0 B16R2.27 Cc1ccc(cc1c2ccccc2)C=O WXVL_QS0887BT0919 [0,1,0,0,0,0|2,0,1]=4 1 B16R2.27 Cc1ccc(cc1c2ccccc2)C=O WXVL_QS0887BT1115 [0,1,0,0,0,0|2,0,1]=4 2 B16R2.27 Cc1ccc(cc1c2ccccc2)C=O WXVL_QS0887BT2957 [0,1,0,0,0,0|2,0,1]=4 3 B16R2.27 O=Cc1ccc(c(c1)c2ccccc2)Cl WXVL_QS1570BT0919 [0,1,0,0,0,0|2,0,1]=4 4 B16R2.27 O=Cc1ccc(c(c1)c2ccccc2)Cl WXVL_QS1570BT1115 [0,1,0,0,0,0|2,0,1]=4 5 B16R2.27 O=Cc1ccc(c(c1)c2ccccc2)Cl WXVL_QS1570BT2957 [0,1,0,0,0,0|2,0,1]=4 6 B16R2.27 O=Cc1ccc(c(c1)c2ccccc2)F WXVL_QS0427BT0919 [0,1,0,0,0,0|2,0,1]=4 7 B16R2.27 O=Cc1ccc(c(c1)c2ccccc2)F WXVL_QS0427BT1115 [0,1,0,0,0,0|2,0,1]=4 8 B16R2.27 O=Cc1ccc(c(c1)c2ccccc2)F WXVL_QS0427BT2957 [0,1,0,0,0,0|2,0,1]=4 9 B16R2.27 O=Cc1ccc(c(c1)c2ccccc2)O WXVL_QS0157BT0919 [0,1,0,0,0,0|1,0,2]=4 10 B16R2.27 O=Cc1ccc(c(c1)c2ccccc2)O WXVL_QS0157BT1115 [0,1,0,0,0,0|1,0,2]=4 11 B16R2.27 O=Cc1ccc(c(c1)c2ccccc2)O WXVL_QS0157BT2957 [0,1,0,0,0,0|1,0,2]=4 12 B16R2.2443 Cc1ccc(c(c1)c2ccccc2)C=O WXVL_QS0467BT0919 [0,1,0,0,0,0|1,0,0]=2 13 B16R2.2443 Cc1ccc(c(c1)c2ccccc2)C=O WXVL_QS0467BT1115 [0,1,0,0,0,0|1,0,0]=2 14 B16R2.2443 Cc1ccc(c(c1)c2ccccc2)C=O WXVL_QS0467BT2957 [0,1,0,0,0,0|1,0,0]=2 15 B16R2.2443 Cc1ccc(c(c1)c2ccccn2)C=O WXVL_QS0467BT0164 [0,1,0,0,0,0|2,0,0]=3 16 B16R2.2443 Cc1ccc(c(c1)c2cccnc2)C=O WXVL_QS0467BT1208 [0,1,0,0,0,0|2,0,0]=3 17 B16R2.2443 Cc1ccc(c(c1)c2cccnc2)C=O WXVL_QS0467BT3912 [0,1,0,0,0,0|2,0,0]=3 18 B16R2.2443 Cc1ccc(c(c1)c2ccncc2)C=O WXVL_QS0467BT0574 [0,1,0,0,0,0|2,0,0]=3 19 B16R2.2443 Cc1ccc(c(c1)c2ccnnc2)C=O WXVL_QS0467BT1744 [0,1,0,0,0,0|3,0,0]=4 20 B16R2.2443 Cc1ccc(c(n1)c2ccccc2)C=O WXVL_QS3039BT0919 [0,1,0,0,0,0|2,0,0]=3 21 B16R2.2443 Cc1ccc(c(n1)c2ccccc2)C=O WXVL_QS3039BT1115 [0,1,0,0,0,0|2,0,0]=3 22 B16R2.2443 Cc1ccc(c(n1)c2ccccc2)C=O WXVL_QS3039BT2957 [0,1,0,0,0,0|2,0,0]=3 23 B16R2.2443 Cc1ccc(c(n1)c2ccccn2)C=O WXVL_QS3039BT0164 [0,1,0,0,0,0|3,0,0]=4 24 B16R2.2443 Cc1ccc(c(n1)c2cccnc2)C=O WXVL_QS3039BT1208 [0,1,0,0,0,0|3,0,0]=4 25 B16R2.2443 Cc1ccc(c(n1)c2cccnc2)C=O WXVL_QS3039BT3912 [0,1,0,0,0,0|3,0,0]=4 26 B16R2.2443 Cc1ccc(c(n1)c2ccncc2)C=O WXVL_QS3039BT0574 [0,1,0,0,0,0|3,0,0]=4 27 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)Cl WXVL_QS1071BT0919 [0,1,0,0,0,0|2,0,0]=3 28 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)Cl WXVL_QS1071BT1115 [0,1,0,0,0,0|2,0,0]=3 29 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)Cl WXVL_QS1071BT2957 [0,1,0,0,0,0|2,0,0]=3 30 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)F WXVL_QS0426BT0919 [0,1,0,0,0,0|2,0,0]=3 31 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)F WXVL_QS0426BT1115 [0,1,0,0,0,0|2,0,0]=3 32 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)F WXVL_QS0426BT2957 [0,1,0,0,0,0|2,0,0]=3 33 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)I WXVL_QS1077BT0919 [0,1,0,0,0,0|2,0,0]=3 34 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)I WXVL_QS1077BT1115 [0,1,0,0,0,0|2,0,0]=3 35 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)I WXVL_QS1077BT2957 [0,1,0,0,0,0|2,0,0]=3 36 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)O WXVL_QS0348BT0919 [0,1,0,0,0,0|2,0,0]=3 37 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)O WXVL_QS0348BT1115 [0,1,0,0,0,0|2,0,0]=3 38 B16R2.2443 O=Cc1ccc(cc1c2ccccc2)O WXVL_QS0348BT2957 [0,1,0,0,0,0|2,0,0]=3 39 B16R2.2443 O=Cc1ccc(cc1c2ccccn2)Cl WXVL_QS1071BT0164 [0,1,0,0,0,0|3,0,0]=4 40 B16R2.2443 O=Cc1ccc(cc1c2ccccn2)F WXVL_QS0426BT0164 [0,1,0,0,0,0|3,0,0]=4 41 B16R2.2443 O=Cc1ccc(cc1c2ccccn2)I WXVL_QS1077BT0164 [0,1,0,0,0,0|3,0,0]=4 42 B16R2.2443 O=Cc1ccc(cc1c2ccccn2)O WXVL_QS0348BT0164 [0,1,0,0,0,0|3,0,0]=4 43 B16R2.2443 O=Cc1ccc(cc1c2cccnc2)Cl WXVL_QS1071BT1208 [0,1,0,0,0,0|3,0,0]=4 44 B16R2.2443 O=Cc1ccc(cc1c2cccnc2)Cl WXVL_QS1071BT3912 [0,1,0,0,0,0|3,0,0]=4 45 B16R2.2443 O=Cc1ccc(cc1c2cccnc2)F WXVL_QS0426BT1208 [0,1,0,0,0,0|3,0,0]=4 46 B16R2.2443 O=Cc1ccc(cc1c2cccnc2)F WXVL_QS0426BT3912 [0,1,0,0,0,0|3,0,0]=4 47 B16R2.2443 O=Cc1ccc(cc1c2cccnc2)I WXVL_QS1077BT1208 [0,1,0,0,0,0|3,0,0]=4 48 B16R2.2443 O=Cc1ccc(cc1c2cccnc2)I WXVL_QS1077BT3912 [0,1,0,0,0,0|3,0,0]=4 49 B16R2.2443 