0 B20R2.10799 C=C(C)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000730704 [0,0,0,0,0,0|2,0,1]=3 1 B20R2.10799 C=C(C)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000730704 [0,0,0,0,0,0|2,0,1]=3 2 B20R2.10799 C=C(C)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000730704 [0,0,0,0,0,0|3,0,1]=4 3 B20R2.10799 C=C(C)CCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000730704 [0,0,0,0,0,0|3,0,1]=4 4 B20R2.10799 C=C(C)CCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000730704 [0,0,0,0,0,0|3,0,1]=4 5 B20R2.10799 C=C(C)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000730704 [0,0,0,0,0,0|1,0,1]=2 6 B20R2.10799 C=C(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000730704 [0,0,0,0,0,0|1,0,1]=2 7 B20R2.10799 C=C(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000730704 [0,0,0,0,0,0|2,0,1]=3 8 B20R2.10799 C=C(C)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000730704 [0,0,0,0,0,0|1,1,1]=3 9 B20R2.10799 C=C(C)CCSC(c1ccccc1)c2ccccc2 62a_100000730704_100011216954 [0,0,0,0,0,0|1,1,1]=3 10 B20R2.10799 C=C(C)CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000748629 [0,0,0,0,0,0|3,0,1]=4 11 B20R2.10799 C=C(C)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000748629 [0,0,0,0,0,0|3,0,1]=4 12 B20R2.10799 C=C(C)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100000748629 [0,0,0,0,0,0|3,0,1]=4 13 B20R2.10799 C=C(C)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100000748629 [0,0,0,0,0,0|3,0,1]=4 14 B20R2.10799 CC(=CCNC(c1ccccc1)c2ccccc2)C 2230a_100000162943_100000761012 [0,0,0,0,0,0|2,0,1]=3 15 B20R2.10799 CC(=CCNC(c1ccccc1)c2ccccc2)C 270004a_100000718196_100000210122 [0,0,0,0,0,0|2,0,1]=3 16 B20R2.10799 CC(=CCNC(c1ccccc1)c2ccccc2)C 34a_100000162943_100000761012 [0,0,0,0,0,0|2,0,1]=3 17 B20R2.10799 CC(=CCNC(c1ccccc1)c2ccccn2)C 2230a_100000689936_100000761012 [0,0,0,0,0,0|3,0,1]=4 18 B20R2.10799 CC(=CCNC(c1ccccc1)c2ccccn2)C 270004a_100000718196_100000210380 [0,0,0,0,0,0|3,0,1]=4 19 B20R2.10799 CC(=CCNC(c1ccccc1)c2cccnc2)C 2230a_100011232609_100000761012 [0,0,0,0,0,0|3,0,1]=4 20 B20R2.10799 CC(=CCNC(c1ccccc1)c2cccnc2)C 270004a_100000718196_100000735413 [0,0,0,0,0,0|3,0,1]=4 21 B20R2.10799 CC(=CCNC(c1ccccc1)c2ccncc2)C 2230a_100025760769_100000761012 [0,0,0,0,0,0|3,0,1]=4 22 B20R2.10799 CC(=CCOC(c1ccccc1)c2ccccc2)C 34a_100000211180_100000761012 [0,0,0,0,0,0|1,0,1]=2 23 B20R2.10799 CC(=CCOC(c1ccccc1)c2ccccc2)C 7a_100000211180_100000761012 [0,0,0,0,0,0|1,0,1]=2 24 B20R2.10799 CC(=CCOC(c1ccccc1)c2ccccn2)C 7a_100000180852_100000761012 [0,0,0,0,0,0|2,0,1]=3 25 B20R2.10799 CC(=CCSC(c1ccccc1)c2ccccc2)C 62a_100000211591_100000761012 [0,0,0,0,0,0|1,1,1]=3 26 B20R2.10799 CC(=CCSC(c1ccccc1)c2ccccc2)C 62a_100000761012_100011216954 [0,0,0,0,0,0|1,1,1]=3 27 B20R2.10799 CC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000070787_100000734929 [0,0,0,0,0,0|2,0,0]=2 28 B20R2.10799 CC(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000053229 [0,0,0,0,0,0|2,0,0]=2 29 B20R2.10799 CC(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000759926_100011216954 [0,0,0,0,0,0|2,0,0]=2 30 B20R2.10799 CC(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000053229 [0,0,0,0,0,0|3,0,0]=3 31 B20R2.10799 CC(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000053229_100011216954 [0,0,0,0,0,0|2,1,0]=3 32 B20R2.10799 CC(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000053229 [0,0,0,0,0,0|2,1,0]=3 33 B20R2.10799 CC(=O)NCCC(c1ccccc1)c2ccccc2 11a_100000272388_100015343762 [0,0,0,0,0,0|4,0,0]=4 34 B20R2.10799 CC(=O)NCCC(c1ccccc1)c2ccccc2 1626a_100000272388_100015343762 [0,0,0,0,0,0|4,0,0]=4 35 B20R2.10799 CC(=O)NCCC(c1ccccc1)c2ccccc2 240690a_100000272388_100015343762 [0,0,0,0,0,0|4,0,0]=4 36 B20R2.10799 CC(=O)NCCC(c1ccccc1)c2ccccc2 527a_100000272388_100103153847 [0,0,0,0,0,0|4,0,0]=4 37 B20R2.10799 CC(=O)OCNC(c1ccccc1)c2ccccc2 34a_100000162943_100009813279 [0,0,0,0,0,0|4,0,0]=4 38 B20R2.10799 CC(=O)OCOC(c1ccccc1)c2ccccc2 34a_100000211180_100009813279 [0,0,0,0,0,0|3,0,0]=3 39 B20R2.10799 CC(=O)OCSC(c1ccccc1)c2ccccc2 62a_100000076356_100011216954 [0,0,0,0,0,0|3,1,0]=4 40 B20R2.10799 CC(=O)OCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000076356 [0,0,0,0,0,0|3,1,0]=4 41 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210312 [0,0,0,0,0,0|2,0,0]=2 42 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccc2 269862a_100000162943_100000185833 [0,0,0,0,0,0|2,0,0]=2 43 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccc2 270004a_100000210545_100000210122 [0,0,0,0,0,0|2,0,0]=2 44 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210312 [0,0,0,0,0,0|2,0,0]=2 45 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210312 [0,0,0,0,0,0|3,0,0]=3 46 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccn2 269862a_100000689936_100000185833 [0,0,0,0,0,0|3,0,0]=3 47 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccn2 270004a_100000210545_100000210380 [0,0,0,0,0,0|3,0,0]=3 48 B20R2.10799 CC(C)CCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000210312 [0,0,0,0,0,0|3,0,0]=3 49 B20R2.10799 CC(C)CCNC(c1ccccc1)c2cccnc2 270004a_100000210545_100000735413 [0,0,0,0,0,0|3,0,0]=3 50 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000210312 [0,0,0,0,0,0|3,0,0]=3 51 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccncc2 269862a_100025760769_100000185833 [0,0,0,0,0,0|3,0,0]=3 52 B20R2.10799 CC(C)CCNC(c1ccccn1)c2ccccn2 269862a_100009954364_100000185833 [0,0,0,0,0,0|4,0,0]=4 53 B20R2.10799 CC(C)CCNC(c1cccnc1)c2ccccn2 270004a_100000210545_100011376182 [0,0,0,0,0,0|4,0,0]=4 54 B20R2.10799 CC(C)CCNC(c1cccnc1)c2cccnc2 270004a_100000210545_200011376183 [0,0,0,0,0,0|4,0,0]=4 55 B20R2.10799 CC(C)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210312 [0,0,0,0,0,0|1,0,0]=1 56 B20R2.10799 CC(C)CCOC(c1ccccc1)c2ccccc2 7a_100000210254_100011216954 [0,0,0,0,0,0|1,0,0]=1 57 B20R2.10799 CC(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210626 [0,0,0,0,0,0|1,0,0]=1 58 B20R2.10799 CC(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210626 [0,0,0,0,0,0|2,0,0]=2 59 B20R2.10799 CC(C)CCSC(c1ccccc1)c2ccccc2 62a_100000210312_100011216954 [0,0,0,0,0,0|1,1,0]=2 60 B20R2.10799 CC(C)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000210312 [0,0,0,0,0,0|1,1,0]=2 61 B20R2.10799 CC(C)CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210760 [0,0,0,0,0,0|3,0,0]=3 62 B20R2.10799 CC(C)CNCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000210432 [0,0,0,0,0,0|3,0,0]=3 63 B20R2.10799 CC(C)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210624 [0,0,0,0,0,0|3,0,0]=3 64 B20R2.10799 CC(C)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210624 [0,0,0,0,0,0|3,0,0]=3 65 B20R2.10799 CC(C)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210760 [0,0,0,0,0,0|3,0,0]=3 66 B20R2.10799 CC(C)NCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000210206 [0,0,0,0,0,0|3,0,0]=3 67 B20R2.10799 CC(C)NCCC(c1ccccc1)c2ccccc2 2230a_100138425928_100009813428 [0,0,0,0,0,0|3,0,0]=3 68 B20R2.10799 CC(C)NCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000210206 [0,0,0,0,0,0|3,0,0]=3 69 B20R2.10799 CC(C)NCCC(c1ccccc1)c2ccccc2 34a_100138425928_100009813428 [0,0,0,0,0,0|3,0,0]=3 70 B20R2.10799 CC(C)NCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000210206 [0,0,0,0,0,0|4,0,0]=4 71 B20R2.10799 CC(C)NCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000210206 [0,0,0,0,0,0|4,0,0]=4 72 B20R2.10799 CC(C)NCC[S+](c1ccccc1)c2ccccc2 2230a_100138425928_100010140906 [0,0,0,0,0,0|4,0,0]=4 73 B20R2.10799 CC(C)NN=CC(c1ccccc1)c2ccccc2 4a_100000741168_100000183636 [0,0,0,0,0,0|4,0,0]=4 74 B20R2.10799 CC(C)OCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210206 [0,0,0,0,0,0|3,0,0]=3 75 B20R2.10799 CC(C)OCCC(c1ccccc1)c2ccccc2 34a_100000212225_100009813428 [0,0,0,0,0,0|3,0,0]=3 76 B20R2.10799 CC(C)OCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210206 [0,0,0,0,0,0|3,0,0]=3 77 B20R2.10799 CC(C)OCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000210206 [0,0,0,0,0,0|4,0,0]=4 78 B20R2.10799 CC(C)OCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000210206 [0,0,0,0,0,0|4,0,0]=4 79 B20R2.10799 CC(C)OCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000709892 [0,0,0,0,0,0|3,0,0]=3 80 B20R2.10799 CC(C)OCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000709892 [0,0,0,0,0,0|3,0,0]=3 81 B20R2.10799 CC(C)OCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000709892 [0,0,0,0,0,0|4,0,0]=4 82 B20R2.10799 CC(C)OCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000709892 [0,0,0,0,0,0|4,0,0]=4 83 B20R2.10799 CC(C)OCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000709892 [0,0,0,0,0,0|4,0,0]=4 84 B20R2.10799 CC(C)OCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000709892 [0,0,0,0,0,0|2,0,0]=2 85 B20R2.10799 CC(C)OCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000709892 [0,0,0,0,0,0|2,1,0]=3 86 B20R2.10799 CC(C)OCSC(c1ccccc1)c2ccccc2 62a_100000709892_100011216954 [0,0,0,0,0,0|2,1,0]=3 87 B20R2.10799 CC(C)SCCC(c1ccccc1)c2ccccc2 62a_100000210206_100009813428 [0,0,0,0,0,0|3,0,0]=3 88 B20R2.10799 CC(C)SCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000210206 [0,0,0,0,0,0|3,0,0]=3 89 B20R2.10799 CC(C)SCC[S+](c1ccccc1)c2ccccc2 62a_100000210206_100010140906 [0,0,0,0,0,0|4,0,0]=4 90 B20R2.10799 CC(C)SCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000210206 [0,0,0,0,0,0|4,0,0]=4 91 B20R2.10799 CC(O)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100012276601 [0,0,0,0,0,0|3,0,0]=3 92 B20R2.10799 CC(O)CCNC(c1ccccc1)c2ccccc2 2230a_200000755665_100000211591 [0,0,0,0,0,0|3,0,0]=3 93 B20R2.10799 CC(O)CCNC(c1ccccc1)c2ccccc2 270004a_200000755665_100000210122 [0,0,0,0,0,0|3,0,0]=3 94 B20R2.10799 CC(O)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100012276601 [0,0,0,0,0,0|3,0,0]=3 95 B20R2.10799 CC(O)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100012276601 [0,0,0,0,0,0|4,0,0]=4 96 B20R2.10799 CC(O)CCNC(c1ccccc1)c2ccccn2 270004a_200000755665_100000210380 [0,0,0,0,0,0|4,0,0]=4 97 B20R2.10799 CC(O)CCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100012276601 [0,0,0,0,0,0|4,0,0]=4 98 B20R2.10799 CC(O)CCNC(c1ccccc1)c2cccnc2 270004a_200000755665_100000735413 [0,0,0,0,0,0|4,0,0]=4 99 B20R2.10799 CC(O)CCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100012276601 [0,0,0,0,0,0|4,0,0]=4 100 B20R2.10799 CC(O)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100012276601 [0,0,0,0,0,0|2,0,0]=2 101 B20R2.10799 CC(O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100012276601 [0,0,0,0,0,0|2,0,0]=2 102 B20R2.10799 CC(O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100012276601 [0,0,0,0,0,0|3,0,0]=3 103 B20R2.10799 CC(O)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100012276601 [0,0,0,0,0,0|2,1,0]=3 104 B20R2.10799 CC(O)CCSC(c1ccccc1)c2ccccc2 62a_100012276601_100011216954 [0,0,0,0,0,0|2,1,0]=3 105 B20R2.10799 CC(O)CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011218427 [0,0,0,0,0,0|4,0,0]=4 106 B20R2.10799 CC(O)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011218427 [0,0,0,0,0,0|4,0,0]=4 107 B20R2.10799 CC(O)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100011218427 [0,0,0,0,0,0|4,0,0]=4 108 B20R2.10799 CC(O)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100011218427 [0,0,0,0,0,0|4,0,0]=4 109 B20R2.10799 CN(C)CCNC(c1ccccc1)c2ccccc2 270004a_100000210585_100000210122 [0,0,0,0,0,0|1,0,0]=1 110 B20R2.10799 CN(C)CCNC(c1ccccc1)c2ccccn2 270004a_100000210585_100000210380 [0,0,0,0,0,0|2,0,0]=2 111 B20R2.10799 CN(C)CCNC(c1ccccc1)c2cccnc2 270004a_100000210585_100000735413 [0,0,0,0,0,0|2,0,0]=2 112 B20R2.10799 CN(C)CCNC(c1cccnc1)c2ccccn2 270004a_100000210585_100011376182 [0,0,0,0,0,0|3,0,0]=3 113 B20R2.10799 CN(C)CCNC(c1cccnc1)c2cccnc2 270004a_100000210585_200011376183 [0,0,0,0,0,0|3,0,0]=3 114 B20R2.10799 CN(C)CCNC(c1cccnc1)c2cnccn2 270004a_100000210585_100000732570 [0,0,0,0,0,0|4,0,0]=4 115 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 2230a_100102631434_100000734929 [0,0,0,0,0,0|0,0,0]=0 116 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_200000210301 [0,0,0,0,0,0|0,0,0]=0 117 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 269982a_100102631434_100000734929 [0,0,0,0,0,0|0,0,0]=0 118 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_200000210301 [0,0,0,0,0,0|0,0,0]=0 119 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000755713 [0,0,0,0,0,0|0,0,0]=0 120 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000755713 [0,0,0,0,0,0|1,0,0]=1 121 B20R2.10799 CN(C)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000755713 [0,0,0,0,0,0|0,1,0]=1 122 B20R2.10799 CN([13CH3])CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_200025704644 [0,0,0,0,0,0|0,0,0]=0 123 B20R2.10799 CN([13CH3])CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_200025704644 [0,0,0,0,0,0|0,0,0]=0 124 B20R2.10799 C[C@@H](O)CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100009817552 [0,0,0,0,0,0|4,0,0]=4 125 B20R2.10799 C[C@@H](O)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100009817552 [0,0,0,0,0,0|4,0,0]=4 126 B20R2.10799 C[C@@H](O)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100009817552 [0,0,0,0,0,0|4,0,0]=4 127 B20R2.10799 C[C@@H](O)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100009817552 [0,0,0,0,0,0|4,0,0]=4 128 B20R2.10799 NC(=O)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000744528 [0,0,0,0,0,0|4,0,0]=4 129 B20R2.10799 NC(=O)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000731001 [0,0,0,0,0,0|4,0,0]=4 130 B20R2.10799 NC(=O)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000731001 [0,0,0,0,0,0|3,0,0]=3 131 B20R2.10799 NC(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000744528 [0,0,0,0,0,0|3,0,0]=3 132 B20R2.10799 NC(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000757172_100011216954 [0,0,0,0,0,0|3,0,0]=3 133 B20R2.10799 NC(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000744528 [0,0,0,0,0,0|4,0,0]=4 134 B20R2.10799 NC(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000744528 [0,0,0,0,0,0|3,1,0]=4 135 B20R2.10799 NC(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000744528_100011216954 [0,0,0,0,0,0|3,1,0]=4 136 B19R2.2474 C#CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000688953 [1,0,0,0,0,0|2,0,1]=4 137 B19R2.2474 C#CCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000688953 [1,0,0,0,0,0|2,0,1]=4 138 B19R2.2474 C#CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000688953 [1,0,0,0,0,0|1,0,1]=3 139 B19R2.2474 C#CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000688953 [1,0,0,0,0,0|1,0,1]=3 140 B19R2.2474 C#CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000688953 [1,0,0,0,0,0|2,0,1]=4 141 B19R2.2474 C#CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000688953 [1,0,0,0,0,0|1,1,1]=4 142 B19R2.2474 C#CCCSC(c1ccccc1)c2ccccc2 62a_100000688953_100011216954 [1,0,0,0,0,0|1,1,1]=4 143 B19R2.2474 C/C=C/CNC(c1ccccc1)c2ccccc2 34a_100000162943_100102629194 [1,0,0,0,0,0|2,0,1]=4 144 B19R2.2474 C/C=C/COC(c1ccccc1)c2ccccc2 34a_100000211180_100102629194 [1,0,0,0,0,0|1,0,1]=3 145 B19R2.2474 C/C=C/COC(c1ccccc1)c2ccccc2 7a_100000211180_100102629194 [1,0,0,0,0,0|1,0,1]=3 146 B19R2.2474 C/C=C/COC(c1ccccc1)c2ccccn2 7a_100000180852_100102629194 [1,0,0,0,0,0|2,0,1]=4 147 B19R2.2474 C/C=C/CSC(c1ccccc1)c2ccccc2 62a_100000211591_100102629194 [1,0,0,0,0,0|1,1,1]=4 148 B19R2.2474 C/C=C/CSC(c1ccccc1)c2ccccc2 62a_100102629194_100011216954 [1,0,0,0,0,0|1,1,1]=4 149 B19R2.2474 C=CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000754431 [1,0,0,0,0,0|2,0,1]=4 150 B19R2.2474 C=CCCNC(c1ccccc1)c2ccccc2 2230a_100015191253_100000211591 [1,0,0,0,0,0|2,0,1]=4 151 B19R2.2474 C=CCCNC(c1ccccc1)c2ccccc2 270004a_100015191253_100000210122 [1,0,0,0,0,0|2,0,1]=4 152 B19R2.2474 C=CCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000754431 [1,0,0,0,0,0|2,0,1]=4 153 B19R2.2474 C=CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000754431 [1,0,0,0,0,0|1,0,1]=3 154 B19R2.2474 C=CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000754431 [1,0,0,0,0,0|1,0,1]=3 155 B19R2.2474 C=CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000754431 [1,0,0,0,0,0|2,0,1]=4 156 B19R2.2474 C=CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000754431 [1,0,0,0,0,0|1,1,1]=4 157 B19R2.2474 C=CCCSC(c1ccccc1)c2ccccc2 62a_100000754431_100011216954 [1,0,0,0,0,0|1,1,1]=4 158 B19R2.2474 CC#CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000748600 [1,0,0,0,0,0|2,0,1]=4 159 B19R2.2474 CC#CCNC(c1ccccc1)c2ccccc2 2230a_100000685387_100000211591 [1,0,0,0,0,0|2,0,1]=4 160 B19R2.2474 CC#CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000748600 [1,0,0,0,0,0|2,0,1]=4 161 B19R2.2474 CC#CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000748600 [1,0,0,0,0,0|1,0,1]=3 162 B19R2.2474 CC#CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000748600 [1,0,0,0,0,0|1,0,1]=3 163 B19R2.2474 CC#CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000748600 [1,0,0,0,0,0|2,0,1]=4 164 B19R2.2474 CC#CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000748600 [1,0,0,0,0,0|1,1,1]=4 165 B19R2.2474 CC#CCSC(c1ccccc1)c2ccccc2 62a_100000748600_100011216954 [1,0,0,0,0,0|1,1,1]=4 166 B19R2.2474 CC=CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000070051 [1,0,0,0,0,0|2,0,1]=4 167 B19R2.2474 CC=CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000070051 [1,0,0,0,0,0|2,0,1]=4 168 B19R2.2474 CC=CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000070051 [1,0,0,0,0,0|1,0,1]=3 169 B19R2.2474 CC=CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000070051 [1,0,0,0,0,0|1,0,1]=3 170 B19R2.2474 CC=CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000070051 [1,0,0,0,0,0|2,0,1]=4 171 B19R2.2474 CC=CCSC(c1ccccc1)c2ccccc2 62a_100000070051_100011216954 [1,0,0,0,0,0|1,1,1]=4 172 B19R2.2474 CC=CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000070051 [1,0,0,0,0,0|1,1,1]=4 173 B19R2.2474 CCCCNC(c1ccccc1)c2ccccc2 2230a_100000102301_100000211591 [1,0,0,0,0,0|2,0,0]=3 174 B19R2.2474 CCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210211 [1,0,0,0,0,0|2,0,0]=3 175 B19R2.2474 CCCCNC(c1ccccc1)c2ccccc2 270004a_100000102301_100000210122 [1,0,0,0,0,0|2,0,0]=3 176 B19R2.2474 CCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210210 [1,0,0,0,0,0|2,0,0]=3 177 B19R2.2474 CCCCNC(c1ccccc1)c2ccccc2 7a_106832991798_100011216954 [1,0,0,0,0,0|2,0,0]=3 178 B19R2.2474 CCCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210211 [1,0,0,0,0,0|3,0,0]=4 179 B19R2.2474 CCCCNC(c1ccccc1)c2ccccn2 270004a_100000102301_100000210380 [1,0,0,0,0,0|3,0,0]=4 180 B19R2.2474 CCCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000210211 [1,0,0,0,0,0|3,0,0]=4 181 B19R2.2474 CCCCNC(c1ccccc1)c2cccnc2 270004a_100000102301_100000735413 [1,0,0,0,0,0|3,0,0]=4 182 B19R2.2474 CCCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000210211 [1,0,0,0,0,0|3,0,0]=4 183 B19R2.2474 CCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210210 [1,0,0,0,0,0|1,0,0]=2 184 B19R2.2474 CCCCOC(c1ccccc1)c2ccccc2 7a_100000210227_100011216954 [1,0,0,0,0,0|1,0,0]=2 185 B19R2.2474 CCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210211 [1,0,0,0,0,0|1,0,0]=2 186 B19R2.2474 CCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210211 [1,0,0,0,0,0|2,0,0]=3 187 B19R2.2474 CCCCSC(c1ccccc1)c2ccccc2 62a_100000210211_100011216954 [1,0,0,0,0,0|1,1,0]=3 188 B19R2.2474 CCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000210210 [1,0,0,0,0,0|1,1,0]=3 189 B19R2.2474 CCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210303 [1,0,0,0,0,0|3,0,0]=4 190 B19R2.2474 CCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210303 [1,0,0,0,0,0|3,0,0]=4 191 B19R2.2474 CCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210303 [1,0,0,0,0,0|3,0,0]=4 192 B19R2.2474 CCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210303 [1,0,0,0,0,0|3,0,0]=4 193 B19R2.2474 CCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000210202 [1,0,0,0,0,0|3,0,0]=4 194 B19R2.2474 CCNCCC(c1ccccc1)c2ccccc2 2230a_100015525214_100009813428 [1,0,0,0,0,0|3,0,0]=4 195 B19R2.2474 CCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000210202 [1,0,0,0,0,0|3,0,0]=4 196 B19R2.2474 CCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210202 [1,0,0,0,0,0|3,0,0]=4 197 B19R2.2474 CCOCCC(c1ccccc1)c2ccccc2 34a_100121572206_100009813428 [1,0,0,0,0,0|3,0,0]=4 198 B19R2.2474 CCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210202 [1,0,0,0,0,0|3,0,0]=4 199 B19R2.2474 CCOCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000739092 [1,0,0,0,0,0|2,1,0]=4 200 B19R2.2474 CCOCSC(c1ccccc1)c2ccccc2 62a_100000739092_100011216954 [1,0,0,0,0,0|2,1,0]=4 201 B19R2.2474 CCSCCC(c1ccccc1)c2ccccc2 62a_100000210202_100009813428 [1,0,0,0,0,0|3,0,0]=4 202 B19R2.2474 CCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000210202 [1,0,0,0,0,0|3,0,0]=4 203 B19R2.2474 CNCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_200000210301 [1,0,0,0,0,0|2,0,0]=3 204 B19R2.2474 CNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_200000210301 [1,0,0,0,0,0|2,0,0]=3 205 B19R2.2474 CNCCOC(c1ccccc1)c2ccccc2 2230a_106832991635_100000734929 [1,0,0,0,0,0|0,0,0]=1 206 B19R2.2474 CNCCOC(c1ccccc1)c2ccccc2 34a_100102657272_100000734929 [1,0,0,0,0,0|0,0,0]=1 207 B19R2.2474 CNCCOC(c1ccccc1)c2ccccc2 7a_106832991635_100000734929 [1,0,0,0,0,0|0,0,0]=1 208 B19R2.2474 COCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011201679 [1,0,0,0,0,0|2,0,0]=3 209 B19R2.2474 COCCNC(c1ccccc1)c2ccccc2 2230a_100000209980_100000211591 [1,0,0,0,0,0|2,0,0]=3 210 B19R2.2474 COCCNC(c1ccccc1)c2ccccc2 270004a_100000209980_100000210122 [1,0,0,0,0,0|2,0,0]=3 211 B19R2.2474 COCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011201679 [1,0,0,0,0,0|2,0,0]=3 212 B19R2.2474 COCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100011201679 [1,0,0,0,0,0|3,0,0]=4 213 B19R2.2474 COCCNC(c1ccccc1)c2ccccn2 270004a_100000209980_100000210380 [1,0,0,0,0,0|3,0,0]=4 214 B19R2.2474 COCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100011201679 [1,0,0,0,0,0|3,0,0]=4 215 B19R2.2474 COCCNC(c1ccccc1)c2cccnc2 270004a_100000209980_100000735413 [1,0,0,0,0,0|3,0,0]=4 216 B19R2.2474 COCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100011201679 [1,0,0,0,0,0|3,0,0]=4 217 B19R2.2474 COCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011201679 [1,0,0,0,0,0|1,0,0]=2 218 B19R2.2474 COCCOC(c1ccccc1)c2ccccc2 34a_100138415774_100000734929 [1,0,0,0,0,0|1,0,0]=2 219 B19R2.2474 COCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000233755 [1,0,0,0,0,0|1,0,0]=2 220 B19R2.2474 COCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000233755 [1,0,0,0,0,0|2,0,0]=3 221 B19R2.2474 COCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000233755 [1,0,0,0,0,0|1,1,0]=3 222 B19R2.2474 COCCSC(c1ccccc1)c2ccccc2 62a_100000233755_100011216954 [1,0,0,0,0,0|1,1,0]=3 223 B19R2.2474 COCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000766300 [1,0,0,0,0,0|3,0,0]=4 224 B19R2.2474 CSCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000751147 [1,0,0,0,0,0|2,0,0]=3 225 B19R2.2474 CSCCNC(c1ccccc1)c2ccccc2 2230a_100020590264_100000211591 [1,0,0,0,0,0|2,0,0]=3 226 B19R2.2474 CSCCNC(c1ccccc1)c2ccccc2 270004a_100020590264_100000210122 [1,0,0,0,0,0|2,0,0]=3 227 B19R2.2474 CSCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000212216 [1,0,0,0,0,0|2,0,0]=3 228 B19R2.2474 CSCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000751147 [1,0,0,0,0,0|3,0,0]=4 229 B19R2.2474 CSCCNC(c1ccccc1)c2ccccn2 270004a_100020590264_100000210380 [1,0,0,0,0,0|3,0,0]=4 230 B19R2.2474 CSCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000751147 [1,0,0,0,0,0|3,0,0]=4 231 B19R2.2474 CSCCNC(c1ccccc1)c2cccnc2 270004a_100020590264_100000735413 [1,0,0,0,0,0|3,0,0]=4 232 B19R2.2474 CSCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000751147 [1,0,0,0,0,0|3,0,0]=4 233 B19R2.2474 CSCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000212216 [1,0,0,0,0,0|1,0,0]=2 234 B19R2.2474 CSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_200000210301 [1,0,0,0,0,0|1,0,0]=2 235 B19R2.2474 CSCCOC(c1ccccc1)c2ccccc2 62a_200000210301_100000734929 [1,0,0,0,0,0|1,0,0]=2 236 B19R2.2474 CSCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000212216 [1,0,0,0,0,0|1,0,0]=2 237 B19R2.2474 CSCCOC(c1ccccc1)c2ccccc2 7a_100000230434_100011216954 [1,0,0,0,0,0|1,0,0]=2 238 B19R2.2474 CSCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000212216 [1,0,0,0,0,0|2,0,0]=3 239 B19R2.2474 CSCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000751147 [1,0,0,0,0,0|1,1,0]=3 240 B19R2.2474 CSCCSC(c1ccccc1)c2ccccc2 62a_100000212216_100011216954 [1,0,0,0,0,0|1,1,0]=3 241 B19R2.2474 CSCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011218213 [1,0,0,0,0,0|3,0,0]=4 242 B19R2.2474 CSCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011218213 [1,0,0,0,0,0|3,0,0]=4 243 B19R2.2474 CSCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100011218213 [1,0,0,0,0,0|3,0,0]=4 244 B19R2.2474 FCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011934791 [1,0,0,0,0,0|3,0,0]=4 245 B19R2.2474 FCCCNC(c1ccccc1)c2ccccc2 2230a_100015189416_100000211591 [1,0,0,0,0,0|3,0,0]=4 246 B19R2.2474 FCCCNC(c1ccccc1)c2ccccc2 270004a_100015189416_100000210122 [1,0,0,0,0,0|3,0,0]=4 247 B19R2.2474 FCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011934791 [1,0,0,0,0,0|3,0,0]=4 248 B19R2.2474 FCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011934791 [1,0,0,0,0,0|2,0,0]=3 249 B19R2.2474 FCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011934791 [1,0,0,0,0,0|2,0,0]=3 250 B19R2.2474 FCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011934791 [1,0,0,0,0,0|3,0,0]=4 251 B19R2.2474 FCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011934791 [1,0,0,0,0,0|2,1,0]=4 252 B19R2.2474 FCCCSC(c1ccccc1)c2ccccc2 62a_100011934791_100011216954 [1,0,0,0,0,0|2,1,0]=4 253 B19R2.2474 N#CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011215226 [1,0,0,0,0,0|3,0,0]=4 254 B19R2.2474 N#CCCNC(c1ccccc1)c2ccccc2 270004a_100000720768_100000210122 [1,0,0,0,0,0|3,0,0]=4 255 B19R2.2474 N#CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000184422 [1,0,0,0,0,0|2,0,0]=3 256 B19R2.2474 N#CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000184422 [1,0,0,0,0,0|3,0,0]=4 257 B19R2.2474 N#CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011215226 [1,0,0,0,0,0|2,1,0]=4 258 B19R2.2474 N#CCCSC(c1ccccc1)c2ccccc2 62a_100011215226_100011216954 [1,0,0,0,0,0|2,1,0]=4 259 B19R2.2474 OCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000230001 [1,0,0,0,0,0|3,0,0]=4 260 B19R2.2474 OCCCNC(c1ccccc1)c2ccccc2 270004a_100000182051_100000210122 [1,0,0,0,0,0|3,0,0]=4 261 B19R2.2474 OCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000230001 [1,0,0,0,0,0|3,0,0]=4 262 B19R2.2474 OCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000230001 [1,0,0,0,0,0|2,0,0]=3 263 B19R2.2474 OCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011215043 [1,0,0,0,0,0|2,0,0]=3 264 B19R2.2474 OCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011215043 [1,0,0,0,0,0|3,0,0]=4 265 B19R2.2474 OCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011215043 [1,0,0,0,0,0|2,1,0]=4 266 B19R2.2474 OCCCSC(c1ccccc1)c2ccccc2 62a_100011215043_100011216954 [1,0,0,0,0,0|2,1,0]=4 267 B19R2.2474 [13CH3]NCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_200025704644 [1,0,0,0,0,0|2,0,0]=3 268 B19R2.2474 [13CH3]NCCCP(c1ccccc1)c2ccccc2 34a_100016990410_200025704644 [1,0,0,0,0,0|2,0,0]=3 269 B19R2.2474 [13CH3]SCCOC(c1ccccc1)c2ccccc2 62a_100000734929_200025704644 [1,0,0,0,0,0|1,0,0]=2 270 B19R2.2474 [13CH3]SCCOC(c1ccccc1)c2ccccc2 62a_200025704644_100000734929 [1,0,0,0,0,0|1,0,0]=2 271 B21R2.21291 C#CC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000211873_100000734929 [0,1,0,0,0,0|2,0,1]=4 272 B21R2.21291 C=CC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000185746_100000734929 [0,1,0,0,0,0|2,0,1]=4 273 B21R2.21291 CC(CF)OCCC(c1ccccc1)c2ccccc2 34a_100016041109_100009813428 [0,1,0,0,0,0|3,0,0]=4 274 B21R2.21291 CC(CF)OCCC(c1ccccc1)c2ccccc2 7a_100016041109_100009813428 [0,1,0,0,0,0|3,0,0]=4 275 B21R2.21291 CC(CN)OCCC(c1ccccc1)c2ccccc2 34a_100000210904_100009813428 [0,1,0,0,0,0|3,0,0]=4 276 B21R2.21291 CC(CO)CCNC(c1ccccc1)c2ccccc2 2230a_106354213184_100000211591 [0,1,0,0,0,0|2,0,0]=3 277 B21R2.21291 CC(CO)CCNC(c1ccccc1)c2ccccc2 270004a_106354213184_100000210122 [0,1,0,0,0,0|2,0,0]=3 278 B21R2.21291 CC(CO)CCNC(c1ccccc1)c2ccccn2 270004a_106354213184_100000210380 [0,1,0,0,0,0|3,0,0]=4 279 B21R2.21291 CC(CO)CCNC(c1ccccc1)c2cccnc2 270004a_106354213184_100000735413 [0,1,0,0,0,0|3,0,0]=4 280 B21R2.21291 CC(CO)NCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100012180447 [0,1,0,0,0,0|3,0,0]=4 281 B21R2.21291 CC(CO)NCCC(c1ccccc1)c2ccccc2 34a_100000272388_100012180447 [0,1,0,0,0,0|3,0,0]=4 282 B21R2.21291 CC(CO)OCCC(c1ccccc1)c2ccccc2 34a_100000032380_100012180447 [0,1,0,0,0,0|3,0,0]=4 283 B21R2.21291 CC(CO)OCCC(c1ccccc1)c2ccccc2 7a_100000032380_100012180447 [0,1,0,0,0,0|3,0,0]=4 284 B21R2.21291 CC(CO)SCCC(c1ccccc1)c2ccccc2 62a_100012180447_100009813428 [0,1,0,0,0,0|3,0,0]=4 285 B21R2.21291 CCC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000210414_100000734929 [0,1,0,0,0,0|2,0,0]=3 286 B21R2.21291 CCC(C)CCNC(c1ccccc1)c2ccccc2 2230a_100020591266_100000211591 [0,1,0,0,0,0|2,0,0]=3 287 B21R2.21291 CCC(C)CCNC(c1ccccc1)c2ccccc2 270004a_100020591266_100000210122 [0,1,0,0,0,0|2,0,0]=3 288 B21R2.21291 CCC(C)CCNC(c1ccccc1)c2ccccn2 270004a_100020591266_100000210380 [0,1,0,0,0,0|3,0,0]=4 289 B21R2.21291 CCC(C)CCNC(c1ccccc1)c2cccnc2 270004a_100020591266_100000735413 [0,1,0,0,0,0|3,0,0]=4 290 B21R2.21291 CCC(C)CCOC(c1ccccc1)c2ccccc2 7a_100011215188_100011216954 [0,1,0,0,0,0|1,0,0]=2 291 B21R2.21291 CCC(C)CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000748023 [0,1,0,0,0,0|3,0,0]=4 292 B21R2.21291 CCC(C)CNCC(c1ccccc1)c2ccccc2 270004a_100000739227_100000243153 [0,1,0,0,0,0|3,0,0]=4 293 B21R2.21291 CCC(C)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000748023 [0,1,0,0,0,0|3,0,0]=4 294 B21R2.21291 CCC(C)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100000748023 [0,1,0,0,0,0|3,0,0]=4 295 B21R2.21291 CCC(C)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100000748023 [0,1,0,0,0,0|3,0,0]=4 296 B21R2.21291 CCC(C)NCCC(c1ccccc1)c2ccccc2 2230a_100000209981_100009813428 [0,1,0,0,0,0|3,0,0]=4 297 B21R2.21291 CCC(C)NCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000758301 [0,1,0,0,0,0|3,0,0]=4 298 B21R2.21291 CCC(C)NCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011215416 [0,1,0,0,0,0|3,0,0]=4 299 B21R2.21291 CCC(C)OCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011215416 [0,1,0,0,0,0|3,0,0]=4 300 B21R2.21291 CCC(C)OCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000758301 [0,1,0,0,0,0|3,0,0]=4 301 B21R2.21291 CCC(C)OCCC(c1ccccc1)c2ccccc2 7a_100000210228_100009813428 [0,1,0,0,0,0|3,0,0]=4 302 B21R2.21291 CCC(C)SCCC(c1ccccc1)c2ccccc2 62a_100000758301_100009813428 [0,1,0,0,0,0|3,0,0]=4 303 B21R2.21291 CCC(C)SCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000758301 [0,1,0,0,0,0|3,0,0]=4 304 B21R2.21291 CCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_100000225621_100000734929 [0,1,0,0,0,0|0,0,0]=1 305 B21R2.21291 CCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100000210202 [0,1,0,0,0,0|0,0,0]=1 306 B21R2.21291 CCN(C)CCOC(c1ccccc1)c2ccccc2 269982a_100000225621_100000734929 [0,1,0,0,0,0|0,0,0]=1 307 B21R2.21291 CCN(C)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100000204670 [0,1,0,0,0,0|0,0,0]=1 308 B21R2.21291 CC[C@H](C)CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100009816398 [0,1,0,0,0,0|3,0,0]=4 309 B21R2.21291 CC[C@H](C)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100009816398 [0,1,0,0,0,0|3,0,0]=4 310 B21R2.21291 CC[C@H](C)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100009816398 [0,1,0,0,0,0|3,0,0]=4 311 B21R2.21291 CC[C@H](C)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100009816398 [0,1,0,0,0,0|3,0,0]=4 312 B21R2.21291 CN(CF)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100015361967 [0,1,0,0,0,0|0,0,0]=1 313 B21R2.21291 CNC(=O)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000737683 [0,1,0,0,0,0|3,0,0]=4 314 B21R2.21291 CNC(=O)CCNC(c1ccccc1)c2ccccc2 2230a_100000738227_100000211591 [0,1,0,0,0,0|3,0,0]=4 315 B21R2.21291 CNC(=O)CCNC(c1ccccc1)c2ccccc2 270004a_100000738227_100000210122 [0,1,0,0,0,0|3,0,0]=4 316 B21R2.21291 CNC(=O)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100012179268 [0,1,0,0,0,0|3,0,0]=4 317 B21R2.21291 CNC(=O)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100012179268 [0,1,0,0,0,0|2,0,0]=3 318 B21R2.21291 CNC(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000737683 [0,1,0,0,0,0|2,0,0]=3 319 B21R2.21291 CNC(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000737683 [0,1,0,0,0,0|3,0,0]=4 320 B21R2.21291 CNC(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000737683 [0,1,0,0,0,0|2,1,0]=4 321 B21R2.21291 CNC(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000737683_100011216954 [0,1,0,0,0,0|2,1,0]=4 322 B21R2.21291 COC(=O)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000204255 [0,1,0,0,0,0|3,0,0]=4 323 B21R2.21291 COC(=O)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000742370 [0,1,0,0,0,0|3,0,0]=4 324 B21R2.21291 COC(=O)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000742370 [0,1,0,0,0,0|2,0,0]=3 325 B21R2.21291 COC(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000204255 [0,1,0,0,0,0|2,0,0]=3 326 B21R2.21291 COC(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000204255 [0,1,0,0,0,0|3,0,0]=4 327 B21R2.21291 COC(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000204255_100011216954 [0,1,0,0,0,0|2,1,0]=4 328 B21R2.21291 COC(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000204255 [0,1,0,0,0,0|2,1,0]=4 329 B21R2.21291 COC(C)CCOC(c1ccccc1)c2ccccc2 7a_100000764861_100011216954 [0,1,0,0,0,0|1,0,0]=2 330 B21R2.21291 COC(C)SCCC(c1ccccc1)c2ccccc2 62a_100009813428_100009879195 [0,1,0,0,0,0|3,0,0]=4 331 B21R2.21291 COC(C)SCCC(c1ccccc1)c2ccccc2 62a_100009879195_100009813428 [0,1,0,0,0,0|3,0,0]=4 332 B21R2.21291 C[C@@H](CO)CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000059175 [0,1,0,0,0,0|3,0,0]=4 333 B21R2.21291 C[C@@H](CO)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000059175 [0,1,0,0,0,0|3,0,0]=4 334 B21R2.21291 C[C@@H](CO)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100000059175 [0,1,0,0,0,0|3,0,0]=4 335 B21R2.21291 C[C@@H](CO)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100000059175 [0,1,0,0,0,0|3,0,0]=4 336 B21R2.21291 C[C@H](CO)NCCC(c1ccccc1)c2ccccc2 2230a_100000737577_100009813428 [0,1,0,0,0,0|3,0,0]=4 337 B21R2.21291 C[C@H](CO)SCCC(c1ccccc1)c2ccccc2 62a_100009813428_100016084084 [0,1,0,0,0,0|3,0,0]=4 338 B21R2.21291 C[C@H](CO)SCCC(c1ccccc1)c2ccccc2 62a_100016084084_100009813428 [0,1,0,0,0,0|3,0,0]=4 339 B21R2.21291 O=C(CO)CCOC(c1ccccc1)c2ccccc2 1458a_100000210174_100000734929 [0,1,0,0,0,0|2,0,0]=3 340 B21R2.32761 CC(=O)C(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011261029 [0,1,0,0,0,0|2,0,1]=4 341 B21R2.32761 CC(=O)C(C)COC(c1ccccc1)c2ccccc2 7a_100000032740_100011216954 [0,1,0,0,0,0|2,0,0]=3 342 B21R2.32761 CC(C)C(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000210198_100009813428 [0,1,0,0,0,0|2,0,1]=4 343 B21R2.32761 CC(C)C(=O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000753385 [0,1,0,0,0,0|2,0,1]=4 344 B21R2.32761 CC(C)C(=O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000753385 [0,1,0,0,0,0|2,0,1]=4 345 B21R2.32761 CC(C)C(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000753385 [0,1,0,0,0,0|1,0,1]=3 346 B21R2.32761 CC(C)C(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000753385 [0,1,0,0,0,0|1,0,1]=3 347 B21R2.32761 CC(C)C(=O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000753385 [0,1,0,0,0,0|2,0,1]=4 348 B21R2.32761 CC(C)C(=O)CSC(c1ccccc1)c2ccccc2 1458a_100000683935_100000210206 [0,1,0,0,0,0|1,1,1]=4 349 B21R2.32761 CC(C)C(=O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000753385 [0,1,0,0,0,0|1,1,1]=4 350 B21R2.32761 CC(C)C(=O)CSC(c1ccccc1)c2ccccc2 62a_100000753385_100011216954 [0,1,0,0,0,0|1,1,1]=4 351 B21R2.32761 CC(C)C(O)CNC(c1ccccc1)c2ccccc2 2230a_100000759067_100000211591 [0,1,0,0,0,0|2,0,0]=3 352 B21R2.32761 CC(C)C(O)CNC(c1ccccc1)c2ccccc2 270004a_100000759067_100000210122 [0,1,0,0,0,0|2,0,0]=3 353 B21R2.32761 CC(C)C(O)CNC(c1ccccc1)c2ccccn2 270004a_100000759067_100000210380 [0,1,0,0,0,0|3,0,0]=4 354 B21R2.32761 CC(C)C(O)CNC(c1ccccc1)c2cccnc2 270004a_100000759067_100000735413 [0,1,0,0,0,0|3,0,0]=4 355 B21R2.32761 CC(C)N(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000210206 [0,1,0,0,0,0|3,0,0]=4 356 B21R2.32761 CC(C)N(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000210206 [0,1,0,0,0,0|3,0,0]=4 357 B21R2.32761 CC(C)N(C)CCC(c1ccccc1)c2ccccc2 269982a_200000211004_100009813428 [0,1,0,0,0,0|3,0,0]=4 358 B21R2.32761 CC(C)N(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000210206 [0,1,0,0,0,0|3,0,0]=4 359 B21R2.32761 CC(COC(c1ccccc1)c2ccccc2)[N+](=O)[O-] 7a_100000039676_100011216954 [0,1,0,0,0,0|2,0,1]=4 360 B21R2.32761 CN(C)C(=O)CCP(c1ccccc1)c2ccccc2 1626a_100102631434_100020644332 [0,1,0,0,0,0|2,0,1]=4 361 B21R2.32761 CN(C)C(=O)CCP(c1ccccc1)c2ccccc2 240690a_100102631434_100020644332 [0,1,0,0,0,0|2,0,1]=4 362 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000185267 [0,1,0,0,0,0|1,0,1]=3 363 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2ccccc2 2230a_100015183351_100000211591 [0,1,0,0,0,0|1,0,1]=3 364 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2ccccc2 270004a_100015183351_100000210122 [0,1,0,0,0,0|1,0,1]=3 365 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000692301 [0,1,0,0,0,0|1,0,1]=3 366 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000185267 [0,1,0,0,0,0|2,0,1]=4 367 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2ccccn2 270004a_100015183351_100000210380 [0,1,0,0,0,0|2,0,1]=4 368 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000185267 [0,1,0,0,0,0|2,0,1]=4 369 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2cccnc2 270004a_100015183351_100000735413 [0,1,0,0,0,0|2,0,1]=4 370 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000185267 [0,1,0,0,0,0|2,0,1]=4 371 B21R2.32761 CN(C)C(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000692301 [0,1,0,0,0,0|0,0,1]=2 372 B21R2.32761 CN(C)C(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000692301 [0,1,0,0,0,0|0,0,1]=2 373 B21R2.32761 CN(C)C(=O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000692301 [0,1,0,0,0,0|1,0,1]=3 374 B21R2.32761 CN(C)C(=O)CSC(c1ccccc1)c2ccccc2 11a_100102631434_100000683935 [0,1,0,0,0,0|0,1,1]=3 375 B21R2.32761 CN(C)C(=O)CSC(c1ccccc1)c2ccccc2 1626a_100102631434_100000683935 [0,1,0,0,0,0|0,1,1]=3 376 B21R2.32761 CN(C)C(=O)CSC(c1ccccc1)c2ccccc2 240690a_100102631434_100000683935 [0,1,0,0,0,0|0,1,1]=3 377 B21R2.32761 CN(C)C(=O)CSC(c1ccccc1)c2ccccc2 527a_100102631434_100000683935 [0,1,0,0,0,0|0,1,1]=3 378 B21R2.32761 CN(C)C(=O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000692301 [0,1,0,0,0,0|0,1,1]=3 379 B21R2.32761 CN(C)C(=O)CSC(c1ccccc1)c2ccccc2 62a_100000692301_100011216954 [0,1,0,0,0,0|0,1,1]=3 380 B21R2.32761 CN(C)C(=O)NCC(c1ccccc1)c2ccccc2 2708a_100000739227_100102631434 [0,1,0,0,0,0|2,0,1]=4 381 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000755188 [0,1,0,0,0,0|2,0,0]=3 382 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2ccccc2 2230a_100000738805_100000211591 [0,1,0,0,0,0|2,0,0]=3 383 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2ccccc2 270004a_100000738805_100000210122 [0,1,0,0,0,0|2,0,0]=3 384 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000755188 [0,1,0,0,0,0|2,0,0]=3 385 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000755188 [0,1,0,0,0,0|3,0,0]=4 386 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2ccccn2 270004a_100000738805_100000210380 [0,1,0,0,0,0|3,0,0]=4 387 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000755188 [0,1,0,0,0,0|3,0,0]=4 388 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2cccnc2 270004a_100000738805_100000735413 [0,1,0,0,0,0|3,0,0]=4 389 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000755188 [0,1,0,0,0,0|3,0,0]=4 390 B21R2.38886 CC(C)(C)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000755188 [0,1,0,0,0,0|1,0,0]=2 391 B21R2.38886 CC(C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000755188 [0,1,0,0,0,0|1,0,0]=2 392 B21R2.38886 CC(C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000765024_100011216954 [0,1,0,0,0,0|1,0,0]=2 393 B21R2.38886 CC(C)(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000755188 [0,1,0,0,0,0|2,0,0]=3 394 B21R2.38886 CC(C)(C)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000755188 [0,1,0,0,0,0|1,1,0]=3 395 B21R2.38886 CC(C)(C)CCSC(c1ccccc1)c2ccccc2 62a_100000755188_100011216954 [0,1,0,0,0,0|1,1,0]=3 396 B21R2.38886 CC(C)(C)CNCC(c1ccccc1)c2ccccc2 270004a_100000739227_100011204126 [0,1,0,0,0,0|3,0,0]=4 397 B21R2.38886 CC(C)(C)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011219605 [0,1,0,0,0,0|3,0,0]=4 398 B21R2.38886 CC(C)(C)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100011219605 [0,1,0,0,0,0|3,0,0]=4 399 B21R2.38886 CC(C)(C)NCCC(c1ccccc1)c2ccccc2 2230a_100000715429_100009813428 [0,1,0,0,0,0|3,0,0]=4 400 B21R2.38886 CC(C)(C)NCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000210625 [0,1,0,0,0,0|3,0,0]=4 401 B21R2.38886 CC(C)(C)OCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210625 [0,1,0,0,0,0|3,0,0]=4 402 B21R2.38886 CC(C)(C)OCCC(c1ccccc1)c2ccccc2 34a_100015890283_100009813428 [0,1,0,0,0,0|3,0,0]=4 403 B21R2.38886 CC(C)(C)OCCC(c1ccccc1)c2ccccc2 7a_100015890283_100009813428 [0,1,0,0,0,0|3,0,0]=4 404 B21R2.38886 CC(C)(C)SCCC(c1ccccc1)c2ccccc2 62a_100000211941_100009813428 [0,1,0,0,0,0|3,0,0]=4 405 B21R2.38886 CC(C)(C)SCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000211941 [0,1,0,0,0,0|3,0,0]=4 406 B21R2.38886 CC(C)(F)CCNC(c1ccccc1)c2ccccc2 2230a_100016253952_100000211591 [0,1,0,0,0,0|2,0,0]=3 407 B21R2.38886 CC(C)(F)CCNC(c1ccccc1)c2ccccc2 270004a_100016253952_100000210122 [0,1,0,0,0,0|2,0,0]=3 408 B21R2.38886 CC(C)(F)CCNC(c1ccccc1)c2ccccn2 270004a_100016253952_100000210380 [0,1,0,0,0,0|3,0,0]=4 409 B21R2.38886 CC(C)(F)CCNC(c1ccccc1)c2cccnc2 270004a_100016253952_100000735413 [0,1,0,0,0,0|3,0,0]=4 410 B21R2.38886 CC(C)(F)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011997219 [0,1,0,0,0,0|3,0,0]=4 411 B21R2.38886 CC(C)(F)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100011997219 [0,1,0,0,0,0|3,0,0]=4 412 B21R2.38886 CC(C)(O)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000702414 [0,1,0,0,0,0|2,0,0]=3 413 B21R2.38886 CC(C)(O)CCNC(c1ccccc1)c2ccccc2 270004a_100000707701_100000210122 [0,1,0,0,0,0|2,0,0]=3 414 B21R2.38886 CC(C)(O)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000702414 [0,1,0,0,0,0|2,0,0]=3 415 B21R2.38886 CC(C)(O)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000702414 [0,1,0,0,0,0|3,0,0]=4 416 B21R2.38886 CC(C)(O)CCNC(c1ccccc1)c2ccccn2 270004a_100000707701_100000210380 [0,1,0,0,0,0|3,0,0]=4 417 B21R2.38886 CC(C)(O)CCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000702414 [0,1,0,0,0,0|3,0,0]=4 418 B21R2.38886 CC(C)(O)CCNC(c1ccccc1)c2cccnc2 270004a_100000707701_100000735413 [0,1,0,0,0,0|3,0,0]=4 419 B21R2.38886 CC(C)(O)CCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000702414 [0,1,0,0,0,0|3,0,0]=4 420 B21R2.38886 CC(C)(O)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000702414 [0,1,0,0,0,0|1,0,0]=2 421 B21R2.38886 CC(C)(O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000702414 [0,1,0,0,0,0|1,0,0]=2 422 B21R2.38886 CC(C)(O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000702414 [0,1,0,0,0,0|2,0,0]=3 423 B21R2.38886 CC(C)(O)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000702414 [0,1,0,0,0,0|1,1,0]=3 424 B21R2.38886 CC(C)(O)CCSC(c1ccccc1)c2ccccc2 62a_100000702414_100011216954 [0,1,0,0,0,0|1,1,0]=3 425 B21R2.38886 CC(C)(O)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000764493 [0,1,0,0,0,0|3,0,0]=4 426 B21R2.38886 CC(C)(O)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100000764493 [0,1,0,0,0,0|3,0,0]=4 427 B21R2.38886 CC(C)(O)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100000764493 [0,1,0,0,0,0|3,0,0]=4 428 B21R2.38886 CS(=O)(=O)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000731031 [0,1,0,0,0,0|3,0,0]=4 429 B21R2.38886 CS(=O)(=O)CCNC(c1ccccc1)c2ccccc2 2230a_100000740961_100000211591 [0,1,0,0,0,0|3,0,0]=4 430 B21R2.38886 CS(=O)(=O)CCNC(c1ccccc1)c2ccccc2 270004a_100000740961_100000210122 [0,1,0,0,0,0|3,0,0]=4 431 B21R2.38886 CS(=O)(=O)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000731031 [0,1,0,0,0,0|3,0,0]=4 432 B21R2.38886 CS(=O)(=O)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000731031 [0,1,0,0,0,0|2,0,0]=3 433 B21R2.38886 CS(=O)(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000230027 [0,1,0,0,0,0|2,0,0]=3 434 B21R2.38886 CS(=O)(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211924_100011216954 [0,1,0,0,0,0|2,0,0]=3 435 B21R2.38886 CS(=O)(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000230027 [0,1,0,0,0,0|3,0,0]=4 436 B21R2.38886 CS(=O)(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000230027 [0,1,0,0,0,0|2,1,0]=4 437 B21R2.38886 CS(=O)(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000731031_100011216954 [0,1,0,0,0,0|2,1,0]=4 438 B21R2.38886 C[N+](C)(C)CCNC(c1ccccc1)c2ccccc2 270004a_100000106457_100000210122 [0,1,0,0,0,0|1,0,1]=3 439 B21R2.38886 C[N+](C)(C)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000085578 [0,1,0,0,0,0|1,0,1]=3 440 B21R2.38886 C[N+](C)(C)CCNC(c1ccccc1)c2ccccn2 270004a_100000106457_100000210380 [0,1,0,0,0,0|2,0,1]=4 441 B21R2.38886 C[N+](C)(C)CCNC(c1ccccc1)c2cccnc2 270004a_100000106457_100000735413 [0,1,0,0,0,0|2,0,1]=4 442 B21R2.38886 C[N+](C)(C)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000085578 [0,1,0,0,0,0|0,0,1]=2 443 B21R2.38886 C[N+](C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000085578 [0,1,0,0,0,0|0,0,1]=2 444 B21R2.38886 C[N+](C)(C)CCOC(c1ccccc1)c2ccccc2 7a_200020618287_100011216954 [0,1,0,0,0,0|0,0,1]=2 445 B21R2.38886 C[N+](C)(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000085578 [0,1,0,0,0,0|1,0,1]=3 446 B21R2.38886 C[N+](C)(C)CCSC(c1ccccc1)c2ccccc2 62a_100000085578_100011216954 [0,1,0,0,0,0|0,1,1]=3 447 B21R2.38886 C[N+](C)(C)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000085578 [0,1,0,0,0,0|0,1,1]=3 448 B21R2.38886 C[Si](C)(C)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_200000733723 [0,1,0,0,0,0|2,0,0]=3 449 B21R2.38886 C[Si](C)(C)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_200000733723 [0,1,0,0,0,0|2,0,0]=3 450 B21R2.38886 C[Si](C)(C)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_200000733723 [0,1,0,0,0,0|3,0,0]=4 451 B21R2.38886 C[Si](C)(C)CCNC(c1ccccc1)c2cccnc2 2230a_100011232609_200000733723 [0,1,0,0,0,0|3,0,0]=4 452 B21R2.38886 C[Si](C)(C)CCNC(c1ccccc1)c2ccncc2 2230a_100025760769_200000733723 [0,1,0,0,0,0|3,0,0]=4 453 B21R2.38886 C[Si](C)(C)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_200000733723 [0,1,0,0,0,0|1,0,0]=2 454 B21R2.38886 C[Si](C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000039746_100011216954 [0,1,0,0,0,0|1,0,0]=2 455 B21R2.38886 C[Si](C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_200000733723 [0,1,0,0,0,0|1,0,0]=2 456 B21R2.38886 C[Si](C)(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_200000733723 [0,1,0,0,0,0|2,0,0]=3 457 B21R2.38886 C[Si](C)(C)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_200000733723 [0,1,0,0,0,0|1,1,0]=3 458 B21R2.38886 C[Si](C)(C)CCSC(c1ccccc1)c2ccccc2 62a_200000733723_100011216954 [0,1,0,0,0,0|1,1,0]=3 459 B21R2.38886 C[Si](C)(C)CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000037933 [0,1,0,0,0,0|3,0,0]=4 460 B21R2.38886 C[Si](C)(C)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100000233785 [0,1,0,0,0,0|3,0,0]=4 461 B21R2.38886 FC(F)(F)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011219754 [0,1,0,0,0,0|3,0,0]=4 462 B21R2.38886 FC(F)(F)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011219754 [0,1,0,0,0,0|3,0,0]=4 463 B21R2.38886 O=S(=O)([O-])CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000762736 [0,1,0,0,0,0|3,0,0]=4 464 B21R2.97772 CC(C)CC(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_100000210624 [0,1,0,0,0,0|2,0,1]=4 465 B21R2.97772 CC(C)CC(=O)NC(c1ccccc1)c2ccccc2 11a_100000162943_100000210554 [0,1,0,0,0,0|2,0,1]=4 466 B21R2.97772 CC(C)CC(=O)NC(c1ccccc1)c2ccccc2 1626a_100000162943_100000210554 [0,1,0,0,0,0|2,0,1]=4 467 B21R2.97772 CC(C)CC(=O)NC(c1ccccc1)c2ccccc2 240690a_100000162943_100000210554 [0,1,0,0,0,0|2,0,1]=4 468 B21R2.97772 CC(C)CC(=O)NC(c1ccccc1)c2ccccc2 527a_100000162943_100000210554 [0,1,0,0,0,0|2,0,1]=4 469 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2ccccc2 2230a_100000162943_100000731052 [0,1,0,0,0,0|2,0,0]=3 470 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2ccccc2 2230a_100000692259_100000211591 [0,1,0,0,0,0|2,0,0]=3 471 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2ccccc2 270004a_100000692259_100000210122 [0,1,0,0,0,0|2,0,0]=3 472 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2ccccc2 34a_100000162943_100000731052 [0,1,0,0,0,0|2,0,0]=3 473 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2ccccn2 2230a_100000689936_100000731052 [0,1,0,0,0,0|3,0,0]=4 474 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2ccccn2 270004a_100000692259_100000210380 [0,1,0,0,0,0|3,0,0]=4 475 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2cccnc2 2230a_100011232609_100000731052 [0,1,0,0,0,0|3,0,0]=4 476 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2cccnc2 270004a_100000692259_100000735413 [0,1,0,0,0,0|3,0,0]=4 477 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2ccncc2 2230a_100025760769_100000731052 [0,1,0,0,0,0|3,0,0]=4 478 B21R2.97772 CC(C)CC(C)OC(c1ccccc1)c2ccccc2 34a_100000211180_100000731052 [0,1,0,0,0,0|1,0,0]=2 479 B21R2.97772 CC(C)CC(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_100000731052 [0,1,0,0,0,0|1,0,0]=2 480 B21R2.97772 CC(C)CC(C)OC(c1ccccc1)c2ccccc2 7a_100000211805_100011216954 [0,1,0,0,0,0|1,0,0]=2 481 B21R2.97772 CC(C)CC(C)OC(c1ccccc1)c2ccccn2 7a_100000180852_100000731052 [0,1,0,0,0,0|2,0,0]=3 482 B21R2.97772 CC(C)CC(C)SC(c1ccccc1)c2ccccc2 62a_100000211591_100000731052 [0,1,0,0,0,0|1,1,0]=3 483 B21R2.97772 CC(C)CC(C)SC(c1ccccc1)c2ccccc2 62a_100000731052_100011216954 [0,1,0,0,0,0|1,1,0]=3 484 B21R2.97772 CC(CN(C)C)SC(c1ccccc1)c2ccccc2 62a_100000211591_100020606517 [0,1,0,0,0,0|0,1,0]=2 485 B21R2.97772 CC(CN(C)C)SC(c1ccccc1)c2ccccc2 62a_100020606517_100011216954 [0,1,0,0,0,0|0,1,0]=2 486 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccccc2 11a_100000162943_100000750896 [0,1,0,0,0,0|1,0,1]=3 487 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccccc2 240690a_100000162943_100000750896 [0,1,0,0,0,0|1,0,1]=3 488 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccccc2 527a_100000162943_100000750896 [0,1,0,0,0,0|1,0,1]=3 489 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccccn2 11a_100000689936_100000750896 [0,1,0,0,0,0|2,0,1]=4 490 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccccn2 240690a_100000689936_100000750896 [0,1,0,0,0,0|2,0,1]=4 491 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccccn2 527a_100000689936_100000750896 [0,1,0,0,0,0|2,0,1]=4 492 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2cccnc2 11a_100011232609_100000750896 [0,1,0,0,0,0|2,0,1]=4 493 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2cccnc2 240690a_100011232609_100000750896 [0,1,0,0,0,0|2,0,1]=4 494 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2cccnc2 527a_100011232609_100000750896 [0,1,0,0,0,0|2,0,1]=4 495 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccncc2 11a_100025760769_100000750896 [0,1,0,0,0,0|2,0,1]=4 496 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccncc2 240690a_100025760769_100000750896 [0,1,0,0,0,0|2,0,1]=4 497 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccncc2 527a_100025760769_100000750896 [0,1,0,0,0,0|2,0,1]=4 498 B21R2.97772 C[S+](C)CC(=O)NC(c1ccccc1)c2ccccc2 11a_100000162943_200159257847 [0,1,0,0,0,0|2,0,1]=4 499 B21R2.97772 C[S+](C)CC(=O)NC(c1ccccc1)c2ccccc2 1626a_100000162943_200159257847 [0,1,0,0,0,0|2,0,1]=4 500 B21R2.97772 C[S+](C)CC(=O)NC(c1ccccc1)c2ccccc2 240690a_100000162943_200159257847 [0,1,0,0,0,0|2,0,1]=4 501 B21R2.97772 C[S+](C)CC(=O)NC(c1ccccc1)c2ccccc2 527a_100000162943_200159257847 [0,1,0,0,0,0|2,0,1]=4 502 B21R2.103739 C=C(C)CCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000730704 [0,1,0,0,0,0|2,0,1]=4 503 B21R2.103739 C=C(C)CCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000730704 [0,1,0,0,0,0|2,0,1]=4 504 B21R2.103739 C=C(C)CCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000730704 [0,1,0,0,0,0|2,0,1]=4 505 B21R2.103739 C=C(C)CCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000730704 [0,1,0,0,0,0|2,0,1]=4 506 B21R2.103739 C=C(C)CCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000730704 [0,1,0,0,0,0|2,0,1]=4 507 B21R2.103739 C=C(C)CCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000730704 [0,1,0,0,0,0|2,0,1]=4 508 B21R2.103739 C=C(C)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000730704 [0,1,0,0,0,0|1,0,1]=3 509 B21R2.103739 C=C(C)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000730704 [0,1,0,0,0,0|1,0,1]=3 510 B21R2.103739 C=C(C)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000730704 [0,1,0,0,0,0|1,0,1]=3 511 B21R2.103739 C=C(C)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000730704 [0,1,0,0,0,0|1,0,1]=3 512 B21R2.103739 CC(=CCNC(c1ccccc1)c2cccc(c2)Br)C 2230a_100011212009_100000761012 [0,1,0,0,0,0|2,0,1]=4 513 B21R2.103739 CC(=CCNC(c1ccccc1)c2cccc(c2)Br)C 270004a_100000718196_100011267660 [0,1,0,0,0,0|2,0,1]=4 514 B21R2.103739 CC(=CCNC(c1ccccc1)c2cccc(c2)Br)C 34a_100011212009_100000761012 [0,1,0,0,0,0|2,0,1]=4 515 B21R2.103739 CC(=CCNC(c1ccccc1)c2cccc(c2)C)C 270004a_100000718196_100011217825 [0,1,0,0,0,0|2,0,1]=4 516 B21R2.103739 CC(=CCNC(c1ccccc1)c2cccc(c2)Cl)C 2230a_100000741085_100000761012 [0,1,0,0,0,0|2,0,1]=4 517 B21R2.103739 CC(=CCNC(c1ccccc1)c2cccc(c2)Cl)C 270004a_100000718196_100011215489 [0,1,0,0,0,0|2,0,1]=4 518 B21R2.103739 CC(=CCNC(c1ccccc1)c2cccc(c2)Cl)C 34a_100000741085_100000761012 [0,1,0,0,0,0|2,0,1]=4 519 B21R2.103739 CC(=CCNC(c1ccccc1)c2cccc(c2)F)C 2230a_100000686443_100000761012 [0,1,0,0,0,0|2,0,1]=4 520 B21R2.103739 CC(=CCNC(c1ccccc1)c2cccc(c2)F)C 270004a_100000718196_200011219850 [0,1,0,0,0,0|2,0,1]=4 521 B21R2.103739 CC(=CCNC(c1ccccc1)c2cccc(c2)F)C 34a_100000686443_100000761012 [0,1,0,0,0,0|2,0,1]=4 522 B21R2.103739 CC(=CCOC(c1ccccc1)c2cccc(c2)Cl)C 34a_100000733576_100000761012 [0,1,0,0,0,0|1,0,1]=3 523 B21R2.103739 CC(=CCOC(c1ccccc1)c2cccc(c2)Cl)C 7a_100000733576_100000761012 [0,1,0,0,0,0|1,0,1]=3 524 B21R2.103739 CC(=CCOC(c1ccccc1)c2cccc(c2)F)C 34a_100000749007_100000761012 [0,1,0,0,0,0|1,0,1]=3 525 B21R2.103739 CC(=CCOC(c1ccccc1)c2cccc(c2)F)C 7a_100000749007_100000761012 [0,1,0,0,0,0|1,0,1]=3 526 B21R2.103739 CC(=O)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000053229 [0,1,0,0,0,0|2,0,0]=3 527 B21R2.103739 CC(=O)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000053229 [0,1,0,0,0,0|2,0,0]=3 528 B21R2.103739 CC(=O)OCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100009813279 [0,1,0,0,0,0|3,0,0]=4 529 B21R2.103739 CC(=O)OCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100009813279 [0,1,0,0,0,0|3,0,0]=4 530 B21R2.103739 CC(C)CCNC(c1cccc(c1)Cl)c2ccccn2 270004a_100000210545_100000688346 [0,1,0,0,0,0|3,0,0]=4 531 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000210312 [0,1,0,0,0,0|2,0,0]=3 532 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)Br 269862a_100011212009_100000185833 [0,1,0,0,0,0|2,0,0]=3 533 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)Br 270004a_100000210545_100011267660 [0,1,0,0,0,0|2,0,0]=3 534 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000210312 [0,1,0,0,0,0|2,0,0]=3 535 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000210312 [0,1,0,0,0,0|2,0,0]=3 536 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)Cl 269862a_100000741085_100000185833 [0,1,0,0,0,0|2,0,0]=3 537 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000210545_100011215489 [0,1,0,0,0,0|2,0,0]=3 538 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000210312 [0,1,0,0,0,0|2,0,0]=3 539 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000210312 [0,1,0,0,0,0|2,0,0]=3 540 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)F 269862a_100000686443_100000185833 [0,1,0,0,0,0|2,0,0]=3 541 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)F 270004a_100000210545_200011219850 [0,1,0,0,0,0|2,0,0]=3 542 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000210312 [0,1,0,0,0,0|2,0,0]=3 543 B21R2.103739 CC(C)CCNC(c1ccccc1)c2cncc(c2)Br 270004a_100000210545_100011267668 [0,1,0,0,0,0|3,0,0]=4 544 B21R2.103739 CC(C)CCNC(c1cccnc1)c2cccc(c2)Cl 270004a_100000210545_100000752423 [0,1,0,0,0,0|3,0,0]=4 545 B21R2.103739 CC(C)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000210312 [0,1,0,0,0,0|1,0,0]=2 546 B21R2.103739 CC(C)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000210626 [0,1,0,0,0,0|1,0,0]=2 547 B21R2.103739 CC(C)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000210312 [0,1,0,0,0,0|1,0,0]=2 548 B21R2.103739 CC(C)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000210626 [0,1,0,0,0,0|1,0,0]=2 549 B21R2.103739 CC(C)OCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000709892 [0,1,0,0,0,0|3,0,0]=4 550 B21R2.103739 CC(C)OCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000709892 [0,1,0,0,0,0|3,0,0]=4 551 B21R2.103739 CC(C)OCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000709892 [0,1,0,0,0,0|3,0,0]=4 552 B21R2.103739 CC(C)OCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000709892 [0,1,0,0,0,0|3,0,0]=4 553 B21R2.103739 CC(C)OCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000709892 [0,1,0,0,0,0|3,0,0]=4 554 B21R2.103739 CC(C)OCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000709892 [0,1,0,0,0,0|3,0,0]=4 555 B21R2.103739 CC(C)OCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000709892 [0,1,0,0,0,0|2,0,0]=3 556 B21R2.103739 CC(C)OCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000709892 [0,1,0,0,0,0|2,0,0]=3 557 B21R2.103739 CC(O)CCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100012276601 [0,1,0,0,0,0|3,0,0]=4 558 B21R2.103739 CC(O)CCNC(c1ccccc1)c2cccc(c2)Br 270004a_200000755665_100011267660 [0,1,0,0,0,0|3,0,0]=4 559 B21R2.103739 CC(O)CCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100012276601 [0,1,0,0,0,0|3,0,0]=4 560 B21R2.103739 CC(O)CCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100012276601 [0,1,0,0,0,0|3,0,0]=4 561 B21R2.103739 CC(O)CCNC(c1ccccc1)c2cccc(c2)Cl 270004a_200000755665_100011215489 [0,1,0,0,0,0|3,0,0]=4 562 B21R2.103739 CC(O)CCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100012276601 [0,1,0,0,0,0|3,0,0]=4 563 B21R2.103739 CC(O)CCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100012276601 [0,1,0,0,0,0|3,0,0]=4 564 B21R2.103739 CC(O)CCNC(c1ccccc1)c2cccc(c2)F 270004a_200000755665_200011219850 [0,1,0,0,0,0|3,0,0]=4 565 B21R2.103739 CC(O)CCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100012276601 [0,1,0,0,0,0|3,0,0]=4 566 B21R2.103739 CC(O)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100012276601 [0,1,0,0,0,0|2,0,0]=3 567 B21R2.103739 CC(O)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100012276601 [0,1,0,0,0,0|2,0,0]=3 568 B21R2.103739 CC(O)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100012276601 [0,1,0,0,0,0|2,0,0]=3 569 B21R2.103739 CC(O)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100012276601 [0,1,0,0,0,0|2,0,0]=3 570 B21R2.103739 CN(C)CCNC(c1cccc(c1)Cl)c2ccccn2 270004a_100000210585_100000688346 [0,1,0,0,0,0|2,0,0]=3 571 B21R2.103739 CN(C)CCNC(c1ccccc1)c2cccc(c2)Br 270004a_100000210585_100011267660 [0,1,0,0,0,0|1,0,0]=2 572 B21R2.103739 CN(C)CCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000210585_100011215489 [0,1,0,0,0,0|1,0,0]=2 573 B21R2.103739 CN(C)CCNC(c1ccccc1)c2cccc(c2)F 270004a_100000210585_200011219850 [0,1,0,0,0,0|1,0,0]=2 574 B21R2.103739 CN(C)CCNC(c1ccccc1)c2cncc(c2)Br 270004a_100000210585_100011267668 [0,1,0,0,0,0|2,0,0]=3 575 B21R2.103739 CN(C)CCNC(c1cccnc1)c2cccc(c2)Cl 270004a_100000210585_100000752423 [0,1,0,0,0,0|2,0,0]=3 576 B21R2.103739 CN(C)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000755713 [0,1,0,0,0,0|0,0,0]=1 577 B21R2.103739 CN(C)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000755713 [0,1,0,0,0,0|0,0,0]=1 578 B21R2.103739 Cc1cccc(c1)C(NCCC(C)C)c2ccccc2 270004a_100000210545_100011217825 [0,1,0,0,0,0|2,0,0]=3 579 B21R2.103739 Cc1cccc(c1)C(NCCC(C)O)c2ccccc2 270004a_200000755665_100011217825 [0,1,0,0,0,0|3,0,0]=4 580 B21R2.103739 Cc1cccc(c1)C(NCCN(C)C)c2ccccc2 270004a_100000210585_100011217825 [0,1,0,0,0,0|1,0,0]=2 581 B21R2.103739 