0 B9R1.6 CC(=O)C1=CN=CN=C1 CS-D0295 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.6 CC(=O)C1=NC=NC=C1 CS-0005388 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.6 CC(Cl)C1=CN=CC=C1 CS-0046962 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.6 CC(N)C1=CC=NC=C1 CS-0109447 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.6 C[C@@H](N)C1=CC=CN=C1 CS-0029799 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.6 C[C@H](N)C1=CC=NC=C1 CS-0098146 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.6 C[C@H](N)C1=NC=CC=C1 CS-M3539 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.6 NC(=O)C1=NC=CC=C1 CS-0020700 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 NC(=S)C1=NC=CC=N1 CS-0037234 [0,0,0,0,0,0|3,1,0]=4 9 B9R1.6 O=C(O)C1=CN=CN=C1 CS-B0029 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.6 O=C(O)C1=NC=CN=N1 CS-0044383 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.6 O=C(O)C1=NC=CN=N1 CS-W000557 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.6 O=C([O-])C1=CC=CC=C1 CS-0013645 [0,0,0,0,0,0|0,0,1]=1 13 B9R1.6 OB(O)C1=CC=CC=N1 CS-W013543 [0,0,0,0,0,0|2,0,1]=3 14 B9R1.6 OB(O)C1=CN=CC=C1 CS-D0809 [0,0,0,0,0,0|2,0,1]=3 15 B8R1.2 C#CC1=CC=CN=C1 CS-W008813 [1,0,0,0,0,0|2,0,1]=4 16 B8R1.2 C#CC1=CC=NC=C1 CS-W004709 [1,0,0,0,0,0|2,0,1]=4 17 B8R1.2 NCC1=CC=NC=C1 CS-W005997 [1,0,0,0,0,0|2,0,1]=4 18 B8R1.2 NNC1=CC=CC=N1 CS-W007453 [1,0,0,0,0,0|3,0,0]=4 19 B8R1.2 NNC1=CC=CN=C1 CS-W021932 [1,0,0,0,0,0|3,0,0]=4 20 B8R1.2 O=CC1=NC=CC=N1 CS-0048725 [1,0,0,0,0,0|2,0,0]=3 21 B8R1.2 O=CC1=NC=CN=C1 CS-W009118 [1,0,0,0,0,0|2,0,0]=3 22 B8R1.2 OCC1=CN=CN=C1 CS-D0994 [1,0,0,0,0,0|2,0,1]=4 23 B8R1.2 SCC1=NC=CC=C1 CS-D0562 [1,0,0,0,0,0|1,1,1]=4 24 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 CS-W019730 [0,1,0,0,0,0|2,0,0]=3 25 B10R1.13 CC(=O)C1=CC=C(C)N=C1 CS-B0461 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 CS-0040244 [0,1,0,0,0,0|2,0,0]=3 27 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 CS-W018594 [0,1,0,0,0,0|3,0,0]=4 28 B10R1.13 CC(=O)C1=NC=C(O)C=C1 CS-W021245 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.13 CC1=CC=C(C(C)O)C=N1 CS-B0462 [0,1,0,0,0,0|2,0,1]=4 30 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 CS-0000299 [0,1,0,0,0,0|2,0,1]=4 31 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 CS-M1249 [0,1,0,0,0,0|2,0,0]=3 32 B10R1.13 CC1=NC=C(C(=O)O)C=C1 CS-W008333 [0,1,0,0,0,0|1,0,0]=2 33 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 CS-W003158 [0,1,0,0,0,0|2,0,1]=4 34 B10R1.13 CN(C)C1=CC=C(O)C=C1 CS-W008911 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 CS-D0020 [0,1,0,0,0,0|2,0,1]=4 36 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 CS-0039205 [0,1,0,0,0,0|1,0,1]=3 37 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 CS-W022338 [0,1,0,0,0,0|2,0,0]=3 38 B10R1.13 NC(=O)C1=NC=C(N)N=C1 CS-W019230 [0,1,0,0,0,0|3,0,0]=4 39 B10R1.13 NC1=CN=C([N+](=O)[O-])C=C1 CS-W018717 [0,1,0,0,0,0|2,0,1]=4 40 B10R1.13 O=C(O)C1=CC=C(F)N=C1 CS-W019722 [0,1,0,0,0,0|1,0,0]=2 41 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 CS-D0613 [0,1,0,0,0,0|1,0,0]=2 42 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=N1 CS-W005777 [0,1,0,0,0,0|2,0,1]=4 43 B10R1.13 OB(O)C1=CC=C(Br)C=C1 CS-W008847 [0,1,0,0,0,0|1,0,1]=3 44 B10R1.13 OB(O)C1=CC=C(F)N=C1 CS-D1045 [0,1,0,0,0,0|2,0,1]=4 45 B10R1.13 OB(O)C1=NC=C(F)C=C1 CS-0053148 [0,1,0,0,0,0|2,0,1]=4 46 B10R1.13 [C@@H](C)(O)C1=CC=C(Br)C=C1 CS-W015566 [0,1,0,0,0,0|1,0,1]=3 47 B10R1.15 C#CC(C)C1=CC=CC=C1 CS-B0615 [0,1,0,0,0,0|2,0,1]=4 48 B10R1.15 C#CC(O)C1=CC=CC=C1 CS-W013411 [0,1,0,0,0,0|1,0,1]=3 49 B10R1.15 CCC(=O)C1=NC=CC=N1 CS-0054932 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 CS-0028334 [0,1,0,0,0,0|2,0,1]=4 51 B10R1.15 C\C(=N\O)C1=NC=CC=C1 CS-M2152 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.15 O=C(CBr)C1=NC=CC=N1 CS-W021586 [0,1,0,0,0,0|3,0,0]=4 53 B10R1.15 OCC(O)C1=CC=CC=C1 CS-W016504 [0,1,0,0,0,0|0,0,2]=3 54 B10R1.28 CS(=N)(=O)C1=CC=CC=C1 CS-0047091 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 CS-W013166 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.28 NS(=O)(=O)C1=NC=CC=C1 CS-W022941 [0,1,0,0,0,0|2,0,1]=4 57 B10R1.28 O=S(=O)(F)C1=NC=CC=C1 CS-0105322 [0,1,0,0,0,0|2,0,1]=4 58 B10R1.61 CC(=O)C1=C(F)N=CC=C1 CS-0044029 [0,1,0,0,0,0|2,0,0]=3 59 B10R1.61 CC(=O)C1=CC=CC=C1Br CS-W007689 [0,1,0,0,0,0|1,0,0]=2 60 B10R1.61 CC(=O)C1=CC=CNC1=O