0 B12R2.612 Brc1ccc2c(c1)CNC2=O PI-39318 [0,0,0,0,0,0|1,1,2]=4 1 B12R2.612 Brc1ccc2c(c1)cnn2C PI-34948 [0,0,0,0,0,0|3,1,0]=4 2 B12R2.612 Brc1ccc2c(c1)onc2Cl PI-39037 [0,0,0,0,0,0|2,1,0]=3 3 B12R2.612 C1=C(Br)C=CC2=C1CCC2=O PI-21521 [0,0,0,0,0,0|2,1,1]=4 4 B12R2.612 C1=CC(=NC2=C1C(=CN2)Br)Cl PI-35902 [0,0,0,0,0,0|3,1,0]=4 5 B12R2.612 C1C(=O)C2=C(O1)C=C(C=C2)O PI-17763 [0,0,0,0,0,0|3,0,1]=4 6 B12R2.612 C1C2=C(C=CC(=C2)Br)C(=O)O1 PI-11635 [0,0,0,0,0,0|2,1,1]=4 7 B12R2.612 C1C2=C(C=CC(=C2)N)C(=O)N1 PI-36570 [0,0,0,0,0,0|2,0,2]=4 8 B12R2.612 C1C2=C(C=CC(=C2)N)C(=O)O1 PI-17686 [0,0,0,0,0,0|3,0,1]=4 9 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)F PI-16849 [0,0,0,0,0,0|2,0,1]=3 10 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)I PI-32739 [0,0,0,0,0,0|2,1,1]=4 11 B12R2.612 CC1=C2C=CC(=CC2=NN1)N PI-45010 [0,0,0,0,0,0|2,0,2]=4 12 B12R2.612 CN1C2=C(C=C(C=C2)I)C=N1 PI-34951 [0,0,0,0,0,0|3,1,0]=4 13 B12R2.612 CN1C2=C(C=C(C=C2)N)C=N1 PI-34947 [0,0,0,0,0,0|4,0,0]=4 14 B12R2.612 ClC1=NNC2=C1C=CC(Br)=C2 PI-46682 [0,0,0,0,0,0|1,1,0]=2 15 B12R2.612 Clc1ccc2C(=O)CCc2c1 PI-31195 [0,0,0,0,0,0|2,1,1]=4 16 B12R2.612 FC1=CC2=C(C=C1)C(Br)=NN2 PI-46756 [0,0,0,0,0,0|1,0,0]=1 17 B12R2.612 Nc1ccc2C(=O)CCc2c1 PI-14100 [0,0,0,0,0,0|3,0,1]=4 18 B12R2.612 O=C1CCC2=C1C=CC(C)=C2 PI-40563 [0,0,0,0,0,0|3,0,1]=4 19 B12R2.612 O=C1NCC2=C1C=CC(O)=C2 PI-46708 [0,0,0,0,0,0|2,0,2]=4 20 B12R2.612 O=C1OCC2=C1C=CC(Cl)=C2 PI-40884 [0,0,0,0,0,0|2,1,1]=4 21 B12R2.612 OC1=CC2=C(N(C)N=C2)C=C1 PI-46693 [0,0,0,0,0,0|4,0,0]=4 22 B12R2.612 Oc1ccc2C(=O)CCc2c1 PI-11505 [0,0,0,0,0,0|3,0,1]=4 23 B11R2.1 B1(C2=CC=CC=C2CO1)O PI-25687 [1,0,0,0,0,0|3,0,0]=4 24 B11R2.1 BrC1=NNC2=C1C=CN=C2 PI-46689 [1,0,0,0,0,0|2,0,0]=3 25 B11R2.1 C1=CC2=C(NC=C2Br)N=C1 PI-41228 [1,0,0,0,0,0|3,0,0]=4 26 B11R2.1 C1=CC2=C(NC=C2Cl)N=C1 PI-42708 [1,0,0,0,0,0|3,0,0]=4 27 B11R2.1 C1=CC2=C(NN=C2C=C1)Br PI-34805 [1,0,0,0,0,0|1,0,2]=4 28 B11R2.1 C1=CC2=NN=C(N2C=C1)Br PI-44880 [1,0,0,0,0,0|2,0,1]=4 29 B11R2.1 C1=CC=C2C(=C1)C(=CN2)Br PI-34828 [1,0,0,0,0,0|2,0,0]=3 30 B11R2.1 C1=CC=C2C(=C1)C(=CO2)Br PI-17445 [1,0,0,0,0,0|3,0,0]=4 31 B11R2.1 C1=CC=C2C(=C1)C(=CS2)Br PI-14249 [1,0,0,0,0,0|3,0,0]=4 32 B11R2.1 C1=CC=C2C(=C1)C(=CS2)O PI-14308 [1,0,0,0,0,0|2,0,0]=3 33 B11R2.1 C1=CC=C2C(=C1)C(=NO2)N PI-14154 [1,0,0,0,0,0|2,0,0]=3 34 B11R2.1 C1=CC=C2C(=C1)C(=NS2)Cl PI-12200 [1,0,0,0,0,0|2,0,0]=3 35 B11R2.1 C1=CC=C2C(=C1)C(=O)NS2 PI-11536 [1,0,0,0,0,0|1,0,2]=4 36 B11R2.1 C1=CC=C2C(=C1)C=NN2N PI-44096 [1,0,0,0,0,0|3,0,0]=4 37 B11R2.1 C1C(=O)C2=CC=CC=C2O1 PI-27871 [1,0,0,0,0,0|2,0,1]=4 38 B11R2.1 C1C(=O)C2=CC=CC=C2O1 PI-33947 [1,0,0,0,0,0|2,0,1]=4 39 B11R2.1 C1CC(=O)C2=CC=CC=C21 PI-12356 [1,0,0,0,0,0|2,0,1]=4 40 B11R2.1 CC1=CSC2=CC=CC=C12 PI-26140 [1,0,0,0,0,0|3,0,0]=4 41 B11R2.1 CN1C2=CC=CC=C2N=N1 PI-17166 [1,0,0,0,0,0|2,0,1]=4 42 B11R2.1 Cc1c[nH]c2c1cccc2 PI-10761 [1,0,0,0,0,0|2,0,0]=3 43 B11R2.1 ClC1=CNC2=C1C=NC=C2 PI-36987 [1,0,0,0,0,0|3,0,0]=4 44 B11R2.1 ClC1=NN=C2C=CC=CN21 PI-46802 [1,0,0,0,0,0|2,0,1]=4 45 B11R2.1 ClC1=NOC2=C1C=CC=C2 PI-15670 [1,0,0,0,0,0|2,0,0]=3 46 B11R2.1 NC1=CNC2=C1C=NC=C2 PI-36984 [1,0,0,0,0,0|3,0,0]=4 47 B11R2.1 NC1=NSC2=NC=CC=C21 PI-46733 [1,0,0,0,0,0|3,0,0]=4 48 B11R2.1 O=C1C2=CC=CC=C2SC1 PI-42644 [1,0,0,0,0,0|2,0,1]=4 49 B11R2.1 O=C1OCc2c1cccc2 PI-33738 [1,0,0,0,0,0|2,0,1]=4 50 B11R2.1 O=C1SSC2=CC=CC=C12 PI-41753 [1,0,0,0,0,0|2,0,1]=4 51 B11R2.1 On1nnc2ccccc12 PI-15275 [1,0,0,0,0,0|1,0,1]=3 52 B11R2.1 On1nnc2ccccc12 PI-15359 [1,0,0,0,0,0|1,0,1]=3 53 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 PI-39747 [1,0,0,0,0,0|2,1,0]=4 54 B11R2.36 Brc1ccc2c(c1)[nH]cc2 PI-10006 [1,0,0,0,0,0|1,1,0]=3 55 B11R2.36 Brc1cnc2c(c1)[nH]cc2 PI-39081 [1,0,0,0,0,0|2,1,0]=4 56 B11R2.36 Brc1ncc2c(c1)[nH]cc2 PI-39092 [1,0,0,0,0,0|2,1,0]=4 57 B11R2.36 C1=CC(=CC2=C1C=CN2)F PI-10018 [1,0,0,0,0,0|1,0,0]=2 58 B11R2.36 C1=CC(=CC2=C1C=CN2)N PI-16826 [1,0,0,0,0,0|2,0,0]=3 59 B11R2.36 C1=CC2=C(C=C1Br)C=NN2 PI-34641 [1,0,0,0,0,0|2,1,0]=4 60 B11R2.36 C1=CC2=C(C=C1Br)NC=N2 PI-44962 [1,0,0,0,0,0|2,1,0]=4 61 B11R2.36 C1=CC2=C(C=C1Br)NN=C2 PI-33950 [1,0,0,0,0,0|0,1,0]=2 62 B11R2.36 C1=CC2=C(C=C1Cl)C=NN2 PI-34938 [1,0,0,0,0,0|2,1,0]=4 63 B11R2.36 C1=CC2=C(C=C1Cl)NN=C2 PI-34962 [1,0,0,0,0,0|0,1,0]=2 64 B11R2.36 C1=CC2=C(C=C1F)C=NN2 PI-34939 [1,0,0,0,0,0|2,0,0]=3 65 B11R2.36 C1=CC2=C(C=C1F)N=CS2 PI-45368 [1,0,0,0,0,0|2,0,1]=4 66 B11R2.36 C1=CC2=C(C=C1F)NC=N2 PI-45215 [1,0,0,0,0,0|2,0,0]=3 67 B11R2.36 C1=CC2=C(C=C1F)NN=C2 PI-34959 [1,0,0,0,0,0|0,0,0]=1 68 B11R2.36 C1=CC2=C(C=C1F)SC=N2 PI-45369 [1,0,0,0,0,0|3,0,0]=4 69 B11R2.36 C1=CC2=C(C=C1N)C=NN2 PI-17683 [1,0,0,0,0,0|3,0,0]=4 70 B11R2.36 C1=CC2=C(C=C1N)NC=N2 PI-34794 [1,0,0,0,0,0|3,0,0]=4 71 B11R2.36 C1=CC2=C(C=C1N)NC=N2 PI-45761 [1,0,0,0,0,0|3,0,0]=4 72 B11R2.36 C1=CC2=C(C=C1O)C=NN2 PI-44936 [1,0,0,0,0,0|3,0,0]=4 73 B11R2.36 C1=CC2=C(C=C1O)NN=C2 PI-45210 [1,0,0,0,0,0|1,0,0]=2 74 B11R2.36 C1=CC2=C(C=CN2)C=C1F PI-10017 [1,0,0,0,0,0|3,0,0]=4 75 B11R2.36 C1CNC2=C1C=CC(=C2)Br PI-36067 [1,0,0,0,0,0|1,1,1]=4 76 B11R2.36 CC1=CC2=C(C=C1)N=CN2 PI-29770 [1,0,0,0,0,0|3,0,0]=4 77 B11R2.36 CC1=CC2=C(C=N1)C=CN2 PI-36829 [1,0,0,0,0,0|3,0,0]=4 78 B11R2.36 CC1=CC=C2[NH]N=CC2=C1 PI-41809 [1,0,0,0,0,0|3,0,0]=4 79 B11R2.36 Cc1ccc2c(c1)[nH]cc2 PI-16265 [1,0,0,0,0,0|2,0,0]=3 80 B11R2.36 ClC1=CC2=C(C=C1)C=CN2 PI-20431 [1,0,0,0,0,0|1,1,0]=3 81 B11R2.36 Clc1ccc2CCNc2c1 PI-36115 [1,0,0,0,0,0|1,1,1]=4 82 B11R2.36 Clc1ncc2c(c1)[nH]cc2 PI-36950 [1,0,0,0,0,0|2,1,0]=4 83 B11R2.36 Clc1ncc2c(c1)[nH]nc2 PI-39108 [1,0,0,0,0,0|1,1,0]=3 84 B11R2.36 Fc1ccc2c(c1)nsn2 PI-23462 [1,0,0,0,0,0|2,0,1]=4 85 B11R2.36 IC1=CC=C2[NH]N=CC2=C1 PI-34940 [1,0,0,0,0,0|2,1,0]=4 86 B11R2.36 Ic1ccc2c(c1)[nH]nc2 PI-34958 [1,0,0,0,0,0|0,1,0]=2 87 B11R2.36 Nc1ccc2c(c1)[nH]nc2 PI-34961 [1,0,0,0,0,0|1,0,0]=2 88 B11R2.36 Oc1ccc2cc[nH]c2c1 PI-16028 [1,0,0,0,0,0|2,0,0]=3 89 B11R2.36 Oc1ccc2nc[nH]c2c1 PI-36411 [1,0,0,0,0,0|3,0,0]=4 90 B13R2.662 C1=CC2=C(C=C1F)NC=C2C=O PI-23602 [0,1,0,0,0,0|1,0,1]=3 91 B13R2.5180 C1CC(=O)C2=C1C(=C(C=C2)F)F PI-34591 [0,1,0,0,0,0|2,0,1]=4 92 B13R2.5187 C1=CC2=C(C=C1F)C(=O)OC2=O PI-10664 [0,1,0,0,0,0|2,0,1]=4 93 B13R2.5190 C1=CC2=C(C=C1Br)NC(=O)C2=O PI-44938 [0,1,0,0,0,0|1,1,1]=4 94 B13R2.5190 C1=CC2=C(C=C1F)NC(=O)C2=O PI-40287 [0,1,0,0,0,0|1,0,1]=3 95 B13R2.5190 Clc1ccc2c(c1)NC(=O)C2=O PI-10574 [0,1,0,0,0,0|1,1,1]=4 96 B13R2.5190 