0 B10R1.17 C#CCSc1ccccc1 CSC000172648 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.17 C=CCSc1ccccc1 CSC000006400 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.17 CCCSc1ccccc1 CSC000005822 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.17 CCCSc1ccccn1 CSC000006455 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.17 CCSCc1ccccc1 CSC000006444 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.17 COCSc1ccccc1 CSC000000817 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.17 CSCCc1ccncc1 CSC015420737 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.17 OCCSc1ccccc1 CSC000230494 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.17 OCCSc1ccccn1 CSC000156319 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.17 OCCSc1ccncc1 CSC011297907 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.8 CCSc1ncccn1 CSC000000290 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.1 Brc1ccc(cc1)OCC#N CSC000169425 [0,1,0,0,0,0|1,0,2]=4 12 B11R1.1 Brc1ccc(cc1)OCC=C CSC000172055 [0,1,0,0,0,0|2,0,1]=4 13 B11R1.1 Brc1ccc(cc1)SCC=C CSC009811901 [0,1,0,0,0,0|2,0,1]=4 14 B11R1.1 CCCOc1ccc(cc1)Br CSC000169948 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.1 CCCOc1ccc(cc1)C CSC000169969 [0,1,0,0,0,0|2,0,0]=3 16 B11R1.1 CCCSc1ccc(cc1)Br CSC009811899 [0,1,0,0,0,0|2,0,0]=3 17 B11R1.1 CCCSc1ccc(cc1)C CSC000006743 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.1 CCCSc1ccc(cc1)Cl CSC000005799 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.1 CCCSc1ccc(cc1)F CSC015531415 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.1 CCNCc1ccc(cc1)Br CSC000187385 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.1 CCNCc1ccc(cc1)C CSC000180869 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.1 CCNCc1ccc(cc1)F CSC000189070 [0,1,0,0,0,0|2,0,0]=3 23 B11R1.1 CCSCc1ccc(cc1)Br CSC000173025 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.1 CCSCc1ccc(cc1)C CSC000029035 [0,1,0,0,0,0|2,0,0]=3 25 B11R1.1 CCSCc1ccc(cc1)Cl CSC000006432 [0,1,0,0,0,0|2,0,0]=3 26 B11R1.1 CCSCc1ccc(cc1)F CSC000044549 [0,1,0,0,0,0|2,0,0]=3 27 B11R1.1 Cc1ccc(cc1)NCC#C CSC000219994 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.1 Cc1ccc(cc1)NCCO CSC011233175 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.1 Cc1ccc(cc1)OCC=C CSC000172063 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.1 Cc1ccc(cc1)OCCO CSC011219107 [0,1,0,0,0,0|2,0,0]=3 31 B11R1.1 Cc1ccc(cc1)SCC#N CSC000173268 [0,1,0,0,0,0|1,0,2]=4 32 B11R1.1 Cc1ccc(cc1)SCC=C CSC000006760 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.1 Cc1ccc(cc1)SCCO CSC000230582 [0,1,0,0,0,0|2,0,0]=3 34 B11R1.1 Clc1ccc(cc1)NCC#C CSC000220173 [0,1,0,0,0,0|2,0,1]=4 35 B11R1.1 Clc1ccc(cc1)SCC=C CSC000006393 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.1 Fc1ccc(cc1)SCC=C CSC000006478 [0,1,0,0,0,0|2,0,1]=4 37 B11R1.1 NCCNc1ccc(cn1)Br CSC011214600 [0,1,0,0,0,0|2,0,0]=3 38 B11R1.1 NCCNc1ncc(cn1)Br CSC011938732 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.1 OCCNc1ccc(cc1)Cl CSC011233097 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.1 OCCNc1ccc(cc1)F CSC011233115 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.1 OCCOc1ccc(cc1)Br CSC000686261 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.1 OCCOc1ccc(cc1)Cl CSC000237962 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.1 OCCOc1ccc(cc1)F CSC011305846 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.1 OCCOc1ccc(cc1)I CSC000230681 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.1 OCCSc1ccc(cc1)Cl CSC000230527 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.1 OCCSc1ccc(cc1)F CSC000230679 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.1 OCCSc1ccc(cn1)Cl CSC011219778 [0,1,0,0,0,0|3,0,0]=4 48 B11R1.16 CCNC(=O)c1ccccc1 CSC000160121 