CS-W008721 [0,1,0,0,0,0|2,0,0]=3 61 B10R1.61 CC1=C(C(=O)O)C=NN=C1 CS-0050427 [0,1,0,0,0,0|2,0,0]=3 62 B10R1.61 CC1=NC=CN=C1C(=O)O CS-D1600 [0,1,0,0,0,0|2,0,0]=3 63 B10R1.61 CN(C)C1=CC=CC=C1N CS-W008997 [0,1,0,0,0,0|3,0,0]=4 64 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 CS-B0638 [0,1,0,0,0,0|1,0,1]=3 65 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 CS-B0639 [0,1,0,0,0,0|1,0,1]=3 66 B10R1.61 NC(=O)C1=C(Br)N=CC=N1 CS-0059681 [0,1,0,0,0,0|3,0,0]=4 67 B10R1.61 NC1=C(C(F)F)C=CC=C1 CS-0036038 [0,1,0,0,0,0|2,0,1]=4 68 B10R1.61 NC1=C([N+](=O)[O-])C=NC=C1 CS-W002462 [0,1,0,0,0,0|2,0,1]=4 69 B10R1.61 O=C(O)C1=C(F)C=CN=C1 CS-0040491 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.61 O=C(O)C1=NC=CC=C1Br CS-W002771 [0,1,0,0,0,0|1,0,0]=2 71 B10R1.61 O=C(O)C1=NC=CC=C1I CS-W021949 [0,1,0,0,0,0|1,0,0]=2 72 B10R1.61 O=C(O)C1=NC=CN=C1Br CS-W020213 [0,1,0,0,0,0|2,0,0]=3 73 B10R1.61 O=C(O)C1=NC=CN=C1I CS-W023217 [0,1,0,0,0,0|2,0,0]=3 74 B10R1.61 O=[N+]([O-])C1=C(Br)C=CN=C1 CS-W006293 [0,1,0,0,0,0|2,0,1]=4 75 B10R1.61 O=[N+]([O-])C1=C(Cl)C=NC=C1 CS-W005126 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.61 O=[N+]([O-])C1=C(O)C=CN=C1 CS-W002397 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.61 O=[N+]([O-])C1=NC=CC=C1Cl CS-W008191 [0,1,0,0,0,0|2,0,1]=4 78 B10R1.61 OB(O)C1=CC=CC=C1Cl CS-D1476 [0,1,0,0,0,0|1,0,1]=3 79 B10R1.113 C=C(Cl)C1=CC(Cl)=NC=C1 CS-M0546 [0,1,0,0,0,0|3,0,0]=4 80 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 CS-W015631 [0,1,0,0,0,0|2,0,0]=3 81 B10R1.113 CC(=O)C1=CC(C)=CN=C1 CS-0101623 [0,1,0,0,0,0|2,0,0]=3 82 B10R1.113 CC(=O)C1=CC(C)=NC=C1 CS-W008996 [0,1,0,0,0,0|2,0,0]=3 83 B10R1.113 CC(=O)C1=CC(Cl)=CC=N1 CS-0037389 [0,1,0,0,0,0|2,0,0]=3 84 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 CS-M0495 [0,1,0,0,0,0|2,0,0]=3 85 B10R1.113 CC(=O)C1=NC(Cl)=CC=C1 CS-0043942 [0,1,0,0,0,0|2,0,0]=3 86 B10R1.113 CC(N)C1=CC=CC(F)=C1 CS-0040943 [0,1,0,0,0,0|2,0,1]=4 87 B10R1.113 CC1=CC(C(=N)N)=NC=C1 CS-0038257 [0,1,0,0,0,0|3,0,0]=4 88 B10R1.113 CC1=CC(C(=O)O)=NC=C1 CS-W005037 [0,1,0,0,0,0|1,0,0]=2 89 B10R1.113 CC1=CC([C@@H](C)N)=CC=C1 CS-W020506 [0,1,0,0,0,0|2,0,1]=4 90 B10R1.113 CC1=NC(C(=N)N)=CC=C1 CS-0037151 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.113 CC1=NC=CC(C(=O)O)=C1 CS-W008764 [0,1,0,0,0,0|1,0,0]=2 92 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 CS-0008494 [0,1,0,0,0,0|2,0,1]=4 93 B10R1.113 N=C(N)C1=CC(Cl)=CC=C1 CS-W020729 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.113 NC(=O)C1=CC(=O)NC=N1 CS-0107166 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.113 NC(=S)C1=CC(F)=CN=C1 CS-0039422 [0,1,0,0,0,0|2,1,0]=4 96 B10R1.113 NC1=CC(C(F)F)=CC=C1 CS-0037842 [0,1,0,0,0,0|2,0,1]=4 97 B10R1.113 NC1=CC([N+](=O)[O-])=CN=C1 CS-0098133 [0,1,0,0,0,0|2,0,1]=4 98 B10R1.113 NC1=CC([N+](=O)[O-])=CN=C1 CS-W001839 [0,1,0,0,0,0|2,0,1]=4 99 B10R1.113 NC1=CC=NC(C(=O)O)=C1 CS-W022082 [0,1,0,0,0,0|1,0,0]=2 100 B10R1.113 NC1=NC=CC(B(O)O)=C1 CS-W005555 [0,1,0,0,0,0|2,0,1]=4 101 B10R1.113 NC1=NC=CC([N+](=O)[O-])=C1 CS-W019623 [0,1,0,0,0,0|2,0,1]=4 102 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 CS-B1791 [0,1,0,0,0,0|1,0,0]=2 103 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 CS-W005983 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 CS-W009049 [0,1,0,0,0,0|1,0,0]=2 105 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 CS-W005070 [0,1,0,0,0,0|2,0,0]=3 106 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 CS-W008759 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.113 O=C1C=C(C(=O)O)C=NN1 CS-W022517 [0,1,0,0,0,0|2,0,0]=3 108 B10R1.113 O=C1N=CC=C(C(=O)O)N1 CS-0019355 [0,1,0,0,0,0|2,0,0]=3 109 B10R1.113 O=[N+]([O-])C1=CC(Cl)=NC=C1 CS-W010890 [0,1,0,0,0,0|2,0,1]=4 110 B10R1.113 O=[N+]([O-])C1=NC=CC(F)=C1 CS-W007124 [0,1,0,0,0,0|2,0,1]=4 111 B10R1.113 OB(O)C1=CC(Br)=CC=C1 CS-W004715 [0,1,0,0,0,0|1,0,1]=3 112 B10R1.113 OB(O)C1=CC(Br)=NC=C1 CS-W015534 [0,1,0,0,0,0|2,0,1]=4 113 B10R1.113 OB(O)C1=CC(F)=NC=C1 CS-D1044 [0,1,0,0,0,0|2,0,1]=4 114 B10R2.320 BrC1CC2=CC=CC=C21 CS-W017070 [0,0,0,1,0,0|2,0,1]=4 115 B10R2.320 O=C1CC2=C1C=CC=C2 CS-W022591 [0,0,0,1,0,0|1,0,0]=2 116 B8R1.7 CC(=O)C1=CNN=C1 CS-0044097 [0,0,0,0,1,0|3,0,0]=4 117 B8R1.7 O=C(O)C1=CC=NS1 CS-W022767 [0,0,0,0,1,0|2,0,0]=3 118 B8R1.7 O=C(O)C1=CN=CN1 CS-W007695 [0,0,0,0,1,0|2,0,0]=3 119 B8R1.7 O=C(O)C1=CN=NN1 CS-W009031 [0,0,0,0,1,0|3,0,0]=4 120 B8R1.7 