NC(=O)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000731001 [0,1,0,0,0,0|3,0,0]=4 582 B21R2.103739 NC(=O)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000744528 [0,1,0,0,0,0|3,0,0]=4 583 B21R2.103739 NC(=O)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000731001 [0,1,0,0,0,0|3,0,0]=4 584 B21R2.103739 NC(=O)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000744528 [0,1,0,0,0,0|3,0,0]=4 585 B21R2.205989 C=C(C)CCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000730704 [0,1,0,0,0,0|2,0,1]=4 586 B21R2.205989 C=C(C)CCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000730704 [0,1,0,0,0,0|2,0,1]=4 587 B21R2.205989 C=C(C)CCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000730704 [0,1,0,0,0,0|2,0,1]=4 588 B21R2.205989 C=C(C)CCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000730704 [0,1,0,0,0,0|2,0,1]=4 589 B21R2.205989 C=C(C)CCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000730704 [0,1,0,0,0,0|1,0,1]=3 590 B21R2.205989 C=C(C)CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000730704 [0,1,0,0,0,0|1,0,1]=3 591 B21R2.205989 C=C(C)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000730704 [0,1,0,0,0,0|1,0,1]=3 592 B21R2.205989 C=C(C)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000730704 [0,1,0,0,0,0|1,0,1]=3 593 B21R2.205989 C=C(C)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000730704 [0,1,0,0,0,0|1,0,1]=3 594 B21R2.205989 C=C(C)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000730704 [0,1,0,0,0,0|1,0,1]=3 595 B21R2.205989 C=C(C)CCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000730704 [0,1,0,0,0,0|1,1,1]=4 596 B21R2.205989 C=C(C)CCSC(c1ccccc1)c2ccccc2C 62a_100000730704_100000230135 [0,1,0,0,0,0|1,1,1]=4 597 B21R2.205989 CC(=CCNC(c1ccccc1)c2ccccc2Br)C 2230a_100011211563_100000761012 [0,1,0,0,0,0|2,0,1]=4 598 B21R2.205989 CC(=CCNC(c1ccccc1)c2ccccc2Br)C 270004a_100000718196_100000198044 [0,1,0,0,0,0|2,0,1]=4 599 B21R2.205989 CC(=CCNC(c1ccccc1)c2ccccc2Br)C 34a_100011211563_100000761012 [0,1,0,0,0,0|2,0,1]=4 600 B21R2.205989 CC(=CCNC(c1ccccc1)c2ccccc2C)C 2230a_100000222801_100000761012 [0,1,0,0,0,0|2,0,1]=4 601 B21R2.205989 CC(=CCNC(c1ccccc1)c2ccccc2C)C 270004a_100000718196_100000735561 [0,1,0,0,0,0|2,0,1]=4 602 B21R2.205989 CC(=CCNC(c1ccccc1)c2ccccc2C)C 34a_100000222801_100000761012 [0,1,0,0,0,0|2,0,1]=4 603 B21R2.205989 CC(=CCNC(c1ccccc1)c2ccccc2Cl)C 270004a_100000718196_100011215288 [0,1,0,0,0,0|2,0,1]=4 604 B21R2.205989 CC(=CCNC(c1ccccc1)c2ccccc2F)C 270004a_100000718196_100011217773 [0,1,0,0,0,0|2,0,1]=4 605 B21R2.205989 CC(=CCOC(c1ccccc1)c2ccccc2C)C 34a_100000212071_100000761012 [0,1,0,0,0,0|1,0,1]=3 606 B21R2.205989 CC(=CCOC(c1ccccc1)c2ccccc2C)C 7a_100000212071_100000761012 [0,1,0,0,0,0|1,0,1]=3 607 B21R2.205989 CC(=CCOC(c1ccccc1)c2ccccc2Cl)C 34a_200011400577_100000761012 [0,1,0,0,0,0|1,0,1]=3 608 B21R2.205989 CC(=CCOC(c1ccccc1)c2ccccc2Cl)C 7a_200011400577_100000761012 [0,1,0,0,0,0|1,0,1]=3 609 B21R2.205989 CC(=CCOC(c1ccccc1)c2ccccc2N)C 34a_100000246470_100000761012 [0,1,0,0,0,0|1,0,1]=3 610 B21R2.205989 CC(=CCOC(c1ccccc1)c2ccccc2N)C 7a_100000246470_100000761012 [0,1,0,0,0,0|1,0,1]=3 611 B21R2.205989 CC(=CCSC(c1ccccc1)c2ccccc2C)C 62a_100000230135_100000761012 [0,1,0,0,0,0|1,1,1]=4 612 B21R2.205989 CC(=CCSC(c1ccccc1)c2ccccc2C)C 62a_100000761012_100000230135 [0,1,0,0,0,0|1,1,1]=4 613 B21R2.205989 CC(=O)CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000053229 [0,1,0,0,0,0|2,0,0]=3 614 B21R2.205989 CC(=O)CCOC(c1ccccc1)c2ccccc2C 7a_100000759926_100000230135 [0,1,0,0,0,0|2,0,0]=3 615 B21R2.205989 CC(=O)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000053229 [0,1,0,0,0,0|2,0,0]=3 616 B21R2.205989 CC(=O)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000053229 [0,1,0,0,0,0|2,0,0]=3 617 B21R2.205989 CC(=O)CCSC(c1ccccc1)c2ccccc2C 62a_100000053229_100000230135 [0,1,0,0,0,0|2,1,0]=4 618 B21R2.205989 CC(=O)CCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000053229 [0,1,0,0,0,0|2,1,0]=4 619 B21R2.205989 CC(=O)OCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100009813279 [0,1,0,0,0,0|3,0,0]=4 620 B21R2.205989 CC(=O)OCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100009813279 [0,1,0,0,0,0|3,0,0]=4 621 B21R2.205989 CC(=O)OCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100009813279 [0,1,0,0,0,0|3,0,0]=4 622 B21R2.205989 CC(C)CCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000210312 [0,1,0,0,0,0|2,0,0]=3 623 B21R2.205989 CC(C)CCNC(c1ccccc1)c2ccccc2Br 269862a_100011211563_100000185833 [0,1,0,0,0,0|2,0,0]=3 624 B21R2.205989 CC(C)CCNC(c1ccccc1)c2ccccc2Br 270004a_100000210545_100000198044 [0,1,0,0,0,0|2,0,0]=3 625 B21R2.205989 CC(C)CCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000210312 [0,1,0,0,0,0|2,0,0]=3 626 B21R2.205989 CC(C)CCNC(c1ccccc1)c2ccccc2Cl 270004a_100000210545_100011215288 [0,1,0,0,0,0|2,0,0]=3 627 B21R2.205989 CC(C)CCNC(c1ccccc1)c2ccccc2F 270004a_100000210545_100011217773 [0,1,0,0,0,0|2,0,0]=3 628 B21R2.205989 CC(C)CCNC(c1ccccn1)c2ccccc2Cl 270004a_100000210545_100011400554 [0,1,0,0,0,0|3,0,0]=4 629 B21R2.205989 CC(C)CCNC(c1cccnc1)c2ccccc2Br 270004a_100000210545_100011532686 [0,1,0,0,0,0|3,0,0]=4 630 B21R2.205989 CC(C)CCNC(c1cccnc1)c2ccccc2Cl 270004a_100000210545_200011400555 [0,1,0,0,0,0|3,0,0]=4 631 B21R2.205989 CC(C)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000210312 [0,1,0,0,0,0|1,0,0]=2 632 B21R2.205989 CC(C)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000210626 [0,1,0,0,0,0|1,0,0]=2 633 B21R2.205989 CC(C)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000210312 [0,1,0,0,0,0|1,0,0]=2 634 B21R2.205989 CC(C)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000210626 [0,1,0,0,0,0|1,0,0]=2 635 B21R2.205989 CC(C)OCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000709892 [0,1,0,0,0,0|3,0,0]=4 636 B21R2.205989 CC(C)OCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000709892 [0,1,0,0,0,0|3,0,0]=4 637 B21R2.205989 CC(C)OCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000709892 [0,1,0,0,0,0|2,0,0]=3 638 B21R2.205989 CC(C)OCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000709892 [0,1,0,0,0,0|2,0,0]=3 639 B21R2.205989 CC(O)CCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100012276601 [0,1,0,0,0,0|3,0,0]=4 640 B21R2.205989 CC(O)CCNC(c1ccccc1)c2ccccc2Br 270004a_200000755665_100000198044 [0,1,0,0,0,0|3,0,0]=4 641 B21R2.205989 CC(O)CCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100012276601 [0,1,0,0,0,0|3,0,0]=4 642 B21R2.205989 CC(O)CCNC(c1ccccc1)c2ccccc2Cl 270004a_200000755665_100011215288 [0,1,0,0,0,0|3,0,0]=4 643 B21R2.205989 CC(O)CCNC(c1ccccc1)c2ccccc2F 270004a_200000755665_100011217773 [0,1,0,0,0,0|3,0,0]=4 644 B21R2.205989 CC(O)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100012276601 [0,1,0,0,0,0|2,0,0]=3 645 B21R2.205989 CC(O)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100012276601 [0,1,0,0,0,0|2,0,0]=3 646 B21R2.205989 CC(O)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100012276601 [0,1,0,0,0,0|2,0,0]=3 647 B21R2.205989 CC(O)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100012276601 [0,1,0,0,0,0|2,0,0]=3 648 B21R2.205989 CN(C)CCNC(c1ccccc1)c2ccccc2Br 270004a_100000210585_100000198044 [0,1,0,0,0,0|1,0,0]=2 649 B21R2.205989 CN(C)CCNC(c1ccccc1)c2ccccc2Cl 270004a_100000210585_100011215288 [0,1,0,0,0,0|1,0,0]=2 650 B21R2.205989 CN(C)CCNC(c1ccccc1)c2ccccc2F 270004a_100000210585_100011217773 [0,1,0,0,0,0|1,0,0]=2 651 B21R2.205989 CN(C)CCNC(c1ccccn1)c2ccccc2Cl 270004a_100000210585_100011400554 [0,1,0,0,0,0|2,0,0]=3 652 B21R2.205989 CN(C)CCNC(c1cccnc1)c2ccccc2Br 270004a_100000210585_100011532686 [0,1,0,0,0,0|2,0,0]=3 653 B21R2.205989 CN(C)CCNC(c1cccnc1)c2ccccc2Cl 270004a_100000210585_200011400555 [0,1,0,0,0,0|2,0,0]=3 654 B21R2.205989 CN(C)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000755713 [0,1,0,0,0,0|0,0,0]=1 655 B21R2.205989 CN(C)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000755713 [0,1,0,0,0,0|0,0,0]=1 656 B21R2.205989 Cc1ccccc1C(NCCC(C)C)c2ccccc2 2230a_100000222801_100000210312 [0,1,0,0,0,0|2,0,0]=3 657 B21R2.205989 Cc1ccccc1C(NCCC(C)C)c2ccccc2 269862a_100000222801_100000185833 [0,1,0,0,0,0|2,0,0]=3 658 B21R2.205989 Cc1ccccc1C(NCCC(C)C)c2ccccc2 270004a_100000210545_100000735561 [0,1,0,0,0,0|2,0,0]=3 659 B21R2.205989 Cc1ccccc1C(NCCC(C)C)c2ccccc2 34a_100000222801_100000210312 [0,1,0,0,0,0|2,0,0]=3 660 B21R2.205989 Cc1ccccc1C(NCCC(C)C)c2ccncc2 2230a_100015184055_100000210312 [0,1,0,0,0,0|3,0,0]=4 661 B21R2.205989 Cc1ccccc1C(NCCC(C)C)c2ccncc2 269862a_100015184055_100000185833 [0,1,0,0,0,0|3,0,0]=4 662 B21R2.205989 Cc1ccccc1C(NCCC(C)O)c2ccccc2 2230a_100000222801_100012276601 [0,1,0,0,0,0|3,0,0]=4 663 B21R2.205989 Cc1ccccc1C(NCCC(C)O)c2ccccc2 2230a_200000755665_100000230135 [0,1,0,0,0,0|3,0,0]=4 664 B21R2.205989 Cc1ccccc1C(NCCC(C)O)c2ccccc2 270004a_200000755665_100000735561 [0,1,0,0,0,0|3,0,0]=4 665 B21R2.205989 Cc1ccccc1C(NCCC(C)O)c2ccccc2 34a_100000222801_100012276601 [0,1,0,0,0,0|3,0,0]=4 666 B21R2.205989 Cc1ccccc1C(NCCN(C)C)c2ccccc2 270004a_100000210585_100000735561 [0,1,0,0,0,0|1,0,0]=2 667 B21R2.205989 Cc1ccccc1C(NCOC(C)C)c2ccccc2 2230a_100000222801_100000709892 [0,1,0,0,0,0|3,0,0]=4 668 B21R2.205989 Cc1ccccc1C(NCOC(C)C)c2ccccc2 34a_100000222801_100000709892 [0,1,0,0,0,0|3,0,0]=4 669 B21R2.205989 Cc1ccccc1C(OCCC(=O)N)c2ccccc2 34a_100000212071_100000731001 [0,1,0,0,0,0|3,0,0]=4 670 B21R2.205989 Cc1ccccc1C(OCCC(=O)N)c2ccccc2 7a_100000212071_100000744528 [0,1,0,0,0,0|3,0,0]=4 671 B21R2.205989 Cc1ccccc1C(OCCC(=O)N)c2ccccc2 7a_100000757172_100000230135 [0,1,0,0,0,0|3,0,0]=4 672 B21R2.205989 Cc1ccccc1C(OCCC(C)C)c2ccccc2 34a_100000212071_100000210312 [0,1,0,0,0,0|1,0,0]=2 673 B21R2.205989 Cc1ccccc1C(OCCC(C)C)c2ccccc2 7a_100000210254_100000230135 [0,1,0,0,0,0|1,0,0]=2 674 B21R2.205989 Cc1ccccc1C(OCCC(C)C)c2ccccc2 7a_100000212071_100000210626 [0,1,0,0,0,0|1,0,0]=2 675 B21R2.205989 Cc1ccccc1C(OCCC(C)O)c2ccccc2 34a_100000212071_100012276601 [0,1,0,0,0,0|2,0,0]=3 676 B21R2.205989 Cc1ccccc1C(OCCC(C)O)c2ccccc2 7a_100000212071_100012276601 [0,1,0,0,0,0|2,0,0]=3 677 B21R2.205989 Cc1ccccc1C(OCCN(C)C)c2ccccc2 7a_100000212071_100000755713 [0,1,0,0,0,0|0,0,0]=1 678 B21R2.205989 Cc1ccccc1C(OCOC(C)C)c2ccccc2 34a_100000212071_100000709892 [0,1,0,0,0,0|2,0,0]=3 679 B21R2.205989 Cc1ccccc1C(SCCC(C)C)c2ccccc2 62a_100000210312_100000230135 [0,1,0,0,0,0|1,1,0]=3 680 B21R2.205989 Cc1ccccc1C(SCCC(C)C)c2ccccc2 62a_100000230135_100000210312 [0,1,0,0,0,0|1,1,0]=3 681 B21R2.205989 Cc1ccccc1C(SCCC(C)O)c2ccccc2 62a_100000230135_100012276601 [0,1,0,0,0,0|2,1,0]=4 682 B21R2.205989 Cc1ccccc1C(SCCC(C)O)c2ccccc2 62a_100012276601_100000230135 [0,1,0,0,0,0|2,1,0]=4 683 B21R2.205989 Cc1ccccc1C(SCCN(C)C)c2ccccc2 62a_100000230135_100000755713 [0,1,0,0,0,0|0,1,0]=2 684 B21R2.205989 Cc1ccccc1C(SCOC(C)C)c2ccccc2 62a_100000230135_100000709892 [0,1,0,0,0,0|2,1,0]=4 685 B21R2.205989 Cc1ccccc1C(SCOC(C)C)c2ccccc2 62a_100000709892_100000230135 [0,1,0,0,0,0|2,1,0]=4 686 B21R2.205989 NC(=O)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000731001 [0,1,0,0,0,0|3,0,0]=4 687 B21R2.205989 NC(=O)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000744528 [0,1,0,0,0,0|3,0,0]=4 688 B21R2.205989 NC(=O)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000731001 [0,1,0,0,0,0|3,0,0]=4 689 B21R2.205989 NC(=O)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000744528 [0,1,0,0,0,0|3,0,0]=4 690 B21R2.252285 C=C(C)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000730704 [0,1,0,0,0,0|1,0,1]=3 691 B21R2.252285 C=C(C)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000730704 [0,1,0,0,0,0|2,0,1]=4 692 B21R2.252285 CC(=CCOC(C)(c1ccccc1)c2ccccc2)C 7a_100011202337_100000761012 [0,1,0,0,0,0|1,0,1]=3 693 B21R2.252285 CC(=CCOC(C)(c1ccccc1)c2ccccn2)C 7a_200000075192_100000761012 [0,1,0,0,0,0|2,0,1]=4 694 B21R2.252285 CC(=O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000053229 [0,1,0,0,0,0|2,0,0]=3 695 B21R2.252285 CC(=O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000053229 [0,1,0,0,0,0|3,0,0]=4 696 B21R2.252285 CC(C)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210626 [0,1,0,0,0,0|1,0,0]=2 697 B21R2.252285 CC(C)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000210626 [0,1,0,0,0,0|2,0,0]=3 698 B21R2.252285 CC(C)CNCC(C)(c1ccccc1)c2ccccc2 2230a_100000706881_100000210760 [0,1,0,0,0,0|3,0,0]=4 699 B21R2.252285 CC(C)CNCC(C)(c1ccccc1)c2ccccc2 270004a_100000706881_100000210432 [0,1,0,0,0,0|3,0,0]=4 700 B21R2.252285 CC(O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100012276601 [0,1,0,0,0,0|2,0,0]=3 701 B21R2.252285 CC(O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100012276601 [0,1,0,0,0,0|3,0,0]=4 702 B21R2.252285 CC(OCCC(=O)N)(c1ccccc1)c2ccccc2 7a_100011202337_100000744528 [0,1,0,0,0,0|3,0,0]=4 703 B21R2.252285 CN(C)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000755713 [0,1,0,0,0,0|0,0,0]=1 704 B21R2.252285 CN(C)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000755713 [0,1,0,0,0,0|1,0,0]=2 705 B21R2.366996 C=C(C)CCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000730704 [0,1,0,0,0,0|2,0,1]=4 706 B21R2.366996 C=C(C)CCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000730704 [0,1,0,0,0,0|2,0,1]=4 707 B21R2.366996 C=C(C)CCNC(c1ccccc1)c2ccc(cc2)C 2230a_100000736602_100000730704 [0,1,0,0,0,0|2,0,1]=4 708 B21R2.366996 C=C(C)CCNC(c1ccccc1)c2ccc(cc2)C 34a_100000736602_100000730704 [0,1,0,0,0,0|2,0,1]=4 709 B21R2.366996 C=C(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000730704 [0,1,0,0,0,0|2,0,1]=4 710 B21R2.366996 C=C(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000730704 [0,1,0,0,0,0|2,0,1]=4 711 B21R2.366996 C=C(C)CCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000730704 [0,1,0,0,0,0|2,0,1]=4 712 B21R2.366996 C=C(C)CCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000730704 [0,1,0,0,0,0|2,0,1]=4 713 B21R2.366996 C=C(C)CCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000730704 [0,1,0,0,0,0|2,0,1]=4 714 B21R2.366996 C=C(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000730704 [0,1,0,0,0,0|2,0,1]=4 715 B21R2.366996 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000730704 [0,1,0,0,0,0|1,0,1]=3 716 B21R2.366996 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000730704 [0,1,0,0,0,0|1,0,1]=3 717 B21R2.366996 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100000730704 [0,1,0,0,0,0|1,0,1]=3 718 B21R2.366996 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000730704 [0,1,0,0,0,0|1,0,1]=3 719 B21R2.366996 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000730704 [0,1,0,0,0,0|1,0,1]=3 720 B21R2.366996 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000730704 [0,1,0,0,0,0|1,0,1]=3 721 B21R2.366996 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000730704 [0,1,0,0,0,0|1,0,1]=3 722 B21R2.366996 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000730704 [0,1,0,0,0,0|1,0,1]=3 723 B21R2.366996 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000730704 [0,1,0,0,0,0|1,0,1]=3 724 B21R2.366996 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000730704 [0,1,0,0,0,0|1,0,1]=3 725 B21R2.366996 C=C(C)CCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000730704 [0,1,0,0,0,0|2,0,1]=4 726 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)Br)C 2230a_100000745999_100000761012 [0,1,0,0,0,0|2,0,1]=4 727 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)Br)C 270004a_100000718196_100000718703 [0,1,0,0,0,0|2,0,1]=4 728 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)Br)C 34a_100000745999_100000761012 [0,1,0,0,0,0|2,0,1]=4 729 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)C)C 2230a_100000736602_100000761012 [0,1,0,0,0,0|2,0,1]=4 730 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)C)C 270004a_100000718196_100000210966 [0,1,0,0,0,0|2,0,1]=4 731 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)C)C 34a_100000736602_100000761012 [0,1,0,0,0,0|2,0,1]=4 732 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)Cl)C 2230a_100000737946_100000761012 [0,1,0,0,0,0|2,0,1]=4 733 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)Cl)C 270004a_100000718196_100000211064 [0,1,0,0,0,0|2,0,1]=4 734 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)Cl)C 34a_100000737946_100000761012 [0,1,0,0,0,0|2,0,1]=4 735 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)F)C 2230a_100000737529_100000761012 [0,1,0,0,0,0|2,0,1]=4 736 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)F)C 270004a_100000718196_100000210425 [0,1,0,0,0,0|2,0,1]=4 737 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)F)C 34a_100000737529_100000761012 [0,1,0,0,0,0|2,0,1]=4 738 B21R2.366996 CC(=CCNC(c1ccccc1)c2ccc(cc2)O)C 34a_100000198503_100000761012 [0,1,0,0,0,0|2,0,1]=4 739 B21R2.366996 CC(=CCOC(c1ccc(cc1)Cl)c2ccccn2)C 34a_100000242608_100000761012 [0,1,0,0,0,0|2,0,1]=4 740 B21R2.366996 CC(=CCOC(c1ccccc1)c2ccc(cc2)Br)C 34a_100011217567_100000761012 [0,1,0,0,0,0|1,0,1]=3 741 B21R2.366996 CC(=CCOC(c1ccccc1)c2ccc(cc2)Br)C 7a_100011217567_100000761012 [0,1,0,0,0,0|1,0,1]=3 742 B21R2.366996 CC(=CCOC(c1ccccc1)c2ccc(cc2)C)C 34a_100000212064_100000761012 [0,1,0,0,0,0|1,0,1]=3 743 B21R2.366996 CC(=CCOC(c1ccccc1)c2ccc(cc2)C)C 7a_100000212064_100000761012 [0,1,0,0,0,0|1,0,1]=3 744 B21R2.366996 CC(=CCOC(c1ccccc1)c2ccc(cc2)Cl)C 34a_100000211768_100000761012 [0,1,0,0,0,0|1,0,1]=3 745 B21R2.366996 CC(=CCOC(c1ccccc1)c2ccc(cc2)Cl)C 7a_100000211768_100000761012 [0,1,0,0,0,0|1,0,1]=3 746 B21R2.366996 CC(=CCOC(c1ccccc1)c2ccc(cc2)F)C 34a_200000246460_100000761012 [0,1,0,0,0,0|1,0,1]=3 747 B21R2.366996 CC(=CCOC(c1ccccc1)c2ccc(cc2)F)C 7a_200000246460_100000761012 [0,1,0,0,0,0|1,0,1]=3 748 B21R2.366996 CC(=CCOC(c1ccccc1)c2ccc(cc2)N)C 34a_100011236343_100000761012 [0,1,0,0,0,0|1,0,1]=3 749 B21R2.366996 CC(=CCOC(c1ccccc1)c2ccc(cc2)N)C 7a_100011236343_100000761012 [0,1,0,0,0,0|1,0,1]=3 750 B21R2.366996 CC(=CCOC(c1ccncc1)c2ccc(cc2)F)C 34a_100000748166_100000761012 [0,1,0,0,0,0|2,0,1]=4 751 B21R2.366996 CC(=O)CCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000759926_200010188304 [0,1,0,0,0,0|3,0,0]=4 752 B21R2.366996 CC(=O)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000053229 [0,1,0,0,0,0|2,0,0]=3 753 B21R2.366996 CC(=O)CCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000053229 [0,1,0,0,0,0|2,0,0]=3 754 B21R2.366996 CC(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000053229 [0,1,0,0,0,0|2,0,0]=3 755 B21R2.366996 CC(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000759926_100000211669 [0,1,0,0,0,0|2,0,0]=3 756 B21R2.366996 CC(=O)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000053229 [0,1,0,0,0,0|2,0,0]=3 757 B21R2.366996 CC(=O)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000053229 [0,1,0,0,0,0|2,0,0]=3 758 B21R2.366996 CC(=O)CCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000053229_100000211669 [0,1,0,0,0,0|2,1,0]=4 759 B21R2.366996 CC(=O)CCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000053229 [0,1,0,0,0,0|2,1,0]=4 760 B21R2.366996 CC(=O)OCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100009813279 [0,1,0,0,0,0|3,0,0]=4 761 B21R2.366996 CC(=O)OCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100009813279 [0,1,0,0,0,0|3,0,0]=4 762 B21R2.366996 CC(=O)OCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100009813279 [0,1,0,0,0,0|3,0,0]=4 763 B21R2.366996 CC(=O)OCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100009813279 [0,1,0,0,0,0|3,0,0]=4 764 B21R2.366996 CC(=O)OCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100009813279 [0,1,0,0,0,0|3,0,0]=4 765 B21R2.366996 CC(C)CCNC(c1ccc(cc1)Br)c2ccccn2 270004a_100000210545_200010179208 [0,1,0,0,0,0|3,0,0]=4 766 B21R2.366996 CC(C)CCNC(c1ccc(cc1)Br)c2cccnc2 270004a_100000210545_100000753996 [0,1,0,0,0,0|3,0,0]=4 767 B21R2.366996 CC(C)CCNC(c1ccc(cc1)Cl)c2ccccn2 270004a_100000210545_100000753647 [0,1,0,0,0,0|3,0,0]=4 768 B21R2.366996 CC(C)CCNC(c1ccc(cc1)Cl)c2cccnc2 270004a_100000210545_100000753233 [0,1,0,0,0,0|3,0,0]=4 769 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000210312 [0,1,0,0,0,0|2,0,0]=3 770 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)Br 269862a_100000745999_100000185833 [0,1,0,0,0,0|2,0,0]=3 771 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000210545_100000718703 [0,1,0,0,0,0|2,0,0]=3 772 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000210312 [0,1,0,0,0,0|2,0,0]=3 773 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000210312 [0,1,0,0,0,0|2,0,0]=3 774 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 269862a_100000737946_100000185833 [0,1,0,0,0,0|2,0,0]=3 775 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000210545_100000211064 [0,1,0,0,0,0|2,0,0]=3 776 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000210312 [0,1,0,0,0,0|2,0,0]=3 777 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000210312 [0,1,0,0,0,0|2,0,0]=3 778 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)F 269862a_100000737529_100000185833 [0,1,0,0,0,0|2,0,0]=3 779 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000210545_100000210425 [0,1,0,0,0,0|2,0,0]=3 780 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000210312 [0,1,0,0,0,0|2,0,0]=3 781 B21R2.366996 CC(C)CCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000210312 [0,1,0,0,0,0|2,0,0]=3 782 B21R2.366996 CC(C)CCNC(c1ccncc1)c2ccc(cc2)F 2230a_100000751741_100000210312 [0,1,0,0,0,0|3,0,0]=4 783 B21R2.366996 CC(C)CCNC(c1ccncc1)c2ccc(cc2)F 269862a_100000751741_100000185833 [0,1,0,0,0,0|3,0,0]=4 784 B21R2.366996 CC(C)CCNC(c1ccncc1)c2ccc(cc2)F 34a_100000751741_100000210312 [0,1,0,0,0,0|3,0,0]=4 785 B21R2.366996 CC(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000210312 [0,1,0,0,0,0|2,0,0]=3 786 B21R2.366996 CC(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000210254_200010188304 [0,1,0,0,0,0|2,0,0]=3 787 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000210312 [0,1,0,0,0,0|1,0,0]=2 788 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000210626 [0,1,0,0,0,0|1,0,0]=2 789 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000210312 [0,1,0,0,0,0|1,0,0]=2 790 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000210254_100000211669 [0,1,0,0,0,0|1,0,0]=2 791 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000210626 [0,1,0,0,0,0|1,0,0]=2 792 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000210312 [0,1,0,0,0,0|1,0,0]=2 793 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000210626 [0,1,0,0,0,0|1,0,0]=2 794 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000210312 [0,1,0,0,0,0|1,0,0]=2 795 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000210626 [0,1,0,0,0,0|1,0,0]=2 796 B21R2.366996 CC(C)CCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000210312 [0,1,0,0,0,0|2,0,0]=3 797 B21R2.366996 CC(C)CCSC(c1ccc(cc1)Cl)c2ccccn2 62a_100000210312_200010188304 [0,1,0,0,0,0|2,1,0]=4 798 B21R2.366996 CC(C)CCSC(c1ccc(cc1)Cl)c2ccccn2 62a_200010188304_100000210312 [0,1,0,0,0,0|2,1,0]=4 799 B21R2.366996 CC(C)OCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000709892 [0,1,0,0,0,0|3,0,0]=4 800 B21R2.366996 CC(C)OCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000709892 [0,1,0,0,0,0|3,0,0]=4 801 B21R2.366996 CC(C)OCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000709892 [0,1,0,0,0,0|3,0,0]=4 802 B21R2.366996 CC(C)OCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000709892 [0,1,0,0,0,0|3,0,0]=4 803 B21R2.366996 CC(C)OCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000709892 [0,1,0,0,0,0|3,0,0]=4 804 B21R2.366996 CC(C)OCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000709892 [0,1,0,0,0,0|3,0,0]=4 805 B21R2.366996 CC(C)OCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000709892 [0,1,0,0,0,0|3,0,0]=4 806 B21R2.366996 CC(C)OCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000709892 [0,1,0,0,0,0|3,0,0]=4 807 B21R2.366996 CC(C)OCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000709892 [0,1,0,0,0,0|2,0,0]=3 808 B21R2.366996 CC(C)OCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000709892 [0,1,0,0,0,0|2,0,0]=3 809 B21R2.366996 CC(C)OCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000709892 [0,1,0,0,0,0|2,0,0]=3 810 B21R2.366996 CC(C)OCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000709892 [0,1,0,0,0,0|2,0,0]=3 811 B21R2.366996 CC(C)OCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000709892 [0,1,0,0,0,0|3,0,0]=4 812 B21R2.366996 CC(C)OCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000709892 [0,1,0,0,0,0|2,1,0]=4 813 B21R2.366996 CC(C)OCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000709892_100000211669 [0,1,0,0,0,0|2,1,0]=4 814 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100012276601 [0,1,0,0,0,0|3,0,0]=4 815 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)Br 270004a_200000755665_100000718703 [0,1,0,0,0,0|3,0,0]=4 816 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100012276601 [0,1,0,0,0,0|3,0,0]=4 817 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100012276601 [0,1,0,0,0,0|3,0,0]=4 818 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_200000755665_100000211669 [0,1,0,0,0,0|3,0,0]=4 819 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_200000755665_100000211064 [0,1,0,0,0,0|3,0,0]=4 820 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100012276601 [0,1,0,0,0,0|3,0,0]=4 821 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100012276601 [0,1,0,0,0,0|3,0,0]=4 822 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)F 270004a_200000755665_100000210425 [0,1,0,0,0,0|3,0,0]=4 823 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100012276601 [0,1,0,0,0,0|3,0,0]=4 824 B21R2.366996 CC(O)CCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100012276601 [0,1,0,0,0,0|3,0,0]=4 825 B21R2.366996 CC(O)CCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100012276601 [0,1,0,0,0,0|3,0,0]=4 826 B21R2.366996 CC(O)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100012276601 [0,1,0,0,0,0|2,0,0]=3 827 B21R2.366996 CC(O)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100012276601 [0,1,0,0,0,0|2,0,0]=3 828 B21R2.366996 CC(O)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100012276601 [0,1,0,0,0,0|2,0,0]=3 829 B21R2.366996 CC(O)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100012276601 [0,1,0,0,0,0|2,0,0]=3 830 B21R2.366996 CC(O)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100012276601 [0,1,0,0,0,0|2,0,0]=3 831 B21R2.366996 CC(O)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100012276601 [0,1,0,0,0,0|2,0,0]=3 832 B21R2.366996 CC(O)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100012276601 [0,1,0,0,0,0|2,0,0]=3 833 B21R2.366996 CC(O)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100012276601 [0,1,0,0,0,0|2,0,0]=3 834 B21R2.366996 CC(O)CCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100012276601 [0,1,0,0,0,0|3,0,0]=4 835 B21R2.366996 CC(O)CCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100012276601 [0,1,0,0,0,0|2,1,0]=4 836 B21R2.366996 CC(O)CCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100012276601_100000211669 [0,1,0,0,0,0|2,1,0]=4 837 B21R2.366996 CN(C)CCNC(c1ccc(cc1)Br)c2ccccn2 270004a_100000210585_200010179208 [0,1,0,0,0,0|2,0,0]=3 838 B21R2.366996 CN(C)CCNC(c1ccc(cc1)Br)c2cccnc2 270004a_100000210585_100000753996 [0,1,0,0,0,0|2,0,0]=3 839 B21R2.366996 CN(C)CCNC(c1ccc(cc1)Cl)c2ccccn2 270004a_100000210585_100000753647 [0,1,0,0,0,0|2,0,0]=3 840 B21R2.366996 CN(C)CCNC(c1ccc(cc1)Cl)c2cccnc2 270004a_100000210585_100000753233 [0,1,0,0,0,0|2,0,0]=3 841 B21R2.366996 CN(C)CCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000210585_100000718703 [0,1,0,0,0,0|1,0,0]=2 842 B21R2.366996 CN(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000210585_100000211064 [0,1,0,0,0,0|1,0,0]=2 843 B21R2.366996 CN(C)CCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000210585_100000210425 [0,1,0,0,0,0|1,0,0]=2 844 B21R2.366996 CN(C)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000755713 [0,1,0,0,0,0|0,0,0]=1 845 B21R2.366996 CN(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000755713 [0,1,0,0,0,0|0,0,0]=1 846 B21R2.366996 CN(C)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000755713 [0,1,0,0,0,0|0,0,0]=1 847 B21R2.366996 CN(C)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000755713 [0,1,0,0,0,0|0,0,0]=1 848 B21R2.366996 CN(C)CCSC(c1ccc(cc1)Cl)c2ccccn2 62a_200010188304_100000755713 [0,1,0,0,0,0|1,1,0]=3 849 B21R2.366996 CN(C)CCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000755713 [0,1,0,0,0,0|0,1,0]=2 850 B21R2.366996 Cc1ccc(cc1)C(NCCC(C)C)c2ccccc2 2230a_100000736602_100000210312 [0,1,0,0,0,0|2,0,0]=3 851 B21R2.366996 Cc1ccc(cc1)C(NCCC(C)C)c2ccccc2 269862a_100000736602_100000185833 [0,1,0,0,0,0|2,0,0]=3 852 B21R2.366996 Cc1ccc(cc1)C(NCCC(C)C)c2ccccc2 270004a_100000210545_100000210966 [0,1,0,0,0,0|2,0,0]=3 853 B21R2.366996 Cc1ccc(cc1)C(NCCC(C)C)c2ccccc2 34a_100000736602_100000210312 [0,1,0,0,0,0|2,0,0]=3 854 B21R2.366996 Cc1ccc(cc1)C(NCCC(C)C)c2ccncc2 269862a_200015185284_100000185833 [0,1,0,0,0,0|3,0,0]=4 855 B21R2.366996 Cc1ccc(cc1)C(NCCC(C)C)c2ccncc2 34a_200015185284_100000210312 [0,1,0,0,0,0|3,0,0]=4 856 B21R2.366996 Cc1ccc(cc1)C(NCCC(C)O)c2ccccc2 2230a_100000736602_100012276601 [0,1,0,0,0,0|3,0,0]=4 857 B21R2.366996 Cc1ccc(cc1)C(NCCC(C)O)c2ccccc2 270004a_200000755665_100000210966 [0,1,0,0,0,0|3,0,0]=4 858 B21R2.366996 Cc1ccc(cc1)C(NCCC(C)O)c2ccccc2 34a_100000736602_100012276601 [0,1,0,0,0,0|3,0,0]=4 859 B21R2.366996 Cc1ccc(cc1)C(NCCN(C)C)c2ccccc2 270004a_100000210585_100000210966 [0,1,0,0,0,0|1,0,0]=2 860 B21R2.366996 Cc1ccc(cc1)C(NCOC(C)C)c2ccccc2 2230a_100000736602_100000709892 [0,1,0,0,0,0|3,0,0]=4 861 B21R2.366996 Cc1ccc(cc1)C(NCOC(C)C)c2ccccc2 34a_100000736602_100000709892 [0,1,0,0,0,0|3,0,0]=4 862 B21R2.366996 Cc1ccc(cc1)C(OCCC(=O)N)c2ccccc2 34a_100000212064_100000731001 [0,1,0,0,0,0|3,0,0]=4 863 B21R2.366996 Cc1ccc(cc1)C(OCCC(=O)N)c2ccccc2 7a_100000212064_100000744528 [0,1,0,0,0,0|3,0,0]=4 864 B21R2.366996 Cc1ccc(cc1)C(OCCC(C)C)c2ccccc2 34a_100000212064_100000210312 [0,1,0,0,0,0|1,0,0]=2 865 B21R2.366996 Cc1ccc(cc1)C(OCCC(C)C)c2ccccc2 7a_100000212064_100000210626 [0,1,0,0,0,0|1,0,0]=2 866 B21R2.366996 Cc1ccc(cc1)C(OCCC(C)O)c2ccccc2 34a_100000212064_100012276601 [0,1,0,0,0,0|2,0,0]=3 867 B21R2.366996 Cc1ccc(cc1)C(OCCC(C)O)c2ccccc2 7a_100000212064_100012276601 [0,1,0,0,0,0|2,0,0]=3 868 B21R2.366996 Cc1ccc(cc1)C(OCCN(C)C)c2ccccc2 7a_100000212064_100000755713 [0,1,0,0,0,0|0,0,0]=1 869 B21R2.366996 Cc1ccc(cc1)C(OCOC(C)C)c2ccccc2 34a_100000212064_100000709892 [0,1,0,0,0,0|2,0,0]=3 870 B21R2.366996 NC(=O)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000731001 [0,1,0,0,0,0|3,0,0]=4 871 B21R2.366996 NC(=O)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000744528 [0,1,0,0,0,0|3,0,0]=4 872 B21R2.366996 NC(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000731001 [0,1,0,0,0,0|3,0,0]=4 873 B21R2.366996 NC(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000744528 [0,1,0,0,0,0|3,0,0]=4 874 B21R2.366996 NC(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000757172_100000211669 [0,1,0,0,0,0|3,0,0]=4 875 B21R2.366996 NC(=O)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000731001 [0,1,0,0,0,0|3,0,0]=4 876 B21R2.366996 NC(=O)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000744528 [0,1,0,0,0,0|3,0,0]=4 877 B21R2.366996 NC(=O)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000731001 [0,1,0,0,0,0|3,0,0]=4 878 B21R2.366996 NC(=O)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000744528 [0,1,0,0,0,0|3,0,0]=4 879 B21R2.402445 C=C(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000730704 [0,1,0,0,0,0|2,0,1]=4 880 B21R2.402445 C=C(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_200000688413_100011216954 [0,1,0,0,0,0|2,0,1]=4 881 B21R2.402445 C=C(C)CCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000730704 [0,1,0,0,0,0|2,0,1]=4 882 B21R2.402445 C=C(C)CCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000730704 [0,1,0,0,0,0|2,0,1]=4 883 B21R2.402445 CC(=CCC(=O)C(c1ccccc1)c2ccccc2)C 1458a_100000210944_100000761012 [0,1,0,0,0,0|2,0,1]=4 884 B21R2.402445 CC(=CCC(=O)C(c1ccccc1)c2ccccc2)C 1458a_100011220947_100011216954 [0,1,0,0,0,0|2,0,1]=4 885 B21R2.402445 CC(=CCN(C)C(c1ccccc1)c2ccccc2)C 2230a_100103148541_100000761012 [0,1,0,0,0,0|2,0,1]=4 886 B21R2.402445 CC(=CCN(C)C(c1ccccc1)c2ccccc2)C 269982a_100103148541_100000761012 [0,1,0,0,0,0|2,0,1]=4 887 B21R2.402445 CC(=O)CCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000053229 [0,1,0,0,0,0|3,0,0]=4 888 B21R2.402445 CC(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000181311_100011216954 [0,1,0,0,0,0|2,0,0]=3 889 B21R2.402445 CC(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000210312 [0,1,0,0,0,0|2,0,0]=3 890 B21R2.402445 CC(C)CCN(C)C(c1ccccc1)c2ccccc2 2230a_100000742789_100000211591 [0,1,0,0,0,0|2,0,0]=3 891 B21R2.402445 CC(C)CCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000210312 [0,1,0,0,0,0|2,0,0]=3 892 B21R2.402445 CC(C)CCN(C)C(c1ccccc1)c2ccccc2 269982a_100000742789_100000211591 [0,1,0,0,0,0|2,0,0]=3 893 B21R2.402445 CC(C)CCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000210312 [0,1,0,0,0,0|2,0,0]=3 894 B21R2.402445 CC(C)CCN(C)C(c1ccccc1)c2ccccc2 270004a_100000742789_100000210122 [0,1,0,0,0,0|2,0,0]=3 895 B21R2.402445 CC(C)CCN(C)C(c1ccccc1)c2ccccn2 270004a_100000742789_100000210380 [0,1,0,0,0,0|3,0,0]=4 896 B21R2.402445 CC(C)CCN(C)C(c1ccccc1)c2cccnc2 270004a_100000742789_100000735413 [0,1,0,0,0,0|3,0,0]=4 897 B21R2.402445 CC(C)CNC(=O)C(c1ccccc1)c2ccccc2 11a_100000210953_100000210944 [0,1,0,0,0,0|3,0,0]=4 898 B21R2.402445 CC(C)CNC(=O)C(c1ccccc1)c2ccccc2 1626a_100000210953_100000210944 [0,1,0,0,0,0|3,0,0]=4 899 B21R2.402445 CC(C)CNC(=O)C(c1ccccc1)c2ccccc2 240690a_100000210953_100000210944 [0,1,0,0,0,0|3,0,0]=4 900 B21R2.402445 CC(C)CNC(=O)C(c1ccccc1)c2ccccc2 527a_100000210953_100000210944 [0,1,0,0,0,0|3,0,0]=4 901 B21R2.402445 CC(C)OCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000745533_100011216954 [0,1,0,0,0,0|3,0,0]=4 902 B21R2.402445 CC(C)OCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000709892 [0,1,0,0,0,0|3,0,0]=4 903 B21R2.402445 CC(C)OCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000709892 [0,1,0,0,0,0|3,0,0]=4 904 B21R2.402445 CC(C)SCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000241585_100011216954 [0,1,0,0,0,0|3,0,0]=4 905 B21R2.402445 CC(O)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100012276601 [0,1,0,0,0,0|3,0,0]=4 906 B21R2.402445 CC(O)CCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100012276601 [0,1,0,0,0,0|3,0,0]=4 907 B21R2.402445 CC(O)CCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100012276601 [0,1,0,0,0,0|3,0,0]=4 908 B21R2.402445 CN(C)CCN(C)C(c1ccccc1)c2ccccc2 269982a_100000225618_100000211591 [0,1,0,0,0,0|1,0,0]=2 909 B21R2.402445 CN(C)CCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000755713 [0,1,0,0,0,0|1,0,0]=2 910 B21R2.402445 CN(C)CCN(C)C(c1ccccc1)c2ccccc2 270004a_100000225618_100000210122 [0,1,0,0,0,0|1,0,0]=2 911 B21R2.402445 CN(C)CCN(C)C(c1ccccc1)c2ccccn2 270004a_100000225618_100000210380 [0,1,0,0,0,0|2,0,0]=3 912 B21R2.402445 CN(C)CCN(C)C(c1ccccc1)c2cccnc2 270004a_100000225618_100000735413 [0,1,0,0,0,0|2,0,0]=3 913 B21R2.402445 CN(C)CCN(C)C(c1cccnc1)c2ccccn2 270004a_100000225618_100011376182 [0,1,0,0,0,0|3,0,0]=4 914 B21R2.402445 CN(C)CCN(C)C(c1cccnc1)c2cccnc2 270004a_100000225618_200011376183 [0,1,0,0,0,0|3,0,0]=4 915 B21R2.402445 C[S+](C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100009452791_100011216954 [0,1,0,0,0,0|2,0,0]=3 916 B21R3.527 CC1CC1COC(c2ccccc2)c3ccccc3 7a_100000744939_100011216954 [0,0,0,1,0,0|1,0,0]=2 917 B21R3.7545 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccccc3 2230a_100016987628_100000211591 [0,0,0,1,0,0|2,0,0]=3 918 B21R3.7545 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccccc3 269982a_100016987628_100000211591 [0,0,0,1,0,0|2,0,0]=3 919 B21R3.7545 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccccc3 270004a_100016987628_100000210122 [0,0,0,1,0,0|2,0,0]=3 920 B21R3.7545 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccccn3 270004a_100016987628_100000210380 [0,0,0,1,0,0|3,0,0]=4 921 B21R3.7545 C[C@@H]1CCN(C1)C(c2ccccc2)c3cccnc3 270004a_100016987628_100000735413 [0,0,0,1,0,0|3,0,0]=4 922 B21R3.7545 F[C@H]1CCN(C1)C(c2ccccc2)c3ccccc3 2230a_100015203821_100000211591 [0,0,0,1,0,0|3,0,0]=4 923 B21R3.7545 F[C@H]1CCN(C1)C(c2ccccc2)c3ccccc3 269982a_100015203821_100000211591 [0,0,0,1,0,0|3,0,0]=4 924 B21R3.7545 F[C@H]1CCN(C1)C(c2ccccc2)c3ccccc3 270004a_100015203821_100000210122 [0,0,0,1,0,0|3,0,0]=4 925 B21R3.7545 OC1CCN(C1)C(c2ccccc2)c3ccccc3 2230a_100011215560_100000211591 [0,0,0,1,0,0|3,0,0]=4 926 B21R3.7545 OC1CCN(C1)C(c2ccccc2)c3ccccc3 269982a_100011215560_100000211591 [0,0,0,1,0,0|3,0,0]=4 927 B21R3.7545 OC1CCN(C1)C(c2ccccc2)c3ccccc3 270004a_100011215560_100000210122 [0,0,0,1,0,0|3,0,0]=4 928 B21R3.21229 C=C1CC(C1)NC(c2ccccc2)c3ccccc3 2230a_100132301982_100000211591 [0,0,0,1,0,0|2,0,1]=4 929 B21R3.21229 C=C1CC(C1)NC(c2ccccc2)c3ccccc3 270004a_100132301982_100000210122 [0,0,0,1,0,0|2,0,1]=4 930 B21R3.21229 CN1CC(C1)NC(c2ccccc2)c3ccccc3 270004a_100015196640_100000210122 [0,0,0,1,0,0|1,0,0]=2 931 B21R3.21229 CN1CC(C1)NC(c2ccccc2)c3ccccn3 270004a_100015196640_100000210380 [0,0,0,1,0,0|2,0,0]=3 932 B21R3.21229 CN1CC(C1)NC(c2ccccc2)c3cccnc3 270004a_100015196640_100000735413 [0,0,0,1,0,0|2,0,0]=3 933 B21R3.21229 CN1CC(C1)NC(c2cccnc2)c3ccccn3 270004a_100015196640_100011376182 [0,0,0,1,0,0|3,0,0]=4 934 B21R3.21229 CN1CC(C1)NC(c2cccnc2)c3cccnc3 270004a_100015196640_200011376183 [0,0,0,1,0,0|3,0,0]=4 935 B21R3.21229 FC1CC(C1)NC(c2ccccc2)c3ccccc3 2230a_100016993743_100000211591 [0,0,0,1,0,0|3,0,0]=4 936 B21R3.21229 FC1CC(C1)NC(c2ccccc2)c3ccccc3 270004a_100016993743_100000210122 [0,0,0,1,0,0|3,0,0]=4 937 B21R3.21229 O=C1CC(C1)SC(c2ccccc2)c3ccccc3 62a_100009894365_100011216954 [0,0,0,1,0,0|2,1,0]=4 938 B21R3.21229 O[C@H]1C[C@@H](C1)NC(c2ccccc2)c3ccccc3 2230a_100020629032_100000211591 [0,0,0,1,0,0|3,0,0]=4 939 B21R3.21229 O[C@H]1C[C@@H](C1)NC(c2ccccc2)c3ccccc3 270004a_100020629032_100000210122 [0,0,0,1,0,0|3,0,0]=4 940 B21R3.47875 c1ccc(cc1)C(CCNC2CC2)c3ccccc3 34a_100000212008_100009813428 [0,0,0,1,0,0|3,0,0]=4 941 B21R3.47875 c1ccc(cc1)C(CCNC2CC2)c3ccccc3 34a_100000272388_100000211595 [0,0,0,1,0,0|3,0,0]=4 942 B21R3.47875 c1ccc(cc1)C(CCOC2CC2)c3ccccc3 34a_100000032380_100000211595 [0,0,0,1,0,0|3,0,0]=4 943 B21R3.47875 c1ccc(cc1)C(CCSC2CC2)c3ccccc3 62a_100009813428_100000211595 [0,0,0,1,0,0|3,0,0]=4 944 B21R3.47875 c1ccc(cc1)C(CNCC2CC2)c3ccccc3 2230a_100000739227_100000742324 [0,0,0,1,0,0|3,0,0]=4 945 B21R3.47875 c1ccc(cc1)C(CNCC2CC2)c3ccccc3 269862a_100000739227_100000741477 [0,0,0,1,0,0|3,0,0]=4 946 B21R3.47875 c1ccc(cc1)C(CNCC2CC2)c3ccccc3 34a_100000739227_100000742324 [0,0,0,1,0,0|3,0,0]=4 947 B21R3.47875 c1ccc(cc1)C(COCC2CC2)c3ccccc3 34a_100011215272_100000742324 [0,0,0,1,0,0|3,0,0]=4 948 B21R3.47875 c1ccc(cc1)C(COCC2CC2)c3ccccc3 7a_100011215272_100000742324 [0,0,0,1,0,0|3,0,0]=4 949 B21R3.47875 c1ccc(cc1)C(NCCC2CC2)c3ccccc3 2230a_100000162943_100000694398 [0,0,0,1,0,0|2,0,0]=3 950 B21R3.47875 c1ccc(cc1)C(NCCC2CC2)c3ccccc3 270004a_100000764129_100000210122 [0,0,0,1,0,0|2,0,0]=3 951 B21R3.47875 c1ccc(cc1)C(NCCC2CC2)c3ccccc3 34a_100000162943_100000694398 [0,0,0,1,0,0|2,0,0]=3 952 B21R3.47875 c1ccc(cc1)C(NCCC2CC2)c3ccccn3 2230a_100000689936_100000694398 [0,0,0,1,0,0|3,0,0]=4 953 B21R3.47875 c1ccc(cc1)C(NCCC2CC2)c3ccccn3 270004a_100000764129_100000210380 [0,0,0,1,0,0|3,0,0]=4 954 B21R3.47875 c1ccc(cc1)C(NCCC2CC2)c3cccnc3 2230a_100011232609_100000694398 [0,0,0,1,0,0|3,0,0]=4 955 B21R3.47875 c1ccc(cc1)C(NCCC2CC2)c3cccnc3 270004a_100000764129_100000735413 [0,0,0,1,0,0|3,0,0]=4 956 B21R3.47875 c1ccc(cc1)C(NCCC2CC2)c3ccncc3 2230a_100025760769_100000694398 [0,0,0,1,0,0|3,0,0]=4 957 B21R3.47875 c1ccc(cc1)C(NCCC2CO2)c3ccccc3 2230a_100000162943_100000732470 [0,0,0,1,0,0|3,0,0]=4 958 B21R3.47875 c1ccc(cc1)C(NCCC2CO2)c3ccccc3 34a_100000162943_100000732470 [0,0,0,1,0,0|3,0,0]=4 959 B21R3.47875 c1ccc(cc1)C(OCCC2CC2)c3ccccc3 34a_100000211180_100000694398 [0,0,0,1,0,0|1,0,0]=2 960 B21R3.47875 c1ccc(cc1)C(OCCC2CC2)c3ccccc3 7a_100000211180_100000764125 [0,0,0,1,0,0|1,0,0]=2 961 B21R3.47875 c1ccc(cc1)C(OCCC2CC2)c3ccccc3 7a_100000754188_100011216954 [0,0,0,1,0,0|1,0,0]=2 962 B21R3.47875 c1ccc(cc1)C(OCCC2CC2)c3ccccn3 7a_100000180852_100000764125 [0,0,0,1,0,0|2,0,0]=3 963 B21R3.47875 c1ccc(cc1)C(OCCC2CO2)c3ccccc3 34a_100000211180_100000732470 [0,0,0,1,0,0|2,0,0]=3 964 B21R3.47875 c1ccc(cc1)C(OCCC2CO2)c3ccccc3 7a_100000211180_100000732470 [0,0,0,1,0,0|2,0,0]=3 965 B21R3.47875 c1ccc(cc1)C(OCCC2CO2)c3ccccn3 7a_100000180852_100000732470 [0,0,0,1,0,0|3,0,0]=4 966 B21R3.47875 c1ccc(cc1)C(SCCC2CC2)c3ccccc3 62a_100000211591_100000764125 [0,0,0,1,0,0|1,1,0]=3 967 B21R3.47875 c1ccc(cc1)C(SCCC2CC2)c3ccccc3 62a_100000764125_100011216954 [0,0,0,1,0,0|1,1,0]=3 968 B21R3.47875 c1ccc(cc1)C(SCCC2CO2)c3ccccc3 62a_100000211591_100000732470 [0,0,0,1,0,0|2,1,0]=4 969 B21R3.47875 c1ccc(cc1)C(SCCC2CO2)c3ccccc3 62a_100000732470_100011216954 [0,0,0,1,0,0|2,1,0]=4 970 B21R3.9913503 C=C(C)CCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000730704 [0,0,0,1,0,0|2,0,1]=4 971 B21R3.9913503 C=C(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000730704 [0,0,0,1,0,0|1,0,1]=3 972 B21R3.9913503 C=C(C)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000730704 [0,0,0,1,0,0|1,1,1]=4 973 B21R3.9913503 CC(=CCNC1c2ccccc2-c3c1cccc3)C 2230a_100000104097_100000761012 [0,0,0,1,0,0|2,0,1]=4 974 B21R3.9913503 CC(=CCOC1c2ccccc2-c3c1cccc3)C 7a_100000211495_100000761012 [0,0,0,1,0,0|1,0,1]=3 975 B21R3.9913503 CC(=CCSC1c2ccccc2-c3c1cccc3)C 62a_100000211598_100000761012 [0,0,0,1,0,0|1,1,1]=4 976 B21R3.9913503 CC(=O)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000053229 [0,0,0,1,0,0|2,0,0]=3 977 B21R3.9913503 CC(=O)CCOC1c2ccccc2-c3c1cccc3 7a_100000759926_100000211598 [0,0,0,1,0,0|2,0,0]=3 978 B21R3.9913503 CC(=O)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000053229 [0,0,0,1,0,0|2,1,0]=4 979 B21R3.9913503 CC(C)CCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000210312 [0,0,0,1,0,0|2,0,0]=3 980 B21R3.9913503 CC(C)CCNC1c2ccccc2-c3c1cccc3 269862a_100000104097_100000185833 [0,0,0,1,0,0|2,0,0]=3 981 B21R3.9913503 CC(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000210254_100000211598 [0,0,0,1,0,0|1,0,0]=2 982 B21R3.9913503 CC(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000210626 [0,0,0,1,0,0|1,0,0]=2 983 B21R3.9913503 CC(C)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000210312 [0,0,0,1,0,0|1,1,0]=3 984 B21R3.9913503 CC(C)CNCC1c2ccccc2-c3c1cccc3 2230a_100016995487_100000210760 [0,0,0,1,0,0|3,0,0]=4 985 B21R3.9913503 CC(C)CNCC1c2ccccc2-c3c1cccc3 270004a_100016995487_100000210432 [0,0,0,1,0,0|3,0,0]=4 986 B21R3.9913503 CC(C)CNCC1c2ccccc2-c3c1cccc3 34a_100016995487_100000210624 [0,0,0,1,0,0|3,0,0]=4 987 B21R3.9913503 CC(C)COCC1c2ccccc2-c3c1cccc3 34a_100011215202_100000210624 [0,0,0,1,0,0|3,0,0]=4 988 B21R3.9913503 CC(C)COCC1c2ccccc2-c3c1cccc3 7a_100011215202_100000210760 [0,0,0,1,0,0|3,0,0]=4 989 B21R3.9913503 CC(C)OCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000709892 [0,0,0,1,0,0|3,0,0]=4 990 B21R3.9913503 CC(C)OCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000709892 [0,0,0,1,0,0|2,1,0]=4 991 B21R3.9913503 CC(O)CCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100012276601 [0,0,0,1,0,0|3,0,0]=4 992 B21R3.9913503 CC(O)CCNC1c2ccccc2-c3c1cccc3 2230a_200000755665_100000211598 [0,0,0,1,0,0|3,0,0]=4 993 B21R3.9913503 CC(O)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100012276601 [0,0,0,1,0,0|2,0,0]=3 994 B21R3.9913503 CC(O)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100012276601 [0,0,0,1,0,0|2,1,0]=4 995 B21R3.9913503 CN(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000755713 [0,0,0,1,0,0|0,0,0]=1 996 B21R3.9913503 CN(C)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000755713 [0,0,0,1,0,0|0,1,0]=2 997 B21R3.9913503 NC(=O)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000744528 [0,0,0,1,0,0|3,0,0]=4 998 B21R3.9913503 NC(=O)CCOC1c2ccccc2-c3c1cccc3 7a_100000757172_100000211598 [0,0,0,1,0,0|3,0,0]=4 999 B19R2.8889 CC(C)CCNC(c1ccccc1)c2ccco2 2230a_100015185865_100000210312 [0,0,0,0,1,0|3,0,0]=4 1000 B19R2.8889 CC(C)CCNC(c1ccccc1)c2ccco2 269862a_100015185865_100000185833 [0,0,0,0,1,0|3,0,0]=4 1001 B19R2.8889 CC(C)CCNC(c1ccccc1)c2ccco2 34a_100015185865_100000210312 [0,0,0,0,1,0|3,0,0]=4 1002 B19R2.8889 CC(C)CCNC(c1ccccc1)c2cccs2 2230a_100025760362_100000210312 [0,0,0,0,1,0|3,0,0]=4 1003 B19R2.8889 CC(C)CCNC(c1ccccc1)c2cccs2 269862a_100025760362_100000185833 [0,0,0,0,1,0|3,0,0]=4 1004 B19R2.8889 CC(C)CCNC(c1ccccc1)c2cccs2 270004a_100000210545_100011214959 [0,0,0,0,1,0|3,0,0]=4 1005 B19R2.8889 CC(C)CCNC(c1ccccc1)c2cccs2 34a_100025760362_100000210312 [0,0,0,0,1,0|3,0,0]=4 1006 B19R2.8889 CC(C)CCNC(c1ccccc1)c2ccoc2 2230a_100102946537_100000210312 [0,0,0,0,1,0|3,0,0]=4 1007 B19R2.8889 CC(C)CCNC(c1ccccc1)c2ccoc2 269862a_100102946537_100000185833 [0,0,0,0,1,0|3,0,0]=4 1008 B19R2.8889 CC(C)CCNC(c1ccccc1)c2ccoc2 34a_100102946537_100000210312 [0,0,0,0,1,0|3,0,0]=4 1009 B19R2.8889 CC(C)CCOC(c1ccccc1)c2ncc[nH]2 7a_100000181881_100000210626 [0,0,0,0,1,0|3,0,0]=4 1010 B19R2.8889 CN(C)CCNC(c1ccccc1)c2cccs2 270004a_100000210585_100011214959 [0,0,0,0,1,0|2,0,0]=3 1011 B19R2.8889 CN(C)CCOC(c1ccccc1)c2ncc[nH]2 7a_100000181881_100000755713 [0,0,0,0,1,0|2,0,0]=3 1012 B19R2.13577 C=C(C)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000748629 [0,0,0,0,1,0|2,0,1]=4 1013 B19R2.13577 C=C(C)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000748629 [0,0,0,0,1,0|2,0,1]=4 1014 B19R2.13577 C=C(C)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000748629 [0,0,0,0,1,0|1,0,1]=3 1015 B19R2.13577 C=C(C)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000748629 [0,0,0,0,1,0|1,0,1]=3 1016 B19R2.13577 C=C(C)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000748629 [0,0,0,0,1,0|2,0,1]=4 1017 B19R2.13577 C=C(C)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000211660 [0,0,0,0,1,0|1,1,1]=4 1018 B19R2.13577 C=C(C)CSC(c1ccccc1)c2ccccc2 62a_100000748629_100011216954 [0,0,0,0,1,0|1,1,1]=4 1019 B19R2.13577 C=C(F)COC(c1ccccc1)c2ccccc2 34a_100000211180_100009893438 [0,0,0,0,1,0|2,0,1]=4 1020 B19R2.13577 C=C(F)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000042424 [0,0,0,0,1,0|2,0,1]=4 1021 B19R2.13577 CC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000070787_100009813428 [0,0,0,0,1,0|2,0,0]=3 1022 B19R2.13577 CC(=O)CCP(c1ccccc1)c2ccccc2 1458a_100020644332_200000210301 [0,0,0,0,1,0|3,0,0]=4 1023 B19R2.13577 CC(=O)CC[S+](c1ccccc1)c2ccccc2 1458a_100000070787_100010140906 [0,0,0,0,1,0|3,0,0]=4 1024 B19R2.13577 CC(=O)CSC(c1ccccc1)c2ccccc2 1458a_100000683935_200000210301 [0,0,0,0,1,0|2,1,0]=4 1025 B19R2.13577 CC(=O)NCC(c1ccccc1)c2ccccc2 1626a_100000739227_100015343762 [0,0,0,0,1,0|3,0,0]=4 1026 B19R2.13577 CC(=O)NCC(c1ccccc1)c2ccccc2 240690a_100000739227_100015343762 [0,0,0,0,1,0|3,0,0]=4 1027 B19R2.13577 CC(=O)NCC(c1ccccc1)c2ccccc2 527a_100000739227_100103153847 [0,0,0,0,1,0|3,0,0]=4 1028 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210760 [0,0,0,0,1,0|2,0,0]=3 1029 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccc2 2230a_100000210953_100000211591 [0,0,0,0,1,0|2,0,0]=3 1030 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccc2 270004a_100000162943_100000210432 [0,0,0,0,1,0|2,0,0]=3 1031 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccc2 270004a_100000210953_100000210122 [0,0,0,0,1,0|2,0,0]=3 1032 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210624 [0,0,0,0,1,0|2,0,0]=3 1033 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210760 [0,0,0,0,1,0|3,0,0]=4 1034 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccn2 270004a_100000210953_100000210380 [0,0,0,0,1,0|3,0,0]=4 1035 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccn2 270004a_100000689936_100000210432 [0,0,0,0,1,0|3,0,0]=4 1036 B19R2.13577 CC(C)CNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000210760 [0,0,0,0,1,0|3,0,0]=4 1037 B19R2.13577 CC(C)CNC(c1ccccc1)c2cccnc2 270004a_100000210953_100000735413 [0,0,0,0,1,0|3,0,0]=4 1038 B19R2.13577 CC(C)CNC(c1ccccc1)c2cccnc2 270004a_100011232609_100000210432 [0,0,0,0,1,0|3,0,0]=4 1039 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000210760 [0,0,0,0,1,0|3,0,0]=4 1040 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccncc2 270004a_100025760769_100000210432 [0,0,0,0,1,0|3,0,0]=4 1041 B19R2.13577 CC(C)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000210624 [0,0,0,0,1,0|1,0,0]=2 1042 B19R2.13577 CC(C)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000210760 [0,0,0,0,1,0|1,0,0]=2 1043 B19R2.13577 CC(C)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000210760 [0,0,0,0,1,0|2,0,0]=3 1044 B19R2.13577 CC(C)CSC(c1ccccc1)c2ccccc2 62a_100000210624_100011216954 [0,0,0,0,1,0|1,1,0]=3 1045 B19R2.13577 CC(C)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000210760 [0,0,0,0,1,0|1,1,0]=3 1046 B19R2.13577 CC(C)NCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210206 [0,0,0,0,1,0|2,0,0]=3 1047 B19R2.13577 CC(C)NCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210206 [0,0,0,0,1,0|2,0,0]=3 1048 B19R2.13577 CC(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210206 [0,0,0,0,1,0|2,0,0]=3 1049 B19R2.13577 CC(C)OCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210206 [0,0,0,0,1,0|2,0,0]=3 1050 B19R2.13577 CC(O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011218427 [0,0,0,0,1,0|3,0,0]=4 1051 B19R2.13577 CC(O)CNC(c1ccccc1)c2ccccc2 2230a_100000210904_100000211591 [0,0,0,0,1,0|3,0,0]=4 1052 B19R2.13577 CC(O)CNC(c1ccccc1)c2ccccc2 270004a_100000210904_100000210122 [0,0,0,0,1,0|3,0,0]=4 1053 B19R2.13577 CC(O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100011218427 [0,0,0,0,1,0|3,0,0]=4 1054 B19R2.13577 CC(O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011218427 [0,0,0,0,1,0|2,0,0]=3 1055 B19R2.13577 CC(O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100011218427 [0,0,0,0,1,0|2,0,0]=3 1056 B19R2.13577 CC(O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100011218427 [0,0,0,0,1,0|3,0,0]=4 1057 B19R2.13577 CC(O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100011218427 [0,0,0,0,1,0|2,1,0]=4 1058 B19R2.13577 CC(O)CSC(c1ccccc1)c2ccccc2 62a_100011218427_100011216954 [0,0,0,0,1,0|2,1,0]=4 1059 B19R2.13577 CN(C)CC=C(c1ccccc1)c2ccccc2 270004a_100102631434_100000050448 [0,0,0,0,1,0|0,0,2]=3 1060 B19R2.13577 CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_200000210301 [0,0,0,0,1,0|0,0,0]=1 1061 B19R2.13577 CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100102631434_100009813428 [0,0,0,0,1,0|0,0,0]=1 1062 B19R2.13577 CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_200000210301 [0,0,0,0,1,0|0,0,0]=1 1063 B19R2.13577 CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100102631434_100009813428 [0,0,0,0,1,0|0,0,0]=1 1064 B19R2.13577 CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_200000210301 [0,0,0,0,1,0|0,0,0]=1 1065 B19R2.13577 CN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100102631434_100010140906 [0,0,0,0,1,0|1,0,0]=2 1066 B19R2.13577 CN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100102631434_100010140906 [0,0,0,0,1,0|1,0,0]=2 1067 B19R2.13577 CN([13CH3])CCC(c1ccccc1)c2ccccc2 2230a_100025726140_200025704644 [0,0,0,0,1,0|0,0,0]=1 1068 B19R2.13577 CN([13CH3])CCC(c1ccccc1)c2ccccc2 269982a_100025726140_200025704644 [0,0,0,0,1,0|0,0,0]=1 1069 B19R2.13577 CN([13CH3])CCC(c1ccccc1)c2ccccc2 34a_100025726140_200025704644 [0,0,0,0,1,0|0,0,0]=1 1070 B19R2.13577 C[C@@H](O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100009817552 [0,0,0,0,1,0|3,0,0]=4 1071 B19R2.13577 C[C@@H](O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100009817552 [0,0,0,0,1,0|3,0,0]=4 1072 B19R2.13577 C[C@@H](O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100009817552 [0,0,0,0,1,0|2,0,0]=3 1073 B19R2.13577 C[C@@H](O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100009817552 [0,0,0,0,1,0|2,0,0]=3 1074 B19R2.13577 C[C@@H](O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100009817552 [0,0,0,0,1,0|3,0,0]=4 1075 B19R2.13577 C[C@@H](O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100009817552 [0,0,0,0,1,0|2,1,0]=4 1076 B19R2.13577 C[C@@H](O)CSC(c1ccccc1)c2ccccc2 62a_100009817552_100011216954 [0,0,0,0,1,0|2,1,0]=4 1077 B19R2.13577 FC(F)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011934356 [0,0,0,0,1,0|3,0,0]=4 1078 B19R2.13577 FC(F)COC(c1ccccc1)c2ccccc2 7a_100000211180_100011934356 [0,0,0,0,1,0|3,0,0]=4 1079 B19R2.13577 NC(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000187820 [0,0,0,0,1,0|3,0,0]=4 1080 B19R2.13577 NC(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000187820 [0,0,0,0,1,0|3,0,0]=4 1081 B19R2.13577 O=C([O-])COC(c1ccccc1)c2ccccc2 34a_100000211180_100020667443 [0,0,0,0,1,0|3,0,0]=4 1082 B19R2.13577 O=[N+]([O-])COC(c1ccccc1)c2ccccc2 34a_100000211180_100000761209 [0,0,0,0,1,0|2,0,1]=4 1083 B19R2.13577 [13CH3]C(=O)CCP(c1ccccc1)c2ccccc2 1458a_100020644332_200025704644 [0,0,0,0,1,0|3,0,0]=4 1084 B19R2.13577 [13CH3]C(=O)CSC(c1ccccc1)c2ccccc2 1458a_100000683935_200025704644 [0,0,0,0,1,0|2,1,0]=4 1085 B21R2.12898 C=C(C)CCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000730704 [0,0,0,0,0,1|2,0,1]=4 1086 B21R2.12898 C=C(C)CCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000730704 [0,0,0,0,0,1|2,0,1]=4 1087 B21R2.12898 C=C(C)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000730704 [0,0,0,0,0,1|1,0,1]=3 1088 B21R2.12898 C=C(C)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000730704 [0,0,0,0,0,1|1,0,1]=3 1089 B21R2.12898 C=C(C)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000748629 [0,0,0,0,0,1|2,0,1]=4 1090 B21R2.12898 C=C(C)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000748629 [0,0,0,0,0,1|2,0,1]=4 1091 B21R2.12898 C=C(C)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000748629 [0,0,0,0,0,1|2,0,1]=4 1092 B21R2.12898 C=C(C)COCCC(c1ccccc1)c2ccccc2 34a_100000210245_100009813428 [0,0,0,0,0,1|2,0,1]=4 1093 B21R2.12898 C=C(C)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000748629 [0,0,0,0,0,1|2,0,1]=4 1094 B21R2.12898 C=C(C)CSCCC(c1ccccc1)c2ccccc2 62a_100000748629_100009813428 [0,0,0,0,0,1|2,0,1]=4 1095 B21R2.12898 C=C(C)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000211660 [0,0,0,0,0,1|2,0,1]=4 1096 B21R2.12898 CC(=CCCNC(c1ccccc1)c2ccccc2)C 2230a_100000162943_100011217483 [0,0,0,0,0,1|2,0,0]=3 1097 B21R2.12898 CC(=CCCNC(c1ccccc1)c2ccccc2)C 34a_100000162943_100011217483 [0,0,0,0,0,1|2,0,0]=3 1098 B21R2.12898 CC(=CCCNC(c1ccccc1)c2ccccn2)C 2230a_100000689936_100011217483 [0,0,0,0,0,1|3,0,0]=4 1099 B21R2.12898 CC(=CCCNC(c1ccccc1)c2cccnc2)C 2230a_100011232609_100011217483 [0,0,0,0,0,1|3,0,0]=4 1100 B21R2.12898 CC(=CCCNC(c1ccccc1)c2ccncc2)C 2230a_100025760769_100011217483 [0,0,0,0,0,1|3,0,0]=4 1101 B21R2.12898 CC(=CCCOC(c1ccccc1)c2ccccc2)C 34a_100000211180_100011217483 [0,0,0,0,0,1|1,0,0]=2 1102 B21R2.12898 CC(=CCCOC(c1ccccc1)c2ccccc2)C 7a_100000211180_100011217483 [0,0,0,0,0,1|1,0,0]=2 1103 B21R2.12898 CC(=CCCOC(c1ccccc1)c2ccccn2)C 7a_100000180852_100011217483 [0,0,0,0,0,1|2,0,0]=3 1104 B21R2.12898 CC(=CCCSC(c1ccccc1)c2ccccc2)C 62a_100000211591_100011217483 [0,0,0,0,0,1|1,1,0]=3 1105 B21R2.12898 CC(=CCCSC(c1ccccc1)c2ccccc2)C 62a_100011217483_100011216954 [0,0,0,0,0,1|1,1,0]=3 1106 B21R2.12898 CC(=CCNCC(c1ccccc1)c2ccccc2)C 2230a_100000739227_100000761012 [0,0,0,0,0,1|2,0,1]=4 1107 B21R2.12898 CC(=CCNCC(c1ccccc1)c2ccccc2)C 34a_100000739227_100000761012 [0,0,0,0,0,1|2,0,1]=4 1108 B21R2.12898 CC(=CCOCC(c1ccccc1)c2ccccc2)C 34a_100011215272_100000761012 [0,0,0,0,0,1|1,0,1]=3 1109 B21R2.12898 CC(=CCOCC(c1ccccc1)c2ccccc2)C 7a_100011215272_100000761012 [0,0,0,0,0,1|1,0,1]=3 1110 B21R2.12898 CC(=O)CCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000685027 [0,0,0,0,0,1|3,0,0]=4 1111 B21R2.12898 CC(=O)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000685027 [0,0,0,0,0,1|2,0,0]=3 1112 B21R2.12898 CC(=O)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011215641 [0,0,0,0,0,1|2,0,0]=3 1113 B21R2.12898 CC(=O)CCCOC(c1ccccc1)c2ccccc2 7a_100000759063_100011216954 [0,0,0,0,0,1|2,0,0]=3 1114 B21R2.12898 CC(=O)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011215641 [0,0,0,0,0,1|3,0,0]=4 1115 B21R2.12898 CC(=O)CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011215641 [0,0,0,0,0,1|2,1,0]=4 1116 B21R2.12898 CC(=O)CCCSC(c1ccccc1)c2ccccc2 62a_100011215641_100011216954 [0,0,0,0,0,1|2,1,0]=4 1117 B21R2.12898 CC(=O)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000053229 [0,0,0,0,0,1|2,0,0]=3 1118 B21R2.12898 CC(=O)COCCC(c1ccccc1)c2ccccc2 34a_100000211253_100009813428 [0,0,0,0,0,1|3,0,0]=4 1119 B21R2.12898 CC(=O)NCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000189650 [0,0,0,0,0,1|3,0,0]=4 1120 B21R2.12898 CC(=O)NCCNC(c1ccccc1)c2ccccc2 2230a_100000209853_100000211591 [0,0,0,0,0,1|3,0,0]=4 1121 B21R2.12898 CC(=O)NCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000189650 [0,0,0,0,0,1|2,0,0]=3 1122 B21R2.12898 CC(=O)NCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000189650 [0,0,0,0,0,1|3,0,0]=4 1123 B21R2.12898 CC(=O)NCCSC(c1ccccc1)c2ccccc2 62a_100000189650_100011216954 [0,0,0,0,0,1|2,1,0]=4 1124 B21R2.12898 CC(=O)NCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000189650 [0,0,0,0,0,1|2,1,0]=4 1125 B21R2.12898 CC(=O)OCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100009814007 [0,0,0,0,0,1|3,0,0]=4 1126 B21R2.12898 CC(=O)OCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100009814007 [0,0,0,0,0,1|2,0,0]=3 1127 B21R2.12898 CC(=O)OCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100009814007 [0,0,0,0,0,1|2,0,0]=3 1128 B21R2.12898 CC(=O)OCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100009814007 [0,0,0,0,0,1|3,0,0]=4 1129 B21R2.12898 CC(=O)OCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100009814007 [0,0,0,0,0,1|2,1,0]=4 1130 B21R2.12898 CC(=O)OCCSC(c1ccccc1)c2ccccc2 62a_100009814007_100011216954 [0,0,0,0,0,1|2,1,0]=4 1131 B21R2.12898 CC(=O)OCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100009813279 [0,0,0,0,0,1|3,0,0]=4 1132 B21R2.12898 CC(Br)COCCC(c1ccccc1)c2ccccc2 34a_100012180447_100009813428 [0,0,0,0,0,1|3,0,0]=4 1133 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011214892 [0,0,0,0,0,1|2,0,0]=3 1134 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2ccccc2 2230a_200000737386_100000211591 [0,0,0,0,0,1|2,0,0]=3 1135 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2ccccc2 270004a_200000737386_100000210122 [0,0,0,0,0,1|2,0,0]=3 1136 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011214892 [0,0,0,0,0,1|2,0,0]=3 1137 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100011214892 [0,0,0,0,0,1|3,0,0]=4 1138 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2ccccn2 270004a_200000737386_100000210380 [0,0,0,0,0,1|3,0,0]=4 1139 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100011214892 [0,0,0,0,0,1|3,0,0]=4 1140 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2cccnc2 270004a_200000737386_100000735413 [0,0,0,0,0,1|3,0,0]=4 1141 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100011214892 [0,0,0,0,0,1|3,0,0]=4 1142 B21R2.12898 CC(C)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011214892 [0,0,0,0,0,1|1,0,0]=2 1143 B21R2.12898 CC(C)CCCOC(c1ccccc1)c2ccccc2 7a_100000210774_100011216954 [0,0,0,0,0,1|1,0,0]=2 1144 B21R2.12898 CC(C)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011214892 [0,0,0,0,0,1|1,0,0]=2 1145 B21R2.12898 CC(C)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011214892 [0,0,0,0,0,1|2,0,0]=3 1146 B21R2.12898 CC(C)CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011214892 [0,0,0,0,0,1|1,1,0]=3 1147 B21R2.12898 CC(C)CCCSC(c1ccccc1)c2ccccc2 62a_100011214892_100011216954 [0,0,0,0,0,1|1,1,0]=3 1148 B21R2.12898 CC(C)CCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210312 [0,0,0,0,0,1|2,0,0]=3 1149 B21R2.12898 CC(C)CCNCC(c1ccccc1)c2ccccc2 269862a_100000739227_100000185833 [0,0,0,0,0,1|2,0,0]=3 1150 B21R2.12898 CC(C)CCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210312 [0,0,0,0,0,1|2,0,0]=3 1151 B21R2.12898 CC(C)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210312 [0,0,0,0,0,1|1,0,0]=2 1152 B21R2.12898 CC(C)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210626 [0,0,0,0,0,1|1,0,0]=2 1153 B21R2.12898 CC(C)CNCC=C(c1ccccc1)c2ccccc2 270004a_100000210953_100000050448 [0,0,0,0,0,1|2,0,1]=4 1154 B21R2.12898 CC(C)CNCCC(c1ccccc1)c2ccccc2 2230a_100000210953_100009813428 [0,0,0,0,0,1|2,0,0]=3 1155 B21R2.12898 CC(C)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000210760 [0,0,0,0,0,1|2,0,0]=3 1156 B21R2.12898 CC(C)CNCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000210432 [0,0,0,0,0,1|2,0,0]=3 1157 B21R2.12898 CC(C)CNCCC(c1ccccc1)c2ccccc2 34a_100000210953_100009813428 [0,0,0,0,0,1|2,0,0]=3 1158 B21R2.12898 CC(C)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000210624 [0,0,0,0,0,1|2,0,0]=3 1159 B21R2.12898 CC(C)CNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_100000210760 [0,0,0,0,0,1|3,0,0]=4 1160 B21R2.12898 CC(C)CNCCP(c1ccccc1)c2ccccc2 