0 B19R1.59546 C#CCN(CC#C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000765449_100000185021 [0,0,0,0,0,0|0,0,4]=4 1 B19R1.59546 C#CCN(CC=C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000731024_100000185021 [0,0,0,0,0,0|0,0,4]=4 2 B19R1.59546 C=CCN(CC=C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000210471_100000185021 [0,0,0,0,0,0|0,0,4]=4 3 B19R1.59546 C=CCN(CC=C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000210471_100000185021 [0,0,0,0,0,0|0,0,4]=4 4 B19R1.59546 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000010689 [0,0,0,0,0,0|3,0,0]=3 5 B19R1.59546 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000010689 [0,0,0,0,0,0|3,0,0]=3 6 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)C 1458a_100000488459_200000210301 [0,0,0,0,0,0|1,0,0]=1 7 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000210455_100000010689 [0,0,0,0,0,0|1,0,0]=1 8 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000210455_100000010689 [0,0,0,0,0,0|1,0,0]=1 9 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000210455_100000231035 [0,0,0,0,0,0|1,0,0]=1 10 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000210455_100000231035 [0,0,0,0,0,0|1,0,0]=1 11 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000210455_100000185021 [0,0,0,0,0,0|0,0,0]=0 12 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000210455_100000185021 [0,0,0,0,0,0|0,0,0]=0 13 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000488459_200025704644 [0,0,0,0,0,0|1,0,0]=1 14 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(C)C 270084a_100000210455_100000183442 [0,0,0,0,0,0|2,0,1]=3 15 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(C)C 274078a_100000210455_100000183442 [0,0,0,0,0,0|2,0,1]=3 16 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000210455_100000209996 [0,0,0,0,0,0|1,0,1]=2 17 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000210455_100000209996 [0,0,0,0,0,0|1,0,1]=2 18 B19R1.59546 CCCN(CCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000210455_100000032944 [0,0,0,0,0,0|1,0,1]=2 19 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000211420_100000010689 [0,0,0,0,0,0|2,0,0]=2 20 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000211420_100000010689 [0,0,0,0,0,0|2,0,0]=2 21 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000211420_100000231035 [0,0,0,0,0,0|2,0,0]=2 22 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000211420_100000231035 [0,0,0,0,0,0|2,0,0]=2 23 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000211420_100000185021 [0,0,0,0,0,0|1,0,0]=1 24 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000211420_100000185021 [0,0,0,0,0,0|1,0,0]=1 25 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(C)C 270084a_100000211420_100000183442 [0,0,0,0,0,0|3,0,1]=4 26 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(C)C 274078a_100000211420_100000183442 [0,0,0,0,0,0|3,0,1]=4 27 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000211420_100000209996 [0,0,0,0,0,0|2,0,1]=3 28 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000211420_100000209996 [0,0,0,0,0,0|2,0,1]=3 29 B19R1.59546 CCCN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000211420_100000032944 [0,0,0,0,0,0|2,0,1]=3 30 B19R1.59546 N#CCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000211797_100000185021 [0,0,0,0,0,0|2,0,2]=4 31 B19R1.59546 NC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000231035 [0,0,0,0,0,0|3,0,0]=3 32 B19R1.59546 NC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000231035 [0,0,0,0,0,0|3,0,0]=3 33 B19R1.59546 O=C(O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000185021 [0,0,0,0,0,0|2,0,0]=2 34 B19R1.59546 O=C(O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000185021 [0,0,0,0,0,0|2,0,0]=2 35 B19R1.59546 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000209996 [0,0,0,0,0,0|3,0,1]=4 36 B19R1.59546 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000209996 [0,0,0,0,0,0|3,0,1]=4 37 B19R1.59546 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCO)CCO 40a_100000210587_100000032944 [0,0,0,0,0,0|3,0,1]=4 38 B18R1.25194 C#CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000744766_100000010689 [1,0,0,0,0,0|1,0,2]=4 39 B18R1.25194 C#CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000744766_100000231035 [1,0,0,0,0,0|1,0,2]=4 40 B18R1.25194 C#CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000744766_100000185021 [1,0,0,0,0,0|0,0,2]=3 41 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000226822_100000010689 [1,0,0,0,0,0|1,0,0]=2 42 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000226822_100000010689 [1,0,0,0,0,0|1,0,0]=2 43 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000226822_100000231035 [1,0,0,0,0,0|1,0,0]=2 44 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000226822_100000231035 [1,0,0,0,0,0|1,0,0]=2 45 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000226822_100000185021 [1,0,0,0,0,0|0,0,0]=1 46 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000226822_100000185021 [1,0,0,0,0,0|0,0,0]=1 47 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(C)C 270084a_100000226822_100000183442 [1,0,0,0,0,0|2,0,1]=4 48 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(C)C 274078a_100000226822_100000183442 [1,0,0,0,0,0|2,0,1]=4 49 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000226822_100000209996 [1,0,0,0,0,0|1,0,1]=3 50 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000226822_100000209996 [1,0,0,0,0,0|1,0,1]=3 51 B18R1.25194 CCCN(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000226822_100000032944 [1,0,0,0,0,0|1,0,1]=3 52 B18R1.25194 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000210973_100000010689 [1,0,0,0,0,0|2,0,0]=3 53 B18R1.25194 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000210973_100000010689 [1,0,0,0,0,0|2,0,0]=3 54 B18R1.25194 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000210973_100000231035 [1,0,0,0,0,0|2,0,0]=3 55 B18R1.25194 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000210973_100000231035 [1,0,0,0,0,0|2,0,0]=3 56 B18R1.25194 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000210973_100000185021 [1,0,0,0,0,0|1,0,0]=2 57 B18R1.25194 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000210973_100000185021 [1,0,0,0,0,0|1,0,0]=2 58 B18R1.25194 CCN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000210973_100000209996 [1,0,0,0,0,0|2,0,1]=4 59 B18R1.25194 CCN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000210973_100000209996 [1,0,0,0,0,0|2,0,1]=4 60 B18R1.25194 CCN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000210973_100000032944 [1,0,0,0,0,0|2,0,1]=4 61 B18R1.44184 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)CCC 270084a_100000210455_100000034458 [1,0,0,0,0,0|1,0,0]=2 62 B18R1.44184 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)CCC 274078a_100000210455_100000034458 [1,0,0,0,0,0|1,0,0]=2 63 B18R1.44184 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)CCO 270084a_100000211420_100000034458 [1,0,0,0,0,0|2,0,0]=3 64 B18R1.44184 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)CCO 274078a_100000211420_100000034458 [1,0,0,0,0,0|2,0,0]=3 65 B18R1.44184 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000034458 [1,0,0,0,0,0|3,0,0]=4 66 B18R1.44184 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000034458 [1,0,0,0,0,0|3,0,0]=4 67 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C#N 270084a_100000210455_100000184514 [1,0,0,0,0,0|1,0,1]=3 68 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C#N 274078a_100000210455_100000184514 [1,0,0,0,0,0|1,0,1]=3 69 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C#N 40a_100000210455_100010740313 [1,0,0,0,0,0|1,0,1]=3 70 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C=O 270084a_100000210455_100000045293 [1,0,0,0,0,0|0,0,0]=1 71 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C=O 274078a_100000210455_100000045293 [1,0,0,0,0,0|0,0,0]=1 72 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CBr 270084a_100000210455_100000763552 [1,0,0,0,0,0|1,0,1]=3 73 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CBr 274078a_100000210455_100000763552 [1,0,0,0,0,0|1,0,1]=3 74 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CBr 40a_100000210455_100011072442 [1,0,0,0,0,0|1,0,1]=3 75 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CC 270084a_100000210455_100000212210 [1,0,0,0,0,0|1,0,1]=3 76 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CC 274078a_100000210455_100000212210 [1,0,0,0,0,0|1,0,1]=3 77 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OC 270084a_100000210455_100000182833 [1,0,0,0,0,0|2,0,0]=3 78 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OC 274078a_100000210455_100000182833 [1,0,0,0,0,0|2,0,0]=3 79 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)SC 270084a_100000210455_100000747762 [1,0,0,0,0,0|2,0,0]=3 80 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(cc1)SC 274078a_100000210455_100000747762 [1,0,0,0,0,0|2,0,0]=3 81 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(nc1)OC 270084a_100000210455_100000756427 [1,0,0,0,0,0|3,0,0]=4 82 B18R1.44184 CCCN(CCC)S(=O)(=O)c1ccc(nc1)OC 274078a_100000210455_100000756427 [1,0,0,0,0,0|3,0,0]=4 83 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C#N 270084a_100000211420_100000184514 [1,0,0,0,0,0|2,0,1]=4 84 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C#N 274078a_100000211420_100000184514 [1,0,0,0,0,0|2,0,1]=4 85 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C#N 40a_100000211420_100010740313 [1,0,0,0,0,0|2,0,1]=4 86 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C=O 270084a_100000211420_100000045293 [1,0,0,0,0,0|1,0,0]=2 87 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C=O 274078a_100000211420_100000045293 [1,0,0,0,0,0|1,0,0]=2 88 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)CBr 270084a_100000211420_100000763552 [1,0,0,0,0,0|2,0,1]=4 89 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)CBr 274078a_100000211420_100000763552 [1,0,0,0,0,0|2,0,1]=4 90 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)CBr 40a_100000211420_100011072442 [1,0,0,0,0,0|2,0,1]=4 91 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)CC 270084a_100000211420_100000212210 [1,0,0,0,0,0|2,0,1]=4 92 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)CC 274078a_100000211420_100000212210 [1,0,0,0,0,0|2,0,1]=4 93 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)OC 270084a_100000211420_100000182833 [1,0,0,0,0,0|3,0,0]=4 94 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)OC 274078a_100000211420_100000182833 [1,0,0,0,0,0|3,0,0]=4 95 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)SC 270084a_100000211420_100000747762 [1,0,0,0,0,0|3,0,0]=4 96 B18R1.44184 CCCN(CCO)S(=O)(=O)c1ccc(cc1)SC 274078a_100000211420_100000747762 [1,0,0,0,0,0|3,0,0]=4 97 B18R1.44184 O=Cc1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000045293 [1,0,0,0,0,0|2,0,0]=3 98 B18R1.44184 O=Cc1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000045293 [1,0,0,0,0,0|2,0,0]=3 99 B18R1.44633 C=C(C)c1ccc(cc1)C(=O)N(CCC)CCC 11a_100000210455_200009908186 [1,0,0,0,0,0|3,0,0]=4 100 B18R1.44633 C=C(C)c1ccc(cc1)C(=O)N(CCC)CCC 1626a_100000210455_200009908186 [1,0,0,0,0,0|3,0,0]=4 101 B18R1.44633 C=C(C)c1ccc(cc1)C(=O)N(CCC)CCC 240690a_100000210455_200009908186 [1,0,0,0,0,0|3,0,0]=4 102 B18R1.44633 C=C(C)c1ccc(cc1)C(=O)N(CCC)CCC 527a_100000210455_200009908186 [1,0,0,0,0,0|3,0,0]=4 103 B18R1.44633 CCCC(CCC)C(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_200011218217 [1,0,0,0,0,0|3,0,0]=4 104 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)N 11a_100000210455_100000230133 [1,0,0,0,0,0|2,0,0]=3 105 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)N 1626a_100000210455_100000230133 [1,0,0,0,0,0|2,0,0]=3 106 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)N 240690a_100000210455_100000230133 [1,0,0,0,0,0|2,0,0]=3 107 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)C(C)O 240690a_100000210455_100000076921 [1,0,0,0,0,0|2,0,1]=4 108 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)S(=O)C 1626a_100000210455_200000217594 [1,0,0,0,0,0|3,0,0]=4 109 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)S(=O)C 240690a_100000210455_200000217594 [1,0,0,0,0,0|3,0,0]=4 110 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)S(=O)C 527a_100000210455_200000217594 [1,0,0,0,0,0|3,0,0]=4 111 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)[N+](=O)[O-] 11a_100000210455_100000185811 [1,0,0,0,0,0|2,0,1]=4 112 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)[N+](=O)[O-] 1626a_100000210455_100000185811 [1,0,0,0,0,0|2,0,1]=4 113 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)[N+](=O)[O-] 240690a_100000210455_100000185811 [1,0,0,0,0,0|2,0,1]=4 114 B18R1.44633 CCCN(CCC)C(=O)c1ccc(cc1)[N+](=O)[O-] 527a_100000210455_100000185811 [1,0,0,0,0,0|2,0,1]=4 115 B18R1.44633 CCCN(CCO)C(=O)c1ccc(cc1)C(=O)N 240690a_100000211420_100000230133 [1,0,0,0,0,0|3,0,0]=4 116 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)CC 1458a_100000488459_100000210202 [0,1,0,0,0,0|1,0,0]=2 117 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)CF 1458a_100000488459_100015361967 [0,1,0,0,0,0|1,0,0]=2 118 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NC 11a_106832991635_100000488459 [0,1,0,0,0,0|1,0,0]=2 119 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NC 1626a_100102657272_100000488459 [0,1,0,0,0,0|1,0,0]=2 120 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NC 240690a_100102657272_100000488459 [0,1,0,0,0,0|1,0,0]=2 121 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NC 270084a_100000210455_100000222204 [0,1,0,0,0,0|1,0,0]=2 122 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_100000210455_100000222204 [0,1,0,0,0,0|1,0,0]=2 123 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NC 527a_100102657272_100000488459 [0,1,0,0,0,0|1,0,0]=2 124 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_100000210455_100000217497 [0,1,0,0,0,0|0,0,0]=1 125 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100000210455_100000217497 [0,1,0,0,0,0|0,0,0]=1 126 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100000210455_100015196439 [0,1,0,0,0,0|0,0,0]=1 127 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(C)CC 270084a_100000210455_100000184581 [0,1,0,0,0,0|2,0,1]=4 128 B20R1.75554 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(C)CC 274078a_100000210455_100000184581 [0,1,0,0,0,0|2,0,1]=4 129 B20R1.75554 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)NC 270084a_100000211420_100000222204 [0,1,0,0,0,0|2,0,0]=3 130 B20R1.75554 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_100000211420_100000222204 [0,1,0,0,0,0|2,0,0]=3 131 B20R1.75554 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_100000211420_100000217497 [0,1,0,0,0,0|1,0,0]=2 132 B20R1.75554 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100000211420_100000217497 [0,1,0,0,0,0|1,0,0]=2 133 B20R1.75554 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100000211420_100015196439 [0,1,0,0,0,0|1,0,0]=2 134 B20R1.75554 CNC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000222204 [0,1,0,0,0,0|3,0,0]=4 135 B20R1.75554 CNC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000222204 [0,1,0,0,0,0|3,0,0]=4 136 B20R1.75554 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000217497 [0,1,0,0,0,0|2,0,0]=3 137 B20R1.75554 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000217497 [0,1,0,0,0,0|2,0,0]=3 138 B20R1.75554 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 40a_100000210587_100015196439 [0,1,0,0,0,0|2,0,0]=3 139 B20R1.75555 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(C)(C)C 270084a_100000210455_100000183310 [0,1,0,0,0,0|2,0,1]=4 140 B20R1.75555 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(C)(C)C 274078a_100000210455_100000183310 [0,1,0,0,0,0|2,0,1]=4 141 B20R1.75555 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(C)(C)C 40a_100000210455_200010235544 [0,1,0,0,0,0|2,0,1]=4 142 B20R1.75555 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(F)(F)F 270084a_100000210455_100000211852 [0,1,0,0,0,0|2,0,1]=4 143 B20R1.75555 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(F)(F)F 274078a_100000210455_100000211852 [0,1,0,0,0,0|2,0,1]=4 144 B20R1.75555 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(F)(F)F 40a_100000210455_100015196465 [0,1,0,0,0,0|2,0,1]=4 145 B20R1.75555 CCCN(CCC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 270084a_100000210455_100000735899 [0,1,0,0,0,0|1,0,1]=3 146 B20R1.75555 CCCN(CCC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 274078a_100000210455_100000735899 [0,1,0,0,0,0|1,0,1]=3 147 B20R1.75555 CCCN(CCC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 270084a_100000210455_200000215108 [0,1,0,0,0,0|1,0,1]=3 148 B20R1.75555 CCCN(CCC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 274078a_100000210455_200000215108 [0,1,0,0,0,0|1,0,1]=3 149 B20R1.75555 CCCN(CCO)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 270084a_100000211420_100000735899 [0,1,0,0,0,0|2,0,1]=4 150 B20R1.75555 CCCN(CCO)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 274078a_100000211420_100000735899 [0,1,0,0,0,0|2,0,1]=4 151 B20R1.75555 CCCN(CCO)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 270084a_100000211420_200000215108 [0,1,0,0,0,0|2,0,1]=4 152 B20R1.75555 CCCN(CCO)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 274078a_100000211420_200000215108 [0,1,0,0,0,0|2,0,1]=4 153 B20R1.75588 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 270084a_100000210455_100000741939 [0,1,0,0,0,0|1,0,1]=3 154 B20R1.75588 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 274078a_100000210455_100000741939 [0,1,0,0,0,0|1,0,1]=3 155 B20R1.75588 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 270084a_100000210455_100000756168 [0,1,0,0,0,0|1,0,1]=3 156 B20R1.75588 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 274078a_100000210455_100000756168 [0,1,0,0,0,0|1,0,1]=3 157 B20R1.75588 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 270084a_100000210455_100011361805 [0,1,0,0,0,0|1,0,1]=3 158 B20R1.75588 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 274078a_100000210455_100011361805 [0,1,0,0,0,0|1,0,1]=3 159 B20R1.75588 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)F)[N+](=O)[O-] 274078a_100000210455_100000745415 [0,1,0,0,0,0|1,0,1]=3 160 B20R1.75588 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 270084a_100000211420_100000741939 [0,1,0,0,0,0|2,0,1]=4 161 B20R1.75588 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 274078a_100000211420_100000741939 [0,1,0,0,0,0|2,0,1]=4 162 B20R1.75588 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 270084a_100000211420_100000756168 [0,1,0,0,0,0|2,0,1]=4 163 B20R1.75588 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 274078a_100000211420_100000756168 [0,1,0,0,0,0|2,0,1]=4 164 B20R1.75588 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 270084a_100000211420_100011361805 [0,1,0,0,0,0|2,0,1]=4 165 B20R1.75588 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 274078a_100000211420_100011361805 [0,1,0,0,0,0|2,0,1]=4 166 B20R1.75588 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)F)[N+](=O)[O-] 274078a_100000211420_100000745415 [0,1,0,0,0,0|2,0,1]=4 167 B20R1.97565 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 270084a_100015185251_100000010689 [0,1,0,0,0,0|2,0,0]=3 168 B20R1.97565 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 274078a_100015185251_100000010689 [0,1,0,0,0,0|2,0,0]=3 169 B20R1.97565 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)O 270084a_100000731851_100000010689 [0,1,0,0,0,0|2,0,0]=3 170 B20R1.97565 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)O 274078a_100000731851_100000010689 [0,1,0,0,0,0|2,0,0]=3 171 B20R1.97565 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100015185251_100000231035 [0,1,0,0,0,0|2,0,0]=3 172 B20R1.97565 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100015185251_100000231035 [0,1,0,0,0,0|2,0,0]=3 173 B20R1.97565 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100015185251_100000185021 [0,1,0,0,0,0|1,0,0]=2 174 B20R1.97565 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100015185251_100000185021 [0,1,0,0,0,0|1,0,0]=2 175 B20R1.97565 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100015185251_100000209996 [0,1,0,0,0,0|2,0,1]=4 176 B20R1.97565 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100015185251_100000209996 [0,1,0,0,0,0|2,0,1]=4 177 B20R1.97565 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100015185251_100000032944 [0,1,0,0,0,0|2,0,1]=4 178 B20R1.97565 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000731851_100000231035 [0,1,0,0,0,0|2,0,0]=3 179 B20R1.97565 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000731851_100000231035 [0,1,0,0,0,0|2,0,0]=3 180 B20R1.97565 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000731851_100000185021 [0,1,0,0,0,0|1,0,0]=2 181 B20R1.97565 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000731851_100000185021 [0,1,0,0,0,0|1,0,0]=2 182 B20R1.97565 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000731851_100000209996 [0,1,0,0,0,0|2,0,1]=4 183 B20R1.97565 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000731851_100000209996 [0,1,0,0,0,0|2,0,1]=4 184 B20R1.112965 C#CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000223814_100000010689 [0,1,0,0,0,0|1,0,2]=4 185 B20R1.112965 C#CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000223814_100000231035 [0,1,0,0,0,0|1,0,2]=4 186 B20R1.112965 C#CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000223814_100000185021 [0,1,0,0,0,0|0,0,2]=3 187 B20R1.112965 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000010689 [0,1,0,0,0,0|2,0,0]=3 188 B20R1.112965 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000010689 [0,1,0,0,0,0|2,0,0]=3 189 B20R1.112965 CCCCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_200011192266_100000010689 [0,1,0,0,0,0|2,0,1]=4 190 B20R1.112965 CCCCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_200011192266_100000231035 [0,1,0,0,0,0|2,0,1]=4 191 B20R1.112965 CCCCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_200011192266_100000185021 [0,1,0,0,0,0|1,0,1]=3 192 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_200000207744_100000010689 [0,1,0,0,0,0|1,0,0]=2 193 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_200000207744_100000010689 [0,1,0,0,0,0|1,0,0]=2 194 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_200000207744_100000231035 [0,1,0,0,0,0|1,0,0]=2 195 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_200000207744_100000231035 [0,1,0,0,0,0|1,0,0]=2 196 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_200000207744_100000185021 [0,1,0,0,0,0|0,0,0]=1 197 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_200000207744_100000185021 [0,1,0,0,0,0|0,0,0]=1 198 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(C)C 270084a_200000207744_100000183442 [0,1,0,0,0,0|2,0,1]=4 199 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(C)C 274078a_200000207744_100000183442 [0,1,0,0,0,0|2,0,1]=4 200 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_200000207744_100000209996 [0,1,0,0,0,0|1,0,1]=3 201 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_200000207744_100000209996 [0,1,0,0,0,0|1,0,1]=3 202 B20R1.112965 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_200000207744_100000032944 [0,1,0,0,0,0|1,0,1]=3 203 B20R1.112965 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000198060_100000010689 [0,1,0,0,0,0|2,0,0]=3 204 B20R1.112965 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000198060_100000010689 [0,1,0,0,0,0|2,0,0]=3 205 B20R1.112965 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000198060_100000231035 [0,1,0,0,0,0|2,0,0]=3 206 B20R1.112965 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000198060_100000231035 [0,1,0,0,0,0|2,0,0]=3 207 B20R1.112965 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000198060_100000185021 [0,1,0,0,0,0|1,0,0]=2 208 B20R1.112965 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000198060_100000185021 [0,1,0,0,0,0|1,0,0]=2 209 B20R1.112965 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000198060_100000209996 [0,1,0,0,0,0|2,0,1]=4 210 B20R1.112965 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000198060_100000209996 [0,1,0,0,0,0|2,0,1]=4 211 B20R1.112965 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000198060_100000032944 [0,1,0,0,0,0|2,0,1]=4 212 B20R1.112965 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000176855_100000010689 [0,1,0,0,0,0|1,0,1]=3 213 B20R1.112965 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000176855_100000231035 [0,1,0,0,0,0|1,0,1]=3 214 B20R1.112965 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000176855_100000185021 [0,1,0,0,0,0|0,0,1]=2 215 B20R1.112965 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000176855_100000209996 [0,1,0,0,0,0|1,0,2]=4 216 B20R1.112965 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000176855_100000032944 [0,1,0,0,0,0|1,0,2]=4 217 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_200011192371_100000010689 [0,1,0,0,0,0|1,0,0]=2 218 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_200011192371_100000010689 [0,1,0,0,0,0|1,0,0]=2 219 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_200011192371_100000231035 [0,1,0,0,0,0|1,0,0]=2 220 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_200011192371_100000231035 [0,1,0,0,0,0|1,0,0]=2 221 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_200011192371_100000185021 [0,1,0,0,0,0|0,0,0]=1 222 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_200011192371_100000185021 [0,1,0,0,0,0|0,0,0]=1 223 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(C)C 270084a_200011192371_100000183442 [0,1,0,0,0,0|2,0,1]=4 224 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(C)C 274078a_200011192371_100000183442 [0,1,0,0,0,0|2,0,1]=4 225 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_200011192371_100000209996 [0,1,0,0,0,0|1,0,1]=3 226 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_200011192371_100000209996 [0,1,0,0,0,0|1,0,1]=3 227 B20R1.112965 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_200011192371_100000032944 [0,1,0,0,0,0|1,0,1]=3 228 B20R1.112965 COCCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100011199603_100000010689 [0,1,0,0,0,0|2,0,1]=4 229 B20R1.112965 COCCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100011199603_100000231035 [0,1,0,0,0,0|2,0,1]=4 230 B20R1.112965 COCCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100011199603_100000185021 [0,1,0,0,0,0|1,0,1]=3 231 B20R1.112965 NC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000231035 [0,1,0,0,0,0|2,0,0]=3 232 B20R1.112965 NC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000231035 [0,1,0,0,0,0|2,0,0]=3 233 B20R1.112965 O=C(O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000185021 [0,1,0,0,0,0|1,0,0]=2 234 B20R1.112965 O=C(O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000185021 [0,1,0,0,0,0|1,0,0]=2 235 B20R1.112965 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000209996 [0,1,0,0,0,0|2,0,1]=4 236 B20R1.112965 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000209996 [0,1,0,0,0,0|2,0,1]=4 237 B20R1.112965 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 40a_200000212863_100000032944 [0,1,0,0,0,0|2,0,1]=4 238 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_200011216551_100000010689 [0,1,0,0,0,0|1,0,0]=2 239 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_200011216551_100000010689 [0,1,0,0,0,0|1,0,0]=2 240 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_200011216551_100000231035 [0,1,0,0,0,0|1,0,0]=2 241 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_200011216551_100000231035 [0,1,0,0,0,0|1,0,0]=2 242 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_200011216551_100000185021 [0,1,0,0,0,0|0,0,0]=1 243 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_200011216551_100000185021 [0,1,0,0,0,0|0,0,0]=1 244 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(C)C 270084a_200011216551_100000183442 [0,1,0,0,0,0|2,0,1]=4 245 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(C)C 274078a_200011216551_100000183442 [0,1,0,0,0,0|2,0,1]=4 246 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_200011216551_100000209996 [0,1,0,0,0,0|1,0,1]=3 247 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_200011216551_100000209996 [0,1,0,0,0,0|1,0,1]=3 248 B20R1.470248 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_200011216551_100000032944 [0,1,0,0,0,0|1,0,1]=3 249 B20R1.470248 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100011303929_100000010689 [0,1,0,0,0,0|2,0,0]=3 250 B20R1.470248 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100011303929_100000010689 [0,1,0,0,0,0|2,0,0]=3 251 B20R1.470248 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100011303929_100000231035 [0,1,0,0,0,0|2,0,0]=3 252 B20R1.470248 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100011303929_100000231035 [0,1,0,0,0,0|2,0,0]=3 253 B20R1.470248 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100011303929_100000185021 [0,1,0,0,0,0|1,0,0]=2 254 B20R1.470248 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100011303929_100000185021 [0,1,0,0,0,0|1,0,0]=2 255 B20R1.470248 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100011303929_100000209996 [0,1,0,0,0,0|2,0,1]=4 256 B20R1.470248 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100011303929_100000209996 [0,1,0,0,0,0|2,0,1]=4 257 B20R1.470248 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100011303929_100000032944 [0,1,0,0,0,0|2,0,1]=4 258 B20R1.839710 CCCN(CCC)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 270084a_100000210455_100000739667 [0,1,0,0,0,0|1,0,1]=3 259 B20R1.839710 CCCN(CCC)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 274078a_100000210455_100000739667 [0,1,0,0,0,0|1,0,1]=3 260 B20R1.839710 CCCN(CCC)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 270084a_100000210455_100000738598 [0,1,0,0,0,0|1,0,1]=3 261 B20R1.839710 CCCN(CCC)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 274078a_100000210455_100000738598 [0,1,0,0,0,0|1,0,1]=3 262 B20R1.839710 CCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_100000210455_100000763611 [0,1,0,0,0,0|0,0,0]=1 263 B20R1.839710 CCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100000210455_100000763611 [0,1,0,0,0,0|0,0,0]=1 264 B20R1.839710 CCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 270084a_100000210455_100000182962 [0,1,0,0,0,0|1,0,1]=3 265 B20R1.839710 CCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 274078a_100000210455_100000182962 [0,1,0,0,0,0|1,0,1]=3 266 B20R1.839710 CCCN(CCC)S(=O)(=O)c1ccc(cc1F)[N+](=O)[O-] 274078a_100000210455_100000741260 [0,1,0,0,0,0|1,0,1]=3 267 B20R1.839710 CCCN(CCO)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 270084a_100000211420_100000739667 [0,1,0,0,0,0|2,0,1]=4 268 B20R1.839710 CCCN(CCO)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 274078a_100000211420_100000739667 [0,1,0,0,0,0|2,0,1]=4 269 B20R1.839710 CCCN(CCO)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 270084a_100000211420_100000738598 [0,1,0,0,0,0|2,0,1]=4 270 B20R1.839710 CCCN(CCO)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 274078a_100000211420_100000738598 [0,1,0,0,0,0|2,0,1]=4 271 B20R1.839710 CCCN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_100000211420_100000763611 [0,1,0,0,0,0|1,0,0]=2 272 B20R1.839710 CCCN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100000211420_100000763611 [0,1,0,0,0,0|1,0,0]=2 273 B20R1.839710 CCCN(CCO)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 270084a_100000211420_100000182962 [0,1,0,0,0,0|2,0,1]=4 274 B20R1.839710 CCCN(CCO)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 274078a_100000211420_100000182962 [0,1,0,0,0,0|2,0,1]=4 275 B20R1.839710 CCCN(CCO)S(=O)(=O)c1ccc(cc1F)[N+](=O)[O-] 274078a_100000211420_100000741260 [0,1,0,0,0,0|2,0,1]=4 276 B20R1.839710 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000763611 [0,1,0,0,0,0|2,0,0]=3 277 B20R1.839710 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000763611 [0,1,0,0,0,0|2,0,0]=3 278 B20R2.46414 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC2C#N 274078a_100000701862_100000010689 [0,0,0,1,0,0|2,0,1]=4 279 B20R2.46414 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2C#N 274078a_106645074975_100000010689 [0,0,0,1,0,0|2,0,1]=4 280 B20R2.46414 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000010689 [0,0,0,1,0,0|2,0,0]=3 281 B20R2.46414 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000010689 [0,0,0,1,0,0|2,0,0]=3 282 B20R2.46414 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C(=O)C 270084a_100000730860_100000010689 [0,0,0,1,0,0|1,0,2]=4 283 B20R2.46414 