O=Cc1ccc(cc1c2cccnc2)O WXVL_QS0348BT1208 [0,1,0,0,0,0|3,0,0]=4 50 B16R2.2443 O=Cc1ccc(cc1c2cccnc2)O WXVL_QS0348BT3912 [0,1,0,0,0,0|3,0,0]=4 51 B16R2.2443 O=Cc1ccc(cc1c2ccncc2)Cl WXVL_QS1071BT0574 [0,1,0,0,0,0|3,0,0]=4 52 B16R2.2443 O=Cc1ccc(cc1c2ccncc2)F WXVL_QS0426BT0574 [0,1,0,0,0,0|3,0,0]=4 53 B16R2.2443 O=Cc1ccc(cc1c2ccncc2)I WXVL_QS1077BT0574 [0,1,0,0,0,0|3,0,0]=4 54 B16R2.2443 O=Cc1ccc(cc1c2ccncc2)O WXVL_QS0348BT0574 [0,1,0,0,0,0|3,0,0]=4 55 B16R2.2443 O=Cc1cnc(cc1c2ccccc2)Cl WXVL_QS1847BT0919 [0,1,0,0,0,0|3,0,0]=4 56 B16R2.2443 O=Cc1cnc(cc1c2ccccc2)Cl WXVL_QS1847BT1115 [0,1,0,0,0,0|3,0,0]=4 57 B16R2.2443 O=Cc1cnc(cc1c2ccccc2)Cl WXVL_QS1847BT2957 [0,1,0,0,0,0|3,0,0]=4 58 B14R1.423 C=C(C)CNC(=O)Cc1ccccc1 WXVL_AK0761SB0092 [0,0,1,0,0,0|2,0,1]=4 59 B14R1.423 C=C(C)CNC(=O)Cc1ccccc1 WXVL_AK0761SB0092 [0,0,1,0,0,0|2,0,1]=4 60 B14R1.423 C=C(C)CNC(=O)Nc1ccccn1 WXVL_AK0761YV0189 [0,0,1,0,0,0|2,0,1]=4 61 B14R1.423 C=C(C)CNC(=O)Nc1ccccn1 WXVL_AK0761YV0189 [0,0,1,0,0,0|2,0,1]=4 62 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 WXVL_AG00183SB0072 [0,0,1,0,0,0|1,0,2]=4 63 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 WXVL_AG00183SB0072 [0,0,1,0,0,0|1,0,2]=4 64 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 WXVL_AG00183SB0357 [0,0,1,0,0,0|2,0,1]=4 65 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 WXVL_AG00183SB0357 [0,0,1,0,0,0|2,0,1]=4 66 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 WXVL_AK2641SB0150 [0,0,1,0,0,0|2,0,1]=4 67 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 WXVL_AK2641SB0150 [0,0,1,0,0,0|2,0,1]=4 68 B14R1.423 CC(=O)OCC(=O)Nc1ccccc1 WXVL_AG00183SB2824 [0,0,1,0,0,0|2,0,1]=4 69 B14R1.423 CC(=O)OCC(=O)Nc1ccccc1 WXVL_AG00183SB2824 [0,0,1,0,0,0|2,0,1]=4 70 B14R1.423 CC(=O)SCC(=O)Nc1ccccc1 WXVL_AG00183SB3992 [0,0,1,0,0,0|2,0,1]=4 71 B14R1.423 CC(=O)SCC(=O)Nc1ccccc1 WXVL_AG00183SB3992 [0,0,1,0,0,0|2,0,1]=4 72 B14R1.423 CC(C)/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB0036 [0,0,1,0,0,0|0,0,2]=3 73 B14R1.423 CC(C)/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB0036 [0,0,1,0,0,0|0,0,2]=3 74 B14R1.423 CC(C)/C=C/C(=O)Nc1ccccn1 WXVL_AF00298SB0036 [0,0,1,0,0,0|1,0,2]=4 75 B14R1.423 CC(C)/C=C/C(=O)Nc1ccccn1 WXVL_AF00298SB0036 [0,0,1,0,0,0|1,0,2]=4 76 B14R2.306 Cc1ccc(c(c1)c2cccs2)C WXVL_LR0498BT0645 [0,0,0,0,1,0|3,0,0]=4 77 B14R2.306 Cc1ccc(c(c1)c2cccs2)O WXVL_LR0498BT2739 [0,0,0,0,1,0|2,0,1]=4 78 B14R2.306 Cc1ccc(c(c1)c2cccs2)O WXVL_LR0498BT3163 [0,0,0,0,1,0|2,0,1]=4 79 B14R2.598 Cc1cc(c(s1)C)c2ccccc2 WXVL_LR1593BT0919 [0,0,0,0,1,0|3,0,0]=4 80 B14R2.598 Cc1cc(c(s1)C)c2ccccc2 WXVL_LR1593BT1115 [0,0,0,0,1,0|3,0,0]=4 81 B14R2.598 Cc1cc(c(s1)C)c2ccccc2 WXVL_LR1593BT2957 [0,0,0,0,1,0|3,0,0]=4 82 B13R1.44 C=CCCC(=O)Nc1ccccc1 WXVL_AG00183SB1035 [1,0,1,0,0,0|0,0,2]=4 83 B13R1.44 C=CCCC(=O)Nc1ccccc1 WXVL_AG00183SB1035 [1,0,1,0,0,0|0,0,2]=4 84 B13R1.44 O=C(/C=C/CBr)Nc1ccccc1 WXVL_AG00183SB0424 [1,0,1,0,0,0|1,0,1]=4 85 B13R1.44 O=C(/C=C/CBr)Nc1ccccc1 WXVL_AG00183SB0424 [1,0,1,0,0,0|1,0,1]=4 86 B15R1.111 C=C(C)CNC(=O)Nc1ccc(cc1)C WXVL_AK0761YV0026 [0,1,1,0,0,0|1,0,1]=4 87 B15R1.111 C=C(C)CNC(=O)Nc1ccc(cc1)C WXVL_AK0761YV0026 [0,1,1,0,0,0|1,0,1]=4 88 B15R1.111 C=C(C)CNC(=O)Nc1ccc(cc1)Cl WXVL_AK0761YV0023 [0,1,1,0,0,0|1,0,1]=4 89 B15R1.111 C=C(C)CNC(=O)Nc1ccc(cc1)Cl WXVL_AK0761YV0023 [0,1,1,0,0,0|1,0,1]=4 90 B15R1.111 CC(C)/C=C/C(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0036 [0,1,1,0,0,0|0,0,2]=4 91 B15R1.111 CC(C)/C=C/C(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0036 [0,1,1,0,0,0|0,0,2]=4 92 B15R1.111 CC(C)/C=C/C(=O)Nc1ccc(cc1)I WXVL_AG1742SB0036 [0,1,1,0,0,0|0,0,2]=4 93 B15R1.111 CC(C)/C=C/C(=O)Nc1ccc(cc1)I WXVL_AG1742SB0036 [0,1,1,0,0,0|0,0,2]=4 94 B15R1.120 C=C(C)CNC(=O)Nc1cccc(c1)Br WXVL_AK0761YV0098 [0,1,1,0,0,0|1,0,1]=4 95 B15R1.120 C=C(C)CNC(=O)Nc1cccc(c1)Br WXVL_AK0761YV0098 [0,1,1,0,0,0|1,0,1]=4 96 B15R1.120 C=C(C)CNC(=O)Nc1cccc(c1)C WXVL_AK0761YV0020 [0,1,1,0,0,0|1,0,1]=4 97 B15R1.120 C=C(C)CNC(=O)Nc1cccc(c1)C WXVL_AK0761YV0020 [0,1,1,0,0,0|1,0,1]=4 98 B15R1.120 C=C(C)CNC(=O)Nc1cccc(c1)Cl WXVL_AK0761YV0016 [0,1,1,0,0,0|1,0,1]=4 