0 B20R2.79822 CCCCC(Nc1ccncc1C)c2cccnc2 27a_200011711859_100000765111 [0,0,0,0,0,0|4,0,0]=4 1 B20R2.79822 CCCCC(Nc1ccncc1C)c2ccncc2 27a_100015203128_100000765111 [0,0,0,0,0,0|4,0,0]=4 2 B20R2.79822 CCCCN(Cc1ccccc1Br)c2ccccc2 2230a_100000211623_100000184730 [0,0,0,0,0,0|4,0,0]=4 3 B20R2.79822 CCCCN(Cc1ccccc1Br)c2ccccc2 269982a_100000211623_100000184730 [0,0,0,0,0,0|4,0,0]=4 4 B20R2.79822 CCCCN(Cc1ccccc1Br)c2ccccc2 34a_100000211623_100000184730 [0,0,0,0,0,0|4,0,0]=4 5 B20R2.79822 CCCCN(Cc1ccccc1C)c2ccccc2 2230a_100000211623_100000211839 [0,0,0,0,0,0|3,0,0]=3 6 B20R2.79822 CCCCN(Cc1ccccc1C)c2ccccc2 269982a_100000211623_100000211839 [0,0,0,0,0,0|3,0,0]=3 7 B20R2.79822 CCCCN(Cc1ccccc1C)c2ccccc2 34a_100000211623_100000211839 [0,0,0,0,0,0|3,0,0]=3 8 B20R2.79822 CCCCN(Cc1ccccc1Cl)c2ccccc2 2230a_100000211623_100000187162 [0,0,0,0,0,0|4,0,0]=4 9 B20R2.79822 CCCCN(Cc1ccccc1Cl)c2ccccc2 269982a_100000211623_100000187162 [0,0,0,0,0,0|4,0,0]=4 10 B20R2.79822 CCCCN(Cc1ccccc1Cl)c2ccccc2 34a_100000211623_100000187162 [0,0,0,0,0,0|4,0,0]=4 11 B20R2.79822 CCCCN(Cc1ccccc1F)c2ccccc2 2230a_100000211623_100000211605 [0,0,0,0,0,0|4,0,0]=4 12 B20R2.79822 CCCCN(Cc1ccccc1F)c2ccccc2 2230a_100000224004_100000210211 [0,0,0,0,0,0|4,0,0]=4 13 B20R2.79822 CCCCN(Cc1ccccc1F)c2ccccc2 269982a_100000211623_100000211605 [0,0,0,0,0,0|4,0,0]=4 14 B20R2.79822 CCCCN(Cc1ccccc1F)c2ccccc2 269982a_100000224004_100000210211 [0,0,0,0,0,0|4,0,0]=4 15 B20R2.79822 CCCCN(Cc1ccccc1F)c2ccccc2 34a_100000211623_100000211605 [0,0,0,0,0,0|4,0,0]=4 16 B20R2.79822 CCCCN(Cc1ccccc1F)c2ccccc2 34a_100000224004_100000210210 [0,0,0,0,0,0|4,0,0]=4 17 B20R2.79822 CCCCN(Cc1ccccc1I)c2ccccc2 2230a_100000211623_100011215278 [0,0,0,0,0,0|4,0,0]=4 18 B20R2.79822 CCCCN(Cc1ccccc1I)c2ccccc2 269982a_100000211623_100011215278 [0,0,0,0,0,0|4,0,0]=4 19 B20R2.79822 CCCCN(Cc1ccccc1I)c2ccccc2 34a_100000211623_100011215278 [0,0,0,0,0,0|4,0,0]=4 20 B20R2.79822 CCCCN(Cc1cccnc1C)c2ccccc2 2230a_100000211623_100000732876 [0,0,0,0,0,0|4,0,0]=4 21 B20R2.79822 CCCCN(Cc1cccnc1C)c2ccccc2 269982a_100000211623_100000732876 [0,0,0,0,0,0|4,0,0]=4 22 B20R2.79822 CCCCN(Cc1cccnc1C)c2ccccc2 34a_100000211623_100000732876 [0,0,0,0,0,0|4,0,0]=4 23 B20R2.79822 CCCCN(Cc1ccncc1C)c2ccccc2 2230a_100000211623_100020672808 [0,0,0,0,0,0|4,0,0]=4 24 B20R2.79822 CCCCN(Cc1ccncc1C)c2ccccc2 269982a_100000211623_100020672808 [0,0,0,0,0,0|4,0,0]=4 25 B20R2.79822 CCCCN(Cc1ccncc1C)c2ccccc2 34a_100000211623_100020672809 [0,0,0,0,0,0|4,0,0]=4 26 B20R2.79822 CCCCN(Cc1cnccc1C)c2ccccc2 2230a_100000211623_100000690890 [0,0,0,0,0,0|4,0,0]=4 27 B20R2.79822 CCCCN(Cc1cnccc1C)c2ccccc2 269982a_100000211623_100000690890 [0,0,0,0,0,0|4,0,0]=4 28 B20R2.79822 CCCCN(Cc1cnccc1C)c2ccccc2 34a_100000211623_100000690890 [0,0,0,0,0,0|4,0,0]=4 29 B20R2.79822 CCCCN(Cc1ncccc1C)c2ccccc2 2230a_100000211623_100000696600 [0,0,0,0,0,0|4,0,0]=4 30 B20R2.79822 CCCCN(Cc1ncccc1C)c2ccccc2 269982a_100000211623_100000696600 [0,0,0,0,0,0|4,0,0]=4 31 B20R2.79822 CCCCN(Cc1ncccc1C)c2ccccc2 34a_100000211623_100000696600 [0,0,0,0,0,0|4,0,0]=4 32 B20R2.79822 COCCN(Cc1ccccc1F)c2ccccc2 2230a_100000224004_100011201679 [0,0,0,0,0,0|4,0,0]=4 33 B20R2.79822 COCCN(Cc1ccccc1F)c2ccccc2 269982a_100000224004_100000233755 [0,0,0,0,0,0|4,0,0]=4 34 B20R2.79822 COCCN(Cc1ccccc1F)c2ccccc2 34a_100000224004_100011201679 [0,0,0,0,0,0|4,0,0]=4 35 B20R2.79822 CSCCN(Cc1ccccc1F)c2ccccc2 2230a_100000224004_100000751147 [0,0,0,0,0,0|4,0,0]=4 36 B20R2.79822 CSCCN(Cc1ccccc1F)c2ccccc2 269982a_100000224004_100000212216 [0,0,0,0,0,0|4,0,0]=4 37 B20R2.79822 CSCCN(Cc1ccccc1F)c2ccccc2 34a_100000224004_100000212216 [0,0,0,0,0,0|4,0,0]=4 38 B20R2.79822 Cc1ccccc1CN(CCC#N)c2ccccc2 2230a_100000183874_100000211839 [0,0,0,0,0,0|4,0,0]=4 39 B20R2.79822 Cc1ccccc1CN(CCCO)c2ccccc2 2230a_100000212590_100000211839 [0,0,0,0,0,0|4,0,0]=4 40 B20R2.79822 Cc1ccccc1CN(CCCO)c2ccccc2 269982a_100000212590_100000211839 [0,0,0,0,0,0|4,0,0]=4 41 B20R2.79822 Cc1ccccc1CN(CCCO)c2ccccc2 34a_100000212590_100000211839 [0,0,0,0,0,0|4,0,0]=4 42 B20R2.79822 Cc1cnccc1NC(CCCO)c2ccccc2 27a_100000759318_100000765111 [0,0,0,0,0,0|4,0,0]=4 43 B19R2.1884 CCCC(Nc1ccncc1Br)c2ccccc2 27a_100000189686_100000726257 [1,0,0,0,0,0|3,0,0]=4 44 B19R2.1884 CCCC(Nc1ccncc1C)c2ccccc2 27a_100000189686_100000765111 [1,0,0,0,0,0|2,0,0]=3 45 B19R2.1884 CCCC(Nc1ccncc1C)c2cccnc2 27a_100011351308_100000765111 [1,0,0,0,0,0|3,0,0]=4 46 B19R2.1884 CCCC(Nc1ccncc1C)c2ccncc2 27a_100011351316_100000765111 [1,0,0,0,0,0|3,0,0]=4 47 B19R2.1884 CCCC(Nc1ccncc1F)c2ccccc2 27a_100000189686_100000035921 [1,0,0,0,0,0|3,0,0]=4 48 B19R2.1884 CCCC(Nc1ncccc1Br)c2ccccc2 27a_100000189686_100000696092 [1,0,0,0,0,0|3,0,0]=4 49 B19R2.1884 CCCC(Nc1nccnc1C)c2ccccc2 27a_100000189686_100011999405 [1,0,0,0,0,0|3,0,0]=4 50 B19R2.1884 CCCC(Nc1ncncc1C)c2ccccc2 27a_100000189686_100011998708 [1,0,0,0,0,0|3,0,0]=4 51 B19R2.1884 CCCC(Nc1nnccc1C)c2ccccc2 27a_100000189686_100000089043 [1,0,0,0,0,0|3,0,0]=4 52 B19R2.1884 CCCN(Cc1ccccc1Br)c2ccccc2 2230a_200011218496_100000184730 [1,0,0,0,0,0|3,0,0]=4 53 B19R2.1884 CCCN(Cc1ccccc1Br)c2ccccc2 269982a_200011218496_100000184730 [1,0,0,0,0,0|3,0,0]=4 54 B19R2.1884 CCCN(Cc1ccccc1Br)c2ccccc2 34a_200011218496_100000184730 [1,0,0,0,0,0|3,0,0]=4 55 B19R2.1884 CCCN(Cc1ccccc1C)c2ccccc2 2230a_200011218496_100000211839 [1,0,0,0,0,0|2,0,0]=3 56 B19R2.1884 CCCN(Cc1ccccc1C)c2ccccc2 269982a_200011218496_100000211839 [1,0,0,0,0,0|2,0,0]=3 57 B19R2.1884 CCCN(Cc1ccccc1C)c2ccccc2 34a_200011218496_100000211839 [1,0,0,0,0,0|2,0,0]=3 58 B19R2.1884 CCCN(Cc1ccccc1Cl)c2ccccc2 2230a_200011218496_100000187162 [1,0,0,0,0,0|3,0,0]=4 59 B19R2.1884 CCCN(Cc1ccccc1Cl)c2ccccc2 269982a_200011218496_100000187162 [1,0,0,0,0,0|3,0,0]=4 60 B19R2.1884 CCCN(Cc1ccccc1Cl)c2ccccc2 34a_200011218496_100000187162 [1,0,0,0,0,0|3,0,0]=4 61 B19R2.1884 CCCN(Cc1ccccc1F)c2ccccc2 2230a_100000224004_100000210303 [1,0,0,0,0,0|3,0,0]=4 62 B19R2.1884 CCCN(Cc1ccccc1F)c2ccccc2 2230a_200011218496_100000211605 [1,0,0,0,0,0|3,0,0]=4 63 B19R2.1884 CCCN(Cc1ccccc1F)c2ccccc2 269982a_100000224004_100000210303 [1,0,0,0,0,0|3,0,0]=4 64 B19R2.1884 CCCN(Cc1ccccc1F)c2ccccc2 269982a_200011218496_100000211605 [1,0,0,0,0,0|3,0,0]=4 65 B19R2.1884 CCCN(Cc1ccccc1F)c2ccccc2 34a_100000224004_100000210303 [1,0,0,0,0,0|3,0,0]=4 66 B19R2.1884 CCCN(Cc1ccccc1F)c2ccccc2 34a_200011218496_100000211605 [1,0,0,0,0,0|3,0,0]=4 67 B19R2.1884 CCCN(Cc1ccccc1I)c2ccccc2 2230a_200011218496_100011215278 [1,0,0,0,0,0|3,0,0]=4 68 B19R2.1884 CCCN(Cc1ccccc1I)c2ccccc2 269982a_200011218496_100011215278 [1,0,0,0,0,0|3,0,0]=4 69 B19R2.1884 CCCN(Cc1ccccc1I)c2ccccc2 34a_200011218496_100011215278 [1,0,0,0,0,0|3,0,0]=4 70 B19R2.1884 CCCN(Cc1cccnc1C)c2ccccc2 2230a_200011218496_100000732876 [1,0,0,0,0,0|3,0,0]=4 71 B19R2.1884 CCCN(Cc1cccnc1C)c2ccccc2 269982a_200011218496_100000732876 [1,0,0,0,0,0|3,0,0]=4 72 B19R2.1884 CCCN(Cc1cccnc1C)c2ccccc2 34a_200011218496_100000732876 [1,0,0,0,0,0|3,0,0]=4 73 B19R2.1884 CCCN(Cc1ccncc1C)c2ccccc2 2230a_200011218496_100020672808 [1,0,0,0,0,0|3,0,0]=4 74 B19R2.1884 CCCN(Cc1ccncc1C)c2ccccc2 269982a_200011218496_100020672808 [1,0,0,0,0,0|3,0,0]=4 75 B19R2.1884 CCCN(Cc1ccncc1C)c2ccccc2 34a_200011218496_100020672809 [1,0,0,0,0,0|3,0,0]=4 76 B19R2.1884 CCCN(Cc1cnccc1C)c2ccccc2 2230a_200011218496_100000690890 [1,0,0,0,0,0|3,0,0]=4 77 B19R2.1884 CCCN(Cc1cnccc1C)c2ccccc2 269982a_200011218496_100000690890 [1,0,0,0,0,0|3,0,0]=4 78 B19R2.1884 CCCN(Cc1cnccc1C)c2ccccc2 34a_200011218496_100000690890 [1,0,0,0,0,0|3,0,0]=4 79 B19R2.1884 CCCN(Cc1ncccc1C)c2ccccc2 2230a_200011218496_100000696600 [1,0,0,0,0,0|3,0,0]=4 80 B19R2.1884 CCCN(Cc1ncccc1C)c2ccccc2 269982a_200011218496_100000696600 [1,0,0,0,0,0|3,0,0]=4 81 B19R2.1884 CCCN(Cc1ncccc1C)c2ccccc2 34a_200011218496_100000696600 [1,0,0,0,0,0|3,0,0]=4 82 B19R2.1884 COC[C@@H](Nc1ccncc1C)c2ccccc2 27a_103619048568_100000765111 [1,0,0,0,0,0|3,0,0]=4 83 B19R2.1884 C[n+]1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100000212160 [1,0,0,0,0,0|2,1,0]=4 84 B19R2.1884 Cc1ccccc1CN(CCO)c2ccccc2 2230a_100000211345_100000211839 [1,0,0,0,0,0|3,0,0]=4 85 B19R2.1884 Cc1ccccc1CN(CCO)c2ccccc2 269982a_100000211345_100000211839 [1,0,0,0,0,0|3,0,0]=4 86 B19R2.1884 Cc1ccccc1CN(CCO)c2ccccc2 34a_100000211345_100000211839 [1,0,0,0,0,0|3,0,0]=4 87 B19R2.1884 Cc1ccccc1OC(CCCl)c2ccccc2 7a_100000210338_200010132975 [1,0,0,0,0,0|1,0,0]=2 88 B19R2.1884 Cc1ccccc1SC(CCCl)c2ccccc2 62a_100000210755_200010132975 [1,0,0,0,0,0|1,1,0]=3 89 B19R2.1884 Cc1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100000210755 [1,0,0,0,0,0|1,1,0]=3 90 B19R2.1884 Cc1cccnc1SC(CCCl)c2ccccc2 62a_100000751373_200010132975 [1,0,0,0,0,0|2,1,0]=4 91 B19R2.1884 Cc1cccnc1SC(CCCl)c2ccccc2 62a_200010132975_100000751373 [1,0,0,0,0,0|2,1,0]=4 92 B19R2.1884 Cc1ccncc1OC(CCCl)c2ccccc2 7a_100011997053_200010132975 [1,0,0,0,0,0|2,0,0]=3 93 B19R2.1884 Cc1ccncc1SC(CCCl)c2ccccc2 62a_100000761580_200010132975 [1,0,0,0,0,0|2,1,0]=4 94 B19R2.1884 Cc1ccncc1SC(CCCl)c2ccccc2 62a_200010132975_100000761580 [1,0,0,0,0,0|2,1,0]=4 95 B19R2.1884 Cc1cnccc1N[C@@H](CCO)c2ccccc2 27a_100025705951_100000765111 [1,0,0,0,0,0|3,0,0]=4 96 B19R2.1884 Cc1cnccc1SC(CCCl)c2ccccc2 62a_100000765111_200010132975 [1,0,0,0,0,0|2,1,0]=4 97 B19R2.1884 Cc1cnccc1SC(CCCl)c2ccccc2 62a_200010132975_100000765111 [1,0,0,0,0,0|2,1,0]=4 98 B19R2.1884 Cc1ncccc1OC(CCCl)c2ccccc2 7a_100000745507_200010132975 [1,0,0,0,0,0|2,0,0]=3 99 B19R2.1884 Cc1ncccc1SC(CCCl)c2ccccc2 62a_100000751574_200010132975 [1,0,0,0,0,0|2,1,0]=4 100 B19R2.1884 Cc1ncccc1SC(CCCl)c2ccccc2 62a_200010132975_100000751574 [1,0,0,0,0,0|2,1,0]=4 101 B19R2.1884 ClCCC(Oc1ccccc1Br)c2ccccc2 7a_100000181306_200010132975 [1,0,0,0,0,0|2,0,0]=3 102 B19R2.1884 ClCCC(Oc1ccccc1Cl)c2ccccc2 7a_100000210172_200010132975 [1,0,0,0,0,0|2,0,0]=3 103 B19R2.1884 ClCCC(Oc1ccccc1I)c2ccccc2 7a_100000739446_200010132975 [1,0,0,0,0,0|2,0,0]=3 104 B19R2.1884 ClCCC(Oc1cccnc1Br)c2ccccc2 7a_100000744436_200010132975 [1,0,0,0,0,0|3,0,0]=4 105 B19R2.1884 ClCCC(Oc1cccnc1Cl)c2ccccc2 7a_100000757616_200010132975 [1,0,0,0,0,0|3,0,0]=4 106 B19R2.1884 ClCCC(Oc1cccnc1I)c2ccccc2 7a_100000034122_200010132975 [1,0,0,0,0,0|3,0,0]=4 107 B19R2.1884 ClCCC(Sc1ccccc1Br)c2ccccc2 62a_100000695589_200010132975 [1,0,0,0,0,0|2,1,0]=4 108 B19R2.1884 ClCCC(Sc1ccccc1Br)c2ccccc2 62a_200010132975_100000695589 [1,0,0,0,0,0|2,1,0]=4 109 B19R2.1884 ClCCC(Sc1ccccc1Cl)c2ccccc2 62a_100000764095_200010132975 [1,0,0,0,0,0|2,1,0]=4 110 B19R2.1884 ClCCC(Sc1ccccc1Cl)c2ccccc2 62a_200010132975_100000764095 [1,0,0,0,0,0|2,1,0]=4 111 B19R2.1884 Fc1ccccc1OC(CCCl)c2ccccc2 7a_100000210171_200010132975 [1,0,0,0,0,0|2,0,0]=3 112 B19R2.1884 Fc1ccccc1SC(CCCl)c2ccccc2 62a_100011215700_200010132975 [1,0,0,0,0,0|2,1,0]=4 113 B19R2.1884 Fc1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100011215700 [1,0,0,0,0,0|2,1,0]=4 114 B19R2.1884 Fc1ncccc1OC(CCCl)c2ccccc2 7a_100000061740_200010132975 [1,0,0,0,0,0|3,0,0]=4 115 B19R2.1884 Nc1ccccc1OC(CCCl)c2ccccc2 7a_100000185747_200010132975 [1,0,0,0,0,0|2,0,0]=3 116 B19R2.1884 Nc1ccccc1SC(CCCl)c2ccccc2 62a_100000210017_200010132975 [1,0,0,0,0,0|2,1,0]=4 117 B19R2.1884 Nc1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100000210017 [1,0,0,0,0,0|2,1,0]=4 118 B19R2.1884 Nc1ncccc1OC(CCCl)c2ccccc2 7a_100000211975_200010132975 [1,0,0,0,0,0|3,0,0]=4 119 B19R2.1884 O=c1occcc1OC(CCCl)c2ccccc2 7a_100000077404_200010132975 [1,0,0,0,0,0|3,0,0]=4 120 B19R2.1884 Oc1ccccc1SC(CCCl)c2ccccc2 62a_100000739446_200010132975 [1,0,0,0,0,0|2,1,0]=4 121 B19R2.1884 Oc1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100000739446 [1,0,0,0,0,0|2,1,0]=4 122 B19R2.1884 [O-][n+]1ccccc1OC(CCCl)c2ccccc2 7a_100000211761_200010132975 [1,0,0,0,0,0|3,0,0]=4 123 B19R2.2770 CCCCN(Cc1ccccc1)c2ccccc2 2230a_100000188819_100000210211 [1,0,0,0,0,0|3,0,0]=4 124 B19R2.2770 CCCCN(Cc1ccccc1)c2ccccc2 2230a_100000211623_100015291786 [1,0,0,0,0,0|3,0,0]=4 125 B19R2.2770 CCCCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000210211 [1,0,0,0,0,0|3,0,0]=4 126 B19R2.2770 CCCCN(Cc1ccccc1)c2ccccc2 269982a_100000211623_100000211182 [1,0,0,0,0,0|3,0,0]=4 127 B19R2.2770 CCCCN(Cc1ccccc1)c2ccccc2 34a_100000188819_100000210210 [1,0,0,0,0,0|3,0,0]=4 128 B19R2.2770 CCCCN(Cc1ccccc1)c2ccccc2 34a_100000211623_100015291786 [1,0,0,0,0,0|3,0,0]=4 129 B19R2.2770 CCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000210303 [1,0,0,0,0,0|3,0,0]=4 130 B19R2.2770 CCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000210303 [1,0,0,0,0,0|3,0,0]=4 131 B19R2.2770 CCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000210303 [1,0,0,0,0,0|3,0,0]=4 132 B19R2.2770 COCCN(Cc1ccccc1)c2ccccc2 2230a_100000188819_100011201679 [1,0,0,0,0,0|3,0,0]=4 133 B19R2.2770 COCCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000233755 [1,0,0,0,0,0|3,0,0]=4 134 B19R2.2770 COCCN(Cc1ccccc1)c2ccccc2 34a_100000188819_100011201679 [1,0,0,0,0,0|3,0,0]=4 135 B19R2.2770 COCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000766300 [1,0,0,0,0,0|3,0,0]=4 136 B19R2.2770 CSCCN(Cc1ccccc1)c2ccccc2 2230a_100000188819_100000751147 [1,0,0,0,0,0|3,0,0]=4 137 B19R2.2770 CSCCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000212216 [1,0,0,0,0,0|3,0,0]=4 138 B19R2.2770 CSCCN(Cc1ccccc1)c2ccccc2 34a_100000188819_100000212216 [1,0,0,0,0,0|3,0,0]=4 139 B19R2.2770 CSCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100011218213 [1,0,0,0,0,0|3,0,0]=4 140 B19R2.2770 CSCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100011218213 [1,0,0,0,0,0|3,0,0]=4 141 B21R2.2433 CCCCCN(Cc1ccccc1C)c2ccccc2 2230a_200000219563_100000211839 [0,1,0,0,0,0|3,0,0]=4 142 B21R2.2433 CCCCCN(Cc1ccccc1C)c2ccccc2 269982a_200000219563_100000211839 [0,1,0,0,0,0|3,0,0]=4 143 B21R2.2433 CCCCCN(Cc1ccccc1C)c2ccccc2 34a_200000219563_100000211839 [0,1,0,0,0,0|3,0,0]=4 144 B21R2.2433 CCCCCN(Cc1ccccc1C)c2ccccc2 7a_200000219563_100000211839 [0,1,0,0,0,0|3,0,0]=4 145 B21R2.5238 CCCCC(Nc1ccncc1C)c2ccc(cc2)Cl 27a_102515440625_100000765111 [0,1,0,0,0,0|3,0,0]=4 146 B21R2.39199 CCCCN(Cc1cc(ccc1C)C)c2ccccc2 2230a_100000211623_100000184699 [0,1,0,0,0,0|3,0,0]=4 147 B21R2.39199 CCCCN(Cc1cc(ccc1C)C)c2ccccc2 269982a_100000211623_100000184699 [0,1,0,0,0,0|3,0,0]=4 148 B21R2.39199 CCCCN(Cc1cc(ccc1C)C)c2ccccc2 34a_100000211623_100000184699 [0,1,0,0,0,0|3,0,0]=4 149 B21R2.39199 CCCCN(Cc1cc(ccc1C)Cl)c2ccccc2 2230a_100000211623_100012186985 [0,1,0,0,0,0|3,0,0]=4 150 B21R2.39199 CCCCN(Cc1cc(ccc1C)Cl)c2ccccc2 269982a_100000211623_100012186985 [0,1,0,0,0,0|3,0,0]=4 151 B21R2.39199 CCCCN(Cc1cc(ccc1C)Cl)c2ccccc2 34a_100000211623_100012186985 [0,1,0,0,0,0|3,0,0]=4 152 B21R2.39199 CCCCN(Cc1cc(ccc1C)F)c2ccccc2 2230a_100000211623_100000709795 [0,1,0,0,0,0|3,0,0]=4 153 B21R2.39199 CCCCN(Cc1cc(ccc1C)F)c2ccccc2 269982a_100000211623_100000709795 [0,1,0,0,0,0|3,0,0]=4 154 B21R2.39199 CCCCN(Cc1cc(ccc1C)F)c2ccccc2 34a_100000211623_100000709795 [0,1,0,0,0,0|3,0,0]=4 155 B21R2.39297 CCCCN(Cc1cccc(c1C)Br)c2ccccc2 2230a_100000211623_100000694682 [0,1,0,0,0,0|3,0,0]=4 156 B21R2.39297 CCCCN(Cc1cccc(c1C)Br)c2ccccc2 269982a_100000211623_100000694682 [0,1,0,0,0,0|3,0,0]=4 157 B21R2.39297 CCCCN(Cc1cccc(c1C)Br)c2ccccc2 34a_100000211623_100000694682 [0,1,0,0,0,0|3,0,0]=4 158 B21R2.39297 CCCCN(Cc1cccc(c1C)C)c2ccccc2 2230a_100000211623_100011515928 [0,1,0,0,0,0|3,0,0]=4 159 B21R2.39297 CCCCN(Cc1cccc(c1C)C)c2ccccc2 269982a_100000211623_100011515928 [0,1,0,0,0,0|3,0,0]=4 160 B21R2.39297 CCCCN(Cc1cccc(c1C)C)c2ccccc2 34a_100000211623_100011273979 [0,1,0,0,0,0|3,0,0]=4 161 B21R2.39297 CCCCN(Cc1cccc(c1C)Cl)c2ccccc2 2230a_100000211623_100012186920 [0,1,0,0,0,0|3,0,0]=4 162 B21R2.39297 CCCCN(Cc1cccc(c1C)Cl)c2ccccc2 269982a_100000211623_100012186920 [0,1,0,0,0,0|3,0,0]=4 163 B21R2.39297 CCCCN(Cc1cccc(c1C)Cl)c2ccccc2 34a_100000211623_100012186920 [0,1,0,0,0,0|3,0,0]=4 164 B21R2.39297 CCCCN(Cc1cccc(c1C)F)c2ccccc2 2230a_100000211623_100009813626 [0,1,0,0,0,0|3,0,0]=4 165 B21R2.39297 CCCCN(Cc1cccc(c1C)F)c2ccccc2 269982a_100000211623_100009813626 [0,1,0,0,0,0|3,0,0]=4 166 B21R2.39297 CCCCN(Cc1cccc(c1C)F)c2ccccc2 34a_100000211623_100009813626 [0,1,0,0,0,0|3,0,0]=4 167 B21R2.39297 CCCCN(Cc1cccc(c1C)I)c2ccccc2 2230a_100000211623_100010150147 [0,1,0,0,0,0|3,0,0]=4 168 B21R2.39297 CCCCN(Cc1cccc(c1C)I)c2ccccc2 269982a_100000211623_100010150147 [0,1,0,0,0,0|3,0,0]=4 169 B21R2.39297 CCCCN(Cc1cccc(c1C)I)c2ccccc2 34a_100000211623_100010150147 [0,1,0,0,0,0|3,0,0]=4 170 B21R2.39322 CCCCN(Cc1ccccc1CO)c2ccccc2 2230a_100000211623_100009816955 [0,1,0,0,0,0|3,0,0]=4 171 B21R2.39322 CCCCN(Cc1ccccc1CO)c2ccccc2 269982a_100000211623_100009816955 [0,1,0,0,0,0|3,0,0]=4 172 B21R2.39322 CCCCN(Cc1ccccc1CO)c2ccccc2 34a_100000211623_100009816955 [0,1,0,0,0,0|3,0,0]=4 173 B21R2.39322 CCCCN(Cc1ccccc1OC)c2ccccc2 2230a_100000211623_100000210004 [0,1,0,0,0,0|3,0,0]=4 174 B21R2.39322 CCCCN(Cc1ccccc1OC)c2ccccc2 269982a_100000211623_100000210004 [0,1,0,0,0,0|3,0,0]=4 175 B21R2.39322 CCCCN(Cc1ccccc1OC)c2ccccc2 34a_100000211623_100000210004 [0,1,0,0,0,0|3,0,0]=4 176 B21R2.39322 CCCCN(Cc1ccccc1SC)c2ccccc2 2230a_100000211623_100000699184 [0,1,0,0,0,0|3,0,0]=4 177 B21R2.39322 CCCCN(Cc1ccccc1SC)c2ccccc2 269982a_100000211623_100000699184 [0,1,0,0,0,0|3,0,0]=4 178 B21R2.39322 CCCCN(Cc1ccccc1SC)c2ccccc2 