0 B23R3.1974194 C(=C(c1ccccc1)c2ccccc2)CN3CCCOC3 270004a_100000131196_100000050448 [0,0,0,0,0,0|1,0,2]=3 1 B23R3.1974194 C(=C(c1ccccc1)c2ccccc2)CN3CCOCC3 270004a_100015191051_100000050448 [0,0,0,0,0,0|1,0,2]=3 2 B23R3.1974194 C(=C(c1ccccc1)c2ccccc2)CN3CCSCC3 270004a_100000737611_100000050448 [0,0,0,0,0,0|1,0,2]=3 3 B23R3.1974194 C1=C(CSCC1)CNC(c2ccccc2)c3ccccc3 270004a_100000162943_100000707794 [0,0,0,0,0,0|3,0,1]=4 4 B23R3.1974194 C1=CC(CCC1)NCC(c2ccccc2)c3ccccc3 2230a_100000739227_100000751183 [0,0,0,0,0,0|2,0,2]=4 5 B23R3.1974194 C1=CC(CCC1)OCC(c2ccccc2)c3ccccc3 7a_100011215272_100000751183 [0,0,0,0,0,0|2,0,2]=4 6 B23R3.1974194 C1=CCC(CC1)CNC(c2ccccc2)c3ccccc3 270004a_100000162943_100000189434 [0,0,0,0,0,0|2,0,2]=4 7 B23R3.1974194 C1=CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000698166_100000050448 [0,0,0,0,0,0|0,0,4]=4 8 B23R3.1974194 C1=CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000698166_100009813428 [0,0,0,0,0,0|0,0,2]=2 9 B23R3.1974194 C1=CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000698166_100009813428 [0,0,0,0,0,0|0,0,2]=2 10 B23R3.1974194 C1=CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100000698166_100009813428 [0,0,0,0,0,0|0,0,2]=2 11 B23R3.1974194 C1=CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000698166_100010140906 [0,0,0,0,0,0|1,0,2]=3 12 B23R3.1974194 C1=CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000698166_100010140906 [0,0,0,0,0,0|1,0,2]=3 13 B23R3.1974194 c1ccc(cc1)C(CCN2CCCOC2)c3ccccc3 2230a_100000131196_100009813428 [0,0,0,0,0,0|1,0,0]=1 14 B23R3.1974194 c1ccc(cc1)C(CCN2CCCOC2)c3ccccc3 269982a_100000131196_100009813428 [0,0,0,0,0,0|1,0,0]=1 15 B23R3.1974194 c1ccc(cc1)C(CCN2CCCOC2)c3ccccc3 34a_100000131196_100009813428 [0,0,0,0,0,0|1,0,0]=1 16 B23R3.1974194 c1ccc(cc1)C(CCN2CCOCC2)c3ccccc3 2230a_100015191051_100009813428 [0,0,0,0,0,0|1,0,0]=1 17 B23R3.1974194 c1ccc(cc1)C(CCN2CCOCC2)c3ccccc3 269982a_100015191051_100009813428 [0,0,0,0,0,0|1,0,0]=1 18 B23R3.1974194 c1ccc(cc1)C(CCN2CCOCC2)c3ccccc3 34a_100015191051_100009813428 [0,0,0,0,0,0|1,0,0]=1 19 B23R3.1974194 c1ccc(cc1)C(CCN2CCSCC2)c3ccccc3 2230a_100000737611_100009813428 [0,0,0,0,0,0|1,0,0]=1 20 B23R3.1974194 c1ccc(cc1)C(CCN2CCSCC2)c3ccccc3 269982a_100000737611_100009813428 [0,0,0,0,0,0|1,0,0]=1 21 B23R3.1974194 c1ccc(cc1)C(CNC2CCCCC2)c3ccccc3 270004a_100000739227_100000210434 [0,0,0,0,0,0|2,0,0]=2 22 B23R3.1974194 c1ccc(cc1)C(CNC2CCCCC2)c3ccccc3 34a_100000739227_100000210327 [0,0,0,0,0,0|2,0,0]=2 23 B23R3.1974194 c1ccc(cc1)C(CNC2CCCOC2)c3ccccc3 270004a_100000739227_100000753404 [0,0,0,0,0,0|3,0,0]=3 24 B23R3.1974194 c1ccc(cc1)C(CNC2CCCOC2)c3ccccc3 34a_100000739227_100000693364 [0,0,0,0,0,0|3,0,0]=3 25 B23R3.1974194 c1ccc(cc1)C(CNC2CCCSC2)c3ccccc3 270004a_100000739227_100000057913 [0,0,0,0,0,0|3,0,0]=3 26 B23R3.1974194 c1ccc(cc1)C(CNC2CCNCC2)c3ccccc3 270004a_100000739227_100015192401 [0,0,0,0,0,0|3,0,0]=3 27 B23R3.1974194 c1ccc(cc1)C(CNC2CCOCC2)c3ccccc3 270004a_100000739227_100011217826 [0,0,0,0,0,0|3,0,0]=3 28 B23R3.1974194 c1ccc(cc1)C(CNC2CCSCC2)c3ccccc3 270004a_100000739227_100000203788 [0,0,0,0,0,0|3,0,0]=3 29 B23R3.1974194 c1ccc(cc1)C(CNC2CCSCC2)c3ccccc3 34a_100000739227_100000069128 [0,0,0,0,0,0|3,0,0]=3 30 B23R3.1974194 c1ccc(cc1)C(COC2CCCCC2)c3ccccc3 34a_100011215272_100000210327 [0,0,0,0,0,0|2,0,0]=2 31 B23R3.1974194 c1ccc(cc1)C(COC2CCCCC2)c3ccccc3 7a_100011215272_100000210327 [0,0,0,0,0,0|2,0,0]=2 32 B23R3.1974194 c1ccc(cc1)C(COC2CCCOC2)c3ccccc3 34a_100011215272_100000693364 [0,0,0,0,0,0|3,0,0]=3 33 B23R3.1974194 c1ccc(cc1)C(COC2CCCOC2)c3ccccc3 7a_100011215272_100000693364 [0,0,0,0,0,0|3,0,0]=3 34 B23R3.1974194 c1ccc(cc1)C(COC2CCOCC2)c3ccccc3 7a_100011215272_100000686592 [0,0,0,0,0,0|3,0,0]=3 35 B23R3.1974194 c1ccc(cc1)C(COC2CCSCC2)c3ccccc3 34a_100011215272_100000069128 [0,0,0,0,0,0|3,0,0]=3 36 B23R3.1974194 c1ccc(cc1)C(COC2CCSCC2)c3ccccc3 7a_100011215272_100011500858 [0,0,0,0,0,0|3,0,0]=3 37 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000162943_100000211423 [0,0,0,0,0,0|2,0,0]=2 38 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000210473_100000211591 [0,0,0,0,0,0|2,0,0]=2 39 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 269862a_100000162943_100000211278 [0,0,0,0,0,0|2,0,0]=2 40 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000210122 [0,0,0,0,0,0|2,0,0]=2 41 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100000162943_100000211423 [0,0,0,0,0,0|2,0,0]=2 42 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccccn3 2230a_100000689936_100000211423 [0,0,0,0,0,0|3,0,0]=3 43 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccccn3 269862a_100000689936_100000211278 [0,0,0,0,0,0|3,0,0]=3 44 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccccn3 270004a_100000210473_100000210380 [0,0,0,0,0,0|3,0,0]=3 45 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3cccnc3 2230a_100011232609_100000211423 [0,0,0,0,0,0|3,0,0]=3 46 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3cccnc3 270004a_100000210473_100000735413 [0,0,0,0,0,0|3,0,0]=3 47 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccncc3 2230a_100025760769_100000211423 [0,0,0,0,0,0|3,0,0]=3 48 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccncc3 269862a_100025760769_100000211278 [0,0,0,0,0,0|3,0,0]=3 49 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 2230a_100000162943_100000211543 [0,0,0,0,0,0|3,0,0]=3 50 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 2230a_100000174945_100000211591 [0,0,0,0,0,0|3,0,0]=3 51 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100000210122 [0,0,0,0,0,0|3,0,0]=3 52 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 34a_100000162943_100000211543 [0,0,0,0,0,0|3,0,0]=3 53 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCO2)c3ccccn3 2230a_100000689936_100000211543 [0,0,0,0,0,0|4,0,0]=4 54 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCO2)c3ccccn3 270004a_100000174945_100000210380 [0,0,0,0,0,0|4,0,0]=4 55 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCO2)c3cccnc3 2230a_100011232609_100000211543 [0,0,0,0,0,0|4,0,0]=4 56 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCO2)c3cccnc3 270004a_100000174945_100000735413 [0,0,0,0,0,0|4,0,0]=4 57 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCO2)c3ccncc3 2230a_100025760769_100000211543 [0,0,0,0,0,0|4,0,0]=4 58 B23R3.1974194 c1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 2230a_100000162943_100000741521 [0,0,0,0,0,0|3,0,0]=3 59 B23R3.1974194 c1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 2230a_100000720124_100000211591 [0,0,0,0,0,0|3,0,0]=3 60 B23R3.1974194 c1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100000210122 [0,0,0,0,0,0|3,0,0]=3 61 B23R3.1974194 c1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 34a_100000162943_100000741521 [0,0,0,0,0,0|3,0,0]=3 62 B23R3.1974194 c1ccc(cc1)C(NCC2CCCOC2)c3ccccn3 2230a_100000689936_100000741521 [0,0,0,0,0,0|4,0,0]=4 63 B23R3.1974194 c1ccc(cc1)C(NCC2CCCOC2)c3ccccn3 270004a_100000720124_100000210380 [0,0,0,0,0,0|4,0,0]=4 64 B23R3.1974194 c1ccc(cc1)C(NCC2CCCOC2)c3cccnc3 2230a_100011232609_100000741521 [0,0,0,0,0,0|4,0,0]=4 65 B23R3.1974194 c1ccc(cc1)C(NCC2CCCOC2)c3cccnc3 270004a_100000720124_100000735413 [0,0,0,0,0,0|4,0,0]=4 66 B23R3.1974194 c1ccc(cc1)C(NCC2CCCOC2)c3ccncc3 2230a_100025760769_100000741521 [0,0,0,0,0,0|4,0,0]=4 67 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 2230a_100000162943_100000754603 [0,0,0,0,0,0|3,0,0]=3 68 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 2230a_100000746373_100000211591 [0,0,0,0,0,0|3,0,0]=3 69 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 269862a_100000162943_100000749017 [0,0,0,0,0,0|3,0,0]=3 70 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100000210122 [0,0,0,0,0,0|3,0,0]=3 71 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 34a_100000162943_100000754603 [0,0,0,0,0,0|3,0,0]=3 72 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3ccccn3 2230a_100000689936_100000754603 [0,0,0,0,0,0|4,0,0]=4 73 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3ccccn3 269862a_100000689936_100000749017 [0,0,0,0,0,0|4,0,0]=4 74 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3ccccn3 270004a_100000746373_100000210380 [0,0,0,0,0,0|4,0,0]=4 75 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3cccnc3 2230a_100011232609_100000754603 [0,0,0,0,0,0|4,0,0]=4 76 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3cccnc3 270004a_100000746373_100000735413 [0,0,0,0,0,0|4,0,0]=4 77 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3ccncc3 2230a_100025760769_100000754603 [0,0,0,0,0,0|4,0,0]=4 78 B23R3.1974194 c1ccc(cc1)C(NCC2CCOCC2)c3ccncc3 269862a_100025760769_100000749017 [0,0,0,0,0,0|4,0,0]=4 79 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 2230a_100015188806_100000211591 [0,0,0,0,0,0|3,0,0]=3 80 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 269862a_100000162943_100000067145 [0,0,0,0,0,0|3,0,0]=3 81 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100000162943_100000067145 [0,0,0,0,0,0|3,0,0]=3 82 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100000210122 [0,0,0,0,0,0|3,0,0]=3 83 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3ccccn3 269862a_100000689936_100000067145 [0,0,0,0,0,0|4,0,0]=4 84 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3ccccn3 270004a_100000689936_100000067145 [0,0,0,0,0,0|4,0,0]=4 85 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3ccccn3 270004a_100015188806_100000210380 [0,0,0,0,0,0|4,0,0]=4 86 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3cccnc3 270004a_100011232609_100000067145 [0,0,0,0,0,0|4,0,0]=4 87 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3cccnc3 270004a_100015188806_100000735413 [0,0,0,0,0,0|4,0,0]=4 88 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3ccncc3 269862a_100025760769_100000067145 [0,0,0,0,0,0|4,0,0]=4 89 B23R3.1974194 c1ccc(cc1)C(NCC2CCSCC2)c3ccncc3 270004a_100025760769_100000067145 [0,0,0,0,0,0|4,0,0]=4 90 B23R3.1974194 c1ccc(cc1)C(NC[C@H]2COCCO2)c3ccccc3 2230a_100010981119_100000211591 [0,0,0,0,0,0|4,0,0]=4 91 B23R3.1974194 c1ccc(cc1)C(NC[C@H]2COCCO2)c3ccccc3 270004a_100010981119_100000210122 [0,0,0,0,0,0|4,0,0]=4 92 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 34a_100000211180_100000211423 [0,0,0,0,0,0|2,0,0]=2 93 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_100000211180_100000211423 [0,0,0,0,0,0|2,0,0]=2 94 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_100000212181_100011216954 [0,0,0,0,0,0|2,0,0]=2 95 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCC2)c3ccccn3 7a_100000180852_100000211423 [0,0,0,0,0,0|3,0,0]=3 96 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 34a_100000211180_100000211543 [0,0,0,0,0,0|3,0,0]=3 97 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_100000211180_100000211543 [0,0,0,0,0,0|3,0,0]=3 98 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_100000211370_100011216954 [0,0,0,0,0,0|3,0,0]=3 99 B23R3.1974194 c1ccc(cc1)C(OCC2CCCCO2)c3ccccn3 7a_100000180852_100000211543 [0,0,0,0,0,0|4,0,0]=4 100 B23R3.1974194 c1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 34a_100000211180_100000741521 [0,0,0,0,0,0|3,0,0]=3 101 B23R3.1974194 c1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 7a_100000211180_100000741521 [0,0,0,0,0,0|3,0,0]=3 102 B23R3.1974194 c1ccc(cc1)C(OCC2CCCOC2)c3ccccn3 7a_100000180852_100000741521 [0,0,0,0,0,0|4,0,0]=4 103 B23R3.1974194 c1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 34a_100000211180_100000754603 [0,0,0,0,0,0|3,0,0]=3 104 B23R3.1974194 c1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 7a_100000211180_100000754603 [0,0,0,0,0,0|3,0,0]=3 105 B23R3.1974194 c1ccc(cc1)C(OCC2CCOCC2)c3ccccn3 7a_100000180852_100000754603 [0,0,0,0,0,0|4,0,0]=4 106 B23R3.1974194 c1ccc(cc1)C(OCC2CCSCC2)c3ccccc3 7a_100000070558_100011216954 [0,0,0,0,0,0|3,0,0]=3 107 B23R3.1974194 c1ccc(cc1)C(SCC2CCCCO2)c3ccccc3 62a_100000211543_100011216954 [0,0,0,0,0,0|3,0,0]=3 108 B23R3.1974194 c1ccc(cc1)C(SCC2CCCCO2)c3ccccc3 62a_100000211591_100000211543 [0,0,0,0,0,0|3,0,0]=3 109 B23R3.1974194 c1ccc(cc1)C(SCC2CCCOC2)c3ccccc3 62a_100000211591_100000741521 [0,0,0,0,0,0|3,0,0]=3 110 B23R3.1974194 c1ccc(cc1)C(SCC2CCCOC2)c3ccccc3 62a_100000741521_100011216954 [0,0,0,0,0,0|3,0,0]=3 111 B23R3.1974194 c1ccc(cc1)C(SCC2CCOCC2)c3ccccc3 62a_100000211591_100000749018 [0,0,0,0,0,0|3,0,0]=3 112 B23R3.1974194 c1ccc(cc1)C(SCC2CCOCC2)c3ccccc3 62a_100000754603_100011216954 [0,0,0,0,0,0|3,0,0]=3 113 B23R3.1974194 c1ccc(cc1)[S+](CCN2CCCOC2)c3ccccc3 2230a_100000131196_100010140906 [0,0,0,0,0,0|2,0,0]=2 114 B23R3.1974194 c1ccc(cc1)[S+](CCN2CCCOC2)c3ccccc3 269982a_100000131196_100010140906 [0,0,0,0,0,0|2,0,0]=2 115 B23R3.1974194 c1ccc(cc1)[S+](CCN2CCOCC2)c3ccccc3 2230a_100015191051_100010140906 [0,0,0,0,0,0|2,0,0]=2 116 B23R3.1974194 c1ccc(cc1)[S+](CCN2CCOCC2)c3ccccc3 269982a_100015191051_100010140906 [0,0,0,0,0,0|2,0,0]=2 117 B23R3.1974194 c1ccc(cc1)[S+](CCN2CCSCC2)c3ccccc3 2230a_100000737611_100010140906 [0,0,0,0,0,0|2,0,0]=2 118 B23R3.1974194 c1ccc(cc1)[S+](CCN2CCSCC2)c3ccccc3 269982a_100000737611_100010140906 [0,0,0,0,0,0|2,0,0]=2 119 B23R3.1974194 c1ccc(nc1)C(NCC2CCCCC2)c3ccccn3 269862a_100009954364_100000211278 [0,0,0,0,0,0|4,0,0]=4 120 B23R3.1974194 c1ccc(nc1)C(NCC2CCCCC2)c3cccnc3 270004a_100000210473_100011376182 [0,0,0,0,0,0|4,0,0]=4 121 B23R3.1974194 c1cncc(c1)C(NCC2CCCCC2)c3cccnc3 270004a_100000210473_200011376183 [0,0,0,0,0,0|4,0,0]=4 122 B24R3.6559 CC(CC(c1ccccc1)c2ccccc2)N3CC=CCC3 270004a_100000698166_200000011111 [0,1,0,0,0,0|0,0,2]=3 123 B24R3.6559 CC(CC(c1ccccc1)c2ccccc2)N3CCCOC3 270004a_100000131196_200000011111 [0,1,0,0,0,0|1,0,0]=2 124 B24R3.6559 CC(CC(c1ccccc1)c2ccccc2)N3CCOCC3 270004a_100015191051_200000011111 [0,1,0,0,0,0|1,0,0]=2 125 B24R3.6559 CC(CC(c1ccccc1)c2ccccc2)N3CCSCC3 270004a_100000737611_200000011111 [0,1,0,0,0,0|1,0,0]=2 126 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3=CCCCC3 2230a_200015185932_100000211591 [0,1,0,0,0,0|2,0,1]=4 127 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3=CCCCC3 270004a_200015185932_100000210122 [0,1,0,0,0,0|2,0,1]=4 128 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3CCCCC3 269862a_100000162943_100000210989 [0,1,0,0,0,0|2,0,0]=3 129 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3CCCCN3 269862a_100000162943_200011997754 [0,1,0,0,0,0|3,0,0]=4 130 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3CCCNC3 269862a_100000162943_100011320585 [0,1,0,0,0,0|3,0,0]=4 131 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3CCNCC3 269862a_100000162943_100015204191 [0,1,0,0,0,0|3,0,0]=4 132 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3CCOCC3 269862a_100000162943_100000759496 [0,1,0,0,0,0|3,0,0]=4 133 B24R3.6559 CC(NC(c1ccccc1)c2ccccn2)C3CCCCC3 269862a_100000689936_100000210989 [0,1,0,0,0,0|3,0,0]=4 134 B24R3.6559 CC(NC(c1ccccc1)c2ccncc2)C3CCCCC3 269862a_100025760769_100000210989 [0,1,0,0,0,0|3,0,0]=4 135 B24R3.6559 CC(OC(c1ccccc1)c2ccccc2)C3CCCCC3 7a_100011216961_100011216954 [0,1,0,0,0,0|2,0,0]=3 136 B24R3.6559 C[C@@H](NC(c1ccccc1)c2ccccc2)C3CCCCC3 2230a_100025707633_100000211591 [0,1,0,0,0,0|2,0,0]=3 137 B24R3.6559 C[C@@H](NC(c1ccccc1)c2ccccc2)C3CCCCC3 270004a_100025707633_100000210122 [0,1,0,0,0,0|2,0,0]=3 138 B24R3.6559 C[C@@H](NC(c1ccccc1)c2ccccn2)C3CCCCC3 270004a_100025707633_100000210380 [0,1,0,0,0,0|3,0,0]=4 139 B24R3.6559 C[C@@H](NC(c1ccccc1)c2cccnc2)C3CCCCC3 270004a_100025707633_100000735413 [0,1,0,0,0,0|3,0,0]=4 140 B24R3.6559 C[C@@H](OC(c1ccccc1)c2ccccc2)C3CCOCC3 7a_100000703848_100011216954 [0,1,0,0,0,0|3,0,0]=4 141 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100000499737_100000210327 [0,1,0,0,0,0|1,0,1]=3 142 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)C3CCCOC3 1458a_100000499737_100000693364 [0,1,0,0,0,0|2,0,1]=4 143 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)C3CCOCC3 1458a_100000499737_100011324220 [0,1,0,0,0,0|2,0,1]=4 144 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CC=CCC3 11a_100000698166_100000499737 [0,1,0,0,0,0|0,0,3]=4 145 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CC=CCC3 1626a_100000698166_100000499737 [0,1,0,0,0,0|0,0,3]=4 146 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CC=CCC3 240690a_100000698166_100000499737 [0,1,0,0,0,0|0,0,3]=4 147 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CC=CCC3 527a_100000698166_100000499737 [0,1,0,0,0,0|0,0,3]=4 148 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CCCOC3 11a_100000131196_100000499737 [0,1,0,0,0,0|1,0,1]=3 149 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CCCOC3 240690a_100000131196_100000499737 [0,1,0,0,0,0|1,0,1]=3 150 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CCOCC3 11a_100015191051_100000499737 [0,1,0,0,0,0|1,0,1]=3 151 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CCOCC3 1626a_100015191051_100000499737 [0,1,0,0,0,0|1,0,1]=3 152 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CCOCC3 240690a_100015191051_100000499737 [0,1,0,0,0,0|1,0,1]=3 153 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CCOCC3 527a_100015191051_100000499737 [0,1,0,0,0,0|1,0,1]=3 154 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CCSCC3 11a_100000737611_100000499737 [0,1,0,0,0,0|1,0,1]=3 155 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CCSCC3 240690a_100000737611_100000499737 [0,1,0,0,0,0|1,0,1]=3 156 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CCSCC3 527a_100000737611_100000499737 [0,1,0,0,0,0|1,0,1]=3 157 B24R3.6559 O=C(CP(c1ccccc1)c2ccccc2)C3CCCCC3 1458a_200020607205_100000210327 [0,1,0,0,0,0|2,0,1]=4 158 B24R3.6559 O=C(CP(c1ccccc1)c2ccccc2)N3CCCOC3 11a_100000131196_200020607205 [0,1,0,0,0,0|2,0,1]=4 159 B24R3.6559 O=C(CP(c1ccccc1)c2ccccc2)N3CCCOC3 240690a_100000131196_200020607205 [0,1,0,0,0,0|2,0,1]=4 160 B24R3.6559 O=C(CP(c1ccccc1)c2ccccc2)N3CCOCC3 11a_100015191051_200020607205 [0,1,0,0,0,0|2,0,1]=4 161 B24R3.6559 O=C(CP(c1ccccc1)c2ccccc2)N3CCOCC3 1626a_100015191051_200020607205 [0,1,0,0,0,0|2,0,1]=4 162 B24R3.6559 O=C(CP(c1ccccc1)c2ccccc2)N3CCOCC3 240690a_100015191051_200020607205 [0,1,0,0,0,0|2,0,1]=4 163 B24R3.6559 O=C(CP(c1ccccc1)c2ccccc2)N3CCOCC3 527a_100015191051_200020607205 [0,1,0,0,0,0|2,0,1]=4 164 B24R3.6559 O=C(CP(c1ccccc1)c2ccccc2)N3CCSCC3 11a_100000737611_200020607205 [0,1,0,0,0,0|2,0,1]=4 165 B24R3.6559 O=C(CP(c1ccccc1)c2ccccc2)N3CCSCC3 240690a_100000737611_200020607205 [0,1,0,0,0,0|2,0,1]=4 166 B24R3.6559 O=C(CP(c1ccccc1)c2ccccc2)N3CCSCC3 527a_100000737611_200020607205 [0,1,0,0,0,0|2,0,1]=4 167 B24R3.6559 O=C(NC(c1ccccc1)c2ccccc2)C3CCCCC3 11a_100000162943_100000210647 [0,1,0,0,0,0|2,0,1]=4 168 B24R3.6559 O=C(NC(c1ccccc1)c2ccccc2)C3CCCCC3 1626a_100000162943_100000210647 [0,1,0,0,0,0|2,0,1]=4 169 B24R3.6559 O=C(NC(c1ccccc1)c2ccccc2)C3CCCCC3 240690a_100000162943_100000210647 [0,1,0,0,0,0|2,0,1]=4 170 B24R3.6559 O=C(NC(c1ccccc1)c2ccccc2)C3CCCCC3 527a_100000162943_100000210647 [0,1,0,0,0,0|2,0,1]=4 171 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 2230a_100011212009_100000211423 [0,1,0,0,0,0|2,0,0]=3 172 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 269862a_100011212009_100000211278 [0,1,0,0,0,0|2,0,0]=3 173 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011267660 [0,1,0,0,0,0|2,0,0]=3 174 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 34a_100011212009_100000211423 [0,1,0,0,0,0|2,0,0]=3 175 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 2230a_100011212009_100000211543 [0,1,0,0,0,0|3,0,0]=4 176 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100011267660 [0,1,0,0,0,0|3,0,0]=4 177 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 34a_100011212009_100000211543 [0,1,0,0,0,0|3,0,0]=4 178 B24R3.21177 Brc1cccc(c1)C(NCC2CCCOC2)c3ccccc3 2230a_100011212009_100000741521 [0,1,0,0,0,0|3,0,0]=4 179 B24R3.21177 Brc1cccc(c1)C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100011267660 [0,1,0,0,0,0|3,0,0]=4 180 B24R3.21177 Brc1cccc(c1)C(NCC2CCCOC2)c3ccccc3 34a_100011212009_100000741521 [0,1,0,0,0,0|3,0,0]=4 181 B24R3.21177 Brc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 2230a_100011212009_100000754603 [0,1,0,0,0,0|3,0,0]=4 182 B24R3.21177 Brc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 269862a_100011212009_100000749017 [0,1,0,0,0,0|3,0,0]=4 183 B24R3.21177 Brc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100011267660 [0,1,0,0,0,0|3,0,0]=4 184 B24R3.21177 Brc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 34a_100011212009_100000754603 [0,1,0,0,0,0|3,0,0]=4 185 B24R3.21177 Brc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 269862a_100011212009_100000067145 [0,1,0,0,0,0|3,0,0]=4 186 B24R3.21177 Brc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100011212009_100000067145 [0,1,0,0,0,0|3,0,0]=4 187 B24R3.21177 Brc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100011267660 [0,1,0,0,0,0|3,0,0]=4 188 B24R3.21177 Brc1cncc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011267668 [0,1,0,0,0,0|3,0,0]=4 189 B24R3.21177 Cc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011217825 [0,1,0,0,0,0|2,0,0]=3 190 B24R3.21177 Cc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100011217825 [0,1,0,0,0,0|3,0,0]=4 191 B24R3.21177 Cc1cccc(c1)C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100011217825 [0,1,0,0,0,0|3,0,0]=4 192 B24R3.21177 Cc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100011217825 [0,1,0,0,0,0|3,0,0]=4 193 B24R3.21177 Cc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100011217825 [0,1,0,0,0,0|3,0,0]=4 194 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 2230a_100000741085_100000211423 [0,1,0,0,0,0|2,0,0]=3 195 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 269862a_100000741085_100000211278 [0,1,0,0,0,0|2,0,0]=3 196 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011215489 [0,1,0,0,0,0|2,0,0]=3 197 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 34a_100000741085_100000211423 [0,1,0,0,0,0|2,0,0]=3 198 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3ccccn3 270004a_100000210473_100000688346 [0,1,0,0,0,0|3,0,0]=4 199 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3cccnc3 270004a_100000210473_100000752423 [0,1,0,0,0,0|3,0,0]=4 200 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 2230a_100000741085_100000211543 [0,1,0,0,0,0|3,0,0]=4 201 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100011215489 [0,1,0,0,0,0|3,0,0]=4 202 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 34a_100000741085_100000211543 [0,1,0,0,0,0|3,0,0]=4 203 B24R3.21177 Clc1cccc(c1)C(NCC2CCCOC2)c3ccccc3 2230a_100000741085_100000741521 [0,1,0,0,0,0|3,0,0]=4 204 B24R3.21177 Clc1cccc(c1)C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100011215489 [0,1,0,0,0,0|3,0,0]=4 205 B24R3.21177 Clc1cccc(c1)C(NCC2CCCOC2)c3ccccc3 34a_100000741085_100000741521 [0,1,0,0,0,0|3,0,0]=4 206 B24R3.21177 Clc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 2230a_100000741085_100000754603 [0,1,0,0,0,0|3,0,0]=4 207 B24R3.21177 Clc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 269862a_100000741085_100000749017 [0,1,0,0,0,0|3,0,0]=4 208 B24R3.21177 Clc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100011215489 [0,1,0,0,0,0|3,0,0]=4 209 B24R3.21177 Clc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 34a_100000741085_100000754603 [0,1,0,0,0,0|3,0,0]=4 210 B24R3.21177 Clc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 269862a_100000741085_100000067145 [0,1,0,0,0,0|3,0,0]=4 211 B24R3.21177 Clc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100000741085_100000067145 [0,1,0,0,0,0|3,0,0]=4 212 B24R3.21177 Clc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100011215489 [0,1,0,0,0,0|3,0,0]=4 213 B24R3.21177 Clc1cccc(c1)C(OCC2CCCCO2)c3ccccc3 34a_100000733576_100000211543 [0,1,0,0,0,0|3,0,0]=4 214 B24R3.21177 Clc1cccc(c1)C(OCC2CCCCO2)c3ccccc3 7a_100000733576_100000211543 [0,1,0,0,0,0|3,0,0]=4 215 B24R3.21177 Clc1cccc(c1)C(OCC2CCCOC2)c3ccccc3 34a_100000733576_100000741521 [0,1,0,0,0,0|3,0,0]=4 216 B24R3.21177 Clc1cccc(c1)C(OCC2CCCOC2)c3ccccc3 7a_100000733576_100000741521 [0,1,0,0,0,0|3,0,0]=4 217 B24R3.21177 Clc1cccc(c1)C(OCC2CCOCC2)c3ccccc3 34a_100000733576_100000754603 [0,1,0,0,0,0|3,0,0]=4 218 B24R3.21177 Clc1cccc(c1)C(OCC2CCOCC2)c3ccccc3 7a_100000733576_100000754603 [0,1,0,0,0,0|3,0,0]=4 219 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 2230a_100000686443_100000211423 [0,1,0,0,0,0|2,0,0]=3 220 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 269862a_100000686443_100000211278 [0,1,0,0,0,0|2,0,0]=3 221 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_200011219850 [0,1,0,0,0,0|2,0,0]=3 222 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 34a_100000686443_100000211423 [0,1,0,0,0,0|2,0,0]=3 223 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 2230a_100000686443_100000211543 [0,1,0,0,0,0|3,0,0]=4 224 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_200011219850 [0,1,0,0,0,0|3,0,0]=4 225 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 34a_100000686443_100000211543 [0,1,0,0,0,0|3,0,0]=4 226 B24R3.21177 Fc1cccc(c1)C(NCC2CCCOC2)c3ccccc3 2230a_100000686443_100000741521 [0,1,0,0,0,0|3,0,0]=4 227 B24R3.21177 Fc1cccc(c1)C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_200011219850 [0,1,0,0,0,0|3,0,0]=4 228 B24R3.21177 Fc1cccc(c1)C(NCC2CCCOC2)c3ccccc3 34a_100000686443_100000741521 [0,1,0,0,0,0|3,0,0]=4 229 B24R3.21177 Fc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 2230a_100000686443_100000754603 [0,1,0,0,0,0|3,0,0]=4 230 B24R3.21177 Fc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 269862a_100000686443_100000749017 [0,1,0,0,0,0|3,0,0]=4 231 B24R3.21177 Fc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_200011219850 [0,1,0,0,0,0|3,0,0]=4 232 B24R3.21177 Fc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 34a_100000686443_100000754603 [0,1,0,0,0,0|3,0,0]=4 233 B24R3.21177 Fc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 269862a_100000686443_100000067145 [0,1,0,0,0,0|3,0,0]=4 234 B24R3.21177 Fc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100000686443_100000067145 [0,1,0,0,0,0|3,0,0]=4 235 B24R3.21177 Fc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_200011219850 [0,1,0,0,0,0|3,0,0]=4 236 B24R3.21177 Fc1cccc(c1)C(OCC2CCCCC2)c3ccccc3 34a_100000749007_100000211423 [0,1,0,0,0,0|2,0,0]=3 237 B24R3.21177 Fc1cccc(c1)C(OCC2CCCCC2)c3ccccc3 7a_100000749007_100000211423 [0,1,0,0,0,0|2,0,0]=3 238 B24R3.21177 Fc1cccc(c1)C(OCC2CCCCO2)c3ccccc3 34a_100000749007_100000211543 [0,1,0,0,0,0|3,0,0]=4 239 B24R3.21177 Fc1cccc(c1)C(OCC2CCCCO2)c3ccccc3 7a_100000749007_100000211543 [0,1,0,0,0,0|3,0,0]=4 240 B24R3.21177 Fc1cccc(c1)C(OCC2CCCOC2)c3ccccc3 34a_100000749007_100000741521 [0,1,0,0,0,0|3,0,0]=4 241 B24R3.21177 Fc1cccc(c1)C(OCC2CCCOC2)c3ccccc3 7a_100000749007_100000741521 [0,1,0,0,0,0|3,0,0]=4 242 B24R3.21177 Fc1cccc(c1)C(OCC2CCOCC2)c3ccccc3 34a_100000749007_100000754603 [0,1,0,0,0,0|3,0,0]=4 243 B24R3.21177 Fc1cccc(c1)C(OCC2CCOCC2)c3ccccc3 7a_100000749007_100000754603 [0,1,0,0,0,0|3,0,0]=4 244 B24R3.21837 Brc1ccccc1C(NCC2CCCCC2)c3ccccc3 2230a_100011211563_100000211423 [0,1,0,0,0,0|2,0,0]=3 245 B24R3.21837 Brc1ccccc1C(NCC2CCCCC2)c3ccccc3 269862a_100011211563_100000211278 [0,1,0,0,0,0|2,0,0]=3 246 B24R3.21837 Brc1ccccc1C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000198044 [0,1,0,0,0,0|2,0,0]=3 247 B24R3.21837 Brc1ccccc1C(NCC2CCCCC2)c3ccccc3 34a_100011211563_100000211423 [0,1,0,0,0,0|2,0,0]=3 248 B24R3.21837 Brc1ccccc1C(NCC2CCCCC2)c3cccnc3 270004a_100000210473_100011532686 [0,1,0,0,0,0|3,0,0]=4 249 B24R3.21837 Brc1ccccc1C(NCC2CCCCO2)c3ccccc3 2230a_100011211563_100000211543 [0,1,0,0,0,0|3,0,0]=4 250 B24R3.21837 Brc1ccccc1C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100000198044 [0,1,0,0,0,0|3,0,0]=4 251 B24R3.21837 Brc1ccccc1C(NCC2CCCCO2)c3ccccc3 34a_100011211563_100000211543 [0,1,0,0,0,0|3,0,0]=4 252 B24R3.21837 Brc1ccccc1C(NCC2CCCOC2)c3ccccc3 2230a_100011211563_100000741521 [0,1,0,0,0,0|3,0,0]=4 253 B24R3.21837 Brc1ccccc1C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100000198044 [0,1,0,0,0,0|3,0,0]=4 254 B24R3.21837 Brc1ccccc1C(NCC2CCCOC2)c3ccccc3 34a_100011211563_100000741521 [0,1,0,0,0,0|3,0,0]=4 255 B24R3.21837 Brc1ccccc1C(NCC2CCOCC2)c3ccccc3 2230a_100011211563_100000754603 [0,1,0,0,0,0|3,0,0]=4 256 B24R3.21837 Brc1ccccc1C(NCC2CCOCC2)c3ccccc3 269862a_100011211563_100000749017 [0,1,0,0,0,0|3,0,0]=4 257 B24R3.21837 Brc1ccccc1C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100000198044 [0,1,0,0,0,0|3,0,0]=4 258 B24R3.21837 Brc1ccccc1C(NCC2CCOCC2)c3ccccc3 34a_100011211563_100000754603 [0,1,0,0,0,0|3,0,0]=4 259 B24R3.21837 Brc1ccccc1C(NCC2CCSCC2)c3ccccc3 269862a_100011211563_100000067145 [0,1,0,0,0,0|3,0,0]=4 260 B24R3.21837 Brc1ccccc1C(NCC2CCSCC2)c3ccccc3 270004a_100011211563_100000067145 [0,1,0,0,0,0|3,0,0]=4 261 B24R3.21837 Brc1ccccc1C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100000198044 [0,1,0,0,0,0|3,0,0]=4 262 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccccc3 2230a_100000210473_100000230135 [0,1,0,0,0,0|2,0,0]=3 263 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccccc3 2230a_100000222801_100000211423 [0,1,0,0,0,0|2,0,0]=3 264 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccccc3 269862a_100000222801_100000211278 [0,1,0,0,0,0|2,0,0]=3 265 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000735561 [0,1,0,0,0,0|2,0,0]=3 266 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccccc3 34a_100000222801_100000211423 [0,1,0,0,0,0|2,0,0]=3 267 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccncc3 2230a_100015184055_100000211423 [0,1,0,0,0,0|3,0,0]=4 268 B24R3.21837 Cc1ccccc1C(NCC2CCCCC2)c3ccncc3 269862a_100015184055_100000211278 [0,1,0,0,0,0|3,0,0]=4 269 B24R3.21837 Cc1ccccc1C(NCC2CCCCO2)c3ccccc3 2230a_100000174945_100000230135 [0,1,0,0,0,0|3,0,0]=4 270 B24R3.21837 Cc1ccccc1C(NCC2CCCCO2)c3ccccc3 2230a_100000222801_100000211543 [0,1,0,0,0,0|3,0,0]=4 271 B24R3.21837 Cc1ccccc1C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100000735561 [0,1,0,0,0,0|3,0,0]=4 272 B24R3.21837 Cc1ccccc1C(NCC2CCCCO2)c3ccccc3 34a_100000222801_100000211543 [0,1,0,0,0,0|3,0,0]=4 273 B24R3.21837 Cc1ccccc1C(NCC2CCCOC2)c3ccccc3 2230a_100000222801_100000741521 [0,1,0,0,0,0|3,0,0]=4 274 B24R3.21837 Cc1ccccc1C(NCC2CCCOC2)c3ccccc3 2230a_100000720124_100000230135 [0,1,0,0,0,0|3,0,0]=4 275 B24R3.21837 Cc1ccccc1C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100000735561 [0,1,0,0,0,0|3,0,0]=4 276 B24R3.21837 Cc1ccccc1C(NCC2CCCOC2)c3ccccc3 34a_100000222801_100000741521 [0,1,0,0,0,0|3,0,0]=4 277 B24R3.21837 Cc1ccccc1C(NCC2CCOCC2)c3ccccc3 2230a_100000222801_100000754603 [0,1,0,0,0,0|3,0,0]=4 278 B24R3.21837 Cc1ccccc1C(NCC2CCOCC2)c3ccccc3 2230a_100000746373_100000230135 [0,1,0,0,0,0|3,0,0]=4 279 B24R3.21837 Cc1ccccc1C(NCC2CCOCC2)c3ccccc3 269862a_100000222801_100000749017 [0,1,0,0,0,0|3,0,0]=4 280 B24R3.21837 Cc1ccccc1C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100000735561 [0,1,0,0,0,0|3,0,0]=4 281 B24R3.21837 Cc1ccccc1C(NCC2CCOCC2)c3ccccc3 34a_100000222801_100000754603 [0,1,0,0,0,0|3,0,0]=4 282 B24R3.21837 Cc1ccccc1C(NCC2CCSCC2)c3ccccc3 2230a_100015188806_100000230135 [0,1,0,0,0,0|3,0,0]=4 283 B24R3.21837 Cc1ccccc1C(NCC2CCSCC2)c3ccccc3 269862a_100000222801_100000067145 [0,1,0,0,0,0|3,0,0]=4 284 B24R3.21837 Cc1ccccc1C(NCC2CCSCC2)c3ccccc3 270004a_100000222801_100000067145 [0,1,0,0,0,0|3,0,0]=4 285 B24R3.21837 Cc1ccccc1C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100000735561 [0,1,0,0,0,0|3,0,0]=4 286 B24R3.21837 Cc1ccccc1C(OCC2CCCCC2)c3ccccc3 34a_100000212071_100000211423 [0,1,0,0,0,0|2,0,0]=3 287 B24R3.21837 Cc1ccccc1C(OCC2CCCCC2)c3ccccc3 7a_100000212071_100000211423 [0,1,0,0,0,0|2,0,0]=3 288 B24R3.21837 Cc1ccccc1C(OCC2CCCCC2)c3ccccc3 7a_100000212181_100000230135 [0,1,0,0,0,0|2,0,0]=3 289 B24R3.21837 Cc1ccccc1C(OCC2CCCCO2)c3ccccc3 34a_100000212071_100000211543 [0,1,0,0,0,0|3,0,0]=4 290 B24R3.21837 Cc1ccccc1C(OCC2CCCCO2)c3ccccc3 7a_100000211370_100000230135 [0,1,0,0,0,0|3,0,0]=4 291 B24R3.21837 Cc1ccccc1C(OCC2CCCCO2)c3ccccc3 7a_100000212071_100000211543 [0,1,0,0,0,0|3,0,0]=4 292 B24R3.21837 Cc1ccccc1C(OCC2CCCOC2)c3ccccc3 34a_100000212071_100000741521 [0,1,0,0,0,0|3,0,0]=4 293 B24R3.21837 Cc1ccccc1C(OCC2CCCOC2)c3ccccc3 7a_100000212071_100000741521 [0,1,0,0,0,0|3,0,0]=4 294 B24R3.21837 Cc1ccccc1C(OCC2CCOCC2)c3ccccc3 34a_100000212071_100000754603 [0,1,0,0,0,0|3,0,0]=4 295 B24R3.21837 Cc1ccccc1C(OCC2CCOCC2)c3ccccc3 7a_100000212071_100000754603 [0,1,0,0,0,0|3,0,0]=4 296 B24R3.21837 Cc1ccccc1C(OCC2CCSCC2)c3ccccc3 7a_100000070558_100000230135 [0,1,0,0,0,0|3,0,0]=4 297 B24R3.21837 Cc1ccccc1C(SCC2CCCCO2)c3ccccc3 62a_100000211543_100000230135 [0,1,0,0,0,0|3,0,0]=4 298 B24R3.21837 Cc1ccccc1C(SCC2CCCCO2)c3ccccc3 62a_100000230135_100000211543 [0,1,0,0,0,0|3,0,0]=4 299 B24R3.21837 Cc1ccccc1C(SCC2CCCOC2)c3ccccc3 62a_100000230135_100000741521 [0,1,0,0,0,0|3,0,0]=4 300 B24R3.21837 Cc1ccccc1C(SCC2CCCOC2)c3ccccc3 62a_100000741521_100000230135 [0,1,0,0,0,0|3,0,0]=4 301 B24R3.21837 Cc1ccccc1C(SCC2CCOCC2)c3ccccc3 62a_100000230135_100000749018 [0,1,0,0,0,0|3,0,0]=4 302 B24R3.21837 Cc1ccccc1C(SCC2CCOCC2)c3ccccc3 62a_100000754603_100000230135 [0,1,0,0,0,0|3,0,0]=4 303 B24R3.21837 Clc1ccccc1C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011215288 [0,1,0,0,0,0|2,0,0]=3 304 B24R3.21837 Clc1ccccc1C(NCC2CCCCC2)c3ccccn3 270004a_100000210473_100011400554 [0,1,0,0,0,0|3,0,0]=4 305 B24R3.21837 Clc1ccccc1C(NCC2CCCCC2)c3cccnc3 270004a_100000210473_200011400555 [0,1,0,0,0,0|3,0,0]=4 306 B24R3.21837 Clc1ccccc1C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100011215288 [0,1,0,0,0,0|3,0,0]=4 307 B24R3.21837 Clc1ccccc1C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100011215288 [0,1,0,0,0,0|3,0,0]=4 308 B24R3.21837 Clc1ccccc1C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100011215288 [0,1,0,0,0,0|3,0,0]=4 309 B24R3.21837 Clc1ccccc1C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100011215288 [0,1,0,0,0,0|3,0,0]=4 310 B24R3.21837 Clc1ccccc1C(OCC2CCCCO2)c3ccccc3 34a_200011400577_100000211543 [0,1,0,0,0,0|3,0,0]=4 311 B24R3.21837 Clc1ccccc1C(OCC2CCCCO2)c3ccccc3 7a_200011400577_100000211543 [0,1,0,0,0,0|3,0,0]=4 312 B24R3.21837 Clc1ccccc1C(OCC2CCCOC2)c3ccccc3 34a_200011400577_100000741521 [0,1,0,0,0,0|3,0,0]=4 313 B24R3.21837 Clc1ccccc1C(OCC2CCCOC2)c3ccccc3 7a_200011400577_100000741521 [0,1,0,0,0,0|3,0,0]=4 314 B24R3.21837 Clc1ccccc1C(OCC2CCOCC2)c3ccccc3 34a_200011400577_100000754603 [0,1,0,0,0,0|3,0,0]=4 315 B24R3.21837 Clc1ccccc1C(OCC2CCOCC2)c3ccccc3 7a_200011400577_100000754603 [0,1,0,0,0,0|3,0,0]=4 316 B24R3.21837 Fc1ccccc1C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011217773 [0,1,0,0,0,0|2,0,0]=3 317 B24R3.21837 Fc1ccccc1C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100011217773 [0,1,0,0,0,0|3,0,0]=4 318 B24R3.21837 Fc1ccccc1C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100011217773 [0,1,0,0,0,0|3,0,0]=4 319 B24R3.21837 Fc1ccccc1C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100011217773 [0,1,0,0,0,0|3,0,0]=4 320 B24R3.21837 Fc1ccccc1C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100011217773 [0,1,0,0,0,0|3,0,0]=4 321 B24R3.21837 Nc1ccccc1C(OCC2CCCCC2)c3ccccc3 34a_100000246470_100000211423 [0,1,0,0,0,0|2,0,0]=3 322 B24R3.21837 Nc1ccccc1C(OCC2CCCCC2)c3ccccc3 7a_100000246470_100000211423 [0,1,0,0,0,0|2,0,0]=3 323 B24R3.21837 Nc1ccccc1C(OCC2CCCCO2)c3ccccc3 34a_100000246470_100000211543 [0,1,0,0,0,0|3,0,0]=4 324 B24R3.21837 Nc1ccccc1C(OCC2CCCCO2)c3ccccc3 7a_100000246470_100000211543 [0,1,0,0,0,0|3,0,0]=4 325 B24R3.21837 Nc1ccccc1C(OCC2CCCOC2)c3ccccc3 34a_100000246470_100000741521 [0,1,0,0,0,0|3,0,0]=4 326 B24R3.21837 Nc1ccccc1C(OCC2CCCOC2)c3ccccc3 7a_100000246470_100000741521 [0,1,0,0,0,0|3,0,0]=4 327 B24R3.21837 Nc1ccccc1C(OCC2CCOCC2)c3ccccc3 34a_100000246470_100000754603 [0,1,0,0,0,0|3,0,0]=4 328 B24R3.21837 Nc1ccccc1C(OCC2CCOCC2)c3ccccc3 7a_100000246470_100000754603 [0,1,0,0,0,0|3,0,0]=4 329 B24R3.35684 CC1CCCCC1NCC(c2ccccc2)c3ccccc3 269862a_100000739227_100000210921 [0,1,0,0,0,0|2,0,0]=3 330 B24R3.35684 CC1CCCCC1NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000210921 [0,1,0,0,0,0|2,0,0]=3 331 B24R3.35684 CC1CCCCN1CC=C(c2ccccc2)c3ccccc3 270004a_100000211376_100000050448 [0,1,0,0,0,0|0,0,2]=3 332 B24R3.35684 CC1CCCCN1CCC(c2ccccc2)c3ccccc3 2230a_100000211376_100009813428 [0,1,0,0,0,0|0,0,0]=1 333 B24R3.35684 CC1CCCCN1CCC(c2ccccc2)c3ccccc3 269982a_100000211376_100009813428 [0,1,0,0,0,0|0,0,0]=1 334 B24R3.35684 CC1CCCCN1CCC(c2ccccc2)c3ccccc3 34a_100000211376_100009813428 [0,1,0,0,0,0|0,0,0]=1 335 B24R3.35684 CC1CCCCN1CC[S+](c2ccccc2)c3ccccc3 2230a_100000211376_100010140906 [0,1,0,0,0,0|1,0,0]=2 336 B24R3.35684 CC1CCCCN1CC[S+](c2ccccc2)c3ccccc3 269982a_100000211376_100010140906 [0,1,0,0,0,0|1,0,0]=2 337 B24R3.35684 CC1CNCCC1NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000703950 [0,1,0,0,0,0|3,0,0]=4 338 B24R3.35684 CC1COCCC1NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000755695 [0,1,0,0,0,0|3,0,0]=4 339 B24R3.35684 CN1CCCCC1CNC(c2ccccc2)c3ccccc3 270004a_100011228421_100000210122 [0,1,0,0,0,0|3,0,0]=4 340 B24R3.35684 CN1CCCCC1CNC(c2ccccc2)c3ccccc3 34a_100000162943_100015186950 [0,1,0,0,0,0|3,0,0]=4 341 B24R3.35684 CN1CCCCC1COC(c2ccccc2)c3ccccc3 34a_100000211180_100015186950 [0,1,0,0,0,0|3,0,0]=4 342 B24R3.35684 CN1CCCCC1COC(c2ccccc2)c3ccccc3 7a_100000211180_100015185383 [0,1,0,0,0,0|3,0,0]=4 343 B24R3.35684 CN1CCCCC1CSC(c2ccccc2)c3ccccc3 62a_100000211591_100015185383 [0,1,0,0,0,0|3,0,0]=4 344 B24R3.35684 CN1CCCCC1CSC(c2ccccc2)c3ccccc3 62a_100015185383_100011216954 [0,1,0,0,0,0|3,0,0]=4 345 B24R3.35684 C[C@H]1COCCN1CC=C(c2ccccc2)c3ccccc3 270004a_100009815349_100000050448 [0,1,0,0,0,0|1,0,2]=4 346 B24R3.35684 C[C@H]1COCCN1CCC(c2ccccc2)c3ccccc3 2230a_100009815349_100009813428 [0,1,0,0,0,0|1,0,0]=2 347 B24R3.35684 C[C@H]1COCCN1CCC(c2ccccc2)c3ccccc3 269982a_100009815349_100009813428 [0,1,0,0,0,0|1,0,0]=2 348 B24R3.35684 C[C@H]1COCCN1CCC(c2ccccc2)c3ccccc3 34a_100009815349_100009813428 [0,1,0,0,0,0|1,0,0]=2 349 B24R3.35684 C[C@H]1COCCN1CC[S+](c2ccccc2)c3ccccc3 2230a_100009815349_100010140906 [0,1,0,0,0,0|2,0,0]=3 350 B24R3.35684 C[C@H]1COCCN1CC[S+](c2ccccc2)c3ccccc3 269982a_100009815349_100010140906 [0,1,0,0,0,0|2,0,0]=3 351 B24R3.35684 FC1CCCCC1NCC(c2ccccc2)c3ccccc3 34a_100000739227_100015423560 [0,1,0,0,0,0|2,0,0]=3 352 B24R3.35684 FC1CCCCC1OCC(c2ccccc2)c3ccccc3 34a_100011215272_100015423560 [0,1,0,0,0,0|2,0,0]=3 353 B24R3.35684 O=C1CCCCC1COC(c2ccccc2)c3ccccc3 7a_100009861125_100011216954 [0,1,0,0,0,0|2,0,1]=4 354 B24R3.35684 O=C1CCCCC1NCC(c2ccccc2)c3ccccc3 34a_100000739227_100000754470 [0,1,0,0,0,0|2,0,1]=4 355 B24R3.35684 O=C1CCCCC1OCC(c2ccccc2)c3ccccc3 34a_100011215272_100000754470 [0,1,0,0,0,0|2,0,1]=4 356 B24R3.35684 O=C1CCCCC1OCC(c2ccccc2)c3ccccc3 7a_100011215272_100000204591 [0,1,0,0,0,0|2,0,1]=4 357 B24R3.35684 OC1CCCCC1CNC(c2ccccc2)c3ccccc3 270004a_100011216029_100000210122 [0,1,0,0,0,0|2,0,0]=3 358 B24R3.35684 OC1CCCCC1CNC(c2ccccc2)c3ccccn3 270004a_100011216029_100000210380 [0,1,0,0,0,0|3,0,0]=4 359 B24R3.35684 OC1CCCCC1CNC(c2ccccc2)c3cccnc3 270004a_100011216029_100000735413 [0,1,0,0,0,0|3,0,0]=4 360 B24R3.35684 OC1CCCCC1NCC(c2ccccc2)c3ccccc3 34a_100000739227_100000038908 [0,1,0,0,0,0|2,0,0]=3 361 B24R3.35684 OC1CCCCC1OCC(c2ccccc2)c3ccccc3 34a_100011215272_100000038908 [0,1,0,0,0,0|2,0,0]=3 362 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100000736448_100000211591 [0,1,0,0,0,0|2,0,0]=3 363 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100000211423 [0,1,0,0,0,0|2,0,0]=3 364 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100000736448_100000211591 [0,1,0,0,0,0|2,0,0]=3 365 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000211423 [0,1,0,0,0,0|2,0,0]=3 366 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 270004a_100000736448_100000210122 [0,1,0,0,0,0|2,0,0]=3 367 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccn3 270004a_100000736448_100000210380 [0,1,0,0,0,0|3,0,0]=4 368 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3cccnc3 270004a_100000736448_100000735413 [0,1,0,0,0,0|3,0,0]=4 369 B24R3.67298 CN(CC1CCCCO1)C(c2ccccc2)c3ccccc3 2230a_100000225654_100000211591 [0,1,0,0,0,0|3,0,0]=4 370 B24R3.67298 CN(CC1CCCCO1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100000211543 [0,1,0,0,0,0|3,0,0]=4 371 B24R3.67298 CN(CC1CCCCO1)C(c2ccccc2)c3ccccc3 269982a_100000225654_100000211591 [0,1,0,0,0,0|3,0,0]=4 372 B24R3.67298 CN(CC1CCCCO1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000211543 [0,1,0,0,0,0|3,0,0]=4 373 B24R3.67298 CN(CC1CCCCO1)C(c2ccccc2)c3ccccc3 270004a_100000225654_100000210122 [0,1,0,0,0,0|3,0,0]=4 374 B24R3.67298 CN(CC1CCCOC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100000741521 [0,1,0,0,0,0|3,0,0]=4 375 B24R3.67298 CN(CC1CCCOC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000741521 [0,1,0,0,0,0|3,0,0]=4 376 B24R3.67298 CN(CC1CCOCC1)C(c2ccccc2)c3ccccc3 2230a_100025706683_100000211591 [0,1,0,0,0,0|3,0,0]=4 377 B24R3.67298 CN(CC1CCOCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100000754603 [0,1,0,0,0,0|3,0,0]=4 378 B24R3.67298 CN(CC1CCOCC1)C(c2ccccc2)c3ccccc3 269982a_100025706683_100000211591 [0,1,0,0,0,0|3,0,0]=4 379 B24R3.67298 CN(CC1CCOCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000754603 [0,1,0,0,0,0|3,0,0]=4 380 B24R3.67298 CN(CC1CCOCC1)C(c2ccccc2)c3ccccc3 270004a_100025706683_100000210122 [0,1,0,0,0,0|3,0,0]=4 381 B24R3.67298 CN(CC1CCSCC1)C(c2ccccc2)c3ccccc3 2230a_100011935259_100000211591 [0,1,0,0,0,0|3,0,0]=4 382 B24R3.67298 CN(CC1CCSCC1)C(c2ccccc2)c3ccccc3 269982a_100011935259_100000211591 [0,1,0,0,0,0|3,0,0]=4 383 B24R3.67298 CN(CC1CCSCC1)C(c2ccccc2)c3ccccc3 270004a_100011935259_100000210122 [0,1,0,0,0,0|3,0,0]=4 384 B24R3.67298 CN(CC1CCSCC1)C(c2ccccc2)c3ccccc3 270004a_100103148541_100000067145 [0,1,0,0,0,0|3,0,0]=4 385 B24R3.67298 O=C(C=C1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000743792_100011216954 [0,1,0,0,0,0|1,0,2]=4 386 B24R3.67298 O=C(CC1=CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000039269_100011216954 [0,1,0,0,0,0|1,0,2]=4 387 B24R3.67298 O=C(CC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100000211423 [0,1,0,0,0,0|1,0,1]=3 388 B24R3.67298 O=C(CC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000211666_100011216954 [0,1,0,0,0,0|1,0,1]=3 389 B24R3.67298 O=C(CC1CCCCO1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100000211543 [0,1,0,0,0,0|2,0,1]=4 390 B24R3.67298 O=C(CC1CCCCO1)C(c2ccccc2)c3ccccc3 1458a_100000238585_100011216954 [0,1,0,0,0,0|2,0,1]=4 391 B24R3.67298 O=C(CC1CCCOC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100000741521 [0,1,0,0,0,0|2,0,1]=4 392 B24R3.67298 O=C(CC1CCCOC1)C(c2ccccc2)c3ccccc3 1458a_100000741523_100011216954 [0,1,0,0,0,0|2,0,1]=4 393 B24R3.67298 O=C(CC1CCOCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100000754603 [0,1,0,0,0,0|2,0,1]=4 394 B24R3.67298 O=C(CC1CCOCC1)C(c2ccccc2)c3ccccc3 1458a_100000757261_100011216954 [0,1,0,0,0,0|2,0,1]=4 395 B24R3.67298 O=C(CN1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000740322_100011216954 [0,1,0,0,0,0|0,0,1]=2 396 B24R3.67298 O=C(CN1CCCOC1)N(c2ccccc2)c3ccccc3 2230a_100000131196_200015198546 [0,1,0,0,0,0|2,0,1]=4 397 B24R3.67298 O=C(CN1CCCOC1)N(c2ccccc2)c3ccccc3 269982a_100000131196_200015198546 [0,1,0,0,0,0|2,0,1]=4 398 B24R3.67298 O=C(CN1CCOCC1)C(c2ccccc2)c3ccccc3 1458a_100000740321_100011216954 [0,1,0,0,0,0|1,0,1]=3 399 B24R3.67298 O=C(CN1CCOCC1)N(c2ccccc2)c3ccccc3 2230a_100015191051_200015198546 [0,1,0,0,0,0|2,0,1]=4 400 B24R3.67298 O=C(CN1CCOCC1)N(c2ccccc2)c3ccccc3 269982a_100015191051_200015198546 [0,1,0,0,0,0|2,0,1]=4 401 B24R3.67298 O=C(CN1CCSCC1)N(c2ccccc2)c3ccccc3 2230a_100000737611_200015198546 [0,1,0,0,0,0|2,0,1]=4 402 B24R3.67298 O=C(CN1CCSCC1)N(c2ccccc2)c3ccccc3 269982a_100000737611_200015198546 [0,1,0,0,0,0|2,0,1]=4 403 B24R3.67298 O=C(NC1CCCCC1)C(c2ccccc2)c3ccccc3 11a_100000182618_100000210944 [0,1,0,0,0,0|2,0,1]=4 404 B24R3.67298 O=C(NC1CCCCC1)C(c2ccccc2)c3ccccc3 1626a_100000182618_100000210944 [0,1,0,0,0,0|2,0,1]=4 405 B24R3.67298 O=C(NC1CCCCC1)C(c2ccccc2)c3ccccc3 240690a_100000182618_100000210944 [0,1,0,0,0,0|2,0,1]=4 406 B24R3.67298 O=C(NC1CCCCC1)C(c2ccccc2)c3ccccc3 527a_100000182618_100000210944 [0,1,0,0,0,0|2,0,1]=4 407 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000745999_100000211423 [0,1,0,0,0,0|2,0,0]=3 408 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 269862a_100000745999_100000211278 [0,1,0,0,0,0|2,0,0]=3 409 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000718703 [0,1,0,0,0,0|2,0,0]=3 410 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100000745999_100000211423 [0,1,0,0,0,0|2,0,0]=3 411 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccn3 270004a_100000210473_200010179208 [0,1,0,0,0,0|3,0,0]=4 412 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3cccnc3 270004a_100000210473_100000753996 [0,1,0,0,0,0|3,0,0]=4 413 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 2230a_100000745999_100000211543 [0,1,0,0,0,0|3,0,0]=4 414 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100000718703 [0,1,0,0,0,0|3,0,0]=4 415 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 34a_100000745999_100000211543 [0,1,0,0,0,0|3,0,0]=4 416 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 2230a_100000745999_100000741521 [0,1,0,0,0,0|3,0,0]=4 417 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100000718703 [0,1,0,0,0,0|3,0,0]=4 418 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 34a_100000745999_100000741521 [0,1,0,0,0,0|3,0,0]=4 419 B24R3.89641 Brc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 2230a_100000745999_100000754603 [0,1,0,0,0,0|3,0,0]=4 420 B24R3.89641 Brc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 269862a_100000745999_100000749017 [0,1,0,0,0,0|3,0,0]=4 421 B24R3.89641 Brc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100000718703 [0,1,0,0,0,0|3,0,0]=4 422 B24R3.89641 Brc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 34a_100000745999_100000754603 [0,1,0,0,0,0|3,0,0]=4 423 B24R3.89641 Brc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 269862a_100000745999_100000067145 [0,1,0,0,0,0|3,0,0]=4 424 B24R3.89641 Brc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100000745999_100000067145 [0,1,0,0,0,0|3,0,0]=4 425 B24R3.89641 Brc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100000718703 [0,1,0,0,0,0|3,0,0]=4 426 B24R3.89641 Brc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 34a_100011217567_100000211543 [0,1,0,0,0,0|3,0,0]=4 427 B24R3.89641 Brc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_100011217567_100000211543 [0,1,0,0,0,0|3,0,0]=4 428 B24R3.89641 Brc1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 34a_100011217567_100000741521 [0,1,0,0,0,0|3,0,0]=4 429 B24R3.89641 Brc1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 7a_100011217567_100000741521 [0,1,0,0,0,0|3,0,0]=4 430 B24R3.89641 Brc1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 34a_100011217567_100000754603 [0,1,0,0,0,0|3,0,0]=4 431 B24R3.89641 Brc1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 7a_100011217567_100000754603 [0,1,0,0,0,0|3,0,0]=4 432 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000736602_100000211423 [0,1,0,0,0,0|2,0,0]=3 433 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 269862a_100000736602_100000211278 [0,1,0,0,0,0|2,0,0]=3 434 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000210966 [0,1,0,0,0,0|2,0,0]=3 435 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100000736602_100000211423 [0,1,0,0,0,0|2,0,0]=3 436 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccncc3 269862a_200015185284_100000211278 [0,1,0,0,0,0|3,0,0]=4 437 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccncc3 34a_200015185284_100000211423 [0,1,0,0,0,0|3,0,0]=4 438 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 2230a_100000736602_100000211543 [0,1,0,0,0,0|3,0,0]=4 439 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100000210966 [0,1,0,0,0,0|3,0,0]=4 440 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 34a_100000736602_100000211543 [0,1,0,0,0,0|3,0,0]=4 441 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 2230a_100000736602_100000741521 [0,1,0,0,0,0|3,0,0]=4 442 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100000210966 [0,1,0,0,0,0|3,0,0]=4 443 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 34a_100000736602_100000741521 [0,1,0,0,0,0|3,0,0]=4 444 B24R3.89641 Cc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 2230a_100000736602_100000754603 [0,1,0,0,0,0|3,0,0]=4 445 B24R3.89641 Cc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 269862a_100000736602_100000749017 [0,1,0,0,0,0|3,0,0]=4 446 B24R3.89641 Cc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100000210966 [0,1,0,0,0,0|3,0,0]=4 447 B24R3.89641 Cc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 34a_100000736602_100000754603 [0,1,0,0,0,0|3,0,0]=4 448 B24R3.89641 Cc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 269862a_100000736602_100000067145 [0,1,0,0,0,0|3,0,0]=4 449 B24R3.89641 Cc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100000736602_100000067145 [0,1,0,0,0,0|3,0,0]=4 450 B24R3.89641 Cc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100000210966 [0,1,0,0,0,0|3,0,0]=4 451 B24R3.89641 Cc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 34a_100000212064_100000211423 [0,1,0,0,0,0|2,0,0]=3 452 B24R3.89641 Cc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_100000212064_100000211423 [0,1,0,0,0,0|2,0,0]=3 453 B24R3.89641 Cc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 34a_100000212064_100000211543 [0,1,0,0,0,0|3,0,0]=4 454 B24R3.89641 Cc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_100000212064_100000211543 [0,1,0,0,0,0|3,0,0]=4 455 B24R3.89641 Cc1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 34a_100000212064_100000741521 [0,1,0,0,0,0|3,0,0]=4 456 B24R3.89641 Cc1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 7a_100000212064_100000741521 [0,1,0,0,0,0|3,0,0]=4 457 B24R3.89641 Cc1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 34a_100000212064_100000754603 [0,1,0,0,0,0|3,0,0]=4 458 B24R3.89641 Cc1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 7a_100000212064_100000754603 [0,1,0,0,0,0|3,0,0]=4 459 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000210473_100000211669 [0,1,0,0,0,0|2,0,0]=3 460 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000737946_100000211423 [0,1,0,0,0,0|2,0,0]=3 461 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 269862a_100000737946_100000211278 [0,1,0,0,0,0|2,0,0]=3 462 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000211064 [0,1,0,0,0,0|2,0,0]=3 463 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100000737946_100000211423 [0,1,0,0,0,0|2,0,0]=3 464 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccn3 2230a_100000210473_200010188304 [0,1,0,0,0,0|3,0,0]=4 465 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccn3 270004a_100000210473_100000753647 [0,1,0,0,0,0|3,0,0]=4 466 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3cccnc3 270004a_100000210473_100000753233 [0,1,0,0,0,0|3,0,0]=4 467 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 2230a_100000174945_100000211669 [0,1,0,0,0,0|3,0,0]=4 468 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 2230a_100000737946_100000211543 [0,1,0,0,0,0|3,0,0]=4 469 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100000211064 [0,1,0,0,0,0|3,0,0]=4 470 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 34a_100000737946_100000211543 [0,1,0,0,0,0|3,0,0]=4 471 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 2230a_100000720124_100000211669 [0,1,0,0,0,0|3,0,0]=4 472 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 2230a_100000737946_100000741521 [0,1,0,0,0,0|3,0,0]=4 473 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100000211064 [0,1,0,0,0,0|3,0,0]=4 474 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 34a_100000737946_100000741521 [0,1,0,0,0,0|3,0,0]=4 475 B24R3.89641 Clc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 2230a_100000737946_100000754603 [0,1,0,0,0,0|3,0,0]=4 476 B24R3.89641 Clc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 2230a_100000746373_100000211669 [0,1,0,0,0,0|3,0,0]=4 477 B24R3.89641 Clc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 269862a_100000737946_100000749017 [0,1,0,0,0,0|3,0,0]=4 478 B24R3.89641 Clc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100000211064 [0,1,0,0,0,0|3,0,0]=4 479 B24R3.89641 Clc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 34a_100000737946_100000754603 [0,1,0,0,0,0|3,0,0]=4 480 B24R3.89641 Clc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 2230a_100015188806_100000211669 [0,1,0,0,0,0|3,0,0]=4 481 B24R3.89641 Clc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 269862a_100000737946_100000067145 [0,1,0,0,0,0|3,0,0]=4 482 B24R3.89641 Clc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100000737946_100000067145 [0,1,0,0,0,0|3,0,0]=4 483 B24R3.89641 Clc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100000211064 [0,1,0,0,0,0|3,0,0]=4 484 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCCC2)c3ccccn3 34a_100000242608_100000211423 [0,1,0,0,0,0|3,0,0]=4 485 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCCC2)c3ccccn3 7a_100000212181_200010188304 [0,1,0,0,0,0|3,0,0]=4 486 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 34a_100000211768_100000211543 [0,1,0,0,0,0|3,0,0]=4 487 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_100000211370_100000211669 [0,1,0,0,0,0|3,0,0]=4 488 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_100000211768_100000211543 [0,1,0,0,0,0|3,0,0]=4 489 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 34a_100000211768_100000741521 [0,1,0,0,0,0|3,0,0]=4 490 B24R3.89641 Clc1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 7a_100000211768_100000741521 [0,1,0,0,0,0|3,0,0]=4 491 B24R3.89641 Clc1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 34a_100000211768_100000754603 [0,1,0,0,0,0|3,0,0]=4 492 B24R3.89641 Clc1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 7a_100000211768_100000754603 [0,1,0,0,0,0|3,0,0]=4 493 B24R3.89641 Clc1ccc(cc1)C(OCC2CCSCC2)c3ccccc3 7a_100000070558_100000211669 [0,1,0,0,0,0|3,0,0]=4 494 B24R3.89641 Clc1ccc(cc1)C(SCC2CCCCO2)c3ccccc3 62a_100000211543_100000211669 [0,1,0,0,0,0|3,0,0]=4 495 B24R3.89641 Clc1ccc(cc1)C(SCC2CCCCO2)c3ccccc3 62a_100000211669_100000211543 [0,1,0,0,0,0|3,0,0]=4 496 B24R3.89641 Clc1ccc(cc1)C(SCC2CCCOC2)c3ccccc3 62a_100000211669_100000741521 [0,1,0,0,0,0|3,0,0]=4 497 B24R3.89641 Clc1ccc(cc1)C(SCC2CCCOC2)c3ccccc3 62a_100000741521_100000211669 [0,1,0,0,0,0|3,0,0]=4 498 B24R3.89641 Clc1ccc(cc1)C(SCC2CCOCC2)c3ccccc3 62a_100000211669_100000749018 [0,1,0,0,0,0|3,0,0]=4 499 B24R3.89641 Clc1ccc(cc1)C(SCC2CCOCC2)c3ccccc3 62a_100000754603_100000211669 [0,1,0,0,0,0|3,0,0]=4 500 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000737529_100000211423 [0,1,0,0,0,0|2,0,0]=3 501 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 269862a_100000737529_100000211278 [0,1,0,0,0,0|2,0,0]=3 502 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000210425 [0,1,0,0,0,0|2,0,0]=3 503 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100000737529_100000211423 [0,1,0,0,0,0|2,0,0]=3 504 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccncc3 2230a_100000751741_100000211423 [0,1,0,0,0,0|3,0,0]=4 505 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccncc3 269862a_100000751741_100000211278 [0,1,0,0,0,0|3,0,0]=4 506 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccncc3 34a_100000751741_100000211423 [0,1,0,0,0,0|3,0,0]=4 507 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 2230a_100000737529_100000211543 [0,1,0,0,0,0|3,0,0]=4 508 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 270004a_100000174945_100000210425 [0,1,0,0,0,0|3,0,0]=4 509 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 34a_100000737529_100000211543 [0,1,0,0,0,0|3,0,0]=4 510 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 2230a_100000737529_100000741521 [0,1,0,0,0,0|3,0,0]=4 511 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 270004a_100000720124_100000210425 [0,1,0,0,0,0|3,0,0]=4 512 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 34a_100000737529_100000741521 [0,1,0,0,0,0|3,0,0]=4 513 B24R3.89641 Fc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 2230a_100000737529_100000754603 [0,1,0,0,0,0|3,0,0]=4 514 B24R3.89641 Fc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 269862a_100000737529_100000749017 [0,1,0,0,0,0|3,0,0]=4 515 B24R3.89641 Fc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 270004a_100000746373_100000210425 [0,1,0,0,0,0|3,0,0]=4 516 B24R3.89641 Fc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 34a_100000737529_100000754603 [0,1,0,0,0,0|3,0,0]=4 517 B24R3.89641 Fc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 269862a_100000737529_100000067145 [0,1,0,0,0,0|3,0,0]=4 518 B24R3.89641 Fc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100000737529_100000067145 [0,1,0,0,0,0|3,0,0]=4 519 B24R3.89641 Fc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100015188806_100000210425 [0,1,0,0,0,0|3,0,0]=4 520 B24R3.89641 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 34a_200000246460_100000211423 [0,1,0,0,0,0|2,0,0]=3 521 B24R3.89641 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_200000246460_100000211423 [0,1,0,0,0,0|2,0,0]=3 522 B24R3.89641 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccncc3 34a_100000748166_100000211423 [0,1,0,0,0,0|3,0,0]=4 523 B24R3.89641 Fc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 34a_200000246460_100000211543 [0,1,0,0,0,0|3,0,0]=4 524 B24R3.89641 Fc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_200000246460_100000211543 [0,1,0,0,0,0|3,0,0]=4 525 B24R3.89641 Fc1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 34a_200000246460_100000741521 [0,1,0,0,0,0|3,0,0]=4 526 B24R3.89641 Fc1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 7a_200000246460_100000741521 [0,1,0,0,0,0|3,0,0]=4 527 B24R3.89641 Fc1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 34a_200000246460_100000754603 [0,1,0,0,0,0|3,0,0]=4 528 B24R3.89641 Fc1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 7a_200000246460_100000754603 [0,1,0,0,0,0|3,0,0]=4 529 B24R3.89641 Nc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 34a_100011236343_100000211423 [0,1,0,0,0,0|2,0,0]=3 530 B24R3.89641 Nc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_100011236343_100000211423 [0,1,0,0,0,0|2,0,0]=3 531 B24R3.89641 Nc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 34a_100011236343_100000211543 [0,1,0,0,0,0|3,0,0]=4 532 B24R3.89641 Nc1ccc(cc1)C(OCC2CCCCO2)c3ccccc3 7a_100011236343_100000211543 [0,1,0,0,0,0|3,0,0]=4 533 B24R3.89641 Nc1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 34a_100011236343_100000741521 [0,1,0,0,0,0|3,0,0]=4 534 B24R3.89641 Nc1ccc(cc1)C(OCC2CCCOC2)c3ccccc3 7a_100011236343_100000741521 [0,1,0,0,0,0|3,0,0]=4 535 B24R3.89641 Nc1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 34a_100011236343_100000754603 [0,1,0,0,0,0|3,0,0]=4 536 B24R3.89641 Nc1ccc(cc1)C(OCC2CCOCC2)c3ccccc3 7a_100011236343_100000754603 [0,1,0,0,0,0|3,0,0]=4 537 B24R3.89641 Oc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100000198503_100000211423 [0,1,0,0,0,0|2,0,0]=3 538 B24R3.89641 Oc1ccc(cc1)C(NCC2CCCCO2)c3ccccc3 34a_100000198503_100000211543 [0,1,0,0,0,0|3,0,0]=4 539 B24R3.89641 Oc1ccc(cc1)C(NCC2CCCOC2)c3ccccc3 34a_100000198503_100000741521 [0,1,0,0,0,0|3,0,0]=4 540 B24R3.89641 Oc1ccc(cc1)C(NCC2CCOCC2)c3ccccc3 34a_100000198503_100000754603 [0,1,0,0,0,0|3,0,0]=4 541 B24R3.89641 Oc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 270004a_100000198503_100000067145 [0,1,0,0,0,0|3,0,0]=4 542 B24R3.89720 C=C1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100010272673 [0,1,0,0,0,0|2,0,1]=4 543 B24R3.89720 C=C1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000752442_100000050448 [0,1,0,0,0,0|0,0,3]=4 544 B24R3.89720 C=C1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000752442_100009813428 [0,1,0,0,0,0|0,0,1]=2 545 B24R3.89720 C=C1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000752442_100009813428 [0,1,0,0,0,0|0,0,1]=2 546 B24R3.89720 C=C1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100000752442_100009813428 [0,1,0,0,0,0|0,0,1]=2 547 B24R3.89720 C=C1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000752442_100010140906 [0,1,0,0,0,0|1,0,1]=3 548 B24R3.89720 C=C1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000752442_100010140906 [0,1,0,0,0,0|1,0,1]=3 549 B24R3.89720 CC1=CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000693516_100009813428 [0,1,0,0,0,0|0,0,2]=3 550 B24R3.89720 CC1=CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000693516_100009813428 [0,1,0,0,0,0|0,0,2]=3 551 B24R3.89720 CC1=CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100000693516_100009813428 [0,1,0,0,0,0|0,0,2]=3 552 B24R3.89720 CC1=CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000693516_100010140906 [0,1,0,0,0,0|1,0,2]=4 553 B24R3.89720 CC1=CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000693516_100010140906 [0,1,0,0,0,0|1,0,2]=4 554 B24R3.89720 CC1CCC(CC1)CNC(c2ccccc2)c3ccccc3 2230a_103436935547_100000211591 [0,1,0,0,0,0|2,0,0]=3 555 B24R3.89720 CC1CCC(CC1)CNC(c2ccccc2)c3ccccc3 270004a_103436935547_100000210122 [0,1,0,0,0,0|2,0,0]=3 556 B24R3.89720 CC1CCC(CC1)CNC(c2ccccc2)c3ccccn3 270004a_103436935547_100000210380 [0,1,0,0,0,0|3,0,0]=4 557 B24R3.89720 CC1CCC(CC1)CNC(c2ccccc2)c3cccnc3 270004a_103436935547_100000735413 [0,1,0,0,0,0|3,0,0]=4 558 B24R3.89720 CC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000185489 [0,1,0,0,0,0|2,0,0]=3 559 B24R3.89720 CC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 34a_100000739227_200011216234 [0,1,0,0,0,0|2,0,0]=3 560 B24R3.89720 CC1CCC(CC1)OCC(c2ccccc2)c3ccccc3 34a_100011215272_200011216234 [0,1,0,0,0,0|2,0,0]=3 561 B24R3.89720 CC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000188429_100000050448 [0,1,0,0,0,0|0,0,2]=3 562 B24R3.89720 CC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000188429_100009813428 [0,1,0,0,0,0|0,0,0]=1 563 B24R3.89720 CC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000188429_100009813428 [0,1,0,0,0,0|0,0,0]=1 564 B24R3.89720 CC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100000188429_100009813428 [0,1,0,0,0,0|0,0,0]=1 565 B24R3.89720 CC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000188429_100010140906 [0,1,0,0,0,0|1,0,0]=2 566 B24R3.89720 CC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000188429_100010140906 [0,1,0,0,0,0|1,0,0]=2 567 B24R3.89720 CN1CCC(CC1)CNC(c2ccccc2)c3ccccc3 270004a_100000746316_100000210122 [0,1,0,0,0,0|3,0,0]=4 568 B24R3.89720 CN1CCC(CC1)CSC(c2ccccc2)c3ccccc3 62a_100000211591_100015183002 [0,1,0,0,0,0|3,0,0]=4 569 B24R3.89720 CN1CCC(CC1)CSC(c2ccccc2)c3ccccc3 62a_100015183002_100011216954 [0,1,0,0,0,0|3,0,0]=4 570 B24R3.89720 CN1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000210137 [0,1,0,0,0,0|3,0,0]=4 571 B24R3.89720 CN1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000188432_100000050448 [0,1,0,0,0,0|1,0,2]=4 572 B24R3.89720 CN1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000188432_100009813428 [0,1,0,0,0,0|1,0,0]=2 573 B24R3.89720 CN1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000188432_100009813428 [0,1,0,0,0,0|1,0,0]=2 574 B24R3.89720 CN1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000188432_100010140906 [0,1,0,0,0,0|2,0,0]=3 575 B24R3.89720 CN1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000188432_100010140906 [0,1,0,0,0,0|2,0,0]=3 576 B24R3.89720 FC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100015193889_100000050448 [0,1,0,0,0,0|0,0,2]=3 577 B24R3.89720 FC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100015193889_100009813428 [0,1,0,0,0,0|0,0,0]=1 578 B24R3.89720 FC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100015193889_100009813428 [0,1,0,0,0,0|0,0,0]=1 579 B24R3.89720 FC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100015193889_100009813428 [0,1,0,0,0,0|0,0,0]=1 580 B24R3.89720 FC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100015193889_100010140906 [0,1,0,0,0,0|1,0,0]=2 581 B24R3.89720 FC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100015193889_100010140906 [0,1,0,0,0,0|1,0,0]=2 582 B24R3.89720 O=S1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000752083_100000050448 [0,1,0,0,0,0|1,0,2]=4 583 B24R3.89720 O=S1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000752083_100009813428 [0,1,0,0,0,0|1,0,0]=2 584 B24R3.89720 O=S1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000752083_100009813428 [0,1,0,0,0,0|1,0,0]=2 585 B24R3.89720 O=S1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000752083_100010140906 [0,1,0,0,0,0|2,0,0]=3 586 B24R3.89720 O=S1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000752083_100010140906 [0,1,0,0,0,0|2,0,0]=3 587 B24R3.89720 OC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000764474 [0,1,0,0,0,0|2,0,0]=3 588 B24R3.89720 OC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100025773856_100000050448 [0,1,0,0,0,0|0,0,2]=3 589 B24R3.89720 OC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100025773856_100009813428 [0,1,0,0,0,0|0,0,0]=1 590 B24R3.89720 OC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100025773856_100009813428 [0,1,0,0,0,0|0,0,0]=1 591 B24R3.89720 OC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100025773856_100010140906 [0,1,0,0,0,0|1,0,0]=2 592 B24R3.89720 OC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100025773856_100010140906 [0,1,0,0,0,0|1,0,0]=2 593 B24R3.243784 CC1=CCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100000725631_100009813428 [0,1,0,0,0,0|0,0,2]=3 594 B24R3.243784 CC1=CCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100000725631_100009813428 [0,1,0,0,0,0|0,0,2]=3 595 B24R3.243784 CC1=CCCN(C1)CCC(c2ccccc2)c3ccccc3 34a_100000725631_100009813428 [0,1,0,0,0,0|0,0,2]=3 596 B24R3.243784 CC1=CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000725631_100010140906 [0,1,0,0,0,0|1,0,2]=4 597 B24R3.243784 CC1=CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000725631_100010140906 [0,1,0,0,0,0|1,0,2]=4 598 B24R3.243784 CC1CC(CCO1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000755752 [0,1,0,0,0,0|3,0,0]=4 599 B24R3.243784 CC1CCCC(C1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000183594 [0,1,0,0,0,0|2,0,0]=3 600 B24R3.243784 CC1CN(CCO1)CC=C(c2ccccc2)c3ccccc3 270004a_100000729577_100000050448 [0,1,0,0,0,0|1,0,2]=4 601 B24R3.243784 CC1CN(CCO1)CCC(c2ccccc2)c3ccccc3 2230a_100000729577_100009813428 [0,1,0,0,0,0|1,0,0]=2 602 B24R3.243784 CC1CN(CCO1)CCC(c2ccccc2)c3ccccc3 269982a_100000729577_100009813428 [0,1,0,0,0,0|1,0,0]=2 603 B24R3.243784 CC1CN(CCO1)CCC(c2ccccc2)c3ccccc3 34a_100000729577_100009813428 [0,1,0,0,0,0|1,0,0]=2 604 B24R3.243784 CC1CN(CCO1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000729577_100010140906 [0,1,0,0,0,0|2,0,0]=3 605 B24R3.243784 CC1CN(CCO1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000729577_100010140906 [0,1,0,0,0,0|2,0,0]=3 606 B24R3.243784 CN1CCCC(C1)CNC(c2ccccc2)c3ccccc3 34a_100000162943_100015183302 [0,1,0,0,0,0|3,0,0]=4 607 B24R3.243784 CN1CCCC(C1)COC(c2ccccc2)c3ccccc3 34a_100000211180_100015183302 [0,1,0,0,0,0|3,0,0]=4 608 B24R3.243784 CN1CCCC(C1)COC(c2ccccc2)c3ccccc3 7a_100000211180_100000752043 [0,1,0,0,0,0|3,0,0]=4 609 B24R3.243784 CN1CCCC(C1)CSC(c2ccccc2)c3ccccc3 62a_100000211591_100000752043 [0,1,0,0,0,0|3,0,0]=4 610 B24R3.243784 CN1CCCC(C1)CSC(c2ccccc2)c3ccccc3 62a_100000752043_100011216954 [0,1,0,0,0,0|3,0,0]=4 611 B24R3.243784 CN1CCC[C@H](C1)CNC(c2ccccc2)c3ccccc3 270004a_100016993746_100000210122 [0,1,0,0,0,0|3,0,0]=4 612 B24R3.243784 C[C@@H]1CC(CCN1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100016994030 [0,1,0,0,0,0|3,0,0]=4 613 B24R3.243784 C[C@H]1CCCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100000717927_100000050448 [0,1,0,0,0,0|0,0,2]=3 614 B24R3.243784 C[C@H]1CCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100000717927_100009813428 [0,1,0,0,0,0|0,0,0]=1 615 B24R3.243784 C[C@H]1CCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100000717927_100009813428 [0,1,0,0,0,0|0,0,0]=1 616 B24R3.243784 C[C@H]1CCCN(C1)CCC(c2ccccc2)c3ccccc3 34a_100000717927_100009813428 [0,1,0,0,0,0|0,0,0]=1 617 B24R3.243784 C[C@H]1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000717927_100010140906 [0,1,0,0,0,0|1,0,0]=2 618 B24R3.243784 C[C@H]1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000717927_100010140906 [0,1,0,0,0,0|1,0,0]=2 619 B24R3.243784 FC1CCCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100000697950_100000050448 [0,1,0,0,0,0|0,0,2]=3 620 B24R3.243784 FC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100000697950_100009813428 [0,1,0,0,0,0|0,0,0]=1 621 B24R3.243784 FC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100000697950_100009813428 [0,1,0,0,0,0|0,0,0]=1 622 B24R3.243784 FC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 34a_100000697950_100009813428 [0,1,0,0,0,0|0,0,0]=1 623 B24R3.243784 FC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000697950_100010140906 [0,1,0,0,0,0|1,0,0]=2 624 B24R3.243784 FC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000697950_100010140906 [0,1,0,0,0,0|1,0,0]=2 625 B24R3.243784 O=C1CN(CCN1)CCC(c2ccccc2)c3ccccc3 2230a_100000184651_100009813428 [0,1,0,0,0,0|1,0,1]=3 626 B24R3.243784 O=C1CN(CCN1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000184651_100010140906 [0,1,0,0,0,0|2,0,1]=4 627 B24R3.243784 O=C1CN(CCO1)CCC(c2ccccc2)c3ccccc3 2230a_100000131268_100009813428 [0,1,0,0,0,0|1,0,1]=3 628 B24R3.243784 O=C1CN(CCO1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000131268_100010140906 [0,1,0,0,0,0|2,0,1]=4 629 B24R3.243784 OC1CCCC(C1)CNC(c2ccccc2)c3ccccc3 2230a_100011254705_100000211591 [0,1,0,0,0,0|2,0,0]=3 630 B24R3.243784 OC1CCCC(C1)CNC(c2ccccc2)c3ccccc3 270004a_100011254705_100000210122 [0,1,0,0,0,0|2,0,0]=3 631 B24R3.243784 OC1CCCC(C1)CNC(c2ccccc2)c3ccccn3 270004a_100011254705_100000210380 [0,1,0,0,0,0|3,0,0]=4 632 B24R3.243784 OC1CCCC(C1)CNC(c2ccccc2)c3cccnc3 270004a_100011254705_100000735413 [0,1,0,0,0,0|3,0,0]=4 633 B24R3.243784 OC1CCCC(C1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100012613340 [0,1,0,0,0,0|2,0,0]=3 634 B24R3.243784 OC1CCCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100000211013_100000050448 [0,1,0,0,0,0|0,0,2]=3 635 B24R3.243784 OC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100000211013_100009813428 [0,1,0,0,0,0|0,0,0]=1 636 B24R3.243784 OC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100000211013_100009813428 [0,1,0,0,0,0|0,0,0]=1 637 B24R3.243784 OC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000211013_100010140906 [0,1,0,0,0,0|1,0,0]=2 638 B24R3.243784 OC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000211013_100010140906 [0,1,0,0,0,0|1,0,0]=2 639 B24R3.243784 OC1CN(CCO1)CC=C(c2ccccc2)c3ccccc3 270004a_100000688207_100000050448 [0,1,0,0,0,0|1,0,2]=4 640 B24R3.243784 OC1CN(CCO1)CCC(c2ccccc2)c3ccccc3 2230a_100000688207_100009813428 [0,1,0,0,0,0|1,0,0]=2 641 B24R3.243784 OC1CN(CCO1)CCC(c2ccccc2)c3ccccc3 269982a_100000688207_100009813428 [0,1,0,0,0,0|1,0,0]=2 642 B24R3.243784 OC1CN(CCO1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000688207_100010140906 [0,1,0,0,0,0|2,0,0]=3 643 B24R3.243784 OC1CN(CCO1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000688207_100010140906 [0,1,0,0,0,0|2,0,0]=3 644 B24R3.1994292 CC(CNC1CCCCC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100000210434 [0,1,0,0,0,0|2,0,0]=3 645 B24R3.1994292 CC(CNC1CCCOC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100000753404 [0,1,0,0,0,0|3,0,0]=4 646 B24R3.1994292 CC(CNC1CCCSC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100000057913 [0,1,0,0,0,0|3,0,0]=4 647 B24R3.1994292 CC(CNC1CCNCC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100015192401 [0,1,0,0,0,0|3,0,0]=4 648 B24R3.1994292 CC(CNC1CCOCC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100011217826 [0,1,0,0,0,0|3,0,0]=4 649 B24R3.1994292 CC(CNC1CCSCC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100000203788 [0,1,0,0,0,0|3,0,0]=4 650 B24R3.1994292 CC(OCC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000211423 [0,1,0,0,0,0|2,0,0]=3 651 B24R3.1994292 CC(OCC1CCCCC1)(c2ccccc2)c3ccccn3 7a_200000075192_100000211423 [0,1,0,0,0,0|3,0,0]=4 652 B24R3.1994292 CC(OCC1CCCCO1)(c2ccccc2)c3ccccc3 7a_100011202337_100000211543 [0,1,0,0,0,0|3,0,0]=4 653 B24R3.1994292 CC(OCC1CCCOC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000741521 [0,1,0,0,0,0|3,0,0]=4 654 B24R3.1994292 CC(OCC1CCOCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000754603 [0,1,0,0,0,0|3,0,0]=4 655 B24R3.1994292 O=P(COC1CCCCC1)(c2ccccc2)c3ccccc3 34a_200000030349_100000210327 [0,1,0,0,0,0|3,0,0]=4 656 B24R3.1994292 O=P(COC1CCCCC1)(c2ccccc2)c3ccccc3 7a_200000030349_100000210327 [0,1,0,0,0,0|3,0,0]=4 657 B24R3.14922733 CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3 2230a_100000706052_100000211591 [0,1,0,0,0,0|2,0,0]=3 658 B24R3.14922733 CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3 269862a_100000162943_100011935227 [0,1,0,0,0,0|2,0,0]=3 659 B24R3.14922733 CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3 270004a_100000706052_100000210122 [0,1,0,0,0,0|2,0,0]=3 660 B24R3.14922733 CC1(CCCCC1)CNC(c2ccccc2)c3ccccn3 269862a_100000689936_100011935227 [0,1,0,0,0,0|3,0,0]=4 661 B24R3.14922733 CC1(CCCCC1)CNC(c2ccccc2)c3ccccn3 270004a_100000706052_100000210380 [0,1,0,0,0,0|3,0,0]=4 662 B24R3.14922733 CC1(CCCCC1)CNC(c2ccccc2)c3cccnc3 270004a_100000706052_100000735413 [0,1,0,0,0,0|3,0,0]=4 663 B24R3.14922733 CC1(CCCCC1)CNC(c2ccccc2)c3ccncc3 269862a_100025760769_100011935227 [0,1,0,0,0,0|3,0,0]=4 664 B24R3.14922733 CC1(CCCCC1)COC(c2ccccc2)c3ccccc3 7a_100000688186_100011216954 [0,1,0,0,0,0|2,0,0]=3 665 B24R3.14922733 CC1(CCOCC1)CNC(c2ccccc2)c3ccccc3 2230a_100000695556_100000211591 [0,1,0,0,0,0|3,0,0]=4 666 B24R3.14922733 CC1(CCOCC1)CNC(c2ccccc2)c3ccccc3 269862a_100000162943_100000701351 [0,1,0,0,0,0|3,0,0]=4 667 B24R3.14922733 CC1(CCOCC1)CNC(c2ccccc2)c3ccccc3 270004a_100000695556_100000210122 [0,1,0,0,0,0|3,0,0]=4 668 B24R3.14922733 CC1(CCOCC1)COC(c2ccccc2)c3ccccc3 7a_100000704393_100011216954 [0,1,0,0,0,0|3,0,0]=4 669 B24R3.14922733 FC1(CCCCC1)COC(c2ccccc2)c3ccccc3 7a_100000090305_100011216954 [0,1,0,0,0,0|2,0,0]=3 670 B24R3.14922733 FC1(CCOCC1)CNC(c2ccccc2)c3ccccc3 2230a_100016991512_100000211591 [0,1,0,0,0,0|3,0,0]=4 671 B24R3.14922733 FC1(CCOCC1)CNC(c2ccccc2)c3ccccc3 270004a_100016991512_100000210122 [0,1,0,0,0,0|3,0,0]=4 672 B24R3.14922733 OC1(CCCCC1)CNC(c2ccccc2)c3ccccc3 2230a_100000748649_100000211591 [0,1,0,0,0,0|2,0,0]=3 673 B24R3.14922733 OC1(CCCCC1)CNC(c2ccccc2)c3ccccc3 270004a_100000748649_100000210122 [0,1,0,0,0,0|2,0,0]=3 674 B24R3.14922733 OC1(CCCCC1)CNC(c2ccccc2)c3ccccn3 270004a_100000748649_100000210380 [0,1,0,0,0,0|3,0,0]=4 675 B24R3.14922733 OC1(CCCCC1)CNC(c2ccccc2)c3cccnc3 270004a_100000748649_100000735413 [0,1,0,0,0,0|3,0,0]=4 676 B24R3.14922733 OC1(CCOCC1)CNC(c2ccccc2)c3ccccc3 2230a_100000704115_100000211591 [0,1,0,0,0,0|3,0,0]=4 677 B24R3.14922733 OC1(CCOCC1)CNC(c2ccccc2)c3ccccc3 270004a_100000704115_100000210122 [0,1,0,0,0,0|3,0,0]=4 678 B24R3.14922733 OC1(CCSCC1)CNC(c2ccccc2)c3ccccc3 2230a_100000758141_100000211591 [0,1,0,0,0,0|3,0,0]=4 679 B24R3.14922733 OC1(CCSCC1)CNC(c2ccccc2)c3ccccc3 270004a_100000758141_100000210122 [0,1,0,0,0,0|3,0,0]=4 680 B22R2.15786 BrCCCCCCOC(c1ccccc1)c2ccccc2 7a_100011215345_100011216954 [0,0,1,0,0,0|3,0,0]=4 681 B22R2.15786 BrCCCCOCCC(c1ccccc1)c2ccccc2 34a_100011216708_100009813428 [0,0,1,0,0,0|2,0,0]=3 682 B22R2.15786 C#CCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000731252 [0,0,1,0,0,0|0,0,2]=3 683 B22R2.15786 C#CCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000695029 [0,0,1,0,0,0|0,0,2]=3 684 B22R2.15786 C#CCCCNCCC(c1ccccc1)c2ccccc2 34a_100000718082_100009813428 [0,0,1,0,0,0|0,0,2]=3 685 B22R2.15786 C#CCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000731252 [0,0,1,0,0,0|1,0,2]=4 686 B22R2.15786 C#CCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000695029 [0,0,1,0,0,0|1,0,2]=4 687 B22R2.15786 C#CCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000695029 [0,0,1,0,0,0|1,0,2]=4 688 B22R2.15786 C#CCCCOCCC(c1ccccc1)c2ccccc2 34a_100000215630_100009813428 [0,0,1,0,0,0|1,0,2]=4 689 B22R2.15786 C#CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011215417 [0,0,1,0,0,0|1,0,2]=4 690 B22R2.15786 C#CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000215630_100009813428 [0,0,1,0,0,0|1,0,2]=4 691 B22R2.15786 C#CCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011215417 [0,0,1,0,0,0|1,0,2]=4 692 B22R2.15786 C#CCCCSCCC(c1ccccc1)c2ccccc2 62a_100011215417_100009813428 [0,0,1,0,0,0|1,0,2]=4 693 B22R2.15786 C/C=C/CCOCCC(c1ccccc1)c2ccccc2 34a_100016278192_100009813428 [0,0,1,0,0,0|1,0,2]=4 694 B22R2.15786 C=CCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011713584 [0,0,1,0,0,0|0,0,2]=3 695 B22R2.15786 C=CCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000700776_100009813428 [0,0,1,0,0,0|0,0,2]=3 696 B22R2.15786 C=CCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000757094 [0,0,1,0,0,0|0,0,2]=3 697 B22R2.15786 C=CCCCNCCC(c1ccccc1)c2ccccc2 34a_100000700776_100009813428 [0,0,1,0,0,0|0,0,2]=3 698 B22R2.15786 C=CCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100011713584 [0,0,1,0,0,0|1,0,2]=4 699 B22R2.15786 C=CCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000757094 [0,0,1,0,0,0|1,0,2]=4 700 B22R2.15786 C=CCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000700776_100010140906 [0,0,1,0,0,0|1,0,2]=4 701 B22R2.15786 C=CCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000757094 [0,0,1,0,0,0|1,0,2]=4 702 B22R2.15786 C=CCCCOCCC(c1ccccc1)c2ccccc2 34a_100000758997_100009813428 [0,0,1,0,0,0|1,0,2]=4 703 B22R2.15786 C=CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000757094 [0,0,1,0,0,0|1,0,2]=4 704 B22R2.15786 C=CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000758997_100009813428 [0,0,1,0,0,0|1,0,2]=4 705 B22R2.15786 C=CCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000757094 [0,0,1,0,0,0|1,0,2]=4 706 B22R2.15786 C=CCCCSCCC(c1ccccc1)c2ccccc2 62a_100011713584_100009813428 [0,0,1,0,0,0|1,0,2]=4 707 B22R2.15786 C=COCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000039644 [0,0,1,0,0,0|1,0,2]=4 708 B22R2.15786 C=COCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000039644 [0,0,1,0,0,0|1,0,2]=4 709 B22R2.15786 CC#CCCOCCC(c1ccccc1)c2ccccc2 34a_100000750427_100009813428 [0,0,1,0,0,0|1,0,2]=4 710 B22R2.15786 CC/C=C\CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100103147603 [0,0,1,0,0,0|0,0,2]=3 711 B22R2.15786 CC/C=C\CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100103147603 [0,0,1,0,0,0|0,0,2]=3 712 B22R2.15786 CC/C=C\CNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100103147603 [0,0,1,0,0,0|1,0,2]=4 713 B22R2.15786 CC/C=C\CNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100103147603 [0,0,1,0,0,0|1,0,2]=4 714 B22R2.15786 CC/C=C\COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100103147603 [0,0,1,0,0,0|1,0,2]=4 715 B22R2.15786 CC/C=C\COCCC(c1ccccc1)c2ccccc2 34a_100016268518_100009813428 [0,0,1,0,0,0|1,0,2]=4 716 B22R2.15786 CC/C=C\COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100103147603 [0,0,1,0,0,0|1,0,2]=4 717 B22R2.15786 CC/C=C\CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100103147603 [0,0,1,0,0,0|1,0,2]=4 718 B22R2.15786 CC/C=C\CSCCC(c1ccccc1)c2ccccc2 62a_100103147603_100009813428 [0,0,1,0,0,0|1,0,2]=4 719 B22R2.15786 CCC#CCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100009813939 [0,0,1,0,0,0|0,0,2]=3 720 B22R2.15786 CCC#CCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100009813939 [0,0,1,0,0,0|0,0,2]=3 721 B22R2.15786 CCC#CCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100009813939 [0,0,1,0,0,0|1,0,2]=4 722 B22R2.15786 CCC#CCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100009813939 [0,0,1,0,0,0|1,0,2]=4 723 B22R2.15786 CCC#CCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100009813939 [0,0,1,0,0,0|1,0,2]=4 724 B22R2.15786 CCC#CCOCCC(c1ccccc1)c2ccccc2 34a_100000032950_100009813428 [0,0,1,0,0,0|1,0,2]=4 725 B22R2.15786 CCC#CCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100009813939 [0,0,1,0,0,0|1,0,2]=4 726 B22R2.15786 CCC#CCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100009813939 [0,0,1,0,0,0|1,0,2]=4 727 B22R2.15786 CCC#CCSCCC(c1ccccc1)c2ccccc2 62a_100009813939_100009813428 [0,0,1,0,0,0|1,0,2]=4 728 B22R2.15786 CCCC/C=C/COC(c1ccccc1)c2ccccc2 7a_200016272032_100011216954 [0,0,1,0,0,0|2,0,1]=4 729 B22R2.15786 CCCCC#CCOC(c1ccccc1)c2ccccc2 7a_200000034558_100011216954 [0,0,1,0,0,0|2,0,1]=4 730 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210681 [0,0,1,0,0,0|2,0,0]=3 731 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000229938_100000211591 [0,0,1,0,0,0|2,0,0]=3 732 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccc2 270004a_100000229938_100000210122 [0,0,1,0,0,0|2,0,0]=3 733 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210614 [0,0,1,0,0,0|2,0,0]=3 734 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210681 [0,0,1,0,0,0|3,0,0]=4 735 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccn2 270004a_100000229938_100000210380 [0,0,1,0,0,0|3,0,0]=4 736 B22R2.15786 CCCCCCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000210681 [0,0,1,0,0,0|3,0,0]=4 737 B22R2.15786 CCCCCCCNC(c1ccccc1)c2cccnc2 270004a_100000229938_100000735413 [0,0,1,0,0,0|3,0,0]=4 738 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000210681 [0,0,1,0,0,0|3,0,0]=4 739 B22R2.15786 CCCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210614 [0,0,1,0,0,0|2,0,0]=3 740 B22R2.15786 CCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000210272_100011216954 [0,0,1,0,0,0|2,0,0]=3 741 B22R2.15786 CCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210614 [0,0,1,0,0,0|2,0,0]=3 742 B22R2.15786 CCCCCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210614 [0,0,1,0,0,0|3,0,0]=4 743 B22R2.15786 CCCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210314 [0,0,1,0,0,0|2,0,0]=3 744 B22R2.15786 CCCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210314 [0,0,1,0,0,0|2,0,0]=3 745 B22R2.15786 CCCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210314 [0,0,1,0,0,0|2,0,0]=3 746 B22R2.15786 CCCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210314 [0,0,1,0,0,0|2,0,0]=3 747 B22R2.15786 CCCCCNCC=C(c1ccccc1)c2ccccc2 270004a_100000209983_100000050448 [0,0,1,0,0,0|0,0,2]=3 748 B22R2.15786 CCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000209983_100009813428 [0,0,1,0,0,0|0,0,0]=1 749 B22R2.15786 CCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000210326 [0,0,1,0,0,0|0,0,0]=1 750 B22R2.15786 CCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000718602 [0,0,1,0,0,0|0,0,0]=1 751 B22R2.15786 CCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000210326 [0,0,1,0,0,0|1,0,0]=2 752 B22R2.15786 CCCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000718602 [0,0,1,0,0,0|1,0,0]=2 753 B22R2.15786 CCCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000209983_100010140906 [0,0,1,0,0,0|1,0,0]=2 754 B22R2.15786 CCCCCNN=CC(c1ccccc1)c2ccccc2 4a_100000694160_100000183636 [0,0,1,0,0,0|1,0,1]=3 755 B22R2.15786 CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000718602 [0,0,1,0,0,0|1,0,0]=2 756 B22R2.15786 CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000210253_100009813428 [0,0,1,0,0,0|1,0,0]=2 757 B22R2.15786 CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210326 [0,0,1,0,0,0|1,0,0]=2 758 B22R2.15786 CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000210253_100009813428 [0,0,1,0,0,0|1,0,0]=2 759 B22R2.15786 CCCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000718602 [0,0,1,0,0,0|2,0,0]=3 760 B22R2.15786 CCCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000210326 [0,0,1,0,0,0|2,0,0]=3 761 B22R2.15786 CCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000210253_100010140906 [0,0,1,0,0,0|2,0,0]=3 762 B22R2.15786 CCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000210326_100010140906 [0,0,1,0,0,0|2,0,0]=3 763 B22R2.15786 CCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000210326 [0,0,1,0,0,0|2,0,0]=3 764 B22R2.15786 CCCCNCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_100000210211 [0,0,1,0,0,0|3,0,0]=4 765 B22R2.15786 CCCCNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100000210210 [0,0,1,0,0,0|3,0,0]=4 766 B22R2.15786 CCCCNCCOC(c1ccccc1)c2ccccc2 2230a_100000102301_100000734929 [0,0,1,0,0,0|3,0,0]=4 767 B22R2.15786 CCCCNCCOC(c1ccccc1)c2ccccc2 7a_106832991798_100000734929 [0,0,1,0,0,0|3,0,0]=4 768 B22R2.15786 CCCCOCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000743108 [0,0,1,0,0,0|3,0,0]=4 769 B22R2.15786 CCCCOCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000743108 [0,0,1,0,0,0|3,0,0]=4 770 B22R2.15786 CCCCOCCOC(c1ccccc1)c2ccccc2 34a_100000210227_100000734929 [0,0,1,0,0,0|3,0,0]=4 771 B22R2.15786 CCCCOCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000743108 [0,0,1,0,0,0|3,0,0]=4 772 B22R2.15786 CCCCOCCOC(c1ccccc1)c2ccccc2 7a_100000210227_100000734929 [0,0,1,0,0,0|3,0,0]=4 773 B22R2.15786 CCCCOCCOC(c1ccccc1)c2ccccc2 7a_100000210238_100011216954 [0,0,1,0,0,0|3,0,0]=4 774 B22R2.15786 CCCCOCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000743108 [0,0,1,0,0,0|3,0,0]=4 775 B22R2.15786 CCCCOCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000743108 [0,0,1,0,0,0|3,0,0]=4 776 B22R2.15786 CCCCOCCSC(c1ccccc1)c2ccccc2 62a_100000743108_100011216954 [0,0,1,0,0,0|3,0,0]=4 777 B22R2.15786 CCCCOCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011995733 [0,0,1,0,0,0|3,0,0]=4 778 B22R2.15786 CCCCOCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011995733 [0,0,1,0,0,0|3,0,0]=4 779 B22R2.15786 CCCCOCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100011995733 [0,0,1,0,0,0|3,0,0]=4 780 B22R2.15786 CCCCSCCNC(c1ccccc1)c2ccccc2 2230a_100025743550_100000211591 [0,0,1,0,0,0|3,0,0]=4 781 B22R2.15786 CCCCSCCNC(c1ccccc1)c2ccccc2 270004a_100025743550_100000210122 [0,0,1,0,0,0|3,0,0]=4 782 B22R2.15786 CCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000210211_100000734929 [0,0,1,0,0,0|3,0,0]=4 783 B22R2.15786 CCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000210210 [0,0,1,0,0,0|3,0,0]=4 784 B22R2.15786 CCCCSCCOC(c1ccccc1)c2ccccc2 7a_200000230436_100011216954 [0,0,1,0,0,0|3,0,0]=4 785 B22R2.15786 CCCOCCCNC(c1ccccc1)c2ccccc2 2230a_100011217757_100000211591 [0,0,1,0,0,0|3,0,0]=4 786 B22R2.15786 CCCOCCCNC(c1ccccc1)c2ccccc2 270004a_100011217757_100000210122 [0,0,1,0,0,0|3,0,0]=4 787 B22R2.15786 CCCOCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011215938 [0,0,1,0,0,0|3,0,0]=4 788 B22R2.15786 CCCOCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011215938 [0,0,1,0,0,0|3,0,0]=4 789 B22R2.15786 CCCOCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100011215938 [0,0,1,0,0,0|3,0,0]=4 790 B22R2.15786 CCCOCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100011215938 [0,0,1,0,0,0|3,0,0]=4 791 B22R2.15786 CCOCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100012232248 [0,0,1,0,0,0|3,0,0]=4 792 B22R2.15786 CCOCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100012232248 [0,0,1,0,0,0|3,0,0]=4 793 B22R2.15786 CCOCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100012232248 [0,0,1,0,0,0|3,0,0]=4 794 B22R2.15786 CCOCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100012232248 [0,0,1,0,0,0|3,0,0]=4 795 B22R2.15786 CCOCCNCC=C(c1ccccc1)c2ccccc2 270004a_102516460346_100000050448 [0,0,1,0,0,0|1,0,2]=4 796 B22R2.15786 CCOCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011215890 [0,0,1,0,0,0|1,0,0]=2 797 B22R2.15786 CCOCCNCCC(c1ccccc1)c2ccccc2 2230a_102516460346_100009813428 [0,0,1,0,0,0|1,0,0]=2 798 B22R2.15786 CCOCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000210147 [0,0,1,0,0,0|1,0,0]=2 799 B22R2.15786 CCOCCNCCC(c1ccccc1)c2ccccc2 34a_102516460346_100009813428 [0,0,1,0,0,0|1,0,0]=2 800 B22R2.15786 CCOCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100011215890 [0,0,1,0,0,0|2,0,0]=3 801 B22R2.15786 CCOCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000210147 [0,0,1,0,0,0|2,0,0]=3 802 B22R2.15786 CCOCCNCC[S+](c1ccccc1)c2ccccc2 2230a_102516460346_100010140906 [0,0,1,0,0,0|2,0,0]=3 803 B22R2.15786 CCOCCNN=CC(c1ccccc1)c2ccccc2 4a_100000732670_100000183636 [0,0,1,0,0,0|2,0,1]=4 804 B22R2.15786 CCOCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210147 [0,0,1,0,0,0|2,0,0]=3 805 B22R2.15786 CCOCCOCCC(c1ccccc1)c2ccccc2 34a_100000210136_100009813428 [0,0,1,0,0,0|2,0,0]=3 806 B22R2.15786 CCOCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011215890 [0,0,1,0,0,0|2,0,0]=3 807 B22R2.15786 CCOCCOCCC(c1ccccc1)c2ccccc2 7a_100000210136_100009813428 [0,0,1,0,0,0|2,0,0]=3 808 B22R2.15786 CCOCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000210147 [0,0,1,0,0,0|3,0,0]=4 809 B22R2.15786 CCOCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100011215890 [0,0,1,0,0,0|3,0,0]=4 810 B22R2.15786 CCOCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000210136_100010140906 [0,0,1,0,0,0|3,0,0]=4 811 B22R2.15786 CCOCCSCCC(c1ccccc1)c2ccccc2 62a_100000210147_100009813428 [0,0,1,0,0,0|2,0,0]=3 812 B22R2.15786 CCOCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011215890 [0,0,1,0,0,0|2,0,0]=3 813 B22R2.15786 CCOCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000210147_100010140906 [0,0,1,0,0,0|3,0,0]=4 814 B22R2.15786 CCOCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100011215890 [0,0,1,0,0,0|3,0,0]=4 815 B22R2.15786 CCSCCNCC=C(c1ccccc1)c2ccccc2 270004a_100000106463_100000050448 [0,0,1,0,0,0|1,0,2]=4 816 B22R2.15786 CCSCCNCCC(c1ccccc1)c2ccccc2 2230a_100000106463_100009813428 [0,0,1,0,0,0|1,0,0]=2 817 B22R2.15786 CCSCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000757381 [0,0,1,0,0,0|1,0,0]=2 818 B22R2.15786 CCSCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000757381 [0,0,1,0,0,0|1,0,0]=2 819 B22R2.15786 CCSCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000757381 [0,0,1,0,0,0|2,0,0]=3 820 B22R2.15786 CCSCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000757381 [0,0,1,0,0,0|2,0,0]=3 821 B22R2.15786 CCSCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000106463_100010140906 [0,0,1,0,0,0|2,0,0]=3 822 B22R2.15786 CCSCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000757381 [0,0,1,0,0,0|2,0,0]=3 823 B22R2.15786 CCSCCOCCC(c1ccccc1)c2ccccc2 34a_100000212035_100009813428 [0,0,1,0,0,0|2,0,0]=3 824 B22R2.15786 CCSCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000757381 [0,0,1,0,0,0|2,0,0]=3 825 B22R2.15786 CCSCCOCCC(c1ccccc1)c2ccccc2 7a_100000212035_100009813428 [0,0,1,0,0,0|2,0,0]=3 826 B22R2.15786 CCSCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000757381 [0,0,1,0,0,0|3,0,0]=4 827 B22R2.15786 CCSCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000757381 [0,0,1,0,0,0|3,0,0]=4 828 B22R2.15786 CCSCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000212035_100010140906 [0,0,1,0,0,0|3,0,0]=4 829 B22R2.15786 CCSCCSCCC(c1ccccc1)c2ccccc2 62a_100000757381_100009813428 [0,0,1,0,0,0|2,0,0]=3 830 B22R2.15786 CCSCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000757381 [0,0,1,0,0,0|2,0,0]=3 831 B22R2.15786 CCSCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000757381_100010140906 [0,0,1,0,0,0|3,0,0]=4 832 B22R2.15786 CCSCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000757381 [0,0,1,0,0,0|3,0,0]=4 833 B22R2.15786 CNCCCOCCC(c1ccccc1)c2ccccc2 34a_100000213112_100009813428 [0,0,1,0,0,0|2,0,0]=3 834 B22R2.15786 COCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000747528_100000211591 [0,0,1,0,0,0|3,0,0]=4 835 B22R2.15786 COCCCCCNC(c1ccccc1)c2ccccc2 270004a_100000747528_100000210122 [0,0,1,0,0,0|3,0,0]=4 836 B22R2.15786 COCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000730899 [0,0,1,0,0,0|3,0,0]=4 837 B22R2.15786 COCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000755781 [0,0,1,0,0,0|3,0,0]=4 838 B22R2.15786 COCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000755781 [0,0,1,0,0,0|3,0,0]=4 839 B22R2.15786 COCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000730899 [0,0,1,0,0,0|3,0,0]=4 840 B22R2.15786 COCCCNCC=C(c1ccccc1)c2ccccc2 270004a_100150723488_100000050448 [0,0,1,0,0,0|1,0,2]=4 841 B22R2.15786 COCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000740836 [0,0,1,0,0,0|1,0,0]=2 842 B22R2.15786 COCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000740836 [0,0,1,0,0,0|1,0,0]=2 843 B22R2.15786 COCCCNCCC(c1ccccc1)c2ccccc2 34a_100150723488_100009813428 [0,0,1,0,0,0|1,0,0]=2 844 B22R2.15786 COCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000740836 [0,0,1,0,0,0|2,0,0]=3 845 B22R2.15786 COCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000740836 [0,0,1,0,0,0|2,0,0]=3 846 B22R2.15786 COCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000740836 [0,0,1,0,0,0|2,0,0]=3 847 B22R2.15786 COCCCOCCC(c1ccccc1)c2ccccc2 34a_100000740835_100009813428 [0,0,1,0,0,0|2,0,0]=3 848 B22R2.15786 COCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000740836 [0,0,1,0,0,0|2,0,0]=3 849 B22R2.15786 COCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000740836 [0,0,1,0,0,0|3,0,0]=4 850 B22R2.15786 COCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000740836 [0,0,1,0,0,0|3,0,0]=4 851 B22R2.15786 COCCCSCCC(c1ccccc1)c2ccccc2 62a_100000709357_100009813428 [0,0,1,0,0,0|2,0,0]=3 852 B22R2.15786 COCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000709357 [0,0,1,0,0,0|2,0,0]=3 853 B22R2.15786 COCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000709357_100010140906 [0,0,1,0,0,0|3,0,0]=4 854 B22R2.15786 COCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000709357 [0,0,1,0,0,0|3,0,0]=4 855 B22R2.15786 CSCCCNCC=C(c1ccccc1)c2ccccc2 270004a_100000749238_100000050448 [0,0,1,0,0,0|1,0,2]=4 856 B22R2.15786 CSCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000749238_100009813428 [0,0,1,0,0,0|1,0,0]=2 857 B22R2.15786 CSCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000749238_100010140906 [0,0,1,0,0,0|2,0,0]=3 858 B22R2.15786 CSCCCOCCC(c1ccccc1)c2ccccc2 34a_100000690336_100009813428 [0,0,1,0,0,0|2,0,0]=3 859 B22R2.15786 CSCCCOCCC(c1ccccc1)c2ccccc2 7a_100000690336_100009813428 [0,0,1,0,0,0|2,0,0]=3 860 B22R2.15786 CSCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000690336_100010140906 [0,0,1,0,0,0|3,0,0]=4 861 B22R2.15786 ClCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000766143_100011216954 [0,0,1,0,0,0|3,0,0]=4 862 B22R2.15786 ClCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000210776_100009813428 [0,0,1,0,0,0|2,0,0]=3 863 B22R2.15786 ClCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000210776_100009813428 [0,0,1,0,0,0|2,0,0]=3 864 B22R2.15786 ClCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000210776_100010140906 [0,0,1,0,0,0|3,0,0]=4 865 B22R2.15786 FCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100015922095 [0,0,1,0,0,0|3,0,0]=4 866 B22R2.15786 FCCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100015922095 [0,0,1,0,0,0|3,0,0]=4 867 B22R2.15786 FCCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100015922095 [0,0,1,0,0,0|3,0,0]=4 868 B22R2.15786 FCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100015922095 [0,0,1,0,0,0|3,0,0]=4 869 B22R2.15786 FCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000732779_100011216954 [0,0,1,0,0,0|3,0,0]=4 870 B22R2.15786 FCCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000729378 [0,0,1,0,0,0|3,0,0]=4 871 B22R2.15786 FCCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000729378 [0,0,1,0,0,0|3,0,0]=4 872 B22R2.15786 FCCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000729378 [0,0,1,0,0,0|3,0,0]=4 873 B22R2.15786 FCCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000729378 [0,0,1,0,0,0|3,0,0]=4 874 B22R2.15786 FCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000729493 [0,0,1,0,0,0|1,0,0]=2 875 B22R2.15786 FCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000729493 [0,0,1,0,0,0|1,0,0]=2 876 B22R2.15786 FCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000729493 [0,0,1,0,0,0|2,0,0]=3 877 B22R2.15786 FCCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000729493 [0,0,1,0,0,0|2,0,0]=3 878 B22R2.15786 FCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000729493 [0,0,1,0,0,0|2,0,0]=3 879 B22R2.15786 FCCCCOCCC(c1ccccc1)c2ccccc2 34a_100011995726_100009813428 [0,0,1,0,0,0|2,0,0]=3 880 B22R2.15786 FCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000729493 [0,0,1,0,0,0|2,0,0]=3 881 B22R2.15786 FCCCCOCCC(c1ccccc1)c2ccccc2 7a_100011995726_100009813428 [0,0,1,0,0,0|2,0,0]=3 882 B22R2.15786 FCCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000729493 [0,0,1,0,0,0|3,0,0]=4 883 B22R2.15786 FCCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000729493 [0,0,1,0,0,0|3,0,0]=4 884 B22R2.15786 FCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100011995726_100010140906 [0,0,1,0,0,0|3,0,0]=4 885 B22R2.15786 FCCCCSCCC(c1ccccc1)c2ccccc2 62a_100000729493_100009813428 [0,0,1,0,0,0|2,0,0]=3 886 B22R2.15786 FCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000729493 [0,0,1,0,0,0|2,0,0]=3 887 B22R2.15786 FCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000729493_100010140906 [0,0,1,0,0,0|3,0,0]=4 888 B22R2.15786 FCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000729493 [0,0,1,0,0,0|3,0,0]=4 889 B22R2.15786 ICCCCOCCC(c1ccccc1)c2ccccc2 34a_200012148704_100009813428 [0,0,1,0,0,0|2,0,0]=3 890 B22R2.15786 N#CCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000687738 [0,0,1,0,0,0|1,0,1]=3 891 B22R2.15786 N#CCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000687738 [0,0,1,0,0,0|2,0,1]=4 892 B22R2.15786 N#CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000687738 [0,0,1,0,0,0|2,0,1]=4 893 B22R2.15786 N#CCCCSCCC(c1ccccc1)c2ccccc2 62a_100000687738_100009813428 [0,0,1,0,0,0|2,0,1]=4 894 B22R2.15786 N#CCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000687738 [0,0,1,0,0,0|2,0,1]=4 895 B22R2.15786 NCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000750430_100009813428 [0,0,1,0,0,0|2,0,0]=3 896 B22R2.15786 O=CCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_200011292268 [0,0,1,0,0,0|1,0,1]=3 897 B22R2.15786 O=CCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_200011292268 [0,0,1,0,0,0|2,0,1]=4 898 B22R2.15786 O=CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_200011292268 [0,0,1,0,0,0|2,0,1]=4 899 B22R2.15786 O=CCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_200011292268 [0,0,1,0,0,0|2,0,1]=4 900 B22R2.15786 O=CCCCSCCC(c1ccccc1)c2ccccc2 62a_200011292268_100009813428 [0,0,1,0,0,0|2,0,1]=4 901 B22R2.15786 OCC#CCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_200000047223 [0,0,1,0,0,0|1,0,2]=4 902 B22R2.15786 OCC#CCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_200000047223 [0,0,1,0,0,0|1,0,2]=4 903 B22R2.15786 OCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000766143 [0,0,1,0,0,0|3,0,0]=4 904 B22R2.15786 OCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000686447_100000211591 [0,0,1,0,0,0|3,0,0]=4 905 B22R2.15786 OCCCCCCNC(c1ccccc1)c2ccccc2 270004a_100000686447_100000210122 [0,0,1,0,0,0|3,0,0]=4 906 B22R2.15786 OCCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000766143 [0,0,1,0,0,0|3,0,0]=4 907 B22R2.15786 OCCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000766143 [0,0,1,0,0,0|3,0,0]=4 908 B22R2.15786 OCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000766143 [0,0,1,0,0,0|3,0,0]=4 909 B22R2.15786 OCCCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000766143 [0,0,1,0,0,0|3,0,0]=4 910 B22R2.15786 OCCCCCCSC(c1ccccc1)c2ccccc2 62a_100000766143_100011216954 [0,0,1,0,0,0|3,0,0]=4 911 B22R2.15786 OCCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000746330 [0,0,1,0,0,0|3,0,0]=4 912 B22R2.15786 OCCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000746330 [0,0,1,0,0,0|3,0,0]=4 913 B22R2.15786 OCCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000746330 [0,0,1,0,0,0|3,0,0]=4 914 B22R2.15786 OCCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000746330 [0,0,1,0,0,0|3,0,0]=4 915 B22R2.15786 OCCCCNCC=C(c1ccccc1)c2ccccc2 270004a_100000750430_100000050448 [0,0,1,0,0,0|1,0,2]=4 916 B22R2.15786 OCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000210776 [0,0,1,0,0,0|1,0,0]=2 917 B22R2.15786 OCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000750430_100009813428 [0,0,1,0,0,0|1,0,0]=2 918 B22R2.15786 OCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011216708 [0,0,1,0,0,0|1,0,0]=2 919 B22R2.15786 OCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000750430_100009813428 [0,0,1,0,0,0|1,0,0]=2 920 B22R2.15786 OCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000210776 [0,0,1,0,0,0|2,0,0]=3 921 B22R2.15786 OCCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100011216708 [0,0,1,0,0,0|2,0,0]=3 922 B22R2.15786 OCCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000750430_100010140906 [0,0,1,0,0,0|2,0,0]=3 923 B22R2.15786 OCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011216708 [0,0,1,0,0,0|2,0,0]=3 924 B22R2.15786 OCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210776 [0,0,1,0,0,0|2,0,0]=3 925 B22R2.15786 OCCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100011216708 [0,0,1,0,0,0|3,0,0]=4 926 B22R2.15786 OCCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000210776 [0,0,1,0,0,0|3,0,0]=4 927 B22R2.15786 OCCCCSCCC(c1ccccc1)c2ccccc2 62a_100000210776_100009813428 [0,0,1,0,0,0|2,0,0]=3 928 B22R2.15786 OCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000210776 [0,0,1,0,0,0|2,0,0]=3 929 B22R2.15786 OCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000210776_100010140906 [0,0,1,0,0,0|3,0,0]=4 930 B22R2.15786 OCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000210776 [0,0,1,0,0,0|3,0,0]=4 931 B22R2.150464 C#CCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000688953 [0,0,1,0,0,0|0,0,2]=3 932 B22R2.150464 C#CCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000730999 [0,0,1,0,0,0|0,0,2]=3 933 B22R2.150464 C#CCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000688953 [0,0,1,0,0,0|0,0,2]=3 934 B22R2.150464 C/C=C/CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100102629194 [0,0,1,0,0,0|0,0,2]=3 935 B22R2.150464 C/C=C/CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100102629194 [0,0,1,0,0,0|0,0,2]=3 936 B22R2.150464 C=CCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100020639649_100009813428 [0,0,1,0,0,0|0,0,2]=3 937 B22R2.150464 C=CCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000754431 [0,0,1,0,0,0|0,0,2]=3 938 B22R2.150464 C=CCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100020639649_100009813428 [0,0,1,0,0,0|0,0,2]=3 939 B22R2.150464 C=CCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000754431 [0,0,1,0,0,0|0,0,2]=3 940 B22R2.150464 C=CCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000754431 [0,0,1,0,0,0|0,0,2]=3 941 B22R2.150464 C=CCCN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100020639649_100010140906 [0,0,1,0,0,0|1,0,2]=4 942 B22R2.150464 C=CCCN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100020639649_100010140906 [0,0,1,0,0,0|1,0,2]=4 943 B22R2.150464 CC#CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000748600 [0,0,1,0,0,0|0,0,2]=3 944 B22R2.150464 CC#CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000748600 [0,0,1,0,0,0|0,0,2]=3 945 B22R2.150464 CC=CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000070051 [0,0,1,0,0,0|0,0,2]=3 946 B22R2.150464 CC=CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000070051 [0,0,1,0,0,0|0,0,2]=3 947 B22R2.150464 CCCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000210183_100009813428 [0,0,1,0,0,0|2,0,0]=3 948 B22R2.150464 CCCCC(=O)CCP(c1ccccc1)c2ccccc2 1458a_100020644332_100000210211 [0,0,1,0,0,0|3,0,0]=4 949 B22R2.150464 CCCCC(=O)CC[S+](c1ccccc1)c2ccccc2 1458a_100000210183_100010140906 [0,0,1,0,0,0|3,0,0]=4 950 B22R2.150464 CCCCC(=O)CSC(c1ccccc1)c2ccccc2 1458a_100000683935_100000210211 [0,0,1,0,0,0|3,0,0]=4 951 B22R2.150464 CCCCC(=O)NCC(c1ccccc1)c2ccccc2 1626a_100000739227_100000210183 [0,0,1,0,0,0|3,0,0]=4 952 B22R2.150464 CCCCC(=O)NCC(c1ccccc1)c2ccccc2 240690a_100000739227_100000210183 [0,0,1,0,0,0|3,0,0]=4 953 B22R2.150464 CCCCC(=O)NCC(c1ccccc1)c2ccccc2 527a_100000739227_100000210183 [0,0,1,0,0,0|3,0,0]=4 954 B22R2.150464 CCCCC(C)COC(c1ccccc1)c2ccccc2 7a_100011995851_100011216954 [0,0,1,0,0,0|2,0,0]=3 955 B22R2.150464 CCCCC(C)NCC(c1ccccc1)c2ccccc2 2230a_100000739227_200011215066 [0,0,1,0,0,0|2,0,0]=3 956 B22R2.150464 CCCCC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000210087 [0,0,1,0,0,0|2,0,0]=3 957 B22R2.150464 CCCCC(C)NCC(c1ccccc1)c2ccccc2 34a_100000739227_200011215066 [0,0,1,0,0,0|2,0,0]=3 958 B22R2.150464 CCCCC(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_200011215066 [0,0,1,0,0,0|2,0,0]=3 959 B22R2.150464 CCCCC(C)OCC(c1ccccc1)c2ccccc2 7a_100011215272_200011215066 [0,0,1,0,0,0|2,0,0]=3 960 B22R2.150464 CCCCN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100000207549_100000050448 [0,0,1,0,0,0|0,0,2]=3 961 B22R2.150464 CCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000207549_100009813428 [0,0,1,0,0,0|0,0,0]=1 962 B22R2.150464 CCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000210211 [0,0,1,0,0,0|0,0,0]=1 963 B22R2.150464 CCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000207549_100009813428 [0,0,1,0,0,0|0,0,0]=1 964 B22R2.150464 CCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000210211 [0,0,1,0,0,0|0,0,0]=1 965 B22R2.150464 CCCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000210210 [0,0,1,0,0,0|0,0,0]=1 966 B22R2.150464 CCCCN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100000207549_100010140906 [0,0,1,0,0,0|1,0,0]=2 967 B22R2.150464 CCCCN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100000207549_100010140906 [0,0,1,0,0,0|1,0,0]=2 968 B22R2.150464 CCCOC(C)CNC(c1ccccc1)c2ccccc2 2230a_100015185124_100000211591 [0,0,1,0,0,0|3,0,0]=4 969 B22R2.150464 CCCOC(C)CNC(c1ccccc1)c2ccccc2 270004a_100015185124_100000210122 [0,0,1,0,0,0|3,0,0]=4 970 B22R2.150464 CCOCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000211967_100009813428 [0,0,1,0,0,0|3,0,0]=4 971 B22R2.150464 CCOCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000739092 [0,0,1,0,0,0|1,0,0]=2 972 B22R2.150464 CCSCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000230394_100009813428 [0,0,1,0,0,0|3,0,0]=4 973 B22R2.150464 CCSCC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_200011216171 [0,0,1,0,0,0|3,0,0]=4 974 B22R2.150464 CN(CC=C(c1ccccc1)c2ccccc2)CCCO 270004a_100000213112_100000050448 [0,0,1,0,0,0|1,0,2]=4 975 B22R2.150464 CN(CCC#N)CCC(c1ccccc1)c2ccccc2 2230a_100000184479_100009813428 [0,0,1,0,0,0|1,0,1]=3 976 B22R2.150464 CN(CCC#N)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100011215226 [0,0,1,0,0,0|1,0,1]=3 977 B22R2.150464 CN(CCC#N)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100011215226 [0,0,1,0,0,0|1,0,1]=3 978 B22R2.150464 CN(CCC#N)CC[S+](c1ccccc1)c2ccccc2 2230a_100000184479_100010140906 [0,0,1,0,0,0|2,0,1]=4 979 B22R2.150464 CN(CCC(c1ccccc1)c2ccccc2)CSC#N 269982a_100025726140_100000211825 [0,0,1,0,0,0|2,0,1]=4 980 B22R2.150464 CN(CCCF)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100011934791 [0,0,1,0,0,0|1,0,0]=2 981 B22R2.150464 CN(CCCF)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100011934791 [0,0,1,0,0,0|1,0,0]=2 982 B22R2.150464 CN(CCCF)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100011934791 [0,0,1,0,0,0|1,0,0]=2 983 B22R2.150464 CN(CCCO)CCC(c1ccccc1)c2ccccc2 2230a_100000213112_100009813428 [0,0,1,0,0,0|1,0,0]=2 984 B22R2.150464 CN(CCCO)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000230001 [0,0,1,0,0,0|1,0,0]=2 985 B22R2.150464 CN(CCCO)CCC(c1ccccc1)c2ccccc2 269982a_100000213112_100009813428 [0,0,1,0,0,0|1,0,0]=2 986 B22R2.150464 CN(CCCO)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100011215043 [0,0,1,0,0,0|1,0,0]=2 987 B22R2.150464 CN(CCCO)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000230001 [0,0,1,0,0,0|1,0,0]=2 988 B22R2.150464 CN(CCCO)CC[S+](c1ccccc1)c2ccccc2 2230a_100000213112_100010140906 [0,0,1,0,0,0|2,0,0]=3 989 B22R2.150464 CN(CCCO)CC[S+](c1ccccc1)c2ccccc2 269982a_100000213112_100010140906 [0,0,1,0,0,0|2,0,0]=3 990 B22R2.150464 COCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000749529_100009813428 [0,0,1,0,0,0|3,0,0]=4 991 B22R2.150464 COCCC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000742357 [0,0,1,0,0,0|3,0,0]=4 992 B22R2.150464 COCCN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100000743101_100000050448 [0,0,1,0,0,0|1,0,2]=4 993 B22R2.150464 COCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000743101_100009813428 [0,0,1,0,0,0|1,0,0]=2 994 B22R2.150464 COCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100011201679 [0,0,1,0,0,0|1,0,0]=2 995 B22R2.150464 COCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000743101_100009813428 [0,0,1,0,0,0|1,0,0]=2 996 B22R2.150464 COCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000233755 [0,0,1,0,0,0|1,0,0]=2 997 B22R2.150464 COCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100011201679 [0,0,1,0,0,0|1,0,0]=2 998 B22R2.150464 COCCN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100000743101_100010140906 [0,0,1,0,0,0|2,0,0]=3 999 B22R2.150464 COCCN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100000743101_100010140906 [0,0,1,0,0,0|2,0,0]=3 1000 B22R2.150464 CSCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000174002_100009813428 [0,0,1,0,0,0|3,0,0]=4 1001 B22R2.150464 CSCCC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100011217047 [0,0,1,0,0,0|3,0,0]=4 1002 B22R2.150464 CSCCN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100000686725_100000050448 [0,0,1,0,0,0|1,0,2]=4 1003 B22R2.150464 CSCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000686725_100009813428 [0,0,1,0,0,0|1,0,0]=2 1004 B22R2.150464 CSCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000751147 [0,0,1,0,0,0|1,0,0]=2 1005 B22R2.150464 CSCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000686725_100009813428 [0,0,1,0,0,0|1,0,0]=2 1006 B22R2.150464 CSCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000212216 [0,0,1,0,0,0|1,0,0]=2 1007 B22R2.150464 CSCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000212216 [0,0,1,0,0,0|1,0,0]=2 1008 B22R2.150464 CSCCN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100000686725_100010140906 [0,0,1,0,0,0|2,0,0]=3 1009 B22R2.150464 CSCCN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100000686725_100010140906 [0,0,1,0,0,0|2,0,0]=3 1010 B22R2.150464 C[C@H](CCCO)CNC(c1ccccc1)c2ccccc2 2230a_100160569302_100000211591 [0,0,1,0,0,0|3,0,0]=4 1011 B22R2.150464 C[C@H](CCCO)CNC(c1ccccc1)c2ccccc2 270004a_100160569302_100000210122 [0,0,1,0,0,0|3,0,0]=4 1012 B22R2.718999 C#CCN(CC)CCC(c1ccccc1)c2ccccc2 2230a_100000744766_100009813428 [0,0,1,0,0,0|0,0,2]=3 1013 B22R2.718999 C#CCN(CC)CCC(c1ccccc1)c2ccccc2 269982a_100000744766_100009813428 [0,0,1,0,0,0|0,0,2]=3 1014 B22R2.718999 C#CCN(CC)CC[S+](c1ccccc1)c2ccccc2 2230a_100000744766_100010140906 [0,0,1,0,0,0|1,0,2]=4 1015 B22R2.718999 C#CCN(CC)CC[S+](c1ccccc1)c2ccccc2 269982a_100000744766_100010140906 [0,0,1,0,0,0|1,0,2]=4 1016 B22R2.718999 CCC(COC)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000757811 [0,0,1,0,0,0|3,0,0]=4 1017 B22R2.718999 CCCC(CC)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000687865 [0,0,1,0,0,0|2,0,0]=3 1018 B22R2.718999 CCCC(CC)OCC(c1ccccc1)c2ccccc2 7a_100011215272_100011219200 [0,0,1,0,0,0|2,0,0]=3 1019 B22R2.718999 CCCN(CC)CC=C(c1ccccc1)c2ccccc2 270004a_100000226822_100000050448 [0,0,1,0,0,0|0,0,2]=3 1020 B22R2.718999 CCCN(CC)CCC(c1ccccc1)c2ccccc2 2230a_100000226822_100009813428 [0,0,1,0,0,0|0,0,0]=1 1021 B22R2.718999 CCCN(CC)CCC(c1ccccc1)c2ccccc2 269982a_100000226822_100009813428 [0,0,1,0,0,0|0,0,0]=1 1022 B22R2.718999 CCCN(CC)CC[S+](c1ccccc1)c2ccccc2 2230a_100000226822_100010140906 [0,0,1,0,0,0|1,0,0]=2 1023 B22R2.718999 CCCN(CC)CC[S+](c1ccccc1)c2ccccc2 269982a_100000226822_100010140906 [0,0,1,0,0,0|1,0,0]=2 1024 B22R2.718999 CCN(CC=C(c1ccccc1)c2ccccc2)CCO 270004a_100000210973_100000050448 [0,0,1,0,0,0|1,0,2]=4 1025 B22R2.718999 CCN(CCO)CCC(c1ccccc1)c2ccccc2 2230a_100000210973_100009813428 [0,0,1,0,0,0|1,0,0]=2 1026 B22R2.718999 CCN(CCO)CCC(c1ccccc1)c2ccccc2 269982a_100000210973_100009813428 [0,0,1,0,0,0|1,0,0]=2 1027 B22R2.718999 CCN(CCO)CC[S+](c1ccccc1)c2ccccc2 2230a_100000210973_100010140906 [0,0,1,0,0,0|2,0,0]=3 1028 B22R2.718999 CCN(CCO)CC[S+](c1ccccc1)c2ccccc2 269982a_100000210973_100010140906 [0,0,1,0,0,0|2,0,0]=3 1029 B22R2.718999 CCOC(CC)CNC(c1ccccc1)c2ccccc2 2230a_100015183923_100000211591 [0,0,1,0,0,0|3,0,0]=4 1030 B22R2.718999 CCOC(CC)CNC(c1ccccc1)c2ccccc2 270004a_100015183923_100000210122 [0,0,1,0,0,0|3,0,0]=4 1031 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2CNC4CCCCC4 270004a_100016995487_100000210434 [0,0,0,1,0,0|2,0,0]=3 1032 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2CNC4CCCCC4 34a_100016995487_100000210327 [0,0,0,1,0,0|2,0,0]=3 1033 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2CNC4CCCOC4 270004a_100016995487_100000753404 [0,0,0,1,0,0|3,0,0]=4 1034 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2CNC4CCCOC4 34a_100016995487_100000693364 [0,0,0,1,0,0|3,0,0]=4 1035 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2CNC4CCCSC4 270004a_100016995487_100000057913 [0,0,0,1,0,0|3,0,0]=4 1036 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2CNC4CCNCC4 270004a_100016995487_100015192401 [0,0,0,1,0,0|3,0,0]=4 1037 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2CNC4CCOCC4 270004a_100016995487_100011217826 [0,0,0,1,0,0|3,0,0]=4 1038 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2CNC4CCSCC4 270004a_100016995487_100000203788 [0,0,0,1,0,0|3,0,0]=4 1039 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2CNC4CCSCC4 34a_100016995487_100000069128 [0,0,0,1,0,0|3,0,0]=4 1040 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2COC4CCCCC4 34a_100011215202_100000210327 [0,0,0,1,0,0|2,0,0]=3 1041 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2COC4CCCCC4 7a_100011215202_100000210327 [0,0,0,1,0,0|2,0,0]=3 1042 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2COC4CCCOC4 34a_100011215202_100000693364 [0,0,0,1,0,0|3,0,0]=4 1043 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2COC4CCCOC4 7a_100011215202_100000693364 [0,0,0,1,0,0|3,0,0]=4 1044 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2COC4CCOCC4 7a_100011215202_100000686592 [0,0,0,1,0,0|3,0,0]=4 1045 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2COC4CCSCC4 34a_100011215202_100000069128 [0,0,0,1,0,0|3,0,0]=4 1046 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2COC4CCSCC4 7a_100011215202_100011500858 [0,0,0,1,0,0|3,0,0]=4 1047 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCC4 2230a_100000104097_100000211423 [0,0,0,1,0,0|2,0,0]=3 1048 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCC4 2230a_100000210473_100000211598 [0,0,0,1,0,0|2,0,0]=3 1049 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCC4 269862a_100000104097_100000211278 [0,0,0,1,0,0|2,0,0]=3 1050 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCO4 2230a_100000104097_100000211543 [0,0,0,1,0,0|3,0,0]=4 1051 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCO4 2230a_100000174945_100000211598 [0,0,0,1,0,0|3,0,0]=4 1052 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCCOC4 2230a_100000104097_100000741521 [0,0,0,1,0,0|3,0,0]=4 1053 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCCOC4 2230a_100000720124_100000211598 [0,0,0,1,0,0|3,0,0]=4 1054 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCOCC4 2230a_100000104097_100000754603 [0,0,0,1,0,0|3,0,0]=4 1055 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCOCC4 2230a_100000746373_100000211598 [0,0,0,1,0,0|3,0,0]=4 1056 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCOCC4 269862a_100000104097_100000749017 [0,0,0,1,0,0|3,0,0]=4 1057 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCSCC4 2230a_100015188806_100000211598 [0,0,0,1,0,0|3,0,0]=4 1058 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCSCC4 269862a_100000104097_100000067145 [0,0,0,1,0,0|3,0,0]=4 1059 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCSCC4 270004a_100000104097_100000067145 [0,0,0,1,0,0|3,0,0]=4 1060 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2OCC4CCCCC4 7a_100000211495_100000211423 [0,0,0,1,0,0|2,0,0]=3 1061 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2OCC4CCCCC4 7a_100000212181_100000211598 [0,0,0,1,0,0|2,0,0]=3 1062 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2OCC4CCCCO4 7a_100000211370_100000211598 [0,0,0,1,0,0|3,0,0]=4 1063 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2OCC4CCCCO4 7a_100000211495_100000211543 [0,0,0,1,0,0|3,0,0]=4 1064 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2OCC4CCCOC4 7a_100000211495_100000741521 [0,0,0,1,0,0|3,0,0]=4 1065 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2OCC4CCOCC4 7a_100000211495_100000754603 [0,0,0,1,0,0|3,0,0]=4 1066 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2OCC4CCSCC4 7a_100000070558_100000211598 [0,0,0,1,0,0|3,0,0]=4 1067 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2SCC4CCCCO4 62a_100000211598_100000211543 [0,0,0,1,0,0|3,0,0]=4 1068 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2SCC4CCCOC4 62a_100000211598_100000741521 [0,0,0,1,0,0|3,0,0]=4 1069 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2SCC4CCOCC4 62a_100000211598_100000749018 [0,0,0,1,0,0|3,0,0]=4 1070 B24R4.1586261 c1ccc(cc1)C(CNC2CCC3C2C3)c4ccccc4 269862a_100000739227_100000692480 [0,0,0,1,0,0|2,0,0]=3 1071 B24R4.1586261 c1ccc(cc1)C(CNC2CCC3C2C3)c4ccccc4 270004a_100000739227_100000692480 [0,0,0,1,0,0|2,0,0]=3 1072 B24R4.1586265 c1ccc(cc1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000162943_100009813300 [0,0,0,1,0,0|2,0,0]=3 1073 B24R4.1586265 c1ccc(cc1)C(OC2C3CCC2CC3)c4ccccc4 34a_100000211180_100009813300 [0,0,0,1,0,0|2,0,0]=3 1074 B24R4.1586265 c1ccc(cc1)C(SC2C3CCC2CC3)c4ccccc4 62a_100000211591_100009813300 [0,0,0,1,0,0|2,0,0]=3 1075 B24R4.1586265 c1ccc(cc1)C(SC2C3CCC2CC3)c4ccccc4 62a_100009813300_100011216954 [0,0,0,1,0,0|2,0,0]=3 1076 B24R4.6579748 C(=C(c1ccccc1)c2ccccc2)CN3CC4CC4C3 270004a_100000741873_100000050448 [0,0,0,1,0,0|0,0,2]=3 1077 B24R4.6579748 c1ccc(cc1)C(CCN2CC3CC3C2)c4ccccc4 2230a_100000741873_100009813428 [0,0,0,1,0,0|0,0,0]=1 1078 B24R4.6579748 c1ccc(cc1)C(CCN2CC3CC3C2)c4ccccc4 269982a_100000741873_100009813428 [0,0,0,1,0,0|0,0,0]=1 1079 B24R4.6579748 c1ccc(cc1)C(CCN2CC3CC3C2)c4ccccc4 34a_100000741873_100009813428 [0,0,0,1,0,0|0,0,0]=1 1080 B24R4.6579748 c1ccc(cc1)C(CNC2CC3CC3C2)c4ccccc4 270004a_100000739227_100010340937 [0,0,0,1,0,0|2,0,0]=3 1081 B24R4.6579748 c1ccc(cc1)[S+](CCN2CC3CC3C2)c4ccccc4 2230a_100000741873_100010140906 [0,0,0,1,0,0|1,0,0]=2 1082 B24R4.6579748 c1ccc(cc1)[S+](CCN2CC3CC3C2)c4ccccc4 269982a_100000741873_100010140906 [0,0,0,1,0,0|1,0,0]=2 1083 B24R4.6581432 c1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 2230a_100000750499_100000211591 [0,0,0,1,0,0|2,0,0]=3 1084 B24R4.6581432 c1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 269982a_100000750499_100000211591 [0,0,0,1,0,0|2,0,0]=3 1085 B24R4.6581432 c1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100000210122 [0,0,0,1,0,0|2,0,0]=3 1086 B24R4.6581432 c1ccc(cc1)C(c2ccccn2)N3CC4CCC3CC4 270004a_100000750499_100000210380 [0,0,0,1,0,0|3,0,0]=4 1087 B24R4.6581432 c1ccc(cc1)C(c2cccnc2)N3CC4CCC3CC4 270004a_100000750499_100000735413 [0,0,0,1,0,0|3,0,0]=4 1088 B22R3.3728 c1ccc(cc1)C(NC2CCCCC2)c3ccccc3 2230a_100000182618_100000211591 [0,0,0,0,1,0|2,0,0]=3 1089 B22R3.3728 c1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000162943_100000210434 [0,0,0,0,1,0|2,0,0]=3 1090 B22R3.3728 c1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000210122 [0,0,0,0,1,0|2,0,0]=3 1091 B22R3.3728 c1ccc(cc1)C(NC2CCCCC2)c3ccccc3 34a_100000162943_100000210327 [0,0,0,0,1,0|2,0,0]=3 1092 B22R3.3728 c1ccc(cc1)C(NC2CCCCC2)c3ccccn3 270004a_100000182618_100000210380 [0,0,0,0,1,0|3,0,0]=4 1093 B22R3.3728 c1ccc(cc1)C(NC2CCCCC2)c3ccccn3 270004a_100000689936_100000210434 [0,0,0,0,1,0|3,0,0]=4 1094 B22R3.3728 c1ccc(cc1)C(NC2CCCCC2)c3cccnc3 270004a_100000182618_100000735413 [0,0,0,0,1,0|3,0,0]=4 1095 B22R3.3728 c1ccc(cc1)C(NC2CCCCC2)c3cccnc3 270004a_100011232609_100000210434 [0,0,0,0,1,0|3,0,0]=4 1096 B22R3.3728 c1ccc(cc1)C(NC2CCCCC2)c3ccncc3 270004a_100025760769_100000210434 [0,0,0,0,1,0|3,0,0]=4 1097 B22R3.3728 c1ccc(cc1)C(NC2CCCOC2)c3ccccc3 2230a_100000719290_100000211591 [0,0,0,0,1,0|3,0,0]=4 1098 B22R3.3728 c1ccc(cc1)C(NC2CCCOC2)c3ccccc3 270004a_100000162943_100000753404 [0,0,0,0,1,0|3,0,0]=4 1099 B22R3.3728 c1ccc(cc1)C(NC2CCCOC2)c3ccccc3 270004a_100000719290_100000210122 [0,0,0,0,1,0|3,0,0]=4 1100 B22R3.3728 c1ccc(cc1)C(NC2CCCOC2)c3ccccc3 34a_100000162943_100000693364 [0,0,0,0,1,0|3,0,0]=4 1101 B22R3.3728 c1ccc(cc1)C(NC2CCCSC2)c3ccccc3 270004a_100000162943_100000057913 [0,0,0,0,1,0|3,0,0]=4 1102 B22R3.3728 c1ccc(cc1)C(NC2CCNCC2)c3ccccc3 270004a_100000162943_100015192401 [0,0,0,0,1,0|3,0,0]=4 1103 B22R3.3728 c1ccc(cc1)C(NC2CCOCC2)c3ccccc3 2230a_100000741149_100000211591 [0,0,0,0,1,0|3,0,0]=4 1104 B22R3.3728 c1ccc(cc1)C(NC2CCOCC2)c3ccccc3 270004a_100000162943_100011217826 [0,0,0,0,1,0|3,0,0]=4 1105 B22R3.3728 c1ccc(cc1)C(NC2CCOCC2)c3ccccc3 270004a_100000741149_100000210122 [0,0,0,0,1,0|3,0,0]=4 1106 B22R3.3728 c1ccc(cc1)C(NC2CCSCC2)c3ccccc3 2230a_100000748639_100000211591 [0,0,0,0,1,0|3,0,0]=4 1107 B22R3.3728 c1ccc(cc1)C(NC2CCSCC2)c3ccccc3 270004a_100000162943_100000203788 [0,0,0,0,1,0|3,0,0]=4 1108 B22R3.3728 c1ccc(cc1)C(NC2CCSCC2)c3ccccc3 270004a_100000748639_100000210122 [0,0,0,0,1,0|3,0,0]=4 1109 B22R3.3728 c1ccc(cc1)C(NC2CCSCC2)c3ccccc3 34a_100000162943_100000069128 [0,0,0,0,1,0|3,0,0]=4 1110 B22R3.3728 c1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_100000211180_100000210327 [0,0,0,0,1,0|2,0,0]=3 1111 B22R3.3728 c1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100000210231_100011216954 [0,0,0,0,1,0|2,0,0]=3 1112 B22R3.3728 c1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100000211180_100000210327 [0,0,0,0,1,0|2,0,0]=3 1113 B22R3.3728 c1ccc(cc1)C(OC2CCCCC2)c3ccccn3 7a_100000180852_100000210327 [0,0,0,0,1,0|3,0,0]=4 1114 B22R3.3728 c1ccc(cc1)C(OC2CCCOC2)c3ccccc3 34a_100000211180_100000693364 [0,0,0,0,1,0|3,0,0]=4 1115 B22R3.3728 c1ccc(cc1)C(OC2CCCOC2)c3ccccc3 7a_100000211180_100000693364 [0,0,0,0,1,0|3,0,0]=4 1116 B22R3.3728 c1ccc(cc1)C(OC2CCCSC2)c3ccccc3 7a_100015962668_100011216954 [0,0,0,0,1,0|3,0,0]=4 1117 B22R3.3728 c1ccc(cc1)C(OC2CCOCC2)c3ccccc3 7a_100000211180_100000686592 [0,0,0,0,1,0|3,0,0]=4 1118 B22R3.3728 c1ccc(cc1)C(OC2CCSCC2)c3ccccc3 34a_100000211180_100000069128 [0,0,0,0,1,0|3,0,0]=4 1119 B22R3.3728 c1ccc(cc1)C(OC2CCSCC2)c3ccccc3 7a_100000211180_100011500858 [0,0,0,0,1,0|3,0,0]=4 1120 B22R3.3728 c1ccc(cc1)C(OC2CCSCC2)c3ccccc3 7a_100000731022_100011216954 [0,0,0,0,1,0|3,0,0]=4 1121 B22R3.3728 c1ccc(cc1)C(SC2CCCCC2)c3ccccc3 62a_100000210327_100011216954 [0,0,0,0,1,0|2,0,0]=3 1122 B22R3.3728 c1ccc(cc1)C(SC2CCCCC2)c3ccccc3 62a_100000211591_100000210327 [0,0,0,0,1,0|2,0,0]=3 1123 B22R3.3728 c1ccc(cc1)C(SC2CCCOC2)c3ccccc3 62a_100000211591_100000693364 [0,0,0,0,1,0|3,0,0]=4 1124 B22R3.3728 c1ccc(cc1)C(SC2CCOCC2)c3ccccc3 62a_100000211591_100011324220 [0,0,0,0,1,0|3,0,0]=4 1125 B22R3.3728 c1ccc(cc1)C(SC2CCSCC2)c3ccccc3 62a_100000211591_100000069128 [0,0,0,0,1,0|3,0,0]=4 1126 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3ccco3 2230a_100015185865_100000211423 [0,0,0,0,1,0|3,0,0]=4 1127 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3ccco3 269862a_100015185865_100000211278 [0,0,0,0,1,0|3,0,0]=4 1128 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3ccco3 34a_100015185865_100000211423 [0,0,0,0,1,0|3,0,0]=4 1129 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3cccs3 2230a_100025760362_100000211423 [0,0,0,0,1,0|3,0,0]=4 1130 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3cccs3 269862a_100025760362_100000211278 [0,0,0,0,1,0|3,0,0]=4 1131 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3cccs3 270004a_100000210473_100011214959 [0,0,0,0,1,0|3,0,0]=4 1132 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3cccs3 34a_100025760362_100000211423 [0,0,0,0,1,0|3,0,0]=4 1133 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3ccoc3 2230a_100102946537_100000211423 [0,0,0,0,1,0|3,0,0]=4 1134 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3ccoc3 269862a_100102946537_100000211278 [0,0,0,0,1,0|3,0,0]=4 1135 B22R3.74155 c1ccc(cc1)C(NCC2CCCCC2)c3ccoc3 34a_100102946537_100000211423 [0,0,0,0,1,0|3,0,0]=4 1136 B22R3.74289 C(=C(c1ccccc1)c2ccccc2)CN3CCCC3 270004a_100000188435_100000050448 [0,0,0,0,1,0|0,0,2]=3 1137 B22R3.74289 C(=C(c1ccccc1)c2ccccc2)CN3CCSC3 270004a_100011215254_100000050448 [0,0,0,0,1,0|1,0,2]=4 1138 B22R3.74289 C1=CCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100015195280_100009813428 [0,0,0,0,1,0|0,0,2]=3 1139 B22R3.74289 C1=CCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100015195280_100010140906 [0,0,0,0,1,0|1,0,2]=4 1140 B22R3.74289 c1ccc(cc1)C(CCN2CCCC2)c3ccccc3 2230a_100000188435_100009813428 [0,0,0,0,1,0|0,0,0]=1 1141 B22R3.74289 c1ccc(cc1)C(CCN2CCCC2)c3ccccc3 269982a_100000188435_100009813428 [0,0,0,0,1,0|0,0,0]=1 1142 B22R3.74289 c1ccc(cc1)C(CCN2CCSC2)c3ccccc3 2230a_100011215254_100009813428 [0,0,0,0,1,0|1,0,0]=2 1143 B22R3.74289 c1ccc(cc1)C(CCN2CCSC2)c3ccccc3 269982a_100011215254_100009813428 [0,0,0,0,1,0|1,0,0]=2 1144 B22R3.74289 c1ccc(cc1)C(CNC2CCCC2)c3ccccc3 2230a_100000739227_100000179811 [0,0,0,0,1,0|2,0,0]=3 1145 B22R3.74289 c1ccc(cc1)C(CNC2CCCC2)c3ccccc3 270004a_100000739227_100000210133 [0,0,0,0,1,0|2,0,0]=3 1146 B22R3.74289 c1ccc(cc1)C(CNC2CCCC2)c3ccccc3 34a_100000739227_100000179811 [0,0,0,0,1,0|2,0,0]=3 1147 B22R3.74289 c1ccc(cc1)C(CNC2CCOC2)c3ccccc3 2230a_100000739227_100000731011 [0,0,0,0,1,0|3,0,0]=4 1148 B22R3.74289 c1ccc(cc1)C(CNC2CCOC2)c3ccccc3 270004a_100000739227_100000752484 [0,0,0,0,1,0|3,0,0]=4 1149 B22R3.74289 c1ccc(cc1)C(CNC2CCOC2)c3ccccc3 34a_100000739227_100000690089 [0,0,0,0,1,0|3,0,0]=4 1150 B22R3.74289 c1ccc(cc1)C(CNC2CCSC2)c3ccccc3 270004a_100000739227_100000212027 [0,0,0,0,1,0|3,0,0]=4 1151 B22R3.74289 c1ccc(cc1)C(COC2CCCC2)c3ccccc3 34a_100011215272_100000179811 [0,0,0,0,1,0|2,0,0]=3 1152 B22R3.74289 c1ccc(cc1)C(COC2CCCC2)c3ccccc3 7a_100011215272_100000179811 [0,0,0,0,1,0|2,0,0]=3 1153 B22R3.74289 c1ccc(cc1)C(COC2CCOC2)c3ccccc3 34a_100011215272_100000690089 [0,0,0,0,1,0|3,0,0]=4 1154 B22R3.74289 c1ccc(cc1)C(COC2CCOC2)c3ccccc3 7a_100011215272_100000731011 [0,0,0,0,1,0|3,0,0]=4 1155 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccccc3 2230a_100000162943_100000740388 [0,0,0,0,1,0|2,0,0]=3 1156 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccccc3 2230a_100000737975_100000211591 [0,0,0,0,1,0|2,0,0]=3 1157 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccccc3 269862a_100000162943_100000746403 [0,0,0,0,1,0|2,0,0]=3 1158 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100000210122 [0,0,0,0,1,0|2,0,0]=3 1159 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccccc3 34a_100000162943_100000740388 [0,0,0,0,1,0|2,0,0]=3 1160 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccccn3 2230a_100000689936_100000740388 [0,0,0,0,1,0|3,0,0]=4 1161 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccccn3 269862a_100000689936_100000746403 [0,0,0,0,1,0|3,0,0]=4 1162 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccccn3 270004a_100000737975_100000210380 [0,0,0,0,1,0|3,0,0]=4 1163 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3cccnc3 2230a_100011232609_100000740388 [0,0,0,0,1,0|3,0,0]=4 1164 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3cccnc3 270004a_100000737975_100000735413 [0,0,0,0,1,0|3,0,0]=4 1165 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccncc3 2230a_100025760769_100000740388 [0,0,0,0,1,0|3,0,0]=4 1166 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccncc3 269862a_100025760769_100000746403 [0,0,0,0,1,0|3,0,0]=4 1167 B22R3.74289 c1ccc(cc1)C(NCC2CCCO2)c3ccccc3 2230a_100000162943_100000203698 [0,0,0,0,1,0|3,0,0]=4 1168 B22R3.74289 c1ccc(cc1)C(NCC2CCOC2)c3ccccc3 2230a_100000162943_100000702531 [0,0,0,0,1,0|3,0,0]=4 1169 B22R3.74289 c1ccc(cc1)C(NCC2CCOC2)c3ccccc3 2230a_100000737293_100000211591 [0,0,0,0,1,0|3,0,0]=4 1170 B22R3.74289 c1ccc(cc1)C(NCC2CCOC2)c3ccccc3 270004a_100000737293_100000210122 [0,0,0,0,1,0|3,0,0]=4 1171 B22R3.74289 c1ccc(cc1)C(NCC2CCOC2)c3ccccc3 34a_100000162943_100011261433 [0,0,0,0,1,0|3,0,0]=4 1172 B22R3.74289 c1ccc(cc1)C(NC[C@@H]2CCCO2)c3ccccc3 2230a_100020590478_100000211591 [0,0,0,0,1,0|3,0,0]=4 1173 B22R3.74289 c1ccc(cc1)C(NC[C@@H]2CCCO2)c3ccccc3 270004a_100020590478_100000210122 [0,0,0,0,1,0|3,0,0]=4 1174 B22R3.74289 c1ccc(cc1)C(OCC2CCCC2)c3ccccc3 34a_100000211180_100000740388 [0,0,0,0,1,0|2,0,0]=3 1175 B22R3.74289 c1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100000211180_100000740388 [0,0,0,0,1,0|2,0,0]=3 1176 B22R3.74289 c1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100000742336_100011216954 [0,0,0,0,1,0|2,0,0]=3 1177 B22R3.74289 c1ccc(cc1)C(OCC2CCCC2)c3ccccn3 7a_100000180852_100000740388 [0,0,0,0,1,0|3,0,0]=4 1178 B22R3.74289 c1ccc(cc1)C(OCC2CCCO2)c3ccccc3 7a_100000210270_100011216954 [0,0,0,0,1,0|3,0,0]=4 1179 B22R3.74289 c1ccc(cc1)C(OCC2CCCO2)c3ccccc3 7a_100000211180_100000203698 [0,0,0,0,1,0|3,0,0]=4 1180 B22R3.74289 c1ccc(cc1)C(OCC2CCOC2)c3ccccc3 34a_100000211180_100011261433 [0,0,0,0,1,0|3,0,0]=4 1181 B22R3.74289 c1ccc(cc1)C(OCC2CCOC2)c3ccccc3 7a_100000211180_100000702531 [0,0,0,0,1,0|3,0,0]=4 1182 B22R3.74289 c1ccc(cc1)C(SCC2CCCC2)c3ccccc3 62a_100000211591_100000740388 [0,0,0,0,1,0|2,0,0]=3 1183 B22R3.74289 c1ccc(cc1)C(SCC2CCCC2)c3ccccc3 62a_100000740388_100011216954 [0,0,0,0,1,0|2,0,0]=3 1184 B22R3.74289 c1ccc(cc1)C(SCC2CCCO2)c3ccccc3 62a_100000203698_100011216954 [0,0,0,0,1,0|3,0,0]=4 1185 B22R3.74289 c1ccc(cc1)C(SCC2CCCO2)c3ccccc3 62a_100000211591_100000203698 [0,0,0,0,1,0|3,0,0]=4 1186 B22R3.74289 c1ccc(cc1)C(SCC2CCOC2)c3ccccc3 62a_100000211591_100000702531 [0,0,0,0,1,0|3,0,0]=4 1187 B22R3.74289 c1ccc(cc1)C(SCC2CCOC2)c3ccccc3 62a_100000702531_100011216954 [0,0,0,0,1,0|3,0,0]=4 1188 B22R3.74289 c1ccc(cc1)[S+](CCN2CCCC2)c3ccccc3 2230a_100000188435_100010140906 [0,0,0,0,1,0|1,0,0]=2 1189 B22R3.74289 c1ccc(cc1)[S+](CCN2CCCC2)c3ccccc3 269982a_100000188435_100010140906 [0,0,0,0,1,0|1,0,0]=2 1190 B22R3.74289 c1ccc(cc1)[S+](CCN2CCSC2)c3ccccc3 2230a_100011215254_100010140906 [0,0,0,0,1,0|2,0,0]=3 1191 B22R3.74289 c1ccc(cc1)[S+](CCN2CCSC2)c3ccccc3 269982a_100011215254_100010140906 [0,0,0,0,1,0|2,0,0]=3 1192 B24R3.5775 c1ccc(cc1)CC(NCC2CCCCC2)c3ccccc3 2230a_100025772854_100000211423 [0,0,0,0,0,1|2,0,0]=3 1193 B24R3.5775 c1ccc(cc1)CC(NCC2CCCCC2)c3ccccc3 269862a_100025772854_100000211278 [0,0,0,0,0,1|2,0,0]=3 1194 B24R3.5775 c1ccc(cc1)CC(NCC2CCCCO2)c3ccccc3 2230a_100025772854_100000211543 [0,0,0,0,0,1|3,0,0]=4 1195 B24R3.5775 c1ccc(cc1)CC(NCC2CCCOC2)c3ccccc3 2230a_100025772854_100000741521 [0,0,0,0,0,1|3,0,0]=4 1196 B24R3.5775 c1ccc(cc1)CC(NCC2CCOCC2)c3ccccc3 2230a_100025772854_100000754603 [0,0,0,0,0,1|3,0,0]=4 1197 B24R3.5775 c1ccc(cc1)CC(NCC2CCOCC2)c3ccccc3 269862a_100025772854_100000749017 [0,0,0,0,0,1|3,0,0]=4 1198 B24R3.5775 c1ccc(cc1)CC(NCC2CCSCC2)c3ccccc3 269862a_100025772854_100000067145 [0,0,0,0,0,1|3,0,0]=4 1199 B24R3.5775 c1ccc(cc1)CC(NCC2CCSCC2)c3ccccc3 270004a_100025772854_100000067145 [0,0,0,0,0,1|3,0,0]=4 1200 B24R3.5775 c1ccc(cc1)CC(OCC2CCCCC2)c3ccccc3 34a_100000246494_100000211423 [0,0,0,0,0,1|2,0,0]=3 1201 B24R3.5775 c1ccc(cc1)CC(OCC2CCCCC2)c3ccccc3 7a_100000246494_100000211423 [0,0,0,0,0,1|2,0,0]=3 1202 B24R3.5775 c1ccc(cc1)CC(OCC2CCCCO2)c3ccccc3 34a_100000246494_100000211543 [0,0,0,0,0,1|3,0,0]=4 1203 B24R3.5775 c1ccc(cc1)CC(OCC2CCCCO2)c3ccccc3 7a_100000246494_100000211543 [0,0,0,0,0,1|3,0,0]=4 1204 B24R3.5775 c1ccc(cc1)CC(OCC2CCCOC2)c3ccccc3 34a_100000246494_100000741521 [0,0,0,0,0,1|3,0,0]=4 1205 B24R3.5775 c1ccc(cc1)CC(OCC2CCCOC2)c3ccccc3 7a_100000246494_100000741521 [0,0,0,0,0,1|3,0,0]=4 1206 B24R3.5775 c1ccc(cc1)CC(OCC2CCOCC2)c3ccccc3 34a_100000246494_100000754603 [0,0,0,0,0,1|3,0,0]=4 1207 B24R3.5775 c1ccc(cc1)CC(OCC2CCOCC2)c3ccccc3 7a_100000246494_100000754603 [0,0,0,0,0,1|3,0,0]=4 1208 B24R3.5775 c1ccc(cc1)CN(CCC2CCCCC2)c3ccccc3 2230a_100000188819_100012355289 [0,0,0,0,0,1|2,0,0]=3 1209 B24R3.5775 c1ccc(cc1)CN(CCC2CCCCC2)c3ccccc3 269982a_100000188819_100011273959 [0,0,0,0,0,1|2,0,0]=3 1210 B24R3.5775 c1ccc(cc1)CN(CCC2CCCCC2)c3ccccc3 34a_100000188819_100011209188 [0,0,0,0,0,1|2,0,0]=3 1211 B24R3.5775 c1ccc(cc1)CN(CCC2CCOCC2)c3ccccc3 2230a_100000188819_100011934994 [0,0,0,0,0,1|3,0,0]=4 1212 B24R3.5775 c1ccc(cc1)CN(CCC2CCOCC2)c3ccccc3 269982a_100000188819_100011934994 [0,0,0,0,0,1|3,0,0]=4 1213 B24R3.5775 c1ccc(cc1)CN(CCC2CCOCC2)c3ccccc3 34a_100000188819_100011934994 [0,0,0,0,0,1|3,0,0]=4 1214 B24R3.5775 c1ccc(cc1)CN(CCN2CCCCC2)c3ccccc3 2230a_100000188819_100000739454 [0,0,0,0,0,1|1,0,0]=2 1215 B24R3.5775 c1ccc(cc1)CN(CCN2CCCCC2)c3ccccc3 269982a_100000188819_100000739454 [0,0,0,0,0,1|1,0,0]=2 1216 B24R3.5775 c1ccc(cc1)CN(CCN2CCCCC2)c3ccccc3 34a_100000188819_100000739454 [0,0,0,0,0,1|1,0,0]=2 1217 B24R3.5775 c1ccc(cc1)CN(CCN2CCOCC2)c3ccccc3 2230a_100000188819_100025781966 [0,0,0,0,0,1|2,0,0]=3 1218 B24R3.5775 c1ccc(cc1)CN(CCN2CCOCC2)c3ccccc3 269982a_100000188819_100000753993 [0,0,0,0,0,1|2,0,0]=3 1219 B24R3.5775 c1ccc(cc1)CN(COC2CCCCC2)c3ccccc3 2230a_100000188819_100011935260 [0,0,0,0,0,1|3,0,0]=4 1220 B24R3.5775 c1ccc(cc1)CN(COC2CCCCC2)c3ccccc3 269982a_100000188819_100011935260 [0,0,0,0,0,1|3,0,0]=4 1221 B24R3.5775 c1ccc(cc1)CN(COC2CCCCC2)c3ccccc3 34a_100000188819_100011935260 [0,0,0,0,0,1|3,0,0]=4 1222 B24R3.5791 C(=C(c1ccccc1)c2ccccc2)CNC3CCCCC3 270004a_100000182618_100000050448 [0,0,0,0,0,1|1,0,2]=4 1223 B24R3.5791 C(=NNC1CCCCC1)C(c2ccccc2)c3ccccc3 4a_100000709804_100000183636 [0,0,0,0,0,1|2,0,1]=4 1224 B24R3.5791 C1=C(CCCC1)CCNC(c2ccccc2)c3ccccc3 2230a_100000212019_100000211591 [0,0,0,0,0,1|1,0,1]=3 1225 B24R3.5791 C1=C(CCCC1)CCNC(c2ccccc2)c3ccccc3 270004a_100000212019_100000210122 [0,0,0,0,0,1|1,0,1]=3 1226 B24R3.5791 C1=C(CCCC1)CCNC(c2ccccc2)c3ccccn3 270004a_100000212019_100000210380 [0,0,0,0,0,1|2,0,1]=4 1227 B24R3.5791 C1=C(CCCC1)CCNC(c2ccccc2)c3cccnc3 270004a_100000212019_100000735413 [0,0,0,0,0,1|2,0,1]=4 1228 B24R3.5791 C1=C(CSCC1)CNCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000707794 [0,0,0,0,0,1|2,0,1]=4 1229 B24R3.5791 C1=CC(CCC1)NCCC(c2ccccc2)c3ccccc3 2230a_100000272388_100000751183 [0,0,0,0,0,1|1,0,2]=4 1230 B24R3.5791 C1=CC(CCC1)OCCC(c2ccccc2)c3ccccc3 34a_100011215024_100009813428 [0,0,0,0,0,1|1,0,2]=4 1231 B24R3.5791 C1=CC(CCC1)OCCC(c2ccccc2)c3ccccc3 7a_100000032380_100000751183 [0,0,0,0,0,1|1,0,2]=4 1232 B24R3.5791 C1=CCC(CC1)CNCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000189434 [0,0,0,0,0,1|1,0,2]=4 1233 B24R3.5791 C1=CCC(CC1)OCCC(c2ccccc2)c3ccccc3 34a_100000073881_100009813428 [0,0,0,0,0,1|1,0,2]=4 1234 B24R3.5791 C1=CCN(CC1)CCOC(c2ccccc2)c3ccccc3 2230a_100000698166_100000734929 [0,0,0,0,0,1|0,0,2]=3 1235 B24R3.5791 C1=CCN(CC1)CCOC(c2ccccc2)c3ccccc3 269982a_100000698166_100000734929 [0,0,0,0,0,1|0,0,2]=3 1236 B24R3.5791 C1=CCN(CC1)CCOC(c2ccccc2)c3ccccc3 34a_100000698166_100000734929 [0,0,0,0,0,1|0,0,2]=3 1237 B24R3.5791 c1ccc(cc1)C(CCNC2CCCCC2)c3ccccc3 2230a_100000182618_100009813428 [0,0,0,0,0,1|1,0,0]=2 1238 B24R3.5791 c1ccc(cc1)C(CCNC2CCCCC2)c3ccccc3 270004a_100000272388_100000210434 [0,0,0,0,0,1|1,0,0]=2 1239 B24R3.5791 c1ccc(cc1)C(CCNC2CCCCC2)c3ccccc3 34a_100000182618_100009813428 [0,0,0,0,0,1|1,0,0]=2 1240 B24R3.5791 c1ccc(cc1)C(CCNC2CCCCC2)c3ccccc3 34a_100000272388_100000210327 [0,0,0,0,0,1|1,0,0]=2 1241 B24R3.5791 c1ccc(cc1)C(CCNC2CCCOC2)c3ccccc3 2230a_100000719290_100009813428 [0,0,0,0,0,1|2,0,0]=3 1242 B24R3.5791 c1ccc(cc1)C(CCNC2CCCOC2)c3ccccc3 270004a_100000272388_100000753404 [0,0,0,0,0,1|2,0,0]=3 1243 B24R3.5791 c1ccc(cc1)C(CCNC2CCCOC2)c3ccccc3 34a_100000272388_100000693364 [0,0,0,0,0,1|2,0,0]=3 1244 B24R3.5791 c1ccc(cc1)C(CCNC2CCCOC2)c3ccccc3 34a_100000719290_100009813428 [0,0,0,0,0,1|2,0,0]=3 1245 B24R3.5791 c1ccc(cc1)C(CCNC2CCCSC2)c3ccccc3 270004a_100000272388_100000057913 [0,0,0,0,0,1|2,0,0]=3 1246 B24R3.5791 c1ccc(cc1)C(CCNC2CCNCC2)c3ccccc3 270004a_100000272388_100015192401 [0,0,0,0,0,1|2,0,0]=3 1247 B24R3.5791 c1ccc(cc1)C(CCNC2CCOCC2)c3ccccc3 2230a_100000741149_100009813428 [0,0,0,0,0,1|2,0,0]=3 1248 B24R3.5791 c1ccc(cc1)C(CCNC2CCOCC2)c3ccccc3 270004a_100000272388_100011217826 [0,0,0,0,0,1|2,0,0]=3 1249 B24R3.5791 c1ccc(cc1)C(CCNC2CCOCC2)c3ccccc3 34a_100000741149_100009813428 [0,0,0,0,0,1|2,0,0]=3 1250 B24R3.5791 c1ccc(cc1)C(CCNC2CCSCC2)c3ccccc3 2230a_100000748639_100009813428 [0,0,0,0,0,1|2,0,0]=3 1251 B24R3.5791 c1ccc(cc1)C(CCNC2CCSCC2)c3ccccc3 270004a_100000272388_100000203788 [0,0,0,0,0,1|2,0,0]=3 1252 B24R3.5791 c1ccc(cc1)C(CCNC2CCSCC2)c3ccccc3 34a_100000272388_100000069128 [0,0,0,0,0,1|2,0,0]=3 1253 B24R3.5791 c1ccc(cc1)C(CCNC2CCSCC2)c3ccccc3 34a_100000748639_100009813428 [0,0,0,0,0,1|2,0,0]=3 1254 B24R3.5791 c1ccc(cc1)C(CCOC2CCCCC2)c3ccccc3 34a_100000032380_100000210327 [0,0,0,0,0,1|1,0,0]=2 1255 B24R3.5791 c1ccc(cc1)C(CCOC2CCCCC2)c3ccccc3 34a_100000210231_100009813428 [0,0,0,0,0,1|1,0,0]=2 1256 B24R3.5791 c1ccc(cc1)C(CCOC2CCCCC2)c3ccccc3 7a_100000032380_100000210327 [0,0,0,0,0,1|1,0,0]=2 1257 B24R3.5791 c1ccc(cc1)C(CCOC2CCCCC2)c3ccccc3 7a_100000210231_100009813428 [0,0,0,0,0,1|1,0,0]=2 1258 B24R3.5791 c1ccc(cc1)C(CCOC2CCCCO2)c3ccccc3 34a_100000033831_100009813428 [0,0,0,0,0,1|2,0,0]=3 1259 B24R3.5791 c1ccc(cc1)C(CCOC2CCCOC2)c3ccccc3 34a_100000032380_100000693364 [0,0,0,0,0,1|2,0,0]=3 1260 B24R3.5791 c1ccc(cc1)C(CCOC2CCCOC2)c3ccccc3 34a_100000754041_100009813428 [0,0,0,0,0,1|2,0,0]=3 1261 B24R3.5791 c1ccc(cc1)C(CCOC2CCCOC2)c3ccccc3 7a_100000032380_100000693364 [0,0,0,0,0,1|2,0,0]=3 1262 B24R3.5791 c1ccc(cc1)C(CCOC2CCCSC2)c3ccccc3 7a_100015962668_100009813428 [0,0,0,0,0,1|2,0,0]=3 1263 B24R3.5791 c1ccc(cc1)C(CCOC2CCOCC2)c3ccccc3 34a_100000744328_100009813428 [0,0,0,0,0,1|2,0,0]=3 1264 B24R3.5791 c1ccc(cc1)C(CCOC2CCOCC2)c3ccccc3 7a_100000032380_100000686592 [0,0,0,0,0,1|2,0,0]=3 1265 B24R3.5791 c1ccc(cc1)C(CCOC2CCSCC2)c3ccccc3 34a_100000032380_100000069128 [0,0,0,0,0,1|2,0,0]=3 1266 B24R3.5791 c1ccc(cc1)C(CCOC2CCSCC2)c3ccccc3 34a_100000731022_100009813428 [0,0,0,0,0,1|2,0,0]=3 1267 B24R3.5791 c1ccc(cc1)C(CCOC2CCSCC2)c3ccccc3 7a_100000032380_100011500858 [0,0,0,0,0,1|2,0,0]=3 1268 B24R3.5791 c1ccc(cc1)C(CCOC2CCSCC2)c3ccccc3 7a_100000731022_100009813428 [0,0,0,0,0,1|2,0,0]=3 1269 B24R3.5791 c1ccc(cc1)C(CCSC2CCCOC2)c3ccccc3 62a_100009813428_100000693364 [0,0,0,0,0,1|2,0,0]=3 1270 B24R3.5791 c1ccc(cc1)C(CCSC2CCOCC2)c3ccccc3 62a_100009813428_100011324220 [0,0,0,0,0,1|2,0,0]=3 1271 B24R3.5791 c1ccc(cc1)C(CCSC2CCSCC2)c3ccccc3 62a_100009813428_100000069128 [0,0,0,0,0,1|2,0,0]=3 1272 B24R3.5791 c1ccc(cc1)C(CNCC2CCCCC2)c3ccccc3 2230a_100000739227_100000211423 [0,0,0,0,0,1|1,0,0]=2 1273 B24R3.5791 c1ccc(cc1)C(CNCC2CCCCC2)c3ccccc3 269862a_100000739227_100000211278 [0,0,0,0,0,1|1,0,0]=2 1274 B24R3.5791 c1ccc(cc1)C(CNCC2CCCCC2)c3ccccc3 34a_100000739227_100000211423 [0,0,0,0,0,1|1,0,0]=2 1275 B24R3.5791 c1ccc(cc1)C(CNCC2CCCCO2)c3ccccc3 2230a_100000739227_100000211543 [0,0,0,0,0,1|2,0,0]=3 1276 B24R3.5791 c1ccc(cc1)C(CNCC2CCCCO2)c3ccccc3 34a_100000739227_100000211543 [0,0,0,0,0,1|2,0,0]=3 1277 B24R3.5791 c1ccc(cc1)C(CNCC2CCCOC2)c3ccccc3 2230a_100000739227_100000741521 [0,0,0,0,0,1|2,0,0]=3 1278 B24R3.5791 c1ccc(cc1)C(CNCC2CCCOC2)c3ccccc3 34a_100000739227_100000741521 [0,0,0,0,0,1|2,0,0]=3 1279 B24R3.5791 c1ccc(cc1)C(CNCC2CCOCC2)c3ccccc3 2230a_100000739227_100000754603 [0,0,0,0,0,1|2,0,0]=3 1280 B24R3.5791 c1ccc(cc1)C(CNCC2CCOCC2)c3ccccc3 269862a_100000739227_100000749017 [0,0,0,0,0,1|2,0,0]=3 1281 B24R3.5791 c1ccc(cc1)C(CNCC2CCOCC2)c3ccccc3 34a_100000739227_100000754603 [0,0,0,0,0,1|2,0,0]=3 1282 B24R3.5791 c1ccc(cc1)C(CNCC2CCSCC2)c3ccccc3 269862a_100000739227_100000067145 [0,0,0,0,0,1|2,0,0]=3 1283 B24R3.5791 c1ccc(cc1)C(CNCC2CCSCC2)c3ccccc3 270004a_100000739227_100000067145 [0,0,0,0,0,1|2,0,0]=3 1284 B24R3.5791 c1ccc(cc1)C(COCC2CCCCC2)c3ccccc3 34a_100011215272_100000211423 [0,0,0,0,0,1|1,0,0]=2 1285 B24R3.5791 c1ccc(cc1)C(COCC2CCCCC2)c3ccccc3 7a_100011215272_100000211423 [0,0,0,0,0,1|1,0,0]=2 1286 B24R3.5791 c1ccc(cc1)C(COCC2CCCCO2)c3ccccc3 34a_100011215272_100000211543 [0,0,0,0,0,1|2,0,0]=3 1287 B24R3.5791 c1ccc(cc1)C(COCC2CCCCO2)c3ccccc3 7a_100011215272_100000211543 [0,0,0,0,0,1|2,0,0]=3 1288 B24R3.5791 c1ccc(cc1)C(COCC2CCCOC2)c3ccccc3 34a_100011215272_100000741521 [0,0,0,0,0,1|2,0,0]=3 1289 B24R3.5791 c1ccc(cc1)C(COCC2CCCOC2)c3ccccc3 7a_100011215272_100000741521 [0,0,0,0,0,1|2,0,0]=3 1290 B24R3.5791 c1ccc(cc1)C(COCC2CCOCC2)c3ccccc3 34a_100011215272_100000754603 [0,0,0,0,0,1|2,0,0]=3 1291 B24R3.5791 c1ccc(cc1)C(COCC2CCOCC2)c3ccccc3 7a_100011215272_100000754603 [0,0,0,0,0,1|2,0,0]=3 1292 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000162943_100012355289 [0,0,0,0,0,1|1,0,0]=2 1293 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000738074_100000211591 [0,0,0,0,0,1|1,0,0]=2 1294 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000162943_100011713444 [0,0,0,0,0,1|1,0,0]=2 1295 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100000210122 [0,0,0,0,0,1|1,0,0]=2 1296 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 34a_100000162943_100011209188 [0,0,0,0,0,1|1,0,0]=2 1297 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccn3 2230a_100000689936_100012355289 [0,0,0,0,0,1|2,0,0]=3 1298 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccn3 270004a_100000689936_100011713444 [0,0,0,0,0,1|2,0,0]=3 1299 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccn3 270004a_100000738074_100000210380 [0,0,0,0,0,1|2,0,0]=3 1300 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3cccnc3 2230a_100011232609_100012355289 [0,0,0,0,0,1|2,0,0]=3 1301 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_100000735413 [0,0,0,0,0,1|2,0,0]=3 1302 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3cccnc3 270004a_100011232609_100011713444 [0,0,0,0,0,1|2,0,0]=3 1303 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccncc3 2230a_100025760769_100012355289 [0,0,0,0,0,1|2,0,0]=3 1304 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccncc3 270004a_100025760769_100011713444 [0,0,0,0,0,1|2,0,0]=3 1305 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCO2)c3ccccc3 2230a_100015183643_100000211591 [0,0,0,0,0,1|2,0,0]=3 1306 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100000210122 [0,0,0,0,0,1|2,0,0]=3 1307 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCO2)c3ccccn3 270004a_100015183643_100000210380 [0,0,0,0,0,1|3,0,0]=4 1308 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCO2)c3cccnc3 270004a_100015183643_100000735413 [0,0,0,0,0,1|3,0,0]=4 1309 B24R3.5791 c1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 2230a_100000162943_100011934994 [0,0,0,0,0,1|2,0,0]=3 1310 B24R3.5791 c1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 2230a_100000755988_100000211591 [0,0,0,0,0,1|2,0,0]=3 1311 B24R3.5791 c1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100000210122 [0,0,0,0,0,1|2,0,0]=3 1312 B24R3.5791 c1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 34a_100000162943_100011934994 [0,0,0,0,0,1|2,0,0]=3 1313 