99 B15R1.120 C=C(C)CNC(=O)Nc1cccc(c1)Cl WXVL_AK0761YV0016 [0,1,1,0,0,0|1,0,1]=4 100 B15R1.120 CC(C)/C=C/C(=O)Nc1cccc(c1)I WXVL_AG0649SB0036 [0,1,1,0,0,0|0,0,2]=4 101 B15R1.120 CC(C)/C=C/C(=O)Nc1cccc(c1)I WXVL_AG0649SB0036 [0,1,1,0,0,0|0,0,2]=4 102 B15R1.120 CC(C)/C=C/C(=O)Nc1cccc(c1)O WXVL_AG00200SB0036 [0,1,1,0,0,0|0,0,2]=4 103 B15R1.120 CC(C)/C=C/C(=O)Nc1cccc(c1)O WXVL_AG00200SB0036 [0,1,1,0,0,0|0,0,2]=4 104 B15R1.120 Cc1cccc(c1)NC(=O)/C=C/C(C)C WXVL_AG0052SB0036 [0,1,1,0,0,0|0,0,2]=4 105 B15R1.120 Cc1cccc(c1)NC(=O)/C=C/C(C)C WXVL_AG0052SB0036 [0,1,1,0,0,0|0,0,2]=4 106 B15R1.256 C=C(C)CNC(=O)Nc1ccccc1Br WXVL_AK0761YV0003 [0,1,1,0,0,0|1,0,1]=4 107 B15R1.256 C=C(C)CNC(=O)Nc1ccccc1Br WXVL_AK0761YV0003 [0,1,1,0,0,0|1,0,1]=4 108 B15R1.256 C=C(C)CNC(=O)Nc1ccccc1C WXVL_AK0761YV0013 [0,1,1,0,0,0|1,0,1]=4 109 B15R1.256 C=C(C)CNC(=O)Nc1ccccc1C WXVL_AK0761YV0013 [0,1,1,0,0,0|1,0,1]=4 110 B15R1.256 C=C(C)CNC(=O)Nc1ccccc1Cl WXVL_AK0761YV0007 [0,1,1,0,0,0|1,0,1]=4 111 B15R1.256 C=C(C)CNC(=O)Nc1ccccc1Cl WXVL_AK0761YV0007 [0,1,1,0,0,0|1,0,1]=4 112 B15R1.256 CC(C)/C=C/C(=O)Nc1ccccc1Br WXVL_AG00180SB0036 [0,1,1,0,0,0|0,0,2]=4 113 B15R1.256 CC(C)/C=C/C(=O)Nc1ccccc1Br WXVL_AG00180SB0036 [0,1,1,0,0,0|0,0,2]=4 114 B15R1.256 CC(C)/C=C/C(=O)Nc1ccccc1Cl WXVL_AG00129SB0036 [0,1,1,0,0,0|0,0,2]=4 115 B15R1.256 CC(C)/C=C/C(=O)Nc1ccccc1Cl WXVL_AG00129SB0036 [0,1,1,0,0,0|0,0,2]=4 116 B15R1.256 CC(C)/C=C/C(=O)Nc1ccccc1I WXVL_AG0385SB0036 [0,1,1,0,0,0|0,0,2]=4 117 B15R1.256 CC(C)/C=C/C(=O)Nc1ccccc1I WXVL_AG0385SB0036 [0,1,1,0,0,0|0,0,2]=4 118 B15R1.256 Cc1ccccc1NC(=O)/C=C/C(C)C WXVL_AG0027SB0036 [0,1,1,0,0,0|0,0,2]=4 119 B15R1.256 Cc1ccccc1NC(=O)/C=C/C(C)C WXVL_AG0027SB0036 [0,1,1,0,0,0|0,0,2]=4 120 B15R1.3675 C/C(=C/C(=O)Nc1ccccc1)/C(=O)O WXVL_AG00183SB2187 [0,1,1,0,0,0|2,0,0]=4 121 B15R1.3675 C/C(=C/C(=O)Nc1ccccc1)/C(=O)O WXVL_AG00183SB2187 [0,1,1,0,0,0|2,0,0]=4 122 B15R2.17 O=Cc1cccc(c1)c2ccccc2 WXVL_QS0055BT0919 [1,1,0,0,0,0|1,0,1]=4 123 B15R2.17 O=Cc1cccc(c1)c2ccccc2 WXVL_QS0055BT1115 [1,1,0,0,0,0|1,0,1]=4 124 B15R2.17 O=Cc1cccc(c1)c2ccccc2 WXVL_QS0055BT2957 [1,1,0,0,0,0|1,0,1]=4 125 B15R2.21 O=Cc1ccccc1c2ccccc2 WXVL_QS0019BT0919 [1,1,0,0,0,0|1,0,0]=3 126 B15R2.21 O=Cc1ccccc1c2ccccc2 WXVL_QS0019BT1115 [1,1,0,0,0,0|1,0,0]=3 127 B15R2.21 O=Cc1ccccc1c2ccccc2 WXVL_QS0019BT2957 [1,1,0,0,0,0|1,0,0]=3 128 B15R2.21 O=Cc1ccccc1c2ccccn2 WXVL_QS0019BT0164 [1,1,0,0,0,0|2,0,0]=4 129 B15R2.21 O=Cc1ccccc1c2cccnc2 WXVL_QS0019BT1208 [1,1,0,0,0,0|2,0,0]=4 130 B15R2.21 O=Cc1ccccc1c2cccnc2 WXVL_QS0019BT3912 [1,1,0,0,0,0|2,0,0]=4 131 B15R2.21 O=Cc1ccccc1c2ccncc2 WXVL_QS0019BT0574 [1,1,0,0,0,0|2,0,0]=4 132 B15R2.21 O=Cc1cccnc1c2ccccc2 WXVL_QS0466BT0919 [1,1,0,0,0,0|2,0,0]=4 133 B15R2.21 O=Cc1cccnc1c2ccccc2 WXVL_QS0466BT1115 [1,1,0,0,0,0|2,0,0]=4 134 B15R2.21 O=Cc1cccnc1c2ccccc2 WXVL_QS0466BT2957 [1,1,0,0,0,0|2,0,0]=4 135 B15R2.21 O=Cc1ccncc1c2ccccc2 WXVL_QS0453BT0919 [1,1,0,0,0,0|2,0,0]=4 136 B15R2.21 O=Cc1ccncc1c2ccccc2 WXVL_QS0453BT1115 [1,1,0,0,0,0|2,0,0]=4 137 B15R2.21 O=Cc1ccncc1c2ccccc2 WXVL_QS0453BT2957 [1,1,0,0,0,0|2,0,0]=4 138 B15R2.21 O=Cc1ncccc1c2ccccc2 WXVL_QS1727BT0919 [1,1,0,0,0,0|2,0,0]=4 139 B15R2.21 O=Cc1ncccc1c2ccccc2 WXVL_QS1727BT1115 [1,1,0,0,0,0|2,0,0]=4 140 B15R2.21 O=Cc1ncccc1c2ccccc2 WXVL_QS1727BT2957 [1,1,0,0,0,0|2,0,0]=4 141 B15R2.4334 Cc1ccc(c(c1)c2cc[nH]c2)C=O WXVL_QS0467BT5115 [0,1,0,0,1,0|2,0,0]=4 142 B15R2.4334 Cc1ccc(c(c1)c2ccco2)C=O WXVL_QS0467BT1995 [0,1,0,0,1,0|2,0,0]=4 143 B15R2.4334 Cc1ccc(c(c1)c2cccs2)C=O WXVL_QS0467BT1547 [0,1,0,0,1,0|2,0,0]=4 144 B15R2.4334 Cc1ccc(c(c1)c2cccs2)C=O WXVL_QS0467BT4023 [0,1,0,0,1,0|2,0,0]=4 145 B15R2.4334 Cc1ccc(c(c1)c2cccs2)C=O WXVL_QS0467BT5079 [0,1,0,0,1,0|2,0,0]=4 146 B15R2.4334 Cc1ccc(c(c1)c2ccoc2)C=O WXVL_QS0467BT1598 [0,1,0,0,1,0|2,0,0]=4 147 B15R2.4334 Cc1ccc(c(c1)c2ccsc2)C=O WXVL_QS0467BT1561 [0,1,0,0,1,0|2,0,0]=4 148 B17R2.2808 COc1ccc(c(c1)c2ccccc2)C=O WXVL_QS1134BT0919 [0,2,0,0,0,0|1,0,0]=3 149 B17R2.2808 COc1ccc(c(c1)c2ccccc2)C=O WXVL_QS1134BT1115 [0,2,0,0,0,0|1,0,0]=3 150 B17R2.2808 COc1ccc(c(c1)c2ccccc2)C=O WXVL_QS1134BT2957 [0,2,0,0,0,0|1,0,0]=3 