O=C(O)C1=CON=C1 CS-W004867 [0,0,0,0,1,0|2,0,0]=3 121 B8R1.7 O=C(O)C1=CSN=C1 CS-D0308 [0,0,0,0,1,0|2,0,0]=3 122 B8R1.7 O=C(O)C1=NC=CS1 CS-W019827 [0,0,0,0,1,0|2,0,0]=3 123 B8R1.7 O=C(O)C1=NOC=C1 CS-W008200 [0,0,0,0,1,0|2,0,0]=3 124 B8R1.7 O=[N+]([O-])C1=CNC=C1 CS-W008547 [0,0,0,0,1,0|2,0,1]=4 125 B10R1.18 CC(=O)CC1=NC=CC=C1 CS-W008575 [0,0,0,0,0,1|2,0,0]=3 126 B10R1.18 CC(C)=CC1=CC=CC=C1 CS-W007259 [0,0,0,0,0,1|2,0,0]=3 127 B7R1.3 OC1=NC=NC=C1 CS-0019949 [2,0,0,0,0,0|2,0,0]=4 128 B9R1.1 C#CC1=CC=C(Cl)C=C1 CS-W018322 [1,1,0,0,0,0|1,0,1]=4 129 B9R1.1 CNC1=CC=C(Br)C=C1 CS-0038061 [1,1,0,0,0,0|2,0,0]=4 130 B9R1.1 FCC1=CC=C(Br)C=C1 CS-0047008 [1,1,0,0,0,0|1,0,1]=4 131 B9R1.1 NC1=CN=C(C=O)C=N1 CS-0102085 [1,1,0,0,0,0|2,0,0]=4 132 B9R1.1 NC1=NC=C(C=O)C=N1 CS-W008999 [1,1,0,0,0,0|2,0,0]=4 133 B9R1.1 NCC1=CC=C(I)C=C1 CS-W014680 [1,1,0,0,0,0|1,0,1]=4 134 B9R1.1 O=CC1=CN=C(Cl)N=C1 CS-0019369 [1,1,0,0,0,0|2,0,0]=4 135 B9R1.1 O=CC1=NC=C(Br)C=C1 CS-D0959 [1,1,0,0,0,0|1,0,0]=3 136 B9R1.1 OCC1=CC=C(Br)N=C1 CS-W016832 [1,1,0,0,0,0|1,0,1]=4 137 B9R1.1 OCC1=NC=C(Br)C=C1 CS-D0982 [1,1,0,0,0,0|1,0,1]=4 138 B9R1.1 OCC1=NC=C(Cl)C=C1 CS-W019365 [1,1,0,0,0,0|1,0,1]=4 139 B9R1.1 OCC1=NC=C(F)C=C1 CS-W018734 [1,1,0,0,0,0|1,0,1]=4 140 B9R1.2 C#CC1=CC(N)=CC=C1 CS-W007423 [1,1,0,0,0,0|1,0,1]=4 141 B9R1.2 C#CC1=CC(O)=CC=C1 CS-W009224 [1,1,0,0,0,0|1,0,1]=4 142 B9R1.2 CC1=CN=CC(C=O)=N1 CS-0054600 [1,1,0,0,0,0|2,0,0]=4 143 B9R1.2 CNC1=CC=CC(Cl)=C1 CS-0108516 [1,1,0,0,0,0|2,0,0]=4 144 B9R1.2 CSC1=CC(O)=CC=C1 CS-0033742 [1,1,0,0,0,0|2,0,0]=4 145 B9R1.2 CSC1=CC=CC(N)=C1 CS-W017751 [1,1,0,0,0,0|2,0,0]=4 146 B9R1.2 N#CC1=CC(I)=CC=C1 CS-W010393 [1,1,0,0,0,0|1,0,1]=4 147 B9R1.2 NC1=CC=CC(CO)=C1 CS-W019472 [1,1,0,0,0,0|0,0,1]=3 148 B9R1.2 NCC1=CC(Cl)=CC=C1 CS-W007429 [1,1,0,0,0,0|1,0,1]=4 149 B9R1.2 NNC1=CC=CC(F)=C1 CS-W017926 [1,1,0,0,0,0|2,0,0]=4 150 B9R1.2 O=C1C=C(CO)C=CN1 CS-0033712 [1,1,0,0,0,0|1,0,1]=4 151 B9R1.2 O=CC1=CC(Cl)=NC=C1 CS-W011025 [1,1,0,0,0,0|1,0,0]=3 152 B9R1.2 O=CC1=CC(O)=CN=C1 CS-0063897 [1,1,0,0,0,0|1,0,0]=3 153 B9R1.2 O=CC1=NC=CC(Cl)=C1 CS-D1623 [1,1,0,0,0,0|1,0,0]=3 154 B9R1.2 O=CC1=NC=CC(F)=C1 CS-W006870 [1,1,0,0,0,0|1,0,0]=3 155 B9R1.2 O=CC1=NC=CC(O)=C1 CS-0103517 [1,1,0,0,0,0|1,0,0]=3 156 B9R1.2 OCC1=CC=CC(F)=C1 CS-W021926 [1,1,0,0,0,0|0,0,1]=3 157 B9R1.2 OCC1=NC(Br)=CC=C1 CS-D0981 [1,1,0,0,0,0|1,0,1]=4 158 B9R1.2 OCC1=NC(F)=CC=C1 CS-W006285 [1,1,0,0,0,0|1,0,1]=4 159 B9R1.8 CCCC1=CC=CC=C1 CS-0035165 [1,1,0,0,0,0|1,0,1]=4 160 B9R1.15 C#CC1=CC=CC=C1F CS-W011208 [1,1,0,0,0,0|1,0,1]=4 161 B9R1.15 C#CC1=CC=CC=C1N CS-W004892 [1,1,0,0,0,0|1,0,1]=4 162 B9R1.15 CC1=C(C=O)C=NC=C1 CS-0044125 [1,1,0,0,0,0|1,0,0]=3 163 B9R1.15 CC1=C(CO)C=NC=C1 CS-0053194 [1,1,0,0,0,0|1,0,1]=4 164 B9R1.15 CC1=CC=CC=C1CN CS-M1443 [1,1,0,0,0,0|1,0,1]=4 165 B9R1.15 CNC1=CC=CC=C1O CS-B1556 [1,1,0,0,0,0|2,0,0]=4 166 B9R1.15 N#CC1=CC=CC=C1I CS-W010392 [1,1,0,0,0,0|1,0,1]=4 167 B9R1.15 NC1=C(C=O)C=CN=C1 CS-0019220 [1,1,0,0,0,0|1,0,0]=3 168 B9R1.15 NC1=C(C=O)C=NC=C1 CS-0080149 [1,1,0,0,0,0|1,0,0]=3 169 B9R1.15 NC1=CC=CC=C1C=O CS-W007486 [1,1,0,0,0,0|0,0,0]=2 170 B9R1.15 O=CC1=C(Cl)C=CC=N1 CS-W005646 [1,1,0,0,0,0|1,0,0]=3 171 B9R1.15 O=CC1=CC=NC=C1Cl CS-W011026 [1,1,0,0,0,0|1,0,0]=3 172 B9R1.15 O=CC1=CC=NC=C1O CS-W005203 [1,1,0,0,0,0|1,0,0]=3 173 B9R1.15 O=CC1=NC=CN=C1Cl CS-0051399 [1,1,0,0,0,0|2,0,0]=4 174 B9R1.15 OCC1=C(Br)N=CC=C1 CS-W020653 [1,1,0,0,0,0|1,0,1]=4 175 B9R1.15 OCC1=CC=CN=C1Cl CS-D0980 [1,1,0,0,0,0|1,0,1]=4 176 B9R1.15 OCC1=NC=CC=C1Br CS-0102751 [1,1,0,0,0,0|1,0,1]=4 177 B9R1.15 OCC1=NC=CC=C1O CS-0020046 [1,1,0,0,0,0|1,0,1]=4 178 B9R1.11 COC(=O)C1=CC=CN1 CS-W013518 [0,1,0,0,1,0|1,0,0]=3 179 B9R1.11 COC(=O)C1=NC=CS1 CS-W022890 [0,1,0,0,1,0|2,0,0]=4 180 B9R1.11 COC(=O)C1=NNC=C1 CS-W008807 [0,1,0,0,1,0|2,0,0]=4 181 B9R1.11 N=C(NO)C1=CSC=C1 CS-0036040 [0,1,0,0,1,0|2,0,0]=4 182 B9R1.35 CC(=O)C1=CC=C(Cl)S1 CS-W019588 [0,1,0,0,1,0|2,0,0]=4 183 B9R1.35 CC1=CC(C(=O)O)=CN1 CS-0018766 [0,1,0,0,1,0|1,0,0]=3 184 B9R1.35 CC1=CN=C(C(=O)O)N1 CS-W019454 [0,1,0,0,1,0|2,0,0]=4 185 B9R1.35 CC1=COC(C(=O)O)=C1 CS-W007308 [0,1,0,0,1,0|1,0,0]=3 186 B9R1.35 CC1=NC(C(=O)O)=CN1 CS-W023071 [0,1,0,0,1,0|2,0,0]=4 187 B9R1.35 CC1=NC(C(=O)O)=CS1 CS-0037835 [0,1,0,0,1,0|2,0,0]=4 188 B9R1.35 CC1=NC=C(C(=O)O)O1 CS-W006682 [0,1,0,0,1,0|2,0,0]=4 189 B9R1.35 CN1C=CC(C(=O)O)=C1 CS-W003777 [0,1,0,0,1,0|1,0,0]=3 190 B9R1.35 CN1C=CC(C(=O)O)=N1 CS-D1728 [0,1,0,0,1,0|2,0,0]=4 