B24R3.5791 c1ccc(cc1)C(NCCC2CCOCC2)c3ccccn3 2230a_100000689936_100011934994 [0,0,0,0,0,1|3,0,0]=4 1314 B24R3.5791 c1ccc(cc1)C(NCCC2CCOCC2)c3ccccn3 270004a_100000755988_100000210380 [0,0,0,0,0,1|3,0,0]=4 1315 B24R3.5791 c1ccc(cc1)C(NCCC2CCOCC2)c3cccnc3 2230a_100011232609_100011934994 [0,0,0,0,0,1|3,0,0]=4 1316 B24R3.5791 c1ccc(cc1)C(NCCC2CCOCC2)c3cccnc3 270004a_100000755988_100000735413 [0,0,0,0,0,1|3,0,0]=4 1317 B24R3.5791 c1ccc(cc1)C(NCCC2CCOCC2)c3ccncc3 2230a_100025760769_100011934994 [0,0,0,0,0,1|3,0,0]=4 1318 B24R3.5791 c1ccc(cc1)C(NCCC2OCCCO2)c3ccccc3 2230a_100000162943_100000764188 [0,0,0,0,0,1|3,0,0]=4 1319 B24R3.5791 c1ccc(cc1)C(NCCC2OCCCO2)c3ccccc3 34a_100000162943_100000764188 [0,0,0,0,0,1|3,0,0]=4 1320 B24R3.5791 c1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 2230a_100000162943_100000739454 [0,0,0,0,0,1|0,0,0]=1 1321 B24R3.5791 c1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100000210122 [0,0,0,0,0,1|0,0,0]=1 1322 B24R3.5791 c1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 34a_100000162943_100000739454 [0,0,0,0,0,1|0,0,0]=1 1323 B24R3.5791 c1ccc(cc1)C(NCCN2CCCCC2)c3ccccn3 2230a_100000689936_100000739454 [0,0,0,0,0,1|1,0,0]=2 1324 B24R3.5791 c1ccc(cc1)C(NCCN2CCCCC2)c3ccccn3 270004a_100000216509_100000210380 [0,0,0,0,0,1|1,0,0]=2 1325 B24R3.5791 c1ccc(cc1)C(NCCN2CCCCC2)c3cccnc3 2230a_100011232609_100000739454 [0,0,0,0,0,1|1,0,0]=2 1326 B24R3.5791 c1ccc(cc1)C(NCCN2CCCCC2)c3cccnc3 270004a_100000216509_100000735413 [0,0,0,0,0,1|1,0,0]=2 1327 B24R3.5791 c1ccc(cc1)C(NCCN2CCCCC2)c3ccncc3 2230a_100025760769_100000739454 [0,0,0,0,0,1|1,0,0]=2 1328 B24R3.5791 c1ccc(cc1)C(NCCN2CCOCC2)c3ccccc3 2230a_100000162943_100025781966 [0,0,0,0,0,1|1,0,0]=2 1329 B24R3.5791 c1ccc(cc1)C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100000210122 [0,0,0,0,0,1|1,0,0]=2 1330 B24R3.5791 c1ccc(cc1)C(NCCN2CCOCC2)c3ccccn3 2230a_100000689936_100025781966 [0,0,0,0,0,1|2,0,0]=3 1331 B24R3.5791 c1ccc(cc1)C(NCCN2CCOCC2)c3ccccn3 270004a_100000211067_100000210380 [0,0,0,0,0,1|2,0,0]=3 1332 B24R3.5791 c1ccc(cc1)C(NCCN2CCOCC2)c3cccnc3 2230a_100011232609_100025781966 [0,0,0,0,0,1|2,0,0]=3 1333 B24R3.5791 c1ccc(cc1)C(NCCN2CCOCC2)c3cccnc3 270004a_100000211067_100000735413 [0,0,0,0,0,1|2,0,0]=3 1334 B24R3.5791 c1ccc(cc1)C(NCCN2CCOCC2)c3ccncc3 2230a_100025760769_100025781966 [0,0,0,0,0,1|2,0,0]=3 1335 B24R3.5791 c1ccc(cc1)C(NCCN2CCSCC2)c3ccccc3 2230a_100000755026_100000211591 [0,0,0,0,0,1|1,0,0]=2 1336 B24R3.5791 c1ccc(cc1)C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100000210122 [0,0,0,0,0,1|1,0,0]=2 1337 B24R3.5791 c1ccc(cc1)C(NCCN2CCSCC2)c3ccccn3 270004a_100000755026_100000210380 [0,0,0,0,0,1|2,0,0]=3 1338 B24R3.5791 c1ccc(cc1)C(NCCN2CCSCC2)c3cccnc3 270004a_100000755026_100000735413 [0,0,0,0,0,1|2,0,0]=3 1339 B24R3.5791 c1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 2230a_100000162943_100011935260 [0,0,0,0,0,1|2,0,0]=3 1340 B24R3.5791 c1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 34a_100000162943_100011935260 [0,0,0,0,0,1|2,0,0]=3 1341 B24R3.5791 c1ccc(cc1)C(NCOC2CCCCC2)c3ccccn3 2230a_100000689936_100011935260 [0,0,0,0,0,1|3,0,0]=4 1342 B24R3.5791 c1ccc(cc1)C(NCOC2CCCCC2)c3cccnc3 2230a_100011232609_100011935260 [0,0,0,0,0,1|3,0,0]=4 1343 B24R3.5791 c1ccc(cc1)C(NCOC2CCCCC2)c3ccncc3 2230a_100025760769_100011935260 [0,0,0,0,0,1|3,0,0]=4 1344 B24R3.5791 c1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 34a_100000211180_100011209188 [0,0,0,0,0,1|1,0,0]=2 1345 B24R3.5791 c1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 7a_100000211180_100011273959 [0,0,0,0,0,1|1,0,0]=2 1346 B24R3.5791 c1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 7a_100011217863_100011216954 [0,0,0,0,0,1|1,0,0]=2 1347 B24R3.5791 c1ccc(cc1)C(OCCC2CCCCC2)c3ccccn3 7a_100000180852_100011273959 [0,0,0,0,0,1|2,0,0]=3 1348 B24R3.5791 c1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 34a_100000211180_100011934994 [0,0,0,0,0,1|2,0,0]=3 1349 B24R3.5791 c1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_100000211180_100011934994 [0,0,0,0,0,1|2,0,0]=3 1350 B24R3.5791 c1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_100011933979_100011216954 [0,0,0,0,0,1|2,0,0]=3 1351 B24R3.5791 c1ccc(cc1)C(OCCC2CCOCC2)c3ccccn3 7a_100000180852_100011934994 [0,0,0,0,0,1|3,0,0]=4 1352 B24R3.5791 c1ccc(cc1)C(OCCC2OCCCO2)c3ccccc3 34a_100000211180_100000764188 [0,0,0,0,0,1|3,0,0]=4 1353 B24R3.5791 c1ccc(cc1)C(OCCC2OCCCO2)c3ccccc3 7a_100000211180_100000764188 [0,0,0,0,0,1|3,0,0]=4 1354 B24R3.5791 c1ccc(cc1)C(OCCC2SCCCS2)c3ccccc3 7a_200011025297_100011216954 [0,0,0,0,0,1|3,0,0]=4 1355 B24R3.5791 c1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 34a_100000211180_100000739454 [0,0,0,0,0,1|0,0,0]=1 1356 B24R3.5791 c1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 7a_100000211180_100000739454 [0,0,0,0,0,1|0,0,0]=1 1357 B24R3.5791 c1ccc(cc1)C(OCCN2CCCCC2)c3ccccn3 7a_100000180852_100000739454 [0,0,0,0,0,1|1,0,0]=2 1358 B24R3.5791 c1ccc(cc1)C(OCCN2CCCOC2)c3ccccc3 2230a_100000131196_100000734929 [0,0,0,0,0,1|1,0,0]=2 1359 B24R3.5791 c1ccc(cc1)C(OCCN2CCCOC2)c3ccccc3 269982a_100000131196_100000734929 [0,0,0,0,0,1|1,0,0]=2 1360 B24R3.5791 c1ccc(cc1)C(OCCN2CCCOC2)c3ccccc3 34a_100000131196_100000734929 [0,0,0,0,0,1|1,0,0]=2 1361 B24R3.5791 c1ccc(cc1)C(OCCN2CCOCC2)c3ccccc3 2230a_100015191051_100000734929 [0,0,0,0,0,1|1,0,0]=2 1362 B24R3.5791 c1ccc(cc1)C(OCCN2CCOCC2)c3ccccc3 269982a_100015191051_100000734929 [0,0,0,0,0,1|1,0,0]=2 1363 B24R3.5791 c1ccc(cc1)C(OCCN2CCOCC2)c3ccccc3 34a_100015191051_100000734929 [0,0,0,0,0,1|1,0,0]=2 1364 B24R3.5791 c1ccc(cc1)C(OCCN2CCOCC2)c3ccccc3 7a_100000211180_100000211760 [0,0,0,0,0,1|1,0,0]=2 1365 B24R3.5791 c1ccc(cc1)C(OCCN2CCOCC2)c3ccccn3 7a_100000180852_100000211760 [0,0,0,0,0,1|2,0,0]=3 1366 B24R3.5791 c1ccc(cc1)C(OCCN2CCSCC2)c3ccccc3 2230a_100000737611_100000734929 [0,0,0,0,0,1|1,0,0]=2 1367 B24R3.5791 c1ccc(cc1)C(OCCN2CCSCC2)c3ccccc3 269982a_100000737611_100000734929 [0,0,0,0,0,1|1,0,0]=2 1368 B24R3.5791 c1ccc(cc1)C(OCCN2CCSCC2)c3ccccc3 7a_100000686052_100011216954 [0,0,0,0,0,1|1,0,0]=2 1369 B24R3.5791 c1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_100000211180_100011935260 [0,0,0,0,0,1|2,0,0]=3 1370 B24R3.5791 c1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_100000211180_100011935260 [0,0,0,0,0,1|2,0,0]=3 1371 B24R3.5791 c1ccc(cc1)C(OCOC2CCCCC2)c3ccccn3 7a_100000180852_100011935260 [0,0,0,0,0,1|3,0,0]=4 1372 B24R3.5791 c1ccc(cc1)C(SCCC2CCOCC2)c3ccccc3 62a_100000211591_100011934994 [0,0,0,0,0,1|2,0,0]=3 1373 B24R3.5791 c1ccc(cc1)C(SCCC2CCOCC2)c3ccccc3 62a_100011934994_100011216954 [0,0,0,0,0,1|2,0,0]=3 1374 B24R3.5791 c1ccc(cc1)C(SCCC2OCCCO2)c3ccccc3 62a_100000211591_100000764188 [0,0,0,0,0,1|3,0,0]=4 1375 B24R3.5791 c1ccc(cc1)C(SCCC2OCCCO2)c3ccccc3 62a_100000764188_100011216954 [0,0,0,0,0,1|3,0,0]=4 1376 B24R3.5791 c1ccc(cc1)C(SCCN2CCCCC2)c3ccccc3 62a_100000211591_100000739454 [0,0,0,0,0,1|0,0,0]=1 1377 B24R3.5791 c1ccc(cc1)C(SCCN2CCCCC2)c3ccccc3 62a_100000739454_100011216954 [0,0,0,0,0,1|0,0,0]=1 1378 B24R3.5791 c1ccc(cc1)C(SCCN2CCOCC2)c3ccccc3 62a_100000211591_100000211760 [0,0,0,0,0,1|1,0,0]=2 1379 B24R3.5791 c1ccc(cc1)C(SCOC2CCCCC2)c3ccccc3 62a_100000211591_100011935260 [0,0,0,0,0,1|2,0,0]=3 1380 B24R3.5791 c1ccc(cc1)C(SCOC2CCCCC2)c3ccccc3 62a_100011935260_100011216954 [0,0,0,0,0,1|2,0,0]=3 1381 B24R3.5791 c1ccc(cc1)N(CCOC2CCCCC2)c3ccccc3 34a_100010001939_100000210327 [0,0,0,0,0,1|2,0,0]=3 1382 B24R3.5791 c1ccc(cc1)N(CCOC2CCCCC2)c3ccccc3 7a_100010001939_100000210327 [0,0,0,0,0,1|2,0,0]=3 1383 B24R3.5791 c1ccc(cc1)N(CCOC2CCCOC2)c3ccccc3 34a_100010001939_100000693364 [0,0,0,0,0,1|3,0,0]=4 1384 B24R3.5791 c1ccc(cc1)N(CCOC2CCCOC2)c3ccccc3 7a_100010001939_100000693364 [0,0,0,0,0,1|3,0,0]=4 1385 B24R3.5791 c1ccc(cc1)N(CCOC2CCOCC2)c3ccccc3 7a_100010001939_100000686592 [0,0,0,0,0,1|3,0,0]=4 1386 B24R3.5791 c1ccc(cc1)N(CCOC2CCSCC2)c3ccccc3 34a_100010001939_100000069128 [0,0,0,0,0,1|3,0,0]=4 1387 B24R3.5791 c1ccc(cc1)N(CCOC2CCSCC2)c3ccccc3 7a_100010001939_100011500858 [0,0,0,0,0,1|3,0,0]=4 1388 B24R3.5791 c1ccc(cc1)P(CCNC2CCCCC2)c3ccccc3 270004a_107094377242_100000210434 [0,0,0,0,0,1|2,0,0]=3 1389 B24R3.5791 c1ccc(cc1)P(CCNC2CCCCC2)c3ccccc3 34a_107094377242_100000210327 [0,0,0,0,0,1|2,0,0]=3 1390 B24R3.5791 c1ccc(cc1)P(CCNC2CCCOC2)c3ccccc3 270004a_107094377242_100000753404 [0,0,0,0,0,1|3,0,0]=4 1391 B24R3.5791 c1ccc(cc1)P(CCNC2CCCOC2)c3ccccc3 34a_107094377242_100000693364 [0,0,0,0,0,1|3,0,0]=4 1392 B24R3.5791 c1ccc(cc1)P(CCNC2CCCSC2)c3ccccc3 270004a_107094377242_100000057913 [0,0,0,0,0,1|3,0,0]=4 1393 B24R3.5791 c1ccc(cc1)P(CCNC2CCNCC2)c3ccccc3 270004a_107094377242_100015192401 [0,0,0,0,0,1|3,0,0]=4 1394 B24R3.5791 c1ccc(cc1)P(CCNC2CCOCC2)c3ccccc3 270004a_107094377242_100011217826 [0,0,0,0,0,1|3,0,0]=4 1395 B24R3.5791 c1ccc(cc1)P(CCNC2CCSCC2)c3ccccc3 270004a_107094377242_100000203788 [0,0,0,0,0,1|3,0,0]=4 1396 B24R3.5791 c1ccc(cc1)P(CCNC2CCSCC2)c3ccccc3 34a_107094377242_100000069128 [0,0,0,0,0,1|3,0,0]=4 1397 B24R3.5791 c1ccc(cc1)[S+](CCNC2CCCCC2)c3ccccc3 2230a_100000182618_100010140906 [0,0,0,0,0,1|2,0,0]=3 1398 B24R3.5791 c1ccc(cc1)[S+](CCNC2CCCOC2)c3ccccc3 2230a_100000719290_100010140906 [0,0,0,0,0,1|3,0,0]=4 1399 B24R3.5791 c1ccc(cc1)[S+](CCNC2CCOCC2)c3ccccc3 2230a_100000741149_100010140906 [0,0,0,0,0,1|3,0,0]=4 1400 B24R3.5791 c1ccc(cc1)[S+](CCNC2CCSCC2)c3ccccc3 2230a_100000748639_100010140906 [0,0,0,0,0,1|3,0,0]=4 1401 B24R3.5791 c1ccc(cc1)[S+](CCOC2CCCCC2)c3ccccc3 7a_100000210231_100010140906 [0,0,0,0,0,1|2,0,0]=3 1402 B24R3.5791 c1ccc(cc1)[S+](CCOC2CCCSC2)c3ccccc3 7a_100015962668_100010140906 [0,0,0,0,0,1|3,0,0]=4 1403 B24R3.5791 c1ccc(cc1)[S+](CCOC2CCSCC2)c3ccccc3 7a_100000731022_100010140906 [0,0,0,0,0,1|3,0,0]=4 1404 B24R3.5791 c1ccc(cc1)[S+](CCSC2CCCCC2)c3ccccc3 62a_100000210327_100010140906 [0,0,0,0,0,1|2,0,0]=3 1405 B24R3.5791 c1ccc(cc1)[S+](CCSC2CCCCC2)c3ccccc3 62a_100010140906_100000210327 [0,0,0,0,0,1|2,0,0]=3 1406 B24R3.5791 c1ccc(cc1)[S+](CCSC2CCCOC2)c3ccccc3 62a_100010140906_100000693364 [0,0,0,0,0,1|3,0,0]=4 1407 B24R3.5791 c1ccc(cc1)[S+](CCSC2CCOCC2)c3ccccc3 62a_100010140906_100011324220 [0,0,0,0,0,1|3,0,0]=4 1408 B24R3.5791 c1ccc(cc1)[S+](CCSC2CCSCC2)c3ccccc3 62a_100010140906_100000069128 [0,0,0,0,0,1|3,0,0]=4 1409 B24R3.5791 c1ccc(nc1)C(NCCC2CCCCC2)c3ccccn3 270004a_100009954364_100011713444 [0,0,0,0,0,1|3,0,0]=4 1410 B24R3.5791 c1ccc(nc1)C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_100011376182 [0,0,0,0,0,1|3,0,0]=4 1411 B24R3.5791 c1ccc(nc1)C(NCCN2CCCCC2)c3cccnc3 270004a_100000216509_100011376182 [0,0,0,0,0,1|2,0,0]=3 1412 B24R3.5791 c1ccc(nc1)C(NCCN2CCOCC2)c3cccnc3 270004a_100000211067_100011376182 [0,0,0,0,0,1|3,0,0]=4 1413 B24R3.5791 c1ccc(nc1)C(NCCN2CCSCC2)c3cccnc3 270004a_100000755026_100011376182 [0,0,0,0,0,1|3,0,0]=4 1414 B24R3.5791 c1cncc(c1)C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_200011376183 [0,0,0,0,0,1|3,0,0]=4 1415 B24R3.5791 c1cncc(c1)C(NCCN2CCCCC2)c3cccnc3 270004a_100000216509_200011376183 [0,0,0,0,0,1|2,0,0]=3 1416 B24R3.5791 c1cncc(c1)C(NCCN2CCCCC2)c3cnccn3 270004a_100000216509_100000732570 [0,0,0,0,0,1|3,0,0]=4 1417 B24R3.5791 c1cncc(c1)C(NCCN2CCOCC2)c3cccnc3 270004a_100000211067_200011376183 [0,0,0,0,0,1|3,0,0]=4 1418 B24R3.5791 c1cncc(c1)C(NCCN2CCSCC2)c3cccnc3 270004a_100000755026_200011376183 [0,0,0,0,0,1|3,0,0]=4 1419 B24R3.3681135 C(=C(c1ccccc1)c2ccccc2)CN3CCCCCC3 270004a_100000185865_100000050448 [0,0,0,0,0,1|0,0,2]=3 1420 B24R3.3681135 C(=C(c1ccccc1)c2ccccc2)CN3CCCOCC3 270004a_100000685342_100000050448 [0,0,0,0,0,1|0,0,2]=3 1421 B24R3.3681135 c1ccc(cc1)C(CCN2CCCCCC2)c3ccccc3 2230a_100000185865_100009813428 [0,0,0,0,0,1|0,0,0]=1 1422 B24R3.3681135 c1ccc(cc1)C(CCN2CCCCCC2)c3ccccc3 269982a_100000185865_100009813428 [0,0,0,0,0,1|0,0,0]=1 1423 B24R3.3681135 c1ccc(cc1)C(CCN2CCCCCC2)c3ccccc3 34a_100000185865_100009813428 [0,0,0,0,0,1|0,0,0]=1 1424 B24R3.3681135 c1ccc(cc1)C(CCN2CCCOCC2)c3ccccc3 2230a_100000685342_100009813428 [0,0,0,0,0,1|0,0,0]=1 1425 B24R3.3681135 c1ccc(cc1)C(CCN2CCCOCC2)c3ccccc3 269982a_100000685342_100009813428 [0,0,0,0,0,1|0,0,0]=1 1426 B24R3.3681135 c1ccc(cc1)C(CCN2CCCOCC2)c3ccccc3 34a_100000685342_100009813428 [0,0,0,0,0,1|0,0,0]=1 1427 B24R3.3681135 c1ccc(cc1)C(CNC2CCCCCC2)c3ccccc3 270004a_100000739227_100000210131 [0,0,0,0,0,1|2,0,0]=3 1428 B24R3.3681135 c1ccc(cc1)C(CNC2CCCCCC2)c3ccccc3 34a_100000739227_100011217769 [0,0,0,0,0,1|2,0,0]=3 1429 B24R3.3681135 c1ccc(cc1)C(CNC2CCCNCC2)c3ccccc3 270004a_100000739227_100015187895 [0,0,0,0,0,1|2,0,0]=3 1430 B24R3.3681135 c1ccc(cc1)C(CNC2CSCCSC2)c3ccccc3 270004a_100000739227_100000068409 [0,0,0,0,0,1|3,0,0]=4 1431 B24R3.3681135 c1ccc(cc1)C(COC2CCCCCC2)c3ccccc3 34a_100011215272_100011217769 [0,0,0,0,0,1|2,0,0]=3 1432 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000162943_200000696569 [0,0,0,0,0,1|2,0,0]=3 1433 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100015204231_100000211591 [0,0,0,0,0,1|2,0,0]=3 1434 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000162943_200000763224 [0,0,0,0,0,1|2,0,0]=3 1435 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100000210122 [0,0,0,0,0,1|2,0,0]=3 1436 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 34a_100000162943_200000696569 [0,0,0,0,0,1|2,0,0]=3 1437 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccn3 2230a_100000689936_200000696569 [0,0,0,0,0,1|3,0,0]=4 1438 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccn3 269862a_100000689936_200000763224 [0,0,0,0,0,1|3,0,0]=4 1439 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccccn3 270004a_100015204231_100000210380 [0,0,0,0,0,1|3,0,0]=4 1440 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3cccnc3 2230a_100011232609_200000696569 [0,0,0,0,0,1|3,0,0]=4 1441 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3cccnc3 270004a_100015204231_100000735413 [0,0,0,0,0,1|3,0,0]=4 1442 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccncc3 2230a_100025760769_200000696569 [0,0,0,0,0,1|3,0,0]=4 1443 B24R3.3681135 c1ccc(cc1)C(NCC2CCCCCC2)c3ccncc3 269862a_100025760769_200000763224 [0,0,0,0,0,1|3,0,0]=4 1444 B24R3.3681135 c1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 34a_100000211180_200000696569 [0,0,0,0,0,1|2,0,0]=3 1445 B24R3.3681135 c1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 7a_100000211180_200000696569 [0,0,0,0,0,1|2,0,0]=3 1446 B24R3.3681135 c1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 7a_100000699130_100011216954 [0,0,0,0,0,1|2,0,0]=3 1447 B24R3.3681135 c1ccc(cc1)C(OCC2CCCCCC2)c3ccccn3 7a_100000180852_200000696569 [0,0,0,0,0,1|3,0,0]=4 1448 B24R3.3681135 c1ccc(cc1)[S+](CCN2CCCCCC2)c3ccccc3 2230a_100000185865_100010140906 [0,0,0,0,0,1|1,0,0]=2 1449 B24R3.3681135 c1ccc(cc1)[S+](CCN2CCCCCC2)c3ccccc3 269982a_100000185865_100010140906 [0,0,0,0,0,1|1,0,0]=2 1450 B24R3.3681135 c1ccc(cc1)[S+](CCN2CCCOCC2)c3ccccc3 2230a_100000685342_100010140906 [0,0,0,0,0,1|1,0,0]=2 1451 B24R3.3681135 c1ccc(cc1)[S+](CCN2CCCOCC2)c3ccccc3 269982a_100000685342_100010140906 [0,0,0,0,0,1|1,0,0]=2 1452 B21R2.2905 BrCCCCCOC(c1ccccc1)c2ccccc2 7a_100000746331_100011216954 [1,0,1,0,0,0|2,0,0]=4 1453 B21R2.2905 BrCCCOCCC(c1ccccc1)c2ccccc2 34a_100011217188_100009813428 [1,0,1,0,0,0|2,0,0]=4 1454 B21R2.2905 C#CCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000731252 [1,0,1,0,0,0|0,0,2]=4 1455 B21R2.2905 C#CCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000695029 [1,0,1,0,0,0|0,0,2]=4 1456 B21R2.2905 C#CCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000688953 [1,0,1,0,0,0|0,0,2]=4 1457 B21R2.2905 C#CCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000688953 [1,0,1,0,0,0|0,0,2]=4 1458 B21R2.2905 C#CCCNCCC(c1ccccc1)c2ccccc2 34a_100000755551_100009813428 [1,0,1,0,0,0|0,0,2]=4 1459 B21R2.2905 C/C=C/CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100102629194 [1,0,1,0,0,0|0,0,2]=4 1460 B21R2.2905 C=CCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011713584 [1,0,1,0,0,0|0,0,2]=4 1461 B21R2.2905 C=CCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000757094 [1,0,1,0,0,0|0,0,2]=4 1462 B21R2.2905 C=CCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000754431 [1,0,1,0,0,0|0,0,2]=4 1463 B21R2.2905 C=CCCNCCC(c1ccccc1)c2ccccc2 2230a_100015191253_100009813428 [1,0,1,0,0,0|0,0,2]=4 1464 B21R2.2905 C=CCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000754431 [1,0,1,0,0,0|0,0,2]=4 1465 B21R2.2905 CC#CCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000748600 [1,0,1,0,0,0|0,0,2]=4 1466 B21R2.2905 CC#CCNCCC(c1ccccc1)c2ccccc2 2230a_100000685387_100009813428 [1,0,1,0,0,0|0,0,2]=4 1467 B21R2.2905 CC#CCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000748600 [1,0,1,0,0,0|0,0,2]=4 1468 B21R2.2905 CC#CCNCCC(c1ccccc1)c2ccccc2 34a_100000685387_100009813428 [1,0,1,0,0,0|0,0,2]=4 1469 B21R2.2905 CC/C=C\CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100103147603 [1,0,1,0,0,0|0,0,2]=4 1470 B21R2.2905 CC/C=C\CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100103147603 [1,0,1,0,0,0|0,0,2]=4 1471 B21R2.2905 CC=CCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000070051 [1,0,1,0,0,0|0,0,2]=4 1472 B21R2.2905 CC=CCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000070051 [1,0,1,0,0,0|0,0,2]=4 1473 B21R2.2905 CCC#CCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100009813939 [1,0,1,0,0,0|0,0,2]=4 1474 B21R2.2905 CCC#CCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100009813939 [1,0,1,0,0,0|0,0,2]=4 1475 B21R2.2905 CCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210314 [1,0,1,0,0,0|1,0,0]=3 1476 B21R2.2905 CCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000210581_100000211591 [1,0,1,0,0,0|1,0,0]=3 1477 B21R2.2905 CCCCCCNC(c1ccccc1)c2ccccc2 270004a_100000210581_100000210122 [1,0,1,0,0,0|1,0,0]=3 1478 B21R2.2905 CCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210314 [1,0,1,0,0,0|1,0,0]=3 1479 B21R2.2905 CCCCCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210314 [1,0,1,0,0,0|2,0,0]=4 1480 B21R2.2905 CCCCCCNC(c1ccccc1)c2ccccn2 270004a_100000210581_100000210380 [1,0,1,0,0,0|2,0,0]=4 1481 B21R2.2905 CCCCCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000210314 [1,0,1,0,0,0|2,0,0]=4 1482 B21R2.2905 CCCCCCNC(c1ccccc1)c2cccnc2 270004a_100000210581_100000735413 [1,0,1,0,0,0|2,0,0]=4 1483 B21R2.2905 CCCCCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000210314 [1,0,1,0,0,0|2,0,0]=4 1484 B21R2.2905 CCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210314 [1,0,1,0,0,0|1,0,0]=3 1485 B21R2.2905 CCCCCCOC(c1ccccc1)c2ccccc2 7a_100000210259_100011216954 [1,0,1,0,0,0|1,0,0]=3 1486 B21R2.2905 CCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210314 [1,0,1,0,0,0|1,0,0]=3 1487 B21R2.2905 CCCCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210314 [1,0,1,0,0,0|2,0,0]=4 1488 B21R2.2905 CCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210326 [1,0,1,0,0,0|0,0,0]=2 1489 B21R2.2905 CCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000718602 [1,0,1,0,0,0|0,0,0]=2 1490 B21R2.2905 CCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000718602 [1,0,1,0,0,0|1,0,0]=3 1491 B21R2.2905 CCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210326 [1,0,1,0,0,0|1,0,0]=3 1492 B21R2.2905 CCCCNCC=C(c1ccccc1)c2ccccc2 270004a_100000102301_100000050448 [1,0,1,0,0,0|0,0,2]=4 1493 B21R2.2905 CCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000102301_100009813428 [1,0,1,0,0,0|0,0,0]=2 1494 B21R2.2905 CCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000210211 [1,0,1,0,0,0|0,0,0]=2 1495 B21R2.2905 CCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000210210 [1,0,1,0,0,0|0,0,0]=2 1496 B21R2.2905 CCCCNCCC(c1ccccc1)c2ccccc2 7a_106832991798_100009813428 [1,0,1,0,0,0|0,0,0]=2 1497 B21R2.2905 CCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000210211 [1,0,1,0,0,0|1,0,0]=3 1498 B21R2.2905 CCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000210210 [1,0,1,0,0,0|1,0,0]=3 1499 B21R2.2905 CCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000102301_100010140906 [1,0,1,0,0,0|1,0,0]=3 1500 B21R2.2905 CCCCNCC[S+](c1ccccc1)c2ccccc2 7a_106832991798_100010140906 [1,0,1,0,0,0|1,0,0]=3 1501 B21R2.2905 CCCCNN=CC(c1ccccc1)c2ccccc2 4a_100025702795_100000183636 [1,0,1,0,0,0|1,0,1]=4 1502 B21R2.2905 CCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210210 [1,0,1,0,0,0|1,0,0]=3 1503 B21R2.2905 CCCCOCCC(c1ccccc1)c2ccccc2 34a_100000210227_100009813428 [1,0,1,0,0,0|1,0,0]=3 1504 B21R2.2905 CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210211 [1,0,1,0,0,0|1,0,0]=3 1505 B21R2.2905 CCCCOCCC(c1ccccc1)c2ccccc2 7a_100000210227_100009813428 [1,0,1,0,0,0|1,0,0]=3 1506 B21R2.2905 CCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000210210 [1,0,1,0,0,0|2,0,0]=4 1507 B21R2.2905 CCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000210211 [1,0,1,0,0,0|2,0,0]=4 1508 B21R2.2905 CCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000210227_100010140906 [1,0,1,0,0,0|2,0,0]=4 1509 B21R2.2905 CCCCOCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011995733 [1,0,1,0,0,0|2,0,0]=4 1510 B21R2.2905 CCCCOCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011995733 [1,0,1,0,0,0|2,0,0]=4 1511 B21R2.2905 CCCCOCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011995733 [1,0,1,0,0,0|2,0,0]=4 1512 B21R2.2905 CCCCOCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011995733 [1,0,1,0,0,0|2,0,0]=4 1513 B21R2.2905 CCCCOCSC(c1ccccc1)c2ccccc2 62a_100011995733_100011216954 [1,0,1,0,0,0|2,0,0]=4 1514 B21R2.2905 CCCCSCCC(c1ccccc1)c2ccccc2 62a_100000210211_100009813428 [1,0,1,0,0,0|1,0,0]=3 1515 B21R2.2905 CCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000210210 [1,0,1,0,0,0|1,0,0]=3 1516 B21R2.2905 CCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000210211_100010140906 [1,0,1,0,0,0|2,0,0]=4 1517 B21R2.2905 CCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000210210 [1,0,1,0,0,0|2,0,0]=4 1518 B21R2.2905 CCCNCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_100000210303 [1,0,1,0,0,0|2,0,0]=4 1519 B21R2.2905 CCCNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100000210303 [1,0,1,0,0,0|2,0,0]=4 1520 B21R2.2905 CCCOCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011215938 [1,0,1,0,0,0|2,0,0]=4 1521 B21R2.2905 CCCOCCNC(c1ccccc1)c2ccccc2 2230a_100161115042_100000211591 [1,0,1,0,0,0|2,0,0]=4 1522 B21R2.2905 CCCOCCNC(c1ccccc1)c2ccccc2 270004a_100161115042_100000210122 [1,0,1,0,0,0|2,0,0]=4 1523 B21R2.2905 CCCOCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011215938 [1,0,1,0,0,0|2,0,0]=4 1524 B21R2.2905 CCCOCCOC(c1ccccc1)c2ccccc2 34a_100000210258_100000734929 [1,0,1,0,0,0|2,0,0]=4 1525 B21R2.2905 CCCOCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011215938 [1,0,1,0,0,0|2,0,0]=4 1526 B21R2.2905 CCCOCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011215938 [1,0,1,0,0,0|2,0,0]=4 1527 B21R2.2905 CCCOCCOC(c1ccccc1)c2ccccc2 7a_100000752267_100011216954 [1,0,1,0,0,0|2,0,0]=4 1528 B21R2.2905 CCCOCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011215938 [1,0,1,0,0,0|2,0,0]=4 1529 B21R2.2905 CCCOCCSC(c1ccccc1)c2ccccc2 62a_100011215938_100011216954 [1,0,1,0,0,0|2,0,0]=4 1530 B21R2.2905 CCCSCCNC(c1ccccc1)c2ccccc2 2230a_100020603323_100000211591 [1,0,1,0,0,0|2,0,0]=4 1531 B21R2.2905 CCCSCCNC(c1ccccc1)c2ccccc2 270004a_100020603323_100000210122 [1,0,1,0,0,0|2,0,0]=4 1532 B21R2.2905 CCCSCCOC(c1ccccc1)c2ccccc2 62a_100000210303_100000734929 [1,0,1,0,0,0|2,0,0]=4 1533 B21R2.2905 CCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000210303 [1,0,1,0,0,0|2,0,0]=4 1534 B21R2.2905 CCCSCCOC(c1ccccc1)c2ccccc2 7a_200000230433_100011216954 [1,0,1,0,0,0|2,0,0]=4 1535 B21R2.2905 CCOCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100012232248 [1,0,1,0,0,0|2,0,0]=4 1536 B21R2.2905 CCOCCCNC(c1ccccc1)c2ccccc2 2230a_100000210961_100000211591 [1,0,1,0,0,0|2,0,0]=4 1537 B21R2.2905 CCOCCCNC(c1ccccc1)c2ccccc2 270004a_100000210961_100000210122 [1,0,1,0,0,0|2,0,0]=4 1538 B21R2.2905 CCOCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100012232248 [1,0,1,0,0,0|2,0,0]=4 1539 B21R2.2905 CCOCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100012232248 [1,0,1,0,0,0|2,0,0]=4 1540 B21R2.2905 CCOCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100012232248 [1,0,1,0,0,0|2,0,0]=4 1541 B21R2.2905 CCOCCCOC(c1ccccc1)c2ccccc2 7a_100000757476_100011216954 [1,0,1,0,0,0|2,0,0]=4 1542 B21R2.2905 CCOCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100012232248 [1,0,1,0,0,0|2,0,0]=4 1543 B21R2.2905 CCOCCCSC(c1ccccc1)c2ccccc2 62a_100012232248_100011216954 [1,0,1,0,0,0|2,0,0]=4 1544 B21R2.2905 CCOCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011215890 [1,0,1,0,0,0|1,0,0]=3 1545 B21R2.2905 CCOCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210147 [1,0,1,0,0,0|1,0,0]=3 1546 B21R2.2905 CCOCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210147 [1,0,1,0,0,0|2,0,0]=4 1547 B21R2.2905 CCOCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100011215890 [1,0,1,0,0,0|2,0,0]=4 1548 B21R2.2905 CCOCSCCC(c1ccccc1)c2ccccc2 62a_100000739092_100009813428 [1,0,1,0,0,0|2,0,0]=4 1549 B21R2.2905 CCOCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000739092 [1,0,1,0,0,0|2,0,0]=4 1550 B21R2.2905 CCSCCCOC(c1ccccc1)c2ccccc2 7a_100011216438_100011216954 [1,0,1,0,0,0|2,0,0]=4 1551 B21R2.2905 CCSCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000757381 [1,0,1,0,0,0|1,0,0]=3 1552 B21R2.2905 CCSCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000757381 [1,0,1,0,0,0|1,0,0]=3 1553 B21R2.2905 CCSCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000757381 [1,0,1,0,0,0|2,0,0]=4 1554 B21R2.2905 CCSCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000757381 [1,0,1,0,0,0|2,0,0]=4 1555 B21R2.2905 COCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000730899 [1,0,1,0,0,0|2,0,0]=4 1556 B21R2.2905 COCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000755781 [1,0,1,0,0,0|2,0,0]=4 1557 B21R2.2905 COCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000755781 [1,0,1,0,0,0|2,0,0]=4 1558 B21R2.2905 COCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000730899 [1,0,1,0,0,0|2,0,0]=4 1559 B21R2.2905 COCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000730899 [1,0,1,0,0,0|2,0,0]=4 1560 B21R2.2905 COCCCCSC(c1ccccc1)c2ccccc2 62a_100000730899_100011216954 [1,0,1,0,0,0|2,0,0]=4 1561 B21R2.2905 COCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000740836 [1,0,1,0,0,0|1,0,0]=3 1562 B21R2.2905 COCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000740836 [1,0,1,0,0,0|1,0,0]=3 1563 B21R2.2905 COCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000740836 [1,0,1,0,0,0|2,0,0]=4 1564 B21R2.2905 COCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000740836 [1,0,1,0,0,0|2,0,0]=4 1565 B21R2.2905 COCCNCCC(c1ccccc1)c2ccccc2 2230a_100000209980_100009813428 [1,0,1,0,0,0|1,0,0]=3 1566 B21R2.2905 COCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011201679 [1,0,1,0,0,0|1,0,0]=3 1567 B21R2.2905 COCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011201679 [1,0,1,0,0,0|1,0,0]=3 1568 B21R2.2905 COCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100011201679 [1,0,1,0,0,0|2,0,0]=4 1569 B21R2.2905 COCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100011201679 [1,0,1,0,0,0|2,0,0]=4 1570 B21R2.2905 COCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000209980_100010140906 [1,0,1,0,0,0|2,0,0]=4 1571 B21R2.2905 COCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011201679 [1,0,1,0,0,0|2,0,0]=4 1572 B21R2.2905 COCCOCCC(c1ccccc1)c2ccccc2 34a_100000210237_100009813428 [1,0,1,0,0,0|2,0,0]=4 1573 B21R2.2905 COCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000233755 [1,0,1,0,0,0|2,0,0]=4 1574 B21R2.2905 COCCSCCC(c1ccccc1)c2ccccc2 62a_100000233755_100009813428 [1,0,1,0,0,0|2,0,0]=4 1575 B21R2.2905 COCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000233755 [1,0,1,0,0,0|2,0,0]=4 1576 B21R2.2905 CSCCCCOC(c1ccccc1)c2ccccc2 7a_100011217163_100011216954 [1,0,1,0,0,0|2,0,0]=4 1577 B21R2.2905 CSCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000751147 [1,0,1,0,0,0|1,0,0]=3 1578 B21R2.2905 CSCCNCCC(c1ccccc1)c2ccccc2 2230a_100020590264_100009813428 [1,0,1,0,0,0|1,0,0]=3 1579 B21R2.2905 CSCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000212216 [1,0,1,0,0,0|1,0,0]=3 1580 B21R2.2905 CSCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000751147 [1,0,1,0,0,0|2,0,0]=4 1581 B21R2.2905 CSCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000212216 [1,0,1,0,0,0|2,0,0]=4 1582 B21R2.2905 CSCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100020590264_100010140906 [1,0,1,0,0,0|2,0,0]=4 1583 B21R2.2905 CSCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000212216 [1,0,1,0,0,0|2,0,0]=4 1584 B21R2.2905 CSCCOCCC(c1ccccc1)c2ccccc2 34a_100000230434_100009813428 [1,0,1,0,0,0|2,0,0]=4 1585 B21R2.2905 CSCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000212216 [1,0,1,0,0,0|2,0,0]=4 1586 B21R2.2905 CSCCOCCC(c1ccccc1)c2ccccc2 7a_100000230434_100009813428 [1,0,1,0,0,0|2,0,0]=4 1587 B21R2.2905 CSCCSCCC(c1ccccc1)c2ccccc2 62a_100000212216_100009813428 [1,0,1,0,0,0|2,0,0]=4 1588 B21R2.2905 CSCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000751147 [1,0,1,0,0,0|2,0,0]=4 1589 B21R2.2905 ClCCCCCOC(c1ccccc1)c2ccccc2 7a_100000746330_100011216954 [1,0,1,0,0,0|2,0,0]=4 1590 B21R2.2905 ClCCCOCCC(c1ccccc1)c2ccccc2 34a_100000230001_100009813428 [1,0,1,0,0,0|2,0,0]=4 1591 B21R2.2905 FCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000729378 [1,0,1,0,0,0|2,0,0]=4 1592 B21R2.2905 FCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000729378 [1,0,1,0,0,0|2,0,0]=4 1593 B21R2.2905 FCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000729378 [1,0,1,0,0,0|2,0,0]=4 1594 B21R2.2905 FCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000729378 [1,0,1,0,0,0|2,0,0]=4 1595 B21R2.2905 FCCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000729378 [1,0,1,0,0,0|2,0,0]=4 1596 B21R2.2905 FCCCCCSC(c1ccccc1)c2ccccc2 62a_100000729378_100011216954 [1,0,1,0,0,0|2,0,0]=4 1597 B21R2.2905 FCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000729493 [1,0,1,0,0,0|1,0,0]=3 1598 B21R2.2905 FCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000729493 [1,0,1,0,0,0|1,0,0]=3 1599 B21R2.2905 FCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000729493 [1,0,1,0,0,0|2,0,0]=4 1600 B21R2.2905 FCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000729493 [1,0,1,0,0,0|2,0,0]=4 1601 B21R2.2905 FCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011934791 [1,0,1,0,0,0|1,0,0]=3 1602 B21R2.2905 FCCCNCCC(c1ccccc1)c2ccccc2 2230a_100015189416_100009813428 [1,0,1,0,0,0|1,0,0]=3 1603 B21R2.2905 FCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011934791 [1,0,1,0,0,0|1,0,0]=3 1604 B21R2.2905 FCCCNCCC(c1ccccc1)c2ccccc2 34a_100015189416_100009813428 [1,0,1,0,0,0|1,0,0]=3 1605 B21R2.2905 FCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100011934791 [1,0,1,0,0,0|2,0,0]=4 1606 B21R2.2905 FCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100011934791 [1,0,1,0,0,0|2,0,0]=4 1607 B21R2.2905 FCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100015189416_100010140906 [1,0,1,0,0,0|2,0,0]=4 1608 B21R2.2905 FCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011934791 [1,0,1,0,0,0|2,0,0]=4 1609 B21R2.2905 FCCCOCCC(c1ccccc1)c2ccccc2 34a_100000759539_100009813428 [1,0,1,0,0,0|2,0,0]=4 1610 B21R2.2905 FCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011934791 [1,0,1,0,0,0|2,0,0]=4 1611 B21R2.2905 FCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011934791 [1,0,1,0,0,0|2,0,0]=4 1612 B21R2.2905 FCCCSCCC(c1ccccc1)c2ccccc2 62a_100011934791_100009813428 [1,0,1,0,0,0|2,0,0]=4 1613 B21R2.2905 ICCCCCOC(c1ccccc1)c2ccccc2 7a_200012148887_100011216954 [1,0,1,0,0,0|2,0,0]=4 1614 B21R2.2905 N#CCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000687738 [1,0,1,0,0,0|1,0,1]=4 1615 B21R2.2905 N#CCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011215226 [1,0,1,0,0,0|1,0,1]=4 1616 B21R2.2905 NCCCOCCC(c1ccccc1)c2ccccc2 34a_100000182051_100009813428 [1,0,1,0,0,0|2,0,0]=4 1617 B21R2.2905 O=CCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_200011292268 [1,0,1,0,0,0|1,0,1]=4 1618 B21R2.2905 OCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000746330 [1,0,1,0,0,0|2,0,0]=4 1619 B21R2.2905 OCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000762737_100000211591 [1,0,1,0,0,0|2,0,0]=4 1620 B21R2.2905 OCCCCCNC(c1ccccc1)c2ccccc2 270004a_100000762737_100000210122 [1,0,1,0,0,0|2,0,0]=4 1621 B21R2.2905 OCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000746330 [1,0,1,0,0,0|2,0,0]=4 1622 B21R2.2905 OCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000746330 [1,0,1,0,0,0|2,0,0]=4 1623 B21R2.2905 OCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000746330 [1,0,1,0,0,0|2,0,0]=4 1624 B21R2.2905 OCCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000746330 [1,0,1,0,0,0|2,0,0]=4 1625 B21R2.2905 OCCCCCSC(c1ccccc1)c2ccccc2 62a_100000746330_100011216954 [1,0,1,0,0,0|2,0,0]=4 1626 B21R2.2905 OCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210776 [1,0,1,0,0,0|1,0,0]=3 1627 B21R2.2905 OCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011216708 [1,0,1,0,0,0|1,0,0]=3 1628 B21R2.2905 OCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100011216708 [1,0,1,0,0,0|2,0,0]=4 1629 B21R2.2905 OCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210776 [1,0,1,0,0,0|2,0,0]=4 1630 B21R2.2905 OCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000230001 [1,0,1,0,0,0|1,0,0]=3 1631 B21R2.2905 OCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000230001 [1,0,1,0,0,0|1,0,0]=3 1632 B21R2.2905 OCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000230001 [1,0,1,0,0,0|2,0,0]=4 1633 B21R2.2905 OCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000230001 [1,0,1,0,0,0|2,0,0]=4 1634 B21R2.2905 OCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000230001 [1,0,1,0,0,0|2,0,0]=4 1635 B21R2.2905 OCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011215043 [1,0,1,0,0,0|2,0,0]=4 1636 B21R2.2905 OCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011215043 [1,0,1,0,0,0|2,0,0]=4 1637 B21R2.2905 OCCCSCCC(c1ccccc1)c2ccccc2 62a_100011215043_100009813428 [1,0,1,0,0,0|2,0,0]=4 1638 B21R2.541 C#CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000225692_100009813428 [1,0,1,0,0,0|0,0,2]=4 1639 B21R2.541 C#CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000038162 [1,0,1,0,0,0|0,0,2]=4 1640 B21R2.541 C#CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100000225692_100009813428 [1,0,1,0,0,0|0,0,2]=4 1641 B21R2.541 C#CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000184674 [1,0,1,0,0,0|0,0,2]=4 1642 B21R2.541 C=CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000225617_100009813428 [1,0,1,0,0,0|0,0,2]=4 1643 B21R2.541 C=CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000210623 [1,0,1,0,0,0|0,0,2]=4 1644 B21R2.541 C=CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000225617_100009813428 [1,0,1,0,0,0|0,0,2]=4 1645 B21R2.541 C=CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000210623 [1,0,1,0,0,0|0,0,2]=4 1646 B21R2.541 C=CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100015514636 [1,0,1,0,0,0|0,0,2]=4 1647 B21R2.541 CCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000211992_100009813428 [1,0,1,0,0,0|2,0,0]=4 1648 B21R2.541 CCCC(C)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011216630 [1,0,1,0,0,0|2,0,0]=4 1649 B21R2.541 CCCC(C)CNC(c1ccccc1)c2ccccc2 270004a_100000162943_100000243154 [1,0,1,0,0,0|2,0,0]=4 1650 B21R2.541 CCCC(C)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100011216630 [1,0,1,0,0,0|2,0,0]=4 1651 B21R2.541 CCCC(C)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011216630 [1,0,1,0,0,0|2,0,0]=4 1652 B21R2.541 CCCC(C)COC(c1ccccc1)c2ccccc2 7a_100000211180_100011216630 [1,0,1,0,0,0|2,0,0]=4 1653 B21R2.541 CCCC(C)COC(c1ccccc1)c2ccccc2 7a_100000688023_100011216954 [1,0,1,0,0,0|2,0,0]=4 1654 B21R2.541 CCCC(C)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100011216630 [1,0,1,0,0,0|2,0,0]=4 1655 B21R2.541 CCCC(C)CSC(c1ccccc1)c2ccccc2 62a_100011216630_100011216954 [1,0,1,0,0,0|2,0,0]=4 1656 B21R2.541 CCCC(C)NCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000766640 [1,0,1,0,0,0|2,0,0]=4 1657 B21R2.541 CCCC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000211909 [1,0,1,0,0,0|2,0,0]=4 1658 B21R2.541 CCCC(C)NCC(c1ccccc1)c2ccccc2 34a_100000739227_100000766640 [1,0,1,0,0,0|2,0,0]=4 1659 B21R2.541 CCCC(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_100000766640 [1,0,1,0,0,0|2,0,0]=4 1660 B21R2.541 CCCC(C)OCC(c1ccccc1)c2ccccc2 7a_100011215272_100000766640 [1,0,1,0,0,0|2,0,0]=4 1661 B21R2.541 CCCN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100000747261_100000050448 [1,0,1,0,0,0|0,0,2]=4 1662 B21R2.541 CCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000747261_100009813428 [1,0,1,0,0,0|0,0,0]=2 1663 B21R2.541 CCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000210303 [1,0,1,0,0,0|0,0,0]=2 1664 B21R2.541 CCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000747261_100009813428 [1,0,1,0,0,0|0,0,0]=2 1665 B21R2.541 CCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000210303 [1,0,1,0,0,0|0,0,0]=2 1666 B21R2.541 CCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000210303 [1,0,1,0,0,0|0,0,0]=2 1667 B21R2.541 CCCN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100000747261_100010140906 [1,0,1,0,0,0|1,0,0]=3 1668 B21R2.541 CCCN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100000747261_100010140906 [1,0,1,0,0,0|1,0,0]=3 1669 B21R2.541 CN(CC#N)CCC(c1ccccc1)c2ccccc2 2230a_100000748184_100009813428 [1,0,1,0,0,0|1,0,1]=4 1670 B21R2.541 CN(CC#N)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100011215382 [1,0,1,0,0,0|1,0,1]=4 1671 B21R2.541 CN(CC#N)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100011214920 [1,0,1,0,0,0|1,0,1]=4 1672 B21R2.541 CN(CC=O)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_200015260668 [1,0,1,0,0,0|1,0,1]=4 1673 B21R2.541 CN(CC=O)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_200015260668 [1,0,1,0,0,0|1,0,1]=4 1674 B21R2.541 CN(CC=O)CCC(c1ccccc1)c2ccccc2 34a_100025726140_200009817547 [1,0,1,0,0,0|1,0,1]=4 1675 B21R2.541 CN(CCF)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100011217306 [1,0,1,0,0,0|1,0,0]=3 1676 B21R2.541 CN(CCF)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100011217306 [1,0,1,0,0,0|1,0,0]=3 1677 B21R2.541 CN(CCF)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100011217306 [1,0,1,0,0,0|1,0,0]=3 1678 B21R2.541 CN(CCO)CCC(c1ccccc1)c2ccccc2 2230a_100000210263_100009813428 [1,0,1,0,0,0|1,0,0]=3 1679 B21R2.541 CN(CCO)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000211926 [1,0,1,0,0,0|1,0,0]=3 1680 B21R2.541 CN(CCO)CCC(c1ccccc1)c2ccccc2 269982a_100000210263_100009813428 [1,0,1,0,0,0|1,0,0]=3 1681 B21R2.541 CN(CCO)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000211926 [1,0,1,0,0,0|1,0,0]=3 1682 B21R2.541 CN(CCO)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000211926 [1,0,1,0,0,0|1,0,0]=3 1683 B21R2.541 CN(CCO)CC[S+](c1ccccc1)c2ccccc2 2230a_100000210263_100010140906 [1,0,1,0,0,0|2,0,0]=4 1684 B21R2.541 CN(CCO)CC[S+](c1ccccc1)c2ccccc2 269982a_100000210263_100010140906 [1,0,1,0,0,0|2,0,0]=4 1685 B21R2.541 COCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000766300 [1,0,1,0,0,0|1,0,0]=3 1686 B21R2.541 COCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000766300 [1,0,1,0,0,0|1,0,0]=3 1687 B21R2.541 CSCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100011218213 [1,0,1,0,0,0|1,0,0]=3 1688 B21R2.541 CSCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100011218213 [1,0,1,0,0,0|1,0,0]=3 1689 B21R2.541 CSCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100011218213 [1,0,1,0,0,0|1,0,0]=3 1690 B21R2.289104 CCC(CC)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011215472 [1,0,1,0,0,0|2,0,0]=4 1691 B21R2.289104 CCC(CC)CNC(c1ccccc1)c2ccccc2 2230a_100102946423_100000211591 [1,0,1,0,0,0|2,0,0]=4 1692 B21R2.289104 CCC(CC)CNC(c1ccccc1)c2ccccc2 269862a_100000162943_100000211137 [1,0,1,0,0,0|2,0,0]=4 1693 B21R2.289104 CCC(CC)CNC(c1ccccc1)c2ccccc2 270004a_100000162943_100000211137 [1,0,1,0,0,0|2,0,0]=4 1694 B21R2.289104 CCC(CC)CNC(c1ccccc1)c2ccccc2 270004a_100102946423_100000210122 [1,0,1,0,0,0|2,0,0]=4 1695 B21R2.289104 CCC(CC)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100011215472 [1,0,1,0,0,0|2,0,0]=4 1696 B21R2.289104 CCC(CC)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011215472 [1,0,1,0,0,0|2,0,0]=4 1697 B21R2.289104 CCC(CC)COC(c1ccccc1)c2ccccc2 7a_100000211180_100011215472 [1,0,1,0,0,0|2,0,0]=4 1698 B21R2.289104 CCC(CC)COC(c1ccccc1)c2ccccc2 7a_100000703878_100011216954 [1,0,1,0,0,0|2,0,0]=4 1699 B21R2.289104 CCC(CC)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100011215472 [1,0,1,0,0,0|2,0,0]=4 1700 B21R2.289104 CCC(CC)CSC(c1ccccc1)c2ccccc2 62a_100011215472_100011216954 [1,0,1,0,0,0|2,0,0]=4 1701 B21R2.289104 CCC(CC)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000210860 [1,0,1,0,0,0|2,0,0]=4 1702 B21R2.289104 CCC(CC)OCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210505 [1,0,1,0,0,0|2,0,0]=4 1703 B21R2.289104 CCN(CC)CC=C(c1ccccc1)c2ccccc2 270004a_100000724800_100000050448 [1,0,1,0,0,0|0,0,2]=4 1704 B21R2.289104 CCN(CC)CCC(c1ccccc1)c2ccccc2 2230a_100000724800_100009813428 [1,0,1,0,0,0|0,0,0]=2 1705 B21R2.289104 CCN(CC)CCC(c1ccccc1)c2ccccc2 269956a_100000042499_100009813428 [1,0,1,0,0,0|0,0,0]=2 1706 B21R2.289104 CCN(CC)CCC(c1ccccc1)c2ccccc2 269982a_100000724800_100009813428 [1,0,1,0,0,0|0,0,0]=2 1707 B21R2.289104 CCN(CC)CC[S+](c1ccccc1)c2ccccc2 2230a_100000724800_100010140906 [1,0,1,0,0,0|1,0,0]=3 1708 B21R2.289104 CCN(CC)CC[S+](c1ccccc1)c2ccccc2 269956a_100000042499_100010140906 [1,0,1,0,0,0|1,0,0]=3 1709 B21R2.289104 CCN(CC)CC[S+](c1ccccc1)c2ccccc2 269982a_100000724800_100010140906 [1,0,1,0,0,0|1,0,0]=3 1710 B21R2.289104 CCN(CC)COC(c1ccccc1)c2ccccc2 7a_200015374951_100011216954 [1,0,1,0,0,0|1,0,0]=3 1711 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)C 270004a_100000229938_100011217825 [0,1,1,0,0,0|2,0,0]=4 1712 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000210681 [0,1,1,0,0,0|2,0,0]=4 1713 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000229938_100011215489 [0,1,1,0,0,0|2,0,0]=4 1714 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000210614 [0,1,1,0,0,0|2,0,0]=4 1715 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000210681 [0,1,1,0,0,0|2,0,0]=4 1716 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)F 270004a_100000229938_200011219850 [0,1,1,0,0,0|2,0,0]=4 1717 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000210614 [0,1,1,0,0,0|2,0,0]=4 1718 B23R2.17646 CCCCCCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000210614 [0,1,1,0,0,0|2,0,0]=4 1719 B23R2.17646 CCCCCCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000210614 [0,1,1,0,0,0|2,0,0]=4 1720 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)C 2230a_100000736602_100000210681 [0,1,1,0,0,0|2,0,0]=4 1721 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)C 270004a_100000229938_100000210966 [0,1,1,0,0,0|2,0,0]=4 1722 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)C 34a_100000736602_100000210614 [0,1,1,0,0,0|2,0,0]=4 1723 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000229938_100000211669 [0,1,1,0,0,0|2,0,0]=4 1724 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000210681 [0,1,1,0,0,0|2,0,0]=4 1725 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000229938_100000211064 [0,1,1,0,0,0|2,0,0]=4 1726 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000210614 [0,1,1,0,0,0|2,0,0]=4 1727 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000210681 [0,1,1,0,0,0|2,0,0]=4 1728 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000229938_100000210425 [0,1,1,0,0,0|2,0,0]=4 1729 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000210614 [0,1,1,0,0,0|2,0,0]=4 1730 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000210614 [0,1,1,0,0,0|2,0,0]=4 1731 B23R2.17649 CCCCCCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000210614 [0,1,1,0,0,0|2,0,0]=4 1732 B23R2.17649 CCCCCCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000210614 [0,1,1,0,0,0|2,0,0]=4 1733 B23R2.17649 CCCCCCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000210614 [0,1,1,0,0,0|2,0,0]=4 1734 B23R2.17649 CCCCCCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000210614 [0,1,1,0,0,0|2,0,0]=4 1735 B23R2.23257 CC(CCN)COCCC(c1ccccc1)c2ccccc2 34a_106354213184_100009813428 [0,1,1,0,0,0|2,0,0]=4 1736 B23R2.23257 CCCC(=O)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000747444 [0,1,1,0,0,0|0,0,1]=3 1737 B23R2.23257 CCCC(=O)CNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000747444 [0,1,1,0,0,0|1,0,1]=4 1738 B23R2.23257 CCCC(=O)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000747444 [0,1,1,0,0,0|1,0,1]=4 1739 B23R2.23257 CCCC(=O)CSCCC(c1ccccc1)c2ccccc2 62a_100000747444_100009813428 [0,1,1,0,0,0|1,0,1]=4 1740 B23R2.23257 CCCC(=O)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000747444 [0,1,1,0,0,0|1,0,1]=4 1741 B23R2.23257 CCCC(C)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011216630 [0,1,1,0,0,0|0,0,0]=2 1742 B23R2.23257 CCCC(C)CNCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000243154 [0,1,1,0,0,0|0,0,0]=2 1743 B23R2.23257 CCCC(C)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011216630 [0,1,1,0,0,0|0,0,0]=2 1744 B23R2.23257 CCCC(C)CNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100011216630 [0,1,1,0,0,0|1,0,0]=3 1745 B23R2.23257 CCCC(C)CNCCP(c1ccccc1)c2ccccc2 270004a_107094377242_100000243154 [0,1,1,0,0,0|1,0,0]=3 1746 B23R2.23257 CCCC(C)CNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100011216630 [0,1,1,0,0,0|1,0,0]=3 1747 B23R2.23257 CCCC(C)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011216630 [0,1,1,0,0,0|1,0,0]=3 1748 B23R2.23257 CCCC(C)COCCC(c1ccccc1)c2ccccc2 34a_100000688023_100009813428 [0,1,1,0,0,0|1,0,0]=3 1749 B23R2.23257 CCCC(C)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011216630 [0,1,1,0,0,0|1,0,0]=3 1750 B23R2.23257 CCCC(C)COCCC(c1ccccc1)c2ccccc2 7a_100000688023_100009813428 [0,1,1,0,0,0|1,0,0]=3 1751 B23R2.23257 CCCC(C)COCCN(c1ccccc1)c2ccccc2 34a_100010001939_100011216630 [0,1,1,0,0,0|2,0,0]=4 1752 B23R2.23257 CCCC(C)COCCN(c1ccccc1)c2ccccc2 7a_100010001939_100011216630 [0,1,1,0,0,0|2,0,0]=4 1753 B23R2.23257 CCCC(C)COCC[S+](c1ccccc1)c2ccccc2 7a_100000688023_100010140906 [0,1,1,0,0,0|2,0,0]=4 1754 B23R2.23257 CCCC(C)CSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100011216630 [0,1,1,0,0,0|2,0,0]=4 1755 B23R2.23257 CCCC(C)CSCC[S+](c1ccccc1)c2ccccc2 62a_100011216630_100010140906 [0,1,1,0,0,0|2,0,0]=4 1756 B23R2.23257 CCC[C@H](N)COCCC(c1ccccc1)c2ccccc2 34a_100000732646_100009813428 [0,1,1,0,0,0|1,0,0]=3 1757 B23R2.23257 CCNC(=O)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000183381 [0,1,1,0,0,0|1,0,1]=4 1758 B23R2.23257 CCNC(=O)CNCCC(c1ccccc1)c2ccccc2 2230a_100016988866_100009813428 [0,1,1,0,0,0|1,0,1]=4 1759 B23R2.23257 CCNC(=O)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000183381 [0,1,1,0,0,0|1,0,1]=4 1760 B23R2.23257 CCOC(=O)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000188475 [0,1,1,0,0,0|1,0,1]=4 1761 B23R2.23257 CCOC(=O)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000188475 [0,1,1,0,0,0|1,0,1]=4 1762 B23R2.23257 COCC(N)COCCC(c1ccccc1)c2ccccc2 34a_100000724102_100009813428 [0,1,1,0,0,0|2,0,0]=4 1763 B23R2.23257 COCC(O)CNCCC(c1ccccc1)c2ccccc2 2230a_100000756049_100009813428 [0,1,1,0,0,0|1,0,0]=3 1764 B23R2.23257 COCC(O)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011215053 [0,1,1,0,0,0|1,0,0]=3 1765 B23R2.23257 COCC(O)CNCCC(c1ccccc1)c2ccccc2 34a_100000756049_100009813428 [0,1,1,0,0,0|1,0,0]=3 1766 B23R2.23257 COCC(O)CNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100011215053 [0,1,1,0,0,0|2,0,0]=4 1767 B23R2.23257 COCC(O)CNCC[S+](c1ccccc1)c2ccccc2 2230a_100000756049_100010140906 [0,1,1,0,0,0|2,0,0]=4 1768 B23R2.23257 COCC(O)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011215053 [0,1,1,0,0,0|2,0,0]=4 1769 B23R2.23257 COCC(O)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011215053 [0,1,1,0,0,0|2,0,0]=4 1770 B23R2.23257 COCC(O)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011215053 [0,1,1,0,0,0|2,0,0]=4 1771 B23R2.23257 COCC(O)CSCCC(c1ccccc1)c2ccccc2 62a_100011215053_100009813428 [0,1,1,0,0,0|2,0,0]=4 1772 B23R2.23257 N#CC[C@H](O)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000001066 [0,1,1,0,0,0|1,0,1]=4 1773 B23R2.26823 CC(CO)CCNCCC(c1ccccc1)c2ccccc2 2230a_106354213184_100009813428 [0,1,1,0,0,0|1,0,0]=3 1774 B23R2.26823 CC(CO)CCNCCC(c1ccccc1)c2ccccc2 34a_106354213184_100009813428 [0,1,1,0,0,0|1,0,0]=3 1775 B23R2.26823 CC(CO)CCNCC[S+](c1ccccc1)c2ccccc2 2230a_106354213184_100010140906 [0,1,1,0,0,0|2,0,0]=4 1776 B23R2.26823 CCC(C)CCNCC=C(c1ccccc1)c2ccccc2 270004a_100020591266_100000050448 [0,1,1,0,0,0|0,0,2]=4 1777 B23R2.26823 CCC(C)CCNCCC(c1ccccc1)c2ccccc2 2230a_100020591266_100009813428 [0,1,1,0,0,0|0,0,0]=2 1778 B23R2.26823 CCC(C)CCNCC[S+](c1ccccc1)c2ccccc2 2230a_100020591266_100010140906 [0,1,1,0,0,0|1,0,0]=3 1779 B23R2.26823 CCC(C)CCOCCC(c1ccccc1)c2ccccc2 7a_100011215188_100009813428 [0,1,1,0,0,0|1,0,0]=3 1780 B23R2.26823 CCC(C)CCOCC[S+](c1ccccc1)c2ccccc2 7a_100011215188_100010140906 [0,1,1,0,0,0|2,0,0]=4 1781 B23R2.26823 CNC(=O)CCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000737683 [0,1,1,0,0,0|1,0,1]=4 1782 B23R2.26823 CNC(=O)CCNCCC(c1ccccc1)c2ccccc2 2230a_100000738227_100009813428 [0,1,1,0,0,0|1,0,1]=4 1783 B23R2.26823 CNC(=O)CCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100012179268 [0,1,1,0,0,0|1,0,1]=4 1784 B23R2.26823 CNC(=O)CCNCCC(c1ccccc1)c2ccccc2 34a_100000738227_100009813428 [0,1,1,0,0,0|1,0,1]=4 1785 B23R2.26823 COC(=O)CCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000204255 [0,1,1,0,0,0|1,0,1]=4 1786 B23R2.26823 COC(=O)CCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000742370 [0,1,1,0,0,0|1,0,1]=4 1787 B23R2.26823 COC(C)CCOCCC(c1ccccc1)c2ccccc2 7a_100000764861_100009813428 [0,1,1,0,0,0|2,0,0]=4 1788 B23R2.28171 BrCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000746331_100009813428 [0,1,1,0,0,0|1,0,0]=3 1789 B23R2.28171 BrCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000746331_100009813428 [0,1,1,0,0,0|1,0,0]=3 1790 B23R2.28171 BrCCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000746331_100010140906 [0,1,1,0,0,0|2,0,0]=4 1791 B23R2.28171 BrCCCCOCCOC(c1ccccc1)c2ccccc2 34a_100011216708_100000734929 [0,1,1,0,0,0|2,0,0]=4 1792 B23R2.28171 BrCCOCCOCCC(c1ccccc1)c2ccccc2 34a_100000692535_100009813428 [0,1,1,0,0,0|2,0,0]=4 1793 B23R2.28171 BrCCOCCOCCC(c1ccccc1)c2ccccc2 7a_100000692535_100009813428 [0,1,1,0,0,0|2,0,0]=4 1794 B23R2.28171 C#CCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100010269958 [0,1,1,0,0,0|0,0,1]=3 1795 B23R2.28171 C#CCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000706060_100009813428 [0,1,1,0,0,0|0,0,1]=3 1796 B23R2.28171 C#CCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100010269958 [0,1,1,0,0,0|0,0,1]=3 1797 B23R2.28171 C#CCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000706060_100009813428 [0,1,1,0,0,0|0,0,1]=3 1798 B23R2.28171 C#CCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100010269958 [0,1,1,0,0,0|1,0,1]=4 1799 B23R2.28171 C#CCCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100010269958 [0,1,1,0,0,0|1,0,1]=4 1800 B23R2.28171 C#CCCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000706060_100010140906 [0,1,1,0,0,0|1,0,1]=4 1801 B23R2.28171 C#CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100010269958 [0,1,1,0,0,0|1,0,1]=4 1802 B23R2.28171 C#CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000766709_100009813428 [0,1,1,0,0,0|1,0,1]=4 1803 B23R2.28171 C#CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100010269958 [0,1,1,0,0,0|1,0,1]=4 1804 B23R2.28171 C#CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000766709_100009813428 [0,1,1,0,0,0|1,0,1]=4 1805 B23R2.28171 C#CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100010269958 [0,1,1,0,0,0|1,0,1]=4 1806 B23R2.28171 C#CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100010269958_100009813428 [0,1,1,0,0,0|1,0,1]=4 1807 B23R2.28171 C#CCCCNCCOC(c1ccccc1)c2ccccc2 34a_100000718082_100000734929 [0,1,1,0,0,0|0,0,2]=4 1808 B23R2.28171 C#CCOCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100010402529 [0,1,1,0,0,0|0,0,2]=4 1809 B23R2.28171 C#CCOCCNCCC(c1ccccc1)c2ccccc2 2230a_100000700922_100009813428 [0,1,1,0,0,0|0,0,2]=4 1810 B23R2.28171 C#CCOCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100010402529 [0,1,1,0,0,0|0,0,2]=4 1811 B23R2.28171 C#CCOCCNCCC(c1ccccc1)c2ccccc2 34a_100000700922_100009813428 [0,1,1,0,0,0|0,0,2]=4 1812 B23R2.28171 C=CCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011215482 [0,1,1,0,0,0|0,0,1]=3 1813 B23R2.28171 C=CCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000703577_100009813428 [0,1,1,0,0,0|0,0,1]=3 1814 B23R2.28171 C=CCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011215482 [0,1,1,0,0,0|0,0,1]=3 1815 B23R2.28171 C=CCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000703577_100009813428 [0,1,1,0,0,0|0,0,1]=3 1816 B23R2.28171 C=CCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100011215482 [0,1,1,0,0,0|1,0,1]=4 1817 B23R2.28171 C=CCCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100011215482 [0,1,1,0,0,0|1,0,1]=4 1818 B23R2.28171 C=CCCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000703577_100010140906 [0,1,1,0,0,0|1,0,1]=4 1819 B23R2.28171 C=CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011215482 [0,1,1,0,0,0|1,0,1]=4 1820 B23R2.28171 C=CCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000766645_100009813428 [0,1,1,0,0,0|1,0,1]=4 1821 B23R2.28171 C=CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011215482 [0,1,1,0,0,0|1,0,1]=4 1822 B23R2.28171 C=CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000766645_100009813428 [0,1,1,0,0,0|1,0,1]=4 1823 B23R2.28171 C=CCCCNCCOC(c1ccccc1)c2ccccc2 2230a_100000700776_100000734929 [0,1,1,0,0,0|0,0,2]=4 1824 B23R2.28171 C=CCCCNCCOC(c1ccccc1)c2ccccc2 34a_100000700776_100000734929 [0,1,1,0,0,0|0,0,2]=4 1825 B23R2.28171 C=COCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000210767_100009813428 [0,1,1,0,0,0|0,0,2]=4 1826 B23R2.28171 C=COCCCNCCC(c1ccccc1)c2ccccc2 34a_100000210767_100009813428 [0,1,1,0,0,0|0,0,2]=4 1827 B23R2.28171 CC/C=C\CCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100015370543 [0,1,1,0,0,0|0,0,1]=3 1828 B23R2.28171 CC/C=C\CCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100015370543 [0,1,1,0,0,0|0,0,1]=3 1829 B23R2.28171 CC/C=C\CCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100015370543 [0,1,1,0,0,0|1,0,1]=4 1830 B23R2.28171 CC/C=C\CCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100015370543 [0,1,1,0,0,0|1,0,1]=4 1831 B23R2.28171 CC/C=C\CCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100015370543 [0,1,1,0,0,0|1,0,1]=4 1832 B23R2.28171 CC/C=C\CCOCCC(c1ccccc1)c2ccccc2 34a_100016288707_100009813428 [0,1,1,0,0,0|1,0,1]=4 1833 B23R2.28171 CC/C=C\CCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100015370543 [0,1,1,0,0,0|1,0,1]=4 1834 B23R2.28171 CC/C=C\CCOCCC(c1ccccc1)c2ccccc2 7a_100016288707_100009813428 [0,1,1,0,0,0|1,0,1]=4 1835 B23R2.28171 CC=CCCCOCCC(c1ccccc1)c2ccccc2 34a_100020645299_100009813428 [0,1,1,0,0,0|1,0,1]=4 1836 B23R2.28171 CCC#CCCOCCC(c1ccccc1)c2ccccc2 34a_100000036655_100009813428 [0,1,1,0,0,0|1,0,1]=4 1837 B23R2.28171 CCC#CCCOCCC(c1ccccc1)c2ccccc2 7a_100000036655_100009813428 [0,1,1,0,0,0|1,0,1]=4 1838 B23R2.28171 CCC/C=C/COCCC(c1ccccc1)c2ccccc2 34a_100016278788_100009813428 [0,1,1,0,0,0|1,0,1]=4 1839 B23R2.28171 CCC/C=C/COCCC(c1ccccc1)c2ccccc2 7a_100016278788_100009813428 [0,1,1,0,0,0|1,0,1]=4 1840 B23R2.28171 CCCC#CCOCCC(c1ccccc1)c2ccccc2 34a_100000034806_100009813428 [0,1,1,0,0,0|1,0,1]=4 1841 B23R2.28171 CCCC#CCOCCC(c1ccccc1)c2ccccc2 7a_100000034806_100009813428 [0,1,1,0,0,0|1,0,1]=4 1842 B23R2.28171 CCCC/C=C\CCOC(c1ccccc1)c2ccccc2 7a_200016286491_100011216954 [0,1,1,0,0,0|1,0,1]=4 1843 B23R2.28171 CCCCC#CCCOC(c1ccccc1)c2ccccc2 7a_100000037610_100011216954 [0,1,1,0,0,0|1,0,1]=4 1844 B23R2.28171 CCCCC/C=C/COC(c1ccccc1)c2ccccc2 7a_100016258190_100011216954 [0,1,1,0,0,0|1,0,1]=4 1845 B23R2.28171 CCCCCC#CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100009816472 [0,1,1,0,0,0|1,0,1]=4 1846 B23R2.28171 CCCCCC#CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100009816472 [0,1,1,0,0,0|1,0,1]=4 1847 B23R2.28171 CCCCCC#CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100009816472 [0,1,1,0,0,0|1,0,1]=4 1848 B23R2.28171 CCCCCC#CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100009816472 [0,1,1,0,0,0|1,0,1]=4 1849 B23R2.28171 CCCCCC#CCOC(c1ccccc1)c2ccccc2 7a_200000033628_100011216954 [0,1,1,0,0,0|1,0,1]=4 1850 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210759 [0,1,1,0,0,0|1,0,0]=3 1851 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000229939_100000211591 [0,1,1,0,0,0|1,0,0]=3 1852 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccc2 270004a_100000229939_100000210122 [0,1,1,0,0,0|1,0,0]=3 1853 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210759 [0,1,1,0,0,0|1,0,0]=3 1854 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210759 [0,1,1,0,0,0|2,0,0]=4 1855 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccn2 270004a_100000229939_100000210380 [0,1,1,0,0,0|2,0,0]=4 1856 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000210759 [0,1,1,0,0,0|2,0,0]=4 1857 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2cccnc2 270004a_100000229939_100000735413 [0,1,1,0,0,0|2,0,0]=4 1858 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000210759 [0,1,1,0,0,0|2,0,0]=4 1859 B23R2.28171 CCCCCCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210759 [0,1,1,0,0,0|2,0,0]=4 1860 B23R2.28171 CCCCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210681 [0,1,1,0,0,0|1,0,0]=3 1861 B23R2.28171 CCCCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210614 [0,1,1,0,0,0|1,0,0]=3 1862 B23R2.28171 CCCCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210614 [0,1,1,0,0,0|1,0,0]=3 1863 B23R2.28171 CCCCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210614 [0,1,1,0,0,0|1,0,0]=3 1864 B23R2.28171 CCCCCCNCC=C(c1ccccc1)c2ccccc2 270004a_100000210581_100000050448 [0,1,1,0,0,0|0,0,2]=4 1865 B23R2.28171 CCCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000210581_100009813428 [0,1,1,0,0,0|0,0,0]=2 1866 B23R2.28171 CCCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000210314 [0,1,1,0,0,0|0,0,0]=2 1867 B23R2.28171 CCCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000210314 [0,1,1,0,0,0|0,0,0]=2 1868 B23R2.28171 CCCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000210314 [0,1,1,0,0,0|1,0,0]=3 1869 B23R2.28171 CCCCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000210314 [0,1,1,0,0,0|1,0,0]=3 1870 B23R2.28171 CCCCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000210581_100010140906 [0,1,1,0,0,0|1,0,0]=3 1871 B23R2.28171 CCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210314 [0,1,1,0,0,0|1,0,0]=3 1872 B23R2.28171 CCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000210259_100009813428 [0,1,1,0,0,0|1,0,0]=3 1873 B23R2.28171 CCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210314 [0,1,1,0,0,0|1,0,0]=3 1874 B23R2.28171 CCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000210259_100009813428 [0,1,1,0,0,0|1,0,0]=3 1875 B23R2.28171 CCCCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000210314 [0,1,1,0,0,0|2,0,0]=4 1876 B23R2.28171 CCCCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000210314 [0,1,1,0,0,0|2,0,0]=4 1877 B23R2.28171 CCCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000210259_100010140906 [0,1,1,0,0,0|2,0,0]=4 1878 B23R2.28171 CCCCCNCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_100000210326 [0,1,1,0,0,0|1,0,0]=3 1879 B23R2.28171 CCCCCNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100000718602 [0,1,1,0,0,0|1,0,0]=3 1880 B23R2.28171 CCCCCNCCOC(c1ccccc1)c2ccccc2 2230a_100000209983_100000734929 [0,1,1,0,0,0|0,0,0]=2 1881 B23R2.28171 CCCCCOCCOC(c1ccccc1)c2ccccc2 34a_100000210253_100000734929 [0,1,1,0,0,0|1,0,0]=3 1882 B23R2.28171 CCCCCOCCOC(c1ccccc1)c2ccccc2 7a_100000210253_100000734929 [0,1,1,0,0,0|1,0,0]=3 1883 B23R2.28171 CCCCCOCCOC(c1ccccc1)c2ccccc2 7a_100011215259_100011216954 [0,1,1,0,0,0|1,0,0]=3 1884 B23R2.28171 CCCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000210326_100000734929 [0,1,1,0,0,0|1,0,0]=3 1885 B23R2.28171 CCCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000210326 [0,1,1,0,0,0|1,0,0]=3 1886 B23R2.28171 CCCCOCCCNC(c1ccccc1)c2ccccc2 2230a_200000211371_100000211591 [0,1,1,0,0,0|2,0,0]=4 1887 B23R2.28171 CCCCOCCCNC(c1ccccc1)c2ccccc2 270004a_200000211371_100000210122 [0,1,1,0,0,0|2,0,0]=4 1888 B23R2.28171 CCCCOCCCOC(c1ccccc1)c2ccccc2 7a_200011215613_100011216954 [0,1,1,0,0,0|2,0,0]=4 1889 B23R2.28171 CCCCOCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000743108 [0,1,1,0,0,0|2,0,0]=4 1890 B23R2.28171 CCCCOCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000743108 [0,1,1,0,0,0|2,0,0]=4 1891 B23R2.28171 CCCCOCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000743108 [0,1,1,0,0,0|2,0,0]=4 1892 B23R2.28171 CCCCOCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000743108 [0,1,1,0,0,0|2,0,0]=4 1893 B23R2.28171 CCCCOCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011995733 [0,1,1,0,0,0|0,0,0]=2 1894 B23R2.28171 CCCCOCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011995733 [0,1,1,0,0,0|0,0,0]=2 1895 B23R2.28171 CCCCOCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100011995733 [0,1,1,0,0,0|1,0,0]=3 1896 B23R2.28171 CCCCOCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100011995733 [0,1,1,0,0,0|1,0,0]=3 1897 B23R2.28171 CCCCOCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011995733 [0,1,1,0,0,0|1,0,0]=3 1898 B23R2.28171 CCCCOCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100011995733 [0,1,1,0,0,0|2,0,0]=4 1899 B23R2.28171 CCCCOCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011995733 [0,1,1,0,0,0|1,0,0]=3 1900 B23R2.28171 CCCCOCSCCC(c1ccccc1)c2ccccc2 62a_100011995733_100009813428 [0,1,1,0,0,0|1,0,0]=3 1901 B23R2.28171 CCCCOCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100011995733 [0,1,1,0,0,0|2,0,0]=4 1902 B23R2.28171 CCCCOCSCC[S+](c1ccccc1)c2ccccc2 62a_100011995733_100010140906 [0,1,1,0,0,0|2,0,0]=4 1903 B23R2.28171 CCCOCCNCC=C(c1ccccc1)c2ccccc2 270004a_100161115042_100000050448 [0,1,1,0,0,0|0,0,2]=4 1904 B23R2.28171 CCCOCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011215938 [0,1,1,0,0,0|0,0,0]=2 1905 B23R2.28171 CCCOCCNCCC(c1ccccc1)c2ccccc2 2230a_100161115042_100009813428 [0,1,1,0,0,0|0,0,0]=2 1906 B23R2.28171 CCCOCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011215938 [0,1,1,0,0,0|0,0,0]=2 1907 B23R2.28171 CCCOCCNCCC(c1ccccc1)c2ccccc2 34a_100161115042_100009813428 [0,1,1,0,0,0|0,0,0]=2 1908 B23R2.28171 CCCOCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100011215938 [0,1,1,0,0,0|1,0,0]=3 1909 B23R2.28171 CCCOCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100011215938 [0,1,1,0,0,0|1,0,0]=3 1910 B23R2.28171 CCCOCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100161115042_100010140906 [0,1,1,0,0,0|1,0,0]=3 1911 B23R2.28171 CCCOCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011215938 [0,1,1,0,0,0|1,0,0]=3 1912 B23R2.28171 CCCOCCOCCC(c1ccccc1)c2ccccc2 34a_100000752267_100009813428 [0,1,1,0,0,0|1,0,0]=3 1913 B23R2.28171 CCCOCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011215938 [0,1,1,0,0,0|1,0,0]=3 1914 B23R2.28171 CCCOCCOCCC(c1ccccc1)c2ccccc2 7a_100000752267_100009813428 [0,1,1,0,0,0|1,0,0]=3 1915 B23R2.28171 CCCOCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100011215938 [0,1,1,0,0,0|2,0,0]=4 1916 B23R2.28171 CCCOCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100011215938 [0,1,1,0,0,0|2,0,0]=4 1917 B23R2.28171 CCCOCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000752267_100010140906 [0,1,1,0,0,0|2,0,0]=4 1918 B23R2.28171 CCCOCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011215938 [0,1,1,0,0,0|1,0,0]=3 1919 B23R2.28171 CCCOCCSCCC(c1ccccc1)c2ccccc2 62a_100011215938_100009813428 [0,1,1,0,0,0|1,0,0]=3 1920 B23R2.28171 CCCOCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100011215938 [0,1,1,0,0,0|2,0,0]=4 1921 B23R2.28171 CCCOCCSCC[S+](c1ccccc1)c2ccccc2 62a_100011215938_100010140906 [0,1,1,0,0,0|2,0,0]=4 1922 B23R2.28171 CCCSCCNCC=C(c1ccccc1)c2ccccc2 270004a_100020603323_100000050448 [0,1,1,0,0,0|0,0,2]=4 1923 B23R2.28171 CCCSCCNCCC(c1ccccc1)c2ccccc2 2230a_100020603323_100009813428 [0,1,1,0,0,0|0,0,0]=2 1924 B23R2.28171 CCCSCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100020603323_100010140906 [0,1,1,0,0,0|1,0,0]=3 1925 B23R2.28171 CCCSCCOCCC(c1ccccc1)c2ccccc2 34a_200000230433_100009813428 [0,1,1,0,0,0|1,0,0]=3 1926 B23R2.28171 CCCSCCOCCC(c1ccccc1)c2ccccc2 7a_200000230433_100009813428 [0,1,1,0,0,0|1,0,0]=3 1927 B23R2.28171 CCCSCCOCC[S+](c1ccccc1)c2ccccc2 7a_200000230433_100010140906 [0,1,1,0,0,0|2,0,0]=4 1928 B23R2.28171 CCOCCCNCC=C(c1ccccc1)c2ccccc2 270004a_100000210961_100000050448 [0,1,1,0,0,0|0,0,2]=4 1929 B23R2.28171 CCOCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000210961_100009813428 [0,1,1,0,0,0|0,0,0]=2 1930 B23R2.28171 CCOCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100012232248 [0,1,1,0,0,0|0,0,0]=2 1931 B23R2.28171 CCOCCCNCCC(c1ccccc1)c2ccccc2 34a_100000210961_100009813428 [0,1,1,0,0,0|0,0,0]=2 1932 B23R2.28171 CCOCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100012232248 [0,1,1,0,0,0|0,0,0]=2 1933 B23R2.28171 CCOCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100012232248 [0,1,1,0,0,0|1,0,0]=3 1934 B23R2.28171 CCOCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100012232248 [0,1,1,0,0,0|1,0,0]=3 1935 B23R2.28171 CCOCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000210961_100010140906 [0,1,1,0,0,0|1,0,0]=3 1936 B23R2.28171 CCOCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100012232248 [0,1,1,0,0,0|1,0,0]=3 1937 B23R2.28171 CCOCCCOCCC(c1ccccc1)c2ccccc2 34a_100000757476_100009813428 [0,1,1,0,0,0|1,0,0]=3 1938 B23R2.28171 CCOCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100012232248 [0,1,1,0,0,0|1,0,0]=3 1939 B23R2.28171 CCOCCCOCCC(c1ccccc1)c2ccccc2 7a_100000757476_100009813428 [0,1,1,0,0,0|1,0,0]=3 1940 B23R2.28171 CCOCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100012232248 [0,1,1,0,0,0|2,0,0]=4 1941 B23R2.28171 CCOCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100012232248 [0,1,1,0,0,0|2,0,0]=4 1942 B23R2.28171 CCOCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000757476_100010140906 [0,1,1,0,0,0|2,0,0]=4 1943 B23R2.28171 CCOCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100012232248 [0,1,1,0,0,0|1,0,0]=3 1944 B23R2.28171 CCOCCCSCCC(c1ccccc1)c2ccccc2 62a_100012232248_100009813428 [0,1,1,0,0,0|1,0,0]=3 1945 B23R2.28171 CCOCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100012232248 [0,1,1,0,0,0|2,0,0]=4 1946 B23R2.28171 CCOCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100012232248_100010140906 [0,1,1,0,0,0|2,0,0]=4 1947 B23R2.28171 CCOCCNCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_100011215890 [0,1,1,0,0,0|2,0,0]=4 1948 B23R2.28171 CCOCCNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100000210147 [0,1,1,0,0,0|2,0,0]=4 1949 B23R2.28171 CCOCCNCCOC(c1ccccc1)c2ccccc2 2230a_102516460346_100000734929 [0,1,1,0,0,0|1,0,0]=3 1950 B23R2.28171 CCOCCNCCOC(c1ccccc1)c2ccccc2 34a_102516460346_100000734929 [0,1,1,0,0,0|1,0,0]=3 1951 B23R2.28171 CCOCCOCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011211534 [0,1,1,0,0,0|2,0,0]=4 1952 B23R2.28171 CCOCCOCCNC(c1ccccc1)c2ccccc2 2230a_100102712874_100000211591 [0,1,1,0,0,0|2,0,0]=4 1953 B23R2.28171 CCOCCOCCNC(c1ccccc1)c2ccccc2 270004a_100102712874_100000210122 [0,1,1,0,0,0|2,0,0]=4 1954 B23R2.28171 CCOCCOCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011211534 [0,1,1,0,0,0|2,0,0]=4 1955 B23R2.28171 CCOCCOCCOC(c1ccccc1)c2ccccc2 34a_100000210136_100000734929 [0,1,1,0,0,0|2,0,0]=4 1956 B23R2.28171 CCOCCOCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011211534 [0,1,1,0,0,0|2,0,0]=4 1957 B23R2.28171 CCOCCOCCOC(c1ccccc1)c2ccccc2 7a_100000210136_100000734929 [0,1,1,0,0,0|2,0,0]=4 1958 B23R2.28171 CCOCCOCCOC(c1ccccc1)c2ccccc2 7a_100000210240_100011216954 [0,1,1,0,0,0|2,0,0]=4 1959 B23R2.28171 CCOCCOCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011211534 [0,1,1,0,0,0|2,0,0]=4 1960 B23R2.28171 CCOCCOCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011211534 [0,1,1,0,0,0|2,0,0]=4 1961 B23R2.28171 CCOCCOCCSC(c1ccccc1)c2ccccc2 62a_100011211534_100011216954 [0,1,1,0,0,0|2,0,0]=4 1962 B23R2.28171 CCOCCSCCOC(c1ccccc1)c2ccccc2 62a_100000210147_100000734929 [0,1,1,0,0,0|2,0,0]=4 1963 B23R2.28171 CCOCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100011215890 [0,1,1,0,0,0|2,0,0]=4 1964 B23R2.28171 CCSCCCOCCC(c1ccccc1)c2ccccc2 34a_100011216438_100009813428 [0,1,1,0,0,0|1,0,0]=3 1965 B23R2.28171 CCSCCCOCCC(c1ccccc1)c2ccccc2 7a_100011216438_100009813428 [0,1,1,0,0,0|1,0,0]=3 1966 B23R2.28171 CCSCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100011216438_100010140906 [0,1,1,0,0,0|2,0,0]=4 1967 B23R2.28171 CCSCCNCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_100000757381 [0,1,1,0,0,0|2,0,0]=4 1968 B23R2.28171 CCSCCNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100000757381 [0,1,1,0,0,0|2,0,0]=4 1969 B23R2.28171 CCSCCNCCOC(c1ccccc1)c2ccccc2 2230a_100000106463_100000734929 [0,1,1,0,0,0|1,0,0]=3 1970 B23R2.28171 CCSCCOCCOC(c1ccccc1)c2ccccc2 34a_100000212035_100000734929 [0,1,1,0,0,0|2,0,0]=4 1971 B23R2.28171 CCSCCOCCOC(c1ccccc1)c2ccccc2 7a_100000212035_100000734929 [0,1,1,0,0,0|2,0,0]=4 1972 B23R2.28171 CCSCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000757381 [0,1,1,0,0,0|2,0,0]=4 1973 B23R2.28171 CCSCCSCCOC(c1ccccc1)c2ccccc2 62a_100000757381_100000734929 [0,1,1,0,0,0|2,0,0]=4 1974 B23R2.28171 CNCCCOCCOC(c1ccccc1)c2ccccc2 34a_100000213112_100000734929 [0,1,1,0,0,0|2,0,0]=4 1975 B23R2.28171 COCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011998445 [0,1,1,0,0,0|2,0,0]=4 1976 B23R2.28171 COCCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011998445 [0,1,1,0,0,0|2,0,0]=4 1977 B23R2.28171 COCCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011998445 [0,1,1,0,0,0|2,0,0]=4 1978 B23R2.28171 COCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011998445 [0,1,1,0,0,0|2,0,0]=4 1979 B23R2.28171 COCCCCCCOC(c1ccccc1)c2ccccc2 7a_200012092642_100011216954 [0,1,1,0,0,0|2,0,0]=4 1980 B23R2.28171 COCCCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011998445 [0,1,1,0,0,0|2,0,0]=4 1981 B23R2.28171 COCCCCCCSC(c1ccccc1)c2ccccc2 62a_100011998445_100011216954 [0,1,1,0,0,0|2,0,0]=4 1982 B23R2.28171 COCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000730899 [0,1,1,0,0,0|0,0,0]=2 1983 B23R2.28171 COCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000755781 [0,1,1,0,0,0|0,0,0]=2 1984 B23R2.28171 COCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000730899 [0,1,1,0,0,0|1,0,0]=3 1985 B23R2.28171 COCCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000755781 [0,1,1,0,0,0|1,0,0]=3 1986 B23R2.28171 COCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000755781 [0,1,1,0,0,0|1,0,0]=3 1987 B23R2.28171 COCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000740925_100009813428 [0,1,1,0,0,0|1,0,0]=3 1988 B23R2.28171 COCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000730899 [0,1,1,0,0,0|1,0,0]=3 1989 B23R2.28171 COCCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000755781 [0,1,1,0,0,0|2,0,0]=4 1990 B23R2.28171 COCCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000730899 [0,1,1,0,0,0|2,0,0]=4 1991 B23R2.28171 COCCCCSCCC(c1ccccc1)c2ccccc2 62a_100000730899_100009813428 [0,1,1,0,0,0|1,0,0]=3 1992 B23R2.28171 COCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000730899 [0,1,1,0,0,0|1,0,0]=3 1993 B23R2.28171 COCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000730899_100010140906 [0,1,1,0,0,0|2,0,0]=4 1994 B23R2.28171 COCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000730899 [0,1,1,0,0,0|2,0,0]=4 1995 B23R2.28171 COCCCNCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_100000740836 [0,1,1,0,0,0|2,0,0]=4 1996 B23R2.28171 COCCCNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100000740836 [0,1,1,0,0,0|2,0,0]=4 1997 B23R2.28171 COCCCNCCOC(c1ccccc1)c2ccccc2 34a_100150723488_100000734929 [0,1,1,0,0,0|1,0,0]=3 1998 B23R2.28171 COCCCOCCOC(c1ccccc1)c2ccccc2 34a_100000740835_100000734929 [0,1,1,0,0,0|2,0,0]=4 1999 B23R2.28171 COCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000709357_100000734929 [0,1,1,0,0,0|2,0,0]=4 2000 B23R2.28171 COCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000709357 [0,1,1,0,0,0|2,0,0]=4 2001 B23R2.28171 COCCOCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000231047 [0,1,1,0,0,0|1,0,0]=3 2002 B23R2.28171 COCCOCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000231047 [0,1,1,0,0,0|2,0,0]=4 2003 B23R2.28171 COCCOCSCCC(c1ccccc1)c2ccccc2 62a_100000231047_100009813428 [0,1,1,0,0,0|2,0,0]=4 2004 B23R2.28171 COCCOCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000231047 [0,1,1,0,0,0|2,0,0]=4 2005 B23R2.28171 CSCCCCOCCC(c1ccccc1)c2ccccc2 34a_100011217163_100009813428 [0,1,1,0,0,0|1,0,0]=3 2006 B23R2.28171 CSCCCCOCCC(c1ccccc1)c2ccccc2 7a_100011217163_100009813428 [0,1,1,0,0,0|1,0,0]=3 2007 B23R2.28171 CSCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100011217163_100010140906 [0,1,1,0,0,0|2,0,0]=4 2008 B23R2.28171 CSCCCNCCOC(c1ccccc1)c2ccccc2 2230a_100000749238_100000734929 [0,1,1,0,0,0|1,0,0]=3 2009 B23R2.28171 CSCCCOCCOC(c1ccccc1)c2ccccc2 34a_100000690336_100000734929 [0,1,1,0,0,0|2,0,0]=4 2010 B23R2.28171 CSCCCOCCOC(c1ccccc1)c2ccccc2 7a_100000690336_100000734929 [0,1,1,0,0,0|2,0,0]=4 2011 B23R2.28171 ClCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000746330_100009813428 [0,1,1,0,0,0|1,0,0]=3 2012 B23R2.28171 ClCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000746330_100009813428 [0,1,1,0,0,0|1,0,0]=3 2013 B23R2.28171 ClCCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000746330_100010140906 [0,1,1,0,0,0|2,0,0]=4 2014 B23R2.28171 ClCCCCOCCOC(c1ccccc1)c2ccccc2 34a_100000210776_100000734929 [0,1,1,0,0,0|2,0,0]=4 2015 B23R2.28171 ClCCCCOCCOC(c1ccccc1)c2ccccc2 7a_100000210776_100000734929 [0,1,1,0,0,0|2,0,0]=4 2016 B23R2.28171 ClCCOCCOCCC(c1ccccc1)c2ccccc2 34a_100011215305_100009813428 [0,1,1,0,0,0|2,0,0]=4 2017 B23R2.28171 ClCCOCCOCCC(c1ccccc1)c2ccccc2 7a_100011215305_100009813428 [0,1,1,0,0,0|2,0,0]=4 2018 B23R2.28171 FCCCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100015922095 [0,1,1,0,0,0|2,0,0]=4 2019 B23R2.28171 FCCCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100015922095 [0,1,1,0,0,0|2,0,0]=4 2020 B23R2.28171 FCCCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100015922095 [0,1,1,0,0,0|2,0,0]=4 2021 B23R2.28171 FCCCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100015922095 [0,1,1,0,0,0|2,0,0]=4 2022 B23R2.28171 FCCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000729378 [0,1,1,0,0,0|0,0,0]=2 2023 B23R2.28171 FCCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000729378 [0,1,1,0,0,0|0,0,0]=2 2024 B23R2.28171 FCCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000729378 [0,1,1,0,0,0|1,0,0]=3 2025 B23R2.28171 FCCCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000729378 [0,1,1,0,0,0|1,0,0]=3 2026 B23R2.28171 FCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000729378 [0,1,1,0,0,0|1,0,0]=3 2027 B23R2.28171 FCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000729378 [0,1,1,0,0,0|1,0,0]=3 2028 B23R2.28171 FCCCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000729378 [0,1,1,0,0,0|2,0,0]=4 2029 B23R2.28171 FCCCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000729378 [0,1,1,0,0,0|2,0,0]=4 2030 B23R2.28171 FCCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000729378_100010140906 [0,1,1,0,0,0|2,0,0]=4 2031 B23R2.28171 FCCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000729378 [0,1,1,0,0,0|2,0,0]=4 2032 B23R2.28171 FCCCCNCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_100000729493 [0,1,1,0,0,0|2,0,0]=4 2033 B23R2.28171 FCCCCNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100000729493 [0,1,1,0,0,0|2,0,0]=4 2034 B23R2.28171 FCCCCOCCOC(c1ccccc1)c2ccccc2 34a_100011995726_100000734929 [0,1,1,0,0,0|2,0,0]=4 2035 B23R2.28171 FCCCCOCCOC(c1ccccc1)c2ccccc2 7a_100011995726_100000734929 [0,1,1,0,0,0|2,0,0]=4 2036 B23R2.28171 FCCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000729493_100000734929 [0,1,1,0,0,0|2,0,0]=4 2037 B23R2.28171 FCCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000729493 [0,1,1,0,0,0|2,0,0]=4 2038 B23R2.28171 FCCOCCOCCC(c1ccccc1)c2ccccc2 34a_200015357709_100009813428 [0,1,1,0,0,0|2,0,0]=4 2039 B23R2.28171 FCCOCCOCCC(c1ccccc1)c2ccccc2 7a_200015357709_100009813428 [0,1,1,0,0,0|2,0,0]=4 2040 B23R2.28171 ICCCCCOCCC(c1ccccc1)c2ccccc2 34a_200012148887_100009813428 [0,1,1,0,0,0|1,0,0]=3 2041 B23R2.28171 ICCCCCOCCC(c1ccccc1)c2ccccc2 7a_200012148887_100009813428 [0,1,1,0,0,0|1,0,0]=3 2042 B23R2.28171 ICCCCCOCC[S+](c1ccccc1)c2ccccc2 7a_200012148887_100010140906 [0,1,1,0,0,0|2,0,0]=4 2043 B23R2.28171 ICCCCOCCOC(c1ccccc1)c2ccccc2 34a_200012148704_100000734929 [0,1,1,0,0,0|2,0,0]=4 2044 B23R2.28171 ICCOCCOCCC(c1ccccc1)c2ccccc2 34a_100012149058_100009813428 [0,1,1,0,0,0|2,0,0]=4 2045 B23R2.28171 ICCOCCOCCC(c1ccccc1)c2ccccc2 7a_100012149058_100009813428 [0,1,1,0,0,0|2,0,0]=4 2046 B23R2.28171 N#CCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000211819 [0,1,1,0,0,0|0,0,1]=3 2047 B23R2.28171 N#CCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000211819 [0,1,1,0,0,0|1,0,1]=4 2048 B23R2.28171 N#CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000211819 [0,1,1,0,0,0|1,0,1]=4 2049 B23R2.28171 N#CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000211819 [0,1,1,0,0,0|1,0,1]=4 2050 B23R2.28171 N#CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100011219923_100009813428 [0,1,1,0,0,0|1,0,1]=4 2051 B23R2.28171 N#CCOCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_200000047693 [0,1,1,0,0,0|1,0,1]=4 2052 B23R2.28171 NCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000762737_100009813428 [0,1,1,0,0,0|1,0,0]=3 2053 B23R2.28171 NCCCCOCCOC(c1ccccc1)c2ccccc2 34a_100000750430_100000734929 [0,1,1,0,0,0|2,0,0]=4 2054 B23R2.28171 NCCOCCOCCC(c1ccccc1)c2ccccc2 34a_100000211614_100009813428 [0,1,1,0,0,0|2,0,0]=4 2055 B23R2.28171 O=CCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000139335 [0,1,1,0,0,0|0,0,1]=3 2056 B23R2.28171 O=CCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000139335 [0,1,1,0,0,0|1,0,1]=4 2057 B23R2.28171 O=CCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000139335 [0,1,1,0,0,0|1,0,1]=4 2058 B23R2.28171 O=CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100000139335_100009813428 [0,1,1,0,0,0|1,0,1]=4 2059 B23R2.28171 O=CCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000139335 [0,1,1,0,0,0|1,0,1]=4 2060 B23R2.28171 OCCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000760002 [0,1,1,0,0,0|2,0,0]=4 2061 B23R2.28171 OCCCCCCCNC(c1ccccc1)c2ccccc2 2230a_100011996573_100000211591 [0,1,1,0,0,0|2,0,0]=4 2062 B23R2.28171 OCCCCCCCNC(c1ccccc1)c2ccccc2 270004a_100011996573_100000210122 [0,1,1,0,0,0|2,0,0]=4 2063 B23R2.28171 OCCCCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000760002 [0,1,1,0,0,0|2,0,0]=4 2064 B23R2.28171 OCCCCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000760002 [0,1,1,0,0,0|2,0,0]=4 2065 B23R2.28171 OCCCCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000760002 [0,1,1,0,0,0|2,0,0]=4 2066 B23R2.28171 OCCCCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000760002 [0,1,1,0,0,0|2,0,0]=4 2067 B23R2.28171 OCCCCCCCSC(c1ccccc1)c2ccccc2 62a_100000760002_100011216954 [0,1,1,0,0,0|2,0,0]=4 2068 B23R2.28171 OCCCCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000766143 [0,1,1,0,0,0|2,0,0]=4 2069 B23R2.28171 OCCCCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000766143 [0,1,1,0,0,0|2,0,0]=4 2070 B23R2.28171 OCCCCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000766143 [0,1,1,0,0,0|2,0,0]=4 2071 B23R2.28171 OCCCCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000766143 [0,1,1,0,0,0|2,0,0]=4 2072 B23R2.28171 OCCCCCNCC=C(c1ccccc1)c2ccccc2 270004a_100000762737_100000050448 [0,1,1,0,0,0|0,0,2]=4 2073 B23R2.28171 OCCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000746330 [0,1,1,0,0,0|0,0,0]=2 2074 B23R2.28171 OCCCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000762737_100009813428 [0,1,1,0,0,0|0,0,0]=2 2075 B23R2.28171 OCCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000746330 [0,1,1,0,0,0|0,0,0]=2 2076 B23R2.28171 OCCCCCNCCC(c1ccccc1)c2ccccc2 34a_100000762737_100009813428 [0,1,1,0,0,0|0,0,0]=2 2077 B23R2.28171 OCCCCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000746330 [0,1,1,0,0,0|1,0,0]=3 2078 B23R2.28171 OCCCCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000746330 [0,1,1,0,0,0|1,0,0]=3 2079 B23R2.28171 OCCCCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000762737_100010140906 [0,1,1,0,0,0|1,0,0]=3 2080 B23R2.28171 OCCCCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000746330 [0,1,1,0,0,0|1,0,0]=3 2081 B23R2.28171 OCCCCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000746330 [0,1,1,0,0,0|1,0,0]=3 2082 B23R2.28171 OCCCCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000746330 [0,1,1,0,0,0|2,0,0]=4 2083 B23R2.28171 OCCCCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000746330 [0,1,1,0,0,0|2,0,0]=4 2084 B23R2.28171 OCCCCCSCCC(c1ccccc1)c2ccccc2 62a_100000746330_100009813428 [0,1,1,0,0,0|1,0,0]=3 2085 B23R2.28171 OCCCCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000746330 [0,1,1,0,0,0|1,0,0]=3 2086 B23R2.28171 OCCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100000746330_100010140906 [0,1,1,0,0,0|2,0,0]=4 2087 B23R2.28171 OCCCCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000746330 [0,1,1,0,0,0|2,0,0]=4 2088 B23R2.28171 OCCCCNCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_100000210776 [0,1,1,0,0,0|2,0,0]=4 2089 B23R2.28171 OCCCCNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100011216708 [0,1,1,0,0,0|2,0,0]=4 2090 B23R2.28171 OCCCCNCCOC(c1ccccc1)c2ccccc2 2230a_100000750430_100000734929 [0,1,1,0,0,0|1,0,0]=3 2091 B23R2.28171 OCCCCNCCOC(c1ccccc1)c2ccccc2 34a_100000750430_100000734929 [0,1,1,0,0,0|1,0,0]=3 2092 B23R2.28171 OCCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000210776_100000734929 [0,1,1,0,0,0|2,0,0]=4 2093 B23R2.28171 OCCCCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000210776 [0,1,1,0,0,0|2,0,0]=4 2094 B23R2.28171 OCCOCCNCCC(c1ccccc1)c2ccccc2 2230a_100000211614_100009813428 [0,1,1,0,0,0|1,0,0]=3 2095 B23R2.28171 OCCOCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011215305 [0,1,1,0,0,0|1,0,0]=3 2096 B23R2.28171 OCCOCCNCCC(c1ccccc1)c2ccccc2 34a_100000211614_100009813428 [0,1,1,0,0,0|1,0,0]=3 2097 B23R2.28171 OCCOCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000692535 [0,1,1,0,0,0|1,0,0]=3 2098 B23R2.28171 OCCOCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100011215305 [0,1,1,0,0,0|2,0,0]=4 2099 B23R2.28171 OCCOCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000692535 [0,1,1,0,0,0|2,0,0]=4 2100 B23R2.28171 OCCOCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000211614_100010140906 [0,1,1,0,0,0|2,0,0]=4 2101 B23R2.28171 OCCOCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000692535 [0,1,1,0,0,0|2,0,0]=4 2102 B23R2.28171 OCCOCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011215305 [0,1,1,0,0,0|2,0,0]=4 2103 B23R2.28171 OCCOCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011215305 [0,1,1,0,0,0|2,0,0]=4 2104 B23R2.28171 OCCOCCSCCC(c1ccccc1)c2ccccc2 62a_100011215305_100009813428 [0,1,1,0,0,0|2,0,0]=4 2105 B23R2.28171 OCCSCCNCCC(c1ccccc1)c2ccccc2 2230a_100011219999_100009813428 [0,1,1,0,0,0|1,0,0]=3 2106 B23R2.28171 OCCSCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100011219999_100010140906 [0,1,1,0,0,0|2,0,0]=4 2107 B23R2.28171 [N-]=[N+]=NCCCNCCC(c1ccccc1)c2ccccc2 2230a_100000744732_100009813428 [0,1,1,0,0,0|2,0,0]=4 2108 B23R2.29366 CC(=CCCNCCC(c1ccccc1)c2ccccc2)C 2230a_100000272388_100011217483 [0,1,1,0,0,0|0,0,2]=4 2109 B23R2.29366 CC(=CCCNCCC(c1ccccc1)c2ccccc2)C 34a_100000272388_100011217483 [0,1,1,0,0,0|0,0,2]=4 2110 B23R2.29366 CC(=O)CCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000685027 [0,1,1,0,0,0|0,0,1]=3 2111 B23R2.29366 CC(=O)CCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000685027 [0,1,1,0,0,0|1,0,1]=4 2112 B23R2.29366 CC(=O)CCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000685027 [0,1,1,0,0,0|1,0,1]=4 2113 B23R2.29366 CC(=O)CCCOCCC(c1ccccc1)c2ccccc2 34a_100000759063_100009813428 [0,1,1,0,0,0|1,0,1]=4 2114 B23R2.29366 CC(=O)CCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011215641 [0,1,1,0,0,0|1,0,1]=4 2115 B23R2.29366 CC(=O)CCCOCCC(c1ccccc1)c2ccccc2 7a_100000759063_100009813428 [0,1,1,0,0,0|1,0,1]=4 2116 B23R2.29366 CC(=O)CCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011215641 [0,1,1,0,0,0|1,0,1]=4 2117 B23R2.29366 CC(=O)CCCSCCC(c1ccccc1)c2ccccc2 62a_100011215641_100009813428 [0,1,1,0,0,0|1,0,1]=4 2118 B23R2.29366 CC(=O)NCCNCCC(c1ccccc1)c2ccccc2 2230a_100000209853_100009813428 [0,1,1,0,0,0|1,0,1]=4 2119 B23R2.29366 CC(=O)NCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000189650 [0,1,1,0,0,0|1,0,1]=4 2120 B23R2.29366 CC(=O)OCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100009814007 [0,1,1,0,0,0|1,0,1]=4 2121 B23R2.29366 CC(C)CCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210682 [0,1,1,0,0,0|2,0,0]=4 2122 B23R2.29366 CC(C)CCCCCNC(c1ccccc1)c2ccccc2 2230a_100011290863_100000211591 [0,1,1,0,0,0|2,0,0]=4 2123 B23R2.29366 CC(C)CCCCCNC(c1ccccc1)c2ccccc2 270004a_100011290863_100000210122 [0,1,1,0,0,0|2,0,0]=4 2124 B23R2.29366 CC(C)CCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210682 [0,1,1,0,0,0|2,0,0]=4 2125 B23R2.29366 CC(C)CCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011216152 [0,1,1,0,0,0|2,0,0]=4 2126 B23R2.29366 CC(C)CCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011216152 [0,1,1,0,0,0|2,0,0]=4 2127 B23R2.29366 CC(C)CCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100011216152 [0,1,1,0,0,0|2,0,0]=4 2128 B23R2.29366 CC(C)CCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100011216152 [0,1,1,0,0,0|2,0,0]=4 2129 B23R2.29366 CC(C)CCCNCC=C(c1ccccc1)c2ccccc2 270004a_200000737386_100000050448 [0,1,1,0,0,0|0,0,2]=4 2130 B23R2.29366 CC(C)CCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011214892 [0,1,1,0,0,0|0,0,0]=2 2131 B23R2.29366 CC(C)CCCNCCC(c1ccccc1)c2ccccc2 2230a_200000737386_100009813428 [0,1,1,0,0,0|0,0,0]=2 2132 B23R2.29366 CC(C)CCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011214892 [0,1,1,0,0,0|0,0,0]=2 2133 B23R2.29366 CC(C)CCCNCCC(c1ccccc1)c2ccccc2 34a_200000737386_100009813428 [0,1,1,0,0,0|0,0,0]=2 2134 B23R2.29366 CC(C)CCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100011214892 [0,1,1,0,0,0|1,0,0]=3 2135 B23R2.29366 CC(C)CCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100011214892 [0,1,1,0,0,0|1,0,0]=3 2136 B23R2.29366 CC(C)CCCNCC[S+](c1ccccc1)c2ccccc2 2230a_200000737386_100010140906 [0,1,1,0,0,0|1,0,0]=3 2137 B23R2.29366 CC(C)CCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011214892 [0,1,1,0,0,0|1,0,0]=3 2138 B23R2.29366 CC(C)CCCOCCC(c1ccccc1)c2ccccc2 34a_100000210774_100009813428 [0,1,1,0,0,0|1,0,0]=3 2139 B23R2.29366 CC(C)CCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011214892 [0,1,1,0,0,0|1,0,0]=3 2140 B23R2.29366 CC(C)CCCOCCC(c1ccccc1)c2ccccc2 7a_100000210774_100009813428 [0,1,1,0,0,0|1,0,0]=3 2141 B23R2.29366 CC(C)CCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100011214892 [0,1,1,0,0,0|2,0,0]=4 2142 B23R2.29366 CC(C)CCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100011214892 [0,1,1,0,0,0|2,0,0]=4 2143 B23R2.29366 CC(C)CCCOCC[S+](c1ccccc1)c2ccccc2 7a_100000210774_100010140906 [0,1,1,0,0,0|2,0,0]=4 2144 B23R2.29366 CC(C)CCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100011214892 [0,1,1,0,0,0|2,0,0]=4 2145 B23R2.29366 CC(C)CCCSCC[S+](c1ccccc1)c2ccccc2 62a_100011214892_100010140906 [0,1,1,0,0,0|2,0,0]=4 2146 B23R2.29366 CC(C)NCCOCCC(c1ccccc1)c2ccccc2 34a_100000224655_100009813428 [0,1,1,0,0,0|2,0,0]=4 2147 B23R2.29366 CC(C)OCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000211751 [0,1,1,0,0,0|1,0,0]=3 2148 B23R2.29366 CC(C)OCCNCCC(c1ccccc1)c2ccccc2 2230a_100000701111_100009813428 [0,1,1,0,0,0|1,0,0]=3 2149 B23R2.29366 CC(C)OCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000211751 [0,1,1,0,0,0|1,0,0]=3 2150 B23R2.29366 CC(C)OCCNCCC(c1ccccc1)c2ccccc2 34a_100000701111_100009813428 [0,1,1,0,0,0|1,0,0]=3 2151 B23R2.29366 CC(C)OCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000211751 [0,1,1,0,0,0|2,0,0]=4 2152 B23R2.29366 CC(C)OCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000211751 [0,1,1,0,0,0|2,0,0]=4 2153 B23R2.29366 CC(C)OCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000701111_100010140906 [0,1,1,0,0,0|2,0,0]=4 2154 B23R2.29366 CC(C)OCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000211751 [0,1,1,0,0,0|2,0,0]=4 2155 B23R2.29366 CC(C)OCCOCCC(c1ccccc1)c2ccccc2 34a_100000211219_100009813428 [0,1,1,0,0,0|2,0,0]=4 2156 B23R2.29366 CC(C)OCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000211751 [0,1,1,0,0,0|2,0,0]=4 2157 B23R2.29366 CC(C)OCCOCCC(c1ccccc1)c2ccccc2 7a_100000211219_100009813428 [0,1,1,0,0,0|2,0,0]=4 2158 B23R2.29366 CC(C)OCCSCCC(c1ccccc1)c2ccccc2 62a_100000211751_100009813428 [0,1,1,0,0,0|2,0,0]=4 2159 B23R2.29366 CC(C)OCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000211751 [0,1,1,0,0,0|2,0,0]=4 2160 B23R2.29366 CC(C)SCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000730970 [0,1,1,0,0,0|1,0,0]=3 2161 B23R2.29366 CC(C)SCCNCCC(c1ccccc1)c2ccccc2 2230a_100000731138_100009813428 [0,1,1,0,0,0|1,0,0]=3 2162 B23R2.29366 CC(C)SCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000730970 [0,1,1,0,0,0|1,0,0]=3 2163 B23R2.29366 CC(C)SCCNCCC(c1ccccc1)c2ccccc2 34a_100000731138_100009813428 [0,1,1,0,0,0|1,0,0]=3 2164 B23R2.29366 CC(C)SCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000730970 [0,1,1,0,0,0|2,0,0]=4 2165 B23R2.29366 CC(C)SCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000730970 [0,1,1,0,0,0|2,0,0]=4 2166 B23R2.29366 CC(C)SCCNCC[S+](c1ccccc1)c2ccccc2 2230a_100000731138_100010140906 [0,1,1,0,0,0|2,0,0]=4 2167 B23R2.29366 CC(C)SCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000730970 [0,1,1,0,0,0|2,0,0]=4 2168 B23R2.29366 CC(C)SCCOCCC(c1ccccc1)c2ccccc2 34a_200011212901_100009813428 [0,1,1,0,0,0|2,0,0]=4 2169 B23R2.29366 CC(C)SCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000730970 [0,1,1,0,0,0|2,0,0]=4 2170 B23R2.29366 CC(C)SCCOCCC(c1ccccc1)c2ccccc2 7a_200011212901_100009813428 [0,1,1,0,0,0|2,0,0]=4 2171 B23R2.29366 CC(O)CCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_200000718107 [0,1,1,0,0,0|0,0,0]=2 2172 B23R2.29366 CC(O)CCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_200000718107 [0,1,1,0,0,0|0,0,0]=2 2173 B23R2.29366 CC(O)CCCNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_200000718107 [0,1,1,0,0,0|1,0,0]=3 2174 B23R2.29366 CC(O)CCCNCCP(c1ccccc1)c2ccccc2 34a_107094377242_200000718107 [0,1,1,0,0,0|1,0,0]=3 2175 B23R2.29366 CC(O)CCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_200000718107 [0,1,1,0,0,0|1,0,0]=3 2176 B23R2.29366 CC(O)CCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_200000718107 [0,1,1,0,0,0|1,0,0]=3 2177 B23R2.29366 CC(O)CCCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_200000718107 [0,1,1,0,0,0|2,0,0]=4 2178 B23R2.29366 CC(O)CCCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_200000718107 [0,1,1,0,0,0|2,0,0]=4 2179 B23R2.29366 CC(O)CCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_200000718107 [0,1,1,0,0,0|1,0,0]=3 2180 B23R2.29366 CC(O)CCCSCCC(c1ccccc1)c2ccccc2 62a_200000718107_100009813428 [0,1,1,0,0,0|1,0,0]=3 2181 B23R2.29366 CC(O)CCCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_200000718107 [0,1,1,0,0,0|2,0,0]=4 2182 B23R2.29366 CC(O)CCCSCC[S+](c1ccccc1)c2ccccc2 62a_200000718107_100010140906 [0,1,1,0,0,0|2,0,0]=4 2183 B23R2.29366 CN(C)CCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000757444 [0,1,1,0,0,0|2,0,0]=4 2184 B23R2.29366 CN(C)CCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000757444 [0,1,1,0,0,0|2,0,0]=4 2185 B23R2.29366 CS(=O)CCCNCCC(c1ccccc1)c2ccccc2 2230a_200000753449_100009813428 [0,1,1,0,0,0|1,0,0]=3 2186 B23R2.29366 CS(=O)CCCNCC[S+](c1ccccc1)c2ccccc2 2230a_200000753449_100010140906 [0,1,1,0,0,0|2,0,0]=4 2187 B23R2.29366 NC(=O)CCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100102525003 [0,1,1,0,0,0|1,0,1]=4 2188 B23R2.29366 NC(=O)CCCNCCC(c1ccccc1)c2ccccc2 34a_100000739312_100009813428 [0,1,1,0,0,0|1,0,1]=4 2189 B23R2.33724 C=CCCC(C)NCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000762624 [0,1,1,0,0,0|0,0,2]=4 2190 B23R2.33724 CC(CCCCl)OCCC(c1ccccc1)c2ccccc2 34a_200000718107_100009813428 [0,1,1,0,0,0|2,0,0]=4 2191 B23R2.33724 CC(CCCCl)OCCC(c1ccccc1)c2ccccc2 7a_200000718107_100009813428 [0,1,1,0,0,0|2,0,0]=4 2192 B23R2.33724 CCCCC(=O)NCCC(c1ccccc1)c2ccccc2 11a_100000272388_100000210183 [0,1,1,0,0,0|0,0,1]=3 2193 B23R2.33724 CCCCC(=O)NCCC(c1ccccc1)c2ccccc2 1626a_100000272388_100000210183 [0,1,1,0,0,0|0,0,1]=3 2194 B23R2.33724 CCCCC(=O)NCCC(c1ccccc1)c2ccccc2 240690a_100000272388_100000210183 [0,1,1,0,0,0|0,0,1]=3 2195 B23R2.33724 CCCCC(=O)NCCC(c1ccccc1)c2ccccc2 527a_100000272388_100000210183 [0,1,1,0,0,0|0,0,1]=3 2196 B23R2.33724 CCCCC(=O)NCCP(c1ccccc1)c2ccccc2 11a_107094377242_100000210183 [0,1,1,0,0,0|1,0,1]=4 2197 B23R2.33724 CCCCC(=O)NCCP(c1ccccc1)c2ccccc2 1626a_107094377242_100000210183 [0,1,1,0,0,0|1,0,1]=4 2198 B23R2.33724 CCCCC(=O)NCCP(c1ccccc1)c2ccccc2 240690a_107094377242_100000210183 [0,1,1,0,0,0|1,0,1]=4 2199 B23R2.33724 CCCCC(=O)NCCP(c1ccccc1)c2ccccc2 527a_107094377242_100000210183 [0,1,1,0,0,0|1,0,1]=4 2200 B23R2.33724 CCCCC(C)NCC=C(c1ccccc1)c2ccccc2 270004a_100000126638_100000050448 [0,1,1,0,0,0|0,0,2]=4 2201 B23R2.33724 CCCCC(C)NCCC(c1ccccc1)c2ccccc2 2230a_100000126638_100009813428 [0,1,1,0,0,0|0,0,0]=2 2202 B23R2.33724 CCCCC(C)NCCC(c1ccccc1)c2ccccc2 2230a_100000272388_200011215066 [0,1,1,0,0,0|0,0,0]=2 2203 B23R2.33724 CCCCC(C)NCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000210087 [0,1,1,0,0,0|0,0,0]=2 2204 B23R2.33724 CCCCC(C)NCCC(c1ccccc1)c2ccccc2 34a_100000272388_200011215066 [0,1,1,0,0,0|0,0,0]=2 2205 B23R2.33724 CCCCC(C)NCCP(c1ccccc1)c2ccccc2 2230a_107094377242_200011215066 [0,1,1,0,0,0|1,0,0]=3 2206 B23R2.33724 CCCCC(C)NCCP(c1ccccc1)c2ccccc2 270004a_107094377242_100000210087 [0,1,1,0,0,0|1,0,0]=3 2207 B23R2.33724 CCCCC(C)NCCP(c1ccccc1)c2ccccc2 34a_107094377242_200011215066 [0,1,1,0,0,0|1,0,0]=3 2208 B23R2.33724 CCCCC(C)NCC[S+](c1ccccc1)c2ccccc2 2230a_100000126638_100010140906 [0,1,1,0,0,0|1,0,0]=3 2209 B23R2.33724 CCCCC(C)OCCC(c1ccccc1)c2ccccc2 34a_100000032380_200011215066 [0,1,1,0,0,0|1,0,0]=3 2210 B23R2.33724 CCCCC(C)OCCC(c1ccccc1)c2ccccc2 34a_100000687866_100009813428 [0,1,1,0,0,0|1,0,0]=3 2211 B23R2.33724 CCCCC(C)OCCC(c1ccccc1)c2ccccc2 7a_100000032380_200011215066 [0,1,1,0,0,0|1,0,0]=3 2212 B23R2.33724 CCCCC(C)OCCC(c1ccccc1)c2ccccc2 7a_100000687866_100009813428 [0,1,1,0,0,0|1,0,0]=3 2213 B23R2.33724 CCCCC(C)OCCN(c1ccccc1)c2ccccc2 34a_100010001939_200011215066 [0,1,1,0,0,0|2,0,0]=4 2214 B23R2.33724 CCCCC(C)OCCN(c1ccccc1)c2ccccc2 7a_100010001939_200011215066 [0,1,1,0,0,0|2,0,0]=4 2215 B23R2.33724 CCCCC(C)OCC[S+](c1ccccc1)c2ccccc2 7a_100000687866_100010140906 [0,1,1,0,0,0|2,0,0]=4 2216 B23R2.33724 CCCNC(=O)NCCC(c1ccccc1)c2ccccc2 2708a_100000272388_100020643023 [0,1,1,0,0,0|1,0,1]=4 2217 B23R2.33724 CCCNC(=O)NCCC(c1ccccc1)c2ccccc2 2708a_100020643023_100000272388 [0,1,1,0,0,0|1,0,1]=4 2218 B23R2.33724 CCCNC(=O)NCCC(c1ccccc1)c2ccccc2 273464a_100000272388_100020643023 [0,1,1,0,0,0|1,0,1]=4 2219 B23R2.33724 CCCNC(=O)NCCC(c1ccccc1)c2ccccc2 273464a_100020643023_100000272388 [0,1,1,0,0,0|1,0,1]=4 2220 B23R2.33724 CCCNC(=O)NCCC(c1ccccc1)c2ccccc2 512a_100020643023_100000272388 [0,1,1,0,0,0|1,0,1]=4 2221 B23R2.33724 CCNCC(=O)NCCC(c1ccccc1)c2ccccc2 2230a_100015525214_100000683963 [0,1,1,0,0,0|1,0,1]=4 2222 B23R2.33724 CCOCC(=O)NCCC(c1ccccc1)c2ccccc2 11a_100000272388_100000211967 [0,1,1,0,0,0|1,0,1]=4 2223 B23R2.33724 CCOCC(=O)NCCC(c1ccccc1)c2ccccc2 1626a_100000272388_100000211967 [0,1,1,0,0,0|1,0,1]=4 2224 B23R2.33724 CCOCC(=O)NCCC(c1ccccc1)c2ccccc2 240690a_100000272388_100000211967 [0,1,1,0,0,0|1,0,1]=4 2225 B23R2.33724 CCOCC(=O)NCCC(c1ccccc1)c2ccccc2 34a_100121572206_100000683963 [0,1,1,0,0,0|1,0,1]=4 2226 B23R2.33724 CCOCC(=O)NCCC(c1ccccc1)c2ccccc2 527a_100000272388_100000211967 [0,1,1,0,0,0|1,0,1]=4 2227 B23R2.33724 CCOCC(C)OCCC(c1ccccc1)c2ccccc2 34a_100000718985_100009813428 [0,1,1,0,0,0|2,0,0]=4 2228 B23R2.33724 CCOCC(C)OCCC(c1ccccc1)c2ccccc2 7a_100000718985_100009813428 [0,1,1,0,0,0|2,0,0]=4 2229 B23R2.33724 CCSCC(=O)NCCC(c1ccccc1)c2ccccc2 11a_100000272388_100000230394 [0,1,1,0,0,0|1,0,1]=4 2230 B23R2.33724 CCSCC(=O)NCCC(c1ccccc1)c2ccccc2 1626a_100000272388_100000230394 [0,1,1,0,0,0|1,0,1]=4 2231 B23R2.33724 CCSCC(=O)NCCC(c1ccccc1)c2ccccc2 240690a_100000272388_100000230394 [0,1,1,0,0,0|1,0,1]=4 2232 B23R2.33724 CCSCC(=O)NCCC(c1ccccc1)c2ccccc2 527a_100000272388_100000230394 [0,1,1,0,0,0|1,0,1]=4 2233 B23R2.33724 CCSCC(=O)NCCC(c1ccccc1)c2ccccc2 62a_100000210202_100000683963 [0,1,1,0,0,0|1,0,1]=4 2234 B23R2.33724 CCSCC(=O)NCCC(c1ccccc1)c2ccccc2 62a_100000683963_100000210202 [0,1,1,0,0,0|1,0,1]=4 2235 B23R2.33724 CCSCC(C)NCCC(c1ccccc1)c2ccccc2 270004a_100000272388_200011216171 [0,1,1,0,0,0|1,0,0]=3 2236 B23R2.33724 CCSCC(C)NCCP(c1ccccc1)c2ccccc2 270004a_107094377242_200011216171 [0,1,1,0,0,0|2,0,0]=4 2237 B23R2.33724 COCCC(=O)NCCC(c1ccccc1)c2ccccc2 11a_100000272388_100000749529 [0,1,1,0,0,0|1,0,1]=4 2238 B23R2.33724 COCCC(=O)NCCC(c1ccccc1)c2ccccc2 1626a_100000272388_100000749529 [0,1,1,0,0,0|1,0,1]=4 2239 B23R2.33724 COCCC(=O)NCCC(c1ccccc1)c2ccccc2 240690a_100000272388_100000749529 [0,1,1,0,0,0|1,0,1]=4 2240 B23R2.33724 COCCC(=O)NCCC(c1ccccc1)c2ccccc2 527a_100000272388_100000749529 [0,1,1,0,0,0|1,0,1]=4 2241 B23R2.33724 COCCC(C)NCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000742357 [0,1,1,0,0,0|1,0,0]=3 2242 B23R2.33724 COCCC(C)NCCP(c1ccccc1)c2ccccc2 270004a_107094377242_100000742357 [0,1,1,0,0,0|2,0,0]=4 2243 B23R2.33724 CSCCC(=O)NCCC(c1ccccc1)c2ccccc2 11a_100000272388_100000174002 [0,1,1,0,0,0|1,0,1]=4 2244 B23R2.33724 CSCCC(=O)NCCC(c1ccccc1)c2ccccc2 1626a_100000272388_100000174002 [0,1,1,0,0,0|1,0,1]=4 2245 B23R2.33724 CSCCC(=O)NCCC(c1ccccc1)c2ccccc2 240690a_100000272388_100000174002 [0,1,1,0,0,0|1,0,1]=4 2246 B23R2.33724 CSCCC(=O)NCCC(c1ccccc1)c2ccccc2 527a_100000272388_100000174002 [0,1,1,0,0,0|1,0,1]=4 2247 B23R2.33724 CSCCC(C)NCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100011217047 [0,1,1,0,0,0|1,0,0]=3 2248 B23R2.33724 CSCCC(C)NCCP(c1ccccc1)c2ccccc2 270004a_107094377242_100011217047 [0,1,1,0,0,0|2,0,0]=4 2249 B23R2.62314 C#CCCCNC(C)CC(c1ccccc1)c2ccccc2 270004a_100000718082_200000011111 [0,1,1,0,0,0|0,0,2]=4 2250 B23R2.62314 C=CCCCNC(C)CC(c1ccccc1)c2ccccc2 270004a_100000700776_200000011111 [0,1,1,0,0,0|0,0,2]=4 2251 B23R2.62314 CC(CC(c1ccccc1)c2ccccc2)NCCCCO 270004a_100000750430_200000011111 [0,1,1,0,0,0|1,0,0]=3 2252 B23R2.62314 CCCCCCC(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_100000210757 [0,1,1,0,0,0|1,0,1]=4 2253 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 2230a_100000162943_100011215978 [0,1,1,0,0,0|2,0,0]=4 2254 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 2230a_100000210919_100000211591 [0,1,1,0,0,0|2,0,0]=4 2255 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000162943_100000210826 [0,1,1,0,0,0|2,0,0]=4 2256 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000210919_100000210122 [0,1,1,0,0,0|2,0,0]=4 2257 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 34a_100000162943_100011215978 [0,1,1,0,0,0|2,0,0]=4 2258 B23R2.62314 CCCCCNC(=O)CC(c1ccccc1)c2ccccc2 11a_100000209983_100000499737 [0,1,1,0,0,0|0,0,1]=3 2259 B23R2.62314 CCCCCNC(=O)CC(c1ccccc1)c2ccccc2 1626a_100000209983_100000499737 [0,1,1,0,0,0|0,0,1]=3 2260 B23R2.62314 CCCCCNC(=O)CC(c1ccccc1)c2ccccc2 240690a_100000209983_100000499737 [0,1,1,0,0,0|0,0,1]=3 2261 B23R2.62314 CCCCCNC(=O)CC(c1ccccc1)c2ccccc2 527a_100000209983_100000499737 [0,1,1,0,0,0|0,0,1]=3 2262 B23R2.62314 CCCCCNC(=O)CP(c1ccccc1)c2ccccc2 11a_100000209983_200020607205 [0,1,1,0,0,0|1,0,1]=4 2263 B23R2.62314 CCCCCNC(=O)CP(c1ccccc1)c2ccccc2 1626a_100000209983_200020607205 [0,1,1,0,0,0|1,0,1]=4 2264 B23R2.62314 CCCCCNC(=O)CP(c1ccccc1)c2ccccc2 240690a_100000209983_200020607205 [0,1,1,0,0,0|1,0,1]=4 2265 B23R2.62314 CCCCCNC(=O)CP(c1ccccc1)c2ccccc2 527a_100000209983_200020607205 [0,1,1,0,0,0|1,0,1]=4 2266 B23R2.62314 CCCCCNC(=O)NC(c1ccccc1)c2ccccc2 2708a_100000209983_100000162943 [0,1,1,0,0,0|1,0,1]=4 2267 B23R2.62314 CCCCCNC(=O)NC(c1ccccc1)c2ccccc2 273464a_100000209983_100000162943 [0,1,1,0,0,0|1,0,1]=4 2268 B23R2.62314 CCCCCNC(=O)NC(c1ccccc1)c2ccccc2 512a_100000209983_100000162943 [0,1,1,0,0,0|1,0,1]=4 2269 B23R2.62314 CCCCCNC(C)CC(c1ccccc1)c2ccccc2 270004a_100000209983_200000011111 [0,1,1,0,0,0|0,0,0]=2 2270 B23R2.62314 CCCCNNC(=O)CC(c1ccccc1)c2ccccc2 22a_100025702795_100000499737 [0,1,1,0,0,0|1,0,1]=4 2271 B23R2.62314 CCOCCNC(=O)CC(c1ccccc1)c2ccccc2 11a_100011200944_100000499737 [0,1,1,0,0,0|1,0,1]=4 2272 B23R2.62314 CCOCCNC(=O)CC(c1ccccc1)c2ccccc2 1626a_102516460346_100000499737 [0,1,1,0,0,0|1,0,1]=4 2273 B23R2.62314 CCOCCNC(=O)CC(c1ccccc1)c2ccccc2 240690a_100011200944_100000499737 [0,1,1,0,0,0|1,0,1]=4 2274 B23R2.62314 CCOCCNC(=O)CC(c1ccccc1)c2ccccc2 527a_100011200944_100000499737 [0,1,1,0,0,0|1,0,1]=4 2275 B23R2.62314 CCOCCNC(C)CC(c1ccccc1)c2ccccc2 270004a_102516460346_200000011111 [0,1,1,0,0,0|1,0,0]=3 2276 B23R2.62314 CCSCCNC(=O)CC(c1ccccc1)c2ccccc2 11a_100000106463_100000499737 [0,1,1,0,0,0|1,0,1]=4 2277 B23R2.62314 CCSCCNC(=O)CC(c1ccccc1)c2ccccc2 1626a_100000106463_100000499737 [0,1,1,0,0,0|1,0,1]=4 2278 B23R2.62314 CCSCCNC(=O)CC(c1ccccc1)c2ccccc2 240690a_100000106463_100000499737 [0,1,1,0,0,0|1,0,1]=4 2279 B23R2.62314 CCSCCNC(=O)CC(c1ccccc1)c2ccccc2 527a_100000106463_100000499737 [0,1,1,0,0,0|1,0,1]=4 2280 B23R2.62314 CCSCCNC(C)CC(c1ccccc1)c2ccccc2 270004a_100000106463_200000011111 [0,1,1,0,0,0|1,0,0]=3 2281 B23R2.62314 COCCCNC(=O)CC(c1ccccc1)c2ccccc2 1626a_100150723488_100000499737 [0,1,1,0,0,0|1,0,1]=4 2282 B23R2.62314 COCCCNC(=O)CC(c1ccccc1)c2ccccc2 240690a_100150723488_100000499737 [0,1,1,0,0,0|1,0,1]=4 2283 B23R2.62314 COCCCNC(=O)CC(c1ccccc1)c2ccccc2 527a_100150723488_100000499737 [0,1,1,0,0,0|1,0,1]=4 2284 B23R2.62314 COCCCNC(C)CC(c1ccccc1)c2ccccc2 270004a_100150723488_200000011111 [0,1,1,0,0,0|1,0,0]=3 2285 B23R2.62314 CSCCCNC(=O)CC(c1ccccc1)c2ccccc2 11a_100000749238_100000499737 [0,1,1,0,0,0|1,0,1]=4 2286 B23R2.62314 CSCCCNC(=O)CC(c1ccccc1)c2ccccc2 1626a_100000749238_100000499737 [0,1,1,0,0,0|1,0,1]=4 2287 B23R2.62314 CSCCCNC(=O)CC(c1ccccc1)c2ccccc2 240690a_100000749238_100000499737 [0,1,1,0,0,0|1,0,1]=4 2288 B23R2.62314 CSCCCNC(=O)CC(c1ccccc1)c2ccccc2 527a_100000749238_100000499737 [0,1,1,0,0,0|1,0,1]=4 2289 B23R2.62314 CSCCCNC(C)CC(c1ccccc1)c2ccccc2 270004a_100000749238_200000011111 [0,1,1,0,0,0|1,0,0]=3 2290 B23R2.62314 O=C(CC(c1ccccc1)c2ccccc2)NCCCCO 240690a_100000750430_100000499737 [0,1,1,0,0,0|1,0,1]=4 2291 B23R2.62314 O=C(CC(c1ccccc1)c2ccccc2)NCCCCO 527a_100000750430_100000499737 [0,1,1,0,0,0|1,0,1]=4 2292 B23R2.63751 CCCCCCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000210614 [0,1,1,0,0,0|1,0,1]=4 2293 B23R2.63751 CCCCCCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000211969_100011216954 [0,1,1,0,0,0|1,0,1]=4 2294 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 2230a_100000228206_100000211591 [0,1,1,0,0,0|2,0,0]=4 2295 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000210681 [0,1,1,0,0,0|2,0,0]=4 2296 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 269982a_100000228206_100000211591 [0,1,1,0,0,0|2,0,0]=4 2297 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000210681 [0,1,1,0,0,0|2,0,0]=4 2298 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 270004a_100000228206_100000210122 [0,1,1,0,0,0|2,0,0]=4 2299 B23R2.63751 CCCCCNCC(=O)N(c1ccccc1)c2ccccc2 2230a_100000209983_200015198546 [0,1,1,0,0,0|1,0,1]=4 2300 B23R2.63751 CCCCCNCC(=O)N(c1ccccc1)c2ccccc2 2230a_100015202596_100000210326 [0,1,1,0,0,0|1,0,1]=4 2301 B23R2.63751 CCCCCNN=C(C)C(c1ccccc1)c2ccccc2 4a_100000694160_100000187087 [0,1,1,0,0,0|1,0,1]=4 2302 B23R2.63751 CCCCCNNC(=O)C(c1ccccc1)c2ccccc2 22a_100000694160_100000210944 [0,1,1,0,0,0|1,0,1]=4 2303 B23R2.151646 CCCCCCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210614 [0,1,1,0,0,0|2,0,0]=4 2304 B23R2.151646 CCCCCCNCC(C)(c1ccccc1)c2ccccc2 2230a_100000706881_100000210314 [0,1,1,0,0,0|2,0,0]=4 2305 B23R2.178741 C#CCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000731252 [0,1,1,0,0,0|0,0,2]=4 2306 B23R2.178741 C#CCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100011215417 [0,1,1,0,0,0|0,0,2]=4 2307 B23R2.178741 C#CCCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000695029 [0,1,1,0,0,0|0,0,2]=4 2308 B23R2.178741 C=CCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100011713584 [0,1,1,0,0,0|0,0,2]=4 2309 B23R2.178741 C=CCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000757094 [0,1,1,0,0,0|0,0,2]=4 2310 B23R2.178741 C=CCCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000757094 [0,1,1,0,0,0|0,0,2]=4 2311 B23R2.178741 CC/C=C\CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100103147603 [0,1,1,0,0,0|0,0,2]=4 2312 B23R2.178741 CC/C=C\CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100103147603 [0,1,1,0,0,0|0,0,2]=4 2313 B23R2.178741 CC/C=C\CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100103147603 [0,1,1,0,0,0|0,0,2]=4 2314 B23R2.178741 CCC#CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100009813939 [0,1,1,0,0,0|0,0,2]=4 2315 B23R2.178741 CCC#CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100009813939 [0,1,1,0,0,0|0,0,2]=4 2316 B23R2.178741 CCCCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000212188_100009813428 [0,1,1,0,0,0|1,0,0]=3 2317 B23R2.178741 CCCCCC(=O)CCP(c1ccccc1)c2ccccc2 1458a_100020644332_100000210326 [0,1,1,0,0,0|2,0,0]=4 2318 B23R2.178741 CCCCCC(=O)CC[S+](c1ccccc1)c2ccccc2 1458a_100000212188_100010140906 [0,1,1,0,0,0|2,0,0]=4 2319 B23R2.178741 CCCCCC(=O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_200012276598 [0,1,1,0,0,0|2,0,0]=4 2320 B23R2.178741 CCCCCC(=O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_200012276598 [0,1,1,0,0,0|2,0,0]=4 2321 B23R2.178741 CCCCCC(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_200012276598 [0,1,1,0,0,0|2,0,0]=4 2322 B23R2.178741 CCCCCC(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_200012276598 [0,1,1,0,0,0|2,0,0]=4 2323 B23R2.178741 CCCCCC(=O)CSC(c1ccccc1)c2ccccc2 1458a_100000683935_100000210326 [0,1,1,0,0,0|2,0,0]=4 2324 B23R2.178741 CCCCCC(=O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_200012276598 [0,1,1,0,0,0|2,0,0]=4 2325 B23R2.178741 CCCCCC(=O)CSC(c1ccccc1)c2ccccc2 62a_200012276598_100011216954 [0,1,1,0,0,0|2,0,0]=4 2326 B23R2.178741 CCCCCC(=O)NCC(c1ccccc1)c2ccccc2 1626a_100000739227_100000212188 [0,1,1,0,0,0|2,0,0]=4 2327 B23R2.178741 CCCCCC(=O)NCC(c1ccccc1)c2ccccc2 240690a_100000739227_100000212188 [0,1,1,0,0,0|2,0,0]=4 2328 B23R2.178741 CCCCCC(=O)NCC(c1ccccc1)c2ccccc2 527a_100000739227_100000212188 [0,1,1,0,0,0|2,0,0]=4 2329 B23R2.178741 CCCCCC(C)NCC(c1ccccc1)c2ccccc2 2230a_100000739227_200011218191 [0,1,1,0,0,0|2,0,0]=4 2330 B23R2.178741 CCCCCC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000211708 [0,1,1,0,0,0|2,0,0]=4 2331 B23R2.178741 CCCCCC(C)NCC(c1ccccc1)c2ccccc2 34a_100000739227_200011218191 [0,1,1,0,0,0|2,0,0]=4 2332 B23R2.178741 CCCCCC(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_200011218191 [0,1,1,0,0,0|2,0,0]=4 2333 B23R2.178741 CCCCCC(C)OCC(c1ccccc1)c2ccccc2 7a_100011215272_200011218191 [0,1,1,0,0,0|2,0,0]=4 2334 B23R2.178741 CCCCCN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100000223495_100000050448 [0,1,1,0,0,0|0,0,2]=4 2335 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000223495_100009813428 [0,1,1,0,0,0|0,0,0]=2 2336 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000210326 [0,1,1,0,0,0|0,0,0]=2 2337 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000223495_100009813428 [0,1,1,0,0,0|0,0,0]=2 2338 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000210215 [0,1,1,0,0,0|0,0,0]=2 2339 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000718602 [0,1,1,0,0,0|0,0,0]=2 2340 B23R2.178741 CCCCCN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100000223495_100010140906 [0,1,1,0,0,0|1,0,0]=3 2341 B23R2.178741 CCCCCN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100000223495_100010140906 [0,1,1,0,0,0|1,0,0]=3 2342 B23R2.178741 CCCOCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000745993_100009813428 [0,1,1,0,0,0|2,0,0]=4 2343 B23R2.178741 CCCSCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000217233_100009813428 [0,1,1,0,0,0|2,0,0]=4 2344 B23R2.178741 CCOCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000749530_100009813428 [0,1,1,0,0,0|2,0,0]=4 2345 B23R2.178741 CCOCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100011215890 [0,1,1,0,0,0|1,0,0]=3 2346 B23R2.178741 CCOCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100011215890 [0,1,1,0,0,0|1,0,0]=3 2347 B23R2.178741 CCOCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000210147 [0,1,1,0,0,0|1,0,0]=3 2348 B23R2.178741 CCSCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000230768_100009813428 [0,1,1,0,0,0|2,0,0]=4 2349 B23R2.178741 CCSCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000757381 [0,1,1,0,0,0|1,0,0]=3 2350 B23R2.178741 CCSCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000757381 [0,1,1,0,0,0|1,0,0]=3 2351 B23R2.178741 CCSCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000757381 [0,1,1,0,0,0|1,0,0]=3 2352 B23R2.178741 CN(CCCC#N)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000687738 [0,1,1,0,0,0|1,0,1]=4 2353 B23R2.178741 CN(CCCC#N)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000687738 [0,1,1,0,0,0|1,0,1]=4 2354 B23R2.178741 CN(CCCC=O)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_200011292268 [0,1,1,0,0,0|1,0,1]=4 2355 B23R2.178741 CN(CCCC=O)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_200011292268 [0,1,1,0,0,0|1,0,1]=4 2356 B23R2.178741 CN(CCCCF)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000729493 [0,1,1,0,0,0|1,0,0]=3 2357 B23R2.178741 CN(CCCCF)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000729493 [0,1,1,0,0,0|1,0,0]=3 2358 B23R2.178741 CN(CCCCF)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000729493 [0,1,1,0,0,0|1,0,0]=3 2359 B23R2.178741 CN(CCCCO)CCC(c1ccccc1)c2ccccc2 2230a_100000717598_100009813428 [0,1,1,0,0,0|1,0,0]=3 2360 B23R2.178741 CN(CCCCO)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000210776 [0,1,1,0,0,0|1,0,0]=3 2361 B23R2.178741 CN(CCCCO)CCC(c1ccccc1)c2ccccc2 269982a_100000717598_100009813428 [0,1,1,0,0,0|1,0,0]=3 2362 B23R2.178741 CN(CCCCO)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000210776 [0,1,1,0,0,0|1,0,0]=3 2363 B23R2.178741 CN(CCCCO)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100011216708 [0,1,1,0,0,0|1,0,0]=3 2364 B23R2.178741 CN(CCCCO)CC[S+](c1ccccc1)c2ccccc2 2230a_100000717598_100010140906 [0,1,1,0,0,0|2,0,0]=4 2365 B23R2.178741 CN(CCCCO)CC[S+](c1ccccc1)c2ccccc2 269982a_100000717598_100010140906 [0,1,1,0,0,0|2,0,0]=4 2366 B23R2.178741 COCCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000741012_100009813428 [0,1,1,0,0,0|2,0,0]=4 2367 B23R2.178741 COCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000224831_100009813428 [0,1,1,0,0,0|1,0,0]=3 2368 B23R2.178741 COCCCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000740836 [0,1,1,0,0,0|1,0,0]=3 2369 B23R2.178741 COCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000224831_100009813428 [0,1,1,0,0,0|1,0,0]=3 2370 B23R2.178741 COCCCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000740836 [0,1,1,0,0,0|1,0,0]=3 2371 B23R2.178741 COCCCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000740836 [0,1,1,0,0,0|1,0,0]=3 2372 B23R2.178741 COCCCN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100000224831_100010140906 [0,1,1,0,0,0|2,0,0]=4 2373 B23R2.178741 COCCCN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100000224831_100010140906 [0,1,1,0,0,0|2,0,0]=4 2374 B23R2.178741 CSCCCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000173376_100009813428 [0,1,1,0,0,0|2,0,0]=4 2375 B23R2.178741 O=C(CCCCO)CCC(c1ccccc1)c2ccccc2 1458a_100000695505_100009813428 [0,1,1,0,0,0|2,0,0]=4 2376 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000210681 [0,1,1,0,0,0|2,0,0]=4 2377 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2C 2230a_100000229938_100000230135 [0,1,1,0,0,0|2,0,0]=4 2378 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2C 270004a_100000229938_100000735561 [0,1,1,0,0,0|2,0,0]=4 2379 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000210614 [0,1,1,0,0,0|2,0,0]=4 2380 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2Cl 270004a_100000229938_100011215288 [0,1,1,0,0,0|2,0,0]=4 2381 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2F 270004a_100000229938_100011217773 [0,1,1,0,0,0|2,0,0]=4 2382 B23R2.485364 CCCCCCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000210614 [0,1,1,0,0,0|2,0,0]=4 2383 B23R2.485364 CCCCCCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000210614 [0,1,1,0,0,0|2,0,0]=4 2384 B23R2.4774 C=CCCN(C)C(C)CC(c1ccccc1)c2ccccc2 270004a_100020639649_200000011111 [0,1,1,0,0,0|0,0,2]=4 2385 B23R2.4774 CC(CC(c1ccccc1)c2ccccc2)N(C)CCC#N 270004a_100000184479_200000011111 [0,1,1,0,0,0|1,0,1]=4 2386 B23R2.4774 CC(CC(c1ccccc1)c2ccccc2)N(C)CCCO 270004a_100000213112_200000011111 [0,1,1,0,0,0|1,0,0]=3 2387 B23R2.4774 CCCCC(C)C(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_200011215066 [0,1,1,0,0,0|1,0,1]=4 2388 B23R2.4774 CCCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 11a_100000207549_100000499737 [0,1,1,0,0,0|0,0,1]=3 2389 B23R2.4774 CCCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 1626a_100000207549_100000499737 [0,1,1,0,0,0|0,0,1]=3 2390 B23R2.4774 CCCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 240690a_100000207549_100000499737 [0,1,1,0,0,0|0,0,1]=3 2391 B23R2.4774 CCCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 527a_100000207549_100000499737 [0,1,1,0,0,0|0,0,1]=3 2392 B23R2.4774 CCCCN(C)C(=O)CP(c1ccccc1)c2ccccc2 11a_100000207549_200020607205 [0,1,1,0,0,0|1,0,1]=4 2393 B23R2.4774 CCCCN(C)C(=O)CP(c1ccccc1)c2ccccc2 1626a_100000207549_200020607205 [0,1,1,0,0,0|1,0,1]=4 2394 B23R2.4774 CCCCN(C)C(=O)CP(c1ccccc1)c2ccccc2 240690a_100000207549_200020607205 [0,1,1,0,0,0|1,0,1]=4 2395 B23R2.4774 CCCCN(C)C(=O)CP(c1ccccc1)c2ccccc2 527a_100000207549_200020607205 [0,1,1,0,0,0|1,0,1]=4 2396 B23R2.4774 CCCCN(C)C(C)CC(c1ccccc1)c2ccccc2 270004a_100000207549_200000011111 [0,1,1,0,0,0|0,0,0]=2 2397 B23R2.4774 CN(CCCO)C(=O)CC(c1ccccc1)c2ccccc2 240690a_100000213112_100000499737 [0,1,1,0,0,0|1,0,1]=4 2398 B23R2.4774 CN(CCCO)C(=O)CC(c1ccccc1)c2ccccc2 527a_100000213112_100000499737 [0,1,1,0,0,0|1,0,1]=4 2399 B23R2.4774 COCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 11a_100000743101_100000499737 [0,1,1,0,0,0|1,0,1]=4 2400 B23R2.4774 COCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 1626a_100000743101_100000499737 [0,1,1,0,0,0|1,0,1]=4 2401 B23R2.4774 COCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 240690a_100000743101_100000499737 [0,1,1,0,0,0|1,0,1]=4 2402 B23R2.4774 COCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 527a_100000743101_100000499737 [0,1,1,0,0,0|1,0,1]=4 2403 B23R2.4774 COCCN(C)C(C)CC(c1ccccc1)c2ccccc2 270004a_100000743101_200000011111 [0,1,1,0,0,0|1,0,0]=3 2404 B23R2.4774 CSCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 11a_100000686725_100000499737 [0,1,1,0,0,0|1,0,1]=4 2405 B23R2.4774 CSCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 1626a_100000686725_100000499737 [0,1,1,0,0,0|1,0,1]=4 2406 B23R2.4774 CSCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 240690a_100000686725_100000499737 [0,1,1,0,0,0|1,0,1]=4 2407 B23R2.4774 CSCCN(C)C(=O)CC(c1ccccc1)c2ccccc2 527a_100000686725_100000499737 [0,1,1,0,0,0|1,0,1]=4 2408 B23R2.4774 CSCCN(C)C(C)CC(c1ccccc1)c2ccccc2 270004a_100000686725_200000011111 [0,1,1,0,0,0|1,0,0]=3 2409 B23R2.78354 CC(CC#N)N(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100009813641 [0,1,1,0,0,0|1,0,1]=4 2410 B23R2.78354 CC(CC#N)N(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100009813641 [0,1,1,0,0,0|1,0,1]=4 2411 B23R2.78354 CC(CCO)N(C)CCC(c1ccccc1)c2ccccc2 2230a_100000731037_100009813428 [0,1,1,0,0,0|1,0,0]=3 2412 B23R2.78354 CC(CCO)N(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100009893172 [0,1,1,0,0,0|1,0,0]=3 2413 B23R2.78354 CC(CCO)N(C)CCC(c1ccccc1)c2ccccc2 269982a_100000731037_100009813428 [0,1,1,0,0,0|1,0,0]=3 2414 B23R2.78354 CC(CCO)N(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100009893172 [0,1,1,0,0,0|1,0,0]=3 2415 B23R2.78354 CC(CCO)N(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100009893172 [0,1,1,0,0,0|1,0,0]=3 2416 B23R2.78354 CC(CCO)N(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100000731037_100010140906 [0,1,1,0,0,0|2,0,0]=4 2417 B23R2.78354 CC(CCO)N(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100000731037_100010140906 [0,1,1,0,0,0|2,0,0]=4 2418 B23R2.78354 CCCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 11a_100025726140_100000211992 [0,1,1,0,0,0|0,0,1]=3 2419 B23R2.78354 CCCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 1626a_100025726140_100000211992 [0,1,1,0,0,0|0,0,1]=3 2420 B23R2.78354 CCCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 240690a_100025726140_100000211992 [0,1,1,0,0,0|0,0,1]=3 2421 B23R2.78354 CCCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 527a_100025726140_100000211992 [0,1,1,0,0,0|0,0,1]=3 2422 B23R2.78354 CCCC(C)C(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000210906_100009813428 [0,1,1,0,0,0|2,0,0]=4 2423 B23R2.78354 CCCC(C)C(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100011216282 [0,1,1,0,0,0|2,0,0]=4 2424 B23R2.78354 CCCC(C)N(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000766640 [0,1,1,0,0,0|0,0,0]=2 2425 B23R2.78354 CCCC(C)N(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000766640 [0,1,1,0,0,0|0,0,0]=2 2426 B23R2.78354 CCCC(C)N(C)CCC(c1ccccc1)c2ccccc2 270004a_100025726140_100000211909 [0,1,1,0,0,0|0,0,0]=2 2427 B23R2.78354 CCCC(C)N(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000766640 [0,1,1,0,0,0|0,0,0]=2 2428 B23R2.78354 CCC[C@H](O)C(=O)CCC(c1ccccc1)c2ccccc2 1458a_100009822183_100009813428 [0,1,1,0,0,0|2,0,0]=4 2429 B23R2.78354 CCNC(=O)N(C)CCC(c1ccccc1)c2ccccc2 2708a_100015525214_100025726140 [0,1,1,0,0,0|1,0,1]=4 2430 B23R2.78354 CCNC(=O)N(C)CCC(c1ccccc1)c2ccccc2 273464a_100015525214_100025726140 [0,1,1,0,0,0|1,0,1]=4 2431 B23R2.78354 CN(CCC(c1ccccc1)c2ccccc2)C(=O)CCO 240690a_100025726140_100011216618 [0,1,1,0,0,0|1,0,1]=4 2432 B23R2.78354 COCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 11a_100025726140_100000210968 [0,1,1,0,0,0|1,0,1]=4 2433 B23R2.78354 COCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 1626a_100025726140_100000210968 [0,1,1,0,0,0|1,0,1]=4 2434 B23R2.78354 COCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 240690a_100025726140_100000210968 [0,1,1,0,0,0|1,0,1]=4 2435 B23R2.78354 COCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 527a_100025726140_100000210968 [0,1,1,0,0,0|1,0,1]=4 2436 B23R2.78354 COCC(C)N(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000765312 [0,1,1,0,0,0|1,0,0]=3 2437 B23R2.78354 COCC(C)N(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000765312 [0,1,1,0,0,0|1,0,0]=3 2438 B23R2.78354 COCC(C)N(C)CCC(c1ccccc1)c2ccccc2 270004a_100025726140_100000749346 [0,1,1,0,0,0|1,0,0]=3 2439 B23R2.78354 COCC(C)N(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000765312 [0,1,1,0,0,0|1,0,0]=3 2440 B23R2.78354 CSCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 11a_100025726140_100000184570 [0,1,1,0,0,0|1,0,1]=4 2441 B23R2.78354 CSCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 1626a_100025726140_100000184570 [0,1,1,0,0,0|1,0,1]=4 2442 B23R2.78354 CSCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 240690a_100025726140_100000184570 [0,1,1,0,0,0|1,0,1]=4 2443 B23R2.78354 CSCC(=O)N(C)CCC(c1ccccc1)c2ccccc2 527a_100025726140_100000184570 [0,1,1,0,0,0|1,0,1]=4 2444 B23R2.78354 CSCC(C)N(C)CCC(c1ccccc1)c2ccccc2 270004a_100025726140_100011216314 [0,1,1,0,0,0|1,0,0]=3 2445 B23R2.176949 CCCCC(C)NCC(C)(c1ccccc1)c2ccccc2 2230a_100000706881_200011215066 [0,1,1,0,0,0|2,0,0]=4 2446 B23R2.176949 CCCCC(C)NCC(C)(c1ccccc1)c2ccccc2 270004a_100000706881_100000210087 [0,1,1,0,0,0|2,0,0]=4 2447 B23R2.472609 C=C(C)CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000730704 [0,1,1,0,0,0|0,0,1]=3 2448 B23R2.472609 C=C(C)CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000730704 [0,1,1,0,0,0|0,0,1]=3 2449 B23R2.472609 C=C(C)CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000730704 [0,1,1,0,0,0|0,0,1]=3 2450 B23R2.472609 CC(=CCN(C)CCC(c1ccccc1)c2ccccc2)C 2230a_100025726140_100000761012 [0,1,1,0,0,0|0,0,2]=4 2451 B23R2.472609 CC(=CCN(C)CCC(c1ccccc1)c2ccccc2)C 269982a_100025726140_100000761012 [0,1,1,0,0,0|0,0,2]=4 2452 B23R2.472609 CC(=CCN(C)CCC(c1ccccc1)c2ccccc2)C 34a_100025726140_100000761012 [0,1,1,0,0,0|0,0,2]=4 2453 B23R2.472609 CC(=O)CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000053229 [0,1,1,0,0,0|0,0,1]=3 2454 B23R2.472609 CC(=O)OCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000076356 [0,1,1,0,0,0|1,0,1]=4 2455 B23R2.472609 CC(=O)OCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100009813279 [0,1,1,0,0,0|1,0,1]=4 2456 B23R2.472609 CC(C)CCC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000181311_100009813428 [0,1,1,0,0,0|2,0,0]=4 2457 B23R2.472609 CC(C)CCC(C)NCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011261404 [0,1,1,0,0,0|2,0,0]=4 2458 B23R2.472609 CC(C)CCC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000210476 [0,1,1,0,0,0|2,0,0]=4 2459 B23R2.472609 CC(C)CCC(C)NCC(c1ccccc1)c2ccccc2 34a_100000739227_100011261404 [0,1,1,0,0,0|2,0,0]=4 2460 B23R2.472609 CC(C)CCC(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_100011261404 [0,1,1,0,0,0|2,0,0]=4 2461 B23R2.472609 CC(C)CCN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100000742789_100000050448 [0,1,1,0,0,0|0,0,2]=4 2462 B23R2.472609 CC(C)CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000742789_100009813428 [0,1,1,0,0,0|0,0,0]=2 2463 B23R2.472609 CC(C)CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000210312 [0,1,1,0,0,0|0,0,0]=2 2464 B23R2.472609 CC(C)CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000742789_100009813428 [0,1,1,0,0,0|0,0,0]=2 2465 B23R2.472609 CC(C)CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000210312 [0,1,1,0,0,0|0,0,0]=2 2466 B23R2.472609 CC(C)CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000210312 [0,1,1,0,0,0|0,0,0]=2 2467 B23R2.472609 CC(C)CCN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100000742789_100010140906 [0,1,1,0,0,0|1,0,0]=3 2468 B23R2.472609 CC(C)CCN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100000742789_100010140906 [0,1,1,0,0,0|1,0,0]=3 2469 B23R2.472609 CC(C)OCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000709892 [0,1,1,0,0,0|1,0,0]=3 2470 B23R2.472609 CC(C)OCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000709892 [0,1,1,0,0,0|1,0,0]=3 2471 B23R2.472609 CC(C)OCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000709892 [0,1,1,0,0,0|1,0,0]=3 2472 B23R2.472609 CC(O)CCN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100012276601 [0,1,1,0,0,0|0,0,0]=2 2473 B23R2.472609 CC(O)CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100012276601 [0,1,1,0,0,0|0,0,0]=2 2474 B23R2.472609 CC(O)CCN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100012276601 [0,1,1,0,0,0|0,0,0]=2 2475 B23R2.472609 CN(C)CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000225618_100009813428 [0,1,1,0,0,0|1,0,0]=3 2476 B23R2.472609 CN(C)CCN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000755713 [0,1,1,0,0,0|1,0,0]=3 2477 B23R2.472609 CN(C)CCN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100000225618_100010140906 [0,1,1,0,0,0|2,0,0]=4 2478 B23R2.472609 CN(CCC(=O)N)CCC(c1ccccc1)c2ccccc2 2230a_100000730477_100009813428 [0,1,1,0,0,0|1,0,1]=4 2479 B23R2.472609 CN(CCC(=O)N)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000744528 [0,1,1,0,0,0|1,0,1]=4 2480 B23R2.472609 CN(CCC(=O)N)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000744528 [0,1,1,0,0,0|1,0,1]=4 2481 B23R2.472609 CN(CCC(=O)N)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000731001 [0,1,1,0,0,0|1,0,1]=4 2482 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000211942 [0,1,1,0,0,0|2,0,0]=4 2483 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 2230a_100000209976_100000211591 [0,1,1,0,0,0|2,0,0]=4 2484 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 269862a_100000162943_100011219736 [0,1,1,0,0,0|2,0,0]=4 2485 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 270004a_100000162943_100011219736 [0,1,1,0,0,0|2,0,0]=4 2486 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 270004a_100000209976_100000210122 [0,1,1,0,0,0|2,0,0]=4 2487 B23R2.509616 CCCCC(CC)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000211942 [0,1,1,0,0,0|2,0,0]=4 2488 B23R2.509616 CCCCC(CC)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000753412 [0,1,1,0,0,0|2,0,0]=4 2489 B23R2.509616 CCCCC(CC)NCC(c1ccccc1)c2ccccc2 34a_100000739227_200011216223 [0,1,1,0,0,0|2,0,0]=4 2490 B23R2.509616 CCCCC(CC)OCC(c1ccccc1)c2ccccc2 34a_100011215272_200011216223 [0,1,1,0,0,0|2,0,0]=4 2491 B23R2.509616 CCCCC(CC)OCC(c1ccccc1)c2ccccc2 7a_100011215272_200011216223 [0,1,1,0,0,0|2,0,0]=4 2492 B23R2.509616 CCCCN(CC)CC=C(c1ccccc1)c2ccccc2 270004a_100000207695_100000050448 [0,1,1,0,0,0|0,0,2]=4 2493 B23R2.509616 CCCCN(CC)CCC(c1ccccc1)c2ccccc2 2230a_100000207695_100009813428 [0,1,1,0,0,0|0,0,0]=2 2494 B23R2.509616 CCCCN(CC)CCC(c1ccccc1)c2ccccc2 269982a_100000207695_100009813428 [0,1,1,0,0,0|0,0,0]=2 2495 B23R2.509616 CCCCN(CC)CC[S+](c1ccccc1)c2ccccc2 2230a_100000207695_100010140906 [0,1,1,0,0,0|1,0,0]=3 2496 B23R2.509616 CCCCN(CC)CC[S+](c1ccccc1)c2ccccc2 269982a_100000207695_100010140906 [0,1,1,0,0,0|1,0,0]=3 2497 B23R2.509616 CCN(CCC#N)CCC(c1ccccc1)c2ccccc2 2230a_100000226048_100009813428 [0,1,1,0,0,0|1,0,1]=4 2498 B23R2.509616 CCN(CCOC)CCC(c1ccccc1)c2ccccc2 2230a_100000731262_100009813428 [0,1,1,0,0,0|1,0,0]=3 2499 B23R2.509616 CCN(CCOC)CCC(c1ccccc1)c2ccccc2 269982a_100000731262_100009813428 [0,1,1,0,0,0|1,0,0]=3 2500 B23R2.509616 CCN(CCOC)CC[S+](c1ccccc1)c2ccccc2 2230a_100000731262_100010140906 [0,1,1,0,0,0|2,0,0]=4 2501 B23R2.509616 CCN(CCOC)CC[S+](c1ccccc1)c2ccccc2 269982a_100000731262_100010140906 [0,1,1,0,0,0|2,0,0]=4 2502 B23R2.763176 C=CC(O)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000730141 [0,1,1,0,0,0|0,0,2]=4 2503 B23R2.763176 C=CC(O)CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000730141 [0,1,1,0,0,0|0,0,2]=4 2504 B23R2.763176 CCC(=O)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000747405 [0,1,1,0,0,0|0,0,1]=3 2505 B23R2.763176 CCC(C)CC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000708755_100009813428 [0,1,1,0,0,0|2,0,0]=4 2506 B23R2.763176 CCC(C)CC(C)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100011710205 [0,1,1,0,0,0|2,0,0]=4 2507 B23R2.763176 CCC(C)CN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100000753921_100000050448 [0,1,1,0,0,0|0,0,2]=4 2508 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000753921_100009813428 [0,1,1,0,0,0|0,0,0]=2 2509 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000748023 [0,1,1,0,0,0|0,0,0]=2 2510 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000753921_100009813428 [0,1,1,0,0,0|0,0,0]=2 2511 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000748023 [0,1,1,0,0,0|0,0,0]=2 2512 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 270004a_100025726140_100000243153 [0,1,1,0,0,0|0,0,0]=2 2513 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000748023 [0,1,1,0,0,0|0,0,0]=2 2514 B23R2.763176 CCC(C)CN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100000753921_100010140906 [0,1,1,0,0,0|1,0,0]=3 2515 B23R2.763176 CCC(C)CN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100000753921_100010140906 [0,1,1,0,0,0|1,0,0]=3 2516 B23R2.763176 CCC(O)CC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100011667805_100009813428 [0,1,1,0,0,0|2,0,0]=4 2517 B23R2.763176 CCC(O)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100011218378 [0,1,1,0,0,0|0,0,0]=2 2518 B23R2.763176 CCC(O)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100011218378 [0,1,1,0,0,0|0,0,0]=2 2519 B23R2.763176 CCC(O)CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100011218378 [0,1,1,0,0,0|0,0,0]=2 2520 B23R2.763176 CC[C@H](C)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100009816398 [0,1,1,0,0,0|0,0,0]=2 2521 B23R2.763176 CC[C@H](C)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100009816398 [0,1,1,0,0,0|0,0,0]=2 2522 B23R2.763176 CC[C@H](C)CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100009816398 [0,1,1,0,0,0|0,0,0]=2 2523 B23R2.763176 CN(CCC(c1ccccc1)c2ccccc2)CC(O)CO 2230a_100011216503_100009813428 [0,1,1,0,0,0|1,0,0]=3 2524 B23R2.763176 CN(CCC(c1ccccc1)c2ccccc2)CC(O)CO 2230a_100025726140_100011219619 [0,1,1,0,0,0|1,0,0]=3 2525 B23R2.763176 CN(CCC(c1ccccc1)c2ccccc2)CC(O)CO 269982a_100011216503_100009813428 [0,1,1,0,0,0|1,0,0]=3 2526 B23R2.763176 CN(CCC(c1ccccc1)c2ccccc2)CC(O)CO 34a_100025726140_100011219619 [0,1,1,0,0,0|1,0,0]=3 2527 B23R2.763176 CN(CCC(c1ccccc1)c2ccccc2)C[C@@H](O)CF 2230a_100025726140_100015614560 [0,1,1,0,0,0|1,0,0]=3 2528 B23R2.763176 CN(CCC(c1ccccc1)c2ccccc2)C[C@@H](O)CF 34a_100025726140_100015614560 [0,1,1,0,0,0|1,0,0]=3 2529 B23R2.763176 CN(CCC(c1ccccc1)c2ccccc2)C[C@@H](O)CO 2230a_100025726140_100009815848 [0,1,1,0,0,0|1,0,0]=3 2530 B23R2.763176 CN(CCC(c1ccccc1)c2ccccc2)C[C@@H](O)CO 34a_100025726140_100009815848 [0,1,1,0,0,0|1,0,0]=3 2531 B23R2.763176 CN(CC[S+](c1ccccc1)c2ccccc2)CC(O)CO 2230a_100011216503_100010140906 [0,1,1,0,0,0|2,0,0]=4 2532 B23R2.763176 CN(CC[S+](c1ccccc1)c2ccccc2)CC(O)CO 269982a_100011216503_100010140906 [0,1,1,0,0,0|2,0,0]=4 2533 B23R2.763176 CNC(=O)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000189611_100009813428 [0,1,1,0,0,0|1,0,1]=4 2534 B23R2.763176 CNC(=O)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000183359 [0,1,1,0,0,0|1,0,1]=4 2535 B23R2.763176 CNC(=O)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000183359 [0,1,1,0,0,0|1,0,1]=4 2536 B23R2.763176 CNC(=O)CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000183359 [0,1,1,0,0,0|1,0,1]=4 2537 B23R2.763176 COC(=O)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000198492_100009813428 [0,1,1,0,0,0|1,0,1]=4 2538 B23R2.763176 COC(=O)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000747449 [0,1,1,0,0,0|1,0,1]=4 2539 B23R2.763176 COC(=O)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000747449 [0,1,1,0,0,0|1,0,1]=4 2540 B23R2.763176 COC(=O)CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000747449 [0,1,1,0,0,0|1,0,1]=4 2541 B23R2.763176 C[C@@H](CO)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000059175 [0,1,1,0,0,0|1,0,0]=3 2542 B23R2.763176 C[C@@H](CO)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000059175 [0,1,1,0,0,0|1,0,0]=3 2543 B23R2.763176 C[C@@H](CO)CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000059175 [0,1,1,0,0,0|1,0,0]=3 2544 B23R2.973169 CCCCN(C)CC(=O)N(c1ccccc1)c2ccccc2 2230a_100000207549_200015198546 [0,1,1,0,0,0|1,0,1]=4 2545 B23R2.973169 CCCCN(C)CC(=O)N(c1ccccc1)c2ccccc2 269982a_100000207549_200015198546 [0,1,1,0,0,0|1,0,1]=4 2546 B23R2.5238162 CCCCC(C)COC(c1ccccc1)c2ccccc2C 7a_100011995851_100000230135 [0,1,1,0,0,0|2,0,0]=4 2547 B23R2.12579442 CCCC[Si](C)(C)COC(c1ccccc1)c2ccccc2 7a_100000211180_200000073895 [0,1,1,0,0,0|2,0,0]=4 2548 B23R2.35471 C#CCN(CC)C(C)CC(c1ccccc1)c2ccccc2 270004a_100000744766_200000011111 [0,1,1,0,0,0|0,0,2]=4 2549 B23R2.35471 CCCC(CC)C(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_100011219200 [0,1,1,0,0,0|1,0,1]=4 2550 B23R2.35471 CCCN(CC)C(=O)CC(c1ccccc1)c2ccccc2 11a_100000226822_100000499737 [0,1,1,0,0,0|0,0,1]=3 2551 B23R2.35471 CCCN(CC)C(=O)CC(c1ccccc1)c2ccccc2 1626a_100000226822_100000499737 [0,1,1,0,0,0|0,0,1]=3 2552 B23R2.35471 CCCN(CC)C(=O)CC(c1ccccc1)c2ccccc2 240690a_100000226822_100000499737 [0,1,1,0,0,0|0,0,1]=3 2553 B23R2.35471 CCCN(CC)C(=O)CC(c1ccccc1)c2ccccc2 527a_100000226822_100000499737 [0,1,1,0,0,0|0,0,1]=3 2554 B23R2.35471 CCCN(CC)C(=O)CP(c1ccccc1)c2ccccc2 11a_100000226822_200020607205 [0,1,1,0,0,0|1,0,1]=4 2555 B23R2.35471 CCCN(CC)C(=O)CP(c1ccccc1)c2ccccc2 1626a_100000226822_200020607205 [0,1,1,0,0,0|1,0,1]=4 2556 B23R2.35471 CCCN(CC)C(=O)CP(c1ccccc1)c2ccccc2 240690a_100000226822_200020607205 [0,1,1,0,0,0|1,0,1]=4 2557 B23R2.35471 CCCN(CC)C(=O)CP(c1ccccc1)c2ccccc2 527a_100000226822_200020607205 [0,1,1,0,0,0|1,0,1]=4 2558 B23R2.35471 CCCN(CC)C(C)CC(c1ccccc1)c2ccccc2 270004a_100000226822_200000011111 [0,1,1,0,0,0|0,0,0]=2 2559 B23R2.35471 CCN(CCO)C(=O)CC(c1ccccc1)c2ccccc2 240690a_100000210973_100000499737 [0,1,1,0,0,0|1,0,1]=4 2560 B23R2.35471 CCN(CCO)C(=O)CC(c1ccccc1)c2ccccc2 527a_100000210973_100000499737 [0,1,1,0,0,0|1,0,1]=4 2561 B23R2.35471 CCN(CCO)C(C)CC(c1ccccc1)c2ccccc2 270004a_100000210973_200000011111 [0,1,1,0,0,0|1,0,0]=3 2562 B23R2.63573 C=C(C)CN(CC)CCC(c1ccccc1)c2ccccc2 2230a_100000211296_100009813428 [0,1,1,0,0,0|0,0,1]=3 2563 B23R2.63573 C=C(C)CN(CC)CCC(c1ccccc1)c2ccccc2 269982a_100000211296_100009813428 [0,1,1,0,0,0|0,0,1]=3 2564 B23R2.63573 C=C(C)CN(CC)CC[S+](c1ccccc1)c2ccccc2 2230a_100000211296_100010140906 [0,1,1,0,0,0|1,0,1]=4 2565 B23R2.63573 C=C(C)CN(CC)CC[S+](c1ccccc1)c2ccccc2 269982a_100000211296_100010140906 [0,1,1,0,0,0|1,0,1]=4 2566 B23R2.63573 CCC(COC(c1ccccc1)c2ccccc2)CC(C)C 7a_100012186708_100011216954 [0,1,1,0,0,0|2,0,0]=4 2567 B23R2.63573 CCN(CC=C(c1ccccc1)c2ccccc2)CC(C)C 270004a_100000738554_100000050448 [0,1,1,0,0,0|0,0,2]=4 2568 B23R2.63573 CCN(CC=C(c1ccccc1)c2ccccc2)C[C@H](C)O 270004a_100000729506_100000050448 [0,1,1,0,0,0|0,0,2]=4 2569 B23R2.63573 CCN(CCC(c1ccccc1)c2ccccc2)CC(=O)N 2230a_200020644421_100000210202 [0,1,1,0,0,0|1,0,1]=4 2570 B23R2.63573 CCN(CCC(c1ccccc1)c2ccccc2)CC(=O)N 269982a_200020644421_100000204670 [0,1,1,0,0,0|1,0,1]=4 2571 B23R2.63573 CCN(CCC(c1ccccc1)c2ccccc2)CC(=O)O 269956a_100000746405_100009813428 [0,1,1,0,0,0|1,0,1]=4 2572 B23R2.63573 CCN(CCC(c1ccccc1)c2ccccc2)CC(C)C 2230a_100000738554_100009813428 [0,1,1,0,0,0|0,0,0]=2 2573 B23R2.63573 CCN(CCC(c1ccccc1)c2ccccc2)CC(C)C 269982a_100000738554_100009813428 [0,1,1,0,0,0|0,0,0]=2 2574 B23R2.63573 CCN(CCC(c1ccccc1)c2ccccc2)C[C@H](C)O 2230a_100000729506_100009813428 [0,1,1,0,0,0|0,0,0]=2 2575 B23R2.63573 CCN(CCC(c1ccccc1)c2ccccc2)C[C@H](C)O 269982a_100000729506_100009813428 [0,1,1,0,0,0|0,0,0]=2 2576 B23R2.63573 CCN(CC[S+](c1ccccc1)c2ccccc2)CC(C)C 2230a_100000738554_100010140906 [0,1,1,0,0,0|1,0,0]=3 2577 B23R2.63573 CCN(CC[S+](c1ccccc1)c2ccccc2)CC(C)C 269982a_100000738554_100010140906 [0,1,1,0,0,0|1,0,0]=3 2578 B23R2.63573 CCN(CC[S+](c1ccccc1)c2ccccc2)C[C@H](C)O 2230a_100000729506_100010140906 [0,1,1,0,0,0|1,0,0]=3 2579 B23R2.63573 CCN(CC[S+](c1ccccc1)c2ccccc2)C[C@H](C)O 269982a_100000729506_100010140906 [0,1,1,0,0,0|1,0,0]=3 2580 B23R2.222941 CCCN(CC)CC(=O)N(c1ccccc1)c2ccccc2 2230a_100000226822_200015198546 [0,1,1,0,0,0|1,0,1]=4 2581 B23R2.222941 CCCN(CC)CC(=O)N(c1ccccc1)c2ccccc2 269982a_100000226822_200015198546 [0,1,1,0,0,0|1,0,1]=4 2582 B23R2.485288 C=CCN(CCC(c1ccccc1)c2ccccc2)C(C)C 2230a_100000742772_100009813428 [0,1,1,0,0,0|0,0,2]=4 2583 B23R2.485288 C=CCN(CCC(c1ccccc1)c2ccccc2)C(C)C 269982a_100000742772_100009813428 [0,1,1,0,0,0|0,0,2]=4 2584 B23R2.485288 CC(C)N(CCO)CCC(c1ccccc1)c2ccccc2 2230a_100000224655_100009813428 [0,1,1,0,0,0|1,0,0]=3 2585 B23R2.485288 CC(C)N(CCO)CCC(c1ccccc1)c2ccccc2 269982a_100000224655_100009813428 [0,1,1,0,0,0|1,0,0]=3 2586 B23R2.485288 CC(C)N(CCO)CC[S+](c1ccccc1)c2ccccc2 2230a_100000224655_100010140906 [0,1,1,0,0,0|2,0,0]=4 2587 B23R2.485288 CC(C)N(CCO)CC[S+](c1ccccc1)c2ccccc2 269982a_100000224655_100010140906 [0,1,1,0,0,0|2,0,0]=4 2588 B23R2.485288 CCCN(CC=C(c1ccccc1)c2ccccc2)C(C)C 270004a_106256033942_100000050448 [0,1,1,0,0,0|0,0,2]=4 2589 B23R2.485288 CCCN(CCC(c1ccccc1)c2ccccc2)C(C)C 2230a_106256033942_100009813428 [0,1,1,0,0,0|0,0,0]=2 2590 B23R2.485288 CCCN(CCC(c1ccccc1)c2ccccc2)C(C)C 269982a_106256033942_100009813428 [0,1,1,0,0,0|0,0,0]=2 2591 B23R2.485288 CCCN(CC[S+](c1ccccc1)c2ccccc2)C(C)C 2230a_106256033942_100010140906 [0,1,1,0,0,0|1,0,0]=3 2592 B23R2.485288 CCCN(CC[S+](c1ccccc1)c2ccccc2)C(C)C 269982a_106256033942_100010140906 [0,1,1,0,0,0|1,0,0]=3 2593 B23R2.529032 CCCC(CCC)NCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000210088 [0,1,1,0,0,0|2,0,0]=4 2594 B23R2.529032 CCCC(CCC)NCC(c1ccccc1)c2ccccc2 34a_100000739227_200011218217 [0,1,1,0,0,0|2,0,0]=4 2595 B23R2.529032 CCCC(CCC)OCC(c1ccccc1)c2ccccc2 34a_100011215272_200011218217 [0,1,1,0,0,0|2,0,0]=4 2596 B23R2.529032 CCCC(CCC)OCC(c1ccccc1)c2ccccc2 7a_100011215272_200011218217 [0,1,1,0,0,0|2,0,0]=4 2597 B23R2.529032 CCCN(CC=C(c1ccccc1)c2ccccc2)CCC 270004a_100000210455_100000050448 [0,1,1,0,0,0|0,0,2]=4 2598 B23R2.529032 CCCN(CC=C(c1ccccc1)c2ccccc2)CCO 270004a_100000211420_100000050448 [0,1,1,0,0,0|0,0,2]=4 2599 B23R2.529032 CCCN(CCC)CCC(c1ccccc1)c2ccccc2 2230a_100000210455_100009813428 [0,1,1,0,0,0|0,0,0]=2 2600 B23R2.529032 CCCN(CCC)CCC(c1ccccc1)c2ccccc2 269982a_100000210455_100009813428 [0,1,1,0,0,0|0,0,0]=2 2601 B23R2.529032 CCCN(CCC)CC[S+](c1ccccc1)c2ccccc2 2230a_100000210455_100010140906 [0,1,1,0,0,0|1,0,0]=3 2602 B23R2.529032 CCCN(CCC)CC[S+](c1ccccc1)c2ccccc2 269982a_100000210455_100010140906 [0,1,1,0,0,0|1,0,0]=3 2603 B23R2.529032 CCCN(CCO)CCC(c1ccccc1)c2ccccc2 2230a_100000211420_100009813428 [0,1,1,0,0,0|0,0,0]=2 2604 B23R2.529032 CCCN(CCO)CCC(c1ccccc1)c2ccccc2 269982a_100000211420_100009813428 [0,1,1,0,0,0|0,0,0]=2 2605 B23R2.529032 CCCN(CCO)CC[S+](c1ccccc1)c2ccccc2 2230a_100000211420_100010140906 [0,1,1,0,0,0|1,0,0]=3 2606 B23R2.529032 CCCN(CCO)CC[S+](c1ccccc1)c2ccccc2 269982a_100000211420_100010140906 [0,1,1,0,0,0|1,0,0]=3 2607 B23R2.529032 OCCN(CCO)CCC(c1ccccc1)c2ccccc2 2230a_100000210587_100009813428 [0,1,1,0,0,0|1,0,0]=3 2608 B23R2.529032 OCCN(CCO)CCC(c1ccccc1)c2ccccc2 269982a_100000210587_100009813428 [0,1,1,0,0,0|1,0,0]=3 2609 B23R2.529032 OCCN(CCO)CC[S+](c1ccccc1)c2ccccc2 2230a_100000210587_100010140906 [0,1,1,0,0,0|2,0,0]=4 2610 B23R2.529032 OCCN(CCO)CC[S+](c1ccccc1)c2ccccc2 269982a_100000210587_100010140906 [0,1,1,0,0,0|2,0,0]=4 2611 B23R2.1002389 CCCC(CC)NCC(C)(c1ccccc1)c2ccccc2 270004a_100000706881_100000687865 [0,1,1,0,0,0|2,0,0]=4 2612 B23R2.1040931 CCC(C)N(CC)CC=C(c1ccccc1)c2ccccc2 270004a_100000732650_100000050448 [0,1,1,0,0,0|0,0,2]=4 2613 B23R2.1040931 CCC(C)N(CC)CCC(c1ccccc1)c2ccccc2 2230a_100000732650_100009813428 [0,1,1,0,0,0|0,0,0]=2 2614 B23R2.1040931 CCC(C)N(CC)CCC(c1ccccc1)c2ccccc2 269982a_100000732650_100009813428 [0,1,1,0,0,0|0,0,0]=2 2615 B23R2.1040931 CCC(C)N(CC)CC[S+](c1ccccc1)c2ccccc2 2230a_100000732650_100010140906 [0,1,1,0,0,0|1,0,0]=3 2616 B23R2.1040931 CCC(C)N(CC)CC[S+](c1ccccc1)c2ccccc2 269982a_100000732650_100010140906 [0,1,1,0,0,0|1,0,0]=3 2617 B23R2.1040931 CCN(CCC(c1ccccc1)c2ccccc2)C(C)CO 2230a_100000731049_100009813428 [0,1,1,0,0,0|1,0,0]=3 2618 B23R2.1040931 CCN(CCC(c1ccccc1)c2ccccc2)C(C)CO 269982a_100000731049_100009813428 [0,1,1,0,0,0|1,0,0]=3 2619 B23R2.1040931 CCN(CC[S+](c1ccccc1)c2ccccc2)C(C)CO 2230a_100000731049_100010140906 [0,1,1,0,0,0|2,0,0]=4 2620 B23R2.1040931 CCN(CC[S+](c1ccccc1)c2ccccc2)C(C)CO 269982a_100000731049_100010140906 [0,1,1,0,0,0|2,0,0]=4 2621 B23R2.9395971 CCCC(C)(CC)OCC(c1ccccc1)c2ccccc2 7a_100011215272_200000040151 [0,1,1,0,0,0|2,0,0]=4 2622 B23R3.15516 CC1CCC(CC1)NC(c2ccccc2)c3ccccc3 270004a_100000162943_100000185489 [0,1,0,0,1,0|2,0,0]=4 2623 B23R3.15516 CC1CCC(CC1)NC(c2ccccc2)c3ccccc3 34a_100000162943_200011216234 [0,1,0,0,1,0|2,0,0]=4 2624 B23R3.15516 CC1CCC(CC1)OC(c2ccccc2)c3ccccc3 34a_100000211180_200011216234 [0,1,0,0,1,0|2,0,0]=4 2625 B23R3.15516 CC1CCC(CC1)OC(c2ccccc2)c3ccccc3 7a_100000210714_100011216954 [0,1,0,0,1,0|2,0,0]=4 2626 B23R3.15516 C[C@H]1CC[C@@H](CC1)NC(c2ccccc2)c3ccccc3 2230a_100020625639_100000211591 [0,1,0,0,1,0|2,0,0]=4 2627 B23R3.15516 C[C@H]1CC[C@@H](CC1)NC(c2ccccc2)c3ccccc3 270004a_100020625639_100000210122 [0,1,0,0,1,0|2,0,0]=4 2628 B23R3.15516 OC1CCC(CC1)NC(c2ccccc2)c3ccccc3 270004a_100000162943_100000764474 [0,1,0,0,1,0|2,0,0]=4 2629 B23R3.15516 O[C@H]1CC[C@H](CC1)NC(c2ccccc2)c3ccccc3 270004a_100020628982_100000210122 [0,1,0,0,1,0|2,0,0]=4 2630 B23R3.16362 Brc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100011267660 [0,1,0,0,1,0|2,0,0]=4 2631 B23R3.16362 Brc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100011212009_100000210434 [0,1,0,0,1,0|2,0,0]=4 2632 B23R3.16362 Brc1cccc(c1)C(NC2CCCCC2)c3ccccc3 34a_100011212009_100000210327 [0,1,0,0,1,0|2,0,0]=4 2633 B23R3.16362 Cc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100011217825 [0,1,0,0,1,0|2,0,0]=4 2634 B23R3.16362 Clc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100011215489 [0,1,0,0,1,0|2,0,0]=4 2635 B23R3.16362 Clc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100000741085_100000210434 [0,1,0,0,1,0|2,0,0]=4 2636 B23R3.16362 Clc1cccc(c1)C(NC2CCCCC2)c3ccccc3 34a_100000741085_100000210327 [0,1,0,0,1,0|2,0,0]=4 2637 B23R3.16362 Clc1cccc(c1)C(OC2CCCCC2)c3ccccc3 34a_100000733576_100000210327 [0,1,0,0,1,0|2,0,0]=4 2638 B23R3.16362 Clc1cccc(c1)C(OC2CCCCC2)c3ccccc3 7a_100000733576_100000210327 [0,1,0,0,1,0|2,0,0]=4 2639 B23R3.16362 Fc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_200011219850 [0,1,0,0,1,0|2,0,0]=4 2640 B23R3.16362 Fc1cccc(c1)C(NC2CCCCC2)c3ccccc3 270004a_100000686443_100000210434 [0,1,0,0,1,0|2,0,0]=4 2641 B23R3.16362 Fc1cccc(c1)C(NC2CCCCC2)c3ccccc3 34a_100000686443_100000210327 [0,1,0,0,1,0|2,0,0]=4 2642 B23R3.16362 Fc1cccc(c1)C(OC2CCCCC2)c3ccccc3 34a_100000749007_100000210327 [0,1,0,0,1,0|2,0,0]=4 2643 B23R3.16362 Fc1cccc(c1)C(OC2CCCCC2)c3ccccc3 7a_100000749007_100000210327 [0,1,0,0,1,0|2,0,0]=4 2644 B23R3.16468 CC1CCCC(C1)NC(c2ccccc2)c3ccccc3 2230a_100011194320_100000211591 [0,1,0,0,1,0|2,0,0]=4 2645 B23R3.16468 CC1CCCC(C1)NC(c2ccccc2)c3ccccc3 270004a_100000162943_100000183594 [0,1,0,0,1,0|2,0,0]=4 2646 B23R3.16468 CC1CCCC(C1)NC(c2ccccc2)c3ccccc3 270004a_100011194320_100000210122 [0,1,0,0,1,0|2,0,0]=4 2647 B23R3.16468 OC1CCCC(C1)NC(c2ccccc2)c3ccccc3 2230a_100015190357_100000211591 [0,1,0,0,1,0|2,0,0]=4 2648 B23R3.16468 OC1CCCC(C1)NC(c2ccccc2)c3ccccc3 270004a_100000162943_100012613340 [0,1,0,0,1,0|2,0,0]=4 2649 B23R3.16468 OC1CCCC(C1)NC(c2ccccc2)c3ccccc3 270004a_100015190357_100000210122 [0,1,0,0,1,0|2,0,0]=4 2650 B23R3.26514 CC1CCCCC1NC(c2ccccc2)c3ccccc3 2230a_100000211402_100000211591 [0,1,0,0,1,0|2,0,0]=4 2651 B23R3.26514 CC1CCCCC1NC(c2ccccc2)c3ccccc3 