0 B10R1.66 CC(=O)NCc1cccs1 CSC000154743 [0,0,0,0,0,0|1,1,0]=2 1 B10R1.66 CC(C)SCc1ccco1 CSC000028915 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.12 CCNCc1cccs1 CSC000186918 [1,0,0,0,0,0|1,1,1]=4 3 B9R1.12 CCSCc1ccco1 CSC000028914 [1,0,0,0,0,0|1,0,1]=3 4 B11R1.25 CCC(=O)NCc1ccco1 CSC000157649 [0,1,0,0,0,0|1,0,0]=2 5 B11R1.25 CCC(C)NCc1ccco1 CSC000199867 [0,1,0,0,0,0|2,0,1]=4 6 B11R1.25 CNC(=O)NCc1ccco1 CSC000233838 [0,1,0,0,0,0|1,0,0]=2 7 B11R1.25 CNC(=O)NCc1cccs1 CSC000233839 [0,1,0,0,0,0|1,1,0]=3 8 B11R1.25 COC(=O)C=Cc1cccs1 CSC000004362 [0,1,0,0,0,0|0,1,2]=4 9 B11R1.25 COC(=O)CCn1cccc1 CSC000181648 [0,1,0,0,0,0|2,0,0]=3 10 B11R1.25 COC(=O)CCn1ccnc1 CSC000176960 [0,1,0,0,0,0|3,0,0]=4 11 B11R1.25 NCC(=O)NCc1ccsc1 CSC011832688 [0,1,0,0,0,0|3,0,0]=4 12 B11R1.25 NNC(=O)CCc1ccco1 CSC000190050 [0,1,0,0,0,0|1,0,0]=2 13 B11R1.35 CN(Cc1ccsc1)C(=O)C CSC000204070 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.75 CC(=O)OCc1nc(no1)C CSC000026107 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.75 Cc1csc(n1)CCC(=O)N CSC000083491 [0,1,0,0,0,0|2,1,0]=4 16 B11R1.75 NC(=O)CCn1cc(cn1)Br CSC011400269 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.75 NC(=O)CCn1cc(cn1)I CSC012072801 [0,1,0,0,0,0|3,0,0]=4 18 B11R1.75 NC(=O)CCn1cc(cn1)I CSC012072801 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.90 CC(=O)CSc1nccn1C CSC000149187 [0,1,0,0,0,0|3,0,0]=4 20 B11R1.510 CC(C)(C)NCc1ccco1 CSC000216215 [0,1,0,0,0,0|2,0,1]=4 21 B11R1.510 CS(=O)(=O)NCc1ccco1 CSC000170911 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.510 CS(=O)(=O)NCc1cccs1 CSC000180765 [0,1,0,0,0,0|2,1,0]=4 23 B9R0.48 CCOC(=O)CCC(=O)C CSC011212338 [0,0,1,0,0,0|1,0,2]=4 24 B9R1.13 CC(=O)Nc1ccsc1 CSC000755801 [0,0,0,0,1,0|3,0,0]=4 25 B9R1.13 NC(=O)Cc1cccs1 CSC000162174 [0,0,0,0,1,0|1,1,0]=3 26 B9R1.13 NC(=O)Cc1ccsc1 CSC000162286 [0,0,0,0,1,0|3,0,0]=4 27 B11R1.91 CC(=C)COc1ccccc1 CSC000171512 [0,0,0,0,0,1|3,0,0]=4 28 B11R1.91 CC(=C)CSc1ccccc1 CSC000006268 [0,0,0,0,0,1|3,0,0]=4 29 B11R1.91 CC(=O)NCc1cccnc1 CSC000154915 [0,0,0,0,0,1|2,0,0]=3 30 