0 B19R3.240555 Oc1ccc(cc1O)c2cccc3c2ccs3 271570a_100010179806_100009813601 [0,0,0,0,0,0|1,0,3]=4 1 B18R2.5362 CNCc1ccsc1Sc2ccc(c(c2)O)O 62a_100009817074_100009813601 [0,0,1,0,0,0|3,0,0]=4 2 B18R2.5362 CNCc1cscc1Sc2ccc(c(c2)O)O 62a_100011935083_100009813601 [0,0,1,0,0,0|3,0,0]=4 3 B18R2.5362 CNCc1sccc1Sc2c[nH]c(=O)c(c2)O 62a_100000767120_100009814561 [0,0,1,0,0,0|2,0,1]=4 4 B18R2.5362 CNCc1sccc1Sc2cc(c(cn2)C)O 62a_100000704368_100000767120 [0,0,1,0,0,0|3,0,0]=4 5 B18R2.5362 CNCc1sccc1Sc2cc(c(cn2)C)O 62a_100000767120_100000704368 [0,0,1,0,0,0|3,0,0]=4 6 B18R2.5362 CNCc1sccc1Sc2cc(c(cn2)F)O 62a_100000767120_100009854642 [0,0,1,0,0,0|3,0,0]=4 7 B18R2.5362 CNCc1sccc1Sc2cc(c(cn2)F)O 62a_100009854642_100000767120 [0,0,1,0,0,0|3,0,0]=4 8 B18R2.5362 CNCc1sccc1Sc2cc(c(cn2)O)C 62a_100000767120_100000692680 [0,0,1,0,0,0|3,0,0]=4 9 B18R2.5362 CNCc1sccc1Sc2cc(c(cn2)O)N 62a_100000767120_100009819941 [0,0,1,0,0,0|3,0,0]=4 10 B18R2.5362 CNCc1sccc1Sc2cc(c(cn2)O)N 62a_100009819941_100000767120 [0,0,1,0,0,0|3,0,0]=4 11 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Br)C 62a_100000767120_100011847877 [0,0,1,0,0,0|3,0,0]=4 12 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Br)C 62a_100011847877_100000767120 [0,0,1,0,0,0|3,0,0]=4 13 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Br)F 62a_100000767120_100012047266 [0,0,1,0,0,0|3,0,0]=4 14 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Br)F 62a_100012047266_100000767120 [0,0,1,0,0,0|3,0,0]=4 15 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Br)N 62a_100000750455_100000767120 [0,0,1,0,0,0|3,0,0]=4 16 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Br)N 62a_100000767120_100000750455 [0,0,1,0,0,0|3,0,0]=4 17 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Br)O 62a_100000767120_100012361655 [0,0,1,0,0,0|2,0,0]=3 18 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Br)O 62a_100012361655_100000767120 [0,0,1,0,0,0|2,0,0]=3 19 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)Br 62a_100000767120_100009813585 [0,0,1,0,0,0|3,0,0]=4 20 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)Br 62a_100009813585_100000767120 [0,0,1,0,0,0|3,0,0]=4 21 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)C 62a_100000767120_100011215607 [0,0,1,0,0,0|3,0,0]=4 22 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)C 62a_100011215607_100000767120 [0,0,1,0,0,0|3,0,0]=4 23 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)Cl 62a_100000049509_100000767120 [0,0,1,0,0,0|3,0,0]=4 24 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)Cl 62a_100000767120_100000049509 [0,0,1,0,0,0|3,0,0]=4 25 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)F 62a_100000767120_100011218330 [0,0,1,0,0,0|3,0,0]=4 26 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)F 62a_100011218330_100000767120 [0,0,1,0,0,0|3,0,0]=4 27 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)N 62a_100000211769_100000767120 [0,0,1,0,0,0|3,0,0]=4 28 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)N 62a_100000767120_100000211769 [0,0,1,0,0,0|3,0,0]=4 29 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)C)O 62a_100000767120_100000186361 [0,0,1,0,0,0|2,0,0]=3 30 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Cl)C 62a_100000767120_100011216363 [0,0,1,0,0,0|3,0,0]=4 31 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Cl)C 62a_100011216363_100000767120 [0,0,1,0,0,0|3,0,0]=4 32 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Cl)Cl 62a_100000767120_100011214914 [0,0,1,0,0,0|3,0,0]=4 33 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Cl)Cl 62a_100011214914_100000767120 [0,0,1,0,0,0|3,0,0]=4 34 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Cl)F 62a_100000767120_100011215976 [0,0,1,0,0,0|3,0,0]=4 35 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Cl)F 62a_100011215976_100000767120 [0,0,1,0,0,0|3,0,0]=4 36 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Cl)N 62a_100000767120_100011218065 [0,0,1,0,0,0|3,0,0]=4 37 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Cl)N 62a_100011218065_100000767120 [0,0,1,0,0,0|3,0,0]=4 38 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Cl)O 62a_100000767120_100012360047 [0,0,1,0,0,0|2,0,0]=3 39 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)Cl)O 62a_100012360047_100000767120 [0,0,1,0,0,0|2,0,0]=3 40 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)Br 62a_100000685389_100000767120 [0,0,1,0,0,0|3,0,0]=4 41 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)Br 62a_100000767120_100000685389 [0,0,1,0,0,0|3,0,0]=4 42 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)C 62a_100000720648_100000767120 [0,0,1,0,0,0|3,0,0]=4 43 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)C 62a_100000767120_100000720648 [0,0,1,0,0,0|3,0,0]=4 44 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)Cl 62a_100000767120_100011216805 [0,0,1,0,0,0|3,0,0]=4 45 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)Cl 62a_100011216805_100000767120 [0,0,1,0,0,0|3,0,0]=4 46 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)F 62a_100000703953_100000767120 [0,0,1,0,0,0|3,0,0]=4 47 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)F 62a_100000767120_100000703953 [0,0,1,0,0,0|3,0,0]=4 48 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)N 62a_100000767120_100011215594 [0,0,1,0,0,0|3,0,0]=4 49 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)N 62a_100011215594_100000767120 [0,0,1,0,0,0|3,0,0]=4 50 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)O 62a_100000185481_100000767120 [0,0,1,0,0,0|2,0,0]=3 51 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)F)O 62a_100000767120_100000185481 [0,0,1,0,0,0|2,0,0]=3 52 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)Br 62a_100000750456_100000767120 [0,0,1,0,0,0|3,0,0]=4 53 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)Br 62a_100000767120_100000750456 [0,0,1,0,0,0|3,0,0]=4 54 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)C 62a_100000761890_100000767120 [0,0,1,0,0,0|3,0,0]=4 55 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)C 62a_100000767120_100000761890 [0,0,1,0,0,0|3,0,0]=4 56 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)Cl 62a_100000767120_200000761891 [0,0,1,0,0,0|3,0,0]=4 57 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)Cl 62a_200000761891_100000767120 [0,0,1,0,0,0|3,0,0]=4 58 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)F 62a_100000740924_100000767120 [0,0,1,0,0,0|3,0,0]=4 59 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)F 62a_100000767120_100000740924 [0,0,1,0,0,0|3,0,0]=4 60 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)N 62a_100000741789_100000767120 [0,0,1,0,0,0|3,0,0]=4 61 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)N 62a_100000767120_100011534411 [0,0,1,0,0,0|3,0,0]=4 62 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)O 62a_100000752626_100000767120 [0,0,1,0,0,0|2,0,0]=3 63 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)N)O 62a_100000767120_100000752626 [0,0,1,0,0,0|2,0,0]=3 64 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)Br 62a_100000767120_100012356990 [0,0,1,0,0,0|2,0,0]=3 65 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)Br 62a_100012356990_100000767120 [0,0,1,0,0,0|2,0,0]=3 66 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)C 62a_100000685420_100000767120 [0,0,1,0,0,0|2,0,0]=3 67 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)C 62a_100000767120_100000685420 [0,0,1,0,0,0|2,0,0]=3 68 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)Cl 62a_100000767120_100011356854 [0,0,1,0,0,0|2,0,0]=3 69 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)Cl 62a_100011356854_100000767120 [0,0,1,0,0,0|2,0,0]=3 70 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)F 62a_100000686035_100000767120 [0,0,1,0,0,0|2,0,0]=3 71 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)F 62a_100000767120_100000686035 [0,0,1,0,0,0|2,0,0]=3 72 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)N 62a_100000739049_100000767120 [0,0,1,0,0,0|2,0,0]=3 73 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)N 62a_100000767120_100000739049 [0,0,1,0,0,0|2,0,0]=3 74 B18R2.5362 CNCc1sccc1Sc2ccc(c(c2)O)O 62a_100000767120_100009813601 [0,0,1,0,0,0|1,0,0]=2 75 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)Br)O 62a_100000725334_100000767120 [0,0,1,0,0,0|3,0,0]=4 76 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)Br)O 62a_100000767120_100000725334 [0,0,1,0,0,0|3,0,0]=4 77 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)C)O 62a_100000767120_100010233687 [0,0,1,0,0,0|3,0,0]=4 78 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)C)O 62a_100010233687_100000767120 [0,0,1,0,0,0|3,0,0]=4 79 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)Cl)O 62a_100000767120_100000721234 [0,0,1,0,0,0|3,0,0]=4 80 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)F)O 62a_100000767120_100009819667 [0,0,1,0,0,0|3,0,0]=4 81 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)F)O 62a_100009819667_100000767120 [0,0,1,0,0,0|3,0,0]=4 82 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)N)O 62a_100000685527_100000767120 [0,0,1,0,0,0|3,0,0]=4 83 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)N)O 62a_100000767120_100000685527 [0,0,1,0,0,0|3,0,0]=4 84 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)O)F 62a_100000767120_100010729010 [0,0,1,0,0,0|3,0,0]=4 85 B18R2.5362 CNCc1sccc1Sc2ccc(c(n2)O)N 62a_100000718904_100000767120 [0,0,1,0,0,0|3,0,0]=4 86 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)C)O 62a_100000685391_100000767120 [0,0,1,0,0,0|3,0,0]=4 87 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)C)O 62a_100000767120_100000685391 [0,0,1,0,0,0|3,0,0]=4 88 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)Cl)O 62a_100000767120_100010238531 [0,0,1,0,0,0|3,0,0]=4 89 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)Cl)O 62a_100010238531_100000767120 [0,0,1,0,0,0|3,0,0]=4 90 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)N)O 62a_100000743729_100000767120 [0,0,1,0,0,0|3,0,0]=4 91 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)N)O 62a_100000767120_100000743729 [0,0,1,0,0,0|3,0,0]=4 92 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)O)C 62a_100000767120_100009864810 [0,0,1,0,0,0|3,0,0]=4 93 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)O)C 62a_100009864810_100000767120 [0,0,1,0,0,0|3,0,0]=4 94 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)O)F 62a_100000767120_100009819871 [0,0,1,0,0,0|3,0,0]=4 95 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)O)F 62a_100009819871_100000767120 [0,0,1,0,0,0|3,0,0]=4 96 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)O)N 62a_100000767120_100009819042 [0,0,1,0,0,0|3,0,0]=4 97 B18R2.5362 CNCc1sccc1Sc2cnc(c(c2)O)N 62a_100009819042_100000767120 [0,0,1,0,0,0|3,0,0]=4 98 B18R2.9095 Cc1cc(ccc1O)NCCCc2cccs2 34a_100011218179_100010992444 [0,0,1,0,0,0|3,0,0]=4 99 B18R2.9095 Cc1cc(ccc1O)NCCCc2cccs2 7a_100011218179_100010992444 [0,0,1,0,0,0|3,0,0]=4 100 B18R2.9095 Cc1cc(ccc1O)SCCCc2cccs2 62a_100010992444_100000186361 [0,0,1,0,0,0|3,0,0]=4 101 B18R2.9095 Cc1ccc(cc1C)CCNCc2ccco2 207a_100020591374_100000186105 [0,0,1,0,0,0|2,1,0]=4 102 B18R2.9095 Cc1ccc(cc1C)CCNCc2ccco2 270004a_100020591374_100000186105 [0,0,1,0,0,0|2,1,0]=4 103 B18R2.9095 Cc1ccc(cc1C)CCNCc2cccs2 207a_100020591374_100000209959 [0,0,1,0,0,0|2,0,0]=3 104 B18R2.9095 Cc1ccc(cc1C)CCNCc2cccs2 270004a_100020591374_100000209959 [0,0,1,0,0,0|2,0,0]=3 105 B18R2.9095 Cc1ccc(cc1C)CCNCc2cncs2 207a_100020591374_100000749870 [0,0,1,0,0,0|3,0,0]=4 106 B18R2.9095 Cc1ccc(cc1C)CCNCc2cncs2 2230a_100020591374_100015185245 [0,0,1,0,0,0|3,0,0]=4 107 B18R2.9095 Cc1ccc(cc1C)CCNCc2cncs2 270004a_100020591374_100000749870 [0,0,1,0,0,0|3,0,0]=4 108 B18R2.9095 Cc1ccc(cc1C)CCNCc2cncs2 34a_100020591374_100015185245 [0,0,1,0,0,0|3,0,0]=4 109 B18R2.9095 Cc1ccc(cc1C)CCNCc2nccs2 207a_100020591374_100000750902 [0,0,1,0,0,0|3,0,0]=4 110 B18R2.9095 Cc1ccc(cc1C)CCNCc2nccs2 2230a_100020591374_100015184050 [0,0,1,0,0,0|3,0,0]=4 111 B18R2.9095 Cc1ccc(cc1C)CCNCc2nccs2 270004a_100020591374_100000750902 [0,0,1,0,0,0|3,0,0]=4 112 B18R2.9095 Cc1ccc(cc1C)CCNCc2nccs2 34a_100020591374_100015184050 [0,0,1,0,0,0|3,0,0]=4 113 B18R2.9095 Cc1ccc(cc1O)NCCCc2cccs2 34a_100000759471_100010992444 [0,0,1,0,0,0|3,0,0]=4 114 B18R2.9095 Cc1ccc(cc1O)NCCCc2cccs2 7a_100000759471_100010992444 [0,0,1,0,0,0|3,0,0]=4 115 B18R2.9095 Cc1ccc(cc1O)SCCCc2cccs2 62a_100000685420_100010992444 [0,0,1,0,0,0|3,0,0]=4 116 B18R2.9095 Cc1ccc(cc1O)SCCCc2cccs2 62a_100010992444_100000685420 [0,0,1,0,0,0|3,0,0]=4 117 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2ccco2 207a_100011207230_100000186105 [0,0,1,0,0,0|2,1,0]=4 118 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2ccco2 2230a_100000185738_100011713676 [0,0,1,0,0,0|2,1,0]=4 119 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2ccco2 270004a_100011207230_100000186105 [0,0,1,0,0,0|2,1,0]=4 120 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2ccco2 34a_100000185738_100011713676 [0,0,1,0,0,0|2,1,0]=4 121 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2cccs2 207a_100011207230_100000209959 [0,0,1,0,0,0|2,0,0]=3 122 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2cccs2 2230a_100000211653_100011713676 [0,0,1,0,0,0|2,0,0]=3 123 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2cccs2 270004a_100011207230_100000209959 [0,0,1,0,0,0|2,0,0]=3 124 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2cncs2 207a_100011207230_100000749870 [0,0,1,0,0,0|3,0,0]=4 125 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2cncs2 2230a_100011207230_100015185245 [0,0,1,0,0,0|3,0,0]=4 126 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2cncs2 2230a_100016987365_100011713676 [0,0,1,0,0,0|3,0,0]=4 127 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2cncs2 270004a_100011207230_100000749870 [0,0,1,0,0,0|3,0,0]=4 128 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2cncs2 34a_100011207230_100015185245 [0,0,1,0,0,0|3,0,0]=4 129 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2nccs2 207a_100011207230_100000750902 [0,0,1,0,0,0|3,0,0]=4 130 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2nccs2 2230a_100000740555_100011713676 [0,0,1,0,0,0|3,0,0]=4 131 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2nccs2 2230a_100011207230_100015184050 [0,0,1,0,0,0|3,0,0]=4 132 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2nccs2 