0 B11R1.91 CC(=C)COc1ccccc1 CSC000171512 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.91 CC(=C)CSc1ccccc1 CSC000006268 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.91 CC(=O)NCc1cccnc1 CSC000154915 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.91 CC(=O)NCc1ccncc1 CSC000154903 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.91 CC(=O)NNc1ccccc1 CSC000153448 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.91 CC(=O)OCc1ccccc1 CSC000000625 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.91 CC(C)SCc1ccccc1 CSC000006445 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.91 CC(O)CNc1ccccc1 CSC011364939 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.91 NC(=O)C#Cc1ccccc1 CSC000041776 [0,0,0,0,0,0|1,0,2]=3 9 B11R1.91 NC(=O)COc1ccccc1 CSC000150575 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.91 NC(=O)CSc1ccccn1 CSC000149794 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.91 NC(=O)CSc1ncccn1 CSC000148889 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.91 OC(=O)CSc1ccccn1 CSC000156281 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.17 C#CCSc1ccccc1 CSC000172648 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.17 C=CCSc1ccccc1 CSC000006400 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.17 CCCSc1ccccc1 CSC000005822 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.17 CCSCc1ccccc1 CSC000006444 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.17 COCSc1ccccc1 CSC000000817 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.17 CSCCc1ccncc1 CSC015420737 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.17 OCCSc1ccccc1 CSC000230494 [1,0,0,0,0,0|1,0,1]=3 20 B10R1.17 OCCSc1ccccn1 CSC000156319 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.17 OCCSc1ccncc1 CSC011297907 [1,0,0,0,0,0|2,0,1]=4 22 B12R1.21 CC(=O)COc1ccc(cc1)Cl CSC000150450 [0,1,0,0,0,0|2,0,0]=3 23 B12R1.21 CC(=O)CSc1ccc(cc1)C CSC000172844 [0,1,0,0,0,0|2,0,0]=3 24 B12R1.21 CC(=O)CSc1ccc(cc1)Cl CSC000150472 [0,1,0,0,0,0|2,0,0]=3 25 B12R1.21 CC(=O)CSc1ccc(cc1)F CSC000148136 [0,1,0,0,0,0|2,0,0]=3 26 B12R1.21 CC(=O)NCc1ccc(cc1)C CSC000154265 [0,1,0,0,0,0|2,0,0]=3 27 B12R1.21 CC(=O)NCc1ccc(cc1)Cl CSC000152849 [0,1,0,0,0,0|2,0,0]=3 28 B12R1.21 CC(=O)NCc1ccc(cc1)F CSC000152308 [0,1,0,0,0,0|2,0,0]=3 29 B12R1.21 CC(=O)NNc1ccc(cc1)Br CSC009815283 [0,1,0,0,0,0|3,0,0]=4 30 B12R1.21 CC(=O)NNc1ccc(cc1)C CSC000002330 [0,1,0,0,0,0|3,0,0]=4 31 B12R1.21 CC(O)CSc1ccc(cc1)Cl CSC011366763 [0,1,0,0,0,0|2,0,1]=4 32 B12R1.21 Cc1ccc(cc1)CNC(=O)N CSC000238954 [0,1,0,0,0,0|2,0,0]=3 33 B12R1.21 Cc1ccc(cc1)SCC(=O)N CSC000149676 [0,1,0,0,0,0|2,0,0]=3 34 B12R1.21 NC(=O)CCc1ccc(cc1)Cl CSC000022186 [0,1,0,0,0,0|1,0,0]=2 35 B12R1.21 NC(=O)COc1ccc(cc1)Br CSC000150415 [0,1,0,0,0,0|2,0,0]=3 36 B12R1.21 NC(=O)COc1ccc(cc1)Cl CSC000150449 [0,1,0,0,0,0|2,0,0]=3 37 B12R1.21 NC(=O)COc1ccc(cc1)F CSC000150549 [0,1,0,0,0,0|2,0,0]=3 38 B12R1.21 NC(=O)CSc1ccc(cc1)Cl CSC000150469 [0,1,0,0,0,0|2,0,0]=3 39 B12R1.21 NC(=O)NCc1ccc(cc1)F CSC000238953 [0,1,0,0,0,0|2,0,0]=3 40 B12R1.21 OC(=O)COc1ccc(cc1)Br CSC000182358 [0,1,0,0,0,0|1,0,0]=2 41 B12R1.27 CC(CO)NCc1ccccc1 CSC000713660 [0,1,0,0,0,0|2,0,1]=4 42 B12R1.27 CCC(=O)NCc1ccccc1 CSC000153145 [0,1,0,0,0,0|2,0,0]=3 43 B12R1.27 CCC(=O)NCc1ccccn1 CSC000154896 [0,1,0,0,0,0|3,0,0]=4 44 B12R1.27 CCC(=O)NCc1cccnc1 CSC000154920 [0,1,0,0,0,0|3,0,0]=4 45 B12R1.27 CCC(=O)NCc1ccncc1 CSC000154908 [0,1,0,0,0,0|3,0,0]=4 46 B12R1.27 CCC(=O)NNc1ccccc1 CSC000001587 [0,1,0,0,0,0|3,0,0]=4 47 B12R1.27 CCC(=O)OCc1ccccc1 CSC000000848 [0,1,0,0,0,0|2,0,0]=3 48 B12R1.27 CNC(=O)CCc1ccccc1 CSC000159837 [0,1,0,0,0,0|1,0,0]=2 49 B12R1.27 CNC(=O)COc1ccccc1 CSC000150564 [0,1,0,0,0,0|2,0,0]=3 50 B12R1.27 CNC(=O)CSc1ccccc1 CSC000150703 [0,1,0,0,0,0|2,0,0]=3 51 B12R1.27 CNC(=O)NCc1ccccc1 CSC000222791 [0,1,0,0,0,0|2,0,0]=3 52 B12R1.27 CNC(=O)NCc1ccccn1 CSC000233842 [0,1,0,0,0,0|3,0,0]=4 53 B12R1.27 CNC(=O)NCc1cccnc1 CSC000233843 [0,1,0,0,0,0|3,0,0]=4 54 B12R1.27 CNC(=O)NCc1ccncc1 CSC000235220 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.27 COC(=O)C#Cc1ccccc1 CSC011216089 [0,1,0,0,0,0|0,0,2]=3 56 B12R1.27 COC(=O)COc1ccccc1 CSC000148705 [0,1,0,0,0,0|1,0,0]=2 57 B12R1.27 COC(=O)CSc1ccccc1 CSC000151200 [0,1,0,0,0,0|1,0,0]=2 58 B12R1.27 COC(=O)CSc1ccccn1 CSC000156013 [0,1,0,0,0,0|2,0,0]=3 59 B12R1.27 COC(=O)CSc1ncccn1 CSC000148893 [0,1,0,0,0,0|3,0,0]=4 60 B12R1.27 COC(=O)NCc1ccccc1 CSC000235978 [0,1,0,0,0,0|1,0,0]=2 61 B12R1.27 NNC(=O)CCc1ccccc1 CSC000189782 [0,1,0,0,0,0|1,0,0]=2 62 B12R1.27 NNC(=O)COc1ccccc1 CSC000186219 [0,1,0,0,0,0|2,0,0]=3 63 B12R1.27 NNC(=O)CSc1ccccc1 CSC000189974 [0,1,0,0,0,0|2,0,0]=3 64 B12R1.27 OCC(=O)NCc1ccccc1 CSC000246335 [0,1,0,0,0,0|1,0,0]=2 65 B12R1.27 OCC(O)CSc1ccccc1 CSC000208506 [0,1,0,0,0,0|1,0,2]=4 66 B12R1.43 CN(Cc1ccccc1)C(=O)C CSC000152884 [0,1,0,0,0,0|2,0,0]=3 67 B12R1.43 CN(Cc1ccccc1)C(=O)N CSC000238888 [0,1,0,0,0,0|2,0,0]=3 68 B12R1.43 NC(=O)C(=O)Nc1ccccc1 CSC000015721 [0,1,0,0,0,0|2,0,1]=4 69 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)N CSC011423145 [0,1,0,0,0,0|1,0,0]=2 70 B12R1.107 CC(NC(=O)C)c1ccccc1 CSC000158019 [0,1,0,0,0,0|2,0,0]=3 71 B12R1.107 CC(OC(=O)C)c1ccccc1 CSC000000578 [0,1,0,0,0,0|2,0,0]=3 72 B12R1.107 CN(CC(=O)O)c1ccccn1 CSC015360306 [0,1,0,0,0,0|2,0,0]=3 73 B12R1.107 CN(NC(=O)C)c1ccccc1 CSC000017130 [0,1,0,0,0,0|3,0,0]=4 74 B12R1.107 C[C@@H](NC(=O)C)c1ccccc1 CSC011908465 [0,1,0,0,0,0|2,0,0]=3 75 B12R1.107 C[C@H](NC(=O)C)c1ccccc1 CSC011908453 [0,1,0,0,0,0|2,0,0]=3 76 B12R1.107 NC(=O)CS(=O)c1ccccc1 CSC000064346 [0,1,0,0,0,0|2,0,0]=3 77 B12R1.125 CC(=C)COc1ccccc1C CSC000171510 [0,1,0,0,0,0|3,0,0]=4 78 B12R1.125 CC(=C)CSc1ccccc1C CSC000053913 [0,1,0,0,0,0|3,0,0]=4 79 B12R1.125 CC(=O)NCc1ccccc1Br CSC011237613 [0,1,0,0,0,0|2,0,0]=3 80 B12R1.125 CC(=O)NCc1ccccc1C CSC000175807 [0,1,0,0,0,0|2,0,0]=3 81 B12R1.125 CC(=O)NCc1ccccc1Cl CSC000155626 [0,1,0,0,0,0|2,0,0]=3 82 B12R1.125 CC(=O)NCc1cnccc1C CSC013037028 [0,1,0,0,0,0|3,0,0]=4 83 B12R1.125 CC(=O)NNc1ccccc1C CSC015226515 [0,1,0,0,0,0|3,0,0]=4 84 B12R1.125 CC(=O)OCc1ccccc1C CSC000000619 [0,1,0,0,0,0|2,0,0]=3 85 B12R1.125 CC(=O)OCc1ccncc1Cl CSC009843883 [0,1,0,0,0,0|3,0,0]=4 86 B12R1.125 Cc1ccccc1OCC(=O)N CSC000150533 [0,1,0,0,0,0|2,0,0]=3 87 B12R1.125 NC(=O)CCc1ccccc1Cl CSC000162028 [0,1,0,0,0,0|1,0,0]=2 88 B12R1.125 NC(=O)CCc1ccccc1F CSC000016472 [0,1,0,0,0,0|1,0,0]=2 89 B12R1.125 NC(=O)COc1ccccc1Cl CSC000150432 [0,1,0,0,0,0|2,0,0]=3 90 B12R1.125 NC(=O)COc1ccccc1F CSC000150391 [0,1,0,0,0,0|2,0,0]=3 91 B12R1.125 NC(=O)COc1ccccc1O CSC000162348 [0,1,0,0,0,0|2,0,0]=3 92 B12R1.125 NC(=O)NNc1ccccc1Cl CSC000022921 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.125 OC(=O)COc1ccccc1F CSC000182486 [0,1,0,0,0,0|1,0,0]=2 94 B12R1.226 CC(=O)NCc1cccc(c1)C CSC011222369 [0,1,0,0,0,0|2,0,0]=3 95 B12R1.226 Cc1cc(ncn1)SCC(=O)O CSC011434495 [0,1,0,0,0,0|3,0,0]=4 96 B12R1.226 NC(=O)COc1cccc(c1)Cl CSC000150646 [0,1,0,0,0,0|2,0,0]=3 97 B12R1.226 NC(=O)NCc1cccc(c1)Cl CSC000238944 [0,1,0,0,0,0|2,0,0]=3 98 B12R1.891 CS(=O)(=O)NCc1ccccc1 CSC000169538 [0,1,0,0,0,0|2,0,1]=4 99 B10R0.78 OC(=O)CCC(=O)NCC=C CSC000216152 [0,0,1,0,0,0|2,0,1]=4 100 B10R1.18 CS(=O)Cc1ccccc1 CSC000064350 [0,0,0,0,1,0|2,0,0]=3 101 B10R1.66 CC(=O)NCc1cccs1 CSC000154743 [0,0,0,0,1,0|3,0,0]=4 102 B12R1.252 CC(=C)CNCc1ccccc1 CSC000224140 [0,0,0,0,0,1|2,0,0]=3 103 B12R1.252 CC(=CCOc1ccccc1)C CSC000173691 [0,0,0,0,0,1|2,0,1]=4 104 B12R1.252 CC(=O)CCSc1ccccc1 CSC000208507 [0,0,0,0,0,1|1,0,0]=2 105 B12R1.252 CC(=O)CCSc1ccccn1 CSC000208669 [0,0,0,0,0,1|2,0,0]=3 106 B12R1.252 CC(=O)CSCc1ccccc1 CSC000172147 [0,0,0,0,0,1|1,0,0]=2 107 B12R1.252 CC(=O)NCCc1ccccc1 CSC000153396 [0,0,0,0,0,1|1,0,0]=2 108 B12R1.252 CC(=O)OCCc1ccccc1 CSC000024547 [0,0,0,0,0,1|1,0,0]=2 109 B12R1.252 CC(C)CCNc1ccccc1 CSC000219564 [0,0,0,0,0,1|2,0,1]=4 110 B12R1.252 CC(C)NCCc1ccccc1 CSC000200190 [0,0,0,0,0,1|2,0,1]=4 111 B12R1.252 CC(O)CNCc1cccnc1 CSC000180864 [0,0,0,0,0,1|2,0,1]=4 112 B12R1.252 CC(O)CNCc1ccncc1 CSC000186853 [0,0,0,0,0,1|2,0,1]=4 113 B12R1.252 NC(=O)CCCc1ccccc1 CSC011273634 [0,0,0,0,0,1|1,0,0]=2 114 B12R1.252 NC(=O)CSCc1ccccc1 CSC000149389 [0,0,0,0,0,1|1,0,0]=2 115 B12R1.252 NC(=O)NCCc1ccccc1 CSC000238938 [0,0,0,0,0,1|1,0,0]=2 116 B12R1.252 NC(=O)NN=Cc1ccccc1 CSC000163793 [0,0,0,0,0,1|2,0,1]=4 117 B11R1.1 Brc1ccc(cc1)OCC=C CSC000172055 [1,1,0,0,0,0|2,0,0]=4 118 B11R1.1 Brc1ccc(cc1)SCC=C CSC009811901 [1,1,0,0,0,0|2,0,0]=4 119 B11R1.1 Cc1ccc(cc1)NCCO CSC011233175 [1,1,0,0,0,0|1,0,1]=4 120 B11R1.1 Cc1ccc(cc1)OCC=C CSC000172063 [1,1,0,0,0,0|2,0,0]=4 121 B11R1.1 Cc1ccc(cc1)OCCO CSC011219107 [1,1,0,0,0,0|1,0,1]=4 