0 B11R1.24 CCCC[n+]1cccc(c1)C H26983 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.24 CCCC[n+]1cccc(c1)C H27496 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.24 CCNCc1cccc(c1)F H56434 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.24 Cc1cccc(c1)CN=C=S H54893 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.24 Cc1cccc(c1)OCCO L04984 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.24 c1cc(cc(c1)Cl)OCC#N A15730 [0,0,0,0,0,0|3,1,0]=4 6 B11R1.24 c1cc(cc(c1)F)OCCN H51681 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.10 CCCc1cccc(c1)O B21266 [1,0,0,0,0,0|1,0,0]=2 8 B10R1.10 CCOc1cccc(c1)Br B21418 [1,0,0,0,0,0|1,1,0]=3 9 B10R1.10 CCOc1cccc(c1)O B24266 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.10 CCOc1cccc(n1)Cl B24984 [1,0,0,0,0,0|2,1,0]=4 11 B10R1.10 CNCc1cccc(c1)Br H54294 [1,0,0,0,0,0|0,1,0]=2 12 B10R1.10 CNCc1cccc(c1)Cl H54986 [1,0,0,0,0,0|0,1,0]=2 13 B10R1.10 CNCc1cccc(c1)F H56177 [1,0,0,0,0,0|0,0,0]=1 14 B10R1.10 Cc1cccc(c1)CC#N A10558 [1,0,0,0,0,0|1,0,2]=4 15 B10R1.10 Cc1cccc(c1)CNC H63231 [1,0,0,0,0,0|1,0,0]=2 16 B10R1.10 c1cc(cc(c1)Br)CC#N B20189 [1,0,0,0,0,0|0,1,2]=4 17 B10R1.10 c1cc(cc(c1)Cl)CC#N A15673 [1,0,0,0,0,0|0,1,2]=4 18 B10R1.10 c1cc(cc(c1)F)CC#N A12737 [1,0,0,0,0,0|0,0,2]=3 19 B10R1.10 c1cc(cc(c1)F)CCN H64762 [1,0,0,0,0,0|0,0,0]=1 20 B10R1.10 c1cc(cc(c1)F)N=C=O L01496 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.10 c1cc(cc(c1)F)N=C=S B25001 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.10 c1cc(cc(c1)I)CC#N L15118 [1,0,0,0,0,0|0,1,2]=4 23 B10R1.17 C#CCCc1ccccc1 L12946 [1,0,0,0,0,0|1,0,1]=3 24 B10R1.17 C#CCOc1ccccc1 43923 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.17 C#CCOc1ccccc1 A18272 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.17 C=CCNc1ccccc1 H55821 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.17 C=CCOc1ccccc1 L03359 [1,0,0,0,0,0|2,0,1]=4 28 B10R1.17 C=CCSc1ccccc1 L04771 [1,0,0,0,0,0|2,0,1]=4 29 B10R1.17 CCC#Cc1ccccc1 A11332 [1,0,0,0,0,0|1,0,2]=4 30 B10R1.17 CCCC[n+]1ccccc1 19740 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.17 CCCC[n+]1ccccc1 H26995 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.17 CCCCc1ccccc1 A10910 [1,0,0,0,0,0|1,0,0]=2 33 B10R1.17 CCNCc1ccccc1 L05651 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.17 CCNCc1cccnc1 H51120 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.17 CCNCc1ccncc1 L13714 [1,0,0,0,0,0|3,0,0]=4 36 B10R1.17 CNCCc1ccccn1 H50190 [1,0,0,0,0,0|1,0,0]=2 37 B10R1.17 c1ccc(cc1)CCC#N L06483 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.17 c1ccc(cc1)CCC=O A10367 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.17 