R2.484 Cc1ocnc1C(=O)Nc2ccc(cc2)I WXVL_AG1742SC0732 [0,1,0,0,1,0|1,0,1]=4 243 B17R2.2825 CCc1ncsc1C(=O)Nc2ccccc2 WXVL_AG00183SC5166 [0,1,0,0,1,0|1,0,1]=4 244 B17R2.2825 CCc1ncsc1C(=O)Nc2ccccc2 WXVL_AG00183SC5166 [0,1,0,0,1,0|1,0,1]=4 245 B17R2.2825 COc1ccsc1C(=O)Nc2ccccc2 WXVL_AG00183SC0825 [0,1,0,0,1,0|0,0,2]=4 246 B17R2.2825 COc1ccsc1C(=O)Nc2ccccc2 WXVL_AG00183SC0825 [0,1,0,0,1,0|0,0,2]=4 247 B17R2.3343 Cc1cc(c(o1)C)C(=O)Nc2ccccc2 WXVL_AG00183SC0073 [0,1,0,0,1,0|0,0,2]=4 248 B17R2.3343 Cc1cc(c(o1)C)C(=O)Nc2ccccc2 WXVL_AG00183SC0073 [0,1,0,0,1,0|0,0,2]=4 249 B17R2.3343 Cc1nc(c(s1)C(=O)Nc2ccccc2)C WXVL_AG00183SC0070 [0,1,0,0,1,0|1,0,1]=4 250 B17R2.3343 Cc1nc(c(s1)C(=O)Nc2ccccc2)C WXVL_AG00183SC0070 [0,1,0,0,1,0|1,0,1]=4 251 B17R2.3343 Cc1nc(sc1C(=O)Nc2ccccc2)Br WXVL_AG00183SC0328 [0,1,0,0,1,0|1,0,1]=4 252 B17R2.3343 Cc1nc(sc1C(=O)Nc2ccccc2)Br WXVL_AG00183SC0328 [0,1,0,0,1,0|1,0,1]=4 253 B17R2.3343 Cc1nc(sc1C(=O)Nc2ccccc2)Cl WXVL_AG00183SC2359 [0,1,0,0,1,0|1,0,1]=4 254 B17R2.3343 Cc1nc(sc1C(=O)Nc2ccccc2)Cl WXVL_AG00183SC2359 [0,1,0,0,1,0|1,0,1]=4 255 B17R2.8669 Cc1noc(c1C(=O)Nc2ccccc2)C WXVL_AG00183SC0068 [0,1,0,0,1,0|1,0,1]=4 256 B17R2.8669 Cc1noc(c1C(=O)Nc2ccccc2)C WXVL_AG00183SC0068 [0,1,0,0,1,0|1,0,1]=4 257 B17R2.8671 Cc1csc(c1C)C(=O)Nc2ccccc2 WXVL_AG00183SC1211 [0,1,0,0,1,0|0,0,2]=4 258 B17R2.8671 Cc1csc(c1C)C(=O)Nc2ccccc2 WXVL_AG00183SC1211 [0,1,0,0,1,0|0,0,2]=4 259 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccccc2Br WXVL_AG00180SC00025 [0,1,0,0,1,0|0,0,0]=2 260 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccccc2Br WXVL_AG00180SC00025 [0,1,0,0,1,0|0,0,0]=2 261 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccccc2C WXVL_AG0027SC00025 [0,1,0,0,1,0|0,0,0]=2 262 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccccc2C WXVL_AG0027SC00025 [0,1,0,0,1,0|0,0,0]=2 263 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccccc2Cl WXVL_AG00129SC00025 [0,1,0,0,1,0|0,0,0]=2 264 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccccc2Cl WXVL_AG00129SC00025 [0,1,0,0,1,0|0,0,0]=2 265 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccccc2I WXVL_AG0385SC00025 [0,1,0,0,1,0|0,0,0]=2 266 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccccc2I WXVL_AG0385SC00025 [0,1,0,0,1,0|0,0,0]=2 267 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2Br WXVL_AF0399SC00025 [0,1,0,0,1,0|1,0,0]=3 268 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2Br WXVL_AF0399SC00025 [0,1,0,0,1,0|1,0,0]=3 269 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2C WXVL_AF0055SC00025 [0,1,0,0,1,0|1,0,0]=3 270 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2C WXVL_AF0055SC00025 [0,1,0,0,1,0|1,0,0]=3 271 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2Cl WXVL_AF0009SC00025 [0,1,0,0,1,0|1,0,0]=3 272 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2Cl WXVL_AF0009SC00025 [0,1,0,0,1,0|1,0,0]=3 273 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2F WXVL_AF0419SC00025 [0,1,0,0,1,0|1,0,0]=3 274 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2F WXVL_AF0419SC00025 [0,1,0,0,1,0|1,0,0]=3 275 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2I WXVL_AF0681SC00025 [0,1,0,0,1,0|1,0,0]=3 276 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2I WXVL_AF0681SC00025 [0,1,0,0,1,0|1,0,0]=3 277 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2O WXVL_AF0440SC00025 [0,1,0,0,1,0|1,0,0]=3 