0 B12R2.246 Nc1cc(c2cc[nH]c2n1)O 271570a_203496583355_100009864914 [0,0,0,0,0,0|1,0,3]=4 1 B12R2.246 Nc1cc(c2scnc2c1)O 271570a_203496583355_200010333430 [0,0,0,0,0,0|3,0,1]=4 2 B12R2.246 Nc1nc(c2[nH]ccc2n1)O 271570a_203496583355_100000093568 [0,0,0,0,0,0|2,0,2]=4 3 B12R2.246 Nc1nc(c2nc[nH]c2n1)O 271570a_203496583355_200000049598 [0,0,0,0,0,0|1,0,3]=4 4 B12R2.246 O=c1[nH]c(nc2c1[nH]cn2)O 271570a_203496583355_100009812310 [0,0,0,0,0,0|2,0,0]=2 5 B13R2.623 CNc1nc(nc2c1[nH]cn2)N 27a_100102657272_100000764887 [0,1,0,0,0,0|2,0,1]=4 6 B13R2.623 CSc1nc(nc2c1[nH]cn2)N 62a_100000764887_200000210301 [0,1,0,0,0,0|1,1,1]=4 7 B13R2.623 CSc1nc(nc2c1[nH]cn2)N 62a_200000210301_100000764887 [0,1,0,0,0,0|1,1,1]=4 8 B13R2.623 [13CH3]Sc1nc(nc2c1[nH]cn2)N 62a_100000764887_200025704644 [0,1,0,0,0,0|1,1,1]=4 9 B13R2.623 [13CH3]Sc1nc(nc2c1[nH]cn2)N 62a_200025704644_100000764887 [0,1,0,0,0,0|1,1,1]=4 10 B13R2.654 C=Cc1nc2nc[nH]c2c(=O)[nH]1 271570a_100011290941_100009812310 [0,1,0,0,0,0|2,0,0]=3 11 B13R2.654 CNc1nc2nc[nH]c2c(=O)[nH]1 27a_100102657272_100020644719 [0,1,0,0,0,0|1,0,0]=2 12 B13R2.654 CSc1nc-2ncnc2c([nH]1)Cl 62a_200000210301_100010207356 [0,1,0,0,0,0|3,0,0]=4 13 B13R2.654 CSc1nc2nc[nH]c2c(=O)[nH]1 62a_200000210301_100020644719 [0,1,0,0,0,0|2,0,0]=3 14 B13R2.654 [13CH3]Sc1nc-2ncnc2c([nH]1)Cl 62a_200025704644_100010207356 [0,1,0,0,0,0|3,0,0]=4 15 B13R2.654 [13CH3]Sc1nc2nc[nH]c2c(=O)[nH]1 62a_200025704644_100020644719 [0,1,0,0,0,0|2,0,0]=3 16 B13R2.4899 Cn1c(nc2cc[nH]c2c1=O)O 271570a_203496583355_100150720343 [0,1,0,0,0,0|3,0,0]=4 17 B13R2.5397 Nc1nc2[nH]c(nc2c(=O)[nH]1)O 271570a_203496583355_200009813169 [0,1,0,0,0,0|1,0,1]=3 18 B11R1.8 C=Cc1[nH]c(=O)[nH]c(=O)c1C 271570a_100011290941_200009866310 [0,0,1,0,0,0|2,0,1]=4 19 B11R1.8 C=Cc1nc(nc(c1C)C)N 271570a_100011290941_100000076065 [0,0,1,0,0,0|2,0,1]=4 20 B11R1.34 CC=Cc1cc(=O)[nH]c(=O)[nH]1 271570a_100016259895_100000015670 [0,0,1,0,0,0|2,0,1]=4 21 B11R1.34 CC=Cc1cc([nH]c(=O)c1)C 271570a_100016259895_100009861981 [0,0,1,0,0,0|3,0,0]=4 22 B11R1.34 CC=Cc1cc(cc(n1)N)C 