0 B8R0.6 COCCNC(=O)CCl CUR-0099538 [0,0,0,0,0,0|3,0,0]=3 1 B8R0.6 COCCNC(=O)CN CUR-0026714 [0,0,0,0,0,0|3,0,0]=3 2 B7R0.1 C(CCCBr)CCBr CUR-0100760 [1,0,0,0,0,0|2,0,1]=4 3 B7R0.1 C(CCCCl)CCO CUR-0102083 [1,0,0,0,0,0|2,0,1]=4 4 B7R0.1 C(CCCN)CCN CUR-0022953 [1,0,0,0,0,0|2,0,1]=4 5 B7R0.1 C(CCCO)CCN CUR-0101772 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.1 CCCCCCC=O CUR-0101726 [1,0,0,0,0,0|1,0,2]=4 7 B7R0.1 CCCCCCCBr CUR-0012025 [1,0,0,0,0,0|1,0,1]=3 8 B7R0.1 CCCCCCCC CUR-0101732 [1,0,0,0,0,0|0,0,1]=2 9 B7R0.1 CCCCCCCI CUR-0002481 [1,0,0,0,0,0|1,0,1]=3 10 B7R0.1 CCCCCCCO CUR-0012442 [1,0,0,0,0,0|1,0,1]=3 11 B7R0.1 CCNCCNCC CUR-0019308 [1,0,0,0,0,0|2,0,0]=3 12 B7R0.3 CCCNC(=O)CCl CUR-0099537 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.3 CCCOC(=O)CCl CUR-0101322 [1,0,0,0,0,0|2,0,0]=3 14 B7R0.3 CNC(=O)OCCO CUR-0053764 [1,0,0,0,0,0|3,0,0]=4 15 B7R0.3 COC(=O)CCCN CUR-0008398 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.3 COCCC(=O)OC CUR-0101774 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.4 C(CCBr)CC(=O)O CUR-0103088 [1,0,0,0,0,0|2,0,0]=3 18 B7R0.4 C(CCN)CC(=O)O CUR-0018281 [1,0,0,0,0,0|2,0,0]=3 19 B7R0.4 CCCCNC(=O)N CUR-0101762 [1,0,0,0,0,0|2,0,0]=3 20 B7R0.4 CCCCOC(=O)C CUR-0026180 [1,0,0,0,0,0|1,0,0]=2 21 B9R0.1 COC(=O)CCCC(=O)Cl CUR-0102733 [0,1,0,0,0,0|2,0,1]=4 22 B9R0.5 CCCCOC(=O)CCS CUR-0102668 [0,1,0,0,0,0|1,0,0]=2 23 B9R0.5 CCO\C=C\C(=O)OCC CUR-0102229 [0,1,0,0,0,0|1,0,2]=4 24 B9R0.8 COC(=O)C(CCCN)N CUR-0026167 [0,1,0,0,0,0|2,0,0]=3 25 B9R0.24 COC(=O)CCC(=O)OC CUR-0101321 [0,1,0,0,0,0|2,0,1]=4 26 B9R0.34 CC(COC)NC(=O)CCl CUR-0101284 [0,1,0,0,0,0|3,0,0]=4 27 B9R0.34 CCC(=O)CC(=O)OCC CUR-0101401 [0,1,0,0,0,0|1,0,1]=3 28 B9R0.34 CCCC(=O)CC(=O)OC CUR-0101393 [0,1,0,0,0,0|1,0,1]=3 29 B9R0.34 CCOC(=O)CC(=O)CCl CUR-0025786 [0,1,0,0,0,0|2,0,1]=4 