0 B9R1.6 BrC(=C)c1ccccc1 1P003AO1 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.6 BrC(=O)c1ccccc1 1P003OJM [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 C(=O)([2H])c1ccccc1 1P00CKBV [0,0,0,0,0,0|2,0,0]=2 3 B9R1.6 CC(=C)c1ccccn1 1P00ELW9 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.6 CC(=C)c1cccnc1 1P00B5O7 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.6 CC(=O)c1ccccc1 1P0036AX [0,0,0,0,0,0|2,0,0]=2 6 B9R1.6 CC(=O)c1ccccn1 1P003GS6 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.6 CC(=O)c1cccnc1 1P003JA6 [0,0,0,0,0,0|1,0,0]=1 8 B9R1.6 CC(=O)c1cccnn1 1P007UEX [0,0,0,0,0,0|2,0,0]=2 9 B9R1.6 CC(=O)c1ccncc1 1P003L3Q [0,0,0,0,0,0|3,0,0]=3 10 B9R1.6 CC(=O)c1ccncn1 1P00BYH9 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.6 CC(=O)c1ccnnc1 1P006VU7 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.6 CC(=O)c1cnccn1 1P003O4N [0,0,0,0,0,0|2,0,0]=2 13 B9R1.6 CC(=O)c1cncnc1 1P003DIC [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 CC(=O)c1ncccn1 1P003GS7 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.6 CC(c1ccccc1)Br 1P003BVV [0,0,0,0,0,0|3,0,1]=4 16 B9R1.6 CC(c1ccccc1)C 1P0032S0 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.6 CC(c1ccccc1)Cl 1P003ENS [0,0,0,0,0,0|3,0,1]=4 18 B9R1.6 CC(c1ccccc1)N 1P00369W [0,0,0,0,0,0|2,0,1]=3 19 B9R1.6 CC(c1ccccc1)N 1P009X79 [0,0,0,0,0,0|2,0,1]=3 20 B9R1.6 CC(c1ccccc1)S 1P003COW [0,0,0,0,0,0|2,1,1]=4 21 B9R1.6 CC(c1ccccn1)N 1P0039UO [0,0,0,0,0,0|3,0,1]=4 22 B9R1.6 CC(c1ccccn1)N 1P003DC9 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.6 CC(c1cccnc1)Br 1P019XJX [0,0,0,0,0,0|2,0,1]=3 24 B9R1.6 CC(c1cccnc1)Cl 1P0169EF [0,0,0,0,0,0|2,0,1]=3 25 B9R1.6 CC(c1cccnc1)N 1P000HRO [0,0,0,0,0,0|1,0,1]=2 26 B9R1.6 CC(c1cccnc1)N 1P003DEG [0,0,0,0,0,0|1,0,1]=2 27 B9R1.6 CC(c1cccnc1)O 1P003IG7 [0,0,0,0,0,0|1,0,2]=3 28 B9R1.6 CC(c1cccnn1)Cl 1P02519E [0,0,0,0,0,0|3,0,1]=4 29 B9R1.6 CC(c1cccnn1)N 1P01KX69 [0,0,0,0,0,0|2,0,1]=3 30 B9R1.6 CC(c1cccnn1)O 1P00HZKK [0,0,0,0,0,0|2,0,2]=4 31 B9R1.6 CC(c1ccncc1)N 1P001ZXP [0,0,0,0,0,0|3,0,1]=4 32 B9R1.6 CC(c1ccncc1)N 1P003DHP [0,0,0,0,0,0|3,0,1]=4 33 B9R1.6 CC(c1ccncc1)N 1P01C1JO [0,0,0,0,0,0|3,0,1]=4 34 B9R1.6 CC(c1ccnnc1)N 1P0003H4 [0,0,0,0,0,0|2,0,1]=3 35 B9R1.6 CC(c1ccnnc1)N 1P00HDEA [0,0,0,0,0,0|2,0,1]=3 36 B9R1.6 CC(c1ccnnc1)O 1P0282XW [0,0,0,0,0,0|2,0,2]=4 37 B9R1.6 CC(c1cnccn1)Cl 1P000Z2P [0,0,0,0,0,0|3,0,1]=4 38 B9R1.6 CC(c1cnccn1)N 1P0027E6 [0,0,0,0,0,0|2,0,1]=3 39 B9R1.6 CC(c1cnccn1)O 1P00IIZX [0,0,0,0,0,0|2,0,2]=4 40 B9R1.6 CC(c1cncnc1)N 1P01K4D6 [0,0,0,0,0,0|2,0,1]=3 41 B9R1.6 CC(c1cncnc1)O 1P00G5BU [0,0,0,0,0,0|2,0,2]=4 42 B9R1.6 CC(c1nccnc1)N 1P01EII2 [0,0,0,0,0,0|2,0,1]=3 43 B9R1.6 CN(c1ccccc1)C 1P003T1K [0,0,0,0,0,0|4,0,0]=4 44 B9R1.6 CN(c1ccccc1)N 1P003EY0 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.6 CN(c1ccccc1)N 1P00EKZW [0,0,0,0,0,0|3,0,0]=3 46 B9R1.6 CN(c1ccccn1)N 1P00736N [0,0,0,0,0,0|4,0,0]=4 47 B9R1.6 CN(c1cccnc1)C 1P0075WN [0,0,0,0,0,0|3,0,0]=3 48 B9R1.6 CN(c1ccncc1)N 1P01E1AT [0,0,0,0,0,0|4,0,0]=4 49 B9R1.6 CN(c1cnccn1)N 1P00G9SO [0,0,0,0,0,0|3,0,0]=3 50 B9R1.6 CP(c1ccccc1)C 1P003Q45 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.6 CP(c1ccccc1)C 1P00BHDQ [0,0,0,0,0,0|4,0,0]=4 52 B9R1.6 CS(=O)c1ccccc1 1P000J0D [0,0,0,0,0,0|3,0,0]=3 53 B9R1.6 CS(=O)c1ccccn1 1P006YWW [0,0,0,0,0,0|4,0,0]=4 54 B9R1.6 C[C@@H](c1ccccc1)N 1P0032WG [0,0,0,0,0,0|2,0,1]=3 55 B9R1.6 C[C@@H](c1ccccc1)O 1P00HXJL [0,0,0,0,0,0|2,0,2]=4 56 B9R1.6 C[C@@H](c1ccccc1)S 1P01BVUY [0,0,0,0,0,0|2,1,1]=4 57 B9R1.6 C[C@@H](c1ccccn1)N 1P002VEV [0,0,0,0,0,0|3,0,1]=4 58 B9R1.6 C[C@@H](c1ccccn1)N 1P00CJBI [0,0,0,0,0,0|3,0,1]=4 59 B9R1.6 C[C@@H](c1cccnc1)N 1P002VEU [0,0,0,0,0,0|1,0,1]=2 60 B9R1.6 C[C@@H](c1cccnc1)N 1P00I8C2 [0,0,0,0,0,0|1,0,1]=2 61 B9R1.6 C[C@@H](c1cccnc1)O 1P003CZF [0,0,0,0,0,0|1,0,2]=3 62 B9R1.6 C[C@@H](c1ccncc1)N 1P002VET [0,0,0,0,0,0|3,0,1]=4 63 B9R1.6 C[C@@H](c1ccncc1)N 1P00CNEB [0,0,0,0,0,0|3,0,1]=4 64 B9R1.6 C[C@@H](c1cnccn1)O 1P01AJZA [0,0,0,0,0,0|2,0,2]=4 65 B9R1.6 C[C@@H](c1nccnc1)N 1P01B2Z8 [0,0,0,0,0,0|2,0,1]=3 66 B9R1.6 C[C@H](c1ccccc1)N 1P0032UU [0,0,0,0,0,0|2,0,1]=3 67 B9R1.6 C[C@H](c1ccccc1)N 1P00BC58 [0,0,0,0,0,0|2,0,1]=3 68 B9R1.6 C[C@H](c1ccccc1)O 1P0032UN [0,0,0,0,0,0|2,0,2]=4 69 B9R1.6 C[C@H](c1ccccc1)S 1P01DWTD [0,0,0,0,0,0|2,1,1]=4 70 B9R1.6 C[C@H](c1ccccn1)N 1P009I22 [0,0,0,0,0,0|3,0,1]=4 71 B9R1.6 C[C@H](c1ccccn1)N 1P00DBIS [0,0,0,0,0,0|3,0,1]=4 72 B9R1.6 C[C@H](c1cccnc1)N 1P000DVB [0,0,0,0,0,0|1,0,1]=2 73 B9R1.6 C[C@H](c1cccnc1)N 1P00CKTS [0,0,0,0,0,0|1,0,1]=2 74 B9R1.6 C[C@H](c1cccnc1)N 1P00I8C1 [0,0,0,0,0,0|1,0,1]=2 75 B9R1.6 C[C@H](c1cccnc1)O 1P003CNM [0,0,0,0,0,0|1,0,2]=3 76 B9R1.6 C[C@H](c1cccnn1)O 1P024TVV [0,0,0,0,0,0|2,0,2]=4 77 B9R1.6 C[C@H](c1ccncc1)N 1P0004FL [0,0,0,0,0,0|3,0,1]=4 78 B9R1.6 C[C@H](c1ccncc1)N 1P00DLCH [0,0,0,0,0,0|3,0,1]=4 79 B9R1.6 C[C@H](c1cnccn1)N 1P000X0F [0,0,0,0,0,0|2,0,1]=3 80 B9R1.6 C[C@H](c1cnccn1)O 1P01AJZ9 [0,0,0,0,0,0|2,0,2]=4 81 B9R1.6 C[C@H](c1nccnc1)N 1P01C72C [0,0,0,0,0,0|2,0,1]=3 82 B9R1.6 C[Si](c1ccccc1)C 1P00358B [0,0,0,0,0,0|3,1,0]=4 83 B9R1.6 ClB(c1ccccc1)Cl 1P004HX5 [0,0,0,0,0,0|4,0,0]=4 84 B9R1.6 ClC(=O)c1ccccc1 1P00374M [0,0,0,0,0,0|2,0,0]=2 85 B9R1.6 ClC(=O)c1ccccn1 1P002ZQS [0,0,0,0,0,0|3,0,0]=3 86 B9R1.6 ClC(=O)c1ccccn1 1P003UJ3 [0,0,0,0,0,0|3,0,0]=3 87 B9R1.6 ClC(=O)c1cccnc1 1P0028T1 [0,0,0,0,0,0|1,0,0]=1 88 B9R1.6 ClC(=O)c1cccnc1 1P008RIG [0,0,0,0,0,0|1,0,0]=1 89 B9R1.6 ClC(=O)c1ccncc1 1P003RKP [0,0,0,0,0,0|3,0,0]=3 90 B9R1.6 ClC(=O)c1cnccn1 1P002C00 [0,0,0,0,0,0|2,0,0]=2 91 B9R1.6 ClC(=O)c1cncnc1 1P00CJ9M [0,0,0,0,0,0|2,0,0]=2 92 B9R1.6 ClC(=O)c1ncccn1 1P00CGQU [0,0,0,0,0,0|4,0,0]=4 93 B9R1.6 ClC(=S)c1ccccc1 1P01E7HC [0,0,0,0,0,0|2,1,0]=3 94 B9R1.6 ClC(c1ccccc1)Cl 1P00IKXY [0,0,0,0,0,0|3,0,1]=4 95 B9R1.6 ClP(c1ccccc1)Cl 1P0035XX [0,0,0,0,0,0|4,0,0]=4 96 B9R1.6 ClS(=O)c1ccccc1 1P00DHD9 [0,0,0,0,0,0|3,0,0]=3 97 B9R1.6 Cl[I](c1ccccc1)Cl 1P0037A2 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.6 FC(=C)c1ccccc1 1P005W4Z [0,0,0,0,0,0|3,0,0]=3 99 B9R1.6 FC(=O)c1ccccc1 1P00D8I4 [0,0,0,0,0,0|2,0,0]=2 100 B9R1.6 FC(c1ccccc1)Br 1P020M24 [0,0,0,0,0,0|3,0,1]=4 101 B9R1.6 FC(c1ccccc1)F 1P00DCHS [0,0,0,0,0,0|3,0,1]=4 102 B9R1.6 FC(c1cccnc1)F 1P005KXX [0,0,0,0,0,0|2,0,1]=3 103 B9R1.6 NC(=N)c1ccccc1 1P002J4G [0,0,0,0,0,0|2,0,0]=2 104 B9R1.6 NC(=N)c1ccccc1 1P0034Y8 [0,0,0,0,0,0|2,0,0]=2 105 B9R1.6 NC(=N)c1ccccc1 1P003OH8 [0,0,0,0,0,0|2,0,0]=2 106 B9R1.6 NC(=N)c1ccccc1 1P00FJIS [0,0,0,0,0,0|2,0,0]=2 107 B9R1.6 NC(=N)c1ccccn1 1P0035Y9 [0,0,0,0,0,0|3,0,0]=3 108 B9R1.6 NC(=N)c1cccnc1 1P002N4J [0,0,0,0,0,0|1,0,0]=1 109 B9R1.6 NC(=N)c1cccnc1 1P003KCV [0,0,0,0,0,0|1,0,0]=1 110 B9R1.6 NC(=N)c1cccnc1 1P00EEAY [0,0,0,0,0,0|1,0,0]=1 111 B9R1.6 NC(=N)c1ccncc1 1P0035IL [0,0,0,0,0,0|3,0,0]=3 112 B9R1.6 NC(=N)c1ccncc1 1P00EDM3 [0,0,0,0,0,0|3,0,0]=3 113 B9R1.6 NC(=N)c1ccncn1 1P01B7CQ [0,0,0,0,0,0|4,0,0]=4 114 B9R1.6 NC(=N)c1cnccn1 1P00199A [0,0,0,0,0,0|2,0,0]=2 115 B9R1.6 NC(=N)c1cncnc1 1P00FB1H [0,0,0,0,0,0|2,0,0]=2 116 B9R1.6 NC(=N)c1ncccn1 1P00199B [0,0,0,0,0,0|4,0,0]=4 117 B9R1.6 NC(=N)c1ncccn1 1P00BK19 [0,0,0,0,0,0|4,0,0]=4 118 B9R1.6 NC(=N)c1ncccn1 1P00DC2K [0,0,0,0,0,0|4,0,0]=4 119 B9R1.6 NC(=O)C1=CCNCC1 1P028UNB [0,0,0,0,0,0|2,0,2]=4 120 B9R1.6 NC(=O)C1=CNCCC1 1P00FAZF [0,0,0,0,0,0|0,0,4]=4 121 B9R1.6 NC(=O)C1CCC=CC1 1P00D9E5 [0,0,0,0,0,0|1,0,3]=4 122 B9R1.6 NC(=O)c1ccccc1 1P00DOQ9 [0,0,0,0,0,0|1,0,0]=1 123 B9R1.6 NC(=O)c1ccccn1 1P003U8O [0,0,0,0,0,0|2,0,0]=2 124 B9R1.6 NC(=O)c1cccnc1 1P00IKH0 [0,0,0,0,0,0|0,0,0]=0 125 B9R1.6 NC(=O)c1cccnn1 1P00DL9W [0,0,0,0,0,0|1,0,0]=1 126 B9R1.6 NC(=O)c1ccncc1 1P001L8G [0,0,0,0,0,0|2,0,0]=2 127 B9R1.6 NC(=O)c1ccncn1 1P002WFX [0,0,0,0,0,0|3,0,0]=3 128 B9R1.6 NC(=O)c1ccnnc1 1P00H1KR [0,0,0,0,0,0|1,0,0]=1 129 B9R1.6 NC(=O)c1cnccn1 1P003UIG [0,0,0,0,0,0|1,0,0]=1 130 B9R1.6 NC(=O)c1cncnc1 1P00BXU6 [0,0,0,0,0,0|1,0,0]=1 131 B9R1.6 NC(=O)c1ncccn1 1P00490W [0,0,0,0,0,0|3,0,0]=3 132 B9R1.6 NC(=S)c1ccccc1 1P00365I [0,0,0,0,0,0|1,1,0]=2 133 B9R1.6 NC(=S)c1ccccn1 1P00IA0A [0,0,0,0,0,0|2,1,0]=3 134 B9R1.6 NC(=S)c1cccnc1 1P00I915 [0,0,0,0,0,0|0,1,0]=1 135 B9R1.6 NC(=S)c1cccnn1 1P00IFKR [0,0,0,0,0,0|1,1,0]=2 136 B9R1.6 NC(=S)c1ccncc1 1P003V92 [0,0,0,0,0,0|2,1,0]=3 137 B9R1.6 NC(=S)c1ccncn1 1P0049JJ [0,0,0,0,0,0|3,1,0]=4 138 B9R1.6 NC(=S)c1ccnnc1 1P00C81H [0,0,0,0,0,0|1,1,0]=2 139 B9R1.6 NC(=S)c1cnccn1 1P003UIJ [0,0,0,0,0,0|1,1,0]=2 140 B9R1.6 NC(=S)c1cncnc1 1P004A55 [0,0,0,0,0,0|1,1,0]=2 141 B9R1.6 NC(=S)c1ncccn1 1P00DJ7T [0,0,0,0,0,0|3,1,0]=4 142 B9R1.6 NS(=O)c1ccccc1 1P001SKC [0,0,0,0,0,0|2,0,0]=2 143 B9R1.6 O=N(=O)c1ccccc1 1P003TLR [0,0,0,0,0,0|3,0,0]=3 144 B9R1.6 OB(c1ccccc1)O 1P0035XS [0,0,0,0,0,0|3,0,1]=4 145 B9R1.6 OB(c1cccnc1)O 1P001Z1A [0,0,0,0,0,0|2,0,1]=3 146 B9R1.6 OB(c1cccnc1)O 1P002U6U [0,0,0,0,0,0|2,0,1]=3 147 B9R1.6 OB(c1cccnn1)O 1P0039U9 [0,0,0,0,0,0|3,0,1]=4 148 B9R1.6 OB(c1cncnc1)O 1P0034RT [0,0,0,0,0,0|3,0,1]=4 149 B9R1.6 OB(c1nccnc1)O 1P005S03 [0,0,0,0,0,0|3,0,1]=4 150 B9R1.6 OC(=O)c1ccccc1 1P0034YN [0,0,0,0,0,0|2,0,0]=2 151 B9R1.6 OC(=O)c1ccccc1 1P003U1P [0,0,0,0,0,0|2,0,0]=2 152 B9R1.6 OC(=O)c1ccccc1 1P0080KJ [0,0,0,0,0,0|2,0,0]=2 153 B9R1.6 OC(=O)c1ccccc1 1P00GSC1 [0,0,0,0,0,0|2,0,0]=2 154 B9R1.6 OC(=O)c1ccccc1 1P01JV1A [0,0,0,0,0,0|2,0,0]=2 155 B9R1.6 OC(=O)c1ccccn1 1P0035Y8 [0,0,0,0,0,0|3,0,0]=3 156 B9R1.6 OC(=O)c1ccccn1 1P003U8P [0,0,0,0,0,0|3,0,0]=3 157 B9R1.6 OC(=O)c1cccnc1 1P00EZXS [0,0,0,0,0,0|1,0,0]=1 158 B9R1.6 OC(=O)c1cccnc1 1P00IBTV [0,0,0,0,0,0|1,0,0]=1 159 B9R1.6 OC(=O)c1cccnn1 1P00BCBL [0,0,0,0,0,0|2,0,0]=2 160 B9R1.6 OC(=O)c1cccnn1 1P01Z9RM [0,0,0,0,0,0|2,0,0]=2 161 B9R1.6 OC(=O)c1ccncc1 1P0035IK [0,0,0,0,0,0|3,0,0]=3 162 B9R1.6 OC(=O)c1ccncn1 1P003UJM [0,0,0,0,0,0|4,0,0]=4 163 B9R1.6 OC(=O)c1ccnnc1 1P0034LS [0,0,0,0,0,0|2,0,0]=2 164 B9R1.6 OC(=O)c1cnccn1 1P0033WC [0,0,0,0,0,0|2,0,0]=2 165 B9R1.6 OC(=O)c1cncnc1 1P003NF7 [0,0,0,0,0,0|2,0,0]=2 166 B9R1.6 OC(=O)c1ncccn1 1P003UJL [0,0,0,0,0,0|4,0,0]=4 167 B9R1.6 OC(=O)c1ncccn1 1P01AJVA [0,0,0,0,0,0|4,0,0]=4 168 B9R1.6 OC(=O)c1nccnn1 1P01DXUR [0,0,0,0,0,0|3,0,0]=3 169 B9R1.6 OC(=S)c1ccccc1 1P00365J [0,0,0,0,0,0|2,0,1]=3 170 B9R1.6 OP(=O)c1ccccc1 1P00262L [0,0,0,0,0,0|3,0,0]=3 171 B9R1.6 OS(=O)c1ccccc1 1P00IBDR [0,0,0,0,0,0|3,0,0]=3 172 B9R1.6 O[Se](=O)c1ccccc1 1P003OHL [0,0,0,0,0,0|3,0,0]=3 173 B9R1.6 [O-]C(=O)c1ccccc1 1P001YXL [0,0,0,0,0,0|2,0,0]=2 174 B9R1.6 [O-]C(=O)c1ccccc1 1P00361Z [0,0,0,0,0,0|2,0,0]=2 175 B9R1.6 [O-]C(=O)c1ccccc1 1P003OB0 [0,0,0,0,0,0|2,0,0]=2 176 B9R1.6 [O-]C(=O)c1ccccc1 1P003RRN [0,0,0,0,0,0|2,0,0]=2 177 B9R1.6 [O-]C(=O)c1ccccc1 1P003UCI [0,0,0,0,0,0|2,0,0]=2 178 B9R1.6 [O-]C(=O)c1ccccc1 1P003UPU [0,0,0,0,0,0|2,0,0]=2 179 B9R1.6 [O-]C(=O)c1ccccc1 1P00C9FZ [0,0,0,0,0,0|2,0,0]=2 180 B9R1.6 [O-]C(=O)c1ccccc1 1P00D9FZ [0,0,0,0,0,0|2,0,0]=2 181 B9R1.6 [O-]C(=O)c1ccccc1 1P01DORW [0,0,0,0,0,0|2,0,0]=2 182 B9R1.6 [O-]C(=O)c1ccccn1 1P001FPK [0,0,0,0,0,0|3,0,0]=3 183 B9R1.6 [O-]C(=O)c1ccccn1 1P003PCW [0,0,0,0,0,0|3,0,0]=3 184 B9R1.6 [O-]C(=O)c1ccccn1 1P003U8R [0,0,0,0,0,0|3,0,0]=3 185 B9R1.6 [O-]C(=O)c1cccnc1 1P003UTW [0,0,0,0,0,0|1,0,0]=1 186 B9R1.6 [O-]C(=O)c1ccncc1 1P003US2 [0,0,0,0,0,0|3,0,0]=3 187 B9R1.6 [O-]C(=O)c1ccncn1 1P0055B7 [0,0,0,0,0,0|4,0,0]=4 188 B9R1.6 [O-]S(=O)c1ccccc1 1P002RKI [0,0,0,0,0,0|3,0,0]=3 189 B9R1.6 [O-]S(=O)c1ccccc1 1P00388M [0,0,0,0,0,0|3,0,0]=3 190 B9R1.6 [O-]S(=O)c1ccccc1 1P004L8X [0,0,0,0,0,0|3,0,0]=3 191 B9R1.6 [O-]S(=O)c1ccccn1 1P00I55G [0,0,0,0,0,0|4,0,0]=4 192 B9R1.6 [O-]S(=O)c1ccccn1 1P01AGPS [0,0,0,0,0,0|4,0,0]=4 193 B9R1.6 [O-]S(=O)c1cccnc1 1P00A6VE [0,0,0,0,0,0|2,0,0]=2 194 B9R1.6 [O-]S(=O)c1cccnc1 1P027XAI [0,0,0,0,0,0|2,0,0]=2 195 B9R1.6 [O-]S(=O)c1ccncc1 1P01FNTD [0,0,0,0,0,0|4,0,0]=4 196 B9R1.6 [O-][N+](=O)c1ccccn1 1P001MRG [0,0,0,0,0,0|4,0,0]=4 197 B9R1.6 [O-][N+](=O)c1cccnc1 1P003KAJ [0,0,0,0,0,0|2,0,0]=2 198 B9R1.6 [O-][N+](=O)c1ccncc1 1P007C8Z [0,0,0,0,0,0|4,0,0]=4 199 B9R1.6 [O-][N+](=O)c1cncnc1 1P001D8H [0,0,0,0,0,0|3,0,0]=3 200 B8R1.2 BrCc1ccccc1 1P0000N4 [1,0,0,0,0,0|2,0,1]=4 201 B8R1.2 BrCc1cccnc1 1P0033XF [1,0,0,0,0,0|1,0,1]=3 202 B8R1.2 BrCc1cccnn1 1P001L60 [1,0,0,0,0,0|2,0,1]=4 203 B8R1.2 BrCc1ccnnc1 1P01V2SC [1,0,0,0,0,0|2,0,1]=4 204 B8R1.2 BrCc1cnccn1 1P001ID7 [1,0,0,0,0,0|2,0,1]=4 205 B8R1.2 BrCc1cncnc1 1P00H1HO [1,0,0,0,0,0|2,0,1]=4 206 B8R1.2 Br[Mg]c1ccccc1 1P0000NW [1,0,0,0,0,0|3,0,0]=4 207 B8R1.2 Br[Se]c1ccccc1 1P00399Q [1,0,0,0,0,0|3,0,0]=4 208 B8R1.2 C#Cc1ccccc1 1P0037R1 [1,0,0,0,0,0|2,0,1]=4 209 B8R1.2 C#Cc1cccnc1 1P002QXU [1,0,0,0,0,0|1,0,1]=3 210 B8R1.2 C#Cc1cccnn1 1P00060E [1,0,0,0,0,0|2,0,1]=4 211 B8R1.2 C#Cc1cnccn1 1P00ADUU [1,0,0,0,0,0|2,0,1]=4 212 B8R1.2 C#Cc1cncnc1 1P00387D [1,0,0,0,0,0|2,0,1]=4 213 B8R1.2 C=C[n+]1ccccc1 1P01EWMV [1,0,0,0,0,0|3,0,0]=4 214 B8R1.2 C=Cc1ccccc1 1P0000N1 [1,0,0,0,0,0|2,0,0]=3 215 B8R1.2 C=Cc1ccccc1 1P00C4A8 [1,0,0,0,0,0|2,0,0]=3 216 B8R1.2 C=Cc1cccnc1 1P003491 [1,0,0,0,0,0|1,0,0]=2 217 B8R1.2 C=Cc1cccnn1 1P01E0FL [1,0,0,0,0,0|2,0,0]=3 218 B8R1.2 C=Cc1ccncc1 1P0000N0 [1,0,0,0,0,0|3,0,0]=4 219 B8R1.2 C=Cc1cnccn1 1P003IFF [1,0,0,0,0,0|2,0,0]=3 220 B8R1.2 C=Cc1cncnc1 1P00DHZ5 [1,0,0,0,0,0|2,0,0]=3 221 B8R1.2 CCc1ccccc1 1P0000N2 [1,0,0,0,0,0|2,0,1]=4 222 B8R1.2 CCc1cccnc1 1P00DE9B [1,0,0,0,0,0|1,0,1]=3 223 B8R1.2 CCc1cccnn1 1P00BI37 [1,0,0,0,0,0|2,0,1]=4 224 B8R1.2 CCc1cnccn1 1P003HNC [1,0,0,0,0,0|2,0,1]=4 225 B8R1.2 CCc1cncnc1 1P002RAM [1,0,0,0,0,0|2,0,1]=4 226 B8R1.2 CNc1ccccc1 1P0000NT [1,0,0,0,0,0|3,0,0]=4 227 B8R1.2 CNc1ccccc1 1P003TNS [1,0,0,0,0,0|3,0,0]=4 228 B8R1.2 CNc1cccnc1 1P00289C [1,0,0,0,0,0|2,0,0]=3 229 B8R1.2 CNc1cccnn1 1P00DM46 [1,0,0,0,0,0|3,0,0]=4 230 B8R1.2 CNc1ccnnc1 1P0035V9 [1,0,0,0,0,0|3,0,0]=4 231 B8R1.2 CNc1cnccn1 1P00CL7Z [1,0,0,0,0,0|3,0,0]=4 232 B8R1.2 CNc1cncnc1 1P00CMNJ [1,0,0,0,0,0|3,0,0]=4 233 B8R1.2 COc1[c-]nccc1 1P008UE4 [1,0,0,0,0,0|2,0,1]=4 234 B8R1.2 COc1ccccc1 1P0000NO [1,0,0,0,0,0|3,0,0]=4 235 B8R1.2 COc1cccnc1 1P00347L [1,0,0,0,0,0|2,0,0]=3 236 B8R1.2 COc1cccnn1 1P002F5K [1,0,0,0,0,0|3,0,0]=4 237 B8R1.2 COc1ccnnc1 1P002JGU [1,0,0,0,0,0|3,0,0]=4 238 B8R1.2 COc1cnccn1 1P003I17 [1,0,0,0,0,0|3,0,0]=4 239 B8R1.2 COc1cncnc1 1P00BXRG [1,0,0,0,0,0|3,0,0]=4 240 B8R1.2 CSc1ccccc1 1P0000NM [1,0,0,0,0,0|3,0,0]=4 241 B8R1.2 CSc1cccnc1 1P002H17 [1,0,0,0,0,0|2,0,0]=3 242 B8R1.2 CSc1cnccn1 1P003BJ9 [1,0,0,0,0,0|3,0,0]=4 243 B8R1.2 CSc1cncnc1 1P009JCV [1,0,0,0,0,0|3,0,0]=4 244 B8R1.2 C[SiH2]c1ccccc1 1P005JR8 [1,0,0,0,0,0|2,1,0]=4 245 B8R1.2 ClCc1cccnc1 1P005WS5 [1,0,0,0,0,0|1,0,1]=3 246 B8R1.2 ClCc1cccnn1 1P00BJDE [1,0,0,0,0,0|2,0,1]=4 247 B8R1.2 ClCc1ccnnc1 1P028UKA [1,0,0,0,0,0|2,0,1]=4 248 B8R1.2 ClCc1cnccn1 1P002KZH [1,0,0,0,0,0|2,0,1]=4 249 B8R1.2 ClCc1cncnc1 1P009EMG [1,0,0,0,0,0|2,0,1]=4 250 B8R1.2 Cl[Mg]c1ccccc1 1P0000NV [1,0,0,0,0,0|3,0,0]=4 251 B8R1.2 Cl[Se]c1ccccc1 1P0035XY [1,0,0,0,0,0|3,0,0]=4 252 B8R1.2 FCc1cccnc1 1P004R6V [1,0,0,0,0,0|1,0,1]=3 253 B8R1.2 ICc1ccccc1 1P0037QF [1,0,0,0,0,0|2,0,1]=4 254 B8R1.2 ICc1cccnc1 1P005TG6 [1,0,0,0,0,0|1,0,1]=3 255 B8R1.2 N#Cc1ccccc1 1P0000MW [1,0,0,0,0,0|1,0,2]=4 256 B8R1.2 N#Cc1ccccc1 1P001LN2 [1,0,0,0,0,0|1,0,2]=4 257 B8R1.2 N#Cc1ccccc1 1P003OQS [1,0,0,0,0,0|1,0,2]=4 258 B8R1.2 N#Cc1cccnc1 1P0000O0 [1,0,0,0,0,0|0,0,2]=3 259 B8R1.2 N#Cc1ccnnc1 1P0061S0 [1,0,0,0,0,0|1,0,2]=4 260 B8R1.2 N#Cc1cncnc1 1P003NF6 [1,0,0,0,0,0|1,0,2]=4 261 B8R1.2 N#[N+]c1ccccc1 1P00CLKS [1,0,0,0,0,0|2,0,1]=4 262 B8R1.2 NCc1ccccc1 1P0000MX [1,0,0,0,0,0|1,0,1]=3 263 B8R1.2 NCc1ccccc1 1P003OLG [1,0,0,0,0,0|1,0,1]=3 264 B8R1.2 NCc1ccccc1 1P00BYUK [1,0,0,0,0,0|1,0,1]=3 265 B8R1.2 NCc1ccccc1 1P00DH5Y [1,0,0,0,0,0|1,0,1]=3 266 B8R1.2 NCc1ccccn1 1P003IDS [1,0,0,0,0,0|2,0,1]=4 267 B8R1.2 NCc1cccnc1 1P003UIR [1,0,0,0,0,0|0,0,1]=2 268 B8R1.2 NCc1cccnc1 1P01XEWA [1,0,0,0,0,0|0,0,1]=2 269 B8R1.2 NCc1cccnn1 1P00GS3J [1,0,0,0,0,0|1,0,1]=3 270 B8R1.2 NCc1cccnn1 1P01JUG1 [1,0,0,0,0,0|1,0,1]=3 271 B8R1.2 NCc1ccncc1 1P0034LV [1,0,0,0,0,0|2,0,1]=4 272 B8R1.2 NCc1ccncc1 1P00ED63 [1,0,0,0,0,0|2,0,1]=4 273 B8R1.2 NCc1ccnnc1 1P003AHQ [1,0,0,0,0,0|1,0,1]=3 274 B8R1.2 NCc1ccnnc1 1P006ZTS [1,0,0,0,0,0|1,0,1]=3 275 B8R1.2 NCc1cnccn1 1P002CZT [1,0,0,0,0,0|1,0,1]=3 276 B8R1.2 NCc1cnccn1 1P00397Q [1,0,0,0,0,0|1,0,1]=3 277 B8R1.2 NCc1cncnc1 1P002RBY [1,0,0,0,0,0|1,0,1]=3 278 B8R1.2 NCc1cncnc1 1P00ILSS [1,0,0,0,0,0|1,0,1]=3 279 B8R1.2 NCc1nccnc1 1P00HE98 [1,0,0,0,0,0|1,0,1]=3 280 B8R1.2 NNc1ccccc1 1P0000NR [1,0,0,0,0,0|2,0,0]=3 281 B8R1.2 NNc1ccccc1 1P0035XW [1,0,0,0,0,0|2,0,0]=3 282 B8R1.2 NNc1ccccc1 1P003U6F [1,0,0,0,0,0|2,0,0]=3 283 B8R1.2 NNc1ccccn1 1P003HU7 [1,0,0,0,0,0|3,0,0]=4 284 B8R1.2 NNc1ccccn1 1P00DIES [1,0,0,0,0,0|3,0,0]=4 285 B8R1.2 NNc1ccccn1 1P00I9B1 [1,0,0,0,0,0|3,0,0]=4 286 B8R1.2 NNc1cccnc1 1P0037EA [1,0,0,0,0,0|1,0,0]=2 287 B8R1.2 NNc1cccnc1 1P00398X [1,0,0,0,0,0|1,0,0]=2 288 B8R1.2 NNc1cccnc1 1P003JZP [1,0,0,0,0,0|1,0,0]=2 289 B8R1.2 NNc1cccnn1 1P000E2H [1,0,0,0,0,0|2,0,0]=3 290 B8R1.2 NNc1ccncc1 1P002JZO [1,0,0,0,0,0|3,0,0]=4 291 B8R1.2 NNc1ccncc1 1P01DFTQ [1,0,0,0,0,0|3,0,0]=4 292 B8R1.2 NNc1ccncc1 1P01FD3X [1,0,0,0,0,0|3,0,0]=4 293 B8R1.2 NNc1ccnnc1 1P028LF6 [1,0,0,0,0,0|2,0,0]=3 294 B8R1.2 NNc1cncnc1 1P01BA7I [1,0,0,0,0,0|2,0,0]=3 295 B8R1.2 NOc1ccccc1 1P0037K5 [1,0,0,0,0,0|2,0,0]=3 296 B8R1.2 N\N=c/1\cncc[nH]1 1P00394I [1,0,0,0,0,0|2,0,0]=3 297 B8R1.2 O=Cc1ccccn1 1P0033WE [1,0,0,0,0,0|2,0,0]=3 298 B8R1.2 O=Cc1cccnc1 1P00348S [1,0,0,0,0,0|0,0,0]=1 299 B8R1.2 O=Cc1cccnn1 1P00EGBR [1,0,0,0,0,0|1,0,0]=2 300 B8R1.2 O=Cc1ccncc1 1P0034LU [1,0,0,0,0,0|2,0,0]=3 301 B8R1.2 O=Cc1ccncc1 1P003MH5 [1,0,0,0,0,0|2,0,0]=3 302 B8R1.2 O=Cc1ccncn1 1P00360K [1,0,0,0,0,0|3,0,0]=4 303 B8R1.2 O=Cc1ccnnc1 1P0037UD [1,0,0,0,0,0|1,0,0]=2 304 B8R1.2 O=Cc1cnccn1 1P003937 [1,0,0,0,0,0|1,0,0]=2 305 B8R1.2 O=Cc1cncnc1 1P00034V [1,0,0,0,0,0|1,0,0]=2 306 B8R1.2 O=Cc1ncccn1 1P003A3I [1,0,0,0,0,0|3,0,0]=4 307 B8R1.2 O=Nc1ccccc1 1P003AHD [1,0,0,0,0,0|2,0,0]=3 308 B8R1.2 O=Nc1ccccn1 1P004ZQ7 [1,0,0,0,0,0|3,0,0]=4 309 B8R1.2 O=[As]c1ccccc1 1P003U68 [1,0,0,0,0,0|2,0,0]=3 310 B8R1.2 O=[I]c1ccccc1 1P0037R0 [1,0,0,0,0,0|2,0,0]=3 311 B8R1.2 OCc1ccccc1 1P0000MS [1,0,0,0,0,0|1,0,2]=4 312 B8R1.2 OCc1cccnc1 1P0000NZ [1,0,0,0,0,0|0,0,2]=3 313 B8R1.2 OCc1cccnn1 1P0037RV [1,0,0,0,0,0|1,0,2]=4 314 B8R1.2 OCc1ccnnc1 1P00DBTI [1,0,0,0,0,0|1,0,2]=4 315 B8R1.2 OCc1cnccn1 1P0033WD [1,0,0,0,0,0|1,0,2]=4 316 B8R1.2 OCc1cncnc1 1P002RAL [1,0,0,0,0,0|1,0,2]=4 317 B8R1.2 OCc1cncnc1 1P028QCV [1,0,0,0,0,0|1,0,2]=4 318 B8R1.2 ONc1ccccc1 1P0000NP [1,0,0,0,0,0|2,0,1]=4 319 B8R1.2 ONc1ccccc1 1P00G4MK [1,0,0,0,0,0|2,0,1]=4 320 B8R1.2 SCc1ccccc1 1P0000O1 [1,0,0,0,0,0|1,1,1]=4 321 B8R1.2 SCc1cccnc1 1P0024X6 [1,0,0,0,0,0|0,1,1]=3 322 B8R1.2 [C-]#[N+]c1ccccc1 1P006IKG [1,0,0,0,0,0|3,0,0]=4 323 B8R1.2 [Mg+]Cc1ccccc1 1P005L1K [1,0,0,0,0,0|2,0,1]=4 324 B8R1.2 c1ccnnc1C#N 1P00DDD9 [1,0,0,0,0,0|1,0,2]=4 325 B8R1.2 c1nccnc1C#N 1P002BZY [1,0,0,0,0,0|1,0,2]=4 326 B10R1.13 Brc1ccc(cc1)N(=O)=O 1P0034L5 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.13 Brc1ccc(cc1)S(=O)C 1P006325 [0,1,0,0,0,0|3,0,0]=4 328 B10R1.13 Brc1ccc(cc1)S(=O)O 1P000JDB [0,1,0,0,0,0|3,0,0]=4 329 B10R1.13 Brc1ccc(cc1)S(=O)[O-] 1P0021BJ [0,1,0,0,0,0|3,0,0]=4 330 B10R1.13 Brc1ccc(cc1)S(=O)[O-] 1P01BEXB [0,1,0,0,0,0|3,0,0]=4 331 B10R1.13 Brc1ccc(cn1)B(O)O 1P006Z7D [0,1,0,0,0,0|2,0,1]=4 332 B10R1.13 Brc1ccc(cn1)C(=C)C 1P01CAUD [0,1,0,0,0,0|2,0,0]=3 333 B10R1.13 Brc1ccc(cn1)C(=O)C 1P001AJL [0,1,0,0,0,0|1,0,0]=2 334 B10R1.13 Brc1ccc(cn1)C(=O)N 1P0089SG [0,1,0,0,0,0|0,0,0]=1 335 B10R1.13 Brc1ccc(cn1)C(=O)O 1P003NLL [0,1,0,0,0,0|1,0,0]=2 336 B10R1.13 Brc1ccc(cn1)C(C)C 1P01FSQM [0,1,0,0,0,0|2,0,1]=4 337 B10R1.13 Brc1ccc(cn1)C(F)F 1P0017A4 [0,1,0,0,0,0|2,0,1]=4 338 B10R1.13 Brc1ccc(cn1)C(O)C 1P00A6BK [0,1,0,0,0,0|1,0,2]=4 339 B10R1.13 Brc1ccc(cn1)N(C)C 1P00CLSE [0,1,0,0,0,0|3,0,0]=4 340 B10R1.13 Brc1ccc(cn1)[C@@H](N)C 1P00HGKC [0,1,0,0,0,0|1,0,1]=3 341 B10R1.13 Brc1ccc(cn1)[C@@H](O)C 1P028HPX [0,1,0,0,0,0|1,0,2]=4 342 B10R1.13 Brc1ccc(cn1)[C@H](N)C 1P01M0WP [0,1,0,0,0,0|1,0,1]=3 343 B10R1.13 Brc1ccc(cn1)[N+](=O)[O-] 1P003H70 [0,1,0,0,0,0|2,0,0]=3 344 B10R1.13 Brc1ccc(nc1)C(=N)N 1P0090FH [0,1,0,0,0,0|3,0,0]=4 345 B10R1.13 Brc1ccc(nc1)C(=O)C 1P0033JA [0,1,0,0,0,0|3,0,0]=4 346 B10R1.13 Brc1ccc(nc1)C(=O)C 1P01BH9H [0,1,0,0,0,0|3,0,0]=4 347 B10R1.13 Brc1ccc(nc1)C(=O)Cl 1P0013CR [0,1,0,0,0,0|3,0,0]=4 348 B10R1.13 Brc1ccc(nc1)C(=O)N 1P00GTTW [0,1,0,0,0,0|2,0,0]=3 349 B10R1.13 Brc1ccc(nc1)C(=O)O 1P0031O7 [0,1,0,0,0,0|3,0,0]=4 350 B10R1.13 Brc1ccc(nc1)C(=S)N 1P01FF2C [0,1,0,0,0,0|2,1,0]=4 351 B10R1.13 Brc1ncc(cn1)[N+](=O)[O-] 1P007PPY [0,1,0,0,0,0|3,0,0]=4 352 B10R1.13 CC(=C)c1ccc(cc1)Br 1P01DFHT [0,1,0,0,0,0|3,0,0]=4 353 B10R1.13 CC(=C)c1ccc(cc1)Cl 1P003LMX [0,1,0,0,0,0|3,0,0]=4 354 B10R1.13 CC(=C)c1ccc(cc1)F 1P003ESP [0,1,0,0,0,0|3,0,0]=4 355 B10R1.13 CC(=C)c1ccc(cc1)I 1P01DFI7 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.13 CC(=C)c1ccc(cc1)O 1P003U4X [0,1,0,0,0,0|3,0,0]=4 357 B10R1.13 CC(=O)c1c[nH]c(=O)cn1 1P000HQ8 [0,1,0,0,0,0|2,0,1]=4 358 B10R1.13 CC(=O)c1cc[n+](cc1)[O-] 1P00BCEM [0,1,0,0,0,0|3,0,0]=4 359 B10R1.13 CC(=O)c1ccc(cc1)Br 1P0034EQ [0,1,0,0,0,0|2,0,0]=3 360 B10R1.13 CC(=O)c1ccc(cc1)Cl 1P0034GF [0,1,0,0,0,0|2,0,0]=3 361 B10R1.13 CC(=O)c1ccc(cc1)F 1P0034HV [0,1,0,0,0,0|2,0,0]=3 362 B10R1.13 CC(=O)c1ccc(cc1)I 1P00150G [0,1,0,0,0,0|2,0,0]=3 363 B10R1.13 CC(=O)c1ccc(cc1)N 1P003L7C [0,1,0,0,0,0|2,0,0]=3 364 B10R1.13 CC(=O)c1ccc(cc1)N 1P003L7D [0,1,0,0,0,0|2,0,0]=3 365 B10R1.13 CC(=O)c1ccc(cc1)O 1P0034IP [0,1,0,0,0,0|2,0,0]=3 366 B10R1.13 CC(=O)c1ccc(cc1)S 1P00CAPQ [0,1,0,0,0,0|2,0,0]=3 367 B10R1.13 CC(=O)c1ccc(nn1)Cl 1P0039CR [0,1,0,0,0,0|2,0,0]=3 368 B10R1.13 CC(=O)c1ccc(nn1)O 1P01DU6D [0,1,0,0,0,0|2,0,0]=3 369 B10R1.13 CC(=O)c1cnc(cn1)Cl 1P001S9V [0,1,0,0,0,0|2,0,0]=3 370 B10R1.13 CC(=O)c1cnc(nc1)Cl 1P008UTP [0,1,0,0,0,0|2,0,0]=3 371 B10R1.13 CC(=O)c1cnc(nc1)N 1P000MJ6 [0,1,0,0,0,0|2,0,0]=3 372 B10R1.13 CC(c1ccc(cc1)Br)N 1P006WO1 [0,1,0,0,0,0|2,0,1]=4 373 B10R1.13 CC(c1ccc(cc1)Br)N 1P00IGF4 [0,1,0,0,0,0|2,0,1]=4 374 B10R1.13 CC(c1ccc(cc1)Cl)N 1P00DL24 [0,1,0,0,0,0|2,0,1]=4 375 B10R1.13 CC(c1ccc(cc1)Cl)N 1P00EAR0 [0,1,0,0,0,0|2,0,1]=4 376 B10R1.13 CC(c1ccc(cc1)F)N 1P003DGB [0,1,0,0,0,0|2,0,1]=4 377 B10R1.13 CC(c1ccc(cc1)F)N 1P00CMBL [0,1,0,0,0,0|2,0,1]=4 378 B10R1.13 CC(c1ccc(cc1)I)N 1P006KJJ [0,1,0,0,0,0|2,0,1]=4 379 B10R1.13 CC(c1ccc(cc1)O)N 1P009BNU [0,1,0,0,0,0|2,0,1]=4 380 B10R1.13 CC(c1ccc(cc1)O)N 1P00J27B [0,1,0,0,0,0|2,0,1]=4 381 B10R1.13 CC(c1cnc(cn1)Cl)N 1P01BDD6 [0,1,0,0,0,0|2,0,1]=4 382 B10R1.13 CC(c1cnc(cn1)Cl)N 1P0287OD [0,1,0,0,0,0|2,0,1]=4 383 B10R1.13 CC1=CCC(=CC1)C(=O)O 1P01DU9K [0,1,0,0,0,0|2,0,1]=4 384 B10R1.13 C[C@@H](c1ccc(cc1)Br)N 1P0038KT [0,1,0,0,0,0|2,0,1]=4 385 B10R1.13 C[C@@H](c1ccc(cc1)Br)N 1P00G42K [0,1,0,0,0,0|2,0,1]=4 386 B10R1.13 C[C@@H](c1ccc(cc1)Cl)N 1P003CZG [0,1,0,0,0,0|2,0,1]=4 387 B10R1.13 C[C@@H](c1ccc(cc1)Cl)N 1P00EJGP [0,1,0,0,0,0|2,0,1]=4 388 B10R1.13 C[C@@H](c1ccc(cc1)F)N 1P003CTR [0,1,0,0,0,0|2,0,1]=4 389 B10R1.13 C[C@@H](c1ccc(cc1)F)N 1P009CLZ [0,1,0,0,0,0|2,0,1]=4 390 B10R1.13 C[C@@H](c1ccc(cc1)I)N 1P00HSQG [0,1,0,0,0,0|2,0,1]=4 391 B10R1.13 C[C@@H](c1ccc(cc1)O)N 1P01X08H [0,1,0,0,0,0|2,0,1]=4 392 B10R1.13 C[C@H](c1ccc(cc1)Br)N 1P003CL3 [0,1,0,0,0,0|2,0,1]=4 393 B10R1.13 C[C@H](c1ccc(cc1)Br)N 1P003CNO [0,1,0,0,0,0|2,0,1]=4 394 B10R1.13 C[C@H](c1ccc(cc1)Cl)N 1P000DML [0,1,0,0,0,0|2,0,1]=4 395 B10R1.13 C[C@H](c1ccc(cc1)Cl)N 1P003CNP [0,1,0,0,0,0|2,0,1]=4 396 B10R1.13 C[C@H](c1ccc(cc1)F)N 1P003CNQ [0,1,0,0,0,0|2,0,1]=4 397 B10R1.13 C[C@H](c1ccc(cc1)F)N 1P00C70Z [0,1,0,0,0,0|2,0,1]=4 398 B10R1.13 C[C@H](c1ccc(cc1)I)N 1P000N1E [0,1,0,0,0,0|2,0,1]=4 399 B10R1.13 C[C@H](c1ccc(cc1)I)N 1P001MR0 [0,1,0,0,0,0|2,0,1]=4 400 B10R1.13 C[C@H](c1ccc(cc1)O)N 1P01DUO1 [0,1,0,0,0,0|2,0,1]=4 401 B10R1.13 Cc1ccc(cc1)C(=O)C 1P0034KH [0,1,0,0,0,0|2,0,0]=3 402 B10R1.13 Cc1ccc(cc1)C(N)C 1P0032ZG [0,1,0,0,0,0|2,0,1]=4 403 B10R1.13 Cc1ccc(cc1)S(=O)C 1P003EYO [0,1,0,0,0,0|3,0,0]=4 404 B10R1.13 Cc1ccc(cc1)S(=O)Cl 1P008Z3I [0,1,0,0,0,0|3,0,0]=4 405 B10R1.13 Cc1ccc(cc1)S(=O)N 1P0034KI [0,1,0,0,0,0|2,0,0]=3 406 B10R1.13 Cc1ccc(cc1)S(=O)O 1P001REW [0,1,0,0,0,0|3,0,0]=4 407 B10R1.13 Cc1ccc(cc1)S(=O)O 1P00IA0Y [0,1,0,0,0,0|3,0,0]=4 408 B10R1.13 Cc1ccc(cc1)S(=O)[O-] 1P001YJL [0,1,0,0,0,0|3,0,0]=4 409 B10R1.13 Cc1ccc(cc1)S(=O)[O-] 1P002JRA [0,1,0,0,0,0|3,0,0]=4 410 B10R1.13 Cc1ccc(cc1)S(=O)[O-] 1P00362L [0,1,0,0,0,0|3,0,0]=4 411 B10R1.13 Cc1ccc(cc1)S(=O)[O-] 1P003UUH [0,1,0,0,0,0|3,0,0]=4 412 B10R1.13 Cc1ccc(cc1)S(=O)[O-] 1P00FCR3 [0,1,0,0,0,0|3,0,0]=4 413 B10R1.13 Cc1ccc(cc1)[C@@H](N)C 1P003CTT [0,1,0,0,0,0|2,0,1]=4 414 B10R1.13 Cc1ccc(cc1)[C@@H](N)C 1P00G7UO [0,1,0,0,0,0|2,0,1]=4 415 B10R1.13 Cc1ccc(cc1)[C@H](N)C 1P0032V0 [0,1,0,0,0,0|2,0,1]=4 416 B10R1.13 Cc1ccc(cc1)[C@H](N)C 1P00CJ86 [0,1,0,0,0,0|2,0,1]=4 417 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] 1P0036PU [0,1,0,0,0,0|3,0,0]=4 418 B10R1.13 Cc1ccc(cc1)[S@@](=O)C 1P003CVR [0,1,0,0,0,0|3,0,0]=4 419 B10R1.13 Cc1ccc(cc1)[S@@](=O)N 1P002PL9 [0,1,0,0,0,0|2,0,0]=3 420 B10R1.13 Cc1ccc(cc1)[S@](=O)C 1P003CMM [0,1,0,0,0,0|3,0,0]=4 421 B10R1.13 Cc1ccc(cc1)[S@](=O)N 1P002HDM [0,1,0,0,0,0|2,0,0]=3 422 B10R1.13 Cc1ccc(cn1)B(O)O 1P003ICT [0,1,0,0,0,0|2,0,1]=4 423 B10R1.13 Cc1ccc(cn1)B(O)O 1P00IMZ9 [0,1,0,0,0,0|2,0,1]=4 424 B10R1.13 Cc1ccc(cn1)C(=O)C 1P007AKR [0,1,0,0,0,0|1,0,0]=2 425 B10R1.13 Cc1ccc(cn1)C(=O)N 1P005KIX [0,1,0,0,0,0|0,0,0]=1 426 B10R1.13 Cc1ccc(cn1)C(=O)O 1P007HIP [0,1,0,0,0,0|1,0,0]=2 427 B10R1.13 Cc1ccc(cn1)C(=S)N 1P00APZR [0,1,0,0,0,0|0,1,0]=2 428 B10R1.13 Cc1ccc(cn1)C(C)C 1P01ADK0 [0,1,0,0,0,0|2,0,1]=4 429 B10R1.13 Cc1ccc(cn1)C(N)C 1P006LP4 [0,1,0,0,0,0|1,0,1]=3 430 B10R1.13 Cc1ccc(cn1)C(O)C 1P0001NO [0,1,0,0,0,0|1,0,2]=4 431 B10R1.13 Cc1ccc(cn1)[C@@H](N)C 1P00BJS2 [0,1,0,0,0,0|1,0,1]=3 432 B10R1.13 Cc1ccc(cn1)[C@@H](N)C 1P024G2C [0,1,0,0,0,0|1,0,1]=3 433 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] 1P003I4H [0,1,0,0,0,0|2,0,0]=3 434 B10R1.13 Cc1ccc(nc1)C(=O)C 1P003GRQ [0,1,0,0,0,0|3,0,0]=4 435 B10R1.13 Cc1ccc(nc1)C(=O)C 1P00J2IE [0,1,0,0,0,0|3,0,0]=4 436 B10R1.13 Cc1ccc(nc1)C(=O)N 1P00C4PA [0,1,0,0,0,0|2,0,0]=3 437 B10R1.13 Cc1ccc(nc1)C(=O)O 1P0025QJ [0,1,0,0,0,0|3,0,0]=4 438 B10R1.13 Cc1ccc(nc1)C(=O)O 1P0038BJ [0,1,0,0,0,0|3,0,0]=4 439 B10R1.13 Cc1ccc(nn1)C(=N)N 1P00J347 [0,1,0,0,0,0|2,0,0]=3 440 B10R1.13 Cc1ccc(nn1)C(=O)C 1P00IH7X [0,1,0,0,0,0|2,0,0]=3 441 B10R1.13 Cc1ccc(nn1)C(=O)O 1P003NRM [0,1,0,0,0,0|2,0,0]=3 442 B10R1.13 Cc1cnc(cn1)C(=O)C 1P0038N6 [0,1,0,0,0,0|2,0,0]=3 443 B10R1.13 Cc1cnc(cn1)C(=O)N 1P00DCKF [0,1,0,0,0,0|1,0,0]=2 444 B10R1.13 Cc1cnc(cn1)C(=O)O 1P00IAB5 [0,1,0,0,0,0|2,0,0]=3 445 B10R1.13 Cc1cnc(cn1)C(N)C 1P027TQR [0,1,0,0,0,0|2,0,1]=4 446 B10R1.13 Cc1ncc(cn1)C(=O)C 1P0017TZ [0,1,0,0,0,0|2,0,0]=3 447 B10R1.13 Cc1ncc(cn1)C(N)C 1P01XD68 [0,1,0,0,0,0|2,0,1]=4 448 B10R1.13 ClC(=C)c1ccc(cc1)Br 1P01DWVX [0,1,0,0,0,0|3,0,0]=4 449 B10R1.13 ClC(=O)c1ccc(cc1)Br 1P00IAVO [0,1,0,0,0,0|2,0,0]=3 450 B10R1.13 ClC(=O)c1ccc(cc1)C 1P003606 [0,1,0,0,0,0|2,0,0]=3 451 B10R1.13 ClC(=O)c1ccc(cc1)F 1P003LVT [0,1,0,0,0,0|2,0,0]=3 452 B10R1.13 ClC(=O)c1ccc(cc1)I 1P007UPD [0,1,0,0,0,0|2,0,0]=3 453 B10R1.13 Clc1ccc(cc1)C(=O)Cl 1P003LNG [0,1,0,0,0,0|2,0,0]=3 454 B10R1.13 Clc1ccc(cc1)S(=O)C 1P00GS94 [0,1,0,0,0,0|3,0,0]=4 455 B10R1.13 Clc1ccc(cc1)S(=O)[O-] 1P001FFH [0,1,0,0,0,0|3,0,0]=4 456 B10R1.13 Clc1ccc(cc1)[N+](=O)[O-] 1P0000MR [0,1,0,0,0,0|3,0,0]=4 457 B10R1.13 Clc1ccc(cn1)B(O)O 1P0033QA [0,1,0,0,0,0|2,0,1]=4 458 B10R1.13 Clc1ccc(cn1)C(=C)C 1P00FCW7 [0,1,0,0,0,0|2,0,0]=3 459 B10R1.13 Clc1ccc(cn1)C(=N)N 1P0028DN [0,1,0,0,0,0|1,0,0]=2 460 B10R1.13 Clc1ccc(cn1)C(=O)C 1P0033OV [0,1,0,0,0,0|1,0,0]=2 461 B10R1.13 Clc1ccc(cn1)C(=O)Cl 1P00IAWT [0,1,0,0,0,0|1,0,0]=2 462 B10R1.13 Clc1ccc(cn1)C(=O)N 1P003NNG [0,1,0,0,0,0|0,0,0]=1 463 B10R1.13 Clc1ccc(cn1)C(=O)O 1P003NNH [0,1,0,0,0,0|1,0,0]=2 464 B10R1.13 Clc1ccc(cn1)C(=S)N 1P00I8BJ [0,1,0,0,0,0|0,1,0]=2 465 B10R1.13 Clc1ccc(cn1)C(Br)C 1P01BQIM [0,1,0,0,0,0|2,0,1]=4 466 B10R1.13 Clc1ccc(cn1)C(C)C 1P01A3BJ [0,1,0,0,0,0|2,0,1]=4 467 B10R1.13 Clc1ccc(cn1)C(Cl)Cl 1P005G92 [0,1,0,0,0,0|2,0,1]=4 468 B10R1.13 Clc1ccc(cn1)C(F)F 1P00FVMG [0,1,0,0,0,0|2,0,1]=4 469 B10R1.13 Clc1ccc(cn1)C(N)C 1P009XYF [0,1,0,0,0,0|1,0,1]=3 470 B10R1.13 Clc1ccc(cn1)C(O)C 1P00C3HJ [0,1,0,0,0,0|1,0,2]=4 471 B10R1.13 Clc1ccc(cn1)N(C)C 1P00CLS8 [0,1,0,0,0,0|3,0,0]=4 472 B10R1.13 Clc1ccc(cn1)S(=O)C 1P0288RX [0,1,0,0,0,0|2,0,0]=3 473 B10R1.13 Clc1ccc(cn1)S(=O)[O-] 1P01ELL8 [0,1,0,0,0,0|2,0,0]=3 474 B10R1.13 Clc1ccc(cn1)[C@@H](N)C 1P01KKL8 [0,1,0,0,0,0|1,0,1]=3 475 B10R1.13 Clc1ccc(cn1)[C@@H](N)C 1P01XGHO [0,1,0,0,0,0|1,0,1]=3 476 B10R1.13 Clc1ccc(cn1)[C@H](N)C 1P01DUQ4 [0,1,0,0,0,0|1,0,1]=3 477 B10R1.13 Clc1ccc(cn1)[C@H](N)C 1P01V2JD [0,1,0,0,0,0|1,0,1]=3 478 B10R1.13 Clc1ccc(cn1)[C@H](N)C 1P01XGHP [0,1,0,0,0,0|1,0,1]=3 479 B10R1.13 Clc1ccc(cn1)[N+](=O)[O-] 1P003HGA [0,1,0,0,0,0|2,0,0]=3 480 B10R1.13 Clc1ccc(nc1)C(=O)C 1P006R8V [0,1,0,0,0,0|3,0,0]=4 481 B10R1.13 Clc1ccc(nc1)C(=O)Cl 1P000Y7Z [0,1,0,0,0,0|3,0,0]=4 482 B10R1.13 Clc1ccc(nc1)C(=O)N 1P00CB78 [0,1,0,0,0,0|2,0,0]=3 483 B10R1.13 Clc1ccc(nc1)C(=O)O 1P003N5J [0,1,0,0,0,0|3,0,0]=4 484 B10R1.13 Clc1ccc(nc1)C(=S)N 1P01KKE4 [0,1,0,0,0,0|2,1,0]=4 485 B10R1.13 Clc1ccc(nn1)C(=O)Cl 1P00ECZE [0,1,0,0,0,0|2,0,0]=3 486 B10R1.13 Clc1cnc(cn1)C(=O)Cl 1P004C95 [0,1,0,0,0,0|2,0,0]=3 487 B10R1.13 Clc1ncc(cn1)C(=O)Cl 1P007EI2 [0,1,0,0,0,0|2,0,0]=3 488 B10R1.13 Clc1ncc(cn1)[N+](=O)[O-] 1P003HGB [0,1,0,0,0,0|3,0,0]=4 489 B10R1.13 FC(=C)c1ccc(cc1)Br 1P01DWIQ [0,1,0,0,0,0|3,0,0]=4 490 B10R1.13 FC(=O)c1ccc(cc1)Br 1P005U0R [0,1,0,0,0,0|2,0,0]=3 491 B10R1.13 FC(=O)c1ccc(cc1)I 1P0222K3 [0,1,0,0,0,0|2,0,0]=3 492 B10R1.13 Fc1ccc(cc1)C(=O)F 1P024VDD [0,1,0,0,0,0|2,0,0]=3 493 B10R1.13 Fc1ccc(cc1)N(=O)=O 1P0034I4 [0,1,0,0,0,0|3,0,0]=4 494 B10R1.13 Fc1ccc(cc1)S(=O)C 1P00FD2V [0,1,0,0,0,0|3,0,0]=4 495 B10R1.13 Fc1ccc(cc1)S(=O)[O-] 1P00G2X2 [0,1,0,0,0,0|3,0,0]=4 496 B10R1.13 Fc1ccc(cc1)[N+](=O)[O-] 1P0026NP [0,1,0,0,0,0|3,0,0]=4 497 B10R1.13 Fc1ccc(cn1)B(O)O 1P0033SK [0,1,0,0,0,0|2,0,1]=4 498 B10R1.13 Fc1ccc(cn1)C(=N)N 1P001HTF [0,1,0,0,0,0|1,0,0]=2 499 B10R1.13 Fc1ccc(cn1)C(=O)C 1P004Y7M [0,1,0,0,0,0|1,0,0]=2 500 B10R1.13 Fc1ccc(cn1)C(=O)Cl 1P00EAWJ [0,1,0,0,0,0|1,0,0]=2 501 B10R1.13 Fc1ccc(cn1)C(=O)F 1P01OHCH [0,1,0,0,0,0|1,0,0]=2 502 B10R1.13 Fc1ccc(cn1)C(=O)N 1P00CZQN [0,1,0,0,0,0|0,0,0]=1 503 B10R1.13 Fc1ccc(cn1)C(=O)O 1P003NOK [0,1,0,0,0,0|1,0,0]=2 504 B10R1.13 Fc1ccc(cn1)C(Br)C 1P01BYAE [0,1,0,0,0,0|2,0,1]=4 505 B10R1.13 Fc1ccc(cn1)C(C)C 1P00JXFK [0,1,0,0,0,0|2,0,1]=4 506 B10R1.13 Fc1ccc(cn1)C(N)C 1P01BSXW [0,1,0,0,0,0|1,0,1]=3 507 B10R1.13 Fc1ccc(cn1)C(O)C 1P0096DG [0,1,0,0,0,0|1,0,2]=4 508 B10R1.13 Fc1ccc(cn1)N(=O)=O 1P0033S3 [0,1,0,0,0,0|2,0,0]=3 509 B10R1.13 Fc1ccc(cn1)N(C)C 1P00I1QS [0,1,0,0,0,0|3,0,0]=4 510 B10R1.13 Fc1ccc(nc1)C(=N)N 1P000IKZ [0,1,0,0,0,0|3,0,0]=4 511 B10R1.13 Fc1ccc(nc1)C(=O)C 1P00GSNJ [0,1,0,0,0,0|3,0,0]=4 512 B10R1.13 Fc1ccc(nc1)C(=O)C 1P028O6Q [0,1,0,0,0,0|3,0,0]=4 513 B10R1.13 Fc1ccc(nc1)C(=O)Cl 1P00FI5J [0,1,0,0,0,0|3,0,0]=4 514 B10R1.13 Fc1ccc(nc1)C(=O)Cl 1P01C0I6 [0,1,0,0,0,0|3,0,0]=4 515 B10R1.13 Fc1ccc(nc1)C(=O)N 1P00DIFZ [0,1,0,0,0,0|2,0,0]=3 516 B10R1.13 Fc1ccc(nc1)C(=O)O 1P0034QI [0,1,0,0,0,0|3,0,0]=4 517 B10R1.13 Fc1ccc(nc1)C(=O)O 1P01A6GL [0,1,0,0,0,0|3,0,0]=4 518 B10R1.13 Fc1ccc(nc1)C(=S)N 1P01ACKI [0,1,0,0,0,0|2,1,0]=4 519 B10R1.13 Ic1ccc(cc1)[N+](=O)[O-] 1P00391K [0,1,0,0,0,0|3,0,0]=4 520 B10R1.13 Ic1ccc(cn1)C(=O)O 1P000V2T [0,1,0,0,0,0|1,0,0]=2 521 B10R1.13 Ic1ccc(cn1)[N+](=O)[O-] 1P003HXA [0,1,0,0,0,0|2,0,0]=3 522 B10R1.13 Ic1ccc(nc1)C(=O)O 1P00C9PY [0,1,0,0,0,0|3,0,0]=4 523 B10R1.13 NC(=N)c1ccc(cc1)Br 1P0034ES [0,1,0,0,0,0|2,0,0]=3 524 B10R1.13 NC(=N)c1ccc(cc1)Br 1P006ZLZ [0,1,0,0,0,0|2,0,0]=3 525 B10R1.13 NC(=N)c1ccc(cc1)C 1P00IBNC [0,1,0,0,0,0|2,0,0]=3 526 B10R1.13 NC(=N)c1ccc(cc1)Cl 1P001J9E [0,1,0,0,0,0|2,0,0]=3 527 B10R1.13 NC(=N)c1ccc(cc1)Cl 1P00AP7K [0,1,0,0,0,0|2,0,0]=3 528 B10R1.13 NC(=N)c1ccc(cc1)F 1P002NJF [0,1,0,0,0,0|2,0,0]=3 529 B10R1.13 NC(=N)c1ccc(cc1)F 1P00I8ZO [0,1,0,0,0,0|2,0,0]=3 530 B10R1.13 NC(=N)c1ccc(cc1)I 1P009GFR [0,1,0,0,0,0|2,0,0]=3 531 B10R1.13 NC(=N)c1ccc(cc1)O 1P0034IQ [0,1,0,0,0,0|2,0,0]=3 532 B10R1.13 NC(=O)c1c[nH]c(=O)cn1 1P00AK1F [0,1,0,0,0,0|1,0,1]=3 533 B10R1.13 NC(=O)c1cc[n+](cc1)[O-] 1P0079PZ [0,1,0,0,0,0|2,0,0]=3 534 B10R1.13 NC(=O)c1ccc(=O)[nH]n1 1P00F4KX [0,1,0,0,0,0|1,0,1]=3 535 B10R1.13 NC(=O)c1ccc(cc1)Br 1P00FARZ [0,1,0,0,0,0|1,0,0]=2 536 B10R1.13 NC(=O)c1ccc(cc1)C 1P003UHI [0,1,0,0,0,0|1,0,0]=2 537 B10R1.13 NC(=O)c1ccc(cc1)Cl 1P00IBEI [0,1,0,0,0,0|1,0,0]=2 538 B10R1.13 NC(=O)c1ccc(cc1)F 1P003LVJ [0,1,0,0,0,0|1,0,0]=2 539 B10R1.13 NC(=O)c1ccc(cc1)I 1P003M19 [0,1,0,0,0,0|1,0,0]=2 540 B10R1.13 NC(=O)c1ccc(cc1)O 1P0018KP [0,1,0,0,0,0|1,0,0]=2 541 B10R1.13 NC(=O)c1ccc(cc1)O 1P003LZM [0,1,0,0,0,0|1,0,0]=2 542 B10R1.13 NC(=O)c1ccc(cc1)S 1P01DWZC [0,1,0,0,0,0|1,0,0]=2 543 B10R1.13 NC(=O)c1ccc(nn1)Cl 1P00FB8Y [0,1,0,0,0,0|1,0,0]=2 544 B10R1.13 NC(=O)c1cnc(=O)[nH]c1 1P00HHP1 [0,1,0,0,0,0|1,0,0]=2 545 B10R1.13 NC(=O)c1cnc(cn1)Br 1P00CL5K [0,1,0,0,0,0|1,0,0]=2 546 B10R1.13 NC(=O)c1cnc(cn1)Cl 1P007RCN [0,1,0,0,0,0|1,0,0]=2 547 B10R1.13 NC(=O)c1cnc(nc1)Cl 1P00GMIS [0,1,0,0,0,0|1,0,0]=2 548 B10R1.13 NC(=O)c1ncc(cn1)Br 1P00C7CX [0,1,0,0,0,0|3,0,0]=4 549 B10R1.13 NC(=S)c1ccc(cc1)Br 1P002SP4 [0,1,0,0,0,0|1,1,0]=3 550 B10R1.13 NC(=S)c1ccc(cc1)C 1P002OEQ [0,1,0,0,0,0|1,1,0]=3 551 B10R1.13 NC(=S)c1ccc(cc1)Cl 1P002REP [0,1,0,0,0,0|1,1,0]=3 552 B10R1.13 NC(=S)c1ccc(cc1)F 1P00709Q [0,1,0,0,0,0|1,1,0]=3 553 B10R1.13 NC(=S)c1ccc(cc1)O 1P003M0N [0,1,0,0,0,0|1,1,0]=3 554 B10R1.13 N[13c]1[13cH][13cH][13c]([13cH][13cH]1)[N+](=O)[O-] 1P0201H6 [0,1,0,0,0,0|3,0,0]=4 555 B10R1.13 Nc1ccc(cc1)C(=N)N 1P002QJF [0,1,0,0,0,0|2,0,0]=3 556 B10R1.13 Nc1ccc(cc1)C(=N)N 1P005T2T [0,1,0,0,0,0|2,0,0]=3 557 B10R1.13 Nc1ccc(cc1)C(=O)N 1P003L7G [0,1,0,0,0,0|1,0,0]=2 558 B10R1.13 Nc1ccc(cc1)C(=S)N 1P003L8W [0,1,0,0,0,0|1,1,0]=3 559 B10R1.13 Nc1ccc(cc1)C(N)C 1P00GVQT [0,1,0,0,0,0|2,0,1]=4 560 B10R1.13 Nc1ccc(cc1)S(=O)C 1P00BI2O [0,1,0,0,0,0|3,0,0]=4 561 B10R1.13 Nc1ccc(cc1)[C@@H](N)C 1P00BH2Y [0,1,0,0,0,0|2,0,1]=4 562 B10R1.13 Nc1ccc(cc1)[C@@H](N)C 1P00FEPL [0,1,0,0,0,0|2,0,1]=4 563 B10R1.13 Nc1ccc(cc1)[C@H](N)C 1P000WVW [0,1,0,0,0,0|2,0,1]=4 564 B10R1.13 Nc1ccc(cc1)[C@H](N)C 1P00FCWH [0,1,0,0,0,0|2,0,1]=4 565 B10R1.13 Nc1ccc(cc1)[N+](=O)[O-] 1P001RAJ [0,1,0,0,0,0|3,0,0]=4 566 B10R1.13 Nc1ccc(cc1)[N+](=O)[O-] 1P0034KZ [0,1,0,0,0,0|3,0,0]=4 567 B10R1.13 Nc1ccc(cn1)B(O)O 1P000VQO [0,1,0,0,0,0|2,0,1]=4 568 B10R1.13 Nc1ccc(cn1)B(O)O 1P0036JZ [0,1,0,0,0,0|2,0,1]=4 569 B10R1.13 Nc1ccc(cn1)C(=N)N 1P027U01 [0,1,0,0,0,0|1,0,0]=2 570 B10R1.13 Nc1ccc(cn1)C(=O)C 1P002BVW [0,1,0,0,0,0|1,0,0]=2 571 B10R1.13 Nc1ccc(cn1)C(=O)N 1P003NJJ [0,1,0,0,0,0|0,0,0]=1 572 B10R1.13 Nc1ccc(cn1)C(=O)O 1P003NJP [0,1,0,0,0,0|1,0,0]=2 573 B10R1.13 Nc1ccc(cn1)C(=S)N 1P00DAQQ [0,1,0,0,0,0|0,1,0]=2 574 B10R1.13 Nc1ccc(cn1)C(C)C 1P00EDI5 [0,1,0,0,0,0|2,0,1]=4 575 B10R1.13 Nc1ccc(cn1)C(F)F 1P00HGEJ [0,1,0,0,0,0|2,0,1]=4 576 B10R1.13 Nc1ccc(cn1)N(C)C 1P0077CP [0,1,0,0,0,0|3,0,0]=4 577 B10R1.13 Nc1ccc(cn1)N(C)C 1P01B6SB [0,1,0,0,0,0|3,0,0]=4 578 B10R1.13 Nc1ccc(cn1)S(=O)C 1P01ANSF [0,1,0,0,0,0|2,0,0]=3 579 B10R1.13 Nc1ccc(cn1)[N+](=O)[O-] 1P003GYA [0,1,0,0,0,0|2,0,0]=3 580 B10R1.13 Nc1ccc(nc1)C(=O)C 1P00DIDZ [0,1,0,0,0,0|3,0,0]=4 581 B10R1.13 Nc1ccc(nc1)C(=O)N 1P001L6V [0,1,0,0,0,0|2,0,0]=3 582 B10R1.13 Nc1ccc(nc1)C(=O)O 1P0034NI [0,1,0,0,0,0|3,0,0]=4 583 B10R1.13 Nc1ccc(nc1)C(=O)O 1P005NVH [0,1,0,0,0,0|3,0,0]=4 584 B10R1.13 Nc1ccc(nc1)C(=S)N 1P007M9Z [0,1,0,0,0,0|2,1,0]=4 585 B10R1.13 Nc1ccc(nn1)C(=O)N 1P00IKH8 [0,1,0,0,0,0|1,0,0]=2 586 B10R1.13 Nc1ccc(nn1)C(=O)O 1P003NJO [0,1,0,0,0,0|2,0,0]=3 587 B10R1.13 Nc1cnc(cn1)C(=O)N 1P0040AP [0,1,0,0,0,0|1,0,0]=2 588 B10R1.13 Nc1cnc(cn1)C(=O)O 1P003MV9 [0,1,0,0,0,0|2,0,0]=3 589 B10R1.13 Nc1cnc(cn1)C(=S)N 1P028I49 [0,1,0,0,0,0|1,1,0]=3 590 B10R1.13 Nc1cnc(nc1)C(=O)N 1P003MVA [0,1,0,0,0,0|3,0,0]=4 591 B10R1.13 Nc1ncc(cn1)[N+](=O)[O-] 1P0031J3 [0,1,0,0,0,0|3,0,0]=4 592 B10R1.13 Nc1ncc(nn1)C(=O)O 1P01ELUV [0,1,0,0,0,0|3,0,0]=4 593 B10R1.13 O=C1CC=C(N=N1)C(=O)O 1P00IJD3 [0,1,0,0,0,0|2,0,1]=4 594 B10R1.13 O=[S-](=O)c1ccc(cc1)C 1P00E5RU [0,1,0,0,0,0|3,0,0]=4 595 B10R1.13 O=c1ccc(co1)C(=O)O 1P006X98 [0,1,0,0,0,0|2,0,0]=3 596 B10R1.13 OC(=O)c1c[nH]c(=O)cn1 1P005PT2 [0,1,0,0,0,0|2,0,1]=4 597 B10R1.13 OC(=O)c1cc[n+](cc1)[O-] 1P003UJ9 [0,1,0,0,0,0|3,0,0]=4 598 B10R1.13 OC(=O)c1ccc(=O)[nH]c1 1P003NPH [0,1,0,0,0,0|1,0,1]=3 599 B10R1.13 OC(=O)c1ccc(=S)[nH]c1 1P0024ZV [0,1,0,0,0,0|1,0,1]=3 600 B10R1.13 OC(=O)c1ccc(cc1)Br 1P0034ET [0,1,0,0,0,0|2,0,0]=3 601 B10R1.13 OC(=O)c1ccc(cc1)C 1P003MJ8 [0,1,0,0,0,0|2,0,0]=3 602 B10R1.13 OC(=O)c1ccc(cc1)Cl 1P003LNA [0,1,0,0,0,0|2,0,0]=3 603 B10R1.13 OC(=O)c1ccc(cc1)F 1P0034I1 [0,1,0,0,0,0|2,0,0]=3 604 B10R1.13 OC(=O)c1ccc(cc1)I 1P003M1C [0,1,0,0,0,0|2,0,0]=3 605 B10R1.13 OC(=O)c1ccc(cc1)N 1P0034D8 [0,1,0,0,0,0|2,0,0]=3 606 B10R1.13 OC(=O)c1ccc(cc1)N 1P00BC4F [0,1,0,0,0,0|2,0,0]=3 607 B10R1.13 OC(=O)c1ccc(cc1)S 1P0034JT [0,1,0,0,0,0|2,0,0]=3 608 B10R1.13 OC(=O)c1ccc(nn1)Br 1P00EGCW [0,1,0,0,0,0|2,0,0]=3 609 B10R1.13 OC(=O)c1ccc(nn1)Cl 1P0034TJ [0,1,0,0,0,0|2,0,0]=3 610 B10R1.13 OC(=O)c1cnc(cn1)Br 1P004M79 [0,1,0,0,0,0|2,0,0]=3 611 B10R1.13 OC(=O)c1cnc(cn1)Cl 1P003N5F [0,1,0,0,0,0|2,0,0]=3 612 B10R1.13 OC(=O)c1cnc(cn1)S 1P028V4X [0,1,0,0,0,0|2,0,0]=3 613 B10R1.13 OC(=O)c1cnc(nc1)Br 1P00HH7H [0,1,0,0,0,0|2,0,0]=3 614 B10R1.13 OC(=O)c1cnc(nc1)C 1P003I72 [0,1,0,0,0,0|2,0,0]=3 615 B10R1.13 OC(=O)c1cnc(nc1)Cl 1P00BZDR [0,1,0,0,0,0|2,0,0]=3 616 B10R1.13 OC(=O)c1cnc(nc1)N 1P0033L5 [0,1,0,0,0,0|2,0,0]=3 617 B10R1.13 OC(=O)c1cnc(nc1)S 1P028GK8 [0,1,0,0,0,0|2,0,0]=3 618 B10R1.13 Oc1ccc(cc1)C(=O)O 1P0034IR [0,1,0,0,0,0|2,0,0]=3 619 B10R1.13 Oc1ccc(cn1)B(O)O 1P0036CF [0,1,0,0,0,0|2,0,1]=4 620 B10R1.13 Oc1ccc(cn1)C(=O)C 1P008ZI1 [0,1,0,0,0,0|1,0,0]=2 621 B10R1.13 Oc1ccc(cn1)C(=O)N 1P00C74F [0,1,0,0,0,0|0,0,0]=1 622 B10R1.13 Oc1ccc(cn1)C(N)C 1P02882C [0,1,0,0,0,0|1,0,1]=3 623 B10R1.13 Oc1ccc(cn1)[C@@H](N)C 1P028N38 [0,1,0,0,0,0|1,0,1]=3 624 B10R1.13 Oc1ccc(cn1)[C@H](N)C 1P028LCQ [0,1,0,0,0,0|1,0,1]=3 625 B10R1.13 Oc1ccc(nc1)C(=O)C 1P00FGUG [0,1,0,0,0,0|3,0,0]=4 626 B10R1.13 Oc1ccc(nc1)C(=O)N 1P003WOP [0,1,0,0,0,0|2,0,0]=3 627 B10R1.13 Oc1ccc(nc1)C(=O)O 1P000PO9 [0,1,0,0,0,0|3,0,0]=4 628 B10R1.13 Oc1ccc(nc1)C(=O)O 1P001N9V [0,1,0,0,0,0|3,0,0]=4 629 B10R1.13 Oc1ccc(nc1)C(=O)O 1P01DLAX [0,1,0,0,0,0|3,0,0]=4 630 B10R1.13 Oc1ccc(nn1)C(=O)O 1P003NP6 [0,1,0,0,0,0|2,0,0]=3 631 B10R1.13 Oc1ccc(nn1)C(=O)O 1P003NP7 [0,1,0,0,0,0|2,0,0]=3 632 B10R1.13 Oc1ccc(nn1)C(=O)O 1P01D9LI [0,1,0,0,0,0|2,0,0]=3 633 B10R1.13 Oc1cnc(cn1)C(=O)O 1P00BZZO [0,1,0,0,0,0|2,0,0]=3 634 B10R1.13 Oc1ncc(cn1)C(=O)O 1P00BYY1 [0,1,0,0,0,0|2,0,0]=3 635 B10R1.13 Sc1ccc(cc1)[N+](=O)[O-] 1P003MDH [0,1,0,0,0,0|3,0,0]=4 636 B10R1.13 Sc1ccc(cn1)C(=O)O 1P003NPT [0,1,0,0,0,0|1,0,0]=2 637 B10R1.13 Sc1ccc(cn1)C(=S)N 1P028HNX [0,1,0,0,0,0|0,1,0]=2 638 B10R1.13 Sc1ccc(cn1)[N+](=O)[O-] 1P003HYT [0,1,0,0,0,0|2,0,0]=3 639 B10R1.13 Sc1ccc(nc1)C(=O)O 1P028GIB [0,1,0,0,0,0|3,0,0]=4 640 B10R1.13 [O-]C(=O)c1ccc(cc1)F 1P00DA0O [0,1,0,0,0,0|2,0,0]=3 641 B10R1.13 [O-]C(=O)c1ccc(cc1)N 1P00189I [0,1,0,0,0,0|2,0,0]=3 642 B10R1.13 [O-]C(=O)c1ccc(cc1)N 1P001LZJ [0,1,0,0,0,0|2,0,0]=3 643 B10R1.13 [O-]C(=O)c1ccc(cc1)N 1P003L7N [0,1,0,0,0,0|2,0,0]=3 644 B10R1.13 [O-]C(=O)c1ccc(cc1)O 1P000AQV [0,1,0,0,0,0|2,0,0]=3 645 B10R1.13 [O-]S(=O)c1ccc(nn1)C 1P02928F [0,1,0,0,0,0|3,0,0]=4 646 B10R1.13 [O-][N+](=O)c1ccc(=O)[nH]c1 1P003HVN [0,1,0,0,0,0|2,0,1]=4 647 B10R1.13 [O-][N+](=O)c1cnc(=O)[nH]c1 1P00C7DP [0,1,0,0,0,0|3,0,0]=4 648 B10R1.13 [O-][N+](=O)c1cnc(cn1)Br 1P000E7J [0,1,0,0,0,0|3,0,0]=4 649 B10R1.13 [O-][N+](=O)c1cnc(cn1)Cl 1P008CVZ [0,1,0,0,0,0|3,0,0]=4 650 B10R1.13 [O-]c1ccc(cc1)[N+](=O)[O-] 1P003MCD [0,1,0,0,0,0|3,0,0]=4 651 B10R1.15 BrCC(=C)c1ccccc1 1P00BYL9 [0,1,0,0,0,0|3,0,0]=4 652 B10R1.15 BrCC(=O)c1ccccc1 1P0033MP [0,1,0,0,0,0|2,0,0]=3 653 B10R1.15 BrCC(=O)c1ccccn1 1P0021LH [0,1,0,0,0,0|3,0,0]=4 654 B10R1.15 BrCC(=O)c1cccnc1 1P0025H6 [0,1,0,0,0,0|1,0,0]=2 655 B10R1.15 BrCC(=O)c1cccnc1 1P00EJUC [0,1,0,0,0,0|1,0,0]=2 656 B10R1.15 BrCC(=O)c1ccncc1 1P00DETO [0,1,0,0,0,0|3,0,0]=4 657 B10R1.15 BrCC(=O)c1cnccn1 1P000T5W [0,1,0,0,0,0|2,0,0]=3 658 B10R1.15 BrCC(=O)c1cnccn1 1P001152 [0,1,0,0,0,0|2,0,0]=3 659 B10R1.15 C#CC(=O)c1ccccc1 1P003F2Q [0,1,0,0,0,0|2,0,0]=3 660 B10R1.15 C=CC(=O)c1ccccc1 1P003A5I [0,1,0,0,0,0|2,0,0]=3 661 B10R1.15 C=CC(c1ccccc1)N 1P00IWY6 [0,1,0,0,0,0|2,0,1]=4 662 B10R1.15 C=CS(=O)c1ccccc1 1P0029ZV [0,1,0,0,0,0|3,0,0]=4 663 B10R1.15 C=C[C@@H](c1ccccc1)N 1P01KKJG [0,1,0,0,0,0|2,0,1]=4 664 B10R1.15 C=C[C@H](c1ccccc1)N 1P01KK9A [0,1,0,0,0,0|2,0,1]=4 665 B10R1.15 C=C[C@H](c1ccccc1)N 1P01KKHY [0,1,0,0,0,0|2,0,1]=4 666 B10R1.15 CC(=NN)c1cnccn1 1P019TJ6 [0,1,0,0,0,0|2,0,0]=3 667 B10R1.15 CC(=NO)c1cnccn1 1P023TQ9 [0,1,0,0,0,0|2,0,1]=4 668 B10R1.15 CC(c1cnccn1)CN 1P018SI7 [0,1,0,0,0,0|2,0,1]=4 669 B10R1.15 CC=C(c1ccccc1)C 1P002K1A [0,1,0,0,0,0|3,0,0]=4 670 B10R1.15 CCC(=C)c1ccccc1 1P0029NW [0,1,0,0,0,0|3,0,0]=4 671 B10R1.15 CCC(=O)c1ccccc1 1P003UGA [0,1,0,0,0,0|2,0,0]=3 672 B10R1.15 CCC(=O)c1ccccn1 1P0033WA [0,1,0,0,0,0|3,0,0]=4 673 B10R1.15 CCC(=O)c1cccnc1 1P003KCR [0,1,0,0,0,0|1,0,0]=2 674 B10R1.15 CCC(=O)c1ccncc1 1P003DKY [0,1,0,0,0,0|3,0,0]=4 675 B10R1.15 CCC(=O)c1ccncc1 1P028X9W [0,1,0,0,0,0|3,0,0]=4 676 B10R1.15 CCC(=O)c1ccnnc1 1P02219B [0,1,0,0,0,0|2,0,0]=3 677 B10R1.15 CCC(=O)c1cnccn1 1P00DLK1 [0,1,0,0,0,0|2,0,0]=3 678 B10R1.15 CCC(=O)c1cncnc1 1P01DX6H [0,1,0,0,0,0|2,0,0]=3 679 B10R1.15 CCC(c1ccccc1)N 1P003F3H [0,1,0,0,0,0|2,0,1]=4 680 B10R1.15 CCC(c1cccnc1)N 1P000K5S [0,1,0,0,0,0|1,0,1]=3 681 B10R1.15 CCC(c1cccnc1)N 1P003DEE [0,1,0,0,0,0|1,0,1]=3 682 B10R1.15 CC[C@@H](c1ccccc1)N 1P003BFK [0,1,0,0,0,0|2,0,1]=4 683 B10R1.15 CC[C@H](c1ccccc1)N 1P0032O5 [0,1,0,0,0,0|2,0,1]=4 684 B10R1.15 CN=C(c1cccnc1)N 1P01B70I [0,1,0,0,0,0|1,0,0]=2 685 B10R1.15 CNC(=N)c1ccccc1 1P01BBOA [0,1,0,0,0,0|2,0,0]=3 686 B10R1.15 CNC(=N)c1ccccn1 1P028I43 [0,1,0,0,0,0|3,0,0]=4 687 B10R1.15 CNC(=N)c1cccnc1 1P01B6ZK [0,1,0,0,0,0|1,0,0]=2 688 B10R1.15 CNC(=O)c1ccccc1 1P003TNT [0,1,0,0,0,0|1,0,0]=2 689 B10R1.15 CNC(=O)c1ccccn1 1P00EFMA [0,1,0,0,0,0|2,0,0]=3 690 B10R1.15 CNC(=O)c1cccnc1 1P000AQ4 [0,1,0,0,0,0|0,0,0]=1 691 B10R1.15 CNC(=O)c1ncccn1 1P028FT7 [0,1,0,0,0,0|3,0,0]=4 692 B10R1.15 CNC(=S)c1ccccc1 1P00E16P [0,1,0,0,0,0|1,1,0]=3 693 B10R1.15 CNC(c1ccccc1)C 1P0038T3 [0,1,0,0,0,0|2,0,1]=4 694 B10R1.15 CNC(c1ccccc1)C 1P00C63A [0,1,0,0,0,0|2,0,1]=4 695 B10R1.15 CNC(c1cccnc1)C 1P008VWL [0,1,0,0,0,0|1,0,1]=3 696 B10R1.15 CNC(c1cccnc1)C 1P00J3UA [0,1,0,0,0,0|1,0,1]=3 697 B10R1.15 CNC(c1cccnc1)C 1P019VP6 [0,1,0,0,0,0|1,0,1]=3 698 B10R1.15 CNC(c1ccnnc1)C 1P027UXS [0,1,0,0,0,0|2,0,1]=4 699 B10R1.15 CN[C@@H](c1ccccc1)C 1P003CMR [0,1,0,0,0,0|2,0,1]=4 700 B10R1.15 CN[C@@H](c1ccccc1)C 1P01FT1Y [0,1,0,0,0,0|2,0,1]=4 701 B10R1.15 CN[C@@H](c1cccnc1)C 1P01FKUY [0,1,0,0,0,0|1,0,1]=3 702 B10R1.15 CN[C@H](c1ccccc1)C 1P003CV3 [0,1,0,0,0,0|2,0,1]=4 703 B10R1.15 CN[C@H](c1ccccc1)C 1P028J6M [0,1,0,0,0,0|2,0,1]=4 704 B10R1.15 CN[C@H](c1cccnc1)C 1P01FKUX [0,1,0,0,0,0|1,0,1]=3 705 B10R1.15 COC(=N)c1ccccc1 1P003SG1 [0,1,0,0,0,0|1,0,2]=4 706 B10R1.15 COC(=O)c1ccccc1 1P00IHWQ [0,1,0,0,0,0|2,0,0]=3 707 B10R1.15 COC(=O)c1ccccn1 1P002P5B [0,1,0,0,0,0|3,0,0]=4 708 B10R1.15 COC(=O)c1cccnc1 1P003SI1 [0,1,0,0,0,0|1,0,0]=2 709 B10R1.15 COC(=O)c1cccnn1 1P00C82F [0,1,0,0,0,0|2,0,0]=3 710 B10R1.15 COC(=O)c1ccncc1 1P002P5A [0,1,0,0,0,0|3,0,0]=4 711 B10R1.15 COC(=O)c1ccnnc1 1P003SJ5 [0,1,0,0,0,0|2,0,0]=3 712 B10R1.15 COC(=O)c1cnccn1 1P003SJ3 [0,1,0,0,0,0|2,0,0]=3 713 B10R1.15 COC(=O)c1cnccn1 1P0287C0 [0,1,0,0,0,0|2,0,0]=3 714 B10R1.15 COC(=O)c1cncnc1 1P0036JN [0,1,0,0,0,0|2,0,0]=3 715 B10R1.15 COS(=O)c1ccccc1 1P0035P8 [0,1,0,0,0,0|3,0,0]=4 716 B10R1.15 CSC(=S)c1ccccc1 1P007PX1 [0,1,0,0,0,0|2,1,0]=4 717 B10R1.15 ClCC(=O)c1ccccn1 1P00DTRX [0,1,0,0,0,0|3,0,0]=4 718 B10R1.15 ClCC(=O)c1cccnc1 1P00E9NE [0,1,0,0,0,0|1,0,0]=2 719 B10R1.15 ClCC(=O)c1ccncc1 1P007OBO [0,1,0,0,0,0|3,0,0]=4 720 B10R1.15 ClCC(=O)c1cncnc1 1P01FIOC [0,1,0,0,0,0|2,0,0]=3 721 B10R1.15 ClCS(=O)c1ccccc1 1P003BRN [0,1,0,0,0,0|3,0,0]=4 722 B10R1.15 FCC(=O)c1ccccc1 1P00I8Y0 [0,1,0,0,0,0|2,0,0]=3 723 B10R1.15 FCC(=O)c1ccccn1 1P00GPM5 [0,1,0,0,0,0|3,0,0]=4 724 B10R1.15 FCC(c1ccccc1)N 1P01BHNS [0,1,0,0,0,0|2,0,1]=4 725 B10R1.15 FC[C@@H](c1ccccc1)N 1P01DFLZ [0,1,0,0,0,0|2,0,1]=4 726 B10R1.15 FC[C@H](c1ccccc1)N 1P019F2G [0,1,0,0,0,0|2,0,1]=4 727 B10R1.15 N#CC(=O)c1ccccc1 1P003OJN [0,1,0,0,0,0|1,0,1]=3 728 B10R1.15 N#CC(c1cccnc1)N 1P00A8FG [0,1,0,0,0,0|1,0,1]=3 729 B10R1.15 N#CC(c1cccnc1)N 1P0288HE [0,1,0,0,0,0|1,0,1]=3 730 B10R1.15 NC(=NO)c1cnccn1 1P019ZC4 [0,1,0,0,0,0|1,0,1]=3 731 B10R1.15 NC(c1ccccc1)C#C 1P01BGT7 [0,1,0,0,0,0|2,0,1]=4 732 B10R1.15 NC(c1ccccc1)C#N 1P00AMGH [0,1,0,0,0,0|2,0,1]=4 733 B10R1.15 NCC(=C)c1ccccc1 1P019VHO [0,1,0,0,0,0|2,0,0]=3 734 B10R1.15 NCC(=O)c1ccccc1 1P007ACW [0,1,0,0,0,0|1,0,0]=2 735 B10R1.15 NCC(=O)c1ccccc1 1P00IA8E [0,1,0,0,0,0|1,0,0]=2 736 B10R1.15 NCC(=O)c1ccccn1 1P00DIEH [0,1,0,0,0,0|2,0,0]=3 737 B10R1.15 NCC(=O)c1cccnc1 1P00DFSO [0,1,0,0,0,0|0,0,0]=1 738 B10R1.15 NCC(=O)c1ccncc1 1P00DIEI [0,1,0,0,0,0|2,0,0]=3 739 B10R1.15 NCC(=O)c1nccnc1 1P01EI7X [0,1,0,0,0,0|1,0,0]=2 740 B10R1.15 NCC(c1ccccc1)F 1P01ADJT [0,1,0,0,0,0|2,0,1]=4 741 B10R1.15 NCC(c1ccccc1)F 1P01AFLW [0,1,0,0,0,0|2,0,1]=4 742 B10R1.15 NCC(c1ccccc1)N 1P001X54 [0,1,0,0,0,0|2,0,1]=4 743 B10R1.15 NCC(c1ccccc1)N 1P00EC97 [0,1,0,0,0,0|2,0,1]=4 744 B10R1.15 NCC(c1ccccc1)O 1P003GT0 [0,1,0,0,0,0|1,0,2]=4 745 B10R1.15 NCC(c1cccnc1)O 1P006JYO [0,1,0,0,0,0|0,0,2]=3 746 B10R1.15 NCC(c1cccnc1)O 1P009SDI [0,1,0,0,0,0|0,0,2]=3 747 B10R1.15 NCC(c1cccnc1)O 1P00J1VN [0,1,0,0,0,0|0,0,2]=3 748 B10R1.15 NC[C@@H](c1ccccc1)C 1P003CRB [0,1,0,0,0,0|2,0,1]=4 749 B10R1.15 NC[C@@H](c1ccccc1)C 1P007LOY [0,1,0,0,0,0|2,0,1]=4 750 B10R1.15 NC[C@@H](c1ccccc1)O 1P003BFB [0,1,0,0,0,0|1,0,2]=4 751 B10R1.15 NC[C@@H](c1ccccc1)O 1P00AQ4Y [0,1,0,0,0,0|1,0,2]=4 752 B10R1.15 NC[C@@H](c1cccnc1)O 1P007FVE [0,1,0,0,0,0|0,0,2]=3 753 B10R1.15 NC[C@H](c1ccccc1)C 1P0021SD [0,1,0,0,0,0|2,0,1]=4 754 B10R1.15 NC[C@H](c1ccccc1)F 1P01ALUF [0,1,0,0,0,0|2,0,1]=4 755 B10R1.15 NC[C@H](c1ccccc1)O 1P003CUG [0,1,0,0,0,0|1,0,2]=4 756 B10R1.15 NC[C@H](c1cccnc1)O 1P001H7V [0,1,0,0,0,0|0,0,2]=3 757 B10R1.15 NN(c1ccccc1)C#N 1P01IE7X [0,1,0,0,0,0|3,0,0]=4 758 B10R1.15 NNC(=N)c1ccccc1 1P002X41 [0,1,0,0,0,0|2,0,0]=3 759 B10R1.15 NNC(=N)c1ccccn1 1P0002LX [0,1,0,0,0,0|3,0,0]=4 760 B10R1.15 NNC(=N)c1cccnc1 1P01AH0S [0,1,0,0,0,0|1,0,0]=2 761 B10R1.15 NNC(=N)c1cccnc1 1P01AH6T [0,1,0,0,0,0|1,0,0]=2 762 B10R1.15 NNC(=O)c1ccccc1 1P003OJR [0,1,0,0,0,0|1,0,0]=2 763 B10R1.15 NNC(=O)c1ccccn1 1P003BQA [0,1,0,0,0,0|2,0,0]=3 764 B10R1.15 NNC(=O)c1cccnc1 1P003TKF [0,1,0,0,0,0|0,0,0]=1 765 B10R1.15 NNC(=O)c1cccnn1 1P0044JE [0,1,0,0,0,0|1,0,0]=2 766 B10R1.15 NNC(=O)c1ccncc1 1P00IA3Q [0,1,0,0,0,0|2,0,0]=3 767 B10R1.15 NNC(=O)c1ccncn1 1P00BZCC [0,1,0,0,0,0|3,0,0]=4 768 B10R1.15 NNC(=O)c1cnccn1 1P00360C [0,1,0,0,0,0|1,0,0]=2 769 B10R1.15 NNC(=O)c1cncnc1 1P0074EG [0,1,0,0,0,0|1,0,0]=2 770 B10R1.15 NNC(=O)c1ncccn1 1P004OIM [0,1,0,0,0,0|3,0,0]=4 771 B10R1.15 NNC(=S)c1ccccc1 1P002AZ4 [0,1,0,0,0,0|1,1,0]=3 772 B10R1.15 NNC(c1ccccc1)C 1P00O2F0 [0,1,0,0,0,0|2,0,1]=4 