0 B7R1.24 C1CNCCNC1 CS-W007768 [1,0,0,0,0,0|1,0,1]=3 1 B9R1.5 NC1CCCCNC1=O CS-M1433 [0,1,0,0,0,0|0,0,0]=1 2 B9R1.89 N#CC1CCCCCC1 CS-0079887 [0,1,0,0,0,0|2,0,1]=4 3 B9R1.89 OC[C@@H]1CCCCCN1 CS-B0632 [0,1,0,0,0,0|0,0,2]=3 4 B7R0.1 C=CCCCCCBr CS-W009270 [0,0,1,0,0,0|2,0,0]=3 5 B7R0.1 ClCCCCCCBr CS-W010503 [0,0,1,0,0,0|2,0,1]=4 6 B7R0.1 NCCCNCCBr CS-W022895 [0,0,1,0,0,0|2,0,1]=4 7 B7R0.3 COC(=O)CCCBr CS-W004701 [0,0,1,0,0,0|2,0,0]=3 8 B7R0.3 COC(=O)CCCCl CS-0001466 [0,0,1,0,0,0|2,0,0]=3 9 B7R0.4 C#CCCCC(=O)O CS-W009272 [0,0,1,0,0,0|1,0,2]=4 10 B7R0.4 CC(=O)OCCCCl CS-W017752 [0,0,1,0,0,0|2,0,0]=3 11 B7R0.4 O=C(O)CCCCBr CS-W017172 [0,0,1,0,0,0|2,0,0]=3 12 B7R0.4 O=C(O)CCCCCl CS-W022362 [0,0,1,0,0,0|2,0,0]=3 13 B7R0.4 O=C([O-])CCCCO CS-0047732 [0,0,1,0,0,0|2,0,0]=3 14 B7R0.7 CC#CC(=O)OCC CS-W009547 [0,0,1,0,0,0|1,0,2]=4 15 B7R0.7 CCOC(=O)CCBr CS-W007449 [0,0,1,0,0,0|2,0,0]=3 16 B7R0.7 CCOC(=O)CNC CS-W020595 [0,0,1,0,0,0|2,0,0]=3 17 B7R1.3 BrC1CCNCC1 CS-W014130 [0,0,0,0,1,0|2,0,1]=4 18 B7R1.3 CC1COCCN1 CS-W009058 [0,0,0,0,1,0|2,0,1]=4 19 B7R1.3 C[C@@H]1COCCN1 CS-W020732 [0,0,0,0,1,0|2,0,1]=4 20 B7R1.3 ClC1CCOCC1 CS-W016579 [0,0,0,0,1,0|2,0,1]=4 21 B7R1.3 NC1CCCOC1 CS-0044162 [0,0,0,0,1,0|2,0,1]=4 22 B7R1.3 NC1CCOCC1 CS-B0654 [0,0,0,0,1,0|2,0,1]=4 23 B7R1.3 NC1CCOCC1 CS-W002372 [0,0,0,0,1,0|2,0,1]=4 24 B7R1.3 NN1CCCCC1 CS-W007639 [0,0,0,0,1,0|2,0,0]=3 25 B7R1.3 N[C@H]1CCCNC1 CS-W020063 [0,0,0,0,1,0|2,0,1]=4 26 B7R1.3 N[C@H]1CCCOC1 CS-W018654 [0,0,0,0,1,0|2,0,1]=4 27 B7R1.3 O=C1CCNCC1 CS-W018762 [0,0,0,0,1,0|1,0,0]=2 28 B7R1.3 O=C1CCNCC1 CS-W020094 [0,0,0,0,1,0|1,0,0]=2 29 B7R1.3 O=C1COCCN1 CS-D1427 [0,0,0,0,1,0|1,0,0]=2 30 B7R1.3 O=C1COCCO1 CS-0031423 [0,0,0,0,1,0|2,0,0]=3 31 B7R1.3 O=C1CSCCN1 CS-W019146 [0,0,0,0,1,0|1,0,0]=2 32 B7R1.3 OC1CCCNC1 CS-W013706 [0,0,0,0,1,0|1,0,2]=4 33 B7R1.3 OC1CCNCC1 CS-W004328 [0,0,0,0,1,0|1,0,2]=4 34 B7R1.3 OC1CCSCC1 CS-D1275 [0,0,0,0,1,0|1,0,2]=4 