30 B9R0.34 COCC(=O)CC(=O)OC CUR-0102272 [0,1,0,0,0,0|2,0,1]=4 31 B9R1.1 C1CC(=O)NCC1CBr CUR-0018111 [0,0,0,1,0,0|2,0,0]=3 32 B9R1.1 CC1CCC(CC1)CN CUR-0005252 [0,0,0,1,0,0|2,0,1]=4 33 B9R1.1 CCN1CCC(=O)CC1 CUR-0019617 [0,0,0,1,0,0|1,0,0]=2 34 B9R1.1 CN1CCC(CC1)CCl CUR-0100711 [0,0,0,1,0,0|3,0,0]=4 35 B9R1.1 CN1CCC(CC1)CO CUR-0099022 [0,0,0,1,0,0|3,0,0]=4 36 B9R1.1 CNC1CCN(CC1)C CUR-0101929 [0,0,0,1,0,0|3,0,0]=4 37 B9R1.2 CCN1CCCC(C1)O CUR-0101951 [0,0,0,1,0,0|3,0,0]=4 38 B9R1.3 C1CC(=O)C(C(=O)C1)Br CUR-0095813 [0,0,0,1,0,0|2,0,1]=4 39 B9R1.5 C1CCNC(=O)C(C1)Br CUR-0028325 [0,0,0,1,0,0|2,0,0]=3 40 B9R1.5 CN1CCCCCC1=O CUR-0100979 [0,0,0,1,0,0|1,0,0]=2 41 B9R1.11 C#CC(=O)N1CCCC1 CUR-0066907 [0,0,0,1,0,0|1,0,2]=4 42 B9R1.11 C1CCC(C1)C(=O)CN CUR-0049317 [0,0,0,1,0,0|1,0,0]=2 43 B9R1.11 C1CCC(C1)\C(=N\O)\N CUR-0019322 [0,0,0,1,0,0|3,0,0]=4 44 B9R1.11 C1CCN(C1)C(=O)CCl CUR-0099533 [0,0,0,1,0,0|2,0,0]=3 45 B9R1.11 COC(=O)C1CC=CC1 CUR-0057577 [0,0,0,1,0,0|1,0,2]=4 46 B9R1.11 COC(=O)C1CCCN1 CUR-0014369 [0,0,0,1,0,0|2,0,0]=3 47 B9R1.50 C1CCCC(=O)CCC1 CUR-0101896 [0,0,0,1,0,0|0,0,0]=1 48 B9R1.50 C1CCCC(CCC1)N CUR-0014335 [0,0,0,1,0,0|1,0,1]=3 49 B9R1.80 C1CC1CNC(=O)CCl CUR-0002284 [0,0,0,1,0,0|2,0,0]=3 50 B9R1.80 COC(=O)CNC1CC1 CUR-0093886 [0,0,0,1,0,0|2,0,0]=3 51 B9R1.89 COC1=NCCCCC1 CUR-0101200 [0,0,0,1,0,0|2,0,0]=3 52 B9R1.118 C1CCC(CC1)(CBr)O CUR-0059710 [0,0,0,1,0,0|1,0,2]=4 53 B9R1.132 CN1C(CCC1=O)CBr CUR-0010107 [0,0,0,1,0,0|2,0,0]=3 54 B6R0.6 C(CC=O)CC=O CUR-0101590 [2,0,0,0,0,0|1,0,1]=4 55 B6R0.6 C(CCBr)CCBr CUR-0024921 [2,0,0,0,0,0|2,0,0]=4 56 B6R0.6 C(CCCl)CCBr CUR-0005784 [2,0,0,0,0,0|2,0,0]=4 57 B6R0.6 C(CCO)CCO CUR-0010266 [2,0,0,0,0,0|2,0,0]=4 58 B6R0.6 CCCCCCBr CUR-0023541 [2,0,0,0,0,0|1,0,0]=3 59 B6R0.6 CCCCCCC CUR-0101599 [2,0,0,0,0,0|0,0,0]=2 60 B6R0.6 CCCCCCI