0 B8R0.7 C(CCC(=O)O)CCBr CUR-0101245 [0,0,0,0,0,0|2,0,1]=3 1 B8R0.7 C(CCC(=O)O)CCN CUR-0025350 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.7 C(CCC(=O)O)CCN CUR-0101191 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.7 C(CCC(=O)[O-])CCN CUR-0024211 [0,0,0,0,0,0|2,0,2]=4 4 B8R0.7 CC(=O)OCCCCCl CUR-0102385 [0,0,0,0,0,0|2,0,2]=4 5 B8R0.7 CCCCCCC(=O)O CUR-0013258 [0,0,0,0,0,0|1,0,1]=2 6 B7R0.1 C(CCCBr)CCBr CUR-0100760 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.1 C(CCCCl)CCO CUR-0102083 [1,0,0,0,0,0|1,0,0]=2 8 B7R0.1 C(CCCN)CCN CUR-0022953 [1,0,0,0,0,0|2,0,0]=3 9 B7R0.1 C(CCCO)CCN CUR-0101772 [1,0,0,0,0,0|1,0,0]=2 10 B7R0.1 C(CNCCO)CO CUR-0027567 [1,0,0,0,0,0|2,0,0]=3 11 B7R0.1 CCCCCCC=O CUR-0101726 [1,0,0,0,0,0|0,0,2]=3 12 B7R0.1 CCCCCCCBr CUR-0012025 [1,0,0,0,0,0|1,0,0]=2 13 B7R0.1 CCCCCCCC CUR-0101732 [1,0,0,0,0,0|0,0,0]=1 14 B7R0.1 CCCCCCCI CUR-0002481 [1,0,0,0,0,0|1,0,0]=2 15 B7R0.1 CCCCCCCO CUR-0012442 [1,0,0,0,0,0|0,0,0]=1 16 B7R0.1 CCNCCNCC CUR-0019308 [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|2,0,1]=4 18 B7R0.4 C(CCN)CC(=O)O CUR-0018281 [1,0,0,0,0,0|2,0,1]=4 19 B7R0.4 CC(C)OCCCN CUR-0101773 [1,0,0,0,0,0|3,0,0]=4 20 B7R0.4 CC(C)OCCCO CUR-0010579 [1,0,0,0,0,0|3,0,0]=4 21 B7R0.4 CCCCOC(=O)C CUR-0026180 [1,0,0,0,0,0|1,0,2]=4 22 B9R0.47 C(CCN)CC(C(=O)O)N CUR-0012942 [0,1,0,0,0,0|2,0,1]=4 23 B9R0.47 C(CCN)C[C@H](C(=O)O)N CUR-0103129 [0,1,0,0,0,0|2,0,1]=4 24 B9R1.2 CC1CCCC(C1)C#N CUR-0025237 [0,0,0,1,0,0|2,0,1]=4 25 B9R1.2 CC1CCCC(C1)NN CUR-0019479 [0,0,0,1,0,0|3,0,0]=4 26 B9R1.2 CCN1CCCC(C1)O CUR-0101951 [0,0,0,1,0,0|1,0,0]=2 27 B9R1.6 B(C1CCCCC1)(O)O CUR-0101912 [0,0,0,1,0,0|2,0,0]=3 28 B9R1.6 C1CC(CNC1)C(=O)O CUR-0002813 [0,0,0,1,0,0|2,0,1]=4 29 B9R1.6 C1CC(COC1)C(=O)O CUR-0008785 [0,0,0,1,0,0|2,0,1]=4 30 B9R1.6 C1CCC(CC1)C(=O)Cl CUR-0025798 [0,0,0,1,0,0|1,0,2]=4 31 B9R1.6 C1CCC(CC1)C(=O)O CUR-0026401 [0,0,0,1,0,0|1,0,1]=3 32 B9R1.6 C1CCNC(C1)C(=O)O CUR-0009302 [0,0,0,1,0,0|2,0,1]=4 33 B9R1.6 C1CNCCC1C(=O)O CUR-0003276 [0,0,0,1,0,0|2,0,1]=4 34 B9R1.6 C1COCCC1C(=O)O CUR-0016356 [0,0,0,1,0,0|2,0,1]=4 35 B9R1.6 CC(=O)C1CCCCN1 CUR-0096516 [0,0,0,1,0,0|1,0,2]=4 36 B9R1.6 CC(C)C1CCCNC1 CUR-0018228 [0,0,0,1,0,0|2,0,0]=3 37 B9R1.6 CC(C)C1CNCCN1 CUR-0098534 [0,0,0,1,0,0|3,0,0]=4 38 B9R1.6 CC(C)N1CCNCC1 CUR-0101930 [0,0,0,1,0,0|3,0,0]=4 39 B9R1.6 CN(C)C1CCCCC1 CUR-0101906 [0,0,0,1,0,0|2,0,0]=3 40 B9R1.6 CN(C)C1CCNCC1 CUR-0006252 [0,0,0,1,0,0|3,0,0]=4 41 B9R1.6 CN(C)C1CCNCC1 CUR-0101330 [0,0,0,1,0,0|3,0,0]=4 42 B9R1.13 C1CCC(C1)CC(=O)O CUR-0016408 [0,0,0,1,0,0|1,0,1]=3 43 B9R1.41 CC1CCCC1C(=O)O CUR-0018388 [0,0,0,1,0,0|1,0,1]=3 44 B9R1.50 C1CCCC(=O)CCC1 CUR-0101896 [0,0,0,1,0,0|0,0,2]=3 45 B9R1.50 C1CCCC(CCC1)N CUR-0014335 [0,0,0,1,0,0|1,0,0]=2 46 B6R0.6 C(CCBr)CCBr CUR-0024921 [2,0,0,0,0,0|2,0,0]=4 47 B6R0.6 C(CCCl)CCBr CUR-0005784 [2,0,0,0,0,0|2,0,0]=4 48 B6R0.6 C(CCO)CCO CUR-0010266 [2,0,0,0,0,0|1,0,0]=3 49 B6R0.6 C(CNCCO)N CUR-0101642 [2,0,0,0,0,0|2,0,0]=4 50 B6R0.6 C(CO)NCCO CUR-0020204 [2,0,0,0,0,0|2,0,0]=4 51 B6R0.6 C(COCCO)N CUR-0101647 [2,0,0,0,0,0|2,0,0]=4 52 B6R0.6 C(COCCO)O CUR-0012642 [2,0,0,0,0,0|2,0,0]=4 53 B6R0.6 C(CSCCO)O CUR-0101840 [2,0,0,0,0,0|2,0,0]=4 54 B6R0.6 CCCCCCBr CUR-0023541 [2,0,0,0,0,0|1,0,0]=3 55 B6R0.6 CCCCCCC CUR-0101599 [2,0,0,0,0,0|0,0,0]=2 56 B6R0.6 CCCCCCI CUR-0008970 [2,0,0,0,0,0|1,0,0]=3 57 B6R0.6 CCCCCCN CUR-0100774 [2,0,0,0,0,0|1,0,0]=3 58 B6R0.6 CCCCCCO CUR-0025713 [2,0,0,0,0,0|0,0,0]=2 59 B6R0.6 CCCCNCC CUR-0101609 [2,0,0,0,0,0|1,0,0]=3 60 B6R0.6 CCCNCCC CUR-0008343 [2,0,0,0,0,0|1,0,0]=3 61 B6R0.6 CCOCCCN CUR-0101632 [2,0,0,0,0,0|2,0,0]=4 62 B6R0.6 CC\C=C\CCO CUR-0007913 [2,0,0,0,0,0|0,0,2]=4 63 B6R0.6 