0 B18R2.16190 CCCCCCNc1nc(c2sccc2n1)O 27a_100000210581_100012177178 [1,0,0,0,0,0|3,0,0]=4 1 B18R2.16190 CCCCCCNc1nc2nc[nH]c2c(=O)[nH]1 27a_100000210581_100020644719 [1,0,0,0,0,0|1,0,2]=4 2 B18R2.16190 CCCCCCSc1nc(c2nc[nH]c2n1)C 62a_100000210314_100000093496 [1,0,0,0,0,0|1,0,2]=4 3 B18R2.16190 CCCCCCSc1nc(c2sccc2n1)N 62a_100012002325_100000210757 [1,0,0,0,0,0|3,0,0]=4 4 B18R2.16190 CCCCCCSc1nc-2ncnc2c([nH]1)Cl 62a_100000210314_100010207356 [1,0,0,0,0,0|1,0,2]=4 5 B18R2.16190 CCCCCCSc1nc2nc[nH]c2c(=O)[nH]1 62a_100000210314_100020644719 [1,0,0,0,0,0|0,0,2]=3 6 B18R2.16190 CCCCOCSc1nc2nc[nH]c2c(=O)[nH]1 62a_100011995733_100020644719 [1,0,0,0,0,0|1,0,2]=4 7 B18R2.16190 CCCOCCSc1nc2nc[nH]c2c(=O)[nH]1 62a_100011215938_100020644719 [1,0,0,0,0,0|1,0,2]=4 8 B18R2.16190 CCOCCCSc1nc2nc[nH]c2c(=O)[nH]1 62a_100012232248_100020644719 [1,0,0,0,0,0|1,0,2]=4 9 B18R2.16190 COCCCCSc1nc2nc[nH]c2c(=O)[nH]1 62a_100000730899_100020644719 [1,0,0,0,0,0|1,0,2]=4 10 B18R2.16190 O=c1[nH]c(nc2c1[nH]cn2)SCCCCCF 62a_100000729378_100020644719 [1,0,0,0,0,0|1,0,2]=4 11 B18R2.16190 O=c1[nH]c(nc2c1[nH]cn2)SCCCCCO 62a_100000746330_100020644719 [1,0,0,0,0,0|1,0,2]=4 12 B18R2.872532 CCCCCCSc1cc2[nH]c(nc2cn1)O 62a_100000210314_100010516660 [1,0,0,0,0,0|1,0,2]=4 13 B18R2.872532 CCCCCCSc1cc2c(cn1)NC(=O)C2 62a_100000210314_100000104063 [1,0,0,0,0,0|2,0,1]=4 14 B18R2.872532 CCCCCCSc1cc2nc(sc2cn1)N 62a_100000210314_100009884557 [1,0,0,0,0,0|3,0,0]=4 15 B18R2.872532 CCCCCCSc1cc2nc(sc2cn1)N 62a_100009884557_100000210757 [1,0,0,0,0,0|3,0,0]=4 16 B18R2.872532 CCCCCCSc1ccc2[nH]c(nc2c1)C 62a_100000210314_100011264012 [1,0,0,0,0,0|3,0,0]=4 17 B18R2.872532 CCCCCCSc1ccc2c(n1)CC(=O)N2 62a_100000210314_100000087150 [1,0,0,0,0,0|2,0,1]=4 18 B18R2.872532 CCCCCCSc1cnc2[nH]c(nc2c1)O 62a_100000210314_100000755142 [1,0,0,0,0,0|3,0,0]=4 19 B18R2.872532 CCCCCCSc1ncc2c(n1)NC(=O)C2 62a_100000210314_100000086852 [1,0,0,0,0,0|1,0,2]=4 20 B17R1.1458 CCCCCCSc1ncc(cn1)NC(=O)C 62a_100000210314_200010565192 [1,0,1,0,0,0|1,0,1]=4 21 B17R2.8766 CCCCCCNc1ncc2[nH]ccc2n1 27a_100000210581_100009831719 [2,0,0,0,0,0|2,0,0]=4 22 B17R2.8766 CCCCCCSc1cc2cc[nH]c2cn1 62a_100000210314_100009864809 [2,0,0,0,0,0|2,0,0]=4 23 B17R2.8766 CCCCCCSc1cc2nc[nH]c2cn1 62a_100000210314_100000070173 [2,0,0,0,0,0|1,0,0]=3 24 B17R2.8766 