0 B19R2.4993 C=Cc1ccc(cc1)CSc2c[nH]c(=O)c(c2)O 62a_100000034074_100009814561 [0,0,0,0,0,0|3,0,1]=4 1 B19R2.4993 C=Cc1ccc(cc1)CSc2cc(c(=O)[nH]n2)C 62a_100000034074_100012187101 [0,0,0,0,0,0|3,0,1]=4 2 B19R2.4993 C=Cc1ccc(cc1)CSc2cc(c(=O)[nH]n2)N 62a_100000034074_100000102183 [0,0,0,0,0,0|3,0,1]=4 3 B19R2.4993 CCc1ccc(cc1)C=Cc2c[nH]c(=O)c(c2)O 271570a_200000062238_100009814561 [0,0,0,0,0,0|2,0,2]=4 4 B19R2.4993 CCc1ccc(cc1)C=Cc2cc(c(=O)[nH]n2)C 271570a_200000062238_100012187101 [0,0,0,0,0,0|2,0,2]=4 5 B19R2.4993 CCc1ccc(cc1)C=Cc2cc(c(=O)[nH]n2)N 271570a_200000062238_100000102183 [0,0,0,0,0,0|2,0,2]=4 6 B19R2.4993 CCc1ccc(cc1)CSc2c[nH]c(=O)c(c2)Br 62a_100000757233_100010125443 [0,0,0,0,0,0|4,0,0]=4 7 B19R2.4993 CCc1ccc(cc1)CSc2c[nH]c(=O)c(c2)Br 62a_100010125443_100000747183 [0,0,0,0,0,0|4,0,0]=4 8 B19R2.4993 CCc1ccc(cc1)CSc2c[nH]c(=O)c(c2)F 62a_100000723523_100000747183 [0,0,0,0,0,0|4,0,0]=4 9 B19R2.4993 CCc1ccc(cc1)CSc2c[nH]c(=O)c(c2)F 62a_100000757233_100000723523 [0,0,0,0,0,0|4,0,0]=4 10 B19R2.4993 CCc1ccc(cc1)CSc2c[nH]c(=O)c(c2)O 62a_100000757233_100009814561 [0,0,0,0,0,0|3,0,0]=3 11 B19R2.4993 CCc1ccc(cc1)CSc2cc(c(=O)[nH]n2)C 62a_100000757233_100012187101 [0,0,0,0,0,0|3,0,0]=3 12 B19R2.4993 CCc1ccc(cc1)CSc2cc(c(=O)[nH]n2)N 62a_100000757233_100000102183 [0,0,0,0,0,0|3,0,0]=3 13 B19R2.4993 CCc1ccc(cc1)CSc2cc(c(cn2)C)O 62a_100000704368_100000747183 [0,0,0,0,0,0|4,0,0]=4 14 B19R2.4993 CCc1ccc(cc1)CSc2cc(c(cn2)C)O 62a_100000757233_100000704368 [0,0,0,0,0,0|4,0,0]=4 15 B19R2.4993 CCc1ccc(cc1)CSc2cc(c(cn2)F)O 62a_100000757233_100009854642 [0,0,0,0,0,0|4,0,0]=4 16 B19R2.4993 CCc1ccc(cc1)CSc2cc(c(cn2)F)O 62a_100009854642_100000747183 [0,0,0,0,0,0|4,0,0]=4 17 B19R2.4993 CCc1ccc(cc1)NCc2c[nH]c(=O)c(c2)Cl 207a_100000211069_100000051075 [0,0,0,0,0,0|4,0,0]=4 18 B19R2.4993 CCc1ccc(cc1)NCc2c[nH]c(=O)c(c2)Cl 270302a_100000211069_100000051075 [0,0,0,0,0,0|4,0,0]=4 19 B19R2.4993 CSc1ccc(cc1)CSc2c[nH]c(=O)c(c2)O 62a_100000181263_100009814561 [0,0,0,0,0,0|4,0,0]=4 20 B19R2.4993 CSc1ccc(cc1)CSc2cc(c(=O)[nH]n2)C 62a_100000181263_100012187101 [0,0,0,0,0,0|4,0,0]=4 21 B19R2.4993 CSc1ccc(cc1)CSc2cc(c(=O)[nH]n2)N 62a_100000181263_100000102183 [0,0,0,0,0,0|4,0,0]=4 22 B19R2.4993 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)C=O 62a_100009816848_100012187101 [0,0,0,0,0,0|2,0,2]=4 23 B19R2.4993 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)CO 62a_100000067286_100012187101 [0,0,0,0,0,0|2,0,0]=2 24 B19R2.4993 Cc1cc(ncc1Br)OCc2ccc(cc2)CO 34a_100000766222_100000067286 [0,0,0,0,0,0|4,0,0]=4 25 B19R2.4993 Cc1cc(ncc1Br)SCc2ccc(cc2)CO 62a_100000067286_100012356354 [0,0,0,0,0,0|4,0,0]=4 26 B19R2.4993 Cc1cc(ncc1Br)SCc2ccc(cc2)CO 62a_100012356354_100000067286 [0,0,0,0,0,0|4,0,0]=4 27 B19R2.4993 Cc1cc(ncc1Cl)OCc2ccc(cc2)CO 34a_200000085746_100000067286 [0,0,0,0,0,0|4,0,0]=4 28 B19R2.4993 Cc1cc(ncc1F)SCc2ccc(cc2)CO 62a_100000067286_100009818257 [0,0,0,0,0,0|4,0,0]=4 29 B19R2.4993 Cc1cc(ncc1F)SCc2ccc(cc2)CO 62a_100009818257_100000067286 [0,0,0,0,0,0|4,0,0]=4 30 B19R2.4993 Cc1cc(ncc1N)SCc2ccc(cc2)CO 62a_100000067204_100000067286 [0,0,0,0,0,0|4,0,0]=4 31 B19R2.4993 Cc1cc(ncc1N)SCc2ccc(cc2)CO 62a_100000067286_100000067204 [0,0,0,0,0,0|4,0,0]=4 32 B19R2.4993 Cc1cc(ncc1O)SCc2ccc(cc2)CO 62a_100000067286_100000692680 [0,0,0,0,0,0|3,0,1]=4 33 B19R2.4993 Cc1cc(nnc1N)SCc2ccc(cc2)CO 62a_100000067286_100153394926 [0,0,0,0,0,0|3,0,1]=4 34 B19R2.4993 Cc1cc(nnc1N)SCc2ccc(cc2)CO 62a_100153394926_100000067286 [0,0,0,0,0,0|3,0,1]=4 35 B19R2.4993 Cc1ccc(cc1O)NCc2ccc(cc2)CO 270302a_100000759471_100009832023 [0,0,0,0,0,0|4,0,0]=4 36 B19R2.4993 Cc1ccc(cc1O)NCc2ccc(cc2)CO 34a_100000759471_100000067286 [0,0,0,0,0,0|4,0,0]=4 37 B19R2.4993 Cc1ccc(cc1O)NCc2ccc(cc2)CO 7a_100000759471_100000067286 [0,0,0,0,0,0|4,0,0]=4 38 B19R2.4993 Cc1ccc(cc1O)SCc2ccc(cc2)CO 62a_100000067286_100000685420 [0,0,0,0,0,0|4,0,0]=4 39 B19R2.4993 Cc1ccc(cc1O)SCc2ccc(cc2)CO 62a_100000685420_100000067286 [0,0,0,0,0,0|4,0,0]=4 40 B19R2.4993 Cc1cnc(cc1Br)OCc2ccc(cc2)CO 34a_100009831917_100000067286 [0,0,0,0,0,0|4,0,0]=4 41 B19R2.4993 Cc1cnc(cc1C)SCc2ccc(cc2)CO 62a_100000067286_100009850809 [0,0,0,0,0,0|4,0,0]=4 42 B19R2.4993 Cc1cnc(cc1C)SCc2ccc(cc2)CO 62a_100009850809_100000067286 [0,0,0,0,0,0|4,0,0]=4 43 B19R2.4993 Cc1cnc(cc1F)NCc2ccc(cc2)CO 27a_100015189231_100009841206 [0,0,0,0,0,0|4,0,0]=4 44 B19R2.4993 Cc1cnc(cc1F)SCc2ccc(cc2)CO 62a_100000067286_100009841206 [0,0,0,0,0,0|4,0,0]=4 45 B19R2.4993 Cc1cnc(cc1F)SCc2ccc(cc2)CO 62a_100009841206_100000067286 [0,0,0,0,0,0|4,0,0]=4 46 B19R2.4993 Cc1cnc(cc1N)SCc2ccc(cc2)CO 62a_100000067286_100000126663 [0,0,0,0,0,0|4,0,0]=4 47 B19R2.4993 Cc1cnc(cc1N)SCc2ccc(cc2)CO 62a_100000126663_100000067286 [0,0,0,0,0,0|4,0,0]=4 48 B19R2.4993 Cc1cnc(cc1O)SCc2ccc(cc2)CO 62a_100000067286_100000704368 [0,0,0,0,0,0|3,0,0]=3 49 B19R2.4993 Cc1cnc(cc1O)SCc2ccc(cc2)CO 62a_100000704368_100000067286 [0,0,0,0,0,0|3,0,0]=3 50 B19R2.4993 Cc1nc(c[nH]c1=O)SCc2ccc(cc2)CO 62a_100000067286_100010363809 [0,0,0,0,0,0|4,0,0]=4 51 B19R2.4993 Cc1nc(c[nH]c1=O)SCc2ccc(cc2)CO 62a_100010363809_100000067286 [0,0,0,0,0,0|4,0,0]=4 52 B19R2.4993 Cc1ncc(cc1O)SCc2ccc(cc2)CO 62a_100000067286_100009864810 [0,0,0,0,0,0|3,0,1]=4 53 B19R2.4993 Cc1ncc(cc1O)SCc2ccc(cc2)CO 62a_100009864810_100000067286 [0,0,0,0,0,0|3,0,1]=4 54 B19R2.4993 Cn1cc(ncc1=O)SCc2ccc(cc2)CO 62a_100000067286_100009843036 [0,0,0,0,0,0|4,0,0]=4 55 B19R2.4993 Cn1cc(ncc1=O)SCc2ccc(cc2)CO 62a_100009843036_100000067286 [0,0,0,0,0,0|4,0,0]=4 56 B19R2.4993 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)C=O 62a_100009816848_100000102183 [0,0,0,0,0,0|2,0,2]=4 57 B19R2.4993 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)CO 62a_100000067286_100000102183 [0,0,0,0,0,0|2,0,0]=2 58 B19R2.4993 Nc1cc(ncc1F)SCc2ccc(cc2)CO 62a_100000067286_100000126464 [0,0,0,0,0,0|4,0,0]=4 59 B19R2.4993 Nc1cc(ncc1F)SCc2ccc(cc2)CO 62a_100000126464_100000067286 [0,0,0,0,0,0|4,0,0]=4 60 B19R2.4993 Nc1cc(ncc1O)SCc2ccc(cc2)CO 62a_100000067286_100009819941 [0,0,0,0,0,0|3,0,1]=4 61 B19R2.4993 Nc1cc(ncc1O)SCc2ccc(cc2)CO 62a_100009819941_100000067286 [0,0,0,0,0,0|3,0,1]=4 62 B19R2.4993 Nc1ccc(cc1O)SCc2ccc(cc2)CO 62a_100000067286_100000739049 [0,0,0,0,0,0|4,0,0]=4 63 B19R2.4993 Nc1ccc(cc1O)SCc2ccc(cc2)CO 62a_100000739049_100000067286 [0,0,0,0,0,0|4,0,0]=4 64 B19R2.4993 Nc1cnc(cc1N)SCc2ccc(cc2)CO 62a_100000067286_100000067514 [0,0,0,0,0,0|4,0,0]=4 65 B19R2.4993 Nc1cnc(cc1N)SCc2ccc(cc2)CO 62a_100000067514_100000067286 [0,0,0,0,0,0|4,0,0]=4 66 B19R2.4993 Nc1ncc(cc1O)SCc2ccc(cc2)CO 62a_100000067286_100009819042 [0,0,0,0,0,0|3,0,1]=4 67 B19R2.4993 Nc1ncc(cc1O)SCc2ccc(cc2)CO 62a_100009819042_100000067286 [0,0,0,0,0,0|3,0,1]=4 68 B19R2.4993 O=Cc1ccc(cc1)CSc2c[nH]c(=O)c(c2)O 62a_100009816848_100009814561 [0,0,0,0,0,0|2,0,2]=4 69 B19R2.4993 O=c1[nH]cc(cc1Br)SCc2ccc(cc2)CO 62a_100000067286_100010125443 [0,0,0,0,0,0|3,0,0]=3 70 B19R2.4993 O=c1[nH]cc(cc1Br)SCc2ccc(cc2)CO 62a_100010125443_100000067286 [0,0,0,0,0,0|3,0,0]=3 71 B19R2.4993 O=c1[nH]cc(cc1Cl)CNc2ccc(cc2)CO 270302a_100011215238_100000051075 [0,0,0,0,0,0|3,0,0]=3 72 B19R2.4993 O=c1[nH]cc(cc1F)SCc2ccc(cc2)CO 62a_100000067286_100000723523 [0,0,0,0,0,0|3,0,0]=3 73 B19R2.4993 O=c1[nH]cc(cc1F)SCc2ccc(cc2)CO 62a_100000723523_100000067286 [0,0,0,0,0,0|3,0,0]=3 74 B19R2.4993 O=c1[nH]cc(cc1O)SCc2ccc(cc2)CO 62a_100000067286_100009814561 [0,0,0,0,0,0|2,0,0]=2 75 B19R2.4993 OCc1ccc(cc1)CNc2ccc(c(c2)O)Cl 270302a_100011934209_100009832023 [0,0,0,0,0,0|4,0,0]=4 76 B19R2.4993 OCc1ccc(cc1)CNc2ccc(c(c2)O)Cl 34a_100011934209_100000067286 [0,0,0,0,0,0|4,0,0]=4 77 B19R2.4993 OCc1ccc(cc1)CNc2ccc(c(c2)O)F 270302a_100012017398_100009832023 [0,0,0,0,0,0|4,0,0]=4 78 B19R2.4993 OCc1ccc(cc1)CNc2ccc(c(c2)O)F 34a_100012017398_100000067286 [0,0,0,0,0,0|4,0,0]=4 79 B19R2.4993 OCc1ccc(cc1)CNc2ccc(c(c2)O)F 7a_100012017398_100000067286 [0,0,0,0,0,0|4,0,0]=4 80 B19R2.4993 OCc1ccc(cc1)CNc2ccc(c(c2)O)O 34a_100102946323_100000067286 [0,0,0,0,0,0|3,0,1]=4 81 B19R2.4993 OCc1ccc(cc1)CNc2ncc(c(n2)O)F 27a_100015189231_100011995740 [0,0,0,0,0,0|4,0,0]=4 82 B19R2.4993 OCc1ccc(cc1)COc2cc(c(cn2)Br)Cl 34a_100010369989_100000067286 [0,0,0,0,0,0|4,0,0]=4 83 B19R2.4993 OCc1ccc(cc1)COc2cc(c(cn2)Cl)Cl 34a_200000099200_100000067286 [0,0,0,0,0,0|4,0,0]=4 84 B19R2.4993 OCc1ccc(cc1)CSc2cc(c(cn2)F)O 62a_100000067286_100009854642 [0,0,0,0,0,0|3,0,0]=3 85 B19R2.4993 OCc1ccc(cc1)CSc2cc(c(cn2)F)O 62a_100009854642_100000067286 [0,0,0,0,0,0|3,0,0]=3 86 B19R2.4993 OCc1ccc(cc1)CSc2ccc(c(c2)O)Br 62a_100000067286_100012356990 [0,0,0,0,0,0|4,0,0]=4 87 B19R2.4993 OCc1ccc(cc1)CSc2ccc(c(c2)O)Br 62a_100012356990_100000067286 [0,0,0,0,0,0|4,0,0]=4 88 B19R2.4993 OCc1ccc(cc1)CSc2ccc(c(c2)O)Cl 62a_100000067286_100011356854 [0,0,0,0,0,0|4,0,0]=4 89 B19R2.4993 OCc1ccc(cc1)CSc2ccc(c(c2)O)Cl 62a_100011356854_100000067286 [0,0,0,0,0,0|4,0,0]=4 90 B19R2.4993 OCc1ccc(cc1)CSc2ccc(c(c2)O)F 62a_100000067286_100000686035 [0,0,0,0,0,0|4,0,0]=4 91 B19R2.4993 