151 B17R2.2808 COc1ccc(c(c1)c2ccccn2)C=O WXVL_QS1134BT0164 [0,2,0,0,0,0|2,0,0]=4 152 B17R2.2808 COc1ccc(c(c1)c2cccnc2)C=O WXVL_QS1134BT1208 [0,2,0,0,0,0|2,0,0]=4 153 B17R2.2808 COc1ccc(c(c1)c2cccnc2)C=O WXVL_QS1134BT3912 [0,2,0,0,0,0|2,0,0]=4 154 B17R2.2808 COc1ccc(c(c1)c2ccncc2)C=O WXVL_QS1134BT0574 [0,2,0,0,0,0|2,0,0]=4 155 B17R2.2808 COc1ccc(c(n1)c2ccccc2)C=O WXVL_QS2674BT0919 [0,2,0,0,0,0|2,0,0]=4 156 B17R2.2808 COc1ccc(c(n1)c2ccccc2)C=O WXVL_QS2674BT1115 [0,2,0,0,0,0|2,0,0]=4 157 B17R2.2808 COc1ccc(c(n1)c2ccccc2)C=O WXVL_QS2674BT2957 [0,2,0,0,0,0|2,0,0]=4 158 B17R2.2808 N#Cc1ccc(c(c1)c2ccccc2)C=O WXVL_QS0446BT0919 [0,2,0,0,0,0|1,0,1]=4 159 B17R2.2808 N#Cc1ccc(c(c1)c2ccccc2)C=O WXVL_QS0446BT1115 [0,2,0,0,0,0|1,0,1]=4 160 B17R2.2808 N#Cc1ccc(c(c1)c2ccccc2)C=O WXVL_QS0446BT2957 [0,2,0,0,0,0|1,0,1]=4 161 B17R2.1938 Cc1cc(c(cc1C=O)C)c2ccccc2 WXVL_QS2710BT0919 [0,2,0,0,0,0|2,0,0]=4 162 B17R2.1938 Cc1cc(c(cc1C=O)C)c2ccccc2 WXVL_QS2710BT1115 [0,2,0,0,0,0|2,0,0]=4 163 B17R2.1938 Cc1cc(c(cc1C=O)C)c2ccccc2 WXVL_QS2710BT2957 [0,2,0,0,0,0|2,0,0]=4 164 B17R2.1938 Cc1cc(c(cc1C=O)F)c2ccccc2 WXVL_QS1142BT0919 [0,2,0,0,0,0|2,0,0]=4 165 B17R2.1938 Cc1cc(c(cc1C=O)F)c2ccccc2 WXVL_QS1142BT1115 [0,2,0,0,0,0|2,0,0]=4 166 B17R2.1938 Cc1cc(c(cc1C=O)F)c2ccccc2 WXVL_QS1142BT2957 [0,2,0,0,0,0|2,0,0]=4 167 B17R2.1939 O=Cc1cc(c(cc1c2ccccc2)F)F WXVL_QS1337BT0919 [0,2,0,0,0,0|2,0,0]=4 168 B17R2.1939 O=Cc1cc(c(cc1c2ccccc2)F)F WXVL_QS1337BT1115 [0,2,0,0,0,0|2,0,0]=4 169 B17R2.1939 O=Cc1cc(c(cc1c2ccccc2)F)F WXVL_QS1337BT2957 [0,2,0,0,0,0|2,0,0]=4 170 B17R2.1973 O=Cc1ccc(c(c1c2ccccc2)F)F WXVL_QS2913BT0919 [0,2,0,0,0,0|2,0,0]=4 171 B17R2.1973 O=Cc1ccc(c(c1c2ccccc2)F)F WXVL_QS2913BT1115 [0,2,0,0,0,0|2,0,0]=4 172 B17R2.1973 O=Cc1ccc(c(c1c2ccccc2)F)F WXVL_QS2913BT2957 [0,2,0,0,0,0|2,0,0]=4 173 B17R2.2405 Cc1ccc(c(c1)c2ccc(cc2)F)C=O WXVL_QS0467BT0486 [0,2,0,0,0,0|1,0,0]=3 174 B17R2.2405 Cc1ccc(c(c1)c2ccc(cc2)F)C=O WXVL_QS0467BT0698 [0,2,0,0,0,0|1,0,0]=3 175 B17R2.2405 Cc1ccc(c(c1)c2ccc(cc2)F)C=O WXVL_QS0467BT2075 [0,2,0,0,0,0|1,0,0]=3 176 B17R2.2405 Cc1ccc(c(c1)c2ccc(cc2)I)C=O WXVL_QS0467BT1574 [0,2,0,0,0,0|1,0,0]=3 177 B17R2.2405 Cc1ccc(c(c1)c2ccc(cc2)O)C=O WXVL_QS0467BT0555 [0,2,0,0,0,0|1,0,0]=3 178 B17R2.2405 Cc1ccc(c(c1)c2ccc(cc2)O)C=O WXVL_QS0467BT0699 [0,2,0,0,0,0|1,0,0]=3 179 B17R2.2405 Cc1ccc(c(c1)c2ccc(cc2)O)C=O WXVL_QS0467BT2080 [0,2,0,0,0,0|1,0,0]=3 180 B17R2.2405 Cc1ccc(c(c1)c2ccc(cc2)O)C=O WXVL_QS0467BT4830 [0,2,0,0,0,0|1,0,0]=3 181 B17R2.2405 Cc1ccc(c(c1)c2ccc(cc2)O)C=O WXVL_QS0467BT7243 [0,2,0,0,0,0|1,0,0]=3 182 B17R2.2405 Cc1ccc(c(c1)c2ccc(cn2)F)C=O WXVL_QS0467BT0922 [0,2,0,0,0,0|2,0,0]=4 183 B17R2.2405 Cc1ccc(c(c1)c2ccc(nc2)C)C=O WXVL_QS0467BT0751 [0,2,0,0,0,0|2,0,0]=4 184 B17R2.2405 Cc1ccc(c(c1)c2ccc(nc2)C)C=O WXVL_QS0467BT2089 [0,2,0,0,0,0|2,0,0]=4 185 B17R2.2405 Cc1ccc(c(c1)c2ccc(nc2)F)C=O WXVL_QS0467BT2539 [0,2,0,0,0,0|2,0,0]=4 186 B17R2.2405 Cc1ccc(c(c1)c2ccc(nc2)F)C=O WXVL_QS0467BT3542 [0,2,0,0,0,0|2,0,0]=4 187 B17R2.2405 Cc1ccc(c(c1)c2ccc(nc2)O)C=O WXVL_QS0467BT1025 [0,2,0,0,0,0|2,0,0]=4 188 B17R2.2405 Cc1ccc(c(c1)c2ccc(nc2)O)C=O WXVL_QS0467BT1602 [0,2,0,0,0,0|2,0,0]=4 189 B17R2.2405 Cc1ccc(c(n1)c2ccc(cc2)F)C=O WXVL_QS3039BT0486 [0,2,0,0,0,0|2,0,0]=4 190 B17R2.2405 Cc1ccc(c(n1)c2ccc(cc2)F)C=O WXVL_QS3039BT0698 [0,2,0,0,0,0|2,0,0]=4 191 B17R2.2405 Cc1ccc(c(n1)c2ccc(cc2)F)C=O WXVL_QS3039BT2075 [0,2,0,0,0,0|2,0,0]=4 192 B17R2.2405 Cc1ccc(c(n1)c2ccc(cc2)I)C=O WXVL_QS3039BT1574 [0,2,0,0,0,0|2,0,0]=4 193 B17R2.2405 Cc1ccc(c(n1)c2ccc(cc2)O)C=O WXVL_QS3039BT0555 [0,2,0,0,0,0|2,0,0]=4 194 B17R2.2405 Cc1ccc(c(n1)c2ccc(cc2)O)C=O WXVL_QS3039BT0699 [0,2,0,0,0,0|2,0,0]=4 195 B17R2.2405 Cc1ccc(c(n1)c2ccc(cc2)O)C=O WXVL_QS3039BT2080 [0,2,0,0,0,0|2,0,0]=4 196 B17R2.2405 Cc1ccc(c(n1)c2ccc(cc2)O)C=O WXVL_QS3039BT4830 [0,2,0,0,0,0|2,0,0]=4 197 B17R2.2405 Cc1ccc(c(n1)c2ccc(cc2)O)C=O WXVL_QS3039BT7243 [0,2,0,0,0,0|2,0,0]=4 198 B17R2.2405 Cc1ccc(cc1)c2cc(ccc2C=O)C WXVL_QS0467BT1573 [0,2,0,0,0,0|1,0,0]=3 199 B17R2.2405 Cc1ccc(cc1)c2cc(ccc2C=O)C WXVL_QS0467BT3934 [0,2,0,0,0,0|1,0,0]=3 200 B17R2.2405 Cc1ccc(cc1)c2cc(ccc2C=O)Cl