CCCCCCSc1ccc2[nH]ccc2n1 62a_100000210314_100000087148 [2,0,0,0,0,0|2,0,0]=4 25 B17R2.8766 CCCCCCSc1ccc2[nH]cnc2c1 62a_100000210314_100011265325 [2,0,0,0,0,0|2,0,0]=4 26 B17R2.8766 CCCCCCSc1ccc2[nH]nnc2n1 62a_100000210314_100000056387 [2,0,0,0,0,0|2,0,0]=4 27 B17R2.8766 CCCCCCSc1ncc2[nH]ccc2n1 62a_100000210314_100009831719 [2,0,0,0,0,0|1,0,0]=3 28 B17R2.8766 CCCCCCSc1ncc2[nH]ncc2n1 62a_100000210314_100009843425 [2,0,0,0,0,0|2,0,0]=4 29 B17R2.8766 CCCCCCSc1ncc2cc[nH]c2n1 62a_100000210314_100000059789 [2,0,0,0,0,0|1,0,1]=4 30 B17R2.8766 CCCCCCSc1ncc2ccsc2n1 62a_100000210314_100009840870 [2,0,0,0,0,0|2,0,0]=4 31 B17R2.8766 CCCCCCSc1ncc2nc[nH]c2n1 62a_100000210314_100000009038 [2,0,0,0,0,0|0,0,2]=4 32 B17R2.8766 CCCCCCSc1ncc2sccc2n1 62a_100000210314_100000117912 [2,0,0,0,0,0|2,0,0]=4 33 B17R2.8766 CCCCOCSc1cc2nc[nH]c2cn1 62a_100011995733_100000070173 [2,0,0,0,0,0|2,0,0]=4 34 B17R2.8766 CCCCOCSc1ncc2[nH]ccc2n1 62a_100011995733_100009831719 [2,0,0,0,0,0|2,0,0]=4 35 B17R2.8766 CCCOCCSc1cc2nc[nH]c2cn1 62a_100011215938_100000070173 [2,0,0,0,0,0|2,0,0]=4 36 B17R2.8766 CCCOCCSc1ncc2[nH]ccc2n1 62a_100011215938_100009831719 [2,0,0,0,0,0|2,0,0]=4 37 B17R2.8766 CCOCCCSc1cc2nc[nH]c2cn1 62a_100012232248_100000070173 [2,0,0,0,0,0|2,0,0]=4 38 B17R2.8766 CCOCCCSc1ncc2[nH]ccc2n1 62a_100012232248_100009831719 [2,0,0,0,0,0|2,0,0]=4 39 B17R2.8766 COCCCCSc1cc2nc[nH]c2cn1 62a_100000730899_100000070173 [2,0,0,0,0,0|2,0,0]=4 40 B17R2.8766 COCCCCSc1ncc2[nH]ccc2n1 62a_100000730899_100009831719 [2,0,0,0,0,0|2,0,0]=4 41 B17R2.8766 FCCCCCSc1cc2nc[nH]c2cn1 62a_100000729378_100000070173 [2,0,0,0,0,0|2,0,0]=4 42 B17R2.8766 FCCCCCSc1ncc2[nH]ccc2n1 62a_100000729378_100009831719 [2,0,0,0,0,0|2,0,0]=4 43 B17R2.8766 OCCCCCSc1cc2nc[nH]c2cn1 62a_100000746330_100000070173 [2,0,0,0,0,0|2,0,0]=4 44 B17R2.8766 OCCCCCSc1ncc2[nH]ccc2n1 62a_100000746330_100009831719 [2,0,0,0,0,0|2,0,0]=4 45 B17R2.19066 CCCCCSc1nc2nc[nH]c2c(=O)[nH]1 62a_100000210326_100020644719 [2,0,0,0,0,0|0,0,2]=4 46 B19R2.14788 CCCCCC(C)Sc1nc2nc[nH]c2c(=O)[nH]1 62a_200011218191_100020644719 [1,1,0,0,0,0|0,0,2]=4 47 B19R2.98182 CC(C)CCCCSc1nc2nc[nH]c2c(=O)[nH]1 62a_100011216152_100020644719 [1,1,0,0,0,0|0,0,2]=4 48 B19R2.116131 CCCCCCCSc1nc2nc[nH]c2c(=O)[nH]1 62a_100000210614_100020644719 [1,1,0,0,0,0|0,0,2]=4 