278 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cccnc2O WXVL_AF0440SC00025 [0,1,0,0,1,0|1,0,0]=3 279 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccncc2C WXVL_AF0049SC00025 [0,1,0,0,1,0|1,0,0]=3 280 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccncc2C WXVL_AF0049SC00025 [0,1,0,0,1,0|1,0,0]=3 281 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccncc2Cl WXVL_AF3285SC00025 [0,1,0,0,1,0|1,0,0]=3 282 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccncc2Cl WXVL_AF3285SC00025 [0,1,0,0,1,0|1,0,0]=3 283 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccncc2F WXVL_AF2713SC00025 [0,1,0,0,1,0|1,0,0]=3 284 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccncc2F WXVL_AF2713SC00025 [0,1,0,0,1,0|1,0,0]=3 285 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccncc2O WXVL_AF0234SC00025 [0,1,0,0,1,0|1,0,0]=3 286 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccncc2O WXVL_AF0234SC00025 [0,1,0,0,1,0|1,0,0]=3 287 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccnnc2O WXVL_AF1433SC00025 [0,1,0,0,1,0|2,0,0]=4 288 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ccnnc2O WXVL_AF1433SC00025 [0,1,0,0,1,0|2,0,0]=4 289 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnccc2Br WXVL_AF1085SC00025 [0,1,0,0,1,0|1,0,0]=3 290 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnccc2Br WXVL_AF1085SC00025 [0,1,0,0,1,0|1,0,0]=3 291 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnccc2C WXVL_AF0075SC00025 [0,1,0,0,1,0|1,0,0]=3 292 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnccc2C WXVL_AF0075SC00025 [0,1,0,0,1,0|1,0,0]=3 293 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnccc2Cl WXVL_AF0294SC00025 [0,1,0,0,1,0|1,0,0]=3 294 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnccc2Cl WXVL_AF0294SC00025 [0,1,0,0,1,0|1,0,0]=3 295 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnccc2I WXVL_AF0133SC00025 [0,1,0,0,1,0|1,0,0]=3 296 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnccc2I WXVL_AF0133SC00025 [0,1,0,0,1,0|1,0,0]=3 297 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cncnc2Br WXVL_AF0648SC00025 [0,1,0,0,1,0|2,0,0]=4 298 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cncnc2Br WXVL_AF0648SC00025 [0,1,0,0,1,0|2,0,0]=4 299 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cncnc2C WXVL_AF0738SC00025 [0,1,0,0,1,0|2,0,0]=4 300 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cncnc2C WXVL_AF0738SC00025 [0,1,0,0,1,0|2,0,0]=4 301 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cncnc2Cl WXVL_AF0353SC00025 [0,1,0,0,1,0|2,0,0]=4 302 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cncnc2Cl WXVL_AF0353SC00025 [0,1,0,0,1,0|2,0,0]=4 303 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cncnc2I WXVL_AF1297SC00025 [0,1,0,0,1,0|2,0,0]=4 304 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cncnc2I WXVL_AF1297SC00025 [0,1,0,0,1,0|2,0,0]=4 305 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cncnc2O WXVL_AF1656SC00025 [0,1,0,0,1,0|2,0,0]=4 306 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cncnc2O WXVL_AF1656SC00025 [0,1,0,0,1,0|2,0,0]=4 307 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnncc2Br WXVL_AF1355SC00025 [0,1,0,0,1,0|2,0,0]=4 308 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnncc2Br WXVL_AF1355SC00025 [0,1,0,0,1,0|2,0,0]=4 309 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnncc2Cl