0 B10R0.3 CC(C)=CCCC(C)CCO CS-W010917 [0,0,0,0,0,0|0,0,2]=2 1 B10R0.3 CC(C)=CCC[C@H](C)CCO CS-W016231 [0,0,0,0,0,0|0,0,2]=2 2 B10R0.3 CC(C)CCCC(C)CCBr CS-W014739 [0,0,0,0,0,0|1,0,0]=1 3 B10R0.3 CC(C)CCCC(C)CCO CS-W010892 [0,0,0,0,0,0|0,0,0]=0 4 B10R0.3 CC(C)CCC[C@H](C)CCO CS-0695932 [0,0,0,0,0,0|0,0,0]=0 5 B9R0.2 CCCCCCCC(C)=O CS-0015991 [1,0,0,0,0,0|2,0,1]=4 6 B9R0.2 CCCNCCCN(C)C CS-0116651 [1,0,0,0,0,0|3,0,0]=4 7 B9R0.2 CN(C)CCCCCCO CS-W017749 [1,0,0,0,0,0|1,0,0]=2 8 B9R0.2 O=C(O)CCCCCCO CS-W022546 [1,0,0,0,0,0|2,0,1]=4 9 B11R0.6 CC(C)=CCC[C@@H](C)CC(=O)O CS-0142271 [0,1,0,0,0,0|0,0,3]=4 10 B11R0.45 CCN(CCO)CCCC(C)N CS-0124046 [0,1,0,0,0,0|2,0,0]=3 11 B11R1.166 C=C(C)[C@@H]1CC[C@@H](C)C[C@H]1O CS-0081229 [0,0,0,1,0,0|0,0,2]=3 12 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1O CS-0144140 [0,0,0,1,0,0|0,0,0]=1 13 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1Cl CS-0328614 [0,0,0,1,0,0|1,0,0]=2 14 B11R1.166 CC(C)[C@H]1CC[C@H](C)C[C@@H]1O CS-W017993 [0,0,0,1,0,0|0,0,0]=1 15 B11R1.166 CC1CCC(C(C)C)C(=O)C1 CS-0022560 [0,0,0,1,0,0|0,0,2]=3 16 B11R1.166 CC1CCC(C(C)C)C(O)C1 CS-M3737 [0,0,0,1,0,0|0,0,0]=1 17 B9R0.48 CC(C)=CCN(C)CCO CS-0203199 [0,0,0,0,1,0|1,0,2]=4 18 B8R0.6 CCCCCC(O)CC CS-0152331 [2,0,0,0,0,0|1,0,0]=3 19 B8R0.6 CCCCC[C@@H](O)CC CS-0464840 [2,0,0,0,0,0|1,0,0]=3 20 B8R0.7 CC(C)CCCCCO CS-0210352 [2,0,0,0,0,0|0,0,0]=2 21 B8R0.7 CC(C)CCCCCO CS-0641181 [2,0,0,0,0,0|0,0,0]=2 22 B8R0.7 CC(C)NCCCCO CS-M3069 [2,0,0,0,0,0|1,0,0]=3 23 B8R0.7 CCCCCCC(C)=O CS-W011125 [2,0,0,0,0,0|1,0,1]=4 24 B8R0.7 CCCCCCC(C)Br CS-0182749 [2,0,0,0,0,0|1,0,0]=3 25 B8R0.7 CCCCCCC(C)O CS-W011107 [2,0,0,0,0,0|1,0,0]=3 26 B8R0.7 CCCCCC[C@@H](C)N CS-0204339 [2,0,0,0,0,0|1,0,0]=3 27 B8R0.7 CCCCCC[C@@H](C)O CS-0140572 [2,0,0,0,0,0|1,0,0]=3 28 B8R0.7 CCCCCC[C@H](C)O CS-0140577 [2,0,0,0,0,0|1,0,0]=3 29 B8R0.7 CN(C)CCCCCN CS-0044781 [2,0,0,0,0,0|2,0,0]=4 30 B8R0.7 CN(C)CCOCCO CS-W011078 [2,0,0,0,0,0|2,0,0]=4 