270004a_100011207230_100000750902 [0,0,1,0,0,0|3,0,0]=4 133 B18R2.9095 Clc1ccc(cc1Cl)CCNCc2nccs2 34a_100011207230_100015184050 [0,0,1,0,0,0|3,0,0]=4 134 B18R2.9095 Clc1ccc(cc1Cl)CCOCc2cccs2 34a_100000211240_100011713676 [0,0,1,0,0,0|3,0,0]=4 135 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2ccco2 207a_200011997520_100000186105 [0,0,1,0,0,0|2,1,0]=4 136 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2ccco2 2230a_100000185738_100012361305 [0,0,1,0,0,0|2,1,0]=4 137 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2ccco2 270004a_200011997520_100000186105 [0,0,1,0,0,0|2,1,0]=4 138 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2ccco2 34a_100000185738_100012361305 [0,0,1,0,0,0|2,1,0]=4 139 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2cccs2 207a_200011997520_100000209959 [0,0,1,0,0,0|2,0,0]=3 140 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2cccs2 2230a_100000211653_100012361305 [0,0,1,0,0,0|2,0,0]=3 141 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2cccs2 270004a_200011997520_100000209959 [0,0,1,0,0,0|2,0,0]=3 142 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2cncs2 207a_200011997520_100000749870 [0,0,1,0,0,0|3,0,0]=4 143 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2cncs2 2230a_100016987365_100012361305 [0,0,1,0,0,0|3,0,0]=4 144 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2cncs2 2230a_200011997520_100015185245 [0,0,1,0,0,0|3,0,0]=4 145 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2cncs2 270004a_200011997520_100000749870 [0,0,1,0,0,0|3,0,0]=4 146 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2cncs2 34a_200011997520_100015185245 [0,0,1,0,0,0|3,0,0]=4 147 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2nccs2 207a_200011997520_100000750902 [0,0,1,0,0,0|3,0,0]=4 148 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2nccs2 2230a_100000740555_100012361305 [0,0,1,0,0,0|3,0,0]=4 149 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2nccs2 2230a_200011997520_100015184050 [0,0,1,0,0,0|3,0,0]=4 150 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2nccs2 270004a_200011997520_100000750902 [0,0,1,0,0,0|3,0,0]=4 151 B18R2.9095 Fc1ccc(cc1Cl)CCNCc2nccs2 34a_200011997520_100015184050 [0,0,1,0,0,0|3,0,0]=4 152 B18R2.9095 Fc1ccc(cc1Cl)CCOCc2cccs2 34a_100000211240_100012361305 [0,0,1,0,0,0|3,0,0]=4 153 B18R2.9095 Fc1ccc(cc1F)CCNCc2ccco2 207a_200000706328_100000186105 [0,0,1,0,0,0|2,1,0]=4 154 B18R2.9095 Fc1ccc(cc1F)CCNCc2ccco2 2230a_100000185738_100000690553 [0,0,1,0,0,0|2,1,0]=4 155 B18R2.9095 Fc1ccc(cc1F)CCNCc2ccco2 270004a_200000706328_100000186105 [0,0,1,0,0,0|2,1,0]=4 156 B18R2.9095 Fc1ccc(cc1F)CCNCc2ccco2 34a_100000185738_100000690553 [0,0,1,0,0,0|2,1,0]=4 157 B18R2.9095 Fc1ccc(cc1F)CCNCc2cccs2 207a_200000706328_100000209959 [0,0,1,0,0,0|2,0,0]=3 158 B18R2.9095 Fc1ccc(cc1F)CCNCc2cccs2 2230a_100000211653_100000690553 [0,0,1,0,0,0|2,0,0]=3 159 B18R2.9095 Fc1ccc(cc1F)CCNCc2cccs2 270004a_200000706328_100000209959 [0,0,1,0,0,0|2,0,0]=3 160 B18R2.9095 Fc1ccc(cc1F)CCNCc2cncs2 207a_200000706328_100000749870 [0,0,1,0,0,0|3,0,0]=4 161 B18R2.9095 Fc1ccc(cc1F)CCNCc2cncs2 2230a_100016987365_100000690553 [0,0,1,0,0,0|3,0,0]=4 162 B18R2.9095 Fc1ccc(cc1F)CCNCc2cncs2 2230a_200000706328_100015185245 [0,0,1,0,0,0|3,0,0]=4 163 B18R2.9095 Fc1ccc(cc1F)CCNCc2cncs2 270004a_200000706328_100000749870 [0,0,1,0,0,0|3,0,0]=4 164 B18R2.9095 Fc1ccc(cc1F)CCNCc2cncs2 34a_200000706328_100015185245 [0,0,1,0,0,0|3,0,0]=4 165 B18R2.9095 Fc1ccc(cc1F)CCNCc2nccs2 207a_200000706328_100000750902 [0,0,1,0,0,0|3,0,0]=4 166 B18R2.9095 Fc1ccc(cc1F)CCNCc2nccs2 2230a_100000740555_100000690553 [0,0,1,0,0,0|3,0,0]=4 167 B18R2.9095 Fc1ccc(cc1F)CCNCc2nccs2 2230a_200000706328_100015184050 [0,0,1,0,0,0|3,0,0]=4 168 B18R2.9095 Fc1ccc(cc1F)CCNCc2nccs2 270004a_200000706328_100000750902 [0,0,1,0,0,0|3,0,0]=4 169 B18R2.9095 Fc1ccc(cc1F)CCNCc2nccs2 34a_200000706328_100015184050 [0,0,1,0,0,0|3,0,0]=4 170 B18R2.9095 Fc1ccc(cc1F)CCOCc2cccs2 34a_100000211240_100000690553 [0,0,1,0,0,0|3,0,0]=4 171 B18R2.9095 Nc1cc(ccc1O)SCCCc2cccs2 62a_100000752626_100010992444 [0,0,1,0,0,0|3,0,0]=4 172 B18R2.9095 Nc1cc(ccc1O)SCCCc2cccs2 62a_100010992444_100000752626 [0,0,1,0,0,0|3,0,0]=4 173 B18R2.9095 Nc1ccc(cc1O)SCCCc2cccs2 62a_100000739049_100010992444 [0,0,1,0,0,0|3,0,0]=4 174 B18R2.9095 Nc1ccc(cc1O)SCCCc2cccs2 62a_100010992444_100000739049 [0,0,1,0,0,0|3,0,0]=4 175 B18R2.9095 Oc1cc(ccc1Br)SCCCc2cccs2 62a_100010992444_100012356990 [0,0,1,0,0,0|3,0,0]=4 176 B18R2.9095 Oc1cc(ccc1Br)SCCCc2cccs2 62a_100012356990_100010992444 [0,0,1,0,0,0|3,0,0]=4 177 B18R2.9095 Oc1cc(ccc1Cl)CNCCc2cccs2 34a_100020636435_100000748579 [0,0,1,0,0,0|3,0,0]=4 178 B18R2.9095 Oc1cc(ccc1Cl)NCCCc2cccs2 34a_100011934209_100010992444 [0,0,1,0,0,0|3,0,0]=4 179 B18R2.9095 Oc1cc(ccc1Cl)SCCCc2cccs2 62a_100010992444_100011356854 [0,0,1,0,0,0|3,0,0]=4 180 B18R2.9095 Oc1cc(ccc1Cl)SCCCc2cccs2 62a_100011356854_100010992444 [0,0,1,0,0,0|3,0,0]=4 181 B18R2.9095 Oc1cc(ccc1F)CNCCc2cccs2 34a_100160469508_100000748579 [0,0,1,0,0,0|3,0,0]=4 182 B18R2.9095 Oc1cc(ccc1F)NCCCc2cccs2 34a_100012017398_100010992444 [0,0,1,0,0,0|3,0,0]=4 183 B18R2.9095 Oc1cc(ccc1F)NCCCc2cccs2 7a_100012017398_100010992444 [0,0,1,0,0,0|3,0,0]=4 184 B18R2.9095 Oc1cc(ccc1F)SCCCc2cccs2 62a_100000686035_100010992444 [0,0,1,0,0,0|3,0,0]=4 185 B18R2.9095 Oc1cc(ccc1F)SCCCc2cccs2 62a_100010992444_100000686035 [0,0,1,0,0,0|3,0,0]=4 186 B18R2.9095 Oc1ccc(cc1Br)NCCCc2cccs2 34a_100011534360_100010992444 [0,0,1,0,0,0|3,0,0]=4 187 B18R2.9095 Oc1ccc(cc1Br)SCCCc2cccs2 62a_100010992444_100012361655 [0,0,1,0,0,0|3,0,0]=4 188 B18R2.9095 Oc1ccc(cc1Br)SCCCc2cccs2 62a_100012361655_100010992444 [0,0,1,0,0,0|3,0,0]=4 189 B18R2.9095 Oc1ccc(cc1Cl)NCCCc2cccs2 34a_100000744943_100010992444 [0,0,1,0,0,0|3,0,0]=4 190 B18R2.9095 Oc1ccc(cc1Cl)SCCCc2cccs2 62a_100010992444_100012360047 [0,0,1,0,0,0|3,0,0]=4 191 B18R2.9095 Oc1ccc(cc1Cl)SCCCc2cccs2 62a_100012360047_100010992444 [0,0,1,0,0,0|3,0,0]=4 192 B18R2.9095 Oc1ccc(cc1F)CNCCc2cccs2 34a_100000758358_100000748579 [0,0,1,0,0,0|3,0,0]=4 193 B18R2.9095 Oc1ccc(cc1F)NCCCc2cccs2 34a_100011220035_100010992444 [0,0,1,0,0,0|3,0,0]=4 194 B18R2.9095 Oc1ccc(cc1F)NCCCc2cccs2 7a_100011220035_100010992444 [0,0,1,0,0,0|3,0,0]=4 195 B18R2.9095 Oc1ccc(cc1F)SCCCc2cccs2 62a_100000185481_100010992444 [0,0,1,0,0,0|3,0,0]=4 196 B18R2.9095 Oc1ccc(cc1F)SCCCc2cccs2 62a_100010992444_100000185481 [0,0,1,0,0,0|3,0,0]=4 197 B18R2.9095 Oc1ccc(cc1O)CCNCc2c[nH]cn2 34a_100000210387_100000707719 [0,0,1,0,0,0|2,0,0]=3 198 B18R2.9095 Oc1ccc(cc1O)CCNCc2ccn[nH]2 34a_100000210387_100000728653 [0,0,1,0,0,0|2,0,0]=3 199 B18R2.9095 Oc1ccc(cc1O)CCNCc2ccon2 34a_100000210387_100000234950 [0,0,1,0,0,0|2,0,0]=3 200 B18R2.9095 Oc1ccc(cc1O)CCNCc2ccsc2 34a_100000210387_100011261437 [0,0,1,0,0,0|2,0,0]=3 201 B18R2.9095 Oc1ccc(cc1O)CCNCc2cncs2 34a_100000210387_100015185245 [0,0,1,0,0,0|1,0,0]=2 202 B18R2.9095 Oc1ccc(cc1O)CCNCc2cscn2 34a_100000210387_100000205941 [0,0,1,0,0,0|2,0,0]=3 203 B18R2.9095 Oc1ccc(cc1O)CCNCc2ncc[nH]2 34a_100000210387_100016991755 [0,0,1,0,0,0|2,0,0]=3 204 B18R2.9095 Oc1ccc(cc1O)CCNCc2ncco2 34a_100000210387_103436540062 [0,0,1,0,0,0|1,1,0]=3 205 B18R2.9095 Oc1ccc(cc1O)CCNCc2nccs2 34a_100000210387_100015184050 [0,0,1,0,0,0|1,0,0]=2 206 B18R2.9095 Oc1ccc(cc1O)CCNCc2ncon2 34a_100000210387_100000233494 [0,0,1,0,0,0|3,0,0]=4 207 B18R2.9095 Oc1ccc(cc1O)CCNCn2cncn2 34a_100000210387_200020645497 [0,0,1,0,0,0|3,0,0]=4 208 B18R2.9095 Oc1ccc(cc1O)CCSCc2c[nH]cn2 62a_100000707719_200010393615 [0,0,1,0,0,0|3,0,0]=4 209 B18R2.9095 Oc1ccc(cc1O)CCSCc2ccn[nH]2 62a_100000728653_200010393615 [0,0,1,0,0,0|3,0,0]=4 210 B18R2.9095 Oc1ccc(cc1O)CCSCc2ccon2 62a_100000234950_200010393615 [0,0,1,0,0,0|3,0,0]=4 211 B18R2.9095 Oc1ccc(cc1O)CCSCc2ccsc2 62a_100011261437_200010393615 [0,0,1,0,0,0|3,0,0]=4 212 B18R2.9095 Oc1ccc(cc1O)CCSCc2cncs2 62a_100015185245_200010393615 [0,0,1,0,0,0|2,0,0]=3 213 B18R2.9095 Oc1ccc(cc1O)CCSCc2cscn2 62a_100000205941_200010393615 [0,0,1,0,0,0|3,0,0]=4 214 B18R2.9095 Oc1ccc(cc1O)CCSCc2ncc[nH]2 62a_100016991755_200010393615 [0,0,1,0,0,0|3,0,0]=4 215 B18R2.9095 Oc1ccc(cc1O)CCSCc2ncco2 62a_103436540062_200010393615 [0,0,1,0,0,0|2,1,0]=4 216 B18R2.9095 Oc1ccc(cc1O)CCSCc2nccs2 62a_100015184050_200010393615 [0,0,1,0,0,0|2,0,0]=3 217 B18R2.9095 Oc1ccc(cc1O)CNCCc2cccs2 34a_100000010075_100000748579 [0,0,1,0,0,0|2,0,0]=3 218 B18R2.9095 Oc1ccc(cc1O)NCCCc2cccs2 34a_100102946323_100010992444 [0,0,1,0,0,0|2,0,0]=3 219 B18R2.9095 Oc1ccc(cc1O)SCCCc2cccs2 62a_100010992444_100009813601 [0,0,1,0,0,0|2,0,0]=3 220 B17R2.91 CNCc1sccc1Sc2cc(ccn2)O 62a_100000767120_100000762945 [1,0,1,0,0,0|2,0,0]=4 221 B17R2.91 CNCc1sccc1Sc2cccc(c2)Br 62a_100000691529_100000767120 [1,0,1,0,0,0|2,0,0]=4 222 B17R2.91 CNCc1sccc1Sc2cccc(c2)Br 62a_100000767120_100000691529 [1,0,1,0,0,0|2,0,0]=4 223 B17R2.91 CNCc1sccc1Sc2cccc(c2)C 62a_100000767120_100011215228 [1,0,1,0,0,0|2,0,0]=4 224 B17R2.91 CNCc1sccc1Sc2cccc(c2)C 62a_100011215228_100000767120 [1,0,1,0,0,0|2,0,0]=4 225 B17R2.91 CNCc1sccc1Sc2cccc(c2)Cl 62a_100000699651_100000767120 [1,0,1,0,0,0|2,0,0]=4 226 B17R2.91 CNCc1sccc1Sc2cccc(c2)Cl 62a_100000767120_100000699651 [1,0,1,0,0,0|2,0,0]=4 227 B17R2.91 CNCc1sccc1Sc2cccc(c2)F 62a_100000685547_100000767120 [1,0,1,0,0,0|2,0,0]=4 228 B17R2.91 CNCc1sccc1Sc2cccc(c2)F 62a_100000767120_100000685547 [1,0,1,0,0,0|2,0,0]=4 229 B17R2.91 CNCc1sccc1Sc2cccc(c2)N 62a_100000210019_100000767120 [1,0,1,0,0,0|2,0,0]=4 230 B17R2.91 CNCc1sccc1Sc2cccc(c2)N 62a_100000767120_100000210019 [1,0,1,0,0,0|2,0,0]=4 231 B17R2.91 CNCc1sccc1Sc2cccc(c2)O 62a_100000767120_100000211634 [1,0,1,0,0,0|1,0,0]=3 232 B17R2.91 CNCc1sccc1Sc2cccc(c2)[S] 62a_100000767120_114929384022 [1,0,1,0,0,0|1,1,0]=4 233 B17R2.91 CNCc1sccc1Sc2cccc(c2)[S] 62a_114929384022_100000767120 [1,0,1,0,0,0|1,1,0]=4 234 B17R2.91 CNCc1sccc1Sc2cncc(c2)O 62a_100000754920_100000767120 [1,0,1,0,0,0|2,0,0]=4 235 B17R2.91 CNCc1sccc1Sc2cncc(c2)O 62a_100000767120_100000754920 [1,0,1,0,0,0|2,0,0]=4 236 B17R2.1295 CSc1sccc1Sc2ccc(c(c2)O)O 62a_200010341309_100009813601 [1,0,1,0,0,0|2,0,0]=4 237 B17R2.1295 OCc1sccc1Sc2ccc(c(c2)O)O 62a_100000702026_100009813601 [1,0,1,0,0,0|2,0,0]=4 238 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)Br 62a_100000752885_100000767120 [1,0,1,0,0,0|2,0,0]=4 239 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)Br 62a_100000767120_100000752885 [1,0,1,0,0,0|2,0,0]=4 240 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)C 62a_100000186775_100000767120 [1,0,1,0,0,0|2,0,0]=4 241 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)C 62a_100000767120_100000186775 [1,0,1,0,0,0|2,0,0]=4 242 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)Cl 62a_100000755918_100000767120 [1,0,1,0,0,0|2,0,0]=4 243 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)Cl 62a_100000767120_100000755918 [1,0,1,0,0,0|2,0,0]=4 244 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)F 62a_100000211213_100000767120 [1,0,1,0,0,0|2,0,0]=4 245 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)F 62a_100000767120_100000211213 [1,0,1,0,0,0|2,0,0]=4 246 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)N 62a_100000185761_100000767120 [1,0,1,0,0,0|2,0,0]=4 247 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)N 62a_100000767120_100000185761 [1,0,1,0,0,0|2,0,0]=4 248 B17R2.3195 CNCc1sccc1Sc2ccc(cc2)O 62a_100000767120_100000185759 [1,0,1,0,0,0|1,0,0]=3 249 B17R2.3195 CNCc1sccc1Sc2ccc(cn2)O 62a_100000685995_100000767120 [1,0,1,0,0,0|2,0,0]=4 250 B17R2.3195 CNCc1sccc1Sc2ccc(cn2)O 62a_100000767120_100000744096 [1,0,1,0,0,0|2,0,0]=4 251 B17R2.346 Brc1ccc(cc1)CCNCc2ccco2 207a_100000755846_100000186105 [1,0,1,0,0,0|1,1,0]=4 252 B17R2.346 Brc1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100011740612 [1,0,1,0,0,0|1,1,0]=4 253 B17R2.346 Brc1ccc(cc1)CCNCc2ccco2 270004a_100000755846_100000186105 [1,0,1,0,0,0|1,1,0]=4 254 B17R2.346 Brc1ccc(cc1)CCNCc2ccco2 34a_100000185738_100011740612 [1,0,1,0,0,0|1,1,0]=4 255 B17R2.346 Brc1ccc(cc1)CCNCc2cccs2 207a_100000755846_100000209959 [1,0,1,0,0,0|1,0,0]=3 256 B17R2.346 Brc1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100011740612 [1,0,1,0,0,0|1,0,0]=3 257 B17R2.346 Brc1ccc(cc1)CCNCc2cccs2 270004a_100000755846_100000209959 [1,0,1,0,0,0|1,0,0]=3 258 B17R2.346 Brc1ccc(cc1)CCNCc2cncs2 207a_100000755846_100000749870 [1,0,1,0,0,0|2,0,0]=4 259 B17R2.346 Brc1ccc(cc1)CCNCc2cncs2 2230a_100000755846_100015185245 [1,0,1,0,0,0|2,0,0]=4 260 B17R2.346 Brc1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100011740612 [1,0,1,0,0,0|2,0,0]=4 261 B17R2.346 Brc1ccc(cc1)CCNCc2cncs2 270004a_100000755846_100000749870 [1,0,1,0,0,0|2,0,0]=4 262 B17R2.346 Brc1ccc(cc1)CCNCc2cncs2 34a_100000755846_100015185245 [1,0,1,0,0,0|2,0,0]=4 263 B17R2.346 Brc1ccc(cc1)CCNCc2nccs2 207a_100000755846_100000750902 [1,0,1,0,0,0|2,0,0]=4 264 B17R2.346 Brc1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100011740612 [1,0,1,0,0,0|2,0,0]=4 265 B17R2.346 Brc1ccc(cc1)CCNCc2nccs2 2230a_100000755846_100015184050 [1,0,1,0,0,0|2,0,0]=4 266 B17R2.346 Brc1ccc(cc1)CCNCc2nccs2 270004a_100000755846_100000750902 [1,0,1,0,0,0|2,0,0]=4 267 B17R2.346 Brc1ccc(cc1)CCNCc2nccs2 34a_100000755846_100015184050 [1,0,1,0,0,0|2,0,0]=4 268 B17R2.346 Brc1ccc(cc1)CCOCc2cccs2 34a_100000211240_100011740612 [1,0,1,0,0,0|2,0,0]=4 269 B17R2.346 Cc1ccc(cc1)CCNCc2ccco2 207a_100000705350_100000186105 [1,0,1,0,0,0|1,1,0]=4 270 B17R2.346 Cc1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100011713686 [1,0,1,0,0,0|1,1,0]=4 271 B17R2.346 Cc1ccc(cc1)CCNCc2ccco2 270004a_100000705350_100000186105 [1,0,1,0,0,0|1,1,0]=4 272 B17R2.346 Cc1ccc(cc1)CCNCc2ccco2 34a_100000185738_100011713686 [1,0,1,0,0,0|1,1,0]=4 273 B17R2.346 Cc1ccc(cc1)CCNCc2cccs2 207a_100000705350_100000209959 [1,0,1,0,0,0|1,0,0]=3 274 B17R2.346 Cc1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100011713686 [1,0,1,0,0,0|1,0,0]=3 275 B17R2.346 Cc1ccc(cc1)CCNCc2cccs2 270004a_100000705350_100000209959 [1,0,1,0,0,0|1,0,0]=3 276 B17R2.346 Cc1ccc(cc1)CCNCc2cncs2 207a_100000705350_100000749870 [1,0,1,0,0,0|2,0,0]=4 277 B17R2.346 Cc1ccc(cc1)CCNCc2cncs2 2230a_100000705350_100015185245 [1,0,1,0,0,0|2,0,0]=4 278 B17R2.346 Cc1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100011713686 [1,0,1,0,0,0|2,0,0]=4 279 B17R2.346 Cc1ccc(cc1)CCNCc2cncs2 270004a_100000705350_100000749870 [1,0,1,0,0,0|2,0,0]=4 280 B17R2.346 Cc1ccc(cc1)CCNCc2cncs2 34a_100000705350_100015185245 [1,0,1,0,0,0|2,0,0]=4 