122 B11R1.1 Cc1ccc(cc1)SCC=C CSC000006760 [1,1,0,0,0,0|2,0,0]=4 123 B11R1.1 Cc1ccc(cc1)SCCO CSC000230582 [1,1,0,0,0,0|1,0,1]=4 124 B11R1.1 Clc1ccc(cc1)SCC=C CSC000006393 [1,1,0,0,0,0|2,0,0]=4 125 B11R1.1 Fc1ccc(cc1)SCC=C CSC000006478 [1,1,0,0,0,0|2,0,0]=4 126 B11R1.1 OCCNc1ccc(cc1)Cl CSC011233097 [1,1,0,0,0,0|1,0,1]=4 127 B11R1.1 OCCNc1ccc(cc1)F CSC011233115 [1,1,0,0,0,0|1,0,1]=4 128 B11R1.1 OCCOc1ccc(cc1)Br CSC000686261 [1,1,0,0,0,0|1,0,1]=4 129 B11R1.1 OCCOc1ccc(cc1)Cl CSC000237962 [1,1,0,0,0,0|1,0,1]=4 130 B11R1.1 OCCOc1ccc(cc1)F CSC011305846 [1,1,0,0,0,0|1,0,1]=4 131 B11R1.1 OCCOc1ccc(cc1)I CSC000230681 [1,1,0,0,0,0|1,0,1]=4 132 B11R1.1 OCCSc1ccc(cc1)Cl CSC000230527 [1,1,0,0,0,0|1,0,1]=4 133 B11R1.1 OCCSc1ccc(cc1)F CSC000230679 [1,1,0,0,0,0|1,0,1]=4 134 B11R1.16 CN(CC=C)c1ccccc1 CSC000018674 [1,1,0,0,0,0|2,0,0]=4 135 B11R1.17 Brc1ccccc1OCC=C CSC000173964 [1,1,0,0,0,0|2,0,0]=4 136 B11R1.17 Cc1ccccc1NCC=C CSC011613358 [1,1,0,0,0,0|2,0,0]=4 137 B11R1.17 Cc1ccccc1NCCO CSC011233185 [1,1,0,0,0,0|1,0,1]=4 138 B11R1.17 Cc1ccccc1OCC=C CSC000172067 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.17 Cc1ccccc1OCCO CSC011305843 [1,1,0,0,0,0|1,0,1]=4 140 B11R1.17 Clc1ccccc1OCC=C CSC000172057 [1,1,0,0,0,0|2,0,0]=4 141 B11R1.17 Fc1ccccc1OCC=C CSC000173442 [1,1,0,0,0,0|2,0,0]=4 142 B11R1.17 OCCNc1ccccc1Br CSC011233104 [1,1,0,0,0,0|1,0,1]=4 143 B11R1.17 OCCOc1ccccc1Cl CSC000230518 [1,1,0,0,0,0|1,0,1]=4 144 B11R1.17 OCCOc1ccccc1F CSC000756447 [1,1,0,0,0,0|1,0,1]=4 145 B11R1.17 OCCSc1ccccc1Br CSC000230852 [1,1,0,0,0,0|1,0,1]=4 146 B11R1.17 OCCSc1ccccc1Cl CSC000230572 [1,1,0,0,0,0|1,0,1]=4 147 B11R1.17 OCCSc1ccccc1F CSC000230732 [1,1,0,0,0,0|1,0,1]=4 148 B11R1.24 Cc1cccc(c1)NCCO CSC011232808 [1,1,0,0,0,0|1,0,1]=4 149 B11R1.24 Cc1cccc(c1)OCCO CSC011215094 [1,1,0,0,0,0|1,0,1]=4 150 B11R1.24 Cc1cccc(c1)SCCO CSC011432187 [1,1,0,0,0,0|1,0,1]=4 151 B11R1.24 OCCOc1cccc(c1)F CSC011305856 [1,1,0,0,0,0|1,0,1]=4 152 B11R1.24 OCCSc1cccc(c1)Br CSC011756134 [1,1,0,0,0,0|1,0,1]=4 153 B11R1.24 OCCSc1cccc(c1)Cl CSC011721761 [1,1,0,0,0,0|1,0,1]=4 154 B11R1.24 OCCSc1cccc(c1)F CSC011996949 [1,1,0,0,0,0|1,0,1]=4 155 B11R1.28 CCCCNc1ccccc1 CSC000211623 [1,1,0,0,0,0|1,0,1]=4 156 B11R1.28 CCCCOc1ccccc1 CSC011212283 [1,1,0,0,0,0|1,0,1]=4 157 B11R1.28 CCCSCc1ccccc1 CSC000006446 [1,1,0,0,0,0|1,0,1]=4 158 B11R1.28 COCCOc1ccccc1 CSC000757042 [1,1,0,0,0,0|1,0,1]=4 159 B11R1.28 COCCSc1ccccc1 CSC025761232 [1,1,0,0,0,0|1,0,1]=4 160 B11R1.28 CSCCCc1ccccc1 CSC000051364 [1,1,0,0,0,0|0,1,1]=4 161 B11R1.28 CSCCOc1ccccc1 CSC000148400 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.28 N#CCCSc1ccccc1 CSC000172086 [1,1,0,0,0,0|1,0,1]=4 163 B11R1.28 OCCCOc1ccccc1 CSC011215863 [1,1,0,0,0,0|0,0,1]=3 164 B11R1.28 OCCNCc1ccccc1 CSC000180844 [1,1,0,0,0,0|0,0,1]=3 165 B11R1.28 OCCNCc1ccccn1 CSC000200435 [1,1,0,0,0,0|1,0,1]=4 166 B11R1.28 OCCNCc1ccncc1 CSC000200482 [1,1,0,0,0,0|1,0,1]=4 167 B11R1.28 OCCSCc1ccccc1 CSC011205989 [1,1,0,0,0,0|0,0,1]=3 168 B11R1.20 CC(=O)Nc1ccc(cc1)Br CSC000153570 [0,1,0,0,1,0|2,0,0]=4 169 B11R1.20 CC(=O)Nc1ccc(cc1)Cl CSC000154020 [0,1,0,0,1,0|2,0,0]=4 170 B11R1.20 CC(=O)Oc1ccc(cc1)Br CSC009811594 [0,1,0,0,1,0|2,0,0]=4 171 B11R1.20 CC(=O)Oc1ccc(cc1)C CSC000001885 [0,1,0,0,1,0|2,0,0]=4 172 B11R1.20 CC(=O)Oc1ccc(cc1)Cl CSC000001863 [0,1,0,0,1,0|2,0,0]=4 173 B11R1.20 CC(=O)Oc1ccc(cc1)F CSC000001924 [0,1,0,0,1,0|2,0,0]=4 174 B11R1.20 Cc1ccc(cc1)CC(=O)N CSC000206417 [0,1,0,0,1,0|1,0,0]=3 175 B11R1.20 NC(=O)Cc1ccc(cc1)Br CSC000162331 [0,1,0,0,1,0|1,0,0]=3 176 B11R1.20 NC(=O)Cc1ccc(cc1)F CSC000162278 [0,1,0,0,1,0|1,0,0]=3 177 B11R1.20 NC(=O)Cc1ccc(cc1)O CSC000020825 [0,1,0,0,1,0|1,0,0]=3 178 B11R1.20 NC(=O)Nc1ccc(cc1)Br CSC000198584 [0,1,0,0,1,0|2,0,0]=4 179 B11R1.20 NC(=O)Nc1ccc(cc1)F CSC000222807 [0,1,0,0,1,0|2,0,0]=4 180 B11R1.36 NC(=O)C(O)c1ccccc1 CSC011200849 [0,1,0,0,1,0|1,0,0]=3 181 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 CSC009816934 [0,1,0,0,1,0|1,0,0]=3 182 B11R1.86 CC(=O)Nc1ccccc1Br CSC000153524 [0,1,0,0,1,0|2,0,0]=4 183 B11R1.86 CC(=O)Nc1ccccc1C CSC000153662 [0,1,0,0,1,0|2,0,0]=4 184 B11R1.86 CC(=O)Nc1ccccc1Cl CSC000153741 [0,1,0,0,1,0|2,0,0]=4 185 B11R1.86 CC(=O)Nc1ccccc1F CSC000154224 [0,1,0,0,1,0|2,0,0]=4 186 B11R1.86 CC(=O)Nc1ccccc1I CSC000154044 [0,1,0,0,1,0|2,0,0]=4 187 B11R1.86 