0 B9R1.69 Brc1c[nH]c(=O)[nH]c1=O PI-10545 [0,0,0,0,0,0|1,1,1]=3 1 B9R1.69 Brc1ccc(N)c(N)c1 PI-34413 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.69 Brc1ccc(c(c1)Br)F PI-28149 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.69 Brc1ccc(c(c1)F)F PI-10759 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.69 Brc1ccc(c(c1)N)F PI-21432 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.69 Brc1ccc(c(c1)O)F PI-33069 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.69 Brc1n[nH]c(=O)[nH]c1=O PI-10278 [0,0,0,0,0,0|2,1,1]=4 7 B9R1.69 Brc1ncc(N)c(C)c1 PI-20000 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.69 C1(=O)C(=NNC(=O)N1)[S-] PI-16311 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.69 C1=C(C(=CN=C1Br)N)N PI-44067 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.69 C1=C(C(=CN=C1Cl)Br)Cl PI-43244 [0,0,0,0,0,0|3,1,0]=4 11 B9R1.69 C1=C(C(=CN=C1Cl)F)I PI-34441 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.69 C1=C(C(=CN=C1Cl)I)F PI-48142 [0,0,0,0,0,0|3,1,0]=4 13 B9R1.69 C1=C(C(=CN=C1Cl)I)N PI-50551 [0,0,0,0,0,0|2,1,0]=3 14 B9R1.69 C1=C(C(=CN=C1Cl)N)Cl PI-48149 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.69 C1=C(C(=CN=C1Cl)O)N PI-43996 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.69 C1=C(C(=CN=C1F)Cl)I PI-34438 [0,0,0,0,0,0|3,1,0]=4 17 B9R1.69 C1=C(C(=CN=C1N)Br)F PI-45767 [0,0,0,0,0,0|3,1,0]=4 18 B9R1.69 C1=C(C(=CNC1=O)Cl)O PI-33382 [0,0,0,0,0,0|2,1,1]=4 19 B9R1.69 C1=C(C(=NC(=N1)Cl)Cl)F PI-15246 [0,0,0,0,0,0|2,0,1]=3 20 B9R1.69 C1=C(C(=NC(=N1)Cl)N)F PI-16325 [0,0,0,0,0,0|1,0,1]=2 21 B9R1.69 C1=CC(=C(C=C1Br)N)O PI-33346 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.69 C1=CC(=C(C=C1Cl)Cl)F PI-16889 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.69 C1=CC(=C(C=C1Cl)N)F PI-28267 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.69 C1=CC(=C(C=C1Cl)N)N PI-16272 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.69 C1=CC(=C(C=C1F)Br)F PI-28496 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.69 C1=CC(=C(C=C1F)N)Cl PI-28546 [0,0,0,0,0,0|3,1,0]=4 27 B9R1.69 C1=CC(=C(C=C1F)N)I PI-10621 [0,0,0,0,0,0|3,1,0]=4 28 B9R1.69 C1=CC(=C(C=C1F)N)N PI-30535 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.69 C1=CC(=C(C=C1I)Cl)F PI-17308 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.69 C1=CC(=C(C=C1I)F)F PI-28714 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.69 C1=CC(=C(C=C1N)Cl)F PI-15213 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.69 C1=CC(=C(C=C1N)N)F PI-28702 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.69 C1=CC(=C(C=C1N)N)N PI-30777 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.69 C1=CC(=C(C=C1O)Cl)F PI-16912 [0,0,0,0,0,0|3,0,1]=4 35 B9R1.69 C1=CC(=C(C=C1S)Cl)F PI-20118 [0,0,0,0,0,0|3,1,0]=4 36 B9R1.69 C1=CC(=C(C=C1S)F)F PI-28680 [0,0,0,0,0,0|3,1,0]=4 37 B9R1.69 C1=CC(=NC(=C1N)N)Cl PI-32634 [0,0,0,0,0,0|3,0,1]=4 38 B9R1.69 C1=CC(=O)C(=CC1=O)Cl PI-17305 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.69 C1=NC(=C(NC1=O)Cl)Br PI-45663 [0,0,0,0,0,0|3,1,0]=4 40 B9R1.69 CC1=C(C=C(C=C1)Br)N PI-31358 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.69 CC1=C(C=C(C=C1)F)N PI-16382 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.69 CC1=C(C=C(C=C1)I)N PI-19927 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.69 CC1=C(C=C(C=C1)O)N PI-11312 [0,0,0,0,0,0|3,0,1]=4 44 B9R1.69 CC1=C(C=CC(=C1)Br)F PI-31216 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.69 CC1=C(C=CC(=C1)Cl)F PI-28542 [0,0,0,0,0,0|4,0,0]=4 46 B9R1.69 CC1=C(C=CC(=C1)F)F PI-28543 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.69 CC1=C(C=CC(=C1)I)F PI-10673 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.69 CC1=C(C=CC(=C1)N)F PI-16984 [0,0,0,0,0,0|4,0,0]=4 49 