49 B19R2.116131 CCCCOCCSc1nc2nc[nH]c2c(=O)[nH]1 62a_100000743108_100020644719 [1,1,0,0,0,0|0,0,2]=4 50 B19R2.116131 O=c1[nH]c(nc2c1[nH]cn2)SCCCCCCF 62a_100015922095_100020644719 [1,1,0,0,0,0|0,0,2]=4 51 B19R2.116131 O=c1[nH]c(nc2c1[nH]cn2)SCCCCCCO 62a_100000766143_100020644719 [1,1,0,0,0,0|0,0,2]=4 52 B19R2.161511 CCCCCCSc1nc(c2[nH]ccc2n1)OC 62a_100000210314_200010292222 [1,1,0,0,0,0|1,0,0]=3 53 B19R2.161511 CCCCCCSc1nc(c2[nH]cnc2n1)NC 62a_100000210314_100102591833 [1,1,0,0,0,0|1,0,0]=3 54 B19R2.161511 CCCCCCSc1nc(c2nc[nH]c2n1)OC 62a_100000210314_200012279070 [1,1,0,0,0,0|0,0,2]=4 55 B19R2.161511 CCCCCCSc1nc(c2sccc2n1)OC 62a_100000210314_200014799438 [1,1,0,0,0,0|2,0,0]=4 56 B19R2.161511 CCCCOCSc1nc(c2[nH]ccc2n1)OC 62a_100011995733_200010292222 [1,1,0,0,0,0|2,0,0]=4 57 B19R2.161511 CCCCOCSc1nc(c2[nH]cnc2n1)NC 62a_100011995733_100102591833 [1,1,0,0,0,0|2,0,0]=4 58 B19R2.161511 CCCOCCSc1nc(c2[nH]ccc2n1)OC 62a_100011215938_200010292222 [1,1,0,0,0,0|2,0,0]=4 59 B19R2.161511 CCCOCCSc1nc(c2[nH]cnc2n1)NC 62a_100011215938_100102591833 [1,1,0,0,0,0|2,0,0]=4 60 B19R2.161511 CCOCCCSc1nc(c2[nH]ccc2n1)OC 62a_100012232248_200010292222 [1,1,0,0,0,0|2,0,0]=4 61 B19R2.161511 CCOCCCSc1nc(c2[nH]cnc2n1)NC 62a_100012232248_100102591833 [1,1,0,0,0,0|2,0,0]=4 62 B19R2.161511 CNc1nc(nc2c1[nH]cn2)SCCCCCF 62a_100000729378_100102591833 [1,1,0,0,0,0|2,0,0]=4 63 B19R2.161511 CNc1nc(nc2c1[nH]cn2)SCCCCCO 62a_100000746330_100102591833 [1,1,0,0,0,0|2,0,0]=4 64 B19R2.161511 CNc1nc(nc2c1[nH]cn2)SCCCCOC 62a_100000730899_100102591833 [1,1,0,0,0,0|2,0,0]=4 65 B19R2.161511 COCCCCSc1nc(c2[nH]ccc2n1)OC 62a_100000730899_200010292222 [1,1,0,0,0,0|2,0,0]=4 66 B19R2.161511 COc1nc(nc2c1[nH]cc2)SCCCCCF 62a_100000729378_200010292222 [1,1,0,0,0,0|2,0,0]=4 67 B19R2.161511 COc1nc(nc2c1[nH]cc2)SCCCCCO 62a_100000746330_200010292222 [1,1,0,0,0,0|2,0,0]=4 68 B19R2.2749680 C#CCCCCSc1nc(c2c(n1)ncn2C)O 62a_100010269958_100000005714 [1,1,0,0,0,0|0,0,2]=4 69 B19R2.2749680 C=CCCCCSc1nc(c2c(n1)ncn2C)O 62a_100011215482_100000005714 [1,1,0,0,0,0|0,0,2]=4 70 B19R2.2749680 CC/C=C\CCSc1nc(c2c(n1)ncn2C)O 62a_100015370543_100000005714 [1,1,0,0,0,0|0,0,2]=4 71 B19R2.2749680 CCCCCC=Cc1nc(c2c(n1)ncn2C)O 271570a_100000062253_100000005714 [1,1,0,0,0,0|1,0,1]=4 72 B19R2.2749680 CCCCCCNc1nc(c2c(n1)ncn2C)O 