CC(=O)Oc1ccccc1C CSC000001913 [0,1,0,0,1,0|2,0,0]=4 188 B11R1.86 CC(=O)Oc1ccccc1F CSC000001835 [0,1,0,0,1,0|2,0,0]=4 189 B11R1.86 Cc1ccccc1NC(=O)N CSC000181700 [0,1,0,0,1,0|2,0,0]=4 190 B11R1.86 NC(=O)Cc1ccccc1Cl CSC000162363 [0,1,0,0,1,0|1,0,0]=3 191 B11R1.86 NC(=O)Cc1ccccc1F CSC000162305 [0,1,0,0,1,0|1,0,0]=3 192 B11R1.86 NC(=O)Nc1ccccc1Br CSC000742221 [0,1,0,0,1,0|2,0,0]=4 193 B11R1.86 NC(=O)Nc1ccccc1Cl CSC000181701 [0,1,0,0,1,0|2,0,0]=4 194 B11R1.157 CC(=O)Nc1cccc(c1)Br CSC000153616 [0,1,0,0,1,0|2,0,0]=4 195 B11R1.157 CC(=O)Nc1cccc(c1)C CSC000153650 [0,1,0,0,1,0|2,0,0]=4 196 B11R1.157 CC(=O)Nc1cccc(c1)F CSC000153968 [0,1,0,0,1,0|2,0,0]=4 197 B11R1.157 CC(=O)Oc1cccc(c1)Br CSC009811612 [0,1,0,0,1,0|2,0,0]=4 198 B11R1.157 CC(=O)Oc1cccc(c1)C CSC000001900 [0,1,0,0,1,0|2,0,0]=4 199 B11R1.157 CC(=O)Oc1cccc(c1)Cl CSC000001977 [0,1,0,0,1,0|2,0,0]=4 200 B11R1.157 CC(=O)Oc1cccc(c1)F CSC000002014 [0,1,0,0,1,0|2,0,0]=4 201 B11R1.157 Cc1cccc(c1)NC(=O)N CSC000181699 [0,1,0,0,1,0|2,0,0]=4 202 B11R1.157 NC(=O)Cc1cccc(c1)Br CSC011586816 [0,1,0,0,1,0|1,0,0]=3 203 B11R1.157 NC(=O)Cc1cccc(c1)Cl CSC011690632 [0,1,0,0,1,0|1,0,0]=3 204 B11R1.157 NC(=O)Cc1cccc(c1)F CSC000162360 [0,1,0,0,1,0|1,0,0]=3 205 B11R1.157 NC(=O)Cc1cccc(c1)N CSC011690101 [0,1,0,0,1,0|1,0,0]=3 206 B11R1.157 NC(=O)Nc1cccc(c1)Br CSC000238923 [0,1,0,0,1,0|2,0,0]=4 207 B11R1.509 CS(=O)(=O)Cc1ccccc1 CSC000034595 [0,1,0,0,1,0|1,0,1]=4 208 B11R1.25 COC(=O)CCn1cccc1 CSC000181648 [0,1,0,0,1,0|1,0,0]=3 209 B11R1.25 COC(=O)CCn1ccnc1 CSC000176960 [0,1,0,0,1,0|2,0,0]=4 210 B11R1.25 NNC(=O)CCc1ccco1 CSC000190050 [0,1,0,0,1,0|2,0,0]=4 211 B13R1.45 CC(=O)COC(=O)c1ccccc1 CSC000000904 [0,1,0,0,0,1|1,0,1]=4 212 B13R1.45 CC(=O)OCC(=O)c1ccccc1 CSC000000662 [0,1,0,0,0,1|1,0,1]=4 213 B13R1.45 CC(CNC(=O)C)c1ccccc1 CSC000154521 [0,1,0,0,0,1|1,0,0]=3 214 B13R1.45 NC(=O)CNC(=O)c1ccccc1 CSC000162210 [0,1,0,0,0,1|1,0,1]=4 215 B13R1.149 CC(=C)CNCc1cccc(c1)Br CSC011645382 [0,1,0,0,0,1|2,0,0]=4 216 B13R1.149 CC(=O)OCCc1cccc(c1)C CSC009866697 [0,1,0,0,0,1|1,0,0]=3 217 B13R1.149 CC(O)CNCc1cccc(c1)Br CSC000189066 [0,1,0,0,0,1|1,0,1]=4 218 B13R1.149 CC(O)CNCc1cccc(c1)Br CSC000189066 [0,1,0,0,0,1|1,0,1]=4 219 B13R1.149 CC(O)CNCc1cccc(c1)Cl CSC000189391 [0,1,0,0,0,1|1,0,1]=4 220 B13R1.149 NC(=O)CSCc1cccc(c1)Cl CSC000162069 [0,1,0,0,0,1|1,0,0]=3 221 B13R1.149 OC(=O)CCNc1cc(ccn1)Br CSC015374659 [0,1,0,0,0,1|1,0,0]=3 222 B13R1.149 OC(=O)CCNc1cncc(c1)Br CSC013713006 [0,1,0,0,0,1|1,0,0]=3 223 B13R1.158 CC(=C)CNCc1ccccc1Br CSC011645383 [0,1,0,0,0,1|2,0,0]=4 224 B13R1.158 CC(O)CNCc1ccccc1Br CSC000196636 [0,1,0,0,0,1|1,0,1]=4 225 B13R1.158 CC(O)CNCc1ccccc1C CSC000196629 [0,1,0,0,0,1|1,0,1]=4 226 B13R1.158 CC(O)CNCc1ccccc1Cl CSC000196624 [0,1,0,0,0,1|1,0,1]=4 227 B13R1.158 CC(O)CNCc1ccccc1F CSC000186673 [0,1,0,0,0,1|1,0,1]=4 228 B13R1.158 Cc1ccccc1CSCC(=O)N CSC000148330 [0,1,0,0,0,1|1,0,0]=3 229 B13R1.158 NC(=O)CSCc1ccccc1Br CSC000148301 [0,1,0,0,0,1|1,0,0]=3 230 B13R1.158 NC(=O)CSCc1ccccc1Cl CSC000164481 [0,1,0,0,0,1|1,0,0]=3 231 B13R1.158 OC(=O)CCNc1ccncc1Br CSC015235960 [0,1,0,0,0,1|1,0,0]=3 232 B13R1.158 OC(=O)CCNc1ccncc1Cl CSC015390251 [0,1,0,0,0,1|1,0,0]=3 233 B13R1.158 OC(=O)CCNc1ncccc1Br CSC015257812 [0,1,0,0,0,1|1,0,0]=3 234 B13R1.158 OC(=O)CCNc1ncccc1Cl CSC021943901 [0,1,0,0,0,1|1,0,0]=3 235 B13R1.158 OC(=O)CCNc1ncccc1I CSC057723439 [0,1,0,0,0,1|1,0,0]=3 236 B13R1.351 CC(CSc1ccccc1)C(=O)N CSC000071512 [0,1,0,0,0,1|1,0,0]=3 237 B13R1.351 CC(SCc1ccccc1)C(=O)N CSC000149388 [0,1,0,0,0,1|1,0,0]=3 238 B13R1.351 OC(=O)C(=O)NCc1ccccc1 CSC000238767 [0,1,0,0,0,1|0,0,1]=3 239 B13R1.351 OC(=O)C(=O)NCc1ccccn1 CSC011297326 [0,1,0,0,0,1|1,0,1]=4 240 B13R1.351 OC(=O)C(=O)NCc1cccnc1 CSC011297347 [0,1,0,0,0,1|1,0,1]=4 241 B13R1.351 OC(=O)C(=O)NCc1ccncc1 CSC011297348 [0,1,0,0,0,1|1,0,1]=4 242 B13R1.513 CC(=C)CNCc1ccc(cc1)Br CSC011645308 [0,1,0,0,0,1|2,0,0]=4 243 B13R1.513 CC(=O)CCSc1ccc(cc1)F CSC000208766 [0,1,0,0,0,1|1,0,0]=3 244 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl CSC000151911 [0,1,0,0,0,1|1,0,0]=3 245 B13R1.513 CC(=O)NCCc1ccc(cc1)F CSC000152297 [0,1,0,0,0,1|1,0,0]=3 246 B13R1.513 CC(=O)NCCc1ccc(cc1)O CSC011395907 [0,1,0,0,0,1|1,0,0]=3 247 B13R1.513 CC(=O)OCCc1ccc(cc1)C CSC009829655 [0,1,0,0,0,1|1,0,0]=3 248 B13R1.513 CC(=O)OCCc1ccc(cc1)Cl CSC009851009 [0,1,0,0,0,1|1,0,0]=3 