CUR-0008970 [2,0,0,0,0,0|1,0,0]=3 61 B6R0.6 CCCCCCN CUR-0100774 [2,0,0,0,0,0|1,0,0]=3 62 B6R0.6 CCCCCCO CUR-0025713 [2,0,0,0,0,0|1,0,0]=3 63 B6R0.6 CCCCNCC CUR-0101609 [2,0,0,0,0,0|1,0,0]=3 64 B6R0.6 CCCCOC=C CUR-0002040 [2,0,0,0,0,0|1,0,1]=4 65 B6R0.6 CCCNCCC CUR-0008343 [2,0,0,0,0,0|1,0,0]=3 66 B6R0.6 CCOCCCN CUR-0101632 [2,0,0,0,0,0|2,0,0]=4 67 B6R0.6 CC\C=C\CCO CUR-0007913 [2,0,0,0,0,0|1,0,1]=4 68 B6R0.6 CNCCCCN CUR-0156103 [2,0,0,0,0,0|2,0,0]=4 69 B6R0.1 CCC(=O)OCC CUR-0101621 [2,0,0,0,0,0|1,0,0]=3 70 B6R0.1 CCNC(=O)CCl CUR-0099539 [2,0,0,0,0,0|2,0,0]=4 71 B6R0.1 CCOC(=O)CBr CUR-0001682 [2,0,0,0,0,0|2,0,0]=4 72 B6R0.1 CCOC(=O)CCl CUR-0015757 [2,0,0,0,0,0|2,0,0]=4 73 B6R0.1 CCOC(=O)CF CUR-0101650 [2,0,0,0,0,0|2,0,0]=4 74 B6R0.1 CCOC(=O)CN CUR-0024509 [2,0,0,0,0,0|2,0,0]=4 75 B6R0.1 CCOC(=O)CO CUR-0101638 [2,0,0,0,0,0|2,0,0]=4 76 B6R0.1 CNCC(=O)OC CUR-0102132 [2,0,0,0,0,0|2,0,0]=4 77 B6R0.1 COC(=O)CCS CUR-0005277 [2,0,0,0,0,0|2,0,0]=4 78 B6R0.1 COCC(=O)OC CUR-0101636 [2,0,0,0,0,0|2,0,0]=4 79 B6R0.4 C(CC(=O)Cl)CBr CUR-0103177 [2,0,0,0,0,0|2,0,0]=4 80 B6R0.4 C(CC(=O)Cl)CCl CUR-0020663 [2,0,0,0,0,0|2,0,0]=4 81 B6R0.4 C(CC(=O)O)CN CUR-0010241 [2,0,0,0,0,0|2,0,0]=4 82 B6R0.4 CC(=O)CCCCl CUR-0004280 [2,0,0,0,0,0|1,0,0]=3 83 B6R0.4 CCCCC(=O)C CUR-0101595 [2,0,0,0,0,0|0,0,0]=2 84 B6R0.4 CCCCC(=O)Cl CUR-0101805 [2,0,0,0,0,0|1,0,0]=3 85 B6R0.4 CCCCC(=O)O CUR-0101620 [2,0,0,0,0,0|1,0,0]=3 86 B6R0.4 CCOCC(=O)O CUR-0101637 [2,0,0,0,0,0|2,0,0]=4 87 B6R0.4 COCCC(=O)O CUR-0012995 [2,0,0,0,0,0|2,0,0]=4 88 B8R0.1 CCCCC(=O)OCC CUR-0101964 [1,1,0,0,0,0|1,0,1]=4 89 B8R0.4 CCCCCCCCCl CUR-0017829 [1,1,0,0,0,0|0,0,1]=3 90 B8R0.4 CCCCCCCCN CUR-0016440 [1,1,0,0,0,0|0,0,1]=3 91 B8R0.4 CCCCCCCCO CUR-0019304 [1,1,0,0,0,0|0,0,1]=3 92 B8R0.4 CCCCNCCCC CUR-0010735 [1,1,0,0,0,0|0,0,1]=3 93 B8R0.11 CCCCC(CC)CN