0 B9R1.15 BrCc1ccccc1C 1P0032QO [0,0,0,0,0,0|4,0,0]=4 1 B9R1.15 BrCc1cccnc1Br 1P003H34 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.15 BrCc1cccnc1Br 1P01K18U [0,0,0,0,0,0|4,0,0]=4 3 B9R1.15 BrCc1cccnc1C 1P0019R8 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.15 BrCc1cccnc1Cl 1P003INP [0,0,0,0,0,0|4,0,0]=4 5 B9R1.15 BrCc1cccnc1F 1P0030IZ [0,0,0,0,0,0|4,0,0]=4 6 B9R1.15 BrCc1cccnc1N 1P01BH5R [0,0,0,0,0,0|4,0,0]=4 7 B9R1.15 BrCc1ncccc1Br 1P003AGB [0,0,0,0,0,0|4,0,0]=4 8 B9R1.15 BrCc1ncccc1Br 1P01DX0S [0,0,0,0,0,0|4,0,0]=4 9 B9R1.15 BrCc1ncccc1C 1P0091H2 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.15 BrCc1ncccc1Cl 1P000JRC [0,0,0,0,0,0|4,0,0]=4 11 B9R1.15 BrCc1ncccc1F 1P0017JV [0,0,0,0,0,0|4,0,0]=4 12 B9R1.15 BrCc1ncccc1F 1P009E6T [0,0,0,0,0,0|4,0,0]=4 13 B9R1.15 BrCc1nccnc1C 1P027Z7H [0,0,0,0,0,0|2,0,0]=2 14 B9R1.15 Br[Mg]c1ccccc1C 1P00IKYX [0,0,0,0,0,0|4,0,0]=4 15 B9R1.15 C#Cc1cccnc1Br 1P01Q8N6 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.15 C#Cc1cccnc1C 1P01DWS5 [0,0,0,0,0,0|2,0,1]=3 17 B9R1.15 C#Cc1cccnc1Cl 1P008XA5 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.15 C#Cc1cccnc1F 1P00II22 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.15 C#Cc1cccnc1N 1P00IC61 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.15 C#Cc1cccnc1O 1P009GXT [0,0,0,0,0,0|3,0,1]=4 21 B9R1.15 C#Cc1cncnc1C 1P029019 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.15 C#Cc1ncccc1Br 1P00IK9U [0,0,0,0,0,0|3,0,1]=4 23 B9R1.15 C#Cc1ncccc1C 1P0030IS [0,0,0,0,0,0|2,0,1]=3 24 B9R1.15 C#Cc1ncccc1Cl 1P018PQD [0,0,0,0,0,0|3,0,1]=4 25 B9R1.15 C#Cc1ncccc1F 1P00HW89 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.15 C#Cc1ncccc1N 1P01K10R [0,0,0,0,0,0|3,0,1]=4 27 B9R1.15 C#Cc1nccnc1Br 1P029319 [0,0,0,0,0,0|2,0,1]=3 28 B9R1.15 C#Cc1nccnc1C 1P00C9LZ [0,0,0,0,0,0|1,0,1]=2 29 B9R1.15 C#Cc1nccnc1Cl 1P0013PW [0,0,0,0,0,0|2,0,1]=3 30 B9R1.15 C#Cc1nccnc1N 1P0002Q2 [0,0,0,0,0,0|2,0,1]=3 31 B9R1.15 C=Cc1cccnc1C 1P00I8ZR [0,0,0,0,0,0|2,0,1]=3 32 B9R1.15 C=Cc1cccnc1F 1P00HX8N [0,0,0,0,0,0|3,0,1]=4 33 B9R1.15 C=Cc1ncccc1Br 1P004ZQ3 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.15 C=Cc1ncccc1C 1P00CC7K [0,0,0,0,0,0|2,0,1]=3 35 B9R1.15 C=Cc1ncccc1F 1P01B626 [0,0,0,0,0,0|3,0,1]=4 36 B9R1.15 C=Cc1nccnc1C 1P002QRI [0,0,0,0,0,0|1,0,1]=2 37 B9R1.15 CC[n+]1ccccc1C 1P00IMY1 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.15 CCc1ccccc1Br 1P002B7A [0,0,0,0,0,0|4,0,0]=4 39 B9R1.15 CCc1ccccc1C 1P003HOX [0,0,0,0,0,0|3,0,0]=3 40 B9R1.15 CCc1ccccc1F 1P00DDKE [0,0,0,0,0,0|4,0,0]=4 41 B9R1.15 CCc1ccccc1I 1P0024MY [0,0,0,0,0,0|4,0,0]=4 42 B9R1.15 CCc1ccccc1N 1P0037MR [0,0,0,0,0,0|4,0,0]=4 43 B9R1.15 CCc1ccccc1S 1P003HO5 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.15 CCc1cccnc1Br 1P01CAQK [0,0,0,0,0,0|3,0,0]=3 45 B9R1.15 CCc1cccnc1Cl 1P00IK9V [0,0,0,0,0,0|3,0,0]=3 46 B9R1.15 CCc1cccnc1F 1P027X3Q [0,0,0,0,0,0|3,0,0]=3 47 B9R1.15 CCc1cccnc1N 1P00BYMN [0,0,0,0,0,0|3,0,0]=3 48 B9R1.15 CCc1cccnc1O 1P00EIVR [0,0,0,0,0,0|3,0,0]=3 49 B9R1.15 CCc1cncnc1Cl 1P00DC4L [0,0,0,0,0,0|4,0,0]=4 50 B9R1.15 CCc1ncc[nH]c1=O 1P00BK7L [0,0,0,0,0,0|2,0,1]=3 51 B9R1.15 CCc1ncc[nH]c1=O 1P01FLFE [0,0,0,0,0,0|2,0,1]=3 52 B9R1.15 CCc1ncccc1Br 1P00CJAY [0,0,0,0,0,0|3,0,0]=3 53 B9R1.15 CCc1ncccc1N 1P01C6YI [0,0,0,0,0,0|3,0,0]=3 54 B9R1.15 CCc1ncccc1O 1P00EJRY [0,0,0,0,0,0|3,0,0]=3 55 B9R1.15 CCc1nccnc1C 1P001PNQ [0,0,0,0,0,0|1,0,0]=1 56 B9R1.15 CCc1nccnc1Cl 1P00E98L [0,0,0,0,0,0|2,0,0]=2 57 B9R1.15 CCc1nccnc1N 1P00H35P [0,0,0,0,0,0|2,0,0]=2 58 B9R1.15 CCc1ncncc1Br 1P0066T5 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.15 CCc1ncncc1F 1P0013GL [0,0,0,0,0,0|4,0,0]=4 60 B9R1.15 CCc1ncncc1O 1P028W1X [0,0,0,0,0,0|4,0,0]=4 61 B9R1.15 CCc1nnc[nH]c1=O 1P024UEL [0,0,0,0,0,0|3,0,1]=4 62 B9R1.15 CNc1ccccc1Br 1P003H96 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.15 CNc1ccccc1Br 1P00IJUS [0,0,0,0,0,0|4,0,0]=4 64 B9R1.15 CNc1ccccc1C 1P003TP2 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.15 CNc1ccccc1Cl 1P006I47 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.15 CNc1ccccc1F 1P002BI4 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.15 CNc1ccccc1I 1P019XX6 [0,0,0,0,0,0|4,0,0]=4 68 B9R1.15 CNc1ccccc1N 1P002R3W [0,0,0,0,0,0|4,0,0]=4 69 B9R1.15 CNc1ccccc1N 1P003T4H [0,0,0,0,0,0|4,0,0]=4 70 B9R1.15 CNc1ccccc1O 1P0033UU [0,0,0,0,0,0|4,0,0]=4 71 B9R1.15 CNc1ccccc1O 1P01K0W3 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.15 CNc1cccnc1Br 1P00GSNK [0,0,0,0,0,0|3,0,0]=3 73 B9R1.15 CNc1cccnc1C 1P009SR0 [0,0,0,0,0,0|2,0,0]=2 74 B9R1.15 CNc1cccnc1C 1P01AM0N [0,0,0,0,0,0|2,0,0]=2 75 B9R1.15 CNc1cccnc1C 1P01FKVI [0,0,0,0,0,0|2,0,0]=2 76 B9R1.15 CNc1cccnc1Cl 1P00I8HE [0,0,0,0,0,0|3,0,0]=3 77 B9R1.15 CNc1cccnc1N 1P00ELAM [0,0,0,0,0,0|3,0,0]=3 78 B9R1.15 CNc1ccncc1C 1P01BE54 [0,0,0,0,0,0|4,0,0]=4 79 B9R1.15 CNc1cnccc1C 1P005RQH [0,0,0,0,0,0|4,0,0]=4 80 B9R1.15 CNc1ncccc1Br 1P00BDBE [0,0,0,0,0,0|3,0,0]=3 81 B9R1.15 CNc1ncccc1C 1P00B9IM [0,0,0,0,0,0|2,0,0]=2 82 B9R1.15 CNc1ncccc1Cl 1P00DKL6 [0,0,0,0,0,0|3,0,0]=3 83 B9R1.15 CNc1ncccc1F 1P00BJFB [0,0,0,0,0,0|3,0,0]=3 84 B9R1.15 CNc1ncccc1I 1P000AOR [0,0,0,0,0,0|3,0,0]=3 85 B9R1.15 CNc1ncccc1N 1P00DEDZ [0,0,0,0,0,0|3,0,0]=3 86 B9R1.15 CNc1ncccc1N 1P019XCU [0,0,0,0,0,0|3,0,0]=3 87 B9R1.15 CNc1nccnc1C 1P01IJES [0,0,0,0,0,0|1,0,0]=1 88 B9R1.15 CNc1nccnc1Cl 1P00DD7L [0,0,0,0,0,0|2,0,0]=2 89 B9R1.15 CNc1nccnc1N 1P004UKH [0,0,0,0,0,0|2,0,0]=2 90 B9R1.15 CNc1ncncc1F 1P01BCYC [0,0,0,0,0,0|4,0,0]=4 91 B9R1.15 CNc1ncncc1I 1P01BHFH [0,0,0,0,0,0|4,0,0]=4 92 B9R1.15 CNc1ncncc1N 1P00AK2S [0,0,0,0,0,0|4,0,0]=4 93 B9R1.15 COc1ccc[nH]c1=O 1P002KM2 [0,0,0,0,0,0|2,1,1]=4 94 B9R1.15 COc1ccccc1Br 1P003H81 [0,0,0,0,0,0|3,1,0]=4 95 B9R1.15 COc1ccccc1C 1P003I55 [0,0,0,0,0,0|2,1,0]=3 96 B9R1.15 COc1ccccc1Cl 1P0033PR [0,0,0,0,0,0|3,1,0]=4 97 B9R1.15 COc1ccccc1F 1P003HS1 [0,0,0,0,0,0|3,1,0]=4 98 B9R1.15 COc1ccccc1I 1P0033TS [0,0,0,0,0,0|3,1,0]=4 99 B9R1.15 COc1ccccc1N 1P003TWA [0,0,0,0,0,0|3,1,0]=4 100 B9R1.15 COc1ccccc1N 1P003TWB [0,0,0,0,0,0|3,1,0]=4 101 B9R1.15 COc1ccccc1O 1P003AR5 [0,0,0,0,0,0|3,1,0]=4 102 B9R1.15 COc1ccccc1S 1P0033UE [0,0,0,0,0,0|3,1,0]=4 103 B9R1.15 COc1cccnc1Br 1P006XU3 [0,0,0,0,0,0|2,1,0]=3 104 B9R1.15 COc1cccnc1C 1P002TI0 [0,0,0,0,0,0|1,1,0]=2 105 B9R1.15 COc1cccnc1Cl 1P00I9VJ [0,0,0,0,0,0|2,1,0]=3 106 B9R1.15 COc1cccnc1F 1P001UE8 [0,0,0,0,0,0|2,1,0]=3 107 B9R1.15 COc1cccnc1I 1P0062GY [0,0,0,0,0,0|2,1,0]=3 108 B9R1.15 COc1cccnc1N 1P0006SA [0,0,0,0,0,0|2,1,0]=3 109 B9R1.15 COc1cccnc1O 1P00I1BE [0,0,0,0,0,0|2,1,0]=3 110 B9R1.15 COc1cccnc1S 1P00B36V [0,0,0,0,0,0|2,1,0]=3 111 B9R1.15 COc1ccncc1C 1P00IKAY [0,0,0,0,0,0|3,1,0]=4 112 B9R1.15 COc1ccnnc1Cl 1P00KCV8 [0,0,0,0,0,0|3,1,0]=4 113 B9R1.15 COc1ccnnc1N 1P01A698 [0,0,0,0,0,0|3,1,0]=4 114 B9R1.15 COc1cncnc1Cl 1P00FCPO [0,0,0,0,0,0|3,1,0]=4 115 B9R1.15 COc1cncnc1N 1P005WSA [0,0,0,0,0,0|3,1,0]=4 116 B9R1.15 COc1ncccc1Br 1P003JHD [0,0,0,0,0,0|2,1,0]=3 117 B9R1.15 COc1ncccc1C 1P002GA3 [0,0,0,0,0,0|1,1,0]=2 118 B9R1.15 COc1ncccc1Cl 1P003JNS [0,0,0,0,0,0|2,1,0]=3 119 B9R1.15 COc1ncccc1F 1P004K0C [0,0,0,0,0,0|2,1,0]=3 120 B9R1.15 COc1ncccc1I 1P003K1W [0,0,0,0,0,0|2,1,0]=3 121 B9R1.15 COc1ncccc1N 1P003I18 [0,0,0,0,0,0|2,1,0]=3 122 B9R1.15 COc1ncccc1O 1P009FJH [0,0,0,0,0,0|2,1,0]=3 123 B9R1.15 COc1ncccc1S 1P01L01U [0,0,0,0,0,0|2,1,0]=3 124 B9R1.15 COc1nccnc1Br 1P008ZI9 [0,0,0,0,0,0|1,1,0]=2 125 B9R1.15 COc1nccnc1C 1P002VX2 [0,0,0,0,0,0|0,1,0]=1 126 B9R1.15 COc1nccnc1C 1P00FAVU [0,0,0,0,0,0|0,1,0]=1 127 B9R1.15 COc1nccnc1Cl 1P0075I4 [0,0,0,0,0,0|1,1,0]=2 128 B9R1.15 COc1nccnc1F 1P023J7U [0,0,0,0,0,0|1,1,0]=2 129 B9R1.15 COc1nccnc1I 1P00EHP1 [0,0,0,0,0,0|1,1,0]=2 130 B9R1.15 COc1nccnc1N 1P00D9E1 [0,0,0,0,0,0|1,1,0]=2 131 B9R1.15 COc1ncncc1Br 1P00DICH [0,0,0,0,0,0|3,1,0]=4 132 B9R1.15 COc1ncncc1C 1P00ALUB [0,0,0,0,0,0|2,1,0]=3 133 B9R1.15 COc1ncncc1Cl 1P000FZI [0,0,0,0,0,0|3,1,0]=4 134 B9R1.15 COc1ncncc1F 1P008Z73 [0,0,0,0,0,0|3,1,0]=4 135 B9R1.15 COc1ncncc1I 1P00I4QX [0,0,0,0,0,0|3,1,0]=4 136 B9R1.15 COc1ncncc1N 1P001ONJ [0,0,0,0,0,0|3,1,0]=4 137 B9R1.15 COc1nnccc1N 1P009X7F [0,0,0,0,0,0|3,1,0]=4 138 B9R1.15 CSC1=NCCCN1C 1P019FIP [0,0,0,0,0,0|2,0,2]=4 139 B9R1.15 CSc1ccccc1Br 1P003H9R [0,0,0,0,0,0|3,0,0]=3 140 B9R1.15 CSc1ccccc1C 1P001G42 [0,0,0,0,0,0|2,0,0]=2 141 B9R1.15 CSc1ccccc1Cl 1P0025PI [0,0,0,0,0,0|3,0,0]=3 142 B9R1.15 CSc1ccccc1F 1P003HSY [0,0,0,0,0,0|3,0,0]=3 143 B9R1.15 CSc1ccccc1I 1P003HXO [0,0,0,0,0,0|3,0,0]=3 144 B9R1.15 CSc1ccccc1N 1P003BJ8 [0,0,0,0,0,0|3,0,0]=3 145 B9R1.15 CSc1ccccc1O 1P003HWT [0,0,0,0,0,0|3,0,0]=3 146 B9R1.15 CSc1cccnc1Br 1P00J3CE [0,0,0,0,0,0|2,0,0]=2 147 B9R1.15 CSc1cccnc1Cl 1P006P9R [0,0,0,0,0,0|2,0,0]=2 148 B9R1.15 CSc1cccnc1F 1P00CGDU [0,0,0,0,0,0|2,0,0]=2 149 B9R1.15 CSc1cccnc1N 1P00BB9C [0,0,0,0,0,0|2,0,0]=2 150 B9R1.15 CSc1ccncc1Br 1P0056GB [0,0,0,0,0,0|4,0,0]=4 151 B9R1.15 CSc1ccncc1N 1P019YSY [0,0,0,0,0,0|4,0,0]=4 152 B9R1.15 CSc1cnccc1N 1P01DL3L [0,0,0,0,0,0|4,0,0]=4 153 B9R1.15 CSc1ncccc1Br 1P00DAU5 [0,0,0,0,0,0|2,0,0]=2 154 B9R1.15 CSc1ncccc1C 1P01BWA1 [0,0,0,0,0,0|1,0,0]=1 155 B9R1.15 CSc1ncccc1Cl 1P01DNYD [0,0,0,0,0,0|2,0,0]=2 156 B9R1.15 CSc1ncccc1N 1P00J30S [0,0,0,0,0,0|2,0,0]=2 157 B9R1.15 CSc1nccnc1C 1P002X49 [0,0,0,0,0,0|0,0,0]=0 158 B9R1.15 ClCc1cccnc1C 1P00EKAT [0,0,0,0,0,0|3,0,0]=3 159 B9R1.15 ClCc1cccnc1Cl 1P003HBI [0,0,0,0,0,0|4,0,0]=4 160 B9R1.15 ClCc1cccnc1Cl 1P0093D5 [0,0,0,0,0,0|4,0,0]=4 161 B9R1.15 ClCc1cccnc1F 1P00CM25 [0,0,0,0,0,0|4,0,0]=4 162 B9R1.15 ClCc1cccnc1N 1P004OOU [0,0,0,0,0,0|4,0,0]=4 163 B9R1.15 ClCc1cccnc1N 1P00G8NW [0,0,0,0,0,0|4,0,0]=4 164 B9R1.15 ClCc1ncccc1Br 1P000K2H [0,0,0,0,0,0|4,0,0]=4 165 B9R1.15 ClCc1ncccc1Br 1P001I6I [0,0,0,0,0,0|4,0,0]=4 166 B9R1.15 ClCc1ncccc1C 1P00DBUW [0,0,0,0,0,0|3,0,0]=3 167 B9R1.15 ClCc1ncccc1C 1P00DD4J [0,0,0,0,0,0|3,0,0]=3 168 B9R1.15 ClCc1ncccc1Cl 1P000MGW [0,0,0,0,0,0|4,0,0]=4 169 B9R1.15 ClCc1ncccc1Cl 1P003JMY [0,0,0,0,0,0|4,0,0]=4 170 B9R1.15 ClCc1ncccc1F 1P001M6W [0,0,0,0,0,0|4,0,0]=4 171 B9R1.15 ClCc1ncccc1F 1P001M7B [0,0,0,0,0,0|4,0,0]=4 172 B9R1.15 ClCc1ncccc1O 1P005N12 [0,0,0,0,0,0|4,0,0]=4 173 B9R1.15 ClCc1nccnc1C 1P001VYQ [0,0,0,0,0,0|2,0,0]=2 174 B9R1.15 ClCc1nccnc1Cl 1P00DK1Z [0,0,0,0,0,0|3,0,0]=3 175 B9R1.15 ClCc1nnccc1C 1P0221HR [0,0,0,0,0,0|4,0,0]=4 176 B9R1.15 N#Cc1ccccc1C 1P003A6S [0,0,0,0,0,0|4,0,0]=4 177 B9R1.15 N#Cc1cccnc1Br 1P002ATH [0,0,0,0,0,0|4,0,0]=4 178 B9R1.15 N#Cc1cccnc1C 1P00APLN [0,0,0,0,0,0|3,0,0]=3 179 B9R1.15 N#Cc1cccnc1Cl 1P003HC0 [0,0,0,0,0,0|4,0,0]=4 180 B9R1.15 N#Cc1cccnc1F 1P003JSK [0,0,0,0,0,0|4,0,0]=4 181 B9R1.15 N#Cc1cccnc1N 1P002OUS [0,0,0,0,0,0|4,0,0]=4 182 B9R1.15 N#Cc1cccnc1O 1P005X0B [0,0,0,0,0,0|4,0,0]=4 183 B9R1.15 N#Cc1cccnc1S 1P00DD4P [0,0,0,0,0,0|4,0,0]=4 184 B9R1.15 N#Cc1cncnc1C 1P000GBK [0,0,0,0,0,0|4,0,0]=4 185 B9R1.15 N#Cc1ncccc1Br 1P003JGX [0,0,0,0,0,0|4,0,0]=4 186 B9R1.15 N#Cc1ncccc1C 1P002KUH [0,0,0,0,0,0|3,0,0]=3 187 B9R1.15 N#Cc1ncccc1F 1P0033QJ [0,0,0,0,0,0|4,0,0]=4 188 B9R1.15 N#Cc1ncccc1I 1P003K2H [0,0,0,0,0,0|4,0,0]=4 189 B9R1.15 N#Cc1ncccc1N 1P003JBA [0,0,0,0,0,0|4,0,0]=4 190 B9R1.15 N#Cc1ncccc1O 1P0033QK [0,0,0,0,0,0|4,0,0]=4 191 B9R1.15 N#Cc1nccnc1Br 1P000NFI [0,0,0,0,0,0|3,0,0]=3 192 B9R1.15 N#Cc1nccnc1C 1P00FAHW [0,0,0,0,0,0|2,0,0]=2 193 B9R1.15 N#Cc1nccnc1Cl 1P00345A [0,0,0,0,0,0|3,0,0]=3 194 B9R1.15 N#Cc1nccnc1N 1P002RGH [0,0,0,0,0,0|3,0,0]=3 195 B9R1.15 N#Cc1nccnc1S 1P028YSA [0,0,0,0,0,0|3,0,0]=3 196 B9R1.15 N#Cc1ncncc1C 1P0092LL [0,0,0,0,0,0|4,0,0]=4 197 B9R1.15 N#Cc1nnccc1C 1P00959O [0,0,0,0,0,0|4,0,0]=4 198 B9R1.15 NCc1ccccc1C 1P0037DE [0,0,0,0,0,0|4,0,0]=4 199 B9R1.15 NCc1cccnc1Br 1P002ARU [0,0,0,0,0,0|4,0,0]=4 200 B9R1.15 NCc1cccnc1Br 1P028CUY [0,0,0,0,0,0|4,0,0]=4 201 B9R1.15 NCc1cccnc1C 1P00EDWW [0,0,0,0,0,0|3,0,0]=3 202 B9R1.15 NCc1cccnc1C 1P00IAV8 [0,0,0,0,0,0|3,0,0]=3 203 B9R1.15 NCc1cccnc1Cl 1P002ARV [0,0,0,0,0,0|4,0,0]=4 204 B9R1.15 NCc1cccnc1Cl 1P00A0HW [0,0,0,0,0,0|4,0,0]=4 205 B9R1.15 NCc1cccnc1Cl 1P00AAIK [0,0,0,0,0,0|4,0,0]=4 206 B9R1.15 NCc1cccnc1F 1P002ART [0,0,0,0,0,0|4,0,0]=4 207 B9R1.15 NCc1cccnc1F 1P004N9V [0,0,0,0,0,0|4,0,0]=4 208 B9R1.15 NCc1cccnc1I 1P028H2F [0,0,0,0,0,0|4,0,0]=4 209 B9R1.15 NCc1cccnc1N 1P001JPL [0,0,0,0,0,0|4,0,0]=4 210 B9R1.15 NCc1ncccc1Br 1P008XMS [0,0,0,0,0,0|4,0,0]=4 211 B9R1.15 NCc1ncccc1Br 1P01B5Q6 [0,0,0,0,0,0|4,0,0]=4 212 B9R1.15 NCc1ncccc1Br 1P01B673 [0,0,0,0,0,0|4,0,0]=4 213 B9R1.15 NCc1ncccc1C 1P0038IX [0,0,0,0,0,0|3,0,0]=3 214 B9R1.15 NCc1ncccc1C 1P003AQ0 [0,0,0,0,0,0|3,0,0]=3 215 B9R1.15 NCc1ncccc1C 1P00IN6R [0,0,0,0,0,0|3,0,0]=3 216 B9R1.15 NCc1ncccc1Cl 1P007HCB [0,0,0,0,0,0|4,0,0]=4 217 B9R1.15 NCc1ncccc1Cl 1P00DGS6 [0,0,0,0,0,0|4,0,0]=4 218 B9R1.15 NCc1ncccc1F 1P000S1P [0,0,0,0,0,0|4,0,0]=4 219 B9R1.15 NCc1ncccc1F 1P0039LA [0,0,0,0,0,0|4,0,0]=4 220 B9R1.15 NCc1ncccc1F 1P00CBG3 [0,0,0,0,0,0|4,0,0]=4 221 B9R1.15 NCc1ncccc1N 1P001JPJ [0,0,0,0,0,0|4,0,0]=4 222 B9R1.15 NCc1ncccc1O 1P00BBSC [0,0,0,0,0,0|4,0,0]=4 223 B9R1.15 NCc1ncccc1O 1P01FIC3 [0,0,0,0,0,0|4,0,0]=4 224 B9R1.15 NCc1nccnc1C 1P00HYI0 [0,0,0,0,0,0|2,0,0]=2 225 B9R1.15 NCc1nccnc1C 1P01JUQD [0,0,0,0,0,0|2,0,0]=2 226 B9R1.15 NCc1nccnc1Cl 1P0036SQ [0,0,0,0,0,0|3,0,0]=3 227 B9R1.15 NCc1nccnc1Cl 1P005Y3P [0,0,0,0,0,0|3,0,0]=3 228 B9R1.15 NCc1nccnc1N 1P002RGF [0,0,0,0,0,0|3,0,0]=3 229 B9R1.15 NCc1nccnc1O 1P028A3M [0,0,0,0,0,0|3,0,0]=3 230 B9R1.15 NCc1nnccc1C 1P0293V7 [0,0,0,0,0,0|4,0,0]=4 231 B9R1.15 NNc1ccccc1C 1P003TYZ [0,0,0,0,0,0|4,0,0]=4 232 B9R1.15 NNc1cccnc1C 1P00IMPU [0,0,0,0,0,0|3,0,0]=3 233 B9R1.15 NNc1cccnc1Cl 1P000E63 [0,0,0,0,0,0|4,0,0]=4 234 B9R1.15 NNc1cccnc1F 1P0240I2 [0,0,0,0,0,0|4,0,0]=4 235 B9R1.15 NNc1ncccc1Br 1P00DFZM [0,0,0,0,0,0|4,0,0]=4 236 B9R1.15 NNc1ncccc1C 1P00DDGM [0,0,0,0,0,0|3,0,0]=3 237 B9R1.15 NNc1ncccc1Cl 1P003JNN [0,0,0,0,0,0|4,0,0]=4 238 B9R1.15 NNc1ncccc1F 1P0036QS [0,0,0,0,0,0|4,0,0]=4 239 B9R1.15 NNc1ncccc1N 1P01B6SP [0,0,0,0,0,0|4,0,0]=4 240 B9R1.15 NNc1nccnc1C 1P002C0X [0,0,0,0,0,0|2,0,0]=2 241 B9R1.15 NNc1nccnc1Cl 1P003HC9 [0,0,0,0,0,0|3,0,0]=3 242 B9R1.15 NNc1nccnc1F 1P00R6M7 [0,0,0,0,0,0|3,0,0]=3 243 B9R1.15 NNc1nnccc1C 1P00G7J5 [0,0,0,0,0,0|4,0,0]=4 244 B9R1.15 O=Cc1ccccc1C 1P0032QN [0,0,0,0,0,0|4,0,0]=4 245 B9R1.15 O=Cc1cccnc1Br 1P000Y70 [0,0,0,0,0,0|4,0,0]=4 246 B9R1.15 O=Cc1cccnc1C 1P00EDM2 [0,0,0,0,0,0|3,0,0]=3 247 B9R1.15 O=Cc1cccnc1Cl 1P003HC8 [0,0,0,0,0,0|4,0,0]=4 248 B9R1.15 O=Cc1cccnc1F 1P003991 [0,0,0,0,0,0|4,0,0]=4 249 B9R1.15 O=Cc1cccnc1N 1P0033JT [0,0,0,0,0,0|4,0,0]=4 250 B9R1.15 O=Cc1cccnc1O 1P01XDHM [0,0,0,0,0,0|4,0,0]=4 251 B9R1.15 O=Cc1ncccc1Br 1P00342J [0,0,0,0,0,0|4,0,0]=4 252 B9R1.15 O=Cc1ncccc1C 1P003K64 [0,0,0,0,0,0|3,0,0]=3 253 B9R1.15 O=Cc1ncccc1Cl 1P002B0R [0,0,0,0,0,0|4,0,0]=4 254 B9R1.15 O=Cc1ncccc1F 1P00346F [0,0,0,0,0,0|4,0,0]=4 255 B9R1.15 O=Cc1ncccc1N 1P0037JT [0,0,0,0,0,0|4,0,0]=4 256 B9R1.15 O=Cc1ncccc1O 1P007SB0 [0,0,0,0,0,0|4,0,0]=4 257 B9R1.15 O=Cc1nccnc1C 1P00BGLJ [0,0,0,0,0,0|2,0,0]=2 258 B9R1.15 O=Cc1nccnc1Cl 1P0081RE [0,0,0,0,0,0|3,0,0]=3 259 B9R1.15 O=Cc1nccnc1F 1P00I4F3 [0,0,0,0,0,0|3,0,0]=3 260 B9R1.15 O=Cc1nccnc1N 1P0039AI [0,0,0,0,0,0|3,0,0]=3 261 B9R1.15 O=Cc1ncncc1C 1P01EMMI [0,0,0,0,0,0|4,0,0]=4 262 B9R1.15 O=Nc1ccccc1C 1P00EG52 [0,0,0,0,0,0|4,0,0]=4 263 B9R1.15 O=c1c(ncc[nH]1)C#N 1P008MV8 [0,0,0,0,0,0|3,0,1]=4 264 B9R1.15 OCc1ccccc1C 1P003I5H [0,0,0,0,0,0|4,0,0]=4 265 B9R1.15 OCc1cccnc1Br 1P001054 [0,0,0,0,0,0|4,0,0]=4 266 B9R1.15 OCc1cccnc1C 1P003BPS [0,0,0,0,0,0|3,0,0]=3 267 B9R1.15 OCc1cccnc1Cl 1P003C3A [0,0,0,0,0,0|4,0,0]=4 268 B9R1.15 OCc1cccnc1F 1P001053 [0,0,0,0,0,0|4,0,0]=4 269 B9R1.15 OCc1cccnc1N 1P002OD6 [0,0,0,0,0,0|4,0,0]=4 270 B9R1.15 OCc1ccnnc1C 1P00I3WD [0,0,0,0,0,0|4,0,0]=4 271 B9R1.15 OCc1cncnc1C 1P01A6T5 [0,0,0,0,0,0|4,0,0]=4 272 B9R1.15 OCc1ncccc1Br 1P0037LG [0,0,0,0,0,0|4,0,0]=4 273 B9R1.15 OCc1ncccc1C 1P00E9TF [0,0,0,0,0,0|3,0,0]=3 274 B9R1.15 OCc1ncccc1Cl 1P00ED23 [0,0,0,0,0,0|4,0,0]=4 275 B9R1.15 OCc1ncccc1F 1P00BETC [0,0,0,0,0,0|4,0,0]=4 276 B9R1.15 OCc1ncccc1N 1P003JAQ [0,0,0,0,0,0|4,0,0]=4 277 B9R1.15 OCc1ncccc1O 1P001CZ5 [0,0,0,0,0,0|4,0,0]=4 278 B9R1.15 OCc1ncccc1O 1P001HER [0,0,0,0,0,0|4,0,0]=4 279 B9R1.15 OCc1nccnc1C 1P001VUR [0,0,0,0,0,0|2,0,0]=2 280 B9R1.15 OCc1nccnc1Cl 1P0041GK [0,0,0,0,0,0|3,0,0]=3 281 B9R1.15 OCc1nccnc1N 1P00CJWI [0,0,0,0,0,0|3,0,0]=3 282 B9R1.15 SCc1ccccc1C 1P003B52 [0,0,0,0,0,0|4,0,0]=4 283 B9R1.15 [C-]#[N+]c1ccccc1C 1P008T4R [0,0,0,0,0,0|3,0,1]=4 284 B9R1.15 [C-]#[N+]c1ncccc1C 1P01SF7K [0,0,0,0,0,0|2,0,1]=3 285 B8R1.2 BrCc1ccccn1 1P00BC33 [1,0,0,0,0,0|3,0,0]=4 286 B8R1.2 BrCc1cccnc1 1P0033XF [1,0,0,0,0,0|3,0,0]=4 287 B8R1.2 BrCc1cnccn1 1P001ID7 [1,0,0,0,0,0|2,0,0]=3 288 B8R1.2 C#Cc1ccccn1 1P003HOZ [1,0,0,0,0,0|2,0,1]=4 289 B8R1.2 C#Cc1cccnc1 1P002QXU [1,0,0,0,0,0|2,0,1]=4 290 B8R1.2 C#Cc1cnccn1 1P00ADUU [1,0,0,0,0,0|1,0,1]=3 291 B8R1.2 C=Cc1cccnc1 1P003491 [1,0,0,0,0,0|2,0,1]=4 292 B8R1.2 C=Cc1cnccn1 1P003IFF [1,0,0,0,0,0|1,0,1]=3 293 B8R1.2 CCc1ccccc1 1P0000N2 [1,0,0,0,0,0|3,0,0]=4 294 B8R1.2 CCc1ccccn1 1P0000NJ [1,0,0,0,0,0|2,0,0]=3 295 B8R1.2 CCc1cccnc1 1P00DE9B [1,0,0,0,0,0|2,0,0]=3 296 B8R1.2 CCc1cccnn1 1P00BI37 [1,0,0,0,0,0|3,0,0]=4 297 B8R1.2 CCc1ccncn1 1P0030XP [1,0,0,0,0,0|3,0,0]=4 298 B8R1.2 CCc1cnccn1 1P003HNC [1,0,0,0,0,0|1,0,0]=2 299 B8R1.2 CCc1cncnc1 1P002RAM [1,0,0,0,0,0|3,0,0]=4 300 B8R1.2 CCc1ncccn1 1P00EGF2 [1,0,0,0,0,0|3,0,0]=4 301 B8R1.2 CN=c1nncc[nH]1 1P00FGZ2 [1,0,0,0,0,0|2,0,1]=4 302 B8R1.2 CNc1ccccc1 1P0000NT [1,0,0,0,0,0|3,0,0]=4 303 B8R1.2 CNc1ccccc1 1P003TNS [1,0,0,0,0,0|3,0,0]=4 304 B8R1.2 CNc1ccccn1 1P003TP7 [1,0,0,0,0,0|2,0,0]=3 305 B8R1.2 CNc1cccnc1 1P00289C [1,0,0,0,0,0|2,0,0]=3 306 B8R1.2 CNc1cccnn1 1P00DM46 [1,0,0,0,0,0|3,0,0]=4 307 B8R1.2 CNc1ccncn1 1P00CCF5 [1,0,0,0,0,0|3,0,0]=4 308 B8R1.2 CNc1ccnnc1 1P0035V9 [1,0,0,0,0,0|3,0,0]=4 309 B8R1.2 CNc1cnccn1 1P00CL7Z [1,0,0,0,0,0|1,0,0]=2 310 B8R1.2 CNc1cncnc1 1P00CMNJ [1,0,0,0,0,0|3,0,0]=4 311 B8R1.2 CNc1ncccn1 1P00H1G9 [1,0,0,0,0,0|3,0,0]=4 312 B8R1.2 COc1[c-]nccc1 1P008UE4 [1,0,0,0,0,0|1,1,1]=4 313 B8R1.2 COc1ccccc1 1P0000NO [1,0,0,0,0,0|2,1,0]=4 314 B8R1.2 COc1ccccn1 1P001TWH [1,0,0,0,0,0|1,1,0]=3 315 B8R1.2 COc1cccnc1 1P00347L [1,0,0,0,0,0|1,1,0]=3 316 B8R1.2 COc1cccnn1 1P002F5K [1,0,0,0,0,0|2,1,0]=4 317 B8R1.2 COc1ccncn1 1P00EFLG [1,0,0,0,0,0|2,1,0]=4 318 B8R1.2 COc1ccnnc1 1P002JGU [1,0,0,0,0,0|2,1,0]=4 319 B8R1.2 COc1cnccn1 1P003I17 [1,0,0,0,0,0|0,1,0]=2 320 B8R1.2 COc1cncnc1 1P00BXRG [1,0,0,0,0,0|2,1,0]=4 321 B8R1.2 COc1ncccn1 1P003I1A [1,0,0,0,0,0|2,1,0]=4 322 B8R1.2 CSc1ccccc1 1P0000NM [1,0,0,0,0,0|2,0,0]=3 323 B8R1.2 CSc1ccccn1 1P00AP6U [1,0,0,0,0,0|1,0,0]=2 324 B8R1.2 CSc1cccnc1 1P002H17 [1,0,0,0,0,0|1,0,0]=2 325 B8R1.2 CSc1ccncc1 1P00CCG6 [1,0,0,0,0,0|3,0,0]=4 326 B8R1.2 CSc1cnccn1 1P003BJ9 [1,0,0,0,0,0|0,0,0]=1 327 B8R1.2 CSc1cncnc1 1P009JCV [1,0,0,0,0,0|2,0,0]=3 328 B8R1.2 CSc1ncccn1 1P00G4ZC [1,0,0,0,0,0|2,0,0]=3 329 B8R1.2 CSc1nccnn1 1P002WQZ [1,0,0,0,0,0|1,0,0]=2 330 B8R1.2 CSc1ncncn1 1P01Q3RJ [1,0,0,0,0,0|3,0,0]=4 331 B8R1.2 C[SiH2]c1ccccc1 1P005JR8 [1,0,0,0,0,0|3,0,0]=4 332 B8R1.2 ClCc1ccccn1 1P0033BZ [1,0,0,0,0,0|3,0,0]=4 333 B8R1.2 ClCc1ccccn1 1P0073L5 [1,0,0,0,0,0|3,0,0]=4 