0 B7R0.4 C#CCNCC(=O)O CUR-0123529 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.4 C(CCBr)CC(=O)O CUR-0103088 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.4 C(CCN)CC(=O)O CUR-0018281 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.4 C(CN=[N+]=[N-])C(=O)O CUR-0027706 [0,0,0,0,0,0|4,0,0]=4 4 B7R0.4 C=CCOCC(=O)O CUR-0014777 [0,0,0,0,0,0|2,0,2]=4 5 B7R0.4 CC(C)OCCCN CUR-0101773 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.4 CC(C)OCCCO CUR-0010579 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.4 CCCCNC(=O)N CUR-0101762 [0,0,0,0,0,0|2,0,0]=2 8 B7R0.4 CCCCOC(=O)C CUR-0026180 [0,0,0,0,0,0|1,0,0]=1 9 B6R0.4 C(CC(=O)Cl)CBr CUR-0103177 [1,0,0,0,0,0|2,0,0]=3 10 B6R0.4 C(CC(=O)Cl)CCl CUR-0020663 [1,0,0,0,0,0|2,0,0]=3 11 B6R0.4 C(CC(=O)O)CN CUR-0010241 [1,0,0,0,0,0|2,0,0]=3 12 B6R0.4 C(CNC(=O)N)N CUR-0013187 [1,0,0,0,0,0|3,0,0]=4 13 B6R0.4 C=CCCC(=O)O CUR-0101586 [1,0,0,0,0,0|1,0,2]=4 14 B6R0.4 CC(=O)CCCCl CUR-0004280 [1,0,0,0,0,0|1,0,0]=2 15 B6R0.4 CCCCC(=O)C CUR-0101595 [1,0,0,0,0,0|0,0,0]=1 16 B6R0.4 CCCCC(=O)Cl CUR-0101805 [1,0,0,0,0,0|1,0,0]=2 17 B6R0.4 CCCCC(=O)O CUR-0101620 [1,0,0,0,0,0|1,0,0]=2 18 B6R0.4 CCOCC(=O)O CUR-0101637 [1,0,0,0,0,0|2,0,0]=3 19 B6R0.4 CN(C)CCCN CUR-0101628 [1,0,0,0,0,0|3,0,0]=4 20 B6R0.4 CN(C)CCCO CUR-0020324 [1,0,0,0,0,0|3,0,0]=4 21 B6R0.4 COCCC(=O)O CUR-0012995 [1,0,0,0,0,0|2,0,0]=3 22 B6R0.6 C(CC=O)CC=O CUR-0101590 [1,0,0,0,0,0|1,0,1]=3 23 B6R0.6 C(CCBr)CCBr CUR-0024921 [1,0,0,0,0,0|2,0,1]=4 24 B6R0.6 C(CCCl)CC#N CUR-0016906 [1,0,0,0,0,0|2,0,1]=4 25 B6R0.6 C(CCCl)CCBr CUR-0005784 [1,0,0,0,0,0|2,0,1]=4 26 B6R0.6 C(CCO)CCO CUR-0010266 [1,0,0,0,0,0|1,0,2]=4 27 B6R0.6 CCCCCCBr CUR-0023541 [1,0,0,0,0,0|1,0,1]=3 28 B6R0.6 CCCCCCC CUR-0101599 [1,0,0,0,0,0|0,0,1]=2 29 B6R0.6 CCCCCCI CUR-0008970 [1,0,0,0,0,0|1,0,1]=3 30 B6R0.6 CCCCCCN CUR-0100774 [1,0,0,0,0,0|1,0,1]=3 31 B6R0.6 CCCCCCO CUR-0025713 [1,0,0,0,0,0|0,0,2]=3 32 B6R0.6 CCCCNCC CUR-0101609 [1,0,0,0,0,0|1,0,1]=3 33 B6R0.6 CCCCOC=C CUR-0002040 [1,0,0,0,0,0|1,0,1]=3 34 B6R0.6 CCCNCCC CUR-0008343 [1,0,0,0,0,0|1,0,1]=3 35 B6R0.6 CCNCCC#N CUR-0021027 [1,0,0,0,0,0|2,0,1]=4 36 B6R0.6 CCOCCCN CUR-0101632 [1,0,0,0,0,0|2,0,1]=4 37 B6R0.6 CNCCCC#C CUR-0122249 [1,0,0,0,0,0|1,0,2]=4 38 B6R0.6 CNCCCCN CUR-0156103 [1,0,0,0,0,0|2,0,0]=3 39 B6R0.6 COCCN=C=O CUR-0101602 [1,0,0,0,0,0|2,0,1]=4 40 B8R0.5 CC(CC(CCO)O)O CUR-0003071 [0,1,0,0,0,0|1,0,2]=4 41 B8R0.5 CCOC(=O)CC(=O)C