269862a_100000162943_100000210921 [0,1,0,0,1,0|2,0,0]=4 2652 B23R3.26514 CC1CCCCC1NC(c2ccccc2)c3ccccc3 270004a_100000162943_100000210921 [0,1,0,0,1,0|2,0,0]=4 2653 B23R3.26514 CC1CCCCC1NC(c2ccccc2)c3ccccc3 270004a_100000211402_100000210122 [0,1,0,0,1,0|2,0,0]=4 2654 B23R3.26514 CC1CCCCC1OC(c2ccccc2)c3ccccc3 7a_100000211207_100011216954 [0,1,0,0,1,0|2,0,0]=4 2655 B23R3.26514 ClC1CCCCC1OC(c2ccccc2)c3ccccc3 7a_100000038908_100011216954 [0,1,0,0,1,0|2,0,0]=4 2656 B23R3.26514 FC1CCCCC1NC(c2ccccc2)c3ccccc3 34a_100000162943_100015423560 [0,1,0,0,1,0|2,0,0]=4 2657 B23R3.26514 FC1CCCCC1OC(c2ccccc2)c3ccccc3 34a_100000211180_100015423560 [0,1,0,0,1,0|2,0,0]=4 2658 B23R3.26514 FC1CCCCC1SC(c2ccccc2)c3ccccc3 62a_100000211591_100015423560 [0,1,0,0,1,0|2,0,0]=4 2659 B23R3.26514 FC1CCCCC1SC(c2ccccc2)c3ccccc3 62a_100015423560_100011216954 [0,1,0,0,1,0|2,0,0]=4 2660 B23R3.26514 F[C@@H]1CCCC[C@H]1NC(c2ccccc2)c3ccccc3 2230a_100015195156_100000211591 [0,1,0,0,1,0|2,0,0]=4 2661 B23R3.26514 F[C@@H]1CCCC[C@H]1NC(c2ccccc2)c3ccccc3 270004a_100015195156_100000210122 [0,1,0,0,1,0|2,0,0]=4 2662 B23R3.26514 F[C@@H]1CCCC[C@H]1OC(c2ccccc2)c3ccccc3 7a_100009816020_100011216954 [0,1,0,0,1,0|2,0,0]=4 2663 B23R3.26514 OC1CCCCC1NC(c2ccccc2)c3ccccc3 34a_100000162943_100000038908 [0,1,0,0,1,0|2,0,0]=4 2664 B23R3.26514 OC1CCCCC1OC(c2ccccc2)c3ccccc3 34a_100000211180_100000038908 [0,1,0,0,1,0|2,0,0]=4 2665 B23R3.26514 OC1CCCCC1SC(c2ccccc2)c3ccccc3 62a_100000038908_100011216954 [0,1,0,0,1,0|2,0,0]=4 2666 B23R3.26514 OC1CCCCC1SC(c2ccccc2)c3ccccc3 62a_100000211591_100000038908 [0,1,0,0,1,0|2,0,0]=4 2667 B23R3.26514 O[C@H]1CCCC[C@H]1NC(c2ccccc2)c3ccccc3 270004a_100015191688_100000210122 [0,1,0,0,1,0|2,0,0]=4 2668 B23R3.38539 Brc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000198044 [0,1,0,0,1,0|2,0,0]=4 2669 B23R3.38539 Brc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100011211563_100000210434 [0,1,0,0,1,0|2,0,0]=4 2670 B23R3.38539 Brc1ccccc1C(NC2CCCCC2)c3ccccc3 34a_100011211563_100000210327 [0,1,0,0,1,0|2,0,0]=4 2671 B23R3.38539 Cc1ccccc1C(NC2CCCCC2)c3ccccc3 2230a_100000182618_100000230135 [0,1,0,0,1,0|2,0,0]=4 2672 B23R3.38539 Cc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000735561 [0,1,0,0,1,0|2,0,0]=4 2673 B23R3.38539 Cc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100000222801_100000210434 [0,1,0,0,1,0|2,0,0]=4 2674 B23R3.38539 Cc1ccccc1C(NC2CCCCC2)c3ccccc3 34a_100000222801_100000210327 [0,1,0,0,1,0|2,0,0]=4 2675 B23R3.38539 Cc1ccccc1C(OC2CCCCC2)c3ccccc3 34a_100000212071_100000210327 [0,1,0,0,1,0|2,0,0]=4 2676 B23R3.38539 Cc1ccccc1C(OC2CCCCC2)c3ccccc3 7a_100000210231_100000230135 [0,1,0,0,1,0|2,0,0]=4 2677 B23R3.38539 Cc1ccccc1C(OC2CCCCC2)c3ccccc3 7a_100000212071_100000210327 [0,1,0,0,1,0|2,0,0]=4 2678 B23R3.38539 Clc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100011215288 [0,1,0,0,1,0|2,0,0]=4 2679 B23R3.38539 Clc1ccccc1C(OC2CCCCC2)c3ccccc3 34a_200011400577_100000210327 [0,1,0,0,1,0|2,0,0]=4 2680 B23R3.38539 Clc1ccccc1C(OC2CCCCC2)c3ccccc3 7a_200011400577_100000210327 [0,1,0,0,1,0|2,0,0]=4 2681 B23R3.38539 Fc1ccccc1C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100011217773 [0,1,0,0,1,0|2,0,0]=4 2682 B23R3.38539 Nc1ccccc1C(OC2CCCCC2)c3ccccc3 34a_100000246470_100000210327 [0,1,0,0,1,0|2,0,0]=4 2683 B23R3.38539 Nc1ccccc1C(OC2CCCCC2)c3ccccc3 7a_100000246470_100000210327 [0,1,0,0,1,0|2,0,0]=4 2684 B23R3.51087 CC(OC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000210327 [0,1,0,0,1,0|2,0,0]=4 2685 B23R3.68581 Brc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000718703 [0,1,0,0,1,0|2,0,0]=4 2686 B23R3.68581 Brc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000745999_100000210434 [0,1,0,0,1,0|2,0,0]=4 2687 B23R3.68581 Brc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 34a_100000745999_100000210327 [0,1,0,0,1,0|2,0,0]=4 2688 B23R3.68581 Brc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_100011217567_100000210327 [0,1,0,0,1,0|2,0,0]=4 2689 B23R3.68581 Brc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100011217567_100000210327 [0,1,0,0,1,0|2,0,0]=4 2690 B23R3.68581 Cc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000210966 [0,1,0,0,1,0|2,0,0]=4 2691 B23R3.68581 Cc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000736602_100000210434 [0,1,0,0,1,0|2,0,0]=4 2692 B23R3.68581 Cc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 34a_100000736602_100000210327 [0,1,0,0,1,0|2,0,0]=4 2693 B23R3.68581 Cc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_100000212064_100000210327 [0,1,0,0,1,0|2,0,0]=4 2694 B23R3.68581 Cc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100000212064_100000210327 [0,1,0,0,1,0|2,0,0]=4 2695 B23R3.68581 Clc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 2230a_100000182618_100000211669 [0,1,0,0,1,0|2,0,0]=4 2696 B23R3.68581 Clc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000211064 [0,1,0,0,1,0|2,0,0]=4 2697 B23R3.68581 Clc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000737946_100000210434 [0,1,0,0,1,0|2,0,0]=4 2698 B23R3.68581 Clc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 34a_100000737946_100000210327 [0,1,0,0,1,0|2,0,0]=4 2699 B23R3.68581 Clc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_100000211768_100000210327 [0,1,0,0,1,0|2,0,0]=4 2700 B23R3.68581 Clc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100000210231_100000211669 [0,1,0,0,1,0|2,0,0]=4 2701 B23R3.68581 Clc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100000211768_100000210327 [0,1,0,0,1,0|2,0,0]=4 2702 B23R3.68581 Fc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000182618_100000210425 [0,1,0,0,1,0|2,0,0]=4 2703 B23R3.68581 Fc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000737529_100000210434 [0,1,0,0,1,0|2,0,0]=4 2704 B23R3.68581 Fc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 34a_100000737529_100000210327 [0,1,0,0,1,0|2,0,0]=4 2705 B23R3.68581 Fc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_200000246460_100000210327 [0,1,0,0,1,0|2,0,0]=4 2706 B23R3.68581 Fc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_200000246460_100000210327 [0,1,0,0,1,0|2,0,0]=4 2707 B23R3.68581 Nc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 34a_100011236343_100000210327 [0,1,0,0,1,0|2,0,0]=4 2708 B23R3.68581 Nc1ccc(cc1)C(OC2CCCCC2)c3ccccc3 7a_100011236343_100000210327 [0,1,0,0,1,0|2,0,0]=4 2709 B23R3.68581 Oc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 270004a_100000198503_100000210434 [0,1,0,0,1,0|2,0,0]=4 2710 B23R3.68581 Oc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 34a_100000198503_100000210327 [0,1,0,0,1,0|2,0,0]=4 2711 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100000207522_100000211591 [0,1,0,0,1,0|2,0,0]=4 2712 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100000207522_100000211591 [0,1,0,0,1,0|2,0,0]=4 2713 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000210327 [0,1,0,0,1,0|2,0,0]=4 2714 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 270004a_100000207522_100000210122 [0,1,0,0,1,0|2,0,0]=4 2715 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 270004a_100103148541_100000210434 [0,1,0,0,1,0|2,0,0]=4 2716 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCCOC3 11a_100000131196_100000210944 [0,1,0,0,1,0|1,0,1]=4 2717 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCCOC3 240690a_100000131196_100000210944 [0,1,0,0,1,0|1,0,1]=4 2718 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCOCC3 11a_100015191051_100000210944 [0,1,0,0,1,0|1,0,1]=4 2719 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCOCC3 1626a_100015191051_100000210944 [0,1,0,0,1,0|1,0,1]=4 2720 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCOCC3 240690a_100015191051_100000210944 [0,1,0,0,1,0|1,0,1]=4 2721 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCOCC3 527a_100015191051_100000210944 [0,1,0,0,1,0|1,0,1]=4 2722 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCSCC3 11a_100000737611_100000210944 [0,1,0,0,1,0|1,0,1]=4 2723 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCSCC3 240690a_100000737611_100000210944 [0,1,0,0,1,0|1,0,1]=4 2724 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCSCC3 527a_100000737611_100000210944 [0,1,0,0,1,0|1,0,1]=4 2725 B23R3.1995413 O=C(C1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210647_100011216954 [0,1,0,0,1,0|1,0,1]=4 2726 B23R3.1995413 O=C(C1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100000210327 [0,1,0,0,1,0|1,0,1]=4 2727 B23R3.9259605 CC1(CCCCC1)NC(c2ccccc2)c3ccccc3 2230a_100000741114_100000211591 [0,1,0,0,1,0|2,0,0]=4 2728 B23R3.9259605 CC1(CCCCC1)NC(c2ccccc2)c3ccccc3 270004a_100000741114_100000210122 [0,1,0,0,1,0|2,0,0]=4 2729 B23R3.9259605 CC1(CCCCC1)OC(c2ccccc2)c3ccccc3 7a_100011215885_100011216954 [0,1,0,0,1,0|2,0,0]=4 2730 B23R3.5136 CC(CC(c1ccccc1)c2ccccc2)N3CCCC3 270004a_100000188435_200000011111 [0,1,0,0,1,0|0,0,0]=2 2731 B23R3.5136 CC(CC(c1ccccc1)c2ccccc2)N3CCSC3 270004a_100011215254_200000011111 [0,1,0,0,1,0|1,0,0]=3 2732 B23R3.5136 CC(NC(c1ccccc1)c2ccccc2)C3CCCC3 2230a_100015185923_100000211591 [0,1,0,0,1,0|2,0,0]=4 2733 B23R3.5136 CC(NC(c1ccccc1)c2ccccc2)C3CCCC3 269862a_100000162943_100000749594 [0,1,0,0,1,0|2,0,0]=4 2734 B23R3.5136 CC(NC(c1ccccc1)c2ccccc2)C3CCCC3 270004a_100000162943_100000749594 [0,1,0,0,1,0|2,0,0]=4 2735 B23R3.5136 CC(NC(c1ccccc1)c2ccccc2)C3CCCC3 270004a_100015185923_100000210122 [0,1,0,0,1,0|2,0,0]=4 2736 B23R3.5136 CC(OC(c1ccccc1)c2ccccc2)C3CCCC3 7a_100011216366_100011216954 [0,1,0,0,1,0|2,0,0]=4 2737 B23R3.5136 O=C(CC(c1ccccc1)c2ccccc2)C3CCCC3 1458a_100000499737_100000179811 [0,1,0,0,1,0|1,0,1]=4 2738 B23R3.5136 O=C(CC(c1ccccc1)c2ccccc2)N3CCCC3 240690a_100000188435_100000499737 [0,1,0,0,1,0|0,0,1]=3 2739 B23R3.5136 O=C(CC(c1ccccc1)c2ccccc2)N3CCCC3 527a_100000188435_100000499737 [0,1,0,0,1,0|0,0,1]=3 2740 B23R3.5136 O=C(CC(c1ccccc1)c2ccccc2)N3CCSC3 11a_100011215254_100000499737 [0,1,0,0,1,0|1,0,1]=4 2741 B23R3.5136 O=C(CC(c1ccccc1)c2ccccc2)N3CCSC3 240690a_100011215254_100000499737 [0,1,0,0,1,0|1,0,1]=4 2742 B23R3.5136 O=C(CC(c1ccccc1)c2ccccc2)N3CCSC3 527a_100011215254_100000499737 [0,1,0,0,1,0|1,0,1]=4 2743 B23R3.5136 O=C(CP(c1ccccc1)c2ccccc2)N3CCCC3 240690a_100000188435_200020607205 [0,1,0,0,1,0|1,0,1]=4 2744 B23R3.5136 O=C(CP(c1ccccc1)c2ccccc2)N3CCCC3 527a_100000188435_200020607205 [0,1,0,0,1,0|1,0,1]=4 2745 B23R3.26238 CC1CCCC1NCC(c2ccccc2)c3ccccc3 269862a_100000739227_100000752053 [0,1,0,0,1,0|2,0,0]=4 2746 B23R3.26238 CC1SCCN1CCC(c2ccccc2)c3ccccc3 2230a_200011216479_100009813428 [0,1,0,0,1,0|1,0,0]=3 2747 B23R3.26238 CC1SCCN1CCC(c2ccccc2)c3ccccc3 269982a_200011216479_100009813428 [0,1,0,0,1,0|1,0,0]=3 2748 B23R3.26238 CC1SCCN1CCC(c2ccccc2)c3ccccc3 34a_200011216479_100009813428 [0,1,0,0,1,0|1,0,0]=3 2749 B23R3.26238 CC1SCCN1CC[S+](c2ccccc2)c3ccccc3 2230a_200011216479_100010140906 [0,1,0,0,1,0|2,0,0]=4 2750 B23R3.26238 CC1SCCN1CC[S+](c2ccccc2)c3ccccc3 269982a_200011216479_100010140906 [0,1,0,0,1,0|2,0,0]=4 2751 B23R3.26238 C[C@@H]1CCCN1CC=C(c2ccccc2)c3ccccc3 270004a_100015189458_100000050448 [0,1,0,0,1,0|0,0,2]=4 2752 B23R3.26238 C[C@@H]1CCCN1CCC(c2ccccc2)c3ccccc3 2230a_100015189458_100009813428 [0,1,0,0,1,0|0,0,0]=2 2753 B23R3.26238 C[C@@H]1CCCN1CCC(c2ccccc2)c3ccccc3 269982a_100015189458_100009813428 [0,1,0,0,1,0|0,0,0]=2 2754 B23R3.26238 C[C@@H]1CCCN1CCC(c2ccccc2)c3ccccc3 34a_100015189458_100009813428 [0,1,0,0,1,0|0,0,0]=2 2755 B23R3.26238 C[C@@H]1CCCN1CC[S+](c2ccccc2)c3ccccc3 2230a_100015189458_100010140906 [0,1,0,0,1,0|1,0,0]=3 2756 B23R3.26238 C[C@@H]1CCCN1CC[S+](c2ccccc2)c3ccccc3 269982a_100015189458_100010140906 [0,1,0,0,1,0|1,0,0]=3 2757 B23R3.26238 C[C@H]1CCCN1CC=C(c2ccccc2)c3ccccc3 270004a_100020605311_100000050448 [0,1,0,0,1,0|0,0,2]=4 2758 B23R3.26238 C[C@H]1CCCN1CCC(c2ccccc2)c3ccccc3 2230a_100020605311_100009813428 [0,1,0,0,1,0|0,0,0]=2 2759 B23R3.26238 C[C@H]1CCCN1CCC(c2ccccc2)c3ccccc3 269982a_100020605311_100009813428 [0,1,0,0,1,0|0,0,0]=2 2760 B23R3.26238 C[C@H]1CCCN1CC[S+](c2ccccc2)c3ccccc3 2230a_100020605311_100010140906 [0,1,0,0,1,0|1,0,0]=3 2761 B23R3.26238 C[C@H]1CCCN1CC[S+](c2ccccc2)c3ccccc3 269982a_100020605311_100010140906 [0,1,0,0,1,0|1,0,0]=3 2762 B23R3.26238 O=C1CCCN1CSC(c2ccccc2)c3ccccc3 62a_100000026320_100011216954 [0,1,0,0,1,0|1,0,1]=4 2763 B23R3.26238 O=C1CCCN1CSC(c2ccccc2)c3ccccc3 62a_100000211591_100000026320 [0,1,0,0,1,0|1,0,1]=4 2764 B23R3.51183 CN(CC1CCCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100000740388 [0,1,0,0,1,0|2,0,0]=4 2765 B23R3.51183 CN(CC1CCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000740388 [0,1,0,0,1,0|2,0,0]=4 2766 B23R3.51183 O=C(CC1CCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210891_100011216954 [0,1,0,0,1,0|1,0,1]=4 2767 B23R3.51183 O=C(CC1CCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100000740388 [0,1,0,0,1,0|1,0,1]=4 2768 B23R3.51183 O=C(CN1CCCC1)C(c2ccccc2)c3ccccc3 1458a_100000740243_100011216954 [0,1,0,0,1,0|0,0,1]=3 2769 B23R3.51183 O=C(CN1CCCC1)N(c2ccccc2)c3ccccc3 2230a_100000188435_200015198546 [0,1,0,0,1,0|1,0,1]=4 2770 B23R3.51183 O=C(CN1CCCC1)N(c2ccccc2)c3ccccc3 269982a_100000188435_200015198546 [0,1,0,0,1,0|1,0,1]=4 2771 B23R3.111056 CC1CCC(C1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100011215218 [0,1,0,0,1,0|2,0,0]=4 2772 B23R3.111056 C[C@@H]1CCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100016987628_100000050448 [0,1,0,0,1,0|0,0,2]=4 2773 B23R3.111056 C[C@@H]1CCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100016987628_100009813428 [0,1,0,0,1,0|0,0,0]=2 2774 B23R3.111056 C[C@@H]1CCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100016987628_100009813428 [0,1,0,0,1,0|0,0,0]=2 2775 B23R3.111056 C[C@@H]1CCN(C1)CCC(c2ccccc2)c3ccccc3 34a_100016987628_100009813428 [0,1,0,0,1,0|0,0,0]=2 2776 B23R3.111056 C[C@@H]1CCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100016987628_100010140906 [0,1,0,0,1,0|1,0,0]=3 2777 B23R3.111056 C[C@@H]1CCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100016987628_100010140906 [0,1,0,0,1,0|1,0,0]=3 2778 B23R3.111056 F[C@H]1CCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100015203821_100000050448 [0,1,0,0,1,0|0,0,2]=4 2779 B23R3.111056 F[C@H]1CCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100015203821_100009813428 [0,1,0,0,1,0|0,0,0]=2 2780 B23R3.111056 F[C@H]1CCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100015203821_100009813428 [0,1,0,0,1,0|0,0,0]=2 2781 B23R3.111056 F[C@H]1CCN(C1)CCC(c2ccccc2)c3ccccc3 34a_100015203821_100009813428 [0,1,0,0,1,0|0,0,0]=2 2782 B23R3.111056 F[C@H]1CCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100015203821_100010140906 [0,1,0,0,1,0|1,0,0]=3 2783 B23R3.111056 F[C@H]1CCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100015203821_100010140906 [0,1,0,0,1,0|1,0,0]=3 2784 B23R3.111056 O=C1CN(CN1)CCC(c2ccccc2)c3ccccc3 2230a_200000708111_100009813428 [0,1,0,0,1,0|1,0,1]=4 2785 B23R3.111056 OC1CCC(C1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100012614533 [0,1,0,0,1,0|2,0,0]=4 2786 B23R3.111056 OC1CCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100011215560_100000050448 [0,1,0,0,1,0|0,0,2]=4 2787 B23R3.111056 OC1CCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100011215560_100009813428 [0,1,0,0,1,0|0,0,0]=2 2788 B23R3.111056 OC1CCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100011215560_100009813428 [0,1,0,0,1,0|0,0,0]=2 2789 B23R3.111056 OC1CCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100011215560_100010140906 [0,1,0,0,1,0|1,0,0]=3 2790 B23R3.111056 OC1CCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100011215560_100010140906 [0,1,0,0,1,0|1,0,0]=3 2791 B23R3.136526 Brc1cccc(c1)C(NCC2CCCC2)c3ccccc3 2230a_100011212009_100000740388 [0,1,0,0,1,0|2,0,0]=4 2792 B23R3.136526 Brc1cccc(c1)C(NCC2CCCC2)c3ccccc3 269862a_100011212009_100000746403 [0,1,0,0,1,0|2,0,0]=4 2793 B23R3.136526 Brc1cccc(c1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100011267660 [0,1,0,0,1,0|2,0,0]=4 2794 B23R3.136526 Brc1cccc(c1)C(NCC2CCCC2)c3ccccc3 34a_100011212009_100000740388 [0,1,0,0,1,0|2,0,0]=4 2795 B23R3.136526 Cc1cccc(c1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100011217825 [0,1,0,0,1,0|2,0,0]=4 2796 B23R3.136526 Clc1cccc(c1)C(NCC2CCCC2)c3ccccc3 2230a_100000741085_100000740388 [0,1,0,0,1,0|2,0,0]=4 2797 B23R3.136526 Clc1cccc(c1)C(NCC2CCCC2)c3ccccc3 269862a_100000741085_100000746403 [0,1,0,0,1,0|2,0,0]=4 2798 B23R3.136526 Clc1cccc(c1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100011215489 [0,1,0,0,1,0|2,0,0]=4 2799 B23R3.136526 Clc1cccc(c1)C(NCC2CCCC2)c3ccccc3 34a_100000741085_100000740388 [0,1,0,0,1,0|2,0,0]=4 2800 B23R3.136526 Clc1cccc(c1)C(OCC2CCCC2)c3ccccc3 34a_100000733576_100000740388 [0,1,0,0,1,0|2,0,0]=4 2801 B23R3.136526 Clc1cccc(c1)C(OCC2CCCC2)c3ccccc3 7a_100000733576_100000740388 [0,1,0,0,1,0|2,0,0]=4 2802 B23R3.136526 Fc1cccc(c1)C(NCC2CCCC2)c3ccccc3 2230a_100000686443_100000740388 [0,1,0,0,1,0|2,0,0]=4 2803 B23R3.136526 Fc1cccc(c1)C(NCC2CCCC2)c3ccccc3 269862a_100000686443_100000746403 [0,1,0,0,1,0|2,0,0]=4 2804 B23R3.136526 Fc1cccc(c1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_200011219850 [0,1,0,0,1,0|2,0,0]=4 2805 B23R3.136526 Fc1cccc(c1)C(NCC2CCCC2)c3ccccc3 34a_100000686443_100000740388 [0,1,0,0,1,0|2,0,0]=4 2806 B23R3.136526 Fc1cccc(c1)C(OCC2CCCC2)c3ccccc3 34a_100000749007_100000740388 [0,1,0,0,1,0|2,0,0]=4 2807 B23R3.136526 Fc1cccc(c1)C(OCC2CCCC2)c3ccccc3 7a_100000749007_100000740388 [0,1,0,0,1,0|2,0,0]=4 2808 B23R3.155183 Brc1ccccc1C(NCC2CCCC2)c3ccccc3 2230a_100011211563_100000740388 [0,1,0,0,1,0|2,0,0]=4 2809 B23R3.155183 Brc1ccccc1C(NCC2CCCC2)c3ccccc3 269862a_100011211563_100000746403 [0,1,0,0,1,0|2,0,0]=4 2810 B23R3.155183 Brc1ccccc1C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100000198044 [0,1,0,0,1,0|2,0,0]=4 2811 B23R3.155183 Brc1ccccc1C(NCC2CCCC2)c3ccccc3 34a_100011211563_100000740388 [0,1,0,0,1,0|2,0,0]=4 2812 B23R3.155183 Cc1ccccc1C(NCC2CCCC2)c3ccccc3 2230a_100000222801_100000740388 [0,1,0,0,1,0|2,0,0]=4 2813 B23R3.155183 Cc1ccccc1C(NCC2CCCC2)c3ccccc3 2230a_100000737975_100000230135 [0,1,0,0,1,0|2,0,0]=4 2814 B23R3.155183 Cc1ccccc1C(NCC2CCCC2)c3ccccc3 269862a_100000222801_100000746403 [0,1,0,0,1,0|2,0,0]=4 2815 B23R3.155183 Cc1ccccc1C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100000735561 [0,1,0,0,1,0|2,0,0]=4 2816 B23R3.155183 Cc1ccccc1C(NCC2CCCC2)c3ccccc3 34a_100000222801_100000740388 [0,1,0,0,1,0|2,0,0]=4 2817 B23R3.155183 Cc1ccccc1C(OCC2CCCC2)c3ccccc3 34a_100000212071_100000740388 [0,1,0,0,1,0|2,0,0]=4 2818 B23R3.155183 Cc1ccccc1C(OCC2CCCC2)c3ccccc3 7a_100000212071_100000740388 [0,1,0,0,1,0|2,0,0]=4 2819 B23R3.155183 Cc1ccccc1C(OCC2CCCC2)c3ccccc3 7a_100000742336_100000230135 [0,1,0,0,1,0|2,0,0]=4 2820 B23R3.155183 Clc1ccccc1C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100011215288 [0,1,0,0,1,0|2,0,0]=4 2821 B23R3.155183 Clc1ccccc1C(OCC2CCCC2)c3ccccc3 34a_200011400577_100000740388 [0,1,0,0,1,0|2,0,0]=4 2822 B23R3.155183 Clc1ccccc1C(OCC2CCCC2)c3ccccc3 7a_200011400577_100000740388 [0,1,0,0,1,0|2,0,0]=4 2823 B23R3.155183 Fc1ccccc1C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100011217773 [0,1,0,0,1,0|2,0,0]=4 2824 B23R3.155183 Nc1ccccc1C(OCC2CCCC2)c3ccccc3 34a_100000246470_100000740388 [0,1,0,0,1,0|2,0,0]=4 2825 B23R3.155183 Nc1ccccc1C(OCC2CCCC2)c3ccccc3 7a_100000246470_100000740388 [0,1,0,0,1,0|2,0,0]=4 2826 B23R3.1300508 Brc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 2230a_100000745999_100000740388 [0,1,0,0,1,0|2,0,0]=4 2827 B23R3.1300508 Brc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 269862a_100000745999_100000746403 [0,1,0,0,1,0|2,0,0]=4 2828 B23R3.1300508 Brc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100000718703 [0,1,0,0,1,0|2,0,0]=4 2829 B23R3.1300508 Brc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 34a_100000745999_100000740388 [0,1,0,0,1,0|2,0,0]=4 2830 B23R3.1300508 Brc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 34a_100011217567_100000740388 [0,1,0,0,1,0|2,0,0]=4 2831 B23R3.1300508 Brc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100011217567_100000740388 [0,1,0,0,1,0|2,0,0]=4 2832 B23R3.1300508 Cc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 2230a_100000736602_100000740388 [0,1,0,0,1,0|2,0,0]=4 2833 B23R3.1300508 Cc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 269862a_100000736602_100000746403 [0,1,0,0,1,0|2,0,0]=4 2834 B23R3.1300508 Cc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100000210966 [0,1,0,0,1,0|2,0,0]=4 2835 B23R3.1300508 Cc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 34a_100000736602_100000740388 [0,1,0,0,1,0|2,0,0]=4 2836 B23R3.1300508 Cc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 34a_100000212064_100000740388 [0,1,0,0,1,0|2,0,0]=4 2837 B23R3.1300508 Cc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100000212064_100000740388 [0,1,0,0,1,0|2,0,0]=4 2838 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 2230a_100000737946_100000740388 [0,1,0,0,1,0|2,0,0]=4 2839 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 2230a_100000737975_100000211669 [0,1,0,0,1,0|2,0,0]=4 2840 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 269862a_100000737946_100000746403 [0,1,0,0,1,0|2,0,0]=4 2841 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100000211064 [0,1,0,0,1,0|2,0,0]=4 2842 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 34a_100000737946_100000740388 [0,1,0,0,1,0|2,0,0]=4 2843 B23R3.1300508 Clc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 34a_100000211768_100000740388 [0,1,0,0,1,0|2,0,0]=4 2844 B23R3.1300508 Clc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100000211768_100000740388 [0,1,0,0,1,0|2,0,0]=4 2845 B23R3.1300508 Clc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100000742336_100000211669 [0,1,0,0,1,0|2,0,0]=4 2846 B23R3.1300508 Fc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 2230a_100000737529_100000740388 [0,1,0,0,1,0|2,0,0]=4 2847 B23R3.1300508 Fc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 269862a_100000737529_100000746403 [0,1,0,0,1,0|2,0,0]=4 2848 B23R3.1300508 Fc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 270004a_100000737975_100000210425 [0,1,0,0,1,0|2,0,0]=4 2849 B23R3.1300508 Fc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 34a_100000737529_100000740388 [0,1,0,0,1,0|2,0,0]=4 2850 B23R3.1300508 Fc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 34a_200000246460_100000740388 [0,1,0,0,1,0|2,0,0]=4 2851 B23R3.1300508 Fc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_200000246460_100000740388 [0,1,0,0,1,0|2,0,0]=4 2852 B23R3.1300508 Nc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 34a_100011236343_100000740388 [0,1,0,0,1,0|2,0,0]=4 2853 B23R3.1300508 Nc1ccc(cc1)C(OCC2CCCC2)c3ccccc3 7a_100011236343_100000740388 [0,1,0,0,1,0|2,0,0]=4 2854 B23R3.1300508 Oc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 34a_100000198503_100000740388 [0,1,0,0,1,0|2,0,0]=4 2855 B23R3.1958141 CC(CNC1CCCC1)(c2ccccc2)c3ccccc3 2230a_100000706881_100000179811 [0,1,0,0,1,0|2,0,0]=4 2856 B23R3.1958141 CC(CNC1CCCC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100000210133 [0,1,0,0,1,0|2,0,0]=4 2857 B23R3.1958141 CC(OCC1CCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000740388 [0,1,0,0,1,0|2,0,0]=4 2858 B23R3.10076806 OC1(CCCC1)CNC(c2ccccc2)c3ccccc3 2230a_100000737848_100000211591 [0,1,0,0,1,0|2,0,0]=4 2859 B23R3.10076806 OC1(CCCC1)CNC(c2ccccc2)c3ccccc3 270004a_100000737848_100000210122 [0,1,0,0,1,0|2,0,0]=4 2860 B25R3.23392 Cc1ccc(cc1)CC(NCC2CCCCC2)c3ccccc3 2230a_217856618520_100000211423 [0,1,0,0,0,1|2,0,0]=4 2861 B25R3.23392 Cc1ccc(cc1)CC(NCC2CCCCC2)c3ccccc3 269862a_217856618520_100000211278 [0,1,0,0,0,1|2,0,0]=4 2862 B25R3.23392 Cc1ccc(cc1)CC(NCC2CCCCC2)c3ccccc3 34a_217856618520_100000211423 [0,1,0,0,0,1|2,0,0]=4 2863 B25R3.25151 CC1CCCN(C1)CCN(Cc2ccccc2)c3ccccc3 2230a_100000188819_100000766211 [0,1,0,0,0,1|1,0,0]=3 2864 B25R3.25151 CC1CCCN(C1)CCN(Cc2ccccc2)c3ccccc3 269982a_100000188819_100000766211 [0,1,0,0,0,1|1,0,0]=3 2865 B25R3.25151 CC1CCCN(C1)CCN(Cc2ccccc2)c3ccccc3 34a_100000188819_100000766211 [0,1,0,0,0,1|1,0,0]=3 2866 B25R3.25239 Brc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 2230a_100000224063_100000739454 [0,1,0,0,0,1|1,0,0]=3 2867 B25R3.25239 Brc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 269982a_100000224063_100000739454 [0,1,0,0,0,1|1,0,0]=3 2868 B25R3.25239 Brc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 34a_100000224063_100000739454 [0,1,0,0,0,1|1,0,0]=3 2869 B25R3.25239 Brc1cccc(c1)N(CCN2CCOCC2)Cc3ccccc3 2230a_100000224063_100025781966 [0,1,0,0,0,1|2,0,0]=4 2870 B25R3.25239 Brc1cccc(c1)N(CCN2CCOCC2)Cc3ccccc3 269982a_100000224063_100000753993 [0,1,0,0,0,1|2,0,0]=4 2871 B25R3.25239 Cc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 2230a_100000185206_100012355289 [0,1,0,0,0,1|2,0,0]=4 2872 B25R3.25239 Cc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 269982a_100000185206_100011273959 [0,1,0,0,0,1|2,0,0]=4 2873 B25R3.25239 Cc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 34a_100000185206_100011209188 [0,1,0,0,0,1|2,0,0]=4 2874 B25R3.25239 Cc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 2230a_100000185206_100000739454 [0,1,0,0,0,1|1,0,0]=3 2875 B25R3.25239 Cc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 269982a_100000185206_100000739454 [0,1,0,0,0,1|1,0,0]=3 2876 B25R3.25239 Cc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 34a_100000185206_100000739454 [0,1,0,0,0,1|1,0,0]=3 2877 B25R3.25239 Cc1cccc(c1)N(CCN2CCOCC2)Cc3ccccc3 2230a_100000185206_100025781966 [0,1,0,0,0,1|2,0,0]=4 2878 B25R3.25239 Cc1cccc(c1)N(CCN2CCOCC2)Cc3ccccc3 269982a_100000185206_100000753993 [0,1,0,0,0,1|2,0,0]=4 2879 B25R3.25239 Clc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 2230a_100102953027_100000739454 [0,1,0,0,0,1|1,0,0]=3 2880 B25R3.25239 Clc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 269982a_100102953027_100000739454 [0,1,0,0,0,1|1,0,0]=3 2881 B25R3.25239 Clc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 34a_100102953027_100000739454 [0,1,0,0,0,1|1,0,0]=3 2882 B25R3.25239 Clc1cccc(c1)N(CCN2CCOCC2)Cc3ccccc3 2230a_100102953027_100025781966 [0,1,0,0,0,1|2,0,0]=4 2883 B25R3.25239 Clc1cccc(c1)N(CCN2CCOCC2)Cc3ccccc3 269982a_100102953027_100000753993 [0,1,0,0,0,1|2,0,0]=4 2884 B25R3.25239 Fc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 2230a_100102952868_100012355289 [0,1,0,0,0,1|2,0,0]=4 2885 B25R3.25239 Fc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 269982a_100102952868_100011273959 [0,1,0,0,0,1|2,0,0]=4 2886 B25R3.25239 Fc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 34a_100102952868_100011209188 [0,1,0,0,0,1|2,0,0]=4 2887 B25R3.25239 Fc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 2230a_100102952868_100000739454 [0,1,0,0,0,1|1,0,0]=3 2888 B25R3.25239 Fc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 269982a_100102952868_100000739454 [0,1,0,0,0,1|1,0,0]=3 2889 B25R3.25239 Fc1cccc(c1)N(CCN2CCCCC2)Cc3ccccc3 34a_100102952868_100000739454 [0,1,0,0,0,1|1,0,0]=3 2890 B25R3.25239 Fc1cccc(c1)N(CCN2CCOCC2)Cc3ccccc3 2230a_100102952868_100025781966 [0,1,0,0,0,1|2,0,0]=4 2891 B25R3.25239 Fc1cccc(c1)N(CCN2CCOCC2)Cc3ccccc3 269982a_100102952868_100000753993 [0,1,0,0,0,1|2,0,0]=4 2892 B25R3.26011 Cc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 2230a_100102946366_100012355289 [0,1,0,0,0,1|2,0,0]=4 2893 B25R3.26011 Cc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 269982a_100102946366_100011273959 [0,1,0,0,0,1|2,0,0]=4 2894 B25R3.26011 Cc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 34a_100102946366_100011209188 [0,1,0,0,0,1|2,0,0]=4 2895 B25R3.26011 Cc1ccccc1N(CCN2CCCCC2)Cc3ccccc3 2230a_100102946366_100000739454 [0,1,0,0,0,1|1,0,0]=3 2896 B25R3.26011 Cc1ccccc1N(CCN2CCCCC2)Cc3ccccc3 269982a_100102946366_100000739454 [0,1,0,0,0,1|1,0,0]=3 2897 B25R3.26011 Cc1ccccc1N(CCN2CCCCC2)Cc3ccccc3 34a_100102946366_100000739454 [0,1,0,0,0,1|1,0,0]=3 2898 B25R3.26011 Cc1ccccc1N(CCN2CCOCC2)Cc3ccccc3 2230a_100102946366_100025781966 [0,1,0,0,0,1|2,0,0]=4 2899 B25R3.26011 Cc1ccccc1N(CCN2CCOCC2)Cc3ccccc3 269982a_100102946366_100000753993 [0,1,0,0,0,1|2,0,0]=4 2900 B25R3.26011 Fc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 2230a_100025753533_100012355289 [0,1,0,0,0,1|2,0,0]=4 2901 B25R3.26011 Fc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 269982a_100025753533_100011273959 [0,1,0,0,0,1|2,0,0]=4 2902 B25R3.26011 Fc1ccccc1N(CCC2CCCCC2)Cc3ccccc3 34a_100025753533_100011209188 [0,1,0,0,0,1|2,0,0]=4 2903 B25R3.26011 Fc1ccccc1N(CCN2CCCCC2)Cc3ccccc3 2230a_100025753533_100000739454 [0,1,0,0,0,1|1,0,0]=3 2904 B25R3.26011 Fc1ccccc1N(CCN2CCCCC2)Cc3ccccc3 269982a_100025753533_100000739454 [0,1,0,0,0,1|1,0,0]=3 2905 B25R3.26011 Fc1ccccc1N(CCN2CCCCC2)Cc3ccccc3 34a_100025753533_100000739454 [0,1,0,0,0,1|1,0,0]=3 2906 B25R3.26011 Fc1ccccc1N(CCN2CCOCC2)Cc3ccccc3 2230a_100025753533_100025781966 [0,1,0,0,0,1|2,0,0]=4 2907 B25R3.26011 Fc1ccccc1N(CCN2CCOCC2)Cc3ccccc3 269982a_100025753533_100000753993 [0,1,0,0,0,1|2,0,0]=4 2908 B25R3.45367 Fc1ccccc1CN(CCC2CCCCC2)c3ccccc3 2230a_100000224004_100012355289 [0,1,0,0,0,1|2,0,0]=4 2909 B25R3.45367 Fc1ccccc1CN(CCC2CCCCC2)c3ccccc3 269982a_100000224004_100011273959 [0,1,0,0,0,1|2,0,0]=4 2910 B25R3.45367 Fc1ccccc1CN(CCC2CCCCC2)c3ccccc3 34a_100000224004_100011209188 [0,1,0,0,0,1|2,0,0]=4 2911 B25R3.45367 Fc1ccccc1CN(CCN2CCCCC2)c3ccccc3 2230a_100000224004_100000739454 [0,1,0,0,0,1|1,0,0]=3 2912 B25R3.45367 Fc1ccccc1CN(CCN2CCCCC2)c3ccccc3 269982a_100000224004_100000739454 [0,1,0,0,0,1|1,0,0]=3 2913 B25R3.45367 Fc1ccccc1CN(CCN2CCCCC2)c3ccccc3 34a_100000224004_100000739454 [0,1,0,0,0,1|1,0,0]=3 2914 B25R3.45367 Fc1ccccc1CN(CCN2CCOCC2)c3ccccc3 2230a_100000224004_100025781966 [0,1,0,0,0,1|2,0,0]=4 2915 B25R3.45367 Fc1ccccc1CN(CCN2CCOCC2)c3ccccc3 269982a_100000224004_100000753993 [0,1,0,0,0,1|2,0,0]=4 2916 B25R3.82774 CC(CN1CCCCC1)N(Cc2ccccc2)c3ccccc3 269982a_100000188819_100009831500 [0,1,0,0,0,1|1,0,0]=3 2917 B25R3.82774 O=C(CC1CCCCC1)C(Cc2ccccc2)c3ccccc3 1458a_200000261918_100000211423 [0,1,0,0,0,1|1,0,1]=4 2918 B25R3.82774 O=C(CN1CCCCC1)N(Cc2ccccc2)c3ccccc3 11a_100000188819_100000740322 [0,1,0,0,0,1|1,0,1]=4 2919 B25R3.82774 O=C(CN1CCCCC1)N(Cc2ccccc2)c3ccccc3 22a_100000188819_100000740322 [0,1,0,0,0,1|1,0,1]=4 2920 B25R3.83042 CC(NC(Cc1ccccc1)c2ccccc2)C3CCCCC3 269862a_100025772854_100000210989 [0,1,0,0,0,1|2,0,0]=4 2921 B25R3.83042 O=C(CN(Cc1ccccc1)c2ccccc2)N3CCCCC3 2230a_100000188819_100000183409 [0,1,0,0,0,1|1,0,1]=4 2922 B25R3.83042 O=C(CN(Cc1ccccc1)c2ccccc2)N3CCCCC3 269982a_100000188819_100000183409 [0,1,0,0,0,1|1,0,1]=4 2923 B25R3.83042 O=C(CN(Cc1ccccc1)c2ccccc2)N3CCCCC3 34a_100000188819_100000183409 [0,1,0,0,0,1|1,0,1]=4 2924 B25R3.114826 Brc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 2230a_100000187040_100000739454 [0,1,0,0,0,1|1,0,0]=3 2925 B25R3.114826 Brc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 269982a_100000187040_100000739454 [0,1,0,0,0,1|1,0,0]=3 2926 B25R3.114826 Brc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 34a_100000187040_100000739454 [0,1,0,0,0,1|1,0,0]=3 2927 B25R3.114826 Brc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccn3 2230a_100000238286_100000739454 [0,1,0,0,0,1|2,0,0]=4 2928 B25R3.114826 Brc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccn3 269982a_100000238286_100000739454 [0,1,0,0,0,1|2,0,0]=4 2929 B25R3.114826 Brc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccn3 34a_100000238286_100000739454 [0,1,0,0,0,1|2,0,0]=4 2930 B25R3.114826 Brc1ccc(cc1)N(CCN2CCCCC2)Cc3cccnc3 2230a_100000189165_100000739454 [0,1,0,0,0,1|2,0,0]=4 2931 B25R3.114826 Brc1ccc(cc1)N(CCN2CCCCC2)Cc3cccnc3 269982a_100000189165_100000739454 [0,1,0,0,0,1|2,0,0]=4 2932 B25R3.114826 Brc1ccc(cc1)N(CCN2CCCCC2)Cc3cccnc3 34a_100000189165_100000739454 [0,1,0,0,0,1|2,0,0]=4 2933 B25R3.114826 Brc1ccc(cc1)N(CCN2CCOCC2)Cc3ccccc3 2230a_100000187040_100025781966 [0,1,0,0,0,1|2,0,0]=4 2934 B25R3.114826 Brc1ccc(cc1)N(CCN2CCOCC2)Cc3ccccc3 269982a_100000187040_100000753993 [0,1,0,0,0,1|2,0,0]=4 2935 B25R3.114826 Cc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 2230a_100000185259_100012355289 [0,1,0,0,0,1|2,0,0]=4 2936 B25R3.114826 Cc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 269982a_100000185259_100011273959 [0,1,0,0,0,1|2,0,0]=4 2937 B25R3.114826 Cc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 34a_100000185259_100011209188 [0,1,0,0,0,1|2,0,0]=4 2938 B25R3.114826 Cc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 2230a_100000185259_100000739454 [0,1,0,0,0,1|1,0,0]=3 2939 B25R3.114826 Cc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 269982a_100000185259_100000739454 [0,1,0,0,0,1|1,0,0]=3 2940 B25R3.114826 Cc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 34a_100000185259_100000739454 [0,1,0,0,0,1|1,0,0]=3 2941 B25R3.114826 Cc1ccc(cc1)N(CCN2CCOCC2)Cc3ccccc3 2230a_100000185259_100025781966 [0,1,0,0,0,1|2,0,0]=4 2942 B25R3.114826 Cc1ccc(cc1)N(CCN2CCOCC2)Cc3ccccc3 269982a_100000185259_100000753993 [0,1,0,0,0,1|2,0,0]=4 2943 B25R3.114826 Clc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 2230a_100000187391_100000739454 [0,1,0,0,0,1|1,0,0]=3 2944 B25R3.114826 Clc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 269982a_100000187391_100000739454 [0,1,0,0,0,1|1,0,0]=3 2945 B25R3.114826 Clc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 34a_100000187391_100000739454 [0,1,0,0,0,1|1,0,0]=3 2946 B25R3.114826 Clc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccn3 2230a_100000742532_100000739454 [0,1,0,0,0,1|2,0,0]=4 2947 B25R3.114826 Clc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccn3 269982a_100000742532_100000739454 [0,1,0,0,0,1|2,0,0]=4 2948 B25R3.114826 Clc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccn3 34a_100000742532_100000739454 [0,1,0,0,0,1|2,0,0]=4 2949 B25R3.114826 Clc1ccc(cc1)N(CCN2CCCCC2)Cc3cccnc3 2230a_100000187240_100000739454 [0,1,0,0,0,1|2,0,0]=4 2950 B25R3.114826 Clc1ccc(cc1)N(CCN2CCCCC2)Cc3cccnc3 269982a_100000187240_100000739454 [0,1,0,0,0,1|2,0,0]=4 2951 B25R3.114826 Clc1ccc(cc1)N(CCN2CCCCC2)Cc3cccnc3 34a_100000187240_100000739454 [0,1,0,0,0,1|2,0,0]=4 2952 B25R3.114826 Clc1ccc(cc1)N(CCN2CCOCC2)Cc3ccccc3 2230a_100000187391_100025781966 [0,1,0,0,0,1|2,0,0]=4 2953 B25R3.114826 Clc1ccc(cc1)N(CCN2CCOCC2)Cc3ccccc3 269982a_100000187391_100000753993 [0,1,0,0,0,1|2,0,0]=4 2954 B25R3.114826 Fc1ccc(cc1)C(Cc2ccccc2)NCC3CCCCC3 2230a_103496528834_100000211423 [0,1,0,0,0,1|2,0,0]=4 2955 B25R3.114826 Fc1ccc(cc1)C(Cc2ccccc2)NCC3CCCCC3 269862a_103496528834_100000211278 [0,1,0,0,0,1|2,0,0]=4 2956 B25R3.114826 Fc1ccc(cc1)C(Cc2ccccc2)NCC3CCCCC3 34a_103496528834_100000211423 [0,1,0,0,0,1|2,0,0]=4 2957 B25R3.114826 Oc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 269982a_200000188756_100011273959 [0,1,0,0,0,1|2,0,0]=4 2958 B25R3.114826 Oc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 34a_200000188756_100011209188 [0,1,0,0,0,1|2,0,0]=4 2959 B25R3.114826 Oc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 269982a_200000188756_100000739454 [0,1,0,0,0,1|1,0,0]=3 2960 B25R3.114826 Oc1ccc(cc1)N(CCN2CCCCC2)Cc3ccccc3 34a_200000188756_100000739454 [0,1,0,0,0,1|1,0,0]=3 2961 B25R3.114826 Oc1ccc(cc1)N(CCN2CCOCC2)Cc3ccccc3 269982a_200000188756_100000753993 [0,1,0,0,0,1|2,0,0]=4 2962 B25R3.114846 CN1CCN(CC1)CCN(Cc2ccccc2)c3ccccc3 269982a_100000188819_100000694902 [0,1,0,0,0,1|2,0,0]=4 2963 B25R3.2109392 N[C@H](c1ccccc1)[C@@H](OCC2CCCCC2)c3ccccc3 34a_100000765503_100000211423 [0,1,0,0,0,1|2,0,0]=4 2964 B25R3.2109392 O=C(c1ccccc1)C(NCC2CCCCC2)c3ccccc3 2230a_100000210473_100000211254 [0,1,0,0,0,1|2,0,0]=4 2965 B25R3.2109392 O=C(c1ccccc1)C(OCC2CCCCC2)c3ccccc3 7a_100000185998_100000211423 [0,1,0,0,0,1|2,0,0]=4 2966 B25R3.2109392 O=C(c1ccccc1)C(OCC2CCCCC2)c3ccccc3 7a_100000212181_100000211254 [0,1,0,0,0,1|2,0,0]=4 2967 B25R3.2109392 O=C(c1ccccc1)C(SCC2CCCCC2)c3ccccc3 62a_100000211254_100000211423 [0,1,0,0,0,1|2,0,0]=4 2968 B25R3.2109392 O=C(c1ccccc1)C(SCC2CCCCC2)c3ccccc3 62a_100000211423_100000211254 [0,1,0,0,0,1|2,0,0]=4 2969 B25R3.2109392 O[C@@H](c1ccccc1)[C@H](NCC2CCCCC2)c3ccccc3 2230a_100000765503_100000211423 [0,1,0,0,0,1|2,0,0]=4 2970 B25R3.2109392 O[C@@H](c1ccccc1)[C@H](NCC2CCCCC2)c3ccccc3 269862a_100000765503_100000211278 [0,1,0,0,0,1|2,0,0]=4 2971 B25R3.18363891 CC1(CCCCC1)CNC(Cc2ccccc2)c3ccccc3 269862a_100025772854_100011935227 [0,1,0,0,0,1|2,0,0]=4 2972 B25R3.20636 CC(NCC(c1ccccc1)c2ccccc2)C3CCCCC3 269862a_100000739227_100000210989 [0,1,0,0,0,1|1,0,0]=3 2973 B25R3.20636 CC(NCC(c1ccccc1)c2ccccc2)C3CCCCN3 269862a_100000739227_200011997754 [0,1,0,0,0,1|2,0,0]=4 2974 B25R3.20636 CC(NCC(c1ccccc1)c2ccccc2)C3CCCNC3 269862a_100000739227_100011320585 [0,1,0,0,0,1|2,0,0]=4 2975 B25R3.20636 CC(NCC(c1ccccc1)c2ccccc2)C3CCNCC3 269862a_100000739227_100015204191 [0,1,0,0,0,1|2,0,0]=4 2976 B25R3.20636 CC(NCC(c1ccccc1)c2ccccc2)C3CCOCC3 269862a_100000739227_100000759496 [0,1,0,0,0,1|2,0,0]=4 2977 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 2230a_100000207522_100009813428 [0,1,0,0,0,1|1,0,0]=3 2978 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 269982a_100000207522_100009813428 [0,1,0,0,0,1|1,0,0]=3 2979 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 269982a_100025726140_100000210327 [0,1,0,0,0,1|1,0,0]=3 2980 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 270004a_100025726140_100000210434 [0,1,0,0,0,1|1,0,0]=3 2981 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 34a_100000207522_100009813428 [0,1,0,0,0,1|1,0,0]=3 2982 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 34a_100025726140_100000210327 [0,1,0,0,0,1|1,0,0]=3 2983 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCOC3 269982a_100025726140_100000693364 [0,1,0,0,0,1|2,0,0]=4 2984 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCOC3 270004a_100025726140_100000753404 [0,1,0,0,0,1|2,0,0]=4 2985 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCOC3 34a_100025726140_100000693364 [0,1,0,0,0,1|2,0,0]=4 2986 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCSC3 270004a_100025726140_100000057913 [0,1,0,0,0,1|2,0,0]=4 2987 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCNCC3 270004a_100025726140_100015192401 [0,1,0,0,0,1|2,0,0]=4 2988 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCOCC3 2230a_100020587155_100009813428 [0,1,0,0,0,1|2,0,0]=4 2989 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCOCC3 269982a_100020587155_100009813428 [0,1,0,0,0,1|2,0,0]=4 2990 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCOCC3 269982a_100025726140_100011324220 [0,1,0,0,0,1|2,0,0]=4 2991 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCOCC3 270004a_100025726140_100011217826 [0,1,0,0,0,1|2,0,0]=4 2992 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCOCC3 34a_100020587155_100009813428 [0,1,0,0,0,1|2,0,0]=4 2993 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 2230a_100015184757_100009813428 [0,1,0,0,0,1|2,0,0]=4 2994 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 269982a_100015184757_100009813428 [0,1,0,0,0,1|2,0,0]=4 2995 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 269982a_100025726140_100000069128 [0,1,0,0,0,1|2,0,0]=4 2996 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 270004a_100025726140_100000203788 [0,1,0,0,0,1|2,0,0]=4 2997 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 34a_100015184757_100009813428 [0,1,0,0,0,1|2,0,0]=4 2998 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 34a_100025726140_100000069128 [0,1,0,0,0,1|2,0,0]=4 2999 B25R3.20636 CN(CC[S+](c1ccccc1)c2ccccc2)C3CCCCC3 2230a_100000207522_100010140906 [0,1,0,0,0,1|2,0,0]=4 3000 B25R3.20636 CN(CC[S+](c1ccccc1)c2ccccc2)C3CCCCC3 269982a_100000207522_100010140906 [0,1,0,0,0,1|2,0,0]=4 3001 B25R3.20636 O=C(CCC(c1ccccc1)c2ccccc2)C3=CCCCC3 1458a_100000765259_100009813428 [0,1,0,0,0,1|1,0,1]=4 3002 B25R3.20636 O=C(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100000210647_100009813428 [0,1,0,0,0,1|1,0,0]=3 3003 B25R3.20636 O=C(CCC(c1ccccc1)c2ccccc2)C3CCCCO3 1458a_100000748299_100009813428 [0,1,0,0,0,1|2,0,0]=4 3004 B25R3.20636 O=C(CCC(c1ccccc1)c2ccccc2)C3CCCOC3 1458a_100000741522_100009813428 [0,1,0,0,0,1|2,0,0]=4 3005 B25R3.20636 O=C(CCC(c1ccccc1)c2ccccc2)C3CCOCC3 1458a_100000195482_100009813428 [0,1,0,0,0,1|2,0,0]=4 3006 B25R3.20636 O=C(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 1458a_100000755232_100009813428 [0,1,0,0,0,1|2,0,0]=4 3007 B25R3.20636 O=C(CCP(c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100020644332_100000210327 [0,1,0,0,0,1|2,0,0]=4 3008 B25R3.20636 O=C(CCP(c1ccccc1)c2ccccc2)N3CCCOC3 240690a_100000131196_100020644332 [0,1,0,0,0,1|2,0,0]=4 3009 B25R3.20636 O=C(CCP(c1ccccc1)c2ccccc2)N3CCOCC3 1626a_100015191051_100020644332 [0,1,0,0,0,1|2,0,0]=4 3010 B25R3.20636 O=C(CCP(c1ccccc1)c2ccccc2)N3CCOCC3 240690a_100015191051_100020644332 [0,1,0,0,0,1|2,0,0]=4 3011 B25R3.20636 O=C(CCP(c1ccccc1)c2ccccc2)N3CCSCC3 240690a_100000737611_100020644332 [0,1,0,0,0,1|2,0,0]=4 3012 B25R3.20636 O=C(CC[S+](c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100000210647_100010140906 [0,1,0,0,0,1|2,0,0]=4 3013 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)C3CCCCC3 2230a_100000162943_100000241979 [0,1,0,0,0,1|1,0,1]=4 3014 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)C3CCCCC3 34a_100000162943_100000241979 [0,1,0,0,0,1|1,0,1]=4 3015 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)N3CCCCC3 2230a_100000162943_100000183409 [0,1,0,0,0,1|0,0,1]=3 3016 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)N3CCCCC3 2230a_100000751303_100000211591 [0,1,0,0,0,1|0,0,1]=3 3017 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)N3CCCCC3 270004a_100000751303_100000210122 [0,1,0,0,0,1|0,0,1]=3 3018 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)N3CCCCC3 34a_100000162943_100000183409 [0,1,0,0,0,1|0,0,1]=3 3019 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)N3CCOCC3 2230a_100000162943_100000183410 [0,1,0,0,0,1|1,0,1]=4 3020 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)N3CCOCC3 2230a_100000697423_100000211591 [0,1,0,0,0,1|1,0,1]=4 3021 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)N3CCOCC3 270004a_100000697423_100000210122 [0,1,0,0,0,1|1,0,1]=4 3022 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)N3CCOCC3 34a_100000162943_100000183410 [0,1,0,0,0,1|1,0,1]=4 3023 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccn2)N3CCCCC3 2230a_100000689936_100000183409 [0,1,0,0,0,1|1,0,1]=4 3024 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccn2)N3CCCCC3 270004a_100000751303_100000210380 [0,1,0,0,0,1|1,0,1]=4 3025 B25R3.20636 O=C(CNC(c1ccccc1)c2cccnc2)N3CCCCC3 2230a_100011232609_100000183409 [0,1,0,0,0,1|1,0,1]=4 3026 B25R3.20636 O=C(CNC(c1ccccc1)c2cccnc2)N3CCCCC3 270004a_100000751303_100000735413 [0,1,0,0,0,1|1,0,1]=4 3027 B25R3.20636 O=C(CNC(c1ccccc1)c2ccncc2)N3CCCCC3 2230a_100025760769_100000183409 [0,1,0,0,0,1|1,0,1]=4 3028 B25R3.20636 O=C(COC(c1ccccc1)c2ccccc2)C3CCCCC3 34a_100000211180_100000241979 [0,1,0,0,0,1|1,0,1]=4 3029 B25R3.20636 O=C(COC(c1ccccc1)c2ccccc2)C3CCCCC3 7a_100000211180_100000241979 [0,1,0,0,0,1|1,0,1]=4 3030 B25R3.20636 O=C(COC(c1ccccc1)c2ccccc2)N3CCCCC3 34a_100000211180_100000183409 [0,1,0,0,0,1|0,0,1]=3 3031 B25R3.20636 O=C(COC(c1ccccc1)c2ccccc2)N3CCCCC3 7a_100000211180_100000183409 [0,1,0,0,0,1|0,0,1]=3 3032 B25R3.20636 O=C(COC(c1ccccc1)c2ccccc2)N3CCCCC3 7a_100011315646_100011216954 [0,1,0,0,0,1|0,0,1]=3 3033 B25R3.20636 O=C(COC(c1ccccc1)c2ccccc2)N3CCOCC3 34a_100000211180_100000183410 [0,1,0,0,0,1|1,0,1]=4 3034 B25R3.20636 O=C(COC(c1ccccc1)c2ccccc2)N3CCOCC3 7a_100000211180_100000183410 [0,1,0,0,0,1|1,0,1]=4 3035 B25R3.20636 O=C(COC(c1ccccc1)c2ccccc2)N3CCOCC3 7a_100000752472_100011216954 [0,1,0,0,0,1|1,0,1]=4 3036 B25R3.20636 O=C(COC(c1ccccc1)c2ccccn2)N3CCCCC3 7a_100000180852_100000183409 [0,1,0,0,0,1|1,0,1]=4 3037 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100000683935_100000210327 [0,1,0,0,0,1|1,0,1]=4 3038 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)C3CCCCC3 62a_100000211591_100000241979 [0,1,0,0,0,1|1,0,1]=4 3039 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)C3CCCCC3 62a_100000241979_100011216954 [0,1,0,0,0,1|1,0,1]=4 3040 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCCCC3 62a_100000183409_100011216954 [0,1,0,0,0,1|0,0,1]=3 3041 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCCCC3 62a_100000211591_100000183409 [0,1,0,0,0,1|0,0,1]=3 3042 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCCOC3 11a_100000131196_100000683935 [0,1,0,0,0,1|1,0,1]=4 3043 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCCOC3 240690a_100000131196_100000683935 [0,1,0,0,0,1|1,0,1]=4 3044 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCOCC3 11a_100015191051_100000683935 [0,1,0,0,0,1|1,0,1]=4 3045 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCOCC3 1626a_100015191051_100000683935 [0,1,0,0,0,1|1,0,1]=4 3046 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCOCC3 240690a_100015191051_100000683935 [0,1,0,0,0,1|1,0,1]=4 3047 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCOCC3 527a_100015191051_100000683935 [0,1,0,0,0,1|1,0,1]=4 3048 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCOCC3 62a_100000183410_100011216954 [0,1,0,0,0,1|1,0,1]=4 3049 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCOCC3 62a_100000211591_100000183410 [0,1,0,0,0,1|1,0,1]=4 3050 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCSCC3 11a_100000737611_100000683935 [0,1,0,0,0,1|1,0,1]=4 3051 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCSCC3 240690a_100000737611_100000683935 [0,1,0,0,0,1|1,0,1]=4 3052 B25R3.20636 O=C(CSC(c1ccccc1)c2ccccc2)N3CCSCC3 527a_100000737611_100000683935 [0,1,0,0,0,1|1,0,1]=4 3053 B25R3.20636 O=C(NCC(c1ccccc1)c2ccccc2)C3CCCCC3 1626a_100000739227_100000210647 [0,1,0,0,0,1|1,0,1]=4 3054 B25R3.20636 O=C(NCC(c1ccccc1)c2ccccc2)C3CCCCC3 240690a_100000739227_100000210647 [0,1,0,0,0,1|1,0,1]=4 3055 B25R3.20636 O=C(NCC(c1ccccc1)c2ccccc2)C3CCCCC3 527a_100000739227_100000210647 [0,1,0,0,0,1|1,0,1]=4 3056 B25R3.20636 O=C(NCC(c1ccccc1)c2ccccc2)N3CCCOC3 2708a_100000739227_100000131196 [0,1,0,0,0,1|1,0,1]=4 3057 B25R3.20636 O=C(NCC(c1ccccc1)c2ccccc2)N3CCCOC3 273464a_100000739227_100000131196 [0,1,0,0,0,1|1,0,1]=4 3058 B25R3.20636 O=C(NCC(c1ccccc1)c2ccccc2)N3CCOCC3 2708a_100000739227_100015191051 [0,1,0,0,0,1|1,0,1]=4 3059 B25R3.20636 O=C(NCC(c1ccccc1)c2ccccc2)N3CCOCC3 273464a_100000739227_100015191051 [0,1,0,0,0,1|1,0,1]=4 3060 B25R3.20636 O=C(NCC(c1ccccc1)c2ccccc2)N3CCSCC3 2708a_100000739227_100000737611 [0,1,0,0,0,1|1,0,1]=4 3061 B25R3.20636 O=C(NCC(c1ccccc1)c2ccccc2)N3CCSCC3 273464a_100000739227_100000737611 [0,1,0,0,0,1|1,0,1]=4 3062 B25R3.25375 CC1=CCCN(C1)CCOC(c2ccccc2)c3ccccc3 2230a_100000725631_100000734929 [0,1,0,0,0,1|0,0,2]=4 3063 B25R3.25375 CC1=CCCN(C1)CCOC(c2ccccc2)c3ccccc3 269982a_100000725631_100000734929 [0,1,0,0,0,1|0,0,2]=4 3064 B25R3.25375 CC1=CCCN(C1)CCOC(c2ccccc2)c3ccccc3 34a_100000725631_100000734929 [0,1,0,0,0,1|0,0,2]=4 3065 B25R3.25375 CC1CC(CCO1)NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100000755752 [0,1,0,0,0,1|2,0,0]=4 3066 B25R3.25375 CC1CC(CCO1)OCCC(c2ccccc2)c3ccccc3 34a_100011986385_100009813428 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CC1CCCN(C1)CCNC(c2ccccc2)c3ccccc3 270004a_100000739826_100000210122 [0,1,0,0,0,1|0,0,0]=2 3077 B25R3.25375 CC1CCCN(C1)CCNC(c2ccccc2)c3ccccc3 34a_100000162943_100000766211 [0,1,0,0,0,1|0,0,0]=2 3078 B25R3.25375 CC1CCCN(C1)CCNC(c2ccccc2)c3ccccn3 2230a_100000689936_100000766211 [0,1,0,0,0,1|1,0,0]=3 3079 B25R3.25375 CC1CCCN(C1)CCNC(c2ccccc2)c3ccccn3 270004a_100000739826_100000210380 [0,1,0,0,0,1|1,0,0]=3 3080 B25R3.25375 CC1CCCN(C1)CCNC(c2ccccc2)c3cccnc3 2230a_100011232609_100000766211 [0,1,0,0,0,1|1,0,0]=3 3081 B25R3.25375 CC1CCCN(C1)CCNC(c2ccccc2)c3cccnc3 270004a_100000739826_100000735413 [0,1,0,0,0,1|1,0,0]=3 3082 B25R3.25375 CC1CCCN(C1)CCNC(c2ccccc2)c3ccncc3 2230a_100025760769_100000766211 [0,1,0,0,0,1|1,0,0]=3 3083 B25R3.25375 CC1CCCN(C1)CCNC(c2cccnc2)c3ccccn3 270004a_100000739826_100011376182 [0,1,0,0,0,1|2,0,0]=4 3084 B25R3.25375 CC1CCCN(C1)CCNC(c2cccnc2)c3cccnc3 270004a_100000739826_200011376183 [0,1,0,0,0,1|2,0,0]=4 3085 B25R3.25375 CC1CCCN(C1)CCOC(c2ccccc2)c3ccccc3 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B25R3.25375 CN1CCCC(C1)COCC(c2ccccc2)c3ccccc3 7a_100011215272_100000752043 [0,1,0,0,0,1|2,0,0]=4 3096 B25R3.25375 C[C@@H]1CC(CCN1)NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100016994030 [0,1,0,0,0,1|2,0,0]=4 3097 B25R3.25375 C[C@H]1CCCN(C1)CCOC(c2ccccc2)c3ccccc3 2230a_100000717927_100000734929 [0,1,0,0,0,1|0,0,0]=2 3098 B25R3.25375 C[C@H]1CCCN(C1)CCOC(c2ccccc2)c3ccccc3 269982a_100000717927_100000734929 [0,1,0,0,0,1|0,0,0]=2 3099 B25R3.25375 C[C@H]1CCCN(C1)CCOC(c2ccccc2)c3ccccc3 34a_100000717927_100000734929 [0,1,0,0,0,1|0,0,0]=2 3100 B25R3.25375 FC1CCCN(C1)CCOC(c2ccccc2)c3ccccc3 2230a_100000697950_100000734929 [0,1,0,0,0,1|0,0,0]=2 3101 B25R3.25375 FC1CCCN(C1)CCOC(c2ccccc2)c3ccccc3 269982a_100000697950_100000734929 [0,1,0,0,0,1|0,0,0]=2 3102 B25R3.25375 FC1CCCN(C1)CCOC(c2ccccc2)c3ccccc3 34a_100000697950_100000734929 [0,1,0,0,0,1|0,0,0]=2 3103 B25R3.25375 O=C1CCCC(C1)OCCC(c2ccccc2)c3ccccc3 34a_100012613340_100009813428 [0,1,0,0,0,1|1,0,1]=4 3104 B25R3.25375 O=C1CN(CCN1)CCOC(c2ccccc2)c3ccccc3 2230a_100000184651_100000734929 [0,1,0,0,0,1|1,0,1]=4 3105 B25R3.25375 O=C1CN(CCO1)CCOC(c2ccccc2)c3ccccc3 2230a_100000131268_100000734929 [0,1,0,0,0,1|1,0,1]=4 3106 B25R3.25375 OC1CCCC(C1)NCCC(c2ccccc2)c3ccccc3 2230a_100015190357_100009813428 [0,1,0,0,0,1|1,0,0]=3 3107 B25R3.25375 OC1CCCC(C1)NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100012613340 [0,1,0,0,0,1|1,0,0]=3 3108 B25R3.25375 OC1CCCC(C1)NCCP(c2ccccc2)c3ccccc3 270004a_107094377242_100012613340 [0,1,0,0,0,1|2,0,0]=4 3109 B25R3.25375 OC1CCCC(C1)NCC[S+](c2ccccc2)c3ccccc3 2230a_100015190357_100010140906 [0,1,0,0,0,1|2,0,0]=4 3110 B25R3.25375 OC1CCCN(C1)CCOC(c2ccccc2)c3ccccc3 2230a_100000211013_100000734929 [0,1,0,0,0,1|0,0,0]=2 3111 B25R3.25375 OC1CCCN(C1)CCOC(c2ccccc2)c3ccccc3 269982a_100000211013_100000734929 [0,1,0,0,0,1|0,0,0]=2 3112 B25R3.25375 OC1CN(CCO1)CCOC(c2ccccc2)c3ccccc3 2230a_100000688207_100000734929 [0,1,0,0,0,1|1,0,0]=3 3113 B25R3.25375 OC1CN(CCO1)CCOC(c2ccccc2)c3ccccc3 269982a_100000688207_100000734929 [0,1,0,0,0,1|1,0,0]=3 3114 B25R3.26173 CC1CCCCC1NCCC(c2ccccc2)c3ccccc3 2230a_100000211402_100009813428 [0,1,0,0,0,1|1,0,0]=3 3115 B25R3.26173 CC1CCCCC1NCCC(c2ccccc2)c3ccccc3 269862a_100000272388_100000210921 [0,1,0,0,0,1|1,0,0]=3 3116 B25R3.26173 CC1CCCCC1NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100000210921 [0,1,0,0,0,1|1,0,0]=3 3117 B25R3.26173 CC1CCCCC1NCCC(c2ccccc2)c3ccccc3 34a_100000211402_100009813428 [0,1,0,0,0,1|1,0,0]=3 3118 B25R3.26173 CC1CCCCC1NCCP(c2ccccc2)c3ccccc3 269862a_107094377242_100000210921 [0,1,0,0,0,1|2,0,0]=4 3119 B25R3.26173 CC1CCCCC1NCCP(c2ccccc2)c3ccccc3 270004a_107094377242_100000210921 [0,1,0,0,0,1|2,0,0]=4 3120 B25R3.26173 CC1CCCCC1NCC[S+](c2ccccc2)c3ccccc3 2230a_100000211402_100010140906 [0,1,0,0,0,1|2,0,0]=4 3121 B25R3.26173 CC1CCCCC1OCCC(c2ccccc2)c3ccccc3 34a_100000211207_100009813428 [0,1,0,0,0,1|1,0,0]=3 3122 B25R3.26173 CC1CCCCC1OCCC(c2ccccc2)c3ccccc3 7a_100000211207_100009813428 [0,1,0,0,0,1|1,0,0]=3 3123 B25R3.26173 CC1CCCCC1OCC[S+](c2ccccc2)c3ccccc3 7a_100000211207_100010140906 [0,1,0,0,0,1|2,0,0]=4 3124 B25R3.26173 CC1CCCCN1CCNC(c2ccccc2)c3ccccc3 2230a_100000739827_100000211591 [0,1,0,0,0,1|0,0,0]=2 3125 B25R3.26173 CC1CCCCN1CCNC(c2ccccc2)c3ccccc3 270004a_100000739827_100000210122 [0,1,0,0,0,1|0,0,0]=2 3126 B25R3.26173 CC1CCCCN1CCNC(c2ccccc2)c3ccccn3 270004a_100000739827_100000210380 [0,1,0,0,0,1|1,0,0]=3 3127 B25R3.26173 CC1CCCCN1CCNC(c2ccccc2)c3cccnc3 270004a_100000739827_100000735413 [0,1,0,0,0,1|1,0,0]=3 3128 B25R3.26173 CC1CCCCN1CCNC(c2cccnc2)c3ccccn3 270004a_100000739827_100011376182 [0,1,0,0,0,1|2,0,0]=4 3129 B25R3.26173 CC1CCCCN1CCNC(c2cccnc2)c3cccnc3 270004a_100000739827_200011376183 [0,1,0,0,0,1|2,0,0]=4 3130 B25R3.26173 CC1CCCCN1CCOC(c2ccccc2)c3ccccc3 2230a_100000211376_100000734929 [0,1,0,0,0,1|0,0,0]=2 3131 B25R3.26173 CC1CCCCN1CCOC(c2ccccc2)c3ccccc3 269982a_100000211376_100000734929 [0,1,0,0,0,1|0,0,0]=2 3132 B25R3.26173 CC1CCCCN1CCOC(c2ccccc2)c3ccccc3 34a_100000211376_100000734929 [0,1,0,0,0,1|0,0,0]=2 3133 B25R3.26173 CC1CCNCC1OCCC(c2ccccc2)c3ccccc3 34a_100000696640_100009813428 [0,1,0,0,0,1|2,0,0]=4 3134 B25R3.26173 CC1CNCCC1NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100000703950 [0,1,0,0,0,1|2,0,0]=4 3135 B25R3.26173 CC1CNCCC1OCCC(c2ccccc2)c3ccccc3 34a_100011998114_100009813428 [0,1,0,0,0,1|2,0,0]=4 3136 B25R3.26173 CC1COCCC1NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100000755695 [0,1,0,0,0,1|2,0,0]=4 3137 B25R3.26173 CN1CCCCC1CCNC(c2ccccc2)c3ccccc3 2230a_100000162943_100000211948 [0,1,0,0,0,1|2,0,0]=4 3138 B25R3.26173 CN1CCCCC1CCNC(c2ccccc2)c3ccccc3 34a_100000162943_100000211948 [0,1,0,0,0,1|2,0,0]=4 3139 B25R3.26173 CN1CCCCC1CCOC(c2ccccc2)c3ccccc3 34a_100000211180_100000211948 [0,1,0,0,0,1|2,0,0]=4 3140 B25R3.26173 CN1CCCCC1CCOC(c2ccccc2)c3ccccc3 7a_100000211180_100000211948 [0,1,0,0,0,1|2,0,0]=4 3141 B25R3.26173 CN1CCCCC1CCSC(c2ccccc2)c3ccccc3 62a_100000211591_100000211948 [0,1,0,0,0,1|2,0,0]=4 3142 B25R3.26173 CN1CCCCC1CCSC(c2ccccc2)c3ccccc3 62a_100000211948_100011216954 [0,1,0,0,0,1|2,0,0]=4 3143 B25R3.26173 CN1CCCCC1CNCC(c2ccccc2)c3ccccc3 34a_100000739227_100015186950 [0,1,0,0,0,1|2,0,0]=4 3144 B25R3.26173 CN1CCCCC1COCC(c2ccccc2)c3ccccc3 34a_100011215272_100015186950 [0,1,0,0,0,1|2,0,0]=4 3145 B25R3.26173 CN1CCCCC1COCC(c2ccccc2)c3ccccc3 7a_100011215272_100015185383 [0,1,0,0,0,1|2,0,0]=4 3146 B25R3.26173 C[C@H]1COCCN1CCOC(c2ccccc2)c3ccccc3 2230a_100009815349_100000734929 [0,1,0,0,0,1|1,0,0]=3 3147 B25R3.26173 C[C@H]1COCCN1CCOC(c2ccccc2)c3ccccc3 269982a_100009815349_100000734929 [0,1,0,0,0,1|1,0,0]=3 3148 B25R3.26173 C[C@H]1COCCN1CCOC(c2ccccc2)c3ccccc3 34a_100009815349_100000734929 [0,1,0,0,0,1|1,0,0]=3 3149 B25R3.26173 ClC1CCCCC1OCCC(c2ccccc2)c3ccccc3 34a_100000038908_100009813428 [0,1,0,0,0,1|1,0,0]=3 3150 B25R3.26173 ClC1CCCCC1OCCC(c2ccccc2)c3ccccc3 7a_100000038908_100009813428 [0,1,0,0,0,1|1,0,0]=3 3151 B25R3.26173 ClC1CCCCC1OCC[S+](c2ccccc2)c3ccccc3 7a_100000038908_100010140906 [0,1,0,0,0,1|2,0,0]=4 3152 B25R3.26173 FC1CCCCC1NCCC(c2ccccc2)c3ccccc3 34a_100000272388_100015423560 [0,1,0,0,0,1|1,0,0]=3 3153 B25R3.26173 FC1CCCCC1NCCP(c2ccccc2)c3ccccc3 34a_107094377242_100015423560 [0,1,0,0,0,1|2,0,0]=4 3154 B25R3.26173 FC1CCCCC1OCCC(c2ccccc2)c3ccccc3 34a_100000032380_100015423560 [0,1,0,0,0,1|1,0,0]=3 3155 B25R3.26173 FC1CCCCC1OCCN(c2ccccc2)c3ccccc3 34a_100010001939_100015423560 [0,1,0,0,0,1|2,0,0]=4 3156 B25R3.26173 FC1CCCCC1SCC[S+](c2ccccc2)c3ccccc3 62a_100010140906_100015423560 [0,1,0,0,0,1|2,0,0]=4 3157 B25R3.26173 FC1CCCCC1SCC[S+](c2ccccc2)c3ccccc3 62a_100015423560_100010140906 [0,1,0,0,0,1|2,0,0]=4 3158 B25R3.26173 F[C@@H]1CCCC[C@H]1NCCC(c2ccccc2)c3ccccc3 2230a_100015195156_100009813428 [0,1,0,0,0,1|1,0,0]=3 3159 B25R3.26173 F[C@@H]1CCCC[C@H]1NCCC(c2ccccc2)c3ccccc3 34a_100015195156_100009813428 [0,1,0,0,0,1|1,0,0]=3 3160 B25R3.26173 F[C@@H]1CCCC[C@H]1NCC[S+](c2ccccc2)c3ccccc3 2230a_100015195156_100010140906 [0,1,0,0,0,1|2,0,0]=4 3161 B25R3.26173 F[C@@H]1CCCC[C@H]1OCCC(c2ccccc2)c3ccccc3 34a_100009816020_100009813428 [0,1,0,0,0,1|1,0,0]=3 3162 B25R3.26173 F[C@@H]1CCCC[C@H]1OCCC(c2ccccc2)c3ccccc3 7a_100009816020_100009813428 [0,1,0,0,0,1|1,0,0]=3 3163 B25R3.26173 F[C@@H]1CCCC[C@H]1OCC[S+](c2ccccc2)c3ccccc3 7a_100009816020_100010140906 [0,1,0,0,0,1|2,0,0]=4 3164 B25R3.26173 F[C@H]1CNCC[C@H]1OCCC(c2ccccc2)c3ccccc3 34a_200016994291_100009813428 [0,1,0,0,0,1|2,0,0]=4 3165 B25R3.26173 F[C@H]1COCC[C@@H]1NCCC(c2ccccc2)c3ccccc3 2230a_100016994078_100009813428 [0,1,0,0,0,1|2,0,0]=4 3166 B25R3.26173 F[C@H]1COCC[C@@H]1NCCC(c2ccccc2)c3ccccc3 34a_100016994078_100009813428 [0,1,0,0,0,1|2,0,0]=4 3167 B25R3.26173 N[C@@H]1CCCC[C@@H]1OCCC(c2ccccc2)c3ccccc3 34a_100015191688_100009813428 [0,1,0,0,0,1|1,0,0]=3 3168 B25R3.26173 N[C@@H]1CCOC[C@@H]1OCCC(c2ccccc2)c3ccccc3 34a_100016994285_100009813428 [0,1,0,0,0,1|2,0,0]=4 3169 B25R3.26173 N[C@H]1COCC[C@@H]1OCCC(c2ccccc2)c3ccccc3 34a_100015739063_100009813428 [0,1,0,0,0,1|2,0,0]=4 3170 B25R3.26173 O=C1CCCCC1NCCC(c2ccccc2)c3ccccc3 34a_100000272388_100000754470 [0,1,0,0,0,1|1,0,1]=4 3171 B25R3.26173 O=C1CCCCC1OCCC(c2ccccc2)c3ccccc3 34a_100000032380_100000754470 [0,1,0,0,0,1|1,0,1]=4 3172 B25R3.26173 O=C1CCCCC1OCCC(c2ccccc2)c3ccccc3 34a_100011214950_100009813428 [0,1,0,0,0,1|1,0,1]=4 3173 B25R3.26173 O=C1CCCCC1OCCC(c2ccccc2)c3ccccc3 7a_100000032380_100000204591 [0,1,0,0,0,1|1,0,1]=4 3174 B25R3.26173 O=C1CCCCC1SCCC(c2ccccc2)c3ccccc3 62a_100000204591_100009813428 [0,1,0,0,0,1|1,0,1]=4 3175 B25R3.26173 O=C1CCCCC1SCCC(c2ccccc2)c3ccccc3 62a_100009813428_100000204591 [0,1,0,0,0,1|1,0,1]=4 3176 B25R3.26173 O=C1CCCCN1CCNC(c2ccccc2)c3ccccc3 2230a_100160573077_100000211591 [0,1,0,0,0,1|0,0,1]=3 3177 B25R3.26173 O=C1CCCCN1CCNC(c2ccccc2)c3ccccc3 270004a_100160573077_100000210122 [0,1,0,0,0,1|0,0,1]=3 3178 B25R3.26173 O=C1CCCCN1CCNC(c2ccccc2)c3ccccn3 270004a_100160573077_100000210380 [0,1,0,0,0,1|1,0,1]=4 3179 B25R3.26173 O=C1CCCCN1CCNC(c2ccccc2)c3cccnc3 270004a_100160573077_100000735413 [0,1,0,0,0,1|1,0,1]=4 3180 B25R3.26173 OC1CCCCC1NCCC(c2ccccc2)c3ccccc3 34a_100000272388_100000038908 [0,1,0,0,0,1|1,0,0]=3 3181 B25R3.26173 OC1CCCCC1NCCP(c2ccccc2)c3ccccc3 34a_107094377242_100000038908 [0,1,0,0,0,1|2,0,0]=4 3182 B25R3.26173 OC1CCCCC1OCCC(c2ccccc2)c3ccccc3 34a_100000032380_100000038908 [0,1,0,0,0,1|1,0,0]=3 3183 B25R3.26173 OC1CCCCC1OCCN(c2ccccc2)c3ccccc3 34a_100010001939_100000038908 [0,1,0,0,0,1|2,0,0]=4 3184 B25R3.26173 OC1CCCCC1SCCC(c2ccccc2)c3ccccc3 62a_100000038908_100009813428 [0,1,0,0,0,1|1,0,0]=3 3185 B25R3.26173 OC1CCCCC1SCCC(c2ccccc2)c3ccccc3 62a_100009813428_100000038908 [0,1,0,0,0,1|1,0,0]=3 3186 B25R3.26173 OC1CCCCC1SCC[S+](c2ccccc2)c3ccccc3 62a_100000038908_100010140906 [0,1,0,0,0,1|2,0,0]=4 3187 B25R3.26173 OC1CCCCC1SCC[S+](c2ccccc2)c3ccccc3 62a_100010140906_100000038908 [0,1,0,0,0,1|2,0,0]=4 3188 B25R3.26173 O[C@H]1CCOC[C@@H]1NCCC(c2ccccc2)c3ccccc3 2230a_100015739063_100009813428 [0,1,0,0,0,1|2,0,0]=4 3189 B25R3.26173 O[C@H]1COCC[C@H]1NCCC(c2ccccc2)c3ccccc3 2230a_100016994285_100009813428 [0,1,0,0,0,1|2,0,0]=4 3190 B25R3.61794 Brc1ccccc1C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_100011532686 [0,1,0,0,0,1|2,0,0]=4 3191 B25R3.61794 Brc1ccccc1C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100000198044 [0,1,0,0,0,1|2,0,0]=4 3192 B25R3.61794 Brc1ccccc1C(NCCC2CCOCC2)c3ccccc3 2230a_100011211563_100011934994 [0,1,0,0,0,1|2,0,0]=4 3193 B25R3.61794 Brc1ccccc1C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100000198044 [0,1,0,0,0,1|2,0,0]=4 3194 B25R3.61794 Brc1ccccc1C(NCCC2CCOCC2)c3ccccc3 34a_100011211563_100011934994 [0,1,0,0,0,1|2,0,0]=4 3195 B25R3.61794 Brc1ccccc1C(NCCN2CCCCC2)c3ccccc3 2230a_100011211563_100000739454 [0,1,0,0,0,1|0,0,0]=2 3196 B25R3.61794 Brc1ccccc1C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100000198044 [0,1,0,0,0,1|0,0,0]=2 3197 B25R3.61794 Brc1ccccc1C(NCCN2CCCCC2)c3ccccc3 34a_100011211563_100000739454 [0,1,0,0,0,1|0,0,0]=2 3198 B25R3.61794 Brc1ccccc1C(NCCN2CCCCC2)c3cccnc3 270004a_100000216509_100011532686 [0,1,0,0,0,1|1,0,0]=3 3199 B25R3.61794 Brc1ccccc1C(NCCN2CCOCC2)c3ccccc3 2230a_100011211563_100025781966 [0,1,0,0,0,1|1,0,0]=3 3200 B25R3.61794 Brc1ccccc1C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100000198044 [0,1,0,0,0,1|1,0,0]=3 3201 B25R3.61794 Brc1ccccc1C(NCCN2CCOCC2)c3cccnc3 270004a_100000211067_100011532686 [0,1,0,0,0,1|2,0,0]=4 3202 B25R3.61794 Brc1ccccc1C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100000198044 [0,1,0,0,0,1|1,0,0]=3 3203 B25R3.61794 Brc1ccccc1C(NCCN2CCSCC2)c3cccnc3 270004a_100000755026_100011532686 [0,1,0,0,0,1|2,0,0]=4 3204 B25R3.61794 Brc1ccccc1C(NCOC2CCCCC2)c3ccccc3 2230a_100011211563_100011935260 [0,1,0,0,0,1|2,0,0]=4 3205 B25R3.61794 Brc1ccccc1C(NCOC2CCCCC2)c3ccccc3 34a_100011211563_100011935260 [0,1,0,0,0,1|2,0,0]=4 3206 B25R3.61794 Cc1ccccc1C(NCCC2=CCCCC2)c3ccccc3 2230a_100000212019_100000230135 [0,1,0,0,0,1|1,0,1]=4 3207 B25R3.61794 Cc1ccccc1C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100000735561 [0,1,0,0,0,1|1,0,1]=4 3208 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccccc3 2230a_100000222801_100012355289 [0,1,0,0,0,1|1,0,0]=3 3209 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccccc3 2230a_100000738074_100000230135 [0,1,0,0,0,1|1,0,0]=3 3210 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccccc3 270004a_100000222801_100011713444 [0,1,0,0,0,1|1,0,0]=3 3211 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100000735561 [0,1,0,0,0,1|1,0,0]=3 3212 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccccc3 34a_100000222801_100011209188 [0,1,0,0,0,1|1,0,0]=3 3213 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccncc3 2230a_100015184055_100012355289 [0,1,0,0,0,1|2,0,0]=4 3214 B25R3.61794 Cc1ccccc1C(NCCC2CCCCC2)c3ccncc3 270004a_100015184055_100011713444 [0,1,0,0,0,1|2,0,0]=4 3215 B25R3.61794 Cc1ccccc1C(NCCC2CCCCO2)c3ccccc3 2230a_100015183643_100000230135 [0,1,0,0,0,1|2,0,0]=4 3216 B25R3.61794 Cc1ccccc1C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100000735561 [0,1,0,0,0,1|2,0,0]=4 3217 B25R3.61794 Cc1ccccc1C(NCCC2CCOCC2)c3ccccc3 2230a_100000222801_100011934994 [0,1,0,0,0,1|2,0,0]=4 3218 B25R3.61794 Cc1ccccc1C(NCCC2CCOCC2)c3ccccc3 2230a_100000755988_100000230135 [0,1,0,0,0,1|2,0,0]=4 3219 B25R3.61794 Cc1ccccc1C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100000735561 [0,1,0,0,0,1|2,0,0]=4 3220 B25R3.61794 Cc1ccccc1C(NCCC2CCOCC2)c3ccccc3 34a_100000222801_100011934994 [0,1,0,0,0,1|2,0,0]=4 3221 B25R3.61794 Cc1ccccc1C(NCCN2CCCCC2)c3ccccc3 2230a_100000222801_100000739454 [0,1,0,0,0,1|0,0,0]=2 3222 B25R3.61794 Cc1ccccc1C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100000735561 [0,1,0,0,0,1|0,0,0]=2 3223 B25R3.61794 Cc1ccccc1C(NCCN2CCCCC2)c3ccccc3 34a_100000222801_100000739454 [0,1,0,0,0,1|0,0,0]=2 3224 B25R3.61794 Cc1ccccc1C(NCCN2CCCCC2)c3ccncc3 2230a_100015184055_100000739454 [0,1,0,0,0,1|1,0,0]=3 3225 B25R3.61794 Cc1ccccc1C(NCCN2CCOCC2)c3ccccc3 2230a_100000222801_100025781966 [0,1,0,0,0,1|1,0,0]=3 3226 B25R3.61794 Cc1ccccc1C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100000735561 [0,1,0,0,0,1|1,0,0]=3 3227 B25R3.61794 Cc1ccccc1C(NCCN2CCOCC2)c3ccncc3 2230a_100015184055_100025781966 [0,1,0,0,0,1|2,0,0]=4 3228 B25R3.61794 Cc1ccccc1C(NCCN2CCSCC2)c3ccccc3 2230a_100000755026_100000230135 [0,1,0,0,0,1|1,0,0]=3 3229 B25R3.61794 Cc1ccccc1C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100000735561 [0,1,0,0,0,1|1,0,0]=3 3230 B25R3.61794 Cc1ccccc1C(NCOC2CCCCC2)c3ccccc3 2230a_100000222801_100011935260 [0,1,0,0,0,1|2,0,0]=4 3231 B25R3.61794 Cc1ccccc1C(NCOC2CCCCC2)c3ccccc3 34a_100000222801_100011935260 [0,1,0,0,0,1|2,0,0]=4 3232 B25R3.61794 Cc1ccccc1C(OCCC2CCOCC2)c3ccccc3 34a_100000212071_100011934994 [0,1,0,0,0,1|2,0,0]=4 3233 B25R3.61794 Cc1ccccc1C(OCCC2CCOCC2)c3ccccc3 7a_100000212071_100011934994 [0,1,0,0,0,1|2,0,0]=4 3234 B25R3.61794 Cc1ccccc1C(OCCC2CCOCC2)c3ccccc3 7a_100011933979_100000230135 [0,1,0,0,0,1|2,0,0]=4 3235 B25R3.61794 Cc1ccccc1C(OCCN2CCCCC2)c3ccccc3 34a_100000212071_100000739454 [0,1,0,0,0,1|0,0,0]=2 3236 B25R3.61794 Cc1ccccc1C(OCCN2CCCCC2)c3ccccc3 7a_100000212071_100000739454 [0,1,0,0,0,1|0,0,0]=2 3237 B25R3.61794 Cc1ccccc1C(OCCN2CCOCC2)c3ccccc3 7a_100000212071_100000211760 [0,1,0,0,0,1|1,0,0]=3 3238 B25R3.61794 Cc1ccccc1C(OCCN2CCSCC2)c3ccccc3 7a_100000686052_100000230135 [0,1,0,0,0,1|1,0,0]=3 3239 B25R3.61794 Cc1ccccc1C(OCOC2CCCCC2)c3ccccc3 34a_100000212071_100011935260 [0,1,0,0,0,1|2,0,0]=4 3240 B25R3.61794 Cc1ccccc1C(OCOC2CCCCC2)c3ccccc3 7a_100000212071_100011935260 [0,1,0,0,0,1|2,0,0]=4 3241 B25R3.61794 Cc1ccccc1C(SCCC2CCOCC2)c3ccccc3 62a_100000230135_100011934994 [0,1,0,0,0,1|2,0,0]=4 3242 B25R3.61794 Cc1ccccc1C(SCCC2CCOCC2)c3ccccc3 62a_100011934994_100000230135 [0,1,0,0,0,1|2,0,0]=4 3243 B25R3.61794 Cc1ccccc1C(SCCN2CCCCC2)c3ccccc3 62a_100000230135_100000739454 [0,1,0,0,0,1|0,0,0]=2 3244 B25R3.61794 Cc1ccccc1C(SCCN2CCCCC2)c3ccccc3 62a_100000739454_100000230135 [0,1,0,0,0,1|0,0,0]=2 3245 B25R3.61794 Cc1ccccc1C(SCCN2CCOCC2)c3ccccc3 62a_100000230135_100000211760 [0,1,0,0,0,1|1,0,0]=3 3246 B25R3.61794 Clc1ccccc1C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100011215288 [0,1,0,0,0,1|1,0,1]=4 3247 B25R3.61794 Clc1ccccc1C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100011215288 [0,1,0,0,0,1|1,0,0]=3 3248 B25R3.61794 Clc1ccccc1C(NCCC2CCCCC2)c3ccccn3 270004a_100000738074_100011400554 [0,1,0,0,0,1|2,0,0]=4 3249 B25R3.61794 Clc1ccccc1C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_200011400555 [0,1,0,0,0,1|2,0,0]=4 3250 B25R3.61794 Clc1ccccc1C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100011215288 [0,1,0,0,0,1|2,0,0]=4 3251 B25R3.61794 Clc1ccccc1C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100011215288 [0,1,0,0,0,1|2,0,0]=4 3252 B25R3.61794 Clc1ccccc1C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100011215288 [0,1,0,0,0,1|0,0,0]=2 3253 B25R3.61794 Clc1ccccc1C(NCCN2CCCCC2)c3ccccn3 270004a_100000216509_100011400554 [0,1,0,0,0,1|1,0,0]=3 3254 B25R3.61794 Clc1ccccc1C(NCCN2CCCCC2)c3cccnc3 270004a_100000216509_200011400555 [0,1,0,0,0,1|1,0,0]=3 3255 B25R3.61794 Clc1ccccc1C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100011215288 [0,1,0,0,0,1|1,0,0]=3 3256 B25R3.61794 Clc1ccccc1C(NCCN2CCOCC2)c3ccccn3 270004a_100000211067_100011400554 [0,1,0,0,0,1|2,0,0]=4 3257 B25R3.61794 Clc1ccccc1C(NCCN2CCOCC2)c3cccnc3 270004a_100000211067_200011400555 [0,1,0,0,0,1|2,0,0]=4 3258 B25R3.61794 Clc1ccccc1C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100011215288 [0,1,0,0,0,1|1,0,0]=3 3259 B25R3.61794 Clc1ccccc1C(NCCN2CCSCC2)c3ccccn3 270004a_100000755026_100011400554 [0,1,0,0,0,1|2,0,0]=4 3260 B25R3.61794 Clc1ccccc1C(NCCN2CCSCC2)c3cccnc3 270004a_100000755026_200011400555 [0,1,0,0,0,1|2,0,0]=4 3261 B25R3.61794 Clc1ccccc1C(OCCC2CCOCC2)c3ccccc3 34a_200011400577_100011934994 [0,1,0,0,0,1|2,0,0]=4 3262 B25R3.61794 Clc1ccccc1C(OCCC2CCOCC2)c3ccccc3 7a_200011400577_100011934994 [0,1,0,0,0,1|2,0,0]=4 3263 B25R3.61794 Clc1ccccc1C(OCCN2CCCCC2)c3ccccc3 34a_200011400577_100000739454 [0,1,0,0,0,1|0,0,0]=2 3264 B25R3.61794 Clc1ccccc1C(OCCN2CCCCC2)c3ccccc3 7a_200011400577_100000739454 [0,1,0,0,0,1|0,0,0]=2 3265 B25R3.61794 Clc1ccccc1C(OCCN2CCOCC2)c3ccccc3 7a_200011400577_100000211760 [0,1,0,0,0,1|1,0,0]=3 3266 B25R3.61794 Clc1ccccc1C(OCOC2CCCCC2)c3ccccc3 34a_200011400577_100011935260 [0,1,0,0,0,1|2,0,0]=4 3267 B25R3.61794 Clc1ccccc1C(OCOC2CCCCC2)c3ccccc3 7a_200011400577_100011935260 [0,1,0,0,0,1|2,0,0]=4 3268 B25R3.61794 Fc1ccccc1C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100011217773 [0,1,0,0,0,1|1,0,1]=4 3269 B25R3.61794 Fc1ccccc1C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100011217773 [0,1,0,0,0,1|1,0,0]=3 3270 B25R3.61794 Fc1ccccc1C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100011217773 [0,1,0,0,0,1|2,0,0]=4 3271 B25R3.61794 Fc1ccccc1C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100011217773 [0,1,0,0,0,1|2,0,0]=4 3272 B25R3.61794 Fc1ccccc1C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100011217773 [0,1,0,0,0,1|0,0,0]=2 3273 B25R3.61794 Fc1ccccc1C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100011217773 [0,1,0,0,0,1|1,0,0]=3 3274 B25R3.61794 Fc1ccccc1C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100011217773 [0,1,0,0,0,1|1,0,0]=3 3275 B25R3.61794 Nc1ccccc1C(OCCC2CCCCC2)c3ccccc3 34a_100000246470_100011209188 [0,1,0,0,0,1|1,0,0]=3 3276 B25R3.61794 Nc1ccccc1C(OCCC2CCCCC2)c3ccccc3 7a_100000246470_100011273959 [0,1,0,0,0,1|1,0,0]=3 3277 B25R3.61794 Nc1ccccc1C(OCCC2CCOCC2)c3ccccc3 34a_100000246470_100011934994 [0,1,0,0,0,1|2,0,0]=4 3278 B25R3.61794 Nc1ccccc1C(OCCC2CCOCC2)c3ccccc3 7a_100000246470_100011934994 [0,1,0,0,0,1|2,0,0]=4 3279 B25R3.61794 Nc1ccccc1C(OCCN2CCCCC2)c3ccccc3 34a_100000246470_100000739454 [0,1,0,0,0,1|0,0,0]=2 3280 B25R3.61794 Nc1ccccc1C(OCCN2CCCCC2)c3ccccc3 7a_100000246470_100000739454 [0,1,0,0,0,1|0,0,0]=2 3281 B25R3.61794 Nc1ccccc1C(OCCN2CCOCC2)c3ccccc3 7a_100000246470_100000211760 [0,1,0,0,0,1|1,0,0]=3 3282 B25R3.61794 Nc1ccccc1C(OCOC2CCCCC2)c3ccccc3 34a_100000246470_100011935260 [0,1,0,0,0,1|2,0,0]=4 3283 B25R3.61794 Nc1ccccc1C(OCOC2CCCCC2)c3ccccc3 7a_100000246470_100011935260 [0,1,0,0,0,1|2,0,0]=4 3284 B25R3.82807 CC(CC(c1ccccc1)c2ccccc2)NC3CCCCC3 270004a_100000182618_200000011111 [0,1,0,0,0,1|1,0,0]=3 3285 B25R3.82807 CC(CC(c1ccccc1)c2ccccc2)NC3CCCOC3 270004a_100000719290_200000011111 [0,1,0,0,0,1|2,0,0]=4 3286 B25R3.82807 CC(CC(c1ccccc1)c2ccccc2)NC3CCOCC3 270004a_100000741149_200000011111 [0,1,0,0,0,1|2,0,0]=4 3287 B25R3.82807 CC(CC(c1ccccc1)c2ccccc2)NC3CCSCC3 270004a_100000748639_200000011111 [0,1,0,0,0,1|2,0,0]=4 3288 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3ccccc3 270004a_100000162943_100011215996 [0,1,0,0,0,1|1,0,0]=3 3289 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3ccccn3 270004a_100000689936_100011215996 [0,1,0,0,0,1|2,0,0]=4 3290 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3cccnc3 270004a_100011232609_100011215996 [0,1,0,0,0,1|2,0,0]=4 3291 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3ccncc3 270004a_100025760769_100011215996 [0,1,0,0,0,1|2,0,0]=4 3292 B25R3.82807 CC(CN1CCCCC1)NC(c2ccccc2)c3ccccc3 2230a_100000738326_100000211591 [0,1,0,0,0,1|0,0,0]=2 3293 B25R3.82807 CC(CN1CCCCC1)NC(c2ccccc2)c3ccccc3 270004a_100000738326_100000210122 [0,1,0,0,0,1|0,0,0]=2 3294 B25R3.82807 CC(CN1CCCCC1)NC(c2ccccc2)c3ccccn3 270004a_100000738326_100000210380 [0,1,0,0,0,1|1,0,0]=3 3295 B25R3.82807 CC(CN1CCCCC1)NC(c2ccccc2)c3cccnc3 270004a_100000738326_100000735413 [0,1,0,0,0,1|1,0,0]=3 3296 B25R3.82807 CC(CN1CCCCC1)NC(c2cccnc2)c3ccccn3 270004a_100000738326_100011376182 [0,1,0,0,0,1|2,0,0]=4 3297 B25R3.82807 CC(CN1CCCCC1)NC(c2cccnc2)c3cccnc3 270004a_100000738326_200011376183 [0,1,0,0,0,1|2,0,0]=4 3298 B25R3.82807 CC(CN1CCCCC1)SC(c2ccccc2)c3ccccc3 62a_100000211591_100009831500 [0,1,0,0,0,1|0,0,0]=2 3299 B25R3.82807 CC(CN1CCCCC1)SC(c2ccccc2)c3ccccc3 62a_100009831500_100011216954 [0,1,0,0,0,1|0,0,0]=2 3300 B25R3.82807 CC(CN1CCOCC1)NC(c2ccccc2)c3ccccc3 2230a_100000739823_100000211591 [0,1,0,0,0,1|1,0,0]=3 3301 B25R3.82807 CC(CN1CCOCC1)NC(c2ccccc2)c3ccccc3 270004a_100000739823_100000210122 [0,1,0,0,0,1|1,0,0]=3 3302 B25R3.82807 CC(CN1CCOCC1)NC(c2ccccc2)c3ccccn3 270004a_100000739823_100000210380 [0,1,0,0,0,1|2,0,0]=4 3303 B25R3.82807 CC(CN1CCOCC1)NC(c2ccccc2)c3cccnc3 270004a_100000739823_100000735413 [0,1,0,0,0,1|2,0,0]=4 3304 B25R3.82807 O=C(CC(c1ccccc1)c2ccccc2)NC3CCCCC3 11a_100000182618_100000499737 [0,1,0,0,0,1|1,0,1]=4 3305 B25R3.82807 O=C(CC(c1ccccc1)c2ccccc2)NC3CCCCC3 1626a_100000182618_100000499737 [0,1,0,0,0,1|1,0,1]=4 3306 B25R3.82807 O=C(CC(c1ccccc1)c2ccccc2)NC3CCCCC3 240690a_100000182618_100000499737 [0,1,0,0,0,1|1,0,1]=4 3307 B25R3.82807 O=C(CC(c1ccccc1)c2ccccc2)NC3CCCCC3 527a_100000182618_100000499737 [0,1,0,0,0,1|1,0,1]=4 3308 B25R3.82807 O=C(CC1CCCCC1)CC(c2ccccc2)c3ccccc3 1458a_100000499737_100000211423 [0,1,0,0,0,1|1,0,0]=3 3309 B25R3.82807 O=C(CC1CCCCC1)CP(c2ccccc2)c3ccccc3 1458a_200020607205_100000211423 [0,1,0,0,0,1|2,0,0]=4 3310 B25R3.82807 O=C(CC1CCCCC1)NC(c2ccccc2)c3ccccc3 11a_100000162943_100000211666 [0,1,0,0,0,1|1,0,1]=4 3311 B25R3.82807 O=C(CC1CCCCC1)NC(c2ccccc2)c3ccccc3 1626a_100000162943_100000211666 [0,1,0,0,0,1|1,0,1]=4 3312 B25R3.82807 O=C(CC1CCCCC1)NC(c2ccccc2)c3ccccc3 240690a_100000162943_100000211666 [0,1,0,0,0,1|1,0,1]=4 3313 B25R3.82807 O=C(CC1CCCCC1)NC(c2ccccc2)c3ccccc3 527a_100000162943_100000211666 [0,1,0,0,0,1|1,0,1]=4 3314 B25R3.82807 O=C(CC1CCCCO1)CC(c2ccccc2)c3ccccc3 1458a_100000499737_100000211543 [0,1,0,0,0,1|2,0,0]=4 3315 B25R3.82807 O=C(CC1CCCOC1)CC(c2ccccc2)c3ccccc3 