Ic1ccc2c(c1)NC(=O)C2=O PI-35977 [0,1,0,0,0,0|1,1,1]=4 97 B13R2.5190 O=C1C(C)CC2=C1C=CC(F)=C2 PI-40268 [0,1,0,0,0,0|2,0,1]=4 98 B13R2.11634 C1CC(=O)C2=CC(=C(C=C21)F)F PI-34592 [0,1,0,0,0,0|2,0,1]=4 99 B13R2.11634 CC1=CC2=C(C=C1Cl)C(Cl)=NN2 PI-46696 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.22 BrCC(=O)c1ccc(F)cc1 PI-16507 [0,0,1,0,0,0|2,0,1]=4 101 B11R1.22 C1=CC(=CC=C1C(=NO)N)Br PI-14454 [0,0,1,0,0,0|2,1,0]=4 102 B11R1.22 C1=CC(=CC=C1C(=NO)N)Cl PI-30654 [0,0,1,0,0,0|2,1,0]=4 103 B11R1.22 C1=CC(=CC=C1C(=NO)N)F PI-23442 [0,0,1,0,0,0|2,0,0]=3 104 B11R1.22 C1=CC(=CC=C1C(=O)C=O)F PI-41037 [0,0,1,0,0,0|2,0,1]=4 105 B11R1.22 C1=CC(=CC=C1C(=O)CCl)F PI-28553 [0,0,1,0,0,0|2,0,1]=4 106 B11R1.22 C1=CC(=CC=C1C(=O)CN)Br PI-29690 [0,0,1,0,0,0|1,1,1]=4 107 B11R1.22 C1=CC(=CC=C1C(=O)CN)Cl PI-16147 [0,0,1,0,0,0|1,1,1]=4 108 B11R1.22 C1=CC(=CC=C1C(=O)CN)F PI-10226 [0,0,1,0,0,0|1,0,1]=3 109 B11R1.22 C1=CC(=CC=C1C(=O)CN)O PI-49411 [0,0,1,0,0,0|2,0,1]=4 110 B11R1.22 C1=CC(=CC=C1C(=O)CO)F PI-30583 [0,0,1,0,0,0|2,0,1]=4 111 B11R1.22 C1=CC(=CC=C1C(=O)NN)Br PI-20532 [0,0,1,0,0,0|0,1,2]=4 112 B11R1.22 C1=CC(=CC=C1C(=O)NN)F PI-23456 [0,0,1,0,0,0|0,0,2]=3 113 B11R1.22 C1=CC(=CC=C1C(=O)NN)I PI-50270 [0,0,1,0,0,0|0,1,2]=4 114 B11R1.22 C1=CC(=CC=C1C(=O)NN)N PI-50237 [0,0,1,0,0,0|1,0,2]=4 115 B11R1.22 C1=CC(=CC=C1C(=O)NN)O PI-50238 [0,0,1,0,0,0|1,0,2]=4 116 B11R1.22 C1=CC(=CC=C1[C@@H](CCl)O)F PI-49814 [0,0,1,0,0,0|2,0,1]=4 117 B11R1.22 CC1=CC=C(C=C1)C(=NO)N PI-30254 [0,0,1,0,0,0|3,0,0]=4 118 B11R1.22 CC1=CC=C(C=C1)C(=O)CN PI-30703 [0,0,1,0,0,0|2,0,1]=4 119 B11R1.22 CC1=CC=C(C=C1)C(=O)NN PI-24359 [0,0,1,0,0,0|1,0,2]=4 120 B11R1.22 NNC(=O)c1ccc(cc1)Cl PI-23138 [0,0,1,0,0,0|0,1,2]=4 121 B11R1.22 O=C(OC)C1=CC=C(F)C=C1 PI-16967 [0,0,1,0,0,0|2,0,1]=4 122 B11R1.24 C1=CC(=CC(=C1)F)CN=C=S PI-23492 [0,0,1,0,0,0|1,1,1]=4 123 B11R1.24 O=C=NCc1cccc(c1)F PI-26032 [0,0,1,0,0,0|1,0,2]=4 124 B11R1.24 O=C\C=C\C1=CC=CC(F)=C1 PI-46535 [0,0,1,0,0,0|2,0,1]=4 125 B11R1.37 C1=CC(=C(C=C1F)C#N)C=O PI-26905 [0,0,1,0,0,0|1,0,2]=4 126 B11R1.37 COc1cc(F)ccc1C=O PI-38318 [0,0,1,0,0,0|2,0,1]=4 127 B11R1.166 B(C1=C(C=C(C=C1)F)C)(O)O PI-23765 [0,0,1,0,0,0|3,0,0]=4 128 B11R1.166 B(C1=C(C=C(C=C1)F)Cl)(O)O PI-10412 [0,0,1,0,0,0|3,0,0]=4 129 B11R1.166 Brc1ccc(C(=O)O)c(F)c1 PI-16060 [0,0,1,0,0,0|2,1,0]=4 130 B11R1.166 C1=CC(=C(C=C1Br)Cl)C(=O)O PI-28671 [0,0,1,0,0,0|2,1,0]=4 131 B11R1.166 C1=CC(=C(C=C1Br)N)C(=O)O PI-18326 [0,0,1,0,0,0|1,1,0]=3 132 B11R1.166 C1=CC(=C(C=C1Br)O)C(=O)O PI-21374 [0,0,1,0,0,0|2,1,0]=4 133 B11R1.166 C1=CC(=C(C=C1Cl)N)C(=O)N PI-35500 [0,0,1,0,0,0|0,1,2]=4 134 B11R1.166 C1=CC(=C(C=C1Cl)O)C(=O)O PI-33938 [0,0,1,0,0,0|2,1,0]=4 135 B11R1.166 C1=CC(=C(C=C1F)Br)C(=O)O PI-16061 [0,0,1,0,0,0|2,0,0]=3 136 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)Cl PI-20069 [0,0,1,0,0,0|2,0,1]=4 137 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)N PI-20057 [0,0,1,0,0,0|1,0,2]=4 138 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)O PI-16103 [0,0,1,0,0,0|2,0,0]=3 139 B11R1.166 C1=CC(=C(C=C1F)F)C(=O)Cl PI-14894 [0,0,1,0,0,0|2,0,1]=4 140 B11R1.166 C1=CC(=C(C=C1F)F)C(=O)N PI-31316 [0,0,1,0,0,0|1,0,2]=4 141 B11R1.166 