c1ccc(cc1)CCCBr A14050 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.17 c1ccc(cc1)CCCCl B20445 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.17 c1ccc(cc1)CCCI H53420 [1,0,0,0,0,0|2,0,0]=3 42 B10R1.17 c1ccc(cc1)CCCN L03023 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.17 c1ccc(cc1)CCCO A13022 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.17 c1ccc(cc1)CCC[Zn+] H58569 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.17 c1ccc(cc1)CN=C=O L02633 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.17 c1ccc(cc1)CN=C=S A15008 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.17 c1ccc(cc1)CN=[N+]=[N-] 32635 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.17 c1ccc(cc1)CNC=O B23722 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.17 c1ccc(cc1)COC=O L13405 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.17 c1ccc(cc1)COCCl H60207 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.17 c1ccc(cc1)CSC#N B23902 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.17 c1ccc(cc1)NCCN L03786 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.17 c1ccc(cc1)NCCO B22131 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.17 c1ccc(cc1)OCC#N A11981 [1,0,0,0,0,0|3,0,0]=4 55 B10R1.17 c1ccc(cc1)OCCBr B21087 [1,0,0,0,0,0|3,0,0]=4 56 B10R1.17 c1ccc(cc1)OCCCl L11345 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.17 c1ccc(cc1)OCCN A12225 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.17 c1ccc(cc1)OCCO A10786 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.17 c1ccc(cc1)SCC#N A12869 [1,0,0,0,0,0|3,0,0]=4 60 B10R1.17 c1ccc(cc1)SCCBr L11005 [1,0,0,0,0,0|3,0,0]=4 61 B10R1.17 c1ccc(cc1)SCCCl B23265 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.17 c1ccc(cc1)SCCO A10861 [1,0,0,0,0,0|3,0,0]=4 63 B12R1.17 CCOC(=O)c1cccc(c1)F L07984 [0,1,0,0,0,0|2,0,1]=4 64 B12R1.28 CCCNCc1cccc(c1)F H56794 [0,1,0,0,0,0|1,0,0]=2 65 B12R1.50 c1cc(cc(c1)F)NC(=S)NN L11652 [0,1,0,0,0,0|2,0,1]=4 66 B12R1.226 CC(C)NCc1cccc(c1)F H56383 [0,1,0,0,0,0|2,0,0]=3 67 B12R1.226 Cc1cccc(c1)CCC(=O)O H34395 [0,1,0,0,0,0|3,0,0]=4 68 B12R1.226 c1cc(cc(c1)Br)CCC(=O)O L18080 [0,1,0,0,0,0|2,1,0]=4 69 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O H33266 [0,1,0,0,0,0|2,1,0]=4 70 B12R1.226 c1cc(cc(c1)F)CCC(=O)O H27847 [0,1,0,0,0,0|2,0,0]=3 71 B12R1.226 c1cc(cc(c1)F)NCC(=O)O B22812 [0,1,0,0,0,0|3,0,0]=4 72 B12R1.226 c1cc(cc(c1)N)CCC(=O)O L19329 [0,1,0,0,0,0|3,0,0]=4 73 B12R1.226 c1cc(cc(c1)O)CCC(=O)O L01279 [0,1,0,0,0,0|3,0,0]=4 74 B12R1.374 COCOc1cc(ccc1F)F H32630 [0,1,0,0,0,0|2,0,0]=3 75 B12R1.382 CCCOc1cccc(c1)C=O H33115 [0,1,0,0,0,0|3,0,0]=4 76 B12R2.24 Cc1ccc2c(c1)CCCN2 A15245 [0,0,0,1,0,0|3,0,0]=4 77 B12R2.24 c1cc2c(cc1Br)CCNC2 H63527 [0,0,0,1,0,0|0,1,0]=2 78 B12R2.24 c1cc2c(cc1Br)CNCC2 B25712 [0,0,0,1,0,0|2,1,0]=4 79 B12R2.24 c1cc2c(cc1Br)CNCC2 H63278 [0,0,0,1,0,0|2,1,0]=4 80 B12R2.24 c1cc2c(cc1Cl)CCNC2 H63786 [0,0,0,1,0,0|0,1,0]=2 81 B12R2.24 c1cc2c(cc1Cl)CNCC2 H63456 [0,0,0,1,0,0|2,1,0]=4 82 B12R2.24 c1cc2c(cc1Cl)CNCC2 H63693 [0,0,0,1,0,0|2,1,0]=4 83 B12R2.24 c1cc2c(cc1F)CCCN2 H35364 [0,0,0,1,0,0|2,0,0]=3 84 B12R2.24 c1cc2c(cc1N)CCNC2 H66983 [0,0,0,1,0,0|1,0,0]=2 85 B12R2.24 c1cc2c(cc1O)CCCC2 L10164 [0,0,0,1,0,0|2,0,0]=3 86 B12R2.24 c1cc2c(cc1O)CCNC2 H64512 [0,0,0,1,0,0|1,0,0]=2 87 B12R2.203 c1cc2c(c(c1)O)C(=O)CC2 H66850 [0,0,0,1,0,0|3,0,0]=4 88 B12R2.612 Cc1ccc2c(c1)CCC2=O H66814 [0,0,0,1,0,0|3,0,0]=4 89 B12R2.612 Cn1cnc2c1ccc(c2)N H66465 [0,0,0,1,0,0|2,0,1]=4 90 B12R2.612 c1cc2c(cc1Br)CCC2=O B25707 [0,0,0,1,0,0|2,1,0]=4 91 B12R2.612 c1cc2c(cc1Cl)CCC2=O A18308 [0,0,0,1,0,0|2,1,0]=4 92 B12R2.612 c1cc2c(cc1F)CCC2=O L10949 [0,0,0,1,0,0|2,0,0]=3 93 B12R2.612 c1cc2c(cc1N)CCC2=O H66425 [0,0,0,1,0,0|3,0,0]=4 94 B12R2.1081 c1cc2c(c(c1)O)CCCC2 L02416 [0,0,0,1,0,0|2,0,0]=3 95 B10R1.16 CCCCc1ccc(s1)C B24943 [0,0,0,0,1,0|3,0,0]=4 96 B9R1.2 C=Cc1cccc(c1)F A12406 [2,0,0,0,0,0|0,0,2]=4 97 B9R1.2 CC[n+]1cccc(c1)O H55169 [2,0,0,0,0,0|2,0,0]=4 98 B9R1.2 CCc1cccc(c1)Br A12258 [2,0,0,0,0,0|0,1,0]=3 99 B9R1.2 CCc1cccc(c1)C L18788 [2,0,0,0,0,0|1,0,0]=3 100 B9R1.2 CCc1cccc(c1)O B23470 [2,0,0,0,0,0|1,0,0]=3 101 B9R1.2 CCc1cccc(n1)N A19146 [2,0,0,0,0,0|2,0,0]=4 102 B9R1.2 CCc1ccnc(c1)N A18754 [2,0,0,0,0,0|2,0,0]=4 103 B9R1.2 CNc1cccc(c1)Br H55464 [2,0,0,0,0,0|0,1,0]=3 104 B9R1.2 CNc1cccc(c1)Cl A12418 [2,0,0,0,0,0|0,1,0]=3 105 B9R1.2 CNc1cccc(c1)F B22565 [2,0,0,0,0,0|0,0,0]=2 106 B9R1.2 COc1cccc(c1)Br A15625 [2,0,0,0,0,0|1,1,0]=4 107 B9R1.2 COc1cccc(c1)Cl A17327 [2,0,0,0,0,0|1,1,0]=4 108 B9R1.2 COc1cccc(c1)F A10931 [2,0,0,0,0,0|1,0,0]=3 109 B9R1.2 COc1cccc(c1)I A14208 [2,0,0,0,0,0|1,1,0]=4 110 B9R1.2 COc1cccc(c1)N A10815 [2,0,0,0,0,0|2,0,0]=4 111 B9R1.2 COc1cccc(c1)O A12826 [2,0,0,0,0,0|2,0,0]=4 112 B9R1.2 COc1cccc(c1)S A10648 [2,0,0,0,0,0|2,0,0]=4 113 B9R1.2 COc1cccc(c1)[Mg+] H54780 [2,0,0,0,0,0|2,0,0]=4 114 B9R1.2 COc1cccc(c1)[Zn+] H58982 [2,0,0,0,0,0|2,0,0]=4 115 B9R1.2 COc1cccc(n1)F H32994 [2,0,0,0,0,0|2,0,0]=4 116 B9R1.2 CSc1cccc(c1)Br B25406 [2,0,0,0,0,0|1,1,0]=4 117 B9R1.2 CSc1cccc(c1)Cl L11346 [2,0,0,0,0,0|1,1,0]=4 118 B9R1.2 CSc1cccc(c1)N B23184 [2,0,0,0,0,0|2,0,0]=4 119 B9R1.2 Cc1cccc(c1)CBr B24731 [2,0,0,0,0,0|2,0,0]=4 120 B9R1.2 Cc1cccc(c1)CCl A10784 [2,0,0,0,0,0|2,0,0]=4 121 B9R1.2 Cc1cccc(c1)CN