0 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 CS-0152462 [0,0,0,0,0,0|1,0,2]=3 1 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 CS-0066796 [0,0,0,0,0,0|0,0,2]=2 2 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 CS-W002049 [0,0,0,0,0,0|0,0,2]=2 3 B13R1.42 CCOC(=O)CCC1=NC=CC=C1 CS-0006559 [0,0,0,0,0,0|1,0,2]=3 4 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 CS-0110084 [0,0,0,0,0,0|1,0,1]=2 5 B13R1.42 CCOC(=O)COC1=CC=CC=C1 CS-0037469 [0,0,0,0,0,0|1,0,1]=2 6 B13R1.42 CCOC(=O)CSC1=CC=CC=C1 CS-W010589 [0,0,0,0,0,0|1,0,1]=2 7 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 CS-0356392 [0,0,0,0,0,0|0,0,0]=0 8 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 CS-W020629 [0,0,0,0,0,0|0,0,0]=0 9 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=N1 CS-0036494 [0,0,0,0,0,0|1,0,0]=1 10 B13R1.42 CCOC(=O)\C=C\C1=CC=CN=C1 CS-0088304 [0,0,0,0,0,0|1,0,0]=1 11 B13R1.42 CNCC(=O)OCC1=CC=CC=C1 CS-0079911 [0,0,0,0,0,0|3,0,1]=4 12 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 CS-0210608 [0,0,0,0,0,0|3,0,1]=4 13 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 CS-W009807 [0,0,0,0,0,0|3,0,1]=4 14 B13R1.42 O=C(CCBr)OCC1=CC=CC=C1 CS-0044117 [0,0,0,0,0,0|3,0,1]=4 15 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 CS-0156247 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.27 CCC(=O)OCC1=CC=CC=C1 CS-0017193 [1,0,0,0,0,0|1,0,1]=3 17 B12R1.27 COC(=O)C#CC1=CC=CC=C1 CS-0063867 [1,0,0,0,0,0|0,0,2]=3 18 B12R1.27 COC(=O)C#CC1=CC=CC=N1 CS-0036606 [1,0,0,0,0,0|1,0,2]=4 19 B12R1.27 COC(=O)CCC1=CC=CC=C1 CS-W007828 [1,0,0,0,0,0|0,0,2]=3 20 B12R1.27 COC(=O)CCC1=CC=CC=N1 CS-0150699 [1,0,0,0,0,0|1,0,2]=4 21 B12R1.27 COC(=O)CCC1=CC=NC=C1 CS-0213157 [1,0,0,0,0,0|1,0,2]=4 22 B12R1.27 COC(=O)CCC1=CN=CC=C1 CS-0150698 [1,0,0,0,0,0|1,0,2]=4 23 B12R1.27 COC(=O)COC1=CC=CC=C1 CS-W016060 [1,0,0,0,0,0|1,0,1]=3 24 B12R1.27 COC(=O)CSC1=CC=CC=C1 CS-W017097 [1,0,0,0,0,0|1,0,1]=3 25 B12R1.27 COC(=O)NCC1=CC=CC=C1 CS-0150648 [1,0,0,0,0,0|1,0,1]=3 26 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 CS-0058614 [1,0,0,0,0,0|0,0,0]=1 27 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 CS-W017928 [1,0,0,0,0,0|0,0,0]=1 28 B12R1.27 COC(=O)\C=C\C1=CC=NC=C1 CS-0166759 [1,0,0,0,0,0|1,0,0]=2 29 B12R1.27 COC(=O)\C=C\C1=CC=NC=C1 CS-0777458 [1,0,0,0,0,0|1,0,0]=2 30 B12R1.27 NCC(=O)OCC1=CC=CC=C1 CS-W005117 [1,0,0,0,0,0|2,0,1]=4 31 B12R1.27 NCC(=O)OCC1=CC=CC=C1 CS-W011916 [1,0,0,0,0,0|2,0,1]=4 32 B12R1.27 O=C(CBr)CCC1=CC=CC=C1 CS-W019479 [1,0,0,0,0,0|1,0,2]=4 33 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 CS-0661942 [1,0,0,0,0,0|2,0,1]=4 34 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 CS-W010391 [1,0,0,0,0,0|2,0,1]=4 35 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 CS-0033864 [1,0,0,0,0,0|2,0,1]=4 36 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 CS-0171366 [1,0,0,0,0,0|2,0,1]=4 37 B12R1.27 O=C(CO)OCC1=CC=CC=C1 CS-W007485 [1,0,0,0,0,0|2,0,1]=4 38 B12R1.27 O=C(\C=C\C1=CC=CC=C1)O[K] CS-0159621 [1,0,0,0,0,0|1,0,0]=2 39 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=C1 CS-W007617 [0,1,0,0,0,0|0,0,1]=2 40 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=N1 CS-W004737 [0,1,0,0,0,0|1,0,1]=3 41 B14R1.29 CCOC(=O)CC(=O)C1=CC=CN=C1 CS-0054614 [0,1,0,0,0,0|1,0,1]=3 42 B14R1.29 CCOC(=O)CC(=O)C1=CC=NC=C1 CS-W002366 [0,1,0,0,0,0|1,0,1]=3 43 B14R1.29 CCOC(=O)CC(=O)C1=NC=CN=C1 CS-0044465 [0,1,0,0,0,0|2,0,1]=4 44 B14R1.29 CCOC(=O)\C=C(/C)C1=CC=CC=C1 CS-0098920 [0,1,0,0,0,0|0,0,0]=1 45 B14R1.32 CCOC(=O)CCC1=CC(C)=CC=C1 CS-M2098 [0,1,0,0,0,0|0,0,2]=3 46 B14R1.32 CCOC(=O)CNC1=CC=CC(F)=C1 CS-0209776 [0,1,0,0,0,0|1,0,1]=3 47 B14R1.32 CCOC(=O)\C=C\C1=CC(N)=CC=C1 CS-0172249 [0,1,0,0,0,0|0,0,0]=1 48 B14R1.32 CCOC(=O)\C=C\C1=CC=CC(Br)=C1 CS-0212814 [0,1,0,0,0,0|0,0,0]=1 49 B14R1.60 CCOC(=O)C(=O)NC1=NC=CC=C1 CS-0255352 [0,1,0,0,0,0|2,0,0]=3 50 B14R1.60 CCOC(=O)C(N)CC1=CC=CC=C1 CS-0151880 [0,1,0,0,0,0|0,0,2]=3 51 B14R1.60 CCOC(=O)C(N)CC1=NC=CC=C1 CS-B1083 [0,1,0,0,0,0|1,0,2]=4 52 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 CS-W012971 [0,1,0,0,0,0|0,0,2]=3 53 B14R1.60 CCOC(=O)[C@H](N)CC1=CC=CC=C1 CS-0151923 [0,1,0,0,0,0|0,0,2]=3 54 B14R1.156 C(C(=O)OCC=C)=CC1=CC=CC=C1 CS-W016797 [0,1,0,0,0,0|0,0,1]=2 55 B14R1.156 NCCCC(=O)OCC1=CC=CC=C1 