0 B9R1.6 CN(C)C1=NC=NC=C1 O12006 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.6 C[C@H](Br)C1=NC=CN=C1 C77147 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13293 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.6 C[C@H](N)C1=CN=CN=C1 P14618 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 C[C@H](N)C1=NC=CC=N1 72045 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.6 C[C@H](N)C1=NC=CN=C1 C93141 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.6 C[C@H](N)C1=NC=CN=C1 C93144 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.6 C[C@H](N)C1=NC=NC=C1 N10689 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.6 C[C@H](N)C1=NC=NC=C1 P10880 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.6 C[C@H](O)C1=NC=NC=C1 AT18318 [0,0,0,0,0,0|2,1,0]=3 13 B9R1.6 N=C(N)C1=CC=NC=C1 71449 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.6 O=C(Cl)C1=CC=NC=C1 D78267 [0,0,0,0,0,0|2,1,1]=4 15 B9R1.6 O=C([O-])C1=NC=CC=C1 T71798 [0,0,0,0,0,0|2,1,1]=4 16 B9R1.6 O=[13C](O)C1=CC=CC=C1 F13987 [0,0,0,0,0,0|1,1,1]=3 17 B9R1.6 [2H]C(=C)C1=CC=CC=C1 D97969 [0,0,0,0,0,0|1,0,2]=3 18 B9R1.6 [2H]N([2H])C1=CC=CC=C1 D98688 [0,0,0,0,0,0|3,0,0]=3 19 B8R1.2 BrCC1=CN=CN=C1 F52462 [1,0,0,0,0,0|3,0,0]=4 20 B8R1.2 BrCC1=NC=CC=N1 D79434 [1,0,0,0,0,0|3,0,0]=4 21 B8R1.2 C=CC1=CC=CN=C1 71366 [1,0,0,0,0,0|1,0,2]=4 22 B8R1.2 CNC1=CC=CN=N1 79165 [1,0,0,0,0,0|3,0,0]=4 23 B8R1.2 CSC1=NC=CC=N1 O10841 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.2 ClCC1=NC=NC=C1 A10562 [1,0,0,0,0,0|3,0,0]=4 25 B8R1.2 NCC1=CC=CC=C1 T70846 [1,0,0,0,0,0|1,0,0]=2 26 B8R1.2 SCC1=NC=CN=C1 78318 [1,0,0,0,0,0|2,0,0]=3 27 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.13 CC(C)C1=NC=C(N)C=N1 81917 [0,1,0,0,0,0|3,0,0]=4 29 B10R1.13 CC(C)C1=NN=C(Br)C=C1 C14147 [0,1,0,0,0,0|3,0,0]=4 30 B10R1.13 CC1=CC=C([S@@](=O)Cl)C=C1 C14066 [0,1,0,0,0,0|2,1,0]=4 31 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10705 [0,1,0,0,0,0|2,0,0]=3 32 B10R1.13 CC1=CN=C([C@H](C)N)C=N1 56573 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56564 [0,1,0,0,0,0|2,0,0]=3 34 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56569 [0,1,0,0,0,0|2,0,0]=3 35 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 AT10886 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 AT10887 [0,1,0,0,0,0|3,0,0]=4 37 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 C90363 [0,1,0,0,0,0|3,0,0]=4 38 B10R1.13 CC1=NC=C([C@H](C)O)C=N1 AT10878 [0,1,0,0,0,0|2,1,0]=4 39 B10R1.13 CN(C)C1=CC=C(S)C=C1 T70960 [0,1,0,0,0,0|2,0,0]=3 40 B10R1.13 CN(C)C1=NC=C(N)C=C1 D74940 [0,1,0,0,0,0|3,0,0]=4 41 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 F16941 [0,1,0,0,0,0|1,0,0]=2 42 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 N12656 [0,1,0,0,0,0|1,0,0]=2 43 B10R1.13 C[C@H](N)C1=CN=C(Br)C=C1 N11221 [0,1,0,0,0,0|2,0,0]=3 44 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 D81683 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 Y10703 [0,1,0,0,0,0|2,0,0]=3 46 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 90531 [0,1,0,0,0,0|2,0,0]=3 47 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 N16973 [0,1,0,0,0,0|2,0,0]=3 48 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 90529 [0,1,0,0,0,0|2,0,0]=3 49 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 91194 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 P12221 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.13 C[C@H](O)C1=CN=C(F)C=C1 AT10687 [0,1,0,0,0,0|1,1,0]=3 52 B10R1.13 C[C@H](O)C1=NC=C(F)C=C1 AT10690 [0,1,0,0,0,0|1,1,0]=3 53 B10R1.13 C[C@H](O)C1=NC=C(O)C=N1 73092 [0,1,0,0,0,0|2,1,0]=4 54 B10R1.13 NC1=CC=C(C(F)F)C=C1 84195 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.13 NC1=NC=C(C(F)F)C=C1 W16938 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.15 C#C[C@@H](O)C1=CC=NC=C1 O10327 [0,1,0,0,0,0|1,1,1]=4 57 B10R1.15 C#C[C@@H](O)C1=CN=CC=C1 AC5787 [0,1,0,0,0,0|1,1,1]=4 58 B10R1.15 C#C[C@@H](O)C1=NC=CC=C1 AC5788 [0,1,0,0,0,0|1,1,1]=4 59 B10R1.15 C=C(CO)C1=CC=CC=C1 A11577 [0,1,0,0,0,0|1,0,1]=3 60 B10R1.15 CCC(=O)C1=CC=NC=C1 N12310 [0,1,0,0,0,0|1,1,1]=4 61 B10R1.15 CCN(C)C1=NC=CC=C1 T72928 [0,1,0,0,0,0|3,0,0]=4 62 B10R1.15 CC[C@H](N)C1=CC=CC=C1 N12648 [0,1,0,0,0,0|1,0,0]=2 63 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10611 [0,1,0,0,0,0|2,0,0]=3 64 B10R1.15 CC[C@H](N)C1=NC=CN=C1 P11367 [0,1,0,0,0,0|3,0,0]=4 65 B10R1.15 CC[C@H](N)C1=NC=CN=C1 P15053 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 L10186 [0,1,0,0,0,0|1,0,0]=2 67 B10R1.15 COC(=N)C1=CC=CC=C1 W12775 [0,1,0,0,0,0|1,0,1]=3 68 B10R1.15 COC(=N)C1=CC=NC=C1 D87808 [0,1,0,0,0,0|2,0,1]=4 69 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1146 [0,1,0,0,0,0|0,1,0]=2 70 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1167 [0,1,0,0,0,0|0,1,0]=2 71 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10550 [0,1,0,0,0,0|0,1,0]=2 72 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10551 [0,1,0,0,0,0|0,1,0]=2 73 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14528 [0,1,0,0,0,0|0,1,0]=2 74 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14530 [0,1,0,0,0,0|0,1,0]=2 75 B10R1.15 NCC(=O)C1=CN=CC=C1 D87739 [0,1,0,0,0,0|1,1,1]=4 76 B10R1.15 NCC(=O)C1=CN=CC=C1 F13353 [0,1,0,0,0,0|1,1,1]=4 77 B10R1.15 NC[C@H](O)C1=CC=NC=C1 C78562 [0,1,0,0,0,0|1,1,0]=3 78 B10R1.15 NC[C@H](O)C1=CN=CC=C1 33361 [0,1,0,0,0,0|1,1,0]=3 79 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11546 [0,1,0,0,0,0|2,0,0]=3 80 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12429 [0,1,0,0,0,0|2,0,0]=3 81 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12120 [0,1,0,0,0,0|2,0,0]=3 82 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12118 [0,1,0,0,0,0|2,0,0]=3 83 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12119 [0,1,0,0,0,0|2,0,0]=3 84 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12430 [0,1,0,0,0,0|2,0,0]=3 85 B10R1.15 N\C(=N/O)C1=CC=CC=C1 L10027 [0,1,0,0,0,0|1,1,1]=4 86 B10R1.15 O=C(CO)C1=CC=NC=C1 AC5781 [0,1,0,0,0,0|1,1,1]=4 87 B10R1.15 O=C(CO)C1=CN=CC=C1 AC2803 [0,1,0,0,0,0|1,1,1]=4 88 B10R1.15 O[C@@H](CCl)C1=CN=CC=C1 Y10944 [0,1,0,0,0,0|1,1,0]=3 89 B10R1.28 CC(C)(C)C1=NC=CC=C1 C75774 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.28 CC(C)(C)C1=NC=CN=C1 T70779 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.28 CC(C)(N)C1=NC=CC=N1 AT12626 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.28 CC(C)(N)C1=NC=CC=N1 D75134 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.28 CC(C)(O)C1=NC=CC=N1 AT18243 [0,1,0,0,0,0|2,1,0]=4 94 B10R1.28 ClC(Cl)(Cl)C1=CN=CC=C1 C71811 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.28 ClC(Cl)(Cl)C1=NC=CC=C1 S11288 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.28 FC(F)(Cl)C1=CC=CC=C1 36909 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 I11569 [0,1,0,0,0,0|2,1,0]=4 98 B10R1.28 [2H]C(C)(C)C1=CC=CC=C1 D98007 [0,1,0,0,0,0|1,0,0]=2 99 B10R1.28 [2H]C([2H])(Br)C1=CC=CC=C1 D99472 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.28 [2H]C([2H])(C)C1=CC=CC=C1 D99069 [0,1,0,0,0,0|1,0,0]=2 101 B10R1.28 [2H]C([2H])(O)C1=CC=CC=C1 AT24168 [0,1,0,0,0,0|1,1,0]=3 102 B10R1.28 [2H]C([2H])([2H])C1=NC=CC=C1 D98627 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.28 [2H][C@@](C)(O)C1=CC=CC=C1 D98825 [0,1,0,0,0,0|0,1,0]=2 104 B10R1.61 BrC1=C(C(Br)Br)C=CN=C1 W10378 [0,1,0,0,0,0|3,0,0]=4 105 B10R1.61 C=C(C)C1=C(I)C=CC=C1 E72643 [0,1,0,0,0,0|1,0,1]=3 106 B10R1.61 CC(=O)C1=C(C)C=CN=C1 69949 [0,1,0,0,0,0|1,1,1]=4 107 B10R1.61 CC(=O)C1=C(C)C=NC=C1 28203 [0,1,0,0,0,0|1,1,1]=4 108 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 86430 [0,1,0,0,0,0|1,1,1]=4 109 B10R1.61 CC(=O)C1=C(N)C=NC=C1 W18377 [0,1,0,0,0,0|1,1,1]=4 110 B10R1.61 CC(=O)C1=C(S)C=CC=C1 93483 [0,1,0,0,0,0|0,1,1]=3 111 B10R1.61 CC(=O)C1=CC=CNC1=O C10188 [0,1,0,0,0,0|1,1,1]=4 112 B10R1.61 CC(C)C1=CN=CN=C1Cl