0 B17R2.71190 CCc1cccc(c1C=C2CCCC2)CC 271570a_100010378317_100010212195 [0,0,0,0,0,0|2,0,1]=3 1 B17R2.71190 CCc1cccc(c1NC2CCCC2)CC 2230a_100000211307_100000179811 [0,0,0,0,0,0|3,0,1]=4 2 B17R2.71190 CCc1cccc(c1NC2CCCC2)CC 34a_100000211307_100000179811 [0,0,0,0,0,0|3,0,1]=4 3 B17R2.71190 CCc1cccc(c1NC2CCCC2)CC 7a_100000211307_100000179811 [0,0,0,0,0,0|3,0,1]=4 4 B17R2.71190 CCc1cccc(c1Nc2ncns2)CC 27a_100000211307_100000693119 [0,0,0,0,0,0|3,0,1]=4 5 B17R2.71190 CCc1cccc(c1Nc2nncs2)CC 27a_100000211307_100000739804 [0,0,0,0,0,0|3,0,1]=4 6 B17R2.71190 CCc1cccc(c1OC2CCCC2)CC 34a_100000078057_100000179811 [0,0,0,0,0,0|3,0,1]=4 7 B17R2.71190 CCc1cccc(c1OC2CCCC2)CC 7a_100000078057_100000179811 [0,0,0,0,0,0|3,0,1]=4 8 B17R2.71190 CCc1cccc(c1SC2CCCC2)CC 62a_100010212195_100000179811 [0,0,0,0,0,0|3,0,1]=4 9 B17R2.71190 CCc1cccc(c1SC2CCCC2)CC 62a_100011217020_100010212195 [0,0,0,0,0,0|3,0,1]=4 10 B17R2.71190 CCc1cccc(c1Sc2c[nH]cn2)CC 62a_100000756875_100010212195 [0,0,0,0,0,0|3,0,1]=4 11 B17R2.71190 CCc1cccc(c1Sc2c[nH]cn2)CC 62a_100010212195_100000756875 [0,0,0,0,0,0|3,0,1]=4 12 B17R2.71190 CCc1cccc(c1Sc2c[nH]nn2)CC 62a_100009819707_100010212195 [0,0,0,0,0,0|4,0,0]=4 13 B17R2.71190 CCc1cccc(c1Sc2c[nH]nn2)CC 62a_100010212195_100009819707 [0,0,0,0,0,0|4,0,0]=4 14 B17R2.71190 CCc1cccc(c1Sc2cc[nH]n2)CC 62a_100000062575_100010212195 [0,0,0,0,0,0|3,0,1]=4 15 B17R2.71190 CCc1cccc(c1Sc2cc[nH]n2)CC 62a_100010212195_100000062575 [0,0,0,0,0,0|3,0,1]=4 16 B17R2.71190 CCc1cccc(c1Sc2ccon2)CC 62a_100009818083_100010212195 [0,0,0,0,0,0|3,0,1]=4 17 B17R2.71190 CCc1cccc(c1Sc2ccon2)CC 62a_100010212195_100009818083 [0,0,0,0,0,0|3,0,1]=4 18 B17R2.71190 CCc1cccc(c1Sc2ccsn2)CC 62a_100009818082_100010212195 [0,0,0,0,0,0|3,0,1]=4 19 B17R2.71190 CCc1cccc(c1Sc2ccsn2)CC 62a_100010212195_100009818082 [0,0,0,0,0,0|3,0,1]=4 20 B17R2.71190 CCc1cccc(c1Sc2cscn2)CC 62a_100000751502_100010212195 [0,0,0,0,0,0|3,0,1]=4 21 B17R2.71190 CCc1cccc(c1Sc2cscn2)CC 62a_100010212195_100000751502 [0,0,0,0,0,0|3,0,1]=4 22 B17R2.71190 CCc1cccc(c1Sc2nc[nH]n2)CC 62a_100000761765_100010212195 [0,0,0,0,0,0|2,0,2]=4 23 B17R2.71190 CCc1cccc(c1Sc2nc[nH]n2)CC 62a_100010212195_100000761765 [0,0,0,0,0,0|2,0,2]=4 24 B17R2.71190 CCc1cccc(c1Sc2ncc[nH]2)CC 62a_100010212195_100025796157 [0,0,0,0,0,0|1,0,2]=3 25 B17R2.71190 CCc1cccc(c1Sc2ncc[nH]2)CC 62a_100025796157_100010212195 [0,0,0,0,0,0|1,0,2]=3 26 B17R2.71190 CCc1cccc(c1Sc2ncco2)CC 62a_100010212195_100011787736 [0,0,0,0,0,0|2,0,2]=4 27 B17R2.71190 CCc1cccc(c1Sc2ncco2)CC 62a_100011787736_100010212195 [0,0,0,0,0,0|2,0,2]=4 28 B17R2.71190 CCc1cccc(c1Sc2nccs2)CC 62a_100000211983_100010212195 [0,0,0,0,0,0|2,0,2]=4 29 B17R2.71190 CCc1cccc(c1Sc2nccs2)CC 62a_100010212195_100000211983 [0,0,0,0,0,0|2,0,2]=4 30 B17R2.71190 CCc1cccc(c1Sc2ncns2)CC 62a_100000693119_100010212195 [0,0,0,0,0,0|3,0,1]=4 31 B17R2.71190 CCc1cccc(c1Sc2ncns2)CC 62a_100010212195_100000693119 [0,0,0,0,0,0|3,0,1]=4 32 B17R2.71190 CCc1cccc(c1Sc2nncs2)CC 62a_100000739804_100010212195 [0,0,0,0,0,0|3,0,1]=4 33 B17R2.71190 CCc1cccc(c1Sc2nncs2)CC 62a_100010212195_100000739804 [0,0,0,0,0,0|3,0,1]=4 34 B16R2.41276 CCc1cccc(c1C=C2CCCC2)C 271570a_100010378317_100000036235 [1,0,0,0,0,0|2,0,1]=4 35 B16R2.41276 CCc1cccc(c1Sc2ncc[nH]2)C 62a_100000036235_100025796157 [1,0,0,0,0,0|1,0,2]=4 36 B16R2.41276 CCc1cccc(c1Sc2ncc[nH]2)C 62a_100025796157_100000036235 [1,0,0,0,0,0|1,0,2]=4 37 B18R2.6632 CCc1cc(cc(c1C=C2CCCC2)CC)Br 271570a_100010378317_100010205833 [0,1,0,0,0,0|2,0,1]=4 38 B18R2.6632 CCc1cc(cc(c1C=C2CCCC2)CC)C 271570a_100010378317_100010203090 [0,1,0,0,0,0|2,0,1]=4 39 B18R2.6632 CCc1cc(cc(c1Sc2ncc[nH]2)CC)Br 62a_100010205833_100025796157 [0,1,0,0,0,0|1,0,2]=4 40 B18R2.6632 CCc1cc(cc(c1Sc2ncc[nH]2)CC)Br 62a_100025796157_100010205833 [0,1,0,0,0,0|1,0,2]=4 41 B18R2.6632 CCc1cc(cc(c1Sc2ncc[nH]2)CC)C 62a_100010203090_100025796157 [0,1,0,0,0,0|1,0,2]=4 42 B18R2.6632 CCc1cc(cc(c1Sc2ncc[nH]2)CC)C 62a_100025796157_100010203090 [0,1,0,0,0,0|1,0,2]=4 43 B18R2.117982 CCc1cccc(c1Sc2nc(c[nH]2)C)CC 62a_100010212195_100161115468 [0,1,0,0,0,0|1,0,2]=4 44 B18R2.117982 