31 B8R0.28 CC(=O)CCCC(C)C CS-0154232 [2,0,0,0,0,0|0,0,2]=4 32 B8R0.28 CC(C)=CCC[C@@H](C)O CS-0726318 [2,0,0,0,0,0|0,0,2]=4 33 B8R0.28 CC(C)CNCC(C)C CS-0154216 [2,0,0,0,0,0|1,0,0]=3 34 B8R0.4 BrCCCCCCCBr CS-W010166 [2,0,0,0,0,0|2,0,0]=4 35 B8R0.4 C#CCCCCCCO CS-W008554 [2,0,0,0,0,0|0,0,2]=4 36 B8R0.4 C=CCCCCCCO CS-0185603 [2,0,0,0,0,0|0,0,2]=4 37 B8R0.4 CCCCC#CCCO CS-0315148 [2,0,0,0,0,0|0,0,2]=4 38 B8R0.4 CCCCCCCC=O CS-0138976 [2,0,0,0,0,0|0,0,2]=4 39 B8R0.4 CCCCCCCCBr CS-0076039 [2,0,0,0,0,0|1,0,0]=3 40 B8R0.4 CCCCCCCCI CS-0188391 [2,0,0,0,0,0|1,0,0]=3 41 B8R0.4 CCCCCCCCN CS-0076038 [2,0,0,0,0,0|1,0,0]=3 42 B8R0.4 CCCCCCCCN CS-0179378 [2,0,0,0,0,0|1,0,0]=3 43 B8R0.4 CCCCCCCCO CS-0076037 [2,0,0,0,0,0|0,0,0]=2 44 B8R0.4 CCCCC\C=C\CO CS-0152366 [2,0,0,0,0,0|0,0,2]=4 45 B8R0.4 CCCCOCCCN CS-0130475 [2,0,0,0,0,0|2,0,0]=4 46 B8R0.4 CCCCSCCCC CS-0255960 [2,0,0,0,0,0|2,0,0]=4 47 B8R0.4 NCCCCCCCN CS-W009537 [2,0,0,0,0,0|2,0,0]=4 48 B8R0.4 NCCCCCCCO CS-0088962 [2,0,0,0,0,0|1,0,0]=3 49 B8R0.4 NCCCOCCCO CS-0147757 [2,0,0,0,0,0|2,0,0]=4 50 B8R0.4 OCCCCCCCBr CS-W008425 [2,0,0,0,0,0|1,0,0]=3 51 B8R0.4 OCCCCCCCO CS-W013404 [2,0,0,0,0,0|1,0,0]=3 52 B8R0.4 OCCCNCCCO CS-0186731 [2,0,0,0,0,0|2,0,0]=4 53 B8R0.4 OCCCOCCCCl CS-0147762 [2,0,0,0,0,0|2,0,0]=4 54 B8R0.4 OCCCOCCCO CS-0131092 [2,0,0,0,0,0|2,0,0]=4 55 B8R0.1 CCCCC(O)CCC CS-0362569 [2,0,0,0,0,0|2,0,0]=4 56 B8R0.1 CCCCN(C)CCO CS-0132259 [2,0,0,0,0,0|1,0,0]=3 57 B10R0.65 CCC(C)(O)CCC=C(C)C CS-W010918 [1,1,0,0,0,0|0,0,2]=4 58 B10R0.74 COC(=O)CCCCCCO CS-0059718 [1,1,0,0,0,0|1,0,1]=4 59 B10R0.1 CCCCCCC(O)CCC CS-0320716 [1,1,0,0,0,0|2,0,0]=4 60 B10R0.156 CCCCCC(C)(O)CCC CS-0128343 [1,1,0,0,0,0|1,0,0]=3 61 B10R1.13 CC(C)C1CCC(=O)CC1 CS-W011030 [1,0,0,1,0,0|1,0,1]=4 62 B10R1.13 CC(C)N1CCC(N)CC1 CS-W021344 [1,0,0,1,0,0|2,0,0]=4 63 B10R1.13 CC(C)N1CCC(O)CC1 CS-W019184 [1,0,0,1,0,0|2,0,0]=4 64 B10R1.13 CC1CCC(C(C)C)CC1 CS-0742316 [1,0,0,1,0,0|0,0,0]=2 65 B10R1.13 