CS-0156248 [0,1,0,0,0,0|2,0,1]=4 56 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 CS-W005160 [0,1,0,0,0,0|2,0,1]=4 57 B14R1.156 O=C(CCCBr)OCC1=CC=CC=C1 CS-W018907 [0,1,0,0,0,0|2,0,1]=4 58 B14R1.156 O=C(CCCO)OCC1=CC=CC=C1 CS-0047314 [0,1,0,0,0,0|2,0,1]=4 59 B14R1.156 O=C(NCCBr)OCC1=CC=CC=C1 CS-W001870 [0,1,0,0,0,0|2,0,1]=4 60 B14R1.156 O=C(NCCI)OCC1=CC=CC=C1 CS-0208775 [0,1,0,0,0,0|2,0,1]=4 61 B14R1.156 O=C(NCCO)OCC1=CC=CC=C1 CS-W004853 [0,1,0,0,0,0|2,0,1]=4 62 B14R1.502 C(C(=O)OCC)=CC1=CNC(=N)C=C1 CS-W015812 [0,1,0,0,0,0|1,0,0]=2 63 B14R1.502 CCOC(=O)C#CC1=CC=C(C)C=C1 CS-0347733 [0,1,0,0,0,0|0,0,2]=3 64 B14R1.502 CCOC(=O)C#CC1=CC=C(F)C=C1 CS-0298737 [0,1,0,0,0,0|0,0,2]=3 65 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 CS-W012554 [0,1,0,0,0,0|0,0,2]=3 66 B14R1.502 CCOC(=O)CCC1=CC=C(Cl)C=C1 CS-M2499 [0,1,0,0,0,0|0,0,2]=3 67 B14R1.502 CCOC(=O)CCC1=CC=C(O)C=C1 CS-W015741 [0,1,0,0,0,0|0,0,2]=3 68 B14R1.502 CCOC(=O)CNC1=CC=C(F)C=C1 CS-0307789 [0,1,0,0,0,0|1,0,1]=3 69 B14R1.502 CCOC(=O)COC1=CC=C(C)C=C1 CS-0315685 [0,1,0,0,0,0|1,0,1]=3 70 B14R1.502 CCOC(=O)COC1=CC=C(O)C=C1 CS-M0586 [0,1,0,0,0,0|1,0,1]=3 71 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 CS-0047571 [0,1,0,0,0,0|0,0,0]=1 72 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 CS-W021127 [0,1,0,0,0,0|0,0,0]=1 73 B14R1.502 CCOC(=O)\C=C\C1=CC=C(C)C=C1 CS-0308791 [0,1,0,0,0,0|0,0,0]=1 74 B14R1.502 CCOC(=O)\C=C\C1=CC=C(F)C=C1 CS-0645506 [0,1,0,0,0,0|0,0,0]=1 75 B14R1.502 CCOC(=O)\C=C\C1=CC=C(N)C=C1 CS-W013217 [0,1,0,0,0,0|0,0,0]=1 76 B14R1.598 CCOC(=O)CCC1=CC=CC=C1Br CS-0151588 [0,1,0,0,0,0|0,0,2]=3 77 B14R1.598 CCOC(=O)\C=C\C1=CC=CC=C1Br CS-0254009 [0,1,0,0,0,0|0,0,0]=1 78 B14R2.21 O=C1CCCC(C2=CC=CC=C2)C1 CS-0341801 [0,0,0,1,0,0|1,0,2]=4 79 B14R2.30 O=C1NCCN1CC2=CC=CC=C2 CS-0217002 [0,0,0,1,0,0|2,0,1]=4 80 B14R2.112 CCOC1=CC2=CC=CC=C2C=C1 CS-W010770 [0,0,0,1,0,0|1,0,0]=2 81 B14R2.112 CNCC1=CC=C2C=CC=CC2=C1 CS-0045366 [0,0,0,1,0,0|3,0,0]=4 82 B14R2.112 OCCC1=CC=C2C=CC=CC2=C1 CS-0137971 [0,0,0,1,0,0|3,0,0]=4 83 B14R2.112 OCCC1=NC2=CC=CC=C2C=C1 CS-D0103 [0,0,0,1,0,0|3,0,0]=4 84 B14R2.203 CC[N+]1=C(C)C=CC2=CC=CC=C21 CS-0182951 [0,0,0,1,0,0|2,0,0]=3 85 B14R2.203 COC1=C2C=CC=CC2=CC=C1Br CS-0041682 [0,0,0,1,0,0|3,0,0]=4 86 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 CS-0059145 [0,0,0,1,0,0|2,0,1]=4 87 B14R2.598 O=C1C=C(C2=CC=CC=C2)C(=O)O1 CS-W008262 [0,0,0,1,0,0|1,0,1]=3 88 B12R1.32 CCCC(=O)CC1=CC=CC=C1 CS-W016112 [0,0,0,0,1,0|1,0,1]=3 89 B12R1.32 CCOC(=O)CC1=CC=NC=C1 CS-W017889 [0,0,0,0,1,0|1,0,1]=3 90 B12R1.32 CCOC(=O)CC1=CC=NC=N1 CS-0054939 [0,0,0,0,1,0|2,0,1]=4 91 B12R1.32 CCOC(=O)CC1=CN=CC=C1 CS-W002001 [0,0,0,0,1,0|1,0,1]=3 92 B12R1.32 CCOC(=O)CC1=NC=CC=C1 CS-0020135 [0,0,0,0,1,0|1,0,1]=3 93 B12R1.32 CCOC(=O)CC1=NC=CC=N1 CS-W003699 [0,0,0,0,1,0|2,0,1]=4 94 B12R1.32 CCOC(=O)CC1=NN=CC=C1 CS-0049523 [0,0,0,0,1,0|2,0,1]=4 95 B12R1.32 CCOC(=O)C[N+]1=CC=CC=C1 CS-0151874 [0,0,0,0,1,0|1,0,1]=3 96 B12R1.32 CCOC(=O)NC1=CC=NC=C1 CS-0028344 [0,0,0,0,1,0|2,0,0]=3 97 B12R1.32 O=C(CCBr)NC1=CC=CC=C1 CS-0079928 [0,0,0,0,1,0|3,0,0]=4 98 B12R1.51 CCOC(=O)\C=C\C1=CN=CS1 CS-0159429 [0,0,0,0,1,0|2,0,0]=3 99 B14R1.520 CCCC(=O)OCCC1=CC=CC=C1 CS-0526537 [0,0,0,0,0,1|1,0,2]=4 100 B14R1.520 CCOC(=O)CCCC1=CC=CC=C1 CS-W010703 [0,0,0,0,0,1|0,0,2]=3 101 B14R1.520 CCOC(=O)CCNC1=NC=CC=C1 CS-M2454 [0,0,0,0,0,1|1,0,2]=4 102 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 CS-M0975 [0,0,0,0,0,1|0,0,2]=3 103 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 CS-W010686 [0,0,0,0,0,1|0,0,2]=3 104 B14R1.520 CCOC(=O)COCC1=CC=CC=C1 CS-0136694 [0,0,0,0,0,1|0,0,2]=3 105 B11R1.28 CCO\C=N\C1=CC=CC=C1 CS-W001215 [2,0,0,0,0,0|1,0,0]=3 106 B11R1.28 CNC\C=C\C1=CC=CC=C1 CS-0236559 [2,0,0,0,0,0|1,0,1]=4 107 B11R1.91 CC(=O)C#CC1=CC=CC=C1 CS-W004450 [2,0,0,0,0,0|0,0,2]=4 108 B11R1.91 CC(=O)CCC1=CC=CC=C1 CS-W016332 [2,0,0,0,0,0|0,0,2]=4 109 B11R1.91 CC(=O)COC1=CC=CC=C1 CS-0066530 [2,0,0,0,0,0|1,0,1]=4 110 B11R1.91 CC(=O)NCC1=CC=CC=C1 CS-0044769 [2,0,0,0,0,0|1,0,1]=4 111 B11R1.91 CC(=O)NNC1=CC=CC=C1 CS-W018141 [2,0,0,0,0,0|2,0,0]=4 112 B11R1.91 CC(=O)OCC1=CC=CC=C1 CS-W018145 [2,0,0,0,0,0|1,0,1]=4 113 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 CS-0031350 [2,0,0,0,0,0|0,0,0]=2 114 