0 B10R1.17 C#CCSc1ccccc1 CSC000172648 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.17 C=CCSc1ccccc1 CSC000006400 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.17 CCCSc1ccccc1 CSC000005822 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.17 CCSCc1ccccc1 CSC000006444 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.17 COCSc1ccccc1 CSC000000817 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.17 CSCCc1ccncc1 CSC015420737 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.17 OCCSc1ccccc1 CSC000230494 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.17 OCCSc1ccccn1 CSC000156319 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.17 OCCSc1ccncc1 CSC011297907 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.1 CCNCc1ccc(cc1)Br CSC000187385 [0,1,0,0,0,0|3,0,0]=4 10 B11R1.1 CCNCc1ccc(cc1)C CSC000180869 [0,1,0,0,0,0|3,0,0]=4 11 B11R1.1 CCNCc1ccc(cc1)F CSC000189070 [0,1,0,0,0,0|3,0,0]=4 12 B11R1.1 CCSCc1ccc(cc1)Br CSC000173025 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.1 CCSCc1ccc(cc1)C CSC000029035 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.1 CCSCc1ccc(cc1)Cl CSC000006432 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.1 CCSCc1ccc(cc1)F CSC000044549 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.1 Cc1ccc(cc1)NCCO CSC011233175 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.1 Cc1ccc(cc1)OCCO CSC011219107 [0,1,0,0,0,0|2,0,1]=4 18 B11R1.1 Cc1ccc(cc1)SCCO CSC000230582 [0,1,0,0,0,0|2,0,1]=4 19 B11R1.1 OCCNc1ccc(cc1)Cl CSC011233097 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.1 OCCNc1ccc(cc1)F CSC011233115 [0,1,0,0,0,0|2,0,1]=4 21 B11R1.1 OCCOc1ccc(cc1)Br CSC000686261 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.1 OCCOc1ccc(cc1)Cl CSC000237962 [0,1,0,0,0,0|2,0,1]=4 23 B11R1.1 OCCOc1ccc(cc1)F CSC011305846 [0,1,0,0,0,0|2,0,1]=4 24 B11R1.1 OCCOc1ccc(cc1)I CSC000230681 [0,1,0,0,0,0|2,0,1]=4 25 B11R1.1 OCCSc1ccc(cc1)Cl CSC000230527 [0,1,0,0,0,0|2,0,1]=4 26 B11R1.1 OCCSc1ccc(cc1)F CSC000230679 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.16 CCNC(C)c1ccccc1 CSC000187283 [0,1,0,0,0,0|3,0,0]=4 28 B11R1.17 CCNCc1ccccc1F CSC000201217 [0,1,0,0,0,0|3,0,0]=4 29 B11R1.17 CCSCc1ccccc1Cl CSC000044547 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.17 Cc1ccccc1NCCO CSC011233185 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.17 