0 B10R2.7 C1=CC2C(=NC=N2)C=C1 AB56425 [0,0,0,0,0,0|1,0,2]=3 1 B10R2.7 C1=CC2C=NN=C2C=C1 PB23156 [0,0,0,0,0,0|1,0,2]=3 2 B10R2.7 C1C=C2C(=CN=N2)C=N1 PB20648 [0,0,0,0,0,0|2,0,2]=4 3 B10R2.7 C1C=C2C(=NC=N2)C=N1 PB20239 [0,0,0,0,0,0|2,0,2]=4 4 B10R2.7 C1C=C2C=NN=C2C=N1 PB27509 [0,0,0,0,0,0|2,0,2]=4 5 B10R2.7 C1C=CN=C2C1=NC=C2 PB18523 [0,0,0,0,0,0|1,0,2]=3 6 B10R2.7 C1C=CN=C2C1=NN=C2 PB32568 [0,0,0,0,0,0|2,0,2]=4 7 B10R2.7 c1c2=CCN=c2cnn1 MB09338 [0,0,0,0,0,0|2,0,2]=4 8 B10R2.7 c1c2=CCN=c2ncn1 PB12495 [0,0,0,0,0,0|2,0,2]=4 9 B10R2.7 c1c2=NCC=c2ncn1 PB22262 [0,0,0,0,0,0|2,0,2]=4 10 B10R2.7 c1c2c(ncn1)NCC2 AB68426 [0,0,0,0,0,0|2,0,2]=4 11 B10R2.7 c1cc2c(cco2)nc1 PB26741 [0,0,0,0,0,0|2,0,0]=2 12 B10R2.7 c1cc2c(ccs2)nc1 PB25371 [0,0,0,0,0,0|2,0,0]=2 13 B10R2.7 c1cc2c(nc1)CNC2 PB30869 [0,0,0,0,0,0|3,0,1]=4 14 B10R2.7 c1cc2c(nc1)NCC2 PB34146 [0,0,0,0,0,0|1,0,2]=3 15 B10R2.7 c1cc2c(nc1)ncs2 MB10672 [0,0,0,0,0,0|2,0,1]=3 16 B10R2.7 c1cc2cnccn2c1 CB10529 [0,0,0,0,0,0|3,0,0]=3 17 B10R2.7 c1cc2nccn2nc1 AB42764 [0,0,0,0,0,0|2,0,1]=3 18 B10R2.7 c1ccc2c(c1)CNC2 MB01342 [0,0,0,0,0,0|2,0,1]=3 19 B10R2.7 c1ccc2c(c1)CNN2 AB31648 [0,0,0,0,0,0|1,0,1]=2 20 B10R2.7 c1ccn2c(c1)ccn2 AB48944 [0,0,0,0,0,0|1,0,1]=2 21 B10R2.7 c1ccn2c(c1)cnn2 MB00828 [0,0,0,0,0,0|2,0,1]=3 22 B10R2.7 c1ccn2c(c1)ncn2 AB15720 [0,0,0,0,0,0|2,0,1]=3 23 B10R2.7 c1ccn2cccc2c1 AB01491 [0,0,0,0,0,0|2,0,0]=2 24 B10R2.7 c1ccn2cncc2c1 AB14043 [0,0,0,0,0,0|3,0,0]=3 25 B10R2.7 c1cn2c(cn1)ncn2 AB53018 [0,0,0,0,0,0|3,0,1]=4 26 B10R2.7 c1cn2ccnc2cn1 AB23577 [0,0,0,0,0,0|2,0,1]=3 27 B10R2.7 c1cnc2=NCC=c2n1 PB29690 [0,0,0,0,0,0|2,0,2]=4 28 B10R2.7 c1cnc2c(n1)CCN2 AB75473 [0,0,0,0,0,0|2,0,2]=4 29 B10R2.7 c1cnc2ccnn2c1 PB20510 [0,0,0,0,0,0|2,0,1]=3 30 B10R2.7 c1cncc2=CCN=c21 PB12213 [0,0,0,0,0,0|1,0,2]=3 31 B10R2.7 c1cncc2=NCC=c21 PB21773 [0,0,0,0,0,0|1,0,2]=3 32 B10R2.7 c1cncc2c1CNC2 AB30511 [0,0,0,0,0,0|3,0,1]=4 33 B10R2.7 c1cncc2c1CNC2 PB24193 [0,0,0,0,0,0|3,0,1]=4 34 B10R2.7 c1cncc2c1ccs2 MB02036 [0,0,0,0,0,0|2,0,0]=2 35 B10R2.7 c1cncn2c1ncc2 AB55782 [0,0,0,0,0,0|2,0,1]=3 36 B10R2.7 c1cnnc2=NCC=c21 PB17814 [0,0,0,0,0,0|2,0,2]=4 37 B11R2.1 B1(c2ccccc2CO1)O AB08148 [0,1,0,0,0,0|2,0,1]=4 38 B11R2.1 C1=CC2C(=NC=C2Br)C=C1 PB10416 [0,1,0,0,0,0|0,0,2]=3 39 B11R2.1 C1=CC2C(=NC=C2O)C=C1 AB12538 [0,1,0,0,0,0|0,0,2]=3 40 B11R2.1 C1=CC2C(=NN=C2Br)C=C1 PB12113 [0,1,0,0,0,0|1,0,2]=4 41 B11R2.1 C1=CC2C(=NN=C2Cl)C=C1 AB02730 [0,1,0,0,0,0|1,0,2]=4 42 B11R2.1 C1=CC2C(=NN=C2I)C=C1 PB34085 [0,1,0,0,0,0|1,0,2]=4 43 B11R2.1 C1C=C2C(=C(C=N2)Br)C=N1 PB16059 [0,1,0,0,0,0|1,0,2]=4 44 B11R2.1 C1C=C2C(=C(C=N2)I)C=N1 PB12508 [0,1,0,0,0,0|1,0,2]=4 45 B11R2.1 C1C=C2C(=CN=C2C=N1)Br AB28409 [0,1,0,0,0,0|1,0,2]=4 46 B11R2.1 C1C=C2C(=CN=C2C=N1)Br PB20950 [0,1,0,0,0,0|1,0,2]=4 47 B11R2.1 C1C=CN=C2C1=NC=C2Br PB14830 [0,1,0,0,0,0|1,0,2]=4 48 B11R2.1 CC1=NN=C2=C1C=CC=C2 PB32213 [0,1,0,0,0,0|1,0,2]=4 49 B11R2.1 CC1=c2cccnc2=NC1 PB29501 [0,1,0,0,0,0|1,0,2]=4 50 B11R2.1 CN1CCc2c1cccc2 MB02030 [0,1,0,0,0,0|0,0,2]=3 51 B11R2.1 Cn1c2ccccc2cn1 PB18505 [0,1,0,0,0,0|1,0,0]=2 52 B11R2.1 Cn1ccc2c1CCN=C2 AB44183 [0,1,0,0,0,0|1,0,2]=4 53 B11R2.1 Cn1ccc2c1nccc2 AB51139 [0,1,0,0,0,0|1,0,0]=2 54 B11R2.1 c1cc2c(c(cs2)Br)nc1 PB28335 [0,1,0,0,0,0|2,0,0]=3 55 B11R2.1 c1cc2c(c(no2)N)nc1 PB21304 [0,1,0,0,0,0|3,0,0]=4 56 B11R2.1 c1cc2c(cnn2nc1)Br PB15135 [0,1,0,0,0,0|2,0,1]=4 57 B11R2.1 c1cc2c(nc1)C(=O)OC2 AB66596 [0,1,0,0,0,0|3,0,0]=4 58 B11R2.1 c1cc2c(nc1)CCC2=O PB12461 [0,1,0,0,0,0|2,0,1]=4 59 B11R2.1 c1cc2c(nc1)OCC2=O AB70107 [0,1,0,0,0,0|2,0,1]=4 60 B11R2.1 c1cc2ncc(n2nc1)Br PB23676 [0,1,0,0,0,0|2,0,1]=4 61 B11R2.1 c1ccc2c(c1)C(=O)CO2 AB02144 [0,1,0,0,0,0|1,0,1]=3 62 B11R2.1 c1ccc2c(c1)C(=O)N=N2 MB00163 [0,1,0,0,0,0|1,0,1]=3 63 B11R2.1 c1ccc2c(c1)C(CO2)N AB27757 [0,1,0,0,0,0|1,0,2]=4 64 B11R2.1 c1ccc2c(c1)C(N=N2)N MB69235 [0,1,0,0,0,0|1,0,2]=4 65 B11R2.1 c1ccc2c(c1)CCC2N AB00328 [0,1,0,0,0,0|1,0,2]=4 66 B11R2.1 c1ccc2c(c1)CCN2N MB03088 [0,1,0,0,0,0|0,0,2]=3 67 B11R2.1 c1ccc2c(c1)CC[C@@H]2N AB04896 [0,1,0,0,0,0|1,0,2]=4 68 B11R2.1 c1ccc2c(c1)CC[C@H]2N AB04893 [0,1,0,0,0,0|1,0,2]=4 69 B11R2.1 c1ccc2c(c1)CNC2=O AB13096 [0,1,0,0,0,0|2,0,0]=3 70 B11R2.1 c1ccc2c(c1)c(co2)Br MB01644 [0,1,0,0,0,0|1,0,0]=2 71 B11R2.1 c1ccc2c(c1)c(no2)Cl MB02698 [0,1,0,0,0,0|2,0,0]=3 72 B11R2.1 c1ccc2c(c1)cnn2N MB08196 [0,1,0,0,0,0|1,0,0]=2 73 B11R2.1 c1ccn2c(c1)c(cn2)Br AB26764 [0,1,0,0,0,0|1,0,1]=3 74 B11R2.1 c1ccn2c(c1)c(cn2)N AB28918 [0,1,0,0,0,0|1,0,1]=3 75 B11R2.1 c1ccn2c(c1)ncc2Br PB14077 [0,1,0,0,0,0|1,0,1]=3 76 B11R2.1 c1ccn2c(c1)ncc2I AB28899 [0,1,0,0,0,0|1,0,1]=3 77 B11R2.1 c1ccn2c(c1)ncc2N AB26722 [0,1,0,0,0,0|1,0,1]=3 78 B11R2.1 c1ccn2c(c1)nnc2Cl PB13083 [0,1,0,0,0,0|2,0,1]=4 79 B11R2.1 c1ccn2c(c1)nnc2N AB13807 [0,1,0,0,0,0|2,0,1]=4 80 B11R2.1 c1ccn2c(c1)nnc2S MB02937 [0,1,0,0,0,0|2,0,1]=4 81 B11R2.1 c1cn2c(cn1)ncc2Br PB32412 [0,1,0,0,0,0|2,0,1]=4 82 B11R2.1 c1cnc2c(cnn2c1)Br PB22252 [0,1,0,0,0,0|2,0,1]=4 83 B11R2.1 c1cnc2c(cnn2c1)N PB27500 [0,1,0,0,0,0|2,0,1]=4 84 B11R2.1 c1cnc2c(cnn2c1)N PB37704 [0,1,0,0,0,0|2,0,1]=4 85 B11R2.1 c1cnc2ncc(n2c1)Br AB23077 [0,1,0,0,0,0|2,0,1]=4 86 B11R2.1 c1cncc2c1C(=O)NC2 AB66595 [0,1,0,0,0,0|3,0,0]=4 87 B11R2.1 c1cncc2c1CNC2=O PB33122 [0,1,0,0,0,0|3,0,0]=4 88 B11R2.1 c1cncc2c1cnn2N MB12332 [0,1,0,0,0,0|2,0,0]=3 89 B11R2.10 C1=CC2C(=NC(=N2)I)C=C1 AB18571 [0,1,0,0,0,0|1,0,2]=4 90 B11R2.10 C1=CC2C=C(N=C2C=C1)I MB08792 [0,1,0,0,0,0|0,0,2]=3 91 B11R2.10 C1C=C2C=C(N=C2C=N1)Br AB28161 [0,1,0,0,0,0|1,0,2]=4 92 B11R2.10 C1C=C2C=C(N=C2C=N1)Cl MB09720 [0,1,0,0,0,0|1,0,2]=4 93 B11R2.10 CC1=NC2=C(=C1)C=CC=N2 PB17562 [0,1,0,0,0,0|1,0,2]=4 94 B11R2.10 CC1=NC2=C(=C1)C=CN=C2 PB23513 [0,1,0,0,0,0|1,0,2]=4 95 B11R2.10 CC1=NC2=C(=C1)C=NC=C2 PB34737 [0,1,0,0,0,0|1,0,2]=4 96 B11R2.10 CC1=NC2=C(=N1)C=CC=C2 AB00442 [0,1,0,0,0,0|1,0,2]=4 97 B11R2.10 Cc1cc2ncccn2n1 AB44285 [0,1,0,0,0,0|2,0,1]=4 98 B11R2.10 Cc1cn2ccccc2n1 MB02386 [0,1,0,0,0,0|1,0,1]=3 99 B11R2.10 Cc1nc2c(o1)cccn2 AB21689 [0,1,0,0,0,0|2,0,1]=4 100 B11R2.10 Cn1cc2ccccc2n1 PB15684 [0,1,0,0,0,0|1,0,1]=3 101 B11R2.10 c1c2c(ncn1)NC(=O)C2 PB13160 [0,1,0,0,0,0|2,0,1]=4 102 B11R2.10 c1cc2=NC(=O)N=c2nc1 AB06227 [0,1,0,0,0,0|2,0,1]=4 103 B11R2.10 c1cc2c(nc1)CC(=O)N2 PB29192 [0,1,0,0,0,0|1,0,1]=3 104 B11R2.10 c1cc2c(nc1)NC(=O)C2 PB29419 [0,1,0,0,0,0|1,0,1]=3 105 B11R2.10 c1cc2c(nc1)nc(o2)Cl AB63474 [0,1,0,0,0,0|2,0,1]=4 106 B11R2.10 c1cc2c(nc1)nc(o2)N AB63475 [0,1,0,0,0,0|2,0,1]=4 107 B11R2.10 c1cc2c(nc1)nc(s2)S AB04817 [0,1,0,0,0,0|2,0,1]=4 108 B11R2.10 c1cc2c(nc1)oc(n2)S AB65959 [0,1,0,0,0,0|2,0,1]=4 109 B11R2.10 c1cc2c(nc1)sc(n2)Br MB05754 [0,1,0,0,0,0|2,0,1]=4 110 B11R2.10 c1cc2c(nc1)sc(n2)Cl AB69999 [0,1,0,0,0,0|2,0,1]=4 111 B11R2.10 c1cc2c(nc1)sc(n2)N AB04928 [0,1,0,0,0,0|2,0,1]=4 112 B11R2.10 c1cc2c(nc1)sc(n2)S AB04404 [0,1,0,0,0,0|2,0,1]=4 113 B11R2.10 c1ccc2c(c1)CC(=O)N2 AB00523 [0,1,0,0,0,0|0,0,1]=2 114 B11R2.10 c1ccc2c(c1)CC(C2)Br MB05045 [0,1,0,0,0,0|1,0,2]=4 115 B11R2.10 c1ccc2c(c1)CC(C2)N AB03106 [0,1,0,0,0,0|1,0,2]=4 116 B11R2.10 c1ccc2c(c1)CN(C2)N MB09229 [0,1,0,0,0,0|2,0,1]=4 117 B11R2.10 c1ccc2c(c1)cc(o2)Br MB02457 [0,1,0,0,0,0|1,0,0]=2 118 B11R2.10 c1ccc2c(c1)nc(o2)Cl AB00524 [0,1,0,0,0,0|1,0,1]=3 119 B11R2.10 c1ccc2c(c1)nc(s2)Cl AB00527 [0,1,0,0,0,0|1,0,1]=3 120 B11R2.10 c1ccn2c(c1)cc(n2)Cl AB28897 [0,1,0,0,0,0|1,0,1]=3 121 B11R2.10 c1ccn2c(c1)nc(n2)Cl AB69404 [0,1,0,0,0,0|2,0,1]=4 122 B11R2.10 c1ccn2c(c1)nc(n2)N AB64641 [0,1,0,0,0,0|2,0,1]=4 123 B11R2.10 c1cn2cc(nc2cn1)Br AB61156 [0,1,0,0,0,0|2,0,1]=4 124 B11R2.10 c1cn2cc(nc2cn1)N AB76352 [0,1,0,0,0,0|2,0,1]=4 125 B11R2.10 c1cncc2=NC(=O)N=c21 AB11607 [0,1,0,0,0,0|2,0,1]=4 126 B11R2.10 c1cncc2c1CC(=O)N2 PB19637 [0,1,0,0,0,0|1,0,1]=3 127 B11R2.10 c1cncc2c1NC(=O)C2 PB17659 [0,1,0,0,0,0|1,0,1]=3 128 B11R2.10 c1cncc2c1nc(o2)S AB65956 [0,1,0,0,0,0|2,0,1]=4 129 B11R2.10 c1cncc2c1nc(s2)N PB34487 [0,1,0,0,0,0|2,0,1]=4 130 B11R2.10 c1cncc2c1nc(s2)S AB65962 [0,1,0,0,0,0|2,0,1]=4 131 B11R2.10 c1cncc2c1oc(n2)S AB65952 [0,1,0,0,0,0|2,0,1]=4 132 B11R2.10 c1cncc2c1sc(n2)N MB05751 [0,1,0,0,0,0|2,0,1]=4 133 B11R2.10 c1cncc2c1sc(n2)S AB65960 [0,1,0,0,0,0|2,0,1]=4 134 B11R2.36 C1=C2C=NC(=O)N=C2N=C1 MB05396 [0,1,0,0,0,0|2,0,1]=4 135 B11R2.36 C1C=C(C=C2C1=NC=C2)Br AB00482 [0,1,0,0,0,0|0,0,2]=3 136 B11R2.36 C1C=C(C=C2C1=NC=C2)Cl AB00485 [0,1,0,0,0,0|0,0,2]=3 137 B11R2.36 C1C=C(C=C2C1=NC=C2)F AB00483 [0,1,0,0,0,0|0,0,2]=3 138 B11R2.36 C1C=C(C=C2C1=NC=C2)I AB04939 [0,1,0,0,0,0|0,0,2]=3 139 B11R2.36 C1C=C(C=C2C1=NC=C2)O AB00494 [0,1,0,0,0,0|0,0,2]=3 140 B11R2.36 C1C=C(C=C2C1=NC=N2)Cl MB04649 [0,1,0,0,0,0|1,0,2]=4 141 B11R2.36 C1C=C(C=C2C1=NC=N2)F AB07100 [0,1,0,0,0,0|1,0,2]=4 142 B11R2.36 C1C=C(C=C2C1=NC=N2)I AB25990 [0,1,0,0,0,0|1,0,2]=4 143 B11R2.36 C1C=C(C=C2C1=NN=C2)Br PB14191 [0,1,0,0,0,0|1,0,2]=4 144 B11R2.36 C1C=C(C=C2C1=NN=C2)Cl PB25912 [0,1,0,0,0,0|1,0,2]=4 145 B11R2.36 C1C=C(C=C2C1=NN=C2)F PB29333 [0,1,0,0,0,0|1,0,2]=4 146 B11R2.36 C1C=C(C=C2C1=NN=C2)I PB10471 [0,1,0,0,0,0|1,0,2]=4 147 B11R2.36 C1C=C(C=C2C1=NN=C2)N AB01685 [0,1,0,0,0,0|1,0,2]=4 148 B11R2.36 C1C=C(C=C2C1=NN=C2)O PB14272 [0,1,0,0,0,0|1,0,2]=4 149 B11R2.36 C1C=C2C(=CC=N2)N=C1Br PB22217 [0,1,0,0,0,0|1,0,2]=4 150 B11R2.36 C1C=C2C(=CC=N2)N=C1Cl PB26323 [0,1,0,0,0,0|1,0,2]=4 151 B11R2.36 C1C=C2C(=CC=N2)N=C1N AB52502 [0,1,0,0,0,0|1,0,2]=4 152 B11R2.36 C1C=C2C(=CC=N2)N=C1O AB63944 [0,1,0,0,0,0|1,0,2]=4 153 B11R2.36 C1C=C2C=CN=C2C=C1Br PB27487 [0,1,0,0,0,0|0,0,2]=3 154 B11R2.36 C1C=C2C=CN=C2C=C1F PB12993 [0,1,0,0,0,0|0,0,2]=3 155 B11R2.36 C1C=C2C=CN=C2C=C1O AB04037 [0,1,0,0,0,0|0,0,2]=3 156 B11R2.36 C1C=C2C=CN=C2N=C1Br PB21932 [0,1,0,0,0,0|1,0,2]=4 157 B11R2.36 C1C=C2C=CN=C2N=C1Cl PB21926 [0,1,0,0,0,0|1,0,2]=4 158 B11R2.36 C1C=C2C=CN=C2N=C1F PB21935 [0,1,0,0,0,0|1,0,2]=4 159 B11R2.36 C1C=C2C=CN=C2N=C1I AB26057 [0,1,0,0,0,0|1,0,2]=4 160 B11R2.36 C1C=C2C=CN=C2N=C1N AB44400 [0,1,0,0,0,0|1,0,2]=4 161 B11R2.36 C1C=C2C=CN=C2N=C1O AB44403 [0,1,0,0,0,0|1,0,2]=4 162 B11R2.36 C1NC=C2N1C=C(C=C2)Br AB41249 [0,1,0,0,0,0|3,0,0]=4 163 B11R2.36 CC1=CC2C=CN=C2C=C1 PB24528 [0,1,0,0,0,0|0,0,2]=3 164 B11R2.36 CC1=CC2C=NN=C2C=C1 MB01911 [0,1,0,0,0,0|1,0,2]=4 165 B11R2.36 CC1=CN=C2C=CN=C2C1 PB12030 [0,1,0,0,0,0|1,0,2]=4 166 B11R2.36 CC1=NC=C2C=CN=C2C1 PB19033 [0,1,0,0,0,0|1,0,2]=4 167 B11R2.36 Cc1cc2c(nc1)NCC2 AB26240 [0,1,0,0,0,0|1,0,2]=4 168 B11R2.36 Cc1cc2nccn2cn1 AB55008 [0,1,0,0,0,0|2,0,1]=4 169 B11R2.36 Cc1ccc2c(c1)CNC2 AB49687 [0,1,0,0,0,0|2,0,1]=4 170 B11R2.36 Cc1ccc2c(c1)N=CC2 PB25888 [0,1,0,0,0,0|0,0,2]=3 171 B11R2.36 Cc1ccc2c(c1)N=NC2 MB04939 [0,1,0,0,0,0|1,0,2]=4 172 B11R2.36 Cc1ccc2c(c1)NCC2 MB04575 [0,1,0,0,0,0|0,0,2]=3 173 B11R2.36 Cc1ccc2c(c1)cco2 MB00739 [0,1,0,0,0,0|1,0,0]=2 174 B11R2.36 Cc1ccc2c(c1)scn2 AB09070 [0,1,0,0,0,0|1,0,1]=3 175 B11R2.36 Cc1ccc2c(n1)N=CC2 AB26035 [0,1,0,0,0,0|1,0,2]=4 176 B11R2.36 Cc1ccn2c(n1)ccn2 AB63891 [0,1,0,0,0,0|2,0,1]=4 177 B11R2.36 Cc1ccn2ccnc2n1 AB43723 [0,1,0,0,0,0|2,0,1]=4 178 B11R2.36 Cc1cnc2ccnn2c1 AB62554 [0,1,0,0,0,0|2,0,1]=4 179 B11R2.36 Cc1cnc2nccn2c1 AB55753 [0,1,0,0,0,0|2,0,1]=4 180 B11R2.36 c1c(cnc2=CCN=c21)Cl PB17747 [0,1,0,0,0,0|1,0,2]=4 181 B11R2.36 c1c(cnc2=CCN=c21)F PB15121 [0,1,0,0,0,0|1,0,2]=4 182 B11R2.36 c1c(cnc2=CCN=c21)I PB10729 [0,1,0,0,0,0|1,0,2]=4 183 B11R2.36 c1c(cnc2=CCN=c21)N PB22282 [0,1,0,0,0,0|1,0,2]=4 184 B11R2.36 c1c(cnc2=NCC=c21)Br PB15851 [0,1,0,0,0,0|1,0,2]=4 185 B11R2.36 c1c(cnc2=NCC=c21)Cl PB24925 [0,1,0,0,0,0|1,0,2]=4 186 B11R2.36 c1c(cnc2=NCC=c21)F PB12380 [0,1,0,0,0,0|1,0,2]=4 187 B11R2.36 c1c(cnc2=NCC=c21)I PB32449 [0,1,0,0,0,0|1,0,2]=4 188 B11R2.36 c1c(cnc2=NCC=c21)N PB34142 [0,1,0,0,0,0|1,0,2]=4 189 B11R2.36 c1c(cnc2=NCC=c21)O PB25038 [0,1,0,0,0,0|1,0,2]=4 190 B11R2.36 c1c(cnc2c1CCN2)Br PB26222 [0,1,0,0,0,0|1,0,2]=4 191 B11R2.36 c1c(cnc2c1NCC2)Br AB73731 [0,1,0,0,0,0|1,0,2]=4 192 B11R2.36 c1c(cnc2c1nco2)Br AB40951 [0,1,0,0,0,0|2,0,1]=4 193 B11R2.36 c1c(cnc2c1nco2)Cl AB41016 [0,1,0,0,0,0|2,0,1]=4 194 B11R2.36 