0 B13R1.52 COC1=C(C=CC(=C1)CC(=O)N)C Z194976376 [0,0,0,0,0,0|2,0,1]=3 1 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)Br Z1269221903 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)C Z168876634 [0,0,0,0,0,0|3,0,1]=4 3 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)Cl Z1269148038 [0,0,0,0,0,0|3,0,1]=4 4 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)N Z4184587402 [0,0,0,0,0,0|3,0,1]=4 5 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)O Z1203162033 [0,0,0,0,0,0|2,0,1]=3 6 B13R1.52 COC1=C(C=CC(=C1)CC(C)N)O Z4119887033 [0,0,0,0,0,0|0,0,0]=0 7 B13R1.52 COC1=C(C=CC(=C1)CN(C)C)O Z2177030804 [0,0,0,0,0,0|2,0,0]=2 8 B13R1.52 COC1=C(C=CC(=C1)NC(=O)C)N Z278204678 [0,0,0,0,0,0|3,0,1]=4 9 B13R1.52 COC1=C(C=CC(=C1)NC(=O)N)Br Z1321379839 [0,0,0,0,0,0|3,0,1]=4 10 B13R1.52 COC1=C(C=CC(=C1)NC(=O)N)F Z1763025566 [0,0,0,0,0,0|3,0,1]=4 11 B13R1.52 COC1=C(C=CC(=C1)OC(F)F)Br Z1269229836 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.19 CC(=O)CC1=CC(=C(C=C1)O)Br Z1269192817 [1,0,0,0,0,0|2,0,1]=4 13 B12R1.19 CC(N)CC1=CC(=C(C=C1)F)Br Z285144030 [1,0,0,0,0,0|2,0,0]=3 14 B12R1.19 CC(N)CC1=CC(=C(C=C1)O)O Z1891776857 [1,0,0,0,0,0|0,0,0]=1 15 B12R1.19 CC(O)CC1=CC(=C(C=C1)Br)F Z1295686053 [1,0,0,0,0,0|3,0,0]=4 16 B12R1.19 CC1=C(C=C(C=C1)CC(C)N)F Z4098107054 [1,0,0,0,0,0|2,0,0]=3 17 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [1,0,0,0,0,0|2,0,1]=4 18 B12R1.19 CC1=C(C=CC(=C1)CN(C)C)N Z335289244 [1,0,0,0,0,0|3,0,0]=4 19 B12R1.19 CC1=C(C=CC(=C1)OC(C)C)N Z239604804 [1,0,0,0,0,0|3,0,0]=4 20 B12R1.19 CN(C)CC1=CC(=C(C=C1)O)Cl Z1945695050 [1,0,0,0,0,0|3,0,0]=4 21 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [1,0,0,0,0,0|2,0,1]=4 22 B12R1.286 C/C=C/C1=CC(=C(C=C1)O)OC Z57953030 [1,0,0,0,0,0|0,0,2]=3 23 B12R1.286 C=CCC1=CC(=C(C=C1)O)OC Z56347226 [1,0,0,0,0,0|0,0,2]=3 24 B12R1.286 CC1=C(C=C(C=C1)CCN)C#N Z3614117785 [1,0,0,0,0,0|3,0,0]=4 25 B12R1.286 CCCC1=CC(=C(C=C1)N)C#N Z1532769937 [1,0,0,0,0,0|3,0,0]=4 26 B12R1.286 CCCC1=CC(=C(C=C1)O)CO Z1513840121 [1,0,0,0,0,0|2,0,0]=3 27 B12R1.286 CCOC1=CC(=C(C=C1)O)C=O Z56347093 [1,0,0,0,0,0|3,0,0]=4 28 B12R1.286 CCOC1=NC(=C(C=C1)N)OC Z3858525756 [1,0,0,0,0,0|3,0,0]=4 29 B12R1.286 CNCC1=CC(=C(C=C1)O)OC Z425387552 [1,0,0,0,0,0|1,0,0]=2 30 B12R1.286 COC1=C(C=CC(=C1)CC#N)C Z168876640 [1,0,0,0,0,0|1,0,2]=4 31 B12R1.286 COC1=C(C=CC(=C1)CCN)C Z1198167712 [1,0,0,0,0,0|1,0,0]=2 32 B12R1.286 COC1=C(C=CC(=C1)CCN)O Z1268152336 [1,0,0,0,0,0|0,0,0]=1 33 B12R1.286 NCCC1=CC(=C(C=C1)O)CO Z1262658266 [1,0,0,0,0,0|2,0,0]=3 34 B12R1.438 COC1=CC(=CC=C1)CC(=N)N Z951367838 [1,0,0,0,0,0|1,0,1]=3 35 B12R1.438 COC1=CC(=CC=C1)CC(=O)N Z33547068 [1,0,0,0,0,0|1,0,1]=3 36 B12R1.438 COC1=CC(=CC=C1)CC(=O)O Z104478986 [1,0,0,0,0,0|2,0,1]=4 37 B12R1.438 COC1=CC(=CC=C1)NC(=O)C Z27795266 [1,0,0,0,0,0|2,0,1]=4 38 B12R1.438 COC1=CC(=CC=C1)NC(=S)N Z56913186 [1,0,0,0,0,0|2,0,1]=4 39 B14R1.881 COC1=C(C=C(C(=C1)CC(=O)O)F)O Z1416167707 [0,1,0,0,0,0|2,0,1]=4 40 B14R1.3405 CNC(=O)CC1=CC(=C(C=C1)C)OC Z196429244 [0,1,0,0,0,0|2,0,1]=4 41 B14R1.3405 COC(=O)CC1=CC(=C(C=C1)Br)OC Z1269111416 [0,1,0,0,0,0|2,0,1]=4 42 B14R1.3405 COC(=O)CC1=CC(=C(C=C1)N)OC Z4188012656 [0,1,0,0,0,0|2,0,1]=4 43 B14R1.3405 COC(=O)CC1=CC(=C(C=C1)O)OC Z1198150768 [0,1,0,0,0,0|1,0,1]=3 44 B14R1.3405 COC1=C(C=CC(=C1)CC(=O)CO)O Z1513806392 [0,1,0,0,0,0|1,0,1]=3 45 B14R1.3651 COC1=C(C=C(C=C1)/C=[N+](/C)\[O-])OC Z56920101 [0,1,0,0,0,0|2,0,1]=4 46 B14R1.3651 COC1=C(C=C(C=C1)CC(=O)N)OC Z33546771 [0,1,0,0,0,0|1,0,1]=3 47 B14R1.3651 COC1=C(C=C(C=C1)CC(=O)O)OC Z56924495 [0,1,0,0,0,0|2,0,1]=4 48 B14R1.3651 COC1=C(C=C(C=C1)CC(=S)N)OC Z235363001 [0,1,0,0,0,0|1,0,1]=3 49 B14R1.3651 COC1=C(C=C(C=C1)NC(=N)N)OC Z3785974910 [0,1,0,0,0,0|2,0,1]=4 50 B14R1.3651 COC1=C(C=C(C=C1)NC(=O)C)OC Z30849291 [0,1,0,0,0,0|2,0,1]=4 51 B14R1.3651 COC1=C(C=C(C=C1)NC(=S)C)OC Z56757210 [0,1,0,0,0,0|2,0,1]=4 52 B14R1.3651 COC1=C(C=C(C=C1)NC(=S)N)OC Z235362229 [0,1,0,0,0,0|2,0,1]=4 53 B14R1.3651 COC1=C(C=C(C=C1)NC(C)C)OC Z266654414 [0,1,0,0,0,0|2,0,0]=3 54 B14R2.1008 CC(=O)NC1=CC2=C(C=C1)OCO2 Z27647423 [0,0,0,1,0,0|2,0,1]=4 55 B14R2.1008 CC(=S)NC1=CC2=C(C=C1)OCO2 Z56764111 [0,0,0,1,0,0|2,0,1]=4 56 B14R2.1008 C[C@@H](O)CC1=CC2=C(C=C1)OCO2 Z1198314644 [0,0,0,1,0,0|1,0,0]=2 57 B14R2.1008 C[C@H](O)CC1=CC2=C(C=C1)OCO2 Z1650168507 [0,0,0,1,0,0|1,0,0]=2 58 B14R2.1008 NC(=O)NC1=CC2=C(C=C1)OCO2 Z107732962 [0,0,0,1,0,0|2,0,1]=4 59 B14R2.1008 NC(=S)NC1=CC2=C(C=C1)OCO2 Z291278954 [0,0,0,1,0,0|2,0,1]=4 60 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCO2 Z274782846 [0,0,0,1,0,0|2,0,1]=4 61 B12R1.56 CC(C)C1=CC(=C(C=C1)O)C=O Z336080488 [0,0,0,0,1,0|3,0,0]=4 62 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)Cl Z1198331246 [0,0,0,0,1,0|2,0,1]=4 63 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)F Z1201620068 [0,0,0,0,1,0|2,0,1]=4 64 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)O Z57234303 [0,0,0,0,1,0|1,0,1]=3 65 B12R1.56 COC1=C(C=CC(=C1)C(=O)N)F Z1198168690 [0,0,0,0,1,0|2,0,1]=4 66 B12R1.56 COC1=C(C=CC(=C1)C(=O)N)N Z1126160967 [0,0,0,0,1,0|2,0,1]=4 67 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)O Z381356666 [0,0,0,0,1,0|2,0,1]=4 68 B12R1.56 COC1=C(C=CC(=C1)C(C)C)C Z54854001 [0,0,0,0,1,0|2,0,0]=3 69 B12R1.56 COC1=C(C=CC(=C1)C(C)N)F Z1198747325 [0,0,0,0,1,0|1,0,0]=2 70 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])O Z415740558 [0,0,0,0,1,0|3,0,0]=4 71 B14R1.42 COC1=C(C=CC(=C1)/C=C/C(C)O)O Z1513917280 [0,0,0,0,0,1|1,0,1]=3 72 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)C)O Z1255442373 [0,0,0,0,0,1|1,0,1]=3 73 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)O Z317038020 [0,0,0,0,0,1|2,0,1]=4 74 B14R1.42 COC1=C(C=CC(=C1)CCC(C)N)O Z3324923673 [0,0,0,0,0,1|0,0,0]=1 75 B11R1.20 CC(C)CC1=CC=C(C=C1)N Z1463350056 [2,0,0,0,0,0|2,0,0]=4 76 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [2,0,0,0,0,0|0,0,0]=2 77 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [2,0,0,0,0,0|2,0,0]=4 78 B11R1.157 CC(C)NC1=CC(=CC=C1)O Z335562192 [2,0,0,0,0,0|2,0,0]=4 79 B11R1.157 CC(C)OC1=CC(=CC=C1)O Z381415570 [2,0,0,0,0,0|2,0,0]=4 80 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [2,0,0,0,0,0|1,0,0]=3 81 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [2,0,0,0,0,0|1,0,0]=3 82 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [2,0,0,0,0,0|0,0,0]=2 83 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [2,0,0,0,0,0|2,0,0]=4 84 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [2,0,0,0,0,0|1,0,1]=4 85 B11R1.192 CC1=C(C=C(C=C1)CCN)C Z2526366647 [2,0,0,0,0,0|1,0,0]=3 86 B11R1.192 CC1=C(C=C(C=C1)CCN)Cl Z4330614334 [2,0,0,0,0,0|2,0,0]=4 87 B11R1.192 CC1=C(C=CC(=C1)CC#N)O Z1255368240 [2,0,0,0,0,0|0,0,2]=4 88 B11R1.192 CC1=C(C=CC(=C1)CCN)Br Z1269233616 [2,0,0,0,0,0|1,0,0]=3 89 B11R1.192 CC1=C(C=CC(=C1)CCN)Cl Z1198178622 [2,0,0,0,0,0|1,0,0]=3 90 B11R1.192 CC1=C(C=CC(=C1)CCN)F Z1682072426 [2,0,0,0,0,0|1,0,0]=3 91 B11R1.192 CCNC1=CC(=C(C=C1)C)C Z5214919889 [2,0,0,0,0,0|2,0,0]=4 92 B11R1.192 CCNC1=CC(=C(C=C1)F)C Z2756154226 [2,0,0,0,0,0|2,0,0]=4 93 B11R1.192 CNCC1=CC(=C(C=C1)C)C Z2238897979 [2,0,0,0,0,0|2,0,0]=4 94 B11R1.192 CNCC1=CC(=C(C=C1)F)C Z1873867371 [2,0,0,0,0,0|2,0,0]=4 95 B11R1.192 NCCC1=CC(=C(C=C1)Br)Cl Z5222342336 [2,0,0,0,0,0|2,0,0]=4 96 B11R1.192 NCCC1=CC(=C(C=C1)Cl)Cl Z285143770 [2,0,0,0,0,0|2,0,0]=4 97 B11R1.192 NCCC1=CC(=C(C=C1)Cl)F