0 B20R3.12143 Brc1ccnc2c1ccc(c2)OC3CCCCC3 34a_100010204257_100000210327 [0,0,0,0,0,0|4,0,0]=4 1 B20R3.12143 Brc1ccnc2c1ccc(c2)OC3CCCCC3 7a_100010204257_100000210327 [0,0,0,0,0,0|4,0,0]=4 2 B20R3.12143 Brc1ccnc2c1ccc(c2)OC3CCOCC3 7a_100010204257_100000686592 [0,0,0,0,0,0|4,0,0]=4 3 B20R3.12143 Brc1ccnc2c1ccc(c2)OC3CCSCC3 34a_100010204257_100000069128 [0,0,0,0,0,0|4,0,0]=4 4 B20R3.12143 Brc1ccnc2c1ccc(c2)OC3CCSCC3 7a_100010204257_100011500858 [0,0,0,0,0,0|4,0,0]=4 5 B20R3.12143 Cc1ccnc2c1ccc(c2)OC3CCCCC3 34a_200009854145_100000210327 [0,0,0,0,0,0|4,0,0]=4 6 B20R3.12143 Cc1ccnc2c1ccc(c2)OC3CCCCC3 7a_200009854145_100000210327 [0,0,0,0,0,0|4,0,0]=4 7 B20R3.12143 Cc1ccnc2c1ccc(c2)OC3CCOCC3 7a_200009854145_100000686592 [0,0,0,0,0,0|4,0,0]=4 8 B20R3.12143 Cc1ccnc2c1ccc(c2)OC3CCSCC3 34a_200009854145_100000069128 [0,0,0,0,0,0|4,0,0]=4 9 B20R3.12143 Cc1ccnc2c1ccc(c2)OC3CCSCC3 7a_200009854145_100011500858 [0,0,0,0,0,0|4,0,0]=4 10 B20R3.12143 Clc1ccnc2c1ccc(c2)OC3CCCCC3 34a_100000045489_100000210327 [0,0,0,0,0,0|4,0,0]=4 11 B20R3.12143 Clc1ccnc2c1ccc(c2)OC3CCCCC3 7a_100000045489_100000210327 [0,0,0,0,0,0|4,0,0]=4 12 B20R3.12143 Clc1ccnc2c1ccc(c2)OC3CCOCC3 7a_100000045489_100000686592 [0,0,0,0,0,0|4,0,0]=4 13 B20R3.12143 Clc1ccnc2c1ccc(c2)OC3CCSCC3 34a_100000045489_100000069128 [0,0,0,0,0,0|4,0,0]=4 14 B20R3.12143 Clc1ccnc2c1ccc(c2)OC3CCSCC3 7a_100000045489_100011500858 [0,0,0,0,0,0|4,0,0]=4 15 B20R3.12143 Clc1nccc2c1ccc(c2)OC3CCCCC3 34a_100009867704_100000210327 [0,0,0,0,0,0|2,0,1]=3 16 B20R3.12143 Clc1nccc2c1ccc(c2)OC3CCCCC3 7a_100009867704_100000210327 [0,0,0,0,0,0|2,0,1]=3 17 B20R3.12143 Clc1nccc2c1ccc(c2)OC3CCCOC3 34a_100009867704_100000693364 [0,0,0,0,0,0|3,0,1]=4 18 B20R3.12143 Clc1nccc2c1ccc(c2)OC3CCCOC3 7a_100009867704_100000693364 [0,0,0,0,0,0|3,0,1]=4 19 B20R3.12143 Clc1nccc2c1ccc(c2)OC3CCOCC3 7a_100009867704_100000686592 [0,0,0,0,0,0|2,0,1]=3 20 B20R3.12143 Clc1nccc2c1ccc(c2)OC3CCSCC3 34a_100009867704_100000069128 [0,0,0,0,0,0|2,0,1]=3 21 B20R3.12143 Clc1nccc2c1ccc(c2)OC3CCSCC3 7a_100009867704_100011500858 [0,0,0,0,0,0|2,0,1]=3 22 B20R3.12143 Fc1cccc2c1ncc(c2)OC3CCCCC3 34a_100012184956_100000210327 [0,0,0,0,0,0|4,0,0]=4 23 B20R3.12143 Fc1cccc2c1ncc(c2)OC3CCCCC3 7a_100012184956_100000210327 [0,0,0,0,0,0|4,0,0]=4 24 B20R3.12143 Fc1cccc2c1ncc(c2)OC3CCOCC3 7a_100012184956_100000686592 [0,0,0,0,0,0|4,0,0]=4 25 B20R3.12143 Fc1cccc2c1ncc(c2)OC3CCSCC3 34a_100012184956_100000069128 [0,0,0,0,0,0|4,0,0]=4 26 B20R3.12143 Fc1cccc2c1ncc(c2)OC3CCSCC3 7a_100012184956_100011500858 [0,0,0,0,0,0|4,0,0]=4 27 B20R3.12143 Nc1cccc2c1ccc(c2)OC3CCCCC3 34a_100000034668_100000210327 [0,0,0,0,0,0|3,0,0]=3 28 B20R3.12143 Nc1cccc2c1ccc(c2)OC3CCCCC3 7a_100000034668_100000210327 [0,0,0,0,0,0|3,0,0]=3 29 B20R3.12143 Nc1cccc2c1ccc(c2)OC3CCCOC3 34a_100000034668_100000693364 [0,0,0,0,0,0|4,0,0]=4 30 B20R3.12143 Nc1cccc2c1ccc(c2)OC3CCCOC3 7a_100000034668_100000693364 [0,0,0,0,0,0|4,0,0]=4 31 B20R3.12143 Nc1cccc2c1ccc(c2)OC3CCOCC3 7a_100000034668_100000686592 [0,0,0,0,0,0|3,0,0]=3 32 B20R3.12143 Nc1cccc2c1ccc(c2)OC3CCSCC3 34a_100000034668_100000069128 [0,0,0,0,0,0|3,0,0]=3 33 B20R3.12143 Nc1cccc2c1ccc(c2)OC3CCSCC3 7a_100000034668_100011500858 [0,0,0,0,0,0|3,0,0]=3 34 B20R3.12143 Nc1cccc2c1ccc(c2)SC3CCCCC3 62a_100000210327_100010090037 [0,0,0,0,0,0|3,1,0]=4 35 B20R3.12143 Nc1cccc2c1ccc(c2)SC3CCCCC3 62a_100010090037_100000210327 [0,0,0,0,0,0|3,1,0]=4 36 B20R3.12143 Nc1cccc2c1ccc(c2)SC3CCOCC3 62a_100010090037_100011324220 [0,0,0,0,0,0|3,1,0]=4 37 B20R3.12143 Nc1cccc2c1ccc(c2)SC3CCSCC3 62a_100010090037_100000069128 [0,0,0,0,0,0|3,1,0]=4 38 B20R3.12143 Nc1nccc2c1ccc(c2)SC3CCCCC3 62a_100000210327_100000732483 [0,0,0,0,0,0|2,1,1]=4 39 B20R3.12143 Nc1nccc2c1ccc(c2)SC3CCCCC3 62a_100000732483_100000210327 [0,0,0,0,0,0|2,1,1]=4 40 B20R3.12143 Nc1nccc2c1ccc(c2)SC3CCOCC3 62a_100000732483_100011324220 [0,0,0,0,0,0|2,1,1]=4 41 B20R3.12143 Nc1nccc2c1ccc(c2)SC3CCSCC3 62a_100000732483_100000069128 [0,0,0,0,0,0|2,1,1]=4 42 B20R3.12143 O=C1CCCc2c1ccc(c2)OC3CCCCC3 7a_100000746981_100000210327 [0,0,0,0,0,0|2,0,2]=4 43 B20R3.12143 O=C1CCCc2c1ccc(c2)OC3CCOCC3 7a_100000746981_100000686592 [0,0,0,0,0,0|2,0,2]=4 44 B20R3.12143 O=C1CCCc2c1ccc(c2)OC3CCSCC3 7a_100000746981_100011500858 [0,0,0,0,0,0|2,0,2]=4 45 B20R3.12143 O=C1CCOc2c1ccc(c2)OC3CCCCC3 34a_100000089553_100000210327 [0,0,0,0,0,0|3,0,1]=4 46 B20R3.12143 O=C1CCOc2c1ccc(c2)OC3CCCCC3 7a_100000089553_100000210327 [0,0,0,0,0,0|3,0,1]=4 47 B20R3.12143 O=C1CCOc2c1ccc(c2)OC3CCOCC3 7a_100000089553_100000686592 [0,0,0,0,0,0|3,0,1]=4 48 B20R3.12143 O=C1CCOc2c1ccc(c2)OC3CCSCC3 34a_100000089553_100000069128 [0,0,0,0,0,0|3,0,1]=4 49 B20R3.12143 O=C1CCOc2c1ccc(c2)OC3CCSCC3 7a_100000089553_100011500858 [0,0,0,0,0,0|3,0,1]=4 50 B20R3.12143 O=C1NCCc2c1ccc(c2)OC3CCCCC3 34a_100000087030_100000210327 [0,0,0,0,0,0|1,0,2]=3 51 B20R3.12143 O=C1NCCc2c1ccc(c2)OC3CCCCC3 7a_100000087030_100000210327 [0,0,0,0,0,0|1,0,2]=3 52 B20R3.12143 O=C1NCCc2c1ccc(c2)OC3CCCOC3 34a_100000087030_100000693364 [0,0,0,0,0,0|2,0,2]=4 53 B20R3.12143 O=C1NCCc2c1ccc(c2)OC3CCCOC3 7a_100000087030_100000693364 [0,0,0,0,0,0|2,0,2]=4 54 B20R3.12143 O=C1NCCc2c1ccc(c2)OC3CCOCC3 7a_100000087030_100000686592 [0,0,0,0,0,0|1,0,2]=3 55 B20R3.12143 O=C1NCCc2c1ccc(c2)OC3CCSCC3 34a_100000087030_100000069128 [0,0,0,0,0,0|1,0,2]=3 56 B20R3.12143 O=C1NCCc2c1ccc(c2)OC3CCSCC3 7a_100000087030_100011500858 [0,0,0,0,0,0|1,0,2]=3 57 B20R3.12143 O=C1NCCc2c1ccc(c2)SC3CCCCC3 62a_100000210327_100009817313 [0,0,0,0,0,0|1,1,2]=4 58 B20R3.12143 O=C1NCCc2c1ccc(c2)SC3CCCCC3 62a_100009817313_100000210327 [0,0,0,0,0,0|1,1,2]=4 59 B20R3.12143 O=C1NCCc2c1ccc(c2)SC3CCOCC3 62a_100009817313_100011324220 [0,0,0,0,0,0|1,1,2]=4 60 B20R3.12143 O=C1NCCc2c1ccc(c2)SC3CCSCC3 62a_100009817313_100000069128 [0,0,0,0,0,0|1,1,2]=4 61 B20R3.12143 O=c1[nH]ccc2c1ccc(c2)OC3C=CCCC3 7a_100009857879_100000751183 [0,0,0,0,0,0|1,0,2]=3 62 B20R3.12143 O=c1[nH]ccc2c1ccc(c2)OC3CCCCC3 34a_100009857879_100000210327 [0,0,0,0,0,0|1,0,0]=1 63 B20R3.12143 O=c1[nH]ccc2c1ccc(c2)OC3CCCCC3 7a_100009857879_100000210327 [0,0,0,0,0,0|1,0,0]=1 64 B20R3.12143 O=c1[nH]ccc2c1ccc(c2)OC3CCCOC3 34a_100009857879_100000693364 [0,0,0,0,0,0|2,0,0]=2 65 B20R3.12143 O=c1[nH]ccc2c1ccc(c2)OC3CCCOC3 7a_100009857879_100000693364 [0,0,0,0,0,0|2,0,0]=2 66 B20R3.12143 O=c1[nH]ccc2c1ccc(c2)OC3CCOCC3 7a_100009857879_100000686592 [0,0,0,0,0,0|1,0,0]=1 67 B20R3.12143 O=c1[nH]ccc2c1ccc(c2)OC3CCSCC3 34a_100009857879_100000069128 [0,0,0,0,0,0|1,0,0]=1 68 B20R3.12143 O=c1[nH]ccc2c1ccc(c2)OC3CCSCC3 7a_100009857879_100011500858 [0,0,0,0,0,0|1,0,0]=1 69 B20R3.12143 O=c1[nH]ccc2c1cnc(c2)SC3CCCCC3 62a_100010134373_100000210327 [0,0,0,0,0,0|2,1,0]=3 70 B20R3.12143 O=c1[nH]ccc2c1cnc(c2)SC3CCCOC3 62a_100010134373_100000693364 [0,0,0,0,0,0|3,1,0]=4 71 B20R3.12143 O=c1[nH]ccc2c1cnc(c2)SC3CCOCC3 62a_100010134373_100011324220 [0,0,0,0,0,0|2,1,0]=3 72 B20R3.12143 O=c1[nH]ccc2c1cnc(c2)SC3CCSCC3 62a_100010134373_100000069128 [0,0,0,0,0,0|2,1,0]=3 73 B20R3.12143 O=c1[nH]cnc2c1ccc(c2)NC3CCCCC3 27a_100000182618_100000230960 [0,0,0,0,0,0|3,0,0]=3 74 B20R3.12143 O=c1[nH]cnc2c1ccc(c2)NC3CCCOC3 27a_100000719290_100000230960 [0,0,0,0,0,0|4,0,0]=4 75 B20R3.12143 O=c1[nH]cnc2c1ccc(c2)NC3CCOCC3 27a_100000741149_100000230960 [0,0,0,0,0,0|3,0,0]=3 76 B20R3.12143 O=c1[nH]cnc2c1ccc(c2)NC3CCSCC3 27a_100000748639_100000230960 [0,0,0,0,0,0|3,0,0]=3 77 B20R3.12143 O=c1[nH]cnc2c1ccc(c2)SC3CCCCC3 62a_100000210327_100000230960 [0,0,0,0,0,0|2,1,0]=3 78 B20R3.12143 O=c1[nH]cnc2c1ncc(c2)NC3CCCCC3 27a_100000182618_100000709876 [0,0,0,0,0,0|4,0,0]=4 79 B20R3.12143 O=c1[nH]cnc2c1ncc(c2)NC3CCOCC3 27a_100000741149_100000709876 [0,0,0,0,0,0|4,0,0]=4 80 B20R3.12143 O=c1[nH]cnc2c1ncc(c2)NC3CCSCC3 27a_100000748639_100000709876 [0,0,0,0,0,0|4,0,0]=4 81 B20R3.12143 O=c1[nH]cnc2c1ncc(c2)SC3CCCCC3 62a_100000210327_100000709876 [0,0,0,0,0,0|3,1,0]=4 82 B20R3.12143 O=c1[nH]ncc2c1ncc(c2)SC3CCCCC3 62a_100000210327_100010284064 [0,0,0,0,0,0|3,1,0]=4 83 B20R3.12143 O=c1ccoc2c1ccc(c2)OC3CCCCC3 34a_200000065989_100000210327 [0,0,0,0,0,0|3,0,0]=3 84 B20R3.12143 O=c1ccoc2c1ccc(c2)OC3CCCCC3 7a_200000065989_100000210327 [0,0,0,0,0,0|3,0,0]=3 85 B20R3.12143 O=c1ccoc2c1ccc(c2)OC3CCCOC3 34a_200000065989_100000693364 [0,0,0,0,0,0|4,0,0]=4 86 B20R3.12143 O=c1ccoc2c1ccc(c2)OC3CCCOC3 7a_200000065989_100000693364 [0,0,0,0,0,0|4,0,0]=4 87 B20R3.12143 O=c1ccoc2c1ccc(c2)OC3CCOCC3 7a_200000065989_100000686592 [0,0,0,0,0,0|3,0,0]=3 88 B20R3.12143 O=c1ccoc2c1ccc(c2)OC3CCSCC3 34a_200000065989_100000069128 [0,0,0,0,0,0|3,0,0]=3 89 B20R3.12143 O=c1ccoc2c1ccc(c2)OC3CCSCC3 7a_200000065989_100011500858 [0,0,0,0,0,0|3,0,0]=3 90 B20R3.12143 O=c1ccoc2c1ccc(c2)SC3CCCCC3 62a_100000210327_100010062221 [0,0,0,0,0,0|3,1,0]=4 91 B20R3.12143 Oc1cccc2c1ccc(c2)NC3CCCCC3 34a_100000035793_100000210327 [0,0,0,0,0,0|3,0,1]=4 92 B20R3.12143 Oc1cccc2c1ccc(c2)NC3CCCCC3 7a_100000035793_100000210327 [0,0,0,0,0,0|3,0,1]=4 93 B20R3.12143 Oc1cccc2c1ccc(c2)NC3CCOCC3 7a_100000035793_100000686592 [0,0,0,0,0,0|3,0,1]=4 94 B20R3.12143 Oc1cccc2c1ccc(c2)NC3CCSCC3 34a_100000035793_100000069128 [0,0,0,0,0,0|3,0,1]=4 95 B20R3.12143 Oc1cccc2c1ccc(c2)NC3CCSCC3 7a_100000035793_100011500858 [0,0,0,0,0,0|3,0,1]=4 96 B20R3.12143 Oc1cccc2c1ccc(c2)SC3CCCCC3 62a_100000210327_100010202202 [0,0,0,0,0,0|2,1,1]=4 97 B20R3.12143 Oc1nccc2c1ccc(c2)SC3CCCCC3 62a_100000210327_100000760485 [0,0,0,0,0,0|1,1,2]=4 98 B19R3.19215 c1cc2cc(ccc2cn1)NC3CCCCC3 34a_100000039641_100000210327 [1,0,0,0,0,0|2,0,1]=4 99 B19R3.19215 c1cc2cc(ccc2cn1)NC3CCSCC3 34a_100000039641_100000069128 [1,0,0,0,0,0|2,0,1]=4 100 B19R3.19215 c1cc2cc(ccc2cn1)OC3CCCCC3 34a_100000046372_100000210327 [1,0,0,0,0,0|1,0,1]=3 101 B19R3.19215 c1cc2cc(ccc2cn1)OC3CCCCC3 7a_100000046372_100000210327 [1,0,0,0,0,0|1,0,1]=3 102 B19R3.19215 c1cc2cc(ccc2cn1)OC3CCCOC3 34a_100000046372_100000693364 [1,0,0,0,0,0|2,0,1]=4 103 B19R3.19215 c1cc2cc(ccc2cn1)OC3CCCOC3 7a_100000046372_100000693364 [1,0,0,0,0,0|2,0,1]=4 104 B19R3.19215 c1cc2cc(ccc2cn1)OC3CCOCC3 7a_100000046372_100000686592 [1,0,0,0,0,0|1,0,1]=3 105 B19R3.19215 c1cc2cc(ccc2cn1)OC3CCSCC3 34a_100000046372_100000069128 [1,0,0,0,0,0|1,0,1]=3 106 B19R3.19215 c1cc2cc(ccc2cn1)OC3CCSCC3 7a_100000046372_100011500858 [1,0,0,0,0,0|1,0,1]=3 107 B19R3.19215 c1cc2cc(ccc2cn1)SC3CCCCC3 62a_100000210327_100009816743 [1,0,0,0,0,0|1,1,1]=4 108 B19R3.19215 c1cc2cc(ccc2cn1)SC3CCCCC3 62a_100009816743_100000210327 [1,0,0,0,0,0|1,1,1]=4 109 B19R3.19215 c1cc2cc(ccc2cn1)SC3CCOCC3 62a_100009816743_100011324220 [1,0,0,0,0,0|1,1,1]=4 110 B19R3.19215 c1cc2cc(ccc2cn1)SC3CCSCC3 62a_100009816743_100000069128 [1,0,0,0,0,0|1,1,1]=4 111 B19R3.19215 c1cc2ccc(cc2cn1)OC3CCCCC3 7a_100000752006_100000210327 [1,0,0,0,0,0|3,0,0]=4 112 B19R3.19215 c1cc2ccc(cc2cn1)OC3CCOCC3 7a_100000752006_100000686592 [1,0,0,0,0,0|3,0,0]=4 113 B19R3.19215 c1cc2ccc(cc2cn1)OC3CCSCC3 7a_100000752006_100011500858 [1,0,0,0,0,0|3,0,0]=4 114 B19R3.19215 c1ccc2cc(ccc2c1)NC3CCCCC3 34a_100000211940_100000210327 [1,0,0,0,0,0|3,0,0]=4 115 B19R3.19215 c1ccc2cc(ccc2c1)NC3CCCCC3 7a_100000211940_100000210327 [1,0,0,0,0,0|3,0,0]=4 116 B19R3.19215 c1ccc2cc(ccc2c1)NC3CCOCC3 7a_100000211940_100000686592 [1,0,0,0,0,0|3,0,0]=4 117 B19R3.19215 c1ccc2cc(ccc2c1)NC3CCSCC3 34a_100000211940_100000069128 [1,0,0,0,0,0|3,0,0]=4 118 B19R3.19215 c1ccc2cc(ccc2c1)NC3CCSCC3 7a_100000211940_100011500858 [1,0,0,0,0,0|3,0,0]=4 119 B19R3.19215 c1ccc2cc(ccc2c1)OC3CCCCC3 34a_100000185828_100000210327 [1,0,0,0,0,0|2,0,0]=3 120 B19R3.19215 c1ccc2cc(ccc2c1)OC3CCCCC3 7a_100000185828_100000210327 [1,0,0,0,0,0|2,0,0]=3 121 B19R3.19215 c1ccc2cc(ccc2c1)OC3CCCOC3 34a_100000185828_100000693364 [1,0,0,0,0,0|3,0,0]=4 122 B19R3.19215 c1ccc2cc(ccc2c1)OC3CCCOC3 7a_100000185828_100000693364 [1,0,0,0,0,0|3,0,0]=4 123 B19R3.19215 c1ccc2cc(ccc2c1)OC3CCOCC3 7a_100000185828_100000686592 [1,0,0,0,0,0|2,0,0]=3 124 B19R3.19215 c1ccc2cc(ccc2c1)OC3CCSCC3 34a_100000185828_100000069128 [1,0,0,0,0,0|2,0,0]=3 125 B19R3.19215 c1ccc2cc(ccc2c1)OC3CCSCC3 7a_100000185828_100011500858 [1,0,0,0,0,0|2,0,0]=3 126 B19R3.19215 c1ccc2cc(ccc2c1)SC3CCCCC3 62a_100000210327_100000233703 [1,0,0,0,0,0|2,1,0]=4 127 B19R3.19215 c1ccc2ncc(cc2c1)OC3CCCCC3 34a_100011934006_100000210327 [1,0,0,0,0,0|3,0,0]=4 128 B19R3.19215 c1ccc2ncc(cc2c1)OC3CCCCC3 7a_100011934006_100000210327 [1,0,0,0,0,0|3,0,0]=4 129 B19R3.19215 c1ccc2ncc(cc2c1)OC3CCOCC3 7a_100011934006_100000686592 [1,0,0,0,0,0|3,0,0]=4 130 B19R3.19215 c1ccc2ncc(cc2c1)OC3CCSCC3 34a_100011934006_100000069128 [1,0,0,0,0,0|3,0,0]=4 131 B19R3.19215 c1ccc2ncc(cc2c1)OC3CCSCC3 7a_100011934006_100011500858 [1,0,0,0,0,0|3,0,0]=4 132 B19R3.19215 