0 B8R0.6 COC(=O)CCCCCl CS-0098043 [0,0,0,0,0,0|1,0,2]=3 1 B8R0.6 COC(=O)CCCCN CS-0018002 [0,0,0,0,0,0|1,0,2]=3 2 B8R0.6 COCCCC(=O)OC CS-W011093 [0,0,0,0,0,0|1,0,2]=3 3 B7R0.3 COC(=O)CCCBr CS-W004701 [1,0,0,0,0,0|1,0,1]=3 4 B7R0.3 COC(=O)CCCCl CS-0001466 [1,0,0,0,0,0|1,0,1]=3 5 B7R0.4 CC(=O)OCCCCl CS-W017752 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.4 CCO\C=C\C(=O)O CS-W019195 [1,0,0,0,0,0|1,0,0]=2 7 B7R0.4 COC\C=C\C(=O)O CS-0100437 [1,0,0,0,0,0|1,0,0]=2 8 B7R0.4 O=C(O)CCCCBr CS-W017172 [1,0,0,0,0,0|1,0,2]=4 9 B7R0.4 O=C(O)CCCCCl CS-W022362 [1,0,0,0,0,0|1,0,2]=4 10 B9R0.1 COC(=O)CCCC(C)=O CS-0090564 [0,1,0,0,0,0|0,0,3]=4 11 B9R0.34 CCCC(=O)CC(=O)OC CS-W005176 [0,1,0,0,0,0|0,0,1]=2 12 B9R0.34 CCOC(=O)CC(=O)CC CS-W019881 [0,1,0,0,0,0|2,0,1]=4 13 B9R0.34 COCC(=O)CC(=O)OC CS-W007767 [0,1,0,0,0,0|1,0,1]=3 14 B9R0.46 COC(=O)CCCCCBr CS-W015176 [0,1,0,0,0,0|0,0,2]=3 15 B9R1.1 CCC1CCC(=O)CC1 CS-W011153 [0,0,0,1,0,0|1,0,2]=4 16 B9R1.2 COC1=CC=NC(C)=C1 CS-W005919 [0,0,0,1,0,0|2,0,1]=4 17 B9R1.11 CNC(=O)[C@@H]1CCCN1 CS-WAA0154 [0,0,0,1,0,0|2,0,1]=4 18 B9R1.11 COC(=O)C1=CCCC1 CS-D0999 [0,0,0,1,0,0|0,0,0]=1 19 B9R1.11 COC(=O)C1=CN=CO1 CS-0044071 [0,0,0,1,0,0|2,0,1]=4 20 B9R1.11 COC(=O)C1=CN=CS1 CS-M1604 [0,0,0,1,0,0|2,0,1]=4 21 B9R1.11 COC(=O)C1=CNC=C1 CS-W008624 [0,0,0,1,0,0|1,0,2]=4 22 B9R1.11 COC(=O)C1=CNN=C1 CS-W005446 [0,0,0,1,0,0|2,0,1]=4 23 B9R1.11 COC(=O)C1CCCN1 CS-W004744 [0,0,0,1,0,0|1,0,1]=3 24 B9R1.11 COC(=O)[C@@H]1CCCN1 CS-M0706 [0,0,0,1,0,0|1,0,1]=3 25 B9R1.11 [C@H]1(C(=O)OC)CCCN1 CS-W010818 [0,0,0,1,0,0|1,0,1]=3 26 B9R1.50 O=C1CCCCCCN1 CS-W022575 [0,0,0,1,0,0|1,0,2]=4 27 B6R0.1 CC#CC(=O)OC CS-0066219 [2,0,0,0,0,0|0,0,2]=4 28 B6R0.1 COC(=O)CCBr CS-W008728 [2,0,0,0,0,0|1,0,0]=3 29 B6R0.1 COC(=O)\C=C\I CS-0042162 [2,0,0,0,0,0|1,0,0]=3 30 B6R0.4 CC(=O)NCCN CS-W013694 [2,0,0,0,0,0|2,0,0]=4 31 B6R0.4 CC(=O)NCCO CS-W013689 [2,0,0,0,0,0|2,0,0]=4 32 B6R0.4 CCOCC(=O)O CS-0071579 [2,0,0,0,0,0|1,0,1]=4 33 B6R0.4 CO\C=C\C(C)=O CS-W013712 [2,0,0,0,0,0|1,0,0]=3 34 B6R0.4 O=C(O)CCCBr CS-W016047 [2,0,0,0,0,0|1,0,1]=4 35 B8R0.3 CCC[C@@H](N)C(=O)OC CS-M2701 [1,1,0,0,0,0|0,0,1]=3 36 B8R0.3 CCOC(=O)C(=O)CC CS-W005382 [1,1,0,0,0,0|2,0,0]=4 37 B8R0.19 CCC(=O)CC(=O)CC CS-W013466 [1,1,0,0,0,0|1,0,1]=4 38 B8R0.19 CN\C(C)=C\C(=O)OC