334 B8R1.2 ClCc1cccnc1 1P005WS5 [1,0,0,0,0,0|3,0,0]=4 335 B8R1.2 ClCc1cnccn1 1P002KZH [1,0,0,0,0,0|2,0,0]=3 336 B8R1.2 FCc1cccnc1 1P004R6V [1,0,0,0,0,0|3,0,0]=4 337 B8R1.2 ICc1cccnc1 1P005TG6 [1,0,0,0,0,0|3,0,0]=4 338 B8R1.2 N#Cc1ccccn1 1P0000NK [1,0,0,0,0,0|3,0,0]=4 339 B8R1.2 N#Cc1cccnc1 1P0000O0 [1,0,0,0,0,0|3,0,0]=4 340 B8R1.2 NCc1ccccn1 1P003IDS [1,0,0,0,0,0|3,0,0]=4 341 B8R1.2 NCc1cccnc1 1P003UIR [1,0,0,0,0,0|3,0,0]=4 342 B8R1.2 NCc1cccnc1 1P01XEWA [1,0,0,0,0,0|3,0,0]=4 343 B8R1.2 NCc1cnccn1 1P002CZT [1,0,0,0,0,0|2,0,0]=3 344 B8R1.2 NCc1cnccn1 1P00397Q [1,0,0,0,0,0|2,0,0]=3 345 B8R1.2 NCc1nccnc1 1P00HE98 [1,0,0,0,0,0|2,0,0]=3 346 B8R1.2 NNc1ccccn1 1P003HU7 [1,0,0,0,0,0|3,0,0]=4 347 B8R1.2 NNc1ccccn1 1P00DIES [1,0,0,0,0,0|3,0,0]=4 348 B8R1.2 NNc1ccccn1 1P00I9B1 [1,0,0,0,0,0|3,0,0]=4 349 B8R1.2 NNc1cccnc1 1P0037EA [1,0,0,0,0,0|3,0,0]=4 350 B8R1.2 NNc1cccnc1 1P00398X [1,0,0,0,0,0|3,0,0]=4 351 B8R1.2 NNc1cccnc1 1P003JZP [1,0,0,0,0,0|3,0,0]=4 352 B8R1.2 N\N=c/1\cncc[nH]1 1P00394I [1,0,0,0,0,0|2,0,1]=4 353 B8R1.2 O=Cc1ccccn1 1P0033WE [1,0,0,0,0,0|3,0,0]=4 354 B8R1.2 O=Cc1cccnc1 1P00348S [1,0,0,0,0,0|3,0,0]=4 355 B8R1.2 O=Cc1cnccn1 1P003937 [1,0,0,0,0,0|2,0,0]=3 356 B8R1.2 O=Nc1ccccn1 1P004ZQ7 [1,0,0,0,0,0|3,0,0]=4 357 B8R1.2 OCc1ccccn1 1P003UIQ [1,0,0,0,0,0|3,0,0]=4 358 B8R1.2 OCc1cccnc1 1P0000NZ [1,0,0,0,0,0|3,0,0]=4 359 B8R1.2 OCc1cnccn1 1P0033WD [1,0,0,0,0,0|2,0,0]=3 360 B8R1.2 SCc1ccccn1 1P0029Y2 [1,0,0,0,0,0|3,0,0]=4 361 B8R1.2 SCc1cccnc1 1P0024X6 [1,0,0,0,0,0|3,0,0]=4 362 B8R1.2 c1nccnc1C#N 1P002BZY [1,0,0,0,0,0|2,0,0]=3 363 B8R1.5 Brc1cccnc1C 1P00342P [1,0,0,0,0,0|2,0,0]=3 364 B8R1.5 Brc1cccnc1Cl 1P0033O3 [1,0,0,0,0,0|3,0,0]=4 365 B8R1.5 Brc1cccnc1F 1P00I7MV [1,0,0,0,0,0|3,0,0]=4 366 B8R1.5 Brc1cccnc1I 1P00BZY8 [1,0,0,0,0,0|3,0,0]=4 367 B8R1.5 Brc1cccnc1N 1P006ZHT [1,0,0,0,0,0|3,0,0]=4 368 B8R1.5 Brc1cccnc1O 1P00342L [1,0,0,0,0,0|2,1,0]=4 369 B8R1.5 Brc1cccnc1S 1P00FGR1 [1,0,0,0,0,0|2,0,0]=3 370 B8R1.5 Brc1ccnnc1C 1P028Z3K [1,0,0,0,0,0|3,0,0]=4 371 B8R1.5 Brc1cncnc1C 1P007YVW [1,0,0,0,0,0|3,0,0]=4 372 B8R1.5 Brc1ncccc1Br 1P0033E8 [1,0,0,0,0,0|3,0,0]=4 373 B8R1.5 Brc1nccnc1Br 1P006D3R [1,0,0,0,0,0|2,0,0]=3 374 B8R1.5 CC1=NCCN=C1C 1P001RXR [1,0,0,0,0,0|0,0,2]=3 375 B8R1.5 C[n+]1cccnc1N 1P01EX4U [1,0,0,0,0,0|3,0,0]=4 376 B8R1.5 Cc1cccc[n+]1C 1P008F0C [1,0,0,0,0,0|3,0,0]=4 377 B8R1.5 Cc1ccccc1Br 1P0033NP [1,0,0,0,0,0|3,0,0]=4 378 B8R1.5 Cc1ccccc1Cl 1P0060OI [1,0,0,0,0,0|3,0,0]=4 379 B8R1.5 Cc1ccccc1F 1P0060O5 [1,0,0,0,0,0|3,0,0]=4 380 B8R1.5 Cc1ccccc1I 1P003HXP [1,0,0,0,0,0|3,0,0]=4 381 B8R1.5 Cc1ccccc1N 1P003TYU [1,0,0,0,0,0|3,0,0]=4 382 B8R1.5 Cc1ccccc1O 1P005GSC [1,0,0,0,0,0|2,1,0]=4 383 B8R1.5 Cc1ccccc1S 1P001358 [1,0,0,0,0,0|2,0,0]=3 384 B8R1.5 Cc1cccnc1Br 1P003H3T [1,0,0,0,0,0|2,0,0]=3 385 B8R1.5 Cc1cccnc1Cl 1P003HCR [1,0,0,0,0,0|2,0,0]=3 386 B8R1.5 Cc1cccnc1F 1P002OMV [1,0,0,0,0,0|2,0,0]=3 387 B8R1.5 Cc1cccnc1I 1P006ZIM [1,0,0,0,0,0|2,0,0]=3 388 B8R1.5 Cc1cccnc1N 1P003GUI [1,0,0,0,0,0|2,0,0]=3 389 B8R1.5 Cc1cccnc1O 1P006L3K [1,0,0,0,0,0|1,1,0]=3 390 B8R1.5 Cc1ccnnc1Br 1P001H7G [1,0,0,0,0,0|3,0,0]=4 391 B8R1.5 Cc1ccnnc1Cl 1P005MDO [1,0,0,0,0,0|3,0,0]=4 392 B8R1.5 Cc1ccnnc1N 1P003JCM [1,0,0,0,0,0|3,0,0]=4 393 B8R1.5 Cc1cnccc1C 1P00E9VT [1,0,0,0,0,0|3,0,0]=4 394 B8R1.5 Cc1cncnc1Br 1P000P75 [1,0,0,0,0,0|3,0,0]=4 395 B8R1.5 Cc1cncnc1Cl 1P00DB4W [1,0,0,0,0,0|3,0,0]=4 396 B8R1.5 Cc1cncnc1N 1P0037ZT [1,0,0,0,0,0|3,0,0]=4 397 B8R1.5 Cc1cncnc1O 1P007URT [1,0,0,0,0,0|2,1,0]=4 398 B8R1.5 Cc1ncccc1C 1P003G1A [1,0,0,0,0,0|1,0,0]=2 399 B8R1.5 Cc1nccnc1Br 1P003H3S [1,0,0,0,0,0|1,0,0]=2 400 B8R1.5 Cc1nccnc1C 1P003G19 [1,0,0,0,0,0|0,0,0]=1 401 B8R1.5 Cc1nccnc1Cl 1P0033O7 [1,0,0,0,0,0|1,0,0]=2 402 B8R1.5 Cc1nccnc1F 1P028HOG [1,0,0,0,0,0|1,0,0]=2 403 B8R1.5 Cc1nccnc1I 1P00EGD2 [1,0,0,0,0,0|1,0,0]=2 404 B8R1.5 Cc1nccnc1N 1P002BXP [1,0,0,0,0,0|1,0,0]=2 405 B8R1.5 Cc1nccnc1N 1P01FJXT [1,0,0,0,0,0|1,0,0]=2 406 B8R1.5 Cc1nnccc1C 1P01AMA9 [1,0,0,0,0,0|2,0,0]=3 407 B8R1.5 Cc1nncnc1O 1P00HZ45 [1,0,0,0,0,0|1,1,0]=3 408 B8R1.5 Clc1cccnc1Br 1P0033LM [1,0,0,0,0,0|3,0,0]=4 409 B8R1.5 Clc1cccnc1C 1P008RBW [1,0,0,0,0,0|2,0,0]=3 410 B8R1.5 Clc1cccnc1F 1P003JNM [1,0,0,0,0,0|3,0,0]=4 411 B8R1.5 Clc1cccnc1I 1P0036XU [1,0,0,0,0,0|3,0,0]=4 412 B8R1.5 Clc1cccnc1N 1P003GU5 [1,0,0,0,0,0|3,0,0]=4 413 B8R1.5 Clc1cccnc1O 1P003JS9 [1,0,0,0,0,0|2,1,0]=4 414 B8R1.5 Clc1cccnc1S 1P00EJOL [1,0,0,0,0,0|2,0,0]=3 415 B8R1.5 Clc1ccnnc1C 1P027OIV [1,0,0,0,0,0|3,0,0]=4 416 B8R1.5 Clc1cncnc1C 1P00DF1Z [1,0,0,0,0,0|3,0,0]=4 417 B8R1.5 Clc1ncccc1Cl 1P0033ED [1,0,0,0,0,0|3,0,0]=4 418 B8R1.5 Clc1nccnc1Br 1P0093ET [1,0,0,0,0,0|2,0,0]=3 419 B8R1.5 Clc1nccnc1Cl 1P003FYH [1,0,0,0,0,0|2,0,0]=3 420 B8R1.5 Clc1nccnc1I 1P003BCW [1,0,0,0,0,0|2,0,0]=3 421 B8R1.5 Cn1cccnc1=S 1P01EXP3 [1,0,0,0,0,0|2,0,1]=4 422 B8R1.5 Fc1ccccc1S 1P0033SM [1,0,0,0,0,0|3,0,0]=4 423 B8R1.5 Fc1cccnc1Br 1P0033LP [1,0,0,0,0,0|3,0,0]=4 424 B8R1.5 Fc1cccnc1C 1P001R2T [1,0,0,0,0,0|2,0,0]=3 425 B8R1.5 Fc1cccnc1Cl 1P003HC6 [1,0,0,0,0,0|3,0,0]=4 426 B8R1.5 Fc1cccnc1I 1P001E78 [1,0,0,0,0,0|3,0,0]=4 427 B8R1.5 Fc1cccnc1N 1P003GU9 [1,0,0,0,0,0|3,0,0]=4 428 B8R1.5 Fc1cccnc1O 1P003JVS [1,0,0,0,0,0|2,1,0]=4 429 B8R1.5 Fc1ncccc1F 1P001NQA [1,0,0,0,0,0|3,0,0]=4 430 B8R1.5 Fc1nccnc1Br 1P002IV2 [1,0,0,0,0,0|2,0,0]=3 431 B8R1.5 Fc1nccnc1Cl 1P0285JV [1,0,0,0,0,0|2,0,0]=3 432 B8R1.5 Fc1nccnc1F 1P00I9WA [1,0,0,0,0,0|2,0,0]=3 433 B8R1.5 Fc1nccnc1I 1P00CG68 [1,0,0,0,0,0|2,0,0]=3 434 B8R1.5 Ic1cccnc1Br 1P002UAK [1,0,0,0,0,0|3,0,0]=4 435 B8R1.5 Ic1cccnc1C 1P001NKR [1,0,0,0,0,0|2,0,0]=3 436 B8R1.5 Ic1cccnc1Cl 1P003HCE [1,0,0,0,0,0|3,0,0]=4 437 B8R1.5 Ic1cccnc1F 1P000AOS [1,0,0,0,0,0|3,0,0]=4 438 B8R1.5 Ic1cccnc1N 1P003K2I [1,0,0,0,0,0|3,0,0]=4 439 B8R1.5 Ic1cccnc1O 1P008ZKZ [1,0,0,0,0,0|2,1,0]=4 440 B8R1.5 Ic1cncnc1C 1P00H1F1 [1,0,0,0,0,0|3,0,0]=4 441 B8R1.5 Ic1ncccc1I 1P003FZY [1,0,0,0,0,0|3,0,0]=4 442 B8R1.5 Ic1nccnc1I 1P01K2EU [1,0,0,0,0,0|2,0,0]=3 443 B8R1.5 Nc1cccnc1Br 1P003JB2 [1,0,0,0,0,0|3,0,0]=4 444 B8R1.5 Nc1cccnc1C 1P00341I [1,0,0,0,0,0|2,0,0]=3 445 B8R1.5 Nc1cccnc1Cl 1P003HBX [1,0,0,0,0,0|3,0,0]=4 446 B8R1.5 Nc1cccnc1F 1P001RT2 [1,0,0,0,0,0|3,0,0]=4 447 B8R1.5 Nc1cccnc1I 1P002KMR [1,0,0,0,0,0|3,0,0]=4 448 B8R1.5 Nc1cccnc1O 1P00IB08 [1,0,0,0,0,0|2,1,0]=4 449 B8R1.5 Nc1cccnc1O 1P01A8IE [1,0,0,0,0,0|2,1,0]=4 450 B8R1.5 Nc1ccnnc1C 1P01A5Q6 [1,0,0,0,0,0|3,0,0]=4 451 B8R1.5 Nc1cncnc1C 1P00C0LQ [1,0,0,0,0,0|3,0,0]=4 452 B8R1.5 Nc1ncccc1N 1P00396H [1,0,0,0,0,0|3,0,0]=4 453 B8R1.5 Nc1nccnc1Br 1P007P84 [1,0,0,0,0,0|2,0,0]=3 454 B8R1.5 Nc1nccnc1Cl 1P003GU4 [1,0,0,0,0,0|2,0,0]=3 455 B8R1.5 Nc1nccnc1F 1P019DIR [1,0,0,0,0,0|2,0,0]=3 456 B8R1.5 Nc1nccnc1I 1P007G5N [1,0,0,0,0,0|2,0,0]=3 457 B8R1.5 Nc1nccnc1N 1P000WG1 [1,0,0,0,0,0|2,0,0]=3 458 B8R1.5 O=c1[nH]cccc1C 1P0001Z2 [1,0,0,0,0,0|1,1,1]=4 459 B8R1.5 O=c1[nH]ccnc1C 1P002BXQ [1,0,0,0,0,0|0,1,1]=3 460 B8R1.5 O=c1[nH]ccnc1C 1P01BCE2 [1,0,0,0,0,0|0,1,1]=3 461 B8R1.5 O=c1[nH]ccnc1Cl 1P0096JP [1,0,0,0,0,0|1,1,1]=4 462 B8R1.5 O=c1[nH]ccnc1N 1P003JEO [1,0,0,0,0,0|1,1,1]=4 463 B8R1.5 Oc1ccccc1S 1P003HZ2 [1,0,0,0,0,0|3,0,0]=4 464 B8R1.5 Oc1cccnc1Br 1P0033LQ [1,0,0,0,0,0|2,1,0]=4 465 B8R1.5 Oc1cccnc1C 1P00346K [1,0,0,0,0,0|1,1,0]=3 466 B8R1.5 Oc1cccnc1Cl 1P0033O5 [1,0,0,0,0,0|2,1,0]=4 467 B8R1.5 Oc1cccnc1F 1P0020B6 [1,0,0,0,0,0|2,1,0]=4 468 B8R1.5 Oc1cccnc1I 1P003HX4 [1,0,0,0,0,0|2,1,0]=4 469 B8R1.5 Oc1cccnc1N 1P003GUC [1,0,0,0,0,0|2,1,0]=4 470 B8R1.5 Oc1cncnc1C 1P0004JY [1,0,0,0,0,0|2,1,0]=4 471 B8R1.5 Oc1ncccc1O 1P0036P2 [1,0,0,0,0,0|2,1,0]=4 472 B8R1.5 Oc1nccnc1Br 1P009KC7 [1,0,0,0,0,0|1,1,0]=3 473 B8R1.5 Oc1nccnc1I 1P028MFM [1,0,0,0,0,0|1,1,0]=3 474 B8R1.5 Oc1nccnc1O 1P01EC4P [1,0,0,0,0,0|1,1,0]=3 475 B8R1.5 S=c1[nH]cccc1C 1P0076M2 [1,0,0,0,0,0|1,0,2]=4 476 B8R1.5 S=c1[nH]ccnc1C 1P01GFHU [1,0,0,0,0,0|0,0,2]=3 477 B8R1.5 Sc1ccccc1Br 1P003H9T [1,0,0,0,0,0|3,0,0]=4 478 B8R1.5 Sc1ccccc1Cl 1P0033QH [1,0,0,0,0,0|3,0,0]=4 479 B8R1.5 Sc1ccccc1I 1P00CMOS [1,0,0,0,0,0|3,0,0]=4 480 B8R1.5 Sc1ccccc1S 1P0021E0 [1,0,0,0,0,0|3,0,0]=4 481 B8R1.5 [O-]c1ccccc1C 1P00E08C [1,0,0,0,0,0|2,1,0]=4 482 B10R1.2 CCc1nccc(c1N)C 1P01BKOZ [0,1,0,0,0,0|3,0,0]=4 483 B10R1.2 CCc1ncnc(c1C)O 1P00AI96 [0,1,0,0,0,0|3,0,0]=4 484 B10R1.2 CNc1cccc(c1C)C 1P019WOD [0,1,0,0,0,0|3,0,0]=4 485 B10R1.2 CNc1cccc(c1C)Cl 1P005ZC7 [0,1,0,0,0,0|3,0,0]=4 486 B10R1.2 CNc1cccc(c1C)F 1P028IT6 [0,1,0,0,0,0|3,0,0]=4 487 B10R1.2 CNc1nccc(c1F)Br 1P027WD2 [0,1,0,0,0,0|3,0,0]=4 488 B10R1.2 CNc1ncnc(c1C)Cl 1P01DXW0 [0,1,0,0,0,0|3,0,0]=4 489 B10R1.2 COc1cccc(c1C)Br 1P003JHE [0,1,0,0,0,0|2,1,0]=4 490 B10R1.2 COc1cccc(c1C)C 1P002YUM [0,1,0,0,0,0|2,1,0]=4 491 B10R1.2 COc1cccc(c1C)Cl 1P003JNU [0,1,0,0,0,0|2,1,0]=4 492 B10R1.2 COc1cccc(c1C)F 1P008VJL [0,1,0,0,0,0|2,1,0]=4 493 B10R1.2 COc1cccc(c1C)I 1P00BFR2 [0,1,0,0,0,0|2,1,0]=4 494 B10R1.2 COc1cccc(c1C)N 1P003EE8 [0,1,0,0,0,0|2,1,0]=4 495 B10R1.2 COc1cccc(c1C)N 1P00501Y [0,1,0,0,0,0|2,1,0]=4 496 B10R1.2 COc1cccc(c1C)O 1P00FCNP [0,1,0,0,0,0|2,1,0]=4 497 B10R1.2 COc1nccc(c1Br)C 1P005G29 [0,1,0,0,0,0|2,1,0]=4 498 B10R1.2 COc1nccc(c1Br)Cl 1P01FPBK [0,1,0,0,0,0|2,1,0]=4 499 B10R1.2 COc1nccc(c1Br)F 1P00HIV4 [0,1,0,0,0,0|2,1,0]=4 500 B10R1.2 COc1nccc(c1Br)N 1P00C4OS [0,1,0,0,0,0|2,1,0]=4 501 B10R1.2 COc1nccc(c1Br)O 1P01NDAD [0,1,0,0,0,0|2,1,0]=4 502 B10R1.2 COc1nccc(c1C)Br 1P0083MK [0,1,0,0,0,0|1,1,0]=3 503 B10R1.2 COc1nccc(c1C)I 1P01XFNW [0,1,0,0,0,0|1,1,0]=3 504 B10R1.2 COc1nccc(c1C)N 1P01V73M [0,1,0,0,0,0|1,1,0]=3 505 B10R1.2 COc1nccc(c1Cl)Br 1P00HHDI [0,1,0,0,0,0|2,1,0]=4 506 B10R1.2 COc1nccc(c1Cl)Cl 1P00II2H [0,1,0,0,0,0|2,1,0]=4 507 B10R1.2 COc1nccc(c1Cl)I 1P01BK8N [0,1,0,0,0,0|2,1,0]=4 508 B10R1.2 COc1nccc(c1F)Br 1P01B73G [0,1,0,0,0,0|2,1,0]=4 509 B10R1.2 COc1nccc(c1F)C 1P01XCBI [0,1,0,0,0,0|2,1,0]=4 510 B10R1.2 COc1nccc(c1F)Cl 1P01BOD3 [0,1,0,0,0,0|2,1,0]=4 511 B10R1.2 COc1nccc(c1F)N 1P000K5I [0,1,0,0,0,0|2,1,0]=4 512 B10R1.2 COc1nccc(c1I)C 1P01PZS3 [0,1,0,0,0,0|2,1,0]=4 513 B10R1.2 COc1nccc(c1I)Cl 1P01X067 [0,1,0,0,0,0|2,1,0]=4 514 B10R1.2 COc1nccc(c1I)N 1P000PJ3 [0,1,0,0,0,0|2,1,0]=4 515 B10R1.2 COc1nccc(c1N)Br 1P0292C9 [0,1,0,0,0,0|2,1,0]=4 516 B10R1.2 COc1nccc(c1N)C 1P00G4HD [0,1,0,0,0,0|2,1,0]=4 517 B10R1.2 COc1nccc(c1N)N 1P00C81U [0,1,0,0,0,0|2,1,0]=4 518 B10R1.2 COc1ncnc(c1C)Br 1P01DZFS [0,1,0,0,0,0|2,1,0]=4 519 B10R1.2 COc1ncnc(c1C)Cl 1P00IK7T [0,1,0,0,0,0|2,1,0]=4 520 B10R1.2 COc1ncnc(c1C)N 1P028DYD [0,1,0,0,0,0|2,1,0]=4 521 B10R1.2 CSc1cccc(c1C)Cl 1P0036WI [0,1,0,0,0,0|2,0,0]=3 522 B10R1.2 CSc1cccc(c1N)C 1P000212 [0,1,0,0,0,0|3,0,0]=4 523 B10R1.2 CSc1ncnc(c1C)Cl 1P019FEN [0,1,0,0,0,0|2,0,0]=3 524 B10R1.2 CSc1ncnc(c1Cl)Cl 1P027U7A [0,1,0,0,0,0|3,0,0]=4 525 B10R1.2 ClCc1nccc(c1C)Cl 1P001YCA [0,1,0,0,0,0|3,0,0]=4 526 B10R1.2 ClCc1nccc(c1C)Cl 1P007Z2V [0,1,0,0,0,0|3,0,0]=4 527 B10R1.2 N#Cc1nccc(c1C)Br 1P00GSJO [0,1,0,0,0,0|3,0,0]=4 528 B10R1.2 N#Cc1nccc(c1C)C 1P01DT9V [0,1,0,0,0,0|3,0,0]=4 529 B10R1.2 N#Cc1nccc(c1C)Cl 1P00IFQU [0,1,0,0,0,0|3,0,0]=4 530 B10R1.2 N#Cc1nccc(c1C)N 1P023J93 [0,1,0,0,0,0|3,0,0]=4 531 B10R1.2 NCc1nccc(c1C)Cl 1P028W0S [0,1,0,0,0,0|3,0,0]=4 532 B10R1.2 O=Cc1nccc(c1C)Cl 1P01JJT1 [0,1,0,0,0,0|3,0,0]=4 533 B10R1.4 BrCCc1ccccc1C 1P001Y5M [0,1,0,0,0,0|3,0,0]=4 534 B10R1.4 CCCc1nccnc1Cl 1P01B7EN [0,1,0,0,0,0|2,0,0]=3 535 B10R1.4 CCCc1nccnc1N 1P01B74B [0,1,0,0,0,0|2,0,0]=3 536 B10R1.4 CCNc1ccccc1C 1P00IIDL [0,1,0,0,0,0|3,0,0]=4 537 B10R1.4 CCNc1cccnc1N 1P00BBQE [0,1,0,0,0,0|3,0,0]=4 538 B10R1.4 CCNc1ncccc1C 1P01BI60 [0,1,0,0,0,0|2,0,0]=3 539 B10R1.4 CCNc1ncccc1I 1P0283H5 [0,1,0,0,0,0|3,0,0]=4 540 B10R1.4 CCNc1ncccc1N 1P007HGD [0,1,0,0,0,0|3,0,0]=4 541 B10R1.4 CCNc1ncccc1N 1P019X8Y [0,1,0,0,0,0|3,0,0]=4 542 B10R1.4 CCNc1nccnc1Cl 1P01ADOY [0,1,0,0,0,0|2,0,0]=3 543 B10R1.4 CCNc1nccnc1N 1P00H39U [0,1,0,0,0,0|2,0,0]=3 544 B10R1.4 CCOc1ccccc1C 1P00EDEP [0,1,0,0,0,0|2,1,0]=4 545 B10R1.4 CCOc1cccnc1Br 1P00436J [0,1,0,0,0,0|2,1,0]=4 546 B10R1.4 CCOc1cccnc1F 1P00IDVS [0,1,0,0,0,0|2,1,0]=4 547 B10R1.4 CCOc1cccnc1N 1P00019E [0,1,0,0,0,0|2,1,0]=4 548 B10R1.4 CCOc1ncccc1Br 1P003JH0 [0,1,0,0,0,0|2,1,0]=4 549 B10R1.4 CCOc1ncccc1Cl 1P0025YL [0,1,0,0,0,0|2,1,0]=4 550 B10R1.4 CCOc1ncccc1I 1P003HMK [0,1,0,0,0,0|2,1,0]=4 551 B10R1.4 CCOc1ncccc1N 1P00DLRU [0,1,0,0,0,0|2,1,0]=4 552 B10R1.4 CCOc1ncccc1O 1P002HLC [0,1,0,0,0,0|2,1,0]=4 553 B10R1.4 CCOc1nccnc1Cl 1P00K0RP [0,1,0,0,0,0|1,1,0]=3 554 B10R1.4 CCOc1nccnc1N 1P0042RB [0,1,0,0,0,0|1,1,0]=3 555 B10R1.4 CCSc1ccc[nH]c1=O 1P01E38X [0,1,0,0,0,0|2,0,1]=4 556 B10R1.4 CCSc1ccccc1Br 1P008E10 [0,1,0,0,0,0|3,0,0]=4 557 B10R1.4 CCSc1ccccc1Cl 1P00I77K [0,1,0,0,0,0|3,0,0]=4 558 B10R1.4 CCSc1ccccc1N 1P001AY7 [0,1,0,0,0,0|3,0,0]=4 559 B10R1.4 CCSc1ccccc1N 1P00J3QB [0,1,0,0,0,0|3,0,0]=4 560 B10R1.4 CCSc1ccccc1O 1P002Z6A [0,1,0,0,0,0|3,0,0]=4 561 B10R1.4 CCSc1cccnc1Cl 1P028BNW [0,1,0,0,0,0|2,0,0]=3 562 B10R1.4 CNCc1ccccc1C 1P004MU6 [0,1,0,0,0,0|3,0,0]=4 563 B10R1.4 CNCc1ccccc1C 1P00J2B1 [0,1,0,0,0,0|3,0,0]=4 564 B10R1.4 CNCc1cccnc1Br 1P028TJK [0,1,0,0,0,0|3,0,0]=4 565 B10R1.4 CNCc1cccnc1Cl 1P00J21X [0,1,0,0,0,0|3,0,0]=4 566 B10R1.4 CNCc1cccnc1Cl 1P0285O8 [0,1,0,0,0,0|3,0,0]=4 567 B10R1.4 CNCc1ncccc1C 1P004GWM [0,1,0,0,0,0|2,0,0]=3 568 B10R1.4 CNCc1ncccc1Cl 1P028SIC [0,1,0,0,0,0|3,0,0]=4 569 B10R1.4 COCc1cccnc1Br 1P01QOYF [0,1,0,0,0,0|2,1,0]=4 570 B10R1.4 CSCc1ccccc1Br 1P01AM4A [0,1,0,0,0,0|3,0,0]=4 571 B10R1.4 CSCc1ccccc1F 1P01DIBG [0,1,0,0,0,0|3,0,0]=4 572 B10R1.4 CSCc1ccccc1N 1P01AC36 [0,1,0,0,0,0|3,0,0]=4 573 B10R1.4 Cc1ncccc1CC#N 1P0004CB [0,1,0,0,0,0|2,0,1]=4 574 B10R1.4 Cc1ncccc1CCN 1P00E8BN [0,1,0,0,0,0|2,0,0]=3 575 B10R1.4 Cc1ncccc1CNC 1P003I33 [0,1,0,0,0,0|2,0,0]=3 576 B10R1.4 Cc1ncccc1NCC 1P01BHU6 [0,1,0,0,0,0|2,0,0]=3 577 B10R1.4 Cc1ncccc1\C=N/O 1P024ZS2 [0,1,0,0,0,0|3,0,0]=4 578 B10R1.4 Cc1nccnc1CC#N 1P01BIFE [0,1,0,0,0,0|1,0,1]=3 579 B10R1.4 Cc1nccnc1CCN 1P01AN51 [0,1,0,0,0,0|1,0,0]=2 580 B10R1.4 Cc1nccnc1CCO 1P00E9U6 [0,1,0,0,0,0|1,0,0]=2 581 B10R1.4 Cc1nccnc1NCC 1P01BHBI [0,1,0,0,0,0|1,0,0]=2 582 B10R1.4 Cc1nccnc1OCC 1P003JU7 [0,1,0,0,0,0|0,1,0]=2 583 B10R1.4 ClCCc1ccccc1C 1P0076GQ [0,1,0,0,0,0|3,0,0]=4 584 B10R1.4 ClCSc1ccccc1C 1P01IES8 [0,1,0,0,0,0|2,0,0]=3 585 B10R1.4 Clc1ncccc1CCCl 1P01EMD0 [0,1,0,0,0,0|3,0,0]=4 586 B10R1.4 Clc1nccnc1CC#N 1P00H043 [0,1,0,0,0,0|2,0,1]=4 587 B10R1.4 Fc1ncccc1CCCl 1P028QVG [0,1,0,0,0,0|3,0,0]=4 588 B10R1.4 NCCc1ccccc1C 1P00IAEQ [0,1,0,0,0,0|3,0,0]=4 589 B10R1.4 NCCc1cccnc1Cl 1P028PPO [0,1,0,0,0,0|3,0,0]=4 590 B10R1.4 NCCc1cccnc1F 1P028R5T [0,1,0,0,0,0|3,0,0]=4 591 B10R1.4 NCCc1cccnc1O 1P027WOI [0,1,0,0,0,0|3,0,0]=4 592 B10R1.4 NCCc1cccnc1O 1P028FLD [0,1,0,0,0,0|3,0,0]=4 593 B10R1.4 NCCc1ncccc1Br 1P006RZ7 [0,1,0,0,0,0|3,0,0]=4 594 B10R1.4 NCCc1ncccc1C 1P004NE2 [0,1,0,0,0,0|2,0,0]=3 595 B10R1.4 NCCc1ncccc1C 1P01C4WV [0,1,0,0,0,0|2,0,0]=3 596 B10R1.4 NCCc1ncccc1F 1P00AO5H [0,1,0,0,0,0|3,0,0]=4 597 B10R1.4 Nc1ncccc1CCN 1P01EKM6 [0,1,0,0,0,0|3,0,0]=4 598 B10R1.4 OCCc1ccccc1C 1P002BSO [0,1,0,0,0,0|3,0,0]=4 599 B10R1.4 OCCc1cccnc1Cl 1P01DVQ8 [0,1,0,0,0,0|3,0,0]=4 600 B10R1.4 OCCc1cccnc1F 1P00B8Q6 [0,1,0,0,0,0|3,0,0]=4 601 B10R1.4 OCCc1ncccc1Br 1P000LZX [0,1,0,0,0,0|3,0,0]=4 602 B10R1.4 OCCc1ncccc1C 1P00DDGW [0,1,0,0,0,0|2,0,0]=3 603 B10R1.4 OCCc1ncccc1F 1P000177 [0,1,0,0,0,0|3,0,0]=4 604 B10R1.4 [N-]=[N+]=Nc1ncccc1C 1P01B3MK [0,1,0,0,0,0|3,0,0]=4 605 B10R1.20 BrCc1ccccc1CC 1P01AVGD [0,1,0,0,0,0|3,0,0]=4 606 B10R1.20 BrCc1cccnc1C#N 1P000DX2 [0,1,0,0,0,0|3,0,0]=4 607 B10R1.20 BrCc1ncccc1C#N 1P000DX3 [0,1,0,0,0,0|3,0,0]=4 608 B10R1.20 C#Cc1ccccc1SC 1P005OS7 [0,1,0,0,0,0|2,0,1]=4 609 B10R1.20 C#Cc1nccnc1OC 1P009GA8 [0,1,0,0,0,0|0,1,1]=3 610 B10R1.20 CCc1ccccc1CC 1P003DUZ [0,1,0,0,0,0|3,0,0]=4 611 B10R1.20 CCc1ccccc1CC 1P003PYH [0,1,0,0,0,0|3,0,0]=4 612 B10R1.20 CCc1cccnc1C#N 1P00EGLP [0,1,0,0,0,0|2,0,1]=4 613 B10R1.20 CCc1cccnc1C=O 1P028QR1 [0,1,0,0,0,0|2,0,1]=4 614 B10R1.20 CCc1cccnc1CCl 1P02893D [0,1,0,0,0,0|2,0,0]=3 615 B10R1.20 CCc1cccnc1CN 1P01A3Z1 [0,1,0,0,0,0|2,0,0]=3 616 B10R1.20 CCc1ncccc1C=O 1P00KEMW [0,1,0,0,0,0|2,0,1]=4 617 B10R1.20 CCc1ncccc1CCl 1P028R6K [0,1,0,0,0,0|2,0,0]=3 618 B10R1.20 CCc1ncccc1CO 1P01B7OZ [0,1,0,0,0,0|2,0,0]=3 619 B10R1.20 CCc1nccnc1CC 1P001PNP [0,1,0,0,0,0|1,0,0]=2 620 B10R1.20 CNc1ccccc1CC 1P0023UP [0,1,0,0,0,0|3,0,0]=4 621 B10R1.20 CNc1ccccc1CCl 1P01FO27 [0,1,0,0,0,0|3,0,0]=4 622 B10R1.20 CNc1ccccc1CN 1P028BJJ [0,1,0,0,0,0|3,0,0]=4 623 B10R1.20 CNc1ccccc1CO 1P002XNH [0,1,0,0,0,0|3,0,0]=4 624 B10R1.20 CNc1ccccc1NC 1P00CNFX [0,1,0,0,0,0|3,0,0]=4 625 B10R1.20 CNc1cccnc1C#N 1P01BGBT [0,1,0,0,0,0|2,0,1]=4 626 B10R1.20 CNc1cccnc1CN 1P01BGGE [0,1,0,0,0,0|2,0,0]=3 627 B10R1.20 CNc1cccnc1OC 1P01AKCY [0,1,0,0,0,0|1,1,0]=3 628 B10R1.20 CNc1ncccc1C#N 1P00DAUM [0,1,0,0,0,0|2,0,1]=4 629 B10R1.20 CNc1ncccc1C=O 1P00383H [0,1,0,0,0,0|2,0,1]=4 630 B10R1.20 CNc1ncccc1C=O 1P00J1KK [0,1,0,0,0,0|2,0,1]=4 631 B10R1.20 CNc1ncccc1CN 1P009464 [0,1,0,0,0,0|2,0,0]=3 632 B10R1.20 CNc1ncccc1CN 1P028GWW [0,1,0,0,0,0|2,0,0]=3 633 B10R1.20 CNc1ncccc1CO 1P00BXVP [0,1,0,0,0,0|2,0,0]=3 634 B10R1.20 CNc1ncccc1OC 1P00GSOH [0,1,0,0,0,0|1,1,0]=3 635 B10R1.20 COc1ccccc1CC 1P001FV1 [0,1,0,0,0,0|2,1,0]=4 636 B10R1.20 COc1ccccc1CCl 1P00FAJI [0,1,0,0,0,0|2,1,0]=4 637 B10R1.20 COc1ccccc1CN 1P0033U9 [0,1,0,0,0,0|2,1,0]=4 638 B10R1.20 COc1ccccc1CO 1P0033U8 [0,1,0,0,0,0|2,1,0]=4 639 B10R1.20 COc1ccccc1CS 1P00H232 [0,1,0,0,0,0|2,1,0]=4 640 B10R1.20 COc1ccccc1NC 1P003BPL [0,1,0,0,0,0|2,1,0]=4 641 B10R1.20 COc1ccccc1NC 1P01B5L6 [0,1,0,0,0,0|2,1,0]=4 642 B10R1.20 COc1cccnc1C#C 1P000OUK [0,1,0,0,0,0|1,1,1]=4 643 B10R1.20 COc1cccnc1C#N 1P006XW2 [0,1,0,0,0,0|1,1,1]=4 644 B10R1.20 COc1cccnc1C=O 1P00757W [0,1,0,0,0,0|1,1,1]=4 645 B10R1.20 COc1cccnc1CBr 1P00H1GU [0,1,0,0,0,0|1,1,0]=3 646 B10R1.20 COc1cccnc1CCl 1P00J2PV [0,1,0,0,0,0|1,1,0]=3 647 B10R1.20 COc1cccnc1CN 1P001RDF [0,1,0,0,0,0|1,1,0]=3 648 B10R1.20 COc1cccnc1CN 1P00IB19 [0,1,0,0,0,0|1,1,0]=3 649 B10R1.20 COc1cccnc1CO 1P00DG0S [0,1,0,0,0,0|1,1,0]=3 650 B10R1.20 COc1cccnc1NN 1P002LJX [0,1,0,0,0,0|2,1,0]=4 651 B10R1.20 COc1ncccc1C#C 1P009A5K [0,1,0,0,0,0|1,1,1]=4 652 B10R1.20 COc1ncccc1C#N 1P0064SE [0,1,0,0,0,0|1,1,1]=4 653 B10R1.20 COc1ncccc1C=O 1P006AHW [0,1,0,0,0,0|1,1,1]=4 654 B10R1.20 COc1ncccc1CBr 1P003INQ [0,1,0,0,0,0|1,1,0]=3 655 B10R1.20 COc1ncccc1CCl 1P001T4O [0,1,0,0,0,0|1,1,0]=3 656 B10R1.20 COc1ncccc1CCl 1P007R59 [0,1,0,0,0,0|1,1,0]=3 657 B10R1.20 COc1ncccc1CN 1P000HEH [0,1,0,0,0,0|1,1,0]=3 658 B10R1.20 COc1ncccc1CN 1P00CJ84 [0,1,0,0,0,0|1,1,0]=3 659 B10R1.20 COc1ncccc1CO 1P0083MJ [0,1,0,0,0,0|1,1,0]=3 660 B10R1.20 COc1ncccc1NN 1P01FSJY [0,1,0,0,0,0|2,1,0]=4 661 B10R1.20 COc1ncccc1NN 1P028FD1 [0,1,0,0,0,0|2,1,0]=4 662 B10R1.20 COc1ncccc1OC 1P00I9VK [0,1,0,0,0,0|1,1,0]=3 663 B10R1.20 COc1nccnc1CC 1P007MTD [0,1,0,0,0,0|0,1,0]=2 664 B10R1.20 COc1nccnc1CCl 1P00HGER [0,1,0,0,0,0|0,1,0]=2 665 B10R1.20 COc1nccnc1CO 1P01DEB9 [0,1,0,0,0,0|0,1,0]=2 666 B10R1.20 COc1nccnc1NN 1P002LJV [0,1,0,0,0,0|1,1,0]=3 667 B10R1.20 COc1nccnc1OC 1P00G0K5 [0,1,0,0,0,0|0,1,0]=2 668 B10R1.20 COc1ncncc1CO 1P00ATX1 [0,1,0,0,0,0|2,1,0]=4 669 B10R1.20 COc1ncncc1OC 1P005L68 [0,1,0,0,0,0|2,1,0]=4 670 B10R1.20 CSc1ccccc1CC 1P002JMX [0,1,0,0,0,0|2,0,0]=3 671 B10R1.20 