1458a_100000499737_100000741521 [0,1,0,0,0,1|2,0,0]=4 3316 B25R3.82807 O=C(CC1CCOCC1)CC(c2ccccc2)c3ccccc3 1458a_100000499737_100000754603 [0,1,0,0,0,1|2,0,0]=4 3317 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3ccccc3 11a_100000162943_100000740322 [0,1,0,0,0,1|0,0,1]=3 3318 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3ccccc3 240690a_100000162943_100000740322 [0,1,0,0,0,1|0,0,1]=3 3319 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3ccccc3 527a_100000162943_100000740322 [0,1,0,0,0,1|0,0,1]=3 3320 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3ccccn3 11a_100000689936_100000740322 [0,1,0,0,0,1|1,0,1]=4 3321 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3ccccn3 240690a_100000689936_100000740322 [0,1,0,0,0,1|1,0,1]=4 3322 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3ccccn3 527a_100000689936_100000740322 [0,1,0,0,0,1|1,0,1]=4 3323 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3cccnc3 11a_100011232609_100000740322 [0,1,0,0,0,1|1,0,1]=4 3324 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3cccnc3 240690a_100011232609_100000740322 [0,1,0,0,0,1|1,0,1]=4 3325 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3cccnc3 527a_100011232609_100000740322 [0,1,0,0,0,1|1,0,1]=4 3326 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3ccncc3 11a_100025760769_100000740322 [0,1,0,0,0,1|1,0,1]=4 3327 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3ccncc3 240690a_100025760769_100000740322 [0,1,0,0,0,1|1,0,1]=4 3328 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3ccncc3 527a_100025760769_100000740322 [0,1,0,0,0,1|1,0,1]=4 3329 B25R3.82807 O=C(CN1CCOCC1)NC(c2ccccc2)c3ccccc3 11a_100000162943_100000740321 [0,1,0,0,0,1|1,0,1]=4 3330 B25R3.82807 O=C(CN1CCOCC1)NC(c2ccccc2)c3ccccc3 240690a_100000162943_100000740321 [0,1,0,0,0,1|1,0,1]=4 3331 B25R3.82807 O=C(CN1CCOCC1)NC(c2ccccc2)c3ccccc3 527a_100000162943_100000740321 [0,1,0,0,0,1|1,0,1]=4 3332 B25R3.114844 C=C1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100010272673 [0,1,0,0,0,1|1,0,1]=4 3333 B25R3.114844 C=C1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 2230a_100000752442_100000734929 [0,1,0,0,0,1|0,0,1]=3 3334 B25R3.114844 C=C1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 269982a_100000752442_100000734929 [0,1,0,0,0,1|0,0,1]=3 3335 B25R3.114844 C=C1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 34a_100000752442_100000734929 [0,1,0,0,0,1|0,0,1]=3 3336 B25R3.114844 CC1=CCN(CC1)CCOC(c2ccccc2)c3ccccc3 2230a_100000693516_100000734929 [0,1,0,0,0,1|0,0,2]=4 3337 B25R3.114844 CC1=CCN(CC1)CCOC(c2ccccc2)c3ccccc3 269982a_100000693516_100000734929 [0,1,0,0,0,1|0,0,2]=4 3338 B25R3.114844 CC1=CCN(CC1)CCOC(c2ccccc2)c3ccccc3 34a_100000693516_100000734929 [0,1,0,0,0,1|0,0,2]=4 3339 B25R3.114844 CC1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100000185489 [0,1,0,0,0,1|1,0,0]=3 3340 B25R3.114844 CC1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 34a_100000272388_200011216234 [0,1,0,0,0,1|1,0,0]=3 3341 B25R3.114844 CC1CCC(CC1)NCCP(c2ccccc2)c3ccccc3 270004a_107094377242_100000185489 [0,1,0,0,0,1|2,0,0]=4 3342 B25R3.114844 CC1CCC(CC1)NCCP(c2ccccc2)c3ccccc3 34a_107094377242_200011216234 [0,1,0,0,0,1|2,0,0]=4 3343 B25R3.114844 CC1CCC(CC1)OCCC(c2ccccc2)c3ccccc3 34a_100000032380_200011216234 [0,1,0,0,0,1|1,0,0]=3 3344 B25R3.114844 CC1CCC(CC1)OCCC(c2ccccc2)c3ccccc3 34a_100000210714_100009813428 [0,1,0,0,0,1|1,0,0]=3 3345 B25R3.114844 CC1CCC(CC1)OCCC(c2ccccc2)c3ccccc3 7a_100000210714_100009813428 [0,1,0,0,0,1|1,0,0]=3 3346 B25R3.114844 CC1CCC(CC1)OCCN(c2ccccc2)c3ccccc3 34a_100010001939_200011216234 [0,1,0,0,0,1|2,0,0]=4 3347 B25R3.114844 CC1CCC(CC1)OCC[S+](c2ccccc2)c3ccccc3 7a_100000210714_100010140906 [0,1,0,0,0,1|2,0,0]=4 3348 B25R3.114844 CC1CCN(CC1)CCNC(c2ccccc2)c3ccccc3 270004a_100000739677_100000210122 [0,1,0,0,0,1|0,0,0]=2 3349 B25R3.114844 CC1CCN(CC1)CCNC(c2ccccc2)c3ccccn3 270004a_100000739677_100000210380 [0,1,0,0,0,1|1,0,0]=3 3350 B25R3.114844 CC1CCN(CC1)CCNC(c2ccccc2)c3cccnc3 270004a_100000739677_100000735413 [0,1,0,0,0,1|1,0,0]=3 3351 B25R3.114844 CC1CCN(CC1)CCNC(c2cccnc2)c3ccccn3 270004a_100000739677_100011376182 [0,1,0,0,0,1|2,0,0]=4 3352 B25R3.114844 CC1CCN(CC1)CCNC(c2cccnc2)c3cccnc3 270004a_100000739677_200011376183 [0,1,0,0,0,1|2,0,0]=4 3353 B25R3.114844 CC1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 2230a_100000188429_100000734929 [0,1,0,0,0,1|0,0,0]=2 3354 B25R3.114844 CC1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 269982a_100000188429_100000734929 [0,1,0,0,0,1|0,0,0]=2 3355 B25R3.114844 CC1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 34a_100000188429_100000734929 [0,1,0,0,0,1|0,0,0]=2 3356 B25R3.114844 CN1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100000210137 [0,1,0,0,0,1|2,0,0]=4 3357 B25R3.114844 CN1CCC(CC1)SCCC(c2ccccc2)c3ccccc3 62a_100009813428_100011215917 [0,1,0,0,0,1|2,0,0]=4 3358 B25R3.114844 CN1CCN(CC1)CCNC(c2ccccc2)c3ccccc3 270004a_100000234785_100000210122 [0,1,0,0,0,1|1,0,0]=3 3359 B25R3.114844 CN1CCN(CC1)CCNC(c2ccccc2)c3ccccn3 270004a_100000234785_100000210380 [0,1,0,0,0,1|2,0,0]=4 3360 B25R3.114844 CN1CCN(CC1)CCNC(c2ccccc2)c3cccnc3 270004a_100000234785_100000735413 [0,1,0,0,0,1|2,0,0]=4 3361 B25R3.114844 CN1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 2230a_100000188432_100000734929 [0,1,0,0,0,1|1,0,0]=3 3362 B25R3.114844 CN1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 269982a_100000188432_100000734929 [0,1,0,0,0,1|1,0,0]=3 3363 B25R3.114844 CN1CCN(CC1)CCSC(c2ccccc2)c3ccccc3 62a_100000211591_100000694902 [0,1,0,0,0,1|1,0,0]=3 3364 B25R3.114844 C[C@H]1CC[C@@H](CC1)NCCC(c2ccccc2)c3ccccc3 2230a_100020625639_100009813428 [0,1,0,0,0,1|1,0,0]=3 3365 B25R3.114844 C[C@H]1CC[C@@H](CC1)NCCC(c2ccccc2)c3ccccc3 34a_100020625639_100009813428 [0,1,0,0,0,1|1,0,0]=3 3366 B25R3.114844 C[C@H]1CC[C@@H](CC1)NCC[S+](c2ccccc2)c3ccccc3 2230a_100020625639_100010140906 [0,1,0,0,0,1|2,0,0]=4 3367 B25R3.114844 FC1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 2230a_100015193889_100000734929 [0,1,0,0,0,1|0,0,0]=2 3368 B25R3.114844 FC1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 269982a_100015193889_100000734929 [0,1,0,0,0,1|0,0,0]=2 3369 B25R3.114844 FC1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 34a_100015193889_100000734929 [0,1,0,0,0,1|0,0,0]=2 3370 B25R3.114844 N[C@H]1CC[C@H](CC1)OCCC(c2ccccc2)c3ccccc3 34a_100020628982_100009813428 [0,1,0,0,0,1|1,0,0]=3 3371 B25R3.114844 O=C1CCC(CC1)OCCC(c2ccccc2)c3ccccc3 34a_100000764474_100009813428 [0,1,0,0,0,1|1,0,1]=4 3372 B25R3.114844 O=C1CCC(CC1)OCCC(c2ccccc2)c3ccccc3 7a_100000764474_100009813428 [0,1,0,0,0,1|1,0,1]=4 3373 B25R3.114844 O=S1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 2230a_100000752083_100000734929 [0,1,0,0,0,1|1,0,0]=3 3374 B25R3.114844 O=S1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 269982a_100000752083_100000734929 [0,1,0,0,0,1|1,0,0]=3 3375 B25R3.114844 OC1CCC(CC1)CCNC(c2ccccc2)c3ccccc3 270004a_200011935226_100000210122 [0,1,0,0,0,1|1,0,0]=3 3376 B25R3.114844 OC1CCC(CC1)CCNC(c2ccccc2)c3ccccn3 270004a_200011935226_100000210380 [0,1,0,0,0,1|2,0,0]=4 3377 B25R3.114844 OC1CCC(CC1)CCNC(c2ccccc2)c3cccnc3 270004a_200011935226_100000735413 [0,1,0,0,0,1|2,0,0]=4 3378 B25R3.114844 OC1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 270004a_100000272388_100000764474 [0,1,0,0,0,1|1,0,0]=3 3379 B25R3.114844 OC1CCC(CC1)NCCP(c2ccccc2)c3ccccc3 270004a_107094377242_100000764474 [0,1,0,0,0,1|2,0,0]=4 3380 B25R3.114844 OC1CCN(CC1)CCNC(c2ccccc2)c3ccccc3 270004a_100020666255_100000210122 [0,1,0,0,0,1|0,0,0]=2 3381 B25R3.114844 OC1CCN(CC1)CCNC(c2ccccc2)c3ccccn3 270004a_100020666255_100000210380 [0,1,0,0,0,1|1,0,0]=3 3382 B25R3.114844 OC1CCN(CC1)CCNC(c2ccccc2)c3cccnc3 270004a_100020666255_100000735413 [0,1,0,0,0,1|1,0,0]=3 3383 B25R3.114844 OC1CCN(CC1)CCNC(c2cccnc2)c3ccccn3 270004a_100020666255_100011376182 [0,1,0,0,0,1|2,0,0]=4 3384 B25R3.114844 OC1CCN(CC1)CCNC(c2cccnc2)c3cccnc3 270004a_100020666255_200011376183 [0,1,0,0,0,1|2,0,0]=4 3385 B25R3.114844 OC1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 2230a_100025773856_100000734929 [0,1,0,0,0,1|0,0,0]=2 3386 B25R3.114844 OC1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 269982a_100025773856_100000734929 [0,1,0,0,0,1|0,0,0]=2 3387 B25R3.121526 Brc1ccc(cc1)C(NCCC2CCCCC2)c3ccccn3 270004a_100000738074_200010179208 [0,1,0,0,0,1|2,0,0]=4 3388 B25R3.121526 Brc1ccc(cc1)C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_100000753996 [0,1,0,0,0,1|2,0,0]=4 3389 B25R3.121526 Brc1ccc(cc1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100000718703 [0,1,0,0,0,1|2,0,0]=4 3390 B25R3.121526 Brc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 2230a_100000745999_100011934994 [0,1,0,0,0,1|2,0,0]=4 3391 B25R3.121526 Brc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100000718703 [0,1,0,0,0,1|2,0,0]=4 3392 B25R3.121526 Brc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 34a_100000745999_100011934994 [0,1,0,0,0,1|2,0,0]=4 3393 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 2230a_100000745999_100000739454 [0,1,0,0,0,1|0,0,0]=2 3394 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100000718703 [0,1,0,0,0,1|0,0,0]=2 3395 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 34a_100000745999_100000739454 [0,1,0,0,0,1|0,0,0]=2 3396 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCCCC2)c3ccccn3 270004a_100000216509_200010179208 [0,1,0,0,0,1|1,0,0]=3 3397 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCCCC2)c3cccnc3 270004a_100000216509_100000753996 [0,1,0,0,0,1|1,0,0]=3 3398 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCOCC2)c3ccccc3 2230a_100000745999_100025781966 [0,1,0,0,0,1|1,0,0]=3 3399 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100000718703 [0,1,0,0,0,1|1,0,0]=3 3400 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCOCC2)c3ccccn3 270004a_100000211067_200010179208 [0,1,0,0,0,1|2,0,0]=4 3401 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCOCC2)c3cccnc3 270004a_100000211067_100000753996 [0,1,0,0,0,1|2,0,0]=4 3402 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100000718703 [0,1,0,0,0,1|1,0,0]=3 3403 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCSCC2)c3ccccn3 270004a_100000755026_200010179208 [0,1,0,0,0,1|2,0,0]=4 3404 B25R3.121526 Brc1ccc(cc1)C(NCCN2CCSCC2)c3cccnc3 270004a_100000755026_100000753996 [0,1,0,0,0,1|2,0,0]=4 3405 B25R3.121526 Brc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 2230a_100000745999_100011935260 [0,1,0,0,0,1|2,0,0]=4 3406 B25R3.121526 Brc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 34a_100000745999_100011935260 [0,1,0,0,0,1|2,0,0]=4 3407 B25R3.121526 Brc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 34a_100011217567_100011934994 [0,1,0,0,0,1|2,0,0]=4 3408 B25R3.121526 Brc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_100011217567_100011934994 [0,1,0,0,0,1|2,0,0]=4 3409 B25R3.121526 Brc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 34a_100011217567_100000739454 [0,1,0,0,0,1|0,0,0]=2 3410 B25R3.121526 Brc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 7a_100011217567_100000739454 [0,1,0,0,0,1|0,0,0]=2 3411 B25R3.121526 Brc1ccc(cc1)C(OCCN2CCOCC2)c3ccccc3 7a_100011217567_100000211760 [0,1,0,0,0,1|1,0,0]=3 3412 B25R3.121526 Brc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_100011217567_100011935260 [0,1,0,0,0,1|2,0,0]=4 3413 B25R3.121526 Brc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_100011217567_100011935260 [0,1,0,0,0,1|2,0,0]=4 3414 B25R3.121526 Cc1ccc(cc1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100000210966 [0,1,0,0,0,1|1,0,1]=4 3415 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000736602_100012355289 [0,1,0,0,0,1|1,0,0]=3 3416 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000736602_100011713444 [0,1,0,0,0,1|1,0,0]=3 3417 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100000210966 [0,1,0,0,0,1|1,0,0]=3 3418 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 34a_100000736602_100011209188 [0,1,0,0,0,1|1,0,0]=3 3419 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccncc3 270004a_200015185284_100011713444 [0,1,0,0,0,1|2,0,0]=4 3420 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccncc3 34a_200015185284_100011209188 [0,1,0,0,0,1|2,0,0]=4 3421 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100000210966 [0,1,0,0,0,1|2,0,0]=4 3422 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 2230a_100000736602_100011934994 [0,1,0,0,0,1|2,0,0]=4 3423 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100000210966 [0,1,0,0,0,1|2,0,0]=4 3424 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 34a_100000736602_100011934994 [0,1,0,0,0,1|2,0,0]=4 3425 B25R3.121526 Cc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 2230a_100000736602_100000739454 [0,1,0,0,0,1|0,0,0]=2 3426 B25R3.121526 Cc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100000210966 [0,1,0,0,0,1|0,0,0]=2 3427 B25R3.121526 Cc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 34a_100000736602_100000739454 [0,1,0,0,0,1|0,0,0]=2 3428 B25R3.121526 Cc1ccc(cc1)C(NCCN2CCCCC2)c3ccncc3 34a_200015185284_100000739454 [0,1,0,0,0,1|1,0,0]=3 3429 B25R3.121526 Cc1ccc(cc1)C(NCCN2CCOCC2)c3ccccc3 2230a_100000736602_100025781966 [0,1,0,0,0,1|1,0,0]=3 3430 B25R3.121526 Cc1ccc(cc1)C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100000210966 [0,1,0,0,0,1|1,0,0]=3 3431 B25R3.121526 Cc1ccc(cc1)C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100000210966 [0,1,0,0,0,1|1,0,0]=3 3432 B25R3.121526 Cc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 2230a_100000736602_100011935260 [0,1,0,0,0,1|2,0,0]=4 3433 B25R3.121526 Cc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 34a_100000736602_100011935260 [0,1,0,0,0,1|2,0,0]=4 3434 B25R3.121526 Cc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 34a_100000212064_100011934994 [0,1,0,0,0,1|2,0,0]=4 3435 B25R3.121526 Cc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_100000212064_100011934994 [0,1,0,0,0,1|2,0,0]=4 3436 B25R3.121526 Cc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 34a_100000212064_100000739454 [0,1,0,0,0,1|0,0,0]=2 3437 B25R3.121526 Cc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 7a_100000212064_100000739454 [0,1,0,0,0,1|0,0,0]=2 3438 B25R3.121526 Cc1ccc(cc1)C(OCCN2CCOCC2)c3ccccc3 7a_100000212064_100000211760 [0,1,0,0,0,1|1,0,0]=3 3439 B25R3.121526 Cc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_100000212064_100011935260 [0,1,0,0,0,1|2,0,0]=4 3440 B25R3.121526 Cc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_100000212064_100011935260 [0,1,0,0,0,1|2,0,0]=4 3441 B25R3.121526 Clc1ccc(cc1)C(NCCC2=CCCCC2)c3ccccc3 2230a_100000212019_100000211669 [0,1,0,0,0,1|1,0,1]=4 3442 B25R3.121526 Clc1ccc(cc1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100000211064 [0,1,0,0,0,1|1,0,1]=4 3443 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000737946_100012355289 [0,1,0,0,0,1|1,0,0]=3 3444 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000738074_100000211669 [0,1,0,0,0,1|1,0,0]=3 3445 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000737946_100011713444 [0,1,0,0,0,1|1,0,0]=3 3446 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100000211064 [0,1,0,0,0,1|1,0,0]=3 3447 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 34a_100000737946_100011209188 [0,1,0,0,0,1|1,0,0]=3 3448 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccn3 2230a_100000738074_200010188304 [0,1,0,0,0,1|2,0,0]=4 3449 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccn3 270004a_100000738074_100000753647 [0,1,0,0,0,1|2,0,0]=4 3450 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_100000753233 [0,1,0,0,0,1|2,0,0]=4 3451 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCO2)c3ccccc3 2230a_100015183643_100000211669 [0,1,0,0,0,1|2,0,0]=4 3452 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100000211064 [0,1,0,0,0,1|2,0,0]=4 3453 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 2230a_100000737946_100011934994 [0,1,0,0,0,1|2,0,0]=4 3454 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 2230a_100000755988_100000211669 [0,1,0,0,0,1|2,0,0]=4 3455 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100000211064 [0,1,0,0,0,1|2,0,0]=4 3456 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 34a_100000737946_100011934994 [0,1,0,0,0,1|2,0,0]=4 3457 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 2230a_100000737946_100000739454 [0,1,0,0,0,1|0,0,0]=2 3458 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100000211064 [0,1,0,0,0,1|0,0,0]=2 3459 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 34a_100000737946_100000739454 [0,1,0,0,0,1|0,0,0]=2 3460 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCCCC2)c3ccccn3 270004a_100000216509_100000753647 [0,1,0,0,0,1|1,0,0]=3 3461 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCCCC2)c3cccnc3 270004a_100000216509_100000753233 [0,1,0,0,0,1|1,0,0]=3 3462 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCOCC2)c3ccccc3 2230a_100000737946_100025781966 [0,1,0,0,0,1|1,0,0]=3 3463 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100000211064 [0,1,0,0,0,1|1,0,0]=3 3464 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCOCC2)c3ccccn3 270004a_100000211067_100000753647 [0,1,0,0,0,1|2,0,0]=4 3465 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCOCC2)c3cccnc3 270004a_100000211067_100000753233 [0,1,0,0,0,1|2,0,0]=4 3466 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCSCC2)c3ccccc3 2230a_100000755026_100000211669 [0,1,0,0,0,1|1,0,0]=3 3467 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100000211064 [0,1,0,0,0,1|1,0,0]=3 3468 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCSCC2)c3ccccn3 2230a_100000755026_200010188304 [0,1,0,0,0,1|2,0,0]=4 3469 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCSCC2)c3ccccn3 270004a_100000755026_100000753647 [0,1,0,0,0,1|2,0,0]=4 3470 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCSCC2)c3cccnc3 270004a_100000755026_100000753233 [0,1,0,0,0,1|2,0,0]=4 3471 B25R3.121526 Clc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 2230a_100000737946_100011935260 [0,1,0,0,0,1|2,0,0]=4 3472 B25R3.121526 Clc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 34a_100000737946_100011935260 [0,1,0,0,0,1|2,0,0]=4 3473 B25R3.121526 Clc1ccc(cc1)C(OCCC2CCCCC2)c3ccccn3 34a_100000242608_100011209188 [0,1,0,0,0,1|2,0,0]=4 3474 B25R3.121526 Clc1ccc(cc1)C(OCCC2CCCCC2)c3ccccn3 7a_100011217863_200010188304 [0,1,0,0,0,1|2,0,0]=4 3475 B25R3.121526 Clc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 34a_100000211768_100011934994 [0,1,0,0,0,1|2,0,0]=4 3476 B25R3.121526 Clc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_100000211768_100011934994 [0,1,0,0,0,1|2,0,0]=4 3477 B25R3.121526 Clc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_100011933979_100000211669 [0,1,0,0,0,1|2,0,0]=4 3478 B25R3.121526 Clc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 34a_100000211768_100000739454 [0,1,0,0,0,1|0,0,0]=2 3479 B25R3.121526 Clc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 7a_100000211768_100000739454 [0,1,0,0,0,1|0,0,0]=2 3480 B25R3.121526 Clc1ccc(cc1)C(OCCN2CCCCC2)c3ccccn3 34a_100000242608_100000739454 [0,1,0,0,0,1|1,0,0]=3 3481 B25R3.121526 Clc1ccc(cc1)C(OCCN2CCOCC2)c3ccccc3 7a_100000211768_100000211760 [0,1,0,0,0,1|1,0,0]=3 3482 B25R3.121526 Clc1ccc(cc1)C(OCCN2CCSCC2)c3ccccc3 7a_100000686052_100000211669 [0,1,0,0,0,1|1,0,0]=3 3483 B25R3.121526 Clc1ccc(cc1)C(OCCN2CCSCC2)c3ccccn3 7a_100000686052_200010188304 [0,1,0,0,0,1|2,0,0]=4 3484 B25R3.121526 Clc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_100000211768_100011935260 [0,1,0,0,0,1|2,0,0]=4 3485 B25R3.121526 Clc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_100000211768_100011935260 [0,1,0,0,0,1|2,0,0]=4 3486 B25R3.121526 Clc1ccc(cc1)C(SCCC2CCOCC2)c3ccccc3 62a_100000211669_100011934994 [0,1,0,0,0,1|2,0,0]=4 3487 B25R3.121526 Clc1ccc(cc1)C(SCCC2CCOCC2)c3ccccc3 62a_100011934994_100000211669 [0,1,0,0,0,1|2,0,0]=4 3488 B25R3.121526 Clc1ccc(cc1)C(SCCN2CCCCC2)c3ccccc3 62a_100000211669_100000739454 [0,1,0,0,0,1|0,0,0]=2 3489 B25R3.121526 Clc1ccc(cc1)C(SCCN2CCCCC2)c3ccccc3 62a_100000739454_100000211669 [0,1,0,0,0,1|0,0,0]=2 3490 B25R3.121526 Clc1ccc(cc1)C(SCCN2CCCCC2)c3ccccn3 62a_100000739454_200010188304 [0,1,0,0,0,1|1,0,0]=3 3491 B25R3.121526 Clc1ccc(cc1)C(SCCN2CCCCC2)c3ccccn3 62a_200010188304_100000739454 [0,1,0,0,0,1|1,0,0]=3 3492 B25R3.121526 Clc1ccc(cc1)C(SCCN2CCOCC2)c3ccccc3 62a_100000211669_100000211760 [0,1,0,0,0,1|1,0,0]=3 3493 B25R3.121526 Clc1ccc(cc1)C(SCCN2CCOCC2)c3ccccn3 62a_200010188304_100000211760 [0,1,0,0,0,1|2,0,0]=4 3494 B25R3.121526 Fc1ccc(cc1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100000210425 [0,1,0,0,0,1|1,0,1]=4 3495 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000737529_100012355289 [0,1,0,0,0,1|1,0,0]=3 3496 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000737529_100011713444 [0,1,0,0,0,1|1,0,0]=3 3497 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100000210425 [0,1,0,0,0,1|1,0,0]=3 3498 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 34a_100000737529_100011209188 [0,1,0,0,0,1|1,0,0]=3 3499 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccncc3 2230a_100000751741_100012355289 [0,1,0,0,0,1|2,0,0]=4 3500 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccncc3 270004a_100000751741_100011713444 [0,1,0,0,0,1|2,0,0]=4 3501 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccncc3 34a_100000751741_100011209188 [0,1,0,0,0,1|2,0,0]=4 3502 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100000210425 [0,1,0,0,0,1|2,0,0]=4 3503 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 2230a_100000737529_100011934994 [0,1,0,0,0,1|2,0,0]=4 3504 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100000210425 [0,1,0,0,0,1|2,0,0]=4 3505 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 34a_100000737529_100011934994 [0,1,0,0,0,1|2,0,0]=4 3506 B25R3.121526 Fc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 2230a_100000737529_100000739454 [0,1,0,0,0,1|0,0,0]=2 3507 B25R3.121526 Fc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100000210425 [0,1,0,0,0,1|0,0,0]=2 3508 B25R3.121526 Fc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 34a_100000737529_100000739454 [0,1,0,0,0,1|0,0,0]=2 3509 B25R3.121526 Fc1ccc(cc1)C(NCCN2CCCCC2)c3ccncc3 2230a_100000751741_100000739454 [0,1,0,0,0,1|1,0,0]=3 3510 B25R3.121526 Fc1ccc(cc1)C(NCCN2CCCCC2)c3ccncc3 34a_100000751741_100000739454 [0,1,0,0,0,1|1,0,0]=3 3511 B25R3.121526 Fc1ccc(cc1)C(NCCN2CCOCC2)c3ccccc3 2230a_100000737529_100025781966 [0,1,0,0,0,1|1,0,0]=3 3512 B25R3.121526 Fc1ccc(cc1)C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100000210425 [0,1,0,0,0,1|1,0,0]=3 3513 B25R3.121526 Fc1ccc(cc1)C(NCCN2CCOCC2)c3ccncc3 2230a_100000751741_100025781966 [0,1,0,0,0,1|2,0,0]=4 3514 B25R3.121526 Fc1ccc(cc1)C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100000210425 [0,1,0,0,0,1|1,0,0]=3 3515 B25R3.121526 Fc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 2230a_100000737529_100011935260 [0,1,0,0,0,1|2,0,0]=4 3516 B25R3.121526 Fc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 34a_100000737529_100011935260 [0,1,0,0,0,1|2,0,0]=4 3517 B25R3.121526 Fc1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 34a_200000246460_100011209188 [0,1,0,0,0,1|1,0,0]=3 3518 B25R3.121526 Fc1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 7a_200000246460_100011273959 [0,1,0,0,0,1|1,0,0]=3 3519 B25R3.121526 Fc1ccc(cc1)C(OCCC2CCCCC2)c3ccncc3 34a_100000748166_100011209188 [0,1,0,0,0,1|2,0,0]=4 3520 B25R3.121526 Fc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 34a_200000246460_100011934994 [0,1,0,0,0,1|2,0,0]=4 3521 B25R3.121526 Fc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_200000246460_100011934994 [0,1,0,0,0,1|2,0,0]=4 3522 B25R3.121526 Fc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 34a_200000246460_100000739454 [0,1,0,0,0,1|0,0,0]=2 3523 B25R3.121526 Fc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 7a_200000246460_100000739454 [0,1,0,0,0,1|0,0,0]=2 3524 B25R3.121526 Fc1ccc(cc1)C(OCCN2CCCCC2)c3ccncc3 34a_100000748166_100000739454 [0,1,0,0,0,1|1,0,0]=3 3525 B25R3.121526 Fc1ccc(cc1)C(OCCN2CCOCC2)c3ccccc3 7a_200000246460_100000211760 [0,1,0,0,0,1|1,0,0]=3 3526 B25R3.121526 Fc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_200000246460_100011935260 [0,1,0,0,0,1|2,0,0]=4 3527 B25R3.121526 Fc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_200000246460_100011935260 [0,1,0,0,0,1|2,0,0]=4 3528 B25R3.121526 Nc1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 34a_100011236343_100011209188 [0,1,0,0,0,1|1,0,0]=3 3529 B25R3.121526 Nc1ccc(cc1)C(OCCC2CCCCC2)c3ccccc3 7a_100011236343_100011273959 [0,1,0,0,0,1|1,0,0]=3 3530 B25R3.121526 Nc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 34a_100011236343_100011934994 [0,1,0,0,0,1|2,0,0]=4 3531 B25R3.121526 Nc1ccc(cc1)C(OCCC2CCOCC2)c3ccccc3 7a_100011236343_100011934994 [0,1,0,0,0,1|2,0,0]=4 3532 B25R3.121526 Nc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 34a_100011236343_100000739454 [0,1,0,0,0,1|0,0,0]=2 3533 B25R3.121526 Nc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 7a_100011236343_100000739454 [0,1,0,0,0,1|0,0,0]=2 3534 B25R3.121526 Nc1ccc(cc1)C(OCCN2CCOCC2)c3ccccc3 7a_100011236343_100000211760 [0,1,0,0,0,1|1,0,0]=3 3535 B25R3.121526 Nc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 34a_100011236343_100011935260 [0,1,0,0,0,1|2,0,0]=4 3536 B25R3.121526 Nc1ccc(cc1)C(OCOC2CCCCC2)c3ccccc3 7a_100011236343_100011935260 [0,1,0,0,0,1|2,0,0]=4 3537 B25R3.121526 Oc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000198503_100011713444 [0,1,0,0,0,1|1,0,0]=3 3538 B25R3.121526 Oc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 34a_100000198503_100011209188 [0,1,0,0,0,1|1,0,0]=3 3539 B25R3.121526 Oc1ccc(cc1)C(NCCC2CCOCC2)c3ccccc3 34a_100000198503_100011934994 [0,1,0,0,0,1|2,0,0]=4 3540 B25R3.121526 Oc1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 34a_100000198503_100000739454 [0,1,0,0,0,1|0,0,0]=2 3541 B25R3.121526 Oc1ccc(cc1)C(NCOC2CCCCC2)c3ccccc3 34a_100000198503_100011935260 [0,1,0,0,0,1|2,0,0]=4 3542 B25R3.2033538 CN(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100012355289 [0,1,0,0,0,1|1,0,0]=3 3543 B25R3.2033538 CN(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100011273959 [0,1,0,0,0,1|1,0,0]=3 3544 B25R3.2033538 CN(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 270004a_100103148541_100011713444 [0,1,0,0,0,1|1,0,0]=3 3545 B25R3.2033538 CN(CCC1CCCCO1)C(c2ccccc2)c3ccccc3 2230a_100015183322_100000211591 [0,1,0,0,0,1|2,0,0]=4 3546 B25R3.2033538 CN(CCC1CCCCO1)C(c2ccccc2)c3ccccc3 269982a_100015183322_100000211591 [0,1,0,0,0,1|2,0,0]=4 3547 B25R3.2033538 CN(CCC1CCCCO1)C(c2ccccc2)c3ccccc3 270004a_100015183322_100000210122 [0,1,0,0,0,1|2,0,0]=4 3548 B25R3.2033538 CN(CCC1CCOCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100011934994 [0,1,0,0,0,1|2,0,0]=4 3549 B25R3.2033538 CN(CCC1CCOCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100011934994 [0,1,0,0,0,1|2,0,0]=4 3550 B25R3.2033538 CN(CCN1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100000739454 [0,1,0,0,0,1|0,0,0]=2 3551 B25R3.2033538 CN(CCN1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000739454 [0,1,0,0,0,1|0,0,0]=2 3552 B25R3.2033538 CN(CCN1CCOCC1)C(c2ccccc2)c3ccccc3 2230a_100000225678_100000211591 [0,1,0,0,0,1|1,0,0]=3 3553 B25R3.2033538 CN(CCN1CCOCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100025781966 [0,1,0,0,0,1|1,0,0]=3 3554 B25R3.2033538 CN(CCN1CCOCC1)C(c2ccccc2)c3ccccc3 269982a_100000225678_100000211591 [0,1,0,0,0,1|1,0,0]=3 3555 B25R3.2033538 CN(CCN1CCOCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000753993 [0,1,0,0,0,1|1,0,0]=3 3556 B25R3.2033538 CN(CCN1CCOCC1)C(c2ccccc2)c3ccccc3 270004a_100000225678_100000210122 [0,1,0,0,0,1|1,0,0]=3 3557 B25R3.2033538 CN(CCN1CCOCC1)C(c2ccccc2)c3ccccn3 270004a_100000225678_100000210380 [0,1,0,0,0,1|2,0,0]=4 3558 B25R3.2033538 CN(CCN1CCOCC1)C(c2ccccc2)c3cccnc3 270004a_100000225678_100000735413 [0,1,0,0,0,1|2,0,0]=4 3559 B25R3.2033538 CN(COC1CCCCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100011935260 [0,1,0,0,0,1|2,0,0]=4 3560 B25R3.2033538 CN(COC1CCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100011935260 [0,1,0,0,0,1|2,0,0]=4 3561 B25R3.2033538 O=C(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100011273959 [0,1,0,0,0,1|1,0,0]=3 3562 B25R3.2033538 O=C(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000211375_100011216954 [0,1,0,0,0,1|1,0,0]=3 3563 B25R3.2033538 O=C(CCC1CCOCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100011934994 [0,1,0,0,0,1|2,0,0]=4 3564 B25R3.2033538 O=C(CCN1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100000739454 [0,1,0,0,0,1|0,0,0]=2 3565 B25R3.2033538 O=C(CCN1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000743487_100011216954 [0,1,0,0,0,1|0,0,0]=2 3566 B25R3.2033538 O=C(CCN1CCCCO1)C(c2ccccc2)c3ccccc3 1458a_200015184090_100011216954 [0,1,0,0,0,1|1,0,0]=3 3567 B25R3.2033538 O=C(CCN1CCOCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100000753993 [0,1,0,0,0,1|1,0,0]=3 3568 B25R3.2033538 O=C(CCN1CCOCC1)C(c2ccccc2)c3ccccc3 1458a_100000749337_100011216954 [0,1,0,0,0,1|1,0,0]=3 3569 B25R3.2033538 O=C(COC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100011935260 [0,1,0,0,0,1|1,0,1]=4 3570 B25R3.2033538 O=C(COC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100011223303_100011216954 [0,1,0,0,0,1|1,0,1]=4 3571 B25R3.2033538 O=C(NCC1CCCCC1)C(c2ccccc2)c3ccccc3 11a_100000210473_100000210944 [0,1,0,0,0,1|1,0,1]=4 3572 B25R3.2033538 O=C(NCC1CCCCC1)C(c2ccccc2)c3ccccc3 1626a_100000210473_100000210944 [0,1,0,0,0,1|1,0,1]=4 3573 B25R3.2033538 O=C(NCC1CCCCC1)C(c2ccccc2)c3ccccc3 240690a_100000210473_100000210944 [0,1,0,0,0,1|1,0,1]=4 3574 B25R3.2033538 O=C(NCC1CCCCC1)C(c2ccccc2)c3ccccc3 527a_100000210473_100000210944 [0,1,0,0,0,1|1,0,1]=4 3575 B25R3.2577903 Brc1cccc(c1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100011267660 [0,1,0,0,0,1|2,0,0]=4 3576 B25R3.2577903 Brc1cccc(c1)C(NCCC2CCOCC2)c3ccccc3 2230a_100011212009_100011934994 [0,1,0,0,0,1|2,0,0]=4 3577 B25R3.2577903 Brc1cccc(c1)C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100011267660 [0,1,0,0,0,1|2,0,0]=4 3578 B25R3.2577903 Brc1cccc(c1)C(NCCC2CCOCC2)c3ccccc3 34a_100011212009_100011934994 [0,1,0,0,0,1|2,0,0]=4 3579 B25R3.2577903 Brc1cccc(c1)C(NCCN2CCCCC2)c3ccccc3 2230a_100011212009_100000739454 [0,1,0,0,0,1|0,0,0]=2 3580 B25R3.2577903 Brc1cccc(c1)C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100011267660 [0,1,0,0,0,1|0,0,0]=2 3581 B25R3.2577903 Brc1cccc(c1)C(NCCN2CCCCC2)c3ccccc3 34a_100011212009_100000739454 [0,1,0,0,0,1|0,0,0]=2 3582 B25R3.2577903 Brc1cccc(c1)C(NCCN2CCOCC2)c3ccccc3 2230a_100011212009_100025781966 [0,1,0,0,0,1|1,0,0]=3 3583 B25R3.2577903 Brc1cccc(c1)C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100011267660 [0,1,0,0,0,1|1,0,0]=3 3584 B25R3.2577903 Brc1cccc(c1)C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100011267660 [0,1,0,0,0,1|1,0,0]=3 3585 B25R3.2577903 Brc1cccc(c1)C(NCOC2CCCCC2)c3ccccc3 2230a_100011212009_100011935260 [0,1,0,0,0,1|2,0,0]=4 3586 B25R3.2577903 Brc1cccc(c1)C(NCOC2CCCCC2)c3ccccc3 34a_100011212009_100011935260 [0,1,0,0,0,1|2,0,0]=4 3587 B25R3.2577903 Brc1cncc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100011267668 [0,1,0,0,0,1|2,0,0]=4 3588 B25R3.2577903 Brc1cncc(c1)C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100011267668 [0,1,0,0,0,1|1,0,0]=3 3589 B25R3.2577903 Brc1cncc(c1)C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100011267668 [0,1,0,0,0,1|2,0,0]=4 3590 B25R3.2577903 Brc1cncc(c1)C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100011267668 [0,1,0,0,0,1|2,0,0]=4 3591 B25R3.2577903 Cc1cccc(c1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100011217825 [0,1,0,0,0,1|1,0,1]=4 3592 B25R3.2577903 Cc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100011217825 [0,1,0,0,0,1|1,0,0]=3 3593 B25R3.2577903 Cc1cccc(c1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100011217825 [0,1,0,0,0,1|2,0,0]=4 3594 B25R3.2577903 Cc1cccc(c1)C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100011217825 [0,1,0,0,0,1|2,0,0]=4 3595 B25R3.2577903 Cc1cccc(c1)C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100011217825 [0,1,0,0,0,1|0,0,0]=2 3596 B25R3.2577903 Cc1cccc(c1)C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100011217825 [0,1,0,0,0,1|1,0,0]=3 3597 B25R3.2577903 Cc1cccc(c1)C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100011217825 [0,1,0,0,0,1|1,0,0]=3 3598 B25R3.2577903 Clc1cccc(c1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_100011215489 [0,1,0,0,0,1|1,0,1]=4 3599 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000741085_100012355289 [0,1,0,0,0,1|1,0,0]=3 3600 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_100011215489 [0,1,0,0,0,1|1,0,0]=3 3601 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000741085_100011713444 [0,1,0,0,0,1|1,0,0]=3 3602 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 34a_100000741085_100011209188 [0,1,0,0,0,1|1,0,0]=3 3603 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccn3 270004a_100000738074_100000688346 [0,1,0,0,0,1|2,0,0]=4 3604 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3cccnc3 270004a_100000738074_100000752423 [0,1,0,0,0,1|2,0,0]=4 3605 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_100011215489 [0,1,0,0,0,1|2,0,0]=4 3606 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCOCC2)c3ccccc3 2230a_100000741085_100011934994 [0,1,0,0,0,1|2,0,0]=4 3607 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_100011215489 [0,1,0,0,0,1|2,0,0]=4 3608 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCOCC2)c3ccccc3 34a_100000741085_100011934994 [0,1,0,0,0,1|2,0,0]=4 3609 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCCCC2)c3ccccc3 2230a_100000741085_100000739454 [0,1,0,0,0,1|0,0,0]=2 3610 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_100011215489 [0,1,0,0,0,1|0,0,0]=2 3611 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCCCC2)c3ccccc3 34a_100000741085_100000739454 [0,1,0,0,0,1|0,0,0]=2 3612 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCCCC2)c3ccccn3 270004a_100000216509_100000688346 [0,1,0,0,0,1|1,0,0]=3 3613 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCCCC2)c3cccnc3 270004a_100000216509_100000752423 [0,1,0,0,0,1|1,0,0]=3 3614 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCOCC2)c3ccccc3 2230a_100000741085_100025781966 [0,1,0,0,0,1|1,0,0]=3 3615 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_100011215489 [0,1,0,0,0,1|1,0,0]=3 3616 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCOCC2)c3ccccn3 270004a_100000211067_100000688346 [0,1,0,0,0,1|2,0,0]=4 3617 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCOCC2)c3cccnc3 270004a_100000211067_100000752423 [0,1,0,0,0,1|2,0,0]=4 3618 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_100011215489 [0,1,0,0,0,1|1,0,0]=3 3619 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCSCC2)c3ccccn3 270004a_100000755026_100000688346 [0,1,0,0,0,1|2,0,0]=4 3620 B25R3.2577903 Clc1cccc(c1)C(NCCN2CCSCC2)c3cccnc3 270004a_100000755026_100000752423 [0,1,0,0,0,1|2,0,0]=4 3621 B25R3.2577903 Clc1cccc(c1)C(NCOC2CCCCC2)c3ccccc3 2230a_100000741085_100011935260 [0,1,0,0,0,1|2,0,0]=4 3622 B25R3.2577903 Clc1cccc(c1)C(NCOC2CCCCC2)c3ccccc3 34a_100000741085_100011935260 [0,1,0,0,0,1|2,0,0]=4 3623 B25R3.2577903 Clc1cccc(c1)C(OCCC2CCOCC2)c3ccccc3 34a_100000733576_100011934994 [0,1,0,0,0,1|2,0,0]=4 3624 B25R3.2577903 Clc1cccc(c1)C(OCCC2CCOCC2)c3ccccc3 7a_100000733576_100011934994 [0,1,0,0,0,1|2,0,0]=4 3625 B25R3.2577903 Clc1cccc(c1)C(OCCN2CCCCC2)c3ccccc3 34a_100000733576_100000739454 [0,1,0,0,0,1|0,0,0]=2 3626 B25R3.2577903 Clc1cccc(c1)C(OCCN2CCCCC2)c3ccccc3 7a_100000733576_100000739454 [0,1,0,0,0,1|0,0,0]=2 3627 B25R3.2577903 Clc1cccc(c1)C(OCCN2CCOCC2)c3ccccc3 7a_100000733576_100000211760 [0,1,0,0,0,1|1,0,0]=3 3628 B25R3.2577903 Clc1cccc(c1)C(OCOC2CCCCC2)c3ccccc3 34a_100000733576_100011935260 [0,1,0,0,0,1|2,0,0]=4 3629 B25R3.2577903 Clc1cccc(c1)C(OCOC2CCCCC2)c3ccccc3 7a_100000733576_100011935260 [0,1,0,0,0,1|2,0,0]=4 3630 B25R3.2577903 Fc1cccc(c1)C(NCCC2=CCCCC2)c3ccccc3 270004a_100000212019_200011219850 [0,1,0,0,0,1|1,0,1]=4 3631 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 2230a_100000686443_100012355289 [0,1,0,0,0,1|1,0,0]=3 3632 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000686443_100011713444 [0,1,0,0,0,1|1,0,0]=3 3633 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 270004a_100000738074_200011219850 [0,1,0,0,0,1|1,0,0]=3 3634 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 34a_100000686443_100011209188 [0,1,0,0,0,1|1,0,0]=3 3635 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCCCO2)c3ccccc3 270004a_100015183643_200011219850 [0,1,0,0,0,1|2,0,0]=4 3636 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCOCC2)c3ccccc3 2230a_100000686443_100011934994 [0,1,0,0,0,1|2,0,0]=4 3637 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCOCC2)c3ccccc3 270004a_100000755988_200011219850 [0,1,0,0,0,1|2,0,0]=4 3638 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCOCC2)c3ccccc3 34a_100000686443_100011934994 [0,1,0,0,0,1|2,0,0]=4 3639 B25R3.2577903 Fc1cccc(c1)C(NCCN2CCCCC2)c3ccccc3 2230a_100000686443_100000739454 [0,1,0,0,0,1|0,0,0]=2 3640 B25R3.2577903 Fc1cccc(c1)C(NCCN2CCCCC2)c3ccccc3 270004a_100000216509_200011219850 [0,1,0,0,0,1|0,0,0]=2 3641 B25R3.2577903 Fc1cccc(c1)C(NCCN2CCCCC2)c3ccccc3 34a_100000686443_100000739454 [0,1,0,0,0,1|0,0,0]=2 3642 B25R3.2577903 Fc1cccc(c1)C(NCCN2CCOCC2)c3ccccc3 2230a_100000686443_100025781966 [0,1,0,0,0,1|1,0,0]=3 3643 B25R3.2577903 Fc1cccc(c1)C(NCCN2CCOCC2)c3ccccc3 270004a_100000211067_200011219850 [0,1,0,0,0,1|1,0,0]=3 3644 B25R3.2577903 Fc1cccc(c1)C(NCCN2CCSCC2)c3ccccc3 270004a_100000755026_200011219850 [0,1,0,0,0,1|1,0,0]=3 3645 B25R3.2577903 Fc1cccc(c1)C(NCOC2CCCCC2)c3ccccc3 2230a_100000686443_100011935260 [0,1,0,0,0,1|2,0,0]=4 3646 B25R3.2577903 Fc1cccc(c1)C(NCOC2CCCCC2)c3ccccc3 34a_100000686443_100011935260 [0,1,0,0,0,1|2,0,0]=4 3647 B25R3.2577903 Fc1cccc(c1)C(OCCC2CCCCC2)c3ccccc3 34a_100000749007_100011209188 [0,1,0,0,0,1|1,0,0]=3 3648 B25R3.2577903 Fc1cccc(c1)C(OCCC2CCCCC2)c3ccccc3 7a_100000749007_100011273959 [0,1,0,0,0,1|1,0,0]=3 3649 B25R3.2577903 Fc1cccc(c1)C(OCCC2CCOCC2)c3ccccc3 34a_100000749007_100011934994 [0,1,0,0,0,1|2,0,0]=4 3650 B25R3.2577903 Fc1cccc(c1)C(OCCC2CCOCC2)c3ccccc3 7a_100000749007_100011934994 [0,1,0,0,0,1|2,0,0]=4 3651 B25R3.2577903 Fc1cccc(c1)C(OCCN2CCCCC2)c3ccccc3 34a_100000749007_100000739454 [0,1,0,0,0,1|0,0,0]=2 3652 B25R3.2577903 Fc1cccc(c1)C(OCCN2CCCCC2)c3ccccc3 7a_100000749007_100000739454 [0,1,0,0,0,1|0,0,0]=2 3653 B25R3.2577903 Fc1cccc(c1)C(OCCN2CCOCC2)c3ccccc3 7a_100000749007_100000211760 [0,1,0,0,0,1|1,0,0]=3 3654 B25R3.2577903 Fc1cccc(c1)C(OCOC2CCCCC2)c3ccccc3 34a_100000749007_100011935260 [0,1,0,0,0,1|2,0,0]=4 3655 B25R3.2577903 Fc1cccc(c1)C(OCOC2CCCCC2)c3ccccc3 7a_100000749007_100011935260 [0,1,0,0,0,1|2,0,0]=4 3656 B25R3.3975663 CC(CNCC1CCCCC1)(c2ccccc2)c3ccccc3 2230a_100000706881_100000211423 [0,1,0,0,0,1|1,0,0]=3 3657 B25R3.3975663 CC(CNCC1CCCCC1)(c2ccccc2)c3ccccc3 269862a_100000706881_100000211278 [0,1,0,0,0,1|1,0,0]=3 3658 B25R3.3975663 CC(CNCC1CCCCO1)(c2ccccc2)c3ccccc3 2230a_100000706881_100000211543 [0,1,0,0,0,1|2,0,0]=4 3659 B25R3.3975663 CC(CNCC1CCCOC1)(c2ccccc2)c3ccccc3 2230a_100000706881_100000741521 [0,1,0,0,0,1|2,0,0]=4 3660 B25R3.3975663 CC(CNCC1CCOCC1)(c2ccccc2)c3ccccc3 2230a_100000706881_100000754603 [0,1,0,0,0,1|2,0,0]=4 3661 B25R3.3975663 CC(CNCC1CCOCC1)(c2ccccc2)c3ccccc3 269862a_100000706881_100000749017 [0,1,0,0,0,1|2,0,0]=4 3662 B25R3.3975663 CC(CNCC1CCSCC1)(c2ccccc2)c3ccccc3 269862a_100000706881_100000067145 [0,1,0,0,0,1|2,0,0]=4 3663 B25R3.3975663 CC(CNCC1CCSCC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100000067145 [0,1,0,0,0,1|2,0,0]=4 3664 B25R3.3975663 CC(OCCC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100011273959 [0,1,0,0,0,1|1,0,0]=3 3665 B25R3.3975663 CC(OCCC1CCCCC1)(c2ccccc2)c3ccccn3 7a_200000075192_100011273959 [0,1,0,0,0,1|2,0,0]=4 3666 B25R3.3975663 CC(OCCC1CCOCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100011934994 [0,1,0,0,0,1|2,0,0]=4 3667 B25R3.3975663 CC(OCCN1CCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000739454 [0,1,0,0,0,1|0,0,0]=2 3668 B25R3.3975663 CC(OCCN1CCCCC1)(c2ccccc2)c3ccccn3 7a_200000075192_100000739454 [0,1,0,0,0,1|1,0,0]=3 3669 B25R3.3975663 CC(OCCN1CCOCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000211760 [0,1,0,0,0,1|1,0,0]=3 3670 B25R3.3975663 CC(OCCN1CCOCC1)(c2ccccc2)c3ccccn3 7a_200000075192_100000211760 [0,1,0,0,0,1|2,0,0]=4 3671 B25R3.3975663 CC(OCOC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100011935260 [0,1,0,0,0,1|2,0,0]=4 3672 B25R3.3975663 O=P(COCC1CCCCC1)(c2ccccc2)c3ccccc3 34a_200000030349_100000211423 [0,1,0,0,0,1|2,0,0]=4 3673 B25R3.3975663 O=P(COCC1CCCCC1)(c2ccccc2)c3ccccc3 7a_200000030349_100000211423 [0,1,0,0,0,1|2,0,0]=4 3674 B25R3.18363890 CC1(CCCCC1)CNCC(c2ccccc2)c3ccccc3 269862a_100000739227_100011935227 [0,1,0,0,0,1|1,0,0]=3 3675 B25R3.18363890 CC1(CCCCC1)NCCC(c2ccccc2)c3ccccc3 2230a_100000741114_100009813428 [0,1,0,0,0,1|1,0,0]=3 3676 B25R3.18363890 CC1(CCCCC1)NCCC(c2ccccc2)c3ccccc3 34a_100000741114_100009813428 [0,1,0,0,0,1|1,0,0]=3 3677 B25R3.18363890 CC1(CCCCC1)NCC[S+](c2ccccc2)c3ccccc3 2230a_100000741114_100010140906 [0,1,0,0,0,1|2,0,0]=4 3678 B25R3.18363890 CC1(CCCCC1)OCCC(c2ccccc2)c3ccccc3 34a_100011215885_100009813428 [0,1,0,0,0,1|1,0,0]=3 3679 B25R3.18363890 CC1(CCCCC1)OCCC(c2ccccc2)c3ccccc3 7a_100011215885_100009813428 [0,1,0,0,0,1|1,0,0]=3 3680 B25R3.18363890 CC1(CCCCC1)OCC[S+](c2ccccc2)c3ccccc3 7a_100011215885_100010140906 [0,1,0,0,0,1|2,0,0]=4 3681 B25R3.18363890 CC1(CCOCC1)CNCC(c2ccccc2)c3ccccc3 269862a_100000739227_100000701351 [0,1,0,0,0,1|2,0,0]=4 3682 B25R3.18363890 CC1(CCOCC1)NCCC(c2ccccc2)c3ccccc3 2230a_100000692449_100009813428 [0,1,0,0,0,1|2,0,0]=4 3683 B25R3.18363890 CC1(CCOCC1)NCCC(c2ccccc2)c3ccccc3 34a_100000692449_100009813428 [0,1,0,0,0,1|2,0,0]=4 3684 B25R3.18363890 CC1(CCOCC1)OCCC(c2ccccc2)c3ccccc3 34a_100011827762_100009813428 [0,1,0,0,0,1|2,0,0]=4 3685 B25R3.18363890 CC1(CCOCC1)OCCC(c2ccccc2)c3ccccc3 7a_100011827762_100009813428 [0,1,0,0,0,1|2,0,0]=4 3686 B25R3.18363890 CC1(CCSCC1)OCCC(c2ccccc2)c3ccccc3 34a_200011004327_100009813428 [0,1,0,0,0,1|2,0,0]=4 3687 B25R3.18363890 CC1(CCSCC1)OCCC(c2ccccc2)c3ccccc3 7a_200011004327_100009813428 [0,1,0,0,0,1|2,0,0]=4 3688 B25R3.18363890 OC1(CCCCC1)CCNC(c2ccccc2)c3ccccc3 2230a_100102740465_100000211591 [0,1,0,0,0,1|1,0,0]=3 3689 B25R3.18363890 OC1(CCCCC1)CCNC(c2ccccc2)c3ccccc3 270004a_100102740465_100000210122 [0,1,0,0,0,1|1,0,0]=3 3690 B25R3.18363890 OC1(CCCCC1)CCNC(c2ccccc2)c3ccccn3 270004a_100102740465_100000210380 [0,1,0,0,0,1|2,0,0]=4 3691 B25R3.18363890 OC1(CCCCC1)CCNC(c2ccccc2)c3cccnc3 270004a_100102740465_100000735413 [0,1,0,0,0,1|2,0,0]=4 3692 B25R3.46108 O=C1CCCCCC1OCC(c2ccccc2)c3ccccc3 7a_100011215272_100000243696 [0,1,0,0,0,1|2,0,0]=4 3693 B25R3.834369 Cc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000736602_200000696569 [0,1,0,0,0,1|2,0,0]=4 3694 B25R3.834369 Cc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000736602_200000763224 [0,1,0,0,0,1|2,0,0]=4 3695 B25R3.834369 Cc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100000210966 [0,1,0,0,0,1|2,0,0]=4 3696 B25R3.834369 Cc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 34a_100000736602_200000696569 [0,1,0,0,0,1|2,0,0]=4 3697 B25R3.834369 Clc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000737946_200000696569 [0,1,0,0,0,1|2,0,0]=4 3698 B25R3.834369 Clc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100015204231_100000211669 [0,1,0,0,0,1|2,0,0]=4 3699 B25R3.834369 Clc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000737946_200000763224 [0,1,0,0,0,1|2,0,0]=4 3700 B25R3.834369 Clc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100000211064 [0,1,0,0,0,1|2,0,0]=4 3701 B25R3.834369 Clc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 34a_100000737946_200000696569 [0,1,0,0,0,1|2,0,0]=4 3702 B25R3.834369 Fc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000737529_200000696569 [0,1,0,0,0,1|2,0,0]=4 3703 B25R3.834369 Fc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000737529_200000763224 [0,1,0,0,0,1|2,0,0]=4 3704 B25R3.834369 Fc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100000210425 [0,1,0,0,0,1|2,0,0]=4 3705 B25R3.834369 Fc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 34a_100000737529_200000696569 [0,1,0,0,0,1|2,0,0]=4 3706 B25R3.834369 Fc1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 34a_200000246460_200000696569 [0,1,0,0,0,1|2,0,0]=4 3707 B25R3.834369 Fc1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 7a_200000246460_200000696569 [0,1,0,0,0,1|2,0,0]=4 3708 B25R3.834369 Nc1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 34a_100011236343_200000696569 [0,1,0,0,0,1|2,0,0]=4 3709 B25R3.834369 Nc1ccc(cc1)C(OCC2CCCCCC2)c3ccccc3 7a_100011236343_200000696569 [0,1,0,0,0,1|2,0,0]=4 3710 B25R3.834369 Oc1ccc(cc1)C(NCC2CCCCCC2)c3ccccc3 34a_100000198503_200000696569 [0,1,0,0,0,1|2,0,0]=4 3711 B25R3.3516444 Cc1ccccc1C(NCC2CCCCCC2)c3ccccc3 2230a_100000222801_200000696569 [0,1,0,0,0,1|2,0,0]=4 3712 B25R3.3516444 Cc1ccccc1C(NCC2CCCCCC2)c3ccccc3 2230a_100015204231_100000230135 [0,1,0,0,0,1|2,0,0]=4 3713 B25R3.3516444 Cc1ccccc1C(NCC2CCCCCC2)c3ccccc3 269862a_100000222801_200000763224 [0,1,0,0,0,1|2,0,0]=4 3714 B25R3.3516444 Cc1ccccc1C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100000735561 [0,1,0,0,0,1|2,0,0]=4 3715 B25R3.3516444 Cc1ccccc1C(NCC2CCCCCC2)c3ccccc3 34a_100000222801_200000696569 [0,1,0,0,0,1|2,0,0]=4 3716 B25R3.3516444 Clc1ccccc1C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100011215288 [0,1,0,0,0,1|2,0,0]=4 3717 B25R3.3516444 Fc1ccccc1C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100011217773 [0,1,0,0,0,1|2,0,0]=4 3718 B25R3.3516444 Nc1ccccc1C(OCC2CCCCCC2)c3ccccc3 34a_100000246470_200000696569 [0,1,0,0,0,1|2,0,0]=4 3719 B25R3.3516444 Nc1ccccc1C(OCC2CCCCCC2)c3ccccc3 7a_100000246470_200000696569 [0,1,0,0,0,1|2,0,0]=4 3720 B25R3.6509934 CC(CC(c1ccccc1)c2ccccc2)N3CCCCCC3 270004a_100000185865_200000011111 [0,1,0,0,0,1|0,0,0]=2 3721 B25R3.6509934 CC(CC(c1ccccc1)c2ccccc2)N3CCCOCC3 270004a_100000685342_200000011111 [0,1,0,0,0,1|0,0,0]=2 3722 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)C3CCCCCC3 1458a_100000499737_100011217769 [0,1,0,0,0,1|1,0,1]=4 3723 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)N3CCCCCC3 11a_100000185865_100000499737 [0,1,0,0,0,1|0,0,1]=3 3724 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)N3CCCCCC3 1626a_100000185865_100000499737 [0,1,0,0,0,1|0,0,1]=3 3725 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)N3CCCCCC3 240690a_100000185865_100000499737 [0,1,0,0,0,1|0,0,1]=3 3726 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)N3CCCCCC3 527a_100000185865_100000499737 [0,1,0,0,0,1|0,0,1]=3 3727 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)N3CCCOCC3 11a_100000685342_100000499737 [0,1,0,0,0,1|0,0,1]=3 3728 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)N3CCCOCC3 1626a_100000685342_100000499737 [0,1,0,0,0,1|0,0,1]=3 3729 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)N3CCCOCC3 240690a_100000685342_100000499737 [0,1,0,0,0,1|0,0,1]=3 3730 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)N3CCCOCC3 527a_100000685342_100000499737 [0,1,0,0,0,1|0,0,1]=3 3731 B25R3.6509934 O=C(CP(c1ccccc1)c2ccccc2)N3CCCCCC3 11a_100000185865_200020607205 [0,1,0,0,0,1|1,0,1]=4 3732 B25R3.6509934 O=C(CP(c1ccccc1)c2ccccc2)N3CCCCCC3 1626a_100000185865_200020607205 [0,1,0,0,0,1|1,0,1]=4 3733 B25R3.6509934 O=C(CP(c1ccccc1)c2ccccc2)N3CCCCCC3 240690a_100000185865_200020607205 [0,1,0,0,0,1|1,0,1]=4 3734 B25R3.6509934 O=C(CP(c1ccccc1)c2ccccc2)N3CCCCCC3 527a_100000185865_200020607205 [0,1,0,0,0,1|1,0,1]=4 3735 B25R3.6509934 O=C(CP(c1ccccc1)c2ccccc2)N3CCCOCC3 11a_100000685342_200020607205 [0,1,0,0,0,1|1,0,1]=4 3736 B25R3.6509934 O=C(CP(c1ccccc1)c2ccccc2)N3CCCOCC3 1626a_100000685342_200020607205 [0,1,0,0,0,1|1,0,1]=4 3737 B25R3.6509934 O=C(CP(c1ccccc1)c2ccccc2)N3CCCOCC3 240690a_100000685342_200020607205 [0,1,0,0,0,1|1,0,1]=4 3738 B25R3.6509934 O=C(CP(c1ccccc1)c2ccccc2)N3CCCOCC3 527a_100000685342_200020607205 [0,1,0,0,0,1|1,0,1]=4 3739 B25R3.13743512 Cc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100011217825 [0,1,0,0,0,1|2,0,0]=4 3740 B25R3.13743512 Clc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000741085_200000696569 [0,1,0,0,0,1|2,0,0]=4 3741 B25R3.13743512 Clc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000741085_200000763224 [0,1,0,0,0,1|2,0,0]=4 3742 B25R3.13743512 Clc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_100011215489 [0,1,0,0,0,1|2,0,0]=4 3743 B25R3.13743512 Clc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 34a_100000741085_200000696569 [0,1,0,0,0,1|2,0,0]=4 3744 B25R3.13743512 Fc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 2230a_100000686443_200000696569 [0,1,0,0,0,1|2,0,0]=4 3745 B25R3.13743512 Fc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 269862a_100000686443_200000763224 [0,1,0,0,0,1|2,0,0]=4 3746 B25R3.13743512 Fc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 270004a_100015204231_200011219850 [0,1,0,0,0,1|2,0,0]=4 3747 B25R3.13743512 Fc1cccc(c1)C(NCC2CCCCCC2)c3ccccc3 34a_100000686443_200000696569 [0,1,0,0,0,1|2,0,0]=4 3748 B25R3.13743512 Fc1cccc(c1)C(OCC2CCCCCC2)c3ccccc3 34a_100000749007_200000696569 [0,1,0,0,0,1|2,0,0]=4 3749 B25R3.13743512 Fc1cccc(c1)C(OCC2CCCCCC2)c3ccccc3 7a_100000749007_200000696569 [0,1,0,0,0,1|2,0,0]=4 3750 B25R3.13948184 O=C1CN(CCCN1)CCC(c2ccccc2)c3ccccc3 2230a_100015190381_100009813428 [0,1,0,0,0,1|0,0,1]=3 3751 B25R3.13948184 O=C1CN(CCCN1)CC[S+](c2ccccc2)c3ccccc3 2230a_100015190381_100010140906 [0,1,0,0,0,1|1,0,1]=4 3752 B25R3.13948184 OC1CCCCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100025706797_100000050448 [0,1,0,0,0,1|0,0,2]=4 3753 B25R3.13948184 OC1CCCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100025706797_100009813428 [0,1,0,0,0,1|0,0,0]=2 3754 B25R3.13948184 OC1CCCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100025706797_100009813428 [0,1,0,0,0,1|0,0,0]=2 3755 B25R3.13948184 OC1CCCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100025706797_100010140906 [0,1,0,0,0,1|1,0,0]=3 3756 B25R3.13948184 OC1CCCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100025706797_100010140906 [0,1,0,0,0,1|1,0,0]=3 3757 B25R3.13948184 O[C@H]1COCCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100016073750_100000050448 [0,1,0,0,0,1|0,0,2]=4 3758 B25R3.13948184 O[C@H]1COCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100016073750_100009813428 [0,1,0,0,0,1|0,0,0]=2 3759 B25R3.13948184 O[C@H]1COCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100016073750_100009813428 [0,1,0,0,0,1|0,0,0]=2 3760 B25R3.13948184 O[C@H]1COCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100016073750_100010140906 [0,1,0,0,0,1|1,0,0]=3 3761 B25R3.13948184 O[C@H]1COCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100016073750_100010140906 [0,1,0,0,0,1|1,0,0]=3 3762 B25R3.17940601 CC1CCCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100025706717_100000050448 [0,1,0,0,0,1|0,0,2]=4 3763 B25R3.17940601 CC1CCCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100025706717_100009813428 [0,1,0,0,0,1|0,0,0]=2 3764 B25R3.17940601 CC1CCCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100025706717_100009813428 [0,1,0,0,0,1|0,0,0]=2 3765 B25R3.17940601 CC1CCCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100025706717_100009813428 [0,1,0,0,0,1|0,0,0]=2 3766 B25R3.17940601 CC1CCCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100025706717_100010140906 [0,1,0,0,0,1|1,0,0]=3 3767 B25R3.17940601 CC1CCCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100025706717_100010140906 [0,1,0,0,0,1|1,0,0]=3 3768 B25R3.17940601 CN1CCCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000211313_100000050448 [0,1,0,0,0,1|0,0,2]=4 3769 B25R3.17940601 CN1CCCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000211313_100009813428 [0,1,0,0,0,1|0,0,0]=2 3770 B25R3.17940601 CN1CCCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000211313_100009813428 [0,1,0,0,0,1|0,0,0]=2 3771 B25R3.17940601 CN1CCCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000211313_100010140906 [0,1,0,0,0,1|1,0,0]=3 3772 B25R3.17940601 CN1CCCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000211313_100010140906 [0,1,0,0,0,1|1,0,0]=3 3773 B25R3.17940601 O=C1CCN(CCN1)CCC(c2ccccc2)c3ccccc3 2230a_100000698595_100009813428 [0,1,0,0,0,1|0,0,1]=3 3774 B25R3.17940601 O=C1CCN(CCN1)CCC(c2ccccc2)c3ccccc3 269982a_100000698595_100009813428 [0,1,0,0,0,1|0,0,1]=3 3775 B25R3.17940601 O=C1CCN(CCN1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000698595_100010140906 [0,1,0,0,0,1|1,0,1]=4 3776 B25R3.17940601 O=C1CCN(CCN1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000698595_100010140906 [0,1,0,0,0,1|1,0,1]=4 3777 B25R3.17940601 OC1CCCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100015186869_100000050448 [0,1,0,0,0,1|0,0,2]=4 3778 B25R3.17940601 OC1CCCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100015186869_100009813428 [0,1,0,0,0,1|0,0,0]=2 3779 B25R3.17940601 OC1CCCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100015186869_100009813428 [0,1,0,0,0,1|0,0,0]=2 3780 B25R3.17940601 OC1CCCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100015186869_100010140906 [0,1,0,0,0,1|1,0,0]=3 3781 B25R3.17940601 OC1CCCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100015186869_100010140906 [0,1,0,0,0,1|1,0,0]=3 3782 B25R3.32596367 CN(CC1CCCCCC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_200000696569 [0,1,0,0,0,1|2,0,0]=4 3783 B25R3.32596367 CN(CC1CCCCCC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_200000696569 [0,1,0,0,0,1|2,0,0]=4 3784 B25R3.32596367 O=C(CC1CCCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_200000696569 [0,1,0,0,0,1|1,0,1]=4 3785 B25R3.32596367 O=C(CC1CCCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000685095_100011216954 [0,1,0,0,0,1|1,0,1]=4 3786 B25R3.32596367 O=C(CN1CCCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000740298_100011216954 [0,1,0,0,0,1|0,0,1]=3 3787 B25R3.32596367 O=C(CN1CCCCCC1)N(c2ccccc2)c3ccccc3 2230a_100000185865_200015198546 [0,1,0,0,0,1|1,0,1]=4 3788 B25R3.32596367 O=C(CN1CCCCCC1)N(c2ccccc2)c3ccccc3 269982a_100000185865_200015198546 [0,1,0,0,0,1|1,0,1]=4 3789 B25R3.32596367 O=C(CN1CCCOCC1)N(c2ccccc2)c3ccccc3 2230a_100000685342_200015198546 [0,1,0,0,0,1|1,0,1]=4 3790 B25R3.32596367 O=C(CN1CCCOCC1)N(c2ccccc2)c3ccccc3 269982a_100000685342_200015198546 [0,1,0,0,0,1|1,0,1]=4 3791 B25R3.32690298 CC(CNC1CCCCCC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100000210131 [0,1,0,0,0,1|2,0,0]=4 3792 B25R3.32690298 CC(CNC1CCCNCC1)(c2ccccc2)c3ccccc3 270004a_100000706881_100015187895 [0,1,0,0,0,1|2,0,0]=4 3793 B25R3.32690298 CC(OCC1CCCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_200000696569 [0,1,0,0,0,1|2,0,0]=4 3794 B25R3.1136 C=C1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 11a_100000752442_100000499737 [0,2,0,0,0,0|0,0,2]=4 3795 B25R3.1136 C=C1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 1626a_100000752442_100000499737 [0,2,0,0,0,0|0,0,2]=4 3796 B25R3.1136 C=C1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 240690a_100000752442_100000499737 [0,2,0,0,0,0|0,0,2]=4 3797 B25R3.1136 C=C1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 527a_100000752442_100000499737 [0,2,0,0,0,0|0,0,2]=4 3798 B25R3.1136 C=C1CCN(CC1)C(C)CC(c2ccccc2)c3ccccc3 270004a_100000752442_200000011111 [0,2,0,0,0,0|0,0,1]=3 3799 B25R3.1136 CC(CC(c1ccccc1)c2ccccc2)N3CCC(CC3)F 270004a_100015193889_200000011111 [0,2,0,0,0,0|0,0,0]=2 3800 B25R3.1136 CC(CC(c1ccccc1)c2ccccc2)N3CCC(CC3)O 270004a_100025773856_200000011111 [0,2,0,0,0,0|0,0,0]=2 3801 B25R3.1136 CC(CC(c1ccccc1)c2ccccc2)N3CCN(CC3)C 270004a_100000188432_200000011111 [0,2,0,0,0,0|1,0,0]=3 3802 B25R3.1136 CC(CC(c1ccccc1)c2ccccc2)N3CCS(=O)CC3 270004a_100000752083_200000011111 [0,2,0,0,0,0|1,0,0]=3 3803 B25R3.1136 CC1=CCN(CC1)C(C)CC(c2ccccc2)c3ccccc3 270004a_100000693516_200000011111 [0,2,0,0,0,0|0,0,2]=4 3804 B25R3.1136 CC1CCC(CC1)C(=O)CC(c2ccccc2)c3ccccc3 1458a_100000499737_200011216234 [0,2,0,0,0,0|1,0,1]=4 3805 B25R3.1136 CC1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 240690a_100000188429_100000499737 [0,2,0,0,0,0|0,0,1]=3 3806 B25R3.1136 CC1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 527a_100000188429_100000499737 [0,2,0,0,0,0|0,0,1]=3 3807 B25R3.1136 CC1CCN(CC1)C(=O)CP(c2ccccc2)c3ccccc3 240690a_100000188429_200020607205 [0,2,0,0,0,0|1,0,1]=4 3808 B25R3.1136 CC1CCN(CC1)C(=O)CP(c2ccccc2)c3ccccc3 527a_100000188429_200020607205 [0,2,0,0,0,0|1,0,1]=4 3809 B25R3.1136 CC1CCN(CC1)C(C)CC(c2ccccc2)c3ccccc3 270004a_100000188429_200000011111 [0,2,0,0,0,0|0,0,0]=2 3810 B25R3.1136 CN1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 11a_100000188432_100000499737 [0,2,0,0,0,0|1,0,1]=4 3811 B25R3.1136 CN1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 240690a_100000188432_100000499737 [0,2,0,0,0,0|1,0,1]=4 3812 B25R3.1136 CN1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 527a_100000188432_100000499737 [0,2,0,0,0,0|1,0,1]=4 3813 B25R3.1136 O=C(CC(c1ccccc1)c2ccccc2)N3CCC(CC3)F 11a_100015193889_100000499737 [0,2,0,0,0,0|0,0,1]=3 3814 B25R3.1136 O=C(CC(c1ccccc1)c2ccccc2)N3CCC(CC3)F 1626a_100015193889_100000499737 [0,2,0,0,0,0|0,0,1]=3 3815 B25R3.1136 O=C(CC(c1ccccc1)c2ccccc2)N3CCC(CC3)F 240690a_100015193889_100000499737 [0,2,0,0,0,0|0,0,1]=3 3816 B25R3.1136 O=C(CC(c1ccccc1)c2ccccc2)N3CCC(CC3)F 527a_100015193889_100000499737 [0,2,0,0,0,0|0,0,1]=3 3817 B25R3.1136 O=C(CC(c1ccccc1)c2ccccc2)N3CCC(CC3)O 240690a_100025773856_100000499737 [0,2,0,0,0,0|0,0,1]=3 3818 B25R3.1136 O=C(CC(c1ccccc1)c2ccccc2)N3CCC(CC3)O 527a_100025773856_100000499737 [0,2,0,0,0,0|0,0,1]=3 3819 B25R3.1136 O=C(CC(c1ccccc1)c2ccccc2)N3CCS(=O)CC3 240690a_100000752083_100000499737 [0,2,0,0,0,0|1,0,1]=4 3820 B25R3.1136 O=C(CC(c1ccccc1)c2ccccc2)N3CCS(=O)CC3 527a_100000752083_100000499737 [0,2,0,0,0,0|1,0,1]=4 3821 B25R3.1136 O=C(CP(c1ccccc1)c2ccccc2)N3CCC(CC3)F 11a_100015193889_200020607205 [0,2,0,0,0,0|1,0,1]=4 3822 B25R3.1136 O=C(CP(c1ccccc1)c2ccccc2)N3CCC(CC3)F 1626a_100015193889_200020607205 [0,2,0,0,0,0|1,0,1]=4 3823 B25R3.1136 O=C(CP(c1ccccc1)c2ccccc2)N3CCC(CC3)F 240690a_100015193889_200020607205 [0,2,0,0,0,0|1,0,1]=4 3824 B25R3.1136 O=C(CP(c1ccccc1)c2ccccc2)N3CCC(CC3)F 527a_100015193889_200020607205 [0,2,0,0,0,0|1,0,1]=4 3825 B25R3.1136 O=C(CP(c1ccccc1)c2ccccc2)N3CCC(CC3)O 240690a_100025773856_200020607205 [0,2,0,0,0,0|1,0,1]=4 3826 B25R3.1136 O=C(CP(c1ccccc1)c2ccccc2)N3CCC(CC3)O 527a_100025773856_200020607205 [0,2,0,0,0,0|1,0,1]=4 3827 B25R3.23513 CC(NC(c1ccccc1)c2ccc(cc2)Cl)C3CCCCC3 269862a_100000737946_100000210989 [0,2,0,0,0,0|2,0,0]=4 3828 B25R3.23513 CC(NC(c1ccccc1)c2ccc(cc2)F)C3CCCCC3 269862a_100000737529_100000210989 [0,2,0,0,0,0|2,0,0]=4 3829 B25R3.23513 C[C@@H](NC(c1ccccc1)c2ccc(cc2)Cl)C3CCCCC3 2230a_100025707633_100000211669 [0,2,0,0,0,0|2,0,0]=4 3830 B25R3.23513 C[C@@H](NC(c1ccccc1)c2ccc(cc2)Cl)C3CCCCC3 270004a_100025707633_100000211064 [0,2,0,0,0,0|2,0,0]=4 3831 B25R3.23513 C[C@@H](NC(c1ccccc1)c2ccc(cc2)F)C3CCCCC3 270004a_100025707633_100000210425 [0,2,0,0,0,0|2,0,0]=4 3832 B25R3.23513 Cc1ccc(cc1)C(NC(C)C2CCCCC2)c3ccccc3 269862a_100000736602_100000210989 [0,2,0,0,0,0|2,0,0]=4 3833 B25R3.23513 Cc1ccc(cc1)C(N[C@H](C)C2CCCCC2)c3ccccc3 270004a_100025707633_100000210966 [0,2,0,0,0,0|2,0,0]=4 3834 B25R3.24883 CCC(NC(c1ccccc1)c2ccccc2)C3CCCCC3 269862a_100000162943_100011216311 [0,2,0,0,0,0|2,0,0]=4 3835 B25R3.24883 CC[C@H](NC(c1ccccc1)c2ccccc2)C3CCCCC3 2230a_100020639352_100000211591 [0,2,0,0,0,0|2,0,0]=4 3836 B25R3.24883 CC[C@H](NC(c1ccccc1)c2ccccc2)C3CCCCC3 270004a_100020639352_100000210122 [0,2,0,0,0,0|2,0,0]=4 3837 B25R3.24883 N#CC(NC(c1ccccc1)c2ccccc2)C3CCCCC3 2230a_100000767018_100000211591 [0,2,0,0,0,0|2,0,0]=4 3838 B25R3.24883 N#CC(NC(c1ccccc1)c2ccccc2)C3CCCCC3 270004a_100000767018_100000210122 [0,2,0,0,0,0|2,0,0]=4 3839 B25R3.24883 OC[C@H](NC(c1ccccc1)c2ccccc2)C3CCCCC3 2230a_100009817630_100000211591 [0,2,0,0,0,0|2,0,0]=4 3840 B25R3.24883 OC[C@H](NC(c1ccccc1)c2ccccc2)C3CCCCC3 270004a_100009817630_100000210122 [0,2,0,0,0,0|2,0,0]=4 3841 B25R3.25109 CC(NC(c1ccccc1)c2cccc(c2)Cl)C3CCCCC3 269862a_100000741085_100000210989 [0,2,0,0,0,0|2,0,0]=4 3842 B25R3.25109 CC(NC(c1ccccc1)c2cccc(c2)F)C3CCCCC3 269862a_100000686443_100000210989 [0,2,0,0,0,0|2,0,0]=4 3843 B25R3.25109 C[C@@H](NC(c1ccccc1)c2cccc(c2)Cl)C3CCCCC3 270004a_100025707633_100011215489 [0,2,0,0,0,0|2,0,0]=4 3844 B25R3.25109 C[C@@H](NC(c1ccccc1)c2cccc(c2)F)C3CCCCC3 270004a_100025707633_200011219850 [0,2,0,0,0,0|2,0,0]=4 3845 B25R3.25109 Cc1cccc(c1)C(N[C@H](C)C2CCCCC2)c3ccccc3 270004a_100025707633_100011217825 [0,2,0,0,0,0|2,0,0]=4 3846 B25R3.45469 C[C@@H](NC(c1ccccc1)c2ccccc2Cl)C3CCCCC3 270004a_100025707633_100011215288 [0,2,0,0,0,0|2,0,0]=4 3847 B25R3.45469 C[C@@H](NC(c1ccccc1)c2ccccc2F)C3CCCCC3 270004a_100025707633_100011217773 [0,2,0,0,0,0|2,0,0]=4 3848 B25R3.45469 Cc1ccccc1C(NC(C)C2CCCCC2)c3ccccc3 269862a_100000222801_100000210989 [0,2,0,0,0,0|2,0,0]=4 3849 B25R3.45469 Cc1ccccc1C(N[C@H](C)C2CCCCC2)c3ccccc3 2230a_100025707633_100000230135 [0,2,0,0,0,0|2,0,0]=4 3850 B25R3.45469 Cc1ccccc1C(N[C@H](C)C2CCCCC2)c3ccccc3 270004a_100025707633_100000735561 [0,2,0,0,0,0|2,0,0]=4 3851 B25R3.45469 O=C(CC(c1ccccc1)c2ccccc2Cl)N3CCCOC3 11a_100000131196_100015187286 [0,2,0,0,0,0|1,0,1]=4 3852 B25R3.45469 O=C(CC(c1ccccc1)c2ccccc2Cl)N3CCCOC3 240690a_100000131196_100015187286 [0,2,0,0,0,0|1,0,1]=4 3853 B25R3.45469 O=C(CC(c1ccccc1)c2ccccc2Cl)N3CCOCC3 11a_100015191051_100015187286 [0,2,0,0,0,0|1,0,1]=4 3854 B25R3.45469 O=C(CC(c1ccccc1)c2ccccc2Cl)N3CCOCC3 1626a_100015191051_100015187286 [0,2,0,0,0,0|1,0,1]=4 3855 B25R3.45469 O=C(CC(c1ccccc1)c2ccccc2Cl)N3CCOCC3 240690a_100015191051_100015187286 [0,2,0,0,0,0|1,0,1]=4 3856 B25R3.45469 O=C(CC(c1ccccc1)c2ccccc2Cl)N3CCOCC3 527a_100015191051_100015187286 [0,2,0,0,0,0|1,0,1]=4 3857 B25R3.45469 O=C(CC(c1ccccc1)c2ccccc2Cl)N3CCSCC3 11a_100000737611_100015187286 [0,2,0,0,0,0|1,0,1]=4 3858 B25R3.45469 O=C(CC(c1ccccc1)c2ccccc2Cl)N3CCSCC3 240690a_100000737611_100015187286 [0,2,0,0,0,0|1,0,1]=4 3859 B25R3.45469 O=C(CC(c1ccccc1)c2ccccc2Cl)N3CCSCC3 527a_100000737611_100015187286 [0,2,0,0,0,0|1,0,1]=4 3860 B25R3.68061 CC(CC(c1ccccc1)c2ccccc2)N3CCCC(C3)F 270004a_100000697950_200000011111 [0,2,0,0,0,0|0,0,0]=2 3861 B25R3.68061 CC(CC(c1ccccc1)c2ccccc2)N3CCCC(C3)O 270004a_100000211013_200000011111 [0,2,0,0,0,0|0,0,0]=2 3862 B25R3.68061 CC(CC(c1ccccc1)c2ccccc2)N3CCC[C@@H](C3)C 270004a_100000717927_200000011111 [0,2,0,0,0,0|0,0,0]=2 3863 B25R3.68061 CC(CC(c1ccccc1)c2ccccc2)N3CCNC(=O)C3 270004a_100000184651_200000011111 [0,2,0,0,0,0|1,0,1]=4 3864 B25R3.68061 CC(CC(c1ccccc1)c2ccccc2)N3CCOC(=O)C3 270004a_100000131268_200000011111 [0,2,0,0,0,0|1,0,1]=4 3865 B25R3.68061 CC(CC(c1ccccc1)c2ccccc2)N3CCOC(C3)O 270004a_100000688207_200000011111 [0,2,0,0,0,0|1,0,0]=3 3866 B25R3.68061 CC1=CCCN(C1)C(C)CC(c2ccccc2)c3ccccc3 270004a_100000725631_200000011111 [0,2,0,0,0,0|0,0,2]=4 3867 B25R3.68061 CC1CN(CCO1)C(=O)CC(c2ccccc2)c3ccccc3 11a_100000729577_100000499737 [0,2,0,0,0,0|1,0,1]=4 3868 B25R3.68061 CC1CN(CCO1)C(=O)CC(c2ccccc2)c3ccccc3 1626a_100000729577_100000499737 [0,2,0,0,0,0|1,0,1]=4 3869 B25R3.68061 CC1CN(CCO1)C(=O)CC(c2ccccc2)c3ccccc3 240690a_100000729577_100000499737 [0,2,0,0,0,0|1,0,1]=4 3870 B25R3.68061 CC1CN(CCO1)C(=O)CC(c2ccccc2)c3ccccc3 527a_100000729577_100000499737 [0,2,0,0,0,0|1,0,1]=4 3871 B25R3.68061 CC1CN(CCO1)C(C)CC(c2ccccc2)c3ccccc3 270004a_100000729577_200000011111 [0,2,0,0,0,0|1,0,0]=3 3872 B25R3.68061 C[C@H]1CCCN(C1)C(=O)CC(c2ccccc2)c3ccccc3 11a_100000717927_100000499737 [0,2,0,0,0,0|0,0,1]=3 3873 B25R3.68061 C[C@H]1CCCN(C1)C(=O)CC(c2ccccc2)c3ccccc3 240690a_100000717927_100000499737 [0,2,0,0,0,0|0,0,1]=3 3874 B25R3.68061 C[C@H]1CCCN(C1)C(=O)CC(c2ccccc2)c3ccccc3 527a_100000717927_100000499737 [0,2,0,0,0,0|0,0,1]=3 3875 B25R3.68061 C[C@H]1CCCN(C1)C(=O)CP(c2ccccc2)c3ccccc3 11a_100000717927_200020607205 [0,2,0,0,0,0|1,0,1]=4 3876 B25R3.68061 C[C@H]1CCCN(C1)C(=O)CP(c2ccccc2)c3ccccc3 240690a_100000717927_200020607205 [0,2,0,0,0,0|1,0,1]=4 3877 B25R3.68061 C[C@H]1CCCN(C1)C(=O)CP(c2ccccc2)c3ccccc3 527a_100000717927_200020607205 [0,2,0,0,0,0|1,0,1]=4 3878 B25R3.68061 O=C(CC(c1ccccc1)c2ccccc2)N3CCCC(C3)F 11a_100000697950_100000499737 [0,2,0,0,0,0|0,0,1]=3 3879 B25R3.68061 O=C(CC(c1ccccc1)c2ccccc2)N3CCCC(C3)F 1626a_100000697950_100000499737 [0,2,0,0,0,0|0,0,1]=3 3880 B25R3.68061 O=C(CC(c1ccccc1)c2ccccc2)N3CCCC(C3)F 240690a_100000697950_100000499737 [0,2,0,0,0,0|0,0,1]=3 3881 B25R3.68061 O=C(CC(c1ccccc1)c2ccccc2)N3CCCC(C3)F 527a_100000697950_100000499737 [0,2,0,0,0,0|0,0,1]=3 3882 B25R3.68061 O=C(CC(c1ccccc1)c2ccccc2)N3CCCC(C3)O 240690a_100000211013_100000499737 [0,2,0,0,0,0|0,0,1]=3 3883 B25R3.68061 O=C(CC(c1ccccc1)c2ccccc2)N3CCCC(C3)O 527a_100000211013_100000499737 [0,2,0,0,0,0|0,0,1]=3 3884 B25R3.68061 O=C(CC(c1ccccc1)c2ccccc2)N3CCOC(C3)O 11a_100000688207_100000499737 [0,2,0,0,0,0|1,0,1]=4 3885 B25R3.68061 O=C(CC(c1ccccc1)c2ccccc2)N3CCOC(C3)O 240690a_100000688207_100000499737 [0,2,0,0,0,0|1,0,1]=4 3886 B25R3.68061 O=C(CC(c1ccccc1)c2ccccc2)N3CCOC(C3)O 527a_100000688207_100000499737 [0,2,0,0,0,0|1,0,1]=4 3887 B25R3.68061 O=C(CP(c1ccccc1)c2ccccc2)N3CCCC(C3)F 11a_100000697950_200020607205 [0,2,0,0,0,0|1,0,1]=4 3888 B25R3.68061 O=C(CP(c1ccccc1)c2ccccc2)N3CCCC(C3)F 1626a_100000697950_200020607205 [0,2,0,0,0,0|1,0,1]=4 3889 B25R3.68061 O=C(CP(c1ccccc1)c2ccccc2)N3CCCC(C3)F 240690a_100000697950_200020607205 [0,2,0,0,0,0|1,0,1]=4 3890 B25R3.68061 O=C(CP(c1ccccc1)c2ccccc2)N3CCCC(C3)F 527a_100000697950_200020607205 [0,2,0,0,0,0|1,0,1]=4 3891 B25R3.68061 O=C(CP(c1ccccc1)c2ccccc2)N3CCCC(C3)O 240690a_100000211013_200020607205 [0,2,0,0,0,0|1,0,1]=4 3892 B25R3.68061 O=C(CP(c1ccccc1)c2ccccc2)N3CCCC(C3)O 527a_100000211013_200020607205 [0,2,0,0,0,0|1,0,1]=4 3893 B25R3.2609278 CC(CC(c1ccccc1)c2ccccc2)N3CCOC[C@@H]3C 270004a_100009815349_200000011111 [0,2,0,0,0,0|1,0,0]=3 3894 B25R3.2609278 CC1CCCCN1C(=O)CC(c2ccccc2)c3ccccc3 11a_100000211376_100000499737 [0,2,0,0,0,0|0,0,1]=3 3895 B25R3.2609278 CC1CCCCN1C(=O)CC(c2ccccc2)c3ccccc3 1626a_100000211376_100000499737 [0,2,0,0,0,0|0,0,1]=3 3896 B25R3.2609278 CC1CCCCN1C(=O)CC(c2ccccc2)c3ccccc3 240690a_100000211376_100000499737 [0,2,0,0,0,0|0,0,1]=3 3897 B25R3.2609278 CC1CCCCN1C(=O)CC(c2ccccc2)c3ccccc3 527a_100000211376_100000499737 [0,2,0,0,0,0|0,0,1]=3 3898 B25R3.2609278 CC1CCCCN1C(=O)CP(c2ccccc2)c3ccccc3 11a_100000211376_200020607205 [0,2,0,0,0,0|1,0,1]=4 3899 B25R3.2609278 CC1CCCCN1C(=O)CP(c2ccccc2)c3ccccc3 1626a_100000211376_200020607205 [0,2,0,0,0,0|1,0,1]=4 3900 B25R3.2609278 CC1CCCCN1C(=O)CP(c2ccccc2)c3ccccc3 240690a_100000211376_200020607205 [0,2,0,0,0,0|1,0,1]=4 3901 B25R3.2609278 CC1CCCCN1C(=O)CP(c2ccccc2)c3ccccc3 527a_100000211376_200020607205 [0,2,0,0,0,0|1,0,1]=4 3902 B25R3.2609278 CC1CCCCN1C(C)CC(c2ccccc2)c3ccccc3 270004a_100000211376_200000011111 [0,2,0,0,0,0|0,0,0]=2 3903 B25R3.2609278 C[C@H]1COCCN1C(=O)CC(c2ccccc2)c3ccccc3 11a_100009815349_100000499737 [0,2,0,0,0,0|1,0,1]=4 3904 B25R3.2609278 C[C@H]1COCCN1C(=O)CC(c2ccccc2)c3ccccc3 240690a_100009815349_100000499737 [0,2,0,0,0,0|1,0,1]=4 3905 B25R3.2609278 C[C@H]1COCCN1C(=O)CC(c2ccccc2)c3ccccc3 527a_100009815349_100000499737 [0,2,0,0,0,0|1,0,1]=4 3906 B25R3.6896509 CC(C(=O)C(c1ccccc1)c2ccccc2)C3CCCCC3 1458a_100011435303_100011216954 [0,2,0,0,0,0|1,0,1]=4 3907 B25R3.6896509 C[C@@H](C(=O)C(c1ccccc1)c2ccccc2)N3CCOCC3 1458a_100000729938_100011216954 [0,2,0,0,0,0|1,0,1]=4 3908 B25R3.6896509 O=C(C(=O)N1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_200011297168_100011216954 [0,2,0,0,0,0|0,0,2]=4 3909 B25R3.6896509 O=C(C(c1ccccc1)c2ccccc2)C(O)C3CCCCC3 1458a_100000242593_100011216954 [0,2,0,0,0,0|1,0,1]=4 3910 B25R3.12843 CCc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100012339983 [0,2,0,0,0,0|2,0,0]=4 3911 B25R3.12843 COc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 2230a_100000296159_100000211423 [0,2,0,0,0,0|2,0,0]=4 3912 B25R3.12843 COc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 269862a_100000296159_100000211278 [0,2,0,0,0,0|2,0,0]=4 3913 B25R3.12843 COc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 34a_100000296159_100000211423 [0,2,0,0,0,0|2,0,0]=4 3914 B25R3.12843 COc1cccc(c1)C(OCC2CCCCC2)c3ccccc3 34a_200017279661_100000211423 [0,2,0,0,0,0|2,0,0]=4 3915 B25R3.12843 COc1cccc(c1)C(OCC2CCCCC2)c3ccccc3 7a_200017279661_100000211423 [0,2,0,0,0,0|2,0,0]=4 3916 B25R3.22825 Fc1cc(cc(c1)C(NCC2CCCCC2)c3ccccc3)F 270004a_100000210473_100011218726 [0,2,0,0,0,0|2,0,0]=4 3917 B25R3.22825 Fc1cc(cc(c1)C(OCC2CCCCC2)c3ccccc3)F 34a_200005489329_100000211423 [0,2,0,0,0,0|2,0,0]=4 3918 B25R3.22825 Fc1cc(cc(c1)C(OCC2CCCCC2)c3ccccc3)F 7a_200005489329_100000211423 [0,2,0,0,0,0|2,0,0]=4 3919 B25R3.26855 Fc1ccc(c(c1)C(NCC2CCCCC2)c3ccccc3)F 270004a_100000210473_100011217027 [0,2,0,0,0,0|2,0,0]=4 3920 B25R3.26855 Nc1ccc(cc1C(OCC2CCCCC2)c3ccccc3)Cl 34a_100000011915_100000211423 [0,2,0,0,0,0|2,0,0]=4 3921 B25R3.26855 Nc1ccc(cc1C(OCC2CCCCC2)c3ccccc3)Cl 7a_100000011915_100000211423 [0,2,0,0,0,0|2,0,0]=4 3922 B25R3.117189 Cc1ccc(cc1C)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000185006 [0,2,0,0,0,0|2,0,0]=4 3923 B25R3.117189 Fc1ccc(cc1F)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011218205 [0,2,0,0,0,0|2,0,0]=4 3924 B25R3.743843 Fc1ccc(cc1)C(NCC2CCCCC2)c3cccc(c3)Br 270004a_100000210473_200011267472 [0,2,0,0,0,0|2,0,0]=4 3925 B25R3.743843 Fc1ccc(cc1)C(NCC2CCCCC2)c3cccc(c3)F 270004a_100000210473_100000185714 [0,2,0,0,0,0|2,0,0]=4 3926 B25R3.743843 Fc1cccc(c1)C(NCC2CCCCC2)c3ccc(cc3)Br 2230a_200000296200_100000211423 [0,2,0,0,0,0|2,0,0]=4 3927 B25R3.743843 Fc1cccc(c1)C(NCC2CCCCC2)c3ccc(cc3)Br 269862a_200000296200_100000211278 [0,2,0,0,0,0|2,0,0]=4 3928 B25R3.743843 Fc1cccc(c1)C(NCC2CCCCC2)c3ccc(cc3)Br 34a_200000296200_100000211423 [0,2,0,0,0,0|2,0,0]=4 3929 B25R3.746999 CC1CCC(CC1)CNC(c2ccccc2)c3cccc(c3)Br 270004a_103436935547_100011267660 [0,2,0,0,0,0|2,0,0]=4 3930 B25R3.746999 CC1CCC(CC1)CNC(c2ccccc2)c3cccc(c3)Cl 270004a_103436935547_100011215489 [0,2,0,0,0,0|2,0,0]=4 3931 B25R3.746999 CC1CCC(CC1)CNC(c2ccccc2)c3cccc(c3)F 270004a_103436935547_200011219850 [0,2,0,0,0,0|2,0,0]=4 3932 B25R3.746999 Cc1cccc(c1)C(NCC2CCC(CC2)C)c3ccccc3 270004a_103436935547_100011217825 [0,2,0,0,0,0|2,0,0]=4 3933 B25R3.2572876 CN(CC1CCCCC1)C(c2ccccc2)c3cccc(c3)Cl 270004a_100000736448_100011215489 [0,2,0,0,0,0|2,0,0]=4 3934 B25R3.2572876 CN(CC1CCCCC1)C(c2ccccc2)c3cccc(c3)F 270004a_100000736448_200011219850 [0,2,0,0,0,0|2,0,0]=4 3935 B25R3.2572876 Cc1cccc(c1)C(c2ccccc2)N(C)CC3CCCCC3 270004a_100000736448_100011217825 [0,2,0,0,0,0|2,0,0]=4 3936 B25R3.2577721 Cc1cccc(c1)C(NCC2CCCCC2O)c3ccccc3 270004a_100011216029_100011217825 [0,2,0,0,0,0|2,0,0]=4 3937 B25R3.2577721 OC1CCCCC1CNC(c2ccccc2)c3cccc(c3)Br 270004a_100011216029_100011267660 [0,2,0,0,0,0|2,0,0]=4 3938 B25R3.2577721 OC1CCCCC1CNC(c2ccccc2)c3cccc(c3)Cl 270004a_100011216029_100011215489 [0,2,0,0,0,0|2,0,0]=4 3939 B25R3.2577721 OC1CCCCC1CNC(c2ccccc2)c3cccc(c3)F 270004a_100011216029_200011219850 [0,2,0,0,0,0|2,0,0]=4 3940 B25R3.2577885 Fc1cccc(c1)C(NCC2CCCCC2)c3cccc(c3)Br 270004a_100000210473_100000687359 [0,2,0,0,0,0|2,0,0]=4 3941 B25R3.2577885 Fc1cccc(c1)C(NCC2CCCCC2)c3cccc(c3)F 270004a_100000210473_100011215574 [0,2,0,0,0,0|2,0,0]=4 3942 B25R3.2577885 Fc1cccc(c1)C(OCC2CCCCC2)c3cccc(c3)F 34a_200000373135_100000211423 [0,2,0,0,0,0|2,0,0]=4 3943 B25R3.2577885 Fc1cccc(c1)C(OCC2CCCCC2)c3cccc(c3)F 7a_200000373135_100000211423 [0,2,0,0,0,0|2,0,0]=4 3944 B25R3.2577889 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3F 270004a_100000210473_100011218100 [0,2,0,0,0,0|2,0,0]=4 3945 B25R3.29688027 Cc1cccc(c1)C(NCC2CCCC(C2)O)c3ccccc3 270004a_100011254705_100011217825 [0,2,0,0,0,0|2,0,0]=4 3946 B25R3.29688027 OC1CCCC(C1)CNC(c2ccccc2)c3cccc(c3)Br 270004a_100011254705_100011267660 [0,2,0,0,0,0|2,0,0]=4 3947 B25R3.29688027 OC1CCCC(C1)CNC(c2ccccc2)c3cccc(c3)Cl 270004a_100011254705_100011215489 [0,2,0,0,0,0|2,0,0]=4 3948 B25R3.29688027 OC1CCCC(C1)CNC(c2ccccc2)c3cccc(c3)F 270004a_100011254705_200011219850 [0,2,0,0,0,0|2,0,0]=4 3949 B25R3.123585167 CC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)Cl 269862a_100000741085_100011935227 [0,2,0,0,0,0|2,0,0]=4 3950 B25R3.123585167 CC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)Cl 270004a_100000706052_100011215489 [0,2,0,0,0,0|2,0,0]=4 3951 B25R3.123585167 CC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)F 269862a_100000686443_100011935227 [0,2,0,0,0,0|2,0,0]=4 3952 B25R3.123585167 CC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)F 270004a_100000706052_200011219850 [0,2,0,0,0,0|2,0,0]=4 3953 B25R3.123585167 Cc1cccc(c1)C(NCC2(CCCCC2)C)c3ccccc3 270004a_100000706052_100011217825 [0,2,0,0,0,0|2,0,0]=4 3954 B25R3.123585167 Cc1cccc(c1)C(NCC2(CCCCC2)O)c3ccccc3 270004a_100000748649_100011217825 [0,2,0,0,0,0|2,0,0]=4 3955 B25R3.123585167 OC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)Br 270004a_100000748649_100011267660 [0,2,0,0,0,0|2,0,0]=4 3956 B25R3.123585167 OC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)Cl 270004a_100000748649_100011215489 [0,2,0,0,0,0|2,0,0]=4 3957 B25R3.123585167 OC1(CCCCC1)CNC(c2ccccc2)c3cccc(c3)F 270004a_100000748649_200011219850 [0,2,0,0,0,0|2,0,0]=4 3958 B25R3.13889 COc1ccccc1C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100011218802 [0,2,0,0,0,0|2,0,0]=4 3959 B25R3.61813 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3Cl 270004a_100000736448_100011215288 [0,2,0,0,0,0|2,0,0]=4 3960 B25R3.61813 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3F 270004a_100000736448_100011217773 [0,2,0,0,0,0|2,0,0]=4 3961 B25R3.61813 Cc1ccccc1C(c2ccccc2)N(C)CC3CCCCC3 2230a_100000736448_100000230135 [0,2,0,0,0,0|2,0,0]=4 3962 B25R3.61813 Cc1ccccc1C(c2ccccc2)N(C)CC3CCCCC3 269982a_100000736448_100000230135 [0,2,0,0,0,0|2,0,0]=4 3963 B25R3.61813 Cc1ccccc1C(c2ccccc2)N(C)CC3CCCCC3 270004a_100000736448_100000735561 [0,2,0,0,0,0|2,0,0]=4 3964 B25R3.743847 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3Cl 270004a_100000210473_100000758304 [0,2,0,0,0,0|2,0,0]=4 3965 B25R3.743847 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3Br 270004a_100000210473_100011267497 [0,2,0,0,0,0|2,0,0]=4 3966 B25R3.743847 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3Cl 270004a_100000210473_100000297523 [0,2,0,0,0,0|2,0,0]=4 3967 B25R3.747003 CC1CCC(CC1)CNC(c2ccccc2)c3ccccc3Br 270004a_103436935547_100000198044 [0,2,0,0,0,0|2,0,0]=4 3968 B25R3.747003 CC1CCC(CC1)CNC(c2ccccc2)c3ccccc3Cl 270004a_103436935547_100011215288 [0,2,0,0,0,0|2,0,0]=4 3969 B25R3.747003 CC1CCC(CC1)CNC(c2ccccc2)c3ccccc3F 270004a_103436935547_100011217773 [0,2,0,0,0,0|2,0,0]=4 3970 B25R3.747003 Cc1ccccc1C(NCC2CCC(CC2)C)c3ccccc3 2230a_103436935547_100000230135 [0,2,0,0,0,0|2,0,0]=4 3971 B25R3.747003 Cc1ccccc1C(NCC2CCC(CC2)C)c3ccccc3 270004a_103436935547_100000735561 [0,2,0,0,0,0|2,0,0]=4 3972 B25R3.2630524 Cc1ccc(c(c1)C)C(NCC2CCCCC2)c3ccccc3 2230a_100102946505_100000211423 [0,2,0,0,0,0|2,0,0]=4 3973 B25R3.2630524 Cc1ccc(c(c1)C)C(NCC2CCCCC2)c3ccccc3 269862a_100102946505_100000211278 [0,2,0,0,0,0|2,0,0]=4 3974 B25R3.2630524 Cc1ccc(c(c1)C)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000185008 [0,2,0,0,0,0|2,0,0]=4 3975 B25R3.2630524 Cc1ccc(c(c1)C)C(NCC2CCCCC2)c3ccccc3 34a_100102946505_100000211423 [0,2,0,0,0,0|2,0,0]=4 3976 B25R3.2630524 Fc1ccc(c(c1)F)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_200011215470 [0,2,0,0,0,0|2,0,0]=4 3977 B25R3.2961455 Cc1ccccc1C(NCC2CCCCC2O)c3ccccc3 270004a_100011216029_100000735561 [0,2,0,0,0,0|2,0,0]=4 3978 B25R3.2961455 OC1CCCCC1CNC(c2ccccc2)c3ccccc3Br 270004a_100011216029_100000198044 [0,2,0,0,0,0|2,0,0]=4 3979 B25R3.2961455 OC1CCCCC1CNC(c2ccccc2)c3ccccc3Cl 270004a_100011216029_100011215288 [0,2,0,0,0,0|2,0,0]=4 3980 B25R3.2961455 OC1CCCCC1CNC(c2ccccc2)c3ccccc3F 270004a_100011216029_100011217773 [0,2,0,0,0,0|2,0,0]=4 3981 B25R3.29688031 Cc1ccccc1C(NCC2CCCC(C2)O)c3ccccc3 2230a_100011254705_100000230135 [0,2,0,0,0,0|2,0,0]=4 3982 B25R3.29688031 Cc1ccccc1C(NCC2CCCC(C2)O)c3ccccc3 270004a_100011254705_100000735561 [0,2,0,0,0,0|2,0,0]=4 3983 B25R3.29688031 OC1CCCC(C1)CNC(c2ccccc2)c3ccccc3Br 270004a_100011254705_100000198044 [0,2,0,0,0,0|2,0,0]=4 3984 B25R3.29688031 OC1CCCC(C1)CNC(c2ccccc2)c3ccccc3Cl 270004a_100011254705_100011215288 [0,2,0,0,0,0|2,0,0]=4 3985 B25R3.29688031 OC1CCCC(C1)CNC(c2ccccc2)c3ccccc3F 270004a_100011254705_100011217773 [0,2,0,0,0,0|2,0,0]=4 3986 B25R3.128396070 CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3Cl 270004a_100000706052_100011215288 [0,2,0,0,0,0|2,0,0]=4 3987 B25R3.128396070 CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3F 270004a_100000706052_100011217773 [0,2,0,0,0,0|2,0,0]=4 3988 B25R3.128396070 Cc1ccccc1C(NCC2(CCCCC2)C)c3ccccc3 2230a_100000706052_100000230135 [0,2,0,0,0,0|2,0,0]=4 3989 B25R3.128396070 Cc1ccccc1C(NCC2(CCCCC2)C)c3ccccc3 269862a_100000222801_100011935227 [0,2,0,0,0,0|2,0,0]=4 3990 B25R3.128396070 Cc1ccccc1C(NCC2(CCCCC2)C)c3ccccc3 270004a_100000706052_100000735561 [0,2,0,0,0,0|2,0,0]=4 3991 B25R3.128396070 Cc1ccccc1C(NCC2(CCCCC2)O)c3ccccc3 2230a_100000748649_100000230135 [0,2,0,0,0,0|2,0,0]=4 3992 B25R3.128396070 Cc1ccccc1C(NCC2(CCCCC2)O)c3ccccc3 270004a_100000748649_100000735561 [0,2,0,0,0,0|2,0,0]=4 3993 B25R3.128396070 Cc1ccccc1C(OCC2(CCCCC2)F)c3ccccc3 7a_100000090305_100000230135 [0,2,0,0,0,0|2,0,0]=4 3994 B25R3.128396070 OC1(CCCCC1)CNC(c2ccccc2)c3ccccc3Br 270004a_100000748649_100000198044 [0,2,0,0,0,0|2,0,0]=4 3995 B25R3.128396070 OC1(CCCCC1)CNC(c2ccccc2)c3ccccc3Cl 270004a_100000748649_100011215288 [0,2,0,0,0,0|2,0,0]=4 3996 B25R3.128396070 OC1(CCCCC1)CNC(c2ccccc2)c3ccccc3F 270004a_100000748649_100011217773 [0,2,0,0,0,0|2,0,0]=4 3997 B25R3.45336 CC1CCCC(C1NCC(c2ccccc2)c3ccccc3)C 269862a_100000739227_100000211995 [0,2,0,0,0,0|2,0,0]=4 3998 B25R3.45336 CC1CCCC(N1CCC(c2ccccc2)c3ccccc3)C 2230a_100000210447_100009813428 [0,2,0,0,0,0|0,0,0]=2 3999 B25R3.45336 CC1CCCC(N1CCC(c2ccccc2)c3ccccc3)C 269982a_100000210447_100009813428 [0,2,0,0,0,0|0,0,0]=2 4000 B25R3.45336 CC1CCCC(N1CCC(c2ccccc2)c3ccccc3)C 34a_100000210447_100009813428 [0,2,0,0,0,0|0,0,0]=2 4001 B25R3.45336 CC1CCCC(N1CC[S+](c2ccccc2)c3ccccc3)C 2230a_100000210447_100010140906 [0,2,0,0,0,0|1,0,0]=3 4002 B25R3.45336 CC1CCCC(N1CC[S+](c2ccccc2)c3ccccc3)C 269982a_100000210447_100010140906 [0,2,0,0,0,0|1,0,0]=3 4003 B25R3.45336 C[C@@H]1COC[C@@H](N1CCC(c2ccccc2)c3ccccc3)C 2230a_100103153222_100009813428 [0,2,0,0,0,0|1,0,0]=3 4004 B25R3.45336 C[C@@H]1COC[C@@H](N1CCC(c2ccccc2)c3ccccc3)C 269982a_100103153222_100009813428 [0,2,0,0,0,0|1,0,0]=3 4005 B25R3.45336 C[C@@H]1COC[C@@H](N1CCC(c2ccccc2)c3ccccc3)C 34a_100103153222_100009813428 [0,2,0,0,0,0|1,0,0]=3 4006 B25R3.45336 C[C@@H]1COC[C@@H](N1CC[S+](c2ccccc2)c3ccccc3)C 2230a_100103153222_100010140906 [0,2,0,0,0,0|2,0,0]=4 4007 B25R3.45336 C[C@@H]1COC[C@@H](N1CC[S+](c2ccccc2)c3ccccc3)C 269982a_100103153222_100010140906 [0,2,0,0,0,0|2,0,0]=4 4008 B25R3.137631 C#CC1CCCCN1CCC(c2ccccc2)c3ccccc3 2230a_200020621307_100009813428 [0,2,0,0,0,0|0,0,0]=2 4009 B25R3.137631 C#CC1CCCCN1CCC(c2ccccc2)c3ccccc3 269982a_200020621307_100009813428 [0,2,0,0,0,0|0,0,0]=2 4010 B25R3.137631 C#CC1CCCCN1CCC(c2ccccc2)c3ccccc3 34a_200020621307_100009813428 [0,2,0,0,0,0|0,0,0]=2 4011 B25R3.137631 C#CC1CCCCN1CC[S+](c2ccccc2)c3ccccc3 2230a_200020621307_100010140906 [0,2,0,0,0,0|1,0,0]=3 4012 B25R3.137631 C#CC1CCCCN1CC[S+](c2ccccc2)c3ccccc3 269982a_200020621307_100010140906 [0,2,0,0,0,0|1,0,0]=3 4013 B25R3.137631 CCC1CCCCC1NCC(c2ccccc2)c3ccccc3 269862a_100000739227_100000757040 [0,2,0,0,0,0|2,0,0]=4 4014 B25R3.137631 CCC1CCCCC1NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000757040 [0,2,0,0,0,0|2,0,0]=4 4015 B25R3.137631 CCC1CCCCN1CC=C(c2ccccc2)c3ccccc3 270004a_100000210034_100000050448 [0,2,0,0,0,0|0,0,2]=4 4016 B25R3.137631 CCC1CCCCN1CCC(c2ccccc2)c3ccccc3 2230a_100000210034_100009813428 [0,2,0,0,0,0|0,0,0]=2 4017 B25R3.137631 CCC1CCCCN1CCC(c2ccccc2)c3ccccc3 269982a_100000210034_100009813428 [0,2,0,0,0,0|0,0,0]=2 4018 B25R3.137631 CCC1CCCCN1CCC(c2ccccc2)c3ccccc3 34a_100000210034_100009813428 [0,2,0,0,0,0|0,0,0]=2 4019 B25R3.137631 CCC1CCCCN1CC[S+](c2ccccc2)c3ccccc3 2230a_100000210034_100010140906 [0,2,0,0,0,0|1,0,0]=3 4020 B25R3.137631 CCC1CCCCN1CC[S+](c2ccccc2)c3ccccc3 269982a_100000210034_100010140906 [0,2,0,0,0,0|1,0,0]=3 4021 B25R3.137631 CC[C@H]1COCCN1CCC(c2ccccc2)c3ccccc3 2230a_100016988097_100009813428 [0,2,0,0,0,0|1,0,0]=3 4022 B25R3.137631 CC[C@H]1COCCN1CCC(c2ccccc2)c3ccccc3 269982a_100016988097_100009813428 [0,2,0,0,0,0|1,0,0]=3 4023 B25R3.137631 CC[C@H]1COCCN1CCC(c2ccccc2)c3ccccc3 34a_100016988097_100009813428 [0,2,0,0,0,0|1,0,0]=3 4024 B25R3.137631 CC[C@H]1COCCN1CC[S+](c2ccccc2)c3ccccc3 2230a_100016988097_100010140906 [0,2,0,0,0,0|2,0,0]=4 4025 B25R3.137631 CC[C@H]1COCCN1CC[S+](c2ccccc2)c3ccccc3 269982a_100016988097_100010140906 [0,2,0,0,0,0|2,0,0]=4 4026 B25R3.137631 COC1CCCCC1NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000740605 [0,2,0,0,0,0|2,0,0]=4 4027 B25R3.137631 N#CC1CCCCN1CCC(c2ccccc2)c3ccccc3 34a_100016989756_100009813428 [0,2,0,0,0,0|0,0,0]=2 4028 B25R3.137631 OCC1CCCCC1NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100009861125 [0,2,0,0,0,0|2,0,0]=4 4029 B25R3.137631 OCC1CCCCN1CCC(c2ccccc2)c3ccccc3 2230a_100000210821_100009813428 [0,2,0,0,0,0|0,0,0]=2 4030 B25R3.137631 OCC1CCCCN1CCC(c2ccccc2)c3ccccc3 269982a_100000210821_100009813428 [0,2,0,0,0,0|0,0,0]=2 4031 B25R3.137631 OCC1CCCCN1CCC(c2ccccc2)c3ccccc3 34a_100000210821_100009813428 [0,2,0,0,0,0|0,0,0]=2 4032 B25R3.137631 OCC1CCCCN1CC[S+](c2ccccc2)c3ccccc3 2230a_100000210821_100010140906 [0,2,0,0,0,0|1,0,0]=3 4033 B25R3.137631 OCC1CCCCN1CC[S+](c2ccccc2)c3ccccc3 269982a_100000210821_100010140906 [0,2,0,0,0,0|1,0,0]=3 4034 B25R3.137631 OC[C@@H]1COCCN1CCC(c2ccccc2)c3ccccc3 2230a_100000717676_100009813428 [0,2,0,0,0,0|1,0,0]=3 4035 B25R3.137631 OC[C@@H]1COCCN1CCC(c2ccccc2)c3ccccc3 269982a_100000717676_100009813428 [0,2,0,0,0,0|1,0,0]=3 4036 B25R3.137631 OC[C@@H]1COCCN1CCC(c2ccccc2)c3ccccc3 34a_100000717676_100009813428 [0,2,0,0,0,0|1,0,0]=3 4037 B25R3.137631 OC[C@@H]1COCCN1CC[S+](c2ccccc2)c3ccccc3 2230a_100000717676_100010140906 [0,2,0,0,0,0|2,0,0]=4 4038 B25R3.137631 OC[C@@H]1COCCN1CC[S+](c2ccccc2)c3ccccc3 269982a_100000717676_100010140906 [0,2,0,0,0,0|2,0,0]=4 4039 B25R3.745268 Cc1ccc(cc1)C(NCC2CCCCC2O)c3ccccc3 270004a_100011216029_100000210966 [0,2,0,0,0,0|2,0,0]=4 4040 B25R3.745268 OC1CCCCC1CNC(c2ccccc2)c3ccc(cc3)Br 270004a_100011216029_100000718703 [0,2,0,0,0,0|2,0,0]=4 4041 B25R3.745268 OC1CCCCC1CNC(c2ccccc2)c3ccc(cc3)Cl 270004a_100011216029_100000211064 [0,2,0,0,0,0|2,0,0]=4 4042 B25R3.745268 OC1CCCCC1CNC(c2ccccc2)c3ccc(cc3)F 270004a_100011216029_100000210425 [0,2,0,0,0,0|2,0,0]=4 4043 B25R3.2630596 C[C@H]1CN(CCN1CCC(c2ccccc2)c3ccccc3)C 2230a_100012002466_100009813428 [0,2,0,0,0,0|1,0,0]=3 4044 B25R3.2630596 C[C@H]1CN(CCN1CCC(c2ccccc2)c3ccccc3)C 269982a_100012002466_100009813428 [0,2,0,0,0,0|1,0,0]=3 4045 B25R3.2630596 C[C@H]1CN(CCN1CC[S+](c2ccccc2)c3ccccc3)C 2230a_100012002466_100010140906 [0,2,0,0,0,0|2,0,0]=4 4046 B25R3.2630596 C[C@H]1CN(CCN1CC[S+](c2ccccc2)c3ccccc3)C 269982a_100012002466_100010140906 [0,2,0,0,0,0|2,0,0]=4 4047 B25R3.2892036 CC1(CCCCC1NCC(c2ccccc2)c3ccccc3)C 269862a_100000739227_100000031690 [0,2,0,0,0,0|2,0,0]=4 4048 B25R3.2892036 CC1(COCCN1CCC(c2ccccc2)c3ccccc3)C 2230a_100000724681_100009813428 [0,2,0,0,0,0|1,0,0]=3 4049 B25R3.2892036 CC1(COCCN1CCC(c2ccccc2)c3ccccc3)C 269982a_100000724681_100009813428 [0,2,0,0,0,0|1,0,0]=3 4050 B25R3.2892036 CC1(COCCN1CCC(c2ccccc2)c3ccccc3)C 34a_100000724681_100009813428 [0,2,0,0,0,0|1,0,0]=3 4051 B25R3.2892036 CC1(COCCN1CC[S+](c2ccccc2)c3ccccc3)C 2230a_100000724681_100010140906 [0,2,0,0,0,0|2,0,0]=4 4052 B25R3.2892036 CC1(COCCN1CC[S+](c2ccccc2)c3ccccc3)C 269982a_100000724681_100010140906 [0,2,0,0,0,0|2,0,0]=4 4053 B25R3.2892036 FC1(CCCCC1NCC(c2ccccc2)c3ccccc3)F 34a_100000739227_200009832135 [0,2,0,0,0,0|2,0,0]=4 4054 B25R3.2892036 FC1(CCCCC1OCC(c2ccccc2)c3ccccc3)F 34a_100011215272_200009832135 [0,2,0,0,0,0|2,0,0]=4 4055 B25R3.2958327 CC1CCCCN1CC(=O)N(c2ccccc2)c3ccccc3 2230a_100000211376_200015198546 [0,2,0,0,0,0|1,0,1]=4 4056 B25R3.2958327 CC1CCCCN1CC(=O)N(c2ccccc2)c3ccccc3 269982a_100000211376_200015198546 [0,2,0,0,0,0|1,0,1]=4 4057 B25R3.2961275 CC1CCCCC1NCC(C)(c2ccccc2)c3ccccc3 269862a_100000706881_100000210921 [0,2,0,0,0,0|2,0,0]=4 4058 B25R3.2961275 CC1CCCCC1NCC(C)(c2ccccc2)c3ccccc3 270004a_100000706881_100000210921 [0,2,0,0,0,0|2,0,0]=4 4059 B25R3.3704162 CC1C(=O)NCCN1CCC(c2ccccc2)c3ccccc3 2230a_100000750721_100009813428 [0,2,0,0,0,0|1,0,1]=4 4060 B25R3.3704162 CC1C(=O)NCCN1CCC(c2ccccc2)c3ccccc3 269982a_100000750721_100009813428 [0,2,0,0,0,0|1,0,1]=4 4061 B25R3.3704162 CC1C(=O)NCCN1CCC(c2ccccc2)c3ccccc3 34a_100000750721_100009813428 [0,2,0,0,0,0|1,0,1]=4 4062 B25R3.3729861 CC1CCC(C(C1)NCC(c2ccccc2)c3ccccc3)C 269862a_100000739227_100000034887 [0,2,0,0,0,0|2,0,0]=4 4063 B25R3.3729861 CC1CCC(C(C1)NCC(c2ccccc2)c3ccccc3)C 270004a_100000739227_100000034887 [0,2,0,0,0,0|2,0,0]=4 4064 B25R3.3729861 C[C@@H]1CN([C@@H](CO1)C)CCC(c2ccccc2)c3ccccc3 2230a_100016991869_100009813428 [0,2,0,0,0,0|1,0,0]=3 4065 B25R3.3729861 C[C@@H]1CN([C@@H](CO1)C)CCC(c2ccccc2)c3ccccc3 269982a_100016991869_100009813428 [0,2,0,0,0,0|1,0,0]=3 4066 B25R3.3729861 C[C@@H]1CN([C@@H](CO1)C)CCC(c2ccccc2)c3ccccc3 34a_100016991869_100009813428 [0,2,0,0,0,0|1,0,0]=3 4067 B25R3.3729861 C[C@@H]1CN([C@@H](CO1)C)CC[S+](c2ccccc2)c3ccccc3 2230a_100016991869_100010140906 [0,2,0,0,0,0|2,0,0]=4 4068 B25R3.3729861 C[C@@H]1CN([C@@H](CO1)C)CC[S+](c2ccccc2)c3ccccc3 269982a_100016991869_100010140906 [0,2,0,0,0,0|2,0,0]=4 4069 B25R3.82776 CC(C(=O)CC1CCCCC1)(c2ccccc2)c3ccccc3 1458a_100000752439_100000211423 [0,2,0,0,0,0|1,0,1]=4 4070 B25R3.82776 C[C@H](NC1CCCCC1)C(O)(c2ccccc2)c3ccccc3 270004a_100016988073_100000210434 [0,2,0,0,0,0|2,0,0]=4 4071 B25R3.120105 CC1CCC(CC1)CC(=O)C(c2ccccc2)c3ccccc3 1458a_100011215564_100011216954 [0,2,0,0,0,0|1,0,1]=4 4072 B25R3.120105 CC1CCN(CC1)CC(=O)C(c2ccccc2)c3ccccc3 1458a_100000238061_100011216954 [0,2,0,0,0,0|0,0,1]=3 4073 B25R3.120105 CC1CCN(CC1)CC(=O)N(c2ccccc2)c3ccccc3 2230a_100000188429_200015198546 [0,2,0,0,0,0|1,0,1]=4 4074 B25R3.120105 CC1CCN(CC1)CC(=O)N(c2ccccc2)c3ccccc3 269982a_100000188429_200015198546 [0,2,0,0,0,0|1,0,1]=4 4075 B25R3.120105 CN1CCN(CC1)CC(=O)C(c2ccccc2)c3ccccc3 1458a_100000753313_100011216954 [0,2,0,0,0,0|1,0,1]=4 4076 B25R3.120105 O=C(CC1CCC(CC1)O)C(c2ccccc2)c3ccccc3 1458a_100012184027_100011216954 [0,2,0,0,0,0|1,0,1]=4 4077 B25R3.120105 O=C(CN1CCC(CC1)F)N(c2ccccc2)c3ccccc3 2230a_100015193889_200015198546 [0,2,0,0,0,0|1,0,1]=4 4078 B25R3.120105 O=C(CN1CCC(CC1)F)N(c2ccccc2)c3ccccc3 269982a_100015193889_200015198546 [0,2,0,0,0,0|1,0,1]=4 4079 B25R3.120105 O=C(CN1CCC(CC1)O)N(c2ccccc2)c3ccccc3 2230a_100025773856_200015198546 [0,2,0,0,0,0|1,0,1]=4 4080 B25R3.120105 O=C(CN1CCC(CC1)O)N(c2ccccc2)c3ccccc3 269982a_100025773856_200015198546 [0,2,0,0,0,0|1,0,1]=4 4081 B25R3.121554 CN(CC1CCCCC1)C(c2ccccc2)c3ccc(cc3)Cl 2230a_100000736448_100000211669 [0,2,0,0,0,0|2,0,0]=4 4082 B25R3.121554 CN(CC1CCCCC1)C(c2ccccc2)c3ccc(cc3)Cl 269982a_100000736448_100000211669 [0,2,0,0,0,0|2,0,0]=4 4083 B25R3.121554 CN(CC1CCCCC1)C(c2ccccc2)c3ccc(cc3)Cl 270004a_100000736448_100000211064 [0,2,0,0,0,0|2,0,0]=4 4084 B25R3.121554 CN(CC1CCCCC1)C(c2ccccc2)c3ccc(cc3)F 270004a_100000736448_100000210425 [0,2,0,0,0,0|2,0,0]=4 4085 B25R3.121554 Cc1ccc(cc1)C(c2ccccc2)N(C)CC3CCCCC3 270004a_100000736448_100000210966 [0,2,0,0,0,0|2,0,0]=4 4086 B25R3.2580977 CC1CCCC(C1)CC(=O)C(c2ccccc2)c3ccccc3 1458a_100000748788_100011216954 [0,2,0,0,0,0|1,0,1]=4 4087 B25R3.2580977 C[C@H]1CCCN(C1)CC(=O)N(c2ccccc2)c3ccccc3 2230a_100000717927_200015198546 [0,2,0,0,0,0|1,0,1]=4 4088 B25R3.2580977 C[C@H]1CCCN(C1)CC(=O)N(c2ccccc2)c3ccccc3 269982a_100000717927_200015198546 [0,2,0,0,0,0|1,0,1]=4 4089 B25R3.2580977 O=C(CN1CCCC(C1)F)N(c2ccccc2)c3ccccc3 2230a_100000697950_200015198546 [0,2,0,0,0,0|1,0,1]=4 4090 B25R3.2580977 O=C(CN1CCCC(C1)F)N(c2ccccc2)c3ccccc3 269982a_100000697950_200015198546 [0,2,0,0,0,0|1,0,1]=4 4091 B25R3.2580977 O=C(CN1CCCC(C1)O)N(c2ccccc2)c3ccccc3 2230a_100000211013_200015198546 [0,2,0,0,0,0|1,0,1]=4 4092 B25R3.2580977 O=C(CN1CCCC(C1)O)N(c2ccccc2)c3ccccc3 269982a_100000211013_200015198546 [0,2,0,0,0,0|1,0,1]=4 4093 B25R3.32677638 O=C(CC1(CCCCC1)O)C(c2ccccc2)c3ccccc3 1458a_100000755886_100011216954 [0,2,0,0,0,0|1,0,1]=4 4094 B25R3.2785 COc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 2230a_100015384205_100000211423 [0,2,0,0,0,0|2,0,0]=4 4095 B25R3.2785 COc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000170244 [0,2,0,0,0,0|2,0,0]=4 4096 B25R3.2785 COc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 34a_100015384205_100000211423 [0,2,0,0,0,0|2,0,0]=4 4097 B25R3.2785 COc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 34a_100000286541_100000211423 [0,2,0,0,0,0|2,0,0]=4 4098 B25R3.2785 COc1ccc(cc1)C(OCC2CCCCC2)c3ccccc3 7a_100000286541_100000211423 [0,2,0,0,0,0|2,0,0]=4 4099 B25R3.2785 OCc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 270004a_100000210473_200010886186 [0,2,0,0,0,0|2,0,0]=4 4100 B25R3.114827 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)C 270004a_100000210473_100000181741 [0,2,0,0,0,0|2,0,0]=4 4101 B25R3.114827 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)Cl 270004a_100000210473_100011267710 [0,2,0,0,0,0|2,0,0]=4 4102 B25R3.114827 Cc1ccc(cc1)C(OCC2CCCCC2)c3ccc(cc3)C 34a_100000297768_100000211423 [0,2,0,0,0,0|2,0,0]=4 4103 B25R3.114827 Cc1ccc(cc1)C(OCC2CCCCC2)c3ccc(cc3)C 7a_100000297768_100000211423 [0,2,0,0,0,0|2,0,0]=4 4104 B25R3.114827 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)Br 270004a_100000210473_200011267496 [0,2,0,0,0,0|2,0,0]=4 4105 B25R3.114827 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)F 2230a_100000210473_100000211696 [0,2,0,0,0,0|2,0,0]=4 4106 B25R3.114827 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)F 2230a_100000743883_100000211423 [0,2,0,0,0,0|2,0,0]=4 4107 B25R3.114827 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)F 34a_100000743883_100000211423 [0,2,0,0,0,0|2,0,0]=4 4108 B25R3.114827 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccc(cc3)F 34a_100000272419_100000211423 [0,2,0,0,0,0|2,0,0]=4 4109 B25R3.114827 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccc(cc3)F 7a_100000212181_100000211696 [0,2,0,0,0,0|2,0,0]=4 4110 B25R3.114827 Fc1ccc(cc1)C(OCC2CCCCC2)c3ccc(cc3)F 7a_100000272419_100000211423 [0,2,0,0,0,0|2,0,0]=4 4111 B25R3.114943 CC1CCC(CC1)CNC(c2ccccc2)c3ccc(cc3)Br 270004a_103436935547_100000718703 [0,2,0,0,0,0|2,0,0]=4 4112 B25R3.114943 CC1CCC(CC1)CNC(c2ccccc2)c3ccc(cc3)Cl 2230a_103436935547_100000211669 [0,2,0,0,0,0|2,0,0]=4 4113 B25R3.114943 CC1CCC(CC1)CNC(c2ccccc2)c3ccc(cc3)Cl 270004a_103436935547_100000211064 [0,2,0,0,0,0|2,0,0]=4 4114 B25R3.114943 CC1CCC(CC1)CNC(c2ccccc2)c3ccc(cc3)F 270004a_103436935547_100000210425 [0,2,0,0,0,0|2,0,0]=4 4115 B25R3.114943 Cc1ccc(cc1)C(NCC2CCC(CC2)C)c3ccccc3 270004a_103436935547_100000210966 [0,2,0,0,0,0|2,0,0]=4 4116 B25R3.743820 Cc1ccc(cc1)C(NCC2CCCC(C2)O)c3ccccc3 270004a_100011254705_100000210966 [0,2,0,0,0,0|2,0,0]=4 4117 B25R3.743820 OC1CCCC(C1)CNC(c2ccccc2)c3ccc(cc3)Br 270004a_100011254705_100000718703 [0,2,0,0,0,0|2,0,0]=4 4118 B25R3.743820 OC1CCCC(C1)CNC(c2ccccc2)c3ccc(cc3)Cl 2230a_100011254705_100000211669 [0,2,0,0,0,0|2,0,0]=4 4119 B25R3.743820 OC1CCCC(C1)CNC(c2ccccc2)c3ccc(cc3)Cl 270004a_100011254705_100000211064 [0,2,0,0,0,0|2,0,0]=4 4120 B25R3.743820 OC1CCCC(C1)CNC(c2ccccc2)c3ccc(cc3)F 270004a_100011254705_100000210425 [0,2,0,0,0,0|2,0,0]=4 4121 B25R3.295449717 CC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)Cl 2230a_100000706052_100000211669 [0,2,0,0,0,0|2,0,0]=4 4122 B25R3.295449717 CC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)Cl 269862a_100000737946_100011935227 [0,2,0,0,0,0|2,0,0]=4 4123 B25R3.295449717 CC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)Cl 270004a_100000706052_100000211064 [0,2,0,0,0,0|2,0,0]=4 4124 B25R3.295449717 CC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)F 269862a_100000737529_100011935227 [0,2,0,0,0,0|2,0,0]=4 4125 B25R3.295449717 CC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)F 270004a_100000706052_100000210425 [0,2,0,0,0,0|2,0,0]=4 4126 B25R3.295449717 Cc1ccc(cc1)C(NCC2(CCCCC2)C)c3ccccc3 269862a_100000736602_100011935227 [0,2,0,0,0,0|2,0,0]=4 4127 B25R3.295449717 Cc1ccc(cc1)C(NCC2(CCCCC2)C)c3ccccc3 270004a_100000706052_100000210966 [0,2,0,0,0,0|2,0,0]=4 4128 B25R3.295449717 Cc1ccc(cc1)C(NCC2(CCCCC2)O)c3ccccc3 270004a_100000748649_100000210966 [0,2,0,0,0,0|2,0,0]=4 4129 B25R3.295449717 OC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)Br 270004a_100000748649_100000718703 [0,2,0,0,0,0|2,0,0]=4 4130 B25R3.295449717 OC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)Cl 2230a_100000748649_100000211669 [0,2,0,0,0,0|2,0,0]=4 4131 B25R3.295449717 OC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)Cl 270004a_100000748649_100000211064 [0,2,0,0,0,0|2,0,0]=4 4132 B25R3.295449717 OC1(CCCCC1)CNC(c2ccccc2)c3ccc(cc3)F 270004a_100000748649_100000210425 [0,2,0,0,0,0|2,0,0]=4 4133 B25R3.31048 C#CC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000722563 [0,2,0,0,0,0|2,0,0]=4 4134 B25R3.31048 C#CC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100016991398_100000050448 [0,2,0,0,0,0|0,0,2]=4 4135 B25R3.31048 C#CC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100016991398_100009813428 [0,2,0,0,0,0|0,0,0]=2 4136 B25R3.31048 C#CC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100016991398_100009813428 [0,2,0,0,0,0|0,0,0]=2 4137 B25R3.31048 C#CC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100016991398_100009813428 [0,2,0,0,0,0|0,0,0]=2 4138 B25R3.31048 C#CC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100016991398_100010140906 [0,2,0,0,0,0|1,0,0]=3 4139 B25R3.31048 C#CC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100016991398_100010140906 [0,2,0,0,0,0|1,0,0]=3 4140 B25R3.31048 CCC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000210631 [0,2,0,0,0,0|2,0,0]=4 4141 B25R3.31048 CCC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000754474_100000050448 [0,2,0,0,0,0|0,0,2]=4 4142 B25R3.31048 CCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000754474_100009813428 [0,2,0,0,0,0|0,0,0]=2 4143 B25R3.31048 CCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000754474_100009813428 [0,2,0,0,0,0|0,0,0]=2 4144 B25R3.31048 CCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100000754474_100009813428 [0,2,0,0,0,0|0,0,0]=2 4145 B25R3.31048 CCC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000754474_100010140906 [0,2,0,0,0,0|1,0,0]=3 4146 B25R3.31048 CCC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000754474_100010140906 [0,2,0,0,0,0|1,0,0]=3 4147 B25R3.31048 CCN1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000210033_100009813428 [0,2,0,0,0,0|1,0,0]=3 4148 B25R3.31048 CCN1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000210033_100009813428 [0,2,0,0,0,0|1,0,0]=3 4149 B25R3.31048 CCN1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000210033_100010140906 [0,2,0,0,0,0|2,0,0]=4 4150 B25R3.31048 CCN1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000210033_100010140906 [0,2,0,0,0,0|2,0,0]=4 4151 B25R3.31048 CNC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_200016988011 [0,2,0,0,0,0|2,0,0]=4 4152 B25R3.31048 COC1CCC(CC1)CNC(c2ccccc2)c3ccccc3 2230a_100000162943_100013032858 [0,2,0,0,0,0|2,0,0]=4 4153 B25R3.31048 COC1CCC(CC1)CNC(c2ccccc2)c3ccccc3 34a_100000162943_100013032858 [0,2,0,0,0,0|2,0,0]=4 4154 B25R3.31048 COC1CCC(CC1)COC(c2ccccc2)c3ccccc3 34a_100000211180_100013032858 [0,2,0,0,0,0|2,0,0]=4 4155 B25R3.31048 COC1CCC(CC1)COC(c2ccccc2)c3ccccc3 7a_100000211180_100013032858 [0,2,0,0,0,0|2,0,0]=4 4156 B25R3.31048 COC1CCC(CC1)CSC(c2ccccc2)c3ccccc3 62a_100000211591_100013032858 [0,2,0,0,0,0|2,0,0]=4 4157 B25R3.31048 COC1CCC(CC1)CSC(c2ccccc2)c3ccccc3 62a_100013032858_100011216954 [0,2,0,0,0,0|2,0,0]=4 4158 B25R3.31048 COC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000747084 [0,2,0,0,0,0|2,0,0]=4 4159 B25R3.31048 COC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000234800_100000050448 [0,2,0,0,0,0|0,0,2]=4 4160 B25R3.31048 COC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000234800_100009813428 [0,2,0,0,0,0|0,0,0]=2 4161 B25R3.31048 COC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000234800_100009813428 [0,2,0,0,0,0|0,0,0]=2 4162 B25R3.31048 COC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100000234800_100009813428 [0,2,0,0,0,0|0,0,0]=2 4163 B25R3.31048 COC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000234800_100010140906 [0,2,0,0,0,0|1,0,0]=3 4164 B25R3.31048 COC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000234800_100010140906 [0,2,0,0,0,0|1,0,0]=3 4165 B25R3.31048 CSC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100015202541_100000050448 [0,2,0,0,0,0|0,0,2]=4 4166 B25R3.31048 CSC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100015202541_100009813428 [0,2,0,0,0,0|0,0,0]=2 4167 B25R3.31048 CSC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100015202541_100009813428 [0,2,0,0,0,0|0,0,0]=2 4168 B25R3.31048 CSC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100015202541_100009813428 [0,2,0,0,0,0|0,0,0]=2 4169 B25R3.31048 CSC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100015202541_100010140906 [0,2,0,0,0,0|1,0,0]=3 4170 B25R3.31048 CSC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100015202541_100010140906 [0,2,0,0,0,0|1,0,0]=3 4171 B25R3.31048 FCC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100015203933_100000050448 [0,2,0,0,0,0|0,0,2]=4 4172 B25R3.31048 FCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100015203933_100009813428 [0,2,0,0,0,0|0,0,0]=2 4173 B25R3.31048 FCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100015203933_100009813428 [0,2,0,0,0,0|0,0,0]=2 4174 B25R3.31048 FCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100015203933_100009813428 [0,2,0,0,0,0|0,0,0]=2 4175 B25R3.31048 FCC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100015203933_100010140906 [0,2,0,0,0,0|1,0,0]=3 4176 B25R3.31048 FCC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100015203933_100010140906 [0,2,0,0,0,0|1,0,0]=3 4177 B25R3.31048 N#CC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100009880307 [0,2,0,0,0,0|2,0,0]=4 4178 B25R3.31048 N#CC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000747632_100000050448 [0,2,0,0,0,0|0,0,2]=4 4179 B25R3.31048 N#CC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000747632_100009813428 [0,2,0,0,0,0|0,0,0]=2 4180 B25R3.31048 N#CC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000747632_100010140906 [0,2,0,0,0,0|1,0,0]=3 4181 B25R3.31048 OCC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000062911 [0,2,0,0,0,0|2,0,0]=4 4182 B25R3.31048 OCC1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 270004a_100000738675_100000050448 [0,2,0,0,0,0|0,0,2]=4 4183 B25R3.31048 OCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000738675_100009813428 [0,2,0,0,0,0|0,0,0]=2 4184 B25R3.31048 OCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000738675_100009813428 [0,2,0,0,0,0|0,0,0]=2 4185 B25R3.31048 OCC1CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100000738675_100009813428 [0,2,0,0,0,0|0,0,0]=2 4186 B25R3.31048 OCC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000738675_100010140906 [0,2,0,0,0,0|1,0,0]=3 4187 B25R3.31048 OCC1CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000738675_100010140906 [0,2,0,0,0,0|1,0,0]=3 4188 B25R3.31048 OC[C@H]1CC[C@@H](CC1)CNC(c2ccccc2)c3ccccc3 2230a_100121570882_100000211591 [0,2,0,0,0,0|2,0,0]=4 4189 B25R3.31048 OC[C@H]1CC[C@@H](CC1)CNC(c2ccccc2)c3ccccc3 270004a_100121570882_100000210122 [0,2,0,0,0,0|2,0,0]=4 4190 B25R3.116384 CC1CCC(CC1C)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000759390 [0,2,0,0,0,0|2,0,0]=4 4191 B25R3.116384 CC1CCN(CC1O)CC=C(c2ccccc2)c3ccccc3 270004a_100000696640_100000050448 [0,2,0,0,0,0|0,0,2]=4 4192 B25R3.116384 CC1CCN(CC1O)CCC(c2ccccc2)c3ccccc3 2230a_100000696640_100009813428 [0,2,0,0,0,0|0,0,0]=2 4193 B25R3.116384 CC1CCN(CC1O)CCC(c2ccccc2)c3ccccc3 269982a_100000696640_100009813428 [0,2,0,0,0,0|0,0,0]=2 4194 B25R3.116384 CC1CCN(CC1O)CC[S+](c2ccccc2)c3ccccc3 2230a_100000696640_100010140906 [0,2,0,0,0,0|1,0,0]=3 4195 B25R3.116384 CC1CCN(CC1O)CC[S+](c2ccccc2)c3ccccc3 269982a_100000696640_100010140906 [0,2,0,0,0,0|1,0,0]=3 4196 B25R3.116384 CC1CN(CCC1O)CCC(c2ccccc2)c3ccccc3 2230a_100011998114_100009813428 [0,2,0,0,0,0|0,0,0]=2 4197 B25R3.116384 CC1CN(CCC1O)CCC(c2ccccc2)c3ccccc3 269982a_100011998114_100009813428 [0,2,0,0,0,0|0,0,0]=2 4198 B25R3.116384 CC1CN(CCC1O)CC[S+](c2ccccc2)c3ccccc3 2230a_100011998114_100010140906 [0,2,0,0,0,0|1,0,0]=3 4199 B25R3.116384 CC1CN(CCC1O)CC[S+](c2ccccc2)c3ccccc3 269982a_100011998114_100010140906 [0,2,0,0,0,0|1,0,0]=3 4200 B25R3.116384 CN1CCN(CC1=O)CCC(c2ccccc2)c3ccccc3 2230a_100000187256_100009813428 [0,2,0,0,0,0|1,0,1]=4 4201 B25R3.116384 CN1CCN(CC1=O)CCC(c2ccccc2)c3ccccc3 269982a_100000187256_100009813428 [0,2,0,0,0,0|1,0,1]=4 4202 B25R3.116384 C[C@H]1CN(CCN1C)CCC(c2ccccc2)c3ccccc3 2230a_100020603432_100009813428 [0,2,0,0,0,0|1,0,0]=3 4203 B25R3.116384 C[C@H]1CN(CCN1C)CCC(c2ccccc2)c3ccccc3 269982a_100020603432_100009813428 [0,2,0,0,0,0|1,0,0]=3 4204 B25R3.116384 C[C@H]1CN(CCN1C)CC[S+](c2ccccc2)c3ccccc3 2230a_100020603432_100010140906 [0,2,0,0,0,0|2,0,0]=4 4205 B25R3.116384 C[C@H]1CN(CCN1C)CC[S+](c2ccccc2)c3ccccc3 269982a_100020603432_100010140906 [0,2,0,0,0,0|2,0,0]=4 4206 B25R3.116384 O[C@@H]1CCN(C[C@@H]1F)CC=C(c2ccccc2)c3ccccc3 270004a_200016994291_100000050448 [0,2,0,0,0,0|0,0,2]=4 4207 B25R3.116384 O[C@@H]1CCN(C[C@@H]1F)CCC(c2ccccc2)c3ccccc3 2230a_200016994291_100009813428 [0,2,0,0,0,0|0,0,0]=2 4208 B25R3.116384 O[C@@H]1CCN(C[C@@H]1F)CCC(c2ccccc2)c3ccccc3 269982a_200016994291_100009813428 [0,2,0,0,0,0|0,0,0]=2 4209 B25R3.116384 O[C@@H]1CCN(C[C@@H]1F)CC[S+](c2ccccc2)c3ccccc3 2230a_200016994291_100010140906 [0,2,0,0,0,0|1,0,0]=3 4210 B25R3.116384 O[C@@H]1CCN(C[C@@H]1F)CC[S+](c2ccccc2)c3ccccc3 269982a_200016994291_100010140906 [0,2,0,0,0,0|1,0,0]=3 4211 B25R3.116384 O[C@@H]1CCN(C[C@@H]1O)CC=C(c2ccccc2)c3ccccc3 270004a_100000690696_100000050448 [0,2,0,0,0,0|0,0,2]=4 4212 B25R3.116384 O[C@@H]1CCN(C[C@@H]1O)CCC(c2ccccc2)c3ccccc3 2230a_100000690696_100009813428 [0,2,0,0,0,0|0,0,0]=2 4213 B25R3.116384 O[C@@H]1CCN(C[C@@H]1O)CCC(c2ccccc2)c3ccccc3 269982a_100000690696_100009813428 [0,2,0,0,0,0|0,0,0]=2 4214 B25R3.116384 O[C@@H]1CCN(C[C@@H]1O)CC[S+](c2ccccc2)c3ccccc3 2230a_100000690696_100010140906 [0,2,0,0,0,0|1,0,0]=3 4215 B25R3.116384 O[C@@H]1CCN(C[C@@H]1O)CC[S+](c2ccccc2)c3ccccc3 269982a_100000690696_100010140906 [0,2,0,0,0,0|1,0,0]=3 4216 B25R3.121401 CC(CNC1CCC(CC1)O)(c2ccccc2)c3ccccc3 270004a_100000706881_100000764474 [0,2,0,0,0,0|2,0,0]=4 4217 B25R3.121401 CC1CCC(CC1)NCC(C)(c2ccccc2)c3ccccc3 270004a_100000706881_100000185489 [0,2,0,0,0,0|2,0,0]=4 4218 B25R3.17226985 CC1(CCC(CC1)NCC(c2ccccc2)c3ccccc3)C 270004a_100000739227_100000061838 [0,2,0,0,0,0|2,0,0]=4 4219 B25R3.17226985 CC1(CCC(CC1)NCC(c2ccccc2)c3ccccc3)O 270004a_100000739227_100012184276 [0,2,0,0,0,0|2,0,0]=4 4220 B25R3.17226985 CC1(CCN(CC1)CC=C(c2ccccc2)c3ccccc3)C 270004a_100000750138_100000050448 [0,2,0,0,0,0|0,0,2]=4 4221 B25R3.17226985 CC1(CCN(CC1)CC=C(c2ccccc2)c3ccccc3)O 270004a_100000690209_100000050448 [0,2,0,0,0,0|0,0,2]=4 4222 B25R3.17226985 CC1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)C 2230a_100000750138_100009813428 [0,2,0,0,0,0|0,0,0]=2 4223 B25R3.17226985 CC1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)C 269982a_100000750138_100009813428 [0,2,0,0,0,0|0,0,0]=2 4224 B25R3.17226985 CC1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)O 2230a_100000690209_100009813428 [0,2,0,0,0,0|0,0,0]=2 4225 B25R3.17226985 CC1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)O 269982a_100000690209_100009813428 [0,2,0,0,0,0|0,0,0]=2 4226 B25R3.17226985 CC1(CCN(CC1)CC[S+](c2ccccc2)c3ccccc3)C 2230a_100000750138_100010140906 [0,2,0,0,0,0|1,0,0]=3 4227 B25R3.17226985 CC1(CCN(CC1)CC[S+](c2ccccc2)c3ccccc3)C 269982a_100000750138_100010140906 [0,2,0,0,0,0|1,0,0]=3 4228 B25R3.17226985 CC1(CCN(CC1)CC[S+](c2ccccc2)c3ccccc3)O 2230a_100000690209_100010140906 [0,2,0,0,0,0|1,0,0]=3 4229 B25R3.17226985 CC1(CCN(CC1)CC[S+](c2ccccc2)c3ccccc3)O 269982a_100000690209_100010140906 [0,2,0,0,0,0|1,0,0]=3 4230 B25R3.17226985 C[Si]1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)C 2230a_100025715224_100009813428 [0,2,0,0,0,0|0,1,0]=3 4231 B25R3.17226985 C[Si]1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)C 269982a_100025715224_100009813428 [0,2,0,0,0,0|0,1,0]=3 4232 B25R3.17226985 C[Si]1(CCN(CC1)CC[S+](c2ccccc2)c3ccccc3)C 2230a_100025715224_100010140906 [0,2,0,0,0,0|1,1,0]=4 4233 B25R3.17226985 C[Si]1(CCN(CC1)CC[S+](c2ccccc2)c3ccccc3)C 269982a_100025715224_100010140906 [0,2,0,0,0,0|1,1,0]=4 4234 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F 2230a_100000162943_100012361406 [0,2,0,0,0,0|2,0,0]=4 4235 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F 2230a_100016988479_100000211591 [0,2,0,0,0,0|2,0,0]=4 4236 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F 269862a_100000162943_100011361451 [0,2,0,0,0,0|2,0,0]=4 4237 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F 270004a_100016988479_100000210122 [0,2,0,0,0,0|2,0,0]=4 4238 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F 34a_100000162943_100012361406 [0,2,0,0,0,0|2,0,0]=4 4239 B25R3.17226985 FC1(CCC(CC1)COC(c2ccccc2)c3ccccc3)F 34a_100000211180_100012361406 [0,2,0,0,0,0|2,0,0]=4 4240 B25R3.17226985 FC1(CCC(CC1)COC(c2ccccc2)c3ccccc3)F 7a_100000211180_100012361406 [0,2,0,0,0,0|2,0,0]=4 4241 B25R3.17226985 FC1(CCC(CC1)COC(c2ccccc2)c3ccccc3)F 7a_100012179939_100011216954 [0,2,0,0,0,0|2,0,0]=4 4242 B25R3.17226985 FC1(CCC(CC1)NCC(c2ccccc2)c3ccccc3)F 270004a_100000739227_100000052966 [0,2,0,0,0,0|2,0,0]=4 4243 B25R3.17226985 FC1(CCC(CC1)NCC(c2ccccc2)c3ccccc3)F 34a_100000739227_100009865109 [0,2,0,0,0,0|2,0,0]=4 4244 B25R3.17226985 FC1(CCC(CC1)OCC(c2ccccc2)c3ccccc3)F 34a_100011215272_100009865109 [0,2,0,0,0,0|2,0,0]=4 4245 B25R3.17226985 FC1(CCC(CC1)OCC(c2ccccc2)c3ccccc3)F 7a_100011215272_100009865109 [0,2,0,0,0,0|2,0,0]=4 4246 B25R3.17226985 FC1(CCN(CC1)CC=C(c2ccccc2)c3ccccc3)F 270004a_100000724815_100000050448 [0,2,0,0,0,0|0,0,2]=4 4247 B25R3.17226985 FC1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)F 2230a_100000724815_100009813428 [0,2,0,0,0,0|0,0,0]=2 4248 B25R3.17226985 FC1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)F 269982a_100000724815_100009813428 [0,2,0,0,0,0|0,0,0]=2 4249 B25R3.17226985 FC1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)F 34a_100000724815_100009813428 [0,2,0,0,0,0|0,0,0]=2 4250 B25R3.17226985 FC1(CCN(CC1)CC[S+](c2ccccc2)c3ccccc3)F 2230a_100000724815_100010140906 [0,2,0,0,0,0|1,0,0]=3 4251 B25R3.17226985 FC1(CCN(CC1)CC[S+](c2ccccc2)c3ccccc3)F 269982a_100000724815_100010140906 [0,2,0,0,0,0|1,0,0]=3 4252 B25R3.17226985 O=S1(=O)CCN(CC1)CCC(c2ccccc2)c3ccccc3 2230a_100000750940_100009813428 [0,2,0,0,0,0|1,0,0]=3 4253 B25R3.17226985 O=S1(=O)CCN(CC1)CCC(c2ccccc2)c3ccccc3 269982a_100000750940_100009813428 [0,2,0,0,0,0|1,0,0]=3 4254 B25R3.17226985 O=S1(=O)CCN(CC1)CCC(c2ccccc2)c3ccccc3 34a_100000750940_100009813428 [0,2,0,0,0,0|1,0,0]=3 4255 B25R3.17226985 O=S1(=O)CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000750940_100010140906 [0,2,0,0,0,0|2,0,0]=4 4256 B25R3.17226985 O=S1(=O)CCN(CC1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000750940_100010140906 [0,2,0,0,0,0|2,0,0]=4 4257 B25R3.17226985 OC1(CCN(CC1)CC=C(c2ccccc2)c3ccccc3)O 270004a_100016987284_100000050448 [0,2,0,0,0,0|0,0,2]=4 4258 B25R3.17226985 OC1(CCN(CC1)CCC(c2ccccc2)c3ccccc3)O 269982a_100016987284_100009813428 [0,2,0,0,0,0|0,0,0]=2 4259 B25R3.17226985 OC1(CCN(CC1)CC[S+](c2ccccc2)c3ccccc3)O 269982a_100016987284_100010140906 [0,2,0,0,0,0|1,0,0]=3 4260 B25R3.1604115 C#CC1CCCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100015191679_100000050448 [0,2,0,0,0,0|0,0,2]=4 4261 B25R3.1604115 C#CC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100015191679_100009813428 [0,2,0,0,0,0|0,0,0]=2 4262 B25R3.1604115 C#CC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100015191679_100009813428 [0,2,0,0,0,0|0,0,0]=2 4263 B25R3.1604115 C#CC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 34a_100015191679_100009813428 [0,2,0,0,0,0|0,0,0]=2 4264 B25R3.1604115 C#CC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100015191679_100010140906 [0,2,0,0,0,0|1,0,0]=3 4265 B25R3.1604115 C#CC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100015191679_100010140906 [0,2,0,0,0,0|1,0,0]=3 4266 B25R3.1604115 CCC1CCCC(C1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000756783 [0,2,0,0,0,0|2,0,0]=4 4267 B25R3.1604115 CCC1CN(CCO1)CCC(c2ccccc2)c3ccccc3 2230a_100000736320_100009813428 [0,2,0,0,0,0|1,0,0]=3 4268 B25R3.1604115 CCC1CN(CCO1)CCC(c2ccccc2)c3ccccc3 269982a_100000736320_100009813428 [0,2,0,0,0,0|1,0,0]=3 4269 B25R3.1604115 CCC1CN(CCO1)CCC(c2ccccc2)c3ccccc3 34a_100000736320_100009813428 [0,2,0,0,0,0|1,0,0]=3 4270 B25R3.1604115 CCC1CN(CCO1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000736320_100010140906 [0,2,0,0,0,0|2,0,0]=4 4271 B25R3.1604115 CCC1CN(CCO1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000736320_100010140906 [0,2,0,0,0,0|2,0,0]=4 4272 B25R3.1604115 COC1CCCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100000695604_100000050448 [0,2,0,0,0,0|0,0,2]=4 4273 B25R3.1604115 COC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100000695604_100009813428 [0,2,0,0,0,0|0,0,0]=2 4274 B25R3.1604115 COC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100000695604_100009813428 [0,2,0,0,0,0|0,0,0]=2 4275 B25R3.1604115 COC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 34a_100000695604_100009813428 [0,2,0,0,0,0|0,0,0]=2 4276 B25R3.1604115 COC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000695604_100010140906 [0,2,0,0,0,0|1,0,0]=3 4277 B25R3.1604115 COC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000695604_100010140906 [0,2,0,0,0,0|1,0,0]=3 4278 B25R3.1604115 CSC1CCCC(C1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100012138059 [0,2,0,0,0,0|2,0,0]=4 4279 B25R3.1604115 FCC1CCCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100016992999_100000050448 [0,2,0,0,0,0|0,0,2]=4 4280 B25R3.1604115 FCC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100016992999_100009813428 [0,2,0,0,0,0|0,0,0]=2 4281 B25R3.1604115 FCC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100016992999_100009813428 [0,2,0,0,0,0|0,0,0]=2 4282 B25R3.1604115 FCC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 34a_100016992999_100009813428 [0,2,0,0,0,0|0,0,0]=2 4283 B25R3.1604115 FCC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100016992999_100010140906 [0,2,0,0,0,0|1,0,0]=3 4284 B25R3.1604115 FCC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100016992999_100010140906 [0,2,0,0,0,0|1,0,0]=3 4285 B25R3.1604115 N#CC1CCCC(C1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_100000747296 [0,2,0,0,0,0|2,0,0]=4 4286 B25R3.1604115 N#CC1CCCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100016989302_100000050448 [0,2,0,0,0,0|0,0,2]=4 4287 B25R3.1604115 N#CC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100016989302_100009813428 [0,2,0,0,0,0|0,0,0]=2 4288 B25R3.1604115 N#CC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_206835378768_100009813428 [0,2,0,0,0,0|0,0,0]=2 4289 B25R3.1604115 N#CC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100016989302_100010140906 [0,2,0,0,0,0|1,0,0]=3 4290 B25R3.1604115 N#CC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_206835378768_100010140906 [0,2,0,0,0,0|1,0,0]=3 4291 B25R3.1604115 N#CC1CN(CCO1)CCC(c2ccccc2)c3ccccc3 2230a_100000752543_100009813428 [0,2,0,0,0,0|1,0,0]=3 4292 B25R3.1604115 N#CC1CN(CCO1)CCC(c2ccccc2)c3ccccc3 34a_100000752543_100009813428 [0,2,0,0,0,0|1,0,0]=3 4293 B25R3.1604115 N#CC1CN(CCO1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000752543_100010140906 [0,2,0,0,0,0|2,0,0]=4 4294 B25R3.1604115 OCC1CCCN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100000211344_100000050448 [0,2,0,0,0,0|0,0,2]=4 4295 B25R3.1604115 OCC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100000211344_100009813428 [0,2,0,0,0,0|0,0,0]=2 4296 B25R3.1604115 OCC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100000211344_100009813428 [0,2,0,0,0,0|0,0,0]=2 4297 B25R3.1604115 OCC1CCCN(C1)CCC(c2ccccc2)c3ccccc3 34a_100000211344_100009813428 [0,2,0,0,0,0|0,0,0]=2 4298 B25R3.1604115 OCC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100000211344_100010140906 [0,2,0,0,0,0|1,0,0]=3 4299 B25R3.1604115 OCC1CCCN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000211344_100010140906 [0,2,0,0,0,0|1,0,0]=3 4300 B25R3.1604115 OC[C@@H]1CN(CCO1)CCC(c2ccccc2)c3ccccc3 2230a_100015189573_100009813428 [0,2,0,0,0,0|1,0,0]=3 4301 B25R3.1604115 OC[C@@H]1CN(CCO1)CCC(c2ccccc2)c3ccccc3 269982a_100015189573_100009813428 [0,2,0,0,0,0|1,0,0]=3 4302 B25R3.1604115 OC[C@@H]1CN(CCO1)CCC(c2ccccc2)c3ccccc3 34a_100015189573_100009813428 [0,2,0,0,0,0|1,0,0]=3 4303 B25R3.1604115 OC[C@@H]1CN(CCO1)CC[S+](c2ccccc2)c3ccccc3 2230a_100015189573_100010140906 [0,2,0,0,0,0|2,0,0]=4 4304 B25R3.1604115 OC[C@@H]1CN(CCO1)CC[S+](c2ccccc2)c3ccccc3 269982a_100015189573_100010140906 [0,2,0,0,0,0|2,0,0]=4 4305 B25R3.2518667 CC1CC(CC(C1)NCC(c2ccccc2)c3ccccc3)C 270004a_100000739227_100000753413 [0,2,0,0,0,0|2,0,0]=4 4306 B25R3.2518667 CC1CC(CN(C1)CC=C(c2ccccc2)c3ccccc3)C 270004a_100000210448_100000050448 [0,2,0,0,0,0|0,0,2]=4 4307 B25R3.2518667 CC1CC(CN(C1)CCC(c2ccccc2)c3ccccc3)C 2230a_100000210448_100009813428 [0,2,0,0,0,0|0,0,0]=2 4308 B25R3.2518667 CC1CC(CN(C1)CCC(c2ccccc2)c3ccccc3)C 269982a_100000210448_100009813428 [0,2,0,0,0,0|0,0,0]=2 4309 B25R3.2518667 CC1CC(CN(C1)CCC(c2ccccc2)c3ccccc3)C 34a_100000210448_100009813428 [0,2,0,0,0,0|0,0,0]=2 4310 B25R3.2518667 CC1CC(CN(C1)CC[S+](c2ccccc2)c3ccccc3)C 2230a_100000210448_100010140906 [0,2,0,0,0,0|1,0,0]=3 4311 B25R3.2518667 CC1CC(CN(C1)CC[S+](c2ccccc2)c3ccccc3)C 269982a_100000210448_100010140906 [0,2,0,0,0,0|1,0,0]=3 4312 B25R3.2518667 CC1CN(CC(O1)C)CCC(c2ccccc2)c3ccccc3 2230a_100000210032_100009813428 [0,2,0,0,0,0|1,0,0]=3 4313 B25R3.2518667 CC1CN(CC(O1)C)CCC(c2ccccc2)c3ccccc3 269982a_100000210032_100009813428 [0,2,0,0,0,0|1,0,0]=3 4314 B25R3.2518667 CC1CN(CC(O1)C)CCC(c2ccccc2)c3ccccc3 34a_100000210032_100009813428 [0,2,0,0,0,0|1,0,0]=3 4315 B25R3.2518667 CC1CN(CC(O1)C)CC[S+](c2ccccc2)c3ccccc3 2230a_100000210032_100010140906 [0,2,0,0,0,0|2,0,0]=4 4316 B25R3.2518667 CC1CN(CC(O1)C)CC[S+](c2ccccc2)c3ccccc3 269982a_100000210032_100010140906 [0,2,0,0,0,0|2,0,0]=4 4317 B25R3.3709786 CC(CNC1CCCC(C1)O)(c2ccccc2)c3ccccc3 270004a_100000706881_100012613340 [0,2,0,0,0,0|2,0,0]=4 4318 B25R3.3709786 CC1CCCC(C1)NCC(C)(c2ccccc2)c3ccccc3 270004a_100000706881_100000183594 [0,2,0,0,0,0|2,0,0]=4 4319 B25R3.18218583 CC1(CCCC(C1)NCC(c2ccccc2)c3ccccc3)C 270004a_100000739227_100000031663 [0,2,0,0,0,0|2,0,0]=4 4320 B25R3.18218583 CC1(CCCN(C1)CC=C(c2ccccc2)c3ccccc3)C 270004a_100000716857_100000050448 [0,2,0,0,0,0|0,0,2]=4 4321 B25R3.18218583 CC1(CCCN(C1)CC=C(c2ccccc2)c3ccccc3)O 270004a_100000695535_100000050448 [0,2,0,0,0,0|0,0,2]=4 4322 B25R3.18218583 CC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)C 2230a_100000716857_100009813428 [0,2,0,0,0,0|0,0,0]=2 4323 B25R3.18218583 CC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)C 269982a_100000716857_100009813428 [0,2,0,0,0,0|0,0,0]=2 4324 B25R3.18218583 CC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)C 34a_100000716857_100009813428 [0,2,0,0,0,0|0,0,0]=2 4325 B25R3.18218583 CC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)O 2230a_100000695535_100009813428 [0,2,0,0,0,0|0,0,0]=2 4326 B25R3.18218583 CC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)O 269982a_100000695535_100009813428 [0,2,0,0,0,0|0,0,0]=2 4327 B25R3.18218583 CC1(CCCN(C1)CC[S+](c2ccccc2)c3ccccc3)C 2230a_100000716857_100010140906 [0,2,0,0,0,0|1,0,0]=3 4328 B25R3.18218583 CC1(CCCN(C1)CC[S+](c2ccccc2)c3ccccc3)C 269982a_100000716857_100010140906 [0,2,0,0,0,0|1,0,0]=3 4329 B25R3.18218583 CC1(CCCN(C1)CC[S+](c2ccccc2)c3ccccc3)O 2230a_100000695535_100010140906 [0,2,0,0,0,0|1,0,0]=3 4330 B25R3.18218583 CC1(CCCN(C1)CC[S+](c2ccccc2)c3ccccc3)O 269982a_100000695535_100010140906 [0,2,0,0,0,0|1,0,0]=3 4331 B25R3.18218583 CC1(CN(CCO1)CCC(c2ccccc2)c3ccccc3)C 2230a_100000738910_100009813428 [0,2,0,0,0,0|1,0,0]=3 4332 B25R3.18218583 CC1(CN(CCO1)CCC(c2ccccc2)c3ccccc3)C 269982a_100000738910_100009813428 [0,2,0,0,0,0|1,0,0]=3 4333 B25R3.18218583 CC1(CN(CCO1)CCC(c2ccccc2)c3ccccc3)C 34a_100000738910_100009813428 [0,2,0,0,0,0|1,0,0]=3 4334 B25R3.18218583 CC1(CN(CCO1)CC[S+](c2ccccc2)c3ccccc3)C 2230a_100000738910_100010140906 [0,2,0,0,0,0|2,0,0]=4 4335 B25R3.18218583 CC1(CN(CCO1)CC[S+](c2ccccc2)c3ccccc3)C 269982a_100000738910_100010140906 [0,2,0,0,0,0|2,0,0]=4 4336 B25R3.18218583 FC1(CCCN(C1)CC=C(c2ccccc2)c3ccccc3)F 270004a_100000732682_100000050448 [0,2,0,0,0,0|0,0,2]=4 4337 B25R3.18218583 FC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)F 2230a_100000732682_100009813428 [0,2,0,0,0,0|0,0,0]=2 4338 B25R3.18218583 FC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)F 269982a_100000732682_100009813428 [0,2,0,0,0,0|0,0,0]=2 4339 B25R3.18218583 FC1(CCCN(C1)CCC(c2ccccc2)c3ccccc3)F 34a_100000732682_100009813428 [0,2,0,0,0,0|0,0,0]=2 4340 B25R3.18218583 FC1(CCCN(C1)CC[S+](c2ccccc2)c3ccccc3)F 2230a_100000732682_100010140906 [0,2,0,0,0,0|1,0,0]=3 4341 B25R3.18218583 FC1(CCCN(C1)CC[S+](c2ccccc2)c3ccccc3)F 269982a_100000732682_100010140906 [0,2,0,0,0,0|1,0,0]=3 4342 B25R3.2488225 C#CC(OCC1CCCCC1)(c2ccccc2)c3ccccc3 34a_100000033177_100000211423 [0,2,0,0,0,0|2,0,0]=4 4343 B25R3.2488225 C#CC(OCC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100000033177_100000211423 [0,2,0,0,0,0|2,0,0]=4 4344 B25R3.2488225 N#CC(CCN1CC=CCC1)(c2ccccc2)c3ccccc3 2230a_100000698166_100000489411 [0,2,0,0,0,0|0,0,2]=4 4345 B25R3.2488225 N#CC(CCN1CC=CCC1)(c2ccccc2)c3ccccc3 269982a_100000698166_100000489411 [0,2,0,0,0,0|0,0,2]=4 4346 B25R3.2488225 N#CC(CCN1CCCOC1)(c2ccccc2)c3ccccc3 2230a_100000131196_100000489411 [0,2,0,0,0,0|1,0,0]=3 4347 B25R3.2488225 N#CC(CCN1CCCOC1)(c2ccccc2)c3ccccc3 269982a_100000131196_100000489411 [0,2,0,0,0,0|1,0,0]=3 4348 B25R3.2488225 N#CC(CCN1CCOCC1)(c2ccccc2)c3ccccc3 2230a_100015191051_100000489411 [0,2,0,0,0,0|1,0,0]=3 4349 B25R3.2488225 N#CC(CCN1CCOCC1)(c2ccccc2)c3ccccc3 269982a_100015191051_100000489411 [0,2,0,0,0,0|1,0,0]=3 4350 B25R3.2488225 N#CC(CCN1CCSCC1)(c2ccccc2)c3ccccc3 2230a_100000737611_100000489411 [0,2,0,0,0,0|1,0,0]=3 4351 B25R3.2488225 N#CC(CCN1CCSCC1)(c2ccccc2)c3ccccc3 269982a_100000737611_100000489411 [0,2,0,0,0,0|1,0,0]=3 4352 B25R3.64240365 N#CC1(CCCCC1)CNC(c2ccccc2)c3ccccc3 34a_100000162943_100011219015 [0,2,0,0,0,0|2,0,0]=4 4353 B25R3.64240365 N#CC1(CCCCC1)COC(c2ccccc2)c3ccccc3 34a_100000211180_100011219015 [0,2,0,0,0,0|2,0,0]=4 4354 B25R3.64240365 N#CC1(CCCCC1)CSC(c2ccccc2)c3ccccc3 62a_100000211591_100011219015 [0,2,0,0,0,0|2,0,0]=4 4355 B25R3.64240365 N#CC1(CCCCC1)CSC(c2ccccc2)c3ccccc3 62a_100011219015_100011216954 [0,2,0,0,0,0|2,0,0]=4 4356 B23R3.569 CCCN1CCC[C@@H]1C(c2ccccc2)c3ccccc3 2230a_100016987801_100000210303 [0,0,1,1,0,0|2,0,0]=4 4357 B23R3.569 CCCN1CCC[C@@H]1C(c2ccccc2)c3ccccc3 269982a_100016987801_100000210303 [0,0,1,1,0,0|2,0,0]=4 4358 B23R3.569 CCCN1CCC[C@@H]1C(c2ccccc2)c3ccccc3 34a_100016987801_100000210303 [0,0,1,1,0,0|2,0,0]=4 4359 B23R3.1793 CCC1CCCCN1C(c2ccccc2)c3ccccc3 2230a_100000210034_100000211591 [0,0,1,1,0,0|2,0,0]=4 4360 B23R3.1793 CCC1CCCCN1C(c2ccccc2)c3ccccc3 269982a_100000210034_100000211591 [0,0,1,1,0,0|2,0,0]=4 4361 B23R3.1793 CCC1CCCCN1C(c2ccccc2)c3ccccc3 270004a_100000210034_100000210122 [0,0,1,1,0,0|2,0,0]=4 4362 B23R3.25260 CC1CC1COCCC(c2ccccc2)c3ccccc3 34a_100000744939_100009813428 [0,0,1,1,0,0|1,0,0]=3 4363 B23R3.25260 CC1CC1COCCC(c2ccccc2)c3ccccc3 7a_100000744939_100009813428 [0,0,1,1,0,0|1,0,0]=3 4364 B23R3.25260 CC1CC1COCC[S+](c2ccccc2)c3ccccc3 7a_100000744939_100010140906 [0,0,1,1,0,0|2,0,0]=4 4365 B23R3.44427 O=C1CCC1NCCC(c2ccccc2)c3ccccc3 34a_100000272388_100009892977 [0,0,1,1,0,0|1,0,1]=4 4366 B23R3.79965 CCC1CCCC1NC(c2ccccc2)c3ccccc3 269862a_100000162943_100000749056 [0,0,1,1,0,0|2,0,0]=4 4367 B23R3.79965 CCC1CCCC1NC(c2ccccc2)c3ccccc3 270004a_100000162943_100000749056 [0,0,1,1,0,0|2,0,0]=4 4368 B23R3.1927702 c1ccc(cc1)C(c2ccccc2)N3CCCCCCC3 2230a_100000211400_100000211591 [0,0,1,1,0,0|2,0,0]=4 4369 B23R3.1927702 c1ccc(cc1)C(c2ccccc2)N3CCCCCCC3 269982a_100000211400_100000211591 [0,0,1,1,0,0|2,0,0]=4 4370 B23R3.1927702 c1ccc(cc1)C(c2ccccc2)N3CCCCCCC3 270004a_100000211400_100000210122 [0,0,1,1,0,0|2,0,0]=4 4371 B23R3.1927729 c1ccc(cc1)C(NC2CCCCCC2)c3ccccc3 2230a_100000210984_100000211591 [0,0,1,1,0,0|2,0,0]=4 4372 B23R3.1927729 c1ccc(cc1)C(NC2CCCCCC2)c3ccccc3 270004a_100000162943_100000210131 [0,0,1,1,0,0|2,0,0]=4 4373 B23R3.1927729 c1ccc(cc1)C(NC2CCCCCC2)c3ccccc3 270004a_100000210984_100000210122 [0,0,1,1,0,0|2,0,0]=4 4374 B23R3.1927729 c1ccc(cc1)C(NC2CCCCCC2)c3ccccc3 34a_100000162943_100011217769 [0,0,1,1,0,0|2,0,0]=4 4375 B23R3.1927729 c1ccc(cc1)C(OC2CCCCCC2)c3ccccc3 34a_100000211180_100011217769 [0,0,1,1,0,0|2,0,0]=4 4376 B23R3.1927729 c1ccc(cc1)C(OC2CCCCCC2)c3ccccc3 7a_100000210887_100011216954 [0,0,1,1,0,0|2,0,0]=4 4377 B23R3.1974330 C(=C(c1ccccc1)c2ccccc2)CNCCC3CC3 270004a_100000764129_100000050448 [0,0,1,1,0,0|0,0,2]=4 4378 B23R3.1974330 c1ccc(cc1)C(CCNCCC2CC2)c3ccccc3 2230a_100000272388_100000694398 [0,0,1,1,0,0|0,0,0]=2 4379 B23R3.1974330 c1ccc(cc1)C(CCNCCC2CC2)c3ccccc3 34a_100000272388_100000694398 [0,0,1,1,0,0|0,0,0]=2 4380 B23R3.1974330 c1ccc(cc1)C(CCNCCC2CC2)c3ccccc3 34a_100000764129_100009813428 [0,0,1,1,0,0|0,0,0]=2 4381 B23R3.1974330 c1ccc(cc1)C(CCNCCC2CO2)c3ccccc3 2230a_100000272388_100000732470 [0,0,1,1,0,0|1,0,0]=3 4382 B23R3.1974330 c1ccc(cc1)C(CCNCCC2CO2)c3ccccc3 34a_100000272388_100000732470 [0,0,1,1,0,0|1,0,0]=3 4383 B23R3.1974330 c1ccc(cc1)C(CCOCCC2CC2)c3ccccc3 34a_100000032380_100000694398 [0,0,1,1,0,0|1,0,0]=3 4384 B23R3.1974330 c1ccc(cc1)C(CCOCCC2CC2)c3ccccc3 34a_100000754188_100009813428 [0,0,1,1,0,0|1,0,0]=3 4385 B23R3.1974330 c1ccc(cc1)C(CCOCCC2CC2)c3ccccc3 7a_100000032380_100000764125 [0,0,1,1,0,0|1,0,0]=3 4386 B23R3.1974330 c1ccc(cc1)C(CCOCCC2CC2)c3ccccc3 7a_100000754188_100009813428 [0,0,1,1,0,0|1,0,0]=3 4387 B23R3.1974330 c1ccc(cc1)C(CCOCCC2CO2)c3ccccc3 34a_100000032380_100000732470 [0,0,1,1,0,0|2,0,0]=4 4388 B23R3.1974330 c1ccc(cc1)C(CCOCCC2CO2)c3ccccc3 7a_100000032380_100000732470 [0,0,1,1,0,0|2,0,0]=4 4389 B23R3.1974330 c1ccc(cc1)C(CCOCC[C@@H]2CO2)c3ccccc3 34a_100009820653_100009813428 [0,0,1,1,0,0|2,0,0]=4 4390 B23R3.1974330 c1ccc(cc1)C(CCSCCC2CC2)c3ccccc3 62a_100000764125_100009813428 [0,0,1,1,0,0|1,0,0]=3 4391 B23R3.1974330 c1ccc(cc1)C(CCSCCC2CC2)c3ccccc3 62a_100009813428_100000764125 [0,0,1,1,0,0|1,0,0]=3 4392 B23R3.1974330 c1ccc(cc1)C(CCSCCC2CO2)c3ccccc3 62a_100000732470_100009813428 [0,0,1,1,0,0|2,0,0]=4 4393 B23R3.1974330 c1ccc(cc1)C(CCSCCC2CO2)c3ccccc3 62a_100009813428_100000732470 [0,0,1,1,0,0|2,0,0]=4 4394 B23R3.1974330 c1ccc(cc1)N(CCOCCC2CC2)c3ccccc3 34a_100010001939_100000694398 [0,0,1,1,0,0|2,0,0]=4 4395 B23R3.1974330 c1ccc(cc1)N(CCOCCC2CC2)c3ccccc3 7a_100010001939_100000764125 [0,0,1,1,0,0|2,0,0]=4 4396 B23R3.1974330 c1ccc(cc1)P(CCNCCC2CC2)c3ccccc3 2230a_107094377242_100000694398 [0,0,1,1,0,0|1,0,0]=3 4397 B23R3.1974330 c1ccc(cc1)P(CCNCCC2CC2)c3ccccc3 34a_107094377242_100000694398 [0,0,1,1,0,0|1,0,0]=3 4398 B23R3.1974330 c1ccc(cc1)P(CCNCCC2CO2)c3ccccc3 2230a_107094377242_100000732470 [0,0,1,1,0,0|2,0,0]=4 4399 B23R3.1974330 c1ccc(cc1)P(CCNCCC2CO2)c3ccccc3 34a_107094377242_100000732470 [0,0,1,1,0,0|2,0,0]=4 4400 B23R3.1974330 c1ccc(cc1)[S+](CCOCCC2CC2)c3ccccc3 7a_100000754188_100010140906 [0,0,1,1,0,0|2,0,0]=4 4401 B23R3.1974330 c1ccc(cc1)[S+](CCSCCC2CC2)c3ccccc3 62a_100000764125_100010140906 [0,0,1,1,0,0|2,0,0]=4 4402 B23R3.1974330 c1ccc(cc1)[S+](CCSCCC2CC2)c3ccccc3 62a_100010140906_100000764125 [0,0,1,1,0,0|2,0,0]=4 4403 B23R3.3868845 C(=C(c1ccccc1)c2ccccc2)CNC3CCCC3 270004a_100000211070_100000050448 [0,0,1,1,0,0|0,0,2]=4 4404 B23R3.3868845 C(=NNC1CCCC1)C(c2ccccc2)c3ccccc3 4a_100000737850_100000183636 [0,0,1,1,0,0|1,0,1]=4 4405 B23R3.3868845 C1=CCC(C1)NCCC(c2ccccc2)c3ccccc3 2230a_100015188752_100009813428 [0,0,1,1,0,0|0,0,2]=4 4406 B23R3.3868845 c1ccc(cc1)C(CCNC2CCCC2)c3ccccc3 2230a_100000211070_100009813428 [0,0,1,1,0,0|0,0,0]=2 4407 B23R3.3868845 c1ccc(cc1)C(CCNC2CCCC2)c3ccccc3 2230a_100000272388_100000179811 [0,0,1,1,0,0|0,0,0]=2 4408 B23R3.3868845 c1ccc(cc1)C(CCNC2CCCC2)c3ccccc3 270004a_100000272388_100000210133 [0,0,1,1,0,0|0,0,0]=2 4409 B23R3.3868845 c1ccc(cc1)C(CCNC2CCCC2)c3ccccc3 34a_100000211070_100009813428 [0,0,1,1,0,0|0,0,0]=2 4410 B23R3.3868845 c1ccc(cc1)C(CCNC2CCCC2)c3ccccc3 34a_100000272388_100000179811 [0,0,1,1,0,0|0,0,0]=2 4411 B23R3.3868845 c1ccc(cc1)C(CCNC2CCOC2)c3ccccc3 2230a_100000272388_100000731011 [0,0,1,1,0,0|1,0,0]=3 4412 B23R3.3868845 c1ccc(cc1)C(CCNC2CCOC2)c3ccccc3 270004a_100000272388_100000752484 [0,0,1,1,0,0|1,0,0]=3 4413 B23R3.3868845 c1ccc(cc1)C(CCNC2CCOC2)c3ccccc3 34a_100000272388_100000690089 [0,0,1,1,0,0|1,0,0]=3 4414 B23R3.3868845 c1ccc(cc1)C(CCNC2CCSC2)c3ccccc3 270004a_100000272388_100000212027 [0,0,1,1,0,0|1,0,0]=3 4415 B23R3.3868845 c1ccc(cc1)C(CCN[C@@H]2CCOC2)c3ccccc3 2230a_200015188469_100009813428 [0,0,1,1,0,0|1,0,0]=3 4416 B23R3.3868845 c1ccc(cc1)C(CCN[C@H]2CCOC2)c3ccccc3 2230a_100015188467_100009813428 [0,0,1,1,0,0|1,0,0]=3 4417 B23R3.3868845 c1ccc(cc1)C(CCN[C@H]2CCOC2)c3ccccc3 34a_100015188467_100009813428 [0,0,1,1,0,0|1,0,0]=3 4418 B23R3.3868845 c1ccc(cc1)C(CCOC2CCCC2)c3ccccc3 34a_100000032380_100000179811 [0,0,1,1,0,0|1,0,0]=3 4419 B23R3.3868845 c1ccc(cc1)C(CCOC2CCCC2)c3ccccc3 34a_100000210269_100009813428 [0,0,1,1,0,0|1,0,0]=3 4420 B23R3.3868845 c1ccc(cc1)C(CCOC2CCCC2)c3ccccc3 7a_100000032380_100000179811 [0,0,1,1,0,0|1,0,0]=3 4421 B23R3.3868845 c1ccc(cc1)C(CCOC2CCCC2)c3ccccc3 7a_100000210269_100009813428 [0,0,1,1,0,0|1,0,0]=3 4422 B23R3.3868845 c1ccc(cc1)C(CCOC2CCCO2)c3ccccc3 34a_100000085407_100009813428 [0,0,1,1,0,0|2,0,0]=4 4423 B23R3.3868845 c1ccc(cc1)C(CCOC2CCOC2)c3ccccc3 34a_100000032380_100000690089 [0,0,1,1,0,0|2,0,0]=4 4424 B23R3.3868845 c1ccc(cc1)C(CCOC2CCOC2)c3ccccc3 7a_100000032380_100000731011 [0,0,1,1,0,0|2,0,0]=4 4425 B23R3.3868845 c1ccc(cc1)C(CCOC2CCSC2)c3ccccc3 7a_100011232664_100009813428 [0,0,1,1,0,0|2,0,0]=4 4426 B23R3.3868845 c1ccc(cc1)C(CCO[C@H]2CCOC2)c3ccccc3 34a_100000717292_100009813428 [0,0,1,1,0,0|2,0,0]=4 4427 B23R3.3868845 c1ccc(cc1)C(CCSC2CCCC2)c3ccccc3 62a_100009813428_100000179811 [0,0,1,1,0,0|1,0,0]=3 4428 B23R3.3868845 c1ccc(cc1)C(CCSC2CCCC2)c3ccccc3 62a_100011217020_100009813428 [0,0,1,1,0,0|1,0,0]=3 4429 B23R3.3868845 c1ccc(cc1)C(CCSC2CCOC2)c3ccccc3 62a_100009813428_100000690089 [0,0,1,1,0,0|2,0,0]=4 4430 B23R3.3868845 c1ccc(cc1)C(CNCC2CCCC2)c3ccccc3 2230a_100000739227_100000740388 [0,0,1,1,0,0|2,0,0]=4 4431 B23R3.3868845 c1ccc(cc1)C(CNCC2CCCC2)c3ccccc3 269862a_100000739227_100000746403 [0,0,1,1,0,0|2,0,0]=4 4432 B23R3.3868845 c1ccc(cc1)C(CNCC2CCCC2)c3ccccc3 34a_100000739227_100000740388 [0,0,1,1,0,0|2,0,0]=4 4433 B23R3.3868845 c1ccc(cc1)C(COCC2CCCC2)c3ccccc3 34a_100011215272_100000740388 [0,0,1,1,0,0|2,0,0]=4 4434 B23R3.3868845 c1ccc(cc1)C(COCC2CCCC2)c3ccccc3 7a_100011215272_100000740388 [0,0,1,1,0,0|2,0,0]=4 4435 B23R3.3868845 c1ccc(cc1)C(NCCC2CCCC2)c3ccccc3 2230a_100000162943_100000760354 [0,0,1,1,0,0|2,0,0]=4 4436 B23R3.3868845 c1ccc(cc1)C(NCCC2CCCC2)c3ccccc3 2230a_100000739158_100000211591 [0,0,1,1,0,0|2,0,0]=4 4437 B23R3.3868845 c1ccc(cc1)C(NCCC2CCCC2)c3ccccc3 270004a_100000739158_100000210122 [0,0,1,1,0,0|2,0,0]=4 4438 B23R3.3868845 c1ccc(cc1)C(NCCC2CCCC2)c3ccccc3 34a_100000162943_100000760354 [0,0,1,1,0,0|2,0,0]=4 4439 B23R3.3868845 c1ccc(cc1)C(OCCC2CCCC2)c3ccccc3 34a_100000211180_100000760354 [0,0,1,1,0,0|2,0,0]=4 4440 B23R3.3868845 c1ccc(cc1)C(OCCC2CCCC2)c3ccccc3 7a_100000211180_100000760354 [0,0,1,1,0,0|2,0,0]=4 4441 B23R3.3868845 c1ccc(cc1)C(OCCC2CCCC2)c3ccccc3 7a_100000749090_100011216954 [0,0,1,1,0,0|2,0,0]=4 4442 B23R3.3868845 c1ccc(cc1)N(CCOC2CCCC2)c3ccccc3 34a_100010001939_100000179811 [0,0,1,1,0,0|2,0,0]=4 4443 B23R3.3868845 c1ccc(cc1)N(CCOC2CCCC2)c3ccccc3 7a_100010001939_100000179811 [0,0,1,1,0,0|2,0,0]=4 4444 B23R3.3868845 c1ccc(cc1)P(CCNC2CCCC2)c3ccccc3 2230a_107094377242_100000179811 [0,0,1,1,0,0|1,0,0]=3 4445 B23R3.3868845 c1ccc(cc1)P(CCNC2CCCC2)c3ccccc3 270004a_107094377242_100000210133 [0,0,1,1,0,0|1,0,0]=3 4446 B23R3.3868845 c1ccc(cc1)P(CCNC2CCCC2)c3ccccc3 34a_107094377242_100000179811 [0,0,1,1,0,0|1,0,0]=3 4447 B23R3.3868845 c1ccc(cc1)P(CCNC2CCOC2)c3ccccc3 2230a_107094377242_100000731011 [0,0,1,1,0,0|2,0,0]=4 4448 B23R3.3868845 c1ccc(cc1)P(CCNC2CCOC2)c3ccccc3 270004a_107094377242_100000752484 [0,0,1,1,0,0|2,0,0]=4 4449 B23R3.3868845 c1ccc(cc1)P(CCNC2CCOC2)c3ccccc3 34a_107094377242_100000690089 [0,0,1,1,0,0|2,0,0]=4 4450 B23R3.3868845 c1ccc(cc1)P(CCNC2CCSC2)c3ccccc3 270004a_107094377242_100000212027 [0,0,1,1,0,0|2,0,0]=4 4451 B23R3.3868845 c1ccc(cc1)[S+](CCNC2CCCC2)c3ccccc3 2230a_100000211070_100010140906 [0,0,1,1,0,0|1,0,0]=3 4452 B23R3.3868845 c1ccc(cc1)[S+](CCN[C@@H]2CCOC2)c3ccccc3 2230a_200015188469_100010140906 [0,0,1,1,0,0|2,0,0]=4 4453 B23R3.3868845 c1ccc(cc1)[S+](CCN[C@H]2CCOC2)c3ccccc3 2230a_100015188467_100010140906 [0,0,1,1,0,0|2,0,0]=4 4454 B23R3.3868845 c1ccc(cc1)[S+](CCOC2CCCC2)c3ccccc3 7a_100000210269_100010140906 [0,0,1,1,0,0|2,0,0]=4 4455 B23R3.3868845 c1ccc(cc1)[S+](CCSC2CCCC2)c3ccccc3 62a_100010140906_100000179811 [0,0,1,1,0,0|2,0,0]=4 4456 B23R3.3868845 c1ccc(cc1)[S+](CCSC2CCCC2)c3ccccc3 62a_100011217020_100010140906 [0,0,1,1,0,0|2,0,0]=4 4457 B23R3.3868848 C(=C(c1ccccc1)c2ccccc2)CNCC3CCC3 270004a_100000738700_100000050448 [0,0,1,1,0,0|0,0,2]=4 4458 B23R3.3868848 C(=NNCC1CCC1)C(c2ccccc2)c3ccccc3 4a_200020586977_100000183636 [0,0,1,1,0,0|1,0,1]=4 4459 B23R3.3868848 c1ccc(cc1)C(CCNCC2CCC2)c3ccccc3 2230a_100000272388_100000763275 [0,0,1,1,0,0|0,0,0]=2 4460 B23R3.3868848 c1ccc(cc1)C(CCNCC2CCC2)c3ccccc3 2230a_100000738700_100009813428 [0,0,1,1,0,0|0,0,0]=2 4461 B23R3.3868848 c1ccc(cc1)C(CCNCC2CCC2)c3ccccc3 269862a_100000272388_100000753134 [0,0,1,1,0,0|0,0,0]=2 4462 B23R3.3868848 c1ccc(cc1)C(CCNCC2CCC2)c3ccccc3 34a_100000272388_100000763275 [0,0,1,1,0,0|0,0,0]=2 4463 B23R3.3868848 c1ccc(cc1)C(CCNCC2CCC2)c3ccccc3 34a_100000738700_100009813428 [0,0,1,1,0,0|0,0,0]=2 4464 B23R3.3868848 c1ccc(cc1)C(CCNCC2CCO2)c3ccccc3 2230a_100000272388_100000103362 [0,0,1,1,0,0|1,0,0]=3 4465 B23R3.3868848 c1ccc(cc1)C(CCNCC2CCO2)c3ccccc3 34a_100000272388_100000103362 [0,0,1,1,0,0|1,0,0]=3 4466 B23R3.3868848 c1ccc(cc1)C(CCNCC2COC2)c3ccccc3 2230a_100000272388_100010264016 [0,0,1,1,0,0|1,0,0]=3 4467 B23R3.3868848 c1ccc(cc1)C(CCNCC2COC2)c3ccccc3 2230a_100015281925_100009813428 [0,0,1,1,0,0|1,0,0]=3 4468 B23R3.3868848 c1ccc(cc1)C(CCNCC2COC2)c3ccccc3 34a_100000272388_100010264016 [0,0,1,1,0,0|1,0,0]=3 4469 B23R3.3868848 c1ccc(cc1)C(CCNCC2COC2)c3ccccc3 34a_100015281925_100009813428 [0,0,1,1,0,0|1,0,0]=3 4470 B23R3.3868848 c1ccc(cc1)C(CCNC[C@@H]2CCO2)c3ccccc3 2230a_100020831831_100009813428 [0,0,1,1,0,0|1,0,0]=3 4471 B23R3.3868848 c1ccc(cc1)C(CCNC[C@@H]2CCO2)c3ccccc3 34a_100020831831_100009813428 [0,0,1,1,0,0|1,0,0]=3 4472 B23R3.3868848 c1ccc(cc1)C(CCOCC2CCC2)c3ccccc3 34a_100000032380_100000763275 [0,0,1,1,0,0|1,0,0]=3 4473 B23R3.3868848 c1ccc(cc1)C(CCOCC2CCC2)c3ccccc3 34a_100000760304_100009813428 [0,0,1,1,0,0|1,0,0]=3 4474 B23R3.3868848 c1ccc(cc1)C(CCOCC2CCC2)c3ccccc3 7a_100000032380_100000763275 [0,0,1,1,0,0|1,0,0]=3 4475 B23R3.3868848 c1ccc(cc1)C(CCOCC2CCO2)c3ccccc3 34a_100000032380_100000103362 [0,0,1,1,0,0|2,0,0]=4 4476 B23R3.3868848 c1ccc(cc1)C(CCOCC2CCO2)c3ccccc3 34a_100000039022_100009813428 [0,0,1,1,0,0|2,0,0]=4 4477 B23R3.3868848 c1ccc(cc1)C(CCOCC2CCO2)c3ccccc3 7a_100000032380_100000103362 [0,0,1,1,0,0|2,0,0]=4 4478 B23R3.3868848 c1ccc(cc1)C(CCOCC2CNC2)c3ccccc3 34a_100016987283_100009813428 [0,0,1,1,0,0|2,0,0]=4 4479 B23R3.3868848 c1ccc(cc1)C(CCOCC2COC2)c3ccccc3 34a_100000032380_100010264016 [0,0,1,1,0,0|2,0,0]=4 4480 B23R3.3868848 c1ccc(cc1)C(CCOCC2COC2)c3ccccc3 34a_100000060846_100009813428 [0,0,1,1,0,0|2,0,0]=4 4481 B23R3.3868848 c1ccc(cc1)C(CCOCC2COC2)c3ccccc3 7a_100000032380_100010264016 [0,0,1,1,0,0|2,0,0]=4 4482 B23R3.3868848 c1ccc(cc1)C(CCSCC2CCC2)c3ccccc3 62a_100000763275_100009813428 [0,0,1,1,0,0|1,0,0]=3 4483 B23R3.3868848 c1ccc(cc1)C(CCSCC2CCC2)c3ccccc3 62a_100009813428_100000763275 [0,0,1,1,0,0|1,0,0]=3 4484 B23R3.3868848 c1ccc(cc1)C(CCSCC2CCO2)c3ccccc3 62a_100000103362_100009813428 [0,0,1,1,0,0|2,0,0]=4 4485 B23R3.3868848 c1ccc(cc1)C(CCSCC2CCO2)c3ccccc3 62a_100009813428_100000103362 [0,0,1,1,0,0|2,0,0]=4 4486 B23R3.3868848 c1ccc(cc1)C(CCSCC2COC2)c3ccccc3 62a_100009813428_100010264016 [0,0,1,1,0,0|2,0,0]=4 4487 B23R3.3868848 c1ccc(cc1)C(CCSCC2COC2)c3ccccc3 62a_100010264016_100009813428 [0,0,1,1,0,0|2,0,0]=4 4488 B23R3.3868848 c1ccc(cc1)N(CCOCC2CCC2)c3ccccc3 34a_100010001939_100000763275 [0,0,1,1,0,0|2,0,0]=4 4489 B23R3.3868848 c1ccc(cc1)N(CCOCC2CCC2)c3ccccc3 7a_100010001939_100000763275 [0,0,1,1,0,0|2,0,0]=4 4490 B23R3.3868848 c1ccc(cc1)P(CCNCC2CCC2)c3ccccc3 2230a_107094377242_100000763275 [0,0,1,1,0,0|1,0,0]=3 4491 B23R3.3868848 c1ccc(cc1)P(CCNCC2CCC2)c3ccccc3 269862a_107094377242_100000753134 [0,0,1,1,0,0|1,0,0]=3 4492 B23R3.3868848 c1ccc(cc1)P(CCNCC2CCC2)c3ccccc3 34a_107094377242_100000763275 [0,0,1,1,0,0|1,0,0]=3 4493 B23R3.3868848 c1ccc(cc1)P(CCNCC2CCO2)c3ccccc3 2230a_107094377242_100000103362 [0,0,1,1,0,0|2,0,0]=4 4494 B23R3.3868848 c1ccc(cc1)P(CCNCC2CCO2)c3ccccc3 34a_107094377242_100000103362 [0,0,1,1,0,0|2,0,0]=4 4495 B23R3.3868848 c1ccc(cc1)P(CCNCC2COC2)c3ccccc3 2230a_107094377242_100010264016 [0,0,1,1,0,0|2,0,0]=4 4496 B23R3.3868848 c1ccc(cc1)P(CCNCC2COC2)c3ccccc3 34a_107094377242_100010264016 [0,0,1,1,0,0|2,0,0]=4 4497 B23R3.3868848 c1ccc(cc1)[S+](CCNCC2CCC2)c3ccccc3 2230a_100000738700_100010140906 [0,0,1,1,0,0|1,0,0]=3 4498 B23R3.3868848 c1ccc(cc1)[S+](CCNCC2COC2)c3ccccc3 2230a_100015281925_100010140906 [0,0,1,1,0,0|2,0,0]=4 4499 B23R3.3868848 c1ccc(cc1)[S+](CCNC[C@@H]2CCO2)c3ccccc3 2230a_100020831831_100010140906 [0,0,1,1,0,0|2,0,0]=4 4500 B23R3.3868848 c1ccc(cc1)[S+](CCSCC2CCC2)c3ccccc3 62a_100000763275_100010140906 [0,0,1,1,0,0|2,0,0]=4 4501 B23R3.3868848 c1ccc(cc1)[S+](CCSCC2CCC2)c3ccccc3 62a_100010140906_100000763275 [0,0,1,1,0,0|2,0,0]=4 4502 B23R3.19744219 CCCCCCCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000210681 [0,0,1,1,0,0|2,0,0]=4 4503 B23R3.19744219 CCCCCCCNC1c2ccccc2-c3c1cccc3 2230a_100000229938_100000211598 [0,0,1,1,0,0|2,0,0]=4 4504 B23R3.19744219 CCCCCCCOC1c2ccccc2-c3c1cccc3 7a_100000210272_100000211598 [0,0,1,1,0,0|2,0,0]=4 4505 B23R3.19744219 CCCCCCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000210614 [0,0,1,1,0,0|2,0,0]=4 4506 B23R3.19744219 CCCCCCNCC1c2ccccc2-c3c1cccc3 2230a_100016995487_100000210314 [0,0,1,1,0,0|2,0,0]=4 4507 B23R3.19744219 CCCCCCNCC1c2ccccc2-c3c1cccc3 34a_100016995487_100000210314 [0,0,1,1,0,0|2,0,0]=4 4508 B23R3.19744219 CCCCCCOCC1c2ccccc2-c3c1cccc3 34a_100011215202_100000210314 [0,0,1,1,0,0|2,0,0]=4 4509 B23R3.19744219 CCCCCCOCC1c2ccccc2-c3c1cccc3 7a_100011215202_100000210314 [0,0,1,1,0,0|2,0,0]=4 4510 B23R3.19744219 CCCCCOCCn1c2ccccc2c3c1cccc3 34a_100000297428_100000718602 [0,0,1,1,0,0|2,0,0]=4 4511 B23R3.96019 CC(NCC(c1ccccc1)c2ccccc2)C3CCC3 269862a_100000739227_100000760154 [0,0,1,1,0,0|2,0,0]=4 4512 B23R3.96019 CN(CC=C(c1ccccc1)c2ccccc2)C3CCC3 270004a_100000758072_100000050448 [0,0,1,1,0,0|0,0,2]=4 4513 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3CCC3 2230a_100000758072_100009813428 [0,0,1,1,0,0|0,0,0]=2 4514 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3CCC3 269982a_100000758072_100009813428 [0,0,1,1,0,0|0,0,0]=2 4515 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3CCC3 269982a_100025726140_100000749161 [0,0,1,1,0,0|0,0,0]=2 4516 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3CCC3 270004a_100025726140_100000241760 [0,0,1,1,0,0|0,0,0]=2 4517 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3CCC3 34a_100000758072_100009813428 [0,0,1,1,0,0|0,0,0]=2 4518 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3CCC3 34a_100025726140_100000749161 [0,0,1,1,0,0|0,0,0]=2 4519 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3COC3 2230a_100102693430_100009813428 [0,0,1,1,0,0|1,0,0]=3 4520 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3COC3 269982a_100025726140_100000687716 [0,0,1,1,0,0|1,0,0]=3 4521 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3COC3 269982a_100102693430_100009813428 [0,0,1,1,0,0|1,0,0]=3 4522 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3COC3 34a_100025726140_100009818527 [0,0,1,1,0,0|1,0,0]=3 4523 B23R3.96019 CN(CC[S+](c1ccccc1)c2ccccc2)C3CCC3 2230a_100000758072_100010140906 [0,0,1,1,0,0|1,0,0]=3 4524 B23R3.96019 CN(CC[S+](c1ccccc1)c2ccccc2)C3CCC3 269982a_100000758072_100010140906 [0,0,1,1,0,0|1,0,0]=3 4525 B23R3.96019 CN(CC[S+](c1ccccc1)c2ccccc2)C3COC3 2230a_100102693430_100010140906 [0,0,1,1,0,0|2,0,0]=4 4526 B23R3.96019 CN(CC[S+](c1ccccc1)c2ccccc2)C3COC3 269982a_100102693430_100010140906 [0,0,1,1,0,0|2,0,0]=4 4527 B23R3.96019 O=C(CCC(c1ccccc1)c2ccccc2)C3CCC3 1458a_100000209988_100009813428 [0,0,1,1,0,0|2,0,0]=4 4528 B23R3.96020 CC(CC1CC1)NCC(c2ccccc2)c3ccccc3 270004a_100000739227_200000686933 [0,0,1,1,0,0|2,0,0]=4 4529 B23R3.96020 CN(CC=C(c1ccccc1)c2ccccc2)CC3CC3 270004a_100000741881_100000050448 [0,0,1,1,0,0|0,0,2]=4 4530 B23R3.96020 CN(CCC(c1ccccc1)c2ccccc2)CC3CC3 2230a_100000741881_100009813428 [0,0,1,1,0,0|0,0,0]=2 4531 B23R3.96020 CN(CCC(c1ccccc1)c2ccccc2)CC3CC3 2230a_100025726140_100000742324 [0,0,1,1,0,0|0,0,0]=2 4532 B23R3.96020 CN(CCC(c1ccccc1)c2ccccc2)CC3CC3 269982a_100000741881_100009813428 [0,0,1,1,0,0|0,0,0]=2 4533 B23R3.96020 CN(CCC(c1ccccc1)c2ccccc2)CC3CC3 269982a_100025726140_100000756562 [0,0,1,1,0,0|0,0,0]=2 4534 B23R3.96020 CN(CCC(c1ccccc1)c2ccccc2)CC3CC3 34a_100025726140_100000742324 [0,0,1,1,0,0|0,0,0]=2 4535 B23R3.96020 CN(CCC(c1ccccc1)c2ccccc2)CC3CO3 2230a_100025726140_100011216344 [0,0,1,1,0,0|1,0,0]=3 4536 B23R3.96020 CN(CCC(c1ccccc1)c2ccccc2)CC3CO3 269982a_100025726140_102125554688 [0,0,1,1,0,0|1,0,0]=3 4537 B23R3.96020 CN(CCC(c1ccccc1)c2ccccc2)CC3CO3 34a_100025726140_102125554688 [0,0,1,1,0,0|1,0,0]=3 4538 B23R3.96020 CN(CCC(c1ccccc1)c2ccccc2)CC3CS3 269982a_100025726140_100000031435 [0,0,1,1,0,0|1,0,0]=3 4539 B23R3.96020 CN(CCC(c1ccccc1)c2ccccc2)C[C@@H]3CO3 269982a_100025726140_100000745022 [0,0,1,1,0,0|1,0,0]=3 4540 B23R3.96020 CN(CC[S+](c1ccccc1)c2ccccc2)CC3CC3 2230a_100000741881_100010140906 [0,0,1,1,0,0|1,0,0]=3 4541 B23R3.96020 CN(CC[S+](c1ccccc1)c2ccccc2)CC3CC3 269982a_100000741881_100010140906 [0,0,1,1,0,0|1,0,0]=3 4542 B23R3.96020 O=C(CCC(c1ccccc1)c2ccccc2)CC3CC3 1458a_100000738066_100009813428 [0,0,1,1,0,0|2,0,0]=4 4543 B23R3.768819 CC1CC1C(=O)CCC(c2ccccc2)c3ccccc3 1458a_100000211227_100009813428 [0,0,1,1,0,0|2,0,0]=4 4544 B23R3.1735855 CCC1CN(C1)CC=C(c2ccccc2)c3ccccc3 270004a_100015205115_100000050448 [0,0,1,1,0,0|0,0,2]=4 4545 B23R3.1735855 CCC1CN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100015205115_100009813428 [0,0,1,1,0,0|0,0,0]=2 4546 B23R3.1735855 CCC1CN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100015205115_100009813428 [0,0,1,1,0,0|0,0,0]=2 4547 B23R3.1735855 CCC1CN(C1)CC[S+](c2ccccc2)c3ccccc3 2230a_100015205115_100010140906 [0,0,1,1,0,0|1,0,0]=3 4548 B23R3.1735855 CCC1CN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100015205115_100010140906 [0,0,1,1,0,0|1,0,0]=3 4549 B23R3.1735855 COC1CN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100000755009_100009813428 [0,0,1,1,0,0|1,0,0]=3 4550 B23R3.1735855 COC1CN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100000755009_100010140906 [0,0,1,1,0,0|2,0,0]=4 4551 B23R3.1735855 CSC1CN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100016990038_100009813428 [0,0,1,1,0,0|1,0,0]=3 4552 B23R3.1735855 CSC1CN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100016990038_100010140906 [0,0,1,1,0,0|2,0,0]=4 4553 B23R3.1735855 FCC1CN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100010363649_100009813428 [0,0,1,1,0,0|1,0,0]=3 4554 B23R3.1735855 FCC1CN(C1)CCC(c2ccccc2)c3ccccc3 34a_100010363649_100009813428 [0,0,1,1,0,0|1,0,0]=3 4555 B23R3.1735855 FCC1CN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100010363649_100010140906 [0,0,1,1,0,0|2,0,0]=4 4556 B23R3.1735855 OCC1CN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100016987283_100009813428 [0,0,1,1,0,0|1,0,0]=3 4557 B23R3.1735855 OCC1CN(C1)CCC(c2ccccc2)c3ccccc3 34a_100016987283_100009813428 [0,0,1,1,0,0|1,0,0]=3 4558 B23R3.1735855 OCC1CN(C1)CC[S+](c2ccccc2)c3ccccc3 269982a_100016987283_100010140906 [0,0,1,1,0,0|2,0,0]=4 4559 B23R3.32362876 CCCCC(C)COC1c2ccccc2-c3c1cccc3 7a_100011995851_100000211598 [0,0,1,1,0,0|2,0,0]=4 4560 B23R3.32362876 CCCCC(C)NCC1c2ccccc2-c3c1cccc3 2230a_100016995487_200011215066 [0,0,1,1,0,0|2,0,0]=4 4561 B23R3.32362876 CCCCC(C)NCC1c2ccccc2-c3c1cccc3 270004a_100016995487_100000210087 [0,0,1,1,0,0|2,0,0]=4 4562 B23R3.32362876 CCCCC(C)NCC1c2ccccc2-c3c1cccc3 34a_100016995487_200011215066 [0,0,1,1,0,0|2,0,0]=4 4563 B23R3.32362876 CCCCC(C)OCC1c2ccccc2-c3c1cccc3 34a_100011215202_200011215066 [0,0,1,1,0,0|2,0,0]=4 4564 B23R3.32362876 CCCCC(C)OCC1c2ccccc2-c3c1cccc3 7a_100011215202_200011215066 [0,0,1,1,0,0|2,0,0]=4 4565 B23R3.15849 C#CCN1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_100000038162 [0,0,1,1,0,0|0,0,2]=4 4566 B23R3.15849 C#CCN1CCC(CC1)(c2ccccc2)c3ccccc3 34a_100020605268_100000184674 [0,0,1,1,0,0|0,0,2]=4 4567 B23R3.15849 C=CCN1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_100000210623 [0,0,1,1,0,0|0,0,2]=4 4568 B23R3.15849 C=CCN1CCC(CC1)(c2ccccc2)c3ccccc3 269982a_100020605268_100000210623 [0,0,1,1,0,0|0,0,2]=4 4569 B23R3.15849 C=CCN1CCC(CC1)(c2ccccc2)c3ccccc3 34a_100020605268_100015514636 [0,0,1,1,0,0|0,0,2]=4 4570 B23R3.15849 CCCN1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_100000210303 [0,0,1,1,0,0|0,0,0]=2 4571 B23R3.15849 CCCN1CCC(CC1)(c2ccccc2)c3ccccc3 269982a_100020605268_100000210303 [0,0,1,1,0,0|0,0,0]=2 4572 B23R3.15849 CCCN1CCC(CC1)(c2ccccc2)c3ccccc3 34a_100020605268_100000210303 [0,0,1,1,0,0|0,0,0]=2 4573 B23R3.15849 CCOC1CCC(CC1)(c2ccccc2)c3ccccc3 34a_100020646429_100000210202 [0,0,1,1,0,0|2,0,0]=4 4574 B23R3.15849 CCOC1CCC(CC1)(c2ccccc2)c3ccccc3 7a_100020646429_100000210202 [0,0,1,1,0,0|2,0,0]=4 4575 B23R3.15849 COCN1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_100000766300 [0,0,1,1,0,0|1,0,0]=3 4576 B23R3.15849 COCN1CCC(CC1)(c2ccccc2)c3ccccc3 269982a_100020605268_100000766300 [0,0,1,1,0,0|1,0,0]=3 4577 B23R3.15849 CSCN1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_100011218213 [0,0,1,1,0,0|1,0,0]=3 4578 B23R3.15849 CSCN1CCC(CC1)(c2ccccc2)c3ccccc3 269982a_100020605268_100011218213 [0,0,1,1,0,0|1,0,0]=3 4579 B23R3.15849 CSCN1CCC(CC1)(c2ccccc2)c3ccccc3 34a_100020605268_100011218213 [0,0,1,1,0,0|1,0,0]=3 4580 B23R3.15849 