0 B21R2.1523891 COc1ccc(cc1OC)CNc2cc(c(cn2)C)F 27a_100000185555_100009841206 [0,0,0,0,0,0|4,0,0]=4 1 B21R2.1523891 COc1ccc(cc1OC)CNc2ccc(c(c2)O)C 270302a_100000759471_100000170513 [0,0,0,0,0,0|4,0,0]=4 2 B21R2.1523891 COc1ccc(cc1OC)CNc2ccc(c(c2)O)Cl 270302a_100011934209_100000170513 [0,0,0,0,0,0|4,0,0]=4 3 B21R2.1523891 COc1ccc(cc1OC)CNc2ccc(c(c2)O)F 270302a_100012017398_100000170513 [0,0,0,0,0,0|4,0,0]=4 4 B21R2.1523891 COc1ccc(cc1OC)CNc2ncc(c(n2)O)F 27a_100000185555_100011995740 [0,0,0,0,0,0|4,0,0]=4 5 B21R2.1523891 COc1ccc(cc1OC)CSc2c[nH]c(=O)c(c2)Br 62a_100010125443_100011233839 [0,0,0,0,0,0|3,0,0]=3 6 B21R2.1523891 COc1ccc(cc1OC)CSc2c[nH]c(=O)c(c2)F 62a_100000723523_100011233839 [0,0,0,0,0,0|3,0,0]=3 7 B21R2.1523891 COc1ccc(cc1OC)CSc2c[nH]c(=O)c(n2)C 62a_100010363809_100011233839 [0,0,0,0,0,0|4,0,0]=4 8 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)Br)C 62a_100012356354_100011233839 [0,0,0,0,0,0|4,0,0]=4 9 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)C)C 62a_100009850809_100011233839 [0,0,0,0,0,0|4,0,0]=4 10 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)C)F 62a_100009841206_100011233839 [0,0,0,0,0,0|4,0,0]=4 11 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)C)N 62a_100000126663_100011233839 [0,0,0,0,0,0|4,0,0]=4 12 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)C)O 62a_100000704368_100011233839 [0,0,0,0,0,0|3,0,0]=3 13 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)F)C 62a_100009818257_100011233839 [0,0,0,0,0,0|4,0,0]=4 14 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)F)N 62a_100000126464_100011233839 [0,0,0,0,0,0|4,0,0]=4 15 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)F)O 62a_100009854642_100011233839 [0,0,0,0,0,0|3,0,0]=3 16 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)N)C 62a_100000067204_100011233839 [0,0,0,0,0,0|4,0,0]=4 17 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)N)N 62a_100000067514_100011233839 [0,0,0,0,0,0|4,0,0]=4 18 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(cn2)O)N 62a_100009819941_100011233839 [0,0,0,0,0,0|3,0,1]=4 19 B21R2.1523891 COc1ccc(cc1OC)CSc2cc(c(nn2)N)C 62a_100153394926_100011233839 [0,0,0,0,0,0|3,0,1]=4 20 B21R2.1523891 COc1ccc(cc1OC)CSc2ccc(c(c2)O)Br 62a_100012356990_100011233839 [0,0,0,0,0,0|4,0,0]=4 21 B21R2.1523891 COc1ccc(cc1OC)CSc2ccc(c(c2)O)C 62a_100000685420_100011233839 [0,0,0,0,0,0|4,0,0]=4 22 B21R2.1523891 COc1ccc(cc1OC)CSc2ccc(c(c2)O)Cl 62a_100011356854_100011233839 [0,0,0,0,0,0|4,0,0]=4 23 B21R2.1523891 COc1ccc(cc1OC)CSc2ccc(c(c2)O)F 62a_100000686035_100011233839 [0,0,0,0,0,0|4,0,0]=4 24 B21R2.1523891 COc1ccc(cc1OC)CSc2ccc(c(c2)O)N 62a_100000739049_100011233839 [0,0,0,0,0,0|4,0,0]=4 25 B21R2.1523891 COc1ccc(cc1OC)CSc2cn(c(=O)cn2)C 62a_100009843036_100011233839 [0,0,0,0,0,0|4,0,0]=4 26 B21R2.1523891 COc1ccc(cc1OC)CSc2cnc(c(c2)O)C 62a_100009864810_100011233839 [0,0,0,0,0,0|3,0,1]=4 27 B21R2.1523891 COc1ccc(cc1OC)CSc2cnc(c(c2)O)F 62a_100009819871_100011233839 [0,0,0,0,0,0|3,0,1]=4 28 B21R2.1523891 COc1ccc(cc1OC)CSc2cnc(c(c2)O)N 62a_100009819042_100011233839 [0,0,0,0,0,0|3,0,1]=4 29 B21R2.1523891 COc1ccc(cc1OC)NCc2c[nH]c(=O)c(c2)Cl 207a_100000187404_100000051075 [0,0,0,0,0,0|3,0,0]=3 30 B21R2.1523891 COc1ccc(cc1OC)NCc2c[nH]c(=O)c(c2)Cl 270302a_100000187404_100000051075 [0,0,0,0,0,0|3,0,0]=3 31 B21R2.1523891 COc1ccc(cc1OC)NCc2cc(c(cn2)Br)C 207a_100000187404_100009814806 [0,0,0,0,0,0|4,0,0]=4 32 B21R2.1523891 COc1ccc(cc1OC)NCc2cc(c(cn2)C)Br 207a_100000187404_100010174032 [0,0,0,0,0,0|4,0,0]=4 33 B20R2.31062 COc1cc(ccc1Br)CSc2c[nH]c(=O)c(c2)O 62a_100010110085_100009814561 [1,0,0,0,0,0|3,0,0]=4 34 B20R2.31062 COc1cc(ccc1Br)CSc2cc(c(=O)[nH]n2)C 62a_100010110085_100012187101 [1,0,0,0,0,0|3,0,0]=4 35 B20R2.31062 COc1cc(ccc1Br)CSc2cc(c(=O)[nH]n2)N 62a_100010110085_100000102183 [1,0,0,0,0,0|3,0,0]=4 36 B20R2.31062 COc1cc(ccc1C)NCc2c[nH]c(=O)c(c2)Cl 207a_100011279678_100000051075 [1,0,0,0,0,0|3,0,0]=4 37 B20R2.31062 COc1cc(ccc1C)NCc2c[nH]c(=O)c(c2)Cl 270302a_100011279678_100000051075 [1,0,0,0,0,0|3,0,0]=4 38 B20R2.31062 COc1cc(ccc1Cl)CSc2c[nH]c(=O)c(c2)O 62a_200010214485_100009814561 [1,0,0,0,0,0|3,0,0]=4 39 B20R2.31062 COc1cc(ccc1Cl)CSc2cc(c(=O)[nH]n2)C 62a_200010214485_100012187101 [1,0,0,0,0,0|3,0,0]=4 40 B20R2.31062 COc1cc(ccc1Cl)CSc2cc(c(=O)[nH]n2)N 62a_200010214485_100000102183 [1,0,0,0,0,0|3,0,0]=4 41 B20R2.31062 COc1cc(ccc1F)CSc2c[nH]c(=O)c(c2)O 62a_100012349856_100009814561 [1,0,0,0,0,0|3,0,0]=4 42 B20R2.31062 COc1cc(ccc1F)CSc2cc(c(=O)[nH]n2)C 62a_100012349856_100012187101 [1,0,0,0,0,0|3,0,0]=4 43 B20R2.31062 COc1cc(ccc1F)CSc2cc(c(=O)[nH]n2)N 62a_100012349856_100000102183 [1,0,0,0,0,0|3,0,0]=4 44 B20R2.31062 COc1cc(ccc1O)NCc2c[nH]c(=O)c(c2)Cl 270302a_100000726020_100000051075 [1,0,0,0,0,0|3,0,0]=4 45 B20R2.41136 COc1cc(ccc1C#N)NCc2ccc(=O)[nH]n2 207a_100011999456_100011361533 [1,0,0,0,0,0|3,0,0]=4 46 B20R2.41136 COc1cc(ccc1CO)NCc2ccc(=O)[nH]n2 207a_100012183141_100011361533 [1,0,0,0,0,0|3,0,0]=4 47 B20R2.41136 COc1ccc(cc1C#N)NCc2ccc(=O)[nH]n2 207a_100011204338_100011361533 [1,0,0,0,0,0|3,0,0]=4 48 B20R2.41136 COc1ccc(cc1OC)CNc2ccc(cn2)Br 27a_100000185555_100000686858 [1,0,0,0,0,0|3,0,0]=4 49 B20R2.41136 COc1ccc(cc1OC)CNc2ccc(nn2)C 27a_100000185555_100000744512 [1,0,0,0,0,0|2,0,1]=4 50 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(=O)[nH]c2 62a_100000212171_100011233839 [1,0,0,0,0,0|2,0,0]=3 51 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(=O)[nH]n2 62a_100009820020_100011233839 [1,0,0,0,0,0|1,0,0]=2 52 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(cn2)Br 62a_100000686858_100011233839 [1,0,0,0,0,0|3,0,0]=4 53 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(cn2)C 62a_100011192072_100011233839 [1,0,0,0,0,0|3,0,0]=4 54 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(cn2)Cl 62a_100011356976_100011233839 [1,0,0,0,0,0|3,0,0]=4 55 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(cn2)F 62a_100000744514_100011233839 [1,0,0,0,0,0|3,0,0]=4 56 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(cn2)N 62a_100000737798_100011233839 [1,0,0,0,0,0|3,0,0]=4 57 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(cn2)O 62a_100000685995_100011233839 [1,0,0,0,0,0|2,0,1]=4 58 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(nn2)C 62a_100000744512_100011233839 [1,0,0,0,0,0|2,0,1]=4 59 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(nn2)Cl 62a_100000068654_100011233839 [1,0,0,0,0,0|2,0,1]=4 60 B20R2.41136 COc1ccc(cc1OC)CSc2ccc(nn2)N 62a_100010219413_100011233839 [1,0,0,0,0,0|2,0,1]=4 61 B20R2.41136 COc1ccc(cc1OC)CSc2cnc(=O)[nH]c2 62a_102495366499_100011233839 [1,0,0,0,0,0|3,0,0]=4 62 