0 B13R2.4899 Cn1c(nc2cc[nH]c2c1=O)O 271570a_203496583355_100150720343 [0,0,0,0,0,0|1,0,2]=3 1 B12R2.246 O=c1[nH]c(nc2c1[nH]cn2)O 271570a_203496583355_100009812310 [1,0,0,0,0,0|0,0,2]=3 2 B14R2.11787 C=Cc1nc2cc[nH]c2c(=O)n1C 271570a_100011290941_100150720343 [0,1,0,0,0,0|2,0,1]=4 3 B14R2.11787 CNc1nc2cc[nH]c2c(=O)n1C 27a_100102657272_100150720343 [0,1,0,0,0,0|2,0,1]=4 4 B14R2.11787 CSc1nc2cc[nH]c2c(=O)n1C 62a_200000210301_100150720343 [0,1,0,0,0,0|1,1,1]=4 5 B14R2.11787 Cn1c(nc2cc[nH]c2c1=O)S[13CH3] 62a_200025704644_100150720343 [0,1,0,0,0,0|1,1,1]=4 6 B12R1.44 C=C=Cc1cc(=O)n(c(=O)[nH]1)C 271570a_100015277604_100000723047 [0,0,1,0,0,0|2,0,1]=4 7 B12R1.44 CC=Cc1cc(=O)n(c(=O)[nH]1)C 271570a_100016259895_100000723047 [0,0,1,0,0,0|2,0,0]=3 8 B12R1.44 CCNc1cc(=O)n(c(=O)[nH]1)C 27a_100015525214_100000723047 [0,0,1,0,0,0|1,0,2]=4 9 B12R1.44 CCSc1cc(=O)n(c(=O)[nH]1)C 62a_100000210202_100000723047 [0,0,1,0,0,0|2,0,1]=4 10 B12R1.44 CCSc1cc(=O)n(c(=O)[nH]1)C 62a_100000723047_100000210202 [0,0,1,0,0,0|2,0,1]=4 11 B12R1.44 Cn1c(=O)cc([nH]c1=O)SCF 62a_100000723047_100015361967 [0,0,1,0,0,0|2,0,1]=4 12 B12R1.44 Cn1c(=O)cc([nH]c1=O)SCF 62a_100015361967_100000723047 [0,0,1,0,0,0|2,0,1]=4 13 B12R1.98 C=Cc1c(n(c(=O)[nH]c1=O)C)N 271570a_100011290941_100000184672 [0,0,1,0,0,0|3,0,0]=4 14 B12R1.108 C/C=C(\C)/C(=O)Cc1c[nH]cn1 1458a_100020587367_100000707719 [0,0,1,0,0,0|3,0,0]=4 15 B12R1.108 C=CC(C)C(=O)Cc1c[nH]cn1 1458a_100011216780_100000707719 [0,0,1,0,0,0|3,0,0]=4 16 B12R1.108 CCN(C)C(=O)Cc1c[nH]cn1 240690a_100000225621_100015291406 [0,0,1,0,0,0|2,0,1]=4 17 B12R1.291 CC=Cc1nc[nH]c1C(=O)OC 271570a_100016259895_100010290838 [0,0,1,0,0,0|3,0,0]=4 18 B11R1.8 C=Cc1[nH]c(=O)[nH]c(=O)c1C 271570a_100011290941_200009866310 [1,0,1,0,0,0|2,0,0]=4 19 B11R1.14 C=Cc1cc(=O)n(c(=O)[nH]1)C 271570a_100011290941_100000723047 [1,0,1,0,0,0|1,0,0]=3 20 B11R1.14 CNc1cc(=O)n(c(=O)[nH]1)C 27a_100102657272_100000723047 [1,0,1,0,0,0|0,0,2]=4 21 B11R1.14 CSc1cc(=O)n(c(=O)[nH]1)C 62a_100000723047_200000210301 [1,0,1,0,0,0|1,0,1]=4 22 B11R1.14 CSc1cc(=O)n(c(=O)[nH]1)C 62a_200000210301_100000723047 [1,0,1,0,0,0|1,0,1]=4 23 B11R1.14 Cn1c(=O)cc([nH]c1=O)S[13CH3] 62a_100000723047_200025704644 [1,0,1,0,0,0|1,0,1]=4 24 B11R1.14 Cn1c(=O)cc([nH]c1=O)S[13CH3] 62a_200025704644_100000723047 [1,0,1,0,0,0|1,0,1]=4 25 B11R1.277 C=Cc1cn(c(=O)[nH]c1=O)C 271570a_100011290941_100000185368 [1,0,1,0,0,0|2,0,0]=4 26 B11R1.277 CNc1cn(c(=O)[nH]c1=O)C 27a_100102657272_100000185368 [1,0,1,0,0,0|1,0,1]=4 27 B11R1.34 