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C(=O)C 274078a_100000730860_100000010689 [0,0,0,1,0,0|1,0,2]=4 284 B20R2.46414 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000730860_100000231035 [0,0,0,1,0,0|1,0,2]=4 285 B20R2.46414 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000730860_100000231035 [0,0,0,1,0,0|1,0,2]=4 286 B20R2.46414 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000730860_100000185021 [0,0,0,1,0,0|0,0,2]=3 287 B20R2.46414 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000730860_100000185021 [0,0,0,1,0,0|0,0,2]=3 288 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)C 270084a_100000754278_100000010689 [0,0,0,1,0,0|1,0,0]=2 289 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)C 274078a_100000754278_100000010689 [0,0,0,1,0,0|1,0,0]=2 290 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000754278_100000231035 [0,0,0,1,0,0|1,0,0]=2 291 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000754278_100000231035 [0,0,0,1,0,0|1,0,0]=2 292 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000754278_100000185021 [0,0,0,1,0,0|0,0,0]=1 293 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000754278_100000185021 [0,0,0,1,0,0|0,0,0]=1 294 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(C)C 270084a_100000754278_100000183442 [0,0,0,1,0,0|2,0,1]=4 295 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(C)C 274078a_100000754278_100000183442 [0,0,0,1,0,0|2,0,1]=4 296 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000754278_100000209996 [0,0,0,1,0,0|1,0,1]=3 297 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000754278_100000209996 [0,0,0,1,0,0|1,0,1]=3 298 B20R2.46414 CCC1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000754278_100000032944 [0,0,0,1,0,0|1,0,1]=3 299 B20R2.46414 N#CC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000701862_100000231035 [0,0,0,1,0,0|2,0,1]=4 300 B20R2.46414 N#CC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000701862_100000185021 [0,0,0,1,0,0|1,0,1]=3 301 B20R2.46414 N#C[C@@H]1CSCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100020626484_100000185021 [0,0,0,1,0,0|2,0,1]=4 302 B20R2.46414 N#C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_106645074975_100000231035 [0,0,0,1,0,0|2,0,1]=4 303 B20R2.46414 N#C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_106645074975_100000185021 [0,0,0,1,0,0|1,0,1]=3 304 B20R2.46414 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000231035 [0,0,0,1,0,0|2,0,0]=3 305 B20R2.46414 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000231035 [0,0,0,1,0,0|2,0,0]=3 306 B20R2.46414 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000185021 [0,0,0,1,0,0|1,0,0]=2 307 B20R2.46414 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000185021 [0,0,0,1,0,0|1,0,0]=2 308 B20R2.46414 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000209996 [0,0,0,1,0,0|2,0,1]=4 309 B20R2.46414 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000209996 [0,0,0,1,0,0|2,0,1]=4 310 B20R2.46414 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 40a_100000745186_100000032944 [0,0,0,1,0,0|2,0,1]=4 311 B20R2.69507 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 270084a_100020590056_100000010689 [0,0,0,1,0,0|3,0,0]=4 312 B20R2.69507 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 274078a_100020590056_100000010689 [0,0,0,1,0,0|3,0,0]=4 313 B20R2.69507 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 270084a_100103146936_100000010689 [0,0,0,1,0,0|3,0,0]=4 314 B20R2.69507 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 274078a_100103146936_100000010689 [0,0,0,1,0,0|3,0,0]=4 315 B20R2.69507 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 270084a_200015306588_100000010689 [0,0,0,1,0,0|2,0,0]=3 316 B20R2.69507 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 274078a_200015306588_100000010689 [0,0,0,1,0,0|2,0,0]=3 317 B20R2.69507 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 270084a_100015207562_100000010689 [0,0,0,1,0,0|3,0,0]=4 318 B20R2.69507 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 274078a_100015207562_100000010689 [0,0,0,1,0,0|3,0,0]=4 319 B20R2.69507 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_200015306588_100000231035 [0,0,0,1,0,0|2,0,0]=3 320 B20R2.69507 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_200015306588_100000231035 [0,0,0,1,0,0|2,0,0]=3 321 B20R2.69507 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_200015306588_100000185021 [0,0,0,1,0,0|1,0,0]=2 322 B20R2.69507 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_200015306588_100000185021 [0,0,0,1,0,0|1,0,0]=2 323 B20R2.69507 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_200015306588_100000209996 [0,0,0,1,0,0|2,0,1]=4 324 B20R2.69507 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_200015306588_100000209996 [0,0,0,1,0,0|2,0,1]=4 325 B20R2.69507 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_200015306588_100000032944 [0,0,0,1,0,0|2,0,1]=4 326 B20R2.69507 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 270084a_100020590056_100000231035 [0,0,0,1,0,0|3,0,0]=4 327 B20R2.69507 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 274078a_100020590056_100000231035 [0,0,0,1,0,0|3,0,0]=4 328 B20R2.69507 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 270084a_100103146936_100000231035 [0,0,0,1,0,0|3,0,0]=4 329 B20R2.69507 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 274078a_100103146936_100000231035 [0,0,0,1,0,0|3,0,0]=4 330 B20R2.69507 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 270084a_100015207562_100000231035 [0,0,0,1,0,0|3,0,0]=4 331 B20R2.69507 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 274078a_100015207562_100000231035 [0,0,0,1,0,0|3,0,0]=4 332 B20R2.69507 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 270084a_100020590056_100000185021 [0,0,0,1,0,0|2,0,0]=3 333 B20R2.69507 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 274078a_100020590056_100000185021 [0,0,0,1,0,0|2,0,0]=3 334 B20R2.69507 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 270084a_100103146936_100000185021 [0,0,0,1,0,0|2,0,0]=3 335 B20R2.69507 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 274078a_100103146936_100000185021 [0,0,0,1,0,0|2,0,0]=3 336 B20R2.69507 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 270084a_100015207562_100000185021 [0,0,0,1,0,0|2,0,0]=3 337 B20R2.69507 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 274078a_100015207562_100000185021 [0,0,0,1,0,0|2,0,0]=3 338 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC=C(C2)C 270084a_100000725631_100000010689 [0,0,0,1,0,0|1,0,2]=4 339 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC=C(C2)C 274078a_100000725631_100000010689 [0,0,0,1,0,0|1,0,2]=4 340 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000010689 [0,0,0,1,0,0|2,0,0]=3 341 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000010689 [0,0,0,1,0,0|2,0,0]=3 342 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000010689 [0,0,0,1,0,0|2,0,0]=3 343 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000010689 [0,0,0,1,0,0|2,0,0]=3 344 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 270084a_100000717927_100000010689 [0,0,0,1,0,0|1,0,0]=2 345 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 274078a_100000717927_100000010689 [0,0,0,1,0,0|1,0,0]=2 346 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 270084a_100000729577_100000010689 [0,0,0,1,0,0|2,0,0]=3 347 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 274078a_100000729577_100000010689 [0,0,0,1,0,0|2,0,0]=3 348 B20R2.153529 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)O 274078a_100000688207_100000010689 [0,0,0,1,0,0|3,0,0]=4 349 B20R2.153529 CC(C)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 270084a_100000717927_100000183442 [0,0,0,1,0,0|2,0,1]=4 350 B20R2.153529 CC(C)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 274078a_100000717927_100000183442 [0,0,0,1,0,0|2,0,1]=4 351 B20R2.153529 CC1=CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000725631_100000231035 [0,0,0,1,0,0|1,0,2]=4 352 B20R2.153529 CC1=CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000725631_100000231035 [0,0,0,1,0,0|1,0,2]=4 353 B20R2.153529 CC1=CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000725631_100000185021 [0,0,0,1,0,0|0,0,2]=3 354 B20R2.153529 CC1=CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000725631_100000185021 [0,0,0,1,0,0|0,0,2]=3 355 B20R2.153529 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000729577_100000231035 [0,0,0,1,0,0|2,0,0]=3 356 B20R2.153529 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000729577_100000231035 [0,0,0,1,0,0|2,0,0]=3 357 B20R2.153529 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000729577_100000185021 [0,0,0,1,0,0|1,0,0]=2 358 B20R2.153529 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000729577_100000185021 [0,0,0,1,0,0|1,0,0]=2 359 B20R2.153529 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000729577_100000209996 [0,0,0,1,0,0|2,0,1]=4 360 B20R2.153529 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000729577_100000209996 [0,0,0,1,0,0|2,0,1]=4 361 B20R2.153529 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000729577_100000032944 [0,0,0,1,0,0|2,0,1]=4 362 B20R2.153529 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000717927_100000231035 [0,0,0,1,0,0|1,0,0]=2 363 B20R2.153529 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000717927_100000231035 [0,0,0,1,0,0|1,0,0]=2 364 B20R2.153529 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000717927_100000185021 [0,0,0,1,0,0|0,0,0]=1 365 B20R2.153529 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000717927_100000185021 [0,0,0,1,0,0|0,0,0]=1 366 B20R2.153529 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000717927_100000209996 [0,0,0,1,0,0|1,0,1]=3 367 B20R2.153529 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000717927_100000209996 [0,0,0,1,0,0|1,0,1]=3 368 B20R2.153529 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000717927_100000032944 [0,0,0,1,0,0|1,0,1]=3 369 B20R2.153529 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000231035 [0,0,0,1,0,0|2,0,0]=3 370 B20R2.153529 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000231035 [0,0,0,1,0,0|2,0,0]=3 371 B20R2.153529 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000231035 [0,0,0,1,0,0|2,0,0]=3 372 B20R2.153529 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000231035 [0,0,0,1,0,0|2,0,0]=3 373 B20R2.153529 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)O 274078a_100000688207_100000231035 [0,0,0,1,0,0|3,0,0]=4 374 B20R2.153529 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000185021 [0,0,0,1,0,0|1,0,0]=2 375 B20R2.153529 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000185021 [0,0,0,1,0,0|1,0,0]=2 376 B20R2.153529 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000185021 [0,0,0,1,0,0|1,0,0]=2 377 B20R2.153529 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000185021 [0,0,0,1,0,0|1,0,0]=2 378 B20R2.153529 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)O 274078a_100000688207_100000185021 [0,0,0,1,0,0|2,0,0]=3 379 B20R2.153529 O=C1CN(CCN1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000184651_100000185021 [0,0,0,1,0,0|2,0,1]=4 380 B20R2.153529 O=C1CN(CCN1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000184651_100000185021 [0,0,0,1,0,0|2,0,1]=4 381 B20R2.153529 O=C1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000131268_100000185021 [0,0,0,1,0,0|2,0,1]=4 382 B20R2.153529 O=C1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000131268_100000185021 [0,0,0,1,0,0|2,0,1]=4 383 B20R2.153529 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000209996 [0,0,0,1,0,0|2,0,1]=4 384 B20R2.153529 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000209996 [0,0,0,1,0,0|2,0,1]=4 385 B20R2.153529 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 40a_100000697950_100000032944 [0,0,0,1,0,0|2,0,1]=4 386 B20R2.153529 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000209996 [0,0,0,1,0,0|2,0,1]=4 387 B20R2.153529 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000209996 [0,0,0,1,0,0|2,0,1]=4 388 B20R2.153529 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 40a_100000211013_100000032944 [0,0,0,1,0,0|2,0,1]=4 389 B20R2.756850 C=C(C)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 271570a_100000694244_200000254439 [0,0,0,1,0,0|2,0,0]=3 390 B20R2.756850 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 1458a_100000488440_200000210301 [0,0,0,1,0,0|1,0,0]=2 391 B20R2.756850 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000010689 [0,0,0,1,0,0|1,0,0]=2 392 B20R2.756850 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000010689 [0,0,0,1,0,0|1,0,0]=2 393 B20R2.756850 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000010689 [0,0,0,1,0,0|2,0,0]=3 394 B20R2.756850 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000010689 [0,0,0,1,0,0|2,0,0]=3 395 B20R2.756850 CC(C)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000183442 [0,0,0,1,0,0|2,0,1]=4 396 B20R2.756850 CC(C)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000183442 [0,0,0,1,0,0|2,0,1]=4 397 B20R2.756850 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000231035 [0,0,0,1,0,0|1,0,0]=2 398 B20R2.756850 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000231035 [0,0,0,1,0,0|1,0,0]=2 399 B20R2.756850 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000231035 [0,0,0,1,0,0|2,0,0]=3 400 B20R2.756850 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000231035 [0,0,0,1,0,0|2,0,0]=3 401 B20R2.756850 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000185021 [0,0,0,1,0,0|0,0,0]=1 402 B20R2.756850 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000185021 [0,0,0,1,0,0|0,0,0]=1 403 B20R2.756850 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000185021 [0,0,0,1,0,0|1,0,0]=2 404 B20R2.756850 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000185021 [0,0,0,1,0,0|1,0,0]=2 405 B20R2.756850 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000209996 [0,0,0,1,0,0|1,0,1]=3 406 B20R2.756850 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000209996 [0,0,0,1,0,0|1,0,1]=3 407 B20R2.756850 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCCCC2 40a_100000185865_100000032944 [0,0,0,1,0,0|1,0,1]=3 408 B20R2.756850 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000209996 [0,0,0,1,0,0|2,0,1]=4 409 B20R2.756850 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000209996 [0,0,0,1,0,0|2,0,1]=4 410 B20R2.756850 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCOCC2 40a_100000685342_100000032944 [0,0,0,1,0,0|2,0,1]=4 411 B20R2.756850 [13CH3]C(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 1458a_100000488440_200025704644 [0,0,0,1,0,0|1,0,0]=2 412 B20R2.2735268 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000010689 [0,0,0,1,0,0|2,0,0]=3 413 B20R2.2735268 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000010689 [0,0,0,1,0,0|2,0,0]=3 414 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)C 270084a_100000765834_100000010689 [0,0,0,1,0,0|1,0,0]=2 415 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)C 274078a_100000765834_100000010689 [0,0,0,1,0,0|1,0,0]=2 416 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000765834_100000231035 [0,0,0,1,0,0|1,0,0]=2 417 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000765834_100000231035 [0,0,0,1,0,0|1,0,0]=2 418 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000765834_100000185021 [0,0,0,1,0,0|0,0,0]=1 419 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000765834_100000185021 [0,0,0,1,0,0|0,0,0]=1 420 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(C)C 270084a_100000765834_100000183442 [0,0,0,1,0,0|2,0,1]=4 421 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(C)C 274078a_100000765834_100000183442 [0,0,0,1,0,0|2,0,1]=4 422 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000765834_100000209996 [0,0,0,1,0,0|1,0,1]=3 423 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000765834_100000209996 [0,0,0,1,0,0|1,0,1]=3 424 B20R2.2735268 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000765834_100000032944 [0,0,0,1,0,0|1,0,1]=3 425 B20R2.2735268 NC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000231035 [0,0,0,1,0,0|2,0,0]=3 426 B20R2.2735268 NC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000231035 [0,0,0,1,0,0|2,0,0]=3 427 B20R2.2735268 O=C(O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000185021 [0,0,0,1,0,0|1,0,0]=2 428 B20R2.2735268 O=C(O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000185021 [0,0,0,1,0,0|1,0,0]=2 429 B20R2.2735268 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000209996 [0,0,0,1,0,0|2,0,1]=4 430 B20R2.2735268 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000209996 [0,0,0,1,0,0|2,0,1]=4 431 B20R2.2735268 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 40a_100000738766_100000032944 [0,0,0,1,0,0|2,0,1]=4 432 B20R1.75553 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000210752 [0,0,0,0,0,1|3,0,0]=4 433 B20R1.75553 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000210752 [0,0,0,0,0,1|3,0,0]=4 434 B20R1.75553 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CCO 40a_100000210587_100000700920 [0,0,0,0,0,1|3,0,0]=4 435 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100000210455_100000740367 [0,0,0,0,0,1|0,0,0]=1 436 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100000210455_100000740367 [0,0,0,0,0,1|0,0,0]=1 437 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CC(C)C 270084a_100000210455_100000738239 [0,0,0,0,0,1|2,0,1]=4 438 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CC(C)C 274078a_100000210455_100000738239 [0,0,0,0,0,1|2,0,1]=4 439 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)NC(=O)C 270084a_100000210455_100000210752 [0,0,0,0,0,1|1,0,0]=2 440 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_100000210455_100000210752 [0,0,0,0,0,1|1,0,0]=2 441 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)NC(=O)C 40a_100000210455_100000700920 [0,0,0,0,0,1|1,0,0]=2 442 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OC(C)C 270084a_100000210455_100000696730 [0,0,0,0,0,1|2,0,1]=4 443 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OC(C)C 274078a_100000210455_100000696730 [0,0,0,0,0,1|2,0,1]=4 444 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OC(F)F 270084a_100000210455_100011206442 [0,0,0,0,0,1|2,0,1]=4 445 B20R1.75553 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OC(F)F 274078a_100000210455_100011206442 [0,0,0,0,0,1|2,0,1]=4 446 B20R1.75553 CCCN(CCO)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100000211420_100000740367 [0,0,0,0,0,1|1,0,0]=2 447 B20R1.75553 CCCN(CCO)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100000211420_100000740367 [0,0,0,0,0,1|1,0,0]=2 448 B20R1.75553 CCCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)C 270084a_100000211420_100000210752 [0,0,0,0,0,1|2,0,0]=3 449 B20R1.75553 CCCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_100000211420_100000210752 [0,0,0,0,0,1|2,0,0]=3 450 B20R1.75553 CCCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)C 40a_100000211420_100000700920 [0,0,0,0,0,1|2,0,0]=3 451 B20R1.75553 O=C(O)Cc1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000740367 [0,0,0,0,0,1|2,0,0]=3 452 B20R1.75553 O=C(O)Cc1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000740367 [0,0,0,0,0,1|2,0,0]=3 453 B20R1.485426 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100011207992_100000010689 [0,0,0,0,0,1|2,0,0]=3 454 B20R1.485426 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100011207992_100000010689 [0,0,0,0,0,1|2,0,0]=3 455 B20R1.485426 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100011207992_100000231035 [0,0,0,0,0,1|2,0,0]=3 456 B20R1.485426 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100011207992_100000231035 [0,0,0,0,0,1|2,0,0]=3 457 B20R1.485426 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100011207992_100000185021 [0,0,0,0,0,1|1,0,0]=2 458 B20R1.485426 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100011207992_100000185021 [0,0,0,0,0,1|1,0,0]=2 459 B20R1.485426 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100011207992_100000209996 [0,0,0,0,0,1|2,0,1]=4 460 B20R1.485426 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100011207992_100000209996 [0,0,0,0,0,1|2,0,1]=4 461 B20R1.485426 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100011207992_100000032944 [0,0,0,0,0,1|2,0,1]=4 462 B20R1.485426 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100015193777_100000010689 [0,0,0,0,0,1|3,0,0]=4 463 B20R1.485426 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100015193777_100000010689 [0,0,0,0,0,1|3,0,0]=4 464 B20R1.485426 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100015193777_100000231035 [0,0,0,0,0,1|3,0,0]=4 465 B20R1.485426 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100015193777_100000231035 [0,0,0,0,0,1|3,0,0]=4 466 B20R1.485426 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100015193777_100000185021 [0,0,0,0,0,1|2,0,0]=3 467 B20R1.485426 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100015193777_100000185021 [0,0,0,0,0,1|2,0,0]=3 468 B20R1.485426 COCC(COC)NS(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100011997029_100000185021 [0,0,0,0,0,1|3,0,0]=4 469 B20R1.839330 CCCN(CCC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 270084a_100000210455_100000735625 [0,0,0,0,0,1|1,0,1]=3 470 B20R1.839330 CCCN(CCC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 274078a_100000210455_100000735625 [0,0,0,0,0,1|1,0,1]=3 471 B20R1.839330 CCCN(CCC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 40a_100000210455_100015196453 [0,0,0,0,0,1|1,0,1]=3 472 B20R1.839330 CCCN(CCO)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 270084a_100000211420_100000735625 [0,0,0,0,0,1|2,0,1]=4 473 B20R1.839330 CCCN(CCO)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 274078a_100000211420_100000735625 [0,0,0,0,0,1|2,0,1]=4 474 B20R1.839330 CCCN(CCO)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 40a_100000211420_100015196453 [0,0,0,0,0,1|2,0,1]=4 475 B17R1.2893 C=C(C)c1ccc(cc1)S(=O)(=O)N(CC)CC 271570a_100000694244_100000164943 [2,0,0,0,0,0|2,0,0]=4 476 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 1458a_100000259280_200000210301 [2,0,0,0,0,0|1,0,0]=3 477 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000724800_100000010689 [2,0,0,0,0,0|1,0,0]=3 478 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000724800_100000010689 [2,0,0,0,0,0|1,0,0]=3 479 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000724800_100000231035 [2,0,0,0,0,0|1,0,0]=3 480 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000724800_100000231035 [2,0,0,0,0,0|1,0,0]=3 481 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000724800_100000185021 [2,0,0,0,0,0|0,0,0]=2 482 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000724800_100000185021 [2,0,0,0,0,0|0,0,0]=2 483 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000259280_200025704644 [2,0,0,0,0,0|1,0,0]=3 484 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000724800_100000209996 [2,0,0,0,0,0|1,0,1]=4 485 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000724800_100000209996 [2,0,0,0,0,0|1,0,1]=4 486 B17R1.2893 CCN(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000724800_100000032944 [2,0,0,0,0,0|1,0,1]=4 487 B17R1.17918 CCCN(CC)C(=O)c1ccc(cc1)C(=O)N 11a_100000226822_100000230133 [2,0,0,0,0,0|2,0,0]=4 488 B17R1.17918 CCCN(CC)C(=O)c1ccc(cc1)C(=O)N 1626a_100000226822_100000230133 [2,0,0,0,0,0|2,0,0]=4 489 B17R1.17918 CCCN(CC)C(=O)c1ccc(cc1)C(=O)N 240690a_100000226822_100000230133 [2,0,0,0,0,0|2,0,0]=4 490 B17R1.18809 C#CCN(C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000225692_100000185021 [2,0,0,0,0,0|0,0,2]=4 491 B17R1.18809 C=CCN(C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000225617_100000185021 [2,0,0,0,0,0|0,0,2]=4 492 B17R1.18809 C=CCN(C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000225617_100000185021 [2,0,0,0,0,0|0,0,2]=4 493 B17R1.18809 CC(=O)c1ccc(cc1)S(=O)(=O)N(C)CCO 270084a_100000210263_100000010689 [2,0,0,0,0,0|2,0,0]=4 494 B17R1.18809 CC(=O)c1ccc(cc1)S(=O)(=O)N(C)CCO 274078a_100000210263_100000010689 [2,0,0,0,0,0|2,0,0]=4 495 B17R1.18809 CCCN(C)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000747261_100000010689 [2,0,0,0,0,0|1,0,0]=3 496 B17R1.18809 CCCN(C)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000747261_100000010689 [2,0,0,0,0,0|1,0,0]=3 497 B17R1.18809 CCCN(C)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000747261_100000231035 [2,0,0,0,0,0|1,0,0]=3 498 B17R1.18809 CCCN(C)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000747261_100000231035 [2,0,0,0,0,0|1,0,0]=3 499 B17R1.18809 CCCN(C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000747261_100000185021 [2,0,0,0,0,0|0,0,0]=2 500 B17R1.18809 CCCN(C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000747261_100000185021 [2,0,0,0,0,0|0,0,0]=2 501 B17R1.18809 CCCN(C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000747261_100000209996 [2,0,0,0,0,0|1,0,1]=4 502 B17R1.18809 CCCN(C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000747261_100000209996 [2,0,0,0,0,0|1,0,1]=4 503 B17R1.18809 CCCN(C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000747261_100000032944 [2,0,0,0,0,0|1,0,1]=4 504 B17R1.18809 CN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000748184_100000185021 [2,0,0,0,0,0|1,0,1]=4 505 B17R1.18809 CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000210263_100000231035 [2,0,0,0,0,0|2,0,0]=4 506 B17R1.18809 CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000210263_100000231035 [2,0,0,0,0,0|2,0,0]=4 507 B17R1.18809 CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000210263_100000185021 [2,0,0,0,0,0|1,0,0]=3 508 B17R1.18809 CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000210263_100000185021 [2,0,0,0,0,0|1,0,0]=3 509 B17R1.19051 C#CCN(CC)S(=O)(=O)c1ccc(cc1)C=O 274078a_100000744766_100000045293 [2,0,0,0,0,0|0,0,2]=4 510 B17R1.19051 C=Cc1ccc(cc1)S(=O)(=O)N(CC)CCC 270084a_100000226822_100000034458 [2,0,0,0,0,0|1,0,0]=3 511 B17R1.19051 C=Cc1ccc(cc1)S(=O)(=O)N(CC)CCC 274078a_100000226822_100000034458 [2,0,0,0,0,0|1,0,0]=3 512 B17R1.19051 C=Cc1ccc(cc1)S(=O)(=O)N(CC)CCO 270084a_100000210973_100000034458 [2,0,0,0,0,0|2,0,0]=4 513 B17R1.19051 C=Cc1ccc(cc1)S(=O)(=O)N(CC)CCO 274078a_100000210973_100000034458 [2,0,0,0,0,0|2,0,0]=4 514 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)C#N 270084a_100000226822_100000184514 [2,0,0,0,0,0|1,0,1]=4 515 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)C#N 274078a_100000226822_100000184514 [2,0,0,0,0,0|1,0,1]=4 516 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)C#N 40a_100000226822_100010740313 [2,0,0,0,0,0|1,0,1]=4 517 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)C=O 270084a_100000226822_100000045293 [2,0,0,0,0,0|0,0,0]=2 518 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)C=O 274078a_100000226822_100000045293 [2,0,0,0,0,0|0,0,0]=2 519 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)CBr 270084a_100000226822_100000763552 [2,0,0,0,0,0|1,0,1]=4 520 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)CBr 274078a_100000226822_100000763552 [2,0,0,0,0,0|1,0,1]=4 521 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)CBr 40a_100000226822_100011072442 [2,0,0,0,0,0|1,0,1]=4 522 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)CC 270084a_100000226822_100000212210 [2,0,0,0,0,0|1,0,1]=4 523 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)CC 274078a_100000226822_100000212210 [2,0,0,0,0,0|1,0,1]=4 524 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)OC 270084a_100000226822_100000182833 [2,0,0,0,0,0|2,0,0]=4 525 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)OC 274078a_100000226822_100000182833 [2,0,0,0,0,0|2,0,0]=4 526 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)SC 270084a_100000226822_100000747762 [2,0,0,0,0,0|2,0,0]=4 527 B17R1.19051 CCCN(CC)S(=O)(=O)c1ccc(cc1)SC 274078a_100000226822_100000747762 [2,0,0,0,0,0|2,0,0]=4 528 B17R1.19051 CCN(CCO)S(=O)(=O)c1ccc(cc1)C=O 270084a_100000210973_100000045293 [2,0,0,0,0,0|1,0,0]=3 529 B17R1.19051 CCN(CCO)S(=O)(=O)c1ccc(cc1)C=O 274078a_100000210973_100000045293 [2,0,0,0,0,0|1,0,0]=3 530 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)Br 270084a_100000210455_100000182491 [2,0,0,0,0,0|1,0,0]=3 531 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)Br 274078a_100000210455_100000182491 [2,0,0,0,0,0|1,0,0]=3 532 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)Br 40a_100000210455_100010306709 [2,0,0,0,0,0|1,0,0]=3 533 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C 270084a_100000210455_100000211267 [2,0,0,0,0,0|0,0,1]=3 534 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C 274078a_100000210455_100000211267 [2,0,0,0,0,0|0,0,1]=3 535 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C 40a_100000210455_100000039673 [2,0,0,0,0,0|0,0,1]=3 536 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)Cl 270084a_100000210455_100000209962 [2,0,0,0,0,0|1,0,0]=3 537 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)Cl 274078a_100000210455_100000209962 [2,0,0,0,0,0|1,0,0]=3 538 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)Cl 40a_100000210455_100000077732 [2,0,0,0,0,0|1,0,0]=3 539 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)F 270084a_100000210455_100000184267 [2,0,0,0,0,0|1,0,0]=3 540 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)F 274078a_100000210455_100000184267 [2,0,0,0,0,0|1,0,0]=3 541 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)F 40a_100000210455_100000081159 [2,0,0,0,0,0|1,0,0]=3 542 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)I 270084a_100000210455_100011205396 [2,0,0,0,0,0|1,0,0]=3 543 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)I 274078a_100000210455_100011205396 [2,0,0,0,0,0|1,0,0]=3 544 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)N 40a_100000210455_100000054796 [2,0,0,0,0,0|1,0,0]=3 545 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)O 270084a_100000210455_100020667864 [2,0,0,0,0,0|0,0,0]=2 546 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cc1)O 274078a_100000210455_100020667864 [2,0,0,0,0,0|0,0,0]=2 547 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cn1)Br 270084a_100000210455_100011361808 [2,0,0,0,0,0|2,0,0]=4 548 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(cn1)Br 274078a_100000210455_100011361808 [2,0,0,0,0,0|2,0,0]=4 549 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(nc1)C 270084a_100000210455_100000719016 [2,0,0,0,0,0|1,0,1]=4 550 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(nc1)C 274078a_100000210455_100000719016 [2,0,0,0,0,0|1,0,1]=4 551 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(nc1)Cl 270084a_100000210455_100000184283 [2,0,0,0,0,0|2,0,0]=4 552 B17R1.1719 CCCN(CCC)S(=O)(=O)c1ccc(nc1)Cl 274078a_100000210455_100000184283 [2,0,0,0,0,0|2,0,0]=4 553 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)Br 270084a_100000211420_100000182491 [2,0,0,0,0,0|2,0,0]=4 554 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)Br 274078a_100000211420_100000182491 [2,0,0,0,0,0|2,0,0]=4 555 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)Br 40a_100000211420_100010306709 [2,0,0,0,0,0|2,0,0]=4 556 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C 270084a_100000211420_100000211267 [2,0,0,0,0,0|1,0,1]=4 557 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C 274078a_100000211420_100000211267 [2,0,0,0,0,0|1,0,1]=4 558 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C 40a_100000211420_100000039673 [2,0,0,0,0,0|1,0,1]=4 559 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)Cl 270084a_100000211420_100000209962 [2,0,0,0,0,0|2,0,0]=4 560 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)Cl 274078a_100000211420_100000209962 [2,0,0,0,0,0|2,0,0]=4 561 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)Cl 40a_100000211420_100000077732 [2,0,0,0,0,0|2,0,0]=4 562 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)F 270084a_100000211420_100000184267 [2,0,0,0,0,0|2,0,0]=4 563 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)F 274078a_100000211420_100000184267 [2,0,0,0,0,0|2,0,0]=4 564 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)F 40a_100000211420_100000081159 [2,0,0,0,0,0|2,0,0]=4 565 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)I 270084a_100000211420_100011205396 [2,0,0,0,0,0|2,0,0]=4 566 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)I 274078a_100000211420_100011205396 [2,0,0,0,0,0|2,0,0]=4 567 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)N 40a_100000211420_100000054796 [2,0,0,0,0,0|2,0,0]=4 568 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)O 270084a_100000211420_100020667864 [2,0,0,0,0,0|1,0,0]=3 569 B17R1.1719 