H10240 [0,1,0,0,0,0|3,0,0]=4 113 B10R1.61 CC(C)C1=NC=CN=C1Cl AT24532 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.61 CC(C)C1=NC=CN=C1N 60031 [0,1,0,0,0,0|3,0,0]=4 115 B10R1.61 CC(C)C1=NC=CN=C1N W15952 [0,1,0,0,0,0|3,0,0]=4 116 B10R1.61 CC1=C(C(C)C)C=CC=C1 T71005 [0,1,0,0,0,0|1,0,0]=2 117 B10R1.61 CC1=C(P(Cl)Cl)C=CC=C1 AC9855 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.61 CC1=[13C](C(=O)O)C=CC=C1 D98685 [0,1,0,0,0,0|1,1,1]=4 119 B10R1.61 C[C@H](Br)C1=C(Cl)C=CC=C1 C77623 [0,1,0,0,0,0|1,0,0]=2 120 B10R1.61 C[C@H](Cl)C1=C(Cl)C=CC=C1 A11172 [0,1,0,0,0,0|1,0,0]=2 121 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70081 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.61 C[C@H](N)C1=C(Cl)C=NC=C1 N14402 [0,1,0,0,0,0|2,0,0]=3 123 B10R1.61 C[C@H](N)C1=C(O)C=CC=N1 N14916 [0,1,0,0,0,0|2,0,0]=3 124 B10R1.61 C[C@H](N)C1=CC=CN=C1N P19332 [0,1,0,0,0,0|2,0,0]=3 125 B10R1.61 C[C@H](O)C1=C(N)N=CC=C1 C10363 [0,1,0,0,0,0|1,1,0]=3 126 B10R1.61 FC(F)C1=C(Br)C=NC=C1 AT12861 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.61 FC(F)C1=C(Br)C=NC=C1 D76051 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.61 FC(F)C1=CC=CN=C1Br 79327 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.61 N=C(N)C1=C(F)C=CC=C1 W10322 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.61 O=C([O-])C1=C(Cl)C=CC=C1 I11424 [0,1,0,0,0,0|1,1,1]=4 131 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 FD10574 [0,1,0,0,0,0|1,1,1]=4 132 B10R1.61 O=C1C=CC=CN1C(F)F AT12838 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.113 C=C(C)C1=CC=CC(Br)=C1 AC1303 [0,1,0,0,0,0|1,0,1]=3 134 B10R1.113 CC(=O)C1=CC(=O)NC=C1 90624 [0,1,0,0,0,0|1,1,1]=4 135 B10R1.113 CC(=O)C1=NC(N)=CC=C1 N14723 [0,1,0,0,0,0|1,1,1]=4 136 B10R1.113 CC(C)C1=CC(Cl)=NC=C1 D71924 [0,1,0,0,0,0|2,0,0]=3 137 B10R1.113 CC(C)C1=NC=CC(Cl)=N1 W12563 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.113 CC1=CC(C(F)F)=NC=C1 C91253 [0,1,0,0,0,0|3,0,0]=4 139 B10R1.113 CC1=CC=CC(C(C)C)=C1 T71023 [0,1,0,0,0,0|1,0,0]=2 140 B10R1.113 CC1=CC=CC(N(C)C)=N1 N10110 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.113 CC1=CC=CC([C@H](C)N)=N1 N13137 [0,1,0,0,0,0|2,0,0]=3 142 B10R1.113 CC1=NC=CC(C(C)C)=N1 O11252 [0,1,0,0,0,0|3,0,0]=4 143 B10R1.113 CC1=NC=CC([C@H](C)O)=C1 F13150 [0,1,0,0,0,0|1,1,0]=3 144 B10R1.113 CN(C)C1=CC(Br)=CN=C1 N10343 [0,1,0,0,0,0|3,0,0]=4 145 B10R1.113 CN(C)C1=CC=CC(F)=N1 AT20362 [0,1,0,0,0,0|3,0,0]=4 146 B10R1.113 CN(C)C1=NC=CC(Cl)=C1 C16301 [0,1,0,0,0,0|3,0,0]=4 147 B10R1.113 CN(N)C1=CC=CC(Br)=N1 95484 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.113 C[C@H](Br)C1=CC(Cl)=CC=C1 55213 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=C1 55217 [0,1,0,0,0,0|1,0,0]=2 150 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=N1 55243 [0,1,0,0,0,0|2,0,0]=3 151 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 90822 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 AC3205 [0,1,0,0,0,0|2,0,0]=3 153 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 90825 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 N10537 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 N13087 [0,1,0,0,0,0|2,0,0]=3 156 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 90539 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 90540 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70883 [0,1,0,0,0,0|1,0,0]=2 159 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y11581 [0,1,0,0,0,0|1,0,0]=2 160 B10R1.113 C[C@H](N)C1=CC=CC(N)=N1 D81409 [0,1,0,0,0,0|2,0,0]=3 161 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 F16880 [0,1,0,0,0,0|1,0,0]=2 162 B10R1.113 C[C@H](N)C1=NC=CC(Br)=C1 90526 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.113 C[C@H](N)C1=NC=CC(Cl)=C1 N14934 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.113 C[C@H](N)C1=NC=CC(Cl)=C1 N14935 [0,1,0,0,0,0|2,0,0]=3 165 B10R1.113 C[C@H](O)C1=CC(F)=CN=C1 AT10686 [0,1,0,0,0,0|1,1,0]=3 166 B10R1.113 C[C@H](O)C1=CC(N)=NC=C1 CS1317 [0,1,0,0,0,0|1,1,0]=3 167 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1245 [0,1,0,0,0,0|0,1,0]=2 168 B10R1.113 C[C@H](O)C1=CC=CC(F)=N1 AT10689 [0,1,0,0,0,0|1,1,0]=3 169 B10R1.113 C[C@H](O)C1=CC=CC(O)=C1 59959 [0,1,0,0,0,0|0,1,0]=2 170 B10R1.113 C[C@H](O)C1=NC=CC(F)=C1 AT10691 [0,1,0,0,0,0|1,1,0]=3 171 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50248 [0,1,0,0,0,0|1,1,0]=3 172 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50315 [0,1,0,0,0,0|1,1,0]=3 173 B10R1.113 FC(F)C1=CC(Cl)=CN=C1 94167 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.113 FC(F)C1=CC=CC(S)=C1 97706 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.113 FC1=NC(C(F)F)=CC=C1 E72212 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.113 NC(=S)C1=CC=CC(I)=C1 A10482 [0,1,0,0,0,0|1,0,2]=4 177 B10R1.113 O=C([O-])C1=CC=CC(Cl)=C1 I11436 [0,1,0,0,0,0|1,1,1]=4 178 B10R1.113 O=[N+]([O-])C1=CC=CC(S)=C1 AT20860 [0,1,0,0,0,0|2,1,0]=4 179 B10R1.113 OB(O)C1=CC=CC(S)=C1 C10361 [0,1,0,0,0,0|2,1,0]=4 180 B10R2.6 C1=CC(C2CC2)=CC=N1 59829 [0,0,0,1,0,0|2,0,0]=3 181 B10R2.6 C1=CN=C(C2CC2)N=C1 P12514 [0,0,0,1,0,0|3,0,0]=4 182 B10R2.320 N[C@H]1CC2=C1C=CC=C2 AT20398 [0,0,0,1,0,0|1,0,0]=2 183 B8R1.7 C[C@H](N)C1=CC=CO1 74860 [0,0,0,0,1,0|2,0,0]=3 184 B8R1.7 C[C@H](N)C1=CC=CO1 F16901 [0,0,0,0,1,0|2,0,0]=3 185 B8R1.7 C[C@H](N)C1=CC=CO1 N12744 [0,0,0,0,1,0|2,0,0]=3 186 B8R1.7 C[C@H](N)C1=CN=CN1 D71963 [0,0,0,0,1,0|3,0,0]=4 187 B8R1.7 C[C@H](N)C1=CN=CS1 AT14771 [0,0,0,0,1,0|3,0,0]=4 188 B8R1.7 C[C@H](N)C1=CN=CS1 AT14772 [0,0,0,0,1,0|3,0,0]=4 189 B8R1.7 C[C@H](N)C1=COC=C1 AT17538 [0,0,0,0,1,0|2,0,0]=3 190 B8R1.7 C[C@H](N)C1=COC=C1 N16718 [0,0,0,0,1,0|2,0,0]=3 191 B8R1.7 C[C@H](N)C1=CSC=C1 27875 [0,0,0,0,1,0|2,0,0]=3 192 B8R1.7 C[C@H](N)C1=CSC=N1 AT12534 [0,0,0,0,1,0|3,0,0]=4 193 B8R1.7 C[C@H](N)C1=CSC=N1 N14692 [0,0,0,0,1,0|3,0,0]=4 194 B8R1.7 C[C@H](N)C1=CSC=N1 N14693 [0,0,0,0,1,0|3,0,0]=4 195 B8R1.7 C[C@H](N)C1=NC=CN1 AT15627 [0,0,0,0,1,0|3,0,0]=4 196 B8R1.7 C[C@H](N)C1=NC=CN1 AT15630 [0,0,0,0,1,0|3,0,0]=4 197 B8R1.7 C[C@H](N)C1=NC=CN1 W10071 [0,0,0,0,1,0|3,0,0]=4 198 B8R1.7 C[C@H](N)C1=NC=CS1 AT14699 [0,0,0,0,1,0|3,0,0]=4 199 B8R1.7 C[C@H](N)C1=NNC=C1 32104 [0,0,0,0,1,0|3,0,0]=4 200 B8R1.7 C[C@H](O)C1=CC=CS1 71923 [0,0,0,0,1,0|1,1,0]=3 201 B8R1.7 C[C@H](O)C1=CC=CS1 AT16382 [0,0,0,0,1,0|1,1,0]=3 202 B8R1.7 C[C@H](O)C1=CC=CS1 AT16384 [0,0,0,0,1,0|1,1,0]=3 203 B8R1.7 C[C@H](O)C1=CN=CS1 AT14775 [0,0,0,0,1,0|2,1,0]=4 204 B8R1.7 C[C@H](O)C1=CN=CS1 AT14778 [0,0,0,0,1,0|2,1,0]=4 205 B8R1.7 C[C@H](O)C1=CN=CS1 AT14782 [0,0,0,0,1,0|2,1,0]=4 206 B8R1.7 C[C@H](O)C1=COC=C1 AT17475 [0,0,0,0,1,0|1,1,0]=3 207 B8R1.7 C[C@H](O)C1=COC=C1 AT17477 [0,0,0,0,1,0|1,1,0]=3 208 B8R1.7 C[C@H](O)C1=COC=N1 F13182 [0,0,0,0,1,0|2,1,0]=4 209 B8R1.7 C[C@H](O)C1=CSC=N1 AT14859 [0,0,0,0,1,0|2,1,0]=4 210 B8R1.7 C[C@H](O)C1=NC=CN1 AT15608 [0,0,0,0,1,0|2,1,0]=4 211 B8R1.7 C[C@H](O)C1=NC=CS1 AT14682 [0,0,0,0,1,0|2,1,0]=4 212 B8R1.7 C[C@H](O)C1=NC=CS1 AT14685 [0,0,0,0,1,0|2,1,0]=4 213 B8R1.7 C[C@H](O)C1=NNC=C1 AT15830 [0,0,0,0,1,0|2,1,0]=4 214 B8R1.7 C[C@H](O)C1=NNC=C1 AT15831 [0,0,0,0,1,0|2,1,0]=4 215 B8R1.7 C[C@H](O)C1=NNC=C1 AT15832 [0,0,0,0,1,0|2,1,0]=4 216 B10R1.18 CC(=O)[15NH]C1=CC=CC=C1 F21470 [0,0,0,0,0,1|0,1,1]=3 217 B10R1.18 CC(C)CC1=CC=NC=C1 AC2809 [0,0,0,0,0,1|2,0,0]=3 218 B10R1.18 C[C@H](N)CC1=CC=NC=C1 F11581 [0,0,0,0,0,1|2,0,0]=3 219 B10R1.18 C[C@H](N)CC1=NC=CC=C1 F13183 [0,0,0,0,0,1|2,0,0]=3 220 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71821 [0,0,0,0,0,1|0,1,0]=2 221 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71861 [0,0,0,0,0,1|0,1,0]=2 222 B10R1.18 C[S@](=O)CC1=CN=CC=C1 E72354 [0,0,0,0,0,1|2,1,0]=4 223 B10R1.18 N=C(N)CC1=CC=CC=C1 C15976 [0,0,0,0,0,1|2,0,1]=4 224 B10R1.18 OB(O)CC1=CC=CC=C1 32975 [0,0,0,0,0,1|2,1,0]=4 225 B10R1.18 [2H]C([2H])=CC1=CC=CC=C1 D99670 [0,0,0,0,0,1|2,0,1]=4 226 B7R0.1 