0 B21R3.29689 Cc1cc(n[nH]c1=O)SCc2csc3c2cccc3 62a_200000742921_100012187101 [0,0,0,0,0,0|3,1,0]=4 1 B21R3.29689 Cc1cc(n[nH]c1=O)SCc2nnc3n2cccc3 62a_100000037651_100012187101 [0,0,0,0,0,0|4,0,0]=4 2 B21R3.29689 Cc1cc(n[nH]c1=O)SCc2noc3c2cccc3 62a_100009813815_100012187101 [0,0,0,0,0,0|2,0,0]=2 3 B21R3.29689 Cc1cc(ncc1Br)SCc2noc3c2cccc3 62a_100009813815_100012356354 [0,0,0,0,0,0|4,0,0]=4 4 B21R3.29689 Cc1cc(ncc1Br)SCc2noc3c2cccc3 62a_100012356354_100009813815 [0,0,0,0,0,0|4,0,0]=4 5 B21R3.29689 Cc1cc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100009818257 [0,0,0,0,0,0|4,0,0]=4 6 B21R3.29689 Cc1cc(ncc1F)SCc2noc3c2cccc3 62a_100009818257_100009813815 [0,0,0,0,0,0|4,0,0]=4 7 B21R3.29689 Cc1cc(ncc1N)SCc2noc3c2cccc3 62a_100000067204_100009813815 [0,0,0,0,0,0|4,0,0]=4 8 B21R3.29689 Cc1cc(ncc1N)SCc2noc3c2cccc3 62a_100009813815_100000067204 [0,0,0,0,0,0|4,0,0]=4 9 B21R3.29689 Cc1cc(ncc1O)SCc2noc3c2cccc3 62a_100009813815_100000692680 [0,0,0,0,0,0|3,0,1]=4 10 B21R3.29689 Cc1cc(nnc1N)SCc2noc3c2cccc3 62a_100009813815_100153394926 [0,0,0,0,0,0|3,0,1]=4 11 B21R3.29689 Cc1cc(nnc1N)SCc2noc3c2cccc3 62a_100153394926_100009813815 [0,0,0,0,0,0|3,0,1]=4 12 B21R3.29689 Cc1ccc(cc1O)SCc2noc3c2cccc3 62a_100000685420_100009813815 [0,0,0,0,0,0|4,0,0]=4 13 B21R3.29689 Cc1ccc(cc1O)SCc2noc3c2cccc3 62a_100009813815_100000685420 [0,0,0,0,0,0|4,0,0]=4 14 B21R3.29689 Cc1ccc(nc1C)SCc2noc3c2cccc3 62a_100000103781_100009813815 [0,0,0,0,0,0|4,0,0]=4 15 B21R3.29689 Cc1ccc(nc1C)SCc2noc3c2cccc3 62a_100009813815_100000103781 [0,0,0,0,0,0|4,0,0]=4 16 B21R3.29689 Cc1ccc(nc1N)SCc2noc3c2cccc3 62a_100009813815_100009857032 [0,0,0,0,0,0|4,0,0]=4 17 B21R3.29689 Cc1ccc(nc1N)SCc2noc3c2cccc3 62a_100009857032_100009813815 [0,0,0,0,0,0|4,0,0]=4 18 B21R3.29689 Cc1cnc(cc1C)SCc2noc3c2cccc3 62a_100009813815_100009850809 [0,0,0,0,0,0|4,0,0]=4 19 B21R3.29689 Cc1cnc(cc1C)SCc2noc3c2cccc3 62a_100009850809_100009813815 [0,0,0,0,0,0|4,0,0]=4 20 B21R3.29689 Cc1cnc(cc1F)SCc2noc3c2cccc3 62a_100009813815_100009841206 [0,0,0,0,0,0|4,0,0]=4 21 B21R3.29689 Cc1cnc(cc1F)SCc2noc3c2cccc3 62a_100009841206_100009813815 [0,0,0,0,0,0|4,0,0]=4 22 B21R3.29689 Cc1cnc(cc1N)SCc2noc3c2cccc3 62a_100000126663_100009813815 [0,0,0,0,0,0|4,0,0]=4 23 B21R3.29689 Cc1cnc(cc1N)SCc2noc3c2cccc3 62a_100009813815_100000126663 [0,0,0,0,0,0|4,0,0]=4 24 B21R3.29689 Cc1cnc(cc1O)SCc2noc3c2cccc3 62a_100000704368_100009813815 [0,0,0,0,0,0|3,0,0]=3 25 B21R3.29689 Cc1cnc(cc1O)SCc2noc3c2cccc3 62a_100009813815_100000704368 [0,0,0,0,0,0|3,0,0]=3 26 B21R3.29689 Cc1cnc(nc1N)SCc2noc3c2cccc3 62a_100009813815_100011996698 [0,0,0,0,0,0|3,0,0]=3 27 B21R3.29689 Cc1cnc(nc1N)SCc2noc3c2cccc3 62a_100011996698_100009813815 [0,0,0,0,0,0|3,0,0]=3 28 B21R3.29689 Cc1nc(c[nH]c1=O)SCc2csc3c2cccc3 62a_100010363809_200000742921 [0,0,0,0,0,0|3,1,0]=4 29 B21R3.29689 Cc1nc(c[nH]c1=O)SCc2csc3c2cccc3 62a_200000742921_100010363809 [0,0,0,0,0,0|3,1,0]=4 30 B21R3.29689 Cc1nc(c[nH]c1=O)SCc2nnc3n2cccc3 62a_100000037651_100010363809 [0,0,0,0,0,0|4,0,0]=4 31 B21R3.29689 Cc1nc(c[nH]c1=O)SCc2nnc3n2cccc3 62a_100010363809_100000037651 [0,0,0,0,0,0|4,0,0]=4 32 B21R3.29689 Cc1nc(c[nH]c1=O)SCc2noc3c2cccc3 62a_100009813815_100010363809 [0,0,0,0,0,0|2,0,0]=2 33 B21R3.29689 Cc1nc(c[nH]c1=O)SCc2noc3c2cccc3 62a_100010363809_100009813815 [0,0,0,0,0,0|2,0,0]=2 34 B21R3.29689 Cc1nc(c[nH]c1=O)SCn2nnc3c2cccc3 62a_100010363809_100000033166 [0,0,0,0,0,0|4,0,0]=4 35 B21R3.29689 Cc1nc(ccc1Br)SCc2noc3c2cccc3 62a_100009813815_100012360386 [0,0,0,0,0,0|4,0,0]=4 36 B21R3.29689 Cc1nc(ccc1Br)SCc2noc3c2cccc3 62a_100012360386_100009813815 [0,0,0,0,0,0|4,0,0]=4 37 B21R3.29689 Cc1nc(ccc1F)SCc2noc3c2cccc3 62a_100009813815_100009814307 [0,0,0,0,0,0|4,0,0]=4 38 B21R3.29689 Cc1nc(ccc1F)SCc2noc3c2cccc3 62a_100009814307_100009813815 [0,0,0,0,0,0|4,0,0]=4 39 B21R3.29689 Cc1nc(ccc1N)SCc2noc3c2cccc3 62a_100000720120_100009813815 [0,0,0,0,0,0|4,0,0]=4 40 B21R3.29689 Cc1nc(ccc1N)SCc2noc3c2cccc3 62a_100009813815_100000720120 [0,0,0,0,0,0|4,0,0]=4 41 B21R3.29689 Cc1nc(ccc1O)SCc2noc3c2cccc3 62a_100009813815_100010233687 [0,0,0,0,0,0|3,0,1]=4 42 B21R3.29689 Cc1nc(ccc1O)SCc2noc3c2cccc3 62a_100010233687_100009813815 [0,0,0,0,0,0|3,0,1]=4 43 B21R3.29689 Cc1nc(cnc1N)SCc2noc3c2cccc3 62a_100009813815_100009818571 [0,0,0,0,0,0|3,0,1]=4 44 B21R3.29689 Cc1nc(cnc1N)SCc2noc3c2cccc3 62a_100009818571_100009813815 [0,0,0,0,0,0|3,0,1]=4 45 B21R3.29689 Cc1nc(ncc1Cl)SCc2noc3c2cccc3 62a_100009813815_100010174973 [0,0,0,0,0,0|3,0,0]=3 46 B21R3.29689 Cc1nc(ncc1Cl)SCc2noc3c2cccc3 62a_100010174973_100009813815 [0,0,0,0,0,0|3,0,0]=3 47 B21R3.29689 Cc1nc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100015641512 [0,0,0,0,0,0|3,0,0]=3 48 B21R3.29689 Cc1nc(ncc1F)SCc2noc3c2cccc3 62a_100015641512_100009813815 [0,0,0,0,0,0|3,0,0]=3 49 B21R3.29689 Cc1nc(ncc1N)SCc2noc3c2cccc3 62a_100000123670_100009813815 [0,0,0,0,0,0|3,0,0]=3 50 B21R3.29689 Cc1nc(ncc1N)SCc2noc3c2cccc3 62a_100009813815_100000123670 [0,0,0,0,0,0|3,0,0]=3 51 B21R3.29689 Cc1ncc(cc1O)SCc2noc3c2cccc3 62a_100009813815_100009864810 [0,0,0,0,0,0|3,0,1]=4 52 B21R3.29689 Cc1ncc(cc1O)SCc2noc3c2cccc3 62a_100009864810_100009813815 [0,0,0,0,0,0|3,0,1]=4 53 B21R3.29689 Cc1ncc(nc1C)SCc2noc3c2cccc3 62a_100009813815_100009878948 [0,0,0,0,0,0|3,0,1]=4 54 B21R3.29689 Cc1ncc(nc1C)SCc2noc3c2cccc3 62a_100009878948_100009813815 [0,0,0,0,0,0|3,0,1]=4 55 B21R3.29689 Cn1cc(ncc1=O)SCc2noc3c2cccc3 62a_100009813815_100009843036 [0,0,0,0,0,0|4,0,0]=4 56 B21R3.29689 Cn1cc(ncc1=O)SCc2noc3c2cccc3 62a_100009843036_100009813815 [0,0,0,0,0,0|4,0,0]=4 57 B21R3.29689 Cn1nc(ccc1=O)SCc2noc3c2cccc3 62a_100009813815_100009820752 [0,0,0,0,0,0|4,0,0]=4 58 B21R3.29689 Cn1nc(ccc1=O)SCc2noc3c2cccc3 62a_100009820752_100009813815 [0,0,0,0,0,0|4,0,0]=4 59 B21R3.29689 Fc1nc(ccc1Br)SCc2noc3c2cccc3 62a_100009813815_100010134343 [0,0,0,0,0,0|4,0,0]=4 60 B21R3.29689 Fc1nc(ccc1Br)SCc2noc3c2cccc3 62a_100010134343_100009813815 [0,0,0,0,0,0|4,0,0]=4 61 B21R3.29689 Nc1cc(n[nH]c1=O)SCc2csc3c2cccc3 62a_200000742921_100000102183 [0,0,0,0,0,0|3,1,0]=4 62 B21R3.29689 Nc1cc(n[nH]c1=O)SCc2nnc3n2cccc3 62a_100000037651_100000102183 [0,0,0,0,0,0|4,0,0]=4 63 B21R3.29689 Nc1cc(n[nH]c1=O)SCc2noc3c2cccc3 62a_100009813815_100000102183 [0,0,0,0,0,0|2,0,0]=2 64 B21R3.29689 Nc1cc(ncc1F)SCc2noc3c2cccc3 62a_100000126464_100009813815 [0,0,0,0,0,0|4,0,0]=4 65 B21R3.29689 Nc1cc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100000126464 [0,0,0,0,0,0|4,0,0]=4 66 B21R3.29689 