c1c(cnc2c1ncs2)Br AB40947 [0,1,0,0,0,0|2,0,1]=4 195 B11R2.36 c1c(cnc2c1ncs2)Cl AB41013 [0,1,0,0,0,0|2,0,1]=4 196 B11R2.36 c1c2=CCN=c2cnc1Br PB17911 [0,1,0,0,0,0|1,0,2]=4 197 B11R2.36 c1c2=CCN=c2cnc1Cl PB34486 [0,1,0,0,0,0|1,0,2]=4 198 B11R2.36 c1c2=CCN=c2cnc1N PB12201 [0,1,0,0,0,0|1,0,2]=4 199 B11R2.36 c1c2=NCC=c2cnc1Br PB10582 [0,1,0,0,0,0|1,0,2]=4 200 B11R2.36 c1c2=NCC=c2cnc1Cl PB22198 [0,1,0,0,0,0|1,0,2]=4 201 B11R2.36 c1c2c(cnc1Br)NCC2 AB76736 [0,1,0,0,0,0|1,0,2]=4 202 B11R2.36 c1c2c(cnc1Cl)NCC2 AB70159 [0,1,0,0,0,0|1,0,2]=4 203 B11R2.36 c1cc(cc2c1cco2)Br PB12534 [0,1,0,0,0,0|1,0,0]=2 204 B11R2.36 c1cc(cc2c1cco2)N MB09331 [0,1,0,0,0,0|1,0,0]=2 205 B11R2.36 c1cc(cc2c1cco2)O MB06436 [0,1,0,0,0,0|1,0,0]=2 206 B11R2.36 c1cc(cc2c1ccs2)Br MB09702 [0,1,0,0,0,0|1,0,0]=2 207 B11R2.36 c1cc(cn2c1ccn2)Br PB33438 [0,1,0,0,0,0|1,0,1]=3 208 B11R2.36 c1cc(nc2c1NCC2)Br AB73732 [0,1,0,0,0,0|1,0,2]=4 209 B11R2.36 c1cc(nc2c1NCC2)Cl AB71540 [0,1,0,0,0,0|1,0,2]=4 210 B11R2.36 c1cc(nc2c1NCC2)F AB73742 [0,1,0,0,0,0|1,0,2]=4 211 B11R2.36 c1cc(nc2c1nco2)Br AB77477 [0,1,0,0,0,0|2,0,1]=4 212 B11R2.36 c1cc(nc2c1nco2)Cl AB77475 [0,1,0,0,0,0|2,0,1]=4 213 B11R2.36 c1cc(nc2c1scc2)Cl PB25245 [0,1,0,0,0,0|2,0,0]=3 214 B11R2.36 c1cc(nn2c1ncc2)Br PB16486 [0,1,0,0,0,0|2,0,1]=4 215 B11R2.36 c1cc(nn2c1ncc2)Cl PB24991 [0,1,0,0,0,0|2,0,1]=4 216 B11R2.36 c1cc2c(cc1Br)CCC2 MB07871 [0,1,0,0,0,0|1,0,2]=4 217 B11R2.36 c1cc2c(cc1Br)CNC2 PB29483 [0,1,0,0,0,0|2,0,1]=4 218 B11R2.36 c1cc2c(cc1Br)NCC2 MB04573 [0,1,0,0,0,0|0,0,2]=3 219 B11R2.36 c1cc2c(cc1Br)OCC2 MB06567 [0,1,0,0,0,0|1,0,2]=4 220 B11R2.36 c1cc2c(cc1Br)cno2 AB26012 [0,1,0,0,0,0|2,0,0]=3 221 B11R2.36 c1cc2c(cc1Br)con2 MB19408 [0,1,0,0,0,0|1,0,1]=3 222 B11R2.36 c1cc2c(cc1Br)nco2 AB13423 [0,1,0,0,0,0|1,0,1]=3 223 B11R2.36 c1cc2c(cc1Br)ncs2 AB12828 [0,1,0,0,0,0|1,0,1]=3 224 B11R2.36 c1cc2c(cc1Br)ocn2 AB13141 [0,1,0,0,0,0|1,0,1]=3 225 B11R2.36 c1cc2c(cc1Br)scn2 AB19945 [0,1,0,0,0,0|1,0,1]=3 226 B11R2.36 c1cc2c(cc1Cl)CNC2 MB09657 [0,1,0,0,0,0|2,0,1]=4 227 B11R2.36 c1cc2c(cc1Cl)cns2 MB19427 [0,1,0,0,0,0|2,0,0]=3 228 B11R2.36 c1cc2c(cc1Cl)con2 MB03067 [0,1,0,0,0,0|1,0,1]=3 229 B11R2.36 c1cc2c(cc1Cl)ncs2 AB04988 [0,1,0,0,0,0|1,0,1]=3 230 B11R2.36 c1cc2c(cc1Cl)ocn2 AB49155 [0,1,0,0,0,0|1,0,1]=3 231 B11R2.36 c1cc2c(cc1Cl)scn2 AB09074 [0,1,0,0,0,0|1,0,1]=3 232 B11R2.36 c1cc2c(cc1F)CCO2 AB43939 [0,1,0,0,0,0|1,0,2]=4 233 B11R2.36 c1cc2c(cc1F)CNC2 MB03627 [0,1,0,0,0,0|2,0,1]=4 234 B11R2.36 c1cc2c(cc1F)NCC2 AB01334 [0,1,0,0,0,0|0,0,2]=3 235 B11R2.36 c1cc2c(cc1F)nco2 AB45629 [0,1,0,0,0,0|1,0,1]=3 236 B11R2.36 c1cc2c(cc1F)ncs2 AB26031 [0,1,0,0,0,0|1,0,1]=3 237 B11R2.36 c1cc2c(cc1F)scn2 AB26019 [0,1,0,0,0,0|1,0,1]=3 238 B11R2.36 c1cc2c(cc1I)CNC2 MB11263 [0,1,0,0,0,0|2,0,1]=4 239 B11R2.36 c1cc2c(cc1I)ncs2 AB26029 [0,1,0,0,0,0|1,0,1]=3 240 B11R2.36 c1cc2c(cc1I)scn2 AB26022 [0,1,0,0,0,0|1,0,1]=3 241 B11R2.36 c1cc2c(cc1N)CCC2 CB10015 [0,1,0,0,0,0|1,0,2]=4 242 B11R2.36 c1cc2c(cc1N)CCO2 AB15578 [0,1,0,0,0,0|1,0,2]=4 243 B11R2.36 c1cc2c(cc1N)CNC2 AB50244 [0,1,0,0,0,0|2,0,1]=4 244 B11R2.36 c1cc2c(cc1N)NCC2 MB00375 [0,1,0,0,0,0|0,0,2]=3 245 B11R2.36 c1cc2c(cc1N)cno2 AB70278 [0,1,0,0,0,0|2,0,0]=3 246 B11R2.36 c1cc2c(cc1N)nco2 AB21693 [0,1,0,0,0,0|1,0,1]=3 247 B11R2.36 c1cc2c(cc1N)ncs2 AB19860 [0,1,0,0,0,0|1,0,1]=3 248 B11R2.36 c1cc2c(cc1O)cno2 AB70280 [0,1,0,0,0,0|2,0,0]=3 249 B11R2.36 c1cc2c(cco2)cc1Br MB02701 [0,1,0,0,0,0|1,0,0]=2 250 B11R2.36 c1cc2c(cco2)cc1Cl AB62579 [0,1,0,0,0,0|1,0,0]=2 251 B11R2.36 c1cc2c(cco2)cc1F AB43937 [0,1,0,0,0,0|1,0,0]=2 252 B11R2.36 c1cc2c(cco2)cc1N AB20798 [0,1,0,0,0,0|1,0,0]=2 253 B11R2.36 c1cc2c(cco2)cc1O MB08821 [0,1,0,0,0,0|1,0,0]=2 254 B11R2.36 c1cc2c(ccs2)cc1Br PB18576 [0,1,0,0,0,0|1,0,0]=2 255 B11R2.36 c1cc2cnoc2cc1Br AB25994 [0,1,0,0,0,0|2,0,0]=3 256 B11R2.36 c1cc2cnoc2cc1Cl AB25992 [0,1,0,0,0,0|2,0,0]=3 257 B11R2.36 c1cc2cnoc2cc1N AB26008 [0,1,0,0,0,0|2,0,0]=3 258 B11R2.36 c1cc2cnsc2cc1Br MB19419 [0,1,0,0,0,0|2,0,0]=3 259 B11R2.36 c1cc2cnsc2cc1Cl MB19415 [0,1,0,0,0,0|2,0,0]=3 260 B11R2.36 c1cc2conc2cc1Br MB19398 [0,1,0,0,0,0|1,0,1]=3 261 B11R2.36 c1cc2conc2cc1Cl MB19396 [0,1,0,0,0,0|1,0,1]=3 262 B11R2.36 c1cc2nccn2cc1Br PB20174 [0,1,0,0,0,0|1,0,1]=3 263 B11R2.36 c1cc2nccn2cc1Cl AB21919 [0,1,0,0,0,0|1,0,1]=3 264 B11R2.36 c1cc2nccn2cc1N PB12399 [0,1,0,0,0,0|1,0,1]=3 265 B11R2.36 c1cc2nccn2cc1O AB28902 [0,1,0,0,0,0|1,0,1]=3 266 B11R2.36 c1cc2nccn2nc1N AB61144 [0,1,0,0,0,0|2,0,1]=4 267 B11R2.36 c1cc2ncnn2cc1Br PB12540 [0,1,0,0,0,0|2,0,1]=4 268 B11R2.36 c1cc2nncn2cc1Br PB10571 [0,1,0,0,0,0|2,0,1]=4 269 B11R2.36 c1cn2c(cc1Br)cnn2 MB09890 [0,1,0,0,0,0|2,0,1]=4 270 B11R2.36 c1cn2c(cc1Br)ncn2 PB32891 [0,1,0,0,0,0|2,0,1]=4 271 B11R2.36 c1cn2cc(cnc2n1)Br PB14681 [0,1,0,0,0,0|2,0,1]=4 272 B11R2.36 c1cn2cc(cnc2n1)Cl AB56410 [0,1,0,0,0,0|2,0,1]=4 273 B11R2.36 c1cn2cc(cnc2n1)N AB56414 [0,1,0,0,0,0|2,0,1]=4 274 B11R2.36 c1cn2cc(ncc2n1)Br PB23663 [0,1,0,0,0,0|2,0,1]=4 275 B11R2.36 c1cn2cc(ncc2n1)Cl AB54752 [0,1,0,0,0,0|2,0,1]=4 276 B11R2.36 c1cn2ccnc2cc1Br PB30948 [0,1,0,0,0,0|1,0,1]=3 277 B11R2.36 c1cn2ccnc2cc1Cl PB34290 [0,1,0,0,0,0|1,0,1]=3 278 B11R2.36 c1cn2ccnc2cc1N PB20545 [0,1,0,0,0,0|1,0,1]=3 279 B11R2.36 c1cn2ccnc2nc1Cl AB61250 [0,1,0,0,0,0|2,0,1]=4 280 B11R2.36 c1cn2cnnc2cc1Br PB16252 [0,1,0,0,0,0|2,0,1]=4 281 B11R2.36 c1cnn2c1[nH]c(=O)cc2 PB28532 [0,1,0,0,0,0|2,0,1]=4 282 B11R2.36 c1cnn2c1cc(cc2)Br PB11898 [0,1,0,0,0,0|1,0,1]=3 283 B11R2.36 c1cnn2c1cc(cc2)O AB44250 [0,1,0,0,0,0|1,0,1]=3 284 B11R2.36 c1cnn2c1nc(cc2)Cl PB23376 [0,1,0,0,0,0|2,0,1]=4 285 B11R2.36 c1cnn2c1nc(cc2)I PB28294 [0,1,0,0,0,0|2,0,1]=4 286 B11R2.36 c1cnn2c1nc(cc2)O AB16973 [0,1,0,0,0,0|2,0,1]=4 287 B11R2.36 c1cnn2c1ncc(c2)Br PB23680 [0,1,0,0,0,0|2,0,1]=4 288 B11R2.36 c1coc2c1cc(cn2)N PB28491 [0,1,0,0,0,0|2,0,0]=3 289 B11R2.36 c1csc2c1cc(cn2)N PB15184 [0,1,0,0,0,0|2,0,0]=3 290 B11R2.36 c1csc2c1cc(nc2)Cl PB13799 [0,1,0,0,0,0|2,0,0]=3 291 B11R2.36 c1csc2c1cnc(n2)Cl PB11077 [0,1,0,0,0,0|3,0,0]=4 292 B11R2.36 c1csc2c1nc(nc2)Cl PB17979 [0,1,0,0,0,0|3,0,0]=4 293 B11R2.106 C1=C2C(=CN=N2)C(=O)N=C1 MB69220 [0,1,0,0,0,0|2,0,1]=4 294 B11R2.106 C1=C2C(=NC=NC2=O)N=C1 PB29165 [0,1,0,0,0,0|2,0,1]=4 295 B11R2.106 C1=CN=C2C1=NC=NC2=O PB28030 [0,1,0,0,0,0|2,0,1]=4 296 B11R2.106 C1=COC2C1=CC=NC2=O PB32246 [0,1,0,0,0,0|2,0,1]=4 297 B11R2.106 C1C=CC(=C2C1=NC=C2)Br PB10160 [0,1,0,0,0,0|0,0,2]=3 298 B11R2.106 C1C=CC(=C2C1=NC=C2)Cl AB00468 [0,1,0,0,0,0|0,0,2]=3 299 B11R2.106 C1C=CC(=C2C1=NC=C2)F PB20892 [0,1,0,0,0,0|0,0,2]=3 300 B11R2.106 C1C=CC(=C2C1=NC=C2)O AB00472 [0,1,0,0,0,0|0,0,2]=3 301 B11R2.106 C1C=CC(=C2C1=NN=C2)Br PB12348 [0,1,0,0,0,0|1,0,2]=4 302 B11R2.106 C1C=CC(=C2C1=NN=C2)Cl PB29043 [0,1,0,0,0,0|1,0,2]=4 303 B11R2.106 C1C=CC(=C2C1=NN=C2)F PB12462 [0,1,0,0,0,0|1,0,2]=4 304 B11R2.106 C1C=CC(=C2C1=NN=C2)I PB27826 [0,1,0,0,0,0|1,0,2]=4 305 B11R2.106 C1C=CC(=C2C1=NN=C2)O PB22002 [0,1,0,0,0,0|1,0,2]=4 306 B11R2.106 C1C=C[N+](=C2C1=NC=C2)[O-] PB26857 [0,1,0,0,0,0|1,0,2]=4 307 B11R2.106 CC1=C2C(=CC=N2)C=CC1 AB00504 [0,1,0,0,0,0|0,0,2]=3 308 B11R2.106 CC1=C2C(=CC=N2)N=CC1 PB26696 [0,1,0,0,0,0|1,0,2]=4 309 B11R2.106 CC1=C2C(=CN=N2)C=CC1 MB03490 [0,1,0,0,0,0|1,0,2]=4 310 B11R2.106 CC1=C2C=CN=C2C=CC1 AB00476 [0,1,0,0,0,0|0,0,2]=3 311 B11R2.106 CC1=C2C=CN=C2N=CC1 PB19900 [0,1,0,0,0,0|1,0,2]=4 312 B11R2.106 CC1=C2C=NN=C2C=CC1 MB03676 [0,1,0,0,0,0|1,0,2]=4 313 B11R2.106 Cc1c2cccn2ccn1 AB52834 [0,1,0,0,0,0|3,0,0]=4 314 B11R2.106 Cc1cccc2c1CCN2 MB06155 [0,1,0,0,0,0|0,0,2]=3 315 B11R2.106 Cc1cccc2c1CNC2 MB06843 [0,1,0,0,0,0|2,0,1]=4 316 B11R2.106 Cc1cccc2c1NCC2 MB04566 [0,1,0,0,0,0|0,0,2]=3 317 B11R2.106 Cc1cccc2c1occ2 MB00742 [0,1,0,0,0,0|1,0,0]=2 318 B11R2.106 c1c2=CCN=c2c(cn1)Br PB15912 [0,1,0,0,0,0|1,0,2]=4 319 B11R2.106 c1c2=CCN=c2c(cn1)Cl PB13266 [0,1,0,0,0,0|1,0,2]=4 320 B11R2.106 c1c2=CCN=c2c(cn1)F PB30026 [0,1,0,0,0,0|1,0,2]=4 321 B11R2.106 c1c2=NCC=c2c(cn1)Br PB31599 [0,1,0,0,0,0|1,0,2]=4 322 B11R2.106 c1c2=NCC=c2c(cn1)Cl PB15239 [0,1,0,0,0,0|1,0,2]=4 323 B11R2.106 c1c2=NCC=c2c(cn1)F PB37419 [0,1,0,0,0,0|1,0,2]=4 324 B11R2.106 c1c2c(c(cn1)Br)NCC2 PB18307 [0,1,0,0,0,0|1,0,2]=4 325 B11R2.106 c1cc(c2c(c1)N=NC2)N PB23340 [0,1,0,0,0,0|1,0,2]=4 326 B11R2.106 c1cc(c2c(c1)NCC2)N MB05532 [0,1,0,0,0,0|0,0,2]=3 327 B11R2.106 c1cc(c2c(c1)OCC2)N PB21917 [0,1,0,0,0,0|1,0,2]=4 328 B11R2.106 c1cc(c2ccoc2c1)N MB06879 [0,1,0,0,0,0|1,0,0]=2 329 B11R2.106 c1cc(c2ccoc2c1)O MB07641 [0,1,0,0,0,0|1,0,0]=2 330 B11R2.106 c1cc(c2nccn2c1)Br PB14615 [0,1,0,0,0,0|1,0,1]=3 331 B11R2.106 c1cc(c2nccn2c1)Br PB38167 [0,1,0,0,0,0|1,0,1]=3 332 B11R2.106 c1cc(c2nccn2c1)N PB32476 [0,1,0,0,0,0|1,0,1]=3 333 B11R2.106 c1cc(c2ncnn2c1)Br PB19103 [0,1,0,0,0,0|2,0,1]=4 334 B11R2.106 c1cc(c2nncn2c1)Br PB29098 [0,1,0,0,0,0|2,0,1]=4 335 B11R2.106 c1cc(n2ccnc2c1)N PB21879 [0,1,0,0,0,0|1,0,1]=3 336 B11R2.106 c1cc2c(=O)[nH]ccn2c1 PB13162 [0,1,0,0,0,0|3,0,0]=4 337 B11R2.106 c1cc2c(c(c1)Br)CCC2 PB24478 [0,1,0,0,0,0|1,0,2]=4 338 B11R2.106 c1cc2c(c(c1)Br)CNC2 MB07470 [0,1,0,0,0,0|2,0,1]=4 339 B11R2.106 c1cc2c(c(c1)Br)ocn2 MB05566 [0,1,0,0,0,0|1,0,1]=3 340 B11R2.106 c1cc2c(c(c1)Br)scn2 PB17880 [0,1,0,0,0,0|1,0,1]=3 341 B11R2.106 c1cc2c(c(c1)Cl)CCN2 MB04569 [0,1,0,0,0,0|0,0,2]=3 342 B11R2.106 c1cc2c(c(c1)Cl)CNC2 MB05816 [0,1,0,0,0,0|2,0,1]=4 343 B11R2.106 c1cc2c(c(c1)Cl)ncs2 MB09046 [0,1,0,0,0,0|1,0,1]=3 344 B11R2.106 c1cc2c(c(c1)Cl)ocn2 MB20023 [0,1,0,0,0,0|1,0,1]=3 345 B11R2.106 c1cc2c(c(c1)F)CNC2 MB08984 [0,1,0,0,0,0|2,0,1]=4 346 B11R2.106 c1cc2c(c(c1)I)CNC2 MB11259 [0,1,0,0,0,0|2,0,1]=4 347 B11R2.106 c1cc2c(c(c1)N)CNC2 AB55999 [0,1,0,0,0,0|2,0,1]=4 348 B11R2.106 c1cc2c(c(c1)N)CNC2 AB66280 [0,1,0,0,0,0|2,0,1]=4 349 B11R2.106 c1cc2c(c(c1)N)NCC2 MB05535 [0,1,0,0,0,0|0,0,2]=3 350 B11R2.106 c1cc2c(c(c1)O)CCN2 MB07004 [0,1,0,0,0,0|0,0,2]=3 351 B11R2.106 c1cc2c(c(c1)O)CNC2 MB08983 [0,1,0,0,0,0|2,0,1]=4 352 B11R2.106 c1cc2c(ccnn2c1)N PB18284 [0,1,0,0,0,0|3,0,0]=4 353 B11R2.106 c1cc2c(cco2)[n+](c1)[O-] CB11844 [0,1,0,0,0,0|2,0,0]=3 354 B11R2.106 c1cc2c(cco2)c(c1)Br PB17600 [0,1,0,0,0,0|1,0,0]=2 355 B11R2.106 c1cc2c(cco2)c(c1)F MB08828 [0,1,0,0,0,0|1,0,0]=2 356 B11R2.106 c1cc2c(ccs2)c(c1)Br PB20282 [0,1,0,0,0,0|1,0,0]=2 357 B11R2.106 c1cc2c(nccn2c1)Cl PB10727 [0,1,0,0,0,0|3,0,0]=4 358 B11R2.106 c1cc2ccnc(n2c1)Cl AB53391 [0,1,0,0,0,0|3,0,0]=4 359 B11R2.106 c1cc2ccnn2c(c1)Br AB28896 [0,1,0,0,0,0|1,0,1]=3 360 B11R2.106 c1cc2ccnn2c(c1)I AB48943 [0,1,0,0,0,0|1,0,1]=3 361 B11R2.106 c1cc2ccoc2c(c1)Br MB06925 [0,1,0,0,0,0|1,0,0]=2 362 B11R2.106 c1cc2ccoc2c(c1)N MB10414 [0,1,0,0,0,0|1,0,0]=2 363 B11R2.106 c1cc2ccsc2c(c1)Br AB25661 [0,1,0,0,0,0|1,0,0]=2 364 B11R2.106 c1cc2cncn2c(c1)Br AB28894 [0,1,0,0,0,0|3,0,0]=4 365 B11R2.106 c1cc2cncn2c(c1)I AB68521 [0,1,0,0,0,0|3,0,0]=4 366 B11R2.106 c1cc2n(c(=O)c1)CCN2 MB08872 [0,1,0,0,0,0|1,0,2]=4 367 B11R2.106 c1cc2nccn2c(c1)Br PB32607 [0,1,0,0,0,0|1,0,1]=3 368 B11R2.106 c1cc2nccn2c(c1)Cl AB61232 [0,1,0,0,0,0|1,0,1]=3 369 B11R2.106 c1cc2ncnn2c(c1)Br PB14838 [0,1,0,0,0,0|2,0,1]=4 370 B11R2.106 c1cc2nncn2c(c1)Br PB16306 [0,1,0,0,0,0|2,0,1]=4 371 B11R2.106 c1cn2ccnc(c2n1)Cl PB29694 [0,1,0,0,0,0|2,0,1]=4 372 B11R2.106 c1cn2ccnc2c(n1)N AB53126 [0,1,0,0,0,0|2,0,1]=4 373 B11R2.106 c1cnc(c2=CCN=c21)Br PB25087 [0,1,0,0,0,0|1,0,2]=4 374 B11R2.106 c1cnc(c2=NCC=c21)Br PB14366 [0,1,0,0,0,0|1,0,2]=4 375 B11R2.106 c1cnc(c2=NCC=c21)Cl PB26100 [0,1,0,0,0,0|1,0,2]=4 376 B11R2.106 c1cnc(c2=NCC=c21)N AB52926 [0,1,0,0,0,0|1,0,2]=4 377 B11R2.106 c1cnc(c2c1NCC2)Br AB73026 [0,1,0,0,0,0|1,0,2]=4 378 B11R2.106 c1cnc(c2c1NCC2)Cl PB31568 [0,1,0,0,0,0|1,0,2]=4 379 B11R2.106 c1cnc(c2c1cco2)Cl PB14748 [0,1,0,0,0,0|2,0,0]=3 380 B11R2.106 c1cnc(c2c1cco2)N AB52921 [0,1,0,0,0,0|2,0,0]=3 381 B11R2.106 c1cnc(c2c1ccs2)Cl PB10318 [0,1,0,0,0,0|2,0,0]=3 382 B11R2.106 c1cnc(c2c1ccs2)N PB25207 [0,1,0,0,0,0|2,0,0]=3 383 B11R2.106 c1cnc(c2c1ncs2)Cl PB28427 [0,1,0,0,0,0|2,0,1]=4 384 B11R2.106 c1cnc(c2c1occ2)N AB52908 [0,1,0,0,0,0|2,0,0]=3 385 B11R2.106 c1cnc(c2c1onc2)Cl AB71663 [0,1,0,0,0,0|3,0,0]=4 386 B11R2.106 c1cnc(c2c1scc2)Cl PB27550 [0,1,0,0,0,0|2,0,0]=3 387 B11R2.106 c1cnc2=CCN=c2c1Br PB10981 [0,1,0,0,0,0|1,0,2]=4 388 B11R2.106 c1cnc2=CCN=c2c1Cl PB14564 [0,1,0,0,0,0|1,0,2]=4 389 B11R2.106 c1cnc2=CCN=c2c1F PB25681 [0,1,0,0,0,0|1,0,2]=4 390 B11R2.106 c1cnc2=NCC=c2c1Br PB31039 [0,1,0,0,0,0|1,0,2]=4 391 B11R2.106 c1cnc2=NCC=c2c1Cl PB29499 [0,1,0,0,0,0|1,0,2]=4 392 B11R2.106 c1cnc2=NCC=c2c1F PB15996 [0,1,0,0,0,0|1,0,2]=4 393 B11R2.106 c1cnc2=NCC=c2c1N PB25081 [0,1,0,0,0,0|1,0,2]=4 394 B11R2.106 c1cnc2=NCC=c2c1O PB23574 [0,1,0,0,0,0|1,0,2]=4 395 B11R2.106 c1cnc2c(c1Br)CCN2 AB76365 [0,1,0,0,0,0|1,0,2]=4 396 B11R2.106 c1cnc2c(c1Cl)cco2 PB22970 [0,1,0,0,0,0|2,0,0]=3 397 B11R2.106 c1cnc2c(c1I)CCN2 AB85220 [0,1,0,0,0,0|1,0,2]=4 398 B11R2.106 c1cnc2ccoc2c1Cl PB22739 [0,1,0,0,0,0|2,0,0]=3 399 B11R2.106 c1cnc2ccsc2c1Cl PB17528 [0,1,0,0,0,0|2,0,0]=3 400 B11R2.106 c1cnc2ccsc2c1N MB06918 [0,1,0,0,0,0|2,0,0]=3 401 B11R2.106 c1cnc2ccsc2c1O PB32284 [0,1,0,0,0,0|2,0,0]=3 402 B11R2.106 c1cnc2nccn2c1Cl AB61265 [0,1,0,0,0,0|2,0,1]=4 403 B11R2.106 c1cnn2c1c(ncc2)Cl AB72522 [0,1,0,0,0,0|2,0,1]=4 404 B11R2.106 c1cnn2c1nccc2Cl PB27621 [0,1,0,0,0,0|2,0,1]=4 405 B11R2.106 c1cnn2c1nccc2O AB16977 [0,1,0,0,0,0|2,0,1]=4 406 B11R2.106 c1cnn2ccnc2c1N PB38542 [0,1,0,0,0,0|2,0,1]=4 407 B11R2.106 c1coc2c1c(ncn2)Cl PB28041 [0,1,0,0,0,0|3,0,0]=4 408 B11R2.106 c1coc2c1c(ncn2)N PB20409 [0,1,0,0,0,0|3,0,0]=4 409 B11R2.106 c1coc2c1ncnc2Cl PB17670 [0,1,0,0,0,0|3,0,0]=4 410 B11R2.106 c1coc2c1ncnc2O AB52914 [0,1,0,0,0,0|3,0,0]=4 411 B11R2.106 c1csc2c1c(cnc2)Cl MB08838 [0,1,0,0,0,0|2,0,0]=3 412 B11R2.106 c1csc2c1c(ncn2)Cl PB14219 [0,1,0,0,0,0|3,0,0]=4 413 B11R2.106 c1csc2c1ncnc2Cl PB24607 [0,1,0,0,0,0|3,0,0]=4 414 B11R2.106 c1csc2c1ncnc2N AB52930 [0,1,0,0,0,0|3,0,0]=4 415 B9R1.8 c1cc(cnc1)CCN AB04606 [0,0,1,0,0,0|1,0,2]=4 416 B9R1.8 c1cc(cnc1)CNN PB16271 [0,0,1,0,0,0|2,0,1]=4 417 B9R1.8 c1ccc(cc1)NC#N MB01061 [0,0,1,0,0,0|1,0,1]=3 418 B9R1.8 c1ccc(cc1)\C=C\Br AB00116 [0,0,1,0,0,0|1,0,0]=2 419 B9R1.8 c1ccc(cc1)\C=N/O AB02488 [0,0,1,0,0,0|2,0,0]=3 420 B9R1.8 c1ccnc(c1)CC=O AB61426 [0,0,1,0,0,0|2,0,1]=4 421 B9R1.8 c1ccnc(c1)CCN AB00732 [0,0,1,0,0,0|1,0,2]=4 422 B9R1.8 c1ccnc(c1)CNN PB19014 [0,0,1,0,0,0|2,0,1]=4 423 B9R1.8 c1cnccc1CCN AB01702 [0,0,1,0,0,0|1,0,2]=4 424 B9R1.8 c1cnccc1CNN PB10342 [0,0,1,0,0,0|2,0,1]=4 425 B9R1.15 C#Cc1ccccc1Br AB10375 [0,0,1,0,0,0|1,0,2]=4 426 B9R1.15 C#Cc1cccnc1N AB66567 [0,0,1,0,0,0|1,0,2]=4 427 B9R1.15 C#Cc1ccncc1N AB69092 [0,0,1,0,0,0|1,0,2]=4 428 B9R1.15 CNc1cccnc1Br AB39252 [0,0,1,0,0,0|2,0,1]=4 429 B9R1.15 CNc1ccncc1O MB27525 [0,0,1,0,0,0|2,0,1]=4 430 B9R1.15 CNc1cnccc1O MB29366 [0,0,1,0,0,0|2,0,1]=4 431 B9R1.15 COc1c(cccn1)N AB07386 [0,0,1,0,0,0|2,0,1]=4 432 B9R1.15 COc1cccnc1N AB40614 [0,0,1,0,0,0|2,0,1]=4 433 B9R1.15 COc1ccncc1N AB40817 [0,0,1,0,0,0|2,0,1]=4 434 B9R1.15 COc1cnccc1N AB55709 [0,0,1,0,0,0|2,0,1]=4 435 B9R1.15 Cc1c(cccn1)C=O PB27878 [0,0,1,0,0,0|3,0,0]=4 436 B9R1.15 Cc1cccnc1C=O PB14292 [0,0,1,0,0,0|3,0,0]=4 437 B9R1.15 Cc1ccncc1C=O PB23498 [0,0,1,0,0,0|3,0,0]=4 438 B9R1.15 Cc1cnccc1C=O AB11481 [0,0,1,0,0,0|3,0,0]=4 439 B9R1.15 c1c(c(ncn1)N)C=O AB55705 [0,0,1,0,0,0|3,0,0]=4 440 B9R1.15 c1cc(c(nc1)Br)C=O AB20862 [0,0,1,0,0,0|3,0,0]=4 441 B9R1.15 c1cc(c(nc1)C#N)N PB18562 [0,0,1,0,0,0|2,0,1]=4 442 B9R1.15 c1cc(c(nc1)C=O)Br AB42598 [0,0,1,0,0,0|3,0,0]=4 443 B9R1.15 c1cc(c(nc1)C=O)F PB22063 [0,0,1,0,0,0|3,0,0]=4 444 B9R1.15 c1cc(c(nc1)C=O)N AB42378 [0,0,1,0,0,0|2,0,0]=3 445 B9R1.15 c1cc(c(nc1)C=O)O PB12355 [0,0,1,0,0,0|3,0,0]=4 446 B9R1.15 c1cc(c(nc1)CCl)N AB31890 [0,0,1,0,0,0|2,0,1]=4 447 B9R1.15 c1cc(c(nc1)CN)N AB48448 [0,0,1,0,0,0|2,0,1]=4 448 B9R1.15 c1cc(c(nc1)CO)N AB31896 [0,0,1,0,0,0|2,0,1]=4 449 B9R1.15 c1cc(c(nc1)Cl)C=O PB27532 [0,0,1,0,0,0|3,0,0]=4 450 B9R1.15 c1cc(c(nc1)F)C=O AB13640 [0,0,1,0,0,0|3,0,0]=4 451 B9R1.15 c1cc(c(nc1)N)C#N AB03606 [0,0,1,0,0,0|2,0,1]=4 452 B9R1.15 c1cc(c(nc1)N)C=O AB09963 [0,0,1,0,0,0|2,0,0]=3 453 B9R1.15 c1cc(c(nc1)N)CCl AB21190 [0,0,1,0,0,0|2,0,1]=4 454 B9R1.15 c1cc(c(nc1)N)CO PB32383 [0,0,1,0,0,0|2,0,1]=4 455 B9R1.15 c1cc(c(nc1)NN)Br MB01287 [0,0,1,0,0,0|3,0,0]=4 456 B9R1.15 c1cc(c(nc1)O)C=O AB55041 [0,0,1,0,0,0|3,0,0]=4 457 B9R1.15 c1ccc(c(c1)C=O)I PB15618 [0,0,1,0,0,0|2,0,0]=3 458 B9R1.15 c1ccc(c(c1)CI)O MB07048 [0,0,1,0,0,0|2,0,1]=4 459 B9R1.15 c1ccc(c(c1)CN)O MB01565 [0,0,1,0,0,0|2,0,1]=4 460 B9R1.15 c1cnc(c(n1)C=O)N PB10822 [0,0,1,0,0,0|3,0,0]=4 461 B9R1.15 c1cncc(c1Br)C=O AB25683 [0,0,1,0,0,0|3,0,0]=4 462 B9R1.15 c1cncc(c1Br)C=O AB53933 [0,0,1,0,0,0|3,0,0]=4 463 B9R1.15 c1cncc(c1C#N)N AB16955 [0,0,1,0,0,0|2,0,1]=4 464 B9R1.15 c1cncc(c1C=O)Br PB17335 [0,0,1,0,0,0|3,0,0]=4 465 B9R1.15 c1cncc(c1C=O)Cl AB23043 [0,0,1,0,0,0|3,0,0]=4 466 B9R1.15 c1cncc(c1C=O)F PB32422 [0,0,1,0,0,0|3,0,0]=4 467 B9R1.15 c1cncc(c1C=O)N PB20170 [0,0,1,0,0,0|2,0,0]=3 468 B9R1.15 c1cncc(c1C=O)O AB08714 [0,0,1,0,0,0|3,0,0]=4 469 B9R1.15 c1cncc(c1CN)N AB49287 [0,0,1,0,0,0|2,0,1]=4 470 B9R1.15 c1cncc(c1CO)N AB25787 [0,0,1,0,0,0|2,0,1]=4 471 B9R1.15 c1cncc(c1Cl)C=O AB17590 [0,0,1,0,0,0|3,0,0]=4 472 B9R1.15 c1cncc(c1F)C=O AB32109 [0,0,1,0,0,0|3,0,0]=4 473 B9R1.15 c1cncc(c1N)C#N AB16952 [0,0,1,0,0,0|2,0,1]=4 474 B9R1.15 c1cncc(c1N)C=O AB12471 [0,0,1,0,0,0|2,0,0]=3 475 B9R1.15 c1cncc(c1N)C=O PB27639 [0,0,1,0,0,0|2,0,0]=3 476 B9R1.15 c1cncc(c1N)CCl AB31893 [0,0,1,0,0,0|2,0,1]=4 477 B9R1.15 c1cncc(c1N)CO PB14435 [0,0,1,0,0,0|2,0,1]=4 478 B9R1.15 c1cncc(c1O)C=O AB59870 [0,0,1,0,0,0|3,0,0]=4 479 B11R2.20 c1cc2c(cccn2)nc1 AB01787 [0,0,0,0,0,1|1,0,1]=3 480 B11R2.20 c1cc2c(nc1)CCCN2 AB45266 [0,0,0,0,0,1|1,0,2]=4 481 B11R2.20 c1cc2c(nc1)CCNC2 AB27765 [0,0,0,0,0,1|1,0,2]=4 482 B11R2.20 c1cc2c(nc1)CNCC2 PB14621 [0,0,0,0,0,1|1,0,2]=4 483 B11R2.20 c1cc2c(nc1)NCCN2 MB05240 [0,0,0,0,0,1|1,0,2]=4 484 B11R2.20 c1cc2c(nc1)NCCO2 AB49130 [0,0,0,0,0,1|1,0,2]=4 485 B11R2.20 c1cc2c(nc1)OCCN2 