Cc1ccccc1OCCO CSC011305843 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.17 OCCNc1ccccc1Br CSC011233104 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.17 OCCOc1ccccc1Cl CSC000230518 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.17 OCCOc1ccccc1F CSC000756447 [0,1,0,0,0,0|2,0,1]=4 35 B11R1.17 OCCSc1ccccc1Br CSC000230852 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.17 OCCSc1ccccc1Cl CSC000230572 [0,1,0,0,0,0|2,0,1]=4 37 B11R1.17 OCCSc1ccccc1F CSC000230732 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.24 CCNCc1cccc(c1)F CSC000195558 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.24 CCNCc1cccc(c1)O CSC000201218 [0,1,0,0,0,0|3,0,0]=4 40 B11R1.24 CCSCc1cccc(c1)Br CSC000173034 [0,1,0,0,0,0|3,0,0]=4 41 B11R1.24 CCSCc1cccc(c1)Cl CSC000044546 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.24 CCSCc1cccc(c1)F CSC000044556 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.24 Cc1cccc(c1)NCCO CSC011232808 [0,1,0,0,0,0|2,0,1]=4 44 B11R1.24 Cc1cccc(c1)OCCO CSC011215094 [0,1,0,0,0,0|2,0,1]=4 45 B11R1.24 Cc1cccc(c1)SCCO CSC011432187 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.24 OCCOc1cccc(c1)F CSC011305856 [0,1,0,0,0,0|2,0,1]=4 47 B11R1.24 OCCSc1cccc(c1)Br CSC011756134 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.24 OCCSc1cccc(c1)Cl CSC011721761 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.24 OCCSc1cccc(c1)F CSC011996949 [0,1,0,0,0,0|2,0,1]=4 50 B11R1.28 CC#CCNc1ccccc1 CSC011641403 [0,1,0,0,0,0|2,0,1]=4 51 B11R1.28 CCCCNc1ccccc1 CSC000211623 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.28 CCCCOc1ccccc1 CSC011212283 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.28 CCCSCc1ccccc1 CSC000006446 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.28 COCCOc1ccccc1 CSC000757042 [0,1,0,0,0,0|2,0,1]=4 55 B11R1.28 COCCSc1ccccc1 CSC025761232 [0,1,0,0,0,0|2,0,1]=4 56 B11R1.28 CSCCCc1ccccc1 CSC000051364 [0,1,0,0,0,0|1,1,1]=4 57 B11R1.28 CSCCOc1ccccc1 CSC000148400 [0,1,0,0,0,0|2,0,1]=4 58 B11R1.28 N#CCCSc1ccccc1 CSC000172086 [0,1,0,0,0,0|2,0,1]=4 59 B11R1.28 OCCCOc1ccccc1 CSC011215863 [0,1,0,0,0,0|1,0,1]=3 60 B11R1.28 OCCNCc1ccccc1 CSC000180844 [0,1,0,0,0,0|1,0,1]=3 61 B11R1.28 OCCNCc1ccccn1 CSC000200435 [0,1,0,0,0,0|2,0,1]=4 62 B11R1.28 OCCNCc1ccncc1 CSC000200482 [0,1,0,0,0,0|2,0,1]=4 63 B11R1.28 OCCSCc1ccccc1 CSC011205989 [0,1,0,0,0,0|1,0,1]=3 64 B11R1.40 CCC(=O)Nc1ccccc1 CSC000153483 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.40 CCC(=O)Oc1ccccc1 CSC000001944 [0,1,0,0,0,0|3,0,0]=4 66 B11R1.40 CCN(C)Cc1ccccc1 CSC000018720 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.40 CNC(=O)Nc1ccccc1 CSC000178567 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.40 COC(=O)Oc1ccccc1 CSC000020726 [0,1,0,0,0,0|3,0,0]=4 69 B11R1.40 NCC(=O)Nc1ccccc1 CSC000168422 [0,1,0,0,0,0|3,0,0]=4 70 B11R1.91 CC(=O)OCc1ccccc1 CSC000000625 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.91 CC(C)SCc1ccccc1 CSC000006445 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.91 CC(O)CNc1ccccc1 CSC011364939 [0,1,0,0,0,0|2,0,1]=4 73 B10R1.1 CSCc1ccc(cc1)C CSC000051358 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.1 CSCc1ccc(cc1)Cl CSC000000312 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.1 CSCc1ccc(cc1)F CSC000051356 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.4 CSCc1ccccc1Br CSC000148299 [1,1,0,0,0,0|2,0,0]=4 77 B10R1.4 CSCc1ccccc1Cl CSC000051354 [1,1,0,0,0,0|2,0,0]=4 78 B10R1.10 CSCc1cccc(c1)Cl CSC000051353 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.10 CSCc1cccc(c1)F CSC000053058 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.15 ONC(=O)c1cccnc1 CSC000190125 [1,1,0,0,0,0|1,0,1]=4 81 B10R1.18 CS(=O)Cc1ccccc1 CSC000064350 [1,1,0,0,0,0|1,0,1]=4 82 B12R1.1 Cc1ccc(cc1)CSCCO CSC011212911 [0,2,0,0,0,0|1,0,1]=4 83 B12R1.1 Cc1ccc(cc1)SCCCO CSC000213565 [0,2,0,0,0,0|1,0,1]=4 84 B12R1.1 OCCCSc1ccc(cc1)Br CSC000213788 [0,2,0,0,0,0|1,0,1]=4 85 B12R1.1 OCCCSc1ccc(cc1)Cl CSC000212878 [0,2,0,0,0,0|1,0,1]=4 86 B12R1.1 OCCNCc1ccc(cc1)Br CSC000186819 [0,2,0,0,0,0|1,0,1]=4 87 B12R1.1 OCCNCc1ccc(cc1)Br CSC000186819 [0,2,0,0,0,0|1,0,1]=4 88 B12R1.1 OCCNCc1ccc(cc1)Cl CSC000180886 [0,2,0,0,0,0|1,0,1]=4 89 B12R1.1 OCCNCc1ccc(cc1)F CSC000180845 [0,2,0,0,0,0|1,0,1]=4 90 B12R1.1 OCCSCc1ccc(cc1)Br CSC011212529 [0,2,0,0,0,0|1,0,1]=4 91 B12R1.1 OCCSCc1ccc(cc1)Cl CSC000186141 [0,2,0,0,0,0|1,0,1]=4 92 B12R1.1 OCCSCc1ccc(cc1)F CSC011212906 [0,2,0,0,0,0|1,0,1]=4 93 B12R1.1 OCCSCc1ccc(cc1)I CSC000238427 [0,2,0,0,0,0|1,0,1]=4 94 B12R1.49 CNC(=O)Cc1ccc(cc1)Br CSC000155101 [0,2,0,0,0,0|1,0,1]=4 95 B12R1.49 CNC(=O)Cc1ccc(cc1)C CSC000185632 [0,2,0,0,0,0|1,0,1]=4 96 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl CSC000159878 [0,2,0,0,0,0|1,0,1]=4 97 B12R1.49 CNC(=O)Cc1ccc(cc1)F CSC000159896 [0,2,0,0,0,0|1,0,1]=4 98 B12R1.49 COC(=O)Cc1ccc(cc1)Br CSC000149743 [0,2,0,0,0,0|2,0,0]=4 99 B12R1.49 COC(=O)Cc1ccc(cc1)C CSC000204387 [0,2,0,0,0,0|2,0,0]=4 100 B12R1.49 COC(=O)Cc1ccc(cc1)F CSC000148989 [0,2,0,0,0,0|2,0,0]=4 101 B12R1.49 COC(=O)Cc1ccc(cc1)I CSC012356276 [0,2,0,0,0,0|2,0,0]=4 102 B12R1.49 COC(=O)Cc1ccc(cc1)O CSC000211648 [0,2,0,0,0,0|2,0,0]=4 103 B12R1.49 Cc1ccc(cc1)CC(=O)NN CSC000189221 [0,2,0,0,0,0|1,0,1]=4 104 B12R1.49 Cc1ccc(cc1)NC(=O)CO CSC000246325 [0,2,0,0,0,0|2,0,0]=4 105 B12R1.49 NNC(=O)Cc1ccc(cc1)Br CSC000189848 [0,2,0,0,0,0|1,0,1]=4 106 B12R1.30 CC(NCCO)c1ccccc1 CSC000224688 [0,2,0,0,0,0|1,0,1]=4 107 B12R1.30 C[C@@H](NCCO)c1ccccc1 CSC000753783 [0,2,0,0,0,0|1,0,1]=4 108 B12R1.34 COC(=O)C(O)c1ccccc1 CSC000150732 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.34 COC(=O)[C@@H](O)c1ccccc1 CSC009815906 [0,2,0,0,0,0|2,0,0]=4 110 B12R1.34 COC(=O)[C@H](O)c1ccccc1 CSC009815907 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.34 NNC(=O)C(O)c1ccccc1 CSC011203043 [0,2,0,0,0,0|1,0,1]=4 112 B12R1.267 Cc1ccccc1CNCCO CSC000200476 [0,2,0,0,0,0|1,0,1]=4 113 B12R1.267 Cc1ccccc1SCCCO CSC011363065 [0,2,0,0,0,0|1,0,1]=4 114 B12R1.267 OCCCSc1ccccc1Br CSC000230866 [0,2,0,0,0,0|1,0,1]=4 115 B12R1.267 OCCCSc1ccccc1Cl CSC000213372 [0,2,0,0,0,0|1,0,1]=4 116 B12R1.267 OCCNCc1ccccc1Cl CSC000200449 [0,2,0,0,0,0|1,0,1]=4 117 B12R1.267 OCCNCc1ccccc1F CSC000200485 [0,2,0,0,0,0|1,0,1]=4 118 B12R1.267 OCCSCc1ccccc1Cl CSC011212904 [0,2,0,0,0,0|1,0,1]=4 119 B12R1.267 OCCSCc1ccccc1F CSC000238361 [0,2,0,0,0,0|1,0,1]=4 120 B12R1.371 CNC(=O)Cc1ccccc1Br CSC009816160 [0,2,0,0,0,0|1,0,1]=4 121 B12R1.371 CNC(=O)Cc1ccccc1C CSC000175625 [0,2,0,0,0,0|1,0,1]=4 122 B12R1.371 CNC(=O)Cc1ccccc1Cl CSC000159959 [0,2,0,0,0,0|1,0,1]=4 123 B12R1.371 CNC(=O)Cc1ccccc1F CSC000159918 [0,2,0,0,0,0|1,0,1]=4 124 B12R1.371 CNC(=O)Cc1ccccc1N CSC000738506 [0,2,0,0,0,0|1,0,1]=4 125 B12R1.371 COC(=O)Cc1ccccc1Br CSC000699816 [0,2,0,0,0,0|2,0,0]=4 126 B12R1.371 COC(=O)Cc1ccccc1C CSC000175439 [0,2,0,0,0,0|2,0,0]=4 127 B12R1.371 COC(=O)Cc1ccccc1F CSC000149365 [0,2,0,0,0,0|2,0,0]=4 128 B12R1.371 COC(=O)Cc1ccccc1O CSC000758901 [0,2,0,0,0,0|2,0,0]=4 129 B12R1.371 Cc1ccccc1CC(=O)NN CSC000190038 [0,2,0,0,0,0|1,0,1]=4 130 B12R1.371 Cc1ccccc1CC(=O)NO CSC000190267 [0,2,0,0,0,0|0,0,1]=3 131 B12R1.371 NNC(=O)Cc1ccccc1Cl CSC000189918 [0,2,0,0,0,0|1,0,1]=4 132 B12R1.371 NNC(=O)Cc1ccccc1F CSC000190036 [0,2,0,0,0,0|1,0,1]=4 133 B12R1.28 Cc1cccc(c1)CSCCO CSC011212950 [0,2,0,0,0,0|1,0,1]=4 134 B12R1.28 Cc1cccc(c1)SCCCO CSC011432191 [0,2,0,0,0,0|1,0,1]=4 135 B12R1.28 OCCCSc1cccc(c1)Br CSC011756144 [0,2,0,0,0,0|1,0,1]=4 136 B12R1.28 OCCCSc1cccc(c1)Cl CSC011721771 [0,2,0,0,0,0|1,0,1]=4 137 B12R1.28 OCCNCc1cccc(c1)Br CSC000187539 [0,2,0,0,0,0|1,0,1]=4 138 B12R1.28 OCCSCc1cccc(c1)Cl CSC011212903 [0,2,0,0,0,0|1,0,1]=4 139 B12R1.28 OCCSCc1cccc(c1)F CSC011212928 [0,2,0,0,0,0|1,0,1]=4 140 B12R1.50 CNC(=O)Cc1cccc(c1)Br CSC011714096 [0,2,0,0,0,0|1,0,1]=4 141 B12R1.50 CNC(=O)Cc1cccc(c1)Cl CSC011795159 [0,2,0,0,0,0|1,0,1]=4 142 B12R1.50 CNC(=O)Cc1cccc(c1)F CSC000159957 [0,2,0,0,0,0|1,0,1]=4 143 B12R1.50 COC(=O)Cc1cccc(c1)Br CSC000699549 [0,2,0,0,0,0|2,0,0]=4 144 B12R1.50 COC(=O)Cc1cccc(c1)C CSC011661688 [0,2,0,0,0,0|2,0,0]=4 145 B12R1.50 COC(=O)Cc1cccc(c1)Cl CSC011690634 [0,2,0,0,0,0|2,0,0]=4 146 B12R1.50 COC(=O)Cc1cccc(c1)F CSC000151121 [0,2,0,0,0,0|2,0,0]=4 147 B12R1.50 Cc1cccc(c1)NC(=O)CO CSC000749660 [0,2,0,0,0,0|2,0,0]=4 148 B12R1.50 NNC(=O)Cc1cccc(c1)Cl CSC011203430 [0,2,0,0,0,0|1,0,1]=4 149 B12R1.50 NNC(=O)Cc1cccc(c1)F CSC000189928 [0,2,0,0,0,0|1,0,1]=4 150 B12R1.27 CC(CO)NCc1ccccc1 CSC000713660 [0,2,0,0,0,0|1,0,1]=4 151 B12R1.27 CCC(=O)NCc1ccccc1 CSC000153145 [0,2,0,0,0,0|2,0,0]=4 152 B12R1.27 CCC(=O)OCc1ccccc1 CSC000000848 [0,2,0,0,0,0|2,0,0]=4 153 B12R1.27 CNC(=O)CCc1ccccc1 CSC000159837 [0,2,0,0,0,0|1,0,1]=4 154 B12R1.27 CNC(=O)COc1ccccc1 CSC000150564 [0,2,0,0,0,0|1,0,1]=4 155 B12R1.27 CNC(=O)CSc1ccccc1 CSC000150703 [0,2,0,0,0,0|1,0,1]=4 156 B12R1.27 CNC(=O)NCc1ccccc1 CSC000222791 [0,2,0,0,0,0|1,0,1]=4 157 B12R1.27 COC(=O)COc1ccccc1 CSC000148705 [0,2,0,0,0,0|2,0,0]=4 158 B12R1.27 COC(=O)CSc1ccccc1 CSC000151200 [0,2,0,0,0,0|2,0,0]=4 159 B12R1.27 COC(=O)NCc1ccccc1 CSC000235978 [0,2,0,0,0,0|2,0,0]=4 160 B12R1.27 NNC(=O)CCc1ccccc1 CSC000189782 [0,2,0,0,0,0|1,0,1]=4 161 B12R1.27 NNC(=O)COc1ccccc1 CSC000186219 [0,2,0,0,0,0|1,0,1]=4 162 B12R1.27 NNC(=O)CSc1ccccc1 CSC000189974 [0,2,0,0,0,0|1,0,1]=4 163 B12R1.27 OCC(=O)NCc1ccccc1 CSC000246335 [0,2,0,0,0,0|1,0,0]=3 164 B12R1.27 OCC(O)CSc1ccccc1 CSC000208506 [0,2,0,0,0,0|1,0,1]=4 165 B12R1.252 CC(=CCOc1ccccc1)C CSC000173691 [0,2,0,0,0,0|2,0,0]=4