0 B12R2.24 C1=C(C=CC2=CC=CC=C12)O ACS015497 [0,0,0,0,0,0|1,0,3]=4 1 B12R2.24 C1N(CCC2=CC=CC=C12)N ACS019121 [0,0,0,0,0,0|3,0,0]=3 2 B12R2.24 Cc1ccc2ccccc2n1 ACS015496 [0,0,0,0,0,0|2,0,2]=4 3 B12R2.24 N1C(C=CC2=CN=CC=C12)=O ACS019125 [0,0,0,0,0,0|2,0,2]=4 4 B12R2.24 NC1=CC2=CC=CC=C2C=C1 ACS015421 [0,0,0,0,0,0|2,0,2]=4 5 B12R2.24 O1C2=C(NC(C1)=O)N=CC=C2 ACS023946 [0,0,0,0,0,0|3,0,0]=3 6 B12R2.24 O1CC(NC2=C1C=CC=C2)=O ACS011909 [0,0,0,0,0,0|2,0,0]=2 7 B12R2.24 c1ccc2c(c1)CCC(=O)O2 ACS015483 [0,0,0,0,0,0|0,0,0]=0 8 B11R2.20 C1=NC=CC2=CC=CC=C12 ACS015488 [1,0,0,0,0,0|2,0,1]=4 9 B11R2.20 N1=CC=CC=2CCCCC12 ACS010857 [1,0,0,0,0,0|2,0,1]=4 10 B11R2.20 O1C2=C(NCC1)N=CC=C2 ACS023962 [1,0,0,0,0,0|2,0,1]=4 11 B11R2.20 O1CCNC2=C1C=CC=C2 ACS023745 [1,0,0,0,0,0|1,0,1]=3 12 B13R2.155 BrC1=CC2=C(OCC(N2)=O)C=C1 ACS018953 [0,1,0,0,0,0|2,0,0]=3 13 B13R2.155 ClC1=CC2=C(OCC(N2)=O)C=C1 ACS018933 [0,1,0,0,0,0|2,0,0]=3 14 B13R2.155 OC1=CC2=C(OCC(N2)=O)C=C1 ACS017342 [0,1,0,0,0,0|2,0,0]=3 15 B13R2.155 OC1=CC=C2C=CC(NC2=C1)=O ACS010856 [0,1,0,0,0,0|1,0,2]=4 16 B13R2.155 c1cc2c(cc1N)NC(=O)CO2 ACS015409 [0,1,0,0,0,0|2,0,0]=3 17 B13R2.162 BrC=1C=CC=C2C=CC(NC12)=O ACS017354 [0,1,0,0,0,0|1,0,2]=4 18 B13R2.162 FC1=CC=CC=2OCC(NC21)=O ACF018866 [0,1,0,0,0,0|2,0,0]=3 19 B13R2.162 OC=1C=CC=C2CCC(CC12)=O ACS011739 [0,1,0,0,0,0|1,0,0]=2 20 B13R2.369 CC1OC2=C(NC1=O)C=CC=C2 ACS023948 [0,1,0,0,0,0|2,0,0]=3 21 B13R2.3683 BrC1=CC=2OCC(NC2N=C1)=O ACS020544 [0,1,0,0,0,0|3,0,0]=4 22 B13R2.3683 BrC=1C=C2C=CC(NC2=CC1)=O ACS017355 [0,1,0,0,0,0|1,0,2]=4 23 B13R2.3683 BrC=1C=C2C=NC(NC2=CC1)=O ACS023890 [0,1,0,0,0,0|2,0,1]=4 24 B13R2.3683 BrC=1C=C2CCC(NC2=CC1)=O ACS023892 [0,1,0,0,0,0|1,0,0]=2 25 B13R2.3683 BrC=1C=C2CCC(OC2=CC1)=O ACS020481 [0,1,0,0,0,0|0,0,0]=1 26 B13R2.3683 BrC=1C=CC2=C(OCC(N2)=O)C1 ACS018796 [0,1,0,0,0,0|2,0,0]=3 27 B13R2.3683 FC=1C=C2CCC(NC2=CC1)=O ACF017388 [0,1,0,0,0,0|1,0,0]=2 28 B13R2.3683 FC=1C=CC2=C(OCC(N2)=O)C1 ACF019142 [0,1,0,0,0,0|2,0,0]=3 29 B13R2.3683 NC=1C=C2C=CC(NC2=CC1)=O ACS019131 [0,1,0,0,0,0|1,0,2]=4 30 B13R2.3683 NC=1C=C2N=CC(NC2=CC1)=O ACS020816 [0,1,0,0,0,0|2,0,1]=4 31 B13R2.3683 OC=1C=CC2=C(OCC(N2)=O)C1 ACS019136 [0,1,0,0,0,0|2,0,0]=3 32 B13R2.5179 BrC1=C2CCC(CC2=CC=C1)=O ACS011836 [0,1,0,0,0,0|1,0,0]=2 33 B13R2.5179 FC1=C2CCC(NC2=NC=C1)=O ACF022587 [0,1,0,0,0,0|2,0,0]=3 34 B13R2.5179 OC1=CC=CC2=C1OCC(N2)=O ACS017347 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.17 C(CC)OC1=C(C=CC=C1)O ACS011557 [0,0,1,0,0,0|2,0,1]=4 36 B11R1.40 C1(=CC=CC=C1)CC(CC)=O ACS014616 [0,0,1,0,0,0|1,0,0]=2 37 B11R1.40 C1(=CC=CC=C1)OC(NC)=O ACS017176 [0,0,1,0,0,0|1,0,0]=2 38 B11R1.41 C(C)OC1=C(C=CC=C1)OC ACS016109 [0,0,1,0,0,0|2,0,1]=4 39 B11R1.86 BrC1=C(C=CC=C1)CC(=O)O ACS012928 [0,0,1,0,0,0|3,0,0]=4 40 B11R1.86 CC1=C(C=CC=C1)CC(=O)O ACS012985 [0,0,1,0,0,0|2,0,0]=3 41 B11R1.86 CC1=C(C=CC=C1)OC(C)=O ACS012685 [0,0,1,0,0,0|0,0,0]=1 42 B11R1.86 FC1=C(NC(C)=O)C=CC=C1 ACF012519 [0,0,1,0,0,0|2,0,0]=3 43 B11R1.86 IC1=C(C=CC=C1)CC(=O)O ACS012978 [0,0,1,0,0,0|3,0,0]=4 44 B11R1.86 OC1=C(C=CC=C1)CC(=O)O ACS012975 [0,0,1,0,0,0|3,0,0]=4 45 B11R1.91 C(C=CC1=CC=CC=C1)(=O)O ACS013027 [0,0,1,0,0,0|0,0,2]=3 46 B11R1.91 C1(=CC=CC=C1)NCC(=O)O ACS024393 [0,0,1,0,0,0|1,0,0]=2 47 B11R1.91 N1=CC(=CC=C1)\C=C\C(=O)O ACS011792 [0,0,1,0,0,0|1,0,2]=4 48 B11R1.91 N1=CC=C(C=C1)OCC(=O)O ACS020765 [0,0,1,0,0,0|2,0,0]=3 49 B11R1.91 [N+](=O)([O-])CCC1=CC=CC=C1 ACS012492 [0,0,1,0,0,0|1,0,1]=3 50 B11R1.91 c1cc(cnc1)\C=C\C(=O)O ACS010540 [0,0,1,0,0,0|1,0,2]=4 51 B11R2.1 BrC1=COC2=C1C=CC=C2 ACS017484 [0,0,0,0,1,0|2,0,1]=4 52 B11R2.1 BrC1=NNC2=CC=CC=C12 ACS018804 [0,0,0,0,1,0|3,0,0]=4 53 B11R2.1 C1(NCC2=CC=CC=C12)=O ACS017554 [0,0,0,0,1,0|1,0,0]=2 54 B11R2.1 C1(OCC2=C1C=CC=C2)=O ACS015427 [0,0,0,0,1,0|1,0,0]=2 55 B11R2.1 CC1=NNC2=CC=CC=C12 ACS017504 [0,0,0,0,1,0|3,0,0]=4 56 B11R2.1 ClC1=NOC2=C1C=CC=C2 ACS018862 [0,0,0,0,1,0|3,0,0]=4 57 B11R2.1 N1N=C(C2=CC=CC=C12)N