L04922 [2,0,0,0,0,0|1,0,0]=3 122 B9R1.2 Cc1cccc(c1)CO B20875 [2,0,0,0,0,0|2,0,0]=4 123 B9R1.2 Cc1cccc(c1)CS L12043 [2,0,0,0,0,0|2,0,0]=4 124 B9R1.2 Cc1cccc(c1)C[Mg+] H54617 [2,0,0,0,0,0|2,0,0]=4 125 B9R1.2 Cc1cccc(c1)NN A13667 [2,0,0,0,0,0|2,0,0]=4 126 B9R1.2 Cc1cccc(c1)NN L11958 [2,0,0,0,0,0|2,0,0]=4 127 B9R1.2 Cc1cccc(c1)OC B21455 [2,0,0,0,0,0|2,0,0]=4 128 B9R1.2 c1cc(cc(c1)Br)CBr A15075 [2,0,0,0,0,0|1,1,0]=4 129 B9R1.2 c1cc(cc(c1)Br)CCl L12458 [2,0,0,0,0,0|1,1,0]=4 130 B9R1.2 c1cc(cc(c1)Br)CN A16132 [2,0,0,0,0,0|0,1,0]=3 131 B9R1.2 c1cc(cc(c1)Br)CN B24963 [2,0,0,0,0,0|0,1,0]=3 132 B9R1.2 c1cc(cc(c1)Br)CO A10929 [2,0,0,0,0,0|1,1,0]=4 133 B9R1.2 c1cc(cc(c1)Br)CS H26358 [2,0,0,0,0,0|1,1,0]=4 134 B9R1.2 c1cc(cc(c1)Br)C[Mg+] H60329 [2,0,0,0,0,0|1,1,0]=4 135 B9R1.2 c1cc(cc(c1)Br)C[Zn+] H58983 [2,0,0,0,0,0|1,1,0]=4 136 B9R1.2 c1cc(cc(c1)Br)NN B23510 [2,0,0,0,0,0|1,1,0]=4 137 B9R1.2 c1cc(cc(c1)Cl)CBr A15844 [2,0,0,0,0,0|1,1,0]=4 138 B9R1.2 c1cc(cc(c1)Cl)CCl A11041 [2,0,0,0,0,0|1,1,0]=4 139 B9R1.2 c1cc(cc(c1)Cl)CN A14078 [2,0,0,0,0,0|0,1,0]=3 140 B9R1.2 c1cc(cc(c1)Cl)CO A11841 [2,0,0,0,0,0|1,1,0]=4 141 B9R1.2 c1cc(cc(c1)Cl)C[Mg+] H54237 [2,0,0,0,0,0|1,1,0]=4 142 B9R1.2 c1cc(cc(c1)Cl)C[Zn+] H58753 [2,0,0,0,0,0|1,1,0]=4 143 B9R1.2 c1cc(cc(c1)Cl)NN A14770 [2,0,0,0,0,0|1,1,0]=4 144 B9R1.2 c1cc(cc(c1)F)C#N B23426 [2,0,0,0,0,0|0,0,2]=4 145 B9R1.2 c1cc(cc(c1)F)C=O A11396 [2,0,0,0,0,0|1,0,1]=4 146 B9R1.2 c1cc(cc(c1)F)CBr A15446 [2,0,0,0,0,0|1,0,0]=3 147 B9R1.2 c1cc(cc(c1)F)CCl A12665 [2,0,0,0,0,0|1,0,0]=3 148 B9R1.2 c1cc(cc(c1)F)CN B23527 [2,0,0,0,0,0|0,0,0]=2 149 B9R1.2 c1cc(cc(c1)F)CO A12509 [2,0,0,0,0,0|1,0,0]=3 150 B9R1.2 c1cc(cc(c1)F)C[Mg+] H54485 [2,0,0,0,0,0|1,0,0]=3 151 B9R1.2 c1cc(cc(c1)F)C[Zn+] H58707 [2,0,0,0,0,0|1,0,0]=3 152 B9R1.2 c1cc(cc(c1)F)NN L07418 [2,0,0,0,0,0|1,0,0]=3 153 B9R1.2 c1cc(cc(c1)I)CBr A11140 [2,0,0,0,0,0|1,1,0]=4 154 B9R1.2 c1cc(cc(c1)I)CN L05622 [2,0,0,0,0,0|0,1,0]=3 155 B9R1.2 c1cc(cc(c1)I)CN L17801 [2,0,0,0,0,0|0,1,0]=3 156 B9R1.2 c1cc(cc(c1)I)CO L05309 [2,0,0,0,0,0|1,1,0]=4 157 B9R1.2 c1cc(cc(c1)N)CO L07847 [2,0,0,0,0,0|2,0,0]=4 158 B9R1.2 c1cc(cc(c1)O)CN H35708 [2,0,0,0,0,0|1,0,0]=3 159 B9R1.2 c1cc(cc(c1)O)CO A15981 [2,0,0,0,0,0|2,0,0]=4 160 B9R1.8 C#CCc1ccccc1 H53500 [2,0,0,0,0,0|0,0,2]=4 161 B9R1.8 C=CCc1ccccc1 A12965 [2,0,0,0,0,0|0,0,2]=4 162 B9R1.8 CC#Cc1ccccc1 A14272 [2,0,0,0,0,0|0,0,2]=4 163 B9R1.8 CCCc1ccccc1 B21468 [2,0,0,0,0,0|0,0,0]=2 164 B9R1.8 CCNc1ccccc1 A15060 [2,0,0,0,0,0|1,0,0]=3 165 B9R1.8 CCOc1ccccc1 A15501 [2,0,0,0,0,0|1,0,0]=3 166 B9R1.8 CCOc1ccccn1 L05649 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.8 CCSc1ccccc1 