Nc1cc(ncc1O)SCc2noc3c2cccc3 62a_100009813815_100009819941 [0,0,0,0,0,0|3,0,1]=4 67 B21R3.29689 Nc1cc(ncc1O)SCc2noc3c2cccc3 62a_100009819941_100009813815 [0,0,0,0,0,0|3,0,1]=4 68 B21R3.29689 Nc1ccc(cc1O)SCc2noc3c2cccc3 62a_100000739049_100009813815 [0,0,0,0,0,0|4,0,0]=4 69 B21R3.29689 Nc1ccc(cc1O)SCc2noc3c2cccc3 62a_100009813815_100000739049 [0,0,0,0,0,0|4,0,0]=4 70 B21R3.29689 Nc1ccc(nc1Cl)SCc2noc3c2cccc3 62a_100009813815_200010233646 [0,0,0,0,0,0|4,0,0]=4 71 B21R3.29689 Nc1ccc(nc1Cl)SCc2noc3c2cccc3 62a_200010233646_100009813815 [0,0,0,0,0,0|4,0,0]=4 72 B21R3.29689 Nc1ccc(nc1F)SCc2noc3c2cccc3 62a_100009813815_100009856439 [0,0,0,0,0,0|4,0,0]=4 73 B21R3.29689 Nc1ccc(nc1F)SCc2noc3c2cccc3 62a_100009856439_100009813815 [0,0,0,0,0,0|4,0,0]=4 74 B21R3.29689 Nc1ccc(nc1N)SCc2noc3c2cccc3 62a_100000747239_100009813815 [0,0,0,0,0,0|4,0,0]=4 75 B21R3.29689 Nc1ccc(nc1O)SCc2noc3c2cccc3 62a_100000718904_100009813815 [0,0,0,0,0,0|3,0,0]=3 76 B21R3.29689 Nc1cnc(cc1N)SCc2noc3c2cccc3 62a_100000067514_100009813815 [0,0,0,0,0,0|4,0,0]=4 77 B21R3.29689 Nc1cnc(cc1N)SCc2noc3c2cccc3 62a_100009813815_100000067514 [0,0,0,0,0,0|4,0,0]=4 78 B21R3.29689 Nc1cnc(nc1N)SCc2noc3c2cccc3 62a_100009813815_100011933915 [0,0,0,0,0,0|3,0,0]=3 79 B21R3.29689 Nc1cnc(nc1N)SCc2noc3c2cccc3 62a_100011933915_100009813815 [0,0,0,0,0,0|3,0,0]=3 80 B21R3.29689 Nc1nc(ccc1F)SCc2noc3c2cccc3 62a_100009813815_100016091773 [0,0,0,0,0,0|4,0,0]=4 81 B21R3.29689 Nc1nc(ccc1F)SCc2noc3c2cccc3 62a_100016091773_100009813815 [0,0,0,0,0,0|4,0,0]=4 82 B21R3.29689 Nc1nc(ccc1O)SCc2noc3c2cccc3 62a_100000685527_100009813815 [0,0,0,0,0,0|3,0,1]=4 83 B21R3.29689 Nc1nc(ccc1O)SCc2noc3c2cccc3 62a_100009813815_100000685527 [0,0,0,0,0,0|3,0,1]=4 84 B21R3.29689 Nc1nc(ncc1F)SCc2noc3c2cccc3 62a_100000185498_100009813815 [0,0,0,0,0,0|3,0,0]=3 85 B21R3.29689 Nc1nc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100000185498 [0,0,0,0,0,0|3,0,0]=3 86 B21R3.29689 Nc1ncc(cc1O)SCc2noc3c2cccc3 62a_100009813815_100009819042 [0,0,0,0,0,0|3,0,1]=4 87 B21R3.29689 Nc1ncc(cc1O)SCc2noc3c2cccc3 62a_100009819042_100009813815 [0,0,0,0,0,0|3,0,1]=4 88 B21R3.29689 Nc1ncc(nc1Br)SCc2noc3c2cccc3 62a_100009813815_100010982571 [0,0,0,0,0,0|3,0,1]=4 89 B21R3.29689 Nc1ncc(nc1Br)SCc2noc3c2cccc3 62a_100010982571_100009813815 [0,0,0,0,0,0|3,0,1]=4 90 B21R3.29689 Nc1ncc(nc1Cl)SCc2noc3c2cccc3 62a_100009813815_100010733632 [0,0,0,0,0,0|3,0,1]=4 91 B21R3.29689 Nc1ncc(nc1Cl)SCc2noc3c2cccc3 62a_100010733632_100009813815 [0,0,0,0,0,0|3,0,1]=4 92 B21R3.29689 Nc1ncc(nc1N)SCc2noc3c2cccc3 62a_100009813815_100009816827 [0,0,0,0,0,0|3,0,1]=4 93 B21R3.29689 Nc1ncc(nc1N)SCc2noc3c2cccc3 62a_100009816827_100009813815 [0,0,0,0,0,0|3,0,1]=4 94 B21R3.29689 O=c1[nH]cc(cc1Br)SCc2noc3c2cccc3 62a_100009813815_100010125443 [0,0,0,0,0,0|3,0,0]=3 95 B21R3.29689 O=c1[nH]cc(cc1Br)SCc2noc3c2cccc3 62a_100010125443_100009813815 [0,0,0,0,0,0|3,0,0]=3 96 B21R3.29689 O=c1[nH]cc(cc1F)SCc2noc3c2cccc3 62a_100000723523_100009813815 [0,0,0,0,0,0|3,0,0]=3 97 B21R3.29689 O=c1[nH]cc(cc1F)SCc2noc3c2cccc3 62a_100009813815_100000723523 [0,0,0,0,0,0|3,0,0]=3 98 B21R3.29689 O=c1[nH]cc(cc1O)SCc2csc3c2cccc3 62a_200000742921_100009814561 [0,0,0,0,0,0|3,1,0]=4 99 B21R3.29689 O=c1[nH]cc(cc1O)SCc2nnc3n2cccc3 62a_100000037651_100009814561 [0,0,0,0,0,0|4,0,0]=4 100 B21R3.29689 O=c1[nH]cc(cc1O)SCc2noc3c2cccc3 62a_100009813815_100009814561 [0,0,0,0,0,0|2,0,0]=2 101 B21R3.29689 Oc1cc(ccc1Br)SCc2noc3c2cccc3 62a_100009813815_100012356990 [0,0,0,0,0,0|4,0,0]=4 102 B21R3.29689 Oc1cc(ccc1Br)SCc2noc3c2cccc3 62a_100012356990_100009813815 [0,0,0,0,0,0|4,0,0]=4 103 B21R3.29689 Oc1cc(ccc1Cl)SCc2noc3c2cccc3 62a_100009813815_100011356854 [0,0,0,0,0,0|4,0,0]=4 104 B21R3.29689 Oc1cc(ccc1Cl)SCc2noc3c2cccc3 62a_100011356854_100009813815 [0,0,0,0,0,0|4,0,0]=4 105 B21R3.29689 Oc1cc(ccc1F)SCc2noc3c2cccc3 62a_100000686035_100009813815 [0,0,0,0,0,0|4,0,0]=4 106 B21R3.29689 Oc1cc(ccc1F)SCc2noc3c2cccc3 62a_100009813815_100000686035 [0,0,0,0,0,0|4,0,0]=4 107 B21R3.29689 Oc1cc(cnc1F)SCc2noc3c2cccc3 62a_100009813815_100009819871 [0,0,0,0,0,0|3,0,1]=4 108 B21R3.29689 Oc1cc(cnc1F)SCc2noc3c2cccc3 62a_100009819871_100009813815 [0,0,0,0,0,0|3,0,1]=4 109 B21R3.29689 Oc1cc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100009854642 [0,0,0,0,0,0|3,0,0]=3 110 B21R3.29689 Oc1cc(ncc1F)SCc2noc3c2cccc3 62a_100009854642_100009813815 [0,0,0,0,0,0|3,0,0]=3 111 B21R3.29689 Oc1ccc(cc1O)SCc2noc3c2cccc3 62a_100009813815_100009813601 [0,0,0,0,0,0|3,0,1]=4 112 B21R3.29689 Oc1ccc(nc1Br)SCc2noc3c2cccc3 62a_100000725334_100009813815 [0,0,0,0,0,0|3,0,1]=4 113 B21R3.29689 Oc1ccc(nc1Br)SCc2noc3c2cccc3 62a_100009813815_100000725334 [0,0,0,0,0,0|3,0,1]=4 114 B21R3.29689 Oc1ccc(nc1Cl)SCc2noc3c2cccc3 62a_100009813815_100000721234 [0,0,0,0,0,0|3,0,1]=4 115 B21R3.29689 Oc1ccc(nc1F)SCc2noc3c2cccc3 62a_100009813815_100009819667 [0,0,0,0,0,0|3,0,1]=4 116 B21R3.29689 Oc1ccc(nc1F)SCc2noc3c2cccc3 62a_100009819667_100009813815 [0,0,0,0,0,0|3,0,1]=4 117 B21R3.29689 Oc1nc(ccc1F)SCc2noc3c2cccc3 62a_100009813815_100010729010 [0,0,0,0,0,0|3,0,0]=3 118 B21R3.29689 Oc1nc(ncc1F)SCc2csc3c2cccc3 62a_200000742921_100011995740 [0,0,0,0,0,0|3,1,0]=4 119 B21R3.29689 Oc1nc(ncc1F)SCc2nnc3n2cccc3 62a_100000037651_100011995740 [0,0,0,0,0,0|4,0,0]=4 120 B21R3.29689 Oc1nc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100011995740 [0,0,0,0,0,0|2,0,0]=2 121 B20R3.644 Brc1ccc(nc1)SCc2noc3c2cccc3 62a_100000686858_100009813815 [1,0,0,0,0,0|3,0,0]=4 122 B20R3.644 Brc1ccc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000686858 [1,0,0,0,0,0|3,0,0]=4 123 B20R3.644 Brc1cnc(cn1)SCc2noc3c2cccc3 62a_100009813815_100010187541 [1,0,0,0,0,0|2,0,1]=4 124 B20R3.644 Brc1cnc(cn1)SCc2noc3c2cccc3 62a_100010187541_100009813815 [1,0,0,0,0,0|2,0,1]=4 125 B20R3.644 Brc1cnc(nc1)SCc2noc3c2cccc3 62a_100000690281_100009813815 [1,0,0,0,0,0|2,0,0]=3 126 B20R3.644 Brc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000690281 [1,0,0,0,0,0|2,0,0]=3 127 B20R3.644 Cc1ccc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000754016 [1,0,0,0,0,0|3,0,0]=4 128 B20R3.644 Cc1ccc(nc1)SCc2noc3c2cccc3 62a_100011192072_100009813815 [1,0,0,0,0,0|3,0,0]=4 129 B20R3.644 Cc1ccc(nn1)SCc2noc3c2cccc3 62a_100000744512_100009813815 [1,0,0,0,0,0|2,0,1]=4 130 B20R3.644 Cc1ccc(nn1)SCc2noc3c2cccc3 62a_100009813815_100000744512 [1,0,0,0,0,0|2,0,1]=4 131 B20R3.644 Cc1cnc(cn1)SCc2noc3c2cccc3 62a_100009813815_100011999403 [1,0,0,0,0,0|2,0,1]=4 