CCc1cccc(c1Sc2nc(c[nH]2)C)CC 62a_100161115468_100010212195 [0,1,0,0,0,0|1,0,2]=4 45 B18R2.117986 CCc1cccc(c1Nc2ncnn2C)CC 27a_100000211307_100000732653 [0,1,0,0,0,0|2,0,1]=4 46 B18R2.117986 CCc1cccc(c1Sc2nccn2C)CC 62a_100000707724_100010212195 [0,1,0,0,0,0|1,0,2]=4 47 B18R2.117986 CCc1cccc(c1Sc2nccn2C)CC 62a_100010212195_100000707724 [0,1,0,0,0,0|1,0,2]=4 48 B18R2.117986 CCc1cccc(c1Sc2ncnn2C)CC 62a_100000732653_100010212195 [0,1,0,0,0,0|2,0,1]=4 49 B18R2.117986 CCc1cccc(c1Sc2ncnn2C)CC 62a_100010212195_100000732653 [0,1,0,0,0,0|2,0,1]=4 50 B16R1.2234 CCCC(=O)Nc1c(cccc1CC)CC 11a_100000211307_100000211992 [0,0,1,0,0,0|3,0,0]=4 51 B16R1.2234 CCCC(=O)Nc1c(cccc1CC)CC 1626a_100000211307_100000211992 [0,0,1,0,0,0|3,0,0]=4 52 B16R1.2234 CCNC(=O)Nc1c(cccc1CC)CC 2430a_100000211307_100015525214 [0,0,1,0,0,0|2,0,0]=3 53 B16R1.2234 CCNC(=O)Nc1c(cccc1CC)CC 512a_100000211307_100015525214 [0,0,1,0,0,0|2,0,0]=3 54 B16R1.2234 CCc1cccc(c1NC(=O)NNC)CC 512a_100000211307_100016993582 [0,0,1,0,0,0|3,0,0]=4 55 B16R1.12687 CCCCC=Cc1c(cccc1CC)CC 271570a_100016275911_100010212195 [0,0,1,0,0,0|2,0,1]=4 56 B16R2.37063 CCc1cccc(c1C2=CCCC2)CC 271570a_100000089523_100010212195 [0,0,0,0,1,0|2,0,0]=3 57 B16R2.37063 CCc1cccc(c1C2=CCOC2)CC 271570a_100009872500_100010212195 [0,0,0,0,1,0|3,0,0]=4 58 B16R2.37063 CCc1cccc(c1C2=COCC2)CC 271570a_100000118173_100010212195 [0,0,0,0,1,0|3,0,0]=4 59 B16R2.37063 CCc1cccc(c1c2cc[nH]n2)CC 271570a_100000062414_100010212195 [0,0,0,0,1,0|2,0,1]=4 60 B16R2.37063 CCc1cccc(c1c2ncc[nH]2)CC 271570a_100016988920_100010212195 [0,0,0,0,1,0|0,0,2]=3 61 B16R2.201364 CCc1cccc(c1NC2CCC2)CC 34a_100000211307_100000749161 [0,0,0,0,1,0|2,0,1]=4 62 B16R2.201364 CCc1cccc(c1OC2CCC2)CC 34a_100000078057_100000749161 [0,0,0,0,1,0|2,0,1]=4 63 B16R2.201364 CCc1cccc(c1SC2CCC2)CC 62a_100010212195_100000749161 [0,0,0,0,1,0|2,0,1]=4 64 B18R2.117941 CCc1cccc(c1NCC2=NCCN2)CC 34a_100000211307_100000737910 [0,0,0,0,0,1|0,0,0]=1 65 B18R2.117941 CCc1cccc(c1NCC2=NCCN2)CC 7a_100000211307_100000737910 [0,0,0,0,0,1|0,0,0]=1 66 B18R2.117941 CCc1cccc(c1NCC2CCCC2)CC 2230a_100000211307_100000740388 [0,0,0,0,0,1|2,0,1]=4 67 B18R2.117941 CCc1cccc(c1NCC2CCCC2)CC 34a_100000211307_100000740388 [0,0,0,0,0,1|2,0,1]=4 68 B18R2.117941 CCc1cccc(c1NCC2CCCC2)CC 7a_100000211307_100000740388 [0,0,0,0,0,1|2,0,1]=4 69 B18R2.117941 CCc1cccc(c1NCC2CCCO2)CC 2230a_100000211307_100000203698 [0,0,0,0,0,1|2,0,1]=4 70 B18R2.117941 CCc1cccc(c1NCC2CCCO2)CC 7a_100000211307_100000203698 [0,0,0,0,0,1|2,0,1]=4 71 B18R2.117941 CCc1cccc(c1NCC2OCCO2)CC 2230a_100000211307_100000755774 [0,0,0,0,0,1|2,0,1]=4 72 B18R2.117941 CCc1cccc(c1NCC2OCCO2)CC 34a_100000211307_100000755774 [0,0,0,0,0,1|2,0,1]=4 73 B18R2.117941 CCc1cccc(c1NCC2OCCO2)CC 7a_100000211307_100000755774 [0,0,0,0,0,1|2,0,1]=4 74 B18R2.117941 CCc1cccc(c1NCc2c[nH]cn2)CC 2230a_100000211307_100000707719 [0,0,0,0,0,1|2,0,1]=4 75 B18R2.117941 CCc1cccc(c1NCc2c[nH]cn2)CC 34a_100000211307_100000707719 [0,0,0,0,0,1|2,0,1]=4 76 B18R2.117941 CCc1cccc(c1NCc2cc[nH]n2)CC 207a_100000211307_100000738523 [0,0,0,0,0,1|2,0,1]=4 77 B18R2.117941 CCc1cccc(c1NCc2ccn[nH]2)CC 2230a_100000211307_100000728653 [0,0,0,0,0,1|2,0,1]=4 78 B18R2.117941 CCc1cccc(c1NCc2ccn[nH]2)CC 34a_100000211307_100000728653 [0,0,0,0,0,1|2,0,1]=4 79 B18R2.117941 CCc1cccc(c1NCc2ccn[nH]2)CC 7a_100000211307_100000728653 [0,0,0,0,0,1|2,0,1]=4 80 B18R2.117941 CCc1cccc(c1NCc2ccon2)CC 2230a_100000211307_100000234950 [0,0,0,0,0,1|2,0,1]=4 81 B18R2.117941 CCc1cccc(c1NCc2ccon2)CC 34a_100000211307_100000234950 [0,0,0,0,0,1|2,0,1]=4 82 B18R2.117941 CCc1cccc(c1NCc2ccon2)CC 7a_100000211307_100000234950 [0,0,0,0,0,1|2,0,1]=4 83 B18R2.117941 CCc1cccc(c1NCc2cnc[nH]2)CC 207a_100000211307_100000742939 [0,0,0,0,0,1|2,0,1]=4 84 B18R2.117941 CCc1cccc(c1NCc2cscn2)CC 207a_100000211307_100000743575 [0,0,0,0,0,1|2,0,1]=4 85 B18R2.117941 CCc1cccc(c1NCc2cscn2)CC 2230a_100000211307_100000205941 [0,0,0,0,0,1|2,0,1]=4 86 B18R2.117941 CCc1cccc(c1NCc2cscn2)CC 270302a_100000211307_100000743575 [0,0,0,0,0,1|2,0,1]=4 87 B18R2.117941 CCc1cccc(c1NCc2cscn2)CC 