CCCN(CCO)S(=O)(=O)c1ccc(cc1)O 274078a_100000211420_100020667864 [2,0,0,0,0,0|1,0,0]=3 570 B17R1.1719 O=S(=O)(c1ccc(cc1)O)N(CCO)CCO 270084a_100000210587_100020667864 [2,0,0,0,0,0|2,0,0]=4 571 B17R1.1719 O=S(=O)(c1ccc(cc1)O)N(CCO)CCO 274078a_100000210587_100020667864 [2,0,0,0,0,0|2,0,0]=4 572 B17R1.31537 C=Cc1ccc(cc1)C(=O)N(CCC)CCC 11a_100000210455_100000687532 [2,0,0,0,0,0|2,0,0]=4 573 B17R1.31537 C=Cc1ccc(cc1)C(=O)N(CCC)CCC 1626a_100000210455_100000687532 [2,0,0,0,0,0|2,0,0]=4 574 B17R1.31537 C=Cc1ccc(cc1)C(=O)N(CCC)CCC 240690a_100000210455_100000687532 [2,0,0,0,0,0|2,0,0]=4 575 B17R1.31537 C=Cc1ccc(cc1)C(=O)N(CCC)CCC 527a_100000210455_100000687532 [2,0,0,0,0,0|2,0,0]=4 576 B17R1.31537 CCCN(CCC)C(=O)c1ccc(cc1)CO 1626a_100000210455_100000183892 [2,0,0,0,0,0|1,0,1]=4 577 B17R1.31537 CCCN(CCC)C(=O)c1ccc(cc1)CO 240690a_100000210455_100000183892 [2,0,0,0,0,0|1,0,1]=4 578 B17R1.18315 CCCN(CCC)Cc1ccc(cc1)C(=O)C 2230a_100000210455_100000756337 [2,0,0,0,0,0|2,0,0]=4 579 B17R1.18315 CCCN(CCC)Cc1ccc(cc1)C(=O)C 269982a_100000210455_100000756337 [2,0,0,0,0,0|2,0,0]=4 580 B17R1.18315 CCCN(CCC)Cc1ccc(cc1)C(=O)C 26a_100000210455_100000185113 [2,0,0,0,0,0|2,0,0]=4 581 B17R1.18315 CCCN(CCC)Cc1ccc(cc1)C(=O)N 2230a_100000210455_100000231043 [2,0,0,0,0,0|2,0,0]=4 582 B17R1.18315 CCCN(CCC)Cc1ccc(cc1)C(=O)N 269982a_100000210455_100000231043 [2,0,0,0,0,0|2,0,0]=4 583 B17R1.18315 CCCN(CCC)Cc1ccc(cc1)C(=O)N 270004a_100000210455_100000038677 [2,0,0,0,0,0|2,0,0]=4 584 B17R1.18315 CCCN(CCC)Cc1ccc(cc1)C(=O)[O-] 26a_100000210455_100016998105 [2,0,0,0,0,0|1,0,1]=4 585 B19R1.12152 CCCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000207695_100000010689 [1,1,0,0,0,0|1,0,0]=3 586 B19R1.12152 CCCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000207695_100000010689 [1,1,0,0,0,0|1,0,0]=3 587 B19R1.12152 CCCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000207695_100000231035 [1,1,0,0,0,0|1,0,0]=3 588 B19R1.12152 CCCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000207695_100000231035 [1,1,0,0,0,0|1,0,0]=3 589 B19R1.12152 CCCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000207695_100000185021 [1,1,0,0,0,0|0,0,0]=2 590 B19R1.12152 CCCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000207695_100000185021 [1,1,0,0,0,0|0,0,0]=2 591 B19R1.12152 CCCCN(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000207695_100000209996 [1,1,0,0,0,0|1,0,1]=4 592 B19R1.12152 CCCCN(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000207695_100000209996 [1,1,0,0,0,0|1,0,1]=4 593 B19R1.12152 CCCCN(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000207695_100000032944 [1,1,0,0,0,0|1,0,1]=4 594 B19R1.12152 CCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000226048_100000010689 [1,1,0,0,0,0|1,0,1]=4 595 B19R1.12152 CCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000226048_100000231035 [1,1,0,0,0,0|1,0,1]=4 596 B19R1.12152 CCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000226048_100000185021 [1,1,0,0,0,0|0,0,1]=3 597 B19R1.12152 CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000731262_100000010689 [1,1,0,0,0,0|1,0,0]=3 598 B19R1.12152 CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000731262_100000010689 [1,1,0,0,0,0|1,0,0]=3 599 B19R1.12152 CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000731262_100000231035 [1,1,0,0,0,0|1,0,0]=3 600 B19R1.12152 CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000731262_100000231035 [1,1,0,0,0,0|1,0,0]=3 601 B19R1.12152 CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000731262_100000185021 [1,1,0,0,0,0|0,0,0]=2 602 B19R1.12152 CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000731262_100000185021 [1,1,0,0,0,0|0,0,0]=2 603 B19R1.12152 CCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000731262_100000209996 [1,1,0,0,0,0|1,0,1]=4 604 B19R1.12152 CCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000731262_100000209996 [1,1,0,0,0,0|1,0,1]=4 605 B19R1.12152 CCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000731262_100000032944 [1,1,0,0,0,0|1,0,1]=4 606 B19R1.26852 C=C(C)CN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000211296_100000010689 [1,1,0,0,0,0|1,0,1]=4 607 B19R1.26852 C=C(C)CN(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000211296_100000010689 [1,1,0,0,0,0|1,0,1]=4 608 B19R1.26852 C=C(C)CN(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000211296_100000231035 [1,1,0,0,0,0|1,0,1]=4 609 B19R1.26852 C=C(C)CN(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000211296_100000231035 [1,1,0,0,0,0|1,0,1]=4 610 B19R1.26852 C=C(C)CN(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000211296_100000185021 [1,1,0,0,0,0|0,0,1]=3 611 B19R1.26852 C=C(C)CN(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000211296_100000185021 [1,1,0,0,0,0|0,0,1]=3 612 B19R1.26852 CCN(CC(C)C)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000738554_100000010689 [1,1,0,0,0,0|1,0,0]=3 613 B19R1.26852 CCN(CC(C)C)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000738554_100000010689 [1,1,0,0,0,0|1,0,0]=3 614 B19R1.26852 CCN(CC(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000738554_100000231035 [1,1,0,0,0,0|1,0,0]=3 615 B19R1.26852 CCN(CC(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000738554_100000231035 [1,1,0,0,0,0|1,0,0]=3 616 B19R1.26852 CCN(CC(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000738554_100000185021 [1,1,0,0,0,0|0,0,0]=2 617 B19R1.26852 CCN(CC(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000738554_100000185021 [1,1,0,0,0,0|0,0,0]=2 618 B19R1.26852 CCN(CC(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000738554_100000209996 [1,1,0,0,0,0|1,0,1]=4 619 B19R1.26852 CCN(CC(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000738554_100000209996 [1,1,0,0,0,0|1,0,1]=4 620 B19R1.26852 CCN(CC(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000738554_100000032944 [1,1,0,0,0,0|1,0,1]=4 621 B19R1.26852 CCN(C[C@H](C)O)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000729506_100000010689 [1,1,0,0,0,0|1,0,0]=3 622 B19R1.26852 CCN(C[C@H](C)O)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000729506_100000010689 [1,1,0,0,0,0|1,0,0]=3 623 B19R1.26852 CCN(C[C@H](C)O)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000729506_100000231035 [1,1,0,0,0,0|1,0,0]=3 624 B19R1.26852 CCN(C[C@H](C)O)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000729506_100000231035 [1,1,0,0,0,0|1,0,0]=3 625 B19R1.26852 CCN(C[C@H](C)O)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000729506_100000185021 [1,1,0,0,0,0|0,0,0]=2 626 B19R1.26852 CCN(C[C@H](C)O)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000729506_100000185021 [1,1,0,0,0,0|0,0,0]=2 627 B19R1.26852 CCN(C[C@H](C)O)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000729506_100000209996 [1,1,0,0,0,0|1,0,1]=4 628 B19R1.26852 CCN(C[C@H](C)O)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000729506_100000209996 [1,1,0,0,0,0|1,0,1]=4 629 B19R1.26852 CCN(C[C@H](C)O)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000729506_100000032944 [1,1,0,0,0,0|1,0,1]=4 630 B19R1.31917 C#CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100000744766_100000217497 [1,1,0,0,0,0|0,0,2]=4 631 B19R1.31917 C#CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100000744766_100015196439 [1,1,0,0,0,0|0,0,2]=4 632 B19R1.31917 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)NC 270084a_100000226822_100000222204 [1,1,0,0,0,0|1,0,0]=3 633 B19R1.31917 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_100000226822_100000222204 [1,1,0,0,0,0|1,0,0]=3 634 B19R1.31917 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_100000226822_100000217497 [1,1,0,0,0,0|0,0,0]=2 635 B19R1.31917 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100000226822_100000217497 [1,1,0,0,0,0|0,0,0]=2 636 B19R1.31917 CCCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100000226822_100015196439 [1,1,0,0,0,0|0,0,0]=2 637 B19R1.31917 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)NC 270084a_100000210973_100000222204 [1,1,0,0,0,0|2,0,0]=4 638 B19R1.31917 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_100000210973_100000222204 [1,1,0,0,0,0|2,0,0]=4 639 B19R1.31917 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_100000210973_100000217497 [1,1,0,0,0,0|1,0,0]=3 640 B19R1.31917 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100000210973_100000217497 [1,1,0,0,0,0|1,0,0]=3 641 B19R1.31917 CCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100000210973_100015196439 [1,1,0,0,0,0|1,0,0]=3 642 B19R1.31918 CCCN(CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 270084a_100000226822_100000735899 [1,1,0,0,0,0|1,0,1]=4 643 B19R1.31918 CCCN(CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 274078a_100000226822_100000735899 [1,1,0,0,0,0|1,0,1]=4 644 B19R1.31918 CCCN(CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 270084a_100000226822_200000215108 [1,1,0,0,0,0|1,0,1]=4 645 B19R1.31918 CCCN(CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 274078a_100000226822_200000215108 [1,1,0,0,0,0|1,0,1]=4 646 B19R1.31951 CCCN(CC)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 270084a_100000226822_100000741939 [1,1,0,0,0,0|1,0,1]=4 647 B19R1.31951 CCCN(CC)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 274078a_100000226822_100000741939 [1,1,0,0,0,0|1,0,1]=4 648 B19R1.31951 CCCN(CC)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 270084a_100000226822_100000756168 [1,1,0,0,0,0|1,0,1]=4 649 B19R1.31951 CCCN(CC)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 274078a_100000226822_100000756168 [1,1,0,0,0,0|1,0,1]=4 650 B19R1.31951 CCCN(CC)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 270084a_100000226822_100011361805 [1,1,0,0,0,0|1,0,1]=4 651 B19R1.31951 CCCN(CC)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 274078a_100000226822_100011361805 [1,1,0,0,0,0|1,0,1]=4 652 B19R1.31951 CCCN(CC)S(=O)(=O)c1ccc(c(c1)F)[N+](=O)[O-] 274078a_100000226822_100000745415 [1,1,0,0,0,0|1,0,1]=4 653 B19R1.307928 C=CCN(C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000742772_100000185021 [1,1,0,0,0,0|0,0,2]=4 654 B19R1.307928 C=CCN(C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000742772_100000185021 [1,1,0,0,0,0|0,0,2]=4 655 B19R1.307928 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)C(C)C 274078a_100000224655_100000010689 [1,1,0,0,0,0|2,0,0]=4 656 B19R1.307928 CC(C)N(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000224655_100000231035 [1,1,0,0,0,0|2,0,0]=4 657 B19R1.307928 CC(C)N(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000224655_100000185021 [1,1,0,0,0,0|1,0,0]=3 658 B19R1.307928 CCCN(C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_106256033942_100000010689 [1,1,0,0,0,0|1,0,0]=3 659 B19R1.307928 CCCN(C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_106256033942_100000010689 [1,1,0,0,0,0|1,0,0]=3 660 B19R1.307928 CCCN(C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_106256033942_100000231035 [1,1,0,0,0,0|1,0,0]=3 661 B19R1.307928 CCCN(C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_106256033942_100000231035 [1,1,0,0,0,0|1,0,0]=3 662 B19R1.307928 CCCN(C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_106256033942_100000185021 [1,1,0,0,0,0|0,0,0]=2 663 B19R1.307928 CCCN(C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_106256033942_100000185021 [1,1,0,0,0,0|0,0,0]=2 664 B19R1.307928 CCCN(C(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_106256033942_100000209996 [1,1,0,0,0,0|1,0,1]=4 665 B19R1.307928 CCCN(C(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_106256033942_100000209996 [1,1,0,0,0,0|1,0,1]=4 666 B19R1.307928 CCCN(C(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_106256033942_100000032944 [1,1,0,0,0,0|1,0,1]=4 667 B19R1.324495 C#CCN(CC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100000744766_100000763611 [1,1,0,0,0,0|0,0,2]=4 668 B19R1.324495 CCCN(CC)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 270084a_100000226822_100000739667 [1,1,0,0,0,0|1,0,1]=4 669 B19R1.324495 CCCN(CC)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 274078a_100000226822_100000739667 [1,1,0,0,0,0|1,0,1]=4 670 B19R1.324495 CCCN(CC)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 270084a_100000226822_100000738598 [1,1,0,0,0,0|1,0,1]=4 671 B19R1.324495 CCCN(CC)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 274078a_100000226822_100000738598 [1,1,0,0,0,0|1,0,1]=4 672 B19R1.324495 CCCN(CC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_100000226822_100000763611 [1,1,0,0,0,0|0,0,0]=2 673 B19R1.324495 CCCN(CC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100000226822_100000763611 [1,1,0,0,0,0|0,0,0]=2 674 B19R1.324495 CCCN(CC)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 270084a_100000226822_100000182962 [1,1,0,0,0,0|1,0,1]=4 675 B19R1.324495 CCCN(CC)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 274078a_100000226822_100000182962 [1,1,0,0,0,0|1,0,1]=4 676 B19R1.324495 CCCN(CC)S(=O)(=O)c1ccc(cc1F)[N+](=O)[O-] 274078a_100000226822_100000741260 [1,1,0,0,0,0|1,0,1]=4 677 B19R1.324495 CCN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_100000210973_100000763611 [1,1,0,0,0,0|1,0,0]=3 678 B19R1.324495 CCN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100000210973_100000763611 [1,1,0,0,0,0|1,0,0]=3 679 B19R1.554143 CCC(C)N(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000732650_100000010689 [1,1,0,0,0,0|1,0,0]=3 680 B19R1.554143 CCC(C)N(CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000732650_100000010689 [1,1,0,0,0,0|1,0,0]=3 681 B19R1.554143 CCC(C)N(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000732650_100000231035 [1,1,0,0,0,0|1,0,0]=3 682 B19R1.554143 CCC(C)N(CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000732650_100000231035 [1,1,0,0,0,0|1,0,0]=3 683 B19R1.554143 CCC(C)N(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000732650_100000185021 [1,1,0,0,0,0|0,0,0]=2 684 B19R1.554143 CCC(C)N(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000732650_100000185021 [1,1,0,0,0,0|0,0,0]=2 685 B19R1.554143 CCC(C)N(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000732650_100000209996 [1,1,0,0,0,0|1,0,1]=4 686 B19R1.554143 CCC(C)N(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000732650_100000209996 [1,1,0,0,0,0|1,0,1]=4 687 B19R1.554143 CCC(C)N(CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000732650_100000032944 [1,1,0,0,0,0|1,0,1]=4 688 B19R1.554143 CCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000731049_100000010689 [1,1,0,0,0,0|2,0,0]=4 689 B19R1.554143 CCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000731049_100000231035 [1,1,0,0,0,0|2,0,0]=4 690 B19R1.554143 CCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000731049_100000185021 [1,1,0,0,0,0|1,0,0]=3 691 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Br)OC 270084a_100000210455_100000184073 [1,1,0,0,0,0|2,0,0]=4 692 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Br)OC 274078a_100000210455_100000184073 [1,1,0,0,0,0|2,0,0]=4 693 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)C)OC 270084a_100000210455_100000738859 [1,1,0,0,0,0|2,0,0]=4 694 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)C)OC 274078a_100000210455_100000738859 [1,1,0,0,0,0|2,0,0]=4 695 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Cl)C#N 270084a_100000210455_100000740098 [1,1,0,0,0,0|1,0,1]=4 696 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Cl)C#N 274078a_100000210455_100000740098 [1,1,0,0,0,0|1,0,1]=4 697 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Cl)OC 270084a_100000210455_100000738900 [1,1,0,0,0,0|2,0,0]=4 698 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Cl)OC 274078a_100000210455_100000738900 [1,1,0,0,0,0|2,0,0]=4 699 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)F)OC 270084a_100000210455_100000738988 [1,1,0,0,0,0|2,0,0]=4 700 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)F)OC 274078a_100000210455_100000738988 [1,1,0,0,0,0|2,0,0]=4 701 B19R1.59564 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)N)OC 40a_100000210455_100000032121 [1,1,0,0,0,0|2,0,0]=4 702 B19R1.73518 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 270084a_100015185251_100000034458 [1,1,0,0,0,0|2,0,0]=4 703 B19R1.73518 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 274078a_100015185251_100000034458 [1,1,0,0,0,0|2,0,0]=4 704 B19R1.73518 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)CC(C)O 270084a_100000731851_100000034458 [1,1,0,0,0,0|2,0,0]=4 705 B19R1.73518 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)CC(C)O 274078a_100000731851_100000034458 [1,1,0,0,0,0|2,0,0]=4 706 B19R1.73518 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)C=O 270084a_100015185251_100000045293 [1,1,0,0,0,0|1,0,0]=3 707 B19R1.73518 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)C=O 274078a_100015185251_100000045293 [1,1,0,0,0,0|1,0,0]=3 708 B19R1.73518 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1)C=O 270084a_100000731851_100000045293 [1,1,0,0,0,0|1,0,0]=3 709 B19R1.73518 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1)C=O 274078a_100000731851_100000045293 [1,1,0,0,0,0|1,0,0]=3 710 B19R1.83276 C#CCN(CCOC)S(=O)(=O)c1ccc(cc1)C=O 274078a_100000223814_100000045293 [1,1,0,0,0,0|0,0,2]=4 711 B19R1.83276 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)CCC#N 274078a_100000176855_100000034458 [1,1,0,0,0,0|1,0,1]=4 712 B19R1.83276 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)CCCC 270084a_200000207744_100000034458 [1,1,0,0,0,0|1,0,0]=3 713 B19R1.83276 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)CCCC 274078a_200000207744_100000034458 [1,1,0,0,0,0|1,0,0]=3 714 B19R1.83276 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)CCOC 270084a_200011192371_100000034458 [1,1,0,0,0,0|1,0,0]=3 715 B19R1.83276 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)CCOC 274078a_200011192371_100000034458 [1,1,0,0,0,0|1,0,0]=3 716 B19R1.83276 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)CCCC 270084a_100000198060_100000034458 [1,1,0,0,0,0|2,0,0]=4 717 B19R1.83276 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)CCCC 274078a_100000198060_100000034458 [1,1,0,0,0,0|2,0,0]=4 718 B19R1.83276 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000034458 [1,1,0,0,0,0|2,0,0]=4 719 B19R1.83276 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000034458 [1,1,0,0,0,0|2,0,0]=4 720 B19R1.83276 CCCCN(CC#N)S(=O)(=O)c1ccc(cc1)C=O 274078a_200011192266_100000045293 [1,1,0,0,0,0|1,0,1]=4 721 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C#N 270084a_200000207744_100000184514 [1,1,0,0,0,0|1,0,1]=4 722 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C#N 274078a_200000207744_100000184514 [1,1,0,0,0,0|1,0,1]=4 723 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C#N 40a_200000207744_100010740313 [1,1,0,0,0,0|1,0,1]=4 724 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C=O 270084a_200000207744_100000045293 [1,1,0,0,0,0|0,0,0]=2 725 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C=O 274078a_200000207744_100000045293 [1,1,0,0,0,0|0,0,0]=2 726 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)CBr 270084a_200000207744_100000763552 [1,1,0,0,0,0|1,0,1]=4 727 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)CBr 274078a_200000207744_100000763552 [1,1,0,0,0,0|1,0,1]=4 728 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)CBr 40a_200000207744_100011072442 [1,1,0,0,0,0|1,0,1]=4 729 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)CC 270084a_200000207744_100000212210 [1,1,0,0,0,0|1,0,1]=4 730 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)CC 274078a_200000207744_100000212210 [1,1,0,0,0,0|1,0,1]=4 731 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)OC 270084a_200000207744_100000182833 [1,1,0,0,0,0|2,0,0]=4 732 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)OC 274078a_200000207744_100000182833 [1,1,0,0,0,0|2,0,0]=4 733 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)SC 270084a_200000207744_100000747762 [1,1,0,0,0,0|2,0,0]=4 734 B19R1.83276 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)SC 274078a_200000207744_100000747762 [1,1,0,0,0,0|2,0,0]=4 735 B19R1.83276 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C=O 270084a_100000198060_100000045293 [1,1,0,0,0,0|1,0,0]=3 736 B19R1.83276 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C=O 274078a_100000198060_100000045293 [1,1,0,0,0,0|1,0,0]=3 737 B19R1.83276 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C=O 274078a_100000176855_100000045293 [1,1,0,0,0,0|0,0,1]=3 738 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C#N 270084a_200011192371_100000184514 [1,1,0,0,0,0|1,0,1]=4 739 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C#N 274078a_200011192371_100000184514 [1,1,0,0,0,0|1,0,1]=4 740 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C#N 40a_200011192371_100010740313 [1,1,0,0,0,0|1,0,1]=4 741 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C=O 270084a_200011192371_100000045293 [1,1,0,0,0,0|0,0,0]=2 742 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C=O 274078a_200011192371_100000045293 [1,1,0,0,0,0|0,0,0]=2 743 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)CBr 270084a_200011192371_100000763552 [1,1,0,0,0,0|1,0,1]=4 744 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)CBr 274078a_200011192371_100000763552 [1,1,0,0,0,0|1,0,1]=4 745 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)CBr 40a_200011192371_100011072442 [1,1,0,0,0,0|1,0,1]=4 746 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)CC 270084a_200011192371_100000212210 [1,1,0,0,0,0|1,0,1]=4 747 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)CC 274078a_200011192371_100000212210 [1,1,0,0,0,0|1,0,1]=4 748 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)OC 270084a_200011192371_100000182833 [1,1,0,0,0,0|2,0,0]=4 749 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)OC 274078a_200011192371_100000182833 [1,1,0,0,0,0|2,0,0]=4 750 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)SC 270084a_200011192371_100000747762 [1,1,0,0,0,0|2,0,0]=4 751 B19R1.83276 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)SC 274078a_200011192371_100000747762 [1,1,0,0,0,0|2,0,0]=4 752 B19R1.83276 COCCN(CC#N)S(=O)(=O)c1ccc(cc1)C=O 274078a_100011199603_100000045293 [1,1,0,0,0,0|1,0,1]=4 753 B19R1.83276 O=Cc1ccc(cc1)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000045293 [1,1,0,0,0,0|1,0,0]=3 754 B19R1.83276 O=Cc1ccc(cc1)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000045293 [1,1,0,0,0,0|1,0,0]=3 755 B19R1.151199 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CCN 40a_100000210455_100000014313 [1,1,0,0,0,0|1,0,1]=4 756 B19R1.151199 CCCN(CCC)S(=O)(=O)c1ccc(cc1)N=C=O 274078a_100000210455_100000033224 [1,1,0,0,0,0|0,0,1]=3 757 B19R1.151199 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OCC 270084a_100000210455_100000182814 [1,1,0,0,0,0|1,0,1]=4 758 B19R1.151199 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OCC 274078a_100000210455_100000182814 [1,1,0,0,0,0|1,0,1]=4 759 B19R1.151199 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OCC 40a_100000210455_100010301650 [1,1,0,0,0,0|1,0,1]=4 760 B19R1.151199 CCCN(CCO)S(=O)(=O)c1ccc(cc1)N=C=O 274078a_100000211420_100000033224 [1,1,0,0,0,0|1,0,1]=4 761 B19R1.151199 CCCc1ccc(cc1)S(=O)(=O)N(CCC)CCC 270084a_100000210455_100000211671 [1,1,0,0,0,0|1,0,1]=4 762 B19R1.151199 CCCc1ccc(cc1)S(=O)(=O)N(CCC)CCC 274078a_100000210455_100000211671 [1,1,0,0,0,0|1,0,1]=4 763 B19R1.307998 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)C(C)CC 270084a_200011216551_100000034458 [1,1,0,0,0,0|1,0,0]=3 764 B19R1.307998 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)C(C)CC 274078a_200011216551_100000034458 [1,1,0,0,0,0|1,0,0]=3 765 B19R1.307998 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)C(C)CO 270084a_100011303929_100000034458 [1,1,0,0,0,0|2,0,0]=4 766 B19R1.307998 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)C(C)CO 274078a_100011303929_100000034458 [1,1,0,0,0,0|2,0,0]=4 767 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C#N 270084a_200011216551_100000184514 [1,1,0,0,0,0|1,0,1]=4 768 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C#N 274078a_200011216551_100000184514 [1,1,0,0,0,0|1,0,1]=4 769 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C#N 40a_200011216551_100010740313 [1,1,0,0,0,0|1,0,1]=4 770 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C=O 270084a_200011216551_100000045293 [1,1,0,0,0,0|0,0,0]=2 771 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C=O 274078a_200011216551_100000045293 [1,1,0,0,0,0|0,0,0]=2 772 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)CBr 270084a_200011216551_100000763552 [1,1,0,0,0,0|1,0,1]=4 773 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)CBr 274078a_200011216551_100000763552 [1,1,0,0,0,0|1,0,1]=4 774 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)CBr 40a_200011216551_100011072442 [1,1,0,0,0,0|1,0,1]=4 775 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)CC 270084a_200011216551_100000212210 [1,1,0,0,0,0|1,0,1]=4 776 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)CC 274078a_200011216551_100000212210 [1,1,0,0,0,0|1,0,1]=4 777 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)OC 270084a_200011216551_100000182833 [1,1,0,0,0,0|2,0,0]=4 778 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)OC 274078a_200011216551_100000182833 [1,1,0,0,0,0|2,0,0]=4 779 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)SC 270084a_200011216551_100000747762 [1,1,0,0,0,0|2,0,0]=4 780 B19R1.307998 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)SC 274078a_200011216551_100000747762 [1,1,0,0,0,0|2,0,0]=4 781 B19R1.307998 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C=O 270084a_100011303929_100000045293 [1,1,0,0,0,0|1,0,0]=3 782 B19R1.307998 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C=O 274078a_100011303929_100000045293 [1,1,0,0,0,0|1,0,0]=3 783 B19R1.528749 CCCN(CCC)S(=O)(=O)c1ccc(cc1Br)OC 270084a_100000210455_100000724158 [1,1,0,0,0,0|2,0,0]=4 784 B19R1.528749 CCCN(CCC)S(=O)(=O)c1ccc(cc1Br)OC 274078a_100000210455_100000724158 [1,1,0,0,0,0|2,0,0]=4 785 B19R1.528749 CCCN(CCC)S(=O)(=O)c1ccc(cc1C)OC 270084a_100000210455_100000742020 [1,1,0,0,0,0|2,0,0]=4 786 B19R1.528749 CCCN(CCC)S(=O)(=O)c1ccc(cc1C)OC 274078a_100000210455_100000742020 [1,1,0,0,0,0|2,0,0]=4 787 B19R1.528749 CCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)C#N 274078a_100000210455_100000698839 [1,1,0,0,0,0|1,0,1]=4 788 B19R1.31020 CCCN(C(=O)c1ccc(cc1)C(=O)N)C(C)CC 11a_200011216551_100000230133 [1,1,0,0,0,0|2,0,0]=4 789 B19R1.31020 CCCN(C(=O)c1ccc(cc1)C(=O)N)C(C)CC 1626a_200011216551_100000230133 [1,1,0,0,0,0|2,0,0]=4 790 B19R1.31020 CCCN(C(=O)c1ccc(cc1)C(=O)N)C(C)CC 240690a_200011216551_100000230133 [1,1,0,0,0,0|2,0,0]=4 791 B19R1.60289 CCCC(CCC)C(=O)c1ccc(cc1)C(=O)OC 1458a_100000211811_200011218217 [1,1,0,0,0,0|2,0,0]=4 792 B19R1.60289 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)NC 11a_100000210455_100011298788 [1,1,0,0,0,0|2,0,0]=4 793 B19R1.60289 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)NC 1626a_100000210455_100011298788 [1,1,0,0,0,0|2,0,0]=4 794 B19R1.60289 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)NC 240690a_100000210455_100011298788 [1,1,0,0,0,0|2,0,0]=4 795 B19R1.60289 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)NC 527a_100000210455_100011298788 [1,1,0,0,0,0|2,0,0]=4 796 B19R1.60289 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)OC 11a_100000210455_100000211811 [1,1,0,0,0,0|1,0,0]=3 797 B19R1.60289 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)OC 1626a_100000210455_100000211811 [1,1,0,0,0,0|1,0,0]=3 798 B19R1.60289 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)OC 240690a_100000210455_100000211811 [1,1,0,0,0,0|1,0,0]=3 799 B19R1.60289 CCCN(CCC)C(=O)c1ccc(cc1)C(=O)OC 527a_100000210455_100000211811 [1,1,0,0,0,0|1,0,0]=3 800 B19R1.60289 CCCN(CCC)C(C)c1ccc(cc1)C(=O)OC 2230a_100000210455_100010159609 [1,1,0,0,0,0|2,0,0]=4 801 B19R1.60289 CCCN(CCC)C(C)c1ccc(cc1)C(=O)OC 269982a_100000210455_100010159609 [1,1,0,0,0,0|2,0,0]=4 802 B19R1.60289 CCCN(CCO)C(=O)c1ccc(cc1)C(=O)OC 240690a_100000211420_100000211811 [1,1,0,0,0,0|2,0,0]=4 803 B19R1.83708 CCCCN(CCC)C(=O)c1ccc(cc1)C(=O)N 11a_200000207744_100000230133 [1,1,0,0,0,0|2,0,0]=4 804 B19R1.83708 CCCCN(CCC)C(=O)c1ccc(cc1)C(=O)N 1626a_200000207744_100000230133 [1,1,0,0,0,0|2,0,0]=4 805 B19R1.83708 CCCCN(CCC)C(=O)c1ccc(cc1)C(=O)N 240690a_200000207744_100000230133 [1,1,0,0,0,0|2,0,0]=4 806 B19R1.83708 CCCN(CCOC)C(=O)c1ccc(cc1)C(=O)N 11a_200011192371_100000230133 [1,1,0,0,0,0|2,0,0]=4 807 B19R1.83708 CCCN(CCOC)C(=O)c1ccc(cc1)C(=O)N 1626a_200011192371_100000230133 [1,1,0,0,0,0|2,0,0]=4 808 B19R1.83708 CCCN(CCOC)C(=O)c1ccc(cc1)C(=O)N 240690a_200011192371_100000230133 [1,1,0,0,0,0|2,0,0]=4 809 B19R1.533532 CCCN(CCC)C(=O)c1ccc(cc1C)C(=O)N 11a_100000210455_100009913687 [1,1,0,0,0,0|2,0,0]=4 810 B19R1.533532 CCCN(CCC)C(=O)c1ccc(cc1C)C(=O)N 1626a_100000210455_100009913687 [1,1,0,0,0,0|2,0,0]=4 811 B19R1.533532 CCCN(CCC)C(=O)c1ccc(cc1C)C(=O)N 240690a_100000210455_100009913687 [1,1,0,0,0,0|2,0,0]=4 812 B19R1.533532 CCCN(CCC)C(=O)c1ccc(cc1C)C(=O)N 527a_100000210455_100009913687 [1,1,0,0,0,0|2,0,0]=4 813 B19R1.59541 CCCN(CCC)S(=O)(=O)c1ccc(o1)C(=O)OC 270084a_100000210455_100000040647 [0,1,0,0,1,0|1,0,0]=3 814 B19R1.59541 CCCN(CCC)S(=O)(=O)c1ccc(o1)C(=O)OC 274078a_100000210455_100000040647 [0,1,0,0,1,0|1,0,0]=3 815 B19R1.59541 CCCN(CCO)S(=O)(=O)c1ccc(o1)C(=O)OC 270084a_100000211420_100000040647 [0,1,0,0,1,0|2,0,0]=4 816 B19R1.59541 CCCN(CCO)S(=O)(=O)c1ccc(o1)C(=O)OC 274078a_100000211420_100000040647 [0,1,0,0,1,0|2,0,0]=4 817 B21R1.88668 CCCN(CCC)S(=O)(=O)c1ccc(cc1)NC(=O)OC 270084a_100000210455_200000708314 [0,1,0,0,0,1|0,0,0]=2 818 B21R1.88668 CCCN(CCC)S(=O)(=O)c1ccc(cc1)NC(=O)OC 274078a_100000210455_200000708314 [0,1,0,0,0,1|0,0,0]=2 819 B21R1.88668 CCCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)OC 270084a_100000211420_200000708314 [0,1,0,0,0,1|1,0,0]=3 820 B21R1.88668 CCCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)OC 274078a_100000211420_200000708314 [0,1,0,0,0,1|1,0,0]=3 821 B21R1.88668 COC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_200000708314 [0,1,0,0,0,1|2,0,0]=4 822 B21R1.88668 COC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_200000708314 [0,1,0,0,0,1|2,0,0]=4 823 B21R1.88723 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Cl)NC(=O)C 270084a_100000210455_100000743022 [0,1,0,0,0,1|1,0,0]=3 824 B21R1.88723 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)Cl)NC(=O)C 274078a_100000210455_100000743022 [0,1,0,0,0,1|1,0,0]=3 825 B21R1.88723 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)F)NC(=O)C 270084a_100000210455_100000684858 [0,1,0,0,0,1|1,0,0]=3 826 B21R1.88723 CCCN(CCC)S(=O)(=O)c1ccc(c(c1)F)NC(=O)C 274078a_100000210455_100000684858 [0,1,0,0,0,1|1,0,0]=3 827 B21R1.88723 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)Cl)NC(=O)C 270084a_100000211420_100000743022 [0,1,0,0,0,1|2,0,0]=4 828 B21R1.88723 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)Cl)NC(=O)C 274078a_100000211420_100000743022 [0,1,0,0,0,1|2,0,0]=4 829 B21R1.88723 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)F)NC(=O)C 270084a_100000211420_100000684858 [0,1,0,0,0,1|2,0,0]=4 830 B21R1.88723 CCCN(CCO)S(=O)(=O)c1ccc(c(c1)F)NC(=O)C 274078a_100000211420_100000684858 [0,1,0,0,0,1|2,0,0]=4 831 B21R1.120121 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 270084a_100015185251_100000210752 [0,1,0,0,0,1|2,0,0]=4 832 B21R1.120121 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 274078a_100015185251_100000210752 [0,1,0,0,0,1|2,0,0]=4 833 B21R1.120121 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 40a_100015185251_100000700920 [0,1,0,0,0,1|2,0,0]=4 834 B21R1.120121 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CC(C)O 270084a_100000731851_100000210752 [0,1,0,0,0,1|2,0,0]=4 835 B21R1.120121 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CC(C)O 274078a_100000731851_100000210752 [0,1,0,0,0,1|2,0,0]=4 836 B21R1.120121 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100015185251_100000740367 [0,1,0,0,0,1|1,0,0]=3 837 B21R1.120121 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100015185251_100000740367 [0,1,0,0,0,1|1,0,0]=3 838 B21R1.120121 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100000731851_100000740367 [0,1,0,0,0,1|1,0,0]=3 839 B21R1.120121 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100000731851_100000740367 [0,1,0,0,0,1|1,0,0]=3 840 B21R1.142140 C#CCN(CCOC)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100000223814_100000740367 [0,1,0,0,0,1|0,0,2]=4 841 B21R1.142140 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000210752 [0,1,0,0,0,1|2,0,0]=4 842 B21R1.142140 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000210752 [0,1,0,0,0,1|2,0,0]=4 843 B21R1.142140 