249 B13R1.513 CC(=O)OCCc1ccc(cc1)F CSC000071711 [0,1,0,0,0,1|1,0,0]=3 250 B13R1.513 CC(O)CNCc1ccc(cc1)Br CSC000187449 [0,1,0,0,0,1|1,0,1]=4 251 B13R1.513 CC(O)CNCc1ccc(cc1)Br CSC000187449 [0,1,0,0,0,1|1,0,1]=4 252 B13R1.513 CC(O)CNCc1ccc(cc1)C CSC000188770 [0,1,0,0,0,1|1,0,1]=4 253 B13R1.513 CC(O)CNCc1ccc(cc1)Cl CSC000186849 [0,1,0,0,0,1|1,0,1]=4 254 B13R1.513 CC(O)CNCc1ccc(cc1)F CSC000186854 [0,1,0,0,0,1|1,0,1]=4 255 B13R1.513 Cc1ccc(cc1)SCCC(=O)N CSC000162367 [0,1,0,0,0,1|1,0,0]=3 256 B13R1.513 NC(=O)CSCc1ccc(cc1)F CSC000162057 [0,1,0,0,0,1|1,0,0]=3 257 B13R1.513 NC(=O)NCCc1ccc(cc1)Cl CSC000238947 [0,1,0,0,0,1|1,0,0]=3 258 B13R1.513 OC(=O)CCNc1ccc(cn1)Br CSC057255885 [0,1,0,0,0,1|1,0,0]=3 259 B13R1.513 OC(=O)CCNc1ccc(cn1)Cl CSC025755724 [0,1,0,0,0,1|1,0,0]=3 260 B13R1.513 OC(=O)CCNc1ccc(cn1)Cl CSC025755724 [0,1,0,0,0,1|1,0,0]=3 261 B13R1.513 OC(=O)CCNc1ccc(cn1)I CSC056847524 [0,1,0,0,0,1|1,0,0]=3 262 B13R1.513 OC(=O)CCNc1ncc(cn1)Br CSC015946636 [0,1,0,0,0,1|2,0,0]=4 263 B13R1.513 OC(=O)CCNc1ncc(cn1)Cl CSC015284654 [0,1,0,0,0,1|2,0,0]=4 264 B13R1.718 CC(CO)CNCc1ccccc1 CSC011493029 [0,1,0,0,0,1|1,0,1]=4 265 B13R1.718 CCC(=O)OCCc1ccccc1 CSC000024285 [0,1,0,0,0,1|1,0,0]=3 266 B13R1.718 CNC(=O)CCSc1ccccc1 CSC000159960 [0,1,0,0,0,1|1,0,0]=3 267 B13R1.718 CNC(=O)CSCc1ccccc1 CSC000149384 [0,1,0,0,0,1|1,0,0]=3 268 B13R1.718 CNC(=O)NCCc1ccccc1 CSC000235216 [0,1,0,0,0,1|1,0,0]=3 269 B13R1.718 COC(=O)CCCc1ccccc1 CSC011295115 [0,1,0,0,0,1|0,0,0]=2 270 B13R1.718 COC(=O)CCOc1ccccc1 CSC000149921 [0,1,0,0,0,1|0,0,0]=2 271 B13R1.718 COC(=O)CCSc1ccccc1 CSC000149870 [0,1,0,0,0,1|0,0,0]=2 272 B13R1.718 COC(=O)CSCc1ccccc1 CSC000151540 [0,1,0,0,0,1|0,0,0]=2 273 B13R1.718 COC(=O)CSCc1cccnc1 CSC000043084 [0,1,0,0,0,1|1,0,0]=3 274 B13R1.718 COC(=O)NCCc1ccccc1 CSC000235985 [0,1,0,0,0,1|0,0,0]=2 275 B13R1.718 NNC(=O)CCOc1ccccc1 CSC000189865 [0,1,0,0,0,1|1,0,0]=3 276 B13R1.718 OCC(O)CNCc1ccccc1 CSC000157146 [0,1,0,0,0,1|0,0,2]=4 277 B13R1.3523 CC(C)(O)CNCc1ccccc1 CSC000697163 [0,1,0,0,0,1|1,0,1]=4 278 B13R1.3523 CS(=O)(=O)NCCc1ccccc1 CSC000165585 [0,1,0,0,0,1|1,0,1]=4 279 B13R1.3 CC(=O)COc1ccc(cc1)C#N CSC000150630 [0,2,0,0,0,0|2,0,0]=4 280 B13R1.3 CCc1ccc(cc1)OCC(=O)N CSC000149771 [0,2,0,0,0,0|2,0,0]=4 281 B13R1.3 COc1ccc(cc1)CCC(=O)C CSC000170882 [0,2,0,0,0,0|1,0,0]=3 282 B13R1.3 COc1ccc(cc1)CNC(=O)C CSC000155742 [0,2,0,0,0,0|2,0,0]=4 283 B13R1.3 COc1ccc(cc1)CNC(=O)N CSC000238945 [0,2,0,0,0,0|2,0,0]=4 284 B13R1.3 NC(=O)COc1ccc(cc1)CO CSC000148266 [0,2,0,0,0,0|2,0,0]=4 285 B13R1.14 CCC(=O)NCc1ccc(cc1)C CSC000154269 [0,2,0,0,0,0|2,0,0]=4 286 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl CSC000152853 [0,2,0,0,0,0|2,0,0]=4 287 B13R1.14 CCC(=O)NCc1ccc(cc1)F CSC000152312 [0,2,0,0,0,0|2,0,0]=4 288 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl CSC000022063 [0,2,0,0,0,0|1,0,0]=3 289 B13R1.14 CNC(=O)CCc1ccc(cc1)F CSC000198136 [0,2,0,0,0,0|1,0,0]=3 290 B13R1.14 CNC(=O)COc1ccc(cc1)C CSC000150494 [0,2,0,0,0,0|2,0,0]=4 291 B13R1.14 CNC(=O)COc1ccc(cc1)Cl CSC000150441 [0,2,0,0,0,0|2,0,0]=4 292 B13R1.14 CNC(=O)COc1ccc(cc1)F CSC000150542 [0,2,0,0,0,0|2,0,0]=4 293 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl CSC000150459 [0,2,0,0,0,0|2,0,0]=4 294 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl CSC000235214 [0,2,0,0,0,0|2,0,0]=4 295 B13R1.14 CNC(=O)NCc1ccc(cc1)F CSC000235249 [0,2,0,0,0,0|2,0,0]=4 296 B13R1.14 COC(=O)CCc1ccc(cc1)Br CSC012357364 [0,2,0,0,0,0|0,0,0]=2 297 B13R1.14 COC(=O)CCc1ccc(cc1)Cl CSC000240969 [0,2,0,0,0,0|0,0,0]=2 298 B13R1.14 COC(=O)CCc1ccc(cc1)F CSC000198246 [0,2,0,0,0,0|0,0,0]=2 299 B13R1.14 COC(=O)CNc1ccc(cc1)Br CSC000219630 [0,2,0,0,0,0|1,0,0]=3 300 B13R1.14 COC(=O)CNc1ccc(cc1)C CSC000219983 [0,2,0,0,0,0|1,0,0]=3 301 B13R1.14 COC(=O)CNc1ccc(cc1)Cl CSC000220163 [0,2,0,0,0,0|1,0,0]=3 302 B13R1.14 COC(=O)CNc1ccc(cc1)F CSC000219835 [0,2,0,0,0,0|1,0,0]=3 303 B13R1.14 COC(=O)COc1ccc(cc1)C CSC000151163 [0,2,0,0,0,0|1,0,0]=3 304 B13R1.14 COC(=O)COc1ccc(cc1)Cl CSC000148943 [0,2,0,0,0,0|1,0,0]=3 305 B13R1.14 COC(=O)COc1ccc(cc1)I CSC000151492 [0,2,0,0,0,0|1,0,0]=3 306 B13R1.14 COC(=O)CSc1ccc(cc1)C CSC000148271 [0,2,0,0,0,0|1,0,0]=3 307 B13R1.14 COC(=O)CSc1ccc(cc1)Cl CSC000150947 [0,2,0,0,0,0|1,0,0]=3 308 B13R1.14 COC(=O)NCc1ccc(cc1)Br CSC011472957 [0,2,0,0,0,0|1,0,0]=3 309 B13R1.14 