Z2681241887 [2,0,0,0,0,0|2,0,0]=4 98 B11R1.192 NCCC1=CC(=C(C=C1)F)Br Z752370708 [2,0,0,0,0,0|2,0,0]=4 99 B11R1.192 NCCC1=CC(=C(C=C1)F)Cl Z4607148848 [2,0,0,0,0,0|2,0,0]=4 100 B11R1.192 NCCC1=CC(=C(C=C1)F)F Z1695670002 [2,0,0,0,0,0|2,0,0]=4 101 B11R1.192 NCCC1=CC(=C(C=C1)O)O Z104474032 [2,0,0,0,0,0|0,0,0]=2 102 B11R1.192 OCCC1=CC(=C(C=C1)O)Cl Z1250886915 [2,0,0,0,0,0|2,0,0]=4 103 B11R1.189 CCC1=CC(=CC=C1)CNC Z6010478687 [2,0,0,0,0,0|2,0,0]=4 104 B11R1.189 CCCC1=CC(=CC=C1)C=O Z1216844686 [2,0,0,0,0,0|2,0,0]=4 105 B11R1.189 CCNC1=CC(=CC=C1)CC Z5510285279 [2,0,0,0,0,0|2,0,0]=4 106 B11R1.189 CCNC1=CC(=CC=C1)OC Z286367386 [2,0,0,0,0,0|1,0,0]=3 107 B11R1.189 CNCC1=CC(=CC=C1)OC Z56939284 [2,0,0,0,0,0|1,0,0]=3 108 B11R1.189 CNCC1=CC(=CN=C1)OC Z1255362175 [2,0,0,0,0,0|2,0,0]=4 109 B11R1.189 CNCC1=CC(=NC=C1)OC Z5851214102 [2,0,0,0,0,0|2,0,0]=4 110 B11R1.189 CNCC1=NC(=CC=C1)OC Z4595018713 [2,0,0,0,0,0|2,0,0]=4 111 B11R1.189 COC1=CC(=CC=C1)CC#N Z285184582 [2,0,0,0,0,0|0,0,2]=4 112 B11R1.189 COC1=CC(=CC=C1)CCN Z285143778 [2,0,0,0,0,0|0,0,0]=2 113 B11R1.189 COC1=NC(=CC=C1)CCN Z1139189688 [2,0,0,0,0,0|1,0,0]=3 114 B11R1.189 COC1=NC(=NC=C1)CCN Z3678332979 [2,0,0,0,0,0|2,0,0]=4 115 B11R1.189 COC1=NC=CC(=C1)CCN Z2298160753 [2,0,0,0,0,0|1,0,0]=3 116 B11R1.189 CSC1=CC(=CC=C1)CCN Z4873760169 [2,0,0,0,0,0|0,1,0]=3 117 B11R1.189 N#CC1=CC=CC(=C1)CCN Z1983080032 [2,0,0,0,0,0|2,0,0]=4 118 B11R1.189 NCCC1=CC(=CC=C1)CO Z4741652081 [2,0,0,0,0,0|2,0,0]=4 119 B11R1.280 CCC1=CC(=C(C=C1)O)C=O Z979493236 [2,0,0,0,0,0|2,0,0]=4 120 B11R1.280 CCC1=CC(=C(C=C1)O)OC Z57234301 [2,0,0,0,0,0|0,0,0]=2 121 B11R1.280 CNC1=CC(=C(C=C1)C)OC Z5981152945 [2,0,0,0,0,0|2,0,0]=4 122 B11R1.280 COC1=C(C=CC(=C1)C#N)O Z56963393 [2,0,0,0,0,0|0,0,2]=4 123 B11R1.280 COC1=C(C=CC(=C1)C=O)O Z57772449 [2,0,0,0,0,0|1,0,1]=4 124 B11R1.280 COC1=C(C=CC(=C1)CN)C Z812517018 [2,0,0,0,0,0|1,0,0]=3 125 B11R1.280 COC1=C(C=CC(=C1)CN)F Z3235016255 [2,0,0,0,0,0|1,0,0]=3 126 B11R1.280 COC1=C(C=CC(=C1)CN)N Z3223855819 [2,0,0,0,0,0|1,0,0]=3 127 B11R1.280 COC1=C(C=CC(=C1)CN)O Z381785798 [2,0,0,0,0,0|0,0,0]=2 128 B11R1.280 COC1=C(C=CC(=C1)CO)C Z397587200 [2,0,0,0,0,0|2,0,0]=4 129 B11R1.280 COC1=C(C=CC(=C1)CO)Cl Z1255366940 [2,0,0,0,0,0|2,0,0]=4 130 B11R1.280 COC1=C(C=CC(=C1)CO)F Z1201620066 [2,0,0,0,0,0|2,0,0]=4 131 B11R1.280 COC1=C(C=CC(=C1)CO)O Z56347244 [2,0,0,0,0,0|1,0,0]=3 132 B11R1.280 COC1=C(C=CC(=C1)SC)N Z1147225829 [2,0,0,0,0,0|2,0,0]=4 133 B11R1.280 