A13987 [2,0,0,0,0,0|1,0,0]=3 168 B9R1.8 CNCc1ccccc1 A13746 [2,0,0,0,0,0|0,0,0]=2 169 B9R1.8 CNCc1cccnc1 H50262 [2,0,0,0,0,0|1,0,0]=3 170 B9R1.8 COCc1ccccc1 B23490 [2,0,0,0,0,0|1,0,0]=3 171 B9R1.8 C\N=C\c1ccccc1 B25161 [2,0,0,0,0,0|0,0,2]=4 172 B9R1.8 c1cc(cnc1)CCN L16311 [2,0,0,0,0,0|1,0,0]=3 173 B9R1.8 c1ccc(cc1)CC#N A10694 [2,0,0,0,0,0|0,0,2]=4 174 B9R1.8 c1ccc(cc1)CC=O A14263 [2,0,0,0,0,0|1,0,1]=4 175 B9R1.8 c1ccc(cc1)CCBr A12528 [2,0,0,0,0,0|1,0,0]=3 176 B9R1.8 c1ccc(cc1)CCCl L04891 [2,0,0,0,0,0|1,0,0]=3 177 B9R1.8 c1ccc(cc1)CCN A13402 [2,0,0,0,0,0|0,0,0]=2 178 B9R1.8 c1ccc(cc1)CCO A15241 [2,0,0,0,0,0|1,0,0]=3 179 B9R1.8 c1ccc(cc1)CC[Zn+] H58154 [2,0,0,0,0,0|1,0,0]=3 180 B9R1.8 c1ccc(cc1)CNN H54916 [2,0,0,0,0,0|1,0,0]=3 181 B9R1.8 c1ccc(cc1)CON A17393 [2,0,0,0,0,0|1,0,0]=3 182 B9R1.8 c1ccc(cc1)CON L13601 [2,0,0,0,0,0|1,0,0]=3 183 B9R1.8 c1ccnc(c1)CCN L05627 [2,0,0,0,0,0|1,0,0]=3 184 B9R1.8 c1ccnc(c1)CCO B23579 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.8 c1cnccc1CCN H27545 [2,0,0,0,0,0|1,0,0]=3 186 B9R1.8 c1cnccc1CCO L13780 [2,0,0,0,0,0|2,0,0]=4 187 B11R1.13 Cc1c(cccc1F)CC#N H32846 [1,1,0,0,0,0|0,0,2]=4 188 B11R1.13 c1cc(c(c(c1)Cl)F)CCO H31742 [1,1,0,0,0,0|1,1,0]=4 189 B11R1.13 c1cc(c(c(c1)F)F)CC#N A19934 [1,1,0,0,0,0|0,0,2]=4 190 B11R1.13 c1cc(c(c(c1)F)F)CCO H32408 [1,1,0,0,0,0|1,0,0]=3 191 B11R1.23 CCC(=O)c1cccc(c1)Br A16757 [1,1,0,0,0,0|0,1,1]=4 192 B11R1.23 CCC(=O)c1cccc(c1)Cl A12542 [1,1,0,0,0,0|0,1,1]=4 193 B11R1.23 CCC(=O)c1cccc(c1)F L11922 [1,1,0,0,0,0|0,0,1]=3 194 B11R1.23 CCC(c1cccc(c1)F)O H32342 [1,1,0,0,0,0|0,0,0]=2 195 B11R1.23 CNC(=O)c1cccc(c1)Cl H56565 [1,1,0,0,0,0|0,1,1]=4 196 B11R1.23 Cc1cccc(c1)C(=O)NC H56299 [1,1,0,0,0,0|1,0,1]=4 197 B11R1.34 c1c(cc(cc1F)Br)CC#N H62605 [1,1,0,0,0,0|0,0,2]=4 198 B11R1.34 c1c(cc(cc1F)Cl)CC#N H30410 [1,1,0,0,0,0|0,0,2]=4 199 B11R1.34 c1c(cc(cc1F)F)CC#N A19544 [1,1,0,0,0,0|0,0,2]=4 200 B11R1.157 CC(=O)Cc1cccc(c1)F B22061 [1,1,0,0,0,0|0,0,1]=3 201 B11R1.157 CC(=O)Nc1cccc(c1)F B22889 [1,1,0,0,0,0|1,0,1]=4 202 B11R1.157 CC(=O)Oc1cccc(c1)F L13465 [1,1,0,0,0,0|1,0,1]=4 203 B11R1.157 CC(C)Oc1cccc(c1)Br L13802 [1,1,0,0,0,0|1,1,0]=4 204 B11R1.157 Cc1cccc(c1)CC(=S)N H33031 [1,1,0,0,0,0|1,0,1]=4 205 B11R1.157 c1cc(cc(c1)Cl)CC(=S)N H32426 [1,1,0,0,0,0|0,1,1]=4 206 B11R1.157 c1cc(cc(c1)F)CC(=O)O A15635 [1,1,0,0,0,0|1,0,1]=4 207 B11R1.157 c1cc(cc(c1)F)NC(=S)N L09538 [1,1,0,0,0,0|1,0,1]=4 208 B11R1.182 CCNc1cc(ccc1C)O L12768 [1,1,0,0,0,0|2,0,0]=4 209 B11R1.182 CCOc1cc(ccc1Br)N B24827 [1,1,0,0,0,0|2,0,0]=4 210 B11R1.182 CCOc1cc(ccc1O)C L08898 [1,1,0,0,0,0|2,0,0]=4 211 B11R1.182 c1cc(c(cc1F)CC#N)F B20246 [1,1,0,0,0,0|0,0,2]=4 