35 B7R1.3 [C@@H]1(O)CCCNC1 CS-W013330 [0,0,0,0,1,0|1,0,2]=4 36 B7R1.3 [C@H]1(C)CCCNC1 CS-W006435 [0,0,0,0,1,0|2,0,1]=4 37 B9R1.50 O=C1CCCCCCN1 CS-W022575 [0,0,0,0,0,1|0,0,0]=1 38 B6R0.6 BrCCCCCBr CS-W019956 [1,0,1,0,0,0|2,0,0]=4 39 B6R0.6 C=CCCCCO CS-W013711 [1,0,1,0,0,0|1,0,1]=4 40 B6R0.6 OCCCCCO CS-W020635 [1,0,1,0,0,0|1,0,1]=4 41 B6R0.1 CCCC(Cl)CC CS-0102884 [1,0,1,0,0,0|1,0,1]=4 42 B6R0.1 CCOC(=O)CO CS-W019892 [1,0,1,0,0,0|2,0,0]=4 43 B6R0.1 CNC(=O)CC#N CS-W018827 [1,0,1,0,0,0|1,0,1]=4 44 B6R0.1 COC(=O)CCBr CS-W008728 [1,0,1,0,0,0|2,0,0]=4 45 B6R0.4 CC(=O)NCCN CS-W013694 [1,0,1,0,0,0|1,0,0]=3 46 B6R0.4 CC(=O)NCCO CS-W013689 [1,0,1,0,0,0|1,0,0]=3 47 B6R0.4 CCOCC(=O)O CS-0071579 [1,0,1,0,0,0|2,0,0]=4 48 B6R0.4 O=C(O)CCCBr CS-W016047 [1,0,1,0,0,0|2,0,0]=4 49 B8R0.7 C=CCCCCC(=O)O CS-0097711 [0,1,1,0,0,0|1,0,1]=4 50 B8R0.7 N=C(N)NCCCCN CS-0058963 [0,1,1,0,0,0|2,0,0]=4 51 B8R0.7 O=C(O)CCCCCCl CS-W018132 [0,1,1,0,0,0|1,0,0]=3 52 B8R0.3 CCC[C@@H](N)C(=O)OC CS-M2701 [0,1,1,0,0,0|1,0,0]=3 53 B8R0.3 CCOC(=O)C(=O)CC CS-W005382 [0,1,1,0,0,0|2,0,0]=4 54 B8R0.19 CCC(=O)CC(=O)CC CS-W013466 [0,1,1,0,0,0|1,0,1]=4 55 B8R0.21 CCCCOS(C)(=O)=O CS-W018582 [0,1,1,0,0,0|2,0,0]=4 56 B8R0.28 CC(=O)NCCC(=O)O CS-0005652 [0,1,1,0,0,0|1,0,1]=4 57 B8R1.2 C#CC1CCCCC1 CS-W022720 [0,1,0,0,1,0|1,0,1]=4 58 B8R1.2 N#CC1CCCCN1 CS-0092627 [0,1,0,0,1,0|1,0,1]=4 59 B8R1.2 NCC1CCCCC1 CS-0015361 [0,1,0,0,1,0|1,0,1]=4 60 B8R1.2 NCC1CCCCN1 CS-W011240 [0,1,0,0,1,0|1,0,1]=4 61 B8R1.2 NNC1CCCCC1 CS-W007595 [0,1,0,0,1,0|1,0,1]=4 62 B8R1.2 O=CC1CCOCC1 CS-D1228 [0,1,0,0,1,0|1,0,1]=4 63 B8R1.2 OCC1CCCCC1 CS-W011242 [0,1,0,0,1,0|0,0,2]=4 64 B8R1.2 OCC1CCCCN1 CS-W013620 [0,1,0,0,1,0|0,0,2]=4 65 B8R1.2 OC[C@H]1CCCCN1 CS-W018567 [0,1,0,0,1,0|0,0,2]=4 66 B8R1.3 CC1CCC(O)CC1 CS-0059254 [0,1,0,0,1,0|0,0,2]=4 67 B8R1.3 CN1CCC(=O)CC1 CS-W009198 [0,1,0,0,1,0|1,0,0]=3 68 B8R1.3 CN1CCC(O)CC1 CS-W019412 [0,1,0,0,1,0|2,0,0]=4 69 