0 B8R0.6 C=CCCCC(=O)OC CS-0015919 [0,0,0,0,0,0|0,0,4]=4 1 B8R0.6 CNCCCC(=O)OC CS-0112438 [0,0,0,0,0,0|1,0,2]=3 2 B7R0.3 CCCOC(=O)OC CS-0111112 [1,0,0,0,0,0|1,0,1]=3 3 B7R0.3 COC(=O)CCC#N CS-W009546 [1,0,0,0,0,0|1,0,2]=4 4 B7R0.3 COC(=O)\C=C\CN CS-0106649 [1,0,0,0,0,0|1,0,0]=2 5 B9R0.5 CCOC(=O)\C=C\CCO CS-0079974 [0,1,0,0,0,0|1,0,2]=4 6 B9R0.24 COC(=O)CCC(=O)OC CS-0015787 [0,1,0,0,0,0|1,0,1]=3 7 B9R0.34 CCOC(=O)CC(=O)CO CS-0093884 [0,1,0,0,0,0|3,0,0]=4 8 B9R1.1 CCC1CCC(=O)CC1 CS-W011153 [0,0,0,1,0,0|1,0,2]=4 9 B9R1.5 CC1CCNCCC1=O CS-0038168 [0,0,0,1,0,0|2,0,1]=4 10 B9R1.7 CCCC1CNC(=O)C1 CS-0061478 [0,0,0,1,0,0|1,0,2]=4 11 B9R1.7 CCC[C@@H]1CNC(=O)C1 CS-0094316 [0,0,0,1,0,0|1,0,2]=4 12 B9R1.7 CCC[C@H]1CNC(=O)C1 CS-0096517 [0,0,0,1,0,0|1,0,2]=4 13 B9R1.11 CNC(=O)C1CCCC1 CS-0104832 [0,0,0,1,0,0|1,0,2]=4 14 B9R1.11 COC(=O)C1=CC=CS1 CS-0038500 [0,0,0,1,0,0|1,0,2]=4 15 B9R1.11 COC(=O)C1CCCC1 CS-W005310 [0,0,0,1,0,0|0,0,2]=3 16 B9R1.11 COC(=O)C1CSCN1 CS-0079604 [0,0,0,1,0,0|2,0,1]=4 17 B9R1.11 COC(=O)[C@@H]1CCNC1 CS-0049282 [0,0,0,1,0,0|1,0,1]=3 18 B9R1.11 COC(=O)[C@@H]1CCOC1 CS-0049283 [0,0,0,1,0,0|1,0,1]=3 19 B9R1.11 COC(=O)[C@@H]1CSCN1 CS-0078994 [0,0,0,1,0,0|2,0,1]=4 20 B9R1.11 COC(=O)[C@H]1CCCO1 CS-0080541 [0,0,0,1,0,0|1,0,1]=3 21 B9R1.11 COC(=O)[C@H]1CCNC1 CS-0049275 [0,0,0,1,0,0|1,0,1]=3 22 B9R1.11 COC(=O)[C@H]1CCOC1 CS-0049276 [0,0,0,1,0,0|1,0,1]=3 23 B9R1.11 O=C(O[Na])[C@@H]1CCCN1 CS-0091626 [0,0,0,1,0,0|2,0,1]=4 24 B9R1.79 COC(=O)C=C1COC1 CS-0049198 [0,0,0,1,0,0|1,0,2]=4 25 B9R1.79 COC(=O)CC1CNC1 CS-0049202 [0,0,0,1,0,0|1,0,2]=4 26 B9R1.79 COC(=O)CC1CNC1 CS-0099123 [0,0,0,1,0,0|1,0,2]=4 27 B9R1.79 COC(=O)CC1COC1 CS-0049199 [0,0,0,1,0,0|1,0,2]=4 28 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N CS-0003938 [0,0,0,1,0,0|1,0,2]=4 29 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N CS-0045471 [0,0,0,1,0,0|1,0,2]=4 30 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N CS-0045473 [0,0,0,1,0,0|1,0,2]=4 31 B9R1.88 COC(=O)C1CC1CO CS-0078743 [0,0,0,1,0,0|1,0,2]=4 32 