B9R1.69 CC1=C(C=CC(=C1)O)F PI-10655 [0,0,0,0,0,0|3,0,1]=4 50 B9R1.69 CC1=C(C=CC(=C1)S)F PI-23789 [0,0,0,0,0,0|3,1,0]=4 51 B9R1.69 CC1=C(C=CC(=N1)Br)F PI-10396 [0,0,0,0,0,0|3,0,1]=4 52 B9R1.69 CC1=C(C=CC(=N1)Cl)F PI-34442 [0,0,0,0,0,0|3,0,1]=4 53 B9R1.69 CC1=C(NC(=O)N=C1)N PI-30711 [0,0,0,0,0,0|1,0,0]=1 54 B9R1.69 CC1=C(NC(=O)N=C1)N PI-30742 [0,0,0,0,0,0|1,0,0]=1 55 B9R1.69 CC1=CC(=C(C=C1)Cl)N PI-17325 [0,0,0,0,0,0|3,1,0]=4 56 B9R1.69 CC1=CC(=C(C=C1)F)Cl PI-10668 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.69 CC1=CC(=C(C=C1)F)F PI-16918 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.69 CC1=CC(=C(C=C1)F)I PI-10677 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.69 CC1=CC(=C(C=C1)F)N PI-16989 [0,0,0,0,0,0|3,0,0]=3 60 B9R1.69 CC1=CC(=C(C=C1)F)O PI-10653 [0,0,0,0,0,0|4,0,0]=4 61 B9R1.69 CC1=CC(=C(C=C1)O)N PI-44624 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.69 CC1=CC(=NC=C1Br)Br PI-39259 [0,0,0,0,0,0|3,1,0]=4 63 B9R1.69 CC1=CC(=NC=C1N)Cl PI-30838 [0,0,0,0,0,0|4,0,0]=4 64 B9R1.69 CC1=CC(N)=NC=C1B PI-30996 [0,0,0,0,0,0|4,0,0]=4 65 B9R1.69 CC1=CC(N)=NC=C1Cl PI-31795 [0,0,0,0,0,0|3,1,0]=4 66 B9R1.69 CC1=CC=C(F)C(Br)=N1 PI-40471 [0,0,0,0,0,0|3,0,1]=4 67 B9R1.69 CC1=CN=C(N=C1Cl)Cl PI-21324 [0,0,0,0,0,0|3,0,1]=4 68 B9R1.69 CC1=CN=C(N=C1Cl)N PI-45074 [0,0,0,0,0,0|3,0,1]=4 69 B9R1.69 CC1=CNC(=O)NC1=O PI-11513 [0,0,0,0,0,0|2,0,1]=3 70 B9R1.69 CC1=NC(=C(C=C1)Br)N PI-30104 [0,0,0,0,0,0|2,1,1]=4 71 B9R1.69 CC1=NC(=NC=C1N)C PI-32946 [0,0,0,0,0,0|3,0,1]=4 72 B9R1.69 CC1=NC(=NC=C1N)Cl PI-45749 [0,0,0,0,0,0|3,0,1]=4 73 B9R1.69 CC1=NC(Cl)=NC=C1Br PI-46752 [0,0,0,0,0,0|2,1,1]=4 74 B9R1.69 CC1=NC(Cl)=NC=C1Cl PI-46723 [0,0,0,0,0,0|2,1,1]=4 75 B9R1.69 CC1=NC=C(C(=O)N1)I PI-47320 [0,0,0,0,0,0|2,1,0]=3 76 B9R1.69 CN1C=CC(=O)NC1=O PI-12567 [0,0,0,0,0,0|4,0,0]=4 77 B9R1.69 Cc1ccc(I)c(N)c1 PI-13704 [0,0,0,0,0,0|3,1,0]=4 78 B9R1.69 Cc1ccc(c(c1)Br)F PI-28541 [0,0,0,0,0,0|4,0,0]=4 79 B9R1.69 Cc1ccc(c(c1)N)Br PI-32614 [0,0,0,0,0,0|3,1,0]=4 80 B9R1.69 Cc1ccc(c(c1)N)N PI-33398 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.69 Cc1ncc(c(c1)C)N PI-38589 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.69 ClC1=CC(=C(C=C1)F)O PI-10650 [0,0,0,0,0,0|4,0,0]=4 83 B9R1.69 ClC1=NC=C(Br)C(N)=C1 PI-39470 [0,0,0,0,0,0|2,1,0]=3 84 B9R1.69 Clc1c[nH]c(=O)[nH]c1=O PI-18269 [0,0,0,0,0,0|1,1,1]=3 85 B9R1.69 Clc1ccc(c(c1)Br)F PI-20628 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.69 Clc1ccc(c(c1)F)F PI-12302 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.69 Clc1ccc(c(c1)N)S PI-14245 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.69 Clc1ccc(c(n1)Cl)F PI-36904 [0,0,0,0,0,0|3,0,1]=4 89 B9R1.69 Clc1ncc(Br)c(Cl)n1 PI-14402 [0,0,0,0,0,0|2,1,1]=4 90 B9R1.69 Clc1ncc(I)c(Cl)n1 PI-21337 [0,0,0,0,0,0|2,1,1]=4 91 B9R1.69 Clc1ncc(N)c(Cl)n1 PI-36018 [0,0,0,0,0,0|3,0,1]=4 92 B9R1.69 Clc1ncc(N)c(N)n1 PI-36496 [0,0,0,0,0,0|2,0,1]=3 93 B9R1.69 Clc1ncc(c(c1)C)Br PI-38910 [0,0,0,0,0,0|3,1,0]=4 94 B9R1.69 Clc1ncc(c(n1)Cl)Cl PI-15248 [0,0,0,0,0,0|2,1,1]=4 95 B9R1.69 Fc1ccc(c(c1)Cl)F PI-28303 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.69 Fc1ccc(c(c1)F)F PI-10729 [0,0,0,0,0,0|4,0,0]=4 97 B9R1.69 Fc1ccc(c(c1)N)Br PI-10617 [0,0,0,0,0,0|3,1,0]=4 98 B9R1.69 Fc1ccc(c(c1)N)F PI-16941 [0,0,0,0,0,0|3,0,0]=3 99 B9R1.69 Fc1ccc(c(c1)N)O PI-15926 [0,0,0,0,0,0|4,0,0]=4 100 B9R1.69 Fc1ccc(c(c1)O)F PI-16913 [0,0,0,0,0,0|4,0,0]=4 101 B9R1.69 Fc1ncc(C)c(I)c1 PI-34432 [0,0,0,0,0,0|4,0,0]=4 102 B9R1.69 Fc1ncc(c(c1)C)Br PI-38328 [0,0,0,0,0,0|3,1,0]=4 103 B9R1.69 Ic1c[nH]c(=O)[nH]c1=O PI-10547 [0,0,0,0,0,0|1,1,1]=3 104 B9R1.69 Ic1ccc(F)c(Br)c1 PI-21453 [0,0,0,0,0,0|4,0,0]=4 105 B9R1.69 NC1=CC(Br)=CC=C1Cl PI-20602 [0,0,0,0,0,0|3,1,0]=4 106 B9R1.69 NC1=CC=C(Cl)C(N)=C1 PI-11322 [0,0,0,0,0,0|3,1,0]=4 