C1=CC(=C(C=C1F)I)C(=O)O PI-34280 [0,0,1,0,0,0|2,0,0]=3 142 B11R1.166 C1=CC(=C(C=C1N)Cl)C(=O)O PI-10541 [0,0,1,0,0,0|3,0,0]=4 143 B11R1.166 C1=CC(=C(C=C1N)F)C(=O)O PI-27599 [0,0,1,0,0,0|3,0,0]=4 144 B11R1.166 C1=CC(=C(C=C1O)F)C(=O)O PI-28723 [0,0,1,0,0,0|3,0,0]=4 145 B11R1.166 C1=CC(=CC(=C1C(O)=O)Br)Br PI-41212 [0,0,1,0,0,0|2,1,0]=4 146 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)Br PI-14425 [0,0,1,0,0,0|2,0,1]=4 147 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)Cl PI-28768 [0,0,1,0,0,0|2,0,1]=4 148 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)F PI-16939 [0,0,1,0,0,0|2,0,1]=4 149 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)N PI-30973 [0,0,1,0,0,0|2,0,1]=4 150 B11R1.166 CC(C1=CC=C(F)C=C1O)=O PI-23585 [0,0,1,0,0,0|2,0,1]=4 151 B11R1.166 CC1=C(C=CC(=C1)F)C(=O)O PI-10190 [0,0,1,0,0,0|2,0,0]=3 152 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)C PI-16114 [0,0,1,0,0,0|3,0,0]=4 153 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)F PI-18894 [0,0,1,0,0,0|3,0,0]=4 154 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O PI-15312 [0,0,1,0,0,0|3,0,0]=4 155 B11R1.166 Cc1ccc(c(c1)Br)C(=O)O PI-22123 [0,0,1,0,0,0|3,0,0]=4 156 B11R1.166 Cc1ccc(c(c1)N)C(=O)N PI-30565 [0,0,1,0,0,0|1,0,2]=4 157 B11R1.166 Cc1ccc(c(c1)N)C(=O)O PI-34285 [0,0,1,0,0,0|2,0,0]=3 158 B11R1.166 Clc1ccc(C(=O)O)c(F)c1 PI-16109 [0,0,1,0,0,0|2,1,0]=4 159 B11R1.166 Clc1ccc(C(=O)O)c(N)c1 PI-14296 [0,0,1,0,0,0|1,1,0]=3 160 B11R1.166 Clc1ccc(c(c1)Br)C(=O)O PI-20610 [0,0,1,0,0,0|2,1,0]=4 161 B11R1.166 Fc1ccc(B(O)O)c(F)c1 PI-28150 [0,0,1,0,0,0|3,0,0]=4 162 B11R1.166 Fc1ccc(C(=O)O)c(F)c1 PI-10195 [0,0,1,0,0,0|2,0,0]=3 163 B11R1.166 Fc1ccc(C(=O)O)c(N)c1 PI-16067 [0,0,1,0,0,0|1,0,0]=2 164 B11R1.166 Fc1ccc(C(=O)O)c(O)c1 PI-34804 [0,0,1,0,0,0|2,0,0]=3 165 B11R1.166 Fc1cnc(c(c1)F)C(=O)O PI-38255 [0,0,1,0,0,0|3,0,0]=4 166 B11R1.166 Ic1ccc(C(=O)O)c(N)c1 PI-35979 [0,0,1,0,0,0|1,1,0]=3 167 B11R1.166 Nc1ccc(c(c1)C)C(=O)O PI-38300 [0,0,1,0,0,0|3,0,0]=4 168 B11R1.166 O=C(O)C1=CC=C(Br)C=C1I PI-41942 [0,0,1,0,0,0|2,1,0]=4 169 B11R1.166 Oc1ccc(C(=O)O)c(Cl)c1 PI-18689 [0,0,1,0,0,0|3,0,0]=4 170 B13R2.3683 Brc1ccc2c(c1)cnc(n2)Cl PI-34844 [0,0,0,0,0,1|2,1,0]=4 171 B13R2.3683 Brc1ccc2c(c1)cnc(n2)N PI-34644 [0,0,0,0,0,1|2,1,0]=4 172 B13R2.3683 C1=CC2=C(C=CC(=C2)Cl)C=C1O PI-36575 [0,0,0,0,0,1|2,1,0]=4 173 B13R2.3683 C1CC2=C(CC1=O)C=CC(=C2)F PI-17758 [0,0,0,0,0,1|2,0,1]=4 174 B13R2.3683 Fc1ccc2nc(C)ccc2c1 PI-28059 [0,0,0,0,0,1|3,0,0]=4 175 B13R2.3683 O=C1COc2c(N1)ccc(c2)F PI-39020 [0,0,0,0,0,1|2,0,1]=4 176 B13R2.3683 Oc1ccc2c(c1)ccc(n2)O PI-38999 [0,0,0,0,0,1|3,0,0]=4 177 B13R2.3683 Oc1ccc2cc(Br)ccc2c1 PI-12042 [0,0,0,0,0,1|2,1,0]=4 178 B13R2.3683 Oc1ccc2cc(O)ccc2c1 PI-10866 [0,0,0,0,0,1|3,0,0]=4 179 B13R2.5179 BrC1=CC=C2C(=NC=CC2=C1)N PI-39738 [0,0,0,0,0,1|2,1,0]=4 180 B13R2.5179 Brc1ccc2c(Cl)ncnc2c1 PI-36126 [0,0,0,0,0,1|1,1,1]=4 181 B13R2.5179 Brc1ccc2c(c1)cn[nH]c2=O PI-36953 [0,0,0,0,0,1|1,1,1]=4 182 B13R2.5179 C1=CC2=C(C=C1F)NC=CC2=O PI-29545 [0,0,0,0,0,1|1,0,1]=3 183 B13R2.5179 C1=CC2=C(C=CC(=C2)O)C(=C1)O PI-32101 [0,0,0,0,0,1|3,0,0]=4 184 B13R2.5179 C1=CC2=C(C=CNC2=O)C=C1F PI-48266 [0,0,0,0,0,1|1,0,2]=4 185 