270004a_107094377242_100000210432 [0,0,0,0,0,1|3,0,0]=4 1161 B21R2.12898 CC(C)CNCCP(c1ccccc1)c2ccccc2 34a_107094377242_100000210624 [0,0,0,0,0,1|3,0,0]=4 1162 B21R2.12898 CC(C)CNCC[S+](c1ccccc1)c2ccccc2 2230a_100000210953_100010140906 [0,0,0,0,0,1|3,0,0]=4 1163 B21R2.12898 CC(C)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210624 [0,0,0,0,0,1|2,0,0]=3 1164 B21R2.12898 CC(C)COCCC(c1ccccc1)c2ccccc2 34a_100000210257_100009813428 [0,0,0,0,0,1|2,0,0]=3 1165 B21R2.12898 CC(C)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210760 [0,0,0,0,0,1|2,0,0]=3 1166 B21R2.12898 CC(C)COCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000210624 [0,0,0,0,0,1|3,0,0]=4 1167 B21R2.12898 CC(C)COCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000210760 [0,0,0,0,0,1|3,0,0]=4 1168 B21R2.12898 CC(C)CSCCC(c1ccccc1)c2ccccc2 62a_100000210624_100009813428 [0,0,0,0,0,1|2,0,0]=3 1169 B21R2.12898 CC(C)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000210760 [0,0,0,0,0,1|2,0,0]=3 1170 B21R2.12898 CC(C)CSCC[S+](c1ccccc1)c2ccccc2 62a_100000210624_100010140906 [0,0,0,0,0,1|3,0,0]=4 1171 B21R2.12898 CC(C)CSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000210760 [0,0,0,0,0,1|3,0,0]=4 1172 B21R2.12898 CC(C)NCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_100000210206 [0,0,0,0,0,1|3,0,0]=4 1173 B21R2.12898 CC(C)NCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100000210206 [0,0,0,0,0,1|3,0,0]=4 1174 B21R2.12898 CC(C)NCCOC(c1ccccc1)c2ccccc2 2230a_100138425928_100000734929 [0,0,0,0,0,1|1,0,0]=2 1175 B21R2.12898 CC(C)NCCOC(c1ccccc1)c2ccccc2 34a_100138425928_100000734929 [0,0,0,0,0,1|1,0,0]=2 1176 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000211751 [0,0,0,0,0,1|2,0,0]=3 1177 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2ccccc2 2230a_100000701111_100000211591 [0,0,0,0,0,1|2,0,0]=3 1178 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2ccccc2 270004a_100000701111_100000210122 [0,0,0,0,0,1|2,0,0]=3 1179 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000211751 [0,0,0,0,0,1|2,0,0]=3 1180 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000211751 [0,0,0,0,0,1|3,0,0]=4 1181 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2ccccn2 270004a_100000701111_100000210380 [0,0,0,0,0,1|3,0,0]=4 1182 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000211751 [0,0,0,0,0,1|3,0,0]=4 1183 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2cccnc2 270004a_100000701111_100000735413 [0,0,0,0,0,1|3,0,0]=4 1184 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000211751 [0,0,0,0,0,1|3,0,0]=4 1185 B21R2.12898 CC(C)OCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000211751 [0,0,0,0,0,1|1,0,0]=2 1186 B21R2.12898 CC(C)OCCOC(c1ccccc1)c2ccccc2 34a_100000212225_100000734929 [0,0,0,0,0,1|1,0,0]=2 1187 B21R2.12898 CC(C)OCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000211751 [0,0,0,0,0,1|1,0,0]=2 1188 B21R2.12898 CC(C)OCCOC(c1ccccc1)c2ccccc2 7a_100000211219_100011216954 [0,0,0,0,0,1|1,0,0]=2 1189 B21R2.12898 CC(C)OCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000211751 [0,0,0,0,0,1|2,0,0]=3 1190 B21R2.12898 CC(C)OCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000211751 [0,0,0,0,0,1|1,1,0]=3 1191 B21R2.12898 CC(C)OCCSC(c1ccccc1)c2ccccc2 62a_100000211751_100011216954 [0,0,0,0,0,1|1,1,0]=3 1192 B21R2.12898 CC(C)OCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000709892 [0,0,0,0,0,1|3,0,0]=4 1193 B21R2.12898 CC(C)OCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000709892 [0,0,0,0,0,1|3,0,0]=4 1194 B21R2.12898 CC(C)OCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000709892 [0,0,0,0,0,1|2,0,0]=3 1195 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000730970 [0,0,0,0,0,1|2,0,0]=3 1196 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2ccccc2 2230a_100000731138_100000211591 [0,0,0,0,0,1|2,0,0]=3 1197 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2ccccc2 270004a_100000731138_100000210122 [0,0,0,0,0,1|2,0,0]=3 1198 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000730970 [0,0,0,0,0,1|2,0,0]=3 1199 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000730970 [0,0,0,0,0,1|3,0,0]=4 1200 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2ccccn2 270004a_100000731138_100000210380 [0,0,0,0,0,1|3,0,0]=4 1201 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000730970 [0,0,0,0,0,1|3,0,0]=4 1202 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2cccnc2 270004a_100000731138_100000735413 [0,0,0,0,0,1|3,0,0]=4 1203 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000730970 [0,0,0,0,0,1|3,0,0]=4 1204 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000730970 [0,0,0,0,0,1|1,0,0]=2 1205 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccc2 62a_100000210206_100000734929 [0,0,0,0,0,1|1,0,0]=2 1206 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000210206 [0,0,0,0,0,1|1,0,0]=2 1207 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000730970 [0,0,0,0,0,1|1,0,0]=2 1208 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccc2 7a_200011212901_100011216954 [0,0,0,0,0,1|1,0,0]=2 1209 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000730970 [0,0,0,0,0,1|2,0,0]=3 1210 B21R2.12898 CC(C)SCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000730970 [0,0,0,0,0,1|1,1,0]=3 1211 B21R2.12898 CC(C)SCCSC(c1ccccc1)c2ccccc2 62a_100000730970_100011216954 [0,0,0,0,0,1|1,1,0]=3 1212 B21R2.12898 CC(F)COCCC(c1ccccc1)c2ccccc2 34a_100015925927_100009813428 [0,0,0,0,0,1|3,0,0]=4 1213 B21R2.12898 CC(O)CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_200000718107 [0,0,0,0,0,1|3,0,0]=4 1214 B21R2.12898 CC(O)CCCNC(c1ccccc1)c2ccccc2 34a_100000162943_200000718107 [0,0,0,0,0,1|3,0,0]=4 1215 B21R2.12898 CC(O)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_200000718107 [0,0,0,0,0,1|2,0,0]=3 1216 B21R2.12898 CC(O)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_200000718107 [0,0,0,0,0,1|2,0,0]=3 1217 B21R2.12898 CC(O)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_200000718107 [0,0,0,0,0,1|3,0,0]=4 1218 B21R2.12898 CC(O)CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_200000718107 [0,0,0,0,0,1|2,1,0]=4 1219 B21R2.12898 CC(O)CCCSC(c1ccccc1)c2ccccc2 62a_200000718107_100011216954 [0,0,0,0,0,1|2,1,0]=4 1220 B21R2.12898 CC(O)CCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100012276601 [0,0,0,0,0,1|3,0,0]=4 1221 B21R2.12898 CC(O)CCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100012276601 [0,0,0,0,0,1|3,0,0]=4 1222 B21R2.12898 CC(O)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100012276601 [0,0,0,0,0,1|2,0,0]=3 1223 B21R2.12898 CC(O)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100012276601 [0,0,0,0,0,1|2,0,0]=3 1224 B21R2.12898 CC(O)CNCCC(c1ccccc1)c2ccccc2 2230a_100000210904_100009813428 [0,0,0,0,0,1|3,0,0]=4 1225 B21R2.12898 CC(O)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011218427 [0,0,0,0,0,1|3,0,0]=4 1226 B21R2.12898 CC(O)CNCCC(c1ccccc1)c2ccccc2 34a_100000210904_100009813428 [0,0,0,0,0,1|3,0,0]=4 1227 B21R2.12898 CC(O)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011218427 [0,0,0,0,0,1|3,0,0]=4 1228 B21R2.12898 CC(O)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011218427 [0,0,0,0,0,1|3,0,0]=4 1229 B21R2.12898 CC(O)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100011218427 [0,0,0,0,0,1|3,0,0]=4 1230 B21R2.12898 CC(O)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011218427 [0,0,0,0,0,1|3,0,0]=4 1231 B21R2.12898 CC(O)CSCCC(c1ccccc1)c2ccccc2 62a_100011218427_100009813428 [0,0,0,0,0,1|3,0,0]=4 1232 B21R2.12898 CN(C)CCCNC(c1ccccc1)c2ccccc2 270004a_102531767803_100000210122 [0,0,0,0,0,1|1,0,0]=2 1233 B21R2.12898 CN(C)CCCNC(c1ccccc1)c2ccccn2 270004a_102531767803_100000210380 [0,0,0,0,0,1|2,0,0]=3 1234 B21R2.12898 CN(C)CCCNC(c1ccccc1)c2cccnc2 270004a_102531767803_100000735413 [0,0,0,0,0,1|2,0,0]=3 1235 B21R2.12898 CN(C)CCCNC(c1cccnc1)c2ccccn2 270004a_102531767803_100011376182 [0,0,0,0,0,1|3,0,0]=4 1236 B21R2.12898 CN(C)CCCNC(c1cccnc1)c2cccnc2 270004a_102531767803_200011376183 [0,0,0,0,0,1|3,0,0]=4 1237 B21R2.12898 CN(C)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000757444 [0,0,0,0,0,1|0,0,0]=1 1238 B21R2.12898 CN(C)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000757444 [0,0,0,0,0,1|1,0,0]=2 1239 B21R2.12898 CN(C)CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000757444 [0,0,0,0,0,1|0,1,0]=2 1240 B21R2.12898 CN(C)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000755713 [0,0,0,0,0,1|0,0,0]=1 1241 B21R2.12898 CS(=O)CCCNC(c1ccccc1)c2ccccc2 2230a_200000753449_100000211591 [0,0,0,0,0,1|3,0,0]=4 1242 B21R2.12898 CS(=O)CCCNC(c1ccccc1)c2ccccc2 270004a_200000753449_100000210122 [0,0,0,0,0,1|3,0,0]=4 1243 B21R2.12898 C[C@@H](Cl)COCCC(c1ccccc1)c2ccccc2 34a_100016084084_100009813428 [0,0,0,0,0,1|3,0,0]=4 1244 B21R2.12898 C[C@@H](N)COCCC(c1ccccc1)c2ccccc2 34a_100000737577_100009813428 [0,0,0,0,0,1|3,0,0]=4 1245 B21R2.12898 C[C@@H](O)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100009817552 [0,0,0,0,0,1|3,0,0]=4 1246 B21R2.12898 C[C@@H](O)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100009817552 [0,0,0,0,0,1|3,0,0]=4 1247 B21R2.12898 C[C@@H](O)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100009817552 [0,0,0,0,0,1|3,0,0]=4 1248 B21R2.12898 C[C@@H](O)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100009817552 [0,0,0,0,0,1|3,0,0]=4 1249 B21R2.12898 C[C@@H](O)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100009817552 [0,0,0,0,0,1|3,0,0]=4 1250 B21R2.12898 C[C@@H](O)CSCCC(c1ccccc1)c2ccccc2 62a_100009817552_100009813428 [0,0,0,0,0,1|3,0,0]=4 1251 B21R2.12898 FC(=CCCOC(c1ccccc1)c2ccccc2)F 34a_100000211180_200009816681 [0,0,0,0,0,1|3,0,0]=4 1252 B21R2.12898 FC(=CCCOC(c1ccccc1)c2ccccc2)F 7a_100000211180_200009816681 [0,0,0,0,0,1|3,0,0]=4 1253 B21R2.12898 NC(=O)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100102525003 [0,0,0,0,0,1|3,0,0]=4 1254 B21R2.12898 NC(=O)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100102525003 [0,0,0,0,0,1|3,0,0]=4 1255 B21R2.12898 NC(=O)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000731001 [0,0,0,0,0,1|3,0,0]=4 1256 B21R2.12898 NC(=O)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000744528 [0,0,0,0,0,1|3,0,0]=4 1257 B21R2.12898 NC(=O)NCCOC(c1ccccc1)c2ccccc2 7a_100000211180_200000034859 [0,0,0,0,0,1|3,0,0]=4 1258 B21R2.12898 NC(=O)OCCOC(c1ccccc1)c2ccccc2 34a_100000211180_200011214921 [0,0,0,0,0,1|3,0,0]=4 1259 B21R2.12898 NC(=O)OCCOC(c1ccccc1)c2ccccc2 7a_100000211180_200011214921 [0,0,0,0,0,1|3,0,0]=4 1260 B21R2.12898 NC(=O)OCCOC(c1ccccc1)c2ccccc2 7a_100000766696_100011216954 [0,0,0,0,0,1|3,0,0]=4 1261 B21R2.12899 C=C(C)CCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000730704 [0,0,0,0,0,1|2,0,1]=4 1262 B21R2.12899 C=C(C)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000730704 [0,0,0,0,0,1|1,0,1]=3 1263 B21R2.12899 C=C(C)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000730704 [0,0,0,0,0,1|1,0,1]=3 1264 B21R2.12899 CC(=CCNC(Cc1ccccc1)c2ccccc2)C 2230a_100025772854_100000761012 [0,0,0,0,0,1|2,0,1]=4 1265 B21R2.12899 CC(=CCOC(Cc1ccccc1)c2ccccc2)C 34a_100000246494_100000761012 [0,0,0,0,0,1|1,0,1]=3 1266 B21R2.12899 CC(=CCOC(Cc1ccccc1)c2ccccc2)C 7a_100000246494_100000761012 [0,0,0,0,0,1|1,0,1]=3 1267 B21R2.12899 CC(=O)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000053229 [0,0,0,0,0,1|2,0,0]=3 1268 B21R2.12899 CC(=O)OCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100009813279 [0,0,0,0,0,1|3,0,0]=4 1269 B21R2.12899 CC(C)CCCN(Cc1ccccc1)c2ccccc2 2230a_100000188819_100011214892 [0,0,0,0,0,1|3,0,0]=4 1270 B21R2.12899 CC(C)CCCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100011214892 [0,0,0,0,0,1|3,0,0]=4 1271 B21R2.12899 CC(C)CCCN(Cc1ccccc1)c2ccccc2 34a_100000188819_100011214892 [0,0,0,0,0,1|3,0,0]=4 1272 B21R2.12899 CC(C)CCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000210312 [0,0,0,0,0,1|2,0,0]=3 1273 B21R2.12899 CC(C)CCNC(Cc1ccccc1)c2ccccc2 269862a_100025772854_100000185833 [0,0,0,0,0,1|2,0,0]=3 1274 B21R2.12899 CC(C)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000210312 [0,0,0,0,0,1|1,0,0]=2 1275 B21R2.12899 CC(C)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000210626 [0,0,0,0,0,1|1,0,0]=2 1276 B21R2.12899 CC(C)OCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000709892 [0,0,0,0,0,1|3,0,0]=4 1277 B21R2.12899 CC(C)OCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000709892 [0,0,0,0,0,1|2,0,0]=3 1278 B21R2.12899 CC(O)CCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100012276601 [0,0,0,0,0,1|3,0,0]=4 1279 B21R2.12899 CC(O)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100012276601 [0,0,0,0,0,1|2,0,0]=3 1280 B21R2.12899 CC(O)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100012276601 [0,0,0,0,0,1|2,0,0]=3 1281 B21R2.12899 CN(C)CCCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000757444 [0,0,0,0,0,1|2,0,0]=3 1282 B21R2.12899 CN(C)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000755713 [0,0,0,0,0,1|0,0,0]=1 1283 B21R2.12899 NC(=O)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000731001 [0,0,0,0,0,1|3,0,0]=4 1284 B21R2.12899 NC(=O)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000744528 [0,0,0,0,0,1|3,0,0]=4 1285 B18R2.40 C#CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000184674 [2,0,0,0,0,0|0,0,2]=4 1286 B18R2.40 C#CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000038162 [2,0,0,0,0,0|0,0,2]=4 1287 B18R2.40 C=CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100015514636 [2,0,0,0,0,0|0,0,2]=4 1288 B18R2.40 C=CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100015514636 [2,0,0,0,0,0|0,0,2]=4 1289 B18R2.40 CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210303 [2,0,0,0,0,0|1,0,0]=3 1290 B18R2.40 CCCNC(c1ccccc1)c2ccccc2 270004a_100020643023_100000210122 [2,0,0,0,0,0|1,0,0]=3 1291 B18R2.40 CCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210303 [2,0,0,0,0,0|1,0,0]=3 1292 B18R2.40 CCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210303 [2,0,0,0,0,0|2,0,0]=4 1293 B18R2.40 CCCNC(c1ccccc1)c2ccccn2 270004a_100020643023_100000210380 [2,0,0,0,0,0|2,0,0]=4 1294 B18R2.40 CCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000210303 [2,0,0,0,0,0|2,0,0]=4 1295 B18R2.40 CCCNC(c1ccccc1)c2cccnc2 270004a_100020643023_100000735413 [2,0,0,0,0,0|2,0,0]=4 1296 B18R2.40 CCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000210303 [2,0,0,0,0,0|2,0,0]=4 1297 B18R2.40 CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210303 [2,0,0,0,0,0|0,0,0]=2 1298 B18R2.40 CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210303 [2,0,0,0,0,0|0,0,0]=2 1299 B18R2.40 CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210303 [2,0,0,0,0,0|1,0,0]=3 1300 B18R2.40 CCCSC(c1ccccc1)c2ccccc2 62a_100000210303_100011216954 [2,0,0,0,0,0|0,1,0]=3 1301 B18R2.40 CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000210303 [2,0,0,0,0,0|0,1,0]=3 1302 B18R2.40 CCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210202 [2,0,0,0,0,0|2,0,0]=4 1303 B18R2.40 CCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210202 [2,0,0,0,0,0|2,0,0]=4 1304 B18R2.40 CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210202 [2,0,0,0,0,0|2,0,0]=4 1305 B18R2.40 CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210202 [2,0,0,0,0,0|2,0,0]=4 1306 B18R2.40 CNCC=C(c1ccccc1)c2ccccc2 270004a_106832991635_100000050448 [2,0,0,0,0,0|0,0,2]=4 1307 B18R2.40 CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_200000210301 [2,0,0,0,0,0|0,0,0]=2 1308 B18R2.40 CNCCC(c1ccccc1)c2ccccc2 2230a_106832991635_100009813428 [2,0,0,0,0,0|0,0,0]=2 1309 B18R2.40 CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_200000210301 [2,0,0,0,0,0|0,0,0]=2 1310 B18R2.40 CNCCC(c1ccccc1)c2ccccc2 34a_100102657272_100009813428 [2,0,0,0,0,0|0,0,0]=2 1311 B18R2.40 CNCCC(c1ccccc1)c2ccccc2 7a_106832991635_100009813428 [2,0,0,0,0,0|0,0,0]=2 1312 B18R2.40 CNCCP(c1ccccc1)c2ccccc2 2230a_107094377242_200000210301 [2,0,0,0,0,0|1,0,0]=3 1313 B18R2.40 CNCCP(c1ccccc1)c2ccccc2 34a_107094377242_200000210301 [2,0,0,0,0,0|1,0,0]=3 1314 B18R2.40 CNCC[S+](c1ccccc1)c2ccccc2 2230a_106832991635_100010140906 [2,0,0,0,0,0|1,0,0]=3 1315 B18R2.40 CNCC[S+](c1ccccc1)c2ccccc2 7a_106832991635_100010140906 [2,0,0,0,0,0|1,0,0]=3 1316 B18R2.40 COCCC(c1ccccc1)c2ccccc2 34a_100000032380_200000210301 [2,0,0,0,0,0|1,0,0]=3 1317 B18R2.40 COCCC(c1ccccc1)c2ccccc2 34a_100138415774_100009813428 [2,0,0,0,0,0|1,0,0]=3 1318 B18R2.40 COCCC(c1ccccc1)c2ccccc2 7a_100000032380_200000210301 [2,0,0,0,0,0|1,0,0]=3 1319 B18R2.40 COCCN(c1ccccc1)c2ccccc2 34a_100010001939_200000210301 [2,0,0,0,0,0|2,0,0]=4 1320 B18R2.40 COCCN(c1ccccc1)c2ccccc2 7a_100010001939_200000210301 [2,0,0,0,0,0|2,0,0]=4 1321 B18R2.40 COCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000766300 [2,0,0,0,0,0|2,0,0]=4 1322 B18R2.40 COCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000766300 [2,0,0,0,0,0|1,1,0]=4 1323 B18R2.40 COCSC(c1ccccc1)c2ccccc2 62a_100000766300_100011216954 [2,0,0,0,0,0|1,1,0]=4 1324 B18R2.40 CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_200000210301 [2,0,0,0,0,0|1,0,0]=3 1325 B18R2.40 CSCCC(c1ccccc1)c2ccccc2 62a_200000210301_100009813428 [2,0,0,0,0,0|1,0,0]=3 1326 B18R2.40 CSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_200000210301 [2,0,0,0,0,0|2,0,0]=4 1327 B18R2.40 CSCC[S+](c1ccccc1)c2ccccc2 62a_200000210301_100010140906 [2,0,0,0,0,0|2,0,0]=4 1328 B18R2.40 CSCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011218213 [2,0,0,0,0,0|2,0,0]=4 1329 B18R2.40 CSCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011218213 [2,0,0,0,0,0|2,0,0]=4 1330 B18R2.40 CSCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011218213 [2,0,0,0,0,0|1,0,0]=3 1331 B18R2.40 CSCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011218213 [2,0,0,0,0,0|1,1,0]=4 1332 B18R2.40 CSCSC(c1ccccc1)c2ccccc2 62a_100011218213_100011216954 [2,0,0,0,0,0|1,1,0]=4 1333 B18R2.40 FCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011217306 [2,0,0,0,0,0|2,0,0]=4 1334 B18R2.40 FCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011217306 [2,0,0,0,0,0|2,0,0]=4 1335 B18R2.40 FCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011217306 [2,0,0,0,0,0|1,0,0]=3 1336 B18R2.40 FCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011217306 [2,0,0,0,0,0|1,0,0]=3 1337 B18R2.40 FCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011217306 [2,0,0,0,0,0|2,0,0]=4 1338 B18R2.40 FCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011217306 [2,0,0,0,0,0|1,1,0]=4 1339 B18R2.40 FCCSC(c1ccccc1)c2ccccc2 62a_100011217306_100011216954 [2,0,0,0,0,0|1,1,0]=4 1340 B18R2.40 N#CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011215382 [2,0,0,0,0,0|0,0,2]=4 1341 B18R2.40 O=CCOC(c1ccccc1)c2ccccc2 34a_100000211180_200009817547 [2,0,0,0,0,0|1,0,1]=4 1342 B18R2.40 O=CCOC(c1ccccc1)c2ccccc2 7a_100000211180_200015260668 [2,0,0,0,0,0|1,0,1]=4 1343 B18R2.40 OCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000211926 [2,0,0,0,0,0|2,0,0]=4 1344 B18R2.40 OCCNC(c1ccccc1)c2ccccc2 2230a_100016997473_100000211591 [2,0,0,0,0,0|2,0,0]=4 1345 B18R2.40 OCCNC(c1ccccc1)c2ccccc2 270004a_100000210304_100000210122 [2,0,0,0,0,0|2,0,0]=4 1346 B18R2.40 OCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000211926 [2,0,0,0,0,0|2,0,0]=4 1347 B18R2.40 OCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000211926 [2,0,0,0,0,0|1,0,0]=3 1348 B18R2.40 OCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000211926 [2,0,0,0,0,0|1,0,0]=3 1349 B18R2.40 OCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000211926 [2,0,0,0,0,0|2,0,0]=4 1350 B18R2.40 OCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000211926 [2,0,0,0,0,0|1,1,0]=4 1351 B18R2.40 OCCSC(c1ccccc1)c2ccccc2 62a_100000211926_100011216954 [2,0,0,0,0,0|1,1,0]=4 1352 B18R2.40 [13CH3]NCCC(c1ccccc1)c2ccccc2 2230a_100000272388_200025704644 [2,0,0,0,0,0|0,0,0]=2 1353 B18R2.40 [13CH3]NCCC(c1ccccc1)c2ccccc2 34a_100000272388_200025704644 [2,0,0,0,0,0|0,0,0]=2 1354 B18R2.40 [13CH3]NCCP(c1ccccc1)c2ccccc2 2230a_107094377242_200025704644 [2,0,0,0,0,0|1,0,0]=3 1355 B18R2.40 [13CH3]NCCP(c1ccccc1)c2ccccc2 34a_107094377242_200025704644 [2,0,0,0,0,0|1,0,0]=3 1356 B18R2.40 [13CH3]OCCC(c1ccccc1)c2ccccc2 34a_100000032380_200025704644 [2,0,0,0,0,0|1,0,0]=3 1357 B18R2.40 [13CH3]OCCC(c1ccccc1)c2ccccc2 7a_100000032380_200025704644 [2,0,0,0,0,0|1,0,0]=3 1358 B18R2.40 [13CH3]OCCN(c1ccccc1)c2ccccc2 34a_100010001939_200025704644 [2,0,0,0,0,0|2,0,0]=4 1359 B18R2.40 [13CH3]OCCN(c1ccccc1)c2ccccc2 7a_100010001939_200025704644 [2,0,0,0,0,0|2,0,0]=4 1360 B18R2.40 [13CH3]SCCC(c1ccccc1)c2ccccc2 62a_100009813428_200025704644 [2,0,0,0,0,0|1,0,0]=3 1361 B18R2.40 [13CH3]SCCC(c1ccccc1)c2ccccc2 62a_200025704644_100009813428 [2,0,0,0,0,0|1,0,0]=3 1362 B18R2.40 [13CH3]SCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_200025704644 [2,0,0,0,0,0|2,0,0]=4 1363 B18R2.40 [13CH3]SCC[S+](c1ccccc1)c2ccccc2 62a_200025704644_100010140906 [2,0,0,0,0,0|2,0,0]=4 1364 B20R2.2498 C#CCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000688953 [1,1,0,0,0,0|1,0,1]=4 1365 B20R2.2498 C#CCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000688953 [1,1,0,0,0,0|1,0,1]=4 1366 B20R2.2498 C#CCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000688953 [1,1,0,0,0,0|1,0,1]=4 1367 B20R2.2498 C#CCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000688953 [1,1,0,0,0,0|1,0,1]=4 1368 B20R2.2498 C/C=C/COC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100102629194 [1,1,0,0,0,0|1,0,1]=4 1369 B20R2.2498 C/C=C/COC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100102629194 [1,1,0,0,0,0|1,0,1]=4 1370 B20R2.2498 C/C=C/COC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100102629194 [1,1,0,0,0,0|1,0,1]=4 1371 B20R2.2498 C/C=C/COC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100102629194 [1,1,0,0,0,0|1,0,1]=4 1372 B20R2.2498 C=CCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000754431 [1,1,0,0,0,0|1,0,1]=4 1373 B20R2.2498 C=CCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000754431 [1,1,0,0,0,0|1,0,1]=4 1374 B20R2.2498 C=CCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000754431 [1,1,0,0,0,0|1,0,1]=4 1375 B20R2.2498 C=CCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000754431 [1,1,0,0,0,0|1,0,1]=4 1376 B20R2.2498 CC#CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000748600 [1,1,0,0,0,0|1,0,1]=4 1377 B20R2.2498 CC#CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000748600 [1,1,0,0,0,0|1,0,1]=4 1378 B20R2.2498 CC#CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000748600 [1,1,0,0,0,0|1,0,1]=4 1379 B20R2.2498 CC#CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000748600 [1,1,0,0,0,0|1,0,1]=4 1380 B20R2.2498 CC=CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000070051 [1,1,0,0,0,0|1,0,1]=4 1381 B20R2.2498 CC=CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000070051 [1,1,0,0,0,0|1,0,1]=4 1382 B20R2.2498 CC=CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000070051 [1,1,0,0,0,0|1,0,1]=4 1383 B20R2.2498 CC=CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000070051 [1,1,0,0,0,0|1,0,1]=4 1384 B20R2.2498 CCCCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000210211 [1,1,0,0,0,0|2,0,0]=4 1385 B20R2.2498 CCCCNC(c1ccccc1)c2cccc(c2)Br 270004a_100000102301_100011267660 [1,1,0,0,0,0|2,0,0]=4 1386 B20R2.2498 CCCCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000210210 [1,1,0,0,0,0|2,0,0]=4 1387 B20R2.2498 CCCCNC(c1ccccc1)c2cccc(c2)C 270004a_100000102301_100011217825 [1,1,0,0,0,0|2,0,0]=4 1388 B20R2.2498 CCCCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000210211 [1,1,0,0,0,0|2,0,0]=4 1389 B20R2.2498 CCCCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000102301_100011215489 [1,1,0,0,0,0|2,0,0]=4 1390 B20R2.2498 CCCCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000210210 [1,1,0,0,0,0|2,0,0]=4 1391 B20R2.2498 CCCCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000210211 [1,1,0,0,0,0|2,0,0]=4 1392 B20R2.2498 CCCCNC(c1ccccc1)c2cccc(c2)F 270004a_100000102301_200011219850 [1,1,0,0,0,0|2,0,0]=4 1393 B20R2.2498 CCCCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000210210 [1,1,0,0,0,0|2,0,0]=4 1394 B20R2.2498 CCCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000210210 [1,1,0,0,0,0|1,0,0]=3 1395 B20R2.2498 CCCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000210211 [1,1,0,0,0,0|1,0,0]=3 1396 B20R2.2498 CCCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000210210 [1,1,0,0,0,0|1,0,0]=3 1397 B20R2.2498 CCCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000210211 [1,1,0,0,0,0|1,0,0]=3 1398 B20R2.2498 COCCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100011201679 [1,1,0,0,0,0|2,0,0]=4 1399 B20R2.2498 COCCNC(c1ccccc1)c2cccc(c2)Br 270004a_100000209980_100011267660 [1,1,0,0,0,0|2,0,0]=4 1400 B20R2.2498 COCCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100011201679 [1,1,0,0,0,0|2,0,0]=4 1401 B20R2.2498 COCCNC(c1ccccc1)c2cccc(c2)C 270004a_100000209980_100011217825 [1,1,0,0,0,0|2,0,0]=4 1402 B20R2.2498 COCCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100011201679 [1,1,0,0,0,0|2,0,0]=4 1403 B20R2.2498 COCCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000209980_100011215489 [1,1,0,0,0,0|2,0,0]=4 1404 B20R2.2498 COCCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100011201679 [1,1,0,0,0,0|2,0,0]=4 1405 B20R2.2498 COCCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100011201679 [1,1,0,0,0,0|2,0,0]=4 1406 B20R2.2498 COCCNC(c1ccccc1)c2cccc(c2)F 270004a_100000209980_200011219850 [1,1,0,0,0,0|2,0,0]=4 1407 B20R2.2498 COCCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100011201679 [1,1,0,0,0,0|2,0,0]=4 1408 B20R2.2498 COCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100011201679 [1,1,0,0,0,0|1,0,0]=3 1409 B20R2.2498 COCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000233755 [1,1,0,0,0,0|1,0,0]=3 1410 B20R2.2498 COCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100011201679 [1,1,0,0,0,0|1,0,0]=3 1411 B20R2.2498 COCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000233755 [1,1,0,0,0,0|1,0,0]=3 1412 B20R2.2498 CSCCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000751147 [1,1,0,0,0,0|2,0,0]=4 1413 B20R2.2498 CSCCNC(c1ccccc1)c2cccc(c2)Br 270004a_100020590264_100011267660 [1,1,0,0,0,0|2,0,0]=4 1414 B20R2.2498 CSCCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000212216 [1,1,0,0,0,0|2,0,0]=4 1415 B20R2.2498 CSCCNC(c1ccccc1)c2cccc(c2)C 270004a_100020590264_100011217825 [1,1,0,0,0,0|2,0,0]=4 1416 B20R2.2498 CSCCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000751147 [1,1,0,0,0,0|2,0,0]=4 1417 B20R2.2498 CSCCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100020590264_100011215489 [1,1,0,0,0,0|2,0,0]=4 1418 B20R2.2498 CSCCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000212216 [1,1,0,0,0,0|2,0,0]=4 1419 B20R2.2498 CSCCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000751147 [1,1,0,0,0,0|2,0,0]=4 1420 B20R2.2498 CSCCNC(c1ccccc1)c2cccc(c2)F 270004a_100020590264_200011219850 [1,1,0,0,0,0|2,0,0]=4 1421 B20R2.2498 CSCCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000212216 [1,1,0,0,0,0|2,0,0]=4 1422 B20R2.2498 CSCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000212216 [1,1,0,0,0,0|1,0,0]=3 1423 B20R2.2498 CSCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000212216 [1,1,0,0,0,0|1,0,0]=3 1424 B20R2.2498 CSCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000212216 [1,1,0,0,0,0|1,0,0]=3 1425 B20R2.2498 CSCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000212216 [1,1,0,0,0,0|1,0,0]=3 1426 B20R2.2498 FCCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100011934791 [1,1,0,0,0,0|2,0,0]=4 1427 B20R2.2498 FCCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100011934791 [1,1,0,0,0,0|2,0,0]=4 1428 B20R2.2498 FCCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100011934791 [1,1,0,0,0,0|2,0,0]=4 1429 B20R2.2498 FCCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100011934791 [1,1,0,0,0,0|2,0,0]=4 1430 B20R2.2498 N#CCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000184422 [1,1,0,0,0,0|2,0,0]=4 1431 B20R2.2498 N#CCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000184422 [1,1,0,0,0,0|2,0,0]=4 1432 B20R2.2498 OCCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000230001 [1,1,0,0,0,0|2,0,0]=4 1433 B20R2.2498 OCCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100011215043 [1,1,0,0,0,0|2,0,0]=4 1434 B20R2.2498 OCCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000230001 [1,1,0,0,0,0|2,0,0]=4 1435 B20R2.2498 OCCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100011215043 [1,1,0,0,0,0|2,0,0]=4 1436 B20R2.2501 C#CCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000688953 [1,1,0,0,0,0|1,0,1]=4 1437 B20R2.2501 C#CCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000688953 [1,1,0,0,0,0|1,0,1]=4 1438 B20R2.2501 C#CCCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100000688953 [1,1,0,0,0,0|1,0,1]=4 1439 B20R2.2501 C#CCCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000688953 [1,1,0,0,0,0|1,0,1]=4 1440 B20R2.2501 C#CCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000688953 [1,1,0,0,0,0|1,0,1]=4 1441 B20R2.2501 C#CCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000688953 [1,1,0,0,0,0|1,0,1]=4 1442 B20R2.2501 C#CCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000688953 [1,1,0,0,0,0|1,0,1]=4 1443 B20R2.2501 C#CCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000688953 [1,1,0,0,0,0|1,0,1]=4 1444 B20R2.2501 C#CCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000688953 [1,1,0,0,0,0|1,0,1]=4 1445 B20R2.2501 C#CCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000688953 [1,1,0,0,0,0|1,0,1]=4 1446 B20R2.2501 C/C=C/COC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100102629194 [1,1,0,0,0,0|1,0,1]=4 1447 B20R2.2501 C/C=C/COC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100102629194 [1,1,0,0,0,0|1,0,1]=4 1448 B20R2.2501 C/C=C/COC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100102629194 [1,1,0,0,0,0|1,0,1]=4 1449 B20R2.2501 C/C=C/COC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100102629194 [1,1,0,0,0,0|1,0,1]=4 1450 B20R2.2501 C/C=C/COC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100102629194 [1,1,0,0,0,0|1,0,1]=4 1451 B20R2.2501 C/C=C/COC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100102629194 [1,1,0,0,0,0|1,0,1]=4 1452 B20R2.2501 C/C=C/COC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100102629194 [1,1,0,0,0,0|1,0,1]=4 1453 B20R2.2501 C/C=C/COC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100102629194 [1,1,0,0,0,0|1,0,1]=4 1454 B20R2.2501 C/C=C/COC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100102629194 [1,1,0,0,0,0|1,0,1]=4 1455 B20R2.2501 C/C=C/COC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100102629194 [1,1,0,0,0,0|1,0,1]=4 1456 B20R2.2501 C=CCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000754431 [1,1,0,0,0,0|1,0,1]=4 1457 B20R2.2501 C=CCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000754431 [1,1,0,0,0,0|1,0,1]=4 1458 B20R2.2501 C=CCCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100000754431 [1,1,0,0,0,0|1,0,1]=4 1459 B20R2.2501 C=CCCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000754431 [1,1,0,0,0,0|1,0,1]=4 1460 B20R2.2501 C=CCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000754431 [1,1,0,0,0,0|1,0,1]=4 1461 B20R2.2501 C=CCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000754431 [1,1,0,0,0,0|1,0,1]=4 1462 B20R2.2501 C=CCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000754431 [1,1,0,0,0,0|1,0,1]=4 1463 B20R2.2501 C=CCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000754431 [1,1,0,0,0,0|1,0,1]=4 1464 B20R2.2501 C=CCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000754431 [1,1,0,0,0,0|1,0,1]=4 1465 B20R2.2501 C=CCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000754431 [1,1,0,0,0,0|1,0,1]=4 1466 B20R2.2501 CC#CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000748600 [1,1,0,0,0,0|1,0,1]=4 1467 B20R2.2501 CC#CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000748600 [1,1,0,0,0,0|1,0,1]=4 1468 B20R2.2501 CC#CCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100000748600 [1,1,0,0,0,0|1,0,1]=4 1469 B20R2.2501 CC#CCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000748600 [1,1,0,0,0,0|1,0,1]=4 1470 B20R2.2501 CC#CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000748600 [1,1,0,0,0,0|1,0,1]=4 1471 B20R2.2501 CC#CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000748600 [1,1,0,0,0,0|1,0,1]=4 1472 B20R2.2501 CC#CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000748600 [1,1,0,0,0,0|1,0,1]=4 1473 B20R2.2501 CC#CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000748600 [1,1,0,0,0,0|1,0,1]=4 1474 B20R2.2501 CC#CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000748600 [1,1,0,0,0,0|1,0,1]=4 1475 B20R2.2501 CC#CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000748600 [1,1,0,0,0,0|1,0,1]=4 1476 B20R2.2501 CC=CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000070051 [1,1,0,0,0,0|1,0,1]=4 1477 B20R2.2501 CC=CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000070051 [1,1,0,0,0,0|1,0,1]=4 1478 B20R2.2501 CC=CCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100000070051 [1,1,0,0,0,0|1,0,1]=4 1479 B20R2.2501 CC=CCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000070051 [1,1,0,0,0,0|1,0,1]=4 1480 B20R2.2501 CC=CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000070051 [1,1,0,0,0,0|1,0,1]=4 1481 B20R2.2501 CC=CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000070051 [1,1,0,0,0,0|1,0,1]=4 1482 B20R2.2501 CC=CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000070051 [1,1,0,0,0,0|1,0,1]=4 1483 B20R2.2501 CC=CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000070051 [1,1,0,0,0,0|1,0,1]=4 1484 B20R2.2501 CC=CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000070051 [1,1,0,0,0,0|1,0,1]=4 1485 B20R2.2501 CC=CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000070051 [1,1,0,0,0,0|1,0,1]=4 1486 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000210211 [1,1,0,0,0,0|2,0,0]=4 1487 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000102301_100000718703 [1,1,0,0,0,0|2,0,0]=4 1488 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000210210 [1,1,0,0,0,0|2,0,0]=4 1489 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)C 2230a_100000736602_100000210211 [1,1,0,0,0,0|2,0,0]=4 1490 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)C 270004a_100000102301_100000210966 [1,1,0,0,0,0|2,0,0]=4 1491 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)C 34a_100000736602_100000210210 [1,1,0,0,0,0|2,0,0]=4 1492 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000102301_100000211669 [1,1,0,0,0,0|2,0,0]=4 1493 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000210211 [1,1,0,0,0,0|2,0,0]=4 1494 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000102301_100000211064 [1,1,0,0,0,0|2,0,0]=4 1495 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000210210 [1,1,0,0,0,0|2,0,0]=4 1496 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)Cl 7a_106832991798_100000211669 [1,1,0,0,0,0|2,0,0]=4 1497 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000210211 [1,1,0,0,0,0|2,0,0]=4 1498 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000102301_100000210425 [1,1,0,0,0,0|2,0,0]=4 1499 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000210210 [1,1,0,0,0,0|2,0,0]=4 1500 B20R2.2501 CCCCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000210210 [1,1,0,0,0,0|2,0,0]=4 1501 B20R2.2501 CCCCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000210210 [1,1,0,0,0,0|2,0,0]=4 1502 B20R2.2501 CCCCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000210227_200010188304 [1,1,0,0,0,0|2,0,0]=4 1503 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000210210 [1,1,0,0,0,0|1,0,0]=3 1504 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000210211 [1,1,0,0,0,0|1,0,0]=3 1505 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100000210210 [1,1,0,0,0,0|1,0,0]=3 1506 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000210211 [1,1,0,0,0,0|1,0,0]=3 1507 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000210210 [1,1,0,0,0,0|1,0,0]=3 1508 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000210227_100000211669 [1,1,0,0,0,0|1,0,0]=3 1509 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000210211 [1,1,0,0,0,0|1,0,0]=3 1510 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000210210 [1,1,0,0,0,0|1,0,0]=3 1511 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000210211 [1,1,0,0,0,0|1,0,0]=3 1512 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000210210 [1,1,0,0,0,0|1,0,0]=3 1513 B20R2.2501 CCCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000210211 [1,1,0,0,0,0|1,0,0]=3 1514 B20R2.2501 CCCCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000210210 [1,1,0,0,0,0|2,0,0]=4 1515 B20R2.2501 CCCCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000210211_100000211669 [1,1,0,0,0,0|1,1,0]=4 1516 B20R2.2501 CCCCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000210210 [1,1,0,0,0,0|1,1,0]=4 1517 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100011201679 [1,1,0,0,0,0|2,0,0]=4 1518 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000209980_100000718703 [1,1,0,0,0,0|2,0,0]=4 1519 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100011201679 [1,1,0,0,0,0|2,0,0]=4 1520 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)C 2230a_100000736602_100011201679 [1,1,0,0,0,0|2,0,0]=4 1521 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)C 270004a_100000209980_100000210966 [1,1,0,0,0,0|2,0,0]=4 1522 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)C 34a_100000736602_100011201679 [1,1,0,0,0,0|2,0,0]=4 1523 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000209980_100000211669 [1,1,0,0,0,0|2,0,0]=4 1524 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100011201679 [1,1,0,0,0,0|2,0,0]=4 1525 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000209980_100000211064 [1,1,0,0,0,0|2,0,0]=4 1526 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100011201679 [1,1,0,0,0,0|2,0,0]=4 1527 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100011201679 [1,1,0,0,0,0|2,0,0]=4 1528 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000209980_100000210425 [1,1,0,0,0,0|2,0,0]=4 1529 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100011201679 [1,1,0,0,0,0|2,0,0]=4 1530 B20R2.2501 COCCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100011201679 [1,1,0,0,0,0|2,0,0]=4 1531 B20R2.2501 COCCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100011201679 [1,1,0,0,0,0|2,0,0]=4 1532 B20R2.2501 COCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100011201679 [1,1,0,0,0,0|1,0,0]=3 1533 B20R2.2501 COCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000233755 [1,1,0,0,0,0|1,0,0]=3 1534 B20R2.2501 COCCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100011201679 [1,1,0,0,0,0|1,0,0]=3 1535 B20R2.2501 COCCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000233755 [1,1,0,0,0,0|1,0,0]=3 1536 B20R2.2501 COCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100011201679 [1,1,0,0,0,0|1,0,0]=3 1537 B20R2.2501 COCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000233755 [1,1,0,0,0,0|1,0,0]=3 1538 B20R2.2501 COCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100011201679 [1,1,0,0,0,0|1,0,0]=3 1539 B20R2.2501 COCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000233755 [1,1,0,0,0,0|1,0,0]=3 1540 B20R2.2501 COCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100011201679 [1,1,0,0,0,0|1,0,0]=3 1541 B20R2.2501 COCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000233755 [1,1,0,0,0,0|1,0,0]=3 1542 B20R2.2501 COCCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100011201679 [1,1,0,0,0,0|2,0,0]=4 1543 B20R2.2501 COCCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000233755 [1,1,0,0,0,0|1,1,0]=4 1544 B20R2.2501 COCCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000233755_100000211669 [1,1,0,0,0,0|1,1,0]=4 1545 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000751147 [1,1,0,0,0,0|2,0,0]=4 1546 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100020590264_100000718703 [1,1,0,0,0,0|2,0,0]=4 1547 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000212216 [1,1,0,0,0,0|2,0,0]=4 1548 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)C 2230a_100000736602_100000751147 [1,1,0,0,0,0|2,0,0]=4 1549 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)C 270004a_100020590264_100000210966 [1,1,0,0,0,0|2,0,0]=4 1550 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)C 34a_100000736602_100000212216 [1,1,0,0,0,0|2,0,0]=4 1551 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000751147 [1,1,0,0,0,0|2,0,0]=4 1552 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100020590264_100000211669 [1,1,0,0,0,0|2,0,0]=4 1553 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100020590264_100000211064 [1,1,0,0,0,0|2,0,0]=4 1554 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000212216 [1,1,0,0,0,0|2,0,0]=4 1555 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000751147 [1,1,0,0,0,0|2,0,0]=4 1556 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)F 270004a_100020590264_100000210425 [1,1,0,0,0,0|2,0,0]=4 1557 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000212216 [1,1,0,0,0,0|2,0,0]=4 1558 B20R2.2501 CSCCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000212216 [1,1,0,0,0,0|2,0,0]=4 1559 B20R2.2501 CSCCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000212216 [1,1,0,0,0,0|2,0,0]=4 1560 B20R2.2501 CSCCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000230434_200010188304 [1,1,0,0,0,0|2,0,0]=4 1561 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000212216 [1,1,0,0,0,0|1,0,0]=3 1562 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000212216 [1,1,0,0,0,0|1,0,0]=3 1563 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100000212216 [1,1,0,0,0,0|1,0,0]=3 1564 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000212216 [1,1,0,0,0,0|1,0,0]=3 1565 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000212216 [1,1,0,0,0,0|1,0,0]=3 1566 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000212216 [1,1,0,0,0,0|1,0,0]=3 1567 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000230434_100000211669 [1,1,0,0,0,0|1,0,0]=3 1568 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000212216 [1,1,0,0,0,0|1,0,0]=3 1569 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000212216 [1,1,0,0,0,0|1,0,0]=3 1570 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000212216 [1,1,0,0,0,0|1,0,0]=3 1571 B20R2.2501 CSCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000212216 [1,1,0,0,0,0|1,0,0]=3 1572 B20R2.2501 CSCCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000212216 [1,1,0,0,0,0|2,0,0]=4 1573 B20R2.2501 CSCCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000751147 [1,1,0,0,0,0|1,1,0]=4 1574 B20R2.2501 CSCCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000212216_100000211669 [1,1,0,0,0,0|1,1,0]=4 1575 B20R2.2501 Cc1ccc(cc1)C(OCCC#N)c2ccccc2 7a_100000212064_100000184422 [1,1,0,0,0,0|2,0,0]=4 1576 B20R2.2501 Cc1ccc(cc1)C(OCCCF)c2ccccc2 34a_100000212064_100011934791 [1,1,0,0,0,0|2,0,0]=4 1577 B20R2.2501 Cc1ccc(cc1)C(OCCCF)c2ccccc2 7a_100000212064_100011934791 [1,1,0,0,0,0|2,0,0]=4 1578 B20R2.2501 Cc1ccc(cc1)C(OCCCO)c2ccccc2 34a_100000212064_100000230001 [1,1,0,0,0,0|2,0,0]=4 1579 B20R2.2501 Cc1ccc(cc1)C(OCCCO)c2ccccc2 7a_100000212064_100011215043 [1,1,0,0,0,0|2,0,0]=4 1580 B20R2.2501 FCCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100011934791 [1,1,0,0,0,0|2,0,0]=4 1581 B20R2.2501 FCCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100011934791 [1,1,0,0,0,0|2,0,0]=4 1582 B20R2.2501 FCCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100011934791 [1,1,0,0,0,0|2,0,0]=4 1583 B20R2.2501 FCCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100011934791 [1,1,0,0,0,0|2,0,0]=4 1584 B20R2.2501 FCCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100011934791 [1,1,0,0,0,0|2,0,0]=4 1585 B20R2.2501 FCCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100011934791 [1,1,0,0,0,0|2,0,0]=4 1586 B20R2.2501 N#CCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000184422 [1,1,0,0,0,0|2,0,0]=4 1587 B20R2.2501 N#CCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000184422 [1,1,0,0,0,0|2,0,0]=4 1588 B20R2.2501 N#CCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000184422 [1,1,0,0,0,0|2,0,0]=4 1589 B20R2.2501 N#CCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000184422 [1,1,0,0,0,0|2,0,0]=4 1590 B20R2.2501 Nc1ccc(cc1)C(OCCCF)c2ccccc2 34a_100011236343_100011934791 [1,1,0,0,0,0|2,0,0]=4 1591 B20R2.2501 Nc1ccc(cc1)C(OCCCF)c2ccccc2 7a_100011236343_100011934791 [1,1,0,0,0,0|2,0,0]=4 1592 B20R2.2501 Nc1ccc(cc1)C(OCCCO)c2ccccc2 34a_100011236343_100000230001 [1,1,0,0,0,0|2,0,0]=4 1593 B20R2.2501 Nc1ccc(cc1)C(OCCCO)c2ccccc2 7a_100011236343_100011215043 [1,1,0,0,0,0|2,0,0]=4 1594 B20R2.2501 OCCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000230001 [1,1,0,0,0,0|2,0,0]=4 1595 B20R2.2501 OCCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100011215043 [1,1,0,0,0,0|2,0,0]=4 1596 B20R2.2501 OCCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000230001 [1,1,0,0,0,0|2,0,0]=4 1597 B20R2.2501 OCCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100011215043 [1,1,0,0,0,0|2,0,0]=4 1598 B20R2.2501 OCCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000230001 [1,1,0,0,0,0|2,0,0]=4 1599 B20R2.2501 OCCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100011215043 [1,1,0,0,0,0|2,0,0]=4 1600 B20R2.4159 C#CCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000695029 [1,1,0,0,0,0|1,0,1]=4 1601 B20R2.4159 C#CCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011215417 [1,1,0,0,0,0|1,0,1]=4 1602 B20R2.4159 C#CCCCOC(c1ccccc1)c2ccccc2 7a_100000215630_100011216954 [1,1,0,0,0,0|1,0,1]=4 1603 B20R2.4159 C#CCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000688953 [1,1,0,0,0,0|1,0,1]=4 1604 B20R2.4159 C#CCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000688953 [1,1,0,0,0,0|1,0,1]=4 1605 B20R2.4159 C/C=C/COCC(c1ccccc1)c2ccccc2 34a_100011215272_100102629194 [1,1,0,0,0,0|1,0,1]=4 1606 B20R2.4159 C/C=C/COCC(c1ccccc1)c2ccccc2 7a_100011215272_100102629194 [1,1,0,0,0,0|1,0,1]=4 1607 B20R2.4159 C=CCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000757094 [1,1,0,0,0,0|1,0,1]=4 1608 B20R2.4159 C=CCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000757094 [1,1,0,0,0,0|1,0,1]=4 1609 B20R2.4159 C=CCCCOC(c1ccccc1)c2ccccc2 7a_100000758997_100011216954 [1,1,0,0,0,0|1,0,1]=4 1610 B20R2.4159 C=CCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000754431 [1,1,0,0,0,0|1,0,1]=4 1611 B20R2.4159 C=CCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000754431 [1,1,0,0,0,0|1,0,1]=4 1612 B20R2.4159 C=COCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000039644 [1,1,0,0,0,0|1,0,1]=4 1613 B20R2.4159 C=COCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000039644 [1,1,0,0,0,0|1,0,1]=4 1614 B20R2.4159 CC#CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000748600 [1,1,0,0,0,0|1,0,1]=4 1615 B20R2.4159 CC#CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000748600 [1,1,0,0,0,0|1,0,1]=4 1616 B20R2.4159 CC/C=C\COC(c1ccccc1)c2ccccc2 34a_100000211180_100103147603 [1,1,0,0,0,0|1,0,1]=4 1617 B20R2.4159 CC/C=C\COC(c1ccccc1)c2ccccc2 7a_100000211180_100103147603 [1,1,0,0,0,0|1,0,1]=4 1618 B20R2.4159 CC=CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000070051 [1,1,0,0,0,0|1,0,1]=4 1619 B20R2.4159 CC=CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000070051 [1,1,0,0,0,0|1,0,1]=4 1620 B20R2.4159 CCC#CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100009813939 [1,1,0,0,0,0|1,0,1]=4 1621 B20R2.4159 CCC#CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100009813939 [1,1,0,0,0,0|1,0,1]=4 1622 B20R2.4159 CCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210326 [1,1,0,0,0,0|2,0,0]=4 1623 B20R2.4159 CCCCCNC(c1ccccc1)c2ccccc2 2230a_100000209983_100000211591 [1,1,0,0,0,0|2,0,0]=4 1624 B20R2.4159 CCCCCNC(c1ccccc1)c2ccccc2 270004a_100000209983_100000210122 [1,1,0,0,0,0|2,0,0]=4 1625 B20R2.4159 CCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000718602 [1,1,0,0,0,0|2,0,0]=4 1626 B20R2.4159 CCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000718602 [1,1,0,0,0,0|1,0,0]=3 1627 B20R2.4159 CCCCCOC(c1ccccc1)c2ccccc2 7a_100000210253_100011216954 [1,1,0,0,0,0|1,0,0]=3 1628 B20R2.4159 CCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210326 [1,1,0,0,0,0|1,0,0]=3 1629 B20R2.4159 CCCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210326 [1,1,0,0,0,0|2,0,0]=4 1630 B20R2.4159 CCCCCSC(c1ccccc1)c2ccccc2 62a_100000210326_100011216954 [1,1,0,0,0,0|1,1,0]=4 1631 B20R2.4159 CCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000210326 [1,1,0,0,0,0|1,1,0]=4 1632 B20R2.4159 CCCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000210211 [1,1,0,0,0,0|2,0,0]=4 1633 B20R2.4159 CCCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210210 [1,1,0,0,0,0|2,0,0]=4 1634 B20R2.4159 CCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210210 [1,1,0,0,0,0|1,0,0]=3 1635 B20R2.4159 CCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210211 [1,1,0,0,0,0|1,0,0]=3 1636 B20R2.4159 CCCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000210303 [1,1,0,0,0,0|2,0,0]=4 1637 B20R2.4159 CCCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000210303 [1,1,0,0,0,0|2,0,0]=4 1638 B20R2.4159 CCCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210303 [1,1,0,0,0,0|2,0,0]=4 1639 B20R2.4159 CCCOCCC(c1ccccc1)c2ccccc2 34a_100000210258_100009813428 [1,1,0,0,0,0|2,0,0]=4 1640 B20R2.4159 CCCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210303 [1,1,0,0,0,0|2,0,0]=4 1641 B20R2.4159 CCCSCCC(c1ccccc1)c2ccccc2 62a_100000210303_100009813428 [1,1,0,0,0,0|2,0,0]=4 1642 B20R2.4159 CCCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000210303 [1,1,0,0,0,0|2,0,0]=4 1643 B20R2.4159 CCNCCCP(c1ccccc1)c2ccccc2 2230a_100016990410_100000210202 [1,1,0,0,0,0|2,0,0]=4 1644 B20R2.4159 CCNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100000210202 [1,1,0,0,0,0|2,0,0]=4 1645 B20R2.4159 CCNCCOC(c1ccccc1)c2ccccc2 2230a_100015525214_100000734929 [1,1,0,0,0,0|0,0,0]=2 1646 B20R2.4159 CCOCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011215890 [1,1,0,0,0,0|2,0,0]=4 1647 B20R2.4159 CCOCCNC(c1ccccc1)c2ccccc2 2230a_102516460346_100000211591 [1,1,0,0,0,0|2,0,0]=4 1648 B20R2.4159 CCOCCNC(c1ccccc1)c2ccccc2 270004a_102516460346_100000210122 [1,1,0,0,0,0|2,0,0]=4 1649 B20R2.4159 CCOCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210147 [1,1,0,0,0,0|2,0,0]=4 1650 B20R2.4159 CCOCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210147 [1,1,0,0,0,0|1,0,0]=3 1651 B20R2.4159 CCOCCOC(c1ccccc1)c2ccccc2 34a_100121572206_100000734929 [1,1,0,0,0,0|1,0,0]=3 1652 B20R2.4159 CCOCCOC(c1ccccc1)c2ccccc2 7a_100000210136_100011216954 [1,1,0,0,0,0|1,0,0]=3 1653 B20R2.4159 CCOCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011215890 [1,1,0,0,0,0|1,0,0]=3 1654 B20R2.4159 CCOCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011215890 [1,1,0,0,0,0|2,0,0]=4 1655 B20R2.4159 CCOCCSC(c1ccccc1)c2ccccc2 62a_100000210147_100011216954 [1,1,0,0,0,0|1,1,0]=4 1656 B20R2.4159 CCOCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100011215890 [1,1,0,0,0,0|1,1,0]=4 1657 B20R2.4159 CCSCCNC(c1ccccc1)c2ccccc2 2230a_100000106463_100000211591 [1,1,0,0,0,0|2,0,0]=4 1658 B20R2.4159 CCSCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000757381 [1,1,0,0,0,0|2,0,0]=4 1659 B20R2.4159 CCSCCNC(c1ccccc1)c2ccccc2 270004a_100000106463_100000210122 [1,1,0,0,0,0|2,0,0]=4 1660 B20R2.4159 CCSCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000757381 [1,1,0,0,0,0|2,0,0]=4 1661 B20R2.4159 CCSCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000757381 [1,1,0,0,0,0|1,0,0]=3 1662 B20R2.4159 CCSCCOC(c1ccccc1)c2ccccc2 62a_100000210202_100000734929 [1,1,0,0,0,0|1,0,0]=3 1663 B20R2.4159 CCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000210202 [1,1,0,0,0,0|1,0,0]=3 1664 B20R2.4159 CCSCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000757381 [1,1,0,0,0,0|1,0,0]=3 1665 B20R2.4159 CCSCCOC(c1ccccc1)c2ccccc2 7a_100000212035_100011216954 [1,1,0,0,0,0|1,0,0]=3 1666 B20R2.4159 CCSCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000757381 [1,1,0,0,0,0|2,0,0]=4 1667 B20R2.4159 CCSCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000757381 [1,1,0,0,0,0|1,1,0]=4 1668 B20R2.4159 CCSCCSC(c1ccccc1)c2ccccc2 62a_100000757381_100011216954 [1,1,0,0,0,0|1,1,0]=4 1669 B20R2.4159 COCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000740836 [1,1,0,0,0,0|2,0,0]=4 1670 B20R2.4159 COCCCNC(c1ccccc1)c2ccccc2 270004a_100150723488_100000210122 [1,1,0,0,0,0|2,0,0]=4 1671 B20R2.4159 COCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000740836 [1,1,0,0,0,0|2,0,0]=4 1672 B20R2.4159 COCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000740836 [1,1,0,0,0,0|1,0,0]=3 1673 B20R2.4159 COCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000740836 [1,1,0,0,0,0|1,0,0]=3 1674 B20R2.4159 COCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000740836 [1,1,0,0,0,0|2,0,0]=4 1675 B20R2.4159 COCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000709357 [1,1,0,0,0,0|1,1,0]=4 1676 B20R2.4159 COCCCSC(c1ccccc1)c2ccccc2 62a_100000709357_100011216954 [1,1,0,0,0,0|1,1,0]=4 1677 B20R2.4159 COCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011201679 [1,1,0,0,0,0|2,0,0]=4 1678 B20R2.4159 COCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011201679 [1,1,0,0,0,0|2,0,0]=4 1679 B20R2.4159 COCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100011201679 [1,1,0,0,0,0|1,0,0]=3 1680 B20R2.4159 COCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000233755 [1,1,0,0,0,0|1,0,0]=3 1681 B20R2.4159 COCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000766300 [1,1,0,0,0,0|2,0,0]=4 1682 B20R2.4159 COCSCCC(c1ccccc1)c2ccccc2 62a_100000766300_100009813428 [1,1,0,0,0,0|2,0,0]=4 1683 B20R2.4159 COCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000766300 [1,1,0,0,0,0|2,0,0]=4 1684 B20R2.4159 CSCCCNC(c1ccccc1)c2ccccc2 2230a_100000749238_100000211591 [1,1,0,0,0,0|2,0,0]=4 1685 B20R2.4159 CSCCCNC(c1ccccc1)c2ccccc2 270004a_100000749238_100000210122 [1,1,0,0,0,0|2,0,0]=4 1686 B20R2.4159 CSCCCOC(c1ccccc1)c2ccccc2 7a_100000690336_100011216954 [1,1,0,0,0,0|1,0,0]=3 1687 B20R2.4159 CSCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000751147 [1,1,0,0,0,0|2,0,0]=4 1688 B20R2.4159 CSCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000212216 [1,1,0,0,0,0|2,0,0]=4 1689 B20R2.4159 CSCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000212216 [1,1,0,0,0,0|1,0,0]=3 1690 B20R2.4159 CSCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000212216 [1,1,0,0,0,0|1,0,0]=3 1691 B20R2.4159 CSCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100011218213 [1,1,0,0,0,0|2,0,0]=4 1692 B20R2.4159 CSCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011218213 [1,1,0,0,0,0|2,0,0]=4 1693 B20R2.4159 CSCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011218213 [1,1,0,0,0,0|2,0,0]=4 1694 B20R2.4159 CSCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011218213 [1,1,0,0,0,0|2,0,0]=4 1695 B20R2.4159 CSCSCCC(c1ccccc1)c2ccccc2 62a_100011218213_100009813428 [1,1,0,0,0,0|2,0,0]=4 1696 B20R2.4159 ClCCCCOC(c1ccccc1)c2ccccc2 7a_100000210776_100011216954 [1,1,0,0,0,0|1,0,0]=3 1697 B20R2.4159 FCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000729493 [1,1,0,0,0,0|2,0,0]=4 1698 B20R2.4159 FCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000729493 [1,1,0,0,0,0|2,0,0]=4 1699 B20R2.4159 FCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000729493 [1,1,0,0,0,0|1,0,0]=3 1700 B20R2.4159 FCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000729493 [1,1,0,0,0,0|1,0,0]=3 1701 B20R2.4159 FCCCCOC(c1ccccc1)c2ccccc2 7a_100011995726_100011216954 [1,1,0,0,0,0|1,0,0]=3 1702 B20R2.4159 FCCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000729493 [1,1,0,0,0,0|2,0,0]=4 1703 B20R2.4159 FCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000729493 [1,1,0,0,0,0|1,1,0]=4 1704 B20R2.4159 FCCCCSC(c1ccccc1)c2ccccc2 62a_100000729493_100011216954 [1,1,0,0,0,0|1,1,0]=4 1705 B20R2.4159 FCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100011934791 [1,1,0,0,0,0|2,0,0]=4 1706 B20R2.4159 FCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100011934791 [1,1,0,0,0,0|2,0,0]=4 1707 B20R2.4159 FCNCCCP(c1ccccc1)c2ccccc2 34a_100016990410_100015361967 [1,1,0,0,0,0|2,0,0]=4 1708 B20R2.4159 FCSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100015361967 [1,1,0,0,0,0|1,0,0]=3 1709 B20R2.4159 FCSCCOC(c1ccccc1)c2ccccc2 62a_100015361967_100000734929 [1,1,0,0,0,0|1,0,0]=3 1710 B20R2.4159 N#CCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000687738 [1,1,0,0,0,0|1,0,1]=4 1711 B20R2.4159 N#CCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000184422 [1,1,0,0,0,0|2,0,0]=4 1712 B20R2.4159 O=CCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_200011292268 [1,1,0,0,0,0|1,0,1]=4 1713 B20R2.4159 OCC#CCOC(c1ccccc1)c2ccccc2 34a_100000211180_200000047223 [1,1,0,0,0,0|1,0,1]=4 1714 B20R2.4159 OCC#CCOC(c1ccccc1)c2ccccc2 7a_100000211180_200000047223 [1,1,0,0,0,0|1,0,1]=4 1715 B20R2.4159 OCCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210776 [1,1,0,0,0,0|2,0,0]=4 1716 B20R2.4159 OCCCCNC(c1ccccc1)c2ccccc2 2230a_100000750430_100000211591 [1,1,0,0,0,0|2,0,0]=4 1717 B20R2.4159 OCCCCNC(c1ccccc1)c2ccccc2 270004a_100000750430_100000210122 [1,1,0,0,0,0|2,0,0]=4 1718 B20R2.4159 OCCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011216708 [1,1,0,0,0,0|2,0,0]=4 1719 B20R2.4159 OCCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011216708 [1,1,0,0,0,0|1,0,0]=3 1720 B20R2.4159 OCCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210776 [1,1,0,0,0,0|1,0,0]=3 1721 B20R2.4159 OCCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210776 [1,1,0,0,0,0|2,0,0]=4 1722 B20R2.4159 OCCCCSC(c1ccccc1)c2ccccc2 62a_100000210776_100011216954 [1,1,0,0,0,0|1,1,0]=4 1723 B20R2.4159 OCCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000210776 [1,1,0,0,0,0|1,1,0]=4 1724 B20R2.4159 OCCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000230001 [1,1,0,0,0,0|2,0,0]=4 1725 B20R2.4159 OCCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100011215043 [1,1,0,0,0,0|2,0,0]=4 1726 B20R2.4986 CCCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210183_100011216954 [1,1,0,0,0,0|2,0,0]=4 1727 B20R2.4986 CCCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000210211 [1,1,0,0,0,0|2,0,0]=4 1728 B20R2.4986 CCCCN(C)C(c1ccccc1)c2ccccc2 2230a_100000207549_100000211591 [1,1,0,0,0,0|2,0,0]=4 1729 B20R2.4986 CCCCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000210211 [1,1,0,0,0,0|2,0,0]=4 1730 B20R2.4986 CCCCN(C)C(c1ccccc1)c2ccccc2 269982a_100000207549_100000211591 [1,1,0,0,0,0|2,0,0]=4 1731 B20R2.4986 CCCCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000210211 [1,1,0,0,0,0|2,0,0]=4 1732 B20R2.4986 CCCCN(C)C(c1ccccc1)c2ccccc2 270004a_100000207549_100000210122 [1,1,0,0,0,0|2,0,0]=4 1733 B20R2.4986 COCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000233755 [1,1,0,0,0,0|2,0,0]=4 1734 B20R2.4986 COCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000749529_100011216954 [1,1,0,0,0,0|2,0,0]=4 1735 B20R2.4986 COCCN(C)C(c1ccccc1)c2ccccc2 2230a_100000743101_100000211591 [1,1,0,0,0,0|2,0,0]=4 1736 B20R2.4986 COCCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100011201679 [1,1,0,0,0,0|2,0,0]=4 1737 B20R2.4986 COCCN(C)C(c1ccccc1)c2ccccc2 269982a_100000743101_100000211591 [1,1,0,0,0,0|2,0,0]=4 1738 B20R2.4986 COCCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000233755 [1,1,0,0,0,0|2,0,0]=4 1739 B20R2.4986 COCCN(C)C(c1ccccc1)c2ccccc2 270004a_100000743101_100000210122 [1,1,0,0,0,0|2,0,0]=4 1740 B20R2.4986 CSCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000174002_100011216954 [1,1,0,0,0,0|2,0,0]=4 1741 B20R2.4986 CSCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000751147 [1,1,0,0,0,0|2,0,0]=4 1742 B20R2.4986 CSCCN(C)C(c1ccccc1)c2ccccc2 2230a_100000686725_100000211591 [1,1,0,0,0,0|2,0,0]=4 1743 B20R2.4986 CSCCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000751147 [1,1,0,0,0,0|2,0,0]=4 1744 B20R2.4986 CSCCN(C)C(c1ccccc1)c2ccccc2 269982a_100000686725_100000211591 [1,1,0,0,0,0|2,0,0]=4 1745 B20R2.4986 CSCCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000212216 [1,1,0,0,0,0|2,0,0]=4 1746 B20R2.4986 CSCCN(C)C(c1ccccc1)c2ccccc2 270004a_100000686725_100000210122 [1,1,0,0,0,0|2,0,0]=4 1747 B20R2.14082 C#CCC(C)OC(c1ccccc1)c2ccccc2 7a_100000685586_100011216954 [1,1,0,0,0,0|1,0,1]=4 1748 B20R2.14082 C=CC[C@@H](C)OC(c1ccccc1)c2ccccc2 7a_100000731007_100011216954 [1,1,0,0,0,0|1,0,1]=4 1749 B20R2.14082 CC(CC#N)OC(c1ccccc1)c2ccccc2 7a_100000211180_100009813641 [1,1,0,0,0,0|2,0,0]=4 1750 B20R2.14082 CC(CCO)OC(c1ccccc1)c2ccccc2 34a_100000211180_100009893172 [1,1,0,0,0,0|2,0,0]=4 1751 B20R2.14082 CC(CCO)OC(c1ccccc1)c2ccccc2 7a_100000211180_100009893172 [1,1,0,0,0,0|2,0,0]=4 1752 B20R2.14082 CCCC(C)NC(c1ccccc1)c2ccccc2 