0 B16R2.124 Cc1cc(n[nH]c1=O)Sc2ccccc2 62a_100000719477_100012187101 [0,0,0,0,0,0|3,0,0]=3 1 B16R2.124 Cc1cc(n[nH]c1=O)Sc2ccccn2 62a_100011216584_100012187101 [0,0,0,0,0,0|4,0,0]=4 2 B16R2.124 Cc1cc(n[nH]c1=O)Sc2cccnc2 62a_100000210063_100012187101 [0,0,0,0,0,0|4,0,0]=4 3 B16R2.124 Cc1cc(n[nH]c1=O)Sc2ccncc2 62a_100000728582_100012187101 [0,0,0,0,0,0|4,0,0]=4 4 B16R2.124 Cc1cnc(cc1O)Sc2ccccc2 62a_100000704368_100000041952 [0,0,0,0,0,0|4,0,0]=4 5 B16R2.124 Cc1cnc(cc1O)Sc2ccccc2 62a_100000719477_100000704368 [0,0,0,0,0,0|4,0,0]=4 6 B16R2.124 Cc1cnc(nc1N)Nc2ccccc2 27a_100000106764_100011996698 [0,0,0,0,0,0|4,0,0]=4 7 B16R2.124 Cc1cnc(nc1N)Sc2ccccc2 62a_100000719477_100011996698 [0,0,0,0,0,0|4,0,0]=4 8 B16R2.124 Cc1cnc(nc1N)Sc2ccccc2 62a_100011996698_100000041952 [0,0,0,0,0,0|4,0,0]=4 9 B16R2.124 Cc1nc(c[nH]c1=O)Sc2ccccc2 62a_100000719477_100010363809 [0,0,0,0,0,0|3,0,0]=3 10 B16R2.124 Cc1nc(c[nH]c1=O)Sc2ccccc2 62a_100010363809_100000041952 [0,0,0,0,0,0|3,0,0]=3 11 B16R2.124 Cc1nc(c[nH]c1=O)Sc2ccccn2 62a_100010363809_100011216584 [0,0,0,0,0,0|4,0,0]=4 12 B16R2.124 Cc1nc(c[nH]c1=O)Sc2ccccn2 62a_100011216584_100010363809 [0,0,0,0,0,0|4,0,0]=4 13 B16R2.124 Cc1nc(c[nH]c1=O)Sc2cccnc2 62a_100000210063_100010363809 [0,0,0,0,0,0|4,0,0]=4 14 B16R2.124 Cc1nc(c[nH]c1=O)Sc2cccnc2 62a_100010363809_100000210063 [0,0,0,0,0,0|4,0,0]=4 15 B16R2.124 Cc1nc(c[nH]c1=O)Sc2ccncc2 62a_100000728582_100010363809 [0,0,0,0,0,0|4,0,0]=4 16 B16R2.124 Cc1nc(c[nH]c1=O)Sc2ccncc2 62a_100010363809_100000728582 [0,0,0,0,0,0|4,0,0]=4 17 B16R2.124 Cc1nc(ncc1Cl)Nc2ccccc2 27a_100000106764_100010174973 [0,0,0,0,0,0|4,0,0]=4 18 B16R2.124 Cc1nc(ncc1Cl)Sc2ccccc2 62a_100000719477_100010174973 [0,0,0,0,0,0|4,0,0]=4 19 B16R2.124 Cc1nc(ncc1Cl)Sc2ccccc2 62a_100010174973_100000041952 [0,0,0,0,0,0|4,0,0]=4 20 B16R2.124 Cc1nc(ncc1F)Nc2ccccc2 27a_100000106764_100015641512 [0,0,0,0,0,0|4,0,0]=4 21 B16R2.124 Cc1nc(ncc1F)Sc2ccccc2 62a_100000719477_100015641512 [0,0,0,0,0,0|4,0,0]=4 22 B16R2.124 Cc1nc(ncc1F)Sc2ccccc2 62a_100015641512_100000041952 [0,0,0,0,0,0|4,0,0]=4 23 B16R2.124 Cc1nc(ncc1N)Nc2ccccc2 27a_100000106764_100000123670 [0,0,0,0,0,0|4,0,0]=4 24 B16R2.124 Cc1nc(ncc1N)Sc2ccccc2 62a_100000123670_100000041952 [0,0,0,0,0,0|4,0,0]=4 25 B16R2.124 Cc1nc(ncc1N)Sc2ccccc2 62a_100000719477_100000123670 [0,0,0,0,0,0|4,0,0]=4 26 B16R2.124 Nc1cc(n[nH]c1=O)Sc2ccccc2 62a_100000719477_100000102183 [0,0,0,0,0,0|3,0,0]=3 27 B16R2.124 Nc1cc(n[nH]c1=O)Sc2ccccn2 62a_100011216584_100000102183 [0,0,0,0,0,0|4,0,0]=4 28 B16R2.124 Nc1cc(n[nH]c1=O)Sc2cccnc2 62a_100000210063_100000102183 [0,0,0,0,0,0|4,0,0]=4 29 B16R2.124 Nc1cc(n[nH]c1=O)Sc2ccncc2 62a_100000728582_100000102183 [0,0,0,0,0,0|4,0,0]=4 30 B16R2.124 Nc1ccc(nc1O)Sc2ccccc2 62a_100000718904_100000041952 [0,0,0,0,0,0|4,0,0]=4 31 B16R2.124 Nc1cnc(nc1N)Sc2ccccc2 62a_100000719477_100011933915 [0,0,0,0,0,0|4,0,0]=4 32 B16R2.124 Nc1cnc(nc1N)Sc2ccccc2 62a_100011933915_100000041952 [0,0,0,0,0,0|4,0,0]=4 33 B16R2.124 Nc1nc(ncc1F)Nc2ccccc2 27a_100000106764_100000185498 [0,0,0,0,0,0|4,0,0]=4 34 B16R2.124 Nc1nc(ncc1F)Sc2ccccc2 62a_100000185498_100000041952 [0,0,0,0,0,0|4,0,0]=4 35 B16R2.124 Nc1nc(ncc1F)Sc2ccccc2 62a_100000719477_100000185498 [0,0,0,0,0,0|4,0,0]=4 36 B16R2.124 O=c1[nH]cc(cc1Br)Sc2ccccc2 62a_100000719477_100010125443 [0,0,0,0,0,0|4,0,0]=4 37 B16R2.124 O=c1[nH]cc(cc1Br)Sc2ccccc2 62a_100010125443_100000041952 [0,0,0,0,0,0|4,0,0]=4 38 B16R2.124 O=c1[nH]cc(cc1F)Sc2ccccc2 62a_100000719477_100000723523 [0,0,0,0,0,0|4,0,0]=4 39 B16R2.124 O=c1[nH]cc(cc1F)Sc2ccccc2 62a_100000723523_100000041952 [0,0,0,0,0,0|4,0,0]=4 40 B16R2.124 O=c1[nH]cc(cc1O)Sc2ccccc2 62a_100000719477_100009814561 [0,0,0,0,0,0|3,0,0]=3 41 B16R2.124 O=c1[nH]cc(cc1O)Sc2ccccn2 62a_100011216584_100009814561 [0,0,0,0,0,0|4,0,0]=4 42 B16R2.124 O=c1[nH]cc(cc1O)Sc2cccnc2 62a_100000210063_100009814561 [0,0,0,0,0,0|4,0,0]=4 43 B16R2.124 O=c1[nH]cc(cc1O)Sc2ccncc2 62a_100000728582_100009814561 [0,0,0,0,0,0|4,0,0]=4 44 B16R2.124 Oc1cc(ncc1F)Sc2ccccc2 62a_100000719477_100009854642 [0,0,0,0,0,0|4,0,0]=4 45 B16R2.124 Oc1cc(ncc1F)Sc2ccccc2 62a_100009854642_100000041952 [0,0,0,0,0,0|4,0,0]=4 46 B16R2.124 Oc1nc(ccc1F)Sc2ccccc2 62a_100000719477_100010729010 [0,0,0,0,0,0|4,0,0]=4 47 B16R2.124 Oc1nc(ncc1F)Nc2ccccc2 27a_100000106764_100011995740 [0,0,0,0,0,0|3,0,0]=3 48 B16R2.124 Oc1nc(ncc1F)Sc2ccccc2 62a_100000719477_100011995740 [0,0,0,0,0,0|3,0,0]=3 49 B16R2.124 Oc1nc(ncc1F)Sc2ccccn2 62a_100011216584_100011995740 [0,0,0,0,0,0|4,0,0]=4 50 B16R2.124 Oc1nc(ncc1F)Sc2cccnc2 62a_100000210063_100011995740 [0,0,0,0,0,0|4,0,0]=4 51 B16R2.124 Oc1nc(ncc1F)Sc2ccncc2 62a_100000728582_100011995740 [0,0,0,0,0,0|4,0,0]=4 52 B15R2.29 Brc1cnc(nc1)Nc2ccccc2 27a_100000106764_100000690281 [1,0,0,0,0,0|3,0,0]=4 53 B15R2.29 Brc1cnc(nc1)Sc2ccccc2 62a_100000690281_100000041952 [1,0,0,0,0,0|3,0,0]=4 54 B15R2.29 Brc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000690281 [1,0,0,0,0,0|3,0,0]=4 55 B15R2.29 Cc1cnc(nc1)Nc2ccccc2 27a_100000106764_100000061069 [1,0,0,0,0,0|3,0,0]=4 56 B15R2.29 Cc1cnc(nc1)Sc2ccccc2 62a_100000061069_100000041952 [1,0,0,0,0,0|3,0,0]=4 57 B15R2.29 Cc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000061069 [1,0,0,0,0,0|3,0,0]=4 58 B15R2.29 Clc1cnc(nc1)Nc2ccccc2 27a_100000106764_100011356929 [1,0,0,0,0,0|3,0,0]=4 59 B15R2.29 Clc1cnc(nc1)Sc2ccccc2 62a_100000719477_100011356929 [1,0,0,0,0,0|3,0,0]=4 60 B15R2.29 Clc1cnc(nc1)Sc2ccccc2 62a_100011356929_100000041952 [1,0,0,0,0,0|3,0,0]=4 61 B15R2.29 Fc1cnc(nc1)Nc2ccccc2 27a_100000106764_100000685220 [1,0,0,0,0,0|3,0,0]=4 62 B15R2.29 Fc1cnc(nc1)Sc2ccccc2 62a_100000685220_100000041952 [1,0,0,0,0,0|3,0,0]=4 63 B15R2.29 Fc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000685220 [1,0,0,0,0,0|3,0,0]=4 64 B15R2.29 Nc1cnc(nc1)Sc2ccccc2 62a_100000068403_100000041952 [1,0,0,0,0,0|3,0,0]=4 65 B15R2.29 Nc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000068403 [1,0,0,0,0,0|3,0,0]=4 66 B15R2.29 O=c1ccc(c[nH]1)Sc2ccccc2 62a_100000212171_100000041952 [1,0,0,0,0,0|3,0,0]=4 67 B15R2.29 O=c1ccc(c[nH]1)Sc2ccccc2 62a_100000719477_100000212171 [1,0,0,0,0,0|3,0,0]=4 68 B15R2.29 O=c1ccc(n[nH]1)Sc2ccccc2 62a_100000719477_100009820020 [1,0,0,0,0,0|2,0,0]=3 69 B15R2.29 O=c1ccc(n[nH]1)Sc2ccccc2 62a_100009820020_100000041952 [1,0,0,0,0,0|2,0,0]=3 70 B15R2.29 O=c1ccc(n[nH]1)Sc2ccccn2 62a_100009820020_100011216584 [1,0,0,0,0,0|3,0,0]=4 71 B15R2.29 O=c1ccc(n[nH]1)Sc2ccccn2 62a_100011216584_100009820020 [1,0,0,0,0,0|3,0,0]=4 72 B15R2.29 O=c1ccc(n[nH]1)Sc2cccnc2 62a_100000210063_100009820020 [1,0,0,0,0,0|3,0,0]=4 73 B15R2.29 O=c1ccc(n[nH]1)Sc2cccnc2 62a_100009820020_100000210063 [1,0,0,0,0,0|3,0,0]=4 74 B15R2.29 O=c1ccc(n[nH]1)Sc2ccncc2 62a_100000728582_100009820020 [1,0,0,0,0,0|3,0,0]=4 75 B15R2.29 O=c1ccc(n[nH]1)Sc2ccncc2 62a_100009820020_100000728582 [1,0,0,0,0,0|3,0,0]=4 76 B15R2.29 Oc1cnc(nc1)Nc2ccccc2 271570a_203496583355_100011939124 [1,0,0,0,0,0|2,0,1]=4 77 B15R2.29 Oc1cnc(nc1)Oc2ccccc2 271570a_203496583355_100011939432 [1,0,0,0,0,0|2,0,1]=4 78 B15R2.29 Oc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000092845 [1,0,0,0,0,0|2,0,1]=4 79 B15R2.29 Oc1cnc(nc1)Sc2ccccc2 62a_100000730009_100000041952 [1,0,0,0,0,0|2,0,1]=4 80 B15R2.31 Cc1ccnc(n1)Nc2ccccc2 27a_100000106764_100000750684 [1,0,0,0,0,0|3,0,0]=4 81 B15R2.31 Cc1ccnc(n1)Sc2ccccc2 62a_100000719477_100011243806 [1,0,0,0,0,0|3,0,0]=4 82 B15R2.31 Cc1ccnc(n1)Sc2ccccc2 62a_100011243806_100000041952 [1,0,0,0,0,0|3,0,0]=4 83 B15R2.31 Nc1ccnc(n1)Nc2ccccc2 27a_100000106764_100000757536 [1,0,0,0,0,0|3,0,0]=4 84 B15R2.31 Nc1ccnc(n1)Sc2ccccc2 62a_100000719477_100000757536 [1,0,0,0,0,0|3,0,0]=4 85 B15R2.31 Nc1ccnc(n1)Sc2ccccc2 62a_100000757536_100000041952 [1,0,0,0,0,0|3,0,0]=4 86 B15R2.31 Oc1cccc(n1)Oc2ccccc2 271570a_203496583355_100011960278 [1,0,0,0,0,0|3,0,0]=4 87 B15R2.31 Oc1ccnc(c1)Sc2ccccc2 62a_100000719477_100000762945 [1,0,0,0,0,0|3,0,0]=4 88 B15R2.31 Oc1ccnc(n1)Nc2ccccc2 27a_100000106764_100011649813 [1,0,0,0,0,0|2,0,0]=3 89 B15R2.31 Oc1ccnc(n1)Sc2ccccc2 62a_100000719477_100011649813 [1,0,0,0,0,0|2,0,0]=3 90 B15R2.31 Oc1ccnc(n1)Sc2ccccn2 62a_100011216584_100011649813 [1,0,0,0,0,0|3,0,0]=4 91 B15R2.31 Oc1ccnc(n1)Sc2cccnc2 62a_100000210063_100011649813 [1,0,0,0,0,0|3,0,0]=4 92 B15R2.31 Oc1ccnc(n1)Sc2ccncc2 62a_100000728582_100011649813 [1,0,0,0,0,0|3,0,0]=4 93 B15R2.31 Oc1cncc(c1)Cc2ccccc2 271570a_203496583355_200010295753 [1,0,0,0,0,0|2,0,1]=4 94 B15R2.31 Oc1cncc(n1)Oc2ccccc2 271570a_203496583355_200011210009 [1,0,0,0,0,0|2,0,1]=4 95 B15R2.31 Oc1cncc(n1)Sc2ccccc2 62a_100000719477_100011269956 [1,0,0,0,0,0|2,0,1]=4 96 B15R2.31 Oc1cnnc(c1)Sc2ccccc2 62a_100000719477_200010734679 [1,0,0,0,0,0|2,0,1]=4 97 B17R2.219 C=C(c1ccccc1)c2c[nH]c(=O)c(c2)O 271570a_100000068269_100009814561 [0,1,0,0,0,0|2,0,1]=4 98 B17R2.219 C=C(c1ccccc1)c2c[nH]c(=O)c(n2)C 271570a_100000068269_100010363809 [0,1,0,0,0,0|2,0,1]=4 99 B17R2.219 C=C(c1ccccc1)c2cc(c(=O)[nH]n2)C 271570a_100000068269_100012187101 [0,1,0,0,0,0|2,0,1]=4 100 B17R2.219 C=C(c1ccccc1)c2cc(c(=O)[nH]n2)N 271570a_100000068269_100000102183 [0,1,0,0,0,0|2,0,1]=4 101 B17R2.219 C=C(c1ccccc1)c2ncc(c(n2)O)F 271570a_100000068269_100011995740 [0,1,0,0,0,0|2,0,1]=4 102 B17R2.472 Cc1cc(n[nH]c1=O)Sc2ccc(cc2)Br 62a_100000752885_100012187101 [0,1,0,0,0,0|3,0,0]=4 103 B17R2.472 Cc1cc(n[nH]c1=O)Sc2ccc(cc2)Cl 62a_100000755918_100012187101 [0,1,0,0,0,0|3,0,0]=4 104 B17R2.472 Cc1cc(n[nH]c1=O)Sc2ccc(cc2)F 62a_100000211213_100012187101 [0,1,0,0,0,0|3,0,0]=4 105 B17R2.472 Cc1cc(n[nH]c1=O)Sc2ccc(cc2)N 62a_100000185761_100012187101 [0,1,0,0,0,0|3,0,0]=4 106 B17R2.472 Cc1ccc(cc1)Nc2ncc(c(n2)O)F 27a_100000124888_100011995740 [0,1,0,0,0,0|3,0,0]=4 107 B17R2.472 Cc1ccc(cc1)Sc2c[nH]c(=O)c(c2)O 62a_100000186775_100009814561 [0,1,0,0,0,0|3,0,0]=4 108 B17R2.472 Cc1ccc(cc1)Sc2c[nH]c(=O)c(n2)C 62a_100000186775_100010363809 [0,1,0,0,0,0|3,0,0]=4 109 B17R2.472 Cc1ccc(cc1)Sc2c[nH]c(=O)c(n2)C 62a_100010363809_100000186775 [0,1,0,0,0,0|3,0,0]=4 110 B17R2.472 Cc1ccc(cc1)Sc2cc(c(=O)[nH]n2)C 62a_100000186775_100012187101 [0,1,0,0,0,0|3,0,0]=4 111 B17R2.472 Cc1ccc(cc1)Sc2cc(c(=O)[nH]n2)N 62a_100000186775_100000102183 [0,1,0,0,0,0|3,0,0]=4 112 B17R2.472 Cc1ccc(cc1)Sc2ncc(c(n2)O)F 62a_100000186775_100011995740 [0,1,0,0,0,0|3,0,0]=4 113 B17R2.472 Cc1nc(c[nH]c1=O)Sc2ccc(cc2)Br 62a_100000752885_100010363809 [0,1,0,0,0,0|3,0,0]=4 114 B17R2.472 Cc1nc(c[nH]c1=O)Sc2ccc(cc2)Br 62a_100010363809_100000752885 [0,1,0,0,0,0|3,0,0]=4 115 B17R2.472 Cc1nc(c[nH]c1=O)Sc2ccc(cc2)Cl 62a_100000755918_100010363809 [0,1,0,0,0,0|3,0,0]=4 116 B17R2.472 Cc1nc(c[nH]c1=O)Sc2ccc(cc2)Cl 62a_100010363809_100000755918 [0,1,0,0,0,0|3,0,0]=4 117 B17R2.472 Cc1nc(c[nH]c1=O)Sc2ccc(cc2)F 62a_100000211213_100010363809 [0,1,0,0,0,0|3,0,0]=4 118 B17R2.472 Cc1nc(c[nH]c1=O)Sc2ccc(cc2)F 62a_100010363809_100000211213 [0,1,0,0,0,0|3,0,0]=4 119 B17R2.472 Cc1nc(c[nH]c1=O)Sc2ccc(cc2)N 62a_100000185761_100010363809 [0,1,0,0,0,0|3,0,0]=4 120 B17R2.472 Cc1nc(c[nH]c1=O)Sc2ccc(cc2)N 62a_100010363809_100000185761 [0,1,0,0,0,0|3,0,0]=4 121 B17R2.472 Cc1nc(c[nH]c1=O)Sc2ccc(cc2)O 62a_100010363809_100000185759 [0,1,0,0,0,0|3,0,0]=4 122 B17R2.472 Nc1cc(n[nH]c1=O)Sc2ccc(cc2)Br 62a_100000752885_100000102183 [0,1,0,0,0,0|3,0,0]=4 123 B17R2.472 Nc1cc(n[nH]c1=O)Sc2ccc(cc2)Cl 62a_100000755918_100000102183 [0,1,0,0,0,0|3,0,0]=4 124 B17R2.472 Nc1cc(n[nH]c1=O)Sc2ccc(cc2)F 62a_100000211213_100000102183 [0,1,0,0,0,0|3,0,0]=4 125 B17R2.472 Nc1ccc(cc1)Sc2c[nH]c(=O)c(c2)O 62a_100000185761_100009814561 [0,1,0,0,0,0|3,0,0]=4 126 B17R2.472 Nc1ccc(cc1)Sc2cc(c(=O)[nH]n2)N 62a_100000185761_100000102183 [0,1,0,0,0,0|3,0,0]=4 127 B17R2.472 Nc1ccc(cc1)Sc2ncc(c(n2)O)F 62a_100000185761_100011995740 [0,1,0,0,0,0|3,0,0]=4 128 B17R2.472 O=c1[nH]cc(cc1O)Sc2ccc(cc2)Br 62a_100000752885_100009814561 [0,1,0,0,0,0|3,0,0]=4 129 B17R2.472 O=c1[nH]cc(cc1O)Sc2ccc(cc2)Cl 62a_100000755918_100009814561 [0,1,0,0,0,0|3,0,0]=4 130 B17R2.472 O=c1[nH]cc(cc1O)Sc2ccc(cc2)F 62a_100000211213_100009814561 [0,1,0,0,0,0|3,0,0]=4 131 B17R2.472 Oc1ccc(cc1)Nc2ncc(c(n2)O)F 27a_100000185829_100011995740 [0,1,0,0,0,0|3,0,0]=4 132 B17R2.472 Oc1nc(ncc1F)Nc2ccc(cc2)Br 27a_100000210018_100011995740 [0,1,0,0,0,0|3,0,0]=4 133 B17R2.472 Oc1nc(ncc1F)Nc2ccc(cc2)Cl 27a_100000210052_100011995740 [0,1,0,0,0,0|3,0,0]=4 134 B17R2.472 Oc1nc(ncc1F)Nc2ccc(cc2)F 27a_100000185862_100011995740 [0,1,0,0,0,0|3,0,0]=4 135 B17R2.472 Oc1nc(ncc1F)Nc2ccc(cc2)I 27a_100000185761_100011995740 [0,1,0,0,0,0|3,0,0]=4 136 B17R2.472 Oc1nc(ncc1F)Sc2ccc(cc2)Br 62a_100000752885_100011995740 [0,1,0,0,0,0|3,0,0]=4 137 B17R2.472 Oc1nc(ncc1F)Sc2ccc(cc2)Cl 62a_100000755918_100011995740 [0,1,0,0,0,0|3,0,0]=4 138 B17R2.472 Oc1nc(ncc1F)Sc2ccc(cc2)F 62a_100000211213_100011995740 [0,1,0,0,0,0|3,0,0]=4 139 B17R2.2418 Nc1nc(ncc1C=O)Sc2ccccc2 62a_100000719477_100010726233 [0,1,0,0,0,0|3,0,0]=4 140 B17R2.2418 Nc1nc(ncc1C=O)Sc2ccccc2 62a_100010726233_100000041952 [0,1,0,0,0,0|3,0,0]=4 141 B17R2.2492 COc1cc(c[nH]c1=O)Sc2ccccc2 62a_100000719477_100010125397 [0,1,0,0,0,0|3,0,0]=4 142 B17R2.2492 COc1nc(ncc1C)Nc2ccccc2 27a_100000106764_100012500371 [0,1,0,0,0,0|3,0,0]=4 143 B17R2.2492 COc1nc(ncc1C)Sc2ccccc2 62a_100000719477_100012500371 [0,1,0,0,0,0|3,0,0]=4 144 B17R2.2492 COc1nc(ncc1C)Sc2ccccc2 62a_100012500371_100000041952 [0,1,0,0,0,0|3,0,0]=4 145 B17R2.2492 COc1nc(ncc1F)Sc2ccccc2 62a_100000719477_100012183945 [0,1,0,0,0,0|3,0,0]=4 146 B17R2.2492 COc1nc(ncc1F)Sc2ccccc2 62a_100012183945_100000041952 [0,1,0,0,0,0|3,0,0]=4 147 B17R2.2492 COc1nc(ncc1N)Nc2ccccc2 27a_100000106764_100012122185 [0,1,0,0,0,0|3,0,0]=4 148 B17R2.2492 COc1nc(ncc1N)Sc2ccccc2 62a_100000719477_100012122185 [0,1,0,0,0,0|3,0,0]=4 149 B17R2.2492 COc1nc(ncc1N)Sc2ccccc2 62a_100012122185_100000041952 [0,1,0,0,0,0|3,0,0]=4 150 B17R2.5115 Cc1cc(n[nH]c1=O)Sc2ccccc2Br 62a_100000695589_100012187101 [0,1,0,0,0,0|3,0,0]=4 151 B17R2.5115 Cc1cc(n[nH]c1=O)Sc2ccccc2Cl 62a_100000764095_100012187101 [0,1,0,0,0,0|3,0,0]=4 152 B17R2.5115 Cc1cc(n[nH]c1=O)Sc2ccccc2F 62a_100011215700_100012187101 [0,1,0,0,0,0|3,0,0]=4 153 B17R2.5115 Cc1cc(n[nH]c1=O)Sc2ccccc2N 62a_100000210017_100012187101 [0,1,0,0,0,0|3,0,0]=4 154 B17R2.5115 Cc1cc(n[nH]c1=O)Sc2ccccc2O 62a_100000739446_100012187101 [0,1,0,0,0,0|3,0,0]=4 155 B17R2.5115 Cc1ccccc1Nc2ncc(c(n2)O)F 27a_100015192222_100011995740 [0,1,0,0,0,0|3,0,0]=4 156 B17R2.5115 Cc1ccccc1Sc2c[nH]c(=O)c(c2)O 62a_100000210755_100009814561 [0,1,0,0,0,0|3,0,0]=4 157 B17R2.5115 Cc1ccccc1Sc2c[nH]c(=O)c(n2)C 62a_100000210755_100010363809 [0,1,0,0,0,0|3,0,0]=4 158 B17R2.5115 Cc1ccccc1Sc2c[nH]c(=O)c(n2)C 62a_100010363809_100000210755 [0,1,0,0,0,0|3,0,0]=4 159 B17R2.5115 Cc1ccccc1Sc2cc(c(=O)[nH]n2)C 62a_100000210755_100012187101 [0,1,0,0,0,0|3,0,0]=4 160 B17R2.5115 Cc1ccccc1Sc2cc(c(=O)[nH]n2)N 62a_100000210755_100000102183 [0,1,0,0,0,0|3,0,0]=4 161 B17R2.5115 Cc1ccccc1Sc2ncc(c(n2)O)F 62a_100000210755_100011995740 [0,1,0,0,0,0|3,0,0]=4 162 B17R2.5115 Cc1nc(c[nH]c1=O)Sc2ccccc2Br 62a_100000695589_100010363809 [0,1,0,0,0,0|3,0,0]=4 163 B17R2.5115 Cc1nc(c[nH]c1=O)Sc2ccccc2Br 62a_100010363809_100000695589 [0,1,0,0,0,0|3,0,0]=4 164 B17R2.5115 Cc1nc(c[nH]c1=O)Sc2ccccc2Cl 62a_100000764095_100010363809 [0,1,0,0,0,0|3,0,0]=4 165 B17R2.5115 Cc1nc(c[nH]c1=O)Sc2ccccc2Cl 62a_100010363809_100000764095 [0,1,0,0,0,0|3,0,0]=4 166 B17R2.5115 Cc1nc(c[nH]c1=O)Sc2ccccc2F 62a_100010363809_100011215700 [0,1,0,0,0,0|3,0,0]=4 167 B17R2.5115 Cc1nc(c[nH]c1=O)Sc2ccccc2F 62a_100011215700_100010363809 [0,1,0,0,0,0|3,0,0]=4 168 B17R2.5115 Cc1nc(c[nH]c1=O)Sc2ccccc2N 62a_100000210017_100010363809 [0,1,0,0,0,0|3,0,0]=4 169 B17R2.5115 Cc1nc(c[nH]c1=O)Sc2ccccc2N 62a_100010363809_100000210017 [0,1,0,0,0,0|3,0,0]=4 170 B17R2.5115 Cc1nc(c[nH]c1=O)Sc2ccccc2O 62a_100000739446_100010363809 [0,1,0,0,0,0|3,0,0]=4 171 B17R2.5115 Cc1nc(c[nH]c1=O)Sc2ccccc2O 62a_100010363809_100000739446 [0,1,0,0,0,0|3,0,0]=4 172 B17R2.5115 Nc1cc(n[nH]c1=O)Sc2ccccc2Br 62a_100000695589_100000102183 [0,1,0,0,0,0|3,0,0]=4 173 B17R2.5115 Nc1cc(n[nH]c1=O)Sc2ccccc2Cl 62a_100000764095_100000102183 [0,1,0,0,0,0|3,0,0]=4 174 B17R2.5115 Nc1cc(n[nH]c1=O)Sc2ccccc2F 62a_100011215700_100000102183 [0,1,0,0,0,0|3,0,0]=4 175 B17R2.5115 Nc1cc(n[nH]c1=O)Sc2ccccc2O 62a_100000739446_100000102183 [0,1,0,0,0,0|3,0,0]=4 176 B17R2.5115 Nc1ccccc1Sc2c[nH]c(=O)c(c2)O 62a_100000210017_100009814561 [0,1,0,0,0,0|3,0,0]=4 177 B17R2.5115 Nc1ccccc1Sc2cc(c(=O)[nH]n2)N 62a_100000210017_100000102183 [0,1,0,0,0,0|3,0,0]=4 178 B17R2.5115 Nc1ccccc1Sc2ncc(c(n2)O)F 62a_100000210017_100011995740 [0,1,0,0,0,0|3,0,0]=4 179 B17R2.5115 O=c1[nH]cc(cc1O)Sc2ccccc2Br 62a_100000695589_100009814561 [0,1,0,0,0,0|3,0,0]=4 180 B17R2.5115 O=c1[nH]cc(cc1O)Sc2ccccc2Cl 62a_100000764095_100009814561 [0,1,0,0,0,0|3,0,0]=4 181 B17R2.5115 O=c1[nH]cc(cc1O)Sc2ccccc2F 62a_100011215700_100009814561 [0,1,0,0,0,0|3,0,0]=4 182 B17R2.5115 O=c1[nH]cc(cc1O)Sc2ccccc2O 62a_100000739446_100009814561 [0,1,0,0,0,0|3,0,0]=4 183 B17R2.5115 Oc1ccccc1Nc2ncc(c(n2)O)F 27a_100000185747_100011995740 [0,1,0,0,0,0|3,0,0]=4 184 B17R2.5115 Oc1ccccc1Sc2ncc(c(n2)O)F 62a_100000739446_100011995740 [0,1,0,0,0,0|3,0,0]=4 185 B17R2.5115 Oc1nc(ncc1F)Nc2ccccc2Cl 27a_100000185783_100011995740 [0,1,0,0,0,0|3,0,0]=4 186 B17R2.5115 Oc1nc(ncc1F)Nc2ccccc2F 27a_100000210422_100011995740 [0,1,0,0,0,0|3,0,0]=4 187 B17R2.5115 Oc1nc(ncc1F)Nc2ccccc2I 27a_100000210053_100011995740 [0,1,0,0,0,0|3,0,0]=4 188 B17R2.5115 Oc1nc(ncc1F)Sc2ccccc2Br 62a_100000695589_100011995740 [0,1,0,0,0,0|3,0,0]=4 189 B17R2.5115 Oc1nc(ncc1F)Sc2ccccc2Cl 62a_100000764095_100011995740 [0,1,0,0,0,0|3,0,0]=4 190 B17R2.5115 Oc1nc(ncc1F)Sc2ccccc2F 62a_100011215700_100011995740 [0,1,0,0,0,0|3,0,0]=4 191 B17R2.36760 Cc1cc(nn(c1=O)C)Sc2ccccc2 62a_100000719477_100010988966 [0,1,0,0,0,0|3,0,0]=4 192 B17R2.36760 Cc1cc(nn(c1=O)C)Sc2ccccc2 62a_100010988966_100000041952 [0,1,0,0,0,0|3,0,0]=4 193 B17R2.41860 Cc1cc(n[nH]c1=O)Sc2cccc(c2)Br 62a_100000691529_100012187101 [0,1,0,0,0,0|3,0,0]=4 194 B17R2.41860 Cc1cc(n[nH]c1=O)Sc2cccc(c2)Cl 62a_100000699651_100012187101 [0,1,0,0,0,0|3,0,0]=4 195 B17R2.41860 Cc1cc(n[nH]c1=O)Sc2cccc(c2)F 62a_100000685547_100012187101 [0,1,0,0,0,0|3,0,0]=4 196 B17R2.41860 Cc1cc(n[nH]c1=O)Sc2cccc(c2)N 62a_100000210019_100012187101 [0,1,0,0,0,0|3,0,0]=4 197 B17R2.41860 Cc1cc(n[nH]c1=O)Sc2cccc(c2)[S] 62a_114929384022_100012187101 [0,1,0,0,0,0|3,0,0]=4 198 B17R2.41860 Cc1cccc(c1)Nc2ncc(c(n2)O)F 27a_100000188690_100011995740 [0,1,0,0,0,0|3,0,0]=4 199 B17R2.41860 Cc1cccc(c1)Sc2c[nH]c(=O)c(c2)O 62a_100011215228_100009814561 [0,1,0,0,0,0|3,0,0]=4 200 B17R2.41860 Cc1cccc(c1)Sc2c[nH]c(=O)c(n2)C 62a_100010363809_100011215228 [0,1,0,0,0,0|3,0,0]=4 201 B17R2.41860 Cc1cccc(c1)Sc2c[nH]c(=O)c(n2)C 62a_100011215228_100010363809 [0,1,0,0,0,0|3,0,0]=4 202 B17R2.41860 Cc1cccc(c1)Sc2cc(c(=O)[nH]n2)C 62a_100011215228_100012187101 [0,1,0,0,0,0|3,0,0]=4 203 B17R2.41860 Cc1cccc(c1)Sc2cc(c(=O)[nH]n2)N 62a_100011215228_100000102183 [0,1,0,0,0,0|3,0,0]=4 204 B17R2.41860 