34a_100000211623_100000699184 [0,1,0,0,0,0|3,0,0]=4 179 B21R2.39330 CCCCC(Nc1ccncc1C)c2cccc(c2)F 27a_100015203083_100000765111 [0,1,0,0,0,0|3,0,0]=4 180 B21R2.106968 CN(C)CCC(Nc1ccncc1Br)c2ccccc2 27a_200015187826_100000726257 [0,1,0,0,0,0|3,0,0]=4 181 B21R2.106968 CN(C)CCC(Nc1ccncc1F)c2ccccc2 27a_200015187826_100000035921 [0,1,0,0,0,0|3,0,0]=4 182 B21R2.106968 CN(C)CCC(Nc1ncccc1Br)c2ccccc2 27a_200015187826_100000696092 [0,1,0,0,0,0|3,0,0]=4 183 B21R2.106968 CN(C)CCN(Cc1ccccc1Br)c2ccccc2 269982a_200000219566_100000184730 [0,1,0,0,0,0|3,0,0]=4 184 B21R2.106968 CN(C)CCN(Cc1ccccc1Cl)c2ccccc2 269982a_200000219566_100000187162 [0,1,0,0,0,0|3,0,0]=4 185 B21R2.106968 CN(C)CCN(Cc1ccccc1F)c2ccccc2 269982a_100000224004_100000755713 [0,1,0,0,0,0|3,0,0]=4 186 B21R2.106968 CN(C)CCN(Cc1ccccc1F)c2ccccc2 269982a_200000219566_100000211605 [0,1,0,0,0,0|3,0,0]=4 187 B21R2.106968 CN(C)CCN(Cc1ccccc1I)c2ccccc2 269982a_200000219566_100011215278 [0,1,0,0,0,0|3,0,0]=4 188 B21R2.106968 Cc1ccccc1CN(CCN(C)C)c2ccccc2 269982a_200000219566_100000211839 [0,1,0,0,0,0|2,0,0]=3 189 B21R2.106968 Cc1ccccc1O[C@H](CCN(C)C)c2ccccc2 2230a_100016988935_200000210301 [0,1,0,0,0,0|0,0,0]=1 190 B21R2.106968 Cc1ccccc1O[C@H](CCN(C)C)c2ccccc2 269982a_100016988935_200000210301 [0,1,0,0,0,0|0,0,0]=1 191 B21R2.106968 Cc1ccccc1O[C@H](CCN(C)C)c2ccccc2 34a_100016988935_200000210301 [0,1,0,0,0,0|0,0,0]=1 192 B21R2.106968 Cc1ccccc1O[C@H](CCN(C)C)c2ccccc2 7a_100016988935_200000210301 [0,1,0,0,0,0|0,0,0]=1 193 B21R2.106968 Cc1ccccc1O[C@H](CCN(C)[13CH3])c2ccccc2 2230a_100016988935_200025704644 [0,1,0,0,0,0|0,0,0]=1 194 B21R2.106968 Cc1ccccc1O[C@H](CCN(C)[13CH3])c2ccccc2 269982a_100016988935_200025704644 [0,1,0,0,0,0|0,0,0]=1 195 B21R2.106968 Cc1ccccc1O[C@H](CCN(C)[13CH3])c2ccccc2 34a_100016988935_200025704644 [0,1,0,0,0,0|0,0,0]=1 196 B21R2.106968 Cc1ccccc1O[C@H](CCN(C)[13CH3])c2ccccc2 7a_100016988935_200025704644 [0,1,0,0,0,0|0,0,0]=1 197 B21R2.106968 Cc1cccnc1CN(CCN(C)C)c2ccccc2 269982a_200000219566_100000696600 [0,1,0,0,0,0|3,0,0]=4 198 B21R2.106968 Cc1ccncc1CN(CCN(C)C)c2ccccc2 269982a_200000219566_100000690890 [0,1,0,0,0,0|3,0,0]=4 199 B21R2.106968 Cc1ccnnc1NC(CCN(C)C)c2ccccc2 27a_200015187826_100000089043 [0,1,0,0,0,0|3,0,0]=4 200 B21R2.106968 Cc1cnccc1CN(CCN(C)C)c2ccccc2 269982a_200000219566_100020672808 [0,1,0,0,0,0|3,0,0]=4 201 B21R2.106968 Cc1cnccc1NC(CCN(C)C)c2ccccc2 27a_200015187826_100000765111 [0,1,0,0,0,0|2,0,0]=3 202 B21R2.106968 Cc1cncnc1NC(CCN(C)C)c2ccccc2 27a_200015187826_100011998708 [0,1,0,0,0,0|3,0,0]=4 203 B21R2.106968 Cc1ncccc1CN(CCN(C)C)c2ccccc2 269982a_200000219566_100000732876 [0,1,0,0,0,0|3,0,0]=4 204 B21R2.106968 Cc1nccnc1NC(CCN(C)C)c2ccccc2 27a_200015187826_100011999405 [0,1,0,0,0,0|3,0,0]=4 205 B21R2.114843 CCCCN(C(=O)c1ccccc1C)c2ccccc2 11a_100000211623_100000212026 [0,1,0,0,0,0|3,0,0]=4 206 B21R2.114843 CCCCN(C(=O)c1ccccc1C)c2ccccc2 1626a_100000211623_100000212026 [0,1,0,0,0,0|3,0,0]=4 207 B21R2.114843 CCCCN(C(=O)c1ccccc1C)c2ccccc2 22a_100000211623_100000212026 [0,1,0,0,0,0|3,0,0]=4 208 B21R2.282289 CCOC(=O)C(Oc1ccccc1C)c2ccccc2 34a_100000210338_100000184263 [0,1,0,0,0,0|2,0,1]=4 209 B21R2.282289 CCOC(=O)C(Oc1ccccc1C)c2ccccc2 7a_100000210338_100000709949 [0,1,0,0,0,0|2,0,1]=4 210 B21R2.282289 COCC(C)N(Cc1ccccc1C)c2ccccc2 2230a_100011695367_100000211839 [0,1,0,0,0,0|3,0,0]=4 211 B21R2.282289 COCC(C)N(Cc1ccccc1C)c2ccccc2 269982a_100011695367_100000211839 [0,1,0,0,0,0|3,0,0]=4 212 B21R2.282289 COCC(C)N(Cc1ccccc1C)c2ccccc2 34a_100011695367_100000211839 [0,1,0,0,0,0|3,0,0]=4 213 B21R2.384591 CCCCN(Cc1ccc(cc1C)Br)c2ccccc2 2230a_100000211623_100000708836 [0,1,0,0,0,0|3,0,0]=4 214 B21R2.384591 CCCCN(Cc1ccc(cc1C)Br)c2ccccc2 269982a_100000211623_100000708836 [0,1,0,0,0,0|3,0,0]=4 215 B21R2.384591 CCCCN(Cc1ccc(cc1C)Br)c2ccccc2 34a_100000211623_100000708836 [0,1,0,0,0,0|3,0,0]=4 216 B21R2.384591 CCCCN(Cc1ccc(cc1C)C)c2ccccc2 2230a_100000211623_100011219618 [0,1,0,0,0,0|3,0,0]=4 217 B21R2.384591 CCCCN(Cc1ccc(cc1C)C)c2ccccc2 269982a_100000211623_100011219618 [0,1,0,0,0,0|3,0,0]=4 218 B21R2.384591 CCCCN(Cc1ccc(cc1C)C)c2ccccc2 34a_100000211623_100011219618 [0,1,0,0,0,0|3,0,0]=4 219 B21R2.384591 CCCCN(Cc1ccc(cc1C)Cl)c2ccccc2 2230a_100000211623_100012361307 [0,1,0,0,0,0|3,0,0]=4 220 B21R2.384591 CCCCN(Cc1ccc(cc1C)Cl)c2ccccc2 269982a_100000211623_100012361307 [0,1,0,0,0,0|3,0,0]=4 221 B21R2.384591 CCCCN(Cc1ccc(cc1C)Cl)c2ccccc2 34a_100000211623_100012361307 [0,1,0,0,0,0|3,0,0]=4 222 B21R2.384591 CCCCN(Cc1ccc(cc1C)F)c2ccccc2 2230a_100000211623_100000700533 [0,1,0,0,0,0|3,0,0]=4 223 B21R2.384591 CCCCN(Cc1ccc(cc1C)F)c2ccccc2 269982a_100000211623_100000700533 [0,1,0,0,0,0|3,0,0]=4 224 B21R2.384591 CCCCN(Cc1ccc(cc1C)F)c2ccccc2 34a_100000211623_100000700533 [0,1,0,0,0,0|3,0,0]=4 225 B21R2.3342778 CCCCN(Cc1c(cccc1Br)C)c2ccccc2 2230a_100000211623_100010146847 [0,1,0,0,0,0|3,0,0]=4 226 B21R2.3342778 CCCCN(Cc1c(cccc1Br)C)c2ccccc2 269982a_100000211623_100010146847 [0,1,0,0,0,0|3,0,0]=4 227 B21R2.3342778 CCCCN(Cc1c(cccc1Br)C)c2ccccc2 34a_100000211623_100010146847 [0,1,0,0,0,0|3,0,0]=4 228 B21R2.3342778 CCCCN(Cc1c(cccc1C)C)c2ccccc2 2230a_100000211623_100000758300 [0,1,0,0,0,0|3,0,0]=4 229 B21R2.3342778 CCCCN(Cc1c(cccc1C)C)c2ccccc2 269982a_100000211623_100000758300 [0,1,0,0,0,0|3,0,0]=4 230 B21R2.3342778 CCCCN(Cc1c(cccc1C)C)c2ccccc2 34a_100000211623_100000758300 [0,1,0,0,0,0|3,0,0]=4 231 B21R2.3342778 CCCCN(Cc1c(cccc1F)C)c2ccccc2 2230a_100000211623_100009814554 [0,1,0,0,0,0|3,0,0]=4 232 B21R2.3342778 CCCCN(Cc1c(cccc1F)C)c2ccccc2 269982a_100000211623_100009814554 [0,1,0,0,0,0|3,0,0]=4 233 B21R2.3342778 CCCCN(Cc1c(cccc1F)C)c2ccccc2 34a_100000211623_100009814554 [0,1,0,0,0,0|3,0,0]=4 234 B21R2.3342778 CCCCN(Cc1c(cccc1I)C)c2ccccc2 2230a_100000211623_100010150146 [0,1,0,0,0,0|3,0,0]=4 235 B21R2.3342778 CCCCN(Cc1c(cccc1I)C)c2ccccc2 269982a_100000211623_100010150146 [0,1,0,0,0,0|3,0,0]=4 236 B21R2.3342778 CCCCN(Cc1c(cccc1I)C)c2ccccc2 34a_100000211623_100010150146 [0,1,0,0,0,0|3,0,0]=4 237 B21R3.238 Cc1cnccc1N2CCCCC2c3ccccc3 27a_100000707174_100000765111 [0,0,0,1,0,0|3,0,0]=4 238 B21R3.9050 CCCCN(c1ccccc1)C2Cc3c2cccc3 269982a_100000211623_100009813401 [0,0,0,1,0,0|3,0,0]=4 239 B21R3.217866 Cc1cnccc1N[C@@H](c2ccccc2)C3CCC3 27a_100025717287_100000765111 [0,0,0,1,0,0|3,0,0]=4 240 B21R3.442232 Cc1cnccc1NC2(CCCC2)c3ccccc3 27a_100025739779_100000765111 [0,0,0,1,0,0|3,0,0]=4 241 B19R2.4625 C#CCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000038162 [0,0,0,0,1,0|2,0,1]=4 242 B19R2.4625 C#CCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000184674 [0,0,0,0,1,0|2,0,1]=4 243 B19R2.4625 C#CCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000184674 [0,0,0,0,1,0|2,0,1]=4 244 B19R2.4625 C#CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000038162 [0,0,0,0,1,0|2,0,1]=4 245 B19R2.4625 C#CCSC(c1ccccc1)c2ccccc2C 62a_100000038162_100000230135 [0,0,0,0,1,0|2,0,1]=4 246 B19R2.4625 C=CCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000210623 [0,0,0,0,1,0|2,0,1]=4 247 B19R2.4625 C=CCNC(c1ccccc1)c2ccccc2C 2230a_100020586998_100000230135 [0,0,0,0,1,0|2,0,1]=4 248 B19R2.4625 C=CCNC(c1ccccc1)c2ccccc2C 270004a_100020586998_100000735561 [0,0,0,0,1,0|2,0,1]=4 249 B19R2.4625 C=CCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100015514636 [0,0,0,0,1,0|2,0,1]=4 250 B19R2.4625 C=CCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100015514636 [0,0,0,0,1,0|2,0,1]=4 251 B19R2.4625 C=CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100015514636 [0,0,0,0,1,0|2,0,1]=4 252 B19R2.4625 C=CCSC(c1ccccc1)c2ccccc2C 62a_100000210623_100000230135 [0,0,0,0,1,0|2,0,1]=4 253 B19R2.4625 C=CCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000210623 [0,0,0,0,1,0|2,0,1]=4 254 B19R2.4625 CCCCN(c1ccccc1)c2ccncc2C 27a_100000211623_100000765111 [0,0,0,0,1,0|3,0,0]=4 255 B19R2.4625 CCCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000210303 [0,0,0,0,1,0|3,0,0]=4 256 B19R2.4625 CCCNC(c1ccccc1)c2ccccc2Br 270004a_100020643023_100000198044 [0,0,0,0,1,0|3,0,0]=4 257 B19R2.4625 CCCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000210303 [0,0,0,0,1,0|3,0,0]=4 258 B19R2.4625 CCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000210303 [0,0,0,0,1,0|2,0,0]=3 259 B19R2.4625 CCCNC(c1ccccc1)c2ccccc2C 270004a_100020643023_100000735561 [0,0,0,0,1,0|2,0,0]=3 260 B19R2.4625 CCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000210303 [0,0,0,0,1,0|2,0,0]=3 261 B19R2.4625 CCCNC(c1ccccc1)c2ccccc2Cl 270004a_100020643023_100011215288 [0,0,0,0,1,0|3,0,0]=4 262 B19R2.4625 CCCNC(c1ccccc1)c2ccccc2F 270004a_100020643023_100011217773 [0,0,0,0,1,0|3,0,0]=4 263 B19R2.4625 CCCNC(c1ccncc1)c2ccccc2C 2230a_100015184055_100000210303 [0,0,0,0,1,0|3,0,0]=4 264 B19R2.4625 CCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000210303 [0,0,0,0,1,0|2,0,0]=3 265 B19R2.4625 CCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000210303 [0,0,0,0,1,0|2,0,0]=3 266 B19R2.4625 CCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000210303 [0,0,0,0,1,0|3,0,0]=4 267 B19R2.4625 CCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000210303 [0,0,0,0,1,0|3,0,0]=4 268 B19R2.4625 CCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000210303 [0,0,0,0,1,0|3,0,0]=4 269 B19R2.4625 CCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000210303 [0,0,0,0,1,0|3,0,0]=4 270 B19R2.4625 CCCSC(c1ccccc1)c2ccccc2C 62a_100000210303_100000230135 [0,0,0,0,1,0|2,0,0]=3 271 B19R2.4625 CCCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000210303 [0,0,0,0,1,0|2,0,0]=3 272 B19R2.4625 COCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000766300 [0,0,0,0,1,0|3,0,0]=4 273 B19R2.4625 COCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000766300 [0,0,0,0,1,0|2,0,0]=3 274 B19R2.4625 COCNC(c1ccncc1)c2ccccc2C 2230a_100015184055_100000766300 [0,0,0,0,1,0|3,0,0]=4 275 B19R2.4625 COCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000766300 [0,0,0,0,1,0|2,0,0]=3 276 B19R2.4625 COCSC(c1ccccc1)c2ccccc2C 62a_100000766300_100000230135 [0,0,0,0,1,0|2,0,0]=3 277 B19R2.4625 CSCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100011218213 [0,0,0,0,1,0|3,0,0]=4 278 B19R2.4625 CSCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100011218213 [0,0,0,0,1,0|3,0,0]=4 279 B19R2.4625 CSCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100011218213 [0,0,0,0,1,0|2,0,0]=3 280 B19R2.4625 CSCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100011218213 [0,0,0,0,1,0|2,0,0]=3 281 B19R2.4625 CSCNC(c1ccncc1)c2ccccc2C 2230a_100015184055_100011218213 [0,0,0,0,1,0|3,0,0]=4 282 B19R2.4625 CSCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100011218213 [0,0,0,0,1,0|2,0,0]=3 283 B19R2.4625 CSCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100011218213 [0,0,0,0,1,0|3,0,0]=4 284 B19R2.4625 CSCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100011218213 [0,0,0,0,1,0|3,0,0]=4 285 B19R2.4625 CSCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100011218213 [0,0,0,0,1,0|2,0,0]=3 286 B19R2.4625 CSCSC(c1ccccc1)c2ccccc2C 62a_100011218213_100000230135 [0,0,0,0,1,0|2,0,0]=3 287 B19R2.4625 Cc1ccccc1C(NCC#N)c2ccccc2 2230a_100000222801_100011215382 [0,0,0,0,1,0|3,0,0]=4 288 B19R2.4625 Cc1ccccc1C(NCC=O)c2ccccc2 2230a_100000222801_200015260668 [0,0,0,0,1,0|3,0,0]=4 289 B19R2.4625 Cc1ccccc1C(NCC=O)c2ccccc2 34a_100000222801_200009817547 [0,0,0,0,1,0|3,0,0]=4 290 B19R2.4625 Cc1ccccc1C(NCCF)c2ccccc2 2230a_100000222801_100011217306 [0,0,0,0,1,0|3,0,0]=4 291 B19R2.4625 Cc1ccccc1C(NCCF)c2ccccc2 34a_100000222801_100011217306 [0,0,0,0,1,0|3,0,0]=4 292 B19R2.4625 Cc1ccccc1C(NCCO)c2ccccc2 2230a_100000222801_100000211926 [0,0,0,0,1,0|3,0,0]=4 293 B19R2.4625 Cc1ccccc1C(NCCO)c2ccccc2 2230a_100016997473_100000230135 [0,0,0,0,1,0|3,0,0]=4 294 B19R2.4625 Cc1ccccc1C(NCCO)c2ccccc2 270004a_100000210304_100000735561 [0,0,0,0,1,0|3,0,0]=4 295 B19R2.4625 Cc1ccccc1C(NCCO)c2ccccc2 34a_100000222801_100000211926 [0,0,0,0,1,0|3,0,0]=4 296 B19R2.4625 Cc1ccccc1C(OCC#N)c2ccccc2 7a_100000212071_100011215382 [0,0,0,0,1,0|3,0,0]=4 297 B19R2.4625 Cc1ccccc1C(OCC=O)c2ccccc2 34a_100000212071_200009817547 [0,0,0,0,1,0|3,0,0]=4 298 B19R2.4625 Cc1ccccc1C(OCC=O)c2ccccc2 7a_100000212071_200015260668 [0,0,0,0,1,0|3,0,0]=4 299 B19R2.4625 Cc1ccccc1C(OCCF)c2ccccc2 34a_100000212071_100011217306 [0,0,0,0,1,0|3,0,0]=4 300 B19R2.4625 Cc1ccccc1C(OCCF)c2ccccc2 7a_100000212071_100011217306 [0,0,0,0,1,0|3,0,0]=4 301 B19R2.4625 Cc1ccccc1C(OCCO)c2ccccc2 34a_100000212071_100000211926 [0,0,0,0,1,0|3,0,0]=4 302 B19R2.4625 Cc1ccccc1C(OCCO)c2ccccc2 7a_100000212071_100000211926 [0,0,0,0,1,0|3,0,0]=4 303 B19R2.4625 Cc1ccccc1C(SCC#N)c2ccccc2 62a_100000230135_100011215382 [0,0,0,0,1,0|3,0,0]=4 304 B19R2.4625 Cc1ccccc1C(SCC#N)c2ccccc2 62a_100011215382_100000230135 [0,0,0,0,1,0|3,0,0]=4 305 B19R2.4625 Cc1ccccc1C(SCC=O)c2ccccc2 62a_100000230135_200015260668 [0,0,0,0,1,0|3,0,0]=4 306 B19R2.4625 Cc1ccccc1C(SCC=O)c2ccccc2 62a_200015260668_100000230135 [0,0,0,0,1,0|3,0,0]=4 307 B19R2.4625 Cc1ccccc1C(SCCF)c2ccccc2 62a_100000230135_100011217306 [0,0,0,0,1,0|3,0,0]=4 308 B19R2.4625 Cc1ccccc1C(SCCF)c2ccccc2 62a_100011217306_100000230135 [0,0,0,0,1,0|3,0,0]=4 309 B19R2.4625 Cc1ccccc1C(SCCO)c2ccccc2 62a_100000211926_100000230135 [0,0,0,0,1,0|3,0,0]=4 310 B19R2.4625 Cc1ccccc1C(SCCO)c2ccccc2 62a_100000230135_100000211926 [0,0,0,0,1,0|3,0,0]=4 311 B21R2.39234 CCCCN(Cc1ccccc1)Cc2ccccc2C 2230a_100000187337_100000210211 [0,0,0,0,0,1|3,0,0]=4 312 B21R2.39234 CCCCN(Cc1ccccc1)Cc2ccccc2C 2230a_100015184623_100015291786 [0,0,0,0,0,1|3,0,0]=4 313 B21R2.39234 CCCCN(Cc1ccccc1)Cc2ccccc2C 2230a_200000196024_100000211839 [0,0,0,0,0,1|3,0,0]=4 314 B21R2.39234 CCCCN(Cc1ccccc1)Cc2ccccc2C 269982a_100000187337_100000210211 [0,0,0,0,0,1|3,0,0]=4 315 B21R2.39234 CCCCN(Cc1ccccc1)Cc2ccccc2C 269982a_100015184623_100000211182 [0,0,0,0,0,1|3,0,0]=4 316 B21R2.39234 CCCCN(Cc1ccccc1)Cc2ccccc2C 269982a_200000196024_100000211839 [0,0,0,0,0,1|3,0,0]=4 317 B21R2.39234 CCCCN(Cc1ccccc1)Cc2ccccc2C 270004a_100015184623_100015611070 [0,0,0,0,0,1|3,0,0]=4 318 B21R2.39234 CCCCN(Cc1ccccc1)Cc2ccccc2C 270004a_200000196024_100000211143 [0,0,0,0,0,1|3,0,0]=4 319 B21R2.39234 CCCCN(Cc1ccccc1)Cc2ccccc2C 34a_100000187337_100000210210 [0,0,0,0,0,1|3,0,0]=4 320 B21R2.39234 COCCN(Cc1ccccc1)Cc2ccccc2C 2230a_100000187337_100011201679 [0,0,0,0,0,1|3,0,0]=4 321 B21R2.39234 COCCN(Cc1ccccc1)Cc2ccccc2C 269982a_100000187337_100000233755 [0,0,0,0,0,1|3,0,0]=4 322 B21R2.39234 COCCN(Cc1ccccc1)Cc2ccccc2C 34a_100000187337_100011201679 [0,0,0,0,0,1|3,0,0]=4 323 B21R2.39234 CSCCN(Cc1ccccc1)Cc2ccccc2C 2230a_100000187337_100000751147 [0,0,0,0,0,1|3,0,0]=4 324 B21R2.39234 CSCCN(Cc1ccccc1)Cc2ccccc2C 269982a_100000187337_100000212216 [0,0,0,0,0,1|3,0,0]=4 325 B21R2.39234 CSCCN(Cc1ccccc1)Cc2ccccc2C 34a_100000187337_100000212216 [0,0,0,0,0,1|3,0,0]=4 326 B21R2.112198 CCCCC(=NNc1ccccc1C)c2ccccc2 4a_100000184220_100000211663 [0,0,0,0,0,1|2,0,1]=4 327 B21R2.112198 CCCCC(NCc1ccccc1Br)c2ccccc2 269862a_100000689332_100000211663 [0,0,0,0,0,1|3,0,0]=4 328 B21R2.112198 CCCCC(NCc1ccccc1C)c2ccccc2 269862a_100000174972_100000211663 [0,0,0,0,0,1|2,0,0]=3 329 B21R2.112198 CCCCC(NCc1ccccc1C)c2cccnc2 207a_200011711859_100000211143 [0,0,0,0,0,1|3,0,0]=4 330 B21R2.112198 CCCCC(NCc1ccccc1C)c2cccnc2 2230a_200011711859_100000211839 [0,0,0,0,0,1|3,0,0]=4 331 B21R2.112198 CCCCC(NCc1ccccc1C)c2cccnc2 269862a_100000174972_200011709925 [0,0,0,0,0,1|3,0,0]=4 332 B21R2.112198 CCCCC(NCc1ccccc1C)c2cccnc2 270004a_200011711859_100000211143 [0,0,0,0,0,1|3,0,0]=4 333 B21R2.112198 CCCCC(NCc1ccccc1C)c2ccncc2 207a_100015203128_100000211143 [0,0,0,0,0,1|3,0,0]=4 334 B21R2.112198 CCCCC(NCc1ccccc1C)c2ccncc2 2230a_100015203128_100000211839 [0,0,0,0,0,1|3,0,0]=4 335 B21R2.112198 CCCCC(NCc1ccccc1C)c2ccncc2 270004a_100015203128_100000211143 [0,0,0,0,0,1|3,0,0]=4 336 B21R2.112198 CCCCC(NCc1ccccc1Cl)c2ccccc2 269862a_100000174879_100000211663 [0,0,0,0,0,1|3,0,0]=4 337 B21R2.112198 CCCCC(NCc1ccccc1F)c2ccccc2 269862a_100000174869_100000211663 [0,0,0,0,0,1|3,0,0]=4 338 B21R2.112198 CCCCC(NCc1ccccc1I)c2ccccc2 269862a_100015347259_100000211663 [0,0,0,0,0,1|3,0,0]=4 339 B21R2.112198 CCCCC(NCc1ccccc1O)c2ccccc2 269862a_100000185550_100000211663 [0,0,0,0,0,1|3,0,0]=4 340 B21R2.112198 CCCCC(NCc1ccncc1C)c2ccccc2 269862a_100000708811_100000211663 [0,0,0,0,0,1|3,0,0]=4 341 B21R2.112198 CCCCC(NCc1cnccc1C)c2ccccc2 269862a_100011997553_100000211663 [0,0,0,0,0,1|3,0,0]=4 342 B21R2.112198 CCCCC(OCc1ccccc1Br)c2ccccc2 34a_100000698411_100000184730 [0,0,0,0,0,1|2,0,0]=3 343 B21R2.112198 CCCCC(OCc1ccccc1Br)c2ccccc2 7a_100000698411_100000184730 [0,0,0,0,0,1|2,0,0]=3 344 B21R2.112198 CCCCC(OCc1ccccc1C)c2ccccc2 34a_100000698411_100000211839 [0,0,0,0,0,1|1,0,0]=2 345 B21R2.112198 CCCCC(OCc1ccccc1C)c2ccccc2 7a_100000698411_100000211839 [0,0,0,0,0,1|1,0,0]=2 346 B21R2.112198 CCCCC(OCc1ccccc1Cl)c2ccccc2 34a_100000698411_100000187162 [0,0,0,0,0,1|2,0,0]=3 347 B21R2.112198 CCCCC(OCc1ccccc1Cl)c2ccccc2 7a_100000698411_100000187162 [0,0,0,0,0,1|2,0,0]=3 348 B21R2.112198 CCCCC(OCc1ccccc1F)c2ccccc2 34a_100000698411_100000211605 [0,0,0,0,0,1|2,0,0]=3 349 B21R2.112198 CCCCC(OCc1ccccc1F)c2ccccc2 7a_100000698411_100000211605 [0,0,0,0,0,1|2,0,0]=3 