OCc1ccc(cc1)CSc2ccc(c(c2)O)F 62a_100000686035_100000067286 [0,0,0,0,0,0|4,0,0]=4 92 B19R2.4993 OCc1ccc(cc1)CSc2ccc(c(c2)O)O 62a_100000067286_100009813601 [0,0,0,0,0,0|3,0,1]=4 93 B19R2.4993 OCc1ccc(cc1)CSc2cnc(c(c2)O)F 62a_100000067286_100009819871 [0,0,0,0,0,0|3,0,1]=4 94 B19R2.4993 OCc1ccc(cc1)CSc2cnc(c(c2)O)F 62a_100009819871_100000067286 [0,0,0,0,0,0|3,0,1]=4 95 B19R2.4993 OCc1ccc(cc1)CSc2ncc(c(n2)O)F 62a_100000067286_100011995740 [0,0,0,0,0,0|4,0,0]=4 96 B18R2.52 C#Cc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100000140223 [1,0,0,0,0,0|2,0,1]=4 97 B18R2.52 C=Cc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100000034074_100009820020 [1,0,0,0,0,0|2,0,1]=4 98 B18R2.52 C=Cc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100000034074 [1,0,0,0,0,0|2,0,1]=4 99 B18R2.52 C=Cc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100011218248_100011361533 [1,0,0,0,0,0|2,0,1]=4 100 B18R2.52 CCc1ccc(cc1)C=Cc2ccc(=O)[nH]n2 271570a_200000062238_100009820020 [1,0,0,0,0,0|1,0,2]=4 101 B18R2.52 CCc1ccc(cc1)COc2ccc(=O)[nH]c2 34a_100000075641_100000747183 [1,0,0,0,0,0|3,0,0]=4 102 B18R2.52 CCc1ccc(cc1)CSc2ccc(=O)[nH]c2 62a_100000212171_100000747183 [1,0,0,0,0,0|3,0,0]=4 103 B18R2.52 CCc1ccc(cc1)CSc2ccc(=O)[nH]c2 62a_100000757233_100000212171 [1,0,0,0,0,0|3,0,0]=4 104 B18R2.52 CCc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100000757233_100009820020 [1,0,0,0,0,0|2,0,0]=3 105 B18R2.52 CCc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100000747183 [1,0,0,0,0,0|2,0,0]=3 106 B18R2.52 CCc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100000211069_100011361533 [1,0,0,0,0,0|2,0,0]=3 107 B18R2.52 COc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100000742318 [1,0,0,0,0,0|3,0,0]=4 108 B18R2.52 COc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100000184247_100011361533 [1,0,0,0,0,0|3,0,0]=4 109 B18R2.52 CSc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100000181263_100009820020 [1,0,0,0,0,0|3,0,0]=4 110 B18R2.52 CSc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100000181263 [1,0,0,0,0,0|3,0,0]=4 111 B18R2.52 CSc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100000212337_100011361533 [1,0,0,0,0,0|3,0,0]=4 112 B18R2.52 Cc1ccc(nc1)CNc2ccc(cc2)CO 2230a_100011215238_100000691093 [1,0,0,0,0,0|3,0,0]=4 113 B18R2.52 Cc1ccc(nc1)CNc2ccc(cc2)CO 34a_100011215238_100000691093 [1,0,0,0,0,0|3,0,0]=4 114 B18R2.52 Cc1ccc(nc1)COc2ccc(cc2)CO 34a_100000211755_100000691093 [1,0,0,0,0,0|3,0,0]=4 115 B18R2.52 Cc1ccc(nc1)CSc2ccc(cc2)CO 62a_100000690907_100000691093 [1,0,0,0,0,0|3,0,0]=4 116 B18R2.52 Cc1ccc(nc1)CSc2ccc(cc2)CO 62a_100000691093_100000690907 [1,0,0,0,0,0|3,0,0]=4 117 B18R2.52 Cc1ccc(nc1)OCc2ccc(cc2)CO 34a_100000759353_100000067286 [1,0,0,0,0,0|3,0,0]=4 118 B18R2.52 Cc1ccc(nc1)SCc2ccc(cc2)CO 62a_100000067286_100000754016 [1,0,0,0,0,0|3,0,0]=4 119 B18R2.52 Cc1ccc(nc1)SCc2ccc(cc2)CO 62a_100011192072_100000067286 [1,0,0,0,0,0|3,0,0]=4 120 B18R2.52 Cc1ccc(nn1)NCc2ccc(cc2)CO 27a_100015189231_100000744512 [1,0,0,0,0,0|2,0,1]=4 121 B18R2.52 Cc1ccc(nn1)SCc2ccc(cc2)CO 62a_100000067286_100000744512 [1,0,0,0,0,0|2,0,1]=4 122 B18R2.52 Cc1ccc(nn1)SCc2ccc(cc2)CO 62a_100000744512_100000067286 [1,0,0,0,0,0|2,0,1]=4 123 B18R2.52 N#Cc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100000184898 [1,0,0,0,0,0|2,0,1]=4 124 B18R2.52 Nc1ccc(nc1)OCc2ccc(cc2)CO 34a_100000729260_100000067286 [1,0,0,0,0,0|3,0,0]=4 125 B18R2.52 Nc1ccc(nc1)SCc2ccc(cc2)CO 62a_100000067286_100000737798 [1,0,0,0,0,0|3,0,0]=4 126 B18R2.52 Nc1ccc(nc1)SCc2ccc(cc2)CO 62a_100000737798_100000067286 [1,0,0,0,0,0|3,0,0]=4 127 B18R2.52 Nc1ccc(nn1)SCc2ccc(cc2)CO 62a_100000067286_100010219413 [1,0,0,0,0,0|2,0,1]=4 128 B18R2.52 Nc1ccc(nn1)SCc2ccc(cc2)CO 62a_100010219413_100000067286 [1,0,0,0,0,0|2,0,1]=4 129 B18R2.52 O=Cc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009816848_100009820020 [1,0,0,0,0,0|1,0,2]=4 130 B18R2.52 O=Cc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100009816848 [1,0,0,0,0,0|1,0,2]=4 131 B18R2.52 O=c1ccc(c[nH]1)OCc2ccc(cc2)CO 34a_100000075641_100000067286 [1,0,0,0,0,0|2,0,0]=3 132 B18R2.52 O=c1ccc(c[nH]1)SCc2ccc(cc2)CO 62a_100000067286_100000212171 [1,0,0,0,0,0|2,0,0]=3 133 B18R2.52 O=c1ccc(c[nH]1)SCc2ccc(cc2)CO 62a_100000212171_100000067286 [1,0,0,0,0,0|2,0,0]=3 134 B18R2.52 O=c1ccc(n[nH]1)SCc2ccc(cc2)CO 62a_100000067286_100009820020 [1,0,0,0,0,0|1,0,0]=2 135 B18R2.52 O=c1ccc(n[nH]1)SCc2ccc(cc2)CO 62a_100009820020_100000067286 [1,0,0,0,0,0|1,0,0]=2 136 B18R2.52 O=c1ncc(c[nH]1)SCc2ccc(cc2)CO 62a_100000067286_102495366499 [1,0,0,0,0,0|3,0,0]=4 137 B18R2.52 O=c1ncc(c[nH]1)SCc2ccc(cc2)CO 62a_102495366499_100000067286 [1,0,0,0,0,0|3,0,0]=4 138 B18R2.52 OCc1ccc(cc1)CNc2ccc(cn2)Br 27a_100015189231_100000686858 [1,0,0,0,0,0|3,0,0]=4 139 B18R2.52 OCc1ccc(cc1)COc2ccc(cn2)Cl 34a_100011215309_100000067286 [1,0,0,0,0,0|3,0,0]=4 140 B18R2.52 OCc1ccc(cc1)COc2ccc(cn2)F 34a_100000742473_100000067286 [1,0,0,0,0,0|3,0,0]=4 141 B18R2.52 OCc1ccc(cc1)CSc2ccc(cn2)Br 62a_100000067286_100000686858 [1,0,0,0,0,0|3,0,0]=4 142 B18R2.52 OCc1ccc(cc1)CSc2ccc(cn2)Br 62a_100000686858_100000067286 [1,0,0,0,0,0|3,0,0]=4 143 B18R2.52 OCc1ccc(cc1)CSc2ccc(cn2)Cl 62a_100000067286_100011356976 [1,0,0,0,0,0|3,0,0]=4 144 B18R2.52 OCc1ccc(cc1)CSc2ccc(cn2)Cl 62a_100011356976_100000067286 [1,0,0,0,0,0|3,0,0]=4 145 B18R2.52 OCc1ccc(cc1)CSc2ccc(cn2)F 62a_100000067286_100000744514 [1,0,0,0,0,0|3,0,0]=4 146 B18R2.52 OCc1ccc(cc1)CSc2ccc(cn2)F 62a_100000744514_100000067286 [1,0,0,0,0,0|3,0,0]=4 147 B18R2.52 OCc1ccc(cc1)CSc2ccc(cn2)O 62a_100000067286_100000744096 [1,0,0,0,0,0|2,0,1]=4 148 B18R2.52 OCc1ccc(cc1)CSc2ccc(cn2)O 62a_100000685995_100000067286 [1,0,0,0,0,0|2,0,1]=4 149 B18R2.52 OCc1ccc(cc1)CSc2ccc(nn2)Cl 62a_100000067286_100000068654 [1,0,0,0,0,0|2,0,1]=4 150 B18R2.52 OCc1ccc(cc1)CSc2ccc(nn2)Cl 62a_100000068654_100000067286 [1,0,0,0,0,0|2,0,1]=4 151 B18R2.52 OCc1ccc(cc1)NCc2ccc(cn2)Br 2230a_100011215238_100000702658 [1,0,0,0,0,0|3,0,0]=4 152 B18R2.52 OCc1ccc(cc1)NCc2ccc(cn2)Br 270302a_100011215238_100000754260 [1,0,0,0,0,0|3,0,0]=4 153 B18R2.52 OCc1ccc(cc1)NCc2ccc(cn2)Br 34a_100011215238_100000702658 [1,0,0,0,0,0|3,0,0]=4 154 B18R2.52 OCc1ccc(cc1)NCc2ccc(cn2)Cl 2230a_100011215238_100012066911 [1,0,0,0,0,0|3,0,0]=4 155 B18R2.52 OCc1ccc(cc1)NCc2ccc(cn2)Cl 270302a_100011215238_100011361569 [1,0,0,0,0,0|3,0,0]=4 156 B18R2.52 OCc1ccc(cc1)NCc2ccc(cn2)Cl 34a_100011215238_100012066911 [1,0,0,0,0,0|3,0,0]=4 157 B18R2.52 OCc1ccc(cc1)NCc2ccc(cn2)F 2230a_100011215238_100000703193 [1,0,0,0,0,0|3,0,0]=4 158 B18R2.52 OCc1ccc(cc1)NCc2ccc(cn2)F 34a_100011215238_100000703193 [1,0,0,0,0,0|3,0,0]=4 159 B18R2.52 OCc1ccc(cc1)NCc2ccc(nn2)Cl 2230a_100011215238_100016992710 [1,0,0,0,0,0|2,0,1]=4 160 B18R2.52 OCc1ccc(cc1)NCc2ccc(nn2)Cl 34a_100011215238_100016992710 [1,0,0,0,0,0|2,0,1]=4 161 B18R2.52 OCc1ccc(cc1)OCc2ccc(cn2)Br 34a_100000211755_100000702658 [1,0,0,0,0,0|3,0,0]=4 162 B18R2.52 OCc1ccc(cc1)OCc2ccc(cn2)Cl 34a_100000211755_100012066911 [1,0,0,0,0,0|3,0,0]=4 163 B18R2.52 OCc1ccc(cc1)OCc2ccc(cn2)F 34a_100000211755_100000703193 [1,0,0,0,0,0|3,0,0]=4 164 B18R2.52 OCc1ccc(cc1)OCc2ccc(nn2)Cl 34a_100000211755_100016992710 [1,0,0,0,0,0|2,0,1]=4 165 B18R2.52 OCc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000690907_100000702658 [1,0,0,0,0,0|3,0,0]=4 166 B18R2.52 OCc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000702658_100000690907 [1,0,0,0,0,0|3,0,0]=4 167 B18R2.52 OCc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100000690907_100000697101 [1,0,0,0,0,0|3,0,0]=4 168 B18R2.52 OCc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100012066911_100000690907 [1,0,0,0,0,0|3,0,0]=4 169 B18R2.52 OCc1ccc(cc1)SCc2ccc(cn2)F 62a_100000690907_100000703193 [1,0,0,0,0,0|3,0,0]=4 170 B18R2.52 OCc1ccc(cc1)SCc2ccc(cn2)F 62a_100000703193_100000690907 [1,0,0,0,0,0|3,0,0]=4 171 B18R2.52 OCc1ccc(cc1)SCc2ccc(nn2)Cl 62a_100000690907_100016992710 [1,0,0,0,0,0|2,0,1]=4 172 B18R2.52 OCc1ccc(cc1)SCc2ccc(nn2)Cl 62a_100016992710_100000690907 [1,0,0,0,0,0|2,0,1]=4 173 B18R2.60 CCc1ccc(cc1)CSc2cc(ccn2)O 62a_100000757233_100000762945 [1,0,0,0,0,0|3,0,0]=4 174 B18R2.60 CCc1ccc(cc1)CSc2cc(cnn2)O 62a_100000757233_200010734679 [1,0,0,0,0,0|2,0,1]=4 175 B18R2.60 Cc1ccnc(c1)CNc2ccc(cc2)CO 2230a_100011215238_100000718516 [1,0,0,0,0,0|3,0,0]=4 176 B18R2.60 Cc1ccnc(c1)CNc2ccc(cc2)CO 34a_100011215238_100000718516 [1,0,0,0,0,0|3,0,0]=4 177 B18R2.60 Cc1ccnc(c1)COc2ccc(cc2)CO 34a_100000211755_100000718516 [1,0,0,0,0,0|3,0,0]=4 178 B18R2.60 Cc1ccnc(c1)CSc2ccc(cc2)CO 62a_100000690907_100000718516 [1,0,0,0,0,0|3,0,0]=4 179 B18R2.60 Cc1ccnc(c1)CSc2ccc(cc2)CO 62a_100000718516_100000690907 [1,0,0,0,0,0|3,0,0]=4 180 B18R2.60 Cc1ccnc(c1)SCc2ccc(cc2)CO 62a_100000067286_100000750283 [1,0,0,0,0,0|3,0,0]=4 181 B18R2.60 Cc1ccnc(c1)SCc2ccc(cc2)CO 62a_100000750283_100000067286 [1,0,0,0,0,0|3,0,0]=4 182 B18R2.60 Cc1cnnc(c1)NCc2ccc(cc2)CO 27a_100015189231_100000070100 [1,0,0,0,0,0|2,0,1]=4 