CSc1ccccc1CCl 1P01A6A1 [0,1,0,0,0,0|2,0,0]=3 672 B10R1.20 CSc1ccccc1CN 1P00DD8R [0,1,0,0,0,0|2,0,0]=3 673 B10R1.20 CSc1ccccc1CO 1P00BYKB [0,1,0,0,0,0|2,0,0]=3 674 B10R1.20 CSc1ccccc1NC 1P0072HI [0,1,0,0,0,0|2,0,0]=3 675 B10R1.20 CSc1ccccc1NN 1P01AASO [0,1,0,0,0,0|3,0,0]=4 676 B10R1.20 CSc1ccccc1OC 1P003I1B [0,1,0,0,0,0|2,0,0]=3 677 B10R1.20 CSc1ccccc1SC 1P003DSJ [0,1,0,0,0,0|2,0,0]=3 678 B10R1.20 CSc1cccnc1C#N 1P00D4TM [0,1,0,0,0,0|1,0,1]=3 679 B10R1.20 CSc1ccncc1CN 1P028XIE [0,1,0,0,0,0|3,0,0]=4 680 B10R1.20 CSc1nccnc1CC 1P003HNN [0,1,0,0,0,0|0,0,0]=1 681 B10R1.20 ClCc1ncccc1C#N 1P008GHG [0,1,0,0,0,0|3,0,0]=4 682 B10R1.20 ClCc1ncccc1CCl 1P00BFQX [0,1,0,0,0,0|3,0,0]=4 683 B10R1.20 N#Cc1nccnc1C#N 1P003UIH [0,1,0,0,0,0|2,0,1]=4 684 B10R1.20 N#Cc1nccnc1NC 1P01AVFQ [0,1,0,0,0,0|1,0,1]=3 685 B10R1.20 N#Cc1nccnc1SC 1P01B28M [0,1,0,0,0,0|0,0,1]=2 686 B10R1.20 NCC1=CC=CC=C1SC 1P01KETL [0,1,0,0,0,0|2,0,0]=3 687 B10R1.20 NCc1ccccc1CC 1P01AKSC [0,1,0,0,0,0|3,0,0]=4 688 B10R1.20 NCc1ncccc1CO 1P01FPDD [0,1,0,0,0,0|3,0,0]=4 689 B10R1.20 NCc1nccnc1CC 1P028WL2 [0,1,0,0,0,0|1,0,0]=2 690 B10R1.20 O=Cc1ccccc1SC 1P003FK4 [0,1,0,0,0,0|2,0,1]=4 691 B10R1.20 O=Cc1nccnc1OC 1P00EDQW [0,1,0,0,0,0|0,1,1]=3 692 B10R1.20 OCc1ccccc1CC 1P003C3Q [0,1,0,0,0,0|3,0,0]=4 693 B10R1.20 OCc1cccnc1C#C 1P00I1UB [0,1,0,0,0,0|2,0,1]=4 694 B10R1.20 OCc1cccnc1C#N 1P001052 [0,1,0,0,0,0|3,0,0]=4 695 B10R1.20 OCc1ncccc1CO 1P00736Q [0,1,0,0,0,0|3,0,0]=4 696 B10R1.20 OCc1ncccc1CO 1P00CI5W [0,1,0,0,0,0|3,0,0]=4 697 B10R1.25 BrCc1ncc(cc1C)Br 1P0289QP [0,1,0,0,0,0|3,0,0]=4 698 B10R1.25 C#Cc1ncc(cc1C)Br 1P027XVD [0,1,0,0,0,0|2,0,1]=4 699 B10R1.25 C#Cc1ncc(cc1C)C 1P01DZJK [0,1,0,0,0,0|2,0,1]=4 700 B10R1.25 C#Cc1ncc(cc1C)Cl 1P01Q6P6 [0,1,0,0,0,0|2,0,1]=4 701 B10R1.25 C#Cc1ncc(cc1C)F 1P009FDZ [0,1,0,0,0,0|2,0,1]=4 702 B10R1.25 C=Cc1ncc(cc1C)C 1P01C587 [0,1,0,0,0,0|2,0,1]=4 703 B10R1.25 CCc1ccc(cc1C)C 1P003LSU [0,1,0,0,0,0|3,0,0]=4 704 B10R1.25 CCc1ccc(cc1C)I 1P01C9IP [0,1,0,0,0,0|3,0,0]=4 705 B10R1.25 CCc1ccc(cc1C)N 1P01A4L1 [0,1,0,0,0,0|3,0,0]=4 706 B10R1.25 CCc1ccc(nc1Cl)N 1P024ZHV [0,1,0,0,0,0|3,0,0]=4 707 B10R1.25 CCc1ccc(nc1N)C 1P003GU7 [0,1,0,0,0,0|3,0,0]=4 708 B10R1.25 CCc1ncc(cc1Br)N 1P01KKPX [0,1,0,0,0,0|3,0,0]=4 709 B10R1.25 CCc1ncc(cc1C)C 1P007TY5 [0,1,0,0,0,0|2,0,0]=3 710 B10R1.25 CCc1ncc(cc1N)Br 1P0099SK [0,1,0,0,0,0|3,0,0]=4 711 B10R1.25 CCc1ncc(cc1N)F 1P01DT9F [0,1,0,0,0,0|3,0,0]=4 712 B10R1.25 CCc1ncc(nc1C)C 1P00HVY7 [0,1,0,0,0,0|1,0,0]=2 713 B10R1.25 CCc1ncc(nc1Cl)Cl 1P000WS7 [0,1,0,0,0,0|2,0,0]=3 714 B10R1.25 CNc1ccc(cc1C)Br 1P00EJOG [0,1,0,0,0,0|3,0,0]=4 715 B10R1.25 CNc1ccc(cc1C)C 1P000UMC [0,1,0,0,0,0|3,0,0]=4 716 B10R1.25 CNc1ccc(cc1C)C 1P0285XH [0,1,0,0,0,0|3,0,0]=4 717 B10R1.25 CNc1ccc(cc1C)O 1P005HQ6 [0,1,0,0,0,0|3,0,0]=4 718 B10R1.25 CNc1ccc(cc1C)O 1P01FMPR [0,1,0,0,0,0|3,0,0]=4 719 B10R1.25 CNc1ccc(nc1Br)Br 1P01MYCF [0,1,0,0,0,0|3,0,0]=4 720 B10R1.25 CNc1ccc(nc1Br)Cl 1P028NH6 [0,1,0,0,0,0|3,0,0]=4 721 B10R1.25 CNc1ccc(nc1Cl)Br 1P0280LR [0,1,0,0,0,0|3,0,0]=4 722 B10R1.25 CNc1ncc(cc1Br)Br 1P01XBGA [0,1,0,0,0,0|3,0,0]=4 723 B10R1.25 CNc1ncc(cc1C)Br 1P002P3D [0,1,0,0,0,0|2,0,0]=3 724 B10R1.25 CNc1ncc(cc1Cl)Cl 1P01A1WP [0,1,0,0,0,0|3,0,0]=4 725 B10R1.25 CNc1ncc(cc1F)F 1P01BHK9 [0,1,0,0,0,0|3,0,0]=4 726 B10R1.25 CNc1ncc(cc1F)F 1P01BHPP [0,1,0,0,0,0|3,0,0]=4 727 B10R1.25 CNc1ncc(cc1N)Br 1P00IG6Y [0,1,0,0,0,0|3,0,0]=4 728 B10R1.25 CNc1ncc(nc1Br)Br 1P00IG7I [0,1,0,0,0,0|2,0,0]=3 729 B10R1.25 CNc1ncc(nc1Cl)Br 1P01JZK6 [0,1,0,0,0,0|2,0,0]=3 730 B10R1.25 COc1ccc(cc1C)Br 1P001FV2 [0,1,0,0,0,0|2,1,0]=4 731 B10R1.25 COc1ccc(cc1C)C 1P003GAZ [0,1,0,0,0,0|2,1,0]=4 732 B10R1.25 COc1ccc(cc1C)Cl 1P003LKG [0,1,0,0,0,0|2,1,0]=4 733 B10R1.25 COc1ccc(cc1C)F 1P0034HQ [0,1,0,0,0,0|2,1,0]=4 734 B10R1.25 COc1ccc(cc1C)I 1P008QBM [0,1,0,0,0,0|2,1,0]=4 735 B10R1.25 COc1ccc(cc1C)N 1P00HUW7 [0,1,0,0,0,0|2,1,0]=4 736 B10R1.25 COc1ccc(cc1C)O 1P006V4M [0,1,0,0,0,0|2,1,0]=4 737 B10R1.25 COc1ccc(nc1Br)Br 1P00GAFJ [0,1,0,0,0,0|2,1,0]=4 738 B10R1.25 COc1ccc(nc1Br)C 1P00BD1B [0,1,0,0,0,0|2,1,0]=4 739 B10R1.25 COc1ccc(nc1Br)Cl 1P000OVO [0,1,0,0,0,0|2,1,0]=4 740 B10R1.25 COc1ccc(nc1Br)F 1P000OVA [0,1,0,0,0,0|2,1,0]=4 741 B10R1.25 COc1ccc(nc1Br)I 1P00C0LP [0,1,0,0,0,0|2,1,0]=4 742 B10R1.25 COc1ccc(nc1Br)N 1P005K1T [0,1,0,0,0,0|2,1,0]=4 743 B10R1.25 COc1ccc(nc1Cl)Br 1P01ANR5 [0,1,0,0,0,0|2,1,0]=4 744 B10R1.25 COc1ccc(nc1Cl)C 1P0029XJ [0,1,0,0,0,0|2,1,0]=4 745 B10R1.25 COc1ccc(nc1Cl)Cl 1P00HGLX [0,1,0,0,0,0|2,1,0]=4 746 B10R1.25 COc1ccc(nc1Cl)I 1P008ZWG [0,1,0,0,0,0|2,1,0]=4 747 B10R1.25 COc1ccc(nc1Cl)N 1P008AW4 [0,1,0,0,0,0|2,1,0]=4 748 B10R1.25 COc1ccc(nc1Cl)N 1P01JVEZ [0,1,0,0,0,0|2,1,0]=4 749 B10R1.25 COc1ccc(nc1F)Br 1P00G6QY [0,1,0,0,0,0|2,1,0]=4 750 B10R1.25 COc1ccc(nc1F)F 1P021Q3G [0,1,0,0,0,0|2,1,0]=4 751 B10R1.25 COc1ccc(nc1F)N 1P020LL4 [0,1,0,0,0,0|2,1,0]=4 752 B10R1.25 COc1ccc(nc1I)Cl 1P00A18I [0,1,0,0,0,0|2,1,0]=4 753 B10R1.25 COc1ccc(nc1I)I 1P00DJEE [0,1,0,0,0,0|2,1,0]=4 754 B10R1.25 COc1ccc(nc1N)Br 1P006EXN [0,1,0,0,0,0|2,1,0]=4 755 B10R1.25 COc1ccc(nc1N)C 1P00DJTZ [0,1,0,0,0,0|2,1,0]=4 756 B10R1.25 COc1ccc(nc1N)F 1P01FSNR [0,1,0,0,0,0|2,1,0]=4 757 B10R1.25 COc1cnc(nc1C)C 1P00132V [0,1,0,0,0,0|2,1,0]=4 758 B10R1.25 COc1cnc(nc1C)Cl 1P000MNL [0,1,0,0,0,0|2,1,0]=4 759 B10R1.25 COc1cnc(nc1C)N 1P0020I6 [0,1,0,0,0,0|2,1,0]=4 760 B10R1.25 COc1ncc(cc1Br)Br 1P007MAN [0,1,0,0,0,0|2,1,0]=4 761 B10R1.25 COc1ncc(cc1Br)C 1P0062V6 [0,1,0,0,0,0|2,1,0]=4 762 B10R1.25 COc1ncc(cc1Br)Cl 1P0086R0 [0,1,0,0,0,0|2,1,0]=4 763 B10R1.25 COc1ncc(cc1Br)F 1P003434 [0,1,0,0,0,0|2,1,0]=4 764 B10R1.25 COc1ncc(cc1Br)I 1P0024AE [0,1,0,0,0,0|2,1,0]=4 765 B10R1.25 COc1ncc(cc1Br)N 1P00D98V [0,1,0,0,0,0|2,1,0]=4 766 B10R1.25 COc1ncc(cc1Br)S 1P0282BW [0,1,0,0,0,0|2,1,0]=4 767 B10R1.25 COc1ncc(cc1C)Br 1P003MY3 [0,1,0,0,0,0|1,1,0]=3 768 B10R1.25 COc1ncc(cc1C)C 1P01AUVZ [0,1,0,0,0,0|1,1,0]=3 769 B10R1.25 COc1ncc(cc1C)F 1P00GV4H [0,1,0,0,0,0|1,1,0]=3 770 B10R1.25 COc1ncc(cc1C)N 1P008FPQ [0,1,0,0,0,0|1,1,0]=3 771 B10R1.25 COc1ncc(cc1C)O 1P0015WC [0,1,0,0,0,0|1,1,0]=3 772 B10R1.25 COc1ncc(cc1Cl)Br 1P004X5S [0,1,0,0,0,0|2,1,0]=4 773 B10R1.25 COc1ncc(cc1Cl)C 1P000JTZ [0,1,0,0,0,0|2,1,0]=4 774 B10R1.25 COc1ncc(cc1Cl)Cl 1P00HU8R [0,1,0,0,0,0|2,1,0]=4 775 B10R1.25 COc1ncc(cc1Cl)I 1P022IOZ [0,1,0,0,0,0|2,1,0]=4 776 B10R1.25 COc1ncc(cc1Cl)N 1P001QM3 [0,1,0,0,0,0|2,1,0]=4 777 B10R1.25 COc1ncc(cc1Cl)S 1P0281SD [0,1,0,0,0,0|2,1,0]=4 778 B10R1.25 COc1ncc(cc1F)Br 1P000MHG [0,1,0,0,0,0|2,1,0]=4 779 B10R1.25 COc1ncc(cc1F)Cl 1P0049J9 [0,1,0,0,0,0|2,1,0]=4 780 B10R1.25 COc1ncc(cc1F)F 1P000ECW [0,1,0,0,0,0|2,1,0]=4 781 B10R1.25 COc1ncc(cc1F)N 1P004AV1 [0,1,0,0,0,0|2,1,0]=4 782 B10R1.25 COc1ncc(cc1F)O 1P00A75S [0,1,0,0,0,0|2,1,0]=4 783 B10R1.25 COc1ncc(cc1I)Br 1P003MZ4 [0,1,0,0,0,0|2,1,0]=4 784 B10R1.25 COc1ncc(cc1N)Br 1P003JCX [0,1,0,0,0,0|2,1,0]=4 785 B10R1.25 COc1ncc(cc1N)C 1P00BB1U [0,1,0,0,0,0|2,1,0]=4 786 B10R1.25 COc1ncc(cc1N)Cl 1P004AV0 [0,1,0,0,0,0|2,1,0]=4 787 B10R1.25 COc1ncc(cc1N)F 1P009X09 [0,1,0,0,0,0|2,1,0]=4 788 B10R1.25 COc1ncc(cc1O)Br 1P009G2P [0,1,0,0,0,0|2,1,0]=4 789 B10R1.25 COc1ncc(cc1O)C 1P009X7H [0,1,0,0,0,0|2,1,0]=4 790 B10R1.25 COc1ncc(cc1O)F 1P009DMB [0,1,0,0,0,0|2,1,0]=4 791 B10R1.25 COc1ncc(cc1S)Br 1P028S8W [0,1,0,0,0,0|2,1,0]=4 792 B10R1.25 COc1ncc(cc1S)Cl 1P027XH4 [0,1,0,0,0,0|2,1,0]=4 793 B10R1.25 COc1ncc(nc1Br)Br 1P008WCU [0,1,0,0,0,0|1,1,0]=3 794 B10R1.25 COc1ncc(nc1C)C 1P006I0F [0,1,0,0,0,0|0,1,0]=2 795 B10R1.25 COc1ncc(nc1Cl)Cl 1P00HX8W [0,1,0,0,0,0|1,1,0]=3 796 B10R1.25 COc1ncc(nc1N)Cl 1P0038L3 [0,1,0,0,0,0|1,1,0]=3 797 B10R1.25 CSc1ccc(cc1Br)F 1P003H52 [0,1,0,0,0,0|3,0,0]=4 798 B10R1.25 CSc1ccc(cc1Br)N 1P002KH8 [0,1,0,0,0,0|3,0,0]=4 799 B10R1.25 CSc1ccc(cc1C)O 1P003K6G [0,1,0,0,0,0|2,0,0]=3 800 B10R1.25 CSc1ccc(cc1Cl)Br 1P000474 [0,1,0,0,0,0|3,0,0]=4 801 B10R1.25 CSc1ccc(cc1Cl)N 1P00DG7H [0,1,0,0,0,0|3,0,0]=4 802 B10R1.25 CSc1ccc(cc1F)Br 1P003LDL [0,1,0,0,0,0|3,0,0]=4 803 B10R1.25 CSc1ccc(cc1F)N 1P002KH7 [0,1,0,0,0,0|3,0,0]=4 804 B10R1.25 CSc1ccc(cc1N)Br 1P01DZ6V [0,1,0,0,0,0|3,0,0]=4 805 B10R1.25 CSc1ccc(cc1N)C 1P028DW5 [0,1,0,0,0,0|3,0,0]=4 806 B10R1.25 CSc1ccc(cc1N)Cl 1P001V73 [0,1,0,0,0,0|3,0,0]=4 807 B10R1.25 CSc1ccc(cc1N)Cl 1P00HG9X [0,1,0,0,0,0|3,0,0]=4 808 B10R1.25 CSc1ccc(cc1N)F 1P028ZBW [0,1,0,0,0,0|3,0,0]=4 809 B10R1.25 CSc1cnc(nc1Cl)Cl 1P0033FQ [0,1,0,0,0,0|3,0,0]=4 810 B10R1.25 CSc1ncc(nc1C)C 1P003BF8 [0,1,0,0,0,0|0,0,0]=1 811 B10R1.25 CSc1ncc(nc1Cl)Cl 1P00HYGV [0,1,0,0,0,0|1,0,0]=2 812 B10R1.25 Cc1cc(Cl)nnc1OC 1P00IG78 [0,1,0,0,0,0|2,1,0]=4 813 B10R1.25 Cc1cnc(c(n1)Cl)C#N 1P002391 [0,1,0,0,0,0|3,0,0]=4 814 B10R1.25 Cc1cnc(c(n1)N)C#N 1P00ENMZ [0,1,0,0,0,0|3,0,0]=4 815 B10R1.25 Cc1nc(=O)ccn1CC 1P028S3A [0,1,0,0,0,0|3,0,0]=4 816 B10R1.25 Cc1nc(Br)ccc1C#N 1P00029C [0,1,0,0,0,0|3,0,0]=4 817 B10R1.25 Cc1nc(Br)ccc1C=O 1P006G7P [0,1,0,0,0,0|3,0,0]=4 818 B10R1.25 Cc1nc(Br)ccc1CCl 1P0095OQ [0,1,0,0,0,0|3,0,0]=4 819 B10R1.25 Cc1nc(Br)ccc1OC 1P004Y4C [0,1,0,0,0,0|1,1,0]=3 820 B10R1.25 Cc1nc(C)ccc1C=O 1P00EAFE [0,1,0,0,0,0|3,0,0]=4 821 B10R1.25 Cc1nc(C)ccc1CCl 1P01ADI3 [0,1,0,0,0,0|3,0,0]=4 822 B10R1.25 Cc1nc(C)ccc1CO 1P00EKF5 [0,1,0,0,0,0|3,0,0]=4 823 B10R1.25 Cc1nc(C)cnc1C=O 1P028JD8 [0,1,0,0,0,0|2,0,0]=3 824 B10R1.25 Cc1nc(C)cnc1CCl 1P006JQR [0,1,0,0,0,0|2,0,0]=3 825 B10R1.25 Cc1nc(Cl)ccc1C#N 1P00FEZV [0,1,0,0,0,0|3,0,0]=4 826 B10R1.25 Cc1nc(Cl)ccc1C=O 1P004F2R [0,1,0,0,0,0|3,0,0]=4 827 B10R1.25 Cc1nc(Cl)ccc1CO 1P0097FR [0,1,0,0,0,0|3,0,0]=4 828 B10R1.25 Cc1nc(Cl)ccc1OC 1P000U2H [0,1,0,0,0,0|1,1,0]=3 829 B10R1.25 Cc1nc(Cl)cnc1C#N 1P009FI3 [0,1,0,0,0,0|2,0,0]=3 830 B10R1.25 Cc1nc(F)ccc1C#C 1P01DZKC [0,1,0,0,0,0|2,0,1]=4 831 B10R1.25 Cc1nc(F)ccc1C#N 1P003NO3 [0,1,0,0,0,0|3,0,0]=4 832 B10R1.25 Cc1nc(F)ccc1C=O 1P004K07 [0,1,0,0,0,0|3,0,0]=4 833 B10R1.25 Cc1nc(F)ccc1CBr 1P0290NP [0,1,0,0,0,0|3,0,0]=4 834 B10R1.25 Cc1nc(F)ccc1CN 1P028RDG [0,1,0,0,0,0|3,0,0]=4 835 B10R1.25 Cc1nc(F)ccc1CO 1P00GV6T [0,1,0,0,0,0|3,0,0]=4 836 B10R1.25 Cc1nc(N)ccc1C#N 1P00280L [0,1,0,0,0,0|3,0,0]=4 837 B10R1.25 Cc1nc(N)ccc1C=C 1P0223GE [0,1,0,0,0,0|2,0,1]=4 838 B10R1.25 Cc1nc(N)cnc1C#N 1P009FS5 [0,1,0,0,0,0|2,0,0]=3 839 B10R1.25 Cc1nc(O)ccc1C#N 1P00CBK0 [0,1,0,0,0,0|3,0,0]=4 840 B10R1.25 Cc1nc(O)ccc1OC 1P00CMLN [0,1,0,0,0,0|1,1,0]=3 841 B10R1.25 ClCc1ccc(nc1C)Cl 1P00959I [0,1,0,0,0,0|3,0,0]=4 842 B10R1.25 ClCc1ccc(nc1C)Cl 1P01A3CN [0,1,0,0,0,0|3,0,0]=4 843 B10R1.25 ClCc1ncc(cc1C)C 1P0036GD [0,1,0,0,0,0|3,0,0]=4 844 B10R1.25 Clc1nc(Cl)cnc1C#N 1P003J2S [0,1,0,0,0,0|3,0,0]=4 845 B10R1.25 Clc1nc(Cl)cnc1C=O 1P0012YY [0,1,0,0,0,0|3,0,0]=4 846 B10R1.25 Clc1nc(Cl)cnc1CBr 1P01AG86 [0,1,0,0,0,0|3,0,0]=4 847 B10R1.25 N#Cc1ncc(cc1C)Br 1P001OY9 [0,1,0,0,0,0|3,0,0]=4 848 B10R1.25 N#Cc1ncc(cc1C)C 1P003J5Z [0,1,0,0,0,0|3,0,0]=4 849 B10R1.25 N#Cc1ncc(cc1C)Cl 1P001OYA [0,1,0,0,0,0|3,0,0]=4 850 B10R1.25 N#Cc1ncc(cc1C)N 1P002RDH [0,1,0,0,0,0|3,0,0]=4 851 B10R1.25 N#Cc1ncc(cc1C)O 1P002LTJ [0,1,0,0,0,0|3,0,0]=4 852 B10R1.25 NCc1ccc(nc1C)N 1P00BGO3 [0,1,0,0,0,0|3,0,0]=4 853 B10R1.25 NCc1ncc(cc1C)Br 1P000P2Q [0,1,0,0,0,0|3,0,0]=4 854 B10R1.25 NCc1ncc(cc1C)Br 1P00IFQN [0,1,0,0,0,0|3,0,0]=4 855 B10R1.25 NCc1ncc(cc1C)C 1P000P3S [0,1,0,0,0,0|3,0,0]=4 856 B10R1.25 NCc1ncc(cc1C)C 1P01BK0U [0,1,0,0,0,0|3,0,0]=4 857 B10R1.25 NCc1ncc(cc1C)Cl 1P009DU9 [0,1,0,0,0,0|3,0,0]=4 858 B10R1.25 NCc1ncc(nc1Cl)Cl 1P01FMCA [0,1,0,0,0,0|3,0,0]=4 859 B10R1.25 NNc1ncc(cc1C)Br 1P009XK2 [0,1,0,0,0,0|3,0,0]=4 860 B10R1.25 NNc1ncc(nc1Cl)Br 1P00GNES [0,1,0,0,0,0|3,0,0]=4 861 B10R1.25 Nc1cnc(c(n1)Cl)C#C 1P027XG2 [0,1,0,0,0,0|2,0,1]=4 862 B10R1.25 Nc1cnc(c(n1)Cl)C#N 1P00CMTW [0,1,0,0,0,0|3,0,0]=4 863 B10R1.25 Nc1nc(Cl)cnc1C#N 1P00D8VN [0,1,0,0,0,0|3,0,0]=4 864 B10R1.25 Nc1nc(Cl)cnc1C=O 1P00414P [0,1,0,0,0,0|3,0,0]=4 865 B10R1.25 O=Cc1ncc(cc1C)Br 1P00C05K [0,1,0,0,0,0|3,0,0]=4 866 B10R1.25 O=Cc1ncc(cc1C)C 1P00FEVE [0,1,0,0,0,0|3,0,0]=4 867 B10R1.25 O=Cc1ncc(cc1C)F 1P00GAS8 [0,1,0,0,0,0|3,0,0]=4 868 B10R1.25 OCc1ncc(cc1C)Br 1P002P3C [0,1,0,0,0,0|3,0,0]=4 869 B10R1.25 OCc1ncc(cc1C)C 1P00290Y [0,1,0,0,0,0|3,0,0]=4 870 B10R1.25 OCc1ncc(cc1C)F 1P00A0FY [0,1,0,0,0,0|3,0,0]=4 871 B10R1.30 C#Cc1cc(N)cnc1C 1P01Q6PN [0,1,0,0,0,0|2,0,1]=4 872 B10R1.30 C#Cc1cc(N)cnc1C 1P028IAW [0,1,0,0,0,0|2,0,1]=4 873 B10R1.30 C#Cc1nc(Br)cnc1N 1P008ZIC [0,1,0,0,0,0|2,0,1]=4 874 B10R1.30 CCc1cc(Br)ccc1C 1P01C8LC [0,1,0,0,0,0|3,0,0]=4 875 B10R1.30 CCc1cc(Br)cnc1N 1P01FEQX [0,1,0,0,0,0|3,0,0]=4 876 B10R1.30 CCc1cc(Cl)cnc1N 1P01BY8D [0,1,0,0,0,0|3,0,0]=4 877 B10R1.30 CCc1cc(I)ccc1C 1P028BTT [0,1,0,0,0,0|3,0,0]=4 878 B10R1.30 CCc1cc(N)ccc1C 1P007Y1R [0,1,0,0,0,0|3,0,0]=4 879 B10R1.30 CCc1cc(N)cnc1C 1P028SZB [0,1,0,0,0,0|2,0,0]=3 880 B10R1.30 CCc1nc(Br)ccc1Br 1P024VRH [0,1,0,0,0,0|3,0,0]=4 881 B10R1.30 CCc1nc(C)ccc1N 1P020M3R [0,1,0,0,0,0|3,0,0]=4 882 B10R1.30 CCc1nc(C)ccc1O 1P000XJS [0,1,0,0,0,0|3,0,0]=4 883 B10R1.30 CCc1nc(C)ccc1O 1P0011CF [0,1,0,0,0,0|3,0,0]=4 884 B10R1.30 CCc1nc(C)ccc1O 1P002OGM [0,1,0,0,0,0|3,0,0]=4 885 B10R1.30 CCc1nc(C)cnc1C 1P003A0D [0,1,0,0,0,0|1,0,0]=2 886 B10R1.30 CCc1nc(C)cnc1C 1P019DEZ [0,1,0,0,0,0|1,0,0]=2 887 B10R1.30 CCc1nc(Cl)ccc1C 1P00J32K [0,1,0,0,0,0|2,0,0]=3 888 B10R1.30 CCc1nc(Cl)ccc1Cl 1P01FJ5C [0,1,0,0,0,0|3,0,0]=4 889 B10R1.30 CCc1nc(Cl)ccc1N 1P00IGX9 [0,1,0,0,0,0|3,0,0]=4 890 B10R1.30 CCc1nc(Cl)ncc1C 1P00J2QD [0,1,0,0,0,0|3,0,0]=4 891 B10R1.30 CCc1nc(N)ccc1Br 1P004RA7 [0,1,0,0,0,0|3,0,0]=4 892 B10R1.30 CCc1nc(N)ncc1C 1P00C8ZH [0,1,0,0,0,0|3,0,0]=4 893 B10R1.30 CCc1nc(O)ncc1C 1P009EDY [0,1,0,0,0,0|3,0,0]=4 894 B10R1.30 CNc1cc(Br)cnc1Br 1P027OIK [0,1,0,0,0,0|3,0,0]=4 895 B10R1.30 CNc1cc(Br)cnc1N 1P001WX5 [0,1,0,0,0,0|3,0,0]=4 896 B10R1.30 CNc1cc(C)ccc1C 1P019WOA [0,1,0,0,0,0|3,0,0]=4 897 B10R1.30 CNc1cc(C)ccc1C 1P01A7UM [0,1,0,0,0,0|3,0,0]=4 898 B10R1.30 CNc1cc(Cl)ccc1C 1P01AD5P [0,1,0,0,0,0|3,0,0]=4 899 B10R1.30 CNc1cc(F)ccc1C 1P00IFGP [0,1,0,0,0,0|3,0,0]=4 900 B10R1.30 CNc1cc(O)ccc1C 1P00ELKY [0,1,0,0,0,0|3,0,0]=4 901 B10R1.30 CNc1nc(Br)cnc1N 1P003GWY [0,1,0,0,0,0|2,0,0]=3 902 B10R1.30 CNc1nc(C)cnc1C 1P027YCH [0,1,0,0,0,0|1,0,0]=2 903 B10R1.30 CNc1nc(Cl)ccc1Br 1P00I1Y2 [0,1,0,0,0,0|3,0,0]=4 904 B10R1.30 CNc1nc(Cl)ccc1N 1P0045DS [0,1,0,0,0,0|3,0,0]=4 905 B10R1.30 COc1cc(Br)ccc1C 1P003LDS [0,1,0,0,0,0|2,1,0]=4 906 B10R1.30 COc1cc(Br)cnc1C 1P000G9Z [0,1,0,0,0,0|1,1,0]=3 907 B10R1.30 COc1cc(Br)cnc1Cl 1P002WL0 [0,1,0,0,0,0|2,1,0]=4 908 B10R1.30 COc1cc(Br)cnc1F 1P003A7E [0,1,0,0,0,0|2,1,0]=4 909 B10R1.30 COc1cc(Br)cnc1I 1P00IIOB [0,1,0,0,0,0|2,1,0]=4 910 B10R1.30 COc1cc(Br)cnc1N 1P003GX1 [0,1,0,0,0,0|2,1,0]=4 911 B10R1.30 COc1cc(Br)cnc1N 1P028O1T [0,1,0,0,0,0|2,1,0]=4 912 B10R1.30 COc1cc(C)ccc1C 1P003BM5 [0,1,0,0,0,0|2,1,0]=4 913 B10R1.30 COc1cc(C)cnc1Cl 1P0094NJ [0,1,0,0,0,0|2,1,0]=4 914 B10R1.30 COc1cc(Cl)ccc1C 1P0075OZ [0,1,0,0,0,0|2,1,0]=4 915 B10R1.30 COc1cc(Cl)cnc1F 1P01DO3U [0,1,0,0,0,0|2,1,0]=4 916 B10R1.30 COc1cc(Cl)cnc1I 1P01ELKC [0,1,0,0,0,0|2,1,0]=4 917 B10R1.30 COc1cc(F)ccc1C 1P003N7Q [0,1,0,0,0,0|2,1,0]=4 918 B10R1.30 COc1cc(F)cnc1Br 1P009ARZ [0,1,0,0,0,0|2,1,0]=4 919 B10R1.30 COc1cc(F)cnc1Cl 1P00HC1Q [0,1,0,0,0,0|2,1,0]=4 920 B10R1.30 COc1cc(F)cnc1N 1P00HC1R [0,1,0,0,0,0|2,1,0]=4 921 B10R1.30 COc1cc(I)ccc1C 1P00BGQZ [0,1,0,0,0,0|2,1,0]=4 922 B10R1.30 COc1cc(N)ccc1C 1P007VW3 [0,1,0,0,0,0|2,1,0]=4 923 B10R1.30 COc1cc(N)cnc1Br 1P0006UL [0,1,0,0,0,0|2,1,0]=4 924 B10R1.30 COc1cc(N)cnc1Cl 1P005VO9 [0,1,0,0,0,0|2,1,0]=4 925 B10R1.30 COc1cc(O)ccc1C 1P002G67 [0,1,0,0,0,0|2,1,0]=4 926 B10R1.30 COc1cc(O)cnc1C 1P028B40 [0,1,0,0,0,0|1,1,0]=3 927 B10R1.30 COc1cc(O)cnc1Cl 1P00HC7M [0,1,0,0,0,0|2,1,0]=4 928 B10R1.30 COc1nc(Br)c[nH]c1=O 1P00H3C6 [0,1,0,0,0,0|1,1,1]=4 929 B10R1.30 COc1nc(Br)ccc1Cl 1P009JYE [0,1,0,0,0,0|2,1,0]=4 930 B10R1.30 COc1nc(Br)ccc1N 1P0034SS [0,1,0,0,0,0|2,1,0]=4 931 B10R1.30 COc1nc(Br)ccc1O 1P00I1PG [0,1,0,0,0,0|2,1,0]=4 932 B10R1.30 COc1nc(Br)cnc1Br 1P00DH5N [0,1,0,0,0,0|1,1,0]=3 933 B10R1.30 COc1nc(Br)cnc1Cl 1P00414Q [0,1,0,0,0,0|1,1,0]=3 934 B10R1.30 COc1nc(Br)cnc1I 1P00707P [0,1,0,0,0,0|1,1,0]=3 935 B10R1.30 COc1nc(Br)cnc1N 1P0034OO [0,1,0,0,0,0|1,1,0]=3 936 B10R1.30 COc1nc(C)ccc1Br 1P003JHC [0,1,0,0,0,0|2,1,0]=4 937 B10R1.30 COc1nc(C)ccc1F 1P0079YX [0,1,0,0,0,0|2,1,0]=4 938 B10R1.30 COc1nc(C)ccc1N 1P00I29Q [0,1,0,0,0,0|2,1,0]=4 939 B10R1.30 COc1nc(C)ccc1O 1P00CHN8 [0,1,0,0,0,0|2,1,0]=4 940 B10R1.30 COc1nc(C)cnc1C 1P002C04 [0,1,0,0,0,0|0,1,0]=2 941 B10R1.30 COc1nc(C)cnc1Cl 1P01JZWT [0,1,0,0,0,0|1,1,0]=3 942 B10R1.30 COc1nc(C)cnc1N 1P0088KP [0,1,0,0,0,0|1,1,0]=3 943 B10R1.30 COc1nc(Cl)c[nH]c1=O 1P028U7O [0,1,0,0,0,0|1,1,1]=4 944 B10R1.30 COc1nc(Cl)ccc1Br 1P00814K [0,1,0,0,0,0|2,1,0]=4 945 B10R1.30 COc1nc(Cl)ccc1Cl 1P0015FR [0,1,0,0,0,0|2,1,0]=4 946 B10R1.30 COc1nc(Cl)ccc1F 1P000S8N [0,1,0,0,0,0|2,1,0]=4 947 B10R1.30 COc1nc(Cl)ccc1I 1P000SG5 [0,1,0,0,0,0|2,1,0]=4 948 B10R1.30 COc1nc(Cl)ccc1N 1P006BHU [0,1,0,0,0,0|2,1,0]=4 949 B10R1.30 COc1nc(Cl)cnc1Br 1P01FRIZ [0,1,0,0,0,0|1,1,0]=3 950 B10R1.30 COc1nc(Cl)cnc1N 1P00H39X [0,1,0,0,0,0|1,1,0]=3 951 B10R1.30 COc1nc(Cl)ncc1C 1P00A94Q [0,1,0,0,0,0|2,1,0]=4 952 B10R1.30 COc1nc(Cl)nnc1Cl 1P01A6VE [0,1,0,0,0,0|2,1,0]=4 953 B10R1.30 COc1nc(F)ccc1Br 1P009YQD [0,1,0,0,0,0|2,1,0]=4 954 B10R1.30 COc1nc(N)ccc1Br 1P009C9S [0,1,0,0,0,0|2,1,0]=4 955 B10R1.30 COc1nc(N)ccc1Cl 1P005DTZ [0,1,0,0,0,0|2,1,0]=4 956 B10R1.30 COc1nc(N)cnc1Br 1P01FT1Z [0,1,0,0,0,0|1,1,0]=3 957 B10R1.30 COc1nc(O)ccc1N 1P01DXRD [0,1,0,0,0,0|2,1,0]=4 958 B10R1.30 CSc1cc(Br)ccc1Br 1P01DO1K [0,1,0,0,0,0|3,0,0]=4 959 B10R1.30 CSc1cc(Br)ccc1Cl 1P01R07I [0,1,0,0,0,0|3,0,0]=4 960 B10R1.30 CSc1cc(Br)ccc1F 1P01C0GR [0,1,0,0,0,0|3,0,0]=4 961 B10R1.30 CSc1cc(Br)ccc1N 1P00IMCM [0,1,0,0,0,0|3,0,0]=4 962 B10R1.30 CSc1cc(Br)ccc1O 1P0291UR [0,1,0,0,0,0|3,0,0]=4 963 B10R1.30 CSc1cc(C)cnc1Br 1P00I153 [0,1,0,0,0,0|2,0,0]=3 964 B10R1.30 CSc1cc(Cl)ccc1C 1P01EY18 [0,1,0,0,0,0|2,0,0]=3 965 B10R1.30 CSc1cc(Cl)ccc1N 1P01C68L [0,1,0,0,0,0|3,0,0]=4 966 B10R1.30 CSc1cc(Cl)cnc1Cl 1P00A0J8 [0,1,0,0,0,0|2,0,0]=3 967 B10R1.30 CSc1cc(Cl)nnc1N 1P01WTMT [0,1,0,0,0,0|3,0,0]=4 968 B10R1.30 CSc1cc(F)ccc1N 1P01C5L8 [0,1,0,0,0,0|3,0,0]=4 969 B10R1.30 CSc1cc(F)ccc1O 1P01JFRT [0,1,0,0,0,0|3,0,0]=4 970 B10R1.30 CSc1cc(N)ccc1C 1P01C60C [0,1,0,0,0,0|2,0,0]=3 971 B10R1.30 CSc1cc(N)ccc1Cl 1P01C39D [0,1,0,0,0,0|3,0,0]=4 972 B10R1.30 CSc1cc(O)ccc1Br 1P02934E [0,1,0,0,0,0|3,0,0]=4 973 B10R1.30 CSc1cc(O)ccc1N 1P00VW1C [0,1,0,0,0,0|3,0,0]=4 974 B10R1.30 CSc1nc(Cl)ncc1Br 1P00EDQM [0,1,0,0,0,0|3,0,0]=4 975 B10R1.30 CSc1nc(Cl)ncc1C 1P00IX8W [0,1,0,0,0,0|2,0,0]=3 976 B10R1.30 CSc1nc(Cl)ncc1Cl 1P028XRH [0,1,0,0,0,0|3,0,0]=4 977 B10R1.30 CSc1nc(Cl)ncc1F 1P00IF8A [0,1,0,0,0,0|3,0,0]=4 978 B10R1.30 CSc1nc(N)ncc1Br 1P01C0XC [0,1,0,0,0,0|3,0,0]=4 979 B10R1.30 ClCc1nc(C)ccc1C 1P028W29 [0,1,0,0,0,0|3,0,0]=4 980 B10R1.30 N#Cc1cc(Br)cnc1C 1P00H97J [0,1,0,0,0,0|3,0,0]=4 981 B10R1.30 N#Cc1cc(Cl)cnc1C 1P000OVS [0,1,0,0,0,0|3,0,0]=4 982 B10R1.30 N#Cc1cc(I)cnc1C 1P01K23O [0,1,0,0,0,0|3,0,0]=4 983 B10R1.30 N#Cc1cc(N)cnc1C 1P01C1KK [0,1,0,0,0,0|3,0,0]=4 984 B10R1.30 N#Cc1nc(Br)ccc1C 1P0014LL [0,1,0,0,0,0|3,0,0]=4 985 B10R1.30 N#Cc1nc(Br)cnc1Br 1P008060 [0,1,0,0,0,0|3,0,0]=4 986 B10R1.30 