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(=O)[nH]n2 207a_100000187404_100011361533 [1,0,0,0,0,0|1,0,0]=2 63 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(cn2)Br 207a_100000187404_100000754260 [1,0,0,0,0,0|3,0,0]=4 64 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(cn2)Br 270302a_100000187404_100000754260 [1,0,0,0,0,0|3,0,0]=4 65 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(cn2)Br 34a_100000187404_100000702658 [1,0,0,0,0,0|3,0,0]=4 66 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(cn2)C 207a_100000187404_100000050478 [1,0,0,0,0,0|3,0,0]=4 67 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(cn2)C 34a_100000187404_100000691093 [1,0,0,0,0,0|3,0,0]=4 68 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(cn2)Cl 207a_100000187404_100011361569 [1,0,0,0,0,0|3,0,0]=4 69 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(cn2)Cl 270302a_100000187404_100011361569 [1,0,0,0,0,0|3,0,0]=4 70 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(cn2)Cl 34a_100000187404_100012066911 [1,0,0,0,0,0|3,0,0]=4 71 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(cn2)F 207a_100000187404_100011934744 [1,0,0,0,0,0|3,0,0]=4 72 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(cn2)F 34a_100000187404_100000703193 [1,0,0,0,0,0|3,0,0]=4 73 B20R2.41136 COc1ccc(cc1OC)NCc2ccc(nn2)Cl 34a_100000187404_100016992710 [1,0,0,0,0,0|2,0,1]=4 74 B20R2.41136 COc1ccc(cc1OC)OCc2ccc(cn2)Br 34a_100000039706_100000702658 [1,0,0,0,0,0|3,0,0]=4 75 B20R2.41136 COc1ccc(cc1OC)OCc2ccc(cn2)C 34a_100000039706_100000691093 [1,0,0,0,0,0|3,0,0]=4 76 B20R2.41136 COc1ccc(cc1OC)OCc2ccc(cn2)Cl 34a_100000039706_100012066911 [1,0,0,0,0,0|3,0,0]=4 77 B20R2.41136 COc1ccc(cc1OC)OCc2ccc(cn2)F 34a_100000039706_100000703193 [1,0,0,0,0,0|3,0,0]=4 78 B20R2.41136 COc1ccc(cc1OC)OCc2ccc(nn2)Cl 34a_100000039706_100016992710 [1,0,0,0,0,0|2,0,1]=4 79 B20R2.41136 COc1ccc(cc1OC)SCc2ccc(cn2)Br 62a_100000702658_100011356967 [1,0,0,0,0,0|3,0,0]=4 80 B20R2.41136 COc1ccc(cc1OC)SCc2ccc(cn2)C 62a_100000691093_100011356967 [1,0,0,0,0,0|3,0,0]=4 81 B20R2.41136 COc1ccc(cc1OC)SCc2ccc(cn2)Cl 62a_100012066911_100011356967 [1,0,0,0,0,0|3,0,0]=4 82 B20R2.41136 COc1ccc(cc1OC)SCc2ccc(cn2)F 62a_100000703193_100011356967 [1,0,0,0,0,0|3,0,0]=4 83 B20R2.41136 COc1ccc(cc1OC)SCc2ccc(nn2)Cl 62a_100016992710_100011356967 [1,0,0,0,0,0|2,0,1]=4 84 B20R2.284515 COc1ccc(cc1OC)CNc2cc(ccn2)F 27a_100000185555_100000764206 [1,0,0,0,0,0|3,0,0]=4 85 B20R2.284515 COc1ccc(cc1OC)CNc2cc(cnn2)C 27a_100000185555_100000070100 [1,0,0,0,0,0|2,0,1]=4 86 B20R2.284515 COc1ccc(cc1OC)CNc2cc(ncn2)O 27a_100000185555_100000765262 [1,0,0,0,0,0|3,0,0]=4 87 B20R2.284515 COc1ccc(cc1OC)CNc2cccc(c2)O 270302a_100000210217_100000170513 [1,0,0,0,0,0|3,0,0]=4 88 B20R2.284515 COc1ccc(cc1OC)CNc2nccc(n2)O 27a_100000185555_100011649813 [1,0,0,0,0,0|3,0,0]=4 89 B20R2.284515 COc1ccc(cc1OC)CSc2cc(ccn2)C 62a_100000750283_100011233839 [1,0,0,0,0,0|3,0,0]=4 90 B20R2.284515 COc1ccc(cc1OC)CSc2cc(ccn2)Cl 62a_100010167805_100011233839 [1,0,0,0,0,0|3,0,0]=4 91 B20R2.284515 COc1ccc(cc1OC)CSc2cc(ccn2)F 62a_100000764206_100011233839 [1,0,0,0,0,0|3,0,0]=4 92 B20R2.284515 COc1ccc(cc1OC)CSc2cc(ccn2)N 62a_100009814236_100011233839 [1,0,0,0,0,0|3,0,0]=4 93 B20R2.284515 COc1ccc(cc1OC)CSc2cc(cnn2)C 62a_100000070100_100011233839 [1,0,0,0,0,0|2,0,1]=4 94 B20R2.284515 COc1ccc(cc1OC)CSc2cc(cnn2)N 62a_100011996757_100011233839 [1,0,0,0,0,0|2,0,1]=4 95 B20R2.284515 COc1ccc(cc1OC)CSc2cncc(c2)O 62a_100000754920_100011233839 [1,0,0,0,0,0|2,0,1]=4 96 B20R2.284515 COc1ccc(cc1OC)NCc2cc(ccn2)Br 34a_100000187404_100010173614 [1,0,0,0,0,0|3,0,0]=4 97 B20R2.284515 COc1ccc(cc1OC)NCc2cc(ccn2)C 207a_100000187404_100011361488 [1,0,0,0,0,0|3,0,0]=4 98 B20R2.284515 COc1ccc(cc1OC)NCc2cc(ccn2)C 34a_100000187404_100000718516 [1,0,0,0,0,0|3,0,0]=4 99 B20R2.284515 COc1ccc(cc1OC)NCc2cc(ccn2)Cl 34a_100000187404_100016988179 [1,0,0,0,0,0|3,0,0]=4 100 B20R2.284515 COc1ccc(cc1OC)NCc2cccc(c2)O 207a_100000187404_100000188321 [1,0,0,0,0,0|3,0,0]=4 101 B20R2.284515 COc1ccc(cc1OC)NCc2cccc(c2)O 34a_100000187404_100011660834 [1,0,0,0,0,0|3,0,0]=4 102 B20R2.284515 COc1ccc(cc1OC)NCc2cncc(c2)O 207a_100000187404_100012187055 [1,0,0,0,0,0|2,0,1]=4 103 B20R2.284515 COc1ccc(cc1OC)OCc2cc(ccn2)Br 34a_100000039706_100010173614 [1,0,0,0,0,0|3,0,0]=4 104 B20R2.284515 COc1ccc(cc1OC)OCc2cc(ccn2)C 34a_100000039706_100000718516 [1,0,0,0,0,0|3,0,0]=4 105 B20R2.284515 COc1ccc(cc1OC)OCc2cc(ccn2)Cl 34a_100000039706_100016988179 [1,0,0,0,0,0|3,0,0]=4 106 B20R2.284515 COc1ccc(cc1OC)OCc2cccc(c2)O 34a_100000039706_100011660834 [1,0,0,0,0,0|3,0,0]=4 107 B20R2.284515 COc1ccc(cc1OC)SCc2cc(ccn2)Br 62a_100010173614_100011356967 [1,0,0,0,0,0|3,0,0]=4 108 B20R2.284515 COc1ccc(cc1OC)SCc2cc(ccn2)C 62a_100000718516_100011356967 [1,0,0,0,0,0|3,0,0]=4 109 B20R2.284515 COc1ccc(cc1OC)SCc2cc(ccn2)Cl 62a_100016988179_100011356967 [1,0,0,0,0,0|3,0,0]=4 110 B20R2.284515 COc1ccc(cc1OC)SCc2cccc(c2)O 62a_100011660834_100011356967 [1,0,0,0,0,0|3,0,0]=4 111 B20R2.2387065 COc1ccc(cc1Br)CSc2c[nH]c(=O)c(c2)O 62a_200011397701_100009814561 [1,0,0,0,0,0|3,0,0]=4 112 B20R2.2387065 COc1ccc(cc1Br)CSc2cc(c(=O)[nH]n2)C 62a_200011397701_100012187101 [1,0,0,0,0,0|3,0,0]=4 113 B20R2.2387065 COc1ccc(cc1Br)CSc2cc(c(=O)[nH]n2)N 62a_200011397701_100000102183 [1,0,0,0,0,0|3,0,0]=4 114 B20R2.2387065 COc1ccc(cc1C)CSc2c[nH]c(=O)c(c2)Br 62a_100010125443_200011290836 [1,0,0,0,0,0|3,0,0]=4 115 B20R2.2387065 COc1ccc(cc1C)CSc2c[nH]c(=O)c(c2)Br 62a_200011290836_100010125443 [1,0,0,0,0,0|3,0,0]=4 116 B20R2.2387065 COc1ccc(cc1C)CSc2c[nH]c(=O)c(c2)F 62a_100000723523_200011290836 [1,0,0,0,0,0|3,0,0]=4 117 B20R2.2387065 COc1ccc(cc1C)CSc2c[nH]c(=O)c(c2)F 62a_200011290836_100000723523 [1,0,0,0,0,0|3,0,0]=4 118 B20R2.2387065 COc1ccc(cc1C)CSc2c[nH]c(=O)c(c2)O 62a_200011290836_100009814561 [1,0,0,0,0,0|2,0,0]=3 119 B20R2.2387065 COc1ccc(cc1C)CSc2cc(c(=O)[nH]n2)C 62a_200011290836_100012187101 [1,0,0,0,0,0|2,0,0]=3 120 B20R2.2387065 COc1ccc(cc1C)CSc2cc(c(=O)[nH]n2)N 62a_200011290836_100000102183 [1,0,0,0,0,0|2,0,0]=3 121 B20R2.2387065 COc1ccc(cc1C)CSc2cc(c(cn2)C)O 62a_100000704368_200011290836 [1,0,0,0,0,0|3,0,0]=4 122 B20R2.2387065 COc1ccc(cc1C)CSc2cc(c(cn2)C)O 62a_200011290836_100000704368 [1,0,0,0,0,0|3,0,0]=4 123 B20R2.2387065 COc1ccc(cc1C)CSc2cc(c(cn2)F)O 62a_100009854642_200011290836 [1,0,0,0,0,0|3,0,0]=4 124 B20R2.2387065 COc1ccc(cc1C)CSc2cc(c(cn2)F)O 62a_200011290836_100009854642 [1,0,0,0,0,0|3,0,0]=4 125 B20R2.2387065 COc1ccc(cc1C)NCc2c[nH]c(=O)c(c2)Cl 207a_100000743268_100000051075 [1,0,0,0,0,0|3,0,0]=4 126 B20R2.2387065 COc1ccc(cc1C)NCc2c[nH]c(=O)c(c2)Cl 