183 B18R2.60 Cc1cnnc(c1)OCc2ccc(cc2)CO 34a_100000766097_100000067286 [1,0,0,0,0,0|2,0,1]=4 184 B18R2.60 Cc1cnnc(c1)SCc2ccc(cc2)CO 62a_100000067286_100000070100 [1,0,0,0,0,0|2,0,1]=4 185 B18R2.60 Cc1cnnc(c1)SCc2ccc(cc2)CO 62a_100000070100_100000067286 [1,0,0,0,0,0|2,0,1]=4 186 B18R2.60 Nc1ccnc(c1)SCc2ccc(cc2)CO 62a_100000067286_100009814236 [1,0,0,0,0,0|3,0,0]=4 187 B18R2.60 Nc1ccnc(c1)SCc2ccc(cc2)CO 62a_100009814236_100000067286 [1,0,0,0,0,0|3,0,0]=4 188 B18R2.60 Nc1cnnc(c1)SCc2ccc(cc2)CO 62a_100000067286_100011996757 [1,0,0,0,0,0|2,0,1]=4 189 B18R2.60 Nc1cnnc(c1)SCc2ccc(cc2)CO 62a_100011996757_100000067286 [1,0,0,0,0,0|2,0,1]=4 190 B18R2.60 OCc1ccc(cc1)CNc2cc(ccn2)F 27a_100015189231_100000764206 [1,0,0,0,0,0|3,0,0]=4 191 B18R2.60 OCc1ccc(cc1)CNc2cc(ncn2)O 27a_100015189231_100000765262 [1,0,0,0,0,0|3,0,0]=4 192 B18R2.60 OCc1ccc(cc1)CNc2cccc(c2)O 270302a_100000210217_100009832023 [1,0,0,0,0,0|3,0,0]=4 193 B18R2.60 OCc1ccc(cc1)CNc2cccc(c2)O 34a_100000210217_100000067286 [1,0,0,0,0,0|3,0,0]=4 194 B18R2.60 OCc1ccc(cc1)CNc2nccc(n2)O 27a_100015189231_100011649813 [1,0,0,0,0,0|3,0,0]=4 195 B18R2.60 OCc1ccc(cc1)CSc2cc(ccn2)Cl 62a_100000067286_100010167805 [1,0,0,0,0,0|3,0,0]=4 196 B18R2.60 OCc1ccc(cc1)CSc2cc(ccn2)Cl 62a_100010167805_100000067286 [1,0,0,0,0,0|3,0,0]=4 197 B18R2.60 OCc1ccc(cc1)CSc2cc(ccn2)F 62a_100000067286_100000764206 [1,0,0,0,0,0|3,0,0]=4 198 B18R2.60 OCc1ccc(cc1)CSc2cc(ccn2)F 62a_100000764206_100000067286 [1,0,0,0,0,0|3,0,0]=4 199 B18R2.60 OCc1ccc(cc1)CSc2cc(ccn2)O 62a_100000067286_100000762945 [1,0,0,0,0,0|2,0,0]=3 200 B18R2.60 OCc1ccc(cc1)CSc2cc(cnn2)O 62a_100000067286_200010734679 [1,0,0,0,0,0|1,0,1]=3 201 B18R2.60 OCc1ccc(cc1)CSc2cc(ncn2)O 62a_100000067286_100000765262 [1,0,0,0,0,0|3,0,0]=4 202 B18R2.60 OCc1ccc(cc1)CSc2cccc(c2)O 62a_100000067286_100000211634 [1,0,0,0,0,0|3,0,0]=4 203 B18R2.60 OCc1ccc(cc1)CSc2cncc(c2)O 62a_100000067286_100000754920 [1,0,0,0,0,0|2,0,1]=4 204 B18R2.60 OCc1ccc(cc1)CSc2cncc(c2)O 62a_100000754920_100000067286 [1,0,0,0,0,0|2,0,1]=4 205 B18R2.60 OCc1ccc(cc1)CSc2nccc(n2)O 62a_100000067286_100011649813 [1,0,0,0,0,0|3,0,0]=4 206 B18R2.60 OCc1ccc(cc1)NCc2cc(ccn2)Br 2230a_100011215238_100010173614 [1,0,0,0,0,0|3,0,0]=4 207 B18R2.60 OCc1ccc(cc1)NCc2cc(ccn2)Br 34a_100011215238_100010173614 [1,0,0,0,0,0|3,0,0]=4 208 B18R2.60 OCc1ccc(cc1)NCc2cc(ccn2)Cl 2230a_100011215238_100016988179 [1,0,0,0,0,0|3,0,0]=4 209 B18R2.60 OCc1ccc(cc1)NCc2cc(ccn2)Cl 34a_100011215238_100016988179 [1,0,0,0,0,0|3,0,0]=4 210 B18R2.60 OCc1ccc(cc1)NCc2cccc(c2)O 2230a_100011215238_100011660834 [1,0,0,0,0,0|3,0,0]=4 211 B18R2.60 OCc1ccc(cc1)NCc2cccc(c2)O 34a_100011215238_100011660834 [1,0,0,0,0,0|3,0,0]=4 212 B18R2.60 OCc1ccc(cc1)OCc2cc(ccn2)Br 34a_100000211755_100010173614 [1,0,0,0,0,0|3,0,0]=4 213 B18R2.60 OCc1ccc(cc1)OCc2cc(ccn2)Cl 34a_100000211755_100016988179 [1,0,0,0,0,0|3,0,0]=4 214 B18R2.60 OCc1ccc(cc1)OCc2cccc(c2)O 34a_100000211755_100011660834 [1,0,0,0,0,0|3,0,0]=4 215 B18R2.60 OCc1ccc(cc1)SCc2cc(ccn2)Br 62a_100000690907_100010173614 [1,0,0,0,0,0|3,0,0]=4 216 B18R2.60 OCc1ccc(cc1)SCc2cc(ccn2)Br 62a_100010173614_100000690907 [1,0,0,0,0,0|3,0,0]=4 217 B18R2.60 OCc1ccc(cc1)SCc2cc(ccn2)Cl 62a_100000690907_100016988179 [1,0,0,0,0,0|3,0,0]=4 218 B18R2.60 OCc1ccc(cc1)SCc2cc(ccn2)Cl 62a_100016988179_100000690907 [1,0,0,0,0,0|3,0,0]=4 219 B18R2.60 OCc1ccc(cc1)SCc2cccc(c2)O 62a_100000690907_100011660834 [1,0,0,0,0,0|3,0,0]=4 220 B18R2.60 OCc1ccc(cc1)SCc2cccc(c2)O 62a_100011660834_100000690907 [1,0,0,0,0,0|3,0,0]=4 221 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)Br 62a_100000189115_100012187101 [1,0,0,0,0,0|3,0,0]=4 222 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)Cl 62a_100000187161_100012187101 [1,0,0,0,0,0|3,0,0]=4 223 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)F 62a_100000198546_100012187101 [1,0,0,0,0,0|3,0,0]=4 224 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)I 62a_100000189116_100012187101 [1,0,0,0,0,0|3,0,0]=4 225 B18R2.9259 Cc1ccc(cc1)C=Cc2c[nH]c(=O)c(c2)O 271570a_100102527916_100009814561 [1,0,0,0,0,0|1,0,2]=4 226 B18R2.9259 Cc1ccc(cc1)C=Cc2cc(c(=O)[nH]n2)C 271570a_100102527916_100012187101 [1,0,0,0,0,0|1,0,2]=4 227 B18R2.9259 Cc1ccc(cc1)C=Cc2cc(c(=O)[nH]n2)N 271570a_100102527916_100000102183 [1,0,0,0,0,0|1,0,2]=4 228 B18R2.9259 Cc1ccc(cc1)CSc2c[nH]c(=O)c(c2)Br 62a_100000210814_100010125443 [1,0,0,0,0,0|3,0,0]=4 229 B18R2.9259 Cc1ccc(cc1)CSc2c[nH]c(=O)c(c2)Br 62a_100010125443_100000210814 [1,0,0,0,0,0|3,0,0]=4 230 B18R2.9259 Cc1ccc(cc1)CSc2c[nH]c(=O)c(c2)F 62a_100000210814_100000723523 [1,0,0,0,0,0|3,0,0]=4 231 B18R2.9259 Cc1ccc(cc1)CSc2c[nH]c(=O)c(c2)F 62a_100000723523_100000210814 [1,0,0,0,0,0|3,0,0]=4 232 B18R2.9259 Cc1ccc(cc1)CSc2c[nH]c(=O)c(c2)O 62a_100000210814_100009814561 [1,0,0,0,0,0|2,0,0]=3 233 B18R2.9259 Cc1ccc(cc1)CSc2cc(c(=O)[nH]n2)C 62a_100000210814_100012187101 [1,0,0,0,0,0|2,0,0]=3 234 B18R2.9259 Cc1ccc(cc1)CSc2cc(c(=O)[nH]n2)N 62a_100000210814_100000102183 [1,0,0,0,0,0|2,0,0]=3 235 B18R2.9259 Cc1ccc(cc1)CSc2cc(c(cn2)C)O 62a_100000210814_100000704368 [1,0,0,0,0,0|3,0,0]=4 236 B18R2.9259 Cc1ccc(cc1)CSc2cc(c(cn2)C)O 62a_100000704368_100000210814 [1,0,0,0,0,0|3,0,0]=4 237 B18R2.9259 Cc1ccc(cc1)CSc2cc(c(cn2)F)O 62a_100000210814_100009854642 [1,0,0,0,0,0|3,0,0]=4 238 B18R2.9259 Cc1ccc(cc1)CSc2cc(c(cn2)F)O 62a_100009854642_100000210814 [1,0,0,0,0,0|3,0,0]=4 239 B18R2.9259 Cc1ccc(cc1)NCc2c[nH]c(=O)c(c2)Cl 207a_100000124888_100000051075 [1,0,0,0,0,0|3,0,0]=4 240 B18R2.9259 Cc1ccc(cc1)NCc2c[nH]c(=O)c(c2)Cl 270302a_100000124888_100000051075 [1,0,0,0,0,0|3,0,0]=4 241 B18R2.9259 Cc1ccc(cn1)CSc2c[nH]c(=O)c(c2)O 62a_100016987292_100009814561 [1,0,0,0,0,0|3,0,0]=4 242 B18R2.9259 Cc1ccc(cn1)CSc2cc(c(=O)[nH]n2)C 62a_100016987292_100012187101 [1,0,0,0,0,0|3,0,0]=4 243 B18R2.9259 Cc1ccc(cn1)CSc2cc(c(=O)[nH]n2)N 62a_100016987292_100000102183 [1,0,0,0,0,0|3,0,0]=4 244 B18R2.9259 Cc1ccc(nc1)CSc2c[nH]c(=O)c(c2)O 62a_100000691093_100009814561 [1,0,0,0,0,0|3,0,0]=4 245 B18R2.9259 Cc1ccc(nc1)CSc2cc(c(=O)[nH]n2)C 62a_100000691093_100012187101 [1,0,0,0,0,0|3,0,0]=4 246 B18R2.9259 Cc1ccc(nc1)CSc2cc(c(=O)[nH]n2)N 62a_100000691093_100000102183 [1,0,0,0,0,0|3,0,0]=4 247 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)Br 62a_100000189115_100000102183 [1,0,0,0,0,0|3,0,0]=4 248 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)Cl 62a_100000187161_100000102183 [1,0,0,0,0,0|3,0,0]=4 249 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)F 62a_100000198546_100000102183 [1,0,0,0,0,0|3,0,0]=4 250 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)I 62a_100000189116_100000102183 [1,0,0,0,0,0|3,0,0]=4 251 B18R2.9259 O=c1[nH]cc(cc1Cl)CNc2ccc(cc2)O 270302a_100000185829_100000051075 [1,0,0,0,0,0|3,0,0]=4 252 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)Br 62a_100000189115_100009814561 [1,0,0,0,0,0|3,0,0]=4 253 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)Cl 62a_100000187161_100009814561 [1,0,0,0,0,0|3,0,0]=4 254 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)F 62a_100000198546_100009814561 [1,0,0,0,0,0|3,0,0]=4 255 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)I 62a_100000189116_100009814561 [1,0,0,0,0,0|3,0,0]=4 256 B20R2.5589 Cc1c(c[nH]c(=O)c1N)SCc2ccc(cc2)CO 62a_100000067286_100010163742 [0,1,0,0,0,0|3,0,0]=4 257 B20R2.5589 Cc1c(c[nH]c(=O)c1N)SCc2ccc(cc2)CO 62a_100010163742_100000067286 [0,1,0,0,0,0|3,0,0]=4 258 B20R2.5590 COc1cnc(cc1O)SCc2ccc(cc2)CO 62a_100000067286_100010264082 [0,1,0,0,0,0|2,0,1]=4 259 B20R2.5590 Cc1cc(ncc1C=O)SCc2ccc(cc2)CO 62a_100000067286_100000085382 [0,1,0,0,0,0|3,0,0]=4 260 B20R2.5590 Cc1cc(ncc1C=O)SCc2ccc(cc2)CO 62a_100000085382_100000067286 [0,1,0,0,0,0|3,0,0]=4 261 B20R2.5590 Nc1cc(ncc1C=O)SCc2ccc(cc2)CO 62a_100000050503_100000067286 [0,1,0,0,0,0|3,0,0]=4 262 B20R2.5590 Nc1cc(ncc1C=O)SCc2ccc(cc2)CO 62a_100000067286_100000050503 [0,1,0,0,0,0|3,0,0]=4 263 B20R2.5590 O=Cc1ccc(cc1O)SCc2ccc(cc2)CO 62a_100000067286_100011277552 [0,1,0,0,0,0|3,0,0]=4 264 B20R2.5590 O=Cc1ccc(cc1O)SCc2ccc(cc2)CO 62a_100011277552_100000067286 [0,1,0,0,0,0|3,0,0]=4 265 B20R2.5591 CCc1ccc(cc1)CSc2c[nH]c(=O)c(c2)OC 62a_100000757233_100010125397 [0,1,0,0,0,0|3,0,0]=4 266 B20R2.5591 COc1cc(c[nH]c1=O)SCc2ccc(cc2)CO 62a_100000067286_100010125397 [0,1,0,0,0,0|2,0,0]=3 267 B20R2.5591 COc1cc(ncc1C)SCc2ccc(cc2)CO 62a_100000067286_100010067687 [0,1,0,0,0,0|3,0,0]=4 268 B20R2.5591 COc1cc(ncc1C)SCc2ccc(cc2)CO 62a_100010067687_100000067286 [0,1,0,0,0,0|3,0,0]=4 269 B20R2.5591 COc1cc(ncc1F)SCc2ccc(cc2)CO 62a_100000067286_200010136270 [0,1,0,0,0,0|3,0,0]=4 270 B20R2.5591 COc1cc(ncc1F)SCc2ccc(cc2)CO 62a_200010136270_100000067286 [0,1,0,0,0,0|3,0,0]=4 271 B20R2.5591 COc1cc(ncc1N)SCc2ccc(cc2)CO 62a_100000067286_100009887741 [0,1,0,0,0,0|3,0,0]=4 272 B20R2.5591 COc1cc(ncc1N)SCc2ccc(cc2)CO 62a_100009887741_100000067286 [0,1,0,0,0,0|3,0,0]=4 273 B20R2.5591 COc1cc(nnc1N)SCc2ccc(cc2)CO 62a_100000067286_100000688033 [0,1,0,0,0,0|2,0,1]=4 274 B20R2.5591 COc1cc(nnc1N)SCc2ccc(cc2)CO 62a_100000688033_100000067286 [0,1,0,0,0,0|2,0,1]=4 275 B20R2.5591 OCc1ccc(cc1)CSc2cc(c(cn2)F)CO 62a_100000067286_100000081974 [0,1,0,0,0,0|3,0,0]=4 276 B20R2.5591 OCc1ccc(cc1)CSc2cc(c(cn2)F)CO 62a_100000081974_100000067286 [0,1,0,0,0,0|3,0,0]=4 277 B20R2.15384 CC(C)c1ccc(cc1)CSc2c[nH]c(=O)c(c2)O 62a_100000181262_100009814561 [0,1,0,0,0,0|3,0,0]=4 278 B20R2.15384 CC(C)c1ccc(cc1)CSc2cc(c(=O)[nH]n2)N 62a_100000181262_100000102183 [0,1,0,0,0,0|3,0,0]=4 279 B20R2.15384 CC(O)c1ccc(cc1)NCc2c[nH]c(=O)c(c2)Cl 207a_100011216399_100000051075 [0,1,0,0,0,0|3,0,0]=4 280 B20R2.15384 CC(O)c1ccc(cc1)NCc2c[nH]c(=O)c(c2)Cl 270302a_100011216399_100000051075 [0,1,0,0,0,0|3,0,0]=4 281 B20R2.15384 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)B(O)O 62a_100009813762_100012187101 [0,1,0,0,0,0|3,0,0]=4 282 B20R2.15384 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)C(C)C 62a_100000181262_100012187101 [0,1,0,0,0,0|3,0,0]=4 283 B20R2.15384 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)C(F)F 62a_200012343607_100012187101 [0,1,0,0,0,0|3,0,0]=4 284 B20R2.15384 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)B(O)O 62a_100009813762_100000102183 [0,1,0,0,0,0|3,0,0]=4 285 B20R2.15384 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)C(F)F 62a_200012343607_100000102183 [0,1,0,0,0,0|3,0,0]=4 286 B20R2.15384 O=c1[nH]cc(cc1O)SCc2ccc(cc2)B(O)O 62a_100009813762_100009814561 [0,1,0,0,0,0|3,0,0]=4 287 B20R2.15384 O=c1[nH]cc(cc1O)SCc2ccc(cc2)C(F)F 62a_200012343607_100009814561 [0,1,0,0,0,0|3,0,0]=4 288 B20R2.44752 Cc1cc(ccc1NCc2c[nH]c(=O)c(c2)Cl)CO 207a_200011997030_100000051075 [0,1,0,0,0,0|3,0,0]=4 289 B20R2.44752 Cc1cc(ccc1NCc2c[nH]c(=O)c(c2)Cl)CO 270302a_200011997030_100000051075 [0,1,0,0,0,0|3,0,0]=4 290 B20R2.44752 O=c1[nH]cc(cc1Cl)CNc2ccc(cc2F)CO 207a_100011217239_100000051075 [0,1,0,0,0,0|3,0,0]=4 291 B20R2.44752 O=c1[nH]cc(cc1Cl)CNc2ccc(cc2F)CO 270302a_100011217239_100000051075 [0,1,0,0,0,0|3,0,0]=4 292 B20R2.70668 CCCc1ccc(cc1)CSc2c[nH]c(=O)c(c2)O 62a_100011982809_100009814561 [0,1,0,0,0,0|3,0,0]=4 293 B20R2.70668 CCCc1ccc(cc1)CSc2cc(c(=O)[nH]n2)C 62a_100011982809_100012187101 [0,1,0,0,0,0|3,0,0]=4 294 B20R2.70668 CCCc1ccc(cc1)CSc2cc(c(=O)[nH]n2)N 62a_100011982809_100000102183 [0,1,0,0,0,0|3,0,0]=4 295 B20R2.70668 COCc1ccc(cc1)NCc2c[nH]c(=O)c(c2)Cl 207a_100000694113_100000051075 [0,1,0,0,0,0|3,0,0]=4 296 B20R2.70668 COCc1ccc(cc1)NCc2c[nH]c(=O)c(c2)Cl 270302a_100000694113_100000051075 [0,1,0,0,0,0|3,0,0]=4 297 B20R2.70668 O=c1[nH]cc(cc1Cl)CNc2ccc(cc2)CCO 207a_100011204434_100000051075 [0,1,0,0,0,0|3,0,0]=4 298 B20R2.70668 O=c1[nH]cc(cc1Cl)CNc2ccc(cc2)CCO 270302a_100011204434_100000051075 [0,1,0,0,0,0|3,0,0]=4 299 B20R2.84836 Cc1[nH]c(=O)c(cc1SCc2ccc(cc2)CO)N 62a_100000067286_100010126670 [0,1,0,0,0,0|3,0,0]=4 300 B20R2.84836 Cc1[nH]c(=O)c(cc1SCc2ccc(cc2)CO)N 62a_100010126670_100000067286 [0,1,0,0,0,0|3,0,0]=4 301 B20R2.85733 CCc1ccc(cc1)CSc2cc(c(=O)n(n2)C)C 62a_100000757233_100010988966 [0,1,0,0,0,0|3,0,0]=4 302 B20R2.85733 CCc1ccc(cc1)CSc2cc(c(=O)n(n2)C)C 62a_100010988966_100000747183 [0,1,0,0,0,0|3,0,0]=4 303 B20R2.85733 Cc1cc(cn(c1=O)C)SCc2ccc(cc2)CO 62a_100000067286_100011830242 [0,1,0,0,0,0|3,0,0]=4 304 B20R2.85733 Cc1cc(cn(c1=O)C)SCc2ccc(cc2)CO 62a_100011830242_100000067286 [0,1,0,0,0,0|3,0,0]=4 305 B20R2.85733 Cc1cc(nn(c1=O)C)SCc2ccc(cc2)CO 62a_100000067286_100010988966 [0,1,0,0,0,0|2,0,0]=3 306 B20R2.85733 Cc1cc(nn(c1=O)C)SCc2ccc(cc2)CO 62a_100010988966_100000067286 [0,1,0,0,0,0|2,0,0]=3 307 B20R2.85733 Cn1cc(cc(c1=O)F)SCc2ccc(cc2)CO 62a_100000067286_100010749421 [0,1,0,0,0,0|3,0,0]=4 308 B20R2.85733 Cn1cc(cc(c1=O)F)SCc2ccc(cc2)CO 62a_100010749421_100000067286 [0,1,0,0,0,0|3,0,0]=4 309 B20R2.85733 Cn1cc(cc(c1=O)N)SCc2ccc(cc2)CO 62a_100000067286_106446545582 [0,1,0,0,0,0|3,0,0]=4 310 B20R2.85733 Cn1cc(cc(c1=O)N)SCc2ccc(cc2)CO 62a_106446545582_100000067286 [0,1,0,0,0,0|3,0,0]=4 311 B20R2.2387065 Cc1cc(ccc1CO)NCc2c[nH]c(=O)c(c2)Cl 207a_100000102464_100000051075 [0,1,0,0,0,0|3,0,0]=4 312 B20R2.2387065 Cc1cc(ccc1CO)NCc2c[nH]c(=O)c(c2)Cl 270302a_100000102464_100000051075 [0,1,0,0,0,0|3,0,0]=4 313 B20R2.2387065 O=c1[nH]cc(cc1Cl)CNc2ccc(c(c2)Cl)CO 207a_100000689119_100000051075 [0,1,0,0,0,0|3,0,0]=4 314 B20R2.2387065 O=c1[nH]cc(cc1Cl)CNc2ccc(c(c2)Cl)CO 270302a_100000689119_100000051075 [0,1,0,0,0,0|3,0,0]=4 315 B18R2.4270 CCc1ccc(cc1)Sc2c[nH]c(=O)c(c2)O 62a_100011215824_100009814561 [0,0,0,0,1,0|3,0,0]=4 316 B18R2.4270 CCc1ccc(cc1)Sc2cc(c(=O)[nH]n2)C 62a_100011215824_100012187101 [0,0,0,0,1,0|3,0,0]=4 317 B18R2.4270 CCc1ccc(cc1)Sc2cc(c(=O)[nH]n2)N 62a_100011215824_100000102183 [0,0,0,0,1,0|3,0,0]=4 318 B18R2.4270 Cc1cc(n[nH]c1=O)Sc2ccc(cc2)CF 62a_100010268989_100012187101 [0,0,0,0,1,0|3,0,0]=4 319 B18R2.4270 Cc1cc(n[nH]c1=O)Sc2ccc(cc2)CN 62a_100016989417_100012187101 [0,0,0,0,1,0|3,0,0]=4 320 B18R2.4270 Cc1cc(n[nH]c1=O)Sc2ccc(cc2)CO 62a_100000690907_100012187101 [0,0,0,0,1,0|2,0,0]=3 321 B18R2.4270 Cc1cc(n[nH]c1=O)Sc2ccc(cn2)CO 62a_100009816760_100012187101 [0,0,0,0,1,0|3,0,0]=4 322 B18R2.4270 Cc1cc(n[nH]c1=O)Sc2ccc(nc2)CO 62a_100000754261_100012187101 [0,0,0,0,1,0|3,0,0]=4 323 B18R2.4270 Cc1cnc(cc1O)Sc2ccc(cc2)CO 62a_100000690907_100000704368 [0,0,0,0,1,0|3,0,0]=4 324 B18R2.4270 Cc1cnc(cc1O)Sc2ccc(cc2)CO 62a_100000704368_100000690907 [0,0,0,0,1,0|3,0,0]=4 325 B18R2.4270 NCc1ccc(cc1)Sc2c[nH]c(=O)c(c2)O 62a_100016989417_100009814561 [0,0,0,0,1,0|3,0,0]=4 326 B18R2.4270 NCc1ccc(cc1)Sc2cc(c(=O)[nH]n2)N 62a_100016989417_100000102183 [0,0,0,0,1,0|3,0,0]=4 327 B18R2.4270 Nc1cc(n[nH]c1=O)Sc2ccc(cc2)CF 62a_100010268989_100000102183 [0,0,0,0,1,0|3,0,0]=4 328 B18R2.4270 Nc1cc(n[nH]c1=O)Sc2ccc(cc2)CO 62a_100000690907_100000102183 [0,0,0,0,1,0|2,0,0]=3 329 B18R2.4270 Nc1cc(n[nH]c1=O)Sc2ccc(cn2)CO 62a_100009816760_100000102183 [0,0,0,0,1,0|3,0,0]=4 330 B18R2.4270 Nc1cc(n[nH]c1=O)Sc2ccc(nc2)CO 62a_100000754261_100000102183 [0,0,0,0,1,0|3,0,0]=4 331 B18R2.4270 O=c1[nH]cc(cc1Br)Sc2ccc(cc2)CO 62a_100000690907_100010125443 [0,0,0,0,1,0|3,0,0]=4 332 B18R2.4270 O=c1[nH]cc(cc1Br)Sc2ccc(cc2)CO 62a_100010125443_100000690907 [0,0,0,0,1,0|3,0,0]=4 333 B18R2.4270 O=c1[nH]cc(cc1F)Sc2ccc(cc2)CO 62a_100000690907_100000723523 [0,0,0,0,1,0|3,0,0]=4 334 B18R2.4270 O=c1[nH]cc(cc1F)Sc2ccc(cc2)CO 62a_100000723523_100000690907 [0,0,0,0,1,0|3,0,0]=4 335 B18R2.4270 O=c1[nH]cc(cc1O)Sc2ccc(cc2)CF 62a_100010268989_100009814561 [0,0,0,0,1,0|3,0,0]=4 336 B18R2.4270 O=c1[nH]cc(cc1O)Sc2ccc(cc2)CO 62a_100000690907_100009814561 [0,0,0,0,1,0|2,0,0]=3 337 B18R2.4270 O=c1[nH]cc(cc1O)Sc2ccc(cn2)CO 62a_100009816760_100009814561 [0,0,0,0,1,0|3,0,0]=4 338 B18R2.4270 O=c1[nH]cc(cc1O)Sc2ccc(nc2)CO 62a_100000754261_100009814561 [0,0,0,0,1,0|3,0,0]=4 339 B18R2.4270 OCc1ccc(cc1)Sc2cc(c(cn2)F)O 62a_100000690907_100009854642 [0,0,0,0,1,0|3,0,0]=4 340 B18R2.4270 OCc1ccc(cc1)Sc2cc(c(cn2)F)O 62a_100009854642_100000690907 [0,0,0,0,1,0|3,0,0]=4 341 B18R2.4322 Cc1[nH]nc(c1C)SCc2ccc(cc2)CO 62a_100000067286_100015309786 [0,0,0,0,1,0|3,0,0]=4 342 B18R2.4322 Cc1[nH]nc(c1C)SCc2ccc(cc2)CO 62a_100015309786_100000067286 [0,0,0,0,1,0|3,0,0]=4 343 B18R2.4322 Cn1c(n[nH]c1=O)CSc2ccc(cc2)CO 62a_100000690907_100010408635 [0,0,0,0,1,0|3,0,0]=4 344 B18R2.4322 Cn1c(n[nH]c1=O)CSc2ccc(cc2)CO 62a_100010408635_100000690907 [0,0,0,0,1,0|3,0,0]=4 345 B20R2.5532 C=Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)O 62a_100000142037_100009814561 [0,0,0,0,0,1|2,0,1]=4 346 B20R2.5532 C=Cc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)C 62a_100000142037_100012187101 [0,0,0,0,0,1|2,0,1]=4 347 B20R2.5532 C=Cc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)N 62a_100000142037_100000102183 [0,0,0,0,0,1|2,0,1]=4 348 B20R2.5532 CCc1ccc(cc1)CNCc2c[nH]c(=O)c(c2)Cl 207a_100000721222_100000051075 [0,0,0,0,0,1|3,0,0]=4 349 B20R2.5532 CCc1ccc(cc1)CNCc2c[nH]c(=O)c(c2)Cl 270004a_100000721222_100000051075 [0,0,0,0,0,1|3,0,0]=4 350 B20R2.5532 COc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)O 62a_100011713689_100009814561 [0,0,0,0,0,1|3,0,0]=4 351 B20R2.5532 COc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)C 62a_100011713689_100012187101 [0,0,0,0,0,1|3,0,0]=4 352 B20R2.5532 COc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)N 62a_100011713689_100000102183 [0,0,0,0,0,1|3,0,0]=4 353 B20R2.5532 Cc1cc(ncc1Br)CNCc2ccc(cc2)CO 207a_100015189231_100009814806 [0,0,0,0,0,1|3,0,0]=4 354 B20R2.5532 Cc1cc(ncc1Br)CNCc2ccc(cc2)CO 270004a_100015189231_100009814806 [0,0,0,0,0,1|3,0,0]=4 355 B20R2.5532 Cc1cc(ncc1Br)COCc2ccc(cc2)CO 34a_200010713146_100000067286 [0,0,0,0,0,1|3,0,0]=4 356 B20R2.5532 Cc1cnc(cc1Br)CNCc2ccc(cc2)CO 207a_100015189231_100010174032 [0,0,0,0,0,1|3,0,0]=4 357 B20R2.5532 Cc1cnc(cc1Br)CNCc2ccc(cc2)CO 270004a_100015189231_100010174032 [0,0,0,0,0,1|3,0,0]=4 358 B20R2.5532 Cc1cnc(cc1Br)COCc2ccc(cc2)CO 34a_100010113723_100000067286 [0,0,0,0,0,1|3,0,0]=4 359 B20R2.5532 Cc1cnc(cc1Br)COCc2ccc(cc2)CO 