CUR-0101954 [1,1,0,0,0,0|1,0,1]=4 94 B8R0.19 CCC(=O)CC(=O)OC CUR-0009634 [1,1,0,0,0,0|1,0,1]=4 95 B8R0.19 CCC(=O)OC(=O)CC CUR-0101961 [1,1,0,0,0,0|1,0,1]=4 96 B8R0.5 CCOC(=O)CC(=O)C CUR-0003002 [1,1,0,0,0,0|1,0,1]=4 97 B10R0.77 CCN(CC)CCCC(C)N CUR-0001667 [0,2,0,0,0,0|2,0,0]=4 98 B10R0.1 CCOC(=O)CCCCCN CUR-0021263 [0,2,0,0,0,0|0,0,0]=2 99 B10R0.2 CCCC(=O)CC(=O)OCC CUR-0102575 [0,2,0,0,0,0|0,0,1]=3 100 B10R0.2 CCCC(=O)OC(=O)CCC CUR-0102577 [0,2,0,0,0,0|1,0,1]=4 101 B10R0.2 CCOC(=O)CC(=O)OCC CUR-0024149 [0,2,0,0,0,0|1,0,1]=4 102 B10R0.6 CC(=O)CC(=O)OCCOC CUR-0102609 [0,2,0,0,0,0|2,0,0]=4 103 B10R0.83 CCCCOC(=O)C(CBr)Br CUR-0101120 [0,2,0,0,0,0|1,0,0]=3 104 B8R1.2 C1CCC(=NO)CC1 CUR-0008698 [1,0,0,1,0,0|2,0,0]=4 105 B8R1.2 C1CCC(CC1)CBr CUR-0011703 [1,0,0,1,0,0|1,0,1]=4 106 B8R1.2 C1CNCCC1CN CUR-0101728 [1,0,0,1,0,0|2,0,0]=4 107 B8R1.2 C1CNCCC1CO CUR-0016636 [1,0,0,1,0,0|2,0,0]=4 108 B8R1.2 C1COCCC1CBr CUR-0017881 [1,0,0,1,0,0|2,0,0]=4 109 B8R1.2 C1COCCC1CN CUR-0016360 [1,0,0,1,0,0|2,0,0]=4 110 B8R1.2 C1COCCC1CN CUR-0101743 [1,0,0,1,0,0|2,0,0]=4 111 B8R1.2 C1COCCC1CO CUR-0025645 [1,0,0,1,0,0|2,0,0]=4 112 B8R1.2 CCC1CCCCN1 CUR-0101713 [1,0,0,1,0,0|1,0,1]=4 113 B8R1.2 CCN1CCNCC1 CUR-0022409 [1,0,0,1,0,0|2,0,0]=4 114 B8R1.2 CNC1CCCCC1 CUR-0022042 [1,0,0,1,0,0|1,0,1]=4 115 B8R1.2 COC1CCNCC1 CUR-0098884 [1,0,0,1,0,0|2,0,0]=4 116 B8R1.2 COC1CCNCC1 CUR-0102416 [1,0,0,1,0,0|2,0,0]=4 117 B8R1.5 CC1C(OCCN1)C CUR-0008066 [1,0,0,1,0,0|2,0,0]=4 118 B8R1.5 CC1C(SCCN1)C CUR-0002582 [1,0,0,1,0,0|2,0,0]=4 119 B8R1.5 CC1CCCCC1N CUR-0101709 [1,0,0,1,0,0|1,0,1]=4 120 B8R1.8 C1CCC(C1)CCN CUR-0004406 [1,0,0,1,0,0|1,0,1]=4 121 B8R1.8 CSCC1CCNC1 CUR-0021647 [1,0,0,1,0,0|2,0,0]=4 122 B8R1.11 CC1CCCC1CN CUR-0083631 [1,0,0,1,0,0|1,0,1]=4 123 B8R1.22 C1CCCC(CC1)N CUR-0011742 [1,0,0,1,0,0|1,0,1]=4 124 B8R1.22 