B8R1.3 N[C@H]1CC[C@H](N)CC1 CS-W007732 [0,1,0,0,1,0|1,0,1]=4 70 B8R1.3 N[C@H]1CC[C@H](O)CC1 CS-W019841 [0,1,0,0,1,0|0,0,2]=4 71 B8R1.3 O=C1CC[C@@H](O)CN1 CS-D0041 [0,1,0,0,1,0|0,0,0]=2 72 B8R1.3 O=C1CC[C@H](O)CN1 CS-D0042 [0,1,0,0,1,0|0,0,0]=2 73 B8R1.4 NC1=CC(=O)CCC1 CS-0032855 [0,1,0,0,1,0|0,0,2]=4 74 B8R1.5 CC1=NCCCN1C CS-W021273 [0,1,0,0,1,0|2,0,0]=4 75 B8R1.5 CC1CNCCC1=O CS-D0046 [0,1,0,0,1,0|1,0,0]=3 76 B8R1.5 CC1NCCNC1=O CS-0046850 [0,1,0,0,1,0|1,0,0]=3 77 B8R1.5 N[C@H]1CCCC[C@@H]1N CS-M0769 [0,1,0,0,1,0|1,0,1]=4 78 B8R1.5 N[C@H]1CCCC[C@@H]1O CS-D0607 [0,1,0,0,1,0|0,0,2]=4 79 B8R1.5 N[C@H]1CCCC[C@H]1N CS-M3552 [0,1,0,0,1,0|1,0,1]=4 80 B8R1.5 O=C1NCCCC1O CS-W008630 [0,1,0,0,1,0|0,0,0]=2 81 B8R1.5 O[C@H]1CCCC[C@H]1O CS-0059289 [0,1,0,0,1,0|0,0,2]=4 82 B8R1.72 CC1(N)CCCCC1 CS-0037804 [0,1,0,0,1,0|1,0,1]=4 83 B8R1.72 CC1(O)CCCCC1 CS-W013634 [0,1,0,0,1,0|0,0,2]=4 84 B8R1.72 O=S1(=O)CCCCO1 CS-W018691 [0,1,0,0,1,0|2,0,0]=4 85 B8R1.72 O=S1(=O)CCNCC1 CS-W005419 [0,1,0,0,1,0|2,0,0]=4 86 B8R1.72 O=S1(=O)CCNCC1 CS-W009111 [0,1,0,0,1,0|2,0,0]=4 87 B8R1.11 N#CC1CCCC1=O CS-W005103 [0,0,1,1,0,0|0,0,2]=4 88 B8R1.1 NC[C@H]1CCC(=O)N1 CS-0105178 [0,0,1,1,0,0|1,0,0]=3 89 B8R1.1 O=C1CCC(CBr)O1 CS-M2142 [0,0,1,1,0,0|2,0,0]=4 90 B8R1.1 O=C1CC[C@@H](CO)N1 CS-B0366 [0,0,1,1,0,0|1,0,0]=3 91 B8R1.1 O=C1N[C@@H](CO)CO1 CS-0067476 [0,0,1,1,0,0|2,0,0]=4 92 B8R1.7 O=C(O)C1CCCN1 CS-W013624 [0,0,1,1,0,0|2,0,0]=4 93 B8R1.7 O=C(O)C1CCCO1 CS-W018496 [0,0,1,1,0,0|2,0,0]=4 94 B8R1.7 O=C(O)C1CCNC1 CS-W019683 [0,0,1,1,0,0|2,0,0]=4 95 B8R1.34 O=C(O)CC1CCC1 CS-D0460 [0,0,1,1,0,0|1,0,0]=3 96 B6R1.1 C1=CCNCC1 CS-W021272 [1,0,0,0,1,0|0,0,2]=4 97 B6R1.1 C1CCNCC1 CS-W004746 [1,0,0,0,1,0|0,0,0]=2 98 B6R1.2 O=C1C=CCC1 CS-W011359 [0,0,0,0,2,0|0,0,2]=4 99 B6R1.2 O=C1CCOC1 CS-D1574 [0,0,0,0,2,0|1,0,0]=3 100 B6R1.2 O=C1NCCS1 CS-W023026 [0,0,0,0,2,0|1,0,0]=3 101 B10R1.78 O=C1CCCCCCCN1 CS-0090258 [0,0,0,0,0,2|0,0,0]=2