WXVL_QS1071BT1573 [0,2,0,0,0,0|2,0,0]=4 201 B17R2.2405 Cc1ccc(cc1)c2cc(ccc2C=O)Cl WXVL_QS1071BT3934 [0,2,0,0,0,0|2,0,0]=4 202 B17R2.2405 Cc1ccc(cc1)c2cc(ccc2C=O)F WXVL_QS0426BT1573 [0,2,0,0,0,0|2,0,0]=4 203 B17R2.2405 Cc1ccc(cc1)c2cc(ccc2C=O)F WXVL_QS0426BT3934 [0,2,0,0,0,0|2,0,0]=4 204 B17R2.2405 Cc1ccc(cc1)c2cc(ccc2C=O)I WXVL_QS1077BT1573 [0,2,0,0,0,0|2,0,0]=4 205 B17R2.2405 Cc1ccc(cc1)c2cc(ccc2C=O)I WXVL_QS1077BT3934 [0,2,0,0,0,0|2,0,0]=4 206 B17R2.2405 Cc1ccc(cc1)c2cc(ccc2C=O)O WXVL_QS0348BT1573 [0,2,0,0,0,0|2,0,0]=4 207 B17R2.2405 Cc1ccc(cc1)c2cc(ccc2C=O)O WXVL_QS0348BT3934 [0,2,0,0,0,0|2,0,0]=4 208 B17R2.2405 Cc1ccc(cc1)c2nc(ccc2C=O)C WXVL_QS3039BT1573 [0,2,0,0,0,0|2,0,0]=4 209 B17R2.2405 Cc1ccc(cc1)c2nc(ccc2C=O)C WXVL_QS3039BT3934 [0,2,0,0,0,0|2,0,0]=4 210 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)Cl WXVL_QS1071BT0486 [0,2,0,0,0,0|2,0,0]=4 211 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)Cl WXVL_QS1071BT0698 [0,2,0,0,0,0|2,0,0]=4 212 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)Cl WXVL_QS1071BT2075 [0,2,0,0,0,0|2,0,0]=4 213 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)F WXVL_QS0426BT0486 [0,2,0,0,0,0|2,0,0]=4 214 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)F WXVL_QS0426BT0698 [0,2,0,0,0,0|2,0,0]=4 215 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)F WXVL_QS0426BT2075 [0,2,0,0,0,0|2,0,0]=4 216 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)I WXVL_QS1077BT0486 [0,2,0,0,0,0|2,0,0]=4 217 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)I WXVL_QS1077BT0698 [0,2,0,0,0,0|2,0,0]=4 218 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)I WXVL_QS1077BT2075 [0,2,0,0,0,0|2,0,0]=4 219 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)O WXVL_QS0348BT0486 [0,2,0,0,0,0|2,0,0]=4 220 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)O WXVL_QS0348BT0698 [0,2,0,0,0,0|2,0,0]=4 221 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)F)O WXVL_QS0348BT2075 [0,2,0,0,0,0|2,0,0]=4 222 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)I)Cl WXVL_QS1071BT1574 [0,2,0,0,0,0|2,0,0]=4 223 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)I)F WXVL_QS0426BT1574 [0,2,0,0,0,0|2,0,0]=4 224 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)I)I WXVL_QS1077BT1574 [0,2,0,0,0,0|2,0,0]=4 225 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)I)O WXVL_QS0348BT1574 [0,2,0,0,0,0|2,0,0]=4 226 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)Cl WXVL_QS1071BT0555 [0,2,0,0,0,0|2,0,0]=4 227 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)Cl WXVL_QS1071BT0699 [0,2,0,0,0,0|2,0,0]=4 228 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)Cl WXVL_QS1071BT2080 [0,2,0,0,0,0|2,0,0]=4 229 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)Cl WXVL_QS1071BT4830 [0,2,0,0,0,0|2,0,0]=4 230 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)Cl WXVL_QS1071BT7243 [0,2,0,0,0,0|2,0,0]=4 231 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)F WXVL_QS0426BT0555 [0,2,0,0,0,0|2,0,0]=4 232 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)F WXVL_QS0426BT0699 [0,2,0,0,0,0|2,0,0]=4 233 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)F WXVL_QS0426BT2080 [0,2,0,0,0,0|2,0,0]=4 234 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)F WXVL_QS0426BT4830 [0,2,0,0,0,0|2,0,0]=4 235 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)F WXVL_QS0426BT7243 [0,2,0,0,0,0|2,0,0]=4 236 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)I WXVL_QS1077BT0555 [0,2,0,0,0,0|2,0,0]=4 237 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)I WXVL_QS1077BT0699 [0,2,0,0,0,0|2,0,0]=4 238 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)I WXVL_QS1077BT2080 [0,2,0,0,0,0|2,0,0]=4 239 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)I WXVL_QS1077BT4830 [0,2,0,0,0,0|2,0,0]=4 240 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)I WXVL_QS1077BT7243 [0,2,0,0,0,0|2,0,0]=4 241 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)O WXVL_QS0348BT0555 [0,2,0,0,0,0|2,0,0]=4 242 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)O WXVL_QS0348BT0699 [0,2,0,0,0,0|2,0,0]=4 243 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)O WXVL_QS0348BT2080 [0,2,0,0,0,0|2,0,0]=4 244 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)O WXVL_QS0348BT4830 [0,2,0,0,0,0|2,0,0]=4 245 B17R2.2405 O=Cc1ccc(cc1c2ccc(cc2)O)O WXVL_QS0348BT7243 [0,2,0,0,0,0|2,0,0]=4 246 B17R2.2440 Cc1ccc(c(c1)c2ccccc2C)C=O WXVL_QS0467BT1515 [0,2,0,0,0,0|1,0,0]=3 247 B17R2.2440 Cc1ccc(c(c1)c2ccccc2C)C=O WXVL_QS0467BT4142 [0,2,0,0,0,0|1,0,0]=3 248 B17R2.2440 Cc1ccc(c(c1)c2ccccc2C)C=O WXVL_QS0467BT9252 [0,2,0,0,0,0|1,0,0]=3 249 B17R2.2440 Cc1ccc(c(c1)c2ccccc2F)C=O WXVL_QS0467BT1435 [0,2,0,0,0,0|1,0,0]=3 250 B17R2.2440 Cc1ccc(c(c1)c2ccccc2F)C=O WXVL_QS0467BT1901 [0,2,0,0,0,0|1,0,0]=3 251 B17R2.2440 Cc1ccc(c(c1)c2ccccc2O)C=O WXVL_QS0467BT1646 [0,2,0,0,0,0|1,0,0]=3 252 B17R2.2440 Cc1ccc(c(c1)c2cccnc2C)C=O WXVL_QS0467BT1625 [0,2,0,0,0,0|2,0,0]=4 253 B17R2.2440 Cc1ccc(c(c1)c2cccnc2C)C=O WXVL_QS0467BT1871 [0,2,0,0,0,0|2,0,0]=4 254 B17R2.2440 Cc1ccc(c(c1)c2cccnc2F)C=O WXVL_QS0467BT0740 [0,2,0,0,0,0|2,0,0]=4 255 B17R2.2440 Cc1ccc(c(c1)c2cccnc2O)C=O WXVL_QS0467BT1653 [0,2,0,0,0,0|2,0,0]=4 256 B17R2.2440 Cc1ccc(c(c1)c2ccncc2C)C=O WXVL_QS0467BT9635 [0,2,0,0,0,0|2,0,0]=4 257 B17R2.2440 Cc1ccc(c(c1)c2ccncc2F)C=O WXVL_QS0467BT0661 [0,2,0,0,0,0|2,0,0]=4 258 B17R2.2440 Cc1ccc(c(c1)c2cnccc2C)C=O WXVL_QS0467BT2595 [0,2,0,0,0,0|2,0,0]=4 259 B17R2.2440 Cc1ccc(c(n1)c2ccccc2C)C=O WXVL_QS3039BT1515 [0,2,0,0,0,0|2,0,0]=4 260 B17R2.2440 Cc1ccc(c(n1)c2ccccc2C)C=O WXVL_QS3039BT4142 [0,2,0,0,0,0|2,0,0]=4 261 B17R2.2440 Cc1ccc(c(n1)c2ccccc2C)C=O WXVL_QS3039BT9252 [0,2,0,0,0,0|2,0,0]=4 262 B17R2.2440 Cc1ccc(c(n1)c2ccccc2F)C=O WXVL_QS3039BT1435 [0,2,0,0,0,0|2,0,0]=4 263 B17R2.2440 Cc1ccc(c(n1)c2ccccc2F)C=O WXVL_QS3039BT1901 [0,2,0,0,0,0|2,0,0]=4 264 B17R2.2440 Cc1ccc(c(n1)c2ccccc2O)C=O WXVL_QS3039BT1646 [0,2,0,0,0,0|2,0,0]=4 265 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)Cl WXVL_QS1071BT1515 [0,2,0,0,0,0|2,0,0]=4 266 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)Cl WXVL_QS1071BT4142 [0,2,0,0,0,0|2,0,0]=4 267 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)Cl WXVL_QS1071BT9252 [0,2,0,0,0,0|2,0,0]=4 268 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)F WXVL_QS0426BT1515 [0,2,0,0,0,0|2,0,0]=4 269 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)F WXVL_QS0426BT4142 [0,2,0,0,0,0|2,0,0]=4 270 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)F WXVL_QS0426BT9252 [0,2,0,0,0,0|2,0,0]=4 271 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)I WXVL_QS1077BT1515 [0,2,0,0,0,0|2,0,0]=4 272 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)I WXVL_QS1077BT4142 [0,2,0,0,0,0|2,0,0]=4 273 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)I WXVL_QS1077BT9252 [0,2,0,0,0,0|2,0,0]=4 274 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)O WXVL_QS0348BT1515 [0,2,0,0,0,0|2,0,0]=4 275 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)O WXVL_QS0348BT4142 [0,2,0,0,0,0|2,0,0]=4 276 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)O WXVL_QS0348BT9252 [0,2,0,0,0,0|2,0,0]=4 277 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)Cl WXVL_QS1071BT1435 [0,2,0,0,0,0|2,0,0]=4 278 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)Cl WXVL_QS1071BT1901 [0,2,0,0,0,0|2,0,0]=4 279 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)F WXVL_QS0426BT1435 [0,2,0,0,0,0|2,0,0]=4 280 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)F WXVL_QS0426BT1901 [0,2,0,0,0,0|2,0,0]=4 281 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)I WXVL_QS1077BT1435 [0,2,0,0,0,0|2,0,0]=4 282 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)I WXVL_QS1077BT1901 [0,2,0,0,0,0|2,0,0]=4 283 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)O WXVL_QS0348BT1435 [0,2,0,0,0,0|2,0,0]=4 284 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)O WXVL_QS0348BT1901 [0,2,0,0,0,0|2,0,0]=4 285 B17R2.2440 O=Cc1ccc(cc1c2ccccc2O)Cl WXVL_QS1071BT1646 [0,2,0,0,0,0|2,0,0]=4 286 B17R2.2440 O=Cc1ccc(cc1c2ccccc2O)F WXVL_QS0426BT1646 [0,2,0,0,0,0|2,0,0]=4 287 B17R2.2440 O=Cc1ccc(cc1c2ccccc2O)I WXVL_QS1077BT1646 [0,2,0,0,0,0|2,0,0]=4 288 B17R2.2440 O=Cc1ccc(cc1c2ccccc2O)O WXVL_QS0348BT1646 [0,2,0,0,0,0|2,0,0]=4 289 B17R2.12249 Cc1ccc(c(c1)c2cc[nH]c(=N)c2)C=O WXVL_QS0467BT1655 [0,2,0,0,0,0|2,0,0]=4 290 B17R2.12249 Cc1ccc(c(c1)c2cc[nH]c(=N)c2)C=O WXVL_QS0467BT1688 [0,2,0,0,0,0|2,0,0]=4 291 B17R2.12249 Cc1ccc(c(c1)c2cccc(c2)F)C=O WXVL_QS0467BT1585 [0,2,0,0,0,0|1,0,0]=3 292 B17R2.12249 Cc1ccc(c(c1)c2cccc(c2)O)C=O WXVL_QS0467BT2076 [0,2,0,0,0,0|1,0,0]=3 293 B17R2.12249 Cc1ccc(c(c1)c2cccc(n2)C)C=O WXVL_QS0467BT2168 [0,2,0,0,0,0|2,0,0]=4 294 B17R2.12249 Cc1ccc(c(c1)c2cccc(n2)F)C=O WXVL_QS0467BT2106 [0,2,0,0,0,0|2,0,0]=4 295 B17R2.12249 Cc1ccc(c(c1)c2cccc(n2)F)C=O WXVL_QS0467BT4494 [0,2,0,0,0,0|2,0,0]=4 296 B17R2.12249 Cc1ccc(c(c1)c2cccc(n2)O)C=O WXVL_QS0467BT2413 [0,2,0,0,0,0|2,0,0]=4 297 B17R2.12249 Cc1ccc(c(c1)c2ccnc(c2)C)C=O WXVL_QS0467BT1792 [0,2,0,0,0,0|2,0,0]=4 298 B17R2.12249 Cc1ccc(c(c1)c2ccnc(c2)F)C=O WXVL_QS0467BT0769 [0,2,0,0,0,0|2,0,0]=4 299 B17R2.12249 Cc1ccc(c(c1)c2ccnc(c2)O)C=O WXVL_QS0467BT2310 [0,2,0,0,0,0|2,0,0]=4 300 B17R2.12249 Cc1ccc(c(c1)c2ccnc(c2)O)C=O WXVL_QS0467BT5136 [0,2,0,0,0,0|2,0,0]=4 301 B17R2.12249 Cc1ccc(c(c1)c2cncc(c2)F)C=O WXVL_QS0467BT0826 [0,2,0,0,0,0|2,0,0]=4 302 B17R2.12249 Cc1ccc(c(c1)c2cncc(c2)O)C=O WXVL_QS0467BT1374 [0,2,0,0,0,0|2,0,0]=4 303 B17R2.12249 Cc1ccc(c(c1)c2cncc(c2)O)C=O WXVL_QS0467BT1749 [0,2,0,0,0,0|2,0,0]=4 304 B17R2.12249 Cc1ccc(c(n1)c2cccc(c2)F)C=O WXVL_QS3039BT1585 [0,2,0,0,0,0|2,0,0]=4 305 B17R2.12249 Cc1ccc(c(n1)c2cccc(c2)O)C=O WXVL_QS3039BT2076 [0,2,0,0,0,0|2,0,0]=4 306 B17R2.12249 Cc1cccc(c1)c2cc(ccc2C=O)C WXVL_QS0467BT0798 [0,2,0,0,0,0|1,0,0]=3 307 B17R2.12249 Cc1cccc(c1)c2cc(ccc2C=O)C WXVL_QS0467BT9299 [0,2,0,0,0,0|1,0,0]=3 308 B17R2.12249 Cc1cccc(c1)c2cc(ccc2C=O)Cl WXVL_QS1071BT0798 [0,2,0,0,0,0|2,0,0]=4 309 B17R2.12249 Cc1cccc(c1)c2cc(ccc2C=O)Cl WXVL_QS1071BT9299 [0,2,0,0,0,0|2,0,0]=4 310 B17R2.12249 Cc1cccc(c1)c2cc(ccc2C=O)F WXVL_QS0426BT0798 [0,2,0,0,0,0|2,0,0]=4 311 B17R2.12249 Cc1cccc(c1)c2cc(ccc2C=O)F WXVL_QS0426BT9299 [0,2,0,0,0,0|2,0,0]=4 312 B17R2.12249 Cc1cccc(c1)c2cc(ccc2C=O)I WXVL_QS1077BT0798 [0,2,0,0,0,0|2,0,0]=4 313 B17R2.12249 Cc1cccc(c1)c2cc(ccc2C=O)I WXVL_QS1077BT9299 [0,2,0,0,0,0|2,0,0]=4 314 B17R2.12249 Cc1cccc(c1)c2cc(ccc2C=O)O WXVL_QS0348BT0798 [0,2,0,0,0,0|2,0,0]=4 315 B17R2.12249 Cc1cccc(c1)c2cc(ccc2C=O)O WXVL_QS0348BT9299 [0,2,0,0,0,0|2,0,0]=4 316 B17R2.12249 Cc1cccc(c1)c2nc(ccc2C=O)C WXVL_QS3039BT0798 [0,2,0,0,0,0|2,0,0]=4 317 B17R2.12249 Cc1cccc(c1)c2nc(ccc2C=O)C WXVL_QS3039BT9299 [0,2,0,0,0,0|2,0,0]=4 318 B17R2.12249 Cc1cncc(c1)c2cc(ccc2C=O)C WXVL_QS0467BT1800 [0,2,0,0,0,0|2,0,0]=4 319 B17R2.12249 O=Cc1ccc(cc1c2cccc(c2)F)Cl WXVL_QS1071BT1585 [0,2,0,0,0,0|2,0,0]=4 320 B17R2.12249 O=Cc1ccc(cc1c2cccc(c2)F)F WXVL_QS0426BT1585 [0,2,0,0,0,0|2,0,0]=4 321 B17R2.12249 O=Cc1ccc(cc1c2cccc(c2)F)I WXVL_QS1077BT1585 [0,2,0,0,0,0|2,0,0]=4 322 B17R2.12249 O=Cc1ccc(cc1c2cccc(c2)F)O WXVL_QS0348BT1585 [0,2,0,0,0,0|2,0,0]=4 323 B17R2.12249 O=Cc1ccc(cc1c2cccc(c2)O)Cl WXVL_QS1071BT2076 [0,2,0,0,0,0|2,0,0]=4 324 B17R2.12249 O=Cc1ccc(cc1c2cccc(c2)O)F WXVL_QS0426BT2076 [0,2,0,0,0,0|2,0,0]=4 325 B17R2.12249 O=Cc1ccc(cc1c2cccc(c2)O)I WXVL_QS1077BT2076 [0,2,0,0,0,0|2,0,0]=4 326 B17R2.12249 O=Cc1ccc(cc1c2cccc(c2)O)O WXVL_QS0348BT2076 [0,2,0,0,0,0|2,0,0]=4 327 B17R2.17866 Cc1cc(c(c(c1)c2ccccc2)C=O)F WXVL_QS2200BT0919 [0,2,0,0,0,0|1,0,0]=3 328 B17R2.17866 Cc1cc(c(c(c1)c2ccccc2)C=O)F WXVL_QS2200BT1115 [0,2,0,0,0,0|1,0,0]=3 329 B17R2.17866 Cc1cc(c(c(c1)c2ccccc2)C=O)F WXVL_QS2200BT2957 [0,2,0,0,0,0|1,0,0]=3 330 B17R2.17866 Cc1cc(c(c(c1)c2ccccn2)C=O)F WXVL_QS2200BT0164 [0,2,0,0,0,0|2,0,0]=4 331 B17R2.17866 Cc1cc(c(c(c1)c2cccnc2)C=O)F WXVL_QS2200BT1208 [0,2,0,0,0,0|2,0,0]=4 332 B17R2.17866 Cc1cc(c(c(c1)c2cccnc2)C=O)F WXVL_QS2200BT3912 [0,2,0,0,0,0|2,0,0]=4 333 B17R2.17866 Cc1cc(c(c(c1)c2ccncc2)C=O)F WXVL_QS2200BT0574 [0,2,0,0,0,0|2,0,0]=4 334 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)Br)Br WXVL_QS2699BT0919 [0,2,0,0,0,0|2,0,0]=4 335 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)Br)Br WXVL_QS2699BT1115 [0,2,0,0,0,0|2,0,0]=4 