B13R2.5179 C1CNC(=O)C2=C1C=C(C=C2)F PI-48157 [0,0,0,0,0,1|1,0,2]=4 186 B13R2.5179 C1COC2=C(C1=O)C=CC(=C2)F PI-32696 [0,0,0,0,0,1|2,0,1]=4 187 B13R2.5179 CC1=CC2=C(C=C1)C(=NC=C2)Cl PI-34194 [0,0,0,0,0,1|3,0,0]=4 188 B13R2.5179 CC1=CC2=C(C=C1)C(=NC=C2)N PI-34195 [0,0,0,0,0,1|3,0,0]=4 189 B13R2.5179 Clc1ccc2c(c1)nccc2O PI-32129 [0,0,0,0,0,1|1,1,1]=4 190 B13R2.5179 Clc1ccc2c(ncnc2Cl)c1 PI-36120 [0,0,0,0,0,1|1,1,1]=4 191 B13R2.5179 Fc1ccc2c(Cl)ncnc2c1 PI-36119 [0,0,0,0,0,1|1,0,1]=3 192 B13R2.5179 Fc1ccc2c(nc[nH]c2=O)c1 PI-36118 [0,0,0,0,0,1|0,0,3]=4 193 B13R2.5179 NC1=C2C=CC(Br)=CC2=NC=N1 PI-46815 [0,0,0,0,0,1|1,1,1]=4 194 B13R2.5179 Nc1ccc2c(O)cccc2c1 PI-18377 [0,0,0,0,0,1|3,0,0]=4 195 B13R2.5179 O=C1C=CNC2=C1C=CC(C)=C2 PI-46705 [0,0,0,0,0,1|2,0,1]=4 196 B13R2.5179 O=C1CCCC2=C1C=CC(F)=C2 PI-32676 [0,0,0,0,0,1|2,0,1]=4 197 B10R1.1 C1=CC(=CC=C1C=NO)Cl PI-27545 [1,0,1,0,0,0|1,1,0]=4 198 B10R1.1 C1=CC(=CC=C1C=NO)F PI-23440 [1,0,1,0,0,0|1,0,0]=3 199 B10R1.1 C1=CC(=CC=C1CCN)F PI-33070 [1,0,1,0,0,0|1,0,1]=4 200 B10R1.13 Brc1ccc(cc1)C(=O)O PI-27741 [1,0,1,0,0,0|1,1,0]=4 201 B10R1.13 C1=C(C(=N)N)C=CC(=C1)F PI-38824 [1,0,1,0,0,0|1,0,0]=3 202 B10R1.13 C1=CC(=CC=C1C(=N)N)Cl PI-23130 [1,0,1,0,0,0|1,1,0]=4 203 B10R1.13 C1=CC(=CC=C1C(=N)N)Cl PI-36543 [1,0,1,0,0,0|1,1,0]=4 204 B10R1.13 C1=CC(=CC=C1C(=N)N)N PI-10167 [1,0,1,0,0,0|2,0,0]=4 205 B10R1.13 C1=CC(=CC=C1C(=N)N)N PI-30927 [1,0,1,0,0,0|2,0,0]=4 206 B10R1.13 C1=CC(=CC=C1C(=O)Cl)F PI-11984 [1,0,1,0,0,0|1,0,1]=4 207 B10R1.13 C1=CC(=CC=C1C(=O)N)Cl PI-30790 [1,0,1,0,0,0|0,1,1]=4 208 B10R1.13 C1=CC(=CC=C1C(=O)N)O PI-20729 [1,0,1,0,0,0|1,0,1]=4 209 B10R1.13 C1=CC(=CC=C1C(=O)O)I PI-12206 [1,0,1,0,0,0|1,1,0]=4 210 B10R1.13 C1=CC(=CC=C1C(=O)O)S PI-11996 [1,0,1,0,0,0|2,0,0]=4 211 B10R1.13 C1=CC(=CC=C1C(=O)[O-])F PI-28585 [1,0,1,0,0,0|1,0,1]=4 212 B10R1.13 C1=CC(=CC=C1C(=S)N)Br PI-22614 [1,0,1,0,0,0|0,2,0]=4 213 B10R1.13 C1=CC(=CC=C1C(N)=O)F PI-28843 [1,0,1,0,0,0|0,0,1]=3 214 B10R1.13 C1=CC(=NC=C1C(=O)O)F PI-16388 [1,0,1,0,0,0|2,0,0]=4 215 B10R1.13 CC1=CC=C(C=C1)C(=N)N PI-29803 [1,0,1,0,0,0|2,0,0]=4 216 B10R1.13 CC1=CC=C(C=C1)C(=S)N PI-30352 [1,0,1,0,0,0|1,1,0]=4 217 B10R1.13 C[C@@H](c1ccc(cc1)F)N PI-43974 [1,0,1,0,0,0|1,0,1]=4 218 B10R1.13 Fc1ccc(cc1)B(O)O PI-31092 [1,0,1,0,0,0|2,0,0]=4 219 B10R1.13 Fc1ccc(cc1)C(=O)O PI-16490 [1,0,1,0,0,0|1,0,0]=3 220 B10R1.13 Fc1ccc(cc1)C(C)O PI-32580 [1,0,1,0,0,0|1,0,1]=4 221 B10R1.13 NC(=N)c1ccc(cc1)Cl PI-30146 [1,0,1,0,0,0|1,1,0]=4 222 B10R1.13 NC(=O)c1ccc(cc1)Br PI-30860 [1,0,1,0,0,0|0,1,1]=4 223 B10R1.13 NC(=S)c1ccc(cc1)Cl PI-30378 [1,0,1,0,0,0|0,2,0]=4 224 B10R1.13 NC(=S)c1ccc(cc1)O PI-20877 [1,0,1,0,0,0|1,1,0]=4 225 B10R1.13 Nc1ccc(cc1)C(=O)N PI-38043 [1,0,1,0,0,0|1,0,1]=4 226 B10R1.13 O=C(N)C1=CC=C(I)C=C1 PI-41985 [1,0,1,0,0,0|0,1,1]=4 227 B10R1.13 Oc1ccc(cc1)C(=N)N PI-20730 [1,0,1,0,0,0|2,0,0]=4 228 B10R1.15 C1=CC=C(C=C1)C(CN)O PI-30384 [1,0,1,0,0,0|1,0,1]=4 229 B10R1.15 CC(=NO)C1=CC=CC=C1 PI-29764 [1,0,1,0,0,0|2,0,0]=4 230 B10R1.15 NCC(=O)c1ccccc1 PI-29691 [1,0,1,0,0,0|1,0,1]=4 231 B10R1.15 NCC(O)c1ccccc1 PI-17268 [1,0,1,0,0,0|1,0,1]=4 232 B10R1.15 NC[C@H](c1ccccc1)O PI-30721 [1,0,1,0,0,0|1,0,1]=4 233 B10R1.15 