271570a_100016259895_100009819863 [0,0,1,0,0,0|3,0,0]=4 23 B11R1.34 CC=Cc1cc(nc(n1)N)C 271570a_100016259895_100000183061 [0,0,1,0,0,0|2,0,1]=4 24 B11R1.34 CC=Cc1cc(nc(n1)N)N 271570a_100016259895_100011177858 [0,0,1,0,0,0|2,0,1]=4 25 B11R1.34 CC=Cc1cc(nc(n1)N)O 271570a_100016259895_100000694715 [0,0,1,0,0,0|1,0,2]=4 26 B11R1.34 CNCc1cc(=O)[nH]c(n1)O 2230a_106832991635_100000185147 [0,0,1,0,0,0|3,0,0]=4 27 B11R1.34 CNCc1cc(=O)[nH]c(n1)O 34a_100102657272_100000185147 [0,0,1,0,0,0|3,0,0]=4 28 B11R1.34 CNCc1cc(=O)[nH]c(n1)O 7a_106832991635_100000185147 [0,0,1,0,0,0|3,0,0]=4 29 B11R1.34 COCc1cc(=O)[nH]c(n1)O 34a_100138415774_100000185147 [0,0,1,0,0,0|3,0,0]=4 30 B11R1.34 CSCc1cc(=O)[nH]c(n1)O 62a_200000210301_100000185147 [0,0,1,0,0,0|3,0,0]=4 31 B11R1.34 [13CH3]SCc1cc(=O)[nH]c(n1)O 62a_200025704644_100000185147 [0,0,1,0,0,0|3,0,0]=4 32 B11R1.81 C=C=Cc1cnc([nH]c1=O)N 271570a_100015277604_100012456729 [0,0,1,0,0,0|1,0,2]=4 33 B11R1.81 CC=Cc1cnc([nH]c1=O)C 271570a_100016259895_100011999157 [0,0,1,0,0,0|2,0,1]=4 34 B11R1.81 CC=Cc1cnc([nH]c1=O)N 271570a_100016259895_100012456729 [0,0,1,0,0,0|1,0,1]=3 35 B11R1.81 CC=Cc1cnc([nH]c1=O)O 271570a_100016259895_100011215686 [0,0,1,0,0,0|2,0,1]=4 36 B11R1.81 CCSc1cnc([nH]c1=O)N 62a_100012456729_100000210202 [0,0,1,0,0,0|2,0,1]=4 37 B11R1.81 Nc1ncc(c(=O)[nH]1)SCF 62a_100012456729_100015361967 [0,0,1,0,0,0|2,0,1]=4 38 B11R1.464 C=Cc1c(nc([nH]c1=O)O)C 271570a_100011290941_100000187651 [0,0,1,0,0,0|2,0,1]=4 39 B11R1.464 N#Cc1c(nc([nH]c1=O)N)O 271570a_203496583355_200009962605 [0,0,1,0,0,0|2,0,1]=4 40 B10R1.30 C=Cc1nc(ccc1C)N 271570a_100011290941_100000126722 [1,0,1,0,0,0|2,0,0]=4 41 B10R1.30 C=Cc1nc(ncc1C)N 271570a_100011290941_100000016107 [1,0,1,0,0,0|1,0,1]=4 42 B10R1.10 CC=Cc1cc[nH]c(=O)c1 271570a_100016259895_100009816521 [1,0,1,0,0,0|2,0,0]=4 43 B10R1.10 CC=Cc1cc[nH]c(=O)n1 271570a_100016259895_200000134032 [1,0,1,0,0,0|2,0,0]=4 44 B10R1.10 CC=Cc1cccc(n1)N 271570a_100016259895_100000740741 [1,0,1,0,0,0|2,0,0]=4 45 B10R1.10 CC=Cc1ccnc(n1)N 271570a_100016259895_100009820717 [1,0,1,0,0,0|1,0,1]=4 46 B10R1.10 CCSc1cc(=O)[nH]cn1 62a_100012002517_100000210202 [1,0,1,0,0,0|1,0,1]=4 47 B10R1.25 C=Cc1cnc([nH]c1=O)C 271570a_100011290941_100011999157 [1,0,1,0,0,0|1,0,1]=4 48 B10R1.25 C=Cc1cnc([nH]c1=O)N 271570a_100011290941_100012456729 [1,0,1,0,0,0|0,0,1]=3 49 B10R1.25 C=Cc1cnc([nH]c1=O)O 271570a_100011290941_100011215686 [1,0,1,0,0,0|1,0,1]=4 50 B10R1.25 CSc1cnc([nH]c1=O)N 62a_100012456729_200000210301 [1,0,1,0,0,0|1,0,1]=4 51 B10R1.25 [13CH3]Sc1cnc([nH]c1=O)N 62a_100012456729_200025704644 [1,0,1,0,0,0|1,0,1]=4 52 B10R1.245 C=Cc1c(nc[nH]c1=O)C 271570a_100011290941_100011356812 [1,0,1,0,0,0|1,0,1]=4 53 B12R1.234 C=Cc1nc([nH]c(=O)c1C#N)N 271570a_100011290941_200009962605 [0,1,1,0,0,0|1,0,1]=4 54 B12R1.100 CC=NNc1cc(=O)[nH]c(=O)[nH]1 4a_100000014984_200000210099 [0,1,1,0,0,0|1,0,1]=4 55 B12R1.101 CC(=O)Cc1cc(=O)[nH]c(n1)O 1458a_100000070787_100000185147 [0,1,1,0,0,0|2,0,0]=4 56 B12R1.69 C=CCSc1cnc([nH]c1=O)C 62a_100000210623_100011999157 [0,1,1,0,0,0|2,0,0]=4 57 B12R1.69 C=CCSc1cnc([nH]c1=O)C 62a_100011999157_100000210623 [0,1,1,0,0,0|2,0,0]=4 58 B12R1.69 C=CCSc1cnc([nH]c1=O)N 62a_100012456729_100000210623 [0,1,1,0,0,0|1,0,0]=3 59 B12R1.69 C=CCSc1cnc([nH]c1=O)O 62a_100000210623_100011215686 [0,1,1,0,0,0|2,0,0]=4 60 B12R1.69 CCCCc1cnc([nH]c1=O)N 271570a_100020621405_100012456729 [0,1,1,0,0,0|1,0,1]=4 61 B12R1.69 CCCSc1cnc([nH]c1=O)N 62a_100012456729_100000210303 [0,1,1,0,0,0|1,0,1]=4 62 B12R1.69 COCSc1cnc([nH]c1=O)N 62a_100012456729_100000766300 [0,1,1,0,0,0|2,0,0]=4 63 B12R1.69 CSCSc1cnc([nH]c1=O)N 62a_100012456729_100011218213 [0,1,1,0,0,0|2,0,0]=4 64 B12R1.69 Cc1ncc(c(=O)[nH]1)SCC=O 62a_100011999157_200015260668 [0,1,1,0,0,0|2,0,0]=4 65 B12R1.69 Cc1ncc(c(=O)[nH]1)SCC=O 62a_200015260668_100011999157 [0,1,1,0,0,0|2,0,0]=4 66 B12R1.69 N#CCSc1cnc([nH]c1=O)N 62a_100012456729_100011215382 [0,1,1,0,0,0|0,0,2]=4 67 B12R1.69 Nc1ncc(c(=O)[nH]1)SCC=O 62a_100012456729_200015260668 [0,1,1,0,0,0|1,0,0]=3 68 B12R1.69 Nc1ncc(c(=O)[nH]1)SCCF 62a_100012456729_100011217306 [0,1,1,0,0,0|1,0,1]=4 69 B12R1.69 