281 B17R2.346 Cc1ccc(cc1)CCNCc2nccs2 207a_100000705350_100000750902 [1,0,1,0,0,0|2,0,0]=4 282 B17R2.346 Cc1ccc(cc1)CCNCc2nccs2 2230a_100000705350_100015184050 [1,0,1,0,0,0|2,0,0]=4 283 B17R2.346 Cc1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100011713686 [1,0,1,0,0,0|2,0,0]=4 284 B17R2.346 Cc1ccc(cc1)CCNCc2nccs2 270004a_100000705350_100000750902 [1,0,1,0,0,0|2,0,0]=4 285 B17R2.346 Cc1ccc(cc1)CCNCc2nccs2 34a_100000705350_100015184050 [1,0,1,0,0,0|2,0,0]=4 286 B17R2.346 Cc1ccc(cc1)CCOCc2cccs2 34a_100000211240_100011713686 [1,0,1,0,0,0|2,0,0]=4 287 B17R2.346 Clc1ccc(cc1)CCNCc2ccco2 207a_100000185265_100000186105 [1,0,1,0,0,0|1,1,0]=4 288 B17R2.346 Clc1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100011713675 [1,0,1,0,0,0|1,1,0]=4 289 B17R2.346 Clc1ccc(cc1)CCNCc2ccco2 270004a_100000185265_100000186105 [1,0,1,0,0,0|1,1,0]=4 290 B17R2.346 Clc1ccc(cc1)CCNCc2ccco2 34a_100000185738_100011713675 [1,0,1,0,0,0|1,1,0]=4 291 B17R2.346 Clc1ccc(cc1)CCNCc2cccs2 207a_100000185265_100000209959 [1,0,1,0,0,0|1,0,0]=3 292 B17R2.346 Clc1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100011713675 [1,0,1,0,0,0|1,0,0]=3 293 B17R2.346 Clc1ccc(cc1)CCNCc2cccs2 270004a_100000185265_100000209959 [1,0,1,0,0,0|1,0,0]=3 294 B17R2.346 Clc1ccc(cc1)CCNCc2cncs2 207a_100000185265_100000749870 [1,0,1,0,0,0|2,0,0]=4 295 B17R2.346 Clc1ccc(cc1)CCNCc2cncs2 2230a_100000185265_100015185245 [1,0,1,0,0,0|2,0,0]=4 296 B17R2.346 Clc1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100011713675 [1,0,1,0,0,0|2,0,0]=4 297 B17R2.346 Clc1ccc(cc1)CCNCc2cncs2 270004a_100000185265_100000749870 [1,0,1,0,0,0|2,0,0]=4 298 B17R2.346 Clc1ccc(cc1)CCNCc2cncs2 34a_100000185265_100015185245 [1,0,1,0,0,0|2,0,0]=4 299 B17R2.346 Clc1ccc(cc1)CCNCc2nccs2 207a_100000185265_100000750902 [1,0,1,0,0,0|2,0,0]=4 300 B17R2.346 Clc1ccc(cc1)CCNCc2nccs2 2230a_100000185265_100015184050 [1,0,1,0,0,0|2,0,0]=4 301 B17R2.346 Clc1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100011713675 [1,0,1,0,0,0|2,0,0]=4 302 B17R2.346 Clc1ccc(cc1)CCNCc2nccs2 270004a_100000185265_100000750902 [1,0,1,0,0,0|2,0,0]=4 303 B17R2.346 Clc1ccc(cc1)CCNCc2nccs2 34a_100000185265_100015184050 [1,0,1,0,0,0|2,0,0]=4 304 B17R2.346 Clc1ccc(cc1)CCOCc2cccs2 34a_100000211240_100011713675 [1,0,1,0,0,0|2,0,0]=4 305 B17R2.346 Fc1ccc(cc1)CCNCc2ccco2 207a_100000199005_100000186105 [1,0,1,0,0,0|1,1,0]=4 306 B17R2.346 Fc1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100011217392 [1,0,1,0,0,0|1,1,0]=4 307 B17R2.346 Fc1ccc(cc1)CCNCc2ccco2 270004a_100000199005_100000186105 [1,0,1,0,0,0|1,1,0]=4 308 B17R2.346 Fc1ccc(cc1)CCNCc2ccco2 34a_100000185738_100011217392 [1,0,1,0,0,0|1,1,0]=4 309 B17R2.346 Fc1ccc(cc1)CCNCc2cccs2 207a_100000199005_100000209959 [1,0,1,0,0,0|1,0,0]=3 310 B17R2.346 Fc1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100011217392 [1,0,1,0,0,0|1,0,0]=3 311 B17R2.346 Fc1ccc(cc1)CCNCc2cccs2 270004a_100000199005_100000209959 [1,0,1,0,0,0|1,0,0]=3 312 B17R2.346 Fc1ccc(cc1)CCNCc2cncs2 207a_100000199005_100000749870 [1,0,1,0,0,0|2,0,0]=4 313 B17R2.346 Fc1ccc(cc1)CCNCc2cncs2 2230a_100000199005_100015185245 [1,0,1,0,0,0|2,0,0]=4 314 B17R2.346 Fc1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100011217392 [1,0,1,0,0,0|2,0,0]=4 315 B17R2.346 Fc1ccc(cc1)CCNCc2cncs2 270004a_100000199005_100000749870 [1,0,1,0,0,0|2,0,0]=4 316 B17R2.346 Fc1ccc(cc1)CCNCc2cncs2 34a_100000199005_100015185245 [1,0,1,0,0,0|2,0,0]=4 317 B17R2.346 Fc1ccc(cc1)CCNCc2nccs2 207a_100000199005_100000750902 [1,0,1,0,0,0|2,0,0]=4 318 B17R2.346 Fc1ccc(cc1)CCNCc2nccs2 2230a_100000199005_100015184050 [1,0,1,0,0,0|2,0,0]=4 319 B17R2.346 Fc1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100011217392 [1,0,1,0,0,0|2,0,0]=4 320 B17R2.346 Fc1ccc(cc1)CCNCc2nccs2 270004a_100000199005_100000750902 [1,0,1,0,0,0|2,0,0]=4 321 B17R2.346 Fc1ccc(cc1)CCNCc2nccs2 34a_100000199005_100015184050 [1,0,1,0,0,0|2,0,0]=4 322 B17R2.346 Fc1ccc(cc1)CCOCc2cccs2 34a_100000211240_100011217392 [1,0,1,0,0,0|2,0,0]=4 323 B17R2.346 Oc1ccc(cc1)CCNCc2c[nH]cn2 34a_100000743037_100000707719 [1,0,1,0,0,0|2,0,0]=4 324 B17R2.346 Oc1ccc(cc1)CCNCc2cc[nH]n2 207a_100000743037_100000738523 [1,0,1,0,0,0|2,0,0]=4 325 B17R2.346 Oc1ccc(cc1)CCNCc2cc[nH]n2 270004a_100000743037_100000738523 [1,0,1,0,0,0|2,0,0]=4 326 B17R2.346 Oc1ccc(cc1)CCNCc2ccco2 207a_100000743037_100000186105 [1,0,1,0,0,0|0,1,0]=3 327 B17R2.346 Oc1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100009816426 [1,0,1,0,0,0|0,1,0]=3 328 B17R2.346 Oc1ccc(cc1)CCNCc2ccco2 270004a_100000743037_100000186105 [1,0,1,0,0,0|0,1,0]=3 329 B17R2.346 Oc1ccc(cc1)CCNCc2cccs2 207a_100000743037_100000209959 [1,0,1,0,0,0|0,0,0]=2 330 B17R2.346 Oc1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100009816426 [1,0,1,0,0,0|0,0,0]=2 331 B17R2.346 Oc1ccc(cc1)CCNCc2cccs2 270004a_100000743037_100000209959 [1,0,1,0,0,0|0,0,0]=2 332 B17R2.346 Oc1ccc(cc1)CCNCc2ccn[nH]2 34a_100000743037_100000728653 [1,0,1,0,0,0|2,0,0]=4 333 B17R2.346 Oc1ccc(cc1)CCNCc2ccoc2 207a_100000743037_100011215517 [1,0,1,0,0,0|2,0,0]=4 334 B17R2.346 Oc1ccc(cc1)CCNCc2ccoc2 2230a_100015206860_100009816426 [1,0,1,0,0,0|2,0,0]=4 335 B17R2.346 Oc1ccc(cc1)CCNCc2ccoc2 270004a_100000743037_100011215517 [1,0,1,0,0,0|2,0,0]=4 336 B17R2.346 Oc1ccc(cc1)CCNCc2ccon2 34a_100000743037_100000234950 [1,0,1,0,0,0|2,0,0]=4 337 B17R2.346 Oc1ccc(cc1)CCNCc2ccsc2 207a_100000743037_100000188534 [1,0,1,0,0,0|2,0,0]=4 338 B17R2.346 Oc1ccc(cc1)CCNCc2ccsc2 2230a_100000186416_100009816426 [1,0,1,0,0,0|2,0,0]=4 339 B17R2.346 Oc1ccc(cc1)CCNCc2ccsc2 270004a_100000743037_100000188534 [1,0,1,0,0,0|2,0,0]=4 340 B17R2.346 Oc1ccc(cc1)CCNCc2ccsc2 34a_100000743037_100011261437 [1,0,1,0,0,0|2,0,0]=4 341 B17R2.346 Oc1ccc(cc1)CCNCc2cnc[nH]2 207a_100000743037_100000742939 [1,0,1,0,0,0|2,0,0]=4 342 B17R2.346 Oc1ccc(cc1)CCNCc2cnco2 270004a_100000743037_100000064291 [1,0,1,0,0,0|1,1,0]=4 343 B17R2.346 Oc1ccc(cc1)CCNCc2cncs2 207a_100000743037_100000749870 [1,0,1,0,0,0|1,0,0]=3 344 B17R2.346 Oc1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100009816426 [1,0,1,0,0,0|1,0,0]=3 345 B17R2.346 Oc1ccc(cc1)CCNCc2cncs2 270004a_100000743037_100000749870 [1,0,1,0,0,0|1,0,0]=3 346 B17R2.346 Oc1ccc(cc1)CCNCc2cncs2 34a_100000743037_100015185245 [1,0,1,0,0,0|1,0,0]=3 347 B17R2.346 Oc1ccc(cc1)CCNCc2cocn2 270004a_100000743037_100000050382 [1,0,1,0,0,0|2,0,0]=4 348 B17R2.346 Oc1ccc(cc1)CCNCc2cscn2 207a_100000743037_100000743575 [1,0,1,0,0,0|2,0,0]=4 349 B17R2.346 Oc1ccc(cc1)CCNCc2cscn2 2230a_100015185402_100009816426 [1,0,1,0,0,0|2,0,0]=4 350 B17R2.346 Oc1ccc(cc1)CCNCc2cscn2 270004a_100000743037_100000743575 [1,0,1,0,0,0|2,0,0]=4 351 B17R2.346 Oc1ccc(cc1)CCNCc2cscn2 34a_100000743037_100000205941 [1,0,1,0,0,0|2,0,0]=4 352 B17R2.346 Oc1ccc(cc1)CCNCc2ncc[nH]2 207a_100000743037_100000743867 [1,0,1,0,0,0|2,0,0]=4 353 B17R2.346 Oc1ccc(cc1)CCNCc2ncc[nH]2 34a_100000743037_100016991755 [1,0,1,0,0,0|2,0,0]=4 354 B17R2.346 Oc1ccc(cc1)CCNCc2ncco2 2230a_100016994969_100009816426 [1,0,1,0,0,0|1,1,0]=4 355 B17R2.346 Oc1ccc(cc1)CCNCc2ncco2 270004a_100000743037_100000064290 [1,0,1,0,0,0|1,1,0]=4 356 B17R2.346 Oc1ccc(cc1)CCNCc2ncco2 34a_100000743037_103436540062 [1,0,1,0,0,0|1,1,0]=4 357 B17R2.346 Oc1ccc(cc1)CCNCc2nccs2 207a_100000743037_100000750902 [1,0,1,0,0,0|1,0,0]=3 358 B17R2.346 Oc1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100009816426 [1,0,1,0,0,0|1,0,0]=3 359 B17R2.346 Oc1ccc(cc1)CCNCc2nccs2 270004a_100000743037_100000750902 [1,0,1,0,0,0|1,0,0]=3 360 B17R2.346 Oc1ccc(cc1)CCNCc2nccs2 34a_100000743037_100015184050 [1,0,1,0,0,0|1,0,0]=3 361 B17R2.346 Oc1ccc(cc1)CCSCc2cncs2 62a_100009816426_100015185245 [1,0,1,0,0,0|2,0,0]=4 362 B17R2.346 Oc1ccc(cc1)CCSCc2cncs2 62a_100015185245_100009816426 [1,0,1,0,0,0|2,0,0]=4 363 B17R2.346 Oc1ccc(cc1)CCSCc2nccs2 62a_100009816426_100015184050 [1,0,1,0,0,0|2,0,0]=4 364 B17R2.346 Oc1ccc(cc1)CCSCc2nccs2 62a_100015184050_100009816426 [1,0,1,0,0,0|2,0,0]=4 365 B17R2.346 Oc1ccc(cc1)CNCCc2cccs2 34a_100000185549_100000748579 [1,0,1,0,0,0|2,0,0]=4 366 B17R2.346 Oc1ccc(cc1)NCCCc2cccs2 34a_100000185829_100010992444 [1,0,1,0,0,0|2,0,0]=4 367 B17R2.346 Oc1ccc(cc1)SCCCc2cccs2 62a_100010992444_100000185759 [1,0,1,0,0,0|2,0,0]=4 368 B17R2.3366 Brc1cccc(c1)CCNCc2ccco2 207a_100011207229_100000186105 [1,0,1,0,0,0|1,1,0]=4 369 B17R2.3366 Brc1cccc(c1)CCNCc2ccco2 2230a_100000185738_100011740638 [1,0,1,0,0,0|1,1,0]=4 370 B17R2.3366 Brc1cccc(c1)CCNCc2ccco2 270004a_100011207229_100000186105 [1,0,1,0,0,0|1,1,0]=4 371 B17R2.3366 Brc1cccc(c1)CCNCc2ccco2 34a_100000185738_100011740638 [1,0,1,0,0,0|1,1,0]=4 372 B17R2.3366 Brc1cccc(c1)CCNCc2cccs2 207a_100011207229_100000209959 [1,0,1,0,0,0|1,0,0]=3 373 B17R2.3366 Brc1cccc(c1)CCNCc2cccs2 2230a_100000211653_100011740638 [1,0,1,0,0,0|1,0,0]=3 374 B17R2.3366 Brc1cccc(c1)CCNCc2cccs2 270004a_100011207229_100000209959 [1,0,1,0,0,0|1,0,0]=3 375 B17R2.3366 Brc1cccc(c1)CCNCc2cncs2 207a_100011207229_100000749870 [1,0,1,0,0,0|2,0,0]=4 376 B17R2.3366 Brc1cccc(c1)CCNCc2cncs2 2230a_100011207229_100015185245 [1,0,1,0,0,0|2,0,0]=4 377 B17R2.3366 Brc1cccc(c1)CCNCc2cncs2 2230a_100016987365_100011740638 [1,0,1,0,0,0|2,0,0]=4 378 B17R2.3366 Brc1cccc(c1)CCNCc2cncs2 270004a_100011207229_100000749870 [1,0,1,0,0,0|2,0,0]=4 379 B17R2.3366 Brc1cccc(c1)CCNCc2cncs2 34a_100011207229_100015185245 [1,0,1,0,0,0|2,0,0]=4 380 B17R2.3366 Brc1cccc(c1)CCNCc2nccs2 207a_100011207229_100000750902 [1,0,1,0,0,0|2,0,0]=4 381 B17R2.3366 Brc1cccc(c1)CCNCc2nccs2 2230a_100000740555_100011740638 [1,0,1,0,0,0|2,0,0]=4 382 B17R2.3366 Brc1cccc(c1)CCNCc2nccs2 2230a_100011207229_100015184050 [1,0,1,0,0,0|2,0,0]=4 383 B17R2.3366 Brc1cccc(c1)CCNCc2nccs2 270004a_100011207229_100000750902 [1,0,1,0,0,0|2,0,0]=4 384 B17R2.3366 Brc1cccc(c1)CCNCc2nccs2 34a_100011207229_100015184050 [1,0,1,0,0,0|2,0,0]=4 385 B17R2.3366 Brc1cccc(c1)CCOCc2cccs2 34a_100000211240_100011740638 [1,0,1,0,0,0|2,0,0]=4 386 B17R2.3366 Cc1cccc(c1)CCNCc2ccco2 207a_100000749837_100000186105 [1,0,1,0,0,0|1,1,0]=4 387 B17R2.3366 Cc1cccc(c1)CCNCc2ccco2 2230a_100000185738_100011713685 [1,0,1,0,0,0|1,1,0]=4 388 B17R2.3366 Cc1cccc(c1)CCNCc2ccco2 270004a_100000749837_100000186105 [1,0,1,0,0,0|1,1,0]=4 389 B17R2.3366 Cc1cccc(c1)CCNCc2ccco2 34a_100000185738_100011713685 [1,0,1,0,0,0|1,1,0]=4 390 B17R2.3366 Cc1cccc(c1)CCNCc2cccs2 207a_100000749837_100000209959 [1,0,1,0,0,0|1,0,0]=3 391 B17R2.3366 Cc1cccc(c1)CCNCc2cccs2 2230a_100000211653_100011713685 [1,0,1,0,0,0|1,0,0]=3 392 B17R2.3366 Cc1cccc(c1)CCNCc2cccs2 270004a_100000749837_100000209959 [1,0,1,0,0,0|1,0,0]=3 393 B17R2.3366 Cc1cccc(c1)CCNCc2cncs2 207a_100000749837_100000749870 [1,0,1,0,0,0|2,0,0]=4 394 B17R2.3366 Cc1cccc(c1)CCNCc2cncs2 2230a_100000749837_100015185245 [1,0,1,0,0,0|2,0,0]=4 395 B17R2.3366 Cc1cccc(c1)CCNCc2cncs2 2230a_100016987365_100011713685 [1,0,1,0,0,0|2,0,0]=4 396 B17R2.3366 Cc1cccc(c1)CCNCc2cncs2 270004a_100000749837_100000749870 [1,0,1,0,0,0|2,0,0]=4 397 B17R2.3366 Cc1cccc(c1)CCNCc2cncs2 34a_100000749837_100015185245 [1,0,1,0,0,0|2,0,0]=4 398 B17R2.3366 Cc1cccc(c1)CCNCc2nccs2 207a_100000749837_100000750902 [1,0,1,0,0,0|2,0,0]=4 399 B17R2.3366 Cc1cccc(c1)CCNCc2nccs2 2230a_100000740555_100011713685 [1,0,1,0,0,0|2,0,0]=4 400 B17R2.3366 Cc1cccc(c1)CCNCc2nccs2 2230a_100000749837_100015184050 [1,0,1,0,0,0|2,0,0]=4 401 B17R2.3366 Cc1cccc(c1)CCNCc2nccs2 270004a_100000749837_100000750902 [1,0,1,0,0,0|2,0,0]=4 402 B17R2.3366 Cc1cccc(c1)CCNCc2nccs2 34a_100000749837_100015184050 [1,0,1,0,0,0|2,0,0]=4 403 B17R2.3366 Cc1cccc(c1)CCOCc2cccs2 34a_100000211240_100011713685 [1,0,1,0,0,0|2,0,0]=4 404 B17R2.3366 Cc1cccc(n1)CCNCc2cccs2 207a_100011824523_100000209959 [1,0,1,0,0,0|2,0,0]=4 405 B17R2.3366 Cc1cccc(n1)CCNCc2cccs2 270004a_100011824523_100000209959 [1,0,1,0,0,0|2,0,0]=4 406 B17R2.3366 Clc1cccc(c1)CCNCc2ccco2 207a_100000185263_100000186105 [1,0,1,0,0,0|1,1,0]=4 407 B17R2.3366 Clc1cccc(c1)CCNCc2ccco2 2230a_100000185738_100011713710 [1,0,1,0,0,0|1,1,0]=4 408 B17R2.3366 Clc1cccc(c1)CCNCc2ccco2 270004a_100000185263_100000186105 [1,0,1,0,0,0|1,1,0]=4 409 B17R2.3366 Clc1cccc(c1)CCNCc2ccco2 34a_100000185738_100011713710 [1,0,1,0,0,0|1,1,0]=4 410 B17R2.3366 Clc1cccc(c1)CCNCc2cccs2 207a_100000185263_100000209959 [1,0,1,0,0,0|1,0,0]=3 411 B17R2.3366 Clc1cccc(c1)CCNCc2cccs2 2230a_100000211653_100011713710 [1,0,1,0,0,0|1,0,0]=3 412 B17R2.3366 Clc1cccc(c1)CCNCc2cccs2 270004a_100000185263_100000209959 [1,0,1,0,0,0|1,0,0]=3 413 B17R2.3366 Clc1cccc(c1)CCNCc2cncs2 207a_100000185263_100000749870 [1,0,1,0,0,0|2,0,0]=4 414 B17R2.3366 Clc1cccc(c1)CCNCc2cncs2 2230a_100000185263_100015185245 [1,0,1,0,0,0|2,0,0]=4 415 B17R2.3366 Clc1cccc(c1)CCNCc2cncs2 2230a_100016987365_100011713710 [1,0,1,0,0,0|2,0,0]=4 416 B17R2.3366 Clc1cccc(c1)CCNCc2cncs2 270004a_100000185263_100000749870 [1,0,1,0,0,0|2,0,0]=4 417 B17R2.3366 Clc1cccc(c1)CCNCc2cncs2 34a_100000185263_100015185245 [1,0,1,0,0,0|2,0,0]=4 418 B17R2.3366 Clc1cccc(c1)CCNCc2nccs2 207a_100000185263_100000750902 [1,0,1,0,0,0|2,0,0]=4 419 B17R2.3366 Clc1cccc(c1)CCNCc2nccs2 2230a_100000185263_100015184050 [1,0,1,0,0,0|2,0,0]=4 420 B17R2.3366 Clc1cccc(c1)CCNCc2nccs2 2230a_100000740555_100011713710 [1,0,1,0,0,0|2,0,0]=4 421 B17R2.3366 Clc1cccc(c1)CCNCc2nccs2 270004a_100000185263_100000750902 [1,0,1,0,0,0|2,0,0]=4 422 B17R2.3366 Clc1cccc(c1)CCNCc2nccs2 34a_100000185263_100015184050 [1,0,1,0,0,0|2,0,0]=4 423 B17R2.3366 Clc1cccc(c1)CCOCc2cccs2 34a_100000211240_100011713710 [1,0,1,0,0,0|2,0,0]=4 424 B17R2.3366 Fc1cccc(c1)CCNCc2ccco2 207a_100000205154_100000186105 [1,0,1,0,0,0|1,1,0]=4 425 B17R2.3366 Fc1cccc(c1)CCNCc2ccco2 2230a_100000185738_100011217235 [1,0,1,0,0,0|1,1,0]=4 426 B17R2.3366 Fc1cccc(c1)CCNCc2ccco2 270004a_100000205154_100000186105 [1,0,1,0,0,0|1,1,0]=4 427 B17R2.3366 Fc1cccc(c1)CCNCc2ccco2 34a_100000185738_100011217235 [1,0,1,0,0,0|1,1,0]=4 428 B17R2.3366 Fc1cccc(c1)CCNCc2cccs2 207a_100000205154_100000209959 [1,0,1,0,0,0|1,0,0]=3 429 B17R2.3366 Fc1cccc(c1)CCNCc2cccs2 2230a_100000211653_100011217235 [1,0,1,0,0,0|1,0,0]=3 430 B17R2.3366 Fc1cccc(c1)CCNCc2cccs2 270004a_100000205154_100000209959 [1,0,1,0,0,0|1,0,0]=3 431 B17R2.3366 Fc1cccc(c1)CCNCc2cncs2 207a_100000205154_100000749870 [1,0,1,0,0,0|2,0,0]=4 432 B17R2.3366 Fc1cccc(c1)CCNCc2cncs2 2230a_100000205154_100015185245 [1,0,1,0,0,0|2,0,0]=4 433 B17R2.3366 Fc1cccc(c1)CCNCc2cncs2 2230a_100016987365_100011217235 [1,0,1,0,0,0|2,0,0]=4 434 B17R2.3366 Fc1cccc(c1)CCNCc2cncs2 270004a_100000205154_100000749870 [1,0,1,0,0,0|2,0,0]=4 