2230a_100000162943_100000766640 [1,1,0,0,0,0|2,0,0]=4 1753 B20R2.14082 CCCC(C)NC(c1ccccc1)c2ccccc2 2230a_100000741246_100000211591 [1,1,0,0,0,0|2,0,0]=4 1754 B20R2.14082 CCCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000162943_100000211909 [1,1,0,0,0,0|2,0,0]=4 1755 B20R2.14082 CCCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000741246_100000210122 [1,1,0,0,0,0|2,0,0]=4 1756 B20R2.14082 CCCC(C)NC(c1ccccc1)c2ccccc2 34a_100000162943_100000766640 [1,1,0,0,0,0|2,0,0]=4 1757 B20R2.14082 CCCC(C)OC(c1ccccc1)c2ccccc2 34a_100000211180_100000766640 [1,1,0,0,0,0|1,0,0]=3 1758 B20R2.14082 CCCC(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_100000766640 [1,1,0,0,0,0|1,0,0]=3 1759 B20R2.14082 CCCC(C)OC(c1ccccc1)c2ccccc2 7a_100000764384_100011216954 [1,1,0,0,0,0|1,0,0]=3 1760 B20R2.14082 CCCC(C)OC(c1ccccc1)c2ccccn2 7a_100000180852_100000766640 [1,1,0,0,0,0|2,0,0]=4 1761 B20R2.14082 CCCC(C)SC(c1ccccc1)c2ccccc2 62a_100000211591_100000766640 [1,1,0,0,0,0|1,1,0]=4 1762 B20R2.14082 CCCC(C)SC(c1ccccc1)c2ccccc2 62a_100000766640_100011216954 [1,1,0,0,0,0|1,1,0]=4 1763 B20R2.14082 CNCC(=O)NC(c1ccccc1)c2ccccc2 2230a_100000589768_200000210301 [1,1,0,0,0,0|1,0,1]=4 1764 B20R2.14082 COCC(C)NC(c1ccccc1)c2ccccc2 2230a_100000162943_100000765312 [1,1,0,0,0,0|2,0,0]=4 1765 B20R2.14082 COCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000162943_100000749346 [1,1,0,0,0,0|2,0,0]=4 1766 B20R2.14082 COCC(C)NC(c1ccccc1)c2ccccc2 34a_100000162943_100000765312 [1,1,0,0,0,0|2,0,0]=4 1767 B20R2.14082 COCC(C)OC(c1ccccc1)c2ccccc2 34a_100000211180_100000765312 [1,1,0,0,0,0|1,0,0]=3 1768 B20R2.14082 COCC(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_100000765312 [1,1,0,0,0,0|1,0,0]=3 1769 B20R2.14082 COCC(C)OC(c1ccccc1)c2ccccn2 7a_100000180852_100000765312 [1,1,0,0,0,0|2,0,0]=4 1770 B20R2.14082 COCC(C)SC(c1ccccc1)c2ccccc2 62a_100000211591_100000765312 [1,1,0,0,0,0|1,1,0]=4 1771 B20R2.14082 COCC(C)SC(c1ccccc1)c2ccccc2 62a_100000765312_100011216954 [1,1,0,0,0,0|1,1,0]=4 1772 B20R2.14082 COC[C@@H](C)NC(c1ccccc1)c2ccccc2 2230a_100000764878_100000211591 [1,1,0,0,0,0|2,0,0]=4 1773 B20R2.14082 COC[C@@H](C)NC(c1ccccc1)c2ccccc2 270004a_100000764878_100000210122 [1,1,0,0,0,0|2,0,0]=4 1774 B20R2.14082 CSCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000162943_100011216314 [1,1,0,0,0,0|2,0,0]=4 1775 B20R2.14082 [13CH3]NCC(=O)NC(c1ccccc1)c2ccccc2 2230a_100000589768_200025704644 [1,1,0,0,0,0|1,0,1]=4 1776 B20R2.18148 C=CC(C)COC(c1ccccc1)c2ccccc2 7a_100011215527_100011216954 [1,1,0,0,0,0|1,0,1]=4 1777 B20R2.18148 C=CC(O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000730141 [1,1,0,0,0,0|1,0,1]=4 1778 B20R2.18148 C=CC(O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000730141 [1,1,0,0,0,0|1,0,1]=4 1779 B20R2.18148 CCC(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000747405 [1,1,0,0,0,0|1,0,1]=4 1780 B20R2.18148 CCC(C)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000748023 [1,1,0,0,0,0|2,0,0]=4 1781 B20R2.18148 CCC(C)CNC(c1ccccc1)c2ccccc2 2230a_100020588543_100000211591 [1,1,0,0,0,0|2,0,0]=4 1782 B20R2.18148 CCC(C)CNC(c1ccccc1)c2ccccc2 270004a_100000162943_100000243153 [1,1,0,0,0,0|2,0,0]=4 1783 B20R2.18148 CCC(C)CNC(c1ccccc1)c2ccccc2 270004a_100020588543_100000210122 [1,1,0,0,0,0|2,0,0]=4 1784 B20R2.18148 CCC(C)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000748023 [1,1,0,0,0,0|2,0,0]=4 1785 B20R2.18148 CCC(C)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000748023 [1,1,0,0,0,0|1,0,0]=3 1786 B20R2.18148 CCC(C)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000748023 [1,1,0,0,0,0|1,0,0]=3 1787 B20R2.18148 CCC(C)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000748023 [1,1,0,0,0,0|2,0,0]=4 1788 B20R2.18148 CCC(C)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000748023 [1,1,0,0,0,0|1,1,0]=4 1789 B20R2.18148 CCC(C)CSC(c1ccccc1)c2ccccc2 62a_100000748023_100011216954 [1,1,0,0,0,0|1,1,0]=4 1790 B20R2.18148 CCC(O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011218378 [1,1,0,0,0,0|2,0,0]=4 1791 B20R2.18148 CCC(O)CNC(c1ccccc1)c2ccccc2 2230a_100011218483_100000211591 [1,1,0,0,0,0|2,0,0]=4 1792 B20R2.18148 CCC(O)CNC(c1ccccc1)c2ccccc2 270004a_100011218483_100000210122 [1,1,0,0,0,0|2,0,0]=4 1793 B20R2.18148 CCC(O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100011218378 [1,1,0,0,0,0|2,0,0]=4 1794 B20R2.18148 CCC(O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011218378 [1,1,0,0,0,0|1,0,0]=3 1795 B20R2.18148 CCC(O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100011218378 [1,1,0,0,0,0|1,0,0]=3 1796 B20R2.18148 CCC(O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100011218378 [1,1,0,0,0,0|2,0,0]=4 1797 B20R2.18148 CCC(O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100011218378 [1,1,0,0,0,0|1,1,0]=4 1798 B20R2.18148 CCC(O)CSC(c1ccccc1)c2ccccc2 62a_100011218378_100011216954 [1,1,0,0,0,0|1,1,0]=4 1799 B20R2.18148 CC[C@H](C)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100009816398 [1,1,0,0,0,0|2,0,0]=4 1800 B20R2.18148 CC[C@H](C)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100009816398 [1,1,0,0,0,0|2,0,0]=4 1801 B20R2.18148 CC[C@H](C)COC(c1ccccc1)c2ccccc2 34a_100000211180_100009816398 [1,1,0,0,0,0|1,0,0]=3 1802 B20R2.18148 CC[C@H](C)COC(c1ccccc1)c2ccccc2 7a_100000211180_100009816398 [1,1,0,0,0,0|1,0,0]=3 1803 B20R2.18148 CC[C@H](C)COC(c1ccccc1)c2ccccc2 7a_100009816381_100011216954 [1,1,0,0,0,0|1,0,0]=3 1804 B20R2.18148 CC[C@H](C)COC(c1ccccc1)c2ccccn2 7a_100000180852_100009816398 [1,1,0,0,0,0|2,0,0]=4 1805 B20R2.18148 CC[C@H](C)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100009816398 [1,1,0,0,0,0|1,1,0]=4 1806 B20R2.18148 CC[C@H](C)CSC(c1ccccc1)c2ccccc2 62a_100009816398_100011216954 [1,1,0,0,0,0|1,1,0]=4 1807 B20R2.18148 CNC(=O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000183359 [1,1,0,0,0,0|1,0,1]=4 1808 B20R2.18148 CNC(=O)CNC(c1ccccc1)c2ccccc2 2230a_100000693194_100000211591 [1,1,0,0,0,0|1,0,1]=4 1809 B20R2.18148 CNC(=O)CNC(c1ccccc1)c2ccccc2 270004a_100000693194_100000210122 [1,1,0,0,0,0|1,0,1]=4 1810 B20R2.18148 CNC(=O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000183359 [1,1,0,0,0,0|1,0,1]=4 1811 B20R2.18148 CNC(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000183359 [1,1,0,0,0,0|0,0,1]=3 1812 B20R2.18148 CNC(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000183359 [1,1,0,0,0,0|0,0,1]=3 1813 B20R2.18148 CNC(=O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000183359 [1,1,0,0,0,0|1,0,1]=4 1814 B20R2.18148 CNC(=O)CSC(c1ccccc1)c2ccccc2 11a_106832991635_100000683935 [1,1,0,0,0,0|0,1,1]=4 1815 B20R2.18148 CNC(=O)CSC(c1ccccc1)c2ccccc2 1626a_100102657272_100000683935 [1,1,0,0,0,0|0,1,1]=4 1816 B20R2.18148 CNC(=O)CSC(c1ccccc1)c2ccccc2 240690a_100102657272_100000683935 [1,1,0,0,0,0|0,1,1]=4 1817 B20R2.18148 CNC(=O)CSC(c1ccccc1)c2ccccc2 527a_100102657272_100000683935 [1,1,0,0,0,0|0,1,1]=4 1818 B20R2.18148 CNC(=O)CSC(c1ccccc1)c2ccccc2 62a_100000183359_100011216954 [1,1,0,0,0,0|0,1,1]=4 1819 B20R2.18148 CNC(=O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000183359 [1,1,0,0,0,0|0,1,1]=4 1820 B20R2.18148 COC(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000747449 [1,1,0,0,0,0|1,0,1]=4 1821 B20R2.18148 COC(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000747449 [1,1,0,0,0,0|1,0,1]=4 1822 B20R2.18148 CO[C@H](C)CNC(c1ccccc1)c2ccccc2 2230a_100020591295_100000211591 [1,1,0,0,0,0|2,0,0]=4 1823 B20R2.18148 CO[C@H](C)CNC(c1ccccc1)c2ccccc2 270004a_100020591295_100000210122 [1,1,0,0,0,0|2,0,0]=4 1824 B20R2.18148 C[C@@H](CO)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000059175 [1,1,0,0,0,0|2,0,0]=4 1825 B20R2.18148 C[C@@H](CO)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000059175 [1,1,0,0,0,0|2,0,0]=4 1826 B20R2.18148 OCC(O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011219619 [1,1,0,0,0,0|2,0,0]=4 1827 B20R2.18148 OCC(O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100011219619 [1,1,0,0,0,0|2,0,0]=4 1828 B20R2.18148 OC[C@H](O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100009815848 [1,1,0,0,0,0|2,0,0]=4 1829 B20R2.18148 OC[C@H](O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100009815848 [1,1,0,0,0,0|2,0,0]=4 1830 B20R2.18148 O[C@@H](CF)COC(c1ccccc1)c2ccccc2 34a_100000211180_100015614560 [1,1,0,0,0,0|2,0,0]=4 1831 B20R2.18148 O[C@@H](CF)COC(c1ccccc1)c2ccccc2 7a_100000211180_100015614560 [1,1,0,0,0,0|2,0,0]=4 1832 B20R2.19886 C#CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000688953 [1,1,0,0,0,0|1,0,1]=4 1833 B20R2.19886 C/C=C/COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100102629194 [1,1,0,0,0,0|1,0,1]=4 1834 B20R2.19886 C=CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000754431 [1,1,0,0,0,0|1,0,1]=4 1835 B20R2.19886 CC#CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000748600 [1,1,0,0,0,0|1,0,1]=4 1836 B20R2.19886 CC(OCCC#N)(c1ccccc1)c2ccccc2 7a_100011202337_100000184422 [1,1,0,0,0,0|2,0,0]=4 1837 B20R2.19886 CC(OCCCF)(c1ccccc1)c2ccccc2 7a_100011202337_100011934791 [1,1,0,0,0,0|2,0,0]=4 1838 B20R2.19886 CC(OCCCO)(c1ccccc1)c2ccccc2 7a_100011202337_100011215043 [1,1,0,0,0,0|2,0,0]=4 1839 B20R2.19886 CC=CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000070051 [1,1,0,0,0,0|1,0,1]=4 1840 B20R2.19886 CCCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210211 [1,1,0,0,0,0|1,0,0]=3 1841 B20R2.19886 CCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000210211 [1,1,0,0,0,0|2,0,0]=4 1842 B20R2.19886 COCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000233755 [1,1,0,0,0,0|1,0,0]=3 1843 B20R2.19886 COCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000233755 [1,1,0,0,0,0|2,0,0]=4 1844 B20R2.19886 CSCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000212216 [1,1,0,0,0,0|1,0,0]=3 1845 B20R2.19886 CSCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000212216 [1,1,0,0,0,0|2,0,0]=4 1846 B20R2.21885 C#CCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000688953 [1,1,0,0,0,0|1,0,1]=4 1847 B20R2.21885 C#CCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000688953 [1,1,0,0,0,0|1,0,1]=4 1848 B20R2.21885 C#CCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000688953 [1,1,0,0,0,0|1,0,1]=4 1849 B20R2.21885 C#CCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000688953 [1,1,0,0,0,0|1,0,1]=4 1850 B20R2.21885 C#CCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000688953 [1,1,0,0,0,0|1,0,1]=4 1851 B20R2.21885 C#CCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000688953 [1,1,0,0,0,0|1,0,1]=4 1852 B20R2.21885 C/C=C/COC(c1ccccc1)c2ccccc2C 34a_100000212071_100102629194 [1,1,0,0,0,0|1,0,1]=4 1853 B20R2.21885 C/C=C/COC(c1ccccc1)c2ccccc2C 7a_100000212071_100102629194 [1,1,0,0,0,0|1,0,1]=4 1854 B20R2.21885 C/C=C/COC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100102629194 [1,1,0,0,0,0|1,0,1]=4 1855 B20R2.21885 C/C=C/COC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100102629194 [1,1,0,0,0,0|1,0,1]=4 1856 B20R2.21885 C/C=C/COC(c1ccccc1)c2ccccc2N 34a_100000246470_100102629194 [1,1,0,0,0,0|1,0,1]=4 1857 B20R2.21885 C/C=C/COC(c1ccccc1)c2ccccc2N 7a_100000246470_100102629194 [1,1,0,0,0,0|1,0,1]=4 1858 B20R2.21885 C=CCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000754431 [1,1,0,0,0,0|1,0,1]=4 1859 B20R2.21885 C=CCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000754431 [1,1,0,0,0,0|1,0,1]=4 1860 B20R2.21885 C=CCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000754431 [1,1,0,0,0,0|1,0,1]=4 1861 B20R2.21885 C=CCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000754431 [1,1,0,0,0,0|1,0,1]=4 1862 B20R2.21885 C=CCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000754431 [1,1,0,0,0,0|1,0,1]=4 1863 B20R2.21885 C=CCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000754431 [1,1,0,0,0,0|1,0,1]=4 1864 B20R2.21885 CC#CCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000748600 [1,1,0,0,0,0|1,0,1]=4 1865 B20R2.21885 CC#CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000748600 [1,1,0,0,0,0|1,0,1]=4 1866 B20R2.21885 CC#CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000748600 [1,1,0,0,0,0|1,0,1]=4 1867 B20R2.21885 CC#CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000748600 [1,1,0,0,0,0|1,0,1]=4 1868 B20R2.21885 CC#CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000748600 [1,1,0,0,0,0|1,0,1]=4 1869 B20R2.21885 CC#CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000748600 [1,1,0,0,0,0|1,0,1]=4 1870 B20R2.21885 CC=CCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000070051 [1,1,0,0,0,0|1,0,1]=4 1871 B20R2.21885 CC=CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000070051 [1,1,0,0,0,0|1,0,1]=4 1872 B20R2.21885 CC=CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000070051 [1,1,0,0,0,0|1,0,1]=4 1873 B20R2.21885 CC=CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000070051 [1,1,0,0,0,0|1,0,1]=4 1874 B20R2.21885 CC=CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000070051 [1,1,0,0,0,0|1,0,1]=4 1875 B20R2.21885 CC=CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000070051 [1,1,0,0,0,0|1,0,1]=4 1876 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000210211 [1,1,0,0,0,0|2,0,0]=4 1877 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2Br 270004a_100000102301_100000198044 [1,1,0,0,0,0|2,0,0]=4 1878 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000210210 [1,1,0,0,0,0|2,0,0]=4 1879 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2C 2230a_100000102301_100000230135 [1,1,0,0,0,0|2,0,0]=4 1880 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000210211 [1,1,0,0,0,0|2,0,0]=4 1881 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2C 270004a_100000102301_100000735561 [1,1,0,0,0,0|2,0,0]=4 1882 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000210210 [1,1,0,0,0,0|2,0,0]=4 1883 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2C 7a_106832991798_100000230135 [1,1,0,0,0,0|2,0,0]=4 1884 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2Cl 270004a_100000102301_100011215288 [1,1,0,0,0,0|2,0,0]=4 1885 B20R2.21885 CCCCNC(c1ccccc1)c2ccccc2F 270004a_100000102301_100011217773 [1,1,0,0,0,0|2,0,0]=4 1886 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000210210 [1,1,0,0,0,0|1,0,0]=3 1887 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2C 7a_100000210227_100000230135 [1,1,0,0,0,0|1,0,0]=3 1888 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000210211 [1,1,0,0,0,0|1,0,0]=3 1889 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000210210 [1,1,0,0,0,0|1,0,0]=3 1890 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000210211 [1,1,0,0,0,0|1,0,0]=3 1891 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000210210 [1,1,0,0,0,0|1,0,0]=3 1892 B20R2.21885 CCCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000210211 [1,1,0,0,0,0|1,0,0]=3 1893 B20R2.21885 CCCCSC(c1ccccc1)c2ccccc2C 62a_100000210211_100000230135 [1,1,0,0,0,0|1,1,0]=4 1894 B20R2.21885 CCCCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000210210 [1,1,0,0,0,0|1,1,0]=4 1895 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100011201679 [1,1,0,0,0,0|2,0,0]=4 1896 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2Br 270004a_100000209980_100000198044 [1,1,0,0,0,0|2,0,0]=4 1897 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100011201679 [1,1,0,0,0,0|2,0,0]=4 1898 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2C 2230a_100000209980_100000230135 [1,1,0,0,0,0|2,0,0]=4 1899 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100011201679 [1,1,0,0,0,0|2,0,0]=4 1900 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2C 270004a_100000209980_100000735561 [1,1,0,0,0,0|2,0,0]=4 1901 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100011201679 [1,1,0,0,0,0|2,0,0]=4 1902 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2Cl 270004a_100000209980_100011215288 [1,1,0,0,0,0|2,0,0]=4 1903 B20R2.21885 COCCNC(c1ccccc1)c2ccccc2F 270004a_100000209980_100011217773 [1,1,0,0,0,0|2,0,0]=4 1904 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100011201679 [1,1,0,0,0,0|1,0,0]=3 1905 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000233755 [1,1,0,0,0,0|1,0,0]=3 1906 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100011201679 [1,1,0,0,0,0|1,0,0]=3 1907 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000233755 [1,1,0,0,0,0|1,0,0]=3 1908 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100011201679 [1,1,0,0,0,0|1,0,0]=3 1909 B20R2.21885 COCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000233755 [1,1,0,0,0,0|1,0,0]=3 1910 B20R2.21885 COCCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000233755 [1,1,0,0,0,0|1,1,0]=4 1911 B20R2.21885 COCCSC(c1ccccc1)c2ccccc2C 62a_100000233755_100000230135 [1,1,0,0,0,0|1,1,0]=4 1912 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000751147 [1,1,0,0,0,0|2,0,0]=4 1913 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2Br 270004a_100020590264_100000198044 [1,1,0,0,0,0|2,0,0]=4 1914 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000212216 [1,1,0,0,0,0|2,0,0]=4 1915 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2C 2230a_100000222801_100000751147 [1,1,0,0,0,0|2,0,0]=4 1916 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2C 2230a_100020590264_100000230135 [1,1,0,0,0,0|2,0,0]=4 1917 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2C 270004a_100020590264_100000735561 [1,1,0,0,0,0|2,0,0]=4 1918 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2C 34a_100000222801_100000212216 [1,1,0,0,0,0|2,0,0]=4 1919 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2Cl 270004a_100020590264_100011215288 [1,1,0,0,0,0|2,0,0]=4 1920 B20R2.21885 CSCCNC(c1ccccc1)c2ccccc2F 270004a_100020590264_100011217773 [1,1,0,0,0,0|2,0,0]=4 1921 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000212216 [1,1,0,0,0,0|1,0,0]=3 1922 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000212216 [1,1,0,0,0,0|1,0,0]=3 1923 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2C 7a_100000230434_100000230135 [1,1,0,0,0,0|1,0,0]=3 1924 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000212216 [1,1,0,0,0,0|1,0,0]=3 1925 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000212216 [1,1,0,0,0,0|1,0,0]=3 1926 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000212216 [1,1,0,0,0,0|1,0,0]=3 1927 B20R2.21885 CSCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000212216 [1,1,0,0,0,0|1,0,0]=3 1928 B20R2.21885 CSCCSC(c1ccccc1)c2ccccc2C 62a_100000212216_100000230135 [1,1,0,0,0,0|1,1,0]=4 1929 B20R2.21885 CSCCSC(c1ccccc1)c2ccccc2C 62a_100000230135_100000751147 [1,1,0,0,0,0|1,1,0]=4 1930 B20R2.21885 Cc1ccccc1C(OCCC#N)c2ccccc2 7a_100000212071_100000184422 [1,1,0,0,0,0|2,0,0]=4 1931 B20R2.21885 Cc1ccccc1C(OCCCF)c2ccccc2 34a_100000212071_100011934791 [1,1,0,0,0,0|2,0,0]=4 1932 B20R2.21885 Cc1ccccc1C(OCCCF)c2ccccc2 7a_100000212071_100011934791 [1,1,0,0,0,0|2,0,0]=4 1933 B20R2.21885 Cc1ccccc1C(OCCCO)c2ccccc2 34a_100000212071_100000230001 [1,1,0,0,0,0|2,0,0]=4 1934 B20R2.21885 Cc1ccccc1C(OCCCO)c2ccccc2 7a_100000212071_100011215043 [1,1,0,0,0,0|2,0,0]=4 1935 B20R2.21885 FCCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100011934791 [1,1,0,0,0,0|2,0,0]=4 1936 B20R2.21885 FCCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100011934791 [1,1,0,0,0,0|2,0,0]=4 1937 B20R2.21885 N#CCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000184422 [1,1,0,0,0,0|2,0,0]=4 1938 B20R2.21885 N#CCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000184422 [1,1,0,0,0,0|2,0,0]=4 1939 B20R2.21885 Nc1ccccc1C(OCCCF)c2ccccc2 34a_100000246470_100011934791 [1,1,0,0,0,0|2,0,0]=4 1940 B20R2.21885 Nc1ccccc1C(OCCCF)c2ccccc2 7a_100000246470_100011934791 [1,1,0,0,0,0|2,0,0]=4 1941 B20R2.21885 Nc1ccccc1C(OCCCO)c2ccccc2 34a_100000246470_100000230001 [1,1,0,0,0,0|2,0,0]=4 1942 B20R2.21885 Nc1ccccc1C(OCCCO)c2ccccc2 7a_100000246470_100011215043 [1,1,0,0,0,0|2,0,0]=4 1943 B20R2.21885 OCCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000230001 [1,1,0,0,0,0|2,0,0]=4 1944 B20R2.21885 OCCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100011215043 [1,1,0,0,0,0|2,0,0]=4 1945 B20R2.67666 CN(C)CCNC(c1ccccc1)c2ccc(s2)Br 270004a_100000210585_100011299753 [0,1,0,0,1,0|2,0,0]=4 1946 B20R2.67666 Cc1ccc(o1)C(OCCN(C)C)c2cccnc2 7a_100000186384_100000755713 [0,1,0,0,1,0|2,0,0]=4 1947 B20R2.72056 CC(C)CCOC(c1cccc(c1)N)c2cccs2 34a_200011934845_100000210312 [0,1,0,0,1,0|2,0,0]=4 1948 B20R2.72056 CC(C)CCOC(c1cccc(c1)N)c2cccs2 7a_200011934845_100000210626 [0,1,0,0,1,0|2,0,0]=4 1949 B20R2.72056 CN(C)CCNC(c1cccc(c1)Br)c2cccs2 270004a_100000210585_200011267850 [0,1,0,0,1,0|2,0,0]=4 1950 B20R2.72056 CN(C)CCOC(c1cccc(c1)N)c2cccs2 7a_200011934845_100000755713 [0,1,0,0,1,0|1,0,0]=3 1951 B20R2.74470 Cc1ccccc1C(NCCN(C)C)c2cccs2 270004a_100000210585_100011267914 [0,1,0,0,1,0|2,0,0]=4 1952 B20R2.76629 CN(C)CCOC(c1ccccc1)c2nccn2C 7a_100000188996_100000755713 [0,1,0,0,1,0|2,0,0]=4 1953 B20R2.235756 CC(C)CCOC(c1ccc(cc1)N)c2cccs2 34a_200011934697_100000210312 [0,1,0,0,1,0|2,0,0]=4 1954 B20R2.235756 CC(C)CCOC(c1ccc(cc1)N)c2cccs2 7a_200011934697_100000210626 [0,1,0,0,1,0|2,0,0]=4 1955 B20R2.235756 CN(C)CCNC(c1ccc(cc1)Cl)c2ccco2 270004a_100000210585_200011299770 [0,1,0,0,1,0|2,0,0]=4 1956 B20R2.235756 CN(C)CCNC(c1ccc(cc1)F)c2ccco2 270004a_100000210585_100000759536 [0,1,0,0,1,0|2,0,0]=4 1957 B20R2.235756 CN(C)CCNC(c1ccc(cc1)F)c2cccs2 270004a_100000210585_100011217774 [0,1,0,0,1,0|2,0,0]=4 1958 B20R2.235756 CN(C)CCOC(c1ccc(cc1)N)c2cccs2 7a_200011934697_100000755713 [0,1,0,0,1,0|1,0,0]=3 1959 B20R2.235756 Cc1ccc(cc1)C(NCCN(C)C)c2ccco2 270004a_100000210585_100011299843 [0,1,0,0,1,0|2,0,0]=4 1960 B20R2.235756 Cc1ccc(cc1)C(NCCN(C)C)c2cccs2 270004a_100000210585_200000189192 [0,1,0,0,1,0|2,0,0]=4 1961 B20R2.262828 CN(C)CCN(C)C(c1ccccc1)c2cccs2 270004a_100000225618_100011214959 [0,1,0,0,1,0|2,0,0]=4 1962 B20R2.29400 CC(=O)C(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_100000179758 [0,1,0,0,1,0|2,0,0]=4 1963 B20R2.29400 CC(C)C(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_100000210206 [0,1,0,0,1,0|1,0,1]=4 1964 B20R2.29400 CC(C)C(C)NC(c1ccccc1)c2ccccc2 2230a_100000211541_100000211591 [0,1,0,0,1,0|2,0,0]=4 1965 B20R2.29400 CC(C)C(C)NC(c1ccccc1)c2ccccc2 270004a_100000211541_100000210122 [0,1,0,0,1,0|2,0,0]=4 1966 B20R2.29400 CC(C)C(C)OC(c1ccccc1)c2ccccc2 7a_100000748068_100011216954 [0,1,0,0,1,0|1,0,0]=3 1967 B20R2.29400 CC(CC(c1ccccc1)c2ccccc2)N(C)C 270004a_100102631434_200000011111 [0,1,0,0,1,0|0,0,0]=2 1968 B20R2.29400 CN(C)C(=O)CC(c1ccccc1)c2ccccc2 11a_100102631434_100000499737 [0,1,0,0,1,0|0,0,1]=3 1969 B20R2.29400 CN(C)C(=O)CC(c1ccccc1)c2ccccc2 1626a_100102631434_100000499737 [0,1,0,0,1,0|0,0,1]=3 1970 B20R2.29400 CN(C)C(=O)CC(c1ccccc1)c2ccccc2 240690a_100102631434_100000499737 [0,1,0,0,1,0|0,0,1]=3 1971 B20R2.29400 CN(C)C(=O)CC(c1ccccc1)c2ccccc2 527a_100102631434_100000499737 [0,1,0,0,1,0|0,0,1]=3 1972 B20R2.29400 CN(C)C(=O)CP(c1ccccc1)c2ccccc2 11a_100102631434_200020607205 [0,1,0,0,1,0|1,0,1]=4 1973 B20R2.29400 CN(C)C(=O)CP(c1ccccc1)c2ccccc2 1626a_100102631434_200020607205 [0,1,0,0,1,0|1,0,1]=4 1974 B20R2.29400 CN(C)C(=O)CP(c1ccccc1)c2ccccc2 240690a_100102631434_200020607205 [0,1,0,0,1,0|1,0,1]=4 1975 B20R2.29400 CN(C)C(=O)CP(c1ccccc1)c2ccccc2 527a_100102631434_200020607205 [0,1,0,0,1,0|1,0,1]=4 1976 B20R2.72040 C=C(C)COC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000748629 [0,1,0,0,1,0|1,0,1]=4 1977 B20R2.72040 C=C(C)COC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000748629 [0,1,0,0,1,0|1,0,1]=4 1978 B20R2.72040 C=C(C)COC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000748629 [0,1,0,0,1,0|1,0,1]=4 1979 B20R2.72040 C=C(C)COC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000748629 [0,1,0,0,1,0|1,0,1]=4 1980 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000210760 [0,1,0,0,1,0|2,0,0]=4 1981 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)Br 270004a_100000210953_100011267660 [0,1,0,0,1,0|2,0,0]=4 1982 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)Br 270004a_100011212009_100000210432 [0,1,0,0,1,0|2,0,0]=4 1983 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000210624 [0,1,0,0,1,0|2,0,0]=4 1984 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000210760 [0,1,0,0,1,0|2,0,0]=4 1985 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000210953_100011215489 [0,1,0,0,1,0|2,0,0]=4 1986 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000741085_100000210432 [0,1,0,0,1,0|2,0,0]=4 1987 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000210624 [0,1,0,0,1,0|2,0,0]=4 1988 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000210760 [0,1,0,0,1,0|2,0,0]=4 1989 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)F 270004a_100000210953_200011219850 [0,1,0,0,1,0|2,0,0]=4 1990 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)F 270004a_100000686443_100000210432 [0,1,0,0,1,0|2,0,0]=4 1991 B20R2.72040 CC(C)CNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000210624 [0,1,0,0,1,0|2,0,0]=4 1992 B20R2.72040 CC(C)COC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000210624 [0,1,0,0,1,0|1,0,0]=3 1993 B20R2.72040 CC(C)COC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000210760 [0,1,0,0,1,0|1,0,0]=3 1994 B20R2.72040 CC(C)COC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000210624 [0,1,0,0,1,0|1,0,0]=3 1995 B20R2.72040 CC(C)COC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000210760 [0,1,0,0,1,0|1,0,0]=3 1996 B20R2.72040 CC(O)COC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100011218427 [0,1,0,0,1,0|2,0,0]=4 1997 B20R2.72040 CC(O)COC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100011218427 [0,1,0,0,1,0|2,0,0]=4 1998 B20R2.72040 CC(O)COC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100011218427 [0,1,0,0,1,0|2,0,0]=4 1999 B20R2.72040 CC(O)COC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100011218427 [0,1,0,0,1,0|2,0,0]=4 2000 B20R2.72040 C[C@@H](O)COC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100009817552 [0,1,0,0,1,0|2,0,0]=4 2001 B20R2.72040 C[C@@H](O)COC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100009817552 [0,1,0,0,1,0|2,0,0]=4 2002 B20R2.72040 C[C@@H](O)COC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100009817552 [0,1,0,0,1,0|2,0,0]=4 2003 B20R2.72040 C[C@@H](O)COC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100009817552 [0,1,0,0,1,0|2,0,0]=4 2004 B20R2.72040 Cc1cccc(c1)C(NCC(C)C)c2ccccc2 270004a_100000210953_100011217825 [0,1,0,0,1,0|2,0,0]=4 2005 B20R2.77823 C=C(C)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000748629 [0,1,0,0,1,0|1,0,1]=4 2006 B20R2.77823 CC(C)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210760 [0,1,0,0,1,0|1,0,0]=3 2007 B20R2.77823 CC(C)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000210760 [0,1,0,0,1,0|2,0,0]=4 2008 B20R2.77823 CC(C)NCC(C)(c1ccccc1)c2ccccc2 2230a_100000706881_100000210206 [0,1,0,0,1,0|2,0,0]=4 2009 B20R2.77823 CC(O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100011218427 [0,1,0,0,1,0|2,0,0]=4 2010 B20R2.77823 C[C@@H](O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100009817552 [0,1,0,0,1,0|2,0,0]=4 2011 B20R2.140971 C=C(C)COC(c1ccccc1)c2ccccc2C 34a_100000212071_100000748629 [0,1,0,0,1,0|1,0,1]=4 2012 B20R2.140971 C=C(C)COC(c1ccccc1)c2ccccc2C 7a_100000212071_100000748629 [0,1,0,0,1,0|1,0,1]=4 2013 B20R2.140971 C=C(C)COC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000748629 [0,1,0,0,1,0|1,0,1]=4 2014 B20R2.140971 C=C(C)COC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000748629 [0,1,0,0,1,0|1,0,1]=4 2015 B20R2.140971 C=C(C)COC(c1ccccc1)c2ccccc2N 34a_100000246470_100000748629 [0,1,0,0,1,0|1,0,1]=4 2016 B20R2.140971 C=C(C)COC(c1ccccc1)c2ccccc2N 7a_100000246470_100000748629 [0,1,0,0,1,0|1,0,1]=4 2017 B20R2.140971 CC(C)CNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000210760 [0,1,0,0,1,0|2,0,0]=4 2018 B20R2.140971 CC(C)CNC(c1ccccc1)c2ccccc2Br 270004a_100000210953_100000198044 [0,1,0,0,1,0|2,0,0]=4 2019 B20R2.140971 CC(C)CNC(c1ccccc1)c2ccccc2Br 270004a_100011211563_100000210432 [0,1,0,0,1,0|2,0,0]=4 2020 B20R2.140971 CC(C)CNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000210624 [0,1,0,0,1,0|2,0,0]=4 2021 B20R2.140971 CC(C)CNC(c1ccccc1)c2ccccc2Cl 270004a_100000210953_100011215288 [0,1,0,0,1,0|2,0,0]=4 2022 B20R2.140971 CC(C)CNC(c1ccccc1)c2ccccc2F 270004a_100000210953_100011217773 [0,1,0,0,1,0|2,0,0]=4 2023 B20R2.140971 CC(C)COC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000210624 [0,1,0,0,1,0|1,0,0]=3 2024 B20R2.140971 CC(C)COC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000210760 [0,1,0,0,1,0|1,0,0]=3 2025 B20R2.140971 CC(C)COC(c1ccccc1)c2ccccc2N 34a_100000246470_100000210624 [0,1,0,0,1,0|1,0,0]=3 2026 B20R2.140971 CC(C)COC(c1ccccc1)c2ccccc2N 7a_100000246470_100000210760 [0,1,0,0,1,0|1,0,0]=3 2027 B20R2.140971 CC(O)COC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100011218427 [0,1,0,0,1,0|2,0,0]=4 2028 B20R2.140971 CC(O)COC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100011218427 [0,1,0,0,1,0|2,0,0]=4 2029 B20R2.140971 CC(O)COC(c1ccccc1)c2ccccc2N 34a_100000246470_100011218427 [0,1,0,0,1,0|2,0,0]=4 2030 B20R2.140971 CC(O)COC(c1ccccc1)c2ccccc2N 7a_100000246470_100011218427 [0,1,0,0,1,0|2,0,0]=4 2031 B20R2.140971 C[C@@H](O)COC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100009817552 [0,1,0,0,1,0|2,0,0]=4 2032 B20R2.140971 C[C@@H](O)COC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100009817552 [0,1,0,0,1,0|2,0,0]=4 2033 B20R2.140971 C[C@@H](O)COC(c1ccccc1)c2ccccc2N 34a_100000246470_100009817552 [0,1,0,0,1,0|2,0,0]=4 2034 B20R2.140971 C[C@@H](O)COC(c1ccccc1)c2ccccc2N 7a_100000246470_100009817552 [0,1,0,0,1,0|2,0,0]=4 2035 B20R2.140971 Cc1ccccc1C(NCC(C)C)c2ccccc2 2230a_100000210953_100000230135 [0,1,0,0,1,0|2,0,0]=4 2036 B20R2.140971 Cc1ccccc1C(NCC(C)C)c2ccccc2 2230a_100000222801_100000210760 [0,1,0,0,1,0|2,0,0]=4 2037 B20R2.140971 Cc1ccccc1C(NCC(C)C)c2ccccc2 270004a_100000210953_100000735561 [0,1,0,0,1,0|2,0,0]=4 2038 B20R2.140971 Cc1ccccc1C(NCC(C)C)c2ccccc2 270004a_100000222801_100000210432 [0,1,0,0,1,0|2,0,0]=4 2039 B20R2.140971 Cc1ccccc1C(NCC(C)C)c2ccccc2 34a_100000222801_100000210624 [0,1,0,0,1,0|2,0,0]=4 2040 B20R2.140971 Cc1ccccc1C(OCC(C)C)c2ccccc2 34a_100000212071_100000210624 [0,1,0,0,1,0|1,0,0]=3 2041 B20R2.140971 Cc1ccccc1C(OCC(C)C)c2ccccc2 7a_100000212071_100000210760 [0,1,0,0,1,0|1,0,0]=3 2042 B20R2.140971 Cc1ccccc1C(OCC(C)O)c2ccccc2 34a_100000212071_100011218427 [0,1,0,0,1,0|2,0,0]=4 2043 B20R2.140971 Cc1ccccc1C(OCC(C)O)c2ccccc2 7a_100000212071_100011218427 [0,1,0,0,1,0|2,0,0]=4 2044 B20R2.140971 Cc1ccccc1C(OC[C@@H](C)O)c2ccccc2 34a_100000212071_100009817552 [0,1,0,0,1,0|2,0,0]=4 2045 B20R2.140971 Cc1ccccc1C(OC[C@@H](C)O)c2ccccc2 7a_100000212071_100009817552 [0,1,0,0,1,0|2,0,0]=4 2046 B20R2.140971 Cc1ccccc1C(SCC(C)C)c2ccccc2 62a_100000210624_100000230135 [0,1,0,0,1,0|1,1,0]=4 2047 B20R2.140971 Cc1ccccc1C(SCC(C)C)c2ccccc2 62a_100000230135_100000210760 [0,1,0,0,1,0|1,1,0]=4 2048 B20R2.174637 CC(C)CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210554_100011216954 [0,1,0,0,1,0|1,0,1]=4 2049 B20R2.174637 CC(C)CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000210624 [0,1,0,0,1,0|1,0,1]=4 2050 B20R2.174637 CC(C)CN(C)C(c1ccccc1)c2ccccc2 2230a_100000747067_100000211591 [0,1,0,0,1,0|2,0,0]=4 2051 B20R2.174637 CC(C)CN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000210760 [0,1,0,0,1,0|2,0,0]=4 2052 B20R2.174637 CC(C)CN(C)C(c1ccccc1)c2ccccc2 269982a_100000747067_100000211591 [0,1,0,0,1,0|2,0,0]=4 2053 B20R2.174637 CC(C)CN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000210624 [0,1,0,0,1,0|2,0,0]=4 2054 B20R2.174637 CC(C)CN(C)C(c1ccccc1)c2ccccc2 270004a_100000747067_100000210122 [0,1,0,0,1,0|2,0,0]=4 2055 B20R2.174637 CC(C)CN(C)C(c1ccccc1)c2ccccc2 270004a_100103148541_100000210432 [0,1,0,0,1,0|2,0,0]=4 2056 B20R2.174637 CN(C)CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000750896_100011216954 [0,1,0,0,1,0|0,0,1]=3 2057 B20R2.174637 CN(C)CC(=O)N(c1ccccc1)c2ccccc2 2230a_100102631434_200015198546 [0,1,0,0,1,0|1,0,1]=4 2058 B20R2.174637 CN(C)CC(=O)N(c1ccccc1)c2ccccc2 269982a_100102631434_200015198546 [0,1,0,0,1,0|1,0,1]=4 2059 B20R2.174637 C[S+](C)CC(=O)C(c1ccccc1)c2ccccc2 1458a_200159257847_100011216954 [0,1,0,0,1,0|1,0,1]=4 2060 B20R2.240825 C=C(C)COC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000748629 [0,1,0,0,1,0|1,0,1]=4 2061 B20R2.240825 C=C(C)COC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000748629 [0,1,0,0,1,0|1,0,1]=4 2062 B20R2.240825 C=C(C)COC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100000748629 [0,1,0,0,1,0|1,0,1]=4 2063 B20R2.240825 C=C(C)COC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000748629 [0,1,0,0,1,0|1,0,1]=4 2064 B20R2.240825 C=C(C)COC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000748629 [0,1,0,0,1,0|1,0,1]=4 2065 B20R2.240825 C=C(C)COC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000748629 [0,1,0,0,1,0|1,0,1]=4 2066 B20R2.240825 C=C(C)COC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000748629 [0,1,0,0,1,0|1,0,1]=4 2067 B20R2.240825 C=C(C)COC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000748629 [0,1,0,0,1,0|1,0,1]=4 2068 B20R2.240825 C=C(C)COC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000748629 [0,1,0,0,1,0|1,0,1]=4 2069 B20R2.240825 C=C(C)COC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000748629 [0,1,0,0,1,0|1,0,1]=4 2070 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000210760 [0,1,0,0,1,0|2,0,0]=4 2071 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000210953_100000718703 [0,1,0,0,1,0|2,0,0]=4 2072 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000745999_100000210432 [0,1,0,0,1,0|2,0,0]=4 2073 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000210624 [0,1,0,0,1,0|2,0,0]=4 2074 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000210953_100000211669 [0,1,0,0,1,0|2,0,0]=4 2075 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000210760 [0,1,0,0,1,0|2,0,0]=4 2076 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000210953_100000211064 [0,1,0,0,1,0|2,0,0]=4 2077 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000737946_100000210432 [0,1,0,0,1,0|2,0,0]=4 2078 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000210624 [0,1,0,0,1,0|2,0,0]=4 2079 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000210760 [0,1,0,0,1,0|2,0,0]=4 2080 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)F 270004a_100000210953_100000210425 [0,1,0,0,1,0|2,0,0]=4 2081 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)F 270004a_100000737529_100000210432 [0,1,0,0,1,0|2,0,0]=4 2082 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000210624 [0,1,0,0,1,0|2,0,0]=4 2083 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)O 270004a_100000198503_100000210432 [0,1,0,0,1,0|2,0,0]=4 2084 B20R2.240825 CC(C)CNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000210624 [0,1,0,0,1,0|2,0,0]=4 2085 B20R2.240825 CC(C)COC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000210624 [0,1,0,0,1,0|2,0,0]=4 2086 B20R2.240825 CC(C)COC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000210624 [0,1,0,0,1,0|1,0,0]=3 2087 B20R2.240825 CC(C)COC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000210760 [0,1,0,0,1,0|1,0,0]=3 2088 B20R2.240825 CC(C)COC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000210624 [0,1,0,0,1,0|1,0,0]=3 2089 B20R2.240825 CC(C)COC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000210760 [0,1,0,0,1,0|1,0,0]=3 2090 B20R2.240825 CC(C)COC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000210624 [0,1,0,0,1,0|1,0,0]=3 2091 B20R2.240825 CC(C)COC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000210760 [0,1,0,0,1,0|1,0,0]=3 2092 B20R2.240825 CC(C)COC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000210624 [0,1,0,0,1,0|1,0,0]=3 2093 B20R2.240825 CC(C)COC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000210760 [0,1,0,0,1,0|1,0,0]=3 2094 B20R2.240825 CC(C)COC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000210624 [0,1,0,0,1,0|2,0,0]=4 2095 B20R2.240825 CC(C)CSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000210624_100000211669 [0,1,0,0,1,0|1,1,0]=4 2096 B20R2.240825 CC(C)CSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000210760 [0,1,0,0,1,0|1,1,0]=4 2097 B20R2.240825 CC(O)COC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100011218427 [0,1,0,0,1,0|2,0,0]=4 2098 B20R2.240825 CC(O)COC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100011218427 [0,1,0,0,1,0|2,0,0]=4 2099 B20R2.240825 CC(O)COC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100011218427 [0,1,0,0,1,0|2,0,0]=4 2100 B20R2.240825 CC(O)COC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100011218427 [0,1,0,0,1,0|2,0,0]=4 2101 B20R2.240825 CC(O)COC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100011218427 [0,1,0,0,1,0|2,0,0]=4 2102 B20R2.240825 CC(O)COC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100011218427 [0,1,0,0,1,0|2,0,0]=4 2103 B20R2.240825 CC(O)COC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100011218427 [0,1,0,0,1,0|2,0,0]=4 2104 B20R2.240825 CC(O)COC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100011218427 [0,1,0,0,1,0|2,0,0]=4 2105 B20R2.240825 C[C@@H](O)COC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100009817552 [0,1,0,0,1,0|2,0,0]=4 2106 B20R2.240825 C[C@@H](O)COC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100009817552 [0,1,0,0,1,0|2,0,0]=4 2107 B20R2.240825 C[C@@H](O)COC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100009817552 [0,1,0,0,1,0|2,0,0]=4 2108 B20R2.240825 C[C@@H](O)COC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100009817552 [0,1,0,0,1,0|2,0,0]=4 2109 B20R2.240825 C[C@@H](O)COC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100009817552 [0,1,0,0,1,0|2,0,0]=4 2110 B20R2.240825 C[C@@H](O)COC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100009817552 [0,1,0,0,1,0|2,0,0]=4 2111 B20R2.240825 C[C@@H](O)COC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100009817552 [0,1,0,0,1,0|2,0,0]=4 2112 B20R2.240825 C[C@@H](O)COC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100009817552 [0,1,0,0,1,0|2,0,0]=4 2113 B20R2.240825 Cc1ccc(cc1)C(NCC(C)C)c2ccccc2 2230a_100000736602_100000210760 [0,1,0,0,1,0|2,0,0]=4 2114 B20R2.240825 Cc1ccc(cc1)C(NCC(C)C)c2ccccc2 270004a_100000210953_100000210966 [0,1,0,0,1,0|2,0,0]=4 2115 B20R2.240825 Cc1ccc(cc1)C(NCC(C)C)c2ccccc2 270004a_100000736602_100000210432 [0,1,0,0,1,0|2,0,0]=4 2116 B20R2.240825 Cc1ccc(cc1)C(NCC(C)C)c2ccccc2 34a_100000736602_100000210624 [0,1,0,0,1,0|2,0,0]=4 2117 B20R2.240825 Cc1ccc(cc1)C(OCC(C)C)c2ccccc2 34a_100000212064_100000210624 [0,1,0,0,1,0|1,0,0]=3 2118 B20R2.240825 Cc1ccc(cc1)C(OCC(C)C)c2ccccc2 7a_100000212064_100000210760 [0,1,0,0,1,0|1,0,0]=3 2119 B20R2.240825 Cc1ccc(cc1)C(OCC(C)O)c2ccccc2 34a_100000212064_100011218427 [0,1,0,0,1,0|2,0,0]=4 2120 B20R2.240825 Cc1ccc(cc1)C(OCC(C)O)c2ccccc2 7a_100000212064_100011218427 [0,1,0,0,1,0|2,0,0]=4 2121 B20R2.240825 Cc1ccc(cc1)C(OC[C@@H](C)O)c2ccccc2 34a_100000212064_100009817552 [0,1,0,0,1,0|2,0,0]=4 2122 B20R2.240825 Cc1ccc(cc1)C(OC[C@@H](C)O)c2ccccc2 7a_100000212064_100009817552 [0,1,0,0,1,0|2,0,0]=4 2123 B20R2.2714554 CC(C)(C)CNC(c1ccccc1)c2ccccc2 2230a_100000743828_100000211591 [0,1,0,0,1,0|2,0,0]=4 2124 B20R2.2714554 CC(C)(C)CNC(c1ccccc1)c2ccccc2 270004a_100000162943_100011204126 [0,1,0,0,1,0|2,0,0]=4 2125 B20R2.2714554 CC(C)(C)CNC(c1ccccc1)c2ccccc2 270004a_100000743828_100000210122 [0,1,0,0,1,0|2,0,0]=4 2126 B20R2.2714554 CC(C)(C)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100011219605 [0,1,0,0,1,0|2,0,0]=4 2127 B20R2.2714554 CC(C)(C)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011219605 [0,1,0,0,1,0|1,0,0]=3 2128 B20R2.2714554 CC(C)(C)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100011219605 [0,1,0,0,1,0|1,1,0]=4 2129 B20R2.2714554 CC(C)(C)CSC(c1ccccc1)c2ccccc2 62a_100011219605_100011216954 [0,1,0,0,1,0|1,1,0]=4 2130 B20R2.2714554 CC(C)(C)NCC(c1ccccc1)c2ccccc2 34a_100000739227_100000210625 [0,1,0,0,1,0|2,0,0]=4 2131 B20R2.2714554 CC(C)(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210625 [0,1,0,0,1,0|2,0,0]=4 2132 B20R2.2714554 CC(C)(F)CNC(c1ccccc1)c2ccccc2 2230a_100020643315_100000211591 [0,1,0,0,1,0|2,0,0]=4 2133 B20R2.2714554 CC(C)(F)CNC(c1ccccc1)c2ccccc2 270004a_100020643315_100000210122 [0,1,0,0,1,0|2,0,0]=4 2134 B20R2.2714554 CC(C)(F)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100011997219 [0,1,0,0,1,0|2,0,0]=4 2135 B20R2.2714554 CC(C)(F)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011997219 [0,1,0,0,1,0|1,0,0]=3 2136 B20R2.2714554 CC(C)(F)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100011997219 [0,1,0,0,1,0|1,1,0]=4 2137 B20R2.2714554 CC(C)(F)CSC(c1ccccc1)c2ccccc2 62a_100011997219_100011216954 [0,1,0,0,1,0|1,1,0]=4 2138 B20R2.2714554 CC(C)(O)CNC(c1ccccc1)c2ccccc2 2230a_100000751335_100000211591 [0,1,0,0,1,0|2,0,0]=4 2139 B20R2.2714554 CC(C)(O)CNC(c1ccccc1)c2ccccc2 270004a_100000751335_100000210122 [0,1,0,0,1,0|2,0,0]=4 2140 B20R2.2714554 CC(C)(O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000764493 [0,1,0,0,1,0|2,0,0]=4 2141 B20R2.2714554 CC(C)(O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000764493 [0,1,0,0,1,0|1,0,0]=3 2142 B20R2.2714554 CC(C)(O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000764493 [0,1,0,0,1,0|1,0,0]=3 2143 B20R2.2714554 CC(C)(O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000764493 [0,1,0,0,1,0|2,0,0]=4 2144 B20R2.2714554 CC(C)(O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000764493 [0,1,0,0,1,0|1,1,0]=4 2145 B20R2.2714554 CC(C)(O)CSC(c1ccccc1)c2ccccc2 62a_100000764493_100011216954 [0,1,0,0,1,0|1,1,0]=4 2146 B20R2.2714554 C[N+](C)(C)CSC(c1ccccc1)c2ccccc2 62a_100000211591_200000036245 [0,1,0,0,1,0|0,1,1]=4 2147 B20R2.2714554 C[N+](C)(C)CSC(c1ccccc1)c2ccccc2 62a_200000036245_100011216954 [0,1,0,0,1,0|0,1,1]=4 2148 B20R2.2714554 C[Si](C)(C)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000037933 [0,1,0,0,1,0|2,0,0]=4 2149 B20R2.2714554 C[Si](C)(C)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000233785 [0,1,0,0,1,0|1,0,0]=3 2150 B20R2.2714554 C[Si](C)(C)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000233785 [0,1,0,0,1,0|2,0,0]=4 2151 B20R2.2714554 C[Si](C)(C)CSC(c1ccccc1)c2ccccc2 62a_100000037933_100011216954 [0,1,0,0,1,0|1,1,0]=4 2152 B20R2.2714554 C[Si](C)(C)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000037933 [0,1,0,0,1,0|1,1,0]=4 2153 B22R2.24730 C#CC(C)NCCOC(c1ccccc1)c2ccccc2 2230a_100000707721_100000734929 [0,1,0,0,0,1|1,0,1]=4 2154 B22R2.24730 C#CC(C)NCCOC(c1ccccc1)c2ccccc2 34a_100000707721_100000734929 [0,1,0,0,0,1|1,0,1]=4 2155 B22R2.24730 C#CC(C)SCCOC(c1ccccc1)c2ccccc2 62a_200000035995_100000734929 [0,1,0,0,0,1|1,0,1]=4 2156 B22R2.24730 C#C[C@@H](C)OCCOC(c1ccccc1)c2ccccc2 34a_100009815206_100000734929 [0,1,0,0,0,1|1,0,1]=4 2157 B22R2.24730 C#C[C@@H](C)OCCOC(c1ccccc1)c2ccccc2 7a_100009815206_100000734929 [0,1,0,0,0,1|1,0,1]=4 2158 B22R2.24730 C=CC(C)OCCOC(c1ccccc1)c2ccccc2 34a_100000695699_100000734929 [0,1,0,0,0,1|1,0,1]=4 2159 B22R2.24730 C=CC(C)SCCOC(c1ccccc1)c2ccccc2 62a_100011215867_100000734929 [0,1,0,0,0,1|1,0,1]=4 2160 B22R2.24730 CC(C#N)NCCOC(c1ccccc1)c2ccccc2 2230a_100000737613_100000734929 [0,1,0,0,0,1|1,0,1]=4 2161 B22R2.24730 CC(C#N)OCCOC(c1ccccc1)c2ccccc2 34a_100011218135_100000734929 [0,1,0,0,0,1|1,0,1]=4 2162 B22R2.24730 CC(C#N)SCCOC(c1ccccc1)c2ccccc2 62a_100000703298_100000734929 [0,1,0,0,0,1|1,0,1]=4 2163 B22R2.24730 CC(C#N)SCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000703298 [0,1,0,0,0,1|1,0,1]=4 2164 B22R2.24730 CC(CF)OCCOC(c1ccccc1)c2ccccc2 34a_100016041109_100000734929 [0,1,0,0,0,1|1,0,0]=3 2165 B22R2.24730 CC(CF)OCCOC(c1ccccc1)c2ccccc2 7a_100016041109_100000734929 [0,1,0,0,0,1|1,0,0]=3 2166 B22R2.24730 CC(CN)COCCC(c1ccccc1)c2ccccc2 34a_100000744482_100009813428 [0,1,0,0,0,1|2,0,0]=4 2167 B22R2.24730 CC(CN)OCCOC(c1ccccc1)c2ccccc2 34a_100000210904_100000734929 [0,1,0,0,0,1|1,0,0]=3 2168 B22R2.24730 CC(CO)CNCCC(c1ccccc1)c2ccccc2 34a_100000744482_100009813428 [0,1,0,0,0,1|2,0,0]=4 2169 B22R2.24730 CC(CO)SCCOC(c1ccccc1)c2ccccc2 62a_100012180447_100000734929 [0,1,0,0,0,1|1,0,0]=3 2170 B22R2.24730 CCC(=O)NCCOC(c1ccccc1)c2ccccc2 7a_200000158885_100011216954 [0,1,0,0,0,1|2,0,0]=4 2171 B22R2.24730 CCC(=O)OCCOC(c1ccccc1)c2ccccc2 7a_200000031056_100011216954 [0,1,0,0,0,1|2,0,0]=4 2172 B22R2.24730 CCC(C)CCCOC(c1ccccc1)c2ccccc2 7a_100011216074_100011216954 [0,1,0,0,0,1|1,0,0]=3 2173 B22R2.24730 CCC(C)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000748023 [0,1,0,0,0,1|2,0,0]=4 2174 B22R2.24730 CCC(C)CNCCC(c1ccccc1)c2ccccc2 2230a_100020588543_100009813428 [0,1,0,0,0,1|2,0,0]=4 2175 B22R2.24730 CCC(C)CNCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100000243153 [0,1,0,0,0,1|2,0,0]=4 2176 B22R2.24730 CCC(C)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000748023 [0,1,0,0,0,1|2,0,0]=4 2177 B22R2.24730 CCC(C)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000748023 [0,1,0,0,0,1|2,0,0]=4 2178 B22R2.24730 CCC(C)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000748023 [0,1,0,0,0,1|2,0,0]=4 2179 B22R2.24730 CCC(C)CSCCC(c1ccccc1)c2ccccc2 62a_100000748023_100009813428 [0,1,0,0,0,1|2,0,0]=4 2180 B22R2.24730 CCC(C)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000748023 [0,1,0,0,0,1|2,0,0]=4 2181 B22R2.24730 CCC(C)NCCOC(c1ccccc1)c2ccccc2 2230a_100000209981_100000734929 [0,1,0,0,0,1|1,0,0]=3 2182 B22R2.24730 CCC(C)OCCOC(c1ccccc1)c2ccccc2 7a_100000210228_100000734929 [0,1,0,0,0,1|1,0,0]=3 2183 B22R2.24730 CCC(C)SCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000758301 [0,1,0,0,0,1|1,0,0]=3 2184 B22R2.24730 CCC(C)SCCOC(c1ccccc1)c2ccccc2 62a_100000758301_100000734929 [0,1,0,0,0,1|1,0,0]=3 2185 B22R2.24730 CCN(C)CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100015186262 [0,1,0,0,0,1|1,0,0]=3 2186 B22R2.24730 CCN(C)CCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100015186262 [0,1,0,0,0,1|2,0,0]=4 2187 B22R2.24730 CCN(C)CCCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100015186262 [0,1,0,0,0,1|2,0,0]=4 2188 B22R2.24730 CCN(C)CCCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100015186262 [0,1,0,0,0,1|2,0,0]=4 2189 B22R2.24730 CCN(C)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100015186262 [0,1,0,0,0,1|0,0,0]=2 2190 B22R2.24730 CCN(C)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100015186262 [0,1,0,0,0,1|1,0,0]=3 2191 B22R2.24730 CCN(C)CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100015186262 [0,1,0,0,0,1|0,1,0]=3 2192 B22R2.24730 CC[C@H](C)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100009816398 [0,1,0,0,0,1|2,0,0]=4 2193 B22R2.24730 CC[C@H](C)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100009816398 [0,1,0,0,0,1|2,0,0]=4 2194 B22R2.24730 CC[C@H](C)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100009816398 [0,1,0,0,0,1|2,0,0]=4 2195 B22R2.24730 CC[C@H](C)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100009816398 [0,1,0,0,0,1|2,0,0]=4 2196 B22R2.24730 CC[C@H](C)COCCC(c1ccccc1)c2ccccc2 7a_100009816381_100009813428 [0,1,0,0,0,1|2,0,0]=4 2197 B22R2.24730 CC[C@H](C)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100009816398 [0,1,0,0,0,1|2,0,0]=4 2198 B22R2.24730 CC[C@H](C)CSCCC(c1ccccc1)c2ccccc2 62a_100009816398_100009813428 [0,1,0,0,0,1|2,0,0]=4 2199 B22R2.24730 CNC(=O)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000741757 [0,1,0,0,0,1|2,0,0]=4 2200 B22R2.24730 CNC(=O)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000741757 [0,1,0,0,0,1|2,0,0]=4 2201 B22R2.24730 CNC(=O)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100012179268 [0,1,0,0,0,1|2,0,0]=4 2202 B22R2.24730 CNC(=O)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000737683 [0,1,0,0,0,1|2,0,0]=4 2203 B22R2.24730 CNC(=O)OCCOC(c1ccccc1)c2ccccc2 34a_100000211180_200011997002 [0,1,0,0,0,1|2,0,0]=4 2204 B22R2.24730 CNC(=O)OCCOC(c1ccccc1)c2ccccc2 7a_100000211180_200011997002 [0,1,0,0,0,1|2,0,0]=4 2205 B22R2.24730 COC(=O)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000742333 [0,1,0,0,0,1|2,0,0]=4 2206 B22R2.24730 COC(=O)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011218270 [0,1,0,0,0,1|2,0,0]=4 2207 B22R2.24730 COC(=O)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000742370 [0,1,0,0,0,1|2,0,0]=4 2208 B22R2.24730 COC(=O)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000204255 [0,1,0,0,0,1|2,0,0]=4 2209 B22R2.24730 COC(C)COCCC(c1ccccc1)c2ccccc2 34a_100000690652_100009813428 [0,1,0,0,0,1|2,0,0]=4 2210 B22R2.24730 COC(C)SCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100009879195 [0,1,0,0,0,1|1,0,0]=3 2211 B22R2.24730 COC(C)SCCOC(c1ccccc1)c2ccccc2 62a_100009879195_100000734929 [0,1,0,0,0,1|1,0,0]=3 2212 B22R2.24730 CO[C@H](C)CNCCC(c1ccccc1)c2ccccc2 2230a_100020591295_100009813428 [0,1,0,0,0,1|2,0,0]=4 2213 B22R2.24730 C[C@@H](CO)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000059175 [0,1,0,0,0,1|2,0,0]=4 2214 B22R2.24730 C[C@@H](CO)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000059175 [0,1,0,0,0,1|2,0,0]=4 2215 B22R2.24730 C[C@@H](CO)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000059175 [0,1,0,0,0,1|2,0,0]=4 2216 B22R2.24730 C[C@@H](CO)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000059175 [0,1,0,0,0,1|2,0,0]=4 2217 B22R2.24730 C[C@@H](CO)CSCCC(c1ccccc1)c2ccccc2 62a_100000059175_100009813428 [0,1,0,0,0,1|2,0,0]=4 2218 B22R2.24730 C[C@@H](CO)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000059175 [0,1,0,0,0,1|2,0,0]=4 2219 B22R2.24730 C[C@H](CO)NCCOC(c1ccccc1)c2ccccc2 2230a_100000737577_100000734929 [0,1,0,0,0,1|1,0,0]=3 2220 B22R2.24730 C[C@H](CO)SCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100016084084 [0,1,0,0,0,1|1,0,0]=3 2221 B22R2.24730 C[C@H](CO)SCCOC(c1ccccc1)c2ccccc2 62a_100016084084_100000734929 [0,1,0,0,0,1|1,0,0]=3 2222 B22R2.41735 C=C(C)C(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000185857_100000734929 [0,1,0,0,0,1|1,0,1]=4 2223 B22R2.41735 CC(=O)N(C)CCOC(c1ccccc1)c2ccccc2 11a_200016989109_100015343762 [0,1,0,0,0,1|2,0,0]=4 2224 B22R2.41735 CC(=O)N(C)CCOC(c1ccccc1)c2ccccc2 1626a_200016989109_100015343762 [0,1,0,0,0,1|2,0,0]=4 2225 B22R2.41735 CC(=O)N(C)CCOC(c1ccccc1)c2ccccc2 240690a_200016989109_100015343762 [0,1,0,0,0,1|2,0,0]=4 2226 B22R2.41735 CC(=O)N(C)CCOC(c1ccccc1)c2ccccc2 527a_200016989109_100103153847 [0,1,0,0,0,1|2,0,0]=4 2227 B22R2.41735 CC(C)C(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000210198_100000734929 [0,1,0,0,0,1|1,0,0]=3 2228 B22R2.41735 CC(C)C(=O)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100000753385 [0,1,0,0,0,1|1,0,1]=4 2229 B22R2.41735 CC(C)C(=O)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100000753385 [0,1,0,0,0,1|1,0,1]=4 2230 B22R2.41735 CC(C)C(C)NCCC(c1ccccc1)c2ccccc2 2230a_100000211541_100009813428 [0,1,0,0,0,1|2,0,0]=4 2231 B22R2.41735 CC(C)C(C)OCCC(c1ccccc1)c2ccccc2 7a_100000748068_100009813428 [0,1,0,0,0,1|2,0,0]=4 2232 B22R2.41735 CC(C)N(C)CCNC(c1ccccc1)c2ccccc2 270004a_100000749581_100000210122 [0,1,0,0,0,1|2,0,0]=4 2233 B22R2.41735 CC(C)N(C)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100000210206 [0,1,0,0,0,1|1,0,0]=3 2234 B22R2.41735 CC(C)N(C)CCOC(c1ccccc1)c2ccccc2 269982a_200000211004_100000734929 [0,1,0,0,0,1|1,0,0]=3 2235 B22R2.41735 CC(C)N(C)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100000210206 [0,1,0,0,0,1|1,0,0]=3 2236 B22R2.41735 CC(F)C(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000062450_100000734929 [0,1,0,0,0,1|2,0,0]=4 2237 B22R2.41735 CN(C)C(=O)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000737620 [0,1,0,0,0,1|1,0,0]=3 2238 B22R2.41735 CN(C)C(=O)CCNC(c1ccccc1)c2ccccc2 2230a_100000738053_100000211591 [0,1,0,0,0,1|1,0,0]=3 2239 B22R2.41735 CN(C)C(=O)CCNC(c1ccccc1)c2ccccc2 270004a_100000738053_100000210122 [0,1,0,0,0,1|1,0,0]=3 2240 B22R2.41735 CN(C)C(=O)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000737620 [0,1,0,0,0,1|2,0,0]=4 2241 B22R2.41735 CN(C)C(=O)CCNC(c1ccccc1)c2ccccn2 270004a_100000738053_100000210380 [0,1,0,0,0,1|2,0,0]=4 2242 B22R2.41735 CN(C)C(=O)CCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000737620 [0,1,0,0,0,1|2,0,0]=4 2243 B22R2.41735 CN(C)C(=O)CCNC(c1ccccc1)c2cccnc2 270004a_100000738053_100000735413 [0,1,0,0,0,1|2,0,0]=4 2244 B22R2.41735 CN(C)C(=O)CCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000737620 [0,1,0,0,0,1|2,0,0]=4 2245 B22R2.41735 CN(C)C(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000737620 [0,1,0,0,0,1|0,0,0]=2 2246 B22R2.41735 CN(C)C(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000737620 [0,1,0,0,0,1|1,0,0]=3 2247 B22R2.41735 CN(C)C(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000737620 [0,1,0,0,0,1|0,1,0]=3 2248 B22R2.41735 CN(C)C(=O)CCSC(c1ccccc1)c2ccccc2 62a_100000737620_100011216954 [0,1,0,0,0,1|0,1,0]=3 2249 B22R2.41735 CN(C)C(=O)CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000185267 [0,1,0,0,0,1|1,0,1]=4 2250 B22R2.41735 CN(C)C(=O)CNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000692301 [0,1,0,0,0,1|1,0,1]=4 2251 B22R2.41735 CN(C)C(=O)COCC(c1ccccc1)c2ccccc2 34a_100011215272_100000692301 [0,1,0,0,0,1|0,0,1]=3 2252 B22R2.41735 CN(C)C(=O)COCC(c1ccccc1)c2ccccc2 7a_100011215272_100000692301 [0,1,0,0,0,1|0,0,1]=3 2253 B22R2.41735 CN(C)C(=O)NCCC(c1ccccc1)c2ccccc2 2708a_100000272388_100102631434 [0,1,0,0,0,1|1,0,1]=4 2254 B22R2.41735 C[C@@H](O)C(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000717761_100000734929 [0,1,0,0,0,1|2,0,0]=4 2255 B22R2.41735 C[C@H](O)C(=O)CCOC(c1ccccc1)c2ccccc2 1458a_217856618621_100000734929 [0,1,0,0,0,1|2,0,0]=4 2256 B22R2.49735 CC(C)(C)CCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000755188 [0,1,0,0,0,1|2,0,0]=4 2257 B22R2.49735 CC(C)(C)CCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000755188 [0,1,0,0,0,1|2,0,0]=4 2258 B22R2.49735 CC(C)(C)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000755188 [0,1,0,0,0,1|1,0,0]=3 2259 B22R2.49735 CC(C)(C)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000755188 [0,1,0,0,0,1|1,0,0]=3 2260 B22R2.49735 CC(C)(C)CNCCC(c1ccccc1)c2ccccc2 2230a_100000743828_100009813428 [0,1,0,0,0,1|2,0,0]=4 2261 B22R2.49735 CC(C)(C)CNCCC(c1ccccc1)c2ccccc2 270004a_100000272388_100011204126 [0,1,0,0,0,1|2,0,0]=4 2262 B22R2.49735 CC(C)(C)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011219605 [0,1,0,0,0,1|2,0,0]=4 2263 B22R2.49735 CC(C)(C)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011219605 [0,1,0,0,0,1|2,0,0]=4 2264 B22R2.49735 CC(C)(C)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011219605 [0,1,0,0,0,1|2,0,0]=4 2265 B22R2.49735 CC(C)(C)CSCCC(c1ccccc1)c2ccccc2 62a_100011219605_100009813428 [0,1,0,0,0,1|2,0,0]=4 2266 B22R2.49735 CC(C)(C)NCCOC(c1ccccc1)c2ccccc2 2230a_100000715429_100000734929 [0,1,0,0,0,1|1,0,0]=3 2267 B22R2.49735 CC(C)(C)OCCNC(c1ccccc1)c2ccccc2 2230a_100000747557_100000211591 [0,1,0,0,0,1|2,0,0]=4 2268 B22R2.49735 CC(C)(C)OCCNC(c1ccccc1)c2ccccc2 270004a_100000747557_100000210122 [0,1,0,0,0,1|2,0,0]=4 2269 B22R2.49735 CC(C)(C)OCCOC(c1ccccc1)c2ccccc2 34a_100015890283_100000734929 [0,1,0,0,0,1|1,0,0]=3 2270 B22R2.49735 CC(C)(C)OCCOC(c1ccccc1)c2ccccc2 7a_100000693234_100011216954 [0,1,0,0,0,1|1,0,0]=3 2271 B22R2.49735 CC(C)(C)OCCOC(c1ccccc1)c2ccccc2 7a_100015890283_100000734929 [0,1,0,0,0,1|1,0,0]=3 2272 B22R2.49735 CC(C)(C)SCCNC(c1ccccc1)c2ccccc2 2230a_100000689375_100000211591 [0,1,0,0,0,1|2,0,0]=4 2273 B22R2.49735 CC(C)(C)SCCNC(c1ccccc1)c2ccccc2 270004a_100000689375_100000210122 [0,1,0,0,0,1|2,0,0]=4 2274 B22R2.49735 CC(C)(C)SCCOC(c1ccccc1)c2ccccc2 62a_100000211941_100000734929 [0,1,0,0,0,1|1,0,0]=3 2275 B22R2.49735 CC(C)(C)SCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000211941 [0,1,0,0,0,1|1,0,0]=3 2276 B22R2.49735 CC(C)(F)CNCCC(c1ccccc1)c2ccccc2 2230a_100020643315_100009813428 [0,1,0,0,0,1|2,0,0]=4 2277 B22R2.49735 CC(C)(F)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100011997219 [0,1,0,0,0,1|2,0,0]=4 2278 B22R2.49735 CC(C)(F)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100011997219 [0,1,0,0,0,1|2,0,0]=4 2279 B22R2.49735 CC(C)(F)COCCC(c1ccccc1)c2ccccc2 34a_100000716592_100009813428 [0,1,0,0,0,1|2,0,0]=4 2280 B22R2.49735 CC(C)(F)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100011997219 [0,1,0,0,0,1|2,0,0]=4 2281 B22R2.49735 CC(C)(F)CSCCC(c1ccccc1)c2ccccc2 62a_100011997219_100009813428 [0,1,0,0,0,1|2,0,0]=4 2282 B22R2.49735 CC(C)(O)CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100009888830 [0,1,0,0,0,1|2,0,0]=4 2283 B22R2.49735 CC(C)(O)CCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100009888830 [0,1,0,0,0,1|2,0,0]=4 2284 B22R2.49735 CC(C)(O)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100009888830 [0,1,0,0,0,1|1,0,0]=3 2285 B22R2.49735 CC(C)(O)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100009888830 [0,1,0,0,0,1|1,0,0]=3 2286 B22R2.49735 CC(C)(O)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100009888830 [0,1,0,0,0,1|2,0,0]=4 2287 B22R2.49735 CC(C)(O)CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100009888830 [0,1,0,0,0,1|1,1,0]=4 2288 B22R2.49735 CC(C)(O)CCCSC(c1ccccc1)c2ccccc2 62a_100009888830_100011216954 [0,1,0,0,0,1|1,1,0]=4 2289 B22R2.49735 CC(C)(O)CCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000702414 [0,1,0,0,0,1|2,0,0]=4 2290 B22R2.49735 CC(C)(O)CCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000702414 [0,1,0,0,0,1|2,0,0]=4 2291 B22R2.49735 CC(C)(O)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000702414 [0,1,0,0,0,1|1,0,0]=3 2292 B22R2.49735 CC(C)(O)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000702414 [0,1,0,0,0,1|1,0,0]=3 2293 B22R2.49735 CC(C)(O)CNCCC(c1ccccc1)c2ccccc2 2230a_100000751335_100009813428 [0,1,0,0,0,1|2,0,0]=4 2294 B22R2.49735 CC(C)(O)CNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000764493 [0,1,0,0,0,1|2,0,0]=4 2295 B22R2.49735 CC(C)(O)COCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000764493 [0,1,0,0,0,1|2,0,0]=4 2296 B22R2.49735 CC(C)(O)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000764493 [0,1,0,0,0,1|2,0,0]=4 2297 B22R2.49735 CC(C)(O)CSCCC(c1ccccc1)c2ccccc2 62a_100000764493_100009813428 [0,1,0,0,0,1|2,0,0]=4 2298 B22R2.49735 CC(C)(O)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000764493 [0,1,0,0,0,1|2,0,0]=4 2299 B22R2.49735 CS(=O)(=O)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000754308 [0,1,0,0,0,1|2,0,0]=4 2300 B22R2.49735 CS(=O)(=O)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000754308 [0,1,0,0,0,1|2,0,0]=4 2301 B22R2.49735 CS(=O)(=O)CCCOC(c1ccccc1)c2ccccc2 7a_100000689940_100011216954 [0,1,0,0,0,1|2,0,0]=4 2302 B22R2.49735 CS(=O)(=O)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000731031 [0,1,0,0,0,1|2,0,0]=4 2303 B22R2.49735 CS(=O)(=O)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000230027 [0,1,0,0,0,1|2,0,0]=4 2304 B22R2.49735 CS(=O)(=O)NCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000754112 [0,1,0,0,0,1|2,0,0]=4 2305 B22R2.49735 CS(=O)(=O)OCCOC(c1ccccc1)c2ccccc2 34a_100000211180_200000036756 [0,1,0,0,0,1|2,0,0]=4 2306 B22R2.49735 CS(=O)(=O)OCCOC(c1ccccc1)c2ccccc2 7a_100000211180_200000036756 [0,1,0,0,0,1|2,0,0]=4 2307 B22R2.49735 C[N+](C)(C)CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100016990835 [0,1,0,0,0,1|1,0,1]=4 2308 B22R2.49735 C[N+](C)(C)CCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100016990835 [0,1,0,0,0,1|1,0,1]=4 2309 B22R2.49735 C[N+](C)(C)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100016990835 [0,1,0,0,0,1|0,0,1]=3 2310 B22R2.49735 C[N+](C)(C)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100016990835 [0,1,0,0,0,1|0,0,1]=3 2311 B22R2.49735 C[N+](C)(C)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100016990835 [0,1,0,0,0,1|1,0,1]=4 2312 B22R2.49735 C[N+](C)(C)CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100016990835 [0,1,0,0,0,1|0,1,1]=4 2313 B22R2.49735 C[N+](C)(C)CCCSC(c1ccccc1)c2ccccc2 62a_100016990835_100011216954 [0,1,0,0,0,1|0,1,1]=4 2314 B22R2.49735 C[N+](C)(C)CCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000085578 [0,1,0,0,0,1|1,0,1]=4 2315 B22R2.49735 C[N+](C)(C)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000085578 [0,1,0,0,0,1|0,0,1]=3 2316 B22R2.49735 C[N+](C)(C)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000085578 [0,1,0,0,0,1|0,0,1]=3 2317 B22R2.49735 C[N+](C)(C)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_200000036245 [0,1,0,0,0,1|1,0,1]=4 2318 B22R2.49735 C[N+](C)(C)CSCCC(c1ccccc1)c2ccccc2 62a_200000036245_100009813428 [0,1,0,0,0,1|1,0,1]=4 2319 B22R2.49735 C[Si](C)(C)/C=C/COC(c1ccccc1)c2ccccc2 7a_200016270829_100011216954 [0,1,0,0,0,1|1,0,1]=4 2320 B22R2.49735 C[Si](C)(C)C#CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000764098 [0,1,0,0,0,1|1,0,1]=4 2321 B22R2.49735 C[Si](C)(C)C#CCOC(c1ccccc1)c2ccccc2 7a_100000036595_100011216954 [0,1,0,0,0,1|1,0,1]=4 2322 B22R2.49735 C[Si](C)(C)C#CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000764098 [0,1,0,0,0,1|1,0,1]=4 2323 B22R2.49735 C[Si](C)(C)CCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011219597 [0,1,0,0,0,1|2,0,0]=4 2324 B22R2.49735 C[Si](C)(C)CCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011219597 [0,1,0,0,0,1|2,0,0]=4 2325 B22R2.49735 C[Si](C)(C)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011219597 [0,1,0,0,0,1|1,0,0]=3 2326 B22R2.49735 C[Si](C)(C)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011219597 [0,1,0,0,0,1|1,0,0]=3 2327 B22R2.49735 C[Si](C)(C)CCCOC(c1ccccc1)c2ccccc2 7a_200011215415_100011216954 [0,1,0,0,0,1|1,0,0]=3 2328 B22R2.49735 C[Si](C)(C)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011219597 [0,1,0,0,0,1|2,0,0]=4 2329 B22R2.49735 C[Si](C)(C)CCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_200000733723 [0,1,0,0,0,1|2,0,0]=4 2330 B22R2.49735 C[Si](C)(C)CCNCC(c1ccccc1)c2ccccc2 34a_100000739227_200000733723 [0,1,0,0,0,1|2,0,0]=4 2331 B22R2.49735 C[Si](C)(C)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_200000733723 [0,1,0,0,0,1|1,0,0]=3 2332 B22R2.49735 C[Si](C)(C)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_200000733723 [0,1,0,0,0,1|1,0,0]=3 2333 B22R2.49735 C[Si](C)(C)CNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000037933 [0,1,0,0,0,1|2,0,0]=4 2334 B22R2.49735 C[Si](C)(C)COCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000233785 [0,1,0,0,0,1|2,0,0]=4 2335 B22R2.49735 C[Si](C)(C)CSCCC(c1ccccc1)c2ccccc2 62a_100000037933_100009813428 [0,1,0,0,0,1|2,0,0]=4 2336 B22R2.49735 C[Si](C)(C)CSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000037933 [0,1,0,0,0,1|2,0,0]=4 2337 B22R2.49735 C[Si](C)(C)OCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_200000032530 [0,1,0,0,0,1|2,0,0]=4 2338 B22R2.49735 C[Si](C)(C)OCCNC(c1ccccc1)c2ccccc2 34a_100000162943_200000032530 [0,1,0,0,0,1|2,0,0]=4 2339 B22R2.49735 C[Si](C)(C)OCCOC(c1ccccc1)c2ccccc2 34a_100000211180_200000032530 [0,1,0,0,0,1|1,0,0]=3 2340 B22R2.49735 C[Si](C)(C)OCCOC(c1ccccc1)c2ccccc2 7a_100000211180_200000032530 [0,1,0,0,0,1|1,0,0]=3 2341 B22R2.49735 C[Si](C)(C)OCCOC(c1ccccc1)c2ccccn2 7a_100000180852_200000032530 [0,1,0,0,0,1|2,0,0]=4 2342 B22R2.49735 C[Si](C)(C)OCCSC(c1ccccc1)c2ccccc2 62a_100000211591_200000032530 [0,1,0,0,0,1|1,1,0]=4 2343 B22R2.49735 C[Si](C)(C)OCCSC(c1ccccc1)c2ccccc2 62a_200000032530_100011216954 [0,1,0,0,0,1|1,1,0]=4 2344 B22R2.50919 CC(=O)CCC(=O)OC(c1ccccc1)c2ccccc2 1458a_100160571778_200000210301 [0,1,0,0,0,1|2,0,0]=4 2345 B22R2.50919 CC(C)CCC(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_100000210312 [0,1,0,0,0,1|2,0,0]=4 2346 B22R2.50919 CC(C)CCC(=O)NC(c1ccccc1)c2ccccc2 11a_100000162943_100000181311 [0,1,0,0,0,1|2,0,0]=4 2347 B22R2.50919 CC(C)CCC(=O)NC(c1ccccc1)c2ccccc2 1626a_100000162943_100000181311 [0,1,0,0,0,1|2,0,0]=4 2348 B22R2.50919 CC(C)CCC(=O)NC(c1ccccc1)c2ccccc2 240690a_100000162943_100000181311 [0,1,0,0,0,1|2,0,0]=4 2349 B22R2.50919 CC(C)CCC(=O)NC(c1ccccc1)c2ccccc2 527a_100000162943_100000181311 [0,1,0,0,0,1|2,0,0]=4 2350 B22R2.50919 CC(C)CCC(C)NC(c1ccccc1)c2ccccc2 2230a_100000162943_100011261404 [0,1,0,0,0,1|2,0,0]=4 2351 B22R2.50919 CC(C)CCC(C)NC(c1ccccc1)c2ccccc2 2230a_100138410893_100000211591 [0,1,0,0,0,1|2,0,0]=4 2352 B22R2.50919 CC(C)CCC(C)NC(c1ccccc1)c2ccccc2 270004a_100000162943_100000210476 [0,1,0,0,0,1|2,0,0]=4 2353 B22R2.50919 CC(C)CCC(C)NC(c1ccccc1)c2ccccc2 270004a_100138410893_100000210122 [0,1,0,0,0,1|2,0,0]=4 2354 B22R2.50919 CC(C)CCC(C)NC(c1ccccc1)c2ccccc2 34a_100000162943_100011261404 [0,1,0,0,0,1|2,0,0]=4 2355 B22R2.50919 CC(C)CCC(C)OC(c1ccccc1)c2ccccc2 34a_100000211180_100011261404 [0,1,0,0,0,1|1,0,0]=3 2356 B22R2.50919 CC(C)CCC(C)OC(c1ccccc1)c2ccccc2 7a_100011215350_100011216954 [0,1,0,0,0,1|1,0,0]=3 2357 B22R2.50919 CC(C)CNC(C)CC(c1ccccc1)c2ccccc2 270004a_100000210953_200000011111 [0,1,0,0,0,1|2,0,0]=4 2358 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccccc2 11a_100000162943_100000689311 [0,1,0,0,0,1|1,0,0]=3 2359 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccccc2 2230a_100102631434_100000402422 [0,1,0,0,0,1|1,0,0]=3 2360 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccccc2 240690a_100000162943_100000689311 [0,1,0,0,0,1|1,0,0]=3 2361 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccccc2 269982a_100102631434_100000402422 [0,1,0,0,0,1|1,0,0]=3 2362 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccccc2 527a_100000162943_100000689311 [0,1,0,0,0,1|1,0,0]=3 2363 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccccn2 11a_100000689936_100000689311 [0,1,0,0,0,1|2,0,0]=4 2364 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccccn2 240690a_100000689936_100000689311 [0,1,0,0,0,1|2,0,0]=4 2365 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccccn2 527a_100000689936_100000689311 [0,1,0,0,0,1|2,0,0]=4 2366 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2cccnc2 11a_100011232609_100000689311 [0,1,0,0,0,1|2,0,0]=4 2367 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2cccnc2 240690a_100011232609_100000689311 [0,1,0,0,0,1|2,0,0]=4 2368 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2cccnc2 527a_100011232609_100000689311 [0,1,0,0,0,1|2,0,0]=4 2369 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccncc2 11a_100025760769_100000689311 [0,1,0,0,0,1|2,0,0]=4 2370 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccncc2 240690a_100025760769_100000689311 [0,1,0,0,0,1|2,0,0]=4 2371 B22R2.50919 CN(C)CCC(=O)NC(c1ccccc1)c2ccncc2 527a_100025760769_100000689311 [0,1,0,0,0,1|2,0,0]=4 2372 B22R2.50919 C[S+](C)CCC(=O)NC(c1ccccc1)c2ccccc2 11a_100000162943_100009452791 [0,1,0,0,0,1|2,0,0]=4 2373 B22R2.50919 C[S+](C)CCC(=O)NC(c1ccccc1)c2ccccc2 1626a_100000162943_100009452791 [0,1,0,0,0,1|2,0,0]=4 2374 B22R2.50919 C[S+](C)CCC(=O)NC(c1ccccc1)c2ccccc2 240690a_100000162943_100009452791 [0,1,0,0,0,1|2,0,0]=4 2375 B22R2.50919 [13CH3]C(=O)CCC(=O)OC(c1ccccc1)c2ccccc2 1458a_100160571778_200025704644 [0,1,0,0,0,1|2,0,0]=4 2376 B22R2.284264 CC(=CCCNC(c1ccccc1)c2ccccc2Br)C 2230a_100011211563_100011217483 [0,1,0,0,0,1|2,0,0]=4 2377 B22R2.284264 CC(=CCCNC(c1ccccc1)c2ccccc2Br)C 34a_100011211563_100011217483 [0,1,0,0,0,1|2,0,0]=4 2378 B22R2.284264 CC(=CCCNC(c1ccccc1)c2ccccc2C)C 2230a_100000222801_100011217483 [0,1,0,0,0,1|2,0,0]=4 2379 B22R2.284264 CC(=CCCNC(c1ccccc1)c2ccccc2C)C 34a_100000222801_100011217483 [0,1,0,0,0,1|2,0,0]=4 2380 B22R2.284264 CC(=CCCOC(c1ccccc1)c2ccccc2C)C 34a_100000212071_100011217483 [0,1,0,0,0,1|1,0,0]=3 2381 B22R2.284264 CC(=CCCOC(c1ccccc1)c2ccccc2C)C 7a_100000212071_100011217483 [0,1,0,0,0,1|1,0,0]=3 2382 B22R2.284264 CC(=CCCOC(c1ccccc1)c2ccccc2Cl)C 34a_200011400577_100011217483 [0,1,0,0,0,1|1,0,0]=3 2383 B22R2.284264 CC(=CCCOC(c1ccccc1)c2ccccc2Cl)C 7a_200011400577_100011217483 [0,1,0,0,0,1|1,0,0]=3 2384 B22R2.284264 CC(=CCCOC(c1ccccc1)c2ccccc2N)C 34a_100000246470_100011217483 [0,1,0,0,0,1|1,0,0]=3 2385 B22R2.284264 CC(=CCCOC(c1ccccc1)c2ccccc2N)C 7a_100000246470_100011217483 [0,1,0,0,0,1|1,0,0]=3 2386 B22R2.284264 CC(=O)CCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000685027 [0,1,0,0,0,1|2,0,0]=4 2387 B22R2.284264 CC(=O)CCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100011215641 [0,1,0,0,0,1|2,0,0]=4 2388 B22R2.284264 CC(=O)CCCOC(c1ccccc1)c2ccccc2C 7a_100000759063_100000230135 [0,1,0,0,0,1|2,0,0]=4 2389 B22R2.284264 CC(=O)CCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000685027 [0,1,0,0,0,1|2,0,0]=4 2390 B22R2.284264 CC(=O)CCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100011215641 [0,1,0,0,0,1|2,0,0]=4 2391 B22R2.284264 CC(=O)CCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000685027 [0,1,0,0,0,1|2,0,0]=4 2392 B22R2.284264 CC(=O)CCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100011215641 [0,1,0,0,0,1|2,0,0]=4 2393 B22R2.284264 CC(=O)NCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000189650 [0,1,0,0,0,1|2,0,0]=4 2394 B22R2.284264 CC(=O)NCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000189650 [0,1,0,0,0,1|2,0,0]=4 2395 B22R2.284264 CC(=O)NCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000189650 [0,1,0,0,0,1|2,0,0]=4 2396 B22R2.284264 CC(=O)OCCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100009814007 [0,1,0,0,0,1|2,0,0]=4 2397 B22R2.284264 CC(=O)OCCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100009814007 [0,1,0,0,0,1|2,0,0]=4 2398 B22R2.284264 CC(=O)OCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100009814007 [0,1,0,0,0,1|2,0,0]=4 2399 B22R2.284264 CC(=O)OCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100009814007 [0,1,0,0,0,1|2,0,0]=4 2400 B22R2.284264 CC(=O)OCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100009814007 [0,1,0,0,0,1|2,0,0]=4 2401 B22R2.284264 CC(=O)OCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100009814007 [0,1,0,0,0,1|2,0,0]=4 2402 B22R2.284264 CC(C)CCCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100011214892 [0,1,0,0,0,1|2,0,0]=4 2403 B22R2.284264 CC(C)CCCNC(c1ccccc1)c2ccccc2Br 270004a_200000737386_100000198044 [0,1,0,0,0,1|2,0,0]=4 2404 B22R2.284264 CC(C)CCCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100011214892 [0,1,0,0,0,1|2,0,0]=4 2405 B22R2.284264 CC(C)CCCNC(c1ccccc1)c2ccccc2Cl 270004a_200000737386_100011215288 [0,1,0,0,0,1|2,0,0]=4 2406 B22R2.284264 CC(C)CCCNC(c1ccccc1)c2ccccc2F 270004a_200000737386_100011217773 [0,1,0,0,0,1|2,0,0]=4 2407 B22R2.284264 CC(C)CCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100011214892 [0,1,0,0,0,1|1,0,0]=3 2408 B22R2.284264 CC(C)CCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100011214892 [0,1,0,0,0,1|1,0,0]=3 2409 B22R2.284264 CC(C)CCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100011214892 [0,1,0,0,0,1|1,0,0]=3 2410 B22R2.284264 CC(C)CCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100011214892 [0,1,0,0,0,1|1,0,0]=3 2411 B22R2.284264 CC(C)OCCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000211751 [0,1,0,0,0,1|2,0,0]=4 2412 B22R2.284264 CC(C)OCCNC(c1ccccc1)c2ccccc2Br 270004a_100000701111_100000198044 [0,1,0,0,0,1|2,0,0]=4 2413 B22R2.284264 CC(C)OCCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000211751 [0,1,0,0,0,1|2,0,0]=4 2414 B22R2.284264 CC(C)OCCNC(c1ccccc1)c2ccccc2Cl 270004a_100000701111_100011215288 [0,1,0,0,0,1|2,0,0]=4 2415 B22R2.284264 CC(C)OCCNC(c1ccccc1)c2ccccc2F 270004a_100000701111_100011217773 [0,1,0,0,0,1|2,0,0]=4 2416 B22R2.284264 CC(C)OCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000211751 [0,1,0,0,0,1|1,0,0]=3 2417 B22R2.284264 CC(C)OCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000211751 [0,1,0,0,0,1|1,0,0]=3 2418 B22R2.284264 CC(C)OCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000211751 [0,1,0,0,0,1|1,0,0]=3 2419 B22R2.284264 CC(C)OCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000211751 [0,1,0,0,0,1|1,0,0]=3 2420 B22R2.284264 CC(C)SCCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000730970 [0,1,0,0,0,1|2,0,0]=4 2421 B22R2.284264 CC(C)SCCNC(c1ccccc1)c2ccccc2Br 270004a_100000731138_100000198044 [0,1,0,0,0,1|2,0,0]=4 2422 B22R2.284264 CC(C)SCCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000730970 [0,1,0,0,0,1|2,0,0]=4 2423 B22R2.284264 CC(C)SCCNC(c1ccccc1)c2ccccc2Cl 270004a_100000731138_100011215288 [0,1,0,0,0,1|2,0,0]=4 2424 B22R2.284264 CC(C)SCCNC(c1ccccc1)c2ccccc2F 270004a_100000731138_100011217773 [0,1,0,0,0,1|2,0,0]=4 2425 B22R2.284264 CC(C)SCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000730970 [0,1,0,0,0,1|1,0,0]=3 2426 B22R2.284264 CC(C)SCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000730970 [0,1,0,0,0,1|1,0,0]=3 2427 B22R2.284264 CC(C)SCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000730970 [0,1,0,0,0,1|1,0,0]=3 2428 B22R2.284264 CC(C)SCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000730970 [0,1,0,0,0,1|1,0,0]=3 2429 B22R2.284264 CC(O)CCCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_200000718107 [0,1,0,0,0,1|2,0,0]=4 2430 B22R2.284264 CC(O)CCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_200000718107 [0,1,0,0,0,1|2,0,0]=4 2431 B22R2.284264 CC(O)CCCOC(c1ccccc1)c2ccccc2N 34a_100000246470_200000718107 [0,1,0,0,0,1|2,0,0]=4 2432 B22R2.284264 CC(O)CCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_200000718107 [0,1,0,0,0,1|2,0,0]=4 2433 B22R2.284264 CN(C)CCCNC(c1ccccc1)c2ccccc2Br 270004a_102531767803_100000198044 [0,1,0,0,0,1|1,0,0]=3 2434 B22R2.284264 CN(C)CCCNC(c1ccccc1)c2ccccc2Cl 270004a_102531767803_100011215288 [0,1,0,0,0,1|1,0,0]=3 2435 B22R2.284264 CN(C)CCCNC(c1ccccc1)c2ccccc2F 270004a_102531767803_100011217773 [0,1,0,0,0,1|1,0,0]=3 2436 B22R2.284264 CN(C)CCCNC(c1ccccn1)c2ccccc2Cl 270004a_102531767803_100011400554 [0,1,0,0,0,1|2,0,0]=4 2437 B22R2.284264 CN(C)CCCNC(c1cccnc1)c2ccccc2Br 270004a_102531767803_100011532686 [0,1,0,0,0,1|2,0,0]=4 2438 B22R2.284264 CN(C)CCCNC(c1cccnc1)c2ccccc2Cl 270004a_102531767803_200011400555 [0,1,0,0,0,1|2,0,0]=4 2439 B22R2.284264 CN(C)CCCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000757444 [0,1,0,0,0,1|0,0,0]=2 2440 B22R2.284264 CN(C)CCCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000757444 [0,1,0,0,0,1|0,0,0]=2 2441 B22R2.284264 Cc1ccccc1C(NCCCC(C)C)c2ccccc2 2230a_100000222801_100011214892 [0,1,0,0,0,1|2,0,0]=4 2442 B22R2.284264 Cc1ccccc1C(NCCCC(C)C)c2ccccc2 2230a_200000737386_100000230135 [0,1,0,0,0,1|2,0,0]=4 2443 B22R2.284264 Cc1ccccc1C(NCCCC(C)C)c2ccccc2 270004a_200000737386_100000735561 [0,1,0,0,0,1|2,0,0]=4 2444 B22R2.284264 Cc1ccccc1C(NCCCC(C)C)c2ccccc2 34a_100000222801_100011214892 [0,1,0,0,0,1|2,0,0]=4 2445 B22R2.284264 Cc1ccccc1C(NCCCN(C)C)c2ccccc2 270004a_102531767803_100000735561 [0,1,0,0,0,1|1,0,0]=3 2446 B22R2.284264 Cc1ccccc1C(NCCOC(C)C)c2ccccc2 2230a_100000222801_100000211751 [0,1,0,0,0,1|2,0,0]=4 2447 B22R2.284264 Cc1ccccc1C(NCCOC(C)C)c2ccccc2 2230a_100000701111_100000230135 [0,1,0,0,0,1|2,0,0]=4 2448 B22R2.284264 Cc1ccccc1C(NCCOC(C)C)c2ccccc2 270004a_100000701111_100000735561 [0,1,0,0,0,1|2,0,0]=4 2449 B22R2.284264 Cc1ccccc1C(NCCOC(C)C)c2ccccc2 34a_100000222801_100000211751 [0,1,0,0,0,1|2,0,0]=4 2450 B22R2.284264 Cc1ccccc1C(NCCSC(C)C)c2ccccc2 2230a_100000222801_100000730970 [0,1,0,0,0,1|2,0,0]=4 2451 B22R2.284264 Cc1ccccc1C(NCCSC(C)C)c2ccccc2 2230a_100000731138_100000230135 [0,1,0,0,0,1|2,0,0]=4 2452 B22R2.284264 Cc1ccccc1C(NCCSC(C)C)c2ccccc2 270004a_100000731138_100000735561 [0,1,0,0,0,1|2,0,0]=4 2453 B22R2.284264 Cc1ccccc1C(NCCSC(C)C)c2ccccc2 34a_100000222801_100000730970 [0,1,0,0,0,1|2,0,0]=4 2454 B22R2.284264 Cc1ccccc1C(OCCCC(C)C)c2ccccc2 34a_100000212071_100011214892 [0,1,0,0,0,1|1,0,0]=3 2455 B22R2.284264 Cc1ccccc1C(OCCCC(C)C)c2ccccc2 7a_100000210774_100000230135 [0,1,0,0,0,1|1,0,0]=3 2456 B22R2.284264 Cc1ccccc1C(OCCCC(C)C)c2ccccc2 7a_100000212071_100011214892 [0,1,0,0,0,1|1,0,0]=3 2457 B22R2.284264 Cc1ccccc1C(OCCCC(C)O)c2ccccc2 34a_100000212071_200000718107 [0,1,0,0,0,1|2,0,0]=4 2458 B22R2.284264 Cc1ccccc1C(OCCCC(C)O)c2ccccc2 7a_100000212071_200000718107 [0,1,0,0,0,1|2,0,0]=4 2459 B22R2.284264 Cc1ccccc1C(OCCCN(C)C)c2ccccc2 7a_100000212071_100000757444 [0,1,0,0,0,1|0,0,0]=2 2460 B22R2.284264 Cc1ccccc1C(OCCOC(C)C)c2ccccc2 34a_100000212071_100000211751 [0,1,0,0,0,1|1,0,0]=3 2461 B22R2.284264 Cc1ccccc1C(OCCOC(C)C)c2ccccc2 7a_100000211219_100000230135 [0,1,0,0,0,1|1,0,0]=3 2462 B22R2.284264 Cc1ccccc1C(OCCOC(C)C)c2ccccc2 7a_100000212071_100000211751 [0,1,0,0,0,1|1,0,0]=3 2463 B22R2.284264 Cc1ccccc1C(OCCSC(C)C)c2ccccc2 34a_100000212071_100000730970 [0,1,0,0,0,1|1,0,0]=3 2464 B22R2.284264 Cc1ccccc1C(OCCSC(C)C)c2ccccc2 7a_100000212071_100000730970 [0,1,0,0,0,1|1,0,0]=3 2465 B22R2.284264 Cc1ccccc1C(OCCSC(C)C)c2ccccc2 7a_200011212901_100000230135 [0,1,0,0,0,1|1,0,0]=3 2466 B22R2.284264 Cc1ccccc1C(SCCCN(C)C)c2ccccc2 62a_100000230135_100000757444 [0,1,0,0,0,1|0,1,0]=3 2467 B22R2.284264 Cc1ccccc1C(SCCOC(C)C)c2ccccc2 62a_100000211751_100000230135 [0,1,0,0,0,1|1,1,0]=4 2468 B22R2.284264 Cc1ccccc1C(SCCOC(C)C)c2ccccc2 62a_100000230135_100000211751 [0,1,0,0,0,1|1,1,0]=4 2469 B22R2.284264 Cc1ccccc1C(SCCSC(C)C)c2ccccc2 62a_100000230135_100000730970 [0,1,0,0,0,1|1,1,0]=4 2470 B22R2.284264 Cc1ccccc1C(SCCSC(C)C)c2ccccc2 62a_100000730970_100000230135 [0,1,0,0,0,1|1,1,0]=4 2471 B22R2.354554 CC(=CCCOC(C)(c1ccccc1)c2ccccc2)C 7a_100011202337_100011217483 [0,1,0,0,0,1|1,0,0]=3 2472 B22R2.354554 CC(=CCCOC(C)(c1ccccc1)c2ccccn2)C 7a_200000075192_100011217483 [0,1,0,0,0,1|2,0,0]=4 2473 B22R2.354554 CC(=O)CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100011215641 [0,1,0,0,0,1|2,0,0]=4 2474 B22R2.354554 CC(=O)NCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000189650 [0,1,0,0,0,1|2,0,0]=4 2475 B22R2.354554 CC(=O)OCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100009814007 [0,1,0,0,0,1|2,0,0]=4 2476 B22R2.354554 CC(C)CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100011214892 [0,1,0,0,0,1|1,0,0]=3 2477 B22R2.354554 CC(C)CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011214892 [0,1,0,0,0,1|2,0,0]=4 2478 B22R2.354554 CC(C)CCNCC(C)(c1ccccc1)c2ccccc2 2230a_100000706881_100000210312 [0,1,0,0,0,1|2,0,0]=4 2479 B22R2.354554 CC(C)CCNCC(C)(c1ccccc1)c2ccccc2 269862a_100000706881_100000185833 [0,1,0,0,0,1|2,0,0]=4 2480 B22R2.354554 CC(C)CCOCP(=O)(c1ccccc1)c2ccccc2 34a_200000030349_100000210312 [0,1,0,0,0,1|2,0,0]=4 2481 B22R2.354554 CC(C)CCOCP(=O)(c1ccccc1)c2ccccc2 7a_200000030349_100000210626 [0,1,0,0,0,1|2,0,0]=4 2482 B22R2.354554 CC(C)OCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000211751 [0,1,0,0,0,1|1,0,0]=3 2483 B22R2.354554 CC(C)OCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000211751 [0,1,0,0,0,1|2,0,0]=4 2484 B22R2.354554 CC(C)SCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000730970 [0,1,0,0,0,1|1,0,0]=3 2485 B22R2.354554 CC(C)SCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000730970 [0,1,0,0,0,1|2,0,0]=4 2486 B22R2.354554 CC(O)CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_200000718107 [0,1,0,0,0,1|2,0,0]=4 2487 B22R2.354554 CN(C)CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000757444 [0,1,0,0,0,1|0,0,0]=2 2488 B22R2.354554 CN(C)CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000757444 [0,1,0,0,0,1|1,0,0]=3 2489 B22R2.354554 CN(C)CCOCP(=O)(c1ccccc1)c2ccccc2 7a_200000030349_100000755713 [0,1,0,0,0,1|1,0,0]=3 2490 B22R2.357800 CC(C)CC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000210554_100009813428 [0,1,0,0,0,1|2,0,0]=4 2491 B22R2.357800 CC(C)CC(=O)CSC(c1ccccc1)c2ccccc2 1458a_100000683935_100000210624 [0,1,0,0,0,1|1,1,0]=4 2492 B22R2.357800 CC(C)CC(C)NCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000731052 [0,1,0,0,0,1|2,0,0]=4 2493 B22R2.357800 CC(C)CC(C)NCC(c1ccccc1)c2ccccc2 34a_100000739227_100000731052 [0,1,0,0,0,1|2,0,0]=4 2494 B22R2.357800 CC(C)CC(C)OCC(c1ccccc1)c2ccccc2 34a_100011215272_100000731052 [0,1,0,0,0,1|1,0,0]=3 2495 B22R2.357800 CC(C)CC(C)OCC(c1ccccc1)c2ccccc2 7a_100011215272_100000731052 [0,1,0,0,0,1|1,0,0]=3 2496 B22R2.357800 CC(C)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100000747067_100009813428 [0,1,0,0,0,1|2,0,0]=4 2497 B22R2.357800 CC(C)CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_100000210760 [0,1,0,0,0,1|2,0,0]=4 2498 B22R2.357800 CC(C)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100000747067_100009813428 [0,1,0,0,0,1|2,0,0]=4 2499 B22R2.357800 CC(C)CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_100000210624 [0,1,0,0,0,1|2,0,0]=4 2500 B22R2.357800 CC(C)CN(C)CCC(c1ccccc1)c2ccccc2 270004a_100025726140_100000210432 [0,1,0,0,0,1|2,0,0]=4 2501 B22R2.357800 CC(C)CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_100000210624 [0,1,0,0,0,1|2,0,0]=4 2502 B22R2.357800 CC(C)NC(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000183996 [0,1,0,0,0,1|1,0,1]=4 2503 B22R2.357800 CC(C)NC(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000183996 [0,1,0,0,0,1|1,0,1]=4 2504 B22R2.357800 CC(C)OC(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011215430 [0,1,0,0,0,1|1,0,1]=4 2505 B22R2.357800 CC(C)OC(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100011215430 [0,1,0,0,0,1|1,0,1]=4 2506 B22R2.357800 CC(CNC(c1ccccc1)c2ccccc2)CN(C)C 2230a_100000162943_100015348159 [0,1,0,0,0,1|1,0,0]=3 2507 B22R2.357800 CC(CNC(c1ccccc1)c2ccccn2)CN(C)C 2230a_100000689936_100015348159 [0,1,0,0,0,1|2,0,0]=4 2508 B22R2.357800 CC(CNC(c1ccccc1)c2cccnc2)CN(C)C 2230a_100011232609_100015348159 [0,1,0,0,0,1|2,0,0]=4 2509 B22R2.357800 CC(CNC(c1ccccc1)c2ccncc2)CN(C)C 2230a_100025760769_100015348159 [0,1,0,0,0,1|2,0,0]=4 2510 B22R2.357800 CC(COC(c1ccccc1)c2ccccc2)CN(C)C 7a_100000211180_100015348159 [0,1,0,0,0,1|0,0,0]=2 2511 B22R2.357800 CC(COC(c1ccccc1)c2ccccn2)CN(C)C 7a_100000180852_100015348159 [0,1,0,0,0,1|1,0,0]=3 2512 B22R2.357800 CC(CSC(c1ccccc1)c2ccccc2)CN(C)C 62a_100000211591_100015348159 [0,1,0,0,0,1|0,1,0]=3 2513 B22R2.357800 CC(CSC(c1ccccc1)c2ccccc2)CN(C)C 62a_100015348159_100011216954 [0,1,0,0,0,1|0,1,0]=3 2514 B22R2.357800 CN(C)CC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000750896_100009813428 [0,1,0,0,0,1|1,0,0]=3 2515 B22R2.357800 CN(C)CC(=O)CC[S+](c1ccccc1)c2ccccc2 1458a_100000750896_100010140906 [0,1,0,0,0,1|2,0,0]=4 2516 B22R2.357800 CN(C)CC(=O)NCC(c1ccccc1)c2ccccc2 2230a_100102631434_200000735016 [0,1,0,0,0,1|1,0,1]=4 2517 B22R2.357800 CN(C)CC(=O)NCC(c1ccccc1)c2ccccc2 240690a_100000739227_100000750896 [0,1,0,0,0,1|1,0,1]=4 2518 B22R2.357800 CN(C)CC(=O)NCC(c1ccccc1)c2ccccc2 269982a_100102631434_200000735016 [0,1,0,0,0,1|1,0,1]=4 2519 B22R2.357800 CN(C)CC(=O)NCC(c1ccccc1)c2ccccc2 527a_100000739227_100000750896 [0,1,0,0,0,1|1,0,1]=4 2520 B22R2.357800 CN(C)CC(=O)NNC(c1ccccc1)c2ccccc2 22a_100000742501_100000750896 [0,1,0,0,0,1|1,0,1]=4 2521 B22R2.357800 C[S+](C)CC(=O)CCC(c1ccccc1)c2ccccc2 1458a_200159257847_100009813428 [0,1,0,0,0,1|2,0,0]=4 2522 B22R2.359629 CC(=CCCC(=O)C(c1ccccc1)c2ccccc2)C 1458a_100000210944_100011217483 [0,1,0,0,0,1|2,0,0]=4 2523 B22R2.359629 CC(=CCCN(C)C(c1ccccc1)c2ccccc2)C 2230a_100103148541_100011217483 [0,1,0,0,0,1|2,0,0]=4 2524 B22R2.359629 CC(=CCCN(C)C(c1ccccc1)c2ccccc2)C 269982a_100103148541_100011217483 [0,1,0,0,0,1|2,0,0]=4 2525 B22R2.359629 CC(C)CCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100011214892 [0,1,0,0,0,1|2,0,0]=4 2526 B22R2.359629 CC(C)CCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100011216857_100011216954 [0,1,0,0,0,1|2,0,0]=4 2527 B22R2.359629 CC(C)CCCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100011214892 [0,1,0,0,0,1|2,0,0]=4 2528 B22R2.359629 CC(C)CCCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100011214892 [0,1,0,0,0,1|2,0,0]=4 2529 B22R2.359629 CC(C)CCNC(=O)C(c1ccccc1)c2ccccc2 11a_100000210545_100000210944 [0,1,0,0,0,1|2,0,0]=4 2530 B22R2.359629 CC(C)CCNC(=O)C(c1ccccc1)c2ccccc2 1626a_100000210545_100000210944 [0,1,0,0,0,1|2,0,0]=4 2531 B22R2.359629 CC(C)CCNC(=O)C(c1ccccc1)c2ccccc2 240690a_100000210545_100000210944 [0,1,0,0,0,1|2,0,0]=4 2532 B22R2.359629 CC(C)CCNC(=O)C(c1ccccc1)c2ccccc2 527a_100000210545_100000210944 [0,1,0,0,0,1|2,0,0]=4 2533 B22R2.359629 CC(C)COCC(=O)C(c1ccccc1)c2ccccc2 1458a_100011223364_100011216954 [0,1,0,0,0,1|2,0,0]=4 2534 B22R2.359629 CC(C)OCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000211751 [0,1,0,0,0,1|2,0,0]=4 2535 B22R2.359629 CC(C)OCCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000211751 [0,1,0,0,0,1|2,0,0]=4 2536 B22R2.359629 CC(C)OCCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000211751 [0,1,0,0,0,1|2,0,0]=4 2537 B22R2.359629 CC(C)SCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000730970 [0,1,0,0,0,1|2,0,0]=4 2538 B22R2.359629 CC(C)SCCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000730970 [0,1,0,0,0,1|2,0,0]=4 2539 B22R2.359629 CC(C)SCCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000730970 [0,1,0,0,0,1|2,0,0]=4 2540 B22R2.359629 CN(C)CC=CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000754359_100011216954 [0,1,0,0,0,1|1,0,1]=4 2541 B22R2.359629 CN(C)CCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000695564 [0,1,0,0,0,1|1,0,0]=3 2542 B22R2.359629 CN(C)CCCN(C)C(c1ccccc1)c2ccccc2 269982a_100000225831_100000211591 [0,1,0,0,0,1|1,0,0]=3 2543 B22R2.359629 CN(C)CCCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000757444 [0,1,0,0,0,1|1,0,0]=3 2544 B22R2.359629 CN(C)CCCN(C)C(c1ccccc1)c2ccccc2 270004a_100000225831_100000210122 [0,1,0,0,0,1|1,0,0]=3 2545 B22R2.359629 CN(C)CCCN(C)C(c1ccccc1)c2ccccn2 270004a_100000225831_100000210380 [0,1,0,0,0,1|2,0,0]=4 2546 B22R2.359629 CN(C)CCCN(C)C(c1ccccc1)c2cccnc2 270004a_100000225831_100000735413 [0,1,0,0,0,1|2,0,0]=4 2547 B22R2.359629 CN(C)CCNC(=O)C(c1ccccc1)c2ccccc2 240690a_100000210585_100000210944 [0,1,0,0,0,1|1,0,0]=3 2548 B22R2.359629 CN(C)CCNC(=O)C(c1ccccc1)c2ccccc2 527a_100000210585_100000210944 [0,1,0,0,0,1|1,0,0]=3 2549 B22R2.532051 CC(=CCCNC(c1ccccc1)c2ccc(cc2)Br)C 2230a_100000745999_100011217483 [0,1,0,0,0,1|2,0,0]=4 2550 B22R2.532051 CC(=CCCNC(c1ccccc1)c2ccc(cc2)Br)C 34a_100000745999_100011217483 [0,1,0,0,0,1|2,0,0]=4 2551 B22R2.532051 CC(=CCCNC(c1ccccc1)c2ccc(cc2)C)C 2230a_100000736602_100011217483 [0,1,0,0,0,1|2,0,0]=4 2552 B22R2.532051 CC(=CCCNC(c1ccccc1)c2ccc(cc2)C)C 34a_100000736602_100011217483 [0,1,0,0,0,1|2,0,0]=4 2553 B22R2.532051 CC(=CCCNC(c1ccccc1)c2ccc(cc2)Cl)C 2230a_100000737946_100011217483 [0,1,0,0,0,1|2,0,0]=4 2554 B22R2.532051 CC(=CCCNC(c1ccccc1)c2ccc(cc2)Cl)C 34a_100000737946_100011217483 [0,1,0,0,0,1|2,0,0]=4 2555 B22R2.532051 CC(=CCCNC(c1ccccc1)c2ccc(cc2)F)C 2230a_100000737529_100011217483 [0,1,0,0,0,1|2,0,0]=4 2556 B22R2.532051 CC(=CCCNC(c1ccccc1)c2ccc(cc2)F)C 34a_100000737529_100011217483 [0,1,0,0,0,1|2,0,0]=4 2557 B22R2.532051 CC(=CCCNC(c1ccccc1)c2ccc(cc2)O)C 34a_100000198503_100011217483 [0,1,0,0,0,1|2,0,0]=4 2558 B22R2.532051 CC(=CCCOC(c1ccc(cc1)Cl)c2ccccn2)C 34a_100000242608_100011217483 [0,1,0,0,0,1|2,0,0]=4 2559 B22R2.532051 CC(=CCCOC(c1ccccc1)c2ccc(cc2)Br)C 34a_100011217567_100011217483 [0,1,0,0,0,1|1,0,0]=3 2560 B22R2.532051 CC(=CCCOC(c1ccccc1)c2ccc(cc2)Br)C 7a_100011217567_100011217483 [0,1,0,0,0,1|1,0,0]=3 2561 B22R2.532051 CC(=CCCOC(c1ccccc1)c2ccc(cc2)C)C 34a_100000212064_100011217483 [0,1,0,0,0,1|1,0,0]=3 2562 B22R2.532051 CC(=CCCOC(c1ccccc1)c2ccc(cc2)C)C 7a_100000212064_100011217483 [0,1,0,0,0,1|1,0,0]=3 2563 B22R2.532051 CC(=CCCOC(c1ccccc1)c2ccc(cc2)Cl)C 34a_100000211768_100011217483 [0,1,0,0,0,1|1,0,0]=3 2564 B22R2.532051 CC(=CCCOC(c1ccccc1)c2ccc(cc2)Cl)C 7a_100000211768_100011217483 [0,1,0,0,0,1|1,0,0]=3 2565 B22R2.532051 CC(=CCCOC(c1ccccc1)c2ccc(cc2)F)C 34a_200000246460_100011217483 [0,1,0,0,0,1|1,0,0]=3 2566 B22R2.532051 CC(=CCCOC(c1ccccc1)c2ccc(cc2)F)C 7a_200000246460_100011217483 [0,1,0,0,0,1|1,0,0]=3 2567 B22R2.532051 CC(=CCCOC(c1ccccc1)c2ccc(cc2)N)C 34a_100011236343_100011217483 [0,1,0,0,0,1|1,0,0]=3 2568 B22R2.532051 CC(=CCCOC(c1ccccc1)c2ccc(cc2)N)C 7a_100011236343_100011217483 [0,1,0,0,0,1|1,0,0]=3 2569 B22R2.532051 CC(=CCCOC(c1ccncc1)c2ccc(cc2)F)C 34a_100000748166_100011217483 [0,1,0,0,0,1|2,0,0]=4 2570 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000685027 [0,1,0,0,0,1|2,0,0]=4 2571 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100011215641 [0,1,0,0,0,1|2,0,0]=4 2572 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100000685027 [0,1,0,0,0,1|2,0,0]=4 2573 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100011215641 [0,1,0,0,0,1|2,0,0]=4 2574 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000685027 [0,1,0,0,0,1|2,0,0]=4 2575 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100011215641 [0,1,0,0,0,1|2,0,0]=4 2576 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000759063_100000211669 [0,1,0,0,0,1|2,0,0]=4 2577 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000685027 [0,1,0,0,0,1|2,0,0]=4 2578 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100011215641 [0,1,0,0,0,1|2,0,0]=4 2579 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000685027 [0,1,0,0,0,1|2,0,0]=4 2580 B22R2.532051 CC(=O)CCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100011215641 [0,1,0,0,0,1|2,0,0]=4 2581 B22R2.532051 CC(=O)NCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000189650 [0,1,0,0,0,1|2,0,0]=4 2582 B22R2.532051 CC(=O)NCCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000189650 [0,1,0,0,0,1|2,0,0]=4 2583 B22R2.532051 CC(=O)NCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000189650 [0,1,0,0,0,1|2,0,0]=4 2584 B22R2.532051 CC(=O)NCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000189650 [0,1,0,0,0,1|2,0,0]=4 2585 B22R2.532051 CC(=O)NCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000189650 [0,1,0,0,0,1|2,0,0]=4 2586 B22R2.532051 CC(=O)OCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100009814007 [0,1,0,0,0,1|2,0,0]=4 2587 B22R2.532051 CC(=O)OCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100009814007 [0,1,0,0,0,1|2,0,0]=4 2588 B22R2.532051 CC(=O)OCCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100009814007 [0,1,0,0,0,1|2,0,0]=4 2589 B22R2.532051 CC(=O)OCCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100009814007 [0,1,0,0,0,1|2,0,0]=4 2590 B22R2.532051 CC(=O)OCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100009814007 [0,1,0,0,0,1|2,0,0]=4 2591 B22R2.532051 CC(=O)OCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100009814007 [0,1,0,0,0,1|2,0,0]=4 2592 B22R2.532051 CC(=O)OCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100009814007 [0,1,0,0,0,1|2,0,0]=4 2593 B22R2.532051 CC(=O)OCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100009814007 [0,1,0,0,0,1|2,0,0]=4 2594 B22R2.532051 CC(=O)OCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100009814007 [0,1,0,0,0,1|2,0,0]=4 2595 B22R2.532051 CC(=O)OCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100009814007 [0,1,0,0,0,1|2,0,0]=4 2596 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100011214892 [0,1,0,0,0,1|2,0,0]=4 2597 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)Br 270004a_200000737386_100000718703 [0,1,0,0,0,1|2,0,0]=4 2598 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100011214892 [0,1,0,0,0,1|2,0,0]=4 2599 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100011214892 [0,1,0,0,0,1|2,0,0]=4 2600 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_200000737386_100000211669 [0,1,0,0,0,1|2,0,0]=4 2601 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_200000737386_100000211064 [0,1,0,0,0,1|2,0,0]=4 2602 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100011214892 [0,1,0,0,0,1|2,0,0]=4 2603 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100011214892 [0,1,0,0,0,1|2,0,0]=4 2604 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)F 270004a_200000737386_100000210425 [0,1,0,0,0,1|2,0,0]=4 2605 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100011214892 [0,1,0,0,0,1|2,0,0]=4 2606 B22R2.532051 CC(C)CCCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100011214892 [0,1,0,0,0,1|2,0,0]=4 2607 B22R2.532051 CC(C)CCCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100011214892 [0,1,0,0,0,1|2,0,0]=4 2608 B22R2.532051 CC(C)CCCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000210774_200010188304 [0,1,0,0,0,1|2,0,0]=4 2609 B22R2.532051 CC(C)CCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100011214892 [0,1,0,0,0,1|1,0,0]=3 2610 B22R2.532051 CC(C)CCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100011214892 [0,1,0,0,0,1|1,0,0]=3 2611 B22R2.532051 CC(C)CCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100011214892 [0,1,0,0,0,1|1,0,0]=3 2612 B22R2.532051 CC(C)CCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000210774_100000211669 [0,1,0,0,0,1|1,0,0]=3 2613 B22R2.532051 CC(C)CCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100011214892 [0,1,0,0,0,1|1,0,0]=3 2614 B22R2.532051 CC(C)CCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100011214892 [0,1,0,0,0,1|1,0,0]=3 2615 B22R2.532051 CC(C)CCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100011214892 [0,1,0,0,0,1|1,0,0]=3 2616 B22R2.532051 CC(C)CCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100011214892 [0,1,0,0,0,1|1,0,0]=3 2617 B22R2.532051 CC(C)CCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100011214892 [0,1,0,0,0,1|1,0,0]=3 2618 B22R2.532051 CC(C)CCCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100011214892 [0,1,0,0,0,1|2,0,0]=4 2619 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000211751 [0,1,0,0,0,1|2,0,0]=4 2620 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000701111_100000718703 [0,1,0,0,0,1|2,0,0]=4 2621 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000211751 [0,1,0,0,0,1|2,0,0]=4 2622 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000701111_100000211669 [0,1,0,0,0,1|2,0,0]=4 2623 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000211751 [0,1,0,0,0,1|2,0,0]=4 2624 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000701111_100000211064 [0,1,0,0,0,1|2,0,0]=4 2625 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000211751 [0,1,0,0,0,1|2,0,0]=4 2626 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000211751 [0,1,0,0,0,1|2,0,0]=4 2627 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000701111_100000210425 [0,1,0,0,0,1|2,0,0]=4 2628 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000211751 [0,1,0,0,0,1|2,0,0]=4 2629 B22R2.532051 CC(C)OCCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000211751 [0,1,0,0,0,1|2,0,0]=4 2630 B22R2.532051 CC(C)OCCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000211751 [0,1,0,0,0,1|2,0,0]=4 2631 B22R2.532051 CC(C)OCCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000211219_200010188304 [0,1,0,0,0,1|2,0,0]=4 2632 B22R2.532051 CC(C)OCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000211751 [0,1,0,0,0,1|1,0,0]=3 2633 B22R2.532051 CC(C)OCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000211751 [0,1,0,0,0,1|1,0,0]=3 2634 B22R2.532051 CC(C)OCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000211751 [0,1,0,0,0,1|1,0,0]=3 2635 B22R2.532051 CC(C)OCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211219_100000211669 [0,1,0,0,0,1|1,0,0]=3 2636 B22R2.532051 CC(C)OCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000211751 [0,1,0,0,0,1|1,0,0]=3 2637 B22R2.532051 CC(C)OCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000211751 [0,1,0,0,0,1|1,0,0]=3 2638 B22R2.532051 CC(C)OCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000211751 [0,1,0,0,0,1|1,0,0]=3 2639 B22R2.532051 CC(C)OCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000211751 [0,1,0,0,0,1|1,0,0]=3 2640 B22R2.532051 CC(C)OCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000211751 [0,1,0,0,0,1|1,0,0]=3 2641 B22R2.532051 CC(C)OCCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000211751 [0,1,0,0,0,1|2,0,0]=4 2642 B22R2.532051 CC(C)OCCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000211751 [0,1,0,0,0,1|1,1,0]=4 2643 B22R2.532051 CC(C)OCCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211751_100000211669 [0,1,0,0,0,1|1,1,0]=4 2644 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000730970 [0,1,0,0,0,1|2,0,0]=4 2645 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000731138_100000718703 [0,1,0,0,0,1|2,0,0]=4 2646 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000730970 [0,1,0,0,0,1|2,0,0]=4 2647 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000731138_100000211669 [0,1,0,0,0,1|2,0,0]=4 2648 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000730970 [0,1,0,0,0,1|2,0,0]=4 2649 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000731138_100000211064 [0,1,0,0,0,1|2,0,0]=4 2650 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000730970 [0,1,0,0,0,1|2,0,0]=4 2651 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000730970 [0,1,0,0,0,1|2,0,0]=4 2652 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000731138_100000210425 [0,1,0,0,0,1|2,0,0]=4 2653 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000730970 [0,1,0,0,0,1|2,0,0]=4 2654 B22R2.532051 CC(C)SCCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000730970 [0,1,0,0,0,1|2,0,0]=4 2655 B22R2.532051 CC(C)SCCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000730970 [0,1,0,0,0,1|2,0,0]=4 2656 B22R2.532051 CC(C)SCCOC(c1ccc(cc1)Cl)c2ccccn2 7a_200011212901_200010188304 [0,1,0,0,0,1|2,0,0]=4 2657 B22R2.532051 CC(C)SCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000730970 [0,1,0,0,0,1|1,0,0]=3 2658 B22R2.532051 CC(C)SCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000730970 [0,1,0,0,0,1|1,0,0]=3 2659 B22R2.532051 CC(C)SCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000730970 [0,1,0,0,0,1|1,0,0]=3 2660 B22R2.532051 CC(C)SCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000730970 [0,1,0,0,0,1|1,0,0]=3 2661 B22R2.532051 CC(C)SCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_200011212901_100000211669 [0,1,0,0,0,1|1,0,0]=3 2662 B22R2.532051 CC(C)SCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000730970 [0,1,0,0,0,1|1,0,0]=3 2663 B22R2.532051 CC(C)SCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000730970 [0,1,0,0,0,1|1,0,0]=3 2664 B22R2.532051 CC(C)SCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000730970 [0,1,0,0,0,1|1,0,0]=3 2665 B22R2.532051 CC(C)SCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000730970 [0,1,0,0,0,1|1,0,0]=3 2666 B22R2.532051 CC(C)SCCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000730970 [0,1,0,0,0,1|2,0,0]=4 2667 B22R2.532051 CC(O)CCCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_200000718107 [0,1,0,0,0,1|2,0,0]=4 2668 B22R2.532051 CC(O)CCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_200000718107 [0,1,0,0,0,1|2,0,0]=4 2669 B22R2.532051 CC(O)CCCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_200000718107 [0,1,0,0,0,1|2,0,0]=4 2670 B22R2.532051 CC(O)CCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_200000718107 [0,1,0,0,0,1|2,0,0]=4 2671 B22R2.532051 CC(O)CCCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_200000718107 [0,1,0,0,0,1|2,0,0]=4 2672 B22R2.532051 CC(O)CCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_200000718107 [0,1,0,0,0,1|2,0,0]=4 2673 B22R2.532051 CC(O)CCCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_200000718107 [0,1,0,0,0,1|2,0,0]=4 2674 B22R2.532051 CC(O)CCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_200000718107 [0,1,0,0,0,1|2,0,0]=4 2675 B22R2.532051 CN(C)CCCNC(c1ccc(cc1)Br)c2ccccn2 270004a_102531767803_200010179208 [0,1,0,0,0,1|2,0,0]=4 2676 B22R2.532051 CN(C)CCCNC(c1ccc(cc1)Br)c2cccnc2 270004a_102531767803_100000753996 [0,1,0,0,0,1|2,0,0]=4 2677 B22R2.532051 CN(C)CCCNC(c1ccc(cc1)Cl)c2ccccn2 270004a_102531767803_100000753647 [0,1,0,0,0,1|2,0,0]=4 2678 B22R2.532051 CN(C)CCCNC(c1ccc(cc1)Cl)c2cccnc2 270004a_102531767803_100000753233 [0,1,0,0,0,1|2,0,0]=4 2679 B22R2.532051 CN(C)CCCNC(c1ccccc1)c2ccc(cc2)Br 270004a_102531767803_100000718703 [0,1,0,0,0,1|1,0,0]=3 2680 B22R2.532051 CN(C)CCCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_102531767803_100000211064 [0,1,0,0,0,1|1,0,0]=3 2681 B22R2.532051 CN(C)CCCNC(c1ccccc1)c2ccc(cc2)F 270004a_102531767803_100000210425 [0,1,0,0,0,1|1,0,0]=3 2682 B22R2.532051 CN(C)CCCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000757444 [0,1,0,0,0,1|0,0,0]=2 2683 B22R2.532051 CN(C)CCCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000757444 [0,1,0,0,0,1|0,0,0]=2 2684 B22R2.532051 CN(C)CCCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000757444 [0,1,0,0,0,1|0,0,0]=2 2685 B22R2.532051 CN(C)CCCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000757444 [0,1,0,0,0,1|0,0,0]=2 2686 B22R2.532051 CN(C)CCCSC(c1ccc(cc1)Cl)c2ccccn2 62a_200010188304_100000757444 [0,1,0,0,0,1|1,1,0]=4 2687 B22R2.532051 CN(C)CCCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000757444 [0,1,0,0,0,1|0,1,0]=3 2688 B22R2.532051 Cc1ccc(cc1)C(NCCCC(C)C)c2ccccc2 2230a_100000736602_100011214892 [0,1,0,0,0,1|2,0,0]=4 2689 B22R2.532051 Cc1ccc(cc1)C(NCCCC(C)C)c2ccccc2 270004a_200000737386_100000210966 [0,1,0,0,0,1|2,0,0]=4 2690 B22R2.532051 Cc1ccc(cc1)C(NCCCC(C)C)c2ccccc2 34a_100000736602_100011214892 [0,1,0,0,0,1|2,0,0]=4 2691 B22R2.532051 Cc1ccc(cc1)C(NCCCN(C)C)c2ccccc2 270004a_102531767803_100000210966 [0,1,0,0,0,1|1,0,0]=3 2692 B22R2.532051 Cc1ccc(cc1)C(NCCOC(C)C)c2ccccc2 2230a_100000736602_100000211751 [0,1,0,0,0,1|2,0,0]=4 2693 B22R2.532051 Cc1ccc(cc1)C(NCCOC(C)C)c2ccccc2 270004a_100000701111_100000210966 [0,1,0,0,0,1|2,0,0]=4 2694 B22R2.532051 Cc1ccc(cc1)C(NCCOC(C)C)c2ccccc2 34a_100000736602_100000211751 [0,1,0,0,0,1|2,0,0]=4 2695 B22R2.532051 Cc1ccc(cc1)C(NCCSC(C)C)c2ccccc2 2230a_100000736602_100000730970 [0,1,0,0,0,1|2,0,0]=4 2696 B22R2.532051 Cc1ccc(cc1)C(NCCSC(C)C)c2ccccc2 270004a_100000731138_100000210966 [0,1,0,0,0,1|2,0,0]=4 2697 B22R2.532051 Cc1ccc(cc1)C(NCCSC(C)C)c2ccccc2 34a_100000736602_100000730970 [0,1,0,0,0,1|2,0,0]=4 2698 B22R2.532051 Cc1ccc(cc1)C(OCCCC(C)C)c2ccccc2 34a_100000212064_100011214892 [0,1,0,0,0,1|1,0,0]=3 2699 B22R2.532051 Cc1ccc(cc1)C(OCCCC(C)C)c2ccccc2 7a_100000212064_100011214892 [0,1,0,0,0,1|1,0,0]=3 2700 B22R2.532051 Cc1ccc(cc1)C(OCCCC(C)O)c2ccccc2 34a_100000212064_200000718107 [0,1,0,0,0,1|2,0,0]=4 2701 B22R2.532051 Cc1ccc(cc1)C(OCCCC(C)O)c2ccccc2 7a_100000212064_200000718107 [0,1,0,0,0,1|2,0,0]=4 2702 B22R2.532051 Cc1ccc(cc1)C(OCCCN(C)C)c2ccccc2 7a_100000212064_100000757444 [0,1,0,0,0,1|0,0,0]=2 2703 B22R2.532051 Cc1ccc(cc1)C(OCCOC(C)C)c2ccccc2 34a_100000212064_100000211751 [0,1,0,0,0,1|1,0,0]=3 2704 B22R2.532051 Cc1ccc(cc1)C(OCCOC(C)C)c2ccccc2 7a_100000212064_100000211751 [0,1,0,0,0,1|1,0,0]=3 2705 B22R2.532051 Cc1ccc(cc1)C(OCCSC(C)C)c2ccccc2 34a_100000212064_100000730970 [0,1,0,0,0,1|1,0,0]=3 2706 B22R2.532051 Cc1ccc(cc1)C(OCCSC(C)C)c2ccccc2 7a_100000212064_100000730970 [0,1,0,0,0,1|1,0,0]=3 2707 B22R2.3984294 CC(=CCCNC(c1ccccc1)c2cccc(c2)Br)C 2230a_100011212009_100011217483 [0,1,0,0,0,1|2,0,0]=4 2708 B22R2.3984294 CC(=CCCNC(c1ccccc1)c2cccc(c2)Br)C 34a_100011212009_100011217483 [0,1,0,0,0,1|2,0,0]=4 2709 B22R2.3984294 CC(=CCCNC(c1ccccc1)c2cccc(c2)Cl)C 2230a_100000741085_100011217483 [0,1,0,0,0,1|2,0,0]=4 2710 B22R2.3984294 CC(=CCCNC(c1ccccc1)c2cccc(c2)Cl)C 34a_100000741085_100011217483 [0,1,0,0,0,1|2,0,0]=4 2711 B22R2.3984294 CC(=CCCNC(c1ccccc1)c2cccc(c2)F)C 2230a_100000686443_100011217483 [0,1,0,0,0,1|2,0,0]=4 2712 B22R2.3984294 CC(=CCCNC(c1ccccc1)c2cccc(c2)F)C 34a_100000686443_100011217483 [0,1,0,0,0,1|2,0,0]=4 2713 B22R2.3984294 CC(=CCCOC(c1ccccc1)c2cccc(c2)Cl)C 34a_100000733576_100011217483 [0,1,0,0,0,1|1,0,0]=3 2714 B22R2.3984294 CC(=CCCOC(c1ccccc1)c2cccc(c2)Cl)C 7a_100000733576_100011217483 [0,1,0,0,0,1|1,0,0]=3 2715 B22R2.3984294 CC(=CCCOC(c1ccccc1)c2cccc(c2)F)C 34a_100000749007_100011217483 [0,1,0,0,0,1|1,0,0]=3 2716 B22R2.3984294 CC(=CCCOC(c1ccccc1)c2cccc(c2)F)C 7a_100000749007_100011217483 [0,1,0,0,0,1|1,0,0]=3 2717 B22R2.3984294 CC(=O)CCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000685027 [0,1,0,0,0,1|2,0,0]=4 2718 B22R2.3984294 CC(=O)CCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100011215641 [0,1,0,0,0,1|2,0,0]=4 2719 B22R2.3984294 CC(=O)CCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000685027 [0,1,0,0,0,1|2,0,0]=4 2720 B22R2.3984294 CC(=O)CCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100011215641 [0,1,0,0,0,1|2,0,0]=4 2721 B22R2.3984294 CC(=O)NCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000189650 [0,1,0,0,0,1|2,0,0]=4 2722 B22R2.3984294 CC(=O)NCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000189650 [0,1,0,0,0,1|2,0,0]=4 2723 B22R2.3984294 CC(=O)OCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100009814007 [0,1,0,0,0,1|2,0,0]=4 2724 B22R2.3984294 CC(=O)OCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100009814007 [0,1,0,0,0,1|2,0,0]=4 2725 B22R2.3984294 CC(=O)OCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100009814007 [0,1,0,0,0,1|2,0,0]=4 2726 B22R2.3984294 CC(=O)OCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100009814007 [0,1,0,0,0,1|2,0,0]=4 2727 B22R2.3984294 CC(C)CCCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100011214892 [0,1,0,0,0,1|2,0,0]=4 2728 B22R2.3984294 CC(C)CCCNC(c1ccccc1)c2cccc(c2)Br 270004a_200000737386_100011267660 [0,1,0,0,0,1|2,0,0]=4 2729 B22R2.3984294 CC(C)CCCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100011214892 [0,1,0,0,0,1|2,0,0]=4 2730 B22R2.3984294 CC(C)CCCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100011214892 [0,1,0,0,0,1|2,0,0]=4 2731 B22R2.3984294 CC(C)CCCNC(c1ccccc1)c2cccc(c2)Cl 270004a_200000737386_100011215489 [0,1,0,0,0,1|2,0,0]=4 2732 B22R2.3984294 CC(C)CCCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100011214892 [0,1,0,0,0,1|2,0,0]=4 2733 B22R2.3984294 CC(C)CCCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100011214892 [0,1,0,0,0,1|2,0,0]=4 2734 B22R2.3984294 CC(C)CCCNC(c1ccccc1)c2cccc(c2)F 270004a_200000737386_200011219850 [0,1,0,0,0,1|2,0,0]=4 2735 B22R2.3984294 CC(C)CCCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100011214892 [0,1,0,0,0,1|2,0,0]=4 2736 B22R2.3984294 CC(C)CCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100011214892 [0,1,0,0,0,1|1,0,0]=3 2737 B22R2.3984294 CC(C)CCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100011214892 [0,1,0,0,0,1|1,0,0]=3 2738 B22R2.3984294 CC(C)CCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100011214892 [0,1,0,0,0,1|1,0,0]=3 2739 B22R2.3984294 CC(C)CCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100011214892 [0,1,0,0,0,1|1,0,0]=3 2740 B22R2.3984294 CC(C)OCCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000211751 [0,1,0,0,0,1|2,0,0]=4 2741 B22R2.3984294 CC(C)OCCNC(c1ccccc1)c2cccc(c2)Br 270004a_100000701111_100011267660 [0,1,0,0,0,1|2,0,0]=4 2742 B22R2.3984294 CC(C)OCCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000211751 [0,1,0,0,0,1|2,0,0]=4 2743 B22R2.3984294 CC(C)OCCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000211751 [0,1,0,0,0,1|2,0,0]=4 2744 B22R2.3984294 CC(C)OCCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000701111_100011215489 [0,1,0,0,0,1|2,0,0]=4 2745 B22R2.3984294 CC(C)OCCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000211751 [0,1,0,0,0,1|2,0,0]=4 2746 B22R2.3984294 CC(C)OCCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000211751 [0,1,0,0,0,1|2,0,0]=4 2747 B22R2.3984294 CC(C)OCCNC(c1ccccc1)c2cccc(c2)F 270004a_100000701111_200011219850 [0,1,0,0,0,1|2,0,0]=4 2748 B22R2.3984294 CC(C)OCCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000211751 [0,1,0,0,0,1|2,0,0]=4 2749 B22R2.3984294 CC(C)OCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000211751 [0,1,0,0,0,1|1,0,0]=3 2750 B22R2.3984294 CC(C)OCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000211751 [0,1,0,0,0,1|1,0,0]=3 2751 B22R2.3984294 CC(C)OCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000211751 [0,1,0,0,0,1|1,0,0]=3 2752 B22R2.3984294 CC(C)OCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000211751 [0,1,0,0,0,1|1,0,0]=3 2753 B22R2.3984294 CC(C)SCCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000730970 [0,1,0,0,0,1|2,0,0]=4 2754 B22R2.3984294 CC(C)SCCNC(c1ccccc1)c2cccc(c2)Br 270004a_100000731138_100011267660 [0,1,0,0,0,1|2,0,0]=4 2755 B22R2.3984294 CC(C)SCCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000730970 [0,1,0,0,0,1|2,0,0]=4 2756 B22R2.3984294 CC(C)SCCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000730970 [0,1,0,0,0,1|2,0,0]=4 2757 B22R2.3984294 CC(C)SCCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000731138_100011215489 [0,1,0,0,0,1|2,0,0]=4 2758 B22R2.3984294 CC(C)SCCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000730970 [0,1,0,0,0,1|2,0,0]=4 2759 B22R2.3984294 CC(C)SCCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000730970 [0,1,0,0,0,1|2,0,0]=4 2760 B22R2.3984294 CC(C)SCCNC(c1ccccc1)c2cccc(c2)F 270004a_100000731138_200011219850 [0,1,0,0,0,1|2,0,0]=4 2761 B22R2.3984294 CC(C)SCCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000730970 [0,1,0,0,0,1|2,0,0]=4 2762 B22R2.3984294 CC(C)SCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000730970 [0,1,0,0,0,1|1,0,0]=3 2763 B22R2.3984294 CC(C)SCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000730970 [0,1,0,0,0,1|1,0,0]=3 2764 B22R2.3984294 CC(C)SCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000730970 [0,1,0,0,0,1|1,0,0]=3 2765 B22R2.3984294 CC(C)SCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000730970 [0,1,0,0,0,1|1,0,0]=3 2766 B22R2.3984294 CC(O)CCCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_200000718107 [0,1,0,0,0,1|2,0,0]=4 2767 B22R2.3984294 CC(O)CCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_200000718107 [0,1,0,0,0,1|2,0,0]=4 2768 B22R2.3984294 CC(O)CCCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_200000718107 [0,1,0,0,0,1|2,0,0]=4 2769 B22R2.3984294 CC(O)CCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_200000718107 [0,1,0,0,0,1|2,0,0]=4 2770 B22R2.3984294 CN(C)CCCNC(c1cccc(c1)Cl)c2ccccn2 270004a_102531767803_100000688346 [0,1,0,0,0,1|2,0,0]=4 2771 B22R2.3984294 CN(C)CCCNC(c1ccccc1)c2cccc(c2)Br 270004a_102531767803_100011267660 [0,1,0,0,0,1|1,0,0]=3 2772 B22R2.3984294 CN(C)CCCNC(c1ccccc1)c2cccc(c2)Cl 270004a_102531767803_100011215489 [0,1,0,0,0,1|1,0,0]=3 2773 B22R2.3984294 CN(C)CCCNC(c1ccccc1)c2cccc(c2)F 270004a_102531767803_200011219850 [0,1,0,0,0,1|1,0,0]=3 2774 B22R2.3984294 CN(C)CCCNC(c1ccccc1)c2cncc(c2)Br 270004a_102531767803_100011267668 [0,1,0,0,0,1|2,0,0]=4 2775 B22R2.3984294 CN(C)CCCNC(c1cccnc1)c2cccc(c2)Cl 270004a_102531767803_100000752423 [0,1,0,0,0,1|2,0,0]=4 2776 B22R2.3984294 CN(C)CCCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000757444 [0,1,0,0,0,1|0,0,0]=2 2777 B22R2.3984294 CN(C)CCCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000757444 [0,1,0,0,0,1|0,0,0]=2 2778 B22R2.3984294 Cc1cccc(c1)C(NCCCC(C)C)c2ccccc2 270004a_200000737386_100011217825 [0,1,0,0,0,1|2,0,0]=4 2779 B22R2.3984294 Cc1cccc(c1)C(NCCCN(C)C)c2ccccc2 270004a_102531767803_100011217825 [0,1,0,0,0,1|1,0,0]=3 2780 B22R2.3984294 Cc1cccc(c1)C(NCCOC(C)C)c2ccccc2 270004a_100000701111_100011217825 [0,1,0,0,0,1|2,0,0]=4 2781 B22R2.3984294 Cc1cccc(c1)C(NCCSC(C)C)c2ccccc2 270004a_100000731138_100011217825 [0,1,0,0,0,1|2,0,0]=4 2782 B22R2.15117 CC(C)CC(C)NC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000731052 [0,1,0,0,0,1|2,0,0]=4 2783 B22R2.15117 CC(C)CC(C)OC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000731052 [0,1,0,0,0,1|1,0,0]=3 2784 B22R2.15117 CC(C)CC(C)OC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000731052 [0,1,0,0,0,1|1,0,0]=3 2785 B22R2.15117 CC(CN(C)C)CN(Cc1ccccc1)c2ccccc2 2230a_100000188819_100015348159 [0,1,0,0,0,1|2,0,0]=4 2786 B22R2.15117 CC(CN(C)C)CN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100015348159 [0,1,0,0,0,1|2,0,0]=4 2787 B22R2.15117 CN(C)CC(=O)NC(Cc1ccccc1)c2ccccc2 11a_100025772854_100000750896 [0,1,0,0,0,1|1,0,1]=4 2788 B22R2.15117 CN(C)CC(=O)NC(Cc1ccccc1)c2ccccc2 2230a_100102631434_100000697283 [0,1,0,0,0,1|1,0,1]=4 2789 B22R2.15117 CN(C)CC(=O)NC(Cc1ccccc1)c2ccccc2 240690a_100025772854_100000750896 [0,1,0,0,0,1|1,0,1]=4 2790 B22R2.15117 CN(C)CC(=O)NC(Cc1ccccc1)c2ccccc2 269982a_100102631434_100000697283 [0,1,0,0,0,1|1,0,1]=4 2791 B22R2.15117 CN(C)CC(=O)NC(Cc1ccccc1)c2ccccc2 527a_100025772854_100000750896 [0,1,0,0,0,1|1,0,1]=4 2792 B22R2.24733 CCN(C)CCCN(Cc1ccccc1)c2ccccc2 2230a_100000188819_100015186262 [0,1,0,0,0,1|2,0,0]=4 2793 B22R2.24733 CCN(C)CCCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100015186262 [0,1,0,0,0,1|2,0,0]=4 2794 B22R2.24733 CNC(=O)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100012179268 [0,1,0,0,0,1|2,0,0]=4 2795 B22R2.24733 CNC(=O)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000737683 [0,1,0,0,0,1|2,0,0]=4 2796 B22R2.24733 COC(=O)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000742370 [0,1,0,0,0,1|2,0,0]=4 2797 B22R2.24733 COC(=O)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000204255 [0,1,0,0,0,1|2,0,0]=4 2798 B22R2.41525 CC(C)C(=O)COC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000753385 [0,1,0,0,0,1|1,0,1]=4 2799 B22R2.41525 CC(C)C(=O)COC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000753385 [0,1,0,0,0,1|1,0,1]=4 2800 B22R2.41525 CN(C)C(=O)CNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000185267 [0,1,0,0,0,1|1,0,1]=4 2801 B22R2.41525 CN(C)C(=O)COC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000692301 [0,1,0,0,0,1|0,0,1]=3 2802 B22R2.41525 CN(C)C(=O)COC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000692301 [0,1,0,0,0,1|0,0,1]=3 2803 B22R2.49736 CC(C)(C)CCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000755188 [0,1,0,0,0,1|2,0,0]=4 2804 B22R2.49736 CC(C)(C)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000755188 [0,1,0,0,0,1|1,0,0]=3 2805 B22R2.49736 CC(C)(C)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000755188 [0,1,0,0,0,1|1,0,0]=3 2806 B22R2.49736 CC(C)(O)CCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000702414 [0,1,0,0,0,1|2,0,0]=4 2807 B22R2.49736 CC(C)(O)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000702414 [0,1,0,0,0,1|1,0,0]=3 2808 B22R2.49736 CC(C)(O)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000702414 [0,1,0,0,0,1|1,0,0]=3 2809 B22R2.49736 CS(=O)(=O)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000731031 [0,1,0,0,0,1|2,0,0]=4 2810 B22R2.49736 CS(=O)(=O)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000230027 [0,1,0,0,0,1|2,0,0]=4 2811 B22R2.49736 C[N+](C)(C)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000085578 [0,1,0,0,0,1|0,0,1]=3 2812 B22R2.49736 C[N+](C)(C)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000085578 [0,1,0,0,0,1|0,0,1]=3 2813 B22R2.49736 C[Si](C)(C)CCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_200000733723 [0,1,0,0,0,1|2,0,0]=4 2814 B22R2.49736 C[Si](C)(C)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_200000733723 [0,1,0,0,0,1|1,0,0]=3 2815 B22R2.49736 C[Si](C)(C)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_200000733723 [0,1,0,0,0,1|1,0,0]=3 2816 B22R2.129964 Cc1ccc(cc1)CC(NCCC(C)C)c2ccccc2 2230a_217856618520_100000210312 [0,1,0,0,0,1|2,0,0]=4 2817 B22R2.129964 Cc1ccc(cc1)CC(NCCC(C)C)c2ccccc2 269862a_217856618520_100000185833 [0,1,0,0,0,1|2,0,0]=4 2818 B22R2.129964 Cc1ccc(cc1)CC(NCCC(C)C)c2ccccc2 34a_217856618520_100000210312 [0,1,0,0,0,1|2,0,0]=4 2819 B22R2.140051 C=C(C)CCOC(Cc1ccccc1)c2cccc(c2)Cl 34a_200000373148_100000730704 [0,1,0,0,0,1|1,0,1]=4 2820 B22R2.140051 C=C(C)CCOC(Cc1ccccc1)c2cccc(c2)Cl 7a_200000373148_100000730704 [0,1,0,0,0,1|1,0,1]=4 2821 B22R2.140051 CC(=CCOC(Cc1ccccc1)c2cccc(c2)Cl)C 34a_200000373148_100000761012 [0,1,0,0,0,1|1,0,1]=4 2822 B22R2.140051 CC(=CCOC(Cc1ccccc1)c2cccc(c2)Cl)C 7a_200000373148_100000761012 [0,1,0,0,0,1|1,0,1]=4 2823 B22R2.140051 CC(=O)CCOC(Cc1ccccc1)c2cccc(c2)Cl 7a_200000373148_100000053229 [0,1,0,0,0,1|2,0,0]=4 2824 B22R2.140051 CC(C)CCOC(Cc1ccccc1)c2cccc(c2)Cl 34a_200000373148_100000210312 [0,1,0,0,0,1|1,0,0]=3 2825 B22R2.140051 CC(C)CCOC(Cc1ccccc1)c2cccc(c2)Cl 7a_200000373148_100000210626 [0,1,0,0,0,1|1,0,0]=3 2826 B22R2.140051 CC(C)OCOC(Cc1ccccc1)c2cccc(c2)Cl 34a_200000373148_100000709892 [0,1,0,0,0,1|2,0,0]=4 2827 B22R2.140051 CC(O)CCOC(Cc1ccccc1)c2cccc(c2)Cl 34a_200000373148_100012276601 [0,1,0,0,0,1|2,0,0]=4 2828 B22R2.140051 CC(O)CCOC(Cc1ccccc1)c2cccc(c2)Cl 7a_200000373148_100012276601 [0,1,0,0,0,1|2,0,0]=4 2829 B22R2.140051 CN(C)CCCN(Cc1ccccc1)c2cccc(c2)Br 269982a_100000224063_100000757444 [0,1,0,0,0,1|2,0,0]=4 2830 B22R2.140051 CN(C)CCCN(Cc1ccccc1)c2cccc(c2)Cl 269982a_100102953027_100000757444 [0,1,0,0,0,1|2,0,0]=4 2831 B22R2.140051 CN(C)CCCN(Cc1ccccc1)c2cccc(c2)F 269982a_100102952868_100000757444 [0,1,0,0,0,1|2,0,0]=4 2832 B22R2.140051 CN(C)CCOC(Cc1ccccc1)c2cccc(c2)Cl 7a_200000373148_100000755713 [0,1,0,0,0,1|0,0,0]=2 2833 B22R2.140051 Cc1cccc(c1)N(CCCN(C)C)Cc2ccccc2 269982a_100000185206_100000757444 [0,1,0,0,0,1|2,0,0]=4 2834 B22R2.143640 CN(C)CCCN(Cc1ccccc1)c2ccccc2F 269982a_100025753533_100000757444 [0,1,0,0,0,1|2,0,0]=4 2835 B22R2.143640 Cc1ccccc1N(CCCN(C)C)Cc2ccccc2 269982a_100102946366_100000757444 [0,1,0,0,0,1|2,0,0]=4 2836 B22R2.150198 CC(C)CCC(=O)C(Cc1ccccc1)c2ccccc2 1458a_200000261918_100000210312 [0,1,0,0,0,1|2,0,0]=4 2837 B22R2.150198 CC(C)CCC(=O)C(Sc1ccccc1)c2ccccc2 1458a_100005462441_100000210312 [0,1,0,0,0,1|2,0,0]=4 2838 B22R2.150198 CN(C)CCC(=O)N(Cc1ccccc1)c2ccccc2 11a_100000188819_100000689311 [0,1,0,0,0,1|2,0,0]=4 2839 B22R2.150198 CN(C)CCC(=O)N(Cc1ccccc1)c2ccccc2 22a_100000188819_100000689311 [0,1,0,0,0,1|2,0,0]=4 2840 B22R2.201374 CN(C)CCCN(Cc1ccccc1F)c2ccccc2 269982a_100000224004_100000757444 [0,1,0,0,0,1|2,0,0]=4 2841 B22R2.359630 C=C(C)CCOC(C(=O)c1ccccc1)c2ccccc2 7a_100000185998_100000730704 [0,1,0,0,0,1|1,0,1]=4 2842 B22R2.359630 C=C(C)CCO[C@@H](c1ccccc1)[C@H](N)c2ccccc2 34a_100000765503_100000730704 [0,1,0,0,0,1|1,0,1]=4 2843 B22R2.359630 CC(=CCOC(C(=O)c1ccccc1)c2ccccc2)C 7a_100000185998_100000761012 [0,1,0,0,0,1|1,0,1]=4 2844 B22R2.359630 CC(=CCO[C@@H](c1ccccc1)[C@H](N)c2ccccc2)C 34a_100000765503_100000761012 [0,1,0,0,0,1|1,0,1]=4 2845 B22R2.359630 CC(=O)CCOC(C(=O)c1ccccc1)c2ccccc2 7a_100000185998_100000053229 [0,1,0,0,0,1|2,0,0]=4 2846 B22R2.359630 CC(=O)CCOC(C(=O)c1ccccc1)c2ccccc2 7a_100000759926_100000211254 [0,1,0,0,0,1|2,0,0]=4 2847 B22R2.359630 CC(C)CCN[C@H](c1ccccc1)[C@@H](O)c2ccccc2 2230a_100000765503_100000210312 [0,1,0,0,0,1|2,0,0]=4 2848 B22R2.359630 CC(C)CCN[C@H](c1ccccc1)[C@@H](O)c2ccccc2 269862a_100000765503_100000185833 [0,1,0,0,0,1|2,0,0]=4 2849 B22R2.359630 CC(C)CCOC(C(=O)c1ccccc1)c2ccccc2 7a_100000185998_100000210626 [0,1,0,0,0,1|1,0,0]=3 2850 B22R2.359630 CC(C)CCOC(C(=O)c1ccccc1)c2ccccc2 7a_100000210254_100000211254 [0,1,0,0,0,1|1,0,0]=3 2851 B22R2.359630 CC(C)CCO[C@@H](c1ccccc1)[C@H](N)c2ccccc2 34a_100000765503_100000210312 [0,1,0,0,0,1|1,0,0]=3 2852 B22R2.359630 CC(C)CCSC(C(=O)c1ccccc1)c2ccccc2 62a_100000210312_100000211254 [0,1,0,0,0,1|1,1,0]=4 2853 B22R2.359630 CC(C)CCSC(C(=O)c1ccccc1)c2ccccc2 62a_100000211254_100000210312 [0,1,0,0,0,1|1,1,0]=4 2854 B22R2.359630 CC(C)OCO[C@@H](c1ccccc1)[C@H](N)c2ccccc2 34a_100000765503_100000709892 [0,1,0,0,0,1|2,0,0]=4 2855 B22R2.359630 CC(O)CCOC(C(=O)c1ccccc1)c2ccccc2 7a_100000185998_100012276601 [0,1,0,0,0,1|2,0,0]=4 2856 B22R2.359630 CC(O)CCO[C@@H](c1ccccc1)[C@H](N)c2ccccc2 34a_100000765503_100012276601 [0,1,0,0,0,1|2,0,0]=4 2857 B22R2.359630 CN(C)CCOC(C(=O)c1ccccc1)c2ccccc2 7a_100000185998_100000755713 [0,1,0,0,0,1|0,0,0]=2 2858 B22R2.359630 CN(C)CCSC(C(=O)c1ccccc1)c2ccccc2 62a_100000211254_100000755713 [0,1,0,0,0,1|0,1,0]=3 2859 B22R2.518919 CC(C)CCNC(Cc1ccccc1)c2ccc(cc2)F 2230a_103496528834_100000210312 [0,1,0,0,0,1|2,0,0]=4 2860 B22R2.518919 CC(C)CCNC(Cc1ccccc1)c2ccc(cc2)F 269862a_103496528834_100000185833 [0,1,0,0,0,1|2,0,0]=4 2861 B22R2.518919 CC(C)CCNC(Cc1ccccc1)c2ccc(cc2)F 34a_103496528834_100000210312 [0,1,0,0,0,1|2,0,0]=4 2862 B22R2.518919 CN(C)CCCN(Cc1ccccc1)c2ccc(cc2)Br 269982a_100000187040_100000757444 [0,1,0,0,0,1|2,0,0]=4 2863 B22R2.518919 CN(C)CCCN(Cc1ccccc1)c2ccc(cc2)Cl 269982a_100000187391_100000757444 [0,1,0,0,0,1|2,0,0]=4 2864 B22R2.518919 CN(C)CCCN(Cc1ccccc1)c2ccc(cc2)O 269982a_200000188756_100000757444 [0,1,0,0,0,1|2,0,0]=4 2865 B22R2.518919 Cc1ccc(cc1)N(CCCN(C)C)Cc2ccccc2 269982a_100000185259_100000757444 [0,1,0,0,0,1|2,0,0]=4 2866 B22R2.10906 CCS(=O)(=O)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000756660 [0,2,0,0,0,0|2,0,0]=4 2867 B22R2.10906 CCS(=O)(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000756660 [0,2,0,0,0,0|2,0,0]=4 2868 B22R2.10906 CCS(=O)(=O)CCOC(c1ccccc1)c2ccccc2 7a_200011216379_100011216954 [0,2,0,0,0,0|2,0,0]=4 2869 B22R2.10906 COC(C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000699976_100011216954 [0,2,0,0,0,0|1,0,0]=3 2870 B22R2.15060 CCN(CC)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000700428 [0,2,0,0,0,0|1,0,0]=3 2871 B22R2.15060 CCN(CC)CCNC(c1ccccc1)c2ccccc2 2230a_100015382049_100000211591 [0,2,0,0,0,0|1,0,0]=3 2872 B22R2.15060 CCN(CC)CCNC(c1ccccc1)c2ccccc2 270004a_100015382049_100000210122 [0,2,0,0,0,0|1,0,0]=3 2873 B22R2.15060 CCN(CC)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000700428 [0,2,0,0,0,0|2,0,0]=4 2874 B22R2.15060 CCN(CC)CCNC(c1ccccc1)c2ccccn2 270004a_100015382049_100000210380 [0,2,0,0,0,0|2,0,0]=4 2875 B22R2.15060 CCN(CC)CCNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000700428 [0,2,0,0,0,0|2,0,0]=4 2876 B22R2.15060 CCN(CC)CCNC(c1ccccc1)c2cccnc2 270004a_100015382049_100000735413 [0,2,0,0,0,0|2,0,0]=4 2877 B22R2.15060 CCN(CC)CCNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000700428 [0,2,0,0,0,0|2,0,0]=4 2878 B22R2.15060 CCN(CC)CCOC(c1ccccc1)c2ccccc2 2230a_100000724800_100000734929 [0,2,0,0,0,0|0,0,0]=2 2879 B22R2.15060 CCN(CC)CCOC(c1ccccc1)c2ccccc2 269956a_100000042499_100000734929 [0,2,0,0,0,0|0,0,0]=2 2880 B22R2.15060 CCN(CC)CCOC(c1ccccc1)c2ccccc2 269982a_100000724800_100000734929 [0,2,0,0,0,0|0,0,0]=2 2881 B22R2.15060 CCN(CC)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000700428 [0,2,0,0,0,0|0,0,0]=2 2882 B22R2.15060 CCN(CC)CCOC(c1ccccc1)c2ccccc2 7a_100016990331_100011216954 [0,2,0,0,0,0|0,0,0]=2 2883 B22R2.15060 CCN(CC)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000700428 [0,2,0,0,0,0|1,0,0]=3 2884 B22R2.15060 CCN(CC)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000700428 [0,2,0,0,0,0|0,1,0]=3 2885 B22R2.15060 COC(CCNC(c1ccccc1)c2ccccc2)OC 2230a_100000162943_100009813347 [0,2,0,0,0,0|2,0,0]=4 2886 B22R2.15060 COC(CCNC(c1ccccc1)c2ccccc2)OC 34a_100000162943_100000139399 [0,2,0,0,0,0|2,0,0]=4 2887 B22R2.15060 COC(CCOC(c1ccccc1)c2ccccc2)OC 34a_100000211180_100000139399 [0,2,0,0,0,0|1,0,0]=3 2888 B22R2.15060 COC(CCOC(c1ccccc1)c2ccccc2)OC 7a_100000211180_100009813347 [0,2,0,0,0,0|1,0,0]=3 2889 B22R2.15060 COC(CCOC(c1ccccc1)c2ccccn2)OC 7a_100000180852_100009813347 [0,2,0,0,0,0|2,0,0]=4 2890 B22R2.15060 