WXVL_AF1037SC00025 [0,1,0,0,1,0|2,0,0]=4 310 B17R2.20534 CC1=C(CCO1)C(=O)Nc2cnncc2Cl WXVL_AF1037SC00025 [0,1,0,0,1,0|2,0,0]=4 311 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2Br WXVL_AF0053SC00025 [0,1,0,0,1,0|1,0,0]=3 312 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2Br WXVL_AF0053SC00025 [0,1,0,0,1,0|1,0,0]=3 313 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2C WXVL_AF0013SC00025 [0,1,0,0,1,0|1,0,0]=3 314 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2C WXVL_AF0013SC00025 [0,1,0,0,1,0|1,0,0]=3 315 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2Cl WXVL_AF1147SC00025 [0,1,0,0,1,0|1,0,0]=3 316 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2Cl WXVL_AF1147SC00025 [0,1,0,0,1,0|1,0,0]=3 317 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2F WXVL_AF0321SC00025 [0,1,0,0,1,0|1,0,0]=3 318 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2F WXVL_AF0321SC00025 [0,1,0,0,1,0|1,0,0]=3 319 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2I WXVL_AF0298SC00025 [0,1,0,0,1,0|1,0,0]=3 320 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2I WXVL_AF0298SC00025 [0,1,0,0,1,0|1,0,0]=3 321 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2O WXVL_AF0347SC00025 [0,1,0,0,1,0|1,0,0]=3 322 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncccc2O WXVL_AF0347SC00025 [0,1,0,0,1,0|1,0,0]=3 323 B17R2.20534 CC1=C(CCO1)C(=O)Nc2nccnc2Br WXVL_AF0708SC00025 [0,1,0,0,1,0|2,0,0]=4 324 B17R2.20534 CC1=C(CCO1)C(=O)Nc2nccnc2Br WXVL_AF0708SC00025 [0,1,0,0,1,0|2,0,0]=4 325 B17R2.20534 CC1=C(CCO1)C(=O)Nc2nccnc2C WXVL_AF0295SC00025 [0,1,0,0,1,0|2,0,0]=4 326 B17R2.20534 CC1=C(CCO1)C(=O)Nc2nccnc2C WXVL_AF0295SC00025 [0,1,0,0,1,0|2,0,0]=4 327 B17R2.20534 CC1=C(CCO1)C(=O)Nc2nccnc2Cl WXVL_AF0102SC00025 [0,1,0,0,1,0|2,0,0]=4 328 B17R2.20534 CC1=C(CCO1)C(=O)Nc2nccnc2Cl WXVL_AF0102SC00025 [0,1,0,0,1,0|2,0,0]=4 329 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncncc2Cl WXVL_AF0145SC00025 [0,1,0,0,1,0|2,0,0]=4 330 B17R2.20534 CC1=C(CCO1)C(=O)Nc2ncncc2Cl WXVL_AF0145SC00025 [0,1,0,0,1,0|2,0,0]=4 331 B17R2.20534 Cc1ccccc1NC(=O)c2ncoc2C WXVL_AG0027SC0732 [0,1,0,0,1,0|1,0,1]=4 332 B17R2.20534 Cc1ccccc1NC(=O)c2ncoc2C WXVL_AG0027SC0732 [0,1,0,0,1,0|1,0,1]=4 333 B17R2.20534 Cc1ccccc1NC(=O)c2sccc2C WXVL_AG0027SC0052 [0,1,0,0,1,0|0,0,2]=4 334 B17R2.20534 Cc1ccccc1NC(=O)c2sccc2C WXVL_AG0027SC0052 [0,1,0,0,1,0|0,0,2]=4 335 B17R2.20534 Cc1ccccc1NC(=O)c2scnc2C WXVL_AG0027SC0093 [0,1,0,0,1,0|1,0,1]=4 336 B17R2.20534 Cc1ccccc1NC(=O)c2scnc2C WXVL_AG0027SC0093 [0,1,0,0,1,0|1,0,1]=4 337 B17R2.20534 Cc1ccccc1NC(=O)c2snnc2C WXVL_AG0027SC0262 [0,1,0,0,1,0|2,0,0]=4 338 B17R2.20534 Cc1ccccc1NC(=O)c2snnc2C WXVL_AG0027SC0262 [0,1,0,0,1,0|2,0,0]=4 339 B17R2.20534 Cc1ccsc1C(=O)Nc2ccccc2Br WXVL_AG00180SC0052 [0,1,0,0,1,0|0,0,2]=4 340 B17R2.20534 Cc1ccsc1C(=O)Nc2ccccc2Br WXVL_AG00180SC0052 [0,1,0,0,1,0|0,0,2]=4 341 B17R2.20534 Cc1ccsc1C(=O)Nc2ccccc2Cl WXVL_AG00129SC0052 [0,1,0,0,1,0|0,0,2]=4 342 B17R2.20534 Cc1ccsc1C(=O)Nc2ccccc2Cl WXVL_AG00129SC0052 [0,1,0,0,1,0|0,0,2]=4 343 B17R2.20534 Cc1ccsc1C(=O)Nc2ccccc2I WXVL_AG0385SC0052 [0,1,0,0,1,0|0,0,2]=4 344 B17R2.20534 Cc1ccsc1C(=O)Nc2ccccc2I WXVL_AG0385SC0052 [0,1,0,0,1,0|0,0,2]=4 345 B17R2.20534 Cc1ncsc1C(=O)Nc2ccccc2Br WXVL_AG00180SC0093 [0,1,0,0,1,0|1,0,1]=4 346 B17R2.20534 Cc1ncsc1C(=O)Nc2ccccc2Br WXVL_AG00180SC0093 [0,1,0,0,1,0|1,0,1]=4 347 B17R2.20534 