ACS017316 [0,0,0,0,1,0|3,0,0]=4 58 B11R2.1 N1NC(C2=CC=CC=C12)=O ACS017555 [0,0,0,0,1,0|2,0,0]=3 59 B11R2.1 O1CC(C=2C1=NC=CC2)=O ACS017716 [0,0,0,0,1,0|2,0,0]=3 60 B11R2.1 O1N=C(C2=C1C=CC=C2)O ACS018863 [0,0,0,0,1,0|2,0,1]=4 61 B11R2.10 BrC=1OC2=C(N1)C=CC=C2 ACS019241 [0,0,0,0,1,0|2,0,0]=3 62 B11R2.10 BrC=1SC2=C(N1)C=CC=C2 ACS023936 [0,0,0,0,1,0|2,1,0]=4 63 B11R2.10 C1C(CC2=CC=CC=C12)=O ACS015485 [0,0,0,0,1,0|1,0,0]=2 64 B11R2.10 C1N(CC2=CC=CC=C12)N ACS019146 [0,0,0,0,1,0|3,0,0]=4 65 B11R2.10 CC=1CC2=CC=CC=C2C1 ACS010787 [0,0,0,0,1,0|2,0,0]=3 66 B11R2.10 CC=1NC2=CC=CC=C2C1 ACS011044 [0,0,0,0,1,0|2,0,1]=4 67 B11R2.10 CC=1OC=2C(=NC=CC2)N1 ACS020926 [0,0,0,0,1,0|3,0,0]=4 68 B11R2.10 ClC=1NC2=C(N1)C=CC=C2 ACS011055 [0,0,0,0,1,0|3,0,0]=4 69 B11R2.10 ClC=1OC2=NC=CC=C2N1 ACS019247 [0,0,0,0,1,0|3,0,0]=4 70 B11R2.10 N1=C(OC2=NC=CC=C21)N ACS019246 [0,0,0,0,1,0|3,0,0]=4 71 B11R2.10 N1=C(OC=2C=NC=CC21)N ACS020200 [0,0,0,0,1,0|3,0,0]=4 72 B11R2.10 N1C(NC2=NC=CC=C21)=O ACS024033 [0,0,0,0,1,0|3,0,0]=4 73 B11R2.10 NC=1NC2=C(N1)C=CC=C2 ACS011188 [0,0,0,0,1,0|3,0,0]=4 74 B11R2.10 NC=1SC2=C(N1)C=CC=C2 ACS015408 [0,0,0,0,1,0|2,1,0]=4 75 B11R2.10 O1C(=NC=2C=NC=CC21)N ACS019244 [0,0,0,0,1,0|3,0,0]=4 76 B11R2.10 O1C(CC2=C1C=CC=C2)=O ACS012026 [0,0,0,0,1,0|0,0,0]=1 77 B11R2.10 ON1CC2=CC=CC=C2C1 ACS015477 [0,0,0,0,1,0|2,0,1]=4 78 B11R2.10 SC=1NC2=C(N1)C=CC=C2 ACS011577 [0,0,0,0,1,0|2,1,0]=4 79 B11R2.10 SC=1OC2=C(N1)C=CC=C2 ACS011162 [0,0,0,0,1,0|1,1,0]=3 80 B11R2.10 c1ccc2c(c1)CC(C2)N ACS015406 [0,0,0,0,1,0|2,0,1]=4 81 B13R2.33 C1=CC=CC2=C1CCC(CC2)=O ACS018799 [0,0,0,0,0,1|1,0,0]=2 82 B10R1.17 BrCCOC1=CC=CC=C1 ACS010459 [1,0,1,0,0,0|1,0,1]=4 83 B10R1.17 C(C=CC1=CC=CC=C1)Cl ACS015577 [1,0,1,0,0,0|2,0,0]=4 84 B10R1.17 ClCCOC1=CC=CC=C1 ACS014772 [1,0,1,0,0,0|1,0,1]=4 85 B10R1.17 O(C1=CC=CC=C1)CCO ACS015601 [1,0,1,0,0,0|1,0,1]=4 86 B10R1.4 BrC1=C(C=CC=C1)OCC ACS010456 [1,0,1,0,0,0|1,0,1]=4 87 B10R1.4 BrC1=C(CCO)C=CC=C1 