COC(=O)NCc1ccc(cc1)Cl CSC000235972 [0,2,0,0,0,0|1,0,0]=3 310 B13R1.14 Cc1ccc(cc1)CNC(=O)CN CSC000168522 [0,2,0,0,0,0|2,0,0]=4 311 B13R1.14 Cc1ccc(cc1)OCC(=O)NN CSC000183956 [0,2,0,0,0,0|2,0,0]=4 312 B13R1.14 NCC(=O)NCc1ccc(cc1)F CSC000168487 [0,2,0,0,0,0|2,0,0]=4 313 B13R1.14 NNC(=O)COc1ccc(cc1)I CSC000189952 [0,2,0,0,0,0|2,0,0]=4 314 B13R1.132 CC(NC(=O)C)c1ccc(cc1)Br CSC000153805 [0,2,0,0,0,0|2,0,0]=4 315 B13R1.132 CC(NC(=O)C)c1ccc(cc1)C CSC011237556 [0,2,0,0,0,0|2,0,0]=4 316 B13R1.132 CC(NC(=O)C)c1ccc(cc1)Cl CSC000153794 [0,2,0,0,0,0|2,0,0]=4 317 B13R1.132 CC(NC(=O)N)c1ccc(cc1)Br CSC000238882 [0,2,0,0,0,0|2,0,0]=4 318 B13R1.132 CN(CC(=O)O)c1ccc(cn1)I CSC056773533 [0,2,0,0,0,0|2,0,0]=4 319 B13R1.133 CC(Nc1ccc(cn1)Br)C(=O)O CSC051419754 [0,2,0,0,0,0|2,0,0]=4 320 B13R1.133 CC(Nc1ccc(cn1)Cl)C(=O)O CSC056939720 [0,2,0,0,0,0|2,0,0]=4 321 B13R1.133 CC(Nc1ccc(cn1)I)C(=O)O CSC056890600 [0,2,0,0,0,0|2,0,0]=4 322 B13R1.133 CC(Oc1ccc(cc1)Br)C(=O)N CSC000150412 [0,2,0,0,0,0|2,0,0]=4 323 B13R1.133 CC(Oc1ccc(cc1)C)C(=O)N CSC000150499 [0,2,0,0,0,0|2,0,0]=4 324 B13R1.133 CC(Oc1ccc(cc1)F)C(=O)N CSC000150547 [0,2,0,0,0,0|2,0,0]=4 325 B13R1.133 CC(Sc1ccc(cc1)C)C(=O)N CSC000149675 [0,2,0,0,0,0|2,0,0]=4 326 B13R1.133 CC(Sc1ccc(cc1)Cl)C(=O)N CSC000150465 [0,2,0,0,0,0|2,0,0]=4 327 B13R1.133 CN(Cc1ccc(cc1)C)C(=O)C CSC000155497 [0,2,0,0,0,0|2,0,0]=4 328 B13R1.133 CN(Cc1ccc(cc1)C)C(=O)N CSC000238865 [0,2,0,0,0,0|2,0,0]=4 329 B13R1.133 C[C@@H](Nc1ccc(cn1)Br)C(=O)O CSC015263983 [0,2,0,0,0,0|2,0,0]=4 330 B13R1.133 C[C@@H](Nc1ccc(cn1)Cl)C(=O)O CSC015919780 [0,2,0,0,0,0|2,0,0]=4 331 B13R1.133 C[C@@H](Nc1ccc(cn1)I)C(=O)O CSC057439611 [0,2,0,0,0,0|2,0,0]=4 332 B13R1.133 C[C@H](Nc1ccc(cn1)Br)C(=O)O CSC015389935 [0,2,0,0,0,0|2,0,0]=4 333 B13R1.133 C[C@H](Nc1ccc(cn1)Cl)C(=O)O CSC015228121 [0,2,0,0,0,0|2,0,0]=4 334 B13R1.133 C[C@H](Nc1ccc(cn1)I)C(=O)O CSC057111767 [0,2,0,0,0,0|2,0,0]=4 335 B13R1.164 CC(=O)COc1ccc(cc1Cl)Cl CSC000150674 [0,2,0,0,0,0|2,0,0]=4 336 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Cl CSC000001290 [0,2,0,0,0,0|2,0,0]=4 337 B13R1.164 Cc1cc(ccc1OCC(=O)N)Br CSC000187326 [0,2,0,0,0,0|2,0,0]=4 338 B13R1.164 Cc1cc(ccc1OCC(=O)N)Cl CSC000149614 [0,2,0,0,0,0|2,0,0]=4 339 B13R1.164 Cc1cc(cnc1NCC(=O)O)Br CSC016130210 [0,2,0,0,0,0|2,0,0]=4 340 B13R1.164 Cc1ccc(c(c1)Br)OCC(=O)N CSC000148664 [0,2,0,0,0,0|2,0,0]=4 341 B13R1.164 Cc1ccc(c(c1)C)OCC(=O)N CSC000148438 [0,2,0,0,0,0|2,0,0]=4 342 B13R1.164 Cc1ccc(c(c1)Cl)OCC(=O)N CSC011725959 [0,2,0,0,0,0|2,0,0]=4 343 B13R1.164 NC(=O)CCc1ccc(cc1Cl)Cl CSC011226212 [0,2,0,0,0,0|1,0,0]=3 344 B13R1.164 NC(=O)COc1ccc(cc1F)Cl CSC000175330 [0,2,0,0,0,0|2,0,0]=4 345 B13R1.164 OC(=O)COc1ccc(cc1Br)F CSC000184067 [0,2,0,0,0,0|1,0,0]=3 346 B13R1.164 OC(=O)COc1ccc(cc1Cl)Br CSC000185252 [0,2,0,0,0,0|1,0,0]=3 347 B13R1.164 OC(=O)COc1ccc(cc1Cl)Cl CSC000180860 [0,2,0,0,0,0|1,0,0]=3 348 B13R1.164 OC(=O)COc1ccc(cc1Cl)F CSC000191239 [0,2,0,0,0,0|1,0,0]=3 349 B13R1.511 Cc1cc(ccc1Br)OCC(=O)N CSC000186616 [0,2,0,0,0,0|2,0,0]=4 350 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)N CSC000149623 [0,2,0,0,0,0|2,0,0]=4 351 B13R1.511 Cc1cc(ncc1Br)NCC(=O)O CSC015408348 [0,2,0,0,0,0|2,0,0]=4 352 B13R1.511 Cc1ccc(cc1C)OCC(=O)N CSC000149134 [0,2,0,0,0,0|2,0,0]=4 353 B13R1.511 Cc1ccc(cc1Cl)OCC(=O)O CSC009999609 [0,2,0,0,0,0|1,0,0]=3 354 B13R1.511 Cc1nc(ccc1Br)NCC(=O)O CSC016053532 [0,2,0,0,0,0|2,0,0]=4 355 B13R1.11 CC(NC(=O)CN)c1ccccc1 CSC000168438 [0,2,0,0,0,0|2,0,0]=4 356 B13R1.11 CCC(=O)NC(C)c1ccccc1 CSC000158022 [0,2,0,0,0,0|2,0,0]=4 357 B13R1.11 CCC(=O)N[C@H](C)c1ccccc1 CSC011908461 [0,2,0,0,0,0|2,0,0]=4 358 B13R1.11 CCC(=O)OC(C)c1ccccc1 CSC000000838 [0,2,0,0,0,0|2,0,0]=4 359 B13R1.11 CNC(=O)CC(C)c1ccccc1 CSC000002954 [0,2,0,0,0,0|1,0,0]=3 360 B13R1.11 COC(=O)CC(C)c1ccccc1 CSC000000072 [0,2,0,0,0,0|0,0,0]=2 361 B13R1.11 COC(=O)NC(C)c1ccccc1 CSC000235971 [0,2,0,0,0,0|1,0,0]=3 362 B13R1.15 CCC(=O)NCc1cccc(c1)Br CSC011236840 [0,2,0,0,0,0|2,0,0]=4 363 B13R1.15 CCC(=O)NCc1cccc(c1)C CSC011222327 [0,2,0,0,0,0|2,0,0]=4 364 B13R1.15 CNC(=O)COc1cccc(c1)C CSC000150510 [0,2,0,0,0,0|2,0,0]=4 365 B13R1.15 CNC(=O)COc1cccc(c1)Cl CSC000150638 [0,2,0,0,0,0|2,0,0]=4 366 B13R1.15 CNC(=O)COc1cccc(c1)F CSC000150749 [0,2,0,0,0,0|2,0,0]=4 367 B13R1.15 COC(=O)CCc1cccc(c1)Br CSC000151591 [0,2,0,0,0,0|0,0,0]=2 