C=CC\C=C\CCC T72633 [1,0,1,0,0,0|0,0,2]=4 227 B7R1.3 ClC1=CC=NC=C1 F17303 [2,0,0,0,0,0|2,0,0]=4 228 B7R1.3 FC1=CC=NC=C1 F19691 [2,0,0,0,0,0|2,0,0]=4 229 B7R1.3 F[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 40525 [2,0,0,0,0,0|1,0,0]=3 230 B7R1.3 SC1=NN=CC=C1 AT13031 [2,0,0,0,0,0|2,0,0]=4 231 B7R1.3 [15NH2]C1=CC=CC=C1 41405 [2,0,0,0,0,0|1,0,0]=3 232 B7R1.3 [2H]C1=CC=CC=C1 D98570 [2,0,0,0,0,0|1,0,0]=3 233 B7R1.3 [2H]C1=CC=NC=C1 D98795 [2,0,0,0,0,0|2,0,0]=4 234 B7R1.3 [2H]C1=NC=CC=C1 D98277 [2,0,0,0,0,0|2,0,0]=4 235 B9R1.1 CC1=NC=C(CBr)C=C1 F52459 [1,1,0,0,0,0|2,0,0]=4 236 B9R1.1 CC1=NC=C(CCl)C=C1 D87733 [1,1,0,0,0,0|2,0,0]=4 237 B9R1.1 CCN1C=CC(=S)C=C1 W16146 [1,1,0,0,0,0|1,0,0]=3 238 B9R1.1 CNC1=CC=C(N)C=C1 C78356 [1,1,0,0,0,0|1,0,0]=3 239 B9R1.1 CNC1=NC=C(N)C=C1 Y13586 [1,1,0,0,0,0|2,0,0]=4 240 B9R1.1 COC1=CN=C(I)C=C1 F17075 [1,1,0,0,0,0|2,0,0]=4 241 B9R1.1 CSC1=NC=C(N)C=C1 D73901 [1,1,0,0,0,0|2,0,0]=4 242 B9R1.1 C[Se]C1=CC=C(Br)C=C1 97865 [1,1,0,0,0,0|1,0,0]=3 243 B9R1.1 ClC1=CN=C(CBr)C=C1 S12201 [1,1,0,0,0,0|2,0,0]=4 244 B9R1.1 ClCC1=CN=C(Cl)C=C1 W18630 [1,1,0,0,0,0|2,0,0]=4 245 B9R1.1 FC1=CN=C(CCl)C=C1 P19178 [1,1,0,0,0,0|2,0,0]=4 246 B9R1.1 NC1=NC=C(CCl)C=C1 AT22351 [1,1,0,0,0,0|2,0,0]=4 247 B9R1.1 NCC1=CC=C(F)C=C1 N12249 [1,1,0,0,0,0|1,0,0]=3 248 B9R1.1 NCC1=CC=C(S)C=C1 AT20992 [1,1,0,0,0,0|1,0,0]=3 249 B9R1.1 NCC1=NC=C(F)C=C1 83593 [1,1,0,0,0,0|2,0,0]=4 250 B9R1.1 NCC1=NC=C(I)C=C1 C91084 [1,1,0,0,0,0|2,0,0]=4 251 B9R1.1 O=C1C=CC(=NCl)C=C1 T72753 [1,1,0,0,0,0|2,0,0]=4 252 B9R1.1 [2H]CC1=CC=C(F)C=C1 D98910 [1,1,0,0,0,0|1,0,0]=3 253 B9R1.2 CC1=CC(CBr)=CN=C1 43925 [1,1,0,0,0,0|2,0,0]=4 254 B9R1.2 CCC1=CC(Cl)=NN=C1 S11387 [1,1,0,0,0,0|2,0,0]=4 255 B9R1.2 CCC1=NC=CC(Cl)=N1 W12562 [1,1,0,0,0,0|2,0,0]=4 256 B9R1.2 CNC1=NC=CC(N)=C1 F12690 [1,1,0,0,0,0|2,0,0]=4 257 B9R1.2 COC1=CC(O)=NC=C1 F17762 [1,1,0,0,0,0|2,0,0]=4 258 B9R1.2 COC1=CN=CC(N)=C1 P11509 [1,1,0,0,0,0|2,0,0]=4 259 B9R1.2 CSC1=CC(Cl)=CN=C1 AT19857 [1,1,0,0,0,0|2,0,0]=4 260 B9R1.2 C\N=C1\C=C(C)C=CN1 W18359 [1,1,0,0,0,0|2,0,0]=4 261 B9R1.2 ClC1=NC=CC(CBr)=C1 C16429 [1,1,0,0,0,0|2,0,0]=4 262 B9R1.2 ClCC1=NC=CC(Cl)=C1 C13998 [1,1,0,0,0,0|2,0,0]=4 263 B9R1.2 FC1=CC(CCl)=CN=C1 O10881 [1,1,0,0,0,0|2,0,0]=4 264 B9R1.2 NCC1=CC(=O)NC=C1 37540 [1,1,0,0,0,0|2,0,0]=4 265 B9R1.2 NCC1=CC(Br)=CN=C1 F19818 [1,1,0,0,0,0|2,0,0]=4 266 B9R1.2 NCC1=CC(F)=NC=C1 W18404 [1,1,0,0,0,0|2,0,0]=4 267 B9R1.2 NCC1=CC(N)=NC=C1 AC6477 [1,1,0,0,0,0|2,0,0]=4 268 B9R1.2 NCC1=CC=CC(Cl)=N1 C72946 [1,1,0,0,0,0|2,0,0]=4 269 B9R1.2 NCC1=CC=CC(I)=C1 CK2420 [1,1,0,0,0,0|1,0,0]=3 270 B9R1.2 NCC1=CC=CC(O)=N1 F10425 [1,1,0,0,0,0|2,0,0]=4 271 B9R1.2 NCC1=NC=CC(Br)=C1 26892 [1,1,0,0,0,0|2,0,0]=4 272 B9R1.2 NCC1=NC=CC(F)=C1 C71953 [1,1,0,0,0,0|2,0,0]=4 273 B9R1.2 NCC1=NC=CC(N)=C1 77886 [1,1,0,0,0,0|2,0,0]=4 274 B9R1.2 [2H]CC1=CC=CC(F)=C1 D99661 [1,1,0,0,0,0|1,0,0]=3 275 B9R1.2 [O-][N+]1=CC=CC(CCl)=C1 96310 [1,1,0,0,0,0|2,0,0]=4 276 B9R1.8 BrCCC1=CN=CC=C1 C77647 [1,1,0,0,0,0|1,0,0]=3 277 B9R1.8 C#C[I+]C1=CC=CC=C1 T71678 [1,1,0,0,0,0|0,0,2]=4 278 B9R1.8 CCCC1=CC=CN=C1 O11051 [1,1,0,0,0,0|1,0,0]=3 279 B9R1.8 CCC[N+]1=CC=CC=C1 T72121 [1,1,0,0,0,0|1,0,0]=3 280 B9R1.8 CCNC1=NC=CN=C1 C76036 [1,1,0,0,0,0|2,0,0]=4 281 B9R1.8 CNCC1=CN=CN=C1 38577 [1,1,0,0,0,0|2,0,0]=4 282 B9R1.8 CNCC1=NC=CC=N1 27199 [1,1,0,0,0,0|2,0,0]=4 283 B9R1.8 CNCC1=NC=CC=N1 72796 [1,1,0,0,0,0|2,0,0]=4 284 B9R1.8 CNCC1=NC=NC=C1 C14477 [1,1,0,0,0,0|2,0,0]=4 285 B9R1.8 CNNC1=CC=CC=C1 C77159 [1,1,0,0,0,0|1,0,0]=3 286 B9R1.8 FCCC1=CC=CC=C1 75534 [1,1,0,0,0,0|0,0,0]=2 287 B9R1.8 IC#CC1=CC=CC=C1 N11813 [1,1,0,0,0,0|0,0,2]=4 288 B9R1.8 NCCC1=CC=CC=C1 T71816 [1,1,0,0,0,0|0,0,0]=2 289 B9R1.8 NCCC1=CC=CC=C1 T72591 [1,1,0,0,0,0|0,0,0]=2 290 B9R1.8 NCCC1=NC=CC=N1 83201 [1,1,0,0,0,0|2,0,0]=4 291 B9R1.8 NCCC1=NC=CC=N1 P10852 [1,1,0,0,0,0|2,0,0]=4 292 B9R1.8 NCCC1=NC=CN=C1 AT22557 [1,1,0,0,0,0|2,0,0]=4 293 B9R1.8 NCCC1=NC=NC=C1 P10950 [1,1,0,0,0,0|2,0,0]=4 294 B9R1.8 NNCC1=NC=CC=C1 P10521 [1,1,0,0,0,0|2,0,0]=4 295 B9R1.8 OCCC1=CC=NC=C1 T72404 [1,1,0,0,0,0|1,0,0]=3 296 B9R1.8 OCCC1=NN=CC=C1 D77083 [1,1,0,0,0,0|2,0,0]=4 297 B9R1.8 SCCC1=NC=CC=C1 F18309 [1,1,0,0,0,0|1,0,0]=3 298 B9R1.8 [C-]#[N+]CC1=CC=NC=C1 AC8779 [1,1,0,0,0,0|1,0,1]=4 299 B9R1.8 [C-]#[N+]CC1=CN=CC=C1 F16136 [1,1,0,0,0,0|1,0,1]=4 300 B9R1.15 C=CC1=C(C)C=CC=C1 T72704 [1,1,0,0,0,0|0,0,2]=4 301 B9R1.15 CC1=C(CBr)C=CC=N1 FD9046 [1,1,0,0,0,0|2,0,0]=4 302 B9R1.15 CC1=C(CBr)C=CC=N1 P11218 [1,1,0,0,0,0|2,0,0]=4 303 B9R1.15 CC1=C(CCl)C=CC=N1 P10970 [1,1,0,0,0,0|2,0,0]=4 304 B9R1.15 CC1=C(CCl)C=NC=C1 P10971 [1,1,0,0,0,0|2,0,0]=4 305 B9R1.15 CC1=CC=CN=C1CBr D97530 [1,1,0,0,0,0|2,0,0]=4 306 B9R1.15 CCC1=C(Br)C=CN=C1 H11182 [1,1,0,0,0,0|1,0,0]=3 307 B9R1.15 CCC1=C(N)N=NC=C1 S11451 [1,1,0,0,0,0|2,0,0]=4 308 B9R1.15 CCC1=CC=CN=C1C 75814 [1,1,0,0,0,0|1,0,0]=3 309 B9R1.15 CCC1=CN=CN=C1O C15413 [1,1,0,0,0,0|2,0,0]=4 310 B9R1.15 COC1=C(Br)C=CN=C1 F10479 [1,1,0,0,0,0|2,0,0]=4 311 B9R1.15 COC1=C(C)C=NC=C1 D74380 [1,1,0,0,0,0|2,0,0]=4 312 B9R1.15 ClC1=CC=CN=C1CBr 79180 [1,1,0,0,0,0|2,0,0]=4 313 B9R1.15 ClC1=CC=CN=C1CBr 86640 [1,1,0,0,0,0|2,0,0]=4 314 B9R1.15 ClCC1=CC=CN=C1Br 55187 [1,1,0,0,0,0|2,0,0]=4 315 B9R1.15 FC1=C(CBr)C=CC=N1 AT20654 [1,1,0,0,0,0|2,0,0]=4 316 B9R1.15 N#CC1=C(S)C=CC=C1 AT20892 [1,1,0,0,0,0|1,0,1]=4 317 B9R1.15 NC1=C(CCl)C=CC=N1 89794 [1,1,0,0,0,0|2,0,0]=4 318 B9R1.15 NCC1=C(Br)C=NC=C1 98160 [1,1,0,0,0,0|2,0,0]=4 319 B9R1.15 NCC1=C(Cl)C=CN=C1 C11073 [1,1,0,0,0,0|2,0,0]=4 320 B9R1.15 NCC1=C(F)C=CN=C1 C90218 [1,1,0,0,0,0|2,0,0]=4 321 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [1,1,0,0,0,0|1,0,0]=3 322 B9R1.15 NCC1=C(O)C=CC=N1 C73700 [1,1,0,0,0,0|2,0,0]=4 323 B9R1.15 NCC1=C(O)C=CN=C1 AT18117 [1,1,0,0,0,0|2,0,0]=4 324 B9R1.15 NCC1=CC=CN=C1Cl 37571 [1,1,0,0,0,0|2,0,0]=4 325 B9R1.15 NCC1=CC=CN=C1N CL0345 [1,1,0,0,0,0|2,0,0]=4 326 B9R1.15 NCC1=[N+]([O-])C=CC=C1 D86206 [1,1,0,0,0,0|2,0,0]=4 327 B9R1.15 OCC1=C(F)C=CN=C1 P11878 [1,1,0,0,0,0|1,1,0]=4 328 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [1,1,0,0,0,0|1,0,0]=3 329 B9R1.15 [C-]#[N+]C1=C(Cl)C=CC=C1 AC9402 [1,1,0,0,0,0|1,0,1]=4 330 B9R1.11 CC[C@H](N)C1=COC=C1 N16720 [0,1,0,0,1,0|2,0,0]=4 331 B9R1.11 CC[C@H](N)C1=COC=C1 N16721 [0,1,0,0,1,0|2,0,0]=4 332 B9R1.11 CC[C@H](N)C1=COC=C1 N16722 [0,1,0,0,1,0|2,0,0]=4 333 B9R1.11 N[C@@H](CO)C1=CC=CO1 C78116 [0,1,0,0,1,0|2,0,0]=4 334 B9R1.11 N[C@@H](CO)C1=COC=C1 N16732 [0,1,0,0,1,0|2,0,0]=4 335 B9R1.11 N[C@@H](CO)C1=CSC=C1 N13030 [0,1,0,0,1,0|2,0,0]=4 336 B9R1.19 CC(C)(C)C1=CNC=C1 F53439 [0,1,0,0,1,0|2,0,0]=4 337 B9R1.35 CC1=CC=C([C@H](C)N)O1 N12562 [0,1,0,0,1,0|2,0,0]=4 338 B9R1.35 CC1=CC=C([C@H](C)N)O1 Y12182 [0,1,0,0,1,0|2,0,0]=4 339 B9R1.35 C[C@H](Cl)C1=CC=C(Cl)O1 55261 [0,1,0,0,1,0|2,0,0]=4 340 B9R1.35 C[C@H](N)C1=CC=C(Br)O1 Y12846 [0,1,0,0,1,0|2,0,0]=4 341 B9R1.35 C[C@H](N)C1=CC=C(Cl)S1 30561 [0,1,0,0,1,0|2,0,0]=4 342 B9R1.35 C[C@H](N)C1=CSC(Cl)=C1 P13206 [0,1,0,0,1,0|2,0,0]=4 343 B9R1.35 C[C@H](O)C1=CC(Br)=CS1 39106 [0,1,0,0,1,0|1,1,0]=4 344 B9R1.35 C[C@H](O)C1=CC(Br)=CS1 P19372 [0,1,0,0,1,0|1,1,0]=4 345 B9R1.35 C[C@H](O)C1=CC=C(Cl)O1 55260 [0,1,0,0,1,0|1,1,0]=4 346 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N14354 [0,1,0,0,0,1|1,0,0]=3 347 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y11268 [0,1,0,0,0,1|1,0,0]=3 348 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N10873 [0,1,0,0,0,1|1,0,0]=3 349 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 85180 [0,1,0,0,0,1|1,0,0]=3 350 B11R1.20 FC(F)SC1=CC=C(Br)C=C1 AT20957 [0,1,0,0,0,1|2,0,0]=4 351 B11R1.20 FC1=CC=C(OC(F)F)C=C1 F17627 [0,1,0,0,0,1|2,0,0]=4 352 B11R1.20 NC1=CC=C(SC(F)F)C=C1 AT20968 [0,1,0,0,0,1|2,0,0]=4 353 B11R1.20 NC1=CC=C(SC(F)F)C=C1 AT20978 [0,1,0,0,0,1|2,0,0]=4 354 B11R1.36 C=C(C1=CC=CC=C1)C(C)C W11468 [0,1,0,0,0,1|1,0,0]=3 355 B11R1.36 CC(=O)N(Cl)C1=CC=CC=C1 T71089 [0,1,0,0,0,1|0,1,1]=4 356 B11R1.36 