CS-M1728 [1,1,0,0,0,0|1,0,0]=3 39 B8R0.5 CCC\C(C)=C\C(=O)O CS-0072967 [1,1,0,0,0,0|0,0,0]=2 40 B8R0.28 CN(C)C\C=C\C(=O)O CS-M0298 [1,1,0,0,0,0|1,0,0]=3 41 B10R0.1 CCOC(=O)CCCCCO CS-W023138 [0,2,0,0,0,0|0,0,2]=4 42 B10R0.18 C#CCCC(=O)CC(=O)OC CS-0038476 [0,2,0,0,0,0|0,0,2]=4 43 B8R1.1 O=C1N[C@@H](CO)CO1 CS-0067476 [1,0,0,1,0,0|2,0,0]=4 44 B8R1.7 O=C(O)C1=CCCC1 CS-W005540 [1,0,0,1,0,0|0,0,0]=2 45 B8R1.7 O=C(O)C1CCCN1 CS-W013624 [1,0,0,1,0,0|1,0,1]=4 46 B8R1.7 O=C(O)C1CCCO1 CS-W018496 [1,0,0,1,0,0|1,0,1]=4 47 B8R1.34 O=C(O)CC1CCC1 CS-D0460 [1,0,0,1,0,0|0,0,2]=4 48 B10R1.14 COC(=O)C1=CC(O)NN1 CS-0035734 [0,1,0,1,0,0|2,0,0]=4 49 B10R1.14 COC(=O)C1=CC=C(C)O1 CS-W005869 [0,1,0,1,0,0|0,0,2]=4 50 B10R1.14 COC(=O)C1=COC(C)=C1 CS-W022870 [0,1,0,1,0,0|1,0,1]=4 51 B10R1.14 COC(=O)C1CCC(N)C1 CS-W006920 [0,1,0,1,0,0|0,0,2]=4 52 B10R1.14 COC(=O)[C@@H]1C=C[C@H](N)C1 CS-M2482 [0,1,0,1,0,0|0,0,2]=4 53 B10R1.14 COC(=O)[C@@H]1C[C@@H](O)CN1 CS-M0623 [0,1,0,1,0,0|1,0,1]=4 54 B10R1.14 COC(=O)[C@@H]1C[C@H](O)CN1 CS-W017145 [0,1,0,1,0,0|1,0,1]=4 55 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 CS-M0680 [0,1,0,1,0,0|1,0,1]=4 56 B10R1.14 [C@@H]1(O)CN[C@@H](C(=O)OC)C1 CS-W006629 [0,1,0,1,0,0|1,0,1]=4 57 B10R1.11 CCOC(=O)[C@H]1CCCN1 CS-0080165 [0,1,0,1,0,0|1,0,1]=4 58 B10R1.130 CCCC1=CC(=O)OC1O CS-B0865 [0,1,0,1,0,0|0,0,0]=2 59 B10R1.137 CCOC(=O)CC1CCC1 CS-D0101 [0,1,0,1,0,0|0,0,2]=4 60 B10R1.15 COC(=O)C1CCCCC1 CS-W007704 [0,1,0,1,0,0|0,0,2]=4 61 B10R1.15 COC(=O)C1CCCCN1 CS-0043132 [0,1,0,1,0,0|0,0,2]=4 62 B10R1.15 COC(=O)C1CCCNC1 CS-0042814 [0,1,0,1,0,0|0,0,2]=4 63 B10R1.15 COC(=O)C1CCNCC1 CS-W016419 [0,1,0,1,0,0|0,0,2]=4 64 B10R1.15 COC(=O)C1CNCCN1 CS-0094441 [0,1,0,1,0,0|1,0,1]=4 65 B10R1.15 COC(=O)C1COCCN1 CS-D1697 [0,1,0,1,0,0|1,0,1]=4 66 B10R1.15 COC(=O)[C@@H]1CCCNC1 CS-0040391 [0,1,0,1,0,0|0,0,2]=4 67 B10R1.15 COC(=O)[C@H]1CCCCN1 CS-D1721 [0,1,0,1,0,0|0,0,2]=4 68 B10R1.15 COC(=O)[C@H]1COCCN1 CS-0109445 [0,1,0,1,0,0|1,0,1]=4 69 B10R1.15 [C@@H]1(C(=O)OC)COCCN1 CS-0044006 [0,1,0,1,0,0|1,0,1]=4 70 B10R1.411 COC(=O)C1(N)CCCC1 CS-B0437 [0,1,0,1,0,0|0,0,2]=4 71 B10R1.149 COC(=O)C1=C(C)N=CS1 CS-W002405 [0,1,0,1,0,0|1,0,1]=4 72 B10R1.149 COC(=O)C1=CN=CN1C CS-W016465 [0,1,0,1,0,0|1,0,1]=4 73 B10R1.149 COC(=O)C1=CNN=C1C CS-W022835 [0,1,0,1,0,0|1,0,1]=4