212 B11R1.182 c1cc(c(cc1F)CCO)F H32082 [1,1,0,0,0,0|1,0,0]=3 213 B11R1.189 CCOc1cccc(c1)C#N A13908 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.189 CCOc1cccc(c1)C=O A18940 [1,1,0,0,0,0|2,0,0]=4 215 B11R1.189 CNCc1cccc(c1)C#N H63054 [1,1,0,0,0,0|1,0,0]=3 216 B11R1.189 CNCc1cccc(c1)OC H54970 [1,1,0,0,0,0|1,0,0]=3 217 B11R1.189 COc1cccc(c1)CCN H64494 [1,1,0,0,0,0|1,0,0]=3 218 B11R1.192 CCOc1ccc(c(c1)F)F B25590 [1,1,0,0,0,0|1,0,0]=3 219 B11R1.192 CCOc1ccc(c(c1)F)N H33706 [1,1,0,0,0,0|1,0,0]=3 220 B11R1.192 c1cc(c(cc1CC#N)F)Br H61205 [1,1,0,0,0,0|0,0,2]=4 221 B11R1.192 c1cc(c(cc1CC#N)F)F A17893 [1,1,0,0,0,0|0,0,2]=4 222 B11R1.192 c1cc(c(cc1CCN)O)O A11136 [1,1,0,0,0,0|1,0,0]=3 223 B11R1.192 c1cc(c(cc1CCO)Cl)F H32291 [1,1,0,0,0,0|1,1,0]=4 224 B11R1.192 c1cc(c(cc1CCO)F)F H31710 [1,1,0,0,0,0|1,0,0]=3 225 B11R1.1 CCCC[n+]1ccc(cc1)C H27100 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.1 CCCC[n+]1ccc(cc1)C H27355 [1,1,0,0,0,0|2,0,0]=4 227 B11R1.1 CCCCc1ccc(cc1)Br B23979 [1,1,0,0,0,0|1,0,0]=3 228 B11R1.1 CCCCc1ccc(cc1)Cl B24138 [1,1,0,0,0,0|1,0,0]=3 229 B11R1.1 CCCCc1ccc(cc1)I A14421 [1,1,0,0,0,0|1,0,0]=3 230 B11R1.1 CCCCc1ccc(cc1)N B25234 [1,1,0,0,0,0|1,0,0]=3 231 B11R1.1 CCCCc1ccc(cc1)O A12812 [1,1,0,0,0,0|1,0,0]=3 232 B11R1.1 CCCOc1ccc(cc1)Br A11462 [1,1,0,0,0,0|2,0,0]=4 233 B11R1.1 CCCOc1ccc(cc1)N H55096 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.1 CCCOc1ccc(cc1)O B22266 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.1 CCNCc1ccc(cc1)F H56689 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.1 COCCc1ccc(cc1)O B23548 [1,1,0,0,0,0|1,0,0]=3 237 B11R1.1 c1cc(ccc1CCC#N)O L07934 [1,1,0,0,0,0|2,0,0]=4 238 B11R1.1 c1cc(ccc1CCCO)Br H61118 [1,1,0,0,0,0|2,0,0]=4 239 B11R1.16 C=CCC(c1ccccc1)O H53466 [1,1,0,0,0,0|1,0,1]=4 240 B11R1.16 CCCC(=O)c1ccccc1 A11345 [1,1,0,0,0,0|1,0,1]=4 241 B11R1.16 CCCC(C)c1ccccc1 B20114 [1,1,0,0,0,0|1,0,0]=3 242 B11R1.16 CCC[C@@H](c1ccccc1)N H27048 [1,1,0,0,0,0|1,0,0]=3 243 B11R1.16 CCC[C@H](c1ccccc1)N H27156 [1,1,0,0,0,0|1,0,0]=3 244 B11R1.16 CNCC(c1ccccc1)O L08111 [1,1,0,0,0,0|0,0,0]=2 245 B11R1.16 c1ccc(cc1)[C@@H](CCCl)O H55567 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.16 c1ccc(cc1)[C@H](CCCl)O H54847 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.17 CCNCc1ccccc1F H56127 [1,1,0,0,0,0|2,0,0]=4 248 B11R1.17 c1ccc(c(c1)CCCO)Br H63884 [1,1,0,0,0,0|2,0,0]=4 249 B11R1.28 C#CCCCc1ccccc1 L11608 [1,1,0,0,0,0|1,0,1]=4 250 B11R1.28 C#CCOCc1ccccc1 H53481 [1,1,0,0,0,0|1,0,1]=4 251 B11R1.28 CCCC#Cc1ccccc1 B20857 [1,1,0,0,0,0|1,0,1]=4 252 B11R1.28 CCCCCc1ccccc1 A15734 [1,1,0,0,0,0|1,0,0]=3 253 B11R1.28 