c1cnc2cc(ccc2c1)OC3CCCCC3 34a_100011216045_100000210327 [1,0,0,0,0,0|3,0,0]=4 133 B19R3.19215 c1cnc2cc(ccc2c1)OC3CCSCC3 34a_100011216045_100000069128 [1,0,0,0,0,0|3,0,0]=4 134 B19R3.19215 c1cnc2ccc(cc2c1)OC3CCCCC3 34a_100011215586_100000210327 [1,0,0,0,0,0|3,0,0]=4 135 B19R3.19215 c1cnc2ccc(cc2c1)OC3CCCCC3 7a_100011215586_100000210327 [1,0,0,0,0,0|3,0,0]=4 136 B19R3.19215 c1cnc2ccc(cc2c1)OC3CCOCC3 7a_100011215586_100000686592 [1,0,0,0,0,0|3,0,0]=4 137 B19R3.19215 c1cnc2ccc(cc2c1)OC3CCSCC3 34a_100011215586_100000069128 [1,0,0,0,0,0|3,0,0]=4 138 B19R3.19215 c1cnc2ccc(cc2c1)OC3CCSCC3 7a_100011215586_100011500858 [1,0,0,0,0,0|3,0,0]=4 139 B21R3.153323 Cn1ccc2cc(ccc2c1=O)SC3CCCCC3 62a_100000210327_100010246303 [0,1,0,0,0,0|1,1,0]=3 140 B21R3.153323 Cn1ccc2cc(ccc2c1=O)SC3CCCCC3 62a_100010246303_100000210327 [0,1,0,0,0,0|1,1,0]=3 141 B21R3.153323 Cn1ccc2cc(ccc2c1=O)SC3CCCOC3 62a_100010246303_100000693364 [0,1,0,0,0,0|2,1,0]=4 142 B21R3.153323 Cn1ccc2cc(ccc2c1=O)SC3CCOCC3 62a_100010246303_100011324220 [0,1,0,0,0,0|1,1,0]=3 143 B21R3.153323 Cn1ccc2cc(ccc2c1=O)SC3CCSCC3 62a_100010246303_100000069128 [0,1,0,0,0,0|1,1,0]=3 144 B21R3.153323 O=C1C=Cc2cc(ccc2C1=O)SC3CCCCC3 62a_100000210327_100009812793 [0,1,0,0,0,0|2,1,0]=4 145 B21R3.153323 O=C1C=Cc2cc(ccc2C1=O)SC3CCCCC3 62a_100009812793_100000210327 [0,1,0,0,0,0|2,1,0]=4 146 B21R3.153323 O=C1C=Cc2cc(ccc2C1=O)SC3CCOCC3 62a_100009812793_100011324220 [0,1,0,0,0,0|2,1,0]=4 147 B21R3.153323 O=C1C=Cc2cc(ccc2C1=O)SC3CCSCC3 62a_100009812793_100000069128 [0,1,0,0,0,0|2,1,0]=4 148 B21R3.397700 CN(c1ccc2c(=O)[nH]cnc2c1)C3CCCCC3 27a_100000207522_100000230960 [0,1,0,0,0,0|3,0,0]=4 149 B21R3.397700 CN(c1ccc2c(=O)[nH]cnc2c1)C3CCOCC3 27a_100020587155_100000230960 [0,1,0,0,0,0|3,0,0]=4 150 B21R3.397700 CN(c1ccc2c(=O)[nH]cnc2c1)C3CCSCC3 27a_100015184757_100000230960 [0,1,0,0,0,0|3,0,0]=4 151 B21R3.397700 O=C(c1ccc2c(=O)[nH]ccc2c1)C3CCCCC3 1458a_200015497760_100000210327 [0,1,0,0,0,0|2,0,0]=3 152 B21R3.397700 O=C(c1ccc2c(=O)[nH]ccc2c1)C3CCCOC3 1458a_200015497760_100000693364 [0,1,0,0,0,0|3,0,0]=4 153 B21R3.397700 O=C(c1ccc2c(=O)[nH]ccc2c1)C3CCOCC3 1458a_200015497760_100011324220 [0,1,0,0,0,0|2,0,0]=3 154 B21R3.397700 O=C(c1ccc2c(=O)[nH]ccc2c1)N3CCOCC3 240690a_100015191051_200015497760 [0,1,0,0,0,0|3,0,0]=4 155 B21R3.397700 O=C(c1ccc2c(=O)[nH]ccc2c1)N3CCOCC3 527a_100015191051_200015497760 [0,1,0,0,0,0|3,0,0]=4 156 B21R3.397700 O=C(c1ccc2c(=O)[nH]ccc2c1)N3CCSCC3 240690a_100000737611_200015497760 [0,1,0,0,0,0|3,0,0]=4 157 B21R3.397700 O=C(c1ccc2c(=O)[nH]ccc2c1)N3CCSCC3 527a_100000737611_200015497760 [0,1,0,0,0,0|3,0,0]=4 158 B21R3.397700 O=C(c1ccc2c(=O)[nH]cnc2c1)C3CCCCC3 1458a_100011298682_100000210327 [0,1,0,0,0,0|3,0,0]=4 159 B21R3.397700 O=C(c1ccc2c(=O)[nH]cnc2c1)C3CCOCC3 1458a_100011298682_100011324220 [0,1,0,0,0,0|3,0,0]=4 160 B21R3.442816 CC1CCCCC1Nc2ccc3c(=O)[nH]cnc3c2 27a_100000211402_100000230960 [0,1,0,0,0,0|3,0,0]=4 161 B21R3.442816 FC1CCCCC1Oc2ccc3c(nccc3c2)Cl 34a_100009867704_100015423560 [0,1,0,0,0,0|2,0,1]=4 162 B21R3.442816 Nc1cccc2c1ccc(c2)OC3CCCCC3F 34a_100000034668_100015423560 [0,1,0,0,0,0|3,0,0]=4 163 B21R3.442816 Nc1cccc2c1ccc(c2)OC3CCCCC3O 34a_100000034668_100000038908 [0,1,0,0,0,0|3,0,0]=4 164 B21R3.442816 O=C1CCCCC1Oc2ccc3c(=O)[nH]ccc3c2 34a_100009857879_100000754470 [0,1,0,0,0,0|1,0,1]=3 165 B21R3.442816 O=C1CCCCC1Oc2ccc3c(=O)[nH]ccc3c2 7a_100009857879_100000204591 [0,1,0,0,0,0|1,0,1]=3 166 B21R3.442816 O=C1CCOCC1Oc2ccc3c(=O)[nH]ccc3c2 34a_100009857879_100012180262 [0,1,0,0,0,0|2,0,1]=4 167 B21R3.442816 O=C1CCOCC1Oc2ccc3c(=O)[nH]ccc3c2 7a_100009857879_100012180262 [0,1,0,0,0,0|2,0,1]=4 168 B21R3.442816 O=C1NCCCC1Oc2ccc3c(=O)[nH]ccc3c2 34a_100009857879_100000687798 [0,1,0,0,0,0|2,0,1]=4 169 B21R3.442816 O=C1NCCCC1Oc2ccc3c(=O)[nH]ccc3c2 7a_100009857879_100000687798 [0,1,0,0,0,0|2,0,1]=4 170 B21R3.442816 O=C1NCCc2c1ccc(c2)OC3CCCCC3F 34a_100000087030_100015423560 [0,1,0,0,0,0|1,0,2]=4 171 B21R3.442816 O=C1NCCc2c1ccc(c2)OC3CCCCC3O 34a_100000087030_100000038908 [0,1,0,0,0,0|1,0,2]=4 172 B21R3.442816 O=c1[nH]ccc2c1ccc(c2)OC3CCCCC3F 34a_100009857879_100015423560 [0,1,0,0,0,0|1,0,0]=2 173 B21R3.442816 O=c1[nH]ccc2c1ccc(c2)OC3CCCCC3O 34a_100009857879_100000038908 [0,1,0,0,0,0|1,0,0]=2 174 B21R3.442816 O=c1[nH]ccc2c1cnc(c2)SC3CCCCC3F 62a_100010134373_100015423560 [0,1,0,0,0,0|2,1,0]=4 175 B21R3.442816 O=c1[nH]ccc2c1cnc(c2)SC3CCCCC3O 62a_100010134373_100000038908 [0,1,0,0,0,0|2,1,0]=4 176 B21R3.442816 O=c1[nH]cnc2c1ccc(c2)N[C@@H]3CCCC[C@@H]3O 27a_100015191688_100000230960 [0,1,0,0,0,0|3,0,0]=4 177 B21R3.442816 O=c1[nH]cnc2c1ccc(c2)N[C@@H]3CCCC[C@H]3F 27a_100015195156_100000230960 [0,1,0,0,0,0|3,0,0]=4 178 B21R3.442816 O=c1[nH]cnc2c1ccc(c2)N[C@@H]3CCOC[C@@H]3O 27a_100016994285_100000230960 [0,1,0,0,0,0|3,0,0]=4 179 B21R3.442816 O=c1[nH]cnc2c1ccc(c2)N[C@H]3CCOC[C@@H]3F 27a_100016994078_100000230960 [0,1,0,0,0,0|3,0,0]=4 180 B21R3.442816 O=c1[nH]cnc2c1ccc(c2)SC3CCCCC3F 62a_100015423560_100000230960 [0,1,0,0,0,0|2,1,0]=4 181 B21R3.442816 O=c1[nH]cnc2c1ccc(c2)SC3CCCCC3O 62a_100000038908_100000230960 [0,1,0,0,0,0|2,1,0]=4 182 B21R3.442816 O=c1ccoc2c1ccc(c2)OC3CCCCC3F 34a_200000065989_100015423560 [0,1,0,0,0,0|3,0,0]=4 183 B21R3.442816 O=c1ccoc2c1ccc(c2)OC3CCCCC3O 34a_200000065989_100000038908 [0,1,0,0,0,0|3,0,0]=4 184 B21R3.442816 OC1CCCCC1Oc2ccc3c(nccc3c2)Cl 34a_100009867704_100000038908 [0,1,0,0,0,0|2,0,1]=4 185 B21R3.475437 Cc1cc2cc(ccc2c(=O)[nH]1)SC3CCCCC3 62a_100000210327_100010883700 [0,1,0,0,0,0|1,1,0]=3 186 B21R3.475437 Cc1nc2cc(ccc2c(=O)[nH]1)NC3CCCCC3 27a_100000182618_100012357626 [0,1,0,0,0,0|3,0,0]=4 187 B21R3.475437 Cc1nc2cc(ccc2c(=O)[nH]1)NC3CCOCC3 27a_100000741149_100012357626 [0,1,0,0,0,0|3,0,0]=4 188 B21R3.475437 Cc1nc2cc(ccc2c(=O)[nH]1)NC3CCSCC3 27a_100000748639_100012357626 [0,1,0,0,0,0|3,0,0]=4 189 B21R3.475437 Cc1nc2cc(ccc2c(=O)[nH]1)SC3CCCCC3 62a_100000210327_100012357626 [0,1,0,0,0,0|2,1,0]=4 190 B21R3.475437 O=C1Cc2cc(ccc2C(=O)N1)SC3CCCCC3 62a_100000210327_100010160918 [0,1,0,0,0,0|1,1,1]=4 191 B21R3.475437 O=c1[nH]c(=O)c2ccc(cc2[nH]1)NC3CCCCC3 27a_100000182618_100012351534 [0,1,0,0,0,0|3,0,0]=4 192 B21R3.475437 O=c1[nH]c(=O)c2ccc(cc2[nH]1)NC3CCOCC3 27a_100000741149_100012351534 [0,1,0,0,0,0|3,0,0]=4 193 B21R3.475437 O=c1[nH]c(=O)c2ccc(cc2[nH]1)NC3CCSCC3 27a_100000748639_100012351534 [0,1,0,0,0,0|3,0,0]=4 194 B21R3.475437 O=c1[nH]c(=O)c2ccc(cc2[nH]1)SC3CCCCC3 62a_100000210327_100010219097 [0,1,0,0,0,0|2,1,0]=4 195 B21R3.659620 CC1CCC(CC1)Oc2ccc3c(=O)[nH]ccc3c2 34a_100009857879_200011216234 [0,1,0,0,0,0|1,0,0]=2 196 B21R3.659620 CC1CCC(CC1)Oc2ccc3c(=O)ccoc3c2 34a_200000065989_200011216234 [0,1,0,0,0,0|3,0,0]=4 197 B21R3.659620 CC1CCC(CC1)Oc2ccc3c(c2)CCNC3=O 34a_100000087030_200011216234 [0,1,0,0,0,0|1,0,2]=4 198 B21R3.659620 CC1CCC(CC1)Oc2ccc3c(cccc3c2)N 34a_100000034668_200011216234 [0,1,0,0,0,0|3,0,0]=4 199 B21R3.659620 CC1CCC(CC1)Oc2ccc3c(nccc3c2)Cl 34a_100009867704_200011216234 [0,1,0,0,0,0|2,0,1]=4 200 B21R3.659620 CC1CCC(CC1)Sc2cc3cc[nH]c(=O)c3cn2 62a_100010134373_200011216234 [0,1,0,0,0,0|2,1,0]=4 201 B21R3.659620 CN1CCC(CC1)Nc2ccc3c(=O)[nH]cnc3c2 27a_100000198570_100000230960 [0,1,0,0,0,0|2,0,0]=3 202 B21R3.659620 CN1CCC(CC1)Nc2cnc3c(=O)[nH]cnc3c2 27a_100000198570_100000709876 [0,1,0,0,0,0|3,0,0]=4 203 B21R3.659620 CN1CCC(CC1)Sc2cc3cc[nH]c(=O)c3cn2 62a_100010134373_100011215917 [0,1,0,0,0,0|1,1,0]=3 204 B21R3.659620 CN1CCC(CC1)Sc2ccc3c(c2)CCNC3=O 62a_100009817313_100011215917 [0,1,0,0,0,0|0,1,2]=4 205 B21R3.659620 CN1CCC(CC1)Sc2ccc3c(cccc3c2)N 62a_100010090037_100011215917 [0,1,0,0,0,0|2,1,0]=4 206 B21R3.659620 CN1CCC(CC1)Sc2ccc3c(nccc3c2)N 62a_100000732483_100011215917 [0,1,0,0,0,0|1,1,1]=4 207 B21R3.659620 C[C@H]1CC[C@@H](CC1)Nc2ccc3c(=O)[nH]cnc3c2 27a_100020625639_100000230960 [0,1,0,0,0,0|3,0,0]=4 208 B21R3.659620 O=c1[nH]cnc2c1ccc(c2)N[C@H]3CC[C@H](CC3)O 27a_100020628982_100000230960 [0,1,0,0,0,0|3,0,0]=4 209 B21R3.6682897 Clc1cccc2c1c(cc(c2)OC3CCCCC3)Br 34a_103552013942_100000210327 [0,1,0,0,0,0|3,0,0]=4 210 B21R3.6682897 Clc1cccc2c1c(cc(c2)OC3CCCCC3)Br 7a_103552013942_100000210327 [0,1,0,0,0,0|3,0,0]=4 211 B21R3.6682897 Clc1cccc2c1c(cc(c2)OC3CCOCC3)Br 7a_103552013942_100000686592 [0,1,0,0,0,0|3,0,0]=4 212 B21R3.6682897 Clc1cccc2c1c(cc(c2)OC3CCSCC3)Br 34a_103552013942_100000069128 [0,1,0,0,0,0|3,0,0]=4 213 B21R3.6682897 Clc1cccc2c1c(cc(c2)OC3CCSCC3)Br 7a_103552013942_100011500858 [0,1,0,0,0,0|3,0,0]=4 214 B21R3.7440561 CC1CCCC(C1)Nc2ccc3c(=O)[nH]cnc3c2 27a_100011194320_100000230960 [0,1,0,0,0,0|3,0,0]=4 215 B21R3.7440561 O=C1CC(CCN1)Nc2ccc3c(=O)[nH]cnc3c2 27a_100016994916_100000230960 [0,1,0,0,0,0|2,0,1]=4 216 B21R3.7440561 O=c1[nH]cnc2c1ccc(c2)NC3CCCC(C3)O 27a_100015190357_100000230960 [0,1,0,0,0,0|3,0,0]=4 217 B21R3.38073023 CC1(CCOCC1)Nc2ccc3c(=O)[nH]cnc3c2 27a_100000692449_100000230960 [0,1,0,0,0,0|3,0,0]=4 218 B19R2.265 C=CCC(=O)c1ccc(cc1)OC2CCOCC2 1458a_100000748587_100000210623 [0,0,1,0,0,0|2,0,0]=3 219 B19R2.265 CCNC(=O)c1ccc(cc1)OC2CCOCC2 11a_100015525214_100000748587 [0,0,1,0,0,0|1,0,2]=4 220 B19R2.265 CCNC(=O)c1ccc(cc1)OC2CCOCC2 240690a_100015525214_100000748587 [0,0,1,0,0,0|1,0,2]=4 221 B19R2.265 CCNC(=O)c1ccc(cc1)OC2CCOCC2 527a_100015525214_100000748587 [0,0,1,0,0,0|1,0,2]=4 222 B19R2.265 CNNC(=O)c1ccc(cc1)OC2CCOCC2 22a_100016993582_100000748587 [0,0,1,0,0,0|2,0,1]=4 223 B19R2.356 CCCC=Cc1cccc(c1)OC2CCNCC2 271570a_100016258520_100000701727 [0,0,1,0,0,0|2,0,1]=4 224 B19R2.356 CCOC=Cc1cccc(c1)OC2CCNCC2 271570a_100016256518_100000701727 [0,0,1,0,0,0|2,0,1]=4 225 B19R2.356 COCC=Cc1cccc(c1)OC2CCNCC2 271570a_100016286323_100000701727 [0,0,1,0,0,0|3,0,0]=4 226 B19R2.1369546 C#CCCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100010269958 [0,0,1,0,0,0|1,0,2]=4 227 B19R2.1369546 C#CCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100010269958 [0,0,1,0,0,0|1,0,2]=4 228 B19R2.1369546 C=CCCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100011215482 [0,0,1,0,0,0|1,0,2]=4 229 B19R2.1369546 C=CCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100011215482 [0,0,1,0,0,0|1,0,2]=4 230 B19R2.1369546 CC/C=C\CCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100015370543 [0,0,1,0,0,0|1,0,1]=3 231 B19R2.1369546 CC/C=C\CCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100015370543 [0,0,1,0,0,0|1,0,1]=3 232 B19R2.1369546 CCCCCCNc1ccc2c(=O)[nH]cnc2c1 27a_100000210581_100000230960 [0,0,1,0,0,0|3,0,0]=4 233 B19R2.1369546 CCCCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000210314 [0,0,1,0,0,0|1,0,0]=2 234 B19R2.1369546 CCCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000210314 [0,0,1,0,0,0|1,0,0]=2 235 B19R2.1369546 CCCCCCOc1ccc2c(=O)ccoc2c1 34a_200000065989_100000210314 [0,0,1,0,0,0|3,0,0]=4 236 B19R2.1369546 CCCCCCOc1ccc2c(=O)ccoc2c1 7a_200000065989_100000210314 [0,0,1,0,0,0|3,0,0]=4 237 B19R2.1369546 CCCCCCOc1ccc2c(c1)CCNC2=O 34a_100000087030_100000210314 [0,0,1,0,0,0|1,0,2]=4 238 B19R2.1369546 CCCCCCOc1ccc2c(c1)CCNC2=O 7a_100000087030_100000210314 [0,0,1,0,0,0|1,0,2]=4 239 B19R2.1369546 CCCCCCOc1ccc2c(cccc2c1)N 34a_100000034668_100000210314 [0,0,1,0,0,0|3,0,0]=4 240 B19R2.1369546 CCCCCCOc1ccc2c(cccc2c1)N 7a_100000034668_100000210314 [0,0,1,0,0,0|3,0,0]=4 241 B19R2.1369546 CCCCCCOc1ccc2c(nccc2c1)Cl 34a_100009867704_100000210314 [0,0,1,0,0,0|2,0,1]=4 242 B19R2.1369546 CCCCCCOc1ccc2c(nccc2c1)Cl 7a_100009867704_100000210314 [0,0,1,0,0,0|2,0,1]=4 243 B19R2.1369546 CCCCCCSc1cc2cc[nH]c(=O)c2cn1 62a_100010134373_100000210757 [0,0,1,0,0,0|2,1,0]=4 244 B19R2.1369546 CCCCCCSc1ccc2c(=O)[nH]cnc2c1 62a_100000210314_100000230960 [0,0,1,0,0,0|2,1,0]=4 245 B19R2.1369546 CCCCOCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100011995733 [0,0,1,0,0,0|2,0,0]=3 246 B19R2.1369546 CCCOCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100011215938 [0,0,1,0,0,0|2,0,0]=3 247 B19R2.1369546 CCCOCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100011215938 [0,0,1,0,0,0|2,0,0]=3 248 B19R2.1369546 CCOCCCNc1ccc2c(=O)[nH]cnc2c1 27a_100000210961_100000230960 [0,0,1,0,0,0|3,0,0]=4 249 B19R2.1369546 CCOCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100012232248 [0,0,1,0,0,0|1,0,0]=2 250 B19R2.1369546 CCOCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100012232248 [0,0,1,0,0,0|1,0,0]=2 251 B19R2.1369546 CCOCCCOc1ccc2c(=O)ccoc2c1 34a_200000065989_100012232248 [0,0,1,0,0,0|3,0,0]=4 252 B19R2.1369546 CCOCCCOc1ccc2c(=O)ccoc2c1 7a_200000065989_100012232248 [0,0,1,0,0,0|3,0,0]=4 253 B19R2.1369546 CCOCCCOc1ccc2c(c1)CCNC2=O 34a_100000087030_100012232248 [0,0,1,0,0,0|1,0,2]=4 254 B19R2.1369546 CCOCCCOc1ccc2c(c1)CCNC2=O 7a_100000087030_100012232248 [0,0,1,0,0,0|1,0,2]=4 255 