CC(=O)[C@H](N)C1=CC=CC=C1 N15518 [0,1,0,0,0,1|0,1,1]=4 357 B11R1.36 CC(C)C(=O)C1=CC=NC=C1 N12821 [0,1,0,0,0,1|2,0,0]=4 358 B11R1.36 CC(C)[C@H](N)C1=CC=CN=C1 74043 [0,1,0,0,0,1|2,0,0]=4 359 B11R1.36 CC(C)[C@H](N)C1=NC=CC=C1 Y10672 [0,1,0,0,0,1|2,0,0]=4 360 B11R1.36 CC(C)[C@H](O)C1=CN=CC=C1 AC2743 [0,1,0,0,0,1|2,0,0]=4 361 B11R1.36 CC(O)C(N)C1=CC=CC=C1 N11175 [0,1,0,0,0,1|0,1,0]=3 362 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Y13368 [0,1,0,0,0,1|0,1,0]=3 363 B11R1.36 CC(O)[C@H](N)C1=CC=CC=C1 N15517 [0,1,0,0,0,1|0,1,0]=3 364 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N15522 [0,1,0,0,0,1|0,1,0]=3 365 B11R1.36 C[C@H](N)C(=O)C1=CC=CC=C1 F13376 [0,1,0,0,0,1|1,0,0]=3 366 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 N15519 [0,1,0,0,0,1|0,1,0]=3 367 B11R1.36 N[C@H](C1=CC=CC=C1)C(F)F 94363 [0,1,0,0,0,1|2,0,0]=4 368 B11R1.36 O[C@H](C1=CC=CC=C1)C(F)F AT21493 [0,1,0,0,0,1|2,0,0]=4 369 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 74053 [0,1,0,0,0,1|1,0,0]=3 370 B11R1.40 CNC(=S)NC1=CC=CC=C1 T72207 [0,1,0,0,0,1|0,0,2]=4 371 B11R1.40 C[C@H](C=O)CC1=CC=CC=C1 F16111 [0,1,0,0,0,1|0,1,0]=3 372 B11R1.40 N#C[C@@H](F)SC1=CC=CC=C1 D90673 [0,1,0,0,0,1|1,0,1]=4 373 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14383 [0,1,0,0,0,1|1,0,0]=3 374 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14384 [0,1,0,0,0,1|1,0,0]=3 375 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14385 [0,1,0,0,0,1|1,0,0]=3 376 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 C78372 [0,1,0,0,0,1|1,0,0]=3 377 B11R1.86 CC(=O)OC1=C(Br)C=CC=C1 F13222 [0,1,0,0,0,1|0,1,1]=4 378 B11R1.86 CC(=S)NC1=C(Br)C=CC=C1 81280 [0,1,0,0,0,1|0,0,2]=4 379 B11R1.86 CC(C)NC1=C(Br)C=CC=C1 C77931 [0,1,0,0,0,1|1,0,0]=3 380 B11R1.86 CC(C)NC1=C(Cl)C=CC=C1 C78464 [0,1,0,0,0,1|1,0,0]=3 381 B11R1.86 CC(C)NC1=C(F)C=CC=C1 C77765 [0,1,0,0,0,1|1,0,0]=3 382 B11R1.86 CC(C)NC1=C(S)C=CC=C1 AC8476 [0,1,0,0,0,1|1,0,0]=3 383 B11R1.86 CC(C)OC1=C(I)C=CC=N1 76901 [0,1,0,0,0,1|2,0,0]=4 384 B11R1.86 CC(C)OC1=C(N)C=CN=C1 AT18128 [0,1,0,0,0,1|2,0,0]=4 385 B11R1.86 CC1=C(C[C@H](C)N)C=CC=C1 N10867 [0,1,0,0,0,1|1,0,0]=3 386 B11R1.86 C[C@H](N)CC1=C(Br)C=CC=C1 N11144 [0,1,0,0,0,1|1,0,0]=3 387 B11R1.86 C[C@H](N)CC1=C(Cl)C=CC=C1 N11063 [0,1,0,0,0,1|1,0,0]=3 388 B11R1.86 C[C@H](O)CC1=C(Br)C=NC=C1 AT12941 [0,1,0,0,0,1|1,1,0]=4 389 B11R1.86 FC(F)OC1=C(Cl)C=CC=C1 F19093 [0,1,0,0,0,1|2,0,0]=4 390 B11R1.86 FC1=C(OC(F)F)C=CC=C1 F18842 [0,1,0,0,0,1|2,0,0]=4 391 B11R1.157 CC(=O)CC1=CC(C)=CC=C1 N12785 [0,1,0,0,0,1|0,1,1]=4 392 B11R1.157 CC(C)CC1=CC=CC(N)=C1 O11024 [0,1,0,0,0,1|1,0,0]=3 393 B11R1.157 CC(C)NC1=CC=CC(Br)=C1 C77831 [0,1,0,0,0,1|1,0,0]=3 394 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 C78133 [0,1,0,0,0,1|1,0,0]=3 395 B11R1.157 CC(C)NC1=NC=CC(N)=C1 F19784 [0,1,0,0,0,1|2,0,0]=4 396 B11R1.157 CC(C)OC1=CC(Br)=CN=C1 F19749 [0,1,0,0,0,1|2,0,0]=4 397 B11R1.157 CC(C)OC1=NC=CC(N)=C1 AT18134 [0,1,0,0,0,1|2,0,0]=4 398 B11R1.157 CC1=CC=CC(C[C@H](C)N)=C1 N11054 [0,1,0,0,0,1|1,0,0]=3 399 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 E72139 [0,1,0,0,0,1|1,0,0]=3 400 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 83690 [0,1,0,0,0,1|1,0,0]=3 401 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 N11066 [0,1,0,0,0,1|1,0,0]=3 402 B11R1.157 C[C@H](N)CC1=CC=CC(F)=C1 N10878 [0,1,0,0,0,1|1,0,0]=3 403 B11R1.157 C[S@](=O)CC1=CC(N)=CC=C1 AT15220 [0,1,0,0,0,1|1,1,0]=4 404 B11R1.157 FC(F)OC1=CC=CC(Cl)=C1 F19087 [0,1,0,0,0,1|2,0,0]=4 405 B11R1.509 CC(C)(Cl)CC1=CC=CC=C1 AC4724 [0,1,0,0,0,1|1,0,0]=3 406 B11R1.509 C[Si](C)(C)SC1=CC=CC=C1 D76934 [0,1,0,0,0,1|1,1,0]=4 407 B11R1.509 [2H]C([2H])([2H])CC1=CC=CC=C1 D99355 [0,1,0,0,0,1|2,0,0]=4 408 B11R1.509 [2H]C([2H])([2H])OC1=CC=CC=C1 D99695 [0,1,0,0,0,1|2,0,0]=4 409 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 D87575 [0,2,0,0,0,0|0,1,1]=4 410 B11R1.3 CC(C)C1=CC=C(CS)C=C1 AT13687 [0,2,0,0,0,0|1,0,0]=3 411 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 N12206 [0,2,0,0,0,0|1,0,0]=3 412 B11R1.3 COC1=CN=C([C@H](C)N)C=C1 90819 [0,2,0,0,0,0|2,0,0]=4 413 B11R1.3 COC1=CN=C([C@H](C)N)C=C1 90820 [0,2,0,0,0,0|2,0,0]=4 414 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 90831 [0,2,0,0,0,0|2,0,0]=4 415 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 N11219 [0,2,0,0,0,0|2,0,0]=4 416 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 D76956 [0,2,0,0,0,0|1,0,0]=3 417 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 N10959 [0,2,0,0,0,0|1,0,0]=3 418 B11R1.3 CSC1=CC=C([C@H](C)O)C=C1 AT20981 [0,2,0,0,0,0|0,1,0]=3 419 B11R1.3 CSC1=CC=C([C@H](C)O)C=C1 AT20982 [0,2,0,0,0,0|0,1,0]=3 420 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 F16855 [0,2,0,0,0,0|1,0,0]=3 421 B11R1.3 C[C@H](N)C1=CC=C(CCl)C=C1 96061 [0,2,0,0,0,0|1,0,0]=3 422 B11R1.3 C[C@H](O)C1=CC=C(C#N)C=C1 C13987 [0,2,0,0,0,0|0,1,0]=3 423 B11R1.3 O=CC1=CC=C(C(F)F)C=C1 C91393 [0,2,0,0,0,0|2,0,0]=4 424 B11R1.3 OCC1=CC=C(C(F)F)C=C1 AT10625 [0,2,0,0,0,0|2,0,0]=4 425 B11R1.19 CC(C)(C)C1=CN=C(O)C=C1 F13765 [0,2,0,0,0,0|2,0,0]=4 426 B11R1.19 CC(C)(F)C1=NC=C(Br)C=C1 AC2038 [0,2,0,0,0,0|2,0,0]=4 427 B11R1.19 CC(C)(N)C1=CC=C(Cl)C=C1 98110 [0,2,0,0,0,0|1,0,0]=3 428 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 N10815 [0,2,0,0,0,0|1,0,0]=3 429 B11R1.19 CC(C)(N)C1=CN=C(Cl)C=C1 91211 [0,2,0,0,0,0|2,0,0]=4 430 B11R1.19 CC(C)(O)C1=CN=C(Br)C=C1 AB10226 [0,2,0,0,0,0|1,1,0]=4 431 B11R1.19 CC(C)(O)C1=CN=C(Cl)C=C1 AT10277 [0,2,0,0,0,0|1,1,0]=4 432 B11R1.19 CC(C)(O)C1=CN=C(F)C=C1 88188 [0,2,0,0,0,0|1,1,0]=4 433 B11R1.19 CC(F)(F)C1=NC=C(Br)C=C1 AC3426 [0,2,0,0,0,0|2,0,0]=4 434 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 F13271 [0,2,0,0,0,0|1,0,0]=3 435 B11R1.19 CP(C)(=O)C1=CC=C(F)C=C1 AT21937 [0,2,0,0,0,0|1,1,0]=4 436 B11R1.19 CP(C)(=O)C1=CC=C(N)C=C1 D77062 [0,2,0,0,0,0|1,1,0]=4 437 B11R1.19 C[S@](=N)(=O)C1=CC=C(Br)C=C1 W13286 [0,2,0,0,0,0|1,1,0]=4 438 B11R1.19 C[S@](=N)(=O)C1=CC=C(Cl)C=C1 AT11346 [0,2,0,0,0,0|1,1,0]=4 439 B11R1.19 C[S@](=N)(=O)C1=CC=C(F)C=C1 W16235 [0,2,0,0,0,0|1,1,0]=4 440 B11R1.19 C[Si](C)(C)C1=CC=C(N)C=C1 D71910 [0,2,0,0,0,0|1,1,0]=4 441 B11R1.19 C[Si](C)(C)C1=CC=C(O)C=C1 D76703 [0,2,0,0,0,0|1,1,0]=4 442 B11R1.19 [2H]C([2H])(Cl)C1=CC=C(F)C=C1 D98641 [0,2,0,0,0,0|2,0,0]=4 443 B11R1.19 [2H]C([2H])([2H])C1=CC=C(Br)C=C1 41381 [0,2,0,0,0,0|2,0,0]=4 444 B11R1.19 [2H]C([2H])([2H])C1=CC=C(F)C=C1 D99459 [0,2,0,0,0,0|2,0,0]=4 445 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 69909 [0,2,0,0,0,0|0,1,1]=4 446 B11R1.21 CC(C)C1=CC(Br)=C(I)C=C1 H11162 [0,2,0,0,0,0|1,0,0]=3 447 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=N1 N14943 [0,2,0,0,0,0|2,0,0]=4 448 B11R1.21 CC1=C(Br)C=NC([C@H](C)N)=C1 D79973 [0,2,0,0,0,0|2,0,0]=4 449 B11R1.21 CC1=C(Br)C=NC([C@H](C)O)=C1 D79321 [0,2,0,0,0,0|1,1,0]=4 450 B11R1.21 CC1=C(Br)C=NC([C@H](C)O)=C1 D79322 [0,2,0,0,0,0|1,1,0]=4 451 B11R1.21 CC1=C(C)C=C([C@H](C)O)C=C1 44393 [0,2,0,0,0,0|0,1,0]=3 452 B11R1.21 CC1=C(N)C=C([C@H](C)N)C=C1 Y11249 [0,2,0,0,0,0|1,0,0]=3 453 B11R1.21 CC1=C(O)C=C([C@H](C)N)C=C1 N14772 [0,2,0,0,0,0|1,0,0]=3 454 B11R1.21 CC1=C(O)C=CC([C@H](C)N)=C1 N14776 [0,2,0,0,0,0|1,0,0]=3 455 B11R1.21 CN(C)C1=CC(N)=C(N)C=C1 F53085 [0,2,0,0,0,0|2,0,0]=4 456 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 Y11087 [0,2,0,0,0,0|1,0,0]=3 457 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 Y11614 [0,2,0,0,0,0|1,0,0]=3 458 B11R1.21 C[C@H](N)C1=CC(O)=C(F)C=C1 N14349 [0,2,0,0,0,0|1,0,0]=3 459 B11R1.21 C[C@H](N)C1=CC(O)=C(F)C=C1 N14734 [0,2,0,0,0,0|1,0,0]=3 460 B11R1.21 C[C@H](O)C1=CC(F)=C(F)C=C1 AT11379 [0,2,0,0,0,0|0,1,0]=3 461 B11R1.21 C[C@H](O)C1=CC(F)=C(F)C=C1 AT11380 [0,2,0,0,0,0|0,1,0]=3 462 B11R1.21 FC(F)C1=CC(I)=C(Br)C=C1 AT23716 [0,2,0,0,0,0|2,0,0]=4 463 B11R1.22 C#C[C@@H](O)C1=CC=C(Br)C=C1 AC6934 [0,2,0,0,0,0|0,1,1]=4 464 B11R1.22 C#C[C@@H](O)C1=CC=C(C)C=C1 AC6704 [0,2,0,0,0,0|0,1,1]=4 465 