350 B21R2.112198 CCCCC(OCc1ccccc1I)c2ccccc2 34a_100000698411_100011215278 [0,0,0,0,0,1|2,0,0]=3 351 B21R2.112198 CCCCC(OCc1ccccc1I)c2ccccc2 7a_100000698411_100011215278 [0,0,0,0,0,1|2,0,0]=3 352 B21R2.112198 CCCCC(OCc1cccnc1Br)c2ccccc2 34a_100000698411_100010140945 [0,0,0,0,0,1|3,0,0]=4 353 B21R2.112198 CCCCC(OCc1cccnc1Br)c2ccccc2 7a_100000698411_100010140945 [0,0,0,0,0,1|3,0,0]=4 354 B21R2.112198 CCCCC(OCc1cccnc1C)c2ccccc2 34a_100000698411_100000732876 [0,0,0,0,0,1|2,0,0]=3 355 B21R2.112198 CCCCC(OCc1cccnc1C)c2ccccc2 7a_100000698411_100000732876 [0,0,0,0,0,1|2,0,0]=3 356 B21R2.112198 CCCCC(OCc1cccnc1Cl)c2ccccc2 34a_100000698411_100000045678 [0,0,0,0,0,1|3,0,0]=4 357 B21R2.112198 CCCCC(OCc1cccnc1Cl)c2ccccc2 7a_100000698411_100000045678 [0,0,0,0,0,1|3,0,0]=4 358 B21R2.112198 CCCCC(OCc1cccnc1F)c2ccccc2 34a_100000698411_100000099810 [0,0,0,0,0,1|3,0,0]=4 359 B21R2.112198 CCCCC(OCc1cccnc1F)c2ccccc2 7a_100000698411_100000099810 [0,0,0,0,0,1|3,0,0]=4 360 B21R2.112198 CCCCC(OCc1ccncc1C)c2ccccc2 34a_100000698411_100020672809 [0,0,0,0,0,1|2,0,0]=3 361 B21R2.112198 CCCCC(OCc1ccncc1C)c2ccccc2 7a_100000698411_100020672808 [0,0,0,0,0,1|2,0,0]=3 362 B21R2.112198 CCCCC(OCc1ccncc1Cl)c2ccccc2 7a_100000698411_100000763264 [0,0,0,0,0,1|3,0,0]=4 363 B21R2.112198 CCCCC(OCc1cnccc1C)c2ccccc2 34a_100000698411_100000690890 [0,0,0,0,0,1|2,0,0]=3 364 B21R2.112198 CCCCC(OCc1cnccc1C)c2ccccc2 7a_100000698411_100000690890 [0,0,0,0,0,1|2,0,0]=3 365 B21R2.112198 CCCCC(OCc1ncccc1Br)c2ccccc2 34a_100000698411_100025702911 [0,0,0,0,0,1|3,0,0]=4 366 B21R2.112198 CCCCC(OCc1ncccc1Br)c2ccccc2 7a_100000698411_100025702911 [0,0,0,0,0,1|3,0,0]=4 367 B21R2.112198 CCCCC(OCc1ncccc1C)c2ccccc2 34a_100000698411_100000696600 [0,0,0,0,0,1|2,0,0]=3 368 B21R2.112198 CCCCC(OCc1ncccc1C)c2ccccc2 7a_100000698411_100000696600 [0,0,0,0,0,1|2,0,0]=3 369 B21R2.112198 CCCCC(OCc1ncccc1Cl)c2ccccc2 7a_100000698411_100000099807 [0,0,0,0,0,1|3,0,0]=4 370 B21R2.112198 CCCCC(OCc1ncccc1F)c2ccccc2 34a_100000698411_100000104219 [0,0,0,0,0,1|3,0,0]=4 371 B21R2.112198 CCCCC(OCc1ncccc1F)c2ccccc2 7a_100000698411_100000104219 [0,0,0,0,0,1|3,0,0]=4 372 B21R2.112198 CCCCC(OCc1ncccc1O)c2ccccc2 34a_100000698411_200020655725 [0,0,0,0,0,1|3,0,0]=4 373 B21R2.112198 CCCCC(OCc1ncccc1O)c2ccccc2 7a_100000698411_200020655725 [0,0,0,0,0,1|3,0,0]=4 374 B21R2.112198 CCCCN(CCc1ccccc1C)c2ccccc2 2230a_100000211623_100011713688 [0,0,0,0,0,1|3,0,0]=4 375 B21R2.112198 CCCCN(CCc1ccccc1C)c2ccccc2 269982a_100000211623_100011713688 [0,0,0,0,0,1|3,0,0]=4 376 B21R2.112198 CCCCN(CCc1ccccc1C)c2ccccc2 34a_100000211623_100011713688 [0,0,0,0,0,1|3,0,0]=4 377 B21R2.112198 CNCCC(NCc1ccccc1Br)c2ccccc2 269862a_100000689332_100015249630 [0,0,0,0,0,1|2,0,0]=3 378 B21R2.112198 CNCCC(NCc1ccccc1C)c2ccccc2 269862a_100000174972_100015249630 [0,0,0,0,0,1|1,0,0]=2 379 B21R2.112198 CNCCC(NCc1ccccc1Cl)c2ccccc2 269862a_100000174879_100015249630 [0,0,0,0,0,1|2,0,0]=3 380 B21R2.112198 CNCCC(NCc1ccccc1F)c2ccccc2 269862a_100000174869_100015249630 [0,0,0,0,0,1|2,0,0]=3 381 B21R2.112198 CNCCC(NCc1ccccc1I)c2ccccc2 269862a_100015347259_100015249630 [0,0,0,0,0,1|2,0,0]=3 382 B21R2.112198 CNCCC(NCc1ccccc1O)c2ccccc2 269862a_100000185550_100015249630 [0,0,0,0,0,1|2,0,0]=3 383 B21R2.112198 CNCCC(NCc1cccnc1Br)c2ccccc2 269862a_100009818023_100015249630 [0,0,0,0,0,1|3,0,0]=4 384 B21R2.112198 CNCCC(NCc1cccnc1Cl)c2ccccc2 269862a_100015189234_100015249630 [0,0,0,0,0,1|3,0,0]=4 385 B21R2.112198 CNCCC(NCc1cccnc1F)c2ccccc2 269862a_100000724633_100015249630 [0,0,0,0,0,1|3,0,0]=4 386 B21R2.112198 CNCCC(NCc1ccncc1Br)c2ccccc2 269862a_100020640021_100015249630 [0,0,0,0,0,1|3,0,0]=4 387 B21R2.112198 CNCCC(NCc1ccncc1C)c2ccccc2 269862a_100000708811_100015249630 [0,0,0,0,0,1|2,0,0]=3 388 B21R2.112198 CNCCC(NCc1ccncc1F)c2ccccc2 269862a_100011935246_100015249630 [0,0,0,0,0,1|3,0,0]=4 389 B21R2.112198 CNCCC(NCc1cnccc1C)c2ccccc2 269862a_100011997553_100015249630 [0,0,0,0,0,1|2,0,0]=3 390 B21R2.112198 Cc1ccccc1CNC(CCCO)c2ccccc2 207a_100000759318_100000211143 [0,0,0,0,0,1|3,0,0]=4 391 B21R2.112198 Cc1ccccc1CNC(CCCO)c2ccccc2 2230a_100000759318_100000211839 [0,0,0,0,0,1|3,0,0]=4 392 B21R2.112198 Cc1ccccc1CNC(CCCO)c2ccccc2 270004a_100000759318_100000211143 [0,0,0,0,0,1|3,0,0]=4 393 B21R2.112198 Cc1ccccc1CNC(CCCO)c2ccccc2 34a_100000759318_100000211839 [0,0,0,0,0,1|3,0,0]=4 394 B18R2.358 CCCN(Cc1ccccc1)c2ccccc2 2230a_100000188819_100000210303 [2,0,0,0,0,0|2,0,0]=4 395 B18R2.358 CCCN(Cc1ccccc1)c2ccccc2 2230a_200011218496_100015291786 [2,0,0,0,0,0|2,0,0]=4 396 B18R2.358 CCCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000210303 [2,0,0,0,0,0|2,0,0]=4 397 B18R2.358 CCCN(Cc1ccccc1)c2ccccc2 269982a_200011218496_100000211182 [2,0,0,0,0,0|2,0,0]=4 398 B18R2.358 CCCN(Cc1ccccc1)c2ccccc2 34a_100000188819_100000210303 [2,0,0,0,0,0|2,0,0]=4 399 B18R2.358 CCCN(Cc1ccccc1)c2ccccc2 34a_200011218496_100015291786 [2,0,0,0,0,0|2,0,0]=4 400 B18R2.358 CCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000210202 [2,0,0,0,0,0|2,0,0]=4 401 B18R2.358 CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000210202 [2,0,0,0,0,0|2,0,0]=4 402 B18R2.358 CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000210202 [2,0,0,0,0,0|2,0,0]=4 403 B18R2.358 ClCCC(Oc1ccccc1)c2ccccc2 7a_100000210340_200010132975 [2,0,0,0,0,0|1,0,0]=3 404 B18R2.358 ClCCC(Oc1cccnc1)c2ccccc2 7a_100000210849_200010132975 [2,0,0,0,0,0|2,0,0]=4 405 B18R2.358 ClCCC(Sc1ccccc1)c2ccccc2 62a_100000719477_200010132975 [2,0,0,0,0,0|1,1,0]=4 406 B18R2.358 ClCCC(Sc1ccccc1)c2ccccc2 62a_200010132975_100000041952 [2,0,0,0,0,0|1,1,0]=4 407 B18R2.7830 CCC(Nc1ccncc1C)c2ccccc2 27a_100000737752_100000765111 [2,0,0,0,0,0|2,0,0]=4 408 B18R2.7830 CCN(Cc1ccccc1C)c2ccccc2 2230a_100000210013_100000211839 [2,0,0,0,0,0|2,0,0]=4 409 B18R2.7830 CCN(Cc1ccccc1C)c2ccccc2 269982a_100000210013_100000211839 [2,0,0,0,0,0|2,0,0]=4 410 B18R2.7830 CCN(Cc1ccccc1C)c2ccccc2 34a_100000210013_100000211839 [2,0,0,0,0,0|2,0,0]=4 411 B20R2.1362 CCCC(Nc1cc(ncc1C)F)c2ccccc2 27a_100000189686_100000049870 [1,1,0,0,0,0|2,0,0]=4 412 B20R2.1362 CCCN(Cc1cc(ccc1C)C)c2ccccc2 2230a_200011218496_100000184699 [1,1,0,0,0,0|2,0,0]=4 413 B20R2.1362 CCCN(Cc1cc(ccc1C)C)c2ccccc2 269982a_200011218496_100000184699 [1,1,0,0,0,0|2,0,0]=4 414 B20R2.1362 CCCN(Cc1cc(ccc1C)C)c2ccccc2 34a_200011218496_100000184699 [1,1,0,0,0,0|2,0,0]=4 415 B20R2.1362 CCCN(Cc1cc(ccc1C)Cl)c2ccccc2 2230a_200011218496_100012186985 [1,1,0,0,0,0|2,0,0]=4 416 B20R2.1362 CCCN(Cc1cc(ccc1C)Cl)c2ccccc2 269982a_200011218496_100012186985 [1,1,0,0,0,0|2,0,0]=4 417 B20R2.1362 CCCN(Cc1cc(ccc1C)Cl)c2ccccc2 34a_200011218496_100012186985 [1,1,0,0,0,0|2,0,0]=4 418 B20R2.1362 CCCN(Cc1cc(ccc1C)F)c2ccccc2 2230a_200011218496_100000709795 [1,1,0,0,0,0|2,0,0]=4 419 B20R2.1362 CCCN(Cc1cc(ccc1C)F)c2ccccc2 269982a_200011218496_100000709795 [1,1,0,0,0,0|2,0,0]=4 420 B20R2.1362 CCCN(Cc1cc(ccc1C)F)c2ccccc2 34a_200011218496_100000709795 [1,1,0,0,0,0|2,0,0]=4 421 B20R2.1362 Cc1ccc(c(c1)NC(CCCl)c2ccccc2)C 2230a_100000185781_200010132975 [1,1,0,0,0,0|2,0,0]=4 422 B20R2.1362 Cc1ccc(c(c1)NC(CCCl)c2ccccc2)C 7a_100000185781_200010132975 [1,1,0,0,0,0|2,0,0]=4 423 B20R2.1362 Cc1ccc(c(c1)OC(CCCl)c2ccccc2)Br 7a_100012002257_200010132975 [1,1,0,0,0,0|2,0,0]=4 424 B20R2.1362 Cc1ccc(c(c1)OC(CCCl)c2ccccc2)C 7a_100000210931_200010132975 [1,1,0,0,0,0|1,0,0]=3 425 B20R2.1362 Cc1ccc(c(c1)OC(CCCl)c2ccccc2)Cl 7a_100000211493_200010132975 [1,1,0,0,0,0|2,0,0]=4 426 B20R2.1362 Cc1ccc(c(c1)OC(CCCl)c2ccccc2)F 7a_100000759540_200010132975 [1,1,0,0,0,0|2,0,0]=4 427 B20R2.1362 Cc1ccc(c(c1)OC(CCCl)c2ccccc2)N 7a_100000211527_200010132975 [1,1,0,0,0,0|2,0,0]=4 428 B20R2.1362 Cc1ccc(c(c1)SC(CCCl)c2ccccc2)C 62a_100000210833_200010132975 [1,1,0,0,0,0|1,1,0]=4 429 B20R2.1362 Cc1ccc(c(c1)SC(CCCl)c2ccccc2)C 62a_200010132975_100000210833 [1,1,0,0,0,0|1,1,0]=4 430 B20R2.1362 Cc1ccc(cc1NC(CCCl)c2ccccc2)Br 7a_100000741167_200010132975 [1,1,0,0,0,0|2,0,0]=4 431 B20R2.1362 Cc1ccc(cc1NC(CCCl)c2ccccc2)Cl 7a_100000211374_200010132975 [1,1,0,0,0,0|2,0,0]=4 432 B20R2.1362 Cc1ccc(cc1NC(CCCl)c2ccccc2)F 7a_100000211107_200010132975 [1,1,0,0,0,0|2,0,0]=4 433 B20R2.1362 Cc1ccc(cc1NC(CCCl)c2ccccc2)I 7a_100000761890_200010132975 [1,1,0,0,0,0|2,0,0]=4 434 B20R2.1362 Cc1ccc(cc1OC(CCCl)c2ccccc2)Br 7a_100000685420_200010132975 [1,1,0,0,0,0|1,0,0]=3 435 B20R2.1362 Cc1ccc(cc1OC(CCCl)c2ccccc2)Cl 7a_100000756515_200010132975 [1,1,0,0,0,0|1,0,0]=3 436 B20R2.1362 Cc1ccc(cc1OC(CCCl)c2ccccc2)F 7a_100000690566_200010132975 [1,1,0,0,0,0|1,0,0]=3 437 B20R2.1362 Cc1ccc(cc1OC(CCCl)c2ccccc2)I 7a_100000766334_200010132975 [1,1,0,0,0,0|1,0,0]=3 438 B20R2.1362 Cc1ccc(cc1OC(CCCl)c2ccccc2)N 7a_100000759471_200010132975 [1,1,0,0,0,0|1,0,0]=3 439 B20R2.1362 Cc1ccc(cc1SC(CCCl)c2ccccc2)F 62a_100011218078_200010132975 [1,1,0,0,0,0|1,1,0]=4 440 B20R2.1362 Cc1ccc(cc1SC(CCCl)c2ccccc2)F 62a_200010132975_100011218078 [1,1,0,0,0,0|1,1,0]=4 441 B20R2.1362 Cc1ccc(cc1SC(CCCl)c2ccccc2)N 62a_100000736455_200010132975 [1,1,0,0,0,0|1,1,0]=4 442 B20R2.1362 Cc1ccc(cc1SC(CCCl)c2ccccc2)N 62a_200010132975_100000736455 [1,1,0,0,0,0|1,1,0]=4 443 B20R2.1362 Cc1ccc(cc1SC(CCCl)c2ccccc2)O 62a_100011380479_200010132975 [1,1,0,0,0,0|1,1,0]=4 444 B20R2.1362 Cc1ccc(cc1SC(CCCl)c2ccccc2)O 62a_200010132975_100011380479 [1,1,0,0,0,0|1,1,0]=4 445 B20R2.1362 Cc1cnc(cc1OC(CCCl)c2ccccc2)Br 7a_100000704368_200010132975 [1,1,0,0,0,0|2,0,0]=4 446 B20R2.1362 Cc1ncc(cc1OC(CCCl)c2ccccc2)Br 7a_100009864810_200010132975 [1,1,0,0,0,0|2,0,0]=4 447 B20R2.1362 ClCCC(Oc1cc(ccc1Br)Br)c2ccccc2 7a_100011220040_200010132975 [1,1,0,0,0,0|2,0,0]=4 448 B20R2.1362 ClCCC(Oc1cc(ccc1Br)Cl)c2ccccc2 7a_100012339455_200010132975 [1,1,0,0,0,0|2,0,0]=4 449 B20R2.1362 ClCCC(Oc1cc(ccc1Br)I)c2ccccc2 7a_100012356990_200010132975 [1,1,0,0,0,0|2,0,0]=4 450 B20R2.1362 ClCCC(Oc1cc(ccc1Cl)Br)c2ccccc2 7a_100000738945_200010132975 [1,1,0,0,0,0|2,0,0]=4 451 B20R2.1362 ClCCC(Oc1cc(ccc1Cl)Cl)c2ccccc2 7a_100000211422_200010132975 [1,1,0,0,0,0|2,0,0]=4 452 B20R2.1362 ClCCC(Oc1cc(ccc1Cl)I)c2ccccc2 7a_100011356854_200010132975 [1,1,0,0,0,0|2,0,0]=4 453 B20R2.1362 ClCCC(Oc1cc(ccc1I)Br)c2ccccc2 7a_100012344904_200010132975 [1,1,0,0,0,0|2,0,0]=4 454 B20R2.1362 ClCCC(Oc1cc(ccc1I)Cl)c2ccccc2 7a_100000050036_200010132975 [1,1,0,0,0,0|2,0,0]=4 455 B20R2.1362 Fc1ccc(c(c1)OC(CCCl)c2ccccc2)Br 7a_100000690578_200010132975 [1,1,0,0,0,0|2,0,0]=4 456 B20R2.1362 Fc1ccc(c(c1)OC(CCCl)c2ccccc2)Cl 7a_100000692107_200010132975 [1,1,0,0,0,0|2,0,0]=4 457 B20R2.1362 Fc1ccc(c(c1)OC(CCCl)c2ccccc2)F 7a_100000752141_200010132975 [1,1,0,0,0,0|2,0,0]=4 458 B20R2.1362 Fc1ccc(c(c1)OC(CCCl)c2ccccc2)I 7a_100010084537_200010132975 [1,1,0,0,0,0|2,0,0]=4 459 B20R2.1362 Fc1ccc(cc1OC(CCCl)c2ccccc2)Br 7a_100000686035_200010132975 [1,1,0,0,0,0|2,0,0]=4 460 B20R2.1362 Fc1ccc(cc1OC(CCCl)c2ccccc2)Cl 7a_100000757397_200010132975 [1,1,0,0,0,0|2,0,0]=4 461 B20R2.1362 Fc1ccc(cc1OC(CCCl)c2ccccc2)I 7a_100009958187_200010132975 [1,1,0,0,0,0|2,0,0]=4 462 B20R2.1362 Nc1ccc(c(c1)OC(CCCl)c2ccccc2)F 7a_100012017398_200010132975 [1,1,0,0,0,0|2,0,0]=4 463 B20R2.1362 Nc1ccc(cc1OC(CCCl)c2ccccc2)Br 7a_100000739049_200010132975 [1,1,0,0,0,0|2,0,0]=4 464 B20R2.1362 Nc1ccc(cc1OC(CCCl)c2ccccc2)Cl 7a_100000185728_200010132975 [1,1,0,0,0,0|2,0,0]=4 465 B20R2.1362 Nc1ccc(cc1OC(CCCl)c2ccccc2)F 7a_100000753323_200010132975 [1,1,0,0,0,0|2,0,0]=4 466 B20R2.1362 Nc1ccc(cc1OC(CCCl)c2ccccc2)I 7a_100000057187_200010132975 [1,1,0,0,0,0|2,0,0]=4 467 B20R2.1468 CCCC(Nc1ccnc(c1C)F)c2ccccc2 27a_100000189686_100010006593 [1,1,0,0,0,0|2,0,0]=4 468 B20R2.1468 CCCC(Nc1nccc(c1C)F)c2ccccc2 27a_100000189686_100009846374 [1,1,0,0,0,0|2,0,0]=4 469 B20R2.1468 CCCN(Cc1cccc(c1C)Br)c2ccccc2 2230a_200011218496_100000694682 [1,1,0,0,0,0|2,0,0]=4 470 B20R2.1468 CCCN(Cc1cccc(c1C)Br)c2ccccc2 269982a_200011218496_100000694682 [1,1,0,0,0,0|2,0,0]=4 471 B20R2.1468 CCCN(Cc1cccc(c1C)Br)c2ccccc2 34a_200011218496_100000694682 [1,1,0,0,0,0|2,0,0]=4 472 B20R2.1468 CCCN(Cc1cccc(c1C)C)c2ccccc2 2230a_200011218496_100011515928 [1,1,0,0,0,0|2,0,0]=4 473 B20R2.1468 CCCN(Cc1cccc(c1C)C)c2ccccc2 269982a_200011218496_100011515928 [1,1,0,0,0,0|2,0,0]=4 474 B20R2.1468 CCCN(Cc1cccc(c1C)C)c2ccccc2 34a_200011218496_100011273979 [1,1,0,0,0,0|2,0,0]=4 475 B20R2.1468 CCCN(Cc1cccc(c1C)Cl)c2ccccc2 2230a_200011218496_100012186920 [1,1,0,0,0,0|2,0,0]=4 476 B20R2.1468 CCCN(Cc1cccc(c1C)Cl)c2ccccc2 269982a_200011218496_100012186920 [1,1,0,0,0,0|2,0,0]=4 477 B20R2.1468 CCCN(Cc1cccc(c1C)Cl)c2ccccc2 34a_200011218496_100012186920 [1,1,0,0,0,0|2,0,0]=4 478 B20R2.1468 CCCN(Cc1cccc(c1C)F)c2ccccc2 2230a_200011218496_100009813626 [1,1,0,0,0,0|2,0,0]=4 479 B20R2.1468 CCCN(Cc1cccc(c1C)F)c2ccccc2 269982a_200011218496_100009813626 [1,1,0,0,0,0|2,0,0]=4 480 B20R2.1468 CCCN(Cc1cccc(c1C)F)c2ccccc2 34a_200011218496_100009813626 [1,1,0,0,0,0|2,0,0]=4 481 B20R2.1468 CCCN(Cc1cccc(c1C)I)c2ccccc2 2230a_200011218496_100010150147 [1,1,0,0,0,0|2,0,0]=4 482 B20R2.1468 CCCN(Cc1cccc(c1C)I)c2ccccc2 269982a_200011218496_100010150147 [1,1,0,0,0,0|2,0,0]=4 483 B20R2.1468 CCCN(Cc1cccc(c1C)I)c2ccccc2 34a_200011218496_100010150147 [1,1,0,0,0,0|2,0,0]=4 484 B20R2.1468 Cc1c(cccc1NC(CCCl)c2ccccc2)Cl 2230a_100000210441_200010132975 [1,1,0,0,0,0|2,0,0]=4 485 B20R2.1468 Cc1c(cccc1NC(CCCl)c2ccccc2)Cl 7a_100000210441_200010132975 [1,1,0,0,0,0|2,0,0]=4 486 B20R2.1468 Cc1c(cccc1NC(CCCl)c2ccccc2)F 7a_100000745574_200010132975 [1,1,0,0,0,0|2,0,0]=4 487 B20R2.1468 Cc1c(cccc1NC(CCCl)c2ccccc2)O 7a_100011216573_200010132975 [1,1,0,0,0,0|2,0,0]=4 488 B20R2.1468 Cc1c(cccc1OC(CCCl)c2ccccc2)Br 7a_100012002258_200010132975 [1,1,0,0,0,0|1,0,0]=3 489 B20R2.1468 Cc1c(cccc1OC(CCCl)c2ccccc2)Cl 7a_100011265684_200010132975 [1,1,0,0,0,0|1,0,0]=3 490 B20R2.1468 Cc1c(cccc1OC(CCCl)c2ccccc2)F 7a_100011217231_200010132975 [1,1,0,0,0,0|1,0,0]=3 491 B20R2.1468 Cc1c(cccc1OC(CCCl)c2ccccc2)N 7a_100011216573_200010132975 [1,1,0,0,0,0|1,0,0]=3 492 B20R2.1468 Cc1c(cccc1SC(CCCl)c2ccccc2)F 62a_100011216893_200010132975 [1,1,0,0,0,0|1,1,0]=4 493 B20R2.1468 Cc1c(cccc1SC(CCCl)c2ccccc2)F 62a_200010132975_100011216893 [1,1,0,0,0,0|1,1,0]=4 494 B20R2.1468 Cc1c(cccc1SC(CCCl)c2ccccc2)N 62a_100000761887_200010132975 [1,1,0,0,0,0|1,1,0]=4 495 B20R2.1468 Cc1c(cccc1SC(CCCl)c2ccccc2)N 62a_200010132975_100000761887 [1,1,0,0,0,0|1,1,0]=4 496 B20R2.1468 Cc1c(cccc1SC(CCCl)c2ccccc2)O 62a_100012002258_200010132975 [1,1,0,0,0,0|1,1,0]=4 497 B20R2.1468 Cc1c(cccc1SC(CCCl)c2ccccc2)O 62a_200010132975_100012002258 [1,1,0,0,0,0|1,1,0]=4 498 B20R2.1468 Cc1cccc(c1Br)OC(CCCl)c2ccccc2 7a_100000686692_200010132975 [1,1,0,0,0,0|2,0,0]=4 499 B20R2.1468 Cc1cccc(c1C)NC(CCCl)c2ccccc2 2230a_100000210026_200010132975 [1,1,0,0,0,0|2,0,0]=4 500 B20R2.1468 Cc1cccc(c1C)NC(CCCl)c2ccccc2 7a_100000210026_200010132975 [1,1,0,0,0,0|2,0,0]=4 501 B20R2.1468 Cc1cccc(c1C)OC(CCCl)c2ccccc2 7a_100000185855_200010132975 [1,1,0,0,0,0|1,0,0]=3 502 B20R2.1468 Cc1cccc(c1C)SC(CCCl)c2ccccc2 62a_100011214922_200010132975 [1,1,0,0,0,0|1,1,0]=4 503 B20R2.1468 Cc1cccc(c1C)SC(CCCl)c2ccccc2 62a_200010132975_100011214922 [1,1,0,0,0,0|1,1,0]=4 504 B20R2.1468 Cc1cccc(c1Cl)OC(CCCl)c2ccccc2 7a_100000695629_200010132975 [1,1,0,0,0,0|2,0,0]=4 505 B20R2.1468 Cc1cccc(c1F)OC(CCCl)c2ccccc2 7a_100000751311_200010132975 [1,1,0,0,0,0|2,0,0]=4 506 B20R2.1468 Cc1cccc(c1I)OC(CCCl)c2ccccc2 7a_100010083724_200010132975 [1,1,0,0,0,0|2,0,0]=4 507 B20R2.1468 Cc1cccc(c1N)OC(CCCl)c2ccccc2 7a_100000743429_200010132975 [1,1,0,0,0,0|2,0,0]=4 508 B20R2.1468 ClCCC(Oc1cccc(c1Br)Br)c2ccccc2 7a_100010187966_200010132975 [1,1,0,0,0,0|2,0,0]=4 509 B20R2.1468 ClCCC(Oc1cccc(c1Br)Cl)c2ccccc2 7a_100012348804_200010132975 [1,1,0,0,0,0|2,0,0]=4 510 B20R2.1468 ClCCC(Oc1cccc(c1Br)I)c2ccccc2 7a_100010187914_200010132975 [1,1,0,0,0,0|2,0,0]=4 511 B20R2.1468 ClCCC(Oc1cccc(c1Cl)Br)c2ccccc2 7a_100010187913_200010132975 [1,1,0,0,0,0|2,0,0]=4 512 B20R2.1468 ClCCC(Oc1cccc(c1Cl)Cl)c2ccccc2 7a_100000211076_200010132975 [1,1,0,0,0,0|2,0,0]=4 513 B20R2.1468 ClCCC(Oc1cccc(c1Cl)I)c2ccccc2 7a_100000049636_200010132975 [1,1,0,0,0,0|2,0,0]=4 514 B20R2.1468 ClCCC(Oc1cccc(c1I)Br)c2ccccc2 7a_100010187912_200010132975 [1,1,0,0,0,0|2,0,0]=4 515 B20R2.1468 ClCCC(Oc1cccc(c1I)Cl)c2ccccc2 7a_100000050174_200010132975 [1,1,0,0,0,0|2,0,0]=4 516 B20R2.1468 Fc1c(cccc1OC(CCCl)c2ccccc2)Br 7a_100009817021_200010132975 [1,1,0,0,0,0|2,0,0]=4 517 B20R2.1468 Fc1c(cccc1OC(CCCl)c2ccccc2)Cl 7a_100000687438_200010132975 [1,1,0,0,0,0|2,0,0]=4 518 B20R2.1468 Fc1cccc(c1Br)OC(CCCl)c2ccccc2 7a_100009820682_200010132975 [1,1,0,0,0,0|2,0,0]=4 519 B20R2.1468 Fc1cccc(c1Cl)OC(CCCl)c2ccccc2 7a_100000087408_200010132975 [1,1,0,0,0,0|2,0,0]=4 520 B20R2.1468 Fc1cccc(c1F)OC(CCCl)c2ccccc2 7a_100000751161_200010132975 [1,1,0,0,0,0|2,0,0]=4 521 B20R2.1468 Fc1cccc(c1I)OC(CCCl)c2ccccc2 7a_100000690913_200010132975 [1,1,0,0,0,0|2,0,0]=4 522 B20R2.1468 Nc1c(cccc1OC(CCCl)c2ccccc2)Br 7a_100011934926_200010132975 [1,1,0,0,0,0|2,0,0]=4 523 B20R2.1468 Nc1c(cccc1OC(CCCl)c2ccccc2)Cl 7a_100012022510_200010132975 [1,1,0,0,0,0|2,0,0]=4 524 B20R2.1468 Nc1c(cccc1OC(CCCl)c2ccccc2)F 7a_100020591140_200010132975 [1,1,0,0,0,0|2,0,0]=4 525 B20R2.1468 Nc1c(cccc1OC(CCCl)c2ccccc2)I 7a_200000049512_200010132975 [1,1,0,0,0,0|2,0,0]=4 526 B20R2.1468 Nc1cccc(c1Br)OC(CCCl)c2ccccc2 