7a_100010113723_100000067286 [0,0,0,0,0,1|3,0,0]=4 360 B20R2.5532 Cc1cnc(cc1Cl)COCc2ccc(cc2)CO 34a_200000144627_100000067286 [0,0,0,0,0,1|3,0,0]=4 361 B20R2.5532 Cc1cnc(cc1Cl)COCc2ccc(cc2)CO 7a_200000144627_100000067286 [0,0,0,0,0,1|3,0,0]=4 362 B20R2.5532 O=c1[nH]cc(cc1Cl)CNCc2ccc(cc2)CO 207a_100015189231_100000051075 [0,0,0,0,0,1|2,0,0]=3 363 B20R2.5532 O=c1[nH]cc(cc1Cl)CNCc2ccc(cc2)CO 270004a_100015189231_100000051075 [0,0,0,0,0,1|2,0,0]=3 364 B20R2.5532 OCc1ccc(cc1)CNCc2ccc(c(c2)O)Cl 34a_100020636435_100000067286 [0,0,0,0,0,1|3,0,0]=4 365 B20R2.5532 OCc1ccc(cc1)CNCc2ccc(c(c2)O)F 207a_100160469508_100009832023 [0,0,0,0,0,1|3,0,0]=4 366 B20R2.5532 OCc1ccc(cc1)CNCc2ccc(c(c2)O)F 270004a_100160469508_100009832023 [0,0,0,0,0,1|3,0,0]=4 367 B20R2.5532 OCc1ccc(cc1)CNCc2ccc(c(c2)O)F 34a_100160469508_100000067286 [0,0,0,0,0,1|3,0,0]=4 368 B20R2.5532 OCc1ccc(cc1)CNCc2ccc(c(c2)O)O 34a_100000010075_100000067286 [0,0,0,0,0,1|2,0,1]=4 369 B20R2.5532 OCc1ccc(cc1)SCCc2ccc(c(c2)O)O 62a_100000690907_200010393615 [0,0,0,0,0,1|2,0,1]=4 370 B17R1.1144 NC(=O)C(=O)NN=CCCc1ccc(cc1)O 4a_100000211141_200011361653 [1,0,1,0,0,0|1,0,1]=4 371 B17R2.48 OCc1ccc(cc1)CNc2cccnn2 27a_100015189231_100016991348 [2,0,0,0,0,0|1,0,1]=4 372 B17R2.48 OCc1ccc(cc1)CSc2ccccn2 62a_100000067286_100011216584 [2,0,0,0,0,0|2,0,0]=4 373 B17R2.48 OCc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000067286 [2,0,0,0,0,0|2,0,0]=4 374 B17R2.48 OCc1ccc(cc1)CSc2cccnn2 62a_100000067286_100016991348 [2,0,0,0,0,0|1,0,1]=4 375 B17R2.48 OCc1ccc(cc1)CSc2cccnn2 62a_100016991348_100000067286 [2,0,0,0,0,0|1,0,1]=4 376 B17R2.48 OCc1ccc(cc1)NCc2ccccn2 2230a_100011215238_100000721315 [2,0,0,0,0,0|2,0,0]=4 377 B17R2.48 OCc1ccc(cc1)NCc2ccccn2 270302a_100011215238_100000209966 [2,0,0,0,0,0|2,0,0]=4 378 B17R2.48 OCc1ccc(cc1)NCc2ccccn2 34a_100011215238_100000721315 [2,0,0,0,0,0|2,0,0]=4 379 B17R2.48 OCc1ccc(cc1)NCc2cccnn2 2230a_100011215238_100016990269 [2,0,0,0,0,0|1,0,1]=4 380 B17R2.48 OCc1ccc(cc1)NCc2cccnn2 34a_100011215238_100016990269 [2,0,0,0,0,0|1,0,1]=4 381 B17R2.48 OCc1ccc(cc1)OCc2ccccn2 34a_100000211755_100000721315 [2,0,0,0,0,0|2,0,0]=4 382 B17R2.48 OCc1ccc(cc1)OCc2cccnn2 34a_100000211755_100016990269 [2,0,0,0,0,0|1,0,1]=4 383 B17R2.48 OCc1ccc(cc1)SCc2ccccn2 62a_100000690907_100000721315 [2,0,0,0,0,0|2,0,0]=4 384 B17R2.48 OCc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000690907 [2,0,0,0,0,0|2,0,0]=4 385 B17R2.48 OCc1ccc(cc1)SCc2cccnn2 62a_100000690907_100016990269 [2,0,0,0,0,0|1,0,1]=4 386 B17R2.48 OCc1ccc(cc1)SCc2cccnn2 62a_100016990269_100000690907 [2,0,0,0,0,0|1,0,1]=4 387 B17R2.207 Cc1ccc(cc1)C=Cc2ccc(=O)[nH]n2 271570a_100102527916_100009820020 [2,0,0,0,0,0|0,0,2]=4 388 B17R2.207 Cc1ccc(cc1)COc2ccc(=O)[nH]c2 34a_100000075641_100000210814 [2,0,0,0,0,0|2,0,0]=4 389 B17R2.207 Cc1ccc(cc1)CSc2ccc(=O)[nH]c2 62a_100000210814_100000212171 [2,0,0,0,0,0|2,0,0]=4 390 B17R2.207 Cc1ccc(cc1)CSc2ccc(=O)[nH]c2 62a_100000212171_100000210814 [2,0,0,0,0,0|2,0,0]=4 391 B17R2.207 Cc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100000210814_100009820020 [2,0,0,0,0,0|1,0,0]=3 392 B17R2.207 Cc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100000210814 [2,0,0,0,0,0|1,0,0]=3 393 B17R2.207 Cc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100000124888_100011361533 [2,0,0,0,0,0|1,0,0]=3 394 B17R2.207 Cc1ccc(cn1)CSc2ccc(=O)[nH]n2 62a_100009820020_100016987292 [2,0,0,0,0,0|2,0,0]=4 395 B17R2.207 Cc1ccc(cn1)CSc2ccc(=O)[nH]n2 62a_100016987292_100009820020 [2,0,0,0,0,0|2,0,0]=4 396 B17R2.207 Cc1ccc(nc1)CSc2ccc(=O)[nH]n2 62a_100000691093_100009820020 [2,0,0,0,0,0|2,0,0]=4 397 B17R2.207 Cc1ccc(nc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100000691093 [2,0,0,0,0,0|2,0,0]=4 398 B17R2.207 O=c1ccc(n[nH]1)CNc2ccc(cc2)Br 207a_100000210018_100011361533 [2,0,0,0,0,0|2,0,0]=4 399 B17R2.207 O=c1ccc(n[nH]1)CNc2ccc(cc2)Cl 207a_100000210052_100011361533 [2,0,0,0,0,0|2,0,0]=4 400 B17R2.207 O=c1ccc(n[nH]1)CNc2ccc(cc2)F 207a_100000185862_100011361533 [2,0,0,0,0,0|2,0,0]=4 401 B17R2.207 O=c1ccc(n[nH]1)CNc2ccc(cc2)I 207a_100000185761_100011361533 [2,0,0,0,0,0|2,0,0]=4 402 B17R2.207 O=c1ccc(n[nH]1)SCc2ccc(cc2)Br 62a_100000189115_100009820020 [2,0,0,0,0,0|2,0,0]=4 403 B17R2.207 O=c1ccc(n[nH]1)SCc2ccc(cc2)Br 62a_100009820020_100000189115 [2,0,0,0,0,0|2,0,0]=4 404 B17R2.207 O=c1ccc(n[nH]1)SCc2ccc(cc2)Cl 62a_100000187161_100009820020 [2,0,0,0,0,0|2,0,0]=4 405 B17R2.207 O=c1ccc(n[nH]1)SCc2ccc(cc2)Cl 62a_100009820020_100000187161 [2,0,0,0,0,0|2,0,0]=4 406 B17R2.207 O=c1ccc(n[nH]1)SCc2ccc(cc2)F 62a_100000198546_100009820020 [2,0,0,0,0,0|2,0,0]=4 407 B17R2.207 O=c1ccc(n[nH]1)SCc2ccc(cc2)F 62a_100009820020_100000187164 [2,0,0,0,0,0|2,0,0]=4 408 B17R2.207 O=c1ccc(n[nH]1)SCc2ccc(cc2)I 62a_100000189116_100009820020 [2,0,0,0,0,0|2,0,0]=4 409 B17R2.207 O=c1ccc(n[nH]1)SCc2ccc(cc2)I 62a_100009820020_100000189116 [2,0,0,0,0,0|2,0,0]=4 410 B17R2.215 Cc1ccc(cc1)CSc2cc(ccn2)O 62a_100000210814_100000762945 [2,0,0,0,0,0|2,0,0]=4 411 B17R2.215 Cc1ccc(cc1)CSc2cc(cnn2)O 62a_100000210814_200010734679 [2,0,0,0,0,0|1,0,1]=4 412 B17R2.193 Cc1cc(n[nH]c1=O)SCc2ccccc2 62a_100000211182_100012187101 [2,0,0,0,0,0|2,0,0]=4 413 B17R2.193 Nc1cc(n[nH]c1=O)SCc2ccccc2 62a_100000211182_100000102183 [2,0,0,0,0,0|2,0,0]=4 414 B17R2.193 O=c1[nH]cc(cc1O)SCc2ccccc2 62a_100000211182_100009814561 [2,0,0,0,0,0|2,0,0]=4 415 B19R2.1056 CCc1ccc(c(c1)C)NCc2ccc(=O)[nH]n2 207a_100011226020_100011361533 [1,1,0,0,0,0|2,0,0]=4 416 B19R2.1056 CCc1ccc(c(c1)F)NCc2ccc(=O)[nH]n2 207a_100016177294_100011361533 [1,1,0,0,0,0|2,0,0]=4 417 B19R2.1056 Cc1cc(ccc1NCc2ccc(=O)[nH]n2)CO 207a_200011997030_100011361533 [1,1,0,0,0,0|1,0,0]=3 418 B19R2.1056 O=c1ccc(n[nH]1)CNc2ccc(cc2F)CO 207a_100011217239_100011361533 [1,1,0,0,0,0|1,0,0]=3 419 B19R2.2679 CCc1ccc(cc1Cl)NCc2ccc(=O)[nH]n2 207a_100000766362_100011361533 [1,1,0,0,0,0|2,0,0]=4 420 B19R2.2679 Cc1cc(ccc1CO)NCc2ccc(=O)[nH]n2 207a_100000102464_100011361533 [1,1,0,0,0,0|1,0,0]=3 421 B19R2.2679 O=c1ccc(n[nH]1)CNc2ccc(c(c2)Cl)CO 207a_100000689119_100011361533 [1,1,0,0,0,0|1,0,0]=3 422 B19R2.4295 CCCc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100011982809 [1,1,0,0,0,0|2,0,0]=4 423 B19R2.4295 CCCc1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100011982809_100009820020 [1,1,0,0,0,0|2,0,0]=4 424 B19R2.4295 CCCc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100000211780_100011361533 [1,1,0,0,0,0|2,0,0]=4 425 B19R2.4295 CCOc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100000739623_100011361533 [1,1,0,0,0,0|2,0,0]=4 426 B19R2.4295 CCSc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100015187087_100011361533 [1,1,0,0,0,0|2,0,0]=4 427 B19R2.4295 COCc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100000694113_100011361533 [1,1,0,0,0,0|1,0,0]=3 428 B19R2.4295 CSCc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_106726388226_100011361533 [1,1,0,0,0,0|1,1,0]=4 429 B19R2.4295 N#CCc1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100000198999_100011361533 [1,1,0,0,0,0|2,0,0]=4 430 B19R2.4295 O=c1ccc(n[nH]1)CNc2ccc(cc2)CCO 207a_100011204434_100011361533 [1,1,0,0,0,0|1,0,0]=3 431 B19R2.4982 CCc1ccc(cc1)CSc2n[nH]c(=O)cc2C 62a_100000757233_100000081757 [1,1,0,0,0,0|2,0,0]=4 432 B19R2.4982 Cc1cc(=O)[nH]nc1SCc2ccc(cc2)CO 62a_100000067286_100000081757 [1,1,0,0,0,0|1,0,0]=3 433 B19R2.4982 Nc1[nH]c(=O)ccc1SCc2ccc(cc2)CO 62a_100009884077_100000067286 [1,1,0,0,0,0|2,0,0]=4 434 B19R2.4982 O=c1[nH]nc(c(=O)[nH]1)NCc2ccc(cc2)CO 27a_100015189231_100000181694 [1,1,0,0,0,0|2,0,0]=4 435 B19R2.4982 O=c1[nH]nc(c(=O)[nH]1)SCc2ccc(cc2)CO 62a_100000067286_100000181694 [1,1,0,0,0,0|2,0,0]=4 436 B19R2.4982 O=c1cc(c(c[nH]1)SCc2ccc(cc2)CO)F 62a_100000067286_100015631685 [1,1,0,0,0,0|2,0,0]=4 437 B19R2.4982 O=c1cc(c(c[nH]1)SCc2ccc(cc2)CO)F 62a_100015631685_100000067286 [1,1,0,0,0,0|2,0,0]=4 438 B19R2.4984 O=Cc1ccc(nc1)SCc2ccc(cc2)CO 62a_100000067286_100000766901 [1,1,0,0,0,0|2,0,0]=4 439 B19R2.4984 O=Cc1ccc(nc1)SCc2ccc(cc2)CO 62a_100000766901_100000067286 [1,1,0,0,0,0|2,0,0]=4 440 B19R2.4984 O=Cc1ccc(nn1)SCc2ccc(cc2)CO 62a_100000044651_100000067286 [1,1,0,0,0,0|1,0,1]=4 441 B19R2.4984 O=Cc1ccc(nn1)SCc2ccc(cc2)CO 62a_100000067286_100000044651 [1,1,0,0,0,0|1,0,1]=4 442 B19R2.12337 CC(C)c1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100000181262_100009820020 [1,1,0,0,0,0|2,0,0]=4 443 B19R2.12337 CC(C)c1ccc(cc1)CSc2ccc(=O)[nH]n2 62a_100009820020_100000181262 [1,1,0,0,0,0|2,0,0]=4 444 B19R2.12337 CC(C)c1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100000210773_100011361533 [1,1,0,0,0,0|2,0,0]=4 445 B19R2.12337 CC(O)c1ccc(cc1)NCc2ccc(=O)[nH]n2 207a_100011216399_100011361533 [1,1,0,0,0,0|1,0,0]=3 446 B19R2.12337 O=c1ccc(n[nH]1)SCc2ccc(cc2)B(O)O 62a_100009813762_100009820020 [1,1,0,0,0,0|2,0,0]=4 447 B19R2.12337 O=c1ccc(n[nH]1)SCc2ccc(cc2)B(O)O 62a_100009820020_100009813762 [1,1,0,0,0,0|2,0,0]=4 448 B19R2.12337 O=c1ccc(n[nH]1)SCc2ccc(cc2)C(F)F 62a_100009820020_200012343607 [1,1,0,0,0,0|2,0,0]=4 449 B19R2.12337 O=c1ccc(n[nH]1)SCc2ccc(cc2)C(F)F 62a_200012343607_100009820020 [1,1,0,0,0,0|2,0,0]=4 450 B19R2.4997 OCc1ccc(cc1)CSc2nccc(c2F)O 62a_100000067286_100009876375 [1,1,0,0,0,0|2,0,0]=4 451 B19R2.4997 OCc1ccc(cc1)CSc2nccc(c2F)O 62a_100009876375_100000067286 [1,1,0,0,0,0|2,0,0]=4 452 B19R2.4999 COc1ccnc(c1)CNc2ccc(cc2)CO 2230a_100011215238_100000752681 [1,1,0,0,0,0|2,0,0]=4 453 B19R2.4999 COc1ccnc(c1)CNc2ccc(cc2)CO 34a_100011215238_100000752681 [1,1,0,0,0,0|2,0,0]=4 454 B19R2.4999 COc1ccnc(c1)COc2ccc(cc2)CO 34a_100000211755_100000752681 [1,1,0,0,0,0|2,0,0]=4 455 B19R2.4999 COc1ccnc(c1)CSc2ccc(cc2)CO 62a_100000690907_100000752681 [1,1,0,0,0,0|2,0,0]=4 456 B19R2.4999 COc1ccnc(c1)CSc2ccc(cc2)CO 62a_100000752681_100000690907 [1,1,0,0,0,0|2,0,0]=4 457 B19R2.4999 COc1ccnc(c1)SCc2ccc(cc2)CO 62a_100000067286_100011216251 [1,1,0,0,0,0|2,0,0]=4 458 B19R2.4999 COc1ccnc(c1)SCc2ccc(cc2)CO 62a_100009817693_100000067286 [1,1,0,0,0,0|2,0,0]=4 459 B19R2.4999 COc1cnnc(c1)SCc2ccc(cc2)CO 62a_100000067286_100000087634 [1,1,0,0,0,0|1,0,1]=4 460 B19R2.4999 OCc1ccc(cc1)CSc2cc(ccn2)CO 62a_100000067286_100009814636 [1,1,0,0,0,0|2,0,0]=4 461 B19R2.4999 OCc1ccc(cc1)CSc2cc(ccn2)CO 62a_100009814636_100000067286 [1,1,0,0,0,0|2,0,0]=4 462 B19R2.2847 COc1cc(c[nH]c1=O)SCc2ccc(cc2)C 62a_100000210814_100010125397 [1,1,0,0,0,0|2,0,0]=4 463 B19R2.12061 Cc1ccc(cc1)C(C)Sc2c[nH]c(=O)c(c2)O 62a_100011261388_100009814561 [1,1,0,0,0,0|2,0,0]=4 464 B19R2.12061 Cc1ccc(cc1)C(C)Sc2cc(c(=O)[nH]n2)C 62a_100011261388_100012187101 [1,1,0,0,0,0|2,0,0]=4 465 B19R2.12061 Cc1ccc(cc1)C(C)Sc2cc(c(=O)[nH]n2)N 62a_100011261388_100000102183 [1,1,0,0,0,0|2,0,0]=4 466 B19R2.51035 Cc1ccc(c(c1)C)CSc2c[nH]c(=O)c(c2)O 62a_100011219618_100009814561 [1,1,0,0,0,0|2,0,0]=4 467 B19R2.51035 Cc1ccc(c(c1)C)CSc2cc(c(=O)[nH]n2)C 62a_100011219618_100012187101 [1,1,0,0,0,0|2,0,0]=4 468 B19R2.51035 Cc1ccc(c(c1)C)CSc2cc(c(=O)[nH]n2)N 62a_100011219618_100000102183 [1,1,0,0,0,0|2,0,0]=4 469 B19R2.51035 Cc1ccc(c(c1)Cl)CSc2c[nH]c(=O)c(c2)O 62a_100012349684_100009814561 [1,1,0,0,0,0|2,0,0]=4 470 B19R2.51035 Cc1ccc(c(c1)Cl)CSc2cc(c(=O)[nH]n2)C 62a_100012349684_100012187101 [1,1,0,0,0,0|2,0,0]=4 471 B19R2.51035 Cc1ccc(c(c1)Cl)CSc2cc(c(=O)[nH]n2)N 62a_100012349684_100000102183 [1,1,0,0,0,0|2,0,0]=4 472 B19R2.51035 Cc1ccc(c(c1)F)CSc2c[nH]c(=O)c(c2)O 62a_100011217900_100009814561 [1,1,0,0,0,0|2,0,0]=4 473 B19R2.51035 Cc1ccc(c(c1)F)CSc2cc(c(=O)[nH]n2)C 62a_100011217900_100012187101 [1,1,0,0,0,0|2,0,0]=4 474 B19R2.51035 Cc1ccc(c(c1)F)CSc2cc(c(=O)[nH]n2)N 62a_100011217900_100000102183 [1,1,0,0,0,0|2,0,0]=4 475 B19R2.149413 Cc1ccc(cc1Br)CSc2c[nH]c(=O)c(c2)O 62a_100012232412_100009814561 [1,1,0,0,0,0|2,0,0]=4 476 B19R2.149413 Cc1ccc(cc1Br)CSc2cc(c(=O)[nH]n2)C 62a_100012232412_100012187101 [1,1,0,0,0,0|2,0,0]=4 477 B19R2.149413 Cc1ccc(cc1Br)CSc2cc(c(=O)[nH]n2)N 62a_100012232412_100000102183 [1,1,0,0,0,0|2,0,0]=4 478 B19R2.149413 Cc1ccc(cc1C)CSc2c[nH]c(=O)c(c2)O 62a_100000742320_100009814561 [1,1,0,0,0,0|2,0,0]=4 479 B19R2.149413 Cc1ccc(cc1C)CSc2cc(c(=O)[nH]n2)C 62a_100000742320_100012187101 [1,1,0,0,0,0|2,0,0]=4 480 B19R2.149413 Cc1ccc(cc1C)CSc2cc(c(=O)[nH]n2)N 62a_100000742320_100000102183 [1,1,0,0,0,0|2,0,0]=4 481 B19R2.149413 Cc1ccc(cc1Cl)CSc2c[nH]c(=O)c(c2)O 62a_100011823929_100009814561 [1,1,0,0,0,0|2,0,0]=4 482 B19R2.149413 Cc1ccc(cc1Cl)CSc2cc(c(=O)[nH]n2)C 62a_100011823929_100012187101 [1,1,0,0,0,0|2,0,0]=4 483 B19R2.149413 Cc1ccc(cc1Cl)CSc2cc(c(=O)[nH]n2)N 62a_100011823929_100000102183 [1,1,0,0,0,0|2,0,0]=4 484 B19R2.149413 Cc1ccc(cc1F)CSc2c[nH]c(=O)c(c2)O 62a_100011217369_100009814561 [1,1,0,0,0,0|2,0,0]=4 485 B19R2.149413 Cc1ccc(cc1F)CSc2cc(c(=O)[nH]n2)C 62a_100011217369_100012187101 [1,1,0,0,0,0|2,0,0]=4 486 B19R2.149413 Cc1ccc(cc1F)CSc2cc(c(=O)[nH]n2)N 62a_100011217369_100000102183 [1,1,0,0,0,0|2,0,0]=4 487 B19R2.149413 Cc1ccc(cc1I)CSc2c[nH]c(=O)c(c2)O 62a_100010206137_100009814561 [1,1,0,0,0,0|2,0,0]=4 488 B19R2.149413 Cc1ccc(cc1I)CSc2cc(c(=O)[nH]n2)C 62a_100010206137_100012187101 [1,1,0,0,0,0|2,0,0]=4 489 B19R2.149413 Cc1ccc(cc1I)CSc2cc(c(=O)[nH]n2)N 62a_100010206137_100000102183 [1,1,0,0,0,0|2,0,0]=4 490 B19R2.1294342 Cc1ccc(cc1)CSc2cc(c(=O)n(n2)C)C 62a_100000210814_100010988966 [1,1,0,0,0,0|2,0,0]=4 491 B19R2.1294342 Cc1ccc(cc1)CSc2cc(c(=O)n(n2)C)C 62a_100010988966_100000210814 [1,1,0,0,0,0|2,0,0]=4 492 B19R2.4898 COc1cc(c[nH]c1=O)Sc2ccc(cc2)CO 62a_100000690907_100010125397 [0,1,0,0,1,0|2,0,0]=4 493 B19R2.11970 CC(O)c1ccc(cc1)Sc2c[nH]c(=O)c(c2)O 62a_100000745893_100009814561 [0,1,0,0,1,0|2,0,0]=4 494 B19R2.11970 CC(O)c1ccc(cc1)Sc2cc(c(=O)[nH]n2)N 62a_100000745893_100000102183 [0,1,0,0,1,0|2,0,0]=4 495 B19R2.11970 Cc1cc(n[nH]c1=O)Sc2ccc(cc2)C(C)O 62a_100000745893_100012187101 [0,1,0,0,1,0|2,0,0]=4 496 B19R2.18951 Cc1cc(ccc1CO)Sc2c[nH]c(=O)c(c2)O 62a_100000748258_100009814561 [0,1,0,0,1,0|2,0,0]=4 497 B19R2.18951 Cc1cc(ccc1CO)Sc2cc(c(=O)[nH]n2)C 62a_100000748258_100012187101 [0,1,0,0,1,0|2,0,0]=4 498 B19R2.18951 Cc1cc(ccc1CO)Sc2cc(c(=O)[nH]n2)N 62a_100000748258_100000102183 [0,1,0,0,1,0|2,0,0]=4 499 B19R2.18951 Cc1cc(n[nH]c1=O)Sc2ccc(c(c2)Br)CO 62a_100010240206_100012187101 [0,1,0,0,1,0|2,0,0]=4 500 B19R2.18951 Cc1cc(n[nH]c1=O)Sc2ccc(c(c2)F)CO 62a_100011191541_100012187101 [0,1,0,0,1,0|2,0,0]=4 501 B19R2.18951 Cc1cc(n[nH]c1=O)Sc2ccc(c(c2)N)CO 62a_100000718831_100012187101 [0,1,0,0,1,0|2,0,0]=4 502 B19R2.18951 Cc1cc(n[nH]c1=O)Sc2ccc(c(c2)O)CO 62a_100000071718_100012187101 [0,1,0,0,1,0|2,0,0]=4 503 B19R2.18951 Nc1cc(ccc1CO)Sc2c[nH]c(=O)c(c2)O 62a_100000718831_100009814561 [0,1,0,0,1,0|2,0,0]=4 504 B19R2.18951 Nc1cc(ccc1CO)Sc2cc(c(=O)[nH]n2)N 62a_100000718831_100000102183 [0,1,0,0,1,0|2,0,0]=4 505 B19R2.18951 Nc1cc(n[nH]c1=O)Sc2ccc(c(c2)Br)CO 62a_100010240206_100000102183 [0,1,0,0,1,0|2,0,0]=4 506 B19R2.18951 Nc1cc(n[nH]c1=O)Sc2ccc(c(c2)F)CO 62a_100011191541_100000102183 [0,1,0,0,1,0|2,0,0]=4 507 B19R2.18951 Nc1cc(n[nH]c1=O)Sc2ccc(c(c2)O)CO 62a_100000071718_100000102183 [0,1,0,0,1,0|2,0,0]=4 508 B19R2.18951 O=c1[nH]cc(cc1O)Sc2ccc(c(c2)Br)CO 62a_100010240206_100009814561 [0,1,0,0,1,0|2,0,0]=4 509 B19R2.18951 O=c1[nH]cc(cc1O)Sc2ccc(c(c2)F)CO 62a_100011191541_100009814561 [0,1,0,0,1,0|2,0,0]=4 510 B19R2.18951 O=c1[nH]cc(cc1O)Sc2ccc(c(c2)O)CO 62a_100000071718_100009814561 [0,1,0,0,1,0|2,0,0]=4 511 B19R2.47089 COCc1ccc(cc1)Sc2c[nH]c(=O)c(c2)O 62a_100011493685_100009814561 [0,1,0,0,1,0|2,0,0]=4 512 B19R2.47089 COCc1ccc(cc1)Sc2cc(c(=O)[nH]n2)C 62a_100011493685_100012187101 [0,1,0,0,1,0|2,0,0]=4 513 B19R2.47089 COCc1ccc(cc1)Sc2cc(c(=O)[nH]n2)N 62a_100011493685_100000102183 [0,1,0,0,1,0|2,0,0]=4 514 B19R2.47089 Cc1cc(n[nH]c1=O)Sc2ccc(cc2)CCO 62a_100000766406_100012187101 [0,1,0,0,1,0|2,0,0]=4 515 B19R2.47089 Nc1cc(n[nH]c1=O)Sc2ccc(cc2)CCO 62a_100000766406_100000102183 [0,1,0,0,1,0|2,0,0]=4 516 B19R2.47089 O=c1[nH]cc(cc1O)Sc2ccc(cc2)CCO 62a_100000766406_100009814561 [0,1,0,0,1,0|2,0,0]=4 517 B19R2.57006 Cc1cc(nn(c1=O)C)Sc2ccc(cc2)CO 62a_100000690907_100010988966 [0,1,0,0,1,0|2,0,0]=4 518 B19R2.57006 Cc1cc(nn(c1=O)C)Sc2ccc(cc2)CO 62a_100010988966_100000690907 [0,1,0,0,1,0|2,0,0]=4 519 B19R2.195686 Cc1cc(ccc1Sc2c[nH]c(=O)c(c2)O)CO 62a_100000718852_100009814561 [0,1,0,0,1,0|2,0,0]=4 520 B19R2.195686 Cc1cc(ccc1Sc2cc(c(=O)[nH]n2)C)CO 62a_100000718852_100012187101 [0,1,0,0,1,0|2,0,0]=4 521 B19R2.195686 Cc1cc(ccc1Sc2cc(c(=O)[nH]n2)N)CO 62a_100000718852_100000102183 [0,1,0,0,1,0|2,0,0]=4 522 B19R2.195686 Cc1cc(n[nH]c1=O)Sc2ccc(cc2Cl)CO 62a_100000718186_100012187101 [0,1,0,0,1,0|2,0,0]=4 523 B19R2.195686 Cc1cc(n[nH]c1=O)Sc2ccc(cc2F)CO 62a_100011533735_100012187101 [0,1,0,0,1,0|2,0,0]=4 524 B19R2.195686 Cc1cc(n[nH]c1=O)Sc2ccc(cc2N)CO 62a_100012347568_100012187101 [0,1,0,0,1,0|2,0,0]=4 525 B19R2.195686 Cc1cc(n[nH]c1=O)Sc2ccc(cc2O)CO 62a_100000049605_100012187101 [0,1,0,0,1,0|2,0,0]=4 526 B19R2.195686 Nc1cc(ccc1Sc2c[nH]c(=O)c(c2)O)CO 62a_100012347568_100009814561 [0,1,0,0,1,0|2,0,0]=4 527 B19R2.195686 Nc1cc(ccc1Sc2cc(c(=O)[nH]n2)N)CO 62a_100012347568_100000102183 [0,1,0,0,1,0|2,0,0]=4 528 B19R2.195686 Nc1cc(n[nH]c1=O)Sc2ccc(cc2Cl)CO 62a_100000718186_100000102183 [0,1,0,0,1,0|2,0,0]=4 529 B19R2.195686 Nc1cc(n[nH]c1=O)Sc2ccc(cc2F)CO 62a_100011533735_100000102183 [0,1,0,0,1,0|2,0,0]=4 530 B19R2.195686 Nc1cc(n[nH]c1=O)Sc2ccc(cc2O)CO 62a_100000049605_100000102183 [0,1,0,0,1,0|2,0,0]=4 531 B19R2.195686 O=c1[nH]cc(cc1O)Sc2ccc(cc2Cl)CO 62a_100000718186_100009814561 [0,1,0,0,1,0|2,0,0]=4 532 B19R2.195686 O=c1[nH]cc(cc1O)Sc2ccc(cc2F)CO 62a_100011533735_100009814561 [0,1,0,0,1,0|2,0,0]=4 533 B19R2.195686 O=c1[nH]cc(cc1O)Sc2ccc(cc2O)CO 62a_100000049605_100009814561 [0,1,0,0,1,0|2,0,0]=4 534 B21R2.6067 COc1cc(ncc1Br)COCc2ccc(cc2)CO 34a_100010999569_100000067286 [0,1,0,0,0,1|2,0,0]=4 535 B21R2.101533 COCc1ccc(cc1)CNCc2c[nH]c(=O)c(c2)Cl 207a_100000738208_100000051075 [0,1,0,0,0,1|2,0,0]=4 536 B21R2.101533 COCc1ccc(cc1)CNCc2c[nH]c(=O)c(c2)Cl 270004a_100000738208_100000051075 [0,1,0,0,0,1|2,0,0]=4 537 B21R2.358463 CC(O)c1ccc(cc1)CNCc2c[nH]c(=O)c(c2)Cl 207a_200000048501_100000051075 [0,1,0,0,0,1|2,0,0]=4 538 B21R2.358463 CC(O)c1ccc(cc1)CNCc2c[nH]c(=O)c(c2)Cl 270004a_200000048501_100000051075 [0,1,0,0,0,1|2,0,0]=4 539 B21R2.125966 COc1cc(ncc1C=O)SCc2ccc(cc2)CO 62a_100000067286_100009846838 [0,2,0,0,0,0|2,0,0]=4 540 B21R2.125966 COc1cc(ncc1C=O)SCc2ccc(cc2)CO 62a_100009846838_100000067286 [0,2,0,0,0,0|2,0,0]=4 541 B17R2.2 CCc1ccc(cc1)Sc2ccc(=O)[nH]n2 62a_100009820020_100011215824 [1,0,0,0,1,0|2,0,0]=4 542 B17R2.2 CCc1ccc(cc1)Sc2ccc(=O)[nH]n2 62a_100011215824_100009820020 [1,0,0,0,1,0|2,0,0]=4 543 B17R2.2 NCc1ccc(cc1)Sc2ccc(=O)[nH]n2 62a_100009820020_100016989417 [1,0,0,0,1,0|2,0,0]=4 544 B17R2.2 NCc1ccc(cc1)Sc2ccc(=O)[nH]n2 62a_100016989417_100009820020 [1,0,0,0,1,0|2,0,0]=4 545 B17R2.2 O=c1ccc(c[nH]1)Sc2ccc(cc2)CO 62a_100000212171_100000690907 [1,0,0,0,1,0|2,0,0]=4 546 B17R2.2 O=c1ccc(c[nH]1)Sc2ccc(cc2)CO 62a_100000690907_100000212171 [1,0,0,0,1,0|2,0,0]=4 547 B17R2.2 O=c1ccc(n[nH]1)Sc2ccc(cc2)CF 62a_100009820020_100010268989 [1,0,0,0,1,0|2,0,0]=4 548 B17R2.2 O=c1ccc(n[nH]1)Sc2ccc(cc2)CF 62a_100010268989_100009820020 [1,0,0,0,1,0|2,0,0]=4 549 B17R2.2 O=c1ccc(n[nH]1)Sc2ccc(cc2)CO 62a_100000690907_100009820020 [1,0,0,0,1,0|1,0,0]=3 550 B17R2.2 O=c1ccc(n[nH]1)Sc2ccc(cc2)CO 62a_100009820020_100000690907 [1,0,0,0,1,0|1,0,0]=3 551 B17R2.2 O=c1ccc(n[nH]1)Sc2ccc(cn2)CO 62a_100009816760_100009820020 [1,0,0,0,1,0|2,0,0]=4 552 B17R2.2 O=c1ccc(n[nH]1)Sc2ccc(cn2)CO 62a_100009820020_100009816760 [1,0,0,0,1,0|2,0,0]=4 553 B17R2.2 O=c1ccc(n[nH]1)Sc2ccc(nc2)CO 62a_100000754261_100009820020 [1,0,0,0,1,0|2,0,0]=4 554 B17R2.2 O=c1ccc(n[nH]1)Sc2ccc(nc2)CO 62a_100009820020_100000754261 [1,0,0,0,1,0|2,0,0]=4 555 B17R2.55 Cc1cc(n[nH]1)SCc2ccc(cc2)CO 62a_100000067286_100009819999 [1,0,0,0,1,0|2,0,0]=4 556 B17R2.55 Cc1cc(n[nH]1)SCc2ccc(cc2)CO 62a_100009819999_100000067286 [1,0,0,0,1,0|2,0,0]=4 557 B17R2.55 Nc1cc(n[nH]1)SCc2ccc(cc2)CO 62a_100000067286_100009822546 [1,0,0,0,1,0|2,0,0]=4 558 B17R2.55 Nc1cc(n[nH]1)SCc2ccc(cc2)CO 62a_100009822546_100000067286 [1,0,0,0,1,0|2,0,0]=4 559 B17R2.55 O=c1[nH]nc([nH]1)CNc2ccc(cc2)CO 2230a_100011215238_100000754189 [1,0,0,0,1,0|2,0,0]=4 560 B17R2.55 O=c1[nH]nc([nH]1)CSc2ccc(cc2)CO 62a_100000690907_100000754189 [1,0,0,0,1,0|2,0,0]=4 561 B17R2.47 OCc1ccc(cc1)Sc2cc(ccn2)O 62a_100000690907_100000762945 [1,0,0,0,1,0|2,0,0]=4 562 B17R2.47 OCc1ccc(cc1)Sc2cc(cnn2)O 62a_100000690907_200010734679 [1,0,0,0,1,0|1,0,1]=4 563 B17R2.54 Cc1c[nH]nc1SCc2ccc(cc2)CO 62a_100000067286_100009871783 [1,0,0,0,1,0|2,0,0]=4 564 B17R2.54 Cc1c[nH]nc1SCc2ccc(cc2)CO 62a_100009871783_100000067286 [1,0,0,0,1,0|2,0,0]=4 565 B17R2.54 Nc1c[nH]nc1SCc2ccc(cc2)CO 62a_100000067286_100010894806 [1,0,0,0,1,0|2,0,0]=4 566 B17R2.54 Nc1c[nH]nc1SCc2ccc(cc2)CO 62a_100010894806_100000067286 [1,0,0,0,1,0|2,0,0]=4 567 B17R2.54 OCc1ccc(cc1)CSc2n[nH]cc2Br 62a_100000067286_100015839836 [1,0,0,0,1,0|2,0,0]=4 568 B17R2.54 OCc1ccc(cc1)CSc2n[nH]cc2Br 62a_100015839836_100000067286 [1,0,0,0,1,0|2,0,0]=4 569 B17R2.472 Cc1ccc(cc1)Sc2c[nH]c(=O)c(c2)O 62a_100000186775_100009814561 [1,0,0,0,1,0|2,0,0]=4 570 B17R2.472 Cc1ccc(cc1)Sc2cc(c(=O)[nH]n2)C 62a_100000186775_100012187101 [1,0,0,0,1,0|2,0,0]=4 571 B17R2.472 Cc1ccc(cc1)Sc2cc(c(=O)[nH]n2)N 62a_100000186775_100000102183 [1,0,0,0,1,0|2,0,0]=4 572 B17R2.70 CCc1ccc(cc1)c2c[nH]c(=O)c(c2)O 271570a_100000767149_100009814561 [0,0,0,0,2,0|2,0,0]=4 573 B17R2.70 CCc1ccc(cc1)c2cc(c(=O)[nH]n2)C 271570a_100000767149_100012187101 [0,0,0,0,2,0|2,0,0]=4 574 B17R2.70 CCc1ccc(cc1)c2cc(c(=O)[nH]n2)N 271570a_100000767149_100000102183 [0,0,0,0,2,0|2,0,0]=4 575 B17R2.70 Cc1cc(n[nH]c1=O)c2ccc(cc2)CBr 271570a_100000695873_100012187101 [0,0,0,0,2,0|2,0,0]=4 576 B17R2.70 Cc1cc(n[nH]c1=O)c2ccc(cc2)CN 271570a_100020603209_100012187101 [0,0,0,0,2,0|2,0,0]=4 577 B17R2.70 Cc1cc(n[nH]c1=O)c2ccc(cc2)CO 271570a_100011830420_100012187101 [0,0,0,0,2,0|1,0,0]=3 578 B17R2.70 Cc1cnc(cc1O)c2ccc(cc2)CO 271570a_100011830420_100000704368 [0,0,0,0,2,0|2,0,0]=4 579 B17R2.70 NCc1ccc(cc1)c2c[nH]c(=O)c(c2)O 271570a_100020603209_100009814561 [0,0,0,0,2,0|2,0,0]=4 580 B17R2.70 NCc1ccc(cc1)c2cc(c(=O)[nH]n2)N 271570a_100020603209_100000102183 [0,0,0,0,2,0|2,0,0]=4 581 B17R2.70 Nc1cc(n[nH]c1=O)c2ccc(cc2)CBr 271570a_100000695873_100000102183 [0,0,0,0,2,0|2,0,0]=4 582 B17R2.70 Nc1cc(n[nH]c1=O)c2ccc(cc2)CO 271570a_100011830420_100000102183 [0,0,0,0,2,0|1,0,0]=3 583 B17R2.70 O=c1[nH]cc(cc1Br)c2ccc(cc2)CO 271570a_100011830420_100010125443 [0,0,0,0,2,0|2,0,0]=4 584 B17R2.70 O=c1[nH]cc(cc1F)c2ccc(cc2)CO 271570a_100011830420_100000723523 [0,0,0,0,2,0|2,0,0]=4 585 B17R2.70 O=c1[nH]cc(cc1O)c2ccc(cc2)CBr 271570a_100000695873_100009814561 [0,0,0,0,2,0|2,0,0]=4 586 B17R2.70 O=c1[nH]cc(cc1O)c2ccc(cc2)CO 271570a_100011830420_100009814561 [0,0,0,0,2,0|1,0,0]=3 587 B17R2.70 OCc1ccc(cc1)c2cc(c(cn2)F)O 271570a_100011830420_100009854642 [0,0,0,0,2,0|2,0,0]=4 588 B19R2.58 C#Cc1ccc(cc1)CNCc2ccc(=O)[nH]n2 207a_100015199678_100011361533 [1,0,0,0,0,1|1,0,1]=4 589 B19R2.58 C#Cc1ccc(cc1)CNCc2ccc(=O)[nH]n2 270004a_100015199678_100011361533 [1,0,0,0,0,1|1,0,1]=4 590 B19R2.58 C=Cc1ccc(cc1)CCSc2ccc(=O)[nH]n2 62a_100000142037_100009820020 [1,0,0,0,0,1|1,0,1]=4 591 B19R2.58 C=Cc1ccc(cc1)CCSc2ccc(=O)[nH]n2 62a_100009820020_100000142037 [1,0,0,0,0,1|1,0,1]=4 592 B19R2.58 C=Cc1ccc(cc1)CNCc2ccc(=O)[nH]n2 207a_200011934891_100011361533 [1,0,0,0,0,1|1,0,1]=4 593 B19R2.58 C=Cc1ccc(cc1)CNCc2ccc(=O)[nH]n2 270004a_200011934891_100011361533 [1,0,0,0,0,1|1,0,1]=4 594 B19R2.58 CCc1ccc(cc1)CNCc2ccc(=O)[nH]n2 207a_100000721222_100011361533 [1,0,0,0,0,1|1,0,0]=3 595 B19R2.58 CCc1ccc(cc1)CNCc2ccc(=O)[nH]n2 270004a_100000721222_100011361533 [1,0,0,0,0,1|1,0,0]=3 596 B19R2.58 CCc1ccc(cc1)COCc2ccc(=O)[nH]c2 34a_100011999846_100000747183 [1,0,0,0,0,1|2,0,0]=4 597 B19R2.58 COc1ccc(cc1)CCSc2ccc(=O)[nH]n2 62a_100009820020_100011713689 [1,0,0,0,0,1|2,0,0]=4 598 B19R2.58 COc1ccc(cc1)CCSc2ccc(=O)[nH]n2 62a_100011713689_100009820020 [1,0,0,0,0,1|2,0,0]=4 599 B19R2.58 COc1ccc(cc1)CNCc2ccc(=O)[nH]n2 207a_100000185587_100011361533 [1,0,0,0,0,1|2,0,0]=4 600 B19R2.58 COc1ccc(cc1)CNCc2ccc(=O)[nH]n2 270004a_100000185587_100011361533 [1,0,0,0,0,1|2,0,0]=4 601 B19R2.58 CSc1ccc(cc1)CNCc2ccc(=O)[nH]n2 207a_100000174980_100011361533 [1,0,0,0,0,1|2,0,0]=4 602 B19R2.58 CSc1ccc(cc1)CNCc2ccc(=O)[nH]n2 270004a_100000174980_100011361533 [1,0,0,0,0,1|2,0,0]=4 603 B19R2.58 Cc1ccc(nc1)CNCc2ccc(cc2)CO 207a_100015189231_100000050478 [1,0,0,0,0,1|2,0,0]=4 604 B19R2.58 Cc1ccc(nc1)CNCc2ccc(cc2)CO 2230a_100015189231_100000691093 [1,0,0,0,0,1|2,0,0]=4 605 B19R2.58 Cc1ccc(nc1)CNCc2ccc(cc2)CO 270004a_100015189231_100000050478 [1,0,0,0,0,1|2,0,0]=4 606 B19R2.58 Cc1ccc(nc1)CNCc2ccc(cc2)CO 34a_100015187455_100000067286 [1,0,0,0,0,1|2,0,0]=4 607 B19R2.58 Cc1ccc(nc1)CNCc2ccc(cc2)CO 34a_100015189231_100000691093 [1,0,0,0,0,1|2,0,0]=4 608 B19R2.58 Cc1ccc(nc1)COCc2ccc(cc2)CO 34a_100012001401_100000067286 [1,0,0,0,0,1|2,0,0]=4 609 B19R2.58 Cc1ccc(nc1)CSCc2ccc(cc2)CO 62a_100000067286_100000691093 [1,0,0,0,0,1|2,0,0]=4 610 B19R2.58 Cc1ccc(nc1)CSCc2ccc(cc2)CO 62a_100000691093_100000067286 [1,0,0,0,0,1|2,0,0]=4 611 B19R2.58 N#Cc1ccc(cc1)CCSc2ccc(=O)[nH]n2 62a_100009820020_100012161189 [1,0,0,0,0,1|1,0,1]=4 612 B19R2.58 N#Cc1ccc(cc1)CNCc2ccc(=O)[nH]n2 207a_100015207190_100011361533 [1,0,0,0,0,1|1,0,1]=4 613 B19R2.58 N#Cc1ccc(cc1)CNCc2ccc(=O)[nH]n2 270004a_100015207190_100011361533 [1,0,0,0,0,1|1,0,1]=4 614 B19R2.58 Nc1ccc(nc1)COCc2ccc(cc2)CO 34a_100011998161_100000067286 [1,0,0,0,0,1|2,0,0]=4 615 B19R2.58 O=c1ccc(c[nH]1)COCc2ccc(cc2)CO 34a_100011999846_100000067286 [1,0,0,0,0,1|1,0,0]=3 616 B19R2.58 O=c1ccc(n[nH]1)CNCc2ccc(cc2)CO 207a_100015189231_100011361533 [1,0,0,0,0,1|0,0,0]=2 617 B19R2.58 O=c1ccc(n[nH]1)CNCc2ccc(cc2)CO 270004a_100015189231_100011361533 [1,0,0,0,0,1|0,0,0]=2 618 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Br 207a_100015189231_100000754260 [1,0,0,0,0,1|2,0,0]=4 619 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Br 2230a_100015189231_100000702658 [1,0,0,0,0,1|2,0,0]=4 620 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Br 270004a_100015189231_100000754260 [1,0,0,0,0,1|2,0,0]=4 621 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100015188789_100000067286 [1,0,0,0,0,1|2,0,0]=4 622 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100015189231_100000702658 [1,0,0,0,0,1|2,0,0]=4 623 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Cl 207a_100015189231_100011361569 [1,0,0,0,0,1|2,0,0]=4 624 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Cl 2230a_100015189231_100012066911 [1,0,0,0,0,1|2,0,0]=4 625 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Cl 270004a_100000697193_100009832023 [1,0,0,0,0,1|2,0,0]=4 626 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Cl 270004a_100015189231_100011361569 [1,0,0,0,0,1|2,0,0]=4 627 