CCCCCc1ccccn1 B22125 [1,1,0,0,0,0|2,0,0]=4 254 B11R1.28 CCCCNc1ccccc1 B24180 [1,1,0,0,0,0|1,0,0]=3 255 B11R1.28 CCCCOc1ccccc1 L04703 [1,1,0,0,0,0|1,0,0]=3 256 B11R1.28 CCCCOc1ccccn1 B21651 [1,1,0,0,0,0|2,0,0]=4 257 B11R1.28 CNCCOc1ccccc1 H50258 [1,1,0,0,0,0|0,0,0]=2 258 B11R1.28 COCCSc1ccccc1 L10464 [1,1,0,0,0,0|1,0,0]=3 259 B11R1.28 c1ccc(cc1)CCCC#N L01638 [1,1,0,0,0,0|1,0,1]=4 260 B11R1.28 c1ccc(cc1)CCCCBr B25237 [1,1,0,0,0,0|1,0,0]=3 261 B11R1.28 c1ccc(cc1)CCCCCl A11753 [1,1,0,0,0,0|1,0,0]=3 262 B11R1.28 c1ccc(cc1)CCCCN L02982 [1,1,0,0,0,0|1,0,0]=3 263 B11R1.28 c1ccc(cc1)CCCCO A13433 [1,1,0,0,0,0|1,0,0]=3 264 B11R1.28 c1ccc(cc1)CCN=C=S A15123 [1,1,0,0,0,0|0,0,2]=4 265 B11R1.28 c1ccc(cc1)CNCC#N L18566 [1,1,0,0,0,0|2,0,0]=4 266 B11R1.28 c1ccc(cc1)CNCCN A13262 [1,1,0,0,0,0|2,0,0]=4 267 B11R1.28 c1ccc(cc1)CNCCO A16866 [1,1,0,0,0,0|2,0,0]=4 268 B11R1.28 c1ccc(cc1)COCCBr H56872 [1,1,0,0,0,0|2,0,0]=4 269 B11R1.28 c1ccc(cc1)COCCI H35095 [1,1,0,0,0,0|2,0,0]=4 270 B11R1.28 c1ccc(cc1)CSCCO L12274 [1,1,0,0,0,0|2,0,0]=4 271 B11R1.28 c1ccc(cc1)OCCCBr L12494 [1,1,0,0,0,0|2,0,0]=4 272 B11R1.28 c1ccc(cc1)OCCCN H52398 [1,1,0,0,0,0|2,0,0]=4 273 B11R1.28 c1ccc(cc1)SCCCCl B21345 [1,1,0,0,0,0|2,0,0]=4 274 B11R1.40 CCN(C)Cc1ccccc1 L08520 [1,1,0,0,0,0|2,0,0]=4 275 B11R1.40 COC(=O)Cc1ccccc1 A15537 [1,1,0,0,0,0|1,0,1]=4 276 B11R1.40 c1ccc(cc1)CC(CO)N H63562 [1,1,0,0,0,0|2,0,0]=4 277 B11R1.40 c1ccc(cc1)C[C@@H](CO)N A11586 [1,1,0,0,0,0|2,0,0]=4 278 B11R1.40 c1ccc(cc1)C[C@H](CO)N L09697 [1,1,0,0,0,0|2,0,0]=4 279 B11R1.91 B(CCc1ccccc1)(O)O H52502 [1,1,0,0,0,0|2,0,0]=4 280 B11R1.91 CC(=C)COc1ccccc1 B22369 [1,1,0,0,0,0|2,0,0]=4 281 B11R1.91 CC(=N)SCc1ccccc1 H51844 [1,1,0,0,0,0|2,0,0]=4 282 B11R1.91 CC(=O)CCc1ccccc1 B22777 [1,1,0,0,0,0|1,0,0]=3 283 B11R1.91 CC(=O)OCc1ccccc1 B23472 [1,1,0,0,0,0|2,0,0]=4 284 B11R1.91 CC(C)NCc1ccccc1 B23243 [1,1,0,0,0,0|2,0,0]=4 285 B11R1.91 CC(CCc1ccccc1)N A18804 [1,1,0,0,0,0|1,0,0]=3 286 B11R1.91 CC(CCc1ccccc1)O L05970 [1,1,0,0,0,0|1,0,0]=3 287 B11R1.91 CC(COc1ccccc1)O L04596 [1,1,0,0,0,0|2,0,0]=4 288 B11R1.91 C[C@@H](CCc1ccccc1)O L18886 [1,1,0,0,0,0|1,0,0]=3 289 B11R1.91 C[C@H](CCc1ccccc1)O L18885 [1,1,0,0,0,0|1,0,0]=3 290 B11R1.91 c1ccc(cc1)CCC(=O)Cl A10860 [1,1,0,0,0,0|2,0,0]=4 291 B11R1.91 c1ccc(cc1)CCC(=O)O A14908 [1,1,0,0,0,0|2,0,0]=4 292 B13R1.147 c1cc(cc(c1)F)[C@H](CC(=O)O)N H52089 [0,2,0,0,0,0|2,0,0]=4 293 B13R1.460 CNCC(c1cccc(c1)OC)O H50758 [0,2,0,0,0,0|1,0,0]=3 294 B13R1.466 CNC[C@@H](c1ccc(c(c1)O)O)O L04911 [0,2,0,0,0,0|1,0,0]=3 295 B13R1.16 CCCCOc1cccc(c1F)F H61913 [0,2,0,0,0,0|1,0,0]=3 296 B13R1.150 Cc1c(cccc1F)CCC(=O)O H31554 [0,2,0,0,0,0|2,0,0]=4 297 