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CO CS-0078747 [0,0,0,1,0,0|1,0,2]=4 33 B9R1.88 COC(=O)[C@@H]1C[C@H]1CO CS-0078750 [0,0,0,1,0,0|1,0,2]=4 34 B6R0.4 CC(=O)CCCBr CS-0103669 [2,0,0,0,0,0|1,0,1]=4 35 B6R0.4 CNCCC(=O)O CS-0112815 [2,0,0,0,0,0|1,0,1]=4 36 B6R0.4 O=C(O)\C=C\CBr CS-0020044 [2,0,0,0,0,0|1,0,0]=3 37 B8R0.3 CCOC(=O)C(=O)NC CS-0036984 [1,1,0,0,0,0|2,0,0]=4 38 B8R0.9 COC(=O)\C=C\C(C)C CS-0113137 [1,1,0,0,0,0|0,0,0]=2 39 B8R0.9 COC(=O)\C=C\C(C)C CS-0113139 [1,1,0,0,0,0|0,0,0]=2 40 B8R0.19 COC(=O)CC(=O)CCl CS-0044248 [1,1,0,0,0,0|1,0,0]=3 41 B8R0.28 CC(C)CCCC(=O)O CS-0096310 [1,1,0,0,0,0|0,0,2]=4 42 B8R0.28 O=C(O)\C=C\CC(=O)O CS-0106651 [1,1,0,0,0,0|1,0,1]=4 43 B10R0.19 CCO\C=C(/C)C(=O)OCC CS-0037394 [0,2,0,0,0,0|1,0,1]=4 44 B10R0.74 CCCCC\C=C\C(=O)OC CS-0097187 [0,2,0,0,0,0|0,0,2]=4 45 B10R0.74 COC(=O)CCCCCCO CS-0059718 [0,2,0,0,0,0|0,0,2]=4 46 B8R1.1 CCC1=NOC(N)=C1 CS-0036176 [1,0,0,1,0,0|2,0,0]=4 47 B8R1.1 CCC1CNC(=O)C1 CS-0046666 [1,0,0,1,0,0|1,0,1]=4 48 B8R1.1 CC[C@H]1COC(=O)N1 CS-0093963 [1,0,0,1,0,0|1,0,1]=4 49 B8R1.1 O=C1CC(CO)CO1 CS-0037642 [1,0,0,1,0,0|1,0,1]=4 50 B8R1.3 CC1C=CC(=O)CC1 CS-0051212 [1,0,0,1,0,0|1,0,0]=3 51 B8R1.3 CC1CCC(=O)NC1 CS-0009361 [1,0,0,1,0,0|1,0,1]=4 52 B8R1.3 CN1C=CC(=O)CC1 CS-0067384 [1,0,0,1,0,0|2,0,0]=4 53 B8R1.3 C[C@@H]1CNC(=O)CN1 CS-0058677 [1,0,0,1,0,0|2,0,0]=4 54 B8R1.3 C[C@H]1CNC(=O)CN1 CS-0053133 [1,0,0,1,0,0|2,0,0]=4 55 B8R1.38 CNC(=O)C1CCC1 CS-0104834 [1,0,0,1,0,0|1,0,1]=4 56 B8R1.38 COC(=O)[C@@H]1CCN1 CS-0049286 [1,0,0,1,0,0|1,0,0]=3 57 B8R1.38 COC(=O)[C@H]1CCN1 CS-0049295 [1,0,0,1,0,0|1,0,0]=3 58 B8R1.40 COC(=O)CC1CC1 CS-0112851 [1,0,0,1,0,0|0,0,1]=3 59 B8R1.4 CC1CC(=O)CCN1 CS-0012636 [1,0,0,1,0,0|1,0,1]=4 60 B8R1.4 CC1CC(=O)CCN1 CS-0080309 [1,0,0,1,0,0|1,0,1]=4 61 B8R1.4 C[C@@H]1CC(=O)CCN1 CS-0053488 [1,0,0,1,0,0|1,0,1]=4 62 B8R1.4 C[C@H]1CC(=O)CCN1 CS-0053434 [1,0,0,1,0,0|1,0,1]=4 63 B8R1.4 C[C@H]1CC(=O)CCN1 CS-0053435 [1,0,0,1,0,0|1,0,1]=4 64 B8R1.6 CCOC1CC(=O)C1 CS-0091770 [1,0,0,1,0,0|1,0,1]=4 65 B8R1.7 O=C(O)[C@@H]1CCNC1 CS-D1771 [1,0,0,1,0,0|1,0,1]=4 