336 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)Br)Br WXVL_QS2699BT2957 [0,2,0,0,0,0|2,0,0]=4 337 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)Cl)F WXVL_QS1316BT0919 [0,2,0,0,0,0|2,0,0]=4 338 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)Cl)F WXVL_QS1316BT1115 [0,2,0,0,0,0|2,0,0]=4 339 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)Cl)F WXVL_QS1316BT2957 [0,2,0,0,0,0|2,0,0]=4 340 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)F)Br WXVL_QS0412BT0919 [0,2,0,0,0,0|2,0,0]=4 341 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)F)Br WXVL_QS0412BT1115 [0,2,0,0,0,0|2,0,0]=4 342 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)F)Br WXVL_QS0412BT2957 [0,2,0,0,0,0|2,0,0]=4 343 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)F)F WXVL_QS2135BT0919 [0,2,0,0,0,0|2,0,0]=4 344 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)F)F WXVL_QS2135BT1115 [0,2,0,0,0,0|2,0,0]=4 345 B17R2.17866 O=Cc1c(cc(cc1c2ccccc2)F)F WXVL_QS2135BT2957 [0,2,0,0,0,0|2,0,0]=4 346 B17R2.57 Cc1ccc(c(c1)c2ccc(cc2)C=O)C WXVL_QS0078BT0645 [0,2,0,0,0,0|2,0,0]=4 347 B17R2.57 Cc1ccc(c(c1)c2ccc(cc2)C=O)O WXVL_QS0078BT2739 [0,2,0,0,0,0|1,0,1]=4 348 B17R2.57 Cc1ccc(c(c1)c2ccc(cc2)C=O)O WXVL_QS0078BT3163 [0,2,0,0,0,0|1,0,1]=4 349 B17R2.2660 Cc1ccc(c(c1)c2cccc(c2)C=O)C WXVL_QS0055BT0645 [0,2,0,0,0,0|2,0,0]=4 350 B17R2.2660 Cc1ccc(c(c1)c2cccc(c2)C=O)O WXVL_QS0055BT2739 [0,2,0,0,0,0|1,0,1]=4 351 B17R2.2660 Cc1ccc(c(c1)c2cccc(c2)C=O)O WXVL_QS0055BT3163 [0,2,0,0,0,0|1,0,1]=4 352 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)C WXVL_QS0019BT0645 [0,2,0,0,0,0|2,0,0]=4 353 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)O WXVL_QS0019BT2739 [0,2,0,0,0,0|1,0,1]=4 354 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)O WXVL_QS0019BT3163 [0,2,0,0,0,0|1,0,1]=4 355 B17R2.111 Cc1cc(c(c(c1)c2ccccc2)O)C=O WXVL_QS2281BT0919 [0,2,0,0,0,0|1,0,1]=4 356 B17R2.111 Cc1cc(c(c(c1)c2ccccc2)O)C=O WXVL_QS2281BT1115 [0,2,0,0,0,0|1,0,1]=4 357 B17R2.111 Cc1cc(c(c(c1)c2ccccc2)O)C=O WXVL_QS2281BT2957 [0,2,0,0,0,0|1,0,1]=4 358 B15R2.38 Cc1cncnc1Nc2ccccc2 WXVL_AG00183LP0053 [0,0,1,1,0,0|2,0,0]=4 359 B15R2.38 Cc1cncnc1Nc2ccccc2 WXVL_AG00183LP0053 [0,0,1,1,0,0|2,0,0]=4 360 B15R2.29 Cc1cnc(nc1)Nc2ccccc2 WXVL_AG00183LP0025 [0,0,1,1,0,0|2,0,0]=4 361 B15R2.29 Cc1cnc(nc1)Nc2ccccc2 WXVL_AG00183LP0025 [0,0,1,1,0,0|2,0,0]=4 362 B15R2.596 C=C1CC(C1)C(=O)Nc2ccccc2 WXVL_AG00183SB0804 [0,0,1,1,0,0|0,0,2]=4 363 B15R2.596 C=C1CC(C1)C(=O)Nc2ccccc2 WXVL_AG00183SB0804 [0,0,1,1,0,0|0,0,2]=4 364 B15R2.1256 O=C(C=CC1CC1)Nc2ccccc2 WXVL_AG00183SB4216 [0,0,1,1,0,0|0,0,2]=4 365 B15R2.1256 O=C(C=CC1CC1)Nc2ccccc2 WXVL_AG00183SB4216 [0,0,1,1,0,0|0,0,2]=4 366 B13R1.45 C=C(C)CNC(=O)c1ccccc1 WXVL_AK0761SD0001 [0,0,1,0,1,0|1,0,1]=4 367 B13R1.45 C=C(C)CNC(=O)c1ccccc1 WXVL_AK0761SD0001 [0,0,1,0,1,0|1,0,1]=4 368 B13R1.348 CC(=CC(=O)Nc1ccccc1)C WXVL_AG00183SB0342 [0,0,1,0,1,0|0,0,1]=3 369 B13R1.348 CC(=CC(=O)Nc1ccccc1)C WXVL_AG00183SB0342 [0,0,1,0,1,0|0,0,1]=3 370 B13R1.348 CC(=CC(=O)Nc1ccccn1)C WXVL_AF00298SB0342 [0,0,1,0,1,0|1,0,1]=4 371 B13R1.348 CC(=CC(=O)Nc1ccccn1)C WXVL_AF00298SB0342 [0,0,1,0,1,0|1,0,1]=4 372 B13R2.10 Cc1ccc(s1)c2ccccc2 WXVL_LR0501BT0919 [1,0,0,0,1,0|2,0,0]=4 373 B13R2.10 Cc1ccc(s1)c2ccccc2 WXVL_LR0501BT1115 [1,0,0,0,1,0|2,0,0]=4 374 B13R2.10 Cc1ccc(s1)c2ccccc2 WXVL_LR0501BT2957 [1,0,0,0,1,0|2,0,0]=4 375 B13R2.13 Cc1cccc(c1)c2cccs2 WXVL_LR0498BT0798 [1,0,0,0,1,0|2,0,0]=4 376 B13R2.13 Cc1cccc(c1)c2cccs2 WXVL_LR0498BT9299 [1,0,0,0,1,0|2,0,0]=4 377 B13R2.15 Cc1ccsc1c2ccccc2 WXVL_LR0502BT0919 [1,0,0,0,1,0|2,0,0]=4 378 B13R2.15 Cc1ccsc1c2ccccc2 WXVL_LR0502BT1115 [1,0,0,0,1,0|2,0,0]=4 379 B13R2.15 Cc1ccsc1c2ccccc2 WXVL_LR0502BT2957 [1,0,0,0,1,0|2,0,0]=4 380 B13R2.15 Cc1cscc1c2ccccc2 WXVL_LR0489BT0919 [1,0,0,0,1,0|2,0,0]=4 381 B13R2.15 Cc1cscc1c2ccccc2 WXVL_LR0489BT1115 [1,0,0,0,1,0|2,0,0]=4 382 B13R2.15 Cc1cscc1c2ccccc2 WXVL_LR0489BT2957 [1,0,0,0,1,0|2,0,0]=4 383 B15R1.1081 CC(=CCCC(=O)Nc1ccccc1)C WXVL_AG00183SB00030 [0,0,1,0,0,1|0,0,2]=4 384 B15R1.1081 CC(=CCCC(=O)Nc1ccccc1)C WXVL_AG00183SB00030 [0,0,1,0,0,1|0,0,2]=4