270302a_100000743268_100000051075 [1,0,0,0,0,0|3,0,0]=4 127 B20R2.2387065 COc1ccc(cc1Cl)CSc2c[nH]c(=O)c(c2)O 62a_100000693707_100009814561 [1,0,0,0,0,0|3,0,0]=4 128 B20R2.2387065 COc1ccc(cc1Cl)CSc2cc(c(=O)[nH]n2)C 62a_100000693707_100012187101 [1,0,0,0,0,0|3,0,0]=4 129 B20R2.2387065 COc1ccc(cc1Cl)CSc2cc(c(=O)[nH]n2)N 62a_100000693707_100000102183 [1,0,0,0,0,0|3,0,0]=4 130 B20R2.2387065 COc1ccc(cc1F)CSc2c[nH]c(=O)c(c2)O 62a_100000189595_100009814561 [1,0,0,0,0,0|3,0,0]=4 131 B20R2.2387065 COc1ccc(cc1F)CSc2cc(c(=O)[nH]n2)C 62a_100000189595_100012187101 [1,0,0,0,0,0|3,0,0]=4 132 B20R2.2387065 COc1ccc(cc1F)CSc2cc(c(=O)[nH]n2)N 62a_100000189595_100000102183 [1,0,0,0,0,0|3,0,0]=4 133 B20R2.2387065 COc1ccc(cc1O)NCc2c[nH]c(=O)c(c2)Cl 270302a_100000211920_100000051075 [1,0,0,0,0,0|3,0,0]=4 134 B22R2.1033717 COc1cc(c(cc1OC)CSc2c[nH]c(=O)c(c2)Br)Br 62a_100011375086_100010125443 [0,1,0,0,0,0|3,0,0]=4 135 B22R2.1033717 COc1cc(c(cc1OC)CSc2c[nH]c(=O)c(c2)F)Br 62a_100011375086_100000723523 [0,1,0,0,0,0|3,0,0]=4 136 B22R2.1033717 COc1cc(c(cc1OC)CSc2c[nH]c(=O)c(c2)O)Br 62a_100011375086_100009814561 [0,1,0,0,0,0|2,0,0]=3 137 B22R2.1033717 COc1cc(c(cc1OC)CSc2cc(c(=O)[nH]n2)C)Br 62a_100011375086_100012187101 [0,1,0,0,0,0|2,0,0]=3 138 B22R2.1033717 COc1cc(c(cc1OC)CSc2cc(c(=O)[nH]n2)N)Br 62a_100011375086_100000102183 [0,1,0,0,0,0|2,0,0]=3 139 B22R2.1033717 COc1cc(c(cc1OC)CSc2cc(c(cn2)C)O)Br 62a_100011375086_100000704368 [0,1,0,0,0,0|3,0,0]=4 140 B22R2.1033717 COc1cc(c(cc1OC)CSc2cc(c(cn2)F)O)Br 62a_100011375086_100009854642 [0,1,0,0,0,0|3,0,0]=4 141 B22R2.1033717 COc1cc(c(cc1OC)NCc2c[nH]c(=O)c(c2)Cl)C 207a_100000183460_100000051075 [0,1,0,0,0,0|3,0,0]=4 142 B22R2.1033717 COc1cc(c(cc1OC)NCc2c[nH]c(=O)c(c2)Cl)C 270302a_100000183460_100000051075 [0,1,0,0,0,0|3,0,0]=4 143 B22R2.1033717 COc1cc(c(cc1OC)NCc2c[nH]c(=O)c(c2)Cl)F 207a_100000753170_100000051075 [0,1,0,0,0,0|3,0,0]=4 144 B22R2.1033717 COc1cc(c(cc1OC)NCc2c[nH]c(=O)c(c2)Cl)F 270302a_100000753170_100000051075 [0,1,0,0,0,0|3,0,0]=4 145 B22R2.1136440 COc1ccc(cc1OC)CSc2c[nH]c(=O)c(c2C)N 62a_100010163742_100011233839 [0,1,0,0,0,0|3,0,0]=4 146 B22R2.1136441 COc1cc(ncc1C)SCc2ccc(c(c2)OC)OC 62a_100010067687_100011233839 [0,1,0,0,0,0|3,0,0]=4 147 B22R2.1136441 COc1cc(ncc1F)SCc2ccc(c(c2)OC)OC 62a_200010136270_100011233839 [0,1,0,0,0,0|3,0,0]=4 148 B22R2.1136441 COc1cc(ncc1N)SCc2ccc(c(c2)OC)OC 62a_100009887741_100011233839 [0,1,0,0,0,0|3,0,0]=4 149 B22R2.1136441 COc1ccc(cc1OC)CSc2cc(c(cn2)F)CO 62a_100000081974_100011233839 [0,1,0,0,0,0|3,0,0]=4 150 B22R2.1136441 COc1ccc(cc1OC)CSc2cc(c(nn2)N)OC 62a_100000688033_100011233839 [0,1,0,0,0,0|2,0,1]=4 151 B22R2.1732797 COc1ccc(c(c1OC)Cl)CSc2c[nH]c(=O)c(c2)Br 62a_100010125443_100011890039 [0,1,0,0,0,0|3,0,0]=4 152 B22R2.1732797 COc1ccc(c(c1OC)Cl)CSc2c[nH]c(=O)c(c2)F 62a_100000723523_100011890039 [0,1,0,0,0,0|3,0,0]=4 153 B22R2.1732797 COc1ccc(c(c1OC)Cl)CSc2cc(c(cn2)C)O 62a_100000704368_100011890039 [0,1,0,0,0,0|3,0,0]=4 154 B22R2.1732797 COc1ccc(c(c1OC)Cl)CSc2cc(c(cn2)F)O 62a_100009854642_100011890039 [0,1,0,0,0,0|3,0,0]=4 155 B22R2.4987898 CCOc1ccc(cc1OC)NCc2c[nH]c(=O)c(c2)Cl 207a_100000184985_100000051075 [0,1,0,0,0,0|3,0,0]=4 156 B22R2.4987898 CCOc1ccc(cc1OC)NCc2c[nH]c(=O)c(c2)Cl 270302a_100000184985_100000051075 [0,1,0,0,0,0|3,0,0]=4 157 B22R2.11813219 COc1ccc(cc1OC)CSc2cc(c(=O)n(c2)C)C 62a_100011830242_100011233839 [0,1,0,0,0,0|3,0,0]=4 158 B22R2.11813219 COc1ccc(cc1OC)CSc2cc(c(=O)n(c2)C)F 62a_100010749421_100011233839 [0,1,0,0,0,0|3,0,0]=4 159 B22R2.11813219 COc1ccc(cc1OC)CSc2cc(c(=O)n(c2)C)N 62a_106446545582_100011233839 [0,1,0,0,0,0|3,0,0]=4 160 B22R2.11813219 COc1ccc(cc1OC)CSc2cc(c(=O)n(n2)C)C 62a_100010988966_100011233839 [0,1,0,0,0,0|2,0,0]=3 161 B22R2.14490022 COc1ccc(cc1OC)CSc2cc(c(=O)[nH]c2C)N 62a_100010126670_100011233839 [0,1,0,0,0,0|3,0,0]=4 162 B22R2.14494528 COc1ccc(cc1OC)CSc2cc(c(cn2)C=O)C 62a_100000085382_100011233839 [0,1,0,0,0,0|3,0,0]=4 163 B22R2.14494528 COc1ccc(cc1OC)CSc2cc(c(cn2)C=O)N 62a_100000050503_100011233839 [0,1,0,0,0,0|3,0,0]=4 164 B22R2.14494528 COc1ccc(cc1OC)CSc2ccc(c(c2)O)C=O 62a_100011277552_100011233839 [0,1,0,0,0,0|3,0,0]=4 165 B20R1.727812 C=CC(=O)NCC(=O)CCc1ccc(c(c1)OC)OC 1458a_200011222540_100011740610 [0,0,1,0,0,0|3,0,0]=4 166 B22R3.1010764 O=c1[nH]cc(cc1Cl)CNc2ccc3c(c2)OCCO3 207a_100020630400_100000051075 [0,0,0,1,0,0|3,0,0]=4 167 B22R3.1010764 O=c1[nH]cc(cc1Cl)CNc2ccc3c(c2)OCCO3 270302a_100020630400_100000051075 [0,0,0,1,0,0|3,0,0]=4 168 B20R2.2258033 COc1ccc(cc1OC)CSc2n[nH]c(c2C)C 62a_100015309786_100011233839 [0,0,0,0,1,0|3,0,0]=4 169 B20R2.2258033 COc1ccc(cc1OC)SCc2n[nH]c(=O)n2C 62a_100010408635_100011356967 [0,0,0,0,1,0|3,0,0]=4 170 B20R2.2386826 CCc1cc(ccc1OC)Sc2c[nH]c(=O)c(c2)O 62a_200010179862_100009814561 [0,0,0,0,1,0|3,0,0]=4 171 B20R2.2386826 CCc1cc(ccc1OC)Sc2cc(c(=O)[nH]n2)C 62a_200010179862_100012187101 [0,0,0,0,1,0|3,0,0]=4 172 B20R2.2386826 CCc1cc(ccc1OC)Sc2cc(c(=O)[nH]n2)N 62a_200010179862_100000102183 [0,0,0,0,1,0|3,0,0]=4 173 B20R2.2386826 CCc1ccc(cc1OC)Sc2c[nH]c(=O)c(c2)O 62a_200010710398_100009814561 [0,0,0,0,1,0|3,0,0]=4 174 B20R2.2386826 CCc1ccc(cc1OC)Sc2cc(c(=O)[nH]n2)C 62a_200010710398_100012187101 [0,0,0,0,1,0|3,0,0]=4 175 B20R2.2386826 CCc1ccc(cc1OC)Sc2cc(c(=O)[nH]n2)N 62a_200010710398_100000102183 [0,0,0,0,1,0|3,0,0]=4 176 B20R2.2386826 COc1cc(ccc1SC)Sc2c[nH]c(=O)c(c2)O 62a_200011001119_100009814561 [0,0,0,0,1,0|2,1,0]=4 177 B20R2.2386826 COc1cc(ccc1SC)Sc2cc(c(=O)[nH]n2)C 62a_200011001119_100012187101 [0,0,0,0,1,0|2,1,0]=4 178 B20R2.2386826 COc1cc(ccc1SC)Sc2cc(c(=O)[nH]n2)N 62a_200011001119_100000102183 [0,0,0,0,1,0|2,1,0]=4 179 B20R2.2386826 COc1ccc(cc1OC)Sc2c[nH]c(=O)c(c2)Br 62a_100010125443_100011356967 [0,0,0,0,1,0|3,0,0]=4 180 B20R2.2386826 COc1ccc(cc1OC)Sc2c[nH]c(=O)c(c2)F 62a_100000723523_100011356967 [0,0,0,0,1,0|3,0,0]=4 181 B20R2.2386826 COc1ccc(cc1OC)Sc2cc(c(cn2)C)O 62a_100000704368_100011356967 [0,0,0,0,1,0|3,0,0]=4 182 B20R2.2386826 COc1ccc(cc1OC)Sc2cc(c(cn2)F)O 62a_100009854642_100011356967 [0,0,0,0,1,0|3,0,0]=4 183 B20R2.2386826 COc1ccc(cc1SC)Sc2c[nH]c(=O)c(c2)O 62a_200009892704_100009814561 [0,0,0,0,1,0|2,1,0]=4 184 B20R2.2386826 COc1ccc(cc1SC)Sc2cc(c(=O)[nH]n2)C 62a_200009892704_100012187101 [0,0,0,0,1,0|2,1,0]=4 185 B20R2.2386826 COc1ccc(cc1SC)Sc2cc(c(=O)[nH]n2)N 62a_200009892704_100000102183 [0,0,0,0,1,0|2,1,0]=4 186 B22R2.1136400 COc1ccc(cc1OC)CCNc2cc(c(cn2)C)F 27a_100000210947_100009841206 [0,0,0,0,0,1|3,0,0]=4 187 B22R2.1136400 COc1ccc(cc1OC)CCNc2ccc(c(c2)O)C 34a_100000759471_100011273988 [0,0,0,0,0,1|3,0,0]=4 188 B22R2.1136400 COc1ccc(cc1OC)CCNc2ccc(c(c2)O)C 7a_100000759471_100011740610 [0,0,0,0,0,1|3,0,0]=4 