PB18914 [0,0,0,0,0,1|1,0,2]=4 486 B11R2.20 c1cc2cccnc2nc1 AB02373 [0,0,0,0,0,1|1,0,1]=3 487 B11R2.20 c1cc2cnccc2nc1 AB02371 [0,0,0,0,0,1|1,0,1]=3 488 B11R2.20 c1ccc2c(c1)CCN=C2 AB01545 [0,0,0,0,0,1|1,0,1]=3 489 B11R2.20 c1ccc2c(c1)NCCO2 MB02357 [0,0,0,0,0,1|0,0,2]=3 490 B11R2.20 c1cncc2c1CCCN2 AB64133 [0,0,0,0,0,1|1,0,2]=4 491 B11R2.20 c1cncc2c1CCNC2 PB10616 [0,0,0,0,0,1|1,0,2]=4 492 B11R2.20 c1cncc2c1CNCC2 AB48928 [0,0,0,0,0,1|1,0,2]=4 493 B11R2.20 c1cncc2c1NCCC2 AB43638 [0,0,0,0,0,1|1,0,2]=4 494 B11R2.20 c1cncc2c1NCCO2 AB66612 [0,0,0,0,0,1|1,0,2]=4 495 B11R2.20 c1cncc2c1OCCN2 AB43406 [0,0,0,0,0,1|1,0,2]=4 496 B8R1.2 CNc1cccnc1 AB09114 [1,0,1,0,0,0|1,0,1]=4 497 B8R1.2 c1cc(cnc1)C=O AB00744 [1,0,1,0,0,0|2,0,0]=4 498 B8R1.2 c1cc(cnc1)CN AB00752 [1,0,1,0,0,0|1,0,1]=4 499 B8R1.2 c1cc(cnc1)NN AB42924 [1,0,1,0,0,0|2,0,0]=4 500 B8R1.2 c1cc(cnc1)NN PB18886 [1,0,1,0,0,0|2,0,0]=4 501 B8R1.2 c1ccnc(c1)C=O AB00680 [1,0,1,0,0,0|2,0,0]=4 502 B8R1.2 c1ccnc(c1)CN AB00731 [1,0,1,0,0,0|1,0,1]=4 503 B8R1.2 c1cnccc1C=O AB00754 [1,0,1,0,0,0|2,0,0]=4 504 B8R1.2 c1cnccc1CN AB00767 [1,0,1,0,0,0|1,0,1]=4 505 B8R1.2 c1cnccc1NN PB27392 [1,0,1,0,0,0|2,0,0]=4 506 B8R1.2 c1cnccc1ON AB31585 [1,0,1,0,0,0|2,0,0]=4 507 B8R1.5 Cc1c(cccn1)N PB33695 [1,0,1,0,0,0|1,0,1]=4 508 B8R1.5 Cc1cccnc1N AB17908 [1,0,1,0,0,0|1,0,1]=4 509 B8R1.5 Cc1ccncc1N PB14127 [1,0,1,0,0,0|1,0,1]=4 510 B8R1.5 Cc1cnccc1N PB17234 [1,0,1,0,0,0|1,0,1]=4 511 B8R1.5 c1cc(c(nc1)Br)N AB17900 [1,0,1,0,0,0|2,0,0]=4 512 B8R1.5 c1cc(c(nc1)Br)N PB26005 [1,0,1,0,0,0|2,0,0]=4 513 B8R1.5 c1cc(c(nc1)Cl)N PB23167 [1,0,1,0,0,0|2,0,0]=4 514 B8R1.5 c1cc(c(nc1)F)N AB17917 [1,0,1,0,0,0|2,0,0]=4 515 B8R1.5 c1cc(c(nc1)N)Br PB20016 [1,0,1,0,0,0|2,0,0]=4 516 B8R1.5 c1cc(c(nc1)N)Cl AB15555 [1,0,1,0,0,0|2,0,0]=4 517 B8R1.5 c1cc(c(nc1)N)F AB17912 [1,0,1,0,0,0|2,0,0]=4 518 B8R1.5 c1cc(c(nc1)N)I PB12756 [1,0,1,0,0,0|2,0,0]=4 519 B8R1.5 c1cc(c(nc1)N)O AB00700 [1,0,1,0,0,0|2,0,0]=4 520 B8R1.5 c1cc(c(nc1)N)O AB17906 [1,0,1,0,0,0|2,0,0]=4 521 B8R1.5 c1cc(c(nc1)N)S AB64540 [1,0,1,0,0,0|2,0,0]=4 522 B8R1.5 c1cc(c(nc1)O)N PB30752 [1,0,1,0,0,0|2,0,0]=4 523 B8R1.5 c1cncc(c1Br)N AB17638 [1,0,1,0,0,0|2,0,0]=4 524 B8R1.5 c1cncc(c1Cl)N AB05299 [1,0,1,0,0,0|2,0,0]=4 525 B8R1.5 c1cncc(c1F)N AB50028 [1,0,1,0,0,0|2,0,0]=4 526 B8R1.5 c1cncc(c1I)N PB23406 [1,0,1,0,0,0|2,0,0]=4 527 B8R1.5 c1cncc(c1N)Br AB28611 [1,0,1,0,0,0|2,0,0]=4 528 B8R1.5 c1cncc(c1N)Cl AB16891 [1,0,1,0,0,0|2,0,0]=4 529 B8R1.5 c1cncc(c1N)F PB33879 [1,0,1,0,0,0|2,0,0]=4 530 B8R1.5 c1cncc(c1N)I AB12095 [1,0,1,0,0,0|2,0,0]=4 531 B10R1.1 Cc1ccc(cc1)CC=O AB02059 [0,1,1,0,0,0|1,0,1]=4 532 B10R1.1 Cc1ccc(cc1)\C=C\Br AB73509 [0,1,1,0,0,0|1,0,0]=3 533 B10R1.1 c1cc(ccc1CC=O)Br AB11790 [0,1,1,0,0,0|1,0,1]=4 534 B10R1.1 c1cc(ccc1CC=O)Cl AB11793 [0,1,1,0,0,0|1,0,1]=4 535 B10R1.1 c1cc(ccc1CC=O)F AB11805 [0,1,1,0,0,0|1,0,1]=4 536 B10R1.1 c1cc(ccc1CC=O)N AB27688 [0,1,1,0,0,0|1,0,1]=4 537 B10R1.1 c1cc(ccc1CCN)Br AB00934 [0,1,1,0,0,0|0,0,2]=4 538 B10R1.1 c1cc(ccc1CCN)Cl AB28066 [0,1,1,0,0,0|0,0,2]=4 539 B10R1.1 c1cc(ccc1CCN)F AB03730 [0,1,1,0,0,0|0,0,2]=4 540 B10R1.1 c1cc(ccc1CCN)N AB00936 [0,1,1,0,0,0|0,0,2]=4 541 B10R1.1 c1cc(ccc1CNN)Br PB32548 [0,1,1,0,0,0|1,0,1]=4 542 B10R1.1 c1cc(ccc1CNN)Cl PB29444 [0,1,1,0,0,0|1,0,1]=4 543 B10R1.1 c1cc(ccc1CNN)F PB20964 [0,1,1,0,0,0|1,0,1]=4 544 B10R1.1 c1cc(ccc1\C=C\Br)Br AB32162 [0,1,1,0,0,0|1,0,0]=3 545 B10R1.1 c1cc(ccc1\C=C\Br)Cl AB32165 [0,1,1,0,0,0|1,0,0]=3 546 B10R1.1 c1cc(ccc1\C=C\Br)F AB66443 [0,1,1,0,0,0|1,0,0]=3 547 B10R1.1 c1cc(ccc1\C=N\O)Br AB06151 [0,1,1,0,0,0|2,0,0]=4 548 B10R1.4 Cc1ccccc1CC=O AB11813 [0,1,1,0,0,0|1,0,1]=4 549 B10R1.4 c1ccc(c(c1)CCN)N AB22073 [0,1,1,0,0,0|0,0,2]=4 550 B10R1.4 c1ccc(c(c1)CCN)O MB00877 [0,1,1,0,0,0|0,0,2]=4 551 B10R1.4 c1ccc(c(c1)CNN)Br PB27972 [0,1,1,0,0,0|1,0,1]=4 552 B10R1.4 c1ccc(c(c1)CNN)Cl PB29439 [0,1,1,0,0,0|1,0,1]=4 553 B10R1.4 c1ccc(c(c1)CNN)F PB23531 [0,1,1,0,0,0|1,0,1]=4 554 B10R1.4 c1ccc(c(c1)\C=N\O)Cl AB01188 [0,1,1,0,0,0|2,0,0]=4 555 B10R1.10 Cc1cccc(c1)CC=O AB11815 [0,1,1,0,0,0|1,0,1]=4 556 B10R1.10 c1cc(cc(c1)Br)CC=O AB11787 [0,1,1,0,0,0|1,0,1]=4 557 B10R1.10 c1cc(cc(c1)Br)CCN AB08439 [0,1,1,0,0,0|0,0,2]=4 558 B10R1.10 c1cc(cc(c1)Br)CNN PB10474 [0,1,1,0,0,0|1,0,1]=4 559 B10R1.10 c1cc(cc(c1)Br)\C=C\Br AB73510 [0,1,1,0,0,0|1,0,0]=3 560 B10R1.10 c1cc(cc(c1)Br)\C=N\O AB03839 [0,1,1,0,0,0|2,0,0]=4 561 B10R1.10 c1cc(cc(c1)Cl)CC=O AB11792 [0,1,1,0,0,0|1,0,1]=4 562 B10R1.10 c1cc(cc(c1)Cl)CCN AB02072 [0,1,1,0,0,0|0,0,2]=4 563 B10R1.10 c1cc(cc(c1)Cl)CNN PB23504 [0,1,1,0,0,0|1,0,1]=4 564 B10R1.10 c1cc(cc(c1)F)CC=O AB11802 [0,1,1,0,0,0|1,0,1]=4 565 B10R1.10 c1cc(cc(c1)F)CNN PB22082 [0,1,1,0,0,0|1,0,1]=4 566 B10R1.10 c1cc(cc(c1)N)CCN AB22060 [0,1,1,0,0,0|0,0,2]=4 567 B10R1.15 C[C@@H](CN)c1ccccc1 AB04898 [0,1,1,0,0,0|0,0,2]=4 568 B10R1.15 C[C@H](CN)c1ccccc1 AB04902 [0,1,1,0,0,0|0,0,2]=4 569 B10R1.15 c1cc(cnc1)C(=O)C=O AB62325 [0,1,1,0,0,0|2,0,0]=4 570 B10R1.15 c1ccc(cc1)C(=O)C=O AB00817 [0,1,1,0,0,0|1,0,0]=3 571 B10R1.15 c1ccc(cc1)C(=O)C=O AB03966 [0,1,1,0,0,0|1,0,0]=3 572 B10R1.15 c1ccc(cc1)C(=O)NN AB00887 [0,1,1,0,0,0|1,0,0]=3 573 B10R1.15 c1ccnc(c1)C(=O)C=O AB62330 [0,1,1,0,0,0|2,0,0]=4 574 B10R1.15 c1cnccc1C(=O)C=O AB62328 [0,1,1,0,0,0|2,0,0]=4 575 B10R1.17 c1ccc(cc1)CCC=O AB00823 [0,1,1,0,0,0|1,0,1]=4 576 B10R1.17 c1ccc(cc1)CCCN AB00940 [0,1,1,0,0,0|0,0,2]=4 577 B10R1.18 CC(=O)Nc1ccncc1 AB06982 [0,1,1,0,0,0|1,0,1]=4 578 B10R1.18 C[C@@H](Cc1ccccc1)N AB03711 [0,1,1,0,0,0|0,0,2]=4 579 B10R1.18 C[C@H](Cc1ccccc1)N AB07478 [0,1,1,0,0,0|0,0,2]=4 580 B10R1.18 c1ccc(cc1)CC(=N)N AB29087 [0,1,1,0,0,0|0,0,1]=3 581 B10R1.66 c1cscc1\C=C\C(=O)Cl AB16567 [0,1,1,0,0,0|2,0,0]=4 582 B10R1.2 CCc1cccc(c1N)O MB24059 [0,1,1,0,0,0|0,0,2]=4 583 B10R1.2 CNc1cccc(c1Br)O MB28270 [0,1,1,0,0,0|1,0,1]=4 584 B10R1.2 CNc1cccc(c1Cl)O MB26964 [0,1,1,0,0,0|1,0,1]=4 585 B10R1.2 CNc1cccc(c1F)O MB34647 [0,1,1,0,0,0|1,0,1]=4 586 B10R1.2 CNc1cccc(c1I)O MB29498 [0,1,1,0,0,0|1,0,1]=4 