CC=Cc1cc(=O)[nH]c(=O)[nH]1 271570a_100016259895_100000015670 [1,0,1,0,0,0|2,0,0]=4 28 B11R1.35 C=C(C)C(=O)Cc1c[nH]cn1 1458a_100000185857_100000707719 [1,0,1,0,0,0|2,0,0]=4 29 B11R1.35 CN(C)C(=O)Cc1c[nH]cn1 240690a_100102631434_100015291406 [1,0,1,0,0,0|1,0,1]=4 30 B11R1.59 C=Cc1nc[nH]c1C(=O)OC 271570a_100011290941_100010290838 [1,0,1,0,0,0|2,0,0]=4 31 B13R1.136 C=CCNc1cc(=O)n(c(=O)[nH]1)C 27a_100020586998_100000723047 [0,1,1,0,0,0|1,0,1]=4 32 B13R1.136 C=CCSc1cc(=O)n(c(=O)[nH]1)C 62a_100000210623_100000723047 [0,1,1,0,0,0|2,0,0]=4 33 B13R1.136 C=CCSc1cc(=O)n(c(=O)[nH]1)C 62a_100000723047_100000210623 [0,1,1,0,0,0|2,0,0]=4 34 B13R1.136 Cn1c(=O)cc([nH]c1=O)SCC=O 62a_100000723047_200015260668 [0,1,1,0,0,0|2,0,0]=4 35 B13R1.136 Cn1c(=O)cc([nH]c1=O)SCC=O 62a_200015260668_100000723047 [0,1,1,0,0,0|2,0,0]=4 36 B13R1.3763 CC(=Cc1cc(=O)n(c(=O)[nH]1)C)C 271570a_100102525489_100000723047 [0,1,1,0,0,0|2,0,0]=4 37 B13R1.66 C=CCN(C)C(=O)Cc1c[nH]cn1 240690a_100000225617_100015291406 [0,1,1,0,0,0|2,0,0]=4 38 B13R1.346 CC(=O)C(C)C(=O)Cc1c[nH]cn1 1458a_100015291406_100000179758 [0,1,1,0,0,0|2,0,0]=4 39 B13R1.346 CC(C(=O)N)C(=O)Cc1c[nH]cn1 1458a_100015291406_100000702099 [0,1,1,0,0,0|2,0,0]=4 40 B13R1.581 COC(=O)c1[nH]cnc1SCC=O 62a_200015260668_100010290838 [0,1,1,0,0,0|2,0,0]=4 41 B13R2.654 C=Cc1nc2nc[nH]c2c(=O)[nH]1 271570a_100011290941_100009812310 [1,1,0,0,0,0|1,0,1]=4 42 B13R2.654 CNc1nc2nc[nH]c2c(=O)[nH]1 27a_100102657272_100020644719 [1,1,0,0,0,0|1,0,1]=4 43 B13R2.654 CSc1nc2nc[nH]c2c(=O)[nH]1 62a_200000210301_100020644719 [1,1,0,0,0,0|0,1,1]=4 44 B13R2.654 [13CH3]Sc1nc2nc[nH]c2c(=O)[nH]1 62a_200025704644_100020644719 [1,1,0,0,0,0|0,1,1]=4 45 B13R2.3742 O=c1[nH]c(=O)c2scc(c2[nH]1)O 271570a_203496583355_100010246816 [1,1,0,0,0,0|2,0,0]=4 46 B13R2.5397 O=c1[nH]c(=O)c2nc([nH]c2[nH]1)O 271570a_203496583355_100010005409 [1,1,0,0,0,0|0,0,2]=4 47 B15R2.60801 Cn1c(=O)c2[nH]c(nc2n(c1=O)C)O 271570a_203496583355_100000185366 [0,2,0,0,0,0|0,0,0]=2 48 B13R1.554 C/C=C(\C)/C(=O)NCc1c[nH]cn1 11a_100000758547_100020587367 [0,0,1,0,0,1|2,0,0]=4 49 B13R1.554 C=CC(C)C(=O)NCc1c[nH]cn1 11a_100000758547_100011216780 [0,0,1,0,0,1|2,0,0]=4 50 B13R1.554 C=CC(C)C(=O)NCc1c[nH]cn1 240690a_100000758547_100011216780 [0,0,1,0,0,1|2,0,0]=4 51 B13R1.554 C=CC(C)C(=O)NCc1c[nH]cn1 527a_100000758547_100011216780 [0,0,1,0,0,1|2,0,0]=4 52 B13R1.554 CCN(C)C(=O)NCc1c[nH]cn1 2708a_100000758547_100000225621 [0,0,1,0,0,1|1,0,1]=4 53 B13R1.554 CCN(C)C(=O)NCc1c[nH]cn1 273464a_100000758547_100000225621 [0,0,1,0,0,1|1,0,1]=4