FCCN1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_100011217306 [0,0,1,1,0,0|1,0,0]=3 4581 B23R3.15849 FCCN1CCC(CC1)(c2ccccc2)c3ccccc3 269982a_100020605268_100011217306 [0,0,1,1,0,0|1,0,0]=3 4582 B23R3.15849 FCCN1CCC(CC1)(c2ccccc2)c3ccccc3 34a_100020605268_100011217306 [0,0,1,1,0,0|1,0,0]=3 4583 B23R3.15849 N#CCN1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_100011215382 [0,0,1,1,0,0|1,0,1]=4 4584 B23R3.15849 N#CCN1CCC(CC1)(c2ccccc2)c3ccccc3 269982a_100020605268_100011214920 [0,0,1,1,0,0|1,0,1]=4 4585 B23R3.15849 O=CCN1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_200015260668 [0,0,1,1,0,0|1,0,1]=4 4586 B23R3.15849 O=CCN1CCC(CC1)(c2ccccc2)c3ccccc3 269982a_100020605268_200015260668 [0,0,1,1,0,0|1,0,1]=4 4587 B23R3.15849 O=CCN1CCC(CC1)(c2ccccc2)c3ccccc3 34a_100020605268_200009817547 [0,0,1,1,0,0|1,0,1]=4 4588 B23R3.15849 OCCN1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_100000211926 [0,0,1,1,0,0|1,0,0]=3 4589 B23R3.15849 OCCN1CCC(CC1)(c2ccccc2)c3ccccc3 269982a_100020605268_100000211926 [0,0,1,1,0,0|1,0,0]=3 4590 B23R3.15849 OCCN1CCC(CC1)(c2ccccc2)c3ccccc3 34a_100020605268_100000211926 [0,0,1,1,0,0|1,0,0]=3 4591 B23R3.749922 C[C@H]1[C@H](CN1CCC(c2ccccc2)c3ccccc3)O 2230a_206633788156_100009813428 [0,0,1,1,0,0|1,0,0]=3 4592 B23R3.749922 C[C@H]1[C@H](CN1CCC(c2ccccc2)c3ccccc3)O 269982a_206633788156_100009813428 [0,0,1,1,0,0|1,0,0]=3 4593 B23R3.749922 C[C@H]1[C@H](CN1CC[S+](c2ccccc2)c3ccccc3)O 2230a_206633788156_100010140906 [0,0,1,1,0,0|2,0,0]=4 4594 B23R3.749922 C[C@H]1[C@H](CN1CC[S+](c2ccccc2)c3ccccc3)O 269982a_206633788156_100010140906 [0,0,1,1,0,0|2,0,0]=4 4595 B23R3.1996861 CCC(NCC(c1ccccc1)c2ccccc2)C3CC3 269862a_100000739227_100000759681 [0,0,1,1,0,0|2,0,0]=4 4596 B23R3.1996861 CCN(CC=C(c1ccccc1)c2ccccc2)C3CC3 270004a_100000738653_100000050448 [0,0,1,1,0,0|0,0,2]=4 4597 B23R3.1996861 CCN(CCC(c1ccccc1)c2ccccc2)C3CC3 2230a_100000738653_100009813428 [0,0,1,1,0,0|0,0,0]=2 4598 B23R3.1996861 CCN(CCC(c1ccccc1)c2ccccc2)C3CC3 269982a_100000738653_100009813428 [0,0,1,1,0,0|0,0,0]=2 4599 B23R3.1996861 CCN(CC[S+](c1ccccc1)c2ccccc2)C3CC3 2230a_100000738653_100010140906 [0,0,1,1,0,0|1,0,0]=3 4600 B23R3.1996861 CCN(CC[S+](c1ccccc1)c2ccccc2)C3CC3 269982a_100000738653_100010140906 [0,0,1,1,0,0|1,0,0]=3 4601 B23R3.5255688 CCC1(CCC1)CNC(c2ccccc2)c3ccccc3 2230a_100000685557_100000211591 [0,0,1,1,0,0|2,0,0]=4 4602 B23R3.5255688 CCC1(CCC1)CNC(c2ccccc2)c3ccccc3 270004a_100000685557_100000210122 [0,0,1,1,0,0|2,0,0]=4 4603 B23R3.8717540 CCCC(CC)NCC1c2ccccc2-c3c1cccc3 270004a_100016995487_100000687865 [0,0,1,1,0,0|2,0,0]=4 4604 B23R3.8717540 CCCC(CC)OCC1c2ccccc2-c3c1cccc3 7a_100011215202_100011219200 [0,0,1,1,0,0|2,0,0]=4 4605 B23R4.1519781 c1ccc(cc1)C(NC2CCC3C2C3)c4ccccc4 269862a_100000162943_100000692480 [0,0,0,1,1,0|2,0,0]=4 4606 B23R4.1519781 c1ccc(cc1)C(NC2CCC3C2C3)c4ccccc4 270004a_100000162943_100000692480 [0,0,0,1,1,0|2,0,0]=4 4607 B23R4.1519814 c1ccc(cc1)C(NC2CC3CC3C2)c4ccccc4 270004a_100000162943_100010340937 [0,0,0,1,1,0|2,0,0]=4 4608 B23R4.1520393 c1ccc2c(c1)-c3ccccc3C2NC4CCCCC4 2230a_100000182618_100000211598 [0,0,0,1,1,0|2,0,0]=4 4609 B23R4.1520393 c1ccc2c(c1)-c3ccccc3C2NC4CCCCC4 270004a_100000104097_100000210434 [0,0,0,1,1,0|2,0,0]=4 4610 B23R4.1520393 c1ccc2c(c1)-c3ccccc3C2OC4CCCCC4 7a_100000210231_100000211598 [0,0,0,1,1,0|2,0,0]=4 4611 B23R4.1520393 c1ccc2c(c1)-c3ccccc3C2OC4CCCCC4 7a_100000211495_100000210327 [0,0,0,1,1,0|2,0,0]=4 4612 B23R4.1520393 c1ccc2c(c1)-c3ccccc3C2SC4CCCCC4 62a_100000211598_100000210327 [0,0,0,1,1,0|2,0,0]=4 4613 B23R4.4610233 c1ccc(cc1)C(c2ccccc2)N3C4CCC3CC4 2230a_100000735658_100000211591 [0,0,0,1,1,0|2,0,0]=4 4614 B23R4.4610233 c1ccc(cc1)C(c2ccccc2)N3C4CCC3CC4 269982a_100000735658_100000211591 [0,0,0,1,1,0|2,0,0]=4 4615 B23R4.4610233 c1ccc(cc1)C(c2ccccc2)N3C4CCC3CC4 270004a_100000735658_100000210122 [0,0,0,1,1,0|2,0,0]=4 4616 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2CNC4CCCC4 2230a_100016995487_100000179811 [0,0,0,1,1,0|2,0,0]=4 4617 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2CNC4CCCC4 270004a_100016995487_100000210133 [0,0,0,1,1,0|2,0,0]=4 4618 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2CNC4CCCC4 34a_100016995487_100000179811 [0,0,0,1,1,0|2,0,0]=4 4619 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2COC4CCCC4 34a_100011215202_100000179811 [0,0,0,1,1,0|2,0,0]=4 4620 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2COC4CCCC4 7a_100011215202_100000179811 [0,0,0,1,1,0|2,0,0]=4 4621 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2NCC4CCCC4 2230a_100000104097_100000740388 [0,0,0,1,1,0|2,0,0]=4 4622 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2NCC4CCCC4 2230a_100000737975_100000211598 [0,0,0,1,1,0|2,0,0]=4 4623 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2NCC4CCCC4 269862a_100000104097_100000746403 [0,0,0,1,1,0|2,0,0]=4 4624 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2OCC4CCCC4 7a_100000211495_100000740388 [0,0,0,1,1,0|2,0,0]=4 4625 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2OCC4CCCC4 7a_100000742336_100000211598 [0,0,0,1,1,0|2,0,0]=4 4626 B23R4.1517316 c1ccc2c(c1)-c3ccccc3C2SCC4CCCC4 62a_100000211598_100000740388 [0,0,0,1,1,0|2,0,0]=4 4627 B23R4.4610239 c1ccc(cc1)C(c2ccccc2)N3CC4CCC3C4 2230a_100000743476_100000211591 [0,0,0,1,1,0|2,0,0]=4 4628 B23R4.4610239 c1ccc(cc1)C(c2ccccc2)N3CC4CCC3C4 269982a_100000743476_100000211591 [0,0,0,1,1,0|2,0,0]=4 4629 B23R4.4610239 c1ccc(cc1)C(c2ccccc2)N3CC4CCC3C4 270004a_100000743476_100000210122 [0,0,0,1,1,0|2,0,0]=4 4630 B25R4.8312528 c1ccc(cc1)CC(OC2C3CCC2CC3)c4ccccc4 34a_100000246494_100009813300 [0,0,0,1,0,1|2,0,0]=4 4631 B25R4.1655245 C1=C(CCCC1)CCNC2c3ccccc3-c4c2cccc4 2230a_100000212019_100000211598 [0,0,0,1,0,1|1,0,1]=4 4632 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCCCC4 2230a_100016995487_100000211423 [0,0,0,1,0,1|1,0,0]=3 4633 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCCCC4 269862a_100016995487_100000211278 [0,0,0,1,0,1|1,0,0]=3 4634 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCCCC4 34a_100016995487_100000211423 [0,0,0,1,0,1|1,0,0]=3 4635 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCCCO4 2230a_100016995487_100000211543 [0,0,0,1,0,1|2,0,0]=4 4636 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCCCO4 34a_100016995487_100000211543 [0,0,0,1,0,1|2,0,0]=4 4637 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCCOC4 2230a_100016995487_100000741521 [0,0,0,1,0,1|2,0,0]=4 4638 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCCOC4 34a_100016995487_100000741521 [0,0,0,1,0,1|2,0,0]=4 4639 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCOCC4 2230a_100016995487_100000754603 [0,0,0,1,0,1|2,0,0]=4 4640 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCOCC4 269862a_100016995487_100000749017 [0,0,0,1,0,1|2,0,0]=4 4641 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCOCC4 34a_100016995487_100000754603 [0,0,0,1,0,1|2,0,0]=4 4642 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCSCC4 269862a_100016995487_100000067145 [0,0,0,1,0,1|2,0,0]=4 4643 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCSCC4 270004a_100016995487_100000067145 [0,0,0,1,0,1|2,0,0]=4 4644 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2COCC4CCCCC4 34a_100011215202_100000211423 [0,0,0,1,0,1|1,0,0]=3 4645 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2COCC4CCCCC4 7a_100011215202_100000211423 [0,0,0,1,0,1|1,0,0]=3 4646 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2COCC4CCCCO4 34a_100011215202_100000211543 [0,0,0,1,0,1|2,0,0]=4 4647 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2COCC4CCCCO4 7a_100011215202_100000211543 [0,0,0,1,0,1|2,0,0]=4 4648 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2COCC4CCCOC4 34a_100011215202_100000741521 [0,0,0,1,0,1|2,0,0]=4 4649 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2COCC4CCCOC4 7a_100011215202_100000741521 [0,0,0,1,0,1|2,0,0]=4 4650 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2COCC4CCOCC4 34a_100011215202_100000754603 [0,0,0,1,0,1|2,0,0]=4 4651 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2COCC4CCOCC4 7a_100011215202_100000754603 [0,0,0,1,0,1|2,0,0]=4 4652 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCC4CCCCC4 2230a_100000104097_100012355289 [0,0,0,1,0,1|1,0,0]=3 4653 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCC4CCCCC4 2230a_100000738074_100000211598 [0,0,0,1,0,1|1,0,0]=3 4654 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCC4CCCCC4 270004a_100000104097_100011713444 [0,0,0,1,0,1|1,0,0]=3 4655 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCC4CCCCO4 2230a_100015183643_100000211598 [0,0,0,1,0,1|2,0,0]=4 4656 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCC4CCOCC4 2230a_100000104097_100011934994 [0,0,0,1,0,1|2,0,0]=4 4657 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCC4CCOCC4 2230a_100000755988_100000211598 [0,0,0,1,0,1|2,0,0]=4 4658 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCN4CCCCC4 2230a_100000104097_100000739454 [0,0,0,1,0,1|0,0,0]=2 4659 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCN4CCOCC4 2230a_100000104097_100025781966 [0,0,0,1,0,1|1,0,0]=3 4660 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCN4CCSCC4 2230a_100000755026_100000211598 [0,0,0,1,0,1|1,0,0]=3 4661 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCOC4CCCCC4 2230a_100000104097_100011935260 [0,0,0,1,0,1|2,0,0]=4 4662 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCCC4CCCCC4 7a_100000211495_100011273959 [0,0,0,1,0,1|1,0,0]=3 4663 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCCC4CCCCC4 7a_100011217863_100000211598 [0,0,0,1,0,1|1,0,0]=3 4664 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCCC4CCOCC4 7a_100000211495_100011934994 [0,0,0,1,0,1|2,0,0]=4 4665 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCCC4CCOCC4 7a_100011933979_100000211598 [0,0,0,1,0,1|2,0,0]=4 4666 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCCN4CCCCC4 7a_100000211495_100000739454 [0,0,0,1,0,1|0,0,0]=2 4667 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCCN4CCOCC4 7a_100000211495_100000211760 [0,0,0,1,0,1|1,0,0]=3 4668 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCCN4CCSCC4 7a_100000686052_100000211598 [0,0,0,1,0,1|1,0,0]=3 4669 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2OCOC4CCCCC4 7a_100000211495_100011935260 [0,0,0,1,0,1|2,0,0]=4 4670 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2SCCC4CCOCC4 62a_100000211598_100011934994 [0,0,0,1,0,1|2,0,0]=4 4671 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2SCCN4CCCCC4 62a_100000211598_100000739454 [0,0,0,1,0,1|0,0,0]=2 4672 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2SCCN4CCOCC4 62a_100000211598_100000211760 [0,0,0,1,0,1|1,0,0]=3 4673 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2SCOC4CCCCC4 62a_100000211598_100011935260 [0,0,0,1,0,1|2,0,0]=4 4674 B25R4.1655245 c1ccc2c(c1)c3ccccc3n2CCOC4CCCCC4 34a_100000297428_100000210327 [0,0,0,1,0,1|2,0,0]=4 4675 B25R4.8313090 c1ccc(cc1)C(CCNC2CCC3C2C3)c4ccccc4 269862a_100000272388_100000692480 [0,0,0,1,0,1|1,0,0]=3 4676 B25R4.8313090 c1ccc(cc1)C(CCNC2CCC3C2C3)c4ccccc4 270004a_100000272388_100000692480 [0,0,0,1,0,1|1,0,0]=3 4677 B25R4.8313090 c1ccc(cc1)C(CCOC2CCC3C2C3)c4ccccc4 34a_200012295571_100009813428 [0,0,0,1,0,1|1,0,0]=3 4678 B25R4.8313090 c1ccc(cc1)P(CCNC2CCC3C2C3)c4ccccc4 269862a_107094377242_100000692480 [0,0,0,1,0,1|2,0,0]=4 4679 B25R4.8313090 c1ccc(cc1)P(CCNC2CCC3C2C3)c4ccccc4 270004a_107094377242_100000692480 [0,0,0,1,0,1|2,0,0]=4 4680 B25R4.8313093 c1ccc(cc1)C(CCN2C3CCC2CC3)c4ccccc4 2230a_100000735658_100009813428 [0,0,0,1,0,1|1,0,0]=3 4681 B25R4.8313093 c1ccc(cc1)C(CCN2C3CCC2CC3)c4ccccc4 269982a_100000735658_100009813428 [0,0,0,1,0,1|1,0,0]=3 4682 B25R4.8313093 c1ccc(cc1)C(CCN2C3CCC2CC3)c4ccccc4 34a_100000735658_100009813428 [0,0,0,1,0,1|1,0,0]=3 4683 B25R4.8313093 c1ccc(cc1)C(CNC2C3CCC2CC3)c4ccccc4 34a_100000739227_100009813300 [0,0,0,1,0,1|1,0,0]=3 4684 B25R4.8313093 c1ccc(cc1)C(COC2C3CCC2CC3)c4ccccc4 34a_100011215272_100009813300 [0,0,0,1,0,1|1,0,0]=3 4685 B25R4.8313093 c1ccc(cc1)[S+](CCN2C3CCC2CC3)c4ccccc4 2230a_100000735658_100010140906 [0,0,0,1,0,1|2,0,0]=4 4686 B25R4.8313093 c1ccc(cc1)[S+](CCN2C3CCC2CC3)c4ccccc4 269982a_100000735658_100010140906 [0,0,0,1,0,1|2,0,0]=4 4687 B25R4.8321265 c1ccc(cc1)C(N[C@H]2CN3CCC2CC3)c4ccccc4 2230a_100016987387_100000211591 [0,0,0,1,0,1|0,0,0]=2 4688 B25R4.8323931 c1ccc(cc1)C(c2ccccc2)N3CCN4CCC3CC4 269982a_100000027273_100000211591 [0,0,0,1,0,1|0,0,0]=2 4689 B25R4.8323931 c1ccc(cc1)C(c2ccccc2)N3CCN4CCC3CC4 270004a_100000027273_100000210122 [0,0,0,1,0,1|0,0,0]=2 4690 B25R4.8323931 c1ccc(cc1)C(c2ccccn2)N3CCN4CCC3CC4 270004a_100000027273_100000210380 [0,0,0,1,0,1|1,0,0]=3 4691 B25R4.8323931 c1ccc(cc1)C(c2cccnc2)N3CCN4CCC3CC4 270004a_100000027273_100000735413 [0,0,0,1,0,1|1,0,0]=3 4692 B25R4.8323931 c1ccc(nc1)C(c2cccnc2)N3CCN4CCC3CC4 270004a_100000027273_100011376182 [0,0,0,1,0,1|2,0,0]=4 4693 B25R4.8323931 c1cncc(c1)C(c2cccnc2)N3CCN4CCC3CC4 270004a_100000027273_200011376183 [0,0,0,1,0,1|2,0,0]=4 4694 B25R4.8323974 c1ccc(cc1)C(CCNC2C3C2COC3)c4ccccc4 2230a_100000702821_100009813428 [0,0,0,1,0,1|2,0,0]=4 4695 B25R4.8323974 c1ccc(cc1)C(CCNC2C3C2COC3)c4ccccc4 34a_100000702821_100009813428 [0,0,0,1,0,1|2,0,0]=4 4696 B25R4.8323978 c1ccc(cc1)C(CCNC2CC3CC3C2)c4ccccc4 270004a_100000272388_100010340937 [0,0,0,1,0,1|1,0,0]=3 4697 B25R4.8323978 c1ccc(cc1)C(OCCN2CC3CC3C2)c4ccccc4 2230a_100000741873_100000734929 [0,0,0,1,0,1|0,0,0]=2 4698 B25R4.8323978 c1ccc(cc1)C(OCCN2CC3CC3C2)c4ccccc4 269982a_100000741873_100000734929 [0,0,0,1,0,1|0,0,0]=2 4699 B25R4.8323978 c1ccc(cc1)C(OCCN2CC3CC3C2)c4ccccc4 34a_100000741873_100000734929 [0,0,0,1,0,1|0,0,0]=2 4700 B25R4.8323978 c1ccc(cc1)P(CCNC2CC3CC3C2)c4ccccc4 270004a_107094377242_100010340937 [0,0,0,1,0,1|2,0,0]=4 4701 B25R4.1654576 c1ccc(cc1)C(CNC2CCCC3C2C3)c4ccccc4 269862a_100000739227_100000697651 [0,0,0,1,0,1|2,0,0]=4 4702 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2CNC4CCCCCC4 270004a_100016995487_100000210131 [0,0,0,1,0,1|2,0,0]=4 4703 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2CNC4CCCCCC4 34a_100016995487_100011217769 [0,0,0,1,0,1|2,0,0]=4 4704 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2CNC4CCCNCC4 270004a_100016995487_100015187895 [0,0,0,1,0,1|2,0,0]=4 4705 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2COC4CCCCCC4 34a_100011215202_100011217769 [0,0,0,1,0,1|2,0,0]=4 4706 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCCC4 2230a_100000104097_200000696569 [0,0,0,1,0,1|2,0,0]=4 4707 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCCC4 2230a_100015204231_100000211598 [0,0,0,1,0,1|2,0,0]=4 4708 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2NCC4CCCCCC4 269862a_100000104097_200000763224 [0,0,0,1,0,1|2,0,0]=4 4709 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2OCC4CCCCCC4 7a_100000211495_200000696569 [0,0,0,1,0,1|2,0,0]=4 4710 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2OCC4CCCCCC4 7a_100000699130_100000211598 [0,0,0,1,0,1|2,0,0]=4 4711 B25R4.1678928 CC(CC(c1ccccc1)c2ccccc2)N3CC4CC4C3 270004a_100000741873_200000011111 [0,1,0,1,0,0|0,0,0]=2 4712 B25R4.1678928 O=C(CC(c1ccccc1)c2ccccc2)N3CC4CC4C3 11a_100000741873_100000499737 [0,1,0,1,0,0|0,0,1]=3 4713 B25R4.1678928 O=C(CC(c1ccccc1)c2ccccc2)N3CC4CC4C3 1626a_100000741873_100000499737 [0,1,0,1,0,0|0,0,1]=3 4714 B25R4.1678928 O=C(CC(c1ccccc1)c2ccccc2)N3CC4CC4C3 240690a_100000741873_100000499737 [0,1,0,1,0,0|0,0,1]=3 4715 B25R4.1678928 O=C(CC(c1ccccc1)c2ccccc2)N3CC4CC4C3 527a_100000741873_100000499737 [0,1,0,1,0,0|0,0,1]=3 4716 B25R4.1678928 O=C(CP(c1ccccc1)c2ccccc2)N3CC4CC4C3 11a_100000741873_200020607205 [0,1,0,1,0,0|1,0,1]=4 4717 B25R4.1678928 O=C(CP(c1ccccc1)c2ccccc2)N3CC4CC4C3 1626a_100000741873_200020607205 [0,1,0,1,0,0|1,0,1]=4 4718 B25R4.1678928 O=C(CP(c1ccccc1)c2ccccc2)N3CC4CC4C3 240690a_100000741873_200020607205 [0,1,0,1,0,0|1,0,1]=4 4719 B25R4.1678928 O=C(CP(c1ccccc1)c2ccccc2)N3CC4CC4C3 527a_100000741873_200020607205 [0,1,0,1,0,0|1,0,1]=4 4720 B25R4.54373159 CC(NC1c2ccccc2-c3c1cccc3)C4CCCCC4 269862a_100000104097_100000210989 [0,1,0,1,0,0|2,0,0]=4 4721 B25R4.54373159 CC(OC1c2ccccc2-c3c1cccc3)C4CCCCC4 7a_100011216961_100000211598 [0,1,0,1,0,0|2,0,0]=4 4722 B25R4.54373159 C[C@@H](NC1c2ccccc2-c3c1cccc3)C4CCCCC4 2230a_100025707633_100000211598 [0,1,0,1,0,0|2,0,0]=4 4723 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)C4CCCCC4 1458a_100000011082_100000210327 [0,1,0,1,0,0|1,0,1]=4 4724 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)N4CCCOC4 11a_100000131196_100000011082 [0,1,0,1,0,0|1,0,1]=4 4725 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)N4CCCOC4 240690a_100000131196_100000011082 [0,1,0,1,0,0|1,0,1]=4 4726 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)N4CCOCC4 11a_100015191051_100000011082 [0,1,0,1,0,0|1,0,1]=4 4727 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)N4CCOCC4 1626a_100015191051_100000011082 [0,1,0,1,0,0|1,0,1]=4 4728 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)N4CCOCC4 240690a_100015191051_100000011082 [0,1,0,1,0,0|1,0,1]=4 4729 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)N4CCOCC4 527a_100015191051_100000011082 [0,1,0,1,0,0|1,0,1]=4 4730 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)N4CCSCC4 11a_100000737611_100000011082 [0,1,0,1,0,0|1,0,1]=4 4731 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)N4CCSCC4 240690a_100000737611_100000011082 [0,1,0,1,0,0|1,0,1]=4 4732 B25R4.54373159 O=C(CC1c2ccccc2-c3c1cccc3)N4CCSCC4 527a_100000737611_100000011082 [0,1,0,1,0,0|1,0,1]=4 4733 B25R4.2295206 Brc1cccc(c1)C(NC2C3CCC2CC3)c4ccccc4 34a_100011212009_100009813300 [0,1,0,1,0,0|2,0,0]=4 4734 B25R4.2295206 Clc1cccc(c1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000741085_100009813300 [0,1,0,1,0,0|2,0,0]=4 4735 B25R4.2295206 Clc1cccc(c1)C(OC2C3CCC2CC3)c4ccccc4 34a_100000733576_100009813300 [0,1,0,1,0,0|2,0,0]=4 4736 B25R4.2295206 Fc1cccc(c1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000686443_100009813300 [0,1,0,1,0,0|2,0,0]=4 4737 B25R4.2295206 Fc1cccc(c1)C(OC2C3CCC2CC3)c4ccccc4 34a_100000749007_100009813300 [0,1,0,1,0,0|2,0,0]=4 4738 B25R4.2937826 Nc1ccc-2c(c1)C(c3c2cccc3)COC4CCCCC4 34a_200010591344_100000210327 [0,1,0,1,0,0|2,0,0]=4 4739 B25R4.2937826 Nc1ccc-2c(c1)C(c3c2cccc3)COC4CCCCC4 7a_200010591344_100000210327 [0,1,0,1,0,0|2,0,0]=4 4740 B25R4.50009191 Brc1cccc(c1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100011267660 [0,1,0,1,0,0|2,0,0]=4 4741 B25R4.50009191 Cc1cccc(c1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100011217825 [0,1,0,1,0,0|2,0,0]=4 4742 B25R4.50009191 Clc1cccc(c1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100011215489 [0,1,0,1,0,0|2,0,0]=4 4743 B25R4.50009191 Fc1cccc(c1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_200011219850 [0,1,0,1,0,0|2,0,0]=4 4744 B25R4.2786505 Brc1ccccc1C(NC2C3CCC2CC3)c4ccccc4 34a_100011211563_100009813300 [0,1,0,1,0,0|2,0,0]=4 4745 B25R4.2786505 Cc1ccccc1C(NC2C3CCC2CC3)c4ccccc4 34a_100000222801_100009813300 [0,1,0,1,0,0|2,0,0]=4 4746 B25R4.2786505 Cc1ccccc1C(OC2C3CCC2CC3)c4ccccc4 34a_100000212071_100009813300 [0,1,0,1,0,0|2,0,0]=4 4747 B25R4.2786505 Clc1ccccc1C(OC2C3CCC2CC3)c4ccccc4 34a_200011400577_100009813300 [0,1,0,1,0,0|2,0,0]=4 4748 B25R4.2786505 Nc1ccccc1C(OC2C3CCC2CC3)c4ccccc4 34a_100000246470_100009813300 [0,1,0,1,0,0|2,0,0]=4 4749 B25R4.3999423 Brc1ccccc1C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100000198044 [0,1,0,1,0,0|2,0,0]=4 4750 B25R4.3999423 Cc1ccccc1C(c2ccccc2)N3CC4CCC3CC4 2230a_100000750499_100000230135 [0,1,0,1,0,0|2,0,0]=4 4751 B25R4.3999423 Cc1ccccc1C(c2ccccc2)N3CC4CCC3CC4 269982a_100000750499_100000230135 [0,1,0,1,0,0|2,0,0]=4 4752 B25R4.3999423 Cc1ccccc1C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100000735561 [0,1,0,1,0,0|2,0,0]=4 4753 B25R4.3999423 Clc1ccccc1C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100011215288 [0,1,0,1,0,0|2,0,0]=4 4754 B25R4.3999423 Fc1ccccc1C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100011217773 [0,1,0,1,0,0|2,0,0]=4 4755 B25R4.8316760 c1ccc2c(c1)Oc3ccccc3C2NCC4CCCCC4 2230a_200000704616_100000211423 [0,1,0,1,0,0|2,0,0]=4 4756 B25R4.8316760 c1ccc2c(c1)Oc3ccccc3C2NCC4CCCCC4 269862a_200000704616_100000211278 [0,1,0,1,0,0|2,0,0]=4 4757 B25R4.8316760 c1ccc2c(c1)Oc3ccccc3C2OCC4CCCCC4 7a_100000210167_100000211423 [0,1,0,1,0,0|2,0,0]=4 4758 B25R4.2358200 CC1CCCCC1NCC2c3ccccc3-c4c2cccc4 269862a_100016995487_100000210921 [0,1,0,1,0,0|2,0,0]=4 4759 B25R4.2358200 CC1CCCCC1NCC2c3ccccc3-c4c2cccc4 270004a_100016995487_100000210921 [0,1,0,1,0,0|2,0,0]=4 4760 B25R4.2358200 FC1CCCCC1NCC2c3ccccc3-c4c2cccc4 34a_100016995487_100015423560 [0,1,0,1,0,0|2,0,0]=4 4761 B25R4.2358200 FC1CCCCC1OCC2c3ccccc3-c4c2cccc4 34a_100011215202_100015423560 [0,1,0,1,0,0|2,0,0]=4 4762 B25R4.2358200 OC1CCCCC1NCC2c3ccccc3-c4c2cccc4 34a_100016995487_100000038908 [0,1,0,1,0,0|2,0,0]=4 4763 B25R4.2358200 OC1CCCCC1OCC2c3ccccc3-c4c2cccc4 34a_100011215202_100000038908 [0,1,0,1,0,0|2,0,0]=4 4764 B25R4.8321568 C(=C(c1ccccc1)c2ccccc2)CN3CC4CCC3C4 270004a_100000743476_100000050448 [0,1,0,1,0,0|0,0,2]=4 4765 B25R4.8321568 C1=CC2CC1CN2CCC(c3ccccc3)c4ccccc4 2230a_100000732668_100009813428 [0,1,0,1,0,0|0,0,2]=4 4766 B25R4.8321568 C1=CC2CC1CN2CCC(c3ccccc3)c4ccccc4 269982a_100000732668_100009813428 [0,1,0,1,0,0|0,0,2]=4 4767 B25R4.8321568 C1=CC2CC1CN2CCC(c3ccccc3)c4ccccc4 34a_100000732668_100009813428 [0,1,0,1,0,0|0,0,2]=4 4768 B25R4.8321568 c1ccc(cc1)C(CCN2CC3CCC2C3)c4ccccc4 2230a_100000743476_100009813428 [0,1,0,1,0,0|0,0,0]=2 4769 B25R4.8321568 c1ccc(cc1)C(CCN2CC3CCC2C3)c4ccccc4 269982a_100000743476_100009813428 [0,1,0,1,0,0|0,0,0]=2 4770 B25R4.8321568 c1ccc(cc1)C(CCN2CC3CCC2C3)c4ccccc4 34a_100000743476_100009813428 [0,1,0,1,0,0|0,0,0]=2 4771 B25R4.8321568 c1ccc(cc1)C(CCN2C[C@H]3C[C@@H]2CO3)c4ccccc4 2230a_100016995552_100009813428 [0,1,0,1,0,0|1,0,0]=3 4772 B25R4.8321568 c1ccc(cc1)C(CCN2C[C@H]3C[C@@H]2CO3)c4ccccc4 269982a_100016995552_100009813428 [0,1,0,1,0,0|1,0,0]=3 4773 B25R4.8321568 c1ccc(cc1)C(CCN2C[C@H]3C[C@@H]2CO3)c4ccccc4 34a_100016995552_100009813428 [0,1,0,1,0,0|1,0,0]=3 4774 B25R4.8321568 c1ccc(cc1)C(CNC2CC3CCC2C3)c4ccccc4 269862a_100000739227_100000223372 [0,1,0,1,0,0|2,0,0]=4 4775 B25R4.8321568 c1ccc(cc1)C(CNC2CC3CCC2C3)c4ccccc4 270004a_100000739227_100000223372 [0,1,0,1,0,0|2,0,0]=4 4776 B25R4.8321568 c1ccc(cc1)C(CNC2CC3CCC2C3)c4ccccc4 34a_100000739227_100000727232 [0,1,0,1,0,0|2,0,0]=4 4777 B25R4.8321568 c1ccc(cc1)C(COC2CC3CCC2C3)c4ccccc4 34a_100011215272_100000727232 [0,1,0,1,0,0|2,0,0]=4 4778 B25R4.8321568 c1ccc(cc1)C(NCC2CC3CCC2C3)c4ccccc4 269862a_100000162943_100000697602 [0,1,0,1,0,0|2,0,0]=4 4779 B25R4.8321568 c1ccc(cc1)C(NCC2CC3CCC2C3)c4ccccc4 270004a_100000162943_100000697602 [0,1,0,1,0,0|2,0,0]=4 4780 B25R4.8321568 c1ccc(cc1)[S+](CCN2CC3CCC2C3)c4ccccc4 2230a_100000743476_100010140906 [0,1,0,1,0,0|1,0,0]=3 4781 B25R4.8321568 c1ccc(cc1)[S+](CCN2CC3CCC2C3)c4ccccc4 269982a_100000743476_100010140906 [0,1,0,1,0,0|1,0,0]=3 4782 B25R4.8321568 c1ccc(cc1)[S+](CCN2C[C@H]3C[C@@H]2CO3)c4ccccc4 2230a_100016995552_100010140906 [0,1,0,1,0,0|2,0,0]=4 4783 B25R4.8321568 c1ccc(cc1)[S+](CCN2C[C@H]3C[C@@H]2CO3)c4ccccc4 269982a_100016995552_100010140906 [0,1,0,1,0,0|2,0,0]=4 4784 B25R4.8323921 c1ccc(cc1)C(c2ccccc2)N3C[C@H]4CCCC[C@H]4C3 2230a_100015204113_100000211591 [0,1,0,1,0,0|2,0,0]=4 4785 B25R4.8323921 c1ccc(cc1)C(c2ccccc2)N3C[C@H]4CCCC[C@H]4C3 269982a_100015204113_100000211591 [0,1,0,1,0,0|2,0,0]=4 4786 B25R4.8323921 c1ccc(cc1)C(c2ccccc2)N3C[C@H]4CCCC[C@H]4C3 270004a_100015204113_100000210122 [0,1,0,1,0,0|2,0,0]=4 4787 B25R4.1553565 CN(C(c1ccccc1)c2ccccc2)C3C4CCC3CC4 269982a_100103148541_100009813300 [0,1,0,1,0,0|2,0,0]=4 4788 B25R4.1553594 O=C(C(c1ccccc1)c2ccccc2)[C@H]3[C@H]4[C@@H]3CCCC4 1458a_100153394716_100011216954 [0,1,0,1,0,0|1,0,1]=4 4789 B25R4.4911602 CN(CC1CCCCC1)C2c3ccccc3-c4c2cccc4 2230a_100000736448_100000211598 [0,1,0,1,0,0|2,0,0]=4 4790 B25R4.4911602 CN(CC1CCCCC1)C2c3ccccc3-c4c2cccc4 269982a_100000736448_100000211598 [0,1,0,1,0,0|2,0,0]=4 4791 B25R4.4911602 C[C@@H](OC1CCCCC1)C2c3ccccc3-c4c2cccc4 34a_200102646376_100000210327 [0,1,0,1,0,0|2,0,0]=4 4792 B25R4.4911602 C[C@@H](OC1CCCCC1)C2c3ccccc3-c4c2cccc4 7a_200102646376_100000210327 [0,1,0,1,0,0|2,0,0]=4 4793 B25R4.4911602 O=C(CC1CCCCC1)C2c3ccccc3-c4c2cccc4 1458a_100000182576_100000211423 [0,1,0,1,0,0|1,0,1]=4 4794 B25R4.54461433 O=C(CN1CC2CC2C1)N(c3ccccc3)c4ccccc4 2230a_100000741873_200015198546 [0,1,0,1,0,0|1,0,1]=4 4795 B25R4.54461433 O=C(CN1CC2CC2C1)N(c3ccccc3)c4ccccc4 269982a_100000741873_200015198546 [0,1,0,1,0,0|1,0,1]=4 4796 B25R4.2257094 Brc1ccc(cc1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000745999_100009813300 [0,1,0,1,0,0|2,0,0]=4 4797 B25R4.2257094 Brc1ccc(cc1)C(OC2C3CCC2CC3)c4ccccc4 34a_100011217567_100009813300 [0,1,0,1,0,0|2,0,0]=4 4798 B25R4.2257094 Cc1ccc(cc1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000736602_100009813300 [0,1,0,1,0,0|2,0,0]=4 4799 B25R4.2257094 Cc1ccc(cc1)C(OC2C3CCC2CC3)c4ccccc4 34a_100000212064_100009813300 [0,1,0,1,0,0|2,0,0]=4 4800 B25R4.2257094 Clc1ccc(cc1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000737946_100009813300 [0,1,0,1,0,0|2,0,0]=4 4801 B25R4.2257094 Clc1ccc(cc1)C(OC2C3CCC2CC3)c4ccccc4 34a_100000211768_100009813300 [0,1,0,1,0,0|2,0,0]=4 4802 B25R4.2257094 Fc1ccc(cc1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000737529_100009813300 [0,1,0,1,0,0|2,0,0]=4 4803 B25R4.2257094 Fc1ccc(cc1)C(OC2C3CCC2CC3)c4ccccc4 34a_200000246460_100009813300 [0,1,0,1,0,0|2,0,0]=4 4804 B25R4.2257094 Nc1ccc(cc1)C(OC2C3CCC2CC3)c4ccccc4 34a_100011236343_100009813300 [0,1,0,1,0,0|2,0,0]=4 4805 B25R4.2257094 Oc1ccc(cc1)C(NC2C3CCC2CC3)c4ccccc4 34a_100000198503_100009813300 [0,1,0,1,0,0|2,0,0]=4 4806 B25R4.5855172 Brc1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100000718703 [0,1,0,1,0,0|2,0,0]=4 4807 B25R4.5855172 Cc1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100000210966 [0,1,0,1,0,0|2,0,0]=4 4808 B25R4.5855172 Clc1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 2230a_100000750499_100000211669 [0,1,0,1,0,0|2,0,0]=4 4809 B25R4.5855172 Clc1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 269982a_100000750499_100000211669 [0,1,0,1,0,0|2,0,0]=4 4810 B25R4.5855172 Clc1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100000211064 [0,1,0,1,0,0|2,0,0]=4 4811 B25R4.5855172 Fc1ccc(cc1)C(c2ccccc2)N3CC4CCC3CC4 270004a_100000750499_100000210425 [0,1,0,1,0,0|2,0,0]=4 4812 B25R4.5851424 CC1CCC(CC1)CNC2c3ccccc3-c4c2cccc4 2230a_103436935547_100000211598 [0,1,0,1,0,0|2,0,0]=4 4813 B25R4.5851424 CC1CCC(CC1)NCC2c3ccccc3-c4c2cccc4 270004a_100016995487_100000185489 [0,1,0,1,0,0|2,0,0]=4 4814 B25R4.5851424 CC1CCC(CC1)NCC2c3ccccc3-c4c2cccc4 34a_100016995487_200011216234 [0,1,0,1,0,0|2,0,0]=4 4815 B25R4.5851424 CC1CCC(CC1)OCC2c3ccccc3-c4c2cccc4 34a_100011215202_200011216234 [0,1,0,1,0,0|2,0,0]=4 4816 B25R4.5851424 OC1CCC(CC1)NCC2c3ccccc3-c4c2cccc4 270004a_100016995487_100000764474 [0,1,0,1,0,0|2,0,0]=4 4817 B25R4.2290569 CC1CCCC(C1)NCC2c3ccccc3-c4c2cccc4 270004a_100016995487_100000183594 [0,1,0,1,0,0|2,0,0]=4 4818 B25R4.2290569 OC1CCCC(C1)CNC2c3ccccc3-c4c2cccc4 2230a_100011254705_100000211598 [0,1,0,1,0,0|2,0,0]=4 4819 B25R4.2290569 OC1CCCC(C1)NCC2c3ccccc3-c4c2cccc4 270004a_100016995487_100012613340 [0,1,0,1,0,0|2,0,0]=4 4820 B25R4.54495375 CC(CNC1CC2CC2C1)(c3ccccc3)c4ccccc4 270004a_100000706881_100010340937 [0,1,0,1,0,0|2,0,0]=4 4821 B25R4.89585375 CC(CNC1CCC2C1C2)(c3ccccc3)c4ccccc4 269862a_100000706881_100000692480 [0,1,0,1,0,0|2,0,0]=4 4822 B25R4.89585375 CC(CNC1CCC2C1C2)(c3ccccc3)c4ccccc4 270004a_100000706881_100000692480 [0,1,0,1,0,0|2,0,0]=4 4823 B25R4.203346805 CC1(c2ccccc2-c3c1cccc3)OCC4CCCCC4 34a_100000075291_100000211423 [0,1,0,1,0,0|2,0,0]=4 4824 B25R4.203346805 CC1(c2ccccc2-c3c1cccc3)OCC4CCCCC4 7a_100000075291_100000211423 [0,1,0,1,0,0|2,0,0]=4 4825 B25R4.236874653 CC1(CCCCC1)CNC2c3ccccc3-c4c2cccc4 2230a_100000706052_100000211598 [0,1,0,1,0,0|2,0,0]=4 4826 B25R4.236874653 CC1(CCCCC1)CNC2c3ccccc3-c4c2cccc4 269862a_100000104097_100011935227 [0,1,0,1,0,0|2,0,0]=4 4827 B25R4.236874653 CC1(CCCCC1)COC2c3ccccc3-c4c2cccc4 7a_100000688186_100000211598 [0,1,0,1,0,0|2,0,0]=4 4828 B25R4.236874653 FC1(CCCCC1)COC2c3ccccc3-c4c2cccc4 7a_100000090305_100000211598 [0,1,0,1,0,0|2,0,0]=4 4829 B25R4.236874653 OC1(CCCCC1)CNC2c3ccccc3-c4c2cccc4 2230a_100000748649_100000211598 [0,1,0,1,0,0|2,0,0]=4 4830 B25R5.1148872 c1ccc2c(c1)-c3ccccc3C2CNC4CCC5C4C5 269862a_100016995487_100000692480 [0,0,0,2,0,0|2,0,0]=4 4831 B25R5.1148872 c1ccc2c(c1)-c3ccccc3C2CNC4CCC5C4C5 270004a_100016995487_100000692480 [0,0,0,2,0,0|2,0,0]=4 4832 B25R5.1148873 c1ccc2c(c1)-c3ccccc3C2CNC4CC5CC5C4 270004a_100016995487_100010340937 [0,0,0,2,0,0|2,0,0]=4 4833 B25R5.1148981 c1ccc2c(c1)-c3ccccc3C2N4CC5CCC4CC5 2230a_100000750499_100000211598 [0,0,0,2,0,0|2,0,0]=4 4834 B25R5.1148981 c1ccc2c(c1)-c3ccccc3C2N4CC5CCC4CC5 269982a_100000750499_100000211598 [0,0,0,2,0,0|2,0,0]=4 4835 B25R5.1148993 c1ccc2c(c1)-c3ccccc3C2SC4C5CCC4CC5 62a_100000211598_100009813300 [0,0,0,2,0,0|2,0,0]=4 4836 B21R2.13336 CCCCCNCCC(c1ccccc1)c2ccco2 2230a_200000066865_100000210326 [0,0,1,0,1,0|1,0,0]=3 4837 B21R2.13336 CCCCCNCCC(c1ccccc1)c2ccco2 34a_200000066865_100000718602 [0,0,1,0,1,0|1,0,0]=3 4838 B21R2.13336 CCOCCNCCC(c1ccccc1)c2ccco2 2230a_200000066865_100011215890 [0,0,1,0,1,0|2,0,0]=4 4839 B21R2.13336 CCOCCNCCC(c1ccccc1)c2ccco2 34a_200000066865_100000210147 [0,0,1,0,1,0|2,0,0]=4 4840 B21R2.13336 CCSCCNCCC(c1ccccc1)c2ccco2 2230a_200000066865_100000757381 [0,0,1,0,1,0|2,0,0]=4 4841 B21R2.13336 CCSCCNCCC(c1ccccc1)c2ccco2 34a_200000066865_100000757381 [0,0,1,0,1,0|2,0,0]=4 4842 B21R2.13336 COCCCNCCC(c1ccccc1)c2ccco2 2230a_200000066865_100000740836 [0,0,1,0,1,0|2,0,0]=4 4843 B21R2.13336 COCCCNCCC(c1ccccc1)c2ccco2 34a_200000066865_100000740836 [0,0,1,0,1,0|2,0,0]=4 4844 B21R2.13336 FCCCCNCCC(c1ccccc1)c2ccco2 2230a_200000066865_100000729493 [0,0,1,0,1,0|2,0,0]=4 4845 B21R2.13336 FCCCCNCCC(c1ccccc1)c2ccco2 34a_200000066865_100000729493 [0,0,1,0,1,0|2,0,0]=4 4846 B21R2.13336 OCCCCNCCC(c1ccccc1)c2ccco2 2230a_200000066865_100000210776 [0,0,1,0,1,0|2,0,0]=4 4847 B21R2.13336 OCCCCNCCC(c1ccccc1)c2ccco2 34a_200000066865_100011216708 [0,0,1,0,1,0|2,0,0]=4 4848 B21R2.25778 CCCCC(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_100000210211 [0,0,1,0,1,0|2,0,0]=4 4849 B21R2.25778 CCCCC(C)NC(c1ccccc1)c2ccccc2 2230a_100000126638_100000211591 [0,0,1,0,1,0|2,0,0]=4 4850 B21R2.25778 CCCCC(C)NC(c1ccccc1)c2ccccc2 2230a_100000162943_200011215066 [0,0,1,0,1,0|2,0,0]=4 4851 B21R2.25778 CCCCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000126638_100000210122 [0,0,1,0,1,0|2,0,0]=4 4852 B21R2.25778 CCCCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000162943_100000210087 [0,0,1,0,1,0|2,0,0]=4 4853 B21R2.25778 CCCCC(C)NC(c1ccccc1)c2ccccc2 34a_100000162943_200011215066 [0,0,1,0,1,0|2,0,0]=4 4854 B21R2.25778 CCCCC(C)OC(c1ccccc1)c2ccccc2 34a_100000211180_200011215066 [0,0,1,0,1,0|2,0,0]=4 4855 B21R2.25778 CCCCC(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_200011215066 [0,0,1,0,1,0|2,0,0]=4 4856 B21R2.25778 CCCCC(C)OC(c1ccccc1)c2ccccc2 7a_100000687866_100011216954 [0,0,1,0,1,0|2,0,0]=4 4857 B21R2.25778 CCCNC(C)CC(c1ccccc1)c2ccccc2 270004a_100020643023_200000011111 [0,0,1,0,1,0|2,0,0]=4 4858 B21R2.5883 CCCC(CC)NC(c1ccccc1)c2ccccc2 2230a_100000747048_100000211591 [0,0,1,0,1,0|2,0,0]=4 4859 B21R2.5883 CCCC(CC)NC(c1ccccc1)c2ccccc2 270004a_100000162943_100000687865 [0,0,1,0,1,0|2,0,0]=4 4860 B21R2.5883 CCCC(CC)NC(c1ccccc1)c2ccccc2 270004a_100000747048_100000210122 [0,0,1,0,1,0|2,0,0]=4 4861 B21R2.5883 CCCC(CC)OC(c1ccccc1)c2ccccc2 7a_100000211180_100011219200 [0,0,1,0,1,0|2,0,0]=4 4862 B21R2.5883 CCCC(CC)OC(c1ccccc1)c2ccccc2 7a_100000687864_100011216954 [0,0,1,0,1,0|2,0,0]=4 4863 B21R3.3138 C1=CCN(CC1)C(c2ccccc2)c3ccccc3 2230a_100000698166_100000211591 [0,0,0,0,2,0|0,0,2]=4 4864 B21R3.3138 C1=CCN(CC1)C(c2ccccc2)c3ccccc3 269982a_100000698166_100000211591 [0,0,0,0,2,0|0,0,2]=4 4865 B21R3.3138 C1=CCN(CC1)C(c2ccccc2)c3ccccc3 270004a_100000698166_100000210122 [0,0,0,0,2,0|0,0,2]=4 4866 B21R3.3138 c1ccc(cc1)C(c2ccccc2)N3CCCOC3 2230a_100000131196_100000211591 [0,0,0,0,2,0|1,0,0]=3 4867 B21R3.3138 c1ccc(cc1)C(c2ccccc2)N3CCCOC3 269982a_100000131196_100000211591 [0,0,0,0,2,0|1,0,0]=3 4868 B21R3.3138 c1ccc(cc1)C(c2ccccc2)N3CCCOC3 270004a_100000131196_100000210122 [0,0,0,0,2,0|1,0,0]=3 4869 B21R3.3138 c1ccc(cc1)C(c2ccccc2)N3CCOCC3 2230a_100015191051_100000211591 [0,0,0,0,2,0|1,0,0]=3 4870 B21R3.3138 c1ccc(cc1)C(c2ccccc2)N3CCOCC3 269982a_100015191051_100000211591 [0,0,0,0,2,0|1,0,0]=3 4871 B21R3.3138 c1ccc(cc1)C(c2ccccc2)N3CCOCC3 270004a_100015191051_100000210122 [0,0,0,0,2,0|1,0,0]=3 4872 B21R3.3138 c1ccc(cc1)C(c2ccccc2)N3CCSCC3 2230a_100000737611_100000211591 [0,0,0,0,2,0|1,0,0]=3 4873 B21R3.3138 c1ccc(cc1)C(c2ccccc2)N3CCSCC3 269982a_100000737611_100000211591 [0,0,0,0,2,0|1,0,0]=3 4874 B21R3.3138 c1ccc(cc1)C(c2ccccc2)N3CCSCC3 270004a_100000737611_100000210122 [0,0,0,0,2,0|1,0,0]=3 4875 B21R3.3138 c1ccc(cc1)C(c2ccccn2)N3CCCOC3 270004a_100000131196_100000210380 [0,0,0,0,2,0|2,0,0]=4 4876 B21R3.3138 c1ccc(cc1)C(c2ccccn2)N3CCOCC3 270004a_100015191051_100000210380 [0,0,0,0,2,0|2,0,0]=4 4877 B21R3.3138 c1ccc(cc1)C(c2ccccn2)N3CCSCC3 270004a_100000737611_100000210380 [0,0,0,0,2,0|2,0,0]=4 4878 B21R3.3138 c1ccc(cc1)C(c2cccnc2)N3CCCOC3 270004a_100000131196_100000735413 [0,0,0,0,2,0|2,0,0]=4 4879 B21R3.3138 c1ccc(cc1)C(c2cccnc2)N3CCOCC3 270004a_100015191051_100000735413 [0,0,0,0,2,0|2,0,0]=4 4880 B21R3.3138 c1ccc(cc1)C(c2cccnc2)N3CCSCC3 270004a_100000737611_100000735413 [0,0,0,0,2,0|2,0,0]=4 4881 B21R3.47836 c1ccc(cc1)C(NC2CCCC2)c3ccccc3 2230a_100000162943_100000179811 [0,0,0,0,2,0|2,0,0]=4 4882 B21R3.47836 c1ccc(cc1)C(NC2CCCC2)c3ccccc3 2230a_100000211070_100000211591 [0,0,0,0,2,0|2,0,0]=4 4883 B21R3.47836 c1ccc(cc1)C(NC2CCCC2)c3ccccc3 270004a_100000162943_100000210133 [0,0,0,0,2,0|2,0,0]=4 4884 B21R3.47836 c1ccc(cc1)C(NC2CCCC2)c3ccccc3 270004a_100000211070_100000210122 [0,0,0,0,2,0|2,0,0]=4 4885 B21R3.47836 c1ccc(cc1)C(NC2CCCC2)c3ccccc3 34a_100000162943_100000179811 [0,0,0,0,2,0|2,0,0]=4 4886 B21R3.47836 c1ccc(cc1)C(OC2CCCC2)c3ccccc3 34a_100000211180_100000179811 [0,0,0,0,2,0|2,0,0]=4 4887 B21R3.47836 c1ccc(cc1)C(OC2CCCC2)c3ccccc3 7a_100000210269_100011216954 [0,0,0,0,2,0|2,0,0]=4 4888 B21R3.47836 c1ccc(cc1)C(OC2CCCC2)c3ccccc3 7a_100000211180_100000179811 [0,0,0,0,2,0|2,0,0]=4 4889 B21R3.47836 c1ccc(cc1)C(SC2CCCC2)c3ccccc3 62a_100000211591_100000179811 [0,0,0,0,2,0|2,0,0]=4 4890 B21R3.47836 c1ccc(cc1)C(SC2CCCC2)c3ccccc3 62a_100011217020_100011216954 [0,0,0,0,2,0|2,0,0]=4 4891 B21R3.47850 c1ccc(cc1)C(CCN2CCC2)c3ccccc3 269982a_100000754969_100009813428 [0,0,0,0,2,0|0,0,0]=2 4892 B21R3.47850 c1ccc(cc1)C(CNC2CCC2)c3ccccc3 270004a_100000739227_100000241760 [0,0,0,0,2,0|2,0,0]=4 4893 B21R3.47850 c1ccc(cc1)C(CNC2CCC2)c3ccccc3 34a_100000739227_100000749161 [0,0,0,0,2,0|2,0,0]=4 4894 B21R3.47850 c1ccc(cc1)C(COC2CCC2)c3ccccc3 34a_100011215272_100000749161 [0,0,0,0,2,0|2,0,0]=4 4895 B21R3.47850 c1ccc(cc1)C(NCC2CCC2)c3ccccc3 2230a_100000162943_100000763275 [0,0,0,0,2,0|2,0,0]=4 4896 B21R3.47850 c1ccc(cc1)C(NCC2CCC2)c3ccccc3 2230a_100000738700_100000211591 [0,0,0,0,2,0|2,0,0]=4 4897 B21R3.47850 c1ccc(cc1)C(NCC2CCC2)c3ccccc3 269862a_100000162943_100000753134 [0,0,0,0,2,0|2,0,0]=4 4898 B21R3.47850 c1ccc(cc1)C(NCC2CCC2)c3ccccc3 270004a_100000738700_100000210122 [0,0,0,0,2,0|2,0,0]=4 4899 B21R3.47850 c1ccc(cc1)C(NCC2CCC2)c3ccccc3 34a_100000162943_100000763275 [0,0,0,0,2,0|2,0,0]=4 4900 B21R3.47850 c1ccc(cc1)C(OCC2CCC2)c3ccccc3 34a_100000211180_100000763275 [0,0,0,0,2,0|2,0,0]=4 4901 B21R3.47850 c1ccc(cc1)C(OCC2CCC2)c3ccccc3 7a_100000211180_100000763275 [0,0,0,0,2,0|2,0,0]=4 4902 B21R3.47850 c1ccc(cc1)C(SCC2CCC2)c3ccccc3 62a_100000211591_100000763275 [0,0,0,0,2,0|2,0,0]=4 4903 B21R3.47850 c1ccc(cc1)C(SCC2CCC2)c3ccccc3 62a_100000763275_100011216954 [0,0,0,0,2,0|2,0,0]=4 4904 B21R3.47850 c1ccc(cc1)[S+](CCN2CCC2)c3ccccc3 269982a_100000754969_100010140906 [0,0,0,0,2,0|1,0,0]=3 4905 B23R2.3575 CCCCCCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000210681 [0,0,1,0,0,1|2,0,0]=4 4906 B23R2.3575 CCCCCCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000210614 [0,0,1,0,0,1|2,0,0]=4 4907 B23R2.3575 CCCCCCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000210614 [0,0,1,0,0,1|2,0,0]=4 4908 B23R2.6160 C#CCN(CC)CCOC(c1ccccc1)c2ccccc2 2230a_100000744766_100000734929 [0,0,1,0,0,1|0,0,2]=4 4909 B23R2.6160 C#CCN(CC)CCOC(c1ccccc1)c2ccccc2 269982a_100000744766_100000734929 [0,0,1,0,0,1|0,0,2]=4 4910 B23R2.6160 CCC(COC)NCCC(c1ccccc1)c2ccccc2 2230a_100000757820_100009813428 [0,0,1,0,0,1|2,0,0]=4 4911 B23R2.6160 CCC(COC)NCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000757811 [0,0,1,0,0,1|2,0,0]=4 4912 B23R2.6160 CCC(COC)OCCC(c1ccccc1)c2ccccc2 7a_200011214946_100009813428 [0,0,1,0,0,1|2,0,0]=4 4913 B23R2.6160 CCCC(CC)NCCC(c1ccccc1)c2ccccc2 2230a_100000747048_100009813428 [0,0,1,0,0,1|1,0,0]=3 4914 B23R2.6160 CCCC(CC)NCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000687865 [0,0,1,0,0,1|1,0,0]=3 4915 B23R2.6160 CCCC(CC)NCCP(c1ccccc1)c2ccccc2 270004a_107094377242_100000687865 [0,0,1,0,0,1|2,0,0]=4 4916 B23R2.6160 CCCC(CC)NCC[S+](c1ccccc1)c2ccccc2 2230a_100000747048_100010140906 [0,0,1,0,0,1|2,0,0]=4 4917 B23R2.6160 CCCC(CC)OCCC(c1ccccc1)c2ccccc2 34a_100000687864_100009813428 [0,0,1,0,0,1|1,0,0]=3 4918 B23R2.6160 CCCC(CC)OCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011219200 [0,0,1,0,0,1|1,0,0]=3 4919 B23R2.6160 CCCC(CC)OCCC(c1ccccc1)c2ccccc2 7a_100000687864_100009813428 [0,0,1,0,0,1|1,0,0]=3 4920 B23R2.6160 CCCC(CC)OCCN(c1ccccc1)c2ccccc2 7a_100010001939_100011219200 [0,0,1,0,0,1|2,0,0]=4 4921 B23R2.6160 CCCC(CC)OCC[S+](c1ccccc1)c2ccccc2 7a_100000687864_100010140906 [0,0,1,0,0,1|2,0,0]=4 4922 B23R2.6160 CCCC(CCOC(c1ccccc1)c2ccccc2)SC 7a_100000032865_100011216954 [0,0,1,0,0,1|2,0,0]=4 4923 B23R2.6160 CCCN(CC)CCOC(c1ccccc1)c2ccccc2 2230a_100000226822_100000734929 [0,0,1,0,0,1|0,0,0]=2 4924 B23R2.6160 CCCN(CC)CCOC(c1ccccc1)c2ccccc2 269982a_100000226822_100000734929 [0,0,1,0,0,1|0,0,0]=2 4925 B23R2.6160 CCC[C@@H](CO)NCCC(c1ccccc1)c2ccccc2 2230a_100000732646_100009813428 [0,0,1,0,0,1|2,0,0]=4 4926 B23R2.6160 CCC[C@@H](CO)NCCC(c1ccccc1)c2ccccc2 34a_100000732646_100009813428 [0,0,1,0,0,1|2,0,0]=4 4927 B23R2.6160 CCN(CCO)CCOC(c1ccccc1)c2ccccc2 2230a_100000210973_100000734929 [0,0,1,0,0,1|1,0,0]=3 4928 B23R2.6160 CCN(CCO)CCOC(c1ccccc1)c2ccccc2 269982a_100000210973_100000734929 [0,0,1,0,0,1|1,0,0]=3 4929 B23R3.4587 c1ccc(cc1)CC(NC2CCCCC2)c3ccccc3 270004a_100025772854_100000210434 [0,0,0,0,1,1|2,0,0]=4 4930 B23R3.4587 c1ccc(cc1)CC(OC2CCCCC2)c3ccccc3 34a_100000246494_100000210327 [0,0,0,0,1,1|2,0,0]=4 4931 B23R3.4587 c1ccc(cc1)CC(OC2CCCCC2)c3ccccc3 7a_100000246494_100000210327 [0,0,0,0,1,1|2,0,0]=4 4932 B23R3.4587 c1ccc(cc1)CN(CC2CCCCC2)c3ccccc3 2230a_100000188819_100000211423 [0,0,0,0,1,1|2,0,0]=4 4933 B23R3.4587 c1ccc(cc1)CN(CC2CCCCC2)c3ccccc3 269982a_100000188819_100000211423 [0,0,0,0,1,1|2,0,0]=4 4934 B23R3.4587 c1ccc(cc1)CN(CC2CCCCC2)c3ccccc3 34a_100000188819_100000211423 [0,0,0,0,1,1|2,0,0]=4 4935 B23R3.4595 c1ccc(cc1)C(CCNC2CCCCC2)c3ccco3 270004a_200000066865_100000210434 [0,0,0,0,1,1|2,0,0]=4 4936 B23R3.4595 c1ccc(cc1)C(CCNC2CCCCC2)c3ccco3 34a_200000066865_100000210327 [0,0,0,0,1,1|2,0,0]=4 4937 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3ccco3 2230a_100015185865_100012355289 [0,0,0,0,1,1|2,0,0]=4 4938 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3ccco3 270004a_100015185865_100011713444 [0,0,0,0,1,1|2,0,0]=4 4939 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3ccco3 34a_100015185865_100011209188 [0,0,0,0,1,1|2,0,0]=4 4940 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3cccs3 2230a_100025760362_100012355289 [0,0,0,0,1,1|2,0,0]=4 4941 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3cccs3 270004a_100000738074_100011214959 [0,0,0,0,1,1|2,0,0]=4 4942 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3cccs3 270004a_100025760362_100011713444 [0,0,0,0,1,1|2,0,0]=4 4943 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3cccs3 34a_100025760362_100011209188 [0,0,0,0,1,1|2,0,0]=4 4944 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3ccoc3 2230a_100102946537_100012355289 [0,0,0,0,1,1|2,0,0]=4 4945 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3ccoc3 270004a_100102946537_100011713444 [0,0,0,0,1,1|2,0,0]=4 4946 B23R3.4595 c1ccc(cc1)C(NCCC2CCCCC2)c3ccoc3 34a_100102946537_100011209188 [0,0,0,0,1,1|2,0,0]=4 4947 B23R3.4595 c1ccc(cc1)C(NCCN2CCCCC2)c3ccco3 2230a_100015185865_100000739454 [0,0,0,0,1,1|1,0,0]=3 4948 B23R3.4595 c1ccc(cc1)C(NCCN2CCCCC2)c3ccco3 34a_100015185865_100000739454 [0,0,0,0,1,1|1,0,0]=3 4949 B23R3.4595 c1ccc(cc1)C(NCCN2CCCCC2)c3cccs3 2230a_100025760362_100000739454 [0,0,0,0,1,1|1,0,0]=3 4950 B23R3.4595 c1ccc(cc1)C(NCCN2CCCCC2)c3cccs3 270004a_100000216509_100011214959 [0,0,0,0,1,1|1,0,0]=3 4951 B23R3.4595 c1ccc(cc1)C(NCCN2CCCCC2)c3cccs3 34a_100025760362_100000739454 [0,0,0,0,1,1|1,0,0]=3 4952 B23R3.4595 c1ccc(cc1)C(NCCN2CCCCC2)c3ccoc3 2230a_100102946537_100000739454 [0,0,0,0,1,1|1,0,0]=3 4953 B23R3.4595 c1ccc(cc1)C(NCCN2CCCCC2)c3ccoc3 34a_100102946537_100000739454 [0,0,0,0,1,1|1,0,0]=3 4954 B23R3.4595 c1ccc(cc1)C(NCCN2CCOCC2)c3ccco3 2230a_100015185865_100025781966 [0,0,0,0,1,1|2,0,0]=4 4955 B23R3.4595 c1ccc(cc1)C(NCCN2CCOCC2)c3cccs3 2230a_100025760362_100025781966 [0,0,0,0,1,1|2,0,0]=4 4956 B23R3.4595 c1ccc(cc1)C(NCCN2CCOCC2)c3cccs3 270004a_100000211067_100011214959 [0,0,0,0,1,1|2,0,0]=4 4957 B23R3.4595 c1ccc(cc1)C(NCCN2CCOCC2)c3ccoc3 2230a_100102946537_100025781966 [0,0,0,0,1,1|2,0,0]=4 4958 B23R3.4595 c1ccc(cc1)C(NCCN2CCSCC2)c3cccs3 270004a_100000755026_100011214959 [0,0,0,0,1,1|2,0,0]=4 4959 B23R3.4595 c1ccc(cc1)C(OCCN2CCCCC2)c3ncc[nH]3 7a_100000181881_100000739454 [0,0,0,0,1,1|2,0,0]=4 4960 B23R3.1974208 c1ccc(cc1)CC(NCC2CCCC2)c3ccccc3 2230a_100025772854_100000740388 [0,0,0,0,1,1|2,0,0]=4 4961 B23R3.1974208 c1ccc(cc1)CC(NCC2CCCC2)c3ccccc3 269862a_100025772854_100000746403 [0,0,0,0,1,1|2,0,0]=4 4962 B23R3.1974208 c1ccc(cc1)CC(OCC2CCCC2)c3ccccc3 34a_100000246494_100000740388 [0,0,0,0,1,1|2,0,0]=4 4963 B23R3.1974208 c1ccc(cc1)CC(OCC2CCCC2)c3ccccc3 7a_100000246494_100000740388 [0,0,0,0,1,1|2,0,0]=4 4964 B23R3.1974208 c1ccc(cc1)CN(CCC2CCCC2)c3ccccc3 2230a_100000188819_100000760354 [0,0,0,0,1,1|2,0,0]=4 4965 B23R3.1974208 c1ccc(cc1)CN(CCC2CCCC2)c3ccccc3 269982a_100000188819_100000760354 [0,0,0,0,1,1|2,0,0]=4 4966 B23R3.1974208 c1ccc(cc1)CN(CCC2CCCC2)c3ccccc3 34a_100000188819_100000760354 [0,0,0,0,1,1|2,0,0]=4 4967 B23R3.1974208 c1ccc(cc1)CN(CCN2CCCC2)c3ccccc3 269982a_100000188819_100000004467 [0,0,0,0,1,1|1,0,0]=3 4968 B25R3.6850 c1ccc(cc1)CC(Cc2ccccc2)NCC3CCCCC3 2230a_100000261440_100000211423 [0,0,0,0,0,2|2,0,0]=4 4969 B25R3.6850 c1ccc(cc1)CC(Cc2ccccc2)NCC3CCCCC3 269862a_100000261440_100000211278 [0,0,0,0,0,2|2,0,0]=4 4970 B25R3.6850 c1ccc(cc1)CC(Cc2ccccc2)OCC3CCCCC3 34a_100000285930_100000211423 [0,0,0,0,0,2|2,0,0]=4 4971 B25R3.6850 c1ccc(cc1)CC(Cc2ccccc2)OCC3CCCCC3 7a_100000285930_100000211423 [0,0,0,0,0,2|2,0,0]=4 4972 B25R3.6850 c1ccc(cc1)CN(CCC2CCCCC2)Cc3ccccc3 2230a_100000185734_100012355289 [0,0,0,0,0,2|2,0,0]=4 4973 B25R3.6850 c1ccc(cc1)CN(CCC2CCCCC2)Cc3ccccc3 269982a_100000185734_100011273959 [0,0,0,0,0,2|2,0,0]=4 4974 B25R3.6850 c1ccc(cc1)CN(CCC2CCCCC2)Cc3ccccc3 270004a_100000185734_100011713444 [0,0,0,0,0,2|2,0,0]=4 4975 B25R3.6850 c1ccc(cc1)CN(CCN2CCCCC2)Cc3ccccc3 2230a_100000185734_100000739454 [0,0,0,0,0,2|1,0,0]=3 4976 B25R3.6850 c1ccc(cc1)CN(CCN2CCCCC2)Cc3ccccc3 269982a_100000185734_100000739454 [0,0,0,0,0,2|1,0,0]=3 4977 B25R3.6850 c1ccc(cc1)CN(CCN2CCCCC2)Cc3ccncc3 269982a_100000186794_100000739454 [0,0,0,0,0,2|2,0,0]=4 4978 B25R3.6850 c1ccc(cc1)CN(CCN2CCCOC2)Cc3ccccc3 2230a_100000131196_200000104094 [0,0,0,0,0,2|2,0,0]=4 4979 B25R3.6850 c1ccc(cc1)CN(CCN2CCCOC2)Cc3ccccc3 269982a_100000131196_200000104094 [0,0,0,0,0,2|2,0,0]=4 4980 B25R3.6850 c1ccc(cc1)CN(CCN2CCOCC2)Cc3ccccc3 2230a_100000185734_100025781966 [0,0,0,0,0,2|2,0,0]=4 4981 B25R3.6850 c1ccc(cc1)CN(CCN2CCOCC2)Cc3ccccc3 2230a_100000196322_100015291786 [0,0,0,0,0,2|2,0,0]=4 4982 B25R3.6850 c1ccc(cc1)CN(CCN2CCOCC2)Cc3ccccc3 2230a_100015191051_200000104094 [0,0,0,0,0,2|2,0,0]=4 4983 B25R3.6850 c1ccc(cc1)CN(CCN2CCOCC2)Cc3ccccc3 269982a_100000185734_100000753993 [0,0,0,0,0,2|2,0,0]=4 4984 B25R3.6850 c1ccc(cc1)CN(CCN2CCOCC2)Cc3ccccc3 269982a_100000196322_100000211182 [0,0,0,0,0,2|2,0,0]=4 4985 B25R3.6850 c1ccc(cc1)CN(CCN2CCOCC2)Cc3ccccc3 269982a_100015191051_200000104094 [0,0,0,0,0,2|2,0,0]=4 4986 B25R3.6850 c1ccc(cc1)CN(CCN2CCOCC2)Cc3ccccc3 270004a_100000196322_100015611070 [0,0,0,0,0,2|2,0,0]=4 4987 B25R3.6850 c1ccc(cc1)CN(CCN2CCSCC2)Cc3ccccc3 2230a_100000737611_200000104094 [0,0,0,0,0,2|2,0,0]=4 4988 B25R3.6850 c1ccc(cc1)CN(CCN2CCSCC2)Cc3ccccc3 269982a_100000737611_200000104094 [0,0,0,0,0,2|2,0,0]=4 4989 B25R3.6855 c1ccc(cc1)CC(NCCC2CCCCC2)c3ccccc3 2230a_100025772854_100012355289 [0,0,0,0,0,2|1,0,0]=3 4990 B25R3.6855 c1ccc(cc1)CC(NCCC2CCCCC2)c3ccccc3 270004a_100025772854_100011713444 [0,0,0,0,0,2|1,0,0]=3 4991 B25R3.6855 c1ccc(cc1)CC(NCCC2CCOCC2)c3ccccc3 2230a_100025772854_100011934994 [0,0,0,0,0,2|2,0,0]=4 4992 B25R3.6855 c1ccc(cc1)CC(NCCN2CCCCC2)c3ccccc3 2230a_100025772854_100000739454 [0,0,0,0,0,2|0,0,0]=2 4993 B25R3.6855 c1ccc(cc1)CC(NCCN2CCOCC2)c3ccccc3 2230a_100025772854_100025781966 [0,0,0,0,0,2|1,0,0]=3 4994 B25R3.6855 c1ccc(cc1)CC(NCOC2CCCCC2)c3ccccc3 2230a_100025772854_100011935260 [0,0,0,0,0,2|2,0,0]=4 4995 B25R3.6855 c1ccc(cc1)CC(OCCC2CCCCC2)c3ccccc3 34a_100000246494_100011209188 [0,0,0,0,0,2|1,0,0]=3 4996 B25R3.6855 c1ccc(cc1)CC(OCCC2CCCCC2)c3ccccc3 7a_100000246494_100011273959 [0,0,0,0,0,2|1,0,0]=3 4997 B25R3.6855 c1ccc(cc1)CC(OCCC2CCOCC2)c3ccccc3 34a_100000246494_100011934994 [0,0,0,0,0,2|2,0,0]=4 4998 B25R3.6855 c1ccc(cc1)CC(OCCC2CCOCC2)c3ccccc3 7a_100000246494_100011934994 [0,0,0,0,0,2|2,0,0]=4 4999 B25R3.6855 c1ccc(cc1)CC(OCCN2CCCCC2)c3ccccc3 34a_100000246494_100000739454 [0,0,0,0,0,2|0,0,0]=2 5000 B25R3.6855 c1ccc(cc1)CC(OCCN2CCCCC2)c3ccccc3 7a_100000246494_100000739454 [0,0,0,0,0,2|0,0,0]=2 5001 B25R3.6855 c1ccc(cc1)CC(OCCN2CCOCC2)c3ccccc3 7a_100000246494_100000211760 [0,0,0,0,0,2|1,0,0]=3 5002 B25R3.6855 c1ccc(cc1)CC(OCOC2CCCCC2)c3ccccc3 34a_100000246494_100011935260 [0,0,0,0,0,2|2,0,0]=4 5003 B25R3.6855 c1ccc(cc1)CC(OCOC2CCCCC2)c3ccccc3 7a_100000246494_100011935260 [0,0,0,0,0,2|2,0,0]=4 5004 B25R3.6855 c1ccc(cc1)CN(CCCN2CCCCC2)c3ccccc3 2230a_100000188819_100000690320 [0,0,0,0,0,2|1,0,0]=3 5005 B25R3.6855 c1ccc(cc1)CN(CCCN2CCCCC2)c3ccccc3 269982a_100000188819_100000690320 [0,0,0,0,0,2|1,0,0]=3 5006 B25R3.6855 c1ccc(cc1)CN(CCCN2CCCCC2)c3ccccc3 34a_100000188819_100000690320 [0,0,0,0,0,2|1,0,0]=3 5007 B25R3.6855 c1ccc(cc1)CN(CCCN2CCOCC2)c3ccccc3 2230a_100000188819_100000748698 [0,0,0,0,0,2|2,0,0]=4 5008 B25R3.6855 c1ccc(cc1)CN(CCCN2CCOCC2)c3ccccc3 269982a_100000188819_100000748698 [0,0,0,0,0,2|2,0,0]=4 5009 B25R3.6855 c1ccc(cc1)CN(CCCN2CCOCC2)c3ccccc3 34a_100000188819_100000748698 [0,0,0,0,0,2|2,0,0]=4 5010 B25R3.6855 c1ccc(cc1)CN(CCOC2CCCCC2)c3ccccc3 2230a_100000188819_100011211530 [0,0,0,0,0,2|2,0,0]=4 5011 B25R3.6855 c1ccc(cc1)CN(CCOC2CCCCC2)c3ccccc3 269982a_100000188819_100011211530 [0,0,0,0,0,2|2,0,0]=4 5012 B25R3.6855 c1ccc(cc1)CN(CCOC2CCCCC2)c3ccccc3 34a_100000188819_100011211530 [0,0,0,0,0,2|2,0,0]=4 5013 B25R3.1946061 c1ccc(cc1)CC(NCC2CCCCCC2)c3ccccc3 2230a_100025772854_200000696569 [0,0,0,0,0,2|2,0,0]=4 5014 B25R3.1946061 c1ccc(cc1)CC(NCC2CCCCCC2)c3ccccc3 269862a_100025772854_200000763224 [0,0,0,0,0,2|2,0,0]=4 5015 B25R3.1946061 c1ccc(cc1)CC(OCC2CCCCCC2)c3ccccc3 34a_100000246494_200000696569 [0,0,0,0,0,2|2,0,0]=4 5016 B25R3.1946061 c1ccc(cc1)CC(OCC2CCCCCC2)c3ccccc3 7a_100000246494_200000696569 [0,0,0,0,0,2|2,0,0]=4 5017 B25R3.1946061 c1ccc(cc1)CN(CCN2CCCCCC2)c3ccccc3 269982a_100000188819_100000722644 [0,0,0,0,0,2|1,0,0]=3 5018 B25R3.2065771 C(#CC(OCC1CCCCC1)c2ccccc2)c3ccccc3 34a_200000068236_100000211423 [0,0,0,0,0,2|2,0,0]=4 5019 B25R3.2065771 C(#CC(OCC1CCCCC1)c2ccccc2)c3ccccc3 7a_200000068236_100000211423 [0,0,0,0,0,2|2,0,0]=4 5020 B25R3.2065771 c1ccc(cc1)CCC(NCC2CCCCC2)c3ccccc3 2230a_100000741669_100000211423 [0,0,0,0,0,2|2,0,0]=4 5021 B25R3.2065771 c1ccc(cc1)CCC(NCC2CCCCC2)c3ccccc3 269862a_100000210473_100000685657 [0,0,0,0,0,2|2,0,0]=4 5022 B25R3.2065771 c1ccc(cc1)CCC(NCC2CCCCC2)c3ccccc3 269862a_100000741669_100000211278 [0,0,0,0,0,2|2,0,0]=4 5023 B25R3.2065771 c1ccc(cc1)CCC(NCC2CCCCC2)c3ccccc3 34a_100000741669_100000211423 [0,0,0,0,0,2|2,0,0]=4 5024 B25R3.2065771 c1ccc(cc1)CCC(OCC2CCCCC2)c3ccccc3 34a_200000373236_100000211423 [0,0,0,0,0,2|2,0,0]=4 5025 B25R3.2065771 c1ccc(cc1)CCC(OCC2CCCCC2)c3ccccc3 7a_200000373236_100000211423 [0,0,0,0,0,2|2,0,0]=4 5026 B25R3.2065771 c1ccc(cc1)CNC(COC2CCCCC2)c3ccccc3 34a_100011217457_100000210327 [0,0,0,0,0,2|2,0,0]=4 5027 B25R3.2065771 c1ccc(cc1)OCC(NCC2CCCCC2)c3ccccc3 269862a_100000210473_100000150584 [0,0,0,0,0,2|2,0,0]=4 5028 B25R3.2065771 c1ccc(cc1)OCC(NCC2CCCCC2)c3ccccc3 270004a_100000210473_100000150584 [0,0,0,0,0,2|2,0,0]=4 5029 B25R3.2065771 c1ccc(cc1)OCC(OCC2CCCCC2)c3ccccc3 34a_100000259978_100000211423 [0,0,0,0,0,2|2,0,0]=4 5030 B25R3.2065771 c1ccc(cc1)OCC(OCC2CCCCC2)c3ccccc3 7a_100000259978_100000211423 [0,0,0,0,0,2|2,0,0]=4 5031 B25R3.6854 C(=C(c1ccccc1)c2ccccc2)CNCC3CCCCC3 270004a_100000210473_100000050448 [0,0,0,0,0,2|1,0,1]=4 5032 B25R3.6854 C(=NNCC1CCCCC1)C(c2ccccc2)c3ccccc3 4a_100000740227_100000183636 [0,0,0,0,0,2|1,0,1]=4 5033 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 2230a_100000210473_100009813428 [0,0,0,0,0,2|1,0,0]=3 5034 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 2230a_100000272388_100000211423 [0,0,0,0,0,2|1,0,0]=3 5035 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 269862a_100000272388_100000211278 [0,0,0,0,0,2|1,0,0]=3 5036 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 34a_100000210473_100009813428 [0,0,0,0,0,2|1,0,0]=3 5037 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 34a_100000272388_100000211423 [0,0,0,0,0,2|1,0,0]=3 5038 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCO2)c3ccccc3 2230a_100000174945_100009813428 [0,0,0,0,0,2|2,0,0]=4 5039 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCO2)c3ccccc3 2230a_100000272388_100000211543 [0,0,0,0,0,2|2,0,0]=4 5040 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCO2)c3ccccc3 34a_100000174945_100009813428 [0,0,0,0,0,2|2,0,0]=4 5041 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCO2)c3ccccc3 34a_100000272388_100000211543 [0,0,0,0,0,2|2,0,0]=4 5042 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCOC2)c3ccccc3 2230a_100000272388_100000741521 [0,0,0,0,0,2|2,0,0]=4 5043 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCOC2)c3ccccc3 2230a_100000720124_100009813428 [0,0,0,0,0,2|2,0,0]=4 5044 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCOC2)c3ccccc3 34a_100000272388_100000741521 [0,0,0,0,0,2|2,0,0]=4 5045 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCOC2)c3ccccc3 34a_100000720124_100009813428 [0,0,0,0,0,2|2,0,0]=4 5046 B25R3.6854 c1ccc(cc1)C(CCNCC2CCOCC2)c3ccccc3 2230a_100000272388_100000754603 [0,0,0,0,0,2|2,0,0]=4 5047 B25R3.6854 c1ccc(cc1)C(CCNCC2CCOCC2)c3ccccc3 2230a_100000746373_100009813428 [0,0,0,0,0,2|2,0,0]=4 5048 B25R3.6854 c1ccc(cc1)C(CCNCC2CCOCC2)c3ccccc3 269862a_100000272388_100000749017 [0,0,0,0,0,2|2,0,0]=4 5049 B25R3.6854 c1ccc(cc1)C(CCNCC2CCOCC2)c3ccccc3 34a_100000272388_100000754603 [0,0,0,0,0,2|2,0,0]=4 5050 B25R3.6854 c1ccc(cc1)C(CCNCC2CCOCC2)c3ccccc3 34a_100000746373_100009813428 [0,0,0,0,0,2|2,0,0]=4 5051 B25R3.6854 c1ccc(cc1)C(CCNCC2CCSCC2)c3ccccc3 2230a_100015188806_100009813428 [0,0,0,0,0,2|2,0,0]=4 5052 B25R3.6854 c1ccc(cc1)C(CCNCC2CCSCC2)c3ccccc3 269862a_100000272388_100000067145 [0,0,0,0,0,2|2,0,0]=4 5053 B25R3.6854 c1ccc(cc1)C(CCNCC2CCSCC2)c3ccccc3 270004a_100000272388_100000067145 [0,0,0,0,0,2|2,0,0]=4 5054 B25R3.6854 c1ccc(cc1)C(CCNCC2CCSCC2)c3ccccc3 34a_100015188806_100009813428 [0,0,0,0,0,2|2,0,0]=4 5055 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCC2)c3ccccc3 34a_100000032380_100000211423 [0,0,0,0,0,2|1,0,0]=3 5056 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCC2)c3ccccc3 34a_100000212181_100009813428 [0,0,0,0,0,2|1,0,0]=3 5057 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCC2)c3ccccc3 7a_100000032380_100000211423 [0,0,0,0,0,2|1,0,0]=3 5058 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCC2)c3ccccc3 7a_100000212181_100009813428 [0,0,0,0,0,2|1,0,0]=3 5059 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCN2)c3ccccc3 34a_100000210821_100009813428 [0,0,0,0,0,2|2,0,0]=4 5060 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCO2)c3ccccc3 34a_100000032380_100000211543 [0,0,0,0,0,2|2,0,0]=4 5061 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCO2)c3ccccc3 34a_100000211370_100009813428 [0,0,0,0,0,2|2,0,0]=4 5062 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCO2)c3ccccc3 7a_100000032380_100000211543 [0,0,0,0,0,2|2,0,0]=4 5063 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCCO2)c3ccccc3 7a_100000211370_100009813428 [0,0,0,0,0,2|2,0,0]=4 5064 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCNC2)c3ccccc3 34a_100000211344_100009813428 [0,0,0,0,0,2|2,0,0]=4 5065 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCOC2)c3ccccc3 34a_100000032380_100000741521 [0,0,0,0,0,2|2,0,0]=4 5066 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCOC2)c3ccccc3 34a_100000741520_100009813428 [0,0,0,0,0,2|2,0,0]=4 5067 B25R3.6854 c1ccc(cc1)C(CCOCC2CCCOC2)c3ccccc3 7a_100000032380_100000741521 [0,0,0,0,0,2|2,0,0]=4 5068 B25R3.6854 c1ccc(cc1)C(CCOCC2CCNCC2)c3ccccc3 34a_100000738675_100009813428 [0,0,0,0,0,2|2,0,0]=4 5069 B25R3.6854 c1ccc(cc1)C(CCOCC2CCOCC2)c3ccccc3 34a_100000032380_100000754603 [0,0,0,0,0,2|2,0,0]=4 5070 B25R3.6854 c1ccc(cc1)C(CCOCC2CCOCC2)c3ccccc3 34a_100000749013_100009813428 [0,0,0,0,0,2|2,0,0]=4 5071 B25R3.6854 c1ccc(cc1)C(CCOCC2CCOCC2)c3ccccc3 7a_100000032380_100000754603 [0,0,0,0,0,2|2,0,0]=4 5072 B25R3.6854 c1ccc(cc1)C(CCOCC2CCSCC2)c3ccccc3 34a_100000070558_100009813428 [0,0,0,0,0,2|2,0,0]=4 5073 B25R3.6854 c1ccc(cc1)C(CCOCC2CCSCC2)c3ccccc3 7a_100000070558_100009813428 [0,0,0,0,0,2|2,0,0]=4 5074 B25R3.6854 c1ccc(cc1)C(CCSCC2CCCCO2)c3ccccc3 62a_100000211543_100009813428 [0,0,0,0,0,2|2,0,0]=4 5075 B25R3.6854 c1ccc(cc1)C(CCSCC2CCCCO2)c3ccccc3 62a_100009813428_100000211543 [0,0,0,0,0,2|2,0,0]=4 5076 B25R3.6854 c1ccc(cc1)C(CCSCC2CCCOC2)c3ccccc3 62a_100000741521_100009813428 [0,0,0,0,0,2|2,0,0]=4 5077 B25R3.6854 c1ccc(cc1)C(CCSCC2CCCOC2)c3ccccc3 62a_100009813428_100000741521 [0,0,0,0,0,2|2,0,0]=4 5078 B25R3.6854 c1ccc(cc1)C(CCSCC2CCOCC2)c3ccccc3 62a_100000754603_100009813428 [0,0,0,0,0,2|2,0,0]=4 5079 B25R3.6854 c1ccc(cc1)C(CCSCC2CCOCC2)c3ccccc3 62a_100009813428_100000749018 [0,0,0,0,0,2|2,0,0]=4 5080 B25R3.6854 c1ccc(cc1)C(CNCCC2CCCCC2)c3ccccc3 2230a_100000739227_100012355289 [0,0,0,0,0,2|1,0,0]=3 5081 B25R3.6854 c1ccc(cc1)C(CNCCC2CCCCC2)c3ccccc3 270004a_100000739227_100011713444 [0,0,0,0,0,2|1,0,0]=3 5082 B25R3.6854 c1ccc(cc1)C(CNCCC2CCCCC2)c3ccccc3 34a_100000739227_100011209188 [0,0,0,0,0,2|1,0,0]=3 5083 B25R3.6854 c1ccc(cc1)C(CNCCC2CCOCC2)c3ccccc3 2230a_100000739227_100011934994 [0,0,0,0,0,2|2,0,0]=4 5084 B25R3.6854 c1ccc(cc1)C(CNCCC2CCOCC2)c3ccccc3 34a_100000739227_100011934994 [0,0,0,0,0,2|2,0,0]=4 5085 B25R3.6854 c1ccc(cc1)C(CNCCN2CCCCC2)c3ccccc3 2230a_100000739227_100000739454 [0,0,0,0,0,2|0,0,0]=2 5086 B25R3.6854 c1ccc(cc1)C(CNCCN2CCCCC2)c3ccccc3 34a_100000739227_100000739454 [0,0,0,0,0,2|0,0,0]=2 5087 B25R3.6854 c1ccc(cc1)C(CNCCN2CCOCC2)c3ccccc3 2230a_100000739227_100025781966 [0,0,0,0,0,2|1,0,0]=3 5088 B25R3.6854 c1ccc(cc1)C(CNCOC2CCCCC2)c3ccccc3 2230a_100000739227_100011935260 [0,0,0,0,0,2|1,0,0]=3 5089 B25R3.6854 c1ccc(cc1)C(CNCOC2CCCCC2)c3ccccc3 34a_100000739227_100011935260 [0,0,0,0,0,2|1,0,0]=3 5090 B25R3.6854 c1ccc(cc1)C(COCCC2CCCCC2)c3ccccc3 34a_100011215272_100011209188 [0,0,0,0,0,2|1,0,0]=3 5091 B25R3.6854 c1ccc(cc1)C(COCCC2CCCCC2)c3ccccc3 7a_100011215272_100011273959 [0,0,0,0,0,2|1,0,0]=3 5092 B25R3.6854 c1ccc(cc1)C(COCCC2CCOCC2)c3ccccc3 34a_100011215272_100011934994 [0,0,0,0,0,2|2,0,0]=4 5093 B25R3.6854 c1ccc(cc1)C(COCCC2CCOCC2)c3ccccc3 7a_100011215272_100011934994 [0,0,0,0,0,2|2,0,0]=4 5094 B25R3.6854 c1ccc(cc1)C(COCCN2CCCCC2)c3ccccc3 34a_100011215272_100000739454 [0,0,0,0,0,2|0,0,0]=2 5095 B25R3.6854 c1ccc(cc1)C(COCCN2CCCCC2)c3ccccc3 7a_100011215272_100000739454 [0,0,0,0,0,2|0,0,0]=2 5096 B25R3.6854 c1ccc(cc1)C(COCCN2CCOCC2)c3ccccc3 7a_100011215272_100000211760 [0,0,0,0,0,2|1,0,0]=3 5097 B25R3.6854 c1ccc(cc1)C(COCOC2CCCCC2)c3ccccc3 34a_100011215272_100011935260 [0,0,0,0,0,2|1,0,0]=3 5098 B25R3.6854 c1ccc(cc1)C(COCOC2CCCCC2)c3ccccc3 7a_100011215272_100011935260 [0,0,0,0,0,2|1,0,0]=3 5099 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccc3 2230a_100000162943_100011713725 [0,0,0,0,0,2|1,0,0]=3 5100 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccc3 2230a_100011211642_100000211591 [0,0,0,0,0,2|1,0,0]=3 5101 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccc3 270004a_100011211642_100000210122 [0,0,0,0,0,2|1,0,0]=3 5102 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccc3 34a_100000162943_100011713725 [0,0,0,0,0,2|1,0,0]=3 5103 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccn3 2230a_100000689936_100011713725 [0,0,0,0,0,2|2,0,0]=4 5104 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccccn3 270004a_100011211642_100000210380 [0,0,0,0,0,2|2,0,0]=4 5105 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3cccnc3 2230a_100011232609_100011713725 [0,0,0,0,0,2|2,0,0]=4 5106 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3cccnc3 270004a_100011211642_100000735413 [0,0,0,0,0,2|2,0,0]=4 5107 B25R3.6854 c1ccc(cc1)C(NCCCC2CCCCC2)c3ccncc3 2230a_100025760769_100011713725 [0,0,0,0,0,2|2,0,0]=4 5108 B25R3.6854 c1ccc(cc1)C(NCCCN2CCCCC2)c3ccccc3 2230a_100000162943_100000690320 [0,0,0,0,0,2|0,0,0]=2 5109 B25R3.6854 c1ccc(cc1)C(NCCCN2CCCCC2)c3ccccc3 270004a_100000204581_100000210122 [0,0,0,0,0,2|0,0,0]=2 5110 B25R3.6854 c1ccc(cc1)C(NCCCN2CCCCC2)c3ccccc3 34a_100000162943_100000690320 [0,0,0,0,0,2|0,0,0]=2 5111 B25R3.6854 c1ccc(cc1)C(NCCCN2CCCCC2)c3ccccn3 2230a_100000689936_100000690320 [0,0,0,0,0,2|1,0,0]=3 5112 B25R3.6854 c1ccc(cc1)C(NCCCN2CCCCC2)c3ccccn3 270004a_100000204581_100000210380 [0,0,0,0,0,2|1,0,0]=3 5113 B25R3.6854 c1ccc(cc1)C(NCCCN2CCCCC2)c3cccnc3 2230a_100011232609_100000690320 [0,0,0,0,0,2|1,0,0]=3 5114 B25R3.6854 c1ccc(cc1)C(NCCCN2CCCCC2)c3cccnc3 270004a_100000204581_100000735413 [0,0,0,0,0,2|1,0,0]=3 5115 B25R3.6854 c1ccc(cc1)C(NCCCN2CCCCC2)c3ccncc3 2230a_100025760769_100000690320 [0,0,0,0,0,2|1,0,0]=3 5116 B25R3.6854 c1ccc(cc1)C(NCCCN2CCOCC2)c3ccccc3 2230a_100000162943_100000748698 [0,0,0,0,0,2|1,0,0]=3 5117 B25R3.6854 c1ccc(cc1)C(NCCCN2CCOCC2)c3ccccc3 270004a_100000210481_100000210122 [0,0,0,0,0,2|1,0,0]=3 5118 B25R3.6854 c1ccc(cc1)C(NCCCN2CCOCC2)c3ccccc3 34a_100000162943_100000748698 [0,0,0,0,0,2|1,0,0]=3 5119 B25R3.6854 c1ccc(cc1)C(NCCCN2CCOCC2)c3ccccn3 2230a_100000689936_100000748698 [0,0,0,0,0,2|2,0,0]=4 5120 B25R3.6854 c1ccc(cc1)C(NCCCN2CCOCC2)c3ccccn3 270004a_100000210481_100000210380 [0,0,0,0,0,2|2,0,0]=4 5121 B25R3.6854 c1ccc(cc1)C(NCCCN2CCOCC2)c3cccnc3 2230a_100011232609_100000748698 [0,0,0,0,0,2|2,0,0]=4 5122 B25R3.6854 c1ccc(cc1)C(NCCCN2CCOCC2)c3cccnc3 270004a_100000210481_100000735413 [0,0,0,0,0,2|2,0,0]=4 5123 B25R3.6854 c1ccc(cc1)C(NCCCN2CCOCC2)c3ccncc3 2230a_100025760769_100000748698 [0,0,0,0,0,2|2,0,0]=4 5124 B25R3.6854 c1ccc(cc1)C(NCCOC2CCCCC2)c3ccccc3 2230a_100000162943_100011211530 [0,0,0,0,0,2|1,0,0]=3 5125 B25R3.6854 c1ccc(cc1)C(NCCOC2CCCCC2)c3ccccc3 270004a_100015206981_100000210122 [0,0,0,0,0,2|1,0,0]=3 5126 B25R3.6854 c1ccc(cc1)C(NCCOC2CCCCC2)c3ccccc3 34a_100000162943_100011211530 [0,0,0,0,0,2|1,0,0]=3 5127 B25R3.6854 c1ccc(cc1)C(NCCOC2CCCCC2)c3ccccn3 2230a_100000689936_100011211530 [0,0,0,0,0,2|2,0,0]=4 5128 B25R3.6854 c1ccc(cc1)C(NCCOC2CCCCC2)c3ccccn3 270004a_100015206981_100000210380 [0,0,0,0,0,2|2,0,0]=4 5129 B25R3.6854 c1ccc(cc1)C(NCCOC2CCCCC2)c3cccnc3 2230a_100011232609_100011211530 [0,0,0,0,0,2|2,0,0]=4 5130 B25R3.6854 c1ccc(cc1)C(NCCOC2CCCCC2)c3cccnc3 270004a_100015206981_100000735413 [0,0,0,0,0,2|2,0,0]=4 5131 B25R3.6854 c1ccc(cc1)C(NCCOC2CCCCC2)c3ccncc3 2230a_100025760769_100011211530 [0,0,0,0,0,2|2,0,0]=4 5132 B25R3.6854 c1ccc(cc1)C(NCCOC2CCCCO2)c3ccccc3 2230a_100000162943_100000744793 [0,0,0,0,0,2|2,0,0]=4 5133 B25R3.6854 c1ccc(cc1)C(NCCOC2CCCCO2)c3ccccc3 34a_100000162943_100000744793 [0,0,0,0,0,2|2,0,0]=4 5134 B25R3.6854 c1ccc(cc1)C(OCCCC2CCCCC2)c3ccccn3 7a_100000180852_100011713725 [0,0,0,0,0,2|2,0,0]=4 5135 B25R3.6854 c1ccc(cc1)C(OCCCN2CCCCC2)c3ccccc3 34a_100000211180_100000690320 [0,0,0,0,0,2|0,0,0]=2 5136 B25R3.6854 c1ccc(cc1)C(OCCCN2CCCCC2)c3ccccc3 7a_100000211180_100000007876 [0,0,0,0,0,2|0,0,0]=2 5137 B25R3.6854 c1ccc(cc1)C(OCCCN2CCCCC2)c3ccccn3 7a_100000180852_100000007876 [0,0,0,0,0,2|1,0,0]=3 5138 B25R3.6854 c1ccc(cc1)C(OCCCN2CCOCC2)c3ccccc3 34a_100000211180_100000748698 [0,0,0,0,0,2|1,0,0]=3 5139 B25R3.6854 c1ccc(cc1)C(OCCCN2CCOCC2)c3ccccc3 7a_100000211180_100000748698 [0,0,0,0,0,2|1,0,0]=3 5140 B25R3.6854 c1ccc(cc1)C(OCCCN2CCOCC2)c3ccccn3 7a_100000180852_100000748698 [0,0,0,0,0,2|2,0,0]=4 5141 B25R3.6854 c1ccc(cc1)C(OCCNC2CCCCC2)c3ccccc3 2230a_100000182618_100000734929 [0,0,0,0,0,2|1,0,0]=3 5142 B25R3.6854 c1ccc(cc1)C(OCCNC2CCCCC2)c3ccccc3 34a_100000182618_100000734929 [0,0,0,0,0,2|1,0,0]=3 5143 B25R3.6854 c1ccc(cc1)C(OCCNC2CCCOC2)c3ccccc3 2230a_100000719290_100000734929 [0,0,0,0,0,2|2,0,0]=4 5144 B25R3.6854 c1ccc(cc1)C(OCCNC2CCCOC2)c3ccccc3 34a_100000719290_100000734929 [0,0,0,0,0,2|2,0,0]=4 5145 B25R3.6854 c1ccc(cc1)C(OCCNC2CCOCC2)c3ccccc3 2230a_100000741149_100000734929 [0,0,0,0,0,2|2,0,0]=4 5146 B25R3.6854 c1ccc(cc1)C(OCCNC2CCOCC2)c3ccccc3 34a_100000741149_100000734929 [0,0,0,0,0,2|2,0,0]=4 5147 B25R3.6854 c1ccc(cc1)C(OCCNC2CCSCC2)c3ccccc3 2230a_100000748639_100000734929 [0,0,0,0,0,2|2,0,0]=4 5148 B25R3.6854 c1ccc(cc1)C(OCCNC2CCSCC2)c3ccccc3 34a_100000748639_100000734929 [0,0,0,0,0,2|2,0,0]=4 5149 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccc3 34a_100000210231_100000734929 [0,0,0,0,0,2|1,0,0]=3 5150 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccc3 34a_100000211180_100011211530 [0,0,0,0,0,2|1,0,0]=3 5151 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccc3 7a_100000210231_100000734929 [0,0,0,0,0,2|1,0,0]=3 5152 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccc3 7a_100000211180_100011211530 [0,0,0,0,0,2|1,0,0]=3 5153 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccc3 7a_100011249652_100011216954 [0,0,0,0,0,2|1,0,0]=3 5154 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCC2)c3ccccn3 7a_100000180852_100011211530 [0,0,0,0,0,2|2,0,0]=4 5155 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCO2)c3ccccc3 34a_100000033831_100000734929 [0,0,0,0,0,2|2,0,0]=4 5156 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCO2)c3ccccc3 34a_100000211180_100000744793 [0,0,0,0,0,2|2,0,0]=4 5157 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCO2)c3ccccc3 7a_100000034223_100011216954 [0,0,0,0,0,2|2,0,0]=4 5158 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCCO2)c3ccccc3 7a_100000211180_100000744793 [0,0,0,0,0,2|2,0,0]=4 5159 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCOC2)c3ccccc3 34a_100000754041_100000734929 [0,0,0,0,0,2|2,0,0]=4 5160 B25R3.6854 c1ccc(cc1)C(OCCOC2CCCSC2)c3ccccc3 7a_100015962668_100000734929 [0,0,0,0,0,2|2,0,0]=4 5161 B25R3.6854 c1ccc(cc1)C(OCCOC2CCOCC2)c3ccccc3 34a_100000744328_100000734929 [0,0,0,0,0,2|2,0,0]=4 5162 B25R3.6854 c1ccc(cc1)C(OCCOC2CCSCC2)c3ccccc3 34a_100000731022_100000734929 [0,0,0,0,0,2|2,0,0]=4 5163 B25R3.6854 c1ccc(cc1)C(OCCOC2CCSCC2)c3ccccc3 7a_100000731022_100000734929 [0,0,0,0,0,2|2,0,0]=4 5164 B25R3.6854 c1ccc(cc1)C(OCCSC2CCCCC2)c3ccccc3 62a_100000210327_100000734929 [0,0,0,0,0,2|1,0,0]=3 5165 B25R3.6854 c1ccc(cc1)C(OCCSC2CCCCC2)c3ccccc3 62a_100000734929_100000210327 [0,0,0,0,0,2|1,0,0]=3 5166 B25R3.6854 c1ccc(cc1)C(OCCSC2CCCOC2)c3ccccc3 62a_100000734929_100000693364 [0,0,0,0,0,2|2,0,0]=4 5167 B25R3.6854 c1ccc(cc1)C(OCCSC2CCOCC2)c3ccccc3 62a_100000734929_100011324220 [0,0,0,0,0,2|2,0,0]=4 5168 B25R3.6854 c1ccc(cc1)C(OCCSC2CCSCC2)c3ccccc3 62a_100000734929_100000069128 [0,0,0,0,0,2|2,0,0]=4 5169 B25R3.6854 c1ccc(cc1)C(SCCCN2CCCCC2)c3ccccc3 62a_100000211591_100000007876 [0,0,0,0,0,2|0,0,0]=2 5170 B25R3.6854 c1ccc(cc1)C(SCCCN2CCCCC2)c3ccccc3 62a_100132302099_100011216954 [0,0,0,0,0,2|0,0,0]=2 5171 B25R3.6854 c1ccc(cc1)C(SCCCN2CCOCC2)c3ccccc3 62a_100000211591_100000748698 [0,0,0,0,0,2|1,0,0]=3 5172 B25R3.6854 c1ccc(cc1)C(SCCOC2CCCCC2)c3ccccc3 62a_100000211591_100011211530 [0,0,0,0,0,2|1,0,0]=3 5173 B25R3.6854 c1ccc(cc1)C(SCCOC2CCCCC2)c3ccccc3 62a_100011211530_100011216954 [0,0,0,0,0,2|1,0,0]=3 5174 B25R3.6854 c1ccc(cc1)C(SCCOC2CCCCO2)c3ccccc3 62a_100000211591_100000744793 [0,0,0,0,0,2|2,0,0]=4 5175 B25R3.6854 c1ccc(cc1)C(SCCOC2CCCCO2)c3ccccc3 62a_100000744793_100011216954 [0,0,0,0,0,2|2,0,0]=4 5176 B25R3.6854 c1ccc(cc1)N(CCOCC2CCCCC2)c3ccccc3 34a_100010001939_100000211423 [0,0,0,0,0,2|2,0,0]=4 5177 B25R3.6854 c1ccc(cc1)N(CCOCC2CCCCC2)c3ccccc3 7a_100010001939_100000211423 [0,0,0,0,0,2|2,0,0]=4 5178 B25R3.6854 c1ccc(cc1)P(CCCNC2CCCCC2)c3ccccc3 270004a_100016990410_100000210434 [0,0,0,0,0,2|2,0,0]=4 5179 B25R3.6854 c1ccc(cc1)P(CCCNC2CCCCC2)c3ccccc3 34a_100016990410_100000210327 [0,0,0,0,0,2|2,0,0]=4 5180 B25R3.6854 c1ccc(cc1)P(CCNCC2CCCCC2)c3ccccc3 2230a_107094377242_100000211423 [0,0,0,0,0,2|2,0,0]=4 5181 B25R3.6854 c1ccc(cc1)P(CCNCC2CCCCC2)c3ccccc3 269862a_107094377242_100000211278 [0,0,0,0,0,2|2,0,0]=4 5182 B25R3.6854 c1ccc(cc1)P(CCNCC2CCCCC2)c3ccccc3 34a_107094377242_100000211423 [0,0,0,0,0,2|2,0,0]=4 5183 B25R3.6854 c1ccc(cc1)[S+](CCNCC2CCCCC2)c3ccccc3 2230a_100000210473_100010140906 [0,0,0,0,0,2|2,0,0]=4 5184 B25R3.6854 c1ccc(cc1)[S+](CCOCC2CCCCC2)c3ccccc3 7a_100000212181_100010140906 [0,0,0,0,0,2|2,0,0]=4 5185 B25R3.6854 c1ccc(nc1)C(NCCCN2CCCCC2)c3cccnc3 270004a_100000204581_100011376182 [0,0,0,0,0,2|2,0,0]=4 5186 B25R3.6854 c1cncc(c1)C(NCCCN2CCCCC2)c3cccnc3 270004a_100000204581_200011376183 [0,0,0,0,0,2|2,0,0]=4 5187 B25R3.1946081 c1ccc(cc1)C(CCNC2CCCCCC2)c3ccccc3 2230a_100000210984_100009813428 [0,0,0,0,0,2|1,0,0]=3 5188 B25R3.1946081 c1ccc(cc1)C(CCNC2CCCCCC2)c3ccccc3 270004a_100000272388_100000210131 [0,0,0,0,0,2|1,0,0]=3 5189 B25R3.1946081 c1ccc(cc1)C(CCNC2CCCCCC2)c3ccccc3 34a_100000210984_100009813428 [0,0,0,0,0,2|1,0,0]=3 5190 B25R3.1946081 c1ccc(cc1)C(CCNC2CCCCCC2)c3ccccc3 34a_100000272388_100011217769 [0,0,0,0,0,2|1,0,0]=3 5191 B25R3.1946081 c1ccc(cc1)C(CCNC2CCCNCC2)c3ccccc3 270004a_100000272388_100015187895 [0,0,0,0,0,2|1,0,0]=3 5192 B25R3.1946081 c1ccc(cc1)C(CCNC2CSCCSC2)c3ccccc3 270004a_100000272388_100000068409 [0,0,0,0,0,2|2,0,0]=4 5193 B25R3.1946081 c1ccc(cc1)C(CCOC2CCCCCC2)c3ccccc3 34a_100000032380_100011217769 [0,0,0,0,0,2|1,0,0]=3 5194 B25R3.1946081 c1ccc(cc1)C(CCOC2CCCCCC2)c3ccccc3 34a_100000210887_100009813428 [0,0,0,0,0,2|1,0,0]=3 5195 B25R3.1946081 c1ccc(cc1)C(CCOC2CCCCCC2)c3ccccc3 7a_100000210887_100009813428 [0,0,0,0,0,2|1,0,0]=3 5196 B25R3.1946081 c1ccc(cc1)C(CNCC2CCCCCC2)c3ccccc3 2230a_100000739227_200000696569 [0,0,0,0,0,2|1,0,0]=3 5197 B25R3.1946081 c1ccc(cc1)C(CNCC2CCCCCC2)c3ccccc3 269862a_100000739227_200000763224 [0,0,0,0,0,2|1,0,0]=3 5198 B25R3.1946081 c1ccc(cc1)C(CNCC2CCCCCC2)c3ccccc3 34a_100000739227_200000696569 [0,0,0,0,0,2|1,0,0]=3 5199 B25R3.1946081 c1ccc(cc1)C(COCC2CCCCCC2)c3ccccc3 34a_100011215272_200000696569 [0,0,0,0,0,2|1,0,0]=3 5200 B25R3.1946081 c1ccc(cc1)C(COCC2CCCCCC2)c3ccccc3 7a_100011215272_200000696569 [0,0,0,0,0,2|1,0,0]=3 5201 B25R3.1946081 c1ccc(cc1)C(NCCC2CCCCCC2)c3ccccc3 2230a_100011532351_100000211591 [0,0,0,0,0,2|1,0,0]=3 5202 B25R3.1946081 c1ccc(cc1)C(NCCC2CCCCCC2)c3ccccc3 270004a_100011532351_100000210122 [0,0,0,0,0,2|1,0,0]=3 5203 B25R3.1946081 c1ccc(cc1)C(NCCC2CCCCCC2)c3ccccn3 270004a_100011532351_100000210380 [0,0,0,0,0,2|2,0,0]=4 5204 B25R3.1946081 c1ccc(cc1)C(NCCC2CCCCCC2)c3cccnc3 270004a_100011532351_100000735413 [0,0,0,0,0,2|2,0,0]=4 5205 B25R3.1946081 c1ccc(cc1)C(NCCN2CCCCCC2)c3ccccc3 270004a_100000738142_100000210122 [0,0,0,0,0,2|0,0,0]=2 5206 B25R3.1946081 c1ccc(cc1)C(NCCN2CCCCCC2)c3ccccn3 270004a_100000738142_100000210380 [0,0,0,0,0,2|1,0,0]=3 5207 B25R3.1946081 c1ccc(cc1)C(NCCN2CCCCCC2)c3cccnc3 270004a_100000738142_100000735413 [0,0,0,0,0,2|1,0,0]=3 5208 B25R3.1946081 c1ccc(cc1)C(OCCN2CCCCCC2)c3ccccc3 2230a_100000185865_100000734929 [0,0,0,0,0,2|0,0,0]=2 5209 B25R3.1946081 c1ccc(cc1)C(OCCN2CCCCCC2)c3ccccc3 269982a_100000185865_100000734929 [0,0,0,0,0,2|0,0,0]=2 5210 B25R3.1946081 c1ccc(cc1)C(OCCN2CCCCCC2)c3ccccc3 34a_100000185865_100000734929 [0,0,0,0,0,2|0,0,0]=2 5211 B25R3.1946081 c1ccc(cc1)C(OCCN2CCCCCC2)c3ccccc3 7a_100000211180_100000722644 [0,0,0,0,0,2|0,0,0]=2 5212 B25R3.1946081 c1ccc(cc1)C(OCCN2CCCCCC2)c3ccccn3 7a_100000180852_100000722644 [0,0,0,0,0,2|1,0,0]=3 5213 B25R3.1946081 c1ccc(cc1)C(OCCN2CCCOCC2)c3ccccc3 2230a_100000685342_100000734929 [0,0,0,0,0,2|0,0,0]=2 5214 B25R3.1946081 c1ccc(cc1)C(OCCN2CCCOCC2)c3ccccc3 269982a_100000685342_100000734929 [0,0,0,0,0,2|0,0,0]=2 5215 B25R3.1946081 c1ccc(cc1)C(OCCN2CCCOCC2)c3ccccc3 34a_100000685342_100000734929 [0,0,0,0,0,2|0,0,0]=2 5216 B25R3.1946081 c1ccc(cc1)C(SCCN2CCCCCC2)c3ccccc3 62a_100000211591_100000722644 [0,0,0,0,0,2|0,0,0]=2 5217 B25R3.1946081 c1ccc(cc1)C(SCCN2CCCCCC2)c3ccccc3 62a_100000722644_100011216954 [0,0,0,0,0,2|0,0,0]=2 5218 B25R3.1946081 c1ccc(cc1)N(CCOC2CCCCCC2)c3ccccc3 34a_100010001939_100011217769 [0,0,0,0,0,2|2,0,0]=4 5219 B25R3.1946081 c1ccc(cc1)P(CCNC2CCCCCC2)c3ccccc3 270004a_107094377242_100000210131 [0,0,0,0,0,2|2,0,0]=4 5220 B25R3.1946081 c1ccc(cc1)P(CCNC2CCCCCC2)c3ccccc3 34a_107094377242_100011217769 [0,0,0,0,0,2|2,0,0]=4 5221 B25R3.1946081 c1ccc(cc1)P(CCNC2CCCNCC2)c3ccccc3 270004a_107094377242_100015187895 [0,0,0,0,0,2|2,0,0]=4 5222 B25R3.1946081 c1ccc(cc1)[S+](CCNC2CCCCCC2)c3ccccc3 2230a_100000210984_100010140906 [0,0,0,0,0,2|2,0,0]=4 5223 B25R3.1946081 c1ccc(cc1)[S+](CCOC2CCCCCC2)c3ccccc3 7a_100000210887_100010140906 [0,0,0,0,0,2|2,0,0]=4 5224 B25R3.1946081 c1ccc(nc1)C(NCCN2CCCCCC2)c3cccnc3 270004a_100000738142_100011376182 [0,0,0,0,0,2|2,0,0]=4 5225 B25R3.1946081 c1cncc(c1)C(NCCN2CCCCCC2)c3cccnc3 270004a_100000738142_200011376183 [0,0,0,0,0,2|2,0,0]=4 5226 B25R3.4239545 C(=C(c1ccccc1)c2ccccc2)CN3CCCCCCC3 270004a_100000211400_100000050448 [0,0,0,0,0,2|0,0,2]=4 5227 B25R3.4239545 C\1=C\CCC(CCC1)CNC(c2ccccc2)c3ccccc3 2230a_100102730862_100000211591 [0,0,0,0,0,2|2,0,0]=4 5228 B25R3.4239545 C\1=C\CCC(CCC1)CNC(c2ccccc2)c3ccccc3 270004a_100102730862_100000210122 [0,0,0,0,0,2|2,0,0]=4 5229 B25R3.4239545 C\1=C\CCC(CCC1)NCC(c2ccccc2)c3ccccc3 34a_100000739227_100021000466 [0,0,0,0,0,2|2,0,0]=4 5230 B25R3.4239545 C\1=C\CCC(CCC1)OCC(c2ccccc2)c3ccccc3 34a_100011215272_100021000466 [0,0,0,0,0,2|2,0,0]=4 5231 B25R3.4239545 C\1=C\CCC(CCC1)OCC(c2ccccc2)c3ccccc3 7a_100011215272_100021000466 [0,0,0,0,0,2|2,0,0]=4 5232 B25R3.4239545 c1ccc(cc1)C(CCN2CCCCCCC2)c3ccccc3 2230a_100000211400_100009813428 [0,0,0,0,0,2|0,0,0]=2 5233 B25R3.4239545 c1ccc(cc1)C(CCN2CCCCCCC2)c3ccccc3 269982a_100000211400_100009813428 [0,0,0,0,0,2|0,0,0]=2 5234 B25R3.4239545 c1ccc(cc1)C(CCN2CCCCCCC2)c3ccccc3 34a_100000211400_100009813428 [0,0,0,0,0,2|0,0,0]=2 5235 B25R3.4239545 c1ccc(cc1)C(CNC2CCCCCCC2)c3ccccc3 270004a_100000739227_100000210524 [0,0,0,0,0,2|2,0,0]=4 5236 B25R3.4239545 c1ccc(cc1)[S+](CCN2CCCCCCC2)c3ccccc3 2230a_100000211400_100010140906 [0,0,0,0,0,2|1,0,0]=3 5237 B25R3.4239545 c1ccc(cc1)[S+](CCN2CCCCCCC2)c3ccccc3 269982a_100000211400_100010140906 [0,0,0,0,0,2|1,0,0]=3