N#Cc1nc(Br)cnc1Cl 1P000OZF [0,1,0,0,0,0|3,0,0]=4 987 B10R1.30 N#Cc1nc(Br)cnc1N 1P003JDK [0,1,0,0,0,0|3,0,0]=4 988 B10R1.30 N#Cc1nc(C)cnc1Cl 1P0012LJ [0,1,0,0,0,0|3,0,0]=4 989 B10R1.30 N#Cc1nc(C)cnc1N 1P0026XE [0,1,0,0,0,0|3,0,0]=4 990 B10R1.30 N#Cc1nc(Cl)ccc1C 1P000R0D [0,1,0,0,0,0|3,0,0]=4 991 B10R1.30 N#Cc1nc(Cl)cnc1Cl 1P00C6TW [0,1,0,0,0,0|3,0,0]=4 992 B10R1.30 N#Cc1nc(Cl)cnc1N 1P007WKA [0,1,0,0,0,0|3,0,0]=4 993 B10R1.30 N#Cc1nc(F)cnc1F 1P00CJAW [0,1,0,0,0,0|3,0,0]=4 994 B10R1.30 N#Cc1nc(F)cnc1O 1P00C6TX [0,1,0,0,0,0|3,0,0]=4 995 B10R1.30 N#Cc1nc(N)ccc1C 1P021OL4 [0,1,0,0,0,0|3,0,0]=4 996 B10R1.30 NCc1cc(Br)cnc1C 1P00HGG8 [0,1,0,0,0,0|3,0,0]=4 997 B10R1.30 NCc1cc(F)cnc1C 1P028BFU [0,1,0,0,0,0|3,0,0]=4 998 B10R1.30 NCc1nc(Br)ccc1C 1P0208A7 [0,1,0,0,0,0|3,0,0]=4 999 B10R1.30 NCc1nc(C)ccc1C 1P01BKZU [0,1,0,0,0,0|3,0,0]=4 1000 B10R1.30 O=Cc1cc(Cl)cnc1C 1P007WDD [0,1,0,0,0,0|3,0,0]=4 1001 B10R1.30 O=Cc1nc(Br)ccc1C 1P021VWE [0,1,0,0,0,0|3,0,0]=4 1002 B10R1.30 O=Cc1nc(Br)cnc1Br 1P000X3D [0,1,0,0,0,0|3,0,0]=4 1003 B10R1.30 O=Cc1nc(Br)cnc1N 1P000PTB [0,1,0,0,0,0|3,0,0]=4 1004 B10R1.30 O=Cc1nc(Cl)cnc1Cl 1P009WZZ [0,1,0,0,0,0|3,0,0]=4 1005 B10R1.30 O=Cc1nc(Cl)cnc1N 1P00IG30 [0,1,0,0,0,0|3,0,0]=4 1006 B10R1.30 OCc1cc(Br)cnc1C 1P00ILCT [0,1,0,0,0,0|3,0,0]=4 1007 B10R1.30 OCc1cc(F)cnc1C 1P01BVKV [0,1,0,0,0,0|3,0,0]=4 1008 B10R1.30 OCc1nc(Br)cnc1N 1P000RYW [0,1,0,0,0,0|3,0,0]=4 1009 B10R1.30 OCc1nc(C)ccc1C 1P004WQH [0,1,0,0,0,0|3,0,0]=4 1010 B10R1.61 CC(=O)c1ccccc1C 1P003I51 [0,1,0,0,0,0|3,0,0]=4 1011 B10R1.61 CC(=O)c1cccnc1Br 1P004PFL [0,1,0,0,0,0|3,0,0]=4 1012 B10R1.61 CC(=O)c1cccnc1C 1P00APS4 [0,1,0,0,0,0|2,0,0]=3 1013 B10R1.61 CC(=O)c1cccnc1Cl 1P003413 [0,1,0,0,0,0|3,0,0]=4 1014 B10R1.61 CC(=O)c1cccnc1F 1P0058LW [0,1,0,0,0,0|3,0,0]=4 1015 B10R1.61 CC(=O)c1cccnc1N 1P003DA0 [0,1,0,0,0,0|3,0,0]=4 1016 B10R1.61 CC(=O)c1cncnc1C 1P01AGIT [0,1,0,0,0,0|3,0,0]=4 1017 B10R1.61 CC(=O)c1ncccc1Br 1P0083FB [0,1,0,0,0,0|3,0,0]=4 1018 B10R1.61 CC(=O)c1ncccc1C 1P003GRM [0,1,0,0,0,0|2,0,0]=3 1019 B10R1.61 CC(=O)c1ncccc1Cl 1P0073R0 [0,1,0,0,0,0|3,0,0]=4 1020 B10R1.61 CC(=O)c1ncccc1F 1P0036MY [0,1,0,0,0,0|3,0,0]=4 1021 B10R1.61 CC(=O)c1ncccc1N 1P0010P6 [0,1,0,0,0,0|3,0,0]=4 1022 B10R1.61 CC(=O)c1ncccc1O 1P0010P5 [0,1,0,0,0,0|3,0,0]=4 1023 B10R1.61 CC(=O)c1nccnc1C 1P0033J9 [0,1,0,0,0,0|1,0,0]=2 1024 B10R1.61 CC(=O)c1nccnc1Cl 1P009X3P [0,1,0,0,0,0|2,0,0]=3 1025 B10R1.61 CC(c1ccccc1C)Br 1P01A1EI [0,1,0,0,0,0|3,0,0]=4 1026 B10R1.61 CC(c1ccccc1C)N 1P003DBW [0,1,0,0,0,0|3,0,0]=4 1027 B10R1.61 CC(c1ccccc1C)N 1P003DBX [0,1,0,0,0,0|3,0,0]=4 1028 B10R1.61 CC(c1ccccc1C)O 1P003DBY [0,1,0,0,0,0|3,0,0]=4 1029 B10R1.61 CC(c1cccnc1Br)Br 1P01BQIP [0,1,0,0,0,0|3,0,0]=4 1030 B10R1.61 CC(c1cccnc1Br)C 1P01FPCO [0,1,0,0,0,0|3,0,0]=4 1031 B10R1.61 CC(c1cccnc1C)N 1P00H2TM [0,1,0,0,0,0|2,0,0]=3 1032 B10R1.61 CC(c1cccnc1C)N 1P028K8Y [0,1,0,0,0,0|2,0,0]=3 1033 B10R1.61 CC(c1cccnc1C)O 1P01B7I5 [0,1,0,0,0,0|2,0,0]=3 1034 B10R1.61 CC(c1cccnc1Cl)O 1P00100N [0,1,0,0,0,0|3,0,0]=4 1035 B10R1.61 CC(c1cccnc1F)N 1P01UNGB [0,1,0,0,0,0|3,0,0]=4 1036 B10R1.61 CC(c1cccnc1F)O 1P00GB0N [0,1,0,0,0,0|3,0,0]=4 1037 B10R1.61 CC(c1cccnc1N)C 1P00ILHF [0,1,0,0,0,0|3,0,0]=4 1038 B10R1.61 CC(c1cccnc1N)N 1P0174Q9 [0,1,0,0,0,0|3,0,0]=4 1039 B10R1.61 CC(c1cccnc1N)N 1P027TVU [0,1,0,0,0,0|3,0,0]=4 1040 B10R1.61 CC(c1cncnc1C)O 1P01AGJV [0,1,0,0,0,0|3,0,0]=4 1041 B10R1.61 CC(c1ncc[nH]c1=O)C 1P00BVBN [0,1,0,0,0,0|2,0,1]=4 1042 B10R1.61 CC(c1ncccc1Br)C 1P01K17I [0,1,0,0,0,0|3,0,0]=4 1043 B10R1.61 CC(c1ncccc1Br)N 1P01JV6R [0,1,0,0,0,0|3,0,0]=4 1044 B10R1.61 CC(c1ncccc1C)N 1P008O6T [0,1,0,0,0,0|2,0,0]=3 1045 B10R1.61 CC(c1ncccc1C)N 1P01DE8D [0,1,0,0,0,0|2,0,0]=3 1046 B10R1.61 CC(c1ncccc1C)O 1P00IDDS [0,1,0,0,0,0|2,0,0]=3 1047 B10R1.61 CC(c1ncccc1Cl)N 1P028JLT [0,1,0,0,0,0|3,0,0]=4 1048 B10R1.61 CC(c1ncccc1F)N 1P009YRQ [0,1,0,0,0,0|3,0,0]=4 1049 B10R1.61 CC(c1ncccc1F)N 1P01C2U2 [0,1,0,0,0,0|3,0,0]=4 1050 B10R1.61 CC(c1ncccc1F)O 1P003DDM [0,1,0,0,0,0|3,0,0]=4 1051 B10R1.61 CC(c1ncccc1N)C 1P01BICZ [0,1,0,0,0,0|3,0,0]=4 1052 B10R1.61 CC(c1ncccc1O)C 1P002HLD [0,1,0,0,0,0|3,0,0]=4 1053 B10R1.61 CC(c1nccnc1C)Br 1P01FIOE [0,1,0,0,0,0|1,0,0]=2 1054 B10R1.61 CC(c1nccnc1C)N 1P01BSMC [0,1,0,0,0,0|1,0,0]=2 1055 B10R1.61 CC(c1nccnc1Cl)C 1P00EK8L [0,1,0,0,0,0|2,0,0]=3 1056 B10R1.61 CC(c1nccnc1Cl)N 1P02235G [0,1,0,0,0,0|2,0,0]=3 1057 B10R1.61 CC(c1nccnc1Cl)O 1P01XFKE [0,1,0,0,0,0|2,0,0]=3 1058 B10R1.61 CC(c1nccnc1N)C 1P01BIHV [0,1,0,0,0,0|2,0,0]=3 1059 B10R1.61 CN(c1ccccc1C)C 1P0035RI [0,1,0,0,0,0|3,0,0]=4 1060 B10R1.61 CN(c1cccnc1N)C 1P01A7DQ [0,1,0,0,0,0|3,0,0]=4 1061 B10R1.61 CN(c1ncccc1Br)C 1P00960E [0,1,0,0,0,0|3,0,0]=4 1062 B10R1.61 CN(c1ncccc1N)C 1P00J2OT [0,1,0,0,0,0|3,0,0]=4 1063 B10R1.61 CN(c1ncccc1N)C 1P00J3KS [0,1,0,0,0,0|3,0,0]=4 1064 B10R1.61 CN(c1ncccc1O)C 1P00CH10 [0,1,0,0,0,0|3,0,0]=4 1065 B10R1.61 CN(c1ncccc1S)C 1P028008 [0,1,0,0,0,0|3,0,0]=4 1066 B10R1.61 CN(c1nccnc1Cl)C 1P00DK0C [0,1,0,0,0,0|2,0,0]=3 1067 B10R1.61 CN(c1nccnc1N)C 1P00428Z [0,1,0,0,0,0|2,0,0]=3 1068 B10R1.61 C[C@@H](c1ccccc1C)N 1P0014ZZ [0,1,0,0,0,0|3,0,0]=4 1069 B10R1.61 C[C@@H](c1ccccc1C)N 1P00G60I [0,1,0,0,0,0|3,0,0]=4 1070 B10R1.61 C[C@@H](c1ccccc1C)O 1P00DA1B [0,1,0,0,0,0|3,0,0]=4 1071 B10R1.61 C[C@@H](c1cccnc1C)N 1P028OLA [0,1,0,0,0,0|2,0,0]=3 1072 B10R1.61 C[C@@H](c1cccnc1F)N 1P028EX4 [0,1,0,0,0,0|3,0,0]=4 1073 B10R1.61 C[C@@H](c1cccnc1F)O 1P0288J7 [0,1,0,0,0,0|3,0,0]=4 1074 B10R1.61 C[C@@H](c1cncnc1C)O 1P01BHDH [0,1,0,0,0,0|3,0,0]=4 1075 B10R1.61 C[C@@H](c1ncccc1Br)O 1P01C38K [0,1,0,0,0,0|3,0,0]=4 1076 B10R1.61 C[C@@H](c1ncccc1Br)O 1P01XBYD [0,1,0,0,0,0|3,0,0]=4 1077 B10R1.61 C[C@@H](c1ncccc1Cl)N 1P01R1ZY [0,1,0,0,0,0|3,0,0]=4 1078 B10R1.61 C[C@@H](c1ncccc1F)N 1P01BGT9 [0,1,0,0,0,0|3,0,0]=4 1079 B10R1.61 C[C@@H](c1ncccc1F)O 1P01BGYU [0,1,0,0,0,0|3,0,0]=4 1080 B10R1.61 C[C@@H](c1nccnc1C)N 1P01FJTG [0,1,0,0,0,0|1,0,0]=2 1081 B10R1.61 C[C@H](c1ccccc1C)N 1P008HMX [0,1,0,0,0,0|3,0,0]=4 1082 B10R1.61 C[C@H](c1ccccc1C)N 1P008Y12 [0,1,0,0,0,0|3,0,0]=4 1083 B10R1.61 C[C@H](c1ccccc1C)O 1P00CLM3 [0,1,0,0,0,0|3,0,0]=4 1084 B10R1.61 C[C@H](c1cccnc1F)N 1P028EHU [0,1,0,0,0,0|3,0,0]=4 1085 B10R1.61 C[C@H](c1cccnc1F)O 1P024V0A [0,1,0,0,0,0|3,0,0]=4 1086 B10R1.61 C[C@H](c1cncnc1C)N 1P01BE0I [0,1,0,0,0,0|3,0,0]=4 1087 B10R1.61 C[C@H](c1cncnc1C)O 1P01BHDG [0,1,0,0,0,0|3,0,0]=4 1088 B10R1.61 C[C@H](c1ncccc1Br)O 1P01C38Q [0,1,0,0,0,0|3,0,0]=4 1089 B10R1.61 C[C@H](c1ncccc1C)N 1P01JV4F [0,1,0,0,0,0|2,0,0]=3 1090 B10R1.61 C[C@H](c1ncccc1C)N 1P01KL6O [0,1,0,0,0,0|2,0,0]=3 1091 B10R1.61 C[C@H](c1ncccc1F)N 1P01BH0Y [0,1,0,0,0,0|3,0,0]=4 1092 B10R1.61 C[C@H](c1ncccc1F)O 1P01BH00 [0,1,0,0,0,0|3,0,0]=4 1093 B10R1.61 C[C@H](c1nccnc1C)N 1P01FJTH [0,1,0,0,0,0|1,0,0]=2 1094 B10R1.61 FC(c1ncccc1C)F 1P01DZFW [0,1,0,0,0,0|3,0,0]=4 1095 B10R1.61 NC(=N)c1ncccc1C 1P000PEE [0,1,0,0,0,0|3,0,0]=4 1096 B10R1.61 NC(=O)c1cccnc1C 1P0036DJ [0,1,0,0,0,0|3,0,0]=4 1097 B10R1.61 NC(=O)c1ncccc1C 1P00GT5N [0,1,0,0,0,0|3,0,0]=4 1098 B10R1.61 NC(=O)c1nccnc1Br 1P002VB7 [0,1,0,0,0,0|3,0,0]=4 1099 B10R1.61 NC(=O)c1nccnc1Cl 1P003JS7 [0,1,0,0,0,0|3,0,0]=4 1100 B10R1.61 NC(=O)c1nccnc1N 1P00CAO8 [0,1,0,0,0,0|3,0,0]=4 1101 B10R1.61 NC(=O)c1nccnc1O 1P003K1L [0,1,0,0,0,0|3,0,0]=4 1102 B10R1.61 NC(=S)c1nccnc1N 1P01SCJN [0,1,0,0,0,0|3,0,0]=4 1103 B10R1.61 O=N(=O)c1cccnc1C 1P00EAXE [0,1,0,0,0,0|3,0,0]=4 1104 B10R1.61 OB(c1cccnc1C)O 1P0033W6 [0,1,0,0,0,0|3,0,0]=4 1105 B10R1.61 OB(c1cccnc1C)O 1P00GSLX [0,1,0,0,0,0|3,0,0]=4 1106 B10R1.61 OB(c1ncccc1C)O 1P003487 [0,1,0,0,0,0|3,0,0]=4 1107 B10R1.61 OC(=O)c1cccnc1C 1P003I6J [0,1,0,0,0,0|3,0,0]=4 1108 B10R1.61 OC(=O)c1cccnc1C 1P007Q5X [0,1,0,0,0,0|3,0,0]=4 1109 B10R1.61 OC(=O)c1ncccc1C 1P000LL7 [0,1,0,0,0,0|3,0,0]=4 1110 B10R1.61 OC(=O)c1ncccc1C 1P003488 [0,1,0,0,0,0|3,0,0]=4 1111 B10R1.61 OC(=O)c1nccnc1Br 1P00H1EL [0,1,0,0,0,0|3,0,0]=4 1112 B10R1.61 OC(=O)c1nccnc1C 1P003485 [0,1,0,0,0,0|2,0,0]=3 1113 B10R1.61 OC(=O)c1nccnc1Cl 1P003JS8 [0,1,0,0,0,0|3,0,0]=4 1114 B10R1.61 OC(=O)c1nccnc1F 1P01OMF7 [0,1,0,0,0,0|3,0,0]=4 1115 B10R1.61 OC(=O)c1nccnc1I 1P007P3R [0,1,0,0,0,0|3,0,0]=4 1116 B10R1.61 OC(=O)c1nccnc1N 1P003JEP [0,1,0,0,0,0|3,0,0]=4 1117 B10R1.61 OC(=O)c1nccnc1S 1P01ANEF [0,1,0,0,0,0|3,0,0]=4 1118 B10R1.61 [O-]S(=O)c1ncccc1C 1P01KLCL [0,1,0,0,0,0|2,0,1]=4 1119 B10R1.61 [O-]S(=O)c1ncccc1C 1P0286T8 [0,1,0,0,0,0|2,0,1]=4 1120 B10R1.61 [O-][N+](=O)c1cccnc1C 1P003I3F [0,1,0,0,0,0|3,0,0]=4 1121 B10R1.61 [O-][N+](=O)c1ncccc1C 1P00I1W2 [0,1,0,0,0,0|3,0,0]=4 1122 B10R1.61 [O-][N+](=O)c1nccnc1Cl 1P0036RO [0,1,0,0,0,0|3,0,0]=4 1123 B10R1.245 BrCc1c(C)ccnc1C 1P028YP9 [0,1,0,0,0,0|3,0,0]=4 1124 B10R1.245 CCc1c(C)cccc1N 1P01BJ4P [0,1,0,0,0,0|3,0,0]=4 1125 B10R1.245 CCc1c(C)ncnc1C 1P0283BI [0,1,0,0,0,0|3,0,0]=4 1126 B10R1.245 CCc1c(C)ncnc1N 1P0292WO [0,1,0,0,0,0|3,0,0]=4 1127 B10R1.245 CCc1c(O)ccnc1N 1P028FOS [0,1,0,0,0,0|3,0,0]=4 1128 B10R1.245 CNc1c(C)cccc1C 1P008PU6 [0,1,0,0,0,0|3,0,0]=4 1129 B10R1.245 CNc1c(C)cccc1F 1P027VWX [0,1,0,0,0,0|3,0,0]=4 1130 B10R1.245 CNc1c(C)cccc1N 1P00FWX5 [0,1,0,0,0,0|3,0,0]=4 1131 B10R1.245 CNc1c(C)ccnc1Cl 1P021WLP [0,1,0,0,0,0|3,0,0]=4 1132 B10R1.245 CNc1c(N)ccnc1Cl 1P01DWFU [0,1,0,0,0,0|3,0,0]=4 1133 B10R1.245 COc1c(Br)ccnc1C 1P000JU1 [0,1,0,0,0,0|1,1,0]=3 1134 B10R1.245 COc1c(Br)ccnc1Cl 1P01B9IY [0,1,0,0,0,0|2,1,0]=4 1135 B10R1.245 COc1c(Br)ccnc1F 1P01BKV2 [0,1,0,0,0,0|2,1,0]=4 1136 B10R1.245 COc1c(Br)ccnc1N 1P01C86R [0,1,0,0,0,0|2,1,0]=4 1137 B10R1.245 COc1c(C)[nH]ccc1=O 1P003K3C [0,1,0,0,0,0|1,1,1]=4 1138 B10R1.245 COc1c(C)cccc1Br 1P00DKWE [0,1,0,0,0,0|2,1,0]=4 1139 B10R1.245 COc1c(C)cccc1C 1P0002DE [0,1,0,0,0,0|2,1,0]=4 1140 B10R1.245 COc1c(C)cccc1I 1P01EV3I [0,1,0,0,0,0|2,1,0]=4 1141 B10R1.245 COc1c(C)cccc1N 1P002337 [0,1,0,0,0,0|2,1,0]=4 1142 B10R1.245 COc1c(C)ncnc1Cl 1P01B2MR [0,1,0,0,0,0|2,1,0]=4 1143 B10R1.245 COc1c(C)occc1=O 1P00DKKV [0,1,0,0,0,0|2,1,0]=4 1144 B10R1.245 COc1c(Cl)ccnc1C 1P007EX9 [0,1,0,0,0,0|1,1,0]=3 1145 B10R1.245 COc1c(Cl)ccnc1Cl 1P00J3B2 [0,1,0,0,0,0|2,1,0]=4 1146 B10R1.245 COc1c(Cl)ccnc1N 1P00A1Z1 [0,1,0,0,0,0|2,1,0]=4 1147 B10R1.245 COc1c(Cl)ccnc1O 1P01A4KO [0,1,0,0,0,0|2,1,0]=4 1148 B10R1.245 COc1c(F)ccnc1Br 1P020MM8 [0,1,0,0,0,0|2,1,0]=4 1149 B10R1.245 COc1c(F)ccnc1N 1P00ANOL [0,1,0,0,0,0|2,1,0]=4 1150 B10R1.245 COc1c(N)ccnc1C 1P00J3CX [0,1,0,0,0,0|1,1,0]=3 1151 B10R1.245 COc1c(N)ccnc1Cl 1P000JUJ [0,1,0,0,0,0|2,1,0]=4 1152 B10R1.245 COc1c(N)ccnc1F 1P01EIL5 [0,1,0,0,0,0|2,1,0]=4 1153 B10R1.245 COc1c(O)ccnc1F 1P01DL3Z [0,1,0,0,0,0|2,1,0]=4 1154 B10R1.245 CSc1c(C)cccc1O 1P00HAIM [0,1,0,0,0,0|2,0,0]=3 1155 B10R1.245 CSc1c(Cl)cccc1I 1P01JX70 [0,1,0,0,0,0|3,0,0]=4 1156 B10R1.245 CSc1c(F)cccc1Br 1P01FUBX [0,1,0,0,0,0|3,0,0]=4 1157 B10R1.245 CSc1c(N)cccc1Cl 1P019S1J [0,1,0,0,0,0|3,0,0]=4 1158 B10R1.245 CSc1c(N)cccc1F 1P003129 [0,1,0,0,0,0|3,0,0]=4 1159 B10R1.245 ClCc1c(C)ccnc1C 1P002JZC [0,1,0,0,0,0|3,0,0]=4 1160 B10R1.245 N#Cc1c(Cl)ccnc1C 1P00HJF9 [0,1,0,0,0,0|3,0,0]=4 1161 B10R1.245 NCc1c(C)ccnc1C 1P028BZB [0,1,0,0,0,0|3,0,0]=4 1162 B10R1.245 O=Cc1c(C)ccnc1C 1P001Y87 [0,1,0,0,0,0|3,0,0]=4 1163 B10R1.245 OCc1c(C)ccnc1C 1P00ACC3 [0,1,0,0,0,0|3,0,0]=4 1164 B10R2.7 C1Cc2c(C1)cccc2 1P0037N7 [0,0,0,1,0,0|3,0,0]=4 1165 B10R2.7 C1Cc2c(N1)nccc2 1P003FZJ [0,0,0,1,0,0|2,0,0]=3 1166 B10R2.7 C1Cc2c(N1)ncnc2 1P01BY0P [0,0,0,1,0,0|3,0,0]=4 1167 B10R2.7 C1Cc2c(N1)nncc2 1P027VME [0,0,0,1,0,0|3,0,0]=4 1168 B10R2.7 C1Nc2c(C1)nccc2 1P009I2U [0,0,0,1,0,0|2,0,0]=3 1169 B10R2.7 C1Nc2c(C1)nccc2 1P00AO2E [0,0,0,1,0,0|2,0,0]=3 1170 B10R2.7 C1Nc2c(C1)nncc2 1P01AV5F [0,0,0,1,0,0|3,0,0]=4 1171 B10R2.7 C1Nc2c(C1)nncc2 1P01AV5G [0,0,0,1,0,0|3,0,0]=4 1172 B10R2.7 C1Sc2c(S1)cccc2 1P00C5DW [0,0,0,1,0,0|3,0,0]=4 1173 B10R2.7 c1ccc2c(c1)OCC2 1P0033EK [0,0,0,1,0,0|2,1,0]=4 1174 B10R2.7 c1cnc2c(c1)CCC2 1P003FX5 [0,0,0,1,0,0|2,0,0]=3 1175 B10R2.7 c1cnc2c(c1)CNC2 1P001FM0 [0,0,0,1,0,0|3,0,0]=4 1176 B10R2.7 c1cnc2c(c1)CNC2 1P001FM2 [0,0,0,1,0,0|3,0,0]=4 1177 B10R2.7 c1cnc2c(c1)CNC2 1P00EL6Y [0,0,0,1,0,0|3,0,0]=4 1178 B10R2.7 c1cnc2c(c1)OCO2 1P005KA4 [0,0,0,1,0,0|2,1,0]=4 1179 B10R2.7 c1cnc2c(c1)ccs2 1P00C1QT [0,0,0,1,0,0|1,0,2]=4 1180 B10R2.7 c1cnc2c(c1)ncs2 1P00BVG7 [0,0,0,1,0,0|2,0,1]=4 1181 B10R2.7 c1cnc2c(c1)scc2 1P00BFOO [0,0,0,1,0,0|1,0,2]=4 1182 B10R2.7 c1cnc2c(c1)scn2 1P00BVG8 [0,0,0,1,0,0|2,0,1]=4 1183 B10R2.7 c1cnc2c(n1)NCC2 1P01XAC3 [0,0,0,1,0,0|1,0,0]=2 1184 B10R2.7 c1cnc2c(n1)[nH]cc2 1P00396J [0,0,0,1,0,0|1,0,2]=4 1185 B10R2.7 c1cnc2c(n1)[nH]cn2 1P00BFFZ [0,0,0,1,0,0|2,0,1]=4 1186 B10R2.7 c1cnc2c(n1)[nH]nc2 1P007LSE [0,0,0,1,0,0|2,0,1]=4 1187 B10R2.7 c1cnc2c(n1)csc2 1P007M3P [0,0,0,1,0,0|2,0,1]=4 1188 B10R2.7 c1cnc2c(n1)scc2 1P00DIC9 [0,0,0,1,0,0|0,0,2]=3 1189 B10R2.7 c1cnc2c(n1)scn2 1P01G8S8 [0,0,0,1,0,0|1,0,1]=3 1190 B8R1.11 BrCc1nccn1C 1P00J2TY [0,0,0,0,1,0|3,0,0]=4 1191 B8R1.11 C#Cc1nccn1C 1P00CAWY [0,0,0,0,1,0|2,0,1]=4 1192 B8R1.11 C#Cc1sccc1C 1P008N5V [0,0,0,0,1,0|2,0,1]=4 1193 B8R1.11 CCc1c[nH]nc1C 1P01UOKS [0,0,0,0,1,0|2,0,0]=3 1194 B8R1.11 CCc1c[nH]nc1N 1P00706L [0,0,0,0,1,0|3,0,0]=4 1195 B8R1.11 CCc1cnnn1C 1P01R4S3 [0,0,0,0,1,0|3,0,0]=4 1196 B8R1.11 CCc1conc1N 1P01DVVE [0,0,0,0,1,0|3,0,0]=4 1197 B8R1.11 CCc1n[nH]cc1Br 1P001QDJ [0,0,0,0,1,0|3,0,0]=4 1198 B8R1.11 CCc1n[nH]cc1Cl 1P01R68I [0,0,0,0,1,0|3,0,0]=4 1199 B8R1.11 CCc1ncoc1Br 1P028G5M [0,0,0,0,1,0|3,0,0]=4 1200 B8R1.11 CCc1ncsc1Br 1P00KDXM [0,0,0,0,1,0|3,0,0]=4 1201 B8R1.11 CCc1ncsc1N 1P01A25Z [0,0,0,0,1,0|3,0,0]=4 1202 B8R1.11 CCc1nncn1C 1P01A9K2 [0,0,0,0,1,0|3,0,0]=4 1203 B8R1.11 CCc1nnnn1C 1P006FW8 [0,0,0,0,1,0|3,0,0]=4 1204 B8R1.11 CCc1nocc1N 1P01EK3W [0,0,0,0,1,0|3,0,0]=4 1205 B8R1.11 CCc1nocc1N 1P0286HW [0,0,0,0,1,0|3,0,0]=4 1206 B8R1.11 CCc1nonc1N 1P019UTA [0,0,0,0,1,0|3,0,0]=4 1207 B8R1.11 CCc1nscc1N 1P027NP7 [0,0,0,0,1,0|3,0,0]=4 1208 B8R1.11 CCc1ocnc1I 1P028UDH [0,0,0,0,1,0|3,0,0]=4 1209 B8R1.11 CCc1scnc1C 1P00C09C [0,0,0,0,1,0|2,0,0]=3 1210 B8R1.11 CCn1ccnc1Br 1P00FDHC [0,0,0,0,1,0|3,0,0]=4 1211 B8R1.11 CCn1ccnc1Br 1P00J2XU [0,0,0,0,1,0|3,0,0]=4 1212 B8R1.11 CCn1ccnc1C 1P007P91 [0,0,0,0,1,0|2,0,0]=3 1213 B8R1.11 CCn1ccnc1Cl 1P00IIUO [0,0,0,0,1,0|3,0,0]=4 1214 B8R1.11 CCn1ccnc1N 1P01RIE9 [0,0,0,0,1,0|3,0,0]=4 1215 B8R1.11 CCn1ccnc1S 1P007X2J [0,0,0,0,1,0|3,0,0]=4 1216 B8R1.11 CCn1cnnc1C 1P01A9K5 [0,0,0,0,1,0|3,0,0]=4 1217 B8R1.11 CCn1nccc1Br 1P000TRN [0,0,0,0,1,0|3,0,0]=4 1218 B8R1.11 CCn1nccc1C 1P00JCO2 [0,0,0,0,1,0|2,0,0]=3 1219 B8R1.11 CCn1nccc1Cl 1P00HX11 [0,0,0,0,1,0|3,0,0]=4 1220 B8R1.11 CCn1nccc1I 1P009X6Z [0,0,0,0,1,0|3,0,0]=4 1221 B8R1.11 CCn1nccc1N 1P003ER6 [0,0,0,0,1,0|3,0,0]=4 1222 B8R1.11 CCn1nccc1O 1P007F8F [0,0,0,0,1,0|3,0,0]=4 1223 B8R1.11 CCn1nccc1O 1P028MCP [0,0,0,0,1,0|3,0,0]=4 1224 B8R1.11 CCn1ncnc1Br 1P00F7R1 [0,0,0,0,1,0|3,0,0]=4 1225 B8R1.11 CCn1ncnc1N 1P00EUDY [0,0,0,0,1,0|3,0,0]=4 1226 B8R1.11 CCn1ncnc1N 1P00J1N9 [0,0,0,0,1,0|3,0,0]=4 1227 B8R1.11 CCn1ncnc1O 1P0288C6 [0,0,0,0,1,0|3,0,0]=4 1228 B8R1.11 CNc1ccnn1C 1P01AKMK [0,0,0,0,1,0|2,0,0]=3 1229 B8R1.11 CNc1ccnn1C 1P01AKML [0,0,0,0,1,0|2,0,0]=3 1230 B8R1.11 CNc1csnc1C 1P01FK14 [0,0,0,0,1,0|2,0,0]=3 1231 B8R1.11 CNc1nncn1C 1P01A50J [0,0,0,0,1,0|3,0,0]=4 1232 B8R1.11 CNc1nnnn1C 1P007CZK [0,0,0,0,1,0|3,0,0]=4 1233 B8R1.11 CNc1nocc1C 1P028YWG [0,0,0,0,1,0|2,0,0]=3 1234 B8R1.11 CNc1nonc1C 1P027VVI [0,0,0,0,1,0|2,0,0]=3 1235 B8R1.11 COc1ccnn1C 1P00HUAZ [0,0,0,0,1,0|1,1,0]=3 1236 B8R1.11 COc1n[nH]cc1C 1P01EJ5X [0,0,0,0,1,0|1,1,0]=3 1237 B8R1.11 COc1n[nH]cc1I 1P00HUB0 [0,0,0,0,1,0|2,1,0]=4 1238 B8R1.11 COc1ncsc1Br 1P01FIXZ [0,0,0,0,1,0|2,1,0]=4 1239 B8R1.11 COc1nonc1N 1P005MR3 [0,0,0,0,1,0|2,1,0]=4 1240 B8R1.11 COc1nscc1Br 1P01A294 [0,0,0,0,1,0|2,1,0]=4 1241 B8R1.11 COc1nscc1I 1P028CPJ [0,0,0,0,1,0|2,1,0]=4 1242 B8R1.11 COc1sccc1Br 1P00EQRS [0,0,0,0,1,0|2,1,0]=4 1243 B8R1.11 CSC1=NCCN1C 1P00ELET [0,0,0,0,1,0|1,0,2]=4 1244 B8R1.11 CSc1ccoc1C 1P003I2Z [0,0,0,0,1,0|1,0,0]=2 1245 B8R1.11 CSc1cn[nH]c1N 1P019U13 [0,0,0,0,1,0|2,0,1]=4 1246 B8R1.11 CSc1cn[nH]c1N 1P019U14 [0,0,0,0,1,0|2,0,1]=4 1247 B8R1.11 CSc1cscc1Br 1P01HIP5 [0,0,0,0,1,0|3,0,0]=4 1248 B8R1.11 CSc1nccn1C 1P001KPA [0,0,0,0,1,0|1,0,0]=2 1249 B8R1.11 CSc1nncn1N 1P00JF0L [0,0,0,0,1,0|3,0,0]=4 1250 B8R1.11 CSc1nnnn1C 1P005P2B [0,0,0,0,1,0|2,0,0]=3 1251 B8R1.11 Cc1c(C=O)nc[nH]1 1P003NBH [0,0,0,0,1,0|2,0,1]=4 1252 B8R1.11 Cc1c(nc[nH]1)C#N 1P008TD0 [0,0,0,0,1,0|2,0,1]=4 1253 B8R1.11 Cc1c[nH]nc1C#C 1P02921G [0,0,0,0,1,0|2,0,1]=4 1254 B8R1.11 Cc1c[nH]nc1C#N 1P01E339 [0,0,0,0,1,0|3,0,0]=4 1255 B8R1.11 Cc1c[nH]nc1C=O 1P01B8B4 [0,0,0,0,1,0|3,0,0]=4 1256 B8R1.11 Cc1c[nH]nc1CCl 1P01E9IH [0,0,0,0,1,0|3,0,0]=4 1257 B8R1.11 Cc1c[nH]nc1CO 1P01BH3L [0,0,0,0,1,0|3,0,0]=4 1258 B8R1.11 Cc1conc1C#C 1P028ZB2 [0,0,0,0,1,0|2,0,1]=4 1259 B8R1.11 Cc1conc1C#N 1P01SWX8 [0,0,0,0,1,0|3,0,0]=4 1260 B8R1.11 Cc1conc1C=O 1P00HBLY [0,0,0,0,1,0|3,0,0]=4 1261 B8R1.11 Cc1conc1CBr 1P01DTUW [0,0,0,0,1,0|3,0,0]=4 1262 B8R1.11 Cc1conc1CO 1P01BVDX [0,0,0,0,1,0|3,0,0]=4 1263 B8R1.11 Cc1conc1CS 1P0285XB [0,0,0,0,1,0|3,0,0]=4 1264 B8R1.11 Cc1csnc1C=O 1P01DVF3 [0,0,0,0,1,0|3,0,0]=4 1265 B8R1.11 Cc1csnc1CCl 1P027UC2 [0,0,0,0,1,0|3,0,0]=4 1266 B8R1.11 Cc1csnc1CO 1P028AK7 [0,0,0,0,1,0|3,0,0]=4 1267 B8R1.11 Cc1n[nH]cc1C#N 1P001011 [0,0,0,0,1,0|3,0,0]=4 1268 B8R1.11 Cc1n[nH]cc1C=O 1P003K5C [0,0,0,0,1,0|3,0,0]=4 1269 B8R1.11 Cc1n[nH]cc1CN 1P00039D [0,0,0,0,1,0|3,0,0]=4 1270 B8R1.11 Cc1n[nH]cc1CN 1P019XQ2 [0,0,0,0,1,0|3,0,0]=4 1271 B8R1.11 Cc1n[nH]cc1CO 1P006WCZ [0,0,0,0,1,0|3,0,0]=4 1272 B8R1.11 Cc1nc[nH]c1CCl 1P00DFNK [0,0,0,0,1,0|2,0,1]=4 1273 B8R1.11 Cc1nc[nH]c1CN 1P00FS4D [0,0,0,0,1,0|2,0,1]=4 1274 B8R1.11 Cc1nc[nH]c1CO 1P002ZFD [0,0,0,0,1,0|2,0,1]=4 1275 B8R1.11 Cc1nc[nH]c1CO 1P003M7Q [0,0,0,0,1,0|2,0,1]=4 1276 B8R1.11 Cc1nccn1C#N 1P0021DP [0,0,0,0,1,0|3,0,0]=4 1277 B8R1.11 Cc1nccn1C=C 1P002W1R [0,0,0,0,1,0|2,0,1]=4 1278 B8R1.11 Cc1ncoc1C#N 1P0001Z4 [0,0,0,0,1,0|3,0,0]=4 1279 B8R1.11 Cc1ncoc1C=O 1P001QVV [0,0,0,0,1,0|3,0,0]=4 1280 B8R1.11 Cc1ncoc1CCl 1P00DLW6 [0,0,0,0,1,0|3,0,0]=4 1281 B8R1.11 Cc1ncoc1CCl 1P021N13 [0,0,0,0,1,0|3,0,0]=4 1282 B8R1.11 Cc1ncoc1CN 1P01AM79 [0,0,0,0,1,0|3,0,0]=4 1283 B8R1.11 Cc1ncoc1CN 1P01EIJH [0,0,0,0,1,0|3,0,0]=4 1284 B8R1.11 Cc1ncoc1CO 1P003M63 [0,0,0,0,1,0|3,0,0]=4 1285 B8R1.11 Cc1ncsc1C=C 1P0021R5 [0,0,0,0,1,0|2,0,1]=4 1286 B8R1.11 Cc1ncsc1C=O 1P003M9J [0,0,0,0,1,0|3,0,0]=4 1287 B8R1.11 Cc1ncsc1CBr 1P00J3DE [0,0,0,0,1,0|3,0,0]=4 1288 B8R1.11 Cc1ncsc1CCl 1P000UJQ [0,0,0,0,1,0|3,0,0]=4 1289 B8R1.11 Cc1ncsc1CN 1P00G55H [0,0,0,0,1,0|3,0,0]=4 1290 B8R1.11 Cc1ncsc1CO 1P002BFI [0,0,0,0,1,0|3,0,0]=4 1291 B8R1.11 Cc1nocc1CBr 1P01E8TO [0,0,0,0,1,0|3,0,0]=4 1292 B8R1.11 Cc1nocc1CCl 1P003WAH [0,0,0,0,1,0|3,0,0]=4 1293 B8R1.11 Cc1nocc1CN 1P0013IW [0,0,0,0,1,0|3,0,0]=4 1294 B8R1.11 Cc1nocc1CN 1P001BI9 [0,0,0,0,1,0|3,0,0]=4 1295 B8R1.11 Cc1nocc1CO 1P000274 [0,0,0,0,1,0|3,0,0]=4 1296 B8R1.11 Cc1nocc1CS 1P028FRL [0,0,0,0,1,0|3,0,0]=4 1297 B8R1.11 Cc1nonc1C=O 1P00IGMN [0,0,0,0,1,0|3,0,0]=4 1298 B8R1.11 Cc1nonc1CBr 1P00J37H [0,0,0,0,1,0|3,0,0]=4 1299 B8R1.11 Cc1nonc1CCl 1P0033XG [0,0,0,0,1,0|3,0,0]=4 1300 B8R1.11 Cc1nonc1CN 1P000HSB [0,0,0,0,1,0|3,0,0]=4 1301 B8R1.11 Cc1nonc1CN 1P007HU1 [0,0,0,0,1,0|3,0,0]=4 1302 B8R1.11 