CN(C)C1CCC(N)CC1 CS-0142728 [1,0,0,1,0,0|2,0,0]=4 66 B10R1.13 CN(C)C1CCC(N)CC1 CS-0142729 [1,0,0,1,0,0|2,0,0]=4 67 B10R1.13 CN(C)[C@H]1CC[C@H](N)CC1 CS-0142733 [1,0,0,1,0,0|2,0,0]=4 68 B10R1.171 CC1(C)CNC[C@@H](CO)O1 CS-0129997 [1,0,0,1,0,0|2,0,0]=4 69 B10R1.171 CC1(C)CNC[C@H](CO)O1 CS-0129999 [1,0,0,1,0,0|2,0,0]=4 70 B10R1.10 N[C@@H]1CCCN(CCO)C1 CS-0343609 [1,0,0,1,0,0|2,0,0]=4 71 B10R1.18 CC(C)C[C@@H]1COCCN1 CS-0154321 [1,0,0,1,0,0|2,0,0]=4 72 B10R1.18 CC(C)NC1CCCCC1 CS-0075695 [1,0,0,1,0,0|2,0,0]=4 73 B10R1.18 CN(C)CC1CNCCO1 CS-W005081 [1,0,0,1,0,0|2,0,0]=4 74 B10R1.61 CN(C)[C@@H]1CCCC[C@H]1N CS-0090931 [1,0,0,1,0,0|2,0,0]=4 75 B10R1.61 CN(C)[C@@H]1CCCC[C@H]1N CS-0103160 [1,0,0,1,0,0|2,0,0]=4 76 B10R1.61 CN(C)[C@@H]1CCCC[C@H]1O CS-0151359 [1,0,0,1,0,0|1,0,0]=3 77 B10R1.61 CN(C)[C@H]1CCCC[C@@H]1N CS-W018664 [1,0,0,1,0,0|2,0,0]=4 78 B10R1.133 CC1(C)CCCN1CCN CS-0498618 [1,0,0,1,0,0|2,0,0]=4 79 B10R1.85 ClCCN1CCCCCC1 CS-0008534 [1,0,0,1,0,0|2,0,0]=4 80 B10R1.85 NCCN1CCCCCC1 CS-0112526 [1,0,0,1,0,0|2,0,0]=4 81 B10R1.85 OCCN1CCCCCC1 CS-B0251 [1,0,0,1,0,0|1,0,0]=3 82 B10R1.377 CCC[N+]1(C)CCCCC1 CS-0152568 [1,0,0,1,0,0|2,0,0]=4 83 B10R1.1 CC1CCN(CCO)CC1 CS-0217252 [0,0,0,1,1,0|1,0,0]=3 84 B10R1.1 CN1CCC(CCO)CC1 CS-0052318 [0,0,0,1,1,0|1,0,0]=3 85 B10R1.1 CN1CCN(CCO)CC1 CS-W003127 [0,0,0,1,1,0|2,0,0]=4 86 B10R1.1 O=C1CCC(CCO)CC1 CS-0054946 [0,0,0,1,1,0|1,0,1]=4 87 B10R1.95 CC1(C)OCC(CCO)O1 CS-W006546 [0,0,0,1,1,0|2,0,0]=4 88 B10R1.95 CC1(C)OC[C@@H](CCO)O1 CS-0139581 [0,0,0,1,1,0|2,0,0]=4 89 B10R1.113 CC(C)C1CC(=O)CCO1 CS-0464877 [0,0,0,1,1,0|1,0,1]=4 90 B10R1.113 CC(C)C1CN(C)CCN1 CS-0635164 [0,0,0,1,1,0|2,0,0]=4 91 B12R1.126 CC1CCC(C(C)(C)O)C(O)C1 CS-0152685 [0,1,0,1,0,0|0,0,0]=2 92 B12R1.126 CC1CCC(C(C)(C)S)C(=O)C1 CS-0132255 [0,1,0,1,0,0|0,0,2]=4 93 B12R2.766 [C@H]12C[C@H]([C@@H](O)C=C1C)C2(C)C CS-0757546 [0,0,0,2,0,0|0,0,2]=4 94 B12R0.277 CN(C)CCOCCN(C)CCO CS-0456055 [0,0,0,0,0,2|2,0,0]=4