773 B10R1.15 NOC(c1ccccc1)C 1P01BCFB [0,1,0,0,0,0|2,0,1]=4 774 B10R1.15 NOC(c1ccccc1)C 1P01BCKY [0,1,0,0,0,0|2,0,1]=4 775 B10R1.15 NO[C@@H](c1ccccc1)C 1P01FJN9 [0,1,0,0,0,0|2,0,1]=4 776 B10R1.15 NO[C@H](c1ccccc1)C 1P01B4DC [0,1,0,0,0,0|2,0,1]=4 777 B10R1.15 N[C@@H](c1ccccc1)C#C 1P028XYR [0,1,0,0,0,0|2,0,1]=4 778 B10R1.15 N[C@@H](c1ccccc1)C#N 1P003IC6 [0,1,0,0,0,0|2,0,1]=4 779 B10R1.15 N\C(=N/O)\c1cnccn1 1P00DEYE [0,1,0,0,0,0|1,0,1]=3 780 B10R1.15 O=CC(=O)c1ccccc1 1P0035XU [0,1,0,0,0,0|2,0,0]=3 781 B10R1.15 O=CC(=O)c1ccccc1 1P0035XV [0,1,0,0,0,0|2,0,0]=3 782 B10R1.15 O=CC(c1ccccc1)C 1P003BQ9 [0,1,0,0,0,0|2,0,1]=4 783 B10R1.15 O=CN(c1ccccc1)C 1P003TOE [0,1,0,0,0,0|3,0,0]=4 784 B10R1.15 O=NN(c1ccccc1)C 1P003TPQ [0,1,0,0,0,0|3,0,0]=4 785 B10R1.15 O=NN(c1ccccc1)[O-] 1P00IKYS [0,1,0,0,0,0|3,0,0]=4 786 B10R1.15 O=NN(c1ccccc1)[O-] 1P01DQLH [0,1,0,0,0,0|3,0,0]=4 787 B10R1.15 OCC(=C)c1ccccc1 1P0036LP [0,1,0,0,0,0|2,0,1]=4 788 B10R1.15 OCC(=C)c1cccnc1 1P024ZQ7 [0,1,0,0,0,0|1,0,1]=3 789 B10R1.15 OCC(=O)c1ccccc1 1P003HVU [0,1,0,0,0,0|2,0,0]=3 790 B10R1.15 OCC(=O)c1ccccn1 1P01DFA8 [0,1,0,0,0,0|3,0,0]=4 791 B10R1.15 OCC(=O)c1cccnc1 1P008Z6T [0,1,0,0,0,0|1,0,0]=2 792 B10R1.15 OCC(c1ccccc1)N 1P003Q9L [0,1,0,0,0,0|1,0,2]=4 793 B10R1.15 OCC(c1cccnc1)N 1P0092VK [0,1,0,0,0,0|0,0,2]=3 794 B10R1.15 OC[C@@H](c1ccccc1)N 1P0032U7 [0,1,0,0,0,0|1,0,2]=4 795 B10R1.15 OC[C@H](c1ccccc1)N 1P0032WQ [0,1,0,0,0,0|1,0,2]=4 796 B10R1.15 OC[C@H](c1ccccc1)N 1P01KLDI [0,1,0,0,0,0|1,0,2]=4 797 B10R1.15 OC[C@H](c1cccnc1)N 1P01X9M9 [0,1,0,0,0,0|0,0,2]=3 798 B10R1.15 ON=C(c1ccccc1)C 1P00DMUA [0,1,0,0,0,0|2,0,1]=4 799 B10R1.15 ON=C(c1ccccc1)Cl 1P01ACQ0 [0,1,0,0,0,0|2,0,1]=4 800 B10R1.15 ON=C(c1ccccc1)N 1P01BA34 [0,1,0,0,0,0|1,0,1]=3 801 B10R1.15 ON=C(c1cccnc1)Cl 1P01BDK9 [0,1,0,0,0,0|1,0,1]=3 802 B10R1.15 ON=C(c1ccncc1)N 1P001R50 [0,1,0,0,0,0|2,0,1]=4 803 B10R1.15 ONC(=N)c1ccccn1 1P0025MV [0,1,0,0,0,0|3,0,0]=4 804 B10R1.15 ONC(=N)c1cccnc1 1P001R4Z [0,1,0,0,0,0|1,0,0]=2 805 B10R1.15 ONC(=O)c1ccccc1 1P003OIX [0,1,0,0,0,0|1,0,0]=2 806 B10R1.15 ONC(c1ccccc1)C 1P002XUP [0,1,0,0,0,0|2,0,1]=4 807 B10R1.15 O\N=C(/c1cccnc1)\C 1P00EA84 [0,1,0,0,0,0|1,0,1]=3 808 B10R1.15 O\N=C(\c1ccccc1)/C 1P003O45 [0,1,0,0,0,0|2,0,1]=4 809 B10R1.15 O\N=C(\c1ccccc1)/Cl 1P00FAE8 [0,1,0,0,0,0|2,0,1]=4 810 B10R1.15 O\N=C(\c1ccccc1)/N 1P003OH7 [0,1,0,0,0,0|1,0,1]=3 811 B10R1.15 O\N=C(\c1ccccc1)/N 1P009A68 [0,1,0,0,0,0|1,0,1]=3 812 B10R1.15 O\N=C(\c1cccnc1)/N 1P018Z8W [0,1,0,0,0,0|0,0,1]=2 813 B10R1.15 SCC(=O)c1ccccc1 1P00BIBD [0,1,0,0,0,0|2,0,0]=3 814 B10R1.15 [O-]NC(=O)c1ccccc1 1P003OIY [0,1,0,0,0,0|1,0,0]=2 815 B10R1.15 [O-]NC(=O)c1ccccc1 1P00C19F [0,1,0,0,0,0|1,0,0]=2 816 B10R1.28 BrS(=O)(=O)c1ccccc1 1P002M7T [0,1,0,0,0,0|3,0,0]=4 817 B10R1.28 CC(c1ccccc1)(N)C 1P0036GZ [0,1,0,0,0,0|2,0,1]=4 818 B10R1.28 CC(c1cccnc1)(C)C 1P00D3UF [0,1,0,0,0,0|2,0,1]=4 819 B10R1.28 CC(c1cccnc1)(N)C 1P003FB2 [0,1,0,0,0,0|1,0,1]=3 820 B10R1.28 CC(c1cccnc1)(O)C 1P001MYP [0,1,0,0,0,0|1,0,2]=4 821 B10R1.28 CP(=O)(c1ccccc1)C 1P01PGUE [0,1,0,0,0,0|3,0,0]=4 822 B10R1.28 CP(=O)(c1ccccc1)Cl 1P003SKW [0,1,0,0,0,0|3,0,0]=4 823 B10R1.28 CP(=O)(c1cccnc1)C 1P028MT4 [0,1,0,0,0,0|2,0,0]=3 824 B10R1.28 CS(=O)(=N)c1ccccc1 1P00E023 [0,1,0,0,0,0|2,0,1]=4 825 B10R1.28 CS(=O)(=N)c1cccnc1 1P027RKY [0,1,0,0,0,0|1,0,1]=3 826 B10R1.28 CS(=O)(=O)c1ccccc1 1P0032MP [0,1,0,0,0,0|3,0,0]=4 827 B10R1.28 CS(=O)(=O)c1cccnc1 1P00DF3B [0,1,0,0,0,0|2,0,0]=3 828 B10R1.28 CS(=O)(=O)c1cncnc1 1P001D8K [0,1,0,0,0,0|3,0,0]=4 829 B10R1.28 C[S@@](=O)(=N)c1ccccc1 1P003CYS [0,1,0,0,0,0|2,0,1]=4 830 B10R1.28 C[Si](c1cccnc1)(C)C 1P001ZMX [0,1,0,0,0,0|2,1,0]=4 831 B10R1.28 ClP(=O)(c1ccccc1)Cl 1P0036VZ [0,1,0,0,0,0|3,0,0]=4 832 B10R1.28 ClS(=O)(=O)c1ccccc1 1P001UZA [0,1,0,0,0,0|3,0,0]=4 833 B10R1.28 ClS(=O)(=O)c1ccccc1 1P003OHS [0,1,0,0,0,0|3,0,0]=4 834 B10R1.28 ClS(=O)(=O)c1cccnc1 1P001SU3 [0,1,0,0,0,0|2,0,0]=3 835 B10R1.28 ClS(=O)(=O)c1cccnc1 1P00I8QH [0,1,0,0,0,0|2,0,0]=3 836 B10R1.28 FC(c1cccnc1)(Cl)F 1P019JX9 [0,1,0,0,0,0|2,0,1]=4 837 B10R1.28 FC(c1cccnc1)(F)F 1P003IRV [0,1,0,0,0,0|2,0,1]=4 838 B10R1.28 FS(=O)(=O)c1ccccc1 1P003OHV [0,1,0,0,0,0|3,0,0]=4 839 B10R1.28 FS(=O)(=O)c1cccnc1 1P01ACOP [0,1,0,0,0,0|2,0,0]=3 840 B10R1.28 FS(=O)(=O)c1cccnn1 1P01A3M3 [0,1,0,0,0,0|3,0,0]=4 841 B10R1.28 FS(=O)(=O)c1nccnc1 1P01C9P4 [0,1,0,0,0,0|3,0,0]=4 842 B10R1.28 F[B-](c1cccnc1)(F)F 1P00DABR [0,1,0,0,0,0|3,0,0]=4 843 B10R1.28 IS(=O)(=O)c1ccccc1 1P028OQQ [0,1,0,0,0,0|3,0,0]=4 844 B10R1.28 NP(=O)(c1ccccc1)N 1P00DT3N [0,1,0,0,0,0|2,0,0]=3 845 B10R1.28 NS(=O)(=N)c1cccnc1 1P028W98 [0,1,0,0,0,0|1,0,0]=2 846 B10R1.28 NS(=O)(=O)c1ccccc1 1P0034YD [0,1,0,0,0,0|2,0,0]=3 847 B10R1.28 NS(=O)(=O)c1ccccn1 1P003AKH [0,1,0,0,0,0|3,0,0]=4 848 B10R1.28 NS(=O)(=O)c1cccnc1 1P002Y8C [0,1,0,0,0,0|1,0,0]=2 849 B10R1.28 NS(=O)(=O)c1cccnn1 1P01C38V [0,1,0,0,0,0|2,0,0]=3 850 B10R1.28 NS(=O)(=O)c1ccncc1 1P00FGYZ [0,1,0,0,0,0|3,0,0]=4 851 B10R1.28 NS(=O)(=O)c1cncnc1 1P005UIF [0,1,0,0,0,0|2,0,0]=3 852 B10R1.28 NS(=O)(=O)c1nccnc1 1P01A04C [0,1,0,0,0,0|2,0,0]=3 853 B10R1.28 O=S(C1=CC=CC=C1)(N)=N 1P01K4LQ [0,1,0,0,0,0|2,0,0]=3 854 B10R1.28 OP(=O)(c1ccccc1)O 1P001POC [0,1,0,0,0,0|3,0,0]=4 855 B10R1.28 OS(=O)(=O)c1ccccc1 1P002SCX [0,1,0,0,0,0|3,0,0]=4 856 B10R1.28 OS(=O)(=O)c1ccccc1 1P003OHO [0,1,0,0,0,0|3,0,0]=4 857 B10R1.28 OS(=O)(=O)c1ccccc1 1P003OHP [0,1,0,0,0,0|3,0,0]=4 858 B10R1.28 OS(=O)(=O)c1ccccc1 1P00756N [0,1,0,0,0,0|3,0,0]=4 859 B10R1.28 OS(=O)(=O)c1cccnc1 1P00348T [0,1,0,0,0,0|2,0,0]=3 860 B10R1.28 [O-]P(=O)(c1ccccc1)[O-] 1P002R3V [0,1,0,0,0,0|3,0,0]=4 861 B10R1.28 [O-]S(=O)(=O)c1ccccc1 1P0035VA [0,1,0,0,0,0|3,0,0]=4 862 B10R1.28 [O-]S(=O)(=O)c1ccccc1 1P003OHQ [0,1,0,0,0,0|3,0,0]=4 863 B10R1.28 [O-]S(=O)(=O)c1cccnc1 1P001O78 [0,1,0,0,0,0|2,0,0]=3 864 B10R1.28 [O-]S(=S)(=O)c1ccccc1 1P002HMU [0,1,0,0,0,0|3,0,0]=4 865 B10R1.61 CC(=C)c1ccccc1Br 1P005H4B [0,1,0,0,0,0|3,0,0]=4 866 B10R1.61 CC(=C)c1ccccc1F 1P01ACS1 [0,1,0,0,0,0|3,0,0]=4 867 B10R1.61 CC(=C)c1ccccc1I 1P01GLJL [0,1,0,0,0,0|3,0,0]=4 868 B10R1.61 CC(=C)c1ccccc1N 1P00DF51 [0,1,0,0,0,0|3,0,0]=4 869 B10R1.61 CC(=O)c1c[nH]ccc1=O 1P00CYEH [0,1,0,0,0,0|1,0,1]=3 870 B10R1.61 CC(=O)c1ccc[nH]c1=O 1P00EG1P [0,1,0,0,0,0|1,0,1]=3 871 B10R1.61 CC(=O)c1ccccc1Br 1P00I4LL [0,1,0,0,0,0|2,0,0]=3 872 B10R1.61 CC(=O)c1ccccc1C 1P003I51 [0,1,0,0,0,0|2,0,0]=3 873 B10R1.61 CC(=O)c1ccccc1Cl 1P0033J6 [0,1,0,0,0,0|2,0,0]=3 874 B10R1.61 CC(=O)c1ccccc1F 1P003GQQ [0,1,0,0,0,0|2,0,0]=3 875 B10R1.61 CC(=O)c1ccccc1I 1P0033TR [0,1,0,0,0,0|2,0,0]=3 876 B10R1.61 CC(=O)c1ccccc1N 1P0033KO [0,1,0,0,0,0|2,0,0]=3 877 B10R1.61 CC(=O)c1ccccc1N 1P003GQI [0,1,0,0,0,0|2,0,0]=3 878 B10R1.61 CC(=O)c1ccccc1O 1P0033TC [0,1,0,0,0,0|2,0,0]=3 879 B10R1.61 CC(=O)c1ccccc1S 1P00BFT3 [0,1,0,0,0,0|2,0,0]=3 880 B10R1.61 CC(=O)c1cccnc1Br 1P004PFL [0,1,0,0,0,0|1,0,0]=2 881 B10R1.61 CC(=O)c1cccnc1C 1P00APS4 [0,1,0,0,0,0|1,0,0]=2 882 B10R1.61 CC(=O)c1cccnc1Cl 1P003413 [0,1,0,0,0,0|1,0,0]=2 883 B10R1.61 CC(=O)c1cccnc1F 1P0058LW [0,1,0,0,0,0|1,0,0]=2 884 B10R1.61 CC(=O)c1cccnc1N 1P003DA0 [0,1,0,0,0,0|1,0,0]=2 885 B10R1.61 CC(=O)c1ccncc1Br 1P007C19 [0,1,0,0,0,0|3,0,0]=4 886 B10R1.61 CC(=O)c1ccncc1C 1P00G65L [0,1,0,0,0,0|3,0,0]=4 887 B10R1.61 CC(=O)c1ccncc1Cl 1P005PZQ [0,1,0,0,0,0|3,0,0]=4 888 B10R1.61 CC(=O)c1ccncc1F 1P003L35 [0,1,0,0,0,0|3,0,0]=4 889 B10R1.61 CC(=O)c1ccncc1N 1P0010P1 [0,1,0,0,0,0|3,0,0]=4 890 B10R1.61 CC(=O)c1ccncc1N 1P008V9A [0,1,0,0,0,0|3,0,0]=4 891 B10R1.61 CC(=O)c1ccncc1O 1P00BFML [0,1,0,0,0,0|3,0,0]=4 892 B10R1.61 CC(=O)c1cnccc1C 1P00DIDY [0,1,0,0,0,0|1,0,0]=2 893 B10R1.61 CC(=O)c1cnccc1Cl 1P01JV6G [0,1,0,0,0,0|1,0,0]=2 894 B10R1.61 CC(=O)c1cnccc1N 1P019U55 [0,1,0,0,0,0|1,0,0]=2 895 B10R1.61 CC(=O)c1cnccc1N 1P0280Q1 [0,1,0,0,0,0|1,0,0]=2 896 B10R1.61 CC(=O)c1cncnc1C 1P01AGIT [0,1,0,0,0,0|2,0,0]=3 897 B10R1.61 CC(=O)c1cncnc1N 1P01KKRL [0,1,0,0,0,0|2,0,0]=3 898 B10R1.61 CC(=O)c1ncccc1Br 1P0083FB [0,1,0,0,0,0|3,0,0]=4 899 B10R1.61 CC(=O)c1ncccc1C 1P003GRM [0,1,0,0,0,0|3,0,0]=4 900 B10R1.61 CC(=O)c1ncccc1Cl 1P0073R0 [0,1,0,0,0,0|3,0,0]=4 901 B10R1.61 CC(=O)c1ncccc1F 1P0036MY [0,1,0,0,0,0|3,0,0]=4 902 B10R1.61 CC(=O)c1ncccc1N 1P0010P6 [0,1,0,0,0,0|3,0,0]=4 903 B10R1.61 CC(=O)c1ncccc1O 1P0010P5 [0,1,0,0,0,0|3,0,0]=4 904 B10R1.61 CC(=O)c1nccnc1C 1P0033J9 [0,1,0,0,0,0|2,0,0]=3 905 B10R1.61 CC(=O)c1nccnc1Cl 1P009X3P [0,1,0,0,0,0|2,0,0]=3 906 B10R1.61 CC(c1ccc[nH]c1=O)N 1P01XCEB [0,1,0,0,0,0|1,0,2]=4 907 B10R1.61 CC(c1ccccc1Br)N 1P000AHK [0,1,0,0,0,0|2,0,1]=4 908 B10R1.61 CC(c1ccccc1Br)N 1P0092T3 [0,1,0,0,0,0|2,0,1]=4 909 B10R1.61 CC(c1ccccc1C)N 1P003DBW [0,1,0,0,0,0|2,0,1]=4 910 B10R1.61 CC(c1ccccc1C)N 1P003DBX [0,1,0,0,0,0|2,0,1]=4 911 B10R1.61 CC(c1ccccc1Cl)N 1P003DAL [0,1,0,0,0,0|2,0,1]=4 912 B10R1.61 CC(c1ccccc1Cl)N 1P004TXJ [0,1,0,0,0,0|2,0,1]=4 913 B10R1.61 CC(c1ccccc1F)N 1P0059PI [0,1,0,0,0,0|2,0,1]=4 914 B10R1.61 CC(c1ccccc1N)N 1P01A3PI [0,1,0,0,0,0|2,0,1]=4 915 B10R1.61 CC(c1ccccc1O)N 1P00H1GO [0,1,0,0,0,0|2,0,1]=4 916 B10R1.61 CC(c1cccnc1Br)Br 1P01BQIP [0,1,0,0,0,0|2,0,1]=4 917 B10R1.61 CC(c1cccnc1Br)C 1P01FPCO [0,1,0,0,0,0|2,0,1]=4 918 B10R1.61 CC(c1cccnc1C)N 1P00H2TM [0,1,0,0,0,0|1,0,1]=3 919 B10R1.61 CC(c1cccnc1C)N 1P028K8Y [0,1,0,0,0,0|1,0,1]=3 920 B10R1.61 CC(c1cccnc1C)O 1P01B7I5 [0,1,0,0,0,0|1,0,2]=4 921 B10R1.61 CC(c1cccnc1Cl)O 1P00100N [0,1,0,0,0,0|1,0,2]=4 922 B10R1.61 CC(c1cccnc1F)N 1P01UNGB [0,1,0,0,0,0|1,0,1]=3 923 B10R1.61 CC(c1cccnc1F)O 1P00GB0N [0,1,0,0,0,0|1,0,2]=4 924 B10R1.61 CC(c1cccnc1N)C 1P00ILHF [0,1,0,0,0,0|2,0,1]=4 925 B10R1.61 CC(c1cccnc1N)N 1P0174Q9 [0,1,0,0,0,0|1,0,1]=3 926 B10R1.61 CC(c1cccnc1N)N 1P027TVU [0,1,0,0,0,0|1,0,1]=3 927 B10R1.61 CC(c1cnccc1C)N 1P01A4NT [0,1,0,0,0,0|1,0,1]=3 928 B10R1.61 CC(c1cnccc1C)O 1P009SOU [0,1,0,0,0,0|1,0,2]=4 929 B10R1.61 CC(c1cnccc1N)C 1P00IGI9 [0,1,0,0,0,0|2,0,1]=4 930 B10R1.61 CC(c1cnccc1O)C 1P01DZ0R [0,1,0,0,0,0|2,0,1]=4 931 B10R1.61 CC(c1cnccc1O)N 1P028OZO [0,1,0,0,0,0|1,0,1]=3 932 B10R1.61 CC(c1nccnc1C)N 1P01BSMC [0,1,0,0,0,0|2,0,1]=4 933 B10R1.61 CC(c1nccnc1Cl)N 1P02235G [0,1,0,0,0,0|2,0,1]=4 934 B10R1.61 CN(c1cccnc1N)C 1P01A7DQ [0,1,0,0,0,0|3,0,0]=4 935 B10R1.61 CN(c1cnccc1N)C 1P01A6MO [0,1,0,0,0,0|3,0,0]=4 936 B10R1.61 CN(c1cnccc1N)C 1P02859L [0,1,0,0,0,0|3,0,0]=4 937 B10R1.61 CS(=O)c1ccccc1Br 1P00ICU5 [0,1,0,0,0,0|3,0,0]=4 938 B10R1.61 CS(=O)c1ccccc1N 1P019WQG [0,1,0,0,0,0|3,0,0]=4 939 B10R1.61 CS(=O)c1ccccc1O 1P008565 [0,1,0,0,0,0|3,0,0]=4 940 B10R1.61 C[C@@H](c1ccccc1Br)N 1P001D2B [0,1,0,0,0,0|2,0,1]=4 941 B10R1.61 C[C@@H](c1ccccc1Br)N 1P008ZLH [0,1,0,0,0,0|2,0,1]=4 942 B10R1.61 C[C@@H](c1ccccc1C)N 1P0014ZZ [0,1,0,0,0,0|2,0,1]=4 943 B10R1.61 C[C@@H](c1ccccc1C)N 1P00G60I [0,1,0,0,0,0|2,0,1]=4 944 B10R1.61 C[C@@H](c1ccccc1Cl)N 1P005LCN [0,1,0,0,0,0|2,0,1]=4 945 B10R1.61 C[C@@H](c1ccccc1Cl)N 1P009ZP2 [0,1,0,0,0,0|2,0,1]=4 946 B10R1.61 C[C@@H](c1ccccc1F)N 1P001501 [0,1,0,0,0,0|2,0,1]=4 947 B10R1.61 C[C@@H](c1ccccc1F)N 1P006CBN [0,1,0,0,0,0|2,0,1]=4 948 B10R1.61 C[C@@H](c1ccccc1O)N 1P007NTC [0,1,0,0,0,0|2,0,1]=4 949 B10R1.61 C[C@@H](c1ccccc1O)N 1P024HV8 [0,1,0,0,0,0|2,0,1]=4 950 B10R1.61 C[C@@H](c1cccnc1C)N 1P028OLA [0,1,0,0,0,0|1,0,1]=3 951 B10R1.61 C[C@@H](c1cccnc1F)N 1P028EX4 [0,1,0,0,0,0|1,0,1]=3 952 B10R1.61 C[C@@H](c1cccnc1F)O 1P0288J7 [0,1,0,0,0,0|1,0,2]=4 953 B10R1.61 C[C@@H](c1cnccc1Cl)O 1P024ZGG [0,1,0,0,0,0|1,0,2]=4 954 B10R1.61 C[C@@H](c1nccnc1C)N 1P01FJTG [0,1,0,0,0,0|2,0,1]=4 955 B10R1.61 C[C@H](c1ccccc1Br)N 1P000AOU [0,1,0,0,0,0|2,0,1]=4 956 B10R1.61 C[C@H](c1ccccc1Br)N 1P0092RK [0,1,0,0,0,0|2,0,1]=4 957 B10R1.61 C[C@H](c1ccccc1C)N 1P008HMX [0,1,0,0,0,0|2,0,1]=4 958 B10R1.61 C[C@H](c1ccccc1C)N 1P008Y12 [0,1,0,0,0,0|2,0,1]=4 959 B10R1.61 C[C@H](c1ccccc1Cl)N 1P000DMI [0,1,0,0,0,0|2,0,1]=4 960 B10R1.61 C[C@H](c1ccccc1Cl)N 1P000XTH [0,1,0,0,0,0|2,0,1]=4 961 B10R1.61 C[C@H](c1ccccc1F)N 1P000DPW [0,1,0,0,0,0|2,0,1]=4 962 B10R1.61 C[C@H](c1ccccc1F)N 1P007790 [0,1,0,0,0,0|2,0,1]=4 963 B10R1.61 C[C@H](c1ccccc1O)N 1P000LS1 [0,1,0,0,0,0|2,0,1]=4 964 B10R1.61 C[C@H](c1ccccc1O)N 1P01BTZ7 [0,1,0,0,0,0|2,0,1]=4 965 B10R1.61 C[C@H](c1cccnc1F)N 1P028EHU [0,1,0,0,0,0|1,0,1]=3 966 B10R1.61 C[C@H](c1cccnc1F)O 1P024V0A [0,1,0,0,0,0|1,0,2]=4 967 B10R1.61 C[C@H](c1cnccc1Cl)O 1P028JWR [0,1,0,0,0,0|1,0,2]=4 968 B10R1.61 C[C@H](c1cncnc1C)N 1P01BE0I [0,1,0,0,0,0|2,0,1]=4 969 B10R1.61 C[C@H](c1nccnc1C)N 1P01FJTH [0,1,0,0,0,0|2,0,1]=4 970 B10R1.61 ClC(=O)c1ccccc1Br 1P003H8A [0,1,0,0,0,0|2,0,0]=3 971 B10R1.61 ClC(=O)c1ccccc1C 1P003TYW [0,1,0,0,0,0|2,0,0]=3 972 B10R1.61 ClC(=O)c1ccccc1Cl 1P003HII [0,1,0,0,0,0|2,0,0]=3 973 B10R1.61 ClC(=O)c1ccccc1F 1P003HSA [0,1,0,0,0,0|2,0,0]=3 974 B10R1.61 ClC(=O)c1ccccc1I 1P003HXI [0,1,0,0,0,0|2,0,0]=3 975 B10R1.61 ClC(=O)c1cccnc1Cl 1P00I9BS [0,1,0,0,0,0|1,0,0]=2 976 B10R1.61 ClC(=O)c1cccnc1F 1P000QAE [0,1,0,0,0,0|1,0,0]=2 977 B10R1.61 ClC(=O)c1ccncc1Br 1P01C2FU [0,1,0,0,0,0|3,0,0]=4 978 B10R1.61 ClC(=O)c1cncnc1Cl 1P01DZ34 [0,1,0,0,0,0|2,0,0]=3 979 B10R1.61 ClS(=O)c1ccccc1Cl 1P01DZLM [0,1,0,0,0,0|3,0,0]=4 980 B10R1.61 ClS(=O)c1ccccc1F 1P01BRL7 [0,1,0,0,0,0|3,0,0]=4 981 B10R1.61 FC(=O)c1ccccc1F 1P01XIN5 [0,1,0,0,0,0|2,0,0]=3 982 B10R1.61 FC(c1cccnc1Br)F 1P0090T7 [0,1,0,0,0,0|2,0,1]=4 983 B10R1.61 FC(c1cccnc1Cl)F 1P00IEL6 [0,1,0,0,0,0|2,0,1]=4 984 B10R1.61 FC(c1cccnc1F)F 1P019D9D [0,1,0,0,0,0|2,0,1]=4 985 B10R1.61 FC(c1cccnc1N)F 1P00IF9W [0,1,0,0,0,0|2,0,1]=4 986 B10R1.61 FC(c1cnccc1Cl)F 1P024ZHA [0,1,0,0,0,0|2,0,1]=4 987 B10R1.61 NC(=N)c1ccccc1Br 1P00EGII [0,1,0,0,0,0|2,0,0]=3 988 B10R1.61 NC(=N)c1ccccc1C 1P003I59 [0,1,0,0,0,0|2,0,0]=3 989 B10R1.61 NC(=N)c1ccccc1Cl 1P003HI9 [0,1,0,0,0,0|2,0,0]=3 990 B10R1.61 NC(=N)c1ccccc1Cl 1P00D8UO [0,1,0,0,0,0|2,0,0]=3 991 B10R1.61 NC(=N)c1ccccc1F 1P00E9F1 [0,1,0,0,0,0|2,0,0]=3 992 B10R1.61 NC(=N)c1ccccc1F 1P00FGXY [0,1,0,0,0,0|2,0,0]=3 993 B10R1.61 NC(=N)c1ccccc1F 1P01C65V [0,1,0,0,0,0|2,0,0]=3 994 B10R1.61 NC(=N)c1ccccc1F 1P02841W [0,1,0,0,0,0|2,0,0]=3 995 B10R1.61 NC(=N)c1ccccc1O 1P00DK4F [0,1,0,0,0,0|2,0,0]=3 996 B10R1.61 NC(=N)c1ncccc1Br 1P0090E6 [0,1,0,0,0,0|3,0,0]=4 997 B10R1.61 NC(=N)c1ncccc1C 1P000PEE [0,1,0,0,0,0|3,0,0]=4 998 B10R1.61 NC(=N)c1ncccc1Cl 1P0090DX [0,1,0,0,0,0|3,0,0]=4 999 B10R1.61 NC(=O)c1ccccc1Br 1P00BXYL [0,1,0,0,0,0|1,0,0]=2 1000 B10R1.61 NC(=O)c1ccccc1C 1P003I57 [0,1,0,0,0,0|1,0,0]=2 1001 B10R1.61 NC(=O)c1ccccc1Cl 1P003HI8 [0,1,0,0,0,0|1,0,0]=2 1002 B10R1.61 NC(=O)c1ccccc1F 1P003HS3 [0,1,0,0,0,0|1,0,0]=2 1003 B10R1.61 NC(=O)c1ccccc1I 1P00C7AR [0,1,0,0,0,0|1,0,0]=2 1004 B10R1.61 NC(=O)c1ccccc1N 1P003GZT [0,1,0,0,0,0|1,0,0]=2 1005 B10R1.61 NC(=O)c1ccccc1O 1P003UNA [0,1,0,0,0,0|1,0,0]=2 1006 B10R1.61 NC(=O)c1ccccc1S 1P01AHBV [0,1,0,0,0,0|1,0,0]=2 1007 B10R1.61 NC(=O)c1cccnc1Br 1P004KW5 [0,1,0,0,0,0|0,0,0]=1 1008 B10R1.61 NC(=O)c1cccnc1C 1P0036DJ [0,1,0,0,0,0|0,0,0]=1 1009 B10R1.61 NC(=O)c1cccnc1Cl 1P003HJJ [0,1,0,0,0,0|0,0,0]=1 1010 B10R1.61 NC(=O)c1cccnc1N 1P003H0N [0,1,0,0,0,0|0,0,0]=1 1011 B10R1.61 NC(=O)c1cccnc1S 1P00E1PI [0,1,0,0,0,0|0,0,0]=1 1012 B10R1.61 NC(=O)c1ccn[nH]c1=O 1P00BVJX [0,1,0,0,0,0|1,0,1]=3 1013 B10R1.61 NC(=O)c1ccncc1Br 1P001BRK [0,1,0,0,0,0|2,0,0]=3 1014 B10R1.61 NC(=O)c1ccncc1C 1P002QZ3 [0,1,0,0,0,0|2,0,0]=3 1015 B10R1.61 NC(=O)c1ccncc1Cl 1P0003HU [0,1,0,0,0,0|2,0,0]=3 1016 B10R1.61 NC(=O)c1ccncc1F 1P00ACKC [0,1,0,0,0,0|2,0,0]=3 1017 B10R1.61 NC(=O)c1ccncc1N 1P003JEB [0,1,0,0,0,0|2,0,0]=3 1018 B10R1.61 NC(=O)c1ccncc1N 1P00EAYC [0,1,0,0,0,0|2,0,0]=3 1019 B10R1.61 NC(=O)c1ccncc1N 1P01AL91 [0,1,0,0,0,0|2,0,0]=3 1020 B10R1.61 NC(=O)c1ccncc1O 1P0004LB [0,1,0,0,0,0|2,0,0]=3 1021 B10R1.61 NC(=O)c1cnccc1Br 1P027UFY [0,1,0,0,0,0|0,0,0]=1 1022 B10R1.61 NC(=O)c1cnccc1C 1P005T1X [0,1,0,0,0,0|0,0,0]=1 1023 B10R1.61 NC(=O)c1cnccc1Cl 1P005DUV [0,1,0,0,0,0|0,0,0]=1 1024 B10R1.61 NC(=O)c1cnccc1N 1P00FCTF [0,1,0,0,0,0|0,0,0]=1 1025 B10R1.61 NC(=O)c1cnccc1O 1P00FFRW [0,1,0,0,0,0|0,0,0]=1 1026 B10R1.61 NC(=O)c1cncnc1N 1P00DCM8 [0,1,0,0,0,0|1,0,0]=2 1027 B10R1.61 NC(=O)c1cncnc1O 1P00DG2R [0,1,0,0,0,0|1,0,0]=2 1028 B10R1.61 NC(=O)c1ncc[nH]c1=O 1P009CO6 [0,1,0,0,0,0|1,0,1]=3 1029 B10R1.61 NC(=O)c1ncccc1Br 1P00CJQP [0,1,0,0,0,0|2,0,0]=3 1030 B10R1.61 NC(=O)c1ncccc1C 1P00GT5N [0,1,0,0,0,0|2,0,0]=3 1031 B10R1.61 NC(=O)c1ncccc1Cl 1P000AYW [0,1,0,0,0,0|2,0,0]=3 1032 B10R1.61 NC(=O)c1ncccc1N 1P00D8IG [0,1,0,0,0,0|2,0,0]=3 1033 B10R1.61 NC(=O)c1ncccc1O 1P003K1J [0,1,0,0,0,0|2,0,0]=3 1034 B10R1.61 NC(=O)c1nccnc1Br 1P002VB7 [0,1,0,0,0,0|1,0,0]=2 1035 B10R1.61 NC(=O)c1nccnc1Cl 1P003JS7 [0,1,0,0,0,0|1,0,0]=2 1036 B10R1.61 NC(=O)c1nccnc1N 1P00CAO8 [0,1,0,0,0,0|1,0,0]=2 1037 B10R1.61 NC(=O)c1nccnc1O 1P003K1L [0,1,0,0,0,0|1,0,0]=2 1038 B10R1.61 NC(=S)c1ccccc1Br 1P003H9S [0,1,0,0,0,0|1,1,0]=3 1039 B10R1.61 NC(=S)c1ccccc1C 1P00D8TE [0,1,0,0,0,0|1,1,0]=3 1040 B10R1.61 NC(=S)c1ccccc1Cl 1P001PQE [0,1,0,0,0,0|1,1,0]=3 1041 B10R1.61 NC(=S)c1ccccc1F 1P005TSU [0,1,0,0,0,0|1,1,0]=3 1042 B10R1.61 NC(=S)c1ccccc1N 1P002OYJ [0,1,0,0,0,0|1,1,0]=3 1043 B10R1.61 NC(=S)c1ccccc1O 1P005VU3 [0,1,0,0,0,0|1,1,0]=3 1044 B10R1.61 NC(=S)c1ccccc1S 1P0286LO [0,1,0,0,0,0|1,1,0]=3 1045 B10R1.61 NC(=S)c1cccnc1N 1P00COUK [0,1,0,0,0,0|0,1,0]=2 1046 B10R1.61 NC(=S)c1cccnc1O 1P0290Z1 [0,1,0,0,0,0|0,1,0]=2 1047 B10R1.61 NC(=S)c1cncnc1N 1P01AICM [0,1,0,0,0,0|1,1,0]=3 1048 B10R1.61 NC(=S)c1ncccc1Br 1P01DTCH [0,1,0,0,0,0|2,1,0]=4 1049 B10R1.61 NC(=S)c1nccnc1N 1P01SCJN [0,1,0,0,0,0|1,1,0]=3 1050 B10R1.61 O=N(=O)c1ccccc1C 1P003IA0 [0,1,0,0,0,0|3,0,0]=4 1051 B10R1.61 O=N(=O)c1ccccc1Cl 1P00IKVH [0,1,0,0,0,0|3,0,0]=4 1052 B10R1.61 O=N(=O)c1ccccc1N 1P003TY5 [0,1,0,0,0,0|3,0,0]=4 1053 B10R1.61 O=N(=O)c1ccccc1O 1P003TY6 [0,1,0,0,0,0|3,0,0]=4 1054 B10R1.61 O=N(=O)c1cccnc1C 1P00EAXE [0,1,0,0,0,0|2,0,0]=3 1055 B10R1.61 OB(c1cccnc1Br)O 1P003C2V [0,1,0,0,0,0|2,0,1]=4 1056 B10R1.61 OB(c1cccnc1C)O 1P0033W6 [0,1,0,0,0,0|2,0,1]=4 1057 B10R1.61 OB(c1cccnc1C)O 1P00GSLX [0,1,0,0,0,0|2,0,1]=4 1058 B10R1.61 OB(c1cccnc1Cl)O 1P003HCS [0,1,0,0,0,0|2,0,1]=4 1059 B10R1.61 OB(c1cccnc1F)O 1P0020B7 [0,1,0,0,0,0|2,0,1]=4 1060 B10R1.61 OB(c1cccnc1N)O 1P008UJI [0,1,0,0,0,0|2,0,1]=4 1061 B10R1.61 OB(c1cccnc1N)O 1P0289CB [0,1,0,0,0,0|2,0,1]=4 1062 B10R1.61 OB(c1cnccc1C)O 1P001LGF [0,1,0,0,0,0|2,0,1]=4 1063 B10R1.61 OB(c1cnccc1Cl)O 1P00DAVF [0,1,0,0,0,0|2,0,1]=4 1064 B10R1.61 OB(c1cnccc1N)O 1P00IK6A [0,1,0,0,0,0|2,0,1]=4 1065 B10R1.61 OC(=O)C1C=CC=NC1=O 1P01KLDR [0,1,0,0,0,0|1,0,1]=3 1066 B10R1.61 OC(=O)c1cccc[n+]1[O-] 1P003U8Q [0,1,0,0,0,0|3,0,0]=4 1067 B10R1.61 OC(=O)c1ccccc1Br 1P0033MS [0,1,0,0,0,0|2,0,0]=3 1068 B10R1.61 OC(=O)c1ccccc1C 1P0035WF [0,1,0,0,0,0|2,0,0]=3 1069 B10R1.61 OC(=O)c1ccccc1Cl 1P003HIE [0,1,0,0,0,0|2,0,0]=3 1070 B10R1.61 OC(=O)c1ccccc1F 1P003HS6 [0,1,0,0,0,0|2,0,0]=3 1071 B10R1.61 OC(=O)c1ccccc1I 1P00IFBA [0,1,0,0,0,0|2,0,0]=3 1072 B10R1.61 OC(=O)c1ccccc1O 1P0072Q7 [0,1,0,0,0,0|2,0,0]=3 1073 B10R1.61 OC(=O)c1ccccc1O 1P00GA1V [0,1,0,0,0,0|2,0,0]=3 1074 B10R1.61 OC(=O)c1cccnc1Br 1P007DQN [0,1,0,0,0,0|1,0,0]=2 1075 B10R1.61 OC(=O)c1cccnc1C 1P003I6J [0,1,0,0,0,0|1,0,0]=2 1076 B10R1.61 OC(=O)c1cccnc1C 1P007Q5X [0,1,0,0,0,0|1,0,0]=2 1077 B10R1.61 OC(=O)c1cccnc1Cl 1P002YTC [0,1,0,0,0,0|1,0,0]=2 1078 B10R1.61 OC(=O)c1cccnc1F 1P003HSN [0,1,0,0,0,0|1,0,0]=2 1079 B10R1.61 OC(=O)c1cccnc1I 1P00EGNX [0,1,0,0,0,0|1,0,0]=2 1080 B10R1.61 OC(=O)c1cccnc1N 1P0033L3 [0,1,0,0,0,0|1,0,0]=2 1081 B10R1.61 OC(=O)c1cccnc1O 1P0033TM [0,1,0,0,0,0|1,0,0]=2 1082 B10R1.61 OC(=O)c1cccnc1S 1P003HZ1 [0,1,0,0,0,0|1,0,0]=2 1083 B10R1.61 OC(=O)c1ccn[nH]c1=O 1P00348K [0,1,0,0,0,0|2,0,1]=4 1084 B10R1.61 OC(=O)c1ccncc1Br 1P001BSI [0,1,0,0,0,0|3,0,0]=4 1085 B10R1.61 OC(=O)c1ccncc1C 1P0039KX [0,1,0,0,0,0|3,0,0]=4 1086 B10R1.61 OC(=O)c1ccncc1C 1P00ELDZ [0,1,0,0,0,0|3,0,0]=4 1087 B10R1.61 OC(=O)c1ccncc1Cl 1P008AMD [0,1,0,0,0,0|3,0,0]=4 1088 B10R1.61 OC(=O)c1ccncc1F 1P003JYI [0,1,0,0,0,0|3,0,0]=4 1089 B10R1.61 OC(=O)c1ccncc1I 1P00E99I [0,1,0,0,0,0|3,0,0]=4 1090 B10R1.61 OC(=O)c1ccncc1N 1P003JEC [0,1,0,0,0,0|3,0,0]=4 1091 B10R1.61 OC(=O)c1ccncc1O 1P0004LD [0,1,0,0,0,0|3,0,0]=4 1092 B10R1.61 OC(=O)c1ccncc1S 1P002331 [0,1,0,0,0,0|3,0,0]=4 1093 B10R1.61 OC(=O)c1ccnnc1C 1P00II15 [0,1,0,0,0,0|2,0,0]=3 1094 B10R1.61 OC(=O)c1ccnnc1Cl 1P0007O6 [0,1,0,0,0,0|2,0,0]=3 1095 B10R1.61 OC(=O)c1ccnnc1N 1P002LSA [0,1,0,0,0,0|2,0,0]=3 1096 B10R1.61 OC(=O)c1ccnnc1S 1P01C250 [0,1,0,0,0,0|2,0,0]=3 1097 B10R1.61 OC(=O)c1cnc[nH]c1=O 1P00FCM6 [0,1,0,0,0,0|2,0,0]=3 1098 B10R1.61 OC(=O)c1cnccc1Br 1P003875 [0,1,0,0,0,0|1,0,0]=2 1099 B10R1.61 OC(=O)c1cnccc1C 1P003M9A [0,1,0,0,0,0|1,0,0]=2 1100 B10R1.61 OC(=O)c1cnccc1C 1P00GSON [0,1,0,0,0,0|1,0,0]=2 1101 B10R1.61 OC(=O)c1cnccc1Cl 1P0005WO [0,1,0,0,0,0|1,0,0]=2 1102 B10R1.61 OC(=O)c1cnccc1F 1P007K8H [0,1,0,0,0,0|1,0,0]=2 1103 B10R1.61 OC(=O)c1cnccc1I 1P01FJ5J [0,1,0,0,0,0|1,0,0]=2 1104 B10R1.61 OC(=O)c1cnccc1N 1P003L8E [0,1,0,0,0,0|1,0,0]=2 1105 B10R1.61 OC(=O)c1cnccc1O 1P003M09 [0,1,0,0,0,0|1,0,0]=2 1106 B10R1.61 OC(=O)c1cnccc1S 1P002333 [0,1,0,0,0,0|1,0,0]=2 1107 B10R1.61 OC(=O)c1cncnc1C 1P001PV1 [0,1,0,0,0,0|2,0,0]=3 1108 B10R1.61 OC(=O)c1cncnc1Cl 1P00GVDA [0,1,0,0,0,0|2,0,0]=3 1109 B10R1.61 OC(=O)c1cncnc1N 1P002JH7 [0,1,0,0,0,0|2,0,0]=3 1110 B10R1.61 OC(=O)c1cnncc1C 1P0095BV [0,1,0,0,0,0|2,0,0]=3 1111 B10R1.61 OC(=O)c1cnncc1C 1P028E7P [0,1,0,0,0,0|2,0,0]=3 1112 B10R1.61 OC(=O)c1cnncc1N 1P00712X [0,1,0,0,0,0|2,0,0]=3 1113 B10R1.61 OC(=O)c1cnncc1O 1P01AUXL [0,1,0,0,0,0|2,0,0]=3 1114 B10R1.61 OC(=O)c1n[nH]ccc1=O 1P01A4WY [0,1,0,0,0,0|2,0,1]=4 1115 B10R1.61 OC(=O)c1ncc[nH]c1=O 1P002JH6 [0,1,0,0,0,0|2,0,1]=4 1116 B10R1.61 OC(=O)c1ncccc1Br 1P00319D [0,1,0,0,0,0|3,0,0]=4 1117 B10R1.61 OC(=O)c1ncccc1C 1P000LL7 [0,1,0,0,0,0|3,0,0]=4 1118 B10R1.61 OC(=O)c1ncccc1C 1P003488 [0,1,0,0,0,0|3,0,0]=4 1119 B10R1.61 OC(=O)c1ncccc1Cl 1P003JRZ [0,1,0,0,0,0|3,0,0]=4 1120 B10R1.61 OC(=O)c1ncccc1F 1P006UT0 [0,1,0,0,0,0|3,0,0]=4 1121 B10R1.61 OC(=O)c1ncccc1I 1P005WO7 [0,1,0,0,0,0|3,0,0]=4 1122 B10R1.61 OC(=O)c1ncccc1N 1P001E9I [0,1,0,0,0,0|3,0,0]=4 1123 B10R1.61 OC(=O)c1ncccc1O 1P00DBOF [0,1,0,0,0,0|3,0,0]=4 1124 B10R1.61 OC(=O)c1ncccc1S 1P00C9IZ [0,1,0,0,0,0|3,0,0]=4 1125 B10R1.61 OC(=O)c1nccnc1Br 1P00H1EL [0,1,0,0,0,0|2,0,0]=3 1126 B10R1.61 OC(=O)c1nccnc1C 1P003485 [0,1,0,0,0,0|2,0,0]=3 1127 B10R1.61 OC(=O)c1nccnc1Cl 1P003JS8 [0,1,0,0,0,0|2,0,0]=3 1128 B10R1.61 OC(=O)c1nccnc1F 1P01OMF7 [0,1,0,0,0,0|2,0,0]=3 1129 B10R1.61 OC(=O)c1nccnc1I 1P007P3R [0,1,0,0,0,0|2,0,0]=3 1130 B10R1.61 OC(=O)c1nccnc1N 1P003JEP [0,1,0,0,0,0|2,0,0]=3 1131 B10R1.61 OC(=O)c1nccnc1S 1P01ANEF [0,1,0,0,0,0|2,0,0]=3 1132 B10R1.61 OC(=O)c1ncnnc1N 1P00CB8M [0,1,0,0,0,0|3,0,0]=4 1133 B10R1.61 OC(=O)c1nnccc1C 1P00BGLQ [0,1,0,0,0,0|2,0,0]=3 1134 B10R1.61 OC(=O)c1nnccc1C 1P028XRQ [0,1,0,0,0,0|2,0,0]=3 1135 B10R1.61 OC(=S)c1ccccc1O 1P006V4J [0,1,0,0,0,0|2,0,1]=4 1136 B10R1.61 [O-]C(=O)c1ccccc1Cl 1P00APO5 [0,1,0,0,0,0|2,0,0]=3 1137 B10R1.61 [O-]C(=O)c1ccccc1F 1P006WEJ [0,1,0,0,0,0|2,0,0]=3 1138 B10R1.61 [O-]C(=O)c1ccccc1O 1P002IGB [0,1,0,0,0,0|2,0,0]=3 1139 B10R1.61 [O-]C(=O)c1ccccc1O 1P00352J [0,1,0,0,0,0|2,0,0]=3 1140 B10R1.61 [O-]C(=O)c1ccccc1O 1P003OC6 [0,1,0,0,0,0|2,0,0]=3 1141 B10R1.61 [O-]C(=O)c1ccccc1O 1P003RSL [0,1,0,0,0,0|2,0,0]=3 1142 B10R1.61 [O-]C(=O)c1ccccc1O 1P003UUP [0,1,0,0,0,0|2,0,0]=3 1143 B10R1.61 [O-]C(=O)c1ccccc1O 1P00IAR4 [0,1,0,0,0,0|2,0,0]=3 1144 B10R1.61 [O-]C(=O)c1ccccc1S 1P003V9F [0,1,0,0,0,0|2,0,0]=3 1145 B10R1.61 [O-]C(=O)c1ncccc1Br 1P008VJH [0,1,0,0,0,0|3,0,0]=4 1146 B10R1.61 [O-]C(=O)c1ncccc1O 1P00IEYX [0,1,0,0,0,0|3,0,0]=4 1147 B10R1.61 [O-]S(=O)c1ccccc1Br 1P01C8NU [0,1,0,0,0,0|3,0,0]=4 1148 B10R1.61 [O-]S(=O)c1ccccc1C 1P00B5ML [0,1,0,0,0,0|3,0,0]=4 1149 B10R1.61 [O-]S(=O)c1ccccc1C 1P028LVY [0,1,0,0,0,0|3,0,0]=4 1150 B10R1.61 [O-]S(=O)c1ccccc1Cl 1P001RKU [0,1,0,0,0,0|3,0,0]=4 1151 B10R1.61 [O-]S(=O)c1ccccc1F 1P01BEXE [0,1,0,0,0,0|3,0,0]=4 1152 B10R1.61 [O-]S(=O)c1cccnc1Cl 1P01FJ1V [0,1,0,0,0,0|2,0,0]=3 1153 B10R1.61 [O-]S(=O)c1cccnc1F 1P01FLAH [0,1,0,0,0,0|2,0,0]=3 1154 B10R1.61 [O-][N+](=O)c1c[nH]ccc1=O 1P001OT5 [0,1,0,0,0,0|2,0,1]=4 1155 B10R1.61 [O-][N+](=O)c1ccccc1Br 1P00380N [0,1,0,0,0,0|3,0,0]=4 1156 B10R1.61 [O-][N+](=O)c1ccccc1F 1P001M0Y [0,1,0,0,0,0|3,0,0]=4 1157 B10R1.61 [O-][N+](=O)c1ccccc1N 1P001RAI [0,1,0,0,0,0|3,0,0]=4 1158 B10R1.61 [O-][N+](=O)c1ccccc1S 1P003A8J [0,1,0,0,0,0|3,0,0]=4 1159 B10R1.61 [O-][N+](=O)c1ccccc1[O-] 1P003BQ2 [0,1,0,0,0,0|3,0,0]=4 1160 B10R1.61 [O-][N+](=O)c1cccnc1Br 1P002BCG [0,1,0,0,0,0|2,0,0]=3 1161 B10R1.61 [O-][N+](=O)c1cccnc1C 1P003I3F [0,1,0,0,0,0|2,0,0]=3 1162 B10R1.61 [O-][N+](=O)c1cccnc1Cl 1P003HCQ [0,1,0,0,0,0|2,0,0]=3 1163 B10R1.61 [O-][N+](=O)c1cccnc1F 1P003HPM [0,1,0,0,0,0|2,0,0]=3 1164 B10R1.61 [O-][N+](=O)c1cccnc1I 1P002KMS [0,1,0,0,0,0|2,0,0]=3 1165 B10R1.61 [O-][N+](=O)c1cccnc1N 1P00I8N4 [0,1,0,0,0,0|2,0,0]=3 1166 B10R1.61 [O-][N+](=O)c1cccnc1O 1P0036FP [0,1,0,0,0,0|2,0,0]=3 1167 B10R1.61 [O-][N+](=O)c1cccnc1S 1P003KAL [0,1,0,0,0,0|2,0,0]=3 1168 B10R1.61 [O-][N+](=O)c1cnccc1Br 1P002MIG [0,1,0,0,0,0|2,0,0]=3 1169 B10R1.61 [O-][N+](=O)c1cnccc1C 1P004QMA [0,1,0,0,0,0|2,0,0]=3 1170 B10R1.61 [O-][N+](=O)c1cnccc1C 1P00E9CE [0,1,0,0,0,0|2,0,0]=3 1171 B10R1.61 [O-][N+](=O)c1cnccc1Cl 1P000VKE [0,1,0,0,0,0|2,0,0]=3 1172 B10R1.61 [O-][N+](=O)c1cnccc1F 1P000HCN [0,1,0,0,0,0|2,0,0]=3 1173 B10R1.61 [O-][N+](=O)c1cnccc1N 1P001Y9X [0,1,0,0,0,0|2,0,0]=3 1174 B10R1.61 [O-][N+](=O)c1cnccc1O 1P00DEG3 [0,1,0,0,0,0|2,0,0]=3 1175 B10R1.61 [O-][N+](=O)c1cncnc1O 1P007P7T [0,1,0,0,0,0|3,0,0]=4 1176 B10R1.61 [O-][N+](=O)c1nccnc1Cl 1P0036RO [0,1,0,0,0,0|3,0,0]=4 1177 B10R1.113 Brc1cccc(c1)C(=C)C 1P01DFHU [0,1,0,0,0,0|3,0,0]=4 1178 B10R1.113 Brc1cccc(c1)C(=C)F 1P01KJDN [0,1,0,0,0,0|3,0,0]=4 1179 B10R1.113 Brc1cccc(c1)C(=N)N 1P002SCY [0,1,0,0,0,0|2,0,0]=3 1180 B10R1.113 Brc1cccc(c1)C(=N)N 1P00385V [0,1,0,0,0,0|2,0,0]=3 1181 B10R1.113 Brc1cccc(c1)C(=O)C 1P00343B [0,1,0,0,0,0|2,0,0]=3 1182 B10R1.113 Brc1cccc(c1)C(=O)Cl 1P003JKS [0,1,0,0,0,0|2,0,0]=3 1183 B10R1.113 Brc1cccc(c1)C(=O)N 1P003JKP [0,1,0,0,0,0|1,0,0]=2 1184 B10R1.113 Brc1cccc(c1)C(=O)O 1P00343E [0,1,0,0,0,0|2,0,0]=3 1185 B10R1.113 Brc1cccc(c1)C(=S)N 1P003JM0 [0,1,0,0,0,0|1,1,0]=3 1186 B10R1.113 Brc1cccc(c1)C(N)C 1P003DD5 [0,1,0,0,0,0|2,0,1]=4 1187 B10R1.113 Brc1cccc(c1)C(N)C 1P00GUE1 [0,1,0,0,0,0|2,0,1]=4 1188 B10R1.113 Brc1cccc(c1)S(=O)C 1P00I61D [0,1,0,0,0,0|3,0,0]=4 1189 B10R1.113 Brc1cccc(c1)S(=O)[O-] 1P0087RC [0,1,0,0,0,0|3,0,0]=4 1190 B10R1.113 Brc1cccc(c1)[C@@H](N)C 1P001B71 [0,1,0,0,0,0|2,0,1]=4 1191 B10R1.113 Brc1cccc(c1)[C@@H](N)C 1P01DUN8 [0,1,0,0,0,0|2,0,1]=4 1192 B10R1.113 Brc1cccc(c1)[C@H](N)C 1P0025AP [0,1,0,0,0,0|2,0,1]=4 1193 B10R1.113 Brc1cccc(c1)[C@H](N)C 1P00HE7L [0,1,0,0,0,0|2,0,1]=4 1194 B10R1.113 Brc1cccc(c1)[N+](=O)[O-] 1P00IAUX [0,1,0,0,0,0|3,0,0]=4 1195 B10R1.113 Brc1cccc(n1)C(=N)N 1P000MV2 [0,1,0,0,0,0|3,0,0]=4 1196 B10R1.113 Brc1cccc(n1)C(=N)N 1P028LAQ [0,1,0,0,0,0|3,0,0]=4 1197 B10R1.113 Brc1cccc(n1)C(=O)C 1P003GRS [0,1,0,0,0,0|3,0,0]=4 1198 B10R1.113 Brc1cccc(n1)C(=O)N 1P002RBC [0,1,0,0,0,0|2,0,0]=3 1199 B10R1.113 Brc1cccc(n1)C(=O)O 1P003NLN [0,1,0,0,0,0|3,0,0]=4 1200 B10R1.113 Brc1cncc(c1)C(Br)C 1P01FIOB [0,1,0,0,0,0|2,0,1]=4 1201 B10R1.113 Brc1nccc(c1)C(=O)C 1P008GLR [0,1,0,0,0,0|3,0,0]=4 1202 B10R1.113 Brc1nccc(c1)C(=O)N 1P0037VO [0,1,0,0,0,0|2,0,0]=3 1203 B10R1.113 Brc1nccc(c1)C(=O)O 1P003H8P [0,1,0,0,0,0|3,0,0]=4 1204 B10R1.113 CC(=C)c1cc(Br)cnc1 1P00CJ77 [0,1,0,0,0,0|2,0,0]=3 1205 B10R1.113 CC(=C)c1cc(Cl)cnc1 1P00Q7ZC [0,1,0,0,0,0|2,0,0]=3 1206 B10R1.113 CC(=O)c1cc(Br)ccn1 1P008X5S [0,1,0,0,0,0|3,0,0]=4 1207 B10R1.113 CC(=O)c1cc(Br)cnc1 1P003JA1 [0,1,0,0,0,0|1,0,0]=2 1208 B10R1.113 CC(=O)c1cc(Cl)ccn1 1P00EAZB [0,1,0,0,0,0|3,0,0]=4 1209 B10R1.113 CC(=O)c1cc(Cl)cnc1 1P0096YV [0,1,0,0,0,0|1,0,0]=2 1210 B10R1.113 CC(=O)c1cc(F)cnc1 1P007HHH [0,1,0,0,0,0|1,0,0]=2 1211 B10R1.113 CC(=O)c1cc(N)ccn1 1P01FPBD [0,1,0,0,0,0|3,0,0]=4 1212 B10R1.113 CC(=O)c1cc(O)cnc1 1P00H2TX [0,1,0,0,0,0|1,0,0]=2 1213 B10R1.113 CC(=O)c1cc[nH]c(=O)c1 1P0087BW [0,1,0,0,0,0|3,0,0]=4 1214 B10R1.113 CC(=O)c1cncc(n1)Cl 1P000Q11 [0,1,0,0,0,0|2,0,0]=3 1215 B10R1.113 CC(c1cc(Br)cnc1)O 1P00BHS0 [0,1,0,0,0,0|1,0,2]=4 1216 B10R1.113 CC(c1cc(Cl)cnc1)Br 1P0249DK [0,1,0,0,0,0|2,0,1]=4 1217 B10R1.113 CC(c1cc(F)cnc1)N 1P01A6ET [0,1,0,0,0,0|1,0,1]=3 1218 B10R1.113 CC(c1cc(F)cnc1)O 1P009JKY [0,1,0,0,0,0|1,0,2]=4 1219 B10R1.113 CC(c1cncc(c1)Br)C 1P00951Z [0,1,0,0,0,0|2,0,1]=4 1220 B10R1.113 CC(c1cncc(c1)F)N 1P01A5GB [0,1,0,0,0,0|1,0,1]=3 1221 B10R1.113 CC(c1cncc(c1)N)C 1P000OWY [0,1,0,0,0,0|2,0,1]=4 1222 B10R1.113 CC(c1cncc(c1)O)C 1P01BWSZ [0,1,0,0,0,0|2,0,1]=4 1223 B10R1.113 CN(c1cncc(c1)Br)C 1P00CJFM [0,1,0,0,0,0|3,0,0]=4 1224 B10R1.113 CN(c1cncc(c1)I)C 1P02916L [0,1,0,0,0,0|3,0,0]=4 1225 B10R1.113 CN(c1cncc(c1)N)C 1P00A7SL [0,1,0,0,0,0|3,0,0]=4 1226 B10R1.113 CN(c1cncc(c1)S)C 1P0290O6 [0,1,0,0,0,0|3,0,0]=4 1227 B10R1.113 CN1C=C(CC=C1)C(=O)N 1P0025UB [0,1,0,0,0,0|0,0,2]=3 1228 B10R1.113 C[C@@H](c1cc(Br)cnc1)O 1P028FL5 [0,1,0,0,0,0|1,0,2]=4 1229 B10R1.113 C[C@@H](c1cc(F)cnc1)N 1P00I40E [0,1,0,0,0,0|1,0,1]=3 1230 B10R1.113 C[C@@H](c1cc(F)cnc1)N 1P01C30I [0,1,0,0,0,0|1,0,1]=3 1231 B10R1.113 C[C@@H](c1cncc(c1)Cl)N 1P024FYP [0,1,0,0,0,0|1,0,1]=3 1232 B10R1.113 C[C@H](c1cc(Br)cnc1)N 1P01JV49 [0,1,0,0,0,0|1,0,1]=3 1233 B10R1.113 C[C@H](c1cc(Br)cnc1)O 1P028H8P [0,1,0,0,0,0|1,0,2]=4 1234 B10R1.113 C[C@H](c1cc(Cl)cnc1)N 1P01OHTY [0,1,0,0,0,0|1,0,1]=3 1235 B10R1.113 C[C@H](c1cncc(c1)Br)N 1P01KLBA [0,1,0,0,0,0|1,0,1]=3 1236 B10R1.113 C[C@H](c1cncc(c1)F)N 1P01C2VE [0,1,0,0,0,0|1,0,1]=3 1237 B10R1.113 C[n+]1cc(ncc1)C(=O)O 1P01F00X [0,1,0,0,0,0|2,0,1]=4 1238 B10R1.113 C[n+]1cccc(c1)C(=O)N 1P0002MF [0,1,0,0,0,0|0,0,1]=2 1239 B10R1.113 C[n+]1cccc(c1)C(=O)O 1P003VJ9 [0,1,0,0,0,0|1,0,1]=3 1240 B10R1.113 C[n+]1cccc(c1)C(=O)[O-] 1P003A9A [0,1,0,0,0,0|1,0,1]=3 1241 B10R1.113 Cc1cc(cnc1)C(=O)N 1P003ND0 [0,1,0,0,0,0|0,0,0]=1 1242 B10R1.113 Cc1cc(cnc1)C(=O)O 1P003ND1 [0,1,0,0,0,0|1,0,0]=2 1243 B10R1.113 Cc1cc(cnn1)C(=O)O 1P00HCMQ [0,1,0,0,0,0|2,0,0]=3 1244 B10R1.113 Cc1cc(cnn1)C(=O)O 1P01AGKY [0,1,0,0,0,0|2,0,0]=3 1245 B10R1.113 Cc1cc(ncc1)C(=N)N 1P0090EF [0,1,0,0,0,0|3,0,0]=4 1246 B10R1.113 Cc1cc(ncc1)C(=O)O 1P0036FE [0,1,0,0,0,0|3,0,0]=4 1247 B10R1.113 Cc1cccc(c1)C(=C)C 1P003RUW [0,1,0,0,0,0|3,0,0]=4 1248 B10R1.113 Cc1cccc(c1)C(=N)N 1P002J5B [0,1,0,0,0,0|2,0,0]=3 1249 B10R1.113 Cc1cccc(c1)C(=N)N 1P0075JC [0,1,0,0,0,0|2,0,0]=3 1250 B10R1.113 Cc1cccc(c1)C(=O)C 1P00IAUW [0,1,0,0,0,0|2,0,0]=3 1251 B10R1.113 Cc1cccc(c1)C(=O)Cl 1P003SN4 [0,1,0,0,0,0|2,0,0]=3 1252 B10R1.113 Cc1cccc(c1)C(=O)N 1P003K78 [0,1,0,0,0,0|1,0,0]=2 1253 B10R1.113 Cc1cccc(c1)C(=O)O 1P003SN2 [0,1,0,0,0,0|2,0,0]=3 1254 B10R1.113 Cc1cccc(c1)C(=S)N 1P002OEP [0,1,0,0,0,0|1,1,0]=3 1255 B10R1.113 Cc1cccc(c1)C(N)C 1P00372B [0,1,0,0,0,0|2,0,1]=4 1256 B10R1.113 Cc1cccc(c1)C(N)C 1P00GATB [0,1,0,0,0,0|2,0,1]=4 1257 B10R1.113 Cc1cccc(c1)N(N)C 1P003EXI [0,1,0,0,0,0|3,0,0]=4 1258 B10R1.113 Cc1cccc(c1)S(=O)C 1P000ZR8 [0,1,0,0,0,0|3,0,0]=4 1259 B10R1.113 Cc1cccc(c1)S(=O)[O-] 1P00ASY9 [0,1,0,0,0,0|3,0,0]=4 1260 B10R1.113 Cc1cccc(c1)[C@@H](N)C 1P0019NW [0,1,0,0,0,0|2,0,1]=4 1261 B10R1.113 Cc1cccc(c1)[C@@H](N)C 1P00J3RI [0,1,0,0,0,0|2,0,1]=4 1262 B10R1.113 Cc1cccc(c1)[C@H](N)C 1P000DMK [0,1,0,0,0,0|2,0,1]=4 1263 B10R1.113 Cc1cccc(c1)[C@H](N)C 1P0019NV [0,1,0,0,0,0|2,0,1]=4 1264 B10R1.113 Cc1cccc(c1)[N+](=O)[O-] 1P003A3U [0,1,0,0,0,0|3,0,0]=4 1265 B10R1.113 Cc1cccc(n1)C(=N)N 1P0090CM [0,1,0,0,0,0|3,0,0]=4 1266 B10R1.113 Cc1cccc(n1)C(=O)C 1P003GRV [0,1,0,0,0,0|3,0,0]=4 1267 B10R1.113 Cc1cccc(n1)C(=O)Cl 1P00F4ND [0,1,0,0,0,0|3,0,0]=4 1268 B10R1.113 Cc1cccc(n1)C(=O)N 1P00EMDK [0,1,0,0,0,0|2,0,0]=3 1269 B10R1.113 Cc1cccc(n1)C(=O)O 1P0034U5 [0,1,0,0,0,0|3,0,0]=4 1270 B10R1.113 Cc1ccnc(c1)C(=O)C 1P003GRN [0,1,0,0,0,0|3,0,0]=4 1271 B10R1.113 Cc1ccnc(n1)C(=O)N 1P0014O1 [0,1,0,0,0,0|3,0,0]=4 1272 B10R1.113 Cc1cncc(c1)C(=O)C 1P00CAT8 [0,1,0,0,0,0|1,0,0]=2 1273 B10R1.113 Cc1cncc(c1)C(C)C 1P01XDSD [0,1,0,0,0,0|2,0,1]=4 1274 B10R1.113 Cc1cncc(c1)C(N)C 1P01ANWN [0,1,0,0,0,0|1,0,1]=3 1275 B10R1.113 Cc1cncc(n1)C(=O)N 1P00DGIS [0,1,0,0,0,0|1,0,0]=2 1276 B10R1.113 Cc1cncc(n1)C(=O)O 1P0036OU [0,1,0,0,0,0|2,0,0]=3 1277 B10R1.113 Cc1cnnc(c1)C(=O)O 1P00HGFO [0,1,0,0,0,0|2,0,0]=3 1278 B10R1.113 Cc1cnnc(c1)C(=O)[O-] 1P01B65Q [0,1,0,0,0,0|2,0,0]=3 1279 B10R1.113 Cc1nccc(c1)C(=O)C 1P00BDBG [0,1,0,0,0,0|3,0,0]=4 1280 B10R1.113 Cc1nccc(c1)C(=O)N 1P00AKYZ [0,1,0,0,0,0|2,0,0]=3 1281 B10R1.113 Cc1nccc(c1)C(=O)O 1P0033UX [0,1,0,0,0,0|3,0,0]=4 1282 B10R1.113 Cc1nccc(c1)C(=S)N 1P00C9NL [0,1,0,0,0,0|2,1,0]=4 1283 B10R1.113 Cc1nccc(n1)C(=O)N 1P00GS4I [0,1,0,0,0,0|3,0,0]=4 1284 B10R1.113 ClC(=O)c1cc(Br)cnc1 1P003N1C [0,1,0,0,0,0|1,0,0]=2 1285 B10R1.113 Clc1cccc(c1)C(=C)C 1P00ATR4 [0,1,0,0,0,0|3,0,0]=4 1286 B10R1.113 Clc1cccc(c1)C(=N)N 1P003A6F [0,1,0,0,0,0|2,0,0]=3 1287 B10R1.113 Clc1cccc(c1)C(=O)Cl 1P00F3HP [0,1,0,0,0,0|2,0,0]=3 1288 B10R1.113 Clc1cccc(c1)C(=O)N 1P00E9KT [0,1,0,0,0,0|1,0,0]=2 1289 B10R1.113 Clc1cccc(c1)C(=O)O 1P003JR5 [0,1,0,0,0,0|2,0,0]=3 1290 B10R1.113 Clc1cccc(c1)C(=S)N 1P003JSG [0,1,0,0,0,0|1,1,0]=3 1291 B10R1.113 Clc1cccc(c1)C(N)C 1P00C2DU [0,1,0,0,0,0|2,0,1]=4 1292 B10R1.113 Clc1cccc(c1)C(N)C 1P00CMAZ [0,1,0,0,0,0|2,0,1]=4 1293 B10R1.113 Clc1cccc(c1)S(=O)[O-] 1P01BEXC [0,1,0,0,0,0|3,0,0]=4 1294 B10R1.113 Clc1cccc(c1)[C@@H](N)C 1P003CZE [0,1,0,0,0,0|2,0,1]=4 1295 B10R1.113 Clc1cccc(c1)[C@@H](N)C 1P009ZW7 [0,1,0,0,0,0|2,0,1]=4 1296 B10R1.113 Clc1cccc(c1)[C@H](N)C 1P003CNL [0,1,0,0,0,0|2,0,1]=4 1297 B10R1.113 Clc1cccc(c1)[C@H](N)C 1P00955Y [0,1,0,0,0,0|2,0,1]=4 1298 B10R1.113 Clc1cccc(c1)[N+](=O)[O-] 1P007Q6W [0,1,0,0,0,0|3,0,0]=4 1299 B10R1.113 Clc1cccc(n1)C(=N)N 1P0090G1 [0,1,0,0,0,0|3,0,0]=4 1300 B10R1.113 Clc1cccc(n1)C(=O)C 1P00APS1 [0,1,0,0,0,0|3,0,0]=4 1301 B10R1.113 Clc1cccc(n1)C(=O)Cl 1P0055OQ [0,1,0,0,0,0|3,0,0]=4 1302 B10R1.113 Clc1cccc(n1)C(=O)N 1P0067G9 [0,1,0,0,0,0|2,0,0]=3 1303 B10R1.113 Clc1cccc(n1)C(=O)O 1P00I91Z [0,1,0,0,0,0|3,0,0]=4 1304 B10R1.113 Clc1ccnc(c1)C(=O)Cl 1P00DEPJ [0,1,0,0,0,0|3,0,0]=4 1305 B10R1.113 Clc1cncc(c1)C(=O)Cl 1P004PP2 [0,1,0,0,0,0|1,0,0]=2 1306 B10R1.113 Clc1cncc(c1)N(=O)=O 1P003JQC [0,1,0,0,0,0|2,0,0]=3 1307 B10R1.113 Clc1cncc(n1)C(=O)Cl 1P001LKS [0,1,0,0,0,0|2,0,0]=3 1308 B10R1.113 Clc1cnnc(c1)C(=O)O 1P00A0QP [0,1,0,0,0,0|2,0,0]=3 1309 B10R1.113 Clc1nccc(c1)C(=O)C 1P003HDL [0,1,0,0,0,0|3,0,0]=4 1310 B10R1.113 Clc1nccc(c1)C(=O)Cl 1P003HJ8 [0,1,0,0,0,0|3,0,0]=4 1311 B10R1.113 Clc1nccc(c1)C(=O)N 1P0003HM [0,1,0,0,0,0|2,0,0]=3 1312 B10R1.113 Clc1nccc(c1)C(=O)O 1P003HAQ [0,1,0,0,0,0|3,0,0]=4 1313 B10R1.113 Clc1nccc(c1)C(=S)N 1P00H5D7 [0,1,0,0,0,0|2,1,0]=4 1314 B10R1.113 Clc1nccc(n1)C(=O)N 1P006Y5K [0,1,0,0,0,0|3,0,0]=4 1315 B10R1.113 FC(c1cncc(c1)Br)F 1P000EX5 [0,1,0,0,0,0|2,0,1]=4 1316 B10R1.113 FC(c1cncc(c1)N)F 1P01A3PF [0,1,0,0,0,0|2,0,1]=4 1317 B10R1.113 FC(c1cncc(c1)O)F 1P023P85 [0,1,0,0,0,0|2,0,1]=4 1318 B10R1.113 Fc1cccc(c1)C(=C)C 1P01AC8N [0,1,0,0,0,0|3,0,0]=4 1319 B10R1.113 Fc1cccc(c1)C(=N)N 1P00FB1F [0,1,0,0,0,0|2,0,0]=3 1320 B10R1.113 Fc1cccc(c1)C(=N)N 1P00ID2X [0,1,0,0,0,0|2,0,0]=3 1321 B10R1.113 Fc1cccc(c1)C(=O)C 1P003JXP [0,1,0,0,0,0|2,0,0]=3 1322 B10R1.113 Fc1cccc(c1)C(=O)Cl 1P00HZZM [0,1,0,0,0,0|2,0,0]=3 1323 B10R1.113 Fc1cccc(c1)C(=O)F 1P028ERF [0,1,0,0,0,0|2,0,0]=3 1324 B10R1.113 Fc1cccc(c1)C(=O)N 1P00DES0 [0,1,0,0,0,0|1,0,0]=2 1325 B10R1.113 Fc1cccc(c1)C(=O)O 1P003JXV [0,1,0,0,0,0|2,0,0]=3 1326 B10R1.113 Fc1cccc(c1)C(=O)[O-] 1P00DAE1 [0,1,0,0,0,0|2,0,0]=3 1327 B10R1.113 Fc1cccc(c1)C(=S)N 1P00FB1I [0,1,0,0,0,0|1,1,0]=3 1328 B10R1.113 Fc1cccc(c1)C(N)C 1P005HQ7 [0,1,0,0,0,0|2,0,1]=4 1329 B10R1.113 Fc1cccc(c1)C(N)C 1P01EII3 [0,1,0,0,0,0|2,0,1]=4 1330 B10R1.113 Fc1cccc(c1)S(=O)[O-] 1P01BEXD [0,1,0,0,0,0|3,0,0]=4 1331 B10R1.113 Fc1cccc(c1)[C@@H](N)C 1P007HTX [0,1,0,0,0,0|2,0,1]=4 1332 B10R1.113 Fc1cccc(c1)[C@@H](N)C 1P00DA1C [0,1,0,0,0,0|2,0,1]=4 1333 B10R1.113 Fc1cccc(c1)[C@H](N)C 1P007HTW [0,1,0,0,0,0|2,0,1]=4 1334 B10R1.113 Fc1cccc(c1)[C@H](N)C 1P008OXD [0,1,0,0,0,0|2,0,1]=4 1335 B10R1.113 Fc1cccc(c1)[N+](=O)[O-] 1P003ESO [0,1,0,0,0,0|3,0,0]=4 1336 B10R1.113 Fc1cccc(n1)C(=O)C 1P006WGK [0,1,0,0,0,0|3,0,0]=4 1337 B10R1.113 Fc1cccc(n1)C(=O)N 1P00C7F7 [0,1,0,0,0,0|2,0,0]=3 1338 B10R1.113 Fc1cccc(n1)C(=O)O 1P003HSX [0,1,0,0,0,0|3,0,0]=4 1339 B10R1.113 Fc1nccc(c1)C(=N)N 1P01FIRJ [0,1,0,0,0,0|3,0,0]=4 1340 B10R1.113 Fc1nccc(c1)C(=O)C 1P008RVB [0,1,0,0,0,0|3,0,0]=4 1341 B10R1.113 Fc1nccc(c1)C(=O)Cl 1P00EEA5 [0,1,0,0,0,0|3,0,0]=4 1342 B10R1.113 Fc1nccc(c1)C(=O)N 1P01A8DW [0,1,0,0,0,0|2,0,0]=3 1343 B10R1.113 Fc1nccc(c1)C(=O)O 1P003HSL [0,1,0,0,0,0|3,0,0]=4 1344 B10R1.113 Fc1nccc(c1)C(=S)N 1P01FKZJ [0,1,0,0,0,0|2,1,0]=4 1345 B10R1.113 Ic1cccc(c1)C(=O)C 1P001K5K [0,1,0,0,0,0|2,0,0]=3 1346 B10R1.113 Ic1cccc(c1)C(=O)Cl 1P003K2B [0,1,0,0,0,0|2,0,0]=3 1347 B10R1.113 Ic1cccc(c1)C(=O)N 1P0085PW [0,1,0,0,0,0|1,0,0]=2 1348 B10R1.113 Ic1cccc(c1)C(=O)O 1P003K29 [0,1,0,0,0,0|2,0,0]=3 1349 B10R1.113 Ic1cccc(c1)C(=S)N 1P007C9W [0,1,0,0,0,0|1,1,0]=3 1350 B10R1.113 Ic1cccc(c1)[N+](=O)[O-] 1P003395 [0,1,0,0,0,0|3,0,0]=4 1351 B10R1.113 Ic1cccc(n1)C(=O)O 1P00IAAK [0,1,0,0,0,0|3,0,0]=4 1352 B10R1.113 Ic1nccc(c1)C(=O)N 1P00C2N5 [0,1,0,0,0,0|2,0,0]=3 1353 B10R1.113 Ic1nccc(c1)C(=O)O 1P0033TU [0,1,0,0,0,0|3,0,0]=4 1354 B10R1.113 NC(=N)c1cc(=O)cc[nH]1 1P01A4LV [0,1,0,0,0,0|3,0,0]=4 1355 B10R1.113 NC(=N)c1cc(Br)ccn1 1P0090E5 [0,1,0,0,0,0|3,0,0]=4 1356 B10R1.113 NC(=N)c1cc(Br)cnc1 1P01B5A1 [0,1,0,0,0,0|1,0,0]=2 1357 B10R1.113 NC(=N)c1cc(Cl)ccn1 1P00FG6R [0,1,0,0,0,0|3,0,0]=4 1358 B10R1.113 NC(=N)c1cc(F)cnc1 1P01BV7A [0,1,0,0,0,0|1,0,0]=2 1359 B10R1.113 NC(=N)c1cccc(=O)[nH]1 1P01A4GU [0,1,0,0,0,0|3,0,0]=4 1360 B10R1.113 NC(=O)c1cc(Br)ccn1 1P00ECYG [0,1,0,0,0,0|2,0,0]=3 1361 B10R1.113 NC(=O)c1cc(Br)cnc1 1P002WR4 [0,1,0,0,0,0|0,0,0]=1 1362 B10R1.113 NC(=O)c1cc(Cl)ccn1 1P003LP2 [0,1,0,0,0,0|2,0,0]=3 1363 B10R1.113 NC(=O)c1cc(Cl)cnc1 1P00C4C5 [0,1,0,0,0,0|0,0,0]=1 1364 B10R1.113 NC(=O)c1cc(Cl)ncn1 1P00GK4N [0,1,0,0,0,0|3,0,0]=4 1365 B10R1.113 NC(=O)c1cc(F)cnc1 1P003N8D [0,1,0,0,0,0|0,0,0]=1 1366 B10R1.113 NC(=O)c1cc(O)cnc1 1P000550 [0,1,0,0,0,0|0,0,0]=1 1367 B10R1.113 NC(=O)c1cc(O)ncn1 1P00IKHA [0,1,0,0,0,0|3,0,0]=4 1368 B10R1.113 NC(=O)c1cncc(n1)Br 1P01JZAV [0,1,0,0,0,0|1,0,0]=2 1369 B10R1.113 NC(=O)c1cncc(n1)Cl 1P00C7DU [0,1,0,0,0,0|1,0,0]=2 1370 B10R1.113 NC(=O)c1cncc(n1)O 1P028A72 [0,1,0,0,0,0|1,0,0]=2 1371 B10R1.113 NC(=O)c1nc(Cl)ccn1 1P020LL0 [0,1,0,0,0,0|3,0,0]=4 1372 B10R1.113 NC(=S)c1cc(Br)cnc1 1P00H31Y [0,1,0,0,0,0|0,1,0]=2 1373 B10R1.113 NC(=S)c1cc(F)cnc1 1P01BV7C [0,1,0,0,0,0|0,1,0]=2 1374 B10R1.113 NC(=S)c1cc(O)cnc1 1P0284E1 [0,1,0,0,0,0|0,1,0]=2 1375 B10R1.113 NC1C=CC=C(C1)C(=O)O 1P00EBRR [0,1,0,0,0,0|2,0,1]=4 1376 B10R1.113 Nc1cc(cnc1)C(=O)O 1P003MV4 [0,1,0,0,0,0|1,0,0]=2 1377 B10R1.113 Nc1cc(cnn1)C(=O)O 1P000M84 [0,1,0,0,0,0|2,0,0]=3 1378 B10R1.113 Nc1cc(ncc1)C(=O)O 1P00014A [0,1,0,0,0,0|3,0,0]=4 1379 B10R1.113 Nc1cc(ncc1)C(=O)O 1P000ZD8 [0,1,0,0,0,0|3,0,0]=4 1380 B10R1.113 Nc1cc(ncc1)C(=O)O 1P003L8Q [0,1,0,0,0,0|3,0,0]=4 1381 B10R1.113 Nc1cccc(c1)C(=C)C 1P01CAQU [0,1,0,0,0,0|3,0,0]=4 1382 B10R1.113 Nc1cccc(c1)C(=N)N 1P003JDV [0,1,0,0,0,0|2,0,0]=3 1383 B10R1.113 Nc1cccc(c1)C(=O)C 1P003JDU [0,1,0,0,0,0|2,0,0]=3 1384 B10R1.113 Nc1cccc(c1)C(=O)N 1P0037SS [0,1,0,0,0,0|1,0,0]=2 1385 B10R1.113 Nc1cccc(c1)C(=O)O 1P003421 [0,1,0,0,0,0|2,0,0]=3 1386 B10R1.113 Nc1cccc(c1)C(=O)O 1P003JDW [0,1,0,0,0,0|2,0,0]=3 1387 B10R1.113 Nc1cccc(c1)C(=O)O 1P003JDX [0,1,0,0,0,0|2,0,0]=3 1388 B10R1.113 Nc1cccc(c1)C(=S)N 1P005DAW [0,1,0,0,0,0|1,1,0]=3 1389 B10R1.113 Nc1cccc(c1)C(N)C 1P000U2U [0,1,0,0,0,0|2,0,1]=4 1390 B10R1.113 Nc1cccc(c1)S(=O)C 1P019WQF [0,1,0,0,0,0|3,0,0]=4 1391 B10R1.113 Nc1cccc(c1)S(=O)C 1P01APKC [0,1,0,0,0,0|3,0,0]=4 1392 B10R1.113 Nc1cccc(c1)[C@@H](N)C 1P003CZD [0,1,0,0,0,0|2,0,1]=4 1393 B10R1.113 Nc1cccc(c1)[C@@H](N)C 1P01DE99 [0,1,0,0,0,0|2,0,1]=4 1394 B10R1.113 Nc1cccc(c1)[C@H](N)C 1P0090GW [0,1,0,0,0,0|2,0,1]=4 1395 B10R1.113 Nc1cccc(c1)[C@H](N)C 1P01TBU1 [0,1,0,0,0,0|2,0,1]=4 1396 B10R1.113 Nc1cccc(c1)[N+](=O)[O-] 1P003A52 [0,1,0,0,0,0|3,0,0]=4 1397 B10R1.113 Nc1cccc(c1)[N+](=O)[O-] 1P003K9M [0,1,0,0,0,0|3,0,0]=4 1398 B10R1.113 Nc1cccc(n1)C(=N)N 1P01A53E [0,1,0,0,0,0|3,0,0]=4 1399 B10R1.113 Nc1cccc(n1)C(=O)C 1P0096CI [0,1,0,0,0,0|3,0,0]=4 1400 B10R1.113 Nc1cccc(n1)C(=O)N 1P009WEN [0,1,0,0,0,0|2,0,0]=3 1401 B10R1.113 Nc1cccc(n1)C(=O)O 1P002OE4 [0,1,0,0,0,0|3,0,0]=4 1402 B10R1.113 Nc1cccc(n1)C(=S)N 1P01BU0O [0,1,0,0,0,0|2,1,0]=4 1403 B10R1.113 Nc1ccnc(c1)C(=N)N 1P01A61K [0,1,0,0,0,0|3,0,0]=4 1404 B10R1.113 Nc1ccnc(c1)C(=O)N 1P0001IS [0,1,0,0,0,0|2,0,0]=3 1405 B10R1.113 Nc1ccnc(c1)C(=S)N 1P0080GY [0,1,0,0,0,0|2,1,0]=4 1406 B10R1.113 Nc1cncc(c1)C(=O)N 1P003MV3 [0,1,0,0,0,0|0,0,0]=1 1407 B10R1.113 Nc1cncc(n1)C(=O)O 1P003NJM [0,1,0,0,0,0|2,0,0]=3 1408 B10R1.113 Nc1nccc(c1)C(=O)C 1P00CL4F [0,1,0,0,0,0|3,0,0]=4 1409 B10R1.113 Nc1nccc(c1)C(=O)N 1P0033K1 [0,1,0,0,0,0|2,0,0]=3 1410 B10R1.113 Nc1nccc(c1)C(=O)O 1P003H05 [0,1,0,0,0,0|3,0,0]=4 1411 B10R1.113 Nc1nccc(c1)C(=O)O 1P00J1XX [0,1,0,0,0,0|3,0,0]=4 1412 B10R1.113 Nc1nccc(n1)C(=O)N 1P00I1RZ [0,1,0,0,0,0|3,0,0]=4 1413 B10R1.113 O=c1cc[nH]c(c1)C(=O)O 1P00IKJ5 [0,1,0,0,0,0|3,0,0]=4 1414 B10R1.113 O=c1cccc(o1)C(=O)O 1P005Q2O [0,1,0,0,0,0|3,0,0]=4 1415 B10R1.113 O=c1ccoc(c1)C(=O)O 1P003PI6 [0,1,0,0,0,0|3,0,0]=4 1416 B10R1.113 O=n1cccc(c1)C(=O)O 1P003TKE [0,1,0,0,0,0|1,0,1]=3 1417 B10R1.113 OB(c1cncc(c1)Br)O 1P00I8YT [0,1,0,0,0,0|2,0,1]=4 1418 B10R1.113 OB(c1cncc(c1)C)O 1P001ZTM [0,1,0,0,0,0|2,0,1]=4 1419 B10R1.113 OB(c1cncc(c1)Cl)O 1P0036TF [0,1,0,0,0,0|2,0,1]=4 1420 B10R1.113 OB(c1cncc(c1)F)O 1P0034QL [0,1,0,0,0,0|2,0,1]=4 1421 B10R1.113 OB(c1cncc(c1)N)O 1P000DW3 [0,1,0,0,0,0|2,0,1]=4 1422 B10R1.113 OB(c1cncc(c1)N)O 1P000VU7 [0,1,0,0,0,0|2,0,1]=4 1423 B10R1.113 OC(=O)c1cc(Br)ccn1 1P0031O8 [0,1,0,0,0,0|3,0,0]=4 1424 B10R1.113 OC(=O)c1cc(Br)cnc1 1P002K2H [0,1,0,0,0,0|1,0,0]=2 1425 B10R1.113 OC(=O)c1cc(Br)nnc1 1P01RLDG [0,1,0,0,0,0|2,0,0]=3 1426 B10R1.113 OC(=O)c1cc(Cl)ccn1 1P003LP3 [0,1,0,0,0,0|3,0,0]=4 1427 B10R1.113 OC(=O)c1cc(Cl)cnc1 1P007ONC [0,1,0,0,0,0|1,0,0]=2 1428 B10R1.113 OC(=O)c1cc(Cl)nnc1 1P000OTO [0,1,0,0,0,0|2,0,0]=3 1429 B10R1.113 OC(=O)c1cc(F)ccn1 1P003A14 [0,1,0,0,0,0|3,0,0]=4 1430 B10R1.113 OC(=O)c1cc(F)cnc1 1P0034QK [0,1,0,0,0,0|1,0,0]=2 1431 B10R1.113 OC(=O)c1cc(I)ccn1 1P00I8FB [0,1,0,0,0,0|3,0,0]=4 1432 B10R1.113 OC(=O)c1cc(I)cnc1 1P00AKQU [0,1,0,0,0,0|1,0,0]=2 1433 B10R1.113 OC(=O)c1cc(S)cnc1 1P01C2E3 [0,1,0,0,0,0|1,0,0]=2 1434 B10R1.113 OC(=O)c1cc[nH]c(=S)c1 1P0039DI [0,1,0,0,0,0|3,0,0]=4 1435 B10R1.113 OC(=O)c1cccc(=O)[nH]1 1P003NP5 [0,1,0,0,0,0|3,0,0]=4 1436 B10R1.113 OC(=O)c1cccc(=S)[nH]1 1P001F54 [0,1,0,0,0,0|3,0,0]=4 1437 B10R1.113 OC(=O)c1cn[nH]c(=O)c1 1P0038UN [0,1,0,0,0,0|2,0,0]=3 1438 B10R1.113 OC(=O)c1cncc(=O)[nH]1 1P001B0Z [0,1,0,0,0,0|2,0,0]=3 1439 B10R1.113 OC(=O)c1cncc(n1)Br 1P000PR6 [0,1,0,0,0,0|2,0,0]=3 1440 B10R1.113 OC(=O)c1cncc(n1)Cl 1P002OLN [0,1,0,0,0,0|2,0,0]=3 1441 B10R1.113 Oc1cccc(c1)C(=N)N 1P00EEVR [0,1,0,0,0,0|2,0,0]=3 1442 B10R1.113 Oc1cccc(c1)C(=O)C 1P003K0U [0,1,0,0,0,0|2,0,0]=3 1443 B10R1.113 Oc1cccc(c1)C(=O)N 1P0037IV [0,1,0,0,0,0|1,0,0]=2 1444 B10R1.113 Oc1cccc(c1)C(=O)O 1P00346R [0,1,0,0,0,0|2,0,0]=3 1445 B10R1.113 Oc1cccc(c1)C(=O)[O-] 1P003URS [0,1,0,0,0,0|2,0,0]=3 1446 B10R1.113 Oc1cccc(c1)C(=S)N 1P007YNT [0,1,0,0,0,0|1,1,0]=3 1447 B10R1.113 Oc1cccc(c1)C(N)C 1P00ECSX [0,1,0,0,0,0|2,0,1]=4 1448 B10R1.113 Oc1cccc(c1)C(N)C 1P019V4B [0,1,0,0,0,0|2,0,1]=4 1449 B10R1.113 Oc1cccc(c1)S(=O)C 1P001NIU [0,1,0,0,0,0|3,0,0]=4 1450 B10R1.113 Oc1cccc(c1)[C@@H](N)C 1P000LS2 [0,1,0,0,0,0|2,0,1]=4 1451 B10R1.113 Oc1cccc(c1)[C@@H](N)C 1P024G1P [0,1,0,0,0,0|2,0,1]=4 1452 B10R1.113 Oc1cccc(c1)[C@H](N)C 1P00DG5L [0,1,0,0,0,0|2,0,1]=4 1453 B10R1.113 Oc1cccc(c1)[C@H](N)C 1P00G7LK [0,1,0,0,0,0|2,0,1]=4 1454 B10R1.113 Oc1cccc(c1)[N+](=O)[O-] 1P00DEND [0,1,0,0,0,0|3,0,0]=4 1455 B10R1.113 Oc1cccc(n1)C(=O)N 1P01DD88 [0,1,0,0,0,0|2,0,0]=3 1456 B10R1.113 Oc1ccnc(c1)C(=O)O 1P0034J9 [0,1,0,0,0,0|3,0,0]=4 1457 B10R1.113 Oc1cncc(c1)B(O)O 1P007PUU [0,1,0,0,0,0|2,0,1]=4 1458 B10R1.113 Oc1cncc(c1)C(=O)O 1P002VC0 [0,1,0,0,0,0|1,0,0]=2 1459 B10R1.113 Oc1cnnc(c1)C(=O)O 1P021ZE5 [0,1,0,0,0,0|2,0,0]=3 1460 B10R1.113 Oc1nccc(c1)C(=O)O 1P0033TH [0,1,0,0,0,0|3,0,0]=4 1461 B10R1.113 Oc1nccc(c1)C(=S)N 1P01BGQP [0,1,0,0,0,0|2,1,0]=4 1462 B10R1.113 Sc1cccc(c1)C(=O)C 1P01AK0X [0,1,0,0,0,0|2,0,0]=3 1463 B10R1.113 Sc1cccc(c1)C(=O)N 1P00EIKO [0,1,0,0,0,0|1,0,0]=2 1464 B10R1.113 Sc1cccc(c1)C(=O)O 1P003K32 [0,1,0,0,0,0|2,0,0]=3 1465 B10R1.113 Sc1cccc(c1)[N+](=O)[O-] 1P00CIK9 [0,1,0,0,0,0|3,0,0]=4 1466 B10R1.113 [O-]C(=O)c1cncc(n1)O 1P01BDFO [0,1,0,0,0,0|2,0,0]=3 1467 B10R1.113 [O-]S(=O)c1cc(Cl)cnc1 1P01FLAP [0,1,0,0,0,0|2,0,0]=3 1468 B10R1.113 [O-][N+](=O)c1cc(Br)cnc1 1P001QTY [0,1,0,0,0,0|2,0,0]=3 1469 B10R1.113 [O-][N+](=O)c1cc(C)cnc1 1P005WRS [0,1,0,0,0,0|2,0,0]=3 1470 B10R1.113 [O-][N+](=O)c1cc(F)cnc1 1P0038SR [0,1,0,0,0,0|2,0,0]=3 1471 B10R1.113 [O-][N+](=O)c1cc(N)cnc1 1P00632L [0,1,0,0,0,0|2,0,0]=3 1472 B10R1.113 [O-][N+](=O)c1cc(N)cnc1 1P009VWV [0,1,0,0,0,0|2,0,0]=3 1473 B10R1.113 [O-][N+](=O)c1cc(O)cnc1 1P00AQ9T [0,1,0,0,0,0|2,0,0]=3 1474 B10R1.113 [O-][n+]1cccc(c1)C(=O)C 1P001HRT [0,1,0,0,0,0|1,0,1]=3 1475 B10R1.113 [O-][n+]1cccc(c1)C(=O)N 1P002C45 [0,1,0,0,0,0|0,0,1]=2 1476 B8R0.7 CC\C=C\C=C\C(=O)O 1P028PCP [0,0,1,0,0,0|2,0,1]=4 1477 B8R0.7 NC\C=C\C=C\C(=O)O 1P0282JT [0,0,1,0,0,0|3,0,0]=4 1478 B10R2.6 N1CC1c2ccccc2 1P001MKW [0,0,0,1,0,0|2,0,1]=4 1479 B10R2.6 c1ccc(cn1)C2CC2 1P002HZK [0,0,0,1,0,0|2,0,1]=4 1480 B10R2.6 c1ccc(cn1)C2CO2 1P00ELQC [0,0,0,1,0,0|1,0,2]=4 1481 B10R2.320 NC1Cc2c1cccc2 1P002M98 [0,0,0,1,0,0|2,0,1]=4 1482 B10R2.320 O=C1Cc2c1cccc2 1P00C72G [0,0,0,1,0,0|2,0,0]=3 1483 B8R1.7 CC(=C)c1ccco1 1P01DDLR [0,0,0,0,1,0|3,0,0]=4 1484 B8R1.7 CC(=C1C=CC=C1)O 1P006CQI [0,0,0,0,1,0|1,0,1]=3 1485 B8R1.7 CC(=O)[C-]1C=CC=C1 1P000X4S [0,0,0,0,1,0|1,0,1]=3 1486 B8R1.7 CC(=O)[C-]1C=CC=C1 1P000XD8 [0,0,0,0,1,0|1,0,1]=3 1487 B8R1.7 CC(=O)c1c[nH]cc1 1P0039FK [0,0,0,0,1,0|1,0,1]=3 1488 B8R1.7 CC(=O)c1c[nH]cn1 1P00EB8A [0,0,0,0,1,0|2,0,0]=3 1489 B8R1.7 CC(=O)c1c[nH]nc1 1P002QO6 [0,0,0,0,1,0|2,0,0]=3 1490 B8R1.7 CC(=O)c1c[nH]nc1 1P01BHYR [0,0,0,0,1,0|2,0,0]=3 1491 B8R1.7 CC(=O)c1c[nH]nn1 1P01C1S8 [0,0,0,0,1,0|3,0,0]=4 1492 B8R1.7 CC(=O)c1ccc[nH]1 1P003GRE [0,0,0,0,1,0|1,0,1]=3 1493 B8R1.7 CC(=O)c1ccco1 1P000IT2 [0,0,0,0,1,0|2,0,0]=3 1494 B8R1.7 CC(=O)c1cccs1 1P0035MZ [0,0,0,0,1,0|2,0,0]=3 1495 B8R1.7 CC(=O)c1ccn[nH]1 1P00APO8 [0,0,0,0,1,0|2,0,0]=3 1496 B8R1.7 CC(=O)c1ccn[nH]1 1P00BGL1 [0,0,0,0,1,0|2,0,0]=3 1497 B8R1.7 CC(=O)c1ccno1 1P0049B3 [0,0,0,0,1,0|2,0,0]=3 1498 B8R1.7 CC(=O)c1ccns1 1P00C067 [0,0,0,0,1,0|2,0,0]=3 1499 B8R1.7 CC(=O)c1ccon1 1P00490X [0,0,0,0,1,0|2,0,0]=3 1500 B8R1.7 CC(=O)c1ccsn1 1P00H14V [0,0,0,0,1,0|2,0,0]=3 1501 B8R1.7 CC(=O)c1cnco1 1P009KIG [0,0,0,0,1,0|2,0,0]=3 1502 B8R1.7 CC(=O)c1cncs1 1P00GT31 [0,0,0,0,1,0|2,0,0]=3 1503 B8R1.7 CC(=O)c1cnn[nH]1 1P024SAL [0,0,0,0,1,0|3,0,0]=4 1504 B8R1.7 CC(=O)c1cnns1 1P0080BZ [0,0,0,0,1,0|3,0,0]=4 1505 B8R1.7 CC(=O)c1cocc1 1P009E7F [0,0,0,0,1,0|2,0,0]=3 1506 B8R1.7 CC(=O)c1cocn1 1P00H3H6 [0,0,0,0,1,0|2,0,0]=3 1507 B8R1.7 CC(=O)c1cscc1 1P001ETA [0,0,0,0,1,0|2,0,0]=3 1508 B8R1.7 CC(=O)c1cscn1 1P007BLA [0,0,0,0,1,0|2,0,0]=3 1509 B8R1.7 CC(=O)c1ncc[nH]1 1P00D9MM [0,0,0,0,1,0|2,0,0]=3 1510 B8R1.7 CC(=O)c1ncc[nH]1 1P01BDZZ [0,0,0,0,1,0|2,0,0]=3 1511 B8R1.7 CC(=O)c1ncco1 1P005DFY [0,0,0,0,1,0|2,0,0]=3 1512 B8R1.7 CC(=O)c1nccs1 1P003D8V [0,0,0,0,1,0|2,0,0]=3 1513 B8R1.7 CC(=O)c1nnc[nH]1 1P00ADE4 [0,0,0,0,1,0|3,0,0]=4 1514 B8R1.7 CC(=O)n1cccn1 1P0006NK [0,0,0,0,1,0|2,0,0]=3 1515 B8R1.7 CC(=O)n1cncc1 1P002PG2 [0,0,0,0,1,0|2,0,0]=3 1516 B8R1.7 CC(=O)n1cncn1 1P001P3G [0,0,0,0,1,0|3,0,0]=4 1517 B8R1.7 CC(c1[nH]cnc1)N 1P01K4D3 [0,0,0,0,1,0|2,0,1]=4 1518 B8R1.7 CC(c1c[nH]cc1)N 1P01A4UJ [0,0,0,0,1,0|1,0,2]=4 1519 B8R1.7 CC(c1c[nH]nc1)N 1P01A3A5 [0,0,0,0,1,0|2,0,1]=4 1520 B8R1.7 CC(c1c[nH]nc1)N 1P01AF15 [0,0,0,0,1,0|2,0,1]=4 1521 B8R1.7 CC(c1c[nH]nc1)N 1P028UUT [0,0,0,0,1,0|2,0,1]=4 1522 B8R1.7 CC(c1cc[nH]n1)N 1P0092LE [0,0,0,0,1,0|2,0,1]=4 1523 B8R1.7 CC(c1cc[nH]n1)N 1P00AO49 [0,0,0,0,1,0|2,0,1]=4 1524 B8R1.7 CC(c1ccc[nH]1)N 1P01A3OU [0,0,0,0,1,0|1,0,2]=4 1525 B8R1.7 CC(c1ccco1)N 1P00BDMZ [0,0,0,0,1,0|2,0,1]=4 1526 B8R1.7 CC(c1ccco1)N 1P019N05 [0,0,0,0,1,0|2,0,1]=4 1527 B8R1.7 CC(c1cccs1)N 1P0032QU [0,0,0,0,1,0|2,0,1]=4 1528 B8R1.7 CC(c1cccs1)N 1P00ATK3 [0,0,0,0,1,0|2,0,1]=4 1529 B8R1.7 CC(c1ccns1)N 1P01BY3O [0,0,0,0,1,0|2,0,1]=4 1530 B8R1.7 CC(c1ccns1)N 1P01BY4V [0,0,0,0,1,0|2,0,1]=4 1531 B8R1.7 CC(c1ccon1)N 1P01A3YI [0,0,0,0,1,0|2,0,1]=4 1532 B8R1.7 CC(c1ccon1)N 1P01AF6D [0,0,0,0,1,0|2,0,1]=4 1533 B8R1.7 CC(c1cncs1)N 1P0099H5 [0,0,0,0,1,0|2,0,1]=4 1534 B8R1.7 CC(c1cncs1)N 1P01EII7 [0,0,0,0,1,0|2,0,1]=4 1535 B8R1.7 CC(c1cocc1)N 1P00BDB1 [0,0,0,0,1,0|2,0,1]=4 1536 B8R1.7 CC(c1cocc1)N 1P01A1FQ [0,0,0,0,1,0|2,0,1]=4 1537 B8R1.7 CC(c1cocn1)N 1P0286V2 [0,0,0,0,1,0|2,0,1]=4 1538 B8R1.7 CC(c1cscc1)N 1P008U4D [0,0,0,0,1,0|2,0,1]=4 1539 B8R1.7 CC(c1cscn1)N 1P0089QY [0,0,0,0,1,0|2,0,1]=4 1540 B8R1.7 CC(c1csnc1)N 1P027Z0S [0,0,0,0,1,0|2,0,1]=4 1541 B8R1.7 CC(c1nc[nH]c1)N 1P00HSY9 [0,0,0,0,1,0|2,0,1]=4 1542 B8R1.7 CC(c1ncc[nH]1)N 1P00J2U6 [0,0,0,0,1,0|2,0,1]=4 1543 B8R1.7 CC(c1ncco1)N 1P00HBMP [0,0,0,0,1,0|2,0,1]=4 1544 B8R1.7 CC(c1ncco1)N 1P01BDX7 [0,0,0,0,1,0|2,0,1]=4 1545 B8R1.7 CC(c1nccs1)N 1P003DCD [0,0,0,0,1,0|2,0,1]=4 1546 B8R1.7 CC(c1nccs1)N 1P003DCE [0,0,0,0,1,0|2,0,1]=4 1547 B8R1.7 CC(c1ocnc1)N 1P01EIHC [0,0,0,0,1,0|2,0,1]=4 1548 B8R1.7 CC(c1scnc1)N 1P024UN9 [0,0,0,0,1,0|2,0,1]=4 1549 B8R1.7 C[C@@H](c1cccs1)N 1P000V48 [0,0,0,0,1,0|2,0,1]=4 1550 B8R1.7 C[C@@H](c1cccs1)N 1P00BJRY [0,0,0,0,1,0|2,0,1]=4 1551 B8R1.7 C[C@@H](c1cocc1)N 1P01KKHI [0,0,0,0,1,0|2,0,1]=4 1552 B8R1.7 C[C@@H](c1cscc1)N 1P00ASPZ [0,0,0,0,1,0|2,0,1]=4 1553 B8R1.7 C[C@@H](c1cscc1)N 1P029045 [0,0,0,0,1,0|2,0,1]=4 1554 B8R1.7 C[C@@H](c1ncc[nH]1)N 1P01ALS4 [0,0,0,0,1,0|2,0,1]=4 1555 B8R1.7 C[C@@H](c1nccs1)N 1P01KKJR [0,0,0,0,1,0|2,0,1]=4 1556 B8R1.7 C[C@@H](c1ncsc1)N 1P01K4C3 [0,0,0,0,1,0|2,0,1]=4 1557 B8R1.7 C[C@@H](c1scnc1)N 1P01AGG1 [0,0,0,0,1,0|2,0,1]=4 1558 B8R1.7 C[C@H](c1ccco1)N 1P01JV6O [0,0,0,0,1,0|2,0,1]=4 1559 B8R1.7 C[C@H](c1cccs1)N 1P00BJSF [0,0,0,0,1,0|2,0,1]=4 1560 B8R1.7 C[C@H](c1cccs1)N 1P01JV6J [0,0,0,0,1,0|2,0,1]=4 1561 B8R1.7 C[C@H](c1cocc1)N 1P028M77 [0,0,0,0,1,0|2,0,1]=4 1562 B8R1.7 C[C@H](c1cscc1)N 1P028ZD0 [0,0,0,0,1,0|2,0,1]=4 1563 B8R1.7 C[C@H](c1ncc[nH]1)N 1P01AM7T [0,0,0,0,1,0|2,0,1]=4 1564 B8R1.7 C[C@H](c1nccs1)N 1P00IN44 [0,0,0,0,1,0|2,0,1]=4 1565 B8R1.7 C[C@H](c1ncsc1)N 1P01K4RV [0,0,0,0,1,0|2,0,1]=4 1566 B8R1.7 C[C@H](c1scnc1)N 1P01A5OR [0,0,0,0,1,0|2,0,1]=4 1567 B8R1.7 ClC(=O)c1ccc[nH]1 1P01I097 [0,0,0,0,1,0|1,0,1]=3 1568 B8R1.7 ClC(=O)c1cccs1 1P003BQI [0,0,0,0,1,0|2,0,0]=3 1569 B8R1.7 ClC(=O)c1ccno1 1P003RMJ [0,0,0,0,1,0|2,0,0]=3 1570 B8R1.7 ClC(=O)c1ccns1 1P0078D4 [0,0,0,0,1,0|2,0,0]=3 1571 B8R1.7 ClC(=O)c1ccon1 1P01IAXG [0,0,0,0,1,0|2,0,0]=3 1572 B8R1.7 ClC(=O)c1cncs1 1P01BDDL [0,0,0,0,1,0|2,0,0]=3 1573 B8R1.7 ClC(=O)c1cocc1 1P002SR8 [0,0,0,0,1,0|2,0,0]=3 1574 B8R1.7 ClC(=O)c1cscc1 1P00IL11 [0,0,0,0,1,0|2,0,0]=3 1575 B8R1.7 ClC(=O)c1cscn1 1P00I7TT [0,0,0,0,1,0|2,0,0]=3 1576 B8R1.7 ClC(=O)n1cccn1 1P00I9ZM [0,0,0,0,1,0|2,0,0]=3 1577 B8R1.7 NC(=N)c1[nH]cnn1 1P028RW0 [0,0,0,0,1,0|3,0,0]=4 1578 B8R1.7 NC(=N)c1c[nH]nc1 1P0288R9 [0,0,0,0,1,0|2,0,0]=3 1579 B8R1.7 NC(=N)c1c[nH]nc1 1P028GUJ [0,0,0,0,1,0|2,0,0]=3 1580 B8R1.7 NC(=N)c1c[nH]nn1 1P01C51V [0,0,0,0,1,0|3,0,0]=4 1581 B8R1.7 NC(=N)c1cc[nH]n1 1P01A6TZ [0,0,0,0,1,0|2,0,0]=3 1582 B8R1.7 NC(=N)c1ccc[nH]1 1P0284JU [0,0,0,0,1,0|1,0,1]=3 1583 B8R1.7 NC(=N)c1ccco1 1P00D99M [0,0,0,0,1,0|2,0,0]=3 1584 B8R1.7 NC(=N)c1cccs1 1P00D9DQ [0,0,0,0,1,0|2,0,0]=3 1585 B8R1.7 NC(=N)c1ccon1 1P0283BE [0,0,0,0,1,0|2,0,0]=3 1586 B8R1.7 NC(=N)c1cncs1 1P01BFO7 [0,0,0,0,1,0|2,0,0]=3 1587 B8R1.7 NC(=N)c1cocc1 1P00DA52 [0,0,0,0,1,0|2,0,0]=3 1588 B8R1.7 NC(=N)c1cocn1 1P028CP3 [0,0,0,0,1,0|2,0,0]=3 1589 B8R1.7 NC(=N)c1cscc1 1P00DIZW [0,0,0,0,1,0|2,0,0]=3 1590 B8R1.7 NC(=N)c1cscn1 1P01AFYD [0,0,0,0,1,0|2,0,0]=3 1591 B8R1.7 NC(=N)c1ncc[nH]1 1P0026TX [0,0,0,0,1,0|2,0,0]=3 1592 B8R1.7 NC(=N)c1nccs1 1P002PJP [0,0,0,0,1,0|2,0,0]=3 1593 B8R1.7 NC(=N)c1nnc[nH]1 1P01A786 [0,0,0,0,1,0|3,0,0]=4 1594 B8R1.7 NC(=N)c1nnc[nH]1 1P01BDNE [0,0,0,0,1,0|3,0,0]=4 1595 B8R1.7 NC(=N)n1cccn1 1P00338J [0,0,0,0,1,0|2,0,0]=3 1596 B8R1.7 NC(=N)n1cncn1 1P003BIH [0,0,0,0,1,0|3,0,0]=4 1597 B8R1.7 NC(=O)C1CC=CC1 1P003PMO [0,0,0,0,1,0|0,0,3]=4 1598 B8R1.7 NC(=O)c1c[nH]cn1 1P00BDOS [0,0,0,0,1,0|1,0,0]=2 1599 B8R1.7 NC(=O)c1c[nH]nc1 1P003MH2 [0,0,0,0,1,0|1,0,0]=2 1600 B8R1.7 NC(=O)c1c[nH]nn1 1P00DKB1 [0,0,0,0,1,0|2,0,0]=3 1601 B8R1.7 NC(=O)c1cc[nH]n1 1P00C7JX [0,0,0,0,1,0|1,0,0]=2 1602 B8R1.7 NC(=O)c1ccc[nH]1 1P00DASS [0,0,0,0,1,0|0,0,1]=2 1603 B8R1.7 NC(=O)c1ccco1 1P003HT3 [0,0,0,0,1,0|1,0,0]=2 1604 B8R1.7 NC(=O)c1ccno1 1P0043TN [0,0,0,0,1,0|1,0,0]=2 1605 B8R1.7 NC(=O)c1ccon1 1P002XP4 [0,0,0,0,1,0|1,0,0]=2 1606 B8R1.7 NC(=O)c1ccsn1 1P00BVCR [0,0,0,0,1,0|1,0,0]=2 1607 B8R1.7 NC(=O)c1cnco1 1P001QI7 [0,0,0,0,1,0|1,0,0]=2 1608 B8R1.7 NC(=O)c1cncs1 1P008QNN [0,0,0,0,1,0|1,0,0]=2 1609 B8R1.7 NC(=O)c1cocc1 1P00EFS9 [0,0,0,0,1,0|1,0,0]=2 1610 B8R1.7 NC(=O)c1cocn1 1P002MBL [0,0,0,0,1,0|1,0,0]=2 1611 B8R1.7 NC(=O)c1cscc1 1P003V9E [0,0,0,0,1,0|1,0,0]=2 1612 B8R1.7 NC(=O)c1cscn1 1P00C1EW [0,0,0,0,1,0|1,0,0]=2 1613 B8R1.7 NC(=O)c1csnn1 1P00C0TL [0,0,0,0,1,0|2,0,0]=3 1614 B8R1.7 NC(=O)c1ncc[nH]1 1P001VZD [0,0,0,0,1,0|1,0,0]=2 1615 B8R1.7 NC(=O)c1ncco1 1P008CTP [0,0,0,0,1,0|1,0,0]=2 1616 B8R1.7 NC(=O)c1nccs1 1P001XS6 [0,0,0,0,1,0|1,0,0]=2 1617 B8R1.7 NC(=O)c1ncn[nH]1 1P003HTF [0,0,0,0,1,0|2,0,0]=3 1618 B8R1.7 NC(=O)c1nnn[nH]1 1P01BW0N [0,0,0,0,1,0|3,0,0]=4 1619 B8R1.7 NC(=S)c1c[nH]cc1 1P01DXAQ [0,0,0,0,1,0|0,1,1]=3 1620 B8R1.7 NC(=S)c1c[nH]cn1 1P00IK5D [0,0,0,0,1,0|1,1,0]=3 1621 B8R1.7 NC(=S)c1c[nH]nc1 1P0005YX [0,0,0,0,1,0|1,1,0]=3 1622 B8R1.7 NC(=S)c1cc[nH]n1 1P000WRG [0,0,0,0,1,0|1,1,0]=3 1623 B8R1.7 NC(=S)c1ccc[nH]1 1P00I7UK [0,0,0,0,1,0|0,1,1]=3 1624 B8R1.7 NC(=S)c1ccco1 1P0021LD [0,0,0,0,1,0|1,1,0]=3 1625 B8R1.7 NC(=S)c1cccs1 1P00293Y [0,0,0,0,1,0|1,1,0]=3 1626 B8R1.7 NC(=S)c1ccno1 1P0021DV [0,0,0,0,1,0|1,1,0]=3 1627 B8R1.7 NC(=S)c1ccsn1 1P01FL5D [0,0,0,0,1,0|1,1,0]=3 1628 B8R1.7 NC(=S)c1cnco1 1P0046TH [0,0,0,0,1,0|1,1,0]=3 1629 B8R1.7 NC(=S)c1cncs1 1P00BZE4 [0,0,0,0,1,0|1,1,0]=3 1630 B8R1.7 NC(=S)c1cocc1 1P00EBIY [0,0,0,0,1,0|1,1,0]=3 1631 B8R1.7 NC(=S)c1cocn1 1P0038MX [0,0,0,0,1,0|1,1,0]=3 1632 B8R1.7 NC(=S)c1conc1 1P00FB0Y [0,0,0,0,1,0|1,1,0]=3 1633 B8R1.7 NC(=S)c1cscc1 1P00BEIE [0,0,0,0,1,0|1,1,0]=3 1634 B8R1.7 NC(=S)c1cscn1 1P00G4NZ [0,0,0,0,1,0|1,1,0]=3 1635 B8R1.7 NC(=S)c1ncc[nH]1 1P00D8UW [0,0,0,0,1,0|1,1,0]=3 1636 B8R1.7 NC(=S)c1nccs1 1P00EAFR [0,0,0,0,1,0|1,1,0]=3 1637 B8R1.7 NC(=S)c1nnc[nH]1 1P019N4P [0,0,0,0,1,0|2,1,0]=4 1638 B8R1.7 NC(=S)c1nocn1 1P00BZXP [0,0,0,0,1,0|2,1,0]=4 1639 B8R1.7 NS(=O)c1ccco1 1P027UN7 [0,0,0,0,1,0|2,0,0]=3 1640 B8R1.7 OC(=O)[C-]1C=CC=C1 1P000X4X [0,0,0,0,1,0|1,0,1]=3 1641 B8R1.7 OC(=O)[C-]1C=CC=C1 1P000ZJ9 [0,0,0,0,1,0|1,0,1]=3 1642 B8R1.7 OC(=O)c1c[nH]cc1 1P003UJU [0,0,0,0,1,0|1,0,1]=3 1643 B8R1.7 OC(=O)c1c[nH]cn1 1P00338I [0,0,0,0,1,0|2,0,0]=3 1644 B8R1.7 OC(=O)c1c[nH]nc1 1P0034LR [0,0,0,0,1,0|2,0,0]=3 1645 B8R1.7 OC(=O)c1c[nH]nn1 1P003JZ0 [0,0,0,0,1,0|3,0,0]=4 1646 B8R1.7 OC(=O)c1cc[nH]n1 1P001T7R [0,0,0,0,1,0|2,0,0]=3 1647 B8R1.7 OC(=O)c1ccc[nH]1 1P00360N [0,0,0,0,1,0|1,0,1]=3 1648 B8R1.7 OC(=O)c1cccs1 1P003IEW [0,0,0,0,1,0|2,0,0]=3 1649 B8R1.7 OC(=O)c1ccn[nH]1 1P008M23 [0,0,0,0,1,0|2,0,0]=3 1650 B8R1.7 OC(=O)c1ccno1 1P003RMK [0,0,0,0,1,0|2,0,0]=3 1651 B8R1.7 OC(=O)c1ccns1 1P0008NL [0,0,0,0,1,0|2,0,0]=3 1652 B8R1.7 OC(=O)c1ccon1 1P0038IR [0,0,0,0,1,0|2,0,0]=3 1653 B8R1.7 OC(=O)c1ccsn1 1P006Z9D [0,0,0,0,1,0|2,0,0]=3 1654 B8R1.7 OC(=O)c1cnco1 1P0038RZ [0,0,0,0,1,0|2,0,0]=3 1655 B8R1.7 OC(=O)c1cncs1 1P001L77 [0,0,0,0,1,0|2,0,0]=3 1656 B8R1.7 OC(=O)c1cnn[nH]1 1P00EIWD [0,0,0,0,1,0|3,0,0]=4 1657 B8R1.7 OC(=O)c1cnn[nH]1 1P01JRD6 [0,0,0,0,1,0|3,0,0]=4 1658 B8R1.7 OC(=O)c1cnns1 1P00DIE1 [0,0,0,0,1,0|3,0,0]=4 1659 B8R1.7 OC(=O)c1cnon1 1P004BG6 [0,0,0,0,1,0|3,0,0]=4 1660 B8R1.7 OC(=O)c1cnsn1 1P0038LO [0,0,0,0,1,0|3,0,0]=4 1661 B8R1.7 OC(=O)c1cocc1 1P00346H [0,0,0,0,1,0|2,0,0]=3 1662 B8R1.7 OC(=O)c1cocn1 1P002MBN [0,0,0,0,1,0|2,0,0]=3 1663 B8R1.7 OC(=O)c1conc1 1P00EAGN [0,0,0,0,1,0|2,0,0]=3 1664 B8R1.7 OC(=O)c1cscc1 1P00348Y [0,0,0,0,1,0|2,0,0]=3 1665 B8R1.7 OC(=O)c1cscn1 1P003MJ5 [0,0,0,0,1,0|2,0,0]=3 1666 B8R1.7 OC(=O)c1csnc1 1P0050GK [0,0,0,0,1,0|2,0,0]=3 1667 B8R1.7 OC(=O)c1csnn1 1P003DRD [0,0,0,0,1,0|3,0,0]=4 1668 B8R1.7 OC(=O)c1n[nH]cn1 1P0036FG [0,0,0,0,1,0|3,0,0]=4 1669 B8R1.7 OC(=O)c1ncc[nH]1 1P00338H [0,0,0,0,1,0|2,0,0]=3 1670 B8R1.7 OC(=O)c1ncco1 1P0035WL [0,0,0,0,1,0|2,0,0]=3 1671 B8R1.7 OC(=O)c1ncco1 1P028A5I [0,0,0,0,1,0|2,0,0]=3 1672 B8R1.7 OC(=O)c1nccs1 1P001HT7 [0,0,0,0,1,0|2,0,0]=3 1673 B8R1.7 OC(=O)c1ncns1 1P00IMRS [0,0,0,0,1,0|3,0,0]=4 1674 B8R1.7 OC(=O)c1nocn1 1P00330S [0,0,0,0,1,0|3,0,0]=4 1675 B8R1.7 SC(=S)c1c[nH]cn1 1P003M0P [0,0,0,0,1,0|2,1,0]=4 1676 B8R1.7 [O-]C(=O)c1cccs1 1P002R08 [0,0,0,0,1,0|2,0,0]=3 1677 B8R1.7 [O-]C(=O)c1cccs1 1P00353G [0,0,0,0,1,0|2,0,0]=3 1678 B8R1.7 [O-]C(=O)c1cccs1 1P01XCZI [0,0,0,0,1,0|2,0,0]=3 1679 B8R1.7 [O-]C(=O)c1cncs1 1P01A8FB [0,0,0,0,1,0|2,0,0]=3 1680 B8R1.7 [O-]C(=O)c1cscn1 1P01A81R [0,0,0,0,1,0|2,0,0]=3 1681 B8R1.7 [O-]C(=O)c1ncco1 1P000O8D [0,0,0,0,1,0|2,0,0]=3 1682 B8R1.7 [O-]C(=O)c1nncs1 1P01EKKT [0,0,0,0,1,0|3,0,0]=4 1683 B8R1.7 [O-]C(=O)c1nscn1 1P0280RZ [0,0,0,0,1,0|3,0,0]=4 1684 B8R1.7 [O-]S(=O)c1c[nH]nc1 1P01C8PX [0,0,0,0,1,0|3,0,0]=4 1685 B8R1.7 [O-]S(=O)c1cccs1 1P019ZVR [0,0,0,0,1,0|3,0,0]=4 1686 B8R1.7 [O-][N+](=O)c1c[nH]cc1 1P003KAM [0,0,0,0,1,0|2,0,1]=4 1687 B8R1.7 [O-][N+](=O)c1c[nH]nc1 1P002JK9 [0,0,0,0,1,0|3,0,0]=4 1688 B8R1.7 [O-][N+](=O)c1cc[nH]n1 1P002UBE [0,0,0,0,1,0|3,0,0]=4 1689 B8R1.7 [O-][N+](=O)c1ccc[nH]1 1P0037M6 [0,0,0,0,1,0|2,0,1]=4 1690 B8R1.7 [O-][N+](=O)c1ccco1 1P003I9C [0,0,0,0,1,0|3,0,0]=4 1691 B8R1.7 [O-][N+](=O)c1cccs1 1P0033VP [0,0,0,0,1,0|3,0,0]=4 1692 B8R1.7 [O-][N+](=O)c1cnc[nH]1 1P0030A4 [0,0,0,0,1,0|3,0,0]=4 1693 B8R1.7 [O-][N+](=O)c1cncs1 1P001L73 [0,0,0,0,1,0|3,0,0]=4 1694 B8R1.7 [O-][N+](=O)c1conc1 1P007UXG [0,0,0,0,1,0|3,0,0]=4 1695 B8R1.7 [O-][N+](=O)c1csnc1 1P00GVGB [0,0,0,0,1,0|3,0,0]=4 1696 B8R1.7 [O-][N+](=O)c1ncc[nH]1 1P003I9D [0,0,0,0,1,0|3,0,0]=4 1697 B8R1.7 [O-][N+](=O)c1nccs1 1P001SIY [0,0,0,0,1,0|3,0,0]=4 1698 B8R1.7 [O-][N+](=O)n1cccn1 1P00FAD2 [0,0,0,0,1,0|3,0,0]=4 1699 B10R1.18 BrC(=C)Cc1ccccc1 1P01EX2V [0,0,0,0,0,1|3,0,0]=4 1700 B10R1.18 BrC(=Cc1ccccc1)Br 1P003C10 [0,0,0,0,0,1|3,0,0]=4 1701 B10R1.18 CC(=C)Cc1ccccc1 1P003I3I [0,0,0,0,0,1|3,0,0]=4 1702 B10R1.18 CC(=Cc1ccccc1)C 1P003I29 [0,0,0,0,0,1|3,0,0]=4 1703 B10R1.18 CC(=O)C[n+]1ccccc1 1P003ECO [0,0,0,0,0,1|3,0,0]=4 1704 B10R1.18 CC(=O)Cc1ccccn1 1P003A4L [0,0,0,0,0,1|3,0,0]=4 1705 B10R1.18 CC(=O)Cc1cccnc1 1P00EAER [0,0,0,0,0,1|1,0,0]=2 1706 B10R1.18 CC(=O)Cc1cccnc1 1P00FGXO [0,0,0,0,0,1|1,0,0]=2 1707 B10R1.18 CC(=O)Cc1ccncc1 1P003MHB [0,0,0,0,0,1|3,0,0]=4 1708 B10R1.18 CC(=O)Cc1ccncc1 1P006BSJ [0,0,0,0,0,1|3,0,0]=4 1709 B10R1.18 CC(=O)Cc1cnccn1 1P005PPF [0,0,0,0,0,1|2,0,0]=3 1710 B10R1.18 CC(=O)Nc1ccccc1 1P0034W2 [0,0,0,0,0,1|2,0,0]=3 1711 B10R1.18 CC(=O)Nc1ccccn1 1P003GRA [0,0,0,0,0,1|3,0,0]=4 1712 B10R1.18 CC(=O)Nc1cccnc1 1P003J9F [0,0,0,0,0,1|1,0,0]=2 1713 B10R1.18 CC(=O)Nc1ccncc1 1P00DD6H [0,0,0,0,0,1|3,0,0]=4 1714 B10R1.18 CC(=O)Oc1ccccc1 1P00170L [0,0,0,0,0,1|2,0,0]=3 1715 B10R1.18 CC(=O)Oc1cccnc1 1P0025SK [0,0,0,0,0,1|1,0,0]=2 1716 B10R1.18 CC(=O)Sc1ccccc1 1P003UVL [0,0,0,0,0,1|2,0,0]=3 1717 B10R1.18 CC(=S)Nc1ccccc1 1P003V8U [0,0,0,0,0,1|2,1,0]=4 1718 B10R1.18 CC(Cc1cccnc1)C 1P001H4I [0,0,0,0,0,1|2,0,1]=4 1719 B10R1.18 CC(Cc1cccnc1)N 1P005KG1 [0,0,0,0,0,1|1,0,1]=3 1720 B10R1.18 CC(Cc1cccnc1)O 1P01A55E [0,0,0,0,0,1|1,0,2]=4 1721 B10R1.18 CC(Cc1cnccn1)N 1P0089WO [0,0,0,0,0,1|2,0,1]=4 1722 B10R1.18 CC(Nc1cccnc1)C 1P00CMF9 [0,0,0,0,0,1|2,0,1]=4 1723 B10R1.18 CC(Oc1cccnc1)C 1P004EQ5 [0,0,0,0,0,1|2,0,1]=4 1724 B10R1.18 CN(Cc1cccnc1)C 1P002ALG [0,0,0,0,0,1|3,0,0]=4 1725 B10R1.18 ClC(=Cc1ccccc1)Cl 1P00FH9O [0,0,0,0,0,1|3,0,0]=4 1726 B10R1.18 ClC(=O)Cc1ccccc1 1P0035XP [0,0,0,0,0,1|2,0,0]=3 1727 B10R1.18 ClC(=O)Nc1ccccc1 1P01B2IA [0,0,0,0,0,1|2,0,0]=3 1728 B10R1.18 ClC(=O)Nc1ccncc1 1P01A60B [0,0,0,0,0,1|3,0,0]=4 1729 B10R1.18 ClC(=S)Oc1ccccc1 1P0002M7 [0,0,0,0,0,1|2,1,0]=4 1730 B10R1.18 ClC(=S)Sc1ccccc1 1P001YYN [0,0,0,0,0,1|2,1,0]=4 1731 B10R1.18 FC(Oc1cccnc1)F 1P019XOW [0,0,0,0,0,1|2,0,1]=4 1732 B10R1.18 NC(=N)Cc1ccccc1 1P002QJI [0,0,0,0,0,1|2,0,0]=3 1733 B10R1.18 NC(=N)Cc1ccccn1 1P00914U [0,0,0,0,0,1|3,0,0]=4 1734 B10R1.18 NC(=N)Cc1cccnc1 1P00J2G5 [0,0,0,0,0,1|1,0,0]=2 1735 B10R1.18 NC(=N)Cc1ccncc1 1P01C5XH [0,0,0,0,0,1|3,0,0]=4 1736 B10R1.18 NC(=N)Cc1ccncc1 1P01C62X [0,0,0,0,0,1|3,0,0]=4 1737 B10R1.18 NC(=N)Nc1ccccc1 1P002D2V [0,0,0,0,0,1|2,0,0]=3 1738 B10R1.18 NC(=N)Nc1ccccc1 1P003U6D [0,0,0,0,0,1|2,0,0]=3 1739 B10R1.18 NC(=N)Nc1cccnc1 1P02804D [0,0,0,0,0,1|1,0,0]=2 1740 B10R1.18 NC(=O)C[n+]1ccccc1 1P003DIN [0,0,0,0,0,1|2,0,0]=3 1741 B10R1.18 NC(=O)Cc1ccccc1 1P0032QS [0,0,0,0,0,1|1,0,0]=2 1742 B10R1.18 NC(=O)Cc1ccccn1 1P003UJ1 [0,0,0,0,0,1|2,0,0]=3 1743 B10R1.18 NC(=O)Cc1cccnc1 1P003FL2 [0,0,0,0,0,1|0,0,0]=1 1744 B10R1.18 NC(=O)Cc1ccncc1 1P003UJ8 [0,0,0,0,0,1|2,0,0]=3 1745 B10R1.18 NC(=O)Cc1cncnc1 1P00E15B [0,0,0,0,0,1|1,0,0]=2 1746 B10R1.18 NC(=O)Cc1ncccn1 1P00171T [0,0,0,0,0,1|3,0,0]=4 1747 B10R1.18 NC(=O)Nc1ccccc1 1P00E9LB [0,0,0,0,0,1|1,0,0]=2 1748 B10R1.18 NC(=O)Nc1ccccn1 1P000W31 [0,0,0,0,0,1|2,0,0]=3 1749 B10R1.18 NC(=O)Nc1cccnc1 1P000W30 [0,0,0,0,0,1|0,0,0]=1 1750 B10R1.18 NC(=O)Nc1ccncc1 1P0011DS [0,0,0,0,0,1|2,0,0]=3 1751 B10R1.18 NC(=O)Nc1cnccn1 1P00IEKK [0,0,0,0,0,1|1,0,0]=2 1752 B10R1.18 NC(=O)Oc1ccccc1 1P003U5L [0,0,0,0,0,1|1,0,0]=2 1753 B10R1.18 NC(=S)Cc1ccccc1 1P0032QT [0,0,0,0,0,1|1,1,0]=3 1754 B10R1.18 NC(=S)Cc1ccccn1 1P002TKX [0,0,0,0,0,1|2,1,0]=4 1755 B10R1.18 NC(=S)Cc1cccnc1 1P00DJ97 [0,0,0,0,0,1|0,1,0]=2 1756 B10R1.18 NC(=S)Nc1ccccn1 1P003BQD [0,0,0,0,0,1|2,1,0]=4 1757 B10R1.18 NC(=S)Nc1cccnc1 1P003KD0 [0,0,0,0,0,1|0,1,0]=2 1758 B10R1.18 NC(=S)Nc1cnccn1 1P007JW2 [0,0,0,0,0,1|1,1,0]=3 1759 B10R1.18 NS(=O)Cc1ccccc1 1P01BG08 [0,0,0,0,0,1|2,0,0]=3 1760 B10R1.18 OC(=O)C[n+]1ccccc1 1P01EUQ6 [0,0,0,0,0,1|3,0,0]=4 1761 B10R1.18 OC(=O)Cc1ccccc1 1P003OC7 [0,0,0,0,0,1|2,0,0]=3 1762 B10R1.18 OC(=O)Cc1ccccn1 1P001WD0 [0,0,0,0,0,1|3,0,0]=4 1763 B10R1.18 OC(=O)Cc1cccnc1 1P00348U [0,0,0,0,0,1|1,0,0]=2 1764 B10R1.18 OC(=O)Cc1cccnc1 1P00I9F0 [0,0,0,0,0,1|1,0,0]=2 1765 B10R1.18 OC(=O)Cc1ccncc1 1P0034LT [0,0,0,0,0,1|3,0,0]=4 1766 B10R1.18 OC(=O)Cc1ccncc1 1P00BCK4 [0,0,0,0,0,1|3,0,0]=4 1767 B10R1.18 OC(=O)Cc1ccnnc1 1P00HYGS [0,0,0,0,0,1|2,0,0]=3 1768 B10R1.18 OC(=O)Cc1cnccn1 1P001DGI [0,0,0,0,0,1|2,0,0]=3 1769 B10R1.18 OC(=O)Cc1cncnc1 1P0034RS [0,0,0,0,0,1|2,0,0]=3 1770 B10R1.18 OC(=O)Cc1cncnc1 1P01BFQH [0,0,0,0,0,1|2,0,0]=3 1771 B10R1.18 OC(=O)Nc1ccccc1 1P007CT0 [0,0,0,0,0,1|2,0,0]=3 1772 B10R1.18 OS(=O)Cc1ccccc1 1P01C4HC [0,0,0,0,0,1|3,0,0]=4 1773 B10R1.18 [O-]C(=O)C[n+]1ccccc1 1P00EKK8 [0,0,0,0,0,1|3,0,0]=4 1774 B10R1.18 [O-]C(=O)Cc1cccnn1 1P00IL7P [0,0,0,0,0,1|2,0,0]=3 1775 B10R1.18 [O-]C(=O)Cc1cccnn1 1P027YSR [0,0,0,0,0,1|2,0,0]=3 1776 B10R1.18 [O-]C(=O)Cc1cnccn1 1P01B83X [0,0,0,0,0,1|2,0,0]=3 1777 B10R1.18 [O-]S(=O)Cc1ccccc1 1P01BCPB [0,0,0,0,0,1|3,0,0]=4 1778 B10R1.18 [O-][N+](=O)Cc1ccccc1 1P019DUF [0,0,0,0,0,1|3,0,0]=4 1779 B10R1.348 OC(=O)C1C=CC=CC=C1 1P01BDNG [0,0,0,0,0,1|2,0,1]=4 1780 B7R0.1 CCC=CC=CC=O 1P00E9KG [1,0,1,0,0,0|1,0,1]=4 1781 B7R0.1 CC\C=C\C=C\C=O 1P003VBB [1,0,1,0,0,0|1,0,1]=4 1782 B7R0.4 CC(=O)OC=CC=C 1P001NUC [1,0,1,0,0,0|2,0,0]=4 1783 B7R0.4 C\C=C/C=C/C(=O)O 1P0030BP [1,0,1,0,0,0|1,0,1]=4 1784 B7R0.4 C\C=C\C=C\C(=O)C 1P003GC2 [1,0,1,0,0,0|1,0,1]=4 1785 B7R0.4 C\C=C\C=C\C(=O)Cl 1P002SB9 [1,0,1,0,0,0|1,0,1]=4 1786 B7R0.4 C\C=C\C=C\C(=O)O 1P003UVD [1,0,1,0,0,0|1,0,1]=4 1787 B7R0.4 C\C=C\C=C\C(=O)[O-] 1P002PCF [1,0,1,0,0,0|1,0,1]=4 1788 B7R0.4 C\C=C\C=C\C(=O)[O-] 1P003UUR [1,0,1,0,0,0|1,0,1]=4 1789 B7R0.4 C\C=C\C=C\C(=O)[O-] 1P005GWB [1,0,1,0,0,0|1,0,1]=4 1790 B7R0.4 OC(=O)C\C=C\C=C 1P01BSMX [1,0,1,0,0,0|1,0,1]=4 1791 B7R0.5 C\C(=C/C=C)\C(=O)O 1P028VMJ [1,0,1,0,0,0|1,0,1]=4 1792 B7R0.5 ClC(=O)C(=C)CC=C 1P028XGZ [1,0,1,0,0,0|1,0,1]=4 1793 B7R0.5 OC(=O)C(=C)CC=C 1P028JZR [1,0,1,0,0,0|1,0,1]=4 1794 B7R1.3 Br[13c]1[13cH][13cH][13cH][13cH][13cH]1 1P008T6V [2,0,0,0,0,0|2,0,0]=4 1795 B7R1.3 Brc1cc[c]nc1 1P003MWR [2,0,0,0,0,0|1,0,1]=4 1796 B7R1.3 Brc1cccnc1 1P00343S [2,0,0,0,0,0|1,0,0]=3 1797 B7R1.3 Brc1cccnn1 1P00343R [2,0,0,0,0,0|2,0,0]=4 1798 B7R1.3 Brc1ccnnc1 1P000WQH [2,0,0,0,0,0|2,0,0]=4 1799 B7R1.3 Brc1ccnnc1 1P00171L [2,0,0,0,0,0|2,0,0]=4 1800 B7R1.3 Brc1cnccn1 1P0033NL [2,0,0,0,0,0|2,0,0]=4 1801 B7R1.3 Brc1cnccn1 1P01ANMT [2,0,0,0,0,0|2,0,0]=4 1802 B7R1.3 Brc1cncnc1 1P0034P7 [2,0,0,0,0,0|2,0,0]=4 1803 B7R1.3 Cc1cccnc1 1P003486 [2,0,0,0,0,0|0,0,1]=3 1804 B7R1.3 Cc1cccnn1 1P001UBK [2,0,0,0,0,0|1,0,1]=4 1805 B7R1.3 Cc1ccnnc1 1P00HCT0 [2,0,0,0,0,0|1,0,1]=4 1806 B7R1.3 Cc1cnccn1 1P003I6Y [2,0,0,0,0,0|1,0,1]=4 1807 B7R1.3 Cc1cncnc1 1P0029HT [2,0,0,0,0,0|1,0,1]=4 1808 B7R1.3 Clc1ccccc1 1P003522 [2,0,0,0,0,0|2,0,0]=4 1809 B7R1.3 Clc1cccnc1 1P003JSA [2,0,0,0,0,0|1,0,0]=3 1810 B7R1.3 Clc1cccnn1 1P00345B [2,0,0,0,0,0|2,0,0]=4 1811 B7R1.3 Clc1cccnn1 1P003ARR [2,0,0,0,0,0|2,0,0]=4 1812 B7R1.3 Clc1ccnnc1 1P000J2M [2,0,0,0,0,0|2,0,0]=4 1813 B7R1.3 Clc1ccnnc1 1P007DV7 [2,0,0,0,0,0|2,0,0]=4 1814 B7R1.3 Clc1cnccn1 1P001L0E [2,0,0,0,0,0|2,0,0]=4 1815 B7R1.3 Clc1cncnc1 1P007DV6 [2,0,0,0,0,0|2,0,0]=4 1816 B7R1.3 Fc1ccccc1 1P0035E9 [2,0,0,0,0,0|2,0,0]=4 1817 B7R1.3 Fc1cccnc1 1P003JYE [2,0,0,0,0,0|1,0,0]=3 1818 B7R1.3 Fc1cnccn1 1P00D9L3 [2,0,0,0,0,0|2,0,0]=4 1819 B7R1.3 Fc1cncnc1 1P0060KF [2,0,0,0,0,0|2,0,0]=4 1820 B7R1.3 Ic1ccccc1 1P0035HS [2,0,0,0,0,0|2,0,0]=4 1821 B7R1.3 Ic1cccnc1 1P003476 [2,0,0,0,0,0|1,0,0]=3 1822 B7R1.3 Ic1cccnn1 1P01BGGD [2,0,0,0,0,0|2,0,0]=4 1823 B7R1.3 Ic1ccnnc1 1P019GH6 [2,0,0,0,0,0|2,0,0]=4 1824 B7R1.3 Ic1cnccn1 1P0035HV [2,0,0,0,0,0|2,0,0]=4 1825 B7R1.3 Ic1cncnc1 1P0037VD [2,0,0,0,0,0|2,0,0]=4 1826 B7R1.3 N[13c]1[13cH][13cH][13cH][13cH][13cH]1 1P0003HD [2,0,0,0,0,0|1,0,0]=3 1827 B7R1.3 N[n+]1ccccc1 1P003EEU [2,0,0,0,0,0|2,0,0]=4 1828 B7R1.3 Nc1ccccc1 1P003OD2 [2,0,0,0,0,0|1,0,0]=3 1829 B7R1.3 Nc1ccccc1 1P003OD4 [2,0,0,0,0,0|1,0,0]=3 1830 B7R1.3 Nc1ccccc1 1P003OD5 [2,0,0,0,0,0|1,0,0]=3 1831 B7R1.3 Nc1ccccc1 1P00DANN [2,0,0,0,0,0|1,0,0]=3 1832 B7R1.3 Nc1ccccn1 1P00CMJB [2,0,0,0,0,0|2,0,0]=4 1833 B7R1.3 Nc1cccnc1 1P003JEQ [2,0,0,0,0,0|0,0,0]=2 1834 B7R1.3 Nc1cccnn1 1P003426 [2,0,0,0,0,0|1,0,0]=3 1835 B7R1.3 Nc1cccnn1 1P0089JT [2,0,0,0,0,0|1,0,0]=3 1836 B7R1.3 Nc1ccncc1 1P0039PA [2,0,0,0,0,0|2,0,0]=4 1837 B7R1.3 Nc1ccnnc1 1P001CGL [2,0,0,0,0,0|1,0,0]=3 1838 B7R1.3 Nc1ccnnc1 1P002JIJ [2,0,0,0,0,0|1,0,0]=3 1839 B7R1.3 Nc1cnccn1 1P003H0L [2,0,0,0,0,0|1,0,0]=3 1840 B7R1.3 Nc1cncnc1 1P0034NO [2,0,0,0,0,0|1,0,0]=3 1841 B7R1.3 Nc1cnncn1 1P0050GR [2,0,0,0,0,0|2,0,0]=4 1842 B7R1.3 Nc1nccnn1 1P003JAB [2,0,0,0,0,0|2,0,0]=4 1843 B7R1.3 O=c1cc[nH]cc1 1P007C4C [2,0,0,0,0,0|2,0,0]=4 1844 B7R1.3 O=c1cc[nH]nc1 1P001ZYO [2,0,0,0,0,0|1,0,0]=3 1845 B7R1.3 O=c1cccc[nH]1 1P00HWQR [2,0,0,0,0,0|2,0,0]=4 1846 B7R1.3 O=c1cccco1 1P003O98 [2,0,0,0,0,0|2,0,0]=4 1847 B7R1.3 O=c1ccocc1 1P003LXT [2,0,0,0,0,0|2,0,0]=4 1848 B7R1.3 O=c1cncc[nH]1 1P003HWP [2,0,0,0,0,0|1,0,0]=3 1849 B7R1.3 O[13c]1[13cH][13cH][13cH][13cH][13cH]1 1P00GVQD [2,0,0,0,0,0|1,0,1]=4 1850 B7R1.3 Oc1ccccc1 1P0000NN [2,0,0,0,0,0|1,0,1]=4 1851 B7R1.3 Oc1cccnc1 1P003K1M [2,0,0,0,0,0|0,0,1]=3 1852 B7R1.3 Oc1cccnn1 1P00DEIH [2,0,0,0,0,0|1,0,1]=4 1853 B7R1.3 Oc1ccnnc1 1P002JFR [2,0,0,0,0,0|1,0,1]=4 1854 B7R1.3 Oc1cnccn1 1P000N6P [2,0,0,0,0,0|1,0,1]=4 1855 B7R1.3 Oc1cncnc1 1P002TRI [2,0,0,0,0,0|1,0,1]=4 1856 B7R1.3 Pc1ccccc1 1P003U5W [2,0,0,0,0,0|1,1,0]=4 1857 B7R1.3 S=c1cccn[nH]1 1P002W4Y [2,0,0,0,0,0|1,1,0]=4 1858 B7R1.3 Sc1cccnc1 1P001SU2 [2,0,0,0,0,0|0,1,0]=3 1859 B7R1.3 Sc1cnccn1 1P003HZ3 [2,0,0,0,0,0|1,1,0]=4 1860 B7R1.3 [15NH2]c1ccccc1 1P00FDEF [2,0,0,0,0,0|1,0,0]=3 1861 B7R1.3 [NH3+]c1ccccc1 1P00DL00 [2,0,0,0,0,0|1,0,1]=4 1862 B7R1.3 [O]c1cncnc1 1P002VWK [2,0,0,0,0,0|1,0,1]=4 1863 B7R1.3 [S-]c1ccccc1 1P00BLKE [2,0,0,0,0,0|1,1,0]=4 1864 B7R1.3 [SeH]c1ccccc1 1P003U6T [2,0,0,0,0,0|1,1,0]=4 1865 B7R1.3 [SiH3]c1ccccc1 1P0039OY [2,0,0,0,0,0|1,1,0]=4 1866 B9R0.2 C=CC=CC=CCC(=O)C 1P0286AW [0,1,1,0,0,0|2,0,0]=4 1867 B9R1.1 BrCc1ccc(nc1)Br 1P0006NA [1,1,0,0,0,0|1,0,1]=4 1868 B9R1.1 BrCc1ccc(nc1)C 1P003AJ4 [1,1,0,0,0,0|1,0,1]=4 1869 B9R1.1 BrCc1ccc(nc1)Cl 1P0024PV [1,1,0,0,0,0|1,0,1]=4 1870 B9R1.1 BrCc1ccc(nc1)F 1P008U70 [1,1,0,0,0,0|1,0,1]=4 1871 B9R1.1 BrCc1ccc(nc1)F 1P01FTR4 [1,1,0,0,0,0|1,0,1]=4 1872 B9R1.1 BrCc1ccc(nc1)N 1P01B29T [1,1,0,0,0,0|1,0,1]=4 1873 B9R1.1 Brc1ccc(nn1)C=O 1P01JWIG [1,1,0,0,0,0|1,0,0]=3 1874 B9R1.1 Brc1cnc(cn1)C=O 1P009W0Q [1,1,0,0,0,0|1,0,0]=3 1875 B9R1.1 C#Cc1ccc(nc1)Br 1P00EFUK [1,1,0,0,0,0|1,0,1]=4 1876 B9R1.1 C#Cc1ccc(nc1)C 1P0092A5 [1,1,0,0,0,0|1,0,1]=4 1877 B9R1.1 C#Cc1ccc(nc1)C 1P00ARIA [1,1,0,0,0,0|1,0,1]=4 1878 B9R1.1 C#Cc1ccc(nc1)Cl 1P002T37 [1,1,0,0,0,0|1,0,1]=4 1879 B9R1.1 C#Cc1ccc(nc1)F 1P004L78 [1,1,0,0,0,0|1,0,1]=4 1880 B9R1.1 C#Cc1ccc(nc1)N 1P008K1E [1,1,0,0,0,0|1,0,1]=4 1881 B9R1.1 C=Cc1ccc(cc1)Br 1P0029MX [1,1,0,0,0,0|2,0,0]=4 1882 B9R1.1 C=Cc1ccc(cc1)C 1P003M9D [1,1,0,0,0,0|2,0,0]=4 1883 B9R1.1 C=Cc1ccc(cc1)Cl 1P0038SY [1,1,0,0,0,0|2,0,0]=4 1884 B9R1.1 C=Cc1ccc(cc1)F 1P00I8EG [1,1,0,0,0,0|2,0,0]=4 1885 B9R1.1 C=Cc1ccc(cc1)I 1P002NYE [1,1,0,0,0,0|2,0,0]=4 1886 B9R1.1 C=Cc1ccc(cc1)N 1P0038QW [1,1,0,0,0,0|2,0,0]=4 1887 B9R1.1 C=Cc1ccc(cc1)O 1P002T1L [1,1,0,0,0,0|2,0,0]=4 1888 B9R1.1 C=Cc1ccc(nc1)Br 1P01DLDS [1,1,0,0,0,0|1,0,0]=3 1889 B9R1.1 C=Cc1ccc(nc1)C 1P001CDY [1,1,0,0,0,0|1,0,0]=3 1890 B9R1.1 C=Cc1ccc(nc1)Cl 1P001Q28 [1,1,0,0,0,0|1,0,0]=3 1891 B9R1.1 C=Cc1ccc(nc1)Cl 1P028BUU [1,1,0,0,0,0|1,0,0]=3 1892 B9R1.1 C=Cc1ccc(nc1)F 1P0008U5 [1,1,0,0,0,0|1,0,0]=3 1893 B9R1.1 C=Cc1ccc(nc1)O 1P01DH08 [1,1,0,0,0,0|1,0,0]=3 1894 B9R1.1 C=Cc1cnc(nc1)Cl 1P000WPE [1,1,0,0,0,0|2,0,0]=4 1895 B9R1.1 C=Cc1cnc(nc1)N 1P007V86 [1,1,0,0,0,0|2,0,0]=4 1896 B9R1.1 CCc1ccc(nc1)Br 1P002BZE [1,1,0,0,0,0|1,0,1]=4 1897 B9R1.1 CCc1ccc(nc1)C 1P003N6Q [1,1,0,0,0,0|1,0,1]=4 1898 B9R1.1 CCc1ccc(nc1)Cl 1P00GVTP [1,1,0,0,0,0|1,0,1]=4 1899 B9R1.1 CCc1ccc(nc1)F 1P024ZTD [1,1,0,0,0,0|1,0,1]=4 1900 B9R1.1 CCc1ccc(nc1)N 1P002BZF [1,1,0,0,0,0|1,0,1]=4 1901 B9R1.1 CCc1ccc(nc1)O 1P00D8JL [1,1,0,0,0,0|1,0,1]=4 1902 B9R1.1 CNc1ccc(nc1)Br 1P00941T [1,1,0,0,0,0|2,0,0]=4 1903 B9R1.1 CNc1ccc(nc1)C 1P00943F [1,1,0,0,0,0|2,0,0]=4 1904 B9R1.1 CNc1ccc(nc1)Cl 1P008UXG [1,1,0,0,0,0|2,0,0]=4 1905 B9R1.1 CNc1ccc(nc1)F 1P00AOFA [1,1,0,0,0,0|2,0,0]=4 1906 B9R1.1 CNc1ccc(nc1)N 1P019SL4 [1,1,0,0,0,0|2,0,0]=4 1907 B9R1.1 COc1ccc(nc1)Br 1P0038TC [1,1,0,0,0,0|2,0,0]=4 1908 B9R1.1 COc1ccc(nc1)C 1P00IABL [1,1,0,0,0,0|2,0,0]=4 1909 B9R1.1 COc1ccc(nc1)Cl 1P001BS1 [1,1,0,0,0,0|2,0,0]=4 1910 B9R1.1 COc1ccc(nc1)F 1P00130G [1,1,0,0,0,0|2,0,0]=4 1911 B9R1.1 COc1ccc(nc1)I 1P001U9H [1,1,0,0,0,0|2,0,0]=4 1912 B9R1.1 COc1ccc(nc1)N 1P0005LO [1,1,0,0,0,0|2,0,0]=4 1913 B9R1.1 CSc1ccc(nc1)Br 1P009EF8 [1,1,0,0,0,0|2,0,0]=4 1914 B9R1.1 CSc1ccc(nc1)Cl 1P00CKSD [1,1,0,0,0,0|2,0,0]=4 1915 B9R1.1 CSc1ccc(nc1)N 1P008P9S [1,1,0,0,0,0|2,0,0]=4 1916 B9R1.1 Cc1ccc(nn1)C=O 1P00ECEM [1,1,0,0,0,0|1,0,0]=3 1917 B9R1.1 Cc1ccc(nn1)NN 1P00BZZG [1,1,0,0,0,0|2,0,0]=4 1918 B9R1.1 Cc1cnc(cn1)C=C 1P007ZUI [1,1,0,0,0,0|2,0,0]=4 1919 B9R1.1 Cc1cnc(cn1)C=O 1P0037UJ [1,1,0,0,0,0|1,0,0]=3 1920 B9R1.1 Cc1cnc(cn1)CN 1P0011FS [1,1,0,0,0,0|1,0,1]=4 1921 B9R1.1 Cc1cnc(cn1)NN 1P001VP6 [1,1,0,0,0,0|2,0,0]=4 1922 B9R1.1 ClCc1ccc(nc1)Br 1P001YD1 [1,1,0,0,0,0|1,0,1]=4 1923 B9R1.1 ClCc1ccc(nc1)Br 1P0094YF [1,1,0,0,0,0|1,0,1]=4 1924 B9R1.1 ClCc1ccc(nc1)C 1P008YVG [1,1,0,0,0,0|1,0,1]=4 1925 B9R1.1 ClCc1ccc(nc1)Cl 1P00378I [1,1,0,0,0,0|1,0,1]=4 1926 B9R1.1 ClCc1ccc(nc1)F 1P00CMTI [1,1,0,0,0,0|1,0,1]=4 1927 B9R1.1 ClCc1ccc(nc1)N 1P01EIRM [1,1,0,0,0,0|1,0,1]=4 1928 B9R1.1 Clc1ccc(nn1)C=O 1P003021 [1,1,0,0,0,0|1,0,0]=3 1929 B9R1.1 Clc1cnc(cn1)C=O 1P004AM6 [1,1,0,0,0,0|1,0,0]=3 1930 B9R1.1 FCc1ccc(nc1)F 1P028KGL [1,1,0,0,0,0|1,0,1]=4 1931 B9R1.1 N#Cc1ccc(nc1)Br 1P001BRZ [1,1,0,0,0,0|0,0,2]=4 1932 B9R1.1 N#Cc1ccc(nc1)C 1P00383W [1,1,0,0,0,0|0,0,2]=4 1933 B9R1.1 N#Cc1ccc(nc1)Cl 1P0033OX [1,1,0,0,0,0|0,0,2]=4 1934 B9R1.1 N#Cc1ccc(nc1)F 1P0034Q3 [1,1,0,0,0,0|0,0,2]=4 1935 B9R1.1 N#Cc1ccc(nc1)I 1P002XMK [1,1,0,0,0,0|0,0,2]=4 1936 B9R1.1 N#Cc1ccc(nc1)N 1P00I8N3 [1,1,0,0,0,0|0,0,2]=4 1937 B9R1.1 N#Cc1ccc(nc1)O 1P00IJYR [1,1,0,0,0,0|0,0,2]=4 1938 B9R1.1 N#Cc1ccc(nc1)S 1P00C2IY [1,1,0,0,0,0|0,0,2]=4 1939 B9R1.1 NCc1ccc(=O)[nH]c1 1P003MNG [1,1,0,0,0,0|0,0,2]=4 1940 B9R1.1 NCc1ccc(cc1)Br 1P002SK4 [1,1,0,0,0,0|1,0,1]=4 1941 B9R1.1 NCc1ccc(cc1)Br 1P0034EY [1,1,0,0,0,0|1,0,1]=4 1942 B9R1.1 NCc1ccc(cc1)C 1P007GSC [1,1,0,0,0,0|1,0,1]=4 1943 B9R1.1 NCc1ccc(cc1)Cl 1P0034GM [1,1,0,0,0,0|1,0,1]=4 1944 B9R1.1 NCc1ccc(cc1)Cl 1P00CMJJ [1,1,0,0,0,0|1,0,1]=4 1945 B9R1.1 NCc1ccc(cc1)F 1P001CDZ [1,1,0,0,0,0|1,0,1]=4 1946 B9R1.1 NCc1ccc(cc1)F 1P00FB8G [1,1,0,0,0,0|1,0,1]=4 1947 B9R1.1 NCc1ccc(cc1)I 1P003M1E [1,1,0,0,0,0|1,0,1]=4 1948 B9R1.1 NCc1ccc(cc1)I 1P003M1F [1,1,0,0,0,0|1,0,1]=4 1949 B9R1.1 NCc1ccc(cc1)N 1P003L7R [1,1,0,0,0,0|1,0,1]=4 1950 B9R1.1 NCc1ccc(cc1)N 1P00DE7Z [1,1,0,0,0,0|1,0,1]=4 1951 B9R1.1 NCc1ccc(cc1)O 1P0002CY [1,1,0,0,0,0|1,0,1]=4 1952 B9R1.1 NCc1ccc(cc1)O 1P0069EG [1,1,0,0,0,0|1,0,1]=4 1953 B9R1.1 NCc1ccc(cc1)O 1P00GSKB [1,1,0,0,0,0|1,0,1]=4 1954 B9R1.1 NCc1ccc(cc1)O 1P00IM7V [1,1,0,0,0,0|1,0,1]=4 1955 B9R1.1 NCc1ccc(cc1)S 1P01FKXD [1,1,0,0,0,0|1,0,1]=4 1956 B9R1.1 NCc1ccc(nc1)Br 1P000NSI [1,1,0,0,0,0|0,0,1]=3 1957 B9R1.1 NCc1ccc(nc1)Br 1P007Q3R [1,1,0,0,0,0|0,0,1]=3 1958 B9R1.1 NCc1ccc(nc1)C 1P00EEYH [1,1,0,0,0,0|0,0,1]=3 1959 B9R1.1 NCc1ccc(nc1)C 1P00I8VC [1,1,0,0,0,0|0,0,1]=3 1960 B9R1.1 NCc1ccc(nc1)Cl 1P00ARA3 [1,1,0,0,0,0|0,0,1]=3 1961 B9R1.1 NCc1ccc(nc1)Cl 1P00IKCY [1,1,0,0,0,0|0,0,1]=3 1962 B9R1.1 NCc1ccc(nc1)F 1P002ARS [1,1,0,0,0,0|0,0,1]=3 1963 B9R1.1 NCc1ccc(nc1)I 1P027Y1N [1,1,0,0,0,0|0,0,1]=3 1964 B9R1.1 NCc1ccc(nc1)N 1P001PLB [1,1,0,0,0,0|0,0,1]=3 1965 B9R1.1 NCc1ccc(nc1)N 1P00BFS2 [1,1,0,0,0,0|0,0,1]=3 1966 B9R1.1 NCc1ccc(nc1)O 1P01AJNO [1,1,0,0,0,0|0,0,1]=3 1967 B9R1.1 NCc1ccc(nn1)C 1P00HZBB [1,1,0,0,0,0|1,0,1]=4 1968 B9R1.1 NCc1ccc(nn1)Cl 1P001I8T [1,1,0,0,0,0|1,0,1]=4 1969 B9R1.1 NCc1ccc(nn1)Cl 1P00GT8M [1,1,0,0,0,0|1,0,1]=4 1970 B9R1.1 NCc1cnc(cn1)Br 1P00HV74 [1,1,0,0,0,0|1,0,1]=4 1971 B9R1.1 NCc1cnc(cn1)Cl 1P007ELF [1,1,0,0,0,0|1,0,1]=4 1972 B9R1.1 NCc1cnc(cn1)Cl 1P01C3G8 [1,1,0,0,0,0|1,0,1]=4 1973 B9R1.1 NCc1cnc(cn1)N 1P0290B5 [1,1,0,0,0,0|1,0,1]=4 1974 B9R1.1 NCc1cnc(nc1)C 1P009I20 [1,1,0,0,0,0|1,0,1]=4 1975 B9R1.1 NCc1cnc(nc1)C 1P01K1SW [1,1,0,0,0,0|1,0,1]=4 1976 B9R1.1 NCc1cnc(nc1)Cl 1P000YZP [1,1,0,0,0,0|1,0,1]=4 1977 B9R1.1 NCc1cnc(nc1)Cl 1P00H1ER [1,1,0,0,0,0|1,0,1]=4 1978 B9R1.1 NCc1cnc(nc1)N 1P00FHHG [1,1,0,0,0,0|1,0,1]=4 1979 B9R1.1 NCc1cnc(nc1)S 1P02890I [1,1,0,0,0,0|1,0,1]=4 1980 B9R1.1 NCc1ncc(nc1)C 1P01JUG0 [1,1,0,0,0,0|1,0,1]=4 1981 B9R1.1 NN=c1cnc(c[nH]1)Cl 1P00BIFD [1,1,0,0,0,0|2,0,0]=4 1982 B9R1.1 NNc1ccc(cc1)Br 1P0034FB [1,1,0,0,0,0|2,0,0]=4 1983 B9R1.1 NNc1ccc(cc1)Br 1P00EAW1 [1,1,0,0,0,0|2,0,0]=4 1984 B9R1.1 NNc1ccc(cc1)C 1P0036LJ [1,1,0,0,0,0|2,0,0]=4 1985 B9R1.1 NNc1ccc(cc1)C 1P00DESK [1,1,0,0,0,0|2,0,0]=4 1986 B9R1.1 NNc1ccc(cc1)Cl 1P001DWX [1,1,0,0,0,0|2,0,0]=4 1987 B9R1.1 NNc1ccc(cc1)Cl 1P003LOR [1,1,0,0,0,0|2,0,0]=4 1988 B9R1.1 NNc1ccc(cc1)Cl 1P007WRK [1,1,0,0,0,0|2,0,0]=4 1989 B9R1.1 NNc1ccc(cc1)F 1P0034I9 [1,1,0,0,0,0|2,0,0]=4 1990 B9R1.1 NNc1ccc(cc1)F 1P00I7SM [1,1,0,0,0,0|2,0,0]=4 1991 B9R1.1 NNc1ccc(cc1)I 1P000W3L [1,1,0,0,0,0|2,0,0]=4 1992 B9R1.1 NNc1ccc(cc1)I 1P00EL3Q [1,1,0,0,0,0|2,0,0]=4 1993 B9R1.1 NNc1ccc(cc1)O 1P0291QT [1,1,0,0,0,0|2,0,0]=4 1994 B9R1.1 NNc1ccc(nc1)Br 1P000TVP [1,1,0,0,0,0|1,0,0]=3 1995 B9R1.1 NNc1ccc(nc1)C 1P003UIV [1,1,0,0,0,0|1,0,0]=3 1996 B9R1.1 NNc1ccc(nc1)C 1P028DYO [1,1,0,0,0,0|1,0,0]=3 1997 B9R1.1 NNc1ccc(nc1)Cl 1P001DZW [1,1,0,0,0,0|1,0,0]=3 1998 B9R1.1 NNc1ccc(nc1)F 1P00H108 [1,1,0,0,0,0|1,0,0]=3 1999 B9R1.1 NNc1ccc(nc1)F 1P028K4X [1,1,0,0,0,0|1,0,0]=3 2000 B9R1.1 NNc1ccc(nn1)F 1P029058 [1,1,0,0,0,0|2,0,0]=4 2001 B9R1.1 NOc1ccc(cc1)Br 1P01BJDR [1,1,0,0,0,0|2,0,0]=4 2002 B9R1.1 NOc1ccc(cc1)Cl 1P01B746 [1,1,0,0,0,0|2,0,0]=4 2003 B9R1.1 NOc1ccc(cc1)F 1P01C1SZ [1,1,0,0,0,0|2,0,0]=4 2004 B9R1.1 N\N=c/1\ccc(n[nH]1)Br 1P003439 [1,1,0,0,0,0|2,0,0]=4 2005 B9R1.1 N\N=c\1/ccc(n[nH]1)Cl 1P0036AM [1,1,0,0,0,0|2,0,0]=4 2006 B9R1.1 Nc1cnc(cn1)C=O 1P01FPZZ [1,1,0,0,0,0|1,0,0]=3 2007 B9R1.1 O=Cc1cc[n+](cc1)C 1P01DWCI [1,1,0,0,0,0|2,0,0]=4 2008 B9R1.1 O=Cc1ccc(=O)[nH]c1 1P0033T4 [1,1,0,0,0,0|0,0,1]=3 2009 B9R1.1 O=Cc1ccc(=O)[nH]n1 1P006458 [1,1,0,0,0,0|1,0,1]=4 2010 B9R1.1 O=Cc1ccc(cc1)Br 1P0034ER [1,1,0,0,0,0|1,0,0]=3 2011 B9R1.1 O=Cc1ccc(cc1)C 1P003UHG [1,1,0,0,0,0|1,0,0]=3 2012 B9R1.1 O=Cc1ccc(cc1)Cl 1P0034GH [1,1,0,0,0,0|1,0,0]=3 2013 B9R1.1 O=Cc1ccc(cc1)F 1P0034HX [1,1,0,0,0,0|1,0,0]=3 2014 B9R1.1 O=Cc1ccc(cc1)I 1P003M18 [1,1,0,0,0,0|1,0,0]=3 2015 B9R1.1 O=Cc1ccc(cc1)N 1P00IV1I [1,1,0,0,0,0|1,0,0]=3 2016 B9R1.1 O=Cc1ccc(cc1)O 1P000KDB [1,1,0,0,0,0|1,0,0]=3 2017 B9R1.1 O=Cc1ccc(cc1)S 1P0037B5 [1,1,0,0,0,0|1,0,0]=3 2018 B9R1.1 O=Cc1ccc(cn1)Br 1P003N1J [1,1,0,0,0,0|2,0,0]=4 2019 B9R1.1 O=Cc1ccc(cn1)C 1P0037VI [1,1,0,0,0,0|2,0,0]=4 2020 B9R1.1 O=Cc1ccc(cn1)Cl 1P0034PX [1,1,0,0,0,0|2,0,0]=4 2021 B9R1.1 O=Cc1ccc(cn1)F 1P0036BB [1,1,0,0,0,0|2,0,0]=4 2022 B9R1.1 O=Cc1ccc(cn1)N 1P0095PU [1,1,0,0,0,0|2,0,0]=4 2023 B9R1.1 O=Cc1ccc(cn1)O 1P00BFVO [1,1,0,0,0,0|2,0,0]=4 2024 B9R1.1 O=Cc1ccc(nc1)Br 1P001MI1 [1,1,0,0,0,0|0,0,0]=2 2025 B9R1.1 O=Cc1ccc(nc1)C 1P003NRI [1,1,0,0,0,0|0,0,0]=2 2026 B9R1.1 O=Cc1ccc(nc1)Cl 1P002MNQ [1,1,0,0,0,0|0,0,0]=2 2027 B9R1.1 O=Cc1ccc(nc1)F 1P0036MR [1,1,0,0,0,0|0,0,0]=2 2028 B9R1.1 O=Cc1ccc(nc1)N 1P001REZ [1,1,0,0,0,0|0,0,0]=2 2029 B9R1.1 O=Cc1ccc(nc1)N 1P00668Q [1,1,0,0,0,0|0,0,0]=2 2030 B9R1.1 O=Cc1cnc(=O)[nH]c1 1P001XEL [1,1,0,0,0,0|1,0,0]=3 2031 B9R1.1 O=Cc1cnc(nc1)Br 1P00AO5O [1,1,0,0,0,0|1,0,0]=3 2032 B9R1.1 O=Cc1cnc(nc1)C 1P006H5C [1,1,0,0,0,0|1,0,0]=3 2033 B9R1.1 O=Cc1cnc(nc1)Cl 1P0037DO [1,1,0,0,0,0|1,0,0]=3 2034 B9R1.1 O=Cc1cnc(nc1)N 1P003H0Q [1,1,0,0,0,0|1,0,0]=3 2035 B9R1.1 O=Cc1cnc(nc1)N 1P00AT3G [1,1,0,0,0,0|1,0,0]=3 2036 B9R1.1 O=Cc1cnc(nc1)S 1P00IE71 [1,1,0,0,0,0|1,0,0]=3 2037 B9R1.1 O=Nc1ccc(cc1)Br 1P00CPA7 [1,1,0,0,0,0|2,0,0]=4 2038 B9R1.1 OCc1ccc(nc1)Br 1P0017JZ [1,1,0,0,0,0|0,0,2]=4 2039 B9R1.1 OCc1ccc(nc1)C 1P003N9G [1,1,0,0,0,0|0,0,2]=4 2040 B9R1.1 OCc1ccc(nc1)Cl 1P003HFN [1,1,0,0,0,0|0,0,2]=4 2041 B9R1.1 OCc1ccc(nc1)F 1P00778N [1,1,0,0,0,0|0,0,2]=4 2042 B9R1.1 OCc1ccc(nc1)N 1P008S78 [1,1,0,0,0,0|0,0,2]=4 2043 B9R1.2 BrCc1cncc(c1)Br 1P001DTK [1,1,0,0,0,0|1,0,1]=4 2044 B9R1.2 BrCc1cncc(c1)Br 1P01A763 [1,1,0,0,0,0|1,0,1]=4 2045 B9R1.2 Brc1cc(C=C)cnc1 1P002FIU [1,1,0,0,0,0|1,0,0]=3 2046 B9R1.2 Brc1cc(C=O)cnc1 1P0034P6 [1,1,0,0,0,0|0,0,0]=2 2047 B9R1.2 Brc1cc(C=O)ncc1 1P00104V [1,1,0,0,0,0|2,0,0]=4 2048 B9R1.2 Brc1cc(cnc1)C#C 1P00GXWD [1,1,0,0,0,0|1,0,1]=4 2049 B9R1.2 Brc1cc(cnc1)C#N 1P0034P2 [1,1,0,0,0,0|0,0,2]=4 2050 B9R1.2 C=Cc1cccc(c1)Br 1P0029O1 [1,1,0,0,0,0|2,0,0]=4 2051 B9R1.2 C=Cc1cccc(c1)C 1P0000ON [1,1,0,0,0,0|2,0,0]=4 2052 B9R1.2 C=Cc1cccc(c1)Cl 1P0029O2 [1,1,0,0,0,0|2,0,0]=4 2053 B9R1.2 C=Cc1cccc(c1)F 1P00BYPO [1,1,0,0,0,0|2,0,0]=4 2054 B9R1.2 C=Cc1cccc(c1)I 1P00I98Z [1,1,0,0,0,0|2,0,0]=4 2055 B9R1.2 C=Cc1cccc(c1)N 1P003KDV [1,1,0,0,0,0|2,0,0]=4 2056 B9R1.2 C=Cc1cccc(c1)O 1P00EFDF [1,1,0,0,0,0|2,0,0]=4 2057 B9R1.2 CCc1cc(Br)cnc1 1P009BLX [1,1,0,0,0,0|1,0,1]=4 2058 B9R1.2 CCc1cc(Cl)cnc1 1P01BUJN [1,1,0,0,0,0|1,0,1]=4 2059 B9R1.2 CCc1cc(N)cnc1 1P0092A4 [1,1,0,0,0,0|1,0,1]=4 2060 B9R1.2 CCc1cc(O)cnc1 1P01IO5Q [1,1,0,0,0,0|1,0,1]=4 2061 B9R1.2 CNc1cc(Br)cnc1 1P003AL0 [1,1,0,0,0,0|2,0,0]=4 2062 B9R1.2 CNc1cncc(c1)C 1P01KHHK [1,1,0,0,0,0|2,0,0]=4 2063 B9R1.2 COc1cc(Br)cnc1 1P003JJQ [1,1,0,0,0,0|2,0,0]=4 2064 B9R1.2 COc1cc(Cl)cnc1 1P005XEU [1,1,0,0,0,0|2,0,0]=4 2065 B9R1.2 COc1cc(F)cnc1 1P007ELO [1,1,0,0,0,0|2,0,0]=4 2066 B9R1.2 COc1cc(I)cnc1 1P003K23 [1,1,0,0,0,0|2,0,0]=4 2067 B9R1.2 COc1cc(N)cnc1 1P003JDA [1,1,0,0,0,0|2,0,0]=4 2068 B9R1.2 COc1cc(O)cnc1 1P003NB5 [1,1,0,0,0,0|2,0,0]=4 2069 B9R1.2 CSc1cc(Br)cnc1 1P007ZGD [1,1,0,0,0,0|2,0,0]=4 2070 B9R1.2 CSc1cc(N)cnc1 1P00CGZQ [1,1,0,0,0,0|2,0,0]=4 2071 B9R1.2 CSc1cncc(c1)N 1P01C2IP [1,1,0,0,0,0|2,0,0]=4 2072 B9R1.2 Cc1cc(C=C)cnc1 1P00DF2A [1,1,0,0,0,0|1,0,0]=3 2073 B9R1.2 Cc1cc(C=O)cnc1 1P0003MU [1,1,0,0,0,0|0,0,0]=2 2074 B9R1.2 Cc1cc(C=O)ncc1 1P003M99 [1,1,0,0,0,0|2,0,0]=4 2075 B9R1.2 Cc1cc(CBr)cnc1 1P000L78 [1,1,0,0,0,0|1,0,1]=4 2076 B9R1.2 Cc1cc(CCl)cnc1 1P00035F [1,1,0,0,0,0|1,0,1]=4 2077 B9R1.2 Cc1cc(CN)cnc1 1P0055YH [1,1,0,0,0,0|0,0,1]=3 2078 B9R1.2 Cc1cc(CN)cnc1 1P00HXPI [1,1,0,0,0,0|0,0,1]=3 2079 B9R1.2 Cc1cc(CO)cnc1 1P00071U [1,1,0,0,0,0|0,0,2]=4 2080 B9R1.2 Cc1cc(CO)cnc1 1P028PCG [1,1,0,0,0,0|0,0,2]=4 2081 B9R1.2 Cc1cc(cnc1)C#C 1P0030IW [1,1,0,0,0,0|1,0,1]=4 2082 B9R1.2 Cc1cc(cnc1)C#N 1P00345F [1,1,0,0,0,0|0,0,2]=4 2083 B9R1.2 Cc1cncc(n1)C=C 1P007LEI [1,1,0,0,0,0|2,0,0]=4 2084 B9R1.2 Cc1cncc(n1)C=O 1P000DN6 [1,1,0,0,0,0|1,0,0]=3 2085 B9R1.2 Cc1cncc(n1)CN 1P01DX7K [1,1,0,0,0,0|1,0,1]=4 2086 B9R1.2 Cc1cncc(n1)NN 1P002C0W [1,1,0,0,0,0|2,0,0]=4 2087 B9R1.2 ClCc1cc(Br)cnc1 1P003JJ4 [1,1,0,0,0,0|1,0,1]=4 2088 B9R1.2 ClCc1cc(Br)cnc1 1P007QU3 [1,1,0,0,0,0|1,0,1]=4 2089 B9R1.2 ClCc1cncc(c1)Cl 1P00G8NV [1,1,0,0,0,0|1,0,1]=4 2090 B9R1.2 Clc1cc(C=O)cnc1 1P007RRE [1,1,0,0,0,0|0,0,0]=2 2091 B9R1.2 Clc1cc(C=O)ncc1 1P003LP1 [1,1,0,0,0,0|2,0,0]=4 2092 B9R1.2 Clc1cc(CBr)cnc1 1P01B78L [1,1,0,0,0,0|1,0,1]=4 2093 B9R1.2 Clc1cc(cnc1)C#C 1P00BZEM [1,1,0,0,0,0|1,0,1]=4 2094 B9R1.2 Clc1cc(cnc1)C#N 1P0034PN [1,1,0,0,0,0|0,0,2]=4 2095 B9R1.2 Clc1cncc(n1)C=O 1P0036SL [1,1,0,0,0,0|1,0,0]=3 2096 B9R1.2 Fc1cc(C=C)cnc1 1P0008U4 [1,1,0,0,0,0|1,0,0]=3 2097 B9R1.2 Fc1cc(C=O)cnc1 1P00778O [1,1,0,0,0,0|0,0,0]=2 2098 B9R1.2 Fc1cc(C=O)cnc1 1P01AG2V [1,1,0,0,0,0|0,0,0]=2 2099 B9R1.2 Fc1cc(C=O)ncc1 1P008ZJK [1,1,0,0,0,0|2,0,0]=4 2100 B9R1.2 Fc1cc(CBr)cnc1 1P009I3P [1,1,0,0,0,0|1,0,1]=4 2101 B9R1.2 Fc1cc(CCl)cnc1 1P0017GY [1,1,0,0,0,0|1,0,1]=4 2102 B9R1.2 Fc1cc(cnc1)C#C 1P00GWPO [1,1,0,0,0,0|1,0,1]=4 2103 B9R1.2 Fc1cc(cnc1)C#N 1P00371W [1,1,0,0,0,0|0,0,2]=4 2104 B9R1.2 Ic1cc(C=O)cnc1 1P004H9C [1,1,0,0,0,0|0,0,0]=2 2105 B9R1.2 NCc1cc(Br)cnc1 1P0038KX [1,1,0,0,0,0|0,0,1]=3 2106 B9R1.2 NCc1cc(Cl)cnc1 1P00196S [1,1,0,0,0,0|0,0,1]=3 2107 B9R1.2 NCc1cc(F)cnc1 1P002O92 [1,1,0,0,0,0|0,0,1]=3 2108 B9R1.2 NCc1cc(F)cnc1 1P00IEIR [1,1,0,0,0,0|0,0,1]=3 2109 B9R1.2 NCc1cc(O)cnc1 1P000MC8 [1,1,0,0,0,0|0,0,1]=3 2110 B9R1.2 NCc1ccc[n+](c1)[O-] 1P01BSKK [1,1,0,0,0,0|0,0,2]=4 2111 B9R1.2 NCc1ccc[n+](c1)[O-] 1P01EIK3 [1,1,0,0,0,0|0,0,2]=4 2112 B9R1.2 NCc1cccc(c1)Br 1P0008LR [1,1,0,0,0,0|1,0,1]=4 2113 B9R1.2 NCc1cccc(c1)Br 1P003JKW [1,1,0,0,0,0|1,0,1]=4 2114 B9R1.2 NCc1cccc(c1)C 1P0000OM [1,1,0,0,0,0|1,0,1]=4 2115 B9R1.2 NCc1cccc(c1)Cl 1P003JR8 [1,1,0,0,0,0|1,0,1]=4 2116 B9R1.2 NCc1cccc(c1)F 1P0000OL [1,1,0,0,0,0|1,0,1]=4 2117 B9R1.2 NCc1cccc(c1)F 1P01K78D [1,1,0,0,0,0|1,0,1]=4 2118 B9R1.2 NCc1cccc(c1)I 1P003K2D [1,1,0,0,0,0|1,0,1]=4 2119 B9R1.2 NCc1cccc(c1)I 1P00I7SX [1,1,0,0,0,0|1,0,1]=4 2120 B9R1.2 NCc1cccc(c1)N 1P003JDZ [1,1,0,0,0,0|1,0,1]=4 2121 B9R1.2 NCc1cccc(c1)O 1P0011H8 [1,1,0,0,0,0|1,0,1]=4 2122 B9R1.2 NCc1cccc(c1)O 1P003IMZ [1,1,0,0,0,0|1,0,1]=4 2123 B9R1.2 NCc1cncc(c1)Br 1P008SBV [1,1,0,0,0,0|0,0,1]=3 2124 B9R1.2 NCc1cncc(c1)C 1P027OFD [1,1,0,0,0,0|0,0,1]=3 2125 B9R1.2 NCc1cncc(c1)Cl 1P009XZW [1,1,0,0,0,0|0,0,1]=3 2126 B9R1.2 NCc1cncc(c1)N 1P00EF6P [1,1,0,0,0,0|0,0,1]=3 2127 B9R1.2 NCc1cncc(c1)O 1P028V18 [1,1,0,0,0,0|0,0,1]=3 2128 B9R1.2 NCc1cncc(n1)C 1P01EIII [1,1,0,0,0,0|1,0,1]=4 2129 B9R1.2 NCc1cncc(n1)Cl 1P009I1R [1,1,0,0,0,0|1,0,1]=4 2130 B9R1.2 NCc1cncc(n1)Cl 1P028WA2 [1,1,0,0,0,0|1,0,1]=4 2131 B9R1.2 NCc1cncc(n1)N 1P028EV3 [1,1,0,0,0,0|1,0,1]=4 2132 B9R1.2 NCc1cncc(n1)O 1P0293RL [1,1,0,0,0,0|1,0,1]=4 2133 B9R1.2 NCc1nncc(c1)C 1P0026TO [1,1,0,0,0,0|1,0,1]=4 2134 B9R1.2 NN=c1cncc([nH]1)Cl 1P00EAXG [1,1,0,0,0,0|2,0,0]=4 2135 B9R1.2 NNc1cc(Br)cnc1 1P00G8MJ [1,1,0,0,0,0|1,0,0]=3 2136 B9R1.2 NNc1cc(F)cnc1 1P01JX7A [1,1,0,0,0,0|1,0,0]=3 2137 B9R1.2 NNc1cccc(c1)Br 1P00343O [1,1,0,0,0,0|2,0,0]=4 2138 B9R1.2 NNc1cccc(c1)C 1P003484 [1,1,0,0,0,0|2,0,0]=4 2139 B9R1.2 NNc1cccc(c1)C 1P003SN5 [1,1,0,0,0,0|2,0,0]=4 2140 B9R1.2 NNc1cccc(c1)Cl 1P002MPK [1,1,0,0,0,0|2,0,0]=4 2141 B9R1.2 NNc1cccc(c1)Cl 1P003JRY [1,1,0,0,0,0|2,0,0]=4 2142 B9R1.2 NNc1cccc(c1)F 1P002YAH [1,1,0,0,0,0|2,0,0]=4 2143 B9R1.2 NNc1cccc(c1)F 1P00FBTT [1,1,0,0,0,0|2,0,0]=4 2144 B9R1.2 NNc1cccc(c1)O 1P00GAL3 [1,1,0,0,0,0|2,0,0]=4 2145 B9R1.2 NNc1cccc(c1)O 1P01B79V [1,1,0,0,0,0|2,0,0]=4 2146 B9R1.2 NNc1cncc(c1)Br 1P009KEQ [1,1,0,0,0,0|1,0,0]=3 2147 B9R1.2 NNc1cncc(c1)C 1P0284S0 [1,1,0,0,0,0|1,0,0]=3 2148 B9R1.2 NOc1cccc(c1)Br 1P028VDB [1,1,0,0,0,0|2,0,0]=4 2149 B9R1.2 NOc1cccc(c1)Cl 1P024WNO [1,1,0,0,0,0|2,0,0]=4 2150 B9R1.2 Nc1cc(CBr)cnc1 1P01KLTB [1,1,0,0,0,0|1,0,1]=4 2151 B9R1.2 Nc1cc(CO)cnc1 1P00DEEH [1,1,0,0,0,0|0,0,2]=4 2152 B9R1.2 Nc1cc(cnc1)C#C 1P00FE6Q [1,1,0,0,0,0|1,0,1]=4 2153 B9R1.2 Nc1cc(cnc1)C#N 1P003MUJ [1,1,0,0,0,0|0,0,2]=4 2154 B9R1.2 O=Cc1cc[nH]c(=O)c1 1P002HFI [1,1,0,0,0,0|2,0,0]=4 2155 B9R1.2 O=Cc1cccc(=O)[nH]1 1P00CBKE [1,1,0,0,0,0|2,0,0]=4 2156 B9R1.2 O=Cc1cccc(c1)Br 1P00343C [1,1,0,0,0,0|1,0,0]=3 2157 B9R1.2 O=Cc1cccc(c1)C 1P003K77 [1,1,0,0,0,0|1,0,0]=3 2158 B9R1.2 O=Cc1cccc(c1)Cl 1P00IAWD [1,1,0,0,0,0|1,0,0]=3 2159 B9R1.2 O=Cc1cccc(c1)F 1P003465 [1,1,0,0,0,0|1,0,0]=3 2160 B9R1.2 O=Cc1cccc(c1)I 1P003475 [1,1,0,0,0,0|1,0,0]=3 2161 B9R1.2 O=Cc1cccc(c1)N 1P000X9L [1,1,0,0,0,0|1,0,0]=3 2162 B9R1.2 O=Cc1cccc(c1)O 1P0000OK [1,1,0,0,0,0|1,0,0]=3 2163 B9R1.2 O=Cc1cccc(c1)S 1P01A8YV [1,1,0,0,0,0|1,0,0]=3 2164 B9R1.2 O=Cc1cccc(n1)Br 1P0034T5 [1,1,0,0,0,0|2,0,0]=4 2165 B9R1.2 O=Cc1cccc(n1)C 1P003NRK [1,1,0,0,0,0|2,0,0]=4 2166 B9R1.2 O=Cc1cccc(n1)Cl 1P00DEFF [1,1,0,0,0,0|2,0,0]=4 2167 B9R1.2 O=Cc1cccc(n1)F 1P002JY1 [1,1,0,0,0,0|2,0,0]=4 2168 B9R1.2 O=Cc1cccc(n1)N 1P00CBAY [1,1,0,0,0,0|2,0,0]=4 2169 B9R1.2 O=Cc1ccnc(c1)Br 1P003H5M [1,1,0,0,0,0|2,0,0]=4 2170 B9R1.2 O=Cc1ccnc(c1)C 1P0037DJ [1,1,0,0,0,0|2,0,0]=4 2171 B9R1.2 O=Cc1ccnc(c1)Cl 1P000448 [1,1,0,0,0,0|2,0,0]=4 2172 B9R1.2 O=Cc1ccnc(c1)Cl 1P000K6W [1,1,0,0,0,0|2,0,0]=4 2173 B9R1.2 O=Cc1ccnc(c1)F 1P00104Q [1,1,0,0,0,0|2,0,0]=4 2174 B9R1.2 OCc1cc(Br)cnc1 1P003JK1 [1,1,0,0,0,0|0,0,2]=4 2175 B9R1.2 OCc1cc(Br)cnc1 1P006XP9 [1,1,0,0,0,0|0,0,2]=4 2176 B9R1.2 OCc1cc(Cl)cnc1 1P006XPA [1,1,0,0,0,0|0,0,2]=4 2177 B9R1.2 OCc1cc(F)cnc1 1P006XPB [1,1,0,0,0,0|0,0,2]=4 2178 B9R1.2 OCc1cncc(c1)O 1P00DGST [1,1,0,0,0,0|0,0,2]=4 2179 B9R1.2 Oc1cc(C=O)cnc1 1P003N9K [1,1,0,0,0,0|0,0,0]=2 2180 B9R1.2 Oc1cc(cnc1)C#C 1P028XYK [1,1,0,0,0,0|1,0,1]=4 2181 B9R1.2 Oc1cc(cnc1)C#N 1P0034R2 [1,1,0,0,0,0|0,0,2]=4 2182 B9R1.8 BrCCc1cccnc1 1P00CJF9 [1,1,0,0,0,0|1,0,1]=4 2183 B9R1.8 Br\C=C/c1cccnc1 1P00A7DJ [1,1,0,0,0,0|1,0,0]=3 2184 B9R1.8 Br\C=C\c1ccccc1 1P003OMN [1,1,0,0,0,0|2,0,0]=4 2185 B9R1.8 C=CCc1ccccc1 1P003O6X [1,1,0,0,0,0|2,0,0]=4 2186 B9R1.8 C=CCc1cccnc1 1P005DFA [1,1,0,0,0,0|1,0,0]=3 2187 B9R1.8 C=CCc1cncnc1 1P01DW3N [1,1,0,0,0,0|2,0,0]=4 2188 B9R1.8 C=COc1ccccc1 1P005W2F [1,1,0,0,0,0|2,0,0]=4 2189 B9R1.8 C=COc1cccnc1 1P009TFJ [1,1,0,0,0,0|1,0,0]=3 2190 B9R1.8 C=CSc1ccccc1 1P0023XU [1,1,0,0,0,0|2,0,0]=4 2191 B9R1.8 CCCc1cccnc1 1P00DG48 [1,1,0,0,0,0|1,0,1]=4 2192 B9R1.8 CCNc1cccnc1 1P00CN8W [1,1,0,0,0,0|1,0,1]=4 2193 B9R1.8 CCOc1cccnc1 1P00ANFG [1,1,0,0,0,0|1,0,1]=4 2194 B9R1.8 CNCc1ccccc1 1P0035T0 [1,1,0,0,0,0|1,0,1]=4 2195 B9R1.8 CNCc1cccnc1 1P003IN0 [1,1,0,0,0,0|0,0,1]=3 2196 B9R1.8 CNCc1cccnc1 1P00JLQD [1,1,0,0,0,0|0,0,1]=3 2197 B9R1.8 CNCc1cccnn1 1P01B717 [1,1,0,0,0,0|1,0,1]=4 2198 B9R1.8 CNCc1cnccn1 1P0081AR [1,1,0,0,0,0|1,0,1]=4 2199 B9R1.8 CNCc1cncnc1 1P00E7RF [1,1,0,0,0,0|1,0,1]=4 2200 B9R1.8 CNCc1cncnc1 1P01C5YL [1,1,0,0,0,0|1,0,1]=4 2201 B9R1.8 CNNc1ccccc1 1P00H3DS [1,1,0,0,0,0|2,0,0]=4 2202 B9R1.8 CSCc1cccnc1 1P01DX2J [1,1,0,0,0,0|0,1,1]=4 2203 B9R1.8 C\C=C/c1ccccc1 1P003PGJ [1,1,0,0,0,0|2,0,0]=4 2204 B9R1.8 C\C=C\c1ccccc1 1P003VFF [1,1,0,0,0,0|2,0,0]=4 2205 B9R1.8 C\C=C\c1cnccn1 1P027XHC [1,1,0,0,0,0|2,0,0]=4 2206 B9R1.8 C\N=C\c1ccccc1 1P003T8J [1,1,0,0,0,0|1,0,1]=4 2207 B9R1.8 ClCCc1cccnc1 1P00CLVG [1,1,0,0,0,0|1,0,1]=4 2208 B9R1.8 ICCc1cccnc1 1P01APKH [1,1,0,0,0,0|1,0,1]=4 2209 B9R1.8 N#CCc1cccnc1 1P003FL3 [1,1,0,0,0,0|0,0,2]=4 2210 B9R1.8 NCCc1ccccc1 1P001OVX [1,1,0,0,0,0|1,0,1]=4 2211 B9R1.8 NCCc1ccccc1 1P00AL3F [1,1,0,0,0,0|1,0,1]=4 2212 B9R1.8 NCCc1cccnc1 1P0031LS [1,1,0,0,0,0|0,0,1]=3 2213 B9R1.8 NCCc1cccnc1 1P007RI3 [1,1,0,0,0,0|0,0,1]=3 2214 B9R1.8 NCCc1cccnc1 1P00G4HF [1,1,0,0,0,0|0,0,1]=3 2215 B9R1.8 NCCc1ccnnc1 1P01FJWH [1,1,0,0,0,0|1,0,1]=4 2216 B9R1.8 NCCc1cnccn1 1P00D8UG [1,1,0,0,0,0|1,0,1]=4 2217 B9R1.8 NCCc1cnccn1 1P00HZ0H [1,1,0,0,0,0|1,0,1]=4 2218 B9R1.8 NCCc1cncnc1 1P00G7HI [1,1,0,0,0,0|1,0,1]=4 2219 B9R1.8 NCCc1cncnc1 1P01B7EM [1,1,0,0,0,0|1,0,1]=4 2220 B9R1.8 NNCc1ccccc1 1P002AS6 [1,1,0,0,0,0|1,0,1]=4 2221 B9R1.8 NNCc1ccccc1 1P003OLM [1,1,0,0,0,0|1,0,1]=4 2222 B9R1.8 NNCc1ccccc1 1P00VUSV [1,1,0,0,0,0|1,0,1]=4 2223 B9R1.8 NNCc1cccnc1 1P0033XM [1,1,0,0,0,0|0,0,1]=3 2224 B9R1.8 NNCc1cccnc1 1P00EM3P [1,1,0,0,0,0|0,0,1]=3 2225 B9R1.8 NNCc1cccnc1 1P00FT0X [1,1,0,0,0,0|0,0,1]=3 2226 B9R1.8 NNCc1cnccn1 1P0080ZM [1,1,0,0,0,0|1,0,1]=4 2227 B9R1.8 NNCc1cnccn1 1P00H0K1 [1,1,0,0,0,0|1,0,1]=4 2228 B9R1.8 NNCc1cncnc1 1P00HX2E [1,1,0,0,0,0|1,0,1]=4 2229 B9R1.8 NOCc1ccccc1 1P0035W0 [1,1,0,0,0,0|1,0,1]=4 2230 B9R1.8 NOCc1ccccc1 1P003TWF [1,1,0,0,0,0|1,0,1]=4 2231 B9R1.8 NOCc1cccnc1 1P00I7X0 [1,1,0,0,0,0|0,0,1]=3 2232 B9R1.8 N\N=C\c1ccccc1 1P00DGB6 [1,1,0,0,0,0|1,0,0]=3 2233 B9R1.8 O=C=Nc1cccnc1 1P003477 [1,1,0,0,0,0|0,0,1]=3 2234 B9R1.8 O=CCc1ccccc1 1P00170M [1,1,0,0,0,0|1,0,0]=3 2235 B9R1.8 O=CNc1ccccc1 1P003R5D [1,1,0,0,0,0|1,0,0]=3 2236 B9R1.8 O=CNc1ccccn1 1P00C130 [1,1,0,0,0,0|2,0,0]=4 2237 B9R1.8 O=COc1ccccc1 1P0035XN [1,1,0,0,0,0|1,0,0]=3 2238 B9R1.8 O=S=Nc1ccccc1 1P003TUI [1,1,0,0,0,0|2,0,0]=4 2239 B9R1.8 OCCc1cccnc1 1P003FB1 [1,1,0,0,0,0|0,0,2]=4 2240 B9R1.8 ON=Cc1cccnc1 1P000J0C [1,1,0,0,0,0|0,0,1]=3 2241 B9R1.8 ON=Cc1cccnn1 1P028I9I [1,1,0,0,0,0|1,0,1]=4 2242 B9R1.8 ON=Cc1cnccn1 1P028X05 [1,1,0,0,0,0|1,0,1]=4 2243 B9R1.8 ONCc1ccccc1 1P002ZBQ [1,1,0,0,0,0|1,0,1]=4 2244 B9R1.8 ONCc1ccccc1 1P003920 [1,1,0,0,0,0|1,0,1]=4 2245 B9R1.8 O\N=C/c1ccccc1 1P00EASV [1,1,0,0,0,0|1,0,1]=4 2246 B9R1.8 O\N=C\c1ccccc1 1P003OH6 [1,1,0,0,0,0|1,0,1]=4 2247 B9R1.8 S=C=Nc1cccnc1 1P00207D [1,1,0,0,0,0|0,1,1]=4 2248 B9R1.8 [C-]#[N+]Cc1cccnc1 1P00EAA0 [1,1,0,0,0,0|0,0,2]=4 2249 B9R1.8 [CH2-]\C=C\c1ccccc1 1P0035WW [1,1,0,0,0,0|2,0,0]=4 2250 B9R1.8 [N-]=[N+]=Cc1ccccc1 1P008PXQ [1,1,0,0,0,0|1,0,1]=4 2251 B9R1.8 [N-]=[N+]=Nc1cccnc1 1P01AB18 [1,1,0,0,0,0|1,0,1]=4 2252 B9R1.15 BrCc1cccnc1Br 1P003H34 [1,1,0,0,0,0|1,0,1]=4 2253 B9R1.15 BrCc1cccnc1Br 1P01K18U [1,1,0,0,0,0|1,0,1]=4 2254 B9R1.15 BrCc1cccnc1C 1P0019R8 [1,1,0,0,0,0|1,0,1]=4 2255 B9R1.15 BrCc1cccnc1Cl 1P003INP [1,1,0,0,0,0|1,0,1]=4 2256 B9R1.15 BrCc1cccnc1F 1P0030IZ [1,1,0,0,0,0|1,0,1]=4 2257 B9R1.15 BrCc1cccnc1N 1P01BH5R [1,1,0,0,0,0|1,0,1]=4 2258 B9R1.15 BrCc1cnccc1C 1P0019R7 [1,1,0,0,0,0|1,0,1]=4 2259 B9R1.15 BrCc1cnccc1Cl 1P027ZHG [1,1,0,0,0,0|1,0,1]=4 2260 B9R1.15 BrCc1cnccc1O 1P0291ZL [1,1,0,0,0,0|1,0,1]=4 2261 B9R1.15 C#Cc1cccnc1Br 1P01Q8N6 [1,1,0,0,0,0|1,0,1]=4 2262 B9R1.15 C#Cc1cccnc1C 1P01DWS5 [1,1,0,0,0,0|1,0,1]=4 2263 B9R1.15 C#Cc1cccnc1Cl 1P008XA5 [1,1,0,0,0,0|1,0,1]=4 2264 B9R1.15 C#Cc1cccnc1F 1P00II22 [1,1,0,0,0,0|1,0,1]=4 2265 B9R1.15 C#Cc1cccnc1N 1P00IC61 [1,1,0,0,0,0|1,0,1]=4 2266 B9R1.15 C#Cc1cccnc1O 1P009GXT [1,1,0,0,0,0|1,0,1]=4 2267 B9R1.15 C#Cc1cnccc1C 1P00C31H [1,1,0,0,0,0|1,0,1]=4 2268 B9R1.15 C#Cc1cnccc1Cl 1P01C3NO [1,1,0,0,0,0|1,0,1]=4 2269 B9R1.15 C#Cc1cnccc1N 1P01FPD6 [1,1,0,0,0,0|1,0,1]=4 2270 B9R1.15 C=Cc1ccccc1Br 1P0029NZ [1,1,0,0,0,0|2,0,0]=4 2271 B9R1.15 C=Cc1ccccc1Cl 1P0029O0 [1,1,0,0,0,0|2,0,0]=4 2272 B9R1.15 C=Cc1ccccc1F 1P0033SL [1,1,0,0,0,0|2,0,0]=4 2273 B9R1.15 C=Cc1ccccc1I 1P006XAK [1,1,0,0,0,0|2,0,0]=4 2274 B9R1.15 C=Cc1ccccc1N 1P0037RP [1,1,0,0,0,0|2,0,0]=4 2275 B9R1.15 C=Cc1ccccc1N 1P00775F [1,1,0,0,0,0|2,0,0]=4 2276 B9R1.15 C=Cc1cccnc1C 1P00I8ZR [1,1,0,0,0,0|1,0,0]=3 2277 B9R1.15 C=Cc1cccnc1F 1P00HX8N [1,1,0,0,0,0|1,0,0]=3 2278 B9R1.15 C=Cc1nccnc1C 1P002QRI [1,1,0,0,0,0|2,0,0]=4 2279 B9R1.15 CCc1cccnc1Br 1P01CAQK [1,1,0,0,0,0|1,0,1]=4 2280 B9R1.15 CCc1cccnc1Cl 1P00IK9V [1,1,0,0,0,0|1,0,1]=4 2281 B9R1.15 CCc1cccnc1F 1P027X3Q [1,1,0,0,0,0|1,0,1]=4 2282 B9R1.15 CCc1cccnc1N 1P00BYMN [1,1,0,0,0,0|1,0,1]=4 2283 B9R1.15 CCc1cccnc1O 1P00EIVR [1,1,0,0,0,0|1,0,1]=4 2284 B9R1.15 CCc1cnccc1Br 1P0023NT [1,1,0,0,0,0|1,0,1]=4 2285 B9R1.15 CCc1cnccc1Br 1P00ILG0 [1,1,0,0,0,0|1,0,1]=4 2286 B9R1.15 CCc1cnccc1O 1P00DYDN [1,1,0,0,0,0|1,0,1]=4 2287 B9R1.15 CNc1cccnc1Br 1P00GSNK [1,1,0,0,0,0|2,0,0]=4 2288 B9R1.15 CNc1cccnc1C 1P009SR0 [1,1,0,0,0,0|2,0,0]=4 2289 B9R1.15 CNc1cccnc1C 1P01AM0N [1,1,0,0,0,0|2,0,0]=4 2290 B9R1.15 CNc1cccnc1C 1P01FKVI [1,1,0,0,0,0|2,0,0]=4 2291 B9R1.15 CNc1cccnc1Cl 1P00I8HE [1,1,0,0,0,0|2,0,0]=4 2292 B9R1.15 CNc1cccnc1N 1P00ELAM [1,1,0,0,0,0|2,0,0]=4 2293 B9R1.15 CNc1cnccc1Br 1P01R0KB [1,1,0,0,0,0|2,0,0]=4 2294 B9R1.15 CNc1cnccc1C 1P005RQH [1,1,0,0,0,0|2,0,0]=4 2295 B9R1.15 CNc1cnccc1Cl 1P021R1K [1,1,0,0,0,0|2,0,0]=4 2296 B9R1.15 CNc1cnccc1N 1P00B4SE [1,1,0,0,0,0|2,0,0]=4 2297 B9R1.15 COc1cccnc1Br 1P006XU3 [1,1,0,0,0,0|2,0,0]=4 2298 B9R1.15 COc1cccnc1C 1P002TI0 [1,1,0,0,0,0|2,0,0]=4 2299 B9R1.15 COc1cccnc1Cl 1P00I9VJ [1,1,0,0,0,0|2,0,0]=4 2300 B9R1.15 COc1cccnc1F 1P001UE8 [1,1,0,0,0,0|2,0,0]=4 2301 B9R1.15 COc1cccnc1I 1P0062GY [1,1,0,0,0,0|2,0,0]=4 2302 B9R1.15 COc1cccnc1N 1P0006SA [1,1,0,0,0,0|2,0,0]=4 2303 B9R1.15 COc1cccnc1O 1P00I1BE [1,1,0,0,0,0|2,0,0]=4 2304 B9R1.15 COc1cccnc1S 1P00B36V [1,1,0,0,0,0|2,0,0]=4 2305 B9R1.15 COc1cnccc1Br 1P0038MU [1,1,0,0,0,0|2,0,0]=4 2306 B9R1.15 COc1cnccc1I 1P0014UJ [1,1,0,0,0,0|2,0,0]=4 2307 B9R1.15 COc1cnccc1N 1P00DBRZ [1,1,0,0,0,0|2,0,0]=4 2308 B9R1.15 CSc1cccnc1Br 1P00J3CE [1,1,0,0,0,0|2,0,0]=4 2309 B9R1.15 CSc1cccnc1Cl 1P006P9R [1,1,0,0,0,0|2,0,0]=4 2310 B9R1.15 CSc1cccnc1F 1P00CGDU [1,1,0,0,0,0|2,0,0]=4 2311 B9R1.15 CSc1cccnc1N 1P00BB9C [1,1,0,0,0,0|2,0,0]=4 2312 B9R1.15 CSc1cnccc1N 1P01DL3L [1,1,0,0,0,0|2,0,0]=4 2313 B9R1.15 ClCc1cccnc1C 1P00EKAT [1,1,0,0,0,0|1,0,1]=4 2314 B9R1.15 ClCc1cccnc1Cl 1P003HBI [1,1,0,0,0,0|1,0,1]=4 2315 B9R1.15 ClCc1cccnc1Cl 1P0093D5 [1,1,0,0,0,0|1,0,1]=4 2316 B9R1.15 ClCc1cccnc1F 1P00CM25 [1,1,0,0,0,0|1,0,1]=4 2317 B9R1.15 ClCc1cccnc1N 