B19R2.1369546 CCOCCCOc1ccc2c(cccc2c1)N 34a_100000034668_100012232248 [0,0,1,0,0,0|3,0,0]=4 256 B19R2.1369546 CCOCCCOc1ccc2c(cccc2c1)N 7a_100000034668_100012232248 [0,0,1,0,0,0|3,0,0]=4 257 B19R2.1369546 CCOCCCOc1ccc2c(nccc2c1)Cl 34a_100009867704_100012232248 [0,0,1,0,0,0|2,0,1]=4 258 B19R2.1369546 CCOCCCOc1ccc2c(nccc2c1)Cl 7a_100009867704_100012232248 [0,0,1,0,0,0|2,0,1]=4 259 B19R2.1369546 CCOCCCSc1cc2cc[nH]c(=O)c2cn1 62a_100010134373_100012232248 [0,0,1,0,0,0|2,1,0]=4 260 B19R2.1369546 CCOCCCSc1ccc2c(=O)[nH]cnc2c1 62a_100012232248_100000230960 [0,0,1,0,0,0|2,1,0]=4 261 B19R2.1369546 COCCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000755781 [0,0,1,0,0,0|2,0,0]=3 262 B19R2.1369546 COCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000730899 [0,0,1,0,0,0|2,0,0]=3 263 B19R2.1369546 N#CCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000211819 [0,0,1,0,0,0|2,0,1]=4 264 B19R2.1369546 O=CCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000139335 [0,0,1,0,0,0|2,0,1]=4 265 B19R2.1369546 O=c1[nH]ccc2c1ccc(c2)OCCCCCF 34a_100009857879_100000729378 [0,0,1,0,0,0|2,0,0]=3 266 B19R2.1369546 O=c1[nH]ccc2c1ccc(c2)OCCCCCF 7a_100009857879_100000729378 [0,0,1,0,0,0|2,0,0]=3 267 B19R2.1369546 O=c1[nH]ccc2c1ccc(c2)OCCCCCO 34a_100009857879_100000746330 [0,0,1,0,0,0|2,0,0]=3 268 B19R2.1369546 O=c1[nH]ccc2c1ccc(c2)OCCCCCO 7a_100009857879_100000746330 [0,0,1,0,0,0|2,0,0]=3 269 B19R2.1369546 O=c1[nH]ccc2c1ccc(c2)OCCOCCO 34a_100009857879_100000692535 [0,0,1,0,0,0|3,0,0]=4 270 B19R2.1369546 O=c1[nH]ccc2c1ccc(c2)OCCOCCO 7a_100009857879_100011215305 [0,0,1,0,0,0|3,0,0]=4 271 B19R2.2870883 CCCCC(C)Nc1ccc2c(=O)[nH]cnc2c1 27a_100000126638_100000230960 [0,0,1,0,0,0|3,0,0]=4 272 B19R2.2870883 CCCCC(C)Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_200011215066 [0,0,1,0,0,0|1,0,0]=2 273 B19R2.2870883 CCCCC(C)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200011215066 [0,0,1,0,0,0|1,0,0]=2 274 B19R2.2870883 CCCCC(C)Oc1ccc2c(=O)ccoc2c1 34a_200000065989_200011215066 [0,0,1,0,0,0|3,0,0]=4 275 B19R2.2870883 CCCCC(C)Oc1ccc2c(=O)ccoc2c1 7a_200000065989_200011215066 [0,0,1,0,0,0|3,0,0]=4 276 B19R2.2870883 CCCCC(C)Oc1ccc2c(c1)CCNC2=O 34a_100000087030_200011215066 [0,0,1,0,0,0|1,0,2]=4 277 B19R2.2870883 CCCCC(C)Oc1ccc2c(c1)CCNC2=O 7a_100000087030_200011215066 [0,0,1,0,0,0|1,0,2]=4 278 B19R2.2870883 CCCCC(C)Oc1ccc2c(cccc2c1)N 34a_100000034668_200011215066 [0,0,1,0,0,0|3,0,0]=4 279 B19R2.2870883 CCCCC(C)Oc1ccc2c(cccc2c1)N 7a_100000034668_200011215066 [0,0,1,0,0,0|3,0,0]=4 280 B19R2.2870883 CCCCC(C)Oc1ccc2c(nccc2c1)Cl 34a_100009867704_200011215066 [0,0,1,0,0,0|2,0,1]=4 281 B19R2.2870883 CCCCC(C)Oc1ccc2c(nccc2c1)Cl 7a_100009867704_200011215066 [0,0,1,0,0,0|2,0,1]=4 282 B19R2.2870883 CCCCC(C)Sc1cc2cc[nH]c(=O)c2cn1 62a_100010134373_200011215066 [0,0,1,0,0,0|2,1,0]=4 283 B19R2.2870883 CCCCC(C)Sc1ccc2c(=O)[nH]cnc2c1 62a_200011215066_100000230960 [0,0,1,0,0,0|2,1,0]=4 284 B19R2.4681212 CCCC(CC)Nc1ccc2c(=O)[nH]cnc2c1 27a_100000747048_100000230960 [0,0,1,0,0,0|3,0,0]=4 285 B19R2.4681212 CCCC(CC)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100011219200 [0,0,1,0,0,0|1,0,0]=2 286 B19R2.4681212 CCCC(CC)Oc1ccc2c(=O)ccoc2c1 7a_200000065989_100011219200 [0,0,1,0,0,0|3,0,0]=4 287 B19R2.4681212 CCCC(CC)Oc1ccc2c(c1)CCNC2=O 7a_100000087030_100011219200 [0,0,1,0,0,0|1,0,2]=4 288 B19R2.4681212 CCCC(CC)Oc1ccc2c(cccc2c1)N 7a_100000034668_100011219200 [0,0,1,0,0,0|3,0,0]=4 289 B19R2.4681212 CCCC(CC)Oc1ccc2c(nccc2c1)Cl 7a_100009867704_100011219200 [0,0,1,0,0,0|2,0,1]=4 290 B19R2.4681212 CCCC(CC)Sc1cc2cc[nH]c(=O)c2cn1 62a_100010134373_100011219200 [0,0,1,0,0,0|2,1,0]=4 291 B19R2.4681212 CCCC(CC)Sc1ccc2c(=O)[nH]cnc2c1 62a_100011219200_100000230960 [0,0,1,0,0,0|2,1,0]=4 292 B21R4.6859064 O=c1[nH]cnc2c1ccc(c2)N3C4CCC3CC4 27a_100000735658_100000230960 [0,0,0,1,0,0|3,0,0]=4 293 B21R4.6859097 O=c1[nH]cnc2c1ccc(c2)NC3C4C3COC4 27a_100000702821_100000230960 [0,0,0,1,0,0|3,0,0]=4 294 B19R3.5798 O=C1C=Cc2c1ccc(c2)SC3CCCCC3 62a_100000210327_100010210589 [0,0,0,0,1,0|1,1,0]=3 295 B19R3.5798 O=C1C=Cc2c1ccc(c2)SC3CCCCC3 62a_100010210589_100000210327 [0,0,0,0,1,0|1,1,0]=3 296 B19R3.5798 O=C1C=Cc2c1ccc(c2)SC3CCCOC3 62a_100010210589_100000693364 [0,0,0,0,1,0|2,1,0]=4 297 B19R3.5798 O=C1C=Cc2c1ccc(c2)SC3CCOCC3 62a_100010210589_100011324220 [0,0,0,0,1,0|1,1,0]=3 298 B19R3.5798 O=C1C=Cc2c1ccc(c2)SC3CCSCC3 62a_100010210589_100000069128 [0,0,0,0,1,0|1,1,0]=3 299 B19R3.5798 O=C1CCc2c1ccc(c2)OC3CCCCC3 34a_100000708912_100000210327 [0,0,0,0,1,0|1,0,2]=4 300 B19R3.5798 O=C1CCc2c1ccc(c2)OC3CCCCC3 7a_100000708912_100000210327 [0,0,0,0,1,0|1,0,2]=4 301 B19R3.5798 O=C1CCc2c1ccc(c2)OC3CCOCC3 7a_100000708912_100000686592 [0,0,0,0,1,0|1,0,2]=4 302 B19R3.5798 O=C1CCc2c1ccc(c2)OC3CCSCC3 34a_100000708912_100000069128 [0,0,0,0,1,0|1,0,2]=4 303 B19R3.5798 O=C1CCc2c1ccc(c2)OC3CCSCC3 7a_100000708912_100011500858 [0,0,0,0,1,0|1,0,2]=4 304 B19R3.5798 O=C1NCc2c1ccc(c2)OC3CCCCC3 34a_100000098542_100000210327 [0,0,0,0,1,0|1,0,1]=3 305 B19R3.5798 O=C1NCc2c1ccc(c2)OC3CCCOC3 34a_100000098542_100000693364 [0,0,0,0,1,0|2,0,1]=4 306 B19R3.5798 O=C1NCc2c1ccc(c2)OC3CCSCC3 34a_100000098542_100000069128 [0,0,0,0,1,0|1,0,1]=3 307 B19R3.5798 O=C1NCc2c1ccc(c2)SC3CCCCC3 62a_100000210327_100000692135 [0,0,0,0,1,0|1,1,1]=4 308 B19R3.5798 O=C1NCc2c1ccc(c2)SC3CCCCC3 62a_100000692135_100000210327 [0,0,0,0,1,0|1,1,1]=4 309 B19R3.5798 O=C1NCc2c1ccc(c2)SC3CCOCC3 62a_100000692135_100011324220 [0,0,0,0,1,0|1,1,1]=4 310 B19R3.5798 O=C1NCc2c1ccc(c2)SC3CCSCC3 62a_100000692135_100000069128 [0,0,0,0,1,0|1,1,1]=4 311 B19R3.5798 O=C1OCc2c1ccc(c2)OC3CCCCC3 7a_100000044543_100000210327 [0,0,0,0,1,0|2,0,1]=4 312 B19R3.5798 O=C1OCc2c1ccc(c2)OC3CCOCC3 7a_100000044543_100000686592 [0,0,0,0,1,0|2,0,1]=4 313 B19R3.5798 O=C1OCc2c1ccc(c2)OC3CCSCC3 7a_100000044543_100011500858 [0,0,0,0,1,0|2,0,1]=4 314 B19R3.5798 O=c1[nH][nH]c2c1ccc(c2)SC3CCCCC3 62a_100000210327_100012353722 [0,0,0,0,1,0|2,1,0]=4 315 B19R3.8275 O=c1[nH]cnc2c1ccc(c2)C3=CCNCC3 271570a_100000731432_100000230960 [0,0,0,0,1,0|1,0,2]=4 316 B19R3.8275 O=c1[nH]cnc2c1ccc(c2)N3CCOCC3 27a_100015191051_100000230960 [0,0,0,0,1,0|3,0,0]=4 317 B19R3.8275 O=c1[nH]cnc2c1ccc(c2)N3CCSCC3 27a_100000737611_100000230960 [0,0,0,0,1,0|3,0,0]=4 318 B19R3.152263 Brc1ccnc2c1ccc(c2)OC3CCCC3 34a_100010204257_100000179811 [0,0,0,0,1,0|3,0,0]=4 319 B19R3.152263 Brc1ccnc2c1ccc(c2)OC3CCCC3 7a_100010204257_100000179811 [0,0,0,0,1,0|3,0,0]=4 320 B19R3.152263 Cc1ccnc2c1ccc(c2)OC3CCCC3 34a_200009854145_100000179811 [0,0,0,0,1,0|3,0,0]=4 321 B19R3.152263 Cc1ccnc2c1ccc(c2)OC3CCCC3 7a_200009854145_100000179811 [0,0,0,0,1,0|3,0,0]=4 322 B19R3.152263 Clc1ccnc2c1ccc(c2)OC3CCCC3 34a_100000045489_100000179811 [0,0,0,0,1,0|3,0,0]=4 323 B19R3.152263 Clc1ccnc2c1ccc(c2)OC3CCCC3 7a_100000045489_100000179811 [0,0,0,0,1,0|3,0,0]=4 324 B19R3.152263 Clc1nccc2c1ccc(c2)OC3CCCC3 34a_100009867704_100000179811 [0,0,0,0,1,0|1,0,1]=3 325 B19R3.152263 Clc1nccc2c1ccc(c2)OC3CCCC3 7a_100009867704_100000179811 [0,0,0,0,1,0|1,0,1]=3 326 B19R3.152263 Clc1nccc2c1ccc(c2)OC3CCOC3 34a_100009867704_100000690089 [0,0,0,0,1,0|2,0,1]=4 327 B19R3.152263 Clc1nccc2c1ccc(c2)OC3CCOC3 7a_100009867704_100000731011 [0,0,0,0,1,0|2,0,1]=4 328 B19R3.152263 Fc1cccc2c1ncc(c2)OC3CCCC3 34a_100012184956_100000179811 [0,0,0,0,1,0|3,0,0]=4 329 B19R3.152263 Fc1cccc2c1ncc(c2)OC3CCCC3 7a_100012184956_100000179811 [0,0,0,0,1,0|3,0,0]=4 330 B19R3.152263 Nc1cccc2c1ccc(c2)OC3CCCC3 34a_100000034668_100000179811 [0,0,0,0,1,0|2,0,0]=3 331 B19R3.152263 Nc1cccc2c1ccc(c2)OC3CCCC3 7a_100000034668_100000179811 [0,0,0,0,1,0|2,0,0]=3 332 B19R3.152263 Nc1cccc2c1ccc(c2)OC3CCOC3 34a_100000034668_100000690089 [0,0,0,0,1,0|3,0,0]=4 333 B19R3.152263 Nc1cccc2c1ccc(c2)OC3CCOC3 7a_100000034668_100000731011 [0,0,0,0,1,0|3,0,0]=4 334 B19R3.152263 Nc1cccc2c1ccc(c2)SC3CCCC3 62a_100010090037_100000179811 [0,0,0,0,1,0|2,1,0]=4 335 B19R3.152263 Nc1cccc2c1ccc(c2)SC3CCCC3 62a_100011217020_100010090037 [0,0,0,0,1,0|2,1,0]=4 336 B19R3.152263 Nc1nccc2c1ccc(c2)SC3CCCC3 62a_100000732483_100000179811 [0,0,0,0,1,0|1,1,1]=4 337 B19R3.152263 Nc1nccc2c1ccc(c2)SC3CCCC3 62a_100011217020_100000732483 [0,0,0,0,1,0|1,1,1]=4 338 B19R3.152263 O=C1CCCc2c1ccc(c2)OC3CCCC3 7a_100000746981_100000179811 [0,0,0,0,1,0|1,0,2]=4 339 B19R3.152263 O=C1CCOc2c1ccc(c2)OC3CCCC3 34a_100000089553_100000179811 [0,0,0,0,1,0|2,0,1]=4 340 B19R3.152263 O=C1CCOc2c1ccc(c2)OC3CCCC3 7a_100000089553_100000179811 [0,0,0,0,1,0|2,0,1]=4 341 B19R3.152263 O=C1NCCc2c1ccc(c2)OC3CCCC3 34a_100000087030_100000179811 [0,0,0,0,1,0|0,0,2]=3 342 B19R3.152263 O=C1NCCc2c1ccc(c2)OC3CCCC3 7a_100000087030_100000179811 [0,0,0,0,1,0|0,0,2]=3 343 B19R3.152263 O=C1NCCc2c1ccc(c2)OC3CCOC3 34a_100000087030_100000690089 [0,0,0,0,1,0|1,0,2]=4 344 B19R3.152263 O=C1NCCc2c1ccc(c2)OC3CCOC3 7a_100000087030_100000731011 [0,0,0,0,1,0|1,0,2]=4 345 B19R3.152263 O=C1NCCc2c1ccc(c2)SC3CCCC3 62a_100009817313_100000179811 [0,0,0,0,1,0|0,1,2]=4 346 B19R3.152263 O=C1NCCc2c1ccc(c2)SC3CCCC3 62a_100011217020_100009817313 [0,0,0,0,1,0|0,1,2]=4 347 B19R3.152263 O=c1[nH]ccc2c1ccc(c2)OC3CCCC3 34a_100009857879_100000179811 [0,0,0,0,1,0|0,0,0]=1 348 B19R3.152263 O=c1[nH]ccc2c1ccc(c2)OC3CCCC3 7a_100009857879_100000179811 [0,0,0,0,1,0|0,0,0]=1 349 B19R3.152263 O=c1[nH]ccc2c1ccc(c2)OC3CCOC3 34a_100009857879_100000690089 [0,0,0,0,1,0|1,0,0]=2 350 B19R3.152263 O=c1[nH]ccc2c1ccc(c2)OC3CCOC3 7a_100009857879_100000731011 [0,0,0,0,1,0|1,0,0]=2 351 B19R3.152263 O=c1[nH]ccc2c1cnc(c2)SC3CCCC3 62a_100010134373_100000179811 [0,0,0,0,1,0|1,1,0]=3 352 B19R3.152263 O=c1[nH]ccc2c1cnc(c2)SC3CCOC3 62a_100010134373_100000690089 [0,0,0,0,1,0|2,1,0]=4 353 B19R3.152263 O=c1[nH]cnc2c1ccc(c2)C=C3CCCC3 271570a_100010378317_100000230960 [0,0,0,0,1,0|2,0,1]=4 354 B19R3.152263 O=c1[nH]cnc2c1ccc(c2)NC3CCCC3 27a_100000211070_100000230960 [0,0,0,0,1,0|2,0,0]=3 355 B19R3.152263 O=c1[nH]cnc2c1ccc(c2)N[C@@H]3CCOC3 27a_200015188469_100000230960 [0,0,0,0,1,0|3,0,0]=4 356 B19R3.152263 O=c1[nH]cnc2c1ccc(c2)N[C@H]3CCOC3 27a_100015188467_100000230960 [0,0,0,0,1,0|3,0,0]=4 357 B19R3.152263 O=c1[nH]cnc2c1ccc(c2)SC3CCCC3 62a_100011217020_100000230960 [0,0,0,0,1,0|1,1,0]=3 358 B19R3.152263 O=c1[nH]cnc2c1ncc(c2)NC3CCCC3 27a_100000211070_100000709876 [0,0,0,0,1,0|3,0,0]=4 359 B19R3.152263 O=c1[nH]cnc2c1ncc(c2)SC3CCCC3 62a_100011217020_100000709876 [0,0,0,0,1,0|2,1,0]=4 360 B19R3.152263 O=c1[nH]ncc2c1ncc(c2)SC3CCCC3 62a_100011217020_100010284064 [0,0,0,0,1,0|2,1,0]=4 361 B19R3.152263 O=c1ccoc2c1ccc(c2)OC3CCCC3 34a_200000065989_100000179811 [0,0,0,0,1,0|2,0,0]=3 362 B19R3.152263 O=c1ccoc2c1ccc(c2)OC3CCCC3 7a_200000065989_100000179811 [0,0,0,0,1,0|2,0,0]=3 363 B19R3.152263 O=c1ccoc2c1ccc(c2)OC3CCOC3 34a_200000065989_100000690089 [0,0,0,0,1,0|3,0,0]=4 364 B19R3.152263 O=c1ccoc2c1ccc(c2)OC3CCOC3 7a_200000065989_100000731011 [0,0,0,0,1,0|3,0,0]=4 365 B19R3.152263 O=c1ccoc2c1ccc(c2)SC3CCCC3 62a_100011217020_100010062221 [0,0,0,0,1,0|2,1,0]=4 366 B19R3.152263 Oc1cccc2c1ccc(c2)NC3CCCC3 34a_100000035793_100000179811 [0,0,0,0,1,0|2,0,1]=4 367 B19R3.152263 Oc1cccc2c1ccc(c2)NC3CCCC3 7a_100000035793_100000179811 [0,0,0,0,1,0|2,0,1]=4 368 B19R3.152263 Oc1cccc2c1ccc(c2)SC3CCCC3 62a_100011217020_100010202202 [0,0,0,0,1,0|1,1,1]=4 369 B19R3.152263 Oc1nccc2c1ccc(c2)SC3CCCC3 62a_100011217020_100000760485 [0,0,0,0,1,0|0,1,2]=4 370 B21R3.397713 Clc1nccc2c1ccc(c2)OCC3CCCCC3 34a_100009867704_100000211423 [0,0,0,0,0,1|2,0,1]=4 371 B21R3.397713 Clc1nccc2c1ccc(c2)OCC3CCCCC3 7a_100009867704_100000211423 [0,0,0,0,0,1|2,0,1]=4 372 B21R3.397713 Clc1nccc2c1ccc(c2)OCC3CCOCC3 34a_100009867704_100000754603 [0,0,0,0,0,1|2,0,1]=4 373 B21R3.397713 Clc1nccc2c1ccc(c2)OCC3CCOCC3 7a_100009867704_100000754603 [0,0,0,0,0,1|2,0,1]=4 374 B21R3.397713 Nc1cccc2c1ccc(c2)OCC3CCCCC3 34a_100000034668_100000211423 [0,0,0,0,0,1|3,0,0]=4 375 B21R3.397713 Nc1cccc2c1ccc(c2)OCC3CCCCC3 7a_100000034668_100000211423 [0,0,0,0,0,1|3,0,0]=4 376 B21R3.397713 Nc1cccc2c1ccc(c2)OCC3CCOCC3 34a_100000034668_100000754603 [0,0,0,0,0,1|3,0,0]=4 377 B21R3.397713 Nc1cccc2c1ccc(c2)OCC3CCOCC3 7a_100000034668_100000754603 [0,0,0,0,0,1|3,0,0]=4 378 B21R3.397713 O=C1NCCc2c1ccc(c2)OCC3CCCCC3 34a_100000087030_100000211423 [0,0,0,0,0,1|1,0,2]=4 379 B21R3.397713 O=C1NCCc2c1ccc(c2)OCC3CCCCC3 7a_100000087030_100000211423 [0,0,0,0,0,1|1,0,2]=4 380 B21R3.397713 O=C1NCCc2c1ccc(c2)OCC3CCOCC3 34a_100000087030_100000754603 [0,0,0,0,0,1|1,0,2]=4 381 B21R3.397713 O=C1NCCc2c1ccc(c2)OCC3CCOCC3 7a_100000087030_100000754603 [0,0,0,0,0,1|1,0,2]=4 382 B21R3.397713 O=c1[nH]ccc2c1ccc(c2)OCC3CCCCC3 34a_100009857879_100000211423 [0,0,0,0,0,1|1,0,0]=2 383 B21R3.397713 