191 B9R1.35 NC1=NC(C(=O)O)=CS1 CS-W023136 [0,1,0,0,1,0|2,0,0]=4 192 B9R1.35 O=C(O)C1=CC(Br)=CO1 CS-W009277 [0,1,0,0,1,0|1,0,0]=3 193 B9R1.35 O=C(O)C1=CC(Br)=NN1 CS-W006919 [0,1,0,0,1,0|2,0,0]=4 194 B9R1.35 O=C(O)C1=CC(Cl)=CS1 CS-0040858 [0,1,0,0,1,0|1,0,0]=3 195 B9R1.35 O=C(O)C1=CC(F)=CS1 CS-0040859 [0,1,0,0,1,0|1,0,0]=3 196 B9R1.35 O=C(O)C1=CC=C(F)S1 CS-D0304 [0,1,0,0,1,0|1,0,0]=3 197 B9R1.35 O=C(O)C1=CNC(Cl)=C1 CS-0035544 [0,1,0,0,1,0|1,0,0]=3 198 B9R1.35 O=C(O)C1=COC(Br)=C1 CS-W023154 [0,1,0,0,1,0|1,0,0]=3 199 B9R1.35 O=C(O)C1=CSC(Cl)=N1 CS-0006101 [0,1,0,0,1,0|2,0,0]=4 200 B9R1.35 O=C1NC=C(C(=O)O)N1 CS-W009540 [0,1,0,0,1,0|2,0,0]=4 201 B9R1.41 CC1=C(C(=O)O)C=CS1 CS-W005121 [0,1,0,0,1,0|1,0,0]=3 202 B9R1.41 CC1=C(C(=O)O)C=NO1 CS-W011150 [0,1,0,0,1,0|2,0,0]=4 203 B9R1.41 CC1=C(C(=O)O)SC=C1 CS-W004782 [0,1,0,0,1,0|1,0,0]=3 204 B9R1.41 CC1=C(C(=O)O)SC=N1 CS-W008019 [0,1,0,0,1,0|2,0,0]=4 205 B9R1.41 CC1=CNN=C1C(=O)O CS-0063428 [0,1,0,0,1,0|2,0,0]=4 206 B9R1.41 CC1=CSC=C1C(=O)O CS-W019951 [0,1,0,0,1,0|1,0,0]=3 207 B9R1.41 CC1=NSC=C1C(=O)O CS-0061411 [0,1,0,0,1,0|2,0,0]=4 208 B9R1.41 CN1C=CC=C1C(=O)O CS-W013520 [0,1,0,0,1,0|1,0,0]=3 209 B9R1.41 NC1=CNN=C1C(=O)O CS-W007190 [0,1,0,0,1,0|2,0,0]=4 210 B9R1.41 O=C(O)C1=C(Br)C=CO1 CS-W021884 [0,1,0,0,1,0|1,0,0]=3 211 B9R1.41 O=C(O)C1=C(Br)OC=C1 CS-0029968 [0,1,0,0,1,0|1,0,0]=3 212 B9R1.41 O=C(O)C1=C(Br)SC=C1 CS-D0553 [0,1,0,0,1,0|1,0,0]=3 213 B9R1.41 O=C(O)C1=C(I)OC=C1 CS-0047021 [0,1,0,0,1,0|1,0,0]=3 214 B9R1.41 O=C(O)C1=NNC=C1Cl CS-W005681 [0,1,0,0,1,0|2,0,0]=4 215 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 CS-B0170 [0,1,0,0,0,1|1,0,0]=3 216 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 CS-0059277 [0,1,0,0,0,1|1,0,0]=3 217 B11R1.20 O=C(O)CC1=CC=C(F)C=N1 CS-0047181 [0,1,0,0,0,1|1,0,0]=3 218 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 CS-W008991 [0,1,0,0,0,1|1,0,0]=3 219 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 CS-0054139 [0,1,0,0,0,1|1,0,0]=3 220 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 CS-W021161 [0,1,0,0,0,1|1,0,0]=3 221 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 CS-0040444 [0,1,0,0,0,1|0,0,0]=2 222 B11R1.40 COC(=O)CC1=CC=CN=C1 CS-0037030 [0,1,0,0,0,1|1,0,0]=3 223 B11R1.40 [C@H](N)(CO)CC1=CC=CC=C1 CS-W018114 [0,1,0,0,0,1|1,0,1]=4 224 B11R1.86 CC(=O)NC1=C(I)C=NC=C1 CS-0100540 [0,1,0,0,0,1|2,0,0]=4 225 B11R1.86 O=C(O)CC1=NC=CC=C1Cl CS-W021389 [0,1,0,0,0,1|1,0,0]=3 226 B11R1.86 O=C(O)CN1C=CC=CC1=O CS-0038742 [0,1,0,0,0,1|1,0,0]=3 227 B11R1.86 O=C(O)CN1C=CC=NC1=O CS-0039063 [0,1,0,0,0,1|2,0,0]=4 228 B11R1.157 CC(=O)NC1=NC(N)=CC=C1 CS-B0370 [0,1,0,0,0,1|2,0,0]=4 229 B11R1.157 N=C(N)NC1=CC(Cl)=CC=C1 CS-M0494 [0,1,0,0,0,1|2,0,0]=4 230 B11R1.157 O=C(O)CC1=CC(Cl)=NC=C1 CS-0060700 [0,1,0,0,0,1|1,0,0]=3 231 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 CS-W008629 [0,1,0,0,0,1|0,0,0]=2 232 B11R1.3 COC1=CC=C(S(C)=O)C=C1 CS-0046999 [0,2,0,0,0,0|2,0,0]=4 233 B11R1.3 COC1=CN=C(C(=O)O)N=C1 CS-0036848 [0,2,0,0,0,0|2,0,0]=4 234 B11R1.3 CS(=O)C1=CC=C(C#N)C=C1 CS-0079978 [0,2,0,0,0,0|2,0,0]=4 235 B11R1.3 C[C@@H](O)C1=CC=C(C#N)C=C1 CS-0102856 [0,2,0,0,0,0|1,0,1]=4 236 B11R1.3 N#CC1=CC=C(B(O)O)C=C1 CS-B0849 [0,2,0,0,0,0|1,0,1]=4 237 B11R1.3 N#CC1=CC=C(C(=O)O)N=C1 CS-W016339 [0,2,0,0,0,0|1,0,0]=3 238 B11R1.3 N#CC1=CN=C(C(=O)O)C=N1 CS-0097641 [0,2,0,0,0,0|2,0,0]=4 239 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 CS-0047067 [0,2,0,0,0,0|1,0,0]=3 240 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 CS-W022928 [0,2,0,0,0,0|1,0,1]=4 241 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0084282 [0,2,0,0,0,0|1,0,0]=3 242 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-M2553 [0,2,0,0,0,0|1,0,0]=3 243 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-WAA0210 [0,2,0,0,0,0|1,0,0]=3 244 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-WAA0255 [0,2,0,0,0,0|1,0,0]=3 245 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 CS-M0622 [0,2,0,0,0,0|1,0,1]=4 246 B11R1.19 CP(C)(=O)C1=CC=C(Br)C=C1 CS-0068255 [0,2,0,0,0,0|2,0,0]=4 247 B11R1.19 CS(=N)(=O)C1=CC=C(F)C=C1 CS-0047355 [0,2,0,0,0,0|2,0,0]=4 248 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 CS-W004825 [0,2,0,0,0,0|1,0,1]=4 249 B11R1.19 N=C1C=CC(S(=O)(=O)O)=CN1 CS-0043744 [0,2,0,0,0,0|2,0,0]=4 250 B11R1.19 NC1=CC=C(S(=O)(=O)F)C=C1 CS-0063889 [0,2,0,0,0,0|1,0,1]=4 251 B11R1.19 O=S(=O)(Cl)C1=CC=C(O)C=C1 CS-0088970 [0,2,0,0,0,0|1,0,1]=4 252 B11R1.21 CC(=O)C1=CC(Cl)=C(C)C=C1 CS-0032914 [0,2,0,0,0,0|1,0,0]=3 253 B11R1.21 CC(=O)C1=CC(F)=C(Cl)C=C1 CS-W017576 [0,2,0,0,0,0|1,0,0]=3 254 B11R1.21 CC(=O)C1=CC=C(I)C(Br)=C1 CS-0098682 [0,2,0,0,0,0|1,0,0]=3 255 B11R1.21 CC(=O)C1=CC=C(O)C(O)=C1 CS-W008953 [0,2,0,0,0,0|1,0,0]=3 256 B11R1.21 CC(=O)C1=NC=C(Br)C(C)=C1 CS-0102116 [0,2,0,0,0,0|2,0,0]=4 257 B11R1.21 CC1=CC(C(=O)O)=CC=C1Cl CS-W017676 [0,2,0,0,0,0|0,0,0]=2 258 B11R1.21 CC1=CC=C(B(O)O)C=C1F CS-W009262 [0,2,0,0,0,0|1,0,1]=4 259 B11R1.21 CC1=CN=C(C(=O)O)C=C1F CS-0094255 [0,2,0,0,0,0|1,0,0]=3 260 B11R1.21 NC1=C(Br)C=CC([N+](=O)[O-])=C1 CS-W002243 [0,2,0,0,0,0|1,0,1]=4 261 B11R1.21 NC1=C(F)C=CC(N(=O)=O)=C1 CS-W007866 [0,2,0,0,0,0|1,0,1]=4 262 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 CS-W007229 [0,2,0,0,0,0|0,0,0]=2 263 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 CS-W005466 [0,2,0,0,0,0|0,0,0]=2 264 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 CS-0041182 [0,2,0,0,0,0|0,0,0]=2 265 B11R1.21 O=C(O)C1=CC=C(O)C(Cl)=C1 CS-0063147 [0,2,0,0,0,0|0,0,0]=2 266 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 CS-W008917 [0,2,0,0,0,0|0,0,0]=2 267 B11R1.21 O=C(O)C1=CNC(=O)C(=O)N1 CS-0109434 [0,2,0,0,0,0|2,0,0]=4 268 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 CS-B0745 [0,2,0,0,0,0|1,0,0]=3 269 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 CS-W009205 [0,2,0,0,0,0|1,0,0]=3 270 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)N=C1 CS-0097645 [0,2,0,0,0,0|2,0,0]=4 271 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 CS-W018684 [0,2,0,0,0,0|1,0,0]=3 272 B11R1.21 O=N(=O)C1=CC(Br)=C(O)C=C1 CS-W007908 [0,2,0,0,0,0|1,0,1]=4 273 B11R1.21 O=[N+]([O-])C1=CC(I)=C(Cl)C=C1 CS-M1168 [0,2,0,0,0,0|1,0,1]=4 274 B11R1.21 O=[N+]([O-])C1=CC=C(Br)C(O)=C1 CS-W008085 [0,2,0,0,0,0|1,0,1]=4 275 B11R1.21 OB(O)C1=CC(F)=C(O)C=C1 CS-W013287 [0,2,0,0,0,0|1,0,1]=4 276 B11R1.21 OB(O)C1=CC(O)=C(F)C=C1 CS-W018015 [0,2,0,0,0,0|1,0,1]=4 277 B11R1.21 OB(O)C1=CC=C(Cl)C(Cl)=C1 CS-W009090 [0,2,0,0,0,0|1,0,1]=4 278 B11R1.22 C#CC(O)C1=CC=C(F)C=C1 CS-0047272 [0,2,0,0,0,0|1,0,1]=4 279 B11R1.22 CNC(=O)C1=CC=C(I)C=C1 CS-0102088 [0,2,0,0,0,0|1,0,0]=3 280 B11R1.22 COC(=O)C1=CC=C(S)C=C1 CS-0037057 [0,2,0,0,0,0|0,0,0]=2 281 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 CS-W018560 [0,2,0,0,0,0|2,0,0]=4 282 B11R1.22 COC(=O)C1=CN=C(O)C=C1 CS-W005768 [0,2,0,0,0,0|1,0,0]=3 283 B11R1.22 COC(=O)C1=CNC(=O)N=C1 CS-0045841 [0,2,0,0,0,0|2,0,0]=4 284 B11R1.22 COC(=O)C1=NC=C(Cl)C=N1 CS-0036347 [0,2,0,0,0,0|2,0,0]=4 285 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 CS-B0937 [0,2,0,0,0,0|2,0,0]=4 286 B11R1.22 COC(=O)C1=NC=C(O)C=N1 CS-0056562 [0,2,0,0,0,0|2,0,0]=4 287 B11R1.22 C\C(=N\O)C1=CC=C(Cl)C=C1 CS-M3526 [0,2,0,0,0,0|1,0,0]=3 288 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 CS-W009051 [0,2,0,0,0,0|1,0,0]=3 289 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 CS-W020378 [0,2,0,0,0,0|1,0,0]=3 290 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 CS-0046949 [0,2,0,0,0,0|1,0,1]=4 291 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 CS-0096195 [0,2,0,0,0,0|1,0,1]=4 292 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 CS-W017674 [0,2,0,0,0,0|1,0,0]=3 293 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 CS-W004840 [0,2,0,0,0,0|1,0,0]=3 294 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 CS-W020416 [0,2,0,0,0,0|1,0,0]=3 295 B11R1.166 CC(=O)C1=C(N)C=C(Br)C=C1 CS-W006736 [0,2,0,0,0,0|1,0,0]=3 296 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 CS-W007177 [0,2,0,0,0,0|1,0,0]=3 297 B11R1.166 CC(=O)C1=CC=C(O)C=C1Br CS-0031408 [0,2,0,0,0,0|1,0,0]=3 298 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 CS-W006084 [0,2,0,0,0,0|1,0,0]=3 299 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 CS-W008011 [0,2,0,0,0,0|0,0,0]=2 300 B11R1.166 CC1=CC(Cl)=NC=C1C(=O)O CS-W007037 [0,2,0,0,0,0|1,0,0]=3 301 B11R1.166 CC1=CC(I)=CC=C1[N+](=O)[O-] CS-0098648 [0,2,0,0,0,0|1,0,1]=4 302 B11R1.166 CC1=CC(N)=CC=C1[N+](=O)[O-] CS-W010957 [0,2,0,0,0,0|1,0,1]=4 303 B11R1.166 CC1=CC(N)=NC=C1C(=O)O CS-0005496 [0,2,0,0,0,0|1,0,0]=3 304 B11R1.166 CC1=CC=C(C(=O)O)C(C)=N1 CS-0038247 [0,2,0,0,0,0|1,0,0]=3 305 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 CS-0045881 [0,2,0,0,0,0|2,0,0]=4 306 B11R1.166 CC1=NC(F)=CC=C1C(=O)O CS-W022498 [0,2,0,0,0,0|1,0,0]=3 307 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 