0 B5R0.3 C#CC(O)C#C CS-0310690 [0,0,0,0,0,0|2,0,2]=4 1 B5R0.3 C=C(C#N)CO CS-0079973 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.3 C=CC(O)C#N CS-0223428 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.3 C=C[C@H](N)CO CS-0089895 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.3 CC(C#N)CBr CS-0241543 [0,0,0,0,0,0|3,0,1]=4 5 B5R0.3 CC(C#N)CN CS-0253541 [0,0,0,0,0,0|3,0,1]=4 6 B5R0.3 CC(CI)CI CS-0512528 [0,0,0,0,0,0|3,0,0]=3 7 B5R0.3 CC(CN)CCl CS-0038279 [0,0,0,0,0,0|3,0,0]=3 8 B5R0.3 CC(CN)CN CS-0168145 [0,0,0,0,0,0|3,0,0]=3 9 B5R0.3 CC(CO)NN CS-0221979 [0,0,0,0,0,0|3,0,0]=3 10 B5R0.3 CCC(Br)CBr CS-0204830 [0,0,0,0,0,0|3,0,0]=3 11 B5R0.3 CCC(C)NN CS-0210628 [0,0,0,0,0,0|4,0,0]=4 12 B5R0.3 CCC(C)ON CS-0232113 [0,0,0,0,0,0|4,0,0]=4 13 B5R0.3 CCC(O)CBr CS-0197080 [0,0,0,0,0,0|2,0,0]=2 14 B5R0.3 CCC(S)CC CS-0253155 [0,0,0,0,0,0|2,1,0]=3 15 B5R0.3 CNC(C)CO CS-0522344 [0,0,0,0,0,0|3,0,0]=3 16 B5R0.3 CN[C@H](C)CO CS-0697577 [0,0,0,0,0,0|3,0,0]=3 17 B5R0.3 C[C@@H](CN)CO CS-0231467 [0,0,0,0,0,0|2,0,0]=2 18 B5R0.3 N#CC(Br)CBr CS-0204302 [0,0,0,0,0,0|3,0,1]=4 19 B5R0.3 N#CC(N)CO CS-0528524 [0,0,0,0,0,0|2,0,1]=3 20 B5R0.3 NCC(=O)CN CS-0181766 [0,0,0,0,0,0|2,0,2]=4 21 B5R0.3 NCC(Br)CBr CS-0259791 [0,0,0,0,0,0|3,0,0]=3 22 B5R0.3 NCC(F)CO CS-0523308 [0,0,0,0,0,0|2,0,0]=2 23 B5R0.3 NCC(O)CF CS-0071970 [0,0,0,0,0,0|2,0,0]=2 24 B5R0.3 NC[C@H](F)CO CS-0517422 [0,0,0,0,0,0|2,0,0]=2 25 B5R0.3 OC(CF)CCl CS-0121193 [0,0,0,0,0,0|2,0,0]=2 26 B5R0.3 OCC(O)CO CS-0188495 [0,0,0,0,0,0|0,0,0]=0 27 B5R0.3 OC[C@@H](O)CF CS-0022575 [0,0,0,0,0,0|1,0,0]=1 28 B4R0.1 C=CB(O)O CS-0176836 [1,0,0,0,0,0|2,0,1]=4 29 B4R0.1 C=C[C@H](C)N CS-0196819 [1,0,0,0,0,0|2,0,1]=4 30 B4R0.1 CC(O)CN CS-0466165 [1,0,0,0,0,0|1,0,0]=2 31 B4R0.1 CC(S)CN CS-0231499 [1,0,0,0,0,0|1,1,0]=3 32 B4R0.1 CCS(C)=O CS-0772381 [1,0,0,0,0,0|2,0,1]=4 33 B4R0.1 C[C@@H](N)CN CS-0341700 [1,0,0,0,0,0|2,0,0]=3 34 B4R0.1 NCC(=O)O CS-0468679 [1,0,0,0,0,0|1,0,2]=4 35 B4R0.1 O=C(O)CS CS-0620475 [1,0,0,0,0,0|0,1,2]=4 36 B4R0.1 O=S([O-])CO CS-0875772 [1,0,0,0,0,0|1,0,2]=4 37 B4R0.2 CCCNC CS-0312281 [1,0,0,0,0,0|3,0,0]=4 38 B4R0.2 CCCNN CS-0670498 [1,0,0,0,0,0|3,0,0]=4 39 B4R0.2 CCNCC CS-0214083 [1,0,0,0,0,0|3,0,0]=4 40 B4R0.2 COCCN CS-0468680 [1,0,0,0,0,0|3,0,0]=4 41 B4R0.2 NCCCF CS-0088913 [1,0,0,0,0,0|2,0,0]=3 42 B4R0.2 NOCCF CS-0231371 [1,0,0,0,0,0|3,0,0]=4 43 B4R0.2 OC\C=C\Cl CS-0224631 [1,0,0,0,0,0|1,0,2]=4 44 B6R0.1 C#CCC(O)CN CS-0244963 [0,1,0,0,0,0|2,0,0]=3 45 B6R0.1 C=CC(N)COC CS-0234293 [0,1,0,0,0,0|2,0,1]=4 46 B6R0.1 C=CCC(N)CC CS-0538746 [0,1,0,0,0,0|3,0,0]=4 47 B6R0.1 C=CCC(O)CC CS-0238036 [0,1,0,0,0,0|2,0,0]=3 48 B6R0.1 C=CC[C@H](N)CO CS-0325766 [0,1,0,0,0,0|2,0,0]=3 49 B6R0.1 CCC(Br)COC CS-0231861 [0,1,0,0,0,0|2,0,0]=3 50 B6R0.1 CCC(C)CCCl CS-0257596 [0,1,0,0,0,0|3,0,0]=4 51 B6R0.1 CCC(N)CCO CS-0757410 [0,1,0,0,0,0|2,0,0]=3 52 B6R0.1 CCC(O)CCN CS-0252993 [0,1,0,0,0,0|2,0,0]=3 53 B6R0.1 CCC(O)CCO CS-0224666 [0,1,0,0,0,0|1,0,0]=2 54 B6R0.1 CCC(O)CNN CS-0739636 [0,1,0,0,0,0|2,0,0]=3 55 B6R0.1 CCCC(=O)CO CS-0239089 [0,1,0,0,0,0|1,0,2]=4 56 B6R0.1 CCCC(Br)CC CS-0320329 [0,1,0,0,0,0|3,0,0]=4 57 B6R0.1 