CUR-0003002 [0,1,0,0,0,0|1,0,1]=3 42 B8R0.5 CCOC(=O)CC(=O)O CUR-0100749 [0,1,0,0,0,0|2,0,1]=4 43 B8R0.5 CCOC(=O)CC(=O)[O-] CUR-0102852 [0,1,0,0,0,0|2,0,1]=4 44 B8R0.6 COCCNC(=O)CCl CUR-0099538 [0,1,0,0,0,0|2,0,0]=3 45 B8R0.6 COCCNC(=O)CN CUR-0026714 [0,1,0,0,0,0|2,0,0]=3 46 B8R0.7 C(CCC(=O)O)CCBr CUR-0101245 [0,1,0,0,0,0|1,0,0]=2 47 B8R0.7 C(CCC(=O)O)CCN CUR-0025350 [0,1,0,0,0,0|1,0,0]=2 48 B8R0.7 C(CCC(=O)O)CCN CUR-0101191 [0,1,0,0,0,0|1,0,0]=2 49 B8R0.7 C(CCC(=O)[O-])CCN CUR-0024211 [0,1,0,0,0,0|1,0,0]=2 50 B8R0.7 C(CCNC(=O)N)CN CUR-0085699 [0,1,0,0,0,0|2,0,0]=3 51 B8R0.7 C(CNCC(=O)O)C#N CUR-0008959 [0,1,0,0,0,0|2,0,1]=4 52 B8R0.7 CC(=O)OCCCCCl CUR-0102385 [0,1,0,0,0,0|1,0,0]=2 53 B8R0.7 CCCCCCC(=O)O CUR-0013258 [0,1,0,0,0,0|1,0,0]=2 54 B8R0.8 C(C[C@@H](C(=O)O)N)CN CUR-0101406 [0,1,0,0,0,0|2,0,0]=3 55 B8R0.8 CCCCC(C(=O)O)Br CUR-0103355 [0,1,0,0,0,0|1,0,0]=2 56 B8R0.8 CCCCC(C(=O)O)N CUR-0009588 [0,1,0,0,0,0|1,0,0]=2 57 B8R0.8 CSCCC(C(=O)O)N CUR-0020132 [0,1,0,0,0,0|2,0,0]=3 58 B8R0.8 CSCC[C@@H](C(=O)O)N CUR-0122285 [0,1,0,0,0,0|2,0,0]=3 59 B8R0.9 COC(=O)CCC(=O)Cl CUR-0001082 [0,1,0,0,0,0|2,0,1]=4 60 B8R0.9 COC(=O)CCC(=O)O CUR-0027389 [0,1,0,0,0,0|2,0,1]=4 61 B8R0.21 C(CCI)CS(=O)(=O)[O-] CUR-0100095 [0,1,0,0,0,0|3,0,0]=4 62 B8R0.21 CNCCNS(=O)(=O)C CUR-0016064 [0,1,0,0,0,0|3,0,0]=4 63 B8R0.21 CS(=O)(=O)NCCCBr CUR-0008330 [0,1,0,0,0,0|3,0,0]=4 64 B8R0.28 C(CC(=O)O)CC(=O)O CUR-0012316 [0,1,0,0,0,0|2,0,1]=4 65 B8R0.28 CC(C)CNCC(C)C CUR-0100841 [0,1,0,0,0,0|2,0,1]=4 66 B8R0.28 CC(CNCC(C)O)O CUR-0102020 [0,1,0,0,0,0|1,0,2]=4 67 B8R1.1 C1C(CNC1=O)CBr CUR-0022348 [0,0,0,1,0,0|2,0,0]=3 68 B8R1.1 C1C(CNC1=O)CN CUR-0046714 [0,0,0,1,0,0|2,0,0]=3 69 B8R1.1 C1C(CNC1=O)CO CUR-0098527 [0,0,0,1,0,0|2,0,0]=3 70 B8R1.1 C1CC(=O)NC1CN CUR-0094491 [0,0,0,1,0,0|2,0,0]=3 71 B8R1.1 C1CC(=O)NC1CO CUR-0028114 [0,0,0,1,0,0|2,0,0]=3 72 B8R1.1 CNC1CC(=O)NC1 CUR-0011593 [0,0,0,1,0,0|2,0,0]=3 73 B8R1.4 C1CC(=O)CC(=O)C1 CUR-0019886 [0,0,0,1,0,0|1,0,1]=3 74 B8R1.4 C1CC(=O)OC(=O)C1 CUR-0009916 [0,0,0,1,0,0|2,0,1]=4 75 B8R1.4 CC1CC(CNC1)C CUR-0101710 [0,0,0,1,0,0|2,0,1]=4 76 B8R1.4 CC1CCCC(=O)C1 CUR-0101702 [0,0,0,1,0,0|0,0,0]=1 77 B8R1.4 CC1CCCC(C1)O CUR-0017679 [0,0,0,1,0,0|0,0,2]=3 78 B8R1.4 CC1CCCC(N1)C CUR-0101708 [0,0,0,1,0,0|1,0,1]=3 79 B8R1.4 CC1CNCC(O1)C CUR-0023957 [0,0,0,1,0,0|1,0,2]=4 80 B8R1.4 CC1COCC(N1)C CUR-0013452 [0,0,0,1,0,0|2,0,1]=4 81 B8R1.4 C[C@@H]1CCC[C@@H](N1)C CUR-0100904 [0,0,0,1,0,0|1,0,1]=3 