O=c1[nH]ccc2c1ccc(c2)OCC3CCCCC3 7a_100009857879_100000211423 [0,0,0,0,0,1|1,0,0]=2 384 B21R3.397713 O=c1[nH]ccc2c1ccc(c2)OCC3CCCCO3 34a_100009857879_100000211543 [0,0,0,0,0,1|2,0,0]=3 385 B21R3.397713 O=c1[nH]ccc2c1ccc(c2)OCC3CCCCO3 7a_100009857879_100000211543 [0,0,0,0,0,1|2,0,0]=3 386 B21R3.397713 O=c1[nH]ccc2c1ccc(c2)OCC3CCCOC3 34a_100009857879_100000741521 [0,0,0,0,0,1|2,0,0]=3 387 B21R3.397713 O=c1[nH]ccc2c1ccc(c2)OCC3CCCOC3 7a_100009857879_100000741521 [0,0,0,0,0,1|2,0,0]=3 388 B21R3.397713 O=c1[nH]ccc2c1ccc(c2)OCC3CCOCC3 34a_100009857879_100000754603 [0,0,0,0,0,1|1,0,0]=2 389 B21R3.397713 O=c1[nH]ccc2c1ccc(c2)OCC3CCOCC3 7a_100009857879_100000754603 [0,0,0,0,0,1|1,0,0]=2 390 B21R3.397713 O=c1[nH]ccc2c1cnc(c2)SCC3CCCCC3 62a_100010134373_100000211423 [0,0,0,0,0,1|2,1,0]=4 391 B21R3.397713 O=c1[nH]ccc2c1cnc(c2)SCC3CCOCC3 62a_100010134373_100000749018 [0,0,0,0,0,1|2,1,0]=4 392 B21R3.397713 O=c1[nH]cnc2c1ccc(c2)C=CC3CCCCC3 271570a_100016283615_100000230960 [0,0,0,0,0,1|3,0,0]=4 393 B21R3.397713 O=c1[nH]cnc2c1ccc(c2)NCC3CCCCC3 27a_100000210473_100000230960 [0,0,0,0,0,1|3,0,0]=4 394 B21R3.397713 O=c1[nH]cnc2c1ccc(c2)NCC3CCOCC3 27a_100000746373_100000230960 [0,0,0,0,0,1|3,0,0]=4 395 B21R3.397713 O=c1[nH]cnc2c1ccc(c2)NCC3CCSCC3 27a_100015188806_100000230960 [0,0,0,0,0,1|3,0,0]=4 396 B21R3.397713 O=c1[nH]cnc2c1ccc(c2)SCC3CCCCC3 62a_100000211423_100000230960 [0,0,0,0,0,1|2,1,0]=4 397 B21R3.397713 O=c1[nH]cnc2c1ccc(c2)SCC3CCOCC3 62a_100000754603_100000230960 [0,0,0,0,0,1|2,1,0]=4 398 B21R3.397713 O=c1ccoc2c1ccc(c2)OCC3CCCCC3 34a_200000065989_100000211423 [0,0,0,0,0,1|3,0,0]=4 399 B21R3.397713 O=c1ccoc2c1ccc(c2)OCC3CCCCC3 7a_200000065989_100000211423 [0,0,0,0,0,1|3,0,0]=4 400 B21R3.397713 O=c1ccoc2c1ccc(c2)OCC3CCOCC3 34a_200000065989_100000754603 [0,0,0,0,0,1|3,0,0]=4 401 B21R3.397713 O=c1ccoc2c1ccc(c2)OCC3CCOCC3 7a_200000065989_100000754603 [0,0,0,0,0,1|3,0,0]=4 402 B21R3.6732625 Clc1nccc2c1ccc(c2)OC3CCCCCC3 34a_100009867704_100011217769 [0,0,0,0,0,1|2,0,1]=4 403 B21R3.6732625 Nc1cccc2c1ccc(c2)OC3CCCCCC3 34a_100000034668_100011217769 [0,0,0,0,0,1|3,0,0]=4 404 B21R3.6732625 O=C1NCCc2c1ccc(c2)OC3CCCCCC3 34a_100000087030_100011217769 [0,0,0,0,0,1|1,0,2]=4 405 B21R3.6732625 O=c1[nH]ccc2c1ccc(c2)OC3CCCCCC3 34a_100009857879_100011217769 [0,0,0,0,0,1|1,0,0]=2 406 B21R3.6732625 O=c1[nH]ccc2c1cnc(c2)SC3CCCCCC3 62a_100010134373_100011217769 [0,0,0,0,0,1|2,1,0]=4 407 B21R3.6732625 O=c1[nH]cnc2c1ccc(c2)NC3CCCCCC3 27a_100000210984_100000230960 [0,0,0,0,0,1|3,0,0]=4 408 B21R3.6732625 O=c1[nH]cnc2c1ccc(c2)SC3CCCCCC3 62a_100011217769_100000230960 [0,0,0,0,0,1|2,1,0]=4 409 B21R3.6732625 O=c1ccoc2c1ccc(c2)OC3CCCCCC3 34a_200000065989_100011217769 [0,0,0,0,0,1|3,0,0]=4 410 B18R2.28 C=CCSc1ccc(cc1)OC2CCNCC2 62a_100000210623_100011524410 [1,0,1,0,0,0|2,0,0]=4 411 B18R2.28 C=CCSc1ccc(cc1)OC2CCNCC2 62a_100011524410_100000210623 [1,0,1,0,0,0|2,0,0]=4 412 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCCCC2 34a_100000192141_100000210327 [1,0,1,0,0,0|1,0,1]=4 413 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCCCC2 7a_100000192141_100000210327 [1,0,1,0,0,0|1,0,1]=4 414 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCOCC2 11a_106832991635_100000748587 [1,0,1,0,0,0|1,0,1]=4 415 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCOCC2 1626a_100102657272_100000748587 [1,0,1,0,0,0|1,0,1]=4 416 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCOCC2 240690a_100102657272_100000748587 [1,0,1,0,0,0|1,0,1]=4 417 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCOCC2 527a_100102657272_100000748587 [1,0,1,0,0,0|1,0,1]=4 418 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCOCC2 7a_100000192141_100000686592 [1,0,1,0,0,0|1,0,1]=4 419 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCSCC2 34a_100000192141_100000069128 [1,0,1,0,0,0|1,0,1]=4 420 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCSCC2 7a_100000192141_100011500858 [1,0,1,0,0,0|1,0,1]=4 421 B18R2.287 NNC(=O)c1ccc(cc1)OC2CCCCC2 34a_100000185078_100000210327 [1,0,1,0,0,0|2,0,0]=4 422 B18R2.287 NNC(=O)c1ccc(cc1)OC2CCSCC2 34a_100000185078_100000069128 [1,0,1,0,0,0|2,0,0]=4 423 B18R2.304 O=CCSc1cccc(c1)OC2CCNCC2 62a_100000701727_200015260668 [1,0,1,0,0,0|1,0,1]=4 424 B18R2.304 O=CCSc1cccc(c1)OC2CCNCC2 62a_200015260668_100000701727 [1,0,1,0,0,0|1,0,1]=4 425 B18R2.3631 NC(=O)c1ccc(cc1Cl)OC2CCCCC2 34a_100011997949_100000210327 [1,0,1,0,0,0|2,0,0]=4 426 B18R2.3631 NC(=O)c1ccc(cc1Cl)OC2CCCCC2 7a_100011997949_100000210327 [1,0,1,0,0,0|2,0,0]=4 427 B18R2.3631 NC(=O)c1ccc(cc1Cl)OC2CCOCC2 7a_100011997949_100000686592 [1,0,1,0,0,0|2,0,0]=4 428 B18R2.3631 NC(=O)c1ccc(cc1Cl)OC2CCSCC2 34a_100011997949_100000069128 [1,0,1,0,0,0|2,0,0]=4 429 B18R2.3631 NC(=O)c1ccc(cc1Cl)OC2CCSCC2 7a_100011997949_100011500858 [1,0,1,0,0,0|2,0,0]=4 430 B18R2.3631 NC(=O)c1ccc(cc1F)OC2CCCCC2 34a_200012186767_100000210327 [1,0,1,0,0,0|2,0,0]=4 431 B18R2.3631 NC(=O)c1ccc(cc1F)OC2CCCCC2 7a_200012186767_100000210327 [1,0,1,0,0,0|2,0,0]=4 432 B18R2.3631 NC(=O)c1ccc(cc1F)OC2CCOCC2 7a_200012186767_100000686592 [1,0,1,0,0,0|2,0,0]=4 433 B18R2.3631 NC(=O)c1ccc(cc1F)OC2CCSCC2 34a_200012186767_100000069128 [1,0,1,0,0,0|2,0,0]=4 434 B18R2.3631 NC(=O)c1ccc(cc1F)OC2CCSCC2 7a_200012186767_100011500858 [1,0,1,0,0,0|2,0,0]=4 435 B18R2.3631 NC(=O)c1ccc(cc1N)OC2CCCCC2 34a_100012186684_100000210327 [1,0,1,0,0,0|2,0,0]=4 436 B18R2.3631 NC(=O)c1ccc(cc1N)OC2CCCCC2 7a_100012186684_100000210327 [1,0,1,0,0,0|2,0,0]=4 437 B18R2.3631 NC(=O)c1ccc(cc1N)OC2CCOCC2 7a_100012186684_100000686592 [1,0,1,0,0,0|2,0,0]=4 438 B18R2.3631 NC(=O)c1ccc(cc1N)OC2CCSCC2 34a_100012186684_100000069128 [1,0,1,0,0,0|2,0,0]=4 439 B18R2.3631 NC(=O)c1ccc(cc1N)OC2CCSCC2 7a_100012186684_100011500858 [1,0,1,0,0,0|2,0,0]=4 440 B18R2.9737 CCCCCCOc1ccc2ccccc2c1 34a_100000185828_100000210314 [1,0,1,0,0,0|2,0,0]=4 441 B18R2.9737 CCCCCCOc1ccc2ccccc2c1 7a_100000185828_100000210314 [1,0,1,0,0,0|2,0,0]=4 442 B18R2.9737 CCCCCCOc1ccc2cnccc2c1 34a_100000046372_100000210314 [1,0,1,0,0,0|1,0,1]=4 443 B18R2.9737 CCCCCCOc1ccc2cnccc2c1 7a_100000046372_100000210314 [1,0,1,0,0,0|1,0,1]=4 444 B18R2.9737 CCNCCCOc1ccc2ccccc2c1 2230a_100015525214_100000750887 [1,0,1,0,0,0|1,0,0]=3 445 B18R2.9737 CCOCCCOc1ccc2ccccc2c1 34a_100000185828_100012232248 [1,0,1,0,0,0|2,0,0]=4 446 B18R2.9737 CCOCCCOc1ccc2ccccc2c1 34a_100121572206_100000750887 [1,0,1,0,0,0|2,0,0]=4 447 B18R2.9737 CCOCCCOc1ccc2ccccc2c1 7a_100000185828_100012232248 [1,0,1,0,0,0|2,0,0]=4 448 B18R2.9737 CCOCCCOc1ccc2cnccc2c1 34a_100000046372_100012232248 [1,0,1,0,0,0|1,0,1]=4 449 B18R2.9737 CCOCCCOc1ccc2cnccc2c1 7a_100000046372_100012232248 [1,0,1,0,0,0|1,0,1]=4 450 B18R2.9737 CCSCCCOc1ccc2ccccc2c1 62a_100000210202_100000750887 [1,0,1,0,0,0|2,0,0]=4 451 B18R2.9737 CCSCCCOc1ccc2ccccc2c1 62a_100000750887_100000210202 [1,0,1,0,0,0|2,0,0]=4 452 B18R2.583487 C#CCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000695029 [1,0,1,0,0,0|0,0,2]=4 453 B18R2.583487 C#CCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100011215417 [1,0,1,0,0,0|0,0,2]=4 454 B18R2.583487 C=CCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000757094 [1,0,1,0,0,0|0,0,2]=4 455 B18R2.583487 C=CCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000757094 [1,0,1,0,0,0|0,0,2]=4 456 B18R2.583487 CC/C=C\COc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100103147603 [1,0,1,0,0,0|0,0,2]=4 457 B18R2.583487 CC/C=C\COc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100103147603 [1,0,1,0,0,0|0,0,2]=4 458 B18R2.583487 CCC#CCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100009813939 [1,0,1,0,0,0|0,0,2]=4 459 B18R2.583487 CCC#CCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100009813939 [1,0,1,0,0,0|0,0,2]=4 460 B18R2.583487 CCCCCNc1ccc2c(=O)[nH]cnc2c1 27a_100000209983_100000230960 [1,0,1,0,0,0|2,0,0]=4 461 B18R2.583487 CCCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000718602 [1,0,1,0,0,0|0,0,0]=2 462 B18R2.583487 CCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000210326 [1,0,1,0,0,0|0,0,0]=2 463 B18R2.583487 CCCCCOc1ccc2c(=O)ccoc2c1 34a_200000065989_100000718602 [1,0,1,0,0,0|2,0,0]=4 464 B18R2.583487 CCCCCOc1ccc2c(=O)ccoc2c1 7a_200000065989_100000210326 [1,0,1,0,0,0|2,0,0]=4 465 B18R2.583487 CCCCCOc1ccc2c(c1)CCNC2=O 34a_100000087030_100000718602 [1,0,1,0,0,0|0,0,2]=4 466 B18R2.583487 CCCCCOc1ccc2c(c1)CCNC2=O 7a_100000087030_100000210326 [1,0,1,0,0,0|0,0,2]=4 467 B18R2.583487 CCCCCOc1ccc2c(cccc2c1)N 34a_100000034668_100000718602 [1,0,1,0,0,0|2,0,0]=4 468 B18R2.583487 CCCCCOc1ccc2c(cccc2c1)N 7a_100000034668_100000210326 [1,0,1,0,0,0|2,0,0]=4 469 B18R2.583487 CCCCCOc1ccc2c(nccc2c1)Cl 34a_100009867704_100000718602 [1,0,1,0,0,0|1,0,1]=4 470 B18R2.583487 CCCCCOc1ccc2c(nccc2c1)Cl 7a_100009867704_100000210326 [1,0,1,0,0,0|1,0,1]=4 471 B18R2.583487 CCCCCSc1cc2cc[nH]c(=O)c2cn1 62a_100010134373_100000210326 [1,0,1,0,0,0|1,1,0]=4 472 B18R2.583487 CCCCCSc1ccc2c(=O)[nH]cnc2c1 62a_100000210326_100000230960 [1,0,1,0,0,0|1,1,0]=4 473 B18R2.583487 CCOCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000210147 [1,0,1,0,0,0|1,0,0]=3 474 B18R2.583487 CCOCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100011215890 [1,0,1,0,0,0|1,0,0]=3 475 B18R2.583487 CCSCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000757381 [1,0,1,0,0,0|1,0,0]=3 476 B18R2.583487 CCSCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000757381 [1,0,1,0,0,0|1,0,0]=3 477 B18R2.583487 COCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000740836 [1,0,1,0,0,0|1,0,0]=3 478 B18R2.583487 COCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000740836 [1,0,1,0,0,0|1,0,0]=3 479 B18R2.583487 N#CCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000687738 [1,0,1,0,0,0|1,0,1]=4 480 B18R2.583487 O=CCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200011292268 [1,0,1,0,0,0|1,0,1]=4 481 B18R2.583487 O=c1[nH]ccc2c1ccc(c2)OCCCCF 34a_100009857879_100000729493 [1,0,1,0,0,0|1,0,0]=3 482 B18R2.583487 O=c1[nH]ccc2c1ccc(c2)OCCCCF 7a_100009857879_100000729493 [1,0,1,0,0,0|1,0,0]=3 483 B18R2.583487 O=c1[nH]ccc2c1ccc(c2)OCCCCO 34a_100009857879_100011216708 [1,0,1,0,0,0|1,0,0]=3 484 B18R2.583487 O=c1[nH]ccc2c1ccc(c2)OCCCCO 7a_100009857879_100000210776 [1,0,1,0,0,0|1,0,0]=3 485 B18R2.33945 CCCCC(C)Oc1ccc2ccccc2c1 34a_100000185828_200011215066 [1,0,1,0,0,0|2,0,0]=4 486 B18R2.33945 CCCCC(C)Oc1ccc2ccccc2c1 7a_100000185828_200011215066 [1,0,1,0,0,0|2,0,0]=4 487 B18R2.33945 CCCCC(C)Oc1ccc2cnccc2c1 34a_100000046372_200011215066 [1,0,1,0,0,0|1,0,1]=4 488 B18R2.33945 CCCCC(C)Oc1ccc2cnccc2c1 7a_100000046372_200011215066 [1,0,1,0,0,0|1,0,1]=4 489 B18R2.895465 CC(CC#N)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100009813641 [1,0,1,0,0,0|0,0,2]=4 490 B18R2.895465 CC(CCO)Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100009893172 [1,0,1,0,0,0|1,0,0]=3 491 B18R2.895465 CC(CCO)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100009893172 [1,0,1,0,0,0|1,0,0]=3 492 B18R2.895465 CCCC(C)Nc1ccc2c(=O)[nH]cnc2c1 27a_100000741246_100000230960 [1,0,1,0,0,0|2,0,0]=4 493 B18R2.895465 CCCC(C)Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000766640 [1,0,1,0,0,0|0,0,0]=2 494 B18R2.895465 CCCC(C)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000766640 [1,0,1,0,0,0|0,0,0]=2 495 B18R2.895465 CCCC(C)Oc1ccc2c(=O)ccoc2c1 34a_200000065989_100000766640 [1,0,1,0,0,0|2,0,0]=4 496 B18R2.895465 CCCC(C)Oc1ccc2c(=O)ccoc2c1 7a_200000065989_100000766640 [1,0,1,0,0,0|2,0,0]=4 497 B18R2.895465 CCCC(C)Oc1ccc2c(c1)CCNC2=O 34a_100000087030_100000766640 [1,0,1,0,0,0|0,0,2]=4 498 B18R2.895465 CCCC(C)Oc1ccc2c(c1)CCNC2=O 7a_100000087030_100000766640 [1,0,1,0,0,0|0,0,2]=4 499 B18R2.895465 CCCC(C)Oc1ccc2c(cccc2c1)N 34a_100000034668_100000766640 [1,0,1,0,0,0|2,0,0]=4 500 B18R2.895465 CCCC(C)Oc1ccc2c(cccc2c1)N 7a_100000034668_100000766640 [1,0,1,0,0,0|2,0,0]=4 501 B18R2.895465 CCCC(C)Oc1ccc2c(nccc2c1)Cl 34a_100009867704_100000766640 [1,0,1,0,0,0|1,0,1]=4 502 B18R2.895465 CCCC(C)Oc1ccc2c(nccc2c1)Cl 7a_100009867704_100000766640 [1,0,1,0,0,0|1,0,1]=4 503 B18R2.895465 CCCC(C)Sc1cc2cc[nH]c(=O)c2cn1 62a_100010134373_100000766640 [1,0,1,0,0,0|1,1,0]=4 504 B18R2.895465 CCCC(C)Sc1ccc2c(=O)[nH]cnc2c1 62a_100000766640_100000230960 [1,0,1,0,0,0|1,1,0]=4 505 B18R2.895465 COCC(C)Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000765312 [1,0,1,0,0,0|1,0,0]=3 506 B18R2.895465 COCC(C)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000765312 [1,0,1,0,0,0|1,0,0]=3 507 B18R2.125209 CCCC(CC)Oc1ccc2ccccc2c1 7a_100000185828_100011219200 [1,0,1,0,0,0|2,0,0]=4 508 B18R2.125209 CCCC(CC)Oc1ccc2cnccc2c1 7a_100000046372_100011219200 [1,0,1,0,0,0|1,0,1]=4 