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.16 CCNC(C)c1ccccc1 CSC000187283 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.16 CN(CC=C)c1ccccc1 CSC000018674 [0,1,0,0,0,0|2,0,1]=4 51 B11R1.16 CN(CCN)c1ccccc1 CSC000231046 [0,1,0,0,0,0|1,0,0]=2 52 B11R1.16 CSCC(=O)c1ccccc1 CSC000748581 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.17 Brc1ccccc1OCC=C CSC000173964 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.17 CCCCn1cnccc1=O CSC012650617 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.17 CCCOc1ccccc1Br CSC000174042 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.17 CCCOc1ccccc1C CSC000169983 [0,1,0,0,0,0|2,0,0]=3 57 B11R1.17 CCCOc1ccccc1F CSC000173322 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.17 CCCSc1ccccc1Br CSC000230854 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.17 CCCSc1ccccc1Cl CSC000006739 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.17 CCNCc1ccccc1F CSC000201217 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.17 CCSCc1ccccc1Cl CSC000044547 [0,1,0,0,0,0|2,0,0]=3 62 B11R1.17 Cc1ccccc1NCC=C CSC011613358 [0,1,0,0,0,0|2,0,1]=4 63 B11R1.17 Cc1ccccc1NCCO CSC011233185 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.17 Cc1ccccc1OCC=C CSC000172067 [0,1,0,0,0,0|2,0,1]=4 65 B11R1.17 Cc1ccccc1OCCO CSC011305843 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.17 Cc1cnccc1NCCN CSC011934644 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.17 Clc1ccccc1OCC#N CSC000169426 [0,1,0,0,0,0|1,0,2]=4 68 B11R1.17 Clc1ccccc1OCC=C CSC000172057 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.17 Clc1ccccc1SCC#N CSC000149087 [0,1,0,0,0,0|1,0,2]=4 70 B11R1.17 FCCSc1ccccc1Br CSC010198681 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.17 Fc1ccccc1OCC#N CSC000173231 [0,1,0,0,0,0|1,0,2]=4 72 B11R1.17 Fc1ccccc1OCC=C CSC000173442 [0,1,0,0,0,0|2,0,1]=4 73 B11R1.17 NCCNc1ccncc1Br CSC013404666 [0,1,0,0,0,0|2,0,0]=3 74 B11R1.17 NCCNc1ncccc1Br CSC011464841 [0,1,0,0,0,0|2,0,0]=3 75 B11R1.17 OCCNc1ccccc1Br CSC011233104 [0,1,0,0,0,0|2,0,0]=3 76 B11R1.17 OCCOc1ccccc1Cl CSC000230518 [0,1,0,0,0,0|2,0,0]=3 77 B11R1.17 OCCOc1ccccc1F CSC000756447 [0,1,0,0,0,0|2,0,0]=3 78 B11R1.17 OCCSc1ccccc1Br CSC000230852 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.17 OCCSc1ccccc1Cl CSC000230572 [0,1,0,0,0,0|2,0,0]=3 80 B11R1.17 OCCSc1ccccc1F CSC000230732 [0,1,0,0,0,0|2,0,0]=3 81 B11R1.24 CCCOc1cccc(c1)C CSC000169976 [0,1,0,0,0,0|2,0,0]=3 82 B11R1.24 CCCSc1cccc(c1)Br CSC009815762 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.24 CCCSc1cccc(c1)C CSC000055754 [0,1,0,0,0,0|2,0,0]=3 84 B11R1.24 CCCSc1cccc(c1)Cl CSC000059010 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.24 CCNCc1cccc(c1)F CSC000195558 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.24 CCNCc1cccc(c1)O CSC000201218 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.24 CCSCc1cccc(c1)Br CSC000173034 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.24 CCSCc1cccc(c1)Cl CSC000044546 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.24 CCSCc1cccc(c1)F CSC000044556 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.24 Cc1cccc(c1)NCCO CSC011232808 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.24 Cc1cccc(c1)OCCO CSC011215094 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.24 Cc1cccc(c1)SCCO CSC011432187 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.24 Cc1ccnc(c1)NCCN CSC011532785 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.24 NCCNc1cncc(c1)Br CSC014501548 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.24 OCCOc1cccc(c1)F CSC011305856 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.24 OCCSc1cccc(c1)Br CSC011756134 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.24 OCCSc1cccc(c1)Cl CSC011721761 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.24 