132 B20R3.644 Cc1cnc(cn1)SCc2noc3c2cccc3 62a_100011999403_100009813815 [1,0,0,0,0,0|2,0,1]=4 133 B20R3.644 Cc1cnc(nc1)SCc2noc3c2cccc3 62a_100000061069_100009813815 [1,0,0,0,0,0|2,0,0]=3 134 B20R3.644 Cc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000061069 [1,0,0,0,0,0|2,0,0]=3 135 B20R3.644 Clc1ccc(nc1)SCc2noc3c2cccc3 62a_100009813815_100011356976 [1,0,0,0,0,0|3,0,0]=4 136 B20R3.644 Clc1ccc(nc1)SCc2noc3c2cccc3 62a_100011356976_100009813815 [1,0,0,0,0,0|3,0,0]=4 137 B20R3.644 Clc1ccc(nn1)SCc2noc3c2cccc3 62a_100000068654_100009813815 [1,0,0,0,0,0|2,0,1]=4 138 B20R3.644 Clc1ccc(nn1)SCc2noc3c2cccc3 62a_100009813815_100000068654 [1,0,0,0,0,0|2,0,1]=4 139 B20R3.644 Clc1cnc(cn1)SCc2noc3c2cccc3 62a_100009813815_100010214907 [1,0,0,0,0,0|2,0,1]=4 140 B20R3.644 Clc1cnc(cn1)SCc2noc3c2cccc3 62a_100010214907_100009813815 [1,0,0,0,0,0|2,0,1]=4 141 B20R3.644 Clc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100011356929 [1,0,0,0,0,0|2,0,0]=3 142 B20R3.644 Clc1cnc(nc1)SCc2noc3c2cccc3 62a_100011356929_100009813815 [1,0,0,0,0,0|2,0,0]=3 143 B20R3.644 Fc1ccc(nc1)SCc2noc3c2cccc3 62a_100000744514_100009813815 [1,0,0,0,0,0|3,0,0]=4 144 B20R3.644 Fc1ccc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000744514 [1,0,0,0,0,0|3,0,0]=4 145 B20R3.644 Fc1cnc(cn1)SCc2noc3c2cccc3 62a_100009813815_100009856528 [1,0,0,0,0,0|2,0,1]=4 146 B20R3.644 Fc1cnc(cn1)SCc2noc3c2cccc3 62a_100009856528_100009813815 [1,0,0,0,0,0|2,0,1]=4 147 B20R3.644 Fc1cnc(nc1)OCc2noc3c2cccc3 34a_100011934040_100009813815 [1,0,0,0,0,0|2,1,0]=4 148 B20R3.644 Fc1cnc(nc1)SCc2noc3c2cccc3 62a_100000685220_100009813815 [1,0,0,0,0,0|2,0,0]=3 149 B20R3.644 Fc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000685220 [1,0,0,0,0,0|2,0,0]=3 150 B20R3.644 Nc1ccc(nc1)SCc2noc3c2cccc3 62a_100000737798_100009813815 [1,0,0,0,0,0|3,0,0]=4 151 B20R3.644 Nc1ccc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000737798 [1,0,0,0,0,0|3,0,0]=4 152 B20R3.644 Nc1ccc(nn1)SCc2noc3c2cccc3 62a_100009813815_100010219413 [1,0,0,0,0,0|2,0,1]=4 153 B20R3.644 Nc1ccc(nn1)SCc2noc3c2cccc3 62a_100010219413_100009813815 [1,0,0,0,0,0|2,0,1]=4 154 B20R3.644 Nc1cnc(cn1)SCc2noc3c2cccc3 62a_100000744751_100009813815 [1,0,0,0,0,0|2,0,1]=4 155 B20R3.644 Nc1cnc(cn1)SCc2noc3c2cccc3 62a_100009813815_100000744751 [1,0,0,0,0,0|2,0,1]=4 156 B20R3.644 Nc1cnc(nc1)SCc2noc3c2cccc3 62a_100000068403_100009813815 [1,0,0,0,0,0|2,0,0]=3 157 B20R3.644 Nc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000068403 [1,0,0,0,0,0|2,0,0]=3 158 B20R3.644 O=c1ccc(c[nH]1)OCc2noc3c2cccc3 34a_100000075641_100009813815 [1,0,0,0,0,0|2,1,0]=4 159 B20R3.644 O=c1ccc(c[nH]1)SCc2noc3c2cccc3 62a_100000212171_100009813815 [1,0,0,0,0,0|2,0,0]=3 160 B20R3.644 O=c1ccc(c[nH]1)SCc2noc3c2cccc3 62a_100009813815_100000212171 [1,0,0,0,0,0|2,0,0]=3 161 B20R3.644 O=c1ccc(n[nH]1)SCc2csc3c2cccc3 62a_100009820020_200000742921 [1,0,0,0,0,0|2,1,0]=4 162 B20R3.644 O=c1ccc(n[nH]1)SCc2csc3c2cccc3 62a_200000742921_100009820020 [1,0,0,0,0,0|2,1,0]=4 163 B20R3.644 O=c1ccc(n[nH]1)SCc2nnc3n2cccc3 62a_100000037651_100009820020 [1,0,0,0,0,0|3,0,0]=4 164 B20R3.644 O=c1ccc(n[nH]1)SCc2nnc3n2cccc3 62a_100009820020_100000037651 [1,0,0,0,0,0|3,0,0]=4 165 B20R3.644 O=c1ccc(n[nH]1)SCc2noc3c2cccc3 62a_100009813815_100009820020 [1,0,0,0,0,0|1,0,0]=2 166 B20R3.644 O=c1ccc(n[nH]1)SCc2noc3c2cccc3 62a_100009820020_100009813815 [1,0,0,0,0,0|1,0,0]=2 167 B20R3.644 O=c1ccc(n[nH]1)SCn2nnc3c2cccc3 62a_100009820020_100000033166 [1,0,0,0,0,0|3,0,0]=4 168 B20R3.644 O=c1ncc(c[nH]1)SCc2noc3c2cccc3 62a_100009813815_102495366499 [1,0,0,0,0,0|3,0,0]=4 169 B20R3.644 O=c1ncc(c[nH]1)SCc2noc3c2cccc3 62a_102495366499_100009813815 [1,0,0,0,0,0|3,0,0]=4 170 B20R3.644 Oc1ccc(nc1)SCc2noc3c2cccc3 62a_100000685995_100009813815 [1,0,0,0,0,0|2,0,1]=4 171 B20R3.644 Oc1ccc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000744096 [1,0,0,0,0,0|2,0,1]=4 172 B20R3.644 Oc1cnc(cn1)SCc2noc3c2cccc3 62a_100009813815_100015839800 [1,0,0,0,0,0|1,0,2]=4 173 B20R3.644 Oc1cnc(cn1)SCc2noc3c2cccc3 62a_100011934580_100009813815 [1,0,0,0,0,0|1,0,2]=4 174 B20R3.644 Oc1cnc(nc1)SCc2noc3c2cccc3 62a_100000730009_100009813815 [1,0,0,0,0,0|1,0,1]=3 175 B20R3.644 Oc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000092845 [1,0,0,0,0,0|1,0,1]=3 176 B20R3.14372 Brc1cccc(n1)SCc2noc3c2cccc3 62a_100000684672_100009813815 [1,0,0,0,0,0|3,0,0]=4 177 B20R3.14372 Brc1cccc(n1)SCc2noc3c2cccc3 62a_100009813815_100000684672 [1,0,0,0,0,0|3,0,0]=4 178 B20R3.14372 Cc1cccc(n1)SCc2noc3c2cccc3 62a_100000742759_100009813815 [1,0,0,0,0,0|3,0,0]=4 179 B20R3.14372 Cc1cccc(n1)SCc2noc3c2cccc3 62a_100009813815_100000742759 [1,0,0,0,0,0|3,0,0]=4 180 B20R3.14372 Cc1ccnc(c1)SCc2noc3c2cccc3 62a_100000750283_100009813815 [1,0,0,0,0,0|3,0,0]=4 181 B20R3.14372 Cc1ccnc(c1)SCc2noc3c2cccc3 62a_100009813815_100000750283 [1,0,0,0,0,0|3,0,0]=4 182 B20R3.14372 Cc1ccnc(n1)SCc2noc3c2cccc3 62a_100009813815_100011243806 [1,0,0,0,0,0|2,0,0]=3 183 B20R3.14372 Cc1ccnc(n1)SCc2noc3c2cccc3 62a_100011243806_100009813815 [1,0,0,0,0,0|2,0,0]=3 184 B20R3.14372 Cc1cncc(n1)SCc2noc3c2cccc3 62a_100000754123_100009813815 [1,0,0,0,0,0|2,0,1]=4 185 B20R3.14372 Cc1cncc(n1)SCc2noc3c2cccc3 62a_100009813815_100000754123 [1,0,0,0,0,0|2,0,1]=4 186 B20R3.14372 Cc1cnnc(c1)SCc2noc3c2cccc3 62a_100000070100_100009813815 [1,0,0,0,0,0|2,0,1]=4 187 B20R3.14372 Cc1cnnc(c1)SCc2noc3c2cccc3 62a_100009813815_100000070100 [1,0,0,0,0,0|2,0,1]=4 188 B20R3.14372 Clc1cccc(n1)SCc2noc3c2cccc3 62a_100000051397_100009813815 [1,0,0,0,0,0|3,0,0]=4 189 B20R3.14372 Clc1cccc(n1)SCc2noc3c2cccc3 62a_100009813815_100000051397 [1,0,0,0,0,0|3,0,0]=4 190 B20R3.14372 Clc1ccnc(c1)SCc2noc3c2cccc3 62a_100009813815_100010167805 [1,0,0,0,0,0|3,0,0]=4 191 B20R3.14372 Clc1ccnc(c1)SCc2noc3c2cccc3 62a_100010167805_100009813815 [1,0,0,0,0,0|3,0,0]=4 192 B20R3.14372 Clc1cncc(n1)SCc2noc3c2cccc3 62a_100009813815_100010892449 [1,0,0,0,0,0|2,0,1]=4 193 B20R3.14372 Clc1cncc(n1)SCc2noc3c2cccc3 62a_100010892449_100009813815 [1,0,0,0,0,0|2,0,1]=4 194 B20R3.14372 Fc1cccc(n1)SCc2noc3c2cccc3 62a_100009813815_100009815982 [1,0,0,0,0,0|3,0,0]=4 195 B20R3.14372 Fc1cccc(n1)SCc2noc3c2cccc3 62a_100009815982_100009813815 [1,0,0,0,0,0|3,0,0]=4 196 B20R3.14372 Fc1ccnc(c1)SCc2noc3c2cccc3 62a_100000764206_100009813815 [1,0,0,0,0,0|3,0,0]=4 197 B20R3.14372 Fc1ccnc(c1)SCc2noc3c2cccc3 62a_100009813815_100000764206 [1,0,0,0,0,0|3,0,0]=4 198 B20R3.14372 Fc1cncc(n1)SCc2noc3c2cccc3 