66 B8R1.7 O=C(O)[C@@H]1CCON1 CS-0097126 [1,0,0,1,0,0|2,0,0]=4 67 B8R1.7 O=C(O)[C@H]1CCCO1 CS-W005223 [1,0,0,1,0,0|1,0,1]=4 68 B8R1.7 O=C(O)[C@H]1CCOC1 CS-0053249 [1,0,0,1,0,0|1,0,1]=4 69 B8R1.7 [C@@H]1(C(=O)O)CCOC1 CS-W006196 [1,0,0,1,0,0|1,0,1]=4 70 B8R1.31 CC1NCC1C(=O)O CS-0091784 [1,0,0,1,0,0|1,0,1]=4 71 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O CS-0053427 [1,0,0,1,0,0|1,0,1]=4 72 B8R1.34 O=C(O)C=C1CCC1 CS-0045555 [1,0,0,1,0,0|0,0,2]=4 73 B8R1.35 O=C(O)\C=C\C1CC1 CS-0062478 [1,0,0,1,0,0|0,0,2]=4 74 B10R1.14 COC(=O)C1CCC(=O)C1 CS-W019720 [0,1,0,1,0,0|0,0,1]=3 75 B10R1.14 COC(=O)C1CCC(Br)C1 CS-0049106 [0,1,0,1,0,0|0,0,2]=4 76 B10R1.14 COC(=O)C1CNC(=S)C1 CS-0089135 [0,1,0,1,0,0|1,0,1]=4 77 B10R1.14 COC(=O)[C@@H]1CCC(S)=N1 CS-0036085 [0,1,0,1,0,0|1,0,0]=3 78 B10R1.14 COC(=O)[C@@H]1CC[C@@H](N)C1 CS-0049309 [0,1,0,1,0,0|0,0,2]=4 79 B10R1.14 COC(=O)[C@@H]1CC[C@@H](O)C1 CS-0055660 [0,1,0,1,0,0|0,0,2]=4 80 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 CS-0049307 [0,1,0,1,0,0|0,0,2]=4 81 B10R1.14 COC(=O)[C@@H]1CNC(=O)C1 CS-0038415 [0,1,0,1,0,0|1,0,1]=4 82 B10R1.14 COC(=O)[C@@H]1CSC(C)N1 CS-0078777 [0,1,0,1,0,0|1,0,1]=4 83 B10R1.14 COC(=O)[C@@H]1C[C@@H](F)CN1 CS-0112435 [0,1,0,1,0,0|1,0,1]=4 84 B10R1.14 COC(=O)[C@@H]1C[C@@H](F)CN1 CS-0112554 [0,1,0,1,0,0|1,0,1]=4 85 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 CS-0049284 [0,1,0,1,0,0|1,0,1]=4 86 B10R1.14 COC(=O)[C@H]1C=C[C@@H](N)C1 CS-0005907 [0,1,0,1,0,0|0,0,0]=2 87 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 CS-0049304 [0,1,0,1,0,0|0,0,1]=3 88 B10R1.14 COC(=O)[C@H]1CC[C@@H](C)N1 CS-0098427 [0,1,0,1,0,0|0,0,2]=4 89 B10R1.14 COC(=O)[C@H]1CC[C@@H](O)C1 CS-0048900 [0,1,0,1,0,0|0,0,2]=4 90 B10R1.14 COC(=O)[C@H]1CC[C@H](Br)C1 CS-0049300 [0,1,0,1,0,0|0,0,2]=4 91 B10R1.14 COC(=O)[C@H]1CC[C@H](N)C1 CS-0058623 [0,1,0,1,0,0|0,0,2]=4 92 B10R1.14 COC(=O)[C@H]1C[C@@H](F)CN1 CS-0049291 [0,1,0,1,0,0|1,0,1]=4 93 B10R1.14 COC(=O)[C@H]1C[C@H](F)CN1 CS-0112546 [0,1,0,1,0,0|1,0,1]=4 94 B10R1.150 COC(=O)CC1CC(O)C1 CS-0049208 [0,1,0,1,0,0|0,0,2]=4 95 B10R1.15 COC(=O)C1=CCOCC1 CS-0049135 [0,1,0,1,0,0|0,0,2]=4 96 B10R1.15 COC(=O)C1=CNCCC1 CS-0049262 [0,1,0,1,0,0|0,0,2]=4 97 B10R1.15 COC(=O)C1CCCCC1 CS-W007704 [0,1,0,1,0,0|0,0,2]=4 98 B10R1.15 COC(=O)C1CCNCC1 CS-W016419 [0,1,0,1,0,0|0,0,2]=4 99 B10R1.15 COC(=O)C1CCSCC1 CS-0048885 [0,1,0,1,0,0|0,0,2]=4 100 B10R1.15 COC(=O)C1CNCCO1 CS-0036148 [0,1,0,1,0,0|1,0,1]=4 101 B10R1.15 COC(=O)N1C=CCCC1 CS-0112806 [0,1,0,1,0,0|1,0,0]=3 102 B10R1.15 COC(=O)[C@@H]1CC=CCC1 CS-0051390 [0,1,0,1,0,0|0,0,0]=2 103 B10R1.15 COC(=O)[C@@H]1CCCNC1 CS-M0789 [0,1,0,1,0,0|0,0,2]=4 104 B10R1.15 COC(=O)[C@@H]1COCCN1 CS-0102814 [0,1,0,1,0,0|1,0,1]=4 105 B10R1.15 COC(=O)[C@H]1CNCCO1 CS-0103649 [0,1,0,1,0,0|1,0,1]=4 106 B10R1.182 COC(=O)[C@H](N)C1CCC1 CS-D0198 [0,1,0,1,0,0|0,0,2]=4 107 B10R1.411 COC(=O)C1(Br)CCCC1 CS-0038233 [0,1,0,1,0,0|0,0,2]=4 108 B10R1.411 COC(=O)C1(C)CCCC1 CS-0089153 [0,1,0,1,0,0|0,0,2]=4 109 B10R1.411 COC(=O)C1(C)CCCO1 CS-0049156 [0,1,0,1,0,0|1,0,1]=4 110 B10R1.411 COC(=O)C1(C)CCNC1 CS-0049070 [0,1,0,1,0,0|1,0,1]=4 111 B10R1.411 COC(=O)C1(C)CCOC1 CS-0049074 [0,1,0,1,0,0|1,0,1]=4 112 B10R1.411 COC(=O)[C@]1(C)CCCN1 CS-0049287 [0,1,0,1,0,0|1,0,1]=4 113 B10R1.27 COC(=O)CC1=CN=CN1 CS-0054332 [0,1,0,1,0,0|1,0,1]=4 114 B10R1.27 COC(=O)CC1=NN=CO1 CS-0037346 [0,1,0,1,0,0|2,0,0]=4 115 B10R1.27 COC(=O)CC1CCOC1 CS-0104771 [0,1,0,1,0,0|0,0,2]=4 116 B10R1.149 COC(=O)C1=C(C)OC=C1 CS-0098016 [0,1,0,1,0,0|0,0,2]=4 117 B10R1.149 COC(=O)C1=CNC=C1C CS-0049030 [0,1,0,1,0,0|0,0,2]=4 118 B10R1.149 COC(=O)C1CCCC1O CS-0081054 [0,1,0,1,0,0|0,0,2]=4 119 B10R1.149 COC(=O)C1COCC1=O CS-D0559 [0,1,0,1,0,0|1,0,1]=4 120 B10R1.149 COC(=O)C1CSCC1=O CS-0106054 [0,1,0,1,0,0|1,0,1]=4 121 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1O CS-M0787 [0,1,0,1,0,0|0,0,2]=4 122 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O CS-0049292 [0,1,0,1,0,0|1,0,1]=4 123 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O CS-0049285 [0,1,0,1,0,0|1,0,1]=4 124 B10R1.172 CCC1=CC(OC)=NC=C1 CS-0092411 [0,1,0,1,0,0|1,0,1]=4