107 B9R1.69 NC1=NC(N)=CC=C1Br PI-46757 [0,0,0,0,0,0|2,1,1]=4 108 B9R1.69 NC1=NC=C(Br)C(Cl)=C1 PI-42591 [0,0,0,0,0,0|3,1,0]=4 109 B9R1.69 Nc1ccc(F)c(C)n1 PI-34452 [0,0,0,0,0,0|3,0,1]=4 110 B9R1.69 Nc1ccc(c(c1)Br)F PI-12304 [0,0,0,0,0,0|4,0,0]=4 111 B9R1.69 Nc1nc(=O)[nH]cc1Br PI-16324 [0,0,0,0,0,0|0,1,2]=3 112 B9R1.69 Nc1nc(=O)[nH]cc1F PI-10154 [0,0,0,0,0,0|0,0,2]=2 113 B9R1.69 O=C1N=CC(I)=C(N)N1 PI-37012 [0,0,0,0,0,0|0,1,0]=1 114 B9R1.69 O=C1NC(C(=CN1)F)=O PI-16620 [0,0,0,0,0,0|1,0,1]=2 115 B9R1.69 OC1=CC=C(N)C=C1N PI-32464 [0,0,0,0,0,0|4,0,0]=4 116 B9R1.69 Oc1ccc(F)c(N)c1 PI-33926 [0,0,0,0,0,0|2,0,1]=3 117 B9R1.69 Oc1ccc(c(c1)Br)F PI-10647 [0,0,0,0,0,0|3,0,1]=4 118 B9R1.69 Oc1ccc(c(c1)F)F PI-16914 [0,0,0,0,0,0|3,0,1]=4 119 B9R1.69 Oc1ccc(c(c1)O)F PI-10442 [0,0,0,0,0,0|3,0,1]=4 120 B9R1.69 Oc1ncc(c(c1)Br)F PI-38921 [0,0,0,0,0,0|2,0,1]=3 121 B8R1.3 Brc1ccc(C)cn1 PI-10149 [1,0,0,0,0,0|3,0,0]=4 122 B8R1.3 Brc1ccc(cn1)F PI-23448 [1,0,0,0,0,0|2,0,0]=3 123 B8R1.3 Brc1ccc(cn1)N PI-31056 [1,0,0,0,0,0|3,0,0]=4 124 B8R1.3 Brc1cnc(Cl)nc1 PI-20664 [1,0,0,0,0,0|1,1,1]=4 125 B8R1.3 Brc1cnc(nc1)I PI-24188 [1,0,0,0,0,0|1,1,1]=4 126 B8R1.3 Brc1cnc(nc1)N PI-31304 [1,0,0,0,0,0|1,1,1]=4 127 B8R1.3 C1=C(C=NC(=N1)Cl)Cl PI-32939 [1,0,0,0,0,0|1,1,1]=4 128 B8R1.3 C1=C(C=NC(=N1)Cl)I PI-39116 [1,0,0,0,0,0|1,1,1]=4 129 B8R1.3 C1=C(C=NC(=N1)Cl)O PI-40987 [1,0,0,0,0,0|2,0,1]=4 130 B8R1.3 C1=C(C=NC(=N1)F)I PI-45099 [1,0,0,0,0,0|1,1,1]=4 131 B8R1.3 C1=C(C=NC(=N1)N)Cl PI-30697 [1,0,0,0,0,0|1,1,1]=4 132 B8R1.3 C1=C(C=NC(=N1)N)F PI-43297 [1,0,0,0,0,0|1,0,1]=3 133 B8R1.3 C1=C(C=NC(=N1)N)I PI-21304 [1,0,0,0,0,0|1,1,1]=4 134 B8R1.3 C1=C(C=NC(=N1)N)N PI-34826 [1,0,0,0,0,0|2,0,1]=4 135 B8R1.3 C1=C(C=NC(=O)N1)Br PI-31176 [1,0,0,0,0,0|0,1,0]=2 136 B8R1.3 C1=C(C=NC(=O)N1)I PI-32628 [1,0,0,0,0,0|0,1,0]=2 137 B8R1.3 C1=C(I)C=CC(=N1)Br PI-38918 [1,0,0,0,0,0|2,1,0]=4 138 B8R1.3 C1=C(N=CC(=O)N1)Cl PI-45666 [1,0,0,0,0,0|2,1,0]=4 139 B8R1.3 C1=CC(=CC=C1F)S PI-17595 [1,0,0,0,0,0|2,1,0]=4 140 B8R1.3 C1=CC(=CC=C1F)[S-] PI-28110 [1,0,0,0,0,0|2,1,0]=4 141 B8R1.3 C1=CC(=NC=C1Br)F PI-23450 [1,0,0,0,0,0|2,1,0]=4 142 B8R1.3 C1=CC(=NC=C1Br)I PI-22827 [1,0,0,0,0,0|2,1,0]=4 143 B8R1.3 C1=CC(=NC=C1Cl)Br PI-10389 [1,0,0,0,0,0|2,1,0]=4 144 B8R1.3 C1=CC(=NC=C1Cl)F PI-16762 [1,0,0,0,0,0|2,1,0]=4 145 B8R1.3 C1=CC(=NC=C1Cl)I PI-34652 [1,0,0,0,0,0|2,1,0]=4 146 B8R1.3 C1=CC(=NC=C1F)Cl PI-10085 [1,0,0,0,0,0|2,0,0]=3 147 B8R1.3 C1=CC(=NC=C1F)N PI-23434 [1,0,0,0,0,0|2,0,0]=3 148 B8R1.3 C1=CC(=NC=C1I)Cl PI-20140 [1,0,0,0,0,0|2,1,0]=4 149 B8R1.3 C1=CC(=NC=C1I)F PI-16769 [1,0,0,0,0,0|2,1,0]=4 150 B8R1.3 C1=CC(=NC=C1N)N PI-33879 [1,0,0,0,0,0|3,0,0]=4 151 B8R1.3 C1=CC(=NC=C1O)Cl PI-10086 [1,0,0,0,0,0|3,0,0]=4 152 B8R1.3 C1=CC(=NC=C1O)I PI-34186 [1,0,0,0,0,0|3,0,0]=4 153 B8R1.3 C1=CC(=NC=C1O)N PI-34189 [1,0,0,0,0,0|3,0,0]=4 154 B8R1.3 C1=CC(=NNC1=O)Cl PI-48747 [1,0,0,0,0,0|2,1,0]=4 155 B8R1.3 CC1=CN=C(C=C1)F PI-34372 [1,0,0,0,0,0|3,0,0]=4 156 B8R1.3 CC1=CNC(=O)C=C1 PI-15774 [1,0,0,0,0,0|2,0,0]=3 157 B8R1.3 CC1=NC=C(C=C1)F PI-16773 [1,0,0,0,0,0|2,0,0]=3 158 B8R1.3 CC1=NC=C(C=C1)O PI-11928 [1,0,0,0,0,0|3,0,0]=4 159 B8R1.3 CC1=NC=C(C=N1)Br PI-35175 [1,0,0,0,0,0|1,1,1]=4 160 B8R1.3 CC1=NC=C(C=N1)F PI-45025 [1,0,0,0,0,0|1,0,1]=3 161 B8R1.3 CC1=NC=C(C=N1)N PI-32948 [1,0,0,0,0,0|2,0,1]=4 162 B8R1.3 CC1=NC=C(C=N1)O PI-42081 [1,0,0,0,0,0|2,0,1]=4 163 B8R1.3 CC1=NNC(=O)C=C1 PI-44765 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.3 Cc1ccc(Cl)cn1 PI-36942 [1,0,0,0,0,0|2,1,0]=4 165 B8R1.3 Cc1ccc(F)cc1 PI-34120 [1,0,0,0,0,0|3,0,0]=4 166 B8R1.3 Cc1ccc(cn1)Br PI-23479 [1,0,0,0,0,0|2,1,0]=4 167 B8R1.3 Cc1ccc(cn1)N PI-13104 [1,0,0,0,0,0|3,0,0]=4 168 B8R1.3 Clc1ccc(Br)cn1 PI-31223 [1,0,0,0,0,0|2,1,0]=4 169 B8R1.3 Clc1ccc(Cl)nc1 PI-10179 [1,0,0,0,0,0|2,1,0]=4 170 B8R1.3 Clc1ccc(cn1)C PI-16696 [1,0,0,0,0,0|3,0,0]=4 171 B8R1.3 Clc1ccc(cn1)N PI-10026 [1,0,0,0,0,0|3,0,0]=4 172 B8R1.3 Clc1cnc(O)nc1 PI-21321 [1,0,0,0,0,0|0,1,2]=4 173 B8R1.3 Clc1cnc(nc1)I PI-38331 [1,0,0,0,0,0|1,1,1]=4 174 B8R1.3 FC1=CC=C(Br)C=C1 PI-33066 [1,0,0,0,0,0|3,0,0]=4 175 B8R1.3 FC1=NC=C(C=C1)O PI-40204 [1,0,0,0,0,0|3,0,0]=4 176 B8R1.3 Fc1ccc(I)cc1 PI-15769 [1,0,0,0,0,0|3,0,0]=4 177 B8R1.3 Fc1ccc(N)cn1 PI-10292 [1,0,0,0,0,0|3,0,0]=4 178 B8R1.3 Fc1ccc(cc1)F PI-11683 [1,0,0,0,0,0|3,0,0]=4 179 B8R1.3 Fc1ccc(cn1)F PI-35922 [1,0,0,0,0,0|2,0,0]=3 180 B8R1.3 Fc1cnc(Cl)nc1 PI-21320 [1,0,0,0,0,0|1,0,1]=3 181 B8R1.3 Ic1ccc(cn1)I PI-32190 [1,0,0,0,0,0|2,1,0]=4 182 B8R1.3 NC1=CN=C(N)C=C1 PI-16689 [1,0,0,0,0,0|3,0,0]=4 183 B8R1.3 Nc1ccc(cc1)F PI-33065 [1,0,0,0,0,0|3,0,0]=4 184 B8R1.3 Nc1ccc(cn1)Br PI-22846 [1,0,0,0,0,0|2,1,0]=4 185 B8R1.3 Nc1ccc(cn1)C PI-25208 [1,0,0,0,0,0|3,0,0]=4 186 B8R1.3 Nc1ccc(cn1)Cl PI-31015 [1,0,0,0,0,0|2,1,0]=4 187 B8R1.3 Nc1ccc(cn1)I PI-10252 [1,0,0,0,0,0|2,1,0]=4 188 B8R1.3 Nc1cnc(nc1)Cl PI-21313 [1,0,0,0,0,0|2,0,1]=4 189 B8R1.3 OC1=CN=C(Br)C=C1 PI-40203 [1,0,0,0,0,0|3,0,0]=4 190 B8R1.3 OC1=NC=C(N)C=C1 PI-37317 [1,0,0,0,0,0|2,0,1]=4 191 B8R1.3 Oc1ccc(cc1)F PI-27532 [1,0,0,0,0,0|2,0,1]=4 192 B8R1.3 Oc1ccc(cn1)Br PI-16568 [1,0,0,0,0,0|1,1,1]=4 193 B8R1.3 Oc1ccc(cn1)C PI-37410 [1,0,0,0,0,0|2,0,1]=4 194 B8R1.3 Oc1ccc(cn1)Cl PI-15823 [1,0,0,0,0,0|1,1,1]=4 195 B8R1.3 Oc1ccc(cn1)F PI-34437 [1,0,0,0,0,0|1,0,1]=3 196 B8R1.3 Oc1ccc(cn1)N PI-28402 [1,0,0,0,0,0|2,0,1]=4 197 B8R1.3 Oc1cnc(N)nc1 PI-36493 [1,0,0,0,0,0|2,0,1]=4 198 B8R1.4 BrC1=NC=CC(N)=N1 PI-46732 [1,0,0,0,0,0|1,0,1]=3 199 B8R1.4 Brc1cc[nH]c(=O)c1 PI-38916 [1,0,0,0,0,0|2,0,1]=4 200 B8R1.4 Brc1ccnc(c1)C PI-32240 [1,0,0,0,0,0|3,0,0]=4 201 B8R1.4 Brc1ccnc(c1)Cl PI-31296 [1,0,0,0,0,0|3,0,0]=4 202 B8R1.4 Brc1ccnc(c1)N PI-35022 [1,0,0,0,0,0|3,0,0]=4 203 B8R1.4 C1=C(N=CN=C1N)N PI-21325 [1,0,0,0,0,0|3,0,0]=4 204 B8R1.4 C1=C(N=CNC1=O)N PI-21312 [1,0,0,0,0,0|2,0,1]=4 205 B8R1.4 C1=C(NC(=S)N=C1)N PI-21307 [1,0,0,0,0,0|0,1,0]=2 206 B8R1.4 C1=CC(=CC(=C1)I)N PI-41422 [1,0,0,0,0,0|3,0,0]=4 207 B8R1.4 C1=CC(=NC(=C1)Br)N PI-14243 [1,0,0,0,0,0|2,0,1]=4 208 B8R1.4 C1=CC(=O)NC(=C1)N PI-28596 [1,0,0,0,0,0|1,0,0]=2 209 B8R1.4 C1=CC(=O)NC(=C1)O PI-11767 [1,0,0,0,0,0|2,0,0]=3 210 B8R1.4 C1=CN=C(C=C1Br)F PI-24079 [1,0,0,0,0,0|3,0,0]=4 211 B8R1.4 C1=CN=C(C=C1F)F PI-40869 [1,0,0,0,0,0|3,0,0]=4 212 B8R1.4 C1=CN=C(C=C1I)Cl PI-11387 [1,0,0,0,0,0|3,0,0]=4 213 B8R1.4 C1=CN=C(N=C1Br)Br PI-50057 [1,0,0,0,0,0|2,0,1]=4 214 B8R1.4 C1=CN=C(N=C1Cl)Br PI-39637 [1,0,0,0,0,0|2,0,1]=4 215 B8R1.4 C1=CN=C(N=C1N)Cl PI-10283 [1,0,0,0,0,0|1,0,1]=3 216 B8R1.4 C1=CN=C(N=C1N)F PI-45161 [1,0,0,0,0,0|1,0,1]=3 217 B8R1.4 C1=CN=C(N=C1N)N PI-11759 [1,0,0,0,0,0|1,0,1]=3 218 B8R1.4 C1=CN=C(NC1=O)N PI-12796 [1,0,0,0,0,0|2,0,0]=3 219 B8R1.4 C1=CNC(=O)C=C1N PI-34824 [1,0,0,0,0,0|1,0,1]=3 220 B8R1.4 C1=CNC(=O)C=C1O PI-10171 [1,0,0,0,0,0|2,0,1]=4 221 B8R1.4 C1=CNC(=S)NC1=O PI-48541 [1,0,0,0,0,0|1,1,1]=4 222 B8R1.4 C1=NC(=NC(=N1)N)N PI-47005 [1,0,0,0,0,0|2,0,1]=4 223 B8R1.4 C1=NNC(=O)NC1=O PI-31204 [1,0,0,0,0,0|2,0,1]=4 224 B8R1.4 CC1=CC(=NC=C1)Br PI-10385 [1,0,0,0,0,0|3,0,0]=4 225 B8R1.4 CC1=CC(=NC=C1)Cl PI-16626 [1,0,0,0,0,0|3,0,0]=4 226 B8R1.4 CC1=CC=CC(=O)N1 PI-16688 [1,0,0,0,0,0|2,0,0]=3 227 B8R1.4 CC1=NC(=NC=C1)Br PI-21314 [1,0,0,0,0,0|2,0,1]=4 228 B8R1.4 CC1=NC=CC(=C1)N PI-13314 [1,0,0,0,0,0|2,0,0]=3 229 B8R1.4 Cc1cc[nH]c(=O)n1 PI-21340 [1,0,0,0,0,0|1,0,2]=4 230 B8R1.4 Cc1cccc(N)n1 PI-32836 [1,0,0,0,0,0|2,0,1]=4 231 B8R1.4 Cc1ccnc(Cl)n1 PI-32949 [1,0,0,0,0,0|2,0,1]=4 232 B8R1.4 Cc1ccnc(N)c1 PI-32462 [1,0,0,0,0,0|3,0,0]=4 233 B8R1.4 Cc1ccnc(c1)F PI-23598 [1,0,0,0,0,0|3,0,0]=4 234 B8R1.4 Cc1ccnc(n1)N PI-21305 [1,0,0,0,0,0|2,0,1]=4 235 B8R1.4 Cc1ccnc(n1)S PI-21344 [1,0,0,0,0,0|1,1,1]=4 236 B8R1.4 Clc1ccnc(Cl)c1 PI-16701 [1,0,0,0,0,0|3,0,0]=4 237 B8R1.4 Clc1ccnc(Cl)n1 PI-28484 [1,0,0,0,0,0|2,0,1]=4 238 B8R1.4 Clc1ccnc(c1)N PI-11783 [1,0,0,0,0,0|3,0,0]=4 239 B8R1.4 Clc1ccnc(n1)C PI-38934 [1,0,0,0,0,0|2,0,1]=4 240 B8R1.4 Clc1ccnc(n1)N PI-27559 [1,0,0,0,0,0|2,0,1]=4 241 B8R1.4 Fc1ccnc(Cl)c1 PI-16761 [1,0,0,0,0,0|3,0,0]=4 242 B8R1.4 Fc1ccnc(c1)Br PI-34451 [1,0,0,0,0,0|3,0,0]=4 243 B8R1.4 Ic1ccnc(Br)c1 PI-27035 [1,0,0,0,0,0|3,0,0]=4 244 B8R1.4 Ic1ccnc(N)c1 PI-36261 [1,0,0,0,0,0|3,0,0]=4 245 B8R1.4 Ic1ccnc(c1)F PI-34431 [1,0,0,0,0,0|3,0,0]=4 246 B8R1.4 NC1=CC(N)=NC=C1 PI-37257 [1,0,0,0,0,0|2,0,0]=3 247 B8R1.4 NC1=NC=CC(=C1)F PI-39567 [1,0,0,0,0,0|3,0,0]=4 248 B8R1.4 NC1=NC=CC(=N1)Br PI-40255 [1,0,0,0,0,0|2,0,1]=4 249 B8R1.4 Nc1cc[nH]c(=O)n1 PI-16002 [1,0,0,0,0,0|0,0,2]=3 250 B8R1.4 Nc1cccc(F)c1 PI-16946 [1,0,0,0,0,0|3,0,0]=4 251 B8R1.4 Nc1cccc(F)n1 PI-15934 [1,0,0,0,0,0|2,0,1]=4 252 B8R1.4 Nc1cccc(N)n1 PI-33126 [1,0,0,0,0,0|2,0,1]=4 253 B8R1.4 Nc1cccc(S)c1 PI-21351 [1,0,0,0,0,0|2,1,0]=4 254 B8R1.4 Nc1cccc(n1)Cl PI-27605 [1,0,0,0,0,0|2,0,1]=4 255 B8R1.4 Nc1ccnc(c1)Br PI-23436 [1,0,0,0,0,0|2,0,0]=3 256 B8R1.4 Nc1ccnc(c1)Cl PI-23438 [1,0,0,0,0,0|2,0,0]=3 257 B8R1.4 Nc1cnnc(c1)Cl PI-39012 [1,0,0,0,0,0|3,0,0]=4 258 B8R1.4 Nc1nc(=O)[nH]cn1 PI-18980 [1,0,0,0,0,0|1,0,2]=4 259 B8R1.4 Nc1ncnc(c1)Cl PI-21308 [1,0,0,0,0,0|3,0,0]=4 260 B8R1.4 O=C1C=CC=C(Cl)N1 PI-35283 [1,0,0,0,0,0|2,0,0]=3 261 B8R1.4 O=C1NC(C=CN1)=O PI-37339 [1,0,0,0,0,0|1,0,1]=3 262 B8R1.4 OC1=NC=CC(C)=C1 PI-28120 [1,0,0,0,0,0|2,0,1]=4 263 B8R1.4 Oc1ccnc(c1)N PI-34188 [1,0,0,0,0,0|3,0,0]=4 264 B8R1.4 Oc1ccnc(n1)Cl PI-38931 [1,0,0,0,0,0|2,0,1]=4 265 B8R1.4 S=c1cc[nH]c(=O)[nH]1 PI-12580 [1,0,0,0,0,0|1,0,1]=3 266 B8R1.5 Brc1cccnc1N PI-30126 [1,0,0,0,0,0|1,1,1]=4 267 B8R1.5 C1=C(C(=NC=N1)Cl)F PI-42904 [1,0,0,0,0,0|1,0,1]=3 268 B8R1.5 C1=C(C(=NC=N1)N)F PI-45138 [1,0,0,0,0,0|0,0,1]=2 269 B8R1.5 C1=C(C(=O)NC=N1)Br PI-45070 [1,0,0,0,0,0|1,1,0]=3 270 B8R1.5 C1=C(C(=O)NC=N1)F PI-15254 [1,0,0,0,0,0|1,0,0]=2 271 B8R1.5 C1=C(C(=O)NC=N1)N PI-45141 [1,0,0,0,0,0|2,0,0]=3 272 B8R1.5 C1=CC(=C(N=C1)Br)F PI-34450 [1,0,0,0,0,0|2,0,1]=4 273 B8R1.5 C1=CC(=C(N=C1)Cl)F PI-16375 [1,0,0,0,0,0|2,0,1]=4 274 B8R1.5 C1=CC(=C(N=C1)F)N PI-16374 [1,0,0,0,0,0|3,0,0]=4 275 B8R1.5 C1=CC(=C(N=C1)N)Cl PI-31793 [1,0,0,0,0,0|1,1,1]=4 276 B8R1.5 C1=CC=C(C(=C1)F)I PI-23606 [1,0,0,0,0,0|3,0,0]=4 277 B8R1.5 C1=CC=C(C(=C1)F)S PI-16911 [1,0,0,0,0,0|3,0,0]=4 278 B8R1.5 C1=CC=C(C(=C1)N)I PI-10964 [1,0,0,0,0,0|2,1,0]=4 279 B8R1.5 C1=CC=C(C(=C1)N)N PI-17100 [1,0,0,0,0,0|3,0,0]=4 280 B8R1.5 C1=CC=C(C(=C1)O)F PI-11848 [1,0,0,0,0,0|3,0,0]=4 281 B8R1.5 C1=CN=CC(=C1Cl)Br PI-28453 [1,0,0,0,0,0|2,1,0]=4 282 B8R1.5 C1=CN=CC(=C1Cl)Cl PI-28640 [1,0,0,0,0,0|2,1,0]=4 283 B8R1.5 C1=CN=CC(=C1Cl)F PI-10413 [1,0,0,0,0,0|2,0,0]=3 284 B8R1.5 C1=CN=CC(=C1Cl)N PI-28262 [1,0,0,0,0,0|3,0,0]=4 285 B8R1.5 C1=CN=CC(=C1I)F PI-34425 [1,0,0,0,0,0|2,0,0]=3 286 B8R1.5 C1=CNC(=O)C(=C1)Cl PI-35282 [1,0,0,0,0,0|2,1,0]=4 287 B8R1.5 C1=CNC(=O)C(=C1)F PI-34509 [1,0,0,0,0,0|2,0,0]=3 288 B8R1.5 C1=CNC(=O)C(=C1)N PI-10375 [1,0,0,0,0,0|3,0,0]=4 289 B8R1.5 C1=CNC(=S)C(=C1)N PI-36113 [1,0,0,0,0,0|3,0,0]=4 290 B8R1.5 CC1=C(Br)C=CN=C1 PI-40508 [1,0,0,0,0,0|3,0,0]=4 291 B8R1.5 CC1=C(C=CN=C1)Cl PI-40252 [1,0,0,0,0,0|3,0,0]=4 292 B8R1.5 CC1=C(C=CN=C1)N PI-14242 [1,0,0,0,0,0|2,0,0]=3 293 B8R1.5 CC1=C(C=NC=C1)F PI-16771 [1,0,0,0,0,0|2,0,0]=3 294 B8R1.5 CC1=C(C=NC=C1)O PI-34258 [1,0,0,0,0,0|3,0,0]=4 295 B8R1.5 CC1=C(N=CC=C1)N PI-33812 [1,0,0,0,0,0|2,0,1]=4 296 B8R1.5 Cc1ccccc1F PI-34118 [1,0,0,0,0,0|3,0,0]=4 297 B8R1.5 Cc1ccncc1Br PI-23509 [1,0,0,0,0,0|2,1,0]=4 298 B8R1.5 Cc1ccncc1N PI-24336 [1,0,0,0,0,0|3,0,0]=4 299 B8R1.5 