0 B21R2.252285 C=C(C)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000730704 [0,0,0,0,0,0|2,0,1]=3 1 B21R2.252285 C=C(C)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000730704 [0,0,0,0,0,0|1,0,1]=2 2 B21R2.252285 CC(=CCOC(C)(c1ccccc1)c2ccccc2)C 7a_100011202337_100000761012 [0,0,0,0,0,0|2,0,1]=3 3 B21R2.252285 CC(=CCOC(C)(c1ccccc1)c2ccccn2)C 7a_200000075192_100000761012 [0,0,0,0,0,0|1,0,1]=2 4 B21R2.252285 CC(=O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000053229 [0,0,0,0,0,0|3,0,0]=3 5 B21R2.252285 CC(=O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000053229 [0,0,0,0,0,0|2,0,0]=2 6 B21R2.252285 CC(C)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210626 [0,0,0,0,0,0|2,0,0]=2 7 B21R2.252285 CC(C)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000210626 [0,0,0,0,0,0|1,0,0]=1 8 B21R2.252285 CC(C)CNCC(C)(c1ccccc1)c2ccccc2 2230a_100000706881_100000210760 [0,0,0,0,0,0|4,0,0]=4 9 B21R2.252285 CC(C)CNCC(C)(c1ccccc1)c2ccccc2 270004a_100000706881_100000210432 [0,0,0,0,0,0|4,0,0]=4 10 B21R2.252285 CC(O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100012276601 [0,0,0,0,0,0|3,0,0]=3 11 B21R2.252285 CC(O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100012276601 [0,0,0,0,0,0|2,0,0]=2 12 B21R2.252285 CC(OCCC(=O)N)(c1ccccc1)c2ccccc2 7a_100011202337_100000744528 [0,0,0,0,0,0|4,0,0]=4 13 B21R2.252285 CC(OCCC(=O)N)(c1ccccc1)c2ccccn2 7a_200000075192_100000744528 [0,0,0,0,0,0|3,0,0]=3 14 B21R2.252285 CN(C)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000755713 [0,0,0,0,0,0|1,0,0]=1 15 B21R2.252285 CN(C)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000755713 [0,0,0,0,0,0|0,0,0]=0 16 B20R2.10799 C=C(C)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000730704 [1,0,0,0,0,0|2,0,1]=4 17 B20R2.10799 C=C(C)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000730704 [1,0,0,0,0,0|2,0,1]=4 18 B20R2.10799 C=C(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000730704 [1,0,0,0,0,0|2,0,1]=4 19 B20R2.10799 C=C(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000730704 [1,0,0,0,0,0|1,0,1]=3 20 B20R2.10799 CC(=CCNC(c1ccccc1)c2ccccn2)C 2230a_100000689936_100000761012 [1,0,0,0,0,0|2,0,1]=4 21 B20R2.10799 CC(=CCNC(c1ccccc1)c2ccccn2)C 270004a_100000718196_100000210380 [1,0,0,0,0,0|2,0,1]=4 22 B20R2.10799 CC(=CCOC(c1ccccc1)c2ccccc2)C 34a_100000211180_100000761012 [1,0,0,0,0,0|2,0,1]=4 23 B20R2.10799 CC(=CCOC(c1ccccc1)c2ccccc2)C 7a_100000211180_100000761012 [1,0,0,0,0,0|2,0,1]=4 24 B20R2.10799 CC(=CCOC(c1ccccc1)c2ccccn2)C 7a_100000180852_100000761012 [1,0,0,0,0,0|1,0,1]=3 25 B20R2.10799 CC(=O)CCOC(c1ccccc1)c2ccccc2 1458a_100000070787_100000734929 [1,0,0,0,0,0|3,0,0]=4 26 B20R2.10799 CC(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000053229 [1,0,0,0,0,0|3,0,0]=4 27 B20R2.10799 CC(=O)CCOC(c1ccccc1)c2ccccc2 7a_100000759926_100011216954 [1,0,0,0,0,0|3,0,0]=4 28 B20R2.10799 CC(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000053229 [1,0,0,0,0,0|2,0,0]=3 29 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210312 [1,0,0,0,0,0|3,0,0]=4 30 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccc2 269862a_100000162943_100000185833 [1,0,0,0,0,0|3,0,0]=4 31 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccc2 270004a_100000210545_100000210122 [1,0,0,0,0,0|3,0,0]=4 32 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210312 [1,0,0,0,0,0|3,0,0]=4 33 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210312 [1,0,0,0,0,0|2,0,0]=3 34 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccn2 269862a_100000689936_100000185833 [1,0,0,0,0,0|2,0,0]=3 35 B20R2.10799 CC(C)CCNC(c1ccccc1)c2ccccn2 270004a_100000210545_100000210380 [1,0,0,0,0,0|2,0,0]=3 36 B20R2.10799 CC(C)CCNC(c1ccccn1)c2ccccn2 269862a_100009954364_100000185833 [1,0,0,0,0,0|3,0,0]=4 37 B20R2.10799 CC(C)CCNC(c1cccnc1)c2ccccn2 270004a_100000210545_100011376182 [1,0,0,0,0,0|3,0,0]=4 38 B20R2.10799 CC(C)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210312 [1,0,0,0,0,0|2,0,0]=3 39 B20R2.10799 CC(C)CCOC(c1ccccc1)c2ccccc2 7a_100000210254_100011216954 [1,0,0,0,0,0|2,0,0]=3 40 B20R2.10799 CC(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210626 [1,0,0,0,0,0|2,0,0]=3 41 B20R2.10799 CC(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210626 [1,0,0,0,0,0|1,0,0]=2 42 B20R2.10799 CC(C)CCSC(c1ccccc1)c2ccccc2 62a_100000210312_100011216954 [1,0,0,0,0,0|2,1,0]=4 43 B20R2.10799 CC(C)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000210312 [1,0,0,0,0,0|2,1,0]=4 44 B20R2.10799 CC(C)OCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000709892 [1,0,0,0,0,0|3,0,0]=4 45 B20R2.10799 CC(C)OCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000709892 [1,0,0,0,0,0|3,0,0]=4 46 B20R2.10799 CC(O)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100012276601 [1,0,0,0,0,0|3,0,0]=4 47 B20R2.10799 CC(O)CCNC(c1ccccc1)c2ccccn2 270004a_200000755665_100000210380 [1,0,0,0,0,0|3,0,0]=4 48 B20R2.10799 CC(O)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100012276601 [1,0,0,0,0,0|3,0,0]=4 49 B20R2.10799 CC(O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100012276601 [1,0,0,0,0,0|3,0,0]=4 50 B20R2.10799 CC(O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100012276601 [1,0,0,0,0,0|2,0,0]=3 51 B20R2.10799 CN(C)CCNC(c1ccccc1)c2ccccc2 270004a_100000210585_100000210122 [1,0,0,0,0,0|2,0,0]=3 52 B20R2.10799 CN(C)CCNC(c1ccccc1)c2ccccn2 270004a_100000210585_100000210380 [1,0,0,0,0,0|1,0,0]=2 53 B20R2.10799 CN(C)CCNC(c1ccccc1)c2cccnc2 270004a_100000210585_100000735413 [1,0,0,0,0,0|3,0,0]=4 54 B20R2.10799 CN(C)CCNC(c1cccnc1)c2ccccn2 270004a_100000210585_100011376182 [1,0,0,0,0,0|2,0,0]=3 55 B20R2.10799 CN(C)CCNC(c1cccnc1)c2cnccn2 270004a_100000210585_100000732570 [1,0,0,0,0,0|3,0,0]=4 56 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 2230a_100102631434_100000734929 [1,0,0,0,0,0|1,0,0]=2 57 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_200000210301 [1,0,0,0,0,0|1,0,0]=2 58 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 269982a_100102631434_100000734929 [1,0,0,0,0,0|1,0,0]=2 59 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_200000210301 [1,0,0,0,0,0|1,0,0]=2 60 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000755713 [1,0,0,0,0,0|1,0,0]=2 61 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000755713 [1,0,0,0,0,0|0,0,0]=1 62 B20R2.10799 CN(C)CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000755713 [1,0,0,0,0,0|1,1,0]=3 63 B20R2.10799 CN([13CH3])CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_200025704644 [1,0,0,0,0,0|1,0,0]=2 64 B20R2.10799 CN([13CH3])CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_200025704644 [1,0,0,0,0,0|1,0,0]=2 65 B20R2.10799 NC(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000744528 [1,0,0,0,0,0|3,0,0]=4 66 B20R2.19886 C#CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000688953 [1,0,0,0,0,0|2,0,1]=4 67 B20R2.19886 C#CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000688953 [1,0,0,0,0,0|1,0,1]=3 68 B20R2.19886 C/C=C/COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100102629194 [1,0,0,0,0,0|2,0,1]=4 69 B20R2.19886 C/C=C/COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100102629194 [1,0,0,0,0,0|1,0,1]=3 70 B20R2.19886 C=CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000754431 [1,0,0,0,0,0|2,0,1]=4 71 B20R2.19886 C=CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000754431 [1,0,0,0,0,0|1,0,1]=3 72 B20R2.19886 CC#CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000748600 [1,0,0,0,0,0|2,0,1]=4 73 B20R2.19886 CC#CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000748600 [1,0,0,0,0,0|1,0,1]=3 74 B20R2.19886 CC(OCCC#N)(c1ccccc1)c2ccccc2 7a_100011202337_100000184422 [1,0,0,0,0,0|3,0,0]=4 75 B20R2.19886 CC(OCCC#N)(c1ccccc1)c2ccccn2 7a_200000075192_100000184422 [1,0,0,0,0,0|2,0,0]=3 76 B20R2.19886 CC(OCCCF)(c1ccccc1)c2ccccc2 7a_100011202337_100011934791 [1,0,0,0,0,0|3,0,0]=4 77 B20R2.19886 CC(OCCCF)(c1ccccc1)c2ccccn2 7a_200000075192_100011934791 [1,0,0,0,0,0|2,0,0]=3 78 B20R2.19886 