CCCC(C)CBr CS-0296949 [0,1,0,0,0,0|3,0,0]=4 58 B6R0.1 CCCC(C)CCl CS-0621759 [0,1,0,0,0,0|3,0,0]=4 59 B6R0.1 CCCC(N)CC CS-0714492 [0,1,0,0,0,0|3,0,0]=4 60 B6R0.1 CCNC(C)CC CS-0441021 [0,1,0,0,0,0|3,0,0]=4 61 B6R0.1 CCOC(C)CN CS-0148791 [0,1,0,0,0,0|3,0,0]=4 62 B6R0.1 CNCC(C)CN CS-0443116 [0,1,0,0,0,0|3,0,0]=4 63 B6R0.1 CNCC(C)CO CS-0263897 [0,1,0,0,0,0|2,0,0]=3 64 B6R0.1 CN[C@@H](C)CCO CS-0802797 [0,1,0,0,0,0|3,0,0]=4 65 B6R0.1 CN[C@H](C)CCO CS-0858605 [0,1,0,0,0,0|3,0,0]=4 66 B6R0.1 COCC(C)NN CS-0232402 [0,1,0,0,0,0|3,0,0]=4 67 B6R0.1 COCC(N)CO CS-0091346 [0,1,0,0,0,0|1,0,0]=2 68 B6R0.1 COCC(O)CCl CS-0303388 [0,1,0,0,0,0|1,0,0]=2 69 B6R0.1 COCC(O)CF CS-0262658 [0,1,0,0,0,0|1,0,0]=2 70 B6R0.1 COC[C@@H](O)CN CS-0509864 [0,1,0,0,0,0|1,0,0]=2 71 B6R0.1 CSC(C)CCO CS-0242025 [0,1,0,0,0,0|3,0,0]=4 72 B6R0.1 CSCC(C)CN CS-0260731 [0,1,0,0,0,0|2,1,0]=4 73 B6R0.1 CSCC(C)CO CS-0242026 [0,1,0,0,0,0|1,1,0]=3 74 B6R0.1 C[C@H](CO)CCO CS-0197580 [0,1,0,0,0,0|1,0,0]=2 75 B6R0.1 NCC(N)CCO CS-0262956 [0,1,0,0,0,0|2,0,0]=3 76 B6R0.1 NCCC(O)CO CS-0212807 [0,1,0,0,0,0|1,0,0]=2 77 B6R0.1 N[C@@H](CO)CCO CS-0091341 [0,1,0,0,0,0|1,0,0]=2 78 B6R0.1 N[C@H](CS)CCS CS-0146136 [0,1,0,0,0,0|1,2,0]=4 79 B6R0.1 O=C(CO)CCO CS-0734935 [0,1,0,0,0,0|0,0,2]=3 80 B6R0.1 OCC[C@H](O)CCl CS-0127558 [0,1,0,0,0,0|1,0,0]=2 81 B6R0.3 C#CC(O)C(=O)O CS-0254224 [0,1,0,0,0,0|1,0,2]=4 82 B6R0.3 C=CC(O)C(=O)O CS-0237282 [0,1,0,0,0,0|1,0,2]=4 83 B6R0.3 C=C[C@@H](C)[C@H](C)O CS-0567857 [0,1,0,0,0,0|2,0,1]=4 84 B6R0.3 CC(=O)C(C)CO CS-0132490 [0,1,0,0,0,0|1,0,2]=4 85 B6R0.3 CC(C)C(C)CO CS-0752023 [0,1,0,0,0,0|2,0,0]=3 86 B6R0.3 CC(C)C(O)CO CS-0965839 [0,1,0,0,0,0|1,0,0]=2 87 B6R0.3 CC(CN)C(=O)O CS-0210672 [0,1,0,0,0,0|2,0,1]=4 88 B6R0.3 CC(N)C(C)CO CS-0262667 [0,1,0,0,0,0|2,0,0]=3 89 B6R0.3 CC(O)C(C)C#N CS-0238999 [0,1,0,0,0,0|2,0,1]=4 90 B6R0.3 CC(O)C(C)CN CS-0257858 [0,1,0,0,0,0|2,0,0]=3 91 B6R0.3 CC(O)C(C)CO CS-0258428 [0,1,0,0,0,0|1,0,0]=2 92 B6R0.3 CC(O)C(N)CO CS-0091337 [0,1,0,0,0,0|1,0,0]=2 93 B6R0.3 CC(O)C(O)CO CS-0332229 [0,1,0,0,0,0|0,0,0]=1 94 B6R0.3 CC(O)\C(N)=N\O CS-0734185 [0,1,0,0,0,0|2,0,1]=4 95 B6R0.3 CCC(=O)C(C)O CS-0242252 [0,1,0,0,0,0|1,0,2]=4 96 B6R0.3 CCC(C)C(=O)O CS-0964752 [0,1,0,0,0,0|2,0,1]=4 97 B6R0.3 CCC(C)C(C)Cl CS-0262916 [0,1,0,0,0,0|3,0,0]=4 98 B6R0.3 CCC(C)C(C)O CS-0234266 [0,1,0,0,0,0|2,0,0]=3 99 B6R0.3 CC[C@@H](N)[C@@H](C)O CS-0538779 [0,1,0,0,0,0|2,0,0]=3 100 B6R0.3 CC[C@@H](N)[C@H](C)O CS-0183883 [0,1,0,0,0,0|2,0,0]=3 101 B6R0.3 CC[C@@H](N)[C@H](C)O CS-0183884 [0,1,0,0,0,0|2,0,0]=3 102 B6R0.3 CC[C@H](Cl)C(=O)O CS-0198776 [0,1,0,0,0,0|2,0,1]=4 103 B6R0.3 CC[C@H](N)C(C)C CS-0215629 [0,1,0,0,0,0|3,0,0]=4 104 B6R0.3 CC[C@H](N)[C@@H](C)O CS-0183872 [0,1,0,0,0,0|2,0,0]=3 105 B6R0.3 C[C@@H](CO)C(=O)O CS-0372687 [0,1,0,0,0,0|1,0,1]=3 106 B6R0.3 C[C@@H](O)[C@H](N)CO CS-0240190 [0,1,0,0,0,0|1,0,0]=2 107 B6R0.3 C[C@H](O)[C@H](N)CO CS-0356224 [0,1,0,0,0,0|1,0,0]=2 108 B6R0.3 NC(=O)C(N)CO CS-0161462 [0,1,0,0,0,0|1,0,2]=4 109 B6R0.3 NC(CCl)C(=O)O CS-0539404 [0,1,0,0,0,0|2,0,1]=4 110 B6R0.3 NC(CF)C(=O)O CS-0181058 [0,1,0,0,0,0|2,0,1]=4 111 B6R0.3 NCC(F)C(=O)O CS-0456683 [0,1,0,0,0,0|2,0,1]=4 