ACS016868 [1,0,1,0,0,0|1,0,1]=4 88 B10R1.4 BrCCC1=C(C=CC=C1)Cl ACS016881 [1,0,1,0,0,0|2,0,0]=4 89 B10R1.4 C(C)OC1=C(C=CC=C1)O ACS014432 [1,0,1,0,0,0|1,0,1]=4 90 B10R1.4 C(C)OC=1C(=NC=CC1)C ACS020372 [1,0,1,0,0,0|1,0,1]=4 91 B10R1.4 FC1=C(C=CC=C1)CCO ACF013749 [1,0,1,0,0,0|1,0,1]=4 92 B10R1.20 C(C)C1=C(C#N)C=CC=C1 ACS013595 [1,0,1,0,0,0|1,0,1]=4 93 B10R1.20 C(C)C1=C(C=O)C=CC=C1 ACS010442 [1,0,1,0,0,0|0,0,0]=2 94 B10R1.20 C=1(C(=CC=CC1)C=O)C=O ACS014310 [1,0,1,0,0,0|1,0,1]=4 95 B10R1.20 COC1=C(C=CC=C1)OC ACS014737 [1,0,1,0,0,0|1,0,1]=4 96 B10R1.20 COC1=C(C=O)C=CN=C1 ACS019441 [1,0,1,0,0,0|2,0,0]=4 97 B10R1.20 COC1=C(CCl)C=CC=C1 ACS010687 [1,0,1,0,0,0|1,0,1]=4 98 B10R1.20 COC1=CC=NC=C1C=O ACS019500 [1,0,1,0,0,0|2,0,0]=4 99 B10R1.18 C(C)(C)OC1=CC=CC=C1 ACS014743 [1,0,1,0,0,0|1,0,1]=4 100 B10R1.18 C1(=CC=CC=C1)CC(=O)O ACS012991 [1,0,1,0,0,0|2,0,0]=4 101 B10R1.18 ClC(=O)OC1=CC=CC=C1 ACS017180 [1,0,1,0,0,0|1,0,0]=3 102 B12R1.125 BrC1=C(C=CC=C1)CCC(=O)O ACS017007 [0,1,1,0,0,0|1,0,0]=3 103 B12R1.32 C(#N)CC(=O)NC1=CC=CC=C1 ACS013817 [0,1,1,0,0,0|1,0,1]=4 104 B12R1.32 N1=C(C=CC=C1)CC(=O)OCC ACS015216 [0,1,1,0,0,0|2,0,0]=4 105 B12R1.34 C(C1=CC=CC=C1)(=O)C(=O)OC ACS011953 [0,1,1,0,0,0|2,0,0]=4 106 B12R1.34 COC(=O)[C@@H](c1ccccc1)O ACS011328 [0,1,1,0,0,0|2,0,0]=4 107 B12R1.34 NC(C(=O)OC)C1=CC=CC=C1 ACS015593 [0,1,1,0,0,0|2,0,0]=4 108 B12R1.75 C(C)(=O)OC1=C(C=CC=C1)OC ACS012520 [0,1,1,0,0,0|1,0,0]=3 109 B12R1.75 COC1=C(C=CC=C1)OC(C)=O ACS012684 [0,1,1,0,0,0|1,0,0]=3 110 B12R1.75 ClCC1=C(C=CC=C1)CC(=O)O ACS012938 [0,1,1,0,0,0|2,0,0]=4 111 B12R1.127 CC1=C(C=C(C=C1)C)CC(=O)O ACS012955 [0,1,1,0,0,0|2,0,0]=4 112 B12R1.127 FC=1C=CC(=C(C1)CC(=O)O)C ACF012964 [0,1,1,0,0,0|2,0,0]=4 113 B12R1.224 CC1=C(C=CC=C1C)CC(=O)O ACS010344 [0,1,1,0,0,0|2,0,0]=4 114 B12R1.224 ClC1=C(C=CC=C1C)NC(C)=O ACS014019 [0,1,1,0,0,0|2,0,0]=4 115 B12R1.1009 Cc1cccc(c1NC(=O)C)C ACS014022 [0,1,1,0,0,0|1,0,0]=3 116 B12R1.27 BrCC(=O)OCC1=CC=CC=C1 