7a_100012183704_200010132975 [1,1,0,0,0,0|2,0,0]=4 527 B20R2.1468 Nc1cccc(c1Cl)OC(CCCl)c2ccccc2 7a_100012002038_200010132975 [1,1,0,0,0,0|2,0,0]=4 528 B20R2.1493 C#Cc1ccccc1OC(CCCl)c2ccccc2 7a_200011470546_200010132975 [1,1,0,0,0,0|1,0,1]=4 529 B20R2.1493 CCCC(Nc1ccncc1CO)c2ccccc2 27a_100000189686_100000117392 [1,1,0,0,0,0|2,0,0]=4 530 B20R2.1493 CCCN(Cc1ccccc1CO)c2ccccc2 2230a_200011218496_100009816955 [1,1,0,0,0,0|2,0,0]=4 531 B20R2.1493 CCCN(Cc1ccccc1CO)c2ccccc2 269982a_200011218496_100009816955 [1,1,0,0,0,0|2,0,0]=4 532 B20R2.1493 CCCN(Cc1ccccc1CO)c2ccccc2 34a_200011218496_100009816955 [1,1,0,0,0,0|2,0,0]=4 533 B20R2.1493 CCCN(Cc1ccccc1OC)c2ccccc2 2230a_200011218496_100000210004 [1,1,0,0,0,0|2,0,0]=4 534 B20R2.1493 CCCN(Cc1ccccc1OC)c2ccccc2 269982a_200011218496_100000210004 [1,1,0,0,0,0|2,0,0]=4 535 B20R2.1493 CCCN(Cc1ccccc1OC)c2ccccc2 34a_200011218496_100000210004 [1,1,0,0,0,0|2,0,0]=4 536 B20R2.1493 CCCN(Cc1ccccc1SC)c2ccccc2 2230a_200011218496_100000699184 [1,1,0,0,0,0|2,0,0]=4 537 B20R2.1493 CCCN(Cc1ccccc1SC)c2ccccc2 269982a_200011218496_100000699184 [1,1,0,0,0,0|2,0,0]=4 538 B20R2.1493 CCCN(Cc1ccccc1SC)c2ccccc2 34a_200011218496_100000699184 [1,1,0,0,0,0|2,0,0]=4 539 B20R2.1493 CCc1ccccc1NC(CCCl)c2ccccc2 2230a_100000212081_200010132975 [1,1,0,0,0,0|2,0,0]=4 540 B20R2.1493 CCc1ccccc1NC(CCCl)c2ccccc2 7a_100000212081_200010132975 [1,1,0,0,0,0|2,0,0]=4 541 B20R2.1493 CCc1ccccc1OC(CCCl)c2ccccc2 7a_100000210936_200010132975 [1,1,0,0,0,0|1,0,0]=3 542 B20R2.1493 CCc1ccccc1SC(CCCl)c2ccccc2 62a_100011215823_200010132975 [1,1,0,0,0,0|1,1,0]=4 543 B20R2.1493 CCc1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100011215823 [1,1,0,0,0,0|1,1,0]=4 544 B20R2.1493 CNc1ccccc1SC(CCCl)c2ccccc2 62a_100020606079_200010132975 [1,1,0,0,0,0|1,1,0]=4 545 B20R2.1493 CNc1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100020606079 [1,1,0,0,0,0|1,1,0]=4 546 B20R2.1493 COc1ccccc1SC(CCCl)c2ccccc2 62a_100000210334_200010132975 [1,1,0,0,0,0|1,1,0]=4 547 B20R2.1493 COc1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100000210334 [1,1,0,0,0,0|1,1,0]=4 548 B20R2.1493 COc1ncccc1OC(CCCl)c2ccccc2 7a_100000698397_200010132975 [1,1,0,0,0,0|2,0,0]=4 549 B20R2.1493 CSc1ccccc1SC(CCCl)c2ccccc2 62a_100011217816_200010132975 [1,1,0,0,0,0|1,1,0]=4 550 B20R2.1493 CSc1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100011217816 [1,1,0,0,0,0|1,1,0]=4 551 B20R2.1493 ClCCC(Oc1cccnc1CBr)c2ccccc2 7a_200020655725_200010132975 [1,1,0,0,0,0|2,0,0]=4 552 B20R2.1493 N#Cc1ccccc1OC(CCCl)c2ccccc2 7a_100000211048_200010132975 [1,1,0,0,0,0|1,0,1]=4 553 B20R2.1493 NCc1ccccc1SC(CCCl)c2ccccc2 62a_100000689332_200010132975 [1,1,0,0,0,0|1,1,0]=4 554 B20R2.1493 NCc1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100000689332 [1,1,0,0,0,0|1,1,0]=4 555 B20R2.1493 OCc1ccccc1SC(CCCl)c2ccccc2 62a_100000187465_200010132975 [1,1,0,0,0,0|1,1,0]=4 556 B20R2.1493 OCc1ccccc1SC(CCCl)c2ccccc2 62a_200010132975_100000187465 [1,1,0,0,0,0|1,1,0]=4 557 B20R2.12179 CCC[C@@H](Nc1ccncc1C)c2ccc(cc2)C 27a_200020633650_100000765111 [1,1,0,0,0,0|2,0,0]=4 558 B20R2.12179 CCC[C@H](Nc1ccncc1C)c2ccc(cc2)F 27a_100020612123_100000765111 [1,1,0,0,0,0|2,0,0]=4 559 B20R2.46891 CCC(C)C(Nc1ccncc1C)c2ccccc2 27a_100025702663_100000765111 [1,1,0,0,0,0|2,0,0]=4 560 B20R2.46891 COC(=O)C(Oc1ccccc1C)c2ccccc2 34a_100000210338_100000185205 [1,1,0,0,0,0|1,0,1]=4 561 B20R2.46891 COC(=O)C(Oc1ccccc1C)c2ccccc2 7a_100000210338_100000754950 [1,1,0,0,0,0|1,0,1]=4 562 B20R2.148412 Cc1cnccc1NC(CN(C)C)c2ccccc2 27a_100000209865_100000765111 [1,1,0,0,0,0|2,0,0]=4 563 B20R2.148412 Cc1cnccc1N[C@@H](CC(C)C)c2ccccc2 27a_100016987908_100000765111 [1,1,0,0,0,0|2,0,0]=4 564 B20R2.176177 CCCN(Cc1ccc(cc1C)Br)c2ccccc2 2230a_200011218496_100000708836 [1,1,0,0,0,0|2,0,0]=4 565 B20R2.176177 CCCN(Cc1ccc(cc1C)Br)c2ccccc2 269982a_200011218496_100000708836 [1,1,0,0,0,0|2,0,0]=4 566 B20R2.176177 CCCN(Cc1ccc(cc1C)Br)c2ccccc2 34a_200011218496_100000708836 [1,1,0,0,0,0|2,0,0]=4 567 B20R2.176177 CCCN(Cc1ccc(cc1C)C)c2ccccc2 2230a_200011218496_100011219618 [1,1,0,0,0,0|2,0,0]=4 568 B20R2.176177 CCCN(Cc1ccc(cc1C)C)c2ccccc2 269982a_200011218496_100011219618 [1,1,0,0,0,0|2,0,0]=4 569 B20R2.176177 CCCN(Cc1ccc(cc1C)C)c2ccccc2 34a_200011218496_100011219618 [1,1,0,0,0,0|2,0,0]=4 570 B20R2.176177 CCCN(Cc1ccc(cc1C)Cl)c2ccccc2 2230a_200011218496_100012361307 [1,1,0,0,0,0|2,0,0]=4 571 B20R2.176177 CCCN(Cc1ccc(cc1C)Cl)c2ccccc2 269982a_200011218496_100012361307 [1,1,0,0,0,0|2,0,0]=4 572 B20R2.176177 CCCN(Cc1ccc(cc1C)Cl)c2ccccc2 34a_200011218496_100012361307 [1,1,0,0,0,0|2,0,0]=4 573 B20R2.176177 CCCN(Cc1ccc(cc1C)F)c2ccccc2 2230a_200011218496_100000700533 [1,1,0,0,0,0|2,0,0]=4 574 B20R2.176177 CCCN(Cc1ccc(cc1C)F)c2ccccc2 269982a_200011218496_100000700533 [1,1,0,0,0,0|2,0,0]=4 575 B20R2.176177 CCCN(Cc1ccc(cc1C)F)c2ccccc2 34a_200011218496_100000700533 [1,1,0,0,0,0|2,0,0]=4 576 B20R2.176177 Cc1cc(c(cn1)OC(CCCl)c2ccccc2)C 7a_200000068632_200010132975 [1,1,0,0,0,0|2,0,0]=4 577 B20R2.176177 Cc1cc(ccc1NC(CCCl)c2ccccc2)Br 7a_100000211769_200010132975 [1,1,0,0,0,0|2,0,0]=4 578 B20R2.176177 Cc1cc(ccc1NC(CCCl)c2ccccc2)Cl 7a_100000210418_200010132975 [1,1,0,0,0,0|2,0,0]=4 579 B20R2.176177 Cc1cc(ccc1NC(CCCl)c2ccccc2)F 7a_100000211637_200010132975 [1,1,0,0,0,0|2,0,0]=4 580 B20R2.176177 Cc1cc(ccc1NC(CCCl)c2ccccc2)I 7a_100000184554_200010132975 [1,1,0,0,0,0|2,0,0]=4 581 B20R2.176177 Cc1cc(ccc1OC(CCCl)c2ccccc2)Br 7a_100000186361_200010132975 [1,1,0,0,0,0|1,0,0]=3 582 B20R2.176177 Cc1cc(ccc1OC(CCCl)c2ccccc2)Cl 7a_100000211091_200010132975 [1,1,0,0,0,0|1,0,0]=3 583 B20R2.176177 Cc1cc(ccc1OC(CCCl)c2ccccc2)F 7a_100000764316_200010132975 [1,1,0,0,0,0|1,0,0]=3 584 B20R2.176177 Cc1cc(ccc1OC(CCCl)c2ccccc2)I 7a_100011218673_200010132975 [1,1,0,0,0,0|1,0,0]=3 585 B20R2.176177 Cc1cc(ccc1OC(CCCl)c2ccccc2)N 7a_100011218179_200010132975 [1,1,0,0,0,0|1,0,0]=3 586 B20R2.176177 Cc1cc(ccc1SC(CCCl)c2ccccc2)F 62a_100011205405_200010132975 [1,1,0,0,0,0|1,1,0]=4 587 B20R2.176177 Cc1cc(ccc1SC(CCCl)c2ccccc2)F 62a_200010132975_100011205405 [1,1,0,0,0,0|1,1,0]=4 588 B20R2.176177 Cc1cc(ccc1SC(CCCl)c2ccccc2)N 62a_100000210723_200010132975 [1,1,0,0,0,0|1,1,0]=4 589 B20R2.176177 Cc1cc(ccc1SC(CCCl)c2ccccc2)N 62a_200010132975_100000210723 [1,1,0,0,0,0|1,1,0]=4 590 B20R2.176177 Cc1cc(ccc1SC(CCCl)c2ccccc2)O 62a_200010132975_100000690111 [1,1,0,0,0,0|1,1,0]=4 591 B20R2.176177 Cc1cc(ncc1OC(CCCl)c2ccccc2)Cl 7a_100000692680_200010132975 [1,1,0,0,0,0|2,0,0]=4 592 B20R2.176177 Cc1cc(ncc1OC(CCCl)c2ccccc2)F 7a_100009856773_200010132975 [1,1,0,0,0,0|2,0,0]=4 593 B20R2.176177 Cc1ccc(c(c1)Br)OC(CCCl)c2ccccc2 7a_100000210800_200010132975 [1,1,0,0,0,0|2,0,0]=4 594 B20R2.176177 Cc1ccc(c(c1)C)NC(CCCl)c2ccccc2 7a_100000736561_200010132975 [1,1,0,0,0,0|2,0,0]=4 595 B20R2.176177 Cc1ccc(c(c1)C)OC(CCCl)c2ccccc2 7a_100000211776_200010132975 [1,1,0,0,0,0|1,0,0]=3 596 B20R2.176177 Cc1ccc(c(c1)C)SC(CCCl)c2ccccc2 62a_100011217332_200010132975 [1,1,0,0,0,0|1,1,0]=4 597 B20R2.176177 Cc1ccc(c(c1)C)SC(CCCl)c2ccccc2 62a_200010132975_100011217332 [1,1,0,0,0,0|1,1,0]=4 598 B20R2.176177 Cc1ccc(c(c1)Cl)OC(CCCl)c2ccccc2 7a_100000749699_200010132975 [1,1,0,0,0,0|2,0,0]=4 599 B20R2.176177 Cc1ccc(c(c1)F)OC(CCCl)c2ccccc2 7a_100011216688_200010132975 [1,1,0,0,0,0|2,0,0]=4 600 B20R2.176177 Cc1ccc(c(c1)I)OC(CCCl)c2ccccc2 7a_100000765521_200010132975 [1,1,0,0,0,0|2,0,0]=4 601 B20R2.176177 Cc1ccc(c(c1)N)OC(CCCl)c2ccccc2 7a_100011215204_200010132975 [1,1,0,0,0,0|2,0,0]=4 602 B20R2.176177 Cc1ccc(c(n1)C)OC(CCCl)c2ccccc2 7a_100011218912_200010132975 [1,1,0,0,0,0|2,0,0]=4 603 B20R2.176177 Cc1nc(ccc1OC(CCCl)c2ccccc2)Br 7a_100012002022_200010132975 [1,1,0,0,0,0|2,0,0]=4 604 B20R2.176177 Cc1nc(ccc1OC(CCCl)c2ccccc2)Cl 7a_100012184626_200010132975 [1,1,0,0,0,0|2,0,0]=4 605 B20R2.176177 Cc1nc(ccc1OC(CCCl)c2ccccc2)F 7a_100009881036_200010132975 [1,1,0,0,0,0|2,0,0]=4 606 B20R2.176177 Cc1nc(ccc1OC(CCCl)c2ccccc2)I 7a_100010233687_200010132975 [1,1,0,0,0,0|2,0,0]=4 607 B20R2.176177 ClCCC(Oc1ccc(cc1Br)Br)c2ccccc2 7a_100000188717_200010132975 [1,1,0,0,0,0|2,0,0]=4 608 B20R2.176177 ClCCC(Oc1ccc(cc1Br)Cl)c2ccccc2 7a_100000211998_200010132975 [1,1,0,0,0,0|2,0,0]=4 609 B20R2.176177 ClCCC(Oc1ccc(cc1Br)I)c2ccccc2 7a_100012361655_200010132975 [1,1,0,0,0,0|2,0,0]=4 610 B20R2.176177 ClCCC(Oc1ccc(cc1Cl)Br)c2ccccc2 7a_100000186472_200010132975 [1,1,0,0,0,0|2,0,0]=4 611 B20R2.176177 ClCCC(Oc1ccc(cc1Cl)Cl)c2ccccc2 7a_100015191787_200010132975 [1,1,0,0,0,0|2,0,0]=4 612 B20R2.176177 ClCCC(Oc1ccc(cc1Cl)I)c2ccccc2 7a_100012360047_200010132975 [1,1,0,0,0,0|2,0,0]=4 613 B20R2.176177 ClCCC(Oc1ccc(cc1I)Br)c2ccccc2 7a_100012355227_200010132975 [1,1,0,0,0,0|2,0,0]=4 614 B20R2.176177 ClCCC(Oc1ccc(cc1I)Cl)c2ccccc2 7a_100011356953_200010132975 [1,1,0,0,0,0|2,0,0]=4 615 B20R2.176177 ClCCC(Oc1ccc(cc1I)I)c2ccccc2 7a_100010001573_200010132975 [1,1,0,0,0,0|2,0,0]=4 616 B20R2.176177 Fc1cc(ccc1OC(CCCl)c2ccccc2)Br 7a_100000185481_200010132975 [1,1,0,0,0,0|2,0,0]=4 617 B20R2.176177 Fc1cc(ccc1OC(CCCl)c2ccccc2)Cl 7a_100000230166_200010132975 [1,1,0,0,0,0|2,0,0]=4 618 B20R2.176177 Fc1cc(ccc1OC(CCCl)c2ccccc2)I 7a_100011356965_200010132975 [1,1,0,0,0,0|2,0,0]=4 619 B20R2.176177 Fc1ccc(c(c1)Br)OC(CCCl)c2ccccc2 7a_100000211999_200010132975 [1,1,0,0,0,0|2,0,0]=4 620 B20R2.176177 Fc1ccc(c(c1)Cl)OC(CCCl)c2ccccc2 7a_100000212004_200010132975 [1,1,0,0,0,0|2,0,0]=4 621 B20R2.176177 Fc1ccc(c(c1)F)OC(CCCl)c2ccccc2 7a_100000230127_200010132975 [1,1,0,0,0,0|2,0,0]=4 622 B20R2.176177 Fc1ccc(c(c1)I)OC(CCCl)c2ccccc2 7a_100012355409_200010132975 [1,1,0,0,0,0|2,0,0]=4 623 B20R2.176177 Nc1cc(ccc1OC(CCCl)c2ccccc2)Br 7a_100000752626_200010132975 [1,1,0,0,0,0|2,0,0]=4 624 B20R2.176177 Nc1cc(ccc1OC(CCCl)c2ccccc2)Cl 7a_100000210500_200010132975 [1,1,0,0,0,0|2,0,0]=4 625 B20R2.176177 Nc1cc(ccc1OC(CCCl)c2ccccc2)F 7a_100000759472_200010132975 [1,1,0,0,0,0|2,0,0]=4 626 B20R2.176177 Nc1cc(ccc1OC(CCCl)c2ccccc2)I 7a_100000753495_200010132975 [1,1,0,0,0,0|2,0,0]=4 627 B20R2.176177 Nc1ccc(c(c1)Br)OC(CCCl)c2ccccc2 7a_100011534360_200010132975 [1,1,0,0,0,0|2,0,0]=4 628 B20R2.176177 Nc1ccc(c(c1)Cl)OC(CCCl)c2ccccc2 7a_100000744943_200010132975 [1,1,0,0,0,0|2,0,0]=4 629 B20R2.176177 Nc1ccc(c(c1)F)OC(CCCl)c2ccccc2 7a_100011220035_200010132975 [1,1,0,0,0,0|2,0,0]=4 630 B20R2.192782 CCCN(C(=O)c1ccccc1C)c2ccccc2 11a_200011218496_100000212026 [1,1,0,0,0,0|2,0,0]=4 631 B20R2.192782 CCCN(C(=O)c1ccccc1C)c2ccccc2 1626a_200011218496_100000212026 [1,1,0,0,0,0|2,0,0]=4 632 B20R2.192782 CCCN(C(=O)c1ccccc1C)c2ccccc2 22a_200011218496_100000212026 [1,1,0,0,0,0|2,0,0]=4 633 B20R2.192782 Cc1ccccc1C(=O)C(CCCl)c2ccccc2 1458a_100000212026_200010132975 [1,1,0,0,0,0|2,0,0]=4 634 B20R2.192782 Cc1ccccc1N(C)C(CCCl)c2ccccc2 2230a_100000219699_200010132975 [1,1,0,0,0,0|2,0,0]=4 635 B20R2.192782 Cc1ccccc1N(C)C(CCCl)c2ccccc2 269982a_100000219699_200010132975 [1,1,0,0,0,0|2,0,0]=4 636 B20R2.326381 CCCN(Cc1ccccc1C)c2ccccc2F 2230a_100011231789_100000211839 [1,1,0,0,0,0|2,0,0]=4 637 B20R2.326381 CCCN(Cc1ccccc1C)c2ccccc2F 269982a_100011231789_100000211839 [1,1,0,0,0,0|2,0,0]=4 638 B20R2.326381 CCCN(Cc1ccccc1C)c2ccccc2F 34a_100011231789_100000211839 [1,1,0,0,0,0|2,0,0]=4 639 B20R2.933840 CCCC(Nc1c(ccnc1F)C)c2ccccc2 27a_100000189686_100009818256 [1,1,0,0,0,0|2,0,0]=4 640 B20R2.933840 CCCN(Cc1c(cccc1Br)C)c2ccccc2 2230a_200011218496_100010146847 [1,1,0,0,0,0|2,0,0]=4 641 B20R2.933840 CCCN(Cc1c(cccc1Br)C)c2ccccc2 269982a_200011218496_100010146847 [1,1,0,0,0,0|2,0,0]=4 642 B20R2.933840 CCCN(Cc1c(cccc1Br)C)c2ccccc2 34a_200011218496_100010146847 [1,1,0,0,0,0|2,0,0]=4 643 B20R2.933840 CCCN(Cc1c(cccc1C)C)c2ccccc2 2230a_200011218496_100000758300 [1,1,0,0,0,0|2,0,0]=4 644 B20R2.933840 CCCN(Cc1c(cccc1C)C)c2ccccc2 269982a_200011218496_100000758300 [1,1,0,0,0,0|2,0,0]=4 645 B20R2.933840 CCCN(Cc1c(cccc1C)C)c2ccccc2 34a_200011218496_100000758300 [1,1,0,0,0,0|2,0,0]=4 646 B20R2.933840 CCCN(Cc1c(cccc1F)C)c2ccccc2 2230a_200011218496_100009814554 [1,1,0,0,0,0|2,0,0]=4 647 B20R2.933840 CCCN(Cc1c(cccc1F)C)c2ccccc2 269982a_200011218496_100009814554 [1,1,0,0,0,0|2,0,0]=4 648 B20R2.933840 CCCN(Cc1c(cccc1F)C)c2ccccc2 34a_200011218496_100009814554 [1,1,0,0,0,0|2,0,0]=4 649 B20R2.933840 CCCN(Cc1c(cccc1I)C)c2ccccc2 2230a_200011218496_100010150146 [1,1,0,0,0,0|2,0,0]=4 650 B20R2.933840 CCCN(Cc1c(cccc1I)C)c2ccccc2 269982a_200011218496_100010150146 [1,1,0,0,0,0|2,0,0]=4 651 B20R2.933840 CCCN(Cc1c(cccc1I)C)c2ccccc2 34a_200011218496_100010150146 [1,1,0,0,0,0|2,0,0]=4 652 B20R2.933840 Cc1cccc(c1OC(CCCl)c2ccccc2)Br 7a_100009817157_200010132975 [1,1,0,0,0,0|1,0,0]=3 653 B20R2.933840 Cc1cccc(c1OC(CCCl)c2ccccc2)C 7a_100000210341_200010132975 [1,1,0,0,0,0|1,0,0]=3 654 B20R2.933840 Cc1cccc(c1OC(CCCl)c2ccccc2)Cl 7a_100000033731_200010132975 [1,1,0,0,0,0|1,0,0]=3 655 B20R2.933840 Cc1cccc(c1OC(CCCl)c2ccccc2)F 7a_100011659162_200010132975 [1,1,0,0,0,0|1,0,0]=3 656 B20R2.933840 Cc1cccc(c1OC(CCCl)c2ccccc2)N 7a_100000756359_200010132975 [1,1,0,0,0,0|1,0,0]=3 657 B20R2.933840 Cc1cccc(c1SC(CCCl)c2ccccc2)C 62a_100000033847_200010132975 [1,1,0,0,0,0|1,1,0]=4 658 B20R2.933840 Cc1cccc(c1SC(CCCl)c2ccccc2)C 62a_200010132975_100000033847 [1,1,0,0,0,0|1,1,0]=4 659 B20R2.933840 Cc1cccc(c1SC(CCCl)c2ccccc2)F 62a_100011218421_200010132975 [1,1,0,0,0,0|1,1,0]=4 660 B20R2.933840 Cc1cccc(c1SC(CCCl)c2ccccc2)F 62a_200010132975_100011218421 [1,1,0,0,0,0|1,1,0]=4 661 B20R2.933840 Cc1cccc(c1SC(CCCl)c2ccccc2)N 62a_100000684715_200010132975 [1,1,0,0,0,0|1,1,0]=4 662 B20R2.933840 Cc1cccc(c1SC(CCCl)c2ccccc2)N 62a_200010132975_100000684715 [1,1,0,0,0,0|1,1,0]=4 663 B20R2.933840 Cc1cccc(c1SC(CCCl)c2ccccc2)O 62a_100000686692_200010132975 [1,1,0,0,0,0|1,1,0]=4 664 B20R2.933840 Cc1cccc(c1SC(CCCl)c2ccccc2)O 62a_200010132975_100000686692 [1,1,0,0,0,0|1,1,0]=4 665 B20R2.933840 Cc1ccnc(c1OC(CCCl)c2ccccc2)C 7a_100011934651_200010132975 [1,1,0,0,0,0|2,0,0]=4 666 B20R2.933840 Cc1ccnc(c1OC(CCCl)c2ccccc2)Cl 7a_100000696282_200010132975 [1,1,0,0,0,0|2,0,0]=4 667 B20R2.933840 ClCCC(Oc1c(cccc1Br)Br)c2ccccc2 7a_100000736428_200010132975 [1,1,0,0,0,0|2,0,0]=4 668 B20R2.933840 ClCCC(Oc1c(cccc1Br)Cl)c2ccccc2 7a_100010214474_200010132975 [1,1,0,0,0,0|2,0,0]=4 669 B20R2.933840 ClCCC(Oc1c(cccc1Cl)Cl)c2ccccc2 7a_100000211709_200010132975 [1,1,0,0,0,0|2,0,0]=4 670 B20R2.933840 ClCCC(Oc1c(cccc1I)Br)c2ccccc2 7a_100010084509_200010132975 [1,1,0,0,0,0|2,0,0]=4 671 B20R2.933840 ClCCC(Oc1c(cccc1I)Cl)c2ccccc2 7a_100010202889_200010132975 [1,1,0,0,0,0|2,0,0]=4 672 B20R2.933840 Fc1cccc(c1OC(CCCl)c2ccccc2)Br 7a_100009813666_200010132975 [1,1,0,0,0,0|2,0,0]=4 673 B20R2.933840 Fc1cccc(c1OC(CCCl)c2ccccc2)Cl 7a_100000694953_200010132975 [1,1,0,0,0,0|2,0,0]=4 674 B20R2.933840 Fc1cccc(c1OC(CCCl)c2ccccc2)F 7a_100000230165_200010132975 [1,1,0,0,0,0|2,0,0]=4 675 B20R2.933840 Fc1cccc(c1OC(CCCl)c2ccccc2)I 7a_100010186298_200010132975 [1,1,0,0,0,0|2,0,0]=4 676 B20R2.447 CCCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000210211 [1,1,0,0,0,0|2,0,0]=4 677 B20R2.447 CCCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000210210 [1,1,0,0,0,0|2,0,0]=4 678 B20R2.447 CCCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000210211 [1,1,0,0,0,0|2,0,0]=4 679 B20R2.447 COCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100011201679 [1,1,0,0,0,0|2,0,0]=4 680 B20R2.447 COCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100011201679 [1,1,0,0,0,0|2,0,0]=4 681 B20R2.447 COCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000233755 [1,1,0,0,0,0|2,0,0]=4 682 B20R2.447 CSCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000751147 [1,1,0,0,0,0|2,0,0]=4 683 B20R2.447 CSCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000212216 [1,1,0,0,0,0|2,0,0]=4 684 B20R2.447 CSCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000212216 [1,1,0,0,0,0|2,0,0]=4 685 B20R2.10559 CN(C)CCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000755713 [1,1,0,0,0,0|2,0,0]=4 686 B20R2.10559 CN(C)CCN(Cc1ccccc1)c2ccccc2 269982a_200000219566_100000211182 [1,1,0,0,0,0|2,0,0]=4 687 B20R2.4906 CCCNC(c1ccccc1)c2ccc(cc2C)C 2230a_100102946505_100000210303 [0,1,0,0,1,0|2,0,0]=4 688 B20R2.4906 CCCNC(c1ccccc1)c2ccc(cc2C)C 270004a_100020643023_100000185008 [0,1,0,0,1,0|2,0,0]=4 689 B20R2.4906 CCCNC(c1ccccc1)c2ccc(cc2C)C 34a_100102946505_100000210303 [0,1,0,0,1,0|2,0,0]=4 690 B20R2.4906 COCNC(c1ccccc1)c2ccc(cc2C)C 2230a_100102946505_100000766300 [0,1,0,0,1,0|2,0,0]=4 691 B20R2.4906 CSCNC(c1ccccc1)c2ccc(cc2C)C 2230a_100102946505_100011218213 [0,1,0,0,1,0|2,0,0]=4 692 B20R2.4906 CSCNC(c1ccccc1)c2ccc(cc2C)C 34a_100102946505_100011218213 [0,1,0,0,1,0|2,0,0]=4 693 B20R2.4914 CCCNC(c1ccccc1)c2ccccc2OC 270004a_100020643023_100011218802 [0,1,0,0,1,0|2,0,0]=4 694 B20R2.21885 C#CCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000688953 [0,1,0,0,1,0|1,0,1]=4 695 B20R2.21885 C#CCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000688953 [0,1,0,0,1,0|1,0,1]=4 696 B20R2.21885 C#CCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000688953 [0,1,0,0,1,0|1,0,1]=4 697 B20R2.21885 C#CCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000688953 [0,1,0,0,1,0|1,0,1]=4 698 B20R2.21885 C#CCCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000688953 [0,1,0,0,1,0|1,0,1]=4 699 B20R2.21885 