189 B22R2.1136400 COc1ccc(cc1OC)CCNc2ccc(c(c2)O)Cl 34a_100011934209_100011273988 [0,0,0,0,0,1|3,0,0]=4 190 B22R2.1136400 COc1ccc(cc1OC)CCNc2ccc(c(c2)O)F 34a_100012017398_100011273988 [0,0,0,0,0,1|3,0,0]=4 191 B22R2.1136400 COc1ccc(cc1OC)CCNc2ccc(c(c2)O)F 7a_100012017398_100011740610 [0,0,0,0,0,1|3,0,0]=4 192 B22R2.1136400 COc1ccc(cc1OC)CCNc2ccc(c(c2)O)O 34a_100102946323_100011273988 [0,0,0,0,0,1|2,0,1]=4 193 B22R2.1136400 COc1ccc(cc1OC)CCNc2ncc(c(n2)O)F 27a_100000210947_100011995740 [0,0,0,0,0,1|3,0,0]=4 194 B22R2.1136400 COc1ccc(cc1OC)CCOc2cc(c(cn2)Br)C 34a_100000766222_100011273988 [0,0,0,0,0,1|3,0,0]=4 195 B22R2.1136400 COc1ccc(cc1OC)CCOc2cc(c(cn2)Br)Cl 34a_100010369989_100011273988 [0,0,0,0,0,1|3,0,0]=4 196 B22R2.1136400 COc1ccc(cc1OC)CCOc2cc(c(cn2)C)Br 34a_100009831917_100011273988 [0,0,0,0,0,1|3,0,0]=4 197 B22R2.1136400 COc1ccc(cc1OC)CCOc2cc(c(cn2)Cl)C 34a_200000085746_100011273988 [0,0,0,0,0,1|3,0,0]=4 198 B22R2.1136400 COc1ccc(cc1OC)CCOc2cc(c(cn2)Cl)Cl 34a_200000099200_100011273988 [0,0,0,0,0,1|3,0,0]=4 199 B22R2.1136400 COc1ccc(cc1OC)CCSc2c[nH]c(=O)c(c2)Br 62a_100010125443_100011740610 [0,0,0,0,0,1|2,0,0]=3 200 B22R2.1136400 COc1ccc(cc1OC)CCSc2c[nH]c(=O)c(c2)F 62a_100000723523_100011740610 [0,0,0,0,0,1|2,0,0]=3 201 B22R2.1136400 COc1ccc(cc1OC)CCSc2c[nH]c(=O)c(n2)C 62a_100010363809_100011740610 [0,0,0,0,0,1|3,0,0]=4 202 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)Br)C 62a_100012356354_100011740610 [0,0,0,0,0,1|3,0,0]=4 203 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)C)C 62a_100009850809_100011740610 [0,0,0,0,0,1|3,0,0]=4 204 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)C)F 62a_100009841206_100011740610 [0,0,0,0,0,1|3,0,0]=4 205 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)C)N 62a_100000126663_100011740610 [0,0,0,0,0,1|3,0,0]=4 206 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)C)O 62a_100000704368_100011740610 [0,0,0,0,0,1|2,0,0]=3 207 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)F)C 62a_100009818257_100011740610 [0,0,0,0,0,1|3,0,0]=4 208 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)F)N 62a_100000126464_100011740610 [0,0,0,0,0,1|3,0,0]=4 209 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)F)O 62a_100009854642_100011740610 [0,0,0,0,0,1|2,0,0]=3 210 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)N)C 62a_100000067204_100011740610 [0,0,0,0,0,1|3,0,0]=4 211 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)N)N 62a_100000067514_100011740610 [0,0,0,0,0,1|3,0,0]=4 212 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(cn2)O)N 62a_100009819941_100011740610 [0,0,0,0,0,1|2,0,1]=4 213 B22R2.1136400 COc1ccc(cc1OC)CCSc2cc(c(nn2)N)C 62a_100153394926_100011740610 [0,0,0,0,0,1|2,0,1]=4 214 B22R2.1136400 COc1ccc(cc1OC)CCSc2ccc(c(c2)O)Br 62a_100012356990_100011740610 [0,0,0,0,0,1|3,0,0]=4 215 B22R2.1136400 COc1ccc(cc1OC)CCSc2ccc(c(c2)O)C 62a_100000685420_100011740610 [0,0,0,0,0,1|3,0,0]=4 216 B22R2.1136400 COc1ccc(cc1OC)CCSc2ccc(c(c2)O)Cl 62a_100011356854_100011740610 [0,0,0,0,0,1|3,0,0]=4 217 B22R2.1136400 COc1ccc(cc1OC)CCSc2ccc(c(c2)O)F 62a_100000686035_100011740610 [0,0,0,0,0,1|3,0,0]=4 218 B22R2.1136400 COc1ccc(cc1OC)CCSc2ccc(c(c2)O)N 62a_100000739049_100011740610 [0,0,0,0,0,1|3,0,0]=4 219 B22R2.1136400 COc1ccc(cc1OC)CCSc2cn(c(=O)cn2)C 62a_100009843036_100011740610 [0,0,0,0,0,1|3,0,0]=4 220 B22R2.1136400 COc1ccc(cc1OC)CCSc2cnc(c(c2)O)C 62a_100009864810_100011740610 [0,0,0,0,0,1|2,0,1]=4 221 B22R2.1136400 COc1ccc(cc1OC)CCSc2cnc(c(c2)O)F 62a_100009819871_100011740610 [0,0,0,0,0,1|2,0,1]=4 222 B22R2.1136400 COc1ccc(cc1OC)CCSc2cnc(c(c2)O)N 62a_100009819042_100011740610 [0,0,0,0,0,1|2,0,1]=4 223 B22R2.1136400 COc1ccc(cc1OC)CNCc2c[nH]c(=O)c(c2)Cl 207a_100000185555_100000051075 [0,0,0,0,0,1|2,0,0]=3 224 B22R2.1136400 COc1ccc(cc1OC)CNCc2c[nH]c(=O)c(c2)Cl 270004a_100000185555_100000051075 [0,0,0,0,0,1|2,0,0]=3 225 B22R2.1136400 COc1ccc(cc1OC)CNCc2cc(c(cn2)Br)C 207a_100000185555_100009814806 [0,0,0,0,0,1|3,0,0]=4 226 B22R2.1136400 COc1ccc(cc1OC)CNCc2cc(c(cn2)Br)C 270004a_100000185555_100009814806 [0,0,0,0,0,1|3,0,0]=4 227 B22R2.1136400 COc1ccc(cc1OC)CNCc2cc(c(cn2)C)Br 207a_100000185555_100010174032 [0,0,0,0,0,1|3,0,0]=4 228 B22R2.1136400 COc1ccc(cc1OC)CNCc2cc(c(cn2)C)Br 270004a_100000185555_100010174032 [0,0,0,0,0,1|3,0,0]=4 229 B22R2.1136400 COc1ccc(cc1OC)CNCc2ccc(c(c2)O)F 207a_100160469508_100000170513 [0,0,0,0,0,1|3,0,0]=4 230 B22R2.1136400 COc1ccc(cc1OC)CNCc2ccc(c(c2)O)F 270004a_100160469508_100000170513 [0,0,0,0,0,1|3,0,0]=4 231 B19R1.108462 COc1ccc(cc1O)CCC=NNC(=O)C(=O)N 4a_100000211141_100000105502 [1,0,1,0,0,0|1,0,1]=4 232 B19R2.2847 COc1cc(ccc1Br)CSc2ccc(=O)[nH]n2 62a_100009820020_100010110085 [2,0,0,0,0,0|2,0,0]=4 233 B19R2.2847 COc1cc(ccc1Br)CSc2ccc(=O)[nH]n2 62a_100010110085_100009820020 [2,0,0,0,0,0|2,0,0]=4 234 B19R2.2847 COc1cc(ccc1Br)NCc2ccc(=O)[nH]n2 207a_100000765947_100011361533 [2,0,0,0,0,0|2,0,0]=4 235 B19R2.2847 COc1cc(ccc1C)NCc2ccc(=O)[nH]n2 207a_100011279678_100011361533 [2,0,0,0,0,0|1,0,0]=3 236 B19R2.2847 COc1cc(ccc1Cl)CSc2ccc(=O)[nH]n2 62a_100009820020_200010214485 [2,0,0,0,0,0|2,0,0]=4 237 B19R2.2847 COc1cc(ccc1Cl)CSc2ccc(=O)[nH]n2 62a_200010214485_100009820020 [2,0,0,0,0,0|2,0,0]=4 238 B19R2.2847 COc1cc(ccc1Cl)NCc2ccc(=O)[nH]n2 207a_100000742311_100011361533 [2,0,0,0,0,0|2,0,0]=4 239 B19R2.2847 COc1cc(ccc1F)CSc2ccc(=O)[nH]n2 62a_100009820020_100012349856 [2,0,0,0,0,0|2,0,0]=4 240 B19R2.2847 COc1cc(ccc1F)CSc2ccc(=O)[nH]n2 62a_100012349856_100009820020 [2,0,0,0,0,0|2,0,0]=4 241 B19R2.2847 COc1cc(ccc1F)NCc2ccc(=O)[nH]n2 207a_100000701188_100011361533 [2,0,0,0,0,0|2,0,0]=4 242 B19R2.2847 COc1cc(ccc1I)NCc2ccc(=O)[nH]n2 207a_100000746945_100011361533 [2,0,0,0,0,0|2,0,0]=4 243 B19R2.149413 Cc1ccc(cc1C)CSc2c[nH]c(=O)c(c2)O 62a_100000742320_100009814561 [2,0,0,0,0,0|2,0,0]=4 244 B19R2.149413 Cc1ccc(cc1C)CSc2cc(c(=O)[nH]n2)C 62a_100000742320_100012187101 [2,0,0,0,0,0|2,0,0]=4 245 B19R2.149413 Cc1ccc(cc1C)CSc2cc(c(=O)[nH]n2)N 62a_100000742320_100000102183 [2,0,0,0,0,0|2,0,0]=4 246 B19R2.191497 COc1cccc(c1)CSc2c[nH]c(=O)c(c2)O 62a_100000688526_100009814561 [2,0,0,0,0,0|2,0,0]=4 247 B19R2.191497 COc1cccc(c1)CSc2cc(c(=O)[nH]n2)C 62a_100000688526_100012187101 [2,0,0,0,0,0|2,0,0]=4 248 B19R2.191497 COc1cccc(c1)CSc2cc(c(=O)[nH]n2)N 62a_100000688526_100000102183 [2,0,0,0,0,0|2,0,0]=4 249 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(=O)[nH]n2 62a_100009820020_200011397701 [2,0,0,0,0,0|2,0,0]=4 250 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(=O)[nH]n2 62a_200011397701_100009820020 [2,0,0,0,0,0|2,0,0]=4 251 B19R2.2679 COc1ccc(cc1Br)NCc2ccc(=O)[nH]n2 