ACS011041 [0,1,1,0,0,0|2,0,0]=4 117 B12R1.27 C(C1=CC=CC=C1)NC(CCl)=O ACS014089 [0,1,1,0,0,0|2,0,0]=4 118 B12R2.1081 BrC1=C2CCCNC2=CC=C1 ACS017344 [1,1,0,0,0,0|1,0,1]=4 119 B12R2.1081 C1(CCCC2=CC=CC=C12)=O ACS011590 [1,1,0,0,0,0|1,0,1]=4 120 B12R2.1081 C1(OCCC2=CC=CC=C12)=O ACS018859 [1,1,0,0,0,0|2,0,0]=4 121 B12R2.1081 ClC1=C2CCCNC2=CC=C1 ACS019187 [1,1,0,0,0,0|1,0,1]=4 122 B12R2.1081 ClC=1C=CC=C2CCCNC12 ACS017386 [1,1,0,0,0,0|1,0,1]=4 123 B12R2.1081 FC1=C2CCCNC2=CC=C1 ACF019490 [1,1,0,0,0,0|1,0,1]=4 124 B12R2.1081 FC1=C2CCCNC2=CC=C1 ACF019491 [1,1,0,0,0,0|1,0,1]=4 125 B12R2.1081 FC1=CC=CC2=C1CC=CO2 ACF015470 [1,1,0,0,0,0|0,0,1]=3 126 B12R2.1081 FC1=CC=CC=2OCCNC21 ACF020344 [1,1,0,0,0,0|1,0,1]=4 127 B12R2.1081 O1C2=C(NCC1)C=CC=C2O ACS017343 [1,1,0,0,0,0|1,0,1]=4 128 B12R2.1081 O1C2=C(OCC1)C(=CC=C2)N ACS020102 [1,1,0,0,0,0|1,0,1]=4 129 B12R2.1081 O1C2=C(OCC1)C(=CC=C2)O ACS020438 [1,1,0,0,0,0|1,0,1]=4 130 B12R2.1081 O1CCC(C2=CC=CC=C12)=O ACS015447 [1,1,0,0,0,0|0,0,2]=4 131 B12R2.1081 O1CCC(C2=CC=CC=C12)N ACS019141 [1,1,0,0,0,0|0,0,1]=3 132 B12R2.1081 c1ccc2c(c1)CCC[C@@H]2N ACS011450 [1,1,0,0,0,0|1,0,1]=4 133 B12R2.1 O1C=C(C2=C1C=CC=C2)C=O ACS020900 [0,1,0,0,1,0|1,0,1]=4 134 B12R2.1 S1C2=C(C(=C1)C=O)C=CC=C2 ACS020436 [0,1,0,0,1,0|1,0,1]=4 135 B12R2.18 CN1NC2=CC=CC=C2C1=O ACS018891 [0,1,0,0,1,0|2,0,0]=4 136 B12R2.18 N[C@H]1[C@H](CC2=CC=CC=C12)O ACS010828 [0,1,0,0,1,0|1,0,1]=4 137 B12R2.132 BrC1=CC=C2CNC(C2=C1)=O ACS017550 [0,1,0,0,1,0|1,0,0]=3 138 B12R2.196 BrC1=C2CCC(C2=CC=C1)=O ACS018808 [0,1,0,0,1,0|0,0,0]=2 139 B12R2.196 ClC1=C2CCC(C2=CC=C1)=O ACS019188 [0,1,0,0,1,0|0,0,0]=2 140 B12R2.196 FC1=C2CCC(C2=CC=C1)=O ACF019209 [0,1,0,0,1,0|0,0,0]=2 141 B12R2.196 OC1=C2CCC(C2=CC=C1)=O ACS011256 [0,1,0,0,1,0|0,0,0]=2 142 B12R2.612 BrC=1C=C2COC(=O)C2=CC1 ACS011975 [0,1,0,0,1,0|1,0,0]=3 143 B12R2.612 ClC=1C=C2CCC(C2=CC1)=O ACS010300 [0,1,0,0,1,0|0,0,0]=2 144 B12R2.612 FC=1C=C2CCC(C2=CC1)=O ACF010326 [0,1,0,0,1,0|0,0,0]=2 