0 B12R2.246 Cc1nc(c2cn[nH]c2n1)O 271570a_203496583355_100000745003 [0,0,0,0,0,0|2,0,2]=4 1 B12R2.246 Nc1cc(c2cc[nH]c2n1)O 271570a_203496583355_100009864914 [0,0,0,0,0,0|3,0,1]=4 2 B12R2.246 Nc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100010185947 [0,0,0,0,0,0|3,0,1]=4 3 B12R2.246 Nc1nc(c2nc[nH]c2n1)O 271570a_203496583355_200000049598 [0,0,0,0,0,0|1,0,2]=3 4 B12R2.246 Nc1nc(nc2c1cn[nH]2)O 271570a_203496583355_100000696086 [0,0,0,0,0,0|3,0,1]=4 5 B12R2.246 O=c1[nH]c(nc2c1[nH]cn2)O 271570a_203496583355_100009812310 [0,0,0,0,0,0|2,0,2]=4 6 B12R2.246 Oc1cc(nc2c1cn[nH]2)F 271570a_203496583355_103551249018 [0,0,0,0,0,0|3,0,1]=4 7 B11R2.36 Oc1ccc2cn[nH]c2n1 271570a_203496583355_100009883947 [1,0,0,0,0,0|3,0,0]=4 8 B11R2.36 Oc1ccc2nc[nH]c2n1 271570a_203496583355_100000077665 [1,0,0,0,0,0|3,0,0]=4 9 B11R2.36 Oc1ccc2nn[nH]c2c1 271570a_203496583355_100009817464 [1,0,0,0,0,0|3,0,0]=4 10 B11R2.106 Oc1ccnc2c1cn[nH]2 271570a_203496583355_100009819725 [1,0,0,0,0,0|2,0,1]=4 11 B11R2.106 Oc1ccnc2c1nc[nH]2 271570a_203496583355_100009820729 [1,0,0,0,0,0|2,0,1]=4 12 B11R2.106 Oc1ccnc2c1nn[nH]2 271570a_203496583355_100009853804 [1,0,0,0,0,0|1,0,1]=3 13 B11R2.106 Oc1ncnc2c1cn[nH]2 271570a_203496583355_100000735611 [1,0,0,0,0,0|1,0,2]=4 14 B13R2.623 C=Cc1nc(nc2c1nc[nH]2)N 271570a_100011290941_200000049598 [0,1,0,0,0,0|2,0,1]=4 15 B13R2.654 CNc1nc(c2cn[nH]c2n1)N 27a_100102657272_100000696086 [0,1,0,0,0,0|2,0,1]=4 16 B13R2.654 CNc1nc(c2nc[nH]c2n1)C 27a_100102657272_100000093496 [0,1,0,0,0,0|2,0,1]=4 17 B13R2.654 CNc1nc(c2nc[nH]c2n1)N 27a_100102657272_100102524922 [0,1,0,0,0,0|2,0,1]=4 18 B13R2.654 CNc1nc2nc[nH]c2c(=O)[nH]1 27a_100102657272_100020644719 [0,1,0,0,0,0|1,0,2]=4 19 B13R2.3742 Cn1cnc2c1nc(nc2O)N 271570a_203496583355_100000708713 [0,1,0,0,0,0|1,0,2]=4 20 B13R2.3742 Cn1ncc2c1nc([nH]c2=O)O 271570a_203496583355_100000057953 [0,1,0,0,0,0|2,0,0]=3 21 B13R2.3742 Cn1ncc2c1nc(nc2O)N 271570a_203496583355_100000144275 [0,1,0,0,0,0|1,0,2]=4 22 B13R2.5397 Nc1nc2[nH]c(nc2c(=O)[nH]1)O 271570a_203496583355_200009813169 [0,1,0,0,0,0|1,0,0]=2 23 B13R2.5397 O=c1[nH]c(=O)c2nc([nH]c2[nH]1)O 271570a_203496583355_100010005409 [0,1,0,0,0,0|2,0,1]=4 24 B13R2.11642 Nc1nc(c2c(n[nH]c2n1)O)N 271570a_203496583355_100010293082 [0,1,0,0,0,0|2,0,1]=4 25 B11R1.81 C=C=Cc1cnc([nH]c1=O)N 271570a_100015277604_100012456729 [0,0,1,0,0,0|3,0,0]=4 26 B11R1.81 CC=Cc1cnc([nH]c1=O)N 