34a_100000211307_100000205941 [0,0,0,0,0,1|2,0,1]=4 88 B18R2.117941 CCc1cccc(c1NCc2cscn2)CC 7a_100000211307_100000205941 [0,0,0,0,0,1|2,0,1]=4 89 B18R2.117941 CCc1cccc(c1NCc2ncc[nH]2)CC 207a_100000211307_100000743867 [0,0,0,0,0,1|0,0,2]=3 90 B18R2.117941 CCc1cccc(c1NCc2ncc[nH]2)CC 2230a_100000211307_100016991755 [0,0,0,0,0,1|0,0,2]=3 91 B18R2.117941 CCc1cccc(c1NCc2ncc[nH]2)CC 34a_100000211307_100016991755 [0,0,0,0,0,1|0,0,2]=3 92 B18R2.117941 CCc1cccc(c1NCc2ncc[nH]2)CC 7a_100000211307_100000753453 [0,0,0,0,0,1|0,0,2]=3 93 B18R2.117941 CCc1cccc(c1NCc2ncco2)CC 2230a_100000211307_103436540062 [0,0,0,0,0,1|1,0,2]=4 94 B18R2.117941 CCc1cccc(c1NCc2ncco2)CC 34a_100000211307_103436540062 [0,0,0,0,0,1|1,0,2]=4 95 B18R2.117941 CCc1cccc(c1NCc2ncco2)CC 7a_100000211307_103436540062 [0,0,0,0,0,1|1,0,2]=4 96 B18R2.117941 CCc1cccc(c1NCc2nccs2)CC 207a_100000211307_100000750902 [0,0,0,0,0,1|1,0,2]=4 97 B18R2.117941 CCc1cccc(c1NCc2nccs2)CC 2230a_100000211307_100015184050 [0,0,0,0,0,1|1,0,2]=4 98 B18R2.117941 CCc1cccc(c1NCc2nccs2)CC 270302a_100000211307_100000750902 [0,0,0,0,0,1|1,0,2]=4 99 B18R2.117941 CCc1cccc(c1NCc2nccs2)CC 34a_100000211307_100015184050 [0,0,0,0,0,1|1,0,2]=4 100 B18R2.117941 CCc1cccc(c1NCc2nccs2)CC 7a_100000211307_100015184050 [0,0,0,0,0,1|1,0,2]=4 101 B18R2.117941 CCc1cccc(c1NCc2ncon2)CC 34a_100000211307_100000233494 [0,0,0,0,0,1|1,0,2]=4 102 B18R2.117941 CCc1cccc(c1NCc2nnn[nH]2)CC 34a_100000211307_100000765167 [0,0,0,0,0,1|2,0,0]=3 103 B18R2.117941 CCc1cccc(c1NCc2nnn[nH]2)CC 7a_100000211307_100000765167 [0,0,0,0,0,1|2,0,0]=3 104 B18R2.117941 CCc1cccc(c1OCC2=NCCN2)CC 34a_100000078057_100000737910 [0,0,0,0,0,1|0,0,0]=1 105 B18R2.117941 CCc1cccc(c1OCC2=NCCN2)CC 7a_100000078057_100000737910 [0,0,0,0,0,1|0,0,0]=1 106 B18R2.117941 CCc1cccc(c1OCC2CCCC2)CC 34a_100000078057_100000740388 [0,0,0,0,0,1|2,0,1]=4 107 B18R2.117941 CCc1cccc(c1OCC2CCCC2)CC 7a_100000078057_100000740388 [0,0,0,0,0,1|2,0,1]=4 108 B18R2.117941 CCc1cccc(c1OCC2CCCO2)CC 7a_100000078057_100000203698 [0,0,0,0,0,1|2,0,1]=4 109 B18R2.117941 CCc1cccc(c1OCC2OCCO2)CC 34a_100000078057_100000755774 [0,0,0,0,0,1|2,0,1]=4 110 B18R2.117941 CCc1cccc(c1OCC2OCCO2)CC 7a_100000078057_100000755774 [0,0,0,0,0,1|2,0,1]=4 111 B18R2.117941 CCc1cccc(c1OCc2c[nH]cn2)CC 34a_100000078057_100000707719 [0,0,0,0,0,1|2,0,1]=4 112 B18R2.117941 CCc1cccc(c1OCc2ccn[nH]2)CC 34a_100000078057_100000728653 [0,0,0,0,0,1|2,0,1]=4 113 B18R2.117941 CCc1cccc(c1OCc2ccn[nH]2)CC 7a_100000078057_100000728653 [0,0,0,0,0,1|2,0,1]=4 114 B18R2.117941 CCc1cccc(c1OCc2ccon2)CC 34a_100000078057_100000234950 [0,0,0,0,0,1|2,0,1]=4 115 B18R2.117941 CCc1cccc(c1OCc2ccon2)CC 7a_100000078057_100000234950 [0,0,0,0,0,1|2,0,1]=4 116 B18R2.117941 CCc1cccc(c1OCc2cscn2)CC 34a_100000078057_100000205941 [0,0,0,0,0,1|2,0,1]=4 117 B18R2.117941 CCc1cccc(c1OCc2cscn2)CC 7a_100000078057_100000205941 [0,0,0,0,0,1|2,0,1]=4 118 B18R2.117941 CCc1cccc(c1OCc2ncc[nH]2)CC 34a_100000078057_100016991755 [0,0,0,0,0,1|0,0,2]=3 119 B18R2.117941 CCc1cccc(c1OCc2ncc[nH]2)CC 7a_100000078057_100000753453 [0,0,0,0,0,1|0,0,2]=3 120 B18R2.117941 CCc1cccc(c1OCc2ncco2)CC 34a_100000078057_103436540062 [0,0,0,0,0,1|1,0,2]=4 121 B18R2.117941 CCc1cccc(c1OCc2ncco2)CC 7a_100000078057_103436540062 [0,0,0,0,0,1|1,0,2]=4 122 B18R2.117941 CCc1cccc(c1OCc2nccs2)CC 34a_100000078057_100015184050 [0,0,0,0,0,1|1,0,2]=4 123 B18R2.117941 CCc1cccc(c1OCc2nccs2)CC 7a_100000078057_100015184050 [0,0,0,0,0,1|1,0,2]=4 124 B18R2.117941 CCc1cccc(c1OCc2ncon2)CC 34a_100000078057_100000233494 [0,0,0,0,0,1|1,0,2]=4 125 B18R2.117941 CCc1cccc(c1OCc2nnn[nH]2)CC 34a_100000078057_100000765167 [0,0,0,0,0,1|2,0,0]=3 126 B18R2.117941 CCc1cccc(c1OCc2nnn[nH]2)CC 7a_100000078057_100000765167 [0,0,0,0,0,1|2,0,0]=3 127 B18R2.117941 CCc1cccc(c1SCC2=NCCN2)CC 62a_100000737910_100010212195 [0,0,0,0,0,1|0,0,0]=1 128 B18R2.117941 CCc1cccc(c1SCC2=NCCN2)CC 62a_100010212195_100000737910 [0,0,0,0,0,1|0,0,0]=1 129 B18R2.117941 CCc1cccc(c1SCC2CCCC2)CC 62a_100000740388_100010212195 [0,0,0,0,0,1|2,0,1]=4 130 B18R2.117941 CCc1cccc(c1SCC2CCCC2)CC 62a_100010212195_100000740388 [0,0,0,0,0,1|2,0,1]=4 131 B18R2.117941 CCc1cccc(c1SCC2CCCO2)CC 62a_100000203698_100010212195 [0,0,0,0,0,1|2,0,1]=4 132 B18R2.117941 CCc1cccc(c1SCC2CCCO2)CC 62a_100010212195_100000203698 [0,0,0,0,0,1|2,0,1]=4 133 B18R2.117941 CCc1cccc(c1SCC2OCCO2)CC 62a_100000755774_100010212195 [0,0,0,0,0,1|2,0,1]=4 134 B18R2.117941 CCc1cccc(c1SCC2OCCO2)CC 62a_100010212195_100000755774 [0,0,0,0,0,1|2,0,1]=4 135 B18R2.117941 CCc1cccc(c1SCc2c[nH]cn2)CC 62a_100000707719_100010212195 [0,0,0,0,0,1|2,0,1]=4 136 B18R2.117941 CCc1cccc(c1SCc2c[nH]cn2)CC 62a_100010212195_100000707719 [0,0,0,0,0,1|2,0,1]=4 137 B18R2.117941 CCc1cccc(c1SCc2ccn[nH]2)CC 62a_100000728653_100010212195 [0,0,0,0,0,1|2,0,1]=4 138 B18R2.117941 CCc1cccc(c1SCc2ccn[nH]2)CC 62a_100010212195_100000728653 [0,0,0,0,0,1|2,0,1]=4 139 B18R2.117941 CCc1cccc(c1SCc2ccon2)CC 62a_100000234950_100010212195 [0,0,0,0,0,1|2,0,1]=4 140 B18R2.117941 CCc1cccc(c1SCc2ccon2)CC 62a_100010212195_100000234950 [0,0,0,0,0,1|2,0,1]=4 141 B18R2.117941 CCc1cccc(c1SCc2cscn2)CC 62a_100000205941_100010212195 [0,0,0,0,0,1|2,0,1]=4 142 B18R2.117941 CCc1cccc(c1SCc2cscn2)CC 62a_100010212195_100000205941 [0,0,0,0,0,1|2,0,1]=4 143 B18R2.117941 CCc1cccc(c1SCc2ncc[nH]2)CC 62a_100010212195_100016991755 [0,0,0,0,0,1|0,0,2]=3 144 B18R2.117941 CCc1cccc(c1SCc2ncc[nH]2)CC 62a_100016991755_100010212195 [0,0,0,0,0,1|0,0,2]=3 145 B18R2.117941 CCc1cccc(c1SCc2ncco2)CC 62a_100010212195_103436540062 [0,0,0,0,0,1|1,0,2]=4 146 B18R2.117941 CCc1cccc(c1SCc2ncco2)CC 62a_103436540062_100010212195 [0,0,0,0,0,1|1,0,2]=4 147 B18R2.117941 CCc1cccc(c1SCc2nccs2)CC 62a_100010212195_100015184050 [0,0,0,0,0,1|1,0,2]=4 148 B18R2.117941 CCc1cccc(c1SCc2nccs2)CC 62a_100015184050_100010212195 [0,0,0,0,0,1|1,0,2]=4 149 B18R2.117941 CCc1cccc(c1SCc2ncon2)CC 62a_100000233494_100010212195 [0,0,0,0,0,1|1,0,2]=4 150 B18R2.117941 CCc1cccc(c1SCc2ncon2)CC 62a_100010212195_100000233494 [0,0,0,0,0,1|1,0,2]=4 151 B18R2.117941 CCc1cccc(c1SCc2nnn[nH]2)CC 62a_100000765167_100010212195 [0,0,0,0,0,1|2,0,0]=3 152 B18R2.117941 CCc1cccc(c1SCc2nnn[nH]2)CC 62a_100010212195_100000765167 [0,0,0,0,0,1|2,0,0]=3 153 B18R2.117941 COc1cccc(c1NCC2=NCCN2)CO 34a_100011999522_100000737910 [0,0,0,0,0,1|2,0,0]=3 154 B18R2.117941 COc1cccc(c1NCC2=NCCN2)OC 34a_100011218430_100000737910 [0,0,0,0,0,1|2,0,0]=3 155 B18R2.117941 COc1cccc(c1NCC2=NCCN2)SC 34a_200012283368_100000737910 [0,0,0,0,0,1|2,0,0]=3 156 B18R2.117941 COc1cccc(c1OCC2=NCCN2)C#N 34a_100011934230_100000737910 [0,0,0,0,0,1|2,0,1]=4 157 B18R2.117941 COc1cccc(c1OCC2=NCCN2)CO 34a_100011218668_100000737910 [0,0,0,0,0,1|2,0,0]=3 158 B18R2.117941 COc1cccc(c1OCC2=NCCN2)OC 34a_100000211025_100000737910 [0,0,0,0,0,1|2,0,0]=3 159 B18R2.117941 COc1cccc(c1SCC2=NCCN2)C=O 62a_100000737910_100010209554 [0,0,0,0,0,1|2,0,1]=4 160 B18R2.117941 COc1cccc(c1SCC2=NCCN2)C=O 62a_100010209554_100000737910 [0,0,0,0,0,1|2,0,1]=4 161 B18R2.117941 COc1cccc(c1SCC2=NCCN2)CO 62a_100000737910_100010236476 [0,0,0,0,0,1|2,0,0]=3 162 B18R2.117941 COc1cccc(c1SCC2=NCCN2)CO 62a_100010236476_100000737910 [0,0,0,0,0,1|2,0,0]=3 163 B18R2.117941 COc1cccc(c1SCC2=NCCN2)OC 62a_100000690108_100000737910 [0,0,0,0,0,1|2,0,0]=3 164 B18R2.117941 COc1cccc(c1SCC2=NCCN2)OC 62a_100000737910_100000690108 [0,0,0,0,0,1|2,0,0]=3 165 B18R2.117941 COc1ccnc(c1SCC2=NCCN2)OC 62a_100000737910_100010114374 [0,0,0,0,0,1|3,0,0]=4 166 B18R2.117941 COc1ccnc(c1SCC2=NCCN2)OC 62a_100010114374_100000737910 [0,0,0,0,0,1|3,0,0]=4 167 B18R2.117941 COc1cncc(c1SCC2=NCCN2)OC 62a_100000737910_200010191558 [0,0,0,0,0,1|3,0,0]=4 168 B18R2.117941 COc1cncc(c1SCC2=NCCN2)OC 62a_200010191558_100000737910 [0,0,0,0,0,1|3,0,0]=4 169 B15R1.1604 CCC(=O)Nc1c(cccc1CC)CC 11a_100000211307_100000210414 [1,0,1,0,0,0|2,0,0]=4 170 B15R1.1604 CCC(=O)Nc1c(cccc1CC)CC 1626a_100000211307_100000210414 [1,0,1,0,0,0|2,0,0]=4 171 B15R1.1604 CCc1cccc(c1NC(=O)NC)CC 2430a_100000211307_100102657272 [1,0,1,0,0,0|2,0,0]=4 172 B15R1.1604 CCc1cccc(c1NC(=O)NC)CC 512a_100000211307_100102657272 [1,0,1,0,0,0|2,0,0]=4 173 B15R1.2560 CCNC(=O)Nc1c(cccc1CC)C 2430a_100000210048_100015525214 [1,0,1,0,0,0|2,0,0]=4 