145 B12R2.612 OC1=CC2=C(C(CO2)=O)C=C1 ACS017478 [0,1,0,0,1,0|1,0,0]=3 146 B12R2.612 OC=1C=C2CCC(C2=CC1)=O ACS011173 [0,1,0,0,1,0|0,0,0]=2 147 B12R2.2028 C1(C=2C(C(=O)O1)=CC=CC2)=O ACS015508 [0,1,0,0,1,0|1,0,1]=4 148 B12R2.2028 C1(NC(C2=CC=CC=C12)=O)=O ACS015456 [0,1,0,0,1,0|1,0,1]=4 149 B12R2.2028 C1(NC(C2=CC=CC=C12)=O)=O ACS015457 [0,1,0,0,1,0|1,0,1]=4 150 B12R2.2028 OI1OC(C2=C1C=CC=C2)=O ACS011601 [0,1,0,0,1,0|2,0,0]=4 151 B12R2.32 ClCC=1OC2=C(N1)C=CC=C2 ACS019240 [0,1,0,0,1,0|2,0,0]=4 152 B12R2.32 S1C(=NC2=C1C=CC=C2)C=O ACS023746 [0,1,0,0,1,0|1,1,0]=4 153 B12R2.95 C1C2=CC=CC=C2NS1(=O)=O ACS023733 [0,1,0,0,1,0|2,0,0]=4 154 B12R2.202 BrC1=CC=CC2=C1N=C(O2)C ACS019225 [0,1,0,0,1,0|2,0,0]=4 155 B12R2.202 BrC1=CC=CC=2N=C(OC21)C ACS019226 [0,1,0,0,1,0|2,0,0]=4 156 B12R2.202 FC1=C2C(=NC=C1)NC(C2)=O ACF021142 [0,1,0,0,1,0|2,0,0]=4 157 B12R2.202 FC1=CC=CC2=C1NC(O2)=O ACF017199 [0,1,0,0,1,0|1,0,0]=3 158 B12R2.202 FC1=CC=CC=2N=C(OC21)N ACF022697 [0,1,0,0,1,0|2,0,0]=4 159 B12R2.202 FC=1C=CC=C2CC(NC12)=O ACF015473 [0,1,0,0,1,0|1,0,0]=3 160 B12R2.606 BrC1=CC2=C(N=C(O2)N)C=C1 ACS020078 [0,1,0,0,1,0|2,0,0]=4 161 B12R2.606 BrC1=CC=C2CC(NC2=C1)=O ACS011028 [0,1,0,0,1,0|1,0,0]=3 162 B12R2.606 BrC=1C=C2CC(CC2=CC1)=O ACS020906 [0,1,0,0,1,0|1,0,0]=3 163 B12R2.606 BrC=1C=CC2=C(C=C(O2)C)C1 ACS017677 [0,1,0,0,1,0|1,0,1]=4 164 B12R2.606 BrC=1C=CC2=C(N=C(O2)C)C1 ACS019224 [0,1,0,0,1,0|2,0,0]=4 165 B12R2.606 BrC=1C=CC2=C(N=C(O2)N)C1 ACS017380 [0,1,0,0,1,0|2,0,0]=4 166 B12R2.606 BrC=1C=CC2=C(NC(O2)=O)C1 ACS020350 [0,1,0,0,1,0|1,0,0]=3 167 B12R2.606 CC=1OC2=C(N1)C=C(C=C2)Cl ACS011165 [0,1,0,0,1,0|2,0,0]=4 168 B12R2.606 CC=1OC2=C(N1)C=C(C=C2)O ACS019506 [0,1,0,0,1,0|2,0,0]=4 169 B12R2.606 CC=1OC2=C(N1)C=CC(=C2)O ACS020503 [0,1,0,0,1,0|2,0,0]=4 170 B12R2.606 ClC1=CC2=C(N=C(O2)C)C=C1 ACS019238 [0,1,0,0,1,0|2,0,0]=4 171 B12R2.606 ClC=1OC2=C(N1)C=CC(=C2)F ACF023639 [0,1,0,0,1,0|2,0,0]=4 172 B12R2.606 FC1=CC2=C(N=C(O2)N)C=C1 