OCCSc1cccc(c1)F CSC011996949 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.28 CC#CCNc1ccccc1 CSC011641403 [0,1,0,0,0,0|1,0,2]=4 100 B11R1.28 CCCCNc1ccccc1 CSC000211623 [0,1,0,0,0,0|1,0,0]=2 101 B11R1.28 CCCCNc1ccccn1 CSC000156416 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.28 CCCCOc1ccccc1 CSC011212283 [0,1,0,0,0,0|1,0,0]=2 103 B11R1.28 CCCCSc1ncccn1 CSC000002571 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.28 CCCNCc1ccccn1 CSC000201641 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.28 CCCNCc1cccnc1 CSC000180834 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.28 CCCNCc1ccncc1 CSC000180873 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.28 CCCSCc1ccccc1 CSC000006446 [0,1,0,0,0,0|1,0,0]=2 108 B11R1.28 COCCOc1ccccc1 CSC000757042 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.28 COCCSc1ccccc1 CSC025761232 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.28 COCCSc1ccccn1 CSC000024487 [0,1,0,0,0,0|3,0,0]=4 111 B11R1.28 CSCCCc1ccccc1 CSC000051364 [0,1,0,0,0,0|1,0,0]=2 112 B11R1.28 CSCCOc1ccccc1 CSC000148400 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.28 N#CCCSc1ccccc1 CSC000172086 [0,1,0,0,0,0|0,0,2]=3 114 B11R1.28 OCCCOc1ccccc1 CSC011215863 [0,1,0,0,0,0|1,0,0]=2 115 B11R1.28 OCCNCc1ccccc1 CSC000180844 [0,1,0,0,0,0|1,0,0]=2 116 B11R1.28 OCCNCc1ccccn1 CSC000200435 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.28 OCCNCc1ccncc1 CSC000200482 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.28 OCCSCc1ccccc1 CSC011205989 [0,1,0,0,0,0|1,0,0]=2 119 B11R1.40 CCC(=O)Nc1ccccc1 CSC000153483 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.40 CCC(=O)Oc1ccccc1 CSC000001944 [0,1,0,0,0,0|2,0,1]=4 121 B11R1.40 CCC(C)Sc1ccccc1 CSC009831573 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.40 CCN(C)Cc1ccccc1 CSC000018720 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.40 NCC(=O)Nc1ccccc1 CSC000168422 [0,1,0,0,0,0|1,0,1]=3 124 B11R1.40 NCC(=O)Nc1ccncc1 CSC000238581 [0,1,0,0,0,0|2,0,1]=4 125 B11R1.91 CC(=C)COc1ccccc1 CSC000171512 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.91 CC(=C)CSc1ccccc1 CSC000006268 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.91 CC(=O)OCc1ccccc1 CSC000000625 [0,1,0,0,0,0|2,0,1]=4 128 B11R1.91 CC(C)CNc1ccccn1 CSC000156674 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.91 CC(C)NCc1ccccn1 CSC000200191 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.91 CC(C)NCc1cccnc1 CSC000200193 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.91 CC(C)NCc1ccncc1 CSC000200223 [0,1,0,0,0,0|3,0,0]=4 132 B11R1.91 CC(C)SCc1ccccc1 CSC000006445 [0,1,0,0,0,0|2,0,0]=3 133 B11R1.91 CC(N)CNc1ccccn1 CSC011914399 [0,1,0,0,0,0|2,0,0]=3 134 B11R1.91 CC(O)CNc1ccccc1 CSC011364939 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.91 NC(=O)C#Cc1ccccc1 CSC000041776 [0,1,0,0,0,0|0,0,3]=4 136 B11R1.91 NC(=O)COc1ccccc1 CSC000150575 [0,1,0,0,0,0|1,0,1]=3 137 B11R1.91 NC(=O)CSc1ccccn1 CSC000149794 [0,1,0,0,0,0|2,0,1]=4 138 B9R1.12 CCNCc1cccs1 CSC000186918 [0,0,0,0,1,0|3,0,0]=4 139 B9R1.12 CCNCc1ccsc1 CSC000201226 [0,0,0,0,1,0|3,0,0]=4 140 B9R1.12 CCSCc1ccco1 CSC000028914 [0,0,0,0,1,0|3,0,0]=4 141 B9R1.12 OCCSc1cccs1 CSC011305907 [0,0,0,0,1,0|3,0,0]=4 142 B10R1.1 CCNc1ccc(cc1)Cl CSC000220165 [1,1,0,0,0,0|1,0,0]=3 143 B10R1.1 CCNc1ccc(cn1)Br CSC000741496 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.1 CCOc1ccc(cc1)Br CSC000169946 [1,1,0,0,0,0|1,0,0]=3 145 B10R1.1 CCOc1ccc(cc1)Cl CSC000169960 [1,1,0,0,0,0|1,0,0]=3 146 B10R1.1 CCOc1ccc(cc1)I CSC000171712 [1,1,0,0,0,0|1,0,0]=3 147 B10R1.1 CCSc1ccc(cc1)Br CSC009811893 [1,1,0,0,0,0|1,0,0]=3 148 B10R1.1 CCSc1ccc(cc1)C CSC000006686 [1,1,0,0,0,0|1,0,0]=3 149 B10R1.1 CCSc1ccc(cc1)Cl CSC000005996 [1,1,0,0,0,0|1,0,0]=3 150 B10R1.1 CCSc1ccc(cc1)F CSC000006007 [1,1,0,0,0,0|1,0,0]=3 