207a_100000187427_100011361533 [2,0,0,0,0,0|2,0,0]=4 252 B19R2.2679 COc1ccc(cc1C)COc2ccc(=O)[nH]c2 34a_100000075641_200011290836 [2,0,0,0,0,0|2,0,0]=4 253 B19R2.2679 COc1ccc(cc1C)CSc2ccc(=O)[nH]c2 62a_100000212171_200011290836 [2,0,0,0,0,0|2,0,0]=4 254 B19R2.2679 COc1ccc(cc1C)CSc2ccc(=O)[nH]c2 62a_200011290836_100000212171 [2,0,0,0,0,0|2,0,0]=4 255 B19R2.2679 COc1ccc(cc1C)CSc2ccc(=O)[nH]n2 62a_100009820020_200011290836 [2,0,0,0,0,0|1,0,0]=3 256 B19R2.2679 COc1ccc(cc1C)CSc2ccc(=O)[nH]n2 62a_200011290836_100009820020 [2,0,0,0,0,0|1,0,0]=3 257 B19R2.2679 COc1ccc(cc1C)NCc2ccc(=O)[nH]n2 207a_100000743268_100011361533 [2,0,0,0,0,0|1,0,0]=3 258 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(=O)[nH]n2 62a_100000693707_100009820020 [2,0,0,0,0,0|2,0,0]=4 259 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(=O)[nH]n2 62a_100009820020_100000693707 [2,0,0,0,0,0|2,0,0]=4 260 B19R2.2679 COc1ccc(cc1Cl)NCc2ccc(=O)[nH]n2 207a_100000211044_100011361533 [2,0,0,0,0,0|2,0,0]=4 261 B19R2.2679 COc1ccc(cc1F)CSc2ccc(=O)[nH]n2 62a_100000189595_100009820020 [2,0,0,0,0,0|2,0,0]=4 262 B19R2.2679 COc1ccc(cc1F)CSc2ccc(=O)[nH]n2 62a_100009820020_100000189595 [2,0,0,0,0,0|2,0,0]=4 263 B19R2.2679 COc1ccc(cc1F)NCc2ccc(=O)[nH]n2 207a_100000740183_100011361533 [2,0,0,0,0,0|2,0,0]=4 264 B19R2.2679 COc1ccc(cc1I)NCc2ccc(=O)[nH]n2 207a_100011356947_100011361533 [2,0,0,0,0,0|2,0,0]=4 265 B19R2.28183 COc1ccc(cc1OC)CNc2cccnn2 27a_100000185555_100016991348 [2,0,0,0,0,0|1,0,1]=4 266 B19R2.28183 COc1ccc(cc1OC)CSc2ccccn2 62a_100011216584_100011233839 [2,0,0,0,0,0|2,0,0]=4 267 B19R2.28183 COc1ccc(cc1OC)CSc2cccnn2 62a_100016991348_100011233839 [2,0,0,0,0,0|1,0,1]=4 268 B19R2.28183 COc1ccc(cc1OC)NCc2ccccn2 207a_100000187404_100000209966 [2,0,0,0,0,0|2,0,0]=4 269 B19R2.28183 COc1ccc(cc1OC)NCc2ccccn2 270302a_100000187404_100000209966 [2,0,0,0,0,0|2,0,0]=4 270 B19R2.28183 COc1ccc(cc1OC)NCc2ccccn2 34a_100000187404_100000721315 [2,0,0,0,0,0|2,0,0]=4 271 B19R2.28183 COc1ccc(cc1OC)NCc2cccnn2 34a_100000187404_100016990269 [2,0,0,0,0,0|1,0,1]=4 272 B19R2.28183 COc1ccc(cc1OC)OCc2ccccn2 34a_100000039706_100000721315 [2,0,0,0,0,0|2,0,0]=4 273 B19R2.28183 COc1ccc(cc1OC)OCc2cccnn2 34a_100000039706_100016990269 [2,0,0,0,0,0|1,0,1]=4 274 B19R2.28183 COc1ccc(cc1OC)SCc2ccccn2 62a_100000721315_100011356967 [2,0,0,0,0,0|2,0,0]=4 275 B19R2.28183 COc1ccc(cc1OC)SCc2cccnn2 62a_100016990269_100011356967 [2,0,0,0,0,0|1,0,1]=4 276 B19R2.28207 COc1ccc(cc1C)CSc2cc(ccn2)O 62a_200011290836_100000762945 [2,0,0,0,0,0|2,0,0]=4 277 B19R2.28207 COc1ccc(cc1C)CSc2cc(cnn2)O 62a_200011290836_200010734679 [2,0,0,0,0,0|1,0,1]=4 278 B21R2.125966 COc1ccc(cc1OC)CSc2ccc(cn2)C=O 62a_100000766901_100011233839 [1,1,0,0,0,0|2,0,0]=4 279 B21R2.125966 COc1ccc(cc1OC)CSc2ccc(nn2)C=O 62a_100000044651_100011233839 [1,1,0,0,0,0|1,0,1]=4 280 B21R2.274566 CCOc1ccc(cc1OC)NCc2ccc(=O)[nH]n2 207a_100000184985_100011361533 [1,1,0,0,0,0|1,0,0]=3 281 B21R2.432873 COc1ccc(cc1C(C)C)NCc2ccc(=O)[nH]n2 207a_100025764739_100011361533 [1,1,0,0,0,0|2,0,0]=4 282 B21R2.444573 COc1ccc(c(c1OC)Cl)CSc2ccc(=O)[nH]c2 62a_100000212171_100011890039 [1,1,0,0,0,0|2,0,0]=4 283 B21R2.444573 COc1ccc(c(c1OC)Cl)CSc2ccc(=O)[nH]n2 62a_100009820020_100011890039 [1,1,0,0,0,0|1,0,0]=3 284 B21R2.465170 COc1cc(c(cc1OC)COc2ccc(=O)[nH]c2)Br 34a_100000075641_100011375086 [1,1,0,0,0,0|2,0,0]=4 285 B21R2.465170 COc1cc(c(cc1OC)CSc2ccc(=O)[nH]c2)Br 62a_100011375086_100000212171 [1,1,0,0,0,0|2,0,0]=4 286 B21R2.465170 COc1cc(c(cc1OC)CSc2ccc(=O)[nH]n2)Br 62a_100011375086_100009820020 [1,1,0,0,0,0|1,0,0]=3 287 B21R2.465170 COc1cc(c(cc1OC)NCc2ccc(=O)[nH]n2)C 207a_100000183460_100011361533 [1,1,0,0,0,0|1,0,0]=3 288 B21R2.465170 COc1cc(c(cc1OC)NCc2ccc(=O)[nH]n2)F 207a_100000753170_100011361533 [1,1,0,0,0,0|1,0,0]=3 289 B21R2.1523882 COc1ccc(cc1OC)CNc2n[nH]c(=O)[nH]c2=O 27a_100000185555_100000181694 [1,1,0,0,0,0|2,0,0]=4 290 B21R2.1523882 COc1ccc(cc1OC)CSc2c[nH]c(=O)cc2F 62a_100015631685_100011233839 [1,1,0,0,0,0|2,0,0]=4 291 B21R2.1523882 COc1ccc(cc1OC)CSc2ccc(=O)[nH]c2N 62a_100009884077_100011233839 [1,1,0,0,0,0|2,0,0]=4 292 B21R2.1441841 COc1cc(c(cc1OC)CSc2cc(ccn2)O)Br 62a_100011375086_100000762945 [1,1,0,0,0,0|2,0,0]=4 293 B21R2.1441841 COc1cc(c(cc1OC)CSc2cc(cnn2)O)Br 62a_100011375086_200010734679 [1,1,0,0,0,0|1,0,1]=4 294 B21R2.1523895 COc1ccc(cc1OC)CSc2nccc(c2F)O 62a_100009876375_100011233839 [1,1,0,0,0,0|2,0,0]=4 295 B21R2.1789036 COc1ccc(cc1OC)CSc2cc(ccn2)CO 62a_100009814636_100011233839 [1,1,0,0,0,0|2,0,0]=4 296 B21R2.1789036 COc1ccnc(c1)CNc2ccc(c(c2)OC)OC 207a_100000187404_100000087537 [1,1,0,0,0,0|2,0,0]=4 297 B21R2.1789036 COc1ccnc(c1)CNc2ccc(c(c2)OC)OC 34a_100000187404_100000752681 [1,1,0,0,0,0|2,0,0]=4 298 B21R2.1789036 COc1ccnc(c1)COc2ccc(c(c2)OC)OC 34a_100000039706_100000752681 [1,1,0,0,0,0|2,0,0]=4 299 B21R2.1789036 COc1ccnc(c1)CSc2ccc(c(c2)OC)OC 62a_100000752681_100011356967 [1,1,0,0,0,0|2,0,0]=4 300 B21R2.1789036 COc1ccnc(c1)SCc2ccc(c(c2)OC)OC 62a_100009817693_100011233839 [1,1,0,0,0,0|2,0,0]=4 301 B21R2.7727630 COc1ccc(cc1C)CSc2cc(c(=O)n(n2)C)C 62a_100010988966_200011290836 [1,1,0,0,0,0|2,0,0]=4 302 B21R2.7727630 COc1ccc(cc1C)CSc2cc(c(=O)n(n2)C)C 62a_200011290836_100010988966 [1,1,0,0,0,0|2,0,0]=4 303 B21R2.261819 COCc1cc(ccc1OC)Sc2c[nH]c(=O)c(c2)O 62a_200011493686_100009814561 [0,1,0,0,1,0|2,0,0]=4 304 B21R2.261819 COCc1cc(ccc1OC)Sc2cc(c(=O)[nH]n2)C 62a_200011493686_100012187101 [0,1,0,0,1,0|2,0,0]=4 305 B21R2.261819 COCc1cc(ccc1OC)Sc2cc(c(=O)[nH]n2)N 62a_200011493686_100000102183 [0,1,0,0,1,0|2,0,0]=4 306 B21R2.465175 COc1cc(c(cc1OC)Sc2c[nH]c(=O)c(c2)O)F 62a_200011765842_100009814561 [0,1,0,0,1,0|2,0,0]=4 307 B21R2.465175 COc1cc(c(cc1OC)Sc2cc(c(=O)[nH]n2)C)F 62a_200011765842_100012187101 [0,1,0,0,1,0|2,0,0]=4 308 B21R2.465175 COc1cc(c(cc1OC)Sc2cc(c(=O)[nH]n2)N)F 62a_200011765842_100000102183 [0,1,0,0,1,0|2,0,0]=4 309 B21R2.7724978 COc1ccc(cc1OC)Sc2cc(c(=O)n(n2)C)C 62a_100010988966_100011356967 [0,1,0,0,1,0|2,0,0]=4 310 B23R2.409256 COc1cc(cc(c1OC)Br)CNCc2c[nH]c(=O)c(c2)Cl 207a_100000748475_100000051075 [0,1,0,0,0,1|2,0,0]=4 311 B23R2.409256 COc1cc(cc(c1OC)Br)CNCc2c[nH]c(=O)c(c2)Cl 270004a_100000748475_100000051075 [0,1,0,0,0,1|2,0,0]=4 312 B23R2.1353298 COc1ccc(c(c1OC)Cl)CNCc2c[nH]c(=O)c(c2)Cl 207a_102515433231_100000051075 [0,1,0,0,0,1|2,0,0]=4 313 B23R2.1353298 COc1ccc(c(c1OC)Cl)CNCc2c[nH]c(=O)c(c2)Cl 270004a_102515433231_100000051075 [0,1,0,0,0,1|2,0,0]=4 314 B23R2.3159020 COc1ccc(cc1OC)CN(C)Cc2c[nH]c(=O)c(c2)Cl 270004a_100000180827_100000051075 [0,1,0,0,0,1|2,0,0]=4 315 B23R2.3159246 COc1ccc(cc1OC)C(=O)CSc2c[nH]c(=O)c(c2)O 62a_100000184214_100009814561 [0,1,0,0,0,1|1,0,1]=4 