271570a_100016259895_100012456729 [0,0,1,0,0,0|3,0,0]=4 27 B11R1.81 CCSc1cnc([nH]c1=O)N 62a_100012456729_100000210202 [0,0,1,0,0,0|3,0,0]=4 28 B11R1.81 Nc1ncc(c(=O)[nH]1)SCF 62a_100012456729_100015361967 [0,0,1,0,0,0|3,0,0]=4 29 B11R1.464 N#Cc1c(nc([nH]c1=O)N)O 271570a_203496583355_200009962605 [0,0,1,0,0,0|2,0,1]=4 30 B10R1.25 C=Cc1cnc([nH]c1=O)N 271570a_100011290941_100012456729 [1,0,1,0,0,0|2,0,0]=4 31 B10R1.25 CSc1cnc([nH]c1=O)N 62a_100012456729_200000210301 [1,0,1,0,0,0|2,0,0]=4 32 B10R1.25 [13CH3]Sc1cnc([nH]c1=O)N 62a_100012456729_200025704644 [1,0,1,0,0,0|2,0,0]=4 33 B10R1.245 CSc1c(nc[nH]c1=O)N 62a_200000210301_200011345422 [1,0,1,0,0,0|2,0,0]=4 34 B10R1.245 CSc1c(nc[nH]c1=O)N 62a_200011345422_200000210301 [1,0,1,0,0,0|2,0,0]=4 35 B10R1.245 [13CH3]Sc1c(nc[nH]c1=O)N 62a_200011345422_200025704644 [1,0,1,0,0,0|2,0,0]=4 36 B10R1.245 [13CH3]Sc1c(nc[nH]c1=O)N 62a_200025704644_200011345422 [1,0,1,0,0,0|2,0,0]=4 37 B12R1.234 CNc1nc([nH]c(=O)c1C#N)N 27a_100102657272_200009962605 [0,1,1,0,0,0|1,0,1]=4 38 B12R2.44 CNc1ccc2cn[nH]c2n1 27a_100102657272_100009883947 [1,1,0,0,0,0|2,0,0]=4 39 B12R2.44 CNc1ncc2cn[nH]c2n1 27a_100102657272_100000063646 [1,1,0,0,0,0|1,0,1]=4 40 B12R2.44 CNc1ncc2nc[nH]c2n1 27a_100102657272_100000009038 [1,1,0,0,0,0|1,0,1]=4 41 B12R2.203 O=c1[nH]cnc2c1c(c[nH]2)O 271570a_203496583355_100010220714 [1,1,0,0,0,0|2,0,0]=4 42 B12R2.203 O=c1[nH]cnc2c1c(n[nH]2)O 271570a_203496583355_100000751889 [1,1,0,0,0,0|1,0,0]=3 43 B12R2.315 C=Cc1ccnc2c1nn[nH]2 271570a_100011290941_100009853804 [1,1,0,0,0,0|2,0,0]=4 44 B12R2.315 CNc1ccnc2c1nn[nH]2 27a_100102657272_100009853804 [1,1,0,0,0,0|2,0,0]=4 45 B12R2.315 CSc1ccnc2c1nn[nH]2 62a_200000210301_100009853804 [1,1,0,0,0,0|1,1,0]=4 46 B12R2.315 [13CH3]Sc1ccnc2c1nn[nH]2 62a_200025704644_100009853804 [1,1,0,0,0,0|1,1,0]=4 47 B14R2.19613 C=Cc1nc2c(cnn2C)c(=O)[nH]1 271570a_100011290941_100000057953 [0,2,0,0,0,0|2,0,0]=4 48 B14R2.19613 CNc1nc2c(cnn2C)c(=O)[nH]1 27a_100102657272_100000057953 [0,2,0,0,0,0|1,0,0]=3 49 B14R2.19613 CSc1nc2c(cnn2C)c(=O)[nH]1 62a_200000210301_100000057953 [0,2,0,0,0,0|2,0,0]=4 50 B14R2.19613 Cn1ncc2c1nc([nH]c2=O)S[13CH3] 62a_200025704644_100000057953 [0,2,0,0,0,0|2,0,0]=4 51 B14R2.38331 C=Cc1nc2c(=O)[nH]c(nc2[nH]1)N 271570a_100011290941_200009813169 [0,2,0,0,0,0|1,0,0]=3 52 B14R2.38331 CNc1nc2c(=O)[nH]c(nc2[nH]1)N 27a_100102657272_200009813169 [0,2,0,0,0,0|1,0,0]=3