CC(OCCCO)(c1ccccc1)c2ccccc2 7a_100011202337_100011215043 [1,0,0,0,0,0|3,0,0]=4 79 B20R2.19886 CC(OCCCO)(c1ccccc1)c2ccccn2 7a_200000075192_100011215043 [1,0,0,0,0,0|2,0,0]=3 80 B20R2.19886 CC=CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000070051 [1,0,0,0,0,0|2,0,1]=4 81 B20R2.19886 CC=CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000070051 [1,0,0,0,0,0|1,0,1]=3 82 B20R2.19886 CCCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210211 [1,0,0,0,0,0|2,0,0]=3 83 B20R2.19886 CCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000210211 [1,0,0,0,0,0|1,0,0]=2 84 B20R2.19886 COCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000233755 [1,0,0,0,0,0|2,0,0]=3 85 B20R2.19886 COCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000233755 [1,0,0,0,0,0|1,0,0]=2 86 B20R2.19886 CSCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000212216 [1,0,0,0,0,0|2,0,0]=3 87 B20R2.19886 CSCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000212216 [1,0,0,0,0,0|1,0,0]=2 88 B22R2.50849 CC(C)CCC(=O)C(C)(c1ccccc1)c2ccccc2 1458a_100000752439_100000210312 [0,1,0,0,0,0|3,0,0]=4 89 B22R2.357744 CC(C)CC(C)OC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000731052 [0,1,0,0,0,0|2,0,0]=3 90 B22R2.357744 CC(C)CC(C)OC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000731052 [0,1,0,0,0,0|1,0,0]=2 91 B22R2.359861 CC(C)C(=O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000753385 [0,1,0,0,0,0|2,0,1]=4 92 B22R2.359861 CC(C)C(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000753385 [0,1,0,0,0,0|1,0,1]=3 93 B22R2.359861 CN(C)C(=O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000692301 [0,1,0,0,0,0|1,0,1]=3 94 B22R2.359861 CN(C)C(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000692301 [0,1,0,0,0,0|0,0,1]=2 95 B22R2.745520 C#CC(OCCC(C)C)(c1ccccc1)c2ccccc2 34a_100000033177_100000210312 [0,1,0,0,0,0|2,0,1]=4 96 B22R2.745520 C#CC(OCCC(C)C)(c1ccccc1)c2ccccc2 7a_100000033177_100000210626 [0,1,0,0,0,0|2,0,1]=4 97 B22R2.745520 C#CC(OCCN(C)C)(c1ccccc1)c2ccccc2 7a_100000033177_100000755713 [0,1,0,0,0,0|1,0,1]=3 98 B22R2.747804 CNC(=O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000737683 [0,1,0,0,0,0|3,0,0]=4 99 B22R2.747804 CNC(=O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000737683 [0,1,0,0,0,0|2,0,0]=3 100 B22R2.747804 COC(=O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000204255 [0,1,0,0,0,0|3,0,0]=4 101 B22R2.747804 COC(=O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000204255 [0,1,0,0,0,0|2,0,0]=3 102 B22R2.3903625 C=C(C)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000730704 [0,1,0,0,0,0|2,0,1]=4 103 B22R2.3903625 C=C(C)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000730704 [0,1,0,0,0,0|2,0,1]=4 104 B22R2.3903625 CC(=CCOC(C)(c1ccccc1)c2ccc(cc2)Cl)C 34a_100016991996_100000761012 [0,1,0,0,0,0|2,0,1]=4 105 B22R2.3903625 CC(=CCOC(C)(c1ccccc1)c2ccc(cc2)Cl)C 7a_100016991996_100000761012 [0,1,0,0,0,0|2,0,1]=4 106 B22R2.3903625 CC(=O)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000053229 [0,1,0,0,0,0|3,0,0]=4 107 B22R2.3903625 CC(C)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000210312 [0,1,0,0,0,0|2,0,0]=3 108 B22R2.3903625 CC(C)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000210626 [0,1,0,0,0,0|2,0,0]=3 109 B22R2.3903625 CC(C)OCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000709892 [0,1,0,0,0,0|3,0,0]=4 110 B22R2.3903625 CC(O)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100012276601 [0,1,0,0,0,0|3,0,0]=4 111 B22R2.3903625 CC(O)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100012276601 [0,1,0,0,0,0|3,0,0]=4 112 B22R2.3903625 CN(C)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000755713 [0,1,0,0,0,0|1,0,0]=2 113 B22R2.4040853 CC(C)(C)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000755188 [0,1,0,0,0,0|2,0,0]=3 114 B22R2.4040853 CC(C)(C)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000755188 [0,1,0,0,0,0|1,0,0]=2 115 B22R2.4040853 CC(C)(O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000702414 [0,1,0,0,0,0|2,0,0]=3 116 B22R2.4040853 CC(C)(O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000702414 [0,1,0,0,0,0|1,0,0]=2 117 B22R2.4040853 CC(OCCC(F)(F)F)(c1ccccc1)c2ccccn2 7a_200000075192_100011219754 [0,1,0,0,0,0|3,0,0]=4 118 B22R2.4040853 CC(OCCS(=O)(=O)C)(c1ccccc1)c2ccccc2 7a_100011202337_100000230027 [0,1,0,0,0,0|3,0,0]=4 119 B22R2.4040853 CC(OCCS(=O)(=O)C)(c1ccccc1)c2ccccn2 7a_200000075192_100000230027 [0,1,0,0,0,0|2,0,0]=3 120 B22R2.4040853 CC(OCC[N+](C)(C)C)(c1ccccc1)c2ccccc2 7a_100011202337_100000085578 [0,1,0,0,0,0|1,0,1]=3 121 B22R2.4040853 CC(OCC[N+](C)(C)C)(c1ccccc1)c2ccccn2 7a_200000075192_100000085578 [0,1,0,0,0,0|0,0,1]=2 122 B22R2.4040853 CC(OCC[Si](C)(C)C)(c1ccccc1)c2ccccc2 7a_100011202337_200000733723 [0,1,0,0,0,0|2,0,0]=3 123 B22R2.4040853 CC(OCC[Si](C)(C)C)(c1ccccc1)c2ccccn2 7a_200000075192_200000733723 [0,1,0,0,0,0|1,0,0]=2 124 B22R3.789659 CC(OCCC1CC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000764125 [0,0,0,1,0,0|2,0,0]=3 125 B22R3.789659 CC(OCCC1CC1)(c2ccccc2)c3ccccn3 7a_200000075192_100000764125 [0,0,0,1,0,0|1,0,0]=2 126 B22R3.789659 CC(OCCC1CO1)(c2ccccc2)c3ccccc3 7a_100011202337_100000732470 [0,0,0,1,0,0|3,0,0]=4 127 B22R3.789659 CC(OCCC1CO1)(c2ccccc2)c3ccccn3 7a_200000075192_100000732470 [0,0,0,1,0,0|2,0,0]=3 128 B22R3.104858762 C=C(C)CCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000730704 [0,0,0,1,0,0|2,0,1]=4 129 B22R3.104858762 C=C(C)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000730704 [0,0,0,1,0,0|2,0,1]=4 130 B22R3.104858762 CC(=CCOC1(c2ccccc2-c3c1cccc3)C)C 34a_100000075291_100000761012 [0,0,0,1,0,0|2,0,1]=4 131 B22R3.104858762 CC(=CCOC1(c2ccccc2-c3c1cccc3)C)C 7a_100000075291_100000761012 [0,0,0,1,0,0|2,0,1]=4 132 B22R3.104858762 CC(=O)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000053229 [0,0,0,1,0,0|3,0,0]=4 133 B22R3.104858762 CC(C)CCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000210312 [0,0,0,1,0,0|2,0,0]=3 134 B22R3.104858762 CC(C)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000210626 [0,0,0,1,0,0|2,0,0]=3 135 B22R3.104858762 CC(C)OCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000709892 [0,0,0,1,0,0|3,0,0]=4 136 B22R3.104858762 CC(O)CCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100012276601 [0,0,0,1,0,0|3,0,0]=4 137 B22R3.104858762 CC(O)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100012276601 [0,0,0,1,0,0|3,0,0]=4 138 B22R3.104858762 CN(C)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000755713 [0,0,0,1,0,0|1,0,0]=2 139 B20R2.77823 C=C(C)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000748629 [0,0,0,0,1,0|2,0,1]=4 140 B20R2.77823 C=C(C)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000748629 [0,0,0,0,1,0|1,0,1]=3 141 B20R2.77823 C=C(F)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000042424 [0,0,0,0,1,0|2,0,1]=4 142 B20R2.77823 CC(C)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210760 [0,0,0,0,1,0|2,0,0]=3 143 B20R2.77823 CC(C)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000210760 [0,0,0,0,1,0|1,0,0]=2 144 B20R2.77823 CC(C)NCC(C)(c1ccccc1)c2ccccc2 2230a_100000706881_100000210206 [0,0,0,0,1,0|3,0,0]=4 145 B20R2.77823 CC(O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100011218427 [0,0,0,0,1,0|3,0,0]=4 146 B20R2.77823 CC(O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011218427 [0,0,0,0,1,0|2,0,0]=3 147 B20R2.77823 CC(OCC(=O)N)(c1ccccc1)c2ccccn2 7a_200000075192_100000187820 [0,0,0,0,1,0|3,0,0]=4 148 B20R2.77823 CC(OCC(F)F)(c1ccccc1)c2ccccn2 7a_200000075192_100011934356 [0,0,0,0,1,0|3,0,0]=4 149 B20R2.77823 C[C@@H](O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100009817552 [0,0,0,0,1,0|3,0,0]=4 150 B20R2.77823 C[C@@H](O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100009817552 [0,0,0,0,1,0|2,0,0]=3 151 B22R2.354554 CC(=CCCOC(C)(c1ccccc1)c2ccccc2)C 7a_100011202337_100011217483 [0,0,0,0,0,1|2,0,0]=3 152 B22R2.354554 CC(=CCCOC(C)(c1ccccc1)c2ccccn2)C 7a_200000075192_100011217483 [0,0,0,0,0,1|1,0,0]=2 153 B22R2.354554 