112 B6R0.3 NCC(N)C(=O)O CS-0666493 [0,1,0,0,0,0|2,0,1]=4 113 B6R0.3 NCC(O)C(F)F CS-0145740 [0,1,0,0,0,0|2,0,0]=3 114 B6R0.3 NCC(O)C(F)F CS-0145741 [0,1,0,0,0,0|2,0,0]=3 115 B6R0.3 NCC(O)C(N)=O CS-0521710 [0,1,0,0,0,0|1,0,2]=4 116 B6R0.3 N[C@@H](CS)C(=O)O CS-0516218 [0,1,0,0,0,0|1,1,1]=4 117 B6R0.3 O=C(O)C(Cl)CCl CS-0204463 [0,1,0,0,0,0|2,0,1]=4 118 B6R0.3 O=C(O)C(O)C[O-] CS-0636758 [0,1,0,0,0,0|0,0,2]=3 119 B6R0.3 O=C(O)[C@@H](Br)CO CS-0099808 [0,1,0,0,0,0|1,0,1]=3 120 B6R0.3 O=C(O)[C@H](Br)CO CS-0099806 [0,1,0,0,0,0|1,0,1]=3 121 B6R0.8 C#CC(C)(C)CO CS-0137418 [0,1,0,0,0,0|2,0,1]=4 122 B6R0.8 CC(C)(CCl)CCl CS-0205194 [0,1,0,0,0,0|3,0,0]=4 123 B6R0.8 CCC(C)(O)C#N CS-0217800 [0,1,0,0,0,0|2,0,1]=4 124 B6R0.8 CSC(C)(C)CO CS-0308636 [0,1,0,0,0,0|3,0,0]=4 125 B6R0.9 C#CC(CC)CN CS-0646559 [0,1,0,0,0,0|3,0,0]=4 126 B6R0.9 CCC(CF)NN CS-0230085 [0,1,0,0,0,0|3,0,0]=4 127 B6R0.9 CCC(CN)CN CS-0239311 [0,1,0,0,0,0|3,0,0]=4 128 B6R0.9 CCC(CN)OC CS-0148793 [0,1,0,0,0,0|2,0,0]=3 129 B6R0.9 CCC(CO)CO CS-0210382 [0,1,0,0,0,0|1,0,0]=2 130 B6R0.9 CNC(CO)CO CS-0238156 [0,1,0,0,0,0|1,0,0]=2 131 B6R0.9 NCC(CO)CO CS-0354635 [0,1,0,0,0,0|1,0,0]=2 132 B6R1.2 Br[C@@H]1CCNC1 CS-0223803 [0,0,0,1,0,0|3,0,0]=4 133 B6R1.2 CC1CCNC1 CS-0451382 [0,0,0,1,0,0|3,0,0]=4 134 B6R1.2 CC1COCO1 CS-0204301 [0,0,0,1,0,0|3,0,0]=4 135 B6R1.2 ClC1CCOC1 CS-W004265 [0,0,0,1,0,0|2,0,0]=3 136 B6R1.2 NC1CCNC1 CS-W004336 [0,0,0,1,0,0|3,0,0]=4 137 B6R1.2 NC1CCSC1 CS-0046717 [0,0,0,1,0,0|2,1,0]=4 138 B6R1.2 O[C@@H]1C=CCC1 CS-1136917 [0,0,0,1,0,0|2,0,1]=4 139 B6R1.2 O[C@@H]1CCSC1 CS-0171629 [0,0,0,1,0,0|1,1,0]=3 140 B6R1.2 SC1CCNC1 CS-0185425 [0,0,0,1,0,0|2,1,0]=4 141 B6R1.2 SC1CCSC1 CS-0232805 [0,0,0,1,0,0|1,2,0]=4 142 B6R1.2 S[C@H]1CCNC1 CS-0185417 [0,0,0,1,0,0|2,1,0]=4 143 B6R1.2 [C@@H]1(N)CCNC1 CS-W016678 [0,0,0,1,0,0|3,0,0]=4 144 B6R1.4 CC1NCC1F CS-0184006 [0,0,0,1,0,0|3,0,0]=4 145 B6R1.4 CC1OCC1N CS-0312215 [0,0,0,1,0,0|2,0,0]=3 146 B6R1.4 CC1OCC1O CS-0051834 [0,0,0,1,0,0|1,0,0]=2 147 B6R1.4 C[C@@H]1NCC1F CS-0478356 [0,0,0,1,0,0|3,0,0]=4 148 B6R1.4 C[C@@H]1NC[C@@H]1F CS-0517876 [0,0,0,1,0,0|3,0,0]=4 149 B6R1.4 C[C@H]1NCC1F CS-0478355 [0,0,0,1,0,0|3,0,0]=4 150 B6R1.4 C[C@H]1NC[C@@H]1O CS-0782278 [0,0,0,1,0,0|2,0,0]=3 151 B6R1.4 C[C@H]1NC[C@H]1F CS-0478354 [0,0,0,1,0,0|3,0,0]=4 152 B6R1.4 NC1CCC1O CS-0310362 [0,0,0,1,0,0|2,0,0]=3 153 B6R1.4 N[C@@H]1CC[C@@H]1O CS-0049745 [0,0,0,1,0,0|2,0,0]=3 154 B6R1.4 N[C@@H]1CC[C@H]1N CS-0474240 [0,0,0,1,0,0|3,0,0]=4 155 B6R1.4 N[C@@H]1CC[C@H]1O CS-0045478 [0,0,0,1,0,0|2,0,0]=3 156 B6R1.4 N[C@H]1CC[C@@H]1O CS-0183307 [0,0,0,1,0,0|2,0,0]=3 157 B6R1.4 N[C@H]1CC[C@H]1O CS-0784768 [0,0,0,1,0,0|2,0,0]=3 158 B6R1.4 OC1CCC1O CS-0683326 [0,0,0,1,0,0|1,0,0]=2 159 B6R1.4 O[C@@H]1CC[C@H]1O CS-0504665 [0,0,0,1,0,0|1,0,0]=2 160 B6R1.4 O[C@H]1CC[C@H]1O CS-0504664 [0,0,0,1,0,0|1,0,0]=2 161 B6R1.6 BrCC1CCO1 CS-0045505 [0,0,0,1,0,0|2,0,0]=3 162 B6R1.6 BrC[C@@H]1CCO1 CS-0310467 [0,0,0,1,0,0|2,0,0]=3 163 B6R1.6 BrC[C@H]1CCO1 CS-0530005 [0,0,0,1,0,0|2,0,0]=3 164 B6R1.6 CNC1COC1 CS-W000751 [0,0,0,1,0,0|3,0,0]=4 165 B6R1.6 FCC1CCN1 CS-0056652 [0,0,0,1,0,0|3,0,0]=4 166 B6R1.6 