Cc1ncsc1C(=O)Nc2ccccc2Cl WXVL_AG00129SC0093 [0,1,0,0,1,0|1,0,1]=4 348 B17R2.20534 Cc1ncsc1C(=O)Nc2ccccc2Cl WXVL_AG00129SC0093 [0,1,0,0,1,0|1,0,1]=4 349 B17R2.20534 Cc1ncsc1C(=O)Nc2ccccc2I WXVL_AG0385SC0093 [0,1,0,0,1,0|1,0,1]=4 350 B17R2.20534 Cc1ncsc1C(=O)Nc2ccccc2I WXVL_AG0385SC0093 [0,1,0,0,1,0|1,0,1]=4 351 B17R2.20534 Cc1nnsc1C(=O)Nc2ccccc2Br WXVL_AG00180SC0262 [0,1,0,0,1,0|2,0,0]=4 352 B17R2.20534 Cc1nnsc1C(=O)Nc2ccccc2Br WXVL_AG00180SC0262 [0,1,0,0,1,0|2,0,0]=4 353 B17R2.20534 Cc1nnsc1C(=O)Nc2ccccc2Cl WXVL_AG00129SC0262 [0,1,0,0,1,0|2,0,0]=4 354 B17R2.20534 Cc1nnsc1C(=O)Nc2ccccc2Cl WXVL_AG00129SC0262 [0,1,0,0,1,0|2,0,0]=4 355 B17R2.20534 Cc1nnsc1C(=O)Nc2ccccc2I WXVL_AG0385SC0262 [0,1,0,0,1,0|2,0,0]=4 356 B17R2.20534 Cc1nnsc1C(=O)Nc2ccccc2I WXVL_AG0385SC0262 [0,1,0,0,1,0|2,0,0]=4 357 B17R2.20534 Cc1ocnc1C(=O)Nc2ccccc2Br WXVL_AG00180SC0732 [0,1,0,0,1,0|1,0,1]=4 358 B17R2.20534 Cc1ocnc1C(=O)Nc2ccccc2Br WXVL_AG00180SC0732 [0,1,0,0,1,0|1,0,1]=4 359 B17R2.20534 Cc1ocnc1C(=O)Nc2ccccc2Cl WXVL_AG00129SC0732 [0,1,0,0,1,0|1,0,1]=4 360 B17R2.20534 Cc1ocnc1C(=O)Nc2ccccc2Cl WXVL_AG00129SC0732 [0,1,0,0,1,0|1,0,1]=4 361 B17R2.20534 Cc1ocnc1C(=O)Nc2ccccc2I WXVL_AG0385SC0732 [0,1,0,0,1,0|1,0,1]=4 362 B17R2.20534 Cc1ocnc1C(=O)Nc2ccccc2I WXVL_AG0385SC0732 [0,1,0,0,1,0|1,0,1]=4 363 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(ccn2)Cl WXVL_AF3296SC00025 [0,1,0,0,1,0|1,0,0]=3 364 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(ccn2)Cl WXVL_AF3296SC00025 [0,1,0,0,1,0|1,0,0]=3 365 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(ccn2)F WXVL_AF0152SC00025 [0,1,0,0,1,0|1,0,0]=3 366 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(ccn2)F WXVL_AF0152SC00025 [0,1,0,0,1,0|1,0,0]=3 367 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(ccn2)O WXVL_AF3303SC00025 [0,1,0,0,1,0|1,0,0]=3 368 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(ccn2)O WXVL_AF3303SC00025 [0,1,0,0,1,0|1,0,0]=3 369 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(cnn2)C WXVL_AF4009SC00025 [0,1,0,0,1,0|2,0,0]=4 370 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(cnn2)C WXVL_AF4009SC00025 [0,1,0,0,1,0|2,0,0]=4 371 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(cnn2)Cl WXVL_AF9282SC00025 [0,1,0,0,1,0|2,0,0]=4 372 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(cnn2)Cl WXVL_AF9282SC00025 [0,1,0,0,1,0|2,0,0]=4 373 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(ncn2)I WXVL_AF4094SC00025 [0,1,0,0,1,0|2,0,0]=4 374 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(ncn2)I WXVL_AF4094SC00025 [0,1,0,0,1,0|2,0,0]=4 375 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(ncn2)O WXVL_AF0437SC00025 [0,1,0,0,1,0|2,0,0]=4 376 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc(ncn2)O WXVL_AF0437SC00025 [0,1,0,0,1,0|2,0,0]=4 377 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc[nH]c(=O)c2 WXVL_AK8414SC00025 [0,1,0,0,1,0|1,0,0]=3 378 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cc[nH]c(=O)c2 WXVL_AK8414SC00025 [0,1,0,0,1,0|1,0,0]=3 379 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(c2)C WXVL_AG0052SC00025 [0,1,0,0,1,0|0,0,0]=2 380 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(c2)C WXVL_AG0052SC00025 [0,1,0,0,1,0|0,0,0]=2 381 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(c2)I WXVL_AG0649SC00025 [0,1,0,0,1,0|0,0,0]=2 382 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(c2)I