509 B18R2.1355618 CCC(CC)Nc1ccc2c(=O)[nH]cnc2c1 27a_100000199018_100000230960 [1,0,1,0,0,0|2,0,0]=4 510 B18R2.1355618 CCC(CC)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000210505 [1,0,1,0,0,0|0,0,0]=2 511 B18R2.1355618 CCC(CC)Oc1ccc2c(=O)ccoc2c1 7a_200000065989_100000210505 [1,0,1,0,0,0|2,0,0]=4 512 B18R2.1355618 CCC(CC)Oc1ccc2c(c1)CCNC2=O 7a_100000087030_100000210505 [1,0,1,0,0,0|0,0,2]=4 513 B18R2.1355618 CCC(CC)Oc1ccc2c(cccc2c1)N 7a_100000034668_100000210505 [1,0,1,0,0,0|2,0,0]=4 514 B18R2.1355618 CCC(CC)Oc1ccc2c(nccc2c1)Cl 7a_100009867704_100000210505 [1,0,1,0,0,0|1,0,1]=4 515 B18R2.1355618 CCC(CC)Sc1cc2cc[nH]c(=O)c2cn1 62a_100010134373_100000210505 [1,0,1,0,0,0|1,1,0]=4 516 B18R2.1355618 CCC(CC)Sc1ccc2c(=O)[nH]cnc2c1 62a_100000210505_100000230960 [1,0,1,0,0,0|1,1,0]=4 517 B20R2.376 C/C=C/CC(=O)c1ccc(cc1)OC2CCOCC2 1458a_100000748587_100102629194 [0,1,1,0,0,0|2,0,0]=4 518 B20R2.376 C=CCCC(=O)c1ccc(cc1)OC2CCOCC2 1458a_100000748587_100000754431 [0,1,1,0,0,0|2,0,0]=4 519 B20R2.376 C=CCNC(=O)c1ccc(cc1)NC2CCCCC2 34a_100000742746_100000210327 [0,1,1,0,0,0|2,0,0]=4 520 B20R2.376 C=CCNC(=O)c1ccc(cc1)NC2CCSCC2 34a_100000742746_100000069128 [0,1,1,0,0,0|2,0,0]=4 521 B20R2.376 C=CCNC(=O)c1ccc(cc1)OC2CCOCC2 1626a_100020586998_100000748587 [0,1,1,0,0,0|1,0,0]=3 522 B20R2.376 C=CCNC(=O)c1ccc(cc1)OC2CCOCC2 240690a_100020586998_100000748587 [0,1,1,0,0,0|1,0,0]=3 523 B20R2.376 C=CCNC(=O)c1ccc(cc1)OC2CCOCC2 527a_100020586998_100000748587 [0,1,1,0,0,0|1,0,0]=3 524 B20R2.376 C=CCOC(=O)c1ccc(cc1)OC2CCCCC2 7a_200000006381_100000210327 [0,1,1,0,0,0|2,0,0]=4 525 B20R2.376 C=CCOC(=O)c1ccc(cc1)OC2CCOCC2 7a_200000006381_100000686592 [0,1,1,0,0,0|2,0,0]=4 526 B20R2.376 C=CCOC(=O)c1ccc(cc1)OC2CCSCC2 7a_200000006381_100011500858 [0,1,1,0,0,0|2,0,0]=4 527 B20R2.376 CC=CCC(=O)c1ccc(cc1)OC2CCOCC2 1458a_100000748587_100000070051 [0,1,1,0,0,0|2,0,0]=4 528 B20R2.4471 C=C(C)CC(=O)c1ccc(cc1)OC2CCOCC2 1458a_100000748587_100000748629 [0,1,1,0,0,0|2,0,0]=4 529 B20R2.4471 C=C(F)CC(=O)c1ccc(cc1)OC2CCOCC2 1458a_100000748587_100009893438 [0,1,1,0,0,0|2,0,0]=4 530 B20R2.141289 CC(=O)CCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100009817362 [0,1,1,0,0,0|1,0,1]=4 531 B20R2.141289 CC(=O)CCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000735457 [0,1,1,0,0,0|1,0,1]=4 532 B20R2.141289 CC(=O)OCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000042594 [0,1,1,0,0,0|1,0,1]=4 533 B20R2.141289 CC(=O)OCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000042594 [0,1,1,0,0,0|1,0,1]=4 534 B20R2.141289 CC(=O)SCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000038929 [0,1,1,0,0,0|1,0,1]=4 535 B20R2.141289 CC(=O)SCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000038929 [0,1,1,0,0,0|1,0,1]=4 536 B20R2.141289 CC(=S)OCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_200135323944 [0,1,1,0,0,0|1,0,1]=4 537 B20R2.141289 CC(=S)OCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200135323944 [0,1,1,0,0,0|1,0,1]=4 538 B20R2.141289 CC(C)CCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100011216152 [0,1,1,0,0,0|1,0,0]=3 539 B20R2.141289 CC(C)CCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100011216152 [0,1,1,0,0,0|1,0,0]=3 540 B20R2.1034950 CCNC(=O)CCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000737597 [0,1,1,0,0,0|0,0,1]=3 541 B20R2.1034950 CCOC(=O)CCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000765890 [0,1,1,0,0,0|1,0,1]=4 542 B20R2.1034950 CCOC(=O)CCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100011206558 [0,1,1,0,0,0|1,0,1]=4 543 B20R2.1494354 CCN(C)CCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100015186262 [0,1,1,0,0,0|0,0,0]=2 544 B20R2.1494354 CCN(C)CCCOc1ccc2c(=O)ccoc2c1 7a_200000065989_100015186262 [0,1,1,0,0,0|2,0,0]=4 545 B20R2.1494354 CCN(C)CCCOc1ccc2c(c1)CCNC2=O 7a_100000087030_100015186262 [0,1,1,0,0,0|0,0,2]=4 546 B20R2.1494354 CCN(C)CCCOc1ccc2c(cccc2c1)N 7a_100000034668_100015186262 [0,1,1,0,0,0|2,0,0]=4 547 B20R2.1494354 CCN(C)CCCOc1ccc2c(nccc2c1)Cl 7a_100009867704_100015186262 [0,1,1,0,0,0|1,0,1]=4 548 B20R2.1494354 CCN(C)CCCSc1cc2cc[nH]c(=O)c2cn1 62a_100010134373_100015186262 [0,1,1,0,0,0|1,1,0]=4 549 B20R2.1494354 CNC(=O)CCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000741757 [0,1,1,0,0,0|2,0,0]=4 550 B20R2.1494354 CNC(=O)CCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000741757 [0,1,1,0,0,0|2,0,0]=4 551 B20R2.1494354 COC(=O)CCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000742333 [0,1,1,0,0,0|2,0,0]=4 552 B20R2.1494354 COC(=O)CCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100011218270 [0,1,1,0,0,0|2,0,0]=4 553 B20R2.1981233 C#CCCCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100012094781 [0,1,1,0,0,0|1,0,1]=4 554 B20R2.1981233 C#CCCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100012094781 [0,1,1,0,0,0|1,0,1]=4 555 B20R2.1981233 C=CCCCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000700193 [0,1,1,0,0,0|1,0,1]=4 556 B20R2.1981233 C=CCCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000700193 [0,1,1,0,0,0|1,0,1]=4 557 B20R2.1981233 CCCCCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000210614 [0,1,1,0,0,0|1,0,0]=3 558 B20R2.1981233 CCCCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000210614 [0,1,1,0,0,0|1,0,0]=3 559 B20R2.1981233 CCCCOCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000743108 [0,1,1,0,0,0|1,0,0]=3 560 B20R2.1981233 CCCCOCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000743108 [0,1,1,0,0,0|1,0,0]=3 561 B20R2.1981233 COCCOCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000695917 [0,1,1,0,0,0|2,0,0]=4 562 B20R2.1981233 COCCOCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000695917 [0,1,1,0,0,0|2,0,0]=4 563 B20R2.1981233 N#CCCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100009813376 [0,1,1,0,0,0|1,0,1]=4 564 B20R2.1981233 O=CCCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000139337 [0,1,1,0,0,0|1,0,1]=4 565 B20R2.1981233 O=c1[nH]ccc2c1ccc(c2)OCCCCCCF 34a_100009857879_100015922095 [0,1,1,0,0,0|1,0,0]=3 566 B20R2.1981233 O=c1[nH]ccc2c1ccc(c2)OCCCCCCF 7a_100009857879_100015922095 [0,1,1,0,0,0|1,0,0]=3 567 B20R2.1981233 O=c1[nH]ccc2c1ccc(c2)OCCCCCCO 34a_100009857879_100000766143 [0,1,1,0,0,0|1,0,0]=3 568 B20R2.1981233 O=c1[nH]ccc2c1ccc(c2)OCCCCCCO 7a_100009857879_100000766143 [0,1,1,0,0,0|1,0,0]=3 569 B20R2.4556934 CCCCCC(C)Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_200011218191 [0,1,1,0,0,0|1,0,0]=3 570 B20R2.4556934 CCCCCC(C)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200011218191 [0,1,1,0,0,0|1,0,0]=3 571 B20R2.5248311 CCCCCCC(=O)c1ccc2c(=O)[nH]ccc2c1 1458a_200015497760_100000210757 [0,1,1,0,0,0|2,0,0]=4 572 B20R2.5248311 CCOCCCC(=O)c1ccc2c(=O)[nH]ccc2c1 1458a_200015497760_100012232248 [0,1,1,0,0,0|2,0,0]=4 573 B20R2.13864254 CCCCCCSc1ccc2c(=O)[nH]c(cc2c1)C 62a_100000210314_100010883700 [0,1,1,0,0,0|1,1,0]=4 574 B20R2.13864254 CCOCCCSc1ccc2c(=O)[nH]c(cc2c1)C 62a_100012232248_100010883700 [0,1,1,0,0,0|1,1,0]=4 575 B20R2.13864259 CCCCCCSc1ccc2c(=O)n(ccc2c1)C 62a_100000210314_100010246303 [0,1,1,0,0,0|1,1,0]=4 576 B20R2.13864259 CCCCCCSc1ccc2c(=O)n(ccc2c1)C 62a_100010246303_100000210757 [0,1,1,0,0,0|1,1,0]=4 577 B20R2.13864259 CCOCCCSc1ccc2c(=O)n(ccc2c1)C 62a_100010246303_100012232248 [0,1,1,0,0,0|1,1,0]=4 578 B20R2.13864259 CCOCCCSc1ccc2c(=O)n(ccc2c1)C 62a_100012232248_100010246303 [0,1,1,0,0,0|1,1,0]=4 579 B20R2.141290 CC(C)CCC(C)Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100011261404 [0,1,1,0,0,0|1,0,0]=3 580 B20R2.3899236 CCCCC(C)Sc1ccc2c(=O)n(ccc2c1)C 62a_100010246303_200011215066 [0,1,1,0,0,0|1,1,0]=4 581 B20R2.3899236 CCCCC(C)Sc1ccc2c(=O)n(ccc2c1)C 62a_200011215066_100010246303 [0,1,1,0,0,0|1,1,0]=4 582 B20R2.5189104 CCCCC(C)Sc1ccc2c(=O)[nH]c(cc2c1)C 62a_200011215066_100010883700 [0,1,1,0,0,0|1,1,0]=4 583 B20R2.7498425 CCCCC(C)C(=O)c1ccc2c(=O)[nH]ccc2c1 1458a_200015497760_200011215066 [0,1,1,0,0,0|2,0,0]=4 584 B20R2.11300643 CCCCC(CC)Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_200011216223 [0,1,1,0,0,0|1,0,0]=3 585 B20R2.11300643 CCCCC(CC)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200011216223 [0,1,1,0,0,0|1,0,0]=3 586 B20R2.12173636 COC(=O)CC(C)Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100009817358 [0,1,1,0,0,0|1,0,1]=4 587 B20R2.12173636 COC(=O)CC(C)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100009817358 [0,1,1,0,0,0|1,0,1]=4 588 B20R2.5556428 CCCC(CC)Sc1ccc2c(=O)[nH]c(cc2c1)C 62a_100011219200_100010883700 [0,1,1,0,0,0|1,1,0]=4 589 B20R2.7826452 CCCC(CC)Sc1ccc2c(=O)n(ccc2c1)C 62a_100010246303_100011219200 [0,1,1,0,0,0|1,1,0]=4 590 B20R2.7826452 CCCC(CC)Sc1ccc2c(=O)n(ccc2c1)C 62a_100011219200_100010246303 [0,1,1,0,0,0|1,1,0]=4 591 B20R2.11404547 CCCC(CC)C(=O)c1ccc2c(=O)[nH]ccc2c1 1458a_200015497760_100011219200 [0,1,1,0,0,0|2,0,0]=4 592 B20R2.11744313 CCCC(CCC)Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_200011218217 [0,1,1,0,0,0|1,0,0]=3 593 B20R2.11744313 CCCC(CCC)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200011218217 [0,1,1,0,0,0|1,0,0]=3 594 B20R2.31660044 CCCC(C)(CC)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_200000040151 [0,1,1,0,0,0|1,0,0]=3 595 B20R3.411 Brc1cc2ccccc2cc1OC3CCCCC3 34a_100009817189_100000210327 [1,1,0,0,0,0|2,0,0]=4 596 B20R3.411 Brc1cc2ccccc2cc1OC3CCCCC3 7a_100009817189_100000210327 [1,1,0,0,0,0|2,0,0]=4 597 B20R3.411 Brc1cc2ccccc2cc1OC3CCOCC3 7a_100009817189_100000686592 [1,1,0,0,0,0|2,0,0]=4 598 B20R3.411 Brc1cc2ccccc2cc1OC3CCSCC3 34a_100009817189_100000069128 [1,1,0,0,0,0|2,0,0]=4 599 B20R3.411 Brc1cc2ccccc2cc1OC3CCSCC3 7a_100009817189_100011500858 [1,1,0,0,0,0|2,0,0]=4 600 B20R3.411 Cc1cc2ccccc2cc1OC3CCCCC3 34a_100000091601_100000210327 [1,1,0,0,0,0|2,0,0]=4 601 B20R3.411 Cc1cc2ccccc2cc1OC3CCCCC3 7a_100000091601_100000210327 [1,1,0,0,0,0|2,0,0]=4 602 B20R3.411 Cc1cc2ccccc2cc1OC3CCOCC3 7a_100000091601_100000686592 [1,1,0,0,0,0|2,0,0]=4 603 B20R3.411 Cc1cc2ccccc2cc1OC3CCSCC3 34a_100000091601_100000069128 [1,1,0,0,0,0|2,0,0]=4 604 B20R3.411 Cc1cc2ccccc2cc1OC3CCSCC3 7a_100000091601_100011500858 [1,1,0,0,0,0|2,0,0]=4 605 B20R3.411 Nc1cc2ccccc2cc1OC3CCCCC3 34a_106744474703_100000210327 [1,1,0,0,0,0|2,0,0]=4 606 B20R3.411 Nc1cc2ccccc2cc1OC3CCCCC3 7a_106744474703_100000210327 [1,1,0,0,0,0|2,0,0]=4 607 B20R3.411 Nc1cc2ccccc2cc1OC3CCOCC3 7a_106744474703_100000686592 [1,1,0,0,0,0|2,0,0]=4 608 B20R3.411 Nc1cc2ccccc2cc1OC3CCSCC3 34a_106744474703_100000069128 [1,1,0,0,0,0|2,0,0]=4 609 B20R3.411 Nc1cc2ccccc2cc1OC3CCSCC3 7a_106744474703_100011500858 [1,1,0,0,0,0|2,0,0]=4 610 B20R3.5551 Brc1ccc2ccc(cc2c1)OC3CCCCC3 34a_100009816537_100000210327 [1,1,0,0,0,0|2,0,0]=4 611 B20R3.5551 Brc1ccc2ccc(cc2c1)OC3CCCCC3 7a_100009816537_100000210327 [1,1,0,0,0,0|2,0,0]=4 612 B20R3.5551 Brc1ccc2ccc(cc2c1)OC3CCOCC3 7a_100009816537_100000686592 [1,1,0,0,0,0|2,0,0]=4 613 B20R3.5551 Brc1ccc2ccc(cc2c1)OC3CCSCC3 34a_100009816537_100000069128 [1,1,0,0,0,0|2,0,0]=4 614 B20R3.5551 Brc1ccc2ccc(cc2c1)OC3CCSCC3 7a_100009816537_100011500858 [1,1,0,0,0,0|2,0,0]=4 615 B20R3.5551 Cc1ccc2ccc(cc2c1)OC3CCCCC3 34a_100000091598_100000210327 [1,1,0,0,0,0|2,0,0]=4 616 B20R3.5551 Cc1ccc2ccc(cc2c1)OC3CCCCC3 7a_100000091598_100000210327 [1,1,0,0,0,0|2,0,0]=4 617 B20R3.5551 Cc1ccc2ccc(cc2c1)OC3CCOCC3 7a_100000091598_100000686592 [1,1,0,0,0,0|2,0,0]=4 618 B20R3.5551 Cc1ccc2ccc(cc2c1)OC3CCSCC3 34a_100000091598_100000069128 [1,1,0,0,0,0|2,0,0]=4 619 B20R3.5551 Cc1ccc2ccc(cc2c1)OC3CCSCC3 7a_100000091598_100011500858 [1,1,0,0,0,0|2,0,0]=4 620 B20R3.5551 Nc1ccc2ccc(cc2c1)OC3CCCCC3 34a_100015378740_100000210327 [1,1,0,0,0,0|2,0,0]=4 621 B20R3.5551 Nc1ccc2ccc(cc2c1)OC3CCCCC3 7a_100015378740_100000210327 [1,1,0,0,0,0|2,0,0]=4 622 B20R3.5551 Nc1ccc2ccc(cc2c1)OC3CCOCC3 7a_100015378740_100000686592 [1,1,0,0,0,0|2,0,0]=4 623 B20R3.5551 Nc1ccc2ccc(cc2c1)OC3CCSCC3 34a_100015378740_100000069128 [1,1,0,0,0,0|2,0,0]=4 624 B20R3.5551 Nc1ccc2ccc(cc2c1)OC3CCSCC3 7a_100015378740_100011500858 [1,1,0,0,0,0|2,0,0]=4 625 B20R3.13439 FC1CCCCC1Oc2ccc3ccccc3c2 34a_100000185828_100015423560 [1,1,0,0,0,0|2,0,0]=4 626 B20R3.13439 FC1CCCCC1Oc2ccc3cnccc3c2 34a_100000046372_100015423560 [1,1,0,0,0,0|1,0,1]=4 627 B20R3.13439 OC1CCCCC1Oc2ccc3ccccc3c2 34a_100000185828_100000038908 [1,1,0,0,0,0|2,0,0]=4 628 B20R3.13439 OC1CCCCC1Oc2ccc3cnccc3c2 34a_100000046372_100000038908 [1,1,0,0,0,0|1,0,1]=4 629 B20R3.13449 Brc1cc(cc2c1cccc2)OC3CCCCC3 34a_100010001680_100000210327 [1,1,0,0,0,0|2,0,0]=4 630 B20R3.13449 Brc1cc(cc2c1cccc2)OC3CCCCC3 7a_100010001680_100000210327 [1,1,0,0,0,0|2,0,0]=4 631 B20R3.13449 Brc1cc(cc2c1cccc2)OC3CCOCC3 