Cc1cnccc1Br PI-33360 [1,0,0,0,0,0|3,0,0]=4 300 B8R1.5 Cc1cnccc1O PI-38275 [1,0,0,0,0,0|3,0,0]=4 301 B8R1.5 Clc1ncncc1Cl PI-31681 [1,0,0,0,0,0|1,1,1]=4 302 B8R1.5 Fc1ccccc1Br PI-33063 [1,0,0,0,0,0|3,0,0]=4 303 B8R1.5 Fc1ccccc1F PI-11671 [1,0,0,0,0,0|3,0,0]=4 304 B8R1.5 Fc1cnccc1Br PI-10110 [1,0,0,0,0,0|2,0,0]=3 305 B8R1.5 Fc1ncccc1F PI-16764 [1,0,0,0,0,0|2,0,1]=4 306 B8R1.5 Ic1cccnc1N PI-36512 [1,0,0,0,0,0|1,1,1]=4 307 B8R1.5 Ic1cncnc1Cl PI-39068 [1,0,0,0,0,0|1,1,1]=4 308 B8R1.5 NC1=C(C=NC=C1)F PI-40470 [1,0,0,0,0,0|1,0,0]=2 309 B8R1.5 Nc1cccnc1N PI-10159 [1,0,0,0,0,0|2,0,1]=4 310 B8R1.5 Nc1ccncc1Br PI-16045 [1,0,0,0,0,0|1,1,0]=3 311 B8R1.5 Nc1cnccc1I PI-36511 [1,0,0,0,0,0|3,0,0]=4 312 B8R1.5 Nc1cnccc1N PI-16569 [1,0,0,0,0,0|2,0,0]=3 313 B8R1.5 Nc1cncnc1Cl PI-38851 [1,0,0,0,0,0|2,0,1]=4 314 B8R1.5 Nc1ncncc1N PI-21323 [1,0,0,0,0,0|1,0,1]=3 315 B8R1.5 O=c1[nH]cccc1C PI-16687 [1,0,0,0,0,0|3,0,0]=4 316 B8R1.5 Oc1cccnc1N PI-16260 [1,0,0,0,0,0|2,0,1]=4 317 B8R1.5 Oc1ccncc1Br PI-38971 [1,0,0,0,0,0|2,1,0]=4 318 B10R1.22 C1(=C(N=C(N=C1Cl)Cl)N)Cl PI-32360 [0,1,0,0,0,0|1,1,1]=4 319 B10R1.22 C1(=C(N=C(N=C1Cl)N)Cl)F PI-45160 [0,1,0,0,0,0|2,0,1]=4 320 B10R1.22 C1(=C(N=C(N=C1N)N)N)N PI-11509 [0,1,0,0,0,0|2,0,1]=4 321 B10R1.22 C1(=C(N=C(N=C1N)N)N)N PI-15318 [0,1,0,0,0,0|2,0,1]=4 322 B10R1.22 C1(=C(N=C(NC1=O)N)N)N PI-20695 [0,1,0,0,0,0|3,0,0]=4 323 B10R1.22 C1(=C(N=C(NC1=O)N)O)N PI-11510 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.22 C1(=C(N=C(NC1=O)N)O)N PI-12434 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.22 C1(=C(NC(=O)NC1=O)N)N PI-12445 [0,1,0,0,0,0|1,0,1]=3 326 B10R1.22 C1=C(C=C(C(=C1N)F)F)F PI-10628 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.22 CC1=C(C(=NC(=N1)C)N)Cl PI-30429 [0,1,0,0,0,0|1,1,1]=4 328 B10R1.22 CC1=C(C(=O)NC(=N1)N)Br PI-13774 [0,1,0,0,0,0|2,1,0]=4 329 B10R1.22 CC1=C(C(=O)NC(=O)N1)Cl PI-10281 [0,1,0,0,0,0|1,1,1]=4 330 B10R1.22 CC1=C(N=C(NC1=O)N)C PI-30571 [0,1,0,0,0,0|3,0,0]=4 331 B10R1.22 CC1=C(N=C(NC1=O)N)O PI-21309 [0,1,0,0,0,0|3,0,0]=4 332 B10R1.22 CC1=CC(=O)NC(=C1C)O PI-12151 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.22 CC1=NC(=C(C(=N1)Cl)F)Cl PI-45136 [0,1,0,0,0,0|2,0,1]=4 334 B10R1.22 CC1=NC(=C(C(=N1)Cl)F)N PI-45154 [0,1,0,0,0,0|1,0,1]=3 335 B10R1.22 CC1=NC(=C(C(=O)N1)Br)O PI-45156 [0,1,0,0,0,0|2,1,0]=4 336 B10R1.22 CC1=NC(=C(C(=O)N1)F)O PI-45144 [0,1,0,0,0,0|2,0,0]=3 337 B10R1.22 Clc1nc(Cl)c(c(n1)Cl)F PI-38187 [0,1,0,0,0,0|2,0,1]=4 338 B10R1.22 Nc1nc(N)c(c(=O)[nH]1)N PI-39055 [0,1,0,0,0,0|3,0,0]=4 339 B10R1.22 O=C1NC(=O)C(=O)C(=O)N1 PI-29642 [0,1,0,0,0,0|2,0,1]=4 340 B10R1.22 O=c1[nH]c(N)c(N)c(=O)[nH]1 PI-11352 [0,1,0,0,0,0|1,0,1]=3 341 B10R1.22 Sc1nc(N)c(c(n1)O)N PI-12790 [0,1,0,0,0,0|1,1,1]=4 342 B10R1.25 C#Cc1c[nH]c(=O)[nH]c1=O PI-38757 [0,1,0,0,0,0|2,0,1]=4 343 B10R1.25 C1=C(C(=NC(=N1)Cl)N)C#N PI-14068 [0,1,0,0,0,0|2,0,1]=4 344 B10R1.25 C1=C(C(=O)NC(=O)N1)C=O PI-16331 [0,1,0,0,0,0|2,0,1]=4 345 B10R1.25 C1=C(C(=O)NC(=O)N1)CO PI-31382 [0,1,0,0,0,0|2,0,1]=4 346 B10R1.25 C1=NC(=NC(=C1CN)N)C PI-40746 [0,1,0,0,0,0|2,0,1]=4 347 B10R1.25 CCC1=CNC(=O)NC1=O PI-40070 [0,1,0,0,0,0|2,0,1]=4 348 B10R1.25 COC1=CNC(=O)NC1=O PI-15321 [0,1,0,0,0,0|2,0,1]=4 349 B10R1.25 N#Cc1cnc(nc1N)C PI-14073 [0,1,0,0,0,0|2,0,1]=4 350 B10R1.25 Nc1nc(=O)[nH]cc1CO PI-30068 [0,1,0,0,0,0|1,0,2]=4 351 B10R1.30 C1=CC(=C(C=C1F)CN)F PI-31317 [0,1,0,0,0,0|3,0,0]=4 352 B10R1.30 C1=CC(=C(C=C1F)NN)F PI-10633 [0,1,0,0,0,0|3,0,0]=4 353 B10R1.30 C1=CC(=C(C=C1F)NN)F PI-21223 [0,1,0,0,0,0|3,0,0]=4 354 B10R1.30 NCc1cc(Cl)ccc1F PI-20075 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.118 C1=C(C(=CC(=C1Br)F)F)N PI-21617 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.118 C1=C(C(=CC(=C1F)Br)F)N PI-14403 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.118 