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 CS-W013311 [2,0,0,0,0,0|0,0,0]=2 115 B11R1.91 O=C(O)C#CC1=CC=CC=C1 CS-W007319 [2,0,0,0,0,0|0,0,2]=4 116 B11R1.91 O=C(O)CCC1=CC=CC=C1 CS-W019781 [2,0,0,0,0,0|0,0,2]=4 117 B11R1.91 O=C(O)CNC1=CC=CC=C1 CS-W016312 [2,0,0,0,0,0|1,0,1]=4 118 B11R1.91 O=C(O)COC1=CC=CC=C1 CS-0013736 [2,0,0,0,0,0|1,0,1]=4 119 B11R1.91 O=C(O)CSC1=CC=CC=C1 CS-W016037 [2,0,0,0,0,0|1,0,1]=4 120 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 CS-0009610 [2,0,0,0,0,0|0,0,0]=2 121 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 CS-W020005 [2,0,0,0,0,0|0,0,0]=2 122 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 CS-0031477 [2,0,0,0,0,0|1,0,0]=3 123 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 CS-W018179 [2,0,0,0,0,0|1,0,0]=3 124 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 CS-0132417 [2,0,0,0,0,0|1,0,0]=3 125 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 CS-W021781 [2,0,0,0,0,0|1,0,0]=3 126 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 CS-W021780 [2,0,0,0,0,0|1,0,0]=3 127 B11R1.91 O=C(O)\C=C\C1=NC=CN=C1 CS-0109600 [2,0,0,0,0,0|2,0,0]=4 128 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 CS-0031474 [2,0,0,0,0,0|1,0,1]=4 129 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 CS-W007478 [2,0,0,0,0,0|1,0,1]=4 130 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 CS-0033829 [2,0,0,0,0,0|1,0,1]=4 131 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 CS-0106351 [2,0,0,0,0,0|1,0,1]=4 132 B13R1.337 CC(=O)OC\C=C\C1=CC=CC=C1 CS-W017407 [1,1,0,0,0,0|0,0,2]=4 133 B13R1.11 CCC(=O)CC(=O)C1=CC=CC=C1 CS-0040402 [1,1,0,0,0,0|0,0,1]=3 134 B13R1.11 COC(=O)CC(=O)C1=CC=CC=C1 CS-0019251 [1,1,0,0,0,0|0,0,1]=3 135 B13R1.11 COC(=O)CC(=O)C1=CC=CC=N1 CS-W023135 [1,1,0,0,0,0|1,0,1]=4 136 B13R1.11 COC(=O)CC(=O)C1=CC=CN=C1 CS-0103379 [1,1,0,0,0,0|1,0,1]=4 137 B13R1.11 COC(=O)CC(=O)C1=CC=NC=C1 CS-0037567 [1,1,0,0,0,0|1,0,1]=4 138 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 CS-0031374 [1,1,0,0,0,0|0,0,2]=4 139 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 CS-0031396 [1,1,0,0,0,0|0,0,2]=4 140 B13R1.14 C(C(=O)OC)=CC1=CC=C(Br)C=C1 CS-W010285 [1,1,0,0,0,0|0,0,0]=2 141 B13R1.14 COC(=O)C#CC1=CC=C(Br)C=C1 CS-0310595 [1,1,0,0,0,0|0,0,2]=4 142 B13R1.14 COC(=O)C#CC1=CC=C(F)C=C1 CS-0163429 [1,1,0,0,0,0|0,0,2]=4 143 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 CS-D0634 [1,1,0,0,0,0|0,0,2]=4 144 B13R1.14 COC(=O)CCC1=CC=C(Cl)C=C1 CS-0061883 [1,1,0,0,0,0|0,0,2]=4 145 B13R1.14 COC(=O)CCC1=CC=C(I)C=C1 CS-0142972 [1,1,0,0,0,0|0,0,2]=4 146 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 CS-0091630 [1,1,0,0,0,0|0,0,2]=4 147 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 CS-W017209 [1,1,0,0,0,0|0,0,2]=4 148 B13R1.14 COC(=O)COC1=CC=C(Cl)C=C1 CS-0161624 [1,1,0,0,0,0|1,0,1]=4 149 B13R1.14 COC(=O)COC1=CC=C(F)C=C1 CS-0904348 [1,1,0,0,0,0|1,0,1]=4 150 B13R1.14 COC(=O)COC1=CC=C(N)C=C1 CS-0187807 [1,1,0,0,0,0|1,0,1]=4 151 B13R1.14 COC(=O)\C=C\C1=CC=C(Br)C=C1 CS-0166760 [1,1,0,0,0,0|0,0,0]=2 152 B13R1.14 COC(=O)\C=C\C1=CC=C(O)C=C1 CS-0022763 [1,1,0,0,0,0|0,0,0]=2 153 B13R1.14 COC(=O)\C=C\C1=CC=C(O)C=C1 CS-W020031 [1,1,0,0,0,0|0,0,0]=2 154 B13R1.15 COC(=O)CCC1=CC(F)=CC=C1 CS-0452462 [1,1,0,0,0,0|0,0,2]=4 155 B13R1.15 COC(=O)CCC1=CC=CC(Br)=C1 CS-W022812 [1,1,0,0,0,0|0,0,2]=4 156 B13R1.15 COC(=O)CCC1=CC=CC(O)=C1 CS-0131489 [1,1,0,0,0,0|0,0,2]=4 157 B13R1.15 COC(=O)COC1=CC(Cl)=CC=C1 CS-0570308 [1,1,0,0,0,0|1,0,1]=4 158 B13R1.15 COC(=O)\C=C\C1=CC(N)=CC=C1 CS-0036729 [1,1,0,0,0,0|0,0,0]=2 159 B13R1.15 COC(=O)\C=C\C1=CC=CC(Br)=C1 CS-0042333 [1,1,0,0,0,0|0,0,0]=2 160 B13R1.15 COC(=O)\C=C\C1=CC=CC(Br)=C1 CS-0173266 [1,1,0,0,0,0|0,0,0]=2 161 B13R1.135 COC(=O)C(Br)CC1=CC=CC=C1 CS-0199086 [1,1,0,0,0,0|0,0,2]=4 162 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 CS-W022742 [1,1,0,0,0,0|0,0,2]=4 163 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 CS-W018849 [1,1,0,0,0,0|0,0,2]=4 164 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 CS-0010907 [1,1,0,0,0,0|0,0,2]=4 165 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 CS-W019793 [1,1,0,0,0,0|0,0,2]=4 166 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 CS-W020565 [1,1,0,0,0,0|0,0,2]=4 167 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 CS-W019028 [1,1,0,0,0,0|0,0,2]=4 168 B13R1.135 O=C(CC1=CC=CC=C1)C(=O)O[Na] CS-W016919 [1,1,0,0,0,0|1,0,1]=4 169 B13R1.135 [C@H](O)(CC1=CC=CC=C1)C(=O)OC CS-W007891 [1,1,0,0,0,0|0,0,2]=4 170 B13R1.351 CC(O)C(=O)OCC1=CC=CC=C1 CS-W017200 [1,1,0,0,0,0|1,0,1]=4 171 B13R1.351 C[C@@H](O)C(=O)OCC1=CC=CC=C1 CS-0115191 [1,1,0,0,0,0|1,0,1]=4 172 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 CS-W011863 [1,1,0,0,0,0|1,0,1]=4 173 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 CS-W020701 [1,1,0,0,0,0|1,0,1]=4 174 B13R1.351 C[C@H](O)C(=O)OCC1=CC=CC=C1 CS-0045408 [1,1,0,0,0,0|1,0,1]=4 175 B13R1.351 O=C(O)C(=O)\C=C\C1=CC=CC=C1 CS-0235779 [1,1,0,0,0,0|1,0,1]=4 176 B13R1.351 [C@H](C)(N)C(=O)OCC1=CC=CC=C1 CS-W011862 [1,1,0,0,0,0|1,0,1]=4 177 B13R1.417 COC(\C=C\C1=CC=CC=C1)OC CS-0887443 [1,1,0,0,0,0|0,0,2]=4 178 B13R1.528 COC(=O)CCC1=CC=CC=C1Br CS-W010269 [1,1,0,0,0,0|0,0,2]=4 179 B13R1.528 COC(=O)CCC1=CC=CC=C1F CS-0208728 [1,1,0,0,0,0|0,0,2]=4 180 B13R1.528 COC(=O)CCC1=CC=CC=C1O CS-0356885 [1,1,0,0,0,0|0,0,2]=4 181 B13R1.528 COC(=O)\C=C\C1=CC=CC=C1Br CS-0150954 [1,1,0,0,0,0|0,0,0]=2 182 B13R1.528 COC(=O)\C=C\C1=CC=CC=C1N CS-0102068 [1,1,0,0,0,0|0,0,0]=2 183 B13R1.19 CCNC(=O)NC1=CC=C(Br)C=C1 CS-M2093 [0,1,0,0,1,0|2,0,0]=4 184 B13R1.19 CCOC(=O)CC1=CC=C(Br)C=C1 CS-W018540 [0,1,0,0,1,0|0,0,1]=3 185 B13R1.19 CCOC(=O)CC1=CC=C(Br)C=N1 CS-0049532 [0,1,0,0,1,0|1,0,1]=4 186 B13R1.19 CCOC(=O)CC1=CC=C(C)C=C1 CS-W017316 [0,1,0,0,1,0|0,0,1]=3 187 B13R1.19 CCOC(=O)CC1=CC=C(C)N=C1 CS-0158920 [0,1,0,0,1,0|1,0,1]=4 188 B13R1.19 CCOC(=O)CC1=CC=C(Cl)C=C1 CS-W022691 [0,1,0,0,1,0|0,0,1]=3 189 B13R1.19 CCOC(=O)CC1=CC=C(Cl)N=C1 CS-0063168 [0,1,0,0,1,0|1,0,1]=4 190 B13R1.19 CCOC(=O)CC1=CC=C(F)C=C1 CS-W022645 [0,1,0,0,1,0|0,0,1]=3 191 B13R1.19 CCOC(=O)CC1=CC=C(I)C=C1 CS-0084634 [0,1,0,0,1,0|0,0,1]=3 192 B13R1.19 CCOC(=O)CC1=CC=C(N)C=C1 CS-0043119 [0,1,0,0,1,0|0,0,1]=3 193 B13R1.19 CCOC(=O)CC1=CC=C(N)C=N1 CS-0049533 [0,1,0,0,1,0|1,0,1]=4 194 B13R1.19 CCOC(=O)CC1=CC=C(N)N=C1 CS-0042619 [0,1,0,0,1,0|1,0,1]=4 195 B13R1.19 CCOC(=O)CC1=CC=C(O)C=C1 CS-W017199 [0,1,0,0,1,0|0,0,1]=3 196 B13R1.19 CCOC(=O)CC1=CC=C(O)N=C1 CS-0187398 [0,1,0,0,1,0|1,0,1]=4 197 B13R1.19 CCOC(=O)CC1=NC=C(F)C=C1 CS-0439697 [0,1,0,0,1,0|1,0,1]=4 198 B13R1.20 CCCC(=O)NC1=CC=CC(Br)=C1 CS-1195254 [0,1,0,0,1,0|2,0,0]=4 199 B13R1.20 CCOC(=O)CC1=CC(Br)=CC=C1 CS-W006014 [0,1,0,0,1,0|0,0,1]=3 200 B13R1.20 CCOC(=O)CC1=CC(Cl)=CC=C1 CS-0151603 [0,1,0,0,1,0|0,0,1]=3 201 B13R1.20 CCOC(=O)CC1=CC(Cl)=NC=C1 CS-0148583 [0,1,0,0,1,0|1,0,1]=4 202 B13R1.20 CCOC(=O)CC1=CC=CC(C)=C1 CS-0299099 [0,1,0,0,1,0|0,0,1]=3 203 B13R1.20 CCOC(=O)CC1=CC=CC(C)=N1 CS-W006746 [0,1,0,0,1,0|1,0,1]=4 204 B13R1.20 CCOC(=O)CC1=CC=CC(N)=C1 CS-0434687 [0,1,0,0,1,0|0,0,1]=3 205 B13R1.20 CCOC(=O)CC1=CC=CC(O)=C1 CS-0030409 [0,1,0,0,1,0|0,0,1]=3 206 B13R1.20 CCOC(=O)CC1=NC(Br)=CC=C1 CS-0041503 [0,1,0,0,1,0|1,0,1]=4 207 B13R1.20 CCOC(=O)CC1=NC(Cl)=CC=C1 CS-0042620 [0,1,0,0,1,0|1,0,1]=4 208 B13R1.20 CCOC(=O)CC1=NC(N)=CC=C1 CS-W019072 [0,1,0,0,1,0|1,0,1]=4 209 B13R1.20 CCOC(=O)CC1=NC=CC(Br)=C1 CS-W020454 [0,1,0,0,1,0|1,0,1]=4 210 B13R1.20 CCOC(=O)NC1=CC=CC(O)=C1 CS-0116794 [0,1,0,0,1,0|1,0,0]=3 211 B13R1.47 CCOC(=O)C(=O)C1=CC=CC=C1 CS-W017334 [0,1,0,0,1,0|0,0,0]=2 212 B13R1.47 CCOC(=O)C(C)C1=CC=CC=C1 CS-0151890 [0,1,0,0,1,0|0,0,1]=3 213 B13R1.47 CCOC(=O)C(Cl)C1=CC=CC=C1 CS-0151885 [0,1,0,0,1,0|0,0,1]=3 214 B13R1.47 CCOC(=O)C(N)C1=CC=CC=C1 CS-0212048 [0,1,0,0,1,0|0,0,1]=3 215 B13R1.47 CCOC(=O)C(N)C1=NC=CC=C1 CS-0045379 [0,1,0,0,1,0|1,0,1]=4 216 B13R1.47 CCOC(=O)C(O)C1=CC=CC=C1 CS-0071062 [0,1,0,0,1,0|0,0,1]=3 217 B13R1.47 CCOC(=O)[C@@H](N)C1=CC=CC=C1 CS-0097338 [0,1,0,0,1,0|0,0,1]=3 218 B13R1.47 CCOC(=O)[C@@H](O)C1=CC=CC=C1 CS-0143523 [0,1,0,0,1,0|0,0,1]=3 219 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 CS-W014884 [0,1,0,0,1,0|0,0,1]=3 220 B13R1.47 CCOC(=O)[C@H](O)C1=CC=CC=C1 CS-0143521 [0,1,0,0,1,0|0,0,1]=3 221 B13R1.348 CC(C)CC(=O)CC1=CC=CC=C1 CS-W022210 [0,1,0,0,1,0|1,0,1]=4 222 B13R1.470 CCOC(=O)CC1=C(Br)C=NC=C1 CS-B0995 [0,1,0,0,1,0|1,0,1]=4 223 B13R1.470 CCOC(=O)CC1=C(Cl)C=CC=C1 CS-0043127 [0,1,0,0,1,0|0,0,1]=3 224 B13R1.470 CCOC(=O)CC1=CC=CC=C1Br CS-0151599 [0,1,0,0,1,0|0,0,1]=3 225 B13R1.470 CCOC(=O)CC1=CC=CC=C1C CS-0197207 [0,1,0,0,1,0|0,0,1]=3 226 B13R1.470 