FC[C@@H]1CCN1 CS-0056653 [0,0,0,1,0,0|3,0,0]=4 167 B6R1.6 NCC1CCN1 CS-0049914 [0,0,0,1,0,0|3,0,0]=4 168 B6R1.6 NCC1CSC1 CS-0045533 [0,0,0,1,0,0|2,1,0]=4 169 B6R1.6 NC[C@@H]1CCO1 CS-0179911 [0,0,0,1,0,0|2,0,0]=3 170 B6R1.6 NC[C@H]1CCO1 CS-0102901 [0,0,0,1,0,0|2,0,0]=3 171 B6R1.6 OCC1CCN1 CS-0637637 [0,0,0,1,0,0|2,0,0]=3 172 B6R1.6 OCC1CSC1 CS-0045518 [0,0,0,1,0,0|1,1,0]=3 173 B6R1.6 OC[C@@H]1CCN1 CS-0148327 [0,0,0,1,0,0|2,0,0]=3 174 B6R1.7 CCC1(N)CC1 CS-0052565 [0,0,0,1,0,0|3,0,0]=4 175 B6R1.7 C[C@@]1(CO)CO1 CS-0093325 [0,0,0,1,0,0|1,0,0]=2 176 B6R1.7 NCC1(N)CC1 CS-0341934 [0,0,0,1,0,0|3,0,0]=4 177 B6R1.7 NCC1(O)CC1 CS-0457151 [0,0,0,1,0,0|2,0,0]=3 178 B6R1.7 OCC1(Br)CC1 CS-0570795 [0,0,0,1,0,0|2,0,0]=3 179 B6R1.8 CC1CC1CBr CS-0266125 [0,0,0,1,0,0|3,0,0]=4 180 B6R1.8 CC1CC1CO CS-0251356 [0,0,0,1,0,0|2,0,0]=3 181 B6R1.8 C[C@H]1C[C@H]1CO CS-0183080 [0,0,0,1,0,0|2,0,0]=3 182 B6R1.8 OCC1CC1Cl CS-0222738 [0,0,0,1,0,0|2,0,0]=3 183 B3R0.1 NCCN CS-0857495 [2,0,0,0,0,0|2,0,0]=4 184 B3R0.1 NCCO CS-0621989 [2,0,0,0,0,0|1,0,0]=3 185 B3R0.2 CC(=O)O CS-1154102 [2,0,0,0,0,0|0,0,2]=4 186 B3R0.2 CC(C)O CS-1046195 [2,0,0,0,0,0|0,0,0]=2 187 B3R0.2 CN(C)O CS-0757536 [2,0,0,0,0,0|1,0,0]=3 188 B5R0.1 C=CCC(C)N CS-0217614 [1,1,0,0,0,0|2,0,0]=4 189 B5R0.1 C=CC[C@H](C)N CS-0910278 [1,1,0,0,0,0|2,0,0]=4 190 B5R0.1 CC(N)CCN CS-0262681 [1,1,0,0,0,0|2,0,0]=4 191 B5R0.1 CC(O)CCCl CS-0959567 [1,1,0,0,0,0|1,0,0]=3 192 B5R0.1 CC(O)CNN CS-0036622 [1,1,0,0,0,0|1,0,0]=3 193 B5R0.1 CN(C)CCO CS-W009541 [1,1,0,0,0,0|2,0,0]=4 194 B5R0.1 CNCC(C)O CS-0754427 [1,1,0,0,0,0|1,0,0]=3 195 B5R0.1 CNC[C@@H](C)O CS-0375929 [1,1,0,0,0,0|1,0,0]=3 196 B5R0.1 CNC[C@H](C)O CS-0139471 [1,1,0,0,0,0|1,0,0]=3 197 B5R0.1 CNC[C@H](C)O CS-0652032 [1,1,0,0,0,0|1,0,0]=3 198 B5R0.1 CSCC(C)N CS-0217650 [1,1,0,0,0,0|1,1,0]=4 199 B5R0.1 C[C@@H](O)CC#N CS-0693312 [1,1,0,0,0,0|1,0,0]=3 200 B5R0.1 C[C@@H](O)CCN CS-0113150 [1,1,0,0,0,0|1,0,0]=3 201 B5R0.4 CC(C)(N)CBr CS-0044806 [1,1,0,0,0,0|2,0,0]=4 202 B5R0.4 CC(C)(N)CF CS-0030310 [1,1,0,0,0,0|2,0,0]=4 203 B5R0.4 CC(C)(N)CO CS-0660148 [1,1,0,0,0,0|1,0,0]=3 204 B5R0.4 OCC(F)(F)Br CS-0179505 [1,1,0,0,0,0|2,0,0]=4 205 B5R0.5 CC(Br)C(C)Br CS-W014879 [1,1,0,0,0,0|2,0,0]=4 206 B5R0.5 CC(N)C(C)O CS-0776838 [1,1,0,0,0,0|1,0,0]=3 207 B5R0.5 CC(N)C(F)F CS-0307900 [1,1,0,0,0,0|2,0,0]=4 208 B5R0.5 CC(O)C(=N)N CS-0037354 [1,1,0,0,0,0|1,0,1]=4 209 B5R0.5 CC(O)C(=N)N CS-0677492 [1,1,0,0,0,0|1,0,1]=4 210 B5R0.5 C[C@@H](N)C(F)F CS-0492658 [1,1,0,0,0,0|2,0,0]=4 211 B5R0.5 C[C@H](N)[C@H](C)O CS-0266951 [1,1,0,0,0,0|1,0,0]=3 212 B5R0.5 C[C@H](N)[C@H](C)O CS-0567898 [1,1,0,0,0,0|1,0,0]=3 213 B5R0.2 CCCCCN CS-0214107 [1,1,0,0,0,0|2,0,0]=4 214 B5R0.2 CCCCCN CS-0468686 [1,1,0,0,0,0|2,0,0]=4 215 B5R0.2 CCNCCCl CS-0072216 [1,1,0,0,0,0|2,0,0]=4 216 B5R0.2 CCSCCN CS-0140655 [1,1,0,0,0,0|2,0,0]=4 217 B5R0.2 CNCCCBr CS-0775766 [1,1,0,0,0,0|2,0,0]=4 218 B5R0.2 COCCON CS-0183776 [1,1,0,0,0,0|2,0,0]=4 219 B5R0.2 CSCCCCl CS-0307998 [1,1,0,0,0,0|1,1,0]=4 220 B5R0.2 NCC#CCO CS-0967867 [1,1,0,0,0,0|1,0,1]=4 221 B5R0.2 NNCCCO CS-0742218 [1,1,0,0,0,0|1,0,0]=3 222 B5R0.2 NOCCCS CS-0308423 [1,1,0,0,0,0|0,1,0]=3 