174 B15R1.4000 CCCC=Cc1c(cccc1CC)CC 271570a_100016258520_100010212195 [1,0,1,0,0,0|1,0,1]=4 175 B15R1.4000 CCOC=Cc1c(cccc1CC)CC 271570a_100016256518_100010212195 [1,0,1,0,0,0|1,0,1]=4 176 B17R1.125354 CCNC(=O)Nc1c(ccc(c1CC)Cl)CC 2430a_100000211528_100015525214 [0,1,1,0,0,0|2,0,0]=4 177 B17R1.125354 CCNC(=O)Nc1c(ccc(c1CC)Cl)CC 512a_100000211528_100015525214 [0,1,1,0,0,0|2,0,0]=4 178 B17R1.155133 CCc1cccc(c1NC(=O)N(C)CC)CC 2430a_100000211307_100000225621 [0,1,1,0,0,0|2,0,0]=4 179 B17R1.162653 CCc1cccc(c1NC(=O)NC(C)C)CC 2430a_100000211307_100138425928 [0,1,1,0,0,0|2,0,0]=4 180 B17R1.162653 CCc1cccc(c1NC(=O)NC(C)C)CC 512a_100000211307_100138425928 [0,1,1,0,0,0|2,0,0]=4 181 B17R1.169247 CCCNC(=O)Nc1c(cccc1CC)CC 2430a_100000211307_100020643023 [0,1,1,0,0,0|2,0,0]=4 182 B17R1.169247 CCCNC(=O)Nc1c(cccc1CC)CC 512a_100000211307_100020643023 [0,1,1,0,0,0|2,0,0]=4 183 B17R1.169247 CCNCC(=O)Nc1c(cccc1CC)CC 2230a_100015525214_100000183655 [0,1,1,0,0,0|2,0,0]=4 184 B17R1.169247 CCNNC(=O)Nc1c(cccc1CC)CC 512a_100000211307_100000756455 [0,1,1,0,0,0|2,0,0]=4 185 B17R1.169247 CCc1cccc(c1NC(=O)NCCF)CC 2430a_100000211307_100000724931 [0,1,1,0,0,0|2,0,0]=4 186 B17R1.169247 CCc1cccc(c1NC(=O)NCCF)CC 512a_100000211307_100000724931 [0,1,1,0,0,0|2,0,0]=4 187 B17R1.169247 CCc1cccc(c1NC(=O)NCCO)CC 2430a_100000211307_100000210304 [0,1,1,0,0,0|2,0,0]=4 188 B17R1.169247 CCc1cccc(c1NC(=O)NCCO)CC 512a_100000211307_100000210304 [0,1,1,0,0,0|2,0,0]=4 189 B17R1.173700 CCNC(=O)Nc1c(cc(cc1CC)Br)CC 2430a_100011216614_100015525214 [0,1,1,0,0,0|2,0,0]=4 190 B17R1.173700 CCNC(=O)Nc1c(cc(cc1CC)Br)CC 512a_100011216614_100015525214 [0,1,1,0,0,0|2,0,0]=4 191 B17R1.173700 CCNC(=O)Nc1c(cc(cc1CC)C)CC 2430a_100000061337_100015525214 [0,1,1,0,0,0|2,0,0]=4 192 B17R1.173700 CCNC(=O)Nc1c(cc(cc1CC)C)CC 512a_100000061337_100015525214 [0,1,1,0,0,0|2,0,0]=4 193 B17R2.5391 CCc1cc(cc(c1C2=CCCC2)CC)Br 271570a_100000089523_100010205833 [0,1,0,0,1,0|2,0,0]=4 194 B17R2.5391 CCc1cc(cc(c1C2=CCCC2)CC)C 271570a_100000089523_100010203090 [0,1,0,0,1,0|2,0,0]=4 195 B17R2.5391 CCc1cc(cc(c1c2ncc[nH]2)CC)Br 271570a_100016988920_100010205833 [0,1,0,0,1,0|0,0,2]=4 196 B17R2.5391 CCc1cc(cc(c1c2ncc[nH]2)CC)C 271570a_100016988920_100010203090 [0,1,0,0,1,0|0,0,2]=4 197 B17R2.5391 CCc1cc(cc(c1c2ncc[nH]2)CC)C 271570a_200010870704_100025796157 [0,1,0,0,1,0|0,0,2]=4 198 B19R2.7837 CCc1cc(cc(c1NCC2=NCCN2)CC)Br 34a_100011216614_100000737910 [0,1,0,0,0,1|0,0,0]=2 199 B19R2.7837 CCc1cc(cc(c1NCC2=NCCN2)CC)Br 7a_100011216614_100000737910 [0,1,0,0,0,1|0,0,0]=2 200 B19R2.7837 CCc1cc(cc(c1NCC2=NCCN2)CC)C 34a_100000061337_100000737910 [0,1,0,0,0,1|0,0,0]=2 201 B19R2.7837 CCc1cc(cc(c1NCC2=NCCN2)CC)C 7a_100000061337_100000737910 [0,1,0,0,0,1|0,0,0]=2 202 B19R2.7837 CCc1cc(cc(c1NCc2ncc[nH]2)CC)Br 207a_100011216614_100000743867 [0,1,0,0,0,1|0,0,2]=4 203 B19R2.7837 CCc1cc(cc(c1NCc2ncc[nH]2)CC)Br 2230a_100011216614_100016991755 [0,1,0,0,0,1|0,0,2]=4 204 B19R2.7837 CCc1cc(cc(c1NCc2ncc[nH]2)CC)Br 34a_100011216614_100016991755 [0,1,0,0,0,1|0,0,2]=4 205 B19R2.7837 CCc1cc(cc(c1NCc2ncc[nH]2)CC)Br 7a_100011216614_100000753453 [0,1,0,0,0,1|0,0,2]=4 206 B19R2.7837 CCc1cc(cc(c1NCc2ncc[nH]2)CC)C 207a_100000061337_100000743867 [0,1,0,0,0,1|0,0,2]=4 207 B19R2.7837 CCc1cc(cc(c1NCc2ncc[nH]2)CC)C 2230a_100000061337_100016991755 [0,1,0,0,0,1|0,0,2]=4 208 B19R2.7837 CCc1cc(cc(c1NCc2ncc[nH]2)CC)C 34a_100000061337_100016991755 [0,1,0,0,0,1|0,0,2]=4 209 B19R2.7837 CCc1cc(cc(c1NCc2ncc[nH]2)CC)C 7a_100000061337_100000753453 [0,1,0,0,0,1|0,0,2]=4 210 B19R2.7837 CCc1cc(cc(c1NCc2nnn[nH]2)CC)Br 34a_100011216614_100000765167 [0,1,0,0,0,1|2,0,0]=4 211 B19R2.7837 CCc1cc(cc(c1NCc2nnn[nH]2)CC)Br 7a_100011216614_100000765167 [0,1,0,0,0,1|2,0,0]=4 212 B19R2.7837 CCc1cc(cc(c1NCc2nnn[nH]2)CC)C 34a_100000061337_100000765167 [0,1,0,0,0,1|2,0,0]=4 213 B19R2.7837 CCc1cc(cc(c1NCc2nnn[nH]2)CC)C 7a_100000061337_100000765167 [0,1,0,0,0,1|2,0,0]=4 214 B19R2.7837 CCc1cc(cc(c1SCC2=NCCN2)CC)Br 62a_100000737910_100010205833 [0,1,0,0,0,1|0,0,0]=2 215 B19R2.7837 CCc1cc(cc(c1SCC2=NCCN2)CC)Br 62a_100010205833_100000737910 [0,1,0,0,0,1|0,0,0]=2 216 B19R2.7837 CCc1cc(cc(c1SCC2=NCCN2)CC)C 62a_100000737910_100010203090 [0,1,0,0,0,1|0,0,0]=2 217 B19R2.7837 CCc1cc(cc(c1SCC2=NCCN2)CC)C 62a_100010203090_100000737910 [0,1,0,0,0,1|0,0,0]=2 218 B19R2.7837 CCc1cc(cc(c1SCc2ncc[nH]2)CC)Br 62a_100010205833_100016991755 [0,1,0,0,0,1|0,0,2]=4 219 B19R2.7837 CCc1cc(cc(c1SCc2ncc[nH]2)CC)Br 62a_100016991755_100010205833 [0,1,0,0,0,1|0,0,2]=4 220 B19R2.7837 CCc1cc(cc(c1SCc2ncc[nH]2)CC)C 62a_100010203090_100016991755 [0,1,0,0,0,1|0,0,2]=4 221 B19R2.7837 CCc1cc(cc(c1SCc2ncc[nH]2)CC)C 62a_100016991755_100010203090 [0,1,0,0,0,1|0,0,2]=4 222 B19R2.7837 CCc1cc(cc(c1SCc2nnn[nH]2)CC)Br 62a_100000765167_100010205833 [0,1,0,0,0,1|2,0,0]=4 223 B19R2.7837 CCc1cc(cc(c1SCc2nnn[nH]2)CC)Br 62a_100010205833_100000765167 [0,1,0,0,0,1|2,0,0]=4 224 B19R2.7837 CCc1cc(cc(c1SCc2nnn[nH]2)CC)C 62a_100000765167_100010203090 [0,1,0,0,0,1|2,0,0]=4 225 B19R2.7837 CCc1cc(cc(c1SCc2nnn[nH]2)CC)C 62a_100010203090_100000765167 [0,1,0,0,0,1|2,0,0]=4 226 B19R2.7837 COc1cc(cc(c1OCC2=NCCN2)CO)Br 34a_100000185604_100000737910 [0,1,0,0,0,1|2,0,0]=4 227 B19R2.7837 COc1cc(cc(c1OCC2=NCCN2)OC)Br 34a_100000691893_100000737910 [0,1,0,0,0,1|2,0,0]=4 228 B19R2.7837 COc1cc(cc(c1OCC2=NCCN2)OC)C 34a_100000186469_100000737910 [0,1,0,0,0,1|2,0,0]=4 229 B19R2.7837 Cc1cc(c(c(c1)CO)OCC2=NCCN2)CO 34a_100000028443_100000737910 [0,1,0,0,0,1|2,0,0]=4 230 B19R2.7837 Cc1cc(c(c(c1)CO)OCC2=NCCN2)CO 7a_100000028443_100000737910 [0,1,0,0,0,1|2,0,0]=4 231 B19R2.7837 OCc1cc(cc(c1OCC2=NCCN2)CO)F 34a_100000010574_100000737910 [0,1,0,0,0,1|2,0,0]=4 232 B19R2.7837 OCc1cc(cc(c1OCC2=NCCN2)CO)F 7a_100000010574_100000737910 [0,1,0,0,0,1|2,0,0]=4 233 B19R2.85617 CCOc1cccc(c1SCC2=NCCN2)C=O 62a_100000737910_200011094417 [0,1,0,0,0,1|1,0,1]=4 234 B19R2.85617 CCOc1cccc(c1SCC2=NCCN2)C=O 62a_200011094417_100000737910 [0,1,0,0,0,1|1,0,1]=4 235 B19R2.184958 CCc1ccc(c(c1NCC2=NCCN2)CC)Cl 34a_100000211528_100000737910 [0,1,0,0,0,1|0,0,0]=2 236 B19R2.184958 CCc1ccc(c(c1NCC2=NCCN2)CC)Cl 7a_100000211528_100000737910 [0,1,0,0,0,1|0,0,0]=2 237 B19R2.184958 CCc1ccc(c(c1NCc2ncc[nH]2)CC)Cl 207a_100000211528_100000743867 [0,1,0,0,0,1|0,0,2]=4 238 B19R2.184958 CCc1ccc(c(c1NCc2ncc[nH]2)CC)Cl 2230a_100000211528_100016991755 [0,1,0,0,0,1|0,0,2]=4 239 B19R2.184958 CCc1ccc(c(c1NCc2ncc[nH]2)CC)Cl 34a_100000211528_100016991755 [0,1,0,0,0,1|0,0,2]=4 240 B19R2.184958 CCc1ccc(c(c1NCc2ncc[nH]2)CC)Cl 7a_100000211528_100000753453 [0,1,0,0,0,1|0,0,2]=4 241 B19R2.184958 CCc1ccc(c(c1NCc2nnn[nH]2)CC)Cl 34a_100000211528_100000765167 [0,1,0,0,0,1|2,0,0]=4 242 B19R2.184958 CCc1ccc(c(c1NCc2nnn[nH]2)CC)Cl 7a_100000211528_100000765167 [0,1,0,0,0,1|2,0,0]=4 243 B19R2.184958 COc1ccc(c(c1SCC2=NCCN2)CO)F 62a_100000737910_200010942130 [0,1,0,0,0,1|2,0,0]=4 244 B19R2.184958 COc1ccc(c(c1SCC2=NCCN2)CO)F 62a_200010942130_100000737910 [0,1,0,0,0,1|2,0,0]=4 245 B19R2.184958 COc1ccc(c(c1SCC2=NCCN2)SC)F 62a_100000737910_200021624531 [0,1,0,0,0,1|2,0,0]=4 246 B19R2.184958 COc1ccc(c(c1SCC2=NCCN2)SC)F 62a_200021624531_100000737910 [0,1,0,0,0,1|2,0,0]=4 247 B19R2.190802 CCc1cccc(c1NCc2nccn2C)CC 207a_100000211307_100000748660 [0,1,0,0,0,1|0,0,2]=4 248 B19R2.190802 CCc1cccc(c1NCc2nccn2C)CC 2230a_100000211307_100000700302 [0,1,0,0,0,1|0,0,2]=4 249 B19R2.190802 CCc1cccc(c1NCc2nccn2C)CC 34a_100000211307_100000700302 [0,1,0,0,0,1|0,0,2]=4 250 B19R2.190802 CCc1cccc(c1NCc2nccn2C)CC 7a_100000211307_100000700302 [0,1,0,0,0,1|0,0,2]=4 251 B19R2.190802 CCc1cccc(c1OCc2nccn2C)CC 34a_100000078057_100000700302 [0,1,0,0,0,1|0,0,2]=4 252 B19R2.190802 CCc1cccc(c1OCc2nccn2C)CC 7a_100000078057_100000700302 [0,1,0,0,0,1|0,0,2]=4 253 B19R2.190802 CCc1cccc(c1SCc2nccn2C)CC 62a_100000700302_100010212195 [0,1,0,0,0,1|0,0,2]=4 254 B19R2.190802 CCc1cccc(c1SCc2nccn2C)CC 62a_100010212195_100000700302 [0,1,0,0,0,1|0,0,2]=4 255 B19R2.191463 CCc1cccc(c1C(=O)Cc2nnn[nH]2)CC 1458a_100000092080_100000765167 [0,1,0,0,0,1|2,0,0]=4 256 B19R2.191538 CCc1cccc(c1NCc2n[nH]c(=O)[nH]2)CC 2230a_100000211307_100000754189 [0,1,0,0,0,1|1,0,1]=4 257 B19R2.191538 CCc1cccc(c1NCc2n[nH]c(=O)[nH]2)CC 