WXVL_AG0649SC00025 [0,1,0,0,1,0|0,0,0]=2 383 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(c2)O WXVL_AG00200SC00025 [0,1,0,0,1,0|0,0,0]=2 384 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(c2)O WXVL_AG00200SC00025 [0,1,0,0,1,0|0,0,0]=2 385 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)Br WXVL_AF0038SC00025 [0,1,0,0,1,0|1,0,0]=3 386 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)Br WXVL_AF0038SC00025 [0,1,0,0,1,0|1,0,0]=3 387 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)C WXVL_AF0019SC00025 [0,1,0,0,1,0|1,0,0]=3 388 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)C WXVL_AF0019SC00025 [0,1,0,0,1,0|1,0,0]=3 389 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)Cl WXVL_AF0312SC00025 [0,1,0,0,1,0|1,0,0]=3 390 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)Cl WXVL_AF0312SC00025 [0,1,0,0,1,0|1,0,0]=3 391 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)F WXVL_AF0307SC00025 [0,1,0,0,1,0|1,0,0]=3 392 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)F WXVL_AF0307SC00025 [0,1,0,0,1,0|1,0,0]=3 393 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)I WXVL_AF0430SC00025 [0,1,0,0,1,0|1,0,0]=3 394 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)I WXVL_AF0430SC00025 [0,1,0,0,1,0|1,0,0]=3 395 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)O WXVL_AF2469SC00025 [0,1,0,0,1,0|1,0,0]=3 396 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cccc(n2)O WXVL_AF2469SC00025 [0,1,0,0,1,0|1,0,0]=3 397 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(c2)Br WXVL_AF0395SC00025 [0,1,0,0,1,0|1,0,0]=3 398 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(c2)Br WXVL_AF0395SC00025 [0,1,0,0,1,0|1,0,0]=3 399 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(c2)Cl WXVL_AF0319SC00025 [0,1,0,0,1,0|1,0,0]=3 400 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(c2)Cl WXVL_AF0319SC00025 [0,1,0,0,1,0|1,0,0]=3 401 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(c2)F WXVL_AF0676SC00025 [0,1,0,0,1,0|1,0,0]=3 402 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(c2)F WXVL_AF0676SC00025 [0,1,0,0,1,0|1,0,0]=3 403 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(c2)O WXVL_AF0326SC00025 [0,1,0,0,1,0|1,0,0]=3 404 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(c2)O WXVL_AF0326SC00025 [0,1,0,0,1,0|1,0,0]=3 405 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(n2)Br WXVL_AF4089SC00025 [0,1,0,0,1,0|2,0,0]=4 406 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(n2)Br WXVL_AF4089SC00025 [0,1,0,0,1,0|2,0,0]=4 407 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(n2)C WXVL_AF0132SC00025 [0,1,0,0,1,0|2,0,0]=4 408 B17R2.41874 CC1=C(CCO1)C(=O)Nc2ccnc(n2)C WXVL_AF0132SC00025 [0,1,0,0,1,0|2,0,0]=4 409 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(c2)Br WXVL_AF0318SC00025 [0,1,0,0,1,0|1,0,0]=3 410 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(c2)Br WXVL_AF0318SC00025 [0,1,0,0,1,0|1,0,0]=3 411 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(c2)C WXVL_AF0136SC00025 [0,1,0,0,1,0|1,0,0]=3 412 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(c2)C WXVL_AF0136SC00025 [0,1,0,0,1,0|1,0,0]=3 413 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(c2)Cl WXVL_AF0629SC00025 [0,1,0,0,1,0|1,0,0]=3 414 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(c2)Cl WXVL_AF0629SC00025 [0,1,0,0,1,0|1,0,0]=3 