Cc1cccc(c1)Sc2ncc(c(n2)O)F 62a_100011215228_100011995740 [0,1,0,0,0,0|3,0,0]=4 205 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)Br 62a_100000691529_100010363809 [0,1,0,0,0,0|3,0,0]=4 206 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)Br 62a_100010363809_100000691529 [0,1,0,0,0,0|3,0,0]=4 207 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)Cl 62a_100000699651_100010363809 [0,1,0,0,0,0|3,0,0]=4 208 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)Cl 62a_100010363809_100000699651 [0,1,0,0,0,0|3,0,0]=4 209 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)F 62a_100000685547_100010363809 [0,1,0,0,0,0|3,0,0]=4 210 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)F 62a_100010363809_100000685547 [0,1,0,0,0,0|3,0,0]=4 211 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)N 62a_100000210019_100010363809 [0,1,0,0,0,0|3,0,0]=4 212 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)N 62a_100010363809_100000210019 [0,1,0,0,0,0|3,0,0]=4 213 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)O 62a_100010363809_100000211634 [0,1,0,0,0,0|3,0,0]=4 214 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)[S] 62a_100010363809_114929384022 [0,1,0,0,0,0|3,0,0]=4 215 B17R2.41860 Cc1nc(c[nH]c1=O)Sc2cccc(c2)[S] 62a_114929384022_100010363809 [0,1,0,0,0,0|3,0,0]=4 216 B17R2.41860 Nc1cc(n[nH]c1=O)Sc2cccc(c2)Br 62a_100000691529_100000102183 [0,1,0,0,0,0|3,0,0]=4 217 B17R2.41860 Nc1cc(n[nH]c1=O)Sc2cccc(c2)Cl 62a_100000699651_100000102183 [0,1,0,0,0,0|3,0,0]=4 218 B17R2.41860 Nc1cc(n[nH]c1=O)Sc2cccc(c2)F 62a_100000685547_100000102183 [0,1,0,0,0,0|3,0,0]=4 219 B17R2.41860 Nc1cc(n[nH]c1=O)Sc2cccc(c2)[S] 62a_114929384022_100000102183 [0,1,0,0,0,0|3,0,0]=4 220 B17R2.41860 Nc1cccc(c1)Sc2c[nH]c(=O)c(c2)O 62a_100000210019_100009814561 [0,1,0,0,0,0|3,0,0]=4 221 B17R2.41860 Nc1cccc(c1)Sc2cc(c(=O)[nH]n2)N 62a_100000210019_100000102183 [0,1,0,0,0,0|3,0,0]=4 222 B17R2.41860 Nc1cccc(c1)Sc2ncc(c(n2)O)F 62a_100000210019_100011995740 [0,1,0,0,0,0|3,0,0]=4 223 B17R2.41860 O=c1[nH]cc(cc1O)Sc2cccc(c2)Br 62a_100000691529_100009814561 [0,1,0,0,0,0|3,0,0]=4 224 B17R2.41860 O=c1[nH]cc(cc1O)Sc2cccc(c2)Cl 62a_100000699651_100009814561 [0,1,0,0,0,0|3,0,0]=4 225 B17R2.41860 O=c1[nH]cc(cc1O)Sc2cccc(c2)F 62a_100000685547_100009814561 [0,1,0,0,0,0|3,0,0]=4 226 B17R2.41860 O=c1[nH]cc(cc1O)Sc2cccc(c2)[S] 62a_114929384022_100009814561 [0,1,0,0,0,0|3,0,0]=4 227 B17R2.41860 Oc1cccc(c1)Nc2ncc(c(n2)O)F 27a_100000210217_100011995740 [0,1,0,0,0,0|3,0,0]=4 228 B17R2.41860 Oc1nc(ncc1F)Nc2cccc(c2)Br 27a_100000210019_100011995740 [0,1,0,0,0,0|3,0,0]=4 229 B17R2.41860 Oc1nc(ncc1F)Nc2cccc(c2)Cl 27a_100000185859_100011995740 [0,1,0,0,0,0|3,0,0]=4 230 B17R2.41860 Oc1nc(ncc1F)Nc2cccc(c2)F 27a_100000210047_100011995740 [0,1,0,0,0,0|3,0,0]=4 231 B17R2.41860 Oc1nc(ncc1F)Nc2cccc(c2)I 27a_100000211102_100011995740 [0,1,0,0,0,0|3,0,0]=4 232 B17R2.41860 Oc1nc(ncc1F)Sc2cccc(c2)Br 62a_100000691529_100011995740 [0,1,0,0,0,0|3,0,0]=4 233 B17R2.41860 Oc1nc(ncc1F)Sc2cccc(c2)Cl 62a_100000699651_100011995740 [0,1,0,0,0,0|3,0,0]=4 234 B17R2.41860 Oc1nc(ncc1F)Sc2cccc(c2)F 62a_100000685547_100011995740 [0,1,0,0,0,0|3,0,0]=4 235 B17R2.41860 Oc1nc(ncc1F)Sc2cccc(c2)[S] 62a_114929384022_100011995740 [0,1,0,0,0,0|3,0,0]=4 236 B15R1.964 C=CC(=O)NCC(=O)Cc1ccccc1 1458a_200011222540_100015291786 [0,0,1,0,0,0|3,0,0]=4 237 B15R1.964 C=CC(=O)NNC(=O)Cc1ccccc1 22a_100000182964_100000185746 [0,0,1,0,0,0|2,0,1]=4 238 B15R1.964 O=C(CO)NNC(=O)Cc1ccccc1 22a_100000182964_100000210174 [0,0,1,0,0,0|1,0,2]=4 239 B15R1.3664 CC(C)C(=O)NN=CCc1ccccc1 4a_100000184118_100000209964 [0,0,1,0,0,0|2,0,1]=4 240 B15R1.3664 NC(=O)C(=O)NN=CCc1ccccc1 4a_100000211141_100000209964 [0,0,1,0,0,0|0,0,2]=3 241 B15R2.94 Cc1cc(n[nH]c1=O)c2ccccc2 271570a_100011218836_100012187101 [0,0,0,0,1,0|2,0,0]=3 242 B15R2.94 Cc1cc(n[nH]c1=O)c2ccccn2 271570a_100011264011_100012187101 [0,0,0,0,1,0|3,0,0]=4 243 B15R2.94 Cc1cc(n[nH]c1=O)c2cccnc2 271570a_100000757648_100012187101 [0,0,0,0,1,0|3,0,0]=4 244 B15R2.94 Cc1cc(n[nH]c1=O)c2ccncc2 271570a_100000752145_100012187101 [0,0,0,0,1,0|3,0,0]=4 245 B15R2.94 Cc1cnc(cc1O)c2ccccc2 271570a_100011218836_100000704368 [0,0,0,0,1,0|3,0,0]=4 246 B15R2.94 Cc1cnc(nc1N)c2ccccc2 271570a_100011218836_100011996698 [0,0,0,0,1,0|3,0,0]=4 247 B15R2.94 Cc1nc(c[nH]c1=O)c2ccccc2 271570a_100011218836_100010363809 [0,0,0,0,1,0|2,0,0]=3 248 B15R2.94 Cc1nc(c[nH]c1=O)c2ccccn2 271570a_100011264011_100010363809 [0,0,0,0,1,0|3,0,0]=4 249 B15R2.94 Cc1nc(c[nH]c1=O)c2cccnc2 271570a_100000757648_100010363809 [0,0,0,0,1,0|3,0,0]=4 250 B15R2.94 Cc1nc(c[nH]c1=O)c2ccncc2 271570a_100000752145_100010363809 [0,0,0,0,1,0|3,0,0]=4 251 B15R2.94 Cc1nc(ncc1Cl)c2ccccc2 271570a_100011218836_100010174973 [0,0,0,0,1,0|3,0,0]=4 252 B15R2.94 Cc1nc(ncc1F)c2ccccc2 271570a_100011218836_100015641512 [0,0,0,0,1,0|3,0,0]=4 253 B15R2.94 Cc1nc(ncc1N)c2ccccc2 271570a_100011218836_100000123670 [0,0,0,0,1,0|3,0,0]=4 254 B15R2.94 Nc1cc(n[nH]c1=O)c2ccccc2 271570a_100011218836_100000102183 [0,0,0,0,1,0|2,0,0]=3 255 B15R2.94 Nc1cc(n[nH]c1=O)c2ccccn2 271570a_100011264011_100000102183 [0,0,0,0,1,0|3,0,0]=4 256 B15R2.94 Nc1cc(n[nH]c1=O)c2cccnc2 271570a_100000757648_100000102183 [0,0,0,0,1,0|3,0,0]=4 257 B15R2.94 Nc1cc(n[nH]c1=O)c2ccncc2 271570a_100000752145_100000102183 [0,0,0,0,1,0|3,0,0]=4 258 B15R2.94 Nc1ccc(nc1O)c2ccccc2 271570a_100011218836_100000718904 [0,0,0,0,1,0|3,0,0]=4 259 B15R2.94 Nc1cnc(nc1N)c2ccccc2 271570a_100011218836_100011933915 [0,0,0,0,1,0|3,0,0]=4 260 B15R2.94 Nc1nc(ncc1F)c2ccccc2 271570a_100011218836_100000185498 [0,0,0,0,1,0|3,0,0]=4 261 B15R2.94 O=c1[nH]cc(cc1Br)c2ccccc2 271570a_100011218836_100010125443 [0,0,0,0,1,0|3,0,0]=4 262 B15R2.94 O=c1[nH]cc(cc1F)c2ccccc2 271570a_100011218836_100000723523 [0,0,0,0,1,0|3,0,0]=4 263 B15R2.94 O=c1[nH]cc(cc1O)c2ccccc2 271570a_100011218836_100009814561 [0,0,0,0,1,0|2,0,0]=3 264 B15R2.94 O=c1[nH]cc(cc1O)c2ccccn2 271570a_100011264011_100009814561 [0,0,0,0,1,0|3,0,0]=4 265 B15R2.94 O=c1[nH]cc(cc1O)c2cccnc2 271570a_100000757648_100009814561 [0,0,0,0,1,0|3,0,0]=4 266 B15R2.94 O=c1[nH]cc(cc1O)c2ccncc2 271570a_100000752145_100009814561 [0,0,0,0,1,0|3,0,0]=4 267 B15R2.94 Oc1cc(ncc1F)c2ccccc2 271570a_100011218836_100009854642 [0,0,0,0,1,0|3,0,0]=4 268 B15R2.94 Oc1nc(ccc1F)c2ccccc2 271570a_100011218836_100010729010 [0,0,0,0,1,0|3,0,0]=4 269 B15R2.94 Oc1nc(ncc1F)c2ccccc2 271570a_100011218836_100011995740 [0,0,0,0,1,0|2,0,0]=3 270 B15R2.94 Oc1nc(ncc1F)c2ccccn2 271570a_100011264011_100011995740 [0,0,0,0,1,0|3,0,0]=4 271 B15R2.94 Oc1nc(ncc1F)c2cccnc2 271570a_100000757648_100011995740 [0,0,0,0,1,0|3,0,0]=4 272 B15R2.94 Oc1nc(ncc1F)c2ccncc2 271570a_100000752145_100011995740 [0,0,0,0,1,0|3,0,0]=4 273 B15R2.4083 Cc1[nH]nc(c1C)Sc2ccccc2 62a_100000719477_100015309786 [0,0,0,0,1,0|3,0,0]=4 274 B15R2.4083 Cc1[nH]nc(c1C)Sc2ccccc2 62a_100015309786_100000041952 [0,0,0,0,1,0|3,0,0]=4 275 B17R2.193 Cc1cc(n[nH]c1=O)C#Cc2ccccc2 271570a_100000069678_100012187101 [0,0,0,0,0,1|2,0,1]=4 276 B17R2.193 Cc1cc(n[nH]c1=O)C=Cc2ccccc2 271570a_100102527694_100012187101 [0,0,0,0,0,1|2,0,1]=4 277 B17R2.193 Cc1cc(n[nH]c1=O)SCc2ccccc2 62a_100000211182_100012187101 [0,0,0,0,0,1|2,0,0]=3 278 B17R2.193 Cc1cc(n[nH]c1=O)SCc2ccccn2 62a_100000721315_100012187101 [0,0,0,0,0,1|3,0,0]=4 279 B17R2.193 Cc1cc(n[nH]c1=O)SCc2cccnc2 62a_100000741622_100012187101 [0,0,0,0,0,1|3,0,0]=4 280 B17R2.193 Cc1cc(n[nH]c1=O)SCc2ccncc2 62a_100015193705_100012187101 [0,0,0,0,0,1|3,0,0]=4 281 B17R2.193 Cc1cnc(cc1O)SCc2ccccc2 62a_100000211182_100000704368 [0,0,0,0,0,1|3,0,0]=4 282 B17R2.193 Cc1cnc(cc1O)SCc2ccccc2 62a_100000704368_100015291786 [0,0,0,0,0,1|3,0,0]=4 283 B17R2.193 Cc1cnc(nc1N)NCc2ccccc2 27a_100015324214_100011996698 [0,0,0,0,0,1|3,0,0]=4 284 B17R2.193 Cc1cnc(nc1N)SCc2ccccc2 62a_100000211182_100011996698 [0,0,0,0,0,1|3,0,0]=4 285 B17R2.193 Cc1cnc(nc1N)SCc2ccccc2 62a_100011996698_100015291786 [0,0,0,0,0,1|3,0,0]=4 286 B17R2.193 Cc1nc(c[nH]c1=O)C#Cc2ccccc2 271570a_100000069678_100010363809 [0,0,0,0,0,1|2,0,1]=4 287 B17R2.193 Cc1nc(c[nH]c1=O)C=Cc2ccccc2 271570a_100102527694_100010363809 [0,0,0,0,0,1|2,0,1]=4 288 B17R2.193 Cc1nc(c[nH]c1=O)SCc2ccccc2 62a_100000211182_100010363809 [0,0,0,0,0,1|2,0,0]=3 289 B17R2.193 Cc1nc(c[nH]c1=O)SCc2ccccc2 62a_100010363809_100015291786 [0,0,0,0,0,1|2,0,0]=3 290 B17R2.193 Cc1nc(c[nH]c1=O)SCc2ccccn2 62a_100000721315_100010363809 [0,0,0,0,0,1|3,0,0]=4 291 B17R2.193 Cc1nc(c[nH]c1=O)SCc2ccccn2 62a_100010363809_100000721315 [0,0,0,0,0,1|3,0,0]=4 292 B17R2.193 Cc1nc(c[nH]c1=O)SCc2cccnc2 62a_100000741622_100010363809 [0,0,0,0,0,1|3,0,0]=4 293 B17R2.193 Cc1nc(c[nH]c1=O)SCc2cccnc2 62a_100010363809_100000741622 [0,0,0,0,0,1|3,0,0]=4 294 B17R2.193 Cc1nc(c[nH]c1=O)SCc2ccncc2 62a_100010363809_100015193705 [0,0,0,0,0,1|3,0,0]=4 295 B17R2.193 Cc1nc(c[nH]c1=O)SCc2ccncc2 62a_100015193705_100010363809 [0,0,0,0,0,1|3,0,0]=4 296 B17R2.193 Cc1nc(ncc1Cl)NCc2ccccc2 27a_100015324214_100010174973 [0,0,0,0,0,1|3,0,0]=4 297 B17R2.193 Cc1nc(ncc1Cl)SCc2ccccc2 62a_100000211182_100010174973 [0,0,0,0,0,1|3,0,0]=4 298 B17R2.193 Cc1nc(ncc1Cl)SCc2ccccc2 62a_100010174973_100015291786 [0,0,0,0,0,1|3,0,0]=4 299 B17R2.193 Cc1nc(ncc1F)NCc2ccccc2 27a_100015324214_100015641512 [0,0,0,0,0,1|3,0,0]=4 300 B17R2.193 Cc1nc(ncc1F)SCc2ccccc2 62a_100000211182_100015641512 [0,0,0,0,0,1|3,0,0]=4 301 B17R2.193 Cc1nc(ncc1F)SCc2ccccc2 62a_100015641512_100015291786 [0,0,0,0,0,1|3,0,0]=4 302 B17R2.193 Cc1nc(ncc1N)NCc2ccccc2 