ACF022696 [0,1,0,0,1,0|2,0,0]=4 173 B12R2.606 FC1=CC=C2C(=N1)NC(C2)=O ACF021926 [0,1,0,0,1,0|2,0,0]=4 174 B12R2.606 FC1=CC=C2CC(NC2=C1)=O ACF010212 [0,1,0,0,1,0|1,0,0]=3 175 B12R2.606 FC=1C=C2C(=NC1)NC(C2)=O ACF021143 [0,1,0,0,1,0|2,0,0]=4 176 B12R2.606 FC=1C=C2CC(NC2=CC1)=O ACF010211 [0,1,0,0,1,0|1,0,0]=3 177 B12R2.606 FC=1C=CC2=C(N=C(O2)N)C1 ACF022695 [0,1,0,0,1,0|2,0,0]=4 178 B14R2.29369 ClC=1C=C2NCC(N(C2=CC1)C)=O ACS020744 [0,2,0,0,0,0|2,0,0]=4 179 B14R2.134 COC=1C=C2CC(COC2=CC1)=O ACS019603 [0,2,0,0,0,0|2,0,0]=4 180 B14R2.134 O=C1NC2=C(OC1)C=CC(=C2)C#N ACS020885 [0,2,0,0,0,0|2,0,0]=4 181 B14R2.2332 O=C1CC=2C=CC(=CC2CC1)C#N ACS020469 [0,2,0,0,0,0|1,0,0]=3 182 B14R2.29365 BrC1=C2CCC(CC2=CC(=C1)F)=O ACF023625 [0,2,0,0,0,0|1,0,0]=3 183 B14R2.29365 SC1=CC=C2C(=CC(OC2=C1)=O)C ACS020071 [0,2,0,0,0,0|0,0,2]=4 184 B14R2.8235 FC=1C=C2CCC(CC2=C(C1)F)=O ACF022456 [0,2,0,0,0,0|1,0,0]=3 185 B10R1.15 BrCC(=O)C1=CC=CC=C1 ACS014488 [0,0,1,0,1,0|1,0,0]=3 186 B10R1.15 C(C)(CC)C1=CC=CC=C1 ACS016273 [0,0,1,0,1,0|1,0,1]=4 187 B10R1.15 C(C)[C@@H](C1=CC=CC=C1)N ACS010872 [0,0,1,0,1,0|1,0,1]=4 188 B10R1.15 C(C1=CC=CC=C1)(=O)OC ACS012777 [0,0,1,0,1,0|1,0,0]=3 189 B10R1.15 ClCC(=O)C1=CC=CC=C1 ACS010471 [0,0,1,0,1,0|1,0,0]=3 190 B10R1.15 FCC(=O)C1=CC=CC=C1 ACF015840 [0,0,1,0,1,0|1,0,0]=3 191 B10R1.15 ICC(=O)C1=CC=CC=C1 ACS015855 [0,0,1,0,1,0|1,0,0]=3 192 B10R1.15 NCC(=O)C1=CC=CC=C1 ACS023930 [0,0,1,0,1,0|1,0,0]=3 193 B10R1.61 BrC1=C(C(=O)O)C=CC=C1 ACS010526 [0,0,1,0,1,0|2,0,0]=4 194 B10R1.61 BrC1=C(C=CC=C1)C(C)=O ACS015795 [0,0,1,0,1,0|1,0,0]=3 195 B10R1.61 C(C)(=O)C=1C(NC=CC1)=O ACS020685 [0,0,1,0,1,0|2,0,0]=4 196 B10R1.61 C=1(C(=CC=CC1)C(=O)O)C ACS011698 [0,0,1,0,1,0|1,0,0]=3 197 B10R1.61 CC1=C(C(=O)O)C=CC=N1 ACS010343 [0,0,1,0,1,0|2,0,0]=4 198 B10R1.61 CC1=CC=NC=C1C(=O)O ACS019313 [0,0,1,0,1,0|2,0,0]=4 199 B10R1.61 ClC1=C(C(=O)Cl)C=CC=C1 ACS013377 [0,0,1,0,1,0|2,0,0]=4 200 B10R1.61 ClC1=C(C(=O)O)C=CC=C1 ACS013118 [0,0,1,0,1,0|2,0,0]=4 201 B10R1.61 ClC1=C(C(=O)[O-])C=CC=C1 ACS013277 [0,0,1,0,1,0|2,0,0]=4 202 B10R1.61 ClC1=C(C=CC=C1)C(C)=O ACS014514 [0,0,1,0,1,0|1,0,0]=3 203 B10R1.61 ClC1=NC=CC=C1C(C)=O ACS011631 [0,0,1,0,1,0|2,0,0]=4 204 B10R1.61 ClC=1C(=NC=CC1)C(C)=O ACS020326 [0,0,1,0,1,0|2,0,0]=4 205 B10R1.61 FC1=C(C(=O)Cl)C=CC=C1 ACF013395 [0,0,1,0,1,0|2,0,0]=4 206 B10R1.61 FC1=C(C(=O)O)C=CC=C1 ACF013185 [0,0,1,0,1,0|2,0,0]=4 207 B10R1.61 FC1=C(C(=O)[O-])C=CC=C1 ACF013292 [0,0,1,0,1,0|2,0,0]=4 208 B10R1.61 FC1=C(C=CC=C1)C(C)=O ACF014555 [0,0,1,0,1,0|1,0,0]=3 209 B10R1.61 FC=1C(=NC=CC1)C(C)=O ACF021098 [0,0,1,0,1,0|2,0,0]=4 210 B10R1.61 FC=1C=NC=CC1C(C)=O ACF019571 [0,0,1,0,1,0|2,0,0]=4 211 B10R1.61 IC1=C(C(=O)O)C=CC=C1 ACS010558 [0,0,1,0,1,0|2,0,0]=4 212 B10R1.61 NC1=C(C(=O)O)C=CC=C1 ACS013040 [0,0,1,0,1,0|2,0,0]=4 213 B10R1.61 OC1=C(C(=O)O)C=CC=C1 ACS013209 [0,0,1,0,1,0|2,0,0]=4 214 B10R1.61 OC1=C(C=CC=C1)C(C)=O ACS014575 [0,0,1,0,1,0|1,0,0]=3 215 B10R1.61 SC1=C(C(=O)O)C=CC=C1 ACS013223 [0,0,1,0,1,0|2,0,0]=4 216 B10R1.61 [N+](=O)([O-])C1=C(C)C=CC=C1 ACS014993 [0,0,1,0,1,0|2,0,0]=4 217 B10R1.66 O1C(=CC=C1)CCC(=O)O ACS015358 [0,0,1,0,1,0|1,0,0]=3 218 B10R2.7 C1C=CC2=CC=CC=C12 ACS011977 [1,0,0,0,1,0|0,0,1]=3 219 B10R2.7 C1NCC2=CC=CC=C12 ACS019153 [1,0,0,0,1,0|1,0,1]=4 220 B10R2.7 C1OC2=C(C=CC=C2)O1 ACS010362 [1,0,0,0,1,0|1,0,0]=3 221 B10R2.7 N1=CNC2=C1C=CC=C2 ACS015425 [1,0,0,0,1,0|2,0,0]=4 222 B10R2.7 N1C=CC2=CC=CC=C12 ACS015484 [1,0,0,0,1,0|1,0,1]=4 223 B10R2.7 N1CCC2=CC=CC=C12 ACS011043 [1,0,0,0,1,0|1,0,0]=3 224 B10R2.7 N1CCC=2C1=NC=CC2 ACS024120 [1,0,0,0,1,0|2,0,0]=4 225 B10R2.7 S1C2=C(C=C1)C=CC=C2 ACS011575 [1,0,0,0,1,0|0,1,1]=4 226 B12R1.252 C(C1=CC=CC=C1)OCC(=O)O ACS017159 [0,0,1,0,0,1|0,0,0]=2 227 B12R1.252 C(C1=CC=CC=C1)OC[C@@H](C)O ACS012310 [0,0,1,0,0,1|1,0,1]=4 228 B12R1.252 C(CC1=CC=CC=C1)OC(C)=O ACS012688 [0,0,1,0,0,1|1,0,0]=3 229 B12R1.252 O(C1=CC=CC=C1)CCC(=O)O ACS015602 [0,0,1,0,0,1|0,0,0]=2