COC1=CC(=C(C=C1)Br)OC Z299596224 [2,0,0,0,0,0|2,0,0]=4 134 B11R1.280 COC1=CC(=C(C=C1)N)OC Z104478344 [2,0,0,0,0,0|2,0,0]=4 135 B13R1.35 COC1=C(C=C(C=C1)CC(C)N)O Z4574899614 [1,1,0,0,0,0|0,0,0]=2 136 B13R1.510 CC(N)C(O)C1=CC(=C(C=C1)F)F Z1342208384 [1,1,0,0,0,0|2,0,0]=4 137 B13R1.510 CC1=C(C=CC(=C1)C(O)C(C)N)F Z4133752082 [1,1,0,0,0,0|1,0,0]=3 138 B13R1.518 CC(C)(N)CC1=CC(=C(C=C1)F)O Z5336269159 [1,1,0,0,0,0|1,0,0]=3 139 B13R1.518 CC1=C(C=CC(=C1)CC(C)(C)N)Br Z2182115428 [1,1,0,0,0,0|1,0,0]=3 140 B13R1.518 CC1=C(C=CC(=C1)CC(F)(F)F)O Z1255403482 [1,1,0,0,0,0|2,0,0]=4 141 B13R1.876 CC(N)CC1=C(C=C(C(=C1)F)F)F Z4092809107 [1,1,0,0,0,0|2,0,0]=4 142 B13R1.2879 CC1=C(C=C(C=C1)CC(N)CO)C Z2255081939 [1,1,0,0,0,0|1,0,0]=3 143 B13R1.49 CCC(C)C1=CC(=C(C=C1)O)C=O Z1198159909 [1,1,0,0,0,0|2,0,0]=4 144 B13R1.49 COC(=O)C1=CC(=C(C=C1)O)OC Z104500600 [1,1,0,0,0,0|1,0,1]=4 145 B13R1.49 COC1=C(C=CC(=C1)C(=O)CN)O Z4654934301 [1,1,0,0,0,0|0,0,1]=3 146 B13R1.49 COC1=C(C=CC(=C1)C(O)CN)O Z2574937385 [1,1,0,0,0,0|0,0,0]=2 147 B13R1.384 CCOC1=CC(=C(C=C1)N)OCC Z3211605347 [1,1,0,0,0,0|2,0,0]=4 148 B13R1.386 C=CCC1=CC(=C(C=C1)OC)OC Z1255398904 [1,1,0,0,0,0|0,0,2]=4 149 B13R1.386 CCNC1=CC(=C(C=C1)OC)OC Z286407122 [1,1,0,0,0,0|1,0,0]=3 150 B13R1.386 CNCC1=CC(=C(C=C1)OC)OC Z56173976 [1,1,0,0,0,0|1,0,0]=3 151 B13R1.386 CNCC1=CC(=C(C=C1)SC)OC Z926900228 [1,1,0,0,0,0|1,1,0]=4 152 B13R1.386 COC1=C(C=C(C=C1)CC#N)OC Z104477288 [1,1,0,0,0,0|0,0,2]=4 153 B13R1.386 COC1=C(C=C(C=C1)CC=O)OC Z1020779916 [1,1,0,0,0,0|1,0,1]=4 154 B13R1.386 COC1=C(C=C(C=C1)CCN)OC Z104477298 [1,1,0,0,0,0|0,0,0]=2 155 B13R1.386 COC1=C(C=C(C=C1)CCO)OC Z397587464 [1,1,0,0,0,0|1,0,0]=3 156 B13R1.387 NCCC1=CC(=C(C=C1)O)[N+](=O)[O-] Z3717955584 [1,1,0,0,0,0|2,0,0]=4 157 B13R1.575 CCCCC1=CC(=C(C=C1)O)C=O Z1504264331 [1,1,0,0,0,0|2,0,0]=4 158 B13R1.575 CNCCC1=CC(=C(C=C1)O)OC Z4437707719 [1,1,0,0,0,0|0,0,0]=2 159 B13R1.575 COCCC1=CC(=C(C=C1)O)C=O Z979493242 [1,1,0,0,0,0|2,0,0]=4 160 B13R1.1255 CNCC1=C(C(=C(C=C1)F)OC)F Z5597727786 [1,1,0,0,0,0|2,0,0]=4 161 B13R1.1255 COC1=C(C(=CC=C1F)CCN)F Z5620691798 [1,1,0,0,0,0|1,0,0]=3 162 B13R1.1255 COC1=C(C(=NC=C1C)CCN)C Z4990375082 [1,1,0,0,0,0|2,0,0]=4 163 B13R1.56 COC1=CC(=CC(=C1)F)CC(C)N Z2240804320 [1,1,0,0,0,0|0,0,0]=2 164 B13R1.80 COC1=CC(=CC=C1)CS(=O)(=O)N Z954606354 [1,1,0,0,0,0|2,0,0]=4 165 B13R1.81 CNC(=O)CC1=CC(=CC=C1)OC Z32016972 [1,1,0,0,0,0|1,0,1]=4 166 B13R1.81 COC1=CC(=CC=C1)CC(=O)CCl Z1255424725 [1,1,0,0,0,0|1,0,1]=4 167 B13R1.81 COC1=CC(=CC=C1)OC(C)CN Z844631912 [1,1,0,0,0,0|1,0,0]=3 168 B13R1.97 COC1=CC(=C(C=C1)O)CC(C)N Z4167757598 [1,1,0,0,0,0|0,0,0]=2 169 B13R1.587 CC(=O)C1=CC=CC(=C1)CC(C)C Z1171158405 [1,1,0,0,0,0|2,0,0]=4 170 B13R1.13 CC(N)C1=CC(=C(C=C1)O)C(=O)N Z5385355796 [0,1,0,0,1,0|2,0,0]=4 171 B13R1.50 COC1=C(C=CC(=C1)C(C)(C)C)O Z1255435164 [0,1,0,0,1,0|1,0,0]=3 172 B13R1.50 COC1=C(C=CC(=C1)S(=O)(=O)N)O Z1269225101 [0,1,0,0,1,0|2,0,0]=4 173 B13R1.651 COC1=C(C=C(C(=C1)C(=O)C)F)O Z1255399946 [0,1,0,0,1,0|1,0,1]=4 174 B13R1.651 COC1=C(C=C(C(=C1)C(=O)C)O)O Z1416187799 [0,1,0,0,1,0|1,0,1]=4 175 B13R1.3091 C=C(C)C1=CC(=C(C=C1)OC)OC Z1238836374 [0,1,0,0,1,0|1,0,1]=4 176 B13R1.3091 COC1=C(C=C(C=C1)C(=O)C)OC Z54182939 [0,1,0,0,1,0|1,0,1]=4 177 B13R1.3091 COC1=C(C=C(C=C1)C(=O)N)OC Z33546772 [0,1,0,0,1,0|1,0,1]=4 178 B13R1.3091 COC1=C(C=C(C=C1)C(=S)N)OC Z56998594 [0,1,0,0,1,0|1,0,1]=4 179 B13R1.3091 COC1=C(C=C(C=C1)C(C)N)OC Z444350090 [0,1,0,0,1,0|0,0,0]=2 180 B13R1.3091 COC1=C(C=C(C=C1)C(C)O)OC Z228586178 [0,1,0,0,1,0|1,0,0]=3 181 B15R1.4027 COC1=C(C=CC(=C1)CNC(C)(C)C)O Z600397696 [0,1,0,0,0,1|1,0,0]=3 182 B15R1.12854 C=C(C)COC1=CC(=C(C=C1)OC)OC Z1578853098 [0,1,0,0,0,1|1,0,1]=4 183 B15R1.12854 COC1=C(C=C(C=C1)CCN(C)C)OC Z103749396 [0,1,0,0,0,1|2,0,0]=4 184 B15R1.12854 COC1=C(C=C(C=C1)CNC(=O)C)OC Z26441089 [0,1,0,0,0,1|1,0,1]=4 185 B15R1.12854 COC1=C(C=C(C=C1)CNC(C)C)OC Z3244908399 [0,1,0,0,0,1|1,0,0]=3 186 B15R1.1799 COC1=C(C=C(C(=C1)Br)CC(=O)N)OC Z94599756 [0,2,0,0,0,0|1,0,1]=4 187 B15R1.3769 CCC(=O)CC1=CC(=C(C=C1)OC)OC Z599781402 [0,2,0,0,0,0|1,0,1]=4 188 B15R1.3769 CCN(C)CC1=CC(=C(C=C1)OC)OC Z140667776 [0,2,0,0,0,0|2,0,0]=4 189 B15R1.3769 COC(=O)CC1=CC(=C(C=C1)OC)OC Z18487615 [0,2,0,0,0,0|1,0,1]=4 190 B15R1.3769 COC1=C(C=C(C=C1)C/C(=N/O)/N)OC Z285225850 [0,2,0,0,0,0|1,0,1]=4 191 B15R1.3769 COC1=C(C=C(C=C1)CC(=O)NO)OC Z59182048 [0,2,0,0,0,0|1,0,1]=4 192 B15R1.3769 COC1=C(C=C(C=C1)CC(C)CN)OC Z1233159532 [0,2,0,0,0,0|0,0,0]=2 193 B13R2.521 CC1=C(C=CC(=C1)CC2CO2)F Z1495386296 [1,0,0,1,0,0|2,0,0]=4 194 B13R2.522 CC1=C(C=C(C=C1)C2CC2N)C Z234897043 [1,0,0,1,0,0|1,0,0]=3 195 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)Cl)Cl Z2298098026 [1,0,0,1,0,0|2,0,0]=4 196 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)Cl)F Z2298098037 [1,0,0,1,0,0|2,0,0]=4 197 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)F)F Z2298098006 [1,0,0,1,0,0|2,0,0]=4 198 B13R2.449 