Nc1ncc(c(=O)[nH]1)SCCO 62a_100012456729_100000211926 [0,1,1,0,0,0|1,0,1]=4 70 B12R1.69 O=CCSc1cnc([nH]c1=O)O 62a_200015260668_100011215686 [0,1,1,0,0,0|2,0,0]=4 71 B12R1.233 CC(=Cc1cnc([nH]c1=O)N)C 271570a_100102525489_100012456729 [0,1,1,0,0,0|1,0,1]=4 72 B12R2.202 O=c1[nH]cnc2c1cc(s2)O 271570a_203496583355_100010062239 [1,1,0,0,0,0|1,0,1]=4 73 B12R2.203 O=c1[nH]cnc2c1c(c[nH]2)O 271570a_203496583355_100010220714 [1,1,0,0,0,0|0,0,2]=4 74 B14R2.8045 Nc1nc2c(cccc2c(=O)[nH]1)O 271570a_203496583355_100010142784 [0,1,0,0,0,1|1,0,1]=4 75 B14R2.8235 Cc1nc2cnc(cc2c(=O)[nH]1)O 271570a_203496583355_100011016189 [0,1,0,0,0,1|1,0,1]=4 76 B14R2.8235 Nc1nc2ccc(cc2c(=O)[nH]1)O 271570a_203496583355_100009815394 [0,1,0,0,0,1|1,0,1]=4 77 B14R2.8235 Nc1nc2ncc(cc2c(=O)[nH]1)O 271570a_203496583355_100009814897 [0,1,0,0,0,1|0,0,1]=3 78 B14R2.587 C=C=Cc1nc2nc[nH]c2c(=O)[nH]1 271570a_100015277604_100009812310 [0,2,0,0,0,0|2,0,0]=4 79 B14R2.587 CC=Cc1nc2nc[nH]c2c(=O)[nH]1 271570a_100016259895_100009812310 [0,2,0,0,0,0|2,0,0]=4 80 B14R2.587 CCNc1nc2nc[nH]c2c(=O)[nH]1 27a_100015525214_100020644719 [0,2,0,0,0,0|1,0,0]=3 81 B14R2.587 CCSc1nc2nc[nH]c2c(=O)[nH]1 62a_100000210202_100020644719 [0,2,0,0,0,0|2,0,0]=4 82 B14R2.587 CNCc1nc2ccsc2c(=O)[nH]1 2230a_106832991635_100000184302 [0,2,0,0,0,0|2,0,0]=4 83 B14R2.587 CNCc1nc2ccsc2c(=O)[nH]1 7a_106832991635_100000184302 [0,2,0,0,0,0|2,0,0]=4 84 B14R2.587 O=c1[nH]c(nc2c1[nH]cn2)SCF 62a_100015361967_100020644719 [0,2,0,0,0,0|2,0,0]=4 85 B14R2.8824 C=C(C)c1nc2nc[nH]c2c(=O)[nH]1 271570a_100000694244_100009812310 [0,2,0,0,0,0|2,0,0]=4 86 B14R2.8824 CN(C)c1nc2nc[nH]c2c(=O)[nH]1 27a_100102631434_100020644719 [0,2,0,0,0,0|1,0,0]=3 87 B14R2.11787 CNc1nc2cc[nH]c2c(=O)n1C 27a_100102657272_100150720343 [0,2,0,0,0,0|2,0,0]=4 88 B14R2.38331 C=Cc1nc2c(=O)[nH]c(nc2[nH]1)N 271570a_100011290941_200009813169 [0,2,0,0,0,0|1,0,1]=4 89 B14R2.38331 CNc1nc2c(=O)[nH]c(nc2[nH]1)N 27a_100102657272_200009813169 [0,2,0,0,0,0|1,0,1]=4 90 B12R2.1317 Nc1ncc(c(=O)[nH]1)C2CC2 271570a_100011220607_100012456729 [0,0,1,1,0,0|1,0,1]=4