B11R1.91 CC(=O)NCc1ccncc1 CSC000154903 [0,0,0,0,0,1|2,0,0]=3 31 B11R1.91 CC(=O)NNc1ccccc1 CSC000153448 [0,0,0,0,0,1|3,0,0]=4 32 B11R1.91 CC(=O)OCc1ccccc1 CSC000000625 [0,0,0,0,0,1|2,0,0]=3 33 B11R1.91 NC(=O)COc1ccccc1 CSC000150575 [0,0,0,0,0,1|3,0,0]=4 34 B11R1.91 NC(=O)CSc1ccccn1 CSC000149794 [0,0,0,0,0,1|3,0,0]=4 35 B11R1.91 NC(=O)CSc1ncccn1 CSC000148889 [0,0,0,0,0,1|3,0,0]=4 36 B11R1.91 OC(=O)CSc1ccccn1 CSC000156281 [0,0,0,0,0,1|3,0,0]=4 37 B11R1.172 CC(=O)NCCn1cccn1 CSC011671154 [0,0,0,0,0,1|2,0,0]=3 38 B11R1.172 CC(C)CNCc1ccco1 CSC000200082 [0,0,0,0,0,1|1,0,1]=3 39 B11R1.172 CC(C)CNCc1cccs1 CSC000187049 [0,0,0,0,0,1|1,1,1]=4 40 B11R1.172 CC(O)CNCc1ccco1 CSC000202024 [0,0,0,0,0,1|0,0,2]=3 41 B11R1.172 CC(O)CNCc1cccs1 CSC000186852 [0,0,0,0,0,1|0,1,2]=4 42 B8R1.8 CCSc1cccs1 CSC009829625 [2,0,0,0,0,0|1,1,0]=4 43 B10R1.21 CCCNCc1cccs1 CSC000186944 [1,1,0,0,0,0|0,1,1]=4 44 B10R1.21 OCCNCc1ccco1 CSC000200452 [1,1,0,0,0,0|0,0,2]=4 45 B12R1.21 CC(=O)COc1ccc(cc1)Cl CSC000150450 [0,1,0,0,0,1|2,0,0]=4 46 B12R1.21 CC(=O)CSc1ccc(cc1)C CSC000172844 [0,1,0,0,0,1|2,0,0]=4 47 B12R1.21 CC(=O)CSc1ccc(cc1)Cl CSC000150472 [0,1,0,0,0,1|2,0,0]=4 48 B12R1.21 CC(=O)CSc1ccc(cc1)F CSC000148136 [0,1,0,0,0,1|2,0,0]=4 49 B12R1.21 CC(=O)NCc1ccc(cc1)C CSC000154265 [0,1,0,0,0,1|2,0,0]=4 50 B12R1.21 CC(=O)NCc1ccc(cc1)Cl CSC000152849 [0,1,0,0,0,1|2,0,0]=4 51 B12R1.21 CC(=O)NCc1ccc(cc1)F CSC000152308 [0,1,0,0,0,1|2,0,0]=4 52 B12R1.21 NC(=O)CCc1ccc(cc1)Cl CSC000022186 [0,1,0,0,0,1|2,0,0]=4 53 B12R1.27 CCC(=O)NCc1ccccc1 CSC000153145 [0,1,0,0,0,1|2,0,0]=4 54 B12R1.27 CCC(=O)NCc1ccccn1 CSC000154896 [0,1,0,0,0,1|2,0,0]=4 55 B12R1.27 CCC(=O)NCc1cccnc1 CSC000154920 [0,1,0,0,0,1|2,0,0]=4 56 B12R1.27 CCC(=O)NCc1ccncc1 CSC000154908 [0,1,0,0,0,1|2,0,0]=4 57 B12R1.27 CCC(=O)OCc1ccccc1 CSC000000848 [0,1,0,0,0,1|2,0,0]=4 58 B12R1.27 CNC(=O)CCc1ccccc1 CSC000159837 [0,1,0,0,0,1|1,0,0]=3 59 B12R1.27 CNC(=O)COc1ccccc1 CSC000150564 [0,1,0,0,0,1|2,0,0]=4 60 B12R1.27 CNC(=O)CSc1ccccc1 CSC000150703 [0,1,0,0,0,1|2,0,0]=4 61 B12R1.27 CNC(=O)NCc1ccccc1 CSC000222791 [0,1,0,0,0,1|2,0,0]=4 