B11R1.22 C#C[C@@H](O)C1=CC=C(Cl)C=C1 AC5833 [0,2,0,0,0,0|0,1,1]=4 466 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 N15257 [0,2,0,0,0,0|1,0,1]=4 467 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 N15258 [0,2,0,0,0,0|1,0,1]=4 468 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15265 [0,2,0,0,0,0|1,0,1]=4 469 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15266 [0,2,0,0,0,0|1,0,1]=4 470 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15267 [0,2,0,0,0,0|1,0,1]=4 471 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 E72771 [0,2,0,0,0,0|1,0,1]=4 472 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15246 [0,2,0,0,0,0|1,0,1]=4 473 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15247 [0,2,0,0,0,0|1,0,1]=4 474 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15248 [0,2,0,0,0,0|1,0,1]=4 475 B11R1.22 C=C[C@H](N)C1=CC=C(F)C=C1 N15237 [0,2,0,0,0,0|1,0,1]=4 476 B11R1.22 C=C[C@H](N)C1=CC=C(F)C=C1 N15238 [0,2,0,0,0,0|1,0,1]=4 477 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15298 [0,2,0,0,0,0|1,0,1]=4 478 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15299 [0,2,0,0,0,0|1,0,1]=4 479 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15300 [0,2,0,0,0,0|1,0,1]=4 480 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 C75563 [0,2,0,0,0,0|0,1,1]=4 481 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 AC6089 [0,2,0,0,0,0|0,1,1]=4 482 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13432 [0,2,0,0,0,0|1,0,0]=3 483 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13433 [0,2,0,0,0,0|1,0,0]=3 484 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13434 [0,2,0,0,0,0|1,0,0]=3 485 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13455 [0,2,0,0,0,0|1,0,0]=3 486 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13456 [0,2,0,0,0,0|1,0,0]=3 487 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13457 [0,2,0,0,0,0|1,0,0]=3 488 B11R1.22 CC1=CC=C([C@@H](O)CN)C=C1 C78285 [0,2,0,0,0,0|0,1,0]=3 489 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 N11154 [0,2,0,0,0,0|2,0,0]=4 490 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 N11155 [0,2,0,0,0,0|2,0,0]=4 491 B11R1.22 CC[C@H](C)C1=CC=C(Br)C=C1 O10385 [0,2,0,0,0,0|1,0,0]=3 492 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 N12295 [0,2,0,0,0,0|1,0,0]=3 493 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11091 [0,2,0,0,0,0|1,0,0]=3 494 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11092 [0,2,0,0,0,0|1,0,0]=3 495 B11R1.22 COC(=N)C1=CC=C(Br)C=C1 AC7283 [0,2,0,0,0,0|1,0,1]=4 496 B11R1.22 CO[C@@H](C)C1=CC=C(Br)C=C1 N11516 [0,2,0,0,0,0|0,1,0]=3 497 B11R1.22 CO[S@@](=O)C1=CC=C(C)C=C1 D92807 [0,2,0,0,0,0|1,1,0]=4 498 B11R1.22 C[C@@H](CN)C1=CC=C(Cl)C=C1 F20636 [0,2,0,0,0,0|1,0,0]=3 499 B11R1.22 C[C@@H](CN)C1=CC=C(O)C=C1 70995 [0,2,0,0,0,0|1,0,0]=3 500 B11R1.22 C[C@H](C#N)C1=CC=C(F)C=C1 AT19993 [0,2,0,0,0,0|1,0,0]=3 501 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 24831 [0,2,0,0,0,0|0,1,1]=4 502 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 F14651 [0,2,0,0,0,0|0,1,1]=4 503 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13423 [0,2,0,0,0,0|1,0,0]=3 504 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13424 [0,2,0,0,0,0|1,0,0]=3 505 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13425 [0,2,0,0,0,0|1,0,0]=3 506 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13446 [0,2,0,0,0,0|1,0,0]=3 507 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13447 [0,2,0,0,0,0|1,0,0]=3 508 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13448 [0,2,0,0,0,0|1,0,0]=3 509 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N12560 [0,2,0,0,0,0|1,0,0]=3 510 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13414 [0,2,0,0,0,0|1,0,0]=3 511 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13415 [0,2,0,0,0,0|1,0,0]=3 512 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13416 [0,2,0,0,0,0|1,0,0]=3 513 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13438 [0,2,0,0,0,0|1,0,0]=3 514 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13439 [0,2,0,0,0,0|1,0,0]=3 515 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13400 [0,2,0,0,0,0|1,0,0]=3 516 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13401 [0,2,0,0,0,0|1,0,0]=3 517 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13402 [0,2,0,0,0,0|1,0,0]=3 518 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13406 [0,2,0,0,0,0|1,0,0]=3 519 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13407 [0,2,0,0,0,0|1,0,0]=3 520 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13408 [0,2,0,0,0,0|1,0,0]=3 521 B11R1.22 NC[C@H](N)C1=CN=C(Br)C=C1 N14910 [0,2,0,0,0,0|2,0,0]=4 522 B11R1.22 NC[C@H](N)C1=NC=C(Br)C=C1 N14909 [0,2,0,0,0,0|2,0,0]=4 523 B11R1.22 NC[C@H](O)C1=CC=C(Br)C=C1 58433 [0,2,0,0,0,0|0,1,0]=3 524 B11R1.22 NC[C@H](O)C1=CC=C(F)C=C1 C78230 [0,2,0,0,0,0|0,1,0]=3 525 B11R1.22 N[C@@H](CF)C1=CC=C(Br)C=C1 N14615 [0,2,0,0,0,0|1,0,0]=3 526 B11R1.22 N[C@@H](CF)C1=CC=C(F)C=C1 N14614 [0,2,0,0,0,0|1,0,0]=3 527 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N11131 [0,2,0,0,0,0|1,0,0]=3 528 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 F16864 [0,2,0,0,0,0|1,0,0]=3 529 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 F16884 [0,2,0,0,0,0|1,0,0]=3 530 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 N10530 [0,2,0,0,0,0|1,0,0]=3 531 B11R1.22 N[C@@H](CO)C1=CN=C(Br)C=C1 N11111 [0,2,0,0,0,0|2,0,0]=4 532 B11R1.22 N[C@@H](CO)C1=NC=C(Br)C=C1 Y11193 [0,2,0,0,0,0|2,0,0]=4 533 B11R1.22 O=C(CF)C1=CC=C(Br)C=C1 W17424 [0,2,0,0,0,0|0,1,1]=4 534 B11R1.22 O=C(CO)C1=CC=C(O)C=C1 D87702 [0,2,0,0,0,0|0,1,1]=4 535 B11R1.22 O=C([13CH2]Br)C1=CC=C(Br)C=C1 D97990 [0,2,0,0,0,0|0,1,1]=4 536 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 FD1217 [0,2,0,0,0,0|0,1,0]=3 537 B11R1.22 O[C@@H](CCl)C1=CC=C(Br)C=C1 58431 [0,2,0,0,0,0|0,1,0]=3 538 B11R1.166 CC(=O)C1=C(Cl)C=C(C)C=C1 AT15339 [0,2,0,0,0,0|0,1,1]=4 539 B11R1.166 CC(=O)C1=C(O)C=C(I)C=C1 62926 [0,2,0,0,0,0|0,1,1]=4 540 B11R1.166 CC(C)C1=C(Br)C=C(Cl)C=C1 F21471 [0,2,0,0,0,0|1,0,0]=3 541 B11R1.166 CC(C)C1=C(F)C=C(Br)C=C1 F52298 [0,2,0,0,0,0|1,0,0]=3 542 B11R1.166 CC1=CC(Br)=C(C(C)C)C=C1 AT26576 [0,2,0,0,0,0|1,0,0]=3 543 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14911 [0,2,0,0,0,0|2,0,0]=4 544 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14912 [0,2,0,0,0,0|2,0,0]=4 545 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14913 [0,2,0,0,0,0|2,0,0]=4 546 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 N12239 [0,2,0,0,0,0|1,0,0]=3 547 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81539 [0,2,0,0,0,0|1,0,0]=3 548 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81617 [0,2,0,0,0,0|1,0,0]=3 549 B11R1.166 CC1=CC(F)=C([C@H](C)O)C=C1 AT15336 [0,2,0,0,0,0|0,1,0]=3 550 B11R1.166 CC1=CC=C(C(C)C)C(N)=N1 AT11138 [0,2,0,0,0,0|2,0,0]=4 551 B11R1.166 C[C@H](Br)C1=C(F)C=C(F)C=C1 C77556 [0,2,0,0,0,0|1,0,0]=3 552 B11R1.166 C[C@H](Cl)C1=NC=C(Cl)C=C1F P14811 [0,2,0,0,0,0|2,0,0]=4 553 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=N1 N14923 [0,2,0,0,0,0|2,0,0]=4 554 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=N1 N14924 [0,2,0,0,0,0|2,0,0]=4 555 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 N12749 [0,2,0,0,0,0|1,0,0]=3 556 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 N13113 [0,2,0,0,0,0|1,0,0]=3 557 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 F16902 [0,2,0,0,0,0|1,0,0]=3 558 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14393 [0,2,0,0,0,0|2,0,0]=4 559 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14394 [0,2,0,0,0,0|2,0,0]=4 560 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14395 [0,2,0,0,0,0|2,0,0]=4 561 B11R1.166 C[C@H](N)C1=NC=C(Cl)C=C1F 79549 [0,2,0,0,0,0|2,0,0]=4 562 B11R1.166 C[C@H](O)C1=C(F)C=C(F)C=C1 