CNCCCCN CUR-0156103 [2,0,0,0,0,0|2,0,0]=4 64 B6R0.4 CC(CCC#C)O CUR-0038064 [2,0,0,0,0,0|0,0,2]=4 65 B6R0.4 CCCCC(=O)C CUR-0101595 [2,0,0,0,0,0|0,0,2]=4 66 B6R0.4 CCCCC(=O)O CUR-0101620 [2,0,0,0,0,0|1,0,1]=4 67 B8R0.1 CCCCC(=O)OCC CUR-0101964 [1,1,0,0,0,0|1,0,1]=4 68 B8R0.4 CCCCCCCCCl CUR-0017829 [1,1,0,0,0,0|0,0,0]=2 69 B8R0.4 CCCCCCCCN CUR-0016440 [1,1,0,0,0,0|0,0,0]=2 70 B8R0.4 CCCCCCCCO CUR-0019304 [1,1,0,0,0,0|0,0,0]=2 71 B8R0.4 CCCCNCCCC CUR-0010735 [1,1,0,0,0,0|0,0,0]=2 72 B8R0.4 COCCNCCOC CUR-0102019 [1,1,0,0,0,0|2,0,0]=4 73 B8R0.4 COCCOCCOC CUR-0002307 [1,1,0,0,0,0|2,0,0]=4 74 B8R0.5 CC(CC(CCO)O)O CUR-0003071 [1,1,0,0,0,0|1,0,0]=3 75 B8R0.8 CCCCC(C(=O)O)Br CUR-0103355 [1,1,0,0,0,0|1,0,1]=4 76 B8R0.8 CCCCC(C(=O)O)N CUR-0009588 [1,1,0,0,0,0|1,0,1]=4 77 B8R0.28 CC(C)CNCC(C)C CUR-0100841 [1,1,0,0,0,0|2,0,0]=4 78 B8R0.28 CC(CNCC(C)O)O CUR-0102020 [1,1,0,0,0,0|1,0,0]=3 79 B10R0.77 CCN(CC)CCCC(C)N CUR-0001667 [0,2,0,0,0,0|2,0,0]=4 80 B10R0.98 CC(C)CCC[C@@H](C(=O)O)N CUR-0017303 [0,2,0,0,0,0|1,0,1]=4 81 B8R1.2 C1CCC(=NO)CC1 CUR-0008698 [1,0,0,1,0,0|1,0,1]=4 82 B8R1.2 C1CCC(CC1)C=O CUR-0101704 [1,0,0,1,0,0|0,0,2]=4 83 B8R1.2 C1CCC(CC1)CBr CUR-0011703 [1,0,0,1,0,0|1,0,0]=3 84 B8R1.2 C1CCC(CC1)[Mg]Cl CUR-0102210 [1,0,0,1,0,0|2,0,0]=4 85 B8R1.2 C1CCOC(C1)CO CUR-0101759 [1,0,0,1,0,0|1,0,0]=3 86 B8R1.2 C1CNCCC1CN CUR-0101728 [1,0,0,1,0,0|2,0,0]=4 87 B8R1.2 C1CNCCC1CO CUR-0016636 [1,0,0,1,0,0|1,0,0]=3 88 B8R1.2 C1COCCC1CBr CUR-0017881 [1,0,0,1,0,0|2,0,0]=4 89 B8R1.2 C1COCCC1CN CUR-0016360 [1,0,0,1,0,0|2,0,0]=4 90 B8R1.2 C1COCCC1CN CUR-0101743 [1,0,0,1,0,0|2,0,0]=4 91 B8R1.2 C1COCCC1CO CUR-0025645 [1,0,0,1,0,0|1,0,0]=3 92 B8R1.2 CCC1CCCCN1 CUR-0101713 [1,0,0,1,0,0|1,0,0]=3 93 B8R1.2 CCN1CCNCC1 CUR-0022409 [1,0,0,1,0,0|2,0,0]=4 94 B8R1.2 CNC1CCCCC1 CUR-0022042 [1,0,0,1,0,0|1,0,0]=3 95 B8R1.2 