C#CCCSC(c1ccccc1)c2ccccc2C 62a_100000688953_100000230135 [0,1,0,0,1,0|1,0,1]=4 700 B20R2.21885 C/C=C/CNC(c1ccccc1)c2ccccc2C 34a_100000222801_100102629194 [0,1,0,0,1,0|1,0,1]=4 701 B20R2.21885 C/C=C/COC(c1ccccc1)c2ccccc2C 34a_100000212071_100102629194 [0,1,0,0,1,0|1,0,1]=4 702 B20R2.21885 C/C=C/COC(c1ccccc1)c2ccccc2C 7a_100000212071_100102629194 [0,1,0,0,1,0|1,0,1]=4 703 B20R2.21885 C/C=C/CSC(c1ccccc1)c2ccccc2C 62a_100000230135_100102629194 [0,1,0,0,1,0|1,0,1]=4 704 B20R2.21885 C/C=C/CSC(c1ccccc1)c2ccccc2C 62a_100102629194_100000230135 [0,1,0,0,1,0|1,0,1]=4 705 B20R2.21885 C=CCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000754431 [0,1,0,0,1,0|1,0,1]=4 706 B20R2.21885 C=CCCNC(c1ccccc1)c2ccccc2C 2230a_100015191253_100000230135 [0,1,0,0,1,0|1,0,1]=4 707 B20R2.21885 C=CCCNC(c1ccccc1)c2ccccc2C 270004a_100015191253_100000735561 [0,1,0,0,1,0|1,0,1]=4 708 B20R2.21885 C=CCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000754431 [0,1,0,0,1,0|1,0,1]=4 709 B20R2.21885 C=CCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000754431 [0,1,0,0,1,0|1,0,1]=4 710 B20R2.21885 C=CCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000754431 [0,1,0,0,1,0|1,0,1]=4 711 B20R2.21885 C=CCCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000754431 [0,1,0,0,1,0|1,0,1]=4 712 B20R2.21885 C=CCCSC(c1ccccc1)c2ccccc2C 62a_100000754431_100000230135 [0,1,0,0,1,0|1,0,1]=4 713 B20R2.21885 CC#CCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000748600 [0,1,0,0,1,0|1,0,1]=4 714 B20R2.21885 CC#CCNC(c1ccccc1)c2ccccc2C 2230a_100000685387_100000230135 [0,1,0,0,1,0|1,0,1]=4 715 B20R2.21885 CC#CCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000748600 [0,1,0,0,1,0|1,0,1]=4 716 B20R2.21885 CC#CCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000748600 [0,1,0,0,1,0|1,0,1]=4 717 B20R2.21885 CC#CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000748600 [0,1,0,0,1,0|1,0,1]=4 718 B20R2.21885 CC#CCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000748600 [0,1,0,0,1,0|1,0,1]=4 719 B20R2.21885 CC#CCSC(c1ccccc1)c2ccccc2C 62a_100000748600_100000230135 [0,1,0,0,1,0|1,0,1]=4 720 B20R2.21885 CC=CCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000070051 [0,1,0,0,1,0|1,0,1]=4 721 B20R2.21885 CC=CCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000070051 [0,1,0,0,1,0|1,0,1]=4 722 B20R2.21885 CC=CCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000070051 [0,1,0,0,1,0|1,0,1]=4 723 B20R2.21885 CC=CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000070051 [0,1,0,0,1,0|1,0,1]=4 724 B20R2.21885 CC=CCSC(c1ccccc1)c2ccccc2C 62a_100000070051_100000230135 [0,1,0,0,1,0|1,0,1]=4 725 B20R2.21885 CC=CCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000070051 [0,1,0,0,1,0|1,0,1]=4 726 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000210211 [0,1,0,0,1,0|2,0,0]=4 727 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2Br 270004a_100000102301_100000198044 [0,1,0,0,1,0|2,0,0]=4 728 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000210210 [0,1,0,0,1,0|2,0,0]=4 729 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2C 2230a_100000102301_100000230135 [0,1,0,0,1,0|1,0,0]=3 730 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000210211 [0,1,0,0,1,0|1,0,0]=3 731 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2C 270004a_100000102301_100000735561 [0,1,0,0,1,0|1,0,0]=3 732 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000210210 [0,1,0,0,1,0|1,0,0]=3 733 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2C 7a_106832991798_100000230135 [0,1,0,0,1,0|1,0,0]=3 734 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2Cl 270004a_100000102301_100011215288 [0,1,0,0,1,0|2,0,0]=4 735 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2F 270004a_100000102301_100011217773 [0,1,0,0,1,0|2,0,0]=4 736 B20R2.21885 CCCCNC(c1ccncc1)c2ccccc2C 2230a_100015184055_100000210211 [0,1,0,0,1,0|2,0,0]=4 737 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000210210 [0,1,0,0,1,0|1,0,0]=3 738 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2C 7a_100000210227_100000230135 [0,1,0,0,1,0|1,0,0]=3 739 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000210211 [0,1,0,0,1,0|1,0,0]=3 740 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000210210 [0,1,0,0,1,0|2,0,0]=4 741 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000210211 [0,1,0,0,1,0|2,0,0]=4 742 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000210210 [0,1,0,0,1,0|2,0,0]=4 743 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000210211 [0,1,0,0,1,0|2,0,0]=4 744 B20R2.21885 CCCCSC(c1ccccc1)c2ccccc2C 62a_100000210211_100000230135 [0,1,0,0,1,0|1,0,0]=3 745 B20R2.21885 CCCCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000210210 [0,1,0,0,1,0|1,0,0]=3 746 B20R2.21885 CCOCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000739092 [0,1,0,0,1,0|2,0,0]=4 747 B20R2.21885 CCOCSC(c1ccccc1)c2ccccc2C 62a_100000739092_100000230135 [0,1,0,0,1,0|2,0,0]=4 748 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100011201679 [0,1,0,0,1,0|2,0,0]=4 749 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2Br 270004a_100000209980_100000198044 [0,1,0,0,1,0|2,0,0]=4 750 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100011201679 [0,1,0,0,1,0|2,0,0]=4 751 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2C 2230a_100000209980_100000230135 [0,1,0,0,1,0|1,0,0]=3 752 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100011201679 [0,1,0,0,1,0|1,0,0]=3 753 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2C 270004a_100000209980_100000735561 [0,1,0,0,1,0|1,0,0]=3 754 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100011201679 [0,1,0,0,1,0|1,0,0]=3 755 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2Cl 270004a_100000209980_100011215288 [0,1,0,0,1,0|2,0,0]=4 756 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2F 270004a_100000209980_100011217773 [0,1,0,0,1,0|2,0,0]=4 757 B20R2.21885 COCCNC(c1ccncc1)c2ccccc2C 2230a_100015184055_100011201679 [0,1,0,0,1,0|2,0,0]=4 758 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100011201679 [0,1,0,0,1,0|1,0,0]=3 759 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000233755 [0,1,0,0,1,0|1,0,0]=3 760 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100011201679 [0,1,0,0,1,0|2,0,0]=4 761 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000233755 [0,1,0,0,1,0|2,0,0]=4 762 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100011201679 [0,1,0,0,1,0|2,0,0]=4 763 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000233755 [0,1,0,0,1,0|2,0,0]=4 764 B20R2.21885 COCCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000233755 [0,1,0,0,1,0|1,0,0]=3 765 B20R2.21885 COCCSC(c1ccccc1)c2ccccc2C 62a_100000233755_100000230135 [0,1,0,0,1,0|1,0,0]=3 766 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000751147 [0,1,0,0,1,0|2,0,0]=4 767 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2Br 270004a_100020590264_100000198044 [0,1,0,0,1,0|2,0,0]=4 768 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000212216 [0,1,0,0,1,0|2,0,0]=4 769 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000751147 [0,1,0,0,1,0|1,0,0]=3 770 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2C 2230a_100020590264_100000230135 [0,1,0,0,1,0|1,0,0]=3 771 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2C 270004a_100020590264_100000735561 [0,1,0,0,1,0|1,0,0]=3 772 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000212216 [0,1,0,0,1,0|1,0,0]=3 773 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2Cl 270004a_100020590264_100011215288 [0,1,0,0,1,0|2,0,0]=4 774 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2F 270004a_100020590264_100011217773 [0,1,0,0,1,0|2,0,0]=4 775 B20R2.21885 CSCCNC(c1ccncc1)c2ccccc2C 2230a_100015184055_100000751147 [0,1,0,0,1,0|2,0,0]=4 776 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000212216 [0,1,0,0,1,0|1,0,0]=3 777 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000212216 [0,1,0,0,1,0|1,0,0]=3 778 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2C 7a_100000230434_100000230135 [0,1,0,0,1,0|1,0,0]=3 779 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000212216 [0,1,0,0,1,0|2,0,0]=4 780 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000212216 [0,1,0,0,1,0|2,0,0]=4 781 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000212216 [0,1,0,0,1,0|2,0,0]=4 782 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000212216 [0,1,0,0,1,0|2,0,0]=4 783 B20R2.21885 CSCCSC(c1ccccc1)c2ccccc2C 62a_100000212216_100000230135 [0,1,0,0,1,0|1,0,0]=3 784 B20R2.21885 CSCCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000751147 [0,1,0,0,1,0|1,0,0]=3 785 B20R2.21885 Cc1ccccc1C(NCCC#N)c2ccccc2 2230a_100000222801_100011215226 [0,1,0,0,1,0|2,0,0]=4 786 B20R2.21885 Cc1ccccc1C(NCCC#N)c2ccccc2 270004a_100000720768_100000735561 [0,1,0,0,1,0|2,0,0]=4 787 B20R2.21885 Cc1ccccc1C(NCCCF)c2ccccc2 2230a_100000222801_100011934791 [0,1,0,0,1,0|2,0,0]=4 788 B20R2.21885 Cc1ccccc1C(NCCCF)c2ccccc2 2230a_100015189416_100000230135 [0,1,0,0,1,0|2,0,0]=4 789 B20R2.21885 Cc1ccccc1C(NCCCF)c2ccccc2 270004a_100015189416_100000735561 [0,1,0,0,1,0|2,0,0]=4 790 B20R2.21885 Cc1ccccc1C(NCCCF)c2ccccc2 34a_100000222801_100011934791 [0,1,0,0,1,0|2,0,0]=4 791 B20R2.21885 Cc1ccccc1C(NCCCO)c2ccccc2 2230a_100000222801_100000230001 [0,1,0,0,1,0|2,0,0]=4 792 B20R2.21885 Cc1ccccc1C(NCCCO)c2ccccc2 270004a_100000182051_100000735561 [0,1,0,0,1,0|2,0,0]=4 793 B20R2.21885 Cc1ccccc1C(NCCCO)c2ccccc2 34a_100000222801_100000230001 [0,1,0,0,1,0|2,0,0]=4 794 B20R2.21885 Cc1ccccc1C(OCCC#N)c2ccccc2 7a_100000212071_100000184422 [0,1,0,0,1,0|2,0,0]=4 795 B20R2.21885 Cc1ccccc1C(OCCCF)c2ccccc2 34a_100000212071_100011934791 [0,1,0,0,1,0|2,0,0]=4 796 B20R2.21885 Cc1ccccc1C(OCCCF)c2ccccc2 7a_100000212071_100011934791 [0,1,0,0,1,0|2,0,0]=4 797 B20R2.21885 Cc1ccccc1C(OCCCO)c2ccccc2 34a_100000212071_100000230001 [0,1,0,0,1,0|2,0,0]=4 798 B20R2.21885 Cc1ccccc1C(OCCCO)c2ccccc2 7a_100000212071_100011215043 [0,1,0,0,1,0|2,0,0]=4 799 B20R2.21885 Cc1ccccc1C(SCCC#N)c2ccccc2 62a_100000230135_100011215226 [0,1,0,0,1,0|2,0,0]=4 800 B20R2.21885 Cc1ccccc1C(SCCC#N)c2ccccc2 62a_100011215226_100000230135 [0,1,0,0,1,0|2,0,0]=4 801 B20R2.21885 Cc1ccccc1C(SCCCF)c2ccccc2 62a_100000230135_100011934791 [0,1,0,0,1,0|2,0,0]=4 802 B20R2.21885 Cc1ccccc1C(SCCCF)c2ccccc2 62a_100011934791_100000230135 [0,1,0,0,1,0|2,0,0]=4 803 B20R2.21885 Cc1ccccc1C(SCCCO)c2ccccc2 62a_100000230135_100011215043 [0,1,0,0,1,0|2,0,0]=4 804 B20R2.21885 Cc1ccccc1C(SCCCO)c2ccccc2 62a_100011215043_100000230135 [0,1,0,0,1,0|2,0,0]=4 805 B20R2.78662 CCCNC(c1ccc(cc1)Br)c2ccccc2C 270004a_100020643023_200011267734 [0,1,0,0,1,0|2,0,0]=4 806 B20R2.140971 C=C(C)CNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000748629 [0,1,0,0,1,0|2,0,0]=4 807 B20R2.140971 C=C(C)CNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000748629 [0,1,0,0,1,0|2,0,0]=4 808 B20R2.140971 C=C(C)COC(c1ccccc1)c2ccccc2C 34a_100000212071_100000748629 [0,1,0,0,1,0|2,0,0]=4 809 B20R2.140971 C=C(C)COC(c1ccccc1)c2ccccc2C 7a_100000212071_100000748629 [0,1,0,0,1,0|2,0,0]=4 810 B20R2.140971 C=C(C)CSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000211660 [0,1,0,0,1,0|2,0,0]=4 811 B20R2.140971 C=C(C)CSC(c1ccccc1)c2ccccc2C 62a_100000748629_100000230135 [0,1,0,0,1,0|2,0,0]=4 812 B20R2.140971 Cc1ccccc1C(NCC(C)C)c2ccccc2 2230a_100000210953_100000230135 [0,1,0,0,1,0|2,0,0]=4 813 B20R2.140971 Cc1ccccc1C(NCC(C)C)c2ccccc2 2230a_100000222801_100000210760 [0,1,0,0,1,0|2,0,0]=4 814 B20R2.140971 Cc1ccccc1C(NCC(C)C)c2ccccc2 270004a_100000210953_100000735561 [0,1,0,0,1,0|2,0,0]=4 815 B20R2.140971 Cc1ccccc1C(NCC(C)C)c2ccccc2 270004a_100000222801_100000210432 [0,1,0,0,1,0|2,0,0]=4 816 B20R2.140971 Cc1ccccc1C(NCC(C)C)c2ccccc2 34a_100000222801_100000210624 [0,1,0,0,1,0|2,0,0]=4 817 B20R2.140971 Cc1ccccc1C(NCC(C)O)c2ccccc2 2230a_100000210904_100000230135 [0,1,0,0,1,0|2,0,0]=4 818 B20R2.140971 Cc1ccccc1C(NCC(C)O)c2ccccc2 2230a_100000222801_100011218427 [0,1,0,0,1,0|2,0,0]=4 819 B20R2.140971 Cc1ccccc1C(NCC(C)O)c2ccccc2 270004a_100000210904_100000735561 [0,1,0,0,1,0|2,0,0]=4 820 B20R2.140971 Cc1ccccc1C(NCC(C)O)c2ccccc2 34a_100000222801_100011218427 [0,1,0,0,1,0|2,0,0]=4 821 B20R2.140971 Cc1ccccc1C(NC[C@@H](C)O)c2ccccc2 2230a_100000222801_100009817552 [0,1,0,0,1,0|2,0,0]=4 822 B20R2.140971 Cc1ccccc1C(NC[C@@H](C)O)c2ccccc2 34a_100000222801_100009817552 [0,1,0,0,1,0|2,0,0]=4 823 B20R2.140971 Cc1ccccc1C(OCC(C)C)c2ccccc2 34a_100000212071_100000210624 [0,1,0,0,1,0|2,0,0]=4 824 B20R2.140971 Cc1ccccc1C(OCC(C)C)c2ccccc2 7a_100000212071_100000210760 [0,1,0,0,1,0|2,0,0]=4 825 B20R2.140971 Cc1ccccc1C(OCC(C)O)c2ccccc2 34a_100000212071_100011218427 [0,1,0,0,1,0|2,0,0]=4 826 B20R2.140971 Cc1ccccc1C(OCC(C)O)c2ccccc2 7a_100000212071_100011218427 [0,1,0,0,1,0|2,0,0]=4 827 B20R2.140971 Cc1ccccc1C(OC[C@@H](C)O)c2ccccc2 34a_100000212071_100009817552 [0,1,0,0,1,0|2,0,0]=4 828 B20R2.140971 Cc1ccccc1C(OC[C@@H](C)O)c2ccccc2 7a_100000212071_100009817552 [0,1,0,0,1,0|2,0,0]=4 829 B20R2.140971 Cc1ccccc1C(SCC(C)C)c2ccccc2 62a_100000210624_100000230135 [0,1,0,0,1,0|2,0,0]=4 830 B20R2.140971 Cc1ccccc1C(SCC(C)C)c2ccccc2 62a_100000230135_100000210760 [0,1,0,0,1,0|2,0,0]=4 831 B20R2.140971 Cc1ccccc1C(SCC(C)O)c2ccccc2 62a_100000230135_100011218427 [0,1,0,0,1,0|2,0,0]=4 832 B20R2.140971 Cc1ccccc1C(SCC(C)O)c2ccccc2 62a_100011218427_100000230135 [0,1,0,0,1,0|2,0,0]=4 833 B20R2.140971 Cc1ccccc1C(SC[C@@H](C)O)c2ccccc2 62a_100000230135_100009817552 [0,1,0,0,1,0|2,0,0]=4 834 B20R2.140971 Cc1ccccc1C(SC[C@@H](C)O)c2ccccc2 62a_100009817552_100000230135 [0,1,0,0,1,0|2,0,0]=4 835 B20R2.192722 CCCN(C)C(c1ccccc1)c2ccccc2C 2230a_100000747261_100000230135 [0,1,0,0,1,0|2,0,0]=4 836 B20R2.192722 CCCN(C)C(c1ccccc1)c2ccccc2C 269982a_100000747261_100000230135 [0,1,0,0,1,0|2,0,0]=4 837 B20R2.192722 CCCN(C)C(c1ccccc1)c2ccccc2C 270004a_100000747261_100000735561 [0,1,0,0,1,0|2,0,0]=4 838 B20R2.252075 CCC(C)NC(c1ccccc1)c2ccccc2C 2230a_100000209981_100000230135 [0,1,0,0,1,0|2,0,0]=4 839 B20R2.252075 CCC(C)NC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000758301 [0,1,0,0,1,0|2,0,0]=4 840 B20R2.252075 CCC(C)NC(c1ccccc1)c2ccccc2C 270004a_100000209981_100000735561 [0,1,0,0,1,0|2,0,0]=4 841 B20R2.252075 CCC(C)NC(c1ccccc1)c2ccccc2C 34a_100000222801_100011215416 [0,1,0,0,1,0|2,0,0]=4 842 B20R2.252075 CCC(C)OC(c1ccccc1)c2ccccc2C 34a_100000212071_100011215416 [0,1,0,0,1,0|2,0,0]=4 843 B20R2.252075 CCC(C)OC(c1ccccc1)c2ccccc2C 7a_100000210228_100000230135 [0,1,0,0,1,0|2,0,0]=4 844 B20R2.252075 CCC(C)OC(c1ccccc1)c2ccccc2C 7a_100000212071_100000758301 [0,1,0,0,1,0|2,0,0]=4 845 B20R2.252075 CCC(C)SC(c1ccccc1)c2ccccc2C 62a_100000230135_100000758301 [0,1,0,0,1,0|2,0,0]=4 846 B20R2.252075 CCC(C)SC(c1ccccc1)c2ccccc2C 62a_100000758301_100000230135 [0,1,0,0,1,0|2,0,0]=4 847 B20R2.252075 CNC(=O)CC(c1ccccc1)c2ccccc2Cl 11a_106832991635_100015187286 [0,1,0,0,1,0|1,0,1]=4 848 B20R2.252075 CNC(=O)CC(c1ccccc1)c2ccccc2Cl 1626a_100102657272_100015187286 [0,1,0,0,1,0|1,0,1]=4 849 B20R2.252075 CNC(=O)CC(c1ccccc1)c2ccccc2Cl 240690a_100102657272_100015187286 [0,1,0,0,1,0|1,0,1]=4 850 B20R2.252075 CNC(=O)CC(c1ccccc1)c2ccccc2Cl 527a_100102657272_100015187286 [0,1,0,0,1,0|1,0,1]=4 851 B20R2.252075 CNC(=O)NC(c1ccccc1)c2ccccc2C 2708a_100102657272_100000222801 [0,1,0,0,1,0|1,0,1]=4 852 B20R2.252075 CNC(=O)NC(c1ccccc1)c2ccccc2C 273464a_100102657272_100000222801 [0,1,0,0,1,0|1,0,1]=4 853 B20R2.252075 CNC(=O)NC(c1ccccc1)c2ccccc2C 512a_106832991638_100000222801 [0,1,0,0,1,0|1,0,1]=4 854 B20R2.252075 COC(C)SC(c1ccccc1)c2ccccc2C 62a_100000230135_100009879195 [0,1,0,0,1,0|2,0,0]=4 855 B20R2.252075 COC(C)SC(c1ccccc1)c2ccccc2C 62a_100009879195_100000230135 [0,1,0,0,1,0|2,0,0]=4 856 B22R2.144015 Cc1ccccc1CN(CCN(C)C)Cc2ccccc2 269982a_100000187337_100000755713 [0,1,0,0,0,1|2,0,0]=4 857 B22R2.144015 Cc1ccccc1CN(CCN(C)C)Cc2ccccc2 269982a_100015185567_100000211182 [0,1,0,0,0,1|2,0,0]=4 858 B22R2.144015 Cc1ccccc1CN(CCN(C)C)Cc2ccccc2 269982a_114929131140_100000211839 [0,1,0,0,0,1|2,0,0]=4 859 B22R2.144015 Cc1ccccc1CN(CCN(C)C)Cc2ccccc2 270004a_100015185567_100015611070 [0,1,0,0,0,1|2,0,0]=4 860 B22R2.144015 Cc1ccccc1CN(CCN(C)C)Cc2ccccc2 270004a_114929131140_100000211143 [0,1,0,0,0,1|2,0,0]=4 861 B22R2.4740 C=CCCC(OCc1ccccc1C)c2ccc(cc2)Br 34a_200012050447_100000211839 [0,1,0,0,0,1|1,0,1]=4 862 B22R2.4740 C=CCCC(OCc1ccccc1C)c2ccc(cc2)Br 7a_200012050447_100000211839 [0,1,0,0,0,1|1,0,1]=4 863 B22R2.4740 CCCCC(NCc1ccccc1C)c2ccc(cc2)Br 269862a_100000174972_100011215321 [0,1,0,0,0,1|2,0,0]=4 864 B22R2.4740 CCCCC(NCc1ccccc1C)c2ccc(cc2)C 269862a_100000174972_100011268017 [0,1,0,0,0,1|2,0,0]=4 865 B22R2.4740 CCCCC(NCc1ccccc1C)c2ccc(cc2)Cl 207a_102515440625_100000211143 [0,1,0,0,0,1|2,0,0]=4 866 B22R2.4740 CCCCC(NCc1ccccc1C)c2ccc(cc2)Cl 2230a_102515440625_100000211839 [0,1,0,0,0,1|2,0,0]=4 867 B22R2.4740 CCCCC(NCc1ccccc1C)c2ccc(cc2)Cl 269862a_100000174972_100011215968 [0,1,0,0,0,1|2,0,0]=4 868 B22R2.4740 CCCCC(NCc1ccccc1C)c2ccc(cc2)Cl 270004a_102515440625_100000211143 [0,1,0,0,0,1|2,0,0]=4 869 B22R2.4740 CCCCC(NCc1ccccc1C)c2ccc(cc2)Cl 34a_102515440625_100000211839 [0,1,0,0,0,1|2,0,0]=4 870 B22R2.4740 