415 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(c2)F WXVL_AF0342SC00025 [0,1,0,0,1,0|1,0,0]=3 416 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(c2)F WXVL_AF0342SC00025 [0,1,0,0,1,0|1,0,0]=3 417 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(c2)O WXVL_AF0659SC00025 [0,1,0,0,1,0|1,0,0]=3 418 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(c2)O WXVL_AF0659SC00025 [0,1,0,0,1,0|1,0,0]=3 419 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(n2)Br WXVL_AF0737SC00025 [0,1,0,0,1,0|2,0,0]=4 420 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(n2)Br WXVL_AF0737SC00025 [0,1,0,0,1,0|2,0,0]=4 421 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(n2)C WXVL_AF0077SC00025 [0,1,0,0,1,0|2,0,0]=4 422 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(n2)C WXVL_AF0077SC00025 [0,1,0,0,1,0|2,0,0]=4 423 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(n2)Cl WXVL_AF0366SC00025 [0,1,0,0,1,0|2,0,0]=4 424 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cncc(n2)Cl WXVL_AF0366SC00025 [0,1,0,0,1,0|2,0,0]=4 425 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cnnc(c2)Cl WXVL_AF0119SC00025 [0,1,0,0,1,0|2,0,0]=4 426 B17R2.41874 CC1=C(CCO1)C(=O)Nc2cnnc(c2)Cl WXVL_AF0119SC00025 [0,1,0,0,1,0|2,0,0]=4 427 B17R2.41874 CC1=C(CCO1)C(=O)Nc2nccc(n2)I WXVL_AF4291SC00025 [0,1,0,0,1,0|2,0,0]=4 428 B17R2.41874 CC1=C(CCO1)C(=O)Nc2nccc(n2)I WXVL_AF4291SC00025 [0,1,0,0,1,0|2,0,0]=4 429 B17R2.41874 Cc1cccc(c1)NC(=O)c2ncoc2C WXVL_AG0052SC0732 [0,1,0,0,1,0|1,0,1]=4 430 B17R2.41874 Cc1cccc(c1)NC(=O)c2ncoc2C WXVL_AG0052SC0732 [0,1,0,0,1,0|1,0,1]=4 431 B17R2.41874 Cc1cccc(c1)NC(=O)c2sccc2C WXVL_AG0052SC0052 [0,1,0,0,1,0|0,0,2]=4 432 B17R2.41874 Cc1cccc(c1)NC(=O)c2sccc2C WXVL_AG0052SC0052 [0,1,0,0,1,0|0,0,2]=4 433 B17R2.41874 Cc1cccc(c1)NC(=O)c2scnc2C WXVL_AG0052SC0093 [0,1,0,0,1,0|1,0,1]=4 434 B17R2.41874 Cc1cccc(c1)NC(=O)c2scnc2C WXVL_AG0052SC0093 [0,1,0,0,1,0|1,0,1]=4 435 B17R2.41874 Cc1cccc(c1)NC(=O)c2snnc2C WXVL_AG0052SC0262 [0,1,0,0,1,0|2,0,0]=4 436 B17R2.41874 Cc1cccc(c1)NC(=O)c2snnc2C WXVL_AG0052SC0262 [0,1,0,0,1,0|2,0,0]=4 437 B17R2.41874 Cc1ccsc1C(=O)Nc2cccc(c2)I WXVL_AG0649SC0052 [0,1,0,0,1,0|0,0,2]=4 438 B17R2.41874 Cc1ccsc1C(=O)Nc2cccc(c2)I WXVL_AG0649SC0052 [0,1,0,0,1,0|0,0,2]=4 439 B17R2.41874 Cc1ccsc1C(=O)Nc2cccc(c2)O WXVL_AG00200SC0052 [0,1,0,0,1,0|0,0,2]=4 440 B17R2.41874 Cc1ccsc1C(=O)Nc2cccc(c2)O WXVL_AG00200SC0052 [0,1,0,0,1,0|0,0,2]=4 441 B17R2.41874 Cc1ncsc1C(=O)Nc2cccc(c2)I WXVL_AG0649SC0093 [0,1,0,0,1,0|1,0,1]=4 442 B17R2.41874 Cc1ncsc1C(=O)Nc2cccc(c2)I WXVL_AG0649SC0093 [0,1,0,0,1,0|1,0,1]=4 443 B17R2.41874 Cc1ncsc1C(=O)Nc2cccc(c2)O WXVL_AG00200SC0093 [0,1,0,0,1,0|1,0,1]=4 444 B17R2.41874 Cc1ncsc1C(=O)Nc2cccc(c2)O WXVL_AG00200SC0093 [0,1,0,0,1,0|1,0,1]=4 445 B17R2.41874 Cc1nnsc1C(=O)Nc2cccc(c2)I WXVL_AG0649SC0262 [0,1,0,0,1,0|2,0,0]=4 446 B17R2.41874 Cc1nnsc1C(=O)Nc2cccc(c2)I WXVL_AG0649SC0262 [0,1,0,0,1,0|2,0,0]=4 447 B17R2.41874 Cc1nnsc1C(=O)Nc2cccc(c2)O WXVL_AG00200SC0262 [0,1,0,0,1,0|2,0,0]=4 448 B17R2.41874 Cc1nnsc1C(=O)Nc2cccc(c2)O WXVL_AG00200SC0262 [0,1,0,0,1,0|2,0,0]=4 449 B17R2.41874 Cc1ocnc1C(=O)Nc2cccc(c2)I WXVL_AG0649SC0732 [0,1,0,0,1,0|1,0,1]=4 450 B17R2.41874 Cc1ocnc1C(=O)Nc2cccc(c2)I WXVL_AG0649SC0732 [0,1,0,0,1,0|1,0,1]=4 451 B17R2.41874 Cc1ocnc1C(=O)Nc2cccc(c2)O WXVL_AG00200SC0732 [0,1,0,0,1,0|1,0,1]=4 452 B17R2.41874 Cc1ocnc1C(=O)Nc2cccc(c2)O