BrCCC1=CC2=C(C=C1)OCC2 Z1250887262 [1,0,0,1,0,0|2,0,0]=4 199 B13R2.449 CNCC1=CC2=C(C=C1)OCC2 Z1889710317 [1,0,0,1,0,0|2,0,0]=4 200 B13R2.449 CNCC1=CC2=C(C=C1)OCO2 Z57307088 [1,0,0,1,0,0|1,0,0]=3 201 B13R2.449 N#CCC1=CC2=C(C=C1)OCO2 Z234894070 [1,0,0,1,0,0|0,0,2]=4 202 B13R2.449 NCCC1=CC2=C(C=C1)OC=C2 Z4327136974 [1,0,0,1,0,0|1,0,1]=4 203 B13R2.449 NCCC1=CC2=C(C=C1)OCC2 Z316119814 [1,0,0,1,0,0|1,0,0]=3 204 B13R2.449 NCCC1=CC2=C(C=C1)OCO2 Z94601334 [1,0,0,1,0,0|0,0,0]=2 205 B13R2.449 O=CCC1=CC2=C(C=C1)OCO2 Z1198331621 [1,0,0,1,0,0|1,0,1]=4 206 B13R2.599 COC1=C(C=C2CCCC2=C1)O Z1513818935 [1,0,0,1,0,0|0,0,0]=2 207 B13R2.599 COC1=C(C=C2COCC2=C1)Br Z3219627381 [1,0,0,1,0,0|2,0,0]=4 208 B13R2.599 O=CC1=C(C=C2CCCC2=C1)O Z1511780763 [1,0,0,1,0,0|2,0,0]=4 209 B13R2.81 COC1=CC(=CC=C1)[C@@H]2C[C@H]2N Z2236704792 [1,0,0,1,0,0|0,0,0]=2 210 B13R2.581 CC1CC2=C(N1)C(=CC=C2)C#N Z1551926164 [1,0,0,1,0,0|2,0,0]=4 211 B13R2.581 COC1=C2CC(CC2=CC=C1)N Z1255380738 [1,0,0,1,0,0|0,0,0]=2 212 B13R2.2121 COC1=CC2=C(C=C1)NC(=C2)C Z1197882538 [1,0,0,1,0,0|0,0,2]=4 213 B13R2.2121 COC1=CC2=C(C=C1)NC(=N2)C Z1587257377 [1,0,0,1,0,0|1,0,1]=4 214 B13R2.2121 COC1=CC2=C(C=C1)NC(C2)C Z1255421552 [1,0,0,1,0,0|0,0,0]=2 215 B13R2.2121 N#CC1=CC2=C(C=C1)CC(C2)N Z1255451461 [1,0,0,1,0,0|2,0,0]=4 216 B13R2.430 CC(=O)C1=CC2=C(C=C1)OCO2 Z104477826 [0,0,0,1,1,0|1,0,1]=4 217 B13R2.430 CC(N)C1=CC2=C(C=C1)CCC2 Z815264034 [0,0,0,1,1,0|2,0,0]=4 218 B13R2.430 CC(N)C1=CC2=C(C=C1)OCO2 Z221421640 [0,0,0,1,1,0|0,0,0]=2 219 B13R2.430 CC(O)C1=CC2=C(C=C1)OCC2 Z445987286 [0,0,0,1,1,0|2,0,0]=4 220 B13R2.430 C[C@@H](N)C1=CC2=C(C=C1)OCO2 Z360055458 [0,0,0,1,1,0|0,0,0]=2 221 B13R2.430 NC(=O)C1=CC2=C(C=C1)OCO2 Z33546650 [0,0,0,1,1,0|1,0,1]=4 222 B13R2.430 NC(=S)C1=CC2=C(C=C1)OCO2 Z381430268 [0,0,0,1,1,0|1,0,1]=4 223 B15R2.4522 COC1=C(C=CC(=C1)CNC2CC2)O Z86138868 [0,0,0,1,0,1|1,0,0]=3 224 B15R2.7688 CC(=O)CCC1=CC2=C(C=C1)OCO2 Z56795046 [0,0,0,1,0,1|1,0,1]=4 225 B15R2.7688 CC(N)CCC1=CC2=C(C=C1)OCO2 Z239627126 [0,0,0,1,0,1|0,0,0]=2 226 B15R2.7688 CC(O)CCC1=CC2=C(C=C1)OCO2 Z335245112 [0,0,0,1,0,1|1,0,0]=3 227 B15R2.4239 N=C(N)C(O)C1=CC2=C(C=C1)OCO2 Z2380344718 [0,1,0,1,0,0|1,0,1]=4 228 B15R2.4416 CCOC1=C(C=C2OC(CC2=C1)C)N Z166652130 [0,1,0,1,0,0|2,0,0]=4 229 B15R2.4343 CCC(O)CC1=CC2=C(C=C1)OCO2 Z1251358037 [0,1,0,1,0,0|1,0,0]=3 230 B15R2.42998 CC(C)(O)CC1=CC2=C(C=C1)OCO2 Z1198339912 [0,1,0,1,0,0|1,0,0]=3 231 B15R2.2035 COC1=C(C=C2OC(CC2=C1)C)C=O