CS-B0703 [0,2,0,0,0,0|1,0,0]=3 308 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=C1 CS-W005731 [0,2,0,0,0,0|1,0,0]=3 309 B11R1.166 N=C(N)C1=CC=C(Br)C=C1F CS-M2562 [0,2,0,0,0,0|2,0,0]=4 310 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1N CS-B0236 [0,2,0,0,0,0|2,0,0]=4 311 B11R1.166 NC(=S)C1=CC=C(Cl)C=C1F CS-0114061 [0,2,0,0,0,0|1,1,0]=4 312 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 CS-W007847 [0,2,0,0,0,0|0,0,0]=2 313 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 CS-W017585 [0,2,0,0,0,0|0,0,0]=2 314 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=N1 CS-W006689 [0,2,0,0,0,0|2,0,0]=4 315 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=N1 CS-W005596 [0,2,0,0,0,0|1,0,0]=3 316 B11R1.166 O=C(O)C1=C(F)C=C(F)C=N1 CS-W007725 [0,2,0,0,0,0|1,0,0]=3 317 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 CS-W022476 [0,2,0,0,0,0|1,0,0]=3 318 B11R1.166 O=C(O)C1=CC=C(F)N=C1Cl CS-0030261 [0,2,0,0,0,0|1,0,0]=3 319 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br CS-0041697 [0,2,0,0,0,0|1,0,0]=3 320 B11R1.166 O=C(O)C1=NC=C(F)C=C1Cl CS-0079379 [0,2,0,0,0,0|1,0,0]=3 321 B11R1.166 O=C(O)C1=NN=C(O)C=C1O CS-0047274 [0,2,0,0,0,0|2,0,0]=4 322 B11R1.166 O=[N+]([O-])C1=CC=C(Br)C=C1F CS-D0900 [0,2,0,0,0,0|1,0,1]=4 323 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)C=C1F CS-W002202 [0,2,0,0,0,0|1,0,1]=4 324 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)C=C1I CS-0041170 [0,2,0,0,0,0|1,0,1]=4 325 B11R1.166 O=[N+]([O-])C1=CC=C(F)C=C1Cl CS-W003054 [0,2,0,0,0,0|1,0,1]=4 326 B11R1.166 O=[N+]([O-])C1=CC=C(O)C=C1Br CS-W003684 [0,2,0,0,0,0|1,0,1]=4 327 B11R1.166 OB(O)C1=C(F)C=C(Br)C=C1 CS-0042069 [0,2,0,0,0,0|1,0,1]=4 328 B11R1.166 OB(O)C1=C(O)C=C(F)C=C1 CS-W006548 [0,2,0,0,0,0|1,0,1]=4 329 B11R1.166 OB(O)C1=CC=C(Cl)C=C1Cl CS-D1008 [0,2,0,0,0,0|1,0,1]=4 330 B11R1.16 O=C(OCCl)C1=CC=CC=C1 CS-W004798 [0,2,0,0,0,0|0,0,0]=2 331 B11R1.16 OC(CCCl)C1=CC=CC=C1 CS-W019837 [0,2,0,0,0,0|1,0,1]=4 332 B11R1.23 CCC(=O)C1=NC(Br)=CC=C1 CS-0059800 [0,2,0,0,0,0|2,0,0]=4 333 B11R1.23 CNC(=O)C1=CC=CC(Br)=C1 CS-W020621 [0,2,0,0,0,0|1,0,0]=3 334 B11R1.23 COC(=O)C1=CC(C)=CN=C1 CS-W019377 [0,2,0,0,0,0|1,0,0]=3 335 B11R1.23 COC(=O)C1=CC(F)=CN=C1 CS-0043948 [0,2,0,0,0,0|1,0,0]=3 336 B11R1.23 COC(=O)C1=CC(O)=CN=C1 CS-0044458 [0,2,0,0,0,0|1,0,0]=3 337 B11R1.23 COC(=O)C1=CC(O)=NN=C1 CS-0061835 [0,2,0,0,0,0|2,0,0]=4 338 B11R1.23 COC(=O)C1=CC(S)=CC=C1 CS-M0304 [0,2,0,0,0,0|0,0,0]=2 339 B11R1.23 COC(=O)C1=CC=CC(N)=C1 CS-W018124 [0,2,0,0,0,0|0,0,0]=2 340 B11R1.23 COC(=O)C1=NC(=O)NC=C1 CS-0040216 [0,2,0,0,0,0|2,0,0]=4 341 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 CS-W018602 [0,2,0,0,0,0|2,0,0]=4 342 B11R1.23 COC(=O)C1=NC(I)=CN=C1 CS-0097624 [0,2,0,0,0,0|2,0,0]=4 343 B11R1.23 COC(=O)C1=NC(N)=NC=C1 CS-0045769 [0,2,0,0,0,0|2,0,0]=4 344 B11R1.23 COC(=O)C1=NC(O)=CC=C1 CS-W005400 [0,2,0,0,0,0|1,0,0]=3 345 B11R1.23 COC(=O)C1=NC=CC(O)=C1 CS-0040761 [0,2,0,0,0,0|1,0,0]=3 346 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 CS-M2109 [0,2,0,0,0,0|1,0,1]=4 347 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 CS-0037552 [0,2,0,0,0,0|1,0,0]=3 348 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 CS-B0677 [0,2,0,0,0,0|1,0,1]=4 349 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 CS-B0678 [0,2,0,0,0,0|1,0,1]=4 350 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 CS-W008243 [0,2,0,0,0,0|1,0,0]=3 351 B11R1.222 CC1=CC=CC=C1C(=O)CBr CS-0029521 [0,2,0,0,0,0|1,0,0]=3 352 B11R1.222 CNC(=O)C1=CC=CC=C1N CS-W004940 [0,2,0,0,0,0|1,0,0]=3 353 B11R1.222 COC(=O)C1=C(C)C=CC=N1 CS-W008502 [0,2,0,0,0,0|1,0,0]=3 354 B11R1.222 COC(=O)C1=C(O)N=CC=C1 CS-W007840 [0,2,0,0,0,0|1,0,0]=3 355 B11R1.222 COC(=O)C1=CC=CN=C1N CS-M1170 [0,2,0,0,0,0|1,0,0]=3 356 B11R1.222 COC(=O)C1=NC=CC=C1O CS-W022831 [0,2,0,0,0,0|1,0,0]=3 357 B11R1.222 COC(=O)C1=NC=CN=C1Br CS-D1608 [0,2,0,0,0,0|2,0,0]=4 358 B11R1.222 COC(=O)C1=NC=CN=C1Cl CS-W019277 [0,2,0,0,0,0|2,0,0]=4 359 B11R1.222 NCC(=O)C1=CC=CC=C1F CS-W021538 [0,2,0,0,0,0|1,0,0]=3 360 B11R1.222 NNC(=O)C1=CC=CC=C1Cl CS-B1329 [0,2,0,0,0,0|1,0,0]=3 361 B11R1.222 O=C(CBr)C1=CC=CC=C1Cl CS-0008415 [0,2,0,0,0,0|1,0,0]=3 362 B11R1.87 CC(C)(O)C1=C(O)C=CC=C1 CS-0047114 [0,2,0,0,0,0|1,0,1]=4 363 B11R1.87 CC1=CC=CC=C1S(=O)(=O)O CS-W007285 [0,2,0,0,0,0|1,0,0]=3 364 B11R1.87 NS(=O)(=O)C1=CC=CC=C1Br CS-0022414 [0,2,0,0,0,0|1,0,1]=4 365 B11R1.87 