Cc1nonc1CO 1P0053ZA [0,0,0,0,1,0|3,0,0]=4 1303 B8R1.11 Cc1nonc1CS 1P0284JS [0,0,0,0,1,0|3,0,0]=4 1304 B8R1.11 Cc1nscc1C#C 1P028F3X [0,0,0,0,1,0|2,0,1]=4 1305 B8R1.11 Cc1nscc1C#N 1P00EDSA [0,0,0,0,1,0|3,0,0]=4 1306 B8R1.11 Cc1nscc1C=O 1P01DZBM [0,0,0,0,1,0|3,0,0]=4 1307 B8R1.11 Cc1nscc1CCl 1P02907E [0,0,0,0,1,0|3,0,0]=4 1308 B8R1.11 Cc1nscc1CO 1P01DZBN [0,0,0,0,1,0|3,0,0]=4 1309 B8R1.11 Cc1occc1C=O 1P00DBXY [0,0,0,0,1,0|3,0,0]=4 1310 B8R1.11 Cc1occc1CN 1P00C939 [0,0,0,0,1,0|3,0,0]=4 1311 B8R1.11 Cc1occc1CN 1P019XAT [0,0,0,0,1,0|3,0,0]=4 1312 B8R1.11 Cc1occc1CO 1P003IP1 [0,0,0,0,1,0|3,0,0]=4 1313 B8R1.11 Cc1ocnc1C#C 1P028IZI [0,0,0,0,1,0|2,0,1]=4 1314 B8R1.11 Cc1ocnc1C#N 1P01A3FL [0,0,0,0,1,0|3,0,0]=4 1315 B8R1.11 Cc1ocnc1C=O 1P00MDY4 [0,0,0,0,1,0|3,0,0]=4 1316 B8R1.11 Cc1ocnc1CCl 1P000LYP [0,0,0,0,1,0|3,0,0]=4 1317 B8R1.11 Cc1ocnc1CO 1P00GW29 [0,0,0,0,1,0|3,0,0]=4 1318 B8R1.11 Cc1sccc1C=O 1P004NVR [0,0,0,0,1,0|3,0,0]=4 1319 B8R1.11 Cc1sccc1CCl 1P027UD7 [0,0,0,0,1,0|3,0,0]=4 1320 B8R1.11 Cc1sccc1CN 1P01FJXJ [0,0,0,0,1,0|3,0,0]=4 1321 B8R1.11 Cc1scnc1C=O 1P002SGK [0,0,0,0,1,0|3,0,0]=4 1322 B8R1.11 Cc1scnc1CCl 1P00HWGE [0,0,0,0,1,0|3,0,0]=4 1323 B8R1.11 Cc1scnc1CN 1P028ZJJ [0,0,0,0,1,0|3,0,0]=4 1324 B8R1.11 Cc1scnc1CO 1P004N28 [0,0,0,0,1,0|3,0,0]=4 1325 B8R1.11 Cc1scnc1CO 1P00J30A [0,0,0,0,1,0|3,0,0]=4 1326 B8R1.11 ClCc1nccn1C 1P002G9F [0,0,0,0,1,0|3,0,0]=4 1327 B8R1.11 ClCc1nccn1C 1P005KGZ [0,0,0,0,1,0|3,0,0]=4 1328 B8R1.11 Cn1nccc1C#C 1P002BDX [0,0,0,0,1,0|2,0,1]=4 1329 B8R1.11 Cn1nccc1C#N 1P00339F [0,0,0,0,1,0|3,0,0]=4 1330 B8R1.11 Cn1nccc1C=O 1P0038KU [0,0,0,0,1,0|3,0,0]=4 1331 B8R1.11 Cn1nccc1CBr 1P01BSNZ [0,0,0,0,1,0|3,0,0]=4 1332 B8R1.11 Cn1nccc1CCl 1P003MNQ [0,0,0,0,1,0|3,0,0]=4 1333 B8R1.11 Cn1nccc1CCl 1P00G7HY [0,0,0,0,1,0|3,0,0]=4 1334 B8R1.11 Cn1nccc1CN 1P003MNB [0,0,0,0,1,0|3,0,0]=4 1335 B8R1.11 Cn1nccc1CN 1P0093F9 [0,0,0,0,1,0|3,0,0]=4 1336 B8R1.11 Cn1nccc1CO 1P008I3U [0,0,0,0,1,0|3,0,0]=4 1337 B8R1.11 Cn1nccc1CS 1P028GXP [0,0,0,0,1,0|3,0,0]=4 1338 B8R1.11 Cn1ncnc1C#C 1P00DYQN [0,0,0,0,1,0|2,0,1]=4 1339 B8R1.11 Cn1ncnc1C#N 1P01EK5T [0,0,0,0,1,0|3,0,0]=4 1340 B8R1.11 Cn1ncnc1CCl 1P009MOF [0,0,0,0,1,0|3,0,0]=4 1341 B8R1.11 Cn1ncnc1CN 1P002OOE [0,0,0,0,1,0|3,0,0]=4 1342 B8R1.11 Cn1ncnc1CN 1P01A4FS [0,0,0,0,1,0|3,0,0]=4 1343 B8R1.11 Cn1ncnc1CO 1P0037FL [0,0,0,0,1,0|3,0,0]=4 1344 B8R1.11 Cn1ncnc1CO 1P01BCIZ [0,0,0,0,1,0|3,0,0]=4 1345 B8R1.11 Cn1ncnc1NN 1P01BGSS [0,0,0,0,1,0|3,0,0]=4 1346 B8R1.11 Cn1ncnc1NN 1P01C51R [0,0,0,0,1,0|3,0,0]=4 1347 B8R1.11 N#CC1=C(C)C=CN1 1P01G7RI [0,0,0,0,1,0|2,0,1]=4 1348 B8R1.11 N#Cc1nccn1C 1P00DEI9 [0,0,0,0,1,0|3,0,0]=4 1349 B8R1.11 N#Cc1sccc1C 1P003K8R [0,0,0,0,1,0|3,0,0]=4 1350 B8R1.11 NCc1c[nH]nc1C 1P01A7EA [0,0,0,0,1,0|3,0,0]=4 1351 B8R1.11 NCc1ccnn1C 1P0091AA [0,0,0,0,1,0|3,0,0]=4 1352 B8R1.11 NCc1csnc1C 1P027W0J [0,0,0,0,1,0|3,0,0]=4 1353 B8R1.11 NCc1n[nH]cc1C 1P00ILM5 [0,0,0,0,1,0|3,0,0]=4 1354 B8R1.11 NCc1nc[nH]c1C 1P019TWY [0,0,0,0,1,0|2,0,1]=4 1355 B8R1.11 NCc1nccn1C 1P000MAC [0,0,0,0,1,0|3,0,0]=4 1356 B8R1.11 NCc1nccn1C 1P007XU1 [0,0,0,0,1,0|3,0,0]=4 1357 B8R1.11 NCc1nccn1C 1P00DIDN [0,0,0,0,1,0|3,0,0]=4 1358 B8R1.11 NCc1occc1C 1P00CM1P [0,0,0,0,1,0|3,0,0]=4 1359 B8R1.11 NCc1sccc1C 1P003C9G [0,0,0,0,1,0|3,0,0]=4 1360 B8R1.11 NCc1sccc1C 1P00HBEG [0,0,0,0,1,0|3,0,0]=4 1361 B8R1.11 NNc1ccnn1C 1P00J3AT [0,0,0,0,1,0|3,0,0]=4 1362 B8R1.11 NNc1nccn1C 1P01AM4H [0,0,0,0,1,0|3,0,0]=4 1363 B8R1.11 NNc1nccn1C 1P01C52O [0,0,0,0,1,0|3,0,0]=4 1364 B8R1.11 O=Cc1[nH]ccc1C 1P007OR5 [0,0,0,0,1,0|2,0,1]=4 1365 B8R1.11 O=Cc1nccn1C 1P0013VA [0,0,0,0,1,0|3,0,0]=4 1366 B8R1.11 O=Cc1sccc1C 1P00347R [0,0,0,0,1,0|3,0,0]=4 1367 B8R1.11 OCc1nccn1C 1P001ZA4 [0,0,0,0,1,0|3,0,0]=4 1368 B8R1.11 OCc1nccn1C 1P01A20A [0,0,0,0,1,0|3,0,0]=4 1369 B8R1.11 OCc1occc1C 1P00C2AP [0,0,0,0,1,0|3,0,0]=4 1370 B8R1.11 OCc1sccc1C 1P00EJFD [0,0,0,0,1,0|3,0,0]=4 1371 B8R1.11 SCc1occc1C 1P01EJ9G [0,0,0,0,1,0|3,0,0]=4 1372 B7R0.10 ON=C(C(=NO)C)C 1P00C5FG [1,0,1,0,0,0|2,0,0]=4 1373 B7R0.10 O\N=C(\C(=N\O)\C)/C 1P003Q3Z [1,0,1,0,0,0|2,0,0]=4 1374 B7R0.10 [O-]\N=C(/C(=N/[O-])/C)\C 1P003Q40 [1,0,1,0,0,0|2,0,0]=4 1375 B7R1.3 Brc1ccccn1 1P0033NM [2,0,0,0,0,0|2,0,0]=4 1376 B7R1.3 Brc1cccnc1 1P00343S [2,0,0,0,0,0|2,0,0]=4 1377 B7R1.3 Brc1cnccn1 1P0033NL [2,0,0,0,0,0|1,0,0]=3 1378 B7R1.3 Brc1cnccn1 1P01ANMT [2,0,0,0,0,0|1,0,0]=3 1379 B7R1.3 Cc1ccccn1 1P0023GU [2,0,0,0,0,0|1,0,0]=3 1380 B7R1.3 Cc1ccccn1 1P0037Z6 [2,0,0,0,0,0|1,0,0]=3 1381 B7R1.3 Cc1cccnc1 1P003486 [2,0,0,0,0,0|1,0,0]=3 1382 B7R1.3 Cc1cccnn1 1P001UBK [2,0,0,0,0,0|2,0,0]=4 1383 B7R1.3 Cc1ccncn1 1P003M9B [2,0,0,0,0,0|2,0,0]=4 1384 B7R1.3 Cc1ccnnc1 1P00HCT0 [2,0,0,0,0,0|2,0,0]=4 1385 B7R1.3 Cc1cnccn1 1P003I6Y [2,0,0,0,0,0|0,0,0]=2 1386 B7R1.3 Cc1cncnc1 1P0029HT [2,0,0,0,0,0|2,0,0]=4 1387 B7R1.3 Cc1ncccn1 1P003I70 [2,0,0,0,0,0|2,0,0]=4 1388 B7R1.3 Cc1nccnn1 1P00C4US [2,0,0,0,0,0|1,0,0]=3 1389 B7R1.3 Clc1c[c-]ccn1 1P008UMS [2,0,0,0,0,0|2,0,0]=4 1390 B7R1.3 Clc1cccnc1 1P003JSA [2,0,0,0,0,0|2,0,0]=4 1391 B7R1.3 Clc1cnccn1 1P001L0E [2,0,0,0,0,0|1,0,0]=3 1392 B7R1.3 Fc1ccccn1 1P0033SI [2,0,0,0,0,0|2,0,0]=4 1393 B7R1.3 Fc1cccnc1 1P003JYE [2,0,0,0,0,0|2,0,0]=4 1394 B7R1.3 Fc1cnccn1 1P00D9L3 [2,0,0,0,0,0|1,0,0]=3 1395 B7R1.3 Ic1ccccn1 1P0036MH [2,0,0,0,0,0|2,0,0]=4 1396 B7R1.3 Ic1cccnc1 1P003476 [2,0,0,0,0,0|2,0,0]=4 1397 B7R1.3 Ic1cnccn1 1P0035HV [2,0,0,0,0,0|1,0,0]=3 1398 B7R1.3 Nc1ccccn1 1P00CMJB [2,0,0,0,0,0|2,0,0]=4 1399 B7R1.3 Nc1cccnc1 1P003JEQ [2,0,0,0,0,0|2,0,0]=4 1400 B7R1.3 Nc1cnccn1 1P003H0L [2,0,0,0,0,0|1,0,0]=3 1401 B7R1.3 Nc1cnncn1 1P0050GR [2,0,0,0,0,0|2,0,0]=4 1402 B7R1.3 Nc1nccnn1 1P003JAB [2,0,0,0,0,0|2,0,0]=4 1403 B7R1.3 O=c1cncc[nH]1 1P003HWP [2,0,0,0,0,0|0,1,1]=4 1404 B7R1.3 Oc1ccccn1 1P003UF8 [2,0,0,0,0,0|1,1,0]=4 1405 B7R1.3 Oc1ccccn1 1P003UIP [2,0,0,0,0,0|1,1,0]=4 1406 B7R1.3 Oc1cccnc1 1P003K1M [2,0,0,0,0,0|1,1,0]=4 1407 B7R1.3 Oc1cnccn1 1P000N6P [2,0,0,0,0,0|0,1,0]=3 1408 B7R1.3 Sc1cccnc1 1P001SU2 [2,0,0,0,0,0|1,0,0]=3 1409 B7R1.3 Sc1cnccn1 1P003HZ3 [2,0,0,0,0,0|0,0,0]=2 1410 B7R1.3 Sc1ncccn1 1P000W8T [2,0,0,0,0,0|2,0,0]=4 1411 B9R1.1 BrCc1cnc(cn1)Br 1P00HVPQ [1,1,0,0,0,0|2,0,0]=4 1412 B9R1.1 Brc1cnc(cn1)C#N 1P0070KA [1,1,0,0,0,0|2,0,0]=4 1413 B9R1.1 Brc1cnc(cn1)C=O 1P009W0Q [1,1,0,0,0,0|2,0,0]=4 1414 B9R1.1 CCc1ccc(cn1)Br 1P00C7IF [1,1,0,0,0,0|2,0,0]=4 1415 B9R1.1 CCc1ccc(cn1)C 1P00235T [1,1,0,0,0,0|2,0,0]=4 1416 B9R1.1 CCc1ccc(cn1)Cl 1P000HRE [1,1,0,0,0,0|2,0,0]=4 1417 B9R1.1 CCc1ccc(cn1)N 1P000TDY [1,1,0,0,0,0|2,0,0]=4 1418 B9R1.1 CCc1ccc(nc1)Br 1P002BZE [1,1,0,0,0,0|2,0,0]=4 1419 B9R1.1 CCc1ccc(nc1)C 1P003N6Q [1,1,0,0,0,0|2,0,0]=4 1420 B9R1.1 CCc1ccc(nc1)Cl 1P00GVTP [1,1,0,0,0,0|2,0,0]=4 1421 B9R1.1 CCc1ccc(nc1)F 1P024ZTD [1,1,0,0,0,0|2,0,0]=4 1422 B9R1.1 CCc1ccc(nc1)N 1P002BZF [1,1,0,0,0,0|2,0,0]=4 1423 B9R1.1 CCc1ccc(nc1)O 1P00D8JL [1,1,0,0,0,0|2,0,0]=4 1424 B9R1.1 CCc1cnc(cn1)C 1P0036KU [1,1,0,0,0,0|1,0,0]=3 1425 B9R1.1 CCc1cnc(cn1)N 1P006ZHR [1,1,0,0,0,0|1,0,0]=3 1426 B9R1.1 CNc1ccc(cn1)Br 1P0054DA [1,1,0,0,0,0|2,0,0]=4 1427 B9R1.1 CNc1ccc(cn1)C 1P00DKLV [1,1,0,0,0,0|2,0,0]=4 1428 B9R1.1 CNc1ccc(cn1)Cl 1P007433 [1,1,0,0,0,0|2,0,0]=4 1429 B9R1.1 CNc1ccc(cn1)I 1P00BK8S [1,1,0,0,0,0|2,0,0]=4 1430 B9R1.1 CNc1ccc(cn1)N 1P008V2F [1,1,0,0,0,0|2,0,0]=4 1431 B9R1.1 CNc1ccc(cn1)N 1P00BEJL [1,1,0,0,0,0|2,0,0]=4 1432 B9R1.1 CNc1ccc(cn1)N 1P01FATH [1,1,0,0,0,0|2,0,0]=4 1433 B9R1.1 CNc1ccc(nc1)Br 1P00941T [1,1,0,0,0,0|2,0,0]=4 1434 B9R1.1 CNc1ccc(nc1)C 1P00943F [1,1,0,0,0,0|2,0,0]=4 1435 B9R1.1 CNc1ccc(nc1)Cl 1P008UXG [1,1,0,0,0,0|2,0,0]=4 1436 B9R1.1 CNc1ccc(nc1)F 1P00AOFA [1,1,0,0,0,0|2,0,0]=4 1437 B9R1.1 CNc1ccc(nc1)N 1P019SL4 [1,1,0,0,0,0|2,0,0]=4 1438 B9R1.1 CNc1cnc(cn1)Br 1P00DGIV [1,1,0,0,0,0|1,0,0]=3 1439 B9R1.1 CNc1cnc(cn1)C 1P003I46 [1,1,0,0,0,0|1,0,0]=3 1440 B9R1.1 CNc1cnc(cn1)Cl 1P01K02E [1,1,0,0,0,0|1,0,0]=3 1441 B9R1.1 COc1ccc(cn1)Br 1P003MY9 [1,1,0,0,0,0|1,1,0]=4 1442 B9R1.1 COc1ccc(cn1)C 1P0070MX [1,1,0,0,0,0|1,1,0]=4 1443 B9R1.1 COc1ccc(cn1)Cl 1P003N3Y [1,1,0,0,0,0|1,1,0]=4 1444 B9R1.1 COc1ccc(cn1)F 1P003N7M [1,1,0,0,0,0|1,1,0]=4 1445 B9R1.1 COc1ccc(cn1)I 1P0032QK [1,1,0,0,0,0|1,1,0]=4 1446 B9R1.1 COc1ccc(cn1)N 1P0033U7 [1,1,0,0,0,0|1,1,0]=4 1447 B9R1.1 COc1ccc(cn1)O 1P003954 [1,1,0,0,0,0|1,1,0]=4 1448 B9R1.1 COc1ccc(cn1)S 1P01L022 [1,1,0,0,0,0|1,1,0]=4 1449 B9R1.1 COc1ccc(nc1)Br 1P0038TC [1,1,0,0,0,0|1,1,0]=4 1450 B9R1.1 COc1ccc(nc1)C 1P00IABL [1,1,0,0,0,0|1,1,0]=4 1451 B9R1.1 COc1ccc(nc1)Cl 1P001BS1 [1,1,0,0,0,0|1,1,0]=4 1452 B9R1.1 COc1ccc(nc1)F 1P00130G [1,1,0,0,0,0|1,1,0]=4 1453 B9R1.1 COc1ccc(nc1)I 1P001U9H [1,1,0,0,0,0|1,1,0]=4 1454 B9R1.1 COc1ccc(nc1)N 1P0005LO [1,1,0,0,0,0|1,1,0]=4 1455 B9R1.1 COc1cnc(cn1)Br 1P0033MJ [1,1,0,0,0,0|0,1,0]=3 1456 B9R1.1 COc1cnc(cn1)Cl 1P00BZ0W [1,1,0,0,0,0|0,1,0]=3 1457 B9R1.1 COc1cnc(cn1)N 1P003GXX [1,1,0,0,0,0|0,1,0]=3 1458 B9R1.1 COc1ncc(nn1)C 1P01GLRT [1,1,0,0,0,0|1,1,0]=4 1459 B9R1.1 CSc1ccc(=O)[nH]n1 1P0285ZR [1,1,0,0,0,0|2,0,0]=4 1460 B9R1.1 CSc1ccc(cc1)Br 1P003LHW [1,1,0,0,0,0|2,0,0]=4 1461 B9R1.1 CSc1ccc(cc1)C 1P003CD6 [1,1,0,0,0,0|2,0,0]=4 1462 B9R1.1 CSc1ccc(cc1)Cl 1P000KDA [1,1,0,0,0,0|2,0,0]=4 1463 B9R1.1 CSc1ccc(cc1)F 1P003LX0 [1,1,0,0,0,0|2,0,0]=4 1464 B9R1.1 CSc1ccc(cc1)I 1P00BY6Q [1,1,0,0,0,0|2,0,0]=4 1465 B9R1.1 CSc1ccc(cc1)N 1P003KPS [1,1,0,0,0,0|2,0,0]=4 1466 B9R1.1 CSc1ccc(cc1)O 1P0034AH [1,1,0,0,0,0|2,0,0]=4 1467 B9R1.1 CSc1ccc(cc1)S 1P003KQA [1,1,0,0,0,0|2,0,0]=4 1468 B9R1.1 CSc1ccc(cn1)Br 1P00D8H6 [1,1,0,0,0,0|1,0,0]=3 1469 B9R1.1 CSc1ccc(cn1)N 1P00CFUQ [1,1,0,0,0,0|1,0,0]=3 1470 B9R1.1 CSc1ccc(nc1)Br 1P009EF8 [1,1,0,0,0,0|1,0,0]=3 1471 B9R1.1 CSc1ccc(nc1)Cl 1P00CKSD [1,1,0,0,0,0|1,0,0]=3 1472 B9R1.1 CSc1ccc(nc1)N 1P008P9S [1,1,0,0,0,0|1,0,0]=3 1473 B9R1.1 CSc1ccc(nn1)Br 1P000HV7 [1,1,0,0,0,0|2,0,0]=4 1474 B9R1.1 CSc1ccc(nn1)Cl 1P005UUE [1,1,0,0,0,0|2,0,0]=4 1475 B9R1.1 CSc1cnc(cn1)Br 1P007GKA [1,1,0,0,0,0|0,0,0]=2 1476 B9R1.1 CSc1cnc(cn1)N 1P002R50 [1,1,0,0,0,0|0,0,0]=2 1477 B9R1.1 CSc1cnc(nc1)Cl 1P000GO4 [1,1,0,0,0,0|2,0,0]=4 1478 B9R1.1 CSc1ncc(cn1)Br 1P001CEF [1,1,0,0,0,0|2,0,0]=4 1479 B9R1.1 CSc1ncc(cn1)Cl 1P003N2M [1,1,0,0,0,0|2,0,0]=4 1480 B9R1.1 CSc1ncc(cn1)F 1P00EDR1 [1,1,0,0,0,0|2,0,0]=4 1481 B9R1.1 CSc1ncc(cn1)N 1P003MTM [1,1,0,0,0,0|2,0,0]=4 1482 B9R1.1 CSc1ncc(cn1)O 1P003N91 [1,1,0,0,0,0|2,0,0]=4 1483 B9R1.1 Cc1cnc(cn1)C#C 1P008X25 [1,1,0,0,0,0|1,0,1]=4 1484 B9R1.1 Cc1cnc(cn1)C#N 1P0037CI [1,1,0,0,0,0|2,0,0]=4 1485 B9R1.1 Cc1cnc(cn1)C=C 1P007ZUI [1,1,0,0,0,0|1,0,1]=4 1486 B9R1.1 Cc1cnc(cn1)C=O 1P0037UJ [1,1,0,0,0,0|2,0,0]=4 1487 B9R1.1 Cc1cnc(cn1)CCl 1P000YCK [1,1,0,0,0,0|2,0,0]=4 1488 B9R1.1 Cc1cnc(cn1)CN 1P0011FS [1,1,0,0,0,0|2,0,0]=4 1489 B9R1.1 Cc1cnc(cn1)CO 1P00EITF [1,1,0,0,0,0|2,0,0]=4 1490 B9R1.1 Cc1cnc(cn1)NN 1P001VP6 [1,1,0,0,0,0|2,0,0]=4 1491 B9R1.1 ClCc1cnc(cn1)Cl 1P00853R [1,1,0,0,0,0|2,0,0]=4 1492 B9R1.1 Clc1cnc(cn1)C#N 1P0037SL [1,1,0,0,0,0|2,0,0]=4 1493 B9R1.1 Clc1cnc(cn1)C=O 1P004AM6 [1,1,0,0,0,0|2,0,0]=4 1494 B9R1.1 Fc1cnc(cn1)C#N 1P019DIC [1,1,0,0,0,0|2,0,0]=4 1495 B9R1.1 NCc1cnc(cn1)Br 1P00HV74 [1,1,0,0,0,0|2,0,0]=4 1496 B9R1.1 NCc1cnc(cn1)Cl 1P007ELF [1,1,0,0,0,0|2,0,0]=4 1497 B9R1.1 NCc1cnc(cn1)Cl 1P01C3G8 [1,1,0,0,0,0|2,0,0]=4 1498 B9R1.1 NCc1cnc(cn1)N 1P0290B5 [1,1,0,0,0,0|2,0,0]=4 1499 B9R1.1 NCc1ncc(nc1)C 1P01JUG0 [1,1,0,0,0,0|2,0,0]=4 1500 B9R1.1 Nc1cnc(cn1)C#C 1P00DM40 [1,1,0,0,0,0|1,0,1]=4 1501 B9R1.1 Nc1cnc(cn1)C#N 1P003GXK [1,1,0,0,0,0|2,0,0]=4 1502 B9R1.1 Nc1cnc(cn1)C=O 1P01FPZZ [1,1,0,0,0,0|2,0,0]=4 1503 B9R1.1 Nc1cnc(cn1)CO 1P01A06C [1,1,0,0,0,0|2,0,0]=4 1504 B9R1.1 OCc1cnc(cn1)Br 1P00FGRP [1,1,0,0,0,0|2,0,0]=4 1505 B9R1.1 OCc1cnc(cn1)Cl 1P003HEP [1,1,0,0,0,0|2,0,0]=4 1506 B9R1.2 Brc1cncc(n1)C#N 1P004X32 [1,1,0,0,0,0|2,0,0]=4 1507 B9R1.2 CCc1cc(Br)ccn1 1P001PG2 [1,1,0,0,0,0|2,0,0]=4 1508 B9R1.2 CCc1cc(Br)cnc1 1P009BLX [1,1,0,0,0,0|2,0,0]=4 1509 B9R1.2 CCc1cc(Cl)cnc1 1P01BUJN [1,1,0,0,0,0|2,0,0]=4 1510 B9R1.2 CCc1cc(N)ccn1 1P00DGSU [1,1,0,0,0,0|2,0,0]=4 1511 B9R1.2 CCc1cc(N)cnc1 1P0092A4 [1,1,0,0,0,0|2,0,0]=4 1512 B9R1.2 CCc1cc(O)cnc1 1P01IO5Q [1,1,0,0,0,0|2,0,0]=4 1513 B9R1.2 CCc1cccc(n1)Br 1P00370H [1,1,0,0,0,0|2,0,0]=4 1514 B9R1.2 CCc1cccc(n1)C 1P0083JM [1,1,0,0,0,0|2,0,0]=4 1515 B9R1.2 CCc1cccc(n1)F 1P00KE64 [1,1,0,0,0,0|2,0,0]=4 1516 B9R1.2 CCc1cccc(n1)N 1P003NNZ [1,1,0,0,0,0|2,0,0]=4 1517 B9R1.2 CCc1cncc(n1)C 1P003HO1 [1,1,0,0,0,0|1,0,0]=3 1518 B9R1.2 CCc1cncc(n1)C 1P00CUFF [1,1,0,0,0,0|1,0,0]=3 1519 B9R1.2 CCc1cncc(n1)N 1P006ZHQ [1,1,0,0,0,0|1,0,0]=3 1520 B9R1.2 CNc1cc(Br)ccn1 1P00DKLE [1,1,0,0,0,0|2,0,0]=4 1521 B9R1.2 CNc1cc(Br)cnc1 1P003AL0 [1,1,0,0,0,0|2,0,0]=4 1522 B9R1.2 CNc1cc(Cl)ccn1 1P00G2NA [1,1,0,0,0,0|2,0,0]=4 1523 B9R1.2 CNc1cc(F)ccn1 1P00A16T [1,1,0,0,0,0|2,0,0]=4 1524 B9R1.2 CNc1cc(N)ccn1 1P009X0L [1,1,0,0,0,0|2,0,0]=4 1525 B9R1.2 CNc1cccc(n1)Br 1P0088O5 [1,1,0,0,0,0|2,0,0]=4 1526 B9R1.2 CNc1cccc(n1)C 1P01AJJZ [1,1,0,0,0,0|2,0,0]=4 1527 B9R1.2 CNc1cccc(n1)Cl 1P00437Y [1,1,0,0,0,0|2,0,0]=4 1528 B9R1.2 CNc1cccc(n1)F 1P00CLTI [1,1,0,0,0,0|2,0,0]=4 1529 B9R1.2 CNc1cccc(n1)N 1P00GALK [1,1,0,0,0,0|2,0,0]=4 1530 B9R1.2 CNc1cccc(n1)O 1P00BU94 [1,1,0,0,0,0|2,0,0]=4 1531 B9R1.2 CNc1cncc(c1)C 1P01KHHK [1,1,0,0,0,0|2,0,0]=4 1532 B9R1.2 CNc1cncc(n1)Br 1P00J2W5 [1,1,0,0,0,0|1,0,0]=3 1533 B9R1.2 CNc1cncc(n1)C 1P00IG75 [1,1,0,0,0,0|1,0,0]=3 1534 B9R1.2 CNc1cncc(n1)Cl 1P008GPP [1,1,0,0,0,0|1,0,0]=3 1535 B9R1.2 CNc1nccc(c1)C 1P019S75 [1,1,0,0,0,0|2,0,0]=4 1536 B9R1.2 COc1cc(Br)ccn1 1P00027I [1,1,0,0,0,0|1,1,0]=4 1537 B9R1.2 COc1cc(Br)cnc1 1P003JJQ [1,1,0,0,0,0|1,1,0]=4 1538 B9R1.2 COc1cc(Cl)ccn1 1P0033U6 [1,1,0,0,0,0|1,1,0]=4 1539 B9R1.2 COc1cc(Cl)cnc1 1P005XEU [1,1,0,0,0,0|1,1,0]=4 1540 B9R1.2 COc1cc(F)ccn1 1P00360G [1,1,0,0,0,0|1,1,0]=4 1541 B9R1.2 COc1cc(F)cnc1 1P007ELO [1,1,0,0,0,0|1,1,0]=4 1542 B9R1.2 COc1cc(I)ccn1 1P0034JF [1,1,0,0,0,0|1,1,0]=4 1543 B9R1.2 COc1cc(I)cnc1 1P003K23 [1,1,0,0,0,0|1,1,0]=4 1544 B9R1.2 COc1cc(N)ccn1 1P0034CU [1,1,0,0,0,0|1,1,0]=4 1545 B9R1.2 COc1cc(N)cnc1 1P003JDA [1,1,0,0,0,0|1,1,0]=4 1546 B9R1.2 COc1cc(O)ccn1 1P00FCFK [1,1,0,0,0,0|1,1,0]=4 1547 B9R1.2 COc1cc(O)cnc1 1P003NB5 [1,1,0,0,0,0|1,1,0]=4 1548 B9R1.2 COc1cc(S)ccn1 1P028W86 [1,1,0,0,0,0|1,1,0]=4 1549 B9R1.2 COc1cccc(n1)Br 1P003H7O [1,1,0,0,0,0|1,1,0]=4 1550 B9R1.2 COc1cccc(n1)C 1P003I0A [1,1,0,0,0,0|1,1,0]=4 1551 B9R1.2 COc1cccc(n1)Cl 1P0033PJ [1,1,0,0,0,0|1,1,0]=4 1552 B9R1.2 COc1cccc(n1)F 1P000CH1 [1,1,0,0,0,0|1,1,0]=4 1553 B9R1.2 COc1cccc(n1)I 1P00240L [1,1,0,0,0,0|1,1,0]=4 1554 B9R1.2 COc1cccc(n1)N 1P0027BO [1,1,0,0,0,0|1,1,0]=4 1555 B9R1.2 COc1cncc(n1)Br 1P006RQE [1,1,0,0,0,0|0,1,0]=3 1556 B9R1.2 COc1cncc(n1)C 1P002X48 [1,1,0,0,0,0|0,1,0]=3 1557 B9R1.2 COc1cncc(n1)Cl 1P007GOB [1,1,0,0,0,0|0,1,0]=3 1558 B9R1.2 COc1cncc(n1)I 1P00EA5I [1,1,0,0,0,0|0,1,0]=3 1559 B9R1.2 COc1cncc(n1)N 1P003NQM [1,1,0,0,0,0|0,1,0]=3 1560 B9R1.2 COc1nccc(c1)C 1P0003HE [1,1,0,0,0,0|1,1,0]=4 1561 B9R1.2 CSc1cc(Br)cnc1 1P007ZGD [1,1,0,0,0,0|1,0,0]=3 1562 B9R1.2 CSc1cc(Br)ncn1 1P0094GP [1,1,0,0,0,0|2,0,0]=4 1563 B9R1.2 CSc1cc(Cl)ccn1 1P00CL7Q [1,1,0,0,0,0|1,0,0]=3 1564 B9R1.2 CSc1cc(Cl)ncn1 1P003LMD [1,1,0,0,0,0|2,0,0]=4 1565 B9R1.2 CSc1cc(I)ncn1 1P00IG1J [1,1,0,0,0,0|2,0,0]=4 1566 B9R1.2 CSc1cc(N)ccn1 1P003L4L [1,1,0,0,0,0|1,0,0]=3 1567 B9R1.2 CSc1cc(N)ccn1 1P01BV4Y [1,1,0,0,0,0|1,0,0]=3 1568 B9R1.2 CSc1cc(N)cnc1 1P00CGZQ [1,1,0,0,0,0|1,0,0]=3 1569 B9R1.2 CSc1cc(N)ncn1 1P0029LA [1,1,0,0,0,0|2,0,0]=4 1570 B9R1.2 CSc1cc(O)ccn1 1P01EMTA [1,1,0,0,0,0|1,0,0]=3 1571 B9R1.2 CSc1cccc(c1)Br 1P003JLZ [1,1,0,0,0,0|2,0,0]=4 1572 B9R1.2 CSc1cccc(c1)Cl 1P003JSF [1,1,0,0,0,0|2,0,0]=4 1573 B9R1.2 CSc1cccc(c1)F 1P003JYJ [1,1,0,0,0,0|2,0,0]=4 1574 B9R1.2 CSc1cccc(c1)I 1P000UUQ [1,1,0,0,0,0|2,0,0]=4 1575 B9R1.2 CSc1cccc(c1)N 1P0026DI [1,1,0,0,0,0|2,0,0]=4 1576 B9R1.2 CSc1cccc(c1)O 1P00C8UY [1,1,0,0,0,0|2,0,0]=4 1577 B9R1.2 CSc1cccc(n1)Br 1P005ECU [1,1,0,0,0,0|1,0,0]=3 1578 B9R1.2 CSc1cccc(n1)Cl 1P005QNO [1,1,0,0,0,0|1,0,0]=3 1579 B9R1.2 CSc1cccc(n1)N 1P01BBLS [1,1,0,0,0,0|1,0,0]=3 1580 B9R1.2 CSc1ccnc(n1)Cl 1P00DEZR [1,1,0,0,0,0|2,0,0]=4 1581 B9R1.2 CSc1ccnc(n1)I 1P01DXLN [1,1,0,0,0,0|2,0,0]=4 1582 B9R1.2 CSc1ccnc(n1)N 1P00856J [1,1,0,0,0,0|2,0,0]=4 1583 B9R1.2 CSc1cncc(c1)N 1P01C2IP [1,1,0,0,0,0|1,0,0]=3 1584 B9R1.2 CSc1cncc(n1)Cl 1P00EK8M [1,1,0,0,0,0|0,0,0]=2 1585 B9R1.2 CSc1cncc(n1)N 1P00D00M [1,1,0,0,0,0|0,0,0]=2 1586 B9R1.2 CSc1nc(=O)cn[nH]1 1P0022MI [1,1,0,0,0,0|1,0,0]=3 1587 B9R1.2 CSc1nc(Br)ccn1 1P00IJZN [1,1,0,0,0,0|2,0,0]=4 1588 B9R1.2 CSc1nc(Cl)ccn1 1P006YDL [1,1,0,0,0,0|2,0,0]=4 1589 B9R1.2 CSc1nc(I)ccn1 1P007C8S [1,1,0,0,0,0|2,0,0]=4 1590 B9R1.2 CSc1nc(N)ccn1 1P006ZL8 [1,1,0,0,0,0|2,0,0]=4 1591 B9R1.2 CSc1nccc(=O)[nH]1 1P003FKH [1,1,0,0,0,0|2,0,0]=4 1592 B9R1.2 CSc1nccc(n1)C 1P001CEI [1,1,0,0,0,0|2,0,0]=4 1593 B9R1.2 CSc1nncc(n1)C 1P021CKC [1,1,0,0,0,0|1,0,0]=3 1594 B9R1.2 Cc1cncc(n1)C#N 1P007N4S [1,1,0,0,0,0|2,0,0]=4 1595 B9R1.2 Cc1cncc(n1)C=C 1P007LEI [1,1,0,0,0,0|1,0,1]=4 1596 B9R1.2 Cc1cncc(n1)C=O 1P000DN6 [1,1,0,0,0,0|2,0,0]=4 1597 B9R1.2 Cc1cncc(n1)CN 1P01DX7K [1,1,0,0,0,0|2,0,0]=4 1598 B9R1.2 Cc1cncc(n1)NN 1P002C0W [1,1,0,0,0,0|2,0,0]=4 1599 B9R1.2 ClCc1cncc(n1)Cl 1P028WTI [1,1,0,0,0,0|2,0,0]=4 1600 B9R1.2 Clc1cncc(n1)C#N 1P0034TI [1,1,0,0,0,0|2,0,0]=4 1601 B9R1.2 Clc1cncc(n1)C=O 1P0036SL [1,1,0,0,0,0|2,0,0]=4 1602 B9R1.2 Fc1cncc(n1)C#N 1P00CMW6 [1,1,0,0,0,0|2,0,0]=4 1603 B9R1.2 NCc1cncc(n1)C 1P01EIII [1,1,0,0,0,0|2,0,0]=4 1604 B9R1.2 NCc1cncc(n1)Cl 1P009I1R [1,1,0,0,0,0|2,0,0]=4 1605 B9R1.2 NCc1cncc(n1)Cl 1P028WA2 [1,1,0,0,0,0|2,0,0]=4 1606 B9R1.2 NCc1cncc(n1)N 1P028EV3 [1,1,0,0,0,0|2,0,0]=4 1607 B9R1.2 NCc1cncc(n1)O 1P0293RL [1,1,0,0,0,0|2,0,0]=4 1608 B9R1.2 Nc1cncc(n1)C#N 1P00ECEI [1,1,0,0,0,0|2,0,0]=4 1609 B9R1.2 Nc1cncc(n1)CO 1P01C27B [1,1,0,0,0,0|2,0,0]=4 1610 B9R1.2 OCc1cncc(n1)Br 1P009MAH [1,1,0,0,0,0|2,0,0]=4 1611 B9R1.2 OCc1cncc(n1)Cl 1P000LYW [1,1,0,0,0,0|2,0,0]=4 1612 B9R1.6 CC(=C)c1ccccn1 1P00ELW9 [1,1,0,0,0,0|2,0,0]=4 1613 B9R1.6 CC(=C)c1cccnc1 1P00B5O7 [1,1,0,0,0,0|2,0,0]=4 1614 B9R1.6 CC(=O)c1ccccn1 1P003GS6 [1,1,0,0,0,0|2,0,0]=4 1615 B9R1.6 CC(=O)c1cccnc1 1P003JA6 [1,1,0,0,0,0|2,0,0]=4 1616 B9R1.6 CC(=O)c1cnccn1 1P003O4N [1,1,0,0,0,0|1,0,0]=3 1617 B9R1.6 CC(c1ccccn1)Br 1P005XKU [1,1,0,0,0,0|2,0,0]=4 1618 B9R1.6 CC(c1ccccn1)Br 1P019XVD [1,1,0,0,0,0|2,0,0]=4 1619 B9R1.6 CC(c1ccccn1)C 1P00E98K [1,1,0,0,0,0|2,0,0]=4 1620 B9R1.6 CC(c1ccccn1)Cl 1P00AO5F [1,1,0,0,0,0|2,0,0]=4 1621 B9R1.6 CC(c1ccccn1)N 1P0039UO [1,1,0,0,0,0|2,0,0]=4 1622 B9R1.6 CC(c1ccccn1)N 1P003DC9 [1,1,0,0,0,0|2,0,0]=4 1623 B9R1.6 CC(c1ccccn1)O 1P003F63 [1,1,0,0,0,0|2,0,0]=4 1624 B9R1.6 CC(c1cccnc1)Br 1P019XJX [1,1,0,0,0,0|2,0,0]=4 1625 B9R1.6 CC(c1cccnc1)Cl 1P0169EF [1,1,0,0,0,0|2,0,0]=4 1626 B9R1.6 CC(c1cccnc1)N 1P000HRO [1,1,0,0,0,0|2,0,0]=4 1627 B9R1.6 CC(c1cccnc1)N 1P003DEG [1,1,0,0,0,0|2,0,0]=4 1628 B9R1.6 CC(c1cccnc1)O 1P003IG7 [1,1,0,0,0,0|2,0,0]=4 1629 B9R1.6 CC(c1cnccn1)Cl 1P000Z2P [1,1,0,0,0,0|1,0,0]=3 1630 B9R1.6 CC(c1cnccn1)N 1P0027E6 [1,1,0,0,0,0|1,0,0]=3 1631 B9R1.6 CC(c1cnccn1)O 1P00IIZX [1,1,0,0,0,0|1,0,0]=3 1632 B9R1.6 CC(c1nccnc1)N 1P01EII2 [1,1,0,0,0,0|1,0,0]=3 1633 B9R1.6 CN(c1ccccn1)C 1P003BOB [1,1,0,0,0,0|2,0,0]=4 1634 