O\N=C(/c1ccccc1)\Cl PI-23127 [1,0,1,0,0,0|2,0,0]=4 234 B10R1.15 O\N=C(\c1ccccc1)/N PI-14770 [1,0,1,0,0,0|2,0,0]=4 235 B10R1.10 C1=CC(=CC(=C1)Br)C=NO PI-27659 [1,0,1,0,0,0|1,1,0]=4 236 B10R1.10 C1=CC(=CC(=C1)Cl)C=NO PI-27977 [1,0,1,0,0,0|1,1,0]=4 237 B10R1.10 C1=CC(=CC(=C1)F)N=C=O PI-19552 [1,0,1,0,0,0|0,0,2]=4 238 B10R1.10 C1=CC(=CC(=C1)F)N=C=S PI-19553 [1,0,1,0,0,0|0,1,1]=4 239 B10R1.17 C1=CC=C(C=C1)NNC=O PI-29787 [1,0,1,0,0,0|0,0,2]=4 240 B10R1.25 C1=CC(=C(C=C1F)Br)C=O PI-10440 [1,0,1,0,0,0|1,0,1]=4 241 B10R1.25 C1=CC(=C(C=C1F)Cl)C=O PI-28857 [1,0,1,0,0,0|1,0,1]=4 242 B10R1.25 C1=CC(=C(C=C1F)N)C=O PI-44252 [1,0,1,0,0,0|0,0,1]=3 243 B10R1.25 C1=CC(=C(C=C1F)O)C=O PI-18485 [1,0,1,0,0,0|1,0,1]=4 244 B10R1.25 C1=CC(=C(C=C1N)N)C=O PI-44093 [1,0,1,0,0,0|1,0,1]=4 245 B10R1.25 CC1=C(C=CC(=C1)F)C=O PI-10459 [1,0,1,0,0,0|1,0,1]=4 246 B10R1.25 CC1=CC(=C(C=C1)CO)N PI-26925 [1,0,1,0,0,0|1,0,1]=4 247 B10R1.25 COC1=C(C=C(C=C1)F)N PI-34515 [1,0,1,0,0,0|2,0,0]=4 248 B10R1.25 NC1=C(C=O)C=CC(=C1)Br PI-41093 [1,0,1,0,0,0|0,1,1]=4 249 B10R1.25 O=CC1=CC=C(F)C=C1F PI-16892 [1,0,1,0,0,0|1,0,1]=4 250 B10R1.25 OCc1ccc(F)cc1F PI-28645 [1,0,1,0,0,0|1,0,1]=4 251 B10R1.25 OCc1ccc(cc1Br)F PI-39278 [1,0,1,0,0,0|1,0,1]=4 252 B10R1.30 C1=CC(=C(C=C1F)C=O)O PI-10579 [1,0,1,0,0,0|2,0,0]=4 253 B10R1.30 C1=CC(=C(C=C1F)NN)Cl PI-50546 [1,0,1,0,0,0|1,0,1]=4 254 B10R1.30 C1=CC(=C(C=C1F)NN)F PI-10633 [1,0,1,0,0,0|1,0,1]=4 255 B10R1.30 C1=CC(=C(C=C1F)NN)F PI-21223 [1,0,1,0,0,0|1,0,1]=4 256 B10R1.30 CC1=C(C=C(C=C1)F)NN PI-10636 [1,0,1,0,0,0|0,0,2]=4 257 B10R1.30 CNC1=C(C=CC(=C1)F)Br PI-39646 [1,0,1,0,0,0|2,0,0]=4 258 B10R1.30 COC1=C(O)C=CC(F)=C1 PI-27601 [1,0,1,0,0,0|2,0,0]=4 259 B10R1.61 B(C1=CC=CC=C1N)(O)O PI-31530 [1,0,1,0,0,0|2,0,0]=4 260 B10R1.61 C1=CC=C(C(=C1)C(=O)O)I PI-18960 [1,0,1,0,0,0|2,0,0]=4 261 B10R1.61 C1=CC=C(C(=C1)C(=O)O)S PI-40146 [1,0,1,0,0,0|2,0,0]=4 262 B10R1.61 C1=CC=C(C(=C1)C(=S)N)N PI-17294 [1,0,1,0,0,0|0,1,1]=4 263 B10R1.61 C1=CN=CC(=C1C(=O)O)N PI-33158 [1,0,1,0,0,0|2,0,0]=4 264 B10R1.61 CC(=O)C1=CC=CC=C1N PI-29399 [1,0,1,0,0,0|1,0,1]=4 265 B10R1.61 CC(=O)c1ccccc1N PI-11796 [1,0,1,0,0,0|1,0,1]=4 266 B10R1.61 CC(O)C1=CC=CC=C1N PI-46775 [1,0,1,0,0,0|1,0,1]=4 267 B10R1.61 OC(=O)c1ccccc1F PI-16976 [1,0,1,0,0,0|2,0,0]=4 268 B10R1.61 OC(=O)c1cccnc1N PI-31221 [1,0,1,0,0,0|2,0,0]=4 269 B10R1.61 OC(=O)c1ccncc1N PI-10177 [1,0,1,0,0,0|2,0,0]=4 270 B10R1.61 OC(=O)c1cnccc1N PI-10029 [1,0,1,0,0,0|2,0,0]=4 271 B10R1.61 OC(=O)c1ncccc1N PI-14129 [1,0,1,0,0,0|2,0,0]=4 272 B10R2.7 C1=CC=C2C(=C1)C=CN2 PI-44715 [2,0,0,0,0,0|1,0,0]=3 273 B10R2.7 C1=CN=CC2=C1C=NN2 PI-50033 [2,0,0,0,0,0|1,0,0]=3 274 B10R2.7 C1=C[NH]C2=C1C=CN=C2 PI-10410 [2,0,0,0,0,0|2,0,0]=4 275 B10R2.7 C1=C[NH]C2=C1C=NC=C2 PI-10409 [2,0,0,0,0,0|2,0,0]=4 276 B10R2.7 C1CNC2=CC=CC=C21 PI-44710 [2,0,0,0,0,0|1,0,1]=4 277 B10R2.7 c1ccc2c(c1)[nH]cn2 PI-31348 [2,0,0,0,0,0|2,0,0]=4 278 B10R2.7 c1ccc2c(c1)[nH]nc2 PI-31379 [2,0,0,0,0,0|0,0,0]=2 279 B10R2.7 c1ccc2ccsc2c1 PI-14247 [2,0,0,0,0,0|2,0,0]=4 280 B10R2.7 c1ccc2cncn2c1 PI-36857 [2,0,0,0,0,0|2,0,0]=4 281 B10R2.7 c1cnc2[nH]ccc2c1 PI-16515 [2,0,0,0,0,0|2,0,0]=4 282 B10R2.7 c1cnc2c(c1)[nH]cc2 PI-10408 [2,0,0,0,0,0|2,0,0]=4 283 B12R1.367 C1=CC(=C(C=C1C(=O)NN)F)F PI-50448 [0,1,1,0,0,0|0,0,2]=4 284 B12R1.367 O=C(NN)C1=CC=C(F)C(Br)=C1 PI-41832 [0,1,1,0,0,0|0,0,2]=4 285 B12R1.367 O\N=C(/N)\c1ccc(F)c(Br)c1 PI-21435 [0,1,1,0,0,0|2,0,0]=4 286 B12R1.1703 C1=CC(=C(C=C1F)F)C(=O)CN PI-10228 [0,1,1,0,0,0|1,0,1]=4 287 B12R1.1703 C1=CC(=C(C=C1F)F)C(=O)NN PI-21139 [0,1,1,0,0,0|0,0,2]=4 288 B12R1.226 C1=CC(=CC(=C1)F)C=CC(=O)O PI-31202 [0,1,1,0,0,0|2,0,0]=4 289 B12R1.226 OC(=O)CCc1cccc(c1)F PI-16998 [0,1,1,0,0,0|2,0,0]=4 290 B12R1.232 C1=C(C(=CC(=C1Br)Cl)N)C(=O)O PI-45739 [0,1,1,0,0,0|1,1,0]=4 291 B12R1.232 C1=C(C(=CC(=C1F)F)Cl)C(=O)O PI-16074 [0,1,1,0,0,0|2,0,0]=4 292 B12R1.232 C1=C(C(=CC(=C1F)F)I)C(=O)O PI-34281 [0,1,1,0,0,0|2,0,0]=4 293 B12R1.232 C1=C(C(=CC(=C1F)F)N)C(=O)O PI-10424 [0,1,1,0,0,0|1,0,0]=3 294 B12R1.232 CC1=CC(=C(C=C1C(=O)O)F)F PI-34463 [0,1,1,0,0,0|2,0,0]=4 295 B12R1.232 CC1=CC(=C(C=C1F)F)C(=O)O PI-34480 [0,1,1,0,0,0|2,0,0]=4 296 B12R1.232 Fc1cc(C(=O)O)c(F)cc1F PI-16078 [0,1,1,0,0,0|2,0,0]=4 297 B12R1.232 O=C(O)C1=CC(C)=C(C)C=C1N PI-40810 [0,1,1,0,0,0|2,0,0]=4 298 B12R1.232 OC(=O)c1cc(Cl)c(F)cc1F PI-10197 [0,1,1,0,0,0|2,0,0]=4 299 B12R1.452 C1=CC(=CC(=C1C(O)=O)N)OC PI-41092 [0,1,1,0,0,0|2,0,0]=4 300 B12R1.893 C1=CC(=C(C(=C1C(=O)O)F)Cl)F PI-20034 [0,1,1,0,0,0|2,0,0]=4 301 B12R1.893 NC1=C(C=CC(F)=C1F)C(O)=O PI-41759 [0,1,1,0,0,0|1,0,0]=3 302 B12R1.893 O=C(O)C1=CC=C(Br)C(F)=C1N PI-41747 [0,1,1,0,0,0|1,1,0]=4 303 B12R1.893 OC(=O)c1ccc(F)c(F)c1F PI-16077 [0,1,1,0,0,0|2,0,0]=4 304 B12R1.893 OC(=O)c1ccc(c(c1C)F)F PI-34462 [0,1,1,0,0,0|2,0,0]=4 305 B12R1.893 OC(=O)c1ccc(c(c1F)C)F PI-34460 [0,1,1,0,0,0|2,0,0]=4 306 B12R1.893 OC(=O)c1ccc(c(c1N)C)C PI-32620 [0,1,1,0,0,0|2,0,0]=4 307 B12R1.893 OC(=O)c1ccc(c(c1N)I)C PI-34646 [0,1,1,0,0,0|2,0,0]=4 308 B12R1.1000 Fc1cc(F)c(C(=O)O)c(F)c1 PI-16079 [0,1,1,0,0,0|2,0,0]=4 309 B12R2.1 BrCC1=NOC2=CC=CC=C12 PI-42779 [1,1,0,0,0,0|2,0,0]=4 310 B12R2.1 C1=CC=C2C(=C1)C(=CN2)C=O PI-16169 [1,1,0,0,0,0|1,0,1]=4 311 B12R2.1 C1=CC=C2C(=C1)C(=NO2)CO PI-48272 [1,1,0,0,0,0|1,0,0]=3 312 B12R2.1 C1=CC=CC2=C1[NH]C=C2C#N PI-10233 [1,1,0,0,0,0|2,0,0]=4 313 B12R2.1 C1CC(=NO)C2=CC=CC=C21 PI-16549 [1,1,0,0,0,0|2,0,0]=4 314 B12R2.1 OCc1c[nH]c2c1cccc2 PI-16182 [1,1,0,0,0,0|1,0,0]=3 315 B12R2.18 Cc1[nH]c2ccccc2c1C PI-11086 [1,1,0,0,0,0|2,0,0]=4 316 B12R2.18 O=C1C(=O)Nc2ccccc12 PI-31744 [1,1,0,0,0,0|1,0,1]=4 317 B12R2.132 CC1=CNC2=C1C=C(C=C2)F PI-22695 [1,1,0,0,0,0|2,0,0]=4 318 B12R2.132 CC1=NNC2=NC=C(Br)C=C21 PI-46814 [1,1,0,0,0,0|2,0,0]=4 319 B12R2.132 ClC1=CC2=C(NN=C2Br)C=C1 PI-46753 [1,1,0,0,0,0|1,0,0]=3 320 B12R2.132 ClC1=NNC2=C1C=C(Br)C=C2 PI-46782 [1,1,0,0,0,0|1,0,0]=3 321 B12R2.132 Clc1ccc2nnn(O)c2c1 PI-17754 [1,1,0,0,0,0|1,0,1]=4 322 B12R2.132 FC1=CC2=C(NN=C2Br)C=C1 PI-46755 [1,1,0,0,0,0|1,0,0]=3 323 B12R2.132 Oc1ccc2c(c1)c(C)c[nH]2 PI-36560 [1,1,0,0,0,0|2,0,0]=4 324 B12R2.203 C1=CC2=C(C(=C1)I)C(=NN2)N PI-45020 [1,1,0,0,0,0|1,0,0]=3 325 B12R2.2028 CN1C2=CC=CC=C2C(=N1)N PI-34974 [1,1,0,0,0,0|1,0,0]=3 326 B12R2.44 C1=CC(=CC2=C1C=CN2)C#N PI-16832 [1,1,0,0,0,0|2,0,0]=4 327 B12R2.44 C1=CC(=CC2=C1C=CN2)C=O PI-16830 [1,1,0,0,0,0|2,0,0]=4 328 B12R2.44 C1=CC2=C(C=C1C=O)NN=C2 