COC1CCNCC1 CUR-0098884 [1,0,0,1,0,0|2,0,0]=4 96 B8R1.2 COC1CCNCC1 CUR-0102416 [1,0,0,1,0,0|2,0,0]=4 97 B8R1.5 CC1C(OCCN1)C CUR-0008066 [1,0,0,1,0,0|2,0,0]=4 98 B8R1.5 CC1C(SCCN1)C CUR-0002582 [1,0,0,1,0,0|2,0,0]=4 99 B8R1.5 CC1CCCCC1=O CUR-0101703 [1,0,0,1,0,0|0,0,2]=4 100 B8R1.5 CC1CCCCC1N CUR-0101709 [1,0,0,1,0,0|1,0,0]=3 101 B8R1.8 C1CC(OC1)CNN CUR-0029161 [1,0,0,1,0,0|2,0,0]=4 102 B8R1.8 C1CCC(C1)CCN CUR-0004406 [1,0,0,1,0,0|1,0,0]=3 103 B8R1.8 C1CCN(C1)CCCl CUR-0014441 [1,0,0,1,0,0|2,0,0]=4 104 B8R1.8 C1COC(O1)CCBr CUR-0103089 [1,0,0,1,0,0|2,0,0]=4 105 B8R1.8 CNCC1CCCO1 CUR-0000545 [1,0,0,1,0,0|1,0,0]=3 106 B8R1.8 CSCC1CCNC1 CUR-0021647 [1,0,0,1,0,0|2,0,0]=4 107 B8R1.10 C1CC(C1)OCCN CUR-0016707 [1,0,0,1,0,0|2,0,0]=4 108 B8R1.10 C1CC(C1)OCCO CUR-0000042 [1,0,0,1,0,0|1,0,0]=3 109 B8R1.10 C1CN(C1)CCCO CUR-0120521 [1,0,0,1,0,0|1,0,0]=3 110 B8R1.11 C1CC(C(C1)N)CO CUR-0048429 [1,0,0,1,0,0|1,0,0]=3 111 B8R1.11 C1CC(C(C1)O)CN CUR-0017233 [1,0,0,1,0,0|1,0,0]=3 112 B8R1.11 CC1CCCC1CN CUR-0083631 [1,0,0,1,0,0|1,0,0]=3 113 B8R1.11 CN1CCCC1CO CUR-0019910 [1,0,0,1,0,0|1,0,0]=3 114 B8R1.11 CSC1CCCC1N CUR-0019849 [1,0,0,1,0,0|2,0,0]=4 115 B8R1.22 C1CCC(=O)OCC1 CUR-0101418 [1,0,0,1,0,0|1,0,1]=4 116 B8R1.22 C1CCCC(=O)CC1 CUR-0004176 [1,0,0,1,0,0|0,0,2]=4 117 B8R1.22 C1CCCC(CC1)N CUR-0011742 [1,0,0,1,0,0|1,0,0]=3 118 B8R1.22 CN1CCCNCC1 CUR-0101729 [1,0,0,1,0,0|2,0,0]=4 119 B8R1.4 CC1CC(CNC1)C CUR-0101710 [1,0,0,1,0,0|2,0,0]=4 120 B8R1.4 CC1CCCC(=O)C1 CUR-0101702 [1,0,0,1,0,0|0,0,2]=4 121 B8R1.4 CC1CCCC(C1)O CUR-0017679 [1,0,0,1,0,0|0,0,0]=2 122 B8R1.4 CC1CCCC(N1)C CUR-0101708 [1,0,0,1,0,0|1,0,0]=3 123 B8R1.4 CC1CNCC(O1)C CUR-0023957 [1,0,0,1,0,0|1,0,0]=3 124 B8R1.4 CC1COCC(N1)C CUR-0013452 [1,0,0,1,0,0|2,0,0]=4 125 B8R1.4 C[C@@H]1CCC[C@@H](N1)C CUR-0100904 [1,0,0,1,0,0|1,0,0]=3 126 B8R1.4 C[C@@H]1CNC[C@@H](O1)C