B9R1.6 CN(c1ccccn1)N 1P00736N [1,1,0,0,0,0|2,0,0]=4 1635 B9R1.6 CN(c1cccnc1)C 1P0075WN [1,1,0,0,0,0|2,0,0]=4 1636 B9R1.6 CN(c1cnccn1)N 1P00G9SO [1,1,0,0,0,0|1,0,0]=3 1637 B9R1.6 CS(=O)c1ccccn1 1P006YWW [1,1,0,0,0,0|1,0,1]=4 1638 B9R1.6 C[C@@H](c1ccccn1)N 1P002VEV [1,1,0,0,0,0|2,0,0]=4 1639 B9R1.6 C[C@@H](c1ccccn1)N 1P00CJBI [1,1,0,0,0,0|2,0,0]=4 1640 B9R1.6 C[C@@H](c1ccccn1)O 1P003CZH [1,1,0,0,0,0|2,0,0]=4 1641 B9R1.6 C[C@@H](c1cccnc1)N 1P002VEU [1,1,0,0,0,0|2,0,0]=4 1642 B9R1.6 C[C@@H](c1cccnc1)N 1P00I8C2 [1,1,0,0,0,0|2,0,0]=4 1643 B9R1.6 C[C@@H](c1cccnc1)O 1P003CZF [1,1,0,0,0,0|2,0,0]=4 1644 B9R1.6 C[C@@H](c1cnccn1)O 1P01AJZA [1,1,0,0,0,0|1,0,0]=3 1645 B9R1.6 C[C@@H](c1nccnc1)N 1P01B2Z8 [1,1,0,0,0,0|1,0,0]=3 1646 B9R1.6 C[C@H](c1ccccn1)N 1P009I22 [1,1,0,0,0,0|2,0,0]=4 1647 B9R1.6 C[C@H](c1ccccn1)N 1P00DBIS [1,1,0,0,0,0|2,0,0]=4 1648 B9R1.6 C[C@H](c1ccccn1)O 1P0032W5 [1,1,0,0,0,0|2,0,0]=4 1649 B9R1.6 C[C@H](c1cccnc1)N 1P000DVB [1,1,0,0,0,0|2,0,0]=4 1650 B9R1.6 C[C@H](c1cccnc1)N 1P00CKTS [1,1,0,0,0,0|2,0,0]=4 1651 B9R1.6 C[C@H](c1cccnc1)N 1P00I8C1 [1,1,0,0,0,0|2,0,0]=4 1652 B9R1.6 C[C@H](c1cccnc1)O 1P003CNM [1,1,0,0,0,0|2,0,0]=4 1653 B9R1.6 C[C@H](c1cnccn1)N 1P000X0F [1,1,0,0,0,0|1,0,0]=3 1654 B9R1.6 C[C@H](c1cnccn1)O 1P01AJZ9 [1,1,0,0,0,0|1,0,0]=3 1655 B9R1.6 C[C@H](c1nccnc1)N 1P01C72C [1,1,0,0,0,0|1,0,0]=3 1656 B9R1.6 ClC(=O)c1cnccn1 1P002C00 [1,1,0,0,0,0|2,0,0]=4 1657 B9R1.6 NC(=N)c1cnccn1 1P00199A [1,1,0,0,0,0|2,0,0]=4 1658 B9R1.6 NC(=O)c1cnccn1 1P003UIG [1,1,0,0,0,0|2,0,0]=4 1659 B9R1.6 NC(=S)c1cnccn1 1P003UIJ [1,1,0,0,0,0|2,0,0]=4 1660 B9R1.6 OB(c1nccnc1)O 1P005S03 [1,1,0,0,0,0|2,0,0]=4 1661 B9R1.6 OC(=O)c1cnccn1 1P0033WC [1,1,0,0,0,0|2,0,0]=4 1662 B9R1.8 BrCCc1ccccn1 1P0033B6 [1,1,0,0,0,0|2,0,0]=4 1663 B9R1.8 BrCCc1cccnc1 1P00CJF9 [1,1,0,0,0,0|2,0,0]=4 1664 B9R1.8 BrCCc1cnccn1 1P01DYXQ [1,1,0,0,0,0|1,0,0]=3 1665 B9R1.8 C(c1cnccn1)C#N 1P00DJ1W [1,1,0,0,0,0|1,0,1]=4 1666 B9R1.8 CCCc1ccccn1 1P003IDJ [1,1,0,0,0,0|2,0,0]=4 1667 B9R1.8 CCCc1cccnc1 1P00DG48 [1,1,0,0,0,0|2,0,0]=4 1668 B9R1.8 CCCc1cnccn1 1P003BQC [1,1,0,0,0,0|1,0,0]=3 1669 B9R1.8 CCNc1ccccn1 1P003FIU [1,1,0,0,0,0|2,0,0]=4 1670 B9R1.8 CCNc1cccnc1 1P00CN8W [1,1,0,0,0,0|2,0,0]=4 1671 B9R1.8 CCNc1cnccn1 1P00F7WN [1,1,0,0,0,0|1,0,0]=3 1672 B9R1.8 CCOc1ccccn1 1P001L8A [1,1,0,0,0,0|1,1,0]=4 1673 B9R1.8 CCOc1cccnc1 1P00ANFG [1,1,0,0,0,0|1,1,0]=4 1674 B9R1.8 CCSc1ccccc1 1P003QX8 [1,1,0,0,0,0|2,0,0]=4 1675 B9R1.8 CCSc1ccccn1 1P002EQQ [1,1,0,0,0,0|1,0,0]=3 1676 B9R1.8 CNCc1ccccn1 1P002L6V [1,1,0,0,0,0|2,0,0]=4 1677 B9R1.8 CNCc1ccccn1 1P00H9TS [1,1,0,0,0,0|2,0,0]=4 1678 B9R1.8 CNCc1cccnc1 1P003IN0 [1,1,0,0,0,0|2,0,0]=4 1679 B9R1.8 CNCc1cccnc1 1P00JLQD [1,1,0,0,0,0|2,0,0]=4 1680 B9R1.8 CNCc1cnccn1 1P0081AR [1,1,0,0,0,0|1,0,0]=3 1681 B9R1.8 COCc1ccccn1 1P002O7L [1,1,0,0,0,0|1,1,0]=4 1682 B9R1.8 CSCc1ccccc1 1P003OL2 [1,1,0,0,0,0|2,0,0]=4 1683 B9R1.8 CSCc1ccccn1 1P00K0NO [1,1,0,0,0,0|1,0,0]=3 1684 B9R1.8 CSCc1cccnc1 1P01DX2J [1,1,0,0,0,0|1,0,0]=3 1685 B9R1.8 C\C=C\c1cnccn1 1P027XHC [1,1,0,0,0,0|1,0,0]=3 1686 B9R1.8 ClCCc1ccccn1 1P00AQES [1,1,0,0,0,0|2,0,0]=4 1687 B9R1.8 ClCCc1ccccn1 1P00CB7K [1,1,0,0,0,0|2,0,0]=4 1688 B9R1.8 ClCCc1cccnc1 1P00CLVG [1,1,0,0,0,0|2,0,0]=4 1689 B9R1.8 ClCSc1ccccc1 1P003PAU [1,1,0,0,0,0|2,0,0]=4 1690 B9R1.8 ICCc1cccnc1 1P01APKH [1,1,0,0,0,0|2,0,0]=4 1691 B9R1.8 NCCc1ccccn1 1P0033BC [1,1,0,0,0,0|2,0,0]=4 1692 B9R1.8 NCCc1cccnc1 1P0031LS [1,1,0,0,0,0|2,0,0]=4 1693 B9R1.8 NCCc1cccnc1 1P007RI3 [1,1,0,0,0,0|2,0,0]=4 1694 B9R1.8 NCCc1cccnc1 1P00G4HF [1,1,0,0,0,0|2,0,0]=4 1695 B9R1.8 NCCc1cnccn1 1P00D8UG [1,1,0,0,0,0|1,0,0]=3 1696 B9R1.8 NCCc1cnccn1 1P00HZ0H [1,1,0,0,0,0|1,0,0]=3 1697 B9R1.8 NNCc1cnccn1 1P0080ZM [1,1,0,0,0,0|2,0,0]=4 1698 B9R1.8 NNCc1cnccn1 1P00H0K1 [1,1,0,0,0,0|2,0,0]=4 1699 B9R1.8 OCCc1ccccn1 1P0038HY [1,1,0,0,0,0|2,0,0]=4 1700 B9R1.8 OCCc1cccnc1 1P003FB1 [1,1,0,0,0,0|2,0,0]=4 1701 B9R1.8 OCCc1cnccn1 1P003F8L [1,1,0,0,0,0|1,0,0]=3 1702 B9R1.8 ON=Cc1cnccn1 1P028X05 [1,1,0,0,0,0|2,0,0]=4 1703 B9R1.8 SCCc1ccccn1 1P0029Y7 [1,1,0,0,0,0|2,0,0]=4 1704 B9R1.8 SCCc1cnccn1 1P003C4B [1,1,0,0,0,0|1,0,0]=3 1705 B9R1.8 [O-]\N=N\c1cnccn1 1P0284KV [1,1,0,0,0,0|2,0,0]=4 1706 B9R1.3 Brc1c(C)ccnc1C 1P00386X [1,1,0,0,0,0|2,0,0]=4 1707 B9R1.3 Brc1ccnc(c1C)Cl 1P000Y6W [1,1,0,0,0,0|2,0,0]=4 1708 B9R1.3 Brc1ccnc(c1C)F 1P000Y6Y [1,1,0,0,0,0|2,0,0]=4 1709 B9R1.3 Brc1ccnc(c1C)N 1P000JT5 [1,1,0,0,0,0|2,0,0]=4 1710 B9R1.3 Brc1ccnc(c1Cl)C 1P01FM2S [1,1,0,0,0,0|2,0,0]=4 1711 B9R1.3 Brc1ccnc(c1F)C 1P009I34 [1,1,0,0,0,0|2,0,0]=4 1712 B9R1.3 Brc1ccnc(c1N)C 1P000T16 [1,1,0,0,0,0|2,0,0]=4 1713 B9R1.3 Cc1c(=O)cc[nH]c1C 1P01BBX5 [1,1,0,0,0,0|1,0,1]=4 1714 B9R1.3 Cc1c(Br)ccnc1Br 1P000Y6U [1,1,0,0,0,0|2,0,0]=4 1715 B9R1.3 Cc1c(Br)ccnc1C 1P002RRG [1,1,0,0,0,0|1,0,0]=3 1716 B9R1.3 Cc1c(Br)ccnc1C 1P01EI7S [1,1,0,0,0,0|1,0,0]=3 1717 B9R1.3 Cc1c(C)cccc1Br 1P0033EW [1,1,0,0,0,0|2,0,0]=4 1718 B9R1.3 Cc1c(C)cccc1C 1P003DRG [1,1,0,0,0,0|2,0,0]=4 1719 B9R1.3 Cc1c(C)cccc1Cl 1P003JMR [1,1,0,0,0,0|2,0,0]=4 1720 B9R1.3 Cc1c(C)cccc1Cl 1P028GZ4 [1,1,0,0,0,0|2,0,0]=4 1721 B9R1.3 Cc1c(C)cccc1F 1P003JY3 [1,1,0,0,0,0|2,0,0]=4 1722 B9R1.3 Cc1c(C)cccc1I 1P003EW5 [1,1,0,0,0,0|2,0,0]=4 1723 B9R1.3 Cc1c(C)cccc1N 1P0033EU [1,1,0,0,0,0|2,0,0]=4 1724 B9R1.3 Cc1c(C)cccc1N 1P003G0V [1,1,0,0,0,0|2,0,0]=4 1725 B9R1.3 Cc1c(C)cccc1O 1P000UCK [1,1,0,0,0,0|2,0,0]=4 1726 B9R1.3 Cc1c(C)cccc1S 1P002H3Y [1,1,0,0,0,0|2,0,0]=4 1727 B9R1.3 Cc1c(C)ccnc1Br 1P00CJBW [1,1,0,0,0,0|2,0,0]=4 1728 B9R1.3 Cc1c(C)ccnc1Cl 1P00FFVC [1,1,0,0,0,0|2,0,0]=4 1729 B9R1.3 Cc1c(C)ncnc1Cl 1P003LM8 [1,1,0,0,0,0|2,0,0]=4 1730 B9R1.3 Cc1c(C)ncnc1N 1P00DDMJ [1,1,0,0,0,0|2,0,0]=4 1731 B9R1.3 Cc1c(C)ncnc1O 1P00C5RZ [1,1,0,0,0,0|2,0,0]=4 1732 B9R1.3 Cc1c(Cl)ccnc1C 1P00D4T4 [1,1,0,0,0,0|1,0,0]=3 1733 B9R1.3 Cc1c(Cl)ccnc1Cl 1P0010NB [1,1,0,0,0,0|2,0,0]=4 1734 B9R1.3 Cc1c(F)cccc1S 1P01FFLY [1,1,0,0,0,0|2,0,0]=4 1735 B9R1.3 Cc1c(F)ccnc1F 1P01K02Y [1,1,0,0,0,0|2,0,0]=4 1736 B9R1.3 Cc1c(N)ccnc1C 1P0017RO [1,1,0,0,0,0|1,0,0]=3 1737 B9R1.3 Cc1c(O)ccnc1C 1P01ENHN [1,1,0,0,0,0|1,0,0]=3 1738 B9R1.3 Cc1c(S)cccc1Cl 1P01BL0W [1,1,0,0,0,0|2,0,0]=4 1739 B9R1.3 Cc1cccc(c1S)C 1P003GM7 [1,1,0,0,0,0|2,0,0]=4 1740 B9R1.3 Clc1c(Cl)ccnc1C 1P008UGI [1,1,0,0,0,0|2,0,0]=4 1741 B9R1.3 Clc1ccnc(c1Br)C 1P01BJR8 [1,1,0,0,0,0|2,0,0]=4 1742 B9R1.3 Clc1ccnc(c1C)Br 1P00ILFZ [1,1,0,0,0,0|2,0,0]=4 1743 B9R1.3 Clc1ccnc(c1C)N 1P000JTR [1,1,0,0,0,0|2,0,0]=4 1744 B9R1.3 Clc1ccnc(c1F)C 1P000JE6 [1,1,0,0,0,0|2,0,0]=4 1745 B9R1.3 Clc1ccnc(c1I)C 1P01ALOD [1,1,0,0,0,0|2,0,0]=4 1746 B9R1.3 Clc1ccnc(c1N)C 1P0096BN [1,1,0,0,0,0|2,0,0]=4 1747 B9R1.3 Fc1ccnc(c1Br)C 1P01BEDI [1,1,0,0,0,0|2,0,0]=4 1748 B9R1.3 Fc1ccnc(c1C)Br 1P021VQV [1,1,0,0,0,0|2,0,0]=4 1749 B9R1.3 Fc1ccnc(c1C)Cl 1P01E6LF [1,1,0,0,0,0|2,0,0]=4 1750 B9R1.3 Fc1ccnc(c1C)N 1P000JT0 [1,1,0,0,0,0|2,0,0]=4 1751 B9R1.3 Fc1ccnc(c1C)N 1P0286LJ [1,1,0,0,0,0|2,0,0]=4 1752 B9R1.3 Fc1ccnc(c1C)O 1P0283BG [1,1,0,0,0,0|1,1,0]=4 1753 B9R1.3 Fc1ccnc(c1Cl)C 1P0291V6 [1,1,0,0,0,0|2,0,0]=4 1754 B9R1.3 Ic1c(C)ccnc1C 1P028SAB [1,1,0,0,0,0|2,0,0]=4 1755 B9R1.3 Ic1ccnc(c1C)Cl 1P00AP1E [1,1,0,0,0,0|2,0,0]=4 1756 B9R1.3 Ic1ccnc(c1C)F 1P0036IU [1,1,0,0,0,0|2,0,0]=4 1757 B9R1.3 Ic1ccnc(c1C)N 1P00HHE2 [1,1,0,0,0,0|2,0,0]=4 1758 B9R1.3 Ic1ccnc(c1Cl)C 1P01A5ZY [1,1,0,0,0,0|2,0,0]=4 1759 B9R1.3 Nc1c(C)ccnc1C 1P0085CQ [1,1,0,0,0,0|2,0,0]=4 1760 B9R1.3 Nc1c(N)ccnc1C 1P001R2S [1,1,0,0,0,0|2,0,0]=4 1761 B9R1.3 Nc1ccnc(c1Br)C 1P00IKGJ [1,1,0,0,0,0|2,0,0]=4 1762 B9R1.3 Nc1ccnc(c1C)Br 1P005CTD [1,1,0,0,0,0|2,0,0]=4 1763 B9R1.3 Nc1ccnc(c1C)Cl 1P005CTC [1,1,0,0,0,0|2,0,0]=4 1764 B9R1.3 Nc1ccnc(c1C)F 1P001BAI [1,1,0,0,0,0|2,0,0]=4 1765 B9R1.3 Nc1ccnc(c1Cl)C 1P006B0Z [1,1,0,0,0,0|2,0,0]=4 1766 B9R1.3 Nc1ccnc(c1F)C 1P001R2R [1,1,0,0,0,0|2,0,0]=4 1767 B9R1.3 Nc1ccnc(c1I)C 1P00G65M [1,1,0,0,0,0|2,0,0]=4 1768 B9R1.3 Oc1c(O)ccnc1C 1P00CKMV [1,1,0,0,0,0|1,1,0]=4 1769 B9R1.3 Oc1ccnc(c1C)Br 1P01BBWO [1,1,0,0,0,0|2,0,0]=4 1770 B9R1.3 Oc1ccnc(c1C)N 1P028IKC [1,1,0,0,0,0|2,0,0]=4 1771 B9R1.3 Oc1ccnc(c1Cl)C 1P01C8JM [1,1,0,0,0,0|2,0,0]=4 1772 B9R1.3 Oc1ccnc(c1N)C 1P028QPS [1,1,0,0,0,0|2,0,0]=4 1773 B9R1.3 Sc1c(C)cccc1Cl 1P002HHE [1,1,0,0,0,0|2,0,0]=4 1774 B9R1.3 Sc1c(C)cccc1F 1P01FFLZ [1,1,0,0,0,0|2,0,0]=4 1775 B9R1.3 Sc1c(C)cccc1N 1P01B6VH [1,1,0,0,0,0|2,0,0]=4 1776 B9R1.3 Sc1ccnc(c1Cl)C 1P028YNR [1,1,0,0,0,0|2,0,0]=4 1777 B9R1.69 Brc1ccc(c(c1)C)C 1P003828 [1,1,0,0,0,0|2,0,0]=4 1778 B9R1.69 Brc1ccc(c(c1)C)S 1P01B9DG [1,1,0,0,0,0|2,0,0]=4 1779 B9R1.69 Brc1ccc(c(c1)S)C 1P01BL10 [1,1,0,0,0,0|2,0,0]=4 1780 B9R1.69 Brc1ccc(c(n1)Br)C 1P00H1GW [1,1,0,0,0,0|2,0,0]=4 1781 B9R1.69 Brc1ccc(c(n1)C)Br 1P003J6T [1,1,0,0,0,0|2,0,0]=4 1782 B9R1.69 Brc1ccc(c(n1)C)C 1P00IKOZ [1,1,0,0,0,0|1,0,0]=3 1783 B9R1.69 Brc1ccc(c(n1)C)Cl 1P005XXB [1,1,0,0,0,0|2,0,0]=4 1784 B9R1.69 Brc1ccc(c(n1)C)F 1P00I7U7 [1,1,0,0,0,0|2,0,0]=4 1785 B9R1.69 Brc1ccc(c(n1)C)N 1P000T17 [1,1,0,0,0,0|2,0,0]=4 1786 B9R1.69 Brc1ccc(c(n1)C)O 1P008YA4 [1,1,0,0,0,0|1,1,0]=4 1787 B9R1.69 Brc1ccc(c(n1)Cl)C 1P00K7SM [1,1,0,0,0,0|2,0,0]=4 1788 B9R1.69 Brc1ccc(c(n1)F)C 1P01BG32 [1,1,0,0,0,0|2,0,0]=4 1789 B9R1.69 Brc1ccc(c(n1)N)C 1P003AHY [1,1,0,0,0,0|2,0,0]=4 1790 B9R1.69 Brc1ccc(c(n1)O)C 1P01UOVT [1,1,0,0,0,0|1,1,0]=4 1791 B9R1.69 Brc1cnc(c(c1)Br)C 1P00I859 [1,1,0,0,0,0|2,0,0]=4 1792 B9R1.69 Brc1cnc(c(c1)C)Br 1P003GDD [1,1,0,0,0,0|2,0,0]=4 1793 B9R1.69 Brc1cnc(c(c1)C)C 1P0038LA [1,1,0,0,0,0|1,0,0]=3 1794 B9R1.69 Brc1cnc(c(c1)C)Cl 1P002Y9Z [1,1,0,0,0,0|2,0,0]=4 1795 B9R1.69 Brc1cnc(c(c1)C)F 1P002YIG [1,1,0,0,0,0|2,0,0]=4 1796 B9R1.69 Brc1cnc(c(c1)C)I 1P00I7VP [1,1,0,0,0,0|2,0,0]=4 1797 B9R1.69 Brc1cnc(c(c1)C)N 1P0033K5 [1,1,0,0,0,0|2,0,0]=4 1798 B9R1.69 Brc1cnc(c(c1)Cl)C 1P003MYU [1,1,0,0,0,0|2,0,0]=4 1799 B9R1.69 Brc1cnc(c(c1)F)C 1P000CJ4 [1,1,0,0,0,0|2,0,0]=4 1800 B9R1.69 Brc1cnc(c(c1)I)C 1P01Q51J [1,1,0,0,0,0|2,0,0]=4 1801 B9R1.69 Brc1cnc(c(c1)N)C 1P0034OF [1,1,0,0,0,0|2,0,0]=4 1802 B9R1.69 Brc1cnc(c(c1)O)C 1P00H1EF [1,1,0,0,0,0|1,1,0]=4 1803 B9R1.69 Brc1cnc(c(n1)Br)Cl 1P0084BN [1,1,0,0,0,0|2,0,0]=4 1804 B9R1.69 Brc1cnc(c(n1)Br)I 1P01RHJR [1,1,0,0,0,0|2,0,0]=4 1805 B9R1.69 Brc1cnc(c(n1)Br)N 1P0033JK [1,1,0,0,0,0|2,0,0]=4 1806 B9R1.69 Brc1cnc(c(n1)C)Br 1P000RHH [1,1,0,0,0,0|1,0,0]=3 1807 B9R1.69 Brc1cnc(c(n1)C)C 1P007B11 [1,1,0,0,0,0|0,0,0]=2 1808 B9R1.69 Brc1cnc(c(n1)C)Cl 1P003AIP [1,1,0,0,0,0|1,0,0]=3 1809 B9R1.69 Brc1cnc(c(n1)C)I 1P01XFIW [1,1,0,0,0,0|1,0,0]=3 1810 B9R1.69 Brc1cnc(c(n1)C)N 1P005MZ2 [1,1,0,0,0,0|1,0,0]=3 1811 B9R1.69 Brc1cnc(c(n1)Cl)Br 1P003AIQ [1,1,0,0,0,0|2,0,0]=4 1812 B9R1.69 Brc1cnc(c(n1)Cl)N 1P006YX6 [1,1,0,0,0,0|2,0,0]=4 1813 B9R1.69 Brc1cnc(c(n1)F)Cl 1P020JGW [1,1,0,0,0,0|2,0,0]=4 1814 B9R1.69 Brc1cnc(c(n1)F)N 1P0280IY [1,1,0,0,0,0|2,0,0]=4 1815 B9R1.69 Brc1cnc(c(n1)I)N 1P00HB9E [1,1,0,0,0,0|2,0,0]=4 1816 B9R1.69 Brc1cnc(c(n1)I)O 1P027YQR [1,1,0,0,0,0|1,1,0]=4 1817 B9R1.69 Brc1cnc(c(n1)N)Br 1P00IJVF [1,1,0,0,0,0|2,0,0]=4 1818 B9R1.69 Brc1cnc(c(n1)N)Cl 1P007DJN [1,1,0,0,0,0|2,0,0]=4 1819 B9R1.69 Brc1cnc(c(n1)N)N 1P003FX9 [1,1,0,0,0,0|2,0,0]=4 1820 B9R1.69 Brc1nnc(c(c1)C)C 1P01DVZL [1,1,0,0,0,0|2,0,0]=4 1821 B9R1.69 Cc1c(C)ccc(=O)[nH]1 1P007MBC [1,1,0,0,0,0|1,0,1]=4 1822 B9R1.69 Cc1c(C)ncc(=O)[nH]1 1P00ELSX [1,1,0,0,0,0|0,0,1]=3 1823 B9R1.69 Cc1cc(=O)[nH]nc1C 1P0001FV [1,1,0,0,0,0|2,0,0]=4 1824 B9R1.69 Cc1ccc(c(c1)C)C 1P003DRZ [1,1,0,0,0,0|2,0,0]=4 1825 B9R1.69 Cc1ccc(c(c1)C)S 1P0033GE [1,1,0,0,0,0|2,0,0]=4 1826 B9R1.69 Cc1ccc(c(c1)S)C 1P003GGD [1,1,0,0,0,0|2,0,0]=4 1827 B9R1.69 Cc1ccc(c(n1)Br)C 1P00I85A [1,1,0,0,0,0|2,0,0]=4 1828 B9R1.69 Cc1ccc(c(n1)C)Br 1P00399L [1,1,0,0,0,0|2,0,0]=4 1829 B9R1.69 Cc1ccc(c(n1)C)N 1P00C05N [1,1,0,0,0,0|2,0,0]=4 1830 B9R1.69 Cc1ccc(c(n1)C)O 1P003GM4 [1,1,0,0,0,0|1,1,0]=4 1831 B9R1.69 Cc1ccc(c(n1)Cl)C 1P00FFTD [1,1,0,0,0,0|2,0,0]=4 1832 B9R1.69 Cc1ccc(c(n1)N)C 1P0036XS [1,1,0,0,0,0|2,0,0]=4 1833 B9R1.69 Cc1ccc(c(n1)S)Br 1P027WKI [1,1,0,0,0,0|2,0,0]=4 1834 B9R1.69 Cc1cnc(c(=O)[nH]1)C 1P001TZO [1,1,0,0,0,0|0,1,1]=4 1835 B9R1.69 Cc1cnc(c(c1)Br)C 1P00ACIW [1,1,0,0,0,0|2,0,0]=4 1836 B9R1.69 Cc1cnc(c(c1)C)Br 1P003H37 [1,1,0,0,0,0|2,0,0]=4 1837 B9R1.69 Cc1cnc(c(c1)C)C 1P0033DW [1,1,0,0,0,0|1,0,0]=3 1838 B9R1.69 Cc1cnc(c(c1)C)Cl 1P00FCS9 [1,1,0,0,0,0|2,0,0]=4 1839 B9R1.69 Cc1cnc(c(c1)C)F 1P008YA5 [1,1,0,0,0,0|2,0,0]=4 1840 B9R1.69 Cc1cnc(c(c1)C)I 1P00721G [1,1,0,0,0,0|2,0,0]=4 1841 B9R1.69 Cc1cnc(c(c1)C)N 1P0033JL [1,1,0,0,0,0|2,0,0]=4 1842 B9R1.69 Cc1cnc(c(c1)C)N 1P00J2ZQ [1,1,0,0,0,0|2,0,0]=4 1843 B9R1.69 Cc1cnc(c(c1)N)C 1P00H4Y1 [1,1,0,0,0,0|2,0,0]=4 1844 B9R1.69 Cc1cnc(c(c1)N)C 1P028GXB [1,1,0,0,0,0|2,0,0]=4 1845 B9R1.69 Cc1cnc(c(c1)O)C 1P00AKXZ [1,1,0,0,0,0|1,1,0]=4 1846 B9R1.69 Cc1cnc(c(n1)Br)Cl 1P009G5P [1,1,0,0,0,0|2,0,0]=4 1847 B9R1.69 Cc1cnc(c(n1)Br)N 1P005MZ3 [1,1,0,0,0,0|2,0,0]=4 1848 B9R1.69 Cc1cnc(c(n1)C)C 1P001EOP [1,1,0,0,0,0|0,0,0]=2 1849 B9R1.69 Cc1cnc(c(n1)C)Cl 1P00BZZ5 [1,1,0,0,0,0|1,0,0]=3 1850 B9R1.69 Cc1cnc(c(n1)C)I 1P01K0L4 [1,1,0,0,0,0|1,0,0]=3 1851 B9R1.69 Cc1cnc(c(n1)C)N 1P006EXC [1,1,0,0,0,0|1,0,0]=3 1852 B9R1.69 Cc1cnc(c(n1)C)O 1P0036KJ [1,1,0,0,0,0|0,1,0]=3 1853 B9R1.69 Cc1cnc(c(n1)Cl)C 1P003JN7 [1,1,0,0,0,0|1,0,0]=3 1854 B9R1.69 Cc1cnc(c(n1)Cl)Cl 1P00CLNW [1,1,0,0,0,0|2,0,0]=4 1855 B9R1.69 Cc1cnc(c(n1)Cl)N 1P003WUL [1,1,0,0,0,0|2,0,0]=4 1856 B9R1.69 Cc1cnc(c(n1)F)C 1P01BTXX [1,1,0,0,0,0|1,0,0]=3 1857 B9R1.69 Cc1cnc(c(n1)I)C 1P00EIVT [1,1,0,0,0,0|1,0,0]=3 1858 B9R1.69 Cc1cnc(c(n1)N)Br 1P01FM51 [1,1,0,0,0,0|2,0,0]=4 1859 B9R1.69 Cc1cnc(c(n1)N)C 1P000WG0 [1,1,0,0,0,0|1,0,0]=3 1860 B9R1.69 Cc1cnc(c(n1)N)Cl 1P00H1H9 [1,1,0,0,0,0|2,0,0]=4 1861 B9R1.69 Cc1cnc(c(n1)N)N 1P00I6MA [1,1,0,0,0,0|2,0,0]=4 1862 B9R1.69 Cc1nc(Br)c[nH]c1=O 1P000159 [1,1,0,0,0,0|0,1,1]=4 1863 B9R1.69 Cc1nc(Cl)c[nH]c1=O 1P00853S [1,1,0,0,0,0|0,1,1]=4 1864 B9R1.69 Clc1ccc(c(c1)C)C 1P003LIM [1,1,0,0,0,0|2,0,0]=4 1865 B9R1.69 Clc1ccc(c(c1)C)S 1P007E8J [1,1,0,0,0,0|2,0,0]=4 1866 B9R1.69 Clc1ccc(c(c1)S)C 1P002HHD [1,1,0,0,0,0|2,0,0]=4 1867 B9R1.69 Clc1ccc(c(n1)Br)C 1P004T0Y [1,1,0,0,0,0|2,0,0]=4 1868 B9R1.69 Clc1ccc(c(n1)C)Br 1P0011CN [1,1,0,0,0,0|2,0,0]=4 1869 B9R1.69 Clc1ccc(c(n1)C)C 1P005KP3 [1,1,0,0,0,0|1,0,0]=3 1870 B9R1.69 Clc1ccc(c(n1)C)Cl 1P000KQ1 [1,1,0,0,0,0|2,0,0]=4 1871 B9R1.69 Clc1ccc(c(n1)C)F 1P003HF6 [1,1,0,0,0,0|2,0,0]=4 1872 B9R1.69 Clc1ccc(c(n1)C)I 1P002QDI [1,1,0,0,0,0|2,0,0]=4 1873 B9R1.69 Clc1ccc(c(n1)C)N 1P001VHT [1,1,0,0,0,0|2,0,0]=4 1874 B9R1.69 Clc1ccc(c(n1)C)O 1P00BIJ9 [1,1,0,0,0,0|1,1,0]=4 1875 B9R1.69 Clc1ccc(c(n1)Cl)C 1P00EC41 [1,1,0,0,0,0|2,0,0]=4 1876 B9R1.69 Clc1ccc(c(n1)Cl)S 1P028CPK [1,1,0,0,0,0|2,0,0]=4 1877 B9R1.69 Clc1ccc(c(n1)N)C 1P00E6FO [1,1,0,0,0,0|2,0,0]=4 1878 B9R1.69 Clc1ccc(c(n1)N)C 1P027U9E [1,1,0,0,0,0|2,0,0]=4 1879 B9R1.69 Clc1cnc(c(c1)Br)C 1P000VTY [1,1,0,0,0,0|2,0,0]=4 1880 B9R1.69 Clc1cnc(c(c1)C)Br 1P00390W [1,1,0,0,0,0|2,0,0]=4 1881 B9R1.69 Clc1cnc(c(c1)C)Cl 1P00IB2K [1,1,0,0,0,0|2,0,0]=4 1882 B9R1.69 Clc1cnc(c(c1)C)F 1P00I7UY [1,1,0,0,0,0|2,0,0]=4 1883 B9R1.69 Clc1cnc(c(c1)C)N 1P002JC3 [1,1,0,0,0,0|2,0,0]=4 1884 B9R1.69 Clc1cnc(c(c1)C)O 1P00E9D5 [1,1,0,0,0,0|1,1,0]=4 1885 B9R1.69 Clc1cnc(c(c1)N)C 1P005OTL [1,1,0,0,0,0|2,0,0]=4 1886 B9R1.69 Clc1cnc(c(n1)Br)N 1P00375A [1,1,0,0,0,0|2,0,0]=4 1887 B9R1.69 Clc1cnc(c(n1)C)Br 1P000RHB [1,1,0,0,0,0|1,0,0]=3 1888 B9R1.69 Clc1cnc(c(n1)C)C 1P00EITX [1,1,0,0,0,0|0,0,0]=2 1889 B9R1.69 Clc1cnc(c(n1)C)Cl 1P0097YM [1,1,0,0,0,0|1,0,0]=3 1890 B9R1.69 Clc1cnc(c(n1)C)I 1P021NB0 [1,1,0,0,0,0|1,0,0]=3 1891 B9R1.69 Clc1cnc(c(n1)C)N 1P0001F6 [1,1,0,0,0,0|1,0,0]=3 1892 B9R1.69 Clc1cnc(c(n1)Cl)Br 1P003ARW [1,1,0,0,0,0|2,0,0]=4 1893 B9R1.69 Clc1cnc(c(n1)Cl)C 1P00GVAK [1,1,0,0,0,0|1,0,0]=3 1894 B9R1.69 Clc1cnc(c(n1)Cl)Cl 1P004I4S [1,1,0,0,0,0|2,0,0]=4 1895 B9R1.69 Clc1cnc(c(n1)Cl)I 1P0012YX [1,1,0,0,0,0|2,0,0]=4 1896 B9R1.69 Clc1cnc(c(n1)Cl)N 1P008EPM [1,1,0,0,0,0|2,0,0]=4 1897 B9R1.69 Clc1cnc(c(n1)I)N 1P002433 [1,1,0,0,0,0|2,0,0]=4 1898 B9R1.69 Clc1cnc(c(n1)N)Br 1P003GU0 [1,1,0,0,0,0|2,0,0]=4 1899 B9R1.69 Clc1cnc(c(n1)N)Cl 1P001J6U [1,1,0,0,0,0|2,0,0]=4 1900 B9R1.69 Clc1cnc(c(n1)N)I 1P01KXGQ [1,1,0,0,0,0|2,0,0]=4 1901 B9R1.69 Clc1cnc(c(n1)N)N 1P000R1U [1,1,0,0,0,0|2,0,0]=4 1902 B9R1.69 Clc1ncc(c(n1)C)C 1P00C7EL [1,1,0,0,0,0|2,0,0]=4 1903 B9R1.69 Clc1nnc(c(c1)C)C 1P004LI2 [1,1,0,0,0,0|2,0,0]=4 1904 B9R1.69 Clc1nnc(c(n1)C)C 1P00D841 [1,1,0,0,0,0|1,0,0]=3 1905 B9R1.69 Clc1nnc(c(n1)C)Cl 1P01BBUR [1,1,0,0,0,0|2,0,0]=4 1906 B9R1.69 Fc1ccc(c(c1)C)C 1P003BGN [1,1,0,0,0,0|2,0,0]=4 1907 B9R1.69 Fc1ccc(c(c1)C)S 1P00G4HY [1,1,0,0,0,0|2,0,0]=4 1908 B9R1.69 Fc1ccc(c(c1)S)C 1P00G54K [1,1,0,0,0,0|2,0,0]=4 1909 B9R1.69 Fc1ccc(c(n1)Br)C 1P009YRR [1,1,0,0,0,0|2,0,0]=4 1910 B9R1.69 Fc1ccc(c(n1)C)Br 1P003MXP [1,1,0,0,0,0|2,0,0]=4 1911 B9R1.69 Fc1ccc(c(n1)C)C 1P01DO3Y [1,1,0,0,0,0|1,0,0]=3 1912 B9R1.69 Fc1ccc(c(n1)C)Cl 1P009Y0C [1,1,0,0,0,0|2,0,0]=4 1913 B9R1.69 Fc1ccc(c(n1)C)F 1P0280A1 [1,1,0,0,0,0|2,0,0]=4 1914 B9R1.69 Fc1ccc(c(n1)C)I 1P008D3X [1,1,0,0,0,0|2,0,0]=4 1915 B9R1.69 Fc1ccc(c(n1)C)N 1P002VYJ [1,1,0,0,0,0|2,0,0]=4 1916 B9R1.69 Fc1ccc(c(n1)C)O 1P009FMV [1,1,0,0,0,0|1,1,0]=4 1917 B9R1.69 Fc1ccc(c(n1)F)C 1P00F2CA [1,1,0,0,0,0|2,0,0]=4 1918 B9R1.69 Fc1ccc(c(n1)F)S 1P02829V [1,1,0,0,0,0|2,0,0]=4 1919 B9R1.69 Fc1ccc(c(n1)N)C 1P020MKO [1,1,0,0,0,0|2,0,0]=4 1920 B9R1.69 Fc1cnc(c(c1)Br)C 1P00A633 [1,1,0,0,0,0|2,0,0]=4 1921 B9R1.69 Fc1cnc(c(c1)C)Br 1P00C7KG [1,1,0,0,0,0|2,0,0]=4 1922 B9R1.69 Fc1cnc(c(c1)C)Cl 1P0033OY [1,1,0,0,0,0|2,0,0]=4 1923 B9R1.69 Fc1cnc(c(c1)C)N 1P0036RB [1,1,0,0,0,0|2,0,0]=4 1924 B9R1.69 Fc1cnc(c(c1)N)C 1P01TAO5 [1,1,0,0,0,0|2,0,0]=4 1925 B9R1.69 Ic1ccc(c(c1)C)C 1P00I6GA [1,1,0,0,0,0|2,0,0]=4 1926 B9R1.69 Ic1ccc(c(n1)C)Br 1P0003GB [1,1,0,0,0,0|2,0,0]=4 1927 B9R1.69 Ic1ccc(c(n1)C)O 1P008GDW [1,1,0,0,0,0|1,1,0]=4 1928 B9R1.69 Ic1cnc(c(c1)C)Br 1P006RYD [1,1,0,0,0,0|2,0,0]=4 1929 B9R1.69 Ic1cnc(c(c1)C)C 1P01AV0U [1,1,0,0,0,0|1,0,0]=3 1930 B9R1.69 Ic1cnc(c(c1)C)Cl 1P00EBVH [1,1,0,0,0,0|2,0,0]=4 1931 B9R1.69 Ic1cnc(c(c1)C)F 1P002AES [1,1,0,0,0,0|2,0,0]=4 1932 B9R1.69 Ic1cnc(c(c1)C)N 1P00HZM4 [1,1,0,0,0,0|2,0,0]=4 1933 B9R1.69 Ic1cnc(c(n1)Br)N 1P001KSL [1,1,0,0,0,0|2,0,0]=4 1934 B9R1.69 Ic1cnc(c(n1)Br)O 1P028IRO [1,1,0,0,0,0|1,1,0]=4 1935 B9R1.69 Ic1cnc(c(n1)C)Cl 1P020JGK [1,1,0,0,0,0|1,0,0]=3 1936 B9R1.69 Ic1cnc(c(n1)C)N 1P006BIA [1,1,0,0,0,0|1,0,0]=3 1937 B9R1.69 Ic1cnc(c(n1)Cl)Cl 1P01V754 [1,1,0,0,0,0|2,0,0]=4 1938 B9R1.69 Ic1cnc(c(n1)Cl)N 1P000NVC [1,1,0,0,0,0|2,0,0]=4 1939 B9R1.69 Nc1ccc(c(c1)C)C 1P003766 [1,1,0,0,0,0|2,0,0]=4 1940 B9R1.69 Nc1ccc(c(c1)C)C 1P00FQ4P [1,1,0,0,0,0|2,0,0]=4 1941 B9R1.69 Nc1ccc(c(c1)S)C 1P019TVV [1,1,0,0,0,0|2,0,0]=4 1942 B9R1.69 Nc1ccc(c(n1)Br)C 1P00H1FJ [1,1,0,0,0,0|2,0,0]=4 1943 B9R1.69 Nc1ccc(c(n1)C)Br 1P003NJ5 [1,1,0,0,0,0|2,0,0]=4 1944 B9R1.69 Nc1ccc(c(n1)C)C 1P00ED1Z [1,1,0,0,0,0|1,0,0]=3 1945 B9R1.69 Nc1ccc(c(n1)C)Cl 1P003N50 [1,1,0,0,0,0|2,0,0]=4 1946 B9R1.69 Nc1ccc(c(n1)C)F 1P003A3H [1,1,0,0,0,0|2,0,0]=4 1947 B9R1.69 Nc1ccc(c(n1)C)I 1P003NJ8 [1,1,0,0,0,0|2,0,0]=4 1948 B9R1.69 Nc1ccc(c(n1)C)N 1P005TIA [1,1,0,0,0,0|2,0,0]=4 1949 B9R1.69 Nc1ccc(c(n1)C)O 1P01UNYV [1,1,0,0,0,0|1,1,0]=4 1950 B9R1.69 Nc1ccc(c(n1)Cl)C 1P00DI4N [1,1,0,0,0,0|2,0,0]=4 1951 