1P004OOU [1,1,0,0,0,0|1,0,1]=4 2318 B9R1.15 ClCc1cccnc1N 1P00G8NW [1,1,0,0,0,0|1,0,1]=4 2319 B9R1.15 ClCc1cnccc1C 1P001EJT [1,1,0,0,0,0|1,0,1]=4 2320 B9R1.15 ClCc1cnccc1Cl 1P01BD8C [1,1,0,0,0,0|1,0,1]=4 2321 B9R1.15 N#Cc1cccnc1Br 1P002ATH [1,1,0,0,0,0|0,0,2]=4 2322 B9R1.15 N#Cc1cccnc1C 1P00APLN [1,1,0,0,0,0|0,0,2]=4 2323 B9R1.15 N#Cc1cccnc1Cl 1P003HC0 [1,1,0,0,0,0|0,0,2]=4 2324 B9R1.15 N#Cc1cccnc1F 1P003JSK [1,1,0,0,0,0|0,0,2]=4 2325 B9R1.15 N#Cc1cccnc1N 1P002OUS [1,1,0,0,0,0|0,0,2]=4 2326 B9R1.15 N#Cc1cccnc1O 1P005X0B [1,1,0,0,0,0|0,0,2]=4 2327 B9R1.15 N#Cc1cccnc1S 1P00DD4P [1,1,0,0,0,0|0,0,2]=4 2328 B9R1.15 N#Cc1cnccc1Br 1P007Y3B [1,1,0,0,0,0|0,0,2]=4 2329 B9R1.15 N#Cc1cnccc1C 1P00IA6Z [1,1,0,0,0,0|0,0,2]=4 2330 B9R1.15 N#Cc1cnccc1Cl 1P0038TX [1,1,0,0,0,0|0,0,2]=4 2331 B9R1.15 N#Cc1cnccc1F 1P0084X0 [1,1,0,0,0,0|0,0,2]=4 2332 B9R1.15 N#Cc1cnccc1I 1P006WEY [1,1,0,0,0,0|0,0,2]=4 2333 B9R1.15 N#Cc1cnccc1N 1P001QK6 [1,1,0,0,0,0|0,0,2]=4 2334 B9R1.15 N#Cc1cnccc1O 1P00GV46 [1,1,0,0,0,0|0,0,2]=4 2335 B9R1.15 N#Cc1cnccc1S 1P01B5ML [1,1,0,0,0,0|0,0,2]=4 2336 B9R1.15 NCc1ccc[nH]c1=O 1P008FIL [1,1,0,0,0,0|0,0,2]=4 2337 B9R1.15 NCc1ccc[nH]c1=O 1P00AI7Z [1,1,0,0,0,0|0,0,2]=4 2338 B9R1.15 NCc1ccccc1Br 1P003H8D [1,1,0,0,0,0|1,0,1]=4 2339 B9R1.15 NCc1ccccc1Br 1P003H8E [1,1,0,0,0,0|1,0,1]=4 2340 B9R1.15 NCc1ccccc1C 1P0037DE [1,1,0,0,0,0|1,0,1]=4 2341 B9R1.15 NCc1ccccc1Cl 1P0033PV [1,1,0,0,0,0|1,0,1]=4 2342 B9R1.15 NCc1ccccc1Cl 1P00BGK2 [1,1,0,0,0,0|1,0,1]=4 2343 B9R1.15 NCc1ccccc1F 1P0033SE [1,1,0,0,0,0|1,0,1]=4 2344 B9R1.15 NCc1ccccc1I 1P007333 [1,1,0,0,0,0|1,0,1]=4 2345 B9R1.15 NCc1ccccc1I 1P00C7RL [1,1,0,0,0,0|1,0,1]=4 2346 B9R1.15 NCc1ccccc1N 1P00DEQ7 [1,1,0,0,0,0|1,0,1]=4 2347 B9R1.15 NCc1ccccc1O 1P003FFO [1,1,0,0,0,0|1,0,1]=4 2348 B9R1.15 NCc1ccccc1O 1P00EIWG [1,1,0,0,0,0|1,0,1]=4 2349 B9R1.15 NCc1ccccc1O 1P01DLDC [1,1,0,0,0,0|1,0,1]=4 2350 B9R1.15 NCc1cccnc1Br 1P002ARU [1,1,0,0,0,0|0,0,1]=3 2351 B9R1.15 NCc1cccnc1Br 1P028CUY [1,1,0,0,0,0|0,0,1]=3 2352 B9R1.15 NCc1cccnc1C 1P00EDWW [1,1,0,0,0,0|0,0,1]=3 2353 B9R1.15 NCc1cccnc1C 1P00IAV8 [1,1,0,0,0,0|0,0,1]=3 2354 B9R1.15 NCc1cccnc1Cl 1P002ARV [1,1,0,0,0,0|0,0,1]=3 2355 B9R1.15 NCc1cccnc1Cl 1P00A0HW [1,1,0,0,0,0|0,0,1]=3 2356 B9R1.15 NCc1cccnc1Cl 1P00AAIK [1,1,0,0,0,0|0,0,1]=3 2357 B9R1.15 NCc1cccnc1F 1P002ART [1,1,0,0,0,0|0,0,1]=3 2358 B9R1.15 NCc1cccnc1F 1P004N9V [1,1,0,0,0,0|0,0,1]=3 2359 B9R1.15 NCc1cccnc1I 1P028H2F [1,1,0,0,0,0|0,0,1]=3 2360 B9R1.15 NCc1cccnc1N 1P001JPL [1,1,0,0,0,0|0,0,1]=3 2361 B9R1.15 NCc1cnccc1Br 1P00A1FX [1,1,0,0,0,0|0,0,1]=3 2362 B9R1.15 NCc1cnccc1C 1P001JR8 [1,1,0,0,0,0|0,0,1]=3 2363 B9R1.15 NCc1cnccc1C 1P01C1KV [1,1,0,0,0,0|0,0,1]=3 2364 B9R1.15 NCc1cnccc1Cl 1P00K2ZK [1,1,0,0,0,0|0,0,1]=3 2365 B9R1.15 NCc1cnccc1Cl 1P019FAL [1,1,0,0,0,0|0,0,1]=3 2366 B9R1.15 NCc1cnccc1N 1P01AGC1 [1,1,0,0,0,0|0,0,1]=3 2367 B9R1.15 NCc1cnccc1O 1P02056P [1,1,0,0,0,0|0,0,1]=3 2368 B9R1.15 NCc1cncnc1N 1P01A1P3 [1,1,0,0,0,0|1,0,1]=4 2369 B9R1.15 NCc1cncnc1N 1P024TUQ [1,1,0,0,0,0|1,0,1]=4 2370 B9R1.15 NCc1nccnc1C 1P00HYI0 [1,1,0,0,0,0|1,0,1]=4 2371 B9R1.15 NCc1nccnc1C 1P01JUQD [1,1,0,0,0,0|1,0,1]=4 2372 B9R1.15 NCc1nccnc1Cl 1P0036SQ [1,1,0,0,0,0|1,0,1]=4 2373 B9R1.15 NCc1nccnc1Cl 1P005Y3P [1,1,0,0,0,0|1,0,1]=4 2374 B9R1.15 NCc1nccnc1N 1P002RGF [1,1,0,0,0,0|1,0,1]=4 2375 B9R1.15 NCc1nccnc1O 1P028A3M [1,1,0,0,0,0|1,0,1]=4 2376 B9R1.15 NCc1nnccc1C 1P0293V7 [1,1,0,0,0,0|1,0,1]=4 2377 B9R1.15 NNc1ccccc1Br 1P001XRH [1,1,0,0,0,0|2,0,0]=4 2378 B9R1.15 NNc1ccccc1Br 1P0033NI [1,1,0,0,0,0|2,0,0]=4 2379 B9R1.15 NNc1ccccc1C 1P003TYZ [1,1,0,0,0,0|2,0,0]=4 2380 B9R1.15 NNc1ccccc1Cl 1P0033Q9 [1,1,0,0,0,0|2,0,0]=4 2381 B9R1.15 NNc1ccccc1F 1P002OLG [1,1,0,0,0,0|2,0,0]=4 2382 B9R1.15 NNc1ccccc1F 1P002YAI [1,1,0,0,0,0|2,0,0]=4 2383 B9R1.15 NNc1ccccc1I 1P00DBVY [1,1,0,0,0,0|2,0,0]=4 2384 B9R1.15 NNc1ccccc1I 1P00EZL5 [1,1,0,0,0,0|2,0,0]=4 2385 B9R1.15 NNc1cccnc1C 1P00IMPU [1,1,0,0,0,0|1,0,0]=3 2386 B9R1.15 NNc1cccnc1Cl 1P000E63 [1,1,0,0,0,0|1,0,0]=3 2387 B9R1.15 NNc1cccnc1F 1P0240I2 [1,1,0,0,0,0|1,0,0]=3 2388 B9R1.15 NNc1nccnc1C 1P002C0X [1,1,0,0,0,0|2,0,0]=4 2389 B9R1.15 NNc1nccnc1Cl 1P003HC9 [1,1,0,0,0,0|2,0,0]=4 2390 B9R1.15 NNc1nccnc1F 1P00R6M7 [1,1,0,0,0,0|2,0,0]=4 2391 B9R1.15 NNc1nnccc1C 1P00G7J5 [1,1,0,0,0,0|2,0,0]=4 2392 B9R1.15 NOc1ccccc1Cl 1P01B91N [1,1,0,0,0,0|2,0,0]=4 2393 B9R1.15 NOc1ccccc1Cl 1P01BFN7 [1,1,0,0,0,0|2,0,0]=4 2394 B9R1.15 NOc1ccccc1F 1P01BFN6 [1,1,0,0,0,0|2,0,0]=4 2395 B9R1.15 O=Cc1c[nH]ccc1=N 1P01DU8B [1,1,0,0,0,0|0,0,1]=3 2396 B9R1.15 O=Cc1ccccc1Br 1P003H83 [1,1,0,0,0,0|1,0,0]=3 2397 B9R1.15 O=Cc1ccccc1C 1P0032QN [1,1,0,0,0,0|1,0,0]=3 2398 B9R1.15 O=Cc1ccccc1Cl 1P0033PS [1,1,0,0,0,0|1,0,0]=3 2399 B9R1.15 O=Cc1ccccc1F 1P003HS2 [1,1,0,0,0,0|1,0,0]=3 2400 B9R1.15 O=Cc1ccccc1I 1P002SZ0 [1,1,0,0,0,0|1,0,0]=3 2401 B9R1.15 O=Cc1ccccc1N 1P00I9WT [1,1,0,0,0,0|1,0,0]=3 2402 B9R1.15 O=Cc1cccnc1Br 1P000Y70 [1,1,0,0,0,0|0,0,0]=2 2403 B9R1.15 O=Cc1cccnc1C 1P00EDM2 [1,1,0,0,0,0|0,0,0]=2 2404 B9R1.15 O=Cc1cccnc1Cl 1P003HC8 [1,1,0,0,0,0|0,0,0]=2 2405 B9R1.15 O=Cc1cccnc1F 1P003991 [1,1,0,0,0,0|0,0,0]=2 2406 B9R1.15 O=Cc1cccnc1N 1P0033JT [1,1,0,0,0,0|0,0,0]=2 2407 B9R1.15 O=Cc1cccnc1O 1P01XDHM [1,1,0,0,0,0|0,0,0]=2 2408 B9R1.15 O=Cc1ccncc1Br 1P003JII [1,1,0,0,0,0|2,0,0]=4 2409 B9R1.15 O=Cc1ccncc1C 1P005AUA [1,1,0,0,0,0|2,0,0]=4 2410 B9R1.15 O=Cc1ccncc1Cl 1P003JOU [1,1,0,0,0,0|2,0,0]=4 2411 B9R1.15 O=Cc1ccncc1F 1P003463 [1,1,0,0,0,0|2,0,0]=4 2412 B9R1.15 O=Cc1ccncc1N 1P00DEZT [1,1,0,0,0,0|2,0,0]=4 2413 B9R1.15 O=Cc1ccncc1O 1P00757U [1,1,0,0,0,0|2,0,0]=4 2414 B9R1.15 O=Cc1cnccc1Br 1P000G6U [1,1,0,0,0,0|0,0,0]=2 2415 B9R1.15 O=Cc1cnccc1Br 1P00AP7I [1,1,0,0,0,0|0,0,0]=2 2416 B9R1.15 O=Cc1cnccc1C 1P00D9CN [1,1,0,0,0,0|0,0,0]=2 2417 B9R1.15 O=Cc1cnccc1Cl 1P000AXW [1,1,0,0,0,0|0,0,0]=2 2418 B9R1.15 O=Cc1cnccc1N 1P0037OR [1,1,0,0,0,0|0,0,0]=2 2419 B9R1.15 O=Cc1cnccc1N 1P00619R [1,1,0,0,0,0|0,0,0]=2 2420 B9R1.15 O=Cc1cnccc1O 1P0036Q3 [1,1,0,0,0,0|0,0,0]=2 2421 B9R1.15 O=Cc1cncnc1N 1P001UPA [1,1,0,0,0,0|1,0,0]=3 2422 B9R1.15 O=Cc1ncccc1Br 1P00342J [1,1,0,0,0,0|2,0,0]=4 2423 B9R1.15 O=Cc1ncccc1C 1P003K64 [1,1,0,0,0,0|2,0,0]=4 2424 B9R1.15 O=Cc1ncccc1Cl 1P002B0R [1,1,0,0,0,0|2,0,0]=4 2425 B9R1.15 O=Cc1ncccc1F 1P00346F [1,1,0,0,0,0|2,0,0]=4 2426 B9R1.15 O=Cc1ncccc1N 1P0037JT [1,1,0,0,0,0|2,0,0]=4 2427 B9R1.15 O=Cc1ncccc1O 1P007SB0 [1,1,0,0,0,0|2,0,0]=4 2428 B9R1.15 O=Cc1nccnc1C 1P00BGLJ [1,1,0,0,0,0|1,0,0]=3 2429 B9R1.15 O=Cc1nccnc1Cl 1P0081RE [1,1,0,0,0,0|1,0,0]=3 2430 B9R1.15 O=Cc1nccnc1F 1P00I4F3 [1,1,0,0,0,0|1,0,0]=3 2431 B9R1.15 O=Cc1nccnc1N 1P0039AI [1,1,0,0,0,0|1,0,0]=3 2432 B9R1.15 O=Nc1ccccc1C 1P00EG52 [1,1,0,0,0,0|2,0,0]=4 2433 B9R1.15 O=c1c(C=O)ccc[nH]1 1P003HWG [1,1,0,0,0,0|0,0,1]=3 2434 B9R1.15 OCc1cccnc1Br 1P001054 [1,1,0,0,0,0|0,0,2]=4 2435 B9R1.15 OCc1cccnc1C 1P003BPS [1,1,0,0,0,0|0,0,2]=4 2436 B9R1.15 OCc1cccnc1Cl 1P003C3A [1,1,0,0,0,0|0,0,2]=4 2437 B9R1.15 OCc1cccnc1F 1P001053 [1,1,0,0,0,0|0,0,2]=4 2438 B9R1.15 OCc1cccnc1N 1P002OD6 [1,1,0,0,0,0|0,0,2]=4 2439 B9R1.15 OCc1cnccc1Br 1P00AQMY [1,1,0,0,0,0|0,0,2]=4 2440 B9R1.15 OCc1cnccc1C 1P00D9CV [1,1,0,0,0,0|0,0,2]=4 2441 B9R1.15 OCc1cnccc1Cl 1P002E5M [1,1,0,0,0,0|0,0,2]=4 2442 B9R1.15 OCc1cnccc1Cl 1P002OUG [1,1,0,0,0,0|0,0,2]=4 2443 B9R1.15 OCc1cnccc1N 1P0018HB [1,1,0,0,0,0|0,0,2]=4 2444 B9R1.11 BrCC(=O)c1ccc[nH]1 1P005CA3 [0,1,0,0,1,0|1,0,1]=4 2445 B9R1.11 BrCC(=O)c1ccco1 1P001NJG [0,1,0,0,1,0|2,0,0]=4 2446 B9R1.11 BrCC(=O)c1cccs1 1P003H2I [0,1,0,0,1,0|2,0,0]=4 2447 B9R1.11 BrCC(=O)c1ccon1 1P01DX6N [0,1,0,0,1,0|2,0,0]=4 2448 B9R1.11 BrCC(=O)c1cscc1 1P001ETB [0,1,0,0,1,0|2,0,0]=4 2449 B9R1.11 BrCC(=O)c1nccs1 1P00BZYW [0,1,0,0,1,0|2,0,0]=4 2450 B9R1.11 CCC(=O)c1c[nH]nc1 1P01BA1Q [0,1,0,0,1,0|2,0,0]=4 2451 B9R1.11 CCC(=O)c1cc[nH]n1 1P0282X4 [0,1,0,0,1,0|2,0,0]=4 2452 B9R1.11 CCC(=O)c1ccc[nH]1 1P003ID5 [0,1,0,0,1,0|1,0,1]=4 2453 B9R1.11 CCC(=O)c1ccco1 1P003ID4 [0,1,0,0,1,0|2,0,0]=4 2454 B9R1.11 CCC(=O)c1cccs1 1P0012U6 [0,1,0,0,1,0|2,0,0]=4 2455 B9R1.11 CCC(=O)c1cnc[nH]1 1P00BHRO [0,1,0,0,1,0|2,0,0]=4 2456 B9R1.11 CCC(=O)c1cnco1 1P028798 [0,1,0,0,1,0|2,0,0]=4 2457 B9R1.11 CCC(=O)c1cocc1 1P00BHS8 [0,1,0,0,1,0|2,0,0]=4 2458 B9R1.11 CCC(=O)c1cocn1 1P028HDM [0,1,0,0,1,0|2,0,0]=4 2459 B9R1.11 CCC(=O)c1ncc[nH]1 1P028BGR [0,1,0,0,1,0|2,0,0]=4 2460 B9R1.11 CCC(=O)c1ncco1 1P028HER [0,1,0,0,1,0|2,0,0]=4 2461 B9R1.11 CCC(=O)c1nccs1 1P003BQB [0,1,0,0,1,0|2,0,0]=4 2462 B9R1.11 CNC(=O)c1c[nH]cn1 1P00DGEC [0,1,0,0,1,0|1,0,0]=3 2463 B9R1.11 CNC(=O)c1c[nH]nc1 1P000GG1 [0,1,0,0,1,0|1,0,0]=3 2464 B9R1.11 CNC(=O)c1c[nH]nn1 1P0291B0 [0,1,0,0,1,0|2,0,0]=4 2465 B9R1.11 CNC(=O)c1cc[nH]n1 1P00JGME [0,1,0,0,1,0|1,0,0]=3 2466 B9R1.11 CNC(=O)c1cccs1 1P00C8IU [0,1,0,0,1,0|1,0,0]=3 2467 B9R1.11 CNC(=O)n1cccn1 1P028GXJ [0,1,0,0,1,0|1,0,0]=3 2468 B9R1.11 CNC(=O)n1cncc1 1P003TMO [0,1,0,0,1,0|1,0,0]=3 2469 B9R1.11 COC(=O)c1c[nH]cc1 1P003S13 [0,1,0,0,1,0|1,0,1]=4 2470 B9R1.11 COC(=O)c1c[nH]cn1 1P0035OC [0,1,0,0,1,0|2,0,0]=4 2471 B9R1.11 COC(=O)c1c[nH]nc1 1P0023PD [0,1,0,0,1,0|2,0,0]=4 2472 B9R1.11 COC(=O)c1c[nH]nc1 1P00DAF2 [0,1,0,0,1,0|2,0,0]=4 2473 B9R1.11 COC(=O)c1cc[nH]n1 1P003S12 [0,1,0,0,1,0|2,0,0]=4 2474 B9R1.11 COC(=O)c1ccc[nH]1 1P000J0Q [0,1,0,0,1,0|1,0,1]=4 2475 B9R1.11 COC(=O)c1ccco1 1P003S4L [0,1,0,0,1,0|2,0,0]=4 2476 B9R1.11 COC(=O)c1cccs1 1P003SJG [0,1,0,0,1,0|2,0,0]=4 2477 B9R1.11 COC(=O)c1ccn[nH]1 1P0289ZM [0,1,0,0,1,0|2,0,0]=4 2478 B9R1.11 COC(=O)c1ccno1 1P001N6B [0,1,0,0,1,0|2,0,0]=4 2479 B9R1.11 COC(=O)c1ccns1 1P001QUW [0,1,0,0,1,0|2,0,0]=4 2480 B9R1.11 COC(=O)c1ccon1 1P00BINX [0,1,0,0,1,0|2,0,0]=4 2481 B9R1.11 COC(=O)c1ccsn1 1P01R884 [0,1,0,0,1,0|2,0,0]=4 2482 B9R1.11 COC(=O)c1cnco1 1P009C0L [0,1,0,0,1,0|2,0,0]=4 2483 B9R1.11 COC(=O)c1cncs1 1P001L74 [0,1,0,0,1,0|2,0,0]=4 2484 B9R1.11 COC(=O)c1cocc1 1P000WBX [0,1,0,0,1,0|2,0,0]=4 2485 B9R1.11 COC(=O)c1cocn1 1P007UTI [0,1,0,0,1,0|2,0,0]=4 2486 B9R1.11 COC(=O)c1cscc1 1P002LY4 [0,1,0,0,1,0|2,0,0]=4 2487 B9R1.11 COC(=O)c1cscn1 1P0035OH [0,1,0,0,1,0|2,0,0]=4 2488 B9R1.11 COC(=O)c1csnc1 1P00E7EL [0,1,0,0,1,0|2,0,0]=4 2489 B9R1.11 COC(=O)c1ncc[nH]1 1P001ZA3 [0,1,0,0,1,0|2,0,0]=4 2490 B9R1.11 COC(=O)c1ncc[nH]1 1P01BVZR [0,1,0,0,1,0|2,0,0]=4 2491 B9R1.11 COC(=O)c1ncco1 1P00CJ9J [0,1,0,0,1,0|2,0,0]=4 2492 B9R1.11 COC(=O)c1nccs1 1P0035MY [0,1,0,0,1,0|2,0,0]=4 2493 B9R1.11 CSC(=O)c1ccco1 1P0012UC [0,1,0,0,1,0|2,0,0]=4 2494 B9R1.11 ClCC(=O)c1ccc[nH]1 1P00DIVX [0,1,0,0,1,0|1,0,1]=4 2495 B9R1.11 ClCC(=O)c1ccco1 1P00DMAM [0,1,0,0,1,0|2,0,0]=4 2496 B9R1.11 ClCC(=O)c1cccs1 1P002ZKT [0,1,0,0,1,0|2,0,0]=4 2497 B9R1.11 ClCC(=O)c1ccns1 1P01C5EK [0,1,0,0,1,0|2,0,0]=4 2498 B9R1.11 ClCC(=O)c1ccon1 1P00H6X3 [0,1,0,0,1,0|2,0,0]=4 2499 B9R1.11 ClCC(=O)c1ccsn1 1P028FED [0,1,0,0,1,0|2,0,0]=4 2500 B9R1.11 ClCC(=O)c1cnco1 1P01EMGZ [0,1,0,0,1,0|2,0,0]=4 2501 B9R1.11 ClCC(=O)c1cncs1 1P028UK9 [0,1,0,0,1,0|2,0,0]=4 2502 B9R1.11 ClCC(=O)c1cocc1 1P00EKPA [0,1,0,0,1,0|2,0,0]=4 2503 B9R1.11 ClCC(=O)c1cocn1 1P009KJD [0,1,0,0,1,0|2,0,0]=4 2504 B9R1.11 ClCC(=O)c1cscn1 1P00DTQP [0,1,0,0,1,0|2,0,0]=4 2505 B9R1.11 ClCC(=O)n1cccn1 1P00C2N8 [0,1,0,0,1,0|2,0,0]=4 2506 B9R1.11 ICC(=O)c1ccc[nH]1 1P01C1RM [0,1,0,0,1,0|1,0,1]=4 2507 B9R1.11 NCC(=O)c1ccc[nH]1 1P027ZXO [0,1,0,0,1,0|0,0,1]=3 2508 B9R1.11 NCC(=O)c1ccco1 1P0045RE [0,1,0,0,1,0|1,0,0]=3 2509 B9R1.11 NCC(=O)c1ccsn1 1P027XBJ [0,1,0,0,1,0|1,0,0]=3 2510 B9R1.11 NCC(=O)c1cscn1 1P028AIH [0,1,0,0,1,0|1,0,0]=3 2511 B9R1.11 NCC(=O)c1nccs1 1P028BYG [0,1,0,0,1,0|1,0,0]=3 2512 B9R1.11 NCC(=O)c1nccs1 1P028CE0 [0,1,0,0,1,0|1,0,0]=3 2513 B9R1.11 NNC(=O)[C-]1C=CC=C1 1P0015PY [0,1,0,0,1,0|0,0,1]=3 2514 B9R1.11 NNC(=O)c1c[nH]cc1 1P01HQXU [0,1,0,0,1,0|0,0,1]=3 2515 B9R1.11 NNC(=O)c1c[nH]nc1 1P00GWBB [0,1,0,0,1,0|1,0,0]=3 2516 B9R1.11 NNC(=O)c1cc[nH]n1 1P002T0I [0,1,0,0,1,0|1,0,0]=3 2517 B9R1.11 NNC(=O)c1ccc[nH]1 1P00DA8K [0,1,0,0,1,0|0,0,1]=3 2518 B9R1.11 NNC(=O)c1ccco1 1P003R5U [0,1,0,0,1,0|1,0,0]=3 2519 B9R1.11 NNC(=O)c1cccs1 1P003IEX [0,1,0,0,1,0|1,0,0]=3 2520 B9R1.11 NNC(=O)c1cccs1 1P01AD5T [0,1,0,0,1,0|1,0,0]=3 2521 B9R1.11 NNC(=O)c1ccon1 1P00F5TG [0,1,0,0,1,0|1,0,0]=3 2522 B9R1.11 NNC(=O)c1cnc[nH]1 1P0027Y3 [0,1,0,0,1,0|1,0,0]=3 2523 B9R1.11 NNC(=O)c1cnco1 1P0046TI [0,1,0,0,1,0|1,0,0]=3 2524 B9R1.11 NNC(=O)c1cncs1 1P0004K2 [0,1,0,0,1,0|1,0,0]=3 2525 B9R1.11 NNC(=O)c1cnn[nH]1 1P002PEC [0,1,0,0,1,0|2,0,0]=4 2526 B9R1.11 NNC(=O)c1cnsn1 1P00F5TH [0,1,0,0,1,0|2,0,0]=4 2527 B9R1.11 NNC(=O)c1cocc1 1P01A8FS [0,1,0,0,1,0|1,0,0]=3 2528 B9R1.11 NNC(=O)c1cocn1 1P00481K [0,1,0,0,1,0|1,0,0]=3 2529 B9R1.11 NNC(=O)c1cscc1 1P0077IY [0,1,0,0,1,0|1,0,0]=3 2530 B9R1.11 NNC(=O)c1cscn1 1P0004K1 [0,1,0,0,1,0|1,0,0]=3 2531 B9R1.11 NNC(=O)c1csnc1 1P0004JS [0,1,0,0,1,0|1,0,0]=3 2532 B9R1.11 NNC(=O)c1n[nH]cn1 1P00BE3C [0,1,0,0,1,0|2,0,0]=4 2533 B9R1.11 NNC(=O)c1nccs1 1P001XS5 [0,1,0,0,1,0|1,0,0]=3 2534 B9R1.11 NNC(=O)c1nocn1 1P00791O [0,1,0,0,1,0|2,0,0]=4 2535 B9R1.11 O=CC(=O)c1ccco1 1P007UQS [0,1,0,0,1,0|2,0,0]=4 2536 B9R1.11 O=CC(=O)c1cccs1 1P022B63 [0,1,0,0,1,0|2,0,0]=4 2537 B9R1.11 O=CC(=O)c1cscc1 1P01GJPF [0,1,0,0,1,0|2,0,0]=4 2538 B9R1.11 OCC(=O)c1ccco1 1P0025D5 [0,1,0,0,1,0|2,0,0]=4 2539 B9R1.11 ON=C(c1ccco1)N 1P019KZD [0,1,0,0,1,0|1,0,1]=4 2540 B9R1.11 ON=C(c1cocc1)N 1P01BCAX [0,1,0,0,1,0|1,0,1]=4 2541 B9R1.11 ON=C(c1ncc[nH]1)N 1P01A6YQ [0,1,0,0,1,0|1,0,1]=4 2542 B9R1.11 ONC(=N)c1cccs1 1P003TJ1 [0,1,0,0,1,0|2,0,0]=4 2543 B9R1.11 ONC(=N)c1cscc1 1P00ED2B [0,1,0,0,1,0|2,0,0]=4 2544 B9R1.11 ONC(=O)c1ccco1 1P00B6L4 [0,1,0,0,1,0|1,0,0]=3 2545 B9R1.11 ONC(=O)c1cccs1 1P0025IK [0,1,0,0,1,0|1,0,0]=3 2546 B9R1.11 O\N=C(\c1ccc[nH]1)/N 1P00DEYH [0,1,0,0,1,0|0,0,2]=4 2547 B9R1.11 O\N=C(\c1cccs1)/N 1P008T9D [0,1,0,0,1,0|1,0,1]=4 2548 B9R1.11 [NH3+]CC(=O)c1cccs1 1P00FI1W [0,1,0,0,1,0|1,0,1]=4 2549 B9R1.19 NS(=O)(=O)c1c[nH]cc1 1P002I98 [0,1,0,0,1,0|1,0,1]=4 2550 B9R1.19 NS(=O)(=O)c1c[nH]nc1 1P00CERD [0,1,0,0,1,0|2,0,0]=4 2551 B9R1.19 NS(=O)(=O)c1ccco1 1P00DWOK [0,1,0,0,1,0|2,0,0]=4 2552 B9R1.19 NS(=O)(=O)c1cccs1 1P003IEP [0,1,0,0,1,0|2,0,0]=4 2553 B9R1.19 NS(=O)(=O)c1ccns1 1P0289OG [0,1,0,0,1,0|2,0,0]=4 2554 B9R1.19 NS(=O)(=O)c1cocc1 1P00CWS8 [0,1,0,0,1,0|2,0,0]=4 2555 B9R1.19 NS(=O)(=O)c1conc1 1P01AIHT [0,1,0,0,1,0|2,0,0]=4 2556 B9R1.19 NS(=O)(=O)c1nc[nH]c1 1P00EXKX [0,1,0,0,1,0|2,0,0]=4 2557 B9R1.19 NS(=O)(=O)c1ncc[nH]1 1P004DWX [0,1,0,0,1,0|2,0,0]=4 2558 B9R1.19 NS(=O)(=O)c1nccs1 1P0008YX [0,1,0,0,1,0|2,0,0]=4 2559 B9R1.19 NS(=O)(=O)c1ncsc1 1P00887H [0,1,0,0,1,0|2,0,0]=4 2560 B9R1.35 Brc1occ(c1)C(=O)N 1P01A0DU [0,1,0,0,1,0|1,0,0]=3 2561 B9R1.35 Brc1occ(c1)C(=O)O 1P003MYZ [0,1,0,0,1,0|2,0,0]=4 2562 B9R1.35 Brc1scc(c1)C(=O)C 1P00ECZK [0,1,0,0,1,0|2,0,0]=4 2563 B9R1.35 Brc1scc(c1)C(=O)N 1P002IQX [0,1,0,0,1,0|1,0,0]=3 2564 B9R1.35 Brc1scc(c1)C(=O)O 1P0002PY [0,1,0,0,1,0|2,0,0]=4 2565 B9R1.35 CC(=O)c1c[nH]c(c1)C 1P00EM9F [0,1,0,0,1,0|1,0,1]=4 2566 B9R1.35 CC(=O)c1cc(c[nH]1)Br 1P00DMFW [0,1,0,0,1,0|1,0,1]=4 2567 B9R1.35 CC(=O)c1cc(cs1)Br 1P0032ZE [0,1,0,0,1,0|2,0,0]=4 2568 B9R1.35 CC(=O)c1cc(cs1)Cl 1P00I7C4 [0,1,0,0,1,0|2,0,0]=4 2569 B9R1.35 CC(=O)c1cc(no1)Br 1P005JRJ [0,1,0,0,1,0|2,0,0]=4 2570 B9R1.35 CC(=O)c1cc(on1)N 1P01KKTV [0,1,0,0,1,0|2,0,0]=4 2571 B9R1.35 CC(=O)c1ccc([nH]1)Br 1P01JZU5 [0,1,0,0,1,0|1,0,1]=4 2572 B9R1.35 CC(=O)c1ccc(o1)Br 1P00C003 [0,1,0,0,1,0|2,0,0]=4 2573 B9R1.35 CC(=O)c1ccc(s1)Br 1P00DEDU [0,1,0,0,1,0|2,0,0]=4 2574 B9R1.35 CC(=O)c1ccc(s1)Cl 1P003GRO [0,1,0,0,1,0|2,0,0]=4 2575 B9R1.35 CC(=O)c1ccc(s1)F 1P019DIZ [0,1,0,0,1,0|2,0,0]=4 2576 B9R1.35 CC(=O)c1ccc(s1)I 1P00327T [0,1,0,0,1,0|2,0,0]=4 2577 B9R1.35 CC(=O)c1cnc([nH]1)N 1P01EKAT [0,1,0,0,1,0|2,0,0]=4 2578 B9R1.35 CC(=O)c1cnc(o1)N 1P004KRE [0,1,0,0,1,0|2,0,0]=4 2579 B9R1.35 CC(=O)c1cnc(s1)Br 1P000CA2 [0,1,0,0,1,0|2,0,0]=4 2580 B9R1.35 CC(=O)c1cnc(s1)Cl 1P00IFL7 [0,1,0,0,1,0|2,0,0]=4 2581 B9R1.35 CC(=O)c1cnc(s1)N 1P00DNW1 [0,1,0,0,1,0|2,0,0]=4 2582 B9R1.35 CC(=O)c1cnc(s1)N 1P01AJO9 [0,1,0,0,1,0|2,0,0]=4 2583 B9R1.35 CC(=O)c1cnc(s1)N 1P01DX8S [0,1,0,0,1,0|2,0,0]=4 2584 B9R1.35 CC(=O)c1csc(n1)Cl 1P028CI9 [0,1,0,0,1,0|2,0,0]=4 2585 B9R1.35 CC(=O)c1csc(n1)N 1P0004JU [0,1,0,0,1,0|2,0,0]=4 2586 B9R1.35 CC(=O)c1n[nH]c(c1)C 1P001ZIA [0,1,0,0,1,0|2,0,0]=4 2587 B9R1.35 CC(=O)c1nc(cs1)Br 1P002K2W [0,1,0,0,1,0|2,0,0]=4 2588 B9R1.35 CC(=O)c1ncc([nH]1)Br 1P01FJ37 [0,1,0,0,1,0|2,0,0]=4 2589 B9R1.35 CC(=O)c1ncc(s1)Br 1P00IDBH [0,1,0,0,1,0|2,0,0]=4 2590 B9R1.35 CC(=O)c1ncc(s1)Cl 1P00IDBG [0,1,0,0,1,0|2,0,0]=4 2591 B9R1.35 CC(=O)n1cc(cn1)I 1P00IKHD [0,1,0,0,1,0|2,0,0]=4 2592 B9R1.35 Cc1c[nH]c(n1)C(=O)C 1P006X4X [0,1,0,0,1,0|2,0,0]=4 2593 B9R1.35 Cc1c[nH]c(n1)C(=O)O 1P00674D [0,1,0,0,1,0|2,0,0]=4 2594 B9R1.35 Cc1c[nH]c(n1)C(=O)O 1P01C2ZS [0,1,0,0,1,0|2,0,0]=4 2595 B9R1.35 Cc1cc([nH]c1)C(=O)O 1P003842 [0,1,0,0,1,0|1,0,1]=4 2596 B9R1.35 Cc1cc([nH]n1)C(=O)O 1P00BZ4U [0,1,0,0,1,0|2,0,0]=4 2597 B9R1.35 Cc1cc(n[nH]1)C(=O)O 1P00378B [0,1,0,0,1,0|2,0,0]=4 2598 B9R1.35 Cc1cc(n[nH]1)C(=S)N 1P01DXQF [0,1,0,0,1,0|1,1,0]=4 2599 B9R1.35 Cc1cc(no1)C(=O)Cl 1P00BZYJ [0,1,0,0,1,0|2,0,0]=4 2600 B9R1.35 Cc1cc(no1)C(=O)N 1P00399F [0,1,0,0,1,0|1,0,0]=3 2601 B9R1.35 Cc1cc(no1)C(=O)O 1P003NCY [0,1,0,0,1,0|2,0,0]=4 2602 B9R1.35 Cc1cc(ns1)C(=O)O 1P007V5O [0,1,0,0,1,0|2,0,0]=4 2603 B9R1.35 Cc1cc(on1)C(=O)Cl 1P00DDCX [0,1,0,0,1,0|2,0,0]=4 2604 B9R1.35 Cc1cc(on1)C(=O)O 1P006X6G [0,1,0,0,1,0|2,0,0]=4 2605 B9R1.35 Cc1cc(sc1)C(=O)N 1P0053HU [0,1,0,0,1,0|1,0,0]=3 2606 B9R1.35 Cc1cc(sc1)C(=O)O 1P006XY7 [0,1,0,0,1,0|2,0,0]=4 2607 B9R1.35 Cc1cc(sn1)C(=O)O 1P00FD3U [0,1,0,0,1,0|2,0,0]=4 2608 B9R1.35 Cc1ccc([nH]1)C(=O)O 1P00380V [0,1,0,0,1,0|1,0,1]=4 2609 B9R1.35 Cc1ccc(o1)C(=N)N 1P00G545 [0,1,0,0,1,0|2,0,0]=4 2610 B9R1.35 Cc1ccc(o1)C(=N)N 1P00J2XA [0,1,0,0,1,0|2,0,0]=4 2611 B9R1.35 Cc1ccc(o1)C(=O)C 1P000J0G [0,1,0,0,1,0|2,0,0]=4 2612 B9R1.35 Cc1ccc(o1)C(=O)Cl 1P001CFN [0,1,0,0,1,0|2,0,0]=4 2613 B9R1.35 Cc1ccc(o1)C(=O)N 1P003WAO [0,1,0,0,1,0|1,0,0]=3 2614 B9R1.35 Cc1ccc(o1)C(=O)O 1P002FW0 [0,1,0,0,1,0|2,0,0]=4 2615 B9R1.35 Cc1ccc(o1)C(=S)N 1P01AJ0O [0,1,0,0,1,0|1,1,0]=4 2616 B9R1.35 Cc1ccc(s1)C(=O)C 1P0012U7 [0,1,0,0,1,0|2,0,0]=4 2617 B9R1.35 Cc1ccc(s1)C(=O)Cl 1P00C8N4 [0,1,0,0,1,0|2,0,0]=4 2618 B9R1.35 Cc1ccc(s1)C(=O)N 1P00F1EP [0,1,0,0,1,0|1,0,0]=3 2619 B9R1.35 Cc1ccc(s1)C(=O)O 1P002FXV [0,1,0,0,1,0|2,0,0]=4 2620 B9R1.35 Cc1ccn(n1)C(=N)N 1P028E33 [0,1,0,0,1,0|2,0,0]=4 2621 B9R1.35 Cc1cnc(s1)C(=O)C 1P00EL9S [0,1,0,0,1,0|2,0,0]=4 2622 B9R1.35 Cc1cnc(s1)C(=O)O 1P00EAXU [0,1,0,0,1,0|2,0,0]=4 2623 B9R1.35 Cc1coc(n1)C(=O)C 1P006H5R [0,1,0,0,1,0|2,0,0]=4 2624 B9R1.35 Cc1csc(c1)C(=O)C 1P0012U8 [0,1,0,0,1,0|2,0,0]=4 2625 B9R1.35 Cc1csc(n1)C(=N)N 1P01ACJW [0,1,0,0,1,0|2,0,0]=4 2626 B9R1.35 Cc1csc(n1)C(=O)C 1P00G607 [0,1,0,0,1,0|2,0,0]=4 2627 B9R1.35 Cc1csc(n1)C(=O)O 1P001DHN [0,1,0,0,1,0|2,0,0]=4 2628 B9R1.35 Cc1nc([nH]n1)C(=O)N 1P0032L3 [0,1,0,0,1,0|2,0,0]=4 2629 B9R1.35 Cc1nc(c[nH]1)C(=O)N 1P004I55 [0,1,0,0,1,0|1,0,0]=3 2630 B9R1.35 Cc1nc(c[nH]1)C(=O)O 1P00J21I [0,1,0,0,1,0|2,0,0]=4 2631 B9R1.35 Cc1nc(co1)C(=N)N 1P027YO6 [0,1,0,0,1,0|2,0,0]=4 2632 B9R1.35 Cc1nc(co1)C(=O)N 1P0003SF [0,1,0,0,1,0|1,0,0]=3 2633 B9R1.35 Cc1nc(co1)C(=O)O 1P002MBJ [0,1,0,0,1,0|2,0,0]=4 2634 B9R1.35 Cc1nc(co1)C(=S)N 1P00GVD7 [0,1,0,0,1,0|1,1,0]=4 2635 B9R1.35 Cc1nc(cs1)C(=O)Cl 1P00D9EV [0,1,0,0,1,0|2,0,0]=4 2636 B9R1.35 Cc1nc(cs1)C(=O)N 1P00C6Q7 [0,1,0,0,1,0|1,0,0]=3 2637 B9R1.35 Cc1nc(cs1)C(=O)O 1P00BYXQ [0,1,0,0,1,0|2,0,0]=4 2638 B9R1.35 Cc1nc(cs1)C(=O)O 1P01BF4Y [0,1,0,0,1,0|2,0,0]=4 2639 B9R1.35 Cc1nc(cs1)C(=S)N 1P001ZZP [0,1,0,0,1,0|1,1,0]=4 2640 B9R1.35 Cc1ncc([nH]1)C(=O)O 1P001DSK [0,1,0,0,1,0|2,0,0]=4 2641 B9R1.35 Cc1ncc(o1)C(=O)O 1P0015U6 [0,1,0,0,1,0|2,0,0]=4 2642 B9R1.35 Cc1ncc(s1)C(=O)C 1P00DJQ9 [0,1,0,0,1,0|2,0,0]=4 2643 B9R1.35 Cc1ncc(s1)C(=O)N 1P01A9BL [0,1,0,0,1,0|1,0,0]=3 2644 B9R1.35 Cc1ncc(s1)C(=O)O 1P0033UI [0,1,0,0,1,0|2,0,0]=4 2645 B9R1.35 Cc1nsc(c1)C(=O)C 1P01DXAF [0,1,0,0,1,0|2,0,0]=4 2646 B9R1.35 Cc1occ(c1)C(=O)O 1P00BGK8 [0,1,0,0,1,0|2,0,0]=4 2647 B9R1.35 Cc1occ(n1)C(=O)C 1P00G984 [0,1,0,0,1,0|2,0,0]=4 2648 B9R1.35 Cc1onc(c1)C(=O)C 1P00C1JB [0,1,0,0,1,0|2,0,0]=4 2649 B9R1.35 Cc1scc(c1)C(=O)C 1P00FGLX [0,1,0,0,1,0|2,0,0]=4 2650 B9R1.35 Cc1scc(c1)C(=O)O 1P002FSF [0,1,0,0,1,0|2,0,0]=4 2651 B9R1.35 Cc1scc(n1)C(=O)C 1P002MB4 [0,1,0,0,1,0|2,0,0]=4 2652 B9R1.35 ClC(=O)c1cc(cs1)Br 1P00EBGR [0,1,0,0,1,0|2,0,0]=4 2653 B9R1.35 ClC(=O)c1ccc(o1)Br 1P00BG2D [0,1,0,0,1,0|2,0,0]=4 2654 B9R1.35 ClC(=O)c1ccc(s1)Br 1P00CB85 [0,1,0,0,1,0|2,0,0]=4 2655 B9R1.35 ClC(=O)n1cc(cn1)Br 1P028XYF [0,1,0,0,1,0|2,0,0]=4 2656 B9R1.35 Clc1ccc(o1)C(=O)Cl 1P006XVP [0,1,0,0,1,0|2,0,0]=4 2657 B9R1.35 Clc1ccc(s1)C(=O)Cl 1P0072CX [0,1,0,0,1,0|2,0,0]=4 2658 B9R1.35 Clc1occ(c1)C(=O)O 1P028N0I [0,1,0,0,1,0|2,0,0]=4 2659 B9R1.35 Clc1scc(c1)C(=O)C 1P00IAT3 [0,1,0,0,1,0|2,0,0]=4 2660 B9R1.35 Clc1scc(c1)C(=O)O 1P00C006 [0,1,0,0,1,0|2,0,0]=4 2661 B9R1.35 Clc1scc(n1)C(=O)Cl 1P001W1C [0,1,0,0,1,0|2,0,0]=4 2662 B9R1.35 Cn1cc(nc1)C(=O)N 1P000UB5 [0,1,0,0,1,0|1,0,0]=3 2663 B9R1.35 Cn1cc(nc1)C(=O)O 1P003EZB [0,1,0,0,1,0|2,0,0]=4 2664 B9R1.35 Cn1cc(nn1)C(=O)N 1P00CLHB [0,1,0,0,1,0|2,0,0]=4 2665 B9R1.35 Cn1ccc(c1)C(=O)C 1P003J9N [0,1,0,0,1,0|1,0,1]=4 2666 B9R1.35 Cn1ccc(c1)C(=O)O 1P00CJ7K [0,1,0,0,1,0|1,0,1]=4 2667 B9R1.35 Cn1ccc(n1)C(=O)C 1P0014IN [0,1,0,0,1,0|2,0,0]=4 2668 B9R1.35 Cn1ccc(n1)C(=O)Cl 1P0054CU [0,1,0,0,1,0|2,0,0]=4 2669 B9R1.35 Cn1ccc(n1)C(=O)N 1P003WQD [0,1,0,0,1,0|1,0,0]=3 2670 B9R1.35 Cn1ccc(n1)C(=O)O 1P002QO3 [0,1,0,0,1,0|2,0,0]=4 2671 B9R1.35 Cn1cnc(c1)C(=O)C 1P000Z8X [0,1,0,0,1,0|2,0,0]=4 2672 B9R1.35 Cn1nc(cn1)C(=O)N 1P028VR6 [0,1,0,0,1,0|2,0,0]=4 2673 B9R1.35 Cn1ncc(c1)C(=N)N 1P019U0U [0,1,0,0,1,0|2,0,0]=4 2674 B9R1.35 Cn1ncc(c1)C(=N)N 1P028JO1 [0,1,0,0,1,0|2,0,0]=4 2675 B9R1.35 Cn1ncc(c1)C(=O)C 1P0038EA [0,1,0,0,1,0|2,0,0]=4 2676 B9R1.35 Cn1ncc(c1)C(=O)Cl 1P008MCZ [0,1,0,0,1,0|2,0,0]=4 2677 B9R1.35 Cn1ncc(c1)C(=O)N 1P00H2BD [0,1,0,0,1,0|1,0,0]=3 2678 B9R1.35 Cn1ncc(c1)C(=O)O 1P003EXY [0,1,0,0,1,0|2,0,0]=4 2679 B9R1.35 Cn1ncc(c1)C(=S)N 1P019VNR [0,1,0,0,1,0|1,1,0]=4 2680 B9R1.35 Ic1scc(c1)C(=O)O 1P01AH3W [0,1,0,0,1,0|2,0,0]=4 2681 B9R1.35 NC(=N)c1ccc(s1)Cl 1P019X2D [0,1,0,0,1,0|2,0,0]=4 2682 B9R1.35 NC(=O)c1c[nH]c(=O)[nH]1 1P028HL5 [0,1,0,0,1,0|1,0,1]=4 2683 B9R1.35 NC(=O)c1c[nH]c(c1)Br 1P01DWKA [0,1,0,0,1,0|0,0,1]=3 2684 B9R1.35 NC(=O)c1cc([nH]n1)Br 1P028URT [0,1,0,0,1,0|1,0,0]=3 2685 B9R1.35 NC(=O)c1cc(c[nH]1)Br 1P007RME [0,1,0,0,1,0|0,0,1]=3 2686 B9R1.35 NC(=O)c1cc(co1)Br 1P00IJVW [0,1,0,0,1,0|1,0,0]=3 2687 B9R1.35 NC(=O)c1cc(cs1)Br 1P004RML [0,1,0,0,1,0|1,0,0]=3 2688 B9R1.35 NC(=O)c1cc(no1)Br 1P000M39 [0,1,0,0,1,0|1,0,0]=3 2689 B9R1.35 NC(=O)c1cc(no1)Cl 1P00BVEZ [0,1,0,0,1,0|1,0,0]=3 2690 B9R1.35 NC(=O)c1cc(no1)O 1P0080DZ [0,1,0,0,1,0|1,0,0]=3 2691 B9R1.35 NC(=O)c1cc(sn1)Br 1P0281MO [0,1,0,0,1,0|1,0,0]=3 2692 B9R1.35 NC(=O)c1ccc([nH]1)Br 1P0021FZ [0,1,0,0,1,0|0,0,1]=3 2693 B9R1.35 NC(=O)c1ccc(o1)Br 1P00EEFR [0,1,0,0,1,0|1,0,0]=3 2694 B9R1.35 NC(=O)c1ccc(s1)Br 1P003N1U [0,1,0,0,1,0|1,0,0]=3 2695 B9R1.35 NC(=O)c1ccc(s1)Cl 1P006Z72 [0,1,0,0,1,0|1,0,0]=3 2696 B9R1.35 NC(=O)c1cnc(s1)Br 1P004R9N [0,1,0,0,1,0|1,0,0]=3 2697 B9R1.35 NC(=O)c1coc(n1)Br 1P019GFY [0,1,0,0,1,0|1,0,0]=3 2698 B9R1.35 NC(=O)c1coc(n1)Cl 1P00085C [0,1,0,0,1,0|1,0,0]=3 2699 B9R1.35 NC(=O)c1csc(n1)Br 1P004R9M [0,1,0,0,1,0|1,0,0]=3 2700 B9R1.35 NC(=O)c1n[nH]c(c1)N 1P0016YH [0,1,0,0,1,0|1,0,0]=3 2701 B9R1.35 NC(=O)c1n[nH]c(c1)N 1P00J2OO [0,1,0,0,1,0|1,0,0]=3 2702 B9R1.35 NC(=O)c1n[nH]c(n1)N 1P00EO5O [0,1,0,0,1,0|2,0,0]=4 2703 B9R1.35 NC(=O)c1nc(cs1)Br 1P028IIE [0,1,0,0,1,0|1,0,0]=3 2704 B9R1.35 NC(=O)c1nc(n[nH]1)Br 1P008VYT [0,1,0,0,1,0|2,0,0]=4 2705 B9R1.35 NC(=O)c1nc(n[nH]1)Cl 1P00DYRM [0,1,0,0,1,0|2,0,0]=4 2706 B9R1.35 NC(=O)c1ncc([nH]1)Br 1P0024AC [0,1,0,0,1,0|1,0,0]=3 2707 B9R1.35 NC(=O)c1nnc(s1)Br 1P0095JS [0,1,0,0,1,0|2,0,0]=4 2708 B9R1.35 NC(=O)c1nnc(s1)Cl 1P00ELCW [0,1,0,0,1,0|2,0,0]=4 2709 B9R1.35 NC(=S)c1cc(cs1)Br 1P019WI8 [0,1,0,0,1,0|1,1,0]=4 2710 B9R1.35 NC(=S)c1ccc(s1)Br 1P019WI7 [0,1,0,0,1,0|1,1,0]=4 2711 B9R1.35 NC(=S)c1ccc(s1)Cl 1P00IY5I [0,1,0,0,1,0|1,1,0]=4 2712 B9R1.35 Nc1c[nH]c(c1)C(=O)N 1P019M0B [0,1,0,0,1,0|0,0,1]=3 2713 B9R1.35 Nc1cc([nH]c1)C(=O)O 1P001OPN [0,1,0,0,1,0|1,0,1]=4 2714 B9R1.35 Nc1cc([nH]n1)C(=O)O 1P01F2QC [0,1,0,0,1,0|2,0,0]=4 2715 B9R1.35 Nc1cc(n[nH]1)C(=O)O 1P000LUD [0,1,0,0,1,0|2,0,0]=4 2716 B9R1.35 Nc1cnc([nH]1)C(=O)O 1P001OPO [0,1,0,0,1,0|2,0,0]=4 2717 B9R1.35 Nc1cnc(s1)C(=O)N 1P009XUS [0,1,0,0,1,0|1,0,0]=3 2718 B9R1.35 Nc1cnc(s1)C(=S)N 1P01A46E [0,1,0,0,1,0|1,1,0]=4 2719 B9R1.35 Nc1csc(c1)C(=O)N 1P00GJ2G [0,1,0,0,1,0|1,0,0]=3 2720 B9R1.35 Nc1csc(n1)C(=O)O 1P020LR2 [0,1,0,0,1,0|2,0,0]=4 2721 B9R1.35 Nc1nc(co1)C(=O)O 1P00H6TL [0,1,0,0,1,0|2,0,0]=4 2722 B9R1.35 Nc1nc(cs1)C(=O)O 1P007TGE [0,1,0,0,1,0|2,0,0]=4 2723 B9R1.35 Nc1nc(cs1)C(=O)O 1P00BYGM [0,1,0,0,1,0|2,0,0]=4 2724 B9R1.35 Nc1ncc([nH]1)C(=O)O 1P004QJA [0,1,0,0,1,0|2,0,0]=4 2725 B9R1.35 Nc1ncc(o1)C(=O)N 1P01K243 [0,1,0,0,1,0|1,0,0]=3 2726 B9R1.35 Nc1ncc(o1)C(=O)O 1P004DTR [0,1,0,0,1,0|2,0,0]=4 2727 B9R1.35 Nc1ncc(s1)C(=O)N 1P00DK22 [0,1,0,0,1,0|1,0,0]=3 2728 B9R1.35 Nc1ncc(s1)C(=O)O 1P003H0W [0,1,0,0,1,0|2,0,0]=4 2729 B9R1.35 Nc1nnc(s1)C(=O)N 1P019GFM [0,1,0,0,1,0|2,0,0]=4 2730 B9R1.35 Nc1occ(n1)C(=O)N 1P01A35Q [0,1,0,0,1,0|1,0,0]=3 2731 B9R1.35 Nc1onc(c1)C(=O)N 1P01DTN4 [0,1,0,0,1,0|1,0,0]=3 2732 B9R1.35 Nc1scc(c1)C(=O)O 1P00428K [0,1,0,0,1,0|2,0,0]=4 2733 B9R1.35 Nc1scc(n1)C(=O)N 1P0076TK [0,1,0,0,1,0|1,0,0]=3 2734 B9R1.35 O=C(C1=CC(Br)=NN1)O 1P01K3J6 [0,1,0,0,1,0|2,0,0]=4 2735 B9R1.35 OC(=O)c1c[nH]c(c1)Br 1P01AIY4 [0,1,0,0,1,0|1,0,1]=4 2736 B9R1.35 OC(=O)c1c[nH]c(c1)C 1P000145 [0,1,0,0,1,0|1,0,1]=4 2737 B9R1.35 OC(=O)c1c[nH]c(c1)Cl 1P00IDIT [0,1,0,0,1,0|1,0,1]=4 2738 B9R1.35 OC(=O)c1cc([nH]n1)Br 1P0011SC [0,1,0,0,1,0|2,0,0]=4 2739 B9R1.35 OC(=O)c1cc([nH]n1)Cl 1P0034PW [0,1,0,0,1,0|2,0,0]=4 2740 B9R1.35 OC(=O)c1cc(c[nH]1)Br 1P002V40 [0,1,0,0,1,0|1,0,1]=4 2741 B9R1.35 OC(=O)c1cc(c[nH]1)Cl 1P002V3Z [0,1,0,0,1,0|1,0,1]=4 2742 B9R1.35 OC(=O)c1cc(c[nH]1)F 1P00I94R [0,1,0,0,1,0|1,0,1]=4 2743 B9R1.35 OC(=O)c1cc(c[nH]1)I 1P00BHHI [0,1,0,0,1,0|1,0,1]=4 2744 B9R1.35 OC(=O)c1cc(co1)Br 1P00CJ7O [0,1,0,0,1,0|2,0,0]=4 2745 B9R1.35 OC(=O)c1cc(cs1)Br 1P001XH5 [0,1,0,0,1,0|2,0,0]=4 2746 B9R1.35 OC(=O)c1cc(cs1)Cl 1P0037GW [0,1,0,0,1,0|2,0,0]=4 2747 B9R1.35 OC(=O)c1cc(cs1)F 1P00CNOT [0,1,0,0,1,0|2,0,0]=4 2748 B9R1.35 OC(=O)c1cc(cs1)I 1P02832Q [0,1,0,0,1,0|2,0,0]=4 2749 B9R1.35 OC(=O)c1cc(n[nH]1)F 1P01AF6J [0,1,0,0,1,0|2,0,0]=4 2750 B9R1.35 OC(=O)c1cc(no1)Br 1P00FAJ4 [0,1,0,0,1,0|2,0,0]=4 2751 B9R1.35 OC(=O)c1cc(no1)Cl 1P002JDV [0,1,0,0,1,0|2,0,0]=4 2752 B9R1.35 OC(=O)c1cc(ns1)Cl 1P01AGRG [0,1,0,0,1,0|2,0,0]=4 2753 B9R1.35 OC(=O)c1cc(on1)Cl 1P01AEJ7 [0,1,0,0,1,0|2,0,0]=4 2754 B9R1.35 OC(=O)c1cc(on1)I 1P01C1O1 [0,1,0,0,1,0|2,0,0]=4 2755 B9R1.35 OC(=O)c1cc(sn1)I 1P028I3X [0,1,0,0,1,0|2,0,0]=4 2756 B9R1.35 OC(=O)c1ccc([nH]1)Br 1P00BIR8 [0,1,0,0,1,0|1,0,1]=4 2757 B9R1.35 OC(=O)c1ccc([nH]1)Cl 1P01AEQB [0,1,0,0,1,0|1,0,1]=4 2758 B9R1.35 OC(=O)c1ccc(o1)Br 1P003N0Q [0,1,0,0,1,0|2,0,0]=4 2759 B9R1.35 OC(=O)c1ccc(o1)Cl 1P00EC71 [0,1,0,0,1,0|2,0,0]=4 2760 B9R1.35 OC(=O)c1ccc(o1)F 1P01A4YN [0,1,0,0,1,0|2,0,0]=4 2761 B9R1.35 OC(=O)c1ccc(o1)I 1P0076RJ [0,1,0,0,1,0|2,0,0]=4 2762 B9R1.35 OC(=O)c1ccc(s1)Br 1P003N1V [0,1,0,0,1,0|2,0,0]=4 2763 B9R1.35 OC(=O)c1ccc(s1)Cl 1P0034Q1 [0,1,0,0,1,0|2,0,0]=4 2764 B9R1.35 OC(=O)c1ccc(s1)F 1P0037P2 [0,1,0,0,1,0|2,0,0]=4 2765 B9R1.35 OC(=O)c1ccc(s1)I 1P00EKUJ [0,1,0,0,1,0|2,0,0]=4 2766 B9R1.35 OC(=O)c1cnc([nH]1)Br 1P027VDL [0,1,0,0,1,0|2,0,0]=4 2767 B9R1.35 OC(=O)c1cnc([nH]1)Cl 1P01EKL4 [0,1,0,0,1,0|2,0,0]=4 2768 B9R1.35 OC(=O)c1cnc([nH]1)S 1P00BF9O [0,1,0,0,1,0|2,0,0]=4 2769 B9R1.35 OC(=O)c1cnc(o1)Br 1P0013LO [0,1,0,0,1,0|2,0,0]=4 2770 B9R1.35 OC(=O)c1cnc(o1)Cl 1P001OGC [0,1,0,0,1,0|2,0,0]=4 2771 B9R1.35 OC(=O)c1cnc(s1)Br 1P00IA41 [0,1,0,0,1,0|2,0,0]=4 2772 B9R1.35 OC(=O)c1cnc(s1)Cl 1P000408 [0,1,0,0,1,0|2,0,0]=4 2773 B9R1.35 OC(=O)c1cnc(s1)F 1P000DLG [0,1,0,0,1,0|2,0,0]=4 2774 B9R1.35 OC(=O)c1coc(n1)Br 1P000DIM [0,1,0,0,1,0|2,0,0]=4 2775 B9R1.35 OC(=O)c1coc(n1)Cl 1P005TBB [0,1,0,0,1,0|2,0,0]=4 2776 B9R1.35 OC(=O)c1csc(n1)Br 1P003H5O [0,1,0,0,1,0|2,0,0]=4 2777 B9R1.35 OC(=O)c1csc(n1)C 1P00J3X4 [0,1,0,0,1,0|2,0,0]=4 2778 B9R1.35 OC(=O)c1csc(n1)Cl 1P0033QF [0,1,0,0,1,0|2,0,0]=4 2779 B9R1.35 OC(=O)c1csc(n1)I 1P00IIM5 [0,1,0,0,1,0|2,0,0]=4 2780 B9R1.35 OC(=O)c1csc(n1)S 1P00H4SC [0,1,0,0,1,0|2,0,0]=4 2781 B9R1.35 OC(=O)c1n[nH]c(c1)O 1P007690 [0,1,0,0,1,0|2,0,0]=4 2782 B9R1.35 OC(=O)c1nc(cs1)Br 1P00460R [0,1,0,0,1,0|2,0,0]=4 2783 B9R1.35 OC(=O)c1nc(cs1)Cl 1P01BGBZ [0,1,0,0,1,0|2,0,0]=4 2784 B9R1.35 OC(=O)c1ncc([nH]1)Br 1P000RKE [0,1,0,0,1,0|2,0,0]=4 2785 B9R1.35 OC(=O)c1ncc([nH]1)Br 1P024XO6 [0,1,0,0,1,0|2,0,0]=4 2786 B9R1.35 OC(=O)c1ncc([nH]1)Cl 1P0024BI [0,1,0,0,1,0|2,0,0]=4 2787 B9R1.35 OC(=O)c1ncc([nH]1)I 1P0024C2 [0,1,0,0,1,0|2,0,0]=4 2788 B9R1.35 OC(=O)c1ncc(s1)Br 1P00IJVZ [0,1,0,0,1,0|2,0,0]=4 2789 B9R1.35 OC(=O)c1ncc(s1)Cl 1P000407 [0,1,0,0,1,0|2,0,0]=4 2790 B9R1.35 Oc1csc(c1)C(=O)O 1P0075UV [0,1,0,0,1,0|2,0,0]=4 2791 B9R1.35 Oc1ncc(o1)C(=O)O 1P00HWCT [0,1,0,0,1,0|2,0,0]=4 2792 B9R1.35 Oc1noc(c1)C(=O)O 1P0038LK [0,1,0,0,1,0|2,0,0]=4 2793 B9R1.35 [O-]C(=O)c1nc(co1)C 1P01CAOG [0,1,0,0,1,0|2,0,0]=4 2794 B9R1.35 [O-]C(=O)c1nc(cs1)Br 1P01FJ5U [0,1,0,0,1,0|2,0,0]=4 2795 B9R1.35 [O-]C(=O)c1nc(cs1)I 1P027TUT [0,1,0,0,1,0|2,0,0]=4 2796 B9R1.35 [O-]C(=O)c1ncc(o1)C 1P00231P [0,1,0,0,1,0|2,0,0]=4 2797 B9R1.35 [O-]C(=O)c1ncc(o1)C 1P01BD53 [0,1,0,0,1,0|2,0,0]=4 2798 B9R1.35 [O-]C(=O)c1ncc(s1)Br 1P01BBZE [0,1,0,0,1,0|2,0,0]=4 2799 B9R1.35 [O-]C(=O)c1ncc(s1)I 1P0293S7 [0,1,0,0,1,0|2,0,0]=4 2800 B9R1.35 [O-]C(=O)c1ncc(s1)N 1P01XANR [0,1,0,0,1,0|2,0,0]=4 2801 B9R1.41 CC(=O)c1c(Br)cn[nH]1 1P01EM0Q [0,1,0,0,1,0|2,0,0]=4 2802 B9R1.41 CC(=O)c1c[nH]cc1C 1P002H7O [0,1,0,0,1,0|1,0,1]=4 2803 B9R1.41 CC(=O)c1c[nH]nc1C 1P00941L [0,1,0,0,1,0|2,0,0]=4 2804 B9R1.41 CC(=O)c1cccn1C 1P003GRG [0,1,0,0,1,0|1,0,1]=4 2805 B9R1.41 CC(=O)c1ccnn1C 1P0014IM [0,1,0,0,1,0|2,0,0]=4 2806 B9R1.41 CC(=O)c1ccsc1Br 1P0013HS [0,1,0,0,1,0|2,0,0]=4 2807 B9R1.41 CC(=O)c1ccsc1N 1P00H3GS [0,1,0,0,1,0|2,0,0]=4 2808 B9R1.41 CC(=O)c1cn[nH]c1C 1P00J9CA [0,1,0,0,1,0|2,0,0]=4 2809 B9R1.41 CC(=O)c1cncn1C 1P002KUI [0,1,0,0,1,0|2,0,0]=4 2810 B9R1.41 CC(=O)c1cncn1C 1P01BE59 [0,1,0,0,1,0|2,0,0]=4 2811 B9R1.41 CC(=O)c1cnoc1C 1P00EE7E [0,1,0,0,1,0|2,0,0]=4 2812 B9R1.41 CC(=O)c1conc1Br 1P027W0I [0,1,0,0,1,0|2,0,0]=4 2813 B9R1.41 CC(=O)c1conc1C 1P00ETLU [0,1,0,0,1,0|2,0,0]=4 2814 B9R1.41 CC(=O)c1cscc1Br 1P01AVHJ [0,1,0,0,1,0|2,0,0]=4 2815 B9R1.41 CC(=O)c1cscc1C 1P028JR5 [0,1,0,0,1,0|2,0,0]=4 2816 B9R1.41 CC(=O)c1csnc1C 1P01DWPQ [0,1,0,0,1,0|2,0,0]=4 2817 B9R1.41 CC(=O)c1n[nH]cc1I 1P028ZKO [0,1,0,0,1,0|2,0,0]=4 2818 B9R1.41 CC(=O)c1nccn1C 1P004Q7M [0,1,0,0,1,0|2,0,0]=4 2819 B9R1.41 CC(=O)c1ncsc1C 1P01EC4G [0,1,0,0,1,0|2,0,0]=4 2820 B9R1.41 CC(=O)c1nscc1Br 1P028X0N [0,1,0,0,1,0|2,0,0]=4 2821 B9R1.41 CC(=O)c1occc1Br 1P007QLH [0,1,0,0,1,0|2,0,0]=4 2822 B9R1.41 CC(=O)c1occc1C 1P000VSJ [0,1,0,0,1,0|2,0,0]=4 2823 B9R1.41 CC(=O)c1sccc1Br 1P00C0VH [0,1,0,0,1,0|2,0,0]=4 2824 B9R1.41 CC(=O)c1sccc1C 1P0012U9 [0,1,0,0,1,0|2,0,0]=4 2825 B9R1.41 CC(=O)c1sccc1Cl 1P003GRL [0,1,0,0,1,0|2,0,0]=4 2826 B9R1.41 CC(=O)c1sccc1O 1P00DEZ7 [0,1,0,0,1,0|2,0,0]=4 2827 B9R1.41 CC(=O)c1scnc1Br 1P01BYF4 [0,1,0,0,1,0|2,0,0]=4 2828 B9R1.41 CC(=O)c1scnc1C 1P00C8WG [0,1,0,0,1,0|2,0,0]=4 2829 B9R1.41 CC(=O)c1scnc1Cl 1P024HPG [0,1,0,0,1,0|2,0,0]=4 2830 B9R1.41 CC(=O)c1sncc1Br 1P01KWHE [0,1,0,0,1,0|2,0,0]=4 2831 B9R1.41 CC(=O)c1sncc1Cl 1P028F9B [0,1,0,0,1,0|2,0,0]=4 2832 B9R1.41 Cc1c(cc[nH]1)C(=O)O 1P00CJAR [0,1,0,0,1,0|1,0,1]=4 2833 B9R1.41 Cc1c(cn[nH]1)C(=O)O 1P008ZBW [0,1,0,0,1,0|2,0,0]=4 2834 B9R1.41 Cc1c(nc[nH]1)C(=O)O 1P00J3V3 [0,1,0,0,1,0|2,0,0]=4 2835 B9R1.41 Cc1c[nH]cc1C(=O)O 1P00EEYA [0,1,0,0,1,0|1,0,1]=4 2836 B9R1.41 Cc1c[nH]nc1C(=O)N 1P0283IM [0,1,0,0,1,0|1,0,0]=3 2837 B9R1.41 Cc1c[nH]nc1C(=O)O 1P003M98 [0,1,0,0,1,0|2,0,0]=4 2838 B9R1.41 Cc1c[nH]nc1C(=O)O 1P01C25O [0,1,0,0,1,0|2,0,0]=4 2839 B9R1.41 Cc1cnoc1C(=O)O 1P002S9L [0,1,0,0,1,0|2,0,0]=4 2840 B9R1.41 Cc1cnsc1C(=O)O 1P001QUX [0,1,0,0,1,0|2,0,0]=4 2841 B9R1.41 Cc1cocc1C(=O)O 1P00HA4A [0,1,0,0,1,0|2,0,0]=4 2842 B9R1.41 Cc1conc1C(=O)N 1P01S3X6 [0,1,0,0,1,0|1,0,0]=3 2843 B9R1.41 Cc1conc1C(=O)O 1P007QD3 [0,1,0,0,1,0|2,0,0]=4 2844 B9R1.41 Cc1cscc1C(=O)Cl 1P01AD6M [0,1,0,0,1,0|2,0,0]=4 2845 B9R1.41 Cc1cscc1C(=O)O 1P008O79 [0,1,0,0,1,0|2,0,0]=4 2846 B9R1.41 Cc1n[nH]cc1C(=O)O 1P0037YK [0,1,0,0,1,0|2,0,0]=4 2847 B9R1.41 Cc1nc[nH]c1C(=O)O 1P001DSJ [0,1,0,0,1,0|2,0,0]=4 2848 B9R1.41 Cc1ncoc1C(=O)Cl 1P00EBHW [0,1,0,0,1,0|2,0,0]=4 2849 B9R1.41 Cc1ncoc1C(=O)N 1P006WSN [0,1,0,0,1,0|1,0,0]=3 2850 B9R1.41 Cc1ncoc1C(=O)O 1P002QXR [0,1,0,0,1,0|2,0,0]=4 2851 B9R1.41 Cc1ncsc1C(=O)Cl 1P00DC0O [0,1,0,0,1,0|2,0,0]=4 2852 B9R1.41 Cc1ncsc1C(=O)O 1P002A6Z [0,1,0,0,1,0|2,0,0]=4 2853 B9R1.41 Cc1nocc1C(=O)N 1P01DVPN [0,1,0,0,1,0|1,0,0]=3 2854 B9R1.41 Cc1nocc1C(=O)O 1P003481 [0,1,0,0,1,0|2,0,0]=4 2855 B9R1.41 Cc1nscc1C(=O)O 1P001QW4 [0,1,0,0,1,0|2,0,0]=4 2856 B9R1.41 Cc1occc1C(=N)N 1P00A7RN [0,1,0,0,1,0|2,0,0]=4 2857 B9R1.41 Cc1occc1C(=O)O 1P003I5Y [0,1,0,0,1,0|2,0,0]=4 2858 B9R1.41 Cc1ocnc1C(=O)O 1P003ND2 [0,1,0,0,1,0|2,0,0]=4 2859 B9R1.41 Cc1oncc1C(=O)Cl 1P00FDHY [0,1,0,0,1,0|2,0,0]=4 2860 B9R1.41 Cc1oncc1C(=O)N 1P01DEZ5 [0,1,0,0,1,0|1,0,0]=3 2861 B9R1.41 Cc1oncc1C(=O)O 1P003NCC [0,1,0,0,1,0|2,0,0]=4 2862 B9R1.41 Cc1sccc1C(=O)O 1P002FXW [0,1,0,0,1,0|2,0,0]=4 2863 B9R1.41 Cc1scnc1C(=O)O 1P007QWB [0,1,0,0,1,0|2,0,0]=4 2864 B9R1.41 Cc1sncc1C(=O)O 1P01DYW5 [0,1,0,0,1,0|2,0,0]=4 2865 B9R1.41 ClC(=O)c1cscc1Br 1P005EGP [0,1,0,0,1,0|2,0,0]=4 2866 B9R1.41 ClC(=O)c1nccn1C 1P01EN3O [0,1,0,0,1,0|2,0,0]=4 2867 B9R1.41 ClC(=O)c1occc1C 1P007ONW [0,1,0,0,1,0|2,0,0]=4 2868 B9R1.41 ClC(=O)c1sccc1C 1P003K8S [0,1,0,0,1,0|2,0,0]=4 2869 B9R1.41 Cn1cncc1C(=O)Cl 1P00BZIQ [0,1,0,0,1,0|2,0,0]=4 2870 B9R1.41 Cn1cncc1C(=O)N 1P00C788 [0,1,0,0,1,0|1,0,0]=3 2871 B9R1.41 Cn1cncc1C(=O)O 1P00339D [0,1,0,0,1,0|2,0,0]=4 2872 B9R1.41 Cn1nccc1C(=N)N 1P028VLL [0,1,0,0,1,0|2,0,0]=4 2873 B9R1.41 Cn1nccc1C(=O)Cl 1P004VXZ [0,1,0,0,1,0|2,0,0]=4 2874 B9R1.41 Cn1nccc1C(=O)N 1P00JE4T [0,1,0,0,1,0|1,0,0]=3 2875 B9R1.41 Cn1nccc1C(=O)O 1P001SBJ [0,1,0,0,1,0|2,0,0]=4 2876 B9R1.41 Cn1nccc1C(=S)N 1P01B6QC [0,1,0,0,1,0|1,1,0]=4 2877 B9R1.41 Cn1nccc1S(=O)N 1P027TX9 [0,1,0,0,1,0|2,0,0]=4 2878 B9R1.41 FC1=C(NC=C1)C(=O)O 1P01FWZK [0,1,0,0,1,0|1,0,1]=4 2879 B9R1.41 NC(=N)c1cccn1C 1P028B9E [0,1,0,0,1,0|1,0,1]=4 2880 B9R1.41 NC(=N)c1nccn1C 1P00G63R [0,1,0,0,1,0|2,0,0]=4 2881 B9R1.41 NC(=N)c1occc1C 1P01ACR5 [0,1,0,0,1,0|2,0,0]=4 2882 B9R1.41 NC(=O)c1[nH]cnc1N 1P0034D4 [0,1,0,0,1,0|1,0,0]=3 2883 B9R1.41 NC(=O)c1[nH]cnc1N 1P0034NM [0,1,0,0,1,0|1,0,0]=3 2884 B9R1.41 NC(=O)c1[nH]ncc1N 1P006K7C [0,1,0,0,1,0|1,0,0]=3 2885 B9R1.41 NC(=O)c1[nH]ncc1N 1P00J2LF [0,1,0,0,1,0|1,0,0]=3 2886 B9R1.41 NC(=O)c1c(Br)cn[nH]1 1P009MCN [0,1,0,0,1,0|1,0,0]=3 2887 B9R1.41 NC(=O)c1c(Cl)cn[nH]1 1P00JE26 [0,1,0,0,1,0|1,0,0]=3 2888 B9R1.41 NC(=O)c1c(O)nc[nH]1 1P00E9J7 [0,1,0,0,1,0|1,0,0]=3 2889 B9R1.41 NC(=O)c1c[nH]nc1N 1P002UGF [0,1,0,0,1,0|1,0,0]=3 2890 B9R1.41 NC(=O)c1c[nH]nc1N 1P003419 [0,1,0,0,1,0|1,0,0]=3 2891 B9R1.41 NC(=O)c1cccn1C 1P00EC56 [0,1,0,0,1,0|0,0,1]=3 2892 B9R1.41 NC(=O)c1cccn1N 1P001U6H [0,1,0,0,1,0|0,0,1]=3 2893 B9R1.41 NC(=O)c1cccn1N 1P00APL7 [0,1,0,0,1,0|0,0,1]=3 2894 B9R1.41 NC(=O)c1ccsc1Br 1P002IS4 [0,1,0,0,1,0|1,0,0]=3 2895 B9R1.41 NC(=O)c1ccsc1N 1P001D9F [0,1,0,0,1,0|1,0,0]=3 2896 B9R1.41 NC(=O)c1cnoc1N 1P000XF2 [0,1,0,0,1,0|1,0,0]=3 2897 B9R1.41 NC(=O)c1cnoc1N 1P005SV3 [0,1,0,0,1,0|1,0,0]=3 2898 B9R1.41 NC(=O)c1cnsc1N 1P001IBT [0,1,0,0,1,0|1,0,0]=3 2899 B9R1.41 NC(=O)c1cscc1Br 1P0001T8 [0,1,0,0,1,0|1,0,0]=3 2900 B9R1.41 NC(=O)c1n[nH]cc1Br 1P006HOX [0,1,0,0,1,0|1,0,0]=3 2901 B9R1.41 NC(=O)c1nc[nH]c1N 1P00EOBR [0,1,0,0,1,0|1,0,0]=3 2902 B9R1.41 NC(=O)c1nccn1C 1P002DC9 [0,1,0,0,1,0|1,0,0]=3 2903 B9R1.41 NC(=O)c1ncsc1Cl 1P01BCY1 [0,1,0,0,1,0|1,0,0]=3 2904 B9R1.41 NC(=O)c1ncsc1N 1P00DIFM [0,1,0,0,1,0|1,0,0]=3 2905 B9R1.41 NC(=O)c1nn[nH]c1N 1P00DH8Y [0,1,0,0,1,0|2,0,0]=4 2906 B9R1.41 NC(=O)c1nsnc1N 1P01AFNI [0,1,0,0,1,0|2,0,0]=4 2907 B9R1.41 NC(=O)c1nsnc1N 1P01BBVS [0,1,0,0,1,0|2,0,0]=4 2908 B9R1.41 NC(=O)c1occc1C 1P01A9MR [0,1,0,0,1,0|1,0,0]=3 2909 B9R1.41 NC(=O)c1sccc1C 1P003K8T [0,1,0,0,1,0|1,0,0]=3 2910 B9R1.41 NC(=O)c1sccc1N 1P001F3L [0,1,0,0,1,0|1,0,0]=3 2911 B9R1.41 NC(=O)c1snnc1C 1P0020Q8 [0,1,0,0,1,0|2,0,0]=4 2912 B9R1.41 NC(=S)c1cn[nH]c1N 1P01AJVH [0,1,0,0,1,0|1,1,0]=4 2913 B9R1.41 NC(=S)c1cscc1Br 1P01DZ6L [0,1,0,0,1,0|1,1,0]=4 2914 B9R1.41 NC(=S)c1nc[nH]c1N 1P0250QV [0,1,0,0,1,0|1,1,0]=4 2915 B9R1.41 NC(=S)c1nccn1C 1P00466V [0,1,0,0,1,0|1,1,0]=4 2916 B9R1.41 NC(=S)c1sccc1Br 1P00BE5L [0,1,0,0,1,0|1,1,0]=4 2917 B9R1.41 NC(=S)c1sccc1C 1P00A8YW [0,1,0,0,1,0|1,1,0]=4 2918 B9R1.41 Nc1c(cn[nH]1)C(=O)O 1P00A3YG [0,1,0,0,1,0|2,0,0]=4 2919 B9R1.41 Nc1c[nH]nc1C(=O)O 1P000BTK [0,1,0,0,1,0|2,0,0]=4 2920 B9R1.41 Nc1cn[nH]c1C(=O)O 1P009WJM [0,1,0,0,1,0|2,0,0]=4 2921 B9R1.41 Nc1csnc1C(=O)O 1P005R0T [0,1,0,0,1,0|2,0,0]=4 2922 B9R1.41 Nc1n[nH]cc1C(=O)O 1P003425 [0,1,0,0,1,0|2,0,0]=4 2923 B9R1.41 Nc1sccc1C(=O)O 1P00EAZ3 [0,1,0,0,1,0|2,0,0]=4 2924 B9R1.41 O=C(C1=C(Br)SN=C1)O 1P01KCRT [0,1,0,0,1,0|2,0,0]=4 2925 B9R1.41 OC(=O)c1[nH]ccc1Br 1P001DWJ [0,1,0,0,1,0|1,0,1]=4 2926 B9R1.41 OC(=O)c1[nH]ccc1C 1P006BCT [0,1,0,0,1,0|1,0,1]=4 2927 B9R1.41 OC(=O)c1c(Br)cn[nH]1 1P008VW1 [0,1,0,0,1,0|2,0,0]=4 2928 B9R1.41 OC(=O)c1c(Br)nc[nH]1 1P00JSC8 [0,1,0,0,1,0|2,0,0]=4 2929 B9R1.41 OC(=O)c1c(Cl)cn[nH]1 1P004RQV [0,1,0,0,1,0|2,0,0]=4 2930 B9R1.41 OC(=O)c1c(Cl)nc[nH]1 1P020MPN [0,1,0,0,1,0|2,0,0]=4 2931 B9R1.41 OC(=O)c1c(I)cn[nH]1 1P006LYK [0,1,0,0,1,0|2,0,0]=4 2932 B9R1.41 OC(=O)c1c[nH]nc1Cl 1P009I65 [0,1,0,0,1,0|2,0,0]=4 2933 B9R1.41 OC(=O)c1c[nH]nc1I 1P01KZM6 [0,1,0,0,1,0|2,0,0]=4 2934 B9R1.41 OC(=O)c1cccn1C 1P00ICFR [0,1,0,0,1,0|1,0,1]=4 2935 B9R1.41 OC(=O)c1ccoc1Br 1P002BKS [0,1,0,0,1,0|2,0,0]=4 2936 B9R1.41 OC(=O)c1ccoc1Cl 1P007JLL [0,1,0,0,1,0|2,0,0]=4 2937 B9R1.41 OC(=O)c1ccoc1I 1P00KE9C [0,1,0,0,1,0|2,0,0]=4 2938 B9R1.41 OC(=O)c1ccsc1Br 1P0033LT [0,1,0,0,1,0|2,0,0]=4 2939 B9R1.41 OC(=O)c1ccsc1Cl 1P00DE30 [0,1,0,0,1,0|2,0,0]=4 2940 B9R1.41 OC(=O)c1ccsc1F 1P006BTP [0,1,0,0,1,0|2,0,0]=4 2941 B9R1.41 OC(=O)c1ccsc1I 1P002I22 [0,1,0,0,1,0|2,0,0]=4 2942 B9R1.41 OC(=O)c1cn[nH]c1Br 1P01BWDO [0,1,0,0,1,0|2,0,0]=4 2943 B9R1.41 OC(=O)c1cn[nH]c1Cl 1P0081IG [0,1,0,0,1,0|2,0,0]=4 2944 B9R1.41 OC(=O)c1cocc1Br 1P020M53 [0,1,0,0,1,0|2,0,0]=4 2945 B9R1.41 OC(=O)c1cscc1Br 1P001XH6 [0,1,0,0,1,0|2,0,0]=4 2946 B9R1.41 OC(=O)c1cscc1Cl 1P019TZV [0,1,0,0,1,0|2,0,0]=4 2947 B9R1.41 OC(=O)c1cscc1F 1P008O78 [0,1,0,0,1,0|2,0,0]=4 2948 B9R1.41 OC(=O)c1cscc1I 1P0055VX [0,1,0,0,1,0|2,0,0]=4 2949 B9R1.41 OC(=O)c1csnc1Br 1P01BZ36 [0,1,0,0,1,0|2,0,0]=4 2950 B9R1.41 OC(=O)c1csnc1Cl 1P006GOM [0,1,0,0,1,0|2,0,0]=4 2951 B9R1.41 OC(=O)c1n[nH]cc1Br 1P0013R2 [0,1,0,0,1,0|2,0,0]=4 2952 B9R1.41 OC(=O)c1n[nH]cc1F 1P019U2K [0,1,0,0,1,0|2,0,0]=4 2953 B9R1.41 OC(=O)c1n[nH]cc1I 1P01K16F [0,1,0,0,1,0|2,0,0]=4 2954 B9R1.41 OC(=O)c1nccn1C 1P002A6Y [0,1,0,0,1,0|2,0,0]=4 2955 B9R1.41 OC(=O)c1ncoc1Br 1P000LYR [0,1,0,0,1,0|2,0,0]=4 2956 B9R1.41 OC(=O)c1ncsc1Br 1P003N1R [0,1,0,0,1,0|2,0,0]=4 2957 B9R1.41 OC(=O)c1nocc1Br 1P028H8R [0,1,0,0,1,0|2,0,0]=4 2958 B9R1.41 OC(=O)c1nocc1Cl 1P01EL98 [0,1,0,0,1,0|2,0,0]=4 2959 B9R1.41 OC(=O)c1nscc1Br 1P00I8ZX [0,1,0,0,1,0|2,0,0]=4 2960 B9R1.41 OC(=O)c1nscc1N 1P01A093 [0,1,0,0,1,0|2,0,0]=4 2961 B9R1.41 OC(=O)c1nscc1O 1P0026ER [0,1,0,0,1,0|2,0,0]=4 2962 B9R1.41 OC(=O)c1occc1Br 1P001LTO [0,1,0,0,1,0|2,0,0]=4 2963 B9R1.41 OC(=O)c1occc1C 1P003K7Z [0,1,0,0,1,0|2,0,0]=4 2964 B9R1.41 OC(=O)c1occc1Cl 1P01BB0X [0,1,0,0,1,0|2,0,0]=4 2965 B9R1.41 OC(=O)c1occc1F 1P027RMC [0,1,0,0,1,0|2,0,0]=4 2966 B9R1.41 OC(=O)c1ocnc1Br 1P021TPK [0,1,0,0,1,0|2,0,0]=4 2967 B9R1.41 OC(=O)c1sccc1Br 1P0036HF [0,1,0,0,1,0|2,0,0]=4 2968 B9R1.41 OC(=O)c1sccc1C 1P00347S [0,1,0,0,1,0|2,0,0]=4 2969 B9R1.41 OC(=O)c1sccc1Cl 1P00392Q [0,1,0,0,1,0|2,0,0]=4 2970 B9R1.41 OC(=O)c1sccc1F 1P00BYYA [0,1,0,0,1,0|2,0,0]=4 2971 B9R1.41 OC(=O)c1sccc1I 1P0037XF [0,1,0,0,1,0|2,0,0]=4 2972 B9R1.41 OC(=O)c1sccc1N 1P003JBB [0,1,0,0,1,0|2,0,0]=4 2973 B9R1.41 OC(=O)c1sccc1O 1P00D9E3 [0,1,0,0,1,0|2,0,0]=4 2974 B9R1.41 OC(=O)c1scnc1Br 1P000MK2 [0,1,0,0,1,0|2,0,0]=4 2975 B9R1.41 OC(=O)c1scnc1Cl 1P00DL89 [0,1,0,0,1,0|2,0,0]=4 2976 B9R1.41 OC(=O)c1scnc1I 1P027VG4 [0,1,0,0,1,0|2,0,0]=4 2977 B9R1.41 OC(=O)c1sncc1Br 1P01A4FX [0,1,0,0,1,0|2,0,0]=4 2978 B9R1.41 [O-]C(=O)c1nccn1C 1P01DX22 [0,1,0,0,1,0|2,0,0]=4 2979 B9R1.41 [O-]C(=O)c1sccc1N 1P01T6ZE [0,1,0,0,1,0|2,0,0]=4 2980 B11R1.20 CC(=O)Cc1ccc(cc1)C 1P002KSA [0,1,0,0,0,1|2,0,0]=4 2981 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1P003LOO [0,1,0,0,0,1|2,0,0]=4 2982 B11R1.20 CC(=O)Cc1ccc(cc1)F 1P003LWP [0,1,0,0,0,1|2,0,0]=4 2983 B11R1.20 CC(=O)Cc1ccc(cc1)O 1P003M0E [0,1,0,0,0,1|2,0,0]=4 2984 B11R1.20 CC(=O)Nc1ccc(cc1)Br 1P003LFZ [0,1,0,0,0,1|2,0,0]=4 2985 B11R1.20 CC(=O)Nc1ccc(cc1)C 1P0034KG [0,1,0,0,0,1|2,0,0]=4 2986 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 1P003LMW [0,1,0,0,0,1|2,0,0]=4 2987 B11R1.20 CC(=O)Nc1ccc(cc1)F 1P003LVG [0,1,0,0,0,1|2,0,0]=4 2988 B11R1.20 CC(=O)Nc1ccc(cc1)I 1P003STB [0,1,0,0,0,1|2,0,0]=4 2989 B11R1.20 CC(=O)Nc1ccc(cc1)N 1P003L7A [0,1,0,0,0,1|2,0,0]=4 2990 B11R1.20 CC(=O)Nc1ccc(cc1)N 1P003L7B [0,1,0,0,0,1|2,0,0]=4 2991 B11R1.20 CC(=O)Nc1ccc(cc1)O 1P0034CJ [0,1,0,0,0,1|2,0,0]=4 2992 B11R1.20 CC(=O)Nc1ccc(cc1)S 1P003L30 [0,1,0,0,0,1|2,0,0]=4 2993 B11R1.20 CC(=O)Nc1ccc(nc1)N 1P01A6QX [0,1,0,0,0,1|1,0,0]=3 2994 B11R1.20 CC(=O)Nc1ccc(nc1)O 1P007373 [0,1,0,0,0,1|1,0,0]=3 2995 B11R1.20 CC(=O)Nc1ccc(nn1)Cl 1P001MB9 [0,1,0,0,0,1|2,0,0]=4 2996 B11R1.20 CC(=O)Oc1ccc(cc1)Br 1P007RNE [0,1,0,0,0,1|2,0,0]=4 2997 B11R1.20 CC(=O)Oc1ccc(cc1)C 1P001CE9 [0,1,0,0,0,1|2,0,0]=4 2998 B11R1.20 CC(=O)Oc1ccc(cc1)Cl 1P004ICL [0,1,0,0,0,1|2,0,0]=4 2999 B11R1.20 CC(=O)Oc1ccc(cc1)F 1P0034I6 [0,1,0,0,0,1|2,0,0]=4 3000 B11R1.20 CC(=O)Oc1ccc(cc1)I 1P00CN12 [0,1,0,0,0,1|2,0,0]=4 3001 B11R1.20 CC(=O)Oc1ccc(cc1)N 1P009BBN [0,1,0,0,0,1|2,0,0]=4 3002 B11R1.20 CC(=O)Oc1ccc(cc1)O 1P00C6UC [0,1,0,0,0,1|2,0,0]=4 3003 B11R1.20 CC(=O)Oc1ccc(nc1)Br 1P01SUQU [0,1,0,0,0,1|1,0,0]=3 3004 B11R1.20 ClC(=O)Cc1ccc(cc1)Br 1P00JLAO [0,1,0,0,0,1|2,0,0]=4 3005 B11R1.20 ClC(=O)Cc1ccc(cc1)C 1P00C0VI [0,1,0,0,0,1|2,0,0]=4 3006 B11R1.20 ClC(=O)Cc1ccc(cc1)Cl 1P0034GI [0,1,0,0,0,1|2,0,0]=4 3007 B11R1.20 ClC(=O)Cc1ccc(cc1)F 1P003LWR [0,1,0,0,0,1|2,0,0]=4 3008 B11R1.20 ClC(=O)Oc1ccc(cc1)Br 1P003LHL [0,1,0,0,0,1|2,0,0]=4 3009 B11R1.20 ClC(=O)Oc1ccc(cc1)Cl 1P003LOH [0,1,0,0,0,1|2,0,0]=4 3010 B11R1.20 ClC(=O)Oc1ccc(cc1)F 1P003LWK [0,1,0,0,0,1|2,0,0]=4 3011 B11R1.20 NC(=N)Cc1ccc(cc1)Br 1P00ER80 [0,1,0,0,0,1|2,0,0]=4 3012 B11R1.20 NC(=N)Cc1ccc(cc1)C 1P00JTEG [0,1,0,0,0,1|2,0,0]=4 3013 B11R1.20 NC(=N)Nc1ccc(cc1)Br 1P01DI4V [0,1,0,0,0,1|2,0,0]=4 3014 B11R1.20 NC(=N)Nc1ccc(cc1)C 1P00DG0U [0,1,0,0,0,1|2,0,0]=4 3015 B11R1.20 NC(=Nc1ccc(cc1)Cl)N 1P007L3M [0,1,0,0,0,1|2,0,0]=4 3016 B11R1.20 NC(=O)Cc1ccc(cc1)Br 1P0059AH [0,1,0,0,0,1|1,0,0]=3 3017 B11R1.20 NC(=O)Cc1ccc(cc1)Cl 1P00BJHH [0,1,0,0,0,1|1,0,0]=3 3018 B11R1.20 NC(=O)Cc1ccc(cc1)F 1P01AARD [0,1,0,0,0,1|1,0,0]=3 3019 B11R1.20 NC(=O)Cc1ccc(cc1)N 1P00FJU0 [0,1,0,0,0,1|1,0,0]=3 3020 B11R1.20 NC(=O)Cc1ccc(cc1)O 1P003M0D [0,1,0,0,0,1|1,0,0]=3 3021 B11R1.20 NC(=O)Cc1ccc(cn1)Br 1P009D92 [0,1,0,0,0,1|2,0,0]=4 3022 B11R1.20 NC(=O)Cc1ccc(nc1)Cl 1P00DIGB [0,1,0,0,0,1|0,0,0]=2 3023 B11R1.20 NC(=O)Cc1ccc(nn1)Cl 1P02493V [0,1,0,0,0,1|1,0,0]=3 3024 B11R1.20 NC(=O)Nc1ccc(cc1)Br 1P003LHR [0,1,0,0,0,1|1,0,0]=3 3025 B11R1.20 NC(=O)Nc1ccc(cc1)C 1P003UI8 [0,1,0,0,0,1|1,0,0]=3 3026 B11R1.20 NC(=O)Nc1ccc(cc1)Cl 1P001CEA [0,1,0,0,0,1|1,0,0]=3 3027 B11R1.20 NC(=O)Nc1ccc(cc1)F 1P003LWX [0,1,0,0,0,1|1,0,0]=3 3028 B11R1.20 NC(=O)Nc1ccc(cc1)N 1P007QRZ [0,1,0,0,0,1|1,0,0]=3 3029 B11R1.20 NC(=S)Cc1ccc(cc1)Cl 1P0020UH [0,1,0,0,0,1|1,1,0]=4 3030 B11R1.20 NC(=S)Cc1ccc(cc1)F 1P00I7F0 [0,1,0,0,0,1|1,1,0]=4 3031 B11R1.20 NC(=S)Cc1ccc(cc1)N 1P01L083 [0,1,0,0,0,1|1,1,0]=4 3032 B11R1.20 NC(=S)Nc1ccc(cc1)Br 1P002TRT [0,1,0,0,0,1|1,1,0]=4 3033 B11R1.20 NC(=S)Nc1ccc(cc1)C 1P003M96 [0,1,0,0,0,1|1,1,0]=4 3034 B11R1.20 NC(=S)Nc1ccc(cc1)Cl 1P003LOV [0,1,0,0,0,1|1,1,0]=4 3035 B11R1.20 NC(=S)Nc1ccc(cc1)F 1P0032OI [0,1,0,0,0,1|1,1,0]=4 3036 B11R1.20 NC(=S)Nc1ccc(cc1)I 1P002HS9 [0,1,0,0,0,1|1,1,0]=4 3037 B11R1.20 NC(=S)Nc1ccc(cc1)O 1P003DGJ [0,1,0,0,0,1|1,1,0]=4 3038 B11R1.20 NC(=S)Nc1ccc(nc1)C 1P027OV6 [0,1,0,0,0,1|0,1,0]=3 3039 B11R1.20 NC(=S)Nc1ccc(nc1)Cl 1P000NOK [0,1,0,0,0,1|0,1,0]=3 3040 B11R1.20 NC(=S)Nc1ccc(nc1)F 1P028DM4 [0,1,0,0,0,1|0,1,0]=3 3041 B11R1.20 O=C1C=CC(=NC(=O)C)C=C1 1P003T57 [0,1,0,0,0,1|2,0,0]=4 3042 B11R1.20 OC(=O)Cc1ccc(=O)[nH]c1 1P01BGNA [0,1,0,0,0,1|1,0,1]=4 3043 B11R1.20 OC(=O)Cc1ccc(cc1)Br 1P002GYL [0,1,0,0,0,1|2,0,0]=4 3044 B11R1.20 OC(=O)Cc1ccc(cc1)C 1P0037QY [0,1,0,0,0,1|2,0,0]=4 3045 B11R1.20 OC(=O)Cc1ccc(cc1)Cl 1P002GYN [0,1,0,0,0,1|2,0,0]=4 3046 B11R1.20 OC(=O)Cc1ccc(cc1)F 1P003LWO [0,1,0,0,0,1|2,0,0]=4 3047 B11R1.20 OC(=O)Cc1ccc(cc1)I 1P0027Q4 [0,1,0,0,0,1|2,0,0]=4 3048 B11R1.20 OC(=O)Cc1ccc(cc1)N 1P000PYE [0,1,0,0,0,1|2,0,0]=4 3049 B11R1.20 OC(=O)Cc1ccc(cc1)O 1P001OVW [0,1,0,0,0,1|2,0,0]=4 3050 B11R1.20 OC(=O)Cc1ccc(cc1)S 1P003M2M [0,1,0,0,0,1|2,0,0]=4 3051 B11R1.20 OC(=O)Cc1ccc(nc1)Br 1P01DM6P [0,1,0,0,0,1|1,0,0]=3 3052 B11R1.20 OC(=O)Cc1ccc(nc1)C 1P002B7O [0,1,0,0,0,1|1,0,0]=3 3053 B11R1.20 OC(=O)Cc1ccc(nc1)Cl 1P00I8AD [0,1,0,0,0,1|1,0,0]=3 3054 B11R1.20 OC(=O)Cc1ccc(nc1)F 1P00015S [0,1,0,0,0,1|1,0,0]=3 3055 B11R1.20 OC(=O)Cc1ccc(nc1)N 1P00CLD9 [0,1,0,0,0,1|1,0,0]=3 3056 B11R1.20 OC(=O)Cc1ccc(nn1)Cl 1P01TEBX [0,1,0,0,0,1|2,0,0]=4 3057 B11R1.20 OC(=O)Cc1cnc(nc1)Cl 1P01XA94 [0,1,0,0,0,1|2,0,0]=4 3058 B11R1.20 [O-]C(=O)Cc1cnc(cn1)C 1P01FLEU [0,1,0,0,0,1|2,0,0]=4 3059 B11R1.20 [O-]C(=O)Cc1cnc(cn1)Cl 1P027XC0 [0,1,0,0,0,1|2,0,0]=4 3060 B11R1.36 BrC(c1ccccc1)C(=O)C 1P002MCS [0,1,0,0,0,1|2,0,0]=4 3061 B11R1.36 BrC(c1ccccc1)C(=O)O 1P003O8M [0,1,0,0,0,1|2,0,0]=4 3062 B11R1.36 C=C(c1ccccc1)C(=O)O 1P0033W1 [0,1,0,0,0,1|2,0,0]=4 3063 B11R1.36 CC(c1ccccc1)C(=N)N 1P00ID61 [0,1,0,0,0,1|2,0,0]=4 3064 B11R1.36 CC(c1ccccc1)C(=O)C 1P005863 [0,1,0,0,0,1|2,0,0]=4 3065 B11R1.36 CC(c1ccccc1)C(=O)N 1P01DYW4 [0,1,0,0,0,1|1,0,0]=3 3066 B11R1.36 CC(c1ccccc1)C(=O)O 1P003Q9M [0,1,0,0,0,1|2,0,0]=4 3067 B11R1.36 CC(c1cncnc1)C(=O)O 1P01BEFY [0,1,0,0,0,1|2,0,0]=4 3068 B11R1.36 CC(c1cncnc1)C(=O)O 1P01BEFZ [0,1,0,0,0,1|2,0,0]=4 3069 B11R1.36 CN(c1ccccc1)C(=N)N 1P019SM4 [0,1,0,0,0,1|2,0,0]=4 3070 B11R1.36 CN(c1ccccc1)C(=O)C 1P003TNP [0,1,0,0,0,1|2,0,0]=4 3071 B11R1.36 CN(c1ccccc1)C(=O)Cl 1P003TOV [0,1,0,0,0,1|2,0,0]=4 3072 B11R1.36 CN(c1ccccc1)C(=O)N 1P00E08N [0,1,0,0,0,1|1,0,0]=3 3073 B11R1.36 CN(c1ccccc1)C(=S)N 1P003TOW [0,1,0,0,0,1|1,1,0]=4 3074 B11R1.36 C[C@@H](c1ccccc1)C(=O)O 1P003CXR [0,1,0,0,0,1|2,0,0]=4 3075 B11R1.36 C[C@H](c1ccccc1)C(=O)N 1P009AQG [0,1,0,0,0,1|1,0,0]=3 3076 B11R1.36 C[C@H](c1ccccc1)C(=O)O 1P003CJO [0,1,0,0,0,1|2,0,0]=4 3077 B11R1.36 ClC(c1ccccc1)C(=O)C 1P00DQWI [0,1,0,0,0,1|2,0,0]=4 3078 B11R1.36 ClC(c1ccccc1)C(=O)Cl 1P002XUX [0,1,0,0,0,1|2,0,0]=4 3079 B11R1.36 ClC(c1ccccc1)C(=O)N 1P00FMLD [0,1,0,0,0,1|1,0,0]=3 3080 B11R1.36 ClC(c1ccccc1)C(=O)O 1P0033NY [0,1,0,0,0,1|2,0,0]=4 3081 B11R1.36 ClN(c1ccccc1)C(=O)C 1P003TCX [0,1,0,0,0,1|2,0,0]=4 3082 B11R1.36 Cl[C@@H](c1ccccc1)C(=O)O 1P00C23B [0,1,0,0,0,1|2,0,0]=4 3083 B11R1.36 FC(c1ccccc1)C(=O)O 1P001Q6K [0,1,0,0,0,1|2,0,0]=4 3084 B11R1.36 NC(=O)C(c1ccccn1)N 1P01ANHW [0,1,0,0,0,1|2,0,0]=4 3085 B11R1.36 NC(=O)N(c1cccnc1)C 1P01B28U [0,1,0,0,0,1|0,0,0]=2 3086 B11R1.36 NC(c1ccccc1)C(=O)C 1P00BZXU [0,1,0,0,0,1|2,0,0]=4 3087 B11R1.36 NC(c1ccccc1)C(=O)N 1P003GTB [0,1,0,0,0,1|1,0,0]=3 3088 B11R1.36 NC(c1ccccc1)C(=O)N 1P019YJK [0,1,0,0,0,1|1,0,0]=3 3089 B11R1.36 NC(c1ccccc1)C(=O)O 1P003BUF [0,1,0,0,0,1|2,0,0]=4 3090 B11R1.36 NC(c1cnccn1)C(=O)O 1P008SC0 [0,1,0,0,0,1|2,0,0]=4 3091 B11R1.36 NN(c1ccccc1)C(=O)C 1P01G7GO [0,1,0,0,0,1|2,0,0]=4 3092 B11R1.36 N[C@@H](c1ccccc1)C(=O)N 1P0035GT [0,1,0,0,0,1|1,0,0]=3 3093 B11R1.36 N[C@@H](c1ccccc1)C(=O)N 1P00EBWG [0,1,0,0,0,1|1,0,0]=3 3094 B11R1.36 N[C@@H](c1ccccc1)C(=O)O 1P003RNB [0,1,0,0,0,1|2,0,0]=4 3095 B11R1.36 N[C@H](c1ccccc1)C(=O)N 1P003POK [0,1,0,0,0,1|1,0,0]=3 3096 B11R1.36 N[C@H](c1ccccc1)C(=O)N 1P00IBVP [0,1,0,0,0,1|1,0,0]=3 3097 B11R1.36 N[C@H](c1ccccc1)C(=O)O 1P003CPF [0,1,0,0,0,1|2,0,0]=4 3098 B11R1.36 N[C@H](c1ccccc1)C(=O)O 1P00BK11 [0,1,0,0,0,1|2,0,0]=4 3099 B11R1.36 O=C(c1ccccc1)C(=O)C 1P003BIO [0,1,0,0,0,1|2,0,0]=4 3100 B11R1.36 O=C(c1ccccc1)C(=O)Cl 1P007MP4 [0,1,0,0,0,1|2,0,0]=4 3101 B11R1.36 O=C(c1ccccc1)C(=O)O 1P00IB9R [0,1,0,0,0,1|2,0,0]=4 3102 B11R1.36 O=C(c1ccccc1)C(=O)[O-] 1P006ZS3 [0,1,0,0,0,1|2,0,0]=4 3103 B11R1.36 O=C(c1ccccc1)C(=S)N 1P019MWH [0,1,0,0,0,1|1,1,0]=4 3104 B11R1.36 OC(=O)C(=O)c1cccnc1 1P00C8U9 [0,1,0,0,0,1|1,0,0]=3 3105 B11R1.36 OC(=O)C(=O)c1cccnc1 1P00J3HH [0,1,0,0,0,1|1,0,0]=3 3106 B11R1.36 OC(=O)C(c1cccnc1)C 1P00IGF2 [0,1,0,0,0,1|1,0,0]=3 3107 B11R1.36 OC(=O)C(c1cccnc1)N 1P00EADJ [0,1,0,0,0,1|1,0,0]=3 3108 B11R1.36 OC(=O)C(c1cccnc1)N 1P00IG20 [0,1,0,0,0,1|1,0,0]=3 3109 B11R1.36 OC(=O)C(c1cccnc1)N 1P019XJQ [0,1,0,0,0,1|1,0,0]=3 3110 B11R1.36 OC(=O)C(c1cccnc1)O 1P00DNB5 [0,1,0,0,0,1|1,0,0]=3 3111 B11R1.36 OC(=O)[C@@H](c1cccnc1)O 1P028RLW [0,1,0,0,0,1|1,0,0]=3 3112 B11R1.36 OC(c1ccccc1)C(=O)C 1P006OD2 [0,1,0,0,0,1|2,0,0]=4 3113 B11R1.36 OC(c1ccccc1)C(=O)N 1P003QAV [0,1,0,0,0,1|1,0,0]=3 3114 B11R1.36 OC(c1ccccc1)C(=O)O 1P003790 [0,1,0,0,0,1|2,0,0]=4 3115 B11R1.36 OC(c1ccccc1)C(=O)[O-] 1P000AQ7 [0,1,0,0,0,1|2,0,0]=4 3116 B11R1.36 O[C@@H](c1ccccc1)C(=O)N 1P003CYI [0,1,0,0,0,1|1,0,0]=3 3117 B11R1.36 O[C@@H](c1ccccc1)C(=O)O 1P000Q83 [0,1,0,0,0,1|2,0,0]=4 3118 B11R1.36 O[C@@H](c1ccccc1)C(=O)O 1P0035JL [0,1,0,0,0,1|2,0,0]=4 3119 B11R1.36 O[C@H](c1ccccc1)C(=O)N 1P003CKR [0,1,0,0,0,1|1,0,0]=3 3120 B11R1.36 O[C@H](c1ccccc1)C(=O)O 1P000Q82 [0,1,0,0,0,1|2,0,0]=4 3121 B11R1.36 O[C@H](c1ccccc1)C(=O)O 1P0032UD [0,1,0,0,0,1|2,0,0]=4 3122 B11R1.36 O[C@H](c1ccccc1)C(=O)O 1P01JVEL [0,1,0,0,0,1|2,0,0]=4 3123 B11R1.36 SC(c1ccccc1)C(=O)O 1P00E0CY [0,1,0,0,0,1|2,0,0]=4 3124 B11R1.36 [O-]C(=O)C(c1cccnc1)C 1P028SSQ [0,1,0,0,0,1|1,0,0]=3 3125 B11R1.36 [O-]C(=O)C(c1cnccn1)C 1P01BY2T [0,1,0,0,0,1|2,0,0]=4 3126 B11R1.40 BrCC(=O)Cc1ccccc1 1P002JOF [0,1,0,0,0,1|2,0,0]=4 3127 B11R1.40 BrCC(=O)Nc1cnccn1 1P019ZSD [0,1,0,0,0,1|2,0,0]=4 3128 B11R1.40 BrCC(=O)Oc1ccccc1 1P0035XL [0,1,0,0,0,1|2,0,0]=4 3129 B11R1.40 C#CC(=O)Cc1ccccc1 1P01A2K5 [0,1,0,0,0,1|2,0,0]=4 3130 B11R1.40 C=CC(=O)Cc1ccccc1 1P01ADIQ [0,1,0,0,0,1|2,0,0]=4 3131 B11R1.40 C=CC(=O)Nc1ccccc1 1P00C29T [0,1,0,0,0,1|2,0,0]=4 3132 B11R1.40 C=CC(=O)Oc1ccccc1 1P003U5I [0,1,0,0,0,1|2,0,0]=4 3133 B11R1.40 CCC(=O)Cc1ccccc1 1P000346 [0,1,0,0,0,1|2,0,0]=4 3134 B11R1.40 CCC(=O)Cc1cccnc1 1P01BIVT [0,1,0,0,0,1|1,0,0]=3 3135 B11R1.40 CCC(=O)Nc1ccccc1 1P0037QW [0,1,0,0,0,1|2,0,0]=4 3136 B11R1.40 CCC(=O)Oc1ccccc1 1P00EG93 [0,1,0,0,0,1|2,0,0]=4 3137 B11R1.40 CNC(=Cc1ccccc1)C 1P01B1W1 [0,1,0,0,0,1|2,0,0]=4 3138 B11R1.40 CNC(=O)Cc1ccccc1 1P00FF7Y [0,1,0,0,0,1|1,0,0]=3 3139 B11R1.40 CNC(=O)Cc1cccnc1 1P009TNL [0,1,0,0,0,1|0,0,0]=2 3140 B11R1.40 CNC(=O)Nc1ccccc1 1P008SLO [0,1,0,0,0,1|1,0,0]=3 3141 B11R1.40 CNC(=O)Oc1ccccc1 1P007S45 [0,1,0,0,0,1|1,0,0]=3 3142 B11R1.40 CNC(=S)Nc1ccccc1 1P007M3I [0,1,0,0,0,1|1,1,0]=4 3143 B11R1.40 COC(=O)Cc1ccccc1 1P0003W2 [0,1,0,0,0,1|2,0,0]=4 3144 B11R1.40 COC(=O)Cc1cccnc1 1P0037QD [0,1,0,0,0,1|1,0,0]=3 3145 B11R1.40 COC(=O)Cc1cccnn1 1P00I7TS [0,1,0,0,0,1|2,0,0]=4 3146 B11R1.40 COC(=O)Cc1ccnnc1 1P00IEGT [0,1,0,0,0,1|2,0,0]=4 3147 B11R1.40 COC(=O)Cc1cnccn1 1P007CSK [0,1,0,0,0,1|2,0,0]=4 3148 B11R1.40 COC(=O)Cc1cncnc1 1P00I19C [0,1,0,0,0,1|2,0,0]=4 3149 B11R1.40 COC(=O)Nc1ccccc1 1P002RWQ [0,1,0,0,0,1|2,0,0]=4 3150 B11R1.40 COC(=O)Oc1ccccc1 1P003SIP [0,1,0,0,0,1|2,0,0]=4 3151 B11R1.40 ClCC(=O)Cc1ccccc1 1P0061Y1 [0,1,0,0,0,1|2,0,0]=4 3152 B11R1.40 ClCC(=O)Nc1ccccc1 1P003HJM [0,1,0,0,0,1|2,0,0]=4 3153 B11R1.40 ClCC(=O)Nc1cccnc1 1P005OSA [0,1,0,0,0,1|1,0,0]=3 3154 B11R1.40 ClCC(=O)Nc1cccnc1 1P01AHLG [0,1,0,0,0,1|1,0,0]=3 3155 B11R1.40 ClCC(=O)Nc1cccnn1 1P01EM8B [0,1,0,0,0,1|2,0,0]=4 3156 B11R1.40 ClCC(=O)Oc1ccccc1 1P01DQKJ [0,1,0,0,0,1|2,0,0]=4 3157 B11R1.40 ICC(=O)Nc1ccccc1 1P00IN3U [0,1,0,0,0,1|2,0,0]=4 3158 B11R1.40 NCC(=O)Cc1ccccc1 1P00334Z [0,1,0,0,0,1|1,0,0]=3 3159 B11R1.40 NCC(=O)Nc1ccccc1 1P00DDPM [0,1,0,0,0,1|1,0,0]=3 3160 B11R1.40 NCC(=O)Nc1ccccc1 1P00DL14 [0,1,0,0,0,1|1,0,0]=3 3161 B11R1.40 NCC(=O)Nc1ccccn1 1P01A0T0 [0,1,0,0,0,1|2,0,0]=4 3162 B11R1.40 NCC(=O)Nc1cccnc1 1P00BKLU [0,1,0,0,0,1|0,0,0]=2 3163 B11R1.40 NCC(=O)Nc1ccncc1 1P028498 [0,1,0,0,0,1|2,0,0]=4 3164 B11R1.40 NCC(=O)Sc1ccccc1 1P028EBQ [0,1,0,0,0,1|1,0,0]=3 3165 B11R1.40 NCC(Cc1cccnc1)O 1P028Y27 [0,1,0,0,0,1|0,0,2]=4 3166 B11R1.40 NCC(Oc1cccnc1)C 1P0048SZ [0,1,0,0,0,1|1,0,1]=4 3167 B11R1.40 NNC(=O)C[n+]1ccccc1 1P0032Z5 [0,1,0,0,0,1|2,0,0]=4 3168 B11R1.40 NNC(=O)Cc1ccccc1 1P003U67 [0,1,0,0,0,1|1,0,0]=3 3169 B11R1.40 NNC(=O)Cc1ccccn1 1P005PSM [0,1,0,0,0,1|2,0,0]=4 3170 B11R1.40 NNC(=O)Cc1cccnc1 1P002B6V [0,1,0,0,0,1|0,0,0]=2 3171 B11R1.40 NNC(=O)Cc1ccncc1 1P00FB95 [0,1,0,0,0,1|2,0,0]=4 3172 B11R1.40 NNC(=O)Nc1ccccc1 1P003MG8 [0,1,0,0,0,1|1,0,0]=3 3173 B11R1.40 NNC(=O)Nc1ccccc1 1P003MG9 [0,1,0,0,0,1|1,0,0]=3 3174 B11R1.40 NNC(=O)Oc1ccccc1 1P003B60 [0,1,0,0,0,1|1,0,0]=3 3175 B11R1.40 NNC(=S)Nc1ccccc1 1P003MFV [0,1,0,0,0,1|1,1,0]=4 3176 B11R1.40 NNC(=S)Nc1cccnc1 1P007H2W [0,1,0,0,0,1|0,1,0]=3 3177 B11R1.40 O=CC(=Cc1ccccc1)C 1P0003W3 [0,1,0,0,0,1|2,0,0]=4 3178 B11R1.40 O=CC(=Cc1ccccc1)Cl 1P002898 [0,1,0,0,0,1|2,0,0]=4 3179 B11R1.40 O=C\C(=C\c1ccccc1)\Br 1P003O8L [0,1,0,0,0,1|2,0,0]=4 3180 B11R1.40 O=C\C(=C\c1ccccc1)\C 1P00ACHR [0,1,0,0,0,1|2,0,0]=4 3181 B11R1.40 O=NN(Cc1cccnc1)C 1P01XLZV [0,1,0,0,0,1|2,0,0]=4 3182 B11R1.40 OCC(=O)Nc1ccccc1 1P00DHB3 [0,1,0,0,0,1|2,0,0]=4 3183 B11R1.40 OCC(Cc1cccnc1)N 1P01BDC0 [0,1,0,0,0,1|0,0,2]=4 3184 B11R1.40 ON=C(Nc1ccccc1)N 1P028FCV [0,1,0,0,0,1|1,0,1]=4 3185 B11R1.40 ONC(=N)Cc1ccccc1 1P002G98 [0,1,0,0,0,1|2,0,0]=4 3186 B11R1.40 ONC(=N)Cc1cccnc1 1P0013TZ [0,1,0,0,0,1|1,0,0]=3 3187 B11R1.40 ONC(=O)Cc1ccccc1 1P00DAOE [0,1,0,0,0,1|1,0,0]=3 3188 B11R1.40 ONC(=O)Oc1ccccc1 1P00CYVR [0,1,0,0,0,1|1,0,0]=3 3189 B11R1.40 O\N=C(\Cc1cccnc1)/N 1P00DAK0 [0,1,0,0,0,1|0,0,1]=3 3190 B11R1.40 SCC(=O)Nc1ccccc1 1P006XF9 [0,1,0,0,0,1|2,0,0]=4 3191 B11R1.86 CC(=O)Cc1ccccc1Br 1P003H9D [0,1,0,0,0,1|2,0,0]=4 3192 B11R1.86 CC(=O)Cc1ccccc1C 1P00D954 [0,1,0,0,0,1|2,0,0]=4 3193 B11R1.86 CC(=O)Cc1ccccc1Cl 1P003DAJ [0,1,0,0,0,1|2,0,0]=4 3194 B11R1.86 CC(=O)Cc1ccccc1F 1P003BOY [0,1,0,0,0,1|2,0,0]=4 3195 B11R1.86 CC(=O)Cc1ccccc1I 1P01ALIT [0,1,0,0,0,1|2,0,0]=4 3196 B11R1.86 CC(=O)Cc1ccccc1O 1P000VSR [0,1,0,0,0,1|2,0,0]=4 3197 B11R1.86 CC(=O)Nc1ccccc1Br 1P003BNA [0,1,0,0,0,1|2,0,0]=4 3198 B11R1.86 CC(=O)Nc1ccccc1C 1P000QH9 [0,1,0,0,0,1|2,0,0]=4 3199 B11R1.86 CC(=O)Nc1ccccc1Cl 1P003BO5 [0,1,0,0,0,1|2,0,0]=4 3200 B11R1.86 CC(=O)Nc1ccccc1F 1P003BOW [0,1,0,0,0,1|2,0,0]=4 3201 B11R1.86 CC(=O)Nc1ccccc1I 1P007RN6 [0,1,0,0,0,1|2,0,0]=4 3202 B11R1.86 CC(=O)Nc1ccccc1N 1P003BMT [0,1,0,0,0,1|2,0,0]=4 3203 B11R1.86 CC(=O)Nc1ccccc1O 1P003GR9 [0,1,0,0,0,1|2,0,0]=4 3204 B11R1.86 CC(=O)Nc1cccnc1N 1P01A75N [0,1,0,0,0,1|1,0,0]=3 3205 B11R1.86 CC(=O)Nc1cccnc1O 1P00G9SH [0,1,0,0,0,1|1,0,0]=3 3206 B11R1.86 CC(=O)Oc1ccccc1Br 1P0024OT [0,1,0,0,0,1|2,0,0]=4 3207 B11R1.86 CC(=O)Oc1ccccc1Cl 1P003HJS [0,1,0,0,0,1|2,0,0]=4 3208 B11R1.86 CC(=O)Oc1ccccc1I 1P00C7MR [0,1,0,0,0,1|2,0,0]=4 3209 B11R1.86 CC(=O)Oc1ccccc1O 1P01BUNR [0,1,0,0,0,1|2,0,0]=4 3210 B11R1.86 CC(=O)Oc1coccc1=O 1P028MQ2 [0,1,0,0,0,1|2,0,0]=4 3211 B11R1.86 Cc1ccncc1CC(=O)O 1P01AVGM [0,1,0,0,0,1|1,0,0]=3 3212 B11R1.86 Cc1ccncc1CC(=O)O 1P01B59V [0,1,0,0,0,1|1,0,0]=3 3213 B11R1.86 Cc1ccncc1NC(=O)C 1P00DMO8 [0,1,0,0,0,1|1,0,0]=3 3214 B11R1.86 Cc1ncccc1CC(=O)O 1P01BAVJ [0,1,0,0,0,1|1,0,0]=3 3215 B11R1.86 ClC(=O)Cc1ccccc1Cl 1P003HJY [0,1,0,0,0,1|2,0,0]=4 3216 B11R1.86 ClC(=O)Cc1ccccc1F 1P003F8E [0,1,0,0,0,1|2,0,0]=4 3217 B11R1.86 ClC(=O)Oc1ccccc1C 1P007RD1 [0,1,0,0,0,1|2,0,0]=4 3218 B11R1.86 ClC(=O)Oc1ccccc1Cl 1P007RD2 [0,1,0,0,0,1|2,0,0]=4 3219 B11R1.86 ClC(=O)Oc1ccccc1F 1P01BCPK [0,1,0,0,0,1|2,0,0]=4 3220 B11R1.86 NC(=N)Cc1ccccc1Br 1P009BM9 [0,1,0,0,0,1|2,0,0]=4 3221 B11R1.86 NC(=N)Cc1ccccc1C 1P00JTDN [0,1,0,0,0,1|2,0,0]=4 3222 B11R1.86 NC(=N)Cc1ccccc1Cl 1P00DK5P [0,1,0,0,0,1|2,0,0]=4 3223 B11R1.86 NC(=N)Cc1ccccc1F 1P00IED3 [0,1,0,0,0,1|2,0,0]=4 3224 B11R1.86 NC(=N)Nc1ccccc1C 1P00C6NB [0,1,0,0,0,1|2,0,0]=4 3225 B11R1.86 NC(=N)Nc1ccccc1C 1P00FEG8 [0,1,0,0,0,1|2,0,0]=4 3226 B11R1.86 NC(=N)Nc1ccccc1Cl 1P00C3UH [0,1,0,0,0,1|2,0,0]=4 3227 B11R1.86 NC(=O)Cc1ccccc1C 1P00C7O3 [0,1,0,0,0,1|1,0,0]=3 3228 B11R1.86 NC(=O)Cc1ccccc1Cl 1P0008KE [0,1,0,0,0,1|1,0,0]=3 3229 B11R1.86 NC(=O)Cc1ccccc1F 1P00I6ND [0,1,0,0,0,1|1,0,0]=3 3230 B11R1.86 NC(=O)Cc1ccccc1N 1P00BZX4 [0,1,0,0,0,1|1,0,0]=3 3231 B11R1.86 NC(=O)Cc1ccccc1O 1P006Y9M [0,1,0,0,0,1|1,0,0]=3 3232 B11R1.86 NC(=O)Nc1ccccc1Br 1P000W2U [0,1,0,0,0,1|1,0,0]=3 3233 B11R1.86 NC(=O)Nc1ccccc1C 1P003TZ2 [0,1,0,0,0,1|1,0,0]=3 3234 B11R1.86 NC(=O)Nc1ccccc1Cl 1P000AQ3 [0,1,0,0,0,1|1,0,0]=3 3235 B11R1.86 NC(=O)Nc1ccccc1F 1P003HSV [0,1,0,0,0,1|1,0,0]=3 3236 B11R1.86 NC(=S)Cc1ccccc1Br 1P008SJN [0,1,0,0,0,1|1,1,0]=4 3237 B11R1.86 NC(=S)Cc1ccccc1F 1P00H9ZX [0,1,0,0,0,1|1,1,0]=4 3238 B11R1.86 NC(=S)Nc1ccccc1Br 1P003865 [0,1,0,0,0,1|1,1,0]=4 3239 B11R1.86 NC(=S)Nc1ccccc1C 1P00IBBO [0,1,0,0,0,1|1,1,0]=4 3240 B11R1.86 NC(=S)Nc1ccccc1Cl 1P0032OG [0,1,0,0,0,1|1,1,0]=4 3241 B11R1.86 NC(=S)Nc1ccccc1F 1P003BFU [0,1,0,0,0,1|1,1,0]=4 3242 B11R1.86 Nc1ncccc1CC(=O)O 1P000686 [0,1,0,0,0,1|1,0,0]=3 3243 B11R1.86 Nc1ncccc1CC(=O)O 1P01BE2W [0,1,0,0,0,1|1,0,0]=3 3244 B11R1.86 OC(=O)Cc1ccc[nH]c1=O 1P01KJHL [0,1,0,0,0,1|1,0,1]=4 3245 B11R1.86 OC(=O)Cc1ccccc1Br 1P0033NF [0,1,0,0,0,1|2,0,0]=4 3246 B11R1.86 OC(=O)Cc1ccccc1C 1P003I6V [0,1,0,0,0,1|2,0,0]=4 3247 B11R1.86 OC(=O)Cc1ccccc1Cl 1P003HJX [0,1,0,0,0,1|2,0,0]=4 3248 B11R1.86 OC(=O)Cc1ccccc1F 1P003HSU [0,1,0,0,0,1|2,0,0]=4 3249 B11R1.86 OC(=O)Cc1ccccc1I 1P0033TV [0,1,0,0,0,1|2,0,0]=4 3250 B11R1.86 OC(=O)Cc1ccccc1N 1P00BXSN [0,1,0,0,0,1|2,0,0]=4 3251 B11R1.86 OC(=O)Cc1ccccc1O 1P0033TN [0,1,0,0,0,1|2,0,0]=4 3252 B11R1.86 OC(=O)Cc1cccnc1Br 1P000JSL [0,1,0,0,0,1|1,0,0]=3 3253 B11R1.86 OC(=O)Cc1cccnc1Cl 1P00392A [0,1,0,0,0,1|1,0,0]=3 3254 B11R1.86 OC(=O)Cc1cccnc1F 1P00015G [0,1,0,0,0,1|1,0,0]=3 3255 B11R1.86 OC(=O)Cc1cnc[nH]c1=O 1P0285W9 [0,1,0,0,0,1|2,0,0]=4 3256 B11R1.86 OC(=O)Cc1cnccc1Cl 1P01BAKZ [0,1,0,0,0,1|1,0,0]=3 3257 B11R1.86 OC(=O)Cc1nccnc1Cl 1P00A11T [0,1,0,0,0,1|2,0,0]=4 3258 B11R1.86 OC(=O)Cc1nccnc1Cl 1P00I1YQ [0,1,0,0,0,1|2,0,0]=4 3259 B11R1.86 OC(=O)Cn1cccnc1=O 1P006P20 [0,1,0,0,0,1|2,0,0]=4 3260 B11R1.86 OC(=O)Cn1cnccc1=O 1P01C2ES [0,1,0,0,0,1|2,0,0]=4 3261 B11R1.86 [O-]C(=O)Cc1ccccc1N 1P00EO9O [0,1,0,0,0,1|2,0,0]=4 3262 B11R1.86 [O-]C(=O)Cc1cncnc1Cl 1P0283PJ [0,1,0,0,0,1|2,0,0]=4 3263 B11R1.86 [O-]C(=O)Cn1cnccc1=O 1P0284X6 [0,1,0,0,0,1|2,0,0]=4 3264 B11R1.157 CC(=O)Cc1cccc(c1)Br 1P00BC3Y [0,1,0,0,0,1|2,0,0]=4 3265 B11R1.157 CC(=O)Cc1cccc(c1)C 1P002H8X [0,1,0,0,0,1|2,0,0]=4 3266 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1P001GKC [0,1,0,0,0,1|2,0,0]=4 3267 B11R1.157 CC(=O)Cc1cccc(c1)F 1P001ZL5 [0,1,0,0,0,1|2,0,0]=4 3268 B11R1.157 CC(=O)Nc1cccc(c1)Br 1P00ECJ9 [0,1,0,0,0,1|2,0,0]=4 3269 B11R1.157 CC(=O)Nc1cccc(c1)C 1P003K73 [0,1,0,0,0,1|2,0,0]=4 3270 B11R1.157 CC(=O)Nc1cccc(c1)Cl 1P003JQW [0,1,0,0,0,1|2,0,0]=4 3271 B11R1.157 CC(=O)Nc1cccc(c1)F 1P003SRL [0,1,0,0,0,1|2,0,0]=4 3272 B11R1.157 CC(=O)Nc1cccc(c1)I 1P002GA9 [0,1,0,0,0,1|2,0,0]=4 3273 B11R1.157 CC(=O)Nc1cccc(c1)N 1P0006PM [0,1,0,0,0,1|2,0,0]=4 3274 B11R1.157 CC(=O)Nc1cccc(c1)N 1P019GG3 [0,1,0,0,0,1|2,0,0]=4 3275 B11R1.157 CC(=O)Nc1cccc(c1)O 1P00IBFR [0,1,0,0,0,1|2,0,0]=4 3276 B11R1.157 CC(=O)Nc1cccc(c1)S 1P01DX1Y [0,1,0,0,0,1|2,0,0]=4 3277 B11R1.157 CC(=O)Nc1cncc(c1)Br 1P001QTQ [0,1,0,0,0,1|1,0,0]=3 3278 B11R1.157 CC(=O)Nc1cncc(n1)Cl 1P00A8P9 [0,1,0,0,0,1|2,0,0]=4 3279 B11R1.157 CC(=O)Oc1cccc(c1)Br 1P00C7TF [0,1,0,0,0,1|2,0,0]=4 3280 B11R1.157 CC(=O)Oc1cccc(c1)C 1P0016ZW [0,1,0,0,0,1|2,0,0]=4 3281 B11R1.157 CC(=O)Oc1cccc(c1)Cl 1P000UR7 [0,1,0,0,0,1|2,0,0]=4 3282 B11R1.157 CC(=O)Oc1cccc(c1)F 1P003JY7 [0,1,0,0,0,1|2,0,0]=4 3283 B11R1.157 CC(=O)Oc1cccc(c1)I 1P00CLS4 [0,1,0,0,0,1|2,0,0]=4 3284 B11R1.157 CC(=O)Oc1cccc(c1)O 1P0006PL [0,1,0,0,0,1|2,0,0]=4 3285 B11R1.157 ClC(=O)Cc1cccc(c1)C 1P001AQH [0,1,0,0,0,1|2,0,0]=4 3286 B11R1.157 ClC(=O)Cc1cccc(c1)Cl 1P00CB7L [0,1,0,0,0,1|2,0,0]=4 3287 B11R1.157 ClC(=O)Cc1cccc(c1)F 1P00DES1 [0,1,0,0,0,1|2,0,0]=4 3288 B11R1.157 ClC(=O)Oc1cccc(c1)Br 1P01B3V1 [0,1,0,0,0,1|2,0,0]=4 3289 B11R1.157 ClC(=O)Oc1cccc(c1)C 1P002YUE [0,1,0,0,0,1|2,0,0]=4 3290 B11R1.157 ClC(=O)Oc1cccc(c1)Cl 1P01B3V3 [0,1,0,0,0,1|2,0,0]=4 3291 B11R1.157 ClC(=O)Oc1cccc(c1)F 1P01B3V5 [0,1,0,0,0,1|2,0,0]=4 3292 B11R1.157 NC(=N)Cc1cccc(c1)Br 1P00HFIH [0,1,0,0,0,1|2,0,0]=4 3293 B11R1.157 NC(=N)Cc1cccc(c1)Cl 1P00EQSS [0,1,0,0,0,1|2,0,0]=4 3294 B11R1.157 NC(=N)Cc1cccc(c1)F 1P00IED4 [0,1,0,0,0,1|2,0,0]=4 3295 B11R1.157 NC(=N)Nc1cccc(c1)Br 1P017386 [0,1,0,0,0,1|2,0,0]=4 3296 B11R1.157 NC(=N)Nc1cccc(c1)C 1P00J5RB [0,1,0,0,0,1|2,0,0]=4 3297 B11R1.157 NC(=N)Nc1cccc(c1)Cl 1P00EAGY [0,1,0,0,0,1|2,0,0]=4 3298 B11R1.157 NC(=O)Cc1cc(Cl)ccn1 1P0035UY [0,1,0,0,0,1|2,0,0]=4 3299 B11R1.157 NC(=O)Cc1cccc(c1)Br 1P00IB5E [0,1,0,0,0,1|1,0,0]=3 3300 B11R1.157 NC(=O)Cc1cccc(c1)Cl 1P00EB7X [0,1,0,0,0,1|1,0,0]=3 3301 B11R1.157 NC(=O)Cc1cccc(c1)N 1P000U3S [0,1,0,0,0,1|1,0,0]=3 3302 B11R1.157 NC(=O)Cc1cccc(c1)O 1P007OXP [0,1,0,0,0,1|1,0,0]=3 3303 B11R1.157 NC(=O)Cc1cncc(c1)F 1P01EM25 [0,1,0,0,0,1|0,0,0]=2 3304 B11R1.157 NC(=O)Nc1cccc(c1)Br 1P003JLO [0,1,0,0,0,1|1,0,0]=3 3305 B11R1.157 NC(=O)Nc1cccc(c1)Cl 1P007RKM [0,1,0,0,0,1|1,0,0]=3 3306 B11R1.157 NC(=O)Nc1cccc(c1)F 1P00G38X [0,1,0,0,0,1|1,0,0]=3 3307 B11R1.157 NC(=O)Nc1cccc(c1)I 1P01ELM8 [0,1,0,0,0,1|1,0,0]=3 3308 B11R1.157 NC(=O)Nc1cccc(c1)N 1P00I5DL [0,1,0,0,0,1|1,0,0]=3 3309 B11R1.157 NC(=O)Nc1cccc(c1)N 1P00IB20 [0,1,0,0,0,1|1,0,0]=3 3310 B11R1.157 NC(=O)Nc1cccc(c1)O 1P003K1I [0,1,0,0,0,1|1,0,0]=3 3311 B11R1.157 NC(=O)Nc1ccnc(c1)Br 1P0290AA [0,1,0,0,0,1|2,0,0]=4 3312 B11R1.157 NC(=S)Cc1cccc(c1)C 1P006SWU [0,1,0,0,0,1|1,1,0]=4 3313 B11R1.157 NC(=S)Cc1cccc(c1)Cl 1P004VQ7 [0,1,0,0,0,1|1,1,0]=4 3314 B11R1.157 NC(=S)Cc1cccc(c1)F 1P01A5WM [0,1,0,0,0,1|1,1,0]=4 3315 B11R1.157 NC(=S)Nc1cccc(c1)Br 1P003JLN [0,1,0,0,0,1|1,1,0]=4 3316 B11R1.157 NC(=S)Nc1cccc(c1)C 1P00EE8Y [0,1,0,0,0,1|1,1,0]=4 3317 B11R1.157 NC(=S)Nc1cccc(c1)Cl 1P003455 [0,1,0,0,0,1|1,1,0]=4 3318 B11R1.157 NC(=S)Nc1cccc(c1)F 1P003DDO [0,1,0,0,0,1|1,1,0]=4 3319 B11R1.157 NC(=S)Nc1cccc(c1)O 1P003DDT [0,1,0,0,0,1|1,1,0]=4 3320 B11R1.157 OC(=O)Cc1cccc(c1)Br 1P002GYM [0,1,0,0,0,1|2,0,0]=4 3321 B11R1.157 OC(=O)Cc1cccc(c1)C 1P00391S [0,1,0,0,0,1|2,0,0]=4 3322 B11R1.157 OC(=O)Cc1cccc(c1)Cl 1P002GYO [0,1,0,0,0,1|2,0,0]=4 3323 B11R1.157 OC(=O)Cc1cccc(c1)F 1P00346B [0,1,0,0,0,1|2,0,0]=4 3324 B11R1.157 OC(=O)Cc1cccc(c1)I 1P002GYK [0,1,0,0,0,1|2,0,0]=4 3325 B11R1.157 OC(=O)Cc1cccc(c1)N 1P003JEL [0,1,0,0,0,1|2,0,0]=4 3326 B11R1.157 OC(=O)Cc1cccc(c1)N 1P01AHAA [0,1,0,0,0,1|2,0,0]=4 3327 B11R1.157 OC(=O)Cc1cccc(c1)O 1P00346V [0,1,0,0,0,1|2,0,0]=4 3328 B11R1.157 OC(=O)Cc1cncc(c1)Br 1P0034OP [0,1,0,0,0,1|1,0,0]=3 3329 B11R1.157 OC(=O)Cc1cncc(c1)C 1P01AG1I [0,1,0,0,0,1|1,0,0]=3 3330 B11R1.157 OC(=O)Cc1cncc(c1)Cl 1P01SNYE [0,1,0,0,0,1|1,0,0]=3 3331 B11R1.157 OC(=O)Cc1cncc(c1)F 1P00CMVY [0,1,0,0,0,1|1,0,0]=3 3332 B11R1.157 OC(=O)Cc1cncc(c1)O 1P01AMHL [0,1,0,0,0,1|1,0,0]=3 3333 B11R1.157 OC(=O)Cc1cncc(n1)Cl 1P00H5VL [0,1,0,0,0,1|2,0,0]=4 3334 B11R1.509 CS(=Nc1cccnc1)(=O)C 1P01AMFH [0,1,0,0,0,1|2,0,0]=4 3335 B11R1.509 CS(=O)(=O)Nc1cccnc1 1P00KNSA [0,1,0,0,0,1|2,0,0]=4 3336 B11R1.509 ClS(=O)(=O)Cc1cccnc1 1P002FIT [0,1,0,0,0,1|2,0,0]=4 3337 B11R1.509 NP(=O)(Oc1ccccc1)N 1P003U6N [0,1,0,0,0,1|2,0,0]=4 3338 B11R1.509 NS(=O)(=O)Cc1ccccc1 1P0036ER [0,1,0,0,0,1|2,0,0]=4 3339 B11R1.509 NS(=O)(=O)Cc1cccnc1 1P00G4IE [0,1,0,0,0,1|1,0,0]=3 3340 B11R1.509 NS(=O)(=O)Cc1nccnc1 1P01B3MN [0,1,0,0,0,1|2,0,0]=4 3341 B11R1.509 NS(=O)(=O)Nc1ccccc1 1P001RNX [0,1,0,0,0,1|2,0,0]=4 3342 B11R1.509 NS(=O)(=O)Oc1ccccc1 1P002BNO [0,1,0,0,0,1|2,0,0]=4 3343 B11R1.3 BrCc1ccc(cc1)C(=O)Br 1P003LGU [0,2,0,0,0,0|2,0,0]=4 3344 B11R1.3 BrCc1ccc(cc1)C(=O)C 1P00DIC1 [0,2,0,0,0,0|2,0,0]=4 3345 B11R1.3 BrCc1ccc(cc1)C(=O)N 1P00EITA [0,2,0,0,0,0|1,0,0]=3 3346 B11R1.3 BrCc1ccc(cc1)C(=O)O 1P00IBH4 [0,2,0,0,0,0|2,0,0]=4 3347 B11R1.3 C#Cc1ccc(cc1)C(=O)C 1P00C0V6 [0,2,0,0,0,0|2,0,0]=4 3348 B11R1.3 C#Cc1ccc(cc1)C(=O)N 1P01J0KW [0,2,0,0,0,0|1,0,0]=3 3349 B11R1.3 C#Cc1ccc(cc1)C(=O)O 1P0036HB [0,2,0,0,0,0|2,0,0]=4 3350 B11R1.3 C#Cc1ccc(cc1)C(=O)[O-] 1P001KHE [0,2,0,0,0,0|2,0,0]=4 3351 B11R1.3 C#Cc1ccc(cn1)C(=O)C 1P027DXI [0,2,0,0,0,0|1,0,0]=3 3352 B11R1.3 C#Cc1ccc(cn1)C(=O)O 1P00E6LH [0,2,0,0,0,0|1,0,0]=3 3353 B11R1.3 C=Cc1ccc(cc1)C(=O)C 1P009RWU [0,2,0,0,0,0|2,0,0]=4 3354 B11R1.3 C=Cc1ccc(cc1)C(=O)O 1P003MJH [0,2,0,0,0,0|2,0,0]=4 3355 B11R1.3 C=Cc1ccc(cn1)C(=O)O 1P01BJ1L [0,2,0,0,0,0|1,0,0]=3 3356 B11R1.3 CCc1ccc(cc1)C(=N)N 1P00VV1X [0,2,0,0,0,0|2,0,0]=4 3357 B11R1.3 CCc1ccc(cc1)C(=O)C 1P003U48 [0,2,0,0,0,0|2,0,0]=4 3358 B11R1.3 CCc1ccc(cc1)C(=O)Cl 1P001UHT [0,2,0,0,0,0|2,0,0]=4 3359 B11R1.3 CCc1ccc(cc1)C(=O)O 1P0034HF [0,2,0,0,0,0|2,0,0]=4 3360 B11R1.3 CCc1ccc(cc1)C(=S)N 1P00EAF7 [0,2,0,0,0,0|1,1,0]=4 3361 B11R1.3 CCc1ccc(cn1)C(=O)O 1P003AZH [0,2,0,0,0,0|1,0,0]=3 3362 B11R1.3 CCc1ccc(cn1)C(=O)O 1P0287PL [0,2,0,0,0,0|1,0,0]=3 3363 B11R1.3 CCc1ccc(cn1)[N+](=O)[O-] 1P00CL73 [0,2,0,0,0,0|2,0,0]=4 3364 B11R1.3 CCc1ncc(cn1)C(=O)C 1P01KHBI [0,2,0,0,0,0|2,0,0]=4 3365 B11R1.3 CCc1ncc(cn1)C(=O)O 1P005FHB [0,2,0,0,0,0|2,0,0]=4 3366 B11R1.3 CCc1ncc(nc1)C(=O)O 1P009XV2 [0,2,0,0,0,0|2,0,0]=4 3367 B11R1.3 CNc1ccc(cc1)C(=N)N 1P01A1MN [0,2,0,0,0,0|2,0,0]=4 3368 B11R1.3 CNc1ccc(cc1)C(=N)N 1P028EU5 [0,2,0,0,0,0|2,0,0]=4 3369 B11R1.3 CNc1ccc(cc1)C(=O)C 1P0025F6 [0,2,0,0,0,0|2,0,0]=4 3370 B11R1.3 CNc1ccc(cc1)C(=O)N 1P019WQV [0,2,0,0,0,0|1,0,0]=3 3371 B11R1.3 CNc1ccc(cc1)C(=O)O 1P0034A9 [0,2,0,0,0,0|2,0,0]=4 3372 B11R1.3 CNc1ccc(cn1)C(=O)N 1P00F0OP [0,2,0,0,0,0|0,0,0]=2 3373 B11R1.3 CNc1ccc(cn1)C(=O)O 1P002STV [0,2,0,0,0,0|1,0,0]=3 3374 B11R1.3 CNc1ccc(cn1)[N+](=O)[O-] 1P003FJL [0,2,0,0,0,0|2,0,0]=4 3375 B11R1.3 CNc1ccc(nc1)C(=O)N 1P028WIK [0,2,0,0,0,0|2,0,0]=4 3376 B11R1.3 CNc1ccc(nn1)C(=O)N 1P01AVFS [0,2,0,0,0,0|1,0,0]=3 3377 B11R1.3 CNc1ncc(cn1)C(=O)O 1P00D8W5 [0,2,0,0,0,0|2,0,0]=4 3378 B11R1.3 CNc1ncc(nc1)C(=O)O 1P01C41N [0,2,0,0,0,0|2,0,0]=4 3379 B11R1.3 COc1ccc(cc1)C(=N)N 1P003APY [0,2,0,0,0,0|2,0,0]=4 3380 B11R1.3 COc1ccc(cc1)C(=N)N 1P007PHJ [0,2,0,0,0,0|2,0,0]=4 3381 B11R1.3 COc1ccc(cc1)C(=O)C 1P0000MP [0,2,0,0,0,0|2,0,0]=4 3382 B11R1.3 COc1ccc(cc1)C(=O)Cl 1P0000MO [0,2,0,0,0,0|2,0,0]=4 3383 B11R1.3 COc1ccc(cc1)C(=O)F 1P005XYX [0,2,0,0,0,0|2,0,0]=4 3384 B11R1.3 COc1ccc(cc1)C(=O)N 1P0034JZ [0,2,0,0,0,0|1,0,0]=3 3385 B11R1.3 COc1ccc(cc1)C(=O)O 1P0000MN [0,2,0,0,0,0|2,0,0]=4 3386 B11R1.3 COc1ccc(cc1)C(=S)N 1P002OEO [0,2,0,0,0,0|1,1,0]=4 3387 B11R1.3 COc1ccc(cn1)C(=N)N 1P0028DO [0,2,0,0,0,0|1,0,0]=3 3388 B11R1.3 COc1ccc(cn1)C(=O)C 1P003MSG [0,2,0,0,0,0|1,0,0]=3 3389 B11R1.3 COc1ccc(cn1)C(=O)Cl 1P007RDG [0,2,0,0,0,0|1,0,0]=3 3390 B11R1.3 COc1ccc(cn1)C(=O)N 1P003NQK [0,2,0,0,0,0|0,0,0]=2 3391 B11R1.3 COc1ccc(cn1)C(=O)O 1P003NQL [0,2,0,0,0,0|1,0,0]=3 3392 B11R1.3 COc1ccc(cn1)C(=S)N 1P00ALRD [0,2,0,0,0,0|0,1,0]=3 3393 B11R1.3 COc1ccc(cn1)C(N)C 1P00ELLA [0,2,0,0,0,0|1,0,1]=4 3394 B11R1.3 COc1ccc(cn1)C(N)C 1P01C70D [0,2,0,0,0,0|1,0,1]=4 3395 B11R1.3 COc1ccc(cn1)C(N)C 1P024FZ2 [0,2,0,0,0,0|1,0,1]=4 3396 B11R1.3 COc1ccc(cn1)S(=O)[O-] 1P01EKK2 [0,2,0,0,0,0|2,0,0]=4 3397 B11R1.3 COc1ccc(cn1)[C@@H](N)C 1P01KL55 [0,2,0,0,0,0|1,0,1]=4 3398 B11R1.3 COc1ccc(cn1)[C@@H](N)C 1P024G0D [0,2,0,0,0,0|1,0,1]=4 3399 B11R1.3 COc1ccc(cn1)[C@H](N)C 1P01KKQ3 [0,2,0,0,0,0|1,0,1]=4 3400 B11R1.3 COc1ccc(cn1)[N+](=O)[O-] 1P00IA76 [0,2,0,0,0,0|2,0,0]=4 3401 B11R1.3 COc1ccc(nn1)C(=O)O 1P0037OF [0,2,0,0,0,0|2,0,0]=4 3402 B11R1.3 COc1ncc(cn1)C(=O)C 1P01FPEI [0,2,0,0,0,0|2,0,0]=4 3403 B11R1.3 COc1ncc(cn1)C(=O)O 1P007G5O [0,2,0,0,0,0|2,0,0]=4 3404 B11R1.3 COc1ncc(nc1)C(=N)N 1P028F2J [0,2,0,0,0,0|2,0,0]=4 3405 B11R1.3 COc1ncc(nc1)C(=O)C 1P00CMKY [0,2,0,0,0,0|2,0,0]=4 3406 B11R1.3 COc1ncc(nc1)C(=O)O 1P00C79R [0,2,0,0,0,0|2,0,0]=4 3407 B11R1.3 CSc1ccc(cc1)C(=O)C 1P007UQ4 [0,2,0,0,0,0|2,0,0]=4 3408 B11R1.3 CSc1ccc(cc1)C(=O)O 1P0010L0 [0,2,0,0,0,0|2,0,0]=4 3409 B11R1.3 CSc1ccc(cn1)C(=O)C 1P005664 [0,2,0,0,0,0|1,0,0]=3 3410 B11R1.3 CSc1ccc(cn1)C(=O)O 1P01AAO8 [0,2,0,0,0,0|1,0,0]=3 3411 B11R1.3 CSc1ccc(cn1)[N+](=O)[O-] 1P002KDW [0,2,0,0,0,0|2,0,0]=4 3412 B11R1.3 CSc1ncc(cn1)C(=O)C 1P004SCU [0,2,0,0,0,0|2,0,0]=4 3413 B11R1.3 CSc1ncc(cn1)C(=O)O 1P007EI4 [0,2,0,0,0,0|2,0,0]=4 3414 B11R1.3 ClCc1ccc(cc1)C(=O)C 1P01AJ2Y [0,2,0,0,0,0|2,0,0]=4 3415 B11R1.3 ClCc1ccc(cc1)C(=O)Cl 1P003KNI [0,2,0,0,0,0|2,0,0]=4 3416 B11R1.3 ClCc1ccc(cc1)C(=O)N 1P0038VC [0,2,0,0,0,0|1,0,0]=3 3417 B11R1.3 ClCc1ccc(cc1)C(=O)O 1P001V6G [0,2,0,0,0,0|2,0,0]=4 3418 B11R1.3 ClCc1ccc(cn1)C(=O)O 1P001G0R [0,2,0,0,0,0|1,0,0]=3 3419 B11R1.3 FCc1ccc(cc1)C(=O)O 1P000JF8 [0,2,0,0,0,0|2,0,0]=4 3420 B11R1.3 FCc1ccc(cn1)C(=O)O 1P0081QD [0,2,0,0,0,0|1,0,0]=3 3421 B11R1.3 N#Cc1ccc(cc1)C(=O)C 1P001JR2 [0,2,0,0,0,0|2,0,0]=4 3422 B11R1.3 N#Cc1ccc(cc1)C(=O)Cl 1P003LPV [0,2,0,0,0,0|2,0,0]=4 3423 B11R1.3 N#Cc1ccc(cc1)C(=O)N 1P00309A [0,2,0,0,0,0|1,0,0]=3 3424 B11R1.3 N#Cc1ccc(cc1)C(=O)O 1P0037F6 [0,2,0,0,0,0|2,0,0]=4 3425 B11R1.3 N#Cc1ccc(cc1)C(=S)N 1P005OR6 [0,2,0,0,0,0|1,1,0]=4 3426 B11R1.3 N#Cc1ccc(cn1)C(=O)C 1P002QFR [0,2,0,0,0,0|1,0,0]=3 3427 B11R1.3 N#Cc1ccc(cn1)C(=O)O 1P003724 [0,2,0,0,0,0|1,0,0]=3 3428 B11R1.3 N#Cc1ccc(cn1)[N+](=O)[O-] 1P00027E [0,2,0,0,0,0|2,0,0]=4 3429 B11R1.3 N#Cc1ccc(nc1)C(=O)N 1P00ED37 [0,2,0,0,0,0|2,0,0]=4 3430 B11R1.3 N#Cc1ccc(nn1)C(=O)O 1P020KTH [0,2,0,0,0,0|2,0,0]=4 3431 B11R1.3 N#Cc1ncc(cn1)C(=O)O 1P0096CC [0,2,0,0,0,0|2,0,0]=4 3432 B11R1.3 N#Cc1ncc(nc1)C(=O)C 1P006FNY [0,2,0,0,0,0|2,0,0]=4 3433 B11R1.3 N#Cc1ncc(nc1)C(=O)O 1P009I3D [0,2,0,0,0,0|2,0,0]=4 3434 B11R1.3 N#[N+]c1ccc(cc1)C(=O)O 1P0034FL [0,2,0,0,0,0|2,0,0]=4 3435 B11R1.3 NCc1ccc(cc1)C(=N)N 1P00BDW8 [0,2,0,0,0,0|2,0,0]=4 3436 B11R1.3 NCc1ccc(cc1)C(=O)C 1P00FB6Q [0,2,0,0,0,0|2,0,0]=4 3437 B11R1.3 NCc1ccc(cc1)C(=O)N 1P0039CY [0,2,0,0,0,0|1,0,0]=3 3438 B11R1.3 NCc1ccc(cc1)C(=O)N 1P00I7RK [0,2,0,0,0,0|1,0,0]=3 3439 B11R1.3 NCc1ccc(cc1)C(=O)O 1P003KMG [0,2,0,0,0,0|2,0,0]=4 3440 B11R1.3 NCc1ccc(cc1)C(=S)N 1P027ZTB [0,2,0,0,0,0|1,1,0]=4 3441 B11R1.3 NCc1ccc(cn1)C(=O)O 1P008OQL [0,2,0,0,0,0|1,0,0]=3 3442 B11R1.3 NCc1ccc(nc1)C(=O)N 1P00BB6V [0,2,0,0,0,0|2,0,0]=4 3443 B11R1.3 NCc1ncc(cn1)C(=O)O 1P01BYCK [0,2,0,0,0,0|2,0,0]=4 3444 B11R1.3 NCc1ncc(nc1)C(=O)O 1P0292RS [0,2,0,0,0,0|2,0,0]=4 3445 B11R1.3 NNc1ccc(cc1)C(=O)C 1P01ACCS [0,2,0,0,0,0|2,0,0]=4 3446 B11R1.3 NNc1ccc(cc1)C(=O)N 1P00CN84 [0,2,0,0,0,0|1,0,0]=3 3447 B11R1.3 NNc1ccc(cc1)C(=O)O 1P002P51 [0,2,0,0,0,0|2,0,0]=4 3448 B11R1.3 NNc1ccc(cc1)C(=O)O 1P003LXW [0,2,0,0,0,0|2,0,0]=4 3449 B11R1.3 NNc1ccc(cn1)C(=O)O 1P0014OO [0,2,0,0,0,0|1,0,0]=3 3450 B11R1.3 NNc1ccc(cn1)C(=O)O 1P01A3YW [0,2,0,0,0,0|1,0,0]=3 3451 B11R1.3 NNc1ccc(cn1)[N+](=O)[O-] 1P00EERD [0,2,0,0,0,0|2,0,0]=4 3452 B11R1.3 NNc1ccc(nn1)C(=O)N 1P00CJLP [0,2,0,0,0,0|1,0,0]=3 3453 B11R1.3 O=Cc1ccc(cc1)C(=N)N 1P00EB5E [0,2,0,0,0,0|2,0,0]=4 3454 B11R1.3 O=Cc1ccc(cc1)C(=O)C 1P003L3E [0,2,0,0,0,0|2,0,0]=4 3455 B11R1.3 O=Cc1ccc(cc1)C(=O)N 1P00ELBR [0,2,0,0,0,0|1,0,0]=3 3456 B11R1.3 O=Cc1ccc(cc1)C(=O)O 1P003LX6 [0,2,0,0,0,0|2,0,0]=4 3457 B11R1.3 O=Cc1ccc(cn1)C(=O)O 1P00F4HL [0,2,0,0,0,0|1,0,0]=3 3458 B11R1.3 O=Cc1ccc(cn1)[N+](=O)[O-] 1P00CAQL [0,2,0,0,0,0|2,0,0]=4 3459 B11R1.3 O=Cc1ncc(nc1)C(=O)N 1P028OWC [0,2,0,0,0,0|1,0,0]=3 3460 B11R1.3 OCc1ccc(cc1)C(=O)C 1P0038X2 [0,2,0,0,0,0|2,0,0]=4 3461 B11R1.3 OCc1ccc(cc1)C(=O)N 1P004L66 [0,2,0,0,0,0|1,0,0]=3 3462 B11R1.3 OCc1ccc(cc1)C(=O)O 1P003KP9 [0,2,0,0,0,0|2,0,0]=4 3463 B11R1.3 OCc1ccc(cn1)C(=O)O 1P008PC8 [0,2,0,0,0,0|1,0,0]=3 3464 B11R1.3 OCc1ccc(cn1)[N+](=O)[O-] 1P00CAQK [0,2,0,0,0,0|2,0,0]=4 3465 B11R1.3 OCc1ccc(nc1)C(=O)N 1P003B1Q [0,2,0,0,0,0|2,0,0]=4 3466 B11R1.3 OCc1ccc(nn1)C(=O)O 1P028RZG [0,2,0,0,0,0|2,0,0]=4 3467 B11R1.3 OCc1ncc(cn1)C(=O)O 1P0286DS [0,2,0,0,0,0|2,0,0]=4 3468 B11R1.3 OCc1ncc(nc1)C(=O)N 1P003MOA [0,2,0,0,0,0|1,0,0]=3 3469 B11R1.3 ONc1ccc(cc1)C(=O)O 1P00118X [0,2,0,0,0,0|2,0,0]=4 3470 B11R1.3 O[Hg]c1ccc(cc1)C(=O)[O-] 1P009AXJ [0,2,0,0,0,0|2,0,0]=4 3471 B11R1.3 SCc1ccc(cc1)C(=O)O 1P0076ZS [0,2,0,0,0,0|2,0,0]=4 3472 B11R1.19 Brc1ccc(cc1)S(=O)(=N)N 1P0283FY [0,2,0,0,0,0|2,0,0]=4 3473 B11R1.19 Brc1ccc(cc1)S(=O)(=O)N 1P005LLJ [0,2,0,0,0,0|2,0,0]=4 3474 B11R1.19 Brc1ccc(cn1)C(N)(C)C 1P028VV3 [0,2,0,0,0,0|1,0,1]=4 3475 B11R1.19 Brc1ccc(cn1)S(=O)(=O)C 1P003H5Q [0,2,0,0,0,0|2,0,0]=4 3476 B11R1.19 Brc1ccc(cn1)S(=O)(=O)Cl 1P00GSJY [0,2,0,0,0,0|2,0,0]=4 3477 B11R1.19 Brc1ccc(cn1)S(=O)(=O)N 1P01BDG0 [0,2,0,0,0,0|1,0,0]=3 3478 B11R1.19 Cc1ccc(cc1)S(=O)(=N)N 1P020MWI [0,2,0,0,0,0|2,0,0]=4 3479 B11R1.19 Cc1ccc(cc1)S(=O)(=O)N 1P003600 [0,2,0,0,0,0|2,0,0]=4 3480 B11R1.19 Cc1ccc(cn1)C(N)(C)C 1P00F32X [0,2,0,0,0,0|1,0,1]=4 3481 B11R1.19 Cc1ccc(cn1)S(=O)(=O)C 1P01E774 [0,2,0,0,0,0|2,0,0]=4 3482 B11R1.19 Cc1ccc(cn1)S(=O)(=O)Cl 1P00DC00 [0,2,0,0,0,0|2,0,0]=4 3483 B11R1.19 Cc1ccc(cn1)S(=O)(=O)Cl 1P00VVXG [0,2,0,0,0,0|2,0,0]=4 3484 B11R1.19 Cc1ccc(cn1)S(=O)(=O)N 1P00D20Y [0,2,0,0,0,0|1,0,0]=3 3485 B11R1.19 Cc1ccc(cn1)S(=O)(=O)O 1P00DEUM [0,2,0,0,0,0|2,0,0]=4 3486 B11R1.19 Cc1ccc(nn1)S(=O)(=O)N 1P01B3EQ [0,2,0,0,0,0|2,0,0]=4 3487 B11R1.19 Clc1ccc(cc1)S(=O)(=N)N 1P0282OL [0,2,0,0,0,0|2,0,0]=4 3488 B11R1.19 Clc1ccc(cc1)S(=O)(=O)N 1P003LN4 [0,2,0,0,0,0|2,0,0]=4 3489 B11R1.19 Clc1ccc(cn1)P(=O)(C)C 1P023R9M [0,2,0,0,0,0|2,0,0]=4 3490 B11R1.19 Clc1ccc(cn1)S(=O)(=N)C 1P01FIX9 [0,2,0,0,0,0|1,0,1]=4 3491 B11R1.19 Clc1ccc(cn1)S(=O)(=O)C 1P003B4H [0,2,0,0,0,0|2,0,0]=4 3492 B11R1.19 Clc1ccc(cn1)S(=O)(=O)Cl 1P003HK5 [0,2,0,0,0,0|2,0,0]=4 3493 B11R1.19 Clc1ccc(cn1)S(=O)(=O)N 1P0075V2 [0,2,0,0,0,0|1,0,0]=3 3494 B11R1.19 Clc1ccc(cn1)S(=O)(=O)O 1P0024ZU [0,2,0,0,0,0|2,0,0]=4 3495 B11R1.19 Clc1ccc(nn1)S(=O)(=O)N 1P01BC1J [0,2,0,0,0,0|2,0,0]=4 3496 B11R1.19 Clc1ncc(cn1)S(=O)(=O)N 1P000GJH [0,2,0,0,0,0|2,0,0]=4 3497 B11R1.19 Fc1ccc(cc1)S(=O)(=O)N 1P0034HY [0,2,0,0,0,0|2,0,0]=4 3498 B11R1.19 Fc1ccc(cn1)P(=O)(C)C 1P028HQT [0,2,0,0,0,0|2,0,0]=4 3499 B11R1.19 Fc1ccc(cn1)S(=O)(=O)Cl 1P008ZMT [0,2,0,0,0,0|2,0,0]=4 3500 B11R1.19 Fc1ccc(cn1)S(=O)(=O)N 1P01B47K [0,2,0,0,0,0|1,0,0]=3 3501 B11R1.19 Ic1ccc(cc1)S(=O)(=O)N 1P0053DM [0,2,0,0,0,0|2,0,0]=4 3502 B11R1.19 Nc1ccc(cc1)S(=O)(=N)N 1P027YM5 [0,2,0,0,0,0|2,0,0]=4 3503 B11R1.19 Nc1ccc(cc1)S(=O)(=O)N 1P00391G [0,2,0,0,0,0|2,0,0]=4 3504 B11R1.19 Nc1ccc(cc1)S(=O)(=O)N 1P00EDG9 [0,2,0,0,0,0|2,0,0]=4 3505 B11R1.19 Nc1ccc(cn1)P(=O)(C)C 1P01XD1T [0,2,0,0,0,0|2,0,0]=4 3506 B11R1.19 Nc1ccc(cn1)S(=O)(=O)C 1P003GWU [0,2,0,0,0,0|2,0,0]=4 3507 B11R1.19 Nc1ccc(cn1)S(=O)(=O)Cl 1P002XM4 [0,2,0,0,0,0|2,0,0]=4 3508 B11R1.19 Nc1ccc(cn1)S(=O)(=O)F 1P028V10 [0,2,0,0,0,0|2,0,0]=4 3509 B11R1.19 Nc1ccc(cn1)S(=O)(=O)N 1P00EK4Y [0,2,0,0,0,0|1,0,0]=3 3510 B11R1.19 Nc1ccc(cn1)S(=O)(=O)O 1P001TNF [0,2,0,0,0,0|2,0,0]=4 3511 B11R1.19 Nc1ccc(nn1)S(=O)(=O)N 1P01BU10 [0,2,0,0,0,0|2,0,0]=4 3512 B11R1.19 Nc1ncc(cn1)S(=O)(=O)N 1P00IKP3 [0,2,0,0,0,0|2,0,0]=4 3513 B11R1.19 Oc1ccc(cc1)S(=O)(=O)N 1P001Q0S [0,2,0,0,0,0|2,0,0]=4 3514 B11R1.19 Oc1ccc(cn1)S(=O)(=O)F 1P028PSW [0,2,0,0,0,0|2,0,0]=4 3515 B11R1.19 Sc1ccc(cn1)S(=O)(=O)N 1P007YSD [0,2,0,0,0,0|1,0,0]=3 3516 B11R1.21 CC(=O)c1ccc(=O)n(c1)C 1P0082IS [0,2,0,0,0,0|1,0,1]=4 3517 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1P00C1MP [0,2,0,0,0,0|2,0,0]=4 3518 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1P003J92 [0,2,0,0,0,0|2,0,0]=4 3519 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1P003945 [0,2,0,0,0,0|2,0,0]=4 3520 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1P00034C [0,2,0,0,0,0|2,0,0]=4 3521 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1P00IITU [0,2,0,0,0,0|2,0,0]=4 3522 B11R1.21 CC(=O)c1ccc(c(c1)Br)N 1P00EDSU [0,2,0,0,0,0|2,0,0]=4 3523 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1P00287A [0,2,0,0,0,0|2,0,0]=4 3524 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1P00BY75 [0,2,0,0,0,0|2,0,0]=4 3525 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1P0033ZE [0,2,0,0,0,0|2,0,0]=4 3526 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1P00BXTW [0,2,0,0,0,0|2,0,0]=4 3527 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1P00BXRF [0,2,0,0,0,0|2,0,0]=4 3528 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1P020AV4 [0,2,0,0,0,0|2,0,0]=4 3529 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1P004Q08 [0,2,0,0,0,0|2,0,0]=4 3530 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1P00BGL2 [0,2,0,0,0,0|2,0,0]=4 3531 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1P00IGR2 [0,2,0,0,0,0|2,0,0]=4 3532 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1P002TLO [0,2,0,0,0,0|2,0,0]=4 3533 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1P002Y9T [0,2,0,0,0,0|2,0,0]=4 3534 B11R1.21 CC(=O)c1ccc(c(c1)Cl)N 1P005LBK [0,2,0,0,0,0|2,0,0]=4 3535 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1P002XJY [0,2,0,0,0,0|2,0,0]=4 3536 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1P0030M8 [0,2,0,0,0,0|2,0,0]=4 3537 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1P003DDN [0,2,0,0,0,0|2,0,0]=4 3538 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1P0034G3 [0,2,0,0,0,0|2,0,0]=4 3539 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1P003IXI [0,2,0,0,0,0|2,0,0]=4 3540 B11R1.21 CC(=O)c1ccc(c(c1)F)N 1P003L64 [0,2,0,0,0,0|2,0,0]=4 3541 B11R1.21 CC(=O)c1ccc(c(c1)F)N 1P01AG5V [0,2,0,0,0,0|2,0,0]=4 3542 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1P003JWI [0,2,0,0,0,0|2,0,0]=4 3543 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1P01C1ZP [0,2,0,0,0,0|2,0,0]=4 3544 B11R1.21 CC(=O)c1ccc(c(c1)I)N 1P00IKG2 [0,2,0,0,0,0|2,0,0]=4 3545 B11R1.21 CC(=O)c1ccc(c(c1)N)Br 1P003J91 [0,2,0,0,0,0|2,0,0]=4 3546 B11R1.21 CC(=O)c1ccc(c(c1)N)C 1P007URY [0,2,0,0,0,0|2,0,0]=4 3547 B11R1.21 CC(=O)c1ccc(c(c1)N)C 1P00J3QI [0,2,0,0,0,0|2,0,0]=4 3548 B11R1.21 CC(=O)c1ccc(c(c1)N)Cl 1P005KND [0,2,0,0,0,0|2,0,0]=4 3549 B11R1.21 CC(=O)c1ccc(c(c1)N)F 1P002D2M [0,2,0,0,0,0|2,0,0]=4 3550 B11R1.21 CC(=O)c1ccc(c(c1)N)N 1P00C1KT [0,2,0,0,0,0|2,0,0]=4 3551 B11R1.21 CC(=O)c1ccc(c(c1)N)O 1P00DLAD [0,2,0,0,0,0|2,0,0]=4 3552 B11R1.21 CC(=O)c1ccc(c(c1)N)O 1P01A5A1 [0,2,0,0,0,0|2,0,0]=4 3553 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1P0039Q0 [0,2,0,0,0,0|2,0,0]=4 3554 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1P00399H [0,2,0,0,0,0|2,0,0]=4 3555 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1P00F560 [0,2,0,0,0,0|2,0,0]=4 3556 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1P003A5Z [0,2,0,0,0,0|2,0,0]=4 3557 B11R1.21 CC(=O)c1ccc(c(c1)O)N 1P00DHPT [0,2,0,0,0,0|2,0,0]=4 3558 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1P000PXS [0,2,0,0,0,0|2,0,0]=4 3559 B11R1.21 CC(=O)c1cnc(c(c1)Br)F 1P01JOLM [0,2,0,0,0,0|1,0,0]=3 3560 B11R1.21 CC(=O)c1cnc(c(c1)C)C 1P01FLOB [0,2,0,0,0,0|1,0,0]=3 3561 B11R1.21 CC(=O)c1cnc(c(c1)C)Cl 1P000OU1 [0,2,0,0,0,0|1,0,0]=3 3562 B11R1.21 CC(=O)c1cnc(c(c1)C)N 1P01KHEA [0,2,0,0,0,0|1,0,0]=3 3563 B11R1.21 CC(=O)c1cnc(c(c1)Cl)Cl 1P007Q1W [0,2,0,0,0,0|1,0,0]=3 3564 B11R1.21 CC(=O)c1cnc(c(c1)O)Cl 1P027W9K [0,2,0,0,0,0|1,0,0]=3 3565 B11R1.21 CC(c1cnc(c(c1)Cl)Cl)N 1P0280U5 [0,2,0,0,0,0|1,0,1]=4 3566 B11R1.21 CC(c1cnc(c(c1)Cl)Cl)N 1P028I6C [0,2,0,0,0,0|1,0,1]=4 3567 B11R1.21 CC1SC(=CN=C1C)C(=O)N 1P00I3VQ [0,2,0,0,0,0|1,0,1]=4 3568 B11R1.21 CN(c1cnc(c(c1)Cl)Cl)N 1P028Y9U [0,2,0,0,0,0|2,0,0]=4 3569 B11R1.21 CS(=O)c1cnc(c(c1)Cl)N 1P01ANGF [0,2,0,0,0,0|2,0,0]=4 3570 B11R1.21 ClC(=O)c1ccc(c(c1)Br)F 1P005Q2C [0,2,0,0,0,0|2,0,0]=4 3571 B11R1.21 ClC(=O)c1ccc(c(c1)C)Cl 1P00CBXA [0,2,0,0,0,0|2,0,0]=4 3572 B11R1.21 ClC(=O)c1ccc(c(c1)C)F 1P003LUZ [0,2,0,0,0,0|2,0,0]=4 3573 B11R1.21 ClC(=O)c1ccc(c(c1)Cl)Br 1P01BDHF [0,2,0,0,0,0|2,0,0]=4 3574 B11R1.21 ClC(=O)c1ccc(c(c1)Cl)Cl 1P003IWV [0,2,0,0,0,0|2,0,0]=4 3575 B11R1.21 ClC(=O)c1ccc(c(c1)Cl)F 1P003JOP [0,2,0,0,0,0|2,0,0]=4 3576 B11R1.21 ClC(=O)c1ccc(c(c1)F)Br 1P00FHBX [0,2,0,0,0,0|2,0,0]=4 3577 B11R1.21 ClC(=O)c1ccc(c(c1)F)C 1P003JX0 [0,2,0,0,0,0|2,0,0]=4 3578 B11R1.21 ClC(=O)c1ccc(c(c1)F)Cl 1P00ADEL [0,2,0,0,0,0|2,0,0]=4 3579 B11R1.21 ClC(=O)c1ccc(c(c1)F)F 1P003IXP [0,2,0,0,0,0|2,0,0]=4 3580 B11R1.21 ClC(=O)c1ccc(c(c1)I)C 1P00D9FC [0,2,0,0,0,0|2,0,0]=4 3581 B11R1.21 ClC(=O)c1cnc(c(c1)Cl)Cl 1P00D8MZ [0,2,0,0,0,0|1,0,0]=3 3582 B11R1.21 Cn1ncc(cc1=O)C(=O)O 1P01XDIM [0,2,0,0,0,0|2,0,0]=4 3583 B11R1.21 NC(=N)c1ccc(c(c1)Br)C 1P01EM3K [0,2,0,0,0,0|2,0,0]=4 3584 B11R1.21 NC(=N)c1ccc(c(c1)Br)F 1P00GYOA [0,2,0,0,0,0|2,0,0]=4 3585 B11R1.21 NC(=N)c1ccc(c(c1)C)Br 1P0028X2 [0,2,0,0,0,0|2,0,0]=4 3586 B11R1.21 NC(=N)c1ccc(c(c1)C)Br 1P01B5YP [0,2,0,0,0,0|2,0,0]=4 3587 B11R1.21 NC(=N)c1ccc(c(c1)C)C 1P008TND [0,2,0,0,0,0|2,0,0]=4 3588 B11R1.21 NC(=N)c1ccc(c(c1)Cl)Cl 1P01AAXH [0,2,0,0,0,0|2,0,0]=4 3589 B11R1.21 NC(=N)c1ccc(c(c1)Cl)F 1P00DG07 [0,2,0,0,0,0|2,0,0]=4 3590 B11R1.21 NC(=N)c1ccc(c(c1)F)Br 1P00151D [0,2,0,0,0,0|2,0,0]=4 3591 B11R1.21 NC(=N)c1ccc(c(c1)F)C 1P00219G [0,2,0,0,0,0|2,0,0]=4 3592 B11R1.21 NC(=N)c1ccc(c(c1)F)F 1P007EY9 [0,2,0,0,0,0|2,0,0]=4 3593 B11R1.21 NC(=N)c1ccc(c(c1)N)N 1P00FF4U [0,2,0,0,0,0|2,0,0]=4 3594 B11R1.21 NC(=N)c1ccc(c(c1)N)N 1P01XD5L [0,2,0,0,0,0|2,0,0]=4 3595 B11R1.21 NC(=O)c1ccc(=O)n(c1)C 1P00FE3E [0,2,0,0,0,0|0,0,1]=3 3596 B11R1.21 NC(=O)c1ccc(c(c1)Br)C 1P0076LT [0,2,0,0,0,0|1,0,0]=3 3597 B11R1.21 NC(=O)c1ccc(c(c1)Br)F 1P00DATP [0,2,0,0,0,0|1,0,0]=3 3598 B11R1.21 NC(=O)c1ccc(c(c1)Br)I 1P01BUND [0,2,0,0,0,0|1,0,0]=3 3599 B11R1.21 NC(=O)c1ccc(c(c1)Br)N 1P019NNG [0,2,0,0,0,0|1,0,0]=3 3600 B11R1.21 NC(=O)c1ccc(c(c1)C)Br 1P00APLJ [0,2,0,0,0,0|1,0,0]=3 3601 B11R1.21 NC(=O)c1ccc(c(c1)C)C 1P003IZ8 [0,2,0,0,0,0|1,0,0]=3 3602 B11R1.21 NC(=O)c1ccc(c(c1)C)F 1P002SM8 [0,2,0,0,0,0|1,0,0]=3 3603 B11R1.21 NC(=O)c1ccc(c(c1)C)N 1P007EOV [0,2,0,0,0,0|1,0,0]=3 3604 B11R1.21 NC(=O)c1ccc(c(c1)C)N 1P019NAU [0,2,0,0,0,0|1,0,0]=3 3605 B11R1.21 NC(=O)c1ccc(c(c1)Cl)Cl 1P003IWP [0,2,0,0,0,0|1,0,0]=3 3606 B11R1.21 NC(=O)c1ccc(c(c1)Cl)F 1P003JON [0,2,0,0,0,0|1,0,0]=3 3607 B11R1.21 NC(=O)c1ccc(c(c1)Cl)I 1P028FTQ [0,2,0,0,0,0|1,0,0]=3 3608 B11R1.21 NC(=O)c1ccc(c(c1)Cl)O 1P0003A3 [0,2,0,0,0,0|1,0,0]=3 3609 B11R1.21 NC(=O)c1ccc(c(c1)Cl)S 1P027ULM [0,2,0,0,0,0|1,0,0]=3 3610 B11R1.21 NC(=O)c1ccc(c(c1)F)Br 1P005HJ7 [0,2,0,0,0,0|1,0,0]=3 3611 B11R1.21 NC(=O)c1ccc(c(c1)F)C 1P00AUV1 [0,2,0,0,0,0|1,0,0]=3 3612 B11R1.21 NC(=O)c1ccc(c(c1)F)F 1P003IXK [0,2,0,0,0,0|1,0,0]=3 3613 B11R1.21 NC(=O)c1ccc(c(c1)F)N 1P00EO2N [0,2,0,0,0,0|1,0,0]=3 3614 B11R1.21 NC(=O)c1ccc(c(c1)F)O 1P01ADA1 [0,2,0,0,0,0|1,0,0]=3 3615 B11R1.21 NC(=O)c1ccc(c(c1)N)C 1P003JCH [0,2,0,0,0,0|1,0,0]=3 3616 B11R1.21 NC(=O)c1ccc(c(c1)N)Cl 1P003JBW [0,2,0,0,0,0|1,0,0]=3 3617 B11R1.21 NC(=O)c1ccc(c(c1)N)F 1P00H871 [0,2,0,0,0,0|1,0,0]=3 3618 B11R1.21 NC(=O)c1ccc(c(c1)N)N 1P00FNZ0 [0,2,0,0,0,0|1,0,0]=3 3619 B11R1.21 NC(=O)c1ccc(c(c1)N)O 1P0081CR [0,2,0,0,0,0|1,0,0]=3 3620 B11R1.21 NC(=O)c1ccc(c(c1)O)Br 1P01C5O5 [0,2,0,0,0,0|1,0,0]=3 3621 B11R1.21 NC(=O)c1ccc(c(c1)O)C 1P007LPN [0,2,0,0,0,0|1,0,0]=3 3622 B11R1.21 NC(=O)c1ccc(c(c1)O)F 1P00HI3T [0,2,0,0,0,0|1,0,0]=3 3623 B11R1.21 NC(=O)c1ccc(c(c1)O)I 1P008ULX [0,2,0,0,0,0|1,0,0]=3 3624 B11R1.21 NC(=O)c1ccc(c(c1)O)N 1P00AUUJ [0,2,0,0,0,0|1,0,0]=3 3625 B11R1.21 NC(=O)c1ccc(c(c1)O)O 1P00IA65 [0,2,0,0,0,0|1,0,0]=3 3626 B11R1.21 NC(=O)c1ccc(c(n1)Br)F 1P009FPS [0,2,0,0,0,0|2,0,0]=4 3627 B11R1.21 NC(=O)c1ccc(c(n1)C)N 1P01A3RZ [0,2,0,0,0,0|2,0,0]=4 3628 B11R1.21 NC(=O)c1ccn(c(=O)c1)C 1P00EGQL [0,2,0,0,0,0|2,0,0]=4 3629 B11R1.21 NC(=O)c1cnc(c(c1)Br)Cl 1P00G6QX [0,2,0,0,0,0|0,0,0]=2 3630 B11R1.21 NC(=O)c1cnc(c(c1)C)C 1P01FGDT [0,2,0,0,0,0|0,0,0]=2 3631 B11R1.21 NC(=O)c1cnc(c(c1)Cl)Br 1P01DL0U [0,2,0,0,0,0|0,0,0]=2 3632 B11R1.21 NC(=O)c1cnc(c(c1)Cl)Cl 1P005YY4 [0,2,0,0,0,0|0,0,0]=2 3633 B11R1.21 NC(=O)c1cnc(c(c1)Cl)N 1P01A8IS [0,2,0,0,0,0|0,0,0]=2 3634 B11R1.21 NC(=O)c1ncc(c(c1)Br)C 1P00247A [0,2,0,0,0,0|2,0,0]=4 3635 B11R1.21 NC(=O)c1ncc(c(c1)Cl)Br 1P01C5F0 [0,2,0,0,0,0|2,0,0]=4 3636 B11R1.21 NC(=O)c1ncc(c(c1)Cl)C 1P01A6WH [0,2,0,0,0,0|2,0,0]=4 3637 B11R1.21 NC(=S)c1ccc(c(c1)Br)Cl 1P021YZI [0,2,0,0,0,0|1,1,0]=4 3638 B11R1.21 NC(=S)c1ccc(c(c1)C)Br 1P01DWVY [0,2,0,0,0,0|1,1,0]=4 3639 B11R1.21 NC(=S)c1ccc(c(c1)C)F 1P00HA02 [0,2,0,0,0,0|1,1,0]=4 3640 B11R1.21 NC(=S)c1ccc(c(c1)Cl)Cl 1P00BDMB [0,2,0,0,0,0|1,1,0]=4 3641 B11R1.21 NC(=S)c1ccc(c(c1)Cl)O 1P01DWU3 [0,2,0,0,0,0|1,1,0]=4 3642 B11R1.21 NC(=S)c1ccc(c(c1)F)C 1P00219H [0,2,0,0,0,0|1,1,0]=4 3643 B11R1.21 NC(=S)c1ccc(c(c1)F)F 1P007J58 [0,2,0,0,0,0|1,1,0]=4 3644 B11R1.21 NC(=S)c1ccc(c(c1)F)O 1P01EN3E [0,2,0,0,0,0|1,1,0]=4 3645 B11R1.21 NC(=S)c1nnc(c(c1)C)C 1P028CV7 [0,2,0,0,0,0|1,1,0]=4 3646 B11R1.21 O=N(=O)c1cnc(c(c1)Cl)Cl 1P003FXT [0,2,0,0,0,0|2,0,0]=4 3647 B11R1.21 OC(=O)c1c[nH]c(=O)c(c1)C 1P006QG9 [0,2,0,0,0,0|1,0,1]=4 3648 B11R1.21 OC(=O)c1c[nH]c(=O)c(c1)O 1P00GA75 [0,2,0,0,0,0|1,0,1]=4 3649 B11R1.21 OC(=O)c1ccc(=O)n(c1)C 1P003EZ1 [0,2,0,0,0,0|1,0,1]=4 3650 B11R1.21 OC(=O)c1ccc(c(c1)Br)Br 1P00ECY9 [0,2,0,0,0,0|2,0,0]=4 3651 B11R1.21 OC(=O)c1ccc(c(c1)Br)C 1P003JIY [0,2,0,0,0,0|2,0,0]=4 3652 B11R1.21 OC(=O)c1ccc(c(c1)Br)Cl 1P003JI5 [0,2,0,0,0,0|2,0,0]=4 3653 B11R1.21 OC(=O)c1ccc(c(c1)Br)F 1P00034B [0,2,0,0,0,0|2,0,0]=4 3654 B11R1.21 OC(=O)c1ccc(c(c1)Br)I 1P002QH9 [0,2,0,0,0,0|2,0,0]=4 3655 B11R1.21 OC(=O)c1ccc(c(c1)Br)N 1P00E9SH [0,2,0,0,0,0|2,0,0]=4 3656 B11R1.21 OC(=O)c1ccc(c(c1)Br)O 1P0038R0 [0,2,0,0,0,0|2,0,0]=4 3657 B11R1.21 OC(=O)c1ccc(c(c1)Br)S 1P01BL0E [0,2,0,0,0,0|2,0,0]=4 3658 B11R1.21 OC(=O)c1ccc(c(c1)C)Br 1P003LF0 [0,2,0,0,0,0|2,0,0]=4 3659 B11R1.21 OC(=O)c1ccc(c(c1)C)C 1P0033ZG [0,2,0,0,0,0|2,0,0]=4 3660 B11R1.21 OC(=O)c1ccc(c(c1)C)Cl 1P0057R0 [0,2,0,0,0,0|2,0,0]=4 3661 B11R1.21 OC(=O)c1ccc(c(c1)C)F 1P003LUY [0,2,0,0,0,0|2,0,0]=4 3662 B11R1.21 OC(=O)c1ccc(c(c1)C)I 1P00D979 [0,2,0,0,0,0|2,0,0]=4 3663 B11R1.21 OC(=O)c1ccc(c(c1)C)N 1P002Q50 [0,2,0,0,0,0|2,0,0]=4 3664 B11R1.21 OC(=O)c1ccc(c(c1)C)O 1P003LYS [0,2,0,0,0,0|2,0,0]=4 3665 B11R1.21 OC(=O)c1ccc(c(c1)Cl)Br 1P007OML [0,2,0,0,0,0|2,0,0]=4 3666 B11R1.21 OC(=O)c1ccc(c(c1)Cl)C 1P00344H [0,2,0,0,0,0|2,0,0]=4 3667 B11R1.21 OC(=O)c1ccc(c(c1)Cl)Cl 1P003IWQ [0,2,0,0,0,0|2,0,0]=4 3668 B11R1.21 OC(=O)c1ccc(c(c1)Cl)F 1P003JOO [0,2,0,0,0,0|2,0,0]=4 3669 B11R1.21 OC(=O)c1ccc(c(c1)Cl)I 1P00F1UF [0,2,0,0,0,0|2,0,0]=4 3670 B11R1.21 OC(=O)c1ccc(c(c1)Cl)N 1P002Q4Z [0,2,0,0,0,0|2,0,0]=4 3671 B11R1.21 OC(=O)c1ccc(c(c1)Cl)O 1P0078JT [0,2,0,0,0,0|2,0,0]=4 3672 B11R1.21 OC(=O)c1ccc(c(c1)Cl)S 1P01A9BV [0,2,0,0,0,0|2,0,0]=4 3673 B11R1.21 OC(=O)c1ccc(c(c1)F)Br 1P0034EF [0,2,0,0,0,0|2,0,0]=4 3674 B11R1.21 OC(=O)c1ccc(c(c1)F)C 1P00345X [0,2,0,0,0,0|2,0,0]=4 3675 B11R1.21 OC(=O)c1ccc(c(c1)F)Cl 1P003LLC [0,2,0,0,0,0|2,0,0]=4 3676 B11R1.21 OC(=O)c1ccc(c(c1)F)F 1P003IXM [0,2,0,0,0,0|2,0,0]=4 3677 B11R1.21 OC(=O)c1ccc(c(c1)F)I 1P00G3NW [0,2,0,0,0,0|2,0,0]=4 3678 B11R1.21 OC(=O)c1ccc(c(c1)F)N 1P003L65 [0,2,0,0,0,0|2,0,0]=4 3679 B11R1.21 OC(=O)c1ccc(c(c1)F)O 1P00BY6U [0,2,0,0,0,0|2,0,0]=4 3680 B11R1.21 OC(=O)c1ccc(c(c1)F)S 1P01C4XB [0,2,0,0,0,0|2,0,0]=4 3681 B11R1.21 OC(=O)c1ccc(c(c1)I)Br 1P0071T3 [0,2,0,0,0,0|2,0,0]=4 3682 B11R1.21 OC(=O)c1ccc(c(c1)I)C 1P003K20 [0,2,0,0,0,0|2,0,0]=4 3683 B11R1.21 OC(=O)c1ccc(c(c1)I)Cl 1P00BXRX [0,2,0,0,0,0|2,0,0]=4 3684 B11R1.21 OC(=O)c1ccc(c(c1)I)F 1P00C7DV [0,2,0,0,0,0|2,0,0]=4 3685 B11R1.21 OC(=O)c1ccc(c(c1)I)I 1P007AC2 [0,2,0,0,0,0|2,0,0]=4 3686 B11R1.21 OC(=O)c1ccc(c(c1)I)N 1P003L69 [0,2,0,0,0,0|2,0,0]=4 3687 B11R1.21 OC(=O)c1ccc(c(c1)I)O 1P003LYE [0,2,0,0,0,0|2,0,0]=4 3688 B11R1.21 OC(=O)c1ccc(c(c1)N)Br 1P007L55 [0,2,0,0,0,0|2,0,0]=4 3689 B11R1.21 OC(=O)c1ccc(c(c1)N)C 1P003JCI [0,2,0,0,0,0|2,0,0]=4 3690 B11R1.21 OC(=O)c1ccc(c(c1)N)Cl 1P003JBX [0,2,0,0,0,0|2,0,0]=4 3691 B11R1.21 OC(=O)c1ccc(c(c1)N)F 1P002OHW [0,2,0,0,0,0|2,0,0]=4 3692 B11R1.21 OC(=O)c1ccc(c(c1)N)I 1P006WOP [0,2,0,0,0,0|2,0,0]=4 3693 B11R1.21 OC(=O)c1ccc(c(c1)N)N 1P003IW4 [0,2,0,0,0,0|2,0,0]=4 3694 B11R1.21 OC(=O)c1ccc(c(c1)N)O 1P001PO4 [0,2,0,0,0,0|2,0,0]=4 3695 B11R1.21 OC(=O)c1ccc(c(c1)N)O 1P00IMR2 [0,2,0,0,0,0|2,0,0]=4 3696 B11R1.21 OC(=O)c1ccc(c(c1)O)Br 1P003LEY [0,2,0,0,0,0|2,0,0]=4 3697 B11R1.21 OC(=O)c1ccc(c(c1)O)C 1P003K0K [0,2,0,0,0,0|2,0,0]=4 3698 B11R1.21 OC(=O)c1ccc(c(c1)O)Cl 1P003LLI [0,2,0,0,0,0|2,0,0]=4 3699 B11R1.21 OC(=O)c1ccc(c(c1)O)F 1P003LUU [0,2,0,0,0,0|2,0,0]=4 3700 B11R1.21 OC(=O)c1ccc(c(c1)O)I 1P003K0B [0,2,0,0,0,0|2,0,0]=4 3701 B11R1.21 OC(=O)c1ccc(c(c1)O)N 1P0034D0 [0,2,0,0,0,0|2,0,0]=4 3702 B11R1.21 OC(=O)c1ccc(c(c1)O)O 1P003IYB [0,2,0,0,0,0|2,0,0]=4 3703 B11R1.21 OC(=O)c1ccc(c(c1)S)F 1P01ALB7 [0,2,0,0,0,0|2,0,0]=4 3704 B11R1.21 OC(=O)c1ccc(c(c1)S)N 1P001DID [0,2,0,0,0,0|2,0,0]=4 3705 B11R1.21 OC(=O)c1ccc(c(c1)S)S 1P027UWL [0,2,0,0,0,0|2,0,0]=4 3706 B11R1.21 OC(=O)c1cnc(c(c1)Br)Br 1P002Y9W [0,2,0,0,0,0|1,0,0]=3 3707 B11R1.21 OC(=O)c1cnc(c(c1)Br)C 1P000ILR [0,2,0,0,0,0|1,0,0]=3 3708 B11R1.21 OC(=O)c1cnc(c(c1)Br)Cl 1P002Y9Y [0,2,0,0,0,0|1,0,0]=3 3709 B11R1.21 OC(=O)c1cnc(c(c1)Br)F 1P002Y9X [0,2,0,0,0,0|1,0,0]=3 3710 B11R1.21 OC(=O)c1cnc(c(c1)Br)N 1P0022E6 [0,2,0,0,0,0|1,0,0]=3 3711 B11R1.21 OC(=O)c1cnc(c(c1)Br)O 1P0071W6 [0,2,0,0,0,0|1,0,0]=3 3712 B11R1.21 OC(=O)c1cnc(c(c1)C)Br 1P00H4Z9 [0,2,0,0,0,0|1,0,0]=3 3713 B11R1.21 OC(=O)c1cnc(c(c1)C)C 1P00371M [0,2,0,0,0,0|1,0,0]=3 3714 B11R1.21 OC(=O)c1cnc(c(c1)C)C 1P00J2VJ [0,2,0,0,0,0|1,0,0]=3 3715 B11R1.21 OC(=O)c1cnc(c(c1)C)Cl 1P00FD39 [0,2,0,0,0,0|1,0,0]=3 3716 B11R1.21 OC(=O)c1cnc(c(c1)C)F 1P008A6W [0,2,0,0,0,0|1,0,0]=3 3717 B11R1.21 OC(=O)c1cnc(c(c1)C)N 1P001XZ1 [0,2,0,0,0,0|1,0,0]=3 3718 B11R1.21 OC(=O)c1cnc(c(c1)Cl)Br 1P01AG85 [0,2,0,0,0,0|1,0,0]=3 3719 B11R1.21 OC(=O)c1cnc(c(c1)Cl)C 1P01FBCS [0,2,0,0,0,0|1,0,0]=3 3720 B11R1.21 OC(=O)c1cnc(c(c1)Cl)Cl 1P0034MU [0,2,0,0,0,0|1,0,0]=3 3721 B11R1.21 OC(=O)c1cnc(c(c1)Cl)F 1P00CAO0 [0,2,0,0,0,0|1,0,0]=3 3722 B11R1.21 OC(=O)c1cnc(c(c1)Cl)N 1P00CLOZ [0,2,0,0,0,0|1,0,0]=3 3723 B11R1.21 OC(=O)c1cnc(c(c1)Cl)O 1P003N4Y [0,2,0,0,0,0|1,0,0]=3 3724 B11R1.21 OC(=O)c1cnc(c(c1)F)Br 1P00CAO1 [0,2,0,0,0,0|1,0,0]=3 3725 B11R1.21 OC(=O)c1cnc(c(c1)F)C 1P01CDB8 [0,2,0,0,0,0|1,0,0]=3 3726 B11R1.21 OC(=O)c1cnc(c(c1)F)Cl 1P00C81P [0,2,0,0,0,0|1,0,0]=3 3727 B11R1.21 OC(=O)c1cnc(c(c1)F)F 1P003MQK [0,2,0,0,0,0|1,0,0]=3 3728 B11R1.21 OC(=O)c1cnc(c(c1)F)O 1P00AEQO [0,2,0,0,0,0|1,0,0]=3 3729 B11R1.21 OC(=O)c1cnc(c(c1)I)Cl 1P003NMQ [0,2,0,0,0,0|1,0,0]=3 3730 B11R1.21 OC(=O)c1cnc(c(c1)I)N 1P00DKLB [0,2,0,0,0,0|1,0,0]=3 3731 B11R1.21 OC(=O)c1cnc(c(c1)I)O 1P00CLSA [0,2,0,0,0,0|1,0,0]=3 3732 B11R1.21 OC(=O)c1cnc(c(c1)N)Br 1P01L09Y [0,2,0,0,0,0|1,0,0]=3 3733 B11R1.21 OC(=O)c1cnc(c(c1)N)C 1P0065IA [0,2,0,0,0,0|1,0,0]=3 3734 B11R1.21 OC(=O)c1cnc(c(c1)N)C 1P028TDB [0,2,0,0,0,0|1,0,0]=3 3735 B11R1.21 OC(=O)c1cnc(c(c1)N)Cl 1P00FCP9 [0,2,0,0,0,0|1,0,0]=3 3736 B11R1.21 OC(=O)c1cnc(c(c1)N)N 1P00C4UN [0,2,0,0,0,0|1,0,0]=3 3737 B11R1.21 OC(=O)c1cnc(c(c1)O)Br 1P0015WA [0,2,0,0,0,0|1,0,0]=3 3738 B11R1.21 OC(=O)c1cnc(c(c1)O)I 1P00EDFQ [0,2,0,0,0,0|1,0,0]=3 3739 B11R1.21 OC(=O)c1cnc(c(c1)O)N 1P0283N6 [0,2,0,0,0,0|1,0,0]=3 3740 B11R1.21 OC(=O)c1cnc(c(n1)Br)Cl 1P01CAQ8 [0,2,0,0,0,0|2,0,0]=4 3741 B11R1.21 OC(=O)c1cnc(c(n1)Br)N 1P0046ON [0,2,0,0,0,0|2,0,0]=4 3742 B11R1.21 OC(=O)c1cnc(c(n1)C)C 1P006ZTP [0,2,0,0,0,0|2,0,0]=4 3743 B11R1.21 OC(=O)c1cnc(c(n1)C)Cl 1P01E3YW [0,2,0,0,0,0|2,0,0]=4 3744 B11R1.21 OC(=O)c1cnc(c(n1)Cl)Cl 1P00G7GO [0,2,0,0,0,0|2,0,0]=4 3745 B11R1.21 OC(=O)c1cnc(c(n1)N)Br 1P01BJJC [0,2,0,0,0,0|2,0,0]=4 3746 B11R1.21 OC(=O)c1coc(=O)c(c1)Br 1P027ROR [0,2,0,0,0,0|2,0,0]=4 3747 B11R1.21 OC(=O)c1nnc(c(c1)C)C 1P02875S [0,2,0,0,0,0|2,0,0]=4 3748 B11R1.21 OC(=O)c1nnc(c(c1)C)Cl 1P028II7 [0,2,0,0,0,0|2,0,0]=4 3749 B11R1.21 [O-]C(=O)c1ccc(c(c1)Cl)F 1P001ICI [0,2,0,0,0,0|2,0,0]=4 3750 B11R1.21 [O-]C(=O)c1ccc(c(c1)F)F 1P00DA60 [0,2,0,0,0,0|2,0,0]=4 3751 B11R1.21 [O-]C(=O)c1nnc(c(c1)Cl)Cl 1P027WEX [0,2,0,0,0,0|2,0,0]=4 3752 B11R1.21 [O-]S(=O)c1cnc(c(c1)C)C 1P028DPR [0,2,0,0,0,0|2,0,0]=4 3753 B11R1.21 [O-]S(=O)c1cnc(c(c1)C)F 1P01FL93 [0,2,0,0,0,0|2,0,0]=4 3754 B11R1.21 [O-]S(=O)c1cnc(c(c1)Cl)F 1P01FL8S [0,2,0,0,0,0|2,0,0]=4 3755 B11R1.21 [O-]S(=O)c1cnc(c(c1)F)F 1P01FL91 [0,2,0,0,0,0|2,0,0]=4 3756 B11R1.21 [O-][N+](=O)c1cnc(c(c1)Br)Br 1P001QTU [0,2,0,0,0,0|2,0,0]=4 3757 B11R1.21 [O-][N+](=O)c1cnc(c(c1)Br)C 1P003848 [0,2,0,0,0,0|2,0,0]=4 3758 B11R1.21 [O-][N+](=O)c1cnc(c(c1)Br)Cl 1P00342I [0,2,0,0,0,0|2,0,0]=4 3759 B11R1.21 [O-][N+](=O)c1cnc(c(c1)Br)F 1P0075LC [0,2,0,0,0,0|2,0,0]=4 3760 B11R1.21 [O-][N+](=O)c1cnc(c(c1)Br)N 1P001QTX [0,2,0,0,0,0|2,0,0]=4 3761 B11R1.21 [O-][N+](=O)c1cnc(c(c1)C)Br 1P002MRB [0,2,0,0,0,0|2,0,0]=4 3762 B11R1.21 [O-][N+](=O)c1cnc(c(c1)C)C 1P0044P5 [0,2,0,0,0,0|2,0,0]=4 3763 B11R1.21 [O-][N+](=O)c1cnc(c(c1)C)Cl 1P006ZIQ [0,2,0,0,0,0|2,0,0]=4 3764 B11R1.21 [O-][N+](=O)c1cnc(c(c1)C)F 1P007RF9 [0,2,0,0,0,0|2,0,0]=4 3765 B11R1.21 [O-][N+](=O)c1cnc(c(c1)C)N 1P00281K [0,2,0,0,0,0|2,0,0]=4 3766 B11R1.21 [O-][N+](=O)c1cnc(c(c1)Cl)Br 1P003H3B [0,2,0,0,0,0|2,0,0]=4 3767 B11R1.21 [O-][N+](=O)c1cnc(c(c1)Cl)C 1P00I9RG [0,2,0,0,0,0|2,0,0]=4 3768 B11R1.21 [O-][N+](=O)c1cnc(c(c1)Cl)F 1P01BJUR [0,2,0,0,0,0|2,0,0]=4 3769 B11R1.21 [O-][N+](=O)c1cnc(c(c1)Cl)N 1P007P6A [0,2,0,0,0,0|2,0,0]=4 3770 B11R1.21 [O-][N+](=O)c1cnc(c(c1)F)Cl 1P0084OI [0,2,0,0,0,0|2,0,0]=4 3771 B11R1.21 [O-][N+](=O)c1cnc(c(c1)F)F 1P0060RF [0,2,0,0,0,0|2,0,0]=4 3772 B11R1.21 [O-][N+](=O)c1cnc(c(c1)F)N 1P000KOF [0,2,0,0,0,0|2,0,0]=4 3773 B11R1.21 [O-][N+](=O)c1cnc(c(c1)F)O 1P008WPB [0,2,0,0,0,0|2,0,0]=4 3774 B11R1.21 [O-][N+](=O)c1cnc(c(c1)I)Cl 1P003HCD [0,2,0,0,0,0|2,0,0]=4 3775 B11R1.21 [O-][N+](=O)c1cnc(c(c1)I)N 1P003K24 [0,2,0,0,0,0|2,0,0]=4 3776 B11R1.21 [O-][N+](=O)c1cnc(c(c1)I)O 1P003K25 [0,2,0,0,0,0|2,0,0]=4 3777 B11R1.21 [O-][N+](=O)c1cnc(c(c1)N)C 1P00D8VJ [0,2,0,0,0,0|2,0,0]=4 3778 B11R1.21 [O-][N+](=O)c1cnc(c(c1)N)N 1P0037T4 [0,2,0,0,0,0|2,0,0]=4 3779 B11R1.21 [O-][N+](=O)c1cnc(c(c1)O)Cl 1P01K20B [0,2,0,0,0,0|2,0,0]=4 3780 B11R1.21 [O-][N+](=O)c1cnc(c(c1)O)N 1P00H1EI [0,2,0,0,0,0|2,0,0]=4 3781 B11R1.22 BrCC(=O)c1ccc(=O)[nH]c1 1P028BU6 [0,2,0,0,0,0|1,0,1]=4 3782 B11R1.22 BrCC(=O)c1ccc(cc1)Br 1P00659A [0,2,0,0,0,0|2,0,0]=4 3783 B11R1.22 BrCC(=O)c1ccc(cc1)C 1P00E9H8 [0,2,0,0,0,0|2,0,0]=4 3784 B11R1.22 BrCC(=O)c1ccc(cc1)Cl 1P003LJM [0,2,0,0,0,0|2,0,0]=4 3785 B11R1.22 BrCC(=O)c1ccc(cc1)F 1P003H4U [0,2,0,0,0,0|2,0,0]=4 3786 B11R1.22 