0 B11R1.172 CC(=O)NCCn1cccn1 CSC011671154 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.172 CC(C)CNCc1ccco1 CSC000200082 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.172 CC(C)CNCc1cccs1 CSC000187049 [0,0,0,0,0,0|2,1,1]=4 3 B11R1.172 CC(O)CNCc1ccco1 CSC000202024 [0,0,0,0,0,0|1,0,2]=3 4 B11R1.172 CC(O)CNCc1cccs1 CSC000186852 [0,0,0,0,0,0|1,1,2]=4 5 B10R1.21 CCCNCc1cccs1 CSC000186944 [1,0,0,0,0,0|1,1,1]=4 6 B10R1.21 OCCNCc1ccco1 CSC000200452 [1,0,0,0,0,0|1,0,2]=4 7 B12R1.105 CC(=C)CNCc1ccc(s1)Br CSC011645356 [0,1,0,0,0,0|2,1,0]=4 8 B12R1.105 CC(C)CNCc1ccc(o1)C CSC000201420 [0,1,0,0,0,0|2,0,1]=4 9 B12R1.105 CC(O)CNCc1ccc(o1)C CSC000202040 [0,1,0,0,0,0|1,0,2]=4 10 B12R1.477 CNC(=O)CSCc1cnns1 CSC061669913 [0,1,0,0,0,0|2,1,0]=4 11 B12R1.477 COC(=O)CSCc1ccco1 CSC011204649 [0,1,0,0,0,0|0,0,0]=1 12 B10R0.3 CCOC(=O)CSCC(=O)C CSC000172134 [0,0,1,0,0,0|1,0,2]=4 13 B10R1.66 CC(=O)NCc1cccs1 CSC000154743 [0,0,0,0,1,0|1,1,0]=3 14 B10R1.66 CC(C)SCc1ccco1 CSC000028915 [0,0,0,0,1,0|1,0,1]=3 15 B12R1.252 CC(=C)CNCc1ccccc1 CSC000224140 [0,0,0,0,0,1|3,0,0]=4 16 B12R1.252 CC(=O)CCSc1ccccc1 CSC000208507 [0,0,0,0,0,1|3,0,0]=4 17 B12R1.252 CC(=O)CCSc1ccccn1 CSC000208669 [0,0,0,0,0,1|3,0,0]=4 18 B12R1.252 CC(=O)CSCc1ccccc1 CSC000172147 [0,0,0,0,0,1|1,0,0]=2 19 B12R1.252 CC(=O)NCCc1ccccc1 CSC000153396 [0,0,0,0,0,1|3,0,0]=4 20 B12R1.252 CC(=O)OCCc1ccccc1 CSC000024547 [0,0,0,0,0,1|3,0,0]=4 21 B12R1.252 NC(=O)CCCc1ccccc1 CSC011273634 [0,0,0,0,0,1|3,0,0]=4 22 B12R1.252 NC(=O)CSCc1ccccc1 CSC000149389 [0,0,0,0,0,1|2,0,0]=3 23 B12R1.255 CC(C)CCNCc1ccco1 CSC000200831 [0,0,0,0,0,1|2,0,1]=4 24 B12R1.255 NC(=O)CCNCc1ccco1 CSC000177373 [0,0,0,0,0,1|2,0,0]=3 25 B9R0.1 COC(=O)CSCC(=O)C CSC000151549 [1,0,1,0,0,0|1,0,1]=4 26 B9R1.12 CCNCc1cccs1 CSC000186918 [2,0,0,0,0,0|1,1,0]=4 27 B9R1.12 CCSCc1ccco1 CSC000028914 [2,0,0,0,0,0|0,0,0]=2 28 B11R1.4 CCCCNCc1ccco1 CSC000200681 [1,1,0,0,0,0|1,0,1]=4 29 B11R1.4 OCCCNCc1ccco1 CSC000200620 [1,1,0,0,0,0|1,0,1]=4 30 B11R1.25 CCC(C)NCc1ccco1 CSC000199867 [1,1,0,0,0,0|1,0,1]=4 31 B11R1.27 CCCNCc1ccc(o1)Br CSC000201683 [1,1,0,0,0,0|1,0,1]=4 32 B11R1.27 CCCNCc1ccc(o1)C CSC000201666 [1,1,0,0,0,0|1,0,1]=4 33 B11R1.90 CC(=O)CSc1nccn1C CSC000149187 [0,1,0,0,1,0|2,0,0]=4 34 B11R1.510 CS(=O)(=O)NCc1ccco1 CSC000170911 [0,1,0,0,1,0|2,0,0]=4 35 B13R1.149 NC(=O)CSCc1cccc(c1)Cl CSC000162069 [0,1,0,0,0,1|2,0,0]=4 36 B13R1.158 Cc1ccccc1CSCC(=O)N CSC000148330 [0,1,0,0,0,1|2,0,0]=4 37 B13R1.158 NC(=O)CSCc1ccccc1Br CSC000148301 [0,1,0,0,0,1|2,0,0]=4 38 B13R1.158 NC(=O)CSCc1ccccc1Cl CSC000164481 [0,1,0,0,0,1|2,0,0]=4 39 B13R1.351 CC(SCc1ccccc1)C(=O)N CSC000149388 [0,1,0,0,0,1|2,0,0]=4 40 B13R1.513 NC(=O)CSCc1ccc(cc1)F CSC000162057 [0,1,0,0,0,1|2,0,0]=4 41 B13R1.718 CNC(=O)CSCc1ccccc1 CSC000149384 [0,1,0,0,0,1|1,0,0]=3 42 B13R1.718 COC(=O)CCCc1ccccc1 CSC011295115 [0,1,0,0,0,1|2,0,0]=4 43 B13R1.718 COC(=O)CSCc1ccccc1 CSC000151540 [0,1,0,0,0,1|1,0,0]=3 44 B13R1.718 COC(=O)CSCc1cccnc1 CSC000043084 [0,1,0,0,0,1|1,0,0]=3 45 B13R1.128 OC(=O)CCNCc1ccc(o1)Br CSC011260722 [0,1,0,0,0,1|2,0,0]=4 46 B13R1.536 CCC(=O)NCCCc1ccco1 CSC046968056 [0,1,0,0,0,1|1,0,0]=3 47 B13R1.717 CNC(=O)CSCc1cc(no1)C CSC016343684 [0,2,0,0,0,0|1,0,0]=3 48 B13R1.717 CNC(=O)CSCc1cc(on1)C CSC016343685 [0,2,0,0,0,0|2,0,0]=4 49 B13R1.717 CNC(=O)CSCc1nc(no1)C CSC016344797 [0,2,0,0,0,0|2,0,0]=4 50 B13R1.717 CNC(=O)CSCc1ncc(o1)C CSC016344799 [0,2,0,0,0,0|1,0,0]=3 51 B13R1.3424 CN(CC(=O)O)Cc1ccc(o1)Br CSC011296753 [0,2,0,0,0,0|2,0,0]=4 52 B13R1.3425 CC(SCc1cc(no1)C)C(=O)N CSC016355856 [0,2,0,0,0,0|2,0,0]=4 53 B13R1.3425 CC(SCc1nc(no1)C)C(=O)C CSC016343874 [0,2,0,0,0,0|2,0,0]=4 54 B13R1.3425 CC(SCc1nnc(o1)C)C(=O)C CSC016343890 [0,2,0,0,0,0|2,0,0]=4 55 B13R1.554 CNC(=O)C(=O)NCc1ccco1 CSC000027865 [0,2,0,0,0,0|1,0,1]=4 56 B13R1.1074 CC(C)(NCc1ccco1)C(=O)O CSC011458585 [0,2,0,0,0,0|2,0,0]=4 57 B9R1.13 NC(=O)Cc1cccs1 CSC000162174 [0,0,0,0,2,0|1,1,0]=4 58 B11R1.28 CCCSCc1ccccc1 CSC000006446 [1,0,0,0,0,1|1,0,1]=4 59 B13R1.337 CC(=O)OCCCc1ccccc1 CSC000006332 [0,0,0,0,0,2|2,0,0]=4