CC(=O)CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100011215641 [0,0,0,0,0,1|3,0,0]=4 154 B22R2.354554 CC(=O)CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011215641 [0,0,0,0,0,1|2,0,0]=3 155 B22R2.354554 CC(=O)NCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000189650 [0,0,0,0,0,1|3,0,0]=4 156 B22R2.354554 CC(=O)NCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000189650 [0,0,0,0,0,1|2,0,0]=3 157 B22R2.354554 CC(=O)OCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100009814007 [0,0,0,0,0,1|3,0,0]=4 158 B22R2.354554 CC(=O)OCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100009814007 [0,0,0,0,0,1|2,0,0]=3 159 B22R2.354554 CC(C)CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100011214892 [0,0,0,0,0,1|2,0,0]=3 160 B22R2.354554 CC(C)CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011214892 [0,0,0,0,0,1|1,0,0]=2 161 B22R2.354554 CC(C)CCNCC(C)(c1ccccc1)c2ccccc2 2230a_100000706881_100000210312 [0,0,0,0,0,1|3,0,0]=4 162 B22R2.354554 CC(C)CCNCC(C)(c1ccccc1)c2ccccc2 269862a_100000706881_100000185833 [0,0,0,0,0,1|3,0,0]=4 163 B22R2.354554 CC(C)OCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000211751 [0,0,0,0,0,1|2,0,0]=3 164 B22R2.354554 CC(C)OCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000211751 [0,0,0,0,0,1|1,0,0]=2 165 B22R2.354554 CC(C)SCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000730970 [0,0,0,0,0,1|2,0,0]=3 166 B22R2.354554 CC(C)SCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000730970 [0,0,0,0,0,1|1,0,0]=2 167 B22R2.354554 CC(O)CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_200000718107 [0,0,0,0,0,1|3,0,0]=4 168 B22R2.354554 CC(O)CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_200000718107 [0,0,0,0,0,1|2,0,0]=3 169 B22R2.354554 CC(OCCC=C(F)F)(c1ccccc1)c2ccccn2 7a_200000075192_200009816681 [0,0,0,0,0,1|3,0,0]=4 170 B22R2.354554 CC(OCCCC(=O)N)(c1ccccc1)c2ccccn2 7a_200000075192_100102525003 [0,0,0,0,0,1|3,0,0]=4 171 B22R2.354554 CC(OCCNC(=O)N)(c1ccccc1)c2ccccn2 7a_200000075192_200000034859 [0,0,0,0,0,1|3,0,0]=4 172 B22R2.354554 CC(OCCOC(=O)N)(c1ccccc1)c2ccccn2 7a_200000075192_200011214921 [0,0,0,0,0,1|3,0,0]=4 173 B22R2.354554 CN(C)CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000757444 [0,0,0,0,0,1|1,0,0]=2 174 B22R2.354554 CN(C)CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000757444 [0,0,0,0,0,1|0,0,0]=1 175 B22R2.354554 CN(C)CCOCP(=O)(c1ccccc1)c2ccccc2 7a_200000030349_100000755713 [0,0,0,0,0,1|3,0,0]=4 176 B19R2.2474 C#CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000688953 [2,0,0,0,0,0|1,0,1]=4 177 B19R2.2474 C/C=C/COC(c1ccccc1)c2ccccn2 7a_100000180852_100102629194 [2,0,0,0,0,0|1,0,1]=4 178 B19R2.2474 C=CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000754431 [2,0,0,0,0,0|1,0,1]=4 179 B19R2.2474 CC#CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000748600 [2,0,0,0,0,0|1,0,1]=4 180 B19R2.2474 CC=CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000070051 [2,0,0,0,0,0|1,0,1]=4 181 B19R2.2474 CCCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210211 [2,0,0,0,0,0|2,0,0]=4 182 B19R2.2474 CCCCNC(c1ccccc1)c2ccccn2 270004a_100000102301_100000210380 [2,0,0,0,0,0|2,0,0]=4 183 B19R2.2474 CCCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210210 [2,0,0,0,0,0|2,0,0]=4 184 B19R2.2474 CCCCOC(c1ccccc1)c2ccccc2 7a_100000210227_100011216954 [2,0,0,0,0,0|2,0,0]=4 185 B19R2.2474 CCCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210211 [2,0,0,0,0,0|2,0,0]=4 186 B19R2.2474 CCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000210211 [2,0,0,0,0,0|1,0,0]=3 187 B19R2.2474 CNCCOC(c1ccccc1)c2ccccc2 2230a_106832991635_100000734929 [2,0,0,0,0,0|1,0,0]=3 188 B19R2.2474 CNCCOC(c1ccccc1)c2ccccc2 34a_100102657272_100000734929 [2,0,0,0,0,0|1,0,0]=3 189 B19R2.2474 CNCCOC(c1ccccc1)c2ccccc2 7a_106832991635_100000734929 [2,0,0,0,0,0|1,0,0]=3 190 B19R2.2474 COCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100011201679 [2,0,0,0,0,0|2,0,0]=4 191 B19R2.2474 COCCNC(c1ccccc1)c2ccccn2 270004a_100000209980_100000210380 [2,0,0,0,0,0|2,0,0]=4 192 B19R2.2474 COCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011201679 [2,0,0,0,0,0|2,0,0]=4 193 B19R2.2474 COCCOC(c1ccccc1)c2ccccc2 34a_100138415774_100000734929 [2,0,0,0,0,0|2,0,0]=4 194 B19R2.2474 COCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000233755 [2,0,0,0,0,0|2,0,0]=4 195 B19R2.2474 COCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000233755 [2,0,0,0,0,0|1,0,0]=3 196 B19R2.2474 CSCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000751147 [2,0,0,0,0,0|2,0,0]=4 197 B19R2.2474 CSCCNC(c1ccccc1)c2ccccn2 270004a_100020590264_100000210380 [2,0,0,0,0,0|2,0,0]=4 198 B19R2.2474 CSCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000212216 [2,0,0,0,0,0|2,0,0]=4 199 B19R2.2474 CSCCOC(c1ccccc1)c2ccccc2 62a_100000734929_200000210301 [2,0,0,0,0,0|2,0,0]=4 200 B19R2.2474 CSCCOC(c1ccccc1)c2ccccc2 62a_200000210301_100000734929 [2,0,0,0,0,0|2,0,0]=4 201 B19R2.2474 CSCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000212216 [2,0,0,0,0,0|2,0,0]=4 202 B19R2.2474 CSCCOC(c1ccccc1)c2ccccc2 7a_100000230434_100011216954 [2,0,0,0,0,0|2,0,0]=4 203 B19R2.2474 CSCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000212216 [2,0,0,0,0,0|1,0,0]=3 204 B19R2.2474 FCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011934791 [2,0,0,0,0,0|2,0,0]=4 205 B19R2.2474 N#CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000184422 [2,0,0,0,0,0|2,0,0]=4 206 B19R2.2474 OCCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011215043 [2,0,0,0,0,0|2,0,0]=4 207 B19R2.2474 [13CH3]SCCOC(c1ccccc1)c2ccccc2 62a_100000734929_200025704644 [2,0,0,0,0,0|2,0,0]=4 208 B19R2.2474 [13CH3]SCCOC(c1ccccc1)c2ccccc2 62a_200025704644_100000734929 [2,0,0,0,0,0|2,0,0]=4 209 B19R2.13225 C#CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000038162 [2,0,0,0,0,0|0,0,2]=4 210 B19R2.13225 C=CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100015514636 [2,0,0,0,0,0|0,0,2]=4 211 B19R2.13225 CC(OCC#N)(c1ccccc1)c2ccccn2 7a_200000075192_100011215382 [2,0,0,0,0,0|0,0,2]=4 212 B19R2.13225 CC(OCC=O)(c1ccccc1)c2ccccn2 7a_200000075192_200015260668 [2,0,0,0,0,0|1,0,1]=4 213 B19R2.13225 CC(OCCF)(c1ccccc1)c2ccccc2 7a_100011202337_100011217306 [2,0,0,0,0,0|2,0,0]=4 214 B19R2.13225 CC(OCCF)(c1ccccc1)c2ccccn2 7a_200000075192_100011217306 [2,0,0,0,0,0|1,0,0]=3 215 B19R2.13225 CC(OCCO)(c1ccccc1)c2ccccc2 7a_100011202337_100000211926 [2,0,0,0,0,0|2,0,0]=4 216 B19R2.13225 CC(OCCO)(c1ccccc1)c2ccccn2 7a_200000075192_100000211926 [2,0,0,0,0,0|1,0,0]=3 217 B19R2.13225 CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210303 [2,0,0,0,0,0|1,0,0]=3 218 B19R2.13225 CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000210303 [2,0,0,0,0,0|0,0,0]=2 219 B21R2.21291 CC(CO)CCNC(c1ccccc1)c2ccccn2 270004a_106354213184_100000210380 [1,1,0,0,0,0|2,0,0]=4 220 B21R2.21291 CCC(C)CCNC(c1ccccc1)c2ccccn2 270004a_100020591266_100000210380 [1,1,0,0,0,0|2,0,0]=4 221 B21R2.21291 CCC(C)CCOC(c1ccccc1)c2ccccc2 7a_100011215188_100011216954 [1,1,0,0,0,0|2,0,0]=4 222 B21R2.21291 CCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_100000225621_100000734929 [1,1,0,0,0,0|1,0,0]=3 223 B21R2.21291 CCN(C)CCOC(c1ccccc1)c2ccccc2 2230a_200016989109_100000210202 [1,1,0,0,0,0|1,0,0]=3 224 B21R2.21291 CCN(C)CCOC(c1ccccc1)c2ccccc2 269982a_100000225621_100000734929 [1,1,0,0,0,0|1,0,0]=3 225 B21R2.21291 CCN(C)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100000204670 [1,1,0,0,0,0|1,0,0]=3 226 B21R2.21291 CN(CF)CCOC(c1ccccc1)c2ccccc2 269982a_200016989109_100015361967 [1,1,0,0,0,0|1,0,0]=3 227 B21R2.21291 CNC(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000737683 [1,1,0,0,0,0|2,0,0]=4 228 B21R2.21291 COC(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000204255 [1,1,0,0,0,0|2,0,0]=4 229 B21R2.21291 COC(C)CCOC(c1ccccc1)c2ccccc2 7a_100000764861_100011216954 [1,1,0,0,0,0|2,0,0]=4 230 B21R2.32761 CC(C)C(=O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000753385 [1,1,0,0,0,0|1,0,1]=4 231 B21R2.32761 