B9R1.69 Nc1cnc(c(c1)Br)C 1P00AQ03 [1,1,0,0,0,0|2,0,0]=4 1952 B9R1.69 Nc1cnc(c(c1)C)Br 1P00BXUH [1,1,0,0,0,0|2,0,0]=4 1953 B9R1.69 Nc1cnc(c(c1)C)C 1P0037G9 [1,1,0,0,0,0|1,0,0]=3 1954 B9R1.69 Nc1cnc(c(c1)C)Cl 1P003HCJ [1,1,0,0,0,0|2,0,0]=4 1955 B9R1.69 Nc1cnc(c(c1)C)F 1P00AOW6 [1,1,0,0,0,0|2,0,0]=4 1956 B9R1.69 Nc1cnc(c(c1)Cl)C 1P00H0M7 [1,1,0,0,0,0|2,0,0]=4 1957 B9R1.69 Nc1cnc(c(c1)F)C 1P01KLJ1 [1,1,0,0,0,0|2,0,0]=4 1958 B9R1.69 Nc1cnc(c(n1)Br)Br 1P00AB2X [1,1,0,0,0,0|2,0,0]=4 1959 B9R1.69 Nc1cnc(c(n1)Br)C 1P005YMW [1,1,0,0,0,0|1,0,0]=3 1960 B9R1.69 Nc1cnc(c(n1)C)Br 1P008R4C [1,1,0,0,0,0|1,0,0]=3 1961 B9R1.69 Nc1cnc(c(n1)C)C 1P00391P [1,1,0,0,0,0|0,0,0]=2 1962 B9R1.69 Nc1cnc(c(n1)C)Cl 1P00DAKK [1,1,0,0,0,0|1,0,0]=3 1963 B9R1.69 Nc1cnc(c(n1)Cl)Br 1P001Z73 [1,1,0,0,0,0|2,0,0]=4 1964 B9R1.69 Nc1cnc(c(n1)Cl)Cl 1P00EIW5 [1,1,0,0,0,0|2,0,0]=4 1965 B9R1.69 Nc1cnc(c(n1)Cl)I 1P00H5PK [1,1,0,0,0,0|2,0,0]=4 1966 B9R1.69 Nc1cnc(c(n1)F)Br 1P027XFP [1,1,0,0,0,0|2,0,0]=4 1967 B9R1.69 Nc1ncc(c(n1)C)C 1P000J0I [1,1,0,0,0,0|2,0,0]=4 1968 B9R1.69 Nc1nnc(c(c1)C)C 1P01AJ0W [1,1,0,0,0,0|2,0,0]=4 1969 B9R1.69 Nc1nnc(c(n1)C)Br 1P028GF9 [1,1,0,0,0,0|2,0,0]=4 1970 B9R1.69 Nc1nnc(c(n1)C)C 1P0021OU [1,1,0,0,0,0|1,0,0]=3 1971 B9R1.69 Oc1ccc(c(c1)C)C 1P003IZJ [1,1,0,0,0,0|2,0,0]=4 1972 B9R1.69 Oc1ccc(c(n1)C)Br 1P003JKC [1,1,0,0,0,0|2,0,0]=4 1973 B9R1.69 Oc1ccc(c(n1)C)Cl 1P007X9T [1,1,0,0,0,0|2,0,0]=4 1974 B9R1.69 Oc1cnc(c(c1)Br)C 1P00AQ08 [1,1,0,0,0,0|2,0,0]=4 1975 B9R1.69 Oc1cnc(c(c1)C)Br 1P00029B [1,1,0,0,0,0|2,0,0]=4 1976 B9R1.69 Oc1cnc(c(c1)C)C 1P0037FP [1,1,0,0,0,0|1,0,0]=3 1977 B9R1.69 Oc1cnc(c(c1)C)Cl 1P003HFK [1,1,0,0,0,0|2,0,0]=4 1978 B9R1.69 Oc1cnc(c(c1)C)F 1P003HQT [1,1,0,0,0,0|2,0,0]=4 1979 B9R1.69 Oc1cnc(c(c1)C)N 1P00BBO2 [1,1,0,0,0,0|2,0,0]=4 1980 B9R1.69 Oc1cnc(c(c1)Cl)C 1P00E2Q0 [1,1,0,0,0,0|2,0,0]=4 1981 B9R1.69 Oc1ncc(c(n1)C)C 1P00J2RO [1,1,0,0,0,0|2,0,0]=4 1982 B9R1.69 Sc1ccc(c(c1)C)C 1P002H3X [1,1,0,0,0,0|2,0,0]=4 1983 B9R1.69 Sc1ncc(c(n1)S)C 1P00F3YQ [1,1,0,0,0,0|2,0,0]=4 1984 B9R1.69 [O-]c1nnc(c(n1)C)C 1P01AD5G [1,1,0,0,0,0|1,0,0]=3 1985 B9R1.69 [S-]c1nnc(c(n1)C)C 1P01FLFJ [1,1,0,0,0,0|1,0,0]=3 1986 B9R1.14 BrCc1nccn1CC 1P01EM8L [0,1,0,0,1,0|2,0,0]=4 1987 B9R1.14 CCc1ccsc1CN 1P019ZOJ [0,1,0,0,1,0|2,0,0]=4 1988 B9R1.14 CCc1conc1CCl 1P028V80 [0,1,0,0,1,0|2,0,0]=4 1989 B9R1.14 CCc1conc1CN 1P028CXG [0,1,0,0,1,0|2,0,0]=4 1990 B9R1.14 CCc1conc1CN 1P028ZSY [0,1,0,0,1,0|2,0,0]=4 1991 B9R1.14 CCc1conc1CO 1P028HZI [0,1,0,0,1,0|2,0,0]=4 1992 B9R1.14 CCc1n[nH]cc1CO 1P0195XT [0,1,0,0,1,0|2,0,0]=4 1993 B9R1.14 CCc1ncoc1CN 1P028187 [0,1,0,0,1,0|2,0,0]=4 1994 B9R1.14 CCc1nocc1CCl 1P01ANIQ [0,1,0,0,1,0|2,0,0]=4 1995 B9R1.14 CCc1nonc1CBr 1P0293E3 [0,1,0,0,1,0|2,0,0]=4 1996 B9R1.14 CCc1nonc1CO 1P02925M [0,1,0,0,1,0|2,0,0]=4 1997 B9R1.14 COc1nscc1CN 1P028AQF [0,1,0,0,1,0|1,1,0]=4 1998 B9R1.14 COc1nscc1CO 1P028DTU [0,1,0,0,1,0|1,1,0]=4 1999 B9R1.14 ClCc1ccnn1CC 1P00JG80 [0,1,0,0,1,0|2,0,0]=4 2000 B9R1.14 ClCc1nccn1CC 1P00A6BS [0,1,0,0,1,0|2,0,0]=4 2001 B9R1.14 ClCc1ncnn1CC 1P01BFYP [0,1,0,0,1,0|2,0,0]=4 2002 B9R1.14 NCc1nccn1CC 1P003ZBQ [0,1,0,0,1,0|2,0,0]=4 2003 B9R1.14 NCc1nccn1CC 1P01AV03 [0,1,0,0,1,0|2,0,0]=4 2004 B9R1.14 OCc1ccnn1CC 1P0092LA [0,1,0,0,1,0|2,0,0]=4 2005 B9R1.14 OCc1cscc1SC 1P028G6U [0,1,0,0,1,0|2,0,0]=4 2006 B9R1.14 OCc1nccn1CC 1P00EESR [0,1,0,0,1,0|2,0,0]=4 2007 B9R1.14 OCc1ncnn1CC 1P007QD4 [0,1,0,0,1,0|2,0,0]=4 2008 B9R1.22 CCc1nc([nH]c1C)C 1P028CR9 [0,1,0,0,1,0|1,0,1]=4 2009 B9R1.22 CCc1nc(sc1C)N 1P00J22W [0,1,0,0,1,0|2,0,0]=4 2010 B9R1.22 CCc1nc(sc1C)N 1P00JD99 [0,1,0,0,1,0|2,0,0]=4 2011 B9R1.22 CCc1sc(nc1C)N 1P00IBDM [0,1,0,0,1,0|2,0,0]=4 2012 B9R1.22 CCn1nc(cc1C)C 1P00250V [0,1,0,0,1,0|2,0,0]=4 2013 B9R1.22 CSC1=CC(=O)OC1=O 1P01J7N4 [0,1,0,0,1,0|2,0,0]=4 2014 B9R1.22 CSc1cn(nc1N)C 1P028462 [0,1,0,0,1,0|2,0,0]=4 2015 B9R1.22 CSc1sc(nc1C)N 1P01A8DJ [0,1,0,0,1,0|1,0,0]=3 2016 B9R1.22 Cc1cc(nn1CC)Br 1P01AP4T [0,1,0,0,1,0|2,0,0]=4 2017 B9R1.22 Cc1cc(nn1CC)N 1P00J2DG [0,1,0,0,1,0|2,0,0]=4 2018 B9R1.22 Cc1nc(cn1CC)Br 1P01DVEO [0,1,0,0,1,0|2,0,0]=4 2019 B9R1.22 Cc1nc(nn1CC)Br 1P01EI5R [0,1,0,0,1,0|2,0,0]=4 2020 B9R1.22 Cn1nc(cc1CC)N 1P01A6T3 [0,1,0,0,1,0|2,0,0]=4 2021 B9R1.22 Cn1nc(cc1CC)N 1P01C48L [0,1,0,0,1,0|2,0,0]=4 2022 B9R1.22 Cn1nc(cc1NC)Br 1P027XSX [0,1,0,0,1,0|2,0,0]=4 2023 B9R1.22 Cn1nc(cc1OC)N 1P01AFMS [0,1,0,0,1,0|1,1,0]=4 2024 B9R1.22 Cn1nc(cc1SC)Br 1P028S4M [0,1,0,0,1,0|1,0,0]=3 2025 B9R1.22 Cn1nc(cc1SC)N 1P00HYYC [0,1,0,0,1,0|1,0,0]=3 2026 B9R1.22 Cn1nc(cc1SC)N 1P027UQN [0,1,0,0,1,0|1,0,0]=3 2027 B9R1.22 Cn1nc(nc1CC)Br 1P00J3ER [0,1,0,0,1,0|2,0,0]=4 2028 B9R1.22 Cn1nc(nc1CC)N 1P00GU6I [0,1,0,0,1,0|2,0,0]=4 2029 B9R1.22 Cn1nc(nc1NC)Cl 1P00J34Q [0,1,0,0,1,0|2,0,0]=4 2030 B9R1.22 Cn1nc(nc1OC)Cl 1P00J321 [0,1,0,0,1,0|1,1,0]=4 2031 B9R1.22 Cn1nc(nc1SC)N 1P004NMU [0,1,0,0,1,0|1,0,0]=3 2032 B9R1.27 CCc1c(Br)cnn1C 1P00J377 [0,1,0,0,1,0|2,0,0]=4 2033 B9R1.27 CCc1c(C)c[nH]c1C 1P003JUV [0,1,0,0,1,0|1,0,1]=4 2034 B9R1.27 CCc1c(C)n[nH]c1C 1P00G55U [0,1,0,0,1,0|2,0,0]=4 2035 B9R1.27 CCc1c(N)[nH]nc1C 1P00B2ZT [0,1,0,0,1,0|2,0,0]=4 2036 B9R1.27 CCc1c(N)cnn1C 1P01FJW4 [0,1,0,0,1,0|2,0,0]=4 2037 B9R1.27 CCc1c(N)onc1C 1P00GU5X [0,1,0,0,1,0|2,0,0]=4 2038 B9R1.27 CCn1c(C)ncc1Cl 1P003N2D [0,1,0,0,1,0|2,0,0]=4 2039 B9R1.27 CNc1c(Br)cnn1C 1P01FJ2Z [0,1,0,0,1,0|2,0,0]=4 2040 B9R1.27 CNc1c(C)noc1C 1P019TIZ [0,1,0,0,1,0|2,0,0]=4 2041 B9R1.27 COc1c(Br)cnn1C 1P0044CI [0,1,0,0,1,0|1,1,0]=4 2042 B9R1.27 COc1c(I)cnn1C 1P028D44 [0,1,0,0,1,0|1,1,0]=4 2043 B9R1.27 CSc1c(Br)cnn1C 1P022LO6 [0,1,0,0,1,0|1,0,0]=3 2044 B9R1.33 BrCCc1nccn1C 1P01BAET [0,1,0,0,1,0|2,0,0]=4 2045 B9R1.33 BrCCn1nccc1C 1P01BBIK [0,1,0,0,1,0|2,0,0]=4 2046 B9R1.33 CCCn1nccc1C 1P00D199 [0,1,0,0,1,0|2,0,0]=4 2047 B9R1.33 CCOc1ocnc1C 1P006WTJ [0,1,0,0,1,0|1,1,0]=4 2048 B9R1.33 CNCc1c[nH]nc1C 1P01C52X [0,1,0,0,1,0|2,0,0]=4 2049 B9R1.33 CNCc1ccnn1C 1P003900 [0,1,0,0,1,0|2,0,0]=4 2050 B9R1.33 CNCc1ccnn1C 1P01BGR5 [0,1,0,0,1,0|2,0,0]=4 2051 B9R1.33 CNCc1ccoc1C 1P006RQK [0,1,0,0,1,0|2,0,0]=4 2052 B9R1.33 CNCc1csnc1C 1P02832W [0,1,0,0,1,0|2,0,0]=4 2053 B9R1.33 CNCc1nccn1C 1P00EAI3 [0,1,0,0,1,0|2,0,0]=4 2054 B9R1.33 CNCc1nccn1C 1P00HAXR [0,1,0,0,1,0|2,0,0]=4 2055 B9R1.33 CNCc1ncnn1C 1P027ZRM [0,1,0,0,1,0|2,0,0]=4 2056 B9R1.33 CNCc1occc1C 1P006RQJ [0,1,0,0,1,0|2,0,0]=4 2057 B9R1.33 CNCc1ocnc1C 1P028NKW [0,1,0,0,1,0|2,0,0]=4 2058 B9R1.33 CNCc1sccc1C 1P00IECX [0,1,0,0,1,0|2,0,0]=4 2059 B9R1.33 CNCc1scnc1C 1P00GSXT [0,1,0,0,1,0|2,0,0]=4 2060 B9R1.33 COCc1ccnn1C 1P01EJ65 [0,1,0,0,1,0|1,1,0]=4 2061 B9R1.33 COCc1nccn1C 1P01EJ3H [0,1,0,0,1,0|1,1,0]=4 2062 B9R1.33 CSSc1ccoc1C 1P003S5A [0,1,0,0,1,0|1,0,0]=3 2063 B9R1.33 Cc1c(CCN)nc[nH]1 1P00C0SN [0,1,0,0,1,0|1,0,1]=4 2064 B9R1.33 Cc1c(CCN)nc[nH]1 1P01ALDP [0,1,0,0,1,0|1,0,1]=4 2065 B9R1.33 Cc1nccn1CCBr 1P00G50M [0,1,0,0,1,0|2,0,0]=4 2066 B9R1.33 Cc1nccn1CCBr 1P00J2NI [0,1,0,0,1,0|2,0,0]=4 2067 B9R1.33 Cc1nccn1CCN 1P0009Z2 [0,1,0,0,1,0|2,0,0]=4 2068 B9R1.33 Cc1nccn1CCO 1P003F90 [0,1,0,0,1,0|2,0,0]=4 2069 B9R1.33 Cc1ncsc1CCBr 1P00FGP2 [0,1,0,0,1,0|2,0,0]=4 2070 B9R1.33 Cc1ncsc1CCCl 1P00DEHU [0,1,0,0,1,0|2,0,0]=4 2071 B9R1.33 Cc1ncsc1CCCl 1P00EGCT [0,1,0,0,1,0|2,0,0]=4 2072 B9R1.33 Cc1ncsc1CCN 1P00EDQY [0,1,0,0,1,0|2,0,0]=4 2073 B9R1.33 Cc1ncsc1CCO 1P00135B [0,1,0,0,1,0|2,0,0]=4 2074 B9R1.33 Cc1ocnc1CCN 1P028UTL [0,1,0,0,1,0|2,0,0]=4 2075 B9R1.33 Cc1scnc1CCO 1P0076Q3 [0,1,0,0,1,0|2,0,0]=4 2076 B9R1.33 ClCCc1nccn1C 1P00J2XE [0,1,0,0,1,0|2,0,0]=4 2077 B9R1.33 ClCCn1nccc1C 1P006R86 [0,1,0,0,1,0|2,0,0]=4 2078 B9R1.33 Cn1nccc1CCBr 1P01BAGZ [0,1,0,0,1,0|2,0,0]=4 2079 B9R1.33 Cn1nccc1CCCl 1P01BD64 [0,1,0,0,1,0|2,0,0]=4 2080 B9R1.33 Cn1nccc1CCN 1P00J35M [0,1,0,0,1,0|2,0,0]=4 2081 B9R1.33 Cn1nccc1CCO 1P01A00I [0,1,0,0,1,0|2,0,0]=4 2082 B9R1.33 Cn1ncnc1CCN 1P019ZLQ [0,1,0,0,1,0|2,0,0]=4 2083 B9R1.33 Cn1ncnc1CCO 1P01BB4U [0,1,0,0,1,0|2,0,0]=4 2084 B9R1.33 NCCc1c[nH]nc1C 1P0285Z1 [0,1,0,0,1,0|2,0,0]=4 2085 B9R1.33 NCCc1n[nH]nc1C 1P028Z4S [0,1,0,0,1,0|2,0,0]=4 2086 B9R1.33 NCCc1nccn1C 1P00J2CY [0,1,0,0,1,0|2,0,0]=4 2087 B9R1.33 NCCc1ncnn1C 1P00J22C [0,1,0,0,1,0|2,0,0]=4 2088 B9R1.33 NCCc1sccc1C 1P01A4W7 [0,1,0,0,1,0|2,0,0]=4 2089 B9R1.33 NCCc1scnc1C 1P009A8D [0,1,0,0,1,0|2,0,0]=4 2090 B9R1.33 NCCc1scnc1C 1P00J3UB [0,1,0,0,1,0|2,0,0]=4 2091 B9R1.33 NCCc1scnc1C 1P019FER [0,1,0,0,1,0|2,0,0]=4 2092 B9R1.33 NCCn1ccnc1C 1P00GARW [0,1,0,0,1,0|2,0,0]=4 2093 B9R1.33 NCCn1nccc1C 1P01DTPG [0,1,0,0,1,0|2,0,0]=4 2094 B9R1.33 OCCc1nccn1C 1P00B76R [0,1,0,0,1,0|2,0,0]=4 2095 B9R1.33 OCCc1sccc1C 1P01DW6N [0,1,0,0,1,0|2,0,0]=4 2096 B9R1.41 CC(=O)c1c[nH]nc1C 1P00941L [0,1,0,0,1,0|2,0,0]=4 2097 B9R1.41 CC(=O)c1ccnn1C 1P0014IM [0,1,0,0,1,0|2,0,0]=4 2098 B9R1.41 CC(=O)c1conc1C 1P00ETLU [0,1,0,0,1,0|2,0,0]=4 2099 B9R1.41 CC(=O)c1csnc1C 1P01DWPQ [0,1,0,0,1,0|2,0,0]=4 2100 B9R1.41 CC(=O)c1nccn1C 1P004Q7M [0,1,0,0,1,0|2,0,0]=4 2101 B9R1.41 CC(=O)c1ncnn1C 1P008UEN [0,1,0,0,1,0|2,0,0]=4 2102 B9R1.41 CC(=O)c1ncsc1C 1P01EC4G [0,1,0,0,1,0|2,0,0]=4 2103 B9R1.41 CC(=O)c1nonc1C 1P00ADDZ [0,1,0,0,1,0|2,0,0]=4 2104 B9R1.41 CC(=O)c1occc1C 1P000VSJ [0,1,0,0,1,0|2,0,0]=4 2105 B9R1.41 CC(=O)c1sccc1C 1P0012U9 [0,1,0,0,1,0|2,0,0]=4 2106 B9R1.41 CC(=O)c1scnc1C 1P00C8WG [0,1,0,0,1,0|2,0,0]=4 2107 B9R1.41 CC(c1c[nH]nc1C)C 1P024TZV [0,1,0,0,1,0|2,0,0]=4 2108 B9R1.41 CC(c1ccnn1C)C 1P01KW0U [0,1,0,0,1,0|2,0,0]=4 2109 B9R1.41 CC(c1ccnn1C)N 1P00JEND [0,1,0,0,1,0|2,0,0]=4 2110 B9R1.41 CC(c1ccnn1C)O 1P01AITA [0,1,0,0,1,0|2,0,0]=4 2111 B9R1.41 CC(c1conc1C)O 1P01C721 [0,1,0,0,1,0|2,0,0]=4 2112 B9R1.41 CC(c1nccn1C)C 1P006Y6L [0,1,0,0,1,0|2,0,0]=4 2113 B9R1.41 CC(c1nccn1C)N 1P01B7BL [0,1,0,0,1,0|2,0,0]=4 2114 B9R1.41 CC(c1nccn1C)O 1P00CAPY [0,1,0,0,1,0|2,0,0]=4 2115 B9R1.41 CC(c1ncnn1C)N 1P008VW7 [0,1,0,0,1,0|2,0,0]=4 2116 B9R1.41 CC(c1ncnn1C)N 1P01BD8V [0,1,0,0,1,0|2,0,0]=4 2117 B9R1.41 CC(c1ncnn1C)O 1P01APKB [0,1,0,0,1,0|2,0,0]=4 2118 B9R1.41 CC(c1sccc1C)O 1P01BDHR [0,1,0,0,1,0|2,0,0]=4 2119 B9R1.41 CC(c1scnc1C)N 1P028U0B [0,1,0,0,1,0|2,0,0]=4 2120 B9R1.41 CC(c1scnc1C)O 1P006ZA8 [0,1,0,0,1,0|2,0,0]=4 2121 B9R1.41 CC(n1ccnc1C)C 1P0036X4 [0,1,0,0,1,0|2,0,0]=4 2122 B9R1.41 C[C@@H](c1ccnn1C)N 1P023QWY [0,1,0,0,1,0|2,0,0]=4 2123 B9R1.41 C[C@@H](c1ccnn1C)O 1P01DZ9W [0,1,0,0,1,0|2,0,0]=4 2124 B9R1.41 C[C@@H](c1nccn1C)O 1P0288DY [0,1,0,0,1,0|2,0,0]=4 2125 B9R1.41 C[C@@H](c1ncnn1C)N 1P028CKN [0,1,0,0,1,0|2,0,0]=4 2126 B9R1.41 C[C@H](c1ccnn1C)N 1P023QWX [0,1,0,0,1,0|2,0,0]=4 2127 B9R1.41 C[C@H](c1ccnn1C)O 1P01DZ9X [0,1,0,0,1,0|2,0,0]=4 2128 B9R1.132 CCc1n[nH]c(c1C)N 1P00H329 [0,1,0,0,1,0|2,0,0]=4 2129 B9R1.132 CCc1n[nH]c(c1C)N 1P00J1OD [0,1,0,0,1,0|2,0,0]=4 2130 B9R1.132 CCc1noc(c1C)N 1P00ADDY [0,1,0,0,1,0|2,0,0]=4 2131 B9R1.132 CCn1ncc(c1C)N 1P000FJV [0,1,0,0,1,0|2,0,0]=4 2132 B9R1.132 COc1noc(c1C)C 1P01EZSD [0,1,0,0,1,0|1,1,0]=4 2133 B9R1.132 Cc1c(Br)cnn1CC 1P008VM1 [0,1,0,0,1,0|2,0,0]=4 2134 B9R1.132 Cc1c(I)cnn1CC 1P00HGWE [0,1,0,0,1,0|2,0,0]=4 2135 B9R1.132 Cc1c(N)cnn1CC 1P0001KI [0,1,0,0,1,0|2,0,0]=4 2136 B9R1.132 Cc1c(N)cnn1CC 1P008V8T [0,1,0,0,1,0|2,0,0]=4 2137 B9R1.132 Cn1c(SC)ncc1Br 1P028DKG [0,1,0,0,1,0|1,0,0]=3 2138 B11R1.8 CSc1nc(N)cc(=O)n1C 1P00DDNW [0,2,0,0,0,0|2,0,0]=4 2139 B11R1.13 Cc1c(CSC)cccc1N 1P01AJKJ [0,2,0,0,0,0|2,0,0]=4 2140 B11R1.159 CC(=O)c1nccc(c1C)Cl 1P01AFX7 [0,2,0,0,0,0|2,0,0]=4 2141 B11R1.265 CCc1c(SC)ncnc1Cl 1P019F8D [0,2,0,0,0,0|2,0,0]=4 2142 B11R1.265 CNc1c(SC)ncnc1Cl 1P019FFO [0,2,0,0,0,0|2,0,0]=4 2143 B11R1.265 COc1c(CO)nccc1Cl 1P00ASGR [0,2,0,0,0,0|1,1,0]=4 2144 B11R1.265 COc1c(CO)nccc1O 1P01BID0 [0,2,0,0,0,0|1,1,0]=4 2145 B11R1.265 COc1c(OC)ccnc1C 1P008UUZ [0,2,0,0,0,0|1,1,0]=4 2146 B11R1.265 COc1nccc(c1CN)C 1P028L7T [0,2,0,0,0,0|1,1,0]=4 2147 B11R1.265 CSc1c(CCl)cccc1Br 1P0283E5 [0,2,0,0,0,0|2,0,0]=4 2148 B11R1.265 CSc1cccc(c1CN)F 1P01BAR9 [0,2,0,0,0,0|2,0,0]=4 2149 B11R1.278 COc1ncc(c(c1C)N)C 1P00OAHM [0,2,0,0,0,0|1,1,0]=4 2150 B11R1.17 CCCOc1nccnc1Cl 1P01BW8G [0,2,0,0,0,0|1,1,0]=4 2151 B11R1.17 CCCOc1nccnc1N 1P028K4I [0,2,0,0,0,0|1,1,0]=4 2152 B11R1.17 CCSCc1cccnc1N 1P01BIEL [0,2,0,0,0,0|2,0,0]=4 2153 B11R1.17 Cc1ncccc1CCCN 1P01DXQ8 [0,2,0,0,0,0|2,0,0]=4 2154 B11R1.17 Cc1ncccc1OCOC 1P028219 [0,2,0,0,0,0|1,1,0]=4 2155 B11R1.17 Cc1nccnc1CCCC 1P001RXN [0,2,0,0,0,0|1,0,0]=3 2156 B11R1.17 N#CCCc1ncccc1C 1P00A8KN [0,2,0,0,0,0|2,0,0]=4 2157 B11R1.17 NCC=Cc1ncccc1C 1P027ZZZ [0,2,0,0,0,0|2,0,0]=4 2158 B11R1.17 NCCNc1ncccc1C 1P008MKQ [0,2,0,0,0,0|2,0,0]=4 2159 B11R1.17 NCCOc1cccnc1C 1P027ZQP [0,2,0,0,0,0|1,1,0]=4 2160 B11R1.17 OCCCc1ncccc1C 1P01IM7K [0,2,0,0,0,0|2,0,0]=4 2161 B11R1.17 OCCOc1nccnc1Cl 1P0280V1 [0,2,0,0,0,0|1,1,0]=4 2162 B11R1.41 CCOc1ncccc1CN 1P00G55G [0,2,0,0,0,0|1,1,0]=4 2163 B11R1.41 CCOc1ncccc1CN 1P00J2GH [0,2,0,0,0,0|1,1,0]=4 2164 B11R1.41 CCOc1nccnc1CC 1P003HMI [0,2,0,0,0,0|0,1,0]=3 2165 B11R1.41 CCOc1nccnc1NN 1P01KL8Y [0,2,0,0,0,0|1,1,0]=4 2166 B11R1.41 CCSc1ccccc1CC 1P01EZGR [0,2,0,0,0,0|2,0,0]=4 2167 B11R1.41 CCSc1ccccc1CCl 1P01BJJ7 [0,2,0,0,0,0|2,0,0]=4 2168 B11R1.41 CCSc1cccnc1C#N 1P01C7JA [0,2,0,0,0,0|1,0,1]=4 2169 B11R1.41 CCSc1nccnc1C#N 1P01BH9I [0,2,0,0,0,0|0,0,1]=3 2170 B11R1.41 CNCc1ccccc1SC 1P01BGT5 [0,2,0,0,0,0|2,0,0]=4 2171 B11R1.41 CNCc1cccnc1OC 1P01RNJB [0,2,0,0,0,0|1,1,0]=4 2172 B11R1.41 COc1ncccc1CC#N 1P00D5OK [0,2,0,0,0,0|1,1,0]=4 2173 B11R1.41 COc1ncccc1CCN 1P01BC3P [0,2,0,0,0,0|1,1,0]=4 2174 B11R1.41 COc1ncccc1CCO 1P00J3BH [0,2,0,0,0,0|1,1,0]=4 2175 B11R1.41 N#CCc1ncccc1OC 1P001M7F [0,2,0,0,0,0|1,1,0]=4 2176 B11R1.41 NCCc1ccccc1SC 1P028DB8 [0,2,0,0,0,0|2,0,0]=4 2177 B11R1.41 NCCc1ncccc1OC 1P028K8A [0,2,0,0,0,0|1,1,0]=4 2178 B11R1.81 CCOc1ccc(nc1C)N 1P005CZ1 [0,2,0,0,0,0|1,1,0]=4 2179 B11R1.81 CCOc1ncc(cc1C)Br 1P00EC4U [0,2,0,0,0,0|1,1,0]=4 2180 B11R1.81 COCc1ccc(nc1C)N 1P0280N9 [0,2,0,0,0,0|1,1,0]=4 2181 B11R1.81 NCCc1ncc(cc1C)C 1P01B2NP [0,2,0,0,0,0|2,0,0]=4 2182 B11R1.81 OCCc1ncc(cc1C)C 1P01C55E [0,2,0,0,0,0|2,0,0]=4 2183 B11R1.86 CC(=O)Cc1ncccc1C 1P00C8O3 [0,2,0,0,0,0|2,0,0]=4 2184 B11R1.86 CC(=O)Nc1ncccc1C 1P005WE9 [0,2,0,0,0,0|2,0,0]=4 2185 B11R1.86 CC(Cc1nccnc1C)C 1P003BP7 [0,2,0,0,0,0|1,0,0]=3 2186 B11R1.86 CC(Nc1cccnc1C)C 1P01AWUY [0,2,0,0,0,0|2,0,0]=4 2187 B11R1.86 CC(Oc1nccnc1C)C 1P003HY1 [0,2,0,0,0,0|0,1,0]=3 2188 B11R1.86 CC(Oc1nccnc1Cl)C 1P01A5IN [0,2,0,0,0,0|1,1,0]=4 2189 B11R1.86 CC(Oc1nccnc1N)C 1P028L54 [0,2,0,0,0,0|1,1,0]=4 2190 B11R1.86 FC(Oc1nccnc1Cl)F 1P01BATA [0,2,0,0,0,0|1,1,0]=4 2191 B11R1.182 CCOc1nc(Br)cnc1N 1P0056MV [0,2,0,0,0,0|1,1,0]=4 2192 B11R1.182 CSCc1nc(N)ccc1Cl 1P01AK3V [0,2,0,0,0,0|2,0,0]=4 2193 B11R1.222 CCC(=O)c1ncccc1C 1P00IHC7 [0,2,0,0,0,0|2,0,0]=4 2194 B11R1.222 CCC(c1ncccc1C)N 1P0005CB [0,2,0,0,0,0|2,0,0]=4 2195 B11R1.222 CCC(c1ncccc1C)N 1P01DE76 [0,2,0,0,0,0|2,0,0]=4 2196 B11R1.222 CNC(=O)c1nccnc1N 1P007BM3 [0,2,0,0,0,0|2,0,0]=4 2197 B11R1.222 COC(=O)c1ncccc1C 1P003S9R [0,2,0,0,0,0|1,1,0]=4 2198 B11R1.222 COC(=O)c1ncccc1C 1P00HVC1 [0,2,0,0,0,0|1,1,0]=4 2199 B11R1.222 COC(=O)c1nccnc1Br 1P0035NE [0,2,0,0,0,0|1,1,0]=4 2200 B11R1.222 COC(=O)c1nccnc1Cl 1P002VB8 [0,2,0,0,0,0|1,1,0]=4 2201 B11R1.222 COC(=O)c1nccnc1F 1P000S9J [0,2,0,0,0,0|1,1,0]=4 2202 B11R1.222 COC(=O)c1nccnc1I 1P001Z7M [0,2,0,0,0,0|1,1,0]=4 2203 B11R1.222 COC(=O)c1nccnc1N 1P001U23 [0,2,0,0,0,0|1,1,0]=4 2204 B11R1.222 Cc1ncccc1C(=O)CBr 1P00EIIO [0,2,0,0,0,0|2,0,0]=4 2205 B11R1.222 Cc1ncccc1C(=O)CBr 1P01ANK5 [0,2,0,0,0,0|2,0,0]=4 2206 B11R1.222 Cc1ncccc1C(=O)OC 1P003S5I [0,2,0,0,0,0|1,1,0]=4 2207 B11R1.222 Cc1nccnc1C(=O)NN 1P008603 [0,2,0,0,0,0|2,0,0]=4 2208 B11R1.222 Cc1nccnc1C(=O)OC 1P00C7EX [0,2,0,0,0,0|0,1,0]=3 2209 B11R1.37 BrCc1nc(C)ccc1OC 1P004WQQ [0,2,0,0,0,0|1,1,0]=4 2210 B11R1.37 CCc1c(CC)ncc(=O)[nH]1 1P001G4D [0,2,0,0,0,0|1,0,1]=4 2211 B11R1.37 CCc1nc(C)cnc1CC 1P003FYS [0,2,0,0,0,0|1,0,0]=3 2212 B11R1.37 CCc1nc(Cl)nnc1CC 1P01AVG8 [0,2,0,0,0,0|2,0,0]=4 2213 B11R1.37 CCc1nc(N)nnc1CC 1P01ADKT [0,2,0,0,0,0|2,0,0]=4 2214 B11R1.37 COc1cc(Br)cnc1CN 1P028U68 [0,2,0,0,0,0|1,1,0]=4 2215 B11R1.37 COc1cc(Br)cnc1CO 1P009MIM [0,2,0,0,0,0|1,1,0]=4 2216 B11R1.37 COc1cc(Br)cnc1OC 1P003AOL [0,2,0,0,0,0|1,1,0]=4 2217 B11R1.37 COc1cc(Br)cnc1SC 1P01AGFI [0,2,0,0,0,0|1,0,0]=3 2218 B11R1.37 COc1cc(C)cnc1OC 1P01FPEE [0,2,0,0,0,0|1,1,0]=4 2219 B11R1.37 COc1cc(Cl)cnc1OC 1P00BHDR [0,2,0,0,0,0|1,1,0]=4 2220 B11R1.37 COc1cc(N)cnc1OC 1P00591H [0,2,0,0,0,0|1,1,0]=4 2221 B11R1.37 COc1cc(S)cnc1OC 1P0283PI [0,2,0,0,0,0|1,1,0]=4 2222 B11R1.37 COc1nc(Br)ccc1CBr 1P01FT16 [0,2,0,0,0,0|1,1,0]=4 2223 B11R1.37 COc1nc(Br)ccc1CO 1P0022AH [0,2,0,0,0,0|1,1,0]=4 2224 B11R1.37 COc1nc(Br)ccc1OC 1P01PR81 [0,2,0,0,0,0|1,1,0]=4 2225 B11R1.37 COc1nc(Br)cnc1C=O 1P021N83 [0,2,0,0,0,0|0,1,1]=4 2226 B11R1.37 COc1nc(Br)cnc1NC 1P00DLMZ [0,2,0,0,0,0|0,1,0]=3 2227 B11R1.37 COc1nc(Br)cnc1OC 1P004306 [0,2,0,0,0,0|0,1,0]=3 2228 B11R1.37 COc1nc(C)ccc1CN 1P01AA8E [0,2,0,0,0,0|1,1,0]=4 2229 B11R1.37 COc1nc(C)ccc1CO 1P00CKTD [0,2,0,0,0,0|1,1,0]=4 2230 B11R1.37 COc1nc(C)ccc1OC 1P00H2F2 [0,2,0,0,0,0|1,1,0]=4 2231 B11R1.37 COc1nc(Cl)ccc1CN 1P01KLCG [0,2,0,0,0,0|1,1,0]=4 2232 B11R1.37 COc1nc(Cl)ccc1CO 1P02519F [0,2,0,0,0,0|1,1,0]=4 2233 B11R1.37 COc1nc(Cl)ccc1OC 1P008VWA [0,2,0,0,0,0|1,1,0]=4 2234 B11R1.37 COc1nc(I)ccc1OC 1P00CAU7 [0,2,0,0,0,0|1,1,0]=4 2235 B11R1.37 COc1nc(N)ccc1OC 1P000Y36 [0,2,0,0,0,0|1,1,0]=4 2236 B11R1.37 COc1nc(N)cnc1C#N 1P01W9H3 [0,2,0,0,0,0|0,1,1]=4 2237 B11R1.37 COc1nc(N)cnc1OC 1P027MOT [0,2,0,0,0,0|0,1,0]=3 2238 B11R1.37 COc1ncc(cc1CBr)Br 1P01BWTW [0,2,0,0,0,0|1,1,0]=4 2239 B11R1.37 COc1ncc(cc1CCl)Br 1P01B7KU [0,2,0,0,0,0|1,1,0]=4 2240 B11R1.37 COc1ncc(cc1CCl)Cl 1P00CMLM [0,2,0,0,0,0|1,1,0]=4 2241 B11R1.37 COc1ncc(cc1CN)Br 1P00GYGV [0,2,0,0,0,0|1,1,0]=4 2242 B11R1.37 COc1ncc(cc1CN)Cl 1P00A0I0 [0,2,0,0,0,0|1,1,0]=4 2243 B11R1.37 COc1ncc(cc1CO)Br 1P00CRCU [0,2,0,0,0,0|1,1,0]=4 2244 B11R1.37 COc1ncc(cc1CO)Cl 1P00D5OL [0,2,0,0,0,0|1,1,0]=4 2245 B11R1.37 COc1ncc(cc1CO)F 1P008CPE [0,2,0,0,0,0|1,1,0]=4 2246 B11R1.37 COc1ncc(cc1CO)N 1P028L2W [0,2,0,0,0,0|1,1,0]=4 2247 B11R1.37 CSc1cc(Br)ccc1OC 1P00FIBR [0,2,0,0,0,0|2,0,0]=4 2248 B11R1.37 CSc1cc(C)ccc1CN 1P019ZYN [0,2,0,0,0,0|2,0,0]=4 2249 B11R1.37 CSc1cc(N)ccc1OC 1P01C307 [0,2,0,0,0,0|2,0,0]=4 2250 B11R1.37 CSc1nc(N)ccc1C#N 1P027XB7 [0,2,0,0,0,0|1,0,1]=4 2251 B11R1.37 CSc1nc(O)ccc1C#N 1P028OH9 [0,2,0,0,0,0|1,0,1]=4 2252 B11R1.37 ClCc1cc(Br)ccc1SC 1P028YEG [0,2,0,0,0,0|2,0,0]=4 2253 B11R1.37 ClCc1nc(C)ccc1OC 1P028P6M [0,2,0,0,0,0|1,1,0]=4 2254 B11R1.37 NCc1cc(C)cnc1OC 1P027V04 [0,2,0,0,0,0|1,1,0]=4 2255 B11R1.37 NCc1cc(F)ccc1SC 1P019TLG [0,2,0,0,0,0|2,0,0]=4 2256 B11R1.37 NCc1ccc(nc1OC)Br 1P01DUNR [0,2,0,0,0,0|1,1,0]=4 2257 B11R1.37 NCc1ccc(nc1OC)Cl 1P024G0S [0,2,0,0,0,0|1,1,0]=4 2258 B11R1.37 NCc1nc(C)ccc1OC 1P027Z1H [0,2,0,0,0,0|1,1,0]=4 2259 B11R1.37 NNc1nc(Br)cnc1OC 1P00A0IL [0,2,0,0,0,0|1,1,0]=4 2260 B11R1.53 CCc1cccnc1C(=O)C 1P01A4AN [0,2,0,0,0,0|2,0,0]=4 2261 B11R1.53 CCc1nccnc1C(=O)C 1P003BMM [0,2,0,0,0,0|1,0,0]=3 2262 B11R1.53 CCc1nccnc1C(=O)O 1P0292OU [0,2,0,0,0,0|1,0,1]=4 2263 B11R1.53 CNc1cccnc1N(C)C 1P019YR3 [0,2,0,0,0,0|2,0,0]=4 2264 B11R1.53 CNc1cccnc1N(C)C 1P019YYS [0,2,0,0,0,0|2,0,0]=4 2265 B11R1.53 COc1cccnc1C(=O)C 1P00CJ7A [0,2,0,0,0,0|1,1,0]=4 2266 B11R1.53 COc1cccnc1C(N)C 1P028WRX [0,2,0,0,0,0|1,1,0]=4 2267 B11R1.53 COc1ncccc1C(=O)C 1P00100M [0,2,0,0,0,0|1,1,0]=4 2268 B11R1.53 COc1ncccc1C(N)C 1P0095O9 [0,2,0,0,0,0|1,1,0]=4 2269 B11R1.53 COc1ncccc1C(O)C 1P008Y6C [0,2,0,0,0,0|1,1,0]=4 2270 B11R1.53 COc1ncccc1[C@@H](O)C 1P028DMW [0,2,0,0,0,0|1,1,0]=4 2271 B11R1.53 COc1ncccc1[C@H](O)C 1P0290F9 [0,2,0,0,0,0|1,1,0]=4 2272 B11R1.53 COc1nccnc1C(=N)N 1P028FTY [0,2,0,0,0,0|0,1,1]=4 2273 B11R1.53 COc1nccnc1C(=O)O 1P0038CU [0,2,0,0,0,0|0,1,1]=4 2274 B11R1.53 COc1nccnc1C(C)C 1P003BPA [0,2,0,0,0,0|0,1,0]=3 2275 B11R1.53 COc1nccnc1C(C)C 1P00GRPQ [0,2,0,0,0,0|0,1,0]=3 2276 B11R1.53 CSc1ccccc1C(=O)C 1P001JET [0,2,0,0,0,0|2,0,0]=4 2277 B11R1.53 CSc1ccccc1C(O)C 1P01B95I [0,2,0,0,0,0|2,0,0]=4 2278 B11R1.53 CSc1ccccc1[C@@H](O)C 1P01B8YM [0,2,0,0,0,0|2,0,0]=4 2279 B11R1.53 CSc1ccccc1[C@H](O)C 1P01B91J [0,2,0,0,0,0|2,0,0]=4 2280 B11R1.53 CSc1cccnc1C(=O)O 1P01C5LN [0,2,0,0,0,0|1,0,1]=4 2281 B11R1.53 CSc1ncccc1C(=O)O 1P003FKD [0,2,0,0,0,0|1,0,1]=4 2282 B11R1.53 CSc1ncccc1[N+](=O)[O-] 1P00J8HQ [0,2,0,0,0,0|2,0,0]=4 2283 B11R1.53 CSc1nccnc1C(=O)O 1P01BU2C [0,2,0,0,0,0|0,0,1]=3 2284 B11R1.53 ClCc1ncccc1C(C)C 1P01KL8P [0,2,0,0,0,0|2,0,0]=4 2285 B11R1.53 ClCc1ncccc1C(C)C 1P028EQN [0,2,0,0,0,0|2,0,0]=4 2286 B11R1.53 NCc1cccnc1N(C)C 1P00COU7 [0,2,0,0,0,0|2,0,0]=4 2287 B11R1.53 NCc1cccnc1N(C)C 1P0280KB [0,2,0,0,0,0|2,0,0]=4 2288 B11R1.53 NCc1ncccc1C(C)C 1P028597 [0,2,0,0,0,0|2,0,0]=4 2289 B11R1.53 NCc1ncccc1N(C)C 1P01BCTJ [0,2,0,0,0,0|2,0,0]=4 2290 B11R1.53 NNc1nccnc1C(C)C 1P01B1Y8 [0,2,0,0,0,0|2,0,0]=4 2291 B11R1.53 OCc1cccnc1C(C)C 1P00BBOI [0,2,0,0,0,0|2,0,0]=4 2292 B11R1.53 OCc1cccnc1N(C)C 1P008VMG [0,2,0,0,0,0|2,0,0]=4 2293 B11R1.53 OCc1ncccc1C(C)C 1P00GIUE [0,2,0,0,0,0|2,0,0]=4 2294 B11R1.53 OCc1nccnc1C(=O)N 1P01DWVB [0,2,0,0,0,0|2,0,0]=4 2295 B11R1.166 Brc1cnc(c(c1)C)C(=O)C 1P009EO1 [0,2,0,0,0,0|2,0,0]=4 2296 B11R1.166 Brc1cnc(c(c1)C)C(N)C 1P01K07J [0,2,0,0,0,0|2,0,0]=4 2297 B11R1.166 CC(=O)c1ncc(nc1Cl)Cl 1P00A9GI [0,2,0,0,0,0|2,0,0]=4 2298 B11R1.166 CC(c1ccc(nc1C)N)C 1P02817G [0,2,0,0,0,0|2,0,0]=4 2299 B11R1.166 CN(c1ncc(nc1Br)Br)C 1P004VZI [0,2,0,0,0,0|2,0,0]=4 2300 B11R1.166 C[C@@H](c1ccc(nc1C)Br)N 1P01FJ0Q [0,2,0,0,0,0|2,0,0]=4 2301 B11R1.166 Cc1ccc(c(n1)C)C(=O)C 1P00AENJ [0,2,0,0,0,0|2,0,0]=4 2302 B11R1.166 Cc1cnc(c(n1)Cl)C(=O)C 1P024HUS [0,2,0,0,0,0|2,0,0]=4 2303 B11R1.166 Cc1cnc(c(n1)Cl)C(C)C 1P000D4L [0,2,0,0,0,0|2,0,0]=4 2304 B11R1.166 Cc1nc(C)cnc1C(=O)O 1P00IIVO [0,2,0,0,0,0|2,0,0]=4 2305 B11R1.166 Cc1nc(Cl)cnc1C(=O)C 1P023PQD [0,2,0,0,0,0|1,0,0]=3 2306 B11R1.166 Cc1nc(N)cnc1C(=O)O 1P028XUJ [0,2,0,0,0,0|2,0,0]=4 2307 B11R1.166 Clc1cnc(c(c1)C)C(=O)C 1P009ETO [0,2,0,0,0,0|2,0,0]=4 2308 B11R1.277 CCc1nc(C)c(nc1C)C 1P001ZTG [0,2,0,0,0,0|1,0,0]=3 2309 B11R1.277 COc1nc(N)c(nc1Br)Br 1P01DJAT [0,2,0,0,0,0|1,1,0]=4 2310 B11R1.277 NCc1nc(C)c(nc1C)C 1P01AD33 [0,2,0,0,0,0|2,0,0]=4 2311 B11R1.277 O=Cc1nc(C)c(nc1C)C 1P00AM46 [0,2,0,0,0,0|2,0,0]=4 2312 B11R1.277 OCc1nc(C)c(nc1C)C 1P00371C [0,2,0,0,0,0|2,0,0]=4 2313 B11R1.279 COc1ncc(cc1C)C#C 1P00AB9V [0,2,0,0,0,0|1,1,0]=4 2314 B11R1.279 COc1ncc(cc1C)C=O 1P009XZQ [0,2,0,0,0,0|1,1,0]=4 2315 B11R1.279 COc1ncc(cc1C)CCl 1P009XZG [0,2,0,0,0,0|1,1,0]=4 2316 B11R1.279 COc1ncc(cc1C)CO 1P00HUNX [0,2,0,0,0,0|1,1,0]=4 2317 B11R1.279 ClCc1ccc(c(n1)C)OC 1P0280GC [0,2,0,0,0,0|1,1,0]=4 2318 B11R1.279 NCc1ccc(c(c1)C)SC 1P01A07F [0,2,0,0,0,0|2,0,0]=4 2319 B11R1.279 NCc1ccc(c(c1)C)SC 1P028IE1 [0,2,0,0,0,0|2,0,0]=4 2320 B11R1.279 NCc1ccc(c(n1)C)OC 1P0280SR [0,2,0,0,0,0|1,1,0]=4 2321 B11R1.279 O=Cc1ccc(c(n1)C)OC 1P01DDFM [0,2,0,0,0,0|1,1,0]=4 2322 B11R1.279 OCc1ccc(c(n1)C)OC 1P0280F0 [0,2,0,0,0,0|1,1,0]=4 2323 B11R1.464 COc1c(Cl)cc(nc1C)Cl 1P0006NS [0,2,0,0,0,0|1,1,0]=4 2324 B11R1.167 Brc1ccc(c(n1)C(=O)C)C 1P0285YC [0,2,0,0,0,0|2,0,0]=4 2325 B11R1.167 Brc1cnc(c(c1)C(=O)C)C 1P000OWJ [0,2,0,0,0,0|2,0,0]=4 2326 B11R1.167 Brc1cnc(c(c1)C(=O)C)C 1P028RZ2 [0,2,0,0,0,0|2,0,0]=4 2327 B11R1.167 Brc1cnc(c(n1)C(C)C)O 1P019FHP [0,2,0,0,0,0|2,0,0]=4 2328 B11R1.167 Cc1cnc(c(n1)C(=O)C)C 1P00DVPJ [0,2,0,0,0,0|1,0,0]=3 2329 B11R1.167 Cc1cnc(c(n1)C(=O)C)C 1P00FQ20 [0,2,0,0,0,0|1,0,0]=3 2330 B11R1.167 Cc1cnc(c(n1)C(=O)C)Cl 1P023RBS [0,2,0,0,0,0|2,0,0]=4 2331 B11R1.167 Cc1cnc(c(n1)C(=O)O)C 1P00BGLH [0,2,0,0,0,0|2,0,0]=4 2332 B11R1.280 COc1nc(C=O)ccc1C 1P00A6XB [0,2,0,0,0,0|1,1,0]=4 2333 B11R1.280 CSc1nc(C=O)ccc1C 1P02837E [0,2,0,0,0,0|1,0,0]=3 2334 B11R1.280 CSc1nnc(c(n1)SC)N 1P00GB2B [0,2,0,0,0,0|2,0,0]=4 2335 B11R1.87 Cc1cccnc1C(N)(C)C 1P01EIM2 [0,2,0,0,0,0|2,0,0]=4 2336 B11R1.87 Cc1cccnc1[Si](C)(C)C 1P0013NO [0,2,0,0,0,0|2,0,0]=4 2337 B11R1.87 Cc1nccnc1C(F)(F)F 1P00K566 [0,2,0,0,0,0|2,0,0]=4 2338 B11R1.87 Cc1nccnc1S(=O)(=O)F 1P028499 [0,2,0,0,0,0|1,0,1]=4 2339 B11R1.87 Cc1nccnc1S(=O)(=O)N 1P00H176 [0,2,0,0,0,0|1,0,1]=4 2340 B11R1.87 Clc1nccnc1S(=O)(=O)C 1P028SGJ [0,2,0,0,0,0|1,0,1]=4 2341 B9R1.11 CSC(=N)c1cccs1 1P00IB3G [0,0,1,1,0,0|1,0,1]=4 2342 B9R2.3 C1CNc2n1ccn2 1P0064J6 [0,0,0,1,1,0|2,0,0]=4 2343 B9R2.3 C1CNc2n1ncc2 1P006L8O [0,0,0,1,1,0|2,0,0]=4 2344 B9R2.3 C1Cc2c(C1)nc[nH]2 1P00HAT4 [0,0,0,1,1,0|1,0,1]=4 2345 B9R2.3 C1Cc2c(C1)ncs2 1P00EGBX [0,0,0,1,1,0|2,0,0]=4 2346 B9R2.3 C1Cn2c(C1)ccn2 1P0084OX [0,0,0,1,1,0|2,0,0]=4 2347 B9R2.3 C1Cn2c(C1)ncc2 1P00ED6Y [0,0,0,1,1,0|2,0,0]=4 2348 B9R2.3 C1Cn2c(C1)ncn2 1P00I3W5 [0,0,0,1,1,0|2,0,0]=4 2349 B11R2.106 Brc1cccc2c1CCS2 1P028AUL [0,1,0,1,0,0|2,0,0]=4 2350 B11R2.106 Brc1ccnc2c1CCN2 1P001BAF [0,1,0,1,0,0|2,0,0]=4 2351 B11R2.106 Brc1ccnc2c1CCO2 1P027IXR [0,1,0,1,0,0|1,1,0]=4 2352 B11R2.106 Cc1ccnc2c1CCN2 1P001VGL [0,1,0,1,0,0|2,0,0]=4 2353 B11R2.106 Cc1ccnc2c1CCN2 1P028C4W [0,1,0,1,0,0|2,0,0]=4 2354 B11R2.106 Clc1ccnc2c1CCC2 1P00DC0I [0,1,0,1,0,0|2,0,0]=4 2355 B11R2.106 Clc1ccnc2c1CCN2 1P0023ND [0,1,0,1,0,0|2,0,0]=4 2356 B11R2.106 Clc1ccnc2c1NCC2 1P020MWX [0,1,0,1,0,0|2,0,0]=4 2357 B11R2.106 Clc1ncnc2c1CCS2 1P028SDG [0,1,0,1,0,0|2,0,0]=4 2358 B11R2.106 Fc1ccnc2c1CCO2 1P0023NV [0,1,0,1,0,0|1,1,0]=4 2359 B11R2.106 Ic1ccnc2c1CCO2 1P001T37 [0,1,0,1,0,0|1,1,0]=4 2360 B11R2.106 Nc1ccnc2c1CCC2 1P008NXJ [0,1,0,1,0,0|2,0,0]=4 2361 B11R2.106 Nc1ccnc2c1CCO2 1P01TOPS [0,1,0,1,0,0|1,1,0]=4 2362 B11R2.106 Oc1ccnc2c1CCN2 1P0024BB [0,1,0,1,0,0|2,0,0]=4 2363 B11R2.10 CC1Cc2c(N1)nccc2 1P00GA8F [0,1,0,1,0,0|2,0,0]=4 2364 B11R2.10 Cc1cc2c([nH]1)nccn2 1P01DYBU [0,1,0,1,0,0|1,0,1]=4 2365 B11R2.10 Clc1nc2c(s1)nccn2 1P01FPBF [0,1,0,1,0,0|1,0,1]=4 2366 B11R2.10 NC1Cc2c(C1)cccn2 1P01EIL9 [0,1,0,1,0,0|2,0,0]=4 2367 B11R2.10 NC1Cc2c(C1)nccn2 1P0285HC [0,1,0,1,0,0|1,0,0]=3 2368 B11R2.10 Nc1nc2c(s1)nccn2 1P01C6F5 [0,1,0,1,0,0|1,0,1]=4 2369 B11R2.10 S=c1sc2c([nH]1)nccn2 1P004KT1 [0,1,0,1,0,0|1,0,1]=4 2370 B11R2.20 C1C=Cc2c(C1)cccn2 1P007O8X [0,1,0,1,0,0|2,0,0]=4 2371 B11R2.20 C1CCc2c(C1)nccc2 1P003MQ0 [0,1,0,1,0,0|2,0,0]=4 2372 B11R2.20 C1CCc2c(C1)nccn2 1P00BXRL [0,1,0,1,0,0|1,0,0]=3 2373 B11R2.20 C1CNc2c(C1)cccn2 1P003DQK [0,1,0,1,0,0|2,0,0]=4 2374 B11R2.20 C1CNc2c(C1)nccc2 1P003DQI [0,1,0,1,0,0|2,0,0]=4 2375 B11R2.20 C1CNc2c(N1)nccc2 1P007FGQ [0,1,0,1,0,0|2,0,0]=4 2376 B11R2.20 C1CNc2c(O1)nccn2 1P0288QO [0,1,0,1,0,0|0,1,0]=3 2377 B11R2.20 C1CNc2c(S1)cccc2 1P0031SR [0,1,0,1,0,0|2,0,0]=4 2378 B11R2.20 C1COc2c(C1)cccn2 1P002SZW [0,1,0,1,0,0|1,1,0]=4 2379 B11R2.20 C1COc2c(C1)nccc2 1P00FDQH [0,1,0,1,0,0|1,1,0]=4 2380 B11R2.20 C1COc2c(N1)cccn2 1P008XTL [0,1,0,1,0,0|1,1,0]=4 2381 B11R2.20 C1COc2c(N1)nccc2 1P0029DC [0,1,0,1,0,0|1,1,0]=4 2382 B11R2.20 C1COc2c(O1)nccc2 1P007O1F [0,1,0,1,0,0|1,1,0]=4 2383 B11R2.20 C1COc2c(S1)cccc2 1P01AL87 [0,1,0,1,0,0|2,0,0]=4 2384 B11R2.20 C1CSc2c(N1)cccn2 1P018SR8 [0,1,0,1,0,0|1,0,0]=3 2385 B11R2.20 C1NCc2c(C1)cccn2 1P0038HV [0,1,0,1,0,0|2,0,0]=4 2386 B11R2.20 C1NCc2c(C1)cccn2 1P007N5A [0,1,0,1,0,0|2,0,0]=4 2387 B11R2.20 C1NCc2c(C1)cccn2 1P009D1X [0,1,0,1,0,0|2,0,0]=4 2388 B11R2.20 C1NCc2c(C1)nccc2 1P003MPT [0,1,0,1,0,0|2,0,0]=4 2389 B11R2.20 C1NCc2c(C1)nccc2 1P00CLBZ [0,1,0,1,0,0|2,0,0]=4 2390 B11R2.20 C1NCc2c(C1)nccc2 1P00IDM2 [0,1,0,1,0,0|2,0,0]=4 2391 B11R2.20 N1CCc2c(C1)nccn2 1P00CJQG [0,1,0,1,0,0|1,0,0]=3 2392 B11R2.20 N1CCc2c(C1)nccn2 1P027WTT [0,1,0,1,0,0|1,0,0]=3 2393 B11R2.55 Clc1nccnc1C2CC2 1P023I0A [0,1,0,1,0,0|2,0,0]=4 2394 B11R2.55 Nc1nccnc1C2CC2 1P00HFD0 [0,1,0,1,0,0|2,0,0]=4 2395 B11R2.1 Brc1csc2c1nccn2 1P0079TE [0,1,0,1,0,0|0,0,2]=4 2396 B11R2.1 Brc1nsc2c1nccn2 1P006B81 [0,1,0,1,0,0|1,0,1]=4 2397 B11R2.1 CC1CCc2c1nccn2 1P006VKY [0,1,0,1,0,0|1,0,0]=3 2398 B11R2.1 CC1CNc2c1nccc2 1P028GS8 [0,1,0,1,0,0|2,0,0]=4 2399 B11R2.1 Cc1n[nH]c2c1nccn2 1P0094EK [0,1,0,1,0,0|2,0,0]=4 2400 B11R2.1 Cc1nsc2c1cccn2 1P0060TS [0,1,0,1,0,0|2,0,0]=4 2401 B11R2.1 NC1CCc2c1cccn2 1P009315 [0,1,0,1,0,0|2,0,0]=4 2402 B11R2.1 NC1CCc2c1nccc2 1P009316 [0,1,0,1,0,0|2,0,0]=4 2403 B11R2.1 NC1COc2c1cccn2 1P01D998 [0,1,0,1,0,0|1,1,0]=4 2404 B11R2.1 NC1CSc2c1cccc2 1P01AJV3 [0,1,0,1,0,0|2,0,0]=4 2405 B11R2.1 N[C@@H]1CCc2c1nccc2 1P01KL2G [0,1,0,1,0,0|2,0,0]=4 2406 B11R2.1 N[C@@H]1CCc2c1nccc2 1P024HCH [0,1,0,1,0,0|2,0,0]=4 2407 B11R2.1 N[C@H]1CCc2c1cccn2 1P024TYR [0,1,0,1,0,0|2,0,0]=4 2408 B11R2.1 Nc1csc2c1nccn2 1P00EEK1 [0,1,0,1,0,0|0,0,2]=4 2409 B11R2.1 O=C1CCc2c1cccn2 1P00172D [0,1,0,1,0,0|2,0,0]=4 2410 B11R2.1 O=C1CCc2c1cccn2 1P002W77 [0,1,0,1,0,0|2,0,0]=4 2411 B11R2.1 O=C1CCc2c1nccc2 1P003MQQ [0,1,0,1,0,0|2,0,0]=4 2412 B11R2.1 O=C1NCc2c1nccn2 1P01XAKD [0,1,0,1,0,0|2,0,0]=4 2413 B11R2.1 OC1CCc2c1cccn2 1P008SIZ [0,1,0,1,0,0|2,0,0]=4 2414 B11R2.1 OC1CCc2c1nccc2 1P003NHM [0,1,0,1,0,0|2,0,0]=4 2415 B11R2.1 OC1COc2c1cccn2 1P001JJ7 [0,1,0,1,0,0|1,1,0]=4 2416 B11R2.1 O[C@@H]1CCc2c1cccn2 1P00NMHB [0,1,0,1,0,0|2,0,0]=4 2417 B11R2.1 O[C@@H]1CCc2c1nccc2 1P00H2SR [0,1,0,1,0,0|2,0,0]=4 2418 B11R2.1 O[C@@H]1CSc2c1cccc2 1P001YCG [0,1,0,1,0,0|2,0,0]=4 2419 B11R2.1 O[C@H]1CCc2c1cccn2 1P00QDE8 [0,1,0,1,0,0|2,0,0]=4 2420 B11R2.1 O[C@H]1CCc2c1nccc2 1P008BKB [0,1,0,1,0,0|2,0,0]=4 2421 B11R2.36 Brc1ccc2c(c1)CCS2 1P01BBMV [0,1,0,1,0,0|2,0,0]=4 2422 B11R2.36 Brc1ccc2c(n1)CCC2 1P01XC3K [0,1,0,1,0,0|2,0,0]=4 2423 B11R2.36 Brc1ccc2c(n1)CCN2 1P000RHP [0,1,0,1,0,0|2,0,0]=4 2424 B11R2.36 Brc1cnc2c(c1)CCC2 1P001QLF [0,1,0,1,0,0|2,0,0]=4 2425 B11R2.36 Brc1cnc2c(c1)CCN2 1P000GUD [0,1,0,1,0,0|2,0,0]=4 2426 B11R2.36 Brc1cnc2c(c1)CCN2 1P00231V [0,1,0,1,0,0|2,0,0]=4 2427 B11R2.36 Brc1cnc2c(c1)CCO2 1P01BA66 [0,1,0,1,0,0|1,1,0]=4 2428 B11R2.36 Brc1cnc2c(c1)NCC2 1P01A5YO [0,1,0,1,0,0|2,0,0]=4 2429 B11R2.36 Brc1cnc2c(c1)OCC2 1P0292RZ [0,1,0,1,0,0|1,1,0]=4 2430 B11R2.36 Brc1cnc2c(n1)scn2 1P004JEQ [0,1,0,1,0,0|1,0,1]=4 2431 B11R2.36 Cc1cnc2c(c1)NCC2 1P01ANDH [0,1,0,1,0,0|2,0,0]=4 2432 B11R2.36 Clc1ccc2c(c1)CCS2 1P028BKS [0,1,0,1,0,0|2,0,0]=4 2433 B11R2.36 Clc1ccc2c(n1)CCC2 1P0077NH [0,1,0,1,0,0|2,0,0]=4 2434 B11R2.36 Clc1ccc2c(n1)NCC2 1P01A5HV [0,1,0,1,0,0|2,0,0]=4 2435 B11R2.36 Clc1ccc2c(n1)OCC2 1P01JV7R [0,1,0,1,0,0|1,1,0]=4 2436 B11R2.36 Clc1cnc2c(c1)CCC2 1P000STF [0,1,0,1,0,0|2,0,0]=4 2437 B11R2.36 Clc1cnc2c(c1)CCN2 1P000FIH [0,1,0,1,0,0|2,0,0]=4 2438 B11R2.36 Fc1ccc2c(n1)CCN2 1P01B772 [0,1,0,1,0,0|2,0,0]=4 2439 B11R2.36 Fc1ccc2c(n1)OCC2 1P02899G [0,1,0,1,0,0|1,1,0]=4 2440 B11R2.36 Fc1cnc2c(c1)CCN2 1P01BUF5 [0,1,0,1,0,0|2,0,0]=4 2441 B11R2.36 Fc1cnc2c(c1)CCO2 1P028O4T [0,1,0,1,0,0|1,1,0]=4 2442 B11R2.36 Fc1cnc2c(c1)NCC2 1P0287KM [0,1,0,1,0,0|2,0,0]=4 2443 B11R2.36 Ic1cnc2c(c1)CCC2 1P000PEW [0,1,0,1,0,0|2,0,0]=4 2444 B11R2.36 Ic1cnc2c(c1)CCN2 1P01XCYG [0,1,0,1,0,0|2,0,0]=4 2445 B11R2.36 Ic1cnc2c(c1)CCO2 1P028ZLV [0,1,0,1,0,0|1,1,0]=4 2446 B11R2.36 Nc1ccc2c(c1)SCC2 1P01GHVT [0,1,0,1,0,0|2,0,0]=4 2447 B11R2.36 Nc1ccc2c(n1)CCC2 1P00AKQX [0,1,0,1,0,0|2,0,0]=4 2448 B11R2.36 Nc1ccc2c(n1)OCC2 1P01KL8H [0,1,0,1,0,0|1,1,0]=4 2449 B11R2.36 Nc1cnc2c(c1)CCC2 1P0026AD [0,1,0,1,0,0|2,0,0]=4 2450 B11R2.36 Nc1cnc2c(c1)CCO2 1P019SA6 [0,1,0,1,0,0|1,1,0]=4 2451 B11R2.36 Oc1ccc2c(c1)SCC2 1P027WJP [0,1,0,1,0,0|2,0,0]=4 2452 B11R2.36 Oc1ccc2c(n1)CCC2 1P0049X6 [0,1,0,1,0,0|2,0,0]=4 2453 B11R2.36 Oc1ccc2c(n1)NCC2 1P028ZUE [0,1,0,1,0,0|2,0,0]=4 2454 B11R2.36 Oc1cnc2c(c1)CCN2 1P028AMJ [0,1,0,1,0,0|2,0,0]=4 2455 B7R1.1 CCc1c[nH]cc1 1P00APDI [1,0,0,0,1,0|1,0,1]=4 2456 B7R1.1 CCc1c[nH]nc1 1P00B6AX [1,0,0,0,1,0|2,0,0]=4 2457 B7R1.1 CCc1cc[nH]n1 1P0018FG [1,0,0,0,1,0|2,0,0]=4 2458 B7R1.1 CCc1ccc[nH]1 1P0033RK [1,0,0,0,1,0|1,0,1]=4 2459 B7R1.1 CCc1ccco1 1P003HOB [1,0,0,0,1,0|2,0,0]=4 2460 B7R1.1 CCc1cccs1 1P003HOV [1,0,0,0,1,0|2,0,0]=4 2461 B7R1.1 CCc1ccon1 1P028EIU [1,0,0,0,1,0|2,0,0]=4 2462 B7R1.1 CCc1cn[nH]n1 1P024SQ7 [1,0,0,0,1,0|2,0,0]=4 2463 B7R1.1 CCc1cnc[nH]1 1P001J1R [1,0,0,0,1,0|1,0,1]=4 2464 B7R1.1 CCc1cnco1 1P007IH6 [1,0,0,0,1,0|2,0,0]=4 2465 B7R1.1 CCc1cocn1 1P01B79E [1,0,0,0,1,0|2,0,0]=4 2466 B7R1.1 CCc1cscc1 1P0027I2 [1,0,0,0,1,0|2,0,0]=4 2467 B7R1.1 CCc1cscn1 1P00250B [1,0,0,0,1,0|2,0,0]=4 2468 B7R1.1 CCc1csnc1 1P01BYG2 [1,0,0,0,1,0|2,0,0]=4 2469 B7R1.1 CCc1n[nH]cn1 1P0039JI [1,0,0,0,1,0|2,0,0]=4 2470 B7R1.1 CCc1ncc[nH]1 1P003BOK [1,0,0,0,1,0|1,0,1]=4 2471 B7R1.1 CCc1nccs1 1P001PGS [1,0,0,0,1,0|2,0,0]=4 2472 B7R1.1 CCn1cccn1 1P003ES5 [1,0,0,0,1,0|2,0,0]=4 2473 B7R1.1 CCn1cncc1 1P003ES2 [1,0,0,0,1,0|2,0,0]=4 2474 B7R1.1 CCn1cncn1 1P001Y2E [1,0,0,0,1,0|2,0,0]=4 2475 B7R1.1 CNc1c[nH]nc1 1P019TPX [1,0,0,0,1,0|2,0,0]=4 2476 B7R1.1 CNc1cc[nH]n1 1P00E6KF [1,0,0,0,1,0|2,0,0]=4 2477 B7R1.1 CNc1ccon1 1P00HS5D [1,0,0,0,1,0|2,0,0]=4 2478 B7R1.1 CNc1ccon1 1P00IAF9 [1,0,0,0,1,0|2,0,0]=4 2479 B7R1.1 CNc1ccsn1 1P028UZC [1,0,0,0,1,0|2,0,0]=4 2480 B7R1.1 CNc1cscc1 1P01B2HP [1,0,0,0,1,0|2,0,0]=4 2481 B7R1.1 CNc1n[nH]cn1 1P00B5HT [1,0,0,0,1,0|2,0,0]=4 2482 B7R1.1 CNc1ncc[nH]1 1P01BE1C [1,0,0,0,1,0|1,0,1]=4 2483 B7R1.1 CNc1ncco1 1P0039ZY [1,0,0,0,1,0|2,0,0]=4 2484 B7R1.1 CNc1nccs1 1P00EGBN [1,0,0,0,1,0|2,0,0]=4 2485 B7R1.1 COc1c[nH]cn1 1P0048ET [1,0,0,0,1,0|0,1,1]=4 2486 B7R1.1 COc1c[nH]nc1 1P001LPP [1,0,0,0,1,0|1,1,0]=4 2487 B7R1.1 COc1c[nH]nc1 1P01B6QU [1,0,0,0,1,0|1,1,0]=4 2488 B7R1.1 COc1cc[nH]n1 1P00I4N8 [1,0,0,0,1,0|1,1,0]=4 2489 B7R1.1 COc1cccs1 1P001YI0 [1,0,0,0,1,0|1,1,0]=4 2490 B7R1.1 COc1ccsn1 1P01BDQO [1,0,0,0,1,0|1,1,0]=4 2491 B7R1.1 COc1cscc1 1P0021M3 [1,0,0,0,1,0|1,1,0]=4 2492 B7R1.1 COc1nccs1 1P001DHP [1,0,0,0,1,0|1,1,0]=4 2493 B7R1.1 CSc1c[nH]cn1 1P0036YT [1,0,0,0,1,0|0,0,1]=3 2494 B7R1.1 CSc1c[nH]nc1 1P009JTI [1,0,0,0,1,0|1,0,0]=3 2495 B7R1.1 CSc1cc[nH]n1 1P0283LV [1,0,0,0,1,0|1,0,0]=3 2496 B7R1.1 CSc1ccc[nH]1 1P01ID3L [1,0,0,0,1,0|0,0,1]=3 2497 B7R1.1 CSc1ccco1 1P000WBV [1,0,0,0,1,0|1,0,0]=3 2498 B7R1.1 CSc1cccs1 1P0033CD [1,0,0,0,1,0|1,0,0]=3 2499 B7R1.1 CSc1cncs1 1P01BU59 [1,0,0,0,1,0|1,0,0]=3 2500 B7R1.1 CSc1cscc1 1P002JFX [1,0,0,0,1,0|1,0,0]=3 2501 B7R1.1 CSc1n[nH]nn1 1P002Z34 [1,0,0,0,1,0|2,0,0]=4 2502 B7R1.1 CSc1ncc[nH]1 1P003FKB [1,0,0,0,1,0|0,0,1]=3 2503 B7R1.1 CSc1ncco1 1P002DMB [1,0,0,0,1,0|1,0,0]=3 2504 B7R1.1 CSc1nccs1 1P003BJA [1,0,0,0,1,0|1,0,0]=3 2505 B7R1.1 CSc1nnc[nH]1 1P005U9S [1,0,0,0,1,0|1,0,1]=4 2506 B7R1.1 CSc1nnc[nH]1 1P028EL9 [1,0,0,0,1,0|1,0,1]=4 2507 B7R1.1 CSc1nncs1 1P028THD [1,0,0,0,1,0|2,0,0]=4 2508 B7R1.4 Brc1c[nH]nc1C 1P0018FJ [1,0,0,0,1,0|2,0,0]=4 2509 B7R1.4 Brc1ccoc1C 1P004W05 [1,0,0,0,1,0|2,0,0]=4 2510 B7R1.4 Brc1ccsc1C 1P00307X [1,0,0,0,1,0|2,0,0]=4 2511 B7R1.4 Brc1conc1C 1P008Z60 [1,0,0,0,1,0|2,0,0]=4 2512 B7R1.4 Brc1csnc1C 1P006JMD [1,0,0,0,1,0|2,0,0]=4 2513 B7R1.4 Brc1ncoc1C 1P023P88 [1,0,0,0,1,0|2,0,0]=4 2514 B7R1.4 Brc1ncsc1C 1P0010UV [1,0,0,0,1,0|2,0,0]=4 2515 B7R1.4 Cc1[nH]ccc1C 1P0037Y2 [1,0,0,0,1,0|0,0,1]=3 2516 B7R1.4 Cc1[nH]cnc1C 1P002MD8 [1,0,0,0,1,0|0,0,1]=3 2517 B7R1.4 Cc1[nH]cnc1C 1P00I9ZF [1,0,0,0,1,0|0,0,1]=3 2518 B7R1.4 Cc1[nH]cnc1C 1P00IEBV [1,0,0,0,1,0|0,0,1]=3 2519 B7R1.4 Cc1c[nH]cc1C 1P0036WU [1,0,0,0,1,0|2,0,0]=4 2520 B7R1.4 Cc1c[nH]nc1Br 1P003ATK [1,0,0,0,1,0|2,0,0]=4 2521 B7R1.4 Cc1c[nH]nc1Cl 1P01AN5U [1,0,0,0,1,0|2,0,0]=4 2522 B7R1.4 Cc1c[nH]nc1N 1P00JGGO [1,0,0,0,1,0|2,0,0]=4 2523 B7R1.4 Cc1c[nH]nc1O 1P00J2YC [1,0,0,0,1,0|1,1,0]=4 2524 B7R1.4 Cc1ccsc1Br 1P003H3U [1,0,0,0,1,0|2,0,0]=4 2525 B7R1.4 Cc1ccsc1Cl 1P003HCL [1,0,0,0,1,0|2,0,0]=4 2526 B7R1.4 Cc1ccsc1I 1P001VNK [1,0,0,0,1,0|2,0,0]=4 2527 B7R1.4 Cc1ccsc1S 1P01BKP7 [1,0,0,0,1,0|1,0,0]=3 2528 B7R1.4 Cc1cocc1C 1P002K4Z [1,0,0,0,1,0|2,0,0]=4 2529 B7R1.4 Cc1conc1Br 1P027WND [1,0,0,0,1,0|2,0,0]=4 2530 B7R1.4 Cc1conc1N 1P0020K6 [1,0,0,0,1,0|2,0,0]=4 2531 B7R1.4 Cc1cscc1C 1P00E9CW [1,0,0,0,1,0|2,0,0]=4 2532 B7R1.4 Cc1n[nH]cc1C 1P0028XH [1,0,0,0,1,0|1,0,0]=3 2533 B7R1.4 Cc1n[nH]cc1C 1P007LJF [1,0,0,0,1,0|1,0,0]=3 2534 B7R1.4 Cc1nc[nH]c1Br 1P001QH3 [1,0,0,0,1,0|1,0,1]=4 2535 B7R1.4 Cc1nc[nH]c1I 1P001QH4 [1,0,0,0,1,0|1,0,1]=4 2536 B7R1.4 Cc1nc[nH]c1N 1P003L6T [1,0,0,0,1,0|1,0,1]=4 2537 B7R1.4 Cc1ncoc1Br 1P01B34H [1,0,0,0,1,0|2,0,0]=4 2538 B7R1.4 Cc1ncsc1Br 1P0034OT [1,0,0,0,1,0|2,0,0]=4 2539 B7R1.4 Cc1ncsc1N 1P00FWA1 [1,0,0,0,1,0|2,0,0]=4 2540 B7R1.4 Cc1ncsc1N 1P01B26U [1,0,0,0,1,0|2,0,0]=4 2541 B7R1.4 Cc1nonc1C 1P00DD7H [1,0,0,0,1,0|1,0,0]=3 2542 B7R1.4 Cc1occc1C 1P001LXH [1,0,0,0,1,0|1,0,0]=3 2543 B7R1.4 Cc1ocnc1C 1P002J27 [1,0,0,0,1,0|1,0,0]=3 2544 B7R1.4 Cc1s[c-]nc1C 1P00GSB6 [1,0,0,0,1,0|1,0,1]=4 2545 B7R1.4 Cc1scnc1C 1P0034BY [1,0,0,0,1,0|1,0,0]=3 2546 B7R1.4 Clc1c[nH]nc1C 1P001RBU [1,0,0,0,1,0|2,0,0]=4 2547 B7R1.4 Clc1ccsc1C 1P007WBT [1,0,0,0,1,0|2,0,0]=4 2548 B7R1.4 Clc1nc[nH]c1C 1P004LHE [1,0,0,0,1,0|1,0,1]=4 2549 B7R1.4 Cn1ccnc1Br 1P003H2T [1,0,0,0,1,0|2,0,0]=4 2550 B7R1.4 Cn1ccnc1C 1P001ZQM [1,0,0,0,1,0|1,0,0]=3 2551 B7R1.4 Cn1ccnc1Cl 1P00BD1D [1,0,0,0,1,0|2,0,0]=4 2552 B7R1.4 Cn1ccnc1I 1P007CDV [1,0,0,0,1,0|2,0,0]=4 2553 B7R1.4 Cn1ccnc1N 1P001KWR [1,0,0,0,1,0|2,0,0]=4 2554 B7R1.4 Cn1ccnc1N 1P0039WI [1,0,0,0,1,0|2,0,0]=4 2555 B7R1.4 Cn1ccnc1S 1P00IB3Q [1,0,0,0,1,0|1,0,0]=3 2556 B7R1.4 Cn1cnnc1C 1P00ACCC [1,0,0,0,1,0|2,0,0]=4 2557 B7R1.4 Cn1cnnc1S 1P003M5Y [1,0,0,0,1,0|2,0,0]=4 2558 B7R1.4 Cn1nccc1Br 1P0038FI [1,0,0,0,1,0|2,0,0]=4 2559 B7R1.4 Cn1nccc1C 1P005MKD [1,0,0,0,1,0|1,0,0]=3 2560 B7R1.4 Cn1nccc1Cl 1P00CL8T [1,0,0,0,1,0|2,0,0]=4 2561 B7R1.4 Cn1nccc1I 1P00C8NB [1,0,0,0,1,0|2,0,0]=4 2562 B7R1.4 Cn1nccc1N 1P000ISJ [1,0,0,0,1,0|2,0,0]=4 2563 B7R1.4 Cn1nccc1O 1P003AIK [1,0,0,0,1,0|1,1,0]=4 2564 B7R1.4 Cn1nccc1O 1P003EXW [1,0,0,0,1,0|1,1,0]=4 2565 B7R1.4 Cn1ncnc1Br 1P00AKQQ [1,0,0,0,1,0|2,0,0]=4 2566 B7R1.4 Cn1ncnc1C 1P027VPU [1,0,0,0,1,0|1,0,0]=3 2567 B7R1.4 Cn1ncnc1Cl 1P00F0NH [1,0,0,0,1,0|2,0,0]=4 2568 B7R1.4 Cn1ncnc1N 1P001QBF [1,0,0,0,1,0|2,0,0]=4 2569 B7R1.4 Cn1nncc1C 1P028ADR [1,0,0,0,1,0|2,0,0]=4 2570 B7R1.4 Cn1nncc1S 1P028MJE [1,0,0,0,1,0|2,0,0]=4 2571 B7R1.4 Cn1nnnc1C 1P00DHP9 [1,0,0,0,1,0|2,0,0]=4 2572 B7R1.4 Cn1nnnc1S 1P003EYY [1,0,0,0,1,0|2,0,0]=4 2573 B7R1.4 Ic1c[nH]nc1C 1P001QDK [1,0,0,0,1,0|2,0,0]=4 2574 B7R1.4 Ic1ncoc1C 1P028TLC [1,0,0,0,1,0|2,0,0]=4 2575 B7R1.4 Nc1c[nH]nc1C 1P000JZM [1,0,0,0,1,0|2,0,0]=4 2576 B7R1.4 Nc1c[nH]nc1C 1P007B6V [1,0,0,0,1,0|2,0,0]=4 2577 B7R1.4 Nc1ccsc1C 1P01BRMN [1,0,0,0,1,0|2,0,0]=4 2578 B7R1.4 Nc1conc1C 1P00CJB5 [1,0,0,0,1,0|2,0,0]=4 2579 B7R1.4 Nc1conc1C 1P01C5S8 [1,0,0,0,1,0|2,0,0]=4 2580 B7R1.4 Nc1csnc1C 1P01EIGO [1,0,0,0,1,0|2,0,0]=4 2581 B7R1.4 Nc1ncsc1C 1P01BVRP [1,0,0,0,1,0|2,0,0]=4 2582 B7R1.4 Nc1ncsc1C 1P01BVRQ [1,0,0,0,1,0|2,0,0]=4 2583 B7R1.4 Nc1nonc1C 1P00255Q [1,0,0,0,1,0|2,0,0]=4 2584 B7R1.4 Sc1ccoc1C 1P002W7D [1,0,0,0,1,0|1,0,0]=3