27a_100015324214_100000123670 [0,0,0,0,0,1|3,0,0]=4 303 B17R2.193 Cc1nc(ncc1N)SCc2ccccc2 62a_100000123670_100015291786 [0,0,0,0,0,1|3,0,0]=4 304 B17R2.193 Cc1nc(ncc1N)SCc2ccccc2 62a_100000211182_100000123670 [0,0,0,0,0,1|3,0,0]=4 305 B17R2.193 Nc1cc(n[nH]c1=O)C#Cc2ccccc2 271570a_100000069678_100000102183 [0,0,0,0,0,1|2,0,1]=4 306 B17R2.193 Nc1cc(n[nH]c1=O)C=Cc2ccccc2 271570a_100102527694_100000102183 [0,0,0,0,0,1|2,0,1]=4 307 B17R2.193 Nc1cc(n[nH]c1=O)SCc2ccccc2 62a_100000211182_100000102183 [0,0,0,0,0,1|2,0,0]=3 308 B17R2.193 Nc1cc(n[nH]c1=O)SCc2ccccn2 62a_100000721315_100000102183 [0,0,0,0,0,1|3,0,0]=4 309 B17R2.193 Nc1cc(n[nH]c1=O)SCc2cccnc2 62a_100000741622_100000102183 [0,0,0,0,0,1|3,0,0]=4 310 B17R2.193 Nc1cc(n[nH]c1=O)SCc2ccncc2 62a_100015193705_100000102183 [0,0,0,0,0,1|3,0,0]=4 311 B17R2.193 Nc1ccc(nc1O)SCc2ccccc2 62a_100000718904_100015291786 [0,0,0,0,0,1|3,0,0]=4 312 B17R2.193 Nc1cnc(nc1N)SCc2ccccc2 62a_100000211182_100011933915 [0,0,0,0,0,1|3,0,0]=4 313 B17R2.193 Nc1cnc(nc1N)SCc2ccccc2 62a_100011933915_100015291786 [0,0,0,0,0,1|3,0,0]=4 314 B17R2.193 Nc1nc(ncc1F)NCc2ccccc2 27a_100015324214_100000185498 [0,0,0,0,0,1|3,0,0]=4 315 B17R2.193 Nc1nc(ncc1F)SCc2ccccc2 62a_100000185498_100015291786 [0,0,0,0,0,1|3,0,0]=4 316 B17R2.193 Nc1nc(ncc1F)SCc2ccccc2 62a_100000211182_100000185498 [0,0,0,0,0,1|3,0,0]=4 317 B17R2.193 O=c1[nH]cc(cc1Br)SCc2ccccc2 62a_100000211182_100010125443 [0,0,0,0,0,1|3,0,0]=4 318 B17R2.193 O=c1[nH]cc(cc1Br)SCc2ccccc2 62a_100010125443_100015291786 [0,0,0,0,0,1|3,0,0]=4 319 B17R2.193 O=c1[nH]cc(cc1Cl)CNc2ccccc2 207a_100000106764_100000051075 [0,0,0,0,0,1|3,0,0]=4 320 B17R2.193 O=c1[nH]cc(cc1Cl)CNc2ccccc2 270302a_100000106764_100000051075 [0,0,0,0,0,1|3,0,0]=4 321 B17R2.193 O=c1[nH]cc(cc1F)SCc2ccccc2 62a_100000211182_100000723523 [0,0,0,0,0,1|3,0,0]=4 322 B17R2.193 O=c1[nH]cc(cc1F)SCc2ccccc2 62a_100000723523_100015291786 [0,0,0,0,0,1|3,0,0]=4 323 B17R2.193 O=c1[nH]cc(cc1O)C#Cc2ccccc2 271570a_100000069678_100009814561 [0,0,0,0,0,1|2,0,1]=4 324 B17R2.193 O=c1[nH]cc(cc1O)C=Cc2ccccc2 271570a_100102527694_100009814561 [0,0,0,0,0,1|2,0,1]=4 325 B17R2.193 O=c1[nH]cc(cc1O)SCc2ccccc2 62a_100000211182_100009814561 [0,0,0,0,0,1|2,0,0]=3 326 B17R2.193 O=c1[nH]cc(cc1O)SCc2ccccn2 62a_100000721315_100009814561 [0,0,0,0,0,1|3,0,0]=4 327 B17R2.193 O=c1[nH]cc(cc1O)SCc2cccnc2 62a_100000741622_100009814561 [0,0,0,0,0,1|3,0,0]=4 328 B17R2.193 O=c1[nH]cc(cc1O)SCc2ccncc2 62a_100015193705_100009814561 [0,0,0,0,0,1|3,0,0]=4 329 B17R2.193 Oc1cc(ncc1F)SCc2ccccc2 62a_100000211182_100009854642 [0,0,0,0,0,1|3,0,0]=4 330 B17R2.193 Oc1cc(ncc1F)SCc2ccccc2 62a_100009854642_100015291786 [0,0,0,0,0,1|3,0,0]=4 331 B17R2.193 Oc1nc(ccc1F)SCc2ccccc2 62a_100000211182_100010729010 [0,0,0,0,0,1|3,0,0]=4 332 B17R2.193 Oc1nc(ncc1F)C#Cc2ccccc2 271570a_100000069678_100011995740 [0,0,0,0,0,1|2,0,1]=4 333 B17R2.193 Oc1nc(ncc1F)C=Cc2ccccc2 271570a_100102527694_100011995740 [0,0,0,0,0,1|2,0,1]=4 334 B17R2.193 Oc1nc(ncc1F)NCc2ccccc2 27a_100015324214_100011995740 [0,0,0,0,0,1|2,0,0]=3 335 B17R2.193 Oc1nc(ncc1F)NCc2ccccn2 27a_100000210449_100011995740 [0,0,0,0,0,1|3,0,0]=4 336 B17R2.193 Oc1nc(ncc1F)NCc2cccnc2 27a_100000210453_100011995740 [0,0,0,0,0,1|3,0,0]=4 337 B17R2.193 Oc1nc(ncc1F)NCc2ccncc2 27a_100000210450_100011995740 [0,0,0,0,0,1|3,0,0]=4 338 B17R2.193 Oc1nc(ncc1F)SCc2ccccc2 62a_100000211182_100011995740 [0,0,0,0,0,1|2,0,0]=3 339 B17R2.193 Oc1nc(ncc1F)SCc2ccccn2 62a_100000721315_100011995740 [0,0,0,0,0,1|3,0,0]=4 340 B17R2.193 Oc1nc(ncc1F)SCc2cccnc2 62a_100000741622_100011995740 [0,0,0,0,0,1|3,0,0]=4 341 B17R2.193 Oc1nc(ncc1F)SCc2ccncc2 62a_100015193705_100011995740 [0,0,0,0,0,1|3,0,0]=4 342 B14R1.716 CCC(=O)NN=CCc1ccccc1 4a_100000183195_100000209964 [1,0,1,0,0,0|1,0,1]=4 343 B14R2.6 c1ccc(cc1)Nc2ncccn2 27a_100000106764_100000211032 [2,0,0,0,0,0|2,0,0]=4 344 B14R2.6 c1ccc(cc1)Sc2ncccn2 62a_100000211032_100000041952 [2,0,0,0,0,0|2,0,0]=4 345 B14R2.6 c1ccc(cc1)Sc2ncccn2 62a_100000719477_100000211032 [2,0,0,0,0,0|2,0,0]=4 346 B16R1.401 NC(=O)C(=O)NN=CCc1ccccc1Cl 4a_100000211141_200011713468 [0,1,1,0,0,0|0,0,2]=4 347 B16R1.401 NC(=O)C(=O)NN=CCc1ccccc1F 4a_100000211141_200000687578 [0,1,1,0,0,0|0,0,2]=4 348 B16R1.1062 Cc1ccc(cc1)CC=NNC(=O)C(=O)N 4a_100000211141_100011361684 [0,1,1,0,0,0|0,0,2]=4 349 B16R1.1062 NC(=O)C(=O)NN=CCc1ccc(cc1)Br 4a_100000211141_100011361690 [0,1,1,0,0,0|0,0,2]=4 350 B16R1.1062 NC(=O)C(=O)NN=CCc1ccc(cc1)Cl 4a_100000211141_100000730895 [0,1,1,0,0,0|0,0,2]=4 351 B16R1.1062 NC(=O)C(=O)NN=CCc1ccc(cc1)F 4a_100000211141_100000684651 [0,1,1,0,0,0|0,0,2]=4 352 B16R1.1635 COC(C)C(=O)NN=CCc1ccccc1 4a_100000243824_100000209964 [0,1,1,0,0,0|1,0,1]=4 353 B16R1.4129 CC(C=NNC(=O)C(=O)N)c1ccccc1 4a_100000211141_100000212034 [0,1,1,0,0,0|0,0,2]=4 354 B16R1.11228 NC(=O)C(=O)NN=CCc1cccc(c1)Br 4a_100000211141_200000698211 [0,1,1,0,0,0|0,0,2]=4 355 B16R1.11228 NC(=O)C(=O)NN=CCc1cccc(c1)Cl 4a_100000211141_100000765889 [0,1,1,0,0,0|0,0,2]=4 356 B16R1.11228 NC(=O)C(=O)NN=CCc1cccc(c1)F 4a_100000211141_100011713417 [0,1,1,0,0,0|0,0,2]=4 357 B16R2.2 O=Cc1cnc(nc1)Nc2ccccc2 27a_100000106764_100000070856 [1,1,0,0,0,0|2,0,0]=4 358 B16R2.2 O=Cc1cnc(nc1)Sc2ccccc2 62a_100000070856_100000041952 [1,1,0,0,0,0|2,0,0]=4 359 B16R2.2 O=Cc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000070856 [1,1,0,0,0,0|2,0,0]=4 360 B16R2.33 Cc1ccc(cc1)Sc2ccc(=O)[nH]n2 62a_100000186775_100009820020 [1,1,0,0,0,0|2,0,0]=4 361 B16R2.33 Cc1ccc(cc1)Sc2ccc(=O)[nH]n2 62a_100009820020_100000186775 [1,1,0,0,0,0|2,0,0]=4 362 B16R2.33 Nc1ccc(cc1)Sc2ccc(=O)[nH]n2 62a_100000185761_100009820020 [1,1,0,0,0,0|2,0,0]=4 363 B16R2.33 Nc1ccc(cc1)Sc2ccc(=O)[nH]n2 62a_100009820020_100000185761 [1,1,0,0,0,0|2,0,0]=4 364 B16R2.33 O=c1ccc(n[nH]1)Sc2ccc(cc2)Br 62a_100000752885_100009820020 [1,1,0,0,0,0|2,0,0]=4 365 B16R2.33 O=c1ccc(n[nH]1)Sc2ccc(cc2)Br 62a_100009820020_100000752885 [1,1,0,0,0,0|2,0,0]=4 366 B16R2.33 O=c1ccc(n[nH]1)Sc2ccc(cc2)Cl 62a_100000755918_100009820020 [1,1,0,0,0,0|2,0,0]=4 367 B16R2.33 O=c1ccc(n[nH]1)Sc2ccc(cc2)Cl 62a_100009820020_100000755918 [1,1,0,0,0,0|2,0,0]=4 368 B16R2.33 O=c1ccc(n[nH]1)Sc2ccc(cc2)F 62a_100000211213_100009820020 [1,1,0,0,0,0|2,0,0]=4 369 B16R2.33 O=c1ccc(n[nH]1)Sc2ccc(cc2)F 62a_100009820020_100000211213 [1,1,0,0,0,0|2,0,0]=4 370 B16R2.33 O=c1ccc(n[nH]1)Sc2ccc(cc2)O 62a_100009820020_100000185759 [1,1,0,0,0,0|2,0,0]=4 371 B16R2.120 C=C(c1ccccc1)c2ccc(=O)[nH]n2 271570a_100000068269_100009820020 [1,1,0,0,0,0|1,0,1]=4 372 B16R2.131 Cc1cccc(c1)Sc2ccc(=O)[nH]n2 62a_100009820020_100011215228 [1,1,0,0,0,0|2,0,0]=4 373 B16R2.131 Cc1cccc(c1)Sc2ccc(=O)[nH]n2 62a_100011215228_100009820020 [1,1,0,0,0,0|2,0,0]=4 374 B16R2.131 Nc1cccc(c1)Sc2ccc(=O)[nH]n2 62a_100000210019_100009820020 [1,1,0,0,0,0|2,0,0]=4 375 B16R2.131 Nc1cccc(c1)Sc2ccc(=O)[nH]n2 62a_100009820020_100000210019 [1,1,0,0,0,0|2,0,0]=4 376 B16R2.131 O=c1ccc(n[nH]1)Sc2cccc(c2)Br 62a_100000691529_100009820020 [1,1,0,0,0,0|2,0,0]=4 377 B16R2.131 O=c1ccc(n[nH]1)Sc2cccc(c2)Br 62a_100009820020_100000691529 [1,1,0,0,0,0|2,0,0]=4 378 B16R2.131 O=c1ccc(n[nH]1)Sc2cccc(c2)Cl 62a_100000699651_100009820020 [1,1,0,0,0,0|2,0,0]=4 379 B16R2.131 O=c1ccc(n[nH]1)Sc2cccc(c2)Cl 62a_100009820020_100000699651 [1,1,0,0,0,0|2,0,0]=4 380 B16R2.131 O=c1ccc(n[nH]1)Sc2cccc(c2)F 62a_100000685547_100009820020 [1,1,0,0,0,0|2,0,0]=4 381 B16R2.131 O=c1ccc(n[nH]1)Sc2cccc(c2)F 62a_100009820020_100000685547 [1,1,0,0,0,0|2,0,0]=4 382 B16R2.131 O=c1ccc(n[nH]1)Sc2cccc(c2)O 62a_100009820020_100000211634 [1,1,0,0,0,0|2,0,0]=4 383 B16R2.131 O=c1ccc(n[nH]1)Sc2cccc(c2)[S] 62a_100009820020_114929384022 [1,1,0,0,0,0|2,0,0]=4 384 B16R2.131 O=c1ccc(n[nH]1)Sc2cccc(c2)[S] 62a_114929384022_100009820020 [1,1,0,0,0,0|2,0,0]=4 385 B16R2.312 Cc1cc(=O)[nH]nc1Sc2ccccc2 62a_100000719477_100000081757 [1,1,0,0,0,0|2,0,0]=4 386 B16R2.1129 Cc1ccccc1Sc2ccc(=O)[nH]n2 62a_100000210755_100009820020 [1,1,0,0,0,0|2,0,0]=4 387 B16R2.1129 Cc1ccccc1Sc2ccc(=O)[nH]n2 62a_100009820020_100000210755 [1,1,0,0,0,0|2,0,0]=4 388 B16R2.1129 Nc1ccccc1Sc2ccc(=O)[nH]n2 62a_100000210017_100009820020 [1,1,0,0,0,0|2,0,0]=4 389 B16R2.1129 Nc1ccccc1Sc2ccc(=O)[nH]n2 62a_100009820020_100000210017 [1,1,0,0,0,0|2,0,0]=4 390 B16R2.1129 O=c1ccc(n[nH]1)Sc2ccccc2Br 62a_100000695589_100009820020 [1,1,0,0,0,0|2,0,0]=4 391 B16R2.1129 O=c1ccc(n[nH]1)Sc2ccccc2Br 62a_100009820020_100000695589 [1,1,0,0,0,0|2,0,0]=4 392 B16R2.1129 O=c1ccc(n[nH]1)Sc2ccccc2Cl 62a_100000764095_100009820020 [1,1,0,0,0,0|2,0,0]=4 393 B16R2.1129 O=c1ccc(n[nH]1)Sc2ccccc2Cl 62a_100009820020_100000764095 [1,1,0,0,0,0|2,0,0]=4 394 B16R2.1129 O=c1ccc(n[nH]1)Sc2ccccc2F 62a_100009820020_100011215700 [1,1,0,0,0,0|2,0,0]=4 395 B16R2.1129 O=c1ccc(n[nH]1)Sc2ccccc2F 62a_100011215700_100009820020 [1,1,0,0,0,0|2,0,0]=4 396 B16R2.1129 O=c1ccc(n[nH]1)Sc2ccccc2O 62a_100000739446_100009820020 [1,1,0,0,0,0|2,0,0]=4 397 B16R2.1129 O=c1ccc(n[nH]1)Sc2ccccc2O 62a_100009820020_100000739446 [1,1,0,0,0,0|2,0,0]=4 398 B16R2.23 COc1ccnc(n1)Nc2ccccc2 27a_100000106764_100000182009 [1,1,0,0,0,0|2,0,0]=4 399 B16R2.23 COc1ccnc(n1)Sc2ccccc2 62a_100000182009_100000041952 [1,1,0,0,0,0|2,0,0]=4 400 B16R2.23 COc1ccnc(n1)Sc2ccccc2 62a_100000719477_100000182009 [1,1,0,0,0,0|2,0,0]=4 401 B16R2.236 C=C(c1ccccc1)c2nccc(n2)O 271570a_100000068269_100011649813 [1,1,0,0,0,0|1,0,1]=4 402 B16R2.251 Cc1cccc(c1)Nc2nccc(n2)O 27a_100000188690_100011649813 [1,1,0,0,0,0|2,0,0]=4 403 B16R2.251 Cc1cccc(c1)Sc2nccc(n2)O 62a_100011215228_100011649813 [1,1,0,0,0,0|2,0,0]=4 404 B16R2.251 Nc1cccc(c1)Sc2nccc(n2)O 62a_100000210019_100011649813 [1,1,0,0,0,0|2,0,0]=4 405 B16R2.251 Oc1cccc(c1)Nc2nccc(n2)O 27a_100000210217_100011649813 [1,1,0,0,0,0|2,0,0]=4 406 B16R2.251 Oc1ccnc(n1)Nc2cccc(c2)Br 27a_100000210019_100011649813 [1,1,0,0,0,0|2,0,0]=4 407 B16R2.251 Oc1ccnc(n1)Nc2cccc(c2)Cl 27a_100000185859_100011649813 [1,1,0,0,0,0|2,0,0]=4 408 B16R2.251 Oc1ccnc(n1)Nc2cccc(c2)F 27a_100000210047_100011649813 [1,1,0,0,0,0|2,0,0]=4 409 B16R2.251 Oc1ccnc(n1)Nc2cccc(c2)I 27a_100000211102_100011649813 [1,1,0,0,0,0|2,0,0]=4 410 B16R2.251 Oc1ccnc(n1)Sc2cccc(c2)Br 62a_100000691529_100011649813 [1,1,0,0,0,0|2,0,0]=4 411 B16R2.251 Oc1ccnc(n1)Sc2cccc(c2)Cl 62a_100000699651_100011649813 [1,1,0,0,0,0|2,0,0]=4 412 B16R2.251 Oc1ccnc(n1)Sc2cccc(c2)F 62a_100000685547_100011649813 [1,1,0,0,0,0|2,0,0]=4 413 B16R2.251 Oc1ccnc(n1)Sc2cccc(c2)[S] 62a_114929384022_100011649813 [1,1,0,0,0,0|2,0,0]=4 414 B16R2.2923 Cc1ccccc1Nc2nccc(n2)O 27a_100015192222_100011649813 [1,1,0,0,0,0|2,0,0]=4 415 B16R2.2923 Cc1ccccc1Sc2nccc(n2)O 62a_100000210755_100011649813 [1,1,0,0,0,0|2,0,0]=4 416 B16R2.2923 Nc1ccccc1Sc2nccc(n2)O 62a_100000210017_100011649813 [1,1,0,0,0,0|2,0,0]=4 417 B16R2.2923 Oc1ccnc(n1)Nc2ccccc2Cl 27a_100000185783_100011649813 [1,1,0,0,0,0|2,0,0]=4 418 B16R2.2923 Oc1ccnc(n1)Nc2ccccc2F 27a_100000210422_100011649813 [1,1,0,0,0,0|2,0,0]=4 419 B16R2.2923 Oc1ccnc(n1)Nc2ccccc2I 27a_100000210053_100011649813 [1,1,0,0,0,0|2,0,0]=4 420 B16R2.2923 Oc1ccnc(n1)Nc2ccccc2O 27a_100000185747_100011649813 [1,1,0,0,0,0|2,0,0]=4 421 B16R2.2923 Oc1ccnc(n1)Sc2ccccc2Br 62a_100000695589_100011649813 [1,1,0,0,0,0|2,0,0]=4 422 B16R2.2923 Oc1ccnc(n1)Sc2ccccc2Cl 62a_100000764095_100011649813 [1,1,0,0,0,0|2,0,0]=4 423 B16R2.2923 Oc1ccnc(n1)Sc2ccccc2F 62a_100011215700_100011649813 [1,1,0,0,0,0|2,0,0]=4 424 B16R2.2923 Oc1ccnc(n1)Sc2ccccc2O 62a_100000739446_100011649813 [1,1,0,0,0,0|2,0,0]=4 425 B16R2.2321 COc1cc(c[nH]c1=O)c2ccccc2 271570a_100011218836_100010125397 [0,1,0,0,1,0|2,0,0]=4 426 B16R2.2321 COc1nc(ncc1C)c2ccccc2 271570a_100011218836_100012500371 [0,1,0,0,1,0|2,0,0]=4 427 B16R2.2321 COc1nc(ncc1F)c2ccccc2 271570a_100011218836_100012183945 [0,1,0,0,1,0|2,0,0]=4 428 B16R2.2321 COc1nc(ncc1N)c2ccccc2 271570a_100011218836_100012122185 [0,1,0,0,1,0|2,0,0]=4 429 B16R2.2864 Cc1cc(n[nH]c1=O)c2ccc(cc2)Br 271570a_100010235827_100012187101 [0,1,0,0,1,0|2,0,0]=4 430 B16R2.2864 Cc1cc(n[nH]c1=O)c2ccc(cc2)Cl 271570a_100011213355_100012187101 [0,1,0,0,1,0|2,0,0]=4 431 B16R2.2864 Cc1cc(n[nH]c1=O)c2ccc(cc2)F 271570a_100011934326_100012187101 [0,1,0,0,1,0|2,0,0]=4 432 B16R2.2864 Cc1cc(n[nH]c1=O)c2ccc(cc2)I 271570a_100000033156_100012187101 [0,1,0,0,1,0|2,0,0]=4 433 B16R2.2864 Cc1cc(n[nH]c1=O)c2ccc(cc2)N 271570a_100015188457_100012187101 [0,1,0,0,1,0|2,0,0]=4 434 B16R2.2864 Cc1cc(n[nH]c1=O)c2ccc(cc2)O 271570a_100015205159_100012187101 [0,1,0,0,1,0|2,0,0]=4 435 B16R2.2864 Cc1ccc(cc1)c2c[nH]c(=O)c(c2)O 271570a_100000708704_100009814561 [0,1,0,0,1,0|2,0,0]=4 436 B16R2.2864 Cc1ccc(cc1)c2c[nH]c(=O)c(n2)C 271570a_100000708704_100010363809 [0,1,0,0,1,0|2,0,0]=4 437 B16R2.2864 Cc1ccc(cc1)c2cc(c(=O)[nH]n2)C 271570a_100000708704_100012187101 [0,1,0,0,1,0|2,0,0]=4 438 B16R2.2864 Cc1ccc(cc1)c2cc(c(=O)[nH]n2)N 271570a_100000708704_100000102183 [0,1,0,0,1,0|2,0,0]=4 439 B16R2.2864 Cc1ccc(cc1)c2ncc(c(n2)O)F 271570a_100000708704_100011995740 [0,1,0,0,1,0|2,0,0]=4 440 B16R2.2864 Cc1nc(c[nH]c1=O)c2ccc(cc2)Br 271570a_100010235827_100010363809 [0,1,0,0,1,0|2,0,0]=4 441 B16R2.2864 Cc1nc(c[nH]c1=O)c2ccc(cc2)Cl 271570a_100011213355_100010363809 [0,1,0,0,1,0|2,0,0]=4 442 B16R2.2864 Cc1nc(c[nH]c1=O)c2ccc(cc2)F 271570a_100011934326_100010363809 [0,1,0,0,1,0|2,0,0]=4 443 B16R2.2864 Cc1nc(c[nH]c1=O)c2ccc(cc2)I 271570a_100000033156_100010363809 [0,1,0,0,1,0|2,0,0]=4 444 B16R2.2864 Cc1nc(c[nH]c1=O)c2ccc(cc2)N 271570a_100015188457_100010363809 [0,1,0,0,1,0|2,0,0]=4 445 B16R2.2864 Cc1nc(c[nH]c1=O)c2ccc(cc2)O 271570a_100015205159_100010363809 [0,1,0,0,1,0|2,0,0]=4 446 B16R2.2864 Nc1cc(n[nH]c1=O)c2ccc(cc2)Br 271570a_100010235827_100000102183 [0,1,0,0,1,0|2,0,0]=4 447 B16R2.2864 Nc1cc(n[nH]c1=O)c2ccc(cc2)Cl 271570a_100011213355_100000102183 [0,1,0,0,1,0|2,0,0]=4 448 B16R2.2864 Nc1cc(n[nH]c1=O)c2ccc(cc2)F 271570a_100011934326_100000102183 [0,1,0,0,1,0|2,0,0]=4 449 B16R2.2864 Nc1cc(n[nH]c1=O)c2ccc(cc2)I 271570a_100000033156_100000102183 [0,1,0,0,1,0|2,0,0]=4 450 B16R2.2864 Nc1cc(n[nH]c1=O)c2ccc(cc2)O 271570a_100015205159_100000102183 [0,1,0,0,1,0|2,0,0]=4 451 B16R2.2864 Nc1ccc(cc1)c2c[nH]c(=O)c(c2)O 271570a_100015188457_100009814561 [0,1,0,0,1,0|2,0,0]=4 452 B16R2.2864 Nc1ccc(cc1)c2cc(c(=O)[nH]n2)N 271570a_100015188457_100000102183 [0,1,0,0,1,0|2,0,0]=4 453 B16R2.2864 Nc1ccc(cc1)c2ncc(c(n2)O)F 271570a_100015188457_100011995740 [0,1,0,0,1,0|2,0,0]=4 454 B16R2.2864 O=c1[nH]cc(cc1O)c2ccc(cc2)Br 271570a_100010235827_100009814561 [0,1,0,0,1,0|2,0,0]=4 455 B16R2.2864 O=c1[nH]cc(cc1O)c2ccc(cc2)Cl 271570a_100011213355_100009814561 [0,1,0,0,1,0|2,0,0]=4 456 B16R2.2864 O=c1[nH]cc(cc1O)c2ccc(cc2)F 271570a_100011934326_100009814561 [0,1,0,0,1,0|2,0,0]=4 457 B16R2.2864 O=c1[nH]cc(cc1O)c2ccc(cc2)I 271570a_100000033156_100009814561 [0,1,0,0,1,0|2,0,0]=4 458 B16R2.2864 O=c1[nH]cc(cc1O)c2ccc(cc2)O 271570a_100015205159_100009814561 [0,1,0,0,1,0|2,0,0]=4 459 B16R2.2864 Oc1ccc(cc1)c2ncc(c(n2)O)F 271570a_100015205159_100011995740 [0,1,0,0,1,0|2,0,0]=4 460 B16R2.2864 Oc1nc(ncc1F)c2ccc(cc2)Br 271570a_100010235827_100011995740 [0,1,0,0,1,0|2,0,0]=4 461 B16R2.2864 Oc1nc(ncc1F)c2ccc(cc2)Cl 271570a_100011213355_100011995740 [0,1,0,0,1,0|2,0,0]=4 462 B16R2.2864 Oc1nc(ncc1F)c2ccc(cc2)F 271570a_100011934326_100011995740 [0,1,0,0,1,0|2,0,0]=4 463 B16R2.2864 Oc1nc(ncc1F)c2ccc(cc2)I 271570a_100000033156_100011995740 [0,1,0,0,1,0|2,0,0]=4 464 B16R2.2917 Cc1cc(n[nH]c1=O)c2cccc(c2)Cl 271570a_100011214927_100012187101 [0,1,0,0,1,0|2,0,0]=4 465 B16R2.2917 Cc1cc(n[nH]c1=O)c2cccc(c2)F 271570a_100012349223_100012187101 [0,1,0,0,1,0|2,0,0]=4 466 B16R2.2917 Cc1cc(n[nH]c1=O)c2cccc(c2)I 271570a_100000043368_100012187101 [0,1,0,0,1,0|2,0,0]=4 467 B16R2.2917 Cc1cc(n[nH]c1=O)c2cccc(c2)N 271570a_100000699968_100012187101 [0,1,0,0,1,0|2,0,0]=4 468 B16R2.2917 Cc1cc(n[nH]c1=O)c2cccc(c2)O 271570a_100000693801_100012187101 [0,1,0,0,1,0|2,0,0]=4 469 B16R2.2917 Cc1cccc(c1)c2c[nH]c(=O)c(c2)O 271570a_100000749446_100009814561 [0,1,0,0,1,0|2,0,0]=4 470 B16R2.2917 Cc1cccc(c1)c2c[nH]c(=O)c(n2)C 271570a_100000749446_100010363809 [0,1,0,0,1,0|2,0,0]=4 471 B16R2.2917 Cc1cccc(c1)c2cc(c(=O)[nH]n2)C 271570a_100000749446_100012187101 [0,1,0,0,1,0|2,0,0]=4 472 B16R2.2917 Cc1cccc(c1)c2cc(c(=O)[nH]n2)N 271570a_100000749446_100000102183 [0,1,0,0,1,0|2,0,0]=4 473 B16R2.2917 Cc1cccc(c1)c2ncc(c(n2)O)F 271570a_100000749446_100011995740 [0,1,0,0,1,0|2,0,0]=4 474 B16R2.2917 Cc1nc(c[nH]c1=O)c2cccc(c2)Cl 271570a_100011214927_100010363809 [0,1,0,0,1,0|2,0,0]=4 475 B16R2.2917 Cc1nc(c[nH]c1=O)c2cccc(c2)F 271570a_100012349223_100010363809 [0,1,0,0,1,0|2,0,0]=4 476 B16R2.2917 Cc1nc(c[nH]c1=O)c2cccc(c2)I 271570a_100000043368_100010363809 [0,1,0,0,1,0|2,0,0]=4 477 B16R2.2917 Cc1nc(c[nH]c1=O)c2cccc(c2)N 271570a_100000699968_100010363809 [0,1,0,0,1,0|2,0,0]=4 478 B16R2.2917 Cc1nc(c[nH]c1=O)c2cccc(c2)O 271570a_100000693801_100010363809 [0,1,0,0,1,0|2,0,0]=4 479 B16R2.2917 Nc1cc(n[nH]c1=O)c2cccc(c2)Cl 271570a_100011214927_100000102183 [0,1,0,0,1,0|2,0,0]=4 480 B16R2.2917 Nc1cc(n[nH]c1=O)c2cccc(c2)F 271570a_100012349223_100000102183 [0,1,0,0,1,0|2,0,0]=4 481 B16R2.2917 Nc1cc(n[nH]c1=O)c2cccc(c2)I 271570a_100000043368_100000102183 [0,1,0,0,1,0|2,0,0]=4 482 B16R2.2917 Nc1cc(n[nH]c1=O)c2cccc(c2)O 271570a_100000693801_100000102183 [0,1,0,0,1,0|2,0,0]=4 483 B16R2.2917 Nc1cccc(c1)c2c[nH]c(=O)c(c2)O 271570a_100000699968_100009814561 [0,1,0,0,1,0|2,0,0]=4 484 B16R2.2917 Nc1cccc(c1)c2cc(c(=O)[nH]n2)N 271570a_100000699968_100000102183 [0,1,0,0,1,0|2,0,0]=4 485 B16R2.2917 Nc1cccc(c1)c2ncc(c(n2)O)F 271570a_100000699968_100011995740 [0,1,0,0,1,0|2,0,0]=4 486 B16R2.2917 O=c1[nH]cc(cc1O)c2cccc(c2)Cl 271570a_100011214927_100009814561 [0,1,0,0,1,0|2,0,0]=4 487 B16R2.2917 O=c1[nH]cc(cc1O)c2cccc(c2)F 271570a_100012349223_100009814561 [0,1,0,0,1,0|2,0,0]=4 488 B16R2.2917 O=c1[nH]cc(cc1O)c2cccc(c2)I 271570a_100000043368_100009814561 [0,1,0,0,1,0|2,0,0]=4 489 B16R2.2917 O=c1[nH]cc(cc1O)c2cccc(c2)O 271570a_100000693801_100009814561 [0,1,0,0,1,0|2,0,0]=4 490 B16R2.2917 Oc1cccc(c1)c2ncc(c(n2)O)F 271570a_100000693801_100011995740 [0,1,0,0,1,0|2,0,0]=4 491 B16R2.2917 Oc1nc(ncc1F)c2cccc(c2)Cl 271570a_100011214927_100011995740 [0,1,0,0,1,0|2,0,0]=4 492 B16R2.2917 Oc1nc(ncc1F)c2cccc(c2)F 271570a_100012349223_100011995740 [0,1,0,0,1,0|2,0,0]=4 493 B16R2.2917 Oc1nc(ncc1F)c2cccc(c2)I 271570a_100000043368_100011995740 [0,1,0,0,1,0|2,0,0]=4 494 B16R2.3269 Cc1cc(n[nH]c1=O)c2ccccc2Cl 271570a_100011934419_100012187101 [0,1,0,0,1,0|2,0,0]=4 495 B16R2.3269 Cc1cc(n[nH]c1=O)c2ccccc2F 271570a_100000761933_100012187101 [0,1,0,0,1,0|2,0,0]=4 496 B16R2.3269 Cc1cc(n[nH]c1=O)c2ccccc2I 271570a_100000069755_100012187101 [0,1,0,0,1,0|2,0,0]=4 497 B16R2.3269 Cc1cc(n[nH]c1=O)c2ccccc2N 271570a_100000034411_100012187101 [0,1,0,0,1,0|2,0,0]=4 498 B16R2.3269 Cc1cc(n[nH]c1=O)c2ccccc2O 271570a_100000035170_100012187101 [0,1,0,0,1,0|2,0,0]=4 499 B16R2.3269 Cc1ccccc1c2c[nH]c(=O)c(c2)O 271570a_100000747142_100009814561 [0,1,0,0,1,0|2,0,0]=4 500 B16R2.3269 Cc1ccccc1c2c[nH]c(=O)c(n2)C 