82 B8R1.4 C[C@@H]1CNC[C@@H](O1)C CUR-0101741 [0,0,0,1,0,0|1,0,2]=4 83 B8R1.7 C1C=CCC1C(=O)O CUR-0017055 [0,0,0,1,0,0|1,0,2]=4 84 B8R1.7 C1CC(NC1)C(=O)O CUR-0028986 [0,0,0,1,0,0|2,0,0]=3 85 B8R1.7 C1CC(OC1)C(=O)O CUR-0016168 [0,0,0,1,0,0|2,0,0]=3 86 B8R1.7 C1CCC(C1)C(=O)O CUR-0019739 [0,0,0,1,0,0|1,0,0]=2 87 B8R1.7 C1CCN(C1)C(=N)N CUR-0006505 [0,0,0,1,0,0|3,0,0]=4 88 B8R1.7 C1CNCC1C(=O)N CUR-0028604 [0,0,0,1,0,0|2,0,0]=3 89 B8R1.7 C1COCC1C(=N)N CUR-0165397 [0,0,0,1,0,0|3,0,0]=4 90 B8R1.7 C1COCC1C(=O)O CUR-0024198 [0,0,0,1,0,0|2,0,0]=3 91 B8R1.7 C1CSC(S1)C(=O)O CUR-0011824 [0,0,0,1,0,0|3,0,0]=4 92 B8R1.7 C1C[C@@H](NC1)C(=O)O CUR-0100756 [0,0,0,1,0,0|2,0,0]=3 93 B8R1.7 C1C[C@H](NC1)C(=O)N CUR-0101723 [0,0,0,1,0,0|2,0,0]=3 94 B8R1.7 C1C[C@H](NC1)C(=O)O CUR-0101268 [0,0,0,1,0,0|2,0,0]=3 95 B8R1.7 C1[C@H](NCS1)C(=O)O CUR-0102015 [0,0,0,1,0,0|3,0,0]=4 96 B8R1.7 CC(C)C1CCNC1 CUR-0011983 [0,0,0,1,0,0|2,0,1]=4 97 B8R1.19 CC1(CCCC1O)C CUR-0056939 [0,0,0,1,0,0|2,0,1]=4 98 B8R1.22 C1CC(=O)CCNC1 CUR-0099157 [0,0,0,1,0,0|1,0,0]=2 99 B8R1.22 C1CCC(=O)NCC1 CUR-0022015 [0,0,0,1,0,0|1,0,0]=2 100 B8R1.22 C1CCC(=O)OCC1 CUR-0101418 [0,0,0,1,0,0|1,0,0]=2 101 B8R1.22 C1CCCC(=O)CC1 CUR-0004176 [0,0,0,1,0,0|0,0,0]=1 102 B8R1.22 C1CCCC(CC1)N CUR-0011742 [0,0,0,1,0,0|1,0,1]=3 103 B8R1.22 C1CNCCNC1=O CUR-0003886 [0,0,0,1,0,0|2,0,0]=3 104 B8R1.22 CN1CCCNCC1 CUR-0101729 [0,0,0,1,0,0|3,0,0]=4 105 B5R0.1 C(CBr)C(=O)O CUR-0102453 [2,0,0,0,0,0|2,0,0]=4 106 B5R0.1 C(CCl)C(=O)Cl CUR-0009101 [2,0,0,0,0,0|2,0,0]=4 107 B5R0.1 C(CCl)C(=O)O CUR-0008480 [2,0,0,0,0,0|2,0,0]=4 108 B5R0.1 C(CN)C(=O)O CUR-0006907 [2,0,0,0,0,0|2,0,0]=4 109 B5R0.1 C(CN)C(=O)[O-] CUR-0101293 [2,0,0,0,0,0|2,0,0]=4 110 B5R0.1 C(CS)C(=O)O CUR-0101651 [2,0,0,0,0,0|2,0,0]=4 111 B5R0.1 CC(=O)COC CUR-0101516 [2,0,0,0,0,0|1,0,0]=3 112 B5R0.1 CCCC(=O)C CUR-0026599 [2,0,0,0,0,0|0,0,0]=2 113 B5R0.1 CCCC(=O)Cl CUR-0020308 [2,0,0,0,0,0|1,0,0]=3 114 B5R0.1 CCCC(=O)O CUR-0020198 [2,0,0,0,0,0|1,0,0]=3 115 B5R0.1 CCCC(C)O CUR-0023615 [2,0,0,0,0,0|0,0,2]=4 116 B5R0.1 CCC[N+](=O)[O-] CUR-0101527 [2,0,0,0,0,0|2,0,0]=4 117 B5R0.1 CCOC(=O)C CUR-0101519 [2,0,0,0,0,0|1,0,0]=3 118 B5R0.1 CCOC(=O)Cl CUR-0026181 [2,0,0,0,0,0|2,0,0]=4 119 B5R0.1 CCOC(=O)N CUR-0100824 [2,0,0,0,0,0|2,0,0]=4 120 B5R0.1 CNCC(=O)O CUR-0018005 [2,0,0,0,0,0|2,0,0]=4 121 B5R0.1 COCC(=O)Cl CUR-0101665 [2,0,0,0,0,0|2,0,0]=4 122 B5R0.1 COCC(=O)O CUR-0014449 [2,0,0,0,0,0|2,0,0]=4 