O=S(=O)(O)C1=CC=CC=C1I CS-0041161 [0,2,0,0,0,0|1,0,0]=3 366 B11R1.87 O=S(=O)([O-])C1=CC=CC=C1I CS-0090215 [0,2,0,0,0,0|1,0,1]=4 367 B11R1.155 CC(C)(O)C1=CC=CC(Br)=C1 CS-W021388 [0,2,0,0,0,0|1,0,1]=4 368 B11R1.155 O=S(=O)(F)C1=CC=CC(Br)=C1 CS-0101418 [0,2,0,0,0,0|1,0,1]=4 369 B11R1.53 CC(=O)C1=CC=CC=C1C#N CS-W005120 [0,2,0,0,0,0|1,0,0]=3 370 B11R1.53 NCC1=CC=CC=C1B(O)O CS-W019371 [0,2,0,0,0,0|1,0,1]=4 371 B11R1.53 O=CC1=CC=CC=C1B(O)O CS-W007320 [0,2,0,0,0,0|1,0,1]=4 372 B11R1.156 CC(=O)C1=C(C)C=CC=C1C CS-W005839 [0,2,0,0,0,0|1,0,0]=3 373 B11R1.156 CC(=O)C1=C(F)C=CC=C1Br CS-W018884 [0,2,0,0,0,0|1,0,0]=3 374 B11R1.156 CC(=O)C1=C(F)C=CC=C1O CS-W005023 [0,2,0,0,0,0|1,0,0]=3 375 B11R1.156 CC(=O)C1=C(O)C=CC=C1Br CS-W019055 [0,2,0,0,0,0|1,0,0]=3 376 B11R1.156 CC1=C([N+](=O)[O-])C(F)=CC=C1 CS-W007827 [0,2,0,0,0,0|1,0,1]=4 377 B11R1.156 CC1=C([N+](=O)[O-])C(O)=CC=C1 CS-W006081 [0,2,0,0,0,0|1,0,1]=4 378 B11R1.156 CC1=CC=CC(Cl)=C1[N+](=O)[O-] CS-D1523 [0,2,0,0,0,0|1,0,1]=4 379 B11R1.156 CC1=NC=CC(C)=C1C(=O)O CS-0052147 [0,2,0,0,0,0|1,0,0]=3 380 B11R1.156 NC1=CC=CC(I)=C1C(=O)O CS-0041326 [0,2,0,0,0,0|0,0,0]=2 381 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br CS-W005569 [0,2,0,0,0,0|0,0,0]=2 382 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1Br CS-0041699 [0,2,0,0,0,0|1,0,1]=4 383 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1Cl CS-W007920 [0,2,0,0,0,0|1,0,1]=4 384 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1F CS-W003306 [0,2,0,0,0,0|1,0,1]=4 385 B11R1.159 CC(=O)C1=CC=CC(F)=C1O CS-0044517 [0,2,0,0,0,0|1,0,0]=3 386 B11R1.159 CC(=O)C1=CC=CC(O)=C1N CS-0033833 [0,2,0,0,0,0|1,0,0]=3 387 B11R1.159 CC1=C(Br)C=CC=C1B(O)O CS-0099140 [0,2,0,0,0,0|1,0,1]=4 388 B11R1.159 CC1=C(Br)C=NC=C1C(=O)O CS-0046901 [0,2,0,0,0,0|1,0,0]=3 389 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1Br CS-W002413 [0,2,0,0,0,0|1,0,1]=4 390 B11R1.159 CC1=NC=NC(C(=O)O)=C1C CS-0036852 [0,2,0,0,0,0|2,0,0]=4 391 B11R1.159 CN1C(=O)C=CC=C1C(=O)O CS-W019189 [0,2,0,0,0,0|1,0,0]=3 392 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 CS-0062146 [0,2,0,0,0,0|2,0,0]=4 393 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O CS-B0777 [0,2,0,0,0,0|0,0,0]=2 394 B11R1.159 NC1=C(C(=O)O)C=NC=C1Br CS-W006865 [0,2,0,0,0,0|1,0,0]=3 395 B11R1.159 NC1=C(I)C=CC=C1C(=O)O CS-0030571 [0,2,0,0,0,0|0,0,0]=2 396 B11R1.159 NC1=C(O)C=CC=C1[N+](=O)[O-] CS-W008642 [0,2,0,0,0,0|1,0,1]=4 397 B11R1.159 NC1=C([N+](=O)[O-])C=CC=C1Br CS-W006849 [0,2,0,0,0,0|1,0,1]=4 398 B11R1.159 NC1=C([N+](=O)[O-])C=CC=C1F CS-D0998 [0,2,0,0,0,0|1,0,1]=4 399 B11R1.159 O=C(O)C1=C(Cl)C(F)=CC=C1 CS-W017481 [0,2,0,0,0,0|0,0,0]=2 400 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 CS-W007697 [0,2,0,0,0,0|0,0,0]=2 401 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 CS-W006030 [0,2,0,0,0,0|0,0,0]=2 402 B11R1.159 O=C(O)C1=CC=CC(Br)=C1I CS-0098092 [0,2,0,0,0,0|0,0,0]=2 403 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I CS-0041180 [0,2,0,0,0,0|0,0,0]=2 404 B11R1.159 O=[N+]([O-])C1=C(I)C(Br)=CC=C1 CS-0041001 [0,2,0,0,0,0|1,0,1]=4 405 B11R1.159 O=[N+]([O-])C1=CC=CC(Br)=C1O CS-W021626 [0,2,0,0,0,0|1,0,1]=4 406 B11R1.159 OB(O)C1=C(F)C(F)=CC=C1 CS-W020412 [0,2,0,0,0,0|1,0,1]=4 407 B11R1.159 OB(O)C1=CC=CC(F)=C1Br CS-0040510 [0,2,0,0,0,0|1,0,1]=4 408 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 CS-W004802 [0,2,0,0,0,0|1,0,0]=3 409 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 CS-W005834 [0,2,0,0,0,0|1,0,0]=3 410 B11R1.167 CC(=O)C1=CC(Br)=CC=C1C CS-0042136 [0,2,0,0,0,0|1,0,0]=3 411 B11R1.167 CC(=O)C1=CC(O)=CC=C1Br CS-0036962 [0,2,0,0,0,0|1,0,0]=3 412 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 CS-D1105 [0,2,0,0,0,0|0,0,0]=2 413 B11R1.167 CC1=C([N+](=O)[O-])C=C(O)C=C1 CS-D1224 [0,2,0,0,0,0|1,0,1]=4 414 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 CS-0008584 [0,2,0,0,0,0|0,0,0]=2 415 B11R1.167 CC1=CC(N(=O)=O)=C(Br)C=C1 CS-W014874 [0,2,0,0,0,0|1,0,1]=4 416 B11R1.167 CC1=CC=C(C)C(B(O)O)=C1 CS-D1026 [0,2,0,0,0,0|1,0,1]=4 417 B11R1.167 CC1=CC=C(Cl)N=C1C(=O)O CS-D0312 [0,2,0,0,0,0|1,0,0]=3 418 B11R1.167 CC1=CC=C(F)C(C(=O)O)=C1 CS-W019919 [0,2,0,0,0,0|0,0,0]=2 419 B11R1.167 CC1=CC=C(I)C(C(=O)O)=C1 CS-W009152 [0,2,0,0,0,0|0,0,0]=2 420 B11R1.167 NC(=O)C1=C(N)N=CC(Br)=C1 CS-D0350 [0,2,0,0,0,0|2,0,0]=4 421 B11R1.167 NC(=O)C1=CC(Br)=CC=C1O CS-W022309 [0,2,0,0,0,0|1,0,0]=3 422 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O