151 B10R1.1 CSCc1ccc(cc1)C CSC000051358 [1,1,0,0,0,0|1,0,0]=3 152 B10R1.1 CSCc1ccc(cc1)Cl CSC000000312 [1,1,0,0,0,0|1,0,0]=3 153 B10R1.1 CSCc1ccc(cc1)F CSC000051356 [1,1,0,0,0,0|1,0,0]=3 154 B10R1.4 CCNc1ccccc1Cl CSC000219383 [1,1,0,0,0,0|1,0,0]=3 155 B10R1.4 CCOc1ccccc1Cl CSC000169953 [1,1,0,0,0,0|1,0,0]=3 156 B10R1.4 CCOc1ccccc1F CSC000172994 [1,1,0,0,0,0|1,0,0]=3 157 B10R1.4 CCSc1ccccc1C CSC000053911 [1,1,0,0,0,0|1,0,0]=3 158 B10R1.4 CCSc1ccccc1Cl CSC000006683 [1,1,0,0,0,0|1,0,0]=3 159 B10R1.4 CSCc1ccccc1Br CSC000148299 [1,1,0,0,0,0|1,0,0]=3 160 B10R1.4 CSCc1ccccc1Cl CSC000051354 [1,1,0,0,0,0|1,0,0]=3 161 B10R1.10 CCOc1cccc(c1)Cl CSC000170019 [1,1,0,0,0,0|1,0,0]=3 162 B10R1.10 CCOc1cccc(c1)F CSC000170038 [1,1,0,0,0,0|1,0,0]=3 163 B10R1.10 CCSc1cccc(c1)C CSC000055746 [1,1,0,0,0,0|1,0,0]=3 164 B10R1.10 CCSc1cccc(c1)Cl CSC000059004 [1,1,0,0,0,0|1,0,0]=3 165 B10R1.10 CCSc1cccc(c1)F CSC000106542 [1,1,0,0,0,0|1,0,0]=3 166 B10R1.10 CSCc1cccc(c1)Cl CSC000051353 [1,1,0,0,0,0|1,0,0]=3 167 B10R1.10 CSCc1cccc(c1)F CSC000053058 [1,1,0,0,0,0|1,0,0]=3 168 B10R1.18 CS(=O)Cc1ccccc1 CSC000064350 [1,1,0,0,0,0|1,0,0]=3 169 B10R1.21 CCCNCc1cccs1 CSC000186944 [0,1,0,0,1,0|2,0,0]=4 170 B10R1.21 CCCNCc1ccsc1 CSC000201670 [0,1,0,0,1,0|2,0,0]=4 171 B10R1.21 OCCNCc1ccco1 CSC000200452 [0,1,0,0,1,0|2,0,0]=4 172 B10R1.21 OCCNCc1cccs1 CSC000200436 [0,1,0,0,1,0|2,0,0]=4 173 B12R1.1 CCCCOc1ccc(cc1)Br CSC011212269 [0,2,0,0,0,0|1,0,0]=3 174 B12R1.1 CCCCOc1ccc(cc1)C CSC011212278 [0,2,0,0,0,0|1,0,0]=3 175 B12R1.1 CCCCOc1ccc(cc1)Cl CSC000237964 [0,2,0,0,0,0|1,0,0]=3 176 B12R1.1 CCCCOc1ccc(cc1)I CSC000230682 [0,2,0,0,0,0|1,0,0]=3 177 B12R1.1 CCCCSc1ccc(cc1)C CSC000015701 [0,2,0,0,0,0|1,0,0]=3 178 B12R1.1 CCCNCc1ccc(cc1)Br CSC000186942 [0,2,0,0,0,0|1,0,0]=3 179 B12R1.1 CCCNCc1ccc(cc1)C CSC000186941 [0,2,0,0,0,0|1,0,0]=3 180 B12R1.1 CCCNCc1ccc(cc1)Cl CSC000180872 [0,2,0,0,0,0|1,0,0]=3 181 B12R1.1 CNCCNc1ccc(cn1)Br CSC011723281 [0,2,0,0,0,0|2,0,0]=4 182 B12R1.1 COCCSc1ccc(cc1)C CSC000022196 [0,2,0,0,0,0|2,0,0]=4 183 B12R1.1 COCCSc1ccc(cc1)Cl CSC000022191 [0,2,0,0,0,0|2,0,0]=4 184 B12R1.1 Cc1ccc(cc1)CSCCO CSC011212911 [0,2,0,0,0,0|1,0,0]=3 185 B12R1.1 Cc1ccc(cc1)SCCCO CSC000213565 [0,2,0,0,0,0|1,0,0]=3 186 B12R1.1 Clc1ccc(cc1)SCCC#N CSC000172061 [0,2,0,0,0,0|0,0,2]=4 187 B12R1.1 OCCCSc1ccc(cc1)Br CSC000213788 [0,2,0,0,0,0|1,0,0]=3 188 B12R1.1 OCCCSc1ccc(cc1)Cl CSC000212878 [0,2,0,0,0,0|1,0,0]=3 189 B12R1.1 OCCNCc1ccc(cc1)Br CSC000186819 [0,2,0,0,0,0|1,0,0]=3 190 B12R1.1 OCCNCc1ccc(cc1)Br CSC000186819 [0,2,0,0,0,0|1,0,0]=3 191 B12R1.1 OCCNCc1ccc(cc1)Cl CSC000180886 [0,2,0,0,0,0|1,0,0]=3 192 B12R1.1 OCCNCc1ccc(cc1)F CSC000180845 [0,2,0,0,0,0|1,0,0]=3 193 B12R1.1 OCCSCc1ccc(cc1)Br CSC011212529 [0,2,0,0,0,0|1,0,0]=3 194 B12R1.1 OCCSCc1ccc(cc1)Cl CSC000186141 [0,2,0,0,0,0|1,0,0]=3 195 B12R1.1 OCCSCc1ccc(cc1)F CSC011212906 [0,2,0,0,0,0|1,0,0]=3 196 B12R1.1 OCCSCc1ccc(cc1)I CSC000238427 [0,2,0,0,0,0|1,0,0]=3 197 B12R1.16 CCNC(C)c1ccc(cc1)Br CSC000231352 [0,2,0,0,0,0|2,0,0]=4 198 B12R1.16 CN(CCN)c1ccc(cn1)Br CSC011706631 [0,2,0,0,0,0|2,0,0]=4 199 B12R1.21 CC(C)COc1ccc(cc1)Br CSC000169949 [0,2,0,0,0,0|2,0,0]=4 200 B12R1.21 CC(C)NCc1ccc(cc1)C CSC000195779 [0,2,0,0,0,0|2,0,0]=4 201 B12R1.21 CC(C)NCc1ccc(cc1)Cl CSC000195761 [0,2,0,0,0,0|2,0,0]=4 202 B12R1.21 CC(C)NCc1ccc(cc1)F CSC000195765 [0,2,0,0,0,0|2,0,0]=4 203 B12R1.21 CC(O)CSc1ccc(cc1)Cl CSC011366763 [0,2,0,0,0,0|2,0,0]=4 204 B12R1.21 Cc1ccc(cc1)CNC(=O)N CSC000238954 [0,2,0,0,0,0|1,0,1]=4 205 B12R1.21 Cc1ccc(cc1)SCC(=O)N CSC000149676 [0,2,0,0,0,0|1,0,1]=4 206 B12R1.21 NC(=O)CCc1ccc(cc1)Cl CSC000022186 [0,2,0,0,0,0|0,0,1]=3 207 B12R1.21 NC(=O)COc1ccc(cc1)Br CSC000150415 [0,2,0,0,0,0|1,0,1]=4 208 B12R1.21 NC(=O)COc1ccc(cc1)Cl CSC000150449 [0,2,0,0,0,0|1,0,1]=4 209 B12R1.21 NC(=O)COc1ccc(cc1)F CSC000150549 [0,2,0,0,0,0|1,0,1]=4 210 B12R1.21 NC(=O)CSc1ccc(cc1)Cl CSC000150469 [0,2,0,0,0,0|1,0,1]=4 211 B12R1.21 NC(=O)NCc1ccc(cc1)F CSC000238953 [0,2,0,0,0,0|1,0,1]=4 212 B12R1.49 Cc1ccc(cc1)CC(=O)NN CSC000189221 [0,2,0,0,0,0|1,0,1]=4 213 B12R1.49 Cc1ccc(cc1)NC(=O)CN CSC000168395 [0,2,0,0,0,0|1,0,1]=4 214 B12R1.49 NCC(=O)Nc1ccc(cc1)Br CSC000168324 [0,2,0,0,0,0|1,0,1]=4 215 B12R1.49 NCC(=O)Nc1ccc(cc1)Cl CSC000168449 [0,2,0,0,0,0|1,0,1]=4 216 B12R1.49 NCC(=O)Nc1ccc(cc1)F CSC000168424 [0,2,0,0,0,0|1,0,1]=4 217 B12R1.49 NNC(=O)Cc1ccc(cc1)Br CSC000189848 [0,2,0,0,0,0|1,0,1]=4 218 B12R1.69 CCCOc1ccc(cc1Br)C CSC000186539 [0,2,0,0,0,0|2,0,0]=4 219 B12R1.69 CCCOc1ccc(cc1Br)Cl CSC000171686 [0,2,0,0,0,0|2,0,0]=4 220 B12R1.69 CCCOc1ccc(cc1Br)F CSC000171698 [0,2,0,0,0,0|2,0,0]=4 221 B12R1.69 CCCOc1ccc(cc1C)Br CSC000186540 [0,2,0,0,0,0|2,0,0]=4 222 B12R1.69 CCCOc1ccc(cc1Cl)Br CSC009811537 [0,2,0,0,0,0|2,0,0]=4 223 B12R1.69 CCCOc1ccc(cc1F)Br CSC009811878 [0,2,0,0,0,0|2,0,0]=4 224 B12R1.69 CCNCc1ccc(cc1Br)F CSC011192156 [0,2,0,0,0,0|2,0,0]=4 225 B12R1.69 CCNCc1ccc(cc1C)Br CSC011327901 [0,2,0,0,0,0|2,0,0]=4 226 B12R1.69 CCNCc1ccc(cc1Cl)Br CSC011344691 [0,2,0,0,0,0|2,0,0]=4 227 B12R1.69 CCNCc1ccc(cc1Cl)Cl CSC000186925 [0,2,0,0,0,0|2,0,0]=4 228 B12R1.69 CCNCc1ccc(cc1F)Br CSC000201290 [0,2,0,0,0,0|2,0,0]=4 229 B12R1.69 CCSCc1ccc(cc1Cl)F CSC000044551 [0,2,0,0,0,0|2,0,0]=4 230 B12R1.69 CCSCc1ccc(cc1F)F CSC010285517 [0,2,0,0,0,0|2,0,0]=4 231 B12R1.69 Cc1cc(ccc1NCCO)Cl CSC012185096 [0,2,0,0,0,0|2,0,0]=4 232 B12R1.69 Cc1cc(cnc1NCCN)Br CSC012632379 [0,2,0,0,0,0|2,0,0]=4 233 B12R1.69 Cc1ccc(c(c1)C)SCCO CSC000230672 [0,2,0,0,0,0|2,0,0]=4 234 B12R1.69 Cc1ccc(c(c1)F)NCCO CSC011243636 [0,2,0,0,0,0|2,0,0]=4 235 B12R1.69 NCCNc1ncc(cc1Br)Cl CSC013753189 [0,2,0,0,0,0|2,0,0]=4 236 B12R1.69 NCCNc1ncc(cc1Cl)Br CSC014045733 [0,2,0,0,0,0|2,0,0]=4 237 B12R1.69 OCCOc1ccc(cc1Cl)Cl CSC000205304 [0,2,0,0,0,0|2,0,0]=4 238 B12R1.69 OCCSc1ccc(cc1Cl)Cl CSC010001942 [0,2,0,0,0,0|2,0,0]=4 239 B12R1.69 OCCSc1ccc(cc1F)F CSC000204339 [0,2,0,0,0,0|2,0,0]=4 240 B12R1.71 CCCOc1ccc(cc1)OC CSC000005956 [0,2,0,0,0,0|2,0,0]=4 241 B12R1.71 CCCSc1ccc(cc1)OC CSC000021480 [0,2,0,0,0,0|2,0,0]=4 242 B12R1.71 CCNCc1ccc(cc1)C#N CSC000218035 [0,2,0,0,0,0|2,0,0]=4 243 B12R1.71 CCNCc1ccc(cc1)CC CSC000180871 [0,2,0,0,0,0|2,0,0]=4 244 B12R1.71 CCNCc1ccc(cc1)SC CSC000201209 [0,2,0,0,0,0|2,0,0]=4 245 B12R1.71 CCSCc1ccc(cc1)SC CSC000044554 [0,2,0,0,0,0|2,0,0]=4 246 B12R1.71 COc1ccc(cc1)OCCO CSC011305860 [0,2,0,0,0,0|2,0,0]=4 247 B12R1.71 COc1ccc(cc1)SCCO CSC000230841 [0,2,0,0,0,0|2,0,0]=4 248 B12R1.71 OCCOc1ccc(cc1)C#N CSC000230533 [0,2,0,0,0,0|2,0,0]=4 249 B12R1.71 OCCOc1ccc(cc1)CO CSC011232690 [0,2,0,0,0,0|2,0,0]=4 250 B12R1.385 CCNCc1ccc(c(c1)C)C CSC000201273 [0,2,0,0,0,0|2,0,0]=4 251 B12R1.385 CCNCc1ccc(c(c1)F)Br CSC011533704 [0,2,0,0,0,0|2,0,0]=4 252 B12R1.385 CCSCc1ccc(c(c1)Cl)Cl CSC000044548 [0,2,0,0,0,0|2,0,0]=4 253 B12R1.385 CCSCc1ccc(c(c1)F)F CSC000053064 [0,2,0,0,0,0|2,0,0]=4 254 B12R1.385 Cc1cc(ccc1Cl)OCCO CSC000230593 [0,2,0,0,0,0|2,0,0]=4 255 B12R1.385 Cc1cc(ncc1Br)NCCN CSC013757698 [0,2,0,0,0,0|2,0,0]=4 256 B12R1.385 Cc1nc(ccc1Br)NCCN CSC014340540 [0,2,0,0,0,0|2,0,0]=4 257 B12R1.385 OCCSc1ccc(c(c1)Cl)Cl CSC012295044 [0,2,0,0,0,0|2,0,0]=4 258 B12R1.3 CCN[C@H](CO)c1ccccc1 CSC012017371 [0,2,0,0,0,0|2,0,0]=4 259 B12R1.17 CN(CCN)c1cncc(c1)Br CSC014501570 [0,2,0,0,0,0|2,0,0]=4 260 B12R1.30 CC(NCC#C)c1ccccc1 CSC000216251 [0,2,0,0,0,0|1,0,1]=4 261 B12R1.30 CC(NCCO)c1ccccc1 CSC000224688 [0,2,0,0,0,0|1,0,0]=3 262 B12R1.30 CC(NCCO)c1ccccn1 CSC000713832 [0,2,0,0,0,0|2,0,0]=4 263 B12R1.30 CCCNC(=O)c1ccccc1 CSC000161722 [0,2,0,0,0,0|1,0,1]=4 264 B12R1.30 CCCNC(C)c1ccccc1 CSC000187307 [0,2,0,0,0,0|1,0,0]=3 265 B12R1.30 CN(CCCN)c1ccccc1 CSC000211881 [0,2,0,0,0,0|0,0,0]=2 266 B12R1.30 C[C@@H](NCC=C)c1ccccc1 