62a_100009813815_200009863489 [1,0,0,0,0,0|2,0,1]=4 199 B20R3.14372 Fc1cncc(n1)SCc2noc3c2cccc3 62a_200009863489_100009813815 [1,0,0,0,0,0|2,0,1]=4 200 B20R3.14372 Nc1cccc(n1)SCc2noc3c2cccc3 62a_100000740741_100009813815 [1,0,0,0,0,0|3,0,0]=4 201 B20R3.14372 Nc1cccc(n1)SCc2noc3c2cccc3 62a_100009813815_100000740741 [1,0,0,0,0,0|3,0,0]=4 202 B20R3.14372 Nc1ccnc(c1)SCc2noc3c2cccc3 62a_100009813815_100009814236 [1,0,0,0,0,0|3,0,0]=4 203 B20R3.14372 Nc1ccnc(c1)SCc2noc3c2cccc3 62a_100009814236_100009813815 [1,0,0,0,0,0|3,0,0]=4 204 B20R3.14372 Nc1ccnc(n1)SCc2noc3c2cccc3 62a_100000757536_100009813815 [1,0,0,0,0,0|2,0,0]=3 205 B20R3.14372 Nc1ccnc(n1)SCc2noc3c2cccc3 62a_100009813815_100000757536 [1,0,0,0,0,0|2,0,0]=3 206 B20R3.14372 Nc1cncc(n1)SCc2noc3c2cccc3 62a_100000747728_100009813815 [1,0,0,0,0,0|2,0,1]=4 207 B20R3.14372 Nc1cncc(n1)SCc2noc3c2cccc3 62a_100009813815_100000747728 [1,0,0,0,0,0|2,0,1]=4 208 B20R3.14372 Nc1cnnc(c1)SCc2noc3c2cccc3 62a_100009813815_100011996757 [1,0,0,0,0,0|2,0,1]=4 209 B20R3.14372 Nc1cnnc(c1)SCc2noc3c2cccc3 62a_100011996757_100009813815 [1,0,0,0,0,0|2,0,1]=4 210 B20R3.14372 Nc1ncnc(n1)SCc2noc3c2cccc3 62a_100000123831_100009813815 [1,0,0,0,0,0|3,0,0]=4 211 B20R3.14372 Nc1ncnc(n1)SCc2noc3c2cccc3 62a_100009813815_100000123831 [1,0,0,0,0,0|3,0,0]=4 212 B20R3.14372 Oc1cc(ncn1)SCc2noc3c2cccc3 62a_100009813815_100000765262 [1,0,0,0,0,0|3,0,0]=4 213 B20R3.14372 Oc1cccc(c1)SCc2noc3c2cccc3 62a_100009813815_100000211634 [1,0,0,0,0,0|3,0,0]=4 214 B20R3.14372 Oc1ccnc(c1)SCc2noc3c2cccc3 62a_100009813815_100000762945 [1,0,0,0,0,0|2,0,0]=3 215 B20R3.14372 Oc1ccnc(n1)SCc2csc3c2cccc3 62a_200000742921_100011649813 [1,0,0,0,0,0|2,1,0]=4 216 B20R3.14372 Oc1ccnc(n1)SCc2nnc3n2cccc3 62a_100000037651_100011649813 [1,0,0,0,0,0|3,0,0]=4 217 B20R3.14372 Oc1ccnc(n1)SCc2noc3c2cccc3 62a_100009813815_100011649813 [1,0,0,0,0,0|1,0,0]=2 218 B20R3.14372 Oc1cncc(c1)SCc2noc3c2cccc3 62a_100000754920_100009813815 [1,0,0,0,0,0|2,0,1]=4 219 B20R3.14372 Oc1cncc(c1)SCc2noc3c2cccc3 62a_100009813815_100000754920 [1,0,0,0,0,0|2,0,1]=4 220 B20R3.14372 Oc1cncc(n1)SCc2noc3c2cccc3 62a_100009813815_100011269956 [1,0,0,0,0,0|1,0,1]=3 221 B20R3.14372 Oc1cnnc(c1)SCc2noc3c2cccc3 62a_100009813815_200010734679 [1,0,0,0,0,0|1,0,1]=3 222 B22R3.4385 CCc1nc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100009843034 [0,1,0,0,0,0|3,0,0]=4 223 B22R3.4385 CCc1nc(ncc1F)SCc2noc3c2cccc3 62a_100009843034_100009813815 [0,1,0,0,0,0|3,0,0]=4 224 B22R3.4385 CNc1nc(ncc1F)SCc2noc3c2cccc3 62a_100000185923_100009813815 [0,1,0,0,0,0|3,0,0]=4 225 B22R3.4385 CNc1nc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100000185923 [0,1,0,0,0,0|3,0,0]=4 226 B22R3.4385 COc1cc(c[nH]c1=O)SCc2noc3c2cccc3 62a_100009813815_100010125397 [0,1,0,0,0,0|2,0,0]=3 227 B22R3.4385 COc1cc(ncc1C)SCc2noc3c2cccc3 62a_100009813815_100010067687 [0,1,0,0,0,0|3,0,0]=4 228 B22R3.4385 COc1cc(ncc1C)SCc2noc3c2cccc3 62a_100010067687_100009813815 [0,1,0,0,0,0|3,0,0]=4 229 B22R3.4385 COc1cc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_200010136270 [0,1,0,0,0,0|3,0,0]=4 230 B22R3.4385 COc1cc(ncc1F)SCc2noc3c2cccc3 62a_200010136270_100009813815 [0,1,0,0,0,0|3,0,0]=4 231 B22R3.4385 COc1cc(ncc1N)SCc2noc3c2cccc3 62a_100009813815_100009887741 [0,1,0,0,0,0|3,0,0]=4 232 B22R3.4385 COc1cc(ncc1N)SCc2noc3c2cccc3 62a_100009887741_100009813815 [0,1,0,0,0,0|3,0,0]=4 233 B22R3.4385 COc1cc(nnc1N)SCc2noc3c2cccc3 62a_100000688033_100009813815 [0,1,0,0,0,0|2,0,1]=4 234 B22R3.4385 COc1cc(nnc1N)SCc2noc3c2cccc3 62a_100009813815_100000688033 [0,1,0,0,0,0|2,0,1]=4 235 B22R3.4385 COc1nc(ccc1N)SCc2noc3c2cccc3 62a_100000687816_100009813815 [0,1,0,0,0,0|3,0,0]=4 236 B22R3.4385 COc1nc(ccc1N)SCc2noc3c2cccc3 62a_100009813815_100000687816 [0,1,0,0,0,0|3,0,0]=4 237 B22R3.4385 COc1nc(ccc1O)SCc2noc3c2cccc3 62a_100009813815_100010893133 [0,1,0,0,0,0|2,0,1]=4 238 B22R3.4385 COc1nc(cnc1N)SCc2noc3c2cccc3 62a_100009813815_100009816943 [0,1,0,0,0,0|2,0,1]=4 239 B22R3.4385 COc1nc(cnc1N)SCc2noc3c2cccc3 62a_100009816943_100009813815 [0,1,0,0,0,0|2,0,1]=4 240 B22R3.4385 COc1nc(cnc1O)SCc2noc3c2cccc3 62a_100009813815_200010365344 [0,1,0,0,0,0|1,0,2]=4 241 B22R3.4385 COc1nc(cnc1O)SCc2noc3c2cccc3 62a_200010365344_100009813815 [0,1,0,0,0,0|1,0,2]=4 242 B22R3.4385 COc1nc(ncc1C)SCc2noc3c2cccc3 62a_100009813815_100012500371 [0,1,0,0,0,0|2,0,0]=3 243 B22R3.4385 COc1nc(ncc1C)SCc2noc3c2cccc3 62a_100012500371_100009813815 [0,1,0,0,0,0|2,0,0]=3 244 B22R3.4385 COc1nc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100012183945 [0,1,0,0,0,0|2,0,0]=3 245 B22R3.4385 COc1nc(ncc1F)SCc2noc3c2cccc3 62a_100012183945_100009813815 [0,1,0,0,0,0|2,0,0]=3 246 B22R3.4385 COc1nc(ncc1N)SCc2noc3c2cccc3 62a_100009813815_100012122185 [0,1,0,0,0,0|2,0,0]=3 247 B22R3.4385 COc1nc(ncc1N)SCc2noc3c2cccc3 62a_100012122185_100009813815 [0,1,0,0,0,0|2,0,0]=3 248 B22R3.4385 CSc1nc(ncc1C)SCc2noc3c2cccc3 62a_100009813815_100012501347 [0,1,0,0,0,0|2,1,0]=4 249 B22R3.4385 CSc1nc(ncc1C)SCc2noc3c2cccc3 62a_100012501347_100009813815 [0,1,0,0,0,0|2,1,0]=4 250 B22R3.4385 CSc1nc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100012187453 [0,1,0,0,0,0|2,1,0]=4 251 B22R3.4385 CSc1nc(ncc1F)SCc2noc3c2cccc3 62a_100012187453_100009813815 [0,1,0,0,0,0|2,1,0]=4 252 B22R3.4385 NNc1nc(ncc1F)SCc2noc3c2cccc3 62a_100000122893_100009813815 [0,1,0,0,0,0|3,0,0]=4 253 B22R3.4385 NNc1nc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100000122893 [0,1,0,0,0,0|3,0,0]=4 254 B22R3.4385 Nc1ncc(nc1CO)SCc2noc3c2cccc3 62a_100009813815_100010174834 [0,1,0,0,0,0|2,0,1]=4 255 B22R3.4385 Nc1ncc(nc1CO)SCc2noc3c2cccc3 62a_100010174834_100009813815 [0,1,0,0,0,0|2,0,1]=4 256 B22R3.4385 OCc1cc(ncc1F)SCc2noc3c2cccc3 62a_100000081974_100009813815 [0,1,0,0,0,0|3,0,0]=4 257 B22R3.4385 OCc1cc(ncc1F)SCc2noc3c2cccc3 62a_100009813815_100000081974 [0,1,0,0,0,0|3,0,0]=4 258 B22R3.118067 COc1cnc(cc1O)SCc2noc3c2cccc3 62a_100009813815_100010264082 [0,1,0,0,0,0|2,0,1]=4 259 B22R3.118067 COc1cnc(nc1C)SCc2noc3c2cccc3 62a_100009813815_100010382893 [0,1,0,0,0,0|2,0,1]=4 260 B22R3.118067 COc1cnc(nc1C)SCc2noc3c2cccc3 62a_100010382893_100009813815 [0,1,0,0,0,0|2,0,1]=4 261 B22R3.118067 COc1cnc(nc1N)SCc2noc3c2cccc3 62a_100009813815_100009886850 [0,1,0,0,0,0|2,0,1]=4 262 B22R3.118067 COc1cnc(nc1N)SCc2noc3c2cccc3 62a_100009886850_100009813815 [0,1,0,0,0,0|2,0,1]=4 263 B22R3.118067 Cc1cc(ncc1C=O)SCc2noc3c2cccc3 62a_100000085382_100009813815 [0,1,0,0,0,0|3,0,0]=4 264 B22R3.118067 