123 B5R0.1 CSCC(=O)O CUR-0025987 [2,0,0,0,0,0|2,0,0]=4 124 B5R0.2 C(CCBr)CBr CUR-0026189 [2,0,0,0,0,0|2,0,0]=4 125 B5R0.2 C(CCBr)CCl CUR-0000065 [2,0,0,0,0,0|2,0,0]=4 126 B5R0.2 C(CCCl)CO CUR-0025105 [2,0,0,0,0,0|1,0,1]=4 127 B5R0.2 C(CCN)CN CUR-0016745 [2,0,0,0,0,0|2,0,0]=4 128 B5R0.2 C(CCO)CO CUR-0024794 [2,0,0,0,0,0|1,0,1]=4 129 B5R0.2 C(CCS)CN CUR-0119579 [2,0,0,0,0,0|1,1,0]=4 130 B5R0.2 C=CCCCN CUR-0089890 [2,0,0,0,0,0|1,0,1]=4 131 B5R0.2 CCCCC#N CUR-0002776 [2,0,0,0,0,0|1,0,1]=4 132 B5R0.2 CCCCC=O CUR-0020580 [2,0,0,0,0,0|0,0,0]=2 133 B5R0.2 CCCCCBr CUR-0020920 [2,0,0,0,0,0|1,0,0]=3 134 B5R0.2 CCCCCI CUR-0007389 [2,0,0,0,0,0|1,0,0]=3 135 B5R0.2 CCCCCN CUR-0101510 [2,0,0,0,0,0|1,0,0]=3 136 B5R0.2 CCCCCO CUR-0018736 [2,0,0,0,0,0|0,0,1]=3 137 B5R0.2 CCCCNC CUR-0101509 [2,0,0,0,0,0|1,0,0]=3 138 B5R0.2 CCCN=C=O CUR-0101493 [2,0,0,0,0,0|1,0,1]=4 139 B5R0.2 CCNCCCl CUR-0137711 [2,0,0,0,0,0|2,0,0]=4 140 B5R0.2 CCNCCO CUR-0101534 [2,0,0,0,0,0|1,0,1]=4 141 B5R0.2 CCOCCBr CUR-0026041 [2,0,0,0,0,0|2,0,0]=4 142 B5R0.2 CCOCCO CUR-0010841 [2,0,0,0,0,0|1,0,1]=4 143 B5R0.2 CCO\C=C\C CUR-0101289 [2,0,0,0,0,0|1,0,1]=4 144 B5R0.2 CNCCCN CUR-0101524 [2,0,0,0,0,0|2,0,0]=4 145 B5R0.2 CNCCNC CUR-0001888 [2,0,0,0,0,0|2,0,0]=4 146 B5R0.2 CNCCOC CUR-0101531 [2,0,0,0,0,0|2,0,0]=4 147 B5R0.2 COCCCN CUR-0101530 [2,0,0,0,0,0|2,0,0]=4 148 B5R0.2 COCCOC CUR-0026380 [2,0,0,0,0,0|2,0,0]=4 149 B7R0.2 CC(=O)CC(=O)OC CUR-0018522 [1,1,0,0,0,0|1,0,1]=4 150 B7R0.2 CCC(C)CC(=O)O CUR-0101758 [1,1,0,0,0,0|1,0,0]=3 151 B7R0.3 CCCNC(=O)CCl CUR-0099537 [1,1,0,0,0,0|1,0,0]=3 152 B7R0.3 CCCOC(=O)CCl CUR-0101322 [1,1,0,0,0,0|1,0,0]=3 153 B7R0.3 CNC(=O)OCCO CUR-0053764 [1,1,0,0,0,0|2,0,0]=4 154 B7R0.3 COC(=O)CCCN CUR-0008398 [1,1,0,0,0,0|1,0,0]=3 155 B7R0.3 COCCC(=O)OC CUR-0101774 [1,1,0,0,0,0|1,0,0]=3 156 B7R0.5 C(CO)C(C(=O)O)N CUR-0009208 [1,1,0,0,0,0|2,0,0]=4 157 B7R0.5 CCCC(C(=O)O)Br CUR-0020650 [1,1,0,0,0,0|1,0,0]=3 158 B7R0.5 CCCC(C)C(C)N CUR-0034233 [1,1,0,0,0,0|1,0,1]=4 159 B7R0.5 CCOC(=O)C(=O)C CUR-0021376 [1,1,0,0,0,0|1,0,1]=4 160 B7R0.6 CC(=O)CCC(=O)C CUR-0022649 [1,1,0,0,0,0|0,0,1]=3 161 B7R0.6 CC(=O)CCC(=O)O CUR-0012941 [1,1,0,0,0,0|1,0,1]=4 162 B7R0.6 CC(C)COC(=O)Cl CUR-0020162 [1,1,0,0,0,0|2,0,0]=4 163 B7R0.8 CCCCS(=O)(=O)Cl CUR-0102553 [1,1,0,0,0,0|2,0,0]=4 164 B7R0.8 CS(=O)(=O)CCCBr CUR-0028536 [1,1,0,0,0,0|2,0,0]=4 165 B7R0.1 C(CCCBr)CCBr CUR-0100760 [1,1,0,0,0,0|1,0,1]=4 166 B7R0.1 C(CCCCl)CCO