CUR-0101741 [1,0,0,1,0,0|1,0,0]=3 127 B8R1.7 C1CCC(C1)C(=O)O CUR-0019739 [1,0,0,1,0,0|1,0,1]=4 128 B8R1.7 CC(C)C1CCNC1 CUR-0011983 [1,0,0,1,0,0|2,0,0]=4 129 B8R1.19 CC1(CCCC1O)C CUR-0056939 [1,0,0,1,0,0|2,0,0]=4 130 B10R1.18 C1CCC(CC1)CC(=O)O CUR-0102197 [0,1,0,1,0,0|1,0,1]=4 131 B10R1.18 C1CCN(CC1)CC(=O)O CUR-0097420 [0,1,0,1,0,0|1,0,1]=4 132 B10R1.18 CC(C)NC1CCCCC1 CUR-0102168 [0,1,0,1,0,0|1,0,0]=3 133 B10R1.18 CC(CN1CCNCC1)O CUR-0100601 [0,1,0,1,0,0|1,0,0]=3 134 B10R1.61 C1CCC(C(C1)C(=O)O)N CUR-0081649 [0,1,0,1,0,0|1,0,1]=4 135 B10R1.66 C1CC(OC1)CCC(=O)O CUR-0004537 [0,1,0,1,0,0|1,0,1]=4 136 B10R1.66 C1CCC(C1)CCC(=O)O CUR-0102198 [0,1,0,1,0,0|1,0,1]=4 137 B10R1.66 C1CCC(C1)OCC(=O)O CUR-0025267 [0,1,0,1,0,0|1,0,1]=4 138 B10R1.66 C1CCC(C1)SCC(=O)O CUR-0094350 [0,1,0,1,0,0|1,0,1]=4 139 B10R1.28 CC(C1CCNCC1)(F)F CUR-0122263 [0,1,0,1,0,0|2,0,0]=4 140 B10R1.15 C1CCC(CC1)C(=O)CBr CUR-0018323 [0,1,0,1,0,0|0,0,2]=4 141 B10R1.15 C1CCC(CC1)C(=O)CN CUR-0083685 [0,1,0,1,0,0|0,0,2]=4 142 B10R1.15 C1CCC(CC1)C(CN)O CUR-0002211 [0,1,0,1,0,0|0,0,0]=2 143 B10R1.15 CC(C1CCCCC1)NN CUR-0020387 [0,1,0,1,0,0|1,0,0]=3 144 B10R1.15 CC(C=O)C1CCCCC1 CUR-0051286 [0,1,0,1,0,0|0,0,1]=3 145 B10R1.27 CCC(CN1CCCC1)N CUR-0018984 [0,1,0,1,0,0|2,0,0]=4 146 B10R1.161 C1CCCC(CCC1)CO CUR-0051597 [0,1,0,1,0,0|0,0,0]=2 147 B10R1.172 C1CC(CC(C1)CN)CN CUR-0102203 [0,1,0,1,0,0|2,0,0]=4 148 B10R2.62 C1[C@H]2C(CN(C1)CC2)O CUR-0101905 [0,0,0,2,0,0|1,0,0]=3 149 B10R2.71 C1CC2CC(=O)CC1O2 CUR-0002105 [0,0,0,2,0,0|1,0,1]=4 150 B10R2.71 C1CC2CC(CC1N2)F CUR-0123146 [0,0,0,2,0,0|2,0,0]=4 151 B10R2.71 C1CC2CC(CC1N2)O CUR-0101904 [0,0,0,2,0,0|1,0,0]=3 152 B10R2.6 C1CC1C2CCNCC2 CUR-0094980 [0,0,0,2,0,0|2,0,0]=4 153 B10R2.14 CC1CC(CN1)C2CC2 CUR-0047231 [0,0,0,2,0,0|2,0,0]=4 154 B10R2.138 C1CC2CNCCC1O2 CUR-0013116 [0,0,0,2,0,0|1,0,0]=3