COC(CCSC(c1ccccc1)c2ccccc2)OC 62a_100000139399_100011216954 [0,2,0,0,0,0|1,1,0]=4 2891 B22R2.15060 COC(CCSC(c1ccccc1)c2ccccc2)OC 62a_100000211591_100000139399 [0,2,0,0,0,0|1,1,0]=4 2892 B22R2.20358 CCC(C)CC(C)NC(c1ccccc1)c2ccccc2 2230a_100000763565_100000211591 [0,2,0,0,0,0|2,0,0]=4 2893 B22R2.20358 CCC(C)CC(C)NC(c1ccccc1)c2ccccc2 270004a_100000162943_100011710205 [0,2,0,0,0,0|2,0,0]=4 2894 B22R2.20358 CCC(C)CC(C)NC(c1ccccc1)c2ccccc2 270004a_100000763565_100000210122 [0,2,0,0,0,0|2,0,0]=4 2895 B22R2.20358 CCN(C)CC(=O)NC(c1ccccc1)c2ccccc2 240690a_100000162943_100116209913 [0,2,0,0,0,0|1,0,1]=4 2896 B22R2.20358 CCN(C)CC(=O)NC(c1ccccc1)c2ccccc2 527a_100000162943_100116209913 [0,2,0,0,0,0|1,0,1]=4 2897 B22R2.20358 COC(=O)CC(C)OC(c1ccccc1)c2ccccc2 34a_100000211180_100009817358 [0,2,0,0,0,0|2,0,0]=4 2898 B22R2.20358 COC(=O)CC(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_100009817358 [0,2,0,0,0,0|2,0,0]=4 2899 B22R2.21581 C#CCC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100011220946_100000734929 [0,2,0,0,0,0|2,0,0]=4 2900 B22R2.21581 C#CCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_100000225692_100000734929 [0,2,0,0,0,0|0,0,0]=2 2901 B22R2.21581 C#CCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100000038162 [0,2,0,0,0,0|0,0,0]=2 2902 B22R2.21581 C#CCN(C)CCOC(c1ccccc1)c2ccccc2 34a_100000225692_100000734929 [0,2,0,0,0,0|0,0,0]=2 2903 B22R2.21581 C=CCC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000210193_100000734929 [0,2,0,0,0,0|2,0,0]=4 2904 B22R2.21581 C=CCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_100000225617_100000734929 [0,2,0,0,0,0|0,0,0]=2 2905 B22R2.21581 C=CCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100000210623 [0,2,0,0,0,0|0,0,0]=2 2906 B22R2.21581 C=CCN(C)CCOC(c1ccccc1)c2ccccc2 269982a_100000225617_100000734929 [0,2,0,0,0,0|0,0,0]=2 2907 B22R2.21581 C=CCN(C)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100000210623 [0,2,0,0,0,0|0,0,0]=2 2908 B22R2.21581 CC#CC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000763181_100000734929 [0,2,0,0,0,0|2,0,0]=4 2909 B22R2.21581 CC=CC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000210699_100000734929 [0,2,0,0,0,0|2,0,0]=4 2910 B22R2.21581 CCCC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000211992_100000734929 [0,2,0,0,0,0|2,0,0]=4 2911 B22R2.21581 CCCC(C)CCOC(c1ccccc1)c2ccccc2 7a_100011217855_100011216954 [0,2,0,0,0,0|1,0,0]=3 2912 B22R2.21581 CCCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_100000747261_100000734929 [0,2,0,0,0,0|0,0,0]=2 2913 B22R2.21581 CCCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100000210303 [0,2,0,0,0,0|0,0,0]=2 2914 B22R2.21581 CCCN(C)CCOC(c1ccccc1)c2ccccc2 269982a_100000747261_100000734929 [0,2,0,0,0,0|0,0,0]=2 2915 B22R2.21581 CCCN(C)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100000210303 [0,2,0,0,0,0|0,0,0]=2 2916 B22R2.21581 CCNC(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000737597 [0,2,0,0,0,0|2,0,0]=4 2917 B22R2.21581 CCOC(=O)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000765890 [0,2,0,0,0,0|2,0,0]=4 2918 B22R2.21581 CCOC(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011206558 [0,2,0,0,0,0|2,0,0]=4 2919 B22R2.21581 CN(CC#N)CCOC(c1ccccc1)c2ccccc2 2230a_100000748184_100000734929 [0,2,0,0,0,0|0,0,0]=2 2920 B22R2.21581 CN(CC#N)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100011215382 [0,2,0,0,0,0|0,0,0]=2 2921 B22R2.21581 CN(CC#N)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100011214920 [0,2,0,0,0,0|0,0,0]=2 2922 B22R2.21581 CN(CC=O)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_200015260668 [0,2,0,0,0,0|0,0,0]=2 2923 B22R2.21581 CN(CC=O)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_200015260668 [0,2,0,0,0,0|0,0,0]=2 2924 B22R2.21581 CN(CCF)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100011217306 [0,2,0,0,0,0|0,0,0]=2 2925 B22R2.21581 CN(CCF)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100011217306 [0,2,0,0,0,0|0,0,0]=2 2926 B22R2.21581 CN(CCO)CCOC(c1ccccc1)c2ccccc2 2230a_100000210263_100000734929 [0,2,0,0,0,0|0,0,0]=2 2927 B22R2.21581 CN(CCO)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100000211926 [0,2,0,0,0,0|0,0,0]=2 2928 B22R2.21581 CN(CCO)CCOC(c1ccccc1)c2ccccc2 269982a_100000210263_100000734929 [0,2,0,0,0,0|0,0,0]=2 2929 B22R2.21581 CN(CCO)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100000211926 [0,2,0,0,0,0|0,0,0]=2 2930 B22R2.21581 COCC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000210968_100000734929 [0,2,0,0,0,0|2,0,0]=4 2931 B22R2.21581 COCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100000766300 [0,2,0,0,0,0|0,0,0]=2 2932 B22R2.21581 COCN(C)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100000766300 [0,2,0,0,0,0|0,0,0]=2 2933 B22R2.21581 CSCC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000184570_100000734929 [0,2,0,0,0,0|2,0,0]=4 2934 B22R2.21581 CSCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100011218213 [0,2,0,0,0,0|0,0,0]=2 2935 B22R2.21581 CSCN(C)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100011218213 [0,2,0,0,0,0|0,0,0]=2 2936 B22R2.21581 N#CCC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100051588842_100000734929 [0,2,0,0,0,0|2,0,0]=4 2937 B22R2.21581 O=C(CCO)CCOC(c1ccccc1)c2ccccc2 1458a_100011216618_100000734929 [0,2,0,0,0,0|2,0,0]=4 2938 B22R2.25518 CC(CO)CCNC(c1ccccc1)c2cccc(c2)Br 270004a_106354213184_100011267660 [0,2,0,0,0,0|2,0,0]=4 2939 B22R2.25518 CC(CO)CCNC(c1ccccc1)c2cccc(c2)Cl 270004a_106354213184_100011215489 [0,2,0,0,0,0|2,0,0]=4 2940 B22R2.25518 CC(CO)CCNC(c1ccccc1)c2cccc(c2)F 270004a_106354213184_200011219850 [0,2,0,0,0,0|2,0,0]=4 2941 B22R2.25518 CCC(C)CCNC(c1ccccc1)c2cccc(c2)Br 270004a_100020591266_100011267660 [0,2,0,0,0,0|2,0,0]=4 2942 B22R2.25518 CCC(C)CCNC(c1ccccc1)c2cccc(c2)C 270004a_100020591266_100011217825 [0,2,0,0,0,0|2,0,0]=4 2943 B22R2.25518 CCC(C)CCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100020591266_100011215489 [0,2,0,0,0,0|2,0,0]=4 2944 B22R2.25518 CCC(C)CCNC(c1ccccc1)c2cccc(c2)F 270004a_100020591266_200011219850 [0,2,0,0,0,0|2,0,0]=4 2945 B22R2.25518 CNC(=O)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100012179268 [0,2,0,0,0,0|2,0,0]=4 2946 B22R2.25518 CNC(=O)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000737683 [0,2,0,0,0,0|2,0,0]=4 2947 B22R2.25518 CNC(=O)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100012179268 [0,2,0,0,0,0|2,0,0]=4 2948 B22R2.25518 CNC(=O)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000737683 [0,2,0,0,0,0|2,0,0]=4 2949 B22R2.25518 COC(=O)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000742370 [0,2,0,0,0,0|2,0,0]=4 2950 B22R2.25518 COC(=O)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000204255 [0,2,0,0,0,0|2,0,0]=4 2951 B22R2.25518 COC(=O)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000742370 [0,2,0,0,0,0|2,0,0]=4 2952 B22R2.25518 COC(=O)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000204255 [0,2,0,0,0,0|2,0,0]=4 2953 B22R2.25518 Cc1cccc(c1)C(NCCC(C)CO)c2ccccc2 270004a_106354213184_100011217825 [0,2,0,0,0,0|2,0,0]=4 2954 B22R2.25521 CC(CO)CCNC(c1ccccc1)c2ccc(cc2)Br 270004a_106354213184_100000718703 [0,2,0,0,0,0|2,0,0]=4 2955 B22R2.25521 CC(CO)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_106354213184_100000211669 [0,2,0,0,0,0|2,0,0]=4 2956 B22R2.25521 CC(CO)CCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_106354213184_100000211064 [0,2,0,0,0,0|2,0,0]=4 2957 B22R2.25521 CC(CO)CCNC(c1ccccc1)c2ccc(cc2)F 270004a_106354213184_100000210425 [0,2,0,0,0,0|2,0,0]=4 2958 B22R2.25521 CCC(C)CCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100020591266_100000718703 [0,2,0,0,0,0|2,0,0]=4 2959 B22R2.25521 CCC(C)CCNC(c1ccccc1)c2ccc(cc2)C 270004a_100020591266_100000210966 [0,2,0,0,0,0|2,0,0]=4 2960 B22R2.25521 CCC(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100020591266_100000211669 [0,2,0,0,0,0|2,0,0]=4 2961 B22R2.25521 CCC(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100020591266_100000211064 [0,2,0,0,0,0|2,0,0]=4 2962 B22R2.25521 CCC(C)CCNC(c1ccccc1)c2ccc(cc2)F 270004a_100020591266_100000210425 [0,2,0,0,0,0|2,0,0]=4 2963 B22R2.25521 CCC(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100011215188_200010188304 [0,2,0,0,0,0|2,0,0]=4 2964 B22R2.25521 CCC(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100011215188_100000211669 [0,2,0,0,0,0|1,0,0]=3 2965 B22R2.25521 CNC(=O)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100012179268 [0,2,0,0,0,0|2,0,0]=4 2966 B22R2.25521 CNC(=O)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000737683 [0,2,0,0,0,0|2,0,0]=4 2967 B22R2.25521 CNC(=O)CCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100012179268 [0,2,0,0,0,0|2,0,0]=4 2968 B22R2.25521 CNC(=O)CCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000737683 [0,2,0,0,0,0|2,0,0]=4 2969 B22R2.25521 CNC(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100012179268 [0,2,0,0,0,0|2,0,0]=4 2970 B22R2.25521 CNC(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000737683 [0,2,0,0,0,0|2,0,0]=4 2971 B22R2.25521 CNC(=O)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100012179268 [0,2,0,0,0,0|2,0,0]=4 2972 B22R2.25521 CNC(=O)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000737683 [0,2,0,0,0,0|2,0,0]=4 2973 B22R2.25521 CNC(=O)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100012179268 [0,2,0,0,0,0|2,0,0]=4 2974 B22R2.25521 CNC(=O)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000737683 [0,2,0,0,0,0|2,0,0]=4 2975 B22R2.25521 COC(=O)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000742370 [0,2,0,0,0,0|2,0,0]=4 2976 B22R2.25521 COC(=O)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000204255 [0,2,0,0,0,0|2,0,0]=4 2977 B22R2.25521 COC(=O)CCOC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_100000742370 [0,2,0,0,0,0|2,0,0]=4 2978 B22R2.25521 COC(=O)CCOC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_100000204255 [0,2,0,0,0,0|2,0,0]=4 2979 B22R2.25521 COC(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000742370 [0,2,0,0,0,0|2,0,0]=4 2980 B22R2.25521 COC(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000204255 [0,2,0,0,0,0|2,0,0]=4 2981 B22R2.25521 COC(=O)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000742370 [0,2,0,0,0,0|2,0,0]=4 2982 B22R2.25521 COC(=O)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000204255 [0,2,0,0,0,0|2,0,0]=4 2983 B22R2.25521 COC(=O)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000742370 [0,2,0,0,0,0|2,0,0]=4 2984 B22R2.25521 COC(=O)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000204255 [0,2,0,0,0,0|2,0,0]=4 2985 B22R2.25521 COC(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000764861_200010188304 [0,2,0,0,0,0|2,0,0]=4 2986 B22R2.25521 COC(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000764861_100000211669 [0,2,0,0,0,0|1,0,0]=3 2987 B22R2.25521 Cc1ccc(cc1)C(NCCC(C)CO)c2ccccc2 270004a_106354213184_100000210966 [0,2,0,0,0,0|2,0,0]=4 2988 B22R2.131333 CCN(C)C(=O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000738999 [0,2,0,0,0,0|1,0,1]=4 2989 B22R2.131333 CCN(C)C(=O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000738999 [0,2,0,0,0,0|1,0,1]=4 2990 B22R2.131333 CCN(C)C(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000738999 [0,2,0,0,0,0|0,0,1]=3 2991 B22R2.131333 CCN(C)C(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000738999 [0,2,0,0,0,0|0,0,1]=3 2992 B22R2.131333 CCN(C)C(=O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000738999 [0,2,0,0,0,0|1,0,1]=4 2993 B22R2.131333 CCN(C)C(=O)CSC(c1ccccc1)c2ccccc2 11a_100000225621_100000683935 [0,2,0,0,0,0|0,1,1]=4 2994 B22R2.131333 CCN(C)C(=O)CSC(c1ccccc1)c2ccccc2 1626a_100000225621_100000683935 [0,2,0,0,0,0|0,1,1]=4 2995 B22R2.131333 CCN(C)C(=O)CSC(c1ccccc1)c2ccccc2 240690a_100000225621_100000683935 [0,2,0,0,0,0|0,1,1]=4 2996 B22R2.131333 CCN(C)C(=O)CSC(c1ccccc1)c2ccccc2 527a_100000225621_100000683935 [0,2,0,0,0,0|0,1,1]=4 2997 B22R2.131333 CCN(C)C(=O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000738999 [0,2,0,0,0,0|0,1,1]=4 2998 B22R2.131333 CCN(C)C(=O)CSC(c1ccccc1)c2ccccc2 62a_100000738999_100011216954 [0,2,0,0,0,0|0,1,1]=4 2999 B22R2.131333 CCN(C)C(C)COC(c1ccccc1)c2ccccc2 7a_100000732741_100011216954 [0,2,0,0,0,0|0,0,0]=2 3000 B22R2.131333 COC(=O)C(C)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000698445 [0,2,0,0,0,0|2,0,0]=4 3001 B22R2.131333 COC(=O)C(C)COC(c1ccccc1)c2ccccc2 7a_100000749362_100011216954 [0,2,0,0,0,0|2,0,0]=4 3002 B22R2.131333 CON(C)C(=O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000764215 [0,2,0,0,0,0|1,0,1]=4 3003 B22R2.131333 CON(C)C(=O)CNC(c1ccccc1)c2ccccc2 2230a_100015207273_100000211591 [0,2,0,0,0,0|1,0,1]=4 3004 B22R2.131333 CON(C)C(=O)CNC(c1ccccc1)c2ccccc2 270004a_100015207273_100000210122 [0,2,0,0,0,0|1,0,1]=4 3005 B22R2.131333 CON(C)C(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000764215 [0,2,0,0,0,0|0,0,1]=3 3006 B22R2.131333 CON(C)C(=O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000764215 [0,2,0,0,0,0|1,0,1]=4 3007 B22R2.131333 CON(C)C(=O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000764215 [0,2,0,0,0,0|0,1,1]=4 3008 B22R2.131333 CON(C)C(=O)CSC(c1ccccc1)c2ccccc2 62a_100000764215_100011216954 [0,2,0,0,0,0|0,1,1]=4 3009 B22R2.557975 CC(CO)CCNC(c1ccccc1)c2ccccc2Br 270004a_106354213184_100000198044 [0,2,0,0,0,0|2,0,0]=4 3010 B22R2.557975 CC(CO)CCNC(c1ccccc1)c2ccccc2Cl 270004a_106354213184_100011215288 [0,2,0,0,0,0|2,0,0]=4 3011 B22R2.557975 CC(CO)CCNC(c1ccccc1)c2ccccc2F 270004a_106354213184_100011217773 [0,2,0,0,0,0|2,0,0]=4 3012 B22R2.557975 CCC(C)CCNC(c1ccccc1)c2ccccc2Br 270004a_100020591266_100000198044 [0,2,0,0,0,0|2,0,0]=4 3013 B22R2.557975 CCC(C)CCNC(c1ccccc1)c2ccccc2C 2230a_100020591266_100000230135 [0,2,0,0,0,0|2,0,0]=4 3014 B22R2.557975 CCC(C)CCNC(c1ccccc1)c2ccccc2C 270004a_100020591266_100000735561 [0,2,0,0,0,0|2,0,0]=4 3015 B22R2.557975 CCC(C)CCNC(c1ccccc1)c2ccccc2Cl 270004a_100020591266_100011215288 [0,2,0,0,0,0|2,0,0]=4 3016 B22R2.557975 CCC(C)CCNC(c1ccccc1)c2ccccc2F 270004a_100020591266_100011217773 [0,2,0,0,0,0|2,0,0]=4 3017 B22R2.557975 CCC(C)CCOC(c1ccccc1)c2ccccc2C 7a_100011215188_100000230135 [0,2,0,0,0,0|1,0,0]=3 3018 B22R2.557975 CNC(=O)CCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100012179268 [0,2,0,0,0,0|2,0,0]=4 3019 B22R2.557975 CNC(=O)CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000737683 [0,2,0,0,0,0|2,0,0]=4 3020 B22R2.557975 CNC(=O)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100012179268 [0,2,0,0,0,0|2,0,0]=4 3021 B22R2.557975 CNC(=O)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000737683 [0,2,0,0,0,0|2,0,0]=4 3022 B22R2.557975 CNC(=O)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100012179268 [0,2,0,0,0,0|2,0,0]=4 3023 B22R2.557975 CNC(=O)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000737683 [0,2,0,0,0,0|2,0,0]=4 3024 B22R2.557975 COC(=O)CCOC(c1ccccc1)c2ccccc2C 34a_100000212071_100000742370 [0,2,0,0,0,0|2,0,0]=4 3025 B22R2.557975 COC(=O)CCOC(c1ccccc1)c2ccccc2C 7a_100000212071_100000204255 [0,2,0,0,0,0|2,0,0]=4 3026 B22R2.557975 COC(=O)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000742370 [0,2,0,0,0,0|2,0,0]=4 3027 B22R2.557975 COC(=O)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000204255 [0,2,0,0,0,0|2,0,0]=4 3028 B22R2.557975 COC(=O)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000742370 [0,2,0,0,0,0|2,0,0]=4 3029 B22R2.557975 COC(=O)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000204255 [0,2,0,0,0,0|2,0,0]=4 3030 B22R2.557975 COC(C)CCOC(c1ccccc1)c2ccccc2C 7a_100000764861_100000230135 [0,2,0,0,0,0|1,0,0]=3 3031 B22R2.557975 Cc1ccccc1C(NCCC(C)CO)c2ccccc2 2230a_106354213184_100000230135 [0,2,0,0,0,0|2,0,0]=4 3032 B22R2.557975 Cc1ccccc1C(NCCC(C)CO)c2ccccc2 270004a_106354213184_100000735561 [0,2,0,0,0,0|2,0,0]=4 3033 B22R2.595935 CCC(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000701222_100011216954 [0,2,0,0,0,0|2,0,0]=4 3034 B22R2.595935 CCN(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000755305_100011216954 [0,2,0,0,0,0|1,0,0]=3 3035 B22R2.747804 CNC(=O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000737683 [0,2,0,0,0,0|2,0,0]=4 3036 B22R2.747804 COC(=O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000204255 [0,2,0,0,0,0|2,0,0]=4 3037 B22R2.53013 CC(C)C(CO)CNC(c1ccccc1)c2ccccc2 270004a_100000692819_100000210122 [0,2,0,0,0,0|2,0,0]=4 3038 B22R2.53013 CCC(CNC(c1ccccc1)c2ccccc2)C(C)C 269862a_100000162943_100011214906 [0,2,0,0,0,0|2,0,0]=4 3039 B22R2.53013 CCC(CNC(c1ccccc1)c2ccccc2)N(C)C 270004a_100000738386_100000210122 [0,2,0,0,0,0|1,0,0]=3 3040 B22R2.53013 CCC(CNC(c1ccccc1)c2ccccn2)N(C)C 270004a_100000738386_100000210380 [0,2,0,0,0,0|2,0,0]=4 3041 B22R2.53013 CCC(CNC(c1ccccc1)c2cccnc2)N(C)C 270004a_100000738386_100000735413 [0,2,0,0,0,0|2,0,0]=4 3042 B22R2.53013 CCC(COC(c1ccccc1)c2ccccc2)C(C)C 7a_100011995916_100011216954 [0,2,0,0,0,0|1,0,0]=3 3043 B22R2.121905 CC(C)(C)C(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000229897 [0,2,0,0,0,0|1,0,1]=4 3044 B22R2.121905 CC(C)(C)C(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000210923 [0,2,0,0,0,0|1,0,1]=4 3045 B22R2.121905 CC(C)(C)C(=O)COC(c1ccccc1)c2ccccc2 7a_200011592769_100011216954 [0,2,0,0,0,0|1,0,1]=4 3046 B22R2.121905 CC(C)(O)[C@H](F)CNC(c1ccccc1)c2ccccc2 270004a_100015379105_100000210122 [0,2,0,0,0,0|2,0,0]=4 3047 B22R2.129975 CC(=O)C(C)COC(c1ccccc1)c2ccc(cc2)Cl 7a_100000032740_100000211669 [0,2,0,0,0,0|2,0,0]=4 3048 B22R2.129975 CC(C)C(=O)COC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000753385 [0,2,0,0,0,0|1,0,1]=4 3049 B22R2.129975 CC(C)C(=O)COC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000753385 [0,2,0,0,0,0|1,0,1]=4 3050 B22R2.129975 CC(C)C(=O)COC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000753385 [0,2,0,0,0,0|1,0,1]=4 3051 B22R2.129975 CC(C)C(=O)COC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000753385 [0,2,0,0,0,0|1,0,1]=4 3052 B22R2.129975 CC(C)C(=O)COC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000753385 [0,2,0,0,0,0|1,0,1]=4 3053 B22R2.129975 CC(C)C(=O)COC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000753385 [0,2,0,0,0,0|1,0,1]=4 3054 B22R2.129975 CC(C)C(=O)COC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000753385 [0,2,0,0,0,0|1,0,1]=4 3055 B22R2.129975 CC(C)C(=O)COC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000753385 [0,2,0,0,0,0|1,0,1]=4 3056 B22R2.129975 CC(C)C(O)CNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000759067_100000718703 [0,2,0,0,0,0|2,0,0]=4 3057 B22R2.129975 CC(C)C(O)CNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000759067_100000211669 [0,2,0,0,0,0|2,0,0]=4 3058 B22R2.129975 CC(C)C(O)CNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000759067_100000211064 [0,2,0,0,0,0|2,0,0]=4 3059 B22R2.129975 CC(C)C(O)CNC(c1ccccc1)c2ccc(cc2)F 270004a_100000759067_100000210425 [0,2,0,0,0,0|2,0,0]=4 3060 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000185267 [0,2,0,0,0,0|1,0,1]=4 3061 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)Br 270004a_100015183351_100000718703 [0,2,0,0,0,0|1,0,1]=4 3062 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000692301 [0,2,0,0,0,0|1,0,1]=4 3063 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000185267 [0,2,0,0,0,0|1,0,1]=4 3064 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100015183351_100000211669 [0,2,0,0,0,0|1,0,1]=4 3065 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100015183351_100000211064 [0,2,0,0,0,0|1,0,1]=4 3066 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000692301 [0,2,0,0,0,0|1,0,1]=4 3067 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000185267 [0,2,0,0,0,0|1,0,1]=4 3068 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)F 270004a_100015183351_100000210425 [0,2,0,0,0,0|1,0,1]=4 3069 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000692301 [0,2,0,0,0,0|1,0,1]=4 3070 B22R2.129975 CN(C)C(=O)CNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000692301 [0,2,0,0,0,0|1,0,1]=4 3071 B22R2.129975 CN(C)C(=O)COC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000692301 [0,2,0,0,0,0|1,0,1]=4 3072 B22R2.129975 CN(C)C(=O)COC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000692301 [0,2,0,0,0,0|0,0,1]=3 3073 B22R2.129975 CN(C)C(=O)COC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000692301 [0,2,0,0,0,0|0,0,1]=3 3074 B22R2.129975 CN(C)C(=O)COC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000692301 [0,2,0,0,0,0|0,0,1]=3 3075 B22R2.129975 CN(C)C(=O)COC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000692301 [0,2,0,0,0,0|0,0,1]=3 3076 B22R2.129975 CN(C)C(=O)COC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000692301 [0,2,0,0,0,0|0,0,1]=3 3077 B22R2.129975 CN(C)C(=O)COC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000692301 [0,2,0,0,0,0|0,0,1]=3 3078 B22R2.129975 CN(C)C(=O)COC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000692301 [0,2,0,0,0,0|0,0,1]=3 3079 B22R2.129975 CN(C)C(=O)COC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000692301 [0,2,0,0,0,0|0,0,1]=3 3080 B22R2.129975 CN(C)C(=O)COC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000692301 [0,2,0,0,0,0|1,0,1]=4 3081 B22R2.129975 CN(C)C(=O)CSC(c1ccccc1)c2ccc(cc2)Cl 11a_100102631434_100000684134 [0,2,0,0,0,0|0,1,1]=4 3082 B22R2.129975 CN(C)C(=O)CSC(c1ccccc1)c2ccc(cc2)Cl 1626a_100102631434_100000684134 [0,2,0,0,0,0|0,1,1]=4 3083 B22R2.129975 CN(C)C(=O)CSC(c1ccccc1)c2ccc(cc2)Cl 240690a_100102631434_100000684134 [0,2,0,0,0,0|0,1,1]=4 3084 B22R2.129975 CN(C)C(=O)CSC(c1ccccc1)c2ccc(cc2)Cl 527a_100102631434_100000684134 [0,2,0,0,0,0|0,1,1]=4 3085 B22R2.129975 CN(C)C(=O)CSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000692301 [0,2,0,0,0,0|0,1,1]=4 3086 B22R2.129975 CN(C)C(=O)CSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000692301_100000211669 [0,2,0,0,0,0|0,1,1]=4 3087 B22R2.129975 Cc1ccc(cc1)C(NCC(=O)N(C)C)c2ccccc2 2230a_100000736602_100000185267 [0,2,0,0,0,0|1,0,1]=4 3088 B22R2.129975 Cc1ccc(cc1)C(NCC(=O)N(C)C)c2ccccc2 270004a_100015183351_100000210966 [0,2,0,0,0,0|1,0,1]=4 3089 B22R2.129975 Cc1ccc(cc1)C(NCC(=O)N(C)C)c2ccccc2 34a_100000736602_100000692301 [0,2,0,0,0,0|1,0,1]=4 3090 B22R2.129975 Cc1ccc(cc1)C(NCC(O)C(C)C)c2ccccc2 270004a_100000759067_100000210966 [0,2,0,0,0,0|2,0,0]=4 3091 B22R2.129975 Cc1ccc(cc1)C(OCC(=O)C(C)C)c2ccccc2 34a_100000212064_100000753385 [0,2,0,0,0,0|1,0,1]=4 3092 B22R2.129975 Cc1ccc(cc1)C(OCC(=O)C(C)C)c2ccccc2 7a_100000212064_100000753385 [0,2,0,0,0,0|1,0,1]=4 3093 B22R2.129975 Cc1ccc(cc1)C(OCC(=O)N(C)C)c2ccccc2 34a_100000212064_100000692301 [0,2,0,0,0,0|0,0,1]=3 3094 B22R2.129975 Cc1ccc(cc1)C(OCC(=O)N(C)C)c2ccccc2 7a_100000212064_100000692301 [0,2,0,0,0,0|0,0,1]=3 3095 B22R2.139395 CC(C)C(=O)COC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000753385 [0,2,0,0,0,0|1,0,1]=4 3096 B22R2.139395 CC(C)C(=O)COC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000753385 [0,2,0,0,0,0|1,0,1]=4 3097 B22R2.139395 CC(C)C(=O)COC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000753385 [0,2,0,0,0,0|1,0,1]=4 3098 B22R2.139395 CC(C)C(=O)COC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000753385 [0,2,0,0,0,0|1,0,1]=4 3099 B22R2.139395 CC(C)C(O)CNC(c1ccccc1)c2cccc(c2)Br 270004a_100000759067_100011267660 [0,2,0,0,0,0|2,0,0]=4 3100 B22R2.139395 CC(C)C(O)CNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000759067_100011215489 [0,2,0,0,0,0|2,0,0]=4 3101 B22R2.139395 CC(C)C(O)CNC(c1ccccc1)c2cccc(c2)F 270004a_100000759067_200011219850 [0,2,0,0,0,0|2,0,0]=4 3102 B22R2.139395 CN(C)C(=O)CNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000185267 [0,2,0,0,0,0|1,0,1]=4 3103 B22R2.139395 CN(C)C(=O)CNC(c1ccccc1)c2cccc(c2)Br 270004a_100015183351_100011267660 [0,2,0,0,0,0|1,0,1]=4 3104 B22R2.139395 CN(C)C(=O)CNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000692301 [0,2,0,0,0,0|1,0,1]=4 3105 B22R2.139395 CN(C)C(=O)CNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000185267 [0,2,0,0,0,0|1,0,1]=4 3106 B22R2.139395 CN(C)C(=O)CNC(c1ccccc1)c2cccc(c2)Cl 270004a_100015183351_100011215489 [0,2,0,0,0,0|1,0,1]=4 3107 B22R2.139395 CN(C)C(=O)CNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000692301 [0,2,0,0,0,0|1,0,1]=4 3108 B22R2.139395 CN(C)C(=O)CNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000185267 [0,2,0,0,0,0|1,0,1]=4 3109 B22R2.139395 CN(C)C(=O)CNC(c1ccccc1)c2cccc(c2)F 270004a_100015183351_200011219850 [0,2,0,0,0,0|1,0,1]=4 3110 B22R2.139395 CN(C)C(=O)CNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000692301 [0,2,0,0,0,0|1,0,1]=4 3111 B22R2.139395 CN(C)C(=O)COC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000692301 [0,2,0,0,0,0|0,0,1]=3 3112 B22R2.139395 CN(C)C(=O)COC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000692301 [0,2,0,0,0,0|0,0,1]=3 3113 B22R2.139395 CN(C)C(=O)COC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000692301 [0,2,0,0,0,0|0,0,1]=3 3114 B22R2.139395 CN(C)C(=O)COC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000692301 [0,2,0,0,0,0|0,0,1]=3 3115 B22R2.139395 Cc1cccc(c1)C(NCC(=O)N(C)C)c2ccccc2 270004a_100015183351_100011217825 [0,2,0,0,0,0|1,0,1]=4 3116 B22R2.139395 Cc1cccc(c1)C(NCC(O)C(C)C)c2ccccc2 270004a_100000759067_100011217825 [0,2,0,0,0,0|2,0,0]=4 3117 B22R2.201379 CC(=O)C(C)COC(c1ccccc1)c2ccccc2C 7a_100000032740_100000230135 [0,2,0,0,0,0|2,0,0]=4 3118 B22R2.201379 CC(C)C(=O)COC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000753385 [0,2,0,0,0,0|1,0,1]=4 3119 B22R2.201379 CC(C)C(=O)COC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000753385 [0,2,0,0,0,0|1,0,1]=4 3120 B22R2.201379 CC(C)C(=O)COC(c1ccccc1)c2ccccc2N 34a_100000246470_100000753385 [0,2,0,0,0,0|1,0,1]=4 3121 B22R2.201379 CC(C)C(=O)COC(c1ccccc1)c2ccccc2N 7a_100000246470_100000753385 [0,2,0,0,0,0|1,0,1]=4 3122 B22R2.201379 CC(C)C(O)CNC(c1ccccc1)c2ccccc2Br 270004a_100000759067_100000198044 [0,2,0,0,0,0|2,0,0]=4 3123 B22R2.201379 CC(C)C(O)CNC(c1ccccc1)c2ccccc2Cl 270004a_100000759067_100011215288 [0,2,0,0,0,0|2,0,0]=4 3124 B22R2.201379 CC(C)C(O)CNC(c1ccccc1)c2ccccc2F 270004a_100000759067_100011217773 [0,2,0,0,0,0|2,0,0]=4 3125 B22R2.201379 CN(C)C(=O)CNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000185267 [0,2,0,0,0,0|1,0,1]=4 3126 B22R2.201379 CN(C)C(=O)CNC(c1ccccc1)c2ccccc2Br 270004a_100015183351_100000198044 [0,2,0,0,0,0|1,0,1]=4 3127 B22R2.201379 CN(C)C(=O)CNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000692301 [0,2,0,0,0,0|1,0,1]=4 3128 B22R2.201379 CN(C)C(=O)CNC(c1ccccc1)c2ccccc2Cl 270004a_100015183351_100011215288 [0,2,0,0,0,0|1,0,1]=4 3129 B22R2.201379 CN(C)C(=O)CNC(c1ccccc1)c2ccccc2F 270004a_100015183351_100011217773 [0,2,0,0,0,0|1,0,1]=4 3130 B22R2.201379 CN(C)C(=O)COC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000692301 [0,2,0,0,0,0|0,0,1]=3 3131 B22R2.201379 CN(C)C(=O)COC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000692301 [0,2,0,0,0,0|0,0,1]=3 3132 B22R2.201379 CN(C)C(=O)COC(c1ccccc1)c2ccccc2N 34a_100000246470_100000692301 [0,2,0,0,0,0|0,0,1]=3 3133 B22R2.201379 CN(C)C(=O)COC(c1ccccc1)c2ccccc2N 7a_100000246470_100000692301 [0,2,0,0,0,0|0,0,1]=3 3134 B22R2.201379 Cc1ccccc1C(NCC(=O)N(C)C)c2ccccc2 2230a_100000222801_100000185267 [0,2,0,0,0,0|1,0,1]=4 3135 B22R2.201379 Cc1ccccc1C(NCC(=O)N(C)C)c2ccccc2 2230a_100015183351_100000230135 [0,2,0,0,0,0|1,0,1]=4 3136 B22R2.201379 Cc1ccccc1C(NCC(=O)N(C)C)c2ccccc2 270004a_100015183351_100000735561 [0,2,0,0,0,0|1,0,1]=4 3137 B22R2.201379 Cc1ccccc1C(NCC(=O)N(C)C)c2ccccc2 34a_100000222801_100000692301 [0,2,0,0,0,0|1,0,1]=4 3138 B22R2.201379 Cc1ccccc1C(NCC(O)C(C)C)c2ccccc2 2230a_100000759067_100000230135 [0,2,0,0,0,0|2,0,0]=4 3139 B22R2.201379 Cc1ccccc1C(NCC(O)C(C)C)c2ccccc2 270004a_100000759067_100000735561 [0,2,0,0,0,0|2,0,0]=4 3140 B22R2.201379 Cc1ccccc1C(OCC(=O)C(C)C)c2ccccc2 34a_100000212071_100000753385 [0,2,0,0,0,0|1,0,1]=4 3141 B22R2.201379 Cc1ccccc1C(OCC(=O)C(C)C)c2ccccc2 7a_100000212071_100000753385 [0,2,0,0,0,0|1,0,1]=4 3142 B22R2.201379 Cc1ccccc1C(OCC(=O)N(C)C)c2ccccc2 34a_100000212071_100000692301 [0,2,0,0,0,0|0,0,1]=3 3143 B22R2.201379 Cc1ccccc1C(OCC(=O)N(C)C)c2ccccc2 7a_100000212071_100000692301 [0,2,0,0,0,0|0,0,1]=3 3144 B22R2.201379 Cc1ccccc1C(SCC(=O)N(C)C)c2ccccc2 62a_100000230135_100000692301 [0,2,0,0,0,0|0,1,1]=4 3145 B22R2.201379 Cc1ccccc1C(SCC(=O)N(C)C)c2ccccc2 62a_100000692301_100000230135 [0,2,0,0,0,0|0,1,1]=4 3146 B22R2.355012 CC(CC(=O)C(c1ccccc1)c2ccccc2)N(C)C 1458a_100011311895_100011216954 [0,2,0,0,0,0|1,0,0]=3 3147 B22R2.355012 CN(C)C(=O)CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000185267 [0,2,0,0,0,0|1,0,1]=4 3148 B22R2.355012 CN(C)C(=O)CN(C)C(c1ccccc1)c2ccccc2 2230a_100000185065_100000211591 [0,2,0,0,0,0|1,0,1]=4 3149 B22R2.355012 CN(C)C(=O)CN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000185267 [0,2,0,0,0,0|1,0,1]=4 3150 B22R2.355012 CN(C)C(=O)CN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000185267 [0,2,0,0,0,0|1,0,1]=4 3151 B22R2.355012 CN(C)C(=O)CN(C)C(c1ccccc1)c2ccccc2 270004a_100000185065_100000210122 [0,2,0,0,0,0|1,0,1]=4 3152 B22R2.355012 CN(C)C(=O)CS(=O)C(c1ccccc1)c2ccccc2 11a_100102631434_100020617424 [0,2,0,0,0,0|0,1,1]=4 3153 B22R2.355012 CN(C)C(=O)CS(=O)C(c1ccccc1)c2ccccc2 1626a_100102631434_100020617424 [0,2,0,0,0,0|0,1,1]=4 3154 B22R2.355012 CN(C)C(=O)CS(=O)C(c1ccccc1)c2ccccc2 240690a_100102631434_100020617424 [0,2,0,0,0,0|0,1,1]=4 3155 B22R2.355012 CN(C)C(=O)CS(=O)C(c1ccccc1)c2ccccc2 527a_100102631434_100020617424 [0,2,0,0,0,0|0,1,1]=4 3156 B22R2.359678 CC(C(=O)NC(c1ccccc1)c2ccccc2)N(C)C 2230a_100102631434_100000389546 [0,2,0,0,0,0|1,0,1]=4 3157 B22R2.359678 CC(C(=O)NC(c1ccccc1)c2ccccc2)N(C)C 269982a_100102631434_100000389546 [0,2,0,0,0,0|1,0,1]=4 3158 B22R2.359678 CC(C)C(=O)C(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_100009893295 [0,2,0,0,0,0|1,0,1]=4 3159 B22R2.359678 CC(NC(c1ccccc1)c2ccccc2)C(=O)N(C)C 2230a_100000162943_100000209910 [0,2,0,0,0,0|1,0,1]=4 3160 B22R2.359678 CC(OC(c1ccccc1)c2ccccc2)C(=O)N(C)C 7a_100000211180_100000209910 [0,2,0,0,0,0|0,0,1]=3 3161 B22R2.359678 CC(OC(c1ccccc1)c2ccccn2)C(=O)N(C)C 7a_100000180852_100000209910 [0,2,0,0,0,0|1,0,1]=4 3162 B22R2.359678 CC(SC(c1ccccc1)c2ccccc2)C(=O)N(C)C 62a_100000209910_100011216954 [0,2,0,0,0,0|0,1,1]=4 3163 B22R2.359678 CC(SC(c1ccccc1)c2ccccc2)C(=O)N(C)C 62a_100000211591_100000209910 [0,2,0,0,0,0|0,1,1]=4 3164 B22R2.359678 C[C@@H](C(=O)NC(c1ccccc1)c2ccccc2)N(C)C 240690a_100000162943_100009822176 [0,2,0,0,0,0|1,0,1]=4 3165 B22R2.359678 C[C@@H](C(=O)NC(c1ccccc1)c2ccccc2)N(C)C 527a_100000162943_100009822176 [0,2,0,0,0,0|1,0,1]=4 3166 B22R2.359678 C[C@H](NC(c1ccccc1)c2ccccc2)C(=O)N(C)C 2230a_100000697320_100000211591 [0,2,0,0,0,0|1,0,1]=4 3167 B22R2.359678 C[C@H](NC(c1ccccc1)c2ccccc2)C(=O)N(C)C 270004a_100000697320_100000210122 [0,2,0,0,0,0|1,0,1]=4 3168 B22R2.359861 CC(C)C(=O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000753385 [0,2,0,0,0,0|1,0,1]=4 3169 B22R2.359861 CN(C)C(=O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000692301 [0,2,0,0,0,0|0,0,1]=3 3170 B22R2.359861 CN(C)C(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000692301 [0,2,0,0,0,0|1,0,1]=4 3171 B22R2.6514830 CN(C)C(C)(C)CNC(c1ccccc1)c2ccccc2 270004a_100153394228_100000210122 [0,2,0,0,0,0|1,0,0]=3 3172 B22R2.6514830 CN(C)C(C)(C)CNC(c1ccccc1)c2ccccn2 270004a_100153394228_100000210380 [0,2,0,0,0,0|2,0,0]=4 3173 B22R2.6514830 CN(C)C(C)(C)CNC(c1ccccc1)c2cccnc2 270004a_100153394228_100000735413 [0,2,0,0,0,0|2,0,0]=4 3174 B22R2.48456 CC(CC(C)(C)C)OC(c1ccccc1)c2ccccc2 7a_200011218616_100011216954 [0,2,0,0,0,0|1,0,0]=3 3175 B22R2.48456 C[C@@H](CC(C)(C)C)NC(c1ccccc1)c2ccccc2 2230a_106358413534_100000211591 [0,2,0,0,0,0|2,0,0]=4 3176 B22R2.48456 C[C@@H](CC(C)(C)C)NC(c1ccccc1)c2ccccc2 270004a_106358413534_100000210122 [0,2,0,0,0,0|2,0,0]=4 3177 B22R2.284170 CC(C)(C)CCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000755188 [0,2,0,0,0,0|2,0,0]=4 3178 B22R2.284170 CC(C)(C)CCNC(c1ccccc1)c2ccccc2Br 270004a_100000738805_100000198044 [0,2,0,0,0,0|2,0,0]=4 3179 B22R2.284170 CC(C)(C)CCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000755188 [0,2,0,0,0,0|2,0,0]=4 3180 B22R2.284170 CC(C)(C)CCNC(c1ccccc1)c2ccccc2Cl 270004a_100000738805_100011215288 [0,2,0,0,0,0|2,0,0]=4 3181 B22R2.284170 CC(C)(C)CCNC(c1ccccc1)c2ccccc2F 270004a_100000738805_100011217773 [0,2,0,0,0,0|2,0,0]=4 3182 B22R2.284170 CC(C)(C)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000755188 [0,2,0,0,0,0|1,0,0]=3 3183 B22R2.284170 CC(C)(C)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000755188 [0,2,0,0,0,0|1,0,0]=3 3184 B22R2.284170 CC(C)(C)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000755188 [0,2,0,0,0,0|1,0,0]=3 3185 B22R2.284170 CC(C)(C)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000755188 [0,2,0,0,0,0|1,0,0]=3 3186 B22R2.284170 CC(C)(F)CCNC(c1ccccc1)c2ccccc2Br 270004a_100016253952_100000198044 [0,2,0,0,0,0|2,0,0]=4 3187 B22R2.284170 CC(C)(F)CCNC(c1ccccc1)c2ccccc2Cl 270004a_100016253952_100011215288 [0,2,0,0,0,0|2,0,0]=4 3188 B22R2.284170 CC(C)(F)CCNC(c1ccccc1)c2ccccc2F 270004a_100016253952_100011217773 [0,2,0,0,0,0|2,0,0]=4 3189 B22R2.284170 CC(C)(O)CCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000702414 [0,2,0,0,0,0|2,0,0]=4 3190 B22R2.284170 CC(C)(O)CCNC(c1ccccc1)c2ccccc2Br 270004a_100000707701_100000198044 [0,2,0,0,0,0|2,0,0]=4 3191 B22R2.284170 CC(C)(O)CCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000702414 [0,2,0,0,0,0|2,0,0]=4 3192 B22R2.284170 CC(C)(O)CCNC(c1ccccc1)c2ccccc2Cl 270004a_100000707701_100011215288 [0,2,0,0,0,0|2,0,0]=4 3193 B22R2.284170 CC(C)(O)CCNC(c1ccccc1)c2ccccc2F 270004a_100000707701_100011217773 [0,2,0,0,0,0|2,0,0]=4 3194 B22R2.284170 CC(C)(O)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000702414 [0,2,0,0,0,0|1,0,0]=3 3195 B22R2.284170 CC(C)(O)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000702414 [0,2,0,0,0,0|1,0,0]=3 3196 B22R2.284170 CC(C)(O)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000702414 [0,2,0,0,0,0|1,0,0]=3 3197 B22R2.284170 CC(C)(O)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000702414 [0,2,0,0,0,0|1,0,0]=3 3198 B22R2.284170 CS(=O)(=O)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000731031 [0,2,0,0,0,0|2,0,0]=4 3199 B22R2.284170 CS(=O)(=O)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000230027 [0,2,0,0,0,0|2,0,0]=4 3200 B22R2.284170 CS(=O)(=O)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000731031 [0,2,0,0,0,0|2,0,0]=4 3201 B22R2.284170 CS(=O)(=O)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000230027 [0,2,0,0,0,0|2,0,0]=4 3202 B22R2.284170 C[N+](C)(C)CCNC(c1ccccc1)c2ccccc2Br 270004a_100000106457_100000198044 [0,2,0,0,0,0|1,0,1]=4 3203 B22R2.284170 C[N+](C)(C)CCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000085578 [0,2,0,0,0,0|1,0,1]=4 3204 B22R2.284170 C[N+](C)(C)CCNC(c1ccccc1)c2ccccc2Cl 270004a_100000106457_100011215288 [0,2,0,0,0,0|1,0,1]=4 3205 B22R2.284170 C[N+](C)(C)CCNC(c1ccccc1)c2ccccc2F 270004a_100000106457_100011217773 [0,2,0,0,0,0|1,0,1]=4 3206 B22R2.284170 C[N+](C)(C)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000085578 [0,2,0,0,0,0|0,0,1]=3 3207 B22R2.284170 C[N+](C)(C)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000085578 [0,2,0,0,0,0|0,0,1]=3 3208 B22R2.284170 C[N+](C)(C)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000085578 [0,2,0,0,0,0|0,0,1]=3 3209 B22R2.284170 C[N+](C)(C)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000085578 [0,2,0,0,0,0|0,0,1]=3 3210 B22R2.284170 C[Si](C)(C)CCNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_200000733723 [0,2,0,0,0,0|2,0,0]=4 3211 B22R2.284170 C[Si](C)(C)CCNC(c1ccccc1)c2ccccc2Br 34a_100011211563_200000733723 [0,2,0,0,0,0|2,0,0]=4 3212 B22R2.284170 C[Si](C)(C)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_200000733723 [0,2,0,0,0,0|1,0,0]=3 3213 B22R2.284170 C[Si](C)(C)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_200000733723 [0,2,0,0,0,0|1,0,0]=3 3214 B22R2.284170 C[Si](C)(C)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_200000733723 [0,2,0,0,0,0|1,0,0]=3 3215 B22R2.284170 C[Si](C)(C)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_200000733723 [0,2,0,0,0,0|1,0,0]=3 3216 B22R2.284170 Cc1ccccc1C(NCCC(C)(C)C)c2ccccc2 2230a_100000222801_100000755188 [0,2,0,0,0,0|2,0,0]=4 3217 B22R2.284170 Cc1ccccc1C(NCCC(C)(C)C)c2ccccc2 2230a_100000738805_100000230135 [0,2,0,0,0,0|2,0,0]=4 3218 B22R2.284170 Cc1ccccc1C(NCCC(C)(C)C)c2ccccc2 270004a_100000738805_100000735561 [0,2,0,0,0,0|2,0,0]=4 3219 B22R2.284170 Cc1ccccc1C(NCCC(C)(C)C)c2ccccc2 34a_100000222801_100000755188 [0,2,0,0,0,0|2,0,0]=4 3220 B22R2.284170 Cc1ccccc1C(NCCC(C)(C)F)c2ccccc2 2230a_100016253952_100000230135 [0,2,0,0,0,0|2,0,0]=4 3221 B22R2.284170 Cc1ccccc1C(NCCC(C)(C)F)c2ccccc2 270004a_100016253952_100000735561 [0,2,0,0,0,0|2,0,0]=4 3222 B22R2.284170 Cc1ccccc1C(NCCC(C)(C)O)c2ccccc2 2230a_100000222801_100000702414 [0,2,0,0,0,0|2,0,0]=4 3223 B22R2.284170 Cc1ccccc1C(NCCC(C)(C)O)c2ccccc2 270004a_100000707701_100000735561 [0,2,0,0,0,0|2,0,0]=4 3224 B22R2.284170 Cc1ccccc1C(NCCC(C)(C)O)c2ccccc2 34a_100000222801_100000702414 [0,2,0,0,0,0|2,0,0]=4 3225 B22R2.284170 Cc1ccccc1C(NCC[N+](C)(C)C)c2ccccc2 270004a_100000106457_100000735561 [0,2,0,0,0,0|1,0,1]=4 3226 B22R2.284170 Cc1ccccc1C(NCC[N+](C)(C)C)c2ccccc2 34a_100000222801_100000085578 [0,2,0,0,0,0|1,0,1]=4 3227 B22R2.284170 Cc1ccccc1C(NCC[Si](C)(C)C)c2ccccc2 2230a_100000222801_200000733723 [0,2,0,0,0,0|2,0,0]=4 3228 B22R2.284170 Cc1ccccc1C(NCC[Si](C)(C)C)c2ccccc2 34a_100000222801_200000733723 [0,2,0,0,0,0|2,0,0]=4 3229 B22R2.284170 Cc1ccccc1C(OCCC(C)(C)C)c2ccccc2 34a_100000212071_100000755188 [0,2,0,0,0,0|1,0,0]=3 3230 B22R2.284170 Cc1ccccc1C(OCCC(C)(C)C)c2ccccc2 7a_100000212071_100000755188 [0,2,0,0,0,0|1,0,0]=3 3231 B22R2.284170 Cc1ccccc1C(OCCC(C)(C)C)c2ccccc2 7a_100000765024_100000230135 [0,2,0,0,0,0|1,0,0]=3 3232 B22R2.284170 Cc1ccccc1C(OCCC(C)(C)O)c2ccccc2 34a_100000212071_100000702414 [0,2,0,0,0,0|1,0,0]=3 3233 B22R2.284170 Cc1ccccc1C(OCCC(C)(C)O)c2ccccc2 7a_100000212071_100000702414 [0,2,0,0,0,0|1,0,0]=3 3234 B22R2.284170 Cc1ccccc1C(OCCS(=O)(=O)C)c2ccccc2 34a_100000212071_100000731031 [0,2,0,0,0,0|2,0,0]=4 3235 B22R2.284170 Cc1ccccc1C(OCCS(=O)(=O)C)c2ccccc2 7a_100000211924_100000230135 [0,2,0,0,0,0|2,0,0]=4 3236 B22R2.284170 Cc1ccccc1C(OCCS(=O)(=O)C)c2ccccc2 7a_100000212071_100000230027 [0,2,0,0,0,0|2,0,0]=4 3237 B22R2.284170 Cc1ccccc1C(OCC[N+](C)(C)C)c2ccccc2 34a_100000212071_100000085578 [0,2,0,0,0,0|0,0,1]=3 3238 B22R2.284170 Cc1ccccc1C(OCC[N+](C)(C)C)c2ccccc2 7a_100000212071_100000085578 [0,2,0,0,0,0|0,0,1]=3 3239 B22R2.284170 Cc1ccccc1C(OCC[N+](C)(C)C)c2ccccc2 7a_200020618287_100000230135 [0,2,0,0,0,0|0,0,1]=3 3240 B22R2.284170 Cc1ccccc1C(OCC[Si](C)(C)C)c2ccccc2 34a_100000212071_200000733723 [0,2,0,0,0,0|1,0,0]=3 3241 B22R2.284170 Cc1ccccc1C(OCC[Si](C)(C)C)c2ccccc2 7a_100000039746_100000230135 [0,2,0,0,0,0|1,0,0]=3 3242 B22R2.284170 Cc1ccccc1C(OCC[Si](C)(C)C)c2ccccc2 7a_100000212071_200000733723 [0,2,0,0,0,0|1,0,0]=3 3243 B22R2.284170 Cc1ccccc1C(SCCC(C)(C)O)c2ccccc2 62a_100000230135_100000702414 [0,2,0,0,0,0|1,1,0]=4 3244 B22R2.284170 Cc1ccccc1C(SCCC(C)(C)O)c2ccccc2 62a_100000702414_100000230135 [0,2,0,0,0,0|1,1,0]=4 3245 B22R2.284170 Cc1ccccc1C(SCC[N+](C)(C)C)c2ccccc2 62a_100000085578_100000230135 [0,2,0,0,0,0|0,1,1]=4 3246 B22R2.284170 Cc1ccccc1C(SCC[N+](C)(C)C)c2ccccc2 62a_100000230135_100000085578 [0,2,0,0,0,0|0,1,1]=4 3247 B22R2.360732 CC(C)(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000755188 [0,2,0,0,0,0|2,0,0]=4 3248 B22R2.360732 CC(C)(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000757465_100011216954 [0,2,0,0,0,0|2,0,0]=4 3249 B22R2.360732 CN(CCC(C)(C)C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000755188 [0,2,0,0,0,0|2,0,0]=4 3250 B22R2.360732 CN(CCC(C)(C)C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000755188 [0,2,0,0,0,0|2,0,0]=4 3251 B22R2.360732 CN(CCC(C)(C)O)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000702414 [0,2,0,0,0,0|2,0,0]=4 3252 B22R2.360732 CN(CC[N+](C)(C)C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000085578 [0,2,0,0,0,0|1,0,1]=4 3253 B22R2.360732 CN(CC[Si](C)(C)C)C(c1ccccc1)c2ccccc2 2230a_100103148541_200000733723 [0,2,0,0,0,0|2,0,0]=4 3254 B22R2.360732 CN(CC[Si](C)(C)C)C(c1ccccc1)c2ccccc2 269982a_100103148541_200000733723 [0,2,0,0,0,0|2,0,0]=4 3255 B22R2.360732 C[N+](C)(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000085578 [0,2,0,0,0,0|1,0,1]=4 3256 B22R2.360732 C[Si](C)(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_200000733723 [0,2,0,0,0,0|2,0,0]=4 3257 B22R2.360732 C[Si](C)(C)CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100011215282_100011216954 [0,2,0,0,0,0|2,0,0]=4 3258 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000755188 [0,2,0,0,0,0|2,0,0]=4 3259 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000738805_100000718703 [0,2,0,0,0,0|2,0,0]=4 3260 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000755188 [0,2,0,0,0,0|2,0,0]=4 3261 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000755188 [0,2,0,0,0,0|2,0,0]=4 3262 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000738805_100000211669 [0,2,0,0,0,0|2,0,0]=4 3263 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000738805_100000211064 [0,2,0,0,0,0|2,0,0]=4 3264 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000755188 [0,2,0,0,0,0|2,0,0]=4 3265 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000755188 [0,2,0,0,0,0|2,0,0]=4 3266 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000738805_100000210425 [0,2,0,0,0,0|2,0,0]=4 3267 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000755188 [0,2,0,0,0,0|2,0,0]=4 3268 B22R2.531953 CC(C)(C)CCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000755188 [0,2,0,0,0,0|2,0,0]=4 3269 B22R2.531953 CC(C)(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000755188 [0,2,0,0,0,0|2,0,0]=4 3270 B22R2.531953 CC(C)(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000765024_200010188304 [0,2,0,0,0,0|2,0,0]=4 3271 B22R2.531953 CC(C)(C)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000755188 [0,2,0,0,0,0|1,0,0]=3 3272 B22R2.531953 CC(C)(C)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000755188 [0,2,0,0,0,0|1,0,0]=3 3273 B22R2.531953 CC(C)(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000755188 [0,2,0,0,0,0|1,0,0]=3 3274 B22R2.531953 CC(C)(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000755188 [0,2,0,0,0,0|1,0,0]=3 3275 B22R2.531953 CC(C)(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000765024_100000211669 [0,2,0,0,0,0|1,0,0]=3 3276 B22R2.531953 CC(C)(C)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000755188 [0,2,0,0,0,0|1,0,0]=3 3277 B22R2.531953 CC(C)(C)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000755188 [0,2,0,0,0,0|1,0,0]=3 3278 B22R2.531953 CC(C)(C)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000755188 [0,2,0,0,0,0|1,0,0]=3 3279 B22R2.531953 CC(C)(C)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000755188 [0,2,0,0,0,0|1,0,0]=3 3280 B22R2.531953 CC(C)(C)CCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000755188 [0,2,0,0,0,0|2,0,0]=4 3281 B22R2.531953 CC(C)(F)CCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100016253952_100000718703 [0,2,0,0,0,0|2,0,0]=4 3282 B22R2.531953 CC(C)(F)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100016253952_100000211669 [0,2,0,0,0,0|2,0,0]=4 3283 B22R2.531953 CC(C)(F)CCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100016253952_100000211064 [0,2,0,0,0,0|2,0,0]=4 3284 B22R2.531953 CC(C)(F)CCNC(c1ccccc1)c2ccc(cc2)F 270004a_100016253952_100000210425 [0,2,0,0,0,0|2,0,0]=4 3285 B22R2.531953 CC(C)(O)CCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000702414 [0,2,0,0,0,0|2,0,0]=4 3286 B22R2.531953 CC(C)(O)CCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000707701_100000718703 [0,2,0,0,0,0|2,0,0]=4 3287 B22R2.531953 CC(C)(O)CCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000702414 [0,2,0,0,0,0|2,0,0]=4 3288 B22R2.531953 CC(C)(O)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000702414 [0,2,0,0,0,0|2,0,0]=4 3289 B22R2.531953 CC(C)(O)CCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000707701_100000211064 [0,2,0,0,0,0|2,0,0]=4 3290 B22R2.531953 CC(C)(O)CCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000702414 [0,2,0,0,0,0|2,0,0]=4 3291 B22R2.531953 CC(C)(O)CCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000702414 [0,2,0,0,0,0|2,0,0]=4 3292 B22R2.531953 CC(C)(O)CCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000707701_100000210425 [0,2,0,0,0,0|2,0,0]=4 3293 B22R2.531953 CC(C)(O)CCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000702414 [0,2,0,0,0,0|2,0,0]=4 3294 B22R2.531953 CC(C)(O)CCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000702414 [0,2,0,0,0,0|2,0,0]=4 3295 B22R2.531953 CC(C)(O)CCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000702414 [0,2,0,0,0,0|2,0,0]=4 3296 B22R2.531953 CC(C)(O)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000702414 [0,2,0,0,0,0|1,0,0]=3 3297 B22R2.531953 CC(C)(O)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000702414 [0,2,0,0,0,0|1,0,0]=3 3298 B22R2.531953 CC(C)(O)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000702414 [0,2,0,0,0,0|1,0,0]=3 3299 B22R2.531953 CC(C)(O)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000702414 [0,2,0,0,0,0|1,0,0]=3 3300 B22R2.531953 CC(C)(O)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000702414 [0,2,0,0,0,0|1,0,0]=3 3301 B22R2.531953 CC(C)(O)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000702414 [0,2,0,0,0,0|1,0,0]=3 3302 B22R2.531953 CC(C)(O)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000702414 [0,2,0,0,0,0|1,0,0]=3 3303 B22R2.531953 CC(C)(O)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000702414 [0,2,0,0,0,0|1,0,0]=3 3304 B22R2.531953 CC(C)(O)CCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000702414 [0,2,0,0,0,0|2,0,0]=4 3305 B22R2.531953 CC(C)(O)CCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000702414 [0,2,0,0,0,0|1,1,0]=4 3306 B22R2.531953 CC(C)(O)CCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000702414_100000211669 [0,2,0,0,0,0|1,1,0]=4 3307 B22R2.531953 CS(=O)(=O)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000731031 [0,2,0,0,0,0|2,0,0]=4 3308 B22R2.531953 CS(=O)(=O)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000230027 [0,2,0,0,0,0|2,0,0]=4 3309 B22R2.531953 CS(=O)(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000731031 [0,2,0,0,0,0|2,0,0]=4 3310 B22R2.531953 CS(=O)(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000230027 [0,2,0,0,0,0|2,0,0]=4 3311 B22R2.531953 CS(=O)(=O)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211924_100000211669 [0,2,0,0,0,0|2,0,0]=4 3312 B22R2.531953 CS(=O)(=O)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000731031 [0,2,0,0,0,0|2,0,0]=4 3313 B22R2.531953 CS(=O)(=O)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000230027 [0,2,0,0,0,0|2,0,0]=4 3314 B22R2.531953 CS(=O)(=O)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000731031 [0,2,0,0,0,0|2,0,0]=4 3315 B22R2.531953 CS(=O)(=O)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000230027 [0,2,0,0,0,0|2,0,0]=4 3316 B22R2.531953 C[N+](C)(C)CCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000106457_100000718703 [0,2,0,0,0,0|1,0,1]=4 3317 B22R2.531953 C[N+](C)(C)CCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000085578 [0,2,0,0,0,0|1,0,1]=4 3318 B22R2.531953 C[N+](C)(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000106457_100000211064 [0,2,0,0,0,0|1,0,1]=4 3319 B22R2.531953 C[N+](C)(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000085578 [0,2,0,0,0,0|1,0,1]=4 3320 B22R2.531953 C[N+](C)(C)CCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000106457_100000210425 [0,2,0,0,0,0|1,0,1]=4 3321 B22R2.531953 C[N+](C)(C)CCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000085578 [0,2,0,0,0,0|1,0,1]=4 3322 B22R2.531953 C[N+](C)(C)CCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000085578 [0,2,0,0,0,0|1,0,1]=4 3323 B22R2.531953 C[N+](C)(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000085578 [0,2,0,0,0,0|1,0,1]=4 3324 B22R2.531953 C[N+](C)(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 7a_200020618287_200010188304 [0,2,0,0,0,0|1,0,1]=4 3325 B22R2.531953 C[N+](C)(C)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000085578 [0,2,0,0,0,0|0,0,1]=3 3326 B22R2.531953 C[N+](C)(C)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000085578 [0,2,0,0,0,0|0,0,1]=3 3327 B22R2.531953 C[N+](C)(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000085578 [0,2,0,0,0,0|0,0,1]=3 3328 B22R2.531953 C[N+](C)(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000085578 [0,2,0,0,0,0|0,0,1]=3 3329 B22R2.531953 C[N+](C)(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_200020618287_100000211669 [0,2,0,0,0,0|0,0,1]=3 3330 B22R2.531953 C[N+](C)(C)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000085578 [0,2,0,0,0,0|0,0,1]=3 3331 B22R2.531953 C[N+](C)(C)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000085578 [0,2,0,0,0,0|0,0,1]=3 3332 B22R2.531953 C[N+](C)(C)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000085578 [0,2,0,0,0,0|0,0,1]=3 3333 B22R2.531953 C[N+](C)(C)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000085578 [0,2,0,0,0,0|0,0,1]=3 3334 B22R2.531953 C[N+](C)(C)CCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000085578 [0,2,0,0,0,0|1,0,1]=4 3335 B22R2.531953 C[N+](C)(C)CCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000085578_100000211669 [0,2,0,0,0,0|0,1,1]=4 3336 B22R2.531953 C[N+](C)(C)CCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000085578 [0,2,0,0,0,0|0,1,1]=4 3337 B22R2.531953 C[Si](C)(C)CCNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_200000733723 [0,2,0,0,0,0|2,0,0]=4 3338 B22R2.531953 C[Si](C)(C)CCNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_200000733723 [0,2,0,0,0,0|2,0,0]=4 3339 B22R2.531953 C[Si](C)(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_200000733723 [0,2,0,0,0,0|2,0,0]=4 3340 B22R2.531953 C[Si](C)(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_200000733723 [0,2,0,0,0,0|2,0,0]=4 3341 B22R2.531953 C[Si](C)(C)CCNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_200000733723 [0,2,0,0,0,0|2,0,0]=4 3342 B22R2.531953 C[Si](C)(C)CCNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_200000733723 [0,2,0,0,0,0|2,0,0]=4 3343 B22R2.531953 C[Si](C)(C)CCNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_200000733723 [0,2,0,0,0,0|2,0,0]=4 3344 B22R2.531953 C[Si](C)(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_200000733723 [0,2,0,0,0,0|2,0,0]=4 3345 B22R2.531953 C[Si](C)(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000039746_200010188304 [0,2,0,0,0,0|2,0,0]=4 3346 B22R2.531953 C[Si](C)(C)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_200000733723 [0,2,0,0,0,0|1,0,0]=3 3347 B22R2.531953 C[Si](C)(C)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_200000733723 [0,2,0,0,0,0|1,0,0]=3 3348 B22R2.531953 C[Si](C)(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_200000733723 [0,2,0,0,0,0|1,0,0]=3 3349 B22R2.531953 C[Si](C)(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000039746_100000211669 [0,2,0,0,0,0|1,0,0]=3 3350 B22R2.531953 C[Si](C)(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_200000733723 [0,2,0,0,0,0|1,0,0]=3 3351 B22R2.531953 C[Si](C)(C)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_200000733723 [0,2,0,0,0,0|1,0,0]=3 3352 B22R2.531953 C[Si](C)(C)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_200000733723 [0,2,0,0,0,0|1,0,0]=3 3353 B22R2.531953 C[Si](C)(C)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_200000733723 [0,2,0,0,0,0|1,0,0]=3 3354 B22R2.531953 C[Si](C)(C)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_200000733723 [0,2,0,0,0,0|1,0,0]=3 3355 B22R2.531953 C[Si](C)(C)CCOC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_200000733723 [0,2,0,0,0,0|2,0,0]=4 3356 B22R2.531953 Cc1ccc(cc1)C(NCCC(C)(C)C)c2ccccc2 2230a_100000736602_100000755188 [0,2,0,0,0,0|2,0,0]=4 3357 B22R2.531953 Cc1ccc(cc1)C(NCCC(C)(C)C)c2ccccc2 270004a_100000738805_100000210966 [0,2,0,0,0,0|2,0,0]=4 3358 B22R2.531953 Cc1ccc(cc1)C(NCCC(C)(C)C)c2ccccc2 34a_100000736602_100000755188 [0,2,0,0,0,0|2,0,0]=4 3359 B22R2.531953 Cc1ccc(cc1)C(NCCC(C)(C)F)c2ccccc2 270004a_100016253952_100000210966 [0,2,0,0,0,0|2,0,0]=4 3360 B22R2.531953 Cc1ccc(cc1)C(NCCC(C)(C)O)c2ccccc2 2230a_100000736602_100000702414 [0,2,0,0,0,0|2,0,0]=4 3361 B22R2.531953 Cc1ccc(cc1)C(NCCC(C)(C)O)c2ccccc2 270004a_100000707701_100000210966 [0,2,0,0,0,0|2,0,0]=4 3362 B22R2.531953 Cc1ccc(cc1)C(NCCC(C)(C)O)c2ccccc2 34a_100000736602_100000702414 [0,2,0,0,0,0|2,0,0]=4 3363 B22R2.531953 Cc1ccc(cc1)C(NCC[N+](C)(C)C)c2ccccc2 270004a_100000106457_100000210966 [0,2,0,0,0,0|1,0,1]=4 3364 B22R2.531953 Cc1ccc(cc1)C(NCC[N+](C)(C)C)c2ccccc2 34a_100000736602_100000085578 [0,2,0,0,0,0|1,0,1]=4 3365 B22R2.531953 Cc1ccc(cc1)C(NCC[Si](C)(C)C)c2ccccc2 2230a_100000736602_200000733723 [0,2,0,0,0,0|2,0,0]=4 3366 B22R2.531953 Cc1ccc(cc1)C(NCC[Si](C)(C)C)c2ccccc2 34a_100000736602_200000733723 [0,2,0,0,0,0|2,0,0]=4 3367 B22R2.531953 Cc1ccc(cc1)C(OCCC(C)(C)C)c2ccccc2 34a_100000212064_100000755188 [0,2,0,0,0,0|1,0,0]=3 3368 B22R2.531953 Cc1ccc(cc1)C(OCCC(C)(C)C)c2ccccc2 7a_100000212064_100000755188 [0,2,0,0,0,0|1,0,0]=3 3369 B22R2.531953 Cc1ccc(cc1)C(OCCC(C)(C)O)c2ccccc2 34a_100000212064_100000702414 [0,2,0,0,0,0|1,0,0]=3 3370 B22R2.531953 Cc1ccc(cc1)C(OCCC(C)(C)O)c2ccccc2 7a_100000212064_100000702414 [0,2,0,0,0,0|1,0,0]=3 3371 B22R2.531953 Cc1ccc(cc1)C(OCCS(=O)(=O)C)c2ccccc2 34a_100000212064_100000731031 [0,2,0,0,0,0|2,0,0]=4 3372 B22R2.531953 Cc1ccc(cc1)C(OCCS(=O)(=O)C)c2ccccc2 7a_100000212064_100000230027 [0,2,0,0,0,0|2,0,0]=4 3373 B22R2.531953 Cc1ccc(cc1)C(OCC[N+](C)(C)C)c2ccccc2 34a_100000212064_100000085578 [0,2,0,0,0,0|0,0,1]=3 3374 B22R2.531953 Cc1ccc(cc1)C(OCC[N+](C)(C)C)c2ccccc2 7a_100000212064_100000085578 [0,2,0,0,0,0|0,0,1]=3 3375 B22R2.531953 Cc1ccc(cc1)C(OCC[Si](C)(C)C)c2ccccc2 34a_100000212064_200000733723 [0,2,0,0,0,0|1,0,0]=3 3376 B22R2.531953 Cc1ccc(cc1)C(OCC[Si](C)(C)C)c2ccccc2 7a_100000212064_200000733723 [0,2,0,0,0,0|1,0,0]=3 3377 B22R2.4040853 CC(C)(C)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000755188 [0,2,0,0,0,0|1,0,0]=3 3378 B22R2.4040853 CC(C)(C)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000755188 [0,2,0,0,0,0|2,0,0]=4 3379 B22R2.4040853 CC(C)(O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000702414 [0,2,0,0,0,0|1,0,0]=3 3380 B22R2.4040853 CC(C)(O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000702414 [0,2,0,0,0,0|2,0,0]=4 3381 B22R2.4040853 CC(OCCS(=O)(=O)C)(c1ccccc1)c2ccccc2 7a_100011202337_100000230027 [0,2,0,0,0,0|2,0,0]=4 3382 B22R2.4040853 CC(OCC[N+](C)(C)C)(c1ccccc1)c2ccccc2 7a_100011202337_100000085578 [0,2,0,0,0,0|0,0,1]=3 3383 B22R2.4040853 CC(OCC[N+](C)(C)C)(c1ccccc1)c2ccccn2 7a_200000075192_100000085578 [0,2,0,0,0,0|1,0,1]=4 3384 B22R2.4040853 CC(OCC[Si](C)(C)C)(c1ccccc1)c2ccccc2 7a_100011202337_200000733723 [0,2,0,0,0,0|1,0,0]=3 3385 B22R2.4040853 CC(OCC[Si](C)(C)C)(c1ccccc1)c2ccccn2 7a_200000075192_200000733723 [0,2,0,0,0,0|2,0,0]=4 3386 B22R2.6124616 CC(C)(C)CCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000755188 [0,2,0,0,0,0|2,0,0]=4 3387 B22R2.6124616 CC(C)(C)CCNC(c1ccccc1)c2cccc(c2)Br 270004a_100000738805_100011267660 [0,2,0,0,0,0|2,0,0]=4 3388 B22R2.6124616 CC(C)(C)CCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000755188 [0,2,0,0,0,0|2,0,0]=4 3389 B22R2.6124616 CC(C)(C)CCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000755188 [0,2,0,0,0,0|2,0,0]=4 3390 B22R2.6124616 CC(C)(C)CCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000738805_100011215489 [0,2,0,0,0,0|2,0,0]=4 3391 B22R2.6124616 CC(C)(C)CCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000755188 [0,2,0,0,0,0|2,0,0]=4 3392 B22R2.6124616 CC(C)(C)CCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000755188 [0,2,0,0,0,0|2,0,0]=4 3393 B22R2.6124616 CC(C)(C)CCNC(c1ccccc1)c2cccc(c2)F 270004a_100000738805_200011219850 [0,2,0,0,0,0|2,0,0]=4 3394 B22R2.6124616 CC(C)(C)CCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000755188 [0,2,0,0,0,0|2,0,0]=4 3395 B22R2.6124616 CC(C)(C)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000755188 [0,2,0,0,0,0|1,0,0]=3 3396 B22R2.6124616 CC(C)(C)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000755188 [0,2,0,0,0,0|1,0,0]=3 3397 B22R2.6124616 CC(C)(C)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000755188 [0,2,0,0,0,0|1,0,0]=3 3398 B22R2.6124616 CC(C)(C)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000755188 [0,2,0,0,0,0|1,0,0]=3 3399 B22R2.6124616 CC(C)(F)CCNC(c1ccccc1)c2cccc(c2)Br 270004a_100016253952_100011267660 [0,2,0,0,0,0|2,0,0]=4 3400 B22R2.6124616 CC(C)(F)CCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100016253952_100011215489 [0,2,0,0,0,0|2,0,0]=4 3401 B22R2.6124616 CC(C)(F)CCNC(c1ccccc1)c2cccc(c2)F 270004a_100016253952_200011219850 [0,2,0,0,0,0|2,0,0]=4 3402 B22R2.6124616 CC(C)(O)CCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000702414 [0,2,0,0,0,0|2,0,0]=4 3403 B22R2.6124616 CC(C)(O)CCNC(c1ccccc1)c2cccc(c2)Br 270004a_100000707701_100011267660 [0,2,0,0,0,0|2,0,0]=4 3404 B22R2.6124616 CC(C)(O)CCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000702414 [0,2,0,0,0,0|2,0,0]=4 3405 B22R2.6124616 CC(C)(O)CCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000702414 [0,2,0,0,0,0|2,0,0]=4 3406 B22R2.6124616 CC(C)(O)CCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000707701_100011215489 [0,2,0,0,0,0|2,0,0]=4 3407 B22R2.6124616 CC(C)(O)CCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000702414 [0,2,0,0,0,0|2,0,0]=4 3408 B22R2.6124616 CC(C)(O)CCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000702414 [0,2,0,0,0,0|2,0,0]=4 3409 B22R2.6124616 CC(C)(O)CCNC(c1ccccc1)c2cccc(c2)F 270004a_100000707701_200011219850 [0,2,0,0,0,0|2,0,0]=4 3410 B22R2.6124616 CC(C)(O)CCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000702414 [0,2,0,0,0,0|2,0,0]=4 3411 B22R2.6124616 CC(C)(O)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000702414 [0,2,0,0,0,0|1,0,0]=3 3412 B22R2.6124616 CC(C)(O)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000702414 [0,2,0,0,0,0|1,0,0]=3 3413 B22R2.6124616 CC(C)(O)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000702414 [0,2,0,0,0,0|1,0,0]=3 3414 B22R2.6124616 CC(C)(O)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000702414 [0,2,0,0,0,0|1,0,0]=3 3415 B22R2.6124616 CS(=O)(=O)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000731031 [0,2,0,0,0,0|2,0,0]=4 3416 B22R2.6124616 CS(=O)(=O)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000230027 [0,2,0,0,0,0|2,0,0]=4 3417 B22R2.6124616 CS(=O)(=O)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000731031 [0,2,0,0,0,0|2,0,0]=4 3418 B22R2.6124616 CS(=O)(=O)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000230027 [0,2,0,0,0,0|2,0,0]=4 3419 B22R2.6124616 C[N+](C)(C)CCNC(c1ccccc1)c2cccc(c2)Br 270004a_100000106457_100011267660 [0,2,0,0,0,0|1,0,1]=4 3420 B22R2.6124616 C[N+](C)(C)CCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000085578 [0,2,0,0,0,0|1,0,1]=4 3421 B22R2.6124616 C[N+](C)(C)CCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000106457_100011215489 [0,2,0,0,0,0|1,0,1]=4 3422 B22R2.6124616 C[N+](C)(C)CCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000085578 [0,2,0,0,0,0|1,0,1]=4 3423 B22R2.6124616 C[N+](C)(C)CCNC(c1ccccc1)c2cccc(c2)F 270004a_100000106457_200011219850 [0,2,0,0,0,0|1,0,1]=4 3424 B22R2.6124616 C[N+](C)(C)CCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000085578 [0,2,0,0,0,0|1,0,1]=4 3425 B22R2.6124616 C[N+](C)(C)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000085578 [0,2,0,0,0,0|0,0,1]=3 3426 B22R2.6124616 C[N+](C)(C)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000085578 [0,2,0,0,0,0|0,0,1]=3 3427 B22R2.6124616 C[N+](C)(C)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000085578 [0,2,0,0,0,0|0,0,1]=3 3428 B22R2.6124616 C[N+](C)(C)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000085578 [0,2,0,0,0,0|0,0,1]=3 3429 B22R2.6124616 C[Si](C)(C)CCNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_200000733723 [0,2,0,0,0,0|2,0,0]=4 3430 B22R2.6124616 C[Si](C)(C)CCNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_200000733723 [0,2,0,0,0,0|2,0,0]=4 3431 B22R2.6124616 C[Si](C)(C)CCNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_200000733723 [0,2,0,0,0,0|2,0,0]=4 3432 B22R2.6124616 C[Si](C)(C)CCNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_200000733723 [0,2,0,0,0,0|2,0,0]=4 3433 B22R2.6124616 C[Si](C)(C)CCNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_200000733723 [0,2,0,0,0,0|2,0,0]=4 3434 B22R2.6124616 C[Si](C)(C)CCNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_200000733723 [0,2,0,0,0,0|2,0,0]=4 3435 B22R2.6124616 C[Si](C)(C)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_200000733723 [0,2,0,0,0,0|1,0,0]=3 3436 B22R2.6124616 C[Si](C)(C)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_200000733723 [0,2,0,0,0,0|1,0,0]=3 3437 B22R2.6124616 C[Si](C)(C)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_200000733723 [0,2,0,0,0,0|1,0,0]=3 3438 B22R2.6124616 C[Si](C)(C)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_200000733723 [0,2,0,0,0,0|1,0,0]=3 3439 B22R2.6124616 Cc1cccc(c1)C(NCCC(C)(C)C)c2ccccc2 270004a_100000738805_100011217825 [0,2,0,0,0,0|2,0,0]=4 3440 B22R2.6124616 Cc1cccc(c1)C(NCCC(C)(C)F)c2ccccc2 270004a_100016253952_100011217825 [0,2,0,0,0,0|2,0,0]=4 3441 B22R2.6124616 Cc1cccc(c1)C(NCCC(C)(C)O)c2ccccc2 270004a_100000707701_100011217825 [0,2,0,0,0,0|2,0,0]=4 3442 B22R2.6124616 Cc1cccc(c1)C(NCC[N+](C)(C)C)c2ccccc2 270004a_100000106457_100011217825 [0,2,0,0,0,0|1,0,1]=4 3443 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_100000731052 [0,2,0,0,0,0|2,0,0]=4 3444 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)Br 270004a_100000692259_100000718703 [0,2,0,0,0,0|2,0,0]=4 3445 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_100000731052 [0,2,0,0,0,0|2,0,0]=4 3446 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000692259_100000211669 [0,2,0,0,0,0|2,0,0]=4 3447 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_100000731052 [0,2,0,0,0,0|2,0,0]=4 3448 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000692259_100000211064 [0,2,0,0,0,0|2,0,0]=4 3449 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_100000731052 [0,2,0,0,0,0|2,0,0]=4 3450 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_100000731052 [0,2,0,0,0,0|2,0,0]=4 3451 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)F 270004a_100000692259_100000210425 [0,2,0,0,0,0|2,0,0]=4 3452 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_100000731052 [0,2,0,0,0,0|2,0,0]=4 3453 B22R2.130094 CC(C)CC(C)NC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_100000731052 [0,2,0,0,0,0|2,0,0]=4 3454 B22R2.130094 CC(C)CC(C)OC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000731052 [0,2,0,0,0,0|2,0,0]=4 3455 B22R2.130094 CC(C)CC(C)OC(c1ccc(cc1)Cl)c2ccccn2 7a_100000211805_200010188304 [0,2,0,0,0,0|2,0,0]=4 3456 B22R2.130094 CC(C)CC(C)OC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000731052 [0,2,0,0,0,0|1,0,0]=3 3457 B22R2.130094 CC(C)CC(C)OC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000731052 [0,2,0,0,0,0|1,0,0]=3 3458 B22R2.130094 CC(C)CC(C)OC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000731052 [0,2,0,0,0,0|1,0,0]=3 3459 B22R2.130094 CC(C)CC(C)OC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000731052 [0,2,0,0,0,0|1,0,0]=3 3460 B22R2.130094 CC(C)CC(C)OC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211805_100000211669 [0,2,0,0,0,0|1,0,0]=3 3461 B22R2.130094 CC(C)CC(C)OC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000731052 [0,2,0,0,0,0|1,0,0]=3 3462 B22R2.130094 CC(C)CC(C)OC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000731052 [0,2,0,0,0,0|1,0,0]=3 3463 B22R2.130094 CC(C)CC(C)OC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000731052 [0,2,0,0,0,0|1,0,0]=3 3464 B22R2.130094 CC(C)CC(C)OC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000731052 [0,2,0,0,0,0|1,0,0]=3 3465 B22R2.130094 CC(C)CC(C)OC(c1ccncc1)c2ccc(cc2)F 34a_100000748166_100000731052 [0,2,0,0,0,0|2,0,0]=4 3466 B22R2.130094 CC(CN(C)C)SC(c1ccc(cc1)Cl)c2ccccn2 62a_100020606517_200010188304 [0,2,0,0,0,0|1,1,0]=4 3467 B22R2.130094 CC(CN(C)C)SC(c1ccc(cc1)Cl)c2ccccn2 62a_200010188304_100020606517 [0,2,0,0,0,0|1,1,0]=4 3468 B22R2.130094 CC(CN(C)C)SC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100020606517 [0,2,0,0,0,0|0,1,0]=3 3469 B22R2.130094 CC(CN(C)C)SC(c1ccccc1)c2ccc(cc2)Cl 62a_100020606517_100000211669 [0,2,0,0,0,0|0,1,0]=3 3470 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)Br 11a_100000745999_100000750896 [0,2,0,0,0,0|1,0,1]=4 3471 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)Br 240690a_100000745999_100000750896 [0,2,0,0,0,0|1,0,1]=4 3472 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)Br 527a_100000745999_100000750896 [0,2,0,0,0,0|1,0,1]=4 3473 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)Cl 11a_100000737946_100000750896 [0,2,0,0,0,0|1,0,1]=4 3474 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)Cl 2230a_100102631434_100000694294 [0,2,0,0,0,0|1,0,1]=4 3475 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)Cl 240690a_100000737946_100000750896 [0,2,0,0,0,0|1,0,1]=4 3476 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)Cl 269982a_100102631434_100000694294 [0,2,0,0,0,0|1,0,1]=4 3477 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)Cl 527a_100000737946_100000750896 [0,2,0,0,0,0|1,0,1]=4 3478 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)F 11a_100000737529_100000750896 [0,2,0,0,0,0|1,0,1]=4 3479 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)F 240690a_100000737529_100000750896 [0,2,0,0,0,0|1,0,1]=4 3480 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)F 527a_100000737529_100000750896 [0,2,0,0,0,0|1,0,1]=4 3481 B22R2.130094 CN(C)CC(=O)NC(c1ccccc1)c2ccc(cc2)O 240690a_100000198503_100000750896 [0,2,0,0,0,0|1,0,1]=4 3482 B22R2.130094 Cc1ccc(cc1)C(NC(=O)CN(C)C)c2ccccc2 11a_100000736602_100000750896 [0,2,0,0,0,0|1,0,1]=4 3483 B22R2.130094 Cc1ccc(cc1)C(NC(=O)CN(C)C)c2ccccc2 240690a_100000736602_100000750896 [0,2,0,0,0,0|1,0,1]=4 3484 B22R2.130094 Cc1ccc(cc1)C(NC(=O)CN(C)C)c2ccccc2 527a_100000736602_100000750896 [0,2,0,0,0,0|1,0,1]=4 3485 B22R2.130094 Cc1ccc(cc1)C(NC(C)CC(C)C)c2ccccc2 2230a_100000736602_100000731052 [0,2,0,0,0,0|2,0,0]=4 3486 B22R2.130094 Cc1ccc(cc1)C(NC(C)CC(C)C)c2ccccc2 270004a_100000692259_100000210966 [0,2,0,0,0,0|2,0,0]=4 3487 B22R2.130094 Cc1ccc(cc1)C(NC(C)CC(C)C)c2ccccc2 34a_100000736602_100000731052 [0,2,0,0,0,0|2,0,0]=4 3488 B22R2.130094 Cc1ccc(cc1)C(OC(C)CC(C)C)c2ccccc2 34a_100000212064_100000731052 [0,2,0,0,0,0|1,0,0]=3 3489 B22R2.130094 Cc1ccc(cc1)C(OC(C)CC(C)C)c2ccccc2 7a_100000212064_100000731052 [0,2,0,0,0,0|1,0,0]=3 3490 B22R2.139526 CC(C)CC(C)NC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_100000731052 [0,2,0,0,0,0|2,0,0]=4 3491 B22R2.139526 CC(C)CC(C)NC(c1ccccc1)c2cccc(c2)Br 270004a_100000692259_100011267660 [0,2,0,0,0,0|2,0,0]=4 3492 B22R2.139526 CC(C)CC(C)NC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_100000731052 [0,2,0,0,0,0|2,0,0]=4 3493 B22R2.139526 CC(C)CC(C)NC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100000731052 [0,2,0,0,0,0|2,0,0]=4 3494 B22R2.139526 CC(C)CC(C)NC(c1ccccc1)c2cccc(c2)Cl 270004a_100000692259_100011215489 [0,2,0,0,0,0|2,0,0]=4 3495 B22R2.139526 CC(C)CC(C)NC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100000731052 [0,2,0,0,0,0|2,0,0]=4 3496 B22R2.139526 CC(C)CC(C)NC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_100000731052 [0,2,0,0,0,0|2,0,0]=4 3497 B22R2.139526 CC(C)CC(C)NC(c1ccccc1)c2cccc(c2)F 270004a_100000692259_200011219850 [0,2,0,0,0,0|2,0,0]=4 3498 B22R2.139526 CC(C)CC(C)NC(c1ccccc1)c2cccc(c2)F 34a_100000686443_100000731052 [0,2,0,0,0,0|2,0,0]=4 3499 B22R2.139526 CC(C)CC(C)OC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000731052 [0,2,0,0,0,0|1,0,0]=3 3500 B22R2.139526 CC(C)CC(C)OC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000731052 [0,2,0,0,0,0|1,0,0]=3 3501 B22R2.139526 CC(C)CC(C)OC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000731052 [0,2,0,0,0,0|1,0,0]=3 3502 B22R2.139526 CC(C)CC(C)OC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000731052 [0,2,0,0,0,0|1,0,0]=3 3503 B22R2.139526 CN(C)CC(=O)NC(c1ccccc1)c2cccc(c2)Br 11a_100011212009_100000750896 [0,2,0,0,0,0|1,0,1]=4 3504 B22R2.139526 CN(C)CC(=O)NC(c1ccccc1)c2cccc(c2)Br 240690a_100011212009_100000750896 [0,2,0,0,0,0|1,0,1]=4 3505 B22R2.139526 CN(C)CC(=O)NC(c1ccccc1)c2cccc(c2)Br 527a_100011212009_100000750896 [0,2,0,0,0,0|1,0,1]=4 3506 B22R2.139526 CN(C)CC(=O)NC(c1ccccc1)c2cccc(c2)Cl 11a_100000741085_100000750896 [0,2,0,0,0,0|1,0,1]=4 3507 B22R2.139526 CN(C)CC(=O)NC(c1ccccc1)c2cccc(c2)Cl 240690a_100000741085_100000750896 [0,2,0,0,0,0|1,0,1]=4 3508 B22R2.139526 CN(C)CC(=O)NC(c1ccccc1)c2cccc(c2)Cl 527a_100000741085_100000750896 [0,2,0,0,0,0|1,0,1]=4 3509 B22R2.139526 CN(C)CC(=O)NC(c1ccccc1)c2cccc(c2)F 11a_100000686443_100000750896 [0,2,0,0,0,0|1,0,1]=4 3510 B22R2.139526 CN(C)CC(=O)NC(c1ccccc1)c2cccc(c2)F 240690a_100000686443_100000750896 [0,2,0,0,0,0|1,0,1]=4 3511 B22R2.139526 CN(C)CC(=O)NC(c1ccccc1)c2cccc(c2)F 527a_100000686443_100000750896 [0,2,0,0,0,0|1,0,1]=4 3512 B22R2.139526 Cc1cccc(c1)C(NC(C)CC(C)C)c2ccccc2 270004a_100000692259_100011217825 [0,2,0,0,0,0|2,0,0]=4 3513 B22R2.201487 CC(C)CC(C)NC(c1ccccc1)c2ccccc2Br 2230a_100011211563_100000731052 [0,2,0,0,0,0|2,0,0]=4 3514 B22R2.201487 CC(C)CC(C)NC(c1ccccc1)c2ccccc2Br 270004a_100000692259_100000198044 [0,2,0,0,0,0|2,0,0]=4 3515 B22R2.201487 CC(C)CC(C)NC(c1ccccc1)c2ccccc2Br 34a_100011211563_100000731052 [0,2,0,0,0,0|2,0,0]=4 3516 B22R2.201487 CC(C)CC(C)NC(c1ccccc1)c2ccccc2Cl 270004a_100000692259_100011215288 [0,2,0,0,0,0|2,0,0]=4 3517 B22R2.201487 CC(C)CC(C)NC(c1ccccc1)c2ccccc2F 270004a_100000692259_100011217773 [0,2,0,0,0,0|2,0,0]=4 3518 B22R2.201487 CC(C)CC(C)OC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000731052 [0,2,0,0,0,0|1,0,0]=3 3519 B22R2.201487 CC(C)CC(C)OC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000731052 [0,2,0,0,0,0|1,0,0]=3 3520 B22R2.201487 CC(C)CC(C)OC(c1ccccc1)c2ccccc2N 34a_100000246470_100000731052 [0,2,0,0,0,0|1,0,0]=3 3521 B22R2.201487 CC(C)CC(C)OC(c1ccccc1)c2ccccc2N 7a_100000246470_100000731052 [0,2,0,0,0,0|1,0,0]=3 3522 B22R2.201487 CN(C)CC(=O)NC(c1ccccc1)c2ccccc2Br 11a_100011211563_100000750896 [0,2,0,0,0,0|1,0,1]=4 3523 B22R2.201487 CN(C)CC(=O)NC(c1ccccc1)c2ccccc2Br 240690a_100011211563_100000750896 [0,2,0,0,0,0|1,0,1]=4 3524 B22R2.201487 CN(C)CC(=O)NC(c1ccccc1)c2ccccc2Br 527a_100011211563_100000750896 [0,2,0,0,0,0|1,0,1]=4 3525 B22R2.201487 Cc1ccccc1C(NC(=O)CN(C)C)c2ccccc2 11a_100000222801_100000750896 [0,2,0,0,0,0|1,0,1]=4 3526 B22R2.201487 Cc1ccccc1C(NC(=O)CN(C)C)c2ccccc2 240690a_100000222801_100000750896 [0,2,0,0,0,0|1,0,1]=4 3527 B22R2.201487 Cc1ccccc1C(NC(=O)CN(C)C)c2ccccc2 527a_100000222801_100000750896 [0,2,0,0,0,0|1,0,1]=4 3528 B22R2.201487 Cc1ccccc1C(NC(C)CC(C)C)c2ccccc2 2230a_100000222801_100000731052 [0,2,0,0,0,0|2,0,0]=4 3529 B22R2.201487 Cc1ccccc1C(NC(C)CC(C)C)c2ccccc2 2230a_100000692259_100000230135 [0,2,0,0,0,0|2,0,0]=4 3530 B22R2.201487 Cc1ccccc1C(NC(C)CC(C)C)c2ccccc2 270004a_100000692259_100000735561 [0,2,0,0,0,0|2,0,0]=4 3531 B22R2.201487 Cc1ccccc1C(NC(C)CC(C)C)c2ccccc2 34a_100000222801_100000731052 [0,2,0,0,0,0|2,0,0]=4 3532 B22R2.201487 Cc1ccccc1C(OC(C)CC(C)C)c2ccccc2 34a_100000212071_100000731052 [0,2,0,0,0,0|1,0,0]=3 3533 B22R2.201487 Cc1ccccc1C(OC(C)CC(C)C)c2ccccc2 7a_100000211805_100000230135 [0,2,0,0,0,0|1,0,0]=3 3534 B22R2.201487 Cc1ccccc1C(OC(C)CC(C)C)c2ccccc2 7a_100000212071_100000731052 [0,2,0,0,0,0|1,0,0]=3 3535 B22R2.201487 Cc1ccccc1C(SC(C)CN(C)C)c2ccccc2 62a_100000230135_100020606517 [0,2,0,0,0,0|0,1,0]=3 3536 B22R2.201487 Cc1ccccc1C(SC(C)CN(C)C)c2ccccc2 62a_100020606517_100000230135 [0,2,0,0,0,0|0,1,0]=3 3537 B22R2.355155 CC(C)CC(C)C(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000731052 [0,2,0,0,0,0|2,0,0]=4 3538 B22R2.355155 CC(C)CC(C)N(C)C(c1ccccc1)c2ccccc2 2230a_100000745462_100000211591 [0,2,0,0,0,0|2,0,0]=4 3539 B22R2.355155 CC(C)CC(C)N(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000731052 [0,2,0,0,0,0|2,0,0]=4 3540 B22R2.355155 CC(C)CC(C)N(C)C(c1ccccc1)c2ccccc2 269982a_100000745462_100000211591 [0,2,0,0,0,0|2,0,0]=4 3541 B22R2.355155 CC(C)CC(C)N(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000731052 [0,2,0,0,0,0|2,0,0]=4 3542 B22R2.355155 CC(C)CC(C)N(C)C(c1ccccc1)c2ccccc2 270004a_100000745462_100000210122 [0,2,0,0,0,0|2,0,0]=4 3543 B22R2.355155 CC(C)C[C@H](O)C(=O)C(c1ccccc1)c2ccccc2 1458a_100012027011_100011216954 [0,2,0,0,0,0|2,0,0]=4 3544 B22R2.355155 CC(CN(C)C)C(=O)C(c1ccccc1)c2ccccc2 1458a_200015186601_100011216954 [0,2,0,0,0,0|1,0,0]=3 3545 B22R2.355155 CC(CN(C)C)N(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100020606517 [0,2,0,0,0,0|1,0,0]=3 3546 B22R2.355155 CN(C)CC(=O)N(C)C(c1ccccc1)c2ccccc2 11a_100103148541_100000750896 [0,2,0,0,0,0|1,0,1]=4 3547 B22R2.355155 CN(C)CC(=O)N(C)C(c1ccccc1)c2ccccc2 240690a_100103148541_100000750896 [0,2,0,0,0,0|1,0,1]=4 3548 B22R2.357542 CC(=O)CC(C)(C)OC(c1ccccc1)c2ccccc2 7a_100000210262_100011216954 [0,2,0,0,0,0|2,0,0]=4 3549 B22R2.357542 CC(C)CC(C)(C)NC(c1ccccc1)c2ccccc2 2230a_100011346068_100000211591 [0,2,0,0,0,0|2,0,0]=4 3550 B22R2.357542 CC(C)CC(C)(C)NC(c1ccccc1)c2ccccc2 270004a_100011346068_100000210122 [0,2,0,0,0,0|2,0,0]=4 3551 B22R2.357542 CN(C)CC(C)(C)NC(c1ccccc1)c2ccccc2 2230a_100015183317_100000211591 [0,2,0,0,0,0|1,0,0]=3 3552 B22R2.357744 CC(C)CC(C)OC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000731052 [0,2,0,0,0,0|1,0,0]=3 3553 B22R2.357744 CC(C)CC(C)OC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000731052 [0,2,0,0,0,0|2,0,0]=4 3554 B22R2.744714 C#CC(CC(C)C)OC(c1ccccc1)c2ccccc2 7a_100011215986_100011216954 [0,2,0,0,0,0|1,0,0]=3 3555 B22R2.744714 C=CC(CC(C)C)OC(c1ccccc1)c2ccccc2 7a_100012186643_100011216954 [0,2,0,0,0,0|1,0,0]=3 3556 B22R2.744714 CC(C)CC(C#N)NC(c1ccccc1)c2ccccc2 2230a_100000741378_100000211591 [0,2,0,0,0,0|2,0,0]=4 3557 B22R2.744714 CC(C)CC(C#N)NC(c1ccccc1)c2ccccc2 270004a_100000741378_100000210122 [0,2,0,0,0,0|2,0,0]=4 3558 B22R2.744714 CC(C)CC(C#N)OC(c1ccccc1)c2ccccc2 7a_200011294978_100011216954 [0,2,0,0,0,0|1,0,0]=3 3559 B22R2.744714 CC(C)C[C@@H](CO)NC(c1ccccc1)c2ccccc2 2230a_100011830311_100000211591 [0,2,0,0,0,0|2,0,0]=4 3560 B22R2.744714 CC(C)C[C@@H](CO)NC(c1ccccc1)c2ccccc2 270004a_100011830311_100000210122 [0,2,0,0,0,0|2,0,0]=4 3561 B22R2.74694 C=C(C)CCOC(c1ccccc1)c2cccc(c2)OC 34a_200017279661_100000730704 [0,2,0,0,0,0|1,0,1]=4 3562 B22R2.74694 C=C(C)CCOC(c1ccccc1)c2cccc(c2)OC 7a_200017279661_100000730704 [0,2,0,0,0,0|1,0,1]=4 3563 B22R2.74694 CCc1cccc(c1)C(NCCC(C)C)c2ccccc2 270004a_100000210545_100012339983 [0,2,0,0,0,0|2,0,0]=4 3564 B22R2.74694 CCc1cccc(c1)C(NCCN(C)C)c2ccccc2 270004a_100000210585_100012339983 [0,2,0,0,0,0|1,0,0]=3 3565 B22R2.74694 COc1cccc(c1)C(NCCC(C)C)c2ccccc2 2230a_100000296159_100000210312 [0,2,0,0,0,0|2,0,0]=4 3566 B22R2.74694 COc1cccc(c1)C(NCCC(C)C)c2ccccc2 269862a_100000296159_100000185833 [0,2,0,0,0,0|2,0,0]=4 3567 B22R2.74694 COc1cccc(c1)C(NCCC(C)C)c2ccccc2 34a_100000296159_100000210312 [0,2,0,0,0,0|2,0,0]=4 3568 B22R2.74694 COc1cccc(c1)C(NCCN(C)C)c2ccccn2 270004a_100000210585_100011350569 [0,2,0,0,0,0|2,0,0]=4 3569 B22R2.74694 COc1cccc(c1)C(OCC=C(C)C)c2ccccc2 34a_200017279661_100000761012 [0,2,0,0,0,0|1,0,1]=4 3570 B22R2.74694 COc1cccc(c1)C(OCC=C(C)C)c2ccccc2 7a_200017279661_100000761012 [0,2,0,0,0,0|1,0,1]=4 3571 B22R2.74694 COc1cccc(c1)C(OCCC(=O)C)c2ccccc2 7a_200017279661_100000053229 [0,2,0,0,0,0|2,0,0]=4 3572 B22R2.74694 COc1cccc(c1)C(OCCC(C)C)c2ccccc2 34a_200017279661_100000210312 [0,2,0,0,0,0|1,0,0]=3 3573 B22R2.74694 COc1cccc(c1)C(OCCC(C)C)c2ccccc2 7a_200017279661_100000210626 [0,2,0,0,0,0|1,0,0]=3 3574 B22R2.74694 COc1cccc(c1)C(OCCC(C)O)c2ccccc2 34a_200017279661_100012276601 [0,2,0,0,0,0|2,0,0]=4 3575 B22R2.74694 COc1cccc(c1)C(OCCC(C)O)c2ccccc2 7a_200017279661_100012276601 [0,2,0,0,0,0|2,0,0]=4 3576 B22R2.74694 COc1cccc(c1)C(OCCN(C)C)c2ccccc2 7a_200017279661_100000755713 [0,2,0,0,0,0|0,0,0]=2 3577 B22R2.74694 COc1cccc(c1)C(OCOC(C)C)c2ccccc2 34a_200017279661_100000709892 [0,2,0,0,0,0|2,0,0]=4 3578 B22R2.127670 C=C(C)CCOC(c1ccccc1)c2cc(cc(c2)F)F 34a_200005489329_100000730704 [0,2,0,0,0,0|1,0,1]=4 3579 B22R2.127670 C=C(C)CCOC(c1ccccc1)c2cc(cc(c2)F)F 7a_200005489329_100000730704 [0,2,0,0,0,0|1,0,1]=4 3580 B22R2.127670 CC(=CCOC(c1ccccc1)c2cc(cc(c2)F)F)C 34a_200005489329_100000761012 [0,2,0,0,0,0|1,0,1]=4 3581 B22R2.127670 CC(=CCOC(c1ccccc1)c2cc(cc(c2)F)F)C 7a_200005489329_100000761012 [0,2,0,0,0,0|1,0,1]=4 3582 B22R2.127670 CC(=O)CCOC(c1ccccc1)c2cc(cc(c2)Cl)Cl 7a_200005489336_100000053229 [0,2,0,0,0,0|2,0,0]=4 3583 B22R2.127670 CC(=O)CCOC(c1ccccc1)c2cc(cc(c2)F)F 7a_200005489329_100000053229 [0,2,0,0,0,0|2,0,0]=4 3584 B22R2.127670 CC(C)CCNC(c1ccccc1)c2cc(cc(c2)F)F 270004a_100000210545_100011218726 [0,2,0,0,0,0|2,0,0]=4 3585 B22R2.127670 CC(C)CCOC(c1ccccc1)c2cc(cc(c2)F)F 34a_200005489329_100000210312 [0,2,0,0,0,0|1,0,0]=3 3586 B22R2.127670 CC(C)CCOC(c1ccccc1)c2cc(cc(c2)F)F 7a_200005489329_100000210626 [0,2,0,0,0,0|1,0,0]=3 3587 B22R2.127670 CC(C)OCOC(c1ccccc1)c2cc(cc(c2)Cl)Cl 34a_200005489336_100000709892 [0,2,0,0,0,0|2,0,0]=4 3588 B22R2.127670 CC(C)OCOC(c1ccccc1)c2cc(cc(c2)F)F 34a_200005489329_100000709892 [0,2,0,0,0,0|2,0,0]=4 3589 B22R2.127670 CC(O)CCOC(c1ccccc1)c2cc(cc(c2)Cl)Cl 34a_200005489336_100012276601 [0,2,0,0,0,0|2,0,0]=4 3590 B22R2.127670 CC(O)CCOC(c1ccccc1)c2cc(cc(c2)Cl)Cl 7a_200005489336_100012276601 [0,2,0,0,0,0|2,0,0]=4 3591 B22R2.127670 CC(O)CCOC(c1ccccc1)c2cc(cc(c2)F)F 34a_200005489329_100012276601 [0,2,0,0,0,0|2,0,0]=4 3592 B22R2.127670 CC(O)CCOC(c1ccccc1)c2cc(cc(c2)F)F 7a_200005489329_100012276601 [0,2,0,0,0,0|2,0,0]=4 3593 B22R2.127670 CN(C)CCNC(c1ccccc1)c2cc(cc(c2)F)F 270004a_100000210585_100011218726 [0,2,0,0,0,0|1,0,0]=3 3594 B22R2.127670 CN(C)CCOC(c1ccccc1)c2cc(cc(c2)Cl)Cl 7a_200005489336_100000755713 [0,2,0,0,0,0|0,0,0]=2 3595 B22R2.127670 CN(C)CCOC(c1ccccc1)c2cc(cc(c2)F)F 7a_200005489329_100000755713 [0,2,0,0,0,0|0,0,0]=2 3596 B22R2.140050 C=C(C)CCOC(c1cccc(c1)F)c2cccc(c2)F 34a_200000373135_100000730704 [0,2,0,0,0,0|1,0,1]=4 3597 B22R2.140050 C=C(C)CCOC(c1cccc(c1)F)c2cccc(c2)F 7a_200000373135_100000730704 [0,2,0,0,0,0|1,0,1]=4 3598 B22R2.140050 CC(=CCOC(c1cccc(c1)F)c2cccc(c2)F)C 34a_200000373135_100000761012 [0,2,0,0,0,0|1,0,1]=4 3599 B22R2.140050 CC(=CCOC(c1cccc(c1)F)c2cccc(c2)F)C 7a_200000373135_100000761012 [0,2,0,0,0,0|1,0,1]=4 3600 B22R2.140050 CC(=O)CCOC(c1cccc(c1)Cl)c2cccc(c2)Cl 7a_200005570840_100000053229 [0,2,0,0,0,0|2,0,0]=4 3601 B22R2.140050 CC(=O)CCOC(c1cccc(c1)F)c2cccc(c2)F 7a_200000373135_100000053229 [0,2,0,0,0,0|2,0,0]=4 3602 B22R2.140050 CC(C)CCNC(c1cccc(c1)Br)c2cccc(c2)Br 270004a_100000210545_100010704256 [0,2,0,0,0,0|2,0,0]=4 3603 B22R2.140050 CC(C)CCNC(c1cccc(c1)Cl)c2cccc(c2)Cl 270004a_100000210545_200011553226 [0,2,0,0,0,0|2,0,0]=4 3604 B22R2.140050 CC(C)CCNC(c1cccc(c1)F)c2cccc(c2)Br 270004a_100000210545_100000687359 [0,2,0,0,0,0|2,0,0]=4 3605 B22R2.140050 CC(C)CCNC(c1cccc(c1)F)c2cccc(c2)F 270004a_100000210545_100011215574 [0,2,0,0,0,0|2,0,0]=4 3606 B22R2.140050 CC(C)CCOC(c1cccc(c1)F)c2cccc(c2)F 34a_200000373135_100000210312 [0,2,0,0,0,0|1,0,0]=3 3607 B22R2.140050 CC(C)CCOC(c1cccc(c1)F)c2cccc(c2)F 7a_200000373135_100000210626 [0,2,0,0,0,0|1,0,0]=3 3608 B22R2.140050 CC(C)OCOC(c1cccc(c1)Cl)c2cccc(c2)Cl 34a_200005570840_100000709892 [0,2,0,0,0,0|2,0,0]=4 3609 B22R2.140050 CC(C)OCOC(c1cccc(c1)F)c2cccc(c2)F 34a_200000373135_100000709892 [0,2,0,0,0,0|2,0,0]=4 3610 B22R2.140050 CC(O)CCOC(c1cccc(c1)Cl)c2cccc(c2)Cl 34a_200005570840_100012276601 [0,2,0,0,0,0|2,0,0]=4 3611 B22R2.140050 CC(O)CCOC(c1cccc(c1)Cl)c2cccc(c2)Cl 7a_200005570840_100012276601 [0,2,0,0,0,0|2,0,0]=4 3612 B22R2.140050 CC(O)CCOC(c1cccc(c1)F)c2cccc(c2)F 34a_200000373135_100012276601 [0,2,0,0,0,0|2,0,0]=4 3613 B22R2.140050 CC(O)CCOC(c1cccc(c1)F)c2cccc(c2)F 7a_200000373135_100012276601 [0,2,0,0,0,0|2,0,0]=4 3614 B22R2.140050 CN(C)CCNC(c1cccc(c1)Br)c2cccc(c2)Br 270004a_100000210585_100010704256 [0,2,0,0,0,0|1,0,0]=3 3615 B22R2.140050 CN(C)CCNC(c1cccc(c1)Cl)c2cccc(c2)Cl 270004a_100000210585_200011553226 [0,2,0,0,0,0|1,0,0]=3 3616 B22R2.140050 CN(C)CCNC(c1cccc(c1)F)c2cccc(c2)Br 270004a_100000210585_100000687359 [0,2,0,0,0,0|1,0,0]=3 3617 B22R2.140050 CN(C)CCNC(c1cccc(c1)F)c2cccc(c2)F 270004a_100000210585_100011215574 [0,2,0,0,0,0|1,0,0]=3 3618 B22R2.140050 CN(C)CCOC(c1cccc(c1)Cl)c2cccc(c2)Cl 7a_200005570840_100000755713 [0,2,0,0,0,0|0,0,0]=2 3619 B22R2.140050 CN(C)CCOC(c1cccc(c1)F)c2cccc(c2)F 7a_200000373135_100000755713 [0,2,0,0,0,0|0,0,0]=2 3620 B22R2.146937 C=C(C)CCOC(c1ccccc1)c2cc(ccc2N)Cl 34a_100000011915_100000730704 [0,2,0,0,0,0|1,0,1]=4 3621 B22R2.146937 C=C(C)CCOC(c1ccccc1)c2cc(ccc2N)Cl 7a_100000011915_100000730704 [0,2,0,0,0,0|1,0,1]=4 3622 B22R2.146937 CC(=CCOC(c1ccccc1)c2cc(ccc2N)Cl)C 34a_100000011915_100000761012 [0,2,0,0,0,0|1,0,1]=4 3623 B22R2.146937 CC(=CCOC(c1ccccc1)c2cc(ccc2N)Cl)C 7a_100000011915_100000761012 [0,2,0,0,0,0|1,0,1]=4 3624 B22R2.146937 CC(=O)CCOC(c1ccccc1)c2cc(ccc2N)Cl 7a_100000011915_100000053229 [0,2,0,0,0,0|2,0,0]=4 3625 B22R2.146937 CC(C)CCNC(c1ccccc1)c2cc(ccc2Cl)Cl 270004a_100000210545_100000699483 [0,2,0,0,0,0|2,0,0]=4 3626 B22R2.146937 CC(C)CCNC(c1ccccc1)c2cc(ccc2F)F 270004a_100000210545_100011217027 [0,2,0,0,0,0|2,0,0]=4 3627 B22R2.146937 CC(C)CCOC(c1ccccc1)c2cc(ccc2N)Cl 34a_100000011915_100000210312 [0,2,0,0,0,0|1,0,0]=3 3628 B22R2.146937 CC(C)CCOC(c1ccccc1)c2cc(ccc2N)Cl 7a_100000011915_100000210626 [0,2,0,0,0,0|1,0,0]=3 3629 B22R2.146937 CC(C)OCOC(c1ccccc1)c2cc(ccc2N)Cl 34a_100000011915_100000709892 [0,2,0,0,0,0|2,0,0]=4 3630 B22R2.146937 CC(O)CCOC(c1ccccc1)c2cc(ccc2N)Cl 34a_100000011915_100012276601 [0,2,0,0,0,0|2,0,0]=4 3631 B22R2.146937 CC(O)CCOC(c1ccccc1)c2cc(ccc2N)Cl 7a_100000011915_100012276601 [0,2,0,0,0,0|2,0,0]=4 3632 B22R2.146937 CN(C)CCNC(c1ccccc1)c2cc(ccc2Cl)Cl 270004a_100000210585_100000699483 [0,2,0,0,0,0|1,0,0]=3 3633 B22R2.146937 CN(C)CCNC(c1ccccc1)c2cc(ccc2F)F 270004a_100000210585_100011217027 [0,2,0,0,0,0|1,0,0]=3 3634 B22R2.146937 CN(C)CCOC(c1ccccc1)c2cc(ccc2N)Cl 7a_100000011915_100000755713 [0,2,0,0,0,0|0,0,0]=2 3635 B22R2.305463 CC(C)CCN(C)C(c1ccccc1)c2cccc(c2)Br 270004a_100000742789_100011267660 [0,2,0,0,0,0|2,0,0]=4 3636 B22R2.305463 CC(C)CCN(C)C(c1ccccc1)c2cccc(c2)Cl 270004a_100000742789_100011215489 [0,2,0,0,0,0|2,0,0]=4 3637 B22R2.305463 CC(C)CCN(C)C(c1ccccc1)c2cccc(c2)F 270004a_100000742789_200011219850 [0,2,0,0,0,0|2,0,0]=4 3638 B22R2.305463 CN(C)CCN(C)C(c1cccc(c1)Cl)c2ccccn2 270004a_100000225618_100000688346 [0,2,0,0,0,0|2,0,0]=4 3639 B22R2.305463 CN(C)CCN(C)C(c1ccccc1)c2cccc(c2)Br 270004a_100000225618_100011267660 [0,2,0,0,0,0|1,0,0]=3 3640 B22R2.305463 CN(C)CCN(C)C(c1ccccc1)c2cccc(c2)Cl 270004a_100000225618_100011215489 [0,2,0,0,0,0|1,0,0]=3 3641 B22R2.305463 CN(C)CCN(C)C(c1ccccc1)c2cccc(c2)F 270004a_100000225618_200011219850 [0,2,0,0,0,0|1,0,0]=3 3642 B22R2.305463 CN(C)CCN(C)C(c1ccccc1)c2cncc(c2)Br 270004a_100000225618_100011267668 [0,2,0,0,0,0|2,0,0]=4 3643 B22R2.305463 CN(C)CCN(C)C(c1cccnc1)c2cccc(c2)Cl 270004a_100000225618_100000752423 [0,2,0,0,0,0|2,0,0]=4 3644 B22R2.305463 Cc1cccc(c1)C(c2ccccc2)N(C)CCC(C)C 270004a_100000742789_100011217825 [0,2,0,0,0,0|2,0,0]=4 3645 B22R2.305463 Cc1cccc(c1)C(c2ccccc2)N(C)CCN(C)C 270004a_100000225618_100011217825 [0,2,0,0,0,0|1,0,0]=3 3646 B22R2.518918 C=C(C)CCOC(c1ccc(cc1)Br)c2cccc(c2)F 34a_200000373125_100000730704 [0,2,0,0,0,0|1,0,1]=4 3647 B22R2.518918 C=C(C)CCOC(c1ccc(cc1)Br)c2cccc(c2)F 7a_200000373125_100000730704 [0,2,0,0,0,0|1,0,1]=4 3648 B22R2.518918 C=C(C)CCOC(c1ccc(cc1)Cl)c2cccc(c2)F 34a_200000373141_100000730704 [0,2,0,0,0,0|1,0,1]=4 3649 B22R2.518918 C=C(C)CCOC(c1ccc(cc1)Cl)c2cccc(c2)F 7a_200000373141_100000730704 [0,2,0,0,0,0|1,0,1]=4 3650 B22R2.518918 C=C(C)CCOC(c1ccc(cc1)F)c2cccc(c2)Br 34a_200000373208_100000730704 [0,2,0,0,0,0|1,0,1]=4 3651 B22R2.518918 C=C(C)CCOC(c1ccc(cc1)F)c2cccc(c2)Br 7a_200000373208_100000730704 [0,2,0,0,0,0|1,0,1]=4 3652 B22R2.518918 C=C(C)CCOC(c1ccc(cc1)F)c2cccc(c2)Cl 34a_200000373149_100000730704 [0,2,0,0,0,0|1,0,1]=4 3653 B22R2.518918 C=C(C)CCOC(c1ccc(cc1)F)c2cccc(c2)Cl 7a_200000373149_100000730704 [0,2,0,0,0,0|1,0,1]=4 3654 B22R2.518918 CC(=CCOC(c1ccc(cc1)Br)c2cccc(c2)F)C 34a_200000373125_100000761012 [0,2,0,0,0,0|1,0,1]=4 3655 B22R2.518918 CC(=CCOC(c1ccc(cc1)Br)c2cccc(c2)F)C 7a_200000373125_100000761012 [0,2,0,0,0,0|1,0,1]=4 3656 B22R2.518918 CC(=CCOC(c1ccc(cc1)Cl)c2cccc(c2)F)C 34a_200000373141_100000761012 [0,2,0,0,0,0|1,0,1]=4 3657 B22R2.518918 CC(=CCOC(c1ccc(cc1)Cl)c2cccc(c2)F)C 7a_200000373141_100000761012 [0,2,0,0,0,0|1,0,1]=4 3658 B22R2.518918 CC(=CCOC(c1ccc(cc1)F)c2cccc(c2)Br)C 34a_200000373208_100000761012 [0,2,0,0,0,0|1,0,1]=4 3659 B22R2.518918 CC(=CCOC(c1ccc(cc1)F)c2cccc(c2)Br)C 7a_200000373208_100000761012 [0,2,0,0,0,0|1,0,1]=4 3660 B22R2.518918 CC(=CCOC(c1ccc(cc1)F)c2cccc(c2)Cl)C 34a_200000373149_100000761012 [0,2,0,0,0,0|1,0,1]=4 3661 B22R2.518918 CC(=CCOC(c1ccc(cc1)F)c2cccc(c2)Cl)C 7a_200000373149_100000761012 [0,2,0,0,0,0|1,0,1]=4 3662 B22R2.518918 CC(=O)CCOC(c1ccc(cc1)Br)c2cccc(c2)F 7a_200000373125_100000053229 [0,2,0,0,0,0|2,0,0]=4 3663 B22R2.518918 CC(=O)CCOC(c1ccc(cc1)Cl)c2cccc(c2)F 7a_200000373141_100000053229 [0,2,0,0,0,0|2,0,0]=4 3664 B22R2.518918 CC(=O)CCOC(c1ccc(cc1)F)c2cccc(c2)Br 7a_200000373208_100000053229 [0,2,0,0,0,0|2,0,0]=4 3665 B22R2.518918 CC(=O)CCOC(c1ccc(cc1)F)c2cccc(c2)Cl 7a_200000373149_100000053229 [0,2,0,0,0,0|2,0,0]=4 3666 B22R2.518918 CC(C)CCNC(c1ccc(cc1)Br)c2cccc(c2)F 2230a_200000296200_100000210312 [0,2,0,0,0,0|2,0,0]=4 3667 B22R2.518918 CC(C)CCNC(c1ccc(cc1)Br)c2cccc(c2)F 269862a_200000296200_100000185833 [0,2,0,0,0,0|2,0,0]=4 3668 B22R2.518918 CC(C)CCNC(c1ccc(cc1)Br)c2cccc(c2)F 34a_200000296200_100000210312 [0,2,0,0,0,0|2,0,0]=4 3669 B22R2.518918 CC(C)CCNC(c1ccc(cc1)Cl)c2cccc(c2)Cl 270004a_100000210545_200011267713 [0,2,0,0,0,0|2,0,0]=4 3670 B22R2.518918 CC(C)CCNC(c1ccc(cc1)F)c2cccc(c2)Br 270004a_100000210545_200011267472 [0,2,0,0,0,0|2,0,0]=4 3671 B22R2.518918 CC(C)CCNC(c1ccc(cc1)F)c2cccc(c2)F 270004a_100000210545_100000185714 [0,2,0,0,0,0|2,0,0]=4 3672 B22R2.518918 CC(C)CCOC(c1ccc(cc1)Br)c2cccc(c2)F 34a_200000373125_100000210312 [0,2,0,0,0,0|1,0,0]=3 3673 B22R2.518918 CC(C)CCOC(c1ccc(cc1)Br)c2cccc(c2)F 7a_200000373125_100000210626 [0,2,0,0,0,0|1,0,0]=3 3674 B22R2.518918 CC(C)CCOC(c1ccc(cc1)Cl)c2cccc(c2)F 34a_200000373141_100000210312 [0,2,0,0,0,0|1,0,0]=3 3675 B22R2.518918 CC(C)CCOC(c1ccc(cc1)Cl)c2cccc(c2)F 7a_200000373141_100000210626 [0,2,0,0,0,0|1,0,0]=3 3676 B22R2.518918 CC(C)CCOC(c1ccc(cc1)F)c2cccc(c2)Br 34a_200000373208_100000210312 [0,2,0,0,0,0|1,0,0]=3 3677 B22R2.518918 CC(C)CCOC(c1ccc(cc1)F)c2cccc(c2)Br 7a_200000373208_100000210626 [0,2,0,0,0,0|1,0,0]=3 3678 B22R2.518918 CC(C)CCOC(c1ccc(cc1)F)c2cccc(c2)Cl 34a_200000373149_100000210312 [0,2,0,0,0,0|1,0,0]=3 3679 B22R2.518918 CC(C)CCOC(c1ccc(cc1)F)c2cccc(c2)Cl 7a_200000373149_100000210626 [0,2,0,0,0,0|1,0,0]=3 3680 B22R2.518918 CC(C)OCOC(c1ccc(cc1)Br)c2cccc(c2)F 34a_200000373125_100000709892 [0,2,0,0,0,0|2,0,0]=4 3681 B22R2.518918 CC(C)OCOC(c1ccc(cc1)Cl)c2cccc(c2)F 34a_200000373141_100000709892 [0,2,0,0,0,0|2,0,0]=4 3682 B22R2.518918 CC(C)OCOC(c1ccc(cc1)F)c2cccc(c2)Br 34a_200000373208_100000709892 [0,2,0,0,0,0|2,0,0]=4 3683 B22R2.518918 CC(C)OCOC(c1ccc(cc1)F)c2cccc(c2)Cl 34a_200000373149_100000709892 [0,2,0,0,0,0|2,0,0]=4 3684 B22R2.518918 CC(O)CCOC(c1ccc(cc1)Br)c2cccc(c2)F 34a_200000373125_100012276601 [0,2,0,0,0,0|2,0,0]=4 3685 B22R2.518918 CC(O)CCOC(c1ccc(cc1)Br)c2cccc(c2)F 7a_200000373125_100012276601 [0,2,0,0,0,0|2,0,0]=4 3686 B22R2.518918 CC(O)CCOC(c1ccc(cc1)Cl)c2cccc(c2)F 34a_200000373141_100012276601 [0,2,0,0,0,0|2,0,0]=4 3687 B22R2.518918 CC(O)CCOC(c1ccc(cc1)Cl)c2cccc(c2)F 7a_200000373141_100012276601 [0,2,0,0,0,0|2,0,0]=4 3688 B22R2.518918 CC(O)CCOC(c1ccc(cc1)F)c2cccc(c2)Br 34a_200000373208_100012276601 [0,2,0,0,0,0|2,0,0]=4 3689 B22R2.518918 CC(O)CCOC(c1ccc(cc1)F)c2cccc(c2)Br 7a_200000373208_100012276601 [0,2,0,0,0,0|2,0,0]=4 3690 B22R2.518918 CC(O)CCOC(c1ccc(cc1)F)c2cccc(c2)Cl 34a_200000373149_100012276601 [0,2,0,0,0,0|2,0,0]=4 3691 B22R2.518918 CC(O)CCOC(c1ccc(cc1)F)c2cccc(c2)Cl 7a_200000373149_100012276601 [0,2,0,0,0,0|2,0,0]=4 3692 B22R2.518918 CN(C)CCNC(c1ccc(cc1)Cl)c2cccc(c2)Cl 270004a_100000210585_200011267713 [0,2,0,0,0,0|1,0,0]=3 3693 B22R2.518918 CN(C)CCNC(c1ccc(cc1)F)c2cccc(c2)Br 270004a_100000210585_200011267472 [0,2,0,0,0,0|1,0,0]=3 3694 B22R2.518918 CN(C)CCNC(c1ccc(cc1)F)c2cccc(c2)F 270004a_100000210585_100000185714 [0,2,0,0,0,0|1,0,0]=3 3695 B22R2.518918 CN(C)CCOC(c1ccc(cc1)Br)c2cccc(c2)F 7a_200000373125_100000755713 [0,2,0,0,0,0|0,0,0]=2 3696 B22R2.518918 CN(C)CCOC(c1ccc(cc1)Cl)c2cccc(c2)F 7a_200000373141_100000755713 [0,2,0,0,0,0|0,0,0]=2 3697 B22R2.518918 CN(C)CCOC(c1ccc(cc1)F)c2cccc(c2)Br 7a_200000373208_100000755713 [0,2,0,0,0,0|0,0,0]=2 3698 B22R2.518918 CN(C)CCOC(c1ccc(cc1)F)c2cccc(c2)Cl 7a_200000373149_100000755713 [0,2,0,0,0,0|0,0,0]=2 3699 B22R2.518918 Cc1ccc(cc1)C(NCCC(C)C)c2cccc(c2)Br 270004a_100000210545_200011268011 [0,2,0,0,0,0|2,0,0]=4 3700 B22R2.518918 Cc1ccc(cc1)C(NCCN(C)C)c2cccc(c2)Br 270004a_100000210585_200011268011 [0,2,0,0,0,0|1,0,0]=3 3701 B22R2.523574 CC(C)CCNC(c1ccccc1)c2ccc(c(c2)Cl)Cl 270004a_100000210545_100011215129 [0,2,0,0,0,0|2,0,0]=4 3702 B22R2.523574 CC(C)CCNC(c1ccccc1)c2ccc(c(c2)F)F 270004a_100000210545_100011218205 [0,2,0,0,0,0|2,0,0]=4 3703 B22R2.523574 CN(C)CCNC(c1ccccc1)c2ccc(c(c2)Cl)Cl 270004a_100000210585_100011215129 [0,2,0,0,0,0|1,0,0]=3 3704 B22R2.523574 CN(C)CCNC(c1ccccc1)c2ccc(c(c2)F)F 270004a_100000210585_100011218205 [0,2,0,0,0,0|1,0,0]=3 3705 B22R2.523574 Cc1ccc(cc1C)C(NCCC(C)C)c2ccccc2 270004a_100000210545_100000185006 [0,2,0,0,0,0|2,0,0]=4 3706 B22R2.523574 Cc1ccc(cc1C)C(NCCN(C)C)c2ccccc2 270004a_100000210585_100000185006 [0,2,0,0,0,0|1,0,0]=3 3707 B22R2.3988806 CC(C)CCNC(c1cccc(c1)Br)c2ccccc2I 270004a_100000210545_100010004308 [0,2,0,0,0,0|2,0,0]=4 3708 B22R2.3988806 CC(C)CCNC(c1cccc(c1)Cl)c2ccccc2Cl 270004a_100000210545_200011400552 [0,2,0,0,0,0|2,0,0]=4 3709 B22R2.3988806 CC(C)CCNC(c1cccc(c1)F)c2ccccc2F 270004a_100000210545_100011218100 [0,2,0,0,0,0|2,0,0]=4 3710 B22R2.3988806 CN(C)CCNC(c1cccc(c1)Br)c2ccccc2I 270004a_100000210585_100010004308 [0,2,0,0,0,0|1,0,0]=3 3711 B22R2.3988806 CN(C)CCNC(c1cccc(c1)Cl)c2ccccc2Cl 270004a_100000210585_200011400552 [0,2,0,0,0,0|1,0,0]=3 3712 B22R2.3988806 CN(C)CCNC(c1cccc(c1)F)c2ccccc2F 270004a_100000210585_100011218100 [0,2,0,0,0,0|1,0,0]=3 3713 B22R2.10939 CC(C)CCN(C)C(c1ccccc1)c2ccccc2Br 270004a_100000742789_100000198044 [0,2,0,0,0,0|2,0,0]=4 3714 B22R2.10939 CC(C)CCN(C)C(c1ccccc1)c2ccccc2Cl 270004a_100000742789_100011215288 [0,2,0,0,0,0|2,0,0]=4 3715 B22R2.10939 CC(C)CCN(C)C(c1ccccc1)c2ccccc2F 270004a_100000742789_100011217773 [0,2,0,0,0,0|2,0,0]=4 3716 B22R2.10939 CN(C)CCN(C)C(c1ccccc1)c2ccccc2Br 270004a_100000225618_100000198044 [0,2,0,0,0,0|1,0,0]=3 3717 B22R2.10939 CN(C)CCN(C)C(c1ccccc1)c2ccccc2Cl 270004a_100000225618_100011215288 [0,2,0,0,0,0|1,0,0]=3 3718 B22R2.10939 CN(C)CCN(C)C(c1ccccc1)c2ccccc2F 270004a_100000225618_100011217773 [0,2,0,0,0,0|1,0,0]=3 3719 B22R2.10939 CN(C)CCN(C)C(c1ccccn1)c2ccccc2Cl 270004a_100000225618_100011400554 [0,2,0,0,0,0|2,0,0]=4 3720 B22R2.10939 CN(C)CCN(C)C(c1cccnc1)c2ccccc2Br 270004a_100000225618_100011532686 [0,2,0,0,0,0|2,0,0]=4 3721 B22R2.10939 CN(C)CCN(C)C(c1cccnc1)c2ccccc2Cl 270004a_100000225618_200011400555 [0,2,0,0,0,0|2,0,0]=4 3722 B22R2.10939 Cc1ccccc1C(c2ccccc2)N(C)CCC(C)C 2230a_100000742789_100000230135 [0,2,0,0,0,0|2,0,0]=4 3723 B22R2.10939 Cc1ccccc1C(c2ccccc2)N(C)CCC(C)C 269982a_100000742789_100000230135 [0,2,0,0,0,0|2,0,0]=4 3724 B22R2.10939 Cc1ccccc1C(c2ccccc2)N(C)CCC(C)C 270004a_100000742789_100000735561 [0,2,0,0,0,0|2,0,0]=4 3725 B22R2.10939 Cc1ccccc1C(c2ccccc2)N(C)CCN(C)C 269982a_100000225618_100000230135 [0,2,0,0,0,0|1,0,0]=3 3726 B22R2.10939 Cc1ccccc1C(c2ccccc2)N(C)CCN(C)C 270004a_100000225618_100000735561 [0,2,0,0,0,0|1,0,0]=3 3727 B22R2.604399 COc1ccccc1C(NCCC(C)C)c2ccccc2 270004a_100000210545_100011218802 [0,2,0,0,0,0|2,0,0]=4 3728 B22R2.604399 COc1ccccc1C(NCCN(C)C)c2ccccc2 270004a_100000210585_100011218802 [0,2,0,0,0,0|1,0,0]=3 3729 B22R2.4061068 CC(=O)CCOC(c1ccccc1Cl)c2ccccc2Cl 7a_200000754862_100000053229 [0,2,0,0,0,0|2,0,0]=4 3730 B22R2.4061068 CC(C)CCNC(c1ccccc1Cl)c2ccccc2Cl 270004a_100000210545_100000755194 [0,2,0,0,0,0|2,0,0]=4 3731 B22R2.4061068 CC(C)OCOC(c1ccccc1Cl)c2ccccc2Cl 34a_200000754862_100000709892 [0,2,0,0,0,0|2,0,0]=4 3732 B22R2.4061068 CC(O)CCOC(c1ccccc1Cl)c2ccccc2Cl 34a_200000754862_100012276601 [0,2,0,0,0,0|2,0,0]=4 3733 B22R2.4061068 CC(O)CCOC(c1ccccc1Cl)c2ccccc2Cl 7a_200000754862_100012276601 [0,2,0,0,0,0|2,0,0]=4 3734 B22R2.4061068 CN(C)CCNC(c1ccccc1Cl)c2ccccc2Cl 270004a_100000210585_100000755194 [0,2,0,0,0,0|1,0,0]=3 3735 B22R2.4061068 CN(C)CCOC(c1ccccc1Cl)c2ccccc2Cl 7a_200000754862_100000755713 [0,2,0,0,0,0|0,0,0]=2 3736 B22R2.4086843 CC(C)CCNC(c1ccccc1)c2ccc(cc2Cl)Cl 270004a_100000210545_100011217691 [0,2,0,0,0,0|2,0,0]=4 3737 B22R2.4086843 CC(C)CCNC(c1ccccc1)c2ccc(cc2F)F 270004a_100000210545_200011215470 [0,2,0,0,0,0|2,0,0]=4 3738 B22R2.4086843 CN(C)CCNC(c1ccccc1)c2ccc(cc2Cl)Cl 270004a_100000210585_100011217691 [0,2,0,0,0,0|1,0,0]=3 3739 B22R2.4086843 CN(C)CCNC(c1ccccc1)c2ccc(cc2F)F 270004a_100000210585_200011215470 [0,2,0,0,0,0|1,0,0]=3 3740 B22R2.4086843 Cc1ccc(c(c1)C)C(NCCC(C)C)c2ccccc2 2230a_100102946505_100000210312 [0,2,0,0,0,0|2,0,0]=4 3741 B22R2.4086843 Cc1ccc(c(c1)C)C(NCCC(C)C)c2ccccc2 269862a_100102946505_100000185833 [0,2,0,0,0,0|2,0,0]=4 3742 B22R2.4086843 Cc1ccc(c(c1)C)C(NCCC(C)C)c2ccccc2 270004a_100000210545_100000185008 [0,2,0,0,0,0|2,0,0]=4 3743 B22R2.4086843 Cc1ccc(c(c1)C)C(NCCC(C)C)c2ccccc2 34a_100102946505_100000210312 [0,2,0,0,0,0|2,0,0]=4 3744 B22R2.4086843 Cc1ccc(c(c1)C)C(NCCN(C)C)c2ccccc2 270004a_100000210585_100000185008 [0,2,0,0,0,0|1,0,0]=3 3745 B22R2.8239985 CC(C)CCNC(c1ccc(cc1)Cl)c2ccccc2Cl 270004a_100000210545_100000287701 [0,2,0,0,0,0|2,0,0]=4 3746 B22R2.8239985 CC(C)CCNC(c1ccc(cc1)F)c2ccccc2Br 270004a_100000210545_100011267497 [0,2,0,0,0,0|2,0,0]=4 3747 B22R2.8239985 CC(C)CCNC(c1ccc(cc1)F)c2ccccc2Cl 270004a_100000210545_100000297523 [0,2,0,0,0,0|2,0,0]=4 3748 B22R2.8239985 CN(C)CCNC(c1ccc(cc1)Cl)c2ccccc2Cl 270004a_100000210585_100000287701 [0,2,0,0,0,0|1,0,0]=3 3749 B22R2.8239985 CN(C)CCNC(c1ccc(cc1)F)c2ccccc2Br 270004a_100000210585_100011267497 [0,2,0,0,0,0|1,0,0]=3 3750 B22R2.8239985 CN(C)CCNC(c1ccc(cc1)F)c2ccccc2Cl 270004a_100000210585_100000297523 [0,2,0,0,0,0|1,0,0]=3 3751 B22R2.8239985 Cc1ccc(cc1)C(NCCC(C)C)c2ccccc2Cl 270004a_100000210545_100000758304 [0,2,0,0,0,0|2,0,0]=4 3752 B22R2.8239985 Cc1ccc(cc1)C(NCCN(C)C)c2ccccc2Cl 270004a_100000210585_100000758304 [0,2,0,0,0,0|1,0,0]=3 3753 B22R2.8239985 Cc1ccccc1C(NCCC(C)C)c2ccc(cc2)Br 270004a_100000210545_200011267734 [0,2,0,0,0,0|2,0,0]=4 3754 B22R2.8239985 Cc1ccccc1C(NCCN(C)C)c2ccc(cc2)Br 270004a_100000210585_200011267734 [0,2,0,0,0,0|1,0,0]=3 3755 B22R2.50849 CC(C)CCC(=O)C(C)(c1ccccc1)c2ccccc2 1458a_100000752439_100000210312 [0,2,0,0,0,0|2,0,0]=4 3756 B22R2.745520 C#CC(OCC=C(C)C)(c1ccccc1)c2ccccc2 34a_100000033177_100000761012 [0,2,0,0,0,0|1,0,1]=4 3757 B22R2.745520 C#CC(OCC=C(C)C)(c1ccccc1)c2ccccc2 7a_100000033177_100000761012 [0,2,0,0,0,0|1,0,1]=4 3758 B22R2.745520 C#CC(OCCC(=C)C)(c1ccccc1)c2ccccc2 34a_100000033177_100000730704 [0,2,0,0,0,0|1,0,1]=4 3759 B22R2.745520 C#CC(OCCC(=C)C)(c1ccccc1)c2ccccc2 7a_100000033177_100000730704 [0,2,0,0,0,0|1,0,1]=4 3760 B22R2.745520 C#CC(OCCC(=O)C)(c1ccccc1)c2ccccc2 7a_100000033177_100000053229 [0,2,0,0,0,0|2,0,0]=4 3761 B22R2.745520 C#CC(OCCC(C)C)(c1ccccc1)c2ccccc2 34a_100000033177_100000210312 [0,2,0,0,0,0|1,0,0]=3 3762 B22R2.745520 C#CC(OCCC(C)C)(c1ccccc1)c2ccccc2 7a_100000033177_100000210626 [0,2,0,0,0,0|1,0,0]=3 3763 B22R2.745520 C#CC(OCCC(C)O)(c1ccccc1)c2ccccc2 34a_100000033177_100012276601 [0,2,0,0,0,0|2,0,0]=4 3764 B22R2.745520 C#CC(OCCC(C)O)(c1ccccc1)c2ccccc2 7a_100000033177_100012276601 [0,2,0,0,0,0|2,0,0]=4 3765 B22R2.745520 C#CC(OCCN(C)C)(c1ccccc1)c2ccccc2 7a_100000033177_100000755713 [0,2,0,0,0,0|0,0,0]=2 3766 B22R2.745520 C#CC(OCOC(C)C)(c1ccccc1)c2ccccc2 34a_100000033177_100000709892 [0,2,0,0,0,0|2,0,0]=4 3767 B22R2.3903625 C=C(C)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000730704 [0,2,0,0,0,0|1,0,1]=4 3768 B22R2.3903625 C=C(C)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000730704 [0,2,0,0,0,0|1,0,1]=4 3769 B22R2.3903625 CC(=CCOC(C)(c1ccccc1)c2ccc(cc2)Cl)C 34a_100016991996_100000761012 [0,2,0,0,0,0|1,0,1]=4 3770 B22R2.3903625 CC(=CCOC(C)(c1ccccc1)c2ccc(cc2)Cl)C 7a_100016991996_100000761012 [0,2,0,0,0,0|1,0,1]=4 3771 B22R2.3903625 CC(=O)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000053229 [0,2,0,0,0,0|2,0,0]=4 3772 B22R2.3903625 CC(C)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000210312 [0,2,0,0,0,0|1,0,0]=3 3773 B22R2.3903625 CC(C)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000210626 [0,2,0,0,0,0|1,0,0]=3 3774 B22R2.3903625 CC(C)OCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000709892 [0,2,0,0,0,0|2,0,0]=4 3775 B22R2.3903625 CC(O)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100012276601 [0,2,0,0,0,0|2,0,0]=4 3776 B22R2.3903625 CC(O)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100012276601 [0,2,0,0,0,0|2,0,0]=4 3777 B22R2.3903625 CN(C)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000755713 [0,2,0,0,0,0|0,0,0]=2 3778 B22R2.7669 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)OC 34a_100000286541_100000730704 [0,2,0,0,0,0|1,0,1]=4 3779 B22R2.7669 C=C(C)CCOC(c1ccccc1)c2ccc(cc2)OC 7a_100000286541_100000730704 [0,2,0,0,0,0|1,0,1]=4 3780 B22R2.7669 CC(C)CCNC(c1ccccc1)c2ccc(cc2)CO 270004a_100000210545_200010886186 [0,2,0,0,0,0|2,0,0]=4 3781 B22R2.7669 CN(C)CCNC(c1ccccc1)c2ccc(cc2)CO 270004a_100000210585_200010886186 [0,2,0,0,0,0|1,0,0]=3 3782 B22R2.7669 COc1ccc(cc1)C(NCCC(C)C)c2ccccc2 2230a_100015384205_100000210312 [0,2,0,0,0,0|2,0,0]=4 3783 B22R2.7669 COc1ccc(cc1)C(NCCC(C)C)c2ccccc2 270004a_100000210545_100000170244 [0,2,0,0,0,0|2,0,0]=4 3784 B22R2.7669 COc1ccc(cc1)C(NCCC(C)C)c2ccccc2 34a_100015384205_100000210312 [0,2,0,0,0,0|2,0,0]=4 3785 B22R2.7669 COc1ccc(cc1)C(NCCN(C)C)c2ccccc2 270004a_100000210585_100000170244 [0,2,0,0,0,0|1,0,0]=3 3786 B22R2.7669 COc1ccc(cc1)C(OCC=C(C)C)c2ccccc2 34a_100000286541_100000761012 [0,2,0,0,0,0|1,0,1]=4 3787 B22R2.7669 COc1ccc(cc1)C(OCC=C(C)C)c2ccccc2 7a_100000286541_100000761012 [0,2,0,0,0,0|1,0,1]=4 3788 B22R2.7669 COc1ccc(cc1)C(OCCC(=O)C)c2ccccc2 7a_100000286541_100000053229 [0,2,0,0,0,0|2,0,0]=4 3789 B22R2.7669 COc1ccc(cc1)C(OCCC(C)C)c2ccccc2 34a_100000286541_100000210312 [0,2,0,0,0,0|1,0,0]=3 3790 B22R2.7669 COc1ccc(cc1)C(OCCC(C)C)c2ccccc2 7a_100000286541_100000210626 [0,2,0,0,0,0|1,0,0]=3 3791 B22R2.7669 COc1ccc(cc1)C(OCCC(C)O)c2ccccc2 34a_100000286541_100012276601 [0,2,0,0,0,0|2,0,0]=4 3792 B22R2.7669 COc1ccc(cc1)C(OCCC(C)O)c2ccccc2 7a_100000286541_100012276601 [0,2,0,0,0,0|2,0,0]=4 3793 B22R2.7669 COc1ccc(cc1)C(OCCN(C)C)c2ccccc2 7a_100000286541_100000755713 [0,2,0,0,0,0|0,0,0]=2 3794 B22R2.7669 COc1ccc(cc1)C(OCOC(C)C)c2ccccc2 34a_100000286541_100000709892 [0,2,0,0,0,0|2,0,0]=4 3795 B22R2.24053 C=C(C)CCOC(c1ccc(cc1)C)c2ccc(cc2)C 34a_100000297768_100000730704 [0,2,0,0,0,0|1,0,1]=4 3796 B22R2.24053 C=C(C)CCOC(c1ccc(cc1)C)c2ccc(cc2)C 7a_100000297768_100000730704 [0,2,0,0,0,0|1,0,1]=4 3797 B22R2.24053 C=C(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)Cl 34a_100000373138_100000730704 [0,2,0,0,0,0|1,0,1]=4 3798 B22R2.24053 C=C(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)Cl 7a_100000373138_100000730704 [0,2,0,0,0,0|1,0,1]=4 3799 B22R2.24053 C=C(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)F 34a_100000272419_100000730704 [0,2,0,0,0,0|1,0,1]=4 3800 B22R2.24053 C=C(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)F 7a_100000272419_100000730704 [0,2,0,0,0,0|1,0,1]=4 3801 B22R2.24053 CC(=CCOC(c1ccc(cc1)C)c2ccc(cc2)C)C 34a_100000297768_100000761012 [0,2,0,0,0,0|1,0,1]=4 3802 B22R2.24053 CC(=CCOC(c1ccc(cc1)C)c2ccc(cc2)C)C 7a_100000297768_100000761012 [0,2,0,0,0,0|1,0,1]=4 3803 B22R2.24053 CC(=CCOC(c1ccc(cc1)F)c2ccc(cc2)Cl)C 34a_100000373138_100000761012 [0,2,0,0,0,0|1,0,1]=4 3804 B22R2.24053 CC(=CCOC(c1ccc(cc1)F)c2ccc(cc2)Cl)C 7a_100000373138_100000761012 [0,2,0,0,0,0|1,0,1]=4 3805 B22R2.24053 CC(=CCOC(c1ccc(cc1)F)c2ccc(cc2)F)C 34a_100000272419_100000761012 [0,2,0,0,0,0|1,0,1]=4 3806 B22R2.24053 CC(=CCOC(c1ccc(cc1)F)c2ccc(cc2)F)C 7a_100000272419_100000761012 [0,2,0,0,0,0|1,0,1]=4 3807 B22R2.24053 CC(=O)CCOC(c1ccc(cc1)C)c2ccc(cc2)C 7a_100000297768_100000053229 [0,2,0,0,0,0|2,0,0]=4 3808 B22R2.24053 CC(=O)CCOC(c1ccc(cc1)Cl)c2ccc(cc2)Cl 7a_100000272391_100000053229 [0,2,0,0,0,0|2,0,0]=4 3809 B22R2.24053 CC(=O)CCOC(c1ccc(cc1)Cl)c2ccc(cc2)Cl 7a_100000759926_100000230178 [0,2,0,0,0,0|2,0,0]=4 3810 B22R2.24053 CC(=O)CCOC(c1ccc(cc1)F)c2ccc(cc2)Cl 7a_100000373138_100000053229 [0,2,0,0,0,0|2,0,0]=4 3811 B22R2.24053 CC(=O)CCOC(c1ccc(cc1)F)c2ccc(cc2)F 7a_100000272419_100000053229 [0,2,0,0,0,0|2,0,0]=4 3812 B22R2.24053 CC(=O)CCOC(c1ccc(cc1)F)c2ccc(cc2)F 7a_100000759926_100000211696 [0,2,0,0,0,0|2,0,0]=4 3813 B22R2.24053 CC(C)CCNC(c1ccc(cc1)Br)c2ccc(cc2)Br 270004a_100000210545_100011219889 [0,2,0,0,0,0|2,0,0]=4 3814 B22R2.24053 CC(C)CCNC(c1ccc(cc1)Cl)c2ccc(cc2)Br 270004a_100000210545_100011267714 [0,2,0,0,0,0|2,0,0]=4 3815 B22R2.24053 CC(C)CCNC(c1ccc(cc1)Cl)c2ccc(cc2)Cl 270004a_100000210545_100000297488 [0,2,0,0,0,0|2,0,0]=4 3816 B22R2.24053 CC(C)CCNC(c1ccc(cc1)F)c2ccc(cc2)Br 270004a_100000210545_200011267496 [0,2,0,0,0,0|2,0,0]=4 3817 B22R2.24053 CC(C)CCNC(c1ccc(cc1)F)c2ccc(cc2)F 2230a_100000743883_100000210312 [0,2,0,0,0,0|2,0,0]=4 3818 B22R2.24053 CC(C)CCNC(c1ccc(cc1)F)c2ccc(cc2)F 34a_100000743883_100000210312 [0,2,0,0,0,0|2,0,0]=4 3819 B22R2.24053 CC(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)Cl 34a_100000373138_100000210312 [0,2,0,0,0,0|1,0,0]=3 3820 B22R2.24053 CC(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)Cl 7a_100000373138_100000210626 [0,2,0,0,0,0|1,0,0]=3 3821 B22R2.24053 CC(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)F 34a_100000272419_100000210312 [0,2,0,0,0,0|1,0,0]=3 3822 B22R2.24053 CC(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)F 7a_100000210254_100000211696 [0,2,0,0,0,0|1,0,0]=3 3823 B22R2.24053 CC(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)F 7a_100000272419_100000210626 [0,2,0,0,0,0|1,0,0]=3 3824 B22R2.24053 CC(C)CCSC(c1ccc(cc1)F)c2ccc(cc2)F 62a_100000210312_100000211696 [0,2,0,0,0,0|1,1,0]=4 3825 B22R2.24053 CC(C)CCSC(c1ccc(cc1)F)c2ccc(cc2)F 62a_100000211696_100000210312 [0,2,0,0,0,0|1,1,0]=4 3826 B22R2.24053 CC(C)OCOC(c1ccc(cc1)Cl)c2ccc(cc2)Cl 34a_100000272391_100000709892 [0,2,0,0,0,0|2,0,0]=4 3827 B22R2.24053 CC(C)OCOC(c1ccc(cc1)F)c2ccc(cc2)Cl 34a_100000373138_100000709892 [0,2,0,0,0,0|2,0,0]=4 3828 B22R2.24053 CC(C)OCOC(c1ccc(cc1)F)c2ccc(cc2)F 34a_100000272419_100000709892 [0,2,0,0,0,0|2,0,0]=4 3829 B22R2.24053 CC(O)CCOC(c1ccc(cc1)Cl)c2ccc(cc2)Cl 34a_100000272391_100012276601 [0,2,0,0,0,0|2,0,0]=4 3830 B22R2.24053 CC(O)CCOC(c1ccc(cc1)Cl)c2ccc(cc2)Cl 7a_100000272391_100012276601 [0,2,0,0,0,0|2,0,0]=4 3831 B22R2.24053 CC(O)CCOC(c1ccc(cc1)F)c2ccc(cc2)Cl 34a_100000373138_100012276601 [0,2,0,0,0,0|2,0,0]=4 3832 B22R2.24053 CC(O)CCOC(c1ccc(cc1)F)c2ccc(cc2)Cl 7a_100000373138_100012276601 [0,2,0,0,0,0|2,0,0]=4 3833 B22R2.24053 CC(O)CCOC(c1ccc(cc1)F)c2ccc(cc2)F 34a_100000272419_100012276601 [0,2,0,0,0,0|2,0,0]=4 3834 B22R2.24053 CC(O)CCOC(c1ccc(cc1)F)c2ccc(cc2)F 7a_100000272419_100012276601 [0,2,0,0,0,0|2,0,0]=4 3835 B22R2.24053 CN(C)CCCC(c1ccc(cc1)F)c2ccc(cc2)F 2230a_100102631434_100000073256 [0,2,0,0,0,0|1,0,0]=3 3836 B22R2.24053 CN(C)CCCC(c1ccc(cc1)F)c2ccc(cc2)F 269982a_100102631434_100000073256 [0,2,0,0,0,0|1,0,0]=3 3837 B22R2.24053 CN(C)CCNC(c1ccc(cc1)Br)c2ccc(cc2)Br 270004a_100000210585_100011219889 [0,2,0,0,0,0|1,0,0]=3 3838 B22R2.24053 CN(C)CCNC(c1ccc(cc1)Cl)c2ccc(cc2)Br 270004a_100000210585_100011267714 [0,2,0,0,0,0|1,0,0]=3 3839 B22R2.24053 CN(C)CCNC(c1ccc(cc1)Cl)c2ccc(cc2)Cl 270004a_100000210585_100000297488 [0,2,0,0,0,0|1,0,0]=3 3840 B22R2.24053 CN(C)CCNC(c1ccc(cc1)F)c2ccc(cc2)Br 270004a_100000210585_200011267496 [0,2,0,0,0,0|1,0,0]=3 3841 B22R2.24053 CN(C)CCOC(c1ccc(cc1)Cl)c2ccc(cc2)Cl 7a_100000272391_100000755713 [0,2,0,0,0,0|0,0,0]=2 3842 B22R2.24053 CN(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)Cl 7a_100000373138_100000755713 [0,2,0,0,0,0|0,0,0]=2 3843 B22R2.24053 CN(C)CCOC(c1ccc(cc1)F)c2ccc(cc2)F 7a_100000272419_100000755713 [0,2,0,0,0,0|0,0,0]=2 3844 B22R2.24053 CN(C)CCSC(c1ccc(cc1)Cl)c2ccc(cc2)Cl 62a_100000230178_100000755713 [0,2,0,0,0,0|0,1,0]=3 3845 B22R2.24053 CN(C)CCSC(c1ccc(cc1)F)c2ccc(cc2)F 62a_100000211696_100000755713 [0,2,0,0,0,0|0,1,0]=3 3846 B22R2.24053 Cc1ccc(cc1)C(NCCC(C)C)c2ccc(cc2)C 270004a_100000210545_100000181741 [0,2,0,0,0,0|2,0,0]=4 3847 B22R2.24053 Cc1ccc(cc1)C(NCCC(C)C)c2ccc(cc2)Cl 270004a_100000210545_100011267710 [0,2,0,0,0,0|2,0,0]=4 3848 B22R2.24053 Cc1ccc(cc1)C(NCCN(C)C)c2ccc(cc2)C 270004a_100000210585_100000181741 [0,2,0,0,0,0|1,0,0]=3 3849 B22R2.24053 Cc1ccc(cc1)C(NCCN(C)C)c2ccc(cc2)Cl 270004a_100000210585_100011267710 [0,2,0,0,0,0|1,0,0]=3 3850 B22R2.24053 Cc1ccc(cc1)C(OCCC(C)C)c2ccc(cc2)C 34a_100000297768_100000210312 [0,2,0,0,0,0|1,0,0]=3 3851 B22R2.24053 Cc1ccc(cc1)C(OCCC(C)C)c2ccc(cc2)C 7a_100000297768_100000210626 [0,2,0,0,0,0|1,0,0]=3 3852 B22R2.24053 Cc1ccc(cc1)C(OCCC(C)O)c2ccc(cc2)C 34a_100000297768_100012276601 [0,2,0,0,0,0|2,0,0]=4 3853 B22R2.24053 Cc1ccc(cc1)C(OCCC(C)O)c2ccc(cc2)C 7a_100000297768_100012276601 [0,2,0,0,0,0|2,0,0]=4 3854 B22R2.24053 Cc1ccc(cc1)C(OCCN(C)C)c2ccc(cc2)C 7a_100000297768_100000755713 [0,2,0,0,0,0|0,0,0]=2 3855 B22R2.24053 Cc1ccc(cc1)C(OCOC(C)C)c2ccc(cc2)C 34a_100000297768_100000709892 [0,2,0,0,0,0|2,0,0]=4 3856 B22R2.24056 CC(C)CCN(C)C(c1ccccc1)c2ccc(cc2)Br 270004a_100000742789_100000718703 [0,2,0,0,0,0|2,0,0]=4 3857 B22R2.24056 CC(C)CCN(C)C(c1ccccc1)c2ccc(cc2)Cl 2230a_100000742789_100000211669 [0,2,0,0,0,0|2,0,0]=4 3858 B22R2.24056 CC(C)CCN(C)C(c1ccccc1)c2ccc(cc2)Cl 269982a_100000742789_100000211669 [0,2,0,0,0,0|2,0,0]=4 3859 B22R2.24056 CC(C)CCN(C)C(c1ccccc1)c2ccc(cc2)Cl 270004a_100000742789_100000211064 [0,2,0,0,0,0|2,0,0]=4 3860 B22R2.24056 CC(C)CCN(C)C(c1ccccc1)c2ccc(cc2)F 270004a_100000742789_100000210425 [0,2,0,0,0,0|2,0,0]=4 3861 B22R2.24056 CN(C)CCN(C)C(c1ccc(cc1)Br)c2ccccn2 270004a_100000225618_200010179208 [0,2,0,0,0,0|2,0,0]=4 3862 B22R2.24056 CN(C)CCN(C)C(c1ccc(cc1)Br)c2cccnc2 270004a_100000225618_100000753996 [0,2,0,0,0,0|2,0,0]=4 3863 B22R2.24056 CN(C)CCN(C)C(c1ccc(cc1)Cl)c2ccccn2 269982a_100000225618_200010188304 [0,2,0,0,0,0|2,0,0]=4 3864 B22R2.24056 CN(C)CCN(C)C(c1ccc(cc1)Cl)c2ccccn2 270004a_100000225618_100000753647 [0,2,0,0,0,0|2,0,0]=4 3865 B22R2.24056 CN(C)CCN(C)C(c1ccc(cc1)Cl)c2cccnc2 270004a_100000225618_100000753233 [0,2,0,0,0,0|2,0,0]=4 3866 B22R2.24056 CN(C)CCN(C)C(c1ccc(cc1)F)c2cccnc2 269982a_100000343095_100000755713 [0,2,0,0,0,0|2,0,0]=4 3867 B22R2.24056 CN(C)CCN(C)C(c1ccccc1)c2ccc(cc2)Br 270004a_100000225618_100000718703 [0,2,0,0,0,0|1,0,0]=3 3868 B22R2.24056 CN(C)CCN(C)C(c1ccccc1)c2ccc(cc2)Cl 269982a_100000225618_100000211669 [0,2,0,0,0,0|1,0,0]=3 3869 B22R2.24056 CN(C)CCN(C)C(c1ccccc1)c2ccc(cc2)Cl 270004a_100000225618_100000211064 [0,2,0,0,0,0|1,0,0]=3 3870 B22R2.24056 CN(C)CCN(C)C(c1ccccc1)c2ccc(cc2)F 270004a_100000225618_100000210425 [0,2,0,0,0,0|1,0,0]=3 3871 B22R2.24056 Cc1ccc(cc1)C(c2ccccc2)N(C)CCC(C)C 270004a_100000742789_100000210966 [0,2,0,0,0,0|2,0,0]=4 3872 B22R2.24056 Cc1ccc(cc1)C(c2ccccc2)N(C)CCN(C)C 270004a_100000225618_100000210966 [0,2,0,0,0,0|1,0,0]=3 3873 B22R2.741406 CCN(CCC(C)C)C(c1ccccc1)c2ccccc2 2230a_100000207693_100000211591 [0,2,0,0,0,0|2,0,0]=4 3874 B22R2.741406 CCN(CCC(C)C)C(c1ccccc1)c2ccccc2 269982a_100000207693_100000211591 [0,2,0,0,0,0|2,0,0]=4 3875 B22R2.741406 CCN(CCC(C)C)C(c1ccccc1)c2ccccc2 270004a_100000207693_100000210122 [0,2,0,0,0,0|2,0,0]=4 3876 B22R2.741406 CCN(CCN(C)C)C(c1ccccc1)c2ccccc2 269982a_100000225870_100000211591 [0,2,0,0,0,0|1,0,0]=3 3877 B22R2.741406 CCN(CCN(C)C)C(c1ccccc1)c2ccccc2 270004a_100000225870_100000210122 [0,2,0,0,0,0|1,0,0]=3 3878 B22R2.741406 CCN(CCN(C)C)C(c1ccccc1)c2ccccn2 270004a_100000225870_100000210380 [0,2,0,0,0,0|2,0,0]=4 3879 B22R2.741406 CCN(CCN(C)C)C(c1ccccc1)c2cccnc2 270004a_100000225870_100000735413 [0,2,0,0,0,0|2,0,0]=4 3880 B20R3.250 CC1CCN1C(c2ccccc2)c3ccccc3 269982a_100000755817_100000211591 [1,0,0,1,0,0|2,0,0]=4 3881 B20R3.2741 c1ccc(cc1)C(c2ccccc2)N3CCCC3 2230a_100000188435_100000211591 [1,0,0,1,0,0|2,0,0]=4 3882 B20R3.2741 c1ccc(cc1)C(c2ccccc2)N3CCCC3 269982a_100000188435_100000211591 [1,0,0,1,0,0|2,0,0]=4 3883 B20R3.2741 c1ccc(cc1)C(c2ccccc2)N3CCCC3 270004a_100000188435_100000210122 [1,0,0,1,0,0|2,0,0]=4 3884 B20R3.2741 c1ccc(cc1)C(c2ccccc2)N3CCSC3 2230a_100011215254_100000211591 [1,0,0,1,0,0|2,0,0]=4 3885 B20R3.2741 c1ccc(cc1)C(c2ccccc2)N3CCSC3 269982a_100011215254_100000211591 [1,0,0,1,0,0|2,0,0]=4 3886 B20R3.2741 c1ccc(cc1)C(c2ccccc2)N3CCSC3 270004a_100011215254_100000210122 [1,0,0,1,0,0|2,0,0]=4 3887 B20R3.30135 c1ccc(cc1)C(NCC2CC2)c3ccccc3 2230a_100000162943_100000742324 [1,0,0,1,0,0|2,0,0]=4 3888 B20R3.30135 c1ccc(cc1)C(NCC2CC2)c3ccccc3 2230a_100000735609_100000211591 [1,0,0,1,0,0|2,0,0]=4 3889 B20R3.30135 c1ccc(cc1)C(NCC2CC2)c3ccccc3 269862a_100000162943_100000741477 [1,0,0,1,0,0|2,0,0]=4 3890 B20R3.30135 c1ccc(cc1)C(NCC2CC2)c3ccccc3 270004a_100000735609_100000210122 [1,0,0,1,0,0|2,0,0]=4 3891 B20R3.30135 c1ccc(cc1)C(NCC2CC2)c3ccccc3 34a_100000162943_100000742324 [1,0,0,1,0,0|2,0,0]=4 3892 B20R3.30135 c1ccc(cc1)C(NCC2CO2)c3ccccc3 2230a_100000162943_100011216344 [1,0,0,1,0,0|2,0,0]=4 3893 B20R3.30135 c1ccc(cc1)C(NCC2CO2)c3ccccc3 34a_100000162943_102125554688 [1,0,0,1,0,0|2,0,0]=4 3894 B20R3.30135 c1ccc(cc1)C(OCC2CC2)c3ccccc3 34a_100000211180_100000742324 [1,0,0,1,0,0|1,0,0]=3 3895 B20R3.30135 c1ccc(cc1)C(OCC2CC2)c3ccccc3 7a_100000211180_100000742324 [1,0,0,1,0,0|1,0,0]=3 3896 B20R3.30135 c1ccc(cc1)C(OCC2CC2)c3ccccn3 7a_100000180852_100000742324 [1,0,0,1,0,0|2,0,0]=4 3897 B20R3.30135 c1ccc(cc1)C(OCC2CO2)c3ccccc3 34a_100000211180_102125554688 [1,0,0,1,0,0|1,0,0]=3 3898 B20R3.30135 c1ccc(cc1)C(OCC2CO2)c3ccccc3 7a_100000211180_102125554688 [1,0,0,1,0,0|1,0,0]=3 3899 B20R3.30135 c1ccc(cc1)C(OCC2CO2)c3ccccn3 7a_100000180852_102125554688 [1,0,0,1,0,0|2,0,0]=4 3900 B20R3.30135 c1ccc(cc1)C(OCC2CS2)c3ccccc3 7a_100000211180_100000031435 [1,0,0,1,0,0|1,0,0]=3 3901 B20R3.30135 c1ccc(cc1)C(OCC2CS2)c3ccccn3 7a_100000180852_100000031435 [1,0,0,1,0,0|2,0,0]=4 3902 B20R3.30135 c1ccc(cc1)C(OC[C@@H]2CO2)c3ccccc3 7a_100000211180_100000745022 [1,0,0,1,0,0|1,0,0]=3 3903 B20R3.30135 c1ccc(cc1)C(OC[C@@H]2CO2)c3ccccn3 7a_100000180852_100000745022 [1,0,0,1,0,0|2,0,0]=4 3904 B20R3.30135 c1ccc(cc1)C(SCC2CC2)c3ccccc3 62a_100000211591_100000742324 [1,0,0,1,0,0|1,1,0]=4 3905 B20R3.30135 c1ccc(cc1)C(SCC2CC2)c3ccccc3 62a_100000756562_100011216954 [1,0,0,1,0,0|1,1,0]=4 3906 B20R3.30135 c1ccc(cc1)C(SCC2CO2)c3ccccc3 62a_100000211591_102125554688 [1,0,0,1,0,0|1,1,0]=4 3907 B20R3.30135 c1ccc(cc1)C(SCC2CO2)c3ccccc3 62a_102125554688_100011216954 [1,0,0,1,0,0|1,1,0]=4 3908 B20R3.30135 c1ccc(cc1)C(SCC2CS2)c3ccccc3 62a_100000031435_100011216954 [1,0,0,1,0,0|1,1,0]=4 3909 B20R3.30135 c1ccc(cc1)C(SCC2CS2)c3ccccc3 62a_100000211591_100000031435 [1,0,0,1,0,0|1,1,0]=4 3910 B20R3.30135 c1ccc(cc1)C(SC[C@@H]2CO2)c3ccccc3 62a_100000211591_100000745022 [1,0,0,1,0,0|1,1,0]=4 3911 B20R3.30135 c1ccc(cc1)C(SC[C@@H]2CO2)c3ccccc3 62a_100000745022_100011216954 [1,0,0,1,0,0|1,1,0]=4 3912 B20R3.30231 c1ccc(cc1)C(NC2CCC2)c3ccccc3 2230a_100000749019_100000211591 [1,0,0,1,0,0|2,0,0]=4 3913 B20R3.30231 c1ccc(cc1)C(NC2CCC2)c3ccccc3 270004a_100000162943_100000241760 [1,0,0,1,0,0|2,0,0]=4 3914 B20R3.30231 c1ccc(cc1)C(NC2CCC2)c3ccccc3 34a_100000162943_100000749161 [1,0,0,1,0,0|2,0,0]=4 3915 B20R3.30231 c1ccc(cc1)C(NC2COC2)c3ccccc3 2230a_100016991112_100000211591 [1,0,0,1,0,0|2,0,0]=4 3916 B20R3.30231 c1ccc(cc1)C(NC2COC2)c3ccccc3 270004a_100016991112_100000210122 [1,0,0,1,0,0|2,0,0]=4 3917 B20R3.30231 c1ccc(cc1)C(NC2COC2)c3ccccc3 34a_100000162943_100009818527 [1,0,0,1,0,0|2,0,0]=4 3918 B20R3.30231 c1ccc(cc1)C(NC2CSC2)c3ccccc3 270004a_100016994217_100000210122 [1,0,0,1,0,0|2,0,0]=4 3919 B20R3.30231 c1ccc(cc1)C(OC2CCC2)c3ccccc3 34a_100000211180_100000749161 [1,0,0,1,0,0|1,0,0]=3 3920 B20R3.30231 c1ccc(cc1)C(OC2COC2)c3ccccc3 34a_100000211180_100009818527 [1,0,0,1,0,0|1,0,0]=3 3921 B20R3.30231 c1ccc(cc1)C(OC2COC2)c3ccccc3 7a_100000211180_100009818527 [1,0,0,1,0,0|1,0,0]=3 3922 B20R3.30231 c1ccc(cc1)C(OC2COC2)c3ccccn3 7a_100000180852_100009818527 [1,0,0,1,0,0|2,0,0]=4 3923 B20R3.30231 c1ccc(cc1)C(OC2CSC2)c3ccccc3 7a_100000072292_100011216954 [1,0,0,1,0,0|1,0,0]=3 3924 B20R3.30231 c1ccc(cc1)C(SC2CCC2)c3ccccc3 62a_100000211591_100000749161 [1,0,0,1,0,0|1,1,0]=4 3925 B20R3.30231 c1ccc(cc1)C(SC2COC2)c3ccccc3 62a_100000211591_100009818527 [1,0,0,1,0,0|1,1,0]=4 3926 B20R3.2040304 C#CCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000688953 [1,0,0,1,0,0|1,0,1]=4 3927 B20R3.2040304 C/C=C/COC1c2ccccc2-c3c1cccc3 7a_100000211495_100102629194 [1,0,0,1,0,0|1,0,1]=4 3928 B20R3.2040304 C=CCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000754431 [1,0,0,1,0,0|1,0,1]=4 3929 B20R3.2040304 CC#CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000748600 [1,0,0,1,0,0|1,0,1]=4 3930 B20R3.2040304 CC=CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000070051 [1,0,0,1,0,0|1,0,1]=4 3931 B20R3.2040304 CCCCNC1c2ccccc2-c3c1cccc3 2230a_100000102301_100000211598 [1,0,0,1,0,0|2,0,0]=4 3932 B20R3.2040304 CCCCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000210211 [1,0,0,1,0,0|2,0,0]=4 3933 B20R3.2040304 CCCCNC1c2ccccc2-c3c1cccc3 7a_106832991798_100000211598 [1,0,0,1,0,0|2,0,0]=4 3934 B20R3.2040304 CCCCOC1c2ccccc2-c3c1cccc3 7a_100000210227_100000211598 [1,0,0,1,0,0|1,0,0]=3 3935 B20R3.2040304 CCCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000210211 [1,0,0,1,0,0|1,0,0]=3 3936 B20R3.2040304 CCCCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000210210 [1,0,0,1,0,0|1,1,0]=4 3937 B20R3.2040304 COCCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100011201679 [1,0,0,1,0,0|2,0,0]=4 3938 B20R3.2040304 COCCNC1c2ccccc2-c3c1cccc3 2230a_100000209980_100000211598 [1,0,0,1,0,0|2,0,0]=4 3939 B20R3.2040304 COCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000233755 [1,0,0,1,0,0|1,0,0]=3 3940 B20R3.2040304 COCCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000233755 [1,0,0,1,0,0|1,1,0]=4 3941 B20R3.2040304 CSCCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000751147 [1,0,0,1,0,0|2,0,0]=4 3942 B20R3.2040304 CSCCNC1c2ccccc2-c3c1cccc3 2230a_100020590264_100000211598 [1,0,0,1,0,0|2,0,0]=4 3943 B20R3.2040304 CSCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000212216 [1,0,0,1,0,0|1,0,0]=3 3944 B20R3.2040304 CSCCOC1c2ccccc2-c3c1cccc3 7a_100000230434_100000211598 [1,0,0,1,0,0|1,0,0]=3 3945 B20R3.2040304 CSCCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000751147 [1,0,0,1,0,0|1,1,0]=4 3946 B20R3.2040304 FCCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100011934791 [1,0,0,1,0,0|2,0,0]=4 3947 B20R3.2040304 N#CCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000184422 [1,0,0,1,0,0|2,0,0]=4 3948 B20R3.2040304 OCCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100011215043 [1,0,0,1,0,0|2,0,0]=4 3949 B20R3.14162 CN1CC(C1)NC(c2ccccc2)c3cccs3 270004a_100015196640_100011214959 [0,0,0,1,1,0|2,0,0]=4 3950 B20R3.8612 CC1CN(C1)C(c2ccccc2)c3ccccc3 2230a_100000702820_100000211591 [0,0,0,1,1,0|2,0,0]=4 3951 B20R3.8612 CC1CN(C1)C(c2ccccc2)c3ccccc3 269982a_100000702820_100000211591 [0,0,0,1,1,0|2,0,0]=4 3952 B20R3.8612 CC1CN(C1)C(c2ccccc2)c3ccccc3 270004a_100000702820_100000210122 [0,0,0,1,1,0|2,0,0]=4 3953 B20R3.651490 C=C(C)COC1c2ccccc2-c3c1cccc3 7a_100000211495_100000748629 [0,0,0,1,1,0|1,0,1]=4 3954 B20R3.651490 CC(C)CNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000210760 [0,0,0,1,1,0|2,0,0]=4 3955 B20R3.651490 CC(C)CNC1c2ccccc2-c3c1cccc3 2230a_100000210953_100000211598 [0,0,0,1,1,0|2,0,0]=4 3956 B20R3.651490 CC(C)CNC1c2ccccc2-c3c1cccc3 270004a_100000104097_100000210432 [0,0,0,1,1,0|2,0,0]=4 3957 B20R3.651490 CC(C)COC1c2ccccc2-c3c1cccc3 7a_100000211495_100000210760 [0,0,0,1,1,0|1,0,0]=3 3958 B20R3.651490 CC(C)CSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000210760 [0,0,0,1,1,0|1,1,0]=4 3959 B20R3.651490 CC(C)NCC1c2ccccc2-c3c1cccc3 2230a_100016995487_100000210206 [0,0,0,1,1,0|2,0,0]=4 3960 B20R3.651490 CC(C)NCC1c2ccccc2-c3c1cccc3 34a_100016995487_100000210206 [0,0,0,1,1,0|2,0,0]=4 3961 B20R3.651490 CC(C)OCC1c2ccccc2-c3c1cccc3 34a_100011215202_100000210206 [0,0,0,1,1,0|2,0,0]=4 3962 B20R3.651490 CC(C)OCC1c2ccccc2-c3c1cccc3 7a_100011215202_100000210206 [0,0,0,1,1,0|2,0,0]=4 3963 B20R3.651490 CC(O)COC1c2ccccc2-c3c1cccc3 7a_100000211495_100011218427 [0,0,0,1,1,0|2,0,0]=4 3964 B20R3.651490 C[C@@H](O)COC1c2ccccc2-c3c1cccc3 7a_100000211495_100009817552 [0,0,0,1,1,0|2,0,0]=4 3965 B22R3.10919 CC1CCC(C1)NC(c2ccccc2)c3ccccc3 270004a_100000162943_100011215218 [0,0,0,1,0,1|2,0,0]=4 3966 B22R3.10919 CN1CCC(C1)NC(c2ccccc2)c3ccccc3 270004a_100000744687_100000210122 [0,0,0,1,0,1|1,0,0]=3 3967 B22R3.10919 CN1CCC(C1)NC(c2ccccc2)c3ccccn3 270004a_100000744687_100000210380 [0,0,0,1,0,1|2,0,0]=4 3968 B22R3.10919 CN1CCC(C1)NC(c2ccccc2)c3cccnc3 270004a_100000744687_100000735413 [0,0,0,1,0,1|2,0,0]=4 3969 B22R3.10919 CN1CCC(C1)OC(c2ccccc2)c3ccccc3 7a_100000211180_200012183744 [0,0,0,1,0,1|0,0,0]=2 3970 B22R3.10919 CN1CCC(C1)OC(c2ccccc2)c3ccccn3 7a_100000180852_200012183744 [0,0,0,1,0,1|1,0,0]=3 3971 B22R3.10919 CN1CCC(C1)SC(c2ccccc2)c3ccccc3 62a_100000211591_200012183744 [0,0,0,1,0,1|0,1,0]=3 3972 B22R3.12622 CC1(CCCN1C(c2ccccc2)c3ccccc3)C 2230a_100000761399_100000211591 [0,0,0,1,0,1|2,0,0]=4 3973 B22R3.12622 CC1(CCCN1C(c2ccccc2)c3ccccc3)C 269982a_100000761399_100000211591 [0,0,0,1,0,1|2,0,0]=4 3974 B22R3.12622 CC1(CCCN1C(c2ccccc2)c3ccccc3)C 270004a_100000761399_100000210122 [0,0,0,1,0,1|2,0,0]=4 3975 B22R3.12622 CC1(COCN1C(c2ccccc2)c3ccccc3)C 2230a_100000043020_100000211591 [0,0,0,1,0,1|2,0,0]=4 3976 B22R3.12622 CC1(COCN1C(c2ccccc2)c3ccccc3)C 269982a_100000043020_100000211591 [0,0,0,1,0,1|2,0,0]=4 3977 B22R3.12622 CC1(COCN1C(c2ccccc2)c3ccccc3)C 270004a_100000043020_100000210122 [0,0,0,1,0,1|2,0,0]=4 3978 B22R3.12622 CC1(SCCN1C(c2ccccc2)c3ccccc3)C 2230a_100011217261_100000211591 [0,0,0,1,0,1|2,0,0]=4 3979 B22R3.12622 CC1(SCCN1C(c2ccccc2)c3ccccc3)C 269982a_100011217261_100000211591 [0,0,0,1,0,1|2,0,0]=4 3980 B22R3.12622 CC1(SCCN1C(c2ccccc2)c3ccccc3)C 270004a_100011217261_100000210122 [0,0,0,1,0,1|2,0,0]=4 3981 B22R3.18599 CC1(CC1COC(c2ccccc2)c3ccccc3)C 7a_100000728257_100011216954 [0,0,0,1,0,1|1,0,0]=3 3982 B22R3.18599 CC1(OC1COC(c2ccccc2)c3ccccc3)C 7a_200010283642_100011216954 [0,0,0,1,0,1|1,0,0]=3 3983 B22R3.31859 CC1=CCCN(C1)C(c2ccccc2)c3ccccc3 2230a_100000725631_100000211591 [0,0,0,1,0,1|2,0,0]=4 3984 B22R3.31859 CC1=CCCN(C1)C(c2ccccc2)c3ccccc3 269982a_100000725631_100000211591 [0,0,0,1,0,1|2,0,0]=4 3985 B22R3.31859 CC1=CCCN(C1)C(c2ccccc2)c3ccccc3 270004a_100000725631_100000210122 [0,0,0,1,0,1|2,0,0]=4 3986 B22R3.31859 CC1CN(CCO1)C(c2ccccc2)c3ccccc3 2230a_100000729577_100000211591 [0,0,0,1,0,1|2,0,0]=4 3987 B22R3.31859 CC1CN(CCO1)C(c2ccccc2)c3ccccc3 269982a_100000729577_100000211591 [0,0,0,1,0,1|2,0,0]=4 3988 B22R3.31859 CC1CN(CCO1)C(c2ccccc2)c3ccccc3 270004a_100000729577_100000210122 [0,0,0,1,0,1|2,0,0]=4 3989 B22R3.31859 C[C@H]1CCCN(C1)C(c2ccccc2)c3ccccc3 2230a_100000717927_100000211591 [0,0,0,1,0,1|2,0,0]=4 3990 B22R3.31859 C[C@H]1CCCN(C1)C(c2ccccc2)c3ccccc3 269982a_100000717927_100000211591 [0,0,0,1,0,1|2,0,0]=4 3991 B22R3.31859 C[C@H]1CCCN(C1)C(c2ccccc2)c3ccccc3 270004a_100000717927_100000210122 [0,0,0,1,0,1|2,0,0]=4 3992 B22R3.74275 C(#CC1CC1)COC(c2ccccc2)c3ccccc3 34a_100000211180_100009895102 [0,0,0,1,0,1|1,0,1]=4 3993 B22R3.74275 C(#CC1CC1)COC(c2ccccc2)c3ccccc3 7a_100000083941_100011216954 [0,0,0,1,0,1|1,0,1]=4 3994 B22R3.74275 C(#CC1CC1)COC(c2ccccc2)c3ccccc3 7a_100000211180_100009895102 [0,0,0,1,0,1|1,0,1]=4 3995 B22R3.74275 c1ccc(cc1)C(CCNCC2CC2)c3ccccc3 2230a_100000272388_100000742324 [0,0,0,1,0,1|2,0,0]=4 3996 B22R3.74275 c1ccc(cc1)C(CCNCC2CC2)c3ccccc3 2230a_100000735609_100009813428 [0,0,0,1,0,1|2,0,0]=4 3997 B22R3.74275 c1ccc(cc1)C(CCNCC2CC2)c3ccccc3 269862a_100000272388_100000741477 [0,0,0,1,0,1|2,0,0]=4 3998 B22R3.74275 c1ccc(cc1)C(CCNCC2CC2)c3ccccc3 34a_100000272388_100000742324 [0,0,0,1,0,1|2,0,0]=4 3999 B22R3.74275 c1ccc(cc1)C(CCNCC2CC2)c3ccccc3 34a_100000735609_100009813428 [0,0,0,1,0,1|2,0,0]=4 4000 B22R3.74275 c1ccc(cc1)C(CCOCC2CC2)c3ccccc3 34a_100000032380_100000742324 [0,0,0,1,0,1|2,0,0]=4 4001 B22R3.74275 c1ccc(cc1)C(CCOCC2CC2)c3ccccc3 34a_100000211283_100009813428 [0,0,0,1,0,1|2,0,0]=4 4002 B22R3.74275 c1ccc(cc1)C(CCOCC2CC2)c3ccccc3 7a_100000032380_100000742324 [0,0,0,1,0,1|2,0,0]=4 4003 B22R3.74275 c1ccc(cc1)C(CCSCC2CC2)c3ccccc3 62a_100000756562_100009813428 [0,0,0,1,0,1|2,0,0]=4 4004 B22R3.74275 c1ccc(cc1)C(CCSCC2CC2)c3ccccc3 62a_100009813428_100000742324 [0,0,0,1,0,1|2,0,0]=4 4005 B22R3.74275 c1ccc(cc1)C(CNCCC2CC2)c3ccccc3 2230a_100000739227_100000694398 [0,0,0,1,0,1|2,0,0]=4 4006 B22R3.74275 c1ccc(cc1)C(CNCCC2CC2)c3ccccc3 34a_100000739227_100000694398 [0,0,0,1,0,1|2,0,0]=4 4007 B22R3.74275 c1ccc(cc1)C(COCCC2CC2)c3ccccc3 34a_100011215272_100000694398 [0,0,0,1,0,1|1,0,0]=3 4008 B22R3.74275 c1ccc(cc1)C(COCCC2CC2)c3ccccc3 7a_100011215272_100000764125 [0,0,0,1,0,1|1,0,0]=3 4009 B22R3.74275 c1ccc(cc1)C(COCCC2CO2)c3ccccc3 34a_100011215272_100000732470 [0,0,0,1,0,1|2,0,0]=4 4010 B22R3.74275 c1ccc(cc1)C(COCCC2CO2)c3ccccc3 7a_100011215272_100000732470 [0,0,0,1,0,1|2,0,0]=4 4011 B22R3.74275 c1ccc(cc1)C(OCCCC2CO2)c3ccccc3 34a_100000211180_100000733510 [0,0,0,1,0,1|2,0,0]=4 4012 B22R3.74275 c1ccc(cc1)C(OCCCC2CO2)c3ccccc3 7a_100000211180_100000733510 [0,0,0,1,0,1|2,0,0]=4 4013 B22R3.74275 c1ccc(cc1)C(OCCNC2CC2)c3ccccc3 34a_100000212008_100000734929 [0,0,0,1,0,1|1,0,0]=3 4014 B22R3.74275 c1ccc(cc1)C(OCCSC2CC2)c3ccccc3 62a_100000734929_100000211595 [0,0,0,1,0,1|1,0,0]=3 4015 B22R3.369172 CC1CN(C1)CCC(c2ccccc2)c3ccccc3 2230a_100000702820_100009813428 [0,0,0,1,0,1|2,0,0]=4 4016 B22R3.369172 CC1CN(C1)CCC(c2ccccc2)c3ccccc3 269982a_100000702820_100009813428 [0,0,0,1,0,1|2,0,0]=4 4017 B22R3.369172 CC1CN(C1)CCC(c2ccccc2)c3ccccc3 34a_100000702820_100009813428 [0,0,0,1,0,1|2,0,0]=4 4018 B22R3.369172 CN1CC(C1)CNC(c2ccccc2)c3ccccc3 270004a_100000723568_100000210122 [0,0,0,1,0,1|1,0,0]=3 4019 B22R3.369172 CN1CC(C1)CNC(c2ccccc2)c3ccccn3 270004a_100000723568_100000210380 [0,0,0,1,0,1|2,0,0]=4 4020 B22R3.369172 CN1CC(C1)CNC(c2ccccc2)c3cccnc3 270004a_100000723568_100000735413 [0,0,0,1,0,1|2,0,0]=4 4021 B22R3.369172 O=C1CC(C1)COC(c2ccccc2)c3ccccc3 7a_100000211180_100009874392 [0,0,0,1,0,1|2,0,0]=4 4022 B22R3.12316512 C=C(C)CCOCC1c2ccccc2-c3c1cccc3 34a_100011215202_100000730704 [0,0,0,1,0,1|1,0,1]=4 4023 B22R3.12316512 C=C(C)CCOCC1c2ccccc2-c3c1cccc3 7a_100011215202_100000730704 [0,0,0,1,0,1|1,0,1]=4 4024 B22R3.12316512 CC(=CCCNC1c2ccccc2-c3c1cccc3)C 2230a_100000104097_100011217483 [0,0,0,1,0,1|2,0,0]=4 4025 B22R3.12316512 CC(=CCCOC1c2ccccc2-c3c1cccc3)C 7a_100000211495_100011217483 [0,0,0,1,0,1|1,0,0]=3 4026 B22R3.12316512 CC(=CCCSC1c2ccccc2-c3c1cccc3)C 62a_100000211598_100011217483 [0,0,0,1,0,1|1,1,0]=4 4027 B22R3.12316512 CC(=CCOCC1c2ccccc2-c3c1cccc3)C 34a_100011215202_100000761012 [0,0,0,1,0,1|1,0,1]=4 4028 B22R3.12316512 CC(=CCOCC1c2ccccc2-c3c1cccc3)C 7a_100011215202_100000761012 [0,0,0,1,0,1|1,0,1]=4 4029 B22R3.12316512 CC(=O)CCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100011215641 [0,0,0,1,0,1|2,0,0]=4 4030 B22R3.12316512 CC(=O)CCCOC1c2ccccc2-c3c1cccc3 7a_100000759063_100000211598 [0,0,0,1,0,1|2,0,0]=4 4031 B22R3.12316512 CC(=O)CCOCC1c2ccccc2-c3c1cccc3 7a_100011215202_100000053229 [0,0,0,1,0,1|2,0,0]=4 4032 B22R3.12316512 CC(=O)NCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000189650 [0,0,0,1,0,1|2,0,0]=4 4033 B22R3.12316512 CC(=O)OCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100009814007 [0,0,0,1,0,1|2,0,0]=4 4034 B22R3.12316512 CC(C)CCCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100011214892 [0,0,0,1,0,1|2,0,0]=4 4035 B22R3.12316512 CC(C)CCCNC1c2ccccc2-c3c1cccc3 2230a_200000737386_100000211598 [0,0,0,1,0,1|2,0,0]=4 4036 B22R3.12316512 CC(C)CCCOC1c2ccccc2-c3c1cccc3 7a_100000210774_100000211598 [0,0,0,1,0,1|1,0,0]=3 4037 B22R3.12316512 CC(C)CCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100011214892 [0,0,0,1,0,1|1,0,0]=3 4038 B22R3.12316512 CC(C)CCCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100011214892 [0,0,0,1,0,1|1,1,0]=4 4039 B22R3.12316512 CC(C)CCNCC1c2ccccc2-c3c1cccc3 2230a_100016995487_100000210312 [0,0,0,1,0,1|2,0,0]=4 4040 B22R3.12316512 CC(C)CCNCC1c2ccccc2-c3c1cccc3 269862a_100016995487_100000185833 [0,0,0,1,0,1|2,0,0]=4 4041 B22R3.12316512 CC(C)CCNCC1c2ccccc2-c3c1cccc3 34a_100016995487_100000210312 [0,0,0,1,0,1|2,0,0]=4 4042 B22R3.12316512 CC(C)CCOCC1c2ccccc2-c3c1cccc3 34a_100011215202_100000210312 [0,0,0,1,0,1|1,0,0]=3 4043 B22R3.12316512 CC(C)CCOCC1c2ccccc2-c3c1cccc3 7a_100011215202_100000210626 [0,0,0,1,0,1|1,0,0]=3 4044 B22R3.12316512 CC(C)OCCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000211751 [0,0,0,1,0,1|2,0,0]=4 4045 B22R3.12316512 CC(C)OCCNC1c2ccccc2-c3c1cccc3 2230a_100000701111_100000211598 [0,0,0,1,0,1|2,0,0]=4 4046 B22R3.12316512 CC(C)OCCOC1c2ccccc2-c3c1cccc3 7a_100000211219_100000211598 [0,0,0,1,0,1|1,0,0]=3 4047 B22R3.12316512 CC(C)OCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000211751 [0,0,0,1,0,1|1,0,0]=3 4048 B22R3.12316512 CC(C)OCCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000211751 [0,0,0,1,0,1|1,1,0]=4 4049 B22R3.12316512 CC(C)OCOCC1c2ccccc2-c3c1cccc3 34a_100011215202_100000709892 [0,0,0,1,0,1|2,0,0]=4 4050 B22R3.12316512 CC(C)SCCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000730970 [0,0,0,1,0,1|2,0,0]=4 4051 B22R3.12316512 CC(C)SCCNC1c2ccccc2-c3c1cccc3 2230a_100000731138_100000211598 [0,0,0,1,0,1|2,0,0]=4 4052 B22R3.12316512 CC(C)SCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000730970 [0,0,0,1,0,1|1,0,0]=3 4053 B22R3.12316512 CC(C)SCCOC1c2ccccc2-c3c1cccc3 7a_200011212901_100000211598 [0,0,0,1,0,1|1,0,0]=3 4054 B22R3.12316512 CC(C)SCCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000730970 [0,0,0,1,0,1|1,1,0]=4 4055 B22R3.12316512 CC(O)CCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_200000718107 [0,0,0,1,0,1|2,0,0]=4 4056 B22R3.12316512 CC(O)CCOCC1c2ccccc2-c3c1cccc3 34a_100011215202_100012276601 [0,0,0,1,0,1|2,0,0]=4 4057 B22R3.12316512 CC(O)CCOCC1c2ccccc2-c3c1cccc3 7a_100011215202_100012276601 [0,0,0,1,0,1|2,0,0]=4 4058 B22R3.12316512 CN(C)CCCCn1c2ccccc2c3c1cccc3 2230a_100102631434_100000426982 [0,0,0,1,0,1|2,0,0]=4 4059 B22R3.12316512 CN(C)CCCCn1c2ccccc2c3c1cccc3 269982a_100102631434_100000426982 [0,0,0,1,0,1|2,0,0]=4 4060 B22R3.12316512 CN(C)CCCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000757444 [0,0,0,1,0,1|0,0,0]=2 4061 B22R3.12316512 CN(C)CCCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000757444 [0,0,0,1,0,1|0,1,0]=3 4062 B22R3.12316512 CN(C)CCOCC1c2ccccc2-c3c1cccc3 7a_100011215202_100000755713 [0,0,0,1,0,1|0,0,0]=2 4063 B22R3.10812 CN1CCC(C1)N(Cc2ccccc2)c3ccccc3 269982a_100000188819_200012183744 [0,0,0,1,0,1|2,0,0]=4 4064 B22R3.74328 c1ccc(cc1)CC(NCCC2CC2)c3ccccc3 2230a_100025772854_100000694398 [0,0,0,1,0,1|2,0,0]=4 4065 B22R3.74328 c1ccc(cc1)CC(OCCC2CC2)c3ccccc3 34a_100000246494_100000694398 [0,0,0,1,0,1|1,0,0]=3 4066 B22R3.74328 c1ccc(cc1)CC(OCCC2CC2)c3ccccc3 7a_100000246494_100000764125 [0,0,0,1,0,1|1,0,0]=3 4067 B22R3.74328 c1ccc(cc1)CC(OCCC2CO2)c3ccccc3 34a_100000246494_100000732470 [0,0,0,1,0,1|2,0,0]=4 4068 B22R3.74328 c1ccc(cc1)CC(OCCC2CO2)c3ccccc3 7a_100000246494_100000732470 [0,0,0,1,0,1|2,0,0]=4 4069 B22R3.12390641 CC(C)CCOc1cc2ccccc2c3c1cccc3 34a_100000036577_100000210312 [0,0,0,1,0,1|1,0,1]=4 4070 B22R3.12390641 CC(C)CCOc1cc2ccccc2c3c1cccc3 7a_100000036577_100000210626 [0,0,0,1,0,1|1,0,1]=4 4071 B22R3.12390641 CN(C)CCNc1nc2ccccc2c3c1cccc3 27a_100000210585_100000028652 [0,0,0,1,0,1|1,0,1]=4 4072 B22R3.12390641 CN(C)CCOc1cc2ccccc2c3c1cccc3 7a_100000036577_100000755713 [0,0,0,1,0,1|0,0,1]=3 4073 B22R3.1191 CC1=CCN(CC1)C(c2ccccc2)c3ccccc3 2230a_100000693516_100000211591 [0,1,0,1,0,0|2,0,0]=4 4074 B22R3.1191 CC1=CCN(CC1)C(c2ccccc2)c3ccccc3 269982a_100000693516_100000211591 [0,1,0,1,0,0|2,0,0]=4 4075 B22R3.1191 CC1=CCN(CC1)C(c2ccccc2)c3ccccc3 270004a_100000693516_100000210122 [0,1,0,1,0,0|2,0,0]=4 4076 B22R3.1191 CC1CCN(CC1)C(c2ccccc2)c3ccccc3 2230a_100000188429_100000211591 [0,1,0,1,0,0|2,0,0]=4 4077 B22R3.1191 CC1CCN(CC1)C(c2ccccc2)c3ccccc3 269982a_100000188429_100000211591 [0,1,0,1,0,0|2,0,0]=4 4078 B22R3.1191 CC1CCN(CC1)C(c2ccccc2)c3ccccc3 270004a_100000188429_100000210122 [0,1,0,1,0,0|2,0,0]=4 4079 B22R3.1191 CN1CCC(=C(c2ccccc2)c3ccccc3)CC1 2230a_100015372603_200000210301 [0,1,0,1,0,0|1,0,1]=4 4080 B22R3.1191 CN1CCC(=C(c2ccccc2)c3ccccc3)CC1 269982a_100015372603_200000210301 [0,1,0,1,0,0|1,0,1]=4 4081 B22R3.1191 CN1CCN(CC1)C(c2ccccc2)c3ccccc3 2230a_100000188432_100000211591 [0,1,0,1,0,0|1,0,0]=3 4082 B22R3.1191 CN1CCN(CC1)C(c2ccccc2)c3ccccc3 2230a_100000723562_200000210301 [0,1,0,1,0,0|1,0,0]=3 4083 B22R3.1191 CN1CCN(CC1)C(c2ccccc2)c3ccccc3 269982a_100000188432_100000211591 [0,1,0,1,0,0|1,0,0]=3 4084 B22R3.1191 CN1CCN(CC1)C(c2ccccc2)c3ccccc3 269982a_100000723562_200000210301 [0,1,0,1,0,0|1,0,0]=3 4085 B22R3.1191 CN1CCN(CC1)C(c2ccccc2)c3ccccc3 270004a_100000188432_100000210122 [0,1,0,1,0,0|1,0,0]=3 4086 B22R3.1191 CN1CCN(CC1)C(c2ccccc2)c3ccccn3 270004a_100000188432_100000210380 [0,1,0,1,0,0|2,0,0]=4 4087 B22R3.1191 CN1CCN(CC1)C(c2ccccc2)c3cccnc3 270004a_100000188432_100000735413 [0,1,0,1,0,0|2,0,0]=4 4088 B22R3.1191 [13CH3]N1CCC(=C(c2ccccc2)c3ccccc3)CC1 2230a_100015372603_200025704644 [0,1,0,1,0,0|1,0,1]=4 4089 B22R3.1191 [13CH3]N1CCC(=C(c2ccccc2)c3ccccc3)CC1 269982a_100015372603_200025704644 [0,1,0,1,0,0|1,0,1]=4 4090 B22R3.1191 [13CH3]N1CCN(CC1)C(c2ccccc2)c3ccccc3 2230a_100000723562_200025704644 [0,1,0,1,0,0|1,0,0]=3 4091 B22R3.1191 [13CH3]N1CCN(CC1)C(c2ccccc2)c3ccccc3 269982a_100000723562_200025704644 [0,1,0,1,0,0|1,0,0]=3 4092 B22R3.4900 CO[C@@H]1CCN(C1)C(c2ccccc2)c3ccccc3 2230a_100000766984_100000211591 [0,1,0,1,0,0|2,0,0]=4 4093 B22R3.4900 CO[C@@H]1CCN(C1)C(c2ccccc2)c3ccccc3 269982a_100000766984_100000211591 [0,1,0,1,0,0|2,0,0]=4 4094 B22R3.4900 CO[C@@H]1CCN(C1)C(c2ccccc2)c3ccccc3 270004a_100000766984_100000210122 [0,1,0,1,0,0|2,0,0]=4 4095 B22R3.4900 OCC1CCN(C1)C(c2ccccc2)c3ccccc3 2230a_100000748654_100000211591 [0,1,0,1,0,0|2,0,0]=4 4096 B22R3.4900 OCC1CCN(C1)C(c2ccccc2)c3ccccc3 269982a_100000748654_100000211591 [0,1,0,1,0,0|2,0,0]=4 4097 B22R3.4900 OCC1CCN(C1)C(c2ccccc2)c3ccccc3 270004a_100000748654_100000210122 [0,1,0,1,0,0|2,0,0]=4 4098 B22R3.58658 CCN1CC(C1)NC(c2ccccc2)c3ccccc3 2230a_200015199589_100000211591 [0,1,0,1,0,0|1,0,0]=3 4099 B22R3.58658 CO[C@H]1C[C@@H](C1)NC(c2ccccc2)c3ccccc3 2230a_100121570643_100000211591 [0,1,0,1,0,0|2,0,0]=4 4100 B22R3.58658 CO[C@H]1C[C@@H](C1)NC(c2ccccc2)c3ccccc3 270004a_100121570643_100000210122 [0,1,0,1,0,0|2,0,0]=4 4101 B22R3.58658 OCC1CC(C1)NC(c2ccccc2)c3ccccc3 270004a_100000095622_100000210122 [0,1,0,1,0,0|2,0,0]=4 4102 B22R3.58658 OCC1CC(C1)NC(c2ccccc2)c3ccccc3 270004a_100000162943_100000101936 [0,1,0,1,0,0|2,0,0]=4 4103 B22R3.58658 OCC1CC(C1)SC(c2ccccc2)c3ccccc3 62a_100000211591_100009874164 [0,1,0,1,0,0|1,1,0]=4 4104 B22R3.58658 OCC1CC(C1)SC(c2ccccc2)c3ccccc3 62a_100009874164_100011216954 [0,1,0,1,0,0|1,1,0]=4 4105 B22R3.3018053 c1ccc(cc1)C(OCCN2CCC2)c3ccccc3 269982a_100000754969_100000734929 [0,1,0,1,0,0|0,0,0]=2 4106 B22R3.16272594 CC(CO)CCNC1c2ccccc2-c3c1cccc3 2230a_106354213184_100000211598 [0,1,0,1,0,0|2,0,0]=4 4107 B22R3.16272594 CCC(C)CCNC1c2ccccc2-c3c1cccc3 2230a_100020591266_100000211598 [0,1,0,1,0,0|2,0,0]=4 4108 B22R3.16272594 CCC(C)CCOC1c2ccccc2-c3c1cccc3 7a_100011215188_100000211598 [0,1,0,1,0,0|1,0,0]=3 4109 B22R3.16272594 CNC(=O)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000737683 [0,1,0,1,0,0|2,0,0]=4 4110 B22R3.16272594 COC(=O)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000204255 [0,1,0,1,0,0|2,0,0]=4 4111 B22R3.16272594 COC(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000764861_100000211598 [0,1,0,1,0,0|1,0,0]=3 4112 B22R3.11283 C[C@@H]1CN(C[C@@H]1O)C(c2ccccc2)c3ccccc3 2230a_200015306588_100000211591 [0,1,0,1,0,0|2,0,0]=4 4113 B22R3.11283 C[C@@H]1CN(C[C@@H]1O)C(c2ccccc2)c3ccccc3 269982a_200015306588_100000211591 [0,1,0,1,0,0|2,0,0]=4 4114 B22R3.11283 C[C@@H]1CN(C[C@@H]1O)C(c2ccccc2)c3ccccc3 270004a_200015306588_100000210122 [0,1,0,1,0,0|2,0,0]=4 4115 B22R3.212965 O=C(COC(c1ccccc1)c2ccccc2)C3CC3 34a_100000211180_100000746382 [0,1,0,1,0,0|1,0,1]=4 4116 B22R3.212965 O=C(COC(c1ccccc1)c2ccccc2)C3CC3 7a_100000211180_100000746382 [0,1,0,1,0,0|1,0,1]=4 4117 B22R3.212965 OC(CNC(c1ccccc1)c2ccccc2)C3CC3 2230a_100000751198_100000211591 [0,1,0,1,0,0|2,0,0]=4 4118 B22R3.212965 OC(CNC(c1ccccc1)c2ccccc2)C3CC3 270004a_100000751198_100000210122 [0,1,0,1,0,0|2,0,0]=4 4119 B22R3.771283 CN(C)C1CN(C1)C(c2ccccc2)c3ccccc3 2230a_200016989689_200000210301 [0,1,0,1,0,0|1,0,0]=3 4120 B22R3.771283 CN(C)C1CN(C1)C(c2ccccc2)c3ccccc3 269982a_100000694738_100000211591 [0,1,0,1,0,0|1,0,0]=3 4121 B22R3.771283 CN(C)C1CN(C1)C(c2ccccc2)c3ccccc3 269982a_100102631434_100016989415 [0,1,0,1,0,0|1,0,0]=3 4122 B22R3.771283 CN(C)C1CN(C1)C(c2ccccc2)c3ccccc3 269982a_200016989689_200000210301 [0,1,0,1,0,0|1,0,0]=3 4123 B22R3.771283 CN(C)C1CN(C1)C(c2ccccc2)c3ccccc3 270004a_100000694738_100000210122 [0,1,0,1,0,0|1,0,0]=3 4124 B22R3.771283 CN(C)C1CN(C1)C(c2ccccc2)c3ccccn3 270004a_100000694738_100000210380 [0,1,0,1,0,0|2,0,0]=4 4125 B22R3.771283 CN(C)C1CN(C1)C(c2ccccc2)c3cccnc3 270004a_100000694738_100000735413 [0,1,0,1,0,0|2,0,0]=4 4126 B22R3.771283 CN([13CH3])C1CN(C1)C(c2ccccc2)c3ccccc3 2230a_200016989689_200025704644 [0,1,0,1,0,0|1,0,0]=3 4127 B22R3.771283 CN([13CH3])C1CN(C1)C(c2ccccc2)c3ccccc3 269982a_200016989689_200025704644 [0,1,0,1,0,0|1,0,0]=3 4128 B22R3.23383988 CC(=O)C(C)COC1c2ccccc2-c3c1cccc3 7a_100000032740_100000211598 [0,1,0,1,0,0|2,0,0]=4 4129 B22R3.23383988 CC(C)C(=O)COC1c2ccccc2-c3c1cccc3 7a_100000211495_100000753385 [0,1,0,1,0,0|1,0,1]=4 4130 B22R3.23383988 CC(C)C(O)CNC1c2ccccc2-c3c1cccc3 2230a_100000759067_100000211598 [0,1,0,1,0,0|2,0,0]=4 4131 B22R3.23383988 CN(C)C(=O)CNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000185267 [0,1,0,1,0,0|1,0,1]=4 4132 B22R3.23383988 CN(C)C(=O)CNC1c2ccccc2-c3c1cccc3 2230a_100015183351_100000211598 [0,1,0,1,0,0|1,0,1]=4 4133 B22R3.23383988 CN(C)C(=O)COC1c2ccccc2-c3c1cccc3 7a_100000211495_100000692301 [0,1,0,1,0,0|0,0,1]=3 4134 B22R3.23383988 CN(C)C(=O)CSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000692301 [0,1,0,1,0,0|0,1,1]=4 4135 B22R3.260141 C[C@@]1(C[C@H](C1)NC(c2ccccc2)c3ccccc3)O 2230a_100121572536_100000211591 [0,1,0,1,0,0|2,0,0]=4 4136 B22R3.260141 C[C@@]1(C[C@H](C1)NC(c2ccccc2)c3ccccc3)O 270004a_100121572536_100000210122 [0,1,0,1,0,0|2,0,0]=4 4137 B22R3.260141 FC1(CC(C1)OC(c2ccccc2)c3ccccc3)F 34a_100000211180_100010741680 [0,1,0,1,0,0|2,0,0]=4 4138 B22R3.260141 FC1(CC(C1)OC(c2ccccc2)c3ccccc3)F 7a_100000211180_100010741680 [0,1,0,1,0,0|2,0,0]=4 4139 B22R3.260141 O=S1(=O)CC(C1)OC(c2ccccc2)c3ccccc3 7a_100000072295_100011216954 [0,1,0,1,0,0|2,0,0]=4 4140 B22R3.260221 CC1(CCN(C1)C(c2ccccc2)c3ccccc3)C 2230a_100000764714_100000211591 [0,1,0,1,0,0|2,0,0]=4 4141 B22R3.260221 CC1(CCN(C1)C(c2ccccc2)c3ccccc3)C 269982a_100000764714_100000211591 [0,1,0,1,0,0|2,0,0]=4 4142 B22R3.260221 CC1(CCN(C1)C(c2ccccc2)c3ccccc3)C 270004a_100000764714_100000210122 [0,1,0,1,0,0|2,0,0]=4 4143 B22R3.260221 CC1(CCN(C1)C(c2ccccc2)c3ccccc3)O 2230a_100000718628_100000211591 [0,1,0,1,0,0|2,0,0]=4 4144 B22R3.260221 CC1(CCN(C1)C(c2ccccc2)c3ccccc3)O 269982a_100000718628_100000211591 [0,1,0,1,0,0|2,0,0]=4 4145 B22R3.260221 CC1(CCN(C1)C(c2ccccc2)c3ccccc3)O 270004a_100000718628_100000210122 [0,1,0,1,0,0|2,0,0]=4 4146 B22R3.219953434 CC(C)(C)CCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000755188 [0,1,0,1,0,0|2,0,0]=4 4147 B22R3.219953434 CC(C)(C)CCNC1c2ccccc2-c3c1cccc3 2230a_100000738805_100000211598 [0,1,0,1,0,0|2,0,0]=4 4148 B22R3.219953434 CC(C)(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000755188 [0,1,0,1,0,0|1,0,0]=3 4149 B22R3.219953434 CC(C)(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000765024_100000211598 [0,1,0,1,0,0|1,0,0]=3 4150 B22R3.219953434 CC(C)(C)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000755188 [0,1,0,1,0,0|1,1,0]=4 4151 B22R3.219953434 CC(C)(F)CCNC1c2ccccc2-c3c1cccc3 2230a_100016253952_100000211598 [0,1,0,1,0,0|2,0,0]=4 4152 B22R3.219953434 CC(C)(O)CCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000702414 [0,1,0,1,0,0|2,0,0]=4 4153 B22R3.219953434 CC(C)(O)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000702414 [0,1,0,1,0,0|1,0,0]=3 4154 B22R3.219953434 CC(C)(O)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000702414 [0,1,0,1,0,0|1,1,0]=4 4155 B22R3.219953434 CS(=O)(=O)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000230027 [0,1,0,1,0,0|2,0,0]=4 4156 B22R3.219953434 CS(=O)(=O)CCOC1c2ccccc2-c3c1cccc3 7a_100000211924_100000211598 [0,1,0,1,0,0|2,0,0]=4 4157 B22R3.219953434 C[N+](C)(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000085578 [0,1,0,1,0,0|0,0,1]=3 4158 B22R3.219953434 C[N+](C)(C)CCOC1c2ccccc2-c3c1cccc3 7a_200020618287_100000211598 [0,1,0,1,0,0|0,0,1]=3 4159 B22R3.219953434 C[N+](C)(C)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000085578 [0,1,0,1,0,0|0,1,1]=4 4160 B22R3.219953434 C[Si](C)(C)CCNC1c2ccccc2-c3c1cccc3 2230a_100000104097_200000733723 [0,1,0,1,0,0|2,0,0]=4 4161 B22R3.219953434 C[Si](C)(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000039746_100000211598 [0,1,0,1,0,0|1,0,0]=3 4162 B22R3.219953434 C[Si](C)(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_200000733723 [0,1,0,1,0,0|1,0,0]=3 4163 B22R3.219953434 C[Si](C)(C)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_200000733723 [0,1,0,1,0,0|1,1,0]=4 4164 B22R3.3256093 CC(CC1CC1)NC(c2ccccc2)c3ccccc3 270004a_100000162943_200000686933 [0,1,0,1,0,0|2,0,0]=4 4165 B22R3.41064905 CC(C)CC(C)NC1c2ccccc2-c3c1cccc3 2230a_100000104097_100000731052 [0,1,0,1,0,0|2,0,0]=4 4166 B22R3.41064905 CC(C)CC(C)NC1c2ccccc2-c3c1cccc3 2230a_100000692259_100000211598 [0,1,0,1,0,0|2,0,0]=4 4167 B22R3.41064905 CC(C)CC(C)OC1c2ccccc2-c3c1cccc3 7a_100000211495_100000731052 [0,1,0,1,0,0|1,0,0]=3 4168 B22R3.41064905 CC(C)CC(C)OC1c2ccccc2-c3c1cccc3 7a_100000211805_100000211598 [0,1,0,1,0,0|1,0,0]=3 4169 B22R3.41064905 CC(C)CC(C)SC1c2ccccc2-c3c1cccc3 62a_100000211598_100000731052 [0,1,0,1,0,0|1,1,0]=4 4170 B22R3.41064905 CC(CN(C)C)SC1c2ccccc2-c3c1cccc3 62a_100000211598_100020606517 [0,1,0,1,0,0|0,1,0]=3 4171 B22R3.41064905 CN(C)CC(=O)NC1c2ccccc2-c3c1cccc3 11a_100000104097_100000750896 [0,1,0,1,0,0|1,0,1]=4 4172 B22R3.41064905 CN(C)CC(=O)NC1c2ccccc2-c3c1cccc3 240690a_100000104097_100000750896 [0,1,0,1,0,0|1,0,1]=4 4173 B22R3.709175 C[C@@H]1CCN(C1)C(c2ccccc2)c3cccc(c3)Br 270004a_100016987628_100011267660 [0,1,0,1,0,0|2,0,0]=4 4174 B22R3.709175 C[C@@H]1CCN(C1)C(c2ccccc2)c3cccc(c3)Cl 270004a_100016987628_100011215489 [0,1,0,1,0,0|2,0,0]=4 4175 B22R3.709175 C[C@@H]1CCN(C1)C(c2ccccc2)c3cccc(c3)F 270004a_100016987628_200011219850 [0,1,0,1,0,0|2,0,0]=4 4176 B22R3.709175 Cc1cccc(c1)C(c2ccccc2)N3CC[C@H](C3)C 270004a_100016987628_100011217825 [0,1,0,1,0,0|2,0,0]=4 4177 B22R3.709181 Brc1cccc(c1)C(NCCC2CC2)c3ccccc3 2230a_100011212009_100000694398 [0,1,0,1,0,0|2,0,0]=4 4178 B22R3.709181 Brc1cccc(c1)C(NCCC2CC2)c3ccccc3 270004a_100000764129_100011267660 [0,1,0,1,0,0|2,0,0]=4 4179 B22R3.709181 Brc1cccc(c1)C(NCCC2CC2)c3ccccc3 34a_100011212009_100000694398 [0,1,0,1,0,0|2,0,0]=4 4180 B22R3.709181 Cc1cccc(c1)C(NCCC2CC2)c3ccccc3 270004a_100000764129_100011217825 [0,1,0,1,0,0|2,0,0]=4 4181 B22R3.709181 Clc1cccc(c1)C(NCCC2CC2)c3ccccc3 2230a_100000741085_100000694398 [0,1,0,1,0,0|2,0,0]=4 4182 B22R3.709181 Clc1cccc(c1)C(NCCC2CC2)c3ccccc3 270004a_100000764129_100011215489 [0,1,0,1,0,0|2,0,0]=4 4183 B22R3.709181 Clc1cccc(c1)C(NCCC2CC2)c3ccccc3 34a_100000741085_100000694398 [0,1,0,1,0,0|2,0,0]=4 4184 B22R3.709181 Clc1cccc(c1)C(OCCC2CC2)c3ccccc3 34a_100000733576_100000694398 [0,1,0,1,0,0|1,0,0]=3 4185 B22R3.709181 Clc1cccc(c1)C(OCCC2CC2)c3ccccc3 7a_100000733576_100000764125 [0,1,0,1,0,0|1,0,0]=3 4186 B22R3.709181 Clc1cccc(c1)C(OCCC2CO2)c3ccccc3 34a_100000733576_100000732470 [0,1,0,1,0,0|2,0,0]=4 4187 B22R3.709181 Clc1cccc(c1)C(OCCC2CO2)c3ccccc3 7a_100000733576_100000732470 [0,1,0,1,0,0|2,0,0]=4 4188 B22R3.709181 Fc1cccc(c1)C(NCCC2CC2)c3ccccc3 2230a_100000686443_100000694398 [0,1,0,1,0,0|2,0,0]=4 4189 B22R3.709181 Fc1cccc(c1)C(NCCC2CC2)c3ccccc3 270004a_100000764129_200011219850 [0,1,0,1,0,0|2,0,0]=4 4190 B22R3.709181 Fc1cccc(c1)C(NCCC2CC2)c3ccccc3 34a_100000686443_100000694398 [0,1,0,1,0,0|2,0,0]=4 4191 B22R3.709181 Fc1cccc(c1)C(OCCC2CC2)c3ccccc3 34a_100000749007_100000694398 [0,1,0,1,0,0|1,0,0]=3 4192 B22R3.709181 Fc1cccc(c1)C(OCCC2CC2)c3ccccc3 7a_100000749007_100000764125 [0,1,0,1,0,0|1,0,0]=3 4193 B22R3.709181 Fc1cccc(c1)C(OCCC2CO2)c3ccccc3 34a_100000749007_100000732470 [0,1,0,1,0,0|2,0,0]=4 4194 B22R3.709181 Fc1cccc(c1)C(OCCC2CO2)c3ccccc3 7a_100000749007_100000732470 [0,1,0,1,0,0|2,0,0]=4 4195 B22R3.5451123 CN1CC(C1)NC(c2cccc(c2)Cl)c3ccccn3 270004a_100015196640_100000688346 [0,1,0,1,0,0|2,0,0]=4 4196 B22R3.5451123 CN1CC(C1)NC(c2ccccc2)c3cccc(c3)Br 270004a_100015196640_100011267660 [0,1,0,1,0,0|1,0,0]=3 4197 B22R3.5451123 CN1CC(C1)NC(c2ccccc2)c3cccc(c3)Cl 270004a_100015196640_100011215489 [0,1,0,1,0,0|1,0,0]=3 4198 B22R3.5451123 CN1CC(C1)NC(c2ccccc2)c3cccc(c3)F 270004a_100015196640_200011219850 [0,1,0,1,0,0|1,0,0]=3 4199 B22R3.5451123 CN1CC(C1)NC(c2ccccc2)c3cncc(c3)Br 270004a_100015196640_100011267668 [0,1,0,1,0,0|2,0,0]=4 4200 B22R3.5451123 CN1CC(C1)NC(c2cccnc2)c3cccc(c3)Cl 270004a_100015196640_100000752423 [0,1,0,1,0,0|2,0,0]=4 4201 B22R3.5451123 Cc1cccc(c1)C(NC2CN(C2)C)c3ccccc3 270004a_100015196640_100011217825 [0,1,0,1,0,0|1,0,0]=3 4202 B22R3.27382 Brc1ccccc1C(NCCC2CC2)c3ccccc3 2230a_100011211563_100000694398 [0,1,0,1,0,0|2,0,0]=4 4203 B22R3.27382 Brc1ccccc1C(NCCC2CC2)c3ccccc3 270004a_100000764129_100000198044 [0,1,0,1,0,0|2,0,0]=4 4204 B22R3.27382 Brc1ccccc1C(NCCC2CC2)c3ccccc3 34a_100011211563_100000694398 [0,1,0,1,0,0|2,0,0]=4 4205 B22R3.27382 Cc1ccccc1C(NCCC2CC2)c3ccccc3 2230a_100000222801_100000694398 [0,1,0,1,0,0|2,0,0]=4 4206 B22R3.27382 Cc1ccccc1C(NCCC2CC2)c3ccccc3 270004a_100000764129_100000735561 [0,1,0,1,0,0|2,0,0]=4 4207 B22R3.27382 Cc1ccccc1C(NCCC2CC2)c3ccccc3 34a_100000222801_100000694398 [0,1,0,1,0,0|2,0,0]=4 4208 B22R3.27382 Cc1ccccc1C(OCCC2CC2)c3ccccc3 34a_100000212071_100000694398 [0,1,0,1,0,0|1,0,0]=3 4209 B22R3.27382 Cc1ccccc1C(OCCC2CC2)c3ccccc3 7a_100000212071_100000764125 [0,1,0,1,0,0|1,0,0]=3 4210 B22R3.27382 Cc1ccccc1C(OCCC2CC2)c3ccccc3 7a_100000754188_100000230135 [0,1,0,1,0,0|1,0,0]=3 4211 B22R3.27382 Cc1ccccc1C(OCCC2CO2)c3ccccc3 34a_100000212071_100000732470 [0,1,0,1,0,0|2,0,0]=4 4212 B22R3.27382 Cc1ccccc1C(OCCC2CO2)c3ccccc3 7a_100000212071_100000732470 [0,1,0,1,0,0|2,0,0]=4 4213 B22R3.27382 Cc1ccccc1C(SCCC2CC2)c3ccccc3 62a_100000230135_100000764125 [0,1,0,1,0,0|1,1,0]=4 4214 B22R3.27382 Cc1ccccc1C(SCCC2CC2)c3ccccc3 62a_100000764125_100000230135 [0,1,0,1,0,0|1,1,0]=4 4215 B22R3.27382 Clc1ccccc1C(NCCC2CC2)c3ccccc3 270004a_100000764129_100011215288 [0,1,0,1,0,0|2,0,0]=4 4216 B22R3.27382 Clc1ccccc1C(OCCC2CC2)c3ccccc3 34a_200011400577_100000694398 [0,1,0,1,0,0|1,0,0]=3 4217 B22R3.27382 Clc1ccccc1C(OCCC2CC2)c3ccccc3 7a_200011400577_100000764125 [0,1,0,1,0,0|1,0,0]=3 4218 B22R3.27382 Clc1ccccc1C(OCCC2CO2)c3ccccc3 34a_200011400577_100000732470 [0,1,0,1,0,0|2,0,0]=4 4219 B22R3.27382 Clc1ccccc1C(OCCC2CO2)c3ccccc3 7a_200011400577_100000732470 [0,1,0,1,0,0|2,0,0]=4 4220 B22R3.27382 Fc1ccccc1C(NCCC2CC2)c3ccccc3 270004a_100000764129_100011217773 [0,1,0,1,0,0|2,0,0]=4 4221 B22R3.27382 Nc1ccccc1C(OCCC2CC2)c3ccccc3 34a_100000246470_100000694398 [0,1,0,1,0,0|1,0,0]=3 4222 B22R3.27382 Nc1ccccc1C(OCCC2CC2)c3ccccc3 7a_100000246470_100000764125 [0,1,0,1,0,0|1,0,0]=3 4223 B22R3.27382 Nc1ccccc1C(OCCC2CO2)c3ccccc3 34a_100000246470_100000732470 [0,1,0,1,0,0|2,0,0]=4 4224 B22R3.27382 Nc1ccccc1C(OCCC2CO2)c3ccccc3 7a_100000246470_100000732470 [0,1,0,1,0,0|2,0,0]=4 4225 B22R3.226873 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccccc3Br 270004a_100016987628_100000198044 [0,1,0,1,0,0|2,0,0]=4 4226 B22R3.226873 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccccc3Cl 270004a_100016987628_100011215288 [0,1,0,1,0,0|2,0,0]=4 4227 B22R3.226873 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccccc3F 270004a_100016987628_100011217773 [0,1,0,1,0,0|2,0,0]=4 4228 B22R3.226873 Cc1ccccc1C(c2ccccc2)N3CC[C@H](C3)C 2230a_100016987628_100000230135 [0,1,0,1,0,0|2,0,0]=4 4229 B22R3.226873 Cc1ccccc1C(c2ccccc2)N3CC[C@H](C3)C 269982a_100016987628_100000230135 [0,1,0,1,0,0|2,0,0]=4 4230 B22R3.226873 Cc1ccccc1C(c2ccccc2)N3CC[C@H](C3)C 270004a_100016987628_100000735561 [0,1,0,1,0,0|2,0,0]=4 4231 B22R3.600758 Cc1ccccc1C(OCC2CC2C)c3ccccc3 7a_100000744939_100000230135 [0,1,0,1,0,0|1,0,0]=3 4232 B22R3.600800 CN1CC(C1)NC(c2ccccc2)c3ccccc3Br 270004a_100015196640_100000198044 [0,1,0,1,0,0|1,0,0]=3 4233 B22R3.600800 CN1CC(C1)NC(c2ccccc2)c3ccccc3Cl 270004a_100015196640_100011215288 [0,1,0,1,0,0|1,0,0]=3 4234 B22R3.600800 CN1CC(C1)NC(c2ccccc2)c3ccccc3F 270004a_100015196640_100011217773 [0,1,0,1,0,0|1,0,0]=3 4235 B22R3.600800 CN1CC(C1)NC(c2ccccn2)c3ccccc3Cl 270004a_100015196640_100011400554 [0,1,0,1,0,0|2,0,0]=4 4236 B22R3.600800 CN1CC(C1)NC(c2cccnc2)c3ccccc3Br 270004a_100015196640_100011532686 [0,1,0,1,0,0|2,0,0]=4 4237 B22R3.600800 CN1CC(C1)NC(c2cccnc2)c3ccccc3Cl 270004a_100015196640_200011400555 [0,1,0,1,0,0|2,0,0]=4 4238 B22R3.600800 Cc1ccccc1C(NC2CN(C2)C)c3ccccc3 270004a_100015196640_100000735561 [0,1,0,1,0,0|1,0,0]=3 4239 B22R3.16182945 C=C(C)CCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000730704 [0,1,0,1,0,0|1,0,1]=4 4240 B22R3.16182945 CC(=CCOC1c2ccccc2Oc3c1cccc3)C 7a_100000210167_100000761012 [0,1,0,1,0,0|1,0,1]=4 4241 B22R3.16182945 CC(=O)CCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000053229 [0,1,0,1,0,0|2,0,0]=4 4242 B22R3.16182945 CC(C)CCNC1c2ccccc2Oc3c1cccc3 2230a_200000704616_100000210312 [0,1,0,1,0,0|2,0,0]=4 4243 B22R3.16182945 CC(C)CCNC1c2ccccc2Oc3c1cccc3 269862a_200000704616_100000185833 [0,1,0,1,0,0|2,0,0]=4 4244 B22R3.16182945 CC(C)CCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000210626 [0,1,0,1,0,0|1,0,0]=3 4245 B22R3.16182945 CC(O)CCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100012276601 [0,1,0,1,0,0|2,0,0]=4 4246 B22R3.16182945 CN(C)CCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000755713 [0,1,0,1,0,0|0,0,0]=2 4247 B22R3.16182945 CN(C)CCSc1c2ccccc2nc3c1cccc3 62a_100000044299_100000755713 [0,1,0,1,0,0|0,1,1]=4 4248 B22R3.789659 CC(OCCC1CC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000764125 [0,1,0,1,0,0|1,0,0]=3 4249 B22R3.789659 CC(OCCC1CC1)(c2ccccc2)c3ccccn3 7a_200000075192_100000764125 [0,1,0,1,0,0|2,0,0]=4 4250 B22R3.789659 CC(OCCC1CO1)(c2ccccc2)c3ccccc3 7a_100011202337_100000732470 [0,1,0,1,0,0|2,0,0]=4 4251 B22R3.104858762 C=C(C)CCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000730704 [0,1,0,1,0,0|1,0,1]=4 4252 B22R3.104858762 C=C(C)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000730704 [0,1,0,1,0,0|1,0,1]=4 4253 B22R3.104858762 CC(=CCOC1(c2ccccc2-c3c1cccc3)C)C 34a_100000075291_100000761012 [0,1,0,1,0,0|1,0,1]=4 4254 B22R3.104858762 CC(=CCOC1(c2ccccc2-c3c1cccc3)C)C 7a_100000075291_100000761012 [0,1,0,1,0,0|1,0,1]=4 4255 B22R3.104858762 CC(=O)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000053229 [0,1,0,1,0,0|2,0,0]=4 4256 B22R3.104858762 CC(C)CCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000210312 [0,1,0,1,0,0|1,0,0]=3 4257 B22R3.104858762 CC(C)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000210626 [0,1,0,1,0,0|1,0,0]=3 4258 B22R3.104858762 CC(C)OCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000709892 [0,1,0,1,0,0|2,0,0]=4 4259 B22R3.104858762 CC(O)CCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100012276601 [0,1,0,1,0,0|2,0,0]=4 4260 B22R3.104858762 CC(O)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100012276601 [0,1,0,1,0,0|2,0,0]=4 4261 B22R3.104858762 CN(C)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000755713 [0,1,0,1,0,0|0,0,0]=2 4262 B22R3.47158 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccc(cc3)Br 270004a_100016987628_100000718703 [0,1,0,1,0,0|2,0,0]=4 4263 B22R3.47158 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccc(cc3)Cl 2230a_100016987628_100000211669 [0,1,0,1,0,0|2,0,0]=4 4264 B22R3.47158 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccc(cc3)Cl 269982a_100016987628_100000211669 [0,1,0,1,0,0|2,0,0]=4 4265 B22R3.47158 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccc(cc3)Cl 270004a_100016987628_100000211064 [0,1,0,1,0,0|2,0,0]=4 4266 B22R3.47158 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccc(cc3)F 270004a_100016987628_100000210425 [0,1,0,1,0,0|2,0,0]=4 4267 B22R3.47158 Cc1ccc(cc1)C(c2ccccc2)N3CC[C@H](C3)C 270004a_100016987628_100000210966 [0,1,0,1,0,0|2,0,0]=4 4268 B22R3.47164 Brc1ccc(cc1)C(NCCC2CC2)c3ccccc3 2230a_100000745999_100000694398 [0,1,0,1,0,0|2,0,0]=4 4269 B22R3.47164 Brc1ccc(cc1)C(NCCC2CC2)c3ccccc3 270004a_100000764129_100000718703 [0,1,0,1,0,0|2,0,0]=4 4270 B22R3.47164 Brc1ccc(cc1)C(NCCC2CC2)c3ccccc3 34a_100000745999_100000694398 [0,1,0,1,0,0|2,0,0]=4 4271 B22R3.47164 Brc1ccc(cc1)C(OCCC2CC2)c3ccccc3 34a_100011217567_100000694398 [0,1,0,1,0,0|1,0,0]=3 4272 B22R3.47164 Brc1ccc(cc1)C(OCCC2CC2)c3ccccc3 7a_100011217567_100000764125 [0,1,0,1,0,0|1,0,0]=3 4273 B22R3.47164 Brc1ccc(cc1)C(OCCC2CO2)c3ccccc3 34a_100011217567_100000732470 [0,1,0,1,0,0|2,0,0]=4 4274 B22R3.47164 Brc1ccc(cc1)C(OCCC2CO2)c3ccccc3 7a_100011217567_100000732470 [0,1,0,1,0,0|2,0,0]=4 4275 B22R3.47164 Cc1ccc(cc1)C(NCCC2CC2)c3ccccc3 2230a_100000736602_100000694398 [0,1,0,1,0,0|2,0,0]=4 4276 B22R3.47164 Cc1ccc(cc1)C(NCCC2CC2)c3ccccc3 270004a_100000764129_100000210966 [0,1,0,1,0,0|2,0,0]=4 4277 B22R3.47164 Cc1ccc(cc1)C(NCCC2CC2)c3ccccc3 34a_100000736602_100000694398 [0,1,0,1,0,0|2,0,0]=4 4278 B22R3.47164 Cc1ccc(cc1)C(OCCC2CC2)c3ccccc3 34a_100000212064_100000694398 [0,1,0,1,0,0|1,0,0]=3 4279 B22R3.47164 Cc1ccc(cc1)C(OCCC2CC2)c3ccccc3 7a_100000212064_100000764125 [0,1,0,1,0,0|1,0,0]=3 4280 B22R3.47164 Cc1ccc(cc1)C(OCCC2CO2)c3ccccc3 34a_100000212064_100000732470 [0,1,0,1,0,0|2,0,0]=4 4281 B22R3.47164 Cc1ccc(cc1)C(OCCC2CO2)c3ccccc3 7a_100000212064_100000732470 [0,1,0,1,0,0|2,0,0]=4 4282 B22R3.47164 Clc1ccc(cc1)C(NCCC2CC2)c3ccccc3 2230a_100000737946_100000694398 [0,1,0,1,0,0|2,0,0]=4 4283 B22R3.47164 Clc1ccc(cc1)C(NCCC2CC2)c3ccccc3 270004a_100000764129_100000211064 [0,1,0,1,0,0|2,0,0]=4 4284 B22R3.47164 Clc1ccc(cc1)C(NCCC2CC2)c3ccccc3 34a_100000737946_100000694398 [0,1,0,1,0,0|2,0,0]=4 4285 B22R3.47164 Clc1ccc(cc1)C(OCCC2CC2)c3ccccc3 34a_100000211768_100000694398 [0,1,0,1,0,0|1,0,0]=3 4286 B22R3.47164 Clc1ccc(cc1)C(OCCC2CC2)c3ccccc3 7a_100000211768_100000764125 [0,1,0,1,0,0|1,0,0]=3 4287 B22R3.47164 Clc1ccc(cc1)C(OCCC2CC2)c3ccccc3 7a_100000754188_100000211669 [0,1,0,1,0,0|1,0,0]=3 4288 B22R3.47164 Clc1ccc(cc1)C(OCCC2CC2)c3ccccn3 34a_100000242608_100000694398 [0,1,0,1,0,0|2,0,0]=4 4289 B22R3.47164 Clc1ccc(cc1)C(OCCC2CC2)c3ccccn3 7a_100000754188_200010188304 [0,1,0,1,0,0|2,0,0]=4 4290 B22R3.47164 Clc1ccc(cc1)C(OCCC2CO2)c3ccccc3 34a_100000211768_100000732470 [0,1,0,1,0,0|2,0,0]=4 4291 B22R3.47164 Clc1ccc(cc1)C(OCCC2CO2)c3ccccc3 7a_100000211768_100000732470 [0,1,0,1,0,0|2,0,0]=4 4292 B22R3.47164 Clc1ccc(cc1)C(SCCC2CC2)c3ccccc3 62a_100000211669_100000764125 [0,1,0,1,0,0|1,1,0]=4 4293 B22R3.47164 Clc1ccc(cc1)C(SCCC2CC2)c3ccccc3 62a_100000764125_100000211669 [0,1,0,1,0,0|1,1,0]=4 4294 B22R3.47164 Fc1ccc(cc1)C(NCCC2CC2)c3ccccc3 2230a_100000737529_100000694398 [0,1,0,1,0,0|2,0,0]=4 4295 B22R3.47164 Fc1ccc(cc1)C(NCCC2CC2)c3ccccc3 270004a_100000764129_100000210425 [0,1,0,1,0,0|2,0,0]=4 4296 B22R3.47164 Fc1ccc(cc1)C(NCCC2CC2)c3ccccc3 34a_100000737529_100000694398 [0,1,0,1,0,0|2,0,0]=4 4297 B22R3.47164 Fc1ccc(cc1)C(OCCC2CC2)c3ccccc3 34a_200000246460_100000694398 [0,1,0,1,0,0|1,0,0]=3 4298 B22R3.47164 Fc1ccc(cc1)C(OCCC2CC2)c3ccccc3 7a_200000246460_100000764125 [0,1,0,1,0,0|1,0,0]=3 4299 B22R3.47164 Fc1ccc(cc1)C(OCCC2CC2)c3ccncc3 34a_100000748166_100000694398 [0,1,0,1,0,0|2,0,0]=4 4300 B22R3.47164 Fc1ccc(cc1)C(OCCC2CO2)c3ccccc3 34a_200000246460_100000732470 [0,1,0,1,0,0|2,0,0]=4 4301 B22R3.47164 Fc1ccc(cc1)C(OCCC2CO2)c3ccccc3 7a_200000246460_100000732470 [0,1,0,1,0,0|2,0,0]=4 4302 B22R3.47164 Nc1ccc(cc1)C(OCCC2CC2)c3ccccc3 34a_100011236343_100000694398 [0,1,0,1,0,0|1,0,0]=3 4303 B22R3.47164 Nc1ccc(cc1)C(OCCC2CC2)c3ccccc3 7a_100011236343_100000764125 [0,1,0,1,0,0|1,0,0]=3 4304 B22R3.47164 Nc1ccc(cc1)C(OCCC2CO2)c3ccccc3 34a_100011236343_100000732470 [0,1,0,1,0,0|2,0,0]=4 4305 B22R3.47164 Nc1ccc(cc1)C(OCCC2CO2)c3ccccc3 7a_100011236343_100000732470 [0,1,0,1,0,0|2,0,0]=4 4306 B22R3.47164 Oc1ccc(cc1)C(NCCC2CC2)c3ccccc3 34a_100000198503_100000694398 [0,1,0,1,0,0|2,0,0]=4 4307 B22R3.1033380 CC1CC1COC(c2ccc(cc2)Cl)c3ccccn3 7a_100000744939_200010188304 [0,1,0,1,0,0|2,0,0]=4 4308 B22R3.1033380 CC1CC1COC(c2ccccc2)c3ccc(cc3)Cl 7a_100000744939_100000211669 [0,1,0,1,0,0|1,0,0]=3 4309 B22R3.1033423 CN1CC(C1)NC(c2ccc(cc2)Br)c3ccccn3 270004a_100015196640_200010179208 [0,1,0,1,0,0|2,0,0]=4 4310 B22R3.1033423 CN1CC(C1)NC(c2ccc(cc2)Br)c3cccnc3 270004a_100015196640_100000753996 [0,1,0,1,0,0|2,0,0]=4 4311 B22R3.1033423 CN1CC(C1)NC(c2ccc(cc2)Cl)c3ccccn3 270004a_100015196640_100000753647 [0,1,0,1,0,0|2,0,0]=4 4312 B22R3.1033423 CN1CC(C1)NC(c2ccc(cc2)Cl)c3cccnc3 270004a_100015196640_100000753233 [0,1,0,1,0,0|2,0,0]=4 4313 B22R3.1033423 CN1CC(C1)NC(c2ccccc2)c3ccc(cc3)Br 270004a_100015196640_100000718703 [0,1,0,1,0,0|1,0,0]=3 4314 B22R3.1033423 CN1CC(C1)NC(c2ccccc2)c3ccc(cc3)Cl 270004a_100015196640_100000211064 [0,1,0,1,0,0|1,0,0]=3 4315 B22R3.1033423 CN1CC(C1)NC(c2ccccc2)c3ccc(cc3)F 270004a_100015196640_100000210425 [0,1,0,1,0,0|1,0,0]=3 4316 B22R3.1033423 Cc1ccc(cc1)C(NC2CN(C2)C)c3ccccc3 270004a_100015196640_100000210966 [0,1,0,1,0,0|1,0,0]=3 4317 B22R3.373704 CC1CC(C1)C(=O)C(c2ccccc2)c3ccccc3 1458a_100000686124_100011216954 [0,1,0,1,0,0|2,0,0]=4 4318 B22R3.373704 CN1CC(C1)C(=O)C(c2ccccc2)c3ccccc3 1458a_100012002723_100011216954 [0,1,0,1,0,0|1,0,0]=3 4319 B22R3.792169 CN(CCC1CC1)C(c2ccccc2)c3ccccc3 2230a_100103148541_100000694398 [0,1,0,1,0,0|2,0,0]=4 4320 B22R3.792169 CN(CCC1CC1)C(c2ccccc2)c3ccccc3 269982a_100103148541_100000694398 [0,1,0,1,0,0|2,0,0]=4 4321 B22R3.792169 O=C(CCC1CC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100000694398 [0,1,0,1,0,0|2,0,0]=4 4322 B22R3.792169 O=C(CCC1CC1)C(c2ccccc2)c3ccccc3 1458a_100000756386_100011216954 [0,1,0,1,0,0|2,0,0]=4 4323 B22R3.1414419 CC1(C[C@@H]1C(=O)C(c2ccccc2)c3ccccc3)C 1458a_100000692687_100011216954 [0,1,0,1,0,0|2,0,0]=4 4324 B22R3.25163314 CC(C)CCC(=O)C1c2ccccc2-c3c1cccc3 1458a_100000182576_100000210312 [0,1,0,1,0,0|2,0,0]=4 4325 B22R3.25163314 CC(C)CCN(C)C1c2ccccc2-c3c1cccc3 2230a_100000742789_100000211598 [0,1,0,1,0,0|2,0,0]=4 4326 B22R3.25163314 CC(C)CCN(C)C1c2ccccc2-c3c1cccc3 269982a_100000742789_100000211598 [0,1,0,1,0,0|2,0,0]=4 4327 B22R3.25163314 CN(C)CCN(C)C1c2ccccc2-c3c1cccc3 269982a_100000225618_100000211598 [0,1,0,1,0,0|1,0,0]=3 4328 B22R4.666070 CC1CC1COC2c3ccccc3-c4c2cccc4 7a_100000744939_100000211598 [0,0,0,2,0,0|1,0,0]=3 4329 B22R4.1468860 c1ccc(cc1)C(c2ccccc2)N3CC4CC4C3 2230a_100000741873_100000211591 [0,0,0,2,0,0|2,0,0]=4 4330 B22R4.1468860 c1ccc(cc1)C(c2ccccc2)N3CC4CC4C3 269982a_100000741873_100000211591 [0,0,0,2,0,0|2,0,0]=4 4331 B22R4.1468860 c1ccc(cc1)C(c2ccccc2)N3CC4CC4C3 270004a_100000741873_100000210122 [0,0,0,2,0,0|2,0,0]=4 4332 B22R4.1609702 C[C@@H]1CCN(C1)C2c3ccccc3-c4c2cccc4 2230a_100016987628_100000211598 [0,0,0,2,0,0|2,0,0]=4 4333 B22R4.1609702 C[C@@H]1CCN(C1)C2c3ccccc3-c4c2cccc4 269982a_100016987628_100000211598 [0,0,0,2,0,0|2,0,0]=4 4334 B22R4.27063635 c1ccc(cc1)C(NC23CC(C2)C3)c4ccccc4 270004a_100016993715_100000210122 [0,0,0,2,0,0|2,0,0]=4 4335 B22R4.1481388 c1ccc2c(c1)-c3ccccc3C2NCCC4CC4 2230a_100000104097_100000694398 [0,0,0,2,0,0|2,0,0]=4 4336 B22R4.1481388 c1ccc2c(c1)-c3ccccc3C2OCCC4CC4 7a_100000211495_100000764125 [0,0,0,2,0,0|1,0,0]=3 4337 B22R4.1481388 c1ccc2c(c1)-c3ccccc3C2OCCC4CC4 7a_100000754188_100000211598 [0,0,0,2,0,0|1,0,0]=3 4338 B22R4.1481388 c1ccc2c(c1)-c3ccccc3C2OCCC4CO4 7a_100000211495_100000732470 [0,0,0,2,0,0|2,0,0]=4 4339 B22R4.1481388 c1ccc2c(c1)-c3ccccc3C2SCCC4CC4 62a_100000211598_100000764125 [0,0,0,2,0,0|1,1,0]=4 4340 B18R1.36714 C=CC=CC(=O)N(CCN(C)C)c1ccccc1 1626a_200000219566_100016291481 [0,0,1,0,1,0|2,0,0]=4 4341 B18R1.36714 C=CC=CC(=O)N(CCN(C)C)c1ccccc1 22a_200000219566_100016291481 [0,0,1,0,1,0|2,0,0]=4 4342 B18R2.7184 CC(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_200000210301 [0,0,0,0,2,0|2,0,0]=4 4343 B18R2.7184 CC(C)NC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210206 [0,0,0,0,2,0|2,0,0]=4 4344 B18R2.7184 CC(C)NC(c1ccccc1)c2ccccc2 2230a_100138425928_100000211591 [0,0,0,0,2,0|2,0,0]=4 4345 B18R2.7184 CC(C)NC(c1ccccc1)c2ccccc2 34a_100000162943_100000210206 [0,0,0,0,2,0|2,0,0]=4 4346 B18R2.7184 CC(C)OC(c1ccccc1)c2ccccc2 34a_100000211180_100000210206 [0,0,0,0,2,0|1,0,0]=3 4347 B18R2.7184 CC(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_100000210206 [0,0,0,0,2,0|1,0,0]=3 4348 B18R2.7184 CC(C)OC(c1ccccc1)c2ccccn2 7a_100000180852_100000210206 [0,0,0,0,2,0|2,0,0]=4 4349 B18R2.7184 CC(C)SC(c1ccccc1)c2ccccc2 62a_100000210206_100011216954 [0,0,0,0,2,0|1,1,0]=4 4350 B18R2.7184 CC(C)SC(c1ccccc1)c2ccccc2 62a_100000211591_100000210206 [0,0,0,0,2,0|1,1,0]=4 4351 B18R2.7184 [13CH3]C(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_200025704644 [0,0,0,0,2,0|2,0,0]=4 4352 B20R2.447 C#CCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000688953 [1,0,0,0,0,1|1,0,1]=4 4353 B20R2.447 C#CCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000688953 [1,0,0,0,0,1|1,0,1]=4 4354 B20R2.447 C/C=C/COC(Cc1ccccc1)c2ccccc2 34a_100000246494_100102629194 [1,0,0,0,0,1|1,0,1]=4 4355 B20R2.447 C/C=C/COC(Cc1ccccc1)c2ccccc2 7a_100000246494_100102629194 [1,0,0,0,0,1|1,0,1]=4 4356 B20R2.447 C=CCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000754431 [1,0,0,0,0,1|1,0,1]=4 4357 B20R2.447 C=CCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000754431 [1,0,0,0,0,1|1,0,1]=4 4358 B20R2.447 CC#CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000748600 [1,0,0,0,0,1|1,0,1]=4 4359 B20R2.447 CC#CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000748600 [1,0,0,0,0,1|1,0,1]=4 4360 B20R2.447 CC=CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000070051 [1,0,0,0,0,1|1,0,1]=4 4361 B20R2.447 CC=CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000070051 [1,0,0,0,0,1|1,0,1]=4 4362 B20R2.447 CCCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000210211 [1,0,0,0,0,1|2,0,0]=4 4363 B20R2.447 CCCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000210210 [1,0,0,0,0,1|1,0,0]=3 4364 B20R2.447 CCCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000210211 [1,0,0,0,0,1|1,0,0]=3 4365 B20R2.447 COCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100011201679 [1,0,0,0,0,1|2,0,0]=4 4366 B20R2.447 COCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100011201679 [1,0,0,0,0,1|1,0,0]=3 4367 B20R2.447 COCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000233755 [1,0,0,0,0,1|1,0,0]=3 4368 B20R2.447 CSCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000751147 [1,0,0,0,0,1|2,0,0]=4 4369 B20R2.447 CSCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000212216 [1,0,0,0,0,1|1,0,0]=3 4370 B20R2.447 CSCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000212216 [1,0,0,0,0,1|1,0,0]=3 4371 B20R2.447 FCCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100011934791 [1,0,0,0,0,1|2,0,0]=4 4372 B20R2.447 FCCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100011934791 [1,0,0,0,0,1|2,0,0]=4 4373 B20R2.447 N#CCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000184422 [1,0,0,0,0,1|2,0,0]=4 4374 B20R2.447 OCCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000230001 [1,0,0,0,0,1|2,0,0]=4 4375 B20R2.447 OCCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100011215043 [1,0,0,0,0,1|2,0,0]=4 4376 B20R2.10613 CN(C)CCCNC(c1ccccc1)c2cccs2 270004a_102531767803_100011214959 [0,0,0,0,1,1|2,0,0]=4 4377 B20R2.10613 CN(C)CCCOC(c1ccccc1)c2ncc[nH]2 7a_100000181881_100000757444 [0,0,0,0,1,1|2,0,0]=4 4378 B20R2.10559 C=C(C)COC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000748629 [0,0,0,0,1,1|1,0,1]=4 4379 B20R2.10559 C=C(C)COC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000748629 [0,0,0,0,1,1|1,0,1]=4 4380 B20R2.10559 CC(C)CCN(Cc1ccccc1)c2ccccc2 2230a_100000188819_100000210312 [0,0,0,0,1,1|2,0,0]=4 4381 B20R2.10559 CC(C)CCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000210312 [0,0,0,0,1,1|2,0,0]=4 4382 B20R2.10559 CC(C)CCN(Cc1ccccc1)c2ccccc2 34a_100000188819_100000210312 [0,0,0,0,1,1|2,0,0]=4 4383 B20R2.10559 CC(C)CNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000210760 [0,0,0,0,1,1|2,0,0]=4 4384 B20R2.10559 CC(C)CNC(Cc1ccccc1)c2ccccc2 270004a_100025772854_100000210432 [0,0,0,0,1,1|2,0,0]=4 4385 B20R2.10559 CC(C)COC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000210624 [0,0,0,0,1,1|1,0,0]=3 4386 B20R2.10559 CC(C)COC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000210760 [0,0,0,0,1,1|1,0,0]=3 4387 B20R2.10559 CC(O)COC(Cc1ccccc1)c2ccccc2 34a_100000246494_100011218427 [0,0,0,0,1,1|2,0,0]=4 4388 B20R2.10559 CC(O)COC(Cc1ccccc1)c2ccccc2 7a_100000246494_100011218427 [0,0,0,0,1,1|2,0,0]=4 4389 B20R2.10559 CN(C)CCC(Nc1cccnn1)c2ccccc2 27a_200015187826_100016991348 [0,0,0,0,1,1|2,0,0]=4 4390 B20R2.10559 CN(C)CCC(Nc1ccncn1)c2ccccc2 27a_200015187826_100000703185 [0,0,0,0,1,1|2,0,0]=4 4391 B20R2.10559 CN(C)CCC(Nc1cnccn1)c2ccccc2 27a_200015187826_100000211759 [0,0,0,0,1,1|2,0,0]=4 4392 B20R2.10559 CN(C)CCC(Nc1ncccn1)c2ccccc2 27a_200015187826_100000211032 [0,0,0,0,1,1|2,0,0]=4 4393 B20R2.10559 CN(C)CCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000755713 [0,0,0,0,1,1|1,0,0]=3 4394 B20R2.10559 CN(C)CCN(Cc1ccccc1)c2ccccc2 269982a_200000219566_100000211182 [0,0,0,0,1,1|1,0,0]=3 4395 B20R2.10559 CN(C)CCN(Cc1ccccn1)c2ccccc2 269982a_200000219566_100000721315 [0,0,0,0,1,1|2,0,0]=4 4396 B20R2.10559 CN(C)CCN(Cc1cccnc1)c2ccccc2 269982a_200000219566_100000733263 [0,0,0,0,1,1|2,0,0]=4 4397 B20R2.10559 CN(C)CCN(Cc1ccncc1)c2ccccc2 269982a_200000219566_100015193705 [0,0,0,0,1,1|2,0,0]=4 4398 B20R2.10559 C[C@@H](O)COC(Cc1ccccc1)c2ccccc2 34a_100000246494_100009817552 [0,0,0,0,1,1|2,0,0]=4 4399 B20R2.10559 C[C@@H](O)COC(Cc1ccccc1)c2ccccc2 7a_100000246494_100009817552 [0,0,0,0,1,1|2,0,0]=4 4400 B22R2.15088 C=C(C)CCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000730704 [0,0,0,0,0,2|1,0,1]=4 4401 B22R2.15088 C=C(C)CCOCCC(c1ccccc1)c2ccccc2 34a_100000764851_100009813428 [0,0,0,0,0,2|1,0,1]=4 4402 B22R2.15088 C=C(C)CCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000730704 [0,0,0,0,0,2|1,0,1]=4 4403 B22R2.15088 C=C(C)COCCOC(c1ccccc1)c2ccccc2 34a_100000210245_100000734929 [0,0,0,0,0,2|1,0,1]=4 4404 B22R2.15088 C=C(C)CSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000211660 [0,0,0,0,0,2|1,0,1]=4 4405 B22R2.15088 C=C(C)CSCCOC(c1ccccc1)c2ccccc2 62a_100000748629_100000734929 [0,0,0,0,0,2|1,0,1]=4 4406 B22R2.15088 CC(=CCCNCC(c1ccccc1)c2ccccc2)C 2230a_100000739227_100011217483 [0,0,0,0,0,2|2,0,0]=4 4407 B22R2.15088 CC(=CCCNCC(c1ccccc1)c2ccccc2)C 34a_100000739227_100011217483 [0,0,0,0,0,2|2,0,0]=4 4408 B22R2.15088 CC(=CCCOCC(c1ccccc1)c2ccccc2)C 34a_100011215272_100011217483 [0,0,0,0,0,2|1,0,0]=3 4409 B22R2.15088 CC(=CCCOCC(c1ccccc1)c2ccccc2)C 7a_100011215272_100011217483 [0,0,0,0,0,2|1,0,0]=3 4410 B22R2.15088 CC(=CCNCCC(c1ccccc1)c2ccccc2)C 2230a_100000272388_100000761012 [0,0,0,0,0,2|2,0,0]=4 4411 B22R2.15088 CC(=CCNCCC(c1ccccc1)c2ccccc2)C 34a_100000272388_100000761012 [0,0,0,0,0,2|2,0,0]=4 4412 B22R2.15088 CC(=CCNCCC(c1ccccc1)c2ccccc2)C 34a_100000718196_100009813428 [0,0,0,0,0,2|2,0,0]=4 4413 B22R2.15088 CC(=CCOCCC(c1ccccc1)c2ccccc2)C 34a_100000032380_100000761012 [0,0,0,0,0,2|1,0,1]=4 4414 B22R2.15088 CC(=CCOCCC(c1ccccc1)c2ccccc2)C 34a_100000753907_100009813428 [0,0,0,0,0,2|1,0,1]=4 4415 B22R2.15088 CC(=CCOCCC(c1ccccc1)c2ccccc2)C 7a_100000032380_100000761012 [0,0,0,0,0,2|1,0,1]=4 4416 B22R2.15088 CC(=CCSCCC(c1ccccc1)c2ccccc2)C 62a_100000761012_100009813428 [0,0,0,0,0,2|2,0,0]=4 4417 B22R2.15088 CC(=CCSCCC(c1ccccc1)c2ccccc2)C 62a_100009813428_100000761012 [0,0,0,0,0,2|2,0,0]=4 4418 B22R2.15088 CC(=O)CCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100009817362 [0,0,0,0,0,2|2,0,0]=4 4419 B22R2.15088 CC(=O)CCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000735457 [0,0,0,0,0,2|2,0,0]=4 4420 B22R2.15088 CC(=O)CCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000685027 [0,0,0,0,0,2|2,0,0]=4 4421 B22R2.15088 CC(=O)CCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100011215641 [0,0,0,0,0,2|2,0,0]=4 4422 B22R2.15088 CC(=O)CCOCCC(c1ccccc1)c2ccccc2 34a_100000759926_100009813428 [0,0,0,0,0,2|2,0,0]=4 4423 B22R2.15088 CC(=O)CCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000053229 [0,0,0,0,0,2|2,0,0]=4 4424 B22R2.15088 CC(=O)CCOCCC(c1ccccc1)c2ccccc2 7a_100000759926_100009813428 [0,0,0,0,0,2|2,0,0]=4 4425 B22R2.15088 CC(=O)COCCOC(c1ccccc1)c2ccccc2 34a_100000211253_100000734929 [0,0,0,0,0,2|2,0,0]=4 4426 B22R2.15088 CC(=O)NCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000189650 [0,0,0,0,0,2|2,0,0]=4 4427 B22R2.15088 CC(=O)OCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000042594 [0,0,0,0,0,2|2,0,0]=4 4428 B22R2.15088 CC(=O)OCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000042594 [0,0,0,0,0,2|2,0,0]=4 4429 B22R2.15088 CC(=O)OCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100009814007 [0,0,0,0,0,2|2,0,0]=4 4430 B22R2.15088 CC(=O)OCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100009814007 [0,0,0,0,0,2|2,0,0]=4 4431 B22R2.15088 CC(=O)SCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000038929 [0,0,0,0,0,2|2,0,0]=4 4432 B22R2.15088 CC(=O)SCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000038929 [0,0,0,0,0,2|2,0,0]=4 4433 B22R2.15088 CC(=S)OCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_200135323944 [0,0,0,0,0,2|2,0,0]=4 4434 B22R2.15088 CC(=S)OCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_200135323944 [0,0,0,0,0,2|2,0,0]=4 4435 B22R2.15088 CC(Br)CCOCCC(c1ccccc1)c2ccccc2 34a_100009893172_100009813428 [0,0,0,0,0,2|2,0,0]=4 4436 B22R2.15088 CC(Br)COCCOC(c1ccccc1)c2ccccc2 34a_100012180447_100000734929 [0,0,0,0,0,2|2,0,0]=4 4437 B22R2.15088 CC(C)CCCCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011216152 [0,0,0,0,0,2|2,0,0]=4 4438 B22R2.15088 CC(C)CCCCNC(c1ccccc1)c2ccccc2 34a_100000162943_100011216152 [0,0,0,0,0,2|2,0,0]=4 4439 B22R2.15088 CC(C)CCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011216152 [0,0,0,0,0,2|1,0,0]=3 4440 B22R2.15088 CC(C)CCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011216152 [0,0,0,0,0,2|1,0,0]=3 4441 B22R2.15088 CC(C)CCCCOC(c1ccccc1)c2ccccc2 7a_100011214890_100011216954 [0,0,0,0,0,2|1,0,0]=3 4442 B22R2.15088 CC(C)CCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011216152 [0,0,0,0,0,2|2,0,0]=4 4443 B22R2.15088 CC(C)CCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100011214892 [0,0,0,0,0,2|2,0,0]=4 4444 B22R2.15088 CC(C)CCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100011214892 [0,0,0,0,0,2|2,0,0]=4 4445 B22R2.15088 CC(C)CCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100011214892 [0,0,0,0,0,2|1,0,0]=3 4446 B22R2.15088 CC(C)CCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100011214892 [0,0,0,0,0,2|1,0,0]=3 4447 B22R2.15088 CC(C)CCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000210312 [0,0,0,0,0,2|2,0,0]=4 4448 B22R2.15088 CC(C)CCNCCC(c1ccccc1)c2ccccc2 269862a_100000272388_100000185833 [0,0,0,0,0,2|2,0,0]=4 4449 B22R2.15088 CC(C)CCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000210312 [0,0,0,0,0,2|2,0,0]=4 4450 B22R2.15088 CC(C)CCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000210312 [0,0,0,0,0,2|1,0,0]=3 4451 B22R2.15088 CC(C)CCOCCC(c1ccccc1)c2ccccc2 34a_100000210254_100009813428 [0,0,0,0,0,2|1,0,0]=3 4452 B22R2.15088 CC(C)CCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000210626 [0,0,0,0,0,2|1,0,0]=3 4453 B22R2.15088 CC(C)CCOCCC(c1ccccc1)c2ccccc2 7a_100000210254_100009813428 [0,0,0,0,0,2|1,0,0]=3 4454 B22R2.15088 CC(C)CCOCCN(c1ccccc1)c2ccccc2 34a_100010001939_100000210312 [0,0,0,0,0,2|2,0,0]=4 4455 B22R2.15088 CC(C)CCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000210626 [0,0,0,0,0,2|2,0,0]=4 4456 B22R2.15088 CC(C)CCOCC[S+](c1ccccc1)c2ccccc2 7a_100000210254_100010140906 [0,0,0,0,0,2|2,0,0]=4 4457 B22R2.15088 CC(C)CCSCCC(c1ccccc1)c2ccccc2 62a_100000210312_100009813428 [0,0,0,0,0,2|1,1,0]=4 4458 B22R2.15088 CC(C)CCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000210312 [0,0,0,0,0,2|1,1,0]=4 4459 B22R2.15088 CC(C)CNCCOC(c1ccccc1)c2ccccc2 2230a_100000210953_100000734929 [0,0,0,0,0,2|1,0,0]=3 4460 B22R2.15088 CC(C)CNCCOC(c1ccccc1)c2ccccc2 34a_100000210953_100000734929 [0,0,0,0,0,2|1,0,0]=3 4461 B22R2.15088 CC(C)COCCOC(c1ccccc1)c2ccccc2 34a_100000210257_100000734929 [0,0,0,0,0,2|1,0,0]=3 4462 B22R2.15088 CC(C)COCCOC(c1ccccc1)c2ccccc2 7a_100000703358_100011216954 [0,0,0,0,0,2|1,0,0]=3 4463 B22R2.15088 CC(C)CSCCOC(c1ccccc1)c2ccccc2 62a_100000210624_100000734929 [0,0,0,0,0,2|1,0,0]=3 4464 B22R2.15088 CC(C)CSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000210760 [0,0,0,0,0,2|1,0,0]=3 4465 B22R2.15088 CC(C)CSCCOC(c1ccccc1)c2ccccc2 7a_200000230437_100011216954 [0,0,0,0,0,2|1,0,0]=3 4466 B22R2.15088 CC(C)OCCCNC(c1ccccc1)c2ccccc2 2230a_100000737246_100000211591 [0,0,0,0,0,2|2,0,0]=4 4467 B22R2.15088 CC(C)OCCCNC(c1ccccc1)c2ccccc2 270004a_100000737246_100000210122 [0,0,0,0,0,2|2,0,0]=4 4468 B22R2.15088 CC(C)OCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000211751 [0,0,0,0,0,2|2,0,0]=4 4469 B22R2.15088 CC(C)OCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000211751 [0,0,0,0,0,2|2,0,0]=4 4470 B22R2.15088 CC(C)OCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000211751 [0,0,0,0,0,2|1,0,0]=3 4471 B22R2.15088 CC(C)OCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000211751 [0,0,0,0,0,2|1,0,0]=3 4472 B22R2.15088 CC(C)OCNCCC(c1ccccc1)c2ccccc2 2230a_100000272388_100000709892 [0,0,0,0,0,2|2,0,0]=4 4473 B22R2.15088 CC(C)OCNCCC(c1ccccc1)c2ccccc2 34a_100000272388_100000709892 [0,0,0,0,0,2|2,0,0]=4 4474 B22R2.15088 CC(C)OCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100000709892 [0,0,0,0,0,2|2,0,0]=4 4475 B22R2.15088 CC(C)OCSCCC(c1ccccc1)c2ccccc2 62a_100000709892_100009813428 [0,0,0,0,0,2|2,0,0]=4 4476 B22R2.15088 CC(C)OCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000709892 [0,0,0,0,0,2|2,0,0]=4 4477 B22R2.15088 CC(C)SCCNCC(c1ccccc1)c2ccccc2 2230a_100000739227_100000730970 [0,0,0,0,0,2|2,0,0]=4 4478 B22R2.15088 CC(C)SCCNCC(c1ccccc1)c2ccccc2 34a_100000739227_100000730970 [0,0,0,0,0,2|2,0,0]=4 4479 B22R2.15088 CC(C)SCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000730970 [0,0,0,0,0,2|1,0,0]=3 4480 B22R2.15088 CC(C)SCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000730970 [0,0,0,0,0,2|1,0,0]=3 4481 B22R2.15088 CC(F)COCCOC(c1ccccc1)c2ccccc2 34a_100015925927_100000734929 [0,0,0,0,0,2|2,0,0]=4 4482 B22R2.15088 CC(O)CCCOCC(c1ccccc1)c2ccccc2 34a_100011215272_200000718107 [0,0,0,0,0,2|2,0,0]=4 4483 B22R2.15088 CC(O)CCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_200000718107 [0,0,0,0,0,2|2,0,0]=4 4484 B22R2.15088 CC(O)CCOCCC(c1ccccc1)c2ccccc2 34a_100000032380_100012276601 [0,0,0,0,0,2|2,0,0]=4 4485 B22R2.15088 CC(O)CCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100012276601 [0,0,0,0,0,2|2,0,0]=4 4486 B22R2.15088 CC(O)CNCCOC(c1ccccc1)c2ccccc2 2230a_100000210904_100000734929 [0,0,0,0,0,2|2,0,0]=4 4487 B22R2.15088 CC(O)CNCCOC(c1ccccc1)c2ccccc2 34a_100000210904_100000734929 [0,0,0,0,0,2|2,0,0]=4 4488 B22R2.15088 CC(O)CSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100011218427 [0,0,0,0,0,2|2,0,0]=4 4489 B22R2.15088 CC(O)CSCCOC(c1ccccc1)c2ccccc2 62a_100011218427_100000734929 [0,0,0,0,0,2|2,0,0]=4 4490 B22R2.15088 CN(C)CCCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000690147 [0,0,0,0,0,2|0,1,0]=3 4491 B22R2.15088 CN(C)CCCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000757444 [0,0,0,0,0,2|0,0,0]=2 4492 B22R2.15088 CN(C)CCNCC=C(c1ccccc1)c2ccccc2 270004a_100000210585_100000050448 [0,0,0,0,0,2|1,0,1]=4 4493 B22R2.15088 CN(C)CCOCCC(c1ccccc1)c2ccccc2 7a_100000032380_100000755713 [0,0,0,0,0,2|0,0,0]=2 4494 B22R2.15088 CN(C)CCOCCN(c1ccccc1)c2ccccc2 7a_100010001939_100000755713 [0,0,0,0,0,2|1,0,0]=3 4495 B22R2.15088 CN(C)CCSCCC(c1ccccc1)c2ccccc2 62a_100009813428_100000755713 [0,0,0,0,0,2|0,1,0]=3 4496 B22R2.15088 CN(C)CCSCC[S+](c1ccccc1)c2ccccc2 62a_100010140906_100000755713 [0,0,0,0,0,2|1,1,0]=4 4497 B22R2.15088 C[C@@H](Cl)COCCOC(c1ccccc1)c2ccccc2 34a_100016084084_100000734929 [0,0,0,0,0,2|2,0,0]=4 4498 B22R2.15088 C[C@@H](N)CCOCCC(c1ccccc1)c2ccccc2 34a_100000706166_100009813428 [0,0,0,0,0,2|2,0,0]=4 4499 B22R2.15088 C[C@@H](N)COCCOC(c1ccccc1)c2ccccc2 34a_100000737577_100000734929 [0,0,0,0,0,2|2,0,0]=4 4500 B22R2.15088 C[C@@H](O)CSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100009817552 [0,0,0,0,0,2|2,0,0]=4 4501 B22R2.15088 C[C@@H](O)CSCCOC(c1ccccc1)c2ccccc2 62a_100009817552_100000734929 [0,0,0,0,0,2|2,0,0]=4 4502 B22R2.15391 CC(=CCCNC(Cc1ccccc1)c2ccccc2)C 2230a_100025772854_100011217483 [0,0,0,0,0,2|2,0,0]=4 4503 B22R2.15391 CC(=CCCOC(Cc1ccccc1)c2ccccc2)C 34a_100000246494_100011217483 [0,0,0,0,0,2|1,0,0]=3 4504 B22R2.15391 CC(=CCCOC(Cc1ccccc1)c2ccccc2)C 7a_100000246494_100011217483 [0,0,0,0,0,2|1,0,0]=3 4505 B22R2.15391 CC(=O)CCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000685027 [0,0,0,0,0,2|2,0,0]=4 4506 B22R2.15391 CC(=O)CCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100011215641 [0,0,0,0,0,2|2,0,0]=4 4507 B22R2.15391 CC(=O)NCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000189650 [0,0,0,0,0,2|2,0,0]=4 4508 B22R2.15391 CC(=O)OCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100009814007 [0,0,0,0,0,2|2,0,0]=4 4509 B22R2.15391 CC(=O)OCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100009814007 [0,0,0,0,0,2|2,0,0]=4 4510 B22R2.15391 CC(C)CCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100011214892 [0,0,0,0,0,2|2,0,0]=4 4511 B22R2.15391 CC(C)CCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100011214892 [0,0,0,0,0,2|1,0,0]=3 4512 B22R2.15391 CC(C)CCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100011214892 [0,0,0,0,0,2|1,0,0]=3 4513 B22R2.15391 CC(C)OCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000211751 [0,0,0,0,0,2|2,0,0]=4 4514 B22R2.15391 CC(C)OCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000211751 [0,0,0,0,0,2|1,0,0]=3 4515 B22R2.15391 CC(C)OCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000211751 [0,0,0,0,0,2|1,0,0]=3 4516 B22R2.15391 CC(C)SCCNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_100000730970 [0,0,0,0,0,2|2,0,0]=4 4517 B22R2.15391 CC(C)SCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000730970 [0,0,0,0,0,2|1,0,0]=3 4518 B22R2.15391 CC(C)SCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000730970 [0,0,0,0,0,2|1,0,0]=3 4519 B22R2.15391 CC(O)CCCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_200000718107 [0,0,0,0,0,2|2,0,0]=4 4520 B22R2.15391 CC(O)CCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_200000718107 [0,0,0,0,0,2|2,0,0]=4 4521 B22R2.15391 CN(C)CCCCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000690147 [0,0,0,0,0,2|2,0,0]=4 4522 B22R2.15391 CN(C)CCCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000757444 [0,0,0,0,0,2|0,0,0]=2 4523 B22R2.15222 C=C(C)CCOC(Cc1ccccc1)Cc2ccccc2 34a_100000285930_100000730704 [0,0,0,0,0,2|1,0,1]=4 4524 B22R2.15222 C=C(C)CCOC(Cc1ccccc1)Cc2ccccc2 7a_100000285930_100000730704 [0,0,0,0,0,2|1,0,1]=4 4525 B22R2.15222 CC(=CCOC(Cc1ccccc1)Cc2ccccc2)C 34a_100000285930_100000761012 [0,0,0,0,0,2|1,0,1]=4 4526 B22R2.15222 CC(=CCOC(Cc1ccccc1)Cc2ccccc2)C 7a_100000285930_100000761012 [0,0,0,0,0,2|1,0,1]=4 4527 B22R2.15222 CC(=O)CCOC(Cc1ccccc1)Cc2ccccc2 7a_100000285930_100000053229 [0,0,0,0,0,2|2,0,0]=4 4528 B22R2.15222 CC(C)CCNC(Cc1ccccc1)Cc2ccccc2 2230a_100000261440_100000210312 [0,0,0,0,0,2|2,0,0]=4 4529 B22R2.15222 CC(C)CCNC(Cc1ccccc1)Cc2ccccc2 269862a_100000261440_100000185833 [0,0,0,0,0,2|2,0,0]=4 4530 B22R2.15222 CC(C)CCOC(Cc1ccccc1)Cc2ccccc2 34a_100000285930_100000210312 [0,0,0,0,0,2|1,0,0]=3 4531 B22R2.15222 CC(C)CCOC(Cc1ccccc1)Cc2ccccc2 7a_100000285930_100000210626 [0,0,0,0,0,2|1,0,0]=3 4532 B22R2.15222 CC(C)OCOC(Cc1ccccc1)Cc2ccccc2 34a_100000285930_100000709892 [0,0,0,0,0,2|2,0,0]=4 4533 B22R2.15222 CC(O)CCOC(Cc1ccccc1)Cc2ccccc2 34a_100000285930_100012276601 [0,0,0,0,0,2|2,0,0]=4 4534 B22R2.15222 CC(O)CCOC(Cc1ccccc1)Cc2ccccc2 7a_100000285930_100012276601 [0,0,0,0,0,2|2,0,0]=4 4535 B22R2.15222 CN(C)CCCN(Cc1ccccc1)Cc2ccccc2 269982a_100000185734_100000757444 [0,0,0,0,0,2|2,0,0]=4 4536 B22R2.15222 CN(C)CCOC(Cc1ccccc1)Cc2ccccc2 7a_100000285930_100000755713 [0,0,0,0,0,2|0,0,0]=2 4537 B22R2.149966 C=C(C)CCOC(/C=C/c1ccccc1)c2ccccc2 34a_100000043163_100000730704 [0,0,0,0,0,2|1,0,1]=4 4538 B22R2.149966 C=C(C)CCOC(/C=C/c1ccccc1)c2ccccc2 7a_100000043163_100000730704 [0,0,0,0,0,2|1,0,1]=4 4539 B22R2.149966 C=C(C)CCOC(C#Cc1ccccc1)c2ccccc2 34a_200000068236_100000730704 [0,0,0,0,0,2|1,0,1]=4 4540 B22R2.149966 C=C(C)CCOC(C#Cc1ccccc1)c2ccccc2 7a_200000068236_100000730704 [0,0,0,0,0,2|1,0,1]=4 4541 B22R2.149966 C=C(C)CCOC(CCc1ccccc1)c2ccccc2 34a_200000373236_100000730704 [0,0,0,0,0,2|1,0,1]=4 4542 B22R2.149966 C=C(C)CCOC(CCc1ccccc1)c2ccccc2 7a_200000373236_100000730704 [0,0,0,0,0,2|1,0,1]=4 4543 B22R2.149966 C=C(C)CCOC(COc1ccccc1)c2ccccc2 34a_100000259978_100000730704 [0,0,0,0,0,2|1,0,1]=4 4544 B22R2.149966 C=C(C)CCOC(COc1ccccc1)c2ccccc2 7a_100000259978_100000730704 [0,0,0,0,0,2|1,0,1]=4 4545 B22R2.149966 CC(=CCOC(/C=C/c1ccccc1)c2ccccc2)C 34a_100000043163_100000761012 [0,0,0,0,0,2|1,0,1]=4 4546 B22R2.149966 CC(=CCOC(/C=C/c1ccccc1)c2ccccc2)C 7a_100000043163_100000761012 [0,0,0,0,0,2|1,0,1]=4 4547 B22R2.149966 CC(=CCOC(C#Cc1ccccc1)c2ccccc2)C 34a_200000068236_100000761012 [0,0,0,0,0,2|1,0,1]=4 4548 B22R2.149966 CC(=CCOC(C#Cc1ccccc1)c2ccccc2)C 7a_200000068236_100000761012 [0,0,0,0,0,2|1,0,1]=4 4549 B22R2.149966 CC(=CCOC(CCc1ccccc1)c2ccccc2)C 34a_200000373236_100000761012 [0,0,0,0,0,2|1,0,1]=4 4550 B22R2.149966 CC(=CCOC(CCc1ccccc1)c2ccccc2)C 7a_200000373236_100000761012 [0,0,0,0,0,2|1,0,1]=4 4551 B22R2.149966 CC(=CCOC(COc1ccccc1)c2ccccc2)C 34a_100000259978_100000761012 [0,0,0,0,0,2|1,0,1]=4 4552 B22R2.149966 CC(=CCOC(COc1ccccc1)c2ccccc2)C 7a_100000259978_100000761012 [0,0,0,0,0,2|1,0,1]=4 4553 B22R2.149966 CC(=O)CCOC(/C=C/c1ccccc1)c2ccccc2 7a_100000043163_100000053229 [0,0,0,0,0,2|2,0,0]=4 4554 B22R2.149966 CC(=O)CCOC(C#Cc1ccccc1)c2ccccc2 7a_200000068236_100000053229 [0,0,0,0,0,2|2,0,0]=4 4555 B22R2.149966 CC(=O)CCOC(CCc1ccccc1)c2ccccc2 7a_200000373236_100000053229 [0,0,0,0,0,2|2,0,0]=4 4556 B22R2.149966 CC(=O)CCOC(COc1ccccc1)c2ccccc2 7a_100000259978_100000053229 [0,0,0,0,0,2|2,0,0]=4 4557 B22R2.149966 CC(C)CCNC(CCc1ccccc1)c2ccccc2 2230a_100000741669_100000210312 [0,0,0,0,0,2|2,0,0]=4 4558 B22R2.149966 CC(C)CCNC(CCc1ccccc1)c2ccccc2 269862a_100000210545_100000685657 [0,0,0,0,0,2|2,0,0]=4 4559 B22R2.149966 CC(C)CCNC(CCc1ccccc1)c2ccccc2 269862a_100000741669_100000185833 [0,0,0,0,0,2|2,0,0]=4 4560 B22R2.149966 CC(C)CCNC(CCc1ccccc1)c2ccccc2 34a_100000741669_100000210312 [0,0,0,0,0,2|2,0,0]=4 4561 B22R2.149966 CC(C)CCNC(COc1ccccc1)c2ccccc2 269862a_100000210545_100000150584 [0,0,0,0,0,2|2,0,0]=4 4562 B22R2.149966 CC(C)CCNC(COc1ccccc1)c2ccccc2 270004a_100000210545_100000150584 [0,0,0,0,0,2|2,0,0]=4 4563 B22R2.149966 CC(C)CCOC(/C=C/c1ccccc1)c2ccccc2 34a_100000043163_100000210312 [0,0,0,0,0,2|1,0,0]=3 4564 B22R2.149966 CC(C)CCOC(/C=C/c1ccccc1)c2ccccc2 7a_100000043163_100000210626 [0,0,0,0,0,2|1,0,0]=3 4565 B22R2.149966 CC(C)CCOC(C#Cc1ccccc1)c2ccccc2 34a_200000068236_100000210312 [0,0,0,0,0,2|1,0,0]=3 4566 B22R2.149966 CC(C)CCOC(C#Cc1ccccc1)c2ccccc2 7a_200000068236_100000210626 [0,0,0,0,0,2|1,0,0]=3 4567 B22R2.149966 CC(C)CCOC(CCc1ccccc1)c2ccccc2 34a_200000373236_100000210312 [0,0,0,0,0,2|1,0,0]=3 4568 B22R2.149966 CC(C)CCOC(CCc1ccccc1)c2ccccc2 7a_200000373236_100000210626 [0,0,0,0,0,2|1,0,0]=3 4569 B22R2.149966 CC(C)CCOC(COc1ccccc1)c2ccccc2 34a_100000259978_100000210312 [0,0,0,0,0,2|1,0,0]=3 4570 B22R2.149966 CC(C)CCOC(COc1ccccc1)c2ccccc2 7a_100000259978_100000210626 [0,0,0,0,0,2|1,0,0]=3 4571 B22R2.149966 CC(C)OCOC(/C=C/c1ccccc1)c2ccccc2 34a_100000043163_100000709892 [0,0,0,0,0,2|2,0,0]=4 4572 B22R2.149966 CC(C)OCOC(C#Cc1ccccc1)c2ccccc2 34a_200000068236_100000709892 [0,0,0,0,0,2|2,0,0]=4 4573 B22R2.149966 CC(C)OCOC(CCc1ccccc1)c2ccccc2 34a_200000373236_100000709892 [0,0,0,0,0,2|2,0,0]=4 4574 B22R2.149966 CC(C)OCOC(COc1ccccc1)c2ccccc2 34a_100000259978_100000709892 [0,0,0,0,0,2|2,0,0]=4 4575 B22R2.149966 CC(O)CCOC(/C=C/c1ccccc1)c2ccccc2 34a_100000043163_100012276601 [0,0,0,0,0,2|2,0,0]=4 4576 B22R2.149966 CC(O)CCOC(/C=C/c1ccccc1)c2ccccc2 7a_100000043163_100012276601 [0,0,0,0,0,2|2,0,0]=4 4577 B22R2.149966 CC(O)CCOC(C#Cc1ccccc1)c2ccccc2 34a_200000068236_100012276601 [0,0,0,0,0,2|2,0,0]=4 4578 B22R2.149966 CC(O)CCOC(C#Cc1ccccc1)c2ccccc2 7a_200000068236_100012276601 [0,0,0,0,0,2|2,0,0]=4 4579 B22R2.149966 CC(O)CCOC(CCc1ccccc1)c2ccccc2 34a_200000373236_100012276601 [0,0,0,0,0,2|2,0,0]=4 4580 B22R2.149966 CC(O)CCOC(CCc1ccccc1)c2ccccc2 7a_200000373236_100012276601 [0,0,0,0,0,2|2,0,0]=4 4581 B22R2.149966 CC(O)CCOC(COc1ccccc1)c2ccccc2 34a_100000259978_100012276601 [0,0,0,0,0,2|2,0,0]=4 4582 B22R2.149966 CC(O)CCOC(COc1ccccc1)c2ccccc2 7a_100000259978_100012276601 [0,0,0,0,0,2|2,0,0]=4 4583 B22R2.149966 CN(C)CCNC(C=Cc1ccccc1)c2ccccn2 270004a_100000210585_100000005140 [0,0,0,0,0,2|2,0,0]=4 4584 B22R2.149966 CN(C)CCNC(CCc1ccccc1)c2ccccc2 269862a_100000210585_100000685657 [0,0,0,0,0,2|1,0,0]=3 4585 B22R2.149966 CN(C)CCNC(COc1ccccc1)c2ccccc2 269862a_100000210585_100000150584 [0,0,0,0,0,2|1,0,0]=3 4586 B22R2.149966 CN(C)CCNC(COc1ccccc1)c2ccccc2 270004a_100000210585_100000150584 [0,0,0,0,0,2|1,0,0]=3 4587 B22R2.149966 CN(C)CCOC(/C=C/c1ccccc1)c2ccccc2 7a_100000043163_100000755713 [0,0,0,0,0,2|0,0,0]=2 4588 B22R2.149966 CN(C)CCOC(C#Cc1ccccc1)c2ccccc2 7a_200000068236_100000755713 [0,0,0,0,0,2|0,0,0]=2 4589 B22R2.149966 CN(C)CCOC(CCc1ccccc1)c2ccccc2 7a_200000373236_100000755713 [0,0,0,0,0,2|0,0,0]=2 4590 B22R2.149966 CN(C)CCOC(COc1ccccc1)c2ccccc2 7a_100000259978_100000755713 [0,0,0,0,0,2|0,0,0]=2