435 B17R2.3366 Fc1cccc(c1)CCNCc2cncs2 34a_100000205154_100015185245 [1,0,1,0,0,0|2,0,0]=4 436 B17R2.3366 Fc1cccc(c1)CCNCc2nccs2 207a_100000205154_100000750902 [1,0,1,0,0,0|2,0,0]=4 437 B17R2.3366 Fc1cccc(c1)CCNCc2nccs2 2230a_100000205154_100015184050 [1,0,1,0,0,0|2,0,0]=4 438 B17R2.3366 Fc1cccc(c1)CCNCc2nccs2 2230a_100000740555_100011217235 [1,0,1,0,0,0|2,0,0]=4 439 B17R2.3366 Fc1cccc(c1)CCNCc2nccs2 270004a_100000205154_100000750902 [1,0,1,0,0,0|2,0,0]=4 440 B17R2.3366 Fc1cccc(c1)CCNCc2nccs2 34a_100000205154_100015184050 [1,0,1,0,0,0|2,0,0]=4 441 B17R2.3366 Fc1cccc(c1)CCOCc2cccs2 34a_100000211240_100011217235 [1,0,1,0,0,0|2,0,0]=4 442 B17R2.3366 Oc1cccc(c1)CCNCc2c[nH]cn2 2230a_100000747277_100000707719 [1,0,1,0,0,0|2,0,0]=4 443 B17R2.3366 Oc1cccc(c1)CCNCc2c[nH]cn2 34a_100000747277_100000707719 [1,0,1,0,0,0|2,0,0]=4 444 B17R2.3366 Oc1cccc(c1)CCNCc2ccn[nH]2 2230a_100000747277_100000728653 [1,0,1,0,0,0|2,0,0]=4 445 B17R2.3366 Oc1cccc(c1)CCNCc2ccn[nH]2 34a_100000747277_100000728653 [1,0,1,0,0,0|2,0,0]=4 446 B17R2.3366 Oc1cccc(c1)CCNCc2ccon2 2230a_100000747277_100000234950 [1,0,1,0,0,0|2,0,0]=4 447 B17R2.3366 Oc1cccc(c1)CCNCc2ccon2 34a_100000747277_100000234950 [1,0,1,0,0,0|2,0,0]=4 448 B17R2.3366 Oc1cccc(c1)CCNCc2ccsc2 2230a_100000747277_100011261437 [1,0,1,0,0,0|2,0,0]=4 449 B17R2.3366 Oc1cccc(c1)CCNCc2ccsc2 34a_100000747277_100011261437 [1,0,1,0,0,0|2,0,0]=4 450 B17R2.3366 Oc1cccc(c1)CCNCc2cncs2 2230a_100000747277_100015185245 [1,0,1,0,0,0|1,0,0]=3 451 B17R2.3366 Oc1cccc(c1)CCNCc2cncs2 34a_100000747277_100015185245 [1,0,1,0,0,0|1,0,0]=3 452 B17R2.3366 Oc1cccc(c1)CCNCc2cscn2 2230a_100000747277_100000205941 [1,0,1,0,0,0|2,0,0]=4 453 B17R2.3366 Oc1cccc(c1)CCNCc2cscn2 34a_100000747277_100000205941 [1,0,1,0,0,0|2,0,0]=4 454 B17R2.3366 Oc1cccc(c1)CCNCc2ncc[nH]2 2230a_100000747277_100016991755 [1,0,1,0,0,0|2,0,0]=4 455 B17R2.3366 Oc1cccc(c1)CCNCc2ncc[nH]2 34a_100000747277_100016991755 [1,0,1,0,0,0|2,0,0]=4 456 B17R2.3366 Oc1cccc(c1)CCNCc2ncco2 2230a_100000747277_103436540062 [1,0,1,0,0,0|1,1,0]=4 457 B17R2.3366 Oc1cccc(c1)CCNCc2ncco2 34a_100000747277_103436540062 [1,0,1,0,0,0|1,1,0]=4 458 B17R2.3366 Oc1cccc(c1)CCNCc2nccs2 2230a_100000747277_100015184050 [1,0,1,0,0,0|1,0,0]=3 459 B17R2.3366 Oc1cccc(c1)CCNCc2nccs2 34a_100000747277_100015184050 [1,0,1,0,0,0|1,0,0]=3 460 B17R2.3366 Oc1cccc(c1)CNCCc2cccs2 207a_100000203755_100000188321 [1,0,1,0,0,0|2,0,0]=4 461 B17R2.3366 Oc1cccc(c1)CNCCc2cccs2 2230a_100000203755_100011660834 [1,0,1,0,0,0|2,0,0]=4 462 B17R2.3366 Oc1cccc(c1)CNCCc2cccs2 2230a_100000743036_100000748579 [1,0,1,0,0,0|2,0,0]=4 463 B17R2.3366 Oc1cccc(c1)CNCCc2cccs2 270004a_100000203755_100000188321 [1,0,1,0,0,0|2,0,0]=4 464 B17R2.3366 Oc1cccc(c1)CNCCc2cccs2 34a_100000203755_100011660834 [1,0,1,0,0,0|2,0,0]=4 465 B17R2.3366 Oc1cccc(c1)CNCCc2cccs2 34a_100000743036_100000748579 [1,0,1,0,0,0|2,0,0]=4 466 B17R2.3366 Oc1cccc(c1)COCCc2cccs2 34a_100011216825_100011660834 [1,0,1,0,0,0|2,0,0]=4 467 B17R2.3366 Oc1cccc(c1)COCCc2cccs2 7a_100011216825_100000084143 [1,0,1,0,0,0|2,0,0]=4 468 B17R2.3366 Oc1cccc(c1)CSCCc2cccs2 62a_100000748579_100011660834 [1,0,1,0,0,0|2,0,0]=4 469 B17R2.3366 Oc1cccc(c1)CSCCc2cccs2 62a_100011660834_100000748579 [1,0,1,0,0,0|2,0,0]=4 470 B17R2.3366 Oc1cccc(c1)NCCCc2cccs2 34a_100000210217_100010992444 [1,0,1,0,0,0|2,0,0]=4 471 B17R2.3366 Oc1cccc(c1)SCCCc2cccs2 62a_100010992444_100000211634 [1,0,1,0,0,0|2,0,0]=4 472 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2C)C)O 62a_100000767120_100012353674 [0,1,1,0,0,0|2,0,0]=4 473 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2C)C)O 62a_100012353674_100000767120 [0,1,1,0,0,0|2,0,0]=4 474 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2C)N)O 62a_100000767120_100013039247 [0,1,1,0,0,0|2,0,0]=4 475 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2C)N)O 62a_100013039247_100000767120 [0,1,1,0,0,0|2,0,0]=4 476 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2F)C)O 62a_100000767120_100010390934 [0,1,1,0,0,0|2,0,0]=4 477 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2F)C)O 62a_100010390934_100000767120 [0,1,1,0,0,0|2,0,0]=4 478 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2F)F)O 62a_100000767120_100011830415 [0,1,1,0,0,0|2,0,0]=4 479 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2F)F)O 62a_100011830415_100000767120 [0,1,1,0,0,0|2,0,0]=4 480 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2F)O)Br 62a_100000767120_200010782288 [0,1,1,0,0,0|2,0,0]=4 481 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2F)O)Br 62a_200010782288_100000767120 [0,1,1,0,0,0|2,0,0]=4 482 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2F)O)F 62a_100000767120_100010167067 [0,1,1,0,0,0|2,0,0]=4 483 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2F)O)F 62a_100010167067_100000767120 [0,1,1,0,0,0|2,0,0]=4 484 B19R2.6368 CNCc1sccc1Sc2ccc(c(c2N)O)Br 62a_100020748643_100000767120 [0,1,1,0,0,0|2,0,0]=4 485 B19R2.6369 CNCc1sccc1Sc2cc(c(cn2)OC)O 62a_100000767120_100010264082 [0,1,1,0,0,0|2,0,0]=4 486 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)Br)CO 62a_100000767120_100010240206 [0,1,1,0,0,0|2,0,0]=4 487 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)Br)CO 62a_100010240206_100000767120 [0,1,1,0,0,0|2,0,0]=4 488 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)Br)OC 62a_100000767120_100011249507 [0,1,1,0,0,0|2,0,0]=4 489 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)Br)OC 62a_100011249507_100000767120 [0,1,1,0,0,0|2,0,0]=4 490 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)C)CO 62a_100000748258_100000767120 [0,1,1,0,0,0|2,0,0]=4 491 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)C)CO 62a_100000767120_100000748258 [0,1,1,0,0,0|2,0,0]=4 492 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)C)OC 62a_100000767120_100011219705 [0,1,1,0,0,0|2,0,0]=4 493 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)C)OC 62a_100011219705_100000767120 [0,1,1,0,0,0|2,0,0]=4 494 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)Cl)OC 62a_100000767120_100012355395 [0,1,1,0,0,0|2,0,0]=4 495 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)Cl)OC 62a_100012355395_100000767120 [0,1,1,0,0,0|2,0,0]=4 496 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)F)CO 62a_100000767120_100011191541 [0,1,1,0,0,0|2,0,0]=4 497 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)F)CO 62a_100011191541_100000767120 [0,1,1,0,0,0|2,0,0]=4 498 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)F)OC 62a_100000171752_100000767120 [0,1,1,0,0,0|2,0,0]=4 499 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)F)OC 62a_100000767120_100000171752 [0,1,1,0,0,0|2,0,0]=4 500 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)N)CO 62a_100000718831_100000767120 [0,1,1,0,0,0|2,0,0]=4 501 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)N)CO 62a_100000767120_100000718831 [0,1,1,0,0,0|2,0,0]=4 502 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)N)OC 62a_100000767120_100011249504 [0,1,1,0,0,0|2,0,0]=4 503 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)N)OC 62a_100011249504_100000767120 [0,1,1,0,0,0|2,0,0]=4 504 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)O)C#N 62a_100000767120_100011934713 [0,1,1,0,0,0|2,0,0]=4 505 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)O)C=O 62a_100000767120_100011277552 [0,1,1,0,0,0|1,0,1]=4 506 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)O)C=O 62a_100011277552_100000767120 [0,1,1,0,0,0|1,0,1]=4 507 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)O)CO 62a_100000071718_100000767120 [0,1,1,0,0,0|1,0,0]=3 508 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)O)CO 62a_100000767120_100000071718 [0,1,1,0,0,0|1,0,0]=3 509 B19R2.6369 CNCc1sccc1Sc2ccc(c(c2)O)OC 62a_100000767120_100009816560 [0,1,1,0,0,0|1,0,0]=3 510 B19R2.6369 CNCc1sccc1Sc2cnc(c(c2)O)OC 62a_100000767120_100010135713 [0,1,1,0,0,0|2,0,0]=4 511 B19R2.6370 CCc1cc(ccc1O)Sc2ccsc2CNC 62a_100000767120_100012338938 [0,1,1,0,0,0|2,0,0]=4 512 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)C#N)O 62a_100000767120_100000687585 [0,1,1,0,0,0|2,0,0]=4 513 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)C=O)O 62a_100000767120_100000186750 [0,1,1,0,0,0|1,0,1]=4 514 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CN)O 62a_100000730032_100000767120 [0,1,1,0,0,0|2,0,0]=4 515 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CN)O 62a_100000767120_100000730032 [0,1,1,0,0,0|2,0,0]=4 516 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)Br 62a_100000767120_100012359683 [0,1,1,0,0,0|2,0,0]=4 517 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)Br 62a_100012359683_100000767120 [0,1,1,0,0,0|2,0,0]=4 518 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)C 62a_100000700630_100000767120 [0,1,1,0,0,0|2,0,0]=4 519 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)C 62a_100000767120_100000700630 [0,1,1,0,0,0|2,0,0]=4 520 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)Cl 62a_100000767120_100010128486 [0,1,1,0,0,0|2,0,0]=4 521 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)Cl 62a_100010128486_100000767120 [0,1,1,0,0,0|2,0,0]=4 522 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)F 62a_100000246282_100000767120 [0,1,1,0,0,0|2,0,0]=4 523 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)F 62a_100000767120_100000246282 [0,1,1,0,0,0|2,0,0]=4 524 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)N 62a_100000767120_100012353972 [0,1,1,0,0,0|2,0,0]=4 525 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)N 62a_100012353972_100000767120 [0,1,1,0,0,0|2,0,0]=4 526 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)O 62a_100000184703_100000767120 [0,1,1,0,0,0|1,0,0]=3 527 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)CO)O 62a_100000767120_100000184703 [0,1,1,0,0,0|1,0,0]=3 528 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)Br 62a_100000767120_100012353699 [0,1,1,0,0,0|2,0,0]=4 529 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)Br 62a_100012353699_100000767120 [0,1,1,0,0,0|2,0,0]=4 530 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)C 62a_100000767120_100011830276 [0,1,1,0,0,0|2,0,0]=4 531 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)C 62a_100011830276_100000767120 [0,1,1,0,0,0|2,0,0]=4 532 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)Cl 62a_100000767120_100011356853 [0,1,1,0,0,0|2,0,0]=4 533 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)Cl 62a_100011356853_100000767120 [0,1,1,0,0,0|2,0,0]=4 534 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)F 62a_100000767120_100011934186 [0,1,1,0,0,0|2,0,0]=4 535 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)F 62a_100011934186_100000767120 [0,1,1,0,0,0|2,0,0]=4 536 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)N 62a_100000767120_100015196925 [0,1,1,0,0,0|2,0,0]=4 537 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)N 62a_100011279103_100000767120 [0,1,1,0,0,0|2,0,0]=4 538 B19R2.6370 CNCc1sccc1Sc2ccc(c(c2)OC)O 62a_100000767120_100000694246 [0,1,1,0,0,0|1,0,0]=3 539 B19R2.6370 CNCc1sccc1Sc2ccc(c(n2)OC)O 62a_100000767120_100010893133 [0,1,1,0,0,0|2,0,0]=4 540 B19R2.6370 CNCc1sccc1Sc2cnc(c(c2)CO)O 62a_100000767120_100010065268 [0,1,1,0,0,0|2,0,0]=4 541 B19R2.6370 CNCc1sccc1Sc2cnc(c(c2)CO)O 62a_100010065268_100000767120 [0,1,1,0,0,0|2,0,0]=4 542 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2Br)Cl)O 62a_100000767120_100021297947 [0,1,1,0,0,0|2,0,0]=4 543 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2Br)Cl)O 62a_100021297947_100000767120 [0,1,1,0,0,0|2,0,0]=4 544 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2C)F)O 62a_100000767120_100010068922 [0,1,1,0,0,0|2,0,0]=4 545 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2C)F)O 62a_100010068922_100000767120 [0,1,1,0,0,0|2,0,0]=4 546 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2C)N)O 62a_100000767120_200010107346 [0,1,1,0,0,0|2,0,0]=4 547 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2C)N)O 62a_200010107346_100000767120 [0,1,1,0,0,0|2,0,0]=4 548 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2C)O)C 62a_100000698207_100000767120 [0,1,1,0,0,0|2,0,0]=4 549 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2C)O)C 62a_100000767120_100000698207 [0,1,1,0,0,0|2,0,0]=4 550 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2C)O)F 62a_100000767120_100012355673 [0,1,1,0,0,0|2,0,0]=4 551 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2C)O)F 62a_100012355673_100000767120 [0,1,1,0,0,0|2,0,0]=4 552 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2C)O)N 62a_100000767120_200010235796 [0,1,1,0,0,0|2,0,0]=4 553 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2C)O)N 62a_200010235796_100000767120 [0,1,1,0,0,0|2,0,0]=4 554 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2Cl)O)N 62a_100000767120_100011011175 [0,1,1,0,0,0|2,0,0]=4 555 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2Cl)O)N 62a_100011011175_100000767120 [0,1,1,0,0,0|2,0,0]=4 556 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)C)O 62a_100000767120_100014242602 [0,1,1,0,0,0|2,0,0]=4 557 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)C)O 62a_100014242602_100000767120 [0,1,1,0,0,0|2,0,0]=4 558 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)Cl)O 62a_100000767120_100010735246 [0,1,1,0,0,0|2,0,0]=4 559 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)Cl)O 62a_100010735246_100000767120 [0,1,1,0,0,0|2,0,0]=4 560 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)F)O 62a_100000767120_100012457948 [0,1,1,0,0,0|2,0,0]=4 561 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)F)O 62a_100012457948_100000767120 [0,1,1,0,0,0|2,0,0]=4 562 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)N)O 62a_100000767120_100013038943 [0,1,1,0,0,0|2,0,0]=4 563 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)N)O 62a_100013038943_100000767120 [0,1,1,0,0,0|2,0,0]=4 564 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)O)F 62a_100000767120_100011830439 [0,1,1,0,0,0|2,0,0]=4 565 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)O)F 62a_100011830439_100000767120 [0,1,1,0,0,0|2,0,0]=4 566 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)O)N 62a_100000767120_100012359894 [0,1,1,0,0,0|2,0,0]=4 567 B19R2.763310 CNCc1sccc1Sc2cc(c(cc2F)O)N 62a_100012359894_100000767120 [0,1,1,0,0,0|2,0,0]=4 568 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)Br)O)C 62a_100000767120_100010982682 [0,1,1,0,0,0|2,0,0]=4 569 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)Br)O)C 62a_100010982682_100000767120 [0,1,1,0,0,0|2,0,0]=4 570 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)C)O)C 62a_100000767120_100011216129 [0,1,1,0,0,0|2,0,0]=4 571 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)C)O)C 62a_100011216129_100000767120 [0,1,1,0,0,0|2,0,0]=4 572 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)Cl)O)C 62a_100000767120_200015900153 [0,1,1,0,0,0|2,0,0]=4 573 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)Cl)O)C 62a_200015900153_100000767120 [0,1,1,0,0,0|2,0,0]=4 574 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)Cl)O)Cl 62a_100000767120_100012339652 [0,1,1,0,0,0|2,0,0]=4 575 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)Cl)O)Cl 62a_100012339652_100000767120 [0,1,1,0,0,0|2,0,0]=4 576 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)F)F)O 62a_100000709865_100000767120 [0,1,1,0,0,0|2,0,0]=4 577 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)F)F)O 62a_100000767120_100000709865 [0,1,1,0,0,0|2,0,0]=4 578 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)F)N)O 62a_100000767120_100015475841 [0,1,1,0,0,0|2,0,0]=4 579 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)F)N)O 62a_100015475841_100000767120 [0,1,1,0,0,0|2,0,0]=4 580 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)F)O)F 62a_100000767120_100011216917 [0,1,1,0,0,0|2,0,0]=4 581 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)F)O)F 62a_100011216917_100000767120 [0,1,1,0,0,0|2,0,0]=4 582 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)F)O)N 62a_100000767120_100011217383 [0,1,1,0,0,0|2,0,0]=4 583 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)F)O)N 62a_100011217383_100000767120 [0,1,1,0,0,0|2,0,0]=4 584 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)F)O)O 62a_100000767120_100010114375 [0,1,1,0,0,0|1,0,0]=3 585 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)N)O)C 62a_100000767120_100011825904 [0,1,1,0,0,0|2,0,0]=4 586 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)N)O)C 62a_100011825904_100000767120 [0,1,1,0,0,0|2,0,0]=4 587 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)O)N)C 62a_100000767120_100010371313 [0,1,1,0,0,0|2,0,0]=4 588 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)O)N)C 62a_100010371313_100000767120 [0,1,1,0,0,0|2,0,0]=4 589 B19R2.763311 CNCc1sccc1Sc2cc(c(c(c2)O)O)O 62a_100000767120_100010658518 [0,1,1,0,0,0|1,0,0]=3 590 B19R2.11984 CC(Cc1ccc(c(c1)Cl)Cl)NCc2cccs2 270004a_100000211653_100011586667 [0,1,1,0,0,0|2,0,0]=4 591 B19R2.11984 Cc1cc(ccc1O)CC(=O)NCc2cccs2 240690a_100000211653_100000083968 [0,1,1,0,0,0|1,0,1]=4 592 B19R2.11984 Cc1cc(ccc1O)CC(=O)NCc2cccs2 527a_100000211653_100000083968 [0,1,1,0,0,0|1,0,1]=4 593 B19R2.11984 Cc1ccc(cc1O)CC(=O)NCc2cccs2 11a_100000211653_100000082272 [0,1,1,0,0,0|1,0,1]=4 594 B19R2.11984 Cc1ccc(cc1O)CC(=O)NCc2cccs2 240690a_100000211653_100000082272 [0,1,1,0,0,0|1,0,1]=4 595 B19R2.11984 Cc1ccc(cc1O)CC(=O)NCc2cccs2 527a_100000211653_100000082272 [0,1,1,0,0,0|1,0,1]=4 596 B19R2.11984 O=C(CCc1cccs1)Cc2ccc(c(c2)O)O 1458a_100000031429_100000748579 [0,1,1,0,0,0|1,0,1]=4 597 B19R2.11984 O=C(Cc1ccc(c(c1)Br)O)NCc2cccs2 240690a_100000211653_100009990404 [0,1,1,0,0,0|1,0,1]=4 598 B19R2.11984 O=C(Cc1ccc(c(c1)Br)O)NCc2cccs2 527a_100000211653_100009990404 [0,1,1,0,0,0|1,0,1]=4 599 B19R2.11984 O=C(Cc1ccc(c(c1)Cl)O)NCc2cccs2 240690a_100000211653_100000035197 [0,1,1,0,0,0|1,0,1]=4 600 B19R2.11984 O=C(Cc1ccc(c(c1)Cl)O)NCc2cccs2 527a_100000211653_100000035197 [0,1,1,0,0,0|1,0,1]=4 601 B19R2.11984 O=C(Cc1ccc(c(c1)F)O)NCc2cccs2 240690a_100000211653_100000039761 [0,1,1,0,0,0|1,0,1]=4 602 B19R2.11984 O=C(Cc1ccc(c(c1)F)O)NCc2cccs2 527a_100000211653_100000039761 [0,1,1,0,0,0|1,0,1]=4 603 B19R2.11984 O=C(Cc1ccc(c(c1)O)O)NCc2ccc[nH]2 527a_100000764082_100000031429 [0,1,1,0,0,0|1,0,1]=4 604 B19R2.11984 O=C(Cc1ccc(c(c1)O)O)NCc2ccco2 527a_100000185738_100000031429 [0,1,1,0,0,0|0,1,1]=4 605 B19R2.11984 O=C(Cc1ccc(c(c1)O)O)NCc2cccs2 527a_100000211653_100000031429 [0,1,1,0,0,0|0,0,1]=3 606 B19R2.11984 O=C(Cc1ccc(c(c1)O)O)NCc2cncs2 527a_100016987365_100000031429 [0,1,1,0,0,0|1,0,1]=4 607 B19R2.11984 O=C(Cc1ccc(c(c1)O)O)NCc2nccs2 527a_100000740555_100000031429 [0,1,1,0,0,0|1,0,1]=4 608 B19R2.11984 O=C(NCc1cccs1)Nc2ccc(c(c2)O)O 2430a_100102946323_100000211653 [0,1,1,0,0,0|1,0,1]=4 609 B19R2.12035 CC(NCCc1ccc(c(c1)Cl)Cl)c2cccs2 2230a_100000703493_100011713676 [0,1,1,0,0,0|2,0,0]=4 610 B19R2.12035 CC(NCCc1ccc(c(c1)Cl)Cl)c2cccs2 269862a_100011207230_100000185736 [0,1,1,0,0,0|2,0,0]=4 611 B19R2.12035 CC(NCCc1ccc(c(c1)Cl)F)c2cccs2 2230a_100000703493_100012361305 [0,1,1,0,0,0|2,0,0]=4 612 B19R2.12035 CC(NCCc1ccc(c(c1)Cl)F)c2cccs2 269862a_200011997520_100000185736 [0,1,1,0,0,0|2,0,0]=4 613 B19R2.12035 CC(NCCc1ccc(c(c1)F)F)c2cccs2 2230a_100000703493_100000690553 [0,1,1,0,0,0|2,0,0]=4 614 B19R2.12035 CC(NCCc1ccc(c(c1)F)F)c2cccs2 269862a_200000706328_100000185736 [0,1,1,0,0,0|2,0,0]=4 615 B19R2.12035 CC(NCCc1ccc(c(c1)O)O)c2cc[nH]c2 269862a_100000210387_100000753940 [0,1,1,0,0,0|2,0,0]=4 616 B19R2.12035 CC(NCCc1ccc(c(c1)O)O)c2ccc[nH]2 269862a_100000210387_100000183661 [0,1,1,0,0,0|1,0,0]=3 617 B19R2.12035 CC(NCCc1ccc(c(c1)O)O)c2cccs2 269862a_100000210387_100000185736 [0,1,1,0,0,0|0,0,0]=2 618 B19R2.12035 CC(NCCc1ccc(c(c1)O)O)c2ccn[nH]2 269862a_100000210387_100000747476 [0,1,1,0,0,0|2,0,0]=4 619 B19R2.12035 CC(NCCc1ccc(c(c1)O)O)c2ccsc2 269862a_100000210387_100000747891 [0,1,1,0,0,0|2,0,0]=4 620 B19R2.12035 CC(NCCc1ccc(c(c1)O)O)c2cscn2 269862a_100000210387_100000693406 [0,1,1,0,0,0|2,0,0]=4 621 B19R2.12035 CC(NCCc1ccc(c(c1)O)O)c2ncc[nH]2 269862a_100000210387_100000718901 [0,1,1,0,0,0|2,0,0]=4 622 B19R2.12035 CC(OCCc1ccc(c(c1)O)O)c2nccs2 7a_100000751044_200010393615 [0,1,1,0,0,0|2,0,0]=4 623 B19R2.12035 C[C@@H](OCCc1ccc(c(c1)O)O)c2cccs2 7a_100000750433_200010393615 [0,1,1,0,0,0|1,0,0]=3 624 B19R2.12035 C[C@H](OCCc1ccc(c(c1)O)O)c2ccco2 7a_100000755270_200010393615 [0,1,1,0,0,0|1,1,0]=4 625 B19R2.12035 Cc1ccc(cc1C)CCNC(C)c2cccs2 269862a_100020591374_100000185736 [0,1,1,0,0,0|2,0,0]=4 626 B19R2.12037 CN(CCc1ccc(c(c1)Cl)Cl)Cc2cccs2 2230a_100000184426_100011713676 [0,1,1,0,0,0|2,0,0]=4 627 B19R2.12037 CN(CCc1ccc(c(c1)Cl)Cl)Cc2cccs2 269982a_100000184426_100011713676 [0,1,1,0,0,0|2,0,0]=4 628 B19R2.12037 CN(CCc1ccc(c(c1)Cl)F)Cc2cccs2 2230a_100000184426_100012361305 [0,1,1,0,0,0|2,0,0]=4 629 B19R2.12037 CN(CCc1ccc(c(c1)Cl)F)Cc2cccs2 269982a_100000184426_100012361305 [0,1,1,0,0,0|2,0,0]=4 630 B19R2.12037 CN(CCc1ccc(c(c1)F)F)Cc2cccs2 2230a_100000184426_100000690553 [0,1,1,0,0,0|2,0,0]=4 631 B19R2.12037 CN(CCc1ccc(c(c1)F)F)Cc2cccs2 269982a_100000184426_100000690553 [0,1,1,0,0,0|2,0,0]=4 632 B19R2.12037 CN(CCc1ccc(c(c1)O)O)Cc2ccco2 269982a_100000185268_200010393615 [0,1,1,0,0,0|0,1,0]=3 633 B19R2.12037 CN(CCc1ccc(c(c1)O)O)Cc2cccs2 269982a_100000184426_200010393615 [0,1,1,0,0,0|0,0,0]=2 634 B19R2.12037 CN(CCc1ccc(c(c1)O)O)Cc2ccon2 269982a_100000757864_200010393615 [0,1,1,0,0,0|2,0,0]=4 635 B19R2.12037 CN(CCc1ccc(c(c1)O)O)Cc2ccsc2 269982a_100020654213_200010393615 [0,1,1,0,0,0|2,0,0]=4 636 B19R2.12037 CN(CCc1ccc(c(c1)O)O)Cc2cscn2 269982a_100000225794_200010393615 [0,1,1,0,0,0|2,0,0]=4 637 B19R2.12037 CN(CCc1ccc(c(c1)O)O)Cc2ncc[nH]2 269982a_100015184136_200010393615 [0,1,1,0,0,0|2,0,0]=4 638 B19R2.12037 CN(CCc1ccc(c(c1)O)O)Cc2nccs2 269982a_100000765864_200010393615 [0,1,1,0,0,0|1,0,0]=3 639 B19R2.12037 O=C(CCc1ccc(c(c1)O)O)Cc2ccc[nH]2 1458a_100000238377_200010393615 [0,1,1,0,0,0|2,0,0]=4 640 B19R2.12037 O=C(CCc1ccc(c(c1)O)O)Cc2ccco2 1458a_100011217309_200010393615 [0,1,1,0,0,0|1,1,0]=4 641 B19R2.12037 O=C(CCc1ccc(c(c1)O)O)Cc2cccs2 1458a_100000210189_200010393615 [0,1,1,0,0,0|1,0,0]=3 642 B19R2.12037 O=C(CCc1ccc(c(c1)O)O)Cc2cncs2 1458a_100000042615_100015185245 [0,1,1,0,0,0|2,0,0]=4 643 B19R2.12037 O=C(CCc1ccc(c(c1)O)O)Cc2nccs2 1458a_100000042615_100015184050 [0,1,1,0,0,0|2,0,0]=4 644 B19R2.12037 O=C(Cc1cccs1)NCc2ccc(c(c2)O)O 240690a_100000010075_100000210189 [0,1,1,0,0,0|2,0,0]=4 645 B19R2.12397 O=C(CCCc1cccs1)c2ccc(c(c2)O)O 1458a_100000212155_100010992444 [0,1,1,0,0,0|1,0,1]=4 646 B19R2.12397 O[C@H](CNCc1cccs1)c2ccc(c(c2)F)F 2230a_100000211653_100000761251 [0,1,1,0,0,0|2,0,0]=4 647 B19R2.12397 Oc1ccc(cc1O)C(O)CNCc2ccon2 34a_100000106456_100000234950 [0,1,1,0,0,0|2,0,0]=4 648 B19R2.12397 Oc1ccc(cc1O)C(O)CNCc2ccsc2 34a_100000106456_100011261437 [0,1,1,0,0,0|2,0,0]=4 649 B19R2.12397 Oc1ccc(cc1O)C(O)CNCc2cncs2 34a_100000106456_100015185245 [0,1,1,0,0,0|1,0,0]=3 650 B19R2.12397 Oc1ccc(cc1O)C(O)CNCc2cscn2 34a_100000106456_100000205941 [0,1,1,0,0,0|2,0,0]=4 651 B19R2.12397 Oc1ccc(cc1O)C(O)CNCc2ncco2 34a_100000106456_103436540062 [0,1,1,0,0,0|1,1,0]=4 652 B19R2.12397 Oc1ccc(cc1O)C(O)CNCc2nccs2 34a_100000106456_100015184050 [0,1,1,0,0,0|1,0,0]=3 653 B19R2.19019 COc1ccc(cc1Br)CCNCc2ccco2 207a_103549771065_100000186105 [0,1,1,0,0,0|1,1,0]=4 654 B19R2.19019 COc1ccc(cc1Br)CCNCc2ccco2 270004a_103549771065_100000186105 [0,1,1,0,0,0|1,1,0]=4 655 B19R2.19019 COc1ccc(cc1Br)CCNCc2cccs2 207a_103549771065_100000209959 [0,1,1,0,0,0|1,0,0]=3 656 B19R2.19019 COc1ccc(cc1Br)CCNCc2cccs2 270004a_103549771065_100000209959 [0,1,1,0,0,0|1,0,0]=3 657 B19R2.19019 COc1ccc(cc1Br)CCNCc2cncs2 207a_103549771065_100000749870 [0,1,1,0,0,0|2,0,0]=4 658 B19R2.19019 COc1ccc(cc1Br)CCNCc2cncs2 2230a_103549771065_100015185245 [0,1,1,0,0,0|2,0,0]=4 659 B19R2.19019 COc1ccc(cc1Br)CCNCc2cncs2 270004a_103549771065_100000749870 [0,1,1,0,0,0|2,0,0]=4 660 B19R2.19019 COc1ccc(cc1Br)CCNCc2cncs2 34a_103549771065_100015185245 [0,1,1,0,0,0|2,0,0]=4 661 B19R2.19019 COc1ccc(cc1Br)CCNCc2nccs2 207a_103549771065_100000750902 [0,1,1,0,0,0|2,0,0]=4 662 B19R2.19019 COc1ccc(cc1Br)CCNCc2nccs2 2230a_103549771065_100015184050 [0,1,1,0,0,0|2,0,0]=4 663 B19R2.19019 COc1ccc(cc1Br)CCNCc2nccs2 270004a_103549771065_100000750902 [0,1,1,0,0,0|2,0,0]=4 664 B19R2.19019 COc1ccc(cc1Br)CCNCc2nccs2 34a_103549771065_100015184050 [0,1,1,0,0,0|2,0,0]=4 665 B19R2.19019 COc1ccc(cc1Cl)CCNCc2ccco2 207a_100025770840_100000186105 [0,1,1,0,0,0|1,1,0]=4 666 B19R2.19019 COc1ccc(cc1Cl)CCNCc2ccco2 270004a_100025770840_100000186105 [0,1,1,0,0,0|1,1,0]=4 667 B19R2.19019 COc1ccc(cc1Cl)CCNCc2cccs2 207a_100025770840_100000209959 [0,1,1,0,0,0|1,0,0]=3 668 B19R2.19019 COc1ccc(cc1Cl)CCNCc2cccs2 270004a_100025770840_100000209959 [0,1,1,0,0,0|1,0,0]=3 669 B19R2.19019 COc1ccc(cc1Cl)CCNCc2cncs2 207a_100025770840_100000749870 [0,1,1,0,0,0|2,0,0]=4 670 B19R2.19019 COc1ccc(cc1Cl)CCNCc2cncs2 2230a_100025770840_100015185245 [0,1,1,0,0,0|2,0,0]=4 671 B19R2.19019 COc1ccc(cc1Cl)CCNCc2cncs2 270004a_100025770840_100000749870 [0,1,1,0,0,0|2,0,0]=4 672 B19R2.19019 COc1ccc(cc1Cl)CCNCc2cncs2 34a_100025770840_100015185245 [0,1,1,0,0,0|2,0,0]=4 673 B19R2.19019 COc1ccc(cc1Cl)CCNCc2nccs2 207a_100025770840_100000750902 [0,1,1,0,0,0|2,0,0]=4 674 B19R2.19019 COc1ccc(cc1Cl)CCNCc2nccs2 2230a_100025770840_100015184050 [0,1,1,0,0,0|2,0,0]=4 675 B19R2.19019 COc1ccc(cc1Cl)CCNCc2nccs2 270004a_100025770840_100000750902 [0,1,1,0,0,0|2,0,0]=4 676 B19R2.19019 COc1ccc(cc1Cl)CCNCc2nccs2 34a_100025770840_100015184050 [0,1,1,0,0,0|2,0,0]=4 677 B19R2.19019 COc1ccc(cc1O)CCNCc2c[nH]cn2 2230a_100011207234_100000707719 [0,1,1,0,0,0|2,0,0]=4 678 B19R2.19019 COc1ccc(cc1O)CCNCc2c[nH]cn2 34a_100011207234_100000707719 [0,1,1,0,0,0|2,0,0]=4 679 B19R2.19019 COc1ccc(cc1O)CCNCc2cc[nH]n2 270004a_100011207234_100000738523 [0,1,1,0,0,0|2,0,0]=4 680 B19R2.19019 COc1ccc(cc1O)CCNCc2ccco2 270004a_100011207234_100000186105 [0,1,1,0,0,0|0,1,0]=3 681 B19R2.19019 COc1ccc(cc1O)CCNCc2cccs2 270004a_100011207234_100000209959 [0,1,1,0,0,0|0,0,0]=2 682 B19R2.19019 COc1ccc(cc1O)CCNCc2ccn[nH]2 2230a_100011207234_100000728653 [0,1,1,0,0,0|2,0,0]=4 683 B19R2.19019 COc1ccc(cc1O)CCNCc2ccn[nH]2 34a_100011207234_100000728653 [0,1,1,0,0,0|2,0,0]=4 684 B19R2.19019 COc1ccc(cc1O)CCNCc2ccoc2 270004a_100011207234_100011215517 [0,1,1,0,0,0|2,0,0]=4 685 B19R2.19019 COc1ccc(cc1O)CCNCc2ccon2 2230a_100011207234_100000234950 [0,1,1,0,0,0|2,0,0]=4 686 B19R2.19019 COc1ccc(cc1O)CCNCc2ccon2 34a_100011207234_100000234950 [0,1,1,0,0,0|2,0,0]=4 687 B19R2.19019 COc1ccc(cc1O)CCNCc2ccsc2 2230a_100011207234_100011261437 [0,1,1,0,0,0|2,0,0]=4 688 B19R2.19019 COc1ccc(cc1O)CCNCc2ccsc2 270004a_100011207234_100000188534 [0,1,1,0,0,0|2,0,0]=4 689 B19R2.19019 COc1ccc(cc1O)CCNCc2ccsc2 34a_100011207234_100011261437 [0,1,1,0,0,0|2,0,0]=4 690 B19R2.19019 COc1ccc(cc1O)CCNCc2cnco2 270004a_100011207234_100000064291 [0,1,1,0,0,0|1,1,0]=4 691 B19R2.19019 COc1ccc(cc1O)CCNCc2cncs2 2230a_100011207234_100015185245 [0,1,1,0,0,0|1,0,0]=3 692 B19R2.19019 COc1ccc(cc1O)CCNCc2cncs2 270004a_100011207234_100000749870 [0,1,1,0,0,0|1,0,0]=3 693 B19R2.19019 COc1ccc(cc1O)CCNCc2cncs2 34a_100011207234_100015185245 [0,1,1,0,0,0|1,0,0]=3 694 B19R2.19019 COc1ccc(cc1O)CCNCc2cocn2 270004a_100011207234_100000050382 [0,1,1,0,0,0|2,0,0]=4 695 B19R2.19019 COc1ccc(cc1O)CCNCc2cscn2 2230a_100011207234_100000205941 [0,1,1,0,0,0|2,0,0]=4 696 B19R2.19019 COc1ccc(cc1O)CCNCc2cscn2 270004a_100011207234_100000743575 [0,1,1,0,0,0|2,0,0]=4 697 B19R2.19019 COc1ccc(cc1O)CCNCc2cscn2 34a_100011207234_100000205941 [0,1,1,0,0,0|2,0,0]=4 698 B19R2.19019 COc1ccc(cc1O)CCNCc2ncc[nH]2 2230a_100011207234_100016991755 [0,1,1,0,0,0|2,0,0]=4 699 B19R2.19019 COc1ccc(cc1O)CCNCc2ncc[nH]2 34a_100011207234_100016991755 [0,1,1,0,0,0|2,0,0]=4 700 B19R2.19019 COc1ccc(cc1O)CCNCc2ncco2 2230a_100011207234_103436540062 [0,1,1,0,0,0|1,1,0]=4 701 B19R2.19019 COc1ccc(cc1O)CCNCc2ncco2 270004a_100011207234_100000064290 [0,1,1,0,0,0|1,1,0]=4 702 B19R2.19019 COc1ccc(cc1O)CCNCc2ncco2 34a_100011207234_103436540062 [0,1,1,0,0,0|1,1,0]=4 703 B19R2.19019 COc1ccc(cc1O)CCNCc2nccs2 2230a_100011207234_100015184050 [0,1,1,0,0,0|1,0,0]=3 704 B19R2.19019 COc1ccc(cc1O)CCNCc2nccs2 270004a_100011207234_100000750902 [0,1,1,0,0,0|1,0,0]=3 705 B19R2.19019 COc1ccc(cc1O)CCNCc2nccs2 34a_100011207234_100015184050 [0,1,1,0,0,0|1,0,0]=3 706 B19R2.19019 COc1ccc(cc1O)CNCCc2cccs2 34a_100000740000_100000748579 [0,1,1,0,0,0|2,0,0]=4 707 B19R2.19019 COc1ccc(cc1O)NCCCc2cccs2 34a_100000211920_100010992444 [0,1,1,0,0,0|2,0,0]=4 708 B19R2.19019 COc1ccc(cc1O)SCCCc2cccs2 62a_100010992444_100009816560 [0,1,1,0,0,0|2,0,0]=4 709 B19R2.19019 OCc1ccc(cc1O)SCCCc2cccs2 62a_100000071718_100010992444 [0,1,1,0,0,0|2,0,0]=4 710 B19R2.19019 OCc1ccc(cc1O)SCCCc2cccs2 62a_100010992444_100000071718 [0,1,1,0,0,0|2,0,0]=4 