CCCCC(NCc1ccccc1C)c2ccc(cc2)F 269862a_100000174972_100000211496 [0,1,0,0,0,1|2,0,0]=4 871 B22R2.4996 CCCCC(NCc1ccc(cc1C)Br)c2ccccc2 269862a_100000753881_100000211663 [0,1,0,0,0,1|2,0,0]=4 872 B22R2.4996 CCCCC(NCc1ccc(cc1C)C)c2ccccc2 269862a_100000737523_100000211663 [0,1,0,0,0,1|2,0,0]=4 873 B22R2.4996 CCCCC(NCc1ccc(cc1C)Cl)c2ccccc2 269862a_103436540063_100000211663 [0,1,0,0,0,1|2,0,0]=4 874 B22R2.4996 CCCCC(NCc1ccc(cc1C)F)c2ccccc2 269862a_100137329023_100000211663 [0,1,0,0,0,1|2,0,0]=4 875 B22R2.4996 CCCCC(OCc1ccc(cc1C)C)c2ccccc2 34a_100000698411_100011219618 [0,1,0,0,0,1|1,0,0]=3 876 B22R2.4996 CCCCC(OCc1ccc(cc1C)C)c2ccccc2 7a_100000698411_100011219618 [0,1,0,0,0,1|1,0,0]=3 877 B22R2.4996 CCCCC(OCc1ccc(cc1C)F)c2ccccc2 34a_100000698411_100000700533 [0,1,0,0,0,1|1,0,0]=3 878 B22R2.4996 CCCCC(OCc1ccc(cc1C)F)c2ccccc2 7a_100000698411_100000700533 [0,1,0,0,0,1|1,0,0]=3 879 B22R2.4996 CCCCC(OCc1ccc(cc1Cl)F)c2ccccc2 34a_100000698411_100011216360 [0,1,0,0,0,1|2,0,0]=4 880 B22R2.4996 CCCCC(OCc1ccc(cc1Cl)F)c2ccccc2 7a_100000698411_100011216360 [0,1,0,0,0,1|2,0,0]=4 881 B22R2.4996 CCCCC(OCc1ccc(cc1F)C)c2ccccc2 34a_100000698411_100012002367 [0,1,0,0,0,1|2,0,0]=4 882 B22R2.4996 CCCCC(OCc1ccc(cc1F)C)c2ccccc2 7a_100000698411_100012002367 [0,1,0,0,0,1|2,0,0]=4 883 B22R2.4996 CCCCC(OCc1ccc(cc1F)Cl)c2ccccc2 34a_100000698411_100000709361 [0,1,0,0,0,1|2,0,0]=4 884 B22R2.4996 CCCCC(OCc1ccc(cc1F)Cl)c2ccccc2 7a_100000698411_100000709361 [0,1,0,0,0,1|2,0,0]=4 885 B22R2.4996 CCCCC(OCc1ccc(cc1F)F)c2ccccc2 34a_100000698411_100000748237 [0,1,0,0,0,1|2,0,0]=4 886 B22R2.4996 CCCCC(OCc1ccc(cc1F)F)c2ccccc2 7a_100000698411_100000748237 [0,1,0,0,0,1|2,0,0]=4 887 B22R2.4996 CCCCC(OCc1ccc(cc1F)I)c2ccccc2 34a_100000698411_100010244991 [0,1,0,0,0,1|2,0,0]=4 888 B22R2.4996 CCCCC(OCc1ccc(cc1F)I)c2ccccc2 7a_100000698411_100010244991 [0,1,0,0,0,1|2,0,0]=4 889 B22R2.4996 CCCCC(OCc1ccc(cc1I)F)c2ccccc2 34a_100000698411_100012354799 [0,1,0,0,0,1|2,0,0]=4 890 B22R2.4996 CCCCC(OCc1ccc(cc1I)F)c2ccccc2 7a_100000698411_100012354799 [0,1,0,0,0,1|2,0,0]=4 891 B22R2.4996 CCCCC(OCc1cnc(cc1C)F)c2ccccc2 34a_100000698411_100010382440 [0,1,0,0,0,1|2,0,0]=4 892 B22R2.4996 CCCCC(OCc1cnc(cc1C)F)c2ccccc2 7a_100000698411_100010382440 [0,1,0,0,0,1|2,0,0]=4 893 B22R2.4996 CCCCC(OCc1ncc(cc1C)C)c2ccccc2 34a_100000698411_100016990036 [0,1,0,0,0,1|2,0,0]=4 894 B22R2.4996 CCCCC(OCc1ncc(cc1C)C)c2ccccc2 7a_100000698411_100016990036 [0,1,0,0,0,1|2,0,0]=4 895 B22R2.4996 CNCCC(NCc1ccc(cc1Br)Cl)c2ccccc2 269862a_100102692131_100015249630 [0,1,0,0,0,1|2,0,0]=4 896 B22R2.4996 CNCCC(NCc1ccc(cc1Br)F)c2ccccc2 269862a_100000708791_100015249630 [0,1,0,0,0,1|2,0,0]=4 897 B22R2.4996 CNCCC(NCc1ccc(cc1C)Br)c2ccccc2 269862a_100000753881_100015249630 [0,1,0,0,0,1|1,0,0]=3 898 B22R2.4996 CNCCC(NCc1ccc(cc1C)C)c2ccccc2 269862a_100000737523_100015249630 [0,1,0,0,0,1|1,0,0]=3 899 B22R2.4996 CNCCC(NCc1ccc(cc1C)Cl)c2ccccc2 269862a_103436540063_100015249630 [0,1,0,0,0,1|1,0,0]=3 900 B22R2.4996 CNCCC(NCc1ccc(cc1C)F)c2ccccc2 269862a_100137329023_100015249630 [0,1,0,0,0,1|1,0,0]=3 901 B22R2.4996 CNCCC(NCc1ccc(cc1Cl)Br)c2ccccc2 269862a_100020628970_100015249630 [0,1,0,0,0,1|2,0,0]=4 902 B22R2.4996 CNCCC(NCc1ccc(cc1Cl)C)c2ccccc2 269862a_100011997539_100015249630 [0,1,0,0,0,1|2,0,0]=4 903 B22R2.4996 CNCCC(NCc1ccc(cc1Cl)Cl)c2ccccc2 269862a_100000174880_100015249630 [0,1,0,0,0,1|2,0,0]=4 904 B22R2.4996 CNCCC(NCc1ccc(cc1Cl)F)c2ccccc2 269862a_100000174946_100015249630 [0,1,0,0,0,1|2,0,0]=4 905 B22R2.4996 CNCCC(NCc1ccc(cc1Cl)O)c2ccccc2 269862a_200161156549_100015249630 [0,1,0,0,0,1|2,0,0]=4 906 B22R2.4996 CNCCC(NCc1ccc(cc1F)Br)c2ccccc2 269862a_100000754580_100015249630 [0,1,0,0,0,1|2,0,0]=4 907 B22R2.4996 CNCCC(NCc1ccc(cc1F)C)c2ccccc2 269862a_100102887089_100015249630 [0,1,0,0,0,1|2,0,0]=4 908 B22R2.4996 CNCCC(NCc1ccc(cc1F)Cl)c2ccccc2 269862a_100000708496_100015249630 [0,1,0,0,0,1|2,0,0]=4 909 B22R2.4996 CNCCC(NCc1ccc(cc1F)F)c2ccccc2 269862a_100000737868_100015249630 [0,1,0,0,0,1|2,0,0]=4 910 B22R2.33990 CCCCCC(NCc1ccccc1C)c2ccccc2 269862a_100000174972_100000211787 [0,1,0,0,0,1|2,0,0]=4 911 B22R2.33990 CCCCCC(OCc1ccccc1C)c2ccccc2 34a_100000748122_100000211839 [0,1,0,0,0,1|1,0,0]=3 912 B22R2.33990 CCCCCC(OCc1ccccc1C)c2ccccc2 7a_100000748122_100000211839 [0,1,0,0,0,1|1,0,0]=3 913 B22R2.33990 CCCCCC(OCc1ccccc1F)c2ccccc2 34a_100000748122_100000211605 [0,1,0,0,0,1|2,0,0]=4 914 B22R2.33990 CCCCCC(OCc1ccccc1F)c2ccccc2 7a_100000748122_100000211605 [0,1,0,0,0,1|2,0,0]=4 915 B22R2.33990 CCCCCC(OCc1cccnc1C)c2ccccc2 34a_100000748122_100000732876 [0,1,0,0,0,1|2,0,0]=4 916 B22R2.33990 CCCCCC(OCc1cccnc1C)c2ccccc2 7a_100000748122_100000732876 [0,1,0,0,0,1|2,0,0]=4 917 B22R2.33990 CCCCCC(OCc1ccncc1C)c2ccccc2 34a_100000748122_100020672809 [0,1,0,0,0,1|2,0,0]=4 918 B22R2.33990 CCCCCC(OCc1ccncc1C)c2ccccc2 7a_100000748122_100020672808 [0,1,0,0,0,1|2,0,0]=4 919 B22R2.33990 CCCCCC(OCc1cnccc1C)c2ccccc2 34a_100000748122_100000690890 [0,1,0,0,0,1|2,0,0]=4 920 B22R2.33990 CCCCCC(OCc1cnccc1C)c2ccccc2 7a_100000748122_100000690890 [0,1,0,0,0,1|2,0,0]=4 921 B22R2.33990 CCCCCC(OCc1ncccc1C)c2ccccc2 34a_100000748122_100000696600 [0,1,0,0,0,1|2,0,0]=4 922 B22R2.33990 CCCCCC(OCc1ncccc1C)c2ccccc2 7a_100000748122_100000696600 [0,1,0,0,0,1|2,0,0]=4 923 B22R2.33990 CNCCCC(NCc1ccccc1C)c2cccnc2 269862a_100000174972_100020654510 [0,1,0,0,0,1|2,0,0]=4 924 B22R2.127949 CCCCC(NC(C)c1ccccc1C)c2ccccc2 269862a_100000181355_100000211663 [0,1,0,0,0,1|2,0,0]=4 925 B22R2.127949 CCCCC(OC(C)c1ccccc1F)c2ccccc2 34a_100000698411_200000741388 [0,1,0,0,0,1|2,0,0]=4 926 B22R2.127949 CCCCC(OC(C)c1ccccc1F)c2ccccc2 7a_100000698411_200000741388 [0,1,0,0,0,1|2,0,0]=4 927 B22R2.127949 CNCCC(NC(C)c1ccccc1Br)c2ccccc2 269862a_100000181357_100015249630 [0,1,0,0,0,1|2,0,0]=4 928 B22R2.127949 CNCCC(NC(C)c1ccccc1C)c2ccccc2 269862a_100000181355_100015249630 [0,1,0,0,0,1|1,0,0]=3 929 B22R2.127949 CNCCC(NC(C)c1ccccc1Cl)c2ccccc2 269862a_100000174978_100015249630 [0,1,0,0,0,1|2,0,0]=4 930 B22R2.127949 CNCCC(NC(C)c1ccccc1F)c2ccccc2 269862a_100000181408_100015249630 [0,1,0,0,0,1|2,0,0]=4 931 B22R2.127949 CNCCC(NC(C)c1ncccc1C)c2ccccc2 269862a_100011536111_100015249630 [0,1,0,0,0,1|2,0,0]=4 932 B22R2.127949 CNCCC(N[C@H](C)c1ccccc1O)c2ccccc2 269862a_100025703389_100015249630 [0,1,0,0,0,1|2,0,0]=4 933 B22R2.144156 CN(C)CCC(NCc1ccccc1Br)c2ccccc2 207a_200015187826_100000211189 [0,1,0,0,0,1|2,0,0]=4 934 B22R2.144156 CN(C)CCC(NCc1ccccc1Br)c2ccccc2 270004a_200015187826_100000211189 [0,1,0,0,0,1|2,0,0]=4 935 B22R2.144156 CN(C)CCC(NCc1ccccc1Cl)c2ccccc2 207a_200015187826_100000210073 [0,1,0,0,0,1|2,0,0]=4 936 B22R2.144156 CN(C)CCC(NCc1ccccc1Cl)c2ccccc2 270004a_200015187826_100000210073 [0,1,0,0,0,1|2,0,0]=4 937 B22R2.144156 CN(C)CCC(NCc1ccccc1F)c2ccccc2 207a_200015187826_100000210811 [0,1,0,0,0,1|2,0,0]=4 938 B22R2.144156 CN(C)CCC(NCc1ccccc1F)c2ccccc2 270004a_200015187826_100000210811 [0,1,0,0,0,1|2,0,0]=4 939 B22R2.144156 CN(C)CCC(NCc1ccccc1I)c2ccccc2 207a_200015187826_100000010305 [0,1,0,0,0,1|2,0,0]=4 940 B22R2.144156 CN(C)CCC(NCc1ccccc1I)c2ccccc2 270004a_200015187826_100000010305 [0,1,0,0,0,1|2,0,0]=4 941 B22R2.144156 Cc1ccccc1CCN(CCN(C)C)c2ccccc2 269982a_200000219566_100011713688 [0,1,0,0,0,1|2,0,0]=4 942 B22R2.144156 Cc1ccccc1CNC(CCC(C)C)c2ccccc2 269862a_100000174972_200011267664 [0,1,0,0,0,1|2,0,0]=4 943 B22R2.144156 Cc1ccccc1CNC(CCC(C)O)c2ccccc2 269862a_100000174972_200012571355 [0,1,0,0,0,1|2,0,0]=4 944 B22R2.144156 Cc1ccccc1CNC(CCN(C)C)c2ccccc2 207a_200015187826_100000211143 [0,1,0,0,0,1|1,0,0]=3 945 B22R2.144156 Cc1ccccc1CNC(CCN(C)C)c2ccccc2 270004a_200015187826_100000211143 [0,1,0,0,0,1|1,0,0]=3 946 B22R2.144156 Cc1cccnc1CNC(CCN(C)C)c2ccccc2 207a_200015187826_100000698913 [0,1,0,0,0,1|2,0,0]=4 947 B22R2.144156 Cc1cccnc1CNC(CCN(C)C)c2ccccc2 270004a_200015187826_100000698913 [0,1,0,0,0,1|2,0,0]=4 948 B22R2.144156 Cc1ccncc1CNC(CCN(C)C)c2ccccc2 207a_200015187826_100000685662 [0,1,0,0,0,1|2,0,0]=4 949 B22R2.144156 Cc1ccncc1CNC(CCN(C)C)c2ccccc2 270004a_200015187826_100000685662 [0,1,0,0,0,1|2,0,0]=4 950 B22R2.144156 Cc1ncccc1CNC(CCN(C)C)c2ccccc2 207a_200015187826_100000751968 [0,1,0,0,0,1|2,0,0]=4 951 B22R2.144156 Cc1ncccc1CNC(CCN(C)C)c2ccccc2 270004a_200015187826_100000751968 [0,1,0,0,0,1|2,0,0]=4 952 B22R2.152231 CCCCC(NCc1ccccc1CO)c2ccccc2 269862a_100000743596_100000211663 [0,1,0,0,0,1|2,0,0]=4 953 B22R2.152231 CCCCC(NCc1ccccc1OC)c2ccccc2 269862a_100000188900_100000211663 [0,1,0,0,0,1|2,0,0]=4 954 B22R2.152231 CCCCC(NCc1ccccc1SC)c2ccccc2 269862a_102495365025_100000211663 [0,1,0,0,0,1|2,0,0]=4 955 B22R2.152231 CCCCC(OCc1ccccc1C#N)c2ccccc2 34a_100000698411_100000181865 [0,1,0,0,0,1|1,0,1]=4 956 B22R2.152231 CCCCC(OCc1ccccc1C#N)c2ccccc2 7a_100000698411_100000181865 [0,1,0,0,0,1|1,0,1]=4 957 B22R2.152231 CCCCC(OCc1ccccc1C=O)c2ccccc2 34a_100000698411_200009853537 [0,1,0,0,0,1|1,0,1]=4 958 B22R2.152231 CCCCC(OCc1ccccc1C=O)c2ccccc2 7a_100000698411_200009853537 [0,1,0,0,0,1|1,0,1]=4 959 B22R2.152231 CCCCC(OCc1ccccc1CO)c2ccccc2 34a_100000698411_100009816955 [0,1,0,0,0,1|1,0,0]=3 960 B22R2.152231 CCCCC(OCc1ccccc1CO)c2ccccc2 7a_100000698411_100009816955 [0,1,0,0,0,1|1,0,0]=3 961 B22R2.152231 CCCCC(OCc1ccccc1OC)c2ccccc2 34a_100000698411_100000210004 [0,1,0,0,0,1|1,0,0]=3 962 B22R2.152231 CCCCC(OCc1ccccc1OC)c2ccccc2 7a_100000698411_100000210004 [0,1,0,0,0,1|1,0,0]=3 963 B22R2.152231 CCCCC(OCc1ccccc1SC)c2ccccc2 34a_100000698411_100000699184 [0,1,0,0,0,1|1,0,0]=3 964 B22R2.152231 CCCCC(OCc1ccccc1SC)c2ccccc2 7a_100000698411_100000699184 [0,1,0,0,0,1|1,0,0]=3 965 B22R2.152231 CCCCC(OCc1cccnc1OC)c2ccccc2 34a_100000698411_100020631285 [0,1,0,0,0,1|2,0,0]=4 966 B22R2.152231 CCCCC(OCc1cccnc1OC)c2ccccc2 7a_100000698411_100020631285 [0,1,0,0,0,1|2,0,0]=4 967 B22R2.152231 CCCCC(OCc1ccncc1OC)c2ccccc2 7a_100000698411_100020635607 [0,1,0,0,0,1|2,0,0]=4 968 B22R2.152231 CCCOC(COc1ccccc1OC)c2ccccc2 34a_100000518805_100000210303 [0,1,0,0,0,1|2,0,0]=4 969 B22R2.152231 CCCOC(COc1ccccc1OC)c2ccccc2 7a_100000518805_100000210303 [0,1,0,0,0,1|2,0,0]=4 970 B22R2.152231 CNCCC(NCc1ccccc1C#N)c2ccccc2 269862a_100016989011_100015249630 [0,1,0,0,0,1|1,0,1]=4 971 B22R2.152231 CNCCC(NCc1ccccc1CO)c2ccccc2 269862a_100000743596_100015249630 [0,1,0,0,0,1|1,0,0]=3 972 B22R2.152231 CNCCC(NCc1ccccc1OC)c2ccccc2 269862a_100000188900_100015249630 [0,1,0,0,0,1|1,0,0]=3 973 B22R2.152231 CNCCC(NCc1ccccc1SC)c2ccccc2 269862a_102495365025_100015249630 [0,1,0,0,0,1|1,0,0]=3 974 B22R2.152231 CNCCC(NCc1cccnc1OC)c2ccccc2 269862a_100102524934_100015249630 [0,1,0,0,0,1|2,0,0]=4 975 B22R2.152231 COc1ccccc1OCC(OCSC)c2ccccc2 34a_100000518805_100011218213 [0,1,0,0,0,1|2,0,0]=4 976 B22R2.364324 CCCCC(NCc1cc(ccc1C)C)c2ccccc2 269862a_100000174964_100000211663 [0,1,0,0,0,1|2,0,0]=4 977 B22R2.364324 CCCCC(NCc1cc(ccc1C)Cl)c2ccccc2 269862a_100000717755_100000211663 [0,1,0,0,0,1|2,0,0]=4 978 B22R2.364324 CCCCC(NCc1cc(ccc1C)F)c2ccccc2 269862a_100011217291_100000211663 [0,1,0,0,0,1|2,0,0]=4 979 B22R2.364324 CCCCC(NCc1cc(ccc1C)O)c2ccccc2 269862a_200009844824_100000211663 [0,1,0,0,0,1|2,0,0]=4 980 B22R2.364324 CCCCC(OCc1cc(ccc1C)C)c2ccccc2 34a_100000698411_100000184699 [0,1,0,0,0,1|1,0,0]=3 981 B22R2.364324 CCCCC(OCc1cc(ccc1C)C)c2ccccc2 7a_100000698411_100000184699 [0,1,0,0,0,1|1,0,0]=3 982 B22R2.364324 CCCCC(OCc1cc(ccc1C)F)c2ccccc2 34a_100000698411_100000709795 [0,1,0,0,0,1|1,0,0]=3 983 B22R2.364324 CCCCC(OCc1cc(ccc1C)F)c2ccccc2 7a_100000698411_100000709795 [0,1,0,0,0,1|1,0,0]=3 984 B22R2.364324 CCCCC(OCc1cc(ccc1Cl)F)c2ccccc2 34a_100000698411_100000709952 [0,1,0,0,0,1|2,0,0]=4 985 B22R2.364324 CCCCC(OCc1cc(ccc1Cl)F)c2ccccc2 7a_100000698411_100000709952 [0,1,0,0,0,1|2,0,0]=4 986 B22R2.364324 CCCCC(OCc1cc(ccc1F)C)c2ccccc2 34a_100000698411_100011260760 [0,1,0,0,0,1|2,0,0]=4 987 B22R2.364324 CCCCC(OCc1cc(ccc1F)C)c2ccccc2 7a_100000698411_100011260760 [0,1,0,0,0,1|2,0,0]=4 988 B22R2.364324 CCCCC(OCc1cc(ccc1F)Cl)c2ccccc2 34a_100000698411_100000716957 [0,1,0,0,0,1|2,0,0]=4 989 B22R2.364324 CCCCC(OCc1cc(ccc1F)Cl)c2ccccc2 7a_100000698411_100000716957 [0,1,0,0,0,1|2,0,0]=4 990 B22R2.364324 CCCCC(OCc1cc(ccc1F)F)c2ccccc2 34a_100000698411_100000741279 [0,1,0,0,0,1|2,0,0]=4 991 B22R2.364324 CCCCC(OCc1cc(ccc1F)F)c2ccccc2 7a_100000698411_100000741279 [0,1,0,0,0,1|2,0,0]=4 992 B22R2.364324 CCCCC(OCc1cc(ccc1F)I)c2ccccc2 34a_100000698411_200010149601 [0,1,0,0,0,1|2,0,0]=4 993 B22R2.364324 CCCCC(OCc1cc(ccc1F)I)c2ccccc2 7a_100000698411_200010149601 [0,1,0,0,0,1|2,0,0]=4 994 B22R2.364324 CCCCC(OCc1cc(ccc1I)F)c2ccccc2 34a_100000698411_100010149606 [0,1,0,0,0,1|2,0,0]=4 995 B22R2.364324 CCCCC(OCc1cc(ccc1I)F)c2ccccc2 7a_100000698411_100010149606 [0,1,0,0,0,1|2,0,0]=4 996 B22R2.364324 CCCCC(OCc1cc(ccc1O)F)c2ccccc2 34a_100000698411_100010161318 [0,1,0,0,0,1|2,0,0]=4 997 B22R2.364324 CCCCC(OCc1cc(ccc1O)F)c2ccccc2 7a_100000698411_100010161318 [0,1,0,0,0,1|2,0,0]=4 998 B22R2.364324 CNCCC(NCc1cc(ccc1Br)Br)c2ccccc2 269862a_100000707832_100015249630 [0,1,0,0,0,1|2,0,0]=4 999 B22R2.364324 CNCCC(NCc1cc(ccc1Br)F)c2ccccc2 269862a_100000742738_100015249630 [0,1,0,0,0,1|2,0,0]=4 1000 B22R2.364324 CNCCC(NCc1cc(ccc1C)C)c2ccccc2 269862a_100000174964_100015249630 [0,1,0,0,0,1|1,0,0]=3 1001 B22R2.364324 CNCCC(NCc1cc(ccc1C)Cl)c2ccccc2 269862a_100000717755_100015249630 [0,1,0,0,0,1|1,0,0]=3 1002 B22R2.364324 CNCCC(NCc1cc(ccc1C)F)c2ccccc2 269862a_100011217291_100015249630 [0,1,0,0,0,1|1,0,0]=3 1003 B22R2.364324 CNCCC(NCc1cc(ccc1C)O)c2ccccc2 269862a_200009844824_100015249630 [0,1,0,0,0,1|1,0,0]=3 1004 B22R2.364324 CNCCC(NCc1cc(ccc1Cl)Br)c2ccccc2 269862a_100025772652_100015249630 [0,1,0,0,0,1|2,0,0]=4 1005 B22R2.364324 CNCCC(NCc1cc(ccc1Cl)C)c2ccccc2 269862a_100025705715_100015249630 [0,1,0,0,0,1|2,0,0]=4 1006 B22R2.364324 CNCCC(NCc1cc(ccc1Cl)Cl)c2ccccc2 269862a_100102946428_100015249630 [0,1,0,0,0,1|2,0,0]=4 1007 B22R2.364324 CNCCC(NCc1cc(ccc1Cl)F)c2ccccc2 269862a_100011830483_100015249630 [0,1,0,0,0,1|2,0,0]=4 1008 B22R2.364324 CNCCC(NCc1cc(ccc1F)Br)c2ccccc2 269862a_100009815772_100015249630 [0,1,0,0,0,1|2,0,0]=4 1009 B22R2.364324 CNCCC(NCc1cc(ccc1F)C)c2ccccc2 269862a_100102693586_100015249630 [0,1,0,0,0,1|2,0,0]=4 1010 B22R2.364324 CNCCC(NCc1cc(ccc1F)Cl)c2ccccc2 269862a_100011211646_100015249630 [0,1,0,0,0,1|2,0,0]=4 1011 B22R2.364324 CNCCC(NCc1cc(ccc1F)F)c2ccccc2 269862a_100000752317_100015249630 [0,1,0,0,0,1|2,0,0]=4 1012 B22R2.364324 CNCCC(NCc1cc(ccc1O)Br)c2ccccc2 269862a_100000730032_100015249630 [0,1,0,0,0,1|2,0,0]=4 1013 B22R2.364324 CNCCC(NCc1cc(ccc1O)Cl)c2ccccc2 269862a_100000238540_100015249630 [0,1,0,0,0,1|2,0,0]=4 1014 B22R2.364431 CCCCC(NCc1cccc(c1C)Br)c2ccccc2 269862a_100000724210_100000211663 [0,1,0,0,0,1|2,0,0]=4 1015 B22R2.364431 CCCCC(NCc1cccc(c1C)C)c2ccccc2 269862a_100011211637_100000211663 [0,1,0,0,0,1|2,0,0]=4 1016 B22R2.364431 CCCCC(NCc1cccc(c1C)Cl)c2ccccc2 269862a_100020639605_100000211663 [0,1,0,0,0,1|2,0,0]=4 1017 B22R2.364431 CCCCC(NCc1cccc(c1C)F)c2ccccc2 269862a_100132306986_100000211663 [0,1,0,0,0,1|2,0,0]=4 1018 B22R2.364431 CCCCC(OCc1cccc(c1C)C)c2ccccc2 34a_100000698411_100011273979 [0,1,0,0,0,1|1,0,0]=3 1019 B22R2.364431 CCCCC(OCc1cccc(c1C)C)c2ccccc2 7a_100000698411_100011515928 [0,1,0,0,0,1|1,0,0]=3 1020 B22R2.364431 CCCCC(OCc1cccc(c1C)F)c2ccccc2 34a_100000698411_100009813626 [0,1,0,0,0,1|1,0,0]=3 1021 B22R2.364431 CCCCC(OCc1cccc(c1C)F)c2ccccc2 7a_100000698411_100009813626 [0,1,0,0,0,1|1,0,0]=3 1022 B22R2.364431 CCCCC(OCc1cccc(c1Cl)F)c2ccccc2 34a_100000698411_100000696688 [0,1,0,0,0,1|2,0,0]=4 1023 B22R2.364431 CCCCC(OCc1cccc(c1Cl)F)c2ccccc2 7a_100000698411_100000696688 [0,1,0,0,0,1|2,0,0]=4 1024 B22R2.364431 CCCCC(OCc1cccc(c1F)C)c2ccccc2 34a_100000698411_100011216058 [0,1,0,0,0,1|2,0,0]=4 1025 B22R2.364431 CCCCC(OCc1cccc(c1F)C)c2ccccc2 7a_100000698411_100011216058 [0,1,0,0,0,1|2,0,0]=4 1026 B22R2.364431 CCCCC(OCc1cccc(c1F)Cl)c2ccccc2 34a_100000698411_100000716733 [0,1,0,0,0,1|2,0,0]=4 1027 B22R2.364431 CCCCC(OCc1cccc(c1F)Cl)c2ccccc2 7a_100000698411_100000716733 [0,1,0,0,0,1|2,0,0]=4 1028 B22R2.364431 CCCCC(OCc1cccc(c1F)F)c2ccccc2 34a_100000698411_100000217499 [0,1,0,0,0,1|2,0,0]=4 1029 B22R2.364431 CCCCC(OCc1cccc(c1F)F)c2ccccc2 7a_100000698411_100000217499 [0,1,0,0,0,1|2,0,0]=4 1030 B22R2.364431 CCCCC(OCc1cccc(c1I)F)c2ccccc2 34a_100000698411_100010149603 [0,1,0,0,0,1|2,0,0]=4 1031 B22R2.364431 CCCCC(OCc1cccc(c1I)F)c2ccccc2 7a_100000698411_100010149603 [0,1,0,0,0,1|2,0,0]=4 1032 B22R2.364431 CCCCC(OCc1nccc(c1C)Cl)c2ccccc2 34a_100000698411_100020614443 [0,1,0,0,0,1|2,0,0]=4 1033 B22R2.364431 CCCCC(OCc1nccc(c1C)Cl)c2ccccc2 7a_100000698411_100020614443 [0,1,0,0,0,1|2,0,0]=4 1034 B22R2.364431 CNCCC(NCc1cccc(c1Br)F)c2ccccc2 269862a_100020638964_100015249630 [0,1,0,0,0,1|2,0,0]=4 1035 B22R2.364431 CNCCC(NCc1cccc(c1C)Br)c2ccccc2 269862a_100000724210_100015249630 [0,1,0,0,0,1|1,0,0]=3 1036 B22R2.364431 CNCCC(NCc1cccc(c1C)C)c2ccccc2 269862a_100011211637_100015249630 [0,1,0,0,0,1|1,0,0]=3 1037 B22R2.364431 CNCCC(NCc1cccc(c1C)Cl)c2ccccc2 269862a_100020639605_100015249630 [0,1,0,0,0,1|1,0,0]=3 1038 B22R2.364431 CNCCC(NCc1cccc(c1C)F)c2ccccc2 269862a_100132306986_100015249630 [0,1,0,0,0,1|1,0,0]=3 1039 B22R2.364431 CNCCC(NCc1cccc(c1Cl)C)c2ccccc2 269862a_100025705714_100015249630 [0,1,0,0,0,1|2,0,0]=4 