CSC011934170 [0,2,0,0,0,0|1,0,1]=4 267 B12R1.30 C[C@@H](NCCO)c1ccccc1 CSC000753783 [0,2,0,0,0,0|1,0,0]=3 268 B12R1.30 NCCNC(=O)c1ccccn1 CSC011198448 [0,2,0,0,0,0|1,0,1]=4 269 B12R1.30 NCCNC(=O)c1ccncc1 CSC011198449 [0,2,0,0,0,0|1,0,1]=4 270 B12R1.34 CN(C(=O)CN)c1ccccc1 CSC000174886 [0,2,0,0,0,0|1,0,1]=4 271 B12R1.34 NNC(=O)C(O)c1ccccc1 CSC011203043 [0,2,0,0,0,0|1,0,1]=4 272 B12R1.39 CCCS(=O)(=O)c1ccccc1 CSC000031128 [0,2,0,0,0,0|2,0,0]=4 273 B12R1.39 OCCS(=O)(=O)c1ccccc1 CSC011215558 [0,2,0,0,0,0|2,0,0]=4 274 B12R1.107 NC(=O)CS(=O)c1ccccc1 CSC000064346 [0,2,0,0,0,0|1,0,1]=4 275 B12R1.308 CN(CCN)c1ccncc1Br CSC013405008 [0,2,0,0,0,0|2,0,0]=4 276 B12R1.308 CN(CCN)c1ncccc1Br CSC011706672 [0,2,0,0,0,0|2,0,0]=4 277 B12R1.25 CCCOc1cccc(c1F)F CSC000060278 [0,2,0,0,0,0|2,0,0]=4 278 B12R1.25 CCNCc1cccc(c1Cl)Cl CSC000201187 [0,2,0,0,0,0|2,0,0]=4 279 B12R1.25 CCNCc1cccc(c1F)F CSC011192140 [0,2,0,0,0,0|2,0,0]=4 280 B12R1.25 Cc1ccnc(c1Br)NCCN CSC014126675 [0,2,0,0,0,0|2,0,0]=4 281 B12R1.121 CCCOc1ccccc1C#N CSC000170523 [0,2,0,0,0,0|2,0,0]=4 282 B12R1.121 CCCOc1ccccc1CN CSC000185556 [0,2,0,0,0,0|2,0,0]=4 283 B12R1.121 CCCOc1ccccc1CO CSC011232767 [0,2,0,0,0,0|2,0,0]=4 284 B12R1.121 CCCOc1ccccc1SC CSC010368029 [0,2,0,0,0,0|2,0,0]=4 285 B12R1.121 CCCSc1ccccc1OC CSC000055745 [0,2,0,0,0,0|2,0,0]=4 286 B12R1.121 CCNCc1ccccc1OC CSC000186928 [0,2,0,0,0,0|2,0,0]=4 287 B12R1.121 CCSCc1ccccc1OC CSC000044553 [0,2,0,0,0,0|2,0,0]=4 288 B12R1.121 CCc1ccccc1NCCO CSC011233141 [0,2,0,0,0,0|2,0,0]=4 289 B12R1.121 COc1ccccc1OCCO CSC011305853 [0,2,0,0,0,0|2,0,0]=4 290 B12R1.121 COc1ccccc1SCCO CSC011448452 [0,2,0,0,0,0|2,0,0]=4 291 B12R1.121 OCCOc1ccccc1C#N CSC000193251 [0,2,0,0,0,0|2,0,0]=4 292 B12R1.125 CC(C)CNc1ccccc1Br CSC011231685 [0,2,0,0,0,0|2,0,0]=4 293 B12R1.125 CC(C)COc1ccccc1Br CSC000173973 [0,2,0,0,0,0|2,0,0]=4 294 B12R1.125 CC(C)NCc1ccccc1Br CSC000195800 [0,2,0,0,0,0|2,0,0]=4 295 B12R1.125 CC(C)NCc1ccccc1C CSC000195778 [0,2,0,0,0,0|2,0,0]=4 296 B12R1.125 CC(C)NCc1ccccc1Cl CSC000195757 [0,2,0,0,0,0|2,0,0]=4 297 B12R1.125 Cc1ccccc1OCC(=O)N CSC000150533 [0,2,0,0,0,0|1,0,1]=4 298 B12R1.125 NC(=O)CCc1ccccc1Cl CSC000162028 [0,2,0,0,0,0|0,0,1]=3 299 B12R1.125 NC(=O)CCc1ccccc1F CSC000016472 [0,2,0,0,0,0|0,0,1]=3 300 B12R1.125 NC(=O)COc1ccccc1Cl CSC000150432 [0,2,0,0,0,0|1,0,1]=4 301 B12R1.125 NC(=O)COc1ccccc1F CSC000150391 [0,2,0,0,0,0|1,0,1]=4 302 B12R1.125 NC(=O)COc1ccccc1O CSC000162348 [0,2,0,0,0,0|1,0,1]=4 303 B12R1.267 CCCCOc1ccccc1C CSC011212280 [0,2,0,0,0,0|1,0,0]=3 304 B12R1.267 CCCNCc1ccccc1C CSC000196471 [0,2,0,0,0,0|1,0,0]=3 305 B12R1.267 CCCNCc1ccccc1Cl CSC000196458 [0,2,0,0,0,0|1,0,0]=3 306 B12R1.267 CNCCNc1ccncc1Br CSC013405003 [0,2,0,0,0,0|2,0,0]=4 307 B12R1.267 CNCCNc1ncccc1Br CSC011723226 [0,2,0,0,0,0|2,0,0]=4 308 B12R1.267 Cc1ccccc1CNCCO CSC000200476 [0,2,0,0,0,0|1,0,0]=3 309 B12R1.267 Cc1ccccc1NCCC#N CSC000219713 [0,2,0,0,0,0|0,0,2]=4 310 B12R1.267 Cc1ccccc1SCCCO CSC011363065 [0,2,0,0,0,0|1,0,0]=3 311 B12R1.267 OCCCSc1ccccc1Br CSC000230866 [0,2,0,0,0,0|1,0,0]=3 312 B12R1.267 OCCCSc1ccccc1Cl CSC000213372 [0,2,0,0,0,0|1,0,0]=3 313 B12R1.267 OCCNCc1ccccc1Cl CSC000200449 [0,2,0,0,0,0|1,0,0]=3 314 B12R1.267 OCCNCc1ccccc1F CSC000200485 [0,2,0,0,0,0|1,0,0]=3 315 B12R1.267 OCCSCc1ccccc1Cl CSC011212904 [0,2,0,0,0,0|1,0,0]=3 316 B12R1.267 OCCSCc1ccccc1F CSC000238361 [0,2,0,0,0,0|1,0,0]=3 317 B12R1.371 Cc1ccccc1CC(=O)NN CSC000190038 [0,2,0,0,0,0|1,0,1]=4 318 B12R1.371 Cc1ccccc1NC(=O)CN CSC000168393 [0,2,0,0,0,0|1,0,1]=4 319 B12R1.371 NCC(=O)Nc1ccccc1Cl CSC000168390 [0,2,0,0,0,0|1,0,1]=4 320 B12R1.371 NCC(=O)Nc1ccccc1F CSC000168463 [0,2,0,0,0,0|1,0,1]=4 321 B12R1.371 NNC(=O)Cc1ccccc1Cl CSC000189918 [0,2,0,0,0,0|1,0,1]=4 322 B12R1.371 NNC(=O)Cc1ccccc1F CSC000190036 [0,2,0,0,0,0|1,0,1]=4 323 B12R1.374 CCCOc1cc(ccc1F)Br CSC012344585 [0,2,0,0,0,0|2,0,0]=4 324 B12R1.374 CCCOc1cc(ccc1F)C CSC012158738 [0,2,0,0,0,0|2,0,0]=4 325 B12R1.374 CCNCc1cc(ccc1Br)F CSC011206893 [0,2,0,0,0,0|2,0,0]=4 326 B12R1.374 CCNCc1cc(ccc1Cl)Br CSC011294197 [0,2,0,0,0,0|2,0,0]=4 327 B12R1.374 CCNCc1cc(ccc1Cl)Cl CSC011269129 [0,2,0,0,0,0|2,0,0]=4 328 B12R1.374 CCNCc1cc(ccc1F)Br CSC000201287 [0,2,0,0,0,0|2,0,0]=4 329 B12R1.374 CCSCc1cc(ccc1F)F CSC000053112 [0,2,0,0,0,0|2,0,0]=4 330 B12R1.1631 CCNCc1c(cccc1Cl)Cl CSC000186926 [0,2,0,0,0,0|2,0,0]=4 331 B12R1.1631 CCNCc1c(cccc1Cl)F CSC000186927 [0,2,0,0,0,0|2,0,0]=4 332 B12R1.1631 CCNCc1c(cccc1F)F CSC000201297 [0,2,0,0,0,0|2,0,0]=4 333 B12R1.1631 CCSCc1c(cccc1Cl)F CSC000044550 [0,2,0,0,0,0|2,0,0]=4 334 B12R1.1631 Cc1cccc(c1OCCO)C CSC000748048 [0,2,0,0,0,0|2,0,0]=4 335 B12R1.1631 OCCOc1c(cccc1Cl)Cl CSC011235770 [0,2,0,0,0,0|2,0,0]=4 336 B12R1.1631 OCCSc1c(cccc1Cl)Cl CSC000021466 [0,2,0,0,0,0|2,0,0]=4 337 B12R1.28 CCCCNc1cccc(c1)C CSC000219676 [0,2,0,0,0,0|1,0,0]=3 338 B12R1.28 CCCCOc1cccc(c1)Br CSC011212284 [0,2,0,0,0,0|1,0,0]=3 339 B12R1.28 CCCNCc1cccc(c1)Br CSC000187640 [0,2,0,0,0,0|1,0,0]=3 340 B12R1.28 CCCNCc1cccc(c1)C CSC000196480 [0,2,0,0,0,0|1,0,0]=3 341 B12R1.28 CCCNCc1cccc(c1)Cl CSC000196467 [0,2,0,0,0,0|1,0,0]=3 342 B12R1.28 CCCNCc1cccc(c1)F CSC000196477 [0,2,0,0,0,0|1,0,0]=3 343 B12R1.28 CNCCNc1cncc(c1)Br CSC014501565 [0,2,0,0,0,0|2,0,0]=4 344 B12R1.28 COCCSc1cccc(c1)Br CSC009815756 [0,2,0,0,0,0|2,0,0]=4 345 B12R1.28 COCCSc1cccc(c1)C CSC000055748 [0,2,0,0,0,0|2,0,0]=4 346 B12R1.28 Cc1cccc(c1)CSCCO CSC011212950 [0,2,0,0,0,0|1,0,0]=3 347 B12R1.28 Cc1cccc(c1)SCCCO CSC011432191 [0,2,0,0,0,0|1,0,0]=3 348 B12R1.28 OCCCSc1cccc(c1)Br CSC011756144 [0,2,0,0,0,0|1,0,0]=3 349 B12R1.28 OCCCSc1cccc(c1)Cl CSC011721771 [0,2,0,0,0,0|1,0,0]=3 350 B12R1.28 OCCNCc1cccc(c1)Br CSC000187539 [0,2,0,0,0,0|1,0,0]=3 351 B12R1.28 OCCSCc1cccc(c1)Cl CSC011212903 [0,2,0,0,0,0|1,0,0]=3 352 B12R1.28 OCCSCc1cccc(c1)F CSC011212928 [0,2,0,0,0,0|1,0,0]=3 353 B12R1.50 Cc1cccc(c1)NC(=O)CN CSC000168384 [0,2,0,0,0,0|1,0,1]=4 354 B12R1.50 NCC(=O)Nc1cccc(c1)Br CSC000168392 [0,2,0,0,0,0|1,0,1]=4 355 B12R1.50 NCC(=O)Nc1cccc(c1)Cl CSC000168427 [0,2,0,0,0,0|1,0,1]=4 356 B12R1.50 NCC(=O)Nc1cccc(c1)F CSC000168492 [0,2,0,0,0,0|1,0,1]=4 357 B12R1.50 NNC(=O)Cc1cccc(c1)Cl CSC011203430 [0,2,0,0,0,0|1,0,1]=4 358 B12R1.50 NNC(=O)Cc1cccc(c1)F CSC000189928 [0,2,0,0,0,0|1,0,1]=4 359 B12R1.100 CCCOc1cc(cc(c1)Br)F CSC012344584 [0,2,0,0,0,0|2,0,0]=4 360 B12R1.100 CCNCc1cc(cc(c1)Cl)Cl CSC011269119 [0,2,0,0,0,0|2,0,0]=4 361 B12R1.100 Cc1cc(cc(c1)OCCO)C CSC011305838 [0,2,0,0,0,0|2,0,0]=4 362 B12R1.226 NC(=O)COc1cccc(c1)Cl CSC000150646 [0,2,0,0,0,0|1,0,1]=4 363 B12R1.226 NC(=O)NCc1cccc(c1)Cl CSC000238944 [0,2,0,0,0,0|1,0,1]=4 364 B12R1.382 CCCOc1cccc(c1)C#N CSC000172522 [0,2,0,0,0,0|2,0,0]=4 365 B12R1.382 CCCOc1cccc(c1)CO CSC011232721 [0,2,0,0,0,0|2,0,0]=4 366 B12R1.382 CCNCc1cccc(c1)C#N CSC000168187 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.382 CCNCc1cccc(c1)OC CSC000201205 [0,2,0,0,0,0|2,0,0]=4 368 B12R1.382 CCSCc1cccc(c1)OC CSC000044552 [0,2,0,0,0,0|2,0,0]=4 369 B12R1.382 COc1cccc(c1)OCCO CSC011305813 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.382 COc1cccc(c1)SCCO CSC011235993 [0,2,0,0,0,0|2,0,0]=4 371 B12R1.8 C=CCCNCc1ccccc1 CSC011934112 [0,2,0,0,0,0|1,0,0]=3 372 B12R1.8 CCCCCNc1ccccc1 CSC000219563 [0,2,0,0,0,0|1,0,0]=3 373 B12R1.8 CCCCCSc1ccccc1 CSC000048317 [0,2,0,0,0,0|1,0,0]=3 374 B12R1.8 CCCCNCc1ccccc1 CSC000196024 [0,2,0,0,0,0|1,0,0]=3 375 B12R1.8 CCCCNCc1ccccn1 CSC000200672 [0,2,0,0,0,0|2,0,0]=4 376 B12R1.8 CCCCNCc1cccnc1 CSC000200674 [0,2,0,0,0,0|2,0,0]=4 377 B12R1.8 CCCCNCc1ccncc1 CSC000200698 [0,2,0,0,0,0|2,0,0]=4 378 B12R1.8 CCOCCSc1ccccn1 CSC000006452 [0,2,0,0,0,0|2,0,0]=4 379 B12R1.8 CCSCCCc1ccccc1 CSC000053059 [0,2,0,0,0,0|1,0,0]=3 380 B12R1.8 