316 B23R2.3159246 COc1ccc(cc1OC)C(=O)CSc2cc(c(=O)[nH]n2)C 62a_100000184214_100012187101 [0,1,0,0,0,1|1,0,1]=4 317 B23R2.3159246 COc1ccc(cc1OC)C(=O)CSc2cc(c(=O)[nH]n2)N 62a_100000184214_100000102183 [0,1,0,0,0,1|1,0,1]=4 318 B23R2.3159246 COc1ccc(cc1OC)[C@@H](C)NCc2c[nH]c(=O)c(c2)Cl 207a_100025717294_100000051075 [0,1,0,0,0,1|2,0,0]=4 319 B23R2.3159246 COc1ccc(cc1OC)[C@@H](C)NCc2c[nH]c(=O)c(c2)Cl 270004a_100025717294_100000051075 [0,1,0,0,0,1|2,0,0]=4 320 B23R2.6605857 CCOc1ccc(cc1OC)CNCc2c[nH]c(=O)c(c2)Cl 207a_200000739100_100000051075 [0,1,0,0,0,1|2,0,0]=4 321 B23R2.6605857 CCOc1ccc(cc1OC)CNCc2c[nH]c(=O)c(c2)Cl 270004a_200000739100_100000051075 [0,1,0,0,0,1|2,0,0]=4 322 B23R2.7536029 CCOc1cc(ccc1OC)CNCc2c[nH]c(=O)c(c2)Cl 207a_100000755831_100000051075 [0,1,0,0,0,1|2,0,0]=4 323 B23R2.7536029 CCOc1cc(ccc1OC)CNCc2c[nH]c(=O)c(c2)Cl 270004a_100000755831_100000051075 [0,1,0,0,0,1|2,0,0]=4 324 B23R2.13578889 COc1cc(c(cc1OC)CNCc2c[nH]c(=O)c(c2)Cl)F 207a_100132302102_100000051075 [0,1,0,0,0,1|2,0,0]=4 325 B23R2.13578889 COc1cc(c(cc1OC)CNCc2c[nH]c(=O)c(c2)Cl)F 270004a_100132302102_100000051075 [0,1,0,0,0,1|2,0,0]=4 326 B23R2.13696677 COc1ccc(cc1OC)CCSc2c[nH]c(=O)c(c2C)N 62a_100010163742_100011740610 [0,1,0,0,0,1|2,0,0]=4 327 B23R2.13696678 COc1cc(ncc1C)SCCc2ccc(c(c2)OC)OC 62a_100010067687_100011740610 [0,1,0,0,0,1|2,0,0]=4 328 B23R2.13696678 COc1cc(ncc1F)SCCc2ccc(c(c2)OC)OC 62a_200010136270_100011740610 [0,1,0,0,0,1|2,0,0]=4 329 B23R2.13696678 COc1cc(ncc1N)SCCc2ccc(c(c2)OC)OC 62a_100009887741_100011740610 [0,1,0,0,0,1|2,0,0]=4 330 B23R2.13696678 COc1ccc(cc1OC)CCSc2cc(c(cn2)F)CO 62a_100000081974_100011740610 [0,1,0,0,0,1|2,0,0]=4 331 B23R2.13696678 COc1ccc(cc1OC)CCSc2cc(c(nn2)N)OC 62a_100000688033_100011740610 [0,1,0,0,0,1|1,0,1]=4 332 B23R2.17888252 COc1ccc(cc1OC)CCSc2cc(c(=O)n(c2)C)C 62a_100011830242_100011740610 [0,1,0,0,0,1|2,0,0]=4 333 B23R2.17888252 COc1ccc(cc1OC)CCSc2cc(c(=O)n(c2)C)F 62a_100010749421_100011740610 [0,1,0,0,0,1|2,0,0]=4 334 B23R2.17888252 COc1ccc(cc1OC)CCSc2cc(c(=O)n(c2)C)N 62a_106446545582_100011740610 [0,1,0,0,0,1|2,0,0]=4 335 B23R2.17888252 COc1ccc(cc1OC)CCSc2cc(c(=O)n(n2)C)C 62a_100010988966_100011740610 [0,1,0,0,0,1|1,0,0]=3 336 B23R2.22684696 COc1ccc(cc1OC)CCSc2cc(c(cn2)C=O)C 62a_100000085382_100011740610 [0,1,0,0,0,1|2,0,0]=4 337 B23R2.22684696 COc1ccc(cc1OC)CCSc2cc(c(cn2)C=O)N 62a_100000050503_100011740610 [0,1,0,0,0,1|2,0,0]=4 338 B23R2.22684696 COc1ccc(cc1OC)CCSc2ccc(c(c2)O)C=O 62a_100011277552_100011740610 [0,1,0,0,0,1|2,0,0]=4 339 B23R2.91926919 COc1ccc(cc1OC)CCSc2cc(c(=O)[nH]c2C)N 62a_100010126670_100011740610 [0,1,0,0,0,1|2,0,0]=4 340 B23R2.90311679 COc1cc(c(cc1OC)CSc2c[nH]c(=O)c(c2)OC)Br 62a_100011375086_100010125397 [0,2,0,0,0,0|2,0,0]=4 341 B23R2.96307975 COc1cc(c(cc1OC)CSc2cc(c(=O)n(n2)C)C)Br 62a_100011375086_100010988966 [0,2,0,0,0,0|2,0,0]=4 342 B23R2.91927005 COc1cc(ncc1C=O)SCc2ccc(c(c2)OC)OC 62a_100009846838_100011233839 [0,2,0,0,0,0|2,0,0]=4 343 B23R2.353949814 COc1ccc(c(c1OC)Cl)CSc2cc(c(=O)n(n2)C)C 62a_100010988966_100011890039 [0,2,0,0,0,0|2,0,0]=4 344 B23R2.3380226 COC(=O)c1ccc(cc1OC)CSc2c[nH]c(=O)c(c2)O 62a_100000695403_100009814561 [0,2,0,0,0,0|2,0,0]=4 345 B23R2.3380226 COC(=O)c1ccc(cc1OC)CSc2cc(c(=O)[nH]n2)C 62a_100000695403_100012187101 [0,2,0,0,0,0|2,0,0]=4 346 B23R2.3380226 COC(=O)c1ccc(cc1OC)CSc2cc(c(=O)[nH]n2)N 62a_100000695403_100000102183 [0,2,0,0,0,0|2,0,0]=4 347 B23R2.3378116 COc1cc(ccc1OC(F)F)CSc2c[nH]c(=O)c(c2)O 62a_100000195516_100009814561 [0,2,0,0,0,0|2,0,0]=4 348 B23R2.3378116 COc1cc(ccc1OC(F)F)CSc2cc(c(=O)[nH]n2)C 62a_100000195516_100012187101 [0,2,0,0,0,0|2,0,0]=4 349 B23R2.3378116 COc1cc(ccc1OC(F)F)CSc2cc(c(=O)[nH]n2)N 62a_100000195516_100000102183 [0,2,0,0,0,0|2,0,0]=4 350 B21R2.2477479 COc1ccc(cc1OC)CCn2cc(nn2)C(=O)N 274090a_100011273988_100011470575 [0,0,1,1,0,0|2,0,0]=4 351 B21R2.2477479 COc1ccc(cc1OC)CSc2cc(on2)C(=O)N 62a_100010589868_100011233839 [0,0,1,1,0,0|1,0,0]=3 352 B21R2.2477479 COc1ccc(cc1OC)CSc2coc(c2)C(=O)N 62a_200009817131_100011233839 [0,0,1,1,0,0|2,0,0]=4 353 B21R2.1458169 COc1cc2c(cc1OC)C(=NNC(=O)C(=O)N)CC2 4a_100000211141_100000694011 [0,0,1,1,0,0|1,0,1]=4 354 B21R3.30927 O=c1ccc(n[nH]1)CNc2ccc3c(c2)CCCO3 207a_100138412508_100011361533 [1,0,0,1,0,0|2,0,0]=4 355 B21R3.30927 O=c1ccc(n[nH]1)CNc2ccc3c(c2)OCCO3 207a_100020630400_100011361533 [1,0,0,1,0,0|1,0,0]=3 356 B21R3.29979 Cc1cc(n[nH]c1=O)Sc2ccc3c(c2)OCCO3 62a_100011216881_100012187101 [0,0,0,1,1,0|2,0,0]=4 357 B21R3.29979 Nc1cc(n[nH]c1=O)Sc2ccc3c(c2)OCCO3 62a_100011216881_100000102183 [0,0,0,1,1,0|2,0,0]=4 358 B21R3.29979 O=c1[nH]cc(cc1O)Sc2ccc3c(c2)OCCO3 62a_100011216881_100009814561 [0,0,0,1,1,0|2,0,0]=4 359 B23R3.1300129 O=c1[nH]cc(cc1Cl)CNCc2ccc3c(c2)OCCO3 207a_100000684186_100000051075 [0,0,0,1,0,1|2,0,0]=4 360 B23R3.1300129 O=c1[nH]cc(cc1Cl)CNCc2ccc3c(c2)OCCO3 270004a_100000684186_100000051075 [0,0,0,1,0,1|2,0,0]=4 361 B23R3.1300217 Cc1cc(n[nH]c1=O)SCc2ccc3c(c2)OCCCO3 62a_100000742768_100012187101 [0,1,0,1,0,0|2,0,0]=4 362 B23R3.1300217 Nc1cc(n[nH]c1=O)SCc2ccc3c(c2)OCCCO3 62a_100000742768_100000102183 [0,1,0,1,0,0|2,0,0]=4 363 B23R3.1300217 O=c1[nH]cc(cc1O)SCc2ccc3c(c2)OCCCO3 62a_100000742768_100009814561 [0,1,0,1,0,0|2,0,0]=4 364 B19R2.22022 COc1cc(ccc1C)Sc2c[nH]c(=O)c(c2)O 62a_100011830276_100009814561 [1,0,0,0,1,0|2,0,0]=4 365 B19R2.22022 COc1cc(ccc1C)Sc2cc(c(=O)[nH]n2)C 62a_100011830276_100012187101 [1,0,0,0,1,0|2,0,0]=4 366 B19R2.22022 COc1cc(ccc1C)Sc2cc(c(=O)[nH]n2)N 62a_100011830276_100000102183 [1,0,0,0,1,0|2,0,0]=4 367 B19R2.2675 CCc1cc(ccc1OC)Sc2ccc(=O)[nH]n2 62a_100009820020_200010179862 [1,0,0,0,1,0|2,0,0]=4 368 B19R2.2675 CCc1cc(ccc1OC)Sc2ccc(=O)[nH]n2 62a_200010179862_100009820020 [1,0,0,0,1,0|2,0,0]=4 369 B19R2.2675 CCc1ccc(cc1OC)Sc2ccc(=O)[nH]n2 62a_100009820020_200010710398 [1,0,0,0,1,0|2,0,0]=4 370 B19R2.2675 CCc1ccc(cc1OC)Sc2ccc(=O)[nH]n2 62a_200010710398_100009820020 [1,0,0,0,1,0|2,0,0]=4 371 B19R2.2675 COc1cc(ccc1SC)Sc2ccc(=O)[nH]n2 62a_200011001119_100009820020 [1,0,0,0,1,0|1,1,0]=4 372 B19R2.2675 COc1cc(cnc1OC)Sc2ccc(=O)[nH]n2 62a_100009820020_100010234541 [1,0,0,0,1,0|2,0,0]=4 373 B19R2.2675 COc1ccc(cc1OC)Sc2ccc(=O)[nH]c2 62a_100000212171_100011356967 [1,0,0,0,1,0|2,0,0]=4 374 B19R2.2675 COc1ccc(cc1OC)Sc2ccc(=O)[nH]n2 62a_100009820020_100011356967 [1,0,0,0,1,0|1,0,0]=3 375 B19R2.2675 COc1ccc(cc1SC)Sc2ccc(=O)[nH]n2 62a_200009892704_100009820020 [1,0,0,0,1,0|1,1,0]=4 376 B19R2.2675 COc1ccc(nc1OC)Sc2ccc(=O)[nH]n2 62a_100009820020_100010214848 [1,0,0,0,1,0|2,0,0]=4 377 B19R2.179604 COc1ccc(cc1OC)CSc2cc([nH]n2)C 62a_100009819999_100011233839 [1,0,0,0,1,0|2,0,0]=4 378 B19R2.179604 