C1=C(C(=CC(=C1F)F)F)N PI-16943 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.118 C1=C(C(=CC(=C1F)O)F)N PI-14079 [0,1,0,0,0,0|3,0,0]=4 359 B10R1.118 C1=C(C(=NC(=C1F)N)N)F PI-42366 [0,1,0,0,0,0|2,0,1]=4 360 B10R1.118 CC1=CC(=C(C=C1Br)N)F PI-43271 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.119 C1=CC(=C(C(=C1F)N)F)F PI-10629 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.119 CC1=NC=C(C(=C1Br)N)Br PI-13321 [0,1,0,0,0,0|2,1,0]=4 363 B10R1.176 C1=CC(=C(C=C1C#N)N)F PI-34256 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.176 C1=CC(=C(C=C1C=O)Cl)F PI-28406 [0,1,0,0,0,0|3,0,0]=4 365 B10R1.176 C1=CC(=C(C=C1C=O)I)F PI-26322 [0,1,0,0,0,0|3,0,0]=4 366 B10R1.176 CC1=C(C=CC(=C1)C=O)F PI-28124 [0,1,0,0,0,0|3,0,0]=4 367 B10R1.176 COC1=NC=C(C(=N1)Cl)F PI-45130 [0,1,0,0,0,0|1,0,2]=4 368 B10R1.176 Fc1ccc(C=O)cc1Br PI-10431 [0,1,0,0,0,0|3,0,0]=4 369 B10R1.176 O=C1NC(OC)=NC=C1F PI-12571 [0,1,0,0,0,0|1,0,1]=3 370 B10R1.176 O=Cc1ccc(F)c(F)c1 PI-10106 [0,1,0,0,0,0|3,0,0]=4 371 B8R1.18 C1(=C(N=C(N1)Br)Br)Br PI-11001 [0,0,0,0,1,0|2,1,0]=4 372 B8R1.18 C1(=C(N=C(N1)I)I)I PI-40526 [0,0,0,0,1,0|2,1,0]=4 373 B7R1.3 Brc1cccnc1 PI-11914 [2,0,0,0,0,0|1,1,0]=4 374 B7R1.3 Brc1ccncc1 PI-10390 [2,0,0,0,0,0|2,0,0]=4 375 B7R1.3 C1=C(C=NC=N1)Br PI-16276 [2,0,0,0,0,0|0,1,1]=4 376 B7R1.3 C1=C(C=NC=N1)Cl PI-21317 [2,0,0,0,0,0|0,1,1]=4 377 B7R1.3 C1=C(C=NC=N1)F PI-28750 [2,0,0,0,0,0|0,0,1]=3 378 B7R1.3 C1=CC(=CN=C1)I PI-11390 [2,0,0,0,0,0|1,1,0]=4 379 B7R1.3 C1=CC(=CN=C1)O PI-44714 [2,0,0,0,0,0|2,0,0]=4 380 B7R1.3 C1=CC(=CN=C1)[O-] PI-42109 [2,0,0,0,0,0|2,0,0]=4 381 B7R1.3 C1=CC(=O)NC=C1 PI-13304 [2,0,0,0,0,0|1,0,0]=3 382 B7R1.3 C1=CC(=O)NC=C1 PI-49120 [2,0,0,0,0,0|1,0,0]=3 383 B7R1.3 C1=CC(=O)OC=C1 PI-46989 [2,0,0,0,0,0|2,0,0]=4 384 B7R1.3 C1=CC(=S)NC=C1 PI-11854 [2,0,0,0,0,0|1,1,0]=4 385 B7R1.3 C1=CC=NC(=C1)I PI-32173 [2,0,0,0,0,0|2,0,0]=4 386 B7R1.3 C1=CN=C(N=C1)N PI-33106 [2,0,0,0,0,0|1,0,1]=4 387 B7R1.3 C1=CN=CC=C1Cl PI-16703 [2,0,0,0,0,0|2,0,0]=4 388 B7R1.3 C1=CN=CC=C1F PI-10293 [2,0,0,0,0,0|2,0,0]=4 389 B7R1.3 C1=CN=CC=C1F PI-28763 [2,0,0,0,0,0|2,0,0]=4 390 B7R1.3 C1=CN=CC=C1I PI-16167 [2,0,0,0,0,0|2,0,0]=4 391 B7R1.3 C1=CN=CN=C1Cl PI-47317 [2,0,0,0,0,0|1,0,1]=4 392 B7R1.3 C1=CN=CN=C1N PI-34789 [2,0,0,0,0,0|0,0,1]=3 393 B7R1.3 C1=CN=CNC1=O PI-21341 [2,0,0,0,0,0|1,0,0]=3 394 B7R1.3 C1=CN=CNC1=O PI-45002 [2,0,0,0,0,0|1,0,0]=3 395 B7R1.3 C1=CNC(=O)N=C1 PI-32626 [2,0,0,0,0,0|0,0,0]=2 396 B7R1.3 C1=CNC(=O)N=C1 PI-33107 [2,0,0,0,0,0|0,0,0]=2 397 B7R1.3 C1=CNC(=S)N=C1 PI-15316 [2,0,0,0,0,0|0,1,0]=3 398 B7R1.3 CC1=CC=CC=N1 PI-38534 [2,0,0,0,0,0|2,0,0]=4 399 B7R1.3 CC1=CN=CN=C1 PI-21343 [2,0,0,0,0,0|1,0,1]=4 400 B7R1.3 Cc1ncccn1 PI-35192 [2,0,0,0,0,0|1,0,1]=4 401 B7R1.3 Clc1cccnc1 PI-11921 [2,0,0,0,0,0|1,1,0]=4 402 B7R1.3 Clc1ccncn1 PI-38789 [2,0,0,0,0,0|1,0,1]=4 403 B7R1.3 Clc1ncccn1 PI-16275 [2,0,0,0,0,0|1,0,1]=4 404 B7R1.3 Fc1ccccn1 PI-11583 [2,0,0,0,0,0|2,0,0]=4 405 B7R1.3 Fc1cccnc1 PI-16759 [2,0,0,0,0,0|1,0,0]=3 406 B7R1.3 Nc1ccnnc1 PI-35933 [2,0,0,0,0,0|2,0,0]=4 407 B7R1.3 Nc1cncnc1 PI-38883 [2,0,0,0,0,0|1,0,1]=4 408 B7R1.3 Nc1ncncn1 PI-14137 [2,0,0,0,0,0|1,0,1]=4 409 B7R1.3 O=C1C=CC=NN1 PI-40006 [2,0,0,0,0,0|2,0,0]=4 410 B7R1.3 Oc1cncnc1 PI-36495 [2,0,0,0,0,0|1,0,1]=4 411 B9R1.1 C1=C(C=NC(=N1)C#N)F PI-42903 [1,1,0,0,0,0|1,0,1]=4 412 B9R1.1 C1=CC(=CC=C1C=O)F PI-33068 [1,1,0,0,0,0|2,0,0]=4 413 B9R1.1 C1=CC(=NC=C1F)C#N PI-40473 [1,1,0,0,0,0|2,0,0]=4 414 B9R1.1 C1=CC(=NC=C1O)C=O PI-40986 [1,1,0,0,0,0|2,0,0]=4 415 B9R1.1 COC1=NC=C(C=C1)F PI-16766 [1,1,0,0,0,0|1,0,1]=4 416 B9R1.1 O=CC1=NC=C(F)C=C1 PI-37201 [1,1,0,0,0,0|1,0,0]=3 417 B9R1.2 Brc1cc(C=O)ncc1 PI-38308 [1,1,0,0,0,0|2,0,0]=4 418 B9R1.2 C1=C(NC(=O)N=C1)NN PI-10282 [1,1,0,0,0,0|0,0,0]=2 419 B9R1.2 