62 B12R1.27 CNC(=O)NCc1ccccn1 CSC000233842 [0,1,0,0,0,1|2,0,0]=4 63 B12R1.27 CNC(=O)NCc1cccnc1 CSC000233843 [0,1,0,0,0,1|2,0,0]=4 64 B12R1.27 CNC(=O)NCc1ccncc1 CSC000235220 [0,1,0,0,0,1|2,0,0]=4 65 B12R1.27 COC(=O)COc1ccccc1 CSC000148705 [0,1,0,0,0,1|2,0,0]=4 66 B12R1.27 COC(=O)CSc1ccccc1 CSC000151200 [0,1,0,0,0,1|2,0,0]=4 67 B12R1.27 COC(=O)CSc1ccccn1 CSC000156013 [0,1,0,0,0,1|2,0,0]=4 68 B12R1.27 COC(=O)CSc1ncccn1 CSC000148893 [0,1,0,0,0,1|2,0,0]=4 69 B12R1.27 COC(=O)NCc1ccccc1 CSC000235978 [0,1,0,0,0,1|2,0,0]=4 70 B12R1.27 NNC(=O)CCc1ccccc1 CSC000189782 [0,1,0,0,0,1|2,0,0]=4 71 B12R1.27 OCC(=O)NCc1ccccc1 CSC000246335 [0,1,0,0,0,1|2,0,0]=4 72 B12R1.43 CN(Cc1ccccc1)C(=O)C CSC000152884 [0,1,0,0,0,1|2,0,0]=4 73 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)N CSC011423145 [0,1,0,0,0,1|2,0,0]=4 74 B12R1.107 CC(NC(=O)C)c1ccccc1 CSC000158019 [0,1,0,0,0,1|2,0,0]=4 75 B12R1.107 CC(OC(=O)C)c1ccccc1 CSC000000578 [0,1,0,0,0,1|2,0,0]=4 76 B12R1.107 C[C@@H](NC(=O)C)c1ccccc1 CSC011908465 [0,1,0,0,0,1|2,0,0]=4 77 B12R1.107 C[C@H](NC(=O)C)c1ccccc1 CSC011908453 [0,1,0,0,0,1|2,0,0]=4 78 B12R1.125 CC(=O)NCc1ccccc1Br CSC011237613 [0,1,0,0,0,1|2,0,0]=4 79 B12R1.125 CC(=O)NCc1ccccc1C CSC000175807 [0,1,0,0,0,1|2,0,0]=4 80 B12R1.125 CC(=O)NCc1ccccc1Cl CSC000155626 [0,1,0,0,0,1|2,0,0]=4 81 B12R1.125 CC(=O)NCc1cnccc1C CSC013037028 [0,1,0,0,0,1|2,0,0]=4 82 B12R1.125 CC(=O)OCc1ccccc1C CSC000000619 [0,1,0,0,0,1|2,0,0]=4 83 B12R1.125 CC(=O)OCc1ccncc1Cl CSC009843883 [0,1,0,0,0,1|2,0,0]=4 84 B12R1.125 NC(=O)CCc1ccccc1Cl CSC000162028 [0,1,0,0,0,1|2,0,0]=4 85 B12R1.125 NC(=O)CCc1ccccc1F CSC000016472 [0,1,0,0,0,1|2,0,0]=4 86 B12R1.226 CC(=O)NCc1cccc(c1)C CSC011222369 [0,1,0,0,0,1|2,0,0]=4 87 B12R1.105 CC(=C)CNCc1ccc(s1)Br CSC011645356 [0,1,0,0,0,1|1,1,0]=4 88 B12R1.105 CC(C)CNCc1ccc(o1)C CSC000201420 [0,1,0,0,0,1|1,0,1]=4 89 B12R1.105 CC(O)CNCc1ccc(o1)C CSC000202040 [0,1,0,0,0,1|0,0,2]=4 90 B12R1.130 CC(=O)OCCc1scnc1C CSC000024203 [0,1,0,0,0,1|1,1,0]=4 91 B12R1.477 COC(=O)CSCc1ccco1 CSC011204649 [0,1,0,0,0,1|0,0,0]=2 92 B12R1.26 