7a_100000211307_100000754189 [0,1,0,0,0,1|1,0,1]=4 258 B19R2.191538 CCc1cccc(c1NCc2nc(c[nH]2)C)CC 207a_100000211307_100000082322 [0,1,0,0,0,1|0,0,2]=4 259 B19R2.191538 CCc1cccc(c1OCc2n[nH]c(=O)[nH]2)CC 7a_100000078057_100000754189 [0,1,0,0,0,1|1,0,1]=4 260 B19R2.191538 CCc1cccc(c1SCc2n[nH]c(=O)[nH]2)CC 62a_100010212195_100000754189 [0,1,0,0,0,1|1,0,1]=4 261 B15R1.10623 CCCC(=O)c1c(cccc1CC)CC 1458a_100000092080_100000210303 [0,0,1,0,1,0|2,0,0]=4 262 B15R1.10623 CCNC(=O)c1c(cccc1CC)CC 11a_100015525214_100000092080 [0,0,1,0,1,0|1,0,0]=3 263 B15R1.10623 CCNC(=O)c1c(cccc1CC)CC 240690a_100015525214_100000092080 [0,0,1,0,1,0|1,0,0]=3 264 B15R1.10623 CCc1cccc(c1C(=O)NNC)CC 22a_100016993582_100000092080 [0,0,1,0,1,0|2,0,0]=4 265 B15R2.2493 CCc1cccc(c1C2=CCCC2)C 271570a_100000089523_100000036235 [1,0,0,0,1,0|2,0,0]=4 266 B15R2.2493 CCc1cccc(c1c2ncc[nH]2)C 271570a_100016988920_100000036235 [1,0,0,0,1,0|0,0,2]=4 267 B15R2.2451 CCc1cccc(c1NC2CC2)CC 34a_100000211307_100000211595 [0,0,0,0,2,0|1,0,1]=4 268 B15R2.2451 CCc1cccc(c1OC2CC2)CC 34a_100000078057_100000211595 [0,0,0,0,2,0|1,0,1]=4 269 B15R2.2451 CCc1cccc(c1SC2CC2)CC 62a_100010212195_100000211595 [0,0,0,0,2,0|1,0,1]=4 270 B17R2.71328 CCc1cccc(c1NCC2=NCCN2)C 34a_100000210048_100000737910 [1,0,0,0,0,1|0,0,0]=2 271 B17R2.71328 CCc1cccc(c1NCC2=NCCN2)C 7a_100000210048_100000737910 [1,0,0,0,0,1|0,0,0]=2 272 B17R2.71328 CCc1cccc(c1NCc2ncc[nH]2)C 207a_100000210048_100000743867 [1,0,0,0,0,1|0,0,2]=4 273 B17R2.71328 CCc1cccc(c1NCc2ncc[nH]2)C 2230a_100000210048_100016991755 [1,0,0,0,0,1|0,0,2]=4 274 B17R2.71328 CCc1cccc(c1NCc2ncc[nH]2)C 34a_100000210048_100016991755 [1,0,0,0,0,1|0,0,2]=4 275 B17R2.71328 CCc1cccc(c1NCc2ncc[nH]2)C 7a_100000210048_100000753453 [1,0,0,0,0,1|0,0,2]=4 276 B17R2.71328 CCc1cccc(c1NCc2nnn[nH]2)C 34a_100000210048_100000765167 [1,0,0,0,0,1|2,0,0]=4 277 B17R2.71328 CCc1cccc(c1NCc2nnn[nH]2)C 7a_100000210048_100000765167 [1,0,0,0,0,1|2,0,0]=4 278 B17R2.71328 CCc1cccc(c1OCC2=NCCN2)Br 34a_200010001580_100000737910 [1,0,0,0,0,1|1,0,0]=3 279 B17R2.71328 CCc1cccc(c1OCC2=NCCN2)Br 7a_200010001580_100000737910 [1,0,0,0,0,1|1,0,0]=3 280 B17R2.71328 CCc1cccc(c1OCC2=NCCN2)C 34a_100000034007_100000737910 [1,0,0,0,0,1|0,0,0]=2 281 B17R2.71328 CCc1cccc(c1OCC2=NCCN2)C 7a_100000034007_100000737910 [1,0,0,0,0,1|0,0,0]=2 282 B17R2.71328 CCc1cccc(c1OCc2ncc[nH]2)C 34a_100000034007_100016991755 [1,0,0,0,0,1|0,0,2]=4 283 B17R2.71328 CCc1cccc(c1OCc2ncc[nH]2)C 7a_100000034007_100000753453 [1,0,0,0,0,1|0,0,2]=4 284 B17R2.71328 CCc1cccc(c1OCc2nnn[nH]2)C 34a_100000034007_100000765167 [1,0,0,0,0,1|2,0,0]=4 285 B17R2.71328 CCc1cccc(c1OCc2nnn[nH]2)C 7a_100000034007_100000765167 [1,0,0,0,0,1|2,0,0]=4 286 B17R2.71328 CCc1cccc(c1SCC2=NCCN2)C 62a_100000036235_100000737910 [1,0,0,0,0,1|0,0,0]=2 287 B17R2.71328 CCc1cccc(c1SCC2=NCCN2)C 62a_100000737910_100000036235 [1,0,0,0,0,1|0,0,0]=2 288 B17R2.71328 CCc1cccc(c1SCc2ncc[nH]2)C 62a_100000036235_100016991755 [1,0,0,0,0,1|0,0,2]=4 289 B17R2.71328 CCc1cccc(c1SCc2ncc[nH]2)C 62a_100016991755_100000036235 [1,0,0,0,0,1|0,0,2]=4 290 B17R2.71328 CCc1cccc(c1SCc2nnn[nH]2)C 62a_100000036235_100000765167 [1,0,0,0,0,1|2,0,0]=4 291 B17R2.71328 CCc1cccc(c1SCc2nnn[nH]2)C 62a_100000765167_100000036235 [1,0,0,0,0,1|2,0,0]=4 292 B17R2.71328 CCc1occc(=O)c1OCC2=NCCN2 34a_100000033269_100000737910 [1,0,0,0,0,1|2,0,0]=4 293 B17R2.71328 COc1cccc(c1NCC2=NCCN2)Br 34a_100000708083_100000737910 [1,0,0,0,0,1|2,0,0]=4 294 B17R2.71328 COc1cccc(c1NCC2=NCCN2)C 34a_100000758225_100000737910 [1,0,0,0,0,1|1,0,0]=3 295 B17R2.71328 COc1cccc(c1NCC2=NCCN2)Cl 34a_100011309317_100000737910 [1,0,0,0,0,1|2,0,0]=4 296 B17R2.71328 COc1cccc(c1NCC2=NCCN2)F 34a_100000686744_100000737910 [1,0,0,0,0,1|2,0,0]=4 297 B17R2.71328 COc1cccc(c1NCC2=NCCN2)O 34a_100012022766_100000737910 [1,0,0,0,0,1|2,0,0]=4 298 B17R2.71328 COc1cccc(c1OCC2=NCCN2)Br 34a_100000686866_100000737910 [1,0,0,0,0,1|2,0,0]=4 299 B17R2.71328 COc1cccc(c1OCC2=NCCN2)C 34a_100011219253_100000737910 [1,0,0,0,0,1|1,0,0]=3 300 B17R2.71328 COc1cccc(c1OCC2=NCCN2)C 7a_100011219253_100000737910 [1,0,0,0,0,1|1,0,0]=3 301 B17R2.71328 COc1cccc(c1OCC2=NCCN2)Cl 34a_100009851661_100000737910 [1,0,0,0,0,1|2,0,0]=4 302 B17R2.71328 COc1cccc(c1OCC2=NCCN2)Cl 7a_100009851661_100000737910 [1,0,0,0,0,1|2,0,0]=4 303 B17R2.71328 COc1cccc(c1OCC2=NCCN2)F 34a_100000036725_100000737910 [1,0,0,0,0,1|2,0,0]=4 304 B17R2.71328 COc1cccc(c1OCC2=NCCN2)F 7a_100000036725_100000737910 [1,0,0,0,0,1|2,0,0]=4 305 B17R2.71328 COc1cccc(c1OCC2=NCCN2)N 34a_100000123586_100000737910 [1,0,0,0,0,1|2,0,0]=4 306 B17R2.71328 COc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100010131421 [1,0,0,0,0,1|2,0,0]=4 307 B17R2.71328 COc1cccc(c1SCC2=NCCN2)Br 62a_100010131421_100000737910 [1,0,0,0,0,1|2,0,0]=4 308 B17R2.71328 COc1cccc(c1SCC2=NCCN2)C 62a_100000737910_100010191535 [1,0,0,0,0,1|1,0,0]=3 309 B17R2.71328 COc1cccc(c1SCC2=NCCN2)C 62a_100010191535_100000737910 [1,0,0,0,0,1|1,0,0]=3 310 B17R2.71328 COc1cccc(c1SCC2=NCCN2)F 62a_100000703912_100000737910 [1,0,0,0,0,1|2,0,0]=4 311 B17R2.71328 COc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100000703912 [1,0,0,0,0,1|2,0,0]=4 312 B17R2.71328 COc1cccc(c1SCC2=NCCN2)N 62a_100000703447_100000737910 [1,0,0,0,0,1|2,0,0]=4 313 B17R2.71328 COc1cccc(c1SCC2=NCCN2)N 62a_100000737910_100000703447 [1,0,0,0,0,1|2,0,0]=4 314 B17R2.71328 COc1cccc(c1SCC2=NCCN2)O 62a_100000737910_100010202623 [1,0,0,0,0,1|2,0,0]=4 315 B17R2.71328 COc1nccc(c1SCC2=NCCN2)C 62a_100000737910_100012353928 [1,0,0,0,0,1|2,0,0]=4 316 B17R2.71328 COc1nccc(c1SCC2=NCCN2)C 62a_100012353928_100000737910 [1,0,0,0,0,1|2,0,0]=4 317 B17R2.71328 Cc1cccc(c1NCC2=NCCN2)CO 34a_100011215590_100000737910 [1,0,0,0,0,1|1,0,0]=3 318 B17R2.71328 Cc1cccc(c1OCC2=NCCN2)C#N 34a_100011659161_100000737910 [1,0,0,0,0,1|1,0,1]=4 319 B17R2.71328 Cc1cccc(c1OCC2=NCCN2)C#N 7a_100011659161_100000737910 [1,0,0,0,0,1|1,0,1]=4 320 B17R2.71328 Cc1cccc(c1OCC2=NCCN2)CN 34a_100020639391_100000737910 [1,0,0,0,0,1|1,0,0]=3 321 B17R2.71328 Cc1cccc(c1SCC2=NCCN2)C#N 62a_100000737910_100011934862 [1,0,0,0,0,1|1,0,1]=4 322 B17R2.71328 Cc1cccc(c1SCC2=NCCN2)C=O 62a_100000737910_100012186367 [1,0,0,0,0,1|1,0,1]=4 323 B17R2.71328 Cc1cccc(c1SCC2=NCCN2)C=O 62a_100012186367_100000737910 [1,0,0,0,0,1|1,0,1]=4 324 B17R2.71328 Cc1cccc(c1SCC2=NCCN2)CO 62a_100000737910_100011659289 [1,0,0,0,0,1|1,0,0]=3 325 B17R2.71328 Cc1cccc(c1SCC2=NCCN2)CO 62a_100011659289_100000737910 [1,0,0,0,0,1|1,0,0]=3 326 B17R2.71328 NCc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100020638964 [1,0,0,0,0,1|2,0,0]=4 327 B17R2.71328 NCc1cccc(c1SCC2=NCCN2)F 62a_100020638964_100000737910 [1,0,0,0,0,1|2,0,0]=4 328 B17R2.71328 OCc1cccc(c1NCC2=NCCN2)Cl 34a_100012182729_100000737910 [1,0,0,0,0,1|2,0,0]=4 329 B17R2.71328 OCc1cccc(c1NCC2=NCCN2)F 34a_100000692437_100000737910 [1,0,0,0,0,1|2,0,0]=4 330 B17R2.71328 OCc1cccc(c1OCC2=NCCN2)F 34a_100011997349_100000737910 [1,0,0,0,0,1|2,0,0]=4 331 B17R2.71328 OCc1cccc(c1OCC2=NCCN2)F 7a_100011997349_100000737910 [1,0,0,0,0,1|2,0,0]=4 332 B17R2.71328 OCc1cccc(c1SCC2=NCCN2)Br 62a_100000737910_100010146604 [1,0,0,0,0,1|2,0,0]=4 333 B17R2.71328 OCc1cccc(c1SCC2=NCCN2)Br 62a_100010146604_100000737910 [1,0,0,0,0,1|2,0,0]=4 334 B17R2.71328 OCc1cccc(c1SCC2=NCCN2)F 62a_100000737910_100012351117 [1,0,0,0,0,1|2,0,0]=4 335 B17R2.71328 OCc1cccc(c1SCC2=NCCN2)F 62a_100012351117_100000737910 [1,0,0,0,0,1|2,0,0]=4 336 B19R2.191185 CCc1cccc(c1NCCc2nnn[nH]2)CC 7a_100000211307_100000031946 [0,0,0,0,0,2|2,0,0]=4 337 B19R2.191185 CCc1cccc(c1OCCc2nnn[nH]2)CC 7a_100000078057_100000031946 [0,0,0,0,0,2|2,0,0]=4 338 B19R2.191185 CCc1cccc(c1SCCc2nnn[nH]2)CC 62a_100000031946_100010212195 [0,0,0,0,0,2|2,0,0]=4 339 B19R2.191185 CCc1cccc(c1SCCc2nnn[nH]2)CC 62a_100010212195_100000031946 [0,0,0,0,0,2|2,0,0]=4 340 B19R2.191185 COc1cccc(c1CNCC2=NCCN2)OC 34a_100011211632_100000737910 [0,0,0,0,0,2|2,0,0]=4 341 B19R2.191185 COc1cccc(c1COCC2=NCCN2)OC 34a_100000686646_100000737910 [0,0,0,0,0,2|2,0,0]=4 342 B19R2.191185 COc1cccc(c1COCC2=NCCN2)OC 7a_100000686646_100000737910 [0,0,0,0,0,2|2,0,0]=4 343 B19R2.191185 COc1cccc(c1COCC2=NCCN2)SC 34a_200009828978_100000737910 [0,0,0,0,0,2|2,0,0]=4