WXVL_AG00200SC0732 [0,1,0,0,1,0|1,0,1]=4 453 B15R2.64 O=C(Nc1ccccc1)C2CCCO2 WXVL_AG00183SB1033 [1,0,0,0,1,0|1,0,1]=4 454 B15R2.64 O=C(Nc1ccccc1)C2CCCO2 WXVL_AG00183SB1033 [1,0,0,0,1,0|1,0,1]=4 455 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 WXVL_AG00183SB0022 [1,0,0,0,1,0|0,0,2]=4 456 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 WXVL_AG00183SB0022 [1,0,0,0,1,0|0,0,2]=4 457 B15R2.64 O=C(Nc1ccccc1)[C@H]2CCCO2 WXVL_AG00183SB00043 [1,0,0,0,1,0|1,0,1]=4 458 B15R2.64 O=C(Nc1ccccc1)[C@H]2CCCO2 WXVL_AG00183SB00043 [1,0,0,0,1,0|1,0,1]=4 459 B15R2.64 O=C(Nc1ccccc1)c2cccs2 WXVL_AG00183SC0051 [1,0,0,0,1,0|0,0,2]=4 460 B15R2.64 O=C(Nc1ccccc1)c2cccs2 WXVL_AG00183SC0051 [1,0,0,0,1,0|0,0,2]=4 461 B15R2.64 O=C(Nc1ccccc1)c2ccns2 WXVL_AG00183SC0027 [1,0,0,0,1,0|1,0,1]=4 462 B15R2.64 O=C(Nc1ccccc1)c2ccns2 WXVL_AG00183SC0027 [1,0,0,0,1,0|1,0,1]=4 463 B15R2.64 O=C(Nc1ccccc1)c2ccoc2 WXVL_AG00183SC0050 [1,0,0,0,1,0|0,0,2]=4 464 B15R2.64 O=C(Nc1ccccc1)c2ccoc2 WXVL_AG00183SC0050 [1,0,0,0,1,0|0,0,2]=4 465 B15R2.64 O=C(Nc1ccccc1)c2cncs2 WXVL_AG00183SC0113 [1,0,0,0,1,0|1,0,1]=4 466 B15R2.64 O=C(Nc1ccccc1)c2cncs2 WXVL_AG00183SC0113 [1,0,0,0,1,0|1,0,1]=4 467 B15R2.64 O=C(Nc1ccccc1)c2cocn2 WXVL_AG00183SC0118 [1,0,0,0,1,0|1,0,1]=4 468 B15R2.64 O=C(Nc1ccccc1)c2cocn2 WXVL_AG00183SC0118 [1,0,0,0,1,0|1,0,1]=4 469 B15R2.1259 O=C(Nc1ccsc1)C2=COCCC2 WXVL_AF00105SB2928 [1,0,0,0,1,0|2,0,0]=4 470 B15R2.1259 O=C(Nc1ccsc1)C2=COCCC2 WXVL_AF00105SB2928 [1,0,0,0,1,0|2,0,0]=4 471 B15R2.410 CC1=C(CCO1)C(=O)Nc2cc[nH]n2 WXVL_AF2373SC00025 [0,0,0,0,2,0|2,0,0]=4 472 B15R2.410 CC1=C(CCO1)C(=O)Nc2cc[nH]n2 WXVL_AF2373SC00025 [0,0,0,0,2,0|2,0,0]=4 473 B15R2.410 CC1=C(CCO1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC00025 [0,0,0,0,2,0|2,0,0]=4 474 B15R2.410 CC1=C(CCO1)C(=O)Nc2ccn[nH]2 WXVL_AF0122SC00025 [0,0,0,0,2,0|2,0,0]=4 475 B15R2.410 CC1=C(CCO1)C(=O)Nc2ccno2 WXVL_AF0588SC00025 [0,0,0,0,2,0|2,0,0]=4 476 B15R2.410 CC1=C(CCO1)C(=O)Nc2ccno2 WXVL_AF0588SC00025 [0,0,0,0,2,0|2,0,0]=4 477 B15R2.410 CC1=C(CCO1)C(=O)Nc2ccns2 WXVL_AF00325SC00025 [0,0,0,0,2,0|2,0,0]=4 478 B15R2.410 CC1=C(CCO1)C(=O)Nc2ccns2 WXVL_AF00325SC00025 [0,0,0,0,2,0|2,0,0]=4 479 B15R2.410 CC1=C(CCO1)C(=O)Nc2ccon2 WXVL_AF0028SC00025 [0,0,0,0,2,0|2,0,0]=4 480 B15R2.410 CC1=C(CCO1)C(=O)Nc2ccon2 WXVL_AF0028SC00025 [0,0,0,0,2,0|2,0,0]=4 481 B15R2.410 CC1=C(CCO1)C(=O)Nc2ccsc2 WXVL_AF00105SC00025 [0,0,0,0,2,0|1,0,0]=3 482 B15R2.410 CC1=C(CCO1)C(=O)Nc2ccsc2 WXVL_AF00105SC00025 [0,0,0,0,2,0|1,0,0]=3 483 B15R2.410 CC1=C(CCO1)C(=O)Nc2cn[nH]c2 WXVL_AF0097SC00025 [0,0,0,0,2,0|2,0,0]=4 484 B15R2.410 CC1=C(CCO1)C(=O)Nc2cn[nH]c2 WXVL_AF0097SC00025 [0,0,0,0,2,0|2,0,0]=4 485 B15R2.410 CC1=C(CCO1)C(=O)Nc2cnc[nH]2 WXVL_AF00103SC00025 [0,0,0,0,2,0|2,0,0]=4 486 B15R2.410 CC1=C(CCO1)C(=O)Nc2cnc[nH]2 WXVL_AF00103SC00025 [0,0,0,0,2,0|2,0,0]=4 487 B15R2.410 CC1=C(CCO1)C(=O)Nc2cncs2 WXVL_AF0724SC00025 [0,0,0,0,2,0|2,0,0]=4 488 B15R2.410 CC1=C(CCO1)C(=O)Nc2cncs2 WXVL_AF0724SC00025 [0,0,0,0,2,0|2,0,0]=4 489 B15R2.410 CC1=C(CCO1)C(=O)Nc2cnoc2 WXVL_AF0677SC00025 [0,0,0,0,2,0|2,0,0]=4 490 B15R2.410 CC1=C(CCO1)C(=O)Nc2cnoc2 WXVL_AF0677SC00025 [0,0,0,0,2,0|2,0,0]=4 491 B15R2.410 CC1=C(CCO1)C(=O)Nc2cnsc2 WXVL_AF00176SC00025 [0,0,0,0,2,0|2,0,0]=4 492 B15R2.410 CC1=C(CCO1)C(=O)Nc2cnsc2 WXVL_AF00176SC00025 [0,0,0,0,2,0|2,0,0]=4 493 B15R2.410 CC1=C(CCO1)C(=O)Nc2cscn2 WXVL_AF00216SC00025 [0,0,0,0,2,0|2,0,0]=4 494 B15R2.410 CC1=C(CCO1)C(=O)Nc2cscn2 WXVL_AF00216SC00025 [0,0,0,0,2,0|2,0,0]=4 495 B15R2.410 CC1=C(CCO1)C(=O)Nc2ncc[nH]2 WXVL_AF0297SC00025 [0,0,0,0,2,0|2,0,0]=4 496 B15R2.410 CC1=C(CCO1)C(=O)Nc2ncc[nH]2 WXVL_AF0297SC00025 [0,0,0,0,2,0|2,0,0]=4 497 B15R2.410 CC1=C(CCO1)C(=O)Nc2ncco2 WXVL_AF0235SC00025 [0,0,0,0,2,0|2,0,0]=4 498 B15R2.410 CC1=C(CCO1)C(=O)Nc2ncco2 WXVL_AF0235SC00025 [0,0,0,0,2,0|2,0,0]=4 499 B15R2.410 CC1=C(CCO1)C(=O)Nc2nccs2 WXVL_AF0003SC00025 [0,0,0,0,2,0|2,0,0]=4 500 B15R2.410 CC1=C(CCO1)C(=O)Nc2nccs2 WXVL_AF0003SC00025 [0,0,0,0,2,0|2,0,0]=4 501 B17R2.2342 O=C(NCc1ccccc1)C2=CCCCO2 WXVL_AK00502SB4858 [1,0,0,0,0,1|1,1,0]=4 502 B17R2.2342 O=C(NCc1ccccc1)C2=CCCCO2 WXVL_AK00502SB4858 [1,0,0,0,0,1|1,1,0]=4 503 B17R2.2342 O=C(NCc1ccccc1)C2=COCCC2 WXVL_AK00502SB2928 [1,0,0,0,0,1|1,0,0]=3 504 B17R2.2342 O=C(NCc1ccccc1)C2=COCCC2 WXVL_AK00502SB2928 [1,0,0,0,0,1|1,0,0]=3 505 B17R2.2342 O=C(NCc1ccccn1)C2=COCCC2 WXVL_AK0018SB2928 [1,0,0,0,0,1|2,0,0]=4 506 B17R2.2342 O=C(NCc1ccccn1)C2=COCCC2 WXVL_AK0018SB2928 [1,0,0,0,0,1|2,0,0]=4 507 B17R2.2342 O=C(NCc1cccnc1)C2=COCCC2 WXVL_AK0020SB2928 [1,0,0,0,0,1|2,0,0]=4 508 B17R2.2342 O=C(NCc1cccnc1)C2=COCCC2 WXVL_AK0020SB2928 [1,0,0,0,0,1|2,0,0]=4 509 B17R2.2342 O=C(NCc1ccncc1)C2=COCCC2 WXVL_AK0021SB2928 [1,0,0,0,0,1|2,0,0]=4 510 B17R2.2342 O=C(NCc1ccncc1)C2=COCCC2 WXVL_AK0021SB2928 [1,0,0,0,0,1|2,0,0]=4 511 B17R2.3530 CC1=C(CCO1)C(=O)NCc2ccccc2 WXVL_AK00502SC00025 [0,0,0,0,1,1|0,0,0]=2 512 B17R2.3530 CC1=C(CCO1)C(=O)NCc2ccccc2 WXVL_AK00502SC00025 [0,0,0,0,1,1|0,0,0]=2 513 B17R2.3530 CC1=C(CCO1)C(=O)NCc2ccccn2 WXVL_AK0018SC00025 [0,0,0,0,1,1|1,0,0]=3 514 B17R2.3530 CC1=C(CCO1)C(=O)NCc2ccccn2 WXVL_AK0018SC00025 [0,0,0,0,1,1|1,0,0]=3 515 B17R2.3530 CC1=C(CCO1)C(=O)NCc2cccnc2 WXVL_AK0020SC00025 [0,0,0,0,1,1|1,0,0]=3 516 B17R2.3530 CC1=C(CCO1)C(=O)NCc2cccnc2 WXVL_AK0020SC00025 [0,0,0,0,1,1|1,0,0]=3 517 B17R2.3530 CC1=C(CCO1)C(=O)NCc2ccncc2 WXVL_AK0021SC00025 [0,0,0,0,1,1|1,0,0]=3 518 B17R2.3530 CC1=C(CCO1)C(=O)NCc2ccncc2 WXVL_AK0021SC00025 [0,0,0,0,1,1|1,0,0]=3 519 B17R2.3530 CC1=C(CCO1)C(=O)NCc2ccncn2 WXVL_AK1356SC00025 [0,0,0,0,1,1|2,0,0]=4 520 B17R2.3530 CC1=C(CCO1)C(=O)NCc2ccncn2 WXVL_AK1356SC00025 [0,0,0,0,1,1|2,0,0]=4 521 B17R2.3530 CC1=C(CCO1)C(=O)NCc2cnccn2 WXVL_AK00262SC00025 [0,0,0,0,1,1|2,0,0]=4 522 B17R2.3530 CC1=C(CCO1)C(=O)NCc2cnccn2 WXVL_AK00262SC00025 [0,0,0,0,1,1|2,0,0]=4 523 B17R2.3530 CC1=C(CCO1)C(=O)NCc2cncnc2 WXVL_AK1364SC00025 [0,0,0,0,1,1|2,0,0]=4 524 B17R2.3530 CC1=C(CCO1)C(=O)NCc2cncnc2 WXVL_AK1364SC00025 [0,0,0,0,1,1|2,0,0]=4 525 B17R2.3530 CC1=C(CCO1)C(=O)NCc2ncccn2 WXVL_AK0279SC00025 [0,0,0,0,1,1|2,0,0]=4 526 B17R2.3530 CC1=C(CCO1)C(=O)NCc2ncccn2 WXVL_AK0279SC00025 [0,0,0,0,1,1|2,0,0]=4 527 B17R2.3530 Cc1ccsc1C(=O)NCc2ccccc2 WXVL_AK00502SC0052 [0,0,0,0,1,1|0,0,2]=4 528 B17R2.3530 Cc1ccsc1C(=O)NCc2ccccc2 WXVL_AK00502SC0052 [0,0,0,0,1,1|0,0,2]=4 529 B17R2.3530 Cc1ncsc1C(=O)NCc2ccccc2 WXVL_AK00502SC0093 [0,0,0,0,1,1|1,0,1]=4 530 B17R2.3530 Cc1ncsc1C(=O)NCc2ccccc2 WXVL_AK00502SC0093 [0,0,0,0,1,1|1,0,1]=4 531 B17R2.3530 Cc1nnsc1C(=O)NCc2ccccc2 WXVL_AK00502SC0262 [0,0,0,0,1,1|2,0,0]=4 532 B17R2.3530 Cc1nnsc1C(=O)NCc2ccccc2 WXVL_AK00502SC0262 [0,0,0,0,1,1|2,0,0]=4 533 B17R2.3530 Cc1ocnc1C(=O)NCc2ccccc2 WXVL_AK00502SC0732 [0,0,0,0,1,1|1,0,1]=4 534 B17R2.3530 Cc1ocnc1C(=O)NCc2ccccc2 WXVL_AK00502SC0732 [0,0,0,0,1,1|1,0,1]=4