CC(C)C(O)CNC(c1ccccc1)c2ccccn2 270004a_100000759067_100000210380 [1,1,0,0,0,0|2,0,0]=4 232 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000185267 [1,1,0,0,0,0|1,0,1]=4 233 B21R2.32761 CN(C)C(=O)CNC(c1ccccc1)c2ccccn2 270004a_100015183351_100000210380 [1,1,0,0,0,0|1,0,1]=4 234 B21R2.32761 CN(C)C(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000692301 [1,1,0,0,0,0|1,0,1]=4 235 B21R2.32761 CN(C)C(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000692301 [1,1,0,0,0,0|1,0,1]=4 236 B21R2.32761 CN(C)C(=O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000692301 [1,1,0,0,0,0|0,0,1]=3 237 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000755188 [1,1,0,0,0,0|2,0,0]=4 238 B21R2.38886 CC(C)(C)CCNC(c1ccccc1)c2ccccn2 270004a_100000738805_100000210380 [1,1,0,0,0,0|2,0,0]=4 239 B21R2.38886 CC(C)(C)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000755188 [1,1,0,0,0,0|2,0,0]=4 240 B21R2.38886 CC(C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000755188 [1,1,0,0,0,0|2,0,0]=4 241 B21R2.38886 CC(C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000765024_100011216954 [1,1,0,0,0,0|2,0,0]=4 242 B21R2.38886 CC(C)(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000755188 [1,1,0,0,0,0|1,0,0]=3 243 B21R2.38886 CC(C)(F)CCNC(c1ccccc1)c2ccccn2 270004a_100016253952_100000210380 [1,1,0,0,0,0|2,0,0]=4 244 B21R2.38886 CC(C)(O)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000702414 [1,1,0,0,0,0|2,0,0]=4 245 B21R2.38886 CC(C)(O)CCNC(c1ccccc1)c2ccccn2 270004a_100000707701_100000210380 [1,1,0,0,0,0|2,0,0]=4 246 B21R2.38886 CC(C)(O)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000702414 [1,1,0,0,0,0|2,0,0]=4 247 B21R2.38886 CC(C)(O)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000702414 [1,1,0,0,0,0|2,0,0]=4 248 B21R2.38886 CC(C)(O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000702414 [1,1,0,0,0,0|1,0,0]=3 249 B21R2.38886 CS(=O)(=O)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000230027 [1,1,0,0,0,0|2,0,0]=4 250 B21R2.38886 C[N+](C)(C)CCNC(c1ccccc1)c2ccccn2 270004a_100000106457_100000210380 [1,1,0,0,0,0|1,0,1]=4 251 B21R2.38886 C[N+](C)(C)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000085578 [1,1,0,0,0,0|1,0,1]=4 252 B21R2.38886 C[N+](C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000085578 [1,1,0,0,0,0|1,0,1]=4 253 B21R2.38886 C[N+](C)(C)CCOC(c1ccccc1)c2ccccc2 7a_200020618287_100011216954 [1,1,0,0,0,0|1,0,1]=4 254 B21R2.38886 C[N+](C)(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000085578 [1,1,0,0,0,0|0,0,1]=3 255 B21R2.38886 C[Si](C)(C)CCNC(c1ccccc1)c2ccccn2 2230a_100000689936_200000733723 [1,1,0,0,0,0|2,0,0]=4 256 B21R2.38886 C[Si](C)(C)CCOC(c1ccccc1)c2ccccc2 34a_100000211180_200000733723 [1,1,0,0,0,0|2,0,0]=4 257 B21R2.38886 C[Si](C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000039746_100011216954 [1,1,0,0,0,0|2,0,0]=4 258 B21R2.38886 C[Si](C)(C)CCOC(c1ccccc1)c2ccccc2 7a_100000211180_200000733723 [1,1,0,0,0,0|2,0,0]=4 259 B21R2.38886 C[Si](C)(C)CCOC(c1ccccc1)c2ccccn2 7a_100000180852_200000733723 [1,1,0,0,0,0|1,0,0]=3 260 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2ccccn2 2230a_100000689936_100000731052 [1,1,0,0,0,0|2,0,0]=4 261 B21R2.97772 CC(C)CC(C)NC(c1ccccc1)c2ccccn2 270004a_100000692259_100000210380 [1,1,0,0,0,0|2,0,0]=4 262 B21R2.97772 CC(C)CC(C)OC(c1ccccc1)c2ccccc2 34a_100000211180_100000731052 [1,1,0,0,0,0|2,0,0]=4 263 B21R2.97772 CC(C)CC(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_100000731052 [1,1,0,0,0,0|2,0,0]=4 264 B21R2.97772 CC(C)CC(C)OC(c1ccccc1)c2ccccc2 7a_100000211805_100011216954 [1,1,0,0,0,0|2,0,0]=4 265 B21R2.97772 CC(C)CC(C)OC(c1ccccc1)c2ccccn2 7a_100000180852_100000731052 [1,1,0,0,0,0|1,0,0]=3 266 B21R2.97772 CC(CN(C)C)SC(c1ccccc1)c2ccccc2 62a_100000211591_100020606517 [1,1,0,0,0,0|1,1,0]=4 267 B21R2.97772 CC(CN(C)C)SC(c1ccccc1)c2ccccc2 62a_100020606517_100011216954 [1,1,0,0,0,0|1,1,0]=4 268 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccccn2 11a_100000689936_100000750896 [1,1,0,0,0,0|1,0,1]=4 269 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccccn2 240690a_100000689936_100000750896 [1,1,0,0,0,0|1,0,1]=4 270 B21R2.97772 CN(C)CC(=O)NC(c1ccccc1)c2ccccn2 527a_100000689936_100000750896 [1,1,0,0,0,0|1,0,1]=4 271 B21R2.103739 CC(C)CCNC(c1cccc(c1)Cl)c2ccccn2 270004a_100000210545_100000688346 [1,1,0,0,0,0|2,0,0]=4 272 B21R2.103739 CC(C)CCOC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100000210312 [1,1,0,0,0,0|2,0,0]=4 273 B21R2.103739 CC(C)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000210626 [1,1,0,0,0,0|2,0,0]=4 274 B21R2.103739 CC(C)CCOC(c1ccccc1)c2cccc(c2)F 34a_100000749007_100000210312 [1,1,0,0,0,0|2,0,0]=4 275 B21R2.103739 CC(C)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000210626 [1,1,0,0,0,0|2,0,0]=4 276 B21R2.103739 CN(C)CCNC(c1cccc(c1)Cl)c2ccccn2 270004a_100000210585_100000688346 [1,1,0,0,0,0|1,0,0]=3 277 B21R2.103739 CN(C)CCNC(c1ccccc1)c2cccc(c2)Br 270004a_100000210585_100011267660 [1,1,0,0,0,0|2,0,0]=4 278 B21R2.103739 CN(C)CCNC(c1ccccc1)c2cccc(c2)Cl 270004a_100000210585_100011215489 [1,1,0,0,0,0|2,0,0]=4 279 B21R2.103739 CN(C)CCNC(c1ccccc1)c2cccc(c2)F 270004a_100000210585_200011219850 [1,1,0,0,0,0|2,0,0]=4 280 B21R2.103739 CN(C)CCOC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100000755713 [1,1,0,0,0,0|1,0,0]=3 281 B21R2.103739 CN(C)CCOC(c1ccccc1)c2cccc(c2)F 7a_100000749007_100000755713 [1,1,0,0,0,0|1,0,0]=3 282 B21R2.103739 Cc1cccc(c1)C(NCCN(C)C)c2ccccc2 270004a_100000210585_100011217825 [1,1,0,0,0,0|2,0,0]=4 283 B21R2.205989 CC(C)CCNC(c1ccccn1)c2ccccc2Cl 270004a_100000210545_100011400554 [1,1,0,0,0,0|2,0,0]=4 284 B21R2.205989 CC(C)CCOC(c1ccccc1)c2ccccc2Cl 34a_200011400577_100000210312 [1,1,0,0,0,0|2,0,0]=4 285 B21R2.205989 CC(C)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000210626 [1,1,0,0,0,0|2,0,0]=4 286 B21R2.205989 CC(C)CCOC(c1ccccc1)c2ccccc2N 34a_100000246470_100000210312 [1,1,0,0,0,0|2,0,0]=4 287 B21R2.205989 CC(C)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000210626 [1,1,0,0,0,0|2,0,0]=4 288 B21R2.205989 CN(C)CCNC(c1ccccc1)c2ccccc2Br 270004a_100000210585_100000198044 [1,1,0,0,0,0|2,0,0]=4 289 B21R2.205989 CN(C)CCNC(c1ccccc1)c2ccccc2Cl 270004a_100000210585_100011215288 [1,1,0,0,0,0|2,0,0]=4 290 B21R2.205989 CN(C)CCNC(c1ccccc1)c2ccccc2F 270004a_100000210585_100011217773 [1,1,0,0,0,0|2,0,0]=4 291 B21R2.205989 CN(C)CCNC(c1ccccn1)c2ccccc2Cl 270004a_100000210585_100011400554 [1,1,0,0,0,0|1,0,0]=3 292 B21R2.205989 CN(C)CCOC(c1ccccc1)c2ccccc2Cl 7a_200011400577_100000755713 [1,1,0,0,0,0|1,0,0]=3 293 B21R2.205989 CN(C)CCOC(c1ccccc1)c2ccccc2N 7a_100000246470_100000755713 [1,1,0,0,0,0|1,0,0]=3 294 B21R2.205989 Cc1ccccc1C(NCCN(C)C)c2ccccc2 270004a_100000210585_100000735561 [1,1,0,0,0,0|2,0,0]=4 295 B21R2.205989 Cc1ccccc1C(OCCC(C)C)c2ccccc2 34a_100000212071_100000210312 [1,1,0,0,0,0|2,0,0]=4 296 B21R2.205989 Cc1ccccc1C(OCCC(C)C)c2ccccc2 7a_100000210254_100000230135 [1,1,0,0,0,0|2,0,0]=4 297 B21R2.205989 Cc1ccccc1C(OCCC(C)C)c2ccccc2 7a_100000212071_100000210626 [1,1,0,0,0,0|2,0,0]=4 298 B21R2.205989 Cc1ccccc1C(OCCN(C)C)c2ccccc2 7a_100000212071_100000755713 [1,1,0,0,0,0|1,0,0]=3 299 B21R2.205989 Cc1ccccc1C(SCCN(C)C)c2ccccc2 62a_100000230135_100000755713 [1,1,0,0,0,0|1,1,0]=4 300 B21R2.366996 C=C(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000730704 [1,1,0,0,0,0|1,0,1]=4 301 B21R2.366996 CC(=CCOC(c1ccc(cc1)Cl)c2ccccn2)C 34a_100000242608_100000761012 [1,1,0,0,0,0|1,0,1]=4 302 B21R2.366996 CC(=O)CCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000759926_200010188304 [1,1,0,0,0,0|2,0,0]=4 303 B21R2.366996 CC(C)CCNC(c1ccc(cc1)Br)c2ccccn2 270004a_100000210545_200010179208 [1,1,0,0,0,0|2,0,0]=4 304 B21R2.366996 CC(C)CCNC(c1ccc(cc1)Cl)c2ccccn2 270004a_100000210545_100000753647 [1,1,0,0,0,0|2,0,0]=4 305 B21R2.366996 CC(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000210312 [1,1,0,0,0,0|1,0,0]=3 306 B21R2.366996 CC(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 7a_100000210254_200010188304 [1,1,0,0,0,0|1,0,0]=3 