223 B7R0.2 C=C(C)CC(N)CO CS-0247968 [0,2,0,0,0,0|2,0,0]=4 224 B7R0.2 CC(CO)CN(C)C CS-0215040 [0,2,0,0,0,0|2,0,0]=4 225 B7R0.2 CCC(O)CN(C)C CS-0246574 [0,2,0,0,0,0|2,0,0]=4 226 B7R0.2 CC[C@@H](C)CC(=O)O CS-0172023 [0,2,0,0,0,0|2,0,0]=4 227 B7R0.2 CC[C@@H](N)CC(=O)O CS-0236565 [0,2,0,0,0,0|2,0,0]=4 228 B7R0.2 NC(CO)CC(=O)O CS-0161147 [0,2,0,0,0,0|1,0,0]=3 229 B7R0.3 C#CCCC(O)CN CS-0238633 [0,2,0,0,0,0|2,0,0]=4 230 B7R0.3 C=CCCC(O)CCl CS-0216419 [0,2,0,0,0,0|2,0,0]=4 231 B7R0.3 CC#CCC(O)CC CS-0328395 [0,2,0,0,0,0|2,0,0]=4 232 B7R0.3 CC(CO)CCCN CS-0224450 [0,2,0,0,0,0|2,0,0]=4 233 B7R0.3 CCC(N)CCCO CS-0236618 [0,2,0,0,0,0|2,0,0]=4 234 B7R0.3 CCC(O)CCCN CS-0263098 [0,2,0,0,0,0|2,0,0]=4 235 B7R0.3 CCC(O)CCCN CS-1026727 [0,2,0,0,0,0|2,0,0]=4 236 B7R0.3 CCCCC(N)CO CS-0091368 [0,2,0,0,0,0|2,0,0]=4 237 B7R0.3 CCCNC(C)CO CS-0450070 [0,2,0,0,0,0|2,0,0]=4 238 B7R0.3 CCNCC(O)CC CS-0669943 [0,2,0,0,0,0|2,0,0]=4 239 B7R0.3 COCCC(N)CO CS-0106481 [0,2,0,0,0,0|1,0,0]=3 240 B7R0.3 CSCCC(N)CO CS-0091223 [0,2,0,0,0,0|1,1,0]=4 241 B7R0.3 CSCCC(O)CN CS-0075038 [0,2,0,0,0,0|1,1,0]=4 242 B7R0.3 OC(CCl)CCCCl CS-0224667 [0,2,0,0,0,0|2,0,0]=4 243 B7R0.5 CC(C)C(N)CCO CS-0208211 [0,2,0,0,0,0|2,0,0]=4 244 B7R0.5 CCC[C@@H](O)C(=O)O CS-0697299 [0,2,0,0,0,0|1,0,1]=4 245 B7R0.5 COCC(C)C(C)N CS-0239715 [0,2,0,0,0,0|2,0,0]=4 246 B7R0.5 COCC(Cl)C(=O)O CS-W016486 [0,2,0,0,0,0|1,0,1]=4 247 B7R0.5 COCC(O)C(C)C CS-0265308 [0,2,0,0,0,0|1,0,0]=3 248 B7R0.5 NCC[C@@H](O)C(=O)O CS-0214761 [0,2,0,0,0,0|1,0,1]=4 249 B7R0.5 N[C@@H](CCO)C(=O)O CS-0541796 [0,2,0,0,0,0|1,0,1]=4 250 B7R0.5 O=C(O)C(O)CCO CS-1001199 [0,2,0,0,0,0|0,0,1]=3 251 B7R0.7 C#CCC(N)COC CS-0216036 [0,2,0,0,0,0|2,0,0]=4 252 B7R0.7 CCCC(C)CCO CS-0216041 [0,2,0,0,0,0|2,0,0]=4 253 B7R0.7 CCCC(O)CCN CS-0241763 [0,2,0,0,0,0|2,0,0]=4 254 B7R0.7 CCCC(O)CNC CS-0237618 [0,2,0,0,0,0|2,0,0]=4 255 B7R0.7 CCOC(C)CCO CS-0523568 [0,2,0,0,0,0|2,0,0]=4 256 B7R0.7 CN(CCO)CCO CS-0510507 [0,2,0,0,0,0|2,0,0]=4 257 B7R0.7 CNCC(C)CCO CS-0239160 [0,2,0,0,0,0|2,0,0]=4 258 B7R0.7 COCC(N)CCO CS-0217710 [0,2,0,0,0,0|1,0,0]=3 259 B7R0.7 CSCC(N)CCO CS-0262815 [0,2,0,0,0,0|1,1,0]=4 260 B7R0.7 O=C(CCO)CCO CS-0139423 [0,2,0,0,0,0|0,0,2]=4 261 B7R0.7 O=C(NCO)NCO CS-0064471 [0,2,0,0,0,0|0,0,2]=4 262 B7R0.10 CC(CO)C(=O)O[Na] CS-0169672 [0,2,0,0,0,0|1,0,1]=4 263 B7R0.10 CCC(C)C(N)CO CS-0091231 [0,2,0,0,0,0|2,0,0]=4 264 B7R0.10 CCN(C)C(C)CO CS-0298081 [0,2,0,0,0,0|2,0,0]=4 265 B7R0.10 CCN(C)[C@@H](C)CO CS-0858619 [0,2,0,0,0,0|2,0,0]=4 266 B7R0.10 COC(=O)[C@@H](N)CO CS-0001840 [0,2,0,0,0,0|1,0,1]=4 267 B7R0.10 O=C[C@@H](O)[C@@H](O)CO CS-0139803 [0,2,0,0,0,0|0,0,0]=2 268 B7R0.10 OC(CBr)C(O)CBr CS-W012677 [0,2,0,0,0,0|1,0,0]=3 269 B7R0.10 OC[C@H](O)[C@@H](O)CO CS-0133193 [0,2,0,0,0,0|0,0,0]=2 270 B7R0.10 OC\C(Br)=C(/Br)CO CS-0887438 [0,2,0,0,0,0|1,0,1]=4 271 B7R0.10 [C@@H](O)(C=O)[C@H](O)CO CS-W013580 [0,2,0,0,0,0|0,0,0]=2 272 B7R0.11 C#CCC(C)(C)CO CS-0112799 [0,2,0,0,0,0|2,0,0]=4 273 B7R0.11 C=CCC(C)(O)CC CS-0324280 [0,2,0,0,0,0|2,0,0]=4 274 B7R0.11 CC(C)(CO)CC#N CS-0440316 [0,2,0,0,0,0|2,0,0]=4 275 B7R0.11 CCC(C)(C)CCO CS-0264957 [0,2,0,0,0,0|2,0,0]=4 276 B7R0.11 