PI-45198 [1,1,0,0,0,0|1,0,0]=3 329 B12R2.44 COc1ccc2c(c1)[nH]cc2 PI-22794 [1,1,0,0,0,0|2,0,0]=4 330 B12R2.100 Brc1cc2cc[nH]c2cc1Cl PI-36785 [1,1,0,0,0,0|1,1,0]=4 331 B12R2.100 C1=C2C(=CC(=C1F)Cl)N=CN2 PI-20064 [1,1,0,0,0,0|2,0,0]=4 332 B12R2.100 C1=C2C=NNC2=CC(=C1Cl)Br PI-45184 [1,1,0,0,0,0|0,1,0]=3 333 B12R2.100 C1=C2C=NNC2=CC(=C1F)Br PI-45077 [1,1,0,0,0,0|0,1,0]=3 334 B12R2.100 C1=C2C=NNC2=CC(=C1F)Cl PI-45185 [1,1,0,0,0,0|0,1,0]=3 335 B12R2.100 C1=CNC2=CC(=C(C=C21)F)Cl PI-20090 [1,1,0,0,0,0|1,1,0]=4 336 B12R2.100 Cc1cc2[nH]nnc2cc1C PI-17666 [1,1,0,0,0,0|2,0,0]=4 337 B12R2.100 Clc1cc2cc[nH]c2cc1F PI-39070 [1,1,0,0,0,0|1,0,0]=3 338 B12R2.100 Fc1cc2NCCc2cc1F PI-36132 [1,1,0,0,0,0|1,0,1]=4 339 B12R2.100 Fc1cc2[nH]ccc2cc1F PI-10013 [1,1,0,0,0,0|1,0,0]=3 340 B12R2.100 Oc1cc2[nH]ccc2cc1O PI-41466 [1,1,0,0,0,0|2,0,0]=4 341 B12R2.246 C1=C(C=C2C(=C1Br)C=NN2)F PI-45207 [1,1,0,0,0,0|0,0,0]=2 342 B12R2.246 C1=C(C=C2C(=C1F)C=NN2)Cl PI-45211 [1,1,0,0,0,0|0,1,0]=3 343 B12R2.246 C1=C(C=C2C(=C1F)C=NN2)F PI-44585 [1,1,0,0,0,0|0,0,0]=2 344 B12R2.246 C1=C(C=C2C(=C1F)C=NN2)F PI-45182 [1,1,0,0,0,0|0,0,0]=2 345 B12R2.246 C1=CNC2=C1C(=CC(=C2)F)F PI-10576 [1,1,0,0,0,0|1,0,0]=3 346 B12R2.606 C1=CC2=C(C=C1F)NC(=O)S2 PI-45348 [1,1,0,0,0,0|2,0,0]=4 347 B12R2.606 C1=CC2=C(C=C1F)NC(=S)N2 PI-45213 [1,1,0,0,0,0|2,0,0]=4 348 B12R2.606 C1=CC2=C(C=C1F)NC(=S)S2 PI-45335 [1,1,0,0,0,0|2,0,0]=4 349 B12R2.606 C1C2=C(C=C(C=C2)F)NC1=O PI-22722 [1,1,0,0,0,0|1,0,1]=4 350 B12R2.606 CC1=NC2=C(N1)C=C(C=C2)F PI-45214 [1,1,0,0,0,0|2,0,0]=4 351 B12R2.606 CC=1NC2=C(C1)C=CC(=C2)Br PI-46796 [1,1,0,0,0,0|1,1,0]=4 352 B12R2.606 CN1C=C2C=CC(=CC2=N1)F PI-34967 [1,1,0,0,0,0|0,0,2]=4 353 B12R2.606 O=C1NC2=CC(F)=CC=C2N1 PI-46692 [1,1,0,0,0,0|2,0,0]=4 354 B14R2.8235 Fc1ccc2nc(Cl)nc(Cl)c2c1 PI-36225 [0,1,0,0,0,1|2,0,0]=4 355 B14R2.8235 Fc1ccc2nc(O)nc(O)c2c1 PI-36227 [0,1,0,0,0,1|1,0,0]=3 356 B14R2.29369 C1=CC2=C(C=CC(=C2F)F)C=C1O PI-34366 [0,1,0,0,0,1|2,0,0]=4 357 B14R2.29365 Brc1ccc2c(c1)nc(O)nc2O PI-36147 [0,1,0,0,0,1|0,1,1]=4 358 B14R2.29365 Fc1ccc2c(c1)[nH]c(=O)[nH]c2=O PI-36137 [0,1,0,0,0,1|0,0,2]=4 359 B14R2.29365 Fc1ccc2c(c1)nc(Cl)nc2Cl PI-36138 [0,1,0,0,0,1|1,0,1]=4 360 B14R2.300 C1=CC2=C(C=C1Br)NN=C2C(=O)O PI-45192 [0,2,0,0,0,0|0,1,0]=3 361 B14R2.300 Clc1ccc2c([nH]cc2C(=O)O)c1 PI-36183 [0,2,0,0,0,0|1,1,0]=4 362 B14R2.300 Clc1ccc2c([nH]nc2C(=O)O)c1 PI-36181 [0,2,0,0,0,0|0,1,0]=3 363 B14R2.467 NCCc1c[nH]c2c1ccc(c2)F PI-27701 [0,2,0,0,0,0|2,0,0]=4 364 B14R2.5719 O=[N+](C1=CC2=C(C=C1)C(C)=NN2)[O-] PI-37335 [0,2,0,0,0,0|2,0,0]=4 365 B14R2.8737 CC1=C(C=CC2=C1NC(=O)C2=O)F PI-34470 [0,2,0,0,0,0|1,0,1]=4 366 B14R2.645 CC1=CC2=C(C=C1F)NC(=O)C2=O PI-34496 [0,2,0,0,0,0|1,0,1]=4 367 B14R2.645 O=C1Nc2cc(F)c(F)cc2C1=O PI-36131 [0,2,0,0,0,0|1,0,1]=4 368 B14R2.27750 Fc1cc2NC(=O)C(=O)c2c(F)c1 PI-35978 [0,2,0,0,0,0|1,0,1]=4 369 B10R2.320 C1=CC=CC2=C1CC2=O PI-40938 [1,0,0,0,1,0|1,0,1]=4 370 B12R1.49 C1=CC(=CC=C1CC(=O)NN)F PI-50267 [0,0,1,0,0,1|0,0,2]=4 371 B12R1.233 C1=CC(=C(C=C1F)Br)CC(=O)O PI-44979 [0,0,1,0,0,1|2,0,0]=4 372 B12R1.233 C1=CC(=C(C=C1F)Cl)CC(=O)O PI-30228 [0,0,1,0,0,1|2,0,0]=4 373 B12R1.233 OC(=O)Cc1ccc(cc1F)F PI-13373 [0,0,1,0,0,1|2,0,0]=4