711 B19R2.21739 COc1cc(ccc1O)CCNCc2c[nH]cn2 34a_100000756042_100000707719 [0,1,1,0,0,0|2,0,0]=4 712 B19R2.21739 COc1cc(ccc1O)CCNCc2cc[nH]n2 207a_100000756042_100000738523 [0,1,1,0,0,0|2,0,0]=4 713 B19R2.21739 COc1cc(ccc1O)CCNCc2cc[nH]n2 270004a_100000756042_100000738523 [0,1,1,0,0,0|2,0,0]=4 714 B19R2.21739 COc1cc(ccc1O)CCNCc2ccco2 207a_100000756042_100000186105 [0,1,1,0,0,0|0,1,0]=3 715 B19R2.21739 COc1cc(ccc1O)CCNCc2ccco2 2230a_100000185738_100010741665 [0,1,1,0,0,0|0,1,0]=3 716 B19R2.21739 COc1cc(ccc1O)CCNCc2ccco2 270004a_100000756042_100000186105 [0,1,1,0,0,0|0,1,0]=3 717 B19R2.21739 COc1cc(ccc1O)CCNCc2cccs2 207a_100000756042_100000209959 [0,1,1,0,0,0|0,0,0]=2 718 B19R2.21739 COc1cc(ccc1O)CCNCc2cccs2 2230a_100000211653_100010741665 [0,1,1,0,0,0|0,0,0]=2 719 B19R2.21739 COc1cc(ccc1O)CCNCc2cccs2 270004a_100000756042_100000209959 [0,1,1,0,0,0|0,0,0]=2 720 B19R2.21739 COc1cc(ccc1O)CCNCc2ccn[nH]2 34a_100000756042_100000728653 [0,1,1,0,0,0|2,0,0]=4 721 B19R2.21739 COc1cc(ccc1O)CCNCc2ccoc2 207a_100000756042_100011215517 [0,1,1,0,0,0|2,0,0]=4 722 B19R2.21739 COc1cc(ccc1O)CCNCc2ccoc2 2230a_100015206860_100010741665 [0,1,1,0,0,0|2,0,0]=4 723 B19R2.21739 COc1cc(ccc1O)CCNCc2ccoc2 270004a_100000756042_100011215517 [0,1,1,0,0,0|2,0,0]=4 724 B19R2.21739 COc1cc(ccc1O)CCNCc2ccon2 34a_100000756042_100000234950 [0,1,1,0,0,0|2,0,0]=4 725 B19R2.21739 COc1cc(ccc1O)CCNCc2ccsc2 207a_100000756042_100000188534 [0,1,1,0,0,0|2,0,0]=4 726 B19R2.21739 COc1cc(ccc1O)CCNCc2ccsc2 2230a_100000186416_100010741665 [0,1,1,0,0,0|2,0,0]=4 727 B19R2.21739 COc1cc(ccc1O)CCNCc2ccsc2 270004a_100000756042_100000188534 [0,1,1,0,0,0|2,0,0]=4 728 B19R2.21739 COc1cc(ccc1O)CCNCc2ccsc2 34a_100000756042_100011261437 [0,1,1,0,0,0|2,0,0]=4 729 B19R2.21739 COc1cc(ccc1O)CCNCc2cnc[nH]2 207a_100000756042_100000742939 [0,1,1,0,0,0|2,0,0]=4 730 B19R2.21739 COc1cc(ccc1O)CCNCc2cnco2 270004a_100000756042_100000064291 [0,1,1,0,0,0|1,1,0]=4 731 B19R2.21739 COc1cc(ccc1O)CCNCc2cncs2 207a_100000756042_100000749870 [0,1,1,0,0,0|1,0,0]=3 732 B19R2.21739 COc1cc(ccc1O)CCNCc2cncs2 2230a_100016987365_100010741665 [0,1,1,0,0,0|1,0,0]=3 733 B19R2.21739 COc1cc(ccc1O)CCNCc2cncs2 270004a_100000756042_100000749870 [0,1,1,0,0,0|1,0,0]=3 734 B19R2.21739 COc1cc(ccc1O)CCNCc2cncs2 34a_100000756042_100015185245 [0,1,1,0,0,0|1,0,0]=3 735 B19R2.21739 COc1cc(ccc1O)CCNCc2cocn2 270004a_100000756042_100000050382 [0,1,1,0,0,0|2,0,0]=4 736 B19R2.21739 COc1cc(ccc1O)CCNCc2cscn2 207a_100000756042_100000743575 [0,1,1,0,0,0|2,0,0]=4 737 B19R2.21739 COc1cc(ccc1O)CCNCc2cscn2 2230a_100015185402_100010741665 [0,1,1,0,0,0|2,0,0]=4 738 B19R2.21739 COc1cc(ccc1O)CCNCc2cscn2 270004a_100000756042_100000743575 [0,1,1,0,0,0|2,0,0]=4 739 B19R2.21739 COc1cc(ccc1O)CCNCc2cscn2 34a_100000756042_100000205941 [0,1,1,0,0,0|2,0,0]=4 740 B19R2.21739 COc1cc(ccc1O)CCNCc2ncc[nH]2 207a_100000756042_100000743867 [0,1,1,0,0,0|2,0,0]=4 741 B19R2.21739 COc1cc(ccc1O)CCNCc2ncc[nH]2 34a_100000756042_100016991755 [0,1,1,0,0,0|2,0,0]=4 742 B19R2.21739 COc1cc(ccc1O)CCNCc2ncco2 2230a_100016994969_100010741665 [0,1,1,0,0,0|1,1,0]=4 743 B19R2.21739 COc1cc(ccc1O)CCNCc2ncco2 270004a_100000756042_100000064290 [0,1,1,0,0,0|1,1,0]=4 744 B19R2.21739 COc1cc(ccc1O)CCNCc2ncco2 34a_100000756042_103436540062 [0,1,1,0,0,0|1,1,0]=4 745 B19R2.21739 COc1cc(ccc1O)CCNCc2nccs2 207a_100000756042_100000750902 [0,1,1,0,0,0|1,0,0]=3 746 B19R2.21739 COc1cc(ccc1O)CCNCc2nccs2 2230a_100000740555_100010741665 [0,1,1,0,0,0|1,0,0]=3 747 B19R2.21739 COc1cc(ccc1O)CCNCc2nccs2 270004a_100000756042_100000750902 [0,1,1,0,0,0|1,0,0]=3 748 B19R2.21739 COc1cc(ccc1O)CCNCc2nccs2 34a_100000756042_100015184050 [0,1,1,0,0,0|1,0,0]=3 749 B19R2.21739 COc1cc(ccc1O)CCSCc2cncs2 62a_100015185245_100010741665 [0,1,1,0,0,0|2,0,0]=4 750 B19R2.21739 COc1cc(ccc1O)CCSCc2nccs2 62a_100015184050_100010741665 [0,1,1,0,0,0|2,0,0]=4 751 B19R2.21739 COc1cc(ccc1O)CNCCc2cccs2 34a_100000185554_100000748579 [0,1,1,0,0,0|2,0,0]=4 752 B19R2.21739 COc1cc(ccc1O)NCCCc2cccs2 34a_100000726020_100010992444 [0,1,1,0,0,0|2,0,0]=4 753 B19R2.21739 COc1cc(ccc1O)SCCCc2cccs2 62a_100010992444_100000694246 [0,1,1,0,0,0|2,0,0]=4 754 B19R2.21739 OCc1cc(ccc1O)SCCCc2cccs2 62a_100000184703_100010992444 [0,1,1,0,0,0|2,0,0]=4 755 B19R2.21739 OCc1cc(ccc1O)SCCCc2cccs2 62a_100010992444_100000184703 [0,1,1,0,0,0|2,0,0]=4 756 B19R2.45219 Cc1cc(no1)CNCCc2ccc(c(c2)O)O 34a_100000210387_100000199038 [0,1,1,0,0,0|2,0,0]=4 757 B19R2.45219 Cc1cc(on1)CNCCc2ccc(c(c2)O)O 34a_100000210387_100000707947 [0,1,1,0,0,0|1,1,0]=4 758 B19R2.45219 Cc1ccc(cc1C)CCNCc2cc(cs2)Br 207a_100020591374_100000211722 [0,1,1,0,0,0|2,0,0]=4 759 B19R2.45219 Cc1ccc(cc1C)CCNCc2cc(cs2)Br 2230a_100020591374_100000746031 [0,1,1,0,0,0|2,0,0]=4 760 B19R2.45219 Cc1ccc(cc1C)CCNCc2cc(cs2)Br 270004a_100020591374_100000211722 [0,1,1,0,0,0|2,0,0]=4 761 B19R2.45219 Cc1ccc(cc1C)CCNCc2cc(cs2)Br 34a_100020591374_100000746031 [0,1,1,0,0,0|2,0,0]=4 762 B19R2.45219 Cc1ccc(cc1C)CCNCc2cc(cs2)Cl 207a_100020591374_100000102487 [0,1,1,0,0,0|2,0,0]=4 763 B19R2.45219 Cc1ccc(cc1C)CCNCc2cc(cs2)Cl 270004a_100020591374_100000102487 [0,1,1,0,0,0|2,0,0]=4 764 B19R2.45219 Cc1ccc(cc1C)CCNCc2cc(cs2)I 207a_100020591374_100010179861 [0,1,1,0,0,0|2,0,0]=4 765 B19R2.45219 Cc1ccc(cc1C)CCNCc2ccc(s2)Br 207a_100020591374_100000179771 [0,1,1,0,0,0|2,0,0]=4 766 B19R2.45219 Cc1ccc(cc1C)CCNCc2ccc(s2)Br 2230a_100020591374_100000708592 [0,1,1,0,0,0|2,0,0]=4 767 B19R2.45219 Cc1ccc(cc1C)CCNCc2ccc(s2)Br 270004a_100020591374_100000179771 [0,1,1,0,0,0|2,0,0]=4 768 B19R2.45219 Cc1ccc(cc1C)CCNCc2ccc(s2)Br 34a_100020591374_100000708592 [0,1,1,0,0,0|2,0,0]=4 769 B19R2.45219 Cc1ccc(cc1C)CCNCc2ccc(s2)Cl 207a_100020591374_100000242774 [0,1,1,0,0,0|2,0,0]=4 770 B19R2.45219 Cc1ccc(cc1C)CCNCc2ccc(s2)Cl 2230a_100020591374_100000185097 [0,1,1,0,0,0|2,0,0]=4 771 B19R2.45219 Cc1ccc(cc1C)CCNCc2ccc(s2)Cl 270004a_100020591374_100000242774 [0,1,1,0,0,0|2,0,0]=4 772 B19R2.45219 Cc1ccc(cc1C)CCNCc2ccc(s2)Cl 34a_100020591374_100000185097 [0,1,1,0,0,0|2,0,0]=4 773 B19R2.45219 Cc1ccc(o1)COCCc2ccc(c(c2)O)O 7a_100011232665_200010393615 [0,1,1,0,0,0|1,1,0]=4 774 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)C)C 207a_100020591374_100000211121 [0,1,1,0,0,0|2,0,0]=4 775 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)C)C 270004a_100020591374_100000211121 [0,1,1,0,0,0|2,0,0]=4 776 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)Cl)Cl 207a_100011207230_100000211121 [0,1,1,0,0,0|2,0,0]=4 777 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)Cl)Cl 2230a_100000238518_100011713676 [0,1,1,0,0,0|2,0,0]=4 778 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)Cl)Cl 270004a_100011207230_100000211121 [0,1,1,0,0,0|2,0,0]=4 779 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)Cl)F 207a_200011997520_100000211121 [0,1,1,0,0,0|2,0,0]=4 780 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)Cl)F 2230a_100000238518_100012361305 [0,1,1,0,0,0|2,0,0]=4 781 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)Cl)F 270004a_200011997520_100000211121 [0,1,1,0,0,0|2,0,0]=4 782 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)F)F 207a_200000706328_100000211121 [0,1,1,0,0,0|2,0,0]=4 783 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)F)F 2230a_100000238518_100000690553 [0,1,1,0,0,0|2,0,0]=4 784 B19R2.45219 Cc1ccc(s1)CNCCc2ccc(c(c2)F)F 270004a_200000706328_100000211121 [0,1,1,0,0,0|2,0,0]=4 785 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)C)C 207a_100020591374_100102525248 [0,1,1,0,0,0|2,0,0]=4 786 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)C)C 270004a_100020591374_100102525248 [0,1,1,0,0,0|2,0,0]=4 787 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)Cl)Cl 207a_100011207230_100102525248 [0,1,1,0,0,0|2,0,0]=4 788 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)Cl)Cl 2230a_100015204214_100011713676 [0,1,1,0,0,0|2,0,0]=4 789 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)Cl)Cl 270004a_100011207230_100102525248 [0,1,1,0,0,0|2,0,0]=4 790 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)Cl)Cl 34a_100015204214_100011713676 [0,1,1,0,0,0|2,0,0]=4 791 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)Cl)F 207a_200011997520_100102525248 [0,1,1,0,0,0|2,0,0]=4 792 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)Cl)F 2230a_100015204214_100012361305 [0,1,1,0,0,0|2,0,0]=4 793 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)Cl)F 270004a_200011997520_100102525248 [0,1,1,0,0,0|2,0,0]=4 794 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)Cl)F 34a_100015204214_100012361305 [0,1,1,0,0,0|2,0,0]=4 795 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)F)F 207a_200000706328_100102525248 [0,1,1,0,0,0|2,0,0]=4 796 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)F)F 2230a_100015204214_100000690553 [0,1,1,0,0,0|2,0,0]=4 797 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)F)F 270004a_200000706328_100102525248 [0,1,1,0,0,0|2,0,0]=4 798 B19R2.45219 Cc1csc(c1)CNCCc2ccc(c(c2)F)F 34a_100015204214_100000690553 [0,1,1,0,0,0|2,0,0]=4 799 B19R2.45219 Cc1csc(c1)COCCc2ccc(c(c2)O)O 7a_200000068372_200010393615 [0,1,1,0,0,0|1,0,0]=3 800 B19R2.45219 Cc1nc(cs1)CNCCc2ccc(c(c2)O)O 34a_100000210387_100015186478 [0,1,1,0,0,0|2,0,0]=4 801 B19R2.45219 Cc1ncc(s1)CNCCc2ccc(c(c2)O)O 34a_100000210387_100020635045 [0,1,1,0,0,0|1,0,0]=3 802 B19R2.45219 Cc1ncc(s1)COCCc2ccc(c(c2)O)O 7a_100000743366_200010393615 [0,1,1,0,0,0|2,0,0]=4 803 B19R2.45219 Cc1ncc(s1)CSCCc2ccc(c(c2)O)O 62a_100020635045_200010393615 [0,1,1,0,0,0|2,0,0]=4 804 B19R2.45219 Cc1nnc(s1)CNCCc2ccc(c(c2)O)O 34a_100000210387_100000688753 [0,1,1,0,0,0|2,0,0]=4 805 B19R2.45219 Clc1ccc(cc1Cl)CCNCc2cc(cs2)I 207a_100011207230_100010179861 [0,1,1,0,0,0|2,0,0]=4 806 B19R2.45219 Cn1ccc(n1)CNCCc2ccc(c(c2)O)O 34a_100000210387_100000726502 [0,1,1,0,0,0|2,0,0]=4 807 B19R2.45219 Cn1cnc(c1)CNCCc2ccc(c(c2)O)O 34a_100000210387_100000717665 [0,1,1,0,0,0|2,0,0]=4 808 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2cc(cs2)Br 207a_200011997520_100000211722 [0,1,1,0,0,0|2,0,0]=4 809 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2cc(cs2)Br 2230a_100000741024_100012361305 [0,1,1,0,0,0|2,0,0]=4 810 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2cc(cs2)Br 2230a_200011997520_100000746031 [0,1,1,0,0,0|2,0,0]=4 811 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2cc(cs2)Br 270004a_200011997520_100000211722 [0,1,1,0,0,0|2,0,0]=4 812 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2cc(cs2)Br 34a_100000741024_100012361305 [0,1,1,0,0,0|2,0,0]=4 813 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2cc(cs2)Br 34a_200011997520_100000746031 [0,1,1,0,0,0|2,0,0]=4 814 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2cc(cs2)Cl 207a_200011997520_100000102487 [0,1,1,0,0,0|2,0,0]=4 815 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2cc(cs2)Cl 270004a_200011997520_100000102487 [0,1,1,0,0,0|2,0,0]=4 816 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2cc(cs2)I 207a_200011997520_100010179861 [0,1,1,0,0,0|2,0,0]=4 817 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2ccc(s2)Br 207a_200011997520_100000179771 [0,1,1,0,0,0|2,0,0]=4 818 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2ccc(s2)Br 2230a_200011997520_100000708592 [0,1,1,0,0,0|2,0,0]=4 819 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2ccc(s2)Br 270004a_200011997520_100000179771 [0,1,1,0,0,0|2,0,0]=4 820 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2ccc(s2)Br 34a_200011997520_100000708592 [0,1,1,0,0,0|2,0,0]=4 821 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2ccc(s2)Cl 207a_200011997520_100000242774 [0,1,1,0,0,0|2,0,0]=4 822 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2ccc(s2)Cl 2230a_100000737310_100012361305 [0,1,1,0,0,0|2,0,0]=4 823 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2ccc(s2)Cl 2230a_200011997520_100000185097 [0,1,1,0,0,0|2,0,0]=4 824 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2ccc(s2)Cl 270004a_200011997520_100000242774 [0,1,1,0,0,0|2,0,0]=4 825 B19R2.45219 Fc1ccc(cc1Cl)CCNCc2ccc(s2)Cl 34a_200011997520_100000185097 [0,1,1,0,0,0|2,0,0]=4 826 B19R2.45219 Fc1ccc(cc1F)CCNCc2cc(cs2)Br 207a_200000706328_100000211722 [0,1,1,0,0,0|2,0,0]=4 827 B19R2.45219 Fc1ccc(cc1F)CCNCc2cc(cs2)Br 2230a_100000741024_100000690553 [0,1,1,0,0,0|2,0,0]=4 828 B19R2.45219 Fc1ccc(cc1F)CCNCc2cc(cs2)Br 2230a_200000706328_100000746031 [0,1,1,0,0,0|2,0,0]=4 829 B19R2.45219 Fc1ccc(cc1F)CCNCc2cc(cs2)Br 270004a_200000706328_100000211722 [0,1,1,0,0,0|2,0,0]=4 830 B19R2.45219 Fc1ccc(cc1F)CCNCc2cc(cs2)Br 34a_100000741024_100000690553 [0,1,1,0,0,0|2,0,0]=4 831 B19R2.45219 Fc1ccc(cc1F)CCNCc2cc(cs2)Br 34a_200000706328_100000746031 [0,1,1,0,0,0|2,0,0]=4 832 B19R2.45219 Fc1ccc(cc1F)CCNCc2cc(cs2)Cl 207a_200000706328_100000102487 [0,1,1,0,0,0|2,0,0]=4 833 B19R2.45219 Fc1ccc(cc1F)CCNCc2cc(cs2)Cl 270004a_200000706328_100000102487 [0,1,1,0,0,0|2,0,0]=4 834 B19R2.45219 Fc1ccc(cc1F)CCNCc2cc(cs2)I 207a_200000706328_100010179861 [0,1,1,0,0,0|2,0,0]=4 835 B19R2.45219 Fc1ccc(cc1F)CCNCc2ccc(s2)Br 207a_200000706328_100000179771 [0,1,1,0,0,0|2,0,0]=4 836 B19R2.45219 Fc1ccc(cc1F)CCNCc2ccc(s2)Br 2230a_200000706328_100000708592 [0,1,1,0,0,0|2,0,0]=4 837 B19R2.45219 Fc1ccc(cc1F)CCNCc2ccc(s2)Br 270004a_200000706328_100000179771 [0,1,1,0,0,0|2,0,0]=4 838 B19R2.45219 Fc1ccc(cc1F)CCNCc2ccc(s2)Br 34a_200000706328_100000708592 [0,1,1,0,0,0|2,0,0]=4 839 B19R2.45219 Fc1ccc(cc1F)CCNCc2ccc(s2)Cl 207a_200000706328_100000242774 [0,1,1,0,0,0|2,0,0]=4 840 B19R2.45219 Fc1ccc(cc1F)CCNCc2ccc(s2)Cl 2230a_100000737310_100000690553 [0,1,1,0,0,0|2,0,0]=4 841 B19R2.45219 Fc1ccc(cc1F)CCNCc2ccc(s2)Cl 2230a_200000706328_100000185097 [0,1,1,0,0,0|2,0,0]=4 842 B19R2.45219 Fc1ccc(cc1F)CCNCc2ccc(s2)Cl 270004a_200000706328_100000242774 [0,1,1,0,0,0|2,0,0]=4 843 B19R2.45219 Fc1ccc(cc1F)CCNCc2ccc(s2)Cl 34a_200000706328_100000185097 [0,1,1,0,0,0|2,0,0]=4 844 B19R2.45219 Nc1ncc(s1)COCCc2ccc(c(c2)O)O 7a_100011997359_200010393615 [0,1,1,0,0,0|2,0,0]=4 845 B19R2.45219 O=C1C=C(CO1)CNCCc2ccc(c(c2)O)O 34a_100000210387_100000716558 [0,1,1,0,0,0|2,0,0]=4 846 B19R2.45219 Oc1ccc(cc1O)CCNCc2cc(cs2)Br 34a_100000210387_100000746031 [0,1,1,0,0,0|0,0,0]=2 847 B19R2.45219 Oc1ccc(cc1O)CCNCc2ccc(s2)Br 34a_100000210387_100000708592 [0,1,1,0,0,0|0,0,0]=2 848 B19R2.45219 Oc1ccc(cc1O)CCNCc2ccc(s2)Cl 34a_100000210387_100000185097 [0,1,1,0,0,0|0,0,0]=2 849 B19R2.45219 Oc1ccc(cc1O)CCNCc2cnc(s2)Br 34a_100000210387_100000717027 [0,1,1,0,0,0|1,0,0]=3 