CCC(C)(N)CCO CS-0295506 [0,2,0,0,0,0|2,0,0]=4 277 B7R0.11 CCC(C)(O)CCN CS-0239873 [0,2,0,0,0,0|2,0,0]=4 278 B7R0.11 CCCC(C)(N)CO CS-0091365 [0,2,0,0,0,0|2,0,0]=4 279 B7R0.11 CCNC(C)(C)CO CS-0715615 [0,2,0,0,0,0|2,0,0]=4 280 B7R0.11 CCOC(C)(C)CO CS-0959717 [0,2,0,0,0,0|2,0,0]=4 281 B7R0.11 CNCC(C)(C)CO CS-0447676 [0,2,0,0,0,0|2,0,0]=4 282 B7R0.11 COCC(C)(C)CBr CS-0246844 [0,2,0,0,0,0|2,0,0]=4 283 B7R0.11 COCC(C)(C)CO CS-0239625 [0,2,0,0,0,0|1,0,0]=3 284 B7R0.11 COCC(C)(O)CN CS-0075373 [0,2,0,0,0,0|1,0,0]=3 285 B7R0.12 C=CCC(CN)CO CS-0225786 [0,2,0,0,0,0|2,0,0]=4 286 B7R0.12 CCN[C@@H](CC)CO CS-0210509 [0,2,0,0,0,0|2,0,0]=4 287 B7R0.12 CCOC(CC)CN CS-0443759 [0,2,0,0,0,0|2,0,0]=4 288 B7R0.12 CCOC(CN)CN CS-0233181 [0,2,0,0,0,0|2,0,0]=4 289 B7R0.12 CCOC(CN)CO CS-0223138 [0,2,0,0,0,0|1,0,0]=3 290 B7R0.13 CC(O)(CO)C(=O)O CS-0062265 [0,2,0,0,0,0|0,0,1]=3 291 B7R0.13 CC(O)C(C)(C)CN CS-0257838 [0,2,0,0,0,0|2,0,0]=4 292 B7R0.14 CCC(O)C(F)(F)F CS-0205441 [0,2,0,0,0,0|2,0,0]=4 293 B7R0.14 OC(CBr)C(F)(F)F CS-0121181 [0,2,0,0,0,0|2,0,0]=4 294 B7R0.14 OC[C@@H](O)C(F)(F)F CS-0357448 [0,2,0,0,0,0|1,0,0]=3 295 B7R0.15 CC(C)C(CO)CBr CS-0964787 [0,2,0,0,0,0|2,0,0]=4 296 B7R0.15 CCC(CC)C(C)O CS-0744567 [0,2,0,0,0,0|2,0,0]=4 297 B7R0.15 CCC(CN)C(=O)O CS-0680219 [0,2,0,0,0,0|2,0,0]=4 298 B7R0.15 CCC(OC)C(=O)O CS-0252116 [0,2,0,0,0,0|1,0,1]=4 299 B7R0.15 CNC(CO)C(C)C CS-0336925 [0,2,0,0,0,0|2,0,0]=4 300 B7R0.15 COC(CO)C(C)C CS-0897361 [0,2,0,0,0,0|1,0,0]=3 301 B7R0.15 CO[C@@H](CN)C(=O)O CS-1055675 [0,2,0,0,0,0|1,0,1]=4 302 B7R0.15 CSC(CO)C(C)N CS-0262446 [0,2,0,0,0,0|1,1,0]=4 303 B7R0.16 CC(C)C(O)C(C)N CS-0231862 [0,2,0,0,0,0|2,0,0]=4 304 B7R0.16 CC(C)C(O)C(F)F CS-0851679 [0,2,0,0,0,0|2,0,0]=4 305 B7R0.16 CC(N)C(O)C(F)F CS-0253488 [0,2,0,0,0,0|2,0,0]=4 306 B7R0.16 CC(O)C(C)C(C)O CS-0242579 [0,2,0,0,0,0|1,0,0]=3 307 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O CS-0031502 [0,2,0,0,0,0|1,0,1]=4 308 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O CS-0668310 [0,2,0,0,0,0|1,0,1]=4 309 B7R0.18 CCC(C)(CC)CO CS-0247941 [0,2,0,0,0,0|2,0,0]=4 310 B7R0.18 CCC(N)(CC)CO CS-0091369 [0,2,0,0,0,0|2,0,0]=4 311 B7R0.18 CCC(O)(C#N)CC CS-0263221 [0,2,0,0,0,0|2,0,0]=4 312 B5R1.2 ClC1COC1 CS-0183303 [1,0,0,1,0,0|1,0,0]=3 313 B5R1.2 SC1COC1 CS-0048763 [1,0,0,1,0,0|0,1,0]=3 314 B5R1.4 C[C@@H]1C[C@H]1N CS-0197605 [1,0,0,1,0,0|2,0,0]=4 315 B5R1.4 C[C@H]1C[C@@H]1N CS-0214194 [1,0,0,1,0,0|2,0,0]=4 316 B5R1.4 C[C@H]1C[C@H]1N CS-0462910 [1,0,0,1,0,0|2,0,0]=4 317 B5R1.4 N[C@@H]1C[C@@H]1F CS-0143338 [1,0,0,1,0,0|2,0,0]=4 318 B5R1.4 [C@@H]1(N)C[C@H]1N CS-W006879 [1,0,0,1,0,0|2,0,0]=4 319 B7R1.1 CNC1CCOC1 CS-0048784 [0,1,0,1,0,0|2,0,0]=4 320 B7R1.1 CN[C@@H]1CCOC1 CS-0053318 [0,1,0,1,0,0|2,0,0]=4 321 B7R1.1 CN[C@@H]1CCOC1 CS-0057591 [0,1,0,1,0,0|2,0,0]=4 322 B7R1.1 CN[C@H]1CCOC1 CS-0057592 [0,1,0,1,0,0|2,0,0]=4 323 B7R1.1 NC[C@H]1CCOC1 CS-0053314 [0,1,0,1,0,0|2,0,0]=4 324 B7R1.1 NOC1CCCC1 CS-0634531 [0,1,0,1,0,0|2,0,0]=4 325 B7R1.1 OCC1C=CCC1 CS-0341069 [0,1,0,1,0,0|2,0,0]=4 326 B7R1.1 OCC1COCO1 CS-W019304 [0,1,0,1,0,0|0,0,0]=2 327 B7R1.2 CC1CC(O)CN1 CS-0222526 [0,1,0,1,0,0|2,0,0]=4 328 B7R1.2 