CS-0006535 [0,2,0,0,0,0|1,0,0]=3 423 B11R1.167 NC1=CC=C(F)C=C1B(O)O CS-0063857 [0,2,0,0,0,0|1,0,1]=4 424 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O CS-W009220 [0,2,0,0,0,0|1,0,0]=3 425 B11R1.167 NC1=CN=C(F)C=C1C(=O)O CS-W006661 [0,2,0,0,0,0|1,0,0]=3 426 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 CS-D1207 [0,2,0,0,0,0|0,0,0]=2 427 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1F CS-D0438 [0,2,0,0,0,0|1,0,0]=3 428 B11R1.167 O=C(O)C1=CC(I)=CC=C1Br CS-D1730 [0,2,0,0,0,0|0,0,0]=2 429 B11R1.167 O=C(O)C1=NC(Br)=CN=C1O CS-0042066 [0,2,0,0,0,0|2,0,0]=4 430 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F CS-W018881 [0,2,0,0,0,0|1,0,0]=3 431 B11R1.167 O=C([O-])C1=C(O)C=CC(O)=C1 CS-W017420 [0,2,0,0,0,0|0,0,1]=3 432 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(Br)=C1 CS-W019135 [0,2,0,0,0,0|1,0,1]=4 433 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CC=C1F CS-W019164 [0,2,0,0,0,0|1,0,1]=4 434 B11R1.167 O=[N+]([O-])C1=CC(I)=CC=C1Br CS-0105563 [0,2,0,0,0,0|1,0,1]=4 435 B11R1.167 O=[N+]([O-])C1=CC(I)=CC=C1Cl CS-0041172 [0,2,0,0,0,0|1,0,1]=4 436 B11R1.167 O=[N+]([O-])C1=CC(I)=CC=C1F CS-W004953 [0,2,0,0,0,0|1,0,1]=4 437 B11R1.167 O=[N+]([O-])C1=CC(O)=CC=C1I CS-0103378 [0,2,0,0,0,0|1,0,1]=4 438 B11R1.167 OB(O)C1=C(F)C=CC(O)=C1 CS-0043940 [0,2,0,0,0,0|1,0,1]=4 439 B11R1.167 OB(O)C1=CC(F)=CC=C1O CS-W020608 [0,2,0,0,0,0|1,0,1]=4 440 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 CS-0015117 [0,2,0,0,0,0|1,0,0]=3 441 B11R1.74 CC1=CC(B(O)O)=CC(Cl)=C1 CS-W005723 [0,2,0,0,0,0|1,0,1]=4 442 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 CS-0007511 [0,2,0,0,0,0|1,0,0]=3 443 B11R1.74 CC1=CC(C(=O)O)=NC(C)=C1 CS-0038256 [0,2,0,0,0,0|1,0,0]=3 444 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 CS-W019036 [0,2,0,0,0,0|1,0,0]=3 445 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=N1 CS-0045868 [0,2,0,0,0,0|2,0,0]=4 446 B11R1.74 CC1=CC(C)=CC(B(O)O)=C1 CS-D1028 [0,2,0,0,0,0|1,0,1]=4 447 B11R1.74 CC1=CC(F)=CC(N(=O)=O)=C1 CS-W016256 [0,2,0,0,0,0|1,0,1]=4 448 B11R1.74 CC1=NC(Br)=CC(C(=O)O)=C1 CS-0098743 [0,2,0,0,0,0|1,0,0]=3 449 B11R1.74 NC1=CC(Cl)=CC(C(=O)O)=C1 CS-W021836 [0,2,0,0,0,0|0,0,0]=2 450 B11R1.74 NC1=CC([N+](=O)[O-])=CC(F)=C1 CS-W006572 [0,2,0,0,0,0|1,0,1]=4 451 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 CS-M1190 [0,2,0,0,0,0|0,0,0]=2 452 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 CS-W011977 [0,2,0,0,0,0|0,0,0]=2 453 B11R1.74 O=[N+]([O-])C1=CC(Br)=CC(O)=C1 CS-W006488 [0,2,0,0,0,0|1,0,1]=4 454 B11R1.74 O=[N+]([O-])C1=CC(Cl)=CC(O)=C1 CS-W005918 [0,2,0,0,0,0|1,0,1]=4 455 B11R1.74 O=[N+]([O-])C1=CC(F)=CC(Br)=C1 CS-W007693 [0,2,0,0,0,0|1,0,1]=4 456 B11R1.74 OB(O)C1=CC(F)=CC(F)=C1 CS-D1004 [0,2,0,0,0,0|1,0,1]=4 457 B11R1.266 COC1=CC=CC(C(=O)O)=N1 CS-D1581 [0,2,0,0,0,0|1,0,0]=3 458 B11R1.266 N#CC1=CC(B(O)O)=CC=C1 CS-W008696 [0,2,0,0,0,0|1,0,1]=4 459 B11R1.266 N#CC1=CC(C(=O)O)=CC=C1 CS-D1397 [0,2,0,0,0,0|0,0,0]=2 460 B11R1.266 N#CC1=CC=CC(C(=O)O)=N1 CS-W018606 [0,2,0,0,0,0|1,0,0]=3 461 B11R1.266 N=C(N)C1=CC=CC(CN)=C1 CS-0064060 [0,2,0,0,0,0|2,0,0]=4 462 B11R1.266 NC(=O)C1=CC=CC(C=O)=C1 CS-W021929 [0,2,0,0,0,0|1,0,0]=3 463 B11R1.266 O=C(O)C1=CC(CO)=NC=C1 CS-0099794 [0,2,0,0,0,0|1,0,0]=3 464 B11R1.266 O=[N+]([O-])C1=CC(CO)=CC=C1 CS-0096804 [0,2,0,0,0,0|1,0,1]=4 465 B11R2.10 IC1=NC2=CC=CC=C2S1 CS-W005648 [0,0,0,1,0,1|1,1,0]=4 466 B11R2.10 O=C1NC2=C(C=NC=C2)N1 CS-W021327 [0,0,0,1,0,1|2,0,0]=4 467 B11R2.10 OC1=NC2=CC=CC=C2N1 CS-W008003 [0,0,0,1,0,1|1,0,0]=3 468 B11R2.1 BrC1=NNC2=CC=CC=C21 CS-W007434 [0,1,0,1,0,0|2,0,0]=4 469 B11R2.1 CC1=NOC2=CC=CC=C21 CS-W008538 [0,1,0,1,0,0|1,0,0]=3 470 B11R2.1 NC1=NCC2=CC=CC=C21 CS-B1325 [0,1,0,1,0,0|2,0,0]=4 471 B11R2.1 NC1=NOC2=C1C=CC=C2 CS-W009278 [0,1,0,1,0,0|1,0,0]=3 472 B11R2.1 NC1COC2=CC=CC=C21 CS-0070832 [0,1,0,1,0,0|1,0,1]=4 473 B11R2.1 O=C1NNC2=C1C=CN=C2 CS-W021333 [0,1,0,1,0,0|2,0,0]=4 474 B7R1.1 O=CC1=CC=CN1 CS-D0925 [1,0,0,0,1,0|1,0,0]=3 475 B7R1.1 O=CC1=CN=CS1 CS-D0828 [1,0,0,0,1,0|2,0,0]=4 476 B7R1.1 O=CC1=CNN=C1 CS-W019597 [1,0,0,0,1,0|2,0,0]=4 477 B11R1.91 O=C(O)CCC1=CN=CN=C1 CS-0047341 [0,0,0,0,0,2|2,0,0]=4 478 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 CS-W021781 [0,0,0,0,0,2|1,0,0]=3 479 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 CS-W021780 [0,0,0,0,0,2|1,0,0]=3 480 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 CS-W021067 [0,0,0,0,0,2|1,0,1]=4