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Cl 34a_100000697193_100000067286 [1,0,0,0,0,1|2,0,0]=4 628 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)Cl 34a_100015189231_100012066911 [1,0,0,0,0,1|2,0,0]=4 629 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)F 207a_100015189231_100011934744 [1,0,0,0,0,1|2,0,0]=4 630 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)F 2230a_100015189231_100000703193 [1,0,0,0,0,1|2,0,0]=4 631 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)F 270004a_100015189231_100011934744 [1,0,0,0,0,1|2,0,0]=4 632 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)F 34a_100015189231_100000703193 [1,0,0,0,0,1|2,0,0]=4 633 B19R2.58 OCc1ccc(cc1)CNCc2ccc(cn2)F 34a_100020620131_100000067286 [1,0,0,0,0,1|2,0,0]=4 634 B19R2.58 OCc1ccc(cc1)CNCc2ccc(nn2)Cl 2230a_100015189231_100016992710 [1,0,0,0,0,1|1,0,1]=4 635 B19R2.58 OCc1ccc(cc1)CNCc2ccc(nn2)Cl 270004a_100015189231_100000044651 [1,0,0,0,0,1|1,0,1]=4 636 B19R2.58 OCc1ccc(cc1)CNCc2ccc(nn2)Cl 34a_100015189231_100016992710 [1,0,0,0,0,1|1,0,1]=4 637 B19R2.58 OCc1ccc(cc1)COCc2ccc(cn2)Br 34a_100000754261_100000067286 [1,0,0,0,0,1|2,0,0]=4 638 B19R2.58 OCc1ccc(cc1)COCc2ccc(cn2)Cl 34a_100000703999_100000067286 [1,0,0,0,0,1|2,0,0]=4 639 B19R2.58 OCc1ccc(cc1)COCc2ccc(cn2)F 34a_100011999454_100000067286 [1,0,0,0,0,1|2,0,0]=4 640 B19R2.58 OCc1ccc(cc1)CSCc2ccc(cn2)Br 62a_100000067286_100000702658 [1,0,0,0,0,1|2,0,0]=4 641 B19R2.58 OCc1ccc(cc1)CSCc2ccc(cn2)Br 62a_100000702658_100000067286 [1,0,0,0,0,1|2,0,0]=4 642 B19R2.58 OCc1ccc(cc1)CSCc2ccc(cn2)Cl 62a_100000067286_100000697101 [1,0,0,0,0,1|2,0,0]=4 643 B19R2.58 OCc1ccc(cc1)CSCc2ccc(cn2)Cl 62a_100012066911_100000067286 [1,0,0,0,0,1|2,0,0]=4 644 B19R2.58 OCc1ccc(cc1)CSCc2ccc(cn2)F 62a_100000067286_100000703193 [1,0,0,0,0,1|2,0,0]=4 645 B19R2.58 OCc1ccc(cc1)CSCc2ccc(cn2)F 62a_100000703193_100000067286 [1,0,0,0,0,1|2,0,0]=4 646 B19R2.58 OCc1ccc(cc1)CSCc2ccc(nn2)Cl 62a_100000067286_100016992710 [1,0,0,0,0,1|1,0,1]=4 647 B19R2.58 OCc1ccc(cc1)CSCc2ccc(nn2)Cl 62a_100016992710_100000067286 [1,0,0,0,0,1|1,0,1]=4 648 B19R2.56 Cc1ccnc(c1)CNCc2ccc(cc2)CO 207a_100015189231_100011361488 [1,0,0,0,0,1|2,0,0]=4 649 B19R2.56 Cc1ccnc(c1)CNCc2ccc(cc2)CO 2230a_100015189231_100000718516 [1,0,0,0,0,1|2,0,0]=4 650 B19R2.56 Cc1ccnc(c1)CNCc2ccc(cc2)CO 270004a_100015189231_100011361488 [1,0,0,0,0,1|2,0,0]=4 651 B19R2.56 Cc1ccnc(c1)CNCc2ccc(cc2)CO 34a_100015189231_100000718516 [1,0,0,0,0,1|2,0,0]=4 652 B19R2.56 Cc1ccnc(c1)COCc2ccc(cc2)CO 34a_100011998357_100000067286 [1,0,0,0,0,1|2,0,0]=4 653 B19R2.56 Cc1ccnc(c1)CSCc2ccc(cc2)CO 62a_100000067286_100000718516 [1,0,0,0,0,1|2,0,0]=4 654 B19R2.56 Cc1ccnc(c1)CSCc2ccc(cc2)CO 62a_100000718516_100000067286 [1,0,0,0,0,1|2,0,0]=4 655 B19R2.56 Cc1cnnc(c1)COCc2ccc(cc2)CO 34a_100016212594_100000067286 [1,0,0,0,0,1|1,0,1]=4 656 B19R2.56 Nc1ccnc(c1)COCc2ccc(cc2)CO 34a_100000692640_100000067286 [1,0,0,0,0,1|2,0,0]=4 657 B19R2.56 OCc1ccc(cc1)CNCc2cc(ccn2)Br 2230a_100015189231_100010173614 [1,0,0,0,0,1|2,0,0]=4 658 B19R2.56 OCc1ccc(cc1)CNCc2cc(ccn2)Br 270004a_100015189231_100009818557 [1,0,0,0,0,1|2,0,0]=4 659 B19R2.56 OCc1ccc(cc1)CNCc2cc(ccn2)Br 34a_100015189231_100010173614 [1,0,0,0,0,1|2,0,0]=4 660 B19R2.56 OCc1ccc(cc1)CNCc2cc(ccn2)Cl 2230a_100015189231_100016988179 [1,0,0,0,0,1|2,0,0]=4 661 B19R2.56 OCc1ccc(cc1)CNCc2cc(ccn2)Cl 270004a_100015189231_100011998288 [1,0,0,0,0,1|2,0,0]=4 662 B19R2.56 OCc1ccc(cc1)CNCc2cc(ccn2)Cl 34a_100015189231_100016988179 [1,0,0,0,0,1|2,0,0]=4 663 B19R2.56 OCc1ccc(cc1)CNCc2cccc(c2)O 207a_100000743036_100009832023 [1,0,0,0,0,1|2,0,0]=4 664 B19R2.56 OCc1ccc(cc1)CNCc2cccc(c2)O 207a_100015189231_100000188321 [1,0,0,0,0,1|2,0,0]=4 665 B19R2.56 OCc1ccc(cc1)CNCc2cccc(c2)O 2230a_100000743036_100000067286 [1,0,0,0,0,1|2,0,0]=4 666 B19R2.56 OCc1ccc(cc1)CNCc2cccc(c2)O 2230a_100015189231_100011660834 [1,0,0,0,0,1|2,0,0]=4 667 B19R2.56 OCc1ccc(cc1)CNCc2cccc(c2)O 270004a_100000743036_100009832023 [1,0,0,0,0,1|2,0,0]=4 668 B19R2.56 OCc1ccc(cc1)CNCc2cccc(c2)O 270004a_100015189231_100000188321 [1,0,0,0,0,1|2,0,0]=4 669 B19R2.56 OCc1ccc(cc1)CNCc2cccc(c2)O 34a_100000743036_100000067286 [1,0,0,0,0,1|2,0,0]=4 670 B19R2.56 OCc1ccc(cc1)CNCc2cccc(c2)O 34a_100015189231_100011660834 [1,0,0,0,0,1|2,0,0]=4 671 B19R2.56 OCc1ccc(cc1)CNCc2cncc(c2)O 207a_100015189231_100012187055 [1,0,0,0,0,1|1,0,1]=4 672 B19R2.56 OCc1ccc(cc1)CNCc2cncc(c2)O 270004a_100015189231_100012187055 [1,0,0,0,0,1|1,0,1]=4 673 B19R2.56 OCc1ccc(cc1)COCc2cc(ccn2)Cl 34a_100000748867_100000067286 [1,0,0,0,0,1|2,0,0]=4 674 B19R2.56 OCc1ccc(cc1)CSCc2cc(ccn2)Br 62a_100000067286_100010173614 [1,0,0,0,0,1|2,0,0]=4 675 B19R2.56 OCc1ccc(cc1)CSCc2cc(ccn2)Br 62a_100010173614_100000067286 [1,0,0,0,0,1|2,0,0]=4 676 B19R2.56 OCc1ccc(cc1)CSCc2cc(ccn2)Cl 62a_100000067286_100016988179 [1,0,0,0,0,1|2,0,0]=4 677 B19R2.56 OCc1ccc(cc1)CSCc2cc(ccn2)Cl 62a_100016988179_100000067286 [1,0,0,0,0,1|2,0,0]=4 678 B19R2.56 OCc1ccc(cc1)CSCc2cccc(c2)O 62a_100000067286_100011660834 [1,0,0,0,0,1|2,0,0]=4 679 B19R2.56 OCc1ccc(cc1)CSCc2cccc(c2)O 62a_100011660834_100000067286 [1,0,0,0,0,1|2,0,0]=4 680 B19R2.12305 Cc1cc(n[nH]c1=O)SCCc2ccc(cc2)Br 62a_100011740612_100012187101 [1,0,0,0,0,1|2,0,0]=4 681 B19R2.12305 Cc1cc(n[nH]c1=O)SCCc2ccc(cc2)Cl 62a_100011713675_100012187101 [1,0,0,0,0,1|2,0,0]=4 682 B19R2.12305 Cc1cc(n[nH]c1=O)SCCc2ccc(cc2)F 62a_100011217392_100012187101 [1,0,0,0,0,1|2,0,0]=4 683 B19R2.12305 Cc1cc(n[nH]c1=O)SCCc2ccc(cc2)O 62a_100009816426_100012187101 [1,0,0,0,0,1|1,0,0]=3 684 B19R2.12305 Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)Br 62a_100010125443_100011713686 [1,0,0,0,0,1|2,0,0]=4 685 B19R2.12305 Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)Br 62a_100011713686_100010125443 [1,0,0,0,0,1|2,0,0]=4 686 B19R2.12305 Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)F 62a_100000723523_100011713686 [1,0,0,0,0,1|2,0,0]=4 687 B19R2.12305 Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)F 62a_100011713686_100000723523 [1,0,0,0,0,1|2,0,0]=4 688 B19R2.12305 Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)O 62a_100011713686_100009814561 [1,0,0,0,0,1|1,0,0]=3 689 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)C 62a_100011713686_100012187101 [1,0,0,0,0,1|1,0,0]=3 690 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)N 62a_100011713686_100000102183 [1,0,0,0,0,1|1,0,0]=3 691 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(cn2)C)O 62a_100000704368_100011713686 [1,0,0,0,0,1|2,0,0]=4 692 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(cn2)C)O 62a_100011713686_100000704368 [1,0,0,0,0,1|2,0,0]=4 693 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(cn2)F)O 62a_100009854642_100011713686 [1,0,0,0,0,1|2,0,0]=4 694 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(cn2)F)O 62a_100011713686_100009854642 [1,0,0,0,0,1|2,0,0]=4 695 B19R2.12305 Cc1ccc(cc1)CNCc2c[nH]c(=O)c(c2)Cl 207a_100000174908_100000051075 [1,0,0,0,0,1|2,0,0]=4 696 B19R2.12305 Cc1ccc(cc1)CNCc2c[nH]c(=O)c(c2)Cl 270004a_100000174908_100000051075 [1,0,0,0,0,1|2,0,0]=4 697 B19R2.12305 Cc1cnc(cc1O)SCCc2ccc(cc2)O 62a_100000704368_100009816426 [1,0,0,0,0,1|2,0,0]=4 698 B19R2.12305 Cc1cnc(cc1O)SCCc2ccc(cc2)O 62a_100009816426_100000704368 [1,0,0,0,0,1|2,0,0]=4 699 B19R2.12305 Nc1cc(n[nH]c1=O)SCCc2ccc(cc2)Br 62a_100011740612_100000102183 [1,0,0,0,0,1|2,0,0]=4 700 B19R2.12305 Nc1cc(n[nH]c1=O)SCCc2ccc(cc2)Cl 62a_100011713675_100000102183 [1,0,0,0,0,1|2,0,0]=4 701 B19R2.12305 Nc1cc(n[nH]c1=O)SCCc2ccc(cc2)F 62a_100011217392_100000102183 [1,0,0,0,0,1|2,0,0]=4 702 B19R2.12305 Nc1cc(n[nH]c1=O)SCCc2ccc(cc2)O 62a_100009816426_100000102183 [1,0,0,0,0,1|1,0,0]=3 703 B19R2.12305 O=c1[nH]cc(cc1Br)SCCc2ccc(cc2)O 62a_100009816426_100010125443 [1,0,0,0,0,1|2,0,0]=4 704 B19R2.12305 O=c1[nH]cc(cc1Br)SCCc2ccc(cc2)O 62a_100010125443_100009816426 [1,0,0,0,0,1|2,0,0]=4 705 B19R2.12305 O=c1[nH]cc(cc1F)SCCc2ccc(cc2)O 62a_100000723523_100009816426 [1,0,0,0,0,1|2,0,0]=4 706 B19R2.12305 O=c1[nH]cc(cc1F)SCCc2ccc(cc2)O 62a_100009816426_100000723523 [1,0,0,0,0,1|2,0,0]=4 707 B19R2.12305 O=c1[nH]cc(cc1O)SCCc2ccc(cc2)Br 62a_100011740612_100009814561 [1,0,0,0,0,1|2,0,0]=4 708 B19R2.12305 O=c1[nH]cc(cc1O)SCCc2ccc(cc2)Cl 62a_100011713675_100009814561 [1,0,0,0,0,1|2,0,0]=4 709 B19R2.12305 O=c1[nH]cc(cc1O)SCCc2ccc(cc2)F 62a_100011217392_100009814561 [1,0,0,0,0,1|2,0,0]=4 710 B19R2.12305 O=c1[nH]cc(cc1O)SCCc2ccc(cc2)O 62a_100009816426_100009814561 [1,0,0,0,0,1|1,0,0]=3 711 B19R2.12305 Oc1ccc(cc1)CCSc2cc(c(cn2)F)O 62a_100009816426_100009854642 [1,0,0,0,0,1|2,0,0]=4 712 B19R2.12305 Oc1ccc(cc1)CCSc2cc(c(cn2)F)O 62a_100009854642_100009816426 [1,0,0,0,0,1|2,0,0]=4 713 B19R2.191497 Cc1cc(n[nH]c1=O)SCc2cccc(c2)CO 62a_100010188025_100012187101 [0,0,0,0,1,1|2,0,0]=4 714 B19R2.191497 Nc1cc(n[nH]c1=O)SCc2cccc(c2)CO 62a_100010188025_100000102183 [0,0,0,0,1,1|2,0,0]=4 715 B19R2.191497 O=c1[nH]cc(cc1O)SCc2cccc(c2)CO 62a_100010188025_100009814561 [0,0,0,0,1,1|2,0,0]=4