B13R1.6 CCCCCCc1cccc(c1)Br H26063 [0,2,0,0,0,0|1,1,0]=4 298 B13R1.6 CCCCNCc1cccc(c1)F H56030 [0,2,0,0,0,0|1,0,0]=3 299 B13R1.149 CC(C)CNCc1cccc(c1)F H56526 [0,2,0,0,0,0|1,0,0]=3 300 B13R1.148 c1cc(cc(c1)F)CC(C(=O)O)N L07297 [0,2,0,0,0,0|2,0,0]=4 301 B13R1.148 c1cc(cc(c1)F)C[C@H](C(=O)O)N H63131 [0,2,0,0,0,0|2,0,0]=4 302 B13R1.2874 COC(=O)Cc1cc(cc(c1)Br)F H62561 [0,2,0,0,0,0|1,0,1]=4 303 B13R1.3420 Cc1cc(cc(c1)F)CCC(=O)O H32551 [0,2,0,0,0,0|2,0,0]=4 304 B13R1.3420 c1c(cc(cc1F)F)CCC(=O)O H54004 [0,2,0,0,0,0|2,0,0]=4 305 B13R1.511 Cc1ccc(cc1F)CCC(=O)O H32105 [0,2,0,0,0,0|2,0,0]=4 306 B13R1.511 c1cc(c(cc1CCC(=O)O)F)Cl H34205 [0,2,0,0,0,0|2,0,0]=4 307 B13R1.511 c1cc(c(cc1CCC(=O)O)F)F H26185 [0,2,0,0,0,0|2,0,0]=4 308 B13R1.893 Cc1ccc(cc1CCC(=O)O)F H32947 [0,2,0,0,0,0|2,0,0]=4 309 B11R2.36 c1cc2c(cc1Br)CCN2 L16992 [1,0,0,1,0,0|0,1,0]=3 310 B11R2.36 c1cc2c(cc1F)CCN2 H54158 [1,0,0,1,0,0|0,0,0]=2 311 B11R2.36 c1cc2c(cc1F)cn[nH]2 H26033 [1,0,0,1,0,0|1,0,1]=4 312 B11R2.36 c1cc2c(cc1N)CCC2 L02504 [1,0,0,1,0,0|1,0,0]=3 313 B11R2.36 c1cc2c(cc1N)CCO2 H33344 [1,0,0,1,0,0|2,0,0]=4 314 B11R2.36 c1cc2c(cc1O)CCC2 L01623 [1,0,0,1,0,0|1,0,0]=3 315 B11R2.36 c1cc2c(cc[nH]2)cc1F A15346 [1,0,0,1,0,0|0,0,2]=4 316 B11R2.106 c1cc2cc[nH]c2c(c1)F L17621 [1,0,0,1,0,0|0,0,2]=4 317 B11R2.1 Cn1c2ccccc2nn1 L00297 [1,0,0,1,0,0|2,0,0]=4 318 B11R2.1 Cn1ccc2c1cccc2 A12605 [1,0,0,1,0,0|0,0,2]=4 319 B11R2.1 Cn1cnc2c1cccc2 B25472 [1,0,0,1,0,0|1,0,1]=4 320 B11R2.1 c1ccc2c(c1)CCC2=O A11056 [1,0,0,1,0,0|2,0,0]=4 321 B11R2.1 c1ccc2c(c1)CCC2N A16585 [1,0,0,1,0,0|2,0,0]=4 322 B11R2.1 c1ccc2c(c1)CCC2O B24536 [1,0,0,1,0,0|2,0,0]=4 323 B11R2.1 c1ccc2c(c1)CC[C@@H]2N L19303 [1,0,0,1,0,0|2,0,0]=4 324 B11R2.1 c1ccc2c(c1)CC[C@H]2N L19302 [1,0,0,1,0,0|2,0,0]=4 325 B11R2.20 c1ccc2c(c1)CCC=C2 L11430 [1,0,0,1,0,0|1,0,1]=4 326 B11R2.20 c1ccc2c(c1)CCCC2 A14962 [1,0,0,1,0,0|1,0,0]=3 327 B11R2.20 c1ccc2c(c1)CCCN2 B22750 [1,0,0,1,0,0|2,0,0]=4 328 B11R2.20 c1ccc2c(c1)CCNC2 L08143 [1,0,0,1,0,0|0,0,0]=2 329 B11R2.20 c1ccc2c(c1)CCOC2 A12566 [1,0,0,1,0,0|1,0,0]=3 330 B11R2.238 c1ccc(cc1)SC2CC2 L12321 [1,0,0,1,0,0|2,0,0]=4 331 B13R2.5179 c1cc2c(cc1F)OCCC2=O H31881 [0,1,0,1,0,0|2,0,0]=4 332 B13R2.5331 c1cc(cc(c1)F)CNC2CC2 H56257 [0,1,0,1,0,0|1,0,0]=3 333 B13R2.11642 c1c(cc(c2c1CCC2=O)F)F H54002 [0,1,0,1,0,0|2,0,0]=4 334 B13R2.57 COc1ccc2c(c1)CCNC2 H31910 [0,1,0,1,0,0|1,0,0]=3 335 B9R1.12 CCCCC1=CC=CC1 H27576 [1,0,0,0,1,0|1,0,1]=4 336 B9R1.12 CCCCC1=CCC=C1 A16719 [1,0,0,0,1,0|1,0,1]=4 337 B9R1.12 CCCCc1ccco1 A13376 [1,0,0,0,1,0|2,0,0]=4 338 B9R1.12 CCCCc1cccs1 A12740 [1,0,0,0,1,0|2,0,0]=4 339 B9R1.12 CCCCc1ccsc1 H55795 [1,0,0,0,1,0|2,0,0]=4