Cc1cc(ncc1C=O)SCc2noc3c2cccc3 62a_100009813815_100000085382 [0,1,0,0,0,0|3,0,0]=4 265 B22R3.118067 Cc1nc(ccc1C=O)SCc2noc3c2cccc3 62a_100000050599_100009813815 [0,1,0,0,0,0|3,0,0]=4 266 B22R3.118067 Cc1nc(ccc1C=O)SCc2noc3c2cccc3 62a_100009813815_100000050599 [0,1,0,0,0,0|3,0,0]=4 267 B22R3.118067 N#Cc1cnc(nc1N)SCc2noc3c2cccc3 62a_100009813519_100009813815 [0,1,0,0,0,0|3,0,0]=4 268 B22R3.118067 N#Cc1cnc(nc1N)SCc2noc3c2cccc3 62a_100009813815_100000041447 [0,1,0,0,0,0|3,0,0]=4 269 B22R3.118067 Nc1cc(ncc1C=O)SCc2noc3c2cccc3 62a_100000050503_100009813815 [0,1,0,0,0,0|3,0,0]=4 270 B22R3.118067 Nc1cc(ncc1C=O)SCc2noc3c2cccc3 62a_100009813815_100000050503 [0,1,0,0,0,0|3,0,0]=4 271 B22R3.118067 Nc1nc(ncc1C=O)SCc2noc3c2cccc3 62a_100009813815_100010726233 [0,1,0,0,0,0|2,0,0]=3 272 B22R3.118067 Nc1nc(ncc1C=O)SCc2noc3c2cccc3 62a_100010726233_100009813815 [0,1,0,0,0,0|2,0,0]=3 273 B22R3.118067 Nc1nc(ncc1CO)SCc2noc3c2cccc3 62a_100009813815_200009965464 [0,1,0,0,0,0|2,0,1]=4 274 B22R3.118067 Nc1nc(ncc1CO)SCc2noc3c2cccc3 62a_200009965464_100009813815 [0,1,0,0,0,0|2,0,1]=4 275 B22R3.118067 O=Cc1ccc(cc1O)SCc2noc3c2cccc3 62a_100009813815_100011277552 [0,1,0,0,0,0|3,0,0]=4 276 B22R3.118067 O=Cc1ccc(cc1O)SCc2noc3c2cccc3 62a_100011277552_100009813815 [0,1,0,0,0,0|3,0,0]=4 277 B22R3.118067 O=Cc1ccc(nc1F)SCc2noc3c2cccc3 62a_100009813815_100010064369 [0,1,0,0,0,0|3,0,0]=4 278 B22R3.118067 O=Cc1ccc(nc1F)SCc2noc3c2cccc3 62a_100010064369_100009813815 [0,1,0,0,0,0|3,0,0]=4 279 B22R3.716910 Cc1[nH]c(=O)c(cc1SCc2noc3c2cccc3)N 62a_100009813815_100010126670 [0,1,0,0,0,0|3,0,0]=4 280 B22R3.716910 Cc1[nH]c(=O)c(cc1SCc2noc3c2cccc3)N 62a_100010126670_100009813815 [0,1,0,0,0,0|3,0,0]=4 281 B22R3.718409 Cc1c(c[nH]c(=O)c1N)SCc2noc3c2cccc3 62a_100009813815_100010163742 [0,1,0,0,0,0|3,0,0]=4 282 B22R3.718409 Cc1c(c[nH]c(=O)c1N)SCc2noc3c2cccc3 62a_100010163742_100009813815 [0,1,0,0,0,0|3,0,0]=4 283 B22R3.10166189 Cc1cc(cn(c1=O)C)SCc2noc3c2cccc3 62a_100009813815_100011830242 [0,1,0,0,0,0|3,0,0]=4 284 B22R3.10166189 Cc1cc(cn(c1=O)C)SCc2noc3c2cccc3 62a_100011830242_100009813815 [0,1,0,0,0,0|3,0,0]=4 285 B22R3.10166189 Cc1cc(nn(c1=O)C)SCc2noc3c2cccc3 62a_100009813815_100010988966 [0,1,0,0,0,0|2,0,0]=3 286 B22R3.10166189 Cc1cc(nn(c1=O)C)SCc2noc3c2cccc3 62a_100010988966_100009813815 [0,1,0,0,0,0|2,0,0]=3 287 B22R3.10166189 Cc1nc(nc(c1N)N)SCc2noc3c2cccc3 62a_100009813815_100011218874 [0,1,0,0,0,0|3,0,0]=4 288 B22R3.10166189 Cc1nc(nc(c1N)N)SCc2noc3c2cccc3 62a_100011218874_100009813815 [0,1,0,0,0,0|3,0,0]=4 289 B22R3.10166189 Cn1cc(cc(c1=O)F)SCc2noc3c2cccc3 62a_100009813815_100010749421 [0,1,0,0,0,0|3,0,0]=4 290 B22R3.10166189 Cn1cc(cc(c1=O)F)SCc2noc3c2cccc3 62a_100010749421_100009813815 [0,1,0,0,0,0|3,0,0]=4 291 B22R3.10166189 Cn1cc(cc(c1=O)N)SCc2noc3c2cccc3 62a_100009813815_106446545582 [0,1,0,0,0,0|3,0,0]=4 292 B22R3.10166189 Cn1cc(cc(c1=O)N)SCc2noc3c2cccc3 62a_106446545582_100009813815 [0,1,0,0,0,0|3,0,0]=4 293 B20R2.96198 Cc1cc(n[nH]c1=O)SCC(=O)c2ccccc2O 62a_100000188908_100012187101 [0,0,1,0,0,0|3,0,0]=4 294 B20R2.96198 Cc1nc(c[nH]c1=O)SCC(=O)c2ccccc2O 62a_100000188908_100010363809 [0,0,1,0,0,0|3,0,0]=4 295 B20R2.96198 Cc1nc(c[nH]c1=O)SCC(=O)c2ccccc2O 62a_100010363809_100000188908 [0,0,1,0,0,0|3,0,0]=4 296 B20R2.96198 Nc1cc(n[nH]c1=O)SCC(=O)c2ccccc2O 62a_100000188908_100000102183 [0,0,1,0,0,0|3,0,0]=4 297 B20R2.96198 O=C(CSc1c[nH]c(=O)c(c1)O)c2ccccc2O 62a_100000188908_100009814561 [0,0,1,0,0,0|3,0,0]=4 298 B20R2.96198 O=C(CSc1ncc(c(n1)O)F)c2ccccc2O 62a_100000188908_100011995740 [0,0,1,0,0,0|3,0,0]=4 299 B20R3.615 Cc1cc(n[nH]c1=O)Sc2noc3c2cccc3 62a_200000703156_100012187101 [0,0,0,0,1,0|2,0,0]=3 300 B20R3.615 Cc1cnc(cc1O)Sc2noc3c2cccc3 62a_100000704368_200000703156 [0,0,0,0,1,0|3,0,0]=4 301 B20R3.615 Cc1cnc(cc1O)Sc2noc3c2cccc3 62a_200000703156_100000704368 [0,0,0,0,1,0|3,0,0]=4 302 B20R3.615 Cc1cnc(nc1N)Sc2noc3c2cccc3 62a_100011996698_200000703156 [0,0,0,0,1,0|3,0,0]=4 303 B20R3.615 Cc1cnc(nc1N)Sc2noc3c2cccc3 62a_200000703156_100011996698 [0,0,0,0,1,0|3,0,0]=4 304 B20R3.615 Cc1nc(c[nH]c1=O)Sc2coc3c2cccc3 62a_100010363809_100009812202 [0,0,0,0,1,0|3,0,0]=4 305 B20R3.615 Cc1nc(c[nH]c1=O)Sc2n[nH]c3c2cccc3 62a_100010363809_100000050141 [0,0,0,0,1,0|3,0,0]=4 306 B20R3.615 Cc1nc(c[nH]c1=O)Sc2noc3c2cccc3 62a_100010363809_200000703156 [0,0,0,0,1,0|2,0,0]=3 307 B20R3.615 Cc1nc(c[nH]c1=O)Sc2noc3c2cccc3 62a_200000703156_100010363809 [0,0,0,0,1,0|2,0,0]=3 308 B20R3.615 Cc1nc(ncc1Cl)Sc2noc3c2cccc3 62a_100010174973_200000703156 [0,0,0,0,1,0|3,0,0]=4 309 B20R3.615 Cc1nc(ncc1Cl)Sc2noc3c2cccc3 62a_200000703156_100010174973 [0,0,0,0,1,0|3,0,0]=4 310 B20R3.615 Cc1nc(ncc1F)Sc2noc3c2cccc3 62a_100015641512_200000703156 [0,0,0,0,1,0|3,0,0]=4 311 B20R3.615 Cc1nc(ncc1F)Sc2noc3c2cccc3 62a_200000703156_100015641512 [0,0,0,0,1,0|3,0,0]=4 312 B20R3.615 Cc1nc(ncc1N)Sc2noc3c2cccc3 62a_100000123670_200000703156 [0,0,0,0,1,0|3,0,0]=4 313 B20R3.615 Cc1nc(ncc1N)Sc2noc3c2cccc3 62a_200000703156_100000123670 [0,0,0,0,1,0|3,0,0]=4 314 B20R3.615 Nc1cc(n[nH]c1=O)Sc2noc3c2cccc3 62a_200000703156_100000102183 [0,0,0,0,1,0|2,0,0]=3 315 B20R3.615 Nc1ccc(nc1O)Sc2noc3c2cccc3 62a_100000718904_200000703156 [0,0,0,0,1,0|3,0,0]=4 316 B20R3.615 Nc1cnc(nc1N)Sc2noc3c2cccc3 62a_100011933915_200000703156 [0,0,0,0,1,0|3,0,0]=4 317 B20R3.615 Nc1cnc(nc1N)Sc2noc3c2cccc3 62a_200000703156_100011933915 [0,0,0,0,1,0|3,0,0]=4 318 B20R3.615 Nc1nc(ncc1F)Sc2noc3c2cccc3 62a_100000185498_200000703156 [0,0,0,0,1,0|3,0,0]=4 319 B20R3.615 Nc1nc(ncc1F)Sc2noc3c2cccc3 62a_200000703156_100000185498 [0,0,0,0,1,0|3,0,0]=4 320 B20R3.615 O=c1[nH]cc(cc1Br)Sc2noc3c2cccc3 62a_100010125443_200000703156 [0,0,0,0,1,0|3,0,0]=4 321 B20R3.615 O=c1[nH]cc(cc1Br)Sc2noc3c2cccc3 62a_200000703156_100010125443 [0,0,0,0,1,0|3,0,0]=4 322 B20R3.615 O=c1[nH]cc(cc1F)Sc2noc3c2cccc3 62a_100000723523_200000703156 [0,0,0,0,1,0|3,0,0]=4 323 B20R3.615 O=c1[nH]cc(cc1F)Sc2noc3c2cccc3 62a_200000703156_100000723523 [0,0,0,0,1,0|3,0,0]=4 324 B20R3.615 O=c1[nH]cc(cc1O)Sc2noc3c2cccc3 62a_200000703156_100009814561 [0,0,0,0,1,0|2,0,0]=3 325 B20R3.615 Oc1cc(ncc1F)Sc2noc3c2cccc3 62a_100009854642_200000703156 [0,0,0,0,1,0|3,0,0]=4 326 B20R3.615 Oc1cc(ncc1F)Sc2noc3c2cccc3 62a_200000703156_100009854642 [0,0,0,0,1,0|3,0,0]=4 327 B20R3.615 Oc1nc(ccc1F)Sc2noc3c2cccc3 62a_200000703156_100010729010 [0,0,0,0,1,0|3,0,0]=4 328 B20R3.615 Oc1nc(ncc1F)Sc2noc3c2cccc3 62a_200000703156_100011995740 [0,0,0,0,1,0|2,0,0]=3 329 B20R3.5376 