CN1CCCNCC1 CUR-0101729 [1,0,0,1,0,0|2,0,0]=4 125 B8R1.1 C1C(CNC1=O)CBr CUR-0022348 [1,0,0,1,0,0|2,0,0]=4 126 B8R1.1 C1C(CNC1=O)CN CUR-0046714 [1,0,0,1,0,0|2,0,0]=4 127 B8R1.1 C1C(CNC1=O)CO CUR-0098527 [1,0,0,1,0,0|2,0,0]=4 128 B8R1.1 C1CC(=O)NC1CN CUR-0094491 [1,0,0,1,0,0|2,0,0]=4 129 B8R1.1 C1CC(=O)NC1CO CUR-0028114 [1,0,0,1,0,0|2,0,0]=4 130 B8R1.1 CNC1CC(=O)NC1 CUR-0011593 [1,0,0,1,0,0|2,0,0]=4 131 B8R1.3 C1CC(=O)NCC1N CUR-0023298 [1,0,0,1,0,0|2,0,0]=4 132 B8R1.3 C1CC(=O)NCC1N CUR-0094615 [1,0,0,1,0,0|2,0,0]=4 133 B8R1.3 C=C1CCC(CC1)N CUR-0123168 [1,0,0,1,0,0|2,0,0]=4 134 B8R1.3 CC1CCC(=O)CC1 CUR-0016613 [1,0,0,1,0,0|0,0,0]=2 135 B8R1.3 CC1CCC(CC1)O CUR-0005881 [1,0,0,1,0,0|0,0,2]=4 136 B8R1.3 CN1CCC(=O)CC1 CUR-0101707 [1,0,0,1,0,0|1,0,0]=3 137 B8R1.3 C[C@H]1CC[C@@H](CC1)N CUR-0101712 [1,0,0,1,0,0|1,0,1]=4 138 B8R1.38 C1CC(C1)C(=O)CN CUR-0153392 [1,0,0,1,0,0|1,0,0]=3 139 B8R1.40 C1CC1NC(=O)CCl CUR-0019155 [1,0,0,1,0,0|2,0,0]=4 140 B8R1.4 C1CC(=O)CC(=O)C1 CUR-0019886 [1,0,0,1,0,0|1,0,1]=4 141 B8R1.4 CC1CCCC(=O)C1 CUR-0101702 [1,0,0,1,0,0|0,0,0]=2 142 B8R1.4 CC1CCCC(C1)O CUR-0017679 [1,0,0,1,0,0|0,0,2]=4 143 B8R1.4 CC1CCCC(N1)C CUR-0101708 [1,0,0,1,0,0|1,0,1]=4 144 B8R1.4 C[C@@H]1CCC[C@@H](N1)C CUR-0100904 [1,0,0,1,0,0|1,0,1]=4 145 B8R1.7 C1CC(NC1)C(=O)O CUR-0028986 [1,0,0,1,0,0|2,0,0]=4 146 B8R1.7 C1CC(OC1)C(=O)O CUR-0016168 [1,0,0,1,0,0|2,0,0]=4 147 B8R1.7 C1CCC(C1)C(=O)O CUR-0019739 [1,0,0,1,0,0|1,0,0]=3 148 B8R1.7 C1CNCC1C(=O)N CUR-0028604 [1,0,0,1,0,0|2,0,0]=4 149 B8R1.7 C1COCC1C(=O)O CUR-0024198 [1,0,0,1,0,0|2,0,0]=4 150 B8R1.7 C1C[C@@H](NC1)C(=O)O CUR-0100756 [1,0,0,1,0,0|2,0,0]=4 151 B8R1.7 C1C[C@H](NC1)C(=O)N CUR-0101723 [1,0,0,1,0,0|2,0,0]=4 152 B8R1.7 C1C[C@H](NC1)C(=O)O CUR-0101268 [1,0,0,1,0,0|2,0,0]=4 153 B10R1.13 CC(=O)N1CCC(=O)CC1 CUR-0102163 [0,1,0,1,0,0|1,0,1]=4 