AT11374 [0,2,0,0,0,0|0,1,0]=3 563 B11R1.166 C[C@H](O)C1=C(F)C=C(F)C=C1 AT11378 [0,2,0,0,0,0|0,1,0]=3 564 B11R1.166 C[C@H](O)C1=CC=C(Cl)N=C1Cl D75887 [0,2,0,0,0,0|1,1,0]=4 565 B11R1.166 C[C@H](O)C1=NC=C(Br)C=C1F S10055 [0,2,0,0,0,0|1,1,0]=4 566 B11R1.166 FC(F)C1=C(Br)C=C(I)C=C1 E70168 [0,2,0,0,0,0|2,0,0]=4 567 B11R1.166 OC1=C(C(F)F)C=CC(F)=C1 79331 [0,2,0,0,0,0|2,0,0]=4 568 B11R1.7 CC(C)(C#N)C1=CC=NC=C1 AT18143 [0,2,0,0,0,0|2,0,0]=4 569 B11R1.7 CC(C)(C=O)C1=CC=CC=C1 AT22663 [0,2,0,0,0,0|0,1,0]=3 570 B11R1.7 CC(C)(CBr)C1=CC=CC=C1 D78707 [0,2,0,0,0,0|1,0,0]=3 571 B11R1.7 CC(C)(CN)C1=CC=NC=C1 AT18144 [0,2,0,0,0,0|2,0,0]=4 572 B11R1.7 C[C@@](N)(C#N)C1=CC=CC=C1 AC6143 [0,2,0,0,0,0|1,0,0]=3 573 B11R1.7 C[C@](N)(CO)C1=CC=CC=C1 N12768 [0,2,0,0,0,0|0,1,0]=3 574 B11R1.12 CCC(CC)C1=CC=CC=C1 T71625 [0,2,0,0,0,0|1,0,0]=3 575 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 N12976 [0,2,0,0,0,0|0,1,0]=3 576 B11R1.16 C#CC[C@H](O)C1=CC=CC=C1 W15219 [0,2,0,0,0,0|0,1,0]=3 577 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 N12265 [0,2,0,0,0,0|1,0,0]=3 578 B11R1.16 CN(CCBr)C1=CC=CC=C1 W15250 [0,2,0,0,0,0|2,0,0]=4 579 B11R1.16 CNC[C@H](C)C1=CC=CC=C1 C11240 [0,2,0,0,0,0|1,0,0]=3 580 B11R1.16 CNC[C@H](O)C1=CC=CC=C1 C11214 [0,2,0,0,0,0|0,1,0]=3 581 B11R1.16 COC[C@H](N)C1=CC=CC=C1 AC6537 [0,2,0,0,0,0|1,0,0]=3 582 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14729 [0,2,0,0,0,0|1,0,0]=3 583 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14730 [0,2,0,0,0,0|1,0,0]=3 584 B11R1.16 OCC[C@H](O)C1=CC=CC=C1 C80043 [0,2,0,0,0,0|0,1,0]=3 585 B11R1.23 C#C[C@@H](O)C1=CC(C)=CC=C1 AC5841 [0,2,0,0,0,0|0,1,1]=4 586 B11R1.23 C#C[C@@H](O)C1=CC=CC(Br)=C1 AC5836 [0,2,0,0,0,0|0,1,1]=4 587 B11R1.23 C#C[C@@H](O)C1=CC=CC(Cl)=C1 AC5834 [0,2,0,0,0,0|0,1,1]=4 588 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15262 [0,2,0,0,0,0|1,0,1]=4 589 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15263 [0,2,0,0,0,0|1,0,1]=4 590 B11R1.23 C=C[C@H](N)C1=CC(C)=CC=C1 N15264 [0,2,0,0,0,0|1,0,1]=4 591 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15252 [0,2,0,0,0,0|1,0,1]=4 592 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15253 [0,2,0,0,0,0|1,0,1]=4 593 B11R1.23 C=C[C@H](N)C1=CC=CC(Br)=C1 N15254 [0,2,0,0,0,0|1,0,1]=4 594 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15242 [0,2,0,0,0,0|1,0,1]=4 595 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15243 [0,2,0,0,0,0|1,0,1]=4 596 B11R1.23 C=C[C@H](N)C1=CC=CC(Cl)=C1 N15245 [0,2,0,0,0,0|1,0,1]=4 597 B11R1.23 C=C[C@H](N)C1=CC=CC(F)=C1 N15235 [0,2,0,0,0,0|1,0,1]=4 598 B11R1.23 C=C[C@H](N)C1=CC=CC(F)=C1 N15236 [0,2,0,0,0,0|1,0,1]=4 599 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15295 [0,2,0,0,0,0|1,0,1]=4 600 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15296 [0,2,0,0,0,0|1,0,1]=4 601 B11R1.23 C=C[C@H](N)C1=CC=CC(O)=C1 N15297 [0,2,0,0,0,0|1,0,1]=4 602 B11R1.23 CC1=CC=CC(C(=O)CO)=C1 AC3231 [0,2,0,0,0,0|0,1,1]=4 603 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13429 [0,2,0,0,0,0|1,0,0]=3 604 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13430 [0,2,0,0,0,0|1,0,0]=3 605 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13431 [0,2,0,0,0,0|1,0,0]=3 606 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13452 [0,2,0,0,0,0|1,0,0]=3 607 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13453 [0,2,0,0,0,0|1,0,0]=3 608 B11R1.23 CC1=CC=CC([C@@H](N)CN)=C1 N13454 [0,2,0,0,0,0|1,0,0]=3 609 B11R1.23 CC1=CC=CC([C@@H](O)CN)=C1 C78286 [0,2,0,0,0,0|0,1,0]=3 610 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 34175 [0,2,0,0,0,0|0,1,1]=4 611 B11R1.23 CC[C@H](O)C1=CC(C)=CC=C1 N14416 [0,2,0,0,0,0|0,1,0]=3 612 B11R1.23 CC[C@H](O)C1=CC=CC(Br)=C1 N12527 [0,2,0,0,0,0|0,1,0]=3 613 B11R1.23 CC[C@H](O)C1=CC=CC(Cl)=C1 N12311 [0,2,0,0,0,0|0,1,0]=3 614 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 N12243 [0,2,0,0,0,0|1,0,0]=3 615 B11R1.23 NCC(=O)C1=CC(O)=CC=C1 C77908 [0,2,0,0,0,0|0,1,1]=4 616 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13420 [0,2,0,0,0,0|1,0,0]=3 617 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13421 [0,2,0,0,0,0|1,0,0]=3 618 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13422 [0,2,0,0,0,0|1,0,0]=3 619 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13443 [0,2,0,0,0,0|1,0,0]=3 620 B11R1.23 NC[C@H](N)C1=CC=CC(Br)=C1 N13445 [0,2,0,0,0,0|1,0,0]=3 621 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13411 [0,2,0,0,0,0|1,0,0]=3 622 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13412 [0,2,0,0,0,0|1,0,0]=3 623 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13413 [0,2,0,0,0,0|1,0,0]=3 624 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13435 [0,2,0,0,0,0|1,0,0]=3 625 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13436 [0,2,0,0,0,0|1,0,0]=3 626 B11R1.23 NC[C@H](N)C1=CC=CC(Cl)=C1 N13437 [0,2,0,0,0,0|1,0,0]=3 627 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13396 [0,2,0,0,0,0|1,0,0]=3 628 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13397 [0,2,0,0,0,0|1,0,0]=3 629 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13398 [0,2,0,0,0,0|1,0,0]=3 630 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13399 [0,2,0,0,0,0|1,0,0]=3 631 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13404 [0,2,0,0,0,0|1,0,0]=3 632 B11R1.23 NC[C@H](N)C1=CC=CC(F)=C1 N13405 [0,2,0,0,0,0|1,0,0]=3 633 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 58439 [0,2,0,0,0,0|0,1,0]=3 634 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 71528 [0,2,0,0,0,0|0,1,0]=3 635 B11R1.23 NC[C@H](O)C1=CC=CC(Br)=C1 92116 [0,2,0,0,0,0|0,1,0]=3 636 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 58428 [0,2,0,0,0,0|0,1,0]=3 637 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 C78287 [0,2,0,0,0,0|0,1,0]=3 638 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 D77208 [0,2,0,0,0,0|0,1,0]=3 639 B11R1.23 N[C@@H](CF)C1=CC=CC(Br)=C1 N14613 [0,2,0,0,0,0|1,0,0]=3 640 B11R1.23 N[C@@H](CO)C1=CC(F)=CN=C1 N14406 [0,2,0,0,0,0|2,0,0]=4 641 B11R1.23 N[C@@H](CO)C1=CC(F)=CN=C1 N14407 [0,2,0,0,0,0|2,0,0]=4 642 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=N1 Y12117 [0,2,0,0,0,0|2,0,0]=4 643 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 N12818 [0,2,0,0,0,0|1,0,0]=3 644 B11R1.23 N[C@@H](CO)C1=NC=CC(Cl)=C1 N14937 [0,2,0,0,0,0|2,0,0]=4 645 B11R1.23 N[C@@H](CO)C1=NC=CC(Cl)=C1 N14938 [0,2,0,0,0,0|2,0,0]=4 646 B11R1.23 O=C(CO)C1=CC=CC(Br)=C1 AC6088 [0,2,0,0,0,0|0,1,1]=4 647 B11R1.23 O=C(CO)C1=CC=CC(F)=C1 AC5675 [0,2,0,0,0,0|0,1,1]=4 648 B11R1.23 O[C@@H](CCl)C1=CC=CC(Br)=C1 58437 [0,2,0,0,0,0|0,1,0]=3 649 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 58424 [0,2,0,0,0,0|0,1,0]=3 650 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 C72678 [0,2,0,0,0,0|0,1,0]=3 651 B11R1.222 C#C[C@@H](O)C1=C(Br)C=CC=C1 AC5641 [0,2,0,0,0,0|0,1,1]=4 652 B11R1.222 C#C[C@@H](O)C1=C(C)C=CC=C1 AC4137 [0,2,0,0,0,0|0,1,1]=4 653 B11R1.222 C#C[C@@H](O)C1=C(Cl)C=CC=C1 AC5063 [0,2,0,0,0,0|0,1,1]=4 654 B11R1.222 C#C[C@@H](O)C1=C(F)C=CC=C1 AC5690 [0,2,0,0,0,0|0,1,1]=4 655 B11R1.222 C#C[C@@H](O)C1=C(O)C=CC=C1 AC5065 [0,2,0,0,0,0|0,1,1]=4 656 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15249 [0,2,0,0,0,0|1,0,1]=4 657 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15250 [0,2,0,0,0,0|1,0,1]=4 658 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15251 [0,2,0,0,0,0|1,0,1]=4 659 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15259 [0,2,0,0,0,0|1,0,1]=4 660 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15260 [0,2,0,0,0,0|1,0,1]=4 661 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15261 [0,2,0,0,0,0|1,0,1]=4 662 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15239 [0,2,0,0,0,0|1,0,1]=4 663 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15240 [0,2,0,0,0,0|1,0,1]=4 664 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15241 [0,2,0,0,0,0|1,0,1]=4 665 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15232 [0,2,0,0,0,0|1,0,1]=4 666 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15233 [0,2,0,0,0,0|1,0,1]=4 667 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15234 [0,2,0,0,0,0|1,0,1]=4 668 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15292 [0,2,0,0,0,0|1,0,1]=4 669 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15293 [0,2,0,0,0,0|1,0,1]=4 670 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15294 [0,2,0,0,0,0|1,0,1]=4 671 B11R1.222 CC1=C(C(=O)CO)C=CC=C1 AC4310 [0,2,0,0,0,0|0,1,1]=4 672 B11R1.222 CC1=C([C@@H](N)CF)C=CC=C1 N14610 [0,2,0,0,0,0|1,0,0]=3 673 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13426 [0,2,0,0,0,0|1,0,0]=3 674 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13427 [0,2,0,0,0,0|1,0,0]=3 675 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13428 [0,2,0,0,0,0|1,0,0]=3 676 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13449 [0,2,0,0,0,0|1,0,0]=3 677 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13450 [0,2,0,0,0,0|1,0,0]=3 678 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13451 [0,2,0,0,0,0|1,0,0]=3 679 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N15069 [0,2,0,0,0,0|1,0,0]=3 680 B11R1.222 CC1=CC=CN=C1[C@@H](N)CN N14901 [0,2,0,0,0,0|2,0,0]=4 681 B11R1.222 CCC(=O)C1=C(Br)C=CC=C1 72058 [0,2,0,0,0,0|0,1,1]=4 682 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 35361 [0,2,0,0,0,0|1,0,0]=3 683 B11R1.222 CC[C@H](N)C1=C(Br)C=CC=C1 N13015 [0,2,0,0,0,0|1,0,0]=3 684 B11R1.222 CC[C@H](N)C1=C(Cl)C=NC=C1 N14403 [0,2,0,0,0,0|2,0,0]=4 685 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13856 [0,2,0,0,0,0|2,0,0]=4 686 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13857 [0,2,0,0,0,0|2,0,0]=4 687 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13858 [0,2,0,0,0,0|2,0,0]=4 688 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13859 [0,2,0,0,0,0|2,0,0]=4 689 B11R1.222 CC[C@H](O)C1=C(Br)C=CC=C1 N12628 [0,2,0,0,0,0|0,1,0]=3 690 B11R1.222 CC[C@H](O)C1=C(C)C=CC=C1 N14414 [0,2,0,0,0,0|0,1,0]=3 691 B11R1.222 CC[C@H](O)C1=C(Cl)C=CC=C1 N14413 [0,2,0,0,0,0|0,1,0]=3 692 B11R1.222 CNC(=O)C1=C(I)C=CC=C1 E72599 [0,2,0,0,0,0|0,1,1]=4 693 B11R1.222 CN[C@@H](C)C1=C(Br)C=CC=C1 N12718 [0,2,0,0,0,0|1,0,0]=3 694 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N12531 [0,2,0,0,0,0|1,0,0]=3 695 B11R1.222 CN[C@@H](C)C1=C(O)C=CC=C1 N12719 [0,2,0,0,0,0|1,0,0]=3 696 B11R1.222 COC(=N)C1=C(Br)C=CC=C1 AC5256 [0,2,0,0,0,0|1,0,1]=4 697 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 W12757 [0,2,0,0,0,0|0,1,1]=4 698 B11R1.222 N#C[C@@H](N)C1=C(F)C=CC=C1 AT10485 [0,2,0,0,0,0|1,0,1]=4 699 B11R1.222 NC1=C(C(=O)CCl)C=CC=C1 72272 [0,2,0,0,0,0|0,1,1]=4 700 B11R1.222 NCC(=O)C1=C(Br)C=CC=C1 W17616 [0,2,0,0,0,0|0,1,1]=4 701 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13418 [0,2,0,0,0,0|1,0,0]=3 702 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13419 [0,2,0,0,0,0|1,0,0]=3 703 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13441 [0,2,0,0,0,0|1,0,0]=3 704 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13442 [0,2,0,0,0,0|1,0,0]=3 705 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13403 [0,2,0,0,0,0|1,0,0]=3 706 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13409 [0,2,0,0,0,0|1,0,0]=3 707 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13410 [0,2,0,0,0,0|1,0,0]=3 708 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13390 [0,2,0,0,0,0|1,0,0]=3 709 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13391 [0,2,0,0,0,0|1,0,0]=3 710 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13392 [0,2,0,0,0,0|1,0,0]=3 711 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13393 [0,2,0,0,0,0|1,0,0]=3 712 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13394 [0,2,0,0,0,0|1,0,0]=3 713 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13395 [0,2,0,0,0,0|1,0,0]=3 714 B11R1.222 NC[C@H](O)C1=C(Br)C=CC=C1 71742 [0,2,0,0,0,0|0,1,0]=3 715 B11R1.222 NC[C@H](O)C1=C(F)C=CC=C1 C78140 [0,2,0,0,0,0|0,1,0]=3 716 B11R1.222 NC[C@H](O)C1=C(I)C=CC=C1 O10641 [0,2,0,0,0,0|0,1,0]=3 717 B11R1.222 N[C@@H](CF)C1=C(F)C=CC=C1 N14609 [0,2,0,0,0,0|1,0,0]=3 718 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 C77783 [0,2,0,0,0,0|1,0,0]=3 719 B11R1.222 N[C@@H](CO)C1=C(Cl)C=NC=C1 N14404 [0,2,0,0,0,0|2,0,0]=4 720 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15244 [0,2,0,0,0,0|1,0,0]=3 721 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15255 [0,2,0,0,0,0|1,0,0]=3 722 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=N1 N14918 [0,2,0,0,0,0|2,0,0]=4 723 B11R1.222 O=C(CCl)C1=C(Cl)C=CC=C1 D71120 [0,2,0,0,0,0|0,1,1]=4 724 B11R1.222 O=C(CO)C1=C(Br)C=CC=C1 AC7495 [0,2,0,0,0,0|0,1,1]=4 725 B11R1.222 O=C(CO)C1=C(F)C=CC=C1 AC5617 [0,2,0,0,0,0|0,1,1]=4 726 B11R1.222 O=C(CO)C1=C(I)C=CC=C1 AC7053 [0,2,0,0,0,0|0,1,1]=4 727 B11R1.222 O[C@@H](CF)C1=CC=CN=C1F AT10158 [0,2,0,0,0,0|1,1,0]=4 728 B11R1.87 CC(C)(C)C1=C(O)C=CC=N1 W16228 [0,2,0,0,0,0|2,0,0]=4 729 B11R1.87 CC(C)(N)C1=C(F)C=CC=C1 C78437 [0,2,0,0,0,0|1,0,0]=3 730 B11R1.87 CC(C)(N)C1=C(F)C=NC=C1 D81239 [0,2,0,0,0,0|2,0,0]=4 731 B11R1.87 CC(C)(O)C1=C(Br)C=CC=N1 N10027 [0,2,0,0,0,0|1,1,0]=4 732 B11R1.87 CC(C)(O)C1=C(Cl)C=NC=C1 N12769 [0,2,0,0,0,0|1,1,0]=4 733 B11R1.87 CC(C)(O)C1=CC=CN=C1F VT1237 [0,2,0,0,0,0|1,1,0]=4 734 B11R1.87 CC(F)(F)C1=C(Br)C=NC=C1 AT13789 [0,2,0,0,0,0|2,0,0]=4 735 B11R1.87 CC(F)(F)C1=C(N)C=CC=C1 AT20037 [0,2,0,0,0,0|1,0,0]=3 736 B11R1.87 C[S@](=N)(=O)C1=C(Br)C=CC=C1 AT11347 [0,2,0,0,0,0|1,1,0]=4 737 B11R1.87 C[S@](=N)(=O)C1=C(Cl)C=CC=C1 AT11351 [0,2,0,0,0,0|1,1,0]=4 738 B11R1.87 C[S@](=N)(=O)C1=C(F)C=CC=C1 AT11350 [0,2,0,0,0,0|1,1,0]=4 739 B11R1.87 [2H]C([2H])([2H])C1=C(F)C=CC=C1 D98484 [0,2,0,0,0,0|2,0,0]=4 740 B11R1.87 [2H]C([2H])([2H])C1=C(N)C=CC=C1 D99263 [0,2,0,0,0,0|2,0,0]=4 741 B11R1.155 CC(C)(C)C1=CC(=O)C=CO1 C91496 [0,2,0,0,0,0|2,0,0]=4 742 B11R1.155 CC(C)(C)C1=NC=CC(N)=C1 F10424 [0,2,0,0,0,0|2,0,0]=4 743 B11R1.155 CC(C)(F)C1=NC=CC(Br)=C1 F52114 [0,2,0,0,0,0|2,0,0]=4 744 B11R1.155 CC(C)(N)C1=CC(Br)=CN=C1 P12300 [0,2,0,0,0,0|2,0,0]=4 745 B11R1.155 CC(C)(O)C1=CC(Br)=CN=C1 AC8886 [0,2,0,0,0,0|1,1,0]=4 746 B11R1.155 CC(C)(O)C1=NC=CC(N)=C1 A51020 [0,2,0,0,0,0|1,1,0]=4 747 B11R1.155 CC(F)(F)C1=CC(Br)=NC=C1 W16968 [0,2,0,0,0,0|2,0,0]=4 748 B11R1.155 CC(F)(F)C1=CC(N)=NC=C1 C91249 [0,2,0,0,0,0|2,0,0]=4 749 B11R1.155 CC1=CC(C(C)(C)F)=NC=C1 C92383 [0,2,0,0,0,0|2,0,0]=4 750 B11R1.155 CC1=CC(C(C)(C)O)=NC=C1 C91263 [0,2,0,0,0,0|1,1,0]=4 751 B11R1.155 CC1=CC(C(C)(F)F)=NC=C1 C91251 [0,2,0,0,0,0|2,0,0]=4 752 B11R1.155 CC1=CC=CC(C(C)(C)N)=C1 N11130 [0,2,0,0,0,0|1,0,0]=3 753 B11R1.155 CP(C)(=O)C1=CC(N)=CC=C1 AT13373 [0,2,0,0,0,0|1,1,0]=4 754 B11R1.155 C[S@](=N)(=O)C1=CC(F)=CC=C1 AT11349 [0,2,0,0,0,0|1,1,0]=4 755 B11R1.155 C[S@](=N)(=O)C1=CC=CC(Br)=C1 C92921 [0,2,0,0,0,0|1,1,0]=4 756 B11R1.155 C[S@](=N)(=O)C1=CC=CC(Cl)=C1 AT11348 [0,2,0,0,0,0|1,1,0]=4 757 B11R1.155 [2H]C([2H])([2H])C1=CC=CC(Br)=C1 AT21394 [0,2,0,0,0,0|2,0,0]=4 758 B11R1.155 [2H]C([2H])([2H])C1=CC=CC(F)=C1 D97940 [0,2,0,0,0,0|2,0,0]=4 759 B11R1.53 CC(C)C1=C(CCl)C=CC=C1 E72192 [0,2,0,0,0,0|1,0,0]=3 760 B11R1.53 COC1=C([C@H](C)N)C=NC=C1 Y12493 [0,2,0,0,0,0|2,0,0]=4 761 B11R1.53 COC1=C([C@H](C)N)N=CC=C1 90521 [0,2,0,0,0,0|2,0,0]=4 762 B11R1.53 C[C@H](N)C1=C(C#N)C=CC=C1 Y12983 [0,2,0,0,0,0|1,0,0]=3 763 B11R1.53 C[C@H](N)C1=C(CO)C=CC=C1 Y13010 [0,2,0,0,0,0|1,0,0]=3 764 B11R1.53 C[C@H](O)C1=C(C#N)C=CC=C1 C73535 [0,2,0,0,0,0|0,1,0]=3 765 B11R1.53 FC(F)C1=C(CBr)C=CC=C1 AT24780 [0,2,0,0,0,0|2,0,0]=4 766 B11R1.53 O=CC1=C(C(F)F)C=CC=C1 O10520 [0,2,0,0,0,0|2,0,0]=4 767 B11R1.53 OCC1=C(C(F)F)C=CC=C1 AT10623 [0,2,0,0,0,0|2,0,0]=4 768 B11R1.156 CC(=O)C1=C(Br)C=CC=C1N C75622 [0,2,0,0,0,0|0,1,1]=4 769 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N