C[C@H]1COC(=O)C1 CS-0120813 [0,1,0,1,0,0|1,0,1]=4 329 B7R1.2 N[C@@H]1CC[C@@H](O)C1 CS-0030169 [0,1,0,1,0,0|2,0,0]=4 330 B7R1.2 O=C1CC[C@H](O)C1 CS-0495545 [0,1,0,1,0,0|1,0,1]=4 331 B7R1.2 OC1CCC(F)C1 CS-0477400 [0,1,0,1,0,0|2,0,0]=4 332 B7R1.3 N[C@@H]1CCCOC1 CS-0183316 [0,1,0,1,0,0|2,0,0]=4 333 B7R1.3 N[C@H]1CCCOC1 CS-0046122 [0,1,0,1,0,0|2,0,0]=4 334 B7R1.3 [C@H]1(O)CCCOC1 CS-W007290 [0,1,0,1,0,0|1,0,0]=3 335 B7R1.4 C[C@@H]1NCC[C@@H]1O CS-0501476 [0,1,0,1,0,0|2,0,0]=4 336 B7R1.4 C[C@H]1CCC[C@H]1O CS-0036366 [0,1,0,1,0,0|2,0,0]=4 337 B7R1.4 C[C@H]1COC[C@@H]1N CS-0184287 [0,1,0,1,0,0|2,0,0]=4 338 B7R1.4 C[C@H]1OCC[C@@H]1N CS-1057343 [0,1,0,1,0,0|2,0,0]=4 339 B7R1.4 ClC1CCOC1Cl CS-0451541 [0,1,0,1,0,0|2,0,0]=4 340 B7R1.4 N[C@@H]1CCC[C@@H]1O CS-0368662 [0,1,0,1,0,0|2,0,0]=4 341 B7R1.4 N[C@@H]1CCC[C@@H]1O CS-0513808 [0,1,0,1,0,0|2,0,0]=4 342 B7R1.4 N[C@@H]1COC[C@@H]1N CS-0049723 [0,1,0,1,0,0|2,0,0]=4 343 B7R1.4 N[C@@H]1COC[C@@H]1O CS-0029555 [0,1,0,1,0,0|1,0,0]=3 344 B7R1.4 N[C@@H]1COC[C@H]1N CS-0053226 [0,1,0,1,0,0|2,0,0]=4 345 B7R1.4 N[C@@H]1COC[C@H]1O CS-0046712 [0,1,0,1,0,0|1,0,0]=3 346 B7R1.4 N[C@H]1COC[C@@H]1N CS-0058692 [0,1,0,1,0,0|2,0,0]=4 347 B7R1.4 N[C@H]1COC[C@@H]1O CS-0184532 [0,1,0,1,0,0|1,0,0]=3 348 B7R1.4 N[C@H]1COC[C@H]1F CS-0092759 [0,1,0,1,0,0|2,0,0]=4 349 B7R1.4 OC1CCCC1O CS-0451973 [0,1,0,1,0,0|1,0,0]=3 350 B7R1.4 OC1CNCC1O CS-0083889 [0,1,0,1,0,0|1,0,0]=3 351 B7R1.4 OC1CNCC1O CS-0496937 [0,1,0,1,0,0|1,0,0]=3 352 B7R1.4 OC1COCC1Br CS-0487203 [0,1,0,1,0,0|1,0,0]=3 353 B7R1.4 O[C@@H]1CCC[C@H]1O CS-0782195 [0,1,0,1,0,0|1,0,0]=3 354 B7R1.4 O[C@@H]1CNC[C@@H]1F CS-0058738 [0,1,0,1,0,0|2,0,0]=4 355 B7R1.4 O[C@H]1CCC[C@@H]1O CS-0058322 [0,1,0,1,0,0|1,0,0]=3 356 B7R1.4 O[C@H]1CNC[C@H]1F CS-0502667 [0,1,0,1,0,0|2,0,0]=4 357 B7R1.4 O[C@H]1COC[C@@H]1O CS-0173155 [0,1,0,1,0,0|0,0,0]=2 358 B7R1.4 [C@@H]1(N)CCC[C@H]1O CS-0031413 [0,1,0,1,0,0|2,0,0]=4 359 B7R1.6 CCNC1COC1 CS-0045508 [0,1,0,1,0,0|2,0,0]=4 360 B7R1.6 CNCC1COC1 CS-0048871 [0,1,0,1,0,0|2,0,0]=4 361 B7R1.6 COC[C@@H]1CCN1 CS-0053449 [0,1,0,1,0,0|2,0,0]=4 362 B7R1.6 COC[C@H]1CCN1 CS-0053501 [0,1,0,1,0,0|2,0,0]=4 363 B7R1.6 NCCC1CCO1 CS-0052220 [0,1,0,1,0,0|2,0,0]=4 364 B7R1.6 NCCC1COC1 CS-0052217 [0,1,0,1,0,0|2,0,0]=4 365 B7R1.6 OCCC1CCC1 CS-0054337 [0,1,0,1,0,0|2,0,0]=4 366 B7R1.6 OCCC1CCO1 CS-0052219 [0,1,0,1,0,0|1,0,0]=3 367 B7R1.6 OCCC1CNC1 CS-0052250 [0,1,0,1,0,0|2,0,0]=4 368 B7R1.6 OCC[C@@H]1CCO1 CS-0623027 [0,1,0,1,0,0|1,0,0]=3 369 B7R1.8 COC1CCC1N CS-0654190 [0,1,0,1,0,0|2,0,0]=4 370 B7R1.8 CO[C@@H]1CC[C@@H]1N CS-0476856 [0,1,0,1,0,0|2,0,0]=4 371 B7R1.8 CO[C@@H]1CC[C@H]1N CS-0309645 [0,1,0,1,0,0|2,0,0]=4 372 B7R1.8 OCC1CCC1F CS-0045492 [0,1,0,1,0,0|2,0,0]=4 373 B7R1.8 OC[C@H]1CC[C@H]1O CS-0499615 [0,1,0,1,0,0|1,0,0]=3 374 B7R1.9 N#CC1CC1CO CS-0654804 [0,1,0,1,0,0|2,0,0]=4 375 B7R1.9 NCC1CC1CO CS-0056025 [0,1,0,1,0,0|2,0,0]=4 376 B7R1.9 NC[C@H]1C[C@H]1CO CS-0444092 [0,1,0,1,0,0|2,0,0]=4 377 B7R1.10 NCC1CC(O)C1 CS-0053792 [0,1,0,1,0,0|2,0,0]=4 378 B7R1.10 NC[C@H]1C[C@H](O)C1 CS-0053933 [0,1,0,1,0,0|2,0,0]=4 379 B7R1.10 N[C@H]1C[C@@H](CO)C1 CS-0053863 [0,1,0,1,0,0|2,0,0]=4 380 B7R1.10 