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)CCCO 40a_200000212863_100000700920 [0,1,0,0,0,1|2,0,0]=4 844 B21R1.142140 CCCCN(CC#N)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_200011192266_100000740367 [0,1,0,0,0,1|1,0,1]=4 845 B21R1.142140 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_200000207744_100000740367 [0,1,0,0,0,1|0,0,0]=2 846 B21R1.142140 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_200000207744_100000740367 [0,1,0,0,0,1|0,0,0]=2 847 B21R1.142140 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)NC(=O)C 270084a_200000207744_100000210752 [0,1,0,0,0,1|1,0,0]=3 848 B21R1.142140 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_200000207744_100000210752 [0,1,0,0,0,1|1,0,0]=3 849 B21R1.142140 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)NC(=O)C 40a_200000207744_100000700920 [0,1,0,0,0,1|1,0,0]=3 850 B21R1.142140 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100000198060_100000740367 [0,1,0,0,0,1|1,0,0]=3 851 B21R1.142140 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100000198060_100000740367 [0,1,0,0,0,1|1,0,0]=3 852 B21R1.142140 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)C 270084a_100000198060_100000210752 [0,1,0,0,0,1|2,0,0]=4 853 B21R1.142140 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_100000198060_100000210752 [0,1,0,0,0,1|2,0,0]=4 854 B21R1.142140 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)C 40a_100000198060_100000700920 [0,1,0,0,0,1|2,0,0]=4 855 B21R1.142140 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100000176855_100000740367 [0,1,0,0,0,1|0,0,1]=3 856 B21R1.142140 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_100000176855_100000210752 [0,1,0,0,0,1|1,0,1]=4 857 B21R1.142140 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)NC(=O)C 40a_100000176855_100000700920 [0,1,0,0,0,1|1,0,1]=4 858 B21R1.142140 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_200011192371_100000740367 [0,1,0,0,0,1|0,0,0]=2 859 B21R1.142140 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_200011192371_100000740367 [0,1,0,0,0,1|0,0,0]=2 860 B21R1.142140 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)NC(=O)C 270084a_200011192371_100000210752 [0,1,0,0,0,1|1,0,0]=3 861 B21R1.142140 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_200011192371_100000210752 [0,1,0,0,0,1|1,0,0]=3 862 B21R1.142140 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)NC(=O)C 40a_200011192371_100000700920 [0,1,0,0,0,1|1,0,0]=3 863 B21R1.142140 COCCN(CC#N)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100011199603_100000740367 [0,1,0,0,0,1|1,0,1]=4 864 B21R1.142140 O=C(O)Cc1ccc(cc1)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000740367 [0,1,0,0,0,1|1,0,0]=3 865 B21R1.142140 O=C(O)Cc1ccc(cc1)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000740367 [0,1,0,0,0,1|1,0,0]=3 866 B21R1.680234 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_200011216551_100000740367 [0,1,0,0,0,1|0,0,0]=2 867 B21R1.680234 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_200011216551_100000740367 [0,1,0,0,0,1|0,0,0]=2 868 B21R1.680234 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)NC(=O)C 270084a_200011216551_100000210752 [0,1,0,0,0,1|1,0,0]=3 869 B21R1.680234 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_200011216551_100000210752 [0,1,0,0,0,1|1,0,0]=3 870 B21R1.680234 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)NC(=O)C 40a_200011216551_100000700920 [0,1,0,0,0,1|1,0,0]=3 871 B21R1.680234 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100011303929_100000740367 [0,1,0,0,0,1|1,0,0]=3 872 B21R1.680234 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100011303929_100000740367 [0,1,0,0,0,1|1,0,0]=3 873 B21R1.680234 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)NC(=O)C 270084a_100011303929_100000210752 [0,1,0,0,0,1|2,0,0]=4 874 B21R1.680234 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_100011303929_100000210752 [0,1,0,0,0,1|2,0,0]=4 875 B21R1.680234 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)NC(=O)C 40a_100011303929_100000700920 [0,1,0,0,0,1|2,0,0]=4 876 B21R1.1265668 CCCN(CCC)S(=O)(=O)c1ccc(cc1C)NC(=O)C 270084a_100000210455_100011198010 [0,1,0,0,0,1|1,0,0]=3 877 B21R1.1265668 CCCN(CCC)S(=O)(=O)c1ccc(cc1C)NC(=O)C 274078a_100000210455_100011198010 [0,1,0,0,0,1|1,0,0]=3 878 B21R1.1265668 CCCN(CCO)S(=O)(=O)c1ccc(cc1C)NC(=O)C 270084a_100000211420_100011198010 [0,1,0,0,0,1|2,0,0]=4 879 B21R1.1265668 CCCN(CCO)S(=O)(=O)c1ccc(cc1C)NC(=O)C 274078a_100000211420_100011198010 [0,1,0,0,0,1|2,0,0]=4 880 B21R1.703007 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)NC 270084a_100011207992_100000222204 [0,1,0,0,0,1|2,0,0]=4 881 B21R1.703007 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_100011207992_100000222204 [0,1,0,0,0,1|2,0,0]=4 882 B21R1.703007 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_100011207992_100000217497 [0,1,0,0,0,1|1,0,0]=3 883 B21R1.703007 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100011207992_100000217497 [0,1,0,0,0,1|1,0,0]=3 884 B21R1.703007 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100011207992_100015196439 [0,1,0,0,0,1|1,0,0]=3 885 B21R1.703007 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_100015193777_100000217497 [0,1,0,0,0,1|2,0,0]=4 886 B21R1.703007 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100015193777_100000217497 [0,1,0,0,0,1|2,0,0]=4 887 B21R1.703007 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100015193777_100015196439 [0,1,0,0,0,1|2,0,0]=4 888 B21R1.721371 CC(C)C[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100161151251_100000185021 [0,1,0,0,0,1|2,0,0]=4 889 B21R1.721371 CC(C)C[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100161151251_100000185021 [0,1,0,0,0,1|2,0,0]=4 890 B21R1.6697998 CCCC(CCC)NS(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_100011207992_100000763611 [0,1,0,0,0,1|1,0,0]=3 891 B21R1.6697998 CCCC(CCC)NS(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100011207992_100000763611 [0,1,0,0,0,1|1,0,0]=3 892 B21R1.6697998 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_100015193777_100000763611 [0,1,0,0,0,1|2,0,0]=4 893 B21R1.6697998 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100015193777_100000763611 [0,1,0,0,0,1|2,0,0]=4 894 B21R1.1264987 CCCN(CCC)S(=O)(=O)Cc1ccc(cc1)C(=O)OC 270084a_100000210455_100000738260 [0,1,0,0,0,1|0,0,0]=2 895 B21R1.1264987 CCCN(CCC)S(=O)(=O)Cc1ccc(cc1)C(=O)OC 274078a_100000210455_100000738260 [0,1,0,0,0,1|0,0,0]=2 896 B21R1.1264987 CCCN(CCC)S(=O)(=O)Cc1ccc(cc1)C(=O)OC 40a_100000210455_100015196419 [0,1,0,0,0,1|0,0,0]=2 897 B21R1.1264987 CCCN(CCO)S(=O)(=O)Cc1ccc(cc1)C(=O)OC 270084a_100000211420_100000738260 [0,1,0,0,0,1|1,0,0]=3 898 B21R1.1264987 CCCN(CCO)S(=O)(=O)Cc1ccc(cc1)C(=O)OC 274078a_100000211420_100000738260 [0,1,0,0,0,1|1,0,0]=3 899 B21R1.1264987 CCCN(CCO)S(=O)(=O)Cc1ccc(cc1)C(=O)OC 40a_100000211420_100015196419 [0,1,0,0,0,1|1,0,0]=3 900 B21R1.1264987 COC(=O)c1ccc(cc1)CS(=O)(=O)N(CCO)CCO 270084a_100000210587_100000738260 [0,1,0,0,0,1|2,0,0]=4 901 B21R1.1264987 COC(=O)c1ccc(cc1)CS(=O)(=O)N(CCO)CCO 274078a_100000210587_100000738260 [0,1,0,0,0,1|2,0,0]=4 902 B21R1.1264987 COC(=O)c1ccc(cc1)CS(=O)(=O)N(CCO)CCO 40a_100000210587_100015196419 [0,1,0,0,0,1|2,0,0]=4 903 B21R1.4689564 CCCCN(CCC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 270084a_200000207744_100000735625 [0,1,0,0,0,1|1,0,1]=4 904 B21R1.4689564 CCCCN(CCC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 274078a_200000207744_100000735625 [0,1,0,0,0,1|1,0,1]=4 905 B21R1.4689564 CCCCN(CCC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 40a_200000207744_100015196453 [0,1,0,0,0,1|1,0,1]=4 906 B21R1.4689564 CCCN(CCOC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 270084a_200011192371_100000735625 [0,1,0,0,0,1|1,0,1]=4 907 B21R1.4689564 CCCN(CCOC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 274078a_200011192371_100000735625 [0,1,0,0,0,1|1,0,1]=4 908 B21R1.4689564 CCCN(CCOC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 40a_200011192371_100015196453 [0,1,0,0,0,1|1,0,1]=4 909 B21R1.6507042 CCCN(C(C)CC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 270084a_200011216551_100000735625 [0,1,0,0,0,1|1,0,1]=4 910 B21R1.6507042 CCCN(C(C)CC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 274078a_200011216551_100000735625 [0,1,0,0,0,1|1,0,1]=4 911 B21R1.6507042 CCCN(C(C)CC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 40a_200011216551_100015196453 [0,1,0,0,0,1|1,0,1]=4 912 B21R1.120122 CNC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 270084a_100015185251_100000222204 [0,2,0,0,0,0|2,0,0]=4 913 B21R1.120122 CNC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 274078a_100015185251_100000222204 [0,2,0,0,0,0|2,0,0]=4 914 B21R1.120122 CNC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)O 270084a_100000731851_100000222204 [0,2,0,0,0,0|2,0,0]=4 915 B21R1.120122 CNC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)O 274078a_100000731851_100000222204 [0,2,0,0,0,0|2,0,0]=4 916 B21R1.120122 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 270084a_100015185251_100000217497 [0,2,0,0,0,0|1,0,0]=3 917 B21R1.120122 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 274078a_100015185251_100000217497 [0,2,0,0,0,0|1,0,0]=3 918 B21R1.120122 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)C 40a_100015185251_100015196439 [0,2,0,0,0,0|1,0,0]=3 919 B21R1.120122 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)O 270084a_100000731851_100000217497 [0,2,0,0,0,0|1,0,0]=3 920 B21R1.120122 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)O 274078a_100000731851_100000217497 [0,2,0,0,0,0|1,0,0]=3 921 B21R1.142141 C#CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100000223814_100000217497 [0,2,0,0,0,0|0,0,2]=4 922 B21R1.142141 C#CCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100000223814_100015196439 [0,2,0,0,0,0|0,0,2]=4 923 B21R1.142141 CCCCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_200011192266_100000217497 [0,2,0,0,0,0|1,0,1]=4 924 B21R1.142141 CCCCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_200011192266_100015196439 [0,2,0,0,0,0|1,0,1]=4 925 B21R1.142141 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NC 270084a_200000207744_100000222204 [0,2,0,0,0,0|1,0,0]=3 926 B21R1.142141 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_200000207744_100000222204 [0,2,0,0,0,0|1,0,0]=3 927 B21R1.142141 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_200000207744_100000217497 [0,2,0,0,0,0|0,0,0]=2 928 B21R1.142141 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_200000207744_100000217497 [0,2,0,0,0,0|0,0,0]=2 929 B21R1.142141 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_200000207744_100015196439 [0,2,0,0,0,0|0,0,0]=2 930 B21R1.142141 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)NC 270084a_100000198060_100000222204 [0,2,0,0,0,0|2,0,0]=4 931 B21R1.142141 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_100000198060_100000222204 [0,2,0,0,0,0|2,0,0]=4 932 B21R1.142141 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_100000198060_100000217497 [0,2,0,0,0,0|1,0,0]=3 933 B21R1.142141 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100000198060_100000217497 [0,2,0,0,0,0|1,0,0]=3 934 B21R1.142141 CCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100000198060_100015196439 [0,2,0,0,0,0|1,0,0]=3 935 B21R1.142141 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_100000176855_100000222204 [0,2,0,0,0,0|1,0,1]=4 936 B21R1.142141 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100000176855_100000217497 [0,2,0,0,0,0|0,0,1]=3 937 B21R1.142141 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100000176855_100015196439 [0,2,0,0,0,0|0,0,1]=3 938 B21R1.142141 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)NC 270084a_200011192371_100000222204 [0,2,0,0,0,0|1,0,0]=3 939 B21R1.142141 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_200011192371_100000222204 [0,2,0,0,0,0|1,0,0]=3 940 B21R1.142141 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_200011192371_100000217497 [0,2,0,0,0,0|0,0,0]=2 941 B21R1.142141 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_200011192371_100000217497 [0,2,0,0,0,0|0,0,0]=2 942 B21R1.142141 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_200011192371_100015196439 [0,2,0,0,0,0|0,0,0]=2 943 B21R1.142141 CNC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000222204 [0,2,0,0,0,0|2,0,0]=4 944 B21R1.142141 CNC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000222204 [0,2,0,0,0,0|2,0,0]=4 945 B21R1.142141 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000217497 [0,2,0,0,0,0|1,0,0]=3 946 B21R1.142141 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000217497 [0,2,0,0,0,0|1,0,0]=3 947 B21R1.142141 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCCO 40a_200000212863_100015196439 [0,2,0,0,0,0|1,0,0]=3 948 B21R1.142141 COCCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100011199603_100000217497 [0,2,0,0,0,0|1,0,1]=4 949 B21R1.142141 COCCN(CC#N)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100011199603_100015196439 [0,2,0,0,0,0|1,0,1]=4 950 B21R1.680235 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)NC 270084a_200011216551_100000222204 [0,2,0,0,0,0|1,0,0]=3 951 B21R1.680235 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_200011216551_100000222204 [0,2,0,0,0,0|1,0,0]=3 952 B21R1.680235 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_200011216551_100000217497 [0,2,0,0,0,0|0,0,0]=2 953 B21R1.680235 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_200011216551_100000217497 [0,2,0,0,0,0|0,0,0]=2 954 B21R1.680235 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_200011216551_100015196439 [0,2,0,0,0,0|0,0,0]=2 955 B21R1.680235 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)NC 270084a_100011303929_100000222204 [0,2,0,0,0,0|2,0,0]=4 956 B21R1.680235 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)NC 274078a_100011303929_100000222204 [0,2,0,0,0,0|2,0,0]=4 957 B21R1.680235 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)OC 270084a_100011303929_100000217497 [0,2,0,0,0,0|1,0,0]=3 958 B21R1.680235 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)OC 274078a_100011303929_100000217497 [0,2,0,0,0,0|1,0,0]=3 959 B21R1.680235 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1)C(=O)OC 40a_100011303929_100015196439 [0,2,0,0,0,0|1,0,0]=3 960 B21R1.830971 C#CCC(=O)c1ccc(cc1)S(=O)(=O)N(CCC)CCC 1458a_100000488459_100000184674 [0,2,0,0,0,0|1,0,0]=3 961 B21R1.830971 C=CCC(=O)c1ccc(cc1)S(=O)(=O)N(CCC)CCC 1458a_100000488459_100000210623 [0,2,0,0,0,0|1,0,0]=3 962 B21R1.830971 CCCC(=O)c1ccc(cc1)S(=O)(=O)N(CCC)CCC 1458a_100000488459_100000210303 [0,2,0,0,0,0|1,0,0]=3 963 B21R1.830971 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)CC#N 1458a_100000488459_100011214920 [0,2,0,0,0,0|1,0,0]=3 964 B21R1.830971 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)CCF 1458a_100000488459_100011217306 [0,2,0,0,0,0|1,0,0]=3 965 B21R1.830971 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)CCO 1458a_100000488459_100000211926 [0,2,0,0,0,0|0,0,0]=2 966 B21R1.830971 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NCC 11a_100015525214_100000488459 [0,2,0,0,0,0|1,0,0]=3 967 B21R1.830971 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NCC 240690a_100015525214_100000488459 [0,2,0,0,0,0|1,0,0]=3 968 B21R1.830971 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NCC 527a_100015525214_100000488459 [0,2,0,0,0,0|1,0,0]=3 969 B21R1.830971 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NNC 22a_100016993582_100000488459 [0,2,0,0,0,0|1,0,0]=3 970 B21R1.830971 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)OCC 270084a_100000210455_100000182953 [0,2,0,0,0,0|0,0,0]=2 971 B21R1.830971 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)OCC 274078a_100000210455_100000182953 [0,2,0,0,0,0|0,0,0]=2 972 B21R1.830971 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OCC 270084a_100000211420_100000182953 [0,2,0,0,0,0|1,0,0]=3 973 B21R1.830971 CCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)OCC 274078a_100000211420_100000182953 [0,2,0,0,0,0|1,0,0]=3 974 B21R1.830971 CCOC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000182953 [0,2,0,0,0,0|2,0,0]=4 975 B21R1.830971 CCOC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000182953 [0,2,0,0,0,0|2,0,0]=4 976 B21R1.1265643 CCCN(CCC)S(=O)(=O)c1ccc(cc1C)C(=O)OC 40a_100000210455_200102728029 [0,2,0,0,0,0|0,0,0]=2 977 B21R1.1265643 CCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)C(=O)OC 270084a_100000210455_100000051267 [0,2,0,0,0,0|0,0,0]=2 978 B21R1.1265643 CCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)C(=O)OC 274078a_100000210455_100000051267 [0,2,0,0,0,0|0,0,0]=2 979 B21R1.1265643 CCCN(CCO)S(=O)(=O)c1ccc(cc1C)C(=O)OC 40a_100000211420_200102728029 [0,2,0,0,0,0|1,0,0]=3 980 B21R1.1265643 CCCN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)OC 270084a_100000211420_100000051267 [0,2,0,0,0,0|1,0,0]=3 981 B21R1.1265643 CCCN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)OC 274078a_100000211420_100000051267 [0,2,0,0,0,0|1,0,0]=3 982 B21R1.1265643 COC(=O)c1ccc(c(c1)C)S(=O)(=O)N(CCO)CCO 40a_100000210587_200102728029 [0,2,0,0,0,0|2,0,0]=4 983 B21R1.1265643 COC(=O)c1ccc(c(c1)Cl)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000051267 [0,2,0,0,0,0|2,0,0]=4 984 B21R1.1265643 COC(=O)c1ccc(c(c1)Cl)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000051267 [0,2,0,0,0,0|2,0,0]=4 985 B21R1.142142 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 270084a_200000207744_100000735899 [0,2,0,0,0,0|1,0,1]=4 986 B21R1.142142 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 274078a_200000207744_100000735899 [0,2,0,0,0,0|1,0,1]=4 987 B21R1.142142 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 270084a_200000207744_200000215108 [0,2,0,0,0,0|1,0,1]=4 988 B21R1.142142 CCCCN(CCC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 274078a_200000207744_200000215108 [0,2,0,0,0,0|1,0,1]=4 989 B21R1.142142 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 270084a_200011192371_100000735899 [0,2,0,0,0,0|1,0,1]=4 990 B21R1.142142 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 274078a_200011192371_100000735899 [0,2,0,0,0,0|1,0,1]=4 991 B21R1.142142 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 270084a_200011192371_200000215108 [0,2,0,0,0,0|1,0,1]=4 992 B21R1.142142 CCCN(CCOC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 274078a_200011192371_200000215108 [0,2,0,0,0,0|1,0,1]=4 993 B21R1.680236 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 270084a_200011216551_100000735899 [0,2,0,0,0,0|1,0,1]=4 994 B21R1.680236 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C 274078a_200011216551_100000735899 [0,2,0,0,0,0|1,0,1]=4 995 B21R1.680236 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 270084a_200011216551_200000215108 [0,2,0,0,0,0|1,0,1]=4 996 B21R1.680236 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N 274078a_200011216551_200000215108 [0,2,0,0,0,0|1,0,1]=4 997 B21R1.142177 CCCCN(CCC)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 270084a_200000207744_100000741939 [0,2,0,0,0,0|1,0,1]=4 998 B21R1.142177 CCCCN(CCC)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 274078a_200000207744_100000741939 [0,2,0,0,0,0|1,0,1]=4 999 B21R1.142177 CCCCN(CCC)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 270084a_200000207744_100000756168 [0,2,0,0,0,0|1,0,1]=4 1000 B21R1.142177 CCCCN(CCC)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 274078a_200000207744_100000756168 [0,2,0,0,0,0|1,0,1]=4 1001 B21R1.142177 CCCCN(CCC)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 270084a_200000207744_100011361805 [0,2,0,0,0,0|1,0,1]=4 1002 B21R1.142177 CCCCN(CCC)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 274078a_200000207744_100011361805 [0,2,0,0,0,0|1,0,1]=4 1003 B21R1.142177 CCCCN(CCC)S(=O)(=O)c1ccc(c(c1)F)[N+](=O)[O-] 274078a_200000207744_100000745415 [0,2,0,0,0,0|1,0,1]=4 1004 B21R1.142177 CCCN(CCOC)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 270084a_200011192371_100000741939 [0,2,0,0,0,0|1,0,1]=4 1005 B21R1.142177 CCCN(CCOC)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 274078a_200011192371_100000741939 [0,2,0,0,0,0|1,0,1]=4 1006 B21R1.142177 CCCN(CCOC)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 270084a_200011192371_100000756168 [0,2,0,0,0,0|1,0,1]=4 1007 B21R1.142177 CCCN(CCOC)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 274078a_200011192371_100000756168 [0,2,0,0,0,0|1,0,1]=4 1008 B21R1.142177 CCCN(CCOC)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 270084a_200011192371_100011361805 [0,2,0,0,0,0|1,0,1]=4 1009 B21R1.142177 CCCN(CCOC)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 274078a_200011192371_100011361805 [0,2,0,0,0,0|1,0,1]=4 1010 B21R1.142177 CCCN(CCOC)S(=O)(=O)c1ccc(c(c1)F)[N+](=O)[O-] 274078a_200011192371_100000745415 [0,2,0,0,0,0|1,0,1]=4 1011 B21R1.680269 CCCN(C(C)CC)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 270084a_200011216551_100000741939 [0,2,0,0,0,0|1,0,1]=4 1012 B21R1.680269 CCCN(C(C)CC)S(=O)(=O)c1ccc(c(c1)Br)[N+](=O)[O-] 274078a_200011216551_100000741939 [0,2,0,0,0,0|1,0,1]=4 1013 B21R1.680269 CCCN(C(C)CC)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 270084a_200011216551_100000756168 [0,2,0,0,0,0|1,0,1]=4 1014 B21R1.680269 CCCN(C(C)CC)S(=O)(=O)c1ccc(c(c1)C)[N+](=O)[O-] 274078a_200011216551_100000756168 [0,2,0,0,0,0|1,0,1]=4 1015 B21R1.680269 CCCN(C(C)CC)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 270084a_200011216551_100011361805 [0,2,0,0,0,0|1,0,1]=4 1016 B21R1.680269 CCCN(C(C)CC)S(=O)(=O)c1ccc(c(c1)Cl)[N+](=O)[O-] 274078a_200011216551_100011361805 [0,2,0,0,0,0|1,0,1]=4 1017 B21R1.680269 CCCN(C(C)CC)S(=O)(=O)c1ccc(c(c1)F)[N+](=O)[O-] 274078a_200011216551_100000745415 [0,2,0,0,0,0|1,0,1]=4 1018 B21R1.120445 CCCN(CC(O)CO)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_200000156893_100000010689 [0,2,0,0,0,0|1,0,0]=3 1019 B21R1.120445 CCCN(CC(O)CO)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_200000156893_100000010689 [0,2,0,0,0,0|1,0,0]=3 1020 B21R1.120445 CCCN(CC(O)CO)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_200000156893_100000231035 [0,2,0,0,0,0|1,0,0]=3 1021 B21R1.120445 CCCN(CC(O)CO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_200000156893_100000231035 [0,2,0,0,0,0|1,0,0]=3 1022 B21R1.120445 CCCN(CC(O)CO)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_200000156893_100000185021 [0,2,0,0,0,0|0,0,0]=2 1023 B21R1.120445 CCCN(CC(O)CO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_200000156893_100000185021 [0,2,0,0,0,0|0,0,0]=2 1024 B21R1.120445 CCCN(CC(O)CO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_200000156893_100000209996 [0,2,0,0,0,0|1,0,1]=4 1025 B21R1.120445 CCCN(CC(O)CO)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_200000156893_100000209996 [0,2,0,0,0,0|1,0,1]=4 1026 B21R1.731752 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)(C)C 270084a_100000752879_100000010689 [0,2,0,0,0,0|2,0,0]=4 1027 B21R1.731752 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(C)(C)C 274078a_100000752879_100000010689 [0,2,0,0,0,0|2,0,0]=4 1028 B21R1.731752 CC(C)(C)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000752879_100000231035 [0,2,0,0,0,0|2,0,0]=4 1029 B21R1.731752 CC(C)(C)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000752879_100000231035 [0,2,0,0,0,0|2,0,0]=4 1030 B21R1.731752 CC(C)(C)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000752879_100000185021 [0,2,0,0,0,0|1,0,0]=3 1031 B21R1.731752 CC(C)(C)CN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000752879_100000185021 [0,2,0,0,0,0|1,0,0]=3 1032 B21R1.731752 CCCN(CC(C)(C)C)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_107254831479_100000010689 [0,2,0,0,0,0|1,0,0]=3 1033 B21R1.731752 CCCN(CC(C)(C)C)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_107254831479_100000010689 [0,2,0,0,0,0|1,0,0]=3 1034 B21R1.731752 CCCN(CC(C)(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_107254831479_100000231035 [0,2,0,0,0,0|1,0,0]=3 1035 B21R1.731752 CCCN(CC(C)(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_107254831479_100000231035 [0,2,0,0,0,0|1,0,0]=3 1036 B21R1.731752 CCCN(CC(C)(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_107254831479_100000185021 [0,2,0,0,0,0|0,0,0]=2 1037 B21R1.731752 CCCN(CC(C)(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_107254831479_100000185021 [0,2,0,0,0,0|0,0,0]=2 1038 B21R1.731752 CCCN(CC(C)(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_107254831479_100000209996 [0,2,0,0,0,0|1,0,1]=4 1039 B21R1.731752 CCCN(CC(C)(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_107254831479_100000209996 [0,2,0,0,0,0|1,0,1]=4 1040 B21R1.731752 CCCN(CC(C)(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_107254831479_100000032944 [0,2,0,0,0,0|1,0,1]=4 1041 B21R1.731752 CCCN(CC(F)(F)F)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000739208_100000010689 [0,2,0,0,0,0|2,0,0]=4 1042 B21R1.731752 CCCN(CC(F)(F)F)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000739208_100000010689 [0,2,0,0,0,0|2,0,0]=4 1043 B21R1.731752 CCCN(CC(F)(F)F)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000739208_100000231035 [0,2,0,0,0,0|2,0,0]=4 1044 B21R1.731752 CCCN(CC(F)(F)F)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000739208_100000231035 [0,2,0,0,0,0|2,0,0]=4 1045 B21R1.731752 CCCN(CC(F)(F)F)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000739208_100000185021 [0,2,0,0,0,0|1,0,0]=3 1046 B21R1.731752 CCCN(CC(F)(F)F)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000739208_100000185021 [0,2,0,0,0,0|1,0,0]=3 1047 B21R1.731752 O=C(O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(F)(F)F 270084a_200000739120_100000185021 [0,2,0,0,0,0|2,0,0]=4 1048 B21R1.731752 O=C(O)c1ccc(cc1)S(=O)(=O)N(CCO)CC(F)(F)F 274078a_200000739120_100000185021 [0,2,0,0,0,0|2,0,0]=4 1049 B21R1.1035020 C=C(C)CN(CC(=C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100012017102_100000185021 [0,2,0,0,0,0|0,0,2]=4 1050 B21R1.1035020 C=C(C)CN(CC(=C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100012017102_100000185021 [0,2,0,0,0,0|0,0,2]=4 1051 B21R1.1035020 CC(=O)c1ccc(cc1)S(=O)(=O)N(CC(C)C)CC(C)C 270084a_100000201412_100000010689 [0,2,0,0,0,0|1,0,0]=3 1052 B21R1.1035020 CC(=O)c1ccc(cc1)S(=O)(=O)N(CC(C)C)CC(C)C 274078a_100000201412_100000010689 [0,2,0,0,0,0|1,0,0]=3 1053 B21R1.1035020 CC(=O)c1ccc(cc1)S(=O)(=O)N(CC(C)O)CC(C)O 270084a_100011218400_100000010689 [0,2,0,0,0,0|1,0,0]=3 1054 B21R1.1035020 CC(=O)c1ccc(cc1)S(=O)(=O)N(CC(C)O)CC(C)O 274078a_100011218400_100000010689 [0,2,0,0,0,0|1,0,0]=3 1055 B21R1.1035020 CC(C)CN(CC(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000201412_100000231035 [0,2,0,0,0,0|1,0,0]=3 1056 B21R1.1035020 CC(C)CN(CC(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000201412_100000231035 [0,2,0,0,0,0|1,0,0]=3 1057 B21R1.1035020 CC(C)CN(CC(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000201412_100000185021 [0,2,0,0,0,0|0,0,0]=2 1058 B21R1.1035020 CC(C)CN(CC(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000201412_100000185021 [0,2,0,0,0,0|0,0,0]=2 1059 B21R1.1035020 CC(C)CN(CC(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000201412_100000209996 [0,2,0,0,0,0|1,0,1]=4 1060 B21R1.1035020 CC(C)CN(CC(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000201412_100000209996 [0,2,0,0,0,0|1,0,1]=4 1061 B21R1.1035020 CC(C)CN(CC(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000201412_100000032944 [0,2,0,0,0,0|1,0,1]=4 1062 B21R1.1035020 CC(O)CN(CC(C)O)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100011218400_100000231035 [0,2,0,0,0,0|1,0,0]=3 1063 B21R1.1035020 CC(O)CN(CC(C)O)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100011218400_100000231035 [0,2,0,0,0,0|1,0,0]=3 1064 B21R1.1035020 CC(O)CN(CC(C)O)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100011218400_100000185021 [0,2,0,0,0,0|0,0,0]=2 1065 B21R1.1035020 CC(O)CN(CC(C)O)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100011218400_100000185021 [0,2,0,0,0,0|0,0,0]=2 1066 B21R1.1035020 CC(O)CN(CC(C)O)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100011218400_100000209996 [0,2,0,0,0,0|1,0,1]=4 1067 B21R1.1035020 CC(O)CN(CC(C)O)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100011218400_100000209996 [0,2,0,0,0,0|1,0,1]=4 1068 B21R1.1035020 CC(O)CN(CC(C)O)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100011218400_100000032944 [0,2,0,0,0,0|1,0,1]=4 1069 B21R1.3392723 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_100015185251_100000763611 [0,2,0,0,0,0|1,0,0]=3 1070 B21R1.3392723 CC(C)CN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100015185251_100000763611 [0,2,0,0,0,0|1,0,0]=3 1071 B21R1.3392723 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_100000731851_100000763611 [0,2,0,0,0,0|1,0,0]=3 1072 B21R1.3392723 CC(O)CN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100000731851_100000763611 [0,2,0,0,0,0|1,0,0]=3 1073 B21R1.6217534 CCCN(C(C)C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_200015185082_100000010689 [0,2,0,0,0,0|1,0,0]=3 1074 B21R1.6217534 CCCN(C(C)C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_200015185082_100000010689 [0,2,0,0,0,0|1,0,0]=3 1075 B21R1.6217534 CCCN(C(C)C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_200015185082_100000231035 [0,2,0,0,0,0|1,0,0]=3 1076 B21R1.6217534 CCCN(C(C)C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_200015185082_100000231035 [0,2,0,0,0,0|1,0,0]=3 1077 B21R1.6217534 CCCN(C(C)C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_200015185082_100000185021 [0,2,0,0,0,0|0,0,0]=2 1078 B21R1.6217534 CCCN(C(C)C(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_200015185082_100000185021 [0,2,0,0,0,0|0,0,0]=2 1079 B21R1.6217534 CCCN(C(C)C(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_200015185082_100000209996 [0,2,0,0,0,0|1,0,1]=4 1080 B21R1.6217534 CCCN(C(C)C(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_200015185082_100000209996 [0,2,0,0,0,0|1,0,1]=4 1081 B21R1.6217534 CCCN(C(C)C(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_200015185082_100000032944 [0,2,0,0,0,0|1,0,1]=4 1082 B21R1.1475 CCCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_200000226819_100000010689 [0,2,0,0,0,0|1,0,0]=3 1083 B21R1.1475 CCCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_200000226819_100000010689 [0,2,0,0,0,0|1,0,0]=3 1084 B21R1.1475 CCCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_200000226819_100000231035 [0,2,0,0,0,0|1,0,0]=3 1085 B21R1.1475 CCCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_200000226819_100000231035 [0,2,0,0,0,0|1,0,0]=3 1086 B21R1.1475 CCCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_200000226819_100000185021 [0,2,0,0,0,0|0,0,0]=2 1087 B21R1.1475 CCCCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_200000226819_100000185021 [0,2,0,0,0,0|0,0,0]=2 1088 B21R1.1475 CCCCCN(CCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_200000226819_100000209996 [0,2,0,0,0,0|1,0,1]=4 1089 B21R1.1475 CCCCCN(CCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_200000226819_100000209996 [0,2,0,0,0,0|1,0,1]=4 1090 B21R1.1475 CCCCCN(CCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_200000226819_100000032944 [0,2,0,0,0,0|1,0,1]=4 1091 B21R1.1475 CCCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000224656_100000010689 [0,2,0,0,0,0|2,0,0]=4 1092 B21R1.1475 CCCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000224656_100000010689 [0,2,0,0,0,0|2,0,0]=4 1093 B21R1.1475 CCCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000224656_100000231035 [0,2,0,0,0,0|2,0,0]=4 1094 B21R1.1475 CCCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000224656_100000231035 [0,2,0,0,0,0|2,0,0]=4 1095 B21R1.1475 CCCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000224656_100000185021 [0,2,0,0,0,0|1,0,0]=3 1096 B21R1.1475 CCCCCN(CCO)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000224656_100000185021 [0,2,0,0,0,0|1,0,0]=3 1097 B21R1.628898 C=CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100011698344_100000010689 [0,2,0,0,0,0|1,0,1]=4 1098 B21R1.628898 C=CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100011698344_100000010689 [0,2,0,0,0,0|1,0,1]=4 1099 B21R1.628898 C=CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100011698344_100000231035 [0,2,0,0,0,0|1,0,1]=4 1100 B21R1.628898 C=CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100011698344_100000231035 [0,2,0,0,0,0|1,0,1]=4 1101 B21R1.628898 C=CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100011698344_100000185021 [0,2,0,0,0,0|0,0,1]=3 1102 B21R1.628898 C=CCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100011698344_100000185021 [0,2,0,0,0,0|0,0,1]=3 1103 B21R1.628898 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCCO)CCCO 270084a_100000212923_100000010689 [0,2,0,0,0,0|1,0,0]=3 1104 B21R1.628898 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCCO)CCCO 274078a_100000212923_100000010689 [0,2,0,0,0,0|1,0,0]=3 1105 B21R1.628898 CCCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_200000177648_100000010689 [0,2,0,0,0,0|1,0,1]=4 1106 B21R1.628898 CCCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_200000177648_100000231035 [0,2,0,0,0,0|1,0,1]=4 1107 B21R1.628898 CCCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_200000177648_100000185021 [0,2,0,0,0,0|0,0,1]=3 1108 B21R1.628898 CCCCN(CCCC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000684618_100000010689 [0,2,0,0,0,0|1,0,0]=3 1109 B21R1.628898 CCCCN(CCCC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000684618_100000010689 [0,2,0,0,0,0|1,0,0]=3 1110 B21R1.628898 CCCCN(CCCC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000684618_100000231035 [0,2,0,0,0,0|1,0,0]=3 1111 B21R1.628898 CCCCN(CCCC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000684618_100000231035 [0,2,0,0,0,0|1,0,0]=3 1112 B21R1.628898 CCCCN(CCCC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000684618_100000185021 [0,2,0,0,0,0|0,0,0]=2 1113 B21R1.628898 CCCCN(CCCC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000684618_100000185021 [0,2,0,0,0,0|0,0,0]=2 1114 B21R1.628898 CCCCN(CCCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000684618_100000209996 [0,2,0,0,0,0|1,0,1]=4 1115 B21R1.628898 CCCCN(CCCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000684618_100000209996 [0,2,0,0,0,0|1,0,1]=4 1116 B21R1.628898 CCCCN(CCCC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000684618_100000032944 [0,2,0,0,0,0|1,0,1]=4 1117 B21R1.628898 CCCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000207391_100000010689 [0,2,0,0,0,0|1,0,0]=3 1118 B21R1.628898 CCCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000207391_100000010689 [0,2,0,0,0,0|1,0,0]=3 1119 B21R1.628898 CCCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000207391_100000231035 [0,2,0,0,0,0|1,0,0]=3 1120 B21R1.628898 CCCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000207391_100000231035 [0,2,0,0,0,0|1,0,0]=3 1121 B21R1.628898 CCCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000207391_100000185021 [0,2,0,0,0,0|0,0,0]=2 1122 B21R1.628898 CCCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000207391_100000185021 [0,2,0,0,0,0|0,0,0]=2 1123 B21R1.628898 CCCCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000207391_100000209996 [0,2,0,0,0,0|1,0,1]=4 1124 B21R1.628898 CCCCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000207391_100000209996 [0,2,0,0,0,0|1,0,1]=4 1125 B21R1.628898 CCCCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000207391_100000032944 [0,2,0,0,0,0|1,0,1]=4 1126 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 1458a_100000680006_200000210301 [0,2,0,0,0,0|1,0,0]=3 1127 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000210589_100000010689 [0,2,0,0,0,0|1,0,0]=3 1128 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000210589_100000010689 [0,2,0,0,0,0|1,0,0]=3 1129 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000210589_100000231035 [0,2,0,0,0,0|1,0,0]=3 1130 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000210589_100000231035 [0,2,0,0,0,0|1,0,0]=3 1131 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000210589_100000185021 [0,2,0,0,0,0|0,0,0]=2 1132 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000210589_100000185021 [0,2,0,0,0,0|0,0,0]=2 1133 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000680006_200025704644 [0,2,0,0,0,0|1,0,0]=3 1134 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000210589_100000209996 [0,2,0,0,0,0|1,0,1]=4 1135 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000210589_100000209996 [0,2,0,0,0,0|1,0,1]=4 1136 B21R1.628898 COCCN(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000210589_100000032944 [0,2,0,0,0,0|1,0,1]=4 1137 B21R1.628898 N#CCCN(CCC#N)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000212050_100000185021 [0,2,0,0,0,0|0,0,2]=4 1138 B21R1.628898 NC(=O)c1ccc(cc1)S(=O)(=O)N(CCCO)CCCO 270084a_100000212923_100000231035 [0,2,0,0,0,0|1,0,0]=3 1139 B21R1.628898 NC(=O)c1ccc(cc1)S(=O)(=O)N(CCCO)CCCO 274078a_100000212923_100000231035 [0,2,0,0,0,0|1,0,0]=3 1140 B21R1.628898 O=C(O)c1ccc(cc1)S(=O)(=O)N(CCCO)CCCO 270084a_100000212923_100000185021 [0,2,0,0,0,0|0,0,0]=2 1141 B21R1.628898 O=C(O)c1ccc(cc1)S(=O)(=O)N(CCCO)CCCO 274078a_100000212923_100000185021 [0,2,0,0,0,0|0,0,0]=2 1142 B21R1.628898 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCCO)CCCO 270084a_100000212923_100000209996 [0,2,0,0,0,0|1,0,1]=4 1143 B21R1.628898 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCCO)CCCO 274078a_100000212923_100000209996 [0,2,0,0,0,0|1,0,1]=4 1144 B21R1.628898 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(CCCO)CCCO 40a_100000212923_100000032944 [0,2,0,0,0,0|1,0,1]=4 1145 B21R1.708550 CCCN(CCN(C)C)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000226821_100000010689 [0,2,0,0,0,0|1,0,0]=3 1146 B21R1.708550 CCCN(CCN(C)C)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000226821_100000010689 [0,2,0,0,0,0|1,0,0]=3 1147 B21R1.708550 CCCN(CCN(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000226821_100000231035 [0,2,0,0,0,0|1,0,0]=3 1148 B21R1.708550 CCCN(CCN(C)C)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000226821_100000231035 [0,2,0,0,0,0|1,0,0]=3 1149 B21R1.708550 CCCN(CCN(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000226821_100000185021 [0,2,0,0,0,0|0,0,0]=2 1150 B21R1.708550 CCCN(CCN(C)C)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000226821_100000185021 [0,2,0,0,0,0|0,0,0]=2 1151 B21R1.708550 CCCN(CCN(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000226821_100000209996 [0,2,0,0,0,0|1,0,1]=4 1152 B21R1.708550 CCCN(CCN(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000226821_100000209996 [0,2,0,0,0,0|1,0,1]=4 1153 B21R1.708550 CCCN(CCN(C)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000226821_100000032944 [0,2,0,0,0,0|1,0,1]=4 1154 B21R1.1022164 C/C=C/CN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100020603311_100000010689 [0,2,0,0,0,0|1,0,1]=4 1155 B21R1.1022164 C/C=C/CN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100020603311_100000010689 [0,2,0,0,0,0|1,0,1]=4 1156 B21R1.1022164 C/C=C/CN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100020603311_100000231035 [0,2,0,0,0,0|1,0,1]=4 1157 B21R1.1022164 C/C=C/CN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100020603311_100000231035 [0,2,0,0,0,0|1,0,1]=4 1158 B21R1.1022164 C/C=C/CN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100020603311_100000185021 [0,2,0,0,0,0|0,0,1]=3 1159 B21R1.1022164 C/C=C/CN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100020603311_100000185021 [0,2,0,0,0,0|0,0,1]=3 1160 B21R1.1022164 CCC(C)N(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_200000740884_100000010689 [0,2,0,0,0,0|1,0,0]=3 1161 B21R1.1022164 CCC(C)N(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_200000740884_100000010689 [0,2,0,0,0,0|1,0,0]=3 1162 B21R1.1022164 CCC(C)N(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_200000740884_100000231035 [0,2,0,0,0,0|1,0,0]=3 1163 B21R1.1022164 CCC(C)N(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_200000740884_100000231035 [0,2,0,0,0,0|1,0,0]=3 1164 B21R1.1022164 CCC(C)N(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_200000740884_100000185021 [0,2,0,0,0,0|0,0,0]=2 1165 B21R1.1022164 CCC(C)N(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_200000740884_100000185021 [0,2,0,0,0,0|0,0,0]=2 1166 B21R1.1022164 CCC(C)N(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_200000740884_100000209996 [0,2,0,0,0,0|1,0,1]=4 1167 B21R1.1022164 CCC(C)N(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_200000740884_100000209996 [0,2,0,0,0,0|1,0,1]=4 1168 B21R1.1022164 CCC(C)N(CCOC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_200000740884_100000032944 [0,2,0,0,0,0|1,0,1]=4 1169 B21R1.1022164 CCCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000207357_100000010689 [0,2,0,0,0,0|1,0,0]=3 1170 B21R1.1022164 CCCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000207357_100000010689 [0,2,0,0,0,0|1,0,0]=3 1171 B21R1.1022164 CCCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000207357_100000231035 [0,2,0,0,0,0|1,0,0]=3 1172 B21R1.1022164 CCCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000207357_100000231035 [0,2,0,0,0,0|1,0,0]=3 1173 B21R1.1022164 CCCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000207357_100000185021 [0,2,0,0,0,0|0,0,0]=2 1174 B21R1.1022164 CCCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000207357_100000185021 [0,2,0,0,0,0|0,0,0]=2 1175 B21R1.1022164 CCCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100000207357_100000209996 [0,2,0,0,0,0|1,0,1]=4 1176 B21R1.1022164 CCCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000207357_100000209996 [0,2,0,0,0,0|1,0,1]=4 1177 B21R1.1022164 CCCCN(C(C)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000207357_100000032944 [0,2,0,0,0,0|1,0,1]=4 1178 B21R1.3527304 C#CCN(CCOC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100000223814_100000763611 [0,2,0,0,0,0|0,0,2]=4 1179 B21R1.3527304 CCCCN(CC#N)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_200011192266_100000763611 [0,2,0,0,0,0|1,0,1]=4 1180 B21R1.3527304 CCCCN(CCC)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 270084a_200000207744_100000739667 [0,2,0,0,0,0|1,0,1]=4 1181 B21R1.3527304 CCCCN(CCC)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 274078a_200000207744_100000739667 [0,2,0,0,0,0|1,0,1]=4 1182 B21R1.3527304 CCCCN(CCC)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 270084a_200000207744_100000738598 [0,2,0,0,0,0|1,0,1]=4 1183 B21R1.3527304 CCCCN(CCC)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 274078a_200000207744_100000738598 [0,2,0,0,0,0|1,0,1]=4 1184 B21R1.3527304 CCCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_200000207744_100000763611 [0,2,0,0,0,0|0,0,0]=2 1185 B21R1.3527304 CCCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_200000207744_100000763611 [0,2,0,0,0,0|0,0,0]=2 1186 B21R1.3527304 CCCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 270084a_200000207744_100000182962 [0,2,0,0,0,0|1,0,1]=4 1187 B21R1.3527304 CCCCN(CCC)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 274078a_200000207744_100000182962 [0,2,0,0,0,0|1,0,1]=4 1188 B21R1.3527304 CCCCN(CCC)S(=O)(=O)c1ccc(cc1F)[N+](=O)[O-] 274078a_200000207744_100000741260 [0,2,0,0,0,0|1,0,1]=4 1189 B21R1.3527304 CCCCN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_100000198060_100000763611 [0,2,0,0,0,0|1,0,0]=3 1190 B21R1.3527304 CCCCN(CCO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100000198060_100000763611 [0,2,0,0,0,0|1,0,0]=3 1191 B21R1.3527304 CCCN(CCC#N)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100000176855_100000763611 [0,2,0,0,0,0|0,0,1]=3 1192 B21R1.3527304 CCCN(CCOC)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 270084a_200011192371_100000739667 [0,2,0,0,0,0|1,0,1]=4 1193 B21R1.3527304 CCCN(CCOC)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 274078a_200011192371_100000739667 [0,2,0,0,0,0|1,0,1]=4 1194 B21R1.3527304 CCCN(CCOC)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 270084a_200011192371_100000738598 [0,2,0,0,0,0|1,0,1]=4 1195 B21R1.3527304 CCCN(CCOC)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 274078a_200011192371_100000738598 [0,2,0,0,0,0|1,0,1]=4 1196 B21R1.3527304 CCCN(CCOC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_200011192371_100000763611 [0,2,0,0,0,0|0,0,0]=2 1197 B21R1.3527304 CCCN(CCOC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_200011192371_100000763611 [0,2,0,0,0,0|0,0,0]=2 1198 B21R1.3527304 CCCN(CCOC)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 270084a_200011192371_100000182962 [0,2,0,0,0,0|1,0,1]=4 1199 B21R1.3527304 CCCN(CCOC)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 274078a_200011192371_100000182962 [0,2,0,0,0,0|1,0,1]=4 1200 B21R1.3527304 CCCN(CCOC)S(=O)(=O)c1ccc(cc1F)[N+](=O)[O-] 274078a_200011192371_100000741260 [0,2,0,0,0,0|1,0,1]=4 1201 B21R1.3527304 COCCN(CC#N)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100011199603_100000763611 [0,2,0,0,0,0|1,0,1]=4 1202 B21R1.3527304 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N(CCO)CCCO 270084a_200000212863_100000763611 [0,2,0,0,0,0|1,0,0]=3 1203 B21R1.3527304 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N(CCO)CCCO 274078a_200000212863_100000763611 [0,2,0,0,0,0|1,0,0]=3 1204 B21R1.707792 CCCN(C(CC)CC)S(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100015185089_100000010689 [0,2,0,0,0,0|1,0,0]=3 1205 B21R1.707792 CCCN(C(CC)CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100015185089_100000010689 [0,2,0,0,0,0|1,0,0]=3 1206 B21R1.707792 CCCN(C(CC)CC)S(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100015185089_100000231035 [0,2,0,0,0,0|1,0,0]=3 1207 B21R1.707792 CCCN(C(CC)CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100015185089_100000231035 [0,2,0,0,0,0|1,0,0]=3 1208 B21R1.707792 CCCN(C(CC)CC)S(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100015185089_100000185021 [0,2,0,0,0,0|0,0,0]=2 1209 B21R1.707792 CCCN(C(CC)CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100015185089_100000185021 [0,2,0,0,0,0|0,0,0]=2 1210 B21R1.707792 CCCN(C(CC)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 270084a_100015185089_100000209996 [0,2,0,0,0,0|1,0,1]=4 1211 B21R1.707792 CCCN(C(CC)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100015185089_100000209996 [0,2,0,0,0,0|1,0,1]=4 1212 B21R1.707792 CCCN(C(CC)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100015185089_100000032944 [0,2,0,0,0,0|1,0,1]=4 1213 B21R1.971245 CCC(C)N(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000210998_100000010689 [0,2,0,0,0,0|1,0,0]=3 1214 B21R1.971245 CCC(C)N(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000210998_100000231035 [0,2,0,0,0,0|1,0,0]=3 1215 B21R1.971245 CCC(C)N(C(C)CC)S(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000210998_100000185021 [0,2,0,0,0,0|0,0,0]=2 1216 B21R1.971245 CCC(C)N(C(C)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 274078a_100000210998_100000209996 [0,2,0,0,0,0|1,0,1]=4 1217 B21R1.971245 CCC(C)N(C(C)CC)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-] 40a_100000210998_100000032944 [0,2,0,0,0,0|1,0,1]=4 1218 B21R1.6507422 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 270084a_200011216551_100000739667 [0,2,0,0,0,0|1,0,1]=4 1219 B21R1.6507422 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1Br)[N+](=O)[O-] 274078a_200011216551_100000739667 [0,2,0,0,0,0|1,0,1]=4 1220 B21R1.6507422 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 270084a_200011216551_100000738598 [0,2,0,0,0,0|1,0,1]=4 1221 B21R1.6507422 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1C)[N+](=O)[O-] 274078a_200011216551_100000738598 [0,2,0,0,0,0|1,0,1]=4 1222 B21R1.6507422 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_200011216551_100000763611 [0,2,0,0,0,0|0,0,0]=2 1223 B21R1.6507422 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_200011216551_100000763611 [0,2,0,0,0,0|0,0,0]=2 1224 B21R1.6507422 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 270084a_200011216551_100000182962 [0,2,0,0,0,0|1,0,1]=4 1225 B21R1.6507422 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1Cl)[N+](=O)[O-] 274078a_200011216551_100000182962 [0,2,0,0,0,0|1,0,1]=4 1226 B21R1.6507422 CCCN(C(C)CC)S(=O)(=O)c1ccc(cc1F)[N+](=O)[O-] 274078a_200011216551_100000741260 [0,2,0,0,0,0|1,0,1]=4 1227 B21R1.6507422 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 270084a_100011303929_100000763611 [0,2,0,0,0,0|1,0,0]=3 1228 B21R1.6507422 CCCN(C(C)CO)S(=O)(=O)c1ccc(cc1Cl)C(=O)O 274078a_100011303929_100000763611 [0,2,0,0,0,0|1,0,0]=3 1229 B21R1.1265646 CCCN(CCC)S(=O)(=O)c1ccc(cc1OC)[N+](=O)[O-] 270084a_100000210455_100000739423 [0,2,0,0,0,0|1,0,1]=4 1230 B21R1.1265646 CCCN(CCC)S(=O)(=O)c1ccc(cc1OC)[N+](=O)[O-] 274078a_100000210455_100000739423 [0,2,0,0,0,0|1,0,1]=4 1231 B21R1.2665004 CCCN(CCC)S(=O)(=O)c1c(cc(cc1F)[N+](=O)[O-])F 274078a_100000210455_100000742752 [0,2,0,0,0,0|1,0,1]=4 1232 B19R2.8735 C=C(C)c1ccc(cc1)S(=O)(=O)N2CCCCC2 271570a_100000694244_100000164690 [1,0,0,1,0,0|2,0,0]=4 1233 B19R2.8735 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC2 1458a_100000488439_200000210301 [1,0,0,1,0,0|1,0,0]=3 1234 B19R2.8735 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOC2 274078a_100000131196_100000010689 [1,0,0,1,0,0|2,0,0]=4 1235 B19R2.8735 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOCC2 1458a_100000388658_200000210301 [1,0,0,1,0,0|2,0,0]=4 1236 B19R2.8735 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOCC2 270084a_100015191051_100000010689 [1,0,0,1,0,0|2,0,0]=4 1237 B19R2.8735 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOCC2 274078a_100015191051_100000010689 [1,0,0,1,0,0|2,0,0]=4 1238 B19R2.8735 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCSCC2 270084a_100000737611_100000010689 [1,0,0,1,0,0|2,0,0]=4 1239 B19R2.8735 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCSCC2 274078a_100000737611_100000010689 [1,0,0,1,0,0|2,0,0]=4 1240 B19R2.8735 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOC2 274078a_100000131196_100000231035 [1,0,0,1,0,0|2,0,0]=4 1241 B19R2.8735 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCOCC2 270084a_100015191051_100000231035 [1,0,0,1,0,0|2,0,0]=4 1242 B19R2.8735 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCOCC2 274078a_100015191051_100000231035 [1,0,0,1,0,0|2,0,0]=4 1243 B19R2.8735 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCSCC2 270084a_100000737611_100000231035 [1,0,0,1,0,0|2,0,0]=4 1244 B19R2.8735 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCSCC2 274078a_100000737611_100000231035 [1,0,0,1,0,0|2,0,0]=4 1245 B19R2.8735 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC=CCC2 270084a_100000698166_100000185021 [1,0,0,1,0,0|0,0,2]=4 1246 B19R2.8735 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC=CCC2 274078a_100000698166_100000185021 [1,0,0,1,0,0|0,0,2]=4 1247 B19R2.8735 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCOC2 274078a_100000131196_100000185021 [1,0,0,1,0,0|1,0,0]=3 1248 B19R2.8735 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCOCC2 270084a_100015191051_100000185021 [1,0,0,1,0,0|1,0,0]=3 1249 B19R2.8735 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCOCC2 274078a_100015191051_100000185021 [1,0,0,1,0,0|1,0,0]=3 1250 B19R2.8735 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCSCC2 270084a_100000737611_100000185021 [1,0,0,1,0,0|1,0,0]=3 1251 B19R2.8735 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCSCC2 274078a_100000737611_100000185021 [1,0,0,1,0,0|1,0,0]=3 1252 B19R2.8735 [13CH3]C(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC2 1458a_100000488439_200025704644 [1,0,0,1,0,0|1,0,0]=3 1253 B19R2.8735 [13CH3]C(=O)c1ccc(cc1)S(=O)(=O)N2CCOCC2 1458a_100000388658_200025704644 [1,0,0,1,0,0|2,0,0]=4 1254 B19R2.45102 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC(C2)O 270084a_100011215560_100000010689 [1,0,0,1,0,0|2,0,0]=4 1255 B19R2.45102 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC(C2)O 274078a_100011215560_100000010689 [1,0,0,1,0,0|2,0,0]=4 1256 B19R2.45102 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@@H](C2)F 270084a_100015203821_100000010689 [1,0,0,1,0,0|2,0,0]=4 1257 B19R2.45102 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@@H](C2)F 274078a_100015203821_100000010689 [1,0,0,1,0,0|2,0,0]=4 1258 B19R2.45102 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@H](C2)C 270084a_100016987628_100000010689 [1,0,0,1,0,0|1,0,0]=3 1259 B19R2.45102 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@H](C2)C 274078a_100016987628_100000010689 [1,0,0,1,0,0|1,0,0]=3 1260 B19R2.45102 C[C@@H]1CCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100016987628_100000231035 [1,0,0,1,0,0|1,0,0]=3 1261 B19R2.45102 C[C@@H]1CCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100016987628_100000231035 [1,0,0,1,0,0|1,0,0]=3 1262 B19R2.45102 C[C@@H]1CCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100016987628_100000185021 [1,0,0,1,0,0|0,0,0]=2 1263 B19R2.45102 C[C@@H]1CCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100016987628_100000185021 [1,0,0,1,0,0|0,0,0]=2 1264 B19R2.45102 C[C@@H]1CCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100016987628_100000209996 [1,0,0,1,0,0|1,0,1]=4 1265 B19R2.45102 C[C@@H]1CCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100016987628_100000209996 [1,0,0,1,0,0|1,0,1]=4 1266 B19R2.45102 C[C@@H]1CCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100016987628_100000032944 [1,0,0,1,0,0|1,0,1]=4 1267 B19R2.45102 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCC(C2)O 270084a_100011215560_100000231035 [1,0,0,1,0,0|2,0,0]=4 1268 B19R2.45102 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCC(C2)O 274078a_100011215560_100000231035 [1,0,0,1,0,0|2,0,0]=4 1269 B19R2.45102 NC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@@H](C2)F 270084a_100015203821_100000231035 [1,0,0,1,0,0|2,0,0]=4 1270 B19R2.45102 NC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@@H](C2)F 274078a_100015203821_100000231035 [1,0,0,1,0,0|2,0,0]=4 1271 B19R2.45102 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCC(C2)O 270084a_100011215560_100000185021 [1,0,0,1,0,0|1,0,0]=3 1272 B19R2.45102 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCC(C2)O 274078a_100011215560_100000185021 [1,0,0,1,0,0|1,0,0]=3 1273 B19R2.45102 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC[C@@H](C2)F 270084a_100015203821_100000185021 [1,0,0,1,0,0|1,0,0]=3 1274 B19R2.45102 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC[C@@H](C2)F 274078a_100015203821_100000185021 [1,0,0,1,0,0|1,0,0]=3 1275 B19R2.51820 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2C 270084a_100020605311_100000010689 [1,0,0,1,0,0|1,0,0]=3 1276 B19R2.51820 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2C 274078a_100020605311_100000010689 [1,0,0,1,0,0|1,0,0]=3 1277 B19R2.51820 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@H]2C 270084a_100015189458_100000010689 [1,0,0,1,0,0|1,0,0]=3 1278 B19R2.51820 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@H]2C 274078a_100015189458_100000010689 [1,0,0,1,0,0|1,0,0]=3 1279 B19R2.51820 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCSC2C 274078a_200011216479_100000010689 [1,0,0,1,0,0|2,0,0]=4 1280 B19R2.51820 CC1SCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_200011216479_100000231035 [1,0,0,1,0,0|2,0,0]=4 1281 B19R2.51820 CC1SCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_200011216479_100000185021 [1,0,0,1,0,0|1,0,0]=3 1282 B19R2.51820 C[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100015189458_100000231035 [1,0,0,1,0,0|1,0,0]=3 1283 B19R2.51820 C[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100015189458_100000231035 [1,0,0,1,0,0|1,0,0]=3 1284 B19R2.51820 C[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100015189458_100000185021 [1,0,0,1,0,0|0,0,0]=2 1285 B19R2.51820 C[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100015189458_100000185021 [1,0,0,1,0,0|0,0,0]=2 1286 B19R2.51820 C[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100015189458_100000209996 [1,0,0,1,0,0|1,0,1]=4 1287 B19R2.51820 C[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100015189458_100000209996 [1,0,0,1,0,0|1,0,1]=4 1288 B19R2.51820 C[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100015189458_100000032944 [1,0,0,1,0,0|1,0,1]=4 1289 B19R2.51820 C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100020605311_100000231035 [1,0,0,1,0,0|1,0,0]=3 1290 B19R2.51820 C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100020605311_100000231035 [1,0,0,1,0,0|1,0,0]=3 1291 B19R2.51820 C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100020605311_100000185021 [1,0,0,1,0,0|0,0,0]=2 1292 B19R2.51820 C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100020605311_100000185021 [1,0,0,1,0,0|0,0,0]=2 1293 B19R2.51820 C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100020605311_100000209996 [1,0,0,1,0,0|1,0,1]=4 1294 B19R2.51820 C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100020605311_100000209996 [1,0,0,1,0,0|1,0,1]=4 1295 B19R2.65021 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@@H]2C)O 270084a_206633788156_100000010689 [1,0,0,1,0,0|2,0,0]=4 1296 B19R2.65021 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@@H]2C)O 274078a_206633788156_100000010689 [1,0,0,1,0,0|2,0,0]=4 1297 B19R2.65021 C[C@H]1[C@H](CN1S(=O)(=O)c2ccc(cc2)C(=O)N)O 270084a_206633788156_100000231035 [1,0,0,1,0,0|2,0,0]=4 1298 B19R2.65021 C[C@H]1[C@H](CN1S(=O)(=O)c2ccc(cc2)C(=O)N)O 274078a_206633788156_100000231035 [1,0,0,1,0,0|2,0,0]=4 1299 B19R2.65021 C[C@H]1[C@H](CN1S(=O)(=O)c2ccc(cc2)C(=O)O)O 270084a_206633788156_100000185021 [1,0,0,1,0,0|1,0,0]=3 1300 B19R2.65021 C[C@H]1[C@H](CN1S(=O)(=O)c2ccc(cc2)C(=O)O)O 274078a_206633788156_100000185021 [1,0,0,1,0,0|1,0,0]=3 1301 B19R2.259774 CCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)C 270084a_100000738653_100000010689 [1,0,0,1,0,0|1,0,0]=3 1302 B19R2.259774 CCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)C 274078a_100000738653_100000010689 [1,0,0,1,0,0|1,0,0]=3 1303 B19R2.259774 CCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000738653_100000231035 [1,0,0,1,0,0|1,0,0]=3 1304 B19R2.259774 CCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000738653_100000231035 [1,0,0,1,0,0|1,0,0]=3 1305 B19R2.259774 CCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000738653_100000185021 [1,0,0,1,0,0|0,0,0]=2 1306 B19R2.259774 CCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000738653_100000185021 [1,0,0,1,0,0|0,0,0]=2 1307 B19R2.259774 CCN(C1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000738653_100000209996 [1,0,0,1,0,0|1,0,1]=4 1308 B19R2.259774 CCN(C1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000738653_100000209996 [1,0,0,1,0,0|1,0,1]=4 1309 B19R2.259774 CCN(C1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000738653_100000032944 [1,0,0,1,0,0|1,0,1]=4 1310 B19R2.65 C=Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000034458 [1,0,0,1,0,0|2,0,0]=4 1311 B19R2.65 C=Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000034458 [1,0,0,1,0,0|2,0,0]=4 1312 B19R2.65 C=Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000034458 [1,0,0,1,0,0|2,0,0]=4 1313 B19R2.65 C=Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000034458 [1,0,0,1,0,0|2,0,0]=4 1314 B19R2.65 C=Cc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 270084a_100000717927_100000034458 [1,0,0,1,0,0|1,0,0]=3 1315 B19R2.65 C=Cc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 274078a_100000717927_100000034458 [1,0,0,1,0,0|1,0,0]=3 1316 B19R2.65 C=Cc1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 270084a_100000729577_100000034458 [1,0,0,1,0,0|2,0,0]=4 1317 B19R2.65 C=Cc1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 274078a_100000729577_100000034458 [1,0,0,1,0,0|2,0,0]=4 1318 B19R2.65 CC1=CCCN(C1)S(=O)(=O)c2ccc(cc2)C=O 270084a_100000725631_100000045293 [1,0,0,1,0,0|0,0,2]=4 1319 B19R2.65 CC1=CCCN(C1)S(=O)(=O)c2ccc(cc2)C=O 274078a_100000725631_100000045293 [1,0,0,1,0,0|0,0,2]=4 1320 B19R2.65 CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)N[13CH3] 34a_100000595397_200025704644 [1,0,0,1,0,0|2,0,0]=4 1321 B19R2.65 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C=O 270084a_100000729577_100000045293 [1,0,0,1,0,0|1,0,0]=3 1322 B19R2.65 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C=O 274078a_100000729577_100000045293 [1,0,0,1,0,0|1,0,0]=3 1323 B19R2.65 CCc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 270084a_100000717927_100000212210 [1,0,0,1,0,0|1,0,1]=4 1324 B19R2.65 CCc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 274078a_100000717927_100000212210 [1,0,0,1,0,0|1,0,1]=4 1325 B19R2.65 CNc1ccc(cc1)S(=O)(=O)N2CCCC(C2)C 34a_100000595397_200000210301 [1,0,0,1,0,0|2,0,0]=4 1326 B19R2.65 COc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 270084a_100000717927_100000182833 [1,0,0,1,0,0|2,0,0]=4 1327 B19R2.65 COc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 274078a_100000717927_100000182833 [1,0,0,1,0,0|2,0,0]=4 1328 B19R2.65 CSc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 270084a_100000717927_100000747762 [1,0,0,1,0,0|2,0,0]=4 1329 B19R2.65 CSc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 274078a_100000717927_100000747762 [1,0,0,1,0,0|2,0,0]=4 1330 B19R2.65 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)C#N 270084a_100000717927_100000184514 [1,0,0,1,0,0|1,0,1]=4 1331 B19R2.65 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)C#N 274078a_100000717927_100000184514 [1,0,0,1,0,0|1,0,1]=4 1332 B19R2.65 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)C#N 40a_100000717927_100010740313 [1,0,0,1,0,0|1,0,1]=4 1333 B19R2.65 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)C=O 270084a_100000717927_100000045293 [1,0,0,1,0,0|0,0,0]=2 1334 B19R2.65 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)C=O 274078a_100000717927_100000045293 [1,0,0,1,0,0|0,0,0]=2 1335 B19R2.65 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)CBr 270084a_100000717927_100000763552 [1,0,0,1,0,0|1,0,1]=4 1336 B19R2.65 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)CBr 274078a_100000717927_100000763552 [1,0,0,1,0,0|1,0,1]=4 1337 B19R2.65 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)CBr 40a_100000717927_100011072442 [1,0,0,1,0,0|1,0,1]=4 1338 B19R2.65 O=Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000045293 [1,0,0,1,0,0|1,0,0]=3 1339 B19R2.65 O=Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000045293 [1,0,0,1,0,0|1,0,0]=3 1340 B19R2.65 O=Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000045293 [1,0,0,1,0,0|1,0,0]=3 1341 B19R2.65 O=Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000045293 [1,0,0,1,0,0|1,0,0]=3 1342 B19R2.65 O=Cc1ccc(cc1)S(=O)(=O)N2CCOC(C2)O 274078a_100000688207_100000045293 [1,0,0,1,0,0|2,0,0]=4 1343 B19R2.5013 C=Cc1ccc(cc1)S(=O)(=O)N2CCCC2CC 270084a_100000754278_100000034458 [1,0,0,1,0,0|1,0,0]=3 1344 B19R2.5013 C=Cc1ccc(cc1)S(=O)(=O)N2CCCC2CC 274078a_100000754278_100000034458 [1,0,0,1,0,0|1,0,0]=3 1345 B19R2.5013 C=Cc1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000034458 [1,0,0,1,0,0|2,0,0]=4 1346 B19R2.5013 C=Cc1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000034458 [1,0,0,1,0,0|2,0,0]=4 1347 B19R2.5013 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C=O 270084a_100000730860_100000045293 [1,0,0,1,0,0|0,0,2]=4 1348 B19R2.5013 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C=O 274078a_100000730860_100000045293 [1,0,0,1,0,0|0,0,2]=4 1349 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C#N 270084a_100000754278_100000184514 [1,0,0,1,0,0|1,0,1]=4 1350 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C#N 274078a_100000754278_100000184514 [1,0,0,1,0,0|1,0,1]=4 1351 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C#N 40a_100000754278_100010740313 [1,0,0,1,0,0|1,0,1]=4 1352 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C=O 270084a_100000754278_100000045293 [1,0,0,1,0,0|0,0,0]=2 1353 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C=O 274078a_100000754278_100000045293 [1,0,0,1,0,0|0,0,0]=2 1354 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)CBr 270084a_100000754278_100000763552 [1,0,0,1,0,0|1,0,1]=4 1355 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)CBr 274078a_100000754278_100000763552 [1,0,0,1,0,0|1,0,1]=4 1356 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)CBr 40a_100000754278_100011072442 [1,0,0,1,0,0|1,0,1]=4 1357 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)OC 270084a_100000754278_100000182833 [1,0,0,1,0,0|2,0,0]=4 1358 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)OC 274078a_100000754278_100000182833 [1,0,0,1,0,0|2,0,0]=4 1359 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)SC 270084a_100000754278_100000747762 [1,0,0,1,0,0|2,0,0]=4 1360 B19R2.5013 CCC1CCCN1S(=O)(=O)c2ccc(cc2)SC 274078a_100000754278_100000747762 [1,0,0,1,0,0|2,0,0]=4 1361 B19R2.5013 CCc1ccc(cc1)S(=O)(=O)N2CCCC2CC 270084a_100000754278_100000212210 [1,0,0,1,0,0|1,0,1]=4 1362 B19R2.5013 CCc1ccc(cc1)S(=O)(=O)N2CCCC2CC 274078a_100000754278_100000212210 [1,0,0,1,0,0|1,0,1]=4 1363 B19R2.5013 N#CC1CCCN1S(=O)(=O)c2ccc(cc2)C=O 274078a_100000701862_100000045293 [1,0,0,1,0,0|1,0,1]=4 1364 B19R2.5013 N#C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2)C=O 274078a_106645074975_100000045293 [1,0,0,1,0,0|1,0,1]=4 1365 B19R2.5013 O=Cc1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000045293 [1,0,0,1,0,0|1,0,0]=3 1366 B19R2.5013 O=Cc1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000045293 [1,0,0,1,0,0|1,0,0]=3 1367 B19R2.5015 C=Cc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 270084a_200015306588_100000034458 [1,0,0,1,0,0|2,0,0]=4 1368 B19R2.5015 C=Cc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 274078a_200015306588_100000034458 [1,0,0,1,0,0|2,0,0]=4 1369 B19R2.5015 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)C=O 270084a_200015306588_100000045293 [1,0,0,1,0,0|1,0,0]=3 1370 B19R2.5015 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)C=O 274078a_200015306588_100000045293 [1,0,0,1,0,0|1,0,0]=3 1371 B19R2.5015 O=Cc1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 270084a_100020590056_100000045293 [1,0,0,1,0,0|2,0,0]=4 1372 B19R2.5015 O=Cc1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 274078a_100020590056_100000045293 [1,0,0,1,0,0|2,0,0]=4 1373 B19R2.5015 O=Cc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 270084a_100103146936_100000045293 [1,0,0,1,0,0|2,0,0]=4 1374 B19R2.5015 O=Cc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 274078a_100103146936_100000045293 [1,0,0,1,0,0|2,0,0]=4 1375 B19R2.5015 O=Cc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 270084a_100015207562_100000045293 [1,0,0,1,0,0|2,0,0]=4 1376 B19R2.5015 O=Cc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 274078a_100015207562_100000045293 [1,0,0,1,0,0|2,0,0]=4 1377 B19R2.56194 C=Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000034458 [1,0,0,1,0,0|1,0,0]=3 1378 B19R2.56194 C=Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2 271570a_100011290941_200000254439 [1,0,0,1,0,0|1,0,0]=3 1379 B19R2.56194 C=Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000034458 [1,0,0,1,0,0|1,0,0]=3 1380 B19R2.56194 C=Cc1ccc(cc1)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000034458 [1,0,0,1,0,0|2,0,0]=4 1381 B19R2.56194 C=Cc1ccc(cc1)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000034458 [1,0,0,1,0,0|2,0,0]=4 1382 B19R2.56194 CCc1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000212210 [1,0,0,1,0,0|1,0,1]=4 1383 B19R2.56194 CCc1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000212210 [1,0,0,1,0,0|1,0,1]=4 1384 B19R2.56194 CNc1ccc(cc1)S(=O)(=O)N2CCCCCC2 34a_100000595301_200000210301 [1,0,0,1,0,0|2,0,0]=4 1385 B19R2.56194 CNc1ccc(cc1)S(=O)(=O)N2CCCCCC2 7a_100000595301_200000210301 [1,0,0,1,0,0|2,0,0]=4 1386 B19R2.56194 COc1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000182833 [1,0,0,1,0,0|2,0,0]=4 1387 B19R2.56194 COc1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000182833 [1,0,0,1,0,0|2,0,0]=4 1388 B19R2.56194 CSc1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000747762 [1,0,0,1,0,0|2,0,0]=4 1389 B19R2.56194 CSc1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000747762 [1,0,0,1,0,0|2,0,0]=4 1390 B19R2.56194 N#Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000184514 [1,0,0,1,0,0|1,0,1]=4 1391 B19R2.56194 N#Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000184514 [1,0,0,1,0,0|1,0,1]=4 1392 B19R2.56194 N#Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2 40a_100000185865_100010740313 [1,0,0,1,0,0|1,0,1]=4 1393 B19R2.56194 O=Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000045293 [1,0,0,1,0,0|0,0,0]=2 1394 B19R2.56194 O=Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000045293 [1,0,0,1,0,0|0,0,0]=2 1395 B19R2.56194 O=Cc1ccc(cc1)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000045293 [1,0,0,1,0,0|1,0,0]=3 1396 B19R2.56194 O=Cc1ccc(cc1)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000045293 [1,0,0,1,0,0|1,0,0]=3 1397 B19R2.56194 O=S(=O)(c1ccc(cc1)CBr)N2CCCCCC2 270084a_100000185865_100000763552 [1,0,0,1,0,0|1,0,1]=4 1398 B19R2.56194 O=S(=O)(c1ccc(cc1)CBr)N2CCCCCC2 274078a_100000185865_100000763552 [1,0,0,1,0,0|1,0,1]=4 1399 B19R2.56194 O=S(=O)(c1ccc(cc1)CBr)N2CCCCCC2 40a_100000185865_100011072442 [1,0,0,1,0,0|1,0,1]=4 1400 B19R2.56194 [13CH3]Nc1ccc(cc1)S(=O)(=O)N2CCCCCC2 34a_100000595301_200025704644 [1,0,0,1,0,0|2,0,0]=4 1401 B19R2.56194 [13CH3]Nc1ccc(cc1)S(=O)(=O)N2CCCCCC2 7a_100000595301_200025704644 [1,0,0,1,0,0|2,0,0]=4 1402 B19R2.508482 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)C2CC2 270084a_100000765834_100000034458 [1,0,0,1,0,0|1,0,0]=3 1403 B19R2.508482 C=Cc1ccc(cc1)S(=O)(=O)N(CCC)C2CC2 274078a_100000765834_100000034458 [1,0,0,1,0,0|1,0,0]=3 1404 B19R2.508482 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000034458 [1,0,0,1,0,0|2,0,0]=4 1405 B19R2.508482 C=Cc1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000034458 [1,0,0,1,0,0|2,0,0]=4 1406 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C#N 270084a_100000765834_100000184514 [1,0,0,1,0,0|1,0,1]=4 1407 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C#N 274078a_100000765834_100000184514 [1,0,0,1,0,0|1,0,1]=4 1408 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C#N 40a_100000765834_100010740313 [1,0,0,1,0,0|1,0,1]=4 1409 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C=O 270084a_100000765834_100000045293 [1,0,0,1,0,0|0,0,0]=2 1410 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C=O 274078a_100000765834_100000045293 [1,0,0,1,0,0|0,0,0]=2 1411 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)CBr 270084a_100000765834_100000763552 [1,0,0,1,0,0|1,0,1]=4 1412 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)CBr 274078a_100000765834_100000763552 [1,0,0,1,0,0|1,0,1]=4 1413 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)CBr 40a_100000765834_100011072442 [1,0,0,1,0,0|1,0,1]=4 1414 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)CC 270084a_100000765834_100000212210 [1,0,0,1,0,0|1,0,1]=4 1415 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)CC 274078a_100000765834_100000212210 [1,0,0,1,0,0|1,0,1]=4 1416 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)OC 270084a_100000765834_100000182833 [1,0,0,1,0,0|2,0,0]=4 1417 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)OC 274078a_100000765834_100000182833 [1,0,0,1,0,0|2,0,0]=4 1418 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)SC 270084a_100000765834_100000747762 [1,0,0,1,0,0|2,0,0]=4 1419 B19R2.508482 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)SC 274078a_100000765834_100000747762 [1,0,0,1,0,0|2,0,0]=4 1420 B19R2.508482 O=Cc1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000045293 [1,0,0,1,0,0|1,0,0]=3 1421 B19R2.508482 O=Cc1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000045293 [1,0,0,1,0,0|1,0,0]=3 1422 B19R2.30945 CCC1CCCN1C(=O)c2ccc(cc2)C(=O)N 11a_100000754278_100000230133 [1,0,0,1,0,0|2,0,0]=4 1423 B19R2.30945 CCC1CCCN1C(=O)c2ccc(cc2)C(=O)N 1626a_100000754278_100000230133 [1,0,0,1,0,0|2,0,0]=4 1424 B19R2.30945 CCC1CCCN1C(=O)c2ccc(cc2)C(=O)N 240690a_100000754278_100000230133 [1,0,0,1,0,0|2,0,0]=4 1425 B19R2.101221 C[C@H]1CCCN(C1)C(=O)c2ccc(cc2)C(=O)N 11a_100000717927_100000230133 [1,0,0,1,0,0|2,0,0]=4 1426 B19R2.101221 C[C@H]1CCCN(C1)C(=O)c2ccc(cc2)C(=O)N 240690a_100000717927_100000230133 [1,0,0,1,0,0|2,0,0]=4 1427 B19R2.508327 CCCN(C(=O)c1ccc(cc1)C(=O)N)C2CC2 11a_100000765834_100000230133 [1,0,0,1,0,0|2,0,0]=4 1428 B19R2.508327 CCCN(C(=O)c1ccc(cc1)C(=O)N)C2CC2 1626a_100000765834_100000230133 [1,0,0,1,0,0|2,0,0]=4 1429 B19R2.508327 CCCN(C(=O)c1ccc(cc1)C(=O)N)C2CC2 240690a_100000765834_100000230133 [1,0,0,1,0,0|2,0,0]=4 1430 B19R2.1020382 NC(=O)c1ccc(cc1)C(=O)N2CCCCCC2 11a_100000185865_100000230133 [1,0,0,1,0,0|2,0,0]=4 1431 B19R2.1020382 NC(=O)c1ccc(cc1)C(=O)N2CCCCCC2 1626a_100000185865_100000230133 [1,0,0,1,0,0|2,0,0]=4 1432 B19R2.1020382 NC(=O)c1ccc(cc1)C(=O)N2CCCCCC2 240690a_100000185865_100000230133 [1,0,0,1,0,0|2,0,0]=4 1433 B21R2.66468 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000210752 [0,0,0,1,0,1|2,0,0]=4 1434 B21R2.66468 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000210752 [0,0,0,1,0,1|2,0,0]=4 1435 B21R2.66468 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 40a_100000745186_100000700920 [0,0,0,1,0,1|2,0,0]=4 1436 B21R2.66468 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)CC(=O)O 270084a_100000730860_100000740367 [0,0,0,1,0,1|0,0,2]=4 1437 B21R2.66468 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)CC(=O)O 274078a_100000730860_100000740367 [0,0,0,1,0,1|0,0,2]=4 1438 B21R2.66468 CCC1CCCN1S(=O)(=O)c2ccc(cc2)CC(=O)O 270084a_100000754278_100000740367 [0,0,0,1,0,1|0,0,0]=2 1439 B21R2.66468 CCC1CCCN1S(=O)(=O)c2ccc(cc2)CC(=O)O 274078a_100000754278_100000740367 [0,0,0,1,0,1|0,0,0]=2 1440 B21R2.66468 CCC1CCCN1S(=O)(=O)c2ccc(cc2)NC(=O)C 270084a_100000754278_100000210752 [0,0,0,1,0,1|1,0,0]=3 1441 B21R2.66468 CCC1CCCN1S(=O)(=O)c2ccc(cc2)NC(=O)C 274078a_100000754278_100000210752 [0,0,0,1,0,1|1,0,0]=3 1442 B21R2.66468 CCC1CCCN1S(=O)(=O)c2ccc(cc2)NC(=O)C 40a_100000754278_100000700920 [0,0,0,1,0,1|1,0,0]=3 1443 B21R2.66468 N#CC1CCCN1S(=O)(=O)c2ccc(cc2)CC(=O)O 274078a_100000701862_100000740367 [0,0,0,1,0,1|1,0,1]=4 1444 B21R2.66468 N#C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2)CC(=O)O 274078a_106645074975_100000740367 [0,0,0,1,0,1|1,0,1]=4 1445 B21R2.66468 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000740367 [0,0,0,1,0,1|1,0,0]=3 1446 B21R2.66468 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000740367 [0,0,0,1,0,1|1,0,0]=3 1447 B21R2.99597 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 270084a_200015306588_100000210752 [0,0,0,1,0,1|2,0,0]=4 1448 B21R2.99597 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 274078a_200015306588_100000210752 [0,0,0,1,0,1|2,0,0]=4 1449 B21R2.99597 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 40a_200015306588_100000700920 [0,0,0,1,0,1|2,0,0]=4 1450 B21R2.99597 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)CC(=O)O 270084a_200015306588_100000740367 [0,0,0,1,0,1|1,0,0]=3 1451 B21R2.99597 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2)CC(=O)O 274078a_200015306588_100000740367 [0,0,0,1,0,1|1,0,0]=3 1452 B21R2.99597 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 270084a_100020590056_100000740367 [0,0,0,1,0,1|2,0,0]=4 1453 B21R2.99597 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 274078a_100020590056_100000740367 [0,0,0,1,0,1|2,0,0]=4 1454 B21R2.99597 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 270084a_100103146936_100000740367 [0,0,0,1,0,1|2,0,0]=4 1455 B21R2.99597 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 274078a_100103146936_100000740367 [0,0,0,1,0,1|2,0,0]=4 1456 B21R2.99597 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 270084a_100015207562_100000740367 [0,0,0,1,0,1|2,0,0]=4 1457 B21R2.99597 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 274078a_100015207562_100000740367 [0,0,0,1,0,1|2,0,0]=4 1458 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(C2)C 11a_100000595397_100015343762 [0,0,0,1,0,1|1,0,0]=3 1459 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(C2)C 1626a_100000595397_100015343762 [0,0,0,1,0,1|1,0,0]=3 1460 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(C2)C 22a_100000595397_100000070787 [0,0,0,1,0,1|1,0,0]=3 1461 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000210752 [0,0,0,1,0,1|2,0,0]=4 1462 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000210752 [0,0,0,1,0,1|2,0,0]=4 1463 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 40a_100000697950_100000700920 [0,0,0,1,0,1|2,0,0]=4 1464 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000210752 [0,0,0,1,0,1|2,0,0]=4 1465 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000210752 [0,0,0,1,0,1|2,0,0]=4 1466 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 40a_100000211013_100000700920 [0,0,0,1,0,1|2,0,0]=4 1467 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 270084a_100000717927_100000210752 [0,0,0,1,0,1|1,0,0]=3 1468 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 274078a_100000717927_100000210752 [0,0,0,1,0,1|1,0,0]=3 1469 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 40a_100000717927_100000700920 [0,0,0,1,0,1|1,0,0]=3 1470 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 270084a_100000729577_100000210752 [0,0,0,1,0,1|2,0,0]=4 1471 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 274078a_100000729577_100000210752 [0,0,0,1,0,1|2,0,0]=4 1472 B21R2.222656 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 40a_100000729577_100000700920 [0,0,0,1,0,1|2,0,0]=4 1473 B21R2.222656 CC1=CCCN(C1)S(=O)(=O)c2ccc(cc2)CC(=O)O 270084a_100000725631_100000740367 [0,0,0,1,0,1|0,0,2]=4 1474 B21R2.222656 CC1=CCCN(C1)S(=O)(=O)c2ccc(cc2)CC(=O)O 274078a_100000725631_100000740367 [0,0,0,1,0,1|0,0,2]=4 1475 B21R2.222656 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)CC(=O)O 270084a_100000729577_100000740367 [0,0,0,1,0,1|1,0,0]=3 1476 B21R2.222656 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)CC(=O)O 274078a_100000729577_100000740367 [0,0,0,1,0,1|1,0,0]=3 1477 B21R2.222656 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)CC(=O)O 270084a_100000717927_100000740367 [0,0,0,1,0,1|0,0,0]=2 1478 B21R2.222656 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)CC(=O)O 274078a_100000717927_100000740367 [0,0,0,1,0,1|0,0,0]=2 1479 B21R2.222656 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000740367 [0,0,0,1,0,1|1,0,0]=3 1480 B21R2.222656 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000740367 [0,0,0,1,0,1|1,0,0]=3 1481 B21R2.222656 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000740367 [0,0,0,1,0,1|1,0,0]=3 1482 B21R2.222656 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000740367 [0,0,0,1,0,1|1,0,0]=3 1483 B21R2.222656 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCOC(C2)O 274078a_100000688207_100000740367 [0,0,0,1,0,1|2,0,0]=4 1484 B21R2.1108004 CC(=Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2)C 271570a_100102525489_200000254439 [0,0,0,1,0,1|2,0,0]=4 1485 B21R2.1108004 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCCCC2 11a_100000595301_100015343762 [0,0,0,1,0,1|1,0,0]=3 1486 B21R2.1108004 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCCCC2 1626a_100000595301_100015343762 [0,0,0,1,0,1|1,0,0]=3 1487 B21R2.1108004 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCCCC2 22a_100000595301_100000070787 [0,0,0,1,0,1|1,0,0]=3 1488 B21R2.1108004 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000210752 [0,0,0,1,0,1|1,0,0]=3 1489 B21R2.1108004 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000210752 [0,0,0,1,0,1|1,0,0]=3 1490 B21R2.1108004 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCCCC2 40a_100000185865_100000700920 [0,0,0,1,0,1|1,0,0]=3 1491 B21R2.1108004 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000210752 [0,0,0,1,0,1|2,0,0]=4 1492 B21R2.1108004 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000210752 [0,0,0,1,0,1|2,0,0]=4 1493 B21R2.1108004 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCOCC2 40a_100000685342_100000700920 [0,0,0,1,0,1|2,0,0]=4 1494 B21R2.1108004 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000740367 [0,0,0,1,0,1|0,0,0]=2 1495 B21R2.1108004 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000740367 [0,0,0,1,0,1|0,0,0]=2 1496 B21R2.1108004 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000740367 [0,0,0,1,0,1|1,0,0]=3 1497 B21R2.1108004 O=C(O)Cc1ccc(cc1)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000740367 [0,0,0,1,0,1|1,0,0]=3 1498 B21R2.2164879 CCCN(CCC)S(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1 270084a_100000210455_100000183317 [0,0,0,1,0,1|1,0,0]=3 1499 B21R2.2164879 CCCN(CCC)S(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1 274078a_100000210455_100000183317 [0,0,0,1,0,1|1,0,0]=3 1500 B21R2.2164879 CCCN(CCC)S(=O)(=O)c1ccc2[nH]c(=O)oc2c1 270084a_100000210455_100000189695 [0,0,0,1,0,1|0,0,0]=2 1501 B21R2.2164879 CCCN(CCC)S(=O)(=O)c1ccc2[nH]c(=O)oc2c1 274078a_100000210455_100000189695 [0,0,0,1,0,1|0,0,0]=2 1502 B21R2.2164879 CCCN(CCC)S(=O)(=O)c1ccc2c(c1)CC(=O)N2 270084a_100000210455_100000203811 [0,0,0,1,0,1|1,0,0]=3 1503 B21R2.2164879 CCCN(CCC)S(=O)(=O)c1ccc2c(c1)CC(=O)N2 274078a_100000210455_100000203811 [0,0,0,1,0,1|1,0,0]=3 1504 B21R2.2164879 CCCN(CCC)S(=O)(=O)c1ccc2nc(sc2c1)C 270084a_100000210455_100000051228 [0,0,0,1,0,1|1,1,0]=4 1505 B21R2.2164879 CCCN(CCC)S(=O)(=O)c1ccc2nc(sc2c1)C 274078a_100000210455_100000051228 [0,0,0,1,0,1|1,1,0]=4 1506 B21R2.2164879 CCCN(CCC)S(=O)(=O)c1ccc2oc(=O)[nH]c2c1 270084a_100000210455_100000010527 [0,0,0,1,0,1|1,0,0]=3 1507 B21R2.2164879 CCCN(CCC)S(=O)(=O)c1ccc2oc(=O)[nH]c2c1 274078a_100000210455_100000010527 [0,0,0,1,0,1|1,0,0]=3 1508 B21R2.2164879 CCCN(CCO)S(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1 270084a_100000211420_100000183317 [0,0,0,1,0,1|2,0,0]=4 1509 B21R2.2164879 CCCN(CCO)S(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1 274078a_100000211420_100000183317 [0,0,0,1,0,1|2,0,0]=4 1510 B21R2.2164879 CCCN(CCO)S(=O)(=O)c1ccc2[nH]c(=O)oc2c1 270084a_100000211420_100000189695 [0,0,0,1,0,1|1,0,0]=3 1511 B21R2.2164879 CCCN(CCO)S(=O)(=O)c1ccc2[nH]c(=O)oc2c1 274078a_100000211420_100000189695 [0,0,0,1,0,1|1,0,0]=3 1512 B21R2.2164879 CCCN(CCO)S(=O)(=O)c1ccc2c(c1)CC(=O)N2 270084a_100000211420_100000203811 [0,0,0,1,0,1|2,0,0]=4 1513 B21R2.2164879 CCCN(CCO)S(=O)(=O)c1ccc2c(c1)CC(=O)N2 274078a_100000211420_100000203811 [0,0,0,1,0,1|2,0,0]=4 1514 B21R2.2164879 CCCN(CCO)S(=O)(=O)c1ccc2oc(=O)[nH]c2c1 270084a_100000211420_100000010527 [0,0,0,1,0,1|2,0,0]=4 1515 B21R2.2164879 CCCN(CCO)S(=O)(=O)c1ccc2oc(=O)[nH]c2c1 274078a_100000211420_100000010527 [0,0,0,1,0,1|2,0,0]=4 1516 B21R2.2164879 O=c1[nH]c2ccc(cc2o1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000189695 [0,0,0,1,0,1|2,0,0]=4 1517 B21R2.2164879 O=c1[nH]c2ccc(cc2o1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000189695 [0,0,0,1,0,1|2,0,0]=4 1518 B21R2.3292152 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000210752 [0,0,0,1,0,1|2,0,0]=4 1519 B21R2.3292152 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000210752 [0,0,0,1,0,1|2,0,0]=4 1520 B21R2.3292152 CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 40a_100000738766_100000700920 [0,0,0,1,0,1|2,0,0]=4 1521 B21R2.3292152 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)CC(=O)O 270084a_100000765834_100000740367 [0,0,0,1,0,1|0,0,0]=2 1522 B21R2.3292152 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)CC(=O)O 274078a_100000765834_100000740367 [0,0,0,1,0,1|0,0,0]=2 1523 B21R2.3292152 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)NC(=O)C 270084a_100000765834_100000210752 [0,0,0,1,0,1|1,0,0]=3 1524 B21R2.3292152 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)NC(=O)C 274078a_100000765834_100000210752 [0,0,0,1,0,1|1,0,0]=3 1525 B21R2.3292152 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)NC(=O)C 40a_100000765834_100000700920 [0,0,0,1,0,1|1,0,0]=3 1526 B21R2.3292152 O=C(O)Cc1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000740367 [0,0,0,1,0,1|1,0,0]=3 1527 B21R2.3292152 O=C(O)Cc1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000740367 [0,0,0,1,0,1|1,0,0]=3 1528 B21R2.103784 CC(=O)c1ccc(cc1)S(=O)(=O)NC2CCCC(C2)C 270084a_100011194320_100000010689 [0,0,0,1,0,1|2,0,0]=4 1529 B21R2.103784 CC(=O)c1ccc(cc1)S(=O)(=O)NC2CCCC(C2)C 274078a_100011194320_100000010689 [0,0,0,1,0,1|2,0,0]=4 1530 B21R2.103784 CC1CCCC(C1)NS(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100011194320_100000231035 [0,0,0,1,0,1|2,0,0]=4 1531 B21R2.103784 CC1CCCC(C1)NS(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100011194320_100000231035 [0,0,0,1,0,1|2,0,0]=4 1532 B21R2.103784 CC1CCCC(C1)NS(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100011194320_100000185021 [0,0,0,1,0,1|1,0,0]=3 1533 B21R2.103784 CC1CCCC(C1)NS(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100011194320_100000185021 [0,0,0,1,0,1|1,0,0]=3 1534 B21R2.103784 CN1CCC[C@@H](C1)NS(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100016992120_100000185021 [0,0,0,1,0,1|2,0,0]=4 1535 B21R2.103784 CN1CCC[C@@H](C1)NS(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100016992120_100000185021 [0,0,0,1,0,1|2,0,0]=4 1536 B21R2.103784 O=C(O)c1ccc(cc1)S(=O)(=O)NC2CCCC(C2)O 270084a_100015190357_100000185021 [0,0,0,1,0,1|2,0,0]=4 1537 B21R2.103784 O=C(O)c1ccc(cc1)S(=O)(=O)NC2CCCC(C2)O 274078a_100015190357_100000185021 [0,0,0,1,0,1|2,0,0]=4 1538 B21R2.281680 COC[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100020646714_100000185021 [0,0,0,1,0,1|2,0,0]=4 1539 B21R2.281680 COC[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100020646714_100000185021 [0,0,0,1,0,1|2,0,0]=4 1540 B21R2.4803269 CC(=O)c1ccc(cc1)S(=O)(=O)NC2CCCCCC2 270084a_100000210984_100000010689 [0,0,0,1,0,1|2,0,0]=4 1541 B21R2.4803269 CC(=O)c1ccc(cc1)S(=O)(=O)NC2CCCCCC2 274078a_100000210984_100000010689 [0,0,0,1,0,1|2,0,0]=4 1542 B21R2.4803269 NC(=O)c1ccc(cc1)S(=O)(=O)NC2CCCCCC2 270084a_100000210984_100000231035 [0,0,0,1,0,1|2,0,0]=4 1543 B21R2.4803269 NC(=O)c1ccc(cc1)S(=O)(=O)NC2CCCCCC2 274078a_100000210984_100000231035 [0,0,0,1,0,1|2,0,0]=4 1544 B21R2.4803269 O=C(O)c1ccc(cc1)S(=O)(=O)NC2CCCCCC2 270084a_100000210984_100000185021 [0,0,0,1,0,1|1,0,0]=3 1545 B21R2.4803269 O=C(O)c1ccc(cc1)S(=O)(=O)NC2CCCCCC2 274078a_100000210984_100000185021 [0,0,0,1,0,1|1,0,0]=3 1546 B21R2.66478 CCC1CCCN1S(=O)(=O)Cc2ccc(cc2)[N+](=O)[O-] 270084a_100000754278_100000735625 [0,0,0,1,0,1|1,0,1]=4 1547 B21R2.66478 CCC1CCCN1S(=O)(=O)Cc2ccc(cc2)[N+](=O)[O-] 274078a_100000754278_100000735625 [0,0,0,1,0,1|1,0,1]=4 1548 B21R2.66478 CCC1CCCN1S(=O)(=O)Cc2ccc(cc2)[N+](=O)[O-] 40a_100000754278_100015196453 [0,0,0,1,0,1|1,0,1]=4 1549 B21R2.222659 C[C@H]1CCCN(C1)S(=O)(=O)Cc2ccc(cc2)[N+](=O)[O-] 270084a_100000717927_100000735625 [0,0,0,1,0,1|1,0,1]=4 1550 B21R2.222659 C[C@H]1CCCN(C1)S(=O)(=O)Cc2ccc(cc2)[N+](=O)[O-] 274078a_100000717927_100000735625 [0,0,0,1,0,1|1,0,1]=4 1551 B21R2.222659 C[C@H]1CCCN(C1)S(=O)(=O)Cc2ccc(cc2)[N+](=O)[O-] 40a_100000717927_100015196453 [0,0,0,1,0,1|1,0,1]=4 1552 B21R2.3292154 CCCN(C1CC1)S(=O)(=O)Cc2ccc(cc2)[N+](=O)[O-] 270084a_100000765834_100000735625 [0,0,0,1,0,1|1,0,1]=4 1553 B21R2.3292154 CCCN(C1CC1)S(=O)(=O)Cc2ccc(cc2)[N+](=O)[O-] 274078a_100000765834_100000735625 [0,0,0,1,0,1|1,0,1]=4 1554 B21R2.3292154 CCCN(C1CC1)S(=O)(=O)Cc2ccc(cc2)[N+](=O)[O-] 40a_100000765834_100015196453 [0,0,0,1,0,1|1,0,1]=4 1555 B21R2.4803572 O=[N+]([O-])c1ccc(cc1)CS(=O)(=O)N2CCCCCC2 270084a_100000185865_100000735625 [0,0,0,1,0,1|1,0,1]=4 1556 B21R2.4803572 O=[N+]([O-])c1ccc(cc1)CS(=O)(=O)N2CCCCCC2 274078a_100000185865_100000735625 [0,0,0,1,0,1|1,0,1]=4 1557 B21R2.4803572 O=[N+]([O-])c1ccc(cc1)CS(=O)(=O)N2CCCCCC2 40a_100000185865_100015196453 [0,0,0,1,0,1|1,0,1]=4 1558 B21R2.20572 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000222204 [0,1,0,1,0,0|2,0,0]=4 1559 B21R2.20572 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000222204 [0,1,0,1,0,0|2,0,0]=4 1560 B21R2.20572 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000222204 [0,1,0,1,0,0|2,0,0]=4 1561 B21R2.20572 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000222204 [0,1,0,1,0,0|2,0,0]=4 1562 B21R2.20572 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 270084a_100000717927_100000222204 [0,1,0,1,0,0|1,0,0]=3 1563 B21R2.20572 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 274078a_100000717927_100000222204 [0,1,0,1,0,0|1,0,0]=3 1564 B21R2.20572 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 270084a_100000729577_100000222204 [0,1,0,1,0,0|2,0,0]=4 1565 B21R2.20572 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 274078a_100000729577_100000222204 [0,1,0,1,0,0|2,0,0]=4 1566 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCC=C(C2)C 270084a_100000725631_100000217497 [0,1,0,1,0,0|0,0,2]=4 1567 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCC=C(C2)C 274078a_100000725631_100000217497 [0,1,0,1,0,0|0,0,2]=4 1568 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCC=C(C2)C 40a_100000725631_100015196439 [0,1,0,1,0,0|0,0,2]=4 1569 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000217497 [0,1,0,1,0,0|1,0,0]=3 1570 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000217497 [0,1,0,1,0,0|1,0,0]=3 1571 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)F 40a_100000697950_100015196439 [0,1,0,1,0,0|1,0,0]=3 1572 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000217497 [0,1,0,1,0,0|1,0,0]=3 1573 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000217497 [0,1,0,1,0,0|1,0,0]=3 1574 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)O 40a_100000211013_100015196439 [0,1,0,1,0,0|1,0,0]=3 1575 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 270084a_100000717927_100000217497 [0,1,0,1,0,0|0,0,0]=2 1576 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 274078a_100000717927_100000217497 [0,1,0,1,0,0|0,0,0]=2 1577 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H](C2)C 40a_100000717927_100015196439 [0,1,0,1,0,0|0,0,0]=2 1578 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 270084a_100000729577_100000217497 [0,1,0,1,0,0|1,0,0]=3 1579 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 274078a_100000729577_100000217497 [0,1,0,1,0,0|1,0,0]=3 1580 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)C 40a_100000729577_100015196439 [0,1,0,1,0,0|1,0,0]=3 1581 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)O 274078a_100000688207_100000217497 [0,1,0,1,0,0|2,0,0]=4 1582 B21R2.20572 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)O 40a_100000688207_100015196439 [0,1,0,1,0,0|2,0,0]=4 1583 B21R2.66465 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C(=O)OC 270084a_100000730860_100000217497 [0,1,0,1,0,0|0,0,2]=4 1584 B21R2.66465 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C(=O)OC 274078a_100000730860_100000217497 [0,1,0,1,0,0|0,0,2]=4 1585 B21R2.66465 CCC1C=CCN1S(=O)(=O)c2ccc(cc2)C(=O)OC 40a_100000730860_100015196439 [0,1,0,1,0,0|0,0,2]=4 1586 B21R2.66465 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)NC 270084a_100000754278_100000222204 [0,1,0,1,0,0|1,0,0]=3 1587 B21R2.66465 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)NC 274078a_100000754278_100000222204 [0,1,0,1,0,0|1,0,0]=3 1588 B21R2.66465 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)OC 270084a_100000754278_100000217497 [0,1,0,1,0,0|0,0,0]=2 1589 B21R2.66465 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)OC 274078a_100000754278_100000217497 [0,1,0,1,0,0|0,0,0]=2 1590 B21R2.66465 CCC1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)OC 40a_100000754278_100015196439 [0,1,0,1,0,0|0,0,0]=2 1591 B21R2.66465 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000222204 [0,1,0,1,0,0|2,0,0]=4 1592 B21R2.66465 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000222204 [0,1,0,1,0,0|2,0,0]=4 1593 B21R2.66465 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC2C#N 274078a_100000701862_100000217497 [0,1,0,1,0,0|1,0,1]=4 1594 B21R2.66465 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC2C#N 40a_100000701862_100015196439 [0,1,0,1,0,0|1,0,1]=4 1595 B21R2.66465 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2C#N 274078a_106645074975_100000217497 [0,1,0,1,0,0|1,0,1]=4 1596 B21R2.66465 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000217497 [0,1,0,1,0,0|1,0,0]=3 1597 B21R2.66465 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000217497 [0,1,0,1,0,0|1,0,0]=3 1598 B21R2.66465 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@H]2CO 40a_100000745186_100015196439 [0,1,0,1,0,0|1,0,0]=3 1599 B21R2.372981 CNC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 270084a_200015306588_100000222204 [0,1,0,1,0,0|2,0,0]=4 1600 B21R2.372981 CNC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 274078a_200015306588_100000222204 [0,1,0,1,0,0|2,0,0]=4 1601 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 270084a_100020590056_100000217497 [0,1,0,1,0,0|2,0,0]=4 1602 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 274078a_100020590056_100000217497 [0,1,0,1,0,0|2,0,0]=4 1603 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 40a_100020590056_100015196439 [0,1,0,1,0,0|2,0,0]=4 1604 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 270084a_100103146936_100000217497 [0,1,0,1,0,0|2,0,0]=4 1605 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 274078a_100103146936_100000217497 [0,1,0,1,0,0|2,0,0]=4 1606 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 40a_100103146936_100015196439 [0,1,0,1,0,0|2,0,0]=4 1607 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 270084a_200015306588_100000217497 [0,1,0,1,0,0|1,0,0]=3 1608 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 274078a_200015306588_100000217497 [0,1,0,1,0,0|1,0,0]=3 1609 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)C 40a_200015306588_100015196439 [0,1,0,1,0,0|1,0,0]=3 1610 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 270084a_100015207562_100000217497 [0,1,0,1,0,0|2,0,0]=4 1611 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 274078a_100015207562_100000217497 [0,1,0,1,0,0|2,0,0]=4 1612 B21R2.372981 COC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 40a_100015207562_100015196439 [0,1,0,1,0,0|2,0,0]=4 1613 B21R2.858132 CCC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 1458a_100000488440_100000210202 [0,1,0,1,0,0|1,0,0]=3 1614 B21R2.858132 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 11a_106832991635_100000488440 [0,1,0,1,0,0|1,0,0]=3 1615 B21R2.858132 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 1626a_100102657272_100000488440 [0,1,0,1,0,0|1,0,0]=3 1616 B21R2.858132 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 240690a_100102657272_100000488440 [0,1,0,1,0,0|1,0,0]=3 1617 B21R2.858132 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000222204 [0,1,0,1,0,0|1,0,0]=3 1618 B21R2.858132 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000222204 [0,1,0,1,0,0|1,0,0]=3 1619 B21R2.858132 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 527a_100102657272_100000488440 [0,1,0,1,0,0|1,0,0]=3 1620 B21R2.858132 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000222204 [0,1,0,1,0,0|2,0,0]=4 1621 B21R2.858132 CNC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000222204 [0,1,0,1,0,0|2,0,0]=4 1622 B21R2.858132 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000217497 [0,1,0,1,0,0|0,0,0]=2 1623 B21R2.858132 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000217497 [0,1,0,1,0,0|0,0,0]=2 1624 B21R2.858132 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 40a_100000185865_100015196439 [0,1,0,1,0,0|0,0,0]=2 1625 B21R2.858132 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000217497 [0,1,0,1,0,0|1,0,0]=3 1626 B21R2.858132 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000217497 [0,1,0,1,0,0|1,0,0]=3 1627 B21R2.858132 COC(=O)c1ccc(cc1)S(=O)(=O)N2CCCOCC2 40a_100000685342_100015196439 [0,1,0,1,0,0|1,0,0]=3 1628 B21R2.858132 O=C(CF)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 1458a_100000488440_100015361967 [0,1,0,1,0,0|1,0,0]=3 1629 B21R2.3292149 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)NC 270084a_100000765834_100000222204 [0,1,0,1,0,0|1,0,0]=3 1630 B21R2.3292149 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)NC 274078a_100000765834_100000222204 [0,1,0,1,0,0|1,0,0]=3 1631 B21R2.3292149 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)OC 270084a_100000765834_100000217497 [0,1,0,1,0,0|0,0,0]=2 1632 B21R2.3292149 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)OC 274078a_100000765834_100000217497 [0,1,0,1,0,0|0,0,0]=2 1633 B21R2.3292149 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)OC 40a_100000765834_100015196439 [0,1,0,1,0,0|0,0,0]=2 1634 B21R2.3292149 CNC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000222204 [0,1,0,1,0,0|2,0,0]=4 1635 B21R2.3292149 CNC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000222204 [0,1,0,1,0,0|2,0,0]=4 1636 B21R2.3292149 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000217497 [0,1,0,1,0,0|1,0,0]=3 1637 B21R2.3292149 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000217497 [0,1,0,1,0,0|1,0,0]=3 1638 B21R2.3292149 COC(=O)c1ccc(cc1)S(=O)(=O)N(CCO)C2CC2 40a_100000738766_100015196439 [0,1,0,1,0,0|1,0,0]=3 1639 B21R2.66466 CCC1CCCN1S(=O)(=O)c2ccc(cc2)S(=O)(=O)C 270084a_100000754278_100000735899 [0,1,0,1,0,0|1,0,1]=4 1640 B21R2.66466 CCC1CCCN1S(=O)(=O)c2ccc(cc2)S(=O)(=O)C 274078a_100000754278_100000735899 [0,1,0,1,0,0|1,0,1]=4 1641 B21R2.66466 CCC1CCCN1S(=O)(=O)c2ccc(cc2)S(=O)(=O)N 270084a_100000754278_200000215108 [0,1,0,1,0,0|1,0,1]=4 1642 B21R2.66466 CCC1CCCN1S(=O)(=O)c2ccc(cc2)S(=O)(=O)N 274078a_100000754278_200000215108 [0,1,0,1,0,0|1,0,1]=4 1643 B21R2.222654 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)C 270084a_100000717927_100000735899 [0,1,0,1,0,0|1,0,1]=4 1644 B21R2.222654 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)C 274078a_100000717927_100000735899 [0,1,0,1,0,0|1,0,1]=4 1645 B21R2.222654 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)N 270084a_100000717927_200000215108 [0,1,0,1,0,0|1,0,1]=4 1646 B21R2.222654 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)N 274078a_100000717927_200000215108 [0,1,0,1,0,0|1,0,1]=4 