AT12995 [0,2,0,0,0,0|1,0,0]=3 770 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1F C91102 [0,2,0,0,0,0|1,0,0]=3 771 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F AT11387 [0,2,0,0,0,0|0,1,0]=3 772 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F AT11388 [0,2,0,0,0,0|0,1,0]=3 773 B11R1.156 C[C@H](O)C1=C(I)C=CN=C1F AT16504 [0,2,0,0,0,0|1,1,0]=4 774 B11R1.156 FC(F)C1=C(Br)C=CC=C1Br AT20038 [0,2,0,0,0,0|2,0,0]=4 775 B11R1.159 C=C(C)C1=C(N)C(C)=CC=C1 F18673 [0,2,0,0,0,0|1,0,1]=4 776 B11R1.159 CC(=O)C1=C(C)C(N)=CC=C1 O10268 [0,2,0,0,0,0|0,1,1]=4 777 B11R1.159 CC(=O)C1=C(C)C(O)=CC=C1 C76227 [0,2,0,0,0,0|0,1,1]=4 778 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1I 94553 [0,2,0,0,0,0|0,1,1]=4 779 B11R1.159 CC(=O)C1=CC=CC(O)=C1F AT11003 [0,2,0,0,0,0|0,1,1]=4 780 B11R1.159 CC(C)C1=CC=CC(Br)=C1O C91212 [0,2,0,0,0,0|1,0,0]=3 781 B11R1.159 CC(C)C1=CC=CC(N)=C1N D85847 [0,2,0,0,0,0|1,0,0]=3 782 B11R1.159 CC(C)N1C=CC=C(N)C1=O AT19244 [0,2,0,0,0,0|2,0,0]=4 783 B11R1.159 CC1=C(Br)C=CC=C1C(F)F D96307 [0,2,0,0,0,0|2,0,0]=4 784 B11R1.159 CC1=CC=CC(C(F)F)=C1C C90878 [0,2,0,0,0,0|2,0,0]=4 785 B11R1.159 CC1=CC=CC([C@H](C)N)=C1C N12727 [0,2,0,0,0,0|1,0,0]=3 786 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1Cl Y11085 [0,2,0,0,0,0|1,0,0]=3 787 B11R1.159 FC1=C(Br)C(C(F)F)=CC=C1 C91613 [0,2,0,0,0,0|2,0,0]=4 788 B11R1.159 FC1=C(Br)C=CC=C1C(F)F F17091 [0,2,0,0,0,0|2,0,0]=4 789 B11R1.159 NC1=C(Cl)C(C(F)F)=CC=C1 AC1561 [0,2,0,0,0,0|2,0,0]=4 790 B11R1.167 CC(=O)C1=C(C)C=CC(Cl)=C1 F52542 [0,2,0,0,0,0|0,1,1]=4 791 B11R1.167 CC(=O)C1=C(N)C=CC(O)=C1 32344 [0,2,0,0,0,0|0,1,1]=4 792 B11R1.167 CC(C)C1=C(Br)C=CC(O)=C1 57997 [0,2,0,0,0,0|1,0,0]=3 793 B11R1.167 CC(C)C1=C(N)C=CC(Br)=C1 N12218 [0,2,0,0,0,0|1,0,0]=3 794 B11R1.167 CC(C)C1=C(O)C=CC(N)=C1 F31161 [0,2,0,0,0,0|1,0,0]=3 795 B11R1.167 CC1=CC(C(C)C)=C(O)C=C1 30812 [0,2,0,0,0,0|1,0,0]=3 796 B11R1.167 CC1=CC([C@H](C)N)=C(C)C=C1 N12153 [0,2,0,0,0,0|1,0,0]=3 797 B11R1.167 CC1=CN=C(F)C([C@H](C)O)=C1 N13304 [0,2,0,0,0,0|1,1,0]=4 798 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 C91100 [0,2,0,0,0,0|1,0,0]=3 799 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 C91101 [0,2,0,0,0,0|1,0,0]=3 800 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13035 [0,2,0,0,0,0|1,0,0]=3 801 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13127 [0,2,0,0,0,0|1,0,0]=3 802 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 AT24141 [0,2,0,0,0,0|1,0,0]=3 803 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 D85891 [0,2,0,0,0,0|1,0,0]=3 804 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 D81270 [0,2,0,0,0,0|1,0,0]=3 805 B11R1.167 C[C@H](O)C1=C(F)C=CC(F)=C1 AT11385 [0,2,0,0,0,0|0,1,0]=3 806 B11R1.167 C[C@H](O)C1=C(F)C=CC(F)=C1 AT11386 [0,2,0,0,0,0|0,1,0]=3 807 B11R1.74 CC(=O)C1=CC(F)=CC(O)=C1 C90880 [0,2,0,0,0,0|0,1,1]=4 808 B11R1.74 CC1=CC(C)=CC([C@H](C)N)=C1 N12241 [0,2,0,0,0,0|1,0,0]=3 809 B11R1.74 CN(C)C1=CC(Br)=CC(F)=C1 N11549 [0,2,0,0,0,0|2,0,0]=4 810 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(F)=C1 F16961 [0,2,0,0,0,0|1,0,0]=3 811 B11R1.74 FC1=CC(C(F)F)=CC(I)=C1 98314 [0,2,0,0,0,0|2,0,0]=4 812 B11R1.74 FC1=CC(F)=CC(C(F)F)=C1 AT19233 [0,2,0,0,0,0|2,0,0]=4 813 B11R1.266 C#CC1=CC=CC(C(C)=O)=C1 C77890 [0,2,0,0,0,0|0,1,1]=4 814 B11R1.266 C=CC1=CC=CC(C(C)=O)=C1 75088 [0,2,0,0,0,0|0,1,1]=4 815 B11R1.266 C=CC1=CC=CC([C@H](C)N)=C1 N14672 [0,2,0,0,0,0|1,0,0]=3 816 B11R1.266 CC(=O)C1=CC(C=O)=CC=C1 CL9709 [0,2,0,0,0,0|0,1,1]=4 817 B11R1.266 CC(=O)C1=CC=CC(CBr)=C1 72814 [0,2,0,0,0,0|0,1,1]=4 818 B11R1.266 CC(C)C1=NC=CC(CN)=C1 AT26652 [0,2,0,0,0,0|2,0,0]=4 819 B11R1.266 CN(C)C1=CC=CC(CBr)=C1 D87630 [0,2,0,0,0,0|2,0,0]=4 820 B11R1.266 COC1=CC([C@H](C)N)=CC=C1 N14218 [0,2,0,0,0,0|1,0,0]=3 821 B11R1.266 COC1=NC([C@H](C)N)=CC=C1 90545 [0,2,0,0,0,0|2,0,0]=4 822 B11R1.266 COC1=NC([C@H](C)N)=CC=C1 E72740 [0,2,0,0,0,0|2,0,0]=4 823 B11R1.266 COC1=NC=CC([C@H](C)N)=C1 F16998 [0,2,0,0,0,0|2,0,0]=4 824 B11R1.266 CSC1=CC([C@H](C)N)=CC=C1 N11121 [0,2,0,0,0,0|1,0,0]=3 825 B11R1.266 C[C@H](Br)C1=CC(C#N)=CC=C1 AC2913 [0,2,0,0,0,0|1,0,0]=3 826 B11R1.266 C[C@H](N)C1=CC=CC(C#N)=C1 F16928 [0,2,0,0,0,0|1,0,0]=3 827 B11R1.266 C[C@H](N)C1=CC=CC(CO)=N1 N14927 [0,2,0,0,0,0|2,0,0]=4 828 B11R1.266 C[C@H](O)C1=CC(C#N)=CC=C1 AC3011 [0,2,0,0,0,0|0,1,0]=3 829 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C14923 [0,0,0,1,0,1|1,0,0]=3 830 B11R2.10 CC1=NC2=CC=CN=C2S1 75584 [0,0,0,1,0,1|1,0,1]=4 831 B11R2.10 FC1=NC2=C(C=CC=C2)S1 T71604 [0,0,0,1,0,1|1,0,1]=4 832 B11R2.10 N=C1CC2=C(C=CC=C2)N1 30671 [0,0,0,1,0,1|1,0,1]=4 833 B11R2.10 O=C1CC2=C(C=CC=C2)S1 A51238 [0,0,0,1,0,1|0,1,1]=4 834 B11R2.34 CC1=CC=C(C2CC2)C=C1 AC9737 [0,1,0,1,0,0|1,0,0]=3 835 B11R2.34 ClC1=CC=C(C2CC2)C=C1 AC9567 [0,1,0,1,0,0|1,0,0]=3 836 B11R2.1 BrC1=CCC2=C1C=CC=C2 D78625 [0,1,0,1,0,0|1,0,1]=4 837 B11R2.1 CC1=C2C=CC=CC2=NO1 AC6101 [0,1,0,1,0,0|0,1,1]=4 838 B11R2.1 C[C@@H]1N=NC2=NC=CC=C21 F17908 [0,1,0,1,0,0|2,0,0]=4 839 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 W18948 [0,1,0,1,0,0|1,0,0]=3 840 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41003 [0,1,0,1,0,0|1,0,0]=3 841 B11R2.1 N[C@H]1CCC2=CC=CN=C21 D81362 [0,1,0,1,0,0|2,0,0]=4 842 B11R2.1 N[C@H]1CCC2=NC=CC=C21 D79496 [0,1,0,1,0,0|2,0,0]=4 843 B11R2.1 N[C@H]1COC2=C1C=CC=C2 I11926 [0,1,0,1,0,0|1,0,0]=3 844 B11R2.1 OC1=CSC2=C1C=CC=C2 C15915 [0,1,0,1,0,0|1,0,1]=4 845 B11R2.1 O[C@H]1COC2=C1C=CC=C2 AT19563 [0,1,0,1,0,0|0,1,0]=3 846 B11R2.40 NC1(C2=CC=NC=C2)CC1 28304 [0,1,0,1,0,0|2,0,0]=4 847 B11R2.40 NC1(C2=NC=CC=C2)CC1 80305 [0,1,0,1,0,0|2,0,0]=4 848 B11R2.40 NC1(C2=NC=CC=C2)CC1 80312 [0,1,0,1,0,0|2,0,0]=4 849 B11R2.239 C1=CC=C(C2CCC2)C=C1 F52090 [0,1,0,1,0,0|1,0,0]=3 850 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 A50749 [0,1,0,1,0,0|1,0,0]=3 851 B11R2.239 C1=CN=C(C2CNC2)C=C1 F31095 [0,1,0,1,0,0|2,0,0]=4 852 B11R2.988 NC[C@H]1CC2=C1C=CC=C2 AT20374 [0,1,0,1,0,0|1,0,0]=3 853 B11R2.988 OC[C@H]1CC2=C1C=CC=C2 67862 [0,1,0,1,0,0|0,1,0]=3 854 B11R2.55 BrC1=C(C2CC2)C=CN=C1 AT12865 [0,1,0,1,0,0|2,0,0]=4 855 B11R2.55 CC1=C(C2CC2)C=CC=C1 AC9736 [0,1,0,1,0,0|1,0,0]=3 856 B11R2.55 CC1=CC=CN=C1C2CC2 AC9685 [0,1,0,1,0,0|2,0,0]=4 857 B11R2.55 CC1=NC=CC=C1C2CC2 F13571 [0,1,0,1,0,0|2,0,0]=4 858 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 AT10463 [0,1,0,1,0,0|0,1,0]=3 859 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 CK2535 [0,1,0,1,0,0|0,1,0]=3 860 B11R2.55 NC1=C(C2CC2)C=CC=C1 A10978 [0,1,0,1,0,0|1,0,0]=3 861 B11R2.55 NC1=C(C2CC2)C=CN=C1 AT16333 [0,1,0,1,0,0|2,0,0]=4 862 B11R2.55 OC1=C(C2CC2)C=CC=C1 91444 [0,1,0,1,0,0|1,0,0]=3 863 B11R2.35 CC1=CC(C2CC2)=NC=C1 AC9117 [0,1,0,1,0,0|2,0,0]=4 864 B11R2.35 CC1=CC=CC(C2CC2)=C1 AC9451 [0,1,0,1,0,0|1,0,0]=3 865 B11R2.35 CC1=CC=CC(C2CC2)=N1 AC9039 [0,1,0,1,0,0|2,0,0]=4 866 B11R2.35 ClC1=CC(C2CC2)=CC=C1 97830 [0,1,0,1,0,0|1,0,0]=3 867 B11R2.35 NC1=CC(C2CC2)=CN=C1 S11509 [0,1,0,1,0,0|2,0,0]=4 868 B11R2.35 NC1=CC(C2CC2)=NC=C1 F52584 [0,1,0,1,0,0|2,0,0]=4 869 B11R2.35 NC1=NC(C2CC2)=CC=C1 AT24911 [0,1,0,1,0,0|2,0,0]=4 870 B11R2.35 OC1=CC(C2CC2)=CC=C1 97835 [0,1,0,1,0,0|1,0,0]=3 871 B11R2.35 OC1=CC(C2CC2)=NC=C1 55360 [0,1,0,1,0,0|2,0,0]=4 872 B7R1.1 CCC1=CN=CO1 C77473 [1,0,0,0,1,0|2,0,0]=4 873 B7R1.1 CCC1=COC=N1 C77618 [1,0,0,0,1,0|2,0,0]=4 874 B7R1.1 ClCC1=CSC=C1 AT17055 [1,0,0,0,1,0|2,0,0]=4 875 B7R1.1 NCC1=COC=C1 61502 [1,0,0,0,1,0|2,0,0]=4 876 B7R1.1 OCC1=CC=CN1 AT16114 [1,0,0,0,1,0|1,1,0]=4 877 B7R1.1 SCC1=CC=CS1 T72725 [1,0,0,0,1,0|1,0,0]=3 878 B11R1.91 CC(C)NCC1=CC=CN=C1 AC5151 [0,0,0,0,0,2|2,0,0]=4 879 B11R1.91 CC(C)NCC1=CC=NC=C1 AC6648 [0,0,0,0,0,2|2,0,0]=4 880 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12753 [0,0,0,0,0,2|1,0,0]=3 881 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12763 [0,0,0,0,0,2|1,0,0]=3 882 B11R1.91 C[C@H](N)CSC1=CC=CC=C1 AT26670 [0,0,0,0,0,2|1,0,0]=3