271570a_100000747142_100010363809 [0,1,0,0,1,0|2,0,0]=4 501 B16R2.3269 Cc1ccccc1c2cc(c(=O)[nH]n2)C 271570a_100000747142_100012187101 [0,1,0,0,1,0|2,0,0]=4 502 B16R2.3269 Cc1ccccc1c2cc(c(=O)[nH]n2)N 271570a_100000747142_100000102183 [0,1,0,0,1,0|2,0,0]=4 503 B16R2.3269 Cc1ccccc1c2ncc(c(n2)O)F 271570a_100000747142_100011995740 [0,1,0,0,1,0|2,0,0]=4 504 B16R2.3269 Cc1nc(c[nH]c1=O)c2ccccc2Cl 271570a_100011934419_100010363809 [0,1,0,0,1,0|2,0,0]=4 505 B16R2.3269 Cc1nc(c[nH]c1=O)c2ccccc2F 271570a_100000761933_100010363809 [0,1,0,0,1,0|2,0,0]=4 506 B16R2.3269 Cc1nc(c[nH]c1=O)c2ccccc2I 271570a_100000069755_100010363809 [0,1,0,0,1,0|2,0,0]=4 507 B16R2.3269 Cc1nc(c[nH]c1=O)c2ccccc2N 271570a_100000034411_100010363809 [0,1,0,0,1,0|2,0,0]=4 508 B16R2.3269 Cc1nc(c[nH]c1=O)c2ccccc2O 271570a_100000035170_100010363809 [0,1,0,0,1,0|2,0,0]=4 509 B16R2.3269 Nc1cc(n[nH]c1=O)c2ccccc2Cl 271570a_100011934419_100000102183 [0,1,0,0,1,0|2,0,0]=4 510 B16R2.3269 Nc1cc(n[nH]c1=O)c2ccccc2F 271570a_100000761933_100000102183 [0,1,0,0,1,0|2,0,0]=4 511 B16R2.3269 Nc1cc(n[nH]c1=O)c2ccccc2I 271570a_100000069755_100000102183 [0,1,0,0,1,0|2,0,0]=4 512 B16R2.3269 Nc1cc(n[nH]c1=O)c2ccccc2O 271570a_100000035170_100000102183 [0,1,0,0,1,0|2,0,0]=4 513 B16R2.3269 Nc1ccccc1c2c[nH]c(=O)c(c2)O 271570a_100000034411_100009814561 [0,1,0,0,1,0|2,0,0]=4 514 B16R2.3269 Nc1ccccc1c2cc(c(=O)[nH]n2)N 271570a_100000034411_100000102183 [0,1,0,0,1,0|2,0,0]=4 515 B16R2.3269 Nc1ccccc1c2ncc(c(n2)O)F 271570a_100000034411_100011995740 [0,1,0,0,1,0|2,0,0]=4 516 B16R2.3269 O=c1[nH]cc(cc1O)c2ccccc2Cl 271570a_100011934419_100009814561 [0,1,0,0,1,0|2,0,0]=4 517 B16R2.3269 O=c1[nH]cc(cc1O)c2ccccc2F 271570a_100000761933_100009814561 [0,1,0,0,1,0|2,0,0]=4 518 B16R2.3269 O=c1[nH]cc(cc1O)c2ccccc2I 271570a_100000069755_100009814561 [0,1,0,0,1,0|2,0,0]=4 519 B16R2.3269 O=c1[nH]cc(cc1O)c2ccccc2O 271570a_100000035170_100009814561 [0,1,0,0,1,0|2,0,0]=4 520 B16R2.3269 Oc1ccccc1c2ncc(c(n2)O)F 271570a_100000035170_100011995740 [0,1,0,0,1,0|2,0,0]=4 521 B16R2.3269 Oc1nc(ncc1F)c2ccccc2Cl 271570a_100011934419_100011995740 [0,1,0,0,1,0|2,0,0]=4 522 B16R2.3269 Oc1nc(ncc1F)c2ccccc2F 271570a_100000761933_100011995740 [0,1,0,0,1,0|2,0,0]=4 523 B16R2.3269 Oc1nc(ncc1F)c2ccccc2I 271570a_100000069755_100011995740 [0,1,0,0,1,0|2,0,0]=4 524 B16R2.22304 Cc1cc(nn(c1=O)C)c2ccccc2 271570a_100011218836_100010988966 [0,1,0,0,1,0|2,0,0]=4 525 B18R2.249 CC(Cc1c[nH]c(=O)c(c1)O)c2ccccc2 271570a_100000062452_100009814561 [0,1,0,0,0,1|2,0,0]=4 526 B18R2.249 CC(Cc1cc(c(=O)[nH]n1)N)c2ccccc2 271570a_100000062452_100000102183 [0,1,0,0,0,1|2,0,0]=4 527 B18R2.249 CC(Cc1ncc(c(n1)O)F)c2ccccc2 271570a_100000062452_100011995740 [0,1,0,0,0,1|2,0,0]=4 528 B18R2.249 CC(Sc1c[nH]c(=O)c(c1)O)c2ccccc2 62a_100000230085_100009814561 [0,1,0,0,0,1|2,0,0]=4 529 B18R2.249 CC(Sc1cc(c(=O)[nH]n1)N)c2ccccc2 62a_100000230085_100000102183 [0,1,0,0,0,1|2,0,0]=4 530 B18R2.249 CC(Sc1ncc(c(n1)O)F)c2ccccc2 62a_100000230085_100011995740 [0,1,0,0,0,1|2,0,0]=4 531 B18R2.249 C[C@@H](Nc1ncc(c(n1)O)F)c2ccccc2 27a_100000751104_100011995740 [0,1,0,0,0,1|2,0,0]=4 532 B18R2.249 Cc1cc(n[nH]c1=O)CC(C)c2ccccc2 271570a_100000062452_100012187101 [0,1,0,0,0,1|2,0,0]=4 533 B18R2.249 Cc1cc(n[nH]c1=O)SC(C)c2ccccc2 62a_100000230085_100012187101 [0,1,0,0,0,1|2,0,0]=4 534 B18R2.249 Cc1nc(c[nH]c1=O)CC(C)c2ccccc2 271570a_100000062452_100010363809 [0,1,0,0,0,1|2,0,0]=4 535 B18R2.249 Cc1nc(c[nH]c1=O)SC(C)c2ccccc2 62a_100000230085_100010363809 [0,1,0,0,0,1|2,0,0]=4 536 B18R2.249 Cc1nc(c[nH]c1=O)SC(C)c2ccccc2 62a_100010363809_100000230085 [0,1,0,0,0,1|2,0,0]=4 537 B18R2.276 CN(Cc1ccccc1)c2ncc(c(n2)O)F 27a_100000186898_100011995740 [0,1,0,0,0,1|2,0,0]=4 538 B18R2.2562 Nc1nc(ncc1C=O)SCc2ccccc2 62a_100000211182_100010726233 [0,1,0,0,0,1|2,0,0]=4 539 B18R2.2562 Nc1nc(ncc1C=O)SCc2ccccc2 62a_100010726233_100015291786 [0,1,0,0,0,1|2,0,0]=4 540 B18R2.2686 COc1cc(c[nH]c1=O)SCc2ccccc2 62a_100000211182_100010125397 [0,1,0,0,0,1|2,0,0]=4 541 B18R2.2686 COc1nc(ncc1C)NCc2ccccc2 27a_100015324214_100012500371 [0,1,0,0,0,1|2,0,0]=4 542 B18R2.2686 COc1nc(ncc1C)SCc2ccccc2 62a_100000211182_100012500371 [0,1,0,0,0,1|2,0,0]=4 543 B18R2.2686 COc1nc(ncc1C)SCc2ccccc2 62a_100012500371_100015291786 [0,1,0,0,0,1|2,0,0]=4 544 B18R2.2686 COc1nc(ncc1F)SCc2ccccc2 62a_100000211182_100012183945 [0,1,0,0,0,1|2,0,0]=4 545 B18R2.2686 COc1nc(ncc1F)SCc2ccccc2 62a_100012183945_100015291786 [0,1,0,0,0,1|2,0,0]=4 546 B18R2.2686 COc1nc(ncc1N)NCc2ccccc2 27a_100015324214_100012122185 [0,1,0,0,0,1|2,0,0]=4 547 B18R2.2686 COc1nc(ncc1N)SCc2ccccc2 62a_100000211182_100012122185 [0,1,0,0,0,1|2,0,0]=4 548 B18R2.2686 COc1nc(ncc1N)SCc2ccccc2 62a_100012122185_100015291786 [0,1,0,0,0,1|2,0,0]=4 549 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)Br 62a_100000189115_100012187101 [0,1,0,0,0,1|2,0,0]=4 550 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)Cl 62a_100000187161_100012187101 [0,1,0,0,0,1|2,0,0]=4 551 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)F 62a_100000198546_100012187101 [0,1,0,0,0,1|2,0,0]=4 552 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)I 62a_100000189116_100012187101 [0,1,0,0,0,1|2,0,0]=4 553 B18R2.9259 Cc1ccc(cc1)CNc2ncc(c(n2)O)F 27a_100000174908_100011995740 [0,1,0,0,0,1|2,0,0]=4 554 B18R2.9259 Cc1ccc(cc1)CSc2c[nH]c(=O)c(c2)O 62a_100000210814_100009814561 [0,1,0,0,0,1|2,0,0]=4 555 B18R2.9259 Cc1ccc(cc1)CSc2c[nH]c(=O)c(n2)C 62a_100000210814_100010363809 [0,1,0,0,0,1|2,0,0]=4 556 B18R2.9259 Cc1ccc(cc1)CSc2c[nH]c(=O)c(n2)C 62a_100010363809_100000210814 [0,1,0,0,0,1|2,0,0]=4 557 B18R2.9259 Cc1ccc(cc1)CSc2cc(c(=O)[nH]n2)C 62a_100000210814_100012187101 [0,1,0,0,0,1|2,0,0]=4 558 B18R2.9259 Cc1ccc(cc1)CSc2cc(c(=O)[nH]n2)N 62a_100000210814_100000102183 [0,1,0,0,0,1|2,0,0]=4 559 B18R2.9259 Cc1ccc(cc1)CSc2ncc(c(n2)O)F 62a_100000210814_100011995740 [0,1,0,0,0,1|2,0,0]=4 560 B18R2.9259 Cc1nc(c[nH]c1=O)SCc2ccc(cc2)Br 62a_100000189115_100010363809 [0,1,0,0,0,1|2,0,0]=4 561 B18R2.9259 Cc1nc(c[nH]c1=O)SCc2ccc(cc2)Br 62a_100010363809_100000189115 [0,1,0,0,0,1|2,0,0]=4 562 B18R2.9259 Cc1nc(c[nH]c1=O)SCc2ccc(cc2)Cl 62a_100000187161_100010363809 [0,1,0,0,0,1|2,0,0]=4 563 B18R2.9259 Cc1nc(c[nH]c1=O)SCc2ccc(cc2)Cl 62a_100010363809_100000187161 [0,1,0,0,0,1|2,0,0]=4 564 B18R2.9259 Cc1nc(c[nH]c1=O)SCc2ccc(cc2)F 62a_100000198546_100010363809 [0,1,0,0,0,1|2,0,0]=4 565 B18R2.9259 Cc1nc(c[nH]c1=O)SCc2ccc(cc2)F 62a_100010363809_100000187164 [0,1,0,0,0,1|2,0,0]=4 566 B18R2.9259 Cc1nc(c[nH]c1=O)SCc2ccc(cc2)I 62a_100000189116_100010363809 [0,1,0,0,0,1|2,0,0]=4 567 B18R2.9259 Cc1nc(c[nH]c1=O)SCc2ccc(cc2)I 62a_100010363809_100000189116 [0,1,0,0,0,1|2,0,0]=4 568 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)Br 62a_100000189115_100000102183 [0,1,0,0,0,1|2,0,0]=4 569 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)Cl 62a_100000187161_100000102183 [0,1,0,0,0,1|2,0,0]=4 570 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)F 62a_100000198546_100000102183 [0,1,0,0,0,1|2,0,0]=4 571 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)I 62a_100000189116_100000102183 [0,1,0,0,0,1|2,0,0]=4 572 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)Br 62a_100000189115_100009814561 [0,1,0,0,0,1|2,0,0]=4 573 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)Cl 62a_100000187161_100009814561 [0,1,0,0,0,1|2,0,0]=4 574 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)F 62a_100000198546_100009814561 [0,1,0,0,0,1|2,0,0]=4 575 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)I 62a_100000189116_100009814561 [0,1,0,0,0,1|2,0,0]=4 576 B18R2.9259 Oc1ccc(cc1)CNc2ncc(c(n2)O)F 27a_100000185549_100011995740 [0,1,0,0,0,1|2,0,0]=4 577 B18R2.9259 Oc1nc(ncc1F)NCc2ccc(cc2)Br 27a_100000174875_100011995740 [0,1,0,0,0,1|2,0,0]=4 578 B18R2.9259 Oc1nc(ncc1F)NCc2ccc(cc2)Cl 27a_100000174871_100011995740 [0,1,0,0,0,1|2,0,0]=4 579 B18R2.9259 Oc1nc(ncc1F)NCc2ccc(cc2)F 27a_100000174882_100011995740 [0,1,0,0,0,1|2,0,0]=4 580 B18R2.9259 Oc1nc(ncc1F)NCc2ccc(cc2)I 27a_100016989417_100011995740 [0,1,0,0,0,1|2,0,0]=4 581 B18R2.9259 Oc1nc(ncc1F)SCc2ccc(cc2)Br 62a_100000189115_100011995740 [0,1,0,0,0,1|2,0,0]=4 582 B18R2.9259 Oc1nc(ncc1F)SCc2ccc(cc2)Cl 62a_100000187161_100011995740 [0,1,0,0,0,1|2,0,0]=4 583 B18R2.9259 Oc1nc(ncc1F)SCc2ccc(cc2)F 62a_100000198546_100011995740 [0,1,0,0,0,1|2,0,0]=4 584 B18R2.9259 Oc1nc(ncc1F)SCc2ccc(cc2)I 62a_100000189116_100011995740 [0,1,0,0,0,1|2,0,0]=4 585 B18R2.38706 Cc1cc(nn(c1=O)C)SCc2ccccc2 62a_100000211182_100010988966 [0,1,0,0,0,1|2,0,0]=4 586 B18R2.38706 Cc1cc(nn(c1=O)C)SCc2ccccc2 62a_100010988966_100015291786 [0,1,0,0,0,1|2,0,0]=4 587 B18R2.39765 Cc1cc(n[nH]c1=O)SCc2ccccc2Br 62a_100000184730_100012187101 [0,1,0,0,0,1|2,0,0]=4 588 B18R2.39765 Cc1cc(n[nH]c1=O)SCc2ccccc2Cl 62a_100000187162_100012187101 [0,1,0,0,0,1|2,0,0]=4 589 B18R2.39765 Cc1cc(n[nH]c1=O)SCc2ccccc2F 62a_100000211605_100012187101 [0,1,0,0,0,1|2,0,0]=4 590 B18R2.39765 Cc1cc(n[nH]c1=O)SCc2ccccc2I 62a_100011216222_100012187101 [0,1,0,0,0,1|2,0,0]=4 591 B18R2.39765 Cc1ccccc1CNc2ncc(c(n2)O)F 27a_100000174972_100011995740 [0,1,0,0,0,1|2,0,0]=4 592 B18R2.39765 Cc1ccccc1CSc2c[nH]c(=O)c(c2)O 62a_100000211839_100009814561 [0,1,0,0,0,1|2,0,0]=4 593 B18R2.39765 Cc1ccccc1CSc2c[nH]c(=O)c(n2)C 62a_100000211839_100010363809 [0,1,0,0,0,1|2,0,0]=4 594 B18R2.39765 Cc1ccccc1CSc2c[nH]c(=O)c(n2)C 62a_100010363809_100000211839 [0,1,0,0,0,1|2,0,0]=4 595 B18R2.39765 Cc1ccccc1CSc2cc(c(=O)[nH]n2)C 62a_100000211839_100012187101 [0,1,0,0,0,1|2,0,0]=4 596 B18R2.39765 Cc1ccccc1CSc2cc(c(=O)[nH]n2)N 62a_100000211839_100000102183 [0,1,0,0,0,1|2,0,0]=4 597 B18R2.39765 Cc1ccccc1CSc2ncc(c(n2)O)F 62a_100000211839_100011995740 [0,1,0,0,0,1|2,0,0]=4 598 B18R2.39765 Cc1nc(c[nH]c1=O)SCc2ccccc2Br 62a_100000184730_100010363809 [0,1,0,0,0,1|2,0,0]=4 599 B18R2.39765 Cc1nc(c[nH]c1=O)SCc2ccccc2Br 62a_100010363809_100000184730 [0,1,0,0,0,1|2,0,0]=4 600 B18R2.39765 Cc1nc(c[nH]c1=O)SCc2ccccc2Cl 62a_100000187162_100010363809 [0,1,0,0,0,1|2,0,0]=4 601 B18R2.39765 Cc1nc(c[nH]c1=O)SCc2ccccc2Cl 62a_100010363809_100000187162 [0,1,0,0,0,1|2,0,0]=4 602 B18R2.39765 Cc1nc(c[nH]c1=O)SCc2ccccc2F 62a_100000211605_100010363809 [0,1,0,0,0,1|2,0,0]=4 603 B18R2.39765 Cc1nc(c[nH]c1=O)SCc2ccccc2F 62a_100010363809_100000211605 [0,1,0,0,0,1|2,0,0]=4 604 B18R2.39765 Cc1nc(c[nH]c1=O)SCc2ccccc2I 62a_100010363809_100011216222 [0,1,0,0,0,1|2,0,0]=4 605 B18R2.39765 Cc1nc(c[nH]c1=O)SCc2ccccc2I 62a_100011216222_100010363809 [0,1,0,0,0,1|2,0,0]=4 606 B18R2.39765 Nc1cc(n[nH]c1=O)SCc2ccccc2Br 62a_100000184730_100000102183 [0,1,0,0,0,1|2,0,0]=4 607 B18R2.39765 Nc1cc(n[nH]c1=O)SCc2ccccc2Cl 62a_100000187162_100000102183 [0,1,0,0,0,1|2,0,0]=4 608 B18R2.39765 Nc1cc(n[nH]c1=O)SCc2ccccc2F 62a_100000211605_100000102183 [0,1,0,0,0,1|2,0,0]=4 609 B18R2.39765 Nc1cc(n[nH]c1=O)SCc2ccccc2I 62a_100011216222_100000102183 [0,1,0,0,0,1|2,0,0]=4 610 B18R2.39765 O=c1[nH]cc(cc1O)SCc2ccccc2Br 62a_100000184730_100009814561 [0,1,0,0,0,1|2,0,0]=4 611 B18R2.39765 O=c1[nH]cc(cc1O)SCc2ccccc2Cl 62a_100000187162_100009814561 [0,1,0,0,0,1|2,0,0]=4 612 B18R2.39765 O=c1[nH]cc(cc1O)SCc2ccccc2F 62a_100000211605_100009814561 [0,1,0,0,0,1|2,0,0]=4 613 B18R2.39765 O=c1[nH]cc(cc1O)SCc2ccccc2I 62a_100011216222_100009814561 [0,1,0,0,0,1|2,0,0]=4 614 B18R2.39765 Oc1ccccc1CNc2ncc(c(n2)O)F 27a_100000185550_100011995740 [0,1,0,0,0,1|2,0,0]=4 615 B18R2.39765 Oc1nc(ncc1F)NCc2ccccc2Br 27a_100000689332_100011995740 [0,1,0,0,0,1|2,0,0]=4 616 B18R2.39765 Oc1nc(ncc1F)NCc2ccccc2Cl 27a_100000174879_100011995740 [0,1,0,0,0,1|2,0,0]=4 617 B18R2.39765 Oc1nc(ncc1F)NCc2ccccc2F 27a_100000174869_100011995740 [0,1,0,0,0,1|2,0,0]=4 618 B18R2.39765 Oc1nc(ncc1F)NCc2ccccc2I 27a_100015347259_100011995740 [0,1,0,0,0,1|2,0,0]=4 619 B18R2.39765 Oc1nc(ncc1F)SCc2ccccc2Br 62a_100000184730_100011995740 [0,1,0,0,0,1|2,0,0]=4 620 B18R2.39765 Oc1nc(ncc1F)SCc2ccccc2Cl 62a_100000187162_100011995740 [0,1,0,0,0,1|2,0,0]=4 621 B18R2.39765 Oc1nc(ncc1F)SCc2ccccc2F 62a_100000211605_100011995740 [0,1,0,0,0,1|2,0,0]=4 622 B18R2.39765 Oc1nc(ncc1F)SCc2ccccc2I 62a_100011216222_100011995740 [0,1,0,0,0,1|2,0,0]=4 623 B18R2.65908 Cc1cc(n[nH]c1=O)SCc2cccc(c2)Br 62a_100000211773_100012187101 [0,1,0,0,0,1|2,0,0]=4 624 B18R2.65908 Cc1cc(n[nH]c1=O)SCc2cccc(c2)Cl 62a_100000187163_100012187101 [0,1,0,0,0,1|2,0,0]=4 625 B18R2.65908 Cc1cc(n[nH]c1=O)SCc2cccc(c2)F 62a_100000230114_100012187101 [0,1,0,0,0,1|2,0,0]=4 626 B18R2.65908 Cc1cc(n[nH]c1=O)SCc2cccc(c2)I 62a_100011218688_100012187101 [0,1,0,0,0,1|2,0,0]=4 627 B18R2.65908 Cc1cc(n[nH]c1=O)SCc2cccc(c2)O 62a_100011660834_100012187101 [0,1,0,0,0,1|2,0,0]=4 628 B18R2.65908 Cc1cccc(c1)CNc2ncc(c(n2)O)F 27a_100000185548_100011995740 [0,1,0,0,0,1|2,0,0]=4 629 B18R2.65908 Cc1cccc(c1)CSc2c[nH]c(=O)c(c2)O 62a_100000211840_100009814561 [0,1,0,0,0,1|2,0,0]=4 630 B18R2.65908 Cc1cccc(c1)CSc2c[nH]c(=O)c(n2)C 62a_100000211840_100010363809 [0,1,0,0,0,1|2,0,0]=4 631 B18R2.65908 Cc1cccc(c1)CSc2c[nH]c(=O)c(n2)C 62a_100010363809_100000211840 [0,1,0,0,0,1|2,0,0]=4 632 B18R2.65908 Cc1cccc(c1)CSc2cc(c(=O)[nH]n2)C 62a_100000211840_100012187101 [0,1,0,0,0,1|2,0,0]=4 633 B18R2.65908 Cc1cccc(c1)CSc2cc(c(=O)[nH]n2)N 62a_100000211840_100000102183 [0,1,0,0,0,1|2,0,0]=4 634 B18R2.65908 Cc1cccc(c1)CSc2ncc(c(n2)O)F 62a_100000211840_100011995740 [0,1,0,0,0,1|2,0,0]=4 635 B18R2.65908 Cc1nc(c[nH]c1=O)SCc2cccc(c2)Br 62a_100000211773_100010363809 [0,1,0,0,0,1|2,0,0]=4 636 B18R2.65908 Cc1nc(c[nH]c1=O)SCc2cccc(c2)Br 62a_100010363809_100000211773 [0,1,0,0,0,1|2,0,0]=4 637 B18R2.65908 Cc1nc(c[nH]c1=O)SCc2cccc(c2)Cl 62a_100000187163_100010363809 [0,1,0,0,0,1|2,0,0]=4 638 B18R2.65908 Cc1nc(c[nH]c1=O)SCc2cccc(c2)Cl 62a_100010363809_100000187163 [0,1,0,0,0,1|2,0,0]=4 639 B18R2.65908 Cc1nc(c[nH]c1=O)SCc2cccc(c2)F 62a_100000230114_100010363809 [0,1,0,0,0,1|2,0,0]=4 640 B18R2.65908 Cc1nc(c[nH]c1=O)SCc2cccc(c2)F 62a_100010363809_100000230114 [0,1,0,0,0,1|2,0,0]=4 641 B18R2.65908 Cc1nc(c[nH]c1=O)SCc2cccc(c2)I 62a_100010363809_100011218688 [0,1,0,0,0,1|2,0,0]=4 642 B18R2.65908 Cc1nc(c[nH]c1=O)SCc2cccc(c2)I 62a_100011218688_100010363809 [0,1,0,0,0,1|2,0,0]=4 643 B18R2.65908 Cc1nc(c[nH]c1=O)SCc2cccc(c2)O 62a_100010363809_100011660834 [0,1,0,0,0,1|2,0,0]=4 644 B18R2.65908 Cc1nc(c[nH]c1=O)SCc2cccc(c2)O 62a_100011660834_100010363809 [0,1,0,0,0,1|2,0,0]=4 645 B18R2.65908 Nc1cc(n[nH]c1=O)SCc2cccc(c2)Br 62a_100000211773_100000102183 [0,1,0,0,0,1|2,0,0]=4 646 B18R2.65908 Nc1cc(n[nH]c1=O)SCc2cccc(c2)Cl 62a_100000187163_100000102183 [0,1,0,0,0,1|2,0,0]=4 647 B18R2.65908 Nc1cc(n[nH]c1=O)SCc2cccc(c2)F 62a_100000230114_100000102183 [0,1,0,0,0,1|2,0,0]=4 648 B18R2.65908 Nc1cc(n[nH]c1=O)SCc2cccc(c2)I 62a_100011218688_100000102183 [0,1,0,0,0,1|2,0,0]=4 649 B18R2.65908 Nc1cc(n[nH]c1=O)SCc2cccc(c2)O 62a_100011660834_100000102183 [0,1,0,0,0,1|2,0,0]=4 650 B18R2.65908 O=c1[nH]cc(cc1O)SCc2cccc(c2)Br 62a_100000211773_100009814561 [0,1,0,0,0,1|2,0,0]=4 651 B18R2.65908 O=c1[nH]cc(cc1O)SCc2cccc(c2)Cl 62a_100000187163_100009814561 [0,1,0,0,0,1|2,0,0]=4 652 B18R2.65908 O=c1[nH]cc(cc1O)SCc2cccc(c2)F 62a_100000230114_100009814561 [0,1,0,0,0,1|2,0,0]=4 653 B18R2.65908 O=c1[nH]cc(cc1O)SCc2cccc(c2)I 62a_100011218688_100009814561 [0,1,0,0,0,1|2,0,0]=4 654 B18R2.65908 O=c1[nH]cc(cc1O)SCc2cccc(c2)O 62a_100011660834_100009814561 [0,1,0,0,0,1|2,0,0]=4 655 B18R2.65908 Oc1cccc(c1)CNc2ncc(c(n2)O)F 27a_100000743036_100011995740 [0,1,0,0,0,1|2,0,0]=4 656 B18R2.65908 Oc1cccc(c1)CSc2ncc(c(n2)O)F 62a_100011660834_100011995740 [0,1,0,0,0,1|2,0,0]=4 657 B18R2.65908 Oc1nc(ncc1F)NCc2cccc(c2)Br 27a_100000174977_100011995740 [0,1,0,0,0,1|2,0,0]=4 658 B18R2.65908 Oc1nc(ncc1F)NCc2cccc(c2)Cl 27a_100000174878_100011995740 [0,1,0,0,0,1|2,0,0]=4 659 B18R2.65908 Oc1nc(ncc1F)NCc2cccc(c2)F 27a_100000174948_100011995740 [0,1,0,0,0,1|2,0,0]=4 660 B18R2.65908 Oc1nc(ncc1F)NCc2cccc(c2)I 27a_100000106179_100011995740 [0,1,0,0,0,1|2,0,0]=4 661 B18R2.65908 Oc1nc(ncc1F)SCc2cccc(c2)Br 62a_100000211773_100011995740 [0,1,0,0,0,1|2,0,0]=4 662 B18R2.65908 Oc1nc(ncc1F)SCc2cccc(c2)Cl 62a_100000187163_100011995740 [0,1,0,0,0,1|2,0,0]=4 663 B18R2.65908 Oc1nc(ncc1F)SCc2cccc(c2)F 62a_100000230114_100011995740 [0,1,0,0,0,1|2,0,0]=4 664 B18R2.65908 Oc1nc(ncc1F)SCc2cccc(c2)I 62a_100011218688_100011995740 [0,1,0,0,0,1|2,0,0]=4 665 B16R2.244211 NC(=O)C(=O)NN=C1Cc2c1cccc2 4a_100000211141_100000051409 [0,0,1,1,0,0|0,0,2]=4 666 B14R2.19 Cc1cc(n[nH]1)Sc2ccccc2 62a_100000719477_100009819999 [1,0,0,0,1,0|2,0,0]=4 667 B14R2.19 Cc1cc(n[nH]1)Sc2ccccc2 62a_100009819999_100000041952 [1,0,0,0,1,0|2,0,0]=4 668 B14R2.19 Cc1nc(n[nH]1)Sc2ccccc2 62a_100000719477_100000732540 [1,0,0,0,1,0|2,0,0]=4 669 B14R2.19 Cc1nc(n[nH]1)Sc2ccccc2 62a_100000732540_100000041952 [1,0,0,0,1,0|2,0,0]=4 670 B14R2.19 Nc1cc(n[nH]1)Sc2ccccc2 62a_100000719477_100009822546 [1,0,0,0,1,0|2,0,0]=4 671 B14R2.19 Nc1cc(n[nH]1)Sc2ccccc2 62a_100009822546_100000041952 [1,0,0,0,1,0|2,0,0]=4 672 B14R2.19 Nc1nc(n[nH]1)Sc2ccccc2 62a_100000719477_100015184587 [1,0,0,0,1,0|2,0,0]=4 673 B14R2.19 Nc1nc(n[nH]1)Sc2ccccc2 62a_100015184587_100000041952 [1,0,0,0,1,0|2,0,0]=4 674 B14R2.68 Brc1cnc(nc1)c2ccccc2 271570a_100011218836_100000690281 [1,0,0,0,1,0|2,0,0]=4 675 B14R2.68 Cc1cnc(nc1)c2ccccc2 271570a_100011218836_100011825175 [1,0,0,0,1,0|2,0,0]=4 676 B14R2.68 Clc1cnc(nc1)c2ccccc2 271570a_100011218836_100011356929 [1,0,0,0,1,0|2,0,0]=4 677 B14R2.68 Fc1cnc(nc1)c2ccccc2 271570a_100011218836_100000685220 [1,0,0,0,1,0|2,0,0]=4 678 B14R2.68 Nc1cnc(nc1)c2ccccc2 271570a_100011218836_100000068403 [1,0,0,0,1,0|2,0,0]=4 679 B14R2.68 O=c1ccc(c[nH]1)c2ccccc2 271570a_100011218836_100000212171 [1,0,0,0,1,0|2,0,0]=4 680 B14R2.68 O=c1ccc(n[nH]1)c2ccccc2 271570a_100011218836_100009820020 [1,0,0,0,1,0|1,0,0]=3 681 B14R2.68 O=c1ccc(n[nH]1)c2ccccn2 271570a_100011264011_100009820020 [1,0,0,0,1,0|2,0,0]=4 682 B14R2.68 O=c1ccc(n[nH]1)c2cccnc2 271570a_100000757648_100009820020 [1,0,0,0,1,0|2,0,0]=4 683 B14R2.68 O=c1ccc(n[nH]1)c2ccncc2 271570a_100000752145_100009820020 [1,0,0,0,1,0|2,0,0]=4 684 B14R2.68 Oc1cnc(nc1)c2ccccc2 271570a_100011218836_100000730009 [1,0,0,0,1,0|1,0,1]=4 685 B14R2.68 Oc1cnc(nc1)c2ccccc2 271570a_203496583355_100009814910 [1,0,0,0,1,0|1,0,1]=4 686 B14R2.21 Cc1ccnc(n1)c2ccccc2 271570a_100011218836_100011243806 [1,0,0,0,1,0|2,0,0]=4 687 B14R2.21 Nc1ccnc(n1)c2ccccc2 271570a_100011218836_100000757536 [1,0,0,0,1,0|2,0,0]=4 688 B14R2.21 Oc1cccc(n1)c2ccccc2 271570a_100010195584_100000210277 [1,0,0,0,1,0|2,0,0]=4 689 B14R2.21 Oc1cccc(n1)c2ccccc2 271570a_203496583355_100012022076 [1,0,0,0,1,0|2,0,0]=4 690 B14R2.21 Oc1ccnc(c1)c2ccccc2 271570a_100011218836_100000762945 [1,0,0,0,1,0|2,0,0]=4 691 B14R2.21 Oc1ccnc(c1)c2ccccc2 271570a_203496583355_100010243831 [1,0,0,0,1,0|2,0,0]=4 692 B14R2.21 Oc1ccnc(n1)c2ccccc2 271570a_100011218836_100011649813 [1,0,0,0,1,0|1,0,0]=3 693 B14R2.21 Oc1ccnc(n1)c2ccccc2 271570a_203496583355_100000750259 [1,0,0,0,1,0|1,0,0]=3 694 B14R2.21 Oc1ccnc(n1)c2ccccn2 271570a_100011264011_100011649813 [1,0,0,0,1,0|2,0,0]=4 695 B14R2.21 Oc1ccnc(n1)c2ccccn2 271570a_203496583355_100011331912 [1,0,0,0,1,0|2,0,0]=4 696 B14R2.21 Oc1ccnc(n1)c2cccnc2 271570a_100000757648_100011649813 [1,0,0,0,1,0|2,0,0]=4 697 B14R2.21 Oc1ccnc(n1)c2ccncc2 271570a_100000752145_100011649813 [1,0,0,0,1,0|2,0,0]=4 698 B14R2.21 Oc1cncc(n1)c2ccccc2 271570a_100011218836_100011269956 [1,0,0,0,1,0|1,0,1]=4 699 B14R2.21 Oc1cncc(n1)c2ccccc2 271570a_203496583355_100000691699 [1,0,0,0,1,0|1,0,1]=4 700 B14R2.21 Oc1cnnc(c1)c2ccccc2 271570a_100011218836_200010734679 [1,0,0,0,1,0|1,0,1]=4 701 B14R2.30 Brc1c[nH]nc1Sc2ccccc2 62a_100000719477_100015839836 [1,0,0,0,1,0|2,0,0]=4 702 B14R2.30 Brc1c[nH]nc1Sc2ccccc2 62a_100015839836_100000041952 [1,0,0,0,1,0|2,0,0]=4 703 B14R2.30 Cc1c[nH]nc1Sc2ccccc2 62a_100000719477_100009871783 [1,0,0,0,1,0|2,0,0]=4 704 B14R2.30 Cc1c[nH]nc1Sc2ccccc2 62a_100009871783_100000041952 [1,0,0,0,1,0|2,0,0]=4 705 B14R2.30 Nc1c[nH]nc1Sc2ccccc2 62a_100000719477_100010894806 [1,0,0,0,1,0|2,0,0]=4 706 B14R2.30 Nc1c[nH]nc1Sc2ccccc2 62a_100010894806_100000041952 [1,0,0,0,1,0|2,0,0]=4 707 B14R2.260 Cc1nc(sc1O)c2ccccc2 271570a_203496583355_100009828503 [0,0,0,0,2,0|2,0,0]=4 708 B14R2.4514 Cc1[nH]nc(c1C)c2ccccc2 271570a_100011218836_100015309786 [0,0,0,0,2,0|2,0,0]=4 709 B14R2.4514 Cc1onc(c1O)c2ccccc2 271570a_203496583355_100000041977 [0,0,0,0,2,0|2,0,0]=4 710 B16R1.4131 NC(=O)C(=O)NN=CCCc1ccccc1 4a_100000211141_100000198083 [0,0,1,0,0,1|0,0,2]=4 711 B16R1.4131 NC(=O)C(=O)NN=CCOc1ccccc1 4a_100000211141_100000758736 [0,0,1,0,0,1|0,0,2]=4 712 B16R2.132 Brc1cnc(nc1)CNc2ccccc2 34a_100000106764_100010064664 [1,0,0,0,0,1|2,0,0]=4 713 B16R2.132 Brc1cnc(nc1)COc2ccccc2 34a_100000210340_100010064664 [1,0,0,0,0,1|2,0,0]=4 714 B16R2.132 Brc1cnc(nc1)COc2ccccc2 7a_100000210340_100010064664 [1,0,0,0,0,1|2,0,0]=4 715 B16R2.132 Brc1cnc(nc1)CSc2ccccc2 62a_100000719477_100010064664 [1,0,0,0,0,1|2,0,0]=4 716 B16R2.132 Brc1cnc(nc1)CSc2ccccc2 62a_100010064664_100000041952 [1,0,0,0,0,1|2,0,0]=4 717 B16R2.132 Brc1cnc(nc1)NCc2ccccc2 27a_100015324214_100000690281 [1,0,0,0,0,1|2,0,0]=4 718 B16R2.132 Brc1cnc(nc1)SCc2ccccc2 62a_100000211182_100000690281 [1,0,0,0,0,1|2,0,0]=4 719 B16R2.132 Brc1cnc(nc1)SCc2ccccc2 62a_100000690281_100015291786 [1,0,0,0,0,1|2,0,0]=4 720 B16R2.132 Cc1cnc(nc1)CNc2ccccc2 34a_100000106764_100000685645 [1,0,0,0,0,1|2,0,0]=4 721 B16R2.132 Cc1cnc(nc1)COc2ccccc2 34a_100000210340_100000685645 [1,0,0,0,0,1|2,0,0]=4 722 B16R2.132 Cc1cnc(nc1)COc2ccccc2 7a_100000210340_100000685645 [1,0,0,0,0,1|2,0,0]=4 723 B16R2.132 Cc1cnc(nc1)CSc2ccccc2 62a_100000685645_100000041952 [1,0,0,0,0,1|2,0,0]=4 724 B16R2.132 Cc1cnc(nc1)CSc2ccccc2 62a_100000719477_100000685645 [1,0,0,0,0,1|2,0,0]=4 725 B16R2.132 Cc1cnc(nc1)NCc2ccccc2 27a_100015324214_100000061069 [1,0,0,0,0,1|2,0,0]=4 726 B16R2.132 Cc1cnc(nc1)SCc2ccccc2 62a_100000061069_100015291786 [1,0,0,0,0,1|2,0,0]=4 727 B16R2.132 Cc1cnc(nc1)SCc2ccccc2 62a_100000211182_100000061069 [1,0,0,0,0,1|2,0,0]=4 728 B16R2.132 Clc1cnc(nc1)NCc2ccccc2 27a_100015324214_100011356929 [1,0,0,0,0,1|2,0,0]=4 729 B16R2.132 Clc1cnc(nc1)SCc2ccccc2 62a_100000211182_100011356929 [1,0,0,0,0,1|2,0,0]=4 730 B16R2.132 Clc1cnc(nc1)SCc2ccccc2 62a_100011356929_100015291786 [1,0,0,0,0,1|2,0,0]=4 731 B16R2.132 Fc1cnc(nc1)NCc2ccccc2 27a_100015324214_100000685220 [1,0,0,0,0,1|2,0,0]=4 732 B16R2.132 Fc1cnc(nc1)OCc2ccccc2 34a_100011934040_100015291786 [1,0,0,0,0,1|2,0,0]=4 733 B16R2.132 Fc1cnc(nc1)SCc2ccccc2 62a_100000211182_100000685220 [1,0,0,0,0,1|2,0,0]=4 734 B16R2.132 Fc1cnc(nc1)SCc2ccccc2 62a_100000685220_100015291786 [1,0,0,0,0,1|2,0,0]=4 735 B16R2.132 Nc1cnc(nc1)SCc2ccccc2 62a_100000068403_100015291786 [1,0,0,0,0,1|2,0,0]=4 736 B16R2.132 Nc1cnc(nc1)SCc2ccccc2 62a_100000211182_100000068403 [1,0,0,0,0,1|2,0,0]=4 737 B16R2.132 O=c1ccc(c[nH]1)OCc2ccccc2 34a_100000075641_100015291786 [1,0,0,0,0,1|2,0,0]=4 738 B16R2.132 O=c1ccc(c[nH]1)SCc2ccccc2 62a_100000211182_100000212171 [1,0,0,0,0,1|2,0,0]=4 739 B16R2.132 O=c1ccc(c[nH]1)SCc2ccccc2 62a_100000212171_100015291786 [1,0,0,0,0,1|2,0,0]=4 740 B16R2.132 O=c1ccc(n[nH]1)C#Cc2ccccc2 271570a_100000069678_100009820020 [1,0,0,0,0,1|1,0,1]=4 741 B16R2.132 O=c1ccc(n[nH]1)C=Cc2ccccc2 271570a_100102527694_100009820020 [1,0,0,0,0,1|1,0,1]=4 742 B16R2.132 O=c1ccc(n[nH]1)CNc2ccccc2 207a_100000106764_100011361533 [1,0,0,0,0,1|1,0,0]=3 743 B16R2.132 O=c1ccc(n[nH]1)SCc2ccccc2 62a_100000211182_100009820020 [1,0,0,0,0,1|1,0,0]=3 744 B16R2.132 O=c1ccc(n[nH]1)SCc2ccccc2 62a_100009820020_100015291786 [1,0,0,0,0,1|1,0,0]=3 745 B16R2.132 O=c1ccc(n[nH]1)SCc2ccccn2 62a_100000721315_100009820020 [1,0,0,0,0,1|2,0,0]=4 746 B16R2.132 O=c1ccc(n[nH]1)SCc2ccccn2 62a_100009820020_100000721315 [1,0,0,0,0,1|2,0,0]=4 747 B16R2.132 O=c1ccc(n[nH]1)SCc2cccnc2 62a_100000741622_100009820020 [1,0,0,0,0,1|2,0,0]=4 748 B16R2.132 O=c1ccc(n[nH]1)SCc2cccnc2 62a_100009820020_100000741622 [1,0,0,0,0,1|2,0,0]=4 749 B16R2.132 O=c1ccc(n[nH]1)SCc2ccncc2 62a_100009820020_100015193705 [1,0,0,0,0,1|2,0,0]=4 750 B16R2.132 O=c1ccc(n[nH]1)SCc2ccncc2 62a_100015193705_100009820020 [1,0,0,0,0,1|2,0,0]=4 751 B16R2.132 Oc1cnc(nc1)OCc2ccccc2 271570a_203496583355_100011830389 [1,0,0,0,0,1|1,0,1]=4 752 B16R2.132 Oc1cnc(nc1)SCc2ccccc2 271570a_203496583355_200011939521 [1,0,0,0,0,1|1,0,1]=4 753 B16R2.132 Oc1cnc(nc1)SCc2ccccc2 62a_100000211182_100000092845 [1,0,0,0,0,1|1,0,1]=4 754 B16R2.132 Oc1cnc(nc1)SCc2ccccc2 62a_100000730009_100015291786 [1,0,0,0,0,1|1,0,1]=4 755 B16R2.252 Cc1ccnc(n1)NCc2ccccc2 27a_100015324214_100000750684 [1,0,0,0,0,1|2,0,0]=4 756 B16R2.252 Cc1ccnc(n1)SCc2ccccc2 62a_100000211182_100011243806 [1,0,0,0,0,1|2,0,0]=4 757 B16R2.252 Cc1ccnc(n1)SCc2ccccc2 62a_100011243806_100015291786 [1,0,0,0,0,1|2,0,0]=4 758 B16R2.252 Nc1ccnc(n1)NCc2ccccc2 27a_100015324214_100000757536 [1,0,0,0,0,1|2,0,0]=4 759 B16R2.252 Nc1ccnc(n1)SCc2ccccc2 62a_100000211182_100000757536 [1,0,0,0,0,1|2,0,0]=4 760 B16R2.252 Nc1ccnc(n1)SCc2ccccc2 62a_100000757536_100015291786 [1,0,0,0,0,1|2,0,0]=4 761 B16R2.252 Oc1cccc(n1)NCc2ccccc2 271570a_203496583355_200011960457 [1,0,0,0,0,1|2,0,0]=4 762 B16R2.252 Oc1cccc(n1)OCc2ccccc2 271570a_203496583355_100011960212 [1,0,0,0,0,1|2,0,0]=4 763 B16R2.252 Oc1ccnc(c1)OCc2ccccc2 271570a_203496583355_200010986176 [1,0,0,0,0,1|2,0,0]=4 764 B16R2.252 Oc1ccnc(c1)SCc2ccccc2 271570a_203496583355_100042452854 [1,0,0,0,0,1|2,0,0]=4 765 B16R2.252 Oc1ccnc(c1)SCc2ccccc2 62a_100000211182_100000762945 [1,0,0,0,0,1|2,0,0]=4 766 B16R2.252 Oc1ccnc(n1)C#Cc2ccccc2 271570a_100000069678_100011649813 [1,0,0,0,0,1|1,0,1]=4 767 B16R2.252 Oc1ccnc(n1)C=Cc2ccccc2 271570a_100102527694_100011649813 [1,0,0,0,0,1|1,0,1]=4 768 B16R2.252 Oc1ccnc(n1)NCc2ccccc2 27a_100015324214_100011649813 [1,0,0,0,0,1|1,0,0]=3 769 B16R2.252 Oc1ccnc(n1)NCc2ccccn2 27a_100000210449_100011649813 [1,0,0,0,0,1|2,0,0]=4 770 B16R2.252 Oc1ccnc(n1)NCc2cccnc2 27a_100000210453_100011649813 [1,0,0,0,0,1|2,0,0]=4 771 B16R2.252 Oc1ccnc(n1)NCc2ccncc2 27a_100000210450_100011649813 [1,0,0,0,0,1|2,0,0]=4 772 B16R2.252 Oc1ccnc(n1)SCc2ccccc2 62a_100000211182_100011649813 [1,0,0,0,0,1|1,0,0]=3 773 B16R2.252 Oc1ccnc(n1)SCc2ccccn2 62a_100000721315_100011649813 [1,0,0,0,0,1|2,0,0]=4 774 B16R2.252 Oc1ccnc(n1)SCc2cccnc2 62a_100000741622_100011649813 [1,0,0,0,0,1|2,0,0]=4 775 B16R2.252 Oc1ccnc(n1)SCc2ccncc2 62a_100015193705_100011649813 [1,0,0,0,0,1|2,0,0]=4 776 B16R2.252 Oc1cncc(n1)NCc2ccccc2 271570a_203496583355_200000243942 [1,0,0,0,0,1|1,0,1]=4 777 B16R2.252 Oc1cncc(n1)OCc2ccccc2 271570a_203496583355_100000243162 [1,0,0,0,0,1|1,0,1]=4 778 B16R2.252 Oc1cncc(n1)SCc2ccccc2 62a_100000211182_100011269956 [1,0,0,0,0,1|1,0,1]=4 779 B16R2.252 Oc1cnnc(c1)SCc2ccccc2 62a_100000211182_200010734679 [1,0,0,0,0,1|1,0,1]=4 780 B18R2.8976 Cc1cc(n[nH]c1=O)C=CCc2ccccc2 271570a_200016263579_100012187101 [0,0,0,0,0,2|2,0,0]=4 781 B18R2.8976 Cc1cc(n[nH]c1=O)SCCc2ccccc2 62a_100000765856_100012187101 [0,0,0,0,0,2|2,0,0]=4 782 B18R2.8976 Cc1cc(n[nH]c1=O)SCSc2ccccc2 62a_100011218342_100012187101 [0,0,0,0,0,2|2,0,0]=4 783 B18R2.8976 Cc1nc(c[nH]c1=O)C=CCc2ccccc2 271570a_200016263579_100010363809 [0,0,0,0,0,2|2,0,0]=4 784 B18R2.8976 Cc1nc(c[nH]c1=O)SCCc2ccccc2 62a_100000765856_100010363809 [0,0,0,0,0,2|2,0,0]=4 785 B18R2.8976 Cc1nc(c[nH]c1=O)SCCc2ccccc2 62a_100010363809_100011218657 [0,0,0,0,0,2|2,0,0]=4 786 B18R2.8976 Cc1nc(c[nH]c1=O)SCSc2ccccc2 62a_100010363809_100011218342 [0,0,0,0,0,2|2,0,0]=4 787 B18R2.8976 Cc1nc(c[nH]c1=O)SCSc2ccccc2 62a_100011218342_100010363809 [0,0,0,0,0,2|2,0,0]=4 788 B18R2.8976 Nc1cc(n[nH]c1=O)C=CCc2ccccc2 271570a_200016263579_100000102183 [0,0,0,0,0,2|2,0,0]=4 789 B18R2.8976 Nc1cc(n[nH]c1=O)SCCc2ccccc2 62a_100000765856_100000102183 [0,0,0,0,0,2|2,0,0]=4 790 B18R2.8976 Nc1cc(n[nH]c1=O)SCSc2ccccc2 62a_100011218342_100000102183 [0,0,0,0,0,2|2,0,0]=4 791 B18R2.8976 O=c1[nH]cc(cc1O)C=CCc2ccccc2 271570a_200016263579_100009814561 [0,0,0,0,0,2|2,0,0]=4 792 B18R2.8976 O=c1[nH]cc(cc1O)SCCc2ccccc2 62a_100000765856_100009814561 [0,0,0,0,0,2|2,0,0]=4 793 B18R2.8976 O=c1[nH]cc(cc1O)SCSc2ccccc2 62a_100011218342_100009814561 [0,0,0,0,0,2|2,0,0]=4 794 B18R2.8976 Oc1nc(ncc1F)C=CCc2ccccc2 271570a_200016263579_100011995740 [0,0,0,0,0,2|2,0,0]=4 795 B18R2.8976 Oc1nc(ncc1F)NCCc2ccccc2 27a_100000106460_100011995740 [0,0,0,0,0,2|2,0,0]=4 796 B18R2.8976 Oc1nc(ncc1F)SCCc2ccccc2 62a_100000765856_100011995740 [0,0,0,0,0,2|2,0,0]=4 797 B18R2.8976 Oc1nc(ncc1F)SCSc2ccccc2 62a_100011218342_100011995740 [0,0,0,0,0,2|2,0,0]=4