BrCC(=O)c1ccc(cc1)I 1P00C0QB [0,2,0,0,0,0|2,0,0]=4 3787 B11R1.22 BrCC(=O)c1ccc(cc1)O 1P002QB3 [0,2,0,0,0,0|2,0,0]=4 3788 B11R1.22 BrCC(=O)c1ccc(nc1)Br 1P0012L7 [0,2,0,0,0,0|1,0,0]=3 3789 B11R1.22 BrCC(=O)c1cnc(cn1)Br 1P01BB9W [0,2,0,0,0,0|2,0,0]=4 3790 B11R1.22 C#CC(=O)c1ccc(cc1)C 1P01B7BJ [0,2,0,0,0,0|2,0,0]=4 3791 B11R1.22 C#CC(=O)c1ccc(cc1)Cl 1P002M4H [0,2,0,0,0,0|2,0,0]=4 3792 B11R1.22 C#CC(=O)c1ccc(cc1)F 1P01B34G [0,2,0,0,0,0|2,0,0]=4 3793 B11R1.22 C=CC(=O)c1ccc(cc1)F 1P00I9OU [0,2,0,0,0,0|2,0,0]=4 3794 B11R1.22 CCC(=O)c1ccc(cc1)Br 1P007H5R [0,2,0,0,0,0|2,0,0]=4 3795 B11R1.22 CCC(=O)c1ccc(cc1)C 1P0037SF [0,2,0,0,0,0|2,0,0]=4 3796 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1P003LOZ [0,2,0,0,0,0|2,0,0]=4 3797 B11R1.22 CCC(=O)c1ccc(cc1)F 1P003LWZ [0,2,0,0,0,0|2,0,0]=4 3798 B11R1.22 CCC(=O)c1ccc(cc1)I 1P00CM5O [0,2,0,0,0,0|2,0,0]=4 3799 B11R1.22 CCC(=O)c1ccc(cc1)N 1P005HAZ [0,2,0,0,0,0|2,0,0]=4 3800 B11R1.22 CCC(=O)c1ccc(cc1)O 1P003M0H [0,2,0,0,0,0|2,0,0]=4 3801 B11R1.22 CCC(=O)c1ccc(nc1)F 1P024ZJT [0,2,0,0,0,0|1,0,0]=3 3802 B11R1.22 CNC(=O)c1ccc(=O)[nH]c1 1P00034A [0,2,0,0,0,0|0,0,1]=3 3803 B11R1.22 CNC(=O)c1ccc(cc1)Br 1P003LHE [0,2,0,0,0,0|1,0,0]=3 3804 B11R1.22 CNC(=O)c1ccc(cc1)C 1P00ACRR [0,2,0,0,0,0|1,0,0]=3 3805 B11R1.22 CNC(=O)c1ccc(cc1)Cl 1P00FHUL [0,2,0,0,0,0|1,0,0]=3 3806 B11R1.22 CNC(=O)c1ccc(cc1)F 1P006CH0 [0,2,0,0,0,0|1,0,0]=3 3807 B11R1.22 CNC(=O)c1ccc(cc1)I 1P00IGDD [0,2,0,0,0,0|1,0,0]=3 3808 B11R1.22 CNC(=O)c1ccc(cc1)N 1P00E9GG [0,2,0,0,0,0|1,0,0]=3 3809 B11R1.22 CNC(=O)c1ccc(cc1)O 1P002URV [0,2,0,0,0,0|1,0,0]=3 3810 B11R1.22 CNC(=O)c1ccc(cc1)S 1P01DWIY [0,2,0,0,0,0|1,0,0]=3 3811 B11R1.22 CNC(=O)c1ccc(cn1)Br 1P0054DD [0,2,0,0,0,0|2,0,0]=4 3812 B11R1.22 CNC(=O)c1ccc(cn1)Cl 1P01NVOT [0,2,0,0,0,0|2,0,0]=4 3813 B11R1.22 CNC(=O)c1ccc(cn1)N 1P00IIEO [0,2,0,0,0,0|2,0,0]=4 3814 B11R1.22 CNC(=O)c1ccc(cn1)O 1P00GWX3 [0,2,0,0,0,0|2,0,0]=4 3815 B11R1.22 CNC(=O)c1ccc(nc1)Br 1P004ONF [0,2,0,0,0,0|0,0,0]=2 3816 B11R1.22 CNC(=O)c1ccc(nc1)Cl 1P00DF2T [0,2,0,0,0,0|0,0,0]=2 3817 B11R1.22 CNC(=O)c1ccc(nc1)N 1P01BDRL [0,2,0,0,0,0|0,0,0]=2 3818 B11R1.22 CNC(=O)c1ccc(nn1)Cl 1P01AL0C [0,2,0,0,0,0|1,0,0]=3 3819 B11R1.22 CNC(=O)c1ccc(nn1)N 1P01C712 [0,2,0,0,0,0|1,0,0]=3 3820 B11R1.22 CNC(=O)c1cnc(cn1)Br 1P01EM5L [0,2,0,0,0,0|1,0,0]=3 3821 B11R1.22 CNC(=O)c1cnc(cn1)C 1P0069WY [0,2,0,0,0,0|1,0,0]=3 3822 B11R1.22 CNC(=O)c1cnc(cn1)Cl 1P024SNX [0,2,0,0,0,0|1,0,0]=3 3823 B11R1.22 COC(=C1C=CC(=O)C=C1)N 1P00EB09 [0,2,0,0,0,0|1,0,1]=4 3824 B11R1.22 COC(=O)c1ccc(=O)[nH]c1 1P01A8IY [0,2,0,0,0,0|1,0,1]=4 3825 B11R1.22 COC(=O)c1ccc(=O)oc1 1P00E9IR [0,2,0,0,0,0|2,0,0]=4 3826 B11R1.22 COC(=O)c1ccc(cc1)Br 1P0035O2 [0,2,0,0,0,0|2,0,0]=4 3827 B11R1.22 COC(=O)c1ccc(cc1)C 1P0035OD [0,2,0,0,0,0|2,0,0]=4 3828 B11R1.22 COC(=O)c1ccc(cc1)Cl 1P0034GL [0,2,0,0,0,0|2,0,0]=4 3829 B11R1.22 COC(=O)c1ccc(cc1)F 1P003SBZ [0,2,0,0,0,0|2,0,0]=4 3830 B11R1.22 COC(=O)c1ccc(cc1)I 1P0034JI [0,2,0,0,0,0|2,0,0]=4 3831 B11R1.22 COC(=O)c1ccc(cc1)N 1P00E930 [0,2,0,0,0,0|2,0,0]=4 3832 B11R1.22 COC(=O)c1ccc(cc1)N 1P00EJER [0,2,0,0,0,0|2,0,0]=4 3833 B11R1.22 COC(=O)c1ccc(cc1)O 1P003A3R [0,2,0,0,0,0|2,0,0]=4 3834 B11R1.22 COC(=O)c1ccc(cc1)S 1P00EFQ0 [0,2,0,0,0,0|2,0,0]=4 3835 B11R1.22 COC(=O)c1ccc(cc1)[O-] 1P0035OB [0,2,0,0,0,0|2,0,0]=4 3836 B11R1.22 COC(=O)c1ccc(nc1)Br 1P002SRS [0,2,0,0,0,0|1,0,0]=3 3837 B11R1.22 COC(=O)c1ccc(nc1)C 1P0035P2 [0,2,0,0,0,0|1,0,0]=3 3838 B11R1.22 COC(=O)c1ccc(nc1)Cl 1P003SF3 [0,2,0,0,0,0|1,0,0]=3 3839 B11R1.22 COC(=O)c1ccc(nc1)F 1P0034TQ [0,2,0,0,0,0|1,0,0]=3 3840 B11R1.22 COC(=O)c1ccc(nc1)I 1P001Z4B [0,2,0,0,0,0|1,0,0]=3 3841 B11R1.22 COC(=O)c1ccc(nc1)N 1P003NJK [0,2,0,0,0,0|1,0,0]=3 3842 B11R1.22 COC(=O)c1ccc(nc1)O 1P003SF8 [0,2,0,0,0,0|1,0,0]=3 3843 B11R1.22 COC(=O)c1ccc(nn1)Br 1P003A4H [0,2,0,0,0,0|2,0,0]=4 3844 B11R1.22 COC(=O)c1ccc(nn1)C 1P0035P3 [0,2,0,0,0,0|2,0,0]=4 3845 B11R1.22 COC(=O)c1ccc(nn1)Cl 1P0037CK [0,2,0,0,0,0|2,0,0]=4 3846 B11R1.22 COC(=O)c1ccc(nn1)N 1P0035OV [0,2,0,0,0,0|2,0,0]=4 3847 B11R1.22 COC(=O)c1cnc(=O)[nH]c1 1P00DIDT [0,2,0,0,0,0|2,0,0]=4 3848 B11R1.22 COC(=O)c1cnc(=O)[nH]c1 1P00I9JZ [0,2,0,0,0,0|2,0,0]=4 3849 B11R1.22 COC(=O)c1cnc(cn1)Br 1P002KZK [0,2,0,0,0,0|2,0,0]=4 3850 B11R1.22 COC(=O)c1cnc(cn1)C 1P0037XH [0,2,0,0,0,0|2,0,0]=4 3851 B11R1.22 COC(=O)c1cnc(cn1)Cl 1P0035OQ [0,2,0,0,0,0|2,0,0]=4 3852 B11R1.22 COC(=O)c1cnc(cn1)F 1P00ALWS [0,2,0,0,0,0|2,0,0]=4 3853 B11R1.22 COC(=O)c1cnc(cn1)N 1P001B11 [0,2,0,0,0,0|2,0,0]=4 3854 B11R1.22 COC(=O)c1cnc(cn1)N 1P001HME [0,2,0,0,0,0|2,0,0]=4 3855 B11R1.22 COC(=O)c1cnc(nc1)Br 1P0095NK [0,2,0,0,0,0|2,0,0]=4 3856 B11R1.22 COC(=O)c1cnc(nc1)C 1P00DDNT [0,2,0,0,0,0|2,0,0]=4 3857 B11R1.22 COC(=O)c1cnc(nc1)Cl 1P002WVW [0,2,0,0,0,0|2,0,0]=4 3858 B11R1.22 COC(=O)c1cnc(nc1)N 1P0031W9 [0,2,0,0,0,0|2,0,0]=4 3859 B11R1.22 COC(=O)c1cnc(nc1)S 1P028APM [0,2,0,0,0,0|2,0,0]=4 3860 B11R1.22 Cc1cnc(cn1)C(=O)CCl 1P024ULA [0,2,0,0,0,0|2,0,0]=4 3861 B11R1.22 Cc1cnc(cn1)C(=O)NN 1P00BZYB [0,2,0,0,0,0|1,0,0]=3 3862 B11R1.22 ClCC(=O)c1ccc(cc1)Br 1P00BXRI [0,2,0,0,0,0|2,0,0]=4 3863 B11R1.22 ClCC(=O)c1ccc(cc1)C 1P019IAR [0,2,0,0,0,0|2,0,0]=4 3864 B11R1.22 ClCC(=O)c1ccc(cc1)Cl 1P003HAT [0,2,0,0,0,0|2,0,0]=4 3865 B11R1.22 ClCC(=O)c1ccc(cc1)F 1P003BNO [0,2,0,0,0,0|2,0,0]=4 3866 B11R1.22 ClCC(=O)c1ccc(cc1)I 1P00CRRB [0,2,0,0,0,0|2,0,0]=4 3867 B11R1.22 ClCC(=O)c1ccc(cc1)N 1P002T4U [0,2,0,0,0,0|2,0,0]=4 3868 B11R1.22 ClCC(=O)c1ccc(cc1)O 1P003HAV [0,2,0,0,0,0|2,0,0]=4 3869 B11R1.22 ClCC(=O)c1ccc(nc1)Cl 1P0012L9 [0,2,0,0,0,0|1,0,0]=3 3870 B11R1.22 Clc1ccc(nn1)C(=O)CBr 1P00CM41 [0,2,0,0,0,0|2,0,0]=4 3871 B11R1.22 FCC(=O)c1ccc(cc1)Br 1P00CU58 [0,2,0,0,0,0|2,0,0]=4 3872 B11R1.22 FCC(=O)c1ccc(cc1)Cl 1P00384K [0,2,0,0,0,0|2,0,0]=4 3873 B11R1.22 FCC(=O)c1ccc(cc1)F 1P00CNPR [0,2,0,0,0,0|2,0,0]=4 3874 B11R1.22 FCC(=O)c1ccc(nc1)Br 1P028D0T [0,2,0,0,0,0|1,0,0]=3 3875 B11R1.22 FCC(=O)c1ccc(nc1)Cl 1P028RN0 [0,2,0,0,0,0|1,0,0]=3 3876 B11R1.22 N#CC(=O)c1ccc(cc1)C 1P007L8C [0,2,0,0,0,0|1,0,1]=4 3877 B11R1.22 N#CC(=O)c1ccc(cc1)Cl 1P000UIQ [0,2,0,0,0,0|1,0,1]=4 3878 B11R1.22 N#CC(=O)c1ccc(cc1)F 1P006OWD [0,2,0,0,0,0|1,0,1]=4 3879 B11R1.22 NCC(=O)c1ccc(cc1)Br 1P003GSM [0,2,0,0,0,0|1,0,0]=3 3880 B11R1.22 NCC(=O)c1ccc(cc1)Cl 1P00DEKX [0,2,0,0,0,0|1,0,0]=3 3881 B11R1.22 NCC(=O)c1ccc(cc1)Cl 1P00ID79 [0,2,0,0,0,0|1,0,0]=3 3882 B11R1.22 NCC(=O)c1ccc(cc1)F 1P00I8ZN [0,2,0,0,0,0|1,0,0]=3 3883 B11R1.22 NCC(=O)c1ccc(cc1)F 1P01A1CC [0,2,0,0,0,0|1,0,0]=3 3884 B11R1.22 NCC(=O)c1ccc(cc1)O 1P002BAP [0,2,0,0,0,0|1,0,0]=3 3885 B11R1.22 NCC(=O)c1ccc(cn1)Br 1P01C0QA [0,2,0,0,0,0|2,0,0]=4 3886 B11R1.22 NCC(=O)c1ccc(cn1)F 1P028B7N [0,2,0,0,0,0|2,0,0]=4 3887 B11R1.22 NCC(=O)c1ccc(nc1)Cl 1P01BSP4 [0,2,0,0,0,0|0,0,0]=2 3888 B11R1.22 NN=C(c1ccc(cc1)Br)N 1P01FJ5A [0,2,0,0,0,0|2,0,0]=4 3889 B11R1.22 NNC(=O)c1cc[n+](cc1)[O-] 1P00O1P5 [0,2,0,0,0,0|2,0,0]=4 3890 B11R1.22 NNC(=O)c1ccc(=O)[nH]c1 1P009DL5 [0,2,0,0,0,0|0,0,1]=3 3891 B11R1.22 NNC(=O)c1ccc(=O)[nH]n1 1P01A16Q [0,2,0,0,0,0|1,0,1]=4 3892 B11R1.22 NNC(=O)c1ccc(cc1)Br 1P003LG9 [0,2,0,0,0,0|1,0,0]=3 3893 B11R1.22 NNC(=O)c1ccc(cc1)C 1P003UHW [0,2,0,0,0,0|1,0,0]=3 3894 B11R1.22 NNC(=O)c1ccc(cc1)Cl 1P00IA0X [0,2,0,0,0,0|1,0,0]=3 3895 B11R1.22 NNC(=O)c1ccc(cc1)F 1P003LVO [0,2,0,0,0,0|1,0,0]=3 3896 B11R1.22 NNC(=O)c1ccc(cc1)I 1P0076ZB [0,2,0,0,0,0|1,0,0]=3 3897 B11R1.22 NNC(=O)c1ccc(cc1)N 1P0034D7 [0,2,0,0,0,0|1,0,0]=3 3898 B11R1.22 NNC(=O)c1ccc(cc1)O 1P003LZP [0,2,0,0,0,0|1,0,0]=3 3899 B11R1.22 NNC(=O)c1ccc(cn1)Br 1P004QUP [0,2,0,0,0,0|2,0,0]=4 3900 B11R1.22 NNC(=O)c1ccc(cn1)F 1P000O4C [0,2,0,0,0,0|2,0,0]=4 3901 B11R1.22 NNC(=O)c1ccc(cn1)N 1P027YHN [0,2,0,0,0,0|2,0,0]=4 3902 B11R1.22 NNC(=O)c1ccc(nc1)C 1P007RJ5 [0,2,0,0,0,0|0,0,0]=2 3903 B11R1.22 NNC(=O)c1ccc(nc1)Cl 1P00APZT [0,2,0,0,0,0|0,0,0]=2 3904 B11R1.22 NNC(=O)c1ccc(nc1)N 1P00C8MV [0,2,0,0,0,0|0,0,0]=2 3905 B11R1.22 NNC(=O)c1cnc(cn1)Cl 1P004QUO [0,2,0,0,0,0|1,0,0]=3 3906 B11R1.22 NNC(=O)c1cnc(nc1)C 1P00J2WX [0,2,0,0,0,0|1,0,0]=3 3907 B11R1.22 NNC(=S)c1ccc(cc1)Cl 1P01DJVX [0,2,0,0,0,0|1,1,0]=4 3908 B11R1.22 NNC(=S)c1ccc(cc1)F 1P00IEH4 [0,2,0,0,0,0|1,1,0]=4 3909 B11R1.22 O=CC(=O)c1ccc(cc1)Br 1P005BYD [0,2,0,0,0,0|2,0,0]=4 3910 B11R1.22 O=CC(=O)c1ccc(cc1)Br 1P00DCVO [0,2,0,0,0,0|2,0,0]=4 3911 B11R1.22 O=CC(=O)c1ccc(cc1)C 1P00FFWR [0,2,0,0,0,0|2,0,0]=4 3912 B11R1.22 O=CC(=O)c1ccc(cc1)Cl 1P00DC88 [0,2,0,0,0,0|2,0,0]=4 3913 B11R1.22 O=CC(=O)c1ccc(cc1)F 1P00ID0I [0,2,0,0,0,0|2,0,0]=4 3914 B11R1.22 O=CC(=O)c1ccc(cc1)O 1P002PDW [0,2,0,0,0,0|2,0,0]=4 3915 B11R1.22 O=CC(=O)c1ccc(cc1)O 1P00IE4Z [0,2,0,0,0,0|2,0,0]=4 3916 B11R1.22 O=NC(=c1ccn(cc1)O)N 1P006JKD [0,2,0,0,0,0|2,0,0]=4 3917 B11R1.22 OCC(=O)c1ccc(cc1)Br 1P007FUC [0,2,0,0,0,0|2,0,0]=4 3918 B11R1.22 OCC(=O)c1ccc(cc1)C 1P00BY5W [0,2,0,0,0,0|2,0,0]=4 3919 B11R1.22 OCC(=O)c1ccc(cc1)Cl 1P00BCDF [0,2,0,0,0,0|2,0,0]=4 3920 B11R1.22 OCC(=O)c1ccc(cc1)I 1P005DWL [0,2,0,0,0,0|2,0,0]=4 3921 B11R1.22 OCC(=O)c1ccc(cc1)O 1P00ELBV [0,2,0,0,0,0|2,0,0]=4 3922 B11R1.22 OCC(c1ccc(nc1)C)N 1P01DUNQ [0,2,0,0,0,0|0,0,2]=4 3923 B11R1.22 OC[C@@H](c1ccc(nc1)Cl)N 1P01DFI9 [0,2,0,0,0,0|0,0,2]=4 3924 B11R1.22 ON=C(c1ccc(cc1)C)N 1P002G97 [0,2,0,0,0,0|1,0,1]=4 3925 B11R1.22 ON=C(c1ccc(cc1)C)N 1P01EI85 [0,2,0,0,0,0|1,0,1]=4 3926 B11R1.22 ON=C(c1ccc(cc1)F)N 1P01DEX3 [0,2,0,0,0,0|1,0,1]=4 3927 B11R1.22 ON=C(c1ccc(cc1)O)N 1P006YKG [0,2,0,0,0,0|1,0,1]=4 3928 B11R1.22 ONC(=N)c1ccc(cc1)Br 1P002G96 [0,2,0,0,0,0|2,0,0]=4 3929 B11R1.22 ONC(=N)c1ccc(cc1)F 1P006ZXO [0,2,0,0,0,0|2,0,0]=4 3930 B11R1.22 ONC(=N)c1ccc(cc1)N 1P002V1R [0,2,0,0,0,0|2,0,0]=4 3931 B11R1.22 ONC(=O)c1ccc(cc1)Br 1P002879 [0,2,0,0,0,0|1,0,0]=3 3932 B11R1.22 ONC(=O)c1ccc(cc1)C 1P006YUE [0,2,0,0,0,0|1,0,0]=3 3933 B11R1.22 ONC(=O)c1ccc(cc1)Cl 1P001SSJ [0,2,0,0,0,0|1,0,0]=3 3934 B11R1.22 ONC(=O)c1ccc(cc1)I 1P019XHA [0,2,0,0,0,0|1,0,0]=3 3935 B11R1.22 ONC(=O)c1ccc(cc1)N 1P00BL6T [0,2,0,0,0,0|1,0,0]=3 3936 B11R1.22 ONC(=O)c1ccc(nc1)Br 1P028DEO [0,2,0,0,0,0|0,0,0]=2 3937 B11R1.22 ONC(=O)c1ccc(nc1)N 1P005W27 [0,2,0,0,0,0|0,0,0]=2 3938 B11R1.22 O\N=C(\c1ccc(cc1)C)/N 1P00IQFL [0,2,0,0,0,0|1,0,1]=4 3939 B11R1.22 O\N=C(\c1ccc(cc1)Cl)/N 1P00D9KM [0,2,0,0,0,0|1,0,1]=4 3940 B11R1.22 O\N=C(\c1ccc(cc1)F)/N 1P003LVK [0,2,0,0,0,0|1,0,1]=4 3941 B11R1.22 O\N=C(\c1ccc(nc1)N)/N 1P00DAQT [0,2,0,0,0,0|0,0,1]=3 3942 B11R1.22 [NH3+]CC(=O)c1ccc(cc1)C 1P00DCZ1 [0,2,0,0,0,0|1,0,1]=4 3943 B11R1.166 Brc1ccc(c(c1)Br)C(=O)C 1P007H6P [0,2,0,0,0,0|2,0,0]=4 3944 B11R1.166 Brc1ccc(c(c1)Br)C(=O)N 1P00IF2D [0,2,0,0,0,0|1,0,0]=3 3945 B11R1.166 Brc1ccc(c(c1)Br)C(=O)O 1P003G6H [0,2,0,0,0,0|2,0,0]=4 3946 B11R1.166 Brc1ccc(c(c1)C)C(=N)N 1P000E9Y [0,2,0,0,0,0|2,0,0]=4 3947 B11R1.166 Brc1ccc(c(c1)C)C(=O)C 1P00ED87 [0,2,0,0,0,0|2,0,0]=4 3948 B11R1.166 Brc1ccc(c(c1)C)C(=O)O 1P0034EB [0,2,0,0,0,0|2,0,0]=4 3949 B11R1.166 Brc1ccc(c(c1)Cl)C(=O)C 1P0036LO [0,2,0,0,0,0|2,0,0]=4 3950 B11R1.166 Brc1ccc(c(c1)Cl)C(=O)Cl 1P01FF80 [0,2,0,0,0,0|2,0,0]=4 3951 B11R1.166 Brc1ccc(c(c1)Cl)C(=O)N 1P00CKFQ [0,2,0,0,0,0|1,0,0]=3 3952 B11R1.166 Brc1ccc(c(c1)Cl)C(=O)O 1P003LCY [0,2,0,0,0,0|2,0,0]=4 3953 B11R1.166 Brc1ccc(c(c1)F)C(=N)N 1P008TUV [0,2,0,0,0,0|2,0,0]=4 3954 B11R1.166 Brc1ccc(c(c1)F)C(=O)C 1P00EBSE [0,2,0,0,0,0|2,0,0]=4 3955 B11R1.166 Brc1ccc(c(c1)F)C(=O)Cl 1P003LDF [0,2,0,0,0,0|2,0,0]=4 3956 B11R1.166 Brc1ccc(c(c1)F)C(=O)N 1P002YC5 [0,2,0,0,0,0|1,0,0]=3 3957 B11R1.166 Brc1ccc(c(c1)F)C(=O)O 1P0034E2 [0,2,0,0,0,0|2,0,0]=4 3958 B11R1.166 Brc1ccc(c(c1)I)C(=O)N 1P028RJB [0,2,0,0,0,0|1,0,0]=3 3959 B11R1.166 Brc1ccc(c(c1)I)C(=O)O 1P008TCP [0,2,0,0,0,0|2,0,0]=4 3960 B11R1.166 Brc1ccc(c(c1)N)C(=O)C 1P000LN2 [0,2,0,0,0,0|2,0,0]=4 3961 B11R1.166 Brc1ccc(c(c1)N)C(=O)N 1P0039FS [0,2,0,0,0,0|1,0,0]=3 3962 B11R1.166 Brc1ccc(c(c1)N)C(=O)O 1P002JQ9 [0,2,0,0,0,0|2,0,0]=4 3963 B11R1.166 Brc1ccc(c(c1)O)C(=O)C 1P0034E4 [0,2,0,0,0,0|2,0,0]=4 3964 B11R1.166 Brc1ccc(c(c1)O)C(=O)N 1P00DHBZ [0,2,0,0,0,0|1,0,0]=3 3965 B11R1.166 Brc1ccc(c(c1)O)C(=O)O 1P001XB8 [0,2,0,0,0,0|2,0,0]=4 3966 B11R1.166 Brc1ccc(c(c1)O)C(=S)N 1P02909X [0,2,0,0,0,0|1,1,0]=4 3967 B11R1.166 Brc1ccc(c(c1)S)C(=O)O 1P000CEP [0,2,0,0,0,0|2,0,0]=4 3968 B11R1.166 Brc1cnc(c(c1)Br)C(=O)N 1P00IED5 [0,2,0,0,0,0|2,0,0]=4 3969 B11R1.166 Brc1cnc(c(c1)Cl)C(=O)N 1P01FLZK [0,2,0,0,0,0|2,0,0]=4 3970 B11R1.166 Brc1cnc(c(c1)F)C(=O)N 1P00FE8E [0,2,0,0,0,0|2,0,0]=4 3971 B11R1.166 Brc1cnc(c(c1)N)C(=O)N 1P00341U [0,2,0,0,0,0|2,0,0]=4 3972 B11R1.166 CC(=O)c1c[nH]c(=O)nc1C 1P00J2JJ [0,2,0,0,0,0|2,0,0]=4 3973 B11R1.166 CC(=O)c1ccc(=O)[nH]c1C 1P00DDQN [0,2,0,0,0,0|1,0,1]=4 3974 B11R1.166 CC(=O)c1ccc(nc1Cl)Cl 1P003J9T [0,2,0,0,0,0|1,0,0]=3 3975 B11R1.166 CC(=O)c1ccc(nc1Cl)N 1P023Z8I [0,2,0,0,0,0|1,0,0]=3 3976 B11R1.166 CC(=O)c1ccc(nc1F)Br 1P024DOV [0,2,0,0,0,0|1,0,0]=3 3977 B11R1.166 CC(=O)c1ccc(nc1F)F 1P00635O [0,2,0,0,0,0|1,0,0]=3 3978 B11R1.166 CC(=O)c1cnc(cc1Cl)Cl 1P00IFW3 [0,2,0,0,0,0|1,0,0]=3 3979 B11R1.166 CC(=O)c1ncc(nc1Cl)Cl 1P00A9GI [0,2,0,0,0,0|2,0,0]=4 3980 B11R1.166 CC(C1=C(O)C=C(Cl)N=C1)=O 1P01KXON [0,2,0,0,0,0|1,0,0]=3 3981 B11R1.166 C[C@@H](c1ccc(nc1C)Br)N 1P01FJ0Q [0,2,0,0,0,0|1,0,1]=4 3982 B11R1.166 Cc1cc(=O)c(c[nH]1)C(=O)O 1P00C6BP [0,2,0,0,0,0|1,0,1]=4 3983 B11R1.166 Cc1cc(Br)c(cn1)C(=O)O 1P0094E8 [0,2,0,0,0,0|1,0,0]=3 3984 B11R1.166 Cc1cc(Br)ncc1C(=O)C 1P023RBX [0,2,0,0,0,0|1,0,0]=3 3985 B11R1.166 Cc1cc(Br)ncc1C(=O)N 1P01KKLQ [0,2,0,0,0,0|0,0,0]=2 3986 B11R1.166 Cc1cc(Br)ncc1C(=O)O 1P00958U [0,2,0,0,0,0|1,0,0]=3 3987 B11R1.166 Cc1cc(C)ncc1C(=O)O 1P00BG4O [0,2,0,0,0,0|1,0,0]=3 3988 B11R1.166 Cc1cc(C)ncc1C(=O)O 1P00J3XG [0,2,0,0,0,0|1,0,0]=3 3989 B11R1.166 Cc1cc(Cl)c(cn1)C(=O)O 1P007WDK [0,2,0,0,0,0|1,0,0]=3 3990 B11R1.166 Cc1cc(Cl)ncc1C(=O)N 1P01JX6Q [0,2,0,0,0,0|0,0,0]=2 3991 B11R1.166 Cc1cc(Cl)ncc1C(=O)O 1P00DCLY [0,2,0,0,0,0|1,0,0]=3 3992 B11R1.166 Cc1cc(Cl)ncc1S(=O)O 1P01FJ1M [0,2,0,0,0,0|2,0,0]=4 3993 B11R1.166 Cc1cc(F)c(cn1)C(=O)O 1P0095UP [0,2,0,0,0,0|1,0,0]=3 3994 B11R1.166 Cc1cc(F)ncc1C(=O)O 1P00IIND [0,2,0,0,0,0|1,0,0]=3 3995 B11R1.166 Cc1cc(N)c(cn1)C(=O)O 1P000Y1A [0,2,0,0,0,0|1,0,0]=3 3996 B11R1.166 Cc1cc(N)ncc1C(=O)O 1P0027KG [0,2,0,0,0,0|1,0,0]=3 3997 B11R1.166 Cc1cc(O)c(cn1)C(=O)O 1P003LZC [0,2,0,0,0,0|1,0,0]=3 3998 B11R1.166 Cc1ccc(c(c1)Br)C(=O)C 1P00972K [0,2,0,0,0,0|2,0,0]=4 3999 B11R1.166 Cc1ccc(c(c1)Br)C(=O)O 1P003H59 [0,2,0,0,0,0|2,0,0]=4 4000 B11R1.166 Cc1ccc(c(c1)Br)C(=S)N 1P01BSO0 [0,2,0,0,0,0|1,1,0]=4 4001 B11R1.166 Cc1ccc(c(c1)C)C(=O)C 1P0033GD [0,2,0,0,0,0|2,0,0]=4 4002 B11R1.166 Cc1ccc(c(c1)C)C(=O)Cl 1P003GB2 [0,2,0,0,0,0|2,0,0]=4 4003 B11R1.166 Cc1ccc(c(c1)C)C(=O)N 1P00FJLO [0,2,0,0,0,0|1,0,0]=3 4004 B11R1.166 Cc1ccc(c(c1)C)C(=O)O 1P003GB0 [0,2,0,0,0,0|2,0,0]=4 4005 B11R1.166 Cc1ccc(c(c1)C)C(=S)N 1P00EVKO [0,2,0,0,0,0|1,1,0]=4 4006 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)C 1P00IGPH [0,2,0,0,0,0|2,0,0]=4 4007 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)Cl 1P01EUZU [0,2,0,0,0,0|2,0,0]=4 4008 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O 1P00373P [0,2,0,0,0,0|2,0,0]=4 4009 B11R1.166 Cc1ccc(c(c1)F)C(=N)N 1P02855S [0,2,0,0,0,0|2,0,0]=4 4010 B11R1.166 Cc1ccc(c(c1)F)C(=N)N 1P028A8Q [0,2,0,0,0,0|2,0,0]=4 4011 B11R1.166 Cc1ccc(c(c1)F)C(=O)C 1P002YTP [0,2,0,0,0,0|2,0,0]=4 4012 B11R1.166 Cc1ccc(c(c1)F)C(=O)N 1P00GYLH [0,2,0,0,0,0|1,0,0]=3 4013 B11R1.166 Cc1ccc(c(c1)F)C(=O)O 1P0033RT [0,2,0,0,0,0|2,0,0]=4 4014 B11R1.166 Cc1ccc(c(c1)F)C(=O)[O-] 1P01K5DP [0,2,0,0,0,0|2,0,0]=4 4015 B11R1.166 Cc1ccc(c(c1)F)C(=S)N 1P01BUFV [0,2,0,0,0,0|1,1,0]=4 4016 B11R1.166 Cc1ccc(c(c1)I)C(=O)O 1P0024P0 [0,2,0,0,0,0|2,0,0]=4 4017 B11R1.166 Cc1ccc(c(c1)N)C(=O)C 1P000JHK [0,2,0,0,0,0|2,0,0]=4 4018 B11R1.166 Cc1ccc(c(c1)N)C(=O)N 1P0037RM [0,2,0,0,0,0|1,0,0]=3 4019 B11R1.166 Cc1ccc(c(c1)N)C(=O)O 1P002MH6 [0,2,0,0,0,0|2,0,0]=4 4020 B11R1.166 Cc1ccc(c(c1)O)C(=O)C 1P00ICDM [0,2,0,0,0,0|2,0,0]=4 4021 B11R1.166 Cc1ccc(c(c1)O)C(=O)N 1P00I9C0 [0,2,0,0,0,0|1,0,0]=3 4022 B11R1.166 Cc1ccc(c(c1)O)C(=O)O 1P0034KS [0,2,0,0,0,0|2,0,0]=4 4023 B11R1.166 Cc1ccc(c(n1)Br)C(=O)O 1P0092W9 [0,2,0,0,0,0|1,0,0]=3 4024 B11R1.166 Cc1ccc(c(n1)C)C(=O)C 1P00AENJ [0,2,0,0,0,0|1,0,0]=3 4025 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)N 1P00DIZD [0,2,0,0,0,0|0,0,0]=2 4026 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)O 1P0030WD [0,2,0,0,0,0|1,0,0]=3 4027 B11R1.166 Cc1ccc(c(n1)N)C(=O)C 1P01WJXR [0,2,0,0,0,0|1,0,0]=3 4028 B11R1.166 Cc1ccc(c(n1)N)C(=O)N 1P009SAB [0,2,0,0,0,0|0,0,0]=2 4029 B11R1.166 Cc1ccc(c(n1)N)C(=O)O 1P004QR8 [0,2,0,0,0,0|1,0,0]=3 4030 B11R1.166 Cc1ccc(c(n1)N)C(=S)N 1P028HDO [0,2,0,0,0,0|0,1,0]=3 4031 B11R1.166 Cc1ccc(c(n1)O)C(=O)N 1P02865F [0,2,0,0,0,0|0,0,0]=2 4032 B11R1.166 Cc1ccc(c(n1)O)C(=O)O 1P003HVQ [0,2,0,0,0,0|1,0,0]=3 4033 B11R1.166 Cc1cnc(c(=O)[nH]1)C(=O)N 1P004IS3 [0,2,0,0,0,0|1,0,1]=4 4034 B11R1.166 Cc1cnc(c(c1)N)C(=O)N 1P0097FN [0,2,0,0,0,0|2,0,0]=4 4035 B11R1.166 Cc1cnc(c(n1)Cl)C(=O)C 1P024HUS [0,2,0,0,0,0|2,0,0]=4 4036 B11R1.166 Cc1cnc(c(n1)Cl)C(=O)N 1P024HZX [0,2,0,0,0,0|1,0,0]=3 4037 B11R1.166 Cc1cnc(c(n1)N)C(=O)O 1P005ZDF [0,2,0,0,0,0|2,0,0]=4 4038 B11R1.166 Cc1nc(Br)ccc1C(=O)O 1P0090B6 [0,2,0,0,0,0|1,0,0]=3 4039 B11R1.166 Cc1nc(C)ccc1C(=O)O 1P0092VF [0,2,0,0,0,0|1,0,0]=3 4040 B11R1.166 Cc1nc(C)ccc1C(=O)O 1P00EAEW [0,2,0,0,0,0|1,0,0]=3 4041 B11R1.166 Cc1nc(C)cnc1C(=O)O 1P00IIVO [0,2,0,0,0,0|2,0,0]=4 4042 B11R1.166 Cc1nc(Cl)ccc1C(=O)O 1P0013BC [0,2,0,0,0,0|1,0,0]=3 4043 B11R1.166 Cc1nc(Cl)cnc1C(=O)C 1P023PQD [0,2,0,0,0,0|2,0,0]=4 4044 B11R1.166 Cc1nc(F)ccc1C(=O)O 1P004F2X [0,2,0,0,0,0|1,0,0]=3 4045 B11R1.166 Cc1nc(N)cnc1C(=O)O 1P028XUJ [0,2,0,0,0,0|2,0,0]=4 4046 B11R1.166 Cc1ncc(c(=O)[nH]1)C(=O)O 1P007U1O [0,2,0,0,0,0|2,0,0]=4 4047 B11R1.166 Cc1ncc(c(c1)C)C(=O)C 1P00HBIZ [0,2,0,0,0,0|1,0,0]=3 4048 B11R1.166 Cc1ncc(c(c1)N)C(=O)C 1P000Y1B [0,2,0,0,0,0|1,0,0]=3 4049 B11R1.166 Cc1ncc(c(c1)O)C(=O)C 1P028ECN [0,2,0,0,0,0|1,0,0]=3 4050 B11R1.166 Cc1ncc(c(n1)Br)C(=O)O 1P01DW02 [0,2,0,0,0,0|2,0,0]=4 4051 B11R1.166 Cc1ncc(c(n1)C)C(=O)C 1P00DKKR [0,2,0,0,0,0|2,0,0]=4 4052 B11R1.166 Cc1ncc(c(n1)C)C(=O)O 1P0033GG [0,2,0,0,0,0|2,0,0]=4 4053 B11R1.166 Cc1ncc(c(n1)N)C(=O)O 1P005868 [0,2,0,0,0,0|2,0,0]=4 4054 B11R1.166 Cc1ncc(c(n1)N)C(=S)N 1P01AAE0 [0,2,0,0,0,0|1,1,0]=4 4055 B11R1.166 Clc1cc(Cl)ncc1N(=O)=O 1P0033FR [0,2,0,0,0,0|2,0,0]=4 4056 B11R1.166 Clc1ccc(c(c1)Br)C(=O)C 1P008JB4 [0,2,0,0,0,0|2,0,0]=4 4057 B11R1.166 Clc1ccc(c(c1)Br)C(=O)N 1P000VSA [0,2,0,0,0,0|1,0,0]=3 4058 B11R1.166 Clc1ccc(c(c1)Br)C(=O)O 1P003H4M [0,2,0,0,0,0|2,0,0]=4 4059 B11R1.166 Clc1ccc(c(c1)C)C(=O)C 1P00I7SA [0,2,0,0,0,0|2,0,0]=4 4060 B11R1.166 Clc1ccc(c(c1)C)C(=O)N 1P0094FZ [0,2,0,0,0,0|1,0,0]=3 4061 B11R1.166 Clc1ccc(c(c1)C)C(=O)O 1P003LKH [0,2,0,0,0,0|2,0,0]=4 4062 B11R1.166 Clc1ccc(c(c1)C)C(=O)[O-] 1P01K5CT [0,2,0,0,0,0|2,0,0]=4 4063 B11R1.166 Clc1ccc(c(c1)Cl)C(=N)N 1P007XYF [0,2,0,0,0,0|2,0,0]=4 4064 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)C 1P003G7N [0,2,0,0,0,0|2,0,0]=4 4065 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)Cl 1P003G7T [0,2,0,0,0,0|2,0,0]=4 4066 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)N 1P002OPH [0,2,0,0,0,0|1,0,0]=3 4067 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)O 1P003G7R [0,2,0,0,0,0|2,0,0]=4 4068 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)[O-] 1P00CTXR [0,2,0,0,0,0|2,0,0]=4 4069 B11R1.166 Clc1ccc(c(c1)Cl)C(=S)N 1P002V4C [0,2,0,0,0,0|1,1,0]=4 4070 B11R1.166 Clc1ccc(c(c1)F)C(=O)C 1P0021L4 [0,2,0,0,0,0|2,0,0]=4 4071 B11R1.166 Clc1ccc(c(c1)F)C(=O)N 1P008XPO [0,2,0,0,0,0|1,0,0]=3 4072 B11R1.166 Clc1ccc(c(c1)F)C(=O)O 1P003LJS [0,2,0,0,0,0|2,0,0]=4 4073 B11R1.166 Clc1ccc(c(c1)I)C(=O)C 1P02491R [0,2,0,0,0,0|2,0,0]=4 4074 B11R1.166 Clc1ccc(c(c1)I)C(=O)O 1P003LK4 [0,2,0,0,0,0|2,0,0]=4 4075 B11R1.166 Clc1ccc(c(c1)N)C(=O)C 1P00CJA1 [0,2,0,0,0,0|2,0,0]=4 4076 B11R1.166 Clc1ccc(c(c1)N)C(=O)N 1P003GVO [0,2,0,0,0,0|1,0,0]=3 4077 B11R1.166 Clc1ccc(c(c1)N)C(=O)O 1P0033JX [0,2,0,0,0,0|2,0,0]=4 4078 B11R1.166 Clc1ccc(c(c1)O)C(=N)N 1P01B28A [0,2,0,0,0,0|2,0,0]=4 4079 B11R1.166 Clc1ccc(c(c1)O)C(=O)C 1P0034FX [0,2,0,0,0,0|2,0,0]=4 4080 B11R1.166 Clc1ccc(c(c1)O)C(=O)N 1P00CRUM [0,2,0,0,0,0|1,0,0]=3 4081 B11R1.166 Clc1ccc(c(c1)O)C(=O)O 1P003LP6 [0,2,0,0,0,0|2,0,0]=4 4082 B11R1.166 Clc1ccc(c(c1)S)C(=O)O 1P002984 [0,2,0,0,0,0|2,0,0]=4 4083 B11R1.166 Clc1cnc(c(c1)Cl)C(=O)N 1P00DIIO [0,2,0,0,0,0|2,0,0]=4 4084 B11R1.166 Clc1cnc(c(c1)F)C(=O)N 1P00BFS8 [0,2,0,0,0,0|2,0,0]=4 4085 B11R1.166 Clc1cnc(c(c1)N)C(=O)N 1P00BD2C [0,2,0,0,0,0|2,0,0]=4 4086 B11R1.166 Clc1ncc(c(n1)C)C(=O)O 1P002HS4 [0,2,0,0,0,0|2,0,0]=4 4087 B11R1.166 Clc1ncc(c(n1)Cl)C(=O)C 1P00H1GG [0,2,0,0,0,0|2,0,0]=4 4088 B11R1.166 Clc1ncc(c(n1)Cl)C(=O)Cl 1P002ZOH [0,2,0,0,0,0|2,0,0]=4 4089 B11R1.166 Clc1ncc(c(n1)Cl)C(=O)N 1P000LWF [0,2,0,0,0,0|1,0,0]=3 4090 B11R1.166 Clc1ncc(c(n1)Cl)C(=O)O 1P0037SD [0,2,0,0,0,0|2,0,0]=4 4091 B11R1.166 Clc1ncc(c(n1)N)C(=O)O 1P008NRA [0,2,0,0,0,0|2,0,0]=4 4092 B11R1.166 Fc1ccc(c(c1)Br)C(=O)C 1P0002WP [0,2,0,0,0,0|2,0,0]=4 4093 B11R1.166 Fc1ccc(c(c1)Br)C(=O)Cl 1P006NYK [0,2,0,0,0,0|2,0,0]=4 4094 B11R1.166 Fc1ccc(c(c1)Br)C(=O)N 1P0090J0 [0,2,0,0,0,0|1,0,0]=3 4095 B11R1.166 Fc1ccc(c(c1)Br)C(=O)O 1P0002WO [0,2,0,0,0,0|2,0,0]=4 4096 B11R1.166 Fc1ccc(c(c1)C)C(=O)C 1P003LTW [0,2,0,0,0,0|2,0,0]=4 4097 B11R1.166 Fc1ccc(c(c1)C)C(=O)Cl 1P006Z5Z [0,2,0,0,0,0|2,0,0]=4 4098 B11R1.166 Fc1ccc(c(c1)C)C(=O)N 1P00GYK9 [0,2,0,0,0,0|1,0,0]=3 4099 B11R1.166 Fc1ccc(c(c1)C)C(=O)O 1P003LWE [0,2,0,0,0,0|2,0,0]=4 4100 B11R1.166 Fc1ccc(c(c1)Cl)C(=N)N 1P00EDSV [0,2,0,0,0,0|2,0,0]=4 4101 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)C 1P0033OH [0,2,0,0,0,0|2,0,0]=4 4102 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)Cl 1P006Z5Y [0,2,0,0,0,0|2,0,0]=4 4103 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)N 1P004BUA [0,2,0,0,0,0|1,0,0]=3 4104 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)O 1P0033OJ [0,2,0,0,0,0|2,0,0]=4 4105 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)[O-] 1P01BBOE [0,2,0,0,0,0|2,0,0]=4 4106 B11R1.166 Fc1ccc(c(c1)Cl)C(=S)N 1P0290PY [0,2,0,0,0,0|1,1,0]=4 4107 B11R1.166 Fc1ccc(c(c1)F)C(=N)N 1P00GW0D [0,2,0,0,0,0|2,0,0]=4 4108 B11R1.166 Fc1ccc(c(c1)F)C(=O)C 1P003G91 [0,2,0,0,0,0|2,0,0]=4 4109 B11R1.166 Fc1ccc(c(c1)F)C(=O)Cl 1P0033G2 [0,2,0,0,0,0|2,0,0]=4 4110 B11R1.166 Fc1ccc(c(c1)F)C(=O)N 1P003G95 [0,2,0,0,0,0|1,0,0]=3 4111 B11R1.166 Fc1ccc(c(c1)F)C(=O)O 1P001QKH [0,2,0,0,0,0|2,0,0]=4 4112 B11R1.166 Fc1ccc(c(c1)F)C(=O)[O-] 1P00256O [0,2,0,0,0,0|2,0,0]=4 4113 B11R1.166 Fc1ccc(c(c1)F)C(=S)N 1P00218C [0,2,0,0,0,0|1,1,0]=4 4114 B11R1.166 Fc1ccc(c(c1)I)C(=O)O 1P003LTS [0,2,0,0,0,0|2,0,0]=4 4115 B11R1.166 Fc1ccc(c(c1)N)C(=O)C 1P001R2J [0,2,0,0,0,0|2,0,0]=4 4116 B11R1.166 Fc1ccc(c(c1)N)C(=O)C 1P01A7C3 [0,2,0,0,0,0|2,0,0]=4 4117 B11R1.166 Fc1ccc(c(c1)N)C(=O)N 1P000PJB [0,2,0,0,0,0|1,0,0]=3 4118 B11R1.166 Fc1ccc(c(c1)N)C(=O)O 1P003GVV [0,2,0,0,0,0|2,0,0]=4 4119 B11R1.166 Fc1ccc(c(c1)O)C(=O)C 1P001FX6 [0,2,0,0,0,0|2,0,0]=4 4120 B11R1.166 Fc1ccc(c(c1)O)C(=O)O 1P0034HO [0,2,0,0,0,0|2,0,0]=4 4121 B11R1.166 Fc1ccc(c(c1)S)C(=O)O 1P004ZLZ [0,2,0,0,0,0|2,0,0]=4 4122 B11R1.166 Ic1ccc(c(c1)Br)C(=O)C 1P01JKTV [0,2,0,0,0,0|2,0,0]=4 4123 B11R1.166 Ic1ccc(c(c1)Br)C(=O)N 1P00HJFY [0,2,0,0,0,0|1,0,0]=3 4124 B11R1.166 Ic1ccc(c(c1)Br)C(=O)O 1P002W5V [0,2,0,0,0,0|2,0,0]=4 4125 B11R1.166 Ic1ccc(c(c1)C)C(=O)O 1P0014WP [0,2,0,0,0,0|2,0,0]=4 4126 B11R1.166 Ic1ccc(c(c1)Cl)C(=O)O 1P001LAI [0,2,0,0,0,0|2,0,0]=4 4127 B11R1.166 Ic1ccc(c(c1)F)C(=O)O 1P000N3H [0,2,0,0,0,0|2,0,0]=4 4128 B11R1.166 Ic1ccc(c(c1)N)C(=O)O 1P002JQ6 [0,2,0,0,0,0|2,0,0]=4 4129 B11R1.166 Ic1ccc(c(c1)O)C(=O)O 1P001YPT [0,2,0,0,0,0|2,0,0]=4 4130 B11R1.166 NC(=O)c1ccc(nc1Cl)Cl 1P00EG2B [0,2,0,0,0,0|0,0,0]=2 4131 B11R1.166 NC(=O)c1ccc(nc1O)O 1P003GLH [0,2,0,0,0,0|0,0,0]=2 4132 B11R1.166 NC(=O)c1cnc(cc1Cl)Cl 1P005UCP [0,2,0,0,0,0|0,0,0]=2 4133 B11R1.166 NC(=O)c1ncc(nc1Cl)Cl 1P00BFW3 [0,2,0,0,0,0|1,0,0]=3 4134 B11R1.166 NC(=O)c1nnc(cc1Cl)Cl 1P01JWLY [0,2,0,0,0,0|1,0,0]=3 4135 B11R1.166 Nc1cc(Cl)c(cn1)C(=O)O 1P008YVH [0,2,0,0,0,0|1,0,0]=3 4136 B11R1.166 Nc1cc(Cl)ncc1C(=O)N 1P02812G [0,2,0,0,0,0|0,0,0]=2 4137 B11R1.166 Nc1cc(Cl)ncc1C(=O)O 1P0097H1 [0,2,0,0,0,0|1,0,0]=3 4138 B11R1.166 Nc1cc(Cl)nnc1C(=O)O 1P01AA2A [0,2,0,0,0,0|2,0,0]=4 4139 B11R1.166 Nc1cc(F)c(cn1)C(=O)O 1P028LJ9 [0,2,0,0,0,0|1,0,0]=3 4140 B11R1.166 Nc1cc(F)ncc1C(=O)O 1P000M6R [0,2,0,0,0,0|1,0,0]=3 4141 B11R1.166 Nc1cc(N)ncc1C(=O)O 1P028J9G [0,2,0,0,0,0|1,0,0]=3 4142 B11R1.166 Nc1ccc(c(c1)Br)C(=O)C 1P00HJFL [0,2,0,0,0,0|2,0,0]=4 4143 B11R1.166 Nc1ccc(c(c1)Br)C(=O)O 1P002Q53 [0,2,0,0,0,0|2,0,0]=4 4144 B11R1.166 Nc1ccc(c(c1)Br)C(=O)O 1P01DX04 [0,2,0,0,0,0|2,0,0]=4 4145 B11R1.166 Nc1ccc(c(c1)C)C(=O)C 1P00C7HZ [0,2,0,0,0,0|2,0,0]=4 4146 B11R1.166 Nc1ccc(c(c1)C)C(=O)N 1P00DNPM [0,2,0,0,0,0|1,0,0]=3 4147 B11R1.166 Nc1ccc(c(c1)C)C(=O)O 1P002Q4Y [0,2,0,0,0,0|2,0,0]=4 4148 B11R1.166 Nc1ccc(c(c1)Cl)C(=O)C 1P005RMU [0,2,0,0,0,0|2,0,0]=4 4149 B11R1.166 Nc1ccc(c(c1)Cl)C(=O)N 1P002LRN [0,2,0,0,0,0|1,0,0]=3 4150 B11R1.166 Nc1ccc(c(c1)Cl)C(=O)O 1P002P2E [0,2,0,0,0,0|2,0,0]=4 4151 B11R1.166 Nc1ccc(c(c1)Cl)C(=O)O 1P019WYV [0,2,0,0,0,0|2,0,0]=4 4152 B11R1.166 Nc1ccc(c(c1)F)C(=O)N 1P00ED7P [0,2,0,0,0,0|1,0,0]=3 4153 B11R1.166 Nc1ccc(c(c1)F)C(=O)O 1P003L58 [0,2,0,0,0,0|2,0,0]=4 4154 B11R1.166 Nc1ccc(c(c1)I)C(=O)O 1P008QUX [0,2,0,0,0,0|2,0,0]=4 4155 B11R1.166 Nc1ccc(c(c1)N)C(=O)N 1P028RPQ [0,2,0,0,0,0|1,0,0]=3 4156 B11R1.166 Nc1ccc(c(c1)N)C(=O)O 1P003G5Z [0,2,0,0,0,0|2,0,0]=4 4157 B11R1.166 Nc1ccc(c(c1)N)C(=O)O 1P00F3FM [0,2,0,0,0,0|2,0,0]=4 4158 B11R1.166 Nc1ccc(c(c1)O)C(=O)C 1P002PTO [0,2,0,0,0,0|2,0,0]=4 4159 B11R1.166 Nc1ccc(c(c1)O)C(=O)N 1P00ENYU [0,2,0,0,0,0|1,0,0]=3 4160 B11R1.166 Nc1ccc(c(c1)O)C(=O)O 1P003L8T [0,2,0,0,0,0|2,0,0]=4 4161 B11R1.166 Nc1ccc(c(c1)O)C(=O)O 1P00737J [0,2,0,0,0,0|2,0,0]=4 4162 B11R1.166 Nc1ccc(c(c1)O)C(=O)[O-] 1P0011Y6 [0,2,0,0,0,0|2,0,0]=4 4163 B11R1.166 Nc1ccc(c(c1)O)C(=O)[O-] 1P0011Y7 [0,2,0,0,0,0|2,0,0]=4 4164 B11R1.166 Nc1ccc(c(c1)O)C(=O)[O-] 1P00IB4H [0,2,0,0,0,0|2,0,0]=4 4165 B11R1.166 Nc1ccc(c(c1)S)C(=O)O 1P005N76 [0,2,0,0,0,0|2,0,0]=4 4166 B11R1.166 Nc1ccc(c(n1)Br)C(=O)O 1P00L9S5 [0,2,0,0,0,0|1,0,0]=3 4167 B11R1.166 Nc1ccc(c(n1)Cl)C(=O)O 1P020N2W [0,2,0,0,0,0|1,0,0]=3 4168 B11R1.166 Nc1ccc(c(n1)F)C(=O)N 1P0021EC [0,2,0,0,0,0|0,0,0]=2 4169 B11R1.166 Nc1ccc(c(n1)F)C(=O)O 1P020KK9 [0,2,0,0,0,0|1,0,0]=3 4170 B11R1.166 Nc1nc(Br)ccc1C(=O)N 1P01XDA7 [0,2,0,0,0,0|0,0,0]=2 4171 B11R1.166 Nc1nc(Br)ccc1C(=O)O 1P000PTS [0,2,0,0,0,0|1,0,0]=3 4172 B11R1.166 Nc1nc(Cl)ccc1C(=O)N 1P003GYX [0,2,0,0,0,0|0,0,0]=2 4173 B11R1.166 Nc1nc(Cl)ccc1C(=O)O 1P00ECT0 [0,2,0,0,0,0|1,0,0]=3 4174 B11R1.166 Nc1nc(Cl)cnc1C(=O)O 1P000RGG [0,2,0,0,0,0|2,0,0]=4 4175 B11R1.166 Nc1ncc(c(=O)[nH]1)C(=O)O 1P00JBLX [0,2,0,0,0,0|2,0,0]=4 4176 B11R1.166 Nc1ncc(c(c1)C)C(=O)N 1P028WZT [0,2,0,0,0,0|0,0,0]=2 4177 B11R1.166 Nc1ncc(c(n1)C)C(=O)C 1P003MSF [0,2,0,0,0,0|2,0,0]=4 4178 B11R1.166 Nc1ncc(c(n1)C)C(=O)O 1P008OZ4 [0,2,0,0,0,0|2,0,0]=4 4179 B11R1.166 Nc1ncc(c(n1)Cl)C(=O)O 1P000LXY [0,2,0,0,0,0|2,0,0]=4 4180 B11R1.166 Nc1ncc(c(n1)N)C(=O)O 1P007T96 [0,2,0,0,0,0|2,0,0]=4 4181 B11R1.166 O=C(C1=NN=C(Cl)C=C1Cl)[O-] 1P01FWT7 [0,2,0,0,0,0|2,0,0]=4 4182 B11R1.166 O=c1ccc(c(o1)C)C(=O)O 1P00BIFY [0,2,0,0,0,0|2,0,0]=4 4183 B11R1.166 OC(=O)c1c[nH]c(=O)cc1C 1P01E8WS [0,2,0,0,0,0|1,0,1]=4 4184 B11R1.166 OC(=O)c1c[nH]c(=O)cc1O 1P00DGGH [0,2,0,0,0,0|1,0,1]=4 4185 B11R1.166 OC(=O)c1ccc(=O)[nH]c1Br 1P0284F5 [0,2,0,0,0,0|1,0,1]=4 4186 B11R1.166 OC(=O)c1ccc(=O)[nH]c1C 1P00FHPX [0,2,0,0,0,0|1,0,1]=4 4187 B11R1.166 OC(=O)c1ccc([nH]c1=O)Cl 1P00397W [0,2,0,0,0,0|1,0,1]=4 4188 B11R1.166 OC(=O)c1ccc(nc1Br)Br 1P00D8VK [0,2,0,0,0,0|1,0,0]=3 4189 B11R1.166 OC(=O)c1ccc(nc1Br)Cl 1P007ELE [0,2,0,0,0,0|1,0,0]=3 4190 B11R1.166 OC(=O)c1ccc(nc1Cl)Br 1P003NKF [0,2,0,0,0,0|1,0,0]=3 4191 B11R1.166 OC(=O)c1ccc(nc1Cl)Cl 1P003GK8 [0,2,0,0,0,0|1,0,0]=3 4192 B11R1.166 OC(=O)c1ccc(nc1Cl)F 1P007PLV [0,2,0,0,0,0|1,0,0]=3 4193 B11R1.166 OC(=O)c1ccc(nc1F)Br 1P0015B1 [0,2,0,0,0,0|1,0,0]=3 4194 B11R1.166 OC(=O)c1ccc(nc1F)Cl 1P009I3M [0,2,0,0,0,0|1,0,0]=3 4195 B11R1.166 OC(=O)c1ccc(nc1F)F 1P0038E0 [0,2,0,0,0,0|1,0,0]=3 4196 B11R1.166 OC(=O)c1cnc(=O)[nH]c1C 1P000UGR [0,2,0,0,0,0|2,0,0]=4 4197 B11R1.166 OC(=O)c1cnc(cc1Br)Br 1P008R5V [0,2,0,0,0,0|1,0,0]=3 4198 B11R1.166 OC(=O)c1cnc(cc1Br)Cl 1P000OX7 [0,2,0,0,0,0|1,0,0]=3 4199 B11R1.166 OC(=O)c1cnc(cc1Br)F 1P01R6L7 [0,2,0,0,0,0|1,0,0]=3 4200 B11R1.166 OC(=O)c1cnc(cc1Cl)Br 1P003AME [0,2,0,0,0,0|1,0,0]=3 4201 B11R1.166 OC(=O)c1cnc(cc1Cl)Cl 1P003L02 [0,2,0,0,0,0|1,0,0]=3 4202 B11R1.166 OC(=O)c1cnc(cc1F)Br 1P0084VJ [0,2,0,0,0,0|1,0,0]=3 4203 B11R1.166 OC(=O)c1cnc(cc1F)F 1P0038V5 [0,2,0,0,0,0|1,0,0]=3 4204 B11R1.166 OC(=O)c1cnc(cc1I)Br 1P000QJ5 [0,2,0,0,0,0|1,0,0]=3 4205 B11R1.166 OC(=O)c1cnc(cc1I)Cl 1P00HGFR [0,2,0,0,0,0|1,0,0]=3 4206 B11R1.166 OC(=O)c1ncc(nc1Cl)Cl 1P0039A1 [0,2,0,0,0,0|2,0,0]=4 4207 B11R1.166 OC(=O)c1nnc(cc1Cl)Cl 1P008UNR [0,2,0,0,0,0|2,0,0]=4 4208 B11R1.166 OS(=O)c1ccc(nc1F)Cl 1P028LZS [0,2,0,0,0,0|2,0,0]=4 4209 B11R1.166 Oc1ccc(c(c1)Br)C(=O)C 1P00EITL [0,2,0,0,0,0|2,0,0]=4 4210 B11R1.166 Oc1ccc(c(c1)Br)C(=O)O 1P00BK8U [0,2,0,0,0,0|2,0,0]=4 4211 B11R1.166 Oc1ccc(c(c1)C)C(=O)C 1P008FCZ [0,2,0,0,0,0|2,0,0]=4 4212 B11R1.166 Oc1ccc(c(c1)C)C(=O)N 1P01B6TP [0,2,0,0,0,0|1,0,0]=3 4213 B11R1.166 Oc1ccc(c(c1)C)C(=O)O 1P003LY6 [0,2,0,0,0,0|2,0,0]=4 4214 B11R1.166 Oc1ccc(c(c1)Cl)C(=O)C 1P0036A8 [0,2,0,0,0,0|2,0,0]=4 4215 B11R1.166 Oc1ccc(c(c1)Cl)C(=O)N 1P003HDZ [0,2,0,0,0,0|1,0,0]=3 4216 B11R1.166 Oc1ccc(c(c1)Cl)C(=O)O 1P003HE0 [0,2,0,0,0,0|2,0,0]=4 4217 B11R1.166 Oc1ccc(c(c1)Cl)C(=O)O 1P003HE1 [0,2,0,0,0,0|2,0,0]=4 4218 B11R1.166 Oc1ccc(c(c1)Cl)C(=S)N 1P028W6N [0,2,0,0,0,0|1,1,0]=4 4219 B11R1.166 Oc1ccc(c(c1)F)C(=O)C 1P0032QF [0,2,0,0,0,0|2,0,0]=4 4220 B11R1.166 Oc1ccc(c(c1)F)C(=O)N 1P003B6H [0,2,0,0,0,0|1,0,0]=3 4221 B11R1.166 Oc1ccc(c(c1)F)C(=O)O 1P003HQ1 [0,2,0,0,0,0|2,0,0]=4 4222 B11R1.166 Oc1ccc(c(c1)N)C(=O)N 1P00537N [0,2,0,0,0,0|1,0,0]=3 4223 B11R1.166 Oc1ccc(c(c1)N)C(=O)O 1P00CJAM [0,2,0,0,0,0|2,0,0]=4 4224 B11R1.166 Oc1ccc(c(c1)O)C(=O)C 1P003G9T [0,2,0,0,0,0|2,0,0]=4 4225 B11R1.166 Oc1ccc(c(c1)O)C(=O)N 1P003BLK [0,2,0,0,0,0|1,0,0]=3 4226 B11R1.166 Oc1ccc(c(c1)O)C(=O)O 1P003G9U [0,2,0,0,0,0|2,0,0]=4 4227 B11R1.166 Oc1ccc(c(n1)Cl)C(=O)O 1P003HHA [0,2,0,0,0,0|1,0,0]=3 4228 B11R1.166 Oc1nc(Br)ccc1C(=O)O 1P01B2M4 [0,2,0,0,0,0|1,0,0]=3 4229 B11R1.166 Oc1ncc(c(c1)Cl)C(=O)O 1P005NI6 [0,2,0,0,0,0|1,0,0]=3 4230 B11R1.166 Oc1ncc(c(n1)N)C(=O)O 1P00C90A [0,2,0,0,0,0|2,0,0]=4 4231 B11R1.166 Oc1nnc(c(n1)O)C(=O)N 1P01A42I [0,2,0,0,0,0|2,0,0]=4 4232 B11R1.166 Sc1ccc(c(c1)Cl)C(=O)O 1P000CEO [0,2,0,0,0,0|2,0,0]=4 4233 B11R1.166 Sc1ccc(c(c1)F)C(=O)O 1P01BL0V [0,2,0,0,0,0|2,0,0]=4 4234 B11R1.166 Sc1ncc(c(n1)O)C(=O)N 1P01BIUI [0,2,0,0,0,0|1,0,0]=3 4235 B11R1.166 [O-]C(=O)c1cnc(cc1Br)C 1P02816E [0,2,0,0,0,0|1,0,0]=3 4236 B11R1.166 [O-]C(=O)c1nnc(cc1Cl)C 1P028HEF [0,2,0,0,0,0|2,0,0]=4 4237 B11R1.166 [O-]C(=O)c1nnc(cc1Cl)Cl 1P01KMEQ [0,2,0,0,0,0|2,0,0]=4 4238 B11R1.166 [O-]S(=O)c1ccc(nc1C)F 1P028SJC [0,2,0,0,0,0|2,0,0]=4 4239 B11R1.166 [O-][N+](=O)c1ccc(nc1Br)Br 1P00IAC0 [0,2,0,0,0,0|2,0,0]=4 4240 B11R1.166 [O-][N+](=O)c1ccc(nc1Br)C 1P00I7U5 [0,2,0,0,0,0|2,0,0]=4 4241 B11R1.166 [O-][N+](=O)c1ccc(nc1Br)Cl 1P00GUZ6 [0,2,0,0,0,0|2,0,0]=4 4242 B11R1.166 [O-][N+](=O)c1ccc(nc1Br)F 1P01X9UV [0,2,0,0,0,0|2,0,0]=4 4243 B11R1.166 [O-][N+](=O)c1ccc(nc1C)Br 1P003H6W [0,2,0,0,0,0|2,0,0]=4 4244 B11R1.166 [O-][N+](=O)c1ccc(nc1C)C 1P001O3U [0,2,0,0,0,0|2,0,0]=4 4245 B11R1.166 [O-][N+](=O)c1ccc(nc1C)Cl 1P003NMB [0,2,0,0,0,0|2,0,0]=4 4246 B11R1.166 [O-][N+](=O)c1ccc(nc1C)F 1P003HR5 [0,2,0,0,0,0|2,0,0]=4 4247 B11R1.166 [O-][N+](=O)c1ccc(nc1C)N 1P003GZB [0,2,0,0,0,0|2,0,0]=4 4248 B11R1.166 [O-][N+](=O)c1ccc(nc1Cl)Br 1P00HX8U [0,2,0,0,0,0|2,0,0]=4 4249 B11R1.166 [O-][N+](=O)c1ccc(nc1Cl)C 1P00DEDB [0,2,0,0,0,0|2,0,0]=4 4250 B11R1.166 [O-][N+](=O)c1ccc(nc1Cl)Cl 1P001S62 [0,2,0,0,0,0|2,0,0]=4 4251 B11R1.166 [O-][N+](=O)c1ccc(nc1Cl)F 1P00I71C [0,2,0,0,0,0|2,0,0]=4 4252 B11R1.166 [O-][N+](=O)c1ccc(nc1Cl)N 1P004W9L [0,2,0,0,0,0|2,0,0]=4 4253 B11R1.166 [O-][N+](=O)c1ccc(nc1F)Br 1P00HWN6 [0,2,0,0,0,0|2,0,0]=4 4254 B11R1.166 [O-][N+](=O)c1ccc(nc1F)C 1P00I3F0 [0,2,0,0,0,0|2,0,0]=4 4255 B11R1.166 [O-][N+](=O)c1ccc(nc1F)Cl 1P00CM3B [0,2,0,0,0,0|2,0,0]=4 4256 B11R1.166 [O-][N+](=O)c1ccc(nc1F)F 1P00380M [0,2,0,0,0,0|2,0,0]=4 4257 B11R1.166 [O-][N+](=O)c1ccc(nc1N)Br 1P004SHG [0,2,0,0,0,0|2,0,0]=4 4258 B11R1.166 [O-][N+](=O)c1ccc(nc1N)C 1P003GUH [0,2,0,0,0,0|2,0,0]=4 4259 B11R1.166 [O-][N+](=O)c1ccc(nc1N)Cl 1P003GYR [0,2,0,0,0,0|2,0,0]=4 4260 B11R1.166 [O-][N+](=O)c1ccc(nc1N)I 1P00CLTH [0,2,0,0,0,0|2,0,0]=4 4261 B11R1.166 [O-][N+](=O)c1ccc(nc1O)C 1P00BXUF [0,2,0,0,0,0|2,0,0]=4 4262 B11R1.166 [O-][N+](=O)c1ccc(nc1O)F 1P01DZGG [0,2,0,0,0,0|2,0,0]=4 4263 B11R1.166 [O-][N+](=O)c1cnc(cc1Br)Br 1P00DBS5 [0,2,0,0,0,0|2,0,0]=4 4264 B11R1.166 [O-][N+](=O)c1cnc(cc1Br)Cl 1P000SG7 [0,2,0,0,0,0|2,0,0]=4 4265 B11R1.166 [O-][N+](=O)c1cnc(cc1Br)N 1P004SHD [0,2,0,0,0,0|2,0,0]=4 4266 B11R1.166 [O-][N+](=O)c1cnc(cc1C)Br 1P002MID [0,2,0,0,0,0|2,0,0]=4 4267 B11R1.166 [O-][N+](=O)c1cnc(cc1C)C 1P007WMA [0,2,0,0,0,0|2,0,0]=4 4268 B11R1.166 [O-][N+](=O)c1cnc(cc1C)Cl 1P002MIL [0,2,0,0,0,0|2,0,0]=4 4269 B11R1.166 [O-][N+](=O)c1cnc(cc1C)F 1P0038NP [0,2,0,0,0,0|2,0,0]=4 4270 B11R1.166 [O-][N+](=O)c1cnc(cc1C)I 1P00ELV3 [0,2,0,0,0,0|2,0,0]=4 4271 B11R1.166 [O-][N+](=O)c1cnc(cc1C)N 1P003GY7 [0,2,0,0,0,0|2,0,0]=4 4272 B11R1.166 [O-][N+](=O)c1cnc(cc1C)O 1P003HVM [0,2,0,0,0,0|2,0,0]=4 4273 B11R1.166 [O-][N+](=O)c1cnc(cc1Cl)Br 1P000A0J [0,2,0,0,0,0|2,0,0]=4 4274 B11R1.166 [O-][N+](=O)c1cnc(cc1Cl)C 1P00IE79 [0,2,0,0,0,0|2,0,0]=4 4275 B11R1.166 [O-][N+](=O)c1cnc(cc1Cl)N 1P002OR8 [0,2,0,0,0,0|2,0,0]=4 4276 B11R1.166 [O-][N+](=O)c1cnc(cc1F)Cl 1P024HGO [0,2,0,0,0,0|2,0,0]=4 4277 B11R1.166 [O-][N+](=O)c1cnc(cc1F)F 1P00ELA6 [0,2,0,0,0,0|2,0,0]=4 4278 B11R1.166 [O-][N+](=O)c1cnc(cc1N)Br 1P004SHC [0,2,0,0,0,0|2,0,0]=4 4279 B11R1.166 [O-][N+](=O)c1cnc(cc1N)Br 1P028OG2 [0,2,0,0,0,0|2,0,0]=4 4280 B11R1.166 [O-][N+](=O)c1cnc(cc1N)C 1P00G63S [0,2,0,0,0,0|2,0,0]=4 4281 B11R1.166 [O-][N+](=O)c1cnc(cc1N)Cl 1P002RXF [0,2,0,0,0,0|2,0,0]=4 4282 B11R1.166 [O-][N+](=O)c1cnc(cc1N)N 1P00C4Q0 [0,2,0,0,0,0|2,0,0]=4 4283 B11R1.166 [O-][N+](=O)c1cnc(cc1N)O 1P005SRO [0,2,0,0,0,0|2,0,0]=4 4284 B11R1.727 OC(=O)C1=CN=S(=O)(C=C1)C 1P01A7CA [0,2,0,0,0,0|2,0,0]=4 4285 B11R1.7 CCS(=O)(=O)c1cccnc1 1P01BT0R [0,2,0,0,0,0|2,0,0]=4 4286 B11R1.7 CNS(=O)(=O)c1ccccc1 1P0035UZ [0,2,0,0,0,0|2,0,0]=4 4287 B11R1.7 ClNS(=O)(=O)c1ccccc1 1P0030O9 [0,2,0,0,0,0|2,0,0]=4 4288 B11R1.7 FNS(=O)(=O)c1ccccc1 1P001DKS [0,2,0,0,0,0|2,0,0]=4 4289 B11R1.7 NCC(c1cccnc1)(C)C 1P01C3R1 [0,2,0,0,0,0|1,0,1]=4 4290 B11R1.7 NCC(c1cccnc1)(F)F 1P00EUG7 [0,2,0,0,0,0|1,0,1]=4 4291 B11R1.7 NNS(=O)(=O)c1ccccc1 1P00IDJP [0,2,0,0,0,0|2,0,0]=4 4292 B11R1.7 ONS(=O)(=O)c1ccccc1 1P003OHM [0,2,0,0,0,0|2,0,0]=4 4293 B11R1.12 CC=C(c1ccccc1)C=O 1P003IBN [0,2,0,0,0,0|2,0,0]=4 4294 B11R1.12 CCC(c1cccnc1)NC 1P005WXV [0,2,0,0,0,0|1,0,1]=4 4295 B11R1.12 CNC(c1cccnc1)CO 1P027U45 [0,2,0,0,0,0|0,0,2]=4 4296 B11R1.12 NCC(c1cccnc1)CO 1P01B8XR [0,2,0,0,0,0|0,0,2]=4 4297 B11R1.12 NCC(c1cccnc1)CO 1P01C532 [0,2,0,0,0,0|0,0,2]=4 4298 B11R1.12 NC\C(=C\Cl)\c1ccccc1 1P00IE2V [0,2,0,0,0,0|2,0,0]=4 4299 B11R1.16 C=C=CC(=O)c1ccccc1 1P01WZTH [0,2,0,0,0,0|2,0,0]=4 4300 B11R1.16 C=CCC(=O)c1ccccc1 1P00F3VL [0,2,0,0,0,0|2,0,0]=4 4301 B11R1.16 C=COC(=O)c1ccccc1 1P003VRK [0,2,0,0,0,0|2,0,0]=4 4302 B11R1.16 CC#CC(=O)c1ccccc1 1P00FHQS [0,2,0,0,0,0|2,0,0]=4 4303 B11R1.16 CC=CC(=O)c1ccccc1 1P003F2O [0,2,0,0,0,0|2,0,0]=4 4304 B11R1.16 CCCC(=O)c1ccccc1 1P003P38 [0,2,0,0,0,0|2,0,0]=4 4305 B11R1.16 CCCC(=O)c1cccnc1 1P00ARKR [0,2,0,0,0,0|1,0,0]=3 4306 B11R1.16 CCCC(c1cccnc1)N 1P00IGO1 [0,2,0,0,0,0|1,0,1]=4 4307 B11R1.16 CCNC(=O)c1ccccc1 1P00EFY2 [0,2,0,0,0,0|1,0,0]=3 4308 B11R1.16 CCNC(=O)c1cccnc1 1P003TH9 [0,2,0,0,0,0|0,0,0]=2 4309 B11R1.16 CCNC(c1cccnc1)C 1P00EFBF [0,2,0,0,0,0|1,0,1]=4 4310 B11R1.16 CCNC(c1cccnc1)C 1P028RTA [0,2,0,0,0,0|1,0,1]=4 4311 B11R1.16 CCOC(=O)c1ccccc1 1P003QV1 [0,2,0,0,0,0|2,0,0]=4 4312 B11R1.16 CCOC(=O)c1cccnc1 1P003QWQ [0,2,0,0,0,0|1,0,0]=3 4313 B11R1.16 CCOC(=O)c1cccnn1 1P0082MH [0,2,0,0,0,0|2,0,0]=4 4314 B11R1.16 CCOC(=O)c1ccnnc1 1P003QXJ [0,2,0,0,0,0|2,0,0]=4 4315 B11R1.16 CCOC(=O)c1cnccn1 1P006AWS [0,2,0,0,0,0|2,0,0]=4 4316 B11R1.16 CCOC(=O)c1cncnc1 1P003QTM [0,2,0,0,0,0|2,0,0]=4 4317 B11R1.16 CNCC(c1cccnc1)O 1P01AKS6 [0,2,0,0,0,0|0,0,2]=4 4318 B11R1.16 CNNC(=O)c1ccccc1 1P00AVBP [0,2,0,0,0,0|1,0,0]=3 4319 B11R1.16 COCC(=O)c1ccccc1 1P003I0C [0,2,0,0,0,0|2,0,0]=4 4320 B11R1.16 COCC(=O)c1cccnc1 1P02889I [0,2,0,0,0,0|1,0,0]=3 4321 B11R1.16 COC[C@@H](c1cccnc1)N 1P028NCG [0,2,0,0,0,0|0,0,2]=4 4322 B11R1.16 COC[C@H](c1cccnc1)N 1P028NBA [0,2,0,0,0,0|0,0,2]=4 4323 B11R1.16 CONC(=O)c1ccccc1 1P007NK5 [0,2,0,0,0,0|1,0,0]=3 4324 B11R1.16 CSCC(=O)c1ccccc1 1P01A91B [0,2,0,0,0,0|2,0,0]=4 4325 B11R1.16 C\C=C\C(=O)c1ccccc1 1P003VC7 [0,2,0,0,0,0|2,0,0]=4 4326 B11R1.16 ClCCC(=O)c1ccccc1 1P003JS2 [0,2,0,0,0,0|2,0,0]=4 4327 B11R1.16 ClCOC(=O)c1ccccc1 1P00DA2O [0,2,0,0,0,0|2,0,0]=4 4328 B11R1.16 ICOC(=O)c1ccccc1 1P001BHI [0,2,0,0,0,0|2,0,0]=4 4329 B11R1.16 N#CCC(=O)c1ccccc1 1P00IBBJ [0,2,0,0,0,0|1,0,1]=4 4330 B11R1.16 N#CCC(=O)c1cccnc1 1P0030VO [0,2,0,0,0,0|0,0,1]=3 4331 B11R1.16 N#CNC(=N)c1ccccc1 1P0020M2 [0,2,0,0,0,0|2,0,0]=4 4332 B11R1.16 N#CNC(=O)c1ccccc1 1P007XF5 [0,2,0,0,0,0|1,0,0]=3 4333 B11R1.16 NCCC(=O)c1ccccc1 1P01KXES [0,2,0,0,0,0|1,0,0]=3 4334 B11R1.16 NCCS(=O)c1ccccc1 1P01AHMQ [0,2,0,0,0,0|2,0,0]=4 4335 B11R1.16 O=C(c1ccccc1)O[NH2+]C 1P003TWD [0,2,0,0,0,0|1,0,1]=4 4336 B11R1.16 O=C=NC(=O)c1ccccc1 1P0038BA [0,2,0,0,0,0|1,0,1]=4 4337 B11R1.16 O=CC=C(c1ccccc1)C 1P000PPZ [0,2,0,0,0,0|2,0,0]=4 4338 B11R1.16 OCCC(=O)c1ccccc1 1P0036LN [0,2,0,0,0,0|2,0,0]=4 4339 B11R1.16 OCC[C@H](c1cccnc1)N 1P028MXF [0,2,0,0,0,0|0,0,2]=4 4340 B11R1.16 OCNC(=O)c1ccccc1 1P003SV5 [0,2,0,0,0,0|1,0,0]=3 4341 B11R1.16 OCNC(=O)c1cccnc1 1P003SV6 [0,2,0,0,0,0|0,0,0]=2 4342 B11R1.16 O\N=C\C(=O)c1ccccc1 1P003HXY [0,2,0,0,0,0|1,0,1]=4 4343 B11R1.16 S=C=NC(=O)c1ccccc1 1P0034YS [0,2,0,0,0,0|1,0,1]=4 4344 B11R1.16 [K]ONC(=O)c1ccccc1 1P01EIRO [0,2,0,0,0,0|1,0,0]=3 4345 B11R1.16 [N-]=[N+]=NC(=O)c1cccnc1 1P00C140 [0,2,0,0,0,0|0,0,1]=3 4346 B11R1.16 [O-]C=CC(=O)c1ccccc1 1P01FIJL [0,2,0,0,0,0|2,0,0]=4 4347 B11R1.23 BrCC(=O)c1cccc(c1)Br 1P0033E5 [0,2,0,0,0,0|2,0,0]=4 4348 B11R1.23 BrCC(=O)c1cccc(c1)C 1P00DHC0 [0,2,0,0,0,0|2,0,0]=4 4349 B11R1.23 BrCC(=O)c1cccc(c1)Cl 1P003JRO [0,2,0,0,0,0|2,0,0]=4 4350 B11R1.23 BrCC(=O)c1cccc(c1)F 1P003H38 [0,2,0,0,0,0|2,0,0]=4 4351 B11R1.23 BrCC(=O)c1cccc(c1)I 1P00ELQ1 [0,2,0,0,0,0|2,0,0]=4 4352 B11R1.23 BrCC(=O)c1cccc(c1)O 1P002QB4 [0,2,0,0,0,0|2,0,0]=4 4353 B11R1.23 BrCC(=O)c1cncc(c1)C 1P01ADIP [0,2,0,0,0,0|1,0,0]=3 4354 B11R1.23 BrCC(=O)c1cncc(c1)F 1P01BALC [0,2,0,0,0,0|1,0,0]=3 4355 B11R1.23 C#CC(=O)c1cccc(c1)Cl 1P01JMOI [0,2,0,0,0,0|2,0,0]=4 4356 B11R1.23 CCC(=O)c1cccc(c1)Br 1P002BVT [0,2,0,0,0,0|2,0,0]=4 4357 B11R1.23 CCC(=O)c1cccc(c1)C 1P003SLJ [0,2,0,0,0,0|2,0,0]=4 4358 B11R1.23 CCC(=O)c1cccc(c1)Cl 1P003J94 [0,2,0,0,0,0|2,0,0]=4 4359 B11R1.23 CCC(=O)c1cccc(c1)F 1P00I8ZC [0,2,0,0,0,0|2,0,0]=4 4360 B11R1.23 CCC(=O)c1cccc(c1)N 1P000PXT [0,2,0,0,0,0|2,0,0]=4 4361 B11R1.23 CCC(=O)c1cccc(c1)O 1P0038C9 [0,2,0,0,0,0|2,0,0]=4 4362 B11R1.23 CCC(=O)c1cncc(c1)F 1P01JV5B [0,2,0,0,0,0|1,0,0]=3 4363 B11R1.23 CNC(=O)c1cc(Br)ccn1 1P00HGA7 [0,2,0,0,0,0|2,0,0]=4 4364 B11R1.23 CNC(=O)c1cc(Cl)ccn1 1P004C7I [0,2,0,0,0,0|2,0,0]=4 4365 B11R1.23 CNC(=O)c1cc(O)ccn1 1P00EKGX [0,2,0,0,0,0|2,0,0]=4 4366 B11R1.23 CNC(=O)c1cccc(c1)Br 1P00DASY [0,2,0,0,0,0|1,0,0]=3 4367 B11R1.23 CNC(=O)c1cccc(c1)I 1P00H50M [0,2,0,0,0,0|1,0,0]=3 4368 B11R1.23 CNC(=O)c1cccc(c1)N 1P006VNV [0,2,0,0,0,0|1,0,0]=3 4369 B11R1.23 CNC(=O)c1cccc(c1)O 1P001Q9H [0,2,0,0,0,0|1,0,0]=3 4370 B11R1.23 CNC(=O)c1cccc(n1)Cl 1P00IDUM [0,2,0,0,0,0|2,0,0]=4 4371 B11R1.23 CNC(=O)c1cccc(n1)N 1P01AJIA [0,2,0,0,0,0|2,0,0]=4 4372 B11R1.23 CNC(=O)c1ccnc(c1)Br 1P00C0NQ [0,2,0,0,0,0|2,0,0]=4 4373 B11R1.23 CNC(=O)c1ccnc(c1)Cl 1P000WLT [0,2,0,0,0,0|2,0,0]=4 4374 B11R1.23 CNC(=O)c1ccnc(c1)F 1P01AI6V [0,2,0,0,0,0|2,0,0]=4 4375 B11R1.23 CNC(=O)c1ccnc(c1)N 1P01AD5B [0,2,0,0,0,0|2,0,0]=4 4376 B11R1.23 CNC(=O)c1cncc(c1)Br 1P00AMUD [0,2,0,0,0,0|0,0,0]=2 4377 B11R1.23 COC(=O)c1cc(Cl)cnn1 1P028VG8 [0,2,0,0,0,0|2,0,0]=4 4378 B11R1.23 COC(=O)c1cc(N)cnn1 1P028B9M [0,2,0,0,0,0|2,0,0]=4 4379 B11R1.23 COC(=O)c1cc(O)cnn1 1P028JOF [0,2,0,0,0,0|2,0,0]=4 4380 B11R1.23 COC(=O)c1ccc[n+](c1)C 1P01PWD3 [0,2,0,0,0,0|1,0,1]=4 4381 B11R1.23 COC(=O)c1ccc[n+](c1)[O-] 1P001QWT [0,2,0,0,0,0|1,0,1]=4 4382 B11R1.23 COC(=O)c1cccc(c1)Br 1P0036DA [0,2,0,0,0,0|2,0,0]=4 4383 B11R1.23 COC(=O)c1cccc(c1)C 1P003S9P [0,2,0,0,0,0|2,0,0]=4 4384 B11R1.23 COC(=O)c1cccc(c1)Cl 1P002XO2 [0,2,0,0,0,0|2,0,0]=4 4385 B11R1.23 COC(=O)c1cccc(c1)F 1P003S8W [0,2,0,0,0,0|2,0,0]=4 4386 B11R1.23 COC(=O)c1cccc(c1)I 1P0035NN [0,2,0,0,0,0|2,0,0]=4 4387 B11R1.23 COC(=O)c1cccc(c1)N 1P004OIR [0,2,0,0,0,0|2,0,0]=4 4388 B11R1.23 COC(=O)c1cccc(c1)N 1P00DEZP [0,2,0,0,0,0|2,0,0]=4 4389 B11R1.23 COC(=O)c1cccc(c1)O 1P003S93 [0,2,0,0,0,0|2,0,0]=4 4390 B11R1.23 COC(=O)c1cccc(c1)S 1P0060DS [0,2,0,0,0,0|2,0,0]=4 4391 B11R1.23 COC(=O)c1cn[nH]c(=O)c1 1P003WOS [0,2,0,0,0,0|2,0,0]=4 4392 B11R1.23 COC(=O)c1cncc(c1)Br 1P002ZK4 [0,2,0,0,0,0|1,0,0]=3 4393 B11R1.23 COC(=O)c1cncc(c1)C 1P002ZK3 [0,2,0,0,0,0|1,0,0]=3 4394 B11R1.23 COC(=O)c1cncc(c1)Cl 1P00D9EZ [0,2,0,0,0,0|1,0,0]=3 4395 B11R1.23 COC(=O)c1cncc(c1)F 1P006ZZC [0,2,0,0,0,0|1,0,0]=3 4396 B11R1.23 COC(=O)c1cncc(c1)I 1P00IX72 [0,2,0,0,0,0|1,0,0]=3 4397 B11R1.23 COC(=O)c1cncc(c1)N 1P003SDR [0,2,0,0,0,0|1,0,0]=3 4398 B11R1.23 COC(=O)c1cncc(c1)N 1P009305 [0,2,0,0,0,0|1,0,0]=3 4399 B11R1.23 COC(=O)c1cncc(c1)O 1P0031P8 [0,2,0,0,0,0|1,0,0]=3 4400 B11R1.23 COC(=O)c1cncc(c1)O 1P003SEK [0,2,0,0,0,0|1,0,0]=3 4401 B11R1.23 COC(=O)c1cncc(n1)Br 1P003AB7 [0,2,0,0,0,0|2,0,0]=4 4402 B11R1.23 COC(=O)c1cncc(n1)C 1P003SFC [0,2,0,0,0,0|2,0,0]=4 4403 B11R1.23 COC(=O)c1cncc(n1)Cl 1P002ODE [0,2,0,0,0,0|2,0,0]=4 4404 B11R1.23 COC(=O)c1cncc(n1)I 1P01DUA0 [0,2,0,0,0,0|2,0,0]=4 4405 B11R1.23 COC(=O)c1cncc(n1)N 1P00819U [0,2,0,0,0,0|2,0,0]=4 4406 B11R1.23 COC(=O)c1cnnc(c1)Br 1P0284KE [0,2,0,0,0,0|2,0,0]=4 4407 B11R1.23 COC(=O)c1cnnc(c1)Cl 1P0035P1 [0,2,0,0,0,0|2,0,0]=4 4408 B11R1.23 COC(=O)c1nncc(c1)C 1P0026U4 [0,2,0,0,0,0|2,0,0]=4 4409 B11R1.23 Cc1cccc(n1)C(=O)NN 1P01BHCA [0,2,0,0,0,0|2,0,0]=4 4410 B11R1.23 ClCC(=O)c1cccc(c1)Cl 1P0033EC [0,2,0,0,0,0|2,0,0]=4 4411 B11R1.23 ClCC(=O)c1cccc(c1)F 1P00DFJY [0,2,0,0,0,0|2,0,0]=4 4412 B11R1.23 FCC(=O)c1cccc(c1)Br 1P01AFMC [0,2,0,0,0,0|2,0,0]=4 4413 B11R1.23 FCC(=O)c1cccc(c1)F 1P01EKBY [0,2,0,0,0,0|2,0,0]=4 4414 B11R1.23 ICC(=O)c1cccc(c1)F 1P01EMEE [0,2,0,0,0,0|2,0,0]=4 4415 B11R1.23 N#CC(=O)c1cccc(c1)Br 1P002QL4 [0,2,0,0,0,0|1,0,1]=4 4416 B11R1.23 N#CC(=O)c1cccc(c1)Cl 1P002SCL [0,2,0,0,0,0|1,0,1]=4 4417 B11R1.23 NCC(=C)c1cccc(c1)F 1P028B4A [0,2,0,0,0,0|2,0,0]=4 4418 B11R1.23 NCC(=O)c1cccc(c1)Br 1P003GTW [0,2,0,0,0,0|1,0,0]=3 4419 B11R1.23 NCC(=O)c1cccc(c1)C 1P005GME [0,2,0,0,0,0|1,0,0]=3 4420 B11R1.23 NCC(=O)c1cccc(c1)Cl 1P00DB0W [0,2,0,0,0,0|1,0,0]=3 4421 B11R1.23 NCC(=O)c1cccc(c1)F 1P006IWV [0,2,0,0,0,0|1,0,0]=3 4422 B11R1.23 NCC(=O)c1cccc(c1)O 1P00AUN3 [0,2,0,0,0,0|1,0,0]=3 4423 B11R1.23 NCC(=O)c1cncc(c1)Br 1P01C0ZN [0,2,0,0,0,0|0,0,0]=2 4424 B11R1.23 NCC(=O)c1cncc(c1)O 1P01EMWF [0,2,0,0,0,0|0,0,0]=2 4425 B11R1.23 NN=C(c1cccc(c1)O)C 1P00EN2Y [0,2,0,0,0,0|2,0,0]=4 4426 B11R1.23 NNC(=O)c1cc(Cl)ccn1 1P005Y20 [0,2,0,0,0,0|2,0,0]=4 4427 B11R1.23 NNC(=O)c1cc[nH]c(=O)c1 1P006A1O [0,2,0,0,0,0|2,0,0]=4 4428 B11R1.23 NNC(=O)c1cccc(=O)[nH]1 1P005ZUE [0,2,0,0,0,0|2,0,0]=4 4429 B11R1.23 NNC(=O)c1cccc(c1)Br 1P00343D [0,2,0,0,0,0|1,0,0]=3 4430 B11R1.23 NNC(=O)c1cccc(c1)C 1P000UZ8 [0,2,0,0,0,0|1,0,0]=3 4431 B11R1.23 NNC(=O)c1cccc(c1)Cl 1P001XQZ [0,2,0,0,0,0|1,0,0]=3 4432 B11R1.23 NNC(=O)c1cccc(c1)F 1P003JXU [0,2,0,0,0,0|1,0,0]=3 4433 B11R1.23 NNC(=O)c1cccc(c1)I 1P00C0X7 [0,2,0,0,0,0|1,0,0]=3 4434 B11R1.23 NNC(=O)c1cccc(c1)N 1P001D1X [0,2,0,0,0,0|1,0,0]=3 4435 B11R1.23 NNC(=O)c1cccc(c1)O 1P003K0Y [0,2,0,0,0,0|1,0,0]=3 4436 B11R1.23 NNC(=O)c1cccc(n1)Cl 1P01B6R8 [0,2,0,0,0,0|2,0,0]=4 4437 B11R1.23 NNC(=O)c1cccc(n1)F 1P01B7L7 [0,2,0,0,0,0|2,0,0]=4 4438 B11R1.23 NNC(=O)c1cccc(n1)N 1P00E1II [0,2,0,0,0,0|2,0,0]=4 4439 B11R1.23 NNC(=O)c1ccnc(c1)Cl 1P00EAEV [0,2,0,0,0,0|2,0,0]=4 4440 B11R1.23 NNC(=O)c1ccnc(c1)N 1P00IAUS [0,2,0,0,0,0|2,0,0]=4 4441 B11R1.23 NNC(=O)c1cncc(c1)Br 1P007UJ4 [0,2,0,0,0,0|0,0,0]=2 4442 B11R1.23 NNC(=O)c1cncc(c1)C 1P00GAT4 [0,2,0,0,0,0|0,0,0]=2 4443 B11R1.23 NNC(=O)c1cncc(c1)F 1P005LLG [0,2,0,0,0,0|0,0,0]=2 4444 B11R1.23 O=CC(=O)c1cccc(c1)Br 1P008UX1 [0,2,0,0,0,0|2,0,0]=4 4445 B11R1.23 O=CC(=O)c1cccc(c1)Br 1P019ED3 [0,2,0,0,0,0|2,0,0]=4 4446 B11R1.23 O=CC(=O)c1cccc(c1)F 1P003JYD [0,2,0,0,0,0|2,0,0]=4 4447 B11R1.23 O=CC(=O)c1cccc(c1)O 1P01BGS8 [0,2,0,0,0,0|2,0,0]=4 4448 B11R1.23 OCC(=C)c1cncc(c1)C 1P027W9R [0,2,0,0,0,0|1,0,1]=4 4449 B11R1.23 OCC(=C)c1cncc(c1)F 1P028FCO [0,2,0,0,0,0|1,0,1]=4 4450 B11R1.23 OCC(=O)c1cccc(c1)Br 1P01AM0T [0,2,0,0,0,0|2,0,0]=4 4451 B11R1.23 OCC(=O)c1cccc(c1)Cl 1P01DFA2 [0,2,0,0,0,0|2,0,0]=4 4452 B11R1.23 OCC(=O)c1cccc(c1)F 1P00BQED [0,2,0,0,0,0|2,0,0]=4 4453 B11R1.23 OCC(c1cncc(c1)Br)N 1P01XCYH [0,2,0,0,0,0|0,0,2]=4 4454 B11R1.23 OC[C@@H](c1cncc(c1)Br)N 1P028AJT [0,2,0,0,0,0|0,0,2]=4 4455 B11R1.23 OC[C@H](c1cncc(c1)Br)N 1P028AP8 [0,2,0,0,0,0|0,0,2]=4 4456 B11R1.23 ON=C(c1cncc(c1)F)N 1P0289N9 [0,2,0,0,0,0|0,0,1]=3 4457 B11R1.23 ONC(=N)c1cccc(c1)Br 1P001ZBX [0,2,0,0,0,0|2,0,0]=4 4458 B11R1.23 ONC(=N)c1cccc(c1)Cl 1P00709P [0,2,0,0,0,0|2,0,0]=4 4459 B11R1.23 ONC(=N)c1cccc(c1)N 1P0002PV [0,2,0,0,0,0|2,0,0]=4 4460 B11R1.23 ONC(=N)c1cncc(c1)O 1P028DXK [0,2,0,0,0,0|1,0,0]=3 4461 B11R1.23 ONC(=O)c1cccc(c1)Br 1P002RKV [0,2,0,0,0,0|1,0,0]=3 4462 B11R1.23 ONC(=O)c1cccc(c1)O 1P001SJP [0,2,0,0,0,0|1,0,0]=3 4463 B11R1.23 O\N=C(/c1ccc[n+](c1)[O-])\N 1P006EUN [0,2,0,0,0,0|0,0,2]=4 4464 B11R1.23 O\N=C(/c1cccc(c1)F)\N 1P00DCNS [0,2,0,0,0,0|1,0,1]=4 4465 B11R1.23 O\N=C(\c1cccc(c1)Br)/N 1P00AXMC [0,2,0,0,0,0|1,0,1]=4 4466 B11R1.23 O\N=C(\c1cccc(c1)C)/N 1P003TJ3 [0,2,0,0,0,0|1,0,1]=4 4467 B11R1.23 O\N=C(\c1cccc(c1)F)/N 1P009XAY [0,2,0,0,0,0|1,0,1]=4 4468 B11R1.222 BrCC(=O)c1ccc[nH]c1=O 1P00BU7Z [0,2,0,0,0,0|1,0,1]=4 4469 B11R1.222 BrCC(=O)c1ccccc1Br 1P00DAWM [0,2,0,0,0,0|2,0,0]=4 4470 B11R1.222 BrCC(=O)c1ccccc1C 1P00DEAM [0,2,0,0,0,0|2,0,0]=4 4471 B11R1.222 BrCC(=O)c1ccccc1Cl 1P003H2D [0,2,0,0,0,0|2,0,0]=4 4472 B11R1.222 BrCC(=O)c1ccccc1F 1P003H2Z [0,2,0,0,0,0|2,0,0]=4 4473 B11R1.222 BrCC(=O)c1ccccc1O 1P002QB5 [0,2,0,0,0,0|2,0,0]=4 4474 B11R1.222 C#CC(=O)c1ccccc1Br 1P01P4JR [0,2,0,0,0,0|2,0,0]=4 4475 B11R1.222 C#CC(=O)c1ccccc1Cl 1P01JMOK [0,2,0,0,0,0|2,0,0]=4 4476 B11R1.222 C=CC(=O)c1ccccc1F 1P003WYY [0,2,0,0,0,0|2,0,0]=4 4477 B11R1.222 CCC(=O)c1ccccc1Br 1P00EK76 [0,2,0,0,0,0|2,0,0]=4 4478 B11R1.222 CCC(=O)c1ccccc1C 1P0029P4 [0,2,0,0,0,0|2,0,0]=4 4479 B11R1.222 CCC(=O)c1ccccc1Cl 1P00EB73 [0,2,0,0,0,0|2,0,0]=4 4480 B11R1.222 CCC(=O)c1ccccc1F 1P003DB2 [0,2,0,0,0,0|2,0,0]=4 4481 B11R1.222 CCC(=O)c1ccccc1N 1P000PPD [0,2,0,0,0,0|2,0,0]=4 4482 B11R1.222 CCC(=O)c1ccccc1O 1P003BP5 [0,2,0,0,0,0|2,0,0]=4 4483 B11R1.222 CCC(=O)c1cnccc1N 1P01A5EL [0,2,0,0,0,0|1,0,0]=3 4484 B11R1.222 CCC(=O)c1cnccc1N 1P028XZG [0,2,0,0,0,0|1,0,0]=3 4485 B11R1.222 CNC(=N)c1ccccc1Cl 