368 B13R1.15 COC(=O)CCc1cccc(c1)Cl CSC000024355 [0,2,0,0,0,0|0,0,0]=2 369 B13R1.15 COC(=O)CNc1cccc(c1)Br CSC000219654 [0,2,0,0,0,0|1,0,0]=3 370 B13R1.15 COC(=O)CNc1cccc(c1)Cl CSC000220050 [0,2,0,0,0,0|1,0,0]=3 371 B13R1.15 COC(=O)COc1cccc(c1)C CSC000149909 [0,2,0,0,0,0|1,0,0]=3 372 B13R1.15 COC(=O)CSc1cccc(c1)Br CSC011756034 [0,2,0,0,0,0|1,0,0]=3 373 B13R1.15 COC(=O)CSc1cccc(c1)C CSC011431931 [0,2,0,0,0,0|1,0,0]=3 374 B13R1.15 COC(=O)CSc1cccc(c1)Cl CSC011721657 [0,2,0,0,0,0|1,0,0]=3 375 B13R1.15 COC(=O)NCc1cccc(c1)Br CSC011256846 [0,2,0,0,0,0|1,0,0]=3 376 B13R1.15 COC(=O)NCc1cccc(c1)Cl CSC000236059 [0,2,0,0,0,0|1,0,0]=3 377 B13R1.15 Cc1cccc(c1)CNC(=O)CN CSC011368966 [0,2,0,0,0,0|2,0,0]=4 378 B13R1.15 NCC(=O)NCc1cccc(c1)Cl CSC000168498 [0,2,0,0,0,0|2,0,0]=4 379 B13R1.15 NCC(=O)NCc1cccc(c1)F CSC011248369 [0,2,0,0,0,0|2,0,0]=4 380 B13R1.15 NNC(=O)COc1cccc(c1)Cl CSC000190028 [0,2,0,0,0,0|2,0,0]=4 381 B13R1.42 CCCC(=O)NCc1ccccc1 CSC000153126 [0,2,0,0,0,0|2,0,0]=4 382 B13R1.42 CCCC(=O)OCc1ccccc1 CSC000000759 [0,2,0,0,0,0|2,0,0]=4 383 B13R1.42 CCNC(=O)CCc1ccccc1 CSC000160125 [0,2,0,0,0,0|1,0,0]=3 384 B13R1.42 CCNC(=O)COc1ccccc1 CSC000150565 [0,2,0,0,0,0|2,0,0]=4 385 B13R1.42 CCNC(=O)CSc1ccccc1 CSC000150704 [0,2,0,0,0,0|2,0,0]=4 386 B13R1.42 CCOC(=O)C#Cc1ccccc1 CSC011216521 [0,2,0,0,0,0|0,0,2]=4 387 B13R1.42 CCOC(=O)CCc1ccccc1 CSC000170145 [0,2,0,0,0,0|0,0,0]=2 388 B13R1.42 CCOC(=O)CCc1ccccn1 CSC011594462 [0,2,0,0,0,0|1,0,0]=3 389 B13R1.42 CCOC(=O)CNc1ccccc1 CSC000219562 [0,2,0,0,0,0|1,0,0]=3 390 B13R1.42 CCOC(=O)COc1ccccc1 CSC000170178 [0,2,0,0,0,0|1,0,0]=3 391 B13R1.42 CCOC(=O)CSc1ccccc1 CSC000170991 [0,2,0,0,0,0|1,0,0]=3 392 B13R1.42 CCOC(=O)CSc1ccccn1 CSC000156745 [0,2,0,0,0,0|2,0,0]=4 393 B13R1.42 COCC(=O)NCc1ccccn1 CSC000159088 [0,2,0,0,0,0|2,0,0]=4 394 B13R1.42 COCC(=O)NCc1cccnc1 CSC000159098 [0,2,0,0,0,0|2,0,0]=4 395 B13R1.42 COCC(=O)NCc1ccncc1 CSC000159093 [0,2,0,0,0,0|2,0,0]=4 396 B13R1.135 CC(Oc1ccccc1)C(=O)NN CSC000188956 [0,2,0,0,0,0|2,0,0]=4 397 B13R1.135 CCC(=O)N(C)Cc1ccccc1 CSC000152899 [0,2,0,0,0,0|2,0,0]=4 398 B13R1.135 CNC(=O)C(C)Oc1ccccc1 CSC000159945 [0,2,0,0,0,0|2,0,0]=4 399 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 CSC011422888 [0,2,0,0,0,0|1,0,0]=3 400 B13R1.135 COC(=O)C(C)Sc1ccccc1 CSC000148442 [0,2,0,0,0,0|1,0,0]=3 401 B13R1.135 COC(=O)[C@@H](O)Cc1ccccc1 CSC009816323 [0,2,0,0,0,0|0,0,0]=2 402 B13R1.254 CNS(=O)(=O)CCc1ccccc1 CSC011275428 [0,2,0,0,0,0|1,0,1]=4 403 B13R1.528 CCC(=O)NCc1ccccc1Br CSC011236884 [0,2,0,0,0,0|2,0,0]=4 404 B13R1.528 CCC(=O)NCc1ccccc1C CSC000175811 [0,2,0,0,0,0|2,0,0]=4 405 B13R1.528 CCC(=O)NCc1ccccc1Cl CSC000155630 [0,2,0,0,0,0|2,0,0]=4 406 B13R1.528 CNC(=O)CCc1ccccc1Br CSC009814840 [0,2,0,0,0,0|1,0,0]=3 407 B13R1.528 CNC(=O)CCc1ccccc1Cl CSC000159727 [0,2,0,0,0,0|1,0,0]=3 408 B13R1.528 CNC(=O)CCc1ccccc1F CSC015378911 [0,2,0,0,0,0|1,0,0]=3 409 B13R1.528 CNC(=O)CCc1ccccc1N CSC011289560 [0,2,0,0,0,0|1,0,0]=3 410 B13R1.528 CNC(=O)COc1ccccc1C CSC000150526 [0,2,0,0,0,0|2,0,0]=4 411 B13R1.528 CNC(=O)COc1ccccc1Cl CSC000150425 [0,2,0,0,0,0|2,0,0]=4 412 B13R1.528 CNC(=O)COc1ccccc1F CSC000150384 [0,2,0,0,0,0|2,0,0]=4 413 B13R1.528 CNC(=O)NCc1ccccc1Cl CSC000235227 [0,2,0,0,0,0|2,0,0]=4 414 B13R1.528 COC(=O)CCc1ccccc1Br CSC009815308 [0,2,0,0,0,0|0,0,0]=2 415 B13R1.528 COC(=O)CCc1ccccc1Cl CSC000151590 [0,2,0,0,0,0|0,0,0]=2 416 B13R1.528 COC(=O)CCc1ccccc1F CSC000016591 [0,2,0,0,0,0|0,0,0]=2 417 B13R1.528 COC(=O)COc1ccccc1C CSC000149375 [0,2,0,0,0,0|1,0,0]=3 418 B13R1.528 COC(=O)COc1ccccc1Cl CSC000149908 [0,2,0,0,0,0|1,0,0]=3 419 B13R1.528 COC(=O)COc1ccccc1F CSC000149924 [0,2,0,0,0,0|1,0,0]=3 420 B13R1.528 COC(=O)NCc1ccccc1Cl CSC000236058 [0,2,0,0,0,0|1,0,0]=3 421 B13R1.528 Cc1ccccc1CNC(=O)CN CSC000214010 [0,2,0,0,0,0|2,0,0]=4 422 B13R1.528 NCC(=O)NCc1ccccc1Cl CSC000168405 [0,2,0,0,0,0|2,0,0]=4 423 B13R1.528 NCC(=O)NCc1ccccc1F CSC000214032 [0,2,0,0,0,0|2,0,0]=4 424 B13R1.528 NNC(=O)CCc1ccccc1Cl CSC000189955 [0,2,0,0,0,0|1,0,0]=3 425 B13R1.528 NNC(=O)CNc1ccccc1Cl CSC000012555 [0,2,0,0,0,0|2,0,0]=4 426 B13R1.528 NNC(=O)COc1ccccc1Br CSC000216501 [0,2,0,0,0,0|2,0,0]=4 427 B13R1.148 CC(Nc1cc(ccn1)Br)C(=O)O CSC056847805 [0,2,0,0,0,0|2,0,0]=4 428 B13R1.148 CC(Nc1cncc(c1)Br)C(=O)O CSC014542693 [0,2,0,0,0,0|2,0,0]=4 429 B13R1.148 CC(Oc1cccc(c1)Br)C(=O)N