Z57054212 [0,1,0,1,0,0|1,0,1]=4 232 B15R2.2035 COC1=C(C=C2OC(CC2=C1)C)CN Z256773494 [0,1,0,1,0,0|2,0,0]=4 233 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)C Z57221419 [1,0,0,0,1,0|1,0,1]=4 234 B11R1.21 CC(C)C1=CC(=C(C=C1)O)N Z57441596 [1,0,0,0,1,0|2,0,0]=4 235 B11R1.21 CC(N)C1=CC(=C(C=C1)Br)F Z3213740225 [1,0,0,0,1,0|2,0,0]=4 236 B11R1.21 CC(N)C1=CC(=C(C=C1)Br)O Z1551939587 [1,0,0,0,1,0|1,0,0]=3 237 B11R1.21 CC(N)C1=CC(=C(C=C1)Cl)Cl Z56347253 [1,0,0,0,1,0|2,0,0]=4 238 B11R1.21 CC(N)C1=CC(=C(C=C1)Cl)F Z1198724032 [1,0,0,0,1,0|2,0,0]=4 239 B11R1.21 CC(N)C1=CC(=C(C=C1)F)Cl Z335437988 [1,0,0,0,1,0|2,0,0]=4 240 B11R1.21 CC(N)C1=CC(=C(C=C1)O)O Z4958589100 [1,0,0,0,1,0|0,0,0]=2 241 B11R1.21 CC1=C(C=C(C=C1)C(C)C)O Z104496566 [1,0,0,0,1,0|2,0,0]=4 242 B11R1.21 CC1=C(C=C(C=C1)C(C)N)C Z285186052 [1,0,0,0,1,0|1,0,0]=3 243 B11R1.21 CC1=C(C=C(C=C1)C(C)N)F Z363990474 [1,0,0,0,1,0|2,0,0]=4 244 B11R1.21 CC1=C(C=C(C=C1)[C@@H](C)O)C Z360055396 [1,0,0,0,1,0|2,0,0]=4 245 B11R1.21 CC1=C(C=C(C=C1)[C@H](C)O)C Z360055400 [1,0,0,0,1,0|2,0,0]=4 246 B11R1.21 CC1=C(C=CC(=C1)C(C)N)F Z1359429587 [1,0,0,0,1,0|1,0,0]=3 247 B11R1.21 CC1=C(C=CC(=C1)N(C)C)O Z4988450441 [1,0,0,0,1,0|2,0,0]=4 248 B11R1.21 C[C@@H](N)C1=CC(=C(C=C1)F)Br Z1696091701 [1,0,0,0,1,0|2,0,0]=4 249 B11R1.21 C[C@@H](N)C1=CC(=C(C=C1)F)Cl Z1127664214 [1,0,0,0,1,0|2,0,0]=4 250 B11R1.21 C[C@H](N)C1=CC(=C(C=C1)Cl)Cl Z1962166972 [1,0,0,0,1,0|2,0,0]=4 251 B11R1.21 C[C@H](N)C1=CC(=C(C=C1)F)Br Z360056272 [1,0,0,0,1,0|2,0,0]=4 252 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)O Z1198152898 [1,0,0,0,1,0|1,0,1]=4 253 B11R1.266 CNC1=CC(=CC=C1)C(C)C Z362639302 [1,0,0,0,1,0|2,0,0]=4 254 B11R1.266 COC1=CC(=CC=C1)C(=N)N Z1263714060 [1,0,0,0,1,0|1,0,1]=4 255 B11R1.266 COC1=CC(=CC=C1)C(=O)C Z54179675 [1,0,0,0,1,0|1,0,1]=4 256 B11R1.266 COC1=CC(=CC=C1)C(=S)N Z56950570 [1,0,0,0,1,0|1,0,1]=4 257 B11R1.266 COC1=CC(=CC=C1)C(C)O Z228586154 [1,0,0,0,1,0|1,0,0]=3 258 B11R1.266 COC1=CC(=CC=C1)[C@@H](C)O Z360055364 [1,0,0,0,1,0|1,0,0]=3 259 B11R1.266 COC1=CC(=CC=C1)[C@H](C)O Z360055368 [1,0,0,0,1,0|1,0,0]=3 260 B11R1.266 COC1=NC(=CC=C1)C(C)O Z1216820543 [1,0,0,0,1,0|2,0,0]=4 261 B13R1.643 COC1=CC(=CC=C1)CNC(=O)N Z198194944 [1,0,0,0,0,1|1,0,1]=4 262 B13R1.643 COC1=CC(=CC=C1)NCC(=O)N Z104592028 [1,0,0,0,0,1|1,0,1]=4 263 B13R1.643 COC1=CC(=CC=C1)SCC(=O)N Z290601360 [1,0,0,0,0,1|1,0,1]=4 264 B13R1.643 COC1=NC=CC(=C1)NCC(C)C Z1516116780 [1,0,0,0,0,1|2,0,0]=4