307 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_100000210312 [1,1,0,0,0,0|2,0,0]=4 308 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000210626 [1,1,0,0,0,0|2,0,0]=4 309 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_100000210312 [1,1,0,0,0,0|2,0,0]=4 310 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000210254_100000211669 [1,1,0,0,0,0|2,0,0]=4 311 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000210626 [1,1,0,0,0,0|2,0,0]=4 312 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_100000210312 [1,1,0,0,0,0|2,0,0]=4 313 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000210626 [1,1,0,0,0,0|2,0,0]=4 314 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_100000210312 [1,1,0,0,0,0|2,0,0]=4 315 B21R2.366996 CC(C)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000210626 [1,1,0,0,0,0|2,0,0]=4 316 B21R2.366996 CC(C)CCSC(c1ccc(cc1)Cl)c2ccccn2 62a_100000210312_200010188304 [1,1,0,0,0,0|1,1,0]=4 317 B21R2.366996 CC(C)CCSC(c1ccc(cc1)Cl)c2ccccn2 62a_200010188304_100000210312 [1,1,0,0,0,0|1,1,0]=4 318 B21R2.366996 CC(C)OCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100000709892 [1,1,0,0,0,0|2,0,0]=4 319 B21R2.366996 CC(O)CCOC(c1ccc(cc1)Cl)c2ccccn2 34a_100000242608_100012276601 [1,1,0,0,0,0|2,0,0]=4 320 B21R2.366996 CN(C)CCNC(c1ccc(cc1)Br)c2ccccn2 270004a_100000210585_200010179208 [1,1,0,0,0,0|1,0,0]=3 321 B21R2.366996 CN(C)CCNC(c1ccc(cc1)Cl)c2ccccn2 270004a_100000210585_100000753647 [1,1,0,0,0,0|1,0,0]=3 322 B21R2.366996 CN(C)CCNC(c1ccccc1)c2ccc(cc2)Br 270004a_100000210585_100000718703 [1,1,0,0,0,0|2,0,0]=4 323 B21R2.366996 CN(C)CCNC(c1ccccc1)c2ccc(cc2)Cl 270004a_100000210585_100000211064 [1,1,0,0,0,0|2,0,0]=4 324 B21R2.366996 CN(C)CCNC(c1ccccc1)c2ccc(cc2)F 270004a_100000210585_100000210425 [1,1,0,0,0,0|2,0,0]=4 325 B21R2.366996 CN(C)CCOC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_100000755713 [1,1,0,0,0,0|1,0,0]=3 326 B21R2.366996 CN(C)CCOC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_100000755713 [1,1,0,0,0,0|1,0,0]=3 327 B21R2.366996 CN(C)CCOC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_100000755713 [1,1,0,0,0,0|1,0,0]=3 328 B21R2.366996 CN(C)CCOC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_100000755713 [1,1,0,0,0,0|1,0,0]=3 329 B21R2.366996 CN(C)CCSC(c1ccc(cc1)Cl)c2ccccn2 62a_200010188304_100000755713 [1,1,0,0,0,0|0,1,0]=3 330 B21R2.366996 CN(C)CCSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_100000755713 [1,1,0,0,0,0|1,1,0]=4 331 B21R2.366996 Cc1ccc(cc1)C(NCCN(C)C)c2ccccc2 270004a_100000210585_100000210966 [1,1,0,0,0,0|2,0,0]=4 332 B21R2.366996 Cc1ccc(cc1)C(OCCC(C)C)c2ccccc2 34a_100000212064_100000210312 [1,1,0,0,0,0|2,0,0]=4 333 B21R2.366996 Cc1ccc(cc1)C(OCCC(C)C)c2ccccc2 7a_100000212064_100000210626 [1,1,0,0,0,0|2,0,0]=4 334 B21R2.366996 Cc1ccc(cc1)C(OCCN(C)C)c2ccccc2 7a_100000212064_100000755713 [1,1,0,0,0,0|1,0,0]=3 335 B21R2.402445 CC(C)CCN(C)C(c1ccccc1)c2ccccn2 270004a_100000742789_100000210380 [1,1,0,0,0,0|2,0,0]=4 336 B21R2.402445 CN(C)CCN(C)C(c1ccccc1)c2ccccc2 269982a_100000225618_100000211591 [1,1,0,0,0,0|2,0,0]=4 337 B21R2.402445 CN(C)CCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000755713 [1,1,0,0,0,0|2,0,0]=4 338 B21R2.402445 CN(C)CCN(C)C(c1ccccc1)c2ccccc2 270004a_100000225618_100000210122 [1,1,0,0,0,0|2,0,0]=4 339 B21R2.402445 CN(C)CCN(C)C(c1ccccc1)c2ccccn2 270004a_100000225618_100000210380 [1,1,0,0,0,0|1,0,0]=3 340 B21R2.402445 CN(C)CCN(C)C(c1cccnc1)c2ccccn2 270004a_100000225618_100011376182 [1,1,0,0,0,0|2,0,0]=4 341 B21R2.7555 C#CCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011215417 [1,1,0,0,0,0|1,0,1]=4 342 B21R2.7555 C=CCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000757094 [1,1,0,0,0,0|1,0,1]=4 343 B21R2.7555 C=COCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000039644 [1,1,0,0,0,0|1,0,1]=4 344 B21R2.7555 CC(OCC#CCO)(c1ccccc1)c2ccccn2 7a_200000075192_200000047223 [1,1,0,0,0,0|1,0,1]=4 345 B21R2.7555 CC(OCCCC#N)(c1ccccc1)c2ccccn2 7a_200000075192_100000687738 [1,1,0,0,0,0|1,0,1]=4 346 B21R2.7555 CC(OCCCC=O)(c1ccccc1)c2ccccn2 7a_200000075192_200011292268 [1,1,0,0,0,0|1,0,1]=4 347 B21R2.7555 CC(OCCCCF)(c1ccccc1)c2ccccc2 7a_100011202337_100000729493 [1,1,0,0,0,0|2,0,0]=4 348 B21R2.7555 CC(OCCCCF)(c1ccccc1)c2ccccn2 7a_200000075192_100000729493 [1,1,0,0,0,0|1,0,0]=3 349 B21R2.7555 CC(OCCCCO)(c1ccccc1)c2ccccc2 7a_100011202337_100000210776 [1,1,0,0,0,0|2,0,0]=4 350 B21R2.7555 CC(OCCCCO)(c1ccccc1)c2ccccn2 7a_200000075192_100000210776 [1,1,0,0,0,0|1,0,0]=3 351 B21R2.7555 CC/C=C\COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100103147603 [1,1,0,0,0,0|1,0,1]=4 352 B21R2.7555 CCC#CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100009813939 [1,1,0,0,0,0|1,0,1]=4 353 B21R2.7555 CCCCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210326 [1,1,0,0,0,0|2,0,0]=4 354 B21R2.7555 CCCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000210326 [1,1,0,0,0,0|1,0,0]=3 355 B21R2.7555 CCOCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100011215890 [1,1,0,0,0,0|2,0,0]=4 356 B21R2.7555 CCOCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011215890 [1,1,0,0,0,0|1,0,0]=3 357 B21R2.7555 CCSCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000757381 [1,1,0,0,0,0|2,0,0]=4 358 B21R2.7555 CCSCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000757381 [1,1,0,0,0,0|1,0,0]=3 359 B21R2.7555 COCCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000740836 [1,1,0,0,0,0|2,0,0]=4 360 B21R2.7555 COCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000740836 [1,1,0,0,0,0|1,0,0]=3 361 B21R2.22881 C=CC(O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000730141 [1,1,0,0,0,0|1,0,1]=4 362 B21R2.22881 CC(OCC(O)CO)(c1ccccc1)c2ccccn2 7a_200000075192_100011219619 [1,1,0,0,0,0|2,0,0]=4 363 B21R2.22881 CC(OC[C@@H](O)CF)(c1ccccc1)c2ccccn2 7a_200000075192_100015614560 [1,1,0,0,0,0|2,0,0]=4 364 B21R2.22881 CC(OC[C@@H](O)CO)(c1ccccc1)c2ccccn2 7a_200000075192_100009815848 [1,1,0,0,0,0|2,0,0]=4 365 B21R2.22881 CCC(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000747405 [1,1,0,0,0,0|1,0,1]=4 366 B21R2.22881 CCC(C)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000748023 [1,1,0,0,0,0|2,0,0]=4 367 B21R2.22881 CCC(C)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000748023 [1,1,0,0,0,0|1,0,0]=3 368 B21R2.22881 CCC(O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100011218378 [1,1,0,0,0,0|2,0,0]=4 369 B21R2.22881 CCC(O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011218378 [1,1,0,0,0,0|1,0,0]=3 370 B21R2.22881 CC[C@H](C)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100009816398 [1,1,0,0,0,0|2,0,0]=4 371 B21R2.22881 CC[C@H](C)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100009816398 [1,1,0,0,0,0|1,0,0]=3 372 B21R2.22881 CNC(=O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000183359 [1,1,0,0,0,0|1,0,1]=4 373 B21R2.22881 CNC(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000183359 [1,1,0,0,0,0|0,0,1]=3 374 B21R2.22881 COC(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000747449 [1,1,0,0,0,0|1,0,1]=4 375 B21R2.22881 C[C@@H](CO)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000059175 [1,1,0,0,0,0|2,0,0]=4 376 B21R2.24795 CCCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000210210 [1,1,0,0,0,0|2,0,0]=4 377 B21R2.24795 CCCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000210211 [1,1,0,0,0,0|2,0,0]=4 378 B21R2.24795 COCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100011201679 [1,1,0,0,0,0|2,0,0]=4 379 B21R2.24795 COCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000233755 [1,1,0,0,0,0|2,0,0]=4 380 B21R2.24795 CSCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000212216 [1,1,0,0,0,0|2,0,0]=4 381 B21R2.24795 CSCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000212216 [1,1,0,0,0,0|2,0,0]=4 382 B21R2.26144 CC(CC#N)OC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100009813641 [1,1,0,0,0,0|2,0,0]=4 383 B21R2.26144 CC(CCO)OC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100009893172 [1,1,0,0,0,0|2,0,0]=4 384 B21R2.26144 CCCC(C)OC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000766640 [1,1,0,0,0,0|2,0,0]=4 385 B21R2.26144 CCCC(C)OC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000766640 [1,1,0,0,0,0|1,0,0]=3 386 B21R2.26144 COCC(C)OC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000765312 [1,1,0,0,0,0|2,0,0]=4 387 B21R2.26144 COCC(C)OC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000765312 [1,1,0,0,0,0|1,0,0]=3 388 B21R2.32715 CC(=O)C(C)OC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000179758 [0,1,0,0,1,0|2,0,0]=4 389 B21R2.508904 CN(C)CCC(C#N)(c1ccccc1)c2ccccc2 2230a_100102631434_100000489411 [0,1,0,0,1,0|1,0,1]=4 390 B21R2.508904 CN(C)CCC(C#N)(c1ccccc1)c2ccccc2 269982a_100102631434_100000489411 [0,1,0,0,1,0|1,0,1]=4 391 B21R2.3174386 CC(C)COC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000210624 [0,1,0,0,1,0|2,0,0]=4 392 B21R2.3174386 CC(C)COC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000210760 [0,1,0,0,1,0|2,0,0]=4 393 B21R2.3257742 CC(C)(O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000764493 [0,1,0,0,1,0|2,0,0]=4 394 B21R2.3257742 CC(C)(O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000764493 [0,1,0,0,1,0|1,0,0]=3 395 B21R2.3257742 CC(OC[Si](C)(C)C)(c1ccccc1)c2ccccc2 7a_100011202337_100000233785 [0,1,0,0,1,0|2,0,0]=4 396 B21R2.3257742 CC(OC[Si](C)(C)C)(c1ccccc1)c2ccccn2 7a_200000075192_100000233785 [0,1,0,0,1,0|1,0,0]=3 397 B23R2.472023 CN(C)CCCC(=O)C(C)(c1ccccc1)c2ccccc2 1458a_100000752439_100000695564 [0,1,0,0,0,1|2,0,0]=4 398 B23R2.472023 CN(C)CCNC(=O)C(C)(c1ccccc1)c2ccccc2 240690a_100000210585_100000752439 [0,1,0,0,0,1|2,0,0]=4 399 B23R2.472023 CN(C)CCNC(=O)C(C)(c1ccccc1)c2ccccc2 527a_100000210585_100000752439 [0,1,0,0,0,1|2,0,0]=4 400 B23R2.746948 CCN(C)CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100015186262 [0,1,0,0,0,1|1,0,0]=3 401 B23R2.746948 CCN(C)CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100015186262 [0,1,0,0,0,1|0,0,0]=2 402 B23R2.746948 CNC(=O)CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000741757 [0,1,0,0,0,1|2,0,0]=4 403 B23R2.746948 CNC(=O)OCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_200011997002 [0,1,0,0,0,1|2,0,0]=4 404 B23R2.746948 COC(=O)CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011218270 [0,1,0,0,0,1|2,0,0]=4 405 B23R2.815793 CC(C)NC(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000183996 [0,1,0,0,0,1|1,0,1]=4 406 B23R2.815793 CC(C)OC(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011215430 [0,1,0,0,0,1|1,0,1]=4 407 B23R2.815793 CC(COC(C)(c1ccccc1)c2ccccc2)CN(C)C 7a_100011202337_100015348159 [0,1,0,0,0,1|1,0,0]=3 408 B23R2.815793 CC(COC(C)(c1ccccc1)c2ccccn2)CN(C)C 7a_200000075192_100015348159 [0,1,0,0,0,1|0,0,0]=2 409 B23R2.1033012 C#CC(OCCCN(C)C)(c1ccccc1)c2ccccc2 7a_100000033177_100000757444 [0,1,0,0,0,1|1,0,1]=4 410 B23R2.3261774 CC(C)(O)CCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100009888830 [0,1,0,0,0,1|2,0,0]=4 411 B23R2.3261774 CC(C)(O)CCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100009888830 [0,1,0,0,0,1|1,0,0]=3 412 B23R2.3261774 CC(OCC#C[Si](C)(C)C)(c1ccccc1)c2ccccn2 7a_200000075192_100000764098 [0,1,0,0,0,1|1,0,1]=4 413 B23R2.3261774 CC(OCCCS(=O)(=O)C)(c1ccccc1)c2ccccn2 7a_200000075192_100000754308 [0,1,0,0,0,1|2,0,0]=4 414 B23R2.3261774 CC(OCCC[N+](C)(C)C)(c1ccccc1)c2ccccc2 7a_100011202337_100016990835 [0,1,0,0,0,1|1,0,1]=4 415 B23R2.3261774 CC(OCCC[N+](C)(C)C)(c1ccccc1)c2ccccn2 7a_200000075192_100016990835 [0,1,0,0,0,1|0,0,1]=3 416 B23R2.3261774 CC(OCCC[Si](C)(C)C)(c1ccccc1)c2ccccc2 7a_100011202337_100011219597 [0,1,0,0,0,1|2,0,0]=4 417 B23R2.3261774 CC(OCCC[Si](C)(C)C)(c1ccccc1)c2ccccn2 7a_200000075192_100011219597 [0,1,0,0,0,1|1,0,0]=3 418 B23R2.3261774 CC(OCCNS(=O)(=O)C)(c1ccccc1)c2ccccn2 7a_200000075192_100000754112 [0,1,0,0,0,1|2,0,0]=4 419 B23R2.3261774 CC(OCCOS(=O)(=O)C)(c1ccccc1)c2ccccn2 7a_200000075192_200000036756 [0,1,0,0,0,1|2,0,0]=4 420 B23R2.3261774 CC(OCCO[Si](C)(C)C)(c1ccccc1)c2ccccc2 7a_100011202337_200000032530 [0,1,0,0,0,1|2,0,0]=4 421 B23R2.3261774 CC(OCCO[Si](C)(C)C)(c1ccccc1)c2ccccn2 7a_200000075192_200000032530 [0,1,0,0,0,1|1,0,0]=3 422 B23R2.4894389 CC(=CCCOC(C)(c1ccccc1)c2ccc(cc2)Cl)C 34a_100016991996_100011217483 [0,1,0,0,0,1|2,0,0]=4 423 B23R2.4894389 CC(=CCCOC(C)(c1ccccc1)c2ccc(cc2)Cl)C 7a_100016991996_100011217483 [0,1,0,0,0,1|2,0,0]=4 424 B23R2.4894389 CC(C)OCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000211751 [0,1,0,0,0,1|2,0,0]=4 425 B23R2.4894389 CC(C)OCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000211751 [0,1,0,0,0,1|2,0,0]=4 426 B23R2.4894389 CC(C)SCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000730970 [0,1,0,0,0,1|2,0,0]=4 427 B23R2.4894389 CC(C)SCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000730970 [0,1,0,0,0,1|2,0,0]=4 428 B23R2.4894389 CN(C)CCCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000757444 [0,1,0,0,0,1|1,0,0]=3 429 B23R2.8949891 CN(C)C(=O)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000737620 [0,1,0,0,0,1|1,0,0]=3 430 B23R2.8949891 CN(C)C(=O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000737620 [0,1,0,0,0,1|0,0,0]=2 431 B23R2.8844128 CC(C)CCOC(C)(C(=O)c1ccccc1)c2ccccc2 7a_100016999863_100000210626 [0,1,0,0,0,1|2,0,0]=4 432 B23R2.8844128 CN(C)CCOC(C)(C(=O)c1ccccc1)c2ccccc2 7a_100016999863_100000755713 [0,1,0,0,0,1|1,0,0]=3 433 B23R2.473108 CC(C)C(=O)C(C)OC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100009893295 [0,2,0,0,0,0|1,0,1]=4 434 B23R2.473108 CC(OC(C)(c1ccccc1)c2ccccc2)C(=O)N(C)C 7a_100011202337_100000209910 [0,2,0,0,0,0|1,0,1]=4 435 B23R2.473108 CC(OC(C)(c1ccccc1)c2ccccn2)C(=O)N(C)C 7a_200000075192_100000209910 [0,2,0,0,0,0|0,0,1]=3 436 B23R2.763012 COC(=O)CC(C)OC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100009817358 [0,2,0,0,0,0|2,0,0]=4 437 B23R2.772623 CCN(C)C(=O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000738999 [0,2,0,0,0,0|1,0,1]=4 438 B23R2.772623 CCN(C)C(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000738999 [0,2,0,0,0,0|0,0,1]=3 439 B23R2.772623 CON(C)C(=O)COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000764215 [0,2,0,0,0,0|1,0,1]=4 440 B23R2.772623 CON(C)C(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000764215 [0,2,0,0,0,0|0,0,1]=3 441 B23R2.2931681 CC(C)(C)C(=O)COC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000210923 [0,2,0,0,0,0|1,0,1]=4 442 B23R2.11874732 CN(C)C(=O)COC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000692301 [0,2,0,0,0,0|1,0,1]=4 443 B23R2.11874732 CN(C)C(=O)COC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000692301 [0,2,0,0,0,0|1,0,1]=4 444 B23R2.347445 CCS(=O)(=O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000756660 [0,2,0,0,0,0|2,0,0]=4 445 B23R2.549066 CCNC(=O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000737597 [0,2,0,0,0,0|2,0,0]=4 446 B23R2.549066 CCOC(=O)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011206558 [0,2,0,0,0,0|2,0,0]=4 447 B23R2.564835 CCN(CC)CCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000700428 [0,2,0,0,0,0|1,0,0]=3 448 B23R2.564835 CCN(CC)CCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000700428 [0,2,0,0,0,0|0,0,0]=2 449 B23R2.564835 COC(CCOC(C)(c1ccccc1)c2ccccc2)OC 7a_100011202337_100009813347 [0,2,0,0,0,0|2,0,0]=4 450 B23R2.564835 COC(CCOC(C)(c1ccccc1)c2ccccn2)OC 7a_200000075192_100009813347 [0,2,0,0,0,0|1,0,0]=3 451 B23R2.161574 CN(C)CCOC(C)(c1ccc(cc1)Cl)c2ccc(cc2)Cl 7a_100000499747_100000755713 [0,2,0,0,0,0|1,0,0]=3 452 B23R2.4894314 CC(C)(O)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000702414 [0,2,0,0,0,0|2,0,0]=4 453 B23R2.4894314 CC(C)(O)CCOC(C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000702414 [0,2,0,0,0,0|2,0,0]=4 454 B23R2.4894314 CC(OCC[N+](C)(C)C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_100000085578 [0,2,0,0,0,0|1,0,1]=4 455 B23R2.4894314 CC(OCC[N+](C)(C)C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_100000085578 [0,2,0,0,0,0|1,0,1]=4 456 B23R2.4894314 