CSC000150601 [0,2,0,0,0,0|2,0,0]=4 430 B13R1.148 CC(Oc1cccc(c1)Cl)C(=O)N CSC000150644 [0,2,0,0,0,0|2,0,0]=4 431 B13R1.148 C[C@@H](Nc1cc(ccn1)Br)C(=O)O CSC015266373 [0,2,0,0,0,0|2,0,0]=4 432 B13R1.148 C[C@@H](Nc1cncc(c1)Br)C(=O)O CSC016095769 [0,2,0,0,0,0|2,0,0]=4 433 B13R1.148 C[C@H](Nc1cc(ccn1)Br)C(=O)O CSC016098195 [0,2,0,0,0,0|2,0,0]=4 434 B13R1.148 C[C@H](Nc1cncc(c1)Br)C(=O)O CSC015950435 [0,2,0,0,0,0|2,0,0]=4 435 B13R1.148 Cc1cccc(c1)NC(=O)C(=O)O CSC000187688 [0,2,0,0,0,0|1,0,1]=4 436 B13R1.148 OC(=O)C(=O)Nc1cccc(c1)F CSC011297300 [0,2,0,0,0,0|1,0,1]=4 437 B13R1.202 CC(Nc1ccncc1Br)C(=O)O CSC056686542 [0,2,0,0,0,0|2,0,0]=4 438 B13R1.202 CC(Nc1ccncc1Cl)C(=O)O CSC056944223 [0,2,0,0,0,0|2,0,0]=4 439 B13R1.202 CC(Nc1ncccc1Br)C(=O)O CSC023261926 [0,2,0,0,0,0|2,0,0]=4 440 B13R1.202 CC(Nc1ncccc1Cl)C(=O)O CSC015398969 [0,2,0,0,0,0|2,0,0]=4 441 B13R1.202 CC(Nc1ncccc1I)C(=O)O CSC057765807 [0,2,0,0,0,0|2,0,0]=4 442 B13R1.202 CC(Oc1ccccc1Br)C(=O)N CSC000148488 [0,2,0,0,0,0|2,0,0]=4 443 B13R1.202 CC(Oc1ccccc1Cl)C(=O)N CSC000150430 [0,2,0,0,0,0|2,0,0]=4 444 B13R1.202 C[C@@H](Nc1ccncc1Br)C(=O)O CSC057777489 [0,2,0,0,0,0|2,0,0]=4 445 B13R1.202 C[C@@H](Nc1ccncc1Cl)C(=O)O CSC015392484 [0,2,0,0,0,0|2,0,0]=4 446 B13R1.202 C[C@@H](Nc1ncccc1Br)C(=O)O CSC015994347 [0,2,0,0,0,0|2,0,0]=4 447 B13R1.202 C[C@@H](Nc1ncccc1Cl)C(=O)O CSC015345995 [0,2,0,0,0,0|2,0,0]=4 448 B13R1.202 C[C@@H](Nc1ncccc1I)C(=O)O CSC057368375 [0,2,0,0,0,0|2,0,0]=4 449 B13R1.202 C[C@H](Nc1ccncc1Br)C(=O)O CSC056893178 [0,2,0,0,0,0|2,0,0]=4 450 B13R1.202 C[C@H](Nc1ccncc1Cl)C(=O)O CSC015355491 [0,2,0,0,0,0|2,0,0]=4 451 B13R1.202 C[C@H](Nc1ncccc1Br)C(=O)O CSC015850839 [0,2,0,0,0,0|2,0,0]=4 452 B13R1.202 C[C@H](Nc1ncccc1Cl)C(=O)O CSC016074063 [0,2,0,0,0,0|2,0,0]=4 453 B13R1.202 C[C@H](Nc1ncccc1I)C(=O)O CSC057145493 [0,2,0,0,0,0|2,0,0]=4 454 B13R1.202 Cc1ccccc1NC(=O)C(=O)O CSC011297352 [0,2,0,0,0,0|1,0,1]=4 455 B13R1.418 CCN(Cc1ccccc1)C(=O)C CSC000155847 [0,2,0,0,0,0|2,0,0]=4 456 B13R1.147 CN(CC(=O)O)c1cc(ccn1)Br CSC015239903 [0,2,0,0,0,0|2,0,0]=4 457 B13R1.147 CN(CC(=O)O)c1cncc(c1)Br CSC015274412 [0,2,0,0,0,0|2,0,0]=4 458 B13R1.201 CN(CC(=O)O)c1ccccc1F CSC011585902 [0,2,0,0,0,0|1,0,0]=3 459 B13R1.201 CN(CC(=O)O)c1ccncc1Br CSC015460234 [0,2,0,0,0,0|2,0,0]=4 460 B13R1.201 CN(CC(=O)O)c1ccncc1Cl CSC015531682 [0,2,0,0,0,0|2,0,0]=4 461 B13R1.201 CN(CC(=O)O)c1ncccc1Br CSC015685921 [0,2,0,0,0,0|2,0,0]=4 462 B13R1.201 CN(CC(=O)O)c1ncccc1Cl CSC021657929 [0,2,0,0,0,0|2,0,0]=4 463 B13R1.201 CN(CC(=O)O)c1ncccc1I CSC057519311 [0,2,0,0,0,0|2,0,0]=4 464 B13R1.713 CC(=O)N[C@@H](CO)c1ccccc1 CSC011995718 [0,2,0,0,0,0|2,0,0]=4 465 B13R1.90 CC(=O)COc1ccccc1C#N CSC000171606 [0,2,0,0,0,0|2,0,0]=4 466 B13R1.90 CC(=O)OCc1ccccc1C#N CSC000000590 [0,2,0,0,0,0|2,0,0]=4 467 B13R1.90 COc1ccccc1CNC(=O)C CSC000152208 [0,2,0,0,0,0|2,0,0]=4 468 B13R1.90 NC(=O)COc1ccccc1C#N CSC000149663 [0,2,0,0,0,0|2,0,0]=4 469 B13R1.150 Cc1cccc(c1C)OCC(=O)N CSC000151105 [0,2,0,0,0,0|2,0,0]=4 470 B13R1.150 Cc1ccnc(c1Br)NCC(=O)O CSC015249475 [0,2,0,0,0,0|2,0,0]=4 471 B13R1.150 OC(=O)COc1cccc(c1Cl)Cl CSC000191259 [0,2,0,0,0,0|1,0,0]=3 472 B13R1.3787 CC(=O)NCc1c(cccc1Cl)F CSC000044876 [0,2,0,0,0,0|2,0,0]=4 473 B13R1.3787 Cc1cccc(c1OCC(=O)N)C CSC000151834 [0,2,0,0,0,0|2,0,0]=4 474 B13R1.3787 OC(=O)COc1c(cccc1Cl)Cl CSC000184137 [0,2,0,0,0,0|1,0,0]=3 475 B13R1.3420 CC(=O)COc1cc(cc(c1)Cl)Cl CSC000148508 [0,2,0,0,0,0|2,0,0]=4 476 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)C CSC000149143 [0,2,0,0,0,0|2,0,0]=4 477 B13R2.72 CC(=O)N1CCc2c1cccc2 CSC000155365 [0,0,0,1,0,1|1,0,0]=3 478 B13R2.72 CC(=O)N1CCc2c1ccnc2 CSC015312797 [0,0,0,1,0,1|2,0,0]=4 479 B13R2.72 CC(=O)N1CCc2c1cncc2 CSC000144878 [0,0,0,1,0,1|2,0,0]=4 480 B13R2.72 NC(=O)N1CCc2c1cccc2 CSC000238899 [0,0,0,1,0,1|1,0,0]=3 481 B9R1.6 CS(=O)c1ccccc1 CSC000038873 [0,0,0,0,2,0|2,0,0]=4 482 B9R1.13 NC(=O)Cc1cccs1 CSC000162174 [0,0,0,0,2,0|2,0,0]=4 483 B9R1.13 NC(=O)Cc1ccsc1 CSC000162286 [0,0,0,0,2,0|2,0,0]=4 484 B13R1.337 CC(=O)NCCOc1ccccc1 CSC000152567 [0,0,0,0,0,2|1,0,0]=3 485 B13R1.337 CC(=O)OCCCc1ccccc1 CSC000006332 [0,0,0,0,0,2|1,0,0]=3 486 B13R1.337 CC(=O)OCCOc1ccccc1 CSC000000575 [0,0,0,0,0,2|1,0,0]=3 487 B13R1.337 CC(=O)OCCSc1ccccc1 CSC009876666 [0,0,0,0,0,2|1,0,0]=3 488 B13R1.337 NC(=O)NCCOc1ccccc1 CSC000189186 [0,0,0,0,0,2|1,0,0]=3