COc1ccc(cc1OC)CSc2cc([nH]n2)N 62a_100009822546_100011233839 [1,0,0,0,1,0|2,0,0]=4 379 B19R2.18903 COc1ccc(cc1OC)CSc2n[nH]cc2Br 62a_100015839836_100011233839 [1,0,0,0,1,0|2,0,0]=4 380 B19R2.18903 COc1ccc(cc1OC)CSc2n[nH]cc2C 62a_100009871783_100011233839 [1,0,0,0,1,0|2,0,0]=4 381 B19R2.18903 COc1ccc(cc1OC)CSc2n[nH]cc2N 62a_100010894806_100011233839 [1,0,0,0,1,0|2,0,0]=4 382 B19R2.18903 COc1ccc(cc1OC)NCc2n[nH]cc2Cl 207a_100000187404_100000040271 [1,0,0,0,1,0|2,0,0]=4 383 B19R2.18951 COc1ccc(cc1C)Sc2c[nH]c(=O)c(c2)O 62a_100011219705_100009814561 [1,0,0,0,1,0|2,0,0]=4 384 B19R2.18951 COc1ccc(cc1C)Sc2cc(c(=O)[nH]n2)C 62a_100011219705_100012187101 [1,0,0,0,1,0|2,0,0]=4 385 B19R2.18951 COc1ccc(cc1C)Sc2cc(c(=O)[nH]n2)N 62a_100011219705_100000102183 [1,0,0,0,1,0|2,0,0]=4 386 B19R2.18913 COc1cc(cnc1OC)c2c[nH]c(=O)c(c2)O 271570a_100010246160_100009814561 [0,0,0,0,2,0|2,0,0]=4 387 B19R2.18913 COc1cc(cnc1OC)c2cc(c(=O)[nH]n2)C 271570a_100010246160_100012187101 [0,0,0,0,2,0|2,0,0]=4 388 B19R2.18913 COc1cc(cnc1OC)c2cc(c(=O)[nH]n2)N 271570a_100010246160_100000102183 [0,0,0,0,2,0|2,0,0]=4 389 B19R2.18913 COc1ccc(cc1OC)c2c[nH]c(=O)c(c2)Br 271570a_100000743868_100010125443 [0,0,0,0,2,0|2,0,0]=4 390 B19R2.18913 COc1ccc(cc1OC)c2c[nH]c(=O)c(c2)F 271570a_100000743868_100000723523 [0,0,0,0,2,0|2,0,0]=4 391 B19R2.18913 COc1ccc(cc1OC)c2c[nH]c(=O)c(c2)O 271570a_100000743868_100009814561 [0,0,0,0,2,0|1,0,0]=3 392 B19R2.18913 COc1ccc(cc1OC)c2cc(c(=O)[nH]n2)C 271570a_100000743868_100012187101 [0,0,0,0,2,0|1,0,0]=3 393 B19R2.18913 COc1ccc(cc1OC)c2cc(c(=O)[nH]n2)N 271570a_100000743868_100000102183 [0,0,0,0,2,0|1,0,0]=3 394 B19R2.18913 COc1ccc(cc1OC)c2cc(c(cn2)C)O 271570a_100000743868_100000704368 [0,0,0,0,2,0|2,0,0]=4 395 B19R2.18913 COc1ccc(cc1OC)c2cc(c(cn2)F)O 271570a_100000743868_100009854642 [0,0,0,0,2,0|2,0,0]=4 396 B21R2.432861 COc1ccc(cc1OC)CCNc2ccc(cn2)Br 27a_100000210947_100000686858 [1,0,0,0,0,1|2,0,0]=4 397 B21R2.432861 COc1ccc(cc1OC)CCNc2ccc(nn2)C 27a_100000210947_100000744512 [1,0,0,0,0,1|1,0,1]=4 398 B21R2.432861 COc1ccc(cc1OC)CCOc2ccc(=O)[nH]c2 34a_100000075641_100011273988 [1,0,0,0,0,1|1,0,0]=3 399 B21R2.432861 COc1ccc(cc1OC)CCOc2ccc(cn2)C 34a_100000759353_100011273988 [1,0,0,0,0,1|2,0,0]=4 400 B21R2.432861 COc1ccc(cc1OC)CCOc2ccc(cn2)Cl 34a_100011215309_100011273988 [1,0,0,0,0,1|2,0,0]=4 401 B21R2.432861 COc1ccc(cc1OC)CCOc2ccc(cn2)F 34a_100000742473_100011273988 [1,0,0,0,0,1|2,0,0]=4 402 B21R2.432861 COc1ccc(cc1OC)CCOc2ccc(cn2)N 34a_100000729260_100011273988 [1,0,0,0,0,1|2,0,0]=4 403 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(=O)[nH]c2 62a_100000212171_100011740610 [1,0,0,0,0,1|1,0,0]=3 404 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(=O)[nH]n2 62a_100009820020_100011740610 [1,0,0,0,0,1|0,0,0]=2 405 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(cn2)Br 62a_100000686858_100011740610 [1,0,0,0,0,1|2,0,0]=4 406 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(cn2)C 62a_100011192072_100011740610 [1,0,0,0,0,1|2,0,0]=4 407 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(cn2)Cl 62a_100011356976_100011740610 [1,0,0,0,0,1|2,0,0]=4 408 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(cn2)F 62a_100000744514_100011740610 [1,0,0,0,0,1|2,0,0]=4 409 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(cn2)N 62a_100000737798_100011740610 [1,0,0,0,0,1|2,0,0]=4 410 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(cn2)O 62a_100000685995_100011740610 [1,0,0,0,0,1|1,0,1]=4 411 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(nn2)C 62a_100000744512_100011740610 [1,0,0,0,0,1|1,0,1]=4 412 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(nn2)Cl 62a_100000068654_100011740610 [1,0,0,0,0,1|1,0,1]=4 413 B21R2.432861 COc1ccc(cc1OC)CCSc2ccc(nn2)N 62a_100010219413_100011740610 [1,0,0,0,0,1|1,0,1]=4 414 B21R2.432861 COc1ccc(cc1OC)CCSc2cnc(=O)[nH]c2 62a_102495366499_100011740610 [1,0,0,0,0,1|2,0,0]=4 415 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(=O)[nH]n2 207a_100000185555_100011361533 [1,0,0,0,0,1|0,0,0]=2 416 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(=O)[nH]n2 270004a_100000185555_100011361533 [1,0,0,0,0,1|0,0,0]=2 417 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)Br 207a_100000185555_100000754260 [1,0,0,0,0,1|2,0,0]=4 418 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)Br 270004a_100000185555_100000754260 [1,0,0,0,0,1|2,0,0]=4 419 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)Br 34a_100000185555_100000702658 [1,0,0,0,0,1|2,0,0]=4 420 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)C 207a_100000185555_100000050478 [1,0,0,0,0,1|2,0,0]=4 421 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)C 270004a_100000185555_100000050478 [1,0,0,0,0,1|2,0,0]=4 422 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)C 34a_100000185555_100000691093 [1,0,0,0,0,1|2,0,0]=4 423 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)Cl 207a_100000185555_100011361569 [1,0,0,0,0,1|2,0,0]=4 424 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)Cl 270004a_100000185555_100011361569 [1,0,0,0,0,1|2,0,0]=4 425 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)Cl 270004a_100000697193_100000170513 [1,0,0,0,0,1|2,0,0]=4 426 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)Cl 34a_100000185555_100012066911 [1,0,0,0,0,1|2,0,0]=4 427 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)F 207a_100000185555_100011934744 [1,0,0,0,0,1|2,0,0]=4 428 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)F 270004a_100000185555_100011934744 [1,0,0,0,0,1|2,0,0]=4 429 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(cn2)F 34a_100000185555_100000703193 [1,0,0,0,0,1|2,0,0]=4 430 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(nn2)Cl 270004a_100000185555_100000044651 [1,0,0,0,0,1|1,0,1]=4 431 B21R2.432861 COc1ccc(cc1OC)CNCc2ccc(nn2)Cl 34a_100000185555_100016992710 [1,0,0,0,0,1|1,0,1]=4 432 B21R2.432861 COc1ccc(cc1OC)COCc2ccc(cn2)Br 34a_100000210929_100000702658 [1,0,0,0,0,1|2,0,0]=4 433 B21R2.432861 COc1ccc(cc1OC)COCc2ccc(cn2)C 34a_100000210929_100000691093 [1,0,0,0,0,1|2,0,0]=4 434 B21R2.432861 COc1ccc(cc1OC)COCc2ccc(cn2)Cl 34a_100000210929_100012066911 [1,0,0,0,0,1|2,0,0]=4 435 B21R2.432861 COc1ccc(cc1OC)COCc2ccc(cn2)F 34a_100000210929_100000703193 [1,0,0,0,0,1|2,0,0]=4 436 B21R2.432861 COc1ccc(cc1OC)COCc2ccc(nn2)Cl 34a_100000210929_100016992710 [1,0,0,0,0,1|1,0,1]=4 437 B21R2.432861 COc1ccc(cc1OC)CSCc2ccc(cn2)Br 62a_100000702658_100011233839 [1,0,0,0,0,1|2,0,0]=4 438 B21R2.432861 COc1ccc(cc1OC)CSCc2ccc(cn2)C 62a_100000691093_100011233839 [1,0,0,0,0,1|2,0,0]=4 439 B21R2.432861 COc1ccc(cc1OC)CSCc2ccc(cn2)Cl 