850 B19R2.45219 Oc1ccc(cc1O)CCNCc2cnc(s2)Cl 34a_100000210387_100000058068 [0,1,1,0,0,0|1,0,0]=3 851 B19R2.45219 Oc1ccc(cc1O)CCNCc2csc(n2)Cl 34a_100000210387_100000024076 [0,1,1,0,0,0|2,0,0]=4 852 B19R2.45219 Oc1ccc(cc1O)CCOCc2cc(cs2)Br 7a_100000238369_200010393615 [0,1,1,0,0,0|1,0,0]=3 853 B19R2.45219 Oc1ccc(cc1O)CCOCc2ccc(o2)Br 7a_100000246276_200010393615 [0,1,1,0,0,0|1,1,0]=4 854 B19R2.45219 Oc1ccc(cc1O)CCOCc2cnc(s2)Br 7a_100009816753_200010393615 [0,1,1,0,0,0|2,0,0]=4 855 B19R2.45219 Oc1ccc(cc1O)CCOCc2cnc(s2)Cl 7a_100000697714_200010393615 [0,1,1,0,0,0|2,0,0]=4 856 B19R2.45219 Oc1ccc(cc1O)CCOCc2nc(cs2)Br 7a_100012000107_200010393615 [0,1,1,0,0,0|2,0,0]=4 857 B19R2.45219 Oc1ccc(cc1O)CCSCc2cc(cs2)Br 62a_100000746031_200010393615 [0,1,1,0,0,0|1,0,0]=3 858 B19R2.45219 Oc1ccc(cc1O)CCSCc2ccc(s2)Br 62a_100000708592_200010393615 [0,1,1,0,0,0|1,0,0]=3 859 B19R2.45219 Oc1ccc(cc1O)CCSCc2ccc(s2)Cl 62a_100000185097_200010393615 [0,1,1,0,0,0|1,0,0]=3 860 B19R2.45219 Oc1ccc(cc1O)CCSCc2cnc(s2)Br 62a_100000717027_200010393615 [0,1,1,0,0,0|2,0,0]=4 861 B19R2.45219 Oc1ccc(cc1O)CCSCc2cnc(s2)Cl 62a_100000058068_200010393615 [0,1,1,0,0,0|2,0,0]=4 862 B19R2.51720 Cc1ccc(cc1C)CCNCc2sccc2Br 207a_100020591374_100000766043 [0,1,1,0,0,0|2,0,0]=4 863 B19R2.51720 Cc1ccc(cc1C)CCNCc2sccc2Br 270004a_100020591374_100000766043 [0,1,1,0,0,0|2,0,0]=4 864 B19R2.51720 Cc1ccc(cc1C)CCNCc2sccc2C 207a_100020591374_100000210881 [0,1,1,0,0,0|2,0,0]=4 865 B19R2.51720 Cc1ccc(cc1C)CCNCc2sccc2C 270004a_100020591374_100000210881 [0,1,1,0,0,0|2,0,0]=4 866 B19R2.51720 Cc1ccc(cc1C)CCNCc2sccc2Cl 207a_100020591374_100000722334 [0,1,1,0,0,0|2,0,0]=4 867 B19R2.51720 Cc1ccc(cc1C)CCNCc2sccc2Cl 270004a_100020591374_100000722334 [0,1,1,0,0,0|2,0,0]=4 868 B19R2.51720 Cc1ccoc1COCCc2ccc(c(c2)O)O 7a_100011273948_200010393615 [0,1,1,0,0,0|1,1,0]=4 869 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)Cl)Cl 207a_100011207230_100000210881 [0,1,1,0,0,0|2,0,0]=4 870 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)Cl)Cl 2230a_100000238519_100011713676 [0,1,1,0,0,0|2,0,0]=4 871 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)Cl)Cl 270004a_100011207230_100000210881 [0,1,1,0,0,0|2,0,0]=4 872 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)Cl)Cl 34a_100000238519_100011713676 [0,1,1,0,0,0|2,0,0]=4 873 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)Cl)F 207a_200011997520_100000210881 [0,1,1,0,0,0|2,0,0]=4 874 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)Cl)F 2230a_100000238519_100012361305 [0,1,1,0,0,0|2,0,0]=4 875 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)Cl)F 270004a_200011997520_100000210881 [0,1,1,0,0,0|2,0,0]=4 876 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)Cl)F 34a_100000238519_100012361305 [0,1,1,0,0,0|2,0,0]=4 877 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)F)F 207a_200000706328_100000210881 [0,1,1,0,0,0|2,0,0]=4 878 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)F)F 2230a_100000238519_100000690553 [0,1,1,0,0,0|2,0,0]=4 879 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)F)F 270004a_200000706328_100000210881 [0,1,1,0,0,0|2,0,0]=4 880 B19R2.51720 Cc1ccsc1CNCCc2ccc(c(c2)F)F 34a_100000238519_100000690553 [0,1,1,0,0,0|2,0,0]=4 881 B19R2.51720 Cc1ccsc1COCCc2ccc(c(c2)O)O 7a_100000238368_200010393615 [0,1,1,0,0,0|1,0,0]=3 882 B19R2.51720 Cc1ncsc1COCCc2ccc(c(c2)O)O 7a_100000750112_200010393615 [0,1,1,0,0,0|2,0,0]=4 883 B19R2.51720 Cc1nnsc1CNCCc2ccc(c(c2)O)O 34a_100000210387_100000732739 [0,1,1,0,0,0|2,0,0]=4 884 B19R2.51720 Cc1ocnc1CNCCc2ccc(c(c2)O)O 34a_100000210387_200000693990 [0,1,1,0,0,0|2,0,0]=4 885 B19R2.51720 Cn1ccnc1CNCCc2ccc(c(c2)O)O 34a_100000210387_100000700302 [0,1,1,0,0,0|2,0,0]=4 886 B19R2.51720 Cn1nccc1CNCCc2ccc(c(c2)O)O 34a_100000210387_100000691648 [0,1,1,0,0,0|2,0,0]=4 887 B19R2.51720 Fc1ccc(cc1Cl)CCNCc2sccc2Br 207a_200011997520_100000766043 [0,1,1,0,0,0|2,0,0]=4 888 B19R2.51720 Fc1ccc(cc1Cl)CCNCc2sccc2Br 270004a_200011997520_100000766043 [0,1,1,0,0,0|2,0,0]=4 889 B19R2.51720 Fc1ccc(cc1Cl)CCNCc2sccc2Cl 207a_200011997520_100000722334 [0,1,1,0,0,0|2,0,0]=4 890 B19R2.51720 Fc1ccc(cc1Cl)CCNCc2sccc2Cl 2230a_100011934584_100012361305 [0,1,1,0,0,0|2,0,0]=4 891 B19R2.51720 Fc1ccc(cc1Cl)CCNCc2sccc2Cl 270004a_200011997520_100000722334 [0,1,1,0,0,0|2,0,0]=4 892 B19R2.51720 Fc1ccc(cc1Cl)CCNCc2sccc2Cl 34a_100011934584_100012361305 [0,1,1,0,0,0|2,0,0]=4 893 B19R2.51720 Fc1ccc(cc1F)CCNCc2sccc2Br 207a_200000706328_100000766043 [0,1,1,0,0,0|2,0,0]=4 894 B19R2.51720 Fc1ccc(cc1F)CCNCc2sccc2Br 270004a_200000706328_100000766043 [0,1,1,0,0,0|2,0,0]=4 895 B19R2.51720 Fc1ccc(cc1F)CCNCc2sccc2Cl 207a_200000706328_100000722334 [0,1,1,0,0,0|2,0,0]=4 896 B19R2.51720 Fc1ccc(cc1F)CCNCc2sccc2Cl 2230a_100011934584_100000690553 [0,1,1,0,0,0|2,0,0]=4 897 B19R2.51720 Fc1ccc(cc1F)CCNCc2sccc2Cl 270004a_200000706328_100000722334 [0,1,1,0,0,0|2,0,0]=4 898 B19R2.51720 Fc1ccc(cc1F)CCNCc2sccc2Cl 34a_100011934584_100000690553 [0,1,1,0,0,0|2,0,0]=4 899 B19R2.51720 Oc1ccc(cc1O)CCNCc2ccsc2Br 34a_100000210387_100009814289 [0,1,1,0,0,0|2,0,0]=4 900 B19R2.51720 Oc1ccc(cc1O)CCNCc2ccsc2Cl 34a_100000210387_100010167017 [0,1,1,0,0,0|2,0,0]=4 901 B19R2.51720 Oc1ccc(cc1O)CCOCc2sccc2Cl 7a_100000722387_200010393615 [0,1,1,0,0,0|1,0,0]=3 902 B19R2.51720 Oc1ccc(cc1O)CCOCc2scnc2Br 7a_100012000948_200010393615 [0,1,1,0,0,0|2,0,0]=4 903 B19R2.867525 Oc1cc(cc(c1O)F)SCCCc2cccs2 62a_100010992444_100010114375 [0,1,1,0,0,0|2,0,0]=4 904 B19R2.867525 Oc1cc(cc(c1O)O)SCCCc2cccs2 62a_100010992444_100010658518 [0,1,1,0,0,0|2,0,0]=4 905 B17R1.30816 C=COC(=O)CNCCc1ccc(c(c1)O)O 34a_100000210387_100000036128 [0,0,2,0,0,0|1,1,0]=4 906 B17R2.339 Brc1ccc(cc1Br)CNCc2cccs2 207a_100000211653_100011215943 [0,0,1,0,1,0|2,0,0]=4 907 B17R2.339 Brc1ccc(cc1Br)CNCc2cccs2 207a_100012351559_100000209959 [0,0,1,0,1,0|2,0,0]=4 908 B17R2.339 Brc1ccc(cc1Br)CNCc2cccs2 2230a_100000211653_100012353900 [0,0,1,0,1,0|2,0,0]=4 909 B17R2.339 Brc1ccc(cc1Br)CNCc2cccs2 270004a_100000211653_100011215943 [0,0,1,0,1,0|2,0,0]=4 910 B17R2.339 Brc1ccc(cc1Br)CNCc2cccs2 270004a_100012351559_100000209959 [0,0,1,0,1,0|2,0,0]=4 911 B17R2.339 Brc1ccc(cc1I)CNCc2cccs2 207a_100000211653_100010146563 [0,0,1,0,1,0|2,0,0]=4 912 B17R2.339 Brc1ccc(cc1I)CNCc2cccs2 2230a_100000211653_100010146616 [0,0,1,0,1,0|2,0,0]=4 913 B17R2.339 Brc1ccc(cc1I)CNCc2cccs2 270004a_100000211653_100010146563 [0,0,1,0,1,0|2,0,0]=4 914 B17R2.339 Cc1cc(ccc1Br)CNCc2cccs2 207a_100000211653_100000765772 [0,0,1,0,1,0|2,0,0]=4 915 B17R2.339 Cc1cc(ccc1Br)CNCc2cccs2 207a_100015205234_100000209959 [0,0,1,0,1,0|2,0,0]=4 916 B17R2.339 Cc1cc(ccc1Br)CNCc2cccs2 2230a_100000211653_100000727479 [0,0,1,0,1,0|2,0,0]=4 917 B17R2.339 Cc1cc(ccc1Br)CNCc2cccs2 270004a_100000211653_100000765772 [0,0,1,0,1,0|2,0,0]=4 918 B17R2.339 Cc1cc(ccc1Br)CNCc2cccs2 270004a_100015205234_100000209959 [0,0,1,0,1,0|2,0,0]=4 919 B17R2.339 Cc1cc(ccc1Cl)CNCc2cccs2 207a_100000211653_100000698814 [0,0,1,0,1,0|2,0,0]=4 920 B17R2.339 Cc1cc(ccc1Cl)CNCc2cccs2 2230a_100000211653_100012184735 [0,0,1,0,1,0|2,0,0]=4 921 B17R2.339 Cc1cc(ccc1Cl)CNCc2cccs2 270004a_100000211653_100000698814 [0,0,1,0,1,0|2,0,0]=4 922 B17R2.339 Cc1cc(ccc1F)CNCc2cccs2 207a_100000211653_100000748208 [0,0,1,0,1,0|2,0,0]=4 923 B17R2.339 Cc1cc(ccc1F)CNCc2cccs2 207a_100000239911_100000209959 [0,0,1,0,1,0|2,0,0]=4 924 B17R2.339 Cc1cc(ccc1F)CNCc2cccs2 2230a_100000211653_100011216667 [0,0,1,0,1,0|2,0,0]=4 925 B17R2.339 Cc1cc(ccc1F)CNCc2cccs2 270004a_100000211653_100000748208 [0,0,1,0,1,0|2,0,0]=4 926 B17R2.339 Cc1cc(ccc1F)CNCc2cccs2 270004a_100000239911_100000209959 [0,0,1,0,1,0|2,0,0]=4 927 B17R2.339 Cc1cc(ccc1O)NCCc2cccs2 34a_100011218179_100000748579 [0,0,1,0,1,0|2,0,0]=4 928 B17R2.339 Cc1cc(ccc1O)NCCc2cccs2 7a_100011218179_100000748579 [0,0,1,0,1,0|2,0,0]=4 929 B17R2.339 Cc1cc(ccc1O)SCCc2cccs2 62a_100000748579_100000186361 [0,0,1,0,1,0|2,0,0]=4 930 B17R2.339 Cc1ccc(cc1Br)CNCc2cccs2 207a_100000211653_100000695567 [0,0,1,0,1,0|2,0,0]=4 931 B17R2.339 Cc1ccc(cc1Br)CNCc2cccs2 2230a_100000211653_100012232412 [0,0,1,0,1,0|2,0,0]=4 932 B17R2.339 Cc1ccc(cc1Br)CNCc2cccs2 270004a_100000211653_100000695567 [0,0,1,0,1,0|2,0,0]=4 933 B17R2.339 Cc1ccc(cc1C)CNCc2cccs2 207a_100000211653_100000229942 [0,0,1,0,1,0|2,0,0]=4 934 B17R2.339 Cc1ccc(cc1C)CNCc2cccs2 207a_100025706692_100000209959 [0,0,1,0,1,0|2,0,0]=4 935 B17R2.339 Cc1ccc(cc1C)CNCc2cccs2 2230a_100000211653_100000742320 [0,0,1,0,1,0|2,0,0]=4 936 B17R2.339 Cc1ccc(cc1C)CNCc2cccs2 270004a_100000211653_100000229942 [0,0,1,0,1,0|2,0,0]=4 937 B17R2.339 Cc1ccc(cc1C)CNCc2cccs2 270004a_100025706692_100000209959 [0,0,1,0,1,0|2,0,0]=4 938 B17R2.339 Cc1ccc(cc1Cl)CNCc2cccs2 207a_100000211653_100000760539 [0,0,1,0,1,0|2,0,0]=4 939 B17R2.339 Cc1ccc(cc1Cl)CNCc2cccs2 207a_102495364989_100000209959 [0,0,1,0,1,0|2,0,0]=4 940 B17R2.339 Cc1ccc(cc1Cl)CNCc2cccs2 2230a_100000211653_100011823929 [0,0,1,0,1,0|2,0,0]=4 941 B17R2.339 Cc1ccc(cc1Cl)CNCc2cccs2 270004a_100000211653_100000760539 [0,0,1,0,1,0|2,0,0]=4 942 B17R2.339 Cc1ccc(cc1Cl)CNCc2cccs2 270004a_102495364989_100000209959 [0,0,1,0,1,0|2,0,0]=4 943 B17R2.339 Cc1ccc(cc1F)CNCc2cccs2 207a_100000211653_100000753222 [0,0,1,0,1,0|2,0,0]=4 944 B17R2.339 Cc1ccc(cc1F)CNCc2cccs2 207a_100102708794_100000209959 [0,0,1,0,1,0|2,0,0]=4 945 B17R2.339 Cc1ccc(cc1F)CNCc2cccs2 2230a_100000211653_100011217369 [0,0,1,0,1,0|2,0,0]=4 946 B17R2.339 Cc1ccc(cc1F)CNCc2cccs2 270004a_100000211653_100000753222 [0,0,1,0,1,0|2,0,0]=4 947 B17R2.339 Cc1ccc(cc1F)CNCc2cccs2 270004a_100102708794_100000209959 [0,0,1,0,1,0|2,0,0]=4 948 B17R2.339 Cc1ccc(cc1I)CNCc2cccs2 207a_100000211653_100010197721 [0,0,1,0,1,0|2,0,0]=4 949 B17R2.339 Cc1ccc(cc1I)CNCc2cccs2 2230a_100000211653_100010206137 [0,0,1,0,1,0|2,0,0]=4 950 B17R2.339 Cc1ccc(cc1I)CNCc2cccs2 270004a_100000211653_100010197721 [0,0,1,0,1,0|2,0,0]=4 951 B17R2.339 Cc1ccc(cc1O)NCCc2cccs2 34a_100000759471_100000748579 [0,0,1,0,1,0|2,0,0]=4 952 B17R2.339 Cc1ccc(cc1O)NCCc2cccs2 7a_100000759471_100000748579 [0,0,1,0,1,0|2,0,0]=4 953 B17R2.339 Cc1ccc(cc1O)SCCc2cccs2 62a_100000685420_100000748579 [0,0,1,0,1,0|2,0,0]=4 954 B17R2.339 Cc1ccc(cc1O)SCCc2cccs2 62a_100000748579_100000685420 [0,0,1,0,1,0|2,0,0]=4 955 B17R2.339 Clc1cc(ccc1Br)CNCc2cccs2 207a_100000211653_100000690054 [0,0,1,0,1,0|2,0,0]=4 956 B17R2.339 Clc1cc(ccc1Br)CNCc2cccs2 207a_100012362553_100000209959 [0,0,1,0,1,0|2,0,0]=4 957 B17R2.339 Clc1cc(ccc1Br)CNCc2cccs2 2230a_100000211653_100012353895 [0,0,1,0,1,0|2,0,0]=4 958 B17R2.339 Clc1cc(ccc1Br)CNCc2cccs2 270004a_100000211653_100000690054 [0,0,1,0,1,0|2,0,0]=4 959 B17R2.339 Clc1cc(ccc1Br)CNCc2cccs2 270004a_100012362553_100000209959 [0,0,1,0,1,0|2,0,0]=4 960 B17R2.339 Clc1cc(ccc1I)CNCc2cccs2 2230a_100000211653_100012349665 [0,0,1,0,1,0|2,0,0]=4 961 B17R2.339 Clc1ccc(cc1Br)CNCc2cccs2 207a_100000211653_100000693810 [0,0,1,0,1,0|2,0,0]=4 962 B17R2.339 Clc1ccc(cc1Br)CNCc2cccs2 207a_100012349490_100000209959 [0,0,1,0,1,0|2,0,0]=4 963 B17R2.339 Clc1ccc(cc1Br)CNCc2cccs2 2230a_100000211653_100012353894 [0,0,1,0,1,0|2,0,0]=4 964 B17R2.339 Clc1ccc(cc1Br)CNCc2cccs2 270004a_100000211653_100000693810 [0,0,1,0,1,0|2,0,0]=4 965 B17R2.339 Clc1ccc(cc1Br)CNCc2cccs2 270004a_100012349490_100000209959 [0,0,1,0,1,0|2,0,0]=4 966 B17R2.339 Clc1ccc(cc1Cl)CNCc2cccs2 207a_100000174881_100000209959 [0,0,1,0,1,0|2,0,0]=4 967 B17R2.339 Clc1ccc(cc1Cl)CNCc2cccs2 207a_100000211653_100000188533 [0,0,1,0,1,0|2,0,0]=4 968 B17R2.339 Clc1ccc(cc1Cl)CNCc2cccs2 2230a_100000211653_100000184707 [0,0,1,0,1,0|2,0,0]=4 969 B17R2.339 Clc1ccc(cc1Cl)CNCc2cccs2 270004a_100000174881_100000209959 [0,0,1,0,1,0|2,0,0]=4 970 B17R2.339 Clc1ccc(cc1Cl)CNCc2cccs2 270004a_100000211653_100000188533 [0,0,1,0,1,0|2,0,0]=4 971 B17R2.339 Clc1ccc(cc1I)CNCc2cccs2 207a_100000211653_100010209939 [0,0,1,0,1,0|2,0,0]=4 972 B17R2.339 Clc1ccc(cc1I)CNCc2cccs2 270004a_100000211653_100010209939 [0,0,1,0,1,0|2,0,0]=4 973 B17R2.339 Fc1cc(ccc1Br)CNCc2cccs2 207a_100000211653_100000686674 [0,0,1,0,1,0|2,0,0]=4 974 B17R2.339 Fc1cc(ccc1Br)CNCc2cccs2 207a_100000755036_100000209959 [0,0,1,0,1,0|2,0,0]=4 975 B17R2.339 Fc1cc(ccc1Br)CNCc2cccs2 2230a_100000211653_100000767054 [0,0,1,0,1,0|2,0,0]=4 976 B17R2.339 Fc1cc(ccc1Br)CNCc2cccs2 270004a_100000211653_100000686674 [0,0,1,0,1,0|2,0,0]=4 977 B17R2.339 Fc1cc(ccc1Br)CNCc2cccs2 270004a_100000755036_100000209959 [0,0,1,0,1,0|2,0,0]=4 978 B17R2.339 Fc1cc(ccc1Cl)CNCc2cccs2 207a_100000211653_100000745630 [0,0,1,0,1,0|2,0,0]=4 979 B17R2.339 Fc1cc(ccc1Cl)CNCc2cccs2 207a_100011219866_100000209959 [0,0,1,0,1,0|2,0,0]=4 980 B17R2.339 Fc1cc(ccc1Cl)CNCc2cccs2 2230a_100000211653_100000716492 [0,0,1,0,1,0|2,0,0]=4 981 B17R2.339 Fc1cc(ccc1Cl)CNCc2cccs2 270004a_100000211653_100000745630 [0,0,1,0,1,0|2,0,0]=4 982 B17R2.339 Fc1cc(ccc1Cl)CNCc2cccs2 270004a_100011219866_100000209959 [0,0,1,0,1,0|2,0,0]=4 983 B17R2.339 Fc1cc(ccc1I)CNCc2cccs2 207a_100000211653_100000050832 [0,0,1,0,1,0|2,0,0]=4 984 B17R2.339 Fc1cc(ccc1I)CNCc2cccs2 2230a_100000211653_100010149604 [0,0,1,0,1,0|2,0,0]=4 985 B17R2.339 Fc1cc(ccc1I)CNCc2cccs2 270004a_100000211653_100000050832 [0,0,1,0,1,0|2,0,0]=4 986 B17R2.339 Fc1ccc(cc1Br)CNCc2cccs2 207a_100000211653_100000211747 [0,0,1,0,1,0|2,0,0]=4 987 B17R2.339 Fc1ccc(cc1Br)CNCc2cccs2 207a_100015193890_100000209959 [0,0,1,0,1,0|2,0,0]=4 988 B17R2.339 Fc1ccc(cc1Br)CNCc2cccs2 2230a_100000211653_100011206884 [0,0,1,0,1,0|2,0,0]=4 989 B17R2.339 Fc1ccc(cc1Br)CNCc2cccs2 270004a_100000211653_100000211747 [0,0,1,0,1,0|2,0,0]=4 990 B17R2.339 Fc1ccc(cc1Br)CNCc2cccs2 270004a_100015193890_100000209959 [0,0,1,0,1,0|2,0,0]=4 991 B17R2.339 Fc1ccc(cc1Cl)CNCc2cccs2 207a_100000211653_100000742290 [0,0,1,0,1,0|2,0,0]=4 992 B17R2.339 Fc1ccc(cc1Cl)CNCc2cccs2 207a_100000749334_100000209959 [0,0,1,0,1,0|2,0,0]=4 993 B17R2.339 Fc1ccc(cc1Cl)CNCc2cccs2 2230a_100000211653_100000717365 [0,0,1,0,1,0|2,0,0]=4 994 B17R2.339 Fc1ccc(cc1Cl)CNCc2cccs2 270004a_100000211653_100000742290 [0,0,1,0,1,0|2,0,0]=4 995 B17R2.339 Fc1ccc(cc1Cl)CNCc2cccs2 270004a_100000749334_100000209959 [0,0,1,0,1,0|2,0,0]=4 996 B17R2.339 Fc1ccc(cc1F)CNCc2cccs2 207a_100000211653_100000211062 [0,0,1,0,1,0|2,0,0]=4 997 B17R2.339 Fc1ccc(cc1F)CNCc2cccs2 207a_100000737897_100000209959 [0,0,1,0,1,0|2,0,0]=4 998 B17R2.339 Fc1ccc(cc1F)CNCc2cccs2 2230a_100000211653_100000757363 [0,0,1,0,1,0|2,0,0]=4 999 B17R2.339 Fc1ccc(cc1F)CNCc2cccs2 270004a_100000211653_100000211062 [0,0,1,0,1,0|2,0,0]=4 1000 B17R2.339 Fc1ccc(cc1F)CNCc2cccs2 