Cc1nc(sc1C)SCc2noc3c2cccc3 62a_100000765934_100009813815 [0,0,0,0,1,0|3,0,0]=4 330 B20R3.5376 Cc1nc(sc1C)SCc2noc3c2cccc3 62a_100009813815_100000765934 [0,0,0,0,1,0|3,0,0]=4 331 B20R3.5376 Cn1nc(nc1N)SCc2noc3c2cccc3 62a_100009813815_200010296169 [0,0,0,0,1,0|3,0,0]=4 332 B20R3.5376 Cn1nc(nc1N)SCc2noc3c2cccc3 62a_200010296169_100009813815 [0,0,0,0,1,0|3,0,0]=4 333 B20R3.93687 Cc1[nH]nc(c1C)SCc2noc3c2cccc3 62a_100009813815_100015309786 [0,0,0,0,1,0|2,0,0]=3 334 B20R3.93687 Cc1[nH]nc(c1C)SCc2noc3c2cccc3 62a_100015309786_100009813815 [0,0,0,0,1,0|2,0,0]=3 335 B22R3.1075 Cc1cc(n[nH]c1=O)SCc2nccc3c2cccc3 62a_100000033776_100012187101 [0,0,0,0,0,1|3,0,0]=4 336 B22R3.1075 Cc1nc(c[nH]c1=O)SCc2nccc3c2cccc3 62a_100000033776_100010363809 [0,0,0,0,0,1|3,0,0]=4 337 B22R3.1075 Cc1nc(c[nH]c1=O)SCc2nccc3c2cccc3 62a_100010363809_100000033776 [0,0,0,0,0,1|3,0,0]=4 338 B22R3.1075 Nc1cc(n[nH]c1=O)SCc2nccc3c2cccc3 62a_100000033776_100000102183 [0,0,0,0,0,1|3,0,0]=4 339 B22R3.1075 O=c1[nH]cc(cc1O)SCc2nccc3c2cccc3 62a_100000033776_100009814561 [0,0,0,0,0,1|3,0,0]=4 340 B22R3.1075 Oc1nc(ncc1F)SCc2nccc3c2cccc3 62a_100000033776_100011995740 [0,0,0,0,0,1|3,0,0]=4 341 B22R3.1010764 Cc1cc(n[nH]c1=O)SCc2cc3ccccc3cn2 62a_100009869231_100012187101 [0,0,0,0,0,1|3,0,0]=4 342 B22R3.1010764 Cc1cc(n[nH]c1=O)SCc2ncc3ccccc3n2 62a_100009868571_100012187101 [0,0,0,0,0,1|3,0,0]=4 343 B22R3.1010764 Cc1nc(c[nH]c1=O)SCc2cc3ccccc3cn2 62a_100009869231_100010363809 [0,0,0,0,0,1|3,0,0]=4 344 B22R3.1010764 Cc1nc(c[nH]c1=O)SCc2cc3ccccc3cn2 62a_100010363809_100009869231 [0,0,0,0,0,1|3,0,0]=4 345 B22R3.1010764 Cc1nc(c[nH]c1=O)SCc2ncc3ccccc3n2 62a_100009868571_100010363809 [0,0,0,0,0,1|3,0,0]=4 346 B22R3.1010764 Cc1nc(c[nH]c1=O)SCc2ncc3ccccc3n2 62a_100010363809_100009868571 [0,0,0,0,0,1|3,0,0]=4 347 B22R3.1010764 Nc1cc(n[nH]c1=O)SCc2cc3ccccc3cn2 62a_100009869231_100000102183 [0,0,0,0,0,1|3,0,0]=4 348 B22R3.1010764 Nc1cc(n[nH]c1=O)SCc2ncc3ccccc3n2 62a_100009868571_100000102183 [0,0,0,0,0,1|3,0,0]=4 349 B22R3.1010764 O=c1[nH]cc(cc1O)SCc2cc3ccccc3cn2 62a_100009869231_100009814561 [0,0,0,0,0,1|3,0,0]=4 350 B22R3.1010764 O=c1[nH]cc(cc1O)SCc2ncc3ccccc3n2 62a_100009868571_100009814561 [0,0,0,0,0,1|3,0,0]=4 351 B22R3.1010764 Oc1nc(ncc1F)SCc2cc3ccccc3cn2 62a_100009869231_100011995740 [0,0,0,0,0,1|3,0,0]=4 352 B22R3.1010764 Oc1nc(ncc1F)SCc2ncc3ccccc3n2 62a_100009868571_100011995740 [0,0,0,0,0,1|3,0,0]=4 353 B19R2.12083 O=C(CSc1ccc(=O)[nH]n1)c2ccccc2O 62a_100000188908_100009820020 [1,0,1,0,0,0|2,0,0]=4 354 B19R2.12083 O=C(CSc1ccc(=O)[nH]n1)c2ccccc2O 62a_100009820020_100000188908 [1,0,1,0,0,0|2,0,0]=4 355 B19R2.101351 O=C(CSc1nccc(n1)O)c2ccccc2O 62a_100000188908_100011649813 [1,0,1,0,0,0|2,0,0]=4 356 B19R3.2370 c1ccc(nc1)SCc2noc3c2cccc3 62a_100009813815_100011216584 [2,0,0,0,0,0|2,0,0]=4 357 B19R3.2370 c1ccc(nc1)SCc2noc3c2cccc3 62a_100011216584_100009813815 [2,0,0,0,0,0|2,0,0]=4 358 B19R3.2370 c1ccc2c(noc2c1)CSc3cnccn3 62a_100000211759_100009813815 [2,0,0,0,0,0|1,0,1]=4 359 B19R3.2370 c1ccc2c(noc2c1)CSc3cnccn3 62a_100009813815_100000211759 [2,0,0,0,0,0|1,0,1]=4 360 B19R3.2370 c1cnc(nc1)SCc2noc3c2cccc3 62a_100000211032_100009813815 [2,0,0,0,0,0|1,0,0]=3 361 B19R3.2370 c1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000211032 [2,0,0,0,0,0|1,0,0]=3 362 B19R3.2370 c1cnnc(c1)SCc2noc3c2cccc3 62a_100009813815_100016991348 [2,0,0,0,0,0|1,0,1]=4 363 B19R3.2370 c1cnnc(c1)SCc2noc3c2cccc3 62a_100016991348_100009813815 [2,0,0,0,0,0|1,0,1]=4 364 B21R3.263 C=Cc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_200000143982 [1,1,0,0,0,0|2,0,0]=4 365 B21R3.263 C=Cc1cnc(nc1)SCc2noc3c2cccc3 62a_200000143982_100009813815 [1,1,0,0,0,0|2,0,0]=4 366 B21R3.263 CCc1cnc(nc1)SCc2noc3c2cccc3 62a_100000033099_100009813815 [1,1,0,0,0,0|2,0,0]=4 367 B21R3.263 CCc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000033099 [1,1,0,0,0,0|2,0,0]=4 368 B21R3.263 COc1cnc(nc1)SCc2noc3c2cccc3 62a_100000069167_100009813815 [1,1,0,0,0,0|1,0,1]=4 369 B21R3.263 COc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000069167 [1,1,0,0,0,0|1,0,1]=4 370 B21R3.263 CSc1cnc(nc1)SCc2noc3c2cccc3 62a_100000718988_100009813815 [1,1,0,0,0,0|1,1,0]=4 371 B21R3.263 CSc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000718988 [1,1,0,0,0,0|1,1,0]=4 372 B21R3.263 N#Cc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000099682 [1,1,0,0,0,0|2,0,0]=4 373 B21R3.263 O=Cc1ccc(nc1)SCc2noc3c2cccc3 62a_100000766901_100009813815 [1,1,0,0,0,0|2,0,0]=4 374 B21R3.263 O=Cc1ccc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000766901 [1,1,0,0,0,0|2,0,0]=4 375 B21R3.263 O=Cc1ccc(nn1)SCc2noc3c2cccc3 62a_100000044651_100009813815 [1,1,0,0,0,0|1,0,1]=4 376 B21R3.263 O=Cc1ccc(nn1)SCc2noc3c2cccc3 62a_100009813815_100000044651 [1,1,0,0,0,0|1,0,1]=4 377 B21R3.263 O=Cc1cnc(cn1)SCc2noc3c2cccc3 62a_100009813815_100012001714 [1,1,0,0,0,0|1,0,1]=4 378 B21R3.263 O=Cc1cnc(cn1)SCc2noc3c2cccc3 62a_100012001714_100009813815 [1,1,0,0,0,0|1,0,1]=4 379 B21R3.263 O=Cc1cnc(nc1)SCc2noc3c2cccc3 62a_100000070856_100009813815 [1,1,0,0,0,0|1,0,0]=3 380 B21R3.263 O=Cc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100000070856 [1,1,0,0,0,0|1,0,0]=3 381 B21R3.263 OCc1cnc(nc1)SCc2noc3c2cccc3 62a_100009813815_100009855073 [1,1,0,0,0,0|1,0,1]=4 382 B21R3.263 OCc1cnc(nc1)SCc2noc3c2cccc3 62a_100009855073_100009813815 [1,1,0,0,0,0|1,0,1]=4 383 B21R3.8754 Cc1cc(=O)[nH]nc1SCc2noc3c2cccc3 62a_100009813815_100000081757 [1,1,0,0,0,0|1,0,0]=3 384 B21R3.8754 Nc1[nH]c(=O)ccc1SCc2noc3c2cccc3 62a_100009884077_100009813815 [1,1,0,0,0,0|2,0,0]=4 385 B21R3.8754 O=c1[nH]nc(c(=O)[nH]1)SCc2noc3c2cccc3 62a_100009813815_100000181694 [1,1,0,0,0,0|2,0,0]=4 386 B21R3.8754 O=c1cc(c(c[nH]1)SCc2noc3c2cccc3)F 62a_100009813815_100015631685 [1,1,0,0,0,0|2,0,0]=4 387 B21R3.8754 O=c1cc(c(c[nH]1)SCc2noc3c2cccc3)F 62a_100015631685_100009813815 [1,1,0,0,0,0|2,0,0]=4 388 B21R3.7968 Oc1ccnc(c1F)SCc2noc3c2cccc3 62a_100009813815_100009876375 [1,1,0,0,0,0|2,0,0]=4 389 B21R3.7968 Oc1ccnc(c1F)SCc2noc3c2cccc3 62a_100009876375_100009813815 [1,1,0,0,0,0|2,0,0]=4 390 B21R3.39025 CCc1ccnc(n1)SCc2noc3c2cccc3 62a_100000100215_100009813815 [1,1,0,0,0,0|2,0,0]=4 391 B21R3.39025 CCc1ccnc(n1)SCc2noc3c2cccc3 62a_100009813815_100000100215 [1,1,0,0,0,0|2,0,0]=4 392 B21R3.39025 CNc1ccnc(n1)SCc2noc3c2cccc3 62a_100009813815_100011649947 [1,1,0,0,0,0|2,0,0]=4 393 B21R3.39025 CNc1ccnc(n1)SCc2noc3c2cccc3 62a_100011649947_100009813815 [1,1,0,0,0,0|2,0,0]=4 394 B21R3.39025 