CUR-0102083 [1,1,0,0,0,0|0,0,2]=4 167 B7R0.1 C(CCCN)CCN CUR-0022953 [1,1,0,0,0,0|1,0,1]=4 168 B7R0.1 C(CCCO)CCN CUR-0101772 [1,1,0,0,0,0|0,0,2]=4 169 B7R0.1 CCCCCCC=O CUR-0101726 [1,1,0,0,0,0|0,0,0]=2 170 B7R0.1 CCCCCCCBr CUR-0012025 [1,1,0,0,0,0|0,0,1]=3 171 B7R0.1 CCCCCCCC CUR-0101732 [1,1,0,0,0,0|0,0,1]=3 172 B7R0.1 CCCCCCCI CUR-0002481 [1,1,0,0,0,0|0,0,1]=3 173 B7R0.1 CCCCCCCO CUR-0012442 [1,1,0,0,0,0|0,0,1]=3 174 B7R0.1 CCNCCNCC CUR-0019308 [1,1,0,0,0,0|1,0,1]=4 175 B7R0.7 COCC(CCO)N CUR-0020087 [1,1,0,0,0,0|2,0,0]=4 176 B7R0.7 CSCC(CCO)N CUR-0018604 [1,1,0,0,0,0|2,0,0]=4 177 B9R0.6 CCOC(=O)C(C(=O)C)Cl CUR-0102734 [0,2,0,0,0,0|1,0,1]=4 178 B9R0.6 CCOC(=O)C(C)C(=O)C CUR-0101061 [0,2,0,0,0,0|1,0,1]=4 179 B9R0.34 CC(COC)NC(=O)CCl CUR-0101284 [0,2,0,0,0,0|2,0,0]=4 180 B9R0.34 CCC(=O)CC(=O)OCC CUR-0101401 [0,2,0,0,0,0|1,0,1]=4 181 B9R0.34 CCCC(=O)CC(=O)OC CUR-0101393 [0,2,0,0,0,0|0,0,1]=3 182 B9R0.34 CCOC(=O)CC(=O)CCl CUR-0025786 [0,2,0,0,0,0|1,0,1]=4 183 B9R0.34 COCC(=O)CC(=O)OC CUR-0102272 [0,2,0,0,0,0|1,0,1]=4 184 B9R0.1 COC(=O)CCCC(=O)Cl CUR-0102733 [0,2,0,0,0,0|1,0,1]=4 185 B9R0.5 CCCCOC(=O)CCS CUR-0102668 [0,2,0,0,0,0|1,0,0]=3 186 B9R0.8 COC(=O)C(CCCN)N CUR-0026167 [0,2,0,0,0,0|1,0,0]=3 187 B9R0.24 COC(=O)CCC(=O)OC CUR-0101321 [0,2,0,0,0,0|1,0,1]=4 188 B9R0.47 C(CCN)CC(C(=O)O)N CUR-0012942 [0,2,0,0,0,0|1,0,0]=3 189 B9R0.47 C(CCN)C[C@H](C(=O)O)N CUR-0103129 [0,2,0,0,0,0|1,0,0]=3 190 B9R0.48 CCCC(=O)NCC(=O)N CUR-0016986 [0,2,0,0,0,0|1,0,1]=4 191 B9R0.48 CCCC(=O)NCC(=O)O CUR-0005830 [0,2,0,0,0,0|1,0,1]=4 192 B9R0.48 CCOC(=O)CCC(=O)C CUR-0102227 [0,2,0,0,0,0|0,0,1]=3 193 B9R0.48 CCOC(=O)CCC(=O)Cl CUR-0015518 [0,2,0,0,0,0|1,0,1]=4 194 B9R0.55 C(CCC(=O)O)CC(=O)O CUR-0025315 [0,2,0,0,0,0|1,0,1]=4 195 B9R0.13 CCCCC(CC)C(=O)O CUR-0102235 [0,2,0,0,0,0|1,0,0]=3 196 B9R0.56 CC(=O)OCC[N+](C)(C)C CUR-0104003 [0,2,0,0,0,0|2,0,0]=4 197 B7R1.2 C1C(CNC1=O)N CUR-0087034 [1,0,0,1,0,0|2,0,0]=4 198 B7R1.2 C1CC(=O)CC1=O CUR-0010695 [1,0,0,1,0,0|1,0,1]=4 199 B7R1.2 CC1CCC(=O)N1 CUR-0016557 [1,0,0,1,0,0|1,0,0]=3 200 B7R1.2 CC1CCC(=O)O1 CUR-0101591 [1,0,0,1,0,0|1,0,0]=3 201 B7R1.2 CC1COC(=O)O1 CUR-0101613 [1,0,0,1,0,0|2,0,0]=4 202 B7R1.3 C1CC=CC(=O)C1 CUR-0002304 [1,0,0,1,0,0|0,0,2]=4 203 B7R1.3 C1CCC(=O)CC1 CUR-0013382 [1,0,0,1,0,0|0,0,0]=2 204 B7R1.3 C1CCC(CC1)Br CUR-0027491 [1,0,0,1,0,0|1,0,1]=4 205 B7R1.3 C1CCC(CC1)N CUR-0004167 [1,0,0,1,0,0|1,0,1]=4 206 B7R1.3 C1CCC(CC1)O CUR-0020069 [1,0,0,1,0,0|0,0,2]=4 207 B7R1.3 C1CCNC(=O)C1 CUR-0002331 [1,0,0,1,0,0|1,0,0]=3 208 B7R1.3 C1CNC(=O)CN1 CUR-0101593 [1,0,0,1,0,0|2,0,0]=4 209 B7R1.3 C1CNCCC1=O CUR-0009294 [1,0,0,1,0,0|1,0,0]=3 210 B7R1.3 C1CNCCC1=O CUR-0102475 [1,0,0,1,0,0|1,0,0]=3 211 B7R1.3 C1COCC(=O)N1 CUR-0014967 [1,0,0,1,0,0|2,0,0]=4 212 B7R1.3 C1COCCC1=O CUR-0001478 [1,0,0,1,0,0|1,0,0]=3 213 B7R1.3 C1CSCC(=O)N1 CUR-0095816 [1,0,0,1,0,0|2,0,0]=4 214 B7R1.3 C1CSCCC1=O CUR-0005576 [1,0,0,1,0,0|1,0,0]=3 215 B7R1.3 CC1CCCCN1 CUR-0101581 [1,0,0,1,0,0|1,0,1]=4 216 B7R1.12 CC1CC1C(=O)O CUR-0100917 [1,0,0,1,0,0|1,0,0]=3 217 B7R1.14 C1CCS(=O)(=O)C1 CUR-0001027 [1,0,0,1,0,0|2,0,0]=4 218 B7R1.18 C1C(CN1)C(=O)O CUR-0009104 [1,0,0,1,0,0|2,0,0]=4 219 B7R1.18 C1CC(C1)C(=O)Cl CUR-0016394 [1,0,0,1,0,0|1,0,0]=3 220 B7R1.18 C1CC(C1)C(=O)O CUR-0009068 [1,0,0,1,0,0|1,0,0]=3 221 B7R1.18 C1CNC1C(=O)O CUR-0081896 [1,0,0,1,0,0|2,0,0]=4 222 B7R1.20 C1CC1CC(=O)O CUR-0101588 [1,0,0,1,0,0|1,0,0]=3 223 B7R1.1 C1CCC(C1)C#N CUR-0101264 [1,0,0,1,0,0|1,0,1]=4 224 B7R1.1 C1CCC(C1)CBr CUR-0005007 [1,0,0,1,0,0|1,0,1]=4 225 B7R1.1 C1CCC(C1)CN CUR-0013562 [1,0,0,1,0,0|1,0,1]=4 226 B7R1.1 C1CCC(C1)CO CUR-0114427 [1,0,0,1,0,0|0,0,2]=4 227 B7R1.1 C1CCC(C1)NN CUR-0100745 [1,0,0,1,0,0|2,0,0]=4 228 B7R1.1 C1CCN(C1)C=O CUR-0050422 [1,0,0,1,0,0|1,0,0]=3 229 B7R1.1 C1CNCC1CF CUR-0122530 [1,0,0,1,0,0|2,0,0]=4 230 B7R1.1 C1COCC1C=O CUR-0082585 [1,0,0,1,0,0|1,0,0]=3 231 B7R1.1 C1COCC1CBr CUR-0003563 [1,0,0,1,0,0|2,0,0]=4 232 B7R1.1 C1COCC1CI CUR-0015713 [1,0,0,1,0,0|2,0,0]=4 233 B7R1.1 C1COCC1CN CUR-0021455 [1,0,0,1,0,0|2,0,0]=4 234 B7R1.1 C1COCC1CO CUR-0101139 [1,0,0,1,0,0|2,0,0]=4 235 B7R1.1 CNC1CCCC1 CUR-0011121 [1,0,0,1,0,0|1,0,0]=3 236 B7R1.1 CNC1CCOC1 CUR-0020484 [1,0,0,1,0,0|2,0,0]=4 237 B7R1.1 CSC1CCNC1 CUR-0121753 [1,0,0,1,0,0|2,0,0]=4 238 B7R1.4 C1CC(=O)C(=O)C1 CUR-0061064 [1,0,0,1,0,0|1,0,1]=4 239 B7R1.4 C1CC(=O)N(C1)N CUR-0099031 [1,0,0,1,0,0|2,0,0]=4 240 B7R1.4 C1CNC(=O)C1Br CUR-0004832 [1,0,0,1,0,0|2,0,0]=4 241 B7R1.4 C1COC(=O)C1Br CUR-0012154 [1,0,0,1,0,0|2,0,0]=4 242 B7R1.4 C1CSC(=O)C1N CUR-0025625 [1,0,0,1,0,0|2,0,0]=4 243 B7R1.4 CN1CCCC1=O CUR-0101576 [1,0,0,1,0,0|1,0,0]=3 244 B7R1.6 C1CC(C1)N=C=O CUR-0004501 [1,0,0,1,0,0|1,0,1]=4 245 B7R1.6 CCNC1CCC1 CUR-0028770 [1,0,0,1,0,0|1,0,1]=4 246 B7R1.24 C1CCCNCC1 CUR-0020867 [1,0,0,1,0,0|1,0,0]=3 247 B7R1.24 C1CNCCNC1 CUR-0010052 [1,0,0,1,0,0|2,0,0]=4 248 B7R1.24 C1CNCCOC1 CUR-0101276 [1,0,0,1,0,0|2,0,0]=4 249 B9R1.13 C1CC(C=C1)CC(=O)O CUR-0025563 [0,1,0,1,0,0|1,0,1]=4 250 B9R1.13 C1CC(OC1)CC(=O)Cl CUR-0122270 [0,1,0,1,0,0|1,0,0]=3 251 B9R1.13 C1CCC(C1)CC(=O)O CUR-0016408 [0,1,0,1,0,0|1,0,0]=3 252 B9R1.13 C1CCC(C1)OC(=O)Cl CUR-0060441 [0,1,0,1,0,0|1,0,0]=3 253 B9R1.13 C1COCC1OC(=O)Cl CUR-0060787 [0,1,0,1,0,0|2,0,0]=4 254 B9R1.41 CC(=O)C1CCCC1=O CUR-0009408 [0,1,0,1,0,0|0,0,1]=3 255 B9R1.41 CC(=O)C1CCOC1=O CUR-0101917 [0,1,0,1,0,0|1,0,1]=4 256 B9R1.41 CC1CCCC1C(=O)O CUR-0018388 [0,1,0,1,0,0|1,0,0]=3 257 B9R1.53 C1C(CC1=O)CC(=O)O CUR-0138479 [0,1,0,1,0,0|1,0,1]=4 258 B9R1.66 C1CC(CS(=O)(=O)C1)N CUR-0010433 [0,1,0,1,0,0|2,0,0]=4 259 B9R1.1 C1CC(=O)NCC1CBr CUR-0018111 [0,1,0,1,0,0|1,0,0]=3 260 B9R1.1 CCN1CCC(=O)CC1 CUR-0019617 [0,1,0,1,0,0|1,0,0]=3 261 B9R1.2 CC1CCCC(C1)C#N CUR-0025237 [0,1,0,1,0,0|1,0,1]=4 262 B9R1.2 CC1CCCC(C1)NN CUR-0019479 [0,1,0,1,0,0|1,0,1]=4 263 B9R1.2 CCN1CCCC(C1)O CUR-0101951 [0,1,0,1,0,0|0,0,2]=4 264 B9R1.3 C1CC(=O)C(C(=O)C1)Br CUR-0095813 [0,1,0,1,0,0|1,0,1]=4 265 B9R1.3 CC1CCCC(C1=O)C CUR-0022583 [0,1,0,1,0,0|0,0,1]=3 266 B9R1.5 C1CCNC(=O)C(C1)Br CUR-0028325 [0,1,0,1,0,0|1,0,0]=3 267 B9R1.5 CN1CCCCCC1=O CUR-0100979 [0,1,0,1,0,0|0,0,0]=2 268 B9R1.11 C#CC(=O)N1CCCC1 CUR-0066907 [0,1,0,1,0,0|1,0,1]=4 269 B9R1.11 C1CCC(C1)C(=O)CN CUR-0049317 [0,1,0,1,0,0|0,0,0]=2 270 B9R1.11 C1CCC(C1)\C(=N\O)\N CUR-0019322 [0,1,0,1,0,0|1,0,1]=4 271 B9R1.11 C1CCN(C1)C(=O)CCl CUR-0099533 [0,1,0,1,0,0|1,0,0]=3 272 B9R1.11 COC(=O)C1CC=CC1 CUR-0057577 [0,1,0,1,0,0|0,0,2]=4 273 B9R1.11 COC(=O)C1CCCN1 CUR-0014369 [0,1,0,1,0,0|1,0,0]=3 274 B9R1.50 C1CCCC(=O)CCC1 CUR-0101896 [0,1,0,1,0,0|0,0,0]=2 275 B9R1.50 C1CCCC(CCC1)N CUR-0014335 [0,1,0,1,0,0|1,0,1]=4 276 B9R1.80 C1CC1CNC(=O)CCl CUR-0002284 [0,1,0,1,0,0|1,0,0]=3 277 B9R1.80 COC(=O)CNC1CC1 CUR-0093886 [0,1,0,1,0,0|1,0,0]=3 278 B9R1.89 C1CCCC(CC1)NN CUR-0008319 [0,1,0,1,0,0|1,0,1]=4 279 B9R1.89 COC1=NCCCCC1 CUR-0101200 [0,1,0,1,0,0|1,0,0]=3 280 B9R1.118 C1CCC(CC1)(CBr)O CUR-0059710 [0,1,0,1,0,0|0,0,2]=4 281 B9R1.132 CN1C(CCC1=O)CBr CUR-0010107 [0,1,0,1,0,0|1,0,0]=3 282 B9R1.132 CNC1CCN(C1=O)C CUR-0015396 [0,1,0,1,0,0|2,0,0]=4 283 B9R1.6 C1CC(CC=C1)C(=O)O CUR-0023113 [0,1,0,1,0,0|1,0,1]=4 284 B9R1.6 C1CC(CNC1)C(=O)N CUR-0027787 [0,1,0,1,0,0|1,0,0]=3 285 B9R1.6 C1CC(CNC1)C(=O)O CUR-0002813 [0,1,0,1,0,0|1,0,0]=3 286 B9R1.6 C1CC(COC1)C(=O)O CUR-0008785 [0,1,0,1,0,0|1,0,0]=3 287 B9R1.6 C1CCC(CC1)C(=O)Cl