N[C@H]1C[C@H](CO)C1 CS-0045535 [0,1,0,1,0,0|2,0,0]=4 381 B7R1.10 N[C@H]1C[C@H](CO)C1 CS-0055246 [0,1,0,1,0,0|2,0,0]=4 382 B7R1.10 O=C1CC(CO)N1 CS-0051147 [0,1,0,1,0,0|1,0,1]=4 383 B7R1.10 O=C1C[C@@H](CO)N1 CS-0523935 [0,1,0,1,0,0|1,0,1]=4 384 B7R1.10 OC1CC(CBr)C1 CS-0501424 [0,1,0,1,0,0|2,0,0]=4 385 B7R1.10 O[C@H]1C[C@@H](CF)C1 CS-0504579 [0,1,0,1,0,0|2,0,0]=4 386 B7R1.21 CCOC1(O)CC1 CS-0056034 [0,1,0,1,0,0|2,0,0]=4 387 B7R1.21 COCC1(O)CC1 CS-0055994 [0,1,0,1,0,0|1,0,0]=3 388 B7R1.21 OCCC1(O)CC1 CS-0052907 [0,1,0,1,0,0|1,0,0]=3 389 B7R1.22 CC(CO)C1CC1 CS-0238008 [0,1,0,1,0,0|2,0,0]=4 390 B7R1.22 NC(CO)C1CC1 CS-0091326 [0,1,0,1,0,0|2,0,0]=4 391 B7R1.22 N[C@@H](CO)C1CC1 CS-0091328 [0,1,0,1,0,0|2,0,0]=4 392 B7R1.22 N[C@H](CO)C1CC1 CS-0091327 [0,1,0,1,0,0|2,0,0]=4 393 B7R1.22 OC(CBr)C1CC1 CS-0271403 [0,1,0,1,0,0|2,0,0]=4 394 B7R1.25 CC1(CN)CCO1 CS-0506326 [0,1,0,1,0,0|2,0,0]=4 395 B7R1.25 CC1(CO)CCN1 CS-0172765 [0,1,0,1,0,0|2,0,0]=4 396 B7R1.25 CC1(CO)CCO1 CS-0183569 [0,1,0,1,0,0|1,0,0]=3 397 B7R1.25 CC1(CO)CSC1 CS-0091512 [0,1,0,1,0,0|1,1,0]=4 398 B7R1.25 CCC1(N)COC1 CS-0172212 [0,1,0,1,0,0|2,0,0]=4 399 B7R1.25 C[C@]1(CN)CCO1 CS-0310466 [0,1,0,1,0,0|2,0,0]=4 400 B7R1.25 FC1(CBr)COC1 CS-0045512 [0,1,0,1,0,0|2,0,0]=4 401 B7R1.25 FC1(CI)COC1 CS-0051366 [0,1,0,1,0,0|2,0,0]=4 402 B7R1.25 NC1(CF)COC1 CS-0172809 [0,1,0,1,0,0|2,0,0]=4 403 B7R1.25 NC1(CO)CCC1 CS-0040898 [0,1,0,1,0,0|2,0,0]=4 404 B7R1.25 NCC1(N)COC1 CS-0051727 [0,1,0,1,0,0|2,0,0]=4 405 B7R1.25 OC1(CF)CNC1 CS-0369697 [0,1,0,1,0,0|2,0,0]=4 406 B7R1.25 OC1(CF)COC1 CS-0478245 [0,1,0,1,0,0|1,0,0]=3 407 B7R1.25 OCC1(F)CNC1 CS-0036390 [0,1,0,1,0,0|2,0,0]=4 408 B7R1.25 OCC1(F)COC1 CS-0045510 [0,1,0,1,0,0|1,0,0]=3 409 B7R1.25 OCC1(O)CCC1 CS-0504512 [0,1,0,1,0,0|1,0,0]=3 410 B7R1.25 OCC1(O)CNC1 CS-0049771 [0,1,0,1,0,0|1,0,0]=3 411 B7R1.25 OCC1(O)CNC1 CS-0852008 [0,1,0,1,0,0|1,0,0]=3 412 B7R1.17 CC1(C)NC[C@@H]1O CS-1056738 [0,1,0,1,0,0|2,0,0]=4 413 B7R1.17 CC1(C)NC[C@H]1O CS-1056740 [0,1,0,1,0,0|2,0,0]=4 414 B7R1.17 CC1(C)OCC1N CS-0184374 [0,1,0,1,0,0|2,0,0]=4 415 B7R1.17 CC1(C)OCC1O CS-0654629 [0,1,0,1,0,0|1,0,0]=3 416 B7R1.18 CC(N)C1COC1 CS-0052814 [0,1,0,1,0,0|2,0,0]=4 417 B7R1.18 CC(O)C1COC1 CS-0056972 [0,1,0,1,0,0|1,0,0]=3 418 B7R1.18 C[C@@H](N)C1COC1 CS-0310112 [0,1,0,1,0,0|2,0,0]=4 419 B7R1.18 C[C@@H](O)C1CCC1 CS-0144928 [0,1,0,1,0,0|2,0,0]=4 420 B7R1.18 C[C@H](N)C1COC1 CS-0310113 [0,1,0,1,0,0|2,0,0]=4 421 B7R1.18 C[C@H](O)C1COC1 CS-0309421 [0,1,0,1,0,0|1,0,0]=3 422 B7R1.18 O=C(O)[C@H]1CCO1 CS-0148271 [0,1,0,1,0,0|1,0,1]=4 423 B7R1.19 CC(C)C1(O)CC1 CS-0183834 [0,1,0,1,0,0|2,0,0]=4 424 B7R1.19 CC1(C(=O)O)CO1 CS-0113830 [0,1,0,1,0,0|1,0,1]=4 425 B7R1.23 OC[C@H]1CC1(F)F CS-0532674 [0,1,0,1,0,0|2,0,0]=4 426 B7R1.14 CC1(O)CCOC1 CS-0210169 [0,1,0,1,0,0|1,0,0]=3 427 B7R1.14 C[C@]1(O)CCNC1 CS-0053260 [0,1,0,1,0,0|2,0,0]=4 428 B7R1.29 C#CC1(CO)CC1 CS-0053660 [0,1,0,1,0,0|2,0,0]=4 429 B7R1.29 CCC1(CO)CC1 CS-0238470 [0,1,0,1,0,0|2,0,0]=4 430 B7R1.29 CNC1(CO)CC1 CS-0109785 [0,1,0,1,0,0|2,0,0]=4 431 B7R1.29 NCC1(CO)CC1 CS-0508193 [0,1,0,1,0,0|2,0,0]=4 432 B7R1.29 OCC1(CF)CC1 CS-0054281 [0,1,0,1,0,0|2,0,0]=4