COc1cccc(n1)SCc2noc3c2cccc3 62a_100000760917_100009813815 [1,1,0,0,0,0|2,0,0]=4 395 B21R3.39025 COc1cccc(n1)SCc2noc3c2cccc3 62a_100009813815_100000760917 [1,1,0,0,0,0|2,0,0]=4 396 B21R3.39025 COc1ccnc(c1)SCc2noc3c2cccc3 62a_100009813815_100011216251 [1,1,0,0,0,0|2,0,0]=4 397 B21R3.39025 COc1ccnc(c1)SCc2noc3c2cccc3 62a_100009817693_100009813815 [1,1,0,0,0,0|2,0,0]=4 398 B21R3.39025 COc1ccnc(n1)SCc2noc3c2cccc3 62a_100000182009_100009813815 [1,1,0,0,0,0|1,0,0]=3 399 B21R3.39025 COc1ccnc(n1)SCc2noc3c2cccc3 62a_100009813815_100000182009 [1,1,0,0,0,0|1,0,0]=3 400 B21R3.39025 COc1cncc(n1)SCc2noc3c2cccc3 62a_100000756030_100009813815 [1,1,0,0,0,0|1,0,1]=4 401 B21R3.39025 COc1cncc(n1)SCc2noc3c2cccc3 62a_100009813815_100000756030 [1,1,0,0,0,0|1,0,1]=4 402 B21R3.39025 COc1cnnc(c1)SCc2noc3c2cccc3 62a_100009813815_100000087634 [1,1,0,0,0,0|1,0,1]=4 403 B21R3.39025 COc1ncnc(n1)SCc2noc3c2cccc3 62a_100009813815_200010750123 [1,1,0,0,0,0|2,0,0]=4 404 B21R3.39025 COc1ncnc(n1)SCc2noc3c2cccc3 62a_200010750123_100009813815 [1,1,0,0,0,0|2,0,0]=4 405 B21R3.39025 CSc1ccnc(n1)SCc2noc3c2cccc3 62a_100009813815_100011650323 [1,1,0,0,0,0|1,1,0]=4 406 B21R3.39025 CSc1ccnc(n1)SCc2noc3c2cccc3 62a_100011650323_100009813815 [1,1,0,0,0,0|1,1,0]=4 407 B21R3.39025 N#Cc1ccnc(n1)SCc2noc3c2cccc3 62a_100009813815_100000066186 [1,1,0,0,0,0|2,0,0]=4 408 B21R3.39025 OCc1cccc(n1)SCc2noc3c2cccc3 62a_100000694195_100009813815 [1,1,0,0,0,0|2,0,0]=4 409 B21R3.39025 OCc1cccc(n1)SCc2noc3c2cccc3 62a_100009813815_100000694195 [1,1,0,0,0,0|2,0,0]=4 410 B21R3.39025 OCc1ccnc(c1)SCc2noc3c2cccc3 62a_100009813815_100009814636 [1,1,0,0,0,0|2,0,0]=4 411 B21R3.39025 OCc1ccnc(c1)SCc2noc3c2cccc3 62a_100009814636_100009813815 [1,1,0,0,0,0|2,0,0]=4 412 B21R3.39025 OCc1cncc(n1)SCc2noc3c2cccc3 62a_100009813815_100009853123 [1,1,0,0,0,0|1,0,1]=4 413 B21R3.39025 OCc1cncc(n1)SCc2noc3c2cccc3 62a_100009853123_100009813815 [1,1,0,0,0,0|1,0,1]=4 414 B21R3.140393 Cc1cc(nc(n1)SCc2noc3c2cccc3)C 62a_100000736147_100009813815 [1,1,0,0,0,0|2,0,0]=4 415 B21R3.140393 Cc1cc(nc(n1)SCc2noc3c2cccc3)C 62a_100009813815_100000736147 [1,1,0,0,0,0|2,0,0]=4 416 B21R3.140393 Cc1cc(nc(n1)SCc2noc3c2cccc3)N 62a_100000687285_100009813815 [1,1,0,0,0,0|2,0,0]=4 417 B21R3.140393 Cc1cc(nc(n1)SCc2noc3c2cccc3)N 62a_100009813815_100000687285 [1,1,0,0,0,0|2,0,0]=4 418 B21R3.140393 Clc1cc(nc(n1)SCc2noc3c2cccc3)Cl 62a_100009813815_100010365624 [1,1,0,0,0,0|2,0,0]=4 419 B21R3.140393 Clc1cc(nc(n1)SCc2noc3c2cccc3)Cl 62a_100010365624_100009813815 [1,1,0,0,0,0|2,0,0]=4 420 B21R3.140393 Nc1cc(nc(c1)SCc2noc3c2cccc3)O 62a_100009813815_200012179554 [1,1,0,0,0,0|2,0,0]=4 421 B21R3.476618 Cc1c[nH]c(=O)c(n1)SCc2noc3c2cccc3 62a_100009813815_100009858157 [1,1,0,0,0,0|2,0,0]=4 422 B21R3.476618 Cc1c[nH]c(=O)c(n1)SCc2noc3c2cccc3 62a_100009858157_100009813815 [1,1,0,0,0,0|2,0,0]=4 423 B21R3.3234 Nc1nc(ncc1C=O)Sc2noc3c2cccc3 62a_100010726233_200000703156 [0,1,0,0,1,0|2,0,0]=4 424 B21R3.3234 Nc1nc(ncc1C=O)Sc2noc3c2cccc3 62a_200000703156_100010726233 [0,1,0,0,1,0|2,0,0]=4 425 B21R3.3527 COc1cc(c[nH]c1=O)Sc2noc3c2cccc3 62a_200000703156_100010125397 [0,1,0,0,1,0|2,0,0]=4 426 B21R3.3527 COc1nc(ncc1C)Sc2noc3c2cccc3 62a_100012500371_200000703156 [0,1,0,0,1,0|2,0,0]=4 427 B21R3.3527 COc1nc(ncc1C)Sc2noc3c2cccc3 62a_200000703156_100012500371 [0,1,0,0,1,0|2,0,0]=4 428 B21R3.3527 COc1nc(ncc1F)Sc2noc3c2cccc3 62a_100012183945_200000703156 [0,1,0,0,1,0|2,0,0]=4 429 B21R3.3527 COc1nc(ncc1F)Sc2noc3c2cccc3 62a_200000703156_100012183945 [0,1,0,0,1,0|2,0,0]=4 430 B21R3.3527 COc1nc(ncc1N)Sc2noc3c2cccc3 62a_100012122185_200000703156 [0,1,0,0,1,0|2,0,0]=4 431 B21R3.3527 COc1nc(ncc1N)Sc2noc3c2cccc3 62a_200000703156_100012122185 [0,1,0,0,1,0|2,0,0]=4 432 B21R3.211159 Cc1cc(nn(c1=O)C)Sc2noc3c2cccc3 62a_100010988966_200000703156 [0,1,0,0,1,0|2,0,0]=4 433 B21R3.211159 Cc1cc(nn(c1=O)C)Sc2noc3c2cccc3 62a_200000703156_100010988966 [0,1,0,0,1,0|2,0,0]=4 434 B21R3.3926 CCn1nc([nH]c1=O)SCc2noc3c2cccc3 62a_100009813815_100009830087 [0,1,0,0,1,0|2,0,0]=4 435 B21R3.3926 Cc1nc(sc1C=O)SCc2noc3c2cccc3 62a_100009813815_100010339034 [0,1,0,0,1,0|2,0,0]=4 436 B21R3.3926 Cc1nc(sc1C=O)SCc2noc3c2cccc3 62a_100010339034_100009813815 [0,1,0,0,1,0|2,0,0]=4 437 B21R3.3926 Cc1nc(sc1CO)SCc2noc3c2cccc3 62a_100009813815_100010264302 [0,1,0,0,1,0|2,0,0]=4 438 B21R3.3926 Cc1nc(sc1CO)SCc2noc3c2cccc3 62a_100010264302_100009813815 [0,1,0,0,1,0|2,0,0]=4 439 B21R3.3926 Cc1oc(nc1C=O)SCc2noc3c2cccc3 62a_100009813815_200010262729 [0,1,0,0,1,0|2,0,0]=4 440 B21R3.3926 Cc1oc(nc1C=O)SCc2noc3c2cccc3 62a_200010262729_100009813815 [0,1,0,0,1,0|2,0,0]=4 441 B21R3.3926 Cc1sc(nc1CO)SCc2noc3c2cccc3 62a_100009813815_100010127906 [0,1,0,0,1,0|2,0,0]=4 442 B21R3.3926 Cc1sc(nc1CO)SCc2noc3c2cccc3 62a_100010127906_100009813815 [0,1,0,0,1,0|2,0,0]=4 443 B21R3.100568 N#Cc1c(n[nH]c1N)SCc2noc3c2cccc3 62a_100009813815_100010590786 [0,1,0,0,1,0|2,0,0]=4 444 B23R3.46332 COc1nc(nc(c1F)C)SCc2noc3c2cccc3 62a_100000709200_100009813815 [0,2,0,0,0,0|2,0,0]=4 445 B23R3.46332 COc1nc(nc(c1F)C)SCc2noc3c2cccc3 62a_100009813815_100000709200 [0,2,0,0,0,0|2,0,0]=4 446 B23R3.1632887 COc1cc(ncc1C=O)SCc2noc3c2cccc3 62a_100009813815_100009846838 [0,2,0,0,0,0|2,0,0]=4 447 B23R3.1632887 COc1cc(ncc1C=O)SCc2noc3c2cccc3 62a_100009846838_100009813815 [0,2,0,0,0,0|2,0,0]=4 448 B23R3.1632887 COc1cnc(nc1OC)SCc2noc3c2cccc3 62a_100009813815_100010280452 [0,2,0,0,0,0|1,0,1]=4 449 B23R3.1632887 COc1nc(ccc1C=O)SCc2noc3c2cccc3 62a_100009813815_100009864722 [0,2,0,0,0,0|2,0,0]=4 450 B23R3.1632887 COc1nc(ccc1C=O)SCc2noc3c2cccc3 62a_100009864722_100009813815 [0,2,0,0,0,0|2,0,0]=4 451 B23R3.1632887 COc1nc(ncc1C#N)SCc2noc3c2cccc3 62a_100009813815_100009870535 [0,2,0,0,0,0|2,0,0]=4 452 B23R3.1632887 COc1nc(ncc1CO)SCc2noc3c2cccc3 62a_100009813815_200011024631 [0,2,0,0,0,0|1,0,1]=4 453 B23R3.1632887 COc1nc(ncc1CO)SCc2noc3c2cccc3 62a_200011024631_100009813815 [0,2,0,0,0,0|1,0,1]=4 454 B19R3.434 Brc1cnc(nc1)Sc2noc3c2cccc3 62a_100000690281_200000703156 [1,0,0,0,1,0|2,0,0]=4 455 B19R3.434 Brc1cnc(nc1)Sc2noc3c2cccc3 62a_200000703156_100000690281 [1,0,0,0,1,0|2,0,0]=4 456 B19R3.434 Cc1cnc(nc1)Sc2noc3c2cccc3 62a_100000061069_200000703156 [1,0,0,0,1,0|2,0,0]=4 457 B19R3.434 Cc1cnc(nc1)Sc2noc3c2cccc3 62a_200000703156_100000061069 [1,0,0,0,1,0|2,0,0]=4 458 B19R3.434 Clc1cnc(nc1)Sc2noc3c2cccc3 62a_100011356929_200000703156 [1,0,0,0,1,0|2,0,0]=4 459 B19R3.434 Clc1cnc(nc1)Sc2noc3c2cccc3 62a_200000703156_100011356929 [1,0,0,0,1,0|2,0,0]=4 460 B19R3.434 Fc1cnc(nc1)Sc2noc3c2cccc3 62a_100000685220_200000703156 [1,0,0,0,1,0|2,0,0]=4 461 B19R3.434 Fc1cnc(nc1)Sc2noc3c2cccc3 62a_200000703156_100000685220 [1,0,0,0,1,0|2,0,0]=4 462 B19R3.434 Nc1cnc(nc1)Sc2noc3c2cccc3 62a_100000068403_200000703156 [1,0,0,0,1,0|2,0,0]=4 463 B19R3.434 Nc1cnc(nc1)Sc2noc3c2cccc3 62a_200000703156_100000068403 [1,0,0,0,1,0|2,0,0]=4 464 B19R3.434 O=c1ccc(c[nH]1)Sc2noc3c2cccc3 62a_100000212171_200000703156 [1,0,0,0,1,0|2,0,0]=4 465 B19R3.434 O=c1ccc(c[nH]1)Sc2noc3c2cccc3 62a_200000703156_100000212171 [1,0,0,0,1,0|2,0,0]=4 466 B19R3.434 O=c1ccc(n[nH]1)Sc2coc3c2cccc3 62a_100009820020_100009812202 [1,0,0,0,1,0|2,0,0]=4 467 B19R3.434 O=c1ccc(n[nH]1)Sc2n[nH]c3c2cccc3 62a_100009820020_100000050141 [1,0,0,0,1,0|2,0,0]=4 468 B19R3.434 O=c1ccc(n[nH]1)Sc2noc3c2cccc3 62a_100009820020_200000703156 [1,0,0,0,1,0|1,0,0]=3 469 B19R3.434 O=c1ccc(n[nH]1)Sc2noc3c2cccc3 62a_200000703156_100009820020 [1,0,0,0,1,0|1,0,0]=3 470 B19R3.434 Oc1cnc(nc1)Sc2noc3c2cccc3 62a_100000730009_200000703156 [1,0,0,0,1,0|1,0,1]=4 471 B19R3.434 Oc1cnc(nc1)Sc2noc3c2cccc3 62a_200000703156_100000092845 [1,0,0,0,1,0|1,0,1]=4 472 B19R3.3759 Brc1csc(n1)SCc2noc3c2cccc3 62a_100009813815_200016082925 [1,0,0,0,1,0|2,0,0]=4 473 B19R3.3759 Brc1csc(n1)SCc2noc3c2cccc3 62a_200016082925_100009813815 [1,0,0,0,1,0|2,0,0]=4 474 B19R3.3759 Cc1c[nH]c(n1)SCc2noc3c2cccc3 62a_100009813815_100161115468 [1,0,0,0,1,0|1,0,1]=4 475 B19R3.3759 Cc1c[nH]c(n1)SCc2noc3c2cccc3 62a_100161115468_100009813815 [1,0,0,0,1,0|1,0,1]=4 476 B19R3.3759 Cc1cc(n[nH]1)SCc2noc3c2cccc3 62a_100009813815_100009819999 [1,0,0,0,1,0|1,0,0]=3 477 B19R3.3759 Cc1cc(n[nH]1)SCc2noc3c2cccc3 62a_100009819999_100009813815 [1,0,0,0,1,0|1,0,0]=3 478 B19R3.3759 Cc1cc(no1)SCc2noc3c2cccc3 62a_100000716708_100009813815 [1,0,0,0,1,0|2,0,0]=4 479 B19R3.3759 Cc1cc(no1)SCc2noc3c2cccc3 62a_100009813815_100000716708 [1,0,0,0,1,0|2,0,0]=4 480 B19R3.3759 Cc1cnc(s1)SCc2noc3c2cccc3 62a_100000690809_100009813815 [1,0,0,0,1,0|2,0,0]=4 481 B19R3.3759 Cc1cnc(s1)SCc2noc3c2cccc3 62a_100009813815_100000690809 [1,0,0,0,1,0|2,0,0]=4 482 B19R3.3759 Cc1csc(n1)SCc2noc3c2cccc3 62a_100009813815_100011291629 [1,0,0,0,1,0|2,0,0]=4 483 B19R3.3759 Cc1csc(n1)SCc2noc3c2cccc3 62a_100011291629_100009813815 [1,0,0,0,1,0|2,0,0]=4 484 B19R3.3759 Cc1nc(c[nH]1)SCc2noc3c2cccc3 62a_100009813815_100009814057 [1,0,0,0,1,0|2,0,0]=4 485 B19R3.3759 Cc1nc(c[nH]1)SCc2noc3c2cccc3 62a_100009814057_100009813815 [1,0,0,0,1,0|2,0,0]=4 486 B19R3.3759 Cc1nc(n[nH]1)SCc2noc3c2cccc3 62a_100000732540_100009813815 [1,0,0,0,1,0|1,0,0]=3 487 B19R3.3759 Cc1nc(n[nH]1)SCc2noc3c2cccc3 62a_100009813815_100000732540 [1,0,0,0,1,0|1,0,0]=3 488 B19R3.3759 Cc1nc(no1)SCc2noc3c2cccc3 62a_100009813815_100012003639 [1,0,0,0,1,0|2,0,0]=4 489 B19R3.3759 Cc1nc(no1)SCc2noc3c2cccc3 62a_100012003639_100009813815 [1,0,0,0,1,0|2,0,0]=4 490 B19R3.3759 Cn1cnc(n1)SCc2noc3c2cccc3 62a_100009813815_100009819955 [1,0,0,0,1,0|2,0,0]=4 491 B19R3.3759 Cn1cnc(n1)SCc2noc3c2cccc3 62a_100009819955_100009813815 [1,0,0,0,1,0|2,0,0]=4 492 B19R3.3759 Nc1cc(n[nH]1)SCc2noc3c2cccc3 62a_100009813815_100009822546 [1,0,0,0,1,0|1,0,0]=3 493 B19R3.3759 Nc1cc(n[nH]1)SCc2noc3c2cccc3 62a_100009822546_100009813815 [1,0,0,0,1,0|1,0,0]=3 494 B19R3.3759 Nc1csc(n1)SCc2noc3c2cccc3 62a_100009813815_200015188442 [1,0,0,0,1,0|2,0,0]=4 495 B19R3.3759 Nc1csc(n1)SCc2noc3c2cccc3 62a_200015188442_100009813815 [1,0,0,0,1,0|2,0,0]=4 496 B19R3.3759 Nc1nc(n[nH]1)SCc2noc3c2cccc3 62a_100009813815_100015184587 [1,0,0,0,1,0|1,0,0]=3 497 B19R3.3759 Nc1nc(n[nH]1)SCc2noc3c2cccc3 62a_100015184587_100009813815 [1,0,0,0,1,0|1,0,0]=3 498 B19R3.5407 Brc1c[nH]nc1SCc2noc3c2cccc3 62a_100009813815_100015839836 [1,0,0,0,1,0|1,0,0]=3 499 B19R3.5407 Brc1c[nH]nc1SCc2noc3c2cccc3 62a_100015839836_100009813815 [1,0,0,0,1,0|1,0,0]=3 500 B19R3.5407 Cc1c[nH]nc1SCc2noc3c2cccc3 62a_100009813815_100009871783 [1,0,0,0,1,0|1,0,0]=3 501 B19R3.5407 Cc1c[nH]nc1SCc2noc3c2cccc3 62a_100009871783_100009813815 [1,0,0,0,1,0|1,0,0]=3 502 B19R3.5407 Nc1c[nH]nc1SCc2noc3c2cccc3 62a_100009813815_100010894806 [1,0,0,0,1,0|1,0,0]=3 503 B19R3.5407 Nc1c[nH]nc1SCc2noc3c2cccc3 62a_100010894806_100009813815 [1,0,0,0,1,0|1,0,0]=3 504 B19R3.9780 Cc1ccnc(n1)Sc2noc3c2cccc3 62a_100011243806_200000703156 [1,0,0,0,1,0|2,0,0]=4 505 B19R3.9780 Cc1ccnc(n1)Sc2noc3c2cccc3 62a_200000703156_100011243806 [1,0,0,0,1,0|2,0,0]=4 506 B19R3.9780 Nc1ccnc(n1)Sc2noc3c2cccc3 62a_100000757536_200000703156 [1,0,0,0,1,0|2,0,0]=4 507 B19R3.9780 Nc1ccnc(n1)Sc2noc3c2cccc3 62a_200000703156_100000757536 [1,0,0,0,1,0|2,0,0]=4 508 B19R3.9780 Oc1ccnc(c1)Sc2noc3c2cccc3 62a_200000703156_100000762945 [1,0,0,0,1,0|2,0,0]=4 509 B19R3.9780 Oc1ccnc(n1)Sc2noc3c2cccc3 62a_200000703156_100011649813 [1,0,0,0,1,0|1,0,0]=3 510 B19R3.9780 Oc1cncc(n1)Sc2noc3c2cccc3 62a_200000703156_100011269956 [1,0,0,0,1,0|1,0,1]=4 511 B19R3.9780 Oc1cnnc(c1)Sc2noc3c2cccc3 62a_200000703156_200010734679 [1,0,0,0,1,0|1,0,1]=4 512 B19R3.17755 Cc1[nH]nc(c1C)Sc2noc3c2cccc3 62a_100015309786_200000703156 [0,0,0,0,2,0|2,0,0]=4 513 B19R3.17755 Cc1[nH]nc(c1C)Sc2noc3c2cccc3 62a_200000703156_100015309786 [0,0,0,0,2,0|2,0,0]=4 514 B21R3.863 O=c1ccc(n[nH]1)SCc2nccc3c2cccc3 62a_100000033776_100009820020 [1,0,0,0,0,1|2,0,0]=4 515 B21R3.863 O=c1ccc(n[nH]1)SCc2nccc3c2cccc3 62a_100009820020_100000033776 [1,0,0,0,0,1|2,0,0]=4 516 B21R3.872 Brc1cnc(nc1)CSCc2noc3c2cccc3 62a_100009813815_100010064664 [1,0,0,0,0,1|2,0,0]=4 517 B21R3.872 Brc1cnc(nc1)CSCc2noc3c2cccc3 62a_100010064664_100009813815 [1,0,0,0,0,1|2,0,0]=4 518 B21R3.872 Cc1cnc(nc1)CSCc2noc3c2cccc3 62a_100000685645_100009813815 [1,0,0,0,0,1|2,0,0]=4 519 B21R3.872 Cc1cnc(nc1)CSCc2noc3c2cccc3 62a_100009813815_100000685645 [1,0,0,0,0,1|2,0,0]=4 520 B21R3.30927 O=c1ccc(n[nH]1)SCc2cc3ccccc3cn2 62a_100009820020_100009869231 [1,0,0,0,0,1|2,0,0]=4 521 B21R3.30927 O=c1ccc(n[nH]1)SCc2cc3ccccc3cn2 62a_100009869231_100009820020 [1,0,0,0,0,1|2,0,0]=4 522 B21R3.30927 O=c1ccc(n[nH]1)SCc2ncc3ccccc3n2 62a_100009820020_100009868571 [1,0,0,0,0,1|2,0,0]=4 523 B21R3.30927 O=c1ccc(n[nH]1)SCc2ncc3ccccc3n2 62a_100009868571_100009820020 [1,0,0,0,0,1|2,0,0]=4 524 B21R3.21578 Oc1ccnc(n1)SCc2nccc3c2cccc3 62a_100000033776_100011649813 [1,0,0,0,0,1|2,0,0]=4 525 B21R3.469780 Oc1ccnc(n1)SCc2cc3ccccc3cn2 62a_100009869231_100011649813 [1,0,0,0,0,1|2,0,0]=4 526 B21R3.469780 Oc1ccnc(n1)SCc2ncc3ccccc3n2 62a_100009868571_100011649813 [1,0,0,0,0,1|2,0,0]=4