CUR-0025798 [0,1,0,1,0,0|1,0,0]=3 288 B9R1.6 C1CCC(CC1)C(=O)O CUR-0026401 [0,1,0,1,0,0|1,0,0]=3 289 B9R1.6 C1CCNC(C1)C(=O)N CUR-0019045 [0,1,0,1,0,0|1,0,0]=3 290 B9R1.6 C1CCNC(C1)C(=O)O CUR-0009302 [0,1,0,1,0,0|1,0,0]=3 291 B9R1.6 C1CNC(CN1)C(=O)O CUR-0012594 [0,1,0,1,0,0|2,0,0]=4 292 B9R1.6 C1CNC(CN1)C(=O)O CUR-0081904 [0,1,0,1,0,0|2,0,0]=4 293 B9R1.6 C1CNCCC1C(=O)N CUR-0025199 [0,1,0,1,0,0|1,0,0]=3 294 B9R1.6 C1CNCCC1C(=O)N CUR-0101274 [0,1,0,1,0,0|1,0,0]=3 295 B9R1.6 C1CNCCC1C(=O)O CUR-0003276 [0,1,0,1,0,0|1,0,0]=3 296 B9R1.6 C1COC(CN1)C(=O)N CUR-0006229 [0,1,0,1,0,0|2,0,0]=4 297 B9R1.6 C1COC(CO1)C(=O)O CUR-0028470 [0,1,0,1,0,0|2,0,0]=4 298 B9R1.6 C1COCCC1C(=O)N CUR-0018286 [0,1,0,1,0,0|1,0,0]=3 299 B9R1.6 C1COCCC1C(=O)O CUR-0016356 [0,1,0,1,0,0|1,0,0]=3 300 B9R1.6 C1COCCN1C(=O)Cl CUR-0102341 [0,1,0,1,0,0|2,0,0]=4 301 B9R1.6 CC(=O)C1CCCCN1 CUR-0096516 [0,1,0,1,0,0|0,0,0]=2 302 B9R1.6 CC(=O)N1CCNCC1 CUR-0101926 [0,1,0,1,0,0|1,0,0]=3 303 B9R1.6 CC(C)C1CCCNC1 CUR-0018228 [0,1,0,1,0,0|1,0,1]=4 304 B9R1.6 CN(C)C1CCCCC1 CUR-0101906 [0,1,0,1,0,0|2,0,0]=4 305 B9R1.6 CN(C)C1CCNCC1 CUR-0006252 [0,1,0,1,0,0|2,0,0]=4 306 B9R1.6 CN(C)C1CCNCC1 CUR-0101330 [0,1,0,1,0,0|2,0,0]=4 307 B9R1.148 C1CNCCS(=O)(=O)C1 CUR-0026858 [0,1,0,1,0,0|2,0,0]=4 308 B9R1.23 CN1CC(CC1=O)CBr CUR-0016550 [0,1,0,1,0,0|2,0,0]=4 309 B9R1.23 CN1CC(CC1=O)CN CUR-0046623 [0,1,0,1,0,0|2,0,0]=4 310 B9R1.23 CN1CC(CC1=O)CN CUR-0120523 [0,1,0,1,0,0|2,0,0]=4 311 B9R1.35 C1C(CNC1C(=O)O)O CUR-0100797 [0,1,0,1,0,0|2,0,0]=4 312 B9R1.35 C1[C@@H](CN[C@@H]1C(=O)O)O CUR-0003674 [0,1,0,1,0,0|2,0,0]=4 313 B9R1.35 C1[C@H](CN[C@@H]1C(=O)O)O CUR-0013245 [0,1,0,1,0,0|2,0,0]=4 314 B9R1.35 CC(C)C1CC(=O)NC1 CUR-0098576 [0,1,0,1,0,0|1,0,0]=3 315 B9R1.35 CC(C)C1COC(=O)N1 CUR-0050365 [0,1,0,1,0,0|2,0,0]=4 316 B9R1.10 C1CS(=O)(=O)CCC1N CUR-0101270 [0,1,0,1,0,0|2,0,0]=4 317 B9R1.133 C1CS(=O)(=O)CC1CN CUR-0020768 [0,1,0,1,0,0|2,0,0]=4 318 B9R1.133 C1CS(=O)(=O)CC1CN CUR-0091150 [0,1,0,1,0,0|2,0,0]=4 319 B9R1.133 CNC1CCS(=O)(=O)C1 CUR-0011580 [0,1,0,1,0,0|2,0,0]=4 320 B9R1.133 CNC1CCS(=O)(=O)C1 CUR-0100591 [0,1,0,1,0,0|2,0,0]=4 321 B9R1.19 CS(=O)(=O)C1CCNC1 CUR-0100636 [0,1,0,1,0,0|2,0,0]=4 322 B9R1.114 C1CC(C1)CS(=O)(=O)Cl CUR-0019377 [0,1,0,1,0,0|2,0,0]=4 323 B9R1.114 C1CC(C1)CS(=O)(=O)[O-] CUR-0100895 [0,1,0,1,0,0|2,0,0]=4 324 B9R2.39 C1C2CNC1C(=O)O2 CUR-0097987 [0,0,0,2,0,0|2,0,0]=4 325 B9R2.174 C1CCC2(CC1)CO2 CUR-0021975 [0,0,0,2,0,0|0,0,2]=4