CC(OCC[Si](C)(C)C)(c1ccccc1)c2ccc(cc2)Cl 34a_100016991996_200000733723 [0,2,0,0,0,0|2,0,0]=4 457 B23R2.4894314 CC(OCC[Si](C)(C)C)(c1ccccc1)c2ccc(cc2)Cl 7a_100016991996_200000733723 [0,2,0,0,0,0|2,0,0]=4 458 B21R3.527 CC1CC1COC(c2ccccc2)c3ccccc3 7a_100000744939_100011216954 [1,0,0,1,0,0|2,0,0]=4 459 B21R3.7545 C[C@@H]1CCN(C1)C(c2ccccc2)c3ccccn3 270004a_100016987628_100000210380 [1,0,0,1,0,0|2,0,0]=4 460 B21R3.21229 CN1CC(C1)NC(c2ccccc2)c3ccccc3 270004a_100015196640_100000210122 [1,0,0,1,0,0|2,0,0]=4 461 B21R3.21229 CN1CC(C1)NC(c2ccccc2)c3ccccn3 270004a_100015196640_100000210380 [1,0,0,1,0,0|1,0,0]=3 462 B21R3.21229 CN1CC(C1)NC(c2cccnc2)c3ccccn3 270004a_100015196640_100011376182 [1,0,0,1,0,0|2,0,0]=4 463 B21R3.47875 c1ccc(cc1)C(NCCC2CC2)c3ccccn3 2230a_100000689936_100000694398 [1,0,0,1,0,0|2,0,0]=4 464 B21R3.47875 c1ccc(cc1)C(NCCC2CC2)c3ccccn3 270004a_100000764129_100000210380 [1,0,0,1,0,0|2,0,0]=4 465 B21R3.47875 c1ccc(cc1)C(OCCC2CC2)c3ccccc3 34a_100000211180_100000694398 [1,0,0,1,0,0|2,0,0]=4 466 B21R3.47875 c1ccc(cc1)C(OCCC2CC2)c3ccccc3 7a_100000211180_100000764125 [1,0,0,1,0,0|2,0,0]=4 467 B21R3.47875 c1ccc(cc1)C(OCCC2CC2)c3ccccc3 7a_100000754188_100011216954 [1,0,0,1,0,0|2,0,0]=4 468 B21R3.47875 c1ccc(cc1)C(OCCC2CC2)c3ccccn3 7a_100000180852_100000764125 [1,0,0,1,0,0|1,0,0]=3 469 B21R3.47875 c1ccc(cc1)C(OCCC2CO2)c3ccccn3 7a_100000180852_100000732470 [1,0,0,1,0,0|2,0,0]=4 470 B21R3.9913503 CC(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000210254_100000211598 [1,0,0,1,0,0|2,0,0]=4 471 B21R3.9913503 CC(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000210626 [1,0,0,1,0,0|2,0,0]=4 472 B21R3.9913503 CN(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000755713 [1,0,0,1,0,0|1,0,0]=3 473 B21R3.9913503 CN(C)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000755713 [1,0,0,1,0,0|1,1,0]=4 474 B21R3.521284 CC(OC1COC1)(c2ccccc2)c3ccccc3 7a_100011202337_100009818527 [1,0,0,1,0,0|2,0,0]=4 475 B21R3.521284 CC(OC1COC1)(c2ccccc2)c3ccccn3 7a_200000075192_100009818527 [1,0,0,1,0,0|1,0,0]=3 476 B21R3.521824 CC(OCC1CC1)(c2ccccc2)c3ccccc3 7a_100011202337_100000742324 [1,0,0,1,0,0|2,0,0]=4 477 B21R3.521824 CC(OCC1CC1)(c2ccccc2)c3ccccn3 7a_200000075192_100000742324 [1,0,0,1,0,0|1,0,0]=3 478 B21R3.521824 CC(OCC1CO1)(c2ccccc2)c3ccccc3 7a_100011202337_102125554688 [1,0,0,1,0,0|2,0,0]=4 479 B21R3.521824 CC(OCC1CO1)(c2ccccc2)c3ccccn3 7a_200000075192_102125554688 [1,0,0,1,0,0|1,0,0]=3 480 B21R3.521824 CC(OCC1CS1)(c2ccccc2)c3ccccc3 7a_100011202337_100000031435 [1,0,0,1,0,0|2,0,0]=4 481 B21R3.521824 CC(OCC1CS1)(c2ccccc2)c3ccccn3 7a_200000075192_100000031435 [1,0,0,1,0,0|1,0,0]=3 482 B21R3.521824 CC(OC[C@@H]1CO1)(c2ccccc2)c3ccccc3 7a_100011202337_100000745022 [1,0,0,1,0,0|2,0,0]=4 483 B21R3.521824 CC(OC[C@@H]1CO1)(c2ccccc2)c3ccccn3 7a_200000075192_100000745022 [1,0,0,1,0,0|1,0,0]=3 484 B21R3.1863186 CCCCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000210210 [1,0,0,1,0,0|2,0,0]=4 485 B21R3.1863186 CCCCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000210211 [1,0,0,1,0,0|2,0,0]=4 486 B21R3.1863186 COCCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100011201679 [1,0,0,1,0,0|2,0,0]=4 487 B21R3.1863186 COCCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000233755 [1,0,0,1,0,0|2,0,0]=4 488 B21R3.1863186 CSCCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000212216 [1,0,0,1,0,0|2,0,0]=4 489 B21R3.1863186 CSCCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000212216 [1,0,0,1,0,0|2,0,0]=4 490 B21R3.808 CN1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_200000210301 [0,0,0,1,1,0|1,0,0]=3 491 B21R3.808 CN1CCC(CC1)(c2ccccc2)c3ccccc3 269982a_100020605268_200000210301 [0,0,0,1,1,0|1,0,0]=3 492 B21R3.808 CN1CCC(CC1)(c2ccccc2)c3ccccc3 34a_100020605268_200000210301 [0,0,0,1,1,0|1,0,0]=3 493 B21R3.808 [13CH3]N1CCC(CC1)(c2ccccc2)c3ccccc3 2230a_100020605268_200025704644 [0,0,0,1,1,0|1,0,0]=3 494 B21R3.808 [13CH3]N1CCC(CC1)(c2ccccc2)c3ccccc3 269982a_100020605268_200025704644 [0,0,0,1,1,0|1,0,0]=3 495 B21R3.808 [13CH3]N1CCC(CC1)(c2ccccc2)c3ccccc3 34a_100020605268_200025704644 [0,0,0,1,1,0|1,0,0]=3 496 B21R3.43024366 CC(C)COC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000210624 [0,0,0,1,1,0|2,0,0]=4 497 B21R3.43024366 CC(C)COC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000210760 [0,0,0,1,1,0|2,0,0]=4 498 B23R3.110961 CN1CCC(C1)OC(C)(c2ccccc2)c3ccccc3 7a_100011202337_200012183744 [0,0,0,1,0,1|1,0,0]=3 499 B23R3.110961 CN1CCC(C1)OC(C)(c2ccccc2)c3ccccn3 7a_200000075192_200012183744 [0,0,0,1,0,1|0,0,0]=2 500 B23R3.338259 CC(OCC1CC(=O)C1)(c2ccccc2)c3ccccn3 7a_200000075192_100009874392 [0,0,0,1,0,1|2,0,0]=4 501 B23R3.940820 CC(OCC#CC1CC1)(c2ccccc2)c3ccccn3 7a_200000075192_100009895102 [0,0,0,1,0,1|1,0,1]=4 502 B23R3.940820 CC(OCCCC1CO1)(c2ccccc2)c3ccccn3 7a_200000075192_100000733510 [0,0,0,1,0,1|2,0,0]=4 503 B23R3.149826665 CC(=CCCOC1(c2ccccc2-c3c1cccc3)C)C 34a_100000075291_100011217483 [0,0,0,1,0,1|2,0,0]=4 504 B23R3.149826665 CC(=CCCOC1(c2ccccc2-c3c1cccc3)C)C 7a_100000075291_100011217483 [0,0,0,1,0,1|2,0,0]=4 505 B23R3.149826665 CC(C)CCCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100011214892 [0,0,0,1,0,1|2,0,0]=4 506 B23R3.149826665 CC(C)CCCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100011214892 [0,0,0,1,0,1|2,0,0]=4 507 B23R3.149826665 CC(C)OCCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000211751 [0,0,0,1,0,1|2,0,0]=4 508 B23R3.149826665 CC(C)OCCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000211751 [0,0,0,1,0,1|2,0,0]=4 509 B23R3.149826665 CC(C)SCCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000730970 [0,0,0,1,0,1|2,0,0]=4 510 B23R3.149826665 CC(C)SCCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000730970 [0,0,0,1,0,1|2,0,0]=4 511 B23R3.149826665 CN(C)CCCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000757444 [0,0,0,1,0,1|1,0,0]=3 512 B23R3.9262680 CC(OC1CC(C1)(F)F)(c2ccccc2)c3ccccn3 7a_200000075192_100010741680 [0,1,0,1,0,0|2,0,0]=4 513 B23R3.150502965 CC(C)CC(C)OC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000731052 [0,1,0,1,0,0|2,0,0]=4 514 B23R3.150502965 CC(C)CC(C)OC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000731052 [0,1,0,1,0,0|2,0,0]=4 515 B23R3.3560120 CC(OCC(=O)C1CC1)(c2ccccc2)c3ccccn3 7a_200000075192_100000746382 [0,1,0,1,0,0|1,0,1]=4 516 B23R3.151430380 CN(C)C(=O)COC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000692301 [0,1,0,1,0,0|1,0,1]=4 517 B23R3.151430380 CN(C)C(=O)COC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000692301 [0,1,0,1,0,0|1,0,1]=4 518 B23R3.50938906 C#CC1(c2ccccc2-c3c1cccc3)OCCN(C)C 7a_200000034321_100000755713 [0,1,0,1,0,0|1,0,1]=4 519 B23R3.119946 CC(OCCC1CC1)(c2ccccc2)c3ccc(cc3)Cl 34a_100016991996_100000694398 [0,1,0,1,0,0|2,0,0]=4 520 B23R3.119946 CC(OCCC1CC1)(c2ccccc2)c3ccc(cc3)Cl 7a_100016991996_100000764125 [0,1,0,1,0,0|2,0,0]=4 521 B23R3.10488419 CC(C)CCOC1(c2ccccc2-c3c1cc(cc3)Br)C 34a_206358413604_100000210312 [0,1,0,1,0,0|2,0,0]=4 522 B23R3.10488419 CC(C)CCOC1(c2ccccc2-c3c1cc(cc3)Br)C 7a_206358413604_100000210626 [0,1,0,1,0,0|2,0,0]=4 523 B23R3.10488419 CN(C)CCOC1(c2ccccc2-c3c1cc(cc3)Br)C 7a_206358413604_100000755713 [0,1,0,1,0,0|1,0,0]=3 524 B23R3.82337375 CC(C)(C)CCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000755188 [0,1,0,1,0,0|2,0,0]=4 525 B23R3.82337375 CC(C)(C)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000755188 [0,1,0,1,0,0|2,0,0]=4 526 B23R3.82337375 CC(C)(O)CCOC1(c2ccccc2-c3c1cccc3)C 34a_100000075291_100000702414 [0,1,0,1,0,0|2,0,0]=4 527 B23R3.82337375 CC(C)(O)CCOC1(c2ccccc2-c3c1cccc3)C 7a_100000075291_100000702414 [0,1,0,1,0,0|2,0,0]=4 528 B23R3.82337375 CC1(c2ccccc2-c3c1cccc3)OCC[N+](C)(C)C 34a_100000075291_100000085578 [0,1,0,1,0,0|1,0,1]=4 529 B23R3.82337375 CC1(c2ccccc2-c3c1cccc3)OCC[N+](C)(C)C 7a_100000075291_100000085578 [0,1,0,1,0,0|1,0,1]=4 530 B23R3.82337375 CC1(c2ccccc2-c3c1cccc3)OCC[Si](C)(C)C 34a_100000075291_200000733723 [0,1,0,1,0,0|2,0,0]=4 531 B23R3.82337375 CC1(c2ccccc2-c3c1cccc3)OCC[Si](C)(C)C 7a_100000075291_200000733723 [0,1,0,1,0,0|2,0,0]=4 532 B23R4.1075467928 CC1(c2ccccc2-c3c1cccc3)OCCC4CC4 34a_100000075291_100000694398 [0,0,0,2,0,0|2,0,0]=4 533 B23R4.1075467928 CC1(c2ccccc2-c3c1cccc3)OCCC4CC4 7a_100000075291_100000764125 [0,0,0,2,0,0|2,0,0]=4 534 B19R2.8889 CC(C)CCOC(c1ccccc1)c2ncc[nH]2 7a_100000181881_100000210626 [1,0,0,0,1,0|2,0,0]=4 535 B19R2.8889 CN(C)CCNC(c1ccccc1)c2cccs2 270004a_100000210585_100011214959 [1,0,0,0,1,0|2,0,0]=4 536 B19R2.8889 CN(C)CCOC(c1ccccc1)c2ncc[nH]2 7a_100000181881_100000755713 [1,0,0,0,1,0|1,0,0]=3 537 B19R2.13577 C=C(C)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000748629 [1,0,0,0,1,0|1,0,1]=4 538 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000210760 [1,0,0,0,1,0|2,0,0]=4 539 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccn2 270004a_100000210953_100000210380 [1,0,0,0,1,0|2,0,0]=4 540 B19R2.13577 CC(C)CNC(c1ccccc1)c2ccccn2 270004a_100000689936_100000210432 [1,0,0,0,1,0|2,0,0]=4 541 B19R2.13577 CC(C)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000210624 [1,0,0,0,1,0|2,0,0]=4 542 B19R2.13577 CC(C)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000210760 [1,0,0,0,1,0|2,0,0]=4 543 B19R2.13577 CC(C)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000210760 [1,0,0,0,1,0|1,0,0]=3 544 B19R2.13577 CC(O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100011218427 [1,0,0,0,1,0|2,0,0]=4 545 B19R2.13577 CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100025726140_200000210301 [1,0,0,0,1,0|1,0,0]=3 546 B19R2.13577 CN(C)CCC(c1ccccc1)c2ccccc2 2230a_100102631434_100009813428 [1,0,0,0,1,0|1,0,0]=3 547 B19R2.13577 CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100025726140_200000210301 [1,0,0,0,1,0|1,0,0]=3 548 B19R2.13577 CN(C)CCC(c1ccccc1)c2ccccc2 269982a_100102631434_100009813428 [1,0,0,0,1,0|1,0,0]=3 549 B19R2.13577 CN(C)CCC(c1ccccc1)c2ccccc2 34a_100025726140_200000210301 [1,0,0,0,1,0|1,0,0]=3 550 B19R2.13577 CN(C)CC[S+](c1ccccc1)c2ccccc2 2230a_100102631434_100010140906 [1,0,0,0,1,0|2,0,0]=4 551 B19R2.13577 CN(C)CC[S+](c1ccccc1)c2ccccc2 269982a_100102631434_100010140906 [1,0,0,0,1,0|2,0,0]=4 552 B19R2.13577 CN([13CH3])CCC(c1ccccc1)c2ccccc2 2230a_100025726140_200025704644 [1,0,0,0,1,0|1,0,0]=3 553 B19R2.13577 CN([13CH3])CCC(c1ccccc1)c2ccccc2 269982a_100025726140_200025704644 [1,0,0,0,1,0|1,0,0]=3 554 B19R2.13577 CN([13CH3])CCC(c1ccccc1)c2ccccc2 34a_100025726140_200025704644 [1,0,0,0,1,0|1,0,0]=3 555 B19R2.13577 C[C@@H](O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100009817552 [1,0,0,0,1,0|2,0,0]=4 556 B19R2.13518 CC(C)OC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100000210206 [0,0,0,0,2,0|2,0,0]=4 557 B19R2.13518 CC(C)OC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000210206 [0,0,0,0,2,0|1,0,0]=3 558 B21R2.12898 CC(=CCCNC(c1ccccc1)c2ccccn2)C 2230a_100000689936_100011217483 [1,0,0,0,0,1|2,0,0]=4 559 B21R2.12898 CC(=CCCOC(c1ccccc1)c2ccccc2)C 34a_100000211180_100011217483 [1,0,0,0,0,1|2,0,0]=4 560 B21R2.12898 CC(=CCCOC(c1ccccc1)c2ccccc2)C 7a_100000211180_100011217483 [1,0,0,0,0,1|2,0,0]=4 561 B21R2.12898 CC(=CCCOC(c1ccccc1)c2ccccn2)C 7a_100000180852_100011217483 [1,0,0,0,0,1|1,0,0]=3 562 B21R2.12898 CC(=O)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011215641 [1,0,0,0,0,1|2,0,0]=4 563 B21R2.12898 CC(=O)NCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000189650 [1,0,0,0,0,1|2,0,0]=4 564 B21R2.12898 CC(=O)OCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100009814007 [1,0,0,0,0,1|2,0,0]=4 565 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100011214892 [1,0,0,0,0,1|2,0,0]=4 566 B21R2.12898 CC(C)CCCNC(c1ccccc1)c2ccccn2 270004a_200000737386_100000210380 [1,0,0,0,0,1|2,0,0]=4 567 B21R2.12898 CC(C)CCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100011214892 [1,0,0,0,0,1|2,0,0]=4 568 B21R2.12898 CC(C)CCCOC(c1ccccc1)c2ccccc2 7a_100000210774_100011216954 [1,0,0,0,0,1|2,0,0]=4 569 B21R2.12898 CC(C)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100011214892 [1,0,0,0,0,1|2,0,0]=4 570 B21R2.12898 CC(C)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100011214892 [1,0,0,0,0,1|1,0,0]=3 571 B21R2.12898 CC(C)CCOCC(c1ccccc1)c2ccccc2 34a_100011215272_100000210312 [1,0,0,0,0,1|2,0,0]=4 572 B21R2.12898 CC(C)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000210626 [1,0,0,0,0,1|2,0,0]=4 573 B21R2.12898 CC(C)NCCOC(c1ccccc1)c2ccccc2 2230a_100138425928_100000734929 [1,0,0,0,0,1|2,0,0]=4 574 B21R2.12898 CC(C)NCCOC(c1ccccc1)c2ccccc2 34a_100138425928_100000734929 [1,0,0,0,0,1|2,0,0]=4 575 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000211751 [1,0,0,0,0,1|2,0,0]=4 576 B21R2.12898 CC(C)OCCNC(c1ccccc1)c2ccccn2 270004a_100000701111_100000210380 [1,0,0,0,0,1|2,0,0]=4 577 B21R2.12898 CC(C)OCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000211751 [1,0,0,0,0,1|2,0,0]=4 578 B21R2.12898 CC(C)OCCOC(c1ccccc1)c2ccccc2 34a_100000212225_100000734929 [1,0,0,0,0,1|2,0,0]=4 579 B21R2.12898 CC(C)OCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000211751 [1,0,0,0,0,1|2,0,0]=4 580 B21R2.12898 CC(C)OCCOC(c1ccccc1)c2ccccc2 7a_100000211219_100011216954 [1,0,0,0,0,1|2,0,0]=4 581 B21R2.12898 CC(C)OCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000211751 [1,0,0,0,0,1|1,0,0]=3 582 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000730970 [1,0,0,0,0,1|2,0,0]=4 583 B21R2.12898 CC(C)SCCNC(c1ccccc1)c2ccccn2 270004a_100000731138_100000210380 [1,0,0,0,0,1|2,0,0]=4 584 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000730970 [1,0,0,0,0,1|2,0,0]=4 585 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccc2 62a_100000210206_100000734929 [1,0,0,0,0,1|2,0,0]=4 586 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccc2 62a_100000734929_100000210206 [1,0,0,0,0,1|2,0,0]=4 587 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000730970 [1,0,0,0,0,1|2,0,0]=4 588 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccc2 7a_200011212901_100011216954 [1,0,0,0,0,1|2,0,0]=4 589 B21R2.12898 CC(C)SCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000730970 [1,0,0,0,0,1|1,0,0]=3 590 B21R2.12898 CC(O)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_200000718107 [1,0,0,0,0,1|2,0,0]=4 591 B21R2.12898 CN(C)CCCNC(c1ccccc1)c2ccccc2 270004a_102531767803_100000210122 [1,0,0,0,0,1|2,0,0]=4 592 B21R2.12898 CN(C)CCCNC(c1ccccc1)c2ccccn2 270004a_102531767803_100000210380 [1,0,0,0,0,1|1,0,0]=3 593 B21R2.12898 CN(C)CCCNC(c1cccnc1)c2ccccn2 270004a_102531767803_100011376182 [1,0,0,0,0,1|2,0,0]=4 594 B21R2.12898 CN(C)CCCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000757444 [1,0,0,0,0,1|1,0,0]=3 595 B21R2.12898 CN(C)CCCOC(c1ccccc1)c2ccccn2 7a_100000180852_100000757444 [1,0,0,0,0,1|0,0,0]=2 596 B21R2.12898 CN(C)CCCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000757444 [1,0,0,0,0,1|1,1,0]=4 597 B21R2.12898 CN(C)CCOCC(c1ccccc1)c2ccccc2 7a_100011215272_100000755713 [1,0,0,0,0,1|1,0,0]=3 598 B21R2.12899 CC(C)CCOC(Cc1ccccc1)c2ccccc2 34a_100000246494_100000210312 [1,0,0,0,0,1|2,0,0]=4 599 B21R2.12899 CC(C)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000210626 [1,0,0,0,0,1|2,0,0]=4 600 B21R2.12899 CN(C)CCOC(Cc1ccccc1)c2ccccc2 7a_100000246494_100000755713 [1,0,0,0,0,1|1,0,0]=3 601 B23R2.472245 CC(=O)CCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000735457 [0,0,0,0,0,2|2,0,0]=4 602 B23R2.472245 CC(=O)OCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000042594 [0,0,0,0,0,2|2,0,0]=4 603 B23R2.472245 CC(=O)SCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100000038929 [0,0,0,0,0,2|2,0,0]=4 604 B23R2.472245 CC(=S)OCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_200135323944 [0,0,0,0,0,2|2,0,0]=4 605 B23R2.472245 CC(C)CCCCOC(C)(c1ccccc1)c2ccccc2 7a_100011202337_100011216152 [0,0,0,0,0,2|2,0,0]=4 606 B23R2.472245 CC(C)CCCCOC(C)(c1ccccc1)c2ccccn2 7a_200000075192_100011216152 [0,0,0,0,0,2|1,0,0]=3 607 B23R2.8948582 CC(C)CCOC(C)(COc1ccccc1)c2ccccc2 7a_200003291822_100000210626 [0,0,0,0,0,2|2,0,0]=4 608 B23R2.8948582 CN(C)CCOC(C)(COc1ccccc1)c2ccccc2 7a_200003291822_100000755713 [0,0,0,0,0,2|1,0,0]=3