C1=CC(=CC(=C1)N)C=O PI-27126 [1,1,0,0,0,0|2,0,0]=4 420 B9R1.2 C1=CN=C(N=C1NN)Cl PI-10285 [1,1,0,0,0,0|1,0,1]=4 421 B9R1.2 COc1cc(N)ccn1 PI-26277 [1,1,0,0,0,0|1,0,1]=4 422 B9R1.2 Clc1cc(C=O)ncc1 PI-39303 [1,1,0,0,0,0|2,0,0]=4 423 B9R1.2 O=C1NC(SC)=NC=C1 PI-12294 [1,1,0,0,0,0|1,1,0]=4 424 B9R1.2 O=Cc1cccc(c1)N PI-11906 [1,1,0,0,0,0|2,0,0]=4 425 B9R1.3 Brc1c(N)ccnc1N PI-39323 [1,1,0,0,0,0|2,0,0]=4 426 B9R1.3 C1=CN=C(C(=C1N)I)Cl PI-50550 [1,1,0,0,0,0|2,0,0]=4 427 B9R1.3 NC1=C(N)C=CN=C1Cl PI-35295 [1,1,0,0,0,0|2,0,0]=4 428 B9R1.3 Nc1ccnc(Cl)c1Br PI-37155 [1,1,0,0,0,0|2,0,0]=4 429 B9R1.34 C1(=NC(=O)NC(=O)N1)N PI-17749 [1,1,0,0,0,0|1,0,1]=4 430 B9R1.34 C1=C(N=C(N=C1F)F)N PI-10277 [1,1,0,0,0,0|1,0,1]=4 431 B9R1.34 C1=C(NC(=O)N=C1N)Cl PI-16329 [1,1,0,0,0,0|1,0,0]=3 432 B9R1.34 C1=C(NC(=O)NC1=O)Cl PI-28524 [1,1,0,0,0,0|1,0,1]=4 433 B9R1.34 C1=C(NC(=O)NC1=O)I PI-16338 [1,1,0,0,0,0|1,0,1]=4 434 B9R1.34 C1=C(NC(=O)NC1=O)N PI-28876 [1,1,0,0,0,0|0,0,1]=3 435 B9R1.34 C1=C(NC(=S)NC1=O)N PI-11958 [1,1,0,0,0,0|0,1,1]=4 436 B9R1.34 CC1=CC(=NC(=O)N1)C PI-31788 [1,1,0,0,0,0|1,0,0]=3 437 B9R1.34 CC1=CC(=O)NC(=N1)C PI-21333 [1,1,0,0,0,0|2,0,0]=4 438 B9R1.34 CC1=NC(=CC(=O)N1)O PI-12843 [1,1,0,0,0,0|2,0,0]=4 439 B9R1.34 CC1=NC(=NC(=O)N1)N PI-30192 [1,1,0,0,0,0|2,0,0]=4 440 B9R1.34 Cc1cc(N)nc(C)n1 PI-33478 [1,1,0,0,0,0|1,0,1]=4 441 B9R1.34 Clc1cc(=O)[nH]c(n1)N PI-30090 [1,1,0,0,0,0|2,0,0]=4 442 B9R1.34 NC1=CC(Cl)=NC(N)=N1 PI-31075 [1,1,0,0,0,0|1,0,1]=4 443 B9R1.34 Nc1cc(C)nc(c1)C PI-38724 [1,1,0,0,0,0|2,0,0]=4 444 B9R1.34 Nc1cc(Cl)nc(Cl)n1 PI-10284 [1,1,0,0,0,0|1,0,1]=4 445 B9R1.34 Nc1cc(F)nc(n1)N PI-16306 [1,1,0,0,0,0|1,0,1]=4 446 B9R1.34 Nc1cc(N)nc(N)n1 PI-11507 [1,1,0,0,0,0|1,0,1]=4 447 B9R1.34 Nc1cc(N)nc(S)n1 PI-11953 [1,1,0,0,0,0|0,1,1]=4 448 B9R1.34 Nc1cc(O)nc(n1)N PI-15456 [1,1,0,0,0,0|1,0,1]=4 449 B9R1.15 C1=C(C(=NC=N1)N)C#N PI-14130 [1,1,0,0,0,0|1,0,1]=4 450 B9R1.15 C1=CC(=C(N=C1)CN)F PI-49343 [1,1,0,0,0,0|1,0,1]=4 451 B9R1.15 C1=CC=C(C(=C1)CN)F PI-31326 [1,1,0,0,0,0|2,0,0]=4 452 B9R1.15 C1=CC=C(C(=C1)NN)F PI-16908 [1,1,0,0,0,0|2,0,0]=4 453 B9R1.15 C1=CC=C(C(=C1)NN)F PI-31140 [1,1,0,0,0,0|2,0,0]=4 454 B9R1.15 C1=CN=CC(=C1N)C=O PI-14094 [1,1,0,0,0,0|2,0,0]=4 455 B9R1.15 CCc1ncncc1F PI-15252 [1,1,0,0,0,0|1,0,1]=4 456 B9R1.15 CNC1=CC=CC=C1F PI-28236 [1,1,0,0,0,0|2,0,0]=4 457 B9R1.15 N#Cc1ccncc1F PI-32520 [1,1,0,0,0,0|1,0,1]=4 458 B9R1.37 C1(=C(C(=O)NC1=O)Br)Br PI-42901 [0,1,0,0,1,0|1,1,0]=4 459 B9R1.37 C1(=C(C(=O)NC1=O)Cl)Cl PI-42638 [0,1,0,0,1,0|1,1,0]=4 460 B9R1.37 C1(=C(C(=O)OC1=O)F)F PI-49218 [0,1,0,0,1,0|2,0,0]=4 461 B11R1.32 CN1C(=C(C(=O)NC1=O)Br)N PI-21306 [0,2,0,0,0,0|0,1,1]=4 462 B11R1.32 CN1C(=C(C(=O)NC1=O)N)N PI-21334 [0,2,0,0,0,0|1,0,1]=4 463 B11R1.464 C1(=C(NC(=O)NC1=O)N)N=O PI-30699 [0,2,0,0,0,0|1,0,1]=4 464 B11R1.277 C1=C(C(=O)NC(=C1F)O)C#N PI-28062 [0,2,0,0,0,0|2,0,0]=4 465 B11R1.280 COC1=NC=C(C(=N1)NN)F PI-48692 [0,2,0,0,0,0|0,0,2]=4 466 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)F PI-16994 [0,2,0,0,0,0|2,0,0]=4 467 B11R1.21 C1=CC(=C(C=C1[N+](=O)[O-])N)F PI-16945 [0,2,0,0,0,0|2,0,0]=4 468 B11R1.192 CCOC1=NC=C(C(=O)N1)F PI-12570 [0,2,0,0,0,0|1,0,1]=4 469 B7R1.2 Brc1c[nH]c(n1)C PI-14475 [1,0,0,0,1,0|1,1,0]=4 470 B7R1.2 C1=C(NNC1=O)N PI-30770 [1,0,0,0,1,0|2,0,0]=4 471 B7R1.2 CC1=CC(=O)N=N1 PI-30060 [1,0,0,0,1,0|2,0,0]=4 472 B7R1.2 CC1=CNC(=O)N1 PI-31820 [1,0,0,0,1,0|1,0,1]=4 473 B7R1.2 CC1=NC=C(N1)I PI-45234 [1,0,0,0,1,0|1,1,0]=4 474 B7R1.2 Cc1[nH][nH]c(=O)c1 PI-10806 [1,0,0,0,1,0|2,0,0]=4 475 B7R1.2 Cc1[nH]cc(c1)C PI-10987 [1,0,0,0,1,0|2,0,0]=4 476 B7R1.2 Cc1[nH]cc(n1)C PI-31821 [1,0,0,0,1,0|2,0,0]=4 477 B7R1.2 NC1=NC=C(C)N1 PI-40524 [1,0,0,0,1,0|2,0,0]=4 478 B7R1.2 O=C1C=CC(=O)N1 PI-29681 [1,0,0,0,1,0|2,0,0]=4 479 B7R1.4 Cn1nccc1N PI-28081 [1,0,0,0,1,0|2,0,0]=4