CCOC(=O)CC1=CC=CC=C1F CS-0100656 [0,1,0,0,1,0|0,0,1]=3 227 B13R1.470 CCOC(=O)CC1=CC=CC=C1I CS-0041136 [0,1,0,0,1,0|0,0,1]=3 228 B13R1.470 CCOC(=O)CC1=CC=CC=C1O CS-0141926 [0,1,0,0,1,0|0,0,1]=3 229 B13R1.470 CCOC(=O)CC1=CC=CN=C1Cl CS-0049541 [0,1,0,0,1,0|1,0,1]=4 230 B13R1.470 CCOC(=O)CC1=NC=CC=C1Br CS-0041501 [0,1,0,0,1,0|1,0,1]=4 231 B13R1.33 CCOC(=O)CC(=O)C1=CC=CN1 CS-0163120 [0,1,0,0,1,0|1,0,1]=4 232 B13R1.33 CCOC(=O)CC(=O)C1=CC=CO1 CS-0067857 [0,1,0,0,1,0|1,0,1]=4 233 B13R1.33 CCOC(=O)CC(=O)C1=CC=CS1 CS-W005116 [0,1,0,0,1,0|1,0,1]=4 234 B13R1.33 CCOC(=O)CC(=O)C1=CSC=C1 CS-0042835 [0,1,0,0,1,0|1,0,1]=4 235 B15R1.89 CCOC(=O)CCC(=O)C1=CC=CC=C1 CS-0240118 [0,1,0,0,0,1|0,0,1]=3 236 B15R1.89 CCOC(=O)CNC(=O)C1=CC=CC=C1 CS-0206786 [0,1,0,0,0,1|0,0,1]=3 237 B15R1.809 CCOC(=O)CC(=O)CC1=CC=CC=C1 CS-W018590 [0,1,0,0,0,1|0,0,1]=3 238 B15R1.826 CCOC(=O)C(=O)CCC1=CC=CC=C1 CS-W015324 [0,1,0,0,0,1|0,0,1]=3 239 B15R1.826 CCOC(=O)C(C)NCC1=CC=CC=C1 CS-0277782 [0,1,0,0,0,1|0,0,2]=4 240 B15R1.826 CCOC(=O)[C@@H](N)CCC1=CC=CC=C1 CS-W002491 [0,1,0,0,0,1|0,0,2]=4 241 B15R1.826 CCOC(=O)[C@@H](O)CCC1=CC=CC=C1 CS-0227146 [0,1,0,0,0,1|0,0,2]=4 242 B15R1.826 CCOC(=O)[C@H](O)CCC1=CC=CC=C1 CS-W015213 [0,1,0,0,0,1|0,0,2]=4 243 B15R1.826 [C@@H](N)(CCC1=CC=CC=C1)C(=O)OCC CS-W014132 [0,1,0,0,0,1|0,0,2]=4 244 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Br)C=C1 CS-W007561 [0,2,0,0,0,0|0,0,1]=3 245 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(C)C=C1 CS-0042836 [0,2,0,0,0,0|0,0,1]=3 246 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Cl)C=C1 CS-W008277 [0,2,0,0,0,0|0,0,1]=3 247 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(F)C=C1 CS-M1528 [0,2,0,0,0,0|0,0,1]=3 248 B15R1.24 CCOC(=O)CC(=O)C1=CC(F)=CC=C1 CS-W015120 [0,2,0,0,0,0|0,0,1]=3 249 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(Br)=C1 CS-W022666 [0,2,0,0,0,0|0,0,1]=3 250 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(C)=C1 CS-W005940 [0,2,0,0,0,0|0,0,1]=3 251 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(Cl)=C1 CS-0099790 [0,2,0,0,0,0|0,0,1]=3 252 B15R1.24 CCOC(=O)CC(N)C1=CC(Br)=CC=C1 CS-0206644 [0,2,0,0,0,0|0,0,2]=4 253 B15R1.578 CCOC(=O)C(Br)C(=O)C1=CC=CC=C1 CS-0213479 [0,2,0,0,0,0|0,0,1]=3 254 B15R1.578 CCOC(=O)C(Br)C(Br)C1=CC=CC=C1 CS-0206377 [0,2,0,0,0,0|0,0,2]=4 255 B15R1.578 CCOC(=O)C(Cl)C(=O)C1=CC=CC=C1 CS-0230692 [0,2,0,0,0,0|0,0,1]=3 256 B15R1.807 CCOC(=O)CC(F)(F)C1=CC=CC=C1 CS-0539614 [0,2,0,0,0,0|0,0,2]=4 257 B15R1.807 CCOC(=O)CS(=O)(=O)C1=CC=CC=C1 CS-0151564 [0,2,0,0,0,0|1,0,1]=4 258 B15R1.3722 CCOC(=O)CC(=O)C1=C(Br)C=CC=C1 CS-0120279 [0,2,0,0,0,0|0,0,1]=3 259 B15R1.3722 CCOC(=O)CC(=O)C1=C(Cl)C=CC=C1 CS-W022636 [0,2,0,0,0,0|0,0,1]=3 260 B15R1.3722 CCOC(=O)CC(=O)C1=C(F)C=CC=C1 CS-0045387 [0,2,0,0,0,0|0,0,1]=3 261 B15R1.3722 CCOC(=O)CC(=O)C1=C(F)C=CC=N1 CS-0151623 [0,2,0,0,0,0|1,0,1]=4 262 B15R1.3722 CCOC(=O)CC(=O)C1=CC=CC=C1C CS-0042530 [0,2,0,0,0,0|0,0,1]=3 263 B15R1.3722 CCOC(=O)CC(N)C1=CC=CC=C1Br CS-0206777 [0,2,0,0,0,0|0,0,2]=4 264 B15R1.3858 CCOC(=O)\C=C\C1=CC(Br)=CN=C1N CS-0172250 [0,2,0,0,0,0|1,0,0]=3 265 B15R1.10389 CCOC(=O)COC1=CC=CC(C=O)=C1 CS-0319944 [0,2,0,0,0,0|1,0,1]=4 266 B15R1.10390 CCOC(=O)C#CC1=CC=C(F)C(F)=C1 CS-0347734 [0,2,0,0,0,0|0,0,2]=4 267 B15R1.10390 CCOC(=O)\C=C\C1=CC=C(O)C(O)=C1 CS-0181967 [0,2,0,0,0,0|0,0,0]=2 268 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(Br)C=C1 CS-M1143 [0,2,0,0,0,0|1,0,0]=3 269 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(C)C=C1 CS-0151549 [0,2,0,0,0,0|1,0,0]=3 270 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(F)C=C1 CS-0151548 [0,2,0,0,0,0|1,0,0]=3 271 B15R1.48 CCOC(=O)C(=O)NC1=NC=C(Cl)C=C1 CS-0092721 [0,2,0,0,0,0|2,0,0]=4 272 B15R1.48 CCOC(=O)C(=O)NC1=NC=C(Cl)C=C1 CS-M3402 [0,2,0,0,0,0|2,0,0]=4 273 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(F)C=C1 CS-0151920 [0,2,0,0,0,0|0,0,2]=4 274 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(O)C=C1 CS-0137959 [0,2,0,0,0,0|0,0,2]=4 275 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(O)C=C1 CS-W012709 [0,2,0,0,0,0|0,0,2]=4 276 B15R1.48 CCOC(=O)[C@H](N)CC1=CC=C(F)C=C1 CS-0162186 [0,2,0,0,0,0|0,0,2]=4 277 B15R1.48 CCOC(=O)[C@H](N)CC1=CC=C(O)C=C1 CS-W014122 [0,2,0,0,0,0|0,0,2]=4 278 B15R1.5919 O=C(O)CNC(=O)\C=C\C1=CC=CC=C1 CS-M1704 [0,2,0,0,0,0|1,0,1]=4 279 B15R1.791 CCOC(=O)COC1=C(Cl)C=C(Cl)C=C1 CS-0696068 [0,2,0,0,0,0|1,0,1]=4 280 B15R1.793 CCOC(=O)CCC1=CC=C(OC)C=C1 CS-0024377 [0,2,0,0,0,0|0,0,2]=4 281 B15R1.793 CCOC(=O)CNC1=CC=C(OC)C=C1 CS-0072086 [0,2,0,0,0,0|1,0,1]=4 282 B15R1.793 CCOC(=O)COC1=CC=C(C=O)C=C1 CS-0116933 [0,2,0,0,0,0|1,0,1]=4 283 B15R1.793 CCOC(=O)\C=C\C1=CC=C(OC)C=C1 CS-0016906 [0,2,0,0,0,0|0,0,0]=2 284 B15R1.768 CCOC(=O)COC1=CC=CC=C1C#N CS-0151566 [0,2,0,0,0,0|1,0,1]=4 285 B15R1.768 CCOC(=O)COC1=CC=CC=C1C=O CS-0018895 [0,2,0,0,0,0|1,0,1]=4 286 B15R1.3465 CC(C)(C)OC(=O)NCC1=CC=CC=C1 CS-0187579 [0,2,0,0,0,0|1,0,1]=4 287 B15R1.3465 CC(C)(C)OC(=O)NNC1=CC=CC=C1 CS-0213217 [0,2,0,0,0,0|2,0,0]=4 288 B13R1.464 CCOC(=O)C1=CC=CC=C1C#N CS-W003061 [0,0,1,1,0,0|1,0,1]=4 289 B13R1.464 CCOC(=O)C1=CC=CC=C1CBr CS-0695446 [0,0,1,1,0,0|1,0,1]=4 290 B13R1.464 CCOC(=O)C1=CC=CC=C1OC CS-0100631 [0,0,1,1,0,0|1,0,1]=4 291 B13R1.460 CCOC(=O)C1=CC(C=O)=NC=C1 CS-0043680 [0,0,1,1,0,0|2,0,0]=4 292 B13R1.460 CCOC(=O)C1=CC(NN)=CC=C1 CS-0151777 [0,0,1,1,0,0|2,0,0]=4 293 B13R1.460 CCOC(=O)C1=CC(OC)=CC=C1 CS-0151776 [0,0,1,1,0,0|1,0,1]=4 294 B13R1.460 CCOC(=O)C1=CC=CC(C#N)=C1 CS-0151746 [0,0,1,1,0,0|1,0,1]=4 295 B13R1.460 CCOC(=O)C1=CC=CC(C=O)=C1 CS-0169487 [0,0,1,1,0,0|1,0,0]=3 296 B13R1.460 CCOC(=O)C1=CC=CC(CCl)=C1 CS-0199658 [0,0,1,1,0,0|1,0,1]=4 297 B13R1.460 CCOC(=O)C1=CC=CC(CN)=C1 CS-0461901 [0,0,1,1,0,0|1,0,1]=4 298 B13R1.460 CCOC(=O)C1=NC=CC(C=O)=C1 CS-0151672 [0,0,1,1,0,0|2,0,0]=4 299 B13R1.446 CCOC(=O)C1=C(Br)C=CC(F)=C1 CS-0041472 [0,0,1,1,0,0|2,0,0]=4 300 B13R1.446 CCOC(=O)C1=C(C)C=CC(Br)=C1 CS-0191148 [0,0,1,1,0,0|1,0,1]=4 301 B13R1.446 CCOC(=O)C1=C(C)C=CC(Cl)=C1 CS-0151845 [0,0,1,1,0,0|1,0,1]=4 302 B13R1.446 CCOC(=O)C1=C(Cl)C=CC(Br)=C1 CS-W012459 [0,0,1,1,0,0|2,0,0]=4 303 B13R1.446 CCOC(=O)C1=C(Cl)C=CC(Cl)=C1 CS-W009518 [0,0,1,1,0,0|2,0,0]=4 304 B13R1.446 CCOC(=O)C1=C(F)C=CC(C)=C1 CS-0151826 [0,0,1,1,0,0|1,0,1]=4 305 B13R1.446 CCOC(=O)C1=C(O)C=CC(C)=C1 CS-0361454 [0,0,1,1,0,0|1,0,1]=4 306 B13R1.446 CCOC(=O)C1=C(O)C=CC(I)=C1 CS-0151825 [0,0,1,1,0,0|2,0,0]=4 307 B13R1.446 CCOC(=O)C1=C(O)C=CC(O)=C1 CS-0086623 [0,0,1,1,0,0|2,0,0]=4 308 B13R1.446 CCOC(=O)C1=CC(Br)=CC=C1F CS-0041473 [0,0,1,1,0,0|2,0,0]=4 309 B13R1.446 CCOC(=O)C1=CC(Br)=CC=C1I CS-0094420 [0,0,1,1,0,0|2,0,0]=4 310 B13R1.446 CCOC(=O)C1=CC(Br)=CC=C1N CS-0041502 [0,0,1,1,0,0|2,0,0]=4 311 B13R1.446 CCOC(=O)C1=CC(Cl)=CC=C1I CS-0041077 [0,0,1,1,0,0|2,0,0]=4 312 B13R1.446 CCOC(=O)C1=CC(F)=CC=C1F CS-0042644 [0,0,1,1,0,0|2,0,0]=4 313 B13R1.446 CCOC(=O)C1=CC(F)=CC=C1N CS-0043150 [0,0,1,1,0,0|2,0,0]=4 314 B13R1.446 CCOC(=O)C1=CC(I)=CC=C1Br CS-0061553 [0,0,1,1,0,0|2,0,0]=4 315 B13R1.446 CCOC(=O)C1=CC(I)=CC=C1C CS-0096412 [0,0,1,1,0,0|1,0,1]=4 316 B13R1.446 CCOC(=O)C1=CC(I)=CC=C1F CS-0044520 [0,0,1,1,0,0|2,0,0]=4 317 B13R1.446 CCOC(=O)C1=CC(I)=CC=C1N CS-0041131 [0,0,1,1,0,0|2,0,0]=4 318 B13R1.446 CCOC(=O)C1=CC(N)=CC=C1C CS-0527934 [0,0,1,1,0,0|1,0,1]=4 319 B13R1.446 CCOC(=O)C1=CC(N)=CC=C1Cl CS-0118143 [0,0,1,1,0,0|2,0,0]=4 320 B13R1.446 CCOC(=O)C1=CC(N)=CC=C1F CS-0092640 [0,0,1,1,0,0|2,0,0]=4 321 B13R2.3 C1=CC=C(C2=CCCCC2)C=C1 CS-W016196 [1,0,0,1,0,0|1,0,1]=4 322 B13R2.3 C1=CC=C(C2=CCNCC2)C=C1 CS-0171304 [1,0,0,1,0,0|1,0,1]=4 323 B13R2.3 C1=CC=C(C2=CCNCC2)C=C1 CS-0187049 [1,0,0,1,0,0|1,0,1]=4 324 B13R2.1613 BrCC1=C2C=CC=CC2=CC=C1 CS-W021252 [1,0,0,1,0,0|2,0,0]=4 325 B13R2.1613 CCC1=C2N=CC=CC2=CC=C1 CS-0152545 [1,0,0,1,0,0|2,0,0]=4 326 B13R2.1613 CCC1=CC=CC2=CC=CC=C21 CS-W008338 [1,0,0,1,0,0|1,0,0]=3 327 B13R2.1613 CC[N+]1=C2C=CC=CC2=CC=C1 CS-0128422 [1,0,0,1,0,0|1,0,0]=3 328 B13R2.1613 CNC1=CC=CC2=CC=CC=C21 CS-W005609 [1,0,0,1,0,0|2,0,0]=4 329 B13R2.1613 COC1=CC=CC2=CC=CC=C21 CS-W013284 [1,0,0,1,0,0|2,0,0]=4 330 B13R2.1613 NCC1=C2C=CC=CC2=CC=C1 CS-0139353 [1,0,0,1,0,0|2,0,0]=4 331 B13R2.1613 NCC1=CC=CC2=CC=CC=C21 CS-W010910 [1,0,0,1,0,0|2,0,0]=4 332 B13R2.1613 OCC1=C2C=CC=CC2=CC=C1 CS-W017957 [1,0,0,1,0,0|2,0,0]=4 333 B13R2.10 ClC1=CC(C2=CC=CC=C2)=NO1 CS-0156348 [1,0,0,1,0,0|2,0,0]=4 334 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 CS-W017937 [1,0,0,1,0,0|2,0,0]=4 335 B13R2.10 O=C1CC(C2=CC=CC=C2)=NO1 CS-0114110 [1,0,0,1,0,0|1,0,1]=4 336 B13R2.10 O=C1CCC(C2=CC=CC=C2)C1 CS-0139334 [1,0,0,1,0,0|0,0,2]=4 337 B13R2.10 O=C1CCN(C2=CC=CC=C2)N1 