CCC(=O)NCc1cc(no1)C CSC011549870 [0,2,0,0,0,0|2,0,0]=4 93 B12R1.26 COC(=O)CCn1cc(cn1)C CSC011363772 [0,2,0,0,0,0|2,0,0]=4 94 B12R1.26 COC(=O)CCn1cc(cn1)Cl CSC011397940 [0,2,0,0,0,0|2,0,0]=4 95 B12R1.26 NCC(=O)NCc1cc(cs1)Br CSC012054940 [0,2,0,0,0,0|1,1,0]=4 96 B12R1.26 NCC(=O)NCc1ccc(s1)Br CSC011395007 [0,2,0,0,0,0|1,1,0]=4 97 B12R1.26 NCC(=O)NCc1ccc(s1)Cl CSC011598780 [0,2,0,0,0,0|1,1,0]=4 98 B12R1.51 CCCC(=O)NCc1ccco1 CSC000157646 [0,2,0,0,0,0|1,0,0]=3 99 B12R1.51 CCOC(=O)CCc1ccco1 CSC011212575 [0,2,0,0,0,0|0,0,0]=2 100 B12R1.51 CCOC(=O)CCc1ccsc1 CSC000246246 [0,2,0,0,0,0|2,0,0]=4 101 B12R1.51 CCOC(=O)CSc1cccs1 CSC011243805 [0,2,0,0,0,0|1,1,0]=4 102 B12R1.51 COCC(=O)NCc1ccco1 CSC000157658 [0,2,0,0,0,0|1,0,0]=3 103 B12R1.51 O=C(CC#N)NCc1cccs1 CSC000187834 [0,2,0,0,0,0|1,1,0]=4 104 B12R1.108 CN(Cc1ccco1)C(=O)CN CSC000168344 [0,2,0,0,0,0|1,0,0]=3 105 B12R1.108 CNC(=O)N(C)Cc1cccs1 CSC000235019 [0,2,0,0,0,0|1,1,0]=4 106 B12R1.108 COC(=O)N(C)Cc1ccco1 CSC000236223 [0,2,0,0,0,0|1,0,0]=3 107 B12R1.196 CCS(=O)(=O)NCc1ccco1 CSC000170912 [0,2,0,0,0,0|2,0,0]=4 108 B12R1.353 COC(=O)CCc1scnc1C CSC000080594 [0,2,0,0,0,0|1,1,0]=4 109 B12R1.353 Cc1ccsc1CNC(=O)CN CSC012662819 [0,2,0,0,0,0|1,1,0]=4 110 B12R1.353 NCC(=O)NCc1sccc1Br CSC012759140 [0,2,0,0,0,0|1,1,0]=4 111 B10R1.17 CSCCc1ccncc1 CSC015420737 [1,0,0,0,0,1|2,0,0]=4 112 B12R1.252 CC(=C)CNCc1ccccc1 CSC000224140 [0,0,0,0,0,2|2,0,0]=4 113 B12R1.252 CC(=O)CCSc1ccccc1 CSC000208507 [0,0,0,0,0,2|1,0,0]=3 114 B12R1.252 CC(=O)CCSc1ccccn1 CSC000208669 [0,0,0,0,0,2|1,0,0]=3 115 B12R1.252 CC(=O)CSCc1ccccc1 CSC000172147 [0,0,0,0,0,2|1,0,0]=3 116 B12R1.252 CC(=O)NCCc1ccccc1 CSC000153396 [0,0,0,0,0,2|1,0,0]=3 117 B12R1.252 CC(=O)OCCc1ccccc1 CSC000024547 [0,0,0,0,0,2|1,0,0]=3 118 B12R1.252 NC(=O)CCCc1ccccc1 CSC011273634 [0,0,0,0,0,2|2,0,0]=4 119 B12R1.252 NC(=O)CSCc1ccccc1 CSC000149389 [0,0,0,0,0,2|2,0,0]=4 120 B12R1.252 NC(=O)NCCc1ccccc1 CSC000238938 [0,0,0,0,0,2|2,0,0]=4 121 B12R1.255 CC(C)CCNCc1ccco1 CSC000200831 [0,0,0,0,0,2|1,0,1]=4 122 B12R1.255 NC(=O)CCNCc1ccco1 CSC000177373 [0,0,0,0,0,2|1,0,0]=3