154 B10R1.13 CC(C)N1CCC(=O)CC1 CUR-0102166 [0,1,0,1,0,0|1,0,0]=3 155 B10R1.197 C1CC(=O)NCCC1CO CUR-0004047 [0,1,0,1,0,0|1,0,0]=3 156 B10R1.10 C1CN(CC(=O)N1)CCO CUR-0096567 [0,1,0,1,0,0|2,0,0]=4 157 B10R1.11 C1CCN(C1)C(=O)CCCl CUR-0029534 [0,1,0,1,0,0|1,0,0]=3 158 B10R1.29 C1CC(=O)N(C1)CCCCl CUR-0016346 [0,1,0,1,0,0|2,0,0]=4 159 B10R1.29 C1CC(=O)N(C1)CCCN CUR-0102200 [0,1,0,1,0,0|2,0,0]=4 160 B10R1.85 C1CCCC(CC1)CCN CUR-0047704 [0,1,0,1,0,0|1,0,1]=4 161 B10R1.85 C1CCCN(CC1)CCCl CUR-0103416 [0,1,0,1,0,0|2,0,0]=4 162 B10R1.245 CC1CCCC(C1CN)C CUR-0053439 [0,1,0,1,0,0|1,0,1]=4 163 B10R1.15 C1CCC(CC1)C(=O)CBr CUR-0018323 [0,1,0,1,0,0|1,0,0]=3 164 B10R1.15 C1CCC(CC1)C(=O)CN CUR-0083685 [0,1,0,1,0,0|1,0,0]=3 165 B10R1.15 C1CCN(CC1)C(=O)CCl CUR-0099534 [0,1,0,1,0,0|1,0,0]=3 166 B10R1.15 C1COCCN1C(=O)CCl CUR-0001965 [0,1,0,1,0,0|2,0,0]=4 167 B10R1.15 CCC(=O)N1CCSCC1 CUR-0047840 [0,1,0,1,0,0|1,0,0]=3 168 B10R1.15 COC(=O)C1CCCCN1 CUR-0103057 [0,1,0,1,0,0|1,0,0]=3 169 B10R1.15 COC(=O)C1CCNCC1 CUR-0102216 [0,1,0,1,0,0|1,0,0]=3 170 B10R1.15 COC(=O)C1CCOCC1 CUR-0019779 [0,1,0,1,0,0|1,0,0]=3 171 B10R1.26 C1CS(=O)(=O)CCC1CBr CUR-0028857 [0,1,0,1,0,0|2,0,0]=4 172 B10R1.95 CCNC1CCS(=O)(=O)C1 CUR-0100690 [0,1,0,1,0,0|2,0,0]=4 173 B10R1.3 CCC1CCC(CC1)NN CUR-0015740 [0,1,0,1,0,0|1,0,1]=4 174 B10R1.27 C#CC(=O)NC1CCCC1 CUR-0066912 [0,1,0,1,0,0|0,0,2]=4 175 B10R1.27 CCC(CN1CCCC1)N CUR-0018984 [0,1,0,1,0,0|1,0,1]=4 176 B10R1.27 COC(=O)CC1CCCN1 CUR-0089011 [0,1,0,1,0,0|1,0,0]=3 177 B10R1.149 COC(=O)C1CCCC1=O CUR-0020267 [0,1,0,1,0,0|1,0,1]=4 178 B10R1.429 COC(=O)CC1(CCC1)N CUR-0123514 [0,1,0,1,0,0|1,0,0]=3 179 B10R1.1 CCCN1CCC(=O)CC1 CUR-0004951 [0,1,0,1,0,0|0,0,0]=2 180 B10R1.161 C1CCCC(CCC1)CO CUR-0051597 [0,1,0,1,0,0|0,0,2]=4 181 B10R1.23 CC(C(=O)N1CCCC1)Cl CUR-0018712 [0,1,0,1,0,0|1,0,0]=3