62a_100012066911_100011233839 [1,0,0,0,0,1|2,0,0]=4 440 B21R2.432861 COc1ccc(cc1OC)CSCc2ccc(cn2)F 62a_100000703193_100011233839 [1,0,0,0,0,1|2,0,0]=4 441 B21R2.432861 COc1ccc(cc1OC)CSCc2ccc(nn2)Cl 62a_100016992710_100011233839 [1,0,0,0,0,1|1,0,1]=4 442 B21R2.432861 COc1ccc(cc1OC)NN=Cc2ccc(=O)[nH]n2 4a_100000071703_100011361533 [1,0,0,0,0,1|1,0,1]=4 443 B21R2.432854 COc1ccc(cc1OC)CCNc2cc(ccn2)F 27a_100000210947_100000764206 [1,0,0,0,0,1|2,0,0]=4 444 B21R2.432854 COc1ccc(cc1OC)CCNc2cc(cnn2)C 27a_100000210947_100000070100 [1,0,0,0,0,1|1,0,1]=4 445 B21R2.432854 COc1ccc(cc1OC)CCNc2cc(ncn2)O 27a_100000210947_100000765262 [1,0,0,0,0,1|2,0,0]=4 446 B21R2.432854 COc1ccc(cc1OC)CCNc2cccc(c2)O 34a_100000210217_100011273988 [1,0,0,0,0,1|2,0,0]=4 447 B21R2.432854 COc1ccc(cc1OC)CCNc2nccc(n2)O 27a_100000210947_100011649813 [1,0,0,0,0,1|2,0,0]=4 448 B21R2.432854 COc1ccc(cc1OC)CCOc2cc(cnn2)C 34a_100000766097_100011273988 [1,0,0,0,0,1|1,0,1]=4 449 B21R2.432854 COc1ccc(cc1OC)CCSc2cc(ccn2)C 62a_100000750283_100011740610 [1,0,0,0,0,1|2,0,0]=4 450 B21R2.432854 COc1ccc(cc1OC)CCSc2cc(ccn2)Cl 62a_100010167805_100011740610 [1,0,0,0,0,1|2,0,0]=4 451 B21R2.432854 COc1ccc(cc1OC)CCSc2cc(ccn2)F 62a_100000764206_100011740610 [1,0,0,0,0,1|2,0,0]=4 452 B21R2.432854 COc1ccc(cc1OC)CCSc2cc(ccn2)N 62a_100009814236_100011740610 [1,0,0,0,0,1|2,0,0]=4 453 B21R2.432854 COc1ccc(cc1OC)CCSc2cc(cnn2)C 62a_100000070100_100011740610 [1,0,0,0,0,1|1,0,1]=4 454 B21R2.432854 COc1ccc(cc1OC)CCSc2cc(cnn2)N 62a_100011996757_100011740610 [1,0,0,0,0,1|1,0,1]=4 455 B21R2.432854 COc1ccc(cc1OC)CCSc2cncc(c2)O 62a_100000754920_100011740610 [1,0,0,0,0,1|1,0,1]=4 456 B21R2.432854 COc1ccc(cc1OC)CNCc2cc(ccn2)Br 270004a_100000185555_100009818557 [1,0,0,0,0,1|2,0,0]=4 457 B21R2.432854 COc1ccc(cc1OC)CNCc2cc(ccn2)Br 34a_100000185555_100010173614 [1,0,0,0,0,1|2,0,0]=4 458 B21R2.432854 COc1ccc(cc1OC)CNCc2cc(ccn2)C 207a_100000185555_100011361488 [1,0,0,0,0,1|2,0,0]=4 459 B21R2.432854 COc1ccc(cc1OC)CNCc2cc(ccn2)C 270004a_100000185555_100011361488 [1,0,0,0,0,1|2,0,0]=4 460 B21R2.432854 COc1ccc(cc1OC)CNCc2cc(ccn2)C 34a_100000185555_100000718516 [1,0,0,0,0,1|2,0,0]=4 461 B21R2.432854 COc1ccc(cc1OC)CNCc2cc(ccn2)Cl 270004a_100000185555_100011998288 [1,0,0,0,0,1|2,0,0]=4 462 B21R2.432854 COc1ccc(cc1OC)CNCc2cc(ccn2)Cl 34a_100000185555_100016988179 [1,0,0,0,0,1|2,0,0]=4 463 B21R2.432854 COc1ccc(cc1OC)CNCc2cccc(c2)O 207a_100000185555_100000188321 [1,0,0,0,0,1|2,0,0]=4 464 B21R2.432854 COc1ccc(cc1OC)CNCc2cccc(c2)O 207a_100000743036_100000170513 [1,0,0,0,0,1|2,0,0]=4 465 B21R2.432854 COc1ccc(cc1OC)CNCc2cccc(c2)O 2230a_100000743036_100011233839 [1,0,0,0,0,1|2,0,0]=4 466 B21R2.432854 COc1ccc(cc1OC)CNCc2cccc(c2)O 270004a_100000185555_100000188321 [1,0,0,0,0,1|2,0,0]=4 467 B21R2.432854 COc1ccc(cc1OC)CNCc2cccc(c2)O 270004a_100000743036_100000170513 [1,0,0,0,0,1|2,0,0]=4 468 B21R2.432854 COc1ccc(cc1OC)CNCc2cccc(c2)O 34a_100000185555_100011660834 [1,0,0,0,0,1|2,0,0]=4 469 B21R2.432854 COc1ccc(cc1OC)CNCc2cncc(c2)O 207a_100000185555_100012187055 [1,0,0,0,0,1|1,0,1]=4 470 B21R2.432854 COc1ccc(cc1OC)CNCc2cncc(c2)O 270004a_100000185555_100012187055 [1,0,0,0,0,1|1,0,1]=4 471 B21R2.432854 COc1ccc(cc1OC)COCc2cc(ccn2)Br 34a_100000210929_100010173614 [1,0,0,0,0,1|2,0,0]=4 472 B21R2.432854 COc1ccc(cc1OC)COCc2cc(ccn2)C 34a_100000210929_100000718516 [1,0,0,0,0,1|2,0,0]=4 473 B21R2.432854 COc1ccc(cc1OC)COCc2cc(ccn2)Cl 34a_100000210929_100016988179 [1,0,0,0,0,1|2,0,0]=4 474 B21R2.432854 COc1ccc(cc1OC)COCc2cccc(c2)O 34a_100000210929_100011660834 [1,0,0,0,0,1|2,0,0]=4 475 B21R2.432854 COc1ccc(cc1OC)CSCc2cc(ccn2)Br 62a_100010173614_100011233839 [1,0,0,0,0,1|2,0,0]=4 476 B21R2.432854 COc1ccc(cc1OC)CSCc2cc(ccn2)C 62a_100000718516_100011233839 [1,0,0,0,0,1|2,0,0]=4 477 B21R2.432854 COc1ccc(cc1OC)CSCc2cc(ccn2)Cl 62a_100016988179_100011233839 [1,0,0,0,0,1|2,0,0]=4 478 B21R2.432854 COc1ccc(cc1OC)CSCc2cccc(c2)O 62a_100011660834_100011233839 [1,0,0,0,0,1|2,0,0]=4 479 B21R2.2711787 COc1ccc(cc1C)CNCc2c[nH]c(=O)c(c2)Cl 207a_100102679029_100000051075 [1,0,0,0,0,1|2,0,0]=4 480 B21R2.2711787 COc1ccc(cc1C)CNCc2c[nH]c(=O)c(c2)Cl 270004a_100102679029_100000051075 [1,0,0,0,0,1|2,0,0]=4 481 B21R2.2711787 COc1ccc(cc1O)CNCc2c[nH]c(=O)c(c2)Cl 207a_100000740000_100000051075 [1,0,0,0,0,1|2,0,0]=4 482 B21R2.239384 COc1cc(cc(c1)OC)CSc2c[nH]c(=O)c(c2)O 62a_100011215721_100009814561 [0,0,0,0,1,1|2,0,0]=4 483 B21R2.239384 COc1cc(cc(c1)OC)CSc2cc(c(=O)[nH]n2)C 62a_100011215721_100012187101 [0,0,0,0,1,1|2,0,0]=4 484 B21R2.239384 COc1cc(cc(c1)OC)CSc2cc(c(=O)[nH]n2)N 62a_100011215721_100000102183 [0,0,0,0,1,1|2,0,0]=4 485 B21R2.1777516 COc1cccc(c1OC)CSc2c[nH]c(=O)c(c2)O 62a_100011217692_100009814561 [0,0,0,0,1,1|2,0,0]=4 486 B21R2.1777516 COc1cccc(c1OC)CSc2cc(c(=O)[nH]n2)C 62a_100011217692_100012187101 [0,0,0,0,1,1|2,0,0]=4 487 B21R2.1777516 COc1cccc(c1OC)CSc2cc(c(=O)[nH]n2)N 62a_100011217692_100000102183 [0,0,0,0,1,1|2,0,0]=4 488 B21R2.1777516 COc1ccnc(c1OC)CSc2c[nH]c(=O)c(c2)O 62a_100000718141_100009814561 [0,0,0,0,1,1|2,0,0]=4 489 B21R2.1777516 COc1ccnc(c1OC)CSc2cc(c(=O)[nH]n2)C 62a_100000718141_100012187101 [0,0,0,0,1,1|2,0,0]=4 490 B21R2.1777516 COc1ccnc(c1OC)CSc2cc(c(=O)[nH]n2)N 62a_100000718141_100000102183 [0,0,0,0,1,1|2,0,0]=4 491 B23R2.3158667 COc1ccc(cc1OC)CCCSc2c[nH]c(=O)c(c2)Br 62a_100010125443_200012094798 [0,0,0,0,0,2|2,0,0]=4 492 B23R2.3158667 COc1ccc(cc1OC)CCCSc2c[nH]c(=O)c(c2)Br 62a_200012094798_100010125443 [0,0,0,0,0,2|2,0,0]=4 493 B23R2.3158667 COc1ccc(cc1OC)CCCSc2c[nH]c(=O)c(c2)F 62a_100000723523_200012094798 [0,0,0,0,0,2|2,0,0]=4 494 B23R2.3158667 COc1ccc(cc1OC)CCCSc2c[nH]c(=O)c(c2)F 62a_200012094798_100000723523 [0,0,0,0,0,2|2,0,0]=4 495 B23R2.3158667 COc1ccc(cc1OC)CCCSc2c[nH]c(=O)c(c2)O 62a_200012094798_100009814561 [0,0,0,0,0,2|1,0,0]=3 496 B23R2.3158667 COc1ccc(cc1OC)CCCSc2cc(c(=O)[nH]n2)C 62a_200012094798_100012187101 [0,0,0,0,0,2|1,0,0]=3 497 B23R2.3158667 COc1ccc(cc1OC)CCCSc2cc(c(=O)[nH]n2)N 62a_200012094798_100000102183 [0,0,0,0,0,2|1,0,0]=3 498 B23R2.3158667 COc1ccc(cc1OC)CCCSc2cc(c(cn2)C)O 62a_100000704368_200012094798 [0,0,0,0,0,2|2,0,0]=4 499 B23R2.3158667 COc1ccc(cc1OC)CCCSc2cc(c(cn2)C)O 62a_200012094798_100000704368 [0,0,0,0,0,2|2,0,0]=4 500 B23R2.3158667 COc1ccc(cc1OC)CCCSc2cc(c(cn2)F)O 62a_100009854642_200012094798 [0,0,0,0,0,2|2,0,0]=4 501 B23R2.3158667 COc1ccc(cc1OC)CCCSc2cc(c(cn2)F)O 62a_200012094798_100009854642 [0,0,0,0,0,2|2,0,0]=4 502 B23R2.3158667 COc1ccc(cc1OC)CCNCc2c[nH]c(=O)c(c2)Cl 207a_100000210947_100000051075 [0,0,0,0,0,2|2,0,0]=4 503 B23R2.3158667 COc1ccc(cc1OC)CCNCc2c[nH]c(=O)c(c2)Cl 270004a_100000210947_100000051075 [0,0,0,0,0,2|2,0,0]=4