COCCNCc1ccncc1 CSC000200151 [0,2,0,0,0,0|2,0,0]=4 381 B12R1.8 N#CCCCSc1ccccc1 CSC000172413 [0,2,0,0,0,0|0,0,1]=3 382 B12R1.8 N#CCCSCc1ccccc1 CSC000172150 [0,2,0,0,0,0|0,0,1]=3 383 B12R1.8 OCCCNCc1ccccn1 CSC000200612 [0,2,0,0,0,0|2,0,0]=4 384 B12R1.27 CC(CO)NCc1ccccc1 CSC000713660 [0,2,0,0,0,0|1,0,0]=3 385 B12R1.27 CCC(=O)NCc1ccccc1 CSC000153145 [0,2,0,0,0,0|1,0,1]=4 386 B12R1.27 CCC(=O)OCc1ccccc1 CSC000000848 [0,2,0,0,0,0|1,0,1]=4 387 B12R1.27 CCC(C)NCc1ccccn1 CSC000199859 [0,2,0,0,0,0|2,0,0]=4 388 B12R1.27 CCC(C)NCc1cccnc1 CSC000187012 [0,2,0,0,0,0|2,0,0]=4 389 B12R1.27 CCC(C)NCc1ccncc1 CSC000180841 [0,2,0,0,0,0|2,0,0]=4 390 B12R1.27 CCC(C)SCc1ccccc1 CSC000000404 [0,2,0,0,0,0|1,0,0]=3 391 B12R1.27 CCC(N)CNc1ccccn1 CSC011915201 [0,2,0,0,0,0|2,0,0]=4 392 B12R1.27 CNC(=O)CCc1ccccc1 CSC000159837 [0,2,0,0,0,0|0,0,1]=3 393 B12R1.27 CNC(=O)COc1ccccc1 CSC000150564 [0,2,0,0,0,0|1,0,1]=4 394 B12R1.27 CNC(=O)CSc1ccccc1 CSC000150703 [0,2,0,0,0,0|1,0,1]=4 395 B12R1.27 CNC(=O)NCc1ccccc1 CSC000222791 [0,2,0,0,0,0|1,0,1]=4 396 B12R1.27 NNC(=O)CCc1ccccc1 CSC000189782 [0,2,0,0,0,0|0,0,1]=3 397 B12R1.27 NNC(=O)COc1ccccc1 CSC000186219 [0,2,0,0,0,0|1,0,1]=4 398 B12R1.27 NNC(=O)CSc1ccccc1 CSC000189974 [0,2,0,0,0,0|1,0,1]=4 399 B12R1.27 OCC(=O)NCc1ccccc1 CSC000246335 [0,2,0,0,0,0|1,0,1]=4 400 B12R1.27 OCC(O)CSc1ccccc1 CSC000208506 [0,2,0,0,0,0|1,0,0]=3 401 B12R1.32 CCCC(=O)Oc1ccccc1 CSC000001941 [0,2,0,0,0,0|1,0,1]=4 402 B12R1.32 CN(CC=C)Cc1ccccc1 CSC000018679 [0,2,0,0,0,0|1,0,1]=4 403 B12R1.32 CN(CCN)Cc1ccccn1 CSC011293285 [0,2,0,0,0,0|1,0,0]=3 404 B12R1.32 CN(CCN)Cc1cccnc1 CSC011293284 [0,2,0,0,0,0|1,0,0]=3 405 B12R1.32 CN(CCN)Cc1cnccn1 CSC011729100 [0,2,0,0,0,0|2,0,0]=4 406 B12R1.32 CN(CCO)Cc1ccccn1 CSC011317074 [0,2,0,0,0,0|2,0,0]=4 407 B12R1.32 CN(CCO)Cc1cccnc1 CSC011316762 [0,2,0,0,0,0|2,0,0]=4 408 B12R1.32 CN(CCO)Cc1ccncc1 CSC000224485 [0,2,0,0,0,0|2,0,0]=4 409 B12R1.32 CNCC(=O)Nc1ccccc1 CSC000168086 [0,2,0,0,0,0|1,0,1]=4 410 B12R1.32 NCCC(=O)Nc1ccccc1 CSC011195676 [0,2,0,0,0,0|0,0,1]=3 411 B12R1.252 CC(=C)CNCc1ccccc1 CSC000224140 [0,2,0,0,0,0|1,0,1]=4 412 B12R1.252 CC(=O)CCSc1ccccc1 CSC000208507 [0,2,0,0,0,0|1,0,1]=4 413 B12R1.252 CC(=O)CSCc1ccccc1 CSC000172147 [0,2,0,0,0,0|1,0,1]=4 414 B12R1.252 CC(=O)NCCc1ccccc1 CSC000153396 [0,2,0,0,0,0|1,0,1]=4 415 B12R1.252 CC(=O)OCCc1ccccc1 CSC000024547 [0,2,0,0,0,0|1,0,1]=4 416 B12R1.252 CC(C)CCNc1ccccc1 CSC000219564 [0,2,0,0,0,0|1,0,0]=3 417 B12R1.252 CC(C)CNCc1ccccn1 CSC000200742 [0,2,0,0,0,0|2,0,0]=4 418 B12R1.252 CC(C)CNCc1cccnc1 CSC000180878 [0,2,0,0,0,0|2,0,0]=4 419 B12R1.252 CC(C)CNCc1ccncc1 CSC000187584 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.252 CC(C)NCCc1ccccc1 CSC000200190 [0,2,0,0,0,0|1,0,0]=3 421 B12R1.252 CC(O)CNCc1cccnc1 CSC000180864 [0,2,0,0,0,0|2,0,0]=4 422 B12R1.252 CC(O)CNCc1ccncc1 CSC000186853 [0,2,0,0,0,0|2,0,0]=4 423 B12R1.252 NC(=O)CCCc1ccccc1 CSC011273634 [0,2,0,0,0,0|0,0,0]=2 424 B12R1.252 NC(=O)CSCc1ccccc1 CSC000149389 [0,2,0,0,0,0|0,0,1]=3 425 B12R1.252 NC(=O)NCCc1ccccc1 CSC000238938 [0,2,0,0,0,0|0,0,1]=3 426 B12R1.43 CN(Cc1ccccc1)C(=O)N CSC000238888 [0,2,0,0,0,0|1,0,1]=4 427 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)N CSC011423145 [0,2,0,0,0,0|0,0,1]=3 428 B12R1.118 CCN(CC)Cc1ccccc1 CSC000184721 [0,2,0,0,0,0|2,0,0]=4 429 B12R1.194 CCS(=O)(=O)Cc1ccccc1 CSC000047422 [0,2,0,0,0,0|2,0,0]=4 430 B12R1.891 CC(C)(N)CNc1ccccn1 CSC012186473 [0,2,0,0,0,0|2,0,0]=4 431 B12R1.891 FC(F)(F)CSc1ccccc1 CSC000044406 [0,2,0,0,0,0|2,0,0]=4 432 B12R2.32 CCN1Cc2ccccc2C1 CSC016200629 [0,1,0,1,0,0|2,0,0]=4 433 B12R2.2057 C(NC1CC1)c2ccccc2 CSC000196367 [0,1,0,1,0,0|1,0,0]=3 434 B12R2.2057 C(Nc1ccccc1)C2CC2 CSC011316272 [0,1,0,1,0,0|1,0,0]=3 435 B12R2.2058 C1CC(C1)Sc2ccccc2 CSC000092208 [0,1,0,1,0,0|1,0,0]=3 436 B8R1.8 CCSc1cccs1 CSC009829625 [1,0,0,0,1,0|2,0,0]=4