1P01BA7J [0,2,0,0,0,0|2,0,0]=4 4486 B11R1.222 CNC(=O)c1c[nH]ccc1=O 1P003SNT [0,2,0,0,0,0|0,0,1]=3 4487 B11R1.222 CNC(=O)c1ccccc1Br 1P00EAJD [0,2,0,0,0,0|1,0,0]=3 4488 B11R1.222 CNC(=O)c1ccccc1Cl 1P007ICE [0,2,0,0,0,0|1,0,0]=3 4489 B11R1.222 CNC(=O)c1ccccc1F 1P00DJ9S [0,2,0,0,0,0|1,0,0]=3 4490 B11R1.222 CNC(=O)c1ccccc1I 1P00IASP [0,2,0,0,0,0|1,0,0]=3 4491 B11R1.222 CNC(=O)c1ccccc1N 1P003H0C [0,2,0,0,0,0|1,0,0]=3 4492 B11R1.222 CNC(=O)c1ccccc1O 1P00AC9J [0,2,0,0,0,0|1,0,0]=3 4493 B11R1.222 CNC(=O)c1ccccc1S 1P002DAW [0,2,0,0,0,0|1,0,0]=3 4494 B11R1.222 CNC(=O)c1cccnc1Cl 1P00DJ9W [0,2,0,0,0,0|0,0,0]=2 4495 B11R1.222 CNC(=O)c1cccnc1N 1P004VCL [0,2,0,0,0,0|0,0,0]=2 4496 B11R1.222 CNC(=O)c1ccncc1N 1P01XD5J [0,2,0,0,0,0|2,0,0]=4 4497 B11R1.222 CNC(=O)c1cnccc1N 1P00H57Q [0,2,0,0,0,0|0,0,0]=2 4498 B11R1.222 CNC(=O)c1ncccc1F 1P01KLCK [0,2,0,0,0,0|2,0,0]=4 4499 B11R1.222 CNC(=O)c1ncccc1O 1P000PPB [0,2,0,0,0,0|2,0,0]=4 4500 B11R1.222 CNC(=O)c1nccnc1N 1P007BM3 [0,2,0,0,0,0|1,0,0]=3 4501 B11R1.222 CNC(c1cccnc1N)C 1P027TYU [0,2,0,0,0,0|1,0,1]=4 4502 B11R1.222 COC(=O)c1c[nH]ccc1=O 1P00FZ4E [0,2,0,0,0,0|1,0,1]=4 4503 B11R1.222 COC(=O)c1ccc[nH]c1=O 1P0004LA [0,2,0,0,0,0|1,0,1]=4 4504 B11R1.222 COC(=O)c1ccc[nH]c1=S 1P005BW3 [0,2,0,0,0,0|1,0,1]=4 4505 B11R1.222 COC(=O)c1ccccc1Br 1P0035MK [0,2,0,0,0,0|2,0,0]=4 4506 B11R1.222 COC(=O)c1ccccc1C 1P0036QP [0,2,0,0,0,0|2,0,0]=4 4507 B11R1.222 COC(=O)c1ccccc1Cl 1P003S46 [0,2,0,0,0,0|2,0,0]=4 4508 B11R1.222 COC(=O)c1ccccc1F 1P00I87W [0,2,0,0,0,0|2,0,0]=4 4509 B11R1.222 COC(=O)c1ccccc1I 1P0033TT [0,2,0,0,0,0|2,0,0]=4 4510 B11R1.222 COC(=O)c1ccccc1N 1P0035P7 [0,2,0,0,0,0|2,0,0]=4 4511 B11R1.222 COC(=O)c1ccccc1O 1P003SJ9 [0,2,0,0,0,0|2,0,0]=4 4512 B11R1.222 COC(=O)c1ccccc1S 1P0035PV [0,2,0,0,0,0|2,0,0]=4 4513 B11R1.222 COC(=O)c1cccnc1Br 1P00I9W4 [0,2,0,0,0,0|1,0,0]=3 4514 B11R1.222 COC(=O)c1cccnc1Cl 1P003S49 [0,2,0,0,0,0|1,0,0]=3 4515 B11R1.222 COC(=O)c1cccnc1F 1P00I8WP [0,2,0,0,0,0|1,0,0]=3 4516 B11R1.222 COC(=O)c1cccnc1N 1P001EOQ [0,2,0,0,0,0|1,0,0]=3 4517 B11R1.222 COC(=O)c1cccnc1O 1P0037A5 [0,2,0,0,0,0|1,0,0]=3 4518 B11R1.222 COC(=O)c1cccoc1=O 1P002RRT [0,2,0,0,0,0|2,0,0]=4 4519 B11R1.222 COC(=O)c1ccnnc1Cl 1P01Z9OO [0,2,0,0,0,0|2,0,0]=4 4520 B11R1.222 COC(=O)c1ccnnc1N 1P000OQZ [0,2,0,0,0,0|2,0,0]=4 4521 B11R1.222 COC(=O)c1cnccc1Br 1P007YLN [0,2,0,0,0,0|1,0,0]=3 4522 B11R1.222 COC(=O)c1cnccc1Br 1P01DDZN [0,2,0,0,0,0|1,0,0]=3 4523 B11R1.222 COC(=O)c1cnccc1Cl 1P006ZTR [0,2,0,0,0,0|1,0,0]=3 4524 B11R1.222 COC(=O)c1cnccc1F 1P0015DS [0,2,0,0,0,0|1,0,0]=3 4525 B11R1.222 COC(=O)c1cnccc1N 1P001SUN [0,2,0,0,0,0|1,0,0]=3 4526 B11R1.222 COC(=O)c1cnccc1O 1P00FAQW [0,2,0,0,0,0|1,0,0]=3 4527 B11R1.222 COC(=O)c1cnccc1S 1P028YCW [0,2,0,0,0,0|1,0,0]=3 4528 B11R1.222 COC(=O)c1cncnc1C 1P00AMKM [0,2,0,0,0,0|2,0,0]=4 4529 B11R1.222 COC(=O)c1cncnc1Cl 1P000MZ9 [0,2,0,0,0,0|2,0,0]=4 4530 B11R1.222 COC(=O)c1cncnc1N 1P00670W [0,2,0,0,0,0|2,0,0]=4 4531 B11R1.222 COC(=O)c1cncnc1O 1P0038AC [0,2,0,0,0,0|2,0,0]=4 4532 B11R1.222 COC(=O)c1cnncc1N 1P028U4I [0,2,0,0,0,0|2,0,0]=4 4533 B11R1.222 COC(=O)c1cnncc1O 1P01Q4UN [0,2,0,0,0,0|2,0,0]=4 4534 B11R1.222 COC(=O)c1nccnc1Br 1P0035NE [0,2,0,0,0,0|2,0,0]=4 4535 B11R1.222 COC(=O)c1nccnc1Cl 1P002VB8 [0,2,0,0,0,0|2,0,0]=4 4536 B11R1.222 COC(=O)c1nccnc1F 1P000S9J [0,2,0,0,0,0|2,0,0]=4 4537 B11R1.222 COC(=O)c1nccnc1I 1P001Z7M [0,2,0,0,0,0|2,0,0]=4 4538 B11R1.222 COC(=O)c1nccnc1N 1P001U23 [0,2,0,0,0,0|2,0,0]=4 4539 B11R1.222 Cc1ccncc1C(=C)CO 1P028FJU [0,2,0,0,0,0|1,0,1]=4 4540 B11R1.222 Cc1ccncc1C(=O)CBr 1P028ZS9 [0,2,0,0,0,0|1,0,0]=3 4541 B11R1.222 Cc1ccncc1C(=O)OC 1P00BZYE [0,2,0,0,0,0|1,0,0]=3 4542 B11R1.222 Cc1ccnnc1C(=O)OC 1P01P5OJ [0,2,0,0,0,0|2,0,0]=4 4543 B11R1.222 Cc1cnncc1C(=O)OC 1P00127C [0,2,0,0,0,0|2,0,0]=4 4544 B11R1.222 Cc1ncccc1C(=O)CBr 1P00EIIO [0,2,0,0,0,0|1,0,0]=3 4545 B11R1.222 Cc1ncccc1C(=O)CBr 1P01ANK5 [0,2,0,0,0,0|1,0,0]=3 4546 B11R1.222 Cc1ncccc1C(=O)NN 1P007RJ6 [0,2,0,0,0,0|0,0,0]=2 4547 B11R1.222 Cc1ncccc1C(=O)OC 1P003S5I [0,2,0,0,0,0|1,0,0]=3 4548 B11R1.222 Cc1nccnc1C(=O)NN 1P008603 [0,2,0,0,0,0|1,0,0]=3 4549 B11R1.222 Cc1nccnc1C(=O)OC 1P00C7EX [0,2,0,0,0,0|2,0,0]=4 4550 B11R1.222 ClCC(=O)c1ccccc1Cl 1P01A092 [0,2,0,0,0,0|2,0,0]=4 4551 B11R1.222 ClCC(=O)c1ccccc1F 1P00DE1J [0,2,0,0,0,0|2,0,0]=4 4552 B11R1.222 FCC(=O)c1ccccc1Br 1P009XTQ [0,2,0,0,0,0|2,0,0]=4 4553 B11R1.222 FCC(=O)c1ccccc1C 1P01DW8K [0,2,0,0,0,0|2,0,0]=4 4554 B11R1.222 FCC(=O)c1ccccc1F 1P001CNY [0,2,0,0,0,0|2,0,0]=4 4555 B11R1.222 FCC(=O)c1cccnc1Cl 1P027VJE [0,2,0,0,0,0|1,0,0]=3 4556 B11R1.222 N#CC(=O)c1ccccc1C 1P00EA75 [0,2,0,0,0,0|1,0,1]=4 4557 B11R1.222 N#CC(=O)c1ccccc1Cl 1P00BYZS [0,2,0,0,0,0|1,0,1]=4 4558 B11R1.222 N#CC(=O)c1ccccc1F 1P008NJP [0,2,0,0,0,0|1,0,1]=4 4559 B11R1.222 NC(=C1C=CC=NC1=O)NO 1P01A8D7 [0,2,0,0,0,0|0,0,1]=3 4560 B11R1.222 NCC(=C)c1ccccc1F 1P028BXM [0,2,0,0,0,0|2,0,0]=4 4561 B11R1.222 NCC(=O)c1ccccc1Br 1P01ALG9 [0,2,0,0,0,0|1,0,0]=3 4562 B11R1.222 NCC(=O)c1ccccc1C 1P00FC2T [0,2,0,0,0,0|1,0,0]=3 4563 B11R1.222 NCC(=O)c1ccccc1Cl 1P00AR76 [0,2,0,0,0,0|1,0,0]=3 4564 B11R1.222 NCC(=O)c1ccccc1F 1P00GW1J [0,2,0,0,0,0|1,0,0]=3 4565 B11R1.222 NCC(=O)c1ccccc1O 1P01C4S3 [0,2,0,0,0,0|1,0,0]=3 4566 B11R1.222 NCC(=O)c1cccnc1Cl 1P01BSJV [0,2,0,0,0,0|0,0,0]=2 4567 B11R1.222 NCC(=O)c1ncccc1Cl 1P01BS15 [0,2,0,0,0,0|2,0,0]=4 4568 B11R1.222 NNC(=O)c1ccccc1C 1P008QFS [0,2,0,0,0,0|1,0,0]=3 4569 B11R1.222 NNC(=O)c1ccccc1Cl 1P003HIC [0,2,0,0,0,0|1,0,0]=3 4570 B11R1.222 NNC(=O)c1ccccc1F 1P003HS4 [0,2,0,0,0,0|1,0,0]=3 4571 B11R1.222 NNC(=O)c1ccccc1F 1P01BGFD [0,2,0,0,0,0|1,0,0]=3 4572 B11R1.222 NNC(=O)c1ccccc1I 1P00BZLS [0,2,0,0,0,0|1,0,0]=3 4573 B11R1.222 NNC(=O)c1ccccc1N 1P002F0J [0,2,0,0,0,0|1,0,0]=3 4574 B11R1.222 NNC(=O)c1ccccc1O 1P003UND [0,2,0,0,0,0|1,0,0]=3 4575 B11R1.222 NNC(=O)c1ccncc1C 1P0024WL [0,2,0,0,0,0|2,0,0]=4 4576 B11R1.222 NNC(=O)c1ccncc1Cl 1P01A7FE [0,2,0,0,0,0|2,0,0]=4 4577 B11R1.222 NNC(=O)c1ccncc1F 1P01ACMI [0,2,0,0,0,0|2,0,0]=4 4578 B11R1.222 NNC(=O)c1ccncc1N 1P00EE8K [0,2,0,0,0,0|2,0,0]=4 4579 B11R1.222 NNC(=O)c1cncnc1C 1P00J2Y6 [0,2,0,0,0,0|1,0,0]=3 4580 B11R1.222 NNC(=O)c1ncccc1C 1P01A2HW [0,2,0,0,0,0|2,0,0]=4 4581 B11R1.222 N\C(=N/O)\c1cccnc1Cl 1P00DQWH [0,2,0,0,0,0|0,0,1]=3 4582 B11R1.222 Nc1ccncc1C(=O)NN 1P003ZHR [0,2,0,0,0,0|0,0,0]=2 4583 B11R1.222 Nc1ncccc1C(=O)NN 1P00E17H [0,2,0,0,0,0|0,0,0]=2 4584 B11R1.222 Nc1nccnc1C(=O)NN 1P005MEU [0,2,0,0,0,0|1,0,0]=3 4585 B11R1.222 O=CC(=O)c1ccccc1Br 1P01B92D [0,2,0,0,0,0|2,0,0]=4 4586 B11R1.222 O=CC(=O)c1ccccc1C 1P00EJ1Q [0,2,0,0,0,0|2,0,0]=4 4587 B11R1.222 O=CC(=O)c1ccccc1C 1P01XC2I [0,2,0,0,0,0|2,0,0]=4 4588 B11R1.222 OCC(=O)c1ccccc1Br 1P01DFAD [0,2,0,0,0,0|2,0,0]=4 4589 B11R1.222 OCC(=O)c1ccccc1Cl 1P003GQ7 [0,2,0,0,0,0|2,0,0]=4 4590 B11R1.222 ON=C(c1ccccc1Cl)N 1P00EB6R [0,2,0,0,0,0|1,0,1]=4 4591 B11R1.222 ON=C(c1ccccc1N)N 1P01EKJM [0,2,0,0,0,0|1,0,1]=4 4592 B11R1.222 ONC(=N)c1ccccc1Br 1P00116I [0,2,0,0,0,0|2,0,0]=4 4593 B11R1.222 ONC(=N)c1ccccc1F 1P01E6LV [0,2,0,0,0,0|2,0,0]=4 4594 B11R1.222 ONC(=N)c1ccccc1N 1P001UME [0,2,0,0,0,0|2,0,0]=4 4595 B11R1.222 ONC(=O)c1ccccc1Br 1P019UXX [0,2,0,0,0,0|1,0,0]=3 4596 B11R1.222 ONC(=O)c1ccccc1O 1P003UNE [0,2,0,0,0,0|1,0,0]=3 4597 B11R1.222 O\N=C(\c1ccccc1C)/N 1P003I58 [0,2,0,0,0,0|1,0,1]=4 4598 B11R1.222 O\N=C(\c1ccccc1F)/N 1P00G3DH [0,2,0,0,0,0|1,0,1]=4 4599 B11R1.87 Brc1ccccc1S(=O)(=N)N 1P0284W0 [0,2,0,0,0,0|2,0,0]=4 4600 B11R1.87 Brc1ccccc1S(=O)(=O)N 1P0061LW [0,2,0,0,0,0|2,0,0]=4 4601 B11R1.87 Brc1ncccc1S(=O)(=O)C 1P00J39M [0,2,0,0,0,0|2,0,0]=4 4602 B11R1.87 Brc1ncccc1S(=O)(=O)Cl 1P007ELH [0,2,0,0,0,0|2,0,0]=4 4603 B11R1.87 Brc1nccnc1S(=O)(=O)N 1P028B65 [0,2,0,0,0,0|2,0,0]=4 4604 B11R1.87 Cc1ccccc1S(=O)(=N)N 1P02850T [0,2,0,0,0,0|2,0,0]=4 4605 B11R1.87 Cc1ccccc1S(=O)(=N)N 1P02856S [0,2,0,0,0,0|2,0,0]=4 4606 B11R1.87 Cc1ccccc1S(=O)(=O)N 1P0033UV [0,2,0,0,0,0|2,0,0]=4 4607 B11R1.87 Cc1ccncc1S(=O)(=O)Cl 1P00I7T9 [0,2,0,0,0,0|2,0,0]=4 4608 B11R1.87 Cc1ccncc1S(=O)(=O)F 1P01EJCJ [0,2,0,0,0,0|2,0,0]=4 4609 B11R1.87 Cc1ccncc1S(=O)(=O)N 1P00DJV3 [0,2,0,0,0,0|1,0,0]=3 4610 B11R1.87 Cc1ccncc1S(=O)(=O)O 1P006YH1 [0,2,0,0,0,0|2,0,0]=4 4611 B11R1.87 Cc1ncccc1S(=O)(=O)Cl 1P027VRB [0,2,0,0,0,0|2,0,0]=4 4612 B11R1.87 Cc1ncccc1S(=O)(=O)F 1P028JFQ [0,2,0,0,0,0|2,0,0]=4 4613 B11R1.87 Cc1ncccc1S(=O)(=O)N 1P01B483 [0,2,0,0,0,0|1,0,0]=3 4614 B11R1.87 Cc1nccnc1S(=O)(=O)N 1P00H176 [0,2,0,0,0,0|2,0,0]=4 4615 B11R1.87 Clc1ccncc1S(=O)(=O)Cl 1P00383P [0,2,0,0,0,0|2,0,0]=4 4616 B11R1.87 Clc1ccncc1S(=O)(=O)F 1P0289G0 [0,2,0,0,0,0|2,0,0]=4 4617 B11R1.87 Clc1ccncc1S(=O)(=O)N 1P0034H2 [0,2,0,0,0,0|1,0,0]=3 4618 B11R1.87 Clc1ccncc1S(=O)(=O)O 1P00DFFJ [0,2,0,0,0,0|2,0,0]=4 4619 B11R1.87 Clc1ncccc1S(=O)(=O)C 1P00FUUV [0,2,0,0,0,0|2,0,0]=4 4620 B11R1.87 Clc1ncccc1S(=O)(=O)Cl 1P00FAN8 [0,2,0,0,0,0|2,0,0]=4 4621 B11R1.87 Clc1ncccc1S(=O)(=O)N 1P00C95T [0,2,0,0,0,0|1,0,0]=3 4622 B11R1.87 Clc1nccnc1S(=O)(=O)N 1P028XOA [0,2,0,0,0,0|2,0,0]=4 4623 B11R1.87 Fc1ccccc1S(=O)(=O)N 1P00BC5A [0,2,0,0,0,0|2,0,0]=4 4624 B11R1.87 Fc1ccncc1S(=O)(=O)F 1P028HEH [0,2,0,0,0,0|2,0,0]=4 4625 B11R1.87 Fc1ncccc1P(=O)(C)C 1P0287U9 [0,2,0,0,0,0|2,0,0]=4 4626 B11R1.87 Fc1ncccc1S(=O)(=O)Cl 1P01C55B [0,2,0,0,0,0|2,0,0]=4 4627 B11R1.87 Ic1ccccc1S(=O)(=O)N 1P00E459 [0,2,0,0,0,0|2,0,0]=4 4628 B11R1.87 Nc1ccccc1S(=O)(=O)N 1P00384C [0,2,0,0,0,0|2,0,0]=4 4629 B11R1.87 Nc1ccncc1P(=O)(C)C 1P01XCIL [0,2,0,0,0,0|2,0,0]=4 4630 B11R1.87 Nc1ccncc1S(=O)(=O)C 1P01BT0M [0,2,0,0,0,0|2,0,0]=4 4631 B11R1.87 Nc1ccncc1S(=O)(=O)N 1P005TSZ [0,2,0,0,0,0|1,0,0]=3 4632 B11R1.87 Nc1ncccc1P(=O)(C)C 1P01XCHJ [0,2,0,0,0,0|2,0,0]=4 4633 B11R1.87 Nc1ncccc1S(=O)(=O)C 1P01DU2P [0,2,0,0,0,0|2,0,0]=4 4634 B11R1.87 Nc1ncccc1S(=O)(=O)N 1P00E4DD [0,2,0,0,0,0|1,0,0]=3 4635 B11R1.87 Oc1ccccc1S(=O)(=O)N 1P00CMKX [0,2,0,0,0,0|2,0,0]=4 4636 B11R1.87 Oc1ccncc1S(=O)(=O)O 1P003M0I [0,2,0,0,0,0|2,0,0]=4 4637 B11R1.87 Oc1ncccc1S(=O)(=O)Cl 1P01B3YZ [0,2,0,0,0,0|2,0,0]=4 4638 B11R1.87 Oc1ncccc1S(=O)(=O)F 1P0292AZ [0,2,0,0,0,0|2,0,0]=4 4639 B11R1.87 Oc1ncccc1S(=O)(=O)N 1P01B3YY [0,2,0,0,0,0|1,0,0]=3 4640 B11R1.155 Brc1cccc(c1)S(=O)(=O)N 1P003JKR [0,2,0,0,0,0|2,0,0]=4 4641 B11R1.155 Brc1cncc(c1)S(=O)(=O)C 1P00DAT4 [0,2,0,0,0,0|2,0,0]=4 4642 B11R1.155 Brc1cncc(c1)S(=O)(=O)Cl 1P00EAAV [0,2,0,0,0,0|2,0,0]=4 4643 B11R1.155 Brc1cncc(c1)S(=O)(=O)F 1P024VNO [0,2,0,0,0,0|2,0,0]=4 4644 B11R1.155 Brc1cncc(c1)S(=O)(=O)N 1P00EC3K [0,2,0,0,0,0|1,0,0]=3 4645 B11R1.155 Brc1cncc(c1)S(=O)(=O)O 1P00EC3L [0,2,0,0,0,0|2,0,0]=4 4646 B11R1.155 CC(c1cncc(c1)F)(N)C 1P02089A [0,2,0,0,0,0|1,0,1]=4 4647 B11R1.155 Cc1cccc(c1)S(=O)(=O)N 1P002ELF [0,2,0,0,0,0|2,0,0]=4 4648 B11R1.155 Cc1cncc(c1)S(=O)(=O)Cl 1P01A05Y [0,2,0,0,0,0|2,0,0]=4 4649 B11R1.155 Cc1cncc(c1)S(=O)(=O)F 1P028H50 [0,2,0,0,0,0|2,0,0]=4 4650 B11R1.155 Cc1cncc(c1)S(=O)(=O)N 1P00H0LF [0,2,0,0,0,0|1,0,0]=3 4651 B11R1.155 Cc1cncc(c1)S(=O)(=O)O 1P00DEUN [0,2,0,0,0,0|2,0,0]=4 4652 B11R1.155 Clc1cccc(c1)S(=O)(=O)N 1P003JR1 [0,2,0,0,0,0|2,0,0]=4 4653 B11R1.155 Clc1cncc(c1)P(=O)(C)C 1P0286MT [0,2,0,0,0,0|2,0,0]=4 4654 B11R1.155 Clc1cncc(c1)S(=O)(=O)Cl 1P008UTL [0,2,0,0,0,0|2,0,0]=4 4655 B11R1.155 Clc1cncc(c1)S(=O)(=O)N 1P01AKIZ [0,2,0,0,0,0|1,0,0]=3 4656 B11R1.155 Fc1cccc(c1)S(=O)(=O)N 1P003466 [0,2,0,0,0,0|2,0,0]=4 4657 B11R1.155 Fc1cncc(c1)P(=O)(C)C 1P028ETO [0,2,0,0,0,0|2,0,0]=4 4658 B11R1.155 Fc1cncc(c1)S(=O)(=O)Cl 1P008WZE [0,2,0,0,0,0|2,0,0]=4 4659 B11R1.155 Ic1cccc(c1)S(=O)(=O)N 1P00DZEG [0,2,0,0,0,0|2,0,0]=4 4660 B11R1.155 Nc1cccc(c1)S(=O)(=O)N 1P005WMQ [0,2,0,0,0,0|2,0,0]=4 4661 B11R1.155 Nc1cncc(c1)P(=O)(C)C 1P01XDIE [0,2,0,0,0,0|2,0,0]=4 4662 B11R1.155 Nc1cncc(c1)S(=O)(=O)C 1P0094M5 [0,2,0,0,0,0|2,0,0]=4 4663 B11R1.155 Nc1cncc(c1)S(=O)(=O)F 1P01BCNE [0,2,0,0,0,0|2,0,0]=4 4664 B11R1.155 O=S(C1=CC(C)=CN=C1)(Cl)=O 1P01KJV4 [0,2,0,0,0,0|2,0,0]=4 4665 B11R1.155 Oc1cccc(c1)S(=O)(=O)N 1P002JM0 [0,2,0,0,0,0|2,0,0]=4 4666 B11R1.53 BrCc1ccccc1C(=O)O 1P003FGO [0,2,0,0,0,0|2,0,0]=4 4667 B11R1.53 BrCc1ncccc1[N+](=O)[O-] 1P002J2E [0,2,0,0,0,0|2,0,0]=4 4668 B11R1.53 C#Cc1ccccc1C(=O)C 1P0095DR [0,2,0,0,0,0|2,0,0]=4 4669 B11R1.53 C#Cc1ccccc1C(=O)O 1P00C16W [0,2,0,0,0,0|2,0,0]=4 4670 B11R1.53 C=Cc1ccccc1C(=O)C 1P00DTOA [0,2,0,0,0,0|2,0,0]=4 4671 B11R1.53 CCc1ccccc1C(=O)C 1P0039TF [0,2,0,0,0,0|2,0,0]=4 4672 B11R1.53 CCc1ccccc1C(=O)N 1P006JB8 [0,2,0,0,0,0|1,0,0]=3 4673 B11R1.53 CCc1ccccc1C(=O)O 1P0036IN [0,2,0,0,0,0|2,0,0]=4 4674 B11R1.53 CCc1ccncc1C(=O)O 1P00E364 [0,2,0,0,0,0|1,0,0]=3 4675 B11R1.53 CCc1ncccc1C(=O)O 1P003KCW [0,2,0,0,0,0|1,0,0]=3 4676 B11R1.53 CCc1ncccc1C(=O)O 1P028FW1 [0,2,0,0,0,0|1,0,0]=3 4677 B11R1.53 CCc1nccnc1C(=O)C 1P003BMM [0,2,0,0,0,0|2,0,0]=4 4678 B11R1.53 CCc1nccnc1C(=O)O 1P0292OU [0,2,0,0,0,0|2,0,0]=4 4679 B11R1.53 CCc1ncncc1C(=O)O 1P019VM6 [0,2,0,0,0,0|2,0,0]=4 4680 B11R1.53 CNc1ccccc1C(=O)C 1P00AM66 [0,2,0,0,0,0|2,0,0]=4 4681 B11R1.53 CNc1ccccc1C(=O)N 1P005F2G [0,2,0,0,0,0|1,0,0]=3 4682 B11R1.53 CNc1ccccc1C(=O)O 1P000PGJ [0,2,0,0,0,0|2,0,0]=4 4683 B11R1.53 CNc1ccncc1[N+](=O)[O-] 1P001UH5 [0,2,0,0,0,0|2,0,0]=4 4684 B11R1.53 CNc1cnncc1C(=O)O 1P028GMI [0,2,0,0,0,0|2,0,0]=4 4685 B11R1.53 CNc1ncccc1C(=O)N 1P009T1Y [0,2,0,0,0,0|0,0,0]=2 4686 B11R1.53 CNc1ncccc1C(=O)O 1P00C64E [0,2,0,0,0,0|1,0,0]=3 4687 B11R1.53 CNc1ncccc1[N+](=O)[O-] 1P00C0LO [0,2,0,0,0,0|2,0,0]=4 4688 B11R1.53 COc1ccccc1C(=N)N 1P00AODY [0,2,0,0,0,0|2,0,0]=4 4689 B11R1.53 COc1ccccc1C(=N)N 1P00D8T7 [0,2,0,0,0,0|2,0,0]=4 4690 B11R1.53 COc1ccccc1C(=N)N 1P00EKGE [0,2,0,0,0,0|2,0,0]=4 4691 B11R1.53 COc1ccccc1C(=O)C 1P0032QL [0,2,0,0,0,0|2,0,0]=4 4692 B11R1.53 COc1ccccc1C(=O)Cl 1P003TWC [0,2,0,0,0,0|2,0,0]=4 4693 B11R1.53 COc1ccccc1C(=O)N 1P003I0E [0,2,0,0,0,0|1,0,0]=3 4694 B11R1.53 COc1ccccc1C(=O)O 1P0035VZ [0,2,0,0,0,0|2,0,0]=4 4695 B11R1.53 COc1ccccc1C(=S)N 1P003I1C [0,2,0,0,0,0|1,1,0]=4 4696 B11R1.53 COc1ccncc1C(=O)C 1P002FW4 [0,2,0,0,0,0|1,0,0]=3 4697 B11R1.53 COc1ccncc1C(=O)N 1P005ZJS [0,2,0,0,0,0|0,0,0]=2 4698 B11R1.53 COc1ccncc1C(=O)O 1P0005WN [0,2,0,0,0,0|1,0,0]=3 4699 B11R1.53 COc1ccncc1C(=S)N 1P0288JF [0,2,0,0,0,0|0,1,0]=3 4700 B11R1.53 COc1ccncc1[N+](=O)[O-] 1P007IMW [0,2,0,0,0,0|2,0,0]=4 4701 B11R1.53 COc1ccncc1[N+](=O)[O-] 1P00BYXZ [0,2,0,0,0,0|2,0,0]=4 4702 B11R1.53 COc1cnncc1C(=O)O 1P028UKL [0,2,0,0,0,0|2,0,0]=4 4703 B11R1.53 COc1ncccc1C(=O)C 1P00100M [0,2,0,0,0,0|1,0,0]=3 4704 B11R1.53 COc1ncccc1C(=O)N 1P0068DO [0,2,0,0,0,0|0,0,0]=2 4705 B11R1.53 COc1ncccc1C(=O)O 1P001VO2 [0,2,0,0,0,0|1,0,0]=3 4706 B11R1.53 COc1ncccc1C(=S)N 1P01AB2U [0,2,0,0,0,0|0,1,0]=3 4707 B11R1.53 COc1ncccc1C(N)C 1P0095O9 [0,2,0,0,0,0|1,0,1]=4 4708 B11R1.53 COc1ncccc1[N+](=O)[O-] 1P0038NN [0,2,0,0,0,0|2,0,0]=4 4709 B11R1.53 COc1nccnc1C(=N)N 1P028FTY [0,2,0,0,0,0|2,0,0]=4 4710 B11R1.53 COc1nccnc1C(=O)O 1P0038CU [0,2,0,0,0,0|2,0,0]=4 4711 B11R1.53 COc1ncncc1C(=O)O 1P003M5Q [0,2,0,0,0,0|2,0,0]=4 4712 B11R1.53 CSc1ccccc1C(=O)C 1P001JET [0,2,0,0,0,0|2,0,0]=4 4713 B11R1.53 CSc1ccccc1C(=O)O 1P003FK5 [0,2,0,0,0,0|2,0,0]=4 4714 B11R1.53 CSc1ncccc1C(=O)O 1P003FKD [0,2,0,0,0,0|1,0,0]=3 4715 B11R1.53 CSc1ncccc1[N+](=O)[O-] 1P00J8HQ [0,2,0,0,0,0|2,0,0]=4 4716 B11R1.53 CSc1nccnc1C(=O)O 1P01BU2C [0,2,0,0,0,0|2,0,0]=4 4717 B11R1.53 ClCc1ccccc1C(=O)Cl 1P00IMVP [0,2,0,0,0,0|2,0,0]=4 4718 B11R1.53 ClCc1ccccc1C(=O)O 1P008GQF [0,2,0,0,0,0|2,0,0]=4 4719 B11R1.53 FCc1ccccc1C(=O)O 1P01BCSG [0,2,0,0,0,0|2,0,0]=4 4720 B11R1.53 N#Cc1ccccc1C(=N)N 1P00I8PO [0,2,0,0,0,0|2,0,0]=4 4721 B11R1.53 N#Cc1ccccc1C(=O)C 1P00GS4B [0,2,0,0,0,0|2,0,0]=4 4722 B11R1.53 N#Cc1ccccc1C(=O)N 1P003HKW [0,2,0,0,0,0|1,0,0]=3 4723 B11R1.53 N#Cc1ccccc1C(=O)O 1P0033QN [0,2,0,0,0,0|2,0,0]=4 4724 B11R1.53 N#Cc1ccncc1C(=O)O 1P004YLB [0,2,0,0,0,0|1,0,0]=3 4725 B11R1.53 N#Cc1ncccc1C(=C)C 1P01KLAG [0,2,0,0,0,0|2,0,0]=4 4726 B11R1.53 N#Cc1ncccc1C(=O)O 1P0038XD [0,2,0,0,0,0|1,0,0]=3 4727 B11R1.53 N#Cc1ncccc1[N+](=O)[O-] 1P00I9NM [0,2,0,0,0,0|2,0,0]=4 4728 B11R1.53 NCc1ccccc1C(=O)O 1P0001MC [0,2,0,0,0,0|2,0,0]=4 4729 B11R1.53 NCc1ncccc1C(=O)O 1P01FIWH [0,2,0,0,0,0|1,0,0]=3 4730 B11R1.53 NNc1ccccc1C(=O)N 1P01BDPR [0,2,0,0,0,0|1,0,0]=3 4731 B11R1.53 NNc1ccccc1C(=O)O 1P0033SQ [0,2,0,0,0,0|2,0,0]=4 4732 B11R1.53 NNc1ccncc1[N+](=O)[O-] 1P007FET [0,2,0,0,0,0|2,0,0]=4 4733 B11R1.53 NNc1ncccc1[N+](=O)[O-] 1P00AQ02 [0,2,0,0,0,0|2,0,0]=4 4734 B11R1.53 O=Cc1ccccc1C(=O)C 1P003GRZ [0,2,0,0,0,0|2,0,0]=4 4735 B11R1.53 O=Cc1ccccc1C(=O)N 1P004GQ3 [0,2,0,0,0,0|1,0,0]=3 4736 B11R1.53 O=Cc1ccccc1C(=O)O 1P000PGK [0,2,0,0,0,0|2,0,0]=4 4737 B11R1.53 O=Cc1ccncc1C(=C)C 1P0285OX [0,2,0,0,0,0|2,0,0]=4 4738 B11R1.53 O=Cc1ccncc1[N+](=O)[O-] 1P0022DU [0,2,0,0,0,0|2,0,0]=4 4739 B11R1.53 O=Cc1ccncc1[N+](=O)[O-] 1P00APZF [0,2,0,0,0,0|2,0,0]=4 4740 B11R1.53 O=Cc1ncccc1C(=O)O 1P002O9P [0,2,0,0,0,0|1,0,0]=3 4741 B11R1.53 O=Cc1ncccc1[N+](=O)[O-] 1P0008DF [0,2,0,0,0,0|2,0,0]=4 4742 B11R1.53 O=[I]c1ccccc1C(=O)O 1P0030GH [0,2,0,0,0,0|2,0,0]=4 4743 B11R1.53 OCc1ccccc1C(=O)N 1P00D1PU [0,2,0,0,0,0|1,0,0]=3 4744 B11R1.53 OCc1cccnc1C(=O)N 1P009V80 [0,2,0,0,0,0|2,0,0]=4 4745 B11R1.53 OCc1ncccc1C(=O)N 1P0091ZS [0,2,0,0,0,0|0,0,0]=2 4746 B11R1.53 OCc1ncccc1C(=O)[O-] 1P01EMT9 [0,2,0,0,0,0|1,0,0]=3 4747 B11R1.53 OCc1ncccc1N(=O)=O 1P00I7PY [0,2,0,0,0,0|2,0,0]=4 4748 B11R1.53 OCc1nccnc1C(=O)N 1P01DWVB [0,2,0,0,0,0|1,0,0]=3 4749 B11R1.156 CC(=O)c1c(Br)cccc1Br 1P028AUP [0,2,0,0,0,0|2,0,0]=4 4750 B11R1.156 CC(=O)c1c(Br)ccnc1F 1P027XPG [0,2,0,0,0,0|1,0,0]=3 4751 B11R1.156 CC(=O)c1c(C)cccc1C 1P00I4LM [0,2,0,0,0,0|2,0,0]=4 4752 B11R1.156 CC(=O)c1c(C)cccc1F 1P0015D6 [0,2,0,0,0,0|2,0,0]=4 4753 B11R1.156 CC(=O)c1c(C)cccc1N 1P00CLH2 [0,2,0,0,0,0|2,0,0]=4 4754 B11R1.156 CC(=O)c1c(C)cccc1O 1P00CN54 [0,2,0,0,0,0|2,0,0]=4 4755 B11R1.156 CC(=O)c1c(Cl)cccc1Br 1P000S75 [0,2,0,0,0,0|2,0,0]=4 4756 B11R1.156 CC(=O)c1c(Cl)cccc1Cl 1P0029P7 [0,2,0,0,0,0|2,0,0]=4 4757 B11R1.156 CC(=O)c1c(Cl)ccnc1Br 1P01KKP2 [0,2,0,0,0,0|1,0,0]=3 4758 B11R1.156 CC(=O)c1c(Cl)ccnc1Cl 1P000MYH [0,2,0,0,0,0|1,0,0]=3 4759 B11R1.156 CC(=O)c1c(Cl)ncnc1Cl 1P00IN3X [0,2,0,0,0,0|2,0,0]=4 4760 B11R1.156 CC(=O)c1c(F)cccc1Br 1P003780 [0,2,0,0,0,0|2,0,0]=4 4761 B11R1.156 CC(=O)c1c(F)cccc1Cl 1P0032Z0 [0,2,0,0,0,0|2,0,0]=4 4762 B11R1.156 CC(=O)c1c(F)cccc1F 1P0012PF [0,2,0,0,0,0|2,0,0]=4 4763 B11R1.156 CC(=O)c1c(F)ccnc1Cl 1P028THW [0,2,0,0,0,0|1,0,0]=3 4764 B11R1.156 CC(=O)c1c(F)ccnc1F 1P028NU3 [0,2,0,0,0,0|1,0,0]=3 4765 B11R1.156 CC(=O)c1c(N)cccc1Br 1P00IAFF [0,2,0,0,0,0|2,0,0]=4 4766 B11R1.156 CC(=O)c1c(N)cccc1Cl 1P002KG8 [0,2,0,0,0,0|2,0,0]=4 4767 B11R1.156 CC(=O)c1c(N)cccc1F 1P00IERD [0,2,0,0,0,0|2,0,0]=4 4768 B11R1.156 CC(=O)c1c(N)ccnc1Cl 1P01K20E [0,2,0,0,0,0|1,0,0]=3 4769 B11R1.156 CC(=O)c1c(O)cccc1Br 1P00DIC5 [0,2,0,0,0,0|2,0,0]=4 4770 B11R1.156 CC(=O)c1c(O)cccc1Cl 1P003AA6 [0,2,0,0,0,0|2,0,0]=4 4771 B11R1.156 CC(=O)c1c(O)cccc1F 1P003HRI [0,2,0,0,0,0|2,0,0]=4 4772 B11R1.156 CC(=O)c1c(O)cccc1O 1P0033IE [0,2,0,0,0,0|2,0,0]=4 4773 B11R1.156 ClC(=O)c1c(C)cccc1C 1P006Z60 [0,2,0,0,0,0|2,0,0]=4 4774 B11R1.156 ClC(=O)c1c(C)cccc1Cl 1P003HHJ [0,2,0,0,0,0|2,0,0]=4 4775 B11R1.156 ClC(=O)c1c(C)cccc1F 1P00D9F9 [0,2,0,0,0,0|2,0,0]=4 4776 B11R1.156 ClC(=O)c1c(Cl)cccc1Cl 1P003GK0 [0,2,0,0,0,0|2,0,0]=4 4777 B11R1.156 ClC(=O)c1c(F)cccc1Br 1P0006ZV [0,2,0,0,0,0|2,0,0]=4 4778 B11R1.156 ClC(=O)c1c(F)cccc1Cl 1P003HH1 [0,2,0,0,0,0|2,0,0]=4 4779 B11R1.156 ClC(=O)c1c(F)cccc1F 1P0022NB [0,2,0,0,0,0|2,0,0]=4 4780 B11R1.156 ClC(=O)c1c(F)cccc1I 1P003HRL [0,2,0,0,0,0|2,0,0]=4 4781 B11R1.156 NC(=N)c1c(C)cccc1C 1P0281IT [0,2,0,0,0,0|2,0,0]=4 4782 B11R1.156 NC(=N)c1c(F)cccc1Br 1P028TVT [0,2,0,0,0,0|2,0,0]=4 4783 B11R1.156 NC(=N)c1c(F)cccc1Cl 1P000E5S [0,2,0,0,0,0|2,0,0]=4 4784 B11R1.156 NC(=N)c1c(F)cccc1F 1P005FC2 [0,2,0,0,0,0|2,0,0]=4 4785 B11R1.156 NC(=N)c1c(O)cccc1Cl 1P01B274 [0,2,0,0,0,0|2,0,0]=4 4786 B11R1.156 NC(=N)c1c(O)cccc1F 1P01BD9Z [0,2,0,0,0,0|2,0,0]=4 4787 B11R1.156 NC(=O)c1c(Br)ccnc1F 1P027YBR [0,2,0,0,0,0|0,0,0]=2 4788 B11R1.156 NC(=O)c1c(C)cc[nH]c1=O 1P01A5RB [0,2,0,0,0,0|0,0,1]=3 4789 B11R1.156 NC(=O)c1c(C)cccc1C 1P00D8N6 [0,2,0,0,0,0|1,0,0]=3 4790 B11R1.156 NC(=O)c1c(C)cccc1Cl 1P000458 [0,2,0,0,0,0|1,0,0]=3 4791 B11R1.156 NC(=O)c1c(C)cccc1F 1P00IFRN [0,2,0,0,0,0|1,0,0]=3 4792 B11R1.156 NC(=O)c1c(C)cccc1N 1P002HEE [0,2,0,0,0,0|1,0,0]=3 4793 B11R1.156 NC(=O)c1c(C)ccnc1Cl 1P003HE5 [0,2,0,0,0,0|0,0,0]=2 4794 B11R1.156 NC(=O)c1c(C)cncc1C 1P008POF [0,2,0,0,0,0|2,0,0]=4 4795 B11R1.156 NC(=O)c1c(Cl)cccc1Br 1P00FHEO [0,2,0,0,0,0|1,0,0]=3 4796 B11R1.156 NC(=O)c1c(Cl)cccc1Cl 1P002DHS [0,2,0,0,0,0|1,0,0]=3 4797 B11R1.156 NC(=O)c1c(Cl)cccc1I 1P000SEQ [0,2,0,0,0,0|1,0,0]=3 4798 B11R1.156 NC(=O)c1c(Cl)ccnc1Cl 1P00FGPQ [0,2,0,0,0,0|0,0,0]=2 4799 B11R1.156 NC(=O)c1c(Cl)ncnc1Cl 1P00H336 [0,2,0,0,0,0|1,0,0]=3 4800 B11R1.156 NC(=O)c1c(F)cccc1Br 1P008UA4 [0,2,0,0,0,0|1,0,0]=3 4801 B11R1.156 NC(=O)c1c(F)cccc1Cl 1P00FAE1 [0,2,0,0,0,0|1,0,0]=3 4802 B11R1.156 NC(=O)c1c(F)cccc1F 1P0022NA [0,2,0,0,0,0|1,0,0]=3 4803 B11R1.156 NC(=O)c1c(F)cncc1Br 1P009ZCR [0,2,0,0,0,0|2,0,0]=4 4804 B11R1.156 NC(=O)c1c(N)cccc1Cl 1P00DJS8 [0,2,0,0,0,0|1,0,0]=3 4805 B11R1.156 NC(=O)c1c(N)cccc1F 1P000H5E [0,2,0,0,0,0|1,0,0]=3 4806 B11R1.156 NC(=O)c1c(N)ccnc1Cl 1P01BAWX [0,2,0,0,0,0|0,0,0]=2 4807 B11R1.156 NC(=O)c1c(N)cncc1Br 1P01BJJ9 [0,2,0,0,0,0|2,0,0]=4 4808 B11R1.156 NC(=O)c1c(O)cccc1F 1P001VQH [0,2,0,0,0,0|1,0,0]=3 4809 B11R1.156 NC(=S)c1c(C)cccc1C 1P01DWXF [0,2,0,0,0,0|1,1,0]=4 4810 B11R1.156 NC(=S)c1c(C)ccnc1N 1P028LNW [0,2,0,0,0,0|0,1,0]=3 4811 B11R1.156 NC(=S)c1c(Cl)cccc1Cl 1P002FY2 [0,2,0,0,0,0|1,1,0]=4 4812 B11R1.156 NC(=S)c1c(F)cccc1Cl 1P00M2YM [0,2,0,0,0,0|1,1,0]=4 4813 B11R1.156 NC(=S)c1c(F)cccc1F 1P00IB4S [0,2,0,0,0,0|1,1,0]=4 4814 B11R1.156 O=N(=O)c1c(N)ccnc1Cl 1P0034CR [0,2,0,0,0,0|2,0,0]=4 4815 B11R1.156 OC(=O)c1c(Br)cccc1Br 1P0033HO [0,2,0,0,0,0|2,0,0]=4 4816 B11R1.156 OC(=O)c1c(Br)cccc1I 1P0007EI [0,2,0,0,0,0|2,0,0]=4 4817 B11R1.156 OC(=O)c1c(Br)ccnc1Br 1P000TYN [0,2,0,0,0,0|1,0,0]=3 4818 B11R1.156 OC(=O)c1c(Br)ccnc1Cl 1P008Y1J [0,2,0,0,0,0|1,0,0]=3 4819 B11R1.156 OC(=O)c1c(Br)ccnc1F 1P009YSQ [0,2,0,0,0,0|1,0,0]=3 4820 B11R1.156 OC(=O)c1c(C)cccc1Br 1P00GRQG [0,2,0,0,0,0|2,0,0]=4 4821 B11R1.156 OC(=O)c1c(C)cccc1C 1P003GM9 [0,2,0,0,0,0|2,0,0]=4 4822 B11R1.156 OC(=O)c1c(C)cccc1Cl 1P003HHH [0,2,0,0,0,0|2,0,0]=4 4823 B11R1.156 OC(=O)c1c(C)cccc1F 1P0033S6 [0,2,0,0,0,0|2,0,0]=4 4824 B11R1.156 OC(=O)c1c(C)cccc1I 1P00D95D [0,2,0,0,0,0|2,0,0]=4 4825 B11R1.156 OC(=O)c1c(C)cccc1N 1P003GZC [0,2,0,0,0,0|2,0,0]=4 4826 B11R1.156 OC(=O)c1c(C)cccc1O 1P003HVP [0,2,0,0,0,0|2,0,0]=4 4827 B11R1.156 OC(=O)c1c(C)ccnc1Br 1P00FHU2 [0,2,0,0,0,0|1,0,0]=3 4828 B11R1.156 OC(=O)c1c(C)ccnc1C 1P00D8TI [0,2,0,0,0,0|1,0,0]=3 4829 B11R1.156 OC(=O)c1c(C)ccnc1C 1P00HTJL [0,2,0,0,0,0|1,0,0]=3 4830 B11R1.156 OC(=O)c1c(C)ccnc1Cl 1P001IJO [0,2,0,0,0,0|1,0,0]=3 4831 B11R1.156 OC(=O)c1c(C)ccnc1N 1P00C7KB [0,2,0,0,0,0|1,0,0]=3 4832 B11R1.156 OC(=O)c1c(C)ccnc1N 1P01BU67 [0,2,0,0,0,0|1,0,0]=3 4833 B11R1.156 OC(=O)c1c(C)ccnc1O 1P00CHZT [0,2,0,0,0,0|1,0,0]=3 4834 B11R1.156 OC(=O)c1c(C)ncnc1C 1P001PV0 [0,2,0,0,0,0|2,0,0]=4 4835 B11R1.156 OC(=O)c1c(Cl)cccc1Br 1P00IHZ1 [0,2,0,0,0,0|2,0,0]=4 4836 B11R1.156 OC(=O)c1c(Cl)cccc1Cl 1P003GJY [0,2,0,0,0,0|2,0,0]=4 4837 B11R1.156 OC(=O)c1c(Cl)cccc1I 1P009GXS [0,2,0,0,0,0|2,0,0]=4 4838 B11R1.156 OC(=O)c1c(Cl)ccnc1Br 1P00HIVI [0,2,0,0,0,0|1,0,0]=3 4839 B11R1.156 OC(=O)c1c(Cl)ccnc1C 1P006BHX [0,2,0,0,0,0|1,0,0]=3 4840 B11R1.156 OC(=O)c1c(Cl)ccnc1C 1P02845H [0,2,0,0,0,0|1,0,0]=3 4841 B11R1.156 OC(=O)c1c(Cl)ccnc1Cl 1P002SW3 [0,2,0,0,0,0|1,0,0]=3 4842 B11R1.156 OC(=O)c1c(Cl)ccnc1F 1P019ZN7 [0,2,0,0,0,0|1,0,0]=3 4843 B11R1.156 OC(=O)c1c(Cl)ccnc1N 1P00EIVF [0,2,0,0,0,0|1,0,0]=3 4844 B11R1.156 OC(=O)c1c(Cl)ncnc1Cl 1P0036S9 [0,2,0,0,0,0|2,0,0]=4 4845 B11R1.156 OC(=O)c1c(F)cccc1Br 1P003H7G [0,2,0,0,0,0|2,0,0]=4 4846 B11R1.156 OC(=O)c1c(F)cccc1Cl 1P0033PF [0,2,0,0,0,0|2,0,0]=4 4847 B11R1.156 OC(=O)c1c(F)cccc1F 1P0033I8 [0,2,0,0,0,0|2,0,0]=4 4848 B11R1.156 OC(=O)c1c(F)cccc1I 1P003HRK [0,2,0,0,0,0|2,0,0]=4 4849 B11R1.156 OC(=O)c1c(F)ccnc1Br 1P008XEN [0,2,0,0,0,0|1,0,0]=3 4850 B11R1.156 OC(=O)c1c(F)ccnc1Cl 1P0037AL [0,2,0,0,0,0|1,0,0]=3 4851 B11R1.156 OC(=O)c1c(F)ccnc1F 1P00GA7Q [0,2,0,0,0,0|1,0,0]=3 4852 B11R1.156 OC(=O)c1c(F)ccnc1O 1P00I0IO [0,2,0,0,0,0|1,0,0]=3 4853 B11R1.156 OC(=O)c1c(I)ccnc1Cl 1P00IA77 [0,2,0,0,0,0|1,0,0]=3 4854 B11R1.156 OC(=O)c1c(I)ccnc1F 1P0036IV [0,2,0,0,0,0|1,0,0]=3 4855 B11R1.156 OC(=O)c1c(N)cccc1Br 1P002JQA [0,2,0,0,0,0|2,0,0]=4 4856 B11R1.156 OC(=O)c1c(N)cccc1Cl 1P003GYS [0,2,0,0,0,0|2,0,0]=4 4857 B11R1.156 OC(=O)c1c(N)cccc1F 1P003GZ3 [0,2,0,0,0,0|2,0,0]=4 4858 B11R1.156 OC(=O)c1c(N)cccc1I 1P002JQ7 [0,2,0,0,0,0|2,0,0]=4 4859 B11R1.156 OC(=O)c1c(N)cccc1O 1P00EISP [0,2,0,0,0,0|2,0,0]=4 4860 B11R1.156 OC(=O)c1c(N)ccnc1Br 1P0095PJ [0,2,0,0,0,0|1,0,0]=3 4861 B11R1.156 OC(=O)c1c(N)ccnc1Cl 1P00068T [0,2,0,0,0,0|1,0,0]=3 4862 B11R1.156 OC(=O)c1c(O)cccc1Br 1P003986 [0,2,0,0,0,0|2,0,0]=4 4863 B11R1.156 OC(=O)c1c(O)cccc1Cl 1P00393T [0,2,0,0,0,0|2,0,0]=4 4864 B11R1.156 OC(=O)c1c(O)cccc1F 1P0034TR [0,2,0,0,0,0|2,0,0]=4 4865 B11R1.156 OC(=O)c1c(O)cccc1I 1P01ADNT [0,2,0,0,0,0|2,0,0]=4 4866 B11R1.156 OC(=O)c1c(O)cccc1O 1P00300P [0,2,0,0,0,0|2,0,0]=4 4867 B11R1.156 OC(=O)c1c(O)ccnc1Br 1P000G98 [0,2,0,0,0,0|1,0,0]=3 4868 B11R1.156 OC(=O)c1c(O)ccnc1O 1P023PBW [0,2,0,0,0,0|1,0,0]=3 4869 B11R1.156 [O-]C(=O)c1c(Cl)cccc1Cl 1P0001A5 [0,2,0,0,0,0|2,0,0]=4 4870 B11R1.156 [O-]C(=O)c1c(F)cccc1Cl 1P0018RB [0,2,0,0,0,0|2,0,0]=4 4871 B11R1.156 [O-]C(=O)c1c(F)cccc1F 1P00EC73 [0,2,0,0,0,0|2,0,0]=4 4872 B11R1.156 [O-]S(=O)c1c(C)ccnc1Cl 1P01FJ1N [0,2,0,0,0,0|2,0,0]=4 4873 B11R1.156 [O-][N+](=O)c1c(Br)ccnc1Br 1P003G67 [0,2,0,0,0,0|2,0,0]=4 4874 B11R1.156 [O-][N+](=O)c1c(Br)ccnc1C 1P002MIC [0,2,0,0,0,0|2,0,0]=4 4875 B11R1.156 [O-][N+](=O)c1c(Br)ccnc1Cl 1P00HVL9 [0,2,0,0,0,0|2,0,0]=4 4876 B11R1.156 [O-][N+](=O)c1c(Br)ccnc1N 1P004SHE [0,2,0,0,0,0|2,0,0]=4 4877 B11R1.156 [O-][N+](=O)c1c(C)ccnc1Br 1P002MIF [0,2,0,0,0,0|2,0,0]=4 4878 B11R1.156 [O-][N+](=O)c1c(C)ccnc1C 1P00855M [0,2,0,0,0,0|2,0,0]=4 4879 B11R1.156 [O-][N+](=O)c1c(C)ccnc1Cl 1P002MII [0,2,0,0,0,0|2,0,0]=4 4880 B11R1.156 [O-][N+](=O)c1c(C)ccnc1F 1P0073JM [0,2,0,0,0,0|2,0,0]=4 4881 B11R1.156 [O-][N+](=O)c1c(C)ccnc1N 1P003GUG [0,2,0,0,0,0|2,0,0]=4 4882 B11R1.156 [O-][N+](=O)c1c(Cl)ccnc1Br 1P01FT2I [0,2,0,0,0,0|2,0,0]=4 4883 B11R1.156 [O-][N+](=O)c1c(Cl)ccnc1C 1P002MIK [0,2,0,0,0,0|2,0,0]=4 4884 B11R1.156 [O-][N+](=O)c1c(Cl)ccnc1Cl 1P0033FN [0,2,0,0,0,0|2,0,0]=4 4885 B11R1.156 [O-][N+](=O)c1c(Cl)ccnc1N 1P00FCUP [0,2,0,0,0,0|2,0,0]=4 4886 B11R1.156 [O-][N+](=O)c1c(F)ccnc1F 1P00ELI8 [0,2,0,0,0,0|2,0,0]=4 4887 B11R1.156 [O-][N+](=O)c1c(N)ccnc1Br 1P004W9K [0,2,0,0,0,0|2,0,0]=4 4888 B11R1.156 [O-][N+](=O)c1c(N)ccnc1C 1P002ULQ [0,2,0,0,0,0|2,0,0]=4 4889 B11R1.156 [O-][N+](=O)c1c(N)ccnc1N 1P002OTJ [0,2,0,0,0,0|2,0,0]=4 4890 B11R1.156 [O-][N+](=O)c1c(N)ccnc1O 1P0038U4 [0,2,0,0,0,0|2,0,0]=4 4891 B11R1.156 [O-][N+](=O)c1c(O)ccnc1Cl 1P00EDKH [0,2,0,0,0,0|2,0,0]=4 4892 B11R1.156 [O-][N+](=O)c1c(O)ccnc1O 1P003G9O [0,2,0,0,0,0|2,0,0]=4 4893 B11R1.159 CC(=O)c1cccc(c1Br)C 1P00IIM4 [0,2,0,0,0,0|2,0,0]=4 4894 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1P00HZ61 [0,2,0,0,0,0|2,0,0]=4 4895 B11R1.159 CC(=O)c1cccc(c1Br)F 1P001T0Q [0,2,0,0,0,0|2,0,0]=4 4896 B11R1.159 CC(=O)c1cccc(c1Br)O 1P01FRM3 [0,2,0,0,0,0|2,0,0]=4 4897 B11R1.159 CC(=O)c1cccc(c1C)Br 1P00E3BI [0,2,0,0,0,0|2,0,0]=4 4898 B11R1.159 CC(=O)c1cccc(c1C)C 1P0036P4 [0,2,0,0,0,0|2,0,0]=4 4899 B11R1.159 CC(=O)c1cccc(c1C)Cl 1P01FFEK [0,2,0,0,0,0|2,0,0]=4 4900 B11R1.159 CC(=O)c1cccc(c1C)I 1P01JKQ6 [0,2,0,0,0,0|2,0,0]=4 4901 B11R1.159 CC(=O)c1cccc(c1C)O 1P00FOJ5 [0,2,0,0,0,0|2,0,0]=4 4902 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1P001T0N [0,2,0,0,0,0|2,0,0]=4 4903 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1P003BKI [0,2,0,0,0,0|2,0,0]=4 4904 B11R1.159 CC(=O)c1cccc(c1Cl)F 1P001T0R [0,2,0,0,0,0|2,0,0]=4 4905 B11R1.159 CC(=O)c1cccc(c1F)Br 1P001T0O [0,2,0,0,0,0|2,0,0]=4 4906 B11R1.159 CC(=O)c1cccc(c1F)C 1P00IEL8 [0,2,0,0,0,0|2,0,0]=4 4907 B11R1.159 CC(=O)c1cccc(c1F)Cl 1P001T0P [0,2,0,0,0,0|2,0,0]=4 4908 B11R1.159 CC(=O)c1cccc(c1F)F 1P002852 [0,2,0,0,0,0|2,0,0]=4 4909 B11R1.159 CC(=O)c1cccc(c1F)N 1P01DS75 [0,2,0,0,0,0|2,0,0]=4 4910 B11R1.159 CC(=O)c1cccc(c1F)O 1P0094QQ [0,2,0,0,0,0|2,0,0]=4 4911 B11R1.159 CC(=O)c1cccc(c1N)C 1P00DKM6 [0,2,0,0,0,0|2,0,0]=4 4912 B11R1.159 CC(=O)c1cccc(c1N)Cl 1P00EET9 [0,2,0,0,0,0|2,0,0]=4 4913 B11R1.159 CC(=O)c1cccc(c1N)F 1P00AFYS [0,2,0,0,0,0|2,0,0]=4 4914 B11R1.159 CC(=O)c1cccc(c1N)O 1P00I8Y2 [0,2,0,0,0,0|2,0,0]=4 4915 B11R1.159 CC(=O)c1cccc(c1O)Br 1P00287B [0,2,0,0,0,0|2,0,0]=4 4916 B11R1.159 CC(=O)c1cccc(c1O)C 1P0032Z6 [0,2,0,0,0,0|2,0,0]=4 4917 B11R1.159 CC(=O)c1cccc(c1O)Cl 1P0038IK [0,2,0,0,0,0|2,0,0]=4 4918 B11R1.159 CC(=O)c1cccc(c1O)F 1P003412 [0,2,0,0,0,0|2,0,0]=4 4919 B11R1.159 CC(=O)c1cccc(c1O)N 1P00ICL0 [0,2,0,0,0,0|2,0,0]=4 4920 B11R1.159 CC(=O)c1cccc(c1O)N 1P00IGF1 [0,2,0,0,0,0|2,0,0]=4 4921 B11R1.159 ClC(=O)c1cccc(c1C)F 1P001Y92 [0,2,0,0,0,0|2,0,0]=4 4922 B11R1.159 ClC(=O)c1cccc(c1Cl)C 1P007PAN [0,2,0,0,0,0|2,0,0]=4 4923 B11R1.159 ClC(=O)c1cccc(c1Cl)Cl 1P002VSN [0,2,0,0,0,0|2,0,0]=4 4924 B11R1.159 ClC(=O)c1cccc(c1Cl)F 1P00BLZY [0,2,0,0,0,0|2,0,0]=4 4925 B11R1.159 ClC(=O)c1cccc(c1F)F 1P002855 [0,2,0,0,0,0|2,0,0]=4 4926 B11R1.159 Cn1ccnc(c1=O)C(=O)N 1P028I3K [0,2,0,0,0,0|1,0,1]=4 4927 B11R1.159 Cn1cncc(c1=O)C(=O)O 1P0077X1 [0,2,0,0,0,0|2,0,0]=4 4928 B11R1.159 NC(=N)c1cccc(c1Cl)Cl 1P00GPPY [0,2,0,0,0,0|2,0,0]=4 4929 B11R1.159 NC(=O)c1cccc(c1Br)F 1P0011I7 [0,2,0,0,0,0|1,0,0]=3 4930 B11R1.159 NC(=O)c1cccc(c1C)Br 1P00H1U4 [0,2,0,0,0,0|1,0,0]=3 4931 B11R1.159 NC(=O)c1cccc(c1C)C 1P003G0Y [0,2,0,0,0,0|1,0,0]=3 4932 B11R1.159 NC(=O)c1cccc(c1C)Cl 1P00I4CG [0,2,0,0,0,0|1,0,0]=3 4933 B11R1.159 NC(=O)c1cccc(c1C)F 1P00GYLJ [0,2,0,0,0,0|1,0,0]=3 4934 B11R1.159 NC(=O)c1cccc(c1C)N 1P007A39 [0,2,0,0,0,0|1,0,0]=3 4935 B11R1.159 NC(=O)c1cccc(c1Cl)Cl 1P003FY4 [0,2,0,0,0,0|1,0,0]=3 4936 B11R1.159 NC(=O)c1cccc(c1Cl)F 1P00FERR [0,2,0,0,0,0|1,0,0]=3 4937 B11R1.159 NC(=O)c1cccc(c1F)Br 1P00H041 [0,2,0,0,0,0|1,0,0]=3 4938 B11R1.159 NC(=O)c1cccc(c1F)C 1P000293 [0,2,0,0,0,0|1,0,0]=3 4939 B11R1.159 NC(=O)c1cccc(c1F)Cl 1P003445 [0,2,0,0,0,0|1,0,0]=3 4940 B11R1.159 NC(=O)c1cccc(c1F)F 1P002853 [0,2,0,0,0,0|1,0,0]=3 4941 B11R1.159 NC(=O)c1cccc(c1F)N 1P01FPBJ [0,2,0,0,0,0|1,0,0]=3 4942 B11R1.159 NC(=O)c1cccc(c1F)O 1P0066YB [0,2,0,0,0,0|1,0,0]=3 4943 B11R1.159 NC(=O)c1cccc(c1I)C 1P01K0VL [0,2,0,0,0,0|1,0,0]=3 4944 B11R1.159 NC(=O)c1cccc(c1I)F 1P01A273 [0,2,0,0,0,0|1,0,0]=3 4945 B11R1.159 NC(=O)c1cccc(c1N)Br 1P003A9G [0,2,0,0,0,0|1,0,0]=3 4946 B11R1.159 NC(=O)c1cccc(c1N)C 1P002HED [0,2,0,0,0,0|1,0,0]=3 4947 B11R1.159 NC(=O)c1cccc(c1N)Cl 1P00APWW [0,2,0,0,0,0|1,0,0]=3 4948 B11R1.159 NC(=O)c1cccc(c1N)F 1P002GZ7 [0,2,0,0,0,0|1,0,0]=3 4949 B11R1.159 NC(=O)c1cccc(c1N)N 1P0038XL [0,2,0,0,0,0|1,0,0]=3 4950 B11R1.159 NC(=O)c1cccc(c1N)O 1P001UNZ [0,2,0,0,0,0|1,0,0]=3 4951 B11R1.159 NC(=O)c1cccc(c1O)C 1P001CHL [0,2,0,0,0,0|1,0,0]=3 4952 B11R1.159 NC(=O)c1cccc(c1O)Cl 1P00OA7D [0,2,0,0,0,0|1,0,0]=3 4953 B11R1.159 NC(=O)c1cccc(c1O)F 1P0067G4 [0,2,0,0,0,0|1,0,0]=3 4954 B11R1.159 NC(=O)c1cccc(c1O)I 1P021Z7V [0,2,0,0,0,0|1,0,0]=3 4955 B11R1.159 NC(=O)c1cccn(c1=O)C 1P005GL8 [0,2,0,0,0,0|0,0,1]=3 4956 B11R1.159 NC(=O)c1ccnc(c1Br)Cl 1P01BKQ2 [0,2,0,0,0,0|2,0,0]=4 4957 B11R1.159 NC(=O)c1ccnc(c1F)Cl 1P01B7GA [0,2,0,0,0,0|2,0,0]=4 4958 B11R1.159 NC(=O)c1ccnc(c1N)Cl 1P007HBX [0,2,0,0,0,0|2,0,0]=4 4959 B11R1.159 NC(=O)c1nccc(c1Cl)Cl 1P00088S [0,2,0,0,0,0|2,0,0]=4 4960 B11R1.159 NC(=S)c1cccc(c1Cl)Cl 1P003FYJ [0,2,0,0,0,0|1,1,0]=4 4961 B11R1.159 OC(=O)c1cccc(c1Br)Br 1P00EDN3 [0,2,0,0,0,0|2,0,0]=4 4962 B11R1.159 OC(=O)c1cccc(c1Br)C 1P003H3Q [0,2,0,0,0,0|2,0,0]=4 4963 B11R1.159 OC(=O)c1cccc(c1Br)Cl 1P00EDUQ [0,2,0,0,0,0|2,0,0]=4 4964 B11R1.159 OC(=O)c1cccc(c1Br)F 1P0011I8 [0,2,0,0,0,0|2,0,0]=4 4965 B11R1.159 OC(=O)c1cccc(c1Br)I 1P0053BH [0,2,0,0,0,0|2,0,0]=4 4966 B11R1.159 OC(=O)c1cccc(c1Br)N 1P001YTB [0,2,0,0,0,0|2,0,0]=4 4967 B11R1.159 OC(=O)c1cccc(c1Br)N 1P028XY5 [0,2,0,0,0,0|2,0,0]=4 4968 B11R1.159 OC(=O)c1cccc(c1Br)O 1P006FN6 [0,2,0,0,0,0|2,0,0]=4 4969 B11R1.159 OC(=O)c1cccc(c1C)Br 1P00342N [0,2,0,0,0,0|2,0,0]=4 4970 B11R1.159 OC(=O)c1cccc(c1C)Cl 1P003JNW [0,2,0,0,0,0|2,0,0]=4 4971 B11R1.159 OC(=O)c1cccc(c1C)F 1P003JVX [0,2,0,0,0,0|2,0,0]=4 4972 B11R1.159 OC(=O)c1cccc(c1C)I 1P0014WQ [0,2,0,0,0,0|2,0,0]=4 4973 B11R1.159 OC(=O)c1cccc(c1C)N 1P00I9SE [0,2,0,0,0,0|2,0,0]=4 4974 B11R1.159 OC(=O)c1cccc(c1C)O 1P00346U [0,2,0,0,0,0|2,0,0]=4 4975 B11R1.159 OC(=O)c1cccc(c1Cl)Br 1P003JGV [0,2,0,0,0,0|2,0,0]=4 4976 B11R1.159 OC(=O)c1cccc(c1Cl)C 1P003HCK [0,2,0,0,0,0|2,0,0]=4 4977 B11R1.159 OC(=O)c1cccc(c1Cl)Cl 1P0037VY [0,2,0,0,0,0|2,0,0]=4 4978 B11R1.159 OC(=O)c1cccc(c1Cl)F 1P003HC3 [0,2,0,0,0,0|2,0,0]=4 4979 B11R1.159 OC(=O)c1cccc(c1Cl)I 1P003ATQ [0,2,0,0,0,0|2,0,0]=4 4980 B11R1.159 OC(=O)c1cccc(c1Cl)N 1P007ULN [0,2,0,0,0,0|2,0,0]=4 4981 B11R1.159 OC(=O)c1cccc(c1Cl)O 1P00DBW5 [0,2,0,0,0,0|2,0,0]=4 4982 B11R1.159 OC(=O)c1cccc(c1F)Br 1P001T0S [0,2,0,0,0,0|2,0,0]=4 4983 B11R1.159 OC(=O)c1cccc(c1F)C 1P003HPI [0,2,0,0,0,0|2,0,0]=4 4984 B11R1.159 OC(=O)c1cccc(c1F)Cl 1P001T0T [0,2,0,0,0,0|2,0,0]=4 4985 B11R1.159 OC(=O)c1cccc(c1F)F 1P00I8YK [0,2,0,0,0,0|2,0,0]=4 4986 B11R1.159 OC(=O)c1cccc(c1F)I 1P00DA39 [0,2,0,0,0,0|2,0,0]=4 4987 B11R1.159 OC(=O)c1cccc(c1F)N 1P00GV3A [0,2,0,0,0,0|2,0,0]=4 4988 B11R1.159 OC(=O)c1cccc(c1F)O 1P003HPD [0,2,0,0,0,0|2,0,0]=4 4989 B11R1.159 OC(=O)c1cccc(c1I)Br 1P00DGHR [0,2,0,0,0,0|2,0,0]=4 4990 B11R1.159 OC(=O)c1cccc(c1I)C 1P003HX5 [0,2,0,0,0,0|2,0,0]=4 4991 B11R1.159 OC(=O)c1cccc(c1I)Cl 1P000KQ7 [0,2,0,0,0,0|2,0,0]=4 4992 B11R1.159 OC(=O)c1cccc(c1I)F 1P00C0NV [0,2,0,0,0,0|2,0,0]=4 4993 B11R1.159 OC(=O)c1cccc(c1I)O 1P01KZLS [0,2,0,0,0,0|2,0,0]=4 4994 B11R1.159 OC(=O)c1cccc(c1N)Br 1P002JQ8 [0,2,0,0,0,0|2,0,0]=4 4995 B11R1.159 OC(=O)c1cccc(c1N)C 1P003GUE [0,2,0,0,0,0|2,0,0]=4 4996 B11R1.159 OC(=O)c1cccc(c1N)Cl 1P003GU2 [0,2,0,0,0,0|2,0,0]=4 4997 B11R1.159 OC(=O)c1cccc(c1N)F 1P003GU8 [0,2,0,0,0,0|2,0,0]=4 4998 B11R1.159 OC(=O)c1cccc(c1N)I 1P002JQ5 [0,2,0,0,0,0|2,0,0]=4 4999 B11R1.159 OC(=O)c1cccc(c1N)N 1P01DWDE [0,2,0,0,0,0|2,0,0]=4 5000 B11R1.159 OC(=O)c1cccc(c1N)N 1P0287V1 [0,2,0,0,0,0|2,0,0]=4 5001 B11R1.159 OC(=O)c1cccc(c1N)O 1P0036K7 [0,2,0,0,0,0|2,0,0]=4 5002 B11R1.159 OC(=O)c1cccc(c1N)O 1P003K0W [0,2,0,0,0,0|2,0,0]=4 5003 B11R1.159 OC(=O)c1cccc(c1N)S 1P028A14 [0,2,0,0,0,0|2,0,0]=4 5004 B11R1.159 OC(=O)c1cccc(c1O)C 1P0036AP [0,2,0,0,0,0|2,0,0]=4 5005 B11R1.159 OC(=O)c1cccc(c1O)Cl 1P0024OW [0,2,0,0,0,0|2,0,0]=4 5006 B11R1.159 OC(=O)c1cccc(c1O)F 1P003JVR [0,2,0,0,0,0|2,0,0]=4 5007 B11R1.159 OC(=O)c1cccc(c1O)O 1P00300K [0,2,0,0,0,0|2,0,0]=4 5008 B11R1.159 OC(=O)c1cccc(c1S)F 1P02839B [0,2,0,0,0,0|2,0,0]=4 5009 B11R1.159 OC(=O)c1cccn(c1=O)C 1P001O2K [0,2,0,0,0,0|1,0,1]=4 5010 B11R1.159 OC(=O)c1cccn(c1=O)O 1P0028JB [0,2,0,0,0,0|1,0,1]=4 5011 B11R1.159 OC(=O)c1cncc(c1C)Br 1P00FFSJ [0,2,0,0,0,0|1,0,0]=3 5012 B11R1.159 OC(=O)c1cncc(c1C)C 1P028H0B [0,2,0,0,0,0|1,0,0]=3 5013 B11R1.159 OC(=O)c1cncc(c1C)Cl 1P01AFRS [0,2,0,0,0,0|1,0,0]=3 5014 B11R1.159 OC(=O)c1cncc(c1C)F 1P00AAEB [0,2,0,0,0,0|1,0,0]=3 5015 B11R1.159 OC(=O)c1cncc(c1C)N 1P018BOZ [0,2,0,0,0,0|1,0,0]=3 5016 B11R1.159 OC(=O)c1cncc(c1Cl)Br 1P000OU4 [0,2,0,0,0,0|1,0,0]=3 5017 B11R1.159 OC(=O)c1cncc(c1Cl)C 1P01A4PO [0,2,0,0,0,0|1,0,0]=3 5018 B11R1.159 OC(=O)c1cncc(c1Cl)Cl 1P00DCF0 [0,2,0,0,0,0|1,0,0]=3 5019 B11R1.159 OC(=O)c1cncc(c1Cl)F 1P00IEBW [0,2,0,0,0,0|1,0,0]=3 5020 B11R1.159 OC(=O)c1cncc(c1Cl)O 1P02923W [0,2,0,0,0,0|1,0,0]=3 5021 B11R1.159 OC(=O)c1cncc(c1I)Br 1P003N02 [0,2,0,0,0,0|1,0,0]=3 5022 B11R1.159 OC(=O)c1cncc(c1N)Br 1P0037KJ [0,2,0,0,0,0|1,0,0]=3 5023 B11R1.159 OC(=O)c1cncc(c1N)Br 1P01FIWF [0,2,0,0,0,0|1,0,0]=3 5024 B11R1.159 OC(=O)c1cncc(c1O)Br 1P0085RA [0,2,0,0,0,0|1,0,0]=3 5025 B11R1.159 OC(=O)c1cncc(c1O)C 1P01A3F1 [0,2,0,0,0,0|1,0,0]=3 5026 B11R1.159 OC(=O)c1cncc(c1O)Cl 1P01B26M [0,2,0,0,0,0|1,0,0]=3 5027 B11R1.159 OC(=O)c1cncc(c1O)F 1P01B22D [0,2,0,0,0,0|1,0,0]=3 5028 B11R1.159 OC(=O)c1cnnc(c1C)C 1P027ZL3 [0,2,0,0,0,0|2,0,0]=4 5029 B11R1.159 [O-]C(=O)c1cccc(c1F)Cl 1P024I0Q [0,2,0,0,0,0|2,0,0]=4 5030 B11R1.159 [O-]C(=O)c1cccc(c1F)F 1P00HZ29 [0,2,0,0,0,0|2,0,0]=4 5031 B11R1.159 [O-]C(=O)c1cccc(c1O)C 1P003K8M [0,2,0,0,0,0|2,0,0]=4 5032 B11R1.159 [O-]C(=O)c1cccc(c1O)C 1P00CJ8W [0,2,0,0,0,0|2,0,0]=4 5033 B11R1.159 [O-][N+](=O)c1cncc(c1Br)Br 1P0290CC [0,2,0,0,0,0|2,0,0]=4 5034 B11R1.159 [O-][N+](=O)c1cncc(c1Br)C 1P01AG2D [0,2,0,0,0,0|2,0,0]=4 5035 B11R1.159 [O-][N+](=O)c1cncc(c1Br)Cl 1P0096GA [0,2,0,0,0,0|2,0,0]=4 5036 B11R1.159 [O-][N+](=O)c1cncc(c1C)Br 1P00371B [0,2,0,0,0,0|2,0,0]=4 5037 B11R1.159 [O-][N+](=O)c1cncc(c1C)Cl 1P01BDEH [0,2,0,0,0,0|2,0,0]=4 5038 B11R1.159 [O-][N+](=O)c1cncc(c1Cl)Br 1P00342S [0,2,0,0,0,0|2,0,0]=4 5039 B11R1.159 [O-][N+](=O)c1cncc(c1Cl)C 1P01WKSX [0,2,0,0,0,0|2,0,0]=4 5040 B11R1.159 [O-][N+](=O)c1cncc(c1Cl)Cl 1P00EK7J [0,2,0,0,0,0|2,0,0]=4 5041 B11R1.159 [O-][N+](=O)c1cncc(c1Cl)I 1P01C355 [0,2,0,0,0,0|2,0,0]=4 5042 B11R1.159 [O-][N+](=O)c1cncc(c1F)Br 1P00MDAV [0,2,0,0,0,0|2,0,0]=4 5043 B11R1.159 [O-][N+](=O)c1cncc(c1N)Br 1P003L5V [0,2,0,0,0,0|2,0,0]=4 5044 B11R1.159 [O-][N+](=O)c1cncc(c1N)C 1P00240V [0,2,0,0,0,0|2,0,0]=4 5045 B11R1.159 [O-][N+](=O)c1cncc(c1N)Cl 1P00414O [0,2,0,0,0,0|2,0,0]=4 5046 B11R1.159 [O-][N+](=O)c1cncc(c1N)I 1P00A0R7 [0,2,0,0,0,0|2,0,0]=4 5047 B11R1.159 [O-][N+](=O)c1cncc(c1O)Br 1P003JIM [0,2,0,0,0,0|2,0,0]=4 5048 B11R1.159 [O-][N+](=O)c1cncc(c1O)Cl 1P00CAU6 [0,2,0,0,0,0|2,0,0]=4 5049 B11R1.159 [O-][N+](=O)c1cncc(c1O)I 1P008STT [0,2,0,0,0,0|2,0,0]=4 5050 B11R1.167 Brc1c[nH]c(=O)c(c1)C(=O)O 1P007HFQ [0,2,0,0,0,0|1,0,1]=4 5051 B11R1.167 Brc1c[nH]c(=O)c(n1)C(=O)N 1P002RQG [0,2,0,0,0,0|1,0,1]=4 5052 B11R1.167 Brc1ccc(c(c1)C(=N)N)F 1P00930D [0,2,0,0,0,0|2,0,0]=4 5053 B11R1.167 Brc1ccc(c(c1)C(=O)C)Br 1P00BXTV [0,2,0,0,0,0|2,0,0]=4 5054 B11R1.167 Brc1ccc(c(c1)C(=O)C)C 1P003A5Y [0,2,0,0,0,0|2,0,0]=4 5055 B11R1.167 Brc1ccc(c(c1)C(=O)C)Cl 1P008TD3 [0,2,0,0,0,0|2,0,0]=4 5056 B11R1.167 Brc1ccc(c(c1)C(=O)C)F 1P002C0I [0,2,0,0,0,0|2,0,0]=4 5057 B11R1.167 Brc1ccc(c(c1)C(=O)C)I 1P000SEJ [0,2,0,0,0,0|2,0,0]=4 5058 B11R1.167 Brc1ccc(c(c1)C(=O)C)N 1P002XVG [0,2,0,0,0,0|2,0,0]=4 5059 B11R1.167 Brc1ccc(c(c1)C(=O)C)O 1P001KWY [0,2,0,0,0,0|2,0,0]=4 5060 B11R1.167 Brc1ccc(c(c1)C(=O)Cl)Br 1P01GL79 [0,2,0,0,0,0|2,0,0]=4 5061 B11R1.167 Brc1ccc(c(c1)C(=O)Cl)Cl 1P00C1QE [0,2,0,0,0,0|2,0,0]=4 5062 B11R1.167 Brc1ccc(c(c1)C(=O)N)C 1P00GA8O [0,2,0,0,0,0|1,0,0]=3 5063 B11R1.167 Brc1ccc(c(c1)C(=O)N)Cl 1P002HRC [0,2,0,0,0,0|1,0,0]=3 5064 B11R1.167 Brc1ccc(c(c1)C(=O)N)F 1P00BH8H [0,2,0,0,0,0|1,0,0]=3 5065 B11R1.167 Brc1ccc(c(c1)C(=O)N)I 1P002XH0 [0,2,0,0,0,0|1,0,0]=3 5066 B11R1.167 Brc1ccc(c(c1)C(=O)N)N 1P001U9O [0,2,0,0,0,0|1,0,0]=3 5067 B11R1.167 Brc1ccc(c(c1)C(=O)N)O 1P00EAJO [0,2,0,0,0,0|1,0,0]=3 5068 B11R1.167 Brc1ccc(c(c1)C(=O)O)Br 1P0033GP [0,2,0,0,0,0|2,0,0]=4 5069 B11R1.167 Brc1ccc(c(c1)C(=O)O)C 1P0034OE [0,2,0,0,0,0|2,0,0]=4 5070 B11R1.167 Brc1ccc(c(c1)C(=O)O)Cl 1P0034O7 [0,2,0,0,0,0|2,0,0]=4 5071 B11R1.167 Brc1ccc(c(c1)C(=O)O)F 1P001ECO [0,2,0,0,0,0|2,0,0]=4 5072 B11R1.167 Brc1ccc(c(c1)C(=O)O)I 1P003MY1 [0,2,0,0,0,0|2,0,0]=4 5073 B11R1.167 Brc1ccc(c(c1)C(=O)O)N 1P0033K8 [0,2,0,0,0,0|2,0,0]=4 5074 B11R1.167 Brc1ccc(c(c1)C(=O)O)O 1P0034P9 [0,2,0,0,0,0|2,0,0]=4 5075 B11R1.167 Brc1ccc(c(c1)C(=S)N)N 1P028DWH [0,2,0,0,0,0|1,1,0]=4 5076 B11R1.167 Brc1ccc(c(n1)C(=O)N)N 1P00HZLQ [0,2,0,0,0,0|2,0,0]=4 5077 B11R1.167 Brc1cnc(c(c1)C(=O)C)C 1P000OWJ [0,2,0,0,0,0|1,0,0]=3 5078 B11R1.167 Brc1cnc(c(c1)C(=O)C)C 1P028RZ2 [0,2,0,0,0,0|1,0,0]=3 5079 B11R1.167 Brc1cnc(c(c1)C(=O)C)Cl 1P008AZF [0,2,0,0,0,0|1,0,0]=3 5080 B11R1.167 Brc1cnc(c(c1)C(=O)C)F 1P003DHX [0,2,0,0,0,0|1,0,0]=3 5081 B11R1.167 Brc1cnc(c(c1)C(=O)C)N 1P01ELLE [0,2,0,0,0,0|1,0,0]=3 5082 B11R1.167 Brc1cnc(c(c1)C(=O)N)Cl 1P008R0E [0,2,0,0,0,0|0,0,0]=2 5083 B11R1.167 Brc1cnc(c(c1)C(=O)N)N 1P00ECWN [0,2,0,0,0,0|0,0,0]=2 5084 B11R1.167 Brc1cnc(c(c1)C(=O)O)Br 1P002YIF [0,2,0,0,0,0|1,0,0]=3 5085 B11R1.167 Brc1cnc(c(c1)C(=O)O)C 1P0038HX [0,2,0,0,0,0|1,0,0]=3 5086 B11R1.167 Brc1cnc(c(c1)C(=O)O)Cl 1P002Y9V [0,2,0,0,0,0|1,0,0]=3 5087 B11R1.167 Brc1cnc(c(c1)C(=O)O)F 1P002YB0 [0,2,0,0,0,0|1,0,0]=3 5088 B11R1.167 Brc1cnc(c(c1)C(=O)O)N 1P00DMD5 [0,2,0,0,0,0|1,0,0]=3 5089 B11R1.167 Brc1cnc(c(c1)C(=O)O)N 1P00I9WN [0,2,0,0,0,0|1,0,0]=3 5090 B11R1.167 Brc1cnc(c(c1)C(=O)O)S 1P01AJMI [0,2,0,0,0,0|1,0,0]=3 5091 B11R1.167 Brc1cnc(c(c1)C(N)C)Br 1P028H93 [0,2,0,0,0,0|1,0,1]=4 5092 B11R1.167 Brc1cnc(c(c1)[N+](=O)[O-])Br 1P001QTT [0,2,0,0,0,0|2,0,0]=4 5093 B11R1.167 Brc1cnc(c(c1)[N+](=O)[O-])C 1P0034OD [0,2,0,0,0,0|2,0,0]=4 5094 B11R1.167 Brc1cnc(c(c1)[N+](=O)[O-])Cl 1P0034O3 [0,2,0,0,0,0|2,0,0]=4 5095 B11R1.167 Brc1cnc(c(c1)[N+](=O)[O-])F 1P0036R4 [0,2,0,0,0,0|2,0,0]=4 5096 B11R1.167 Brc1cnc(c(c1)[N+](=O)[O-])N 1P0033K6 [0,2,0,0,0,0|2,0,0]=4 5097 B11R1.167 Brc1cnc(c(n1)C(=O)N)N 1P0026XF [0,2,0,0,0,0|1,0,0]=3 5098 B11R1.167 Brc1cnc(c(n1)C(=O)O)Br 1P005YTP [0,2,0,0,0,0|2,0,0]=4 5099 B11R1.167 Brc1cnc(c(n1)C(=O)O)N 1P006WST [0,2,0,0,0,0|2,0,0]=4 5100 B11R1.167 Brc1cnc(c(n1)C(=O)[O-])O 1P028VYL [0,2,0,0,0,0|2,0,0]=4 5101 B11R1.167 Brc1ncc(c(c1)C(=O)N)F 1P01FPDF [0,2,0,0,0,0|2,0,0]=4 5102 B11R1.167 CN1CC(=C(C=C1)I)C(=O)N 1P003EZF [0,2,0,0,0,0|0,0,2]=4 5103 B11R1.167 Cc1c[nH]c(=O)c(c1)C(=O)O 1P00CLY0 [0,2,0,0,0,0|1,0,1]=4 5104 B11R1.167 Cc1ccc(c(c1)C(=O)C)Br 1P00GAT6 [0,2,0,0,0,0|2,0,0]=4 5105 B11R1.167 Cc1ccc(c(c1)C(=O)C)C 1P0033H7 [0,2,0,0,0,0|2,0,0]=4 5106 B11R1.167 Cc1ccc(c(c1)C(=O)C)Cl 1P01V4LI [0,2,0,0,0,0|2,0,0]=4 5107 B11R1.167 Cc1ccc(c(c1)C(=O)C)F 1P003BOS [0,2,0,0,0,0|2,0,0]=4 5108 B11R1.167 Cc1ccc(c(c1)C(=O)C)N 1P00BQFJ [0,2,0,0,0,0|2,0,0]=4 5109 B11R1.167 Cc1ccc(c(c1)C(=O)C)O 1P001KX0 [0,2,0,0,0,0|2,0,0]=4 5110 B11R1.167 Cc1ccc(c(c1)C(=O)Cl)C 1P00BDAF [0,2,0,0,0,0|2,0,0]=4 5111 B11R1.167 Cc1ccc(c(c1)C(=O)Cl)F 1P003HR3 [0,2,0,0,0,0|2,0,0]=4 5112 B11R1.167 Cc1ccc(c(c1)C(=O)N)C 1P00EO1G [0,2,0,0,0,0|1,0,0]=3 5113 B11R1.167 Cc1ccc(c(c1)C(=O)N)F 1P00GVBI [0,2,0,0,0,0|1,0,0]=3 5114 B11R1.167 Cc1ccc(c(c1)C(=O)N)N 1P00772Z [0,2,0,0,0,0|1,0,0]=3 5115 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 1P00380H [0,2,0,0,0,0|1,0,0]=3 5116 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br 1P003H6R [0,2,0,0,0,0|2,0,0]=4 5117 B11R1.167 Cc1ccc(c(c1)C(=O)O)C 1P003GGE [0,2,0,0,0,0|2,0,0]=4 5118 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl 1P0037FO [0,2,0,0,0,0|2,0,0]=4 5119 B11R1.167 Cc1ccc(c(c1)C(=O)O)F 1P003NOJ [0,2,0,0,0,0|2,0,0]=4 5120 B11R1.167 Cc1ccc(c(c1)C(=O)O)I 1P00D96L [0,2,0,0,0,0|2,0,0]=4 5121 B11R1.167 Cc1ccc(c(c1)C(=O)O)N 1P003GXZ [0,2,0,0,0,0|2,0,0]=4 5122 B11R1.167 Cc1ccc(c(c1)C(=O)O)O 1P003ZSU [0,2,0,0,0,0|2,0,0]=4 5123 B11R1.167 Cc1cnc(c(c1)C(=O)C)Cl 1P0048IR [0,2,0,0,0,0|1,0,0]=3 5124 B11R1.167 Cc1cnc(c(c1)C(=O)N)Cl 1P00ELLE [0,2,0,0,0,0|0,0,0]=2 5125 B11R1.167 Cc1cnc(c(c1)C(=O)N)N 1P0007BB [0,2,0,0,0,0|0,0,0]=2 5126 B11R1.167 Cc1cnc(c(c1)C(=O)O)C 1P028OML [0,2,0,0,0,0|1,0,0]=3 5127 B11R1.167 Cc1cnc(c(c1)C(=O)O)Cl 1P00FBJ9 [0,2,0,0,0,0|1,0,0]=3 5128 B11R1.167 Cc1cnc(c(c1)C(=O)O)F 1P008YBJ [0,2,0,0,0,0|1,0,0]=3 5129 B11R1.167 Cc1cnc(c(c1)C(=O)O)N 1P00D8VH [0,2,0,0,0,0|1,0,0]=3 5130 B11R1.167 Cc1cnc(c(c1)C(N)C)F 1P028LBG [0,2,0,0,0,0|1,0,1]=4 5131 B11R1.167 Cc1cnc(c(c1)S(=O)[O-])F 1P01FL9C [0,2,0,0,0,0|2,0,0]=4 5132 B11R1.167 Cc1cnc(c(c1)[N+](=O)[O-])Br 1P002MIE [0,2,0,0,0,0|2,0,0]=4 5133 B11R1.167 Cc1cnc(c(c1)[N+](=O)[O-])Cl 1P002MIH [0,2,0,0,0,0|2,0,0]=4 5134 B11R1.167 Cc1cnc(c(c1)[N+](=O)[O-])F 1P003HR0 [0,2,0,0,0,0|2,0,0]=4 5135 B11R1.167 Cc1cnc(c(c1)[N+](=O)[O-])I 1P01DDNH [0,2,0,0,0,0|2,0,0]=4 5136 B11R1.167 Cc1cnc(c(c1)[N+](=O)[O-])N 1P00G2PJ [0,2,0,0,0,0|2,0,0]=4 5137 B11R1.167 Cc1cnc(c(c1)[N+](=O)[O-])O 1P008PY0 [0,2,0,0,0,0|2,0,0]=4 5138 B11R1.167 Cc1cnc(c(n1)C(=O)C)C 1P00DVPJ [0,2,0,0,0,0|2,0,0]=4 5139 B11R1.167 Cc1cnc(c(n1)C(=O)C)C 1P00FQ20 [0,2,0,0,0,0|2,0,0]=4 5140 B11R1.167 Cc1cnc(c(n1)C(=O)C)Cl 1P023RBS [0,2,0,0,0,0|2,0,0]=4 5141 B11R1.167 Cc1cnc(c(n1)C(=O)O)C 1P00BGLH [0,2,0,0,0,0|2,0,0]=4 5142 B11R1.167 Cc1cnc(c(n1)C(=O)O)N 1P00DIDA [0,2,0,0,0,0|2,0,0]=4 5143 B11R1.167 Cc1nnc(c(c1)C(=O)O)C 1P019T97 [0,2,0,0,0,0|2,0,0]=4 5144 B11R1.167 Cc1nnc(c(c1)C(=O)O)Cl 1P00GVD4 [0,2,0,0,0,0|2,0,0]=4 5145 B11R1.167 Clc1c[nH]c(=O)c(n1)C(=O)N 1P002RQF [0,2,0,0,0,0|1,0,1]=4 5146 B11R1.167 Clc1ccc(c(c1)C(=N)N)F 1P005OAH [0,2,0,0,0,0|2,0,0]=4 5147 B11R1.167 Clc1ccc(c(c1)C(=N)N)F 1P00HF7L [0,2,0,0,0,0|2,0,0]=4 5148 B11R1.167 Clc1ccc(c(c1)C(=N)N)O 1P01BDKX [0,2,0,0,0,0|2,0,0]=4 5149 B11R1.167 Clc1ccc(c(c1)C(=O)C)Br 1P00H1EO [0,2,0,0,0,0|2,0,0]=4 5150 B11R1.167 Clc1ccc(c(c1)C(=O)C)C 1P00EKVP [0,2,0,0,0,0|2,0,0]=4 5151 B11R1.167 Clc1ccc(c(c1)C(=O)C)Cl 1P002PUD [0,2,0,0,0,0|2,0,0]=4 5152 B11R1.167 Clc1ccc(c(c1)C(=O)C)F 1P00DD5T [0,2,0,0,0,0|2,0,0]=4 5153 B11R1.167 Clc1ccc(c(c1)C(=O)C)N 1P001YL0 [0,2,0,0,0,0|2,0,0]=4 5154 B11R1.167 Clc1ccc(c(c1)C(=O)C)O 1P001KWZ [0,2,0,0,0,0|2,0,0]=4 5155 B11R1.167 Clc1ccc(c(c1)C(=O)Cl)Cl 1P002VSM [0,2,0,0,0,0|2,0,0]=4 5156 B11R1.167 Clc1ccc(c(c1)C(=O)Cl)F 1P003N37 [0,2,0,0,0,0|2,0,0]=4 5157 B11R1.167 Clc1ccc(c(c1)C(=O)Cl)O 1P007Z4X [0,2,0,0,0,0|2,0,0]=4 5158 B11R1.167 Clc1ccc(c(c1)C(=O)N)C 1P01A5IM [0,2,0,0,0,0|1,0,0]=3 5159 B11R1.167 Clc1ccc(c(c1)C(=O)N)Cl 1P003BLU [0,2,0,0,0,0|1,0,0]=3 5160 B11R1.167 Clc1ccc(c(c1)C(=O)N)F 1P002SHR [0,2,0,0,0,0|1,0,0]=3 5161 B11R1.167 Clc1ccc(c(c1)C(=O)N)N 1P0036CW [0,2,0,0,0,0|1,0,0]=3 5162 B11R1.167 Clc1ccc(c(c1)C(=O)N)O 1P003N5N [0,2,0,0,0,0|1,0,0]=3 5163 B11R1.167 Clc1ccc(c(c1)C(=O)O)Br 1P003H61 [0,2,0,0,0,0|2,0,0]=4 5164 B11R1.167 Clc1ccc(c(c1)C(=O)O)C 1P003N43 [0,2,0,0,0,0|2,0,0]=4 5165 B11R1.167 Clc1ccc(c(c1)C(=O)O)Cl 1P0033GU [0,2,0,0,0,0|2,0,0]=4 5166 B11R1.167 Clc1ccc(c(c1)C(=O)O)F 1P003N34 [0,2,0,0,0,0|2,0,0]=4 5167 B11R1.167 Clc1ccc(c(c1)C(=O)O)I 1P009DJG [0,2,0,0,0,0|2,0,0]=4 5168 B11R1.167 Clc1ccc(c(c1)C(=O)O)N 1P0033KC [0,2,0,0,0,0|2,0,0]=4 5169 B11R1.167 Clc1ccc(c(c1)C(=O)O)O 1P0037U3 [0,2,0,0,0,0|2,0,0]=4 5170 B11R1.167 Clc1ccc(c(c1)C(=O)O)S 1P002983 [0,2,0,0,0,0|2,0,0]=4 5171 B11R1.167 Clc1ccc(c(c1)C(=O)[O-])Cl 1P00EL0D [0,2,0,0,0,0|2,0,0]=4 5172 B11R1.167 Clc1ccc(c(c1)C(=S)N)F 1P0289MW [0,2,0,0,0,0|1,1,0]=4 5173 B11R1.167 Clc1ccc(c(n1)C(=O)N)Br 1P000Y2Y [0,2,0,0,0,0|2,0,0]=4 5174 B11R1.167 Clc1ccc(c(n1)C(=O)N)C 1P01XAI0 [0,2,0,0,0,0|2,0,0]=4 5175 B11R1.167 Clc1ccc(c(n1)C(=O)N)Cl 1P00ADE2 [0,2,0,0,0,0|2,0,0]=4 5176 B11R1.167 Clc1ccc(c(n1)C(=O)N)N 1P0021EB [0,2,0,0,0,0|2,0,0]=4 5177 B11R1.167 Clc1cnc(c(c1)C(=O)C)Cl 1P00IUAW [0,2,0,0,0,0|1,0,0]=3 5178 B11R1.167 Clc1cnc(c(c1)C(=O)C)F 1P01JWGL [0,2,0,0,0,0|1,0,0]=3 5179 B11R1.167 Clc1cnc(c(c1)C(=O)N)Cl 1P005YY3 [0,2,0,0,0,0|0,0,0]=2 5180 B11R1.167 Clc1cnc(c(c1)C(=O)N)N 1P00EIVG [0,2,0,0,0,0|0,0,0]=2 5181 B11R1.167 Clc1cnc(c(c1)C(=O)O)Br 1P00EA8I [0,2,0,0,0,0|1,0,0]=3 5182 B11R1.167 Clc1cnc(c(c1)C(=O)O)C 1P007BS1 [0,2,0,0,0,0|1,0,0]=3 5183 B11R1.167 Clc1cnc(c(c1)C(=O)O)Cl 1P003GE7 [0,2,0,0,0,0|1,0,0]=3 5184 B11R1.167 Clc1cnc(c(c1)C(=O)O)F 1P003N39 [0,2,0,0,0,0|1,0,0]=3 5185 B11R1.167 Clc1cnc(c(c1)C(=O)O)N 1P00D8VQ [0,2,0,0,0,0|1,0,0]=3 5186 B11R1.167 Clc1cnc(c(c1)C(=O)O)O 1P003N3J [0,2,0,0,0,0|1,0,0]=3 5187 B11R1.167 Clc1cnc(c(c1)C(=O)[O-])F 1P01BRZM [0,2,0,0,0,0|1,0,0]=3 5188 B11R1.167 Clc1cnc(c(c1)[N+](=O)[O-])Br 1P003H5Z [0,2,0,0,0,0|2,0,0]=4 5189 B11R1.167 Clc1cnc(c(c1)[N+](=O)[O-])C 1P007PLU [0,2,0,0,0,0|2,0,0]=4 5190 B11R1.167 Clc1cnc(c(c1)[N+](=O)[O-])Cl 1P003GDR [0,2,0,0,0,0|2,0,0]=4 5191 B11R1.167 Clc1cnc(c(c1)[N+](=O)[O-])F 1P0037L0 [0,2,0,0,0,0|2,0,0]=4 5192 B11R1.167 Clc1cnc(c(c1)[N+](=O)[O-])I 1P00IMQW [0,2,0,0,0,0|2,0,0]=4 5193 B11R1.167 Clc1cnc(c(c1)[N+](=O)[O-])N 1P0037K3 [0,2,0,0,0,0|2,0,0]=4 5194 B11R1.167 Clc1cnc(c(n1)C(=O)N)Cl 1P0007RV [0,2,0,0,0,0|1,0,0]=3 5195 B11R1.167 Clc1cnc(c(n1)C(=O)N)N 1P0094Y1 [0,2,0,0,0,0|1,0,0]=3 5196 B11R1.167 Clc1cnc(c(n1)C(=O)O)Br 1P000RO4 [0,2,0,0,0,0|2,0,0]=4 5197 B11R1.167 Clc1cnc(c(n1)C(=O)O)Cl 1P00D5QQ [0,2,0,0,0,0|2,0,0]=4 5198 B11R1.167 Clc1cnc(c(n1)C(=O)O)N 1P00C1PG [0,2,0,0,0,0|2,0,0]=4 5199 B11R1.167 Clc1ncc(c(c1)C(=O)N)Cl 1P00AAI5 [0,2,0,0,0,0|2,0,0]=4 5200 B11R1.167 Clc1ncc(c(c1)C(=O)N)N 1P00162O [0,2,0,0,0,0|2,0,0]=4 5201 B11R1.167 Clc1nnc(c(c1)C(=O)C)Cl 1P022198 [0,2,0,0,0,0|2,0,0]=4 5202 B11R1.167 Clc1nnc(c(c1)C(=O)Cl)Cl 1P00ETBJ [0,2,0,0,0,0|2,0,0]=4 5203 B11R1.167 Clc1nnc(c(c1)C(=O)N)Cl 1P00BIG8 [0,2,0,0,0,0|1,0,0]=3 5204 B11R1.167 Clc1nnc(c(c1)C(=O)O)C 1P0291JI [0,2,0,0,0,0|2,0,0]=4 5205 B11R1.167 Clc1nnc(c(c1)C(=O)O)Cl 1P00340N [0,2,0,0,0,0|2,0,0]=4 5206 B11R1.167 Clc1nnc(c(c1)C(=O)O)N 1P028UVS [0,2,0,0,0,0|2,0,0]=4 5207 B11R1.167 Clc1nnc(c(c1)C(=O)O)O 1P00DIC6 [0,2,0,0,0,0|2,0,0]=4 5208 B11R1.167 Cn1ccc(=O)c(c1)C(=O)N 1P00G5AZ [0,2,0,0,0,0|0,0,1]=3 5209 B11R1.167 Cn1ccc(=O)c(c1)C(=O)O 1P00938H [0,2,0,0,0,0|1,0,1]=4 5210 B11R1.167 Fc1c[nH]c(=O)c(c1)C(=O)N 1P01EEHT [0,2,0,0,0,0|0,0,1]=3 5211 B11R1.167 Fc1c[nH]c(=O)c(n1)C(=O)N 1P002RQE [0,2,0,0,0,0|1,0,1]=4 5212 B11R1.167 Fc1ccc(c(c1)C(=N)N)F 1P004DCN [0,2,0,0,0,0|2,0,0]=4 5213 B11R1.167 Fc1ccc(c(c1)C(=O)C)Br 1P0002WR [0,2,0,0,0,0|2,0,0]=4 5214 B11R1.167 Fc1ccc(c(c1)C(=O)C)C 1P002YTO [0,2,0,0,0,0|2,0,0]=4 5215 B11R1.167 Fc1ccc(c(c1)C(=O)C)Cl 1P002ZGZ [0,2,0,0,0,0|2,0,0]=4 5216 B11R1.167 Fc1ccc(c(c1)C(=O)C)F 1P002BMD [0,2,0,0,0,0|2,0,0]=4 5217 B11R1.167 Fc1ccc(c(c1)C(=O)C)I 1P0036EC [0,2,0,0,0,0|2,0,0]=4 5218 B11R1.167 Fc1ccc(c(c1)C(=O)C)N 1P002NO5 [0,2,0,0,0,0|2,0,0]=4 5219 B11R1.167 Fc1ccc(c(c1)C(=O)C)O 1P0034Q9 [0,2,0,0,0,0|2,0,0]=4 5220 B11R1.167 Fc1ccc(c(c1)C(=O)Cl)Br 1P007SOY [0,2,0,0,0,0|2,0,0]=4 5221 B11R1.167 Fc1ccc(c(c1)C(=O)Cl)F 1P003GF2 [0,2,0,0,0,0|2,0,0]=4 5222 B11R1.167 Fc1ccc(c(c1)C(=O)N)Br 1P0002WQ [0,2,0,0,0,0|1,0,0]=3 5223 B11R1.167 Fc1ccc(c(c1)C(=O)N)C 1P0021B5 [0,2,0,0,0,0|1,0,0]=3 5224 B11R1.167 Fc1ccc(c(c1)C(=O)N)Cl 1P003HFA [0,2,0,0,0,0|1,0,0]=3 5225 B11R1.167 Fc1ccc(c(c1)C(=O)N)F 1P003GEY [0,2,0,0,0,0|1,0,0]=3 5226 B11R1.167 Fc1ccc(c(c1)C(=O)N)N 1P0037FW [0,2,0,0,0,0|1,0,0]=3 5227 B11R1.167 Fc1ccc(c(c1)C(=O)N)O 1P01B5Y0 [0,2,0,0,0,0|1,0,0]=3 5228 B11R1.167 Fc1ccc(c(c1)C(=O)O)Br 1P0033MA [0,2,0,0,0,0|2,0,0]=4 5229 B11R1.167 Fc1ccc(c(c1)C(=O)O)C 1P0033UR [0,2,0,0,0,0|2,0,0]=4 5230 B11R1.167 Fc1ccc(c(c1)C(=O)O)Cl 1P003HFB [0,2,0,0,0,0|2,0,0]=4 5231 B11R1.167 Fc1ccc(c(c1)C(=O)O)F 1P003GF0 [0,2,0,0,0,0|2,0,0]=4 5232 B11R1.167 Fc1ccc(c(c1)C(=O)O)I 1P003N7F [0,2,0,0,0,0|2,0,0]=4 5233 B11R1.167 Fc1ccc(c(c1)C(=O)O)N 1P003GXN [0,2,0,0,0,0|2,0,0]=4 5234 B11R1.167 Fc1ccc(c(c1)C(=O)O)O 1P00I7A4 [0,2,0,0,0,0|2,0,0]=4 5235 B11R1.167 Fc1ccc(c(c1)C(=O)O)S 1P000QTN [0,2,0,0,0,0|2,0,0]=4 5236 B11R1.167 Fc1ccc(c(c1)C(=O)[O-])F 1P00DAX6 [0,2,0,0,0,0|2,0,0]=4 5237 B11R1.167 Fc1ccc(c(c1)C(=S)N)Br 1P028VWK [0,2,0,0,0,0|1,1,0]=4 5238 B11R1.167 Fc1ccc(c(c1)C(=S)N)F 1P01BCFQ [0,2,0,0,0,0|1,1,0]=4 5239 B11R1.167 Fc1ccc(c(c1)C(=S)N)N 1P028ELG [0,2,0,0,0,0|1,1,0]=4 5240 B11R1.167 Fc1cnc(c(c1)C(=O)C)Cl 1P003DAB [0,2,0,0,0,0|1,0,0]=3 5241 B11R1.167 Fc1cnc(c(c1)C(=O)C)F 1P001N6P [0,2,0,0,0,0|1,0,0]=3 5242 B11R1.167 Fc1cnc(c(c1)C(=O)N)C 1P028C42 [0,2,0,0,0,0|0,0,0]=2 5243 B11R1.167 Fc1cnc(c(c1)C(=O)N)Cl 1P005D1T [0,2,0,0,0,0|0,0,0]=2 5244 B11R1.167 Fc1cnc(c(c1)C(=O)N)N 1P01FZZC [0,2,0,0,0,0|0,0,0]=2 5245 B11R1.167 Fc1cnc(c(c1)C(=O)O)Br 1P00C7NY [0,2,0,0,0,0|1,0,0]=3 5246 B11R1.167 Fc1cnc(c(c1)C(=O)O)Cl 1P003HFD [0,2,0,0,0,0|1,0,0]=3 5247 B11R1.167 Fc1cnc(c(c1)C(=O)O)F 1P004R93 [0,2,0,0,0,0|1,0,0]=3 5248 B11R1.167 Fc1cnc(c(c1)C(=O)O)N 1P000PSX [0,2,0,0,0,0|1,0,0]=3 5249 B11R1.167 Fc1cnc(c(c1)C(=O)O)O 1P004K0A [0,2,0,0,0,0|1,0,0]=3 5250 B11R1.167 Fc1cnc(c(c1)[N+](=O)[O-])Br 1P00ED5L [0,2,0,0,0,0|2,0,0]=4 5251 B11R1.167 Fc1cnc(c(c1)[N+](=O)[O-])C 1P01KL0T [0,2,0,0,0,0|2,0,0]=4 5252 B11R1.167 Fc1cnc(c(c1)[N+](=O)[O-])Cl 1P0012ZF [0,2,0,0,0,0|2,0,0]=4 5253 B11R1.167 Fc1cnc(c(c1)[N+](=O)[O-])F 1P0027K7 [0,2,0,0,0,0|2,0,0]=4 5254 B11R1.167 Fc1cnc(c(c1)[N+](=O)[O-])N 1P0033JP [0,2,0,0,0,0|2,0,0]=4 5255 B11R1.167 Fc1cnc(c(n1)C(=O)N)F 1P00D5QS [0,2,0,0,0,0|1,0,0]=3 5256 B11R1.167 Ic1ccc(c(c1)C(=O)C)Br 1P0281NL [0,2,0,0,0,0|2,0,0]=4 5257 B11R1.167 Ic1ccc(c(c1)C(=O)C)Cl 1P01JKQA [0,2,0,0,0,0|2,0,0]=4 5258 B11R1.167 Ic1ccc(c(c1)C(=O)C)F 1P00HDLJ [0,2,0,0,0,0|2,0,0]=4 5259 B11R1.167 Ic1ccc(c(c1)C(=O)C)O 1P0061WY [0,2,0,0,0,0|2,0,0]=4 5260 B11R1.167 Ic1ccc(c(c1)C(=O)Cl)Cl 1P00I5R6 [0,2,0,0,0,0|2,0,0]=4 5261 B11R1.167 Ic1ccc(c(c1)C(=O)N)Br 1P00IEKG [0,2,0,0,0,0|1,0,0]=3 5262 B11R1.167 Ic1ccc(c(c1)C(=O)N)N 1P00BZXF [0,2,0,0,0,0|1,0,0]=3 5263 B11R1.167 Ic1ccc(c(c1)C(=O)O)Br 1P0036BE [0,2,0,0,0,0|2,0,0]=4 5264 B11R1.167 Ic1ccc(c(c1)C(=O)O)C 1P003N9R [0,2,0,0,0,0|2,0,0]=4 5265 B11R1.167 Ic1ccc(c(c1)C(=O)O)Cl 1P002FE4 [0,2,0,0,0,0|2,0,0]=4 5266 B11R1.167 Ic1ccc(c(c1)C(=O)O)F 1P000N3G [0,2,0,0,0,0|2,0,0]=4 5267 B11R1.167 Ic1ccc(c(c1)C(=O)O)I 1P001HUM [0,2,0,0,0,0|2,0,0]=4 5268 B11R1.167 Ic1ccc(c(c1)C(=O)O)N 1P0033KH [0,2,0,0,0,0|2,0,0]=4 5269 B11R1.167 Ic1ccc(c(c1)C(=O)O)O 1P003HVG [0,2,0,0,0,0|2,0,0]=4 5270 B11R1.167 Ic1cnc(c(c1)C(=O)O)Br 1P00EQR8 [0,2,0,0,0,0|1,0,0]=3 5271 B11R1.167 Ic1cnc(c(c1)C(=O)O)Cl 1P00EAYU [0,2,0,0,0,0|1,0,0]=3 5272 B11R1.167 Ic1cnc(c(c1)C(=O)O)N 1P00DIEJ [0,2,0,0,0,0|1,0,0]=3 5273 B11R1.167 Ic1cnc(c(c1)C(=O)O)O 1P00772C [0,2,0,0,0,0|1,0,0]=3 5274 B11R1.167 Ic1cnc(c(c1)[N+](=O)[O-])Cl 1P003HFP [0,2,0,0,0,0|2,0,0]=4 5275 B11R1.167 Ic1cnc(c(c1)[N+](=O)[O-])N 1P007NS5 [0,2,0,0,0,0|2,0,0]=4 5276 B11R1.167 Ic1cnc(c(c1)[N+](=O)[O-])O 1P003N9W [0,2,0,0,0,0|2,0,0]=4 5277 B11R1.167 Ic1cnc(c(n1)C(=O)O)N 1P008F9C [0,2,0,0,0,0|2,0,0]=4 5278 B11R1.167 Nc1ccc(c(c1)C(=O)C)Br 1P001MLC [0,2,0,0,0,0|2,0,0]=4 5279 B11R1.167 Nc1ccc(c(c1)C(=O)C)C 1P00BQAS [0,2,0,0,0,0|2,0,0]=4 5280 B11R1.167 Nc1ccc(c(c1)C(=O)C)Cl 1P01KYYJ [0,2,0,0,0,0|2,0,0]=4 5281 B11R1.167 Nc1ccc(c(c1)C(=O)C)F 1P00FGTC [0,2,0,0,0,0|2,0,0]=4 5282 B11R1.167 Nc1ccc(c(c1)C(=O)C)F 1P01B8CU [0,2,0,0,0,0|2,0,0]=4 5283 B11R1.167 Nc1ccc(c(c1)C(=O)C)O 1P00DCA9 [0,2,0,0,0,0|2,0,0]=4 5284 B11R1.167 Nc1ccc(c(c1)C(=O)N)Br 1P00J2KH [0,2,0,0,0,0|1,0,0]=3 5285 B11R1.167 Nc1ccc(c(c1)C(=O)N)C 1P00DHRU [0,2,0,0,0,0|1,0,0]=3 5286 B11R1.167 Nc1ccc(c(c1)C(=O)N)Cl 1P007TM3 [0,2,0,0,0,0|1,0,0]=3 5287 B11R1.167 Nc1ccc(c(c1)C(=O)N)F 1P00DI2I [0,2,0,0,0,0|1,0,0]=3 5288 B11R1.167 Nc1ccc(c(c1)C(=O)O)Br 1P00BD5V [0,2,0,0,0,0|2,0,0]=4 5289 B11R1.167 Nc1ccc(c(c1)C(=O)O)C 1P00I5SH [0,2,0,0,0,0|2,0,0]=4 5290 B11R1.167 Nc1ccc(c(c1)C(=O)O)Cl 1P003MTU [0,2,0,0,0,0|2,0,0]=4 5291 B11R1.167 Nc1ccc(c(c1)C(=O)O)F 1P003MTY [0,2,0,0,0,0|2,0,0]=4 5292 B11R1.167 Nc1ccc(c(c1)C(=O)O)I 1P01OZIP [0,2,0,0,0,0|2,0,0]=4 5293 B11R1.167 Nc1ccc(c(c1)C(=O)O)N 1P000HE0 [0,2,0,0,0,0|2,0,0]=4 5294 B11R1.167 Nc1ccc(c(c1)C(=O)O)N 1P00E9JO [0,2,0,0,0,0|2,0,0]=4 5295 B11R1.167 Nc1ccc(c(c1)C(=O)O)O 1P003MVD [0,2,0,0,0,0|2,0,0]=4 5296 B11R1.167 Nc1ccc(c(c1)C(=O)[O-])O 1P003US4 [0,2,0,0,0,0|2,0,0]=4 5297 B11R1.167 Nc1cnc(c(c1)C(=O)N)C 1P019RI1 [0,2,0,0,0,0|0,0,0]=2 5298 B11R1.167 Nc1cnc(c(c1)C(=O)O)Br 1P028XEX [0,2,0,0,0,0|1,0,0]=3 5299 B11R1.167 Nc1cnc(c(c1)C(=O)O)C 1P007BS0 [0,2,0,0,0,0|1,0,0]=3 5300 B11R1.167 Nc1cnc(c(c1)C(=O)O)Cl 1P0070QT [0,2,0,0,0,0|1,0,0]=3 5301 B11R1.167 OC(=O)c1cc(=O)[nH]nc1Cl 1P01IKFP [0,2,0,0,0,0|2,0,0]=4 5302 B11R1.167 Oc1ccc(c(c1)C(=O)C)Br 1P0094JS [0,2,0,0,0,0|2,0,0]=4 5303 B11R1.167 Oc1ccc(c(c1)C(=O)C)C 1P0075H7 [0,2,0,0,0,0|2,0,0]=4 5304 B11R1.167 Oc1ccc(c(c1)C(=O)C)Cl 1P00IASK [0,2,0,0,0,0|2,0,0]=4 5305 B11R1.167 Oc1ccc(c(c1)C(=O)C)F 1P001L93 [0,2,0,0,0,0|2,0,0]=4 5306 B11R1.167 Oc1ccc(c(c1)C(=O)C)N 1P00327Z [0,2,0,0,0,0|2,0,0]=4 5307 B11R1.167 Oc1ccc(c(c1)C(=O)C)O 1P0033H2 [0,2,0,0,0,0|2,0,0]=4 5308 B11R1.167 Oc1ccc(c(c1)C(=O)N)C 1P009DJ0 [0,2,0,0,0,0|1,0,0]=3 5309 B11R1.167 Oc1ccc(c(c1)C(=O)O)Br 1P00ED7I [0,2,0,0,0,0|2,0,0]=4 5310 B11R1.167 Oc1ccc(c(c1)C(=O)O)C 1P003935 [0,2,0,0,0,0|2,0,0]=4 5311 B11R1.167 Oc1ccc(c(c1)C(=O)O)Cl 1P003HFL [0,2,0,0,0,0|2,0,0]=4 5312 B11R1.167 Oc1ccc(c(c1)C(=O)O)F 1P003HQU [0,2,0,0,0,0|2,0,0]=4 5313 B11R1.167 Oc1ccc(c(c1)C(=O)O)I 1P00EJ2U [0,2,0,0,0,0|2,0,0]=4 5314 B11R1.167 Oc1ccc(c(c1)C(=O)O)N 1P0034QY [0,2,0,0,0,0|2,0,0]=4 5315 B11R1.167 Oc1ccc(c(c1)C(=O)O)O 1P003R7I [0,2,0,0,0,0|2,0,0]=4 5316 B11R1.167 Oc1ccc(c(c1)C(=O)O)O 1P006K3G [0,2,0,0,0,0|2,0,0]=4 5317 B11R1.167 Oc1ccc(c(c1)C(=O)[O-])O 1P003URD [0,2,0,0,0,0|2,0,0]=4 5318 B11R1.167 Oc1cnc(c(c1)C(=O)O)Cl 1P00CM2Q [0,2,0,0,0,0|1,0,0]=3 5319 B11R1.167 Oc1cnc(c(c1)C(=O)O)N 1P01B303 [0,2,0,0,0,0|1,0,0]=3 5320 B11R1.167 Oc1cnc(c(c1)C(=O)O)N 1P01B4FE [0,2,0,0,0,0|1,0,0]=3 5321 B11R1.167 Oc1cnc(c(c1)[N+](=O)[O-])C 1P024HR5 [0,2,0,0,0,0|2,0,0]=4 5322 B11R1.167 Oc1cnc(c(c1)[N+](=O)[O-])N 1P01JWGA [0,2,0,0,0,0|2,0,0]=4 5323 B11R1.167 Sc1ccc(c(c1)C(=O)O)Br 1P01A60P [0,2,0,0,0,0|2,0,0]=4 5324 B11R1.74 Brc1cc(I)cc(c1)C(=O)C 1P008UUV [0,2,0,0,0,0|2,0,0]=4 5325 B11R1.74 Brc1cc(I)cc(c1)C(=O)O 1P002HU5 [0,2,0,0,0,0|2,0,0]=4 5326 B11R1.74 CC(=O)c1cc(Br)cc(c1)Br 1P001J9B [0,2,0,0,0,0|2,0,0]=4 5327 B11R1.74 CC(=O)c1cc(Cl)cc(c1)Cl 1P001J9C [0,2,0,0,0,0|2,0,0]=4 5328 B11R1.74 CC(=O)c1cc(F)cc(c1)F 1P000L9X [0,2,0,0,0,0|2,0,0]=4 5329 B11R1.74 CC(=O)c1cc(O)cc(c1)O 1P003J41 [0,2,0,0,0,0|2,0,0]=4 5330 B11R1.74 Cc1cc(Br)cc(c1)C(=O)C 1P0014LX [0,2,0,0,0,0|2,0,0]=4 5331 B11R1.74 Cc1cc(Br)cc(c1)C(=O)N 1P0003A4 [0,2,0,0,0,0|1,0,0]=3 5332 B11R1.74 Cc1cc(Br)cc(c1)C(=O)O 1P003JJT [0,2,0,0,0,0|2,0,0]=4 5333 B11R1.74 Cc1cc(C)cc(c1)C(=O)C 1P00IA2B [0,2,0,0,0,0|2,0,0]=4 5334 B11R1.74 Cc1cc(Cl)cc(c1)C(=O)C 1P01K61P [0,2,0,0,0,0|2,0,0]=4 5335 B11R1.74 Cc1cc(Cl)cc(c1)C(=O)N 1P01BIWW [0,2,0,0,0,0|1,0,0]=3 5336 B11R1.74 Cc1cc(Cl)cc(c1)C(=O)O 1P00344T [0,2,0,0,0,0|2,0,0]=4 5337 B11R1.74 Cc1cc(F)cc(c1)C(=O)C 1P00GYMH [0,2,0,0,0,0|2,0,0]=4 5338 B11R1.74 Cc1cc(F)cc(c1)C(=O)N 1P00DHU3 [0,2,0,0,0,0|1,0,0]=3 5339 B11R1.74 Cc1cc(F)cc(c1)C(=O)O 1P003JXL [0,2,0,0,0,0|2,0,0]=4 5340 B11R1.74 Cc1cc(I)cc(c1)C(=O)O 1P00DZFI [0,2,0,0,0,0|2,0,0]=4 5341 B11R1.74 Cc1cc(N)cc(c1)C(=O)N 1P01AUW0 [0,2,0,0,0,0|1,0,0]=3 5342 B11R1.74 Cc1cc(N)cc(c1)C(=O)N 1P028CM2 [0,2,0,0,0,0|1,0,0]=3 5343 B11R1.74 Cc1cc(N)cc(c1)C(=O)O 1P002MH5 [0,2,0,0,0,0|2,0,0]=4 5344 B11R1.74 Cc1cc(O)cc(c1)C(=O)C 1P00I8RI [0,2,0,0,0,0|2,0,0]=4 5345 B11R1.74 Cc1cc(O)cc(c1)C(=O)O 1P00393C [0,2,0,0,0,0|2,0,0]=4 5346 B11R1.74 Cc1nc(Cl)cc(c1)C(=O)N 1P00BGME [0,2,0,0,0,0|2,0,0]=4 5347 B11R1.74 ClC(=O)c1cc(C)cc(c1)C 1P003J5J [0,2,0,0,0,0|2,0,0]=4 5348 B11R1.74 ClC(=O)c1cc(F)cc(c1)F 1P000U23 [0,2,0,0,0,0|2,0,0]=4 5349 B11R1.74 Clc1cc(Br)cc(c1)C(=O)C 1P007GRW [0,2,0,0,0,0|2,0,0]=4 5350 B11R1.74 Clc1cc(Br)cc(c1)C(=O)N 1P00GVA9 [0,2,0,0,0,0|1,0,0]=3 5351 B11R1.74 Clc1cc(Br)cc(c1)C(=O)O 1P003431 [0,2,0,0,0,0|2,0,0]=4 5352 B11R1.74 Clc1cc(Cl)cc(c1)C(=O)Cl 1P002XO3 [0,2,0,0,0,0|2,0,0]=4 5353 B11R1.74 Clc1cc(Cl)nc(c1)C(=O)N 1P00IKI5 [0,2,0,0,0,0|2,0,0]=4 5354 B11R1.74 Clc1cc(I)cc(c1)C(=O)O 1P002XGX [0,2,0,0,0,0|2,0,0]=4 5355 B11R1.74 Fc1cc(Br)cc(c1)C(=O)C 1P003J8V [0,2,0,0,0,0|2,0,0]=4 5356 B11R1.74 Fc1cc(Br)cc(c1)C(=O)Cl 1P004639 [0,2,0,0,0,0|2,0,0]=4 5357 B11R1.74 Fc1cc(Br)cc(c1)C(=O)N 1P00GVAB [0,2,0,0,0,0|1,0,0]=3 5358 B11R1.74 Fc1cc(Br)cc(c1)C(=O)O 1P00257I [0,2,0,0,0,0|2,0,0]=4 5359 B11R1.74 Fc1cc(Cl)cc(c1)C(=O)C 1P003JPV [0,2,0,0,0,0|2,0,0]=4 5360 B11R1.74 Fc1cc(Cl)cc(c1)C(=O)Cl 1P00GYKO [0,2,0,0,0,0|2,0,0]=4 5361 B11R1.74 Fc1cc(Cl)cc(c1)C(=O)N 1P00GYMO [0,2,0,0,0,0|1,0,0]=3 5362 B11R1.74 Fc1cc(Cl)cc(c1)C(=O)O 1P007OQ6 [0,2,0,0,0,0|2,0,0]=4 5363 B11R1.74 Fc1cc(I)cc(c1)C(=O)O 1P005IPC [0,2,0,0,0,0|2,0,0]=4 5364 B11R1.74 NC(=N)c1cc(C)cc(c1)C 1P002S8U [0,2,0,0,0,0|2,0,0]=4 5365 B11R1.74 NC(=N)c1cc(Cl)cc(c1)Cl 1P00BD5Y [0,2,0,0,0,0|2,0,0]=4 5366 B11R1.74 NC(=N)c1cc(F)cc(c1)F 1P001KN9 [0,2,0,0,0,0|2,0,0]=4 5367 B11R1.74 NC(=O)c1cc(Br)cc(c1)Br 1P002166 [0,2,0,0,0,0|1,0,0]=3 5368 B11R1.74 NC(=O)c1cc(Cl)cc(c1)Cl 1P0033ZX [0,2,0,0,0,0|1,0,0]=3 5369 B11R1.74 NC(=O)c1cc(Cl)nc(c1)Cl 1P00417U [0,2,0,0,0,0|2,0,0]=4 5370 B11R1.74 NC(=O)c1cc(F)cc(c1)F 1P0011XK [0,2,0,0,0,0|1,0,0]=3 5371 B11R1.74 NC(=O)c1cc(O)cc(c1)O 1P00BZSZ [0,2,0,0,0,0|1,0,0]=3 5372 B11R1.74 NC(=S)c1cc(C)cc(c1)C 1P01DX1Q [0,2,0,0,0,0|1,1,0]=4 5373 B11R1.74 NC(=S)c1cc(Cl)cc(c1)Cl 1P00C1LV [0,2,0,0,0,0|1,1,0]=4 5374 B11R1.74 NC(=S)c1cc(F)cc(c1)F 1P004INE [0,2,0,0,0,0|1,1,0]=4 5375 B11R1.74 Nc1cc(Br)cc(c1)C(=O)O 1P0073K0 [0,2,0,0,0,0|2,0,0]=4 5376 B11R1.74 Nc1cc(Cl)cc(c1)C(=O)N 1P01BI8J [0,2,0,0,0,0|1,0,0]=3 5377 B11R1.74 Nc1cc(Cl)cc(c1)C(=O)O 1P003JD0 [0,2,0,0,0,0|2,0,0]=4 5378 B11R1.74 Nc1cc(F)cc(c1)C(=O)N 1P003JD4 [0,2,0,0,0,0|1,0,0]=3 5379 B11R1.74 Nc1cc(F)cc(c1)C(=O)O 1P0052DT [0,2,0,0,0,0|2,0,0]=4 5380 B11R1.74 Nc1cc(I)cc(c1)C(=O)O 1P00078Q [0,2,0,0,0,0|2,0,0]=4 5381 B11R1.74 Nc1cc(O)cc(c1)C(=O)O 1P001I5H [0,2,0,0,0,0|2,0,0]=4 5382 B11R1.74 Nc1cc(O)cc(c1)C(=O)O 1P003JD6 [0,2,0,0,0,0|2,0,0]=4 5383 B11R1.74 OC(=O)c1cc(Br)cc(c1)Br 1P003926 [0,2,0,0,0,0|2,0,0]=4 5384 B11R1.74 OC(=O)c1cc(C)cc(c1)C 1P003J5H [0,2,0,0,0,0|2,0,0]=4 5385 B11R1.74 OC(=O)c1cc(Cl)cc(c1)Cl 1P0033ZY [0,2,0,0,0,0|2,0,0]=4 5386 B11R1.74 OC(=O)c1cc(Cl)cc(c1)Cl 1P01SVAY [0,2,0,0,0,0|2,0,0]=4 5387 B11R1.74 OC(=O)c1cc(F)cc(c1)F 1P003J3G [0,2,0,0,0,0|2,0,0]=4 5388 B11R1.74 OC(=O)c1cc(I)cc(c1)I 1P002FE6 [0,2,0,0,0,0|2,0,0]=4 5389 B11R1.74 OC(=O)c1cc(N)cc(c1)N 1P003J1A [0,2,0,0,0,0|2,0,0]=4 5390 B11R1.74 OC(=O)c1cc(N)cc(c1)N 1P003J1B [0,2,0,0,0,0|2,0,0]=4 5391 B11R1.74 Oc1cc(Br)cc(c1)C(=O)N 1P000MCI [0,2,0,0,0,0|1,0,0]=3 5392 B11R1.74 Oc1cc(Br)cc(c1)C(=O)O 1P001CYX [0,2,0,0,0,0|2,0,0]=4 5393 B11R1.74 Oc1cc(Cl)cc(c1)C(=O)O 1P00IA3H [0,2,0,0,0,0|2,0,0]=4 5394 B11R1.74 Oc1cc(F)cc(c1)C(=O)C 1P01C7SA [0,2,0,0,0,0|2,0,0]=4 5395 B11R1.74 Oc1cc(F)cc(c1)C(=O)O 1P004VJZ [0,2,0,0,0,0|2,0,0]=4 5396 B11R1.74 Oc1cc(F)nc(c1)C(=O)N 1P028QOO [0,2,0,0,0,0|2,0,0]=4 5397 B11R1.74 Oc1cc(I)cc(c1)C(=O)O 1P00DCAZ [0,2,0,0,0,0|2,0,0]=4 5398 B11R1.74 Oc1cc(O)cc(c1)C(=O)O 1P003J43 [0,2,0,0,0,0|2,0,0]=4 5399 B11R1.74 Sc1cc(Cl)cc(c1)C(=O)O 1P01L0DR [0,2,0,0,0,0|2,0,0]=4 5400 B11R1.74 [O-]C(=O)c1cc(F)cc(c1)F 1P00DA61 [0,2,0,0,0,0|2,0,0]=4 5401 B11R1.266 BrCc1cccc(c1)C(=O)C 1P00ID39 [0,2,0,0,0,0|2,0,0]=4 5402 B11R1.266 BrCc1cccc(c1)C(=O)N 1P00DBVK [0,2,0,0,0,0|1,0,0]=3 5403 B11R1.266 BrCc1cccc(c1)C(=O)O 1P00ED4H [0,2,0,0,0,0|2,0,0]=4 5404 B11R1.266 C#Cc1cccc(c1)C(=O)C 1P001BZ2 [0,2,0,0,0,0|2,0,0]=4 5405 B11R1.266 C#Cc1cccc(c1)C(=O)N 1P00EIL7 [0,2,0,0,0,0|1,0,0]=3 5406 B11R1.266 C#Cc1cccc(c1)C(=O)O 1P008S5E [0,2,0,0,0,0|2,0,0]=4 5407 B11R1.266 C#Cc1cncc(c1)C(=O)N 1P01BHZA [0,2,0,0,0,0|0,0,0]=2 5408 B11R1.266 C#Cc1cncc(c1)C(=O)O 1P009JX9 [0,2,0,0,0,0|1,0,0]=3 5409 B11R1.266 C=Cc1cccc(c1)C(=O)O 1P007L22 [0,2,0,0,0,0|2,0,0]=4 5410 B11R1.266 CCc1cccc(c1)C(=O)C 1P006XDU [0,2,0,0,0,0|2,0,0]=4 5411 B11R1.266 CCc1cccc(c1)C(=O)O 1P00EAUJ [0,2,0,0,0,0|2,0,0]=4 5412 B11R1.266 CCc1cncc(c1)C(=O)O 1P00CJQE [0,2,0,0,0,0|1,0,0]=3 5413 B11R1.266 CCc1cncc(c1)C(=O)O 1P027V7G [0,2,0,0,0,0|1,0,0]=3 5414 B11R1.266 CCc1cnnc(c1)C(=O)[O-] 1P027Y5H [0,2,0,0,0,0|2,0,0]=4 5415 B11R1.266 CNc1cccc(c1)C(=O)N 1P028GEU [0,2,0,0,0,0|1,0,0]=3 5416 B11R1.266 CNc1cccc(c1)C(=O)O 1P000JBB [0,2,0,0,0,0|2,0,0]=4 5417 B11R1.266 CNc1cccc(c1)C(=O)O 1P003IPC [0,2,0,0,0,0|2,0,0]=4 5418 B11R1.266 CNc1ccnc(c1)C(=O)N 1P01A6TW [0,2,0,0,0,0|2,0,0]=4 5419 B11R1.266 CNc1cncc(c1)C(=O)O 1P0034MI [0,2,0,0,0,0|1,0,0]=3 5420 B11R1.266 CNc1cnnc(c1)C(=O)[O-] 1P027XLP [0,2,0,0,0,0|2,0,0]=4 5421 B11R1.266 CO[n+]1cccc(c1)C(=O)O 1P01EWV7 [0,2,0,0,0,0|1,0,1]=4 5422 B11R1.266 COc1cccc(c1)C(=N)N 1P002S65 [0,2,0,0,0,0|2,0,0]=4 5423 B11R1.266 COc1cccc(c1)C(=O)C 1P003K3S [0,2,0,0,0,0|2,0,0]=4 5424 B11R1.266 COc1cccc(c1)C(=O)Cl 1P003K40 [0,2,0,0,0,0|2,0,0]=4 5425 B11R1.266 COc1cccc(c1)C(=O)N 1P003K3U [0,2,0,0,0,0|1,0,0]=3 5426 B11R1.266 COc1cccc(c1)C(=O)O 1P003K3Y [0,2,0,0,0,0|2,0,0]=4 5427 B11R1.266 COc1cccc(c1)C(=S)N 1P003K4U [0,2,0,0,0,0|1,1,0]=4 5428 B11R1.266 COc1cccc(n1)C(=O)N 1P006TE1 [0,2,0,0,0,0|2,0,0]=4 5429 B11R1.266 COc1cncc(c1)C(=O)C 1P00GSKX [0,2,0,0,0,0|1,0,0]=3 5430 B11R1.266 COc1cncc(c1)C(=O)C 1P028NXH [0,2,0,0,0,0|1,0,0]=3 5431 B11R1.266 COc1cncc(c1)C(=O)Cl 1P021ECF [0,2,0,0,0,0|1,0,0]=3 5432 B11R1.266 COc1cncc(c1)C(=O)N 1P00991O [0,2,0,0,0,0|0,0,0]=2 5433 B11R1.266 COc1cncc(c1)C(=O)O 1P002K2I [0,2,0,0,0,0|1,0,0]=3 5434 B11R1.266 COc1cncc(c1)C(=O)O 1P024ZJH [0,2,0,0,0,0|1,0,0]=3 5435 B11R1.266 COc1cncc(c1)C(=S)N 1P01B75P [0,2,0,0,0,0|0,1,0]=3 5436 B11R1.266 COc1cncc(n1)C(=O)N 1P00D2YB [0,2,0,0,0,0|1,0,0]=3 5437 B11R1.266 COc1cncc(n1)C(=O)O 1P00C2GM [0,2,0,0,0,0|2,0,0]=4 5438 B11R1.266 COc1cnnc(c1)C(=O)O 1P021EJ1 [0,2,0,0,0,0|2,0,0]=4 5439 B11R1.266 COc1nncc(c1)C(=O)O 1P00HX1B [0,2,0,0,0,0|2,0,0]=4 5440 B11R1.266 CSc1cccc(c1)C(=O)C 1P001JER [0,2,0,0,0,0|2,0,0]=4 5441 B11R1.266 CSc1cccc(c1)C(=O)O 1P003IPV [0,2,0,0,0,0|2,0,0]=4 5442 B11R1.266 CSc1cncc(c1)C(=O)O 1P01DNZC [0,2,0,0,0,0|1,0,0]=3 5443 B11R1.266 CSc1cncc(c1)[N+](=O)[O-] 1P00I2R7 [0,2,0,0,0,0|2,0,0]=4 5444 B11R1.266 CSc1cncc(n1)C(=O)O 1P01BS5R [0,2,0,0,0,0|2,0,0]=4 5445 B11R1.266 ClCc1cccc(c1)C(=O)C 1P00C08T [0,2,0,0,0,0|2,0,0]=4 5446 B11R1.266 ClCc1cccc(c1)C(=O)Cl 1P003BQX [0,2,0,0,0,0|2,0,0]=4 5447 B11R1.266 ClCc1cccc(c1)C(=O)N 1P007LPV [0,2,0,0,0,0|1,0,0]=3 5448 B11R1.266 ClCc1cccc(c1)C(=O)O 1P003IO0 [0,2,0,0,0,0|2,0,0]=4 5449 B11R1.266 FCc1cccc(c1)C(=O)O 1P0087MQ [0,2,0,0,0,0|2,0,0]=4 5450 B11R1.266 N#Cc1cccc(c1)C(=O)C 1P003JA3 [0,2,0,0,0,0|2,0,0]=4 5451 B11R1.266 N#Cc1cccc(c1)C(=O)Cl 1P003JSU [0,2,0,0,0,0|2,0,0]=4 5452 B11R1.266 N#Cc1cccc(c1)C(=O)N 1P00BY55 [0,2,0,0,0,0|1,0,0]=3 5453 B11R1.266 N#Cc1cccc(c1)C(=O)O 1P003JST [0,2,0,0,0,0|2,0,0]=4 5454 B11R1.266 N#Cc1cccc(n1)C(=O)N 1P00E2W9 [0,2,0,0,0,0|2,0,0]=4 5455 B11R1.266 N#Cc1cncc(c1)C(=O)C 1P009B2Y [0,2,0,0,0,0|1,0,0]=3 5456 B11R1.266 N#Cc1cncc(c1)C(=O)O 1P003N65 [0,2,0,0,0,0|1,0,0]=3 5457 B11R1.266 N#Cc1nccc(c1)C(=O)N 1P01E9SJ [0,2,0,0,0,0|2,0,0]=4 5458 B11R1.266 NCC=1C=NC=C(C(=O)N)C1 1P01FWS0 [0,2,0,0,0,0|0,0,0]=2 5459 B11R1.266 NCc1cccc(c1)C(=N)N 1P00C06O [0,2,0,0,0,0|2,0,0]=4 5460 B11R1.266 NCc1cccc(c1)C(=N)N 1P00FCW6 [0,2,0,0,0,0|2,0,0]=4 5461 B11R1.266 NCc1cccc(c1)C(=O)C 1P01BFFX [0,2,0,0,0,0|2,0,0]=4 5462 B11R1.266 NCc1cccc(c1)C(=O)N 1P000877 [0,2,0,0,0,0|1,0,0]=3 5463 B11R1.266 NCc1cccc(c1)C(=O)N 1P019E58 [0,2,0,0,0,0|1,0,0]=3 5464 B11R1.266 NCc1cccc(c1)C(=O)O 1P003A60 [0,2,0,0,0,0|2,0,0]=4 5465 B11R1.266 NCc1cccc(c1)C(=O)O 1P007OWA [0,2,0,0,0,0|2,0,0]=4 5466 B11R1.266 NCc1cccc(c1)C(=S)N 1P027VL5 [0,2,0,0,0,0|1,1,0]=4 5467 B11R1.266 NCc1ccnc(c1)C(=O)N 1P01BDSJ [0,2,0,0,0,0|2,0,0]=4 5468 B11R1.266 NCc1ccnc(c1)C(=O)N 1P028GYK [0,2,0,0,0,0|2,0,0]=4 5469 B11R1.266 NCc1cncc(c1)C(=O)O 1P028EF4 [0,2,0,0,0,0|1,0,0]=3 5470 B11R1.266 NNc1cccc(c1)C(=O)N 1P01FLEW [0,2,0,0,0,0|1,0,0]=3 5471 B11R1.266 NNc1cccc(c1)C(=O)O 1P00346J [0,2,0,0,0,0|2,0,0]=4 5472 B11R1.266 NNc1cccc(c1)C(=O)O 1P003JZO [0,2,0,0,0,0|2,0,0]=4 5473 B11R1.266 O=Cc1cccc(c1)C(=O)C 1P003JA2 [0,2,0,0,0,0|2,0,0]=4 5474 B11R1.266 O=Cc1cccc(c1)C(=O)N 1P000TDM [0,2,0,0,0,0|1,0,0]=3 5475 B11R1.266 O=Cc1cccc(c1)C(=O)O 1P00343W [0,2,0,0,0,0|2,0,0]=4 5476 B11R1.266 O=Cc1cncc(c1)C(=C)C 1P028B56 [0,2,0,0,0,0|2,0,0]=4 5477 B11R1.266 O=Cc1cncc(c1)C(=O)O 1P003XKW [0,2,0,0,0,0|1,0,0]=3 5478 B11R1.266 O=Cc1cncc(c1)C(=O)O 1P01FLF0 [0,2,0,0,0,0|1,0,0]=3 5479 B11R1.266 O=[BH]c1cccc(c1)C(=O)Cl 1P00BZTJ [0,2,0,0,0,0|2,0,0]=4 5480 B11R1.266 OCc1cccc(c1)C(=O)C 1P000OER [0,2,0,0,0,0|2,0,0]=4 5481 B11R1.266 OCc1cccc(c1)C(=O)N 1P000TYC [0,2,0,0,0,0|1,0,0]=3 5482 B11R1.266 OCc1cccc(c1)C(=O)O 1P00BCQY [0,2,0,0,0,0|2,0,0]=4 5483 B11R1.266 OCc1cccc(n1)C(=O)N 1P00CN6L [0,2,0,0,0,0|2,0,0]=4 5484 B11R1.266 OCc1cncc(c1)C(=O)O 1P0285TB [0,2,0,0,0,0|1,0,0]=3 5485 B11R1.266 SCc1cccc(c1)C(=O)O 1P00BXNU [0,2,0,0,0,0|2,0,0]=4 5486 B11R1.266 SCc1cccc(n1)C(=O)N 1P01A621 [0,2,0,0,0,0|2,0,0]=4 5487 B9R1.13 NC(=O)Cc1ccc[nH]1 1P00IG80 [0,0,1,1,0,0|0,0,2]=4 5488 B9R1.13 NC(=O)Cc1cccs1 1P003V97 [0,0,1,1,0,0|1,0,1]=4 5489 B9R1.13 NC(=O)Cc1cnc[nH]1 1P028C2D [0,0,1,1,0,0|1,0,1]=4 5490 B9R1.13 NC(=O)Cc1cscc1 1P009XM0 [0,0,1,1,0,0|1,0,1]=4 5491 B9R1.13 NC(=O)Cn1cccn1 1P007T21 [0,0,1,1,0,0|1,0,1]=4 5492 B9R1.69 Brc1ccc(c(=O)[nH]1)N 1P0092XJ [0,0,1,1,0,0|2,0,0]=4 5493 B9R1.69 Cc1ccc(=N)[nH]c1N 1P00DJKY [0,0,1,1,0,0|1,0,1]=4 5494 B9R1.69 Cc1ccc(c(=O)[nH]1)Br 1P00380Z [0,0,1,1,0,0|2,0,0]=4 5495 B9R1.69 Cc1ncc(c(=O)[nH]1)Br 1P001XXP [0,0,1,1,0,0|1,0,1]=4 5496 B9R1.69 Cc1ncc(c(=O)[nH]1)C 1P00313P [0,0,1,1,0,0|0,0,2]=4 5497 B9R1.69 Cc1ncc(c(=O)[nH]1)I 1P009540 [0,0,1,1,0,0|1,0,1]=4 5498 B9R1.69 Clc1ccc(c(=O)[nH]1)Br 1P00GNEE [0,0,1,1,0,0|2,0,0]=4 5499 B9R1.69 Clc1ccc(c(=O)[nH]1)C 1P000SBF [0,0,1,1,0,0|1,0,1]=4 5500 B9R1.69 Clc1ccc(c(=O)[nH]1)Cl 1P01I7DS [0,0,1,1,0,0|2,0,0]=4 5501 B9R1.69 Clc1ccc(c(=O)[nH]1)F 1P00132U [0,0,1,1,0,0|2,0,0]=4 5502 B9R1.69 Clc1ncc(c(=O)[nH]1)C 1P009K9S [0,0,1,1,0,0|1,0,1]=4 5503 B9R1.69 Clc1ncc(c(=O)[nH]1)Cl 1P01BEWZ [0,0,1,1,0,0|2,0,0]=4 5504 B9R1.69 Clc1ncc(c(=O)[nH]1)Cl 1P01XAHO [0,0,1,1,0,0|2,0,0]=4 5505 B9R1.69 Clc1ncc(c(=O)[nH]1)F 1P001O0F [0,0,1,1,0,0|2,0,0]=4 5506 B9R1.69 Clc1ncc(c(=O)[nH]1)I 1P01JUG7 [0,0,1,1,0,0|2,0,0]=4 5507 B9R1.69 Nc1ncc(c(=O)[nH]1)Br 1P0015Q0 [0,0,1,1,0,0|2,0,0]=4 5508 B9R1.69 Nc1ncc(c(=O)[nH]1)Br 1P00EAYR [0,0,1,1,0,0|2,0,0]=4 5509 B9R1.69 Nc1ncc(c(=O)[nH]1)C 1P001RVP [0,0,1,1,0,0|1,0,1]=4 5510 B9R1.69 Nc1ncc(c(=O)[nH]1)Cl 1P01E83P [0,0,1,1,0,0|2,0,0]=4 5511 B9R1.69 Nc1ncc(c(=O)[nH]1)F 1P001YHK [0,0,1,1,0,0|2,0,0]=4 5512 B9R1.69 Nc1ncc(c(=O)[nH]1)I 1P00CKRQ [0,0,1,1,0,0|2,0,0]=4 5513 B9R1.69 Nc1ncc(c(=O)[nH]1)N 1P003AMC [0,0,1,1,0,0|2,0,0]=4 5514 B11R2.4 N[C@H]1C[C@@H]1c2cccnc2 1P00JQJ5 [0,0,0,1,0,1|1,0,1]=4 5515 B11R2.10 Brc1cc2c([nH]1)ccnc2 1P01JVDC [0,0,0,1,0,1|1,0,0]=3 5516 B11R2.10 Brc1cc2c([nH]1)cncc2 1P008A5F [0,0,0,1,0,1|2,0,0]=4 5517 B11R2.10 Brc1cc2c([nH]1)nccc2 1P007DJB [0,0,0,1,0,1|1,0,0]=3 5518 B11R2.10 Brc1cc2c([nH]1)ncnc2 1P00IG2U [0,0,0,1,0,1|2,0,0]=4 5519 B11R2.10 Brc1cc2c(s1)cccn2 1P00GUQS [0,0,0,1,0,1|2,0,0]=4 5520 B11R2.10 Brc1cc2c(s1)ccnc2 1P00GUQT [0,0,0,1,0,1|1,1,0]=4 5521 B11R2.10 Brc1cc2c(s1)cncc2 1P005B45 [0,0,0,1,0,1|2,0,0]=4 5522 B11R2.10 Brc1cc2c(s1)nccc2 1P00FHC1 [0,0,0,1,0,1|1,1,0]=4 5523 B11R2.10 Brc1nc2c([nH]1)cccc2 1P003H88 [0,0,0,1,0,1|2,0,0]=4 5524 B11R2.10 Brc1nc2c([nH]1)nccc2 1P0018BN [0,0,0,1,0,1|1,0,0]=3 5525 B11R2.10 Brc1nc2c(s1)cccn2 1P01A2FZ [0,0,0,1,0,1|1,0,1]=4 5526 B11R2.10 Brc1nc2c(s1)nccc2 1P007375 [0,0,0,1,0,1|1,1,0]=4 5527 B11R2.10 CC1Cc2c(N1)ccnc2 1P01AMN5 [0,0,0,1,0,1|1,0,1]=4 5528 B11R2.10 CC1Cc2c(N1)nccc2 1P00GA8F [0,0,0,1,0,1|1,0,1]=4 5529 B11R2.10 Cc1cc2c([nH]1)cccc2 1P003I67 [0,0,0,1,0,1|2,0,0]=4 5530 B11R2.10 Cc1cc2c([nH]1)cccn2 1P00FDS9 [0,0,0,1,0,1|2,0,0]=4 5531 B11R2.10 Cc1cc2c([nH]1)ccnc2 1P000AOM [0,0,0,1,0,1|1,0,0]=3 5532 B11R2.10 Cc1cc2c([nH]1)cncc2 1P00FD1N [0,0,0,1,0,1|2,0,0]=4 5533 B11R2.10 Cc1cc2c([nH]1)nccc2 1P002OD8 [0,0,0,1,0,1|1,0,0]=3 5534 B11R2.10 Cc1cc2c([nH]1)nccn2 1P01DYBU [0,0,0,1,0,1|2,0,0]=4 5535 B11R2.10 Cc1cc2c([nH]1)ncnc2 1P00BUDC [0,0,0,1,0,1|2,0,0]=4 5536 B11R2.10 Cc1cc2c(o1)cccn2 1P01IBC2 [0,0,0,1,0,1|2,0,0]=4 5537 B11R2.10 Cc1nc2c([nH]1)cccc2 1P003I5B [0,0,0,1,0,1|2,0,0]=4 5538 B11R2.10 Cc1nc2c([nH]1)cccn2 1P005ZCI [0,0,0,1,0,1|1,0,1]=4 5539 B11R2.10 Cc1nc2c([nH]1)cncc2 1P00EDR9 [0,0,0,1,0,1|1,0,1]=4 5540 B11R2.10 Cc1nc2c([nH]1)nccc2 1P00J2H2 [0,0,0,1,0,1|1,0,0]=3 5541 B11R2.10 Cc1nc2c(o1)cccn2 1P008GLS [0,0,0,1,0,1|1,0,1]=4 5542 B11R2.10 Cc1nc2c(o1)ccnc2 1P00G2NS [0,0,0,1,0,1|1,0,1]=4 5543 B11R2.10 Cc1nc2c(o1)nccc2 1P00IHCR [0,0,0,1,0,1|1,0,1]=4 5544 B11R2.10 Cc1nc2c(s1)ccnc2 1P00H2XF [0,0,0,1,0,1|1,1,0]=4 5545 B11R2.10 Cc1nc2c(s1)ccnc2 1P01BVUQ [0,0,0,1,0,1|1,1,0]=4 5546 B11R2.10 Clc1cc2c([nH]1)cccc2 1P00FGG8 [0,0,0,1,0,1|2,0,0]=4 5547 B11R2.10 Clc1cc2c(s1)ccnc2 1P002WWE [0,0,0,1,0,1|1,1,0]=4 5548 B11R2.10 Clc1nc2c([nH]1)cccc2 1P003HID [0,0,0,1,0,1|2,0,0]=4 5549 B11R2.10 Clc1nc2c([nH]1)cccn2 1P007Y5T [0,0,0,1,0,1|1,0,1]=4 5550 B11R2.10 Clc1nc2c([nH]1)nccc2 1P0010X9 [0,0,0,1,0,1|1,0,0]=3 5551 B11R2.10 Clc1nc2c(o1)cccn2 1P0022RO [0,0,0,1,0,1|1,0,1]=4 5552 B11R2.10 Clc1nc2c(o1)cncc2 1P000PC6 [0,0,0,1,0,1|1,0,1]=4 5553 B11R2.10 Clc1nc2c(o1)nccc2 1P001RXI [0,0,0,1,0,1|1,0,1]=4 5554 B11R2.10 Clc1nc2c(s1)cccn2 1P007K4T [0,0,0,1,0,1|1,0,1]=4 5555 B11R2.10 Clc1nc2c(s1)ccnc2 1P004AH9 [0,0,0,1,0,1|1,1,0]=4 5556 B11R2.10 Clc1nc2c(s1)nccc2 1P006A3D [0,0,0,1,0,1|1,1,0]=4 5557 B11R2.10 Fc1cc2c([nH]1)cccc2 1P01DNNI [0,0,0,1,0,1|2,0,0]=4 5558 B11R2.10 Ic1cc2c([nH]1)cccc2 1P002TAV [0,0,0,1,0,1|2,0,0]=4 5559 B11R2.10 Ic1cc2c([nH]1)ccnc2 1P000JLY [0,0,0,1,0,1|1,0,0]=3 5560 B11R2.10 Ic1cc2c([nH]1)cncc2 1P000JM7 [0,0,0,1,0,1|2,0,0]=4 5561 B11R2.10 Ic1cc2c([nH]1)nccc2 1P000JNF [0,0,0,1,0,1|1,0,0]=3 5562 B11R2.10 Ic1cc2c([nH]1)ncnc2 1P00I46E [0,0,0,1,0,1|2,0,0]=4 5563 B11R2.10 NC1Cc2c(C1)cccn2 1P01EIL9 [0,0,0,1,0,1|1,0,1]=4 5564 B11R2.10 NC1Cc2c(C1)ccnc2 1P01C2HM [0,0,0,1,0,1|1,0,1]=4 5565 B11R2.10 Nc1cc2c([nH]1)cccc2 1P00C33H [0,0,0,1,0,1|2,0,0]=4 5566 B11R2.10 Nc1cc2c(s1)cccc2 1P00DKVI [0,0,0,1,0,1|1,1,0]=4 5567 B11R2.10 Nc1cc2c(s1)ncnc2 1P027UTP [0,0,0,1,0,1|1,1,0]=4 5568 B11R2.10 Nc1cn2c(n1)cccn2 1P028MS2 [0,0,0,1,0,1|2,0,0]=4 5569 B11R2.10 Nc1cn2c(n1)cncc2 1P000Z0G [0,0,0,1,0,1|2,0,0]=4 5570 B11R2.10 Nc1cn2c(n1)nccc2 1P007JYB [0,0,0,1,0,1|2,0,0]=4 5571 B11R2.10 Nc1nc2c([nH]1)cccc2 1P0063TV [0,0,0,1,0,1|2,0,0]=4 5572 B11R2.10 Nc1nc2c([nH]1)ccnc2 1P00618Y [0,0,0,1,0,1|1,0,0]=3 5573 B11R2.10 Nc1nc2c([nH]1)nccc2 1P0011TA [0,0,0,1,0,1|1,0,0]=3 5574 B11R2.10 Nc1nc2c(o1)cccc2 1P0033KR [0,0,0,1,0,1|1,0,1]=4 5575 B11R2.10 Nc1nc2c(o1)cccn2 1P00C9F9 [0,0,0,1,0,1|1,0,0]=3 5576 B11R2.10 Nc1nc2c(o1)ccnc2 1P000F0R [0,0,0,1,0,1|0,0,1]=3 5577 B11R2.10 Nc1nc2c(o1)cncc2 1P000S0R [0,0,0,1,0,1|1,0,0]=3 5578 B11R2.10 Nc1nc2c(o1)nccc2 1P00760G [0,0,0,1,0,1|0,0,1]=3 5579 B11R2.10 Nc1nc2c(s1)cccc2 1P003H1F [0,0,0,1,0,1|1,1,0]=4 5580 B11R2.10 Nc1nc2c(s1)cccc2 1P00IJ00 [0,0,0,1,0,1|1,1,0]=4 5581 B11R2.10 Nc1nc2c(s1)cccn2 1P007NYC [0,0,0,1,0,1|1,0,0]=3 5582 B11R2.10 Nc1nc2c(s1)ccnc2 1P0087CC [0,0,0,1,0,1|0,1,0]=3 5583 B11R2.10 Nc1nc2c(s1)nccc2 1P007IWS [0,0,0,1,0,1|0,1,0]=3 5584 B11R2.10 Nc1nc2c(s1)nccn2 1P01C6F5 [0,0,0,1,0,1|1,1,0]=4 5585 B11R2.10 Nc1nc2c(s1)ncnc2 1P006F61 [0,0,0,1,0,1|1,1,0]=4 5586 B11R2.10 Nc1nn2c(c1)nccc2 1P01BEIQ [0,0,0,1,0,1|2,0,0]=4 5587 B11R2.10 Nc1nn2c(n1)cncc2 1P004OEO [0,0,0,1,0,1|2,0,0]=4 5588 B11R2.10 Nc1nn2c(n1)nccc2 1P0010VZ [0,0,0,1,0,1|2,0,0]=4 5589 B11R2.10 O=C1Cc2c(C1)cccc2 1P003HWU [0,0,0,1,0,1|2,0,0]=4 5590 B11R2.10 O=C1Cc2c(N1)cccc2 1P003RGZ [0,0,0,1,0,1|1,0,0]=3 5591 B11R2.10 O=C1Cc2c(N1)ccnc2 1P007MBX [0,0,0,1,0,1|0,0,0]=2 5592 B11R2.10 O=C1Cc2c(N1)cncc2 1P002Z4A [0,0,0,1,0,1|1,0,0]=3 5593 B11R2.10 O=C1Cc2c(N1)cncc2 1P00DCAB [0,0,0,1,0,1|1,0,0]=3 5594 B11R2.10 O=C1Cc2c(N1)nccc2 1P00381R [0,0,0,1,0,1|0,0,0]=2 5595 B11R2.10 O=C1Cc2c(N1)nccc2 1P00HX1N [0,0,0,1,0,1|0,0,0]=2 5596 B11R2.10 O=C1Cc2c(N1)ncnc2 1P00EYLJ [0,0,0,1,0,1|1,0,0]=3 5597 B11R2.10 O=C1Cc2c(O1)cccc2 1P00IABW [0,0,0,1,0,1|2,0,0]=4 5598 B11R2.10 O=C1Nc2c(C1)nccc2 1P003834 [0,0,0,1,0,1|1,0,0]=3 5599 B11R2.10 O=c1[nH]c2c([nH]1)cccc2 1P00IBCA [0,0,0,1,0,1|1,0,0]=3 5600 B11R2.10 O=c1[nH]c2c([nH]1)cccn2 1P001UGG [0,0,0,1,0,1|0,0,0]=2 5601 B11R2.10 O=c1[nH]c2c([nH]1)ccnc2 1P00ICXA [0,0,0,1,0,1|0,0,0]=2 5602 B11R2.10 O=c1[nH]c2c([nH]1)nccn2 1P001UGF [0,0,0,1,0,1|1,0,0]=3 5603 B11R2.10 O=c1cc2c(o1)cocc2 1P00G5JB [0,0,0,1,0,1|2,0,0]=4 5604 B11R2.10 O=c1cc2n([nH]1)cccc2 1P00EIUQ [0,0,0,1,0,1|2,0,0]=4 5605 B11R2.10 O=c1oc2c([nH]1)cccn2 1P008Z6E [0,0,0,1,0,1|1,0,0]=3 5606 B11R2.10 O=c1oc2c([nH]1)ccnc2 1P00FGZI [0,0,0,1,0,1|0,0,0]=2 5607 B11R2.10 O=c1oc2c([nH]1)cncc2 1P01DDQ6 [0,0,0,1,0,1|1,0,0]=3 5608 B11R2.10 O=c1oc2c([nH]1)nccc2 1P003TZC [0,0,0,1,0,1|0,0,0]=2 5609 B11R2.10 O=c1oc2c(o1)cccc2 1P00BCH5 [0,0,0,1,0,1|2,0,0]=4 5610 B11R2.10 O=c1sc2c([nH]1)cccc2 1P003HVZ [0,0,0,1,0,1|1,0,0]=3 5611 B11R2.10 Oc1cc2c([nH]1)cccc2 1P00ALC2 [0,0,0,1,0,1|1,0,1]=4 5612 B11R2.10 Oc1cc2c([nH]1)nccc2 1P000SHY [0,0,0,1,0,1|0,0,1]=3 5613 B11R2.10 S=C1Cc2c(N1)cccc2 1P00DAOH [0,0,0,1,0,1|1,1,0]=4 5614 B11R2.10 S=c1[nH]c2c([nH]1)cccn2 1P002YUY [0,0,0,1,0,1|0,1,0]=3 5615 B11R2.10 S=c1[nH]c2c([nH]1)ccnc2 1P0066IT [0,0,0,1,0,1|0,1,0]=3 5616 B11R2.10 S=c1oc2c([nH]1)cccn2 1P001Z1Z [0,0,0,1,0,1|1,0,1]=4 5617 B11R2.10 S=c1oc2c([nH]1)cncc2 1P00974L [0,0,0,1,0,1|1,0,1]=4 5618 B11R2.10 S=c1oc2c([nH]1)nccc2 1P00DEE0 [0,0,0,1,0,1|0,1,0]=3 5619 B11R2.10 S=c1sc2c([nH]1)cccc2 1P002QCO [0,0,0,1,0,1|1,1,0]=4 5620 B11R2.10 S=c1sc2c([nH]1)cccc2 1P00HYRI [0,0,0,1,0,1|1,1,0]=4 5621 B11R2.10 S=c1sc2c([nH]1)ccnc2 1P000DXR [0,0,0,1,0,1|0,1,0]=3 5622 B11R2.10 S=c1sc2c([nH]1)nccn2 1P004KT1 [0,0,0,1,0,1|1,1,0]=4 5623 B11R2.10 Sc1nc2c([nH]1)cccc2 1P0033U1 [0,0,0,1,0,1|1,1,0]=4 5624 B11R2.10 Sc1nc2c(o1)cccn2 1P006Z84 [0,0,0,1,0,1|0,1,1]=4 5625 B11R2.10 Sc1nc2c(s1)cccn2 1P00IKP0 [0,0,0,1,0,1|0,1,1]=4 5626 B11R2.10 Sc1nc2c(s1)ccnc2 1P00ELCB [0,0,0,1,0,1|1,1,0]=4 5627 B11R2.10 Sc1nc2c(s1)nccc2 1P00EBPH [0,0,0,1,0,1|1,1,0]=4 5628 B11R2.363 Brc1ccc2c(c1)CC2=O 1P0286CQ [0,1,0,1,0,0|2,0,0]=4 5629 B11R2.1 Brc1c[nH]c2c1cccc2 1P001LDH [0,1,0,1,0,0|2,0,0]=4 5630 B11R2.1 Brc1c[nH]c2c1cccn2 1P003JKG [0,1,0,1,0,0|1,0,0]=3 5631 B11R2.1 Brc1c[nH]c2c1cccn2 1P01A7G2 [0,1,0,1,0,0|1,0,0]=3 5632 B11R2.1 Brc1c[nH]c2c1cncc2 1P002OD9 [0,1,0,1,0,0|1,0,0]=3 5633 B11R2.1 Brc1c[nH]c2c1cncn2 1P0021N7 [0,1,0,1,0,0|2,0,0]=4 5634 B11R2.1 Brc1c[nH]c2c1nccn2 1P00DIBX [0,1,0,1,0,0|2,0,0]=4 5635 B11R2.1 Brc1coc2c1cccn2 1P006734 [0,1,0,1,0,0|1,0,1]=4 5636 B11R2.1 Brc1coc2c1cncc2 1P006732 [0,1,0,1,0,0|1,0,1]=4 5637 B11R2.1 Brc1csc2c1cccn2 1P002VKT [0,1,0,1,0,0|1,1,0]=4 5638 B11R2.1 Brc1csc2c1cncc2 1P002WWG [0,1,0,1,0,0|1,1,0]=4 5639 B11R2.1 Brc1n[nH]c2c1cccc2 1P003JG4 [0,1,0,1,0,0|2,0,0]=4 5640 B11R2.1 Brc1n[nH]c2c1cccn2 1P003JG7 [0,1,0,1,0,0|1,0,0]=3 5641 B11R2.1 Brc1n[nH]c2c1cncc2 1P00EDCS [0,1,0,1,0,0|1,0,0]=3 5642 B11R2.1 Brc1n[nH]c2c1cncn2 1P000NNN [0,1,0,1,0,0|2,0,0]=4 5643 B11R2.1 Brc1n[nH]c2c1nccn2 1P005333 [0,1,0,1,0,0|2,0,0]=4 5644 B11R2.1 Brc1noc2c1cccn2 1P00IEK7 [0,1,0,1,0,0|1,0,1]=4 5645 B11R2.1 Brc1nsc2c1cccn2 1P00DL7U [0,1,0,1,0,0|1,0,1]=4 5646 B11R2.1 Cc1[nH]nc2c1cccc2 1P00J2W9 [0,1,0,1,0,0|2,0,0]=4 5647 B11R2.1 Cc1[nH]nc2c1cccc2 1P01B6UF [0,1,0,1,0,0|2,0,0]=4 5648 B11R2.1 Cc1c[nH]c2c1cccc2 1P003K87 [0,1,0,1,0,0|2,0,0]=4 5649 B11R2.1 Cc1c[nH]c2c1cccn2 1P003K71 [0,1,0,1,0,0|1,0,0]=3 5650 B11R2.1 Cc1c[nH]c2c1cncc2 1P002M10 [0,1,0,1,0,0|1,0,0]=3 5651 B11R2.1 Cc1n[nH]c2c1cccc2 1P00I6HC [0,1,0,1,0,0|2,0,0]=4 5652 B11R2.1 Cc1n[nH]c2c1cccn2 1P000DQP [0,1,0,1,0,0|1,0,0]=3 5653 B11R2.1 Cc1n[nH]c2c1cncc2 1P008ZNQ [0,1,0,1,0,0|1,0,0]=3 5654 B11R2.1 Cc1n[nH]c2c1cncc2 1P028IVW [0,1,0,1,0,0|1,0,0]=3 5655 B11R2.1 Cc1n[nH]c2c1nccn2 1P0094EK [0,1,0,1,0,0|2,0,0]=4 5656 B11R2.1 Cc1nsc2c1cccn2 1P0060TS [0,1,0,1,0,0|1,0,1]=4 5657 B11R2.1 Clc1c[nH]c2c1cccc2 1P001YOG [0,1,0,1,0,0|2,0,0]=4 5658 B11R2.1 Clc1c[nH]c2c1cccn2 1P003JQU [0,1,0,1,0,0|1,0,0]=3 5659 B11R2.1 Clc1c[nH]c2c1cncn2 1P0099KS [0,1,0,1,0,0|2,0,0]=4 5660 B11R2.1 Clc1n[nH]c2c1cccc2 1P002XU8 [0,1,0,1,0,0|2,0,0]=4 5661 B11R2.1 Clc1n[nH]c2c1cccn2 1P000DZM [0,1,0,1,0,0|1,0,0]=3 5662 B11R2.1 Clc1n[nH]c2c1nccn2 1P000RO2 [0,1,0,1,0,0|2,0,0]=4 5663 B11R2.1 Fc1c[nH]c2c1cccn2 1P000RAH [0,1,0,1,0,0|1,0,0]=3 5664 B11R2.1 Fc1n[nH]c2c1cccc2 1P006K58 [0,1,0,1,0,0|2,0,0]=4 5665 B11R2.1 Ic1c[nH]c2c1cccc2 1P002TA1 [0,1,0,1,0,0|2,0,0]=4 5666 B11R2.1 Ic1c[nH]c2c1cccn2 1P002ODL [0,1,0,1,0,0|1,0,0]=3 5667 B11R2.1 Ic1c[nH]c2c1cncc2 1P004K3Q [0,1,0,1,0,0|1,0,0]=3 5668 B11R2.1 Ic1c[nH]c2c1cncn2 1P0021N6 [0,1,0,1,0,0|2,0,0]=4 5669 B11R2.1 Ic1c[nH]c2c1nccn2 1P00IFZF [0,1,0,1,0,0|2,0,0]=4 5670 B11R2.1 Ic1n[nH]c2c1cccc2 1P00H8K8 [0,1,0,1,0,0|2,0,0]=4 5671 B11R2.1 Ic1n[nH]c2c1cccn2 1P000E0P [0,1,0,1,0,0|1,0,0]=3 5672 B11R2.1 Ic1n[nH]c2c1cncc2 1P00125N [0,1,0,1,0,0|1,0,0]=3 5673 B11R2.1 N=c1[nH][nH]c2c1cncc2 1P00H3MW [0,1,0,1,0,0|1,0,0]=3 5674 B11R2.1 NC1=NCc2c1cccc2 1P003JAG [0,1,0,1,0,0|2,0,0]=4 5675 B11R2.1 NC1=NCc2c1cccc2 1P00G3KS [0,1,0,1,0,0|2,0,0]=4 5676 B11R2.1 NC1CCc2c1cccn2 1P009315 [0,1,0,1,0,0|1,0,1]=4 5677 B11R2.1 NC1COc2c1cccn2 1P01D998 [0,1,0,1,0,0|0,0,2]=4 5678 B11R2.1 N[C@H]1CCc2c1cccn2 1P024TYR [0,1,0,1,0,0|1,0,1]=4 5679 B11R2.1 Nc1[nH]nc2c1nccn2 1P005334 [0,1,0,1,0,0|2,0,0]=4 5680 B11R2.1 Nc1c[nH]c2c1cccc2 1P00EB72 [0,1,0,1,0,0|2,0,0]=4 5681 B11R2.1 Nc1c[nH]c2c1cccn2 1P0003SB [0,1,0,1,0,0|1,0,0]=3 5682 B11R2.1 Nc1c[nH]c2c1cncc2 1P01KL3I [0,1,0,1,0,0|1,0,0]=3 5683 B11R2.1 Nc1cnn2c1cccn2 1P01BEZJ [0,1,0,1,0,0|2,0,0]=4 5684 B11R2.1 Nc1cnn2c1cncc2 1P021SZ5 [0,1,0,1,0,0|2,0,0]=4 5685 B11R2.1 Nc1cnn2c1cncc2 1P027Z3H [0,1,0,1,0,0|2,0,0]=4 5686 B11R2.1 Nc1csc2c1cccc2 1P001ZVH [0,1,0,1,0,0|1,1,0]=4 5687 B11R2.1 Nc1csc2c1cccc2 1P00CMAA [0,1,0,1,0,0|1,1,0]=4 5688 B11R2.1 Nc1csc2c1cccn2 1P002U7H [0,1,0,1,0,0|0,1,0]=3 5689 B11R2.1 Nc1csc2c1cncc2 1P008UNJ [0,1,0,1,0,0|0,1,0]=3 5690 B11R2.1 Nc1csc2c1nccn2 1P00EEK1 [0,1,0,1,0,0|1,1,0]=4 5691 B11R2.1 Nc1n[nH]c2c1cccc2 1P003JAF [0,1,0,1,0,0|2,0,0]=4 5692 B11R2.1 Nc1n[nH]c2c1cccn2 1P0038YC [0,1,0,1,0,0|1,0,0]=3 5693 B11R2.1 Nc1nnc2n1cccn2 1P000POP [0,1,0,1,0,0|2,0,0]=4 5694 B11R2.1 Nc1nnc2n1cccn2 1P028C0U [0,1,0,1,0,0|2,0,0]=4 5695 B11R2.1 Nc1nnc2n1cncc2 1P028AA9 [0,1,0,1,0,0|2,0,0]=4 5696 B11R2.1 Nc1noc2c1cccc2 1P007AWB [0,1,0,1,0,0|1,0,1]=4 5697 B11R2.1 Nc1noc2c1cccn2 1P006KQ7 [0,1,0,1,0,0|0,0,1]=3 5698 B11R2.1 Nc1noc2c1cncc2 1P000K8U [0,1,0,1,0,0|0,0,1]=3 5699 B11R2.1 Nc1noc2c1cncn2 1P0284V4 [0,1,0,1,0,0|1,0,1]=4 5700 B11R2.1 Nc1noc2c1nccn2 1P0059R1 [0,1,0,1,0,0|1,0,1]=4 5701 B11R2.1 Nc1nsc2c1cccc2 1P002MFD [0,1,0,1,0,0|1,1,0]=4 5702 B11R2.1 Nc1nsc2c1cccn2 1P00ELCG [0,1,0,1,0,0|0,1,0]=3 5703 B11R2.1 Nc1onc2c1cccc2 1P0028QL [0,1,0,1,0,0|1,0,1]=4 5704 B11R2.1 Nc1snc2c1cccc2 1P00BFPG [0,1,0,1,0,0|1,1,0]=4 5705 B11R2.1 Nc1snc2c1cccn2 1P00C82Q [0,1,0,1,0,0|0,1,0]=3 5706 B11R2.1 Nc1snc2c1nccn2 1P028FAJ [0,1,0,1,0,0|1,1,0]=4 5707 B11R2.1 O=C1CCc2c1cccn2 1P00172D [0,1,0,1,0,0|1,0,0]=3 5708 B11R2.1 O=C1CCc2c1cccn2 1P002W77 [0,1,0,1,0,0|1,0,0]=3 5709 B11R2.1 O=C1CCc2c1cncc2 1P0037KQ [0,1,0,1,0,0|1,0,0]=3 5710 B11R2.1 O=C1CNc2[n+]1cccc2 1P01C68T [0,1,0,1,0,0|2,0,0]=4 5711 B11R2.1 O=C1COc2c1cccc2 1P00345D [0,1,0,1,0,0|2,0,0]=4 5712 B11R2.1 O=C1COc2c1cccn2 1P00BJBI [0,1,0,1,0,0|1,0,0]=3 5713 B11R2.1 O=C1CSc2c1cccc2 1P000UBJ [0,1,0,1,0,0|2,0,0]=4 5714 B11R2.1 O=C1NCC2=C1CC=CC2 1P002DF9 [0,1,0,1,0,0|1,0,1]=4 5715 B11R2.1 O=C1NCc2c1cccc2 1P0035II [0,1,0,1,0,0|1,0,0]=3 5716 B11R2.1 O=C1NCc2c1cccn2 1P0034S2 [0,1,0,1,0,0|0,0,0]=2 5717 B11R2.1 O=C1NCc2c1ccnc2 1P00EKI3 [0,1,0,1,0,0|2,0,0]=4 5718 B11R2.1 O=C1NCc2c1cncc2 1P0075NW [0,1,0,1,0,0|0,0,0]=2 5719 B11R2.1 O=C1NCc2c1nccc2 1P009H7O [0,1,0,1,0,0|2,0,0]=4 5720 B11R2.1 O=C1NCc2c1nccn2 1P01XAKD [0,1,0,1,0,0|1,0,0]=3 5721 B11R2.1 O=C1OCc2c1cccc2 1P003U89 [0,1,0,1,0,0|2,0,0]=4 5722 B11R2.1 O=C1OCc2c1cccn2 1P00393G [0,1,0,1,0,0|1,0,0]=3 5723 B11R2.1 O=C1OCc2c1cncc2 1P01C1N0 [0,1,0,1,0,0|1,0,0]=3 5724 B11R2.1 O=C1SCc2c1cccc2 1P000J6E [0,1,0,1,0,0|2,0,0]=4 5725 B11R2.1 O=c1[nH][nH]c2c1cccc2 1P003K1Q [0,1,0,1,0,0|1,0,0]=3 5726 B11R2.1 O=c1[nH][nH]c2c1cccn2 1P002YSA [0,1,0,1,0,0|0,0,0]=2 5727 B11R2.1 O=c1[nH][nH]c2c1ccnc2 1P00DKUW [0,1,0,1,0,0|2,0,0]=4 5728 B11R2.1 O=c1[nH][nH]c2c1nccn2 1P008ZLR [0,1,0,1,0,0|1,0,0]=3 5729 B11R2.1 O=c1[nH]cc2n1cccc2 1P01J549 [0,1,0,1,0,0|2,0,0]=4 5730 B11R2.1 O=c1[nH]nc2n1cccc2 1P003BGD [0,1,0,1,0,0|2,0,0]=4 5731 B11R2.1 O=c1[nH]nc2n1cccn2 1P00ELAY [0,1,0,1,0,0|1,0,0]=3 5732 B11R2.1 O=c1[nH]oc2c1cccc2 1P0034YJ [0,1,0,1,0,0|1,0,0]=3 5733 B11R2.1 O=c1[nH]oc2c1cccn2 1P001YSK [0,1,0,1,0,0|0,0,0]=2 5734 B11R2.1 O=c1s[nH]c2c1cccc2 1P018H3I [0,1,0,1,0,0|1,0,0]=3 5735 B11R2.1 O=c1ssc2c1cccc2 1P001Y0I [0,1,0,1,0,0|2,0,0]=4 5736 B11R2.1 Oc1n[nH]c2c1cccc2 1P0003O7 [0,1,0,1,0,0|1,0,1]=4 5737 B11R2.1 Oc1n[nH]c2c1cncc2 1P00CMIK [0,1,0,1,0,0|0,0,1]=3 5738 B11R2.1 S=c1ssc2c1cccn2 1P00CZZT [0,1,0,1,0,0|1,1,0]=4 5739 B11R2.1 Sc1c[nH]c2c1cccc2 1P00I97N [0,1,0,1,0,0|1,1,0]=4 5740 B11R2.40 NC1(CC1)c2cccnc2 1P0092UL [0,1,0,1,0,0|1,0,1]=4 5741 B11R2.40 NC1(CC1)c2cccnc2 1P00I9HY [0,1,0,1,0,0|1,0,1]=4 5742 B11R2.54 O=C1C(C)c2c1cccc2 1P005NMP [0,1,0,1,0,0|2,0,0]=4 5743 B11R2.239 N1CC(C1)c2cccnc2 1P000LDY [0,1,0,1,0,0|1,0,1]=4 5744 B11R2.239 c1ccc(cn1)C2=CCC2 1P01BW4I [0,1,0,1,0,0|2,0,0]=4 5745 B11R2.468 Brc1cccc2c1C(=O)C2 1P01DZPQ [0,1,0,1,0,0|2,0,0]=4 5746 B11R2.468 Clc1cccc2c1C(=O)C2 1P01DT9P [0,1,0,1,0,0|2,0,0]=4 5747 B11R2.468 Fc1cccc2c1C(=O)C2 1P01BRWO [0,1,0,1,0,0|2,0,0]=4 5748 B11R2.117 Brc1ccc2c(c1)C(=O)C2 1P027UFV [0,1,0,1,0,0|2,0,0]=4 5749 B11R2.117 Fc1ccc2c(c1)C(=O)C2 1P00JSIA [0,1,0,1,0,0|2,0,0]=4 5750 B7R1.1 C=C[C-]1C=CC=C1 1P000X4U [1,0,0,0,1,0|1,0,1]=4 5751 B7R1.1 C=Cc1c[nH]cn1 1P01BJ1I [1,0,0,0,1,0|2,0,0]=4 5752 B7R1.1 C=Cc1c[nH]nc1 1P027OES [1,0,0,0,1,0|2,0,0]=4 5753 B7R1.1 C=Cc1cc[nH]n1 1P003AWK [1,0,0,0,1,0|2,0,0]=4 5754 B7R1.1 C=Cc1ccco1 1P001LLL [1,0,0,0,1,0|2,0,0]=4 5755 B7R1.1 C=Cc1cccs1 1P002FXU [1,0,0,0,1,0|2,0,0]=4 5756 B7R1.1 C=Cc1cncs1 1P01BRJP [1,0,0,0,1,0|2,0,0]=4 5757 B7R1.1 C=Cc1cscc1 1P0012UB [1,0,0,0,1,0|2,0,0]=4 5758 B7R1.1 C=Cc1ncc[nH]1 1P00DIAP [1,0,0,0,1,0|2,0,0]=4 5759 B7R1.1 C=Cc1ncc[nH]1 1P0285M8 [1,0,0,0,1,0|2,0,0]=4 5760 B7R1.1 C=Cc1nccs1 1P00HVP0 [1,0,0,0,1,0|2,0,0]=4 5761 B7R1.1 C=Cn1cccc1 1P0080L9 [1,0,0,0,1,0|2,0,0]=4 5762 B7R1.1 C=Cn1cccn1 1P00289Z [1,0,0,0,1,0|2,0,0]=4 5763 B7R1.1 NCc1c[nH]cc1 1P008B5V [1,0,0,0,1,0|0,0,2]=4 5764 B7R1.1 NCc1c[nH]cn1 1P00FFS6 [1,0,0,0,1,0|1,0,1]=4 5765 B7R1.1 NCc1c[nH]nc1 1P000EI2 [1,0,0,0,1,0|1,0,1]=4 5766 B7R1.1 NCc1cc[nH]n1 1P00398P [1,0,0,0,1,0|1,0,1]=4 5767 B7R1.1 NCc1ccc[nH]1 1P0033BP [1,0,0,0,1,0|0,0,2]=4 5768 B7R1.1 NCc1ccc[nH]1 1P006SOC [1,0,0,0,1,0|0,0,2]=4 5769 B7R1.1 NCc1ccco1 1P00IBDE [1,0,0,0,1,0|1,0,1]=4 5770 B7R1.1 NCc1cccs1 1P002V4I [1,0,0,0,1,0|1,0,1]=4 5771 B7R1.1 NCc1ccn[nH]1 1P008UV1 [1,0,0,0,1,0|1,0,1]=4 5772 B7R1.1 NCc1ccno1 1P0037YF [1,0,0,0,1,0|1,0,1]=4 5773 B7R1.1 NCc1ccno1 1P007323 [1,0,0,0,1,0|1,0,1]=4 5774 B7R1.1 NCc1ccns1 1P01B6TZ [1,0,0,0,1,0|1,0,1]=4 5775 B7R1.1 NCc1ccns1 1P01B6V6 [1,0,0,0,1,0|1,0,1]=4 5776 B7R1.1 NCc1ccon1 1P00811U [1,0,0,0,1,0|1,0,1]=4 5777 B7R1.1 NCc1ccon1 1P009337 [1,0,0,0,1,0|1,0,1]=4 5778 B7R1.1 NCc1ccsn1 1P0076B9 [1,0,0,0,1,0|1,0,1]=4 5779 B7R1.1 NCc1cnco1 1P000PTG [1,0,0,0,1,0|1,0,1]=4 5780 B7R1.1 NCc1cncs1 1P001WDD [1,0,0,0,1,0|1,0,1]=4 5781 B7R1.1 NCc1cncs1 1P00811W [1,0,0,0,1,0|1,0,1]=4 5782 B7R1.1 NCc1cocc1 1P0038AA [1,0,0,0,1,0|1,0,1]=4 5783 B7R1.1 NCc1cocc1 1P009BQA [1,0,0,0,1,0|1,0,1]=4 5784 B7R1.1 NCc1cocn1 1P0039FL [1,0,0,0,1,0|1,0,1]=4 5785 B7R1.1 NCc1cocn1 1P00DG0B [1,0,0,0,1,0|1,0,1]=4 5786 B7R1.1 NCc1conc1 1P001ZPV [1,0,0,0,1,0|1,0,1]=4 5787 B7R1.1 NCc1cscc1 1P000GRT [1,0,0,0,1,0|1,0,1]=4 5788 B7R1.1 NCc1cscc1 1P002V4H [1,0,0,0,1,0|1,0,1]=4 5789 B7R1.1 NCc1cscn1 1P000E2I [1,0,0,0,1,0|1,0,1]=4 5790 B7R1.1 NCc1cscn1 1P001WF7 [1,0,0,0,1,0|1,0,1]=4 5791 B7R1.1 NCc1csnc1 1P01FJYB [1,0,0,0,1,0|1,0,1]=4 5792 B7R1.1 NCc1csnc1 1P01FJYC [1,0,0,0,1,0|1,0,1]=4 5793 B7R1.1 NCc1nc[nH]c1 1P0038XO [1,0,0,0,1,0|1,0,1]=4 5794 B7R1.1 NCc1ncc[nH]1 1P001A1F [1,0,0,0,1,0|1,0,1]=4 5795 B7R1.1 NCc1ncc[nH]1 1P003A7Q [1,0,0,0,1,0|1,0,1]=4 5796 B7R1.1 NCc1ncco1 1P0038HB [1,0,0,0,1,0|1,0,1]=4 5797 B7R1.1 NCc1ncco1 1P028B4B [1,0,0,0,1,0|1,0,1]=4 5798 B7R1.1 NCc1nccs1 1P0033BR [1,0,0,0,1,0|1,0,1]=4 5799 B7R1.1 NCc1nccs1 1P0037J6 [1,0,0,0,1,0|1,0,1]=4 5800 B7R1.1 NCc1nccs1 1P00G4H4 [1,0,0,0,1,0|1,0,1]=4 5801 B7R1.1 NCc1ncsc1 1P00J1AF [1,0,0,0,1,0|1,0,1]=4 5802 B7R1.1 NCc1ocnc1 1P009I2F [1,0,0,0,1,0|1,0,1]=4 5803 B7R1.1 NCc1scnc1 1P0015PG [1,0,0,0,1,0|1,0,1]=4 5804 B7R1.1 NNc1nccs1 1P007JQK [1,0,0,0,1,0|2,0,0]=4 5805 B7R1.1 O=C[C-]1C=CC=C1 1P000X4V [1,0,0,0,1,0|0,0,1]=3 5806 B7R1.1 O=Cc1c[nH]cc1 1P00360O [1,0,0,0,1,0|0,0,1]=3 5807 B7R1.1 O=Cc1c[nH]nc1 1P000Q03 [1,0,0,0,1,0|1,0,0]=3 5808 B7R1.1 O=Cc1c[nH]nc1 1P0036BF [1,0,0,0,1,0|1,0,0]=3 5809 B7R1.1 O=Cc1c[nH]nn1 1P007WZ9 [1,0,0,0,1,0|2,0,0]=4 5810 B7R1.1 O=Cc1cc[nH]n1 1P0037YS [1,0,0,0,1,0|1,0,0]=3 5811 B7R1.1 O=Cc1ccc[nH]1 1P0001Y8 [1,0,0,0,1,0|0,0,1]=3 5812 B7R1.1 O=Cc1ccc[se]1 1P002QYK [1,0,0,0,1,0|1,0,0]=3 5813 B7R1.1 O=Cc1ccco1 1P0033SN [1,0,0,0,1,0|1,0,0]=3 5814 B7R1.1 O=Cc1cccs1 1P0039RD [1,0,0,0,1,0|1,0,0]=3 5815 B7R1.1 O=Cc1ccn[nH]1 1P003EVE [1,0,0,0,1,0|1,0,0]=3 5816 B7R1.1 O=Cc1ccno1 1P00ABVW [1,0,0,0,1,0|1,0,0]=3 5817 B7R1.1 O=Cc1ccns1 1P00395A [1,0,0,0,1,0|1,0,0]=3 5818 B7R1.1 O=Cc1ccon1 1P0036Q6 [1,0,0,0,1,0|1,0,0]=3 5819 B7R1.1 O=Cc1ccsn1 1P01E7HF [1,0,0,0,1,0|1,0,0]=3 5820 B7R1.1 O=Cc1cnc[nH]1 1P00309Z [1,0,0,0,1,0|1,0,0]=3 5821 B7R1.1 O=Cc1cnco1 1P007RNX [1,0,0,0,1,0|1,0,0]=3 5822 B7R1.1 O=Cc1cncs1 1P0001Y5 [1,0,0,0,1,0|1,0,0]=3 5823 B7R1.1 O=Cc1cnns1 1P01SU11 [1,0,0,0,1,0|2,0,0]=4 5824 B7R1.1 O=Cc1cnon1 1P01C3RF [1,0,0,0,1,0|2,0,0]=4 5825 B7R1.1 O=Cc1cnsn1 1P005N99 [1,0,0,0,1,0|2,0,0]=4 5826 B7R1.1 O=Cc1cocc1 1P003JYV [1,0,0,0,1,0|1,0,0]=3 5827 B7R1.1 O=Cc1cocn1 1P0039FC [1,0,0,0,1,0|1,0,0]=3 5828 B7R1.1 O=Cc1conc1 1P00EAG3 [1,0,0,0,1,0|1,0,0]=3 5829 B7R1.1 O=Cc1cscc1 1P00348X [1,0,0,0,1,0|1,0,0]=3 5830 B7R1.1 O=Cc1cscn1 1P007D9X [1,0,0,0,1,0|1,0,0]=3 5831 B7R1.1 O=Cc1csnc1 1P005H6H [1,0,0,0,1,0|1,0,0]=3 5832 B7R1.1 O=Cc1csnn1 1P002URS [1,0,0,0,1,0|2,0,0]=4 5833 B7R1.1 O=Cc1ncc[nH]1 1P00047Y [1,0,0,0,1,0|1,0,0]=3 5834 B7R1.1 O=Cc1ncco1 1P0037C2 [1,0,0,0,1,0|1,0,0]=3 5835 B7R1.1 O=Cc1nccs1 1P0006QL [1,0,0,0,1,0|1,0,0]=3 5836 B7R1.1 O=Cc1ncn[nH]1 1P00CJAB [1,0,0,0,1,0|2,0,0]=4 5837 B7R1.1 O=Cc1nncs1 1P001KQO [1,0,0,0,1,0|2,0,0]=4 5838 B7R1.1 O=Cc1nscn1 1P028B7G [1,0,0,0,1,0|2,0,0]=4 5839 B11R1.91 CC(=C)COc1cccnc1 1P01BVZD [0,0,0,0,0,2|2,0,0]=4 5840 B11R1.91 CC(=O)C#Cc1ccccc1 1P0023J2 [0,0,0,0,0,2|2,0,0]=4 5841 B11R1.91 CC(=O)C=Cc1ccccc1 1P0016ZQ [0,0,0,0,0,2|2,0,0]=4 5842 B11R1.91 CC(=O)CCc1ccccc1 1P003OLF [0,0,0,0,0,2|2,0,0]=4 5843 B11R1.91 CC(=O)CCc1cccnc1 1P01BTZ4 [0,0,0,0,0,2|1,0,0]=3 5844 B11R1.91 CC(=O)COc1ccccc1 1P003U54 [0,0,0,0,0,2|2,0,0]=4 5845 B11R1.91 CC(=O)CSc1ccccc1 1P006UAN [0,0,0,0,0,2|2,0,0]=4 5846 B11R1.91 CC(=O)NCc1ccccc1 1P003T87 [0,0,0,0,0,2|2,0,0]=4 5847 B11R1.91 CC(=O)NCc1cccnc1 1P002M86 [0,0,0,0,0,2|1,0,0]=3 5848 B11R1.91 CC(=O)NCc1cccnn1 1P01BW9E [0,0,0,0,0,2|2,0,0]=4 5849 B11R1.91 CC(=O)NNc1ccccc1 1P000AQR [0,0,0,0,0,2|2,0,0]=4 5850 B11R1.91 CC(=O)OCc1ccccc1 1P001CDM [0,0,0,0,0,2|2,0,0]=4 5851 B11R1.91 CC(=O)OCc1cccnc1 1P00036I [0,0,0,0,0,2|1,0,0]=3 5852 B11R1.91 CC(=O)SCc1ccccc1 1P00C8DO [0,0,0,0,0,2|2,0,0]=4 5853 B11R1.91 CC(=O)\C=C\c1ccccc1 1P002E97 [0,0,0,0,0,2|2,0,0]=4 5854 B11R1.91 CC(CCc1cccnc1)N 1P01ZZDK [0,0,0,0,0,2|1,0,1]=4 5855 B11R1.91 ClC(=O)C=Cc1ccccc1 1P0006PX [0,0,0,0,0,2|2,0,0]=4 5856 B11R1.91 ClC(=O)CCc1ccccc1 1P003KCH [0,0,0,0,0,2|2,0,0]=4 5857 B11R1.91 ClC(=O)COc1ccccc1 1P003U56 [0,0,0,0,0,2|2,0,0]=4 5858 B11R1.91 ClC(=O)OCc1cccnc1 1P01DWJE [0,0,0,0,0,2|1,0,0]=3 5859 B11R1.91 ClC(=O)\C=C\c1ccccc1 1P00ACFX [0,0,0,0,0,2|2,0,0]=4 5860 B11R1.91 NC(=N)CCc1ccccc1 1P00CD5C [0,0,0,0,0,2|2,0,0]=4 5861 B11R1.91 NC(=N)COc1ccccc1 1P003IB1 [0,0,0,0,0,2|2,0,0]=4 5862 B11R1.91 NC(=N)CSc1ccccc1 1P004RQX [0,0,0,0,0,2|2,0,0]=4 5863 B11R1.91 NC(=N)NCc1ccccc1 1P00HE8W [0,0,0,0,0,2|2,0,0]=4 5864 B11R1.91 NC(=N)NCc1ccccc1 1P00J2IU [0,0,0,0,0,2|2,0,0]=4 5865 B11R1.91 NC(=N)NCc1cccnc1 1P00J1YL [0,0,0,0,0,2|1,0,0]=3 5866 B11R1.91 NC(=N)SCc1ccccc1 1P00394W [0,0,0,0,0,2|2,0,0]=4 5867 B11R1.91 NC(=N)[NH2+]Cc1ccccc1 1P0070M0 [0,0,0,0,0,2|2,0,0]=4 5868 B11R1.91 NC(=NCc1ccccc1)N 1P01AJFT [0,0,0,0,0,2|2,0,0]=4 5869 B11R1.91 NC(=O)C#Cc1ccccc1 1P00697N [0,0,0,0,0,2|1,0,0]=3 5870 B11R1.91 NC(=O)C=Cc1ccccc1 1P00352M [0,0,0,0,0,2|1,0,0]=3 5871 B11R1.91 NC(=O)CCc1ccccc1 1P0006PW [0,0,0,0,0,2|1,0,0]=3 5872 B11R1.91 NC(=O)CCc1cccnc1 1P004YZ2 [0,0,0,0,0,2|0,0,0]=2 5873 B11R1.91 NC(=O)CCc1ccncc1 1P00IDTF [0,0,0,0,0,2|2,0,0]=4 5874 B11R1.91 NC(=O)CNc1ccccc1 1P00C37C [0,0,0,0,0,2|1,0,0]=3 5875 B11R1.91 NC(=O)CNc1cnccn1 1P0280M7 [0,0,0,0,0,2|1,0,0]=3 5876 B11R1.91 NC(=O)COc1ccccc1 1P00EASD [0,0,0,0,0,2|1,0,0]=3 5877 B11R1.91 NC(=O)COc1cccnc1 1P01A97N [0,0,0,0,0,2|0,0,0]=2 5878 B11R1.91 NC(=O)CSc1ccccc1 1P00BJGD [0,0,0,0,0,2|1,0,0]=3 5879 B11R1.91 NC(=O)NCc1ccccc1 1P003OM7 [0,0,0,0,0,2|1,0,0]=3 5880 B11R1.91 NC(=O)NCc1ccccn1 1P00IRVC [0,0,0,0,0,2|2,0,0]=4 5881 B11R1.91 NC(=O)NCc1cccnc1 1P00CKKY [0,0,0,0,0,2|0,0,0]=2 5882 B11R1.91 NC(=O)NCc1ccncc1 1P01A9GM [0,0,0,0,0,2|2,0,0]=4 5883 B11R1.91 NC(=O)NNc1ccccc1 1P003F3K [0,0,0,0,0,2|1,0,0]=3 5884 B11R1.91 NC(=O)OCc1ccccc1 1P00IBFU [0,0,0,0,0,2|1,0,0]=3 5885 B11R1.91 NC(=O)\C=C/c1ccccc1 1P0076YW [0,0,0,0,0,2|1,0,0]=3 5886 B11R1.91 NC(=O)\C=C\c1ccccc1 1P00352N [0,0,0,0,0,2|1,0,0]=3 5887 B11R1.91 NC(=S)CCc1ccccc1 1P006QBP [0,0,0,0,0,2|1,1,0]=4 5888 B11R1.91 NC(=S)COc1ccccc1 1P003IBE [0,0,0,0,0,2|1,1,0]=4 5889 B11R1.91 NC(=S)NCc1ccccc1 1P003OLU [0,0,0,0,0,2|1,1,0]=4 5890 B11R1.91 NC(=S)NCc1ccccc1 1P01AKHE [0,0,0,0,0,2|1,1,0]=4 5891 B11R1.91 NC(=S)NNc1ccccc1 1P003F2X [0,0,0,0,0,2|1,1,0]=4 5892 B11R1.91 O=N(=O)\C=C\c1cccnc1 1P01DL51 [0,0,0,0,0,2|2,0,0]=4 5893 B11R1.91 OC(=O)C#Cc1ccccc1 1P003U6Q [0,0,0,0,0,2|2,0,0]=4 5894 B11R1.91 OC(=O)C#Cc1cccnc1 1P00EIWZ [0,0,0,0,0,2|1,0,0]=3 5895 B11R1.91 OC(=O)C=Cc1ccccc1 1P0037GS [0,0,0,0,0,2|2,0,0]=4 5896 B11R1.91 OC(=O)C=Cc1cccnc1 1P00IL06 [0,0,0,0,0,2|1,0,0]=3 5897 B11R1.91 OC(=O)CCc1ccccc1 1P003RFB [0,0,0,0,0,2|2,0,0]=4 5898 B11R1.91 OC(=O)CCc1cccnc1 1P003IJC [0,0,0,0,0,2|1,0,0]=3 5899 B11R1.91 OC(=O)CCc1cccnn1 1P00ILVC [0,0,0,0,0,2|2,0,0]=4 5900 B11R1.91 OC(=O)CCc1cnccn1 1P00FDK0 [0,0,0,0,0,2|2,0,0]=4 5901 B11R1.91 OC(=O)CCc1cnccn1 1P028581 [0,0,0,0,0,2|2,0,0]=4 5902 B11R1.91 OC(=O)CCc1cncnc1 1P00II0L [0,0,0,0,0,2|2,0,0]=4 5903 B11R1.91 OC(=O)CNc1ccccc1 1P003TRX [0,0,0,0,0,2|2,0,0]=4 5904 B11R1.91 OC(=O)CNc1cccnc1 1P00CILN [0,0,0,0,0,2|1,0,0]=3 5905 B11R1.91 OC(=O)CNc1cccnc1 1P01DX0R [0,0,0,0,0,2|1,0,0]=3 5906 B11R1.91 OC(=O)CNc1cnccn1 1P01DTVX [0,0,0,0,0,2|2,0,0]=4 5907 B11R1.91 OC(=O)COc1ccccc1 1P0016ZP [0,0,0,0,0,2|2,0,0]=4 5908 B11R1.91 OC(=O)COc1cccnc1 1P004LEB [0,0,0,0,0,2|1,0,0]=3 5909 B11R1.91 OC(=O)COc1cccnc1 1P00DK7D [0,0,0,0,0,2|1,0,0]=3 5910 B11R1.91 OC(=O)CSc1ccccc1 1P003CIK [0,0,0,0,0,2|2,0,0]=4 5911 B11R1.91 OC(=O)\C=C\c1ccccc1 1P001CDN [0,0,0,0,0,2|2,0,0]=4 5912 B11R1.91 OC(=O)\C=C\c1cccnc1 1P003CH8 [0,0,0,0,0,2|1,0,0]=3 5913 B11R1.91 OC(=O)\C=C\c1ccnnc1 1P006VU5 [0,0,0,0,0,2|2,0,0]=4 5914 B11R1.91 OC(=O)\C=C\c1cnccn1 1P000L6S [0,0,0,0,0,2|2,0,0]=4 5915 B11R1.91 OC(=O)\C=C\c1cncnc1 1P009Z25 [0,0,0,0,0,2|2,0,0]=4 5916 B11R1.91 [O-]C(=O)C=Cc1ccccc1 1P001VX1 [0,0,0,0,0,2|2,0,0]=4 5917 B11R1.91 [O-]C(=O)CCc1ccccc1 1P0036E4 [0,0,0,0,0,2|2,0,0]=4 5918 B11R1.91 [O-]C(=O)CNc1ccccc1 1P003TRZ [0,0,0,0,0,2|2,0,0]=4 5919 B11R1.91 [O-]C(=O)COc1ccccc1 1P003UU9 [0,0,0,0,0,2|2,0,0]=4 5920 B11R1.91 [O-]C(=O)COc1ccccc1 1P00I6DB [0,0,0,0,0,2|2,0,0]=4 5921 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 1P00IA2C [0,0,0,0,0,2|2,0,0]=4 5922 B11R1.91 [O-][N+](=O)C=Cc1cccnc1 1P01AJUS [0,0,0,0,0,2|2,0,0]=4 5923 B11R1.91 [O-][N+](=O)\C=C\c1cccnc1 1P003IHY [0,0,0,0,0,2|2,0,0]=4