270004a_100000737897_100000209959 [0,0,1,0,1,0|2,0,0]=4 1001 B17R2.339 Fc1ccc(cc1I)CNCc2cccs2 207a_100000211653_100010188209 [0,0,1,0,1,0|2,0,0]=4 1002 B17R2.339 Fc1ccc(cc1I)CNCc2cccs2 2230a_100000211653_100010188208 [0,0,1,0,1,0|2,0,0]=4 1003 B17R2.339 Fc1ccc(cc1I)CNCc2cccs2 270004a_100000211653_100010188209 [0,0,1,0,1,0|2,0,0]=4 1004 B17R2.339 Nc1cc(ccc1O)SCCc2cccs2 62a_100000748579_100000752626 [0,0,1,0,1,0|2,0,0]=4 1005 B17R2.339 Nc1cc(ccc1O)SCCc2cccs2 62a_100000752626_100000748579 [0,0,1,0,1,0|2,0,0]=4 1006 B17R2.339 Nc1ccc(cc1O)SCCc2cccs2 62a_100000739049_100000748579 [0,0,1,0,1,0|2,0,0]=4 1007 B17R2.339 Nc1ccc(cc1O)SCCc2cccs2 62a_100000748579_100000739049 [0,0,1,0,1,0|2,0,0]=4 1008 B17R2.339 O=c1cc(occ1O)CNCc2cccs2 2230a_100000211653_100000010605 [0,0,1,0,1,0|1,0,1]=4 1009 B17R2.339 Oc1cc(ccc1Br)SCCc2cccs2 62a_100000748579_100012356990 [0,0,1,0,1,0|2,0,0]=4 1010 B17R2.339 Oc1cc(ccc1Br)SCCc2cccs2 62a_100012356990_100000748579 [0,0,1,0,1,0|2,0,0]=4 1011 B17R2.339 Oc1cc(ccc1Cl)CNCc2cncs2 34a_100020636435_100015185245 [0,0,1,0,1,0|2,0,0]=4 1012 B17R2.339 Oc1cc(ccc1Cl)CNCc2nccs2 34a_100020636435_100015184050 [0,0,1,0,1,0|2,0,0]=4 1013 B17R2.339 Oc1cc(ccc1Cl)NCCc2cccs2 34a_100011934209_100000748579 [0,0,1,0,1,0|2,0,0]=4 1014 B17R2.339 Oc1cc(ccc1Cl)SCCc2cccs2 62a_100000748579_100011356854 [0,0,1,0,1,0|2,0,0]=4 1015 B17R2.339 Oc1cc(ccc1Cl)SCCc2cccs2 62a_100011356854_100000748579 [0,0,1,0,1,0|2,0,0]=4 1016 B17R2.339 Oc1cc(ccc1F)CNCc2ccco2 207a_100160469508_100000186105 [0,0,1,0,1,0|1,1,0]=4 1017 B17R2.339 Oc1cc(ccc1F)CNCc2ccco2 270004a_100160469508_100000186105 [0,0,1,0,1,0|1,1,0]=4 1018 B17R2.339 Oc1cc(ccc1F)CNCc2cccs2 207a_100160469508_100000209959 [0,0,1,0,1,0|1,0,0]=3 1019 B17R2.339 Oc1cc(ccc1F)CNCc2cccs2 270004a_100160469508_100000209959 [0,0,1,0,1,0|1,0,0]=3 1020 B17R2.339 Oc1cc(ccc1F)CNCc2cncs2 207a_100160469508_100000749870 [0,0,1,0,1,0|2,0,0]=4 1021 B17R2.339 Oc1cc(ccc1F)CNCc2cncs2 270004a_100160469508_100000749870 [0,0,1,0,1,0|2,0,0]=4 1022 B17R2.339 Oc1cc(ccc1F)CNCc2cncs2 34a_100160469508_100015185245 [0,0,1,0,1,0|2,0,0]=4 1023 B17R2.339 Oc1cc(ccc1F)CNCc2nccs2 207a_100160469508_100000750902 [0,0,1,0,1,0|2,0,0]=4 1024 B17R2.339 Oc1cc(ccc1F)CNCc2nccs2 270004a_100160469508_100000750902 [0,0,1,0,1,0|2,0,0]=4 1025 B17R2.339 Oc1cc(ccc1F)CNCc2nccs2 34a_100160469508_100015184050 [0,0,1,0,1,0|2,0,0]=4 1026 B17R2.339 Oc1cc(ccc1F)NCCc2cccs2 34a_100012017398_100000748579 [0,0,1,0,1,0|2,0,0]=4 1027 B17R2.339 Oc1cc(ccc1F)NCCc2cccs2 7a_100012017398_100000748579 [0,0,1,0,1,0|2,0,0]=4 1028 B17R2.339 Oc1cc(ccc1F)SCCc2cccs2 62a_100000686035_100000748579 [0,0,1,0,1,0|2,0,0]=4 1029 B17R2.339 Oc1cc(ccc1F)SCCc2cccs2 62a_100000748579_100000686035 [0,0,1,0,1,0|2,0,0]=4 1030 B17R2.339 Oc1ccc(cc1Br)NCCc2cccs2 34a_100011534360_100000748579 [0,0,1,0,1,0|2,0,0]=4 1031 B17R2.339 Oc1ccc(cc1Br)SCCc2cccs2 62a_100000748579_100012361655 [0,0,1,0,1,0|2,0,0]=4 1032 B17R2.339 Oc1ccc(cc1Br)SCCc2cccs2 62a_100012361655_100000748579 [0,0,1,0,1,0|2,0,0]=4 1033 B17R2.339 Oc1ccc(cc1Cl)NCCc2cccs2 34a_100000744943_100000748579 [0,0,1,0,1,0|2,0,0]=4 1034 B17R2.339 Oc1ccc(cc1Cl)SCCc2cccs2 62a_100000748579_100012360047 [0,0,1,0,1,0|2,0,0]=4 1035 B17R2.339 Oc1ccc(cc1Cl)SCCc2cccs2 62a_100012360047_100000748579 [0,0,1,0,1,0|2,0,0]=4 1036 B17R2.339 Oc1ccc(cc1F)CNCc2ccco2 270004a_100000758358_100000186105 [0,0,1,0,1,0|1,1,0]=4 1037 B17R2.339 Oc1ccc(cc1F)CNCc2cccs2 270004a_100000758358_100000209959 [0,0,1,0,1,0|1,0,0]=3 1038 B17R2.339 Oc1ccc(cc1F)CNCc2cncs2 270004a_100000758358_100000749870 [0,0,1,0,1,0|2,0,0]=4 1039 B17R2.339 Oc1ccc(cc1F)CNCc2cncs2 34a_100000758358_100015185245 [0,0,1,0,1,0|2,0,0]=4 1040 B17R2.339 Oc1ccc(cc1F)CNCc2nccs2 270004a_100000758358_100000750902 [0,0,1,0,1,0|2,0,0]=4 1041 B17R2.339 Oc1ccc(cc1F)CNCc2nccs2 34a_100000758358_100015184050 [0,0,1,0,1,0|2,0,0]=4 1042 B17R2.339 Oc1ccc(cc1F)NCCc2cccs2 34a_100011220035_100000748579 [0,0,1,0,1,0|2,0,0]=4 1043 B17R2.339 Oc1ccc(cc1F)NCCc2cccs2 7a_100011220035_100000748579 [0,0,1,0,1,0|2,0,0]=4 1044 B17R2.339 Oc1ccc(cc1F)SCCc2cccs2 62a_100000185481_100000748579 [0,0,1,0,1,0|2,0,0]=4 1045 B17R2.339 Oc1ccc(cc1F)SCCc2cccs2 62a_100000748579_100000185481 [0,0,1,0,1,0|2,0,0]=4 1046 B17R2.339 Oc1ccc(cc1O)CCNc2ncns2 27a_100000210387_100000693119 [0,0,1,0,1,0|2,0,0]=4 1047 B17R2.339 Oc1ccc(cc1O)CCNc2nncs2 27a_100000210387_100000739804 [0,0,1,0,1,0|2,0,0]=4 1048 B17R2.339 Oc1ccc(cc1O)CCSc2ccco2 62a_100009814098_200010393615 [0,0,1,0,1,0|1,1,0]=4 1049 B17R2.339 Oc1ccc(cc1O)CCSc2cccs2 62a_100011215356_200010393615 [0,0,1,0,1,0|1,0,0]=3 1050 B17R2.339 Oc1ccc(cc1O)CCSc2cncs2 62a_100011934649_200010393615 [0,0,1,0,1,0|2,0,0]=4 1051 B17R2.339 Oc1ccc(cc1O)CCSc2nccs2 62a_100000211983_200010393615 [0,0,1,0,1,0|2,0,0]=4 1052 B17R2.339 Oc1ccc(cc1O)CNCc2c[nH]cn2 34a_100000010075_100000707719 [0,0,1,0,1,0|2,0,0]=4 1053 B17R2.339 Oc1ccc(cc1O)CNCc2ccn[nH]2 34a_100000010075_100000728653 [0,0,1,0,1,0|2,0,0]=4 1054 B17R2.339 Oc1ccc(cc1O)CNCc2ccon2 34a_100000010075_100000234950 [0,0,1,0,1,0|2,0,0]=4 1055 B17R2.339 Oc1ccc(cc1O)CNCc2ccsc2 34a_100000010075_100011261437 [0,0,1,0,1,0|2,0,0]=4 1056 B17R2.339 Oc1ccc(cc1O)CNCc2cncs2 34a_100000010075_100015185245 [0,0,1,0,1,0|1,0,0]=3 1057 B17R2.339 Oc1ccc(cc1O)CNCc2cscn2 34a_100000010075_100000205941 [0,0,1,0,1,0|2,0,0]=4 1058 B17R2.339 Oc1ccc(cc1O)CNCc2ncc[nH]2 34a_100000010075_100016991755 [0,0,1,0,1,0|2,0,0]=4 1059 B17R2.339 Oc1ccc(cc1O)CNCc2ncco2 34a_100000010075_103436540062 [0,0,1,0,1,0|1,1,0]=4 1060 B17R2.339 Oc1ccc(cc1O)CNCc2nccs2 34a_100000010075_100015184050 [0,0,1,0,1,0|1,0,0]=3 1061 B17R2.339 Oc1ccc(cc1O)NCCc2cccs2 34a_100102946323_100000748579 [0,0,1,0,1,0|1,0,0]=3 1062 B17R2.339 Oc1ccc(cc1O)SCCc2cccs2 62a_100000748579_100009813601 [0,0,1,0,1,0|1,0,0]=3 1063 B17R2.339 Oc1ncc(cc1Br)CNCc2cccs2 207a_100000211653_100010064886 [0,0,1,0,1,0|2,0,0]=4 1064 B17R2.339 Oc1ncc(cc1Br)CNCc2cccs2 270004a_100000211653_100010064886 [0,0,1,0,1,0|2,0,0]=4 1065 B19R2.67031 CNCc1sccc1SCc2cc(=O)c(co2)O 62a_100000767120_100000010605 [0,0,1,0,0,1|1,0,1]=4 1066 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)Br)C 62a_100000767120_100012232412 [0,0,1,0,0,1|2,0,0]=4 1067 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)Br)C 62a_100012232412_100000767120 [0,0,1,0,0,1|2,0,0]=4 1068 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)Br)F 62a_100000767120_100011206884 [0,0,1,0,0,1|2,0,0]=4 1069 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)Br)F 62a_100011206884_100000767120 [0,0,1,0,0,1|2,0,0]=4 1070 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)C)Br 62a_100000727479_100000767120 [0,0,1,0,0,1|2,0,0]=4 1071 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)C)Br 62a_100000767120_100000727479 [0,0,1,0,0,1|2,0,0]=4 1072 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)C)C 62a_100000742320_100000767120 [0,0,1,0,0,1|2,0,0]=4 1073 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)C)C 62a_100000767120_100000742320 [0,0,1,0,0,1|2,0,0]=4 1074 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)C)Cl 62a_100000767120_100012184735 [0,0,1,0,0,1|2,0,0]=4 1075 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)C)Cl 62a_100012184735_100000767120 [0,0,1,0,0,1|2,0,0]=4 1076 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)C)F 62a_100000767120_100011216667 [0,0,1,0,0,1|2,0,0]=4 1077 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)C)F 62a_100011216667_100000767120 [0,0,1,0,0,1|2,0,0]=4 1078 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)Cl)C 62a_100000767120_100011823929 [0,0,1,0,0,1|2,0,0]=4 1079 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)Cl)C 62a_100011823929_100000767120 [0,0,1,0,0,1|2,0,0]=4 1080 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)Cl)F 62a_100000717365_100000767120 [0,0,1,0,0,1|2,0,0]=4 1081 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)Cl)F 62a_100000767120_100011934319 [0,0,1,0,0,1|2,0,0]=4 1082 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)F)Br 62a_100000767054_100000767120 [0,0,1,0,0,1|2,0,0]=4 1083 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)F)Br 62a_100000767120_100000767054 [0,0,1,0,0,1|2,0,0]=4 1084 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)F)C 62a_100000767120_100011217369 [0,0,1,0,0,1|2,0,0]=4 1085 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)F)C 62a_100011217369_100000767120 [0,0,1,0,0,1|2,0,0]=4 1086 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)F)Cl 62a_100000716492_100000767120 [0,0,1,0,0,1|2,0,0]=4 1087 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)F)Cl 62a_100000767120_100000716492 [0,0,1,0,0,1|2,0,0]=4 1088 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)F)F 62a_100000757363_100000767120 [0,0,1,0,0,1|2,0,0]=4 1089 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)F)F 62a_100000767120_100000757363 [0,0,1,0,0,1|2,0,0]=4 1090 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)F)I 62a_100000767120_100010149604 [0,0,1,0,0,1|2,0,0]=4 1091 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)F)I 62a_100010149604_100000767120 [0,0,1,0,0,1|2,0,0]=4 1092 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)I)C 62a_100000767120_100010206137 [0,0,1,0,0,1|2,0,0]=4 1093 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)I)C 62a_100010206137_100000767120 [0,0,1,0,0,1|2,0,0]=4 1094 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)I)F 62a_100000767120_100010188208 [0,0,1,0,0,1|2,0,0]=4 1095 B19R2.67031 CNCc1sccc1SCc2ccc(c(c2)I)F 62a_100010188208_100000767120 [0,0,1,0,0,1|2,0,0]=4 1096 B19R2.117829 CNCc1cc(ccn1)Sc2ccc(c(c2)O)O 62a_100102954512_100009813601 [0,0,1,0,0,1|2,0,0]=4 1097 B19R2.117829 CNCc1cccc(c1)Sc2ccc(c(c2)O)O 62a_100000187585_100009813601 [0,0,1,0,0,1|2,0,0]=4 1098 B19R2.117829 CNCc1cccc(n1)Sc2ccc(c(c2)O)O 62a_106354212997_100009813601 [0,0,1,0,0,1|2,0,0]=4 1099 B19R2.11839 Oc1ccc(cc1O)CCNCc2ccccc2 34a_100000210387_100015291786 [0,0,1,0,0,1|1,0,0]=3 1100 B19R2.11839 Oc1ccc(cc1O)CCNCc2ccccn2 34a_100000210387_100000721315 [0,0,1,0,0,1|1,0,0]=3 1101 B19R2.11839 Oc1ccc(cc1O)CCNCc2cccnc2 34a_100000210387_100000733263 [0,0,1,0,0,1|1,0,0]=3 1102 B19R2.11839 Oc1ccc(cc1O)CCNCc2cccnn2 34a_100000210387_100016990269 [0,0,1,0,0,1|1,0,0]=3 1103 B19R2.11839 Oc1ccc(cc1O)CCNCc2cnccn2 34a_100000210387_100016995436 [0,0,1,0,0,1|1,0,0]=3 1104 B19R2.11839 Oc1ccc(cc1O)CCNCc2cncnc2 34a_100000210387_100015196519 [0,0,1,0,0,1|2,0,0]=4 1105 B19R2.11839 Oc1ccc(cc1O)CCNCc2ncccn2 34a_100000210387_100000703007 [0,0,1,0,0,1|1,0,0]=3 1106 B19R2.11839 Oc1ccc(cc1O)CCOCc2ccccc2 7a_100000210790_200010393615 [0,0,1,0,0,1|2,0,0]=4 1107 B19R2.11839 Oc1ccc(cc1O)CCSCc2ccccc2 62a_100000211182_200010393615 [0,0,1,0,0,1|2,0,0]=4 1108 B19R2.11839 Oc1ccc(cc1O)CCSCc2ccccn2 62a_100000721315_200010393615 [0,0,1,0,0,1|2,0,0]=4 1109 B19R2.11839 Oc1ccc(cc1O)CCSCc2cccnc2 62a_100000741622_200010393615 [0,0,1,0,0,1|2,0,0]=4 1110 B19R2.11839 Oc1ccc(cc1O)CCSCc2cccnn2 62a_100016990269_200010393615 [0,0,1,0,0,1|2,0,0]=4 1111 B19R2.11839 Oc1ccc(cc1O)CCSCc2ccncc2 62a_100015193705_200010393615 [0,0,1,0,0,1|2,0,0]=4 1112 B19R2.11839 Oc1ccc(cc1O)CCSCc2cnccn2 62a_100016995436_200010393615 [0,0,1,0,0,1|2,0,0]=4 1113 B19R2.11839 Oc1ccc(cc1O)CCSCc2ncccn2 62a_100000703007_200010393615 [0,0,1,0,0,1|2,0,0]=4 1114 B19R2.12036 Cc1cc(ccc1Cl)OCCNCc2cccs2 207a_100025718798_100000209959 [0,0,1,0,0,1|2,0,0]=4 1115 B19R2.12036 Cc1cc(ccc1Cl)OCCNCc2cccs2 270004a_100025718798_100000209959 [0,0,1,0,0,1|2,0,0]=4 1116 B19R2.12036 Cc1ccc(cc1C)CCNCCc2cccs2 2230a_100020591374_100000748579 [0,0,1,0,0,1|2,0,0]=4 1117 B19R2.12036 Cc1ccc(cc1C)CCNCCc2cccs2 34a_100020591374_100000748579 [0,0,1,0,0,1|2,0,0]=4 1118 B19R2.12036 Cc1ccc(cc1C)OCCNCc2cccs2 207a_100015185357_100000209959 [0,0,1,0,0,1|2,0,0]=4 1119 B19R2.12036 Cc1ccc(cc1C)OCCNCc2cccs2 2230a_100000211653_200011210794 [0,0,1,0,0,1|2,0,0]=4 1120 B19R2.12036 Cc1ccc(cc1C)OCCNCc2cccs2 270004a_100015185357_100000209959 [0,0,1,0,0,1|2,0,0]=4 1121 B19R2.12036 Clc1ccc(cc1Cl)CCNCCc2cccs2 2230a_100000203755_100011713676 [0,0,1,0,0,1|2,0,0]=4 1122 B19R2.12036 Clc1ccc(cc1Cl)CCNCCc2cccs2 2230a_100011207230_100000748579 [0,0,1,0,0,1|2,0,0]=4 1123 B19R2.12036 Clc1ccc(cc1Cl)CCNCCc2cccs2 34a_100000203755_100011713676 [0,0,1,0,0,1|2,0,0]=4 1124 B19R2.12036 Clc1ccc(cc1Cl)CCNCCc2cccs2 34a_100011207230_100000748579 [0,0,1,0,0,1|2,0,0]=4 1125 B19R2.12036 Clc1ccc(cc1Cl)OCCNCc2cccs2 207a_100015199673_100000209959 [0,0,1,0,0,1|2,0,0]=4 1126 B19R2.12036 Clc1ccc(cc1Cl)OCCNCc2cccs2 270004a_100015199673_100000209959 [0,0,1,0,0,1|2,0,0]=4 1127 B19R2.12036 Fc1ccc(cc1Cl)CCNCCc2cccs2 2230a_100000203755_100012361305 [0,0,1,0,0,1|2,0,0]=4 1128 B19R2.12036 Fc1ccc(cc1Cl)CCNCCc2cccs2 2230a_200011997520_100000748579 [0,0,1,0,0,1|2,0,0]=4 1129 B19R2.12036 Fc1ccc(cc1Cl)CCNCCc2cccs2 34a_100000203755_100012361305 [0,0,1,0,0,1|2,0,0]=4 1130 B19R2.12036 Fc1ccc(cc1Cl)CCNCCc2cccs2 34a_200011997520_100000748579 [0,0,1,0,0,1|2,0,0]=4 1131 B19R2.12036 Fc1ccc(cc1Cl)OCCNCc2cccs2 2230a_100000211653_100011936913 [0,0,1,0,0,1|2,0,0]=4 1132 B19R2.12036 Fc1ccc(cc1F)CCNCCc2cccs2 2230a_100000203755_100000690553 [0,0,1,0,0,1|2,0,0]=4 1133 B19R2.12036 Fc1ccc(cc1F)CCNCCc2cccs2 2230a_200000706328_100000748579 [0,0,1,0,0,1|2,0,0]=4 1134 B19R2.12036 Fc1ccc(cc1F)CCNCCc2cccs2 34a_100000203755_100000690553 [0,0,1,0,0,1|2,0,0]=4 1135 B19R2.12036 Fc1ccc(cc1F)CCNCCc2cccs2 34a_200000706328_100000748579 [0,0,1,0,0,1|2,0,0]=4 1136 B19R2.12036 Oc1cc(ccc1Cl)CNCCCc2cccs2 34a_100020636435_100010992444 [0,0,1,0,0,1|2,0,0]=4 1137 B19R2.12036 Oc1cc(ccc1F)CNCCCc2cccs2 34a_100160469508_100010992444 [0,0,1,0,0,1|2,0,0]=4 1138 B19R2.12036 Oc1ccc(cc1F)CNCCCc2cccs2 34a_100000758358_100010992444 [0,0,1,0,0,1|2,0,0]=4 1139 B19R2.12036 Oc1ccc(cc1O)CCNCCc2cccs2 34a_100000210387_100000748579 [0,0,1,0,0,1|0,0,0]=2 1140 B19R2.12036 Oc1ccc(cc1O)CCNCCn2cccn2 34a_100000210387_100015204718 [0,0,1,0,0,1|2,0,0]=4 1141 B19R2.12036 Oc1ccc(cc1O)CCOCCc2cccs2 7a_100011216825_200010393615 [0,0,1,0,0,1|1,0,0]=3 1142 B19R2.12036 Oc1ccc(cc1O)CCSCCc2cccs2 62a_100000748579_200010393615 [0,0,1,0,0,1|1,0,0]=3 1143 B19R2.12036 Oc1ccc(cc1O)CNCCCc2cccs2 34a_100000010075_100010992444 [0,0,1,0,0,1|1,0,0]=3 1144 B21R3.29964 Oc1cc(ccc1Cl)CNC2CCCc3c2ccs3 269862a_100020636435_100000024123 [0,0,0,0,0,2|2,0,0]=4 1145 B21R3.29964 Oc1cc(ccc1F)CNC2CCCc3c2ccs3 269862a_100160469508_100000024123 [0,0,0,0,0,2|2,0,0]=4 1146 B21R3.29964 Oc1ccc(cc1F)CNC2CCCc3c2ccs3 269862a_100000758358_100000024123 [0,0,0,0,0,2|2,0,0]=4