27a_100000210581_100000005714 [1,1,0,0,0,0|1,0,0]=3 73 B19R2.2749680 CCCCCCSc1nc(c2c(n1)ncn2C)O 62a_100000210314_100000005714 [1,1,0,0,0,0|0,0,0]=2 74 B19R2.2749680 CCCCOCSc1nc(c2c(n1)ncn2C)O 62a_100011995733_100000005714 [1,1,0,0,0,0|1,0,0]=3 75 B19R2.2749680 CCCOCCNc1nc(c2c(n1)ncn2C)O 27a_100161115042_100000005714 [1,1,0,0,0,0|2,0,0]=4 76 B19R2.2749680 CCCOCCSc1nc(c2c(n1)ncn2C)O 62a_100011215938_100000005714 [1,1,0,0,0,0|1,0,0]=3 77 B19R2.2749680 CCCSCCNc1nc(c2c(n1)ncn2C)O 27a_100020603323_100000005714 [1,1,0,0,0,0|2,0,0]=4 78 B19R2.2749680 CCOCCCNc1nc(c2c(n1)ncn2C)O 27a_100000210961_100000005714 [1,1,0,0,0,0|2,0,0]=4 79 B19R2.2749680 CCOCCCSc1nc(c2c(n1)ncn2C)O 62a_100012232248_100000005714 [1,1,0,0,0,0|1,0,0]=3 80 B19R2.2749680 COCCCCSc1nc(c2c(n1)ncn2C)O 62a_100000730899_100000005714 [1,1,0,0,0,0|1,0,0]=3 81 B19R2.2749680 COCCOCSc1nc(c2c(n1)ncn2C)O 62a_100000231047_100000005714 [1,1,0,0,0,0|2,0,0]=4 82 B19R2.2749680 Cn1cnc2c1c(nc(n2)NCCCCCO)O 27a_100000762737_100000005714 [1,1,0,0,0,0|2,0,0]=4 83 B19R2.2749680 Cn1cnc2c1c(nc(n2)SCCCCC#N)O 62a_100011219923_100000005714 [1,1,0,0,0,0|1,0,1]=4 84 B19R2.2749680 Cn1cnc2c1c(nc(n2)SCCCCC=O)O 62a_100000139335_100000005714 [1,1,0,0,0,0|1,0,1]=4 85 B19R2.2749680 Cn1cnc2c1c(nc(n2)SCCCCCF)O 62a_100000729378_100000005714 [1,1,0,0,0,0|1,0,0]=3 86 B19R2.2749680 Cn1cnc2c1c(nc(n2)SCCCCCO)O 62a_100000746330_100000005714 [1,1,0,0,0,0|1,0,0]=3 87 B19R2.2749680 Cn1cnc2c1c(nc(n2)SCCOCCO)O 62a_100011215305_100000005714 [1,1,0,0,0,0|2,0,0]=4 88 B19R2.220340 CCCCCCSc1ncc2[nH]c(=O)n(c2n1)C 62a_100000210314_100010511113 [1,1,0,0,0,0|0,0,2]=4 89 B19R2.220371 CCCCCCSc1cc2cc([nH]c2cn1)CO 62a_100000210314_100010549619 [1,1,0,0,0,0|2,0,0]=4 90 B19R2.220371 CCCCCCSc1ccc2[nH]c(nc2c1)CO 62a_100000698547_100000210757 [1,1,0,0,0,0|2,0,0]=4 91 B19R2.1369561 CCCCCCSc1ccc2c(c1)nc(n2C)O 62a_100000210314_100013992850 [1,1,0,0,0,0|2,0,0]=4 92 B21R2.2602869 CCCCCCSc1nc(c2cc(ccc2n1)OC)O 62a_100000210314_100012360530 [0,1,0,0,0,1|2,0,0]=4 93 B19R3.9172 O=c1[nH]c(nc2c1[nH]cn2)SC3CCCCC3 62a_100000210327_100020644719 [1,0,0,1,0,0|0,0,2]=4 94 B19R3.171661 O=c1[nH]c(nc2c1[nH]cn2)SCC3CCCC3 62a_100000740388_100020644719 [1,0,0,1,0,0|0,0,2]=4 95 B19R2.16961 CCCCCCSc1ccc2ccc(nc2n1)O 62a_100000210314_200010218124 [1,0,0,0,0,1|2,0,0]=4