7a_100010001680_100000686592 [1,1,0,0,0,0|2,0,0]=4 632 B20R3.13449 Brc1cc(cc2c1cccc2)OC3CCSCC3 34a_100010001680_100000069128 [1,1,0,0,0,0|2,0,0]=4 633 B20R3.13449 Brc1cc(cc2c1cccc2)OC3CCSCC3 7a_100010001680_100011500858 [1,1,0,0,0,0|2,0,0]=4 634 B20R3.13449 Brc1cc(cc2c1cncc2)OC3CCCCC3 34a_100011009069_100000210327 [1,1,0,0,0,0|1,0,1]=4 635 B20R3.13449 Brc1cc(cc2c1cncc2)OC3CCCCC3 7a_100011009069_100000210327 [1,1,0,0,0,0|1,0,1]=4 636 B20R3.13449 Brc1cc(cc2c1cncc2)OC3CCOCC3 7a_100011009069_100000686592 [1,1,0,0,0,0|1,0,1]=4 637 B20R3.13449 Brc1cc(cc2c1cncc2)OC3CCSCC3 34a_100011009069_100000069128 [1,1,0,0,0,0|1,0,1]=4 638 B20R3.13449 Brc1cc(cc2c1cncc2)OC3CCSCC3 7a_100011009069_100011500858 [1,1,0,0,0,0|1,0,1]=4 639 B20R3.19901 CC1CCC(CC1)Oc2ccc3ccccc3c2 34a_100000185828_200011216234 [1,1,0,0,0,0|2,0,0]=4 640 B20R3.19901 CC1CCC(CC1)Oc2ccc3cnccc3c2 34a_100000046372_200011216234 [1,1,0,0,0,0|1,0,1]=4 641 B20R3.19901 CN1CCC(CC1)Sc2ccc3cnccc3c2 62a_100009816743_100011215917 [1,1,0,0,0,0|0,1,1]=4 642 B20R3.96365 Brc1c(ccc2c1cccc2)OC3CCCCC3 34a_100000183829_100000210327 [1,1,0,0,0,0|2,0,0]=4 643 B20R3.96365 Brc1c(ccc2c1cccc2)OC3CCCCC3 7a_100000183829_100000210327 [1,1,0,0,0,0|2,0,0]=4 644 B20R3.96365 Brc1c(ccc2c1cccc2)OC3CCOCC3 7a_100000183829_100000686592 [1,1,0,0,0,0|2,0,0]=4 645 B20R3.96365 Brc1c(ccc2c1cccc2)OC3CCSCC3 34a_100000183829_100000069128 [1,1,0,0,0,0|2,0,0]=4 646 B20R3.96365 Brc1c(ccc2c1cccc2)OC3CCSCC3 7a_100000183829_100011500858 [1,1,0,0,0,0|2,0,0]=4 647 B20R3.96365 Cc1c(ccc2c1cccc2)OC3CCCCC3 34a_100009830054_100000210327 [1,1,0,0,0,0|2,0,0]=4 648 B20R3.96365 Cc1c(ccc2c1cccc2)OC3CCCCC3 7a_100009830054_100000210327 [1,1,0,0,0,0|2,0,0]=4 649 B20R3.96365 Cc1c(ccc2c1cccc2)OC3CCOCC3 7a_100009830054_100000686592 [1,1,0,0,0,0|2,0,0]=4 650 B20R3.96365 Cc1c(ccc2c1cccc2)OC3CCSCC3 34a_100009830054_100000069128 [1,1,0,0,0,0|2,0,0]=4 651 B20R3.96365 Cc1c(ccc2c1cccc2)OC3CCSCC3 7a_100009830054_100011500858 [1,1,0,0,0,0|2,0,0]=4 652 B20R3.96365 Clc1c(ccc2c1cccc2)OC3CCCCC3 34a_100000029778_100000210327 [1,1,0,0,0,0|2,0,0]=4 653 B20R3.96365 Clc1c(ccc2c1cccc2)OC3CCCCC3 7a_100000029778_100000210327 [1,1,0,0,0,0|2,0,0]=4 654 B20R3.96365 Clc1c(ccc2c1cccc2)OC3CCOCC3 7a_100000029778_100000686592 [1,1,0,0,0,0|2,0,0]=4 655 B20R3.96365 Clc1c(ccc2c1cccc2)OC3CCSCC3 34a_100000029778_100000069128 [1,1,0,0,0,0|2,0,0]=4 656 B20R3.96365 Clc1c(ccc2c1cccc2)OC3CCSCC3 7a_100000029778_100011500858 [1,1,0,0,0,0|2,0,0]=4 657 B20R3.96365 Clc1c(ccc2c1ccnc2)OC3CCCCC3 34a_100009824633_100000210327 [1,1,0,0,0,0|1,0,1]=4 658 B20R3.96365 Clc1c(ccc2c1ccnc2)OC3CCCCC3 7a_100009824633_100000210327 [1,1,0,0,0,0|1,0,1]=4 659 B20R3.96365 Clc1c(ccc2c1ccnc2)OC3CCOCC3 7a_100009824633_100000686592 [1,1,0,0,0,0|1,0,1]=4 660 B20R3.96365 Clc1c(ccc2c1ccnc2)OC3CCSCC3 34a_100009824633_100000069128 [1,1,0,0,0,0|1,0,1]=4 661 B20R3.96365 Clc1c(ccc2c1ccnc2)OC3CCSCC3 7a_100009824633_100011500858 [1,1,0,0,0,0|1,0,1]=4 662 B20R3.96365 Ic1c(ccc2c1cccc2)OC3CCCCC3 34a_100000041551_100000210327 [1,1,0,0,0,0|2,0,0]=4 663 B20R3.96365 Ic1c(ccc2c1cccc2)OC3CCCCC3 7a_100000041551_100000210327 [1,1,0,0,0,0|2,0,0]=4 664 B20R3.96365 Ic1c(ccc2c1cccc2)OC3CCOCC3 7a_100000041551_100000686592 [1,1,0,0,0,0|2,0,0]=4 665 B20R3.96365 Ic1c(ccc2c1cccc2)OC3CCSCC3 34a_100000041551_100000069128 [1,1,0,0,0,0|2,0,0]=4 666 B20R3.96365 Ic1c(ccc2c1cccc2)OC3CCSCC3 7a_100000041551_100011500858 [1,1,0,0,0,0|2,0,0]=4 667 B20R3.96365 Nc1c(ccc2c1cccc2)OC3CCCCC3 34a_100000007056_100000210327 [1,1,0,0,0,0|2,0,0]=4 668 B20R3.96365 Nc1c(ccc2c1cccc2)OC3CCCCC3 7a_100000007056_100000210327 [1,1,0,0,0,0|2,0,0]=4 669 B20R3.96365 Nc1c(ccc2c1cccc2)OC3CCOCC3 7a_100000007056_100000686592 [1,1,0,0,0,0|2,0,0]=4 670 B20R3.96365 Nc1c(ccc2c1cccc2)OC3CCSCC3 34a_100000007056_100000069128 [1,1,0,0,0,0|2,0,0]=4 671 B20R3.96365 Nc1c(ccc2c1cccc2)OC3CCSCC3 7a_100000007056_100011500858 [1,1,0,0,0,0|2,0,0]=4 672 B20R3.142237 Brc1ccc2cc(ccc2c1)OC3CCCCC3 34a_100000185455_100000210327 [1,1,0,0,0,0|2,0,0]=4 673 B20R3.142237 Brc1ccc2cc(ccc2c1)OC3CCCCC3 7a_100000185455_100000210327 [1,1,0,0,0,0|2,0,0]=4 674 B20R3.142237 Brc1ccc2cc(ccc2c1)OC3CCOCC3 7a_100000185455_100000686592 [1,1,0,0,0,0|2,0,0]=4 675 B20R3.142237 Brc1ccc2cc(ccc2c1)OC3CCSCC3 34a_100000185455_100000069128 [1,1,0,0,0,0|2,0,0]=4 676 B20R3.142237 Brc1ccc2cc(ccc2c1)OC3CCSCC3 7a_100000185455_100011500858 [1,1,0,0,0,0|2,0,0]=4 677 B20R3.142237 Cc1ccc2cc(ccc2c1)OC3CCCCC3 34a_100000074090_100000210327 [1,1,0,0,0,0|2,0,0]=4 678 B20R3.142237 Cc1ccc2cc(ccc2c1)OC3CCCCC3 7a_100000074090_100000210327 [1,1,0,0,0,0|2,0,0]=4 679 B20R3.142237 Cc1ccc2cc(ccc2c1)OC3CCOCC3 7a_100000074090_100000686592 [1,1,0,0,0,0|2,0,0]=4 680 B20R3.142237 Cc1ccc2cc(ccc2c1)OC3CCSCC3 34a_100000074090_100000069128 [1,1,0,0,0,0|2,0,0]=4 681 B20R3.142237 Cc1ccc2cc(ccc2c1)OC3CCSCC3 7a_100000074090_100011500858 [1,1,0,0,0,0|2,0,0]=4 682 B20R3.142237 Clc1ccc2cc(ccc2c1)OC3CCCCC3 34a_100000074905_100000210327 [1,1,0,0,0,0|2,0,0]=4 683 B20R3.142237 Clc1ccc2cc(ccc2c1)OC3CCCCC3 7a_100000074905_100000210327 [1,1,0,0,0,0|2,0,0]=4 684 B20R3.142237 Clc1ccc2cc(ccc2c1)OC3CCOCC3 7a_100000074905_100000686592 [1,1,0,0,0,0|2,0,0]=4 685 B20R3.142237 Clc1ccc2cc(ccc2c1)OC3CCSCC3 34a_100000074905_100000069128 [1,1,0,0,0,0|2,0,0]=4 686 B20R3.142237 Clc1ccc2cc(ccc2c1)OC3CCSCC3 7a_100000074905_100011500858 [1,1,0,0,0,0|2,0,0]=4 687 B20R3.142237 Fc1ccc2cc(ccc2c1)OC3CCCCC3 34a_100009847029_100000210327 [1,1,0,0,0,0|2,0,0]=4 688 B20R3.142237 Fc1ccc2cc(ccc2c1)OC3CCCCC3 7a_100009847029_100000210327 [1,1,0,0,0,0|2,0,0]=4 689 B20R3.142237 Fc1ccc2cc(ccc2c1)OC3CCOCC3 7a_100009847029_100000686592 [1,1,0,0,0,0|2,0,0]=4 690 B20R3.142237 Fc1ccc2cc(ccc2c1)OC3CCSCC3 34a_100009847029_100000069128 [1,1,0,0,0,0|2,0,0]=4 691 B20R3.142237 Fc1ccc2cc(ccc2c1)OC3CCSCC3 7a_100009847029_100011500858 [1,1,0,0,0,0|2,0,0]=4 692 B20R3.251407 Brc1cccc2c1cc(cc2)OC3CCCCC3 34a_100010169565_100000210327 [1,1,0,0,0,0|2,0,0]=4 693 B20R3.251407 Brc1cccc2c1cc(cc2)OC3CCCCC3 7a_100010169565_100000210327 [1,1,0,0,0,0|2,0,0]=4 694 B20R3.251407 Brc1cccc2c1cc(cc2)OC3CCOCC3 7a_100010169565_100000686592 [1,1,0,0,0,0|2,0,0]=4 695 B20R3.251407 Brc1cccc2c1cc(cc2)OC3CCSCC3 34a_100010169565_100000069128 [1,1,0,0,0,0|2,0,0]=4 696 B20R3.251407 Brc1cccc2c1cc(cc2)OC3CCSCC3 7a_100010169565_100011500858 [1,1,0,0,0,0|2,0,0]=4 697 B20R3.251407 Cc1cccc2c1cc(cc2)OC3CCCCC3 34a_200000091600_100000210327 [1,1,0,0,0,0|2,0,0]=4 698 B20R3.251407 Cc1cccc2c1cc(cc2)OC3CCCCC3 7a_200000091600_100000210327 [1,1,0,0,0,0|2,0,0]=4 699 B20R3.251407 Cc1cccc2c1cc(cc2)OC3CCOCC3 7a_200000091600_100000686592 [1,1,0,0,0,0|2,0,0]=4 700 B20R3.251407 Cc1cccc2c1cc(cc2)OC3CCSCC3 34a_200000091600_100000069128 [1,1,0,0,0,0|2,0,0]=4 701 B20R3.251407 Cc1cccc2c1cc(cc2)OC3CCSCC3 7a_200000091600_100011500858 [1,1,0,0,0,0|2,0,0]=4 702 B20R3.251407 Fc1cccc2c1cc(cc2)OC3CCCCC3 34a_100000091619_100000210327 [1,1,0,0,0,0|2,0,0]=4 703 B20R3.251407 Fc1cccc2c1cc(cc2)OC3CCCCC3 7a_100000091619_100000210327 [1,1,0,0,0,0|2,0,0]=4 704 B20R3.251407 Fc1cccc2c1cc(cc2)OC3CCOCC3 7a_100000091619_100000686592 [1,1,0,0,0,0|2,0,0]=4 705 B20R3.251407 Fc1cccc2c1cc(cc2)OC3CCSCC3 34a_100000091619_100000069128 [1,1,0,0,0,0|2,0,0]=4 706 B20R3.251407 Fc1cccc2c1cc(cc2)OC3CCSCC3 7a_100000091619_100011500858 [1,1,0,0,0,0|2,0,0]=4 707 B20R3.251407 Nc1cccc2c1cc(cc2)OC3CCCCC3 34a_100000034012_100000210327 [1,1,0,0,0,0|2,0,0]=4 708 B20R3.251407 Nc1cccc2c1cc(cc2)OC3CCCCC3 7a_100000034012_100000210327 [1,1,0,0,0,0|2,0,0]=4 709 B20R3.251407 Nc1cccc2c1cc(cc2)OC3CCOCC3 7a_100000034012_100000686592 [1,1,0,0,0,0|2,0,0]=4 710 B20R3.251407 Nc1cccc2c1cc(cc2)OC3CCSCC3 34a_100000034012_100000069128 [1,1,0,0,0,0|2,0,0]=4 711 B20R3.251407 Nc1cccc2c1cc(cc2)OC3CCSCC3 7a_100000034012_100011500858 [1,1,0,0,0,0|2,0,0]=4 712 B20R3.155180 O=C1NC(=O)c2c1ccc(c2)OC3CCCCC3 7a_100000101950_100000210327 [0,1,0,0,1,0|1,0,0]=3 713 B20R3.155180 O=C1NC(=O)c2c1ccc(c2)OC3CCCOC3 7a_100000101950_100000693364 [0,1,0,0,1,0|2,0,0]=4 714 B20R3.155180 O=C1NC(=O)c2c1ccc(c2)OC3CCOCC3 7a_100000101950_100000686592 [0,1,0,0,1,0|1,0,0]=3 715 B20R3.155180 O=C1NC(=O)c2c1ccc(c2)OC3CCSCC3 7a_100000101950_100011500858 [0,1,0,0,1,0|1,0,0]=3 716 B20R3.155180 O=C1NC(=O)c2c1ccc(c2)SC3CCCCC3 62a_100000185758_100000210327 [0,1,0,0,1,0|1,1,0]=4 717 B20R3.155180 O=C1NC(=O)c2c1ccc(c2)SC3CCOCC3 62a_100000185758_100011324220 [0,1,0,0,1,0|1,1,0]=4 718 B20R3.155180 O=C1NC(=O)c2c1ccc(c2)SC3CCSCC3 62a_100000185758_100000069128 [0,1,0,0,1,0|1,1,0]=4 719 B20R3.155180 O=C1OC(=O)c2c1ccc(c2)OC3CCCCC3 7a_100000030292_100000210327 [0,1,0,0,1,0|2,0,0]=4 720 B20R3.155180 O=C1OC(=O)c2c1ccc(c2)OC3CCOCC3 7a_100000030292_100000686592 [0,1,0,0,1,0|2,0,0]=4 721 B20R3.155180 O=C1OC(=O)c2c1ccc(c2)OC3CCSCC3 7a_100000030292_100011500858 [0,1,0,0,1,0|2,0,0]=4 722 B20R3.281067 O=C1C=Cc2c1ccc(c2)SC3CCCCC3F 62a_100010210589_100015423560 [0,1,0,0,1,0|1,1,0]=4 723 B20R3.281067 O=C1C=Cc2c1ccc(c2)SC3CCCCC3F 62a_100015423560_100010210589 [0,1,0,0,1,0|1,1,0]=4 724 B20R3.281067 O=C1C=Cc2c1ccc(c2)SC3CCCCC3O 62a_100000038908_100010210589 [0,1,0,0,1,0|1,1,0]=4 725 B20R3.281067 O=C1C=Cc2c1ccc(c2)SC3CCCCC3O 62a_100010210589_100000038908 [0,1,0,0,1,0|1,1,0]=4 726 B20R3.281067 O=C1NCc2c1ccc(c2)OC3CCCCC3F 34a_100000098542_100015423560 [0,1,0,0,1,0|1,0,1]=4 727 B20R3.281067 O=C1NCc2c1ccc(c2)OC3CCCCC3O 34a_100000098542_100000038908 [0,1,0,0,1,0|1,0,1]=4 728 B20R3.407865 CC1CCC(CC1)Oc2ccc3c(c2)CNC3=O 34a_100000098542_200011216234 [0,1,0,0,1,0|1,0,1]=4 729 B20R3.407865 CC1CCC(CC1)Sc2ccc3c(c2)C=CC3=O 62a_100010210589_200011216234 [0,1,0,0,1,0|1,1,0]=4 730 B20R3.407865 CN1CCC(CC1)Sc2ccc3c(c2)C=CC3=O 62a_100010210589_100011215917 [0,1,0,0,1,0|0,1,0]=3 731 B20R3.407865 CN1CCC(CC1)Sc2ccc3c(c2)CNC3=O 62a_100000692135_100011215917 [0,1,0,0,1,0|0,1,1]=4 732 B20R3.14623 Cc1cc2cc(ccc2c(=O)[nH]1)C3=CCNCC3 271570a_100000731432_100010883700 [0,1,0,0,1,0|0,0,2]=4 733 B20R3.88396 CN1CCN(CC1)c2ccc3c(=O)[nH]cnc3c2 27a_100000188432_100000230960 [0,1,0,0,1,0|2,0,0]=4 734 B20R3.93110 Cn1ccc2cc(ccc2c1=O)C3=CCNCC3 271570a_100000731432_100010246303 [0,1,0,0,1,0|0,0,2]=4 735 B20R3.93109 Cn1ccc2cc(ccc2c1=O)C=C3CCCC3 271570a_100010378317_100010246303 [0,1,0,0,1,0|1,0,1]=4 736 B20R3.93109 Cn1ccc2cc(ccc2c1=O)SC3CCCC3 62a_100010246303_100000179811 [0,1,0,0,1,0|0,1,0]=3 737 B20R3.93109 Cn1ccc2cc(ccc2c1=O)SC3CCCC3 62a_100011217020_100010246303 [0,1,0,0,1,0|0,1,0]=3 738 B20R3.93109 Cn1ccc2cc(ccc2c1=O)SC3CCOC3 62a_100010246303_100000690089 [0,1,0,0,1,0|1,1,0]=4 739 B20R3.93109 O=C1C=Cc2cc(ccc2C1=O)SC3CCCC3 62a_100009812793_100000179811 [0,1,0,0,1,0|1,1,0]=4 740 B20R3.93109 O=C1C=Cc2cc(ccc2C1=O)SC3CCCC3 62a_100011217020_100009812793 [0,1,0,0,1,0|1,1,0]=4 741 B20R3.250882 CN(c1ccc2c(=O)[nH]cnc2c1)C3CCCC3 27a_100000207505_100000230960 [0,1,0,0,1,0|2,0,0]=4 742 B20R3.250882 O=C(c1ccc2c(=O)[nH]ccc2c1)C3CCCC3 1458a_200015497760_100000179811 [0,1,0,0,1,0|1,0,0]=3 743 B20R3.250882 O=C(c1ccc2c(=O)[nH]ccc2c1)C3CCOC3 1458a_200015497760_100000690089 [0,1,0,0,1,0|2,0,0]=4 744 B20R3.250882 O=C(c1ccc2c(=O)[nH]ccc2c1)N3CCCC3 240690a_100000188435_200015497760 [0,1,0,0,1,0|2,0,0]=4 745 B20R3.250882 O=C(c1ccc2c(=O)[nH]ccc2c1)N3CCCC3 527a_100000188435_200015497760 [0,1,0,0,1,0|2,0,0]=4 746 B20R3.250882 O=C(c1ccc2c(=O)[nH]cnc2c1)C3CCCC3 1458a_100011298682_100000179811 [0,1,0,0,1,0|2,0,0]=4 747 B20R3.261932 O=C1CCCC1Oc2ccc3c(=O)[nH]ccc3c2 34a_100009857879_100000709159 [0,1,0,0,1,0|0,0,1]=3 748 B20R3.261932 O=C1CCCC1Oc2ccc3c(=O)[nH]ccc3c2 7a_100009857879_100000211823 [0,1,0,0,1,0|0,0,1]=3 749 B20R3.261932 O=C1OCCC1Oc2ccc3c(=O)[nH]ccc3c2 34a_100009857879_100000211211 [0,1,0,0,1,0|1,0,1]=4 750 B20R3.261932 O=C1OCCC1Oc2ccc3c(=O)[nH]ccc3c2 7a_100009857879_100000211211 [0,1,0,0,1,0|1,0,1]=4 751 B20R3.261932 O=c1[nH]ccc2c1ccc(c2)OC3COCC3O 34a_100009857879_200000725654 [0,1,0,0,1,0|1,0,0]=3 752 B20R3.261932 O=c1[nH]ccc2c1ccc(c2)OC3COCC3O 7a_100009857879_200000725654 [0,1,0,0,1,0|1,0,0]=3 753 B20R3.261932 O=c1[nH]ccc2c1cnc(c2)S[C@@H]3CCC[C@H]3O 62a_100010134373_200016002552 [0,1,0,0,1,0|1,1,0]=4 754 B20R3.261932 O=c1[nH]cnc2c1ccc(c2)N[C@H]3CCC[C@@H]3O 27a_100000748460_100000230960 [0,1,0,0,1,0|2,0,0]=4 755 B20R3.261932 O=c1[nH]cnc2c1ccc(c2)S[C@@H]3CCC[C@H]3O 62a_200016002552_100000230960 [0,1,0,0,1,0|1,1,0]=4 756 B20R3.2739449 CN1CCC(C1)Nc2ccc3c(=O)[nH]cnc3c2 27a_100000744687_100000230960 [0,1,0,0,1,0|2,0,0]=4 757 B20R3.2739449 CN1CCC(C1)Oc2ccc3c(=O)[nH]ccc3c2 7a_100009857879_200012183744 [0,1,0,0,1,0|0,0,0]=2 758 B20R3.2739449 CN1CCC(C1)Oc2ccc3c(=O)ccoc3c2 7a_200000065989_200012183744 [0,1,0,0,1,0|2,0,0]=4 759 B20R3.2739449 CN1CCC(C1)Oc2ccc3c(c2)CCNC3=O 7a_100000087030_200012183744 [0,1,0,0,1,0|0,0,2]=4 760 B20R3.2739449 CN1CCC(C1)Oc2ccc3c(cccc3c2)N 7a_100000034668_200012183744 [0,1,0,0,1,0|2,0,0]=4 761 B20R3.2739449 CN1CCC(C1)Oc2ccc3c(nccc3c2)Cl 7a_100009867704_200012183744 [0,1,0,0,1,0|1,0,1]=4 762 B20R3.2739449 CN1CCC(C1)Sc2cc3cc[nH]c(=O)c3cn2 62a_100010134373_200012183744 [0,1,0,0,1,0|1,1,0]=4 763 B20R3.2739449 O=c1[nH]cnc2c1ccc(c2)N[C@H]3CC[C@H](C3)O 27a_100015195300_100000230960 [0,1,0,0,1,0|2,0,0]=4 764 B20R3.4873880 Cc1cc2cc(ccc2c(=O)[nH]1)C=C3CCCC3 271570a_100010378317_100010883700 [0,1,0,0,1,0|1,0,1]=4 765 B20R3.4873880 Cc1cc2cc(ccc2c(=O)[nH]1)SC3CCCC3 62a_100011217020_100010883700 [0,1,0,0,1,0|0,1,0]=3 766 B20R3.4873880 Cc1nc2cc(ccc2c(=O)[nH]1)NC3CCCC3 27a_100000211070_100012357626 [0,1,0,0,1,0|2,0,0]=4 767 B20R3.4873880 Cc1nc2cc(ccc2c(=O)[nH]1)SC3CCCC3 62a_100011217020_100012357626 [0,1,0,0,1,0|1,1,0]=4 768 B20R3.4873880 O=C1Cc2cc(ccc2C(=O)N1)SC3CCCC3 62a_100011217020_100010160918 [0,1,0,0,1,0|0,1,1]=4 769 B20R3.4873880 O=c1[nH]c(=O)c2ccc(cc2[nH]1)NC3CCCC3 2230a_100012184015_100000179811 [0,1,0,0,1,0|2,0,0]=4 770 B20R3.4873880 O=c1[nH]c(=O)c2ccc(cc2[nH]1)NC3CCCC3 27a_100000211070_100012351534 [0,1,0,0,1,0|2,0,0]=4 771 B20R3.4873880 O=c1[nH]c(=O)c2ccc(cc2[nH]1)SC3CCCC3 62a_100011217020_100010219097 [0,1,0,0,1,0|1,1,0]=4 772 B20R3.19469316 Clc1cccc2c1c(cc(c2)OC3CCCC3)Br 34a_103552013942_100000179811 [0,1,0,0,1,0|2,0,0]=4 773 B20R3.19469316 Clc1cccc2c1c(cc(c2)OC3CCCC3)Br 7a_103552013942_100000179811 [0,1,0,0,1,0|2,0,0]=4 774 B22R3.242696 Cn1ccc2cc(ccc2c1=O)C=CC3CCCCC3 271570a_100016283615_100010246303 [0,1,0,0,0,1|2,0,0]=4 775 B22R3.242696 Cn1ccc2cc(ccc2c1=O)SCC3CCCCC3 62a_100000211423_100010246303 [0,1,0,0,0,1|1,1,0]=4 776 B22R3.242696 Cn1ccc2cc(ccc2c1=O)SCC3CCCCC3 62a_100010246303_100000211423 [0,1,0,0,0,1|1,1,0]=4 777 B22R3.242696 Cn1ccc2cc(ccc2c1=O)SCC3CCOCC3 62a_100000754603_100010246303 [0,1,0,0,0,1|1,1,0]=4 778 B22R3.242696 Cn1ccc2cc(ccc2c1=O)SCC3CCOCC3 62a_100010246303_100000749018 [0,1,0,0,0,1|1,1,0]=4 779 B22R3.607718 O=C(CC1CCCCC1)c2ccc3c(=O)[nH]ccc3c2 1458a_200015497760_100000211423 [0,1,0,0,0,1|2,0,0]=4 780 B22R3.607718 O=C(CC1CCOCC1)c2ccc3c(=O)[nH]ccc3c2 1458a_200015497760_100000754603 [0,1,0,0,0,1|2,0,0]=4 781 B22R3.607718 O=C(NC1CCCCC1)c2ccc3c(=O)[nH]ccc3c2 240690a_100000182618_200015497760 [0,1,0,0,0,1|2,0,0]=4 782 B22R3.607718 O=C(NC1CCCCC1)c2ccc3c(=O)[nH]ccc3c2 527a_100000182618_200015497760 [0,1,0,0,0,1|2,0,0]=4 783 B22R3.607718 O=C(NC1CCOCC1)c2ccc3c(=O)[nH]ccc3c2 240690a_100000741149_200015497760 [0,1,0,0,0,1|2,0,0]=4 784 B22R3.607718 O=C(NC1CCOCC1)c2ccc3c(=O)[nH]ccc3c2 527a_100000741149_200015497760 [0,1,0,0,0,1|2,0,0]=4 785 B22R3.607718 O=C(NC1CCSCC1)c2ccc3c(=O)[nH]ccc3c2 240690a_100000748639_200015497760 [0,1,0,0,0,1|2,0,0]=4 786 B22R3.607718 O=C(NC1CCSCC1)c2ccc3c(=O)[nH]ccc3c2 527a_100000748639_200015497760 [0,1,0,0,0,1|2,0,0]=4 787 B22R3.607733 O=C(Nc1ccc2c(=O)[nH]ccc2c1)C3CCCCC3 11a_100009854415_100000210647 [0,1,0,0,0,1|2,0,0]=4 788 B22R3.607733 O=C(Nc1ccc2c(=O)[nH]ccc2c1)C3CCCCC3 22a_100009854415_100000210647 [0,1,0,0,0,1|2,0,0]=4 789 B22R3.607733 O=C(Nc1ccc2c(=O)[nH]ccc2c1)C3CCCCC3 527a_100009854415_100000210647 [0,1,0,0,0,1|2,0,0]=4 790 B22R3.607733 O=C(Nc1ccc2c(=O)[nH]ccc2c1)C3CCOCC3 11a_100009854415_100000195482 [0,1,0,0,0,1|2,0,0]=4 791 B22R3.607733 O=C(Nc1ccc2c(=O)[nH]ccc2c1)C3CCOCC3 22a_100009854415_100000195482 [0,1,0,0,0,1|2,0,0]=4 792 B22R3.607733 O=C(Nc1ccc2c(=O)[nH]ccc2c1)C3CCOCC3 527a_100009854415_100000195482 [0,1,0,0,0,1|2,0,0]=4 793 B22R3.607733 O=C(Nc1ccc2c(=O)[nH]ccc2c1)C3CCSCC3 11a_100009854415_100000755232 [0,1,0,0,0,1|2,0,0]=4 794 B22R3.607733 O=C(Nc1ccc2c(=O)[nH]ccc2c1)C3CCSCC3 22a_100009854415_100000755232 [0,1,0,0,0,1|2,0,0]=4 795 B22R3.607733 O=C(Nc1ccc2c(=O)[nH]ccc2c1)C3CCSCC3 527a_100009854415_100000755232 [0,1,0,0,0,1|2,0,0]=4 796 B22R3.717055 Cc1cc2cc(ccc2c(=O)[nH]1)C=CC3CCCCC3 271570a_100016283615_100010883700 [0,1,0,0,0,1|2,0,0]=4 797 B22R3.717055 Cc1cc2cc(ccc2c(=O)[nH]1)SCC3CCCCC3 62a_100000211423_100010883700 [0,1,0,0,0,1|1,1,0]=4 798 B22R3.717055 Cc1cc2cc(ccc2c(=O)[nH]1)SCC3CCOCC3 62a_100000754603_100010883700 [0,1,0,0,0,1|1,1,0]=4 799 B22R3.1033232 CN1CCC(CC1)CNc2ccc3c(=O)[nH]cnc3c2 27a_100000746316_100000230960 [0,1,0,0,0,1|2,0,0]=4 800 B22R3.1033232 CN1CCC(CC1)CSc2cc3cc[nH]c(=O)c3cn2 62a_100010134373_100015183002 [0,1,0,0,0,1|1,1,0]=4 801 B22R3.1033232 CN1CCC(CC1)CSc2ccc3c(=O)[nH]cnc3c2 62a_100015183002_100000230960 [0,1,0,0,0,1|1,1,0]=4 802 B22R3.6715880 CN1CCCCC1COc2ccc3c(=O)[nH]ccc3c2 34a_100009857879_100015186950 [0,1,0,0,0,1|2,0,0]=4 803 B22R3.6715880 CN1CCCCC1COc2ccc3c(=O)[nH]ccc3c2 7a_100009857879_100015185383 [0,1,0,0,0,1|2,0,0]=4 804 B22R3.11548996 CN1CCCC(C1)COc2ccc3c(=O)[nH]ccc3c2 34a_100009857879_100015183302 [0,1,0,0,0,1|2,0,0]=4 805 B22R3.11548996 CN1CCCC(C1)COc2ccc3c(=O)[nH]ccc3c2 7a_100009857879_100000752043 [0,1,0,0,0,1|2,0,0]=4 806 B22R3.5510003 O=C1CCCCCC1Oc2ccc3c(=O)[nH]ccc3c2 7a_100009857879_100000243696 [0,1,0,0,0,1|1,0,0]=3 807 B22R3.5510003 O=C1NCCCCC1Oc2ccc3c(=O)[nH]ccc3c2 7a_100009857879_100000735217 [0,1,0,0,0,1|1,0,1]=4 808 B22R3.11636144 Cc1cc2cc(ccc2c(=O)[nH]1)SC3CCCCCC3 62a_100011217769_100010883700 [0,1,0,0,0,1|1,1,0]=4 809 B22R3.41845756 Cn1ccc2cc(ccc2c1=O)SC3CCCCCC3 62a_100010246303_100011217769 [0,1,0,0,0,1|1,1,0]=4 810 B22R3.41845756 Cn1ccc2cc(ccc2c1=O)SC3CCCCCC3 62a_100011217769_100010246303 [0,1,0,0,0,1|1,1,0]=4 811 B22R3.71835321 O=C(c1ccc2c(=O)[nH]ccc2c1)C3CCCCCC3 1458a_200015497760_100011217769 [0,1,0,0,0,1|2,0,0]=4 812 B22R3.11158803 Cn1ccc2cc(ccc2c1=O)SC3CCCCC3F 62a_100010246303_100015423560 [0,2,0,0,0,0|1,1,0]=4 813 B22R3.11158803 Cn1ccc2cc(ccc2c1=O)SC3CCCCC3F 62a_100015423560_100010246303 [0,2,0,0,0,0|1,1,0]=4 814 B22R3.11158803 Cn1ccc2cc(ccc2c1=O)SC3CCCCC3O 62a_100000038908_100010246303 [0,2,0,0,0,0|1,1,0]=4 815 B22R3.11158803 Cn1ccc2cc(ccc2c1=O)SC3CCCCC3O 62a_100010246303_100000038908 [0,2,0,0,0,0|1,1,0]=4 816 B22R3.15323341 CC1CCC(CC1)Sc2ccc3c(=O)n(ccc3c2)C 62a_100010246303_200011216234 [0,2,0,0,0,0|1,1,0]=4 817 B22R3.15323341 CN1CCC(CC1)Sc2ccc3c(=O)n(ccc3c2)C 62a_100010246303_100011215917 [0,2,0,0,0,0|0,1,0]=3 818 B22R3.15323341 CN1CCC(CC1)Sc2ccc3c(c2)C=CC(=O)C3=O 62a_100009812793_100011215917 [0,2,0,0,0,0|1,1,0]=4 819 B22R3.1016943 CC1CCC(CC1)C(=O)c2ccc3c(=O)[nH]ccc3c2 1458a_200015497760_200011216234 [0,2,0,0,0,0|2,0,0]=4 820 B22R3.1016943 CN1CCN(CC1)C(=O)c2ccc3c(=O)[nH]ccc3c2 240690a_100000188432_200015497760 [0,2,0,0,0,0|2,0,0]=4 821 B22R3.1016943 CN1CCN(CC1)C(=O)c2ccc3c(=O)[nH]ccc3c2 527a_100000188432_200015497760 [0,2,0,0,0,0|2,0,0]=4 822 B22R3.607157 O=c1[nH]ccc2c1ccc(c2)OC3CCCCC3(F)F 34a_100009857879_200009832135 [0,2,0,0,0,0|1,0,0]=3 823 B22R3.11158801 Cc1cc2cc(ccc2c(=O)[nH]1)SC3CCCCC3F 62a_100015423560_100010883700 [0,2,0,0,0,0|1,1,0]=4 824 B22R3.11158801 Cc1cc2cc(ccc2c(=O)[nH]1)SC3CCCCC3O 62a_100000038908_100010883700 [0,2,0,0,0,0|1,1,0]=4 825 B22R3.15323339 CN1CCC(CC1)Nc2ccc3c(=O)[nH]c(=O)[nH]c3c2 27a_100000198570_100012351534 [0,2,0,0,0,0|2,0,0]=4 826 B22R3.15323339 Cc1nc2cc(ccc2c(=O)[nH]1)NC3CCN(CC3)C 27a_100000198570_100012357626 [0,2,0,0,0,0|2,0,0]=4 827 B22R3.284076 CCN1CCC(CC1)Nc2ccc3c(=O)[nH]cnc3c2 27a_100000199033_100000230960 [0,2,0,0,0,0|2,0,0]=4 828 B22R3.10411361 O=c1[nH]ccc2c1ccc(c2)OC3CCC(CC3)(F)F 34a_100009857879_100009865109 [0,2,0,0,0,0|1,0,0]=3 829 B22R3.10411361 O=c1[nH]ccc2c1ccc(c2)OC3CCC(CC3)(F)F 7a_100009857879_100009865109 [0,2,0,0,0,0|1,0,0]=3 830 B22R3.10411363 CC1CC(CCN1C)Nc2ccc3c(=O)[nH]cnc3c2 27a_200000760522_100000230960 [0,2,0,0,0,0|2,0,0]=4 831 B22R3.10411362 CC1(CC(CCO1)Oc2ccc3c(=O)[nH]ccc3c2)C 34a_100009857879_100010191092 [0,2,0,0,0,0|1,0,0]=3 832 B22R3.10411362 CC1(CC(CCO1)Oc2ccc3c(=O)[nH]ccc3c2)C 7a_100009857879_100010191092 [0,2,0,0,0,0|1,0,0]=3 833 B18R1.1107 C=CCC(=O)c1ccc(cc1)OCCCCCC 1458a_100000182910_100000210623 [0,0,2,0,0,0|2,0,0]=4 834 B20R3.40 c1c[nH]c(n1)c2ccc(cc2)OC3CCCCC3 271570a_100000733196_100025796157 [0,0,1,1,0,0|2,0,0]=4 835 B20R3.40 c1c[nH]c(n1)c2ccc(cc2)OC3CCCCC3 271570a_100016988920_200011235866 [0,0,1,1,0,0|2,0,0]=4 836 B20R3.40 c1c[nH]c(n1)c2ccc(cc2)OC3CCCCC3 34a_200000748570_100000210327 [0,0,1,1,0,0|2,0,0]=4 837 B20R3.40 c1c[nH]c(n1)c2ccc(cc2)OC3CCNCC3 271570a_100016988920_100011524410 [0,0,1,1,0,0|1,0,0]=3 838 B20R3.40 c1c[nH]c(n1)c2ccc(cc2)OC3CCOCC3 271570a_100016988920_100011356961 [0,0,1,1,0,0|2,0,0]=4 839 B20R3.40 c1c[nH]c(n1)c2ccc(cc2)OC3CCSCC3 34a_200000748570_100000069128 [0,0,1,1,0,0|2,0,0]=4 840 B20R3.40 c1coc(c1)c2ccc(cc2)OC3CCNCC3 271570a_100000750936_100011524410 [0,0,1,1,0,0|1,0,1]=4 841 B20R3.40 c1csc(c1)c2ccc(cc2)OC3CCNCC3 271570a_100000742291_100011524410 [0,0,1,1,0,0|1,1,0]=4 842 B20R3.2717 c1cc(cc(c1)c2cc[nH]c2)OC3CCCCC3 271570a_100000102155_200000701403 [0,0,1,1,0,0|2,0,0]=4 843 B20R3.2717 c1cc(cc(c1)c2cc[nH]c2)OC3CCNCC3 271570a_100000102155_100000701727 [0,0,1,1,0,0|1,0,0]=3 844 B20R3.2717 c1cc(cc(c1)c2cc[nH]n2)OC3CCNCC3 271570a_100000062414_100000701727 [0,0,1,1,0,0|2,0,0]=4 845 B20R3.2717 c1cc(cc(c1)c2ccco2)OC3CCNCC3 271570a_100000750936_100000701727 [0,0,1,1,0,0|1,0,1]=4 846 B20R3.2717 c1cc(cc(c1)c2cccs2)OC3CCNCC3 271570a_100000742291_100000701727 [0,0,1,1,0,0|1,1,0]=4 847 B20R3.2717 c1cc(cc(c1)c2ccoc2)OC3CCNCC3 271570a_100011218838_100000701727 [0,0,1,1,0,0|2,0,0]=4 848 B20R3.2717 c1cc(cc(c1)c2ccsc2)OC3CCNCC3 271570a_100011934443_100000701727 [0,0,1,1,0,0|2,0,0]=4 849 B20R3.2717 c1cc(cc(c1)c2cn[nH]c2)OC3CCNCC3 271570a_100000041997_100000701727 [0,0,1,1,0,0|2,0,0]=4 850 B20R3.2717 c1cc(cc(c1)c2cncs2)OC3CCNCC3 271570a_100010231675_100000701727 [0,0,1,1,0,0|0,1,1]=4 851 B20R3.2717 c1cc(nc(c1)c2cc[nH]c2)OC3CCNCC3 271570a_100000102155_100020638990 [0,0,1,1,0,0|2,0,0]=4 852 B20R3.247867 O=c1[nH]ccc2c1c(ccc2)OC3CCCCC3 34a_200010358299_100000210327 [0,0,1,1,0,0|1,0,0]=3 853 B20R3.247867 O=c1[nH]ccc2c1c(ccc2)OC3CCCCC3 7a_200010358299_100000210327 [0,0,1,1,0,0|1,0,0]=3 854 B20R3.247867 O=c1[nH]ccc2c1c(ccc2)OC3CCCOC3 34a_200010358299_100000693364 [0,0,1,1,0,0|2,0,0]=4 855 B20R3.247867 O=c1[nH]ccc2c1c(ccc2)OC3CCCOC3 7a_200010358299_100000693364 [0,0,1,1,0,0|2,0,0]=4 856 B20R3.247867 O=c1[nH]ccc2c1c(ccc2)OC3CCOCC3 7a_200010358299_100000686592 [0,0,1,1,0,0|1,0,0]=3 857 B20R3.247867 O=c1[nH]ccc2c1c(ccc2)OC3CCSCC3 34a_200010358299_100000069128 [0,0,1,1,0,0|1,0,0]=3 858 B20R3.247867 O=c1[nH]ccc2c1c(ccc2)OC3CCSCC3 7a_200010358299_100011500858 [0,0,1,1,0,0|1,0,0]=3 859 B20R3.173 O=c1ccc2c(cccc2[nH]1)SC3CCCCC3 62a_100000210327_100000726145 [0,0,1,1,0,0|1,1,0]=4 860 B20R3.250890 O=c1[nH]ccc2c1ccc(c2)OCC3CCCC3 34a_100009857879_100000740388 [0,0,1,1,0,0|1,0,0]=3 861 B20R3.250890 O=c1[nH]ccc2c1ccc(c2)OCC3CCCC3 7a_100009857879_100000740388 [0,0,1,1,0,0|1,0,0]=3 862 B20R3.250890 O=c1[nH]ccc2c1ccc(c2)OCC3CCCO3 7a_100009857879_100000203698 [0,0,1,1,0,0|2,0,0]=4 863 B20R3.250890 O=c1[nH]ccc2c1ccc(c2)OCC3CCOC3 34a_100009857879_100011261433 [0,0,1,1,0,0|1,0,0]=3 864 B20R3.250890 O=c1[nH]ccc2c1ccc(c2)OCC3CCOC3 7a_100009857879_100000702531 [0,0,1,1,0,0|1,0,0]=3 865 B20R3.4422919 O=c1[nH]ccc2c1ccc(c2)OCCCC3CO3 34a_100009857879_100000733510 [0,0,1,1,0,0|2,0,0]=4 866 B20R3.4422919 O=c1[nH]ccc2c1ccc(c2)OCCCC3CO3 7a_100009857879_100000733510 [0,0,1,1,0,0|2,0,0]=4 867 B22R4.12030709 O=c1[nH]ccc2c1ccc(c2)OC3C4CCC3CC4 34a_100009857879_100009813300 [0,0,0,1,0,1|1,0,0]=3 868 B22R4.86457931 O=c1[nH]ccc2c1ccc(c2)OC3CC4CCC3C4 34a_100009857879_100000727232 [0,1,0,1,0,0|1,0,0]=3 869 B18R2.228 C=CCC(=O)c1ccc(cc1)C2CCCCC2 1458a_100000185286_100000210623 [0,0,1,0,1,0|2,0,0]=4 870 B18R2.228 C=CCC(=O)c1ccc(cc1)C2CCOCC2 1458a_200010239727_100000210623 [0,0,1,0,1,0|2,0,0]=4 871 B18R2.8102 C=CCC(=O)c1ccc(cc1)OC2CCCC2 1458a_100000738054_100000210623 [0,0,1,0,1,0|1,0,0]=3 872 B18R2.8102 CCNC(=O)c1ccc(cc1)OC2CCCC2 11a_100015525214_100000738054 [0,0,1,0,1,0|0,0,2]=4 873 B18R2.8102 CCNC(=O)c1ccc(cc1)OC2CCCC2 240690a_100015525214_100000738054 [0,0,1,0,1,0|0,0,2]=4 874 B18R2.8102 CCNC(=O)c1ccc(cc1)OC2CCCC2 527a_100015525214_100000738054 [0,0,1,0,1,0|0,0,2]=4 875 B18R2.8102 CNNC(=O)c1ccc(cc1)OC2CCCC2 22a_100016993582_100000738054 [0,0,1,0,1,0|1,0,1]=4 876 B18R2.872541 CCCCCCOc1ccc2c(c1)CNC2=O 34a_100000098542_100000210314 [0,0,1,0,1,0|1,0,1]=4 877 B18R2.872541 CCCCCCSc1ccc2c(c1)C=CC2=O 62a_100000210314_100010210589 [0,0,1,0,1,0|1,1,0]=4 878 B18R2.872541 CCCCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000210757 [0,0,1,0,1,0|1,1,0]=4 879 B18R2.872541 CCOCCCOc1ccc2c(c1)CNC2=O 34a_100000098542_100012232248 [0,0,1,0,1,0|1,0,1]=4 880 B18R2.872541 CCOCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100012232248 [0,0,1,0,1,0|1,1,0]=4 881 B18R2.872541 CCOCCCSc1ccc2c(c1)C=CC2=O 