CS-W010860 [1,0,0,1,0,0|2,0,0]=4 338 B13R2.10 O=C1CC[C@H](C2=CC=CC=C2)N1 CS-0098324 [1,0,0,1,0,0|1,0,1]=4 339 B13R2.10 O=C1CN=C(C2=CC=CC=C2)O1 CS-W017933 [1,0,0,1,0,0|2,0,0]=4 340 B13R2.10 O=C1N=C(C2=CC=CC=C2)NO1 CS-0043875 [1,0,0,1,0,0|2,0,0]=4 341 B13R2.10 O=C1NC(C2=CC=CC=C2)CO1 CS-0039132 [1,0,0,1,0,0|1,0,1]=4 342 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 CS-0031471 [1,0,0,1,0,0|1,0,1]=4 343 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 CS-W017924 [1,0,0,1,0,0|1,0,1]=4 344 B13R2.10 O=C1OCC(C2=CC=CC=C2)O1 CS-0697972 [1,0,0,1,0,0|1,0,1]=4 345 B13R2.10 O=C1ON=C(C2=CC=CC=C2)O1 CS-0699002 [1,0,0,1,0,0|2,0,0]=4 346 B13R2.32 CC1=C(O)C=CC2=CC=CC=C21 CS-0153503 [1,0,0,1,0,0|0,0,2]=4 347 B13R2.32 CN1C(=O)C=CC2=CC=CC=C21 CS-W023164 [1,0,0,1,0,0|1,0,0]=3 348 B13R2.32 CN1C(=O)C=NC2=CC=CC=C21 CS-0265478 [1,0,0,1,0,0|2,0,0]=4 349 B13R2.33 O=C1CCC2=CC=CC=C2CC1 CS-W020691 [1,0,0,1,0,0|0,0,2]=4 350 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 CS-W014727 [1,0,0,1,0,0|2,0,0]=4 351 B13R2.57 CCC1=CC2=CC=CC=C2C=C1 CS-0152501 [1,0,0,1,0,0|1,0,0]=3 352 B13R2.57 CCC1=CC2=CC=CC=C2N=C1 CS-0535356 [1,0,0,1,0,0|2,0,0]=4 353 B13R2.57 CNC1=NC2=CC=CC=C2C=C1 CS-0139232 [1,0,0,1,0,0|2,0,0]=4 354 B13R2.57 COC1=CC2=C(C=C1)C=NC=C2 CS-0005444 [1,0,0,1,0,0|2,0,0]=4 355 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 CS-W010895 [1,0,0,1,0,0|1,0,0]=3 356 B13R2.57 COC1=CC2=CC=CC=C2N=C1 CS-W021958 [1,0,0,1,0,0|2,0,0]=4 357 B13R2.57 COC1=CC=C2C=CC=NC2=C1 CS-W022551 [1,0,0,1,0,0|2,0,0]=4 358 B13R2.57 COC1=CC=C2C=CN=CC2=C1 CS-0043907 [1,0,0,1,0,0|2,0,0]=4 359 B13R2.57 COC1=CC=C2N=CC=CC2=C1 CS-W017948 [1,0,0,1,0,0|2,0,0]=4 360 B13R2.57 COC1=NC2=CC=CC=C2C=C1 CS-W006119 [1,0,0,1,0,0|1,0,0]=3 361 B13R2.57 CSC1=CC2=CC=CC=C2C=C1 CS-0368258 [1,0,0,1,0,0|1,1,0]=4 362 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 CS-0695678 [1,0,0,1,0,0|2,0,0]=4 363 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 CS-W023193 [1,0,0,1,0,0|2,0,0]=4 364 B13R2.57 NCC1=CC2=CC=CC=C2C=C1 CS-W002778 [1,0,0,1,0,0|2,0,0]=4 365 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 CS-W018759 [1,0,0,1,0,0|2,0,0]=4 366 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 CS-0456360 [1,0,0,1,0,0|2,0,0]=4 367 B13R2.57 OCC1=CC2=C(C=CC=C2)C=C1 CS-W001953 [1,0,0,1,0,0|2,0,0]=4 368 B13R2.57 OCC1=NC2=CC=CC=C2C=C1 CS-0044957 [1,0,0,1,0,0|2,0,0]=4 369 B13R2.26 CCOC1=NC2=CC=CC=C2N1 CS-W020457 [0,0,0,1,1,0|2,0,0]=4 370 B13R2.135 CCN1C(=O)NC2=CC=CC=C21 CS-0021217 [0,0,0,1,1,0|2,0,0]=4 371 B13R2.163 O=C1CC2=CC=CC=C2CCN1 CS-W000444 [0,0,0,1,1,0|1,0,1]=4 372 B13R2.163 O=C1CCCC2=CC=CC=C2N1 CS-D0727 [0,0,0,1,1,0|2,0,0]=4 373 B13R2.449 CCOC1=CC2=C(C=CN2)C=C1 CS-0019170 [0,0,0,1,1,0|2,0,0]=4 374 B15R2.31 O=C1CN(CC2=CC=CC=C2)CCO1 CS-W001898 [0,0,0,1,0,1|0,0,2]=4 375 B15R2.73 CCOC(=O)C1=C2C=CC=CN2C=N1 CS-0044486 [0,0,0,1,0,1|1,0,0]=3 376 B15R2.73 CCOC(=O)C1=C2C=CC=CN2N=C1 CS-D0884 [0,0,0,1,0,1|1,0,0]=3 377 B15R2.73 CCOC(=O)C1=C2C=NC=CN2N=C1 CS-0037996 [0,0,0,1,0,1|2,0,0]=4 378 B15R2.73 CCOC(=O)C1=C2N=CC=CN2N=C1 CS-W000737 [0,0,0,1,0,1|2,0,0]=4 379 B15R2.73 CCOC(=O)C1=CN=C2C=CC=CN12 CS-0043129 [0,0,0,1,0,1|1,0,0]=3 380 B15R2.73 CCOC(=O)C1=CN=C2C=NC=CN12 CS-0036829 [0,0,0,1,0,1|2,0,0]=4 381 B15R2.73 CCOC(=O)C1=CN=C2N=CC=CN12 CS-0094357 [0,0,0,1,0,1|2,0,0]=4 382 B15R2.73 CCOC(=O)C1=CNC2=CC=CC=C21 CS-W015944 [0,0,0,1,0,1|0,0,0]=2 383 B15R2.73 CCOC(=O)C1=CNC2=CC=NC=C21 CS-0449026 [0,0,0,1,0,1|1,0,0]=3 384 B15R2.73 CCOC(=O)C1=NNC2=C1C=CC=C2 CS-0006067 [0,0,0,1,0,1|1,0,0]=3 385 B15R2.73 CCOC(=O)C1=NNC2=CC=CN=C21 CS-0043190 [0,0,0,1,0,1|2,0,0]=4 386 B15R2.73 CCOC(=O)C1=NOC2=C1C=CC=C2 CS-W006634 [0,0,0,1,0,1|1,0,0]=3 387 B15R2.1342 CCOC(=O)C1OC1C2=CC=CC=C2 CS-0075541 [0,0,0,1,0,1|0,0,2]=4 388 B15R2.1342 CCOC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2 CS-0049583 [0,0,0,1,0,1|0,0,2]=4 389 B15R2.395 O=C1CCCC1C(=O)C2=CC=CC=C2 CS-0237238 [0,1,0,1,0,0|1,0,1]=4 390 B15R2.2248 CCN1N=C(C2=CC=CC=C2)C=C1N CS-0224980 [0,1,0,1,0,0|2,0,0]=4 391 B15R2.41154 O=C(CC(=O)C1CC1)C2=CC=CC=C2 CS-0531015 [0,1,0,1,0,0|1,0,1]=4 392 B15R2.1290 CCOC1=CC=C2N=CC=C(Cl)C2=C1 CS-0198222 [0,1,0,1,0,0|2,0,0]=4 393 B15R2.1290 CCOC1=CC=C2N=CC=C(O)C2=C1 CS-0069294 [0,1,0,1,0,0|2,0,0]=4 394 B15R2.10252 CCOC1=CC2=CC=C(Br)C=C2C=C1 CS-0186589 [0,1,0,1,0,0|1,0,0]=3 395 B15R2.10252 CCOC1=CC=C2N=C(C)C=CC2=C1 CS-W015987 [0,1,0,1,0,0|2,0,0]=4 396 B15R2.38 O=C1COCCN1CC2=CC=CC=C2 CS-0156277 [0,1,0,1,0,0|1,0,1]=4 397 B15R2.1356 CCOC(=O)C1=CC2=C(C=CC=C2)N1 CS-D1745 [0,1,0,1,0,0|0,0,0]=2 398 B15R2.1356 CCOC(=O)C1=CC2=C(C=CC=N2)N1 CS-W006111 [0,1,0,1,0,0|1,0,0]=3 399 B15R2.1356 CCOC(=O)C1=CC2=C(C=CN=C2)N1 CS-W018733 [0,1,0,1,0,0|1,0,0]=3 400 B15R2.1356 CCOC(=O)C1=CC2=CC=CC=C2O1 CS-0030572 [0,1,0,1,0,0|0,0,0]=2 401 B15R2.1356 CCOC(=O)C1=CC2=CC=CC=C2S1 CS-0206798 [0,1,0,1,0,0|0,0,0]=2 402 B15R2.1356 CCOC(=O)C1=CC2=CC=CN=C2N1 CS-B1286 [0,1,0,1,0,0|1,0,0]=3 403 B15R2.1356 CCOC(=O)C1=CC2=CC=NC=C2N1 CS-0049552 [0,1,0,1,0,0|1,0,0]=3 404 B15R2.1356 CCOC(=O)C1=CN2C=CC=CC2=N1 CS-W015892 [0,1,0,1,0,0|1,0,0]=3 405 B15R2.1356 CCOC(=O)C1=CN2C=CC=NC2=N1 CS-W002930 [0,1,0,1,0,0|2,0,0]=4 406 B15R2.1356 CCOC(=O)C1=CN2C=CN=CC2=N1 CS-W003528 [0,1,0,1,0,0|2,0,0]=4 407 B15R2.1356 CCOC(=O)C1=CN2N=CC=CC2=N1 CS-0037452 [0,1,0,1,0,0|2,0,0]=4 408 B15R2.1356 CCOC(=O)C1=NC2=CC=CC=C2N1 CS-0043193 [0,1,0,1,0,0|1,0,0]=3 409 B15R2.1356 CCOC(=O)C1=NC2=CC=CC=C2S1 CS-W015265 [0,1,0,1,0,0|1,0,0]=3 410 B15R2.1356 CCOC(=O)C1=NC2=CC=CN=C2S1 CS-0646606 [0,1,0,1,0,0|2,0,0]=4 411 B15R2.1356 CCOC(=O)C1=NN2C=CC=NC2=C1 CS-0038296 [0,1,0,1,0,0|2,0,0]=4 412 B15R2.352 CCCCC1=CC2=CC=CC=C2C=C1 CS-0329582 [0,1,0,1,0,0|2,0,0]=4 413 B15R2.352 CCCOC1=CC2=CC=CC=C2C=C1 CS-0318343 [0,1,0,1,0,0|1,0,0]=3 414 B15R2.352 OCCOC1=CC2=CC=CC=C2C=C1 CS-W016799 [0,1,0,1,0,0|1,0,0]=3 415 B15R2.1282 CCOC1=CC2=CC(O)=CC=C2C=C1 CS-0044817 [0,1,0,1,0,0|1,0,0]=3 416 B15R2.1282 CCOC1=CC=C2C=CC(=O)OC2=C1 CS-0110669 [0,1,0,1,0,0|2,0,0]=4 417 B15R2.1601 CCC(N)C1=CC2=C(C=CC=C2)C=C1 CS-0513766 [0,1,0,1,0,0|2,0,0]=4 418 B15R2.1601 CC[C@@H](N)C1=CC2=C(C=CC=C2)C=C1 CS-0196892 [0,1,0,1,0,0|2,0,0]=4 419 B15R2.1601 CC[C@H](N)C1=CC=C2C=CC=CC2=C1 CS-0162118 [0,1,0,1,0,0|2,0,0]=4 420 B15R3.2009 [C@@H]12NC(=O)O[C@@H]1CC3=C2C=CC=C3 CS-0098288 [0,0,0,2,0,0|1,0,1]=4 421 B15R3.2009 [C@H]12CC3=C(C=CC=C3)[C@H]1NC(=O)O2 CS-0093685 [0,0,0,2,0,0|1,0,1]=4 422 B11R1.25 COC(=O)\C=C\C1=CN=CN1 CS-0301804 [1,0,0,0,1,0|2,0,0]=4 423 B11R1.25 COC(=O)\C=C\C1=CSC=C1 CS-0468967 [1,0,0,0,1,0|1,0,0]=3 424 B11R1.40 CCC(=O)OC1=CC=CC=C1 CS-0182542 [1,0,0,0,1,0|1,0,0]=3 425 B11R1.40 COC(=O)CC1=CC=CN=C1 CS-0037030 [1,0,0,0,1,0|1,0,1]=4 426 B11R1.40 COC(=O)CC1=CC=NC=C1 CS-0015139 [1,0,0,0,1,0|1,0,1]=4 427 B11R1.40 COC(=O)CC1=NC=CC=C1 CS-0020075 [1,0,0,0,1,0|1,0,1]=4 428 B11R1.40 COC(=O)OC1=CC=CC=C1 CS-0115513 [1,0,0,0,1,0|1,0,0]=3 429 B11R1.40 O=C(CBr)NC1=CC=CC=C1 CS-D0368 [1,0,0,0,1,0|2,0,0]=4 430 B11R1.40 O=C(CBr)OC1=CC=CC=C1 CS-W009102 [1,0,0,0,1,0|2,0,0]=4 431 B11R1.40 O=C(CCl)CC1=CC=CC=C1 CS-0124989 [1,0,0,0,1,0|1,0,1]=4 432 B11R1.40 O=C(CCl)NC1=CC=CC=C1 CS-0079929 [1,0,0,0,1,0|2,0,0]=4 433 B11R1.40 O=C(CO)NC1=CC=CC=C1 CS-0139260 [1,0,0,0,1,0|2,0,0]=4 434 B11R1.16 C=COC(=O)C1=CC=CC=C1 CS-0167828 [0,0,0,0,2,0|0,0,2]=4 435 B11R1.16 CCCC(=O)C1=CC=CC=C1 CS-W010981 [0,0,0,0,2,0|1,0,0]=3 436 B11R1.16 CCCC(=O)C1=CC=CC=N1 CS-0152465 [0,0,0,0,2,0|2,0,0]=4 437 B11R1.16 CCOC(=O)C1=CC=CC=C1 CS-W018155 [0,0,0,0,2,0|0,0,0]=2 438 B11R1.16 CCOC(=O)C1=CC=CC=N1 CS-W008053 [0,0,0,0,2,0|1,0,0]=3 439 B11R1.16 CCOC(=O)C1=CC=NC=C1 CS-W020597 [0,0,0,0,2,0|1,0,0]=3 440 B11R1.16 CCOC(=O)C1=CN=CC=C1 CS-W014344 [0,0,0,0,2,0|1,0,0]=3 441 B11R1.16 CCOC(=O)C1=CN=CN=C1 CS-0188316 [0,0,0,0,2,0|2,0,0]=4 442 B11R1.16 CCOC(=O)C1=NC=CC=N1 CS-W022718 [0,0,0,0,2,0|2,0,0]=4 443 B11R1.16 CCOC(=O)C1=NC=CN=C1 CS-M0893 [0,0,0,0,2,0|2,0,0]=4 444 B11R1.16 CCOC(=O)C1=NC=NC=C1 CS-W003653 [0,0,0,0,2,0|2,0,0]=4 445 B11R1.16 CCO[PH](=O)C1=CC=CC=C1 CS-0151414 [0,0,0,0,2,0|1,0,0]=3 446 B11R1.16 COCC(=O)C1=CC=CC=C1 CS-0138576 [0,0,0,0,2,0|2,0,0]=4 447 B11R1.16 C\C=C\C(=O)C1=CC=CC=C1 CS-W010991 [0,0,0,0,2,0|1,0,1]=4 448 B11R1.16 O=C(CCCl)C1=CC=CC=C1 CS-0030740 [0,0,0,0,2,0|2,0,0]=4 449 B11R1.16 O=C(OCCl)C1=CC=CC=C1 CS-W004798 [0,0,0,0,2,0|1,0,0]=3 450 B11R1.16 O=C(OCI)C1=CC=CC=C1 CS-0445868 [0,0,0,0,2,0|1,0,0]=3 451 B11R1.30 CCOC(=O)CC1=CC=CS1 CS-0042492 [0,0,0,0,2,0|1,0,1]=4 452 B11R1.30 CCOC(=O)CC1=CSC=C1 CS-0215599 [0,0,0,0,2,0|1,0,1]=4 453 B15R1.778 CCOC(=O)CCCOC1=CC=CC=C1 CS-0179390 [0,0,0,0,0,2|0,0,2]=4 454 B15R1.778 CCOC(=O)CCNCC1=CC=CC=C1 CS-W015263 [0,0,0,0,0,2|0,0,2]=4