1647 B21R2.3292150 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)C 270084a_100000765834_100000735899 [0,1,0,1,0,0|1,0,1]=4 1648 B21R2.3292150 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)C 274078a_100000765834_100000735899 [0,1,0,1,0,0|1,0,1]=4 1649 B21R2.3292150 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)N 270084a_100000765834_200000215108 [0,1,0,1,0,0|1,0,1]=4 1650 B21R2.3292150 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)N 274078a_100000765834_200000215108 [0,1,0,1,0,0|1,0,1]=4 1651 B21R2.7979606 CS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000735899 [0,1,0,1,0,0|1,0,1]=4 1652 B21R2.7979606 CS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000735899 [0,1,0,1,0,0|1,0,1]=4 1653 B21R2.7979606 NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 270084a_100000185865_200000215108 [0,1,0,1,0,0|1,0,1]=4 1654 B21R2.7979606 NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2 274078a_100000185865_200000215108 [0,1,0,1,0,0|1,0,1]=4 1655 B21R2.66502 CCC1CCCN1S(=O)(=O)c2ccc(c(c2)Br)[N+](=O)[O-] 270084a_100000754278_100000741939 [0,1,0,1,0,0|1,0,1]=4 1656 B21R2.66502 CCC1CCCN1S(=O)(=O)c2ccc(c(c2)Br)[N+](=O)[O-] 274078a_100000754278_100000741939 [0,1,0,1,0,0|1,0,1]=4 1657 B21R2.66502 CCC1CCCN1S(=O)(=O)c2ccc(c(c2)C)[N+](=O)[O-] 270084a_100000754278_100000756168 [0,1,0,1,0,0|1,0,1]=4 1658 B21R2.66502 CCC1CCCN1S(=O)(=O)c2ccc(c(c2)C)[N+](=O)[O-] 274078a_100000754278_100000756168 [0,1,0,1,0,0|1,0,1]=4 1659 B21R2.66502 CCC1CCCN1S(=O)(=O)c2ccc(c(c2)Cl)[N+](=O)[O-] 270084a_100000754278_100011361805 [0,1,0,1,0,0|1,0,1]=4 1660 B21R2.66502 CCC1CCCN1S(=O)(=O)c2ccc(c(c2)Cl)[N+](=O)[O-] 274078a_100000754278_100011361805 [0,1,0,1,0,0|1,0,1]=4 1661 B21R2.66502 CCC1CCCN1S(=O)(=O)c2ccc(c(c2)F)[N+](=O)[O-] 274078a_100000754278_100000745415 [0,1,0,1,0,0|1,0,1]=4 1662 B21R2.222673 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(c(c2)Br)[N+](=O)[O-] 270084a_100000717927_100000741939 [0,1,0,1,0,0|1,0,1]=4 1663 B21R2.222673 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(c(c2)Br)[N+](=O)[O-] 274078a_100000717927_100000741939 [0,1,0,1,0,0|1,0,1]=4 1664 B21R2.222673 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(c(c2)Cl)[N+](=O)[O-] 270084a_100000717927_100011361805 [0,1,0,1,0,0|1,0,1]=4 1665 B21R2.222673 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(c(c2)Cl)[N+](=O)[O-] 274078a_100000717927_100011361805 [0,1,0,1,0,0|1,0,1]=4 1666 B21R2.222673 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(c(c2)F)[N+](=O)[O-] 274078a_100000717927_100000745415 [0,1,0,1,0,0|1,0,1]=4 1667 B21R2.222673 Cc1cc(ccc1[N+](=O)[O-])S(=O)(=O)N2CCC[C@@H](C2)C 270084a_100000717927_100000756168 [0,1,0,1,0,0|1,0,1]=4 1668 B21R2.222673 Cc1cc(ccc1[N+](=O)[O-])S(=O)(=O)N2CCC[C@@H](C2)C 274078a_100000717927_100000756168 [0,1,0,1,0,0|1,0,1]=4 1669 B21R2.3292177 CCCN(C1CC1)S(=O)(=O)c2ccc(c(c2)Br)[N+](=O)[O-] 270084a_100000765834_100000741939 [0,1,0,1,0,0|1,0,1]=4 1670 B21R2.3292177 CCCN(C1CC1)S(=O)(=O)c2ccc(c(c2)Br)[N+](=O)[O-] 274078a_100000765834_100000741939 [0,1,0,1,0,0|1,0,1]=4 1671 B21R2.3292177 CCCN(C1CC1)S(=O)(=O)c2ccc(c(c2)C)[N+](=O)[O-] 270084a_100000765834_100000756168 [0,1,0,1,0,0|1,0,1]=4 1672 B21R2.3292177 CCCN(C1CC1)S(=O)(=O)c2ccc(c(c2)C)[N+](=O)[O-] 274078a_100000765834_100000756168 [0,1,0,1,0,0|1,0,1]=4 1673 B21R2.3292177 CCCN(C1CC1)S(=O)(=O)c2ccc(c(c2)Cl)[N+](=O)[O-] 270084a_100000765834_100011361805 [0,1,0,1,0,0|1,0,1]=4 1674 B21R2.3292177 CCCN(C1CC1)S(=O)(=O)c2ccc(c(c2)Cl)[N+](=O)[O-] 274078a_100000765834_100011361805 [0,1,0,1,0,0|1,0,1]=4 1675 B21R2.3292177 CCCN(C1CC1)S(=O)(=O)c2ccc(c(c2)F)[N+](=O)[O-] 274078a_100000765834_100000745415 [0,1,0,1,0,0|1,0,1]=4 1676 B21R2.11808780 Cc1cc(ccc1[N+](=O)[O-])S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000756168 [0,1,0,1,0,0|1,0,1]=4 1677 B21R2.11808780 Cc1cc(ccc1[N+](=O)[O-])S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000756168 [0,1,0,1,0,0|1,0,1]=4 1678 B21R2.11808780 O=[N+]([O-])c1ccc(cc1Br)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000741939 [0,1,0,1,0,0|1,0,1]=4 1679 B21R2.11808780 O=[N+]([O-])c1ccc(cc1Br)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000741939 [0,1,0,1,0,0|1,0,1]=4 1680 B21R2.11808780 O=[N+]([O-])c1ccc(cc1Cl)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100011361805 [0,1,0,1,0,0|1,0,1]=4 1681 B21R2.11808780 O=[N+]([O-])c1ccc(cc1Cl)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100011361805 [0,1,0,1,0,0|1,0,1]=4 1682 B21R2.11808780 O=[N+]([O-])c1ccc(cc1F)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000745415 [0,1,0,1,0,0|1,0,1]=4 1683 B21R2.47681 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H](C[C@H]2CO)O 270084a_100000707816_100000010689 [0,1,0,1,0,0|2,0,0]=4 1684 B21R2.47681 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H](C[C@H]2CO)O 274078a_100000707816_100000010689 [0,1,0,1,0,0|2,0,0]=4 1685 B21R2.47681 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H](C[C@H]2CO)F 270084a_100015204000_100000010689 [0,1,0,1,0,0|2,0,0]=4 1686 B21R2.47681 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H](C[C@H]2CO)F 274078a_100015204000_100000010689 [0,1,0,1,0,0|2,0,0]=4 1687 B21R2.47681 N#C[C@@H]1C[C@@H](CN1S(=O)(=O)c2ccc(cc2)C(=O)O)F 274078a_100020587076_100000185021 [0,1,0,1,0,0|1,0,1]=4 1688 B21R2.47681 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H](C[C@H]2CO)O 270084a_100000707816_100000231035 [0,1,0,1,0,0|2,0,0]=4 1689 B21R2.47681 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@@H](C[C@H]2CO)O 274078a_100000707816_100000231035 [0,1,0,1,0,0|2,0,0]=4 1690 B21R2.47681 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H](C[C@H]2CO)F 270084a_100015204000_100000231035 [0,1,0,1,0,0|2,0,0]=4 1691 B21R2.47681 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H](C[C@H]2CO)F 274078a_100015204000_100000231035 [0,1,0,1,0,0|2,0,0]=4 1692 B21R2.47681 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@@H](C[C@H]2CO)O 270084a_100000707816_100000185021 [0,1,0,1,0,0|1,0,0]=3 1693 B21R2.47681 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@@H](C[C@H]2CO)O 274078a_100000707816_100000185021 [0,1,0,1,0,0|1,0,0]=3 1694 B21R2.47681 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@H](C[C@H]2CO)F 270084a_100015204000_100000185021 [0,1,0,1,0,0|1,0,0]=3 1695 B21R2.47681 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@H](C[C@H]2CO)F 274078a_100015204000_100000185021 [0,1,0,1,0,0|1,0,0]=3 1696 B21R2.95186 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC(CC(C2)C)C 1458a_100000680154_200000210301 [0,1,0,1,0,0|1,0,0]=3 1697 B21R2.95186 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC(CC(C2)C)C 270084a_100000210448_100000010689 [0,1,0,1,0,0|1,0,0]=3 1698 B21R2.95186 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC(CC(C2)C)C 274078a_100000210448_100000010689 [0,1,0,1,0,0|1,0,0]=3 1699 B21R2.95186 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC(OC(C2)C)C 1458a_100000680008_200000210301 [0,1,0,1,0,0|1,0,0]=3 1700 B21R2.95186 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC(OC(C2)C)C 270084a_100000210032_100000010689 [0,1,0,1,0,0|1,0,0]=3 1701 B21R2.95186 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC(OC(C2)C)C 274078a_100000210032_100000010689 [0,1,0,1,0,0|1,0,0]=3 1702 B21R2.95186 CC1CC(CN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N)C 270084a_100000210448_100000231035 [0,1,0,1,0,0|1,0,0]=3 1703 B21R2.95186 CC1CC(CN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N)C 274078a_100000210448_100000231035 [0,1,0,1,0,0|1,0,0]=3 1704 B21R2.95186 CC1CC(CN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O)C 270084a_100000210448_100000185021 [0,1,0,1,0,0|0,0,0]=2 1705 B21R2.95186 CC1CC(CN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O)C 274078a_100000210448_100000185021 [0,1,0,1,0,0|0,0,0]=2 1706 B21R2.95186 CC1CC(CN(C1)S(=O)(=O)c2ccc(cc2)C(=O)[13CH3])C 1458a_100000680154_200025704644 [0,1,0,1,0,0|1,0,0]=3 1707 B21R2.95186 CC1CC(CN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])C 270084a_100000210448_100000209996 [0,1,0,1,0,0|1,0,1]=4 1708 B21R2.95186 CC1CC(CN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])C 274078a_100000210448_100000209996 [0,1,0,1,0,0|1,0,1]=4 1709 B21R2.95186 CC1CC(CN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])C 40a_100000210448_100000032944 [0,1,0,1,0,0|1,0,1]=4 1710 B21R2.95186 CC1CN(CC(O1)C)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000210032_100000231035 [0,1,0,1,0,0|1,0,0]=3 1711 B21R2.95186 CC1CN(CC(O1)C)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000210032_100000231035 [0,1,0,1,0,0|1,0,0]=3 1712 B21R2.95186 CC1CN(CC(O1)C)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000210032_100000185021 [0,1,0,1,0,0|0,0,0]=2 1713 B21R2.95186 CC1CN(CC(O1)C)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000210032_100000185021 [0,1,0,1,0,0|0,0,0]=2 1714 B21R2.95186 CC1CN(CC(O1)C)S(=O)(=O)c2ccc(cc2)C(=O)[13CH3] 1458a_100000680008_200025704644 [0,1,0,1,0,0|1,0,0]=3 1715 B21R2.95186 CC1CN(CC(O1)C)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000210032_100000209996 [0,1,0,1,0,0|1,0,1]=4 1716 B21R2.95186 CC1CN(CC(O1)C)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000210032_100000209996 [0,1,0,1,0,0|1,0,1]=4 1717 B21R2.95186 CC1CN(CC(O1)C)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000210032_100000032944 [0,1,0,1,0,0|1,0,1]=4 1718 B21R2.253946 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC2C(C)C 270084a_100000762757_100000010689 [0,1,0,1,0,0|1,0,0]=3 1719 B21R2.253946 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC2C(C)C 274078a_100000762757_100000010689 [0,1,0,1,0,0|1,0,0]=3 1720 B21R2.253946 CC(C)C1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000762757_100000231035 [0,1,0,1,0,0|1,0,0]=3 1721 B21R2.253946 CC(C)C1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000762757_100000231035 [0,1,0,1,0,0|1,0,0]=3 1722 B21R2.253946 CC(C)C1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000762757_100000185021 [0,1,0,1,0,0|0,0,0]=2 1723 B21R2.253946 CC(C)C1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000762757_100000185021 [0,1,0,1,0,0|0,0,0]=2 1724 B21R2.253946 CC(C)C1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000762757_100000209996 [0,1,0,1,0,0|1,0,1]=4 1725 B21R2.253946 CC(C)C1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000762757_100000209996 [0,1,0,1,0,0|1,0,1]=4 1726 B21R2.253946 CC(C)C1CCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000762757_100000032944 [0,1,0,1,0,0|1,0,1]=4 1727 B21R2.253946 NC(=O)[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000003125_100000185021 [0,1,0,1,0,0|1,0,1]=4 1728 B21R2.253946 NC(=O)[C@@H]1CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000003125_100000185021 [0,1,0,1,0,0|1,0,1]=4 1729 B21R2.253949 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)(C)C 270084a_100000716857_100000010689 [0,1,0,1,0,0|1,0,0]=3 1730 B21R2.253949 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)(C)C 274078a_100000716857_100000010689 [0,1,0,1,0,0|1,0,0]=3 1731 B21R2.253949 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)(C)O 270084a_100000695535_100000010689 [0,1,0,1,0,0|1,0,0]=3 1732 B21R2.253949 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)(C)O 274078a_100000695535_100000010689 [0,1,0,1,0,0|1,0,0]=3 1733 B21R2.253949 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)(F)F 270084a_100000732682_100000010689 [0,1,0,1,0,0|2,0,0]=4 1734 B21R2.253949 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)(F)F 274078a_100000732682_100000010689 [0,1,0,1,0,0|2,0,0]=4 1735 B21R2.253949 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)(C)C 270084a_100000738910_100000010689 [0,1,0,1,0,0|2,0,0]=4 1736 B21R2.253949 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC(C2)(C)C 274078a_100000738910_100000010689 [0,1,0,1,0,0|2,0,0]=4 1737 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N)C 270084a_100000716857_100000231035 [0,1,0,1,0,0|1,0,0]=3 1738 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N)C 274078a_100000716857_100000231035 [0,1,0,1,0,0|1,0,0]=3 1739 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N)O 270084a_100000695535_100000231035 [0,1,0,1,0,0|1,0,0]=3 1740 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N)O 274078a_100000695535_100000231035 [0,1,0,1,0,0|1,0,0]=3 1741 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O)C 270084a_100000716857_100000185021 [0,1,0,1,0,0|0,0,0]=2 1742 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O)C 274078a_100000716857_100000185021 [0,1,0,1,0,0|0,0,0]=2 1743 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O)O 270084a_100000695535_100000185021 [0,1,0,1,0,0|0,0,0]=2 1744 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O)O 274078a_100000695535_100000185021 [0,1,0,1,0,0|0,0,0]=2 1745 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])C 270084a_100000716857_100000209996 [0,1,0,1,0,0|1,0,1]=4 1746 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])C 274078a_100000716857_100000209996 [0,1,0,1,0,0|1,0,1]=4 1747 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])C 40a_100000716857_100000032944 [0,1,0,1,0,0|1,0,1]=4 1748 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])O 270084a_100000695535_100000209996 [0,1,0,1,0,0|1,0,1]=4 1749 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])O 274078a_100000695535_100000209996 [0,1,0,1,0,0|1,0,1]=4 1750 B21R2.253949 CC1(CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])O 40a_100000695535_100000032944 [0,1,0,1,0,0|1,0,1]=4 1751 B21R2.253949 CC1(CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)N)C 270084a_100000738910_100000231035 [0,1,0,1,0,0|2,0,0]=4 1752 B21R2.253949 CC1(CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)N)C 274078a_100000738910_100000231035 [0,1,0,1,0,0|2,0,0]=4 1753 B21R2.253949 CC1(CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)O)C 270084a_100000738910_100000185021 [0,1,0,1,0,0|1,0,0]=3 1754 B21R2.253949 CC1(CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)O)C 274078a_100000738910_100000185021 [0,1,0,1,0,0|1,0,0]=3 1755 B21R2.253949 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)(F)F 270084a_100000732682_100000231035 [0,1,0,1,0,0|2,0,0]=4 1756 B21R2.253949 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)(F)F 274078a_100000732682_100000231035 [0,1,0,1,0,0|2,0,0]=4 1757 B21R2.253949 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)(F)F 270084a_100000732682_100000185021 [0,1,0,1,0,0|1,0,0]=3 1758 B21R2.253949 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)(F)F 274078a_100000732682_100000185021 [0,1,0,1,0,0|1,0,0]=3 1759 B21R2.1111581 CC(=O)c1ccc(cc1)S(=O)(=O)N(CC(C)C)C2CC2 270084a_100000737031_100000010689 [0,1,0,1,0,0|1,0,0]=3 1760 B21R2.1111581 CC(=O)c1ccc(cc1)S(=O)(=O)N(CC(C)C)C2CC2 274078a_100000737031_100000010689 [0,1,0,1,0,0|1,0,0]=3 1761 B21R2.1111581 CC(C)CN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000737031_100000231035 [0,1,0,1,0,0|1,0,0]=3 1762 B21R2.1111581 CC(C)CN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000737031_100000231035 [0,1,0,1,0,0|1,0,0]=3 1763 B21R2.1111581 CC(C)CN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000737031_100000185021 [0,1,0,1,0,0|0,0,0]=2 1764 B21R2.1111581 CC(C)CN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000737031_100000185021 [0,1,0,1,0,0|0,0,0]=2 1765 B21R2.1111581 CC(C)CN(C1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000737031_100000209996 [0,1,0,1,0,0|1,0,1]=4 1766 B21R2.1111581 CC(C)CN(C1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000737031_100000209996 [0,1,0,1,0,0|1,0,1]=4 1767 B21R2.1111581 CC(C)CN(C1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000737031_100000032944 [0,1,0,1,0,0|1,0,1]=4 1768 B21R2.3237792 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC(C2)O 270084a_100025706797_100000010689 [0,1,0,1,0,0|1,0,0]=3 1769 B21R2.3237792 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC(C2)O 274078a_100025706797_100000010689 [0,1,0,1,0,0|1,0,0]=3 1770 B21R2.3237792 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC[C@@H](C2)O 270084a_100016073750_100000010689 [0,1,0,1,0,0|2,0,0]=4 1771 B21R2.3237792 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC[C@@H](C2)O 274078a_100016073750_100000010689 [0,1,0,1,0,0|2,0,0]=4 1772 B21R2.3237792 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC(C2)O 270084a_100025706797_100000231035 [0,1,0,1,0,0|1,0,0]=3 1773 B21R2.3237792 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC(C2)O 274078a_100025706797_100000231035 [0,1,0,1,0,0|1,0,0]=3 1774 B21R2.3237792 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC[C@@H](C2)O 270084a_100016073750_100000231035 [0,1,0,1,0,0|2,0,0]=4 1775 B21R2.3237792 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC[C@@H](C2)O 274078a_100016073750_100000231035 [0,1,0,1,0,0|2,0,0]=4 1776 B21R2.3237792 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCCC(C2)O 270084a_100025706797_100000185021 [0,1,0,1,0,0|0,0,0]=2 1777 B21R2.3237792 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCCC(C2)O 274078a_100025706797_100000185021 [0,1,0,1,0,0|0,0,0]=2 1778 B21R2.3237792 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCOC[C@@H](C2)O 270084a_100016073750_100000185021 [0,1,0,1,0,0|1,0,0]=3 1779 B21R2.3237792 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCOC[C@@H](C2)O 274078a_100016073750_100000185021 [0,1,0,1,0,0|1,0,0]=3 1780 B21R2.3237792 O=C1CN(CCCN1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100015190381_100000185021 [0,1,0,1,0,0|1,0,1]=4 1781 B21R2.3237792 O=C1CN(CCCN1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100015190381_100000185021 [0,1,0,1,0,0|1,0,1]=4 1782 B21R2.3237792 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCCC(C2)O 270084a_100025706797_100000209996 [0,1,0,1,0,0|1,0,1]=4 1783 B21R2.3237792 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCCC(C2)O 274078a_100025706797_100000209996 [0,1,0,1,0,0|1,0,1]=4 1784 B21R2.3237792 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCCC(C2)O 40a_100025706797_100000032944 [0,1,0,1,0,0|1,0,1]=4 1785 B21R2.5128502 CCCN(CC1CC1)S(=O)(=O)c2ccc(cc2)C(=O)C 270084a_100000210729_100000010689 [0,1,0,1,0,0|1,0,0]=3 1786 B21R2.5128502 CCCN(CC1CC1)S(=O)(=O)c2ccc(cc2)C(=O)C 274078a_100000210729_100000010689 [0,1,0,1,0,0|1,0,0]=3 1787 B21R2.5128502 CCCN(CC1CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000210729_100000231035 [0,1,0,1,0,0|1,0,0]=3 1788 B21R2.5128502 CCCN(CC1CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000210729_100000231035 [0,1,0,1,0,0|1,0,0]=3 1789 B21R2.5128502 CCCN(CC1CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000210729_100000185021 [0,1,0,1,0,0|0,0,0]=2 1790 B21R2.5128502 CCCN(CC1CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000210729_100000185021 [0,1,0,1,0,0|0,0,0]=2 1791 B21R2.5128502 CCCN(CC1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000210729_100000209996 [0,1,0,1,0,0|1,0,1]=4 1792 B21R2.5128502 CCCN(CC1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000210729_100000209996 [0,1,0,1,0,0|1,0,1]=4 1793 B21R2.5128502 CCCN(CC1CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000210729_100000032944 [0,1,0,1,0,0|1,0,1]=4 1794 B21R2.19803 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC(C(C2)C)O 270084a_100011998114_100000010689 [0,1,0,1,0,0|1,0,0]=3 1795 B21R2.19803 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC(C(C2)C)O 274078a_100011998114_100000010689 [0,1,0,1,0,0|1,0,0]=3 1796 B21R2.19803 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC(C(C2)O)C 270084a_100000696640_100000010689 [0,1,0,1,0,0|2,0,0]=4 1797 B21R2.19803 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC(C(C2)O)C 274078a_100000696640_100000010689 [0,1,0,1,0,0|2,0,0]=4 1798 B21R2.19803 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCN([C@H](C2)C)C 270084a_100020603432_100000010689 [0,1,0,1,0,0|1,0,0]=3 1799 B21R2.19803 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCN([C@H](C2)C)C 274078a_100020603432_100000010689 [0,1,0,1,0,0|1,0,0]=3 1800 B21R2.19803 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)F)O 270084a_200016994291_100000010689 [0,1,0,1,0,0|2,0,0]=4 1801 B21R2.19803 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)F)O 274078a_200016994291_100000010689 [0,1,0,1,0,0|2,0,0]=4 1802 B21R2.19803 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)O)O 270084a_100000690696_100000010689 [0,1,0,1,0,0|2,0,0]=4 1803 B21R2.19803 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)O)O 274078a_100000690696_100000010689 [0,1,0,1,0,0|2,0,0]=4 1804 B21R2.19803 CC1CCN(CC1O)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000696640_100000231035 [0,1,0,1,0,0|2,0,0]=4 1805 B21R2.19803 CC1CCN(CC1O)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000696640_100000231035 [0,1,0,1,0,0|2,0,0]=4 1806 B21R2.19803 CC1CCN(CC1O)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000696640_100000185021 [0,1,0,1,0,0|1,0,0]=3 1807 B21R2.19803 CC1CCN(CC1O)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000696640_100000185021 [0,1,0,1,0,0|1,0,0]=3 1808 B21R2.19803 CC1CN(CCC1O)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100011998114_100000231035 [0,1,0,1,0,0|1,0,0]=3 1809 B21R2.19803 CC1CN(CCC1O)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100011998114_100000231035 [0,1,0,1,0,0|1,0,0]=3 1810 B21R2.19803 CC1CN(CCC1O)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100011998114_100000185021 [0,1,0,1,0,0|0,0,0]=2 1811 B21R2.19803 CC1CN(CCC1O)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100011998114_100000185021 [0,1,0,1,0,0|0,0,0]=2 1812 B21R2.19803 CC1CN(CCC1O)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100011998114_100000209996 [0,1,0,1,0,0|1,0,1]=4 1813 B21R2.19803 CC1CN(CCC1O)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100011998114_100000209996 [0,1,0,1,0,0|1,0,1]=4 1814 B21R2.19803 CC1CN(CCC1O)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100011998114_100000032944 [0,1,0,1,0,0|1,0,1]=4 1815 B21R2.19803 CN1CCN(CC1=O)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000187256_100000185021 [0,1,0,1,0,0|1,0,1]=4 1816 B21R2.19803 CN1CCN(CC1=O)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000187256_100000185021 [0,1,0,1,0,0|1,0,1]=4 1817 B21R2.19803 C[C@H]1CN(CCN1C)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100020603432_100000231035 [0,1,0,1,0,0|1,0,0]=3 1818 B21R2.19803 C[C@H]1CN(CCN1C)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100020603432_100000231035 [0,1,0,1,0,0|1,0,0]=3 1819 B21R2.19803 C[C@H]1CN(CCN1C)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100020603432_100000185021 [0,1,0,1,0,0|0,0,0]=2 1820 B21R2.19803 C[C@H]1CN(CCN1C)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100020603432_100000185021 [0,1,0,1,0,0|0,0,0]=2 1821 B21R2.19803 C[C@H]1CN(CCN1C)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100020603432_100000209996 [0,1,0,1,0,0|1,0,1]=4 1822 B21R2.19803 C[C@H]1CN(CCN1C)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100020603432_100000209996 [0,1,0,1,0,0|1,0,1]=4 1823 B21R2.19803 C[C@H]1CN(CCN1C)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100020603432_100000032944 [0,1,0,1,0,0|1,0,1]=4 1824 B21R2.19803 NC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)F)O 270084a_200016994291_100000231035 [0,1,0,1,0,0|2,0,0]=4 1825 B21R2.19803 NC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)F)O 274078a_200016994291_100000231035 [0,1,0,1,0,0|2,0,0]=4 1826 B21R2.19803 NC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)O)O 270084a_100000690696_100000231035 [0,1,0,1,0,0|2,0,0]=4 1827 B21R2.19803 NC(=O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)O)O 274078a_100000690696_100000231035 [0,1,0,1,0,0|2,0,0]=4 1828 B21R2.19803 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)F)O 270084a_200016994291_100000185021 [0,1,0,1,0,0|1,0,0]=3 1829 B21R2.19803 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)F)O 274078a_200016994291_100000185021 [0,1,0,1,0,0|1,0,0]=3 1830 B21R2.19803 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)O)O 270084a_100000690696_100000185021 [0,1,0,1,0,0|1,0,0]=3 1831 B21R2.19803 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC[C@H]([C@H](C2)O)O 274078a_100000690696_100000185021 [0,1,0,1,0,0|1,0,0]=3 1832 B21R2.60849 C#CC1CCCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_200020621307_100000185021 [0,1,0,1,0,0|0,0,2]=4 1833 B21R2.60849 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC2CO 270084a_100000210821_100000010689 [0,1,0,1,0,0|2,0,0]=4 1834 B21R2.60849 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC2CO 274078a_100000210821_100000010689 [0,1,0,1,0,0|2,0,0]=4 1835 B21R2.60849 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC[C@H]2CO 274078a_100000717676_100000010689 [0,1,0,1,0,0|2,0,0]=4 1836 B21R2.60849 CCC1CCCCN1S(=O)(=O)c2ccc(cc2)C(=O)C 270084a_100000210034_100000010689 [0,1,0,1,0,0|1,0,0]=3 1837 B21R2.60849 CCC1CCCCN1S(=O)(=O)c2ccc(cc2)C(=O)C 274078a_100000210034_100000010689 [0,1,0,1,0,0|1,0,0]=3 1838 B21R2.60849 CCC1CCCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000210034_100000231035 [0,1,0,1,0,0|1,0,0]=3 1839 B21R2.60849 CCC1CCCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000210034_100000231035 [0,1,0,1,0,0|1,0,0]=3 1840 B21R2.60849 CCC1CCCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000210034_100000185021 [0,1,0,1,0,0|0,0,0]=2 1841 B21R2.60849 CCC1CCCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000210034_100000185021 [0,1,0,1,0,0|0,0,0]=2 1842 B21R2.60849 CCC1CCCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000210034_100000209996 [0,1,0,1,0,0|1,0,1]=4 1843 B21R2.60849 CCC1CCCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000210034_100000209996 [0,1,0,1,0,0|1,0,1]=4 1844 B21R2.60849 CCC1CCCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000210034_100000032944 [0,1,0,1,0,0|1,0,1]=4 1845 B21R2.60849 CC[C@H]1COCCN1S(=O)(=O)c2ccc(cc2)C(=O)C 270084a_100016988097_100000010689 [0,1,0,1,0,0|1,0,0]=3 1846 B21R2.60849 CC[C@H]1COCCN1S(=O)(=O)c2ccc(cc2)C(=O)C 274078a_100016988097_100000010689 [0,1,0,1,0,0|1,0,0]=3 1847 B21R2.60849 CC[C@H]1COCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100016988097_100000231035 [0,1,0,1,0,0|1,0,0]=3 1848 B21R2.60849 CC[C@H]1COCCN1S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100016988097_100000231035 [0,1,0,1,0,0|1,0,0]=3 1849 B21R2.60849 CC[C@H]1COCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100016988097_100000185021 [0,1,0,1,0,0|0,0,0]=2 1850 B21R2.60849 CC[C@H]1COCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100016988097_100000185021 [0,1,0,1,0,0|0,0,0]=2 1851 B21R2.60849 CC[C@H]1COCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100016988097_100000209996 [0,1,0,1,0,0|1,0,1]=4 1852 B21R2.60849 CC[C@H]1COCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100016988097_100000209996 [0,1,0,1,0,0|1,0,1]=4 1853 B21R2.60849 CC[C@H]1COCCN1S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100016988097_100000032944 [0,1,0,1,0,0|1,0,1]=4 1854 B21R2.60849 N#CC1CCCCN1S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100016989756_100000185021 [0,1,0,1,0,0|1,0,1]=4 1855 B21R2.60849 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC2CO 270084a_100000210821_100000231035 [0,1,0,1,0,0|2,0,0]=4 1856 B21R2.60849 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCC2CO 274078a_100000210821_100000231035 [0,1,0,1,0,0|2,0,0]=4 1857 B21R2.60849 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCOC[C@H]2CO 274078a_100000717676_100000231035 [0,1,0,1,0,0|2,0,0]=4 1858 B21R2.60849 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCCC2CO 270084a_100000210821_100000185021 [0,1,0,1,0,0|1,0,0]=3 1859 B21R2.60849 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCCC2CO 274078a_100000210821_100000185021 [0,1,0,1,0,0|1,0,0]=3 1860 B21R2.60849 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCOC[C@H]2CO 274078a_100000717676_100000185021 [0,1,0,1,0,0|1,0,0]=3 1861 B21R2.459049 C#CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)C 270084a_100015191679_100000010689 [0,1,0,1,0,0|1,0,1]=4 1862 B21R2.459049 C#CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)C 274078a_100015191679_100000010689 [0,1,0,1,0,0|1,0,1]=4 1863 B21R2.459049 C#CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100015191679_100000231035 [0,1,0,1,0,0|1,0,1]=4 1864 B21R2.459049 C#CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100015191679_100000231035 [0,1,0,1,0,0|1,0,1]=4 1865 B21R2.459049 C#CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100015191679_100000185021 [0,1,0,1,0,0|0,0,1]=3 1866 B21R2.459049 C#CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100015191679_100000185021 [0,1,0,1,0,0|0,0,1]=3 1867 B21R2.459049 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)C#N 274078a_100016989302_100000010689 [0,1,0,1,0,0|1,0,1]=4 1868 B21R2.459049 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CF 270084a_100016992999_100000010689 [0,1,0,1,0,0|1,0,0]=3 1869 B21R2.459049 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CF 274078a_100016992999_100000010689 [0,1,0,1,0,0|1,0,0]=3 1870 B21R2.459049 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CO 270084a_100000211344_100000010689 [0,1,0,1,0,0|1,0,0]=3 1871 B21R2.459049 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CO 274078a_100000211344_100000010689 [0,1,0,1,0,0|1,0,0]=3 1872 B21R2.459049 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCO[C@@H](C2)CO 270084a_100015189573_100000010689 [0,1,0,1,0,0|2,0,0]=4 1873 B21R2.459049 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCO[C@@H](C2)CO 274078a_100015189573_100000010689 [0,1,0,1,0,0|2,0,0]=4 1874 B21R2.459049 CCC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)C 270084a_100000736320_100000010689 [0,1,0,1,0,0|2,0,0]=4 1875 B21R2.459049 CCC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)C 274078a_100000736320_100000010689 [0,1,0,1,0,0|2,0,0]=4 1876 B21R2.459049 CCC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000736320_100000231035 [0,1,0,1,0,0|2,0,0]=4 1877 B21R2.459049 CCC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000736320_100000231035 [0,1,0,1,0,0|2,0,0]=4 1878 B21R2.459049 CCC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000736320_100000185021 [0,1,0,1,0,0|1,0,0]=3 1879 B21R2.459049 CCC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000736320_100000185021 [0,1,0,1,0,0|1,0,0]=3 1880 B21R2.459049 COC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)C 270084a_100000695604_100000010689 [0,1,0,1,0,0|1,0,0]=3 1881 B21R2.459049 COC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)C 274078a_100000695604_100000010689 [0,1,0,1,0,0|1,0,0]=3 1882 B21R2.459049 COC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000695604_100000231035 [0,1,0,1,0,0|1,0,0]=3 1883 B21R2.459049 COC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000695604_100000231035 [0,1,0,1,0,0|1,0,0]=3 1884 B21R2.459049 COC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000695604_100000185021 [0,1,0,1,0,0|0,0,0]=2 1885 B21R2.459049 COC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000695604_100000185021 [0,1,0,1,0,0|0,0,0]=2 1886 B21R2.459049 COC1CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000695604_100000209996 [0,1,0,1,0,0|1,0,1]=4 1887 B21R2.459049 COC1CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000695604_100000209996 [0,1,0,1,0,0|1,0,1]=4 1888 B21R2.459049 COC1CCCN(C1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000695604_100000032944 [0,1,0,1,0,0|1,0,1]=4 1889 B21R2.459049 N#CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100016989302_100000231035 [0,1,0,1,0,0|1,0,1]=4 1890 B21R2.459049 N#CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100016989302_100000185021 [0,1,0,1,0,0|0,0,1]=3 1891 B21R2.459049 N#CC1CN(CCO1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000752543_100000185021 [0,1,0,1,0,0|1,0,1]=4 1892 B21R2.459049 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CF 270084a_100016992999_100000231035 [0,1,0,1,0,0|1,0,0]=3 1893 B21R2.459049 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CF 274078a_100016992999_100000231035 [0,1,0,1,0,0|1,0,0]=3 1894 B21R2.459049 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CO 270084a_100000211344_100000231035 [0,1,0,1,0,0|1,0,0]=3 1895 B21R2.459049 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CO 274078a_100000211344_100000231035 [0,1,0,1,0,0|1,0,0]=3 1896 B21R2.459049 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCO[C@@H](C2)CO 270084a_100015189573_100000231035 [0,1,0,1,0,0|2,0,0]=4 1897 B21R2.459049 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCO[C@@H](C2)CO 274078a_100015189573_100000231035 [0,1,0,1,0,0|2,0,0]=4 1898 B21R2.459049 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CF 270084a_100016992999_100000185021 [0,1,0,1,0,0|0,0,0]=2 1899 B21R2.459049 