1040 B22R2.364431 CNCCC(NCc1cccc(c1Cl)Cl)c2ccccc2 269862a_100011211633_100015249630 [0,1,0,0,0,1|2,0,0]=4 1041 B22R2.364431 CNCCC(NCc1cccc(c1Cl)F)c2ccccc2 269862a_100012001614_100015249630 [0,1,0,0,0,1|2,0,0]=4 1042 B22R2.364431 CNCCC(NCc1cccc(c1F)Br)c2ccccc2 269862a_100015189953_100015249630 [0,1,0,0,0,1|2,0,0]=4 1043 B22R2.364431 CNCCC(NCc1cccc(c1F)C)c2ccccc2 269862a_100012002060_100015249630 [0,1,0,0,0,1|2,0,0]=4 1044 B22R2.364431 CNCCC(NCc1cccc(c1F)Cl)c2ccccc2 269862a_100000764326_100015249630 [0,1,0,0,0,1|2,0,0]=4 1045 B22R2.364431 CNCCC(NCc1cccc(c1F)F)c2ccccc2 269862a_100011199105_100015249630 [0,1,0,0,0,1|2,0,0]=4 1046 B22R2.364431 CNCCC(NCc1cccc(c1F)O)c2ccccc2 269862a_100025773512_100015249630 [0,1,0,0,0,1|2,0,0]=4 1047 B22R2.364431 CNCCC(NCc1cccc(c1O)C)c2ccccc2 269862a_100020639391_100015249630 [0,1,0,0,0,1|2,0,0]=4 1048 B22R2.364464 CCCCC(NCc1ccccc1C)c2cccc(c2)F 207a_100015203083_100000211143 [0,1,0,0,0,1|2,0,0]=4 1049 B22R2.364464 CCCCC(NCc1ccccc1C)c2cccc(c2)F 2230a_100015203083_100000211839 [0,1,0,0,0,1|2,0,0]=4 1050 B22R2.364464 CCCCC(NCc1ccccc1C)c2cccc(c2)F 270004a_100015203083_100000211143 [0,1,0,0,0,1|2,0,0]=4 1051 B22R2.364464 CCCCC(NCc1ccccc1C)c2cccc(c2)F 34a_100015203083_100000211839 [0,1,0,0,0,1|2,0,0]=4 1052 B22R2.4133226 CCCCC(NCc1c(cccc1C)C)c2ccccc2 269862a_100000689800_100000211663 [0,1,0,0,0,1|2,0,0]=4 1053 B22R2.4133226 CCCCC(NCc1c(cccc1F)C)c2ccccc2 269862a_100000762012_100000211663 [0,1,0,0,0,1|2,0,0]=4 1054 B22R2.4133226 CCCCC(OCc1c(cccc1C)C)c2ccccc2 34a_100000698411_100000758300 [0,1,0,0,0,1|1,0,0]=3 1055 B22R2.4133226 CCCCC(OCc1c(cccc1C)C)c2ccccc2 7a_100000698411_100000758300 [0,1,0,0,0,1|1,0,0]=3 1056 B22R2.4133226 CCCCC(OCc1c(cccc1Cl)F)c2ccccc2 34a_100000698411_100000187852 [0,1,0,0,0,1|2,0,0]=4 1057 B22R2.4133226 CCCCC(OCc1c(cccc1Cl)F)c2ccccc2 7a_100000698411_100000187852 [0,1,0,0,0,1|2,0,0]=4 1058 B22R2.4133226 CCCCC(OCc1c(cccc1F)C)c2ccccc2 34a_100000698411_100009814554 [0,1,0,0,0,1|1,0,0]=3 1059 B22R2.4133226 CCCCC(OCc1c(cccc1F)C)c2ccccc2 7a_100000698411_100009814554 [0,1,0,0,0,1|1,0,0]=3 1060 B22R2.4133226 CCCCC(OCc1c(cccc1F)F)c2ccccc2 34a_100000698411_100000698325 [0,1,0,0,0,1|2,0,0]=4 1061 B22R2.4133226 CCCCC(OCc1c(cccc1F)F)c2ccccc2 7a_100000698411_100000698325 [0,1,0,0,0,1|2,0,0]=4 1062 B22R2.4133226 CCCCC(OCc1c(cccc1I)F)c2ccccc2 34a_100000698411_100010149602 [0,1,0,0,0,1|2,0,0]=4 1063 B22R2.4133226 CCCCC(OCc1c(cccc1I)F)c2ccccc2 7a_100000698411_100010149602 [0,1,0,0,0,1|2,0,0]=4 1064 B22R2.4133226 CNCCC(NCc1c(cccc1Br)F)c2ccccc2 269862a_100012349121_100015249630 [0,1,0,0,0,1|2,0,0]=4 1065 B22R2.4133226 CNCCC(NCc1c(cccc1C)C)c2ccccc2 269862a_100000689800_100015249630 [0,1,0,0,0,1|1,0,0]=3 1066 B22R2.4133226 CNCCC(NCc1c(cccc1Cl)Cl)c2ccccc2 269862a_100000174884_100015249630 [0,1,0,0,0,1|2,0,0]=4 1067 B22R2.4133226 CNCCC(NCc1c(cccc1Cl)F)c2ccccc2 269862a_100000174883_100015249630 [0,1,0,0,0,1|2,0,0]=4 1068 B22R2.4133226 CNCCC(NCc1c(cccc1F)C)c2ccccc2 269862a_100000762012_100015249630 [0,1,0,0,0,1|1,0,0]=3 1069 B22R2.4133226 CNCCC(NCc1c(cccc1F)F)c2ccccc2 269862a_100000688400_100015249630 [0,1,0,0,0,1|2,0,0]=4 1070 B22R2.6584396 C=CCCC(OCc1ccccc1C)c2ccccc2C 34a_200012050492_100000211839 [0,1,0,0,0,1|1,0,1]=4 1071 B22R2.6584396 C=CCCC(OCc1ccccc1C)c2ccccc2C 7a_200012050492_100000211839 [0,1,0,0,0,1|1,0,1]=4 1072 B22R2.6584396 CCCCC(NCc1ccccc1C)c2ccccc2F 269862a_100000174972_100011804260 [0,1,0,0,0,1|2,0,0]=4 1073 B22R2.539587 CCN(C)CC[C@@H](Oc1ccccc1C)c2ccccc2 2230a_100016988935_100000210202 [0,2,0,0,0,0|0,0,0]=2 1074 B22R2.539587 CCN(C)CC[C@@H](Oc1ccccc1C)c2ccccc2 269982a_100016988935_100000204670 [0,2,0,0,0,0|0,0,0]=2 1075 B22R2.539587 CCN(C)CC[C@@H](Oc1ccccc1C)c2ccccc2 34a_100016988935_100000210202 [0,2,0,0,0,0|0,0,0]=2 1076 B22R2.539587 CCN(C)CC[C@@H](Oc1ccccc1C)c2ccccc2 7a_100016988935_100000210202 [0,2,0,0,0,0|0,0,0]=2 1077 B22R2.539587 Cc1ccccc1O[C@H](CCN(C)CF)c2ccccc2 269982a_100016988935_100015361967 [0,2,0,0,0,0|0,0,0]=2 1078 B22R2.539587 Cc1ccccc1O[C@H](CCN(C)CF)c2ccccc2 34a_100016988935_100015361967 [0,2,0,0,0,0|0,0,0]=2 1079 B22R2.539587 Cc1ccccc1O[C@H](CCN(C)CF)c2ccccc2 7a_100016988935_100015361967 [0,2,0,0,0,0|0,0,0]=2 1080 B22R2.3901233 Cc1cnccc1NC(CCN(C)C)c2ccc(cc2)F 27a_100020682738_100000765111 [0,2,0,0,0,0|2,0,0]=4 1081 B22R2.146680 Cc1ccc(c(c1)CN(CCN(C)C)c2ccccc2)C 269982a_200000219566_100000184699 [0,2,0,0,0,0|2,0,0]=4 1082 B22R2.146680 Cc1ccc(cc1CN(CCN(C)C)c2ccccc2)Cl 269982a_200000219566_100012186985 [0,2,0,0,0,0|2,0,0]=4 1083 B22R2.146680 Cc1ccc(cc1CN(CCN(C)C)c2ccccc2)F 269982a_200000219566_100000709795 [0,2,0,0,0,0|2,0,0]=4 1084 B22R2.146680 Cc1cnc(cc1NC(CCN(C)C)c2ccccc2)F 27a_200015187826_100000049870 [0,2,0,0,0,0|2,0,0]=4 1085 B22R2.140895 Cc1c(cccc1CN(CCN(C)C)c2ccccc2)Br 269982a_200000219566_100000694682 [0,2,0,0,0,0|2,0,0]=4 1086 B22R2.140895 Cc1c(cccc1CN(CCN(C)C)c2ccccc2)Cl 269982a_200000219566_100012186920 [0,2,0,0,0,0|2,0,0]=4 1087 B22R2.140895 Cc1c(cccc1CN(CCN(C)C)c2ccccc2)F 269982a_200000219566_100009813626 [0,2,0,0,0,0|2,0,0]=4 1088 B22R2.140895 Cc1c(cccc1CN(CCN(C)C)c2ccccc2)I 269982a_200000219566_100010150147 [0,2,0,0,0,0|2,0,0]=4 1089 B22R2.140895 Cc1c(ccnc1F)NC(CCN(C)C)c2ccccc2 27a_200015187826_100010006593 [0,2,0,0,0,0|2,0,0]=4 1090 B22R2.140895 Cc1c(ccnc1NC(CCN(C)C)c2ccccc2)F 27a_200015187826_100009846374 [0,2,0,0,0,0|2,0,0]=4 1091 B22R2.140895 Cc1cccc(c1C)CN(CCN(C)C)c2ccccc2 269982a_200000219566_100011515928 [0,2,0,0,0,0|2,0,0]=4 1092 B22R2.81610 CN(C)CCC(Nc1ccncc1CO)c2ccccc2 27a_200015187826_100000117392 [0,2,0,0,0,0|2,0,0]=4 1093 B22R2.81610 CN(C)CCN(Cc1ccccc1CO)c2ccccc2 269982a_200000219566_100009816955 [0,2,0,0,0,0|2,0,0]=4 1094 B22R2.81610 COc1ccccc1CN(CCN(C)C)c2ccccc2 269982a_200000219566_100000210004 [0,2,0,0,0,0|2,0,0]=4 1095 B22R2.81610 CSc1ccccc1CN(CCN(C)C)c2ccccc2 269982a_200000219566_100000699184 [0,2,0,0,0,0|2,0,0]=4 1096 B22R2.398340 CCCC(=O)C(Oc1ccccc1CC)c2ccccc2 1458a_100000753236_100000210303 [0,2,0,0,0,0|1,0,1]=4 1097 B22R2.398340 CCc1ccccc1OC(C(=O)NNC)c2ccccc2 22a_100016993582_100000753236 [0,2,0,0,0,0|1,0,1]=4 1098 B22R2.202040 Cc1ccccc1C(=O)N(CCN(C)C)c2ccccc2 11a_200000219566_100000212026 [0,2,0,0,0,0|2,0,0]=4 1099 B22R2.202040 Cc1ccccc1C(=O)N(CCN(C)C)c2ccccc2 1626a_200000219566_100000212026 [0,2,0,0,0,0|2,0,0]=4 1100 B22R2.202040 Cc1ccccc1C(=O)N(CCN(C)C)c2ccccc2 22a_200000219566_100000212026 [0,2,0,0,0,0|2,0,0]=4 1101 B22R2.304529 Cc1cccc(c1CN(CCN(C)C)c2ccccc2)Br 269982a_200000219566_100010146847 [0,2,0,0,0,0|2,0,0]=4 1102 B22R2.304529 Cc1cccc(c1CN(CCN(C)C)c2ccccc2)C 269982a_200000219566_100000758300 [0,2,0,0,0,0|2,0,0]=4 1103 B22R2.304529 Cc1cccc(c1CN(CCN(C)C)c2ccccc2)F 269982a_200000219566_100009814554 [0,2,0,0,0,0|2,0,0]=4 1104 B22R2.304529 Cc1cccc(c1CN(CCN(C)C)c2ccccc2)I 269982a_200000219566_100010150146 [0,2,0,0,0,0|2,0,0]=4 1105 B22R2.304529 Cc1ccnc(c1NC(CCN(C)C)c2ccccc2)F 27a_200015187826_100009818256 [0,2,0,0,0,0|2,0,0]=4 1106 B22R2.4079337 Cc1cc(ccc1CN(CCN(C)C)c2ccccc2)Br 269982a_200000219566_100000708836 [0,2,0,0,0,0|2,0,0]=4 1107 B22R2.4079337 Cc1cc(ccc1CN(CCN(C)C)c2ccccc2)Cl 269982a_200000219566_100012361307 [0,2,0,0,0,0|2,0,0]=4 1108 B22R2.4079337 Cc1cc(ccc1CN(CCN(C)C)c2ccccc2)F 269982a_200000219566_100000700533 [0,2,0,0,0,0|2,0,0]=4 1109 B22R2.4079337 Cc1ccc(c(c1)C)CN(CCN(C)C)c2ccccc2 269982a_200000219566_100011219618 [0,2,0,0,0,0|2,0,0]=4 1110 B20R3.263 Cc1cnccc1N2CCCC2c3ccccc3 27a_100000243309_100000765111 [1,0,0,1,0,0|2,0,0]=4 1111 B20R3.265 Cc1cnccc1N[C@H]2CCCc3c2cccc3 27a_100020654734_100000765111 [1,0,0,1,0,0|2,0,0]=4 1112 B20R3.16776 CCCN(c1ccccc1)C2Cc3c2cccc3 269982a_200011218496_100009813401 [1,0,0,1,0,0|2,0,0]=4 1113 B20R3.133151 Cc1ccccc1OC2CC(=O)c3c2cccc3 7a_100000210338_100010208147 [1,0,0,1,0,0|1,0,1]=4 1114 B20R3.133722 Cc1cnccc1NC(c2ccccc2)C3CC3 27a_100000735078_100000765111 [1,0,0,1,0,0|2,0,0]=4 1115 B20R3.234917 CNCC1=Nc2ccccc2Cc3c1cccc3 2230a_106832991635_200015227246 [1,0,0,1,0,0|1,0,1]=4 1116 B20R3.234917 CNCC1=Nc2ccccc2Cc3c1cccc3 7a_106832991635_200015227246 [1,0,0,1,0,0|1,0,1]=4 1117 B20R3.280733 Cc1cnccc1NC2(CCC2)c3ccccc3 27a_100000734848_100000765111 [1,0,0,1,0,0|2,0,0]=4 1118 B20R3.8056 Cc1ccccc1C(NC2CC2)c3ccccc3 34a_100000222801_100000211595 [0,0,0,1,1,0|2,0,0]=4 1119 B20R3.8056 Cc1ccccc1C(OC2CC2)c3ccccc3 34a_100000212071_100000211595 [0,0,0,1,1,0|2,0,0]=4 1120 B20R3.8056 Cc1ccccc1C(SC2CC2)c3ccccc3 62a_100000230135_100000211595 [0,0,0,1,1,0|2,0,0]=4 1121 B20R3.12037 Cc1ccccc1C(c2ccccc2)N3CCC3 269982a_100000754969_100000230135 [0,0,0,1,1,0|2,0,0]=4 1122 B22R3.254052 Cc1ccccc1CNC2CCCCc3c2cccc3 269862a_100000174972_100000184060 [0,0,0,1,0,1|2,0,0]=4 1123 B22R3.254052 Cc1ccccc1NN=C2CCNCc3c2cccc3 4a_100000184220_100020645865 [0,0,0,1,0,1|1,0,1]=4 1124 B22R3.270734 CCCCC(OC1Cc2c1cccc2)c3ccccc3 7a_100000698411_100009813401 [0,0,0,1,0,1|1,0,0]=3 1125 B22R3.346008 Cc1ccccc1CNC(c2ccccc2)C3CCC3 269862a_100000174972_100011215208 [0,0,0,1,0,1|2,0,0]=4 1126 B22R3.346008 Cc1ccccc1CN[C@@H](c2ccccc2)C3CCC3 207a_100025717287_100000211143 [0,0,0,1,0,1|2,0,0]=4 1127 B22R3.346008 Cc1ccccc1CN[C@@H](c2ccccc2)C3CCC3 2230a_100025717287_100000211839 [0,0,0,1,0,1|2,0,0]=4 1128 B22R3.346008 Cc1ccccc1CN[C@@H](c2ccccc2)C3CCC3 270004a_100025717287_100000211143 [0,0,0,1,0,1|2,0,0]=4 1129 B22R3.346008 Cc1ccccc1CN[C@@H](c2ccccc2)C3CCC3 34a_100025717287_100000211839 [0,0,0,1,0,1|2,0,0]=4 1130 B22R3.670380 Cc1ccccc1CNC2(CCCC2)c3ccccc3 207a_100025739779_100000211143 [0,0,0,1,0,1|2,0,0]=4 1131 B22R3.670380 Cc1ccccc1CNC2(CCCC2)c3ccccc3 2230a_100025739779_100000211839 [0,0,0,1,0,1|2,0,0]=4 1132 B22R3.670380 Cc1ccccc1CNC2(CCCC2)c3ccccc3 270004a_100025739779_100000211143 [0,0,0,1,0,1|2,0,0]=4 1133 B22R3.670380 Cc1ccccc1CNC2(CCCC2)c3ccccc3 34a_100025739779_100000211839 [0,0,0,1,0,1|2,0,0]=4 1134 B22R3.5678366 Cc1ccccc1CNC2CCC(c3c2cccc3)C 269862a_100000174972_100000689179 [0,0,0,1,0,1|2,0,0]=4 1135 B22R3.5678366 Cc1ccccc1COC2CCC(=O)c3c2cccc3 7a_100000100557_100000211839 [0,0,0,1,0,1|2,0,0]=4 1136 B22R3.1099048 CN(C)CCN(c1ccccc1)C2Cc3c2cccc3 269982a_200000219566_100009813401 [0,1,0,1,0,0|2,0,0]=4 1137 B18R2.7738 CCCN(c1ccccc1)c2ccncc2C 27a_200011218496_100000765111 [1,0,0,0,1,0|2,0,0]=4 1138 B18R2.7738 CCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000210202 [1,0,0,0,1,0|2,0,0]=4 1139 B18R2.7738 CCNC(c1ccccc1)c2ccccc2Br 270004a_100015525214_100000198044 [1,0,0,0,1,0|2,0,0]=4 1140 B18R2.7738 CCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000210202 [1,0,0,0,1,0|2,0,0]=4 1141 B18R2.7738 CCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000210202 [1,0,0,0,1,0|1,0,0]=3 1142 B18R2.7738 CCNC(c1ccccc1)c2ccccc2C 2230a_100015525214_100000230135 [1,0,0,0,1,0|1,0,0]=3 1143 B18R2.7738 CCNC(c1ccccc1)c2ccccc2C 270004a_100015525214_100000735561 [1,0,0,0,1,0|1,0,0]=3 1144 B18R2.7738 CCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000210202 [1,0,0,0,1,0|1,0,0]=3 1145 B18R2.7738 CCNC(c1ccccc1)c2ccccc2Cl 270004a_100015525214_100011215288 [1,0,0,0,1,0|2,0,0]=4 1146 B18R2.7738 CCNC(c1ccccc1)c2ccccc2F 270004a_100015525214_100011217773 [1,0,0,0,1,0|2,0,0]=4 1147 B18R2.7738 CCNC(c1ccncc1)c2ccccc2C 2230a_100015184055_100000210202 [1,0,0,0,1,0|2,0,0]=4 1148 B18R2.7738 CCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000210202 [1,0,0,0,1,0|1,0,0]=3 1149 B18R2.7738 CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000210202 [1,0,0,0,1,0|1,0,0]=3 1150 B18R2.7738 CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000210202 [1,0,0,0,1,0|2,0,0]=4 1151 B18R2.7738 CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000210202 [1,0,0,0,1,0|2,0,0]=4 1152 B18R2.7738 CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000210202 [1,0,0,0,1,0|2,0,0]=4 1153 B18R2.7738 CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000210202 [1,0,0,0,1,0|2,0,0]=4 1154 B18R2.7738 CCSC(c1ccccc1)c2ccccc2C 62a_100000210202_100000230135 [1,0,0,0,1,0|1,0,0]=3 1155 B18R2.7738 CCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000210202 [1,0,0,0,1,0|1,0,0]=3 1156 B18R2.7738 Cc1ccccc1C(NCF)c2ccccc2 34a_100000222801_100015361967 [1,0,0,0,1,0|2,0,0]=4 1157 B18R2.7738 Cc1ccccc1C(OCF)c2ccccc2 34a_100000212071_100015361967 [1,0,0,0,1,0|2,0,0]=4 1158 B18R2.7738 Cc1ccccc1C(OCF)c2ccccc2 7a_100000212071_100015361967 [1,0,0,0,1,0|2,0,0]=4 1159 B18R2.7738 Cc1ccccc1C(SCF)c2ccccc2 62a_100000230135_100015361967 [1,0,0,0,1,0|2,0,0]=4 1160 B18R2.7738 Cc1ccccc1C(SCF)c2ccccc2 62a_100015361967_100000230135 [1,0,0,0,1,0|2,0,0]=4 1161 B18R2.40 CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210303 [1,0,0,0,1,0|2,0,0]=4 1162 B18R2.40 CCCNC(c1ccccc1)c2ccccc2 270004a_100020643023_100000210122 [1,0,0,0,1,0|2,0,0]=4 1163 B18R2.40 CCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210303 [1,0,0,0,1,0|2,0,0]=4 1164 B18R2.40 CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210303 [1,0,0,0,1,0|2,0,0]=4 1165 B18R2.40 CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210303 [1,0,0,0,1,0|2,0,0]=4 1166 B18R2.40 CCCSC(c1ccccc1)c2ccccc2 62a_100000210303_100011216954 [1,0,0,0,1,0|2,0,0]=4 1167 B18R2.40 CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000210303 [1,0,0,0,1,0|2,0,0]=4 1168 B18R2.40 CCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210202 [1,0,0,0,1,0|2,0,0]=4 1169 B18R2.40 CCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210202 [1,0,0,0,1,0|2,0,0]=4 1170 B18R2.40 CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210202 [1,0,0,0,1,0|2,0,0]=4 1171 B18R2.40 CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210202 [1,0,0,0,1,0|2,0,0]=4 1172 B18R2.40 CNCC=C(c1ccccc1)c2ccccc2 270004a_106832991635_100000050448 [1,0,0,0,1,0|0,0,2]=4 1173 B18R2.40 CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_200000210301 [1,0,0,0,1,0|0,0,0]=2 1174 B18R2.40 CNCCC(c1ccccc1)c2ccccc2 2230a_106832991635_100009813428 [1,0,0,0,1,0|0,0,0]=2 1175 B18R2.40 CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_200000210301 [1,0,0,0,1,0|0,0,0]=2 1176 B18R2.40 CNCCC(c1ccccc1)c2ccccc2 34a_100102657272_100009813428 [1,0,0,0,1,0|0,0,0]=2 1177 B18R2.40 CNCCC(c1ccccc1)c2ccccc2 7a_106832991635_100009813428 [1,0,0,0,1,0|0,0,0]=2 1178 B18R2.40 CNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_200000210301 [1,0,0,0,1,0|1,0,0]=3 1179 B18R2.40 CNCCP(c1ccccc1)c2ccccc2 34a_107094377242_200000210301 [1,0,0,0,1,0|1,0,0]=3 1180 B18R2.40 CNCC[S+](c1ccccc1)c2ccccc2 2230a_106832991635_100010140906 [1,0,0,0,1,0|1,0,0]=3 1181 B18R2.40 CNCC[S+](c1ccccc1)c2ccccc2 7a_106832991635_100010140906 [1,0,0,0,1,0|1,0,0]=3 1182 B18R2.40 COCCC(c1ccccc1)c2ccccc2 34a_100000032380_200000210301 [1,0,0,0,1,0|1,0,0]=3 1183 B18R2.40 COCCC(c1ccccc1)c2ccccc2 34a_100138415774_100009813428 [1,0,0,0,1,0|1,0,0]=3 1184 B18R2.40 COCCC(c1ccccc1)c2ccccc2 7a_100000032380_200000210301 [1,0,0,0,1,0|1,0,0]=3 1185 B18R2.40 COCCN(c1ccccc1)c2ccccc2 34a_100010001939_200000210301 [1,0,0,0,1,0|2,0,0]=4 1186 B18R2.40 COCCN(c1ccccc1)c2ccccc2 7a_100010001939_200000210301 [1,0,0,0,1,0|2,0,0]=4 1187 B18R2.40 COCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000766300 [1,0,0,0,1,0|2,0,0]=4 1188 B18R2.40 COCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000766300 [1,0,0,0,1,0|2,0,0]=4 1189 B18R2.40 COCSC(c1ccccc1)c2ccccc2 62a_100000766300_100011216954 [1,0,0,0,1,0|2,0,0]=4 1190 B18R2.40 CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_200000210301 [1,0,0,0,1,0|1,0,0]=3 1191 B18R2.40 CSCCC(c1ccccc1)c2ccccc2 62a_200000210301_100009813428 [1,0,0,0,1,0|1,0,0]=3 1192 B18R2.40 CSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_200000210301 [1,0,0,0,1,0|2,0,0]=4 1193 B18R2.40 CSCC[S+](c1ccccc1)c2ccccc2 62a_200000210301_100010140906 [1,0,0,0,1,0|2,0,0]=4 1194 B18R2.40 CSCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011218213 [1,0,0,0,1,0|2,0,0]=4 1195 B18R2.40 CSCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011218213 [1,0,0,0,1,0|2,0,0]=4 1196 B18R2.40 CSCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011218213 [1,0,0,0,1,0|2,0,0]=4 1197 B18R2.40 CSCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011218213 [1,0,0,0,1,0|2,0,0]=4 1198 B18R2.40 CSCSC(c1ccccc1)c2ccccc2 62a_100011218213_100011216954 [1,0,0,0,1,0|2,0,0]=4 1199 B18R2.40 [13CH3]NCCC(c1ccccc1)c2ccccc2 2230a_100000272388_200025704644 [1,0,0,0,1,0|0,0,0]=2 1200 B18R2.40 [13CH3]NCCC(c1ccccc1)c2ccccc2 34a_100000272388_200025704644 [1,0,0,0,1,0|0,0,0]=2 1201 B18R2.40 [13CH3]NCCP(c1ccccc1)c2ccccc2 2230a_107094377242_200025704644 [1,0,0,0,1,0|1,0,0]=3 1202 B18R2.40 [13CH3]NCCP(c1ccccc1)c2ccccc2 34a_107094377242_200025704644 [1,0,0,0,1,0|1,0,0]=3 1203 B18R2.40 [13CH3]OCCC(c1ccccc1)c2ccccc2 34a_100000032380_200025704644 [1,0,0,0,1,0|1,0,0]=3 1204 B18R2.40 [13CH3]OCCC(c1ccccc1)c2ccccc2 7a_100000032380_200025704644 [1,0,0,0,1,0|1,0,0]=3 1205 B18R2.40 [13CH3]OCCN(c1ccccc1)c2ccccc2 34a_100010001939_200025704644 [1,0,0,0,1,0|2,0,0]=4 1206 B18R2.40 [13CH3]OCCN(c1ccccc1)c2ccccc2 7a_100010001939_200025704644 [1,0,0,0,1,0|2,0,0]=4 1207 B18R2.40 [13CH3]SCCC(c1ccccc1)c2ccccc2 62a_100009813428_200025704644 [1,0,0,0,1,0|1,0,0]=3 1208 B18R2.40 [13CH3]SCCC(c1ccccc1)c2ccccc2 62a_200025704644_100009813428 [1,0,0,0,1,0|1,0,0]=3 1209 B18R2.40 [13CH3]SCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_200025704644 [1,0,0,0,1,0|2,0,0]=4 1210 B18R2.40 [13CH3]SCC[S+](c1ccccc1)c2ccccc2 62a_200025704644_100010140906 [1,0,0,0,1,0|2,0,0]=4 1211 B20R2.1395 CCCN(Cc1ccccc1)Cc2ccccc2C 2230a_100000184400_100000211839 [1,0,0,0,0,1|2,0,0]=4 1212 B20R2.1395 CCCN(Cc1ccccc1)Cc2ccccc2C 2230a_100000187337_100000210303 [1,0,0,0,0,1|2,0,0]=4 1213 B20R2.1395 CCCN(Cc1ccccc1)Cc2ccccc2C 2230a_100015185261_100015291786 [1,0,0,0,0,1|2,0,0]=4 1214 B20R2.1395 CCCN(Cc1ccccc1)Cc2ccccc2C 269982a_100000184400_100000211839 [1,0,0,0,0,1|2,0,0]=4 1215 B20R2.1395 CCCN(Cc1ccccc1)Cc2ccccc2C 269982a_100000187337_100000210303 [1,0,0,0,0,1|2,0,0]=4 1216 B20R2.1395 CCCN(Cc1ccccc1)Cc2ccccc2C 269982a_100015185261_100000211182 [1,0,0,0,0,1|2,0,0]=4 1217 B20R2.1395 CCCN(Cc1ccccc1)Cc2ccccc2C 270004a_100000184400_100000211143 [1,0,0,0,0,1|2,0,0]=4 1218 B20R2.1395 CCCN(Cc1ccccc1)Cc2ccccc2C 270004a_100015185261_100015611070 [1,0,0,0,0,1|2,0,0]=4 1219 B20R2.1395 CCCN(Cc1ccccc1)Cc2ccccc2C 34a_100000187337_100000210303 [1,0,0,0,0,1|2,0,0]=4 1220 B20R2.190247 O=c1cccccc1OC(CCCl)c2ccccc2 7a_100000036025_200010132975 [1,0,0,0,0,1|2,0,0]=4 1221 B20R2.190404 C=CCC(OCc1ccccc1C)c2ccccc2 34a_100000687291_100000211839 [1,0,0,0,0,1|0,0,2]=4 1222 B20R2.190404 C=CCC(OCc1ccccc1C)c2ccccc2 7a_100000687291_100000211839 [1,0,0,0,0,1|0,0,2]=4 1223 B20R2.190404 CCCC(=NNc1ccccc1C)c2ccccc2 4a_100000184220_100000211045 [1,0,0,0,0,1|1,0,1]=4 1224 B20R2.190404 CCCC(NCc1ccccc1Br)c2ccccc2 207a_100000189686_100000211189 [1,0,0,0,0,1|2,0,0]=4 1225 B20R2.190404 CCCC(NCc1ccccc1Br)c2ccccc2 2230a_100000189686_100000184730 [1,0,0,0,0,1|2,0,0]=4 1226 B20R2.190404 CCCC(NCc1ccccc1Br)c2ccccc2 269862a_100000689332_100000211045 [1,0,0,0,0,1|2,0,0]=4 1227 B20R2.190404 CCCC(NCc1ccccc1Br)c2ccccc2 270004a_100000189686_100000211189 [1,0,0,0,0,1|2,0,0]=4 1228 B20R2.190404 CCCC(NCc1ccccc1Br)c2ccccc2 34a_100000189686_100000184730 [1,0,0,0,0,1|2,0,0]=4 1229 B20R2.190404 CCCC(NCc1ccccc1C)c2ccccc2 207a_100000189686_100000211143 [1,0,0,0,0,1|1,0,0]=3 1230 B20R2.190404 CCCC(NCc1ccccc1C)c2ccccc2 2230a_100000189686_100000211839 [1,0,0,0,0,1|1,0,0]=3 1231 B20R2.190404 CCCC(NCc1ccccc1C)c2ccccc2 269862a_100000174972_100000211045 [1,0,0,0,0,1|1,0,0]=3 1232 B20R2.190404 CCCC(NCc1ccccc1C)c2ccccc2 270004a_100000189686_100000211143 [1,0,0,0,0,1|1,0,0]=3 1233 B20R2.190404 CCCC(NCc1ccccc1C)c2ccccc2 34a_100000189686_100000211839 [1,0,0,0,0,1|1,0,0]=3 1234 B20R2.190404 CCCC(NCc1ccccc1C)c2ccccn2 269862a_100000174972_100000751832 [1,0,0,0,0,1|2,0,0]=4 1235 B20R2.190404 CCCC(NCc1ccccc1C)c2cccnc2 207a_100011351308_100000211143 [1,0,0,0,0,1|2,0,0]=4 1236 B20R2.190404 CCCC(NCc1ccccc1C)c2cccnc2 2230a_100011351308_100000211839 [1,0,0,0,0,1|2,0,0]=4 1237 B20R2.190404 CCCC(NCc1ccccc1C)c2cccnc2 269862a_100000174972_100000700227 [1,0,0,0,0,1|2,0,0]=4 1238 B20R2.190404 CCCC(NCc1ccccc1C)c2cccnc2 270004a_100011351308_100000211143 [1,0,0,0,0,1|2,0,0]=4 1239 B20R2.190404 CCCC(NCc1ccccc1C)c2ccncc2 207a_100011351316_100000211143 [1,0,0,0,0,1|2,0,0]=4 1240 B20R2.190404 CCCC(NCc1ccccc1C)c2ccncc2 269862a_100000174972_100011350605 [1,0,0,0,0,1|2,0,0]=4 1241 B20R2.190404 CCCC(NCc1ccccc1C)c2ccncc2 270004a_100011351316_100000211143 [1,0,0,0,0,1|2,0,0]=4 1242 B20R2.190404 CCCC(NCc1ccccc1Cl)c2ccccc2 207a_100000189686_100000210073 [1,0,0,0,0,1|2,0,0]=4 1243 B20R2.190404 CCCC(NCc1ccccc1Cl)c2ccccc2 2230a_100000189686_100000187162 [1,0,0,0,0,1|2,0,0]=4 1244 B20R2.190404 CCCC(NCc1ccccc1Cl)c2ccccc2 269862a_100000174879_100000211045 [1,0,0,0,0,1|2,0,0]=4 1245 B20R2.190404 CCCC(NCc1ccccc1Cl)c2ccccc2 270004a_100000189686_100000210073 [1,0,0,0,0,1|2,0,0]=4 1246 B20R2.190404 CCCC(NCc1ccccc1Cl)c2ccccc2 34a_100000189686_100000187162 [1,0,0,0,0,1|2,0,0]=4 1247 B20R2.190404 CCCC(NCc1ccccc1F)c2ccccc2 207a_100000189686_100000210811 [1,0,0,0,0,1|2,0,0]=4 1248 B20R2.190404 CCCC(NCc1ccccc1F)c2ccccc2 2230a_100000189686_100000211605 [1,0,0,0,0,1|2,0,0]=4 1249 B20R2.190404 CCCC(NCc1ccccc1F)c2ccccc2 269862a_100000174869_100000211045 [1,0,0,0,0,1|2,0,0]=4 1250 B20R2.190404 CCCC(NCc1ccccc1F)c2ccccc2 270004a_100000189686_100000210811 [1,0,0,0,0,1|2,0,0]=4 1251 B20R2.190404 CCCC(NCc1ccccc1F)c2ccccc2 34a_100000189686_100000211605 [1,0,0,0,0,1|2,0,0]=4 1252 B20R2.190404 CCCC(NCc1ccccc1I)c2ccccc2 207a_100000189686_100000010305 [1,0,0,0,0,1|2,0,0]=4 1253 B20R2.190404 CCCC(NCc1ccccc1I)c2ccccc2 2230a_100000189686_100011215278 [1,0,0,0,0,1|2,0,0]=4 1254 B20R2.190404 CCCC(NCc1ccccc1I)c2ccccc2 269862a_100015347259_100000211045 [1,0,0,0,0,1|2,0,0]=4 1255 B20R2.190404 CCCC(NCc1ccccc1I)c2ccccc2 270004a_100000189686_100000010305 [1,0,0,0,0,1|2,0,0]=4 1256 B20R2.190404 CCCC(NCc1ccccc1I)c2ccccc2 34a_100000189686_100011215278 [1,0,0,0,0,1|2,0,0]=4 1257 B20R2.190404 CCCC(NCc1ccccc1O)c2ccccc2 269862a_100000185550_100000211045 [1,0,0,0,0,1|2,0,0]=4 1258 B20R2.190404 CCCC(NCc1cccnc1C)c2ccccc2 207a_100000189686_100000751968 [1,0,0,0,0,1|2,0,0]=4 1259 B20R2.190404 CCCC(NCc1cccnc1C)c2ccccc2 2230a_100000189686_100000732876 [1,0,0,0,0,1|2,0,0]=4 1260 B20R2.190404 CCCC(NCc1cccnc1C)c2ccccc2 270004a_100000189686_100000751968 [1,0,0,0,0,1|2,0,0]=4 1261 B20R2.190404 CCCC(NCc1cccnc1C)c2ccccc2 34a_100000189686_100000732876 [1,0,0,0,0,1|2,0,0]=4 1262 B20R2.190404 CCCC(NCc1ccncc1C)c2ccccc2 2230a_100000189686_100020672808 [1,0,0,0,0,1|2,0,0]=4 1263 B20R2.190404 CCCC(NCc1ccncc1C)c2ccccc2 269862a_100000708811_100000211045 [1,0,0,0,0,1|2,0,0]=4 1264 B20R2.190404 CCCC(NCc1ccncc1C)c2ccccc2 34a_100000189686_100020672809 [1,0,0,0,0,1|2,0,0]=4 1265 B20R2.190404 CCCC(NCc1cnccc1C)c2ccccc2 207a_100000189686_100000685662 [1,0,0,0,0,1|2,0,0]=4 1266 B20R2.190404 CCCC(NCc1cnccc1C)c2ccccc2 2230a_100000189686_100000690890 [1,0,0,0,0,1|2,0,0]=4 1267 B20R2.190404 CCCC(NCc1cnccc1C)c2ccccc2 269862a_100011997553_100000211045 [1,0,0,0,0,1|2,0,0]=4 1268 B20R2.190404 CCCC(NCc1cnccc1C)c2ccccc2 270004a_100000189686_100000685662 [1,0,0,0,0,1|2,0,0]=4 1269 B20R2.190404 CCCC(NCc1cnccc1C)c2ccccc2 34a_100000189686_100000690890 [1,0,0,0,0,1|2,0,0]=4 1270 B20R2.190404 CCCC(NCc1ncccc1C)c2ccccc2 207a_100000189686_100000698913 [1,0,0,0,0,1|2,0,0]=4 1271 B20R2.190404 CCCC(NCc1ncccc1C)c2ccccc2 2230a_100000189686_100000696600 [1,0,0,0,0,1|2,0,0]=4 1272 B20R2.190404 CCCC(NCc1ncccc1C)c2ccccc2 270004a_100000189686_100000698913 [1,0,0,0,0,1|2,0,0]=4 1273 B20R2.190404 CCCC(NCc1ncccc1C)c2ccccc2 34a_100000189686_100000696600 [1,0,0,0,0,1|2,0,0]=4 1274 B20R2.190404 CCCC(OCc1ccccc1Br)c2ccccc2 34a_100000747916_100000184730 [1,0,0,0,0,1|1,0,0]=3 1275 B20R2.190404 CCCC(OCc1ccccc1Br)c2ccccc2 7a_100000747916_100000184730 [1,0,0,0,0,1|1,0,0]=3 1276 B20R2.190404 CCCC(OCc1ccccc1C)c2ccccc2 34a_100000747916_100000211839 [1,0,0,0,0,1|0,0,0]=2 1277 B20R2.190404 CCCC(OCc1ccccc1C)c2ccccc2 7a_100000747916_100000211839 [1,0,0,0,0,1|0,0,0]=2 1278 B20R2.190404 CCCC(OCc1ccccc1Cl)c2ccccc2 34a_100000747916_100000187162 [1,0,0,0,0,1|1,0,0]=3 1279 B20R2.190404 CCCC(OCc1ccccc1Cl)c2ccccc2 7a_100000747916_100000187162 [1,0,0,0,0,1|1,0,0]=3 1280 B20R2.190404 CCCC(OCc1ccccc1F)c2ccccc2 34a_100000747916_100000211605 [1,0,0,0,0,1|1,0,0]=3 1281 B20R2.190404 CCCC(OCc1ccccc1F)c2ccccc2 7a_100000747916_100000211605 [1,0,0,0,0,1|1,0,0]=3 1282 B20R2.190404 CCCC(OCc1ccccc1I)c2ccccc2 34a_100000747916_100011215278 [1,0,0,0,0,1|1,0,0]=3 1283 B20R2.190404 CCCC(OCc1ccccc1I)c2ccccc2 7a_100000747916_100011215278 [1,0,0,0,0,1|1,0,0]=3 1284 B20R2.190404 CCCC(OCc1cccnc1Br)c2ccccc2 34a_100000747916_100010140945 [1,0,0,0,0,1|2,0,0]=4 1285 B20R2.190404 CCCC(OCc1cccnc1Br)c2ccccc2 7a_100000747916_100010140945 [1,0,0,0,0,1|2,0,0]=4 1286 B20R2.190404 CCCC(OCc1cccnc1C)c2ccccc2 34a_100000747916_100000732876 [1,0,0,0,0,1|1,0,0]=3 1287 B20R2.190404 CCCC(OCc1cccnc1C)c2ccccc2 7a_100000747916_100000732876 [1,0,0,0,0,1|1,0,0]=3 1288 B20R2.190404 CCCC(OCc1cccnc1Cl)c2ccccc2 34a_100000747916_100000045678 [1,0,0,0,0,1|2,0,0]=4 1289 B20R2.190404 CCCC(OCc1cccnc1Cl)c2ccccc2 7a_100000747916_100000045678 [1,0,0,0,0,1|2,0,0]=4 1290 B20R2.190404 CCCC(OCc1cccnc1F)c2ccccc2 34a_100000747916_100000099810 [1,0,0,0,0,1|2,0,0]=4 1291 B20R2.190404 CCCC(OCc1cccnc1F)c2ccccc2 7a_100000747916_100000099810 [1,0,0,0,0,1|2,0,0]=4 1292 B20R2.190404 CCCC(OCc1ccncc1C)c2ccccc2 34a_100000747916_100020672809 [1,0,0,0,0,1|1,0,0]=3 1293 B20R2.190404 CCCC(OCc1ccncc1C)c2ccccc2 7a_100000747916_100020672808 [1,0,0,0,0,1|1,0,0]=3 1294 B20R2.190404 CCCC(OCc1ccncc1Cl)c2ccccc2 7a_100000747916_100000763264 [1,0,0,0,0,1|2,0,0]=4 1295 B20R2.190404 CCCC(OCc1cnccc1C)c2ccccc2 34a_100000747916_100000690890 [1,0,0,0,0,1|1,0,0]=3 1296 B20R2.190404 CCCC(OCc1cnccc1C)c2ccccc2 7a_100000747916_100000690890 [1,0,0,0,0,1|1,0,0]=3 1297 B20R2.190404 CCCC(OCc1ncccc1Br)c2ccccc2 34a_100000747916_100025702911 [1,0,0,0,0,1|2,0,0]=4 1298 B20R2.190404 CCCC(OCc1ncccc1Br)c2ccccc2 7a_100000747916_100025702911 [1,0,0,0,0,1|2,0,0]=4 1299 B20R2.190404 CCCC(OCc1ncccc1C)c2ccccc2 34a_100000747916_100000696600 [1,0,0,0,0,1|1,0,0]=3 1300 B20R2.190404 CCCC(OCc1ncccc1C)c2ccccc2 7a_100000747916_100000696600 [1,0,0,0,0,1|1,0,0]=3 1301 B20R2.190404 CCCC(OCc1ncccc1Cl)c2ccccc2 7a_100000747916_100000099807 [1,0,0,0,0,1|2,0,0]=4 1302 B20R2.190404 CCCC(OCc1ncccc1F)c2ccccc2 34a_100000747916_100000104219 [1,0,0,0,0,1|2,0,0]=4 1303 B20R2.190404 CCCC(OCc1ncccc1F)c2ccccc2 7a_100000747916_100000104219 [1,0,0,0,0,1|2,0,0]=4 1304 B20R2.190404 CCCC(OCc1ncccc1O)c2ccccc2 34a_100000747916_200020655725 [1,0,0,0,0,1|2,0,0]=4 1305 B20R2.190404 CCCC(OCc1ncccc1O)c2ccccc2 7a_100000747916_200020655725 [1,0,0,0,0,1|2,0,0]=4 1306 B20R2.190404 CCCN(CCc1ccccc1C)c2ccccc2 2230a_200011218496_100011713688 [1,0,0,0,0,1|2,0,0]=4 1307 B20R2.190404 CCCN(CCc1ccccc1C)c2ccccc2 269982a_200011218496_100011713688 [1,0,0,0,0,1|2,0,0]=4 1308 B20R2.190404 CCCN(CCc1ccccc1C)c2ccccc2 34a_200011218496_100011713688 [1,0,0,0,0,1|2,0,0]=4 1309 B20R2.190404 COCC(NCc1ccccc1C)c2ccccc2 269862a_100000174972_100000765260 [1,0,0,0,0,1|2,0,0]=4 1310 B20R2.190404 COC[C@@H](NCc1ccccc1C)c2ccccc2 207a_103619048568_100000211143 [1,0,0,0,0,1|2,0,0]=4 1311 B20R2.190404 COC[C@@H](NCc1ccccc1C)c2ccccc2 2230a_103619048568_100000211839 [1,0,0,0,0,1|2,0,0]=4 1312 B20R2.190404 COC[C@@H](NCc1ccccc1C)c2ccccc2 270004a_103619048568_100000211143 [1,0,0,0,0,1|2,0,0]=4 1313 B20R2.190404 COC[C@@H](NCc1ccccc1C)c2ccccc2 34a_103619048568_100000211839 [1,0,0,0,0,1|2,0,0]=4 1314 B20R2.190404 Cc1ccccc1CN[C@@H](CCO)c2ccccc2 207a_100025705951_100000211143 [1,0,0,0,0,1|2,0,0]=4 1315 B20R2.190404 Cc1ccccc1CN[C@@H](CCO)c2ccccc2 2230a_100025705951_100000211839 [1,0,0,0,0,1|2,0,0]=4 1316 B20R2.190404 Cc1ccccc1CN[C@@H](CCO)c2ccccc2 270004a_100025705951_100000211143 [1,0,0,0,0,1|2,0,0]=4 1317 B20R2.190404 Cc1ccccc1COC(CCCl)c2ccccc2 7a_100000698903_200010132975 [1,0,0,0,0,1|1,0,0]=3 1318 B20R2.190404 Cc1ccccc1COC(CCN)c2ccccc2 34a_100000763605_100000211839 [1,0,0,0,0,1|0,0,0]=2 1319 B20R2.190404 Cc1ccccc1CO[C@H](CC#N)c2ccccc2 7a_100009817555_100000211839 [1,0,0,0,0,1|0,0,2]=4 1320 B20R2.190404 Cc1ccccc1CO[C@H](CCCl)c2ccccc2 34a_100000729684_100000211839 [1,0,0,0,0,1|1,0,0]=3 1321 B20R2.190404 Cc1ccccc1CO[C@H](CCCl)c2ccccc2 7a_100000729684_100000211839 [1,0,0,0,0,1|1,0,0]=3 1322 B20R2.190404 Cc1ccccc1CSC(CCCl)c2ccccc2 62a_100000211839_200010132975 [1,0,0,0,0,1|1,1,0]=4 1323 B20R2.190404 Cc1ccccc1CSC(CCCl)c2ccccc2 62a_200010132975_100000211839 [1,0,0,0,0,1|1,1,0]=4 1324 B20R2.190404 Cc1cccnc1COC(CCN)c2ccccc2 34a_100000763605_100000696600 [1,0,0,0,0,1|1,0,0]=3 1325 B20R2.190404 Cc1cccnc1CO[C@H](CCCl)c2ccccc2 34a_100000729684_100000696600 [1,0,0,0,0,1|2,0,0]=4 1326 B20R2.190404 Cc1cccnc1CO[C@H](CCCl)c2ccccc2 7a_100000729684_100000696600 [1,0,0,0,0,1|2,0,0]=4 1327 B20R2.190404 Cc1ccncc1COC(CCN)c2ccccc2 34a_100000763605_100000690890 [1,0,0,0,0,1|1,0,0]=3 1328 B20R2.190404 Cc1ccncc1CO[C@H](CCCl)c2ccccc2 34a_100000729684_100000690890 [1,0,0,0,0,1|2,0,0]=4 1329 B20R2.190404 Cc1ccncc1CO[C@H](CCCl)c2ccccc2 7a_100000729684_100000690890 [1,0,0,0,0,1|2,0,0]=4 1330 B20R2.190404 Cc1cnccc1COC(CCN)c2ccccc2 34a_100000763605_100020672809 [1,0,0,0,0,1|1,0,0]=3 1331 B20R2.190404 Cc1cnccc1CO[C@H](CCCl)c2ccccc2 34a_100000729684_100020672809 [1,0,0,0,0,1|2,0,0]=4 1332 B20R2.190404 Cc1cnccc1CO[C@H](CCCl)c2ccccc2 7a_100000729684_100020672808 [1,0,0,0,0,1|2,0,0]=4 1333 B20R2.190404 Cc1ncccc1COC(CCCl)c2ccccc2 7a_100000729262_200010132975 [1,0,0,0,0,1|2,0,0]=4 1334 B20R2.190404 Cc1ncccc1COC(CCN)c2ccccc2 34a_100000763605_100000732876 [1,0,0,0,0,1|1,0,0]=3 1335 B20R2.190404 Cc1ncccc1CO[C@H](CCCl)c2ccccc2 34a_100000729684_100000732876 [1,0,0,0,0,1|2,0,0]=4 1336 B20R2.190404 Cc1ncccc1CO[C@H](CCCl)c2ccccc2 7a_100000729684_100000732876 [1,0,0,0,0,1|2,0,0]=4 1337 B20R2.190404 ClCCC(OCc1ccccc1Br)c2ccccc2 7a_100000756307_200010132975 [1,0,0,0,0,1|2,0,0]=4 1338 B20R2.190404 ClCCC(OCc1ccccc1Cl)c2ccccc2 7a_100000210847_200010132975 [1,0,0,0,0,1|2,0,0]=4 1339 B20R2.190404 ClCCC(OCc1ccccc1I)c2ccccc2 7a_100000187465_200010132975 [1,0,0,0,0,1|2,0,0]=4 1340 B20R2.190404 ClCC[C@@H](OCc1ccccc1Br)c2ccccc2 34a_100000729684_100000184730 [1,0,0,0,0,1|2,0,0]=4 1341 B20R2.190404 ClCC[C@@H](OCc1ccccc1Br)c2ccccc2 7a_100000729684_100000184730 [1,0,0,0,0,1|2,0,0]=4 1342 B20R2.190404 ClCC[C@@H](OCc1ccccc1Cl)c2ccccc2 34a_100000729684_100000187162 [1,0,0,0,0,1|2,0,0]=4 1343 B20R2.190404 ClCC[C@@H](OCc1ccccc1Cl)c2ccccc2 7a_100000729684_100000187162 [1,0,0,0,0,1|2,0,0]=4 1344 B20R2.190404 ClCC[C@@H](OCc1ccccc1I)c2ccccc2 34a_100000729684_100011215278 [1,0,0,0,0,1|2,0,0]=4 1345 B20R2.190404 ClCC[C@@H](OCc1ccccc1I)c2ccccc2 7a_100000729684_100011215278 [1,0,0,0,0,1|2,0,0]=4 1346 B20R2.190404 Fc1ccccc1COC(CCCl)c2ccccc2 7a_100000211962_200010132975 [1,0,0,0,0,1|2,0,0]=4 1347 B20R2.190404 Fc1ccccc1CO[C@H](CCCl)c2ccccc2 34a_100000729684_100000211605 [1,0,0,0,0,1|2,0,0]=4 1348 B20R2.190404 Fc1ccccc1CO[C@H](CCCl)c2ccccc2 7a_100000729684_100000211605 [1,0,0,0,0,1|2,0,0]=4 1349 B20R2.190404 NCCC(OCc1ccccc1Br)c2ccccc2 34a_100000763605_100000184730 [1,0,0,0,0,1|1,0,0]=3 1350 B20R2.190404 NCCC(OCc1ccccc1Cl)c2ccccc2 34a_100000763605_100000187162 [1,0,0,0,0,1|1,0,0]=3 1351 B20R2.190404 NCCC(OCc1ccccc1F)c2ccccc2 34a_100000763605_100000211605 [1,0,0,0,0,1|1,0,0]=3 1352 B20R2.190404 NCCC(OCc1ccccc1I)c2ccccc2 34a_100000763605_100011215278 [1,0,0,0,0,1|1,0,0]=3 1353 B20R2.190404 NCCC(OCc1cccnc1Br)c2ccccc2 34a_100000763605_100010140945 [1,0,0,0,0,1|2,0,0]=4 1354 B20R2.190404 NCCC(OCc1cccnc1Cl)c2ccccc2 34a_100000763605_100000045678 [1,0,0,0,0,1|2,0,0]=4 1355 B20R2.190404 NCCC(OCc1cccnc1F)c2ccccc2 34a_100000763605_100000099810 [1,0,0,0,0,1|2,0,0]=4 1356 B20R2.190404 NCCC(OCc1ncccc1Br)c2ccccc2 34a_100000763605_100025702911 [1,0,0,0,0,1|2,0,0]=4 1357 B20R2.190404 NCCC(OCc1ncccc1F)c2ccccc2 34a_100000763605_100000104219 [1,0,0,0,0,1|2,0,0]=4 1358 B20R2.190404 NCCC(OCc1ncccc1O)c2ccccc2 34a_100000763605_200020655725 [1,0,0,0,0,1|2,0,0]=4 1359 B20R2.2842 CNCCN(Cc1ccccc1)Cc2ccccc2 2230a_106832991635_200000104094 [1,0,0,0,0,1|2,0,0]=4 1360 B20R2.2842 CNCCN(Cc1ccccc1)Cc2ccccc2 2230a_200011271996_200000210301 [1,0,0,0,0,1|2,0,0]=4 1361 B20R2.2842 CNCCN(Cc1ccccc1)Cc2ccccc2 7a_106832991635_200000104094 [1,0,0,0,0,1|2,0,0]=4 1362 B20R2.2842 [13CH3]NCCN(Cc1ccccc1)Cc2ccccc2 2230a_200011271996_200025704644 [1,0,0,0,0,1|2,0,0]=4 1363 B22R2.364465 CCCCC(Cc1ccccc1)NCc2ccccc2C 270004a_100000174972_200011218368 [0,0,0,0,0,2|2,0,0]=4 1364 B22R2.150537 CCCCC(NCCc1ccccc1C)c2ccccc2 269862a_100000685071_100000211663 [0,0,0,0,0,2|2,0,0]=4 1365 B22R2.150537 CCCCC(OCCc1ccccc1Br)c2ccccc2 34a_100000698411_100012161201 [0,0,0,0,0,2|2,0,0]=4 1366 B22R2.150537 CCCCC(OCCc1ccccc1Br)c2ccccc2 7a_100000698411_100012161201 [0,0,0,0,0,2|2,0,0]=4 1367 B22R2.150537 CCCCC(OCCc1ccccc1C)c2ccccc2 34a_100000698411_100011713688 [0,0,0,0,0,2|1,0,0]=3 1368 B22R2.150537 CCCCC(OCCc1ccccc1C)c2ccccc2 7a_100000698411_100011713688 [0,0,0,0,0,2|1,0,0]=3 1369 B22R2.150537 CCCCC(OCCc1ccccc1Cl)c2ccccc2 34a_100000698411_100011713703 [0,0,0,0,0,2|2,0,0]=4 1370 B22R2.150537 CCCCC(OCCc1ccccc1Cl)c2ccccc2 7a_100000698411_100011713703 [0,0,0,0,0,2|2,0,0]=4 1371 B22R2.150537 CCCCC(OCCc1ccccc1F)c2ccccc2 34a_100000698411_100000720011 [0,0,0,0,0,2|2,0,0]=4 1372 B22R2.150537 CCCCC(OCCc1ccccc1F)c2ccccc2 7a_100000698411_100000720011 [0,0,0,0,0,2|2,0,0]=4 1373 B22R2.150537 CCCCC(OCCc1ccccc1O)c2ccccc2 34a_100000698411_100000722297 [0,0,0,0,0,2|2,0,0]=4 1374 B22R2.150537 CCCCC(OCCc1ccccc1O)c2ccccc2 7a_100000698411_100000722297 [0,0,0,0,0,2|2,0,0]=4 1375 B22R2.150537 CCCCN(CCOc1ccccc1C)c2ccccc2 2230a_100000211623_100000184434 [0,0,0,0,0,2|2,0,0]=4 1376 B22R2.150537 CCCCN(CCOc1ccccc1C)c2ccccc2 269982a_100000211623_100000184434 [0,0,0,0,0,2|2,0,0]=4 1377 B22R2.150537 CCCCN(CCOc1ccccc1C)c2ccccc2 34a_100000211623_100000184434 [0,0,0,0,0,2|2,0,0]=4 1378 B22R2.150537 CNCCC(NCCc1ccccc1Br)c2ccccc2 269862a_100000747383_100015249630 [0,0,0,0,0,2|2,0,0]=4 1379 B22R2.150537 CNCCC(NCCc1ccccc1C)c2ccccc2 269862a_100000685071_100015249630 [0,0,0,0,0,2|1,0,0]=3 1380 B22R2.150537 CNCCC(NCCc1ccccc1Cl)c2ccccc2 269862a_100011207228_100015249630 [0,0,0,0,0,2|2,0,0]=4 1381 B22R2.150537 CNCCC(NCCc1ccccc1F)c2ccccc2 269862a_100000185272_100015249630 [0,0,0,0,0,2|2,0,0]=4 1382 B22R2.150537 CNCCC(NCCc1ccccc1O)c2ccccc2 269862a_100011207237_100015249630 [0,0,0,0,0,2|2,0,0]=4