62a_100012232248_100010210589 [0,0,1,0,1,0|1,1,0]=4 882 B18R2.891493 CCCCC(C)Oc1ccc2c(c1)CNC2=O 34a_100000098542_200011215066 [0,0,1,0,1,0|1,0,1]=4 883 B18R2.891493 CCCCC(C)Sc1ccc2c(c1)C=CC2=O 62a_100010210589_200011215066 [0,0,1,0,1,0|1,1,0]=4 884 B18R2.891493 CCCCC(C)Sc1ccc2c(c1)C=CC2=O 62a_200011215066_100010210589 [0,0,1,0,1,0|1,1,0]=4 885 B18R2.304625 CCCC(CC)Sc1ccc2c(c1)C=CC2=O 62a_100010210589_100011219200 [0,0,1,0,1,0|1,1,0]=4 886 B18R2.304625 CCCC(CC)Sc1ccc2c(c1)C=CC2=O 62a_100011219200_100010210589 [0,0,1,0,1,0|1,1,0]=4 887 B18R3.12792 c1cc2cc(ccc2[nH]1)OC3CCCCC3 34a_100000756620_100000210327 [1,0,0,0,1,0|1,0,0]=3 888 B18R3.12792 c1cc2cc(ccc2[nH]1)OC3CCCOC3 34a_100000756620_100000693364 [1,0,0,0,1,0|2,0,0]=4 889 B18R3.12792 c1cc2cc(ccc2[nH]1)OC3CCSCC3 34a_100000756620_100000069128 [1,0,0,0,1,0|1,0,0]=3 890 B18R3.12792 c1cc2cc(ccc2[nH]1)SC3CCCCC3 62a_100000210327_100000035808 [1,0,0,0,1,0|1,1,0]=4 891 B18R3.12792 c1cc2cc(ccc2o1)OC3CCCCC3 34a_100000070125_100000210327 [1,0,0,0,1,0|2,0,0]=4 892 B18R3.12792 c1cc2cc(ccc2o1)OC3CCCCC3 7a_100000070125_100000210327 [1,0,0,0,1,0|2,0,0]=4 893 B18R3.12792 c1cc2cc(ccc2o1)OC3CCOCC3 7a_100000070125_100000686592 [1,0,0,0,1,0|2,0,0]=4 894 B18R3.12792 c1cc2cc(ccc2o1)OC3CCSCC3 34a_100000070125_100000069128 [1,0,0,0,1,0|2,0,0]=4 895 B18R3.12792 c1cc2cc(ccc2o1)OC3CCSCC3 7a_100000070125_100011500858 [1,0,0,0,1,0|2,0,0]=4 896 B18R3.12792 c1cc2cc(ccc2s1)OC3CCCCC3 34a_100012180905_100000210327 [1,0,0,0,1,0|2,0,0]=4 897 B18R3.12792 c1cc2cc(ccc2s1)OC3CCCCC3 7a_100012180905_100000210327 [1,0,0,0,1,0|2,0,0]=4 898 B18R3.12792 c1cc2cc(ccc2s1)OC3CCOCC3 7a_100012180905_100000686592 [1,0,0,0,1,0|2,0,0]=4 899 B18R3.12792 c1cc2cc(ccc2s1)OC3CCSCC3 34a_100012180905_100000069128 [1,0,0,0,1,0|2,0,0]=4 900 B18R3.12792 c1cc2cc(ccc2s1)OC3CCSCC3 7a_100012180905_100011500858 [1,0,0,0,1,0|2,0,0]=4 901 B18R3.12792 c1cc2cc(cnc2[nH]1)OC3CCCCC3 34a_100000087691_100000210327 [1,0,0,0,1,0|2,0,0]=4 902 B18R3.12792 c1cc2cc(cnc2[nH]1)OC3CCSCC3 34a_100000087691_100000069128 [1,0,0,0,1,0|2,0,0]=4 903 B18R3.12792 c1cc2ccc(cc2[nH]1)OC3CCCCC3 34a_100000036713_100000210327 [1,0,0,0,1,0|2,0,0]=4 904 B18R3.12792 c1cc2ccc(cc2[nH]1)OC3CCSCC3 34a_100000036713_100000069128 [1,0,0,0,1,0|2,0,0]=4 905 B18R3.12792 c1cc2ccc(cc2o1)OC3CCCCC3 34a_100000089557_100000210327 [1,0,0,0,1,0|2,0,0]=4 906 B18R3.12792 c1cc2ccc(cc2o1)OC3CCCCC3 7a_100000089557_100000210327 [1,0,0,0,1,0|2,0,0]=4 907 B18R3.12792 c1cc2ccc(cc2o1)OC3CCOCC3 7a_100000089557_100000686592 [1,0,0,0,1,0|2,0,0]=4 908 B18R3.12792 c1cc2ccc(cc2o1)OC3CCSCC3 34a_100000089557_100000069128 [1,0,0,0,1,0|2,0,0]=4 909 B18R3.12792 c1cc2ccc(cc2o1)OC3CCSCC3 7a_100000089557_100011500858 [1,0,0,0,1,0|2,0,0]=4 910 B18R3.36580 c1cc2cc(ccc2cn1)NC3CCCC3 34a_100000039641_100000179811 [1,0,0,0,1,0|1,0,1]=4 911 B18R3.36580 c1cc2cc(ccc2cn1)OC3CCCC3 34a_100000046372_100000179811 [1,0,0,0,1,0|0,0,1]=3 912 B18R3.36580 c1cc2cc(ccc2cn1)OC3CCCC3 7a_100000046372_100000179811 [1,0,0,0,1,0|0,0,1]=3 913 B18R3.36580 c1cc2cc(ccc2cn1)OC3CCOC3 34a_100000046372_100000690089 [1,0,0,0,1,0|1,0,1]=4 914 B18R3.36580 c1cc2cc(ccc2cn1)OC3CCOC3 7a_100000046372_100000731011 [1,0,0,0,1,0|1,0,1]=4 915 B18R3.36580 c1cc2cc(ccc2cn1)SC3CCCC3 62a_100009816743_100000179811 [1,0,0,0,1,0|0,1,1]=4 916 B18R3.36580 c1cc2cc(ccc2cn1)SC3CCCC3 62a_100011217020_100009816743 [1,0,0,0,1,0|0,1,1]=4 917 B18R3.36580 c1cc2ccc(cc2cn1)OC3CCCC3 7a_100000752006_100000179811 [1,0,0,0,1,0|2,0,0]=4 918 B18R3.36580 c1ccc2cc(ccc2c1)NC3CCCC3 34a_100000211940_100000179811 [1,0,0,0,1,0|2,0,0]=4 919 B18R3.36580 c1ccc2cc(ccc2c1)NC3CCCC3 7a_100000211940_100000179811 [1,0,0,0,1,0|2,0,0]=4 920 B18R3.36580 c1ccc2cc(ccc2c1)OC3CCCC3 34a_100000185828_100000179811 [1,0,0,0,1,0|1,0,0]=3 921 B18R3.36580 c1ccc2cc(ccc2c1)OC3CCCC3 7a_100000185828_100000179811 [1,0,0,0,1,0|1,0,0]=3 922 B18R3.36580 c1ccc2cc(ccc2c1)OC3CCOC3 34a_100000185828_100000690089 [1,0,0,0,1,0|2,0,0]=4 923 B18R3.36580 c1ccc2cc(ccc2c1)OC3CCOC3 7a_100000185828_100000731011 [1,0,0,0,1,0|2,0,0]=4 924 B18R3.36580 c1ccc2cc(ccc2c1)SC3CCCC3 62a_100011217020_100000233703 [1,0,0,0,1,0|1,1,0]=4 925 B18R3.36580 c1ccc2ncc(cc2c1)OC3CCCC3 34a_100011934006_100000179811 [1,0,0,0,1,0|2,0,0]=4 926 B18R3.36580 c1ccc2ncc(cc2c1)OC3CCCC3 7a_100011934006_100000179811 [1,0,0,0,1,0|2,0,0]=4 927 B18R3.36580 c1cnc2cc(ccc2c1)OC3CCCC3 34a_100011216045_100000179811 [1,0,0,0,1,0|2,0,0]=4 928 B18R3.36580 c1cnc2ccc(cc2c1)OC3CCCC3 34a_100011215586_100000179811 [1,0,0,0,1,0|2,0,0]=4 929 B18R3.36580 c1cnc2ccc(cc2c1)OC3CCCC3 7a_100011215586_100000179811 [1,0,0,0,1,0|2,0,0]=4 930 B18R3.4180 O=C1C=Cc2c1ccc(c2)C3=CCNCC3 271570a_100000731432_100010210589 [0,0,0,0,2,0|0,0,2]=4 931 B18R3.53157 O=C1C=Cc2c1ccc(c2)C=C3CCCC3 271570a_100010378317_100010210589 [0,0,0,0,2,0|1,0,1]=4 932 B18R3.53157 O=C1C=Cc2c1ccc(c2)SC3CCCC3 62a_100010210589_100000179811 [0,0,0,0,2,0|0,1,0]=3 933 B18R3.53157 O=C1C=Cc2c1ccc(c2)SC3CCCC3 62a_100011217020_100010210589 [0,0,0,0,2,0|0,1,0]=3 934 B18R3.53157 O=C1C=Cc2c1ccc(c2)SC3CCOC3 62a_100010210589_100000690089 [0,0,0,0,2,0|1,1,0]=4 935 B18R3.53157 O=C1CCc2c1ccc(c2)OC3CCCC3 34a_100000708912_100000179811 [0,0,0,0,2,0|0,0,2]=4 936 B18R3.53157 O=C1CCc2c1ccc(c2)OC3CCCC3 7a_100000708912_100000179811 [0,0,0,0,2,0|0,0,2]=4 937 B18R3.53157 O=C1NCc2c1ccc(c2)OC3CCCC3 34a_100000098542_100000179811 [0,0,0,0,2,0|0,0,1]=3 938 B18R3.53157 O=C1NCc2c1ccc(c2)OC3CCOC3 34a_100000098542_100000690089 [0,0,0,0,2,0|1,0,1]=4 939 B18R3.53157 O=C1NCc2c1ccc(c2)SC3CCCC3 62a_100000692135_100000179811 [0,0,0,0,2,0|0,1,1]=4 940 B18R3.53157 O=C1NCc2c1ccc(c2)SC3CCCC3 62a_100011217020_100000692135 [0,0,0,0,2,0|0,1,1]=4 941 B18R3.53157 O=C1OCc2c1ccc(c2)OC3CCCC3 7a_100000044543_100000179811 [0,0,0,0,2,0|1,0,1]=4 942 B18R3.53157 O=c1[nH][nH]c2c1ccc(c2)SC3CCCC3 62a_100011217020_100012353722 [0,0,0,0,2,0|1,1,0]=4 943 B18R3.5872 O=c1[nH]cnc2c1ccc(c2)N3CCCC3 27a_100000188435_100000230960 [0,0,0,0,2,0|2,0,0]=4 944 B18R3.89316 Clc1nccc2c1ccc(c2)OC3CCC3 34a_100009867704_100000749161 [0,0,0,0,2,0|1,0,1]=4 945 B18R3.89316 Nc1cccc2c1ccc(c2)OC3CCC3 34a_100000034668_100000749161 [0,0,0,0,2,0|2,0,0]=4 946 B18R3.89316 O=C1NCCc2c1ccc(c2)OC3CCC3 34a_100000087030_100000749161 [0,0,0,0,2,0|0,0,2]=4 947 B18R3.89316 O=c1[nH]ccc2c1ccc(c2)OC3CCC3 34a_100009857879_100000749161 [0,0,0,0,2,0|0,0,0]=2 948 B18R3.89316 O=c1[nH]ccc2c1ccc(c2)OC3COC3 34a_100009857879_100009818527 [0,0,0,0,2,0|1,0,0]=3 949 B18R3.89316 O=c1[nH]ccc2c1ccc(c2)OC3COC3 7a_100009857879_100009818527 [0,0,0,0,2,0|1,0,0]=3 950 B18R3.89316 O=c1[nH]ccc2c1cnc(c2)SC3CCC3 62a_100010134373_100000749161 [0,0,0,0,2,0|1,1,0]=4 951 B18R3.89316 O=c1[nH]cnc2c1ccc(c2)NC3CCC3 27a_100000749019_100000230960 [0,0,0,0,2,0|2,0,0]=4 952 B18R3.89316 O=c1ccoc2c1ccc(c2)OC3CCC3 34a_200000065989_100000749161 [0,0,0,0,2,0|2,0,0]=4 953 B20R2.392 C=CCC(=O)Nc1ccc(cc1)OC2CCCCC2 11a_100000756656_100000210193 [0,0,1,0,0,1|2,0,0]=4 954 B20R2.392 C=CCC(=O)Nc1ccc(cc1)OC2CCCCC2 1626a_100000756656_100000210193 [0,0,1,0,0,1|2,0,0]=4 955 B20R2.392 C=CCC(=O)Nc1ccc(cc1)OC2CCCCC2 22a_100000756656_100000210193 [0,0,1,0,0,1|2,0,0]=4 956 B20R2.392 C=CCC(=O)Nc1ccc(cc1)OC2CCCCC2 527a_100000756656_100000210193 [0,0,1,0,0,1|2,0,0]=4 957 B20R2.13615 C=CCC(=O)c1ccc(cc1)OCC2CCCCC2 1458a_100015207027_100000210623 [0,0,1,0,0,1|2,0,0]=4 958 B20R3.30190 c1cc2cc(ccc2cn1)COC3CCCCC3 34a_100000210231_100020605334 [1,0,0,0,0,1|1,0,1]=4 959 B20R3.30190 c1cc2cc(ccc2cn1)COC3CCCCC3 7a_100000210231_100020605334 [1,0,0,0,0,1|1,0,1]=4 960 B20R3.30190 c1cc2cc(ccc2cn1)COC3CCOCC3 34a_100000744328_100020605334 [1,0,0,0,0,1|1,0,1]=4 961 B20R3.30190 c1cc2cc(ccc2cn1)COC3CCSCC3 34a_100000731022_100020605334 [1,0,0,0,0,1|1,0,1]=4 962 B20R3.30190 c1cc2cc(ccc2cn1)COC3CCSCC3 7a_100000731022_100020605334 [1,0,0,0,0,1|1,0,1]=4 963 B20R3.30190 c1cc2cc(ccc2cn1)OCC3CCCCC3 34a_100000046372_100000211423 [1,0,0,0,0,1|1,0,1]=4 964 B20R3.30190 c1cc2cc(ccc2cn1)OCC3CCCCC3 7a_100000046372_100000211423 [1,0,0,0,0,1|1,0,1]=4 965 B20R3.30190 c1cc2cc(ccc2cn1)OCC3CCOCC3 34a_100000046372_100000754603 [1,0,0,0,0,1|1,0,1]=4 966 B20R3.30190 c1cc2cc(ccc2cn1)OCC3CCOCC3 7a_100000046372_100000754603 [1,0,0,0,0,1|1,0,1]=4 967 B20R3.30190 c1ccc2cc(ccc2c1)CNC3CCNCC3 270004a_100000739491_100015192401 [1,0,0,0,0,1|2,0,0]=4 968 B20R3.30190 c1ccc2cc(ccc2c1)COC3CCCCC3 34a_100000210231_100011216711 [1,0,0,0,0,1|2,0,0]=4 969 B20R3.30190 c1ccc2cc(ccc2c1)COC3CCCCC3 34a_100011215330_100000210327 [1,0,0,0,0,1|2,0,0]=4 970 B20R3.30190 c1ccc2cc(ccc2c1)COC3CCCCC3 7a_100000210231_100011216711 [1,0,0,0,0,1|2,0,0]=4 971 B20R3.30190 c1ccc2cc(ccc2c1)COC3CCCCC3 7a_100011215330_100000210327 [1,0,0,0,0,1|2,0,0]=4 972 B20R3.30190 c1ccc2cc(ccc2c1)COC3CCOCC3 34a_100000744328_100011216711 [1,0,0,0,0,1|2,0,0]=4 973 B20R3.30190 c1ccc2cc(ccc2c1)COC3CCOCC3 7a_100011215330_100000686592 [1,0,0,0,0,1|2,0,0]=4 974 B20R3.30190 c1ccc2cc(ccc2c1)COC3CCSCC3 34a_100000731022_100011216711 [1,0,0,0,0,1|2,0,0]=4 975 B20R3.30190 c1ccc2cc(ccc2c1)COC3CCSCC3 34a_100011215330_100000069128 [1,0,0,0,0,1|2,0,0]=4 976 B20R3.30190 c1ccc2cc(ccc2c1)COC3CCSCC3 7a_100000731022_100011216711 [1,0,0,0,0,1|2,0,0]=4 977 B20R3.30190 c1ccc2cc(ccc2c1)COC3CCSCC3 7a_100011215330_100011500858 [1,0,0,0,0,1|2,0,0]=4 978 B20R3.30190 c1ccc2cc(ccc2c1)OCC3CCCCC3 34a_100000185828_100000211423 [1,0,0,0,0,1|2,0,0]=4 979 B20R3.30190 c1ccc2cc(ccc2c1)OCC3CCCCC3 7a_100000185828_100000211423 [1,0,0,0,0,1|2,0,0]=4 980 B20R3.30190 c1ccc2cc(ccc2c1)OCC3CCOCC3 34a_100000185828_100000754603 [1,0,0,0,0,1|2,0,0]=4 981 B20R3.30190 c1ccc2cc(ccc2c1)OCC3CCOCC3 7a_100000185828_100000754603 [1,0,0,0,0,1|2,0,0]=4 982 B20R3.1869517 c1cc2cc(ccc2cn1)OC3CCCCCC3 34a_100000046372_100011217769 [1,0,0,0,0,1|1,0,1]=4 983 B20R3.1869517 c1ccc2cc(ccc2c1)OC3CCCCCC3 34a_100000185828_100011217769 [1,0,0,0,0,1|2,0,0]=4 984 B20R3.145858 O=C1C=Cc2c1ccc(c2)C=CC3CCCCC3 271570a_100016283615_100010210589 [0,0,0,0,1,1|2,0,0]=4 985 B20R3.145858 O=C1C=Cc2c1ccc(c2)SCC3CCCCC3 62a_100000211423_100010210589 [0,0,0,0,1,1|1,1,0]=4 986 B20R3.145858 O=C1C=Cc2c1ccc(c2)SCC3CCCCC3 62a_100010210589_100000211423 [0,0,0,0,1,1|1,1,0]=4 987 B20R3.145858 O=C1C=Cc2c1ccc(c2)SCC3CCOCC3 62a_100000754603_100010210589 [0,0,0,0,1,1|1,1,0]=4 988 B20R3.145858 O=C1C=Cc2c1ccc(c2)SCC3CCOCC3 62a_100010210589_100000749018 [0,0,0,0,1,1|1,1,0]=4 989 B20R3.145858 O=C1NCc2c1ccc(c2)OCC3CCCCC3 34a_100000098542_100000211423 [0,0,0,0,1,1|1,0,1]=4 990 B20R3.145858 O=C1NCc2c1ccc(c2)OCC3CCOCC3 34a_100000098542_100000754603 [0,0,0,0,1,1|1,0,1]=4 991 B20R3.3324873 O=C1C=Cc2c1ccc(c2)SC3CCCCCC3 62a_100010210589_100011217769 [0,0,0,0,1,1|1,1,0]=4 992 B20R3.3324873 O=C1C=Cc2c1ccc(c2)SC3CCCCCC3 62a_100011217769_100010210589 [0,0,0,0,1,1|1,1,0]=4 993 B20R3.3324873 O=C1NCc2c1ccc(c2)OC3CCCCCC3 34a_100000098542_100011217769 [0,0,0,0,1,1|1,0,1]=4 994 B20R3.12173 O=c1[nH]ccc2c1cccc2SC3CCCCC3 62a_100000210327_100000703947 [0,0,0,0,1,1|1,1,0]=4 995 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCCC3CCCCC3 34a_100009857879_100011209188 [0,0,0,0,0,2|1,0,0]=3 996 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCCC3CCCCC3 7a_100009857879_100011273959 [0,0,0,0,0,2|1,0,0]=3 997 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCCC3CCOCC3 34a_100009857879_100011934994 [0,0,0,0,0,2|1,0,0]=3 998 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCCC3CCOCC3 7a_100009857879_100011934994 [0,0,0,0,0,2|1,0,0]=3 999 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCCN3CCCCC3 34a_100009857879_100000739454 [0,0,0,0,0,2|2,0,0]=4 1000 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCCN3CCCCC3 7a_100009857879_100000739454 [0,0,0,0,0,2|2,0,0]=4 1001 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCCN3CCOCC3 7a_100009857879_100000211760 [0,0,0,0,0,2|2,0,0]=4 1002 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCOC3CCCCC3 34a_100009857879_100011935260 [0,0,0,0,0,2|1,0,0]=3 1003 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCOC3CCCCC3 7a_100009857879_100011935260 [0,0,0,0,0,2|1,0,0]=3 1004 B22R3.607737 O=c1[nH]ccc2c1cnc(c2)SCOC3CCCCC3 62a_100010134373_100011935260 [0,0,0,0,0,2|2,0,0]=4 1005 B22R3.607737 O=c1[nH]cnc2c1ccc(c2)SCOC3CCCCC3 62a_100011935260_100000230960 [0,0,0,0,0,2|2,0,0]=4 1006 B22R3.10406684 O=c1[nH]ccc2c1ccc(c2)OCC3CCCCCC3 34a_100009857879_200000696569 [0,0,0,0,0,2|1,0,0]=3 1007 B22R3.10406684 O=c1[nH]ccc2c1ccc(c2)OCC3CCCCCC3 7a_100009857879_200000696569 [0,0,0,0,0,2|1,0,0]=3 1008 B22R3.10406710 O=c1[nH]ccc2c1ccc(c2)OC3CC/C=C\CCC3 34a_100009857879_100021000466 [0,0,0,0,0,2|1,0,0]=3 1009 B22R3.10406710 O=c1[nH]ccc2c1ccc(c2)OC3CC/C=C\CCC3 7a_100009857879_100021000466 [0,0,0,0,0,2|1,0,0]=3