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CF 274078a_100016992999_100000185021 [0,1,0,1,0,0|0,0,0]=2 1900 B21R2.459049 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CO 270084a_100000211344_100000185021 [0,1,0,1,0,0|0,0,0]=2 1901 B21R2.459049 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CO 274078a_100000211344_100000185021 [0,1,0,1,0,0|0,0,0]=2 1902 B21R2.459049 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCO[C@@H](C2)CO 270084a_100015189573_100000185021 [0,1,0,1,0,0|1,0,0]=3 1903 B21R2.459049 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCO[C@@H](C2)CO 274078a_100015189573_100000185021 [0,1,0,1,0,0|1,0,0]=3 1904 B21R2.459049 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CF 270084a_100016992999_100000209996 [0,1,0,1,0,0|1,0,1]=4 1905 B21R2.459049 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CF 274078a_100016992999_100000209996 [0,1,0,1,0,0|1,0,1]=4 1906 B21R2.459049 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CF 40a_100016992999_100000032944 [0,1,0,1,0,0|1,0,1]=4 1907 B21R2.459049 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CO 270084a_100000211344_100000209996 [0,1,0,1,0,0|1,0,1]=4 1908 B21R2.459049 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CO 274078a_100000211344_100000209996 [0,1,0,1,0,0|1,0,1]=4 1909 B21R2.459049 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(C2)CO 40a_100000211344_100000032944 [0,1,0,1,0,0|1,0,1]=4 1910 B21R2.2781399 CC(=O)c1ccc(cc1)S(=O)(=O)N(CCC#N)C2CC2 274078a_100000177889_100000010689 [0,1,0,1,0,0|1,0,1]=4 1911 B21R2.2781399 N#CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000177889_100000231035 [0,1,0,1,0,0|1,0,1]=4 1912 B21R2.2781399 N#CCCN(C1CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000177889_100000185021 [0,1,0,1,0,0|0,0,1]=3 1913 B21R2.3556454 C=C(C)c1ccc(cc1)S(=O)(=O)N2CCCN(CC2)C 271570a_100000694244_200000485476 [0,1,0,1,0,0|2,0,0]=4 1914 B21R2.3556454 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)C 270084a_100025706717_100000010689 [0,1,0,1,0,0|1,0,0]=3 1915 B21R2.3556454 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)C 274078a_100025706717_100000010689 [0,1,0,1,0,0|1,0,0]=3 1916 B21R2.3556454 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)O 270084a_100015186869_100000010689 [0,1,0,1,0,0|1,0,0]=3 1917 B21R2.3556454 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)O 274078a_100015186869_100000010689 [0,1,0,1,0,0|1,0,0]=3 1918 B21R2.3556454 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCN(CC2)C 270084a_100000211313_100000010689 [0,1,0,1,0,0|1,0,0]=3 1919 B21R2.3556454 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCN(CC2)C 274078a_100000211313_100000010689 [0,1,0,1,0,0|1,0,0]=3 1920 B21R2.3556454 CC1CCCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100025706717_100000231035 [0,1,0,1,0,0|1,0,0]=3 1921 B21R2.3556454 CC1CCCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100025706717_100000231035 [0,1,0,1,0,0|1,0,0]=3 1922 B21R2.3556454 CC1CCCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100025706717_100000185021 [0,1,0,1,0,0|0,0,0]=2 1923 B21R2.3556454 CC1CCCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100025706717_100000185021 [0,1,0,1,0,0|0,0,0]=2 1924 B21R2.3556454 CC1CCCN(CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100025706717_100000209996 [0,1,0,1,0,0|1,0,1]=4 1925 B21R2.3556454 CC1CCCN(CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100025706717_100000209996 [0,1,0,1,0,0|1,0,1]=4 1926 B21R2.3556454 CC1CCCN(CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100025706717_100000032944 [0,1,0,1,0,0|1,0,1]=4 1927 B21R2.3556454 CN1CCCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100000211313_100000231035 [0,1,0,1,0,0|1,0,0]=3 1928 B21R2.3556454 CN1CCCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100000211313_100000231035 [0,1,0,1,0,0|1,0,0]=3 1929 B21R2.3556454 CN1CCCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000211313_100000185021 [0,1,0,1,0,0|0,0,0]=2 1930 B21R2.3556454 CN1CCCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000211313_100000185021 [0,1,0,1,0,0|0,0,0]=2 1931 B21R2.3556454 CN1CCCN(CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 270084a_100000211313_100000209996 [0,1,0,1,0,0|1,0,1]=4 1932 B21R2.3556454 CN1CCCN(CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 274078a_100000211313_100000209996 [0,1,0,1,0,0|1,0,1]=4 1933 B21R2.3556454 CN1CCCN(CC1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-] 40a_100000211313_100000032944 [0,1,0,1,0,0|1,0,1]=4 1934 B21R2.3556454 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)O 270084a_100015186869_100000231035 [0,1,0,1,0,0|1,0,0]=3 1935 B21R2.3556454 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)O 274078a_100015186869_100000231035 [0,1,0,1,0,0|1,0,0]=3 1936 B21R2.3556454 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)O 270084a_100015186869_100000185021 [0,1,0,1,0,0|0,0,0]=2 1937 B21R2.3556454 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)O 274078a_100015186869_100000185021 [0,1,0,1,0,0|0,0,0]=2 1938 B21R2.3556454 O=C1CCN(CCN1)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100000698595_100000185021 [0,1,0,1,0,0|1,0,1]=4 1939 B21R2.3556454 O=C1CCN(CCN1)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100000698595_100000185021 [0,1,0,1,0,0|1,0,1]=4 1940 B21R2.3556454 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)O 270084a_100015186869_100000209996 [0,1,0,1,0,0|1,0,1]=4 1941 B21R2.3556454 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)O 274078a_100015186869_100000209996 [0,1,0,1,0,0|1,0,1]=4 1942 B21R2.3556454 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC(CC2)O 40a_100015186869_100000032944 [0,1,0,1,0,0|1,0,1]=4 1943 B21R2.4803245 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCCC2 270084a_100000211400_100000010689 [0,1,0,1,0,0|1,0,0]=3 1944 B21R2.4803245 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCCC2 274078a_100000211400_100000010689 [0,1,0,1,0,0|1,0,0]=3 1945 B21R2.4803245 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCCC2 270084a_100000211400_100000231035 [0,1,0,1,0,0|1,0,0]=3 1946 B21R2.4803245 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCCC2 274078a_100000211400_100000231035 [0,1,0,1,0,0|1,0,0]=3 1947 B21R2.4803245 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCCCCC2 270084a_100000211400_100000185021 [0,1,0,1,0,0|0,0,0]=2 1948 B21R2.4803245 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCCCCC2 274078a_100000211400_100000185021 [0,1,0,1,0,0|0,0,0]=2 1949 B21R2.4803245 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCCCCC2 270084a_100000211400_100000209996 [0,1,0,1,0,0|1,0,1]=4 1950 B21R2.4803245 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCCCCC2 274078a_100000211400_100000209996 [0,1,0,1,0,0|1,0,1]=4 1951 B21R2.4803245 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCCCCC2 40a_100000211400_100000032944 [0,1,0,1,0,0|1,0,1]=4 1952 B21R2.226294 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H](OC[C@H]2C)C 270084a_100016991869_100000010689 [0,1,0,1,0,0|2,0,0]=4 1953 B21R2.226294 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H](OC[C@H]2C)C 274078a_100016991869_100000010689 [0,1,0,1,0,0|2,0,0]=4 1954 B21R2.226294 C[C@@H]1CN([C@@H](CO1)C)S(=O)(=O)c2ccc(cc2)C(=O)N 270084a_100016991869_100000231035 [0,1,0,1,0,0|2,0,0]=4 1955 B21R2.226294 C[C@@H]1CN([C@@H](CO1)C)S(=O)(=O)c2ccc(cc2)C(=O)N 274078a_100016991869_100000231035 [0,1,0,1,0,0|2,0,0]=4 1956 B21R2.226294 C[C@@H]1CN([C@@H](CO1)C)S(=O)(=O)c2ccc(cc2)C(=O)O 270084a_100016991869_100000185021 [0,1,0,1,0,0|1,0,0]=3 1957 B21R2.226294 C[C@@H]1CN([C@@H](CO1)C)S(=O)(=O)c2ccc(cc2)C(=O)O 274078a_100016991869_100000185021 [0,1,0,1,0,0|1,0,0]=3 1958 B21R2.2742270 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@]2(C)CO 270084a_100016195882_100000010689 [0,1,0,1,0,0|2,0,0]=4 1959 B21R2.2742270 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCC[C@@]2(C)CO 274078a_100016195882_100000010689 [0,1,0,1,0,0|2,0,0]=4 1960 B21R2.2742270 C[C@]1(CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N)CO 270084a_100016195882_100000231035 [0,1,0,1,0,0|2,0,0]=4 1961 B21R2.2742270 C[C@]1(CCCN1S(=O)(=O)c2ccc(cc2)C(=O)N)CO 274078a_100016195882_100000231035 [0,1,0,1,0,0|2,0,0]=4 1962 B21R2.2742270 C[C@]1(CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O)CO 270084a_100016195882_100000185021 [0,1,0,1,0,0|1,0,0]=3 1963 B21R2.2742270 C[C@]1(CCCN1S(=O)(=O)c2ccc(cc2)C(=O)O)CO 274078a_100016195882_100000185021 [0,1,0,1,0,0|1,0,0]=3 1964 B21R2.66470 CCC1C=CCN1S(=O)(=O)c2ccc(cc2Cl)C(=O)O 270084a_100000730860_100000763611 [0,1,0,1,0,0|0,0,2]=4 1965 B21R2.66470 CCC1C=CCN1S(=O)(=O)c2ccc(cc2Cl)C(=O)O 274078a_100000730860_100000763611 [0,1,0,1,0,0|0,0,2]=4 1966 B21R2.66470 CCC1CCCN1S(=O)(=O)c2ccc(cc2Br)[N+](=O)[O-] 270084a_100000754278_100000739667 [0,1,0,1,0,0|1,0,1]=4 1967 B21R2.66470 CCC1CCCN1S(=O)(=O)c2ccc(cc2Br)[N+](=O)[O-] 274078a_100000754278_100000739667 [0,1,0,1,0,0|1,0,1]=4 1968 B21R2.66470 CCC1CCCN1S(=O)(=O)c2ccc(cc2C)[N+](=O)[O-] 270084a_100000754278_100000738598 [0,1,0,1,0,0|1,0,1]=4 1969 B21R2.66470 CCC1CCCN1S(=O)(=O)c2ccc(cc2C)[N+](=O)[O-] 274078a_100000754278_100000738598 [0,1,0,1,0,0|1,0,1]=4 1970 B21R2.66470 CCC1CCCN1S(=O)(=O)c2ccc(cc2Cl)C(=O)O 270084a_100000754278_100000763611 [0,1,0,1,0,0|0,0,0]=2 1971 B21R2.66470 CCC1CCCN1S(=O)(=O)c2ccc(cc2Cl)C(=O)O 274078a_100000754278_100000763611 [0,1,0,1,0,0|0,0,0]=2 1972 B21R2.66470 CCC1CCCN1S(=O)(=O)c2ccc(cc2Cl)[N+](=O)[O-] 270084a_100000754278_100000182962 [0,1,0,1,0,0|1,0,1]=4 1973 B21R2.66470 CCC1CCCN1S(=O)(=O)c2ccc(cc2Cl)[N+](=O)[O-] 274078a_100000754278_100000182962 [0,1,0,1,0,0|1,0,1]=4 1974 B21R2.66470 CCC1CCCN1S(=O)(=O)c2ccc(cc2F)[N+](=O)[O-] 274078a_100000754278_100000741260 [0,1,0,1,0,0|1,0,1]=4 1975 B21R2.66470 N#CC1CCCN1S(=O)(=O)c2ccc(cc2Cl)C(=O)O 274078a_100000701862_100000763611 [0,1,0,1,0,0|1,0,1]=4 1976 B21R2.66470 N#C[C@H]1CCCN1S(=O)(=O)c2ccc(cc2Cl)C(=O)O 274078a_106645074975_100000763611 [0,1,0,1,0,0|1,0,1]=4 1977 B21R2.66470 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCC[C@@H]2CO 270084a_100000745186_100000763611 [0,1,0,1,0,0|1,0,0]=3 1978 B21R2.66470 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCC[C@@H]2CO 274078a_100000745186_100000763611 [0,1,0,1,0,0|1,0,0]=3 1979 B21R2.222658 CC1=CCCN(C1)S(=O)(=O)c2ccc(cc2Cl)C(=O)O 270084a_100000725631_100000763611 [0,1,0,1,0,0|0,0,2]=4 1980 B21R2.222658 CC1=CCCN(C1)S(=O)(=O)c2ccc(cc2Cl)C(=O)O 274078a_100000725631_100000763611 [0,1,0,1,0,0|0,0,2]=4 1981 B21R2.222658 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2Cl)C(=O)O 270084a_100000729577_100000763611 [0,1,0,1,0,0|1,0,0]=3 1982 B21R2.222658 CC1CN(CCO1)S(=O)(=O)c2ccc(cc2Cl)C(=O)O 274078a_100000729577_100000763611 [0,1,0,1,0,0|1,0,0]=3 1983 B21R2.222658 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2Br)[N+](=O)[O-] 270084a_100000717927_100000739667 [0,1,0,1,0,0|1,0,1]=4 1984 B21R2.222658 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2Br)[N+](=O)[O-] 274078a_100000717927_100000739667 [0,1,0,1,0,0|1,0,1]=4 1985 B21R2.222658 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2Cl)C(=O)O 270084a_100000717927_100000763611 [0,1,0,1,0,0|0,0,0]=2 1986 B21R2.222658 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2Cl)C(=O)O 274078a_100000717927_100000763611 [0,1,0,1,0,0|0,0,0]=2 1987 B21R2.222658 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2Cl)[N+](=O)[O-] 270084a_100000717927_100000182962 [0,1,0,1,0,0|1,0,1]=4 1988 B21R2.222658 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2Cl)[N+](=O)[O-] 274078a_100000717927_100000182962 [0,1,0,1,0,0|1,0,1]=4 1989 B21R2.222658 C[C@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2F)[N+](=O)[O-] 274078a_100000717927_100000741260 [0,1,0,1,0,0|1,0,1]=4 1990 B21R2.222658 Cc1cc(ccc1S(=O)(=O)N2CCC[C@@H](C2)C)[N+](=O)[O-] 270084a_100000717927_100000738598 [0,1,0,1,0,0|1,0,1]=4 1991 B21R2.222658 Cc1cc(ccc1S(=O)(=O)N2CCC[C@@H](C2)C)[N+](=O)[O-] 274078a_100000717927_100000738598 [0,1,0,1,0,0|1,0,1]=4 1992 B21R2.222658 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCCC(C2)F 270084a_100000697950_100000763611 [0,1,0,1,0,0|1,0,0]=3 1993 B21R2.222658 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCCC(C2)F 274078a_100000697950_100000763611 [0,1,0,1,0,0|1,0,0]=3 1994 B21R2.222658 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCCC(C2)O 270084a_100000211013_100000763611 [0,1,0,1,0,0|1,0,0]=3 1995 B21R2.222658 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCCC(C2)O 274078a_100000211013_100000763611 [0,1,0,1,0,0|1,0,0]=3 1996 B21R2.222658 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCOC(C2)O 274078a_100000688207_100000763611 [0,1,0,1,0,0|2,0,0]=4 1997 B21R2.3146625 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2Cl)C(=O)O 270084a_200015306588_100000763611 [0,1,0,1,0,0|1,0,0]=3 1998 B21R2.3146625 C[C@@H]1CN(C[C@@H]1O)S(=O)(=O)c2ccc(cc2Cl)C(=O)O 274078a_200015306588_100000763611 [0,1,0,1,0,0|1,0,0]=3 1999 B21R2.3146625 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 270084a_100020590056_100000763611 [0,1,0,1,0,0|2,0,0]=4 2000 B21R2.3146625 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2C[C@@H]([C@H](C2)F)O 274078a_100020590056_100000763611 [0,1,0,1,0,0|2,0,0]=4 2001 B21R2.3146625 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 270084a_100103146936_100000763611 [0,1,0,1,0,0|2,0,0]=4 2002 B21R2.3146625 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2C[C@H]([C@H](C2)F)F 274078a_100103146936_100000763611 [0,1,0,1,0,0|2,0,0]=4 2003 B21R2.3146625 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 270084a_100015207562_100000763611 [0,1,0,1,0,0|2,0,0]=4 2004 B21R2.3146625 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2C[C@H]([C@H](C2)O)O 274078a_100015207562_100000763611 [0,1,0,1,0,0|2,0,0]=4 2005 B21R2.3292153 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2Br)[N+](=O)[O-] 270084a_100000765834_100000739667 [0,1,0,1,0,0|1,0,1]=4 2006 B21R2.3292153 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2Br)[N+](=O)[O-] 274078a_100000765834_100000739667 [0,1,0,1,0,0|1,0,1]=4 2007 B21R2.3292153 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2C)[N+](=O)[O-] 270084a_100000765834_100000738598 [0,1,0,1,0,0|1,0,1]=4 2008 B21R2.3292153 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2C)[N+](=O)[O-] 274078a_100000765834_100000738598 [0,1,0,1,0,0|1,0,1]=4 2009 B21R2.3292153 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2Cl)C(=O)O 270084a_100000765834_100000763611 [0,1,0,1,0,0|0,0,0]=2 2010 B21R2.3292153 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2Cl)C(=O)O 274078a_100000765834_100000763611 [0,1,0,1,0,0|0,0,0]=2 2011 B21R2.3292153 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2Cl)[N+](=O)[O-] 270084a_100000765834_100000182962 [0,1,0,1,0,0|1,0,1]=4 2012 B21R2.3292153 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2Cl)[N+](=O)[O-] 274078a_100000765834_100000182962 [0,1,0,1,0,0|1,0,1]=4 2013 B21R2.3292153 CCCN(C1CC1)S(=O)(=O)c2ccc(cc2F)[N+](=O)[O-] 274078a_100000765834_100000741260 [0,1,0,1,0,0|1,0,1]=4 2014 B21R2.3292153 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N(CCO)C2CC2 270084a_100000738766_100000763611 [0,1,0,1,0,0|1,0,0]=3 2015 B21R2.3292153 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N(CCO)C2CC2 274078a_100000738766_100000763611 [0,1,0,1,0,0|1,0,0]=3 2016 B21R2.11807859 Cc1cc(ccc1S(=O)(=O)N2CCCCCC2)[N+](=O)[O-] 270084a_100000185865_100000738598 [0,1,0,1,0,0|1,0,1]=4 2017 B21R2.11807859 Cc1cc(ccc1S(=O)(=O)N2CCCCCC2)[N+](=O)[O-] 274078a_100000185865_100000738598 [0,1,0,1,0,0|1,0,1]=4 2018 B21R2.11807859 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000763611 [0,1,0,1,0,0|0,0,0]=2 2019 B21R2.11807859 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000763611 [0,1,0,1,0,0|0,0,0]=2 2020 B21R2.11807859 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCCOCC2 270084a_100000685342_100000763611 [0,1,0,1,0,0|1,0,0]=3 2021 B21R2.11807859 O=C(O)c1ccc(c(c1)Cl)S(=O)(=O)N2CCCOCC2 274078a_100000685342_100000763611 [0,1,0,1,0,0|1,0,0]=3 2022 B21R2.11807859 O=[N+]([O-])c1ccc(c(c1)Br)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000739667 [0,1,0,1,0,0|1,0,1]=4 2023 B21R2.11807859 O=[N+]([O-])c1ccc(c(c1)Br)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000739667 [0,1,0,1,0,0|1,0,1]=4 2024 B21R2.11807859 O=[N+]([O-])c1ccc(c(c1)Cl)S(=O)(=O)N2CCCCCC2 270084a_100000185865_100000182962 [0,1,0,1,0,0|1,0,1]=4 2025 B21R2.11807859 O=[N+]([O-])c1ccc(c(c1)Cl)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000182962 [0,1,0,1,0,0|1,0,1]=4 2026 B21R2.11807859 O=[N+]([O-])c1ccc(c(c1)F)S(=O)(=O)N2CCCCCC2 274078a_100000185865_100000741260 [0,1,0,1,0,0|1,0,1]=4 2027 B21R3.511868 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC23CC3 270084a_100020620911_100000010689 [0,0,0,2,0,0|1,0,0]=3 2028 B21R3.511868 CC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC23CC3 274078a_100020620911_100000010689 [0,0,0,2,0,0|1,0,0]=3 2029 B21R3.511868 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC23CC3 270084a_100020620911_100000231035 [0,0,0,2,0,0|1,0,0]=3 2030 B21R3.511868 NC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC23CC3 274078a_100020620911_100000231035 [0,0,0,2,0,0|1,0,0]=3 2031 B21R3.511868 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC23CC3 270084a_100020620911_100000185021 [0,0,0,2,0,0|0,0,0]=2 2032 B21R3.511868 O=C(O)c1ccc(cc1)S(=O)(=O)N2CCCC23CC3 274078a_100020620911_100000185021 [0,0,0,2,0,0|0,0,0]=2 2033 B21R3.511868 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC23CC3 270084a_100020620911_100000209996 [0,0,0,2,0,0|1,0,1]=4 2034 B21R3.511868 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC23CC3 274078a_100020620911_100000209996 [0,0,0,2,0,0|1,0,1]=4 2035 B21R3.511868 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CCCC23CC3 40a_100020620911_100000032944 [0,0,0,2,0,0|1,0,1]=4 2036 B21R3.7897073 CC(=O)c1ccc(cc1)S(=O)(=O)N2C3CCC2CC3 270084a_100000735658_100000010689 [0,0,0,2,0,0|1,0,0]=3 2037 B21R3.7897073 CC(=O)c1ccc(cc1)S(=O)(=O)N2C3CCC2CC3 274078a_100000735658_100000010689 [0,0,0,2,0,0|1,0,0]=3 2038 B21R3.7897073 NC(=O)c1ccc(cc1)S(=O)(=O)N2C3CCC2CC3 270084a_100000735658_100000231035 [0,0,0,2,0,0|1,0,0]=3 2039 B21R3.7897073 NC(=O)c1ccc(cc1)S(=O)(=O)N2C3CCC2CC3 274078a_100000735658_100000231035 [0,0,0,2,0,0|1,0,0]=3 2040 B21R3.7897073 O=C(O)c1ccc(cc1)S(=O)(=O)N2C3CCC2CC3 270084a_100000735658_100000185021 [0,0,0,2,0,0|0,0,0]=2 2041 B21R3.7897073 O=C(O)c1ccc(cc1)S(=O)(=O)N2C3CCC2CC3 274078a_100000735658_100000185021 [0,0,0,2,0,0|0,0,0]=2 2042 B21R3.7897073 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2C3CCC2CC3 270084a_100000735658_100000209996 [0,0,0,2,0,0|1,0,1]=4 2043 B21R3.7897073 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2C3CCC2CC3 274078a_100000735658_100000209996 [0,0,0,2,0,0|1,0,1]=4 2044 B21R3.7897073 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2C3CCC2CC3 40a_100000735658_100000032944 [0,0,0,2,0,0|1,0,1]=4 2045 B21R3.7897079 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC3CCC2C3 270084a_100000743476_100000010689 [0,0,0,2,0,0|1,0,0]=3 2046 B21R3.7897079 CC(=O)c1ccc(cc1)S(=O)(=O)N2CC3CCC2C3 274078a_100000743476_100000010689 [0,0,0,2,0,0|1,0,0]=3 2047 B21R3.7897079 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]3C[C@@H]2CO3 270084a_100016995552_100000010689 [0,0,0,2,0,0|2,0,0]=4 2048 B21R3.7897079 CC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]3C[C@@H]2CO3 274078a_100016995552_100000010689 [0,0,0,2,0,0|2,0,0]=4 2049 B21R3.7897079 NC(=O)c1ccc(cc1)S(=O)(=O)N2CC3CCC2C3 270084a_100000743476_100000231035 [0,0,0,2,0,0|1,0,0]=3 2050 B21R3.7897079 NC(=O)c1ccc(cc1)S(=O)(=O)N2CC3CCC2C3 274078a_100000743476_100000231035 [0,0,0,2,0,0|1,0,0]=3 2051 B21R3.7897079 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]3C[C@@H]2CO3 270084a_100016995552_100000231035 [0,0,0,2,0,0|2,0,0]=4 2052 B21R3.7897079 NC(=O)c1ccc(cc1)S(=O)(=O)N2C[C@H]3C[C@@H]2CO3 274078a_100016995552_100000231035 [0,0,0,2,0,0|2,0,0]=4 2053 B21R3.7897079 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC3C=CC2C3 270084a_100000732668_100000185021 [0,0,0,2,0,0|0,0,2]=4 2054 B21R3.7897079 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC3C=CC2C3 274078a_100000732668_100000185021 [0,0,0,2,0,0|0,0,2]=4 2055 B21R3.7897079 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC3CCC2C3 270084a_100000743476_100000185021 [0,0,0,2,0,0|0,0,0]=2 2056 B21R3.7897079 O=C(O)c1ccc(cc1)S(=O)(=O)N2CC3CCC2C3 274078a_100000743476_100000185021 [0,0,0,2,0,0|0,0,0]=2 2057 B21R3.7897079 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@H]3C[C@@H]2CO3 270084a_100016995552_100000185021 [0,0,0,2,0,0|1,0,0]=3 2058 B21R3.7897079 O=C(O)c1ccc(cc1)S(=O)(=O)N2C[C@H]3C[C@@H]2CO3 274078a_100016995552_100000185021 [0,0,0,2,0,0|1,0,0]=3 2059 B21R3.7897079 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CC3CCC2C3 270084a_100000743476_100000209996 [0,0,0,2,0,0|1,0,1]=4 2060 B21R3.7897079 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CC3CCC2C3 274078a_100000743476_100000209996 [0,0,0,2,0,0|1,0,1]=4 2061 B21R3.7897079 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N2CC3CCC2C3 40a_100000743476_100000032944 [0,0,0,2,0,0|1,0,1]=4 2062 B21R3.43179068 CC(=O)c1ccc(cc1)S(=O)(=O)N(C2CC2)C3CC3 274078a_100000708171_100000010689 [0,0,0,2,0,0|1,0,0]=3 2063 B21R3.43179068 NC(=O)c1ccc(cc1)S(=O)(=O)N(C2CC2)C3CC3 274078a_100000708171_100000231035 [0,0,0,2,0,0|1,0,0]=3 2064 B21R3.43179068 O=C(O)c1ccc(cc1)S(=O)(=O)N(C2CC2)C3CC3 274078a_100000708171_100000185021 [0,0,0,2,0,0|0,0,0]=2 2065 B21R3.43179068 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(C2CC2)C3CC3 274078a_100000708171_100000209996 [0,0,0,2,0,0|1,0,1]=4 2066 B21R3.43179068 O=[N+]([O-])c1ccc(cc1)S(=O)(=O)N(C2CC2)C3CC3 40a_100000708171_100000032944 [0,0,0,2,0,0|1,0,1]=4 2067 B19R1.14220 CCC(COC)NS(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000757820_100000185021 [1,0,0,0,0,1|2,0,0]=4 2068 B19R1.14220 CCC(COC)NS(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000757820_100000185021 [1,0,0,0,0,1|2,0,0]=4 2069 B19R1.14220 CCCC(CC)NS(=O)(=O)c1ccc(cc1)C(=O)C 270084a_100000747048_100000010689 [1,0,0,0,0,1|2,0,0]=4 2070 B19R1.14220 CCCC(CC)NS(=O)(=O)c1ccc(cc1)C(=O)C 274078a_100000747048_100000010689 [1,0,0,0,0,1|2,0,0]=4 2071 B19R1.14220 CCCC(CC)NS(=O)(=O)c1ccc(cc1)C(=O)N 270084a_100000747048_100000231035 [1,0,0,0,0,1|2,0,0]=4 2072 B19R1.14220 CCCC(CC)NS(=O)(=O)c1ccc(cc1)C(=O)N 274078a_100000747048_100000231035 [1,0,0,0,0,1|2,0,0]=4 2073 B19R1.14220 CCCC(CC)NS(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000747048_100000185021 [1,0,0,0,0,1|1,0,0]=3 2074 B19R1.14220 CCCC(CC)NS(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000747048_100000185021 [1,0,0,0,0,1|1,0,0]=3 2075 B19R1.14220 CCC[C@@H](CO)NS(=O)(=O)c1ccc(cc1)C(=O)O 270084a_100000732646_100000185021 [1,0,0,0,0,1|2,0,0]=4 2076 B19R1.14220 CCC[C@@H](CO)NS(=O)(=O)c1ccc(cc1)C(=O)O 274078a_100000732646_100000185021 [1,0,0,0,0,1|2,0,0]=4 2077 B19R1.31916 C#CCN(CC)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100000744766_100000740367 [1,0,0,0,0,1|0,0,2]=4 2078 B19R1.31916 CCCN(CC)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100000226822_100000740367 [1,0,0,0,0,1|0,0,0]=2 2079 B19R1.31916 CCCN(CC)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100000226822_100000740367 [1,0,0,0,0,1|0,0,0]=2 2080 B19R1.31916 CCCN(CC)S(=O)(=O)c1ccc(cc1)NC(=O)C 270084a_100000226822_100000210752 [1,0,0,0,0,1|1,0,0]=3 2081 B19R1.31916 CCCN(CC)S(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_100000226822_100000210752 [1,0,0,0,0,1|1,0,0]=3 2082 B19R1.31916 CCCN(CC)S(=O)(=O)c1ccc(cc1)NC(=O)C 40a_100000226822_100000700920 [1,0,0,0,0,1|1,0,0]=3 2083 B19R1.31916 CCN(CCO)S(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100000210973_100000740367 [1,0,0,0,0,1|1,0,0]=3 2084 B19R1.31916 CCN(CCO)S(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100000210973_100000740367 [1,0,0,0,0,1|1,0,0]=3 2085 B19R1.31916 CCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)C 270084a_100000210973_100000210752 [1,0,0,0,0,1|2,0,0]=4 2086 B19R1.31916 CCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_100000210973_100000210752 [1,0,0,0,0,1|2,0,0]=4 2087 B19R1.31916 CCN(CCO)S(=O)(=O)c1ccc(cc1)NC(=O)C 40a_100000210973_100000700920 [1,0,0,0,0,1|2,0,0]=4 2088 B19R1.178886 CCCN(CC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 270084a_100000226822_100000735625 [1,0,0,0,0,1|1,0,1]=4 2089 B19R1.178886 CCCN(CC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 274078a_100000226822_100000735625 [1,0,0,0,0,1|1,0,1]=4 2090 B19R1.178886 CCCN(CC)S(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 40a_100000226822_100015196453 [1,0,0,0,0,1|1,0,1]=4 2091 B19R1.317756 C=Cc1ccc(cc1)S(=O)(=O)NC(CCC)CCC 270084a_100011207992_100000034458 [1,0,0,0,0,1|2,0,0]=4 2092 B19R1.317756 C=Cc1ccc(cc1)S(=O)(=O)NC(CCC)CCC 274078a_100011207992_100000034458 [1,0,0,0,0,1|2,0,0]=4 2093 B19R1.317756 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C=O 270084a_100011207992_100000045293 [1,0,0,0,0,1|1,0,0]=3 2094 B19R1.317756 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)C=O 274078a_100011207992_100000045293 [1,0,0,0,0,1|1,0,0]=3 2095 B19R1.317756 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C=O 270084a_100015193777_100000045293 [1,0,0,0,0,1|2,0,0]=4 2096 B19R1.317756 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)C=O 274078a_100015193777_100000045293 [1,0,0,0,0,1|2,0,0]=4 2097 B19R1.528567 CCCN(CCC)S(=O)(=O)Cc1ccc(cc1)C#N 270084a_100000210455_100000222202 [1,0,0,0,0,1|1,0,1]=4 2098 B19R1.528567 CCCN(CCC)S(=O)(=O)Cc1ccc(cc1)C#N 274078a_100000210455_100000222202 [1,0,0,0,0,1|1,0,1]=4 2099 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)NC(=O)C 11a_100000210455_100000185149 [1,0,0,0,0,1|2,0,0]=4 2100 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)NC(=O)C 11a_100000287633_100015343762 [1,0,0,0,0,1|2,0,0]=4 2101 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)NC(=O)C 1626a_100000210455_100000185149 [1,0,0,0,0,1|2,0,0]=4 2102 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)NC(=O)C 1626a_100000287633_100015343762 [1,0,0,0,0,1|2,0,0]=4 2103 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)NC(=O)C 22a_100000287633_100000070787 [1,0,0,0,0,1|2,0,0]=4 2104 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)NC(=O)C 240690a_100000210455_100000185149 [1,0,0,0,0,1|2,0,0]=4 2105 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)NC(=O)C 527a_100000210455_100000185149 [1,0,0,0,0,1|2,0,0]=4 2106 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)NC(=O)C 527a_100000287633_100103153847 [1,0,0,0,0,1|2,0,0]=4 2107 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)OC(=O)C 11a_100000210455_100000188978 [1,0,0,0,0,1|2,0,0]=4 2108 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)OC(=O)C 1626a_100000210455_100000188978 [1,0,0,0,0,1|2,0,0]=4 2109 B19R1.60288 CCCN(CCC)C(=O)c1ccc(cc1)OC(=O)C 240690a_100000210455_100000188978 [1,0,0,0,0,1|2,0,0]=4 2110 B19R1.86245 CCCN(CCC)C(=O)Nc1ccc(cc1)C(=O)N 2430a_100000210537_100000210455 [1,0,0,0,0,1|2,0,0]=4 2111 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)C(=O)C 1458a_100000590323_200000210301 [0,0,0,0,1,1|1,0,0]=3 2112 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)C(=O)C 270084a_100000210455_100000681846 [0,0,0,0,1,1|1,0,0]=3 2113 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)C(=O)C 274078a_100000210455_100000681846 [0,0,0,0,1,1|1,0,0]=3 2114 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)C(=O)N 40a_100000210455_200010577599 [0,0,0,0,1,1|1,0,0]=3 2115 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)C(=O)O 270084a_100000210455_100000182766 [0,0,0,0,1,1|0,0,0]=2 2116 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)C(=O)O 274078a_100000210455_100000182766 [0,0,0,0,1,1|0,0,0]=2 2117 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)C(=O)O 40a_100000210455_100000023039 [0,0,0,0,1,1|0,0,0]=2 2118 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)C(=O)[13CH3] 1458a_100000590323_200025704644 [0,0,0,0,1,1|1,0,0]=3 2119 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)[N+](=O)[O-] 270084a_100000210455_100000183757 [0,0,0,0,1,1|1,0,1]=4 2120 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)[N+](=O)[O-] 274078a_100000210455_100000183757 [0,0,0,0,1,1|1,0,1]=4 2121 B19R1.59553 CCCN(CCC)S(=O)(=O)c1cccc(c1)[N+](=O)[O-] 40a_100000210455_100000701557 [0,0,0,0,1,1|1,0,1]=4 2122 B19R1.59553 CCCN(CCO)S(=O)(=O)c1cccc(c1)C(=O)C 270084a_100000211420_100000681846 [0,0,0,0,1,1|2,0,0]=4 2123 B19R1.59553 CCCN(CCO)S(=O)(=O)c1cccc(c1)C(=O)C 274078a_100000211420_100000681846 [0,0,0,0,1,1|2,0,0]=4 2124 B19R1.59553 CCCN(CCO)S(=O)(=O)c1cccc(c1)C(=O)N 40a_100000211420_200010577599 [0,0,0,0,1,1|2,0,0]=4 2125 B19R1.59553 CCCN(CCO)S(=O)(=O)c1cccc(c1)C(=O)O 270084a_100000211420_100000182766 [0,0,0,0,1,1|1,0,0]=3 2126 B19R1.59553 CCCN(CCO)S(=O)(=O)c1cccc(c1)C(=O)O 274078a_100000211420_100000182766 [0,0,0,0,1,1|1,0,0]=3 2127 B19R1.59553 CCCN(CCO)S(=O)(=O)c1cccc(c1)C(=O)O 40a_100000211420_100000023039 [0,0,0,0,1,1|1,0,0]=3 2128 B19R1.59553 O=C(O)c1cccc(c1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000182766 [0,0,0,0,1,1|2,0,0]=4 2129 B19R1.59553 O=C(O)c1cccc(c1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000182766 [0,0,0,0,1,1|2,0,0]=4 2130 B19R1.59553 O=C(O)c1cccc(c1)S(=O)(=O)N(CCO)CCO 40a_100000210587_100000023039 [0,0,0,0,1,1|2,0,0]=4 2131 B21R1.88666 CCCN(CCC)S(=O)(=O)c1ccc(cc1)/C=C/C(=O)O 270084a_100000210455_100000682431 [0,0,0,0,0,2|0,0,0]=2 2132 B21R1.88666 CCCN(CCC)S(=O)(=O)c1ccc(cc1)/C=C/C(=O)O 274078a_100000210455_100000682431 [0,0,0,0,0,2|0,0,0]=2 2133 B21R1.88666 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CCC(=O)O 270084a_100000210455_100000206002 [0,0,0,0,0,2|0,0,0]=2 2134 B21R1.88666 CCCN(CCC)S(=O)(=O)c1ccc(cc1)CCC(=O)O 274078a_100000210455_100000206002 [0,0,0,0,0,2|0,0,0]=2 2135 B21R1.88666 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OCC(=O)N 270084a_100000210455_100011361753 [0,0,0,0,0,2|1,0,0]=3 2136 B21R1.88666 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OCC(=O)N 274078a_100000210455_100011361753 [0,0,0,0,0,2|1,0,0]=3 2137 B21R1.88666 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OCC(=O)O 270084a_100000210455_100000738494 [0,0,0,0,0,2|0,0,0]=2 2138 B21R1.88666 CCCN(CCC)S(=O)(=O)c1ccc(cc1)OCC(=O)O 274078a_100000210455_100000738494 [0,0,0,0,0,2|0,0,0]=2 2139 B21R1.88666 CCCN(CCO)S(=O)(=O)c1ccc(cc1)/C=C/C(=O)O 270084a_100000211420_100000682431 [0,0,0,0,0,2|1,0,0]=3 2140 B21R1.88666 CCCN(CCO)S(=O)(=O)c1ccc(cc1)/C=C/C(=O)O 274078a_100000211420_100000682431 [0,0,0,0,0,2|1,0,0]=3 2141 B21R1.88666 CCCN(CCO)S(=O)(=O)c1ccc(cc1)CCC(=O)O 270084a_100000211420_100000206002 [0,0,0,0,0,2|1,0,0]=3 2142 B21R1.88666 CCCN(CCO)S(=O)(=O)c1ccc(cc1)CCC(=O)O 274078a_100000211420_100000206002 [0,0,0,0,0,2|1,0,0]=3 2143 B21R1.88666 CCCN(CCO)S(=O)(=O)c1ccc(cc1)OCC(=O)N 270084a_100000211420_100011361753 [0,0,0,0,0,2|2,0,0]=4 2144 B21R1.88666 CCCN(CCO)S(=O)(=O)c1ccc(cc1)OCC(=O)N 274078a_100000211420_100011361753 [0,0,0,0,0,2|2,0,0]=4 2145 B21R1.88666 CCCN(CCO)S(=O)(=O)c1ccc(cc1)OCC(=O)O 270084a_100000211420_100000738494 [0,0,0,0,0,2|1,0,0]=3 2146 B21R1.88666 CCCN(CCO)S(=O)(=O)c1ccc(cc1)OCC(=O)O 274078a_100000211420_100000738494 [0,0,0,0,0,2|1,0,0]=3 2147 B21R1.88666 O=C(O)/C=C/c1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000682431 [0,0,0,0,0,2|2,0,0]=4 2148 B21R1.88666 O=C(O)/C=C/c1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000682431 [0,0,0,0,0,2|2,0,0]=4 2149 B21R1.88666 O=C(O)CCc1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000206002 [0,0,0,0,0,2|2,0,0]=4 2150 B21R1.88666 O=C(O)CCc1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000206002 [0,0,0,0,0,2|2,0,0]=4 2151 B21R1.88666 O=C(O)COc1ccc(cc1)S(=O)(=O)N(CCO)CCO 270084a_100000210587_100000738494 [0,0,0,0,0,2|2,0,0]=4 2152 B21R1.88666 O=C(O)COc1ccc(cc1)S(=O)(=O)N(CCO)CCO 274078a_100000210587_100000738494 [0,0,0,0,0,2|2,0,0]=4 2153 B21R1.703006 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100011207992_100000740367 [0,0,0,0,0,2|1,0,0]=3 2154 B21R1.703006 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100011207992_100000740367 [0,0,0,0,0,2|1,0,0]=3 2155 B21R1.703006 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)NC(=O)C 270084a_100011207992_100000210752 [0,0,0,0,0,2|2,0,0]=4 2156 B21R1.703006 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)NC(=O)C 274078a_100011207992_100000210752 [0,0,0,0,0,2|2,0,0]=4 2157 B21R1.703006 CCCC(CCC)NS(=O)(=O)c1ccc(cc1)NC(=O)C 40a_100011207992_100000700920 [0,0,0,0,0,2|2,0,0]=4 2158 B21R1.703006 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100015193777_100000740367 [0,0,0,0,0,2|2,0,0]=4 2159 B21R1.703006 CCC[C@@H](CCO)NS(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100015193777_100000740367 [0,0,0,0,0,2|2,0,0]=4