587 B10R1.2 CNc1cccc(c1N)O MB33054 [0,1,1,0,0,0|1,0,1]=4 588 B10R1.2 CNc1cccc(c1O)Br MB26263 [0,1,1,0,0,0|1,0,1]=4 589 B10R1.2 CNc1cccc(c1O)Cl MB33654 [0,1,1,0,0,0|1,0,1]=4 590 B10R1.2 CNc1cccc(c1O)F MB28274 [0,1,1,0,0,0|1,0,1]=4 591 B10R1.2 CNc1cccc(c1O)I MB32214 [0,1,1,0,0,0|1,0,1]=4 592 B10R1.2 CNc1cccc(c1O)N MB33525 [0,1,1,0,0,0|1,0,1]=4 593 B10R1.2 COc1cccc(c1N)O MB12204 [0,1,1,0,0,0|1,0,1]=4 594 B10R1.2 CSc1cccc(c1N)O MB32351 [0,1,1,0,0,0|1,0,1]=4 595 B10R1.2 Cc1c(c(ccn1)C=O)N AB70908 [0,1,1,0,0,0|2,0,0]=4 596 B10R1.2 Cc1c(cccc1O)C=O MB08410 [0,1,1,0,0,0|2,0,0]=4 597 B10R1.2 Cc1c(cccc1O)NC MB37053 [0,1,1,0,0,0|0,0,2]=4 598 B10R1.2 Cc1cccc(c1N)C#N MB08131 [0,1,1,0,0,0|1,0,1]=4 599 B10R1.2 Cc1cccc(c1N)CN MB08906 [0,1,1,0,0,0|1,0,1]=4 600 B10R1.2 Cc1cccc(c1N)OC AB02877 [0,1,1,0,0,0|1,0,1]=4 601 B10R1.2 Cc1cccc(c1O)NC MB31993 [0,1,1,0,0,0|1,0,1]=4 602 B10R1.2 Cc1ccnc(c1N)C=O AB83759 [0,1,1,0,0,0|2,0,0]=4 603 B10R1.2 Cc1cncc(c1N)C=O AB83665 [0,1,1,0,0,0|2,0,0]=4 604 B10R1.2 c1c(c(c(cn1)Br)N)C=O AB83649 [0,1,1,0,0,0|2,0,0]=4 605 B10R1.2 c1c(c(c(cn1)Cl)N)C=O AB83651 [0,1,1,0,0,0|2,0,0]=4 606 B10R1.2 c1c(c(c(cn1)N)N)C=O AB83667 [0,1,1,0,0,0|2,0,0]=4 607 B10R1.2 c1cc(c(c(c1)Br)O)C=O AB01203 [0,1,1,0,0,0|2,0,0]=4 608 B10R1.2 c1cc(c(c(c1)Cl)Br)C=O MB08895 [0,1,1,0,0,0|2,0,0]=4 609 B10R1.2 c1cc(c(c(c1)Cl)F)C=O AB09379 [0,1,1,0,0,0|2,0,0]=4 610 B10R1.2 c1cc(c(c(c1)Cl)O)C=O AB21383 [0,1,1,0,0,0|2,0,0]=4 611 B10R1.2 c1cc(c(c(c1)F)O)C=O AB00313 [0,1,1,0,0,0|2,0,0]=4 612 B10R1.2 c1cc(c(c(c1)I)O)C=O MB12368 [0,1,1,0,0,0|2,0,0]=4 613 B10R1.2 c1cc(c(c(c1)O)Br)C=O AB03304 [0,1,1,0,0,0|2,0,0]=4 614 B10R1.2 c1cc(c(c(c1)O)F)C=O AB63446 [0,1,1,0,0,0|2,0,0]=4 615 B10R1.2 c1cc(c(c(c1)O)I)C=O MB07518 [0,1,1,0,0,0|2,0,0]=4 616 B10R1.2 c1cc(c(c(c1)O)N)C#N MB09969 [0,1,1,0,0,0|1,0,1]=4 617 B10R1.2 c1cc(c(c(c1)O)N)C=O MB38000 [0,1,1,0,0,0|1,0,0]=3 618 B10R1.2 c1cc(c(c(c1)O)N)CN MB35261 [0,1,1,0,0,0|1,0,1]=4 619 B10R1.2 c1cnc(c(c1Br)N)C=O AB83752 [0,1,1,0,0,0|2,0,0]=4 620 B10R1.2 c1cnc(c(c1C=O)N)Br AB71718 [0,1,1,0,0,0|2,0,0]=4 621 B10R1.2 c1cnc(c(c1C=O)N)Cl AB71714 [0,1,1,0,0,0|2,0,0]=4 622 B10R1.2 c1cnc(c(c1C=O)N)N AB83595 [0,1,1,0,0,0|2,0,0]=4 623 B10R1.2 c1cnc(c(c1Cl)N)C=O AB83753 [0,1,1,0,0,0|2,0,0]=4 624 B10R1.20 C#Cc1ccccc1C=O AB17472 [0,1,1,0,0,0|1,0,1]=4 625 B10R1.20 COc1ccccc1C=O AB00311 [0,1,1,0,0,0|1,0,1]=4 626 B10R1.20 c1cc(c(nc1)CN)C=O AB31410 [0,1,1,0,0,0|2,0,0]=4 627 B10R1.25 CCc1ccc(cc1N)O MB23949 [0,1,1,0,0,0|0,0,2]=4 628 B10R1.25 CNc1ccc(cc1F)O MB31256 [0,1,1,0,0,0|1,0,1]=4 629 B10R1.25 CNc1ccc(cc1I)O MB37121 [0,1,1,0,0,0|1,0,1]=4 630 B10R1.25 CNc1ccc(cc1N)O MB30558 [0,1,1,0,0,0|1,0,1]=4 631 B10R1.25 CNc1ccc(cc1O)Cl MB25839 [0,1,1,0,0,0|1,0,1]=4 632 B10R1.25 CNc1ccc(cc1O)N MB33015 [0,1,1,0,0,0|1,0,1]=4 633 B10R1.25 COc1ccc(cc1N)O MB34521 [0,1,1,0,0,0|1,0,1]=4 634 B10R1.25 CSc1ccc(cc1N)O MB34593 [0,1,1,0,0,0|1,0,1]=4 635 B10R1.25 Cc1cc(c(cn1)C=O)N AB83689 [0,1,1,0,0,0|2,0,0]=4 636 B10R1.25 Cc1cc(c(nc1)C=O)N AB83746 [0,1,1,0,0,0|2,0,0]=4 637 B10R1.25 Cc1cc(ccc1NC)O MB05083 [0,1,1,0,0,0|0,0,2]=4 638 B10R1.25 Cc1ccc(c(c1)F)NN AB27888 [0,1,1,0,0,0|2,0,0]=4 639 B10R1.25 Cc1ccc(c(c1)N)C#N AB04357 [0,1,1,0,0,0|1,0,1]=4 640 B10R1.25 Cc1ccc(c(c1)N)C=O AB58436 [0,1,1,0,0,0|1,0,0]=3 641 B10R1.25 Cc1ccc(c(c1)O)NC MB33283 [0,1,1,0,0,0|1,0,1]=4 642 B10R1.25 Cc1ccc(c(n1)N)C=O AB27631 [0,1,1,0,0,0|2,0,0]=4 643 B10R1.25 c1c(c(cnc1Br)C=O)N AB68108 [0,1,1,0,0,0|2,0,0]=4 644 B10R1.25 c1c(c(cnc1Cl)C=O)N AB52769 [0,1,1,0,0,0|2,0,0]=4 645 B10R1.25 c1c(c(cnc1N)C=O)N AB43397 [0,1,1,0,0,0|2,0,0]=4 646 B10R1.25 c1c(cnc(c1N)C=O)Br AB83734 [0,1,1,0,0,0|2,0,0]=4 647 B10R1.25 c1c(cnc(c1N)C=O)Cl AB83735 [0,1,1,0,0,0|2,0,0]=4 648 B10R1.25 c1c(cnc(c1N)C=O)N AB83749 [0,1,1,0,0,0|2,0,0]=4 649 B10R1.25 c1cc(c(cc1Br)Br)C=O AB66752 [0,1,1,0,0,0|2,0,0]=4 650 B10R1.25 c1cc(c(cc1Br)N)C=O AB45657 [0,1,1,0,0,0|1,0,0]=3 651 B10R1.25 c1cc(c(cc1Br)N)CO AB42495 [0,1,1,0,0,0|1,0,1]=4 652 B10R1.25 c1cc(c(cc1Br)O)C=O AB23661 [0,1,1,0,0,0|2,0,0]=4 653 B10R1.25 c1cc(c(cc1Cl)Br)C=O MB06997 [0,1,1,0,0,0|2,0,0]=4 654 B10R1.25 c1cc(c(cc1Cl)N)C=O AB58432 [0,1,1,0,0,0|1,0,0]=3 655 B10R1.25 c1cc(c(cc1Cl)O)C=O AB23660 [0,1,1,0,0,0|2,0,0]=4 656 B10R1.25 c1cc(c(cc1F)Br)C=O AB06851 [0,1,1,0,0,0|2,0,0]=4 657 B10R1.25 c1cc(c(cc1F)N)C=O AB55874 [0,1,1,0,0,0|1,0,0]=3 658 B10R1.25 c1cc(c(cc1F)N)CN AB50268 [0,1,1,0,0,0|1,0,1]=4 659 B10R1.25 c1cc(c(cc1I)O)C=O MB06220 [0,1,1,0,0,0|2,0,0]=4 660 B10R1.25 c1cc(c(cc1N)O)C=O MB09039 [0,1,1,0,0,0|2,0,0]=4 661 B10R1.25 c1cc(c(cc1O)Br)C=O MB25584 [0,1,1,0,0,0|2,0,0]=4 662 B10R1.25 c1cc(c(cc1O)I)C=O MB25658 [0,1,1,0,0,0|2,0,0]=4 663 B10R1.25 c1cc(c(cc1O)N)C#N MB14762 [0,1,1,0,0,0|1,0,1]=4 664 B10R1.25 c1cc(c(cc1O)N)C=O MB38477 [0,1,1,0,0,0|1,0,0]=3 665 B10R1.25 c1cc(c(cc1O)N)CN MB29325 [0,1,1,0,0,0|1,0,1]=4 666 B10R1.25 c1cc(nc(c1C=O)N)Br AB69709 [0,1,1,0,0,0|2,0,0]=4 667 B10R1.25 c1cc(nc(c1C=O)N)Cl AB69707 [0,1,1,0,0,0|2,0,0]=4 668 B10R1.25 c1cc(nc(c1C=O)N)N AB76145 [0,1,1,0,0,0|2,0,0]=4 669 B10R1.30 CCc1cc(ccc1N)O MB23757 [0,1,1,0,0,0|0,0,2]=4 670 B10R1.30 CNc1cc(ccc1Cl)O MB30361 [0,1,1,0,0,0|1,0,1]=4 671 B10R1.30 CNc1cc(ccc1F)O MB28645 [0,1,1,0,0,0|1,0,1]=4 672 B10R1.30 CNc1cc(ccc1I)O MB33108 [0,1,1,0,0,0|1,0,1]=4 673 B10R1.30 CNc1cc(ccc1N)O MB33092 [0,1,1,0,0,0|1,0,1]=4 674 B10R1.30 CNc1cc(ccc1O)Br MB32072 [0,1,1,0,0,0|1,0,1]=4 675 B10R1.30 CNc1cc(ccc1O)F MB26737 [0,1,1,0,0,0|1,0,1]=4 676 B10R1.30 CNc1cc(ccc1O)I MB35760 [0,1,1,0,0,0|1,0,1]=4 677 B10R1.30 CNc1cc(ccc1O)N MB28647 [0,1,1,0,0,0|1,0,1]=4 678 B10R1.30 COc1cc(ccc1N)F MB00562 [0,1,1,0,0,0|1,0,1]=4 679 B10R1.30 COc1cc(ccc1N)O MB01122 [0,1,1,0,0,0|1,0,1]=4 680 B10R1.30 CSc1cc(ccc1N)O MB25516 [0,1,1,0,0,0|1,0,1]=4 681 B10R1.30 Cc1cc(c(cn1)N)C=O AB83642 [0,1,1,0,0,0|2,0,0]=4 682 B10R1.30 Cc1cc(c(nc1)N)C=O AB51533 [0,1,1,0,0,0|2,0,0]=4 683 B10R1.30 Cc1ccc(c(c1)C=O)N AB58438 [0,1,1,0,0,0|1,0,0]=3 684 B10R1.30 Cc1ccc(c(n1)C=O)N AB76244 [0,1,1,0,0,0|2,0,0]=4 685 B10R1.30 Cc1ccc(cc1C=O)Cl AB63586 [0,1,1,0,0,0|2,0,0]=4 686 B10R1.30 Cc1ccc(cc1C=O)O MB23457 [0,1,1,0,0,0|2,0,0]=4 687 B10R1.30 Cc1ccc(cc1NC)O MB36159 [0,1,1,0,0,0|0,0,2]=4 688 B10R1.30 c1c(c(cnc1Br)N)C=O AB76683 [0,1,1,0,0,0|2,0,0]=4 689 B10R1.30 c1c(c(cnc1Cl)N)C=O AB64790 [0,1,1,0,0,0|2,0,0]=4 690 B10R1.30 c1c(c(cnc1N)N)C=O AB76707 [0,1,1,0,0,0|2,0,0]=4 691 B10R1.30 c1c(cnc(c1C=O)N)Br AB50973 [0,1,1,0,0,0|2,0,0]=4 692 B10R1.30 c1c(cnc(c1C=O)N)Cl AB58421 [0,1,1,0,0,0|2,0,0]=4 693 B10R1.30 c1c(cnc(c1C=O)N)F AB70294 [0,1,1,0,0,0|2,0,0]=4 694 B10R1.30 c1cc(c(cc1Br)C#N)N MB00791 [0,1,1,0,0,0|1,0,1]=4 695 B10R1.30 c1cc(c(cc1Br)C=O)Br MB01225 [0,1,1,0,0,0|2,0,0]=4 696 B10R1.30 c1cc(c(cc1Br)C=O)N AB58429 [0,1,1,0,0,0|1,0,0]=3 697 B10R1.30 c1cc(c(cc1Br)CN)N AB23393 [0,1,1,0,0,0|1,0,1]=4 698 B10R1.30 c1cc(c(cc1Br)CO)N MB05459 [0,1,1,0,0,0|1,0,1]=4 699 B10R1.30 c1cc(c(cc1Br)NN)F AB13329 [0,1,1,0,0,0|2,0,0]=4 700 B10R1.30 c1cc(c(cc1Cl)C=O)O AB00314 [0,1,1,0,0,0|2,0,0]=4 701 B10R1.30 c1cc(c(cc1Cl)CN)N AB23303 [0,1,1,0,0,0|1,0,1]=4 702 B10R1.30 c1cc(c(cc1Cl)CO)N MB00550 [0,1,1,0,0,0|1,0,1]=4 703 B10R1.30 c1cc(c(cc1F)C=O)Br AB03821 [0,1,1,0,0,0|2,0,0]=4 704 B10R1.30 c1cc(c(cc1F)C=O)N AB58443 [0,1,1,0,0,0|1,0,0]=3 705 B10R1.30 c1cc(c(cc1F)CN)N AB23426 [0,1,1,0,0,0|1,0,1]=4 706 B10R1.30 c1cc(c(cc1F)CO)N MB05463 [0,1,1,0,0,0|1,0,1]=4 707 B10R1.30 c1cc(c(cc1N)C=O)O MB01352 [0,1,1,0,0,0|2,0,0]=4 708 B10R1.30 c1cc(c(cc1O)C#N)N MB03902 [0,1,1,0,0,0|1,0,1]=4 709 B10R1.30 c1cc(c(cc1O)C=O)Br AB13035 [0,1,1,0,0,0|2,0,0]=4 710 B10R1.30 c1cc(c(cc1O)C=O)Cl MB05036 [0,1,1,0,0,0|2,0,0]=4 711 B10R1.30 c1cc(c(cc1O)C=O)F MB06891 [0,1,1,0,0,0|2,0,0]=4 712 B10R1.30 c1cc(c(cc1O)C=O)N MB29975 [0,1,1,0,0,0|1,0,0]=3 713 B10R1.30 c1cc(nc(c1N)C=O)Br AB83719 [0,1,1,0,0,0|2,0,0]=4 714 B10R1.30 c1cc(nc(c1N)C=O)Cl AB76329 [0,1,1,0,0,0|2,0,0]=4 715 B10R1.30 c1cc(nc(c1N)C=O)N AB83733 [0,1,1,0,0,0|2,0,0]=4 716 B10R1.61 B(c1ccccc1N)(O)O AB08088 [0,1,1,0,0,0|2,0,0]=4 717 B10R1.61 CC(=O)c1c(cccn1)N AB08681 [0,1,1,0,0,0|1,0,1]=4 718 B10R1.61 CC(=O)c1cccnc1N AB11689 [0,1,1,0,0,0|1,0,1]=4 719 B10R1.61 CC(=O)c1ccncc1N AB41121 [0,1,1,0,0,0|1,0,1]=4 720 B10R1.61 CN(C)c1ccccc1O MB08302 [0,1,1,0,0,0|1,0,1]=4 721 B10R1.61 Cc1ccccc1C(=N)N AB18273 [0,1,1,0,0,0|2,0,0]=4 722 B10R1.61 Cc1ccccc1C(=S)N AB16881 [0,1,1,0,0,0|2,0,0]=4 723 B10R1.61 c1cc(c(nc1)C(=O)N)N PB24920 [0,1,1,0,0,0|2,0,0]=4 724 B10R1.61 c1cc(c(nc1)C(=O)O)N PB32134 [0,1,1,0,0,0|2,0,0]=4 725 B10R1.61 c1cc(c(nc1)N)C(=O)O PB30535 [0,1,1,0,0,0|2,0,0]=4 726 B10R1.61 c1ccc(c(c1)C(=N)N)Br AB18326 [0,1,1,0,0,0|2,0,0]=4 727 B10R1.61 c1ccc(c(c1)C(=N)N)Cl AB05888 [0,1,1,0,0,0|2,0,0]=4 728 B10R1.61 c1ccc(c(c1)C(=N)N)F AB18318 [0,1,1,0,0,0|2,0,0]=4 729 B10R1.61 c1ccc(c(c1)C(=N)N)O AB55085 [0,1,1,0,0,0|2,0,0]=4 730 B10R1.61 c1ccc(c(c1)C(=O)O)Br AB00223 [0,1,1,0,0,0|2,0,0]=4 731 B10R1.61 c1ccc(c(c1)C(=S)N)Br AB21272 [0,1,1,0,0,0|2,0,0]=4 732 B10R1.61 c1ccc(c(c1)C(=S)N)Cl AB01839 [0,1,1,0,0,0|2,0,0]=4 733 B10R1.61 c1ccc(c(c1)C(=S)N)N AB07816 [0,1,1,0,0,0|1,0,0]=3 734 B10R1.61 c1cncc(c1C(=O)O)N PB17122 [0,1,1,0,0,0|2,0,0]=4 735 B10R1.61 c1cncc(c1N)C(=O)N PB21456 [0,1,1,0,0,0|2,0,0]=4 736 B10R1.61 c1cncc(c1N)C(=O)O PB26016 [0,1,1,0,0,0|2,0,0]=4 737 B10R1.245 CCc1c(cccc1O)N MB23558 [0,1,1,0,0,0|0,0,2]=4 738 B10R1.245 CNc1c(cccc1Br)O MB31500 [0,1,1,0,0,0|1,0,1]=4 739 B10R1.245 CNc1c(cccc1Cl)O MB33359 [0,1,1,0,0,0|1,0,1]=4 740 B10R1.245 CNc1c(cccc1F)O MB29137 [0,1,1,0,0,0|1,0,1]=4 741 B10R1.245 CNc1c(cccc1I)O MB30346 [0,1,1,0,0,0|1,0,1]=4 742 B10R1.245 CNc1c(cccc1O)N MB01610 [0,1,1,0,0,0|1,0,1]=4 743 B10R1.245 COc1c(cccc1F)N MB00204 [0,1,1,0,0,0|1,0,1]=4 744 B10R1.245 COc1c(cccc1O)N MB14425 [0,1,1,0,0,0|1,0,1]=4 745 B10R1.245 CSc1c(cccc1O)N MB26572 [0,1,1,0,0,0|1,0,1]=4 746 B10R1.245 Cc1c(c(ccn1)N)C=O AB68110 [0,1,1,0,0,0|2,0,0]=4 747 B10R1.245 Cc1cccc(c1C=O)O MB14829 [0,1,1,0,0,0|2,0,0]=4 748 B10R1.245 Cc1ccnc(c1C=O)N AB70910 [0,1,1,0,0,0|2,0,0]=4 749 B10R1.245 Cc1cncc(c1C=O)N AB83619 [0,1,1,0,0,0|2,0,0]=4 750 B10R1.245 c1c(c(c(cn1)Br)C=O)N AB83602 [0,1,1,0,0,0|2,0,0]=4 751 B10R1.245 c1c(c(c(cn1)Cl)C=O)N AB83603 [0,1,1,0,0,0|2,0,0]=4 752 B10R1.245 c1c(c(c(cn1)N)C=O)N AB83622 [0,1,1,0,0,0|2,0,0]=4 753 B10R1.245 c1c(c(c(cn1)O)C=O)N AB84386 [0,1,1,0,0,0|2,0,0]=4 754 B10R1.245 c1cc(c(c(c1)Br)C=O)Br CB11474 [0,1,1,0,0,0|2,0,0]=4 755 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl MB01095 [0,1,1,0,0,0|2,0,0]=4 756 B10R1.245 c1cc(c(c(c1)Br)C=O)F AB14028 [0,1,1,0,0,0|2,0,0]=4 757 B10R1.245 c1cc(c(c(c1)Br)C=O)N PB34549 [0,1,1,0,0,0|1,0,0]=3 758 B10R1.245 c1cc(c(c(c1)Br)C=O)O AB43626 [0,1,1,0,0,0|2,0,0]=4 759 B10R1.245 c1cc(c(c(c1)Cl)C=O)N AB58431 [0,1,1,0,0,0|1,0,0]=3 760 B10R1.245 c1cc(c(c(c1)Cl)C=O)O MB01945 [0,1,1,0,0,0|2,0,0]=4 761 B10R1.245 c1cc(c(c(c1)F)C=O)O MB01694 [0,1,1,0,0,0|2,0,0]=4 762 B10R1.245 c1cc(c(c(c1)I)C=O)O MB14699 [0,1,1,0,0,0|2,0,0]=4 763 B10R1.245 c1cc(c(c(c1)O)C#N)N MB34868 [0,1,1,0,0,0|1,0,1]=4 764 B10R1.245 c1cc(c(c(c1)O)C=O)N MB27161 [0,1,1,0,0,0|1,0,0]=3 765 B10R1.245 c1cc(c(c(c1)O)CN)N MB31845 [0,1,1,0,0,0|1,0,1]=4 766 B10R1.245 c1cnc(c(c1Br)C=O)N AB83695 [0,1,1,0,0,0|2,0,0]=4 767 B10R1.245 c1cnc(c(c1Cl)C=O)N PB22850 [0,1,1,0,0,0|2,0,0]=4 768 B10R1.245 c1cnc(c(c1N)C=O)Br AB83694 [0,1,1,0,0,0|2,0,0]=4 769 B10R1.245 c1cnc(c(c1N)C=O)Cl AB52768 [0,1,1,0,0,0|2,0,0]=4 770 B10R1.245 c1cnc(c(c1N)C=O)O AB84486 [0,1,1,0,0,0|2,0,0]=4 771 B10R1.245 c1cnc(c(c1O)C=O)N AB84460 [0,1,1,0,0,0|2,0,0]=4 772 B12R2.24 CC1CNc2ccccc2O1 AB30912 [0,1,0,0,0,1|0,0,2]=4 773 B12R2.24 CC1COc2ccccc2N1 AB10564 [0,1,0,0,0,1|0,0,2]=4 774 B12R2.24 CC1Cc2ccccc2CN1 AB30586 [0,1,0,0,0,1|0,0,2]=4 775 B12R2.24 C[C@H]1Cc2ccccc2CN1 AB39365 [0,1,0,0,0,1|0,0,2]=4 776 B12R2.24 Cc1ccc2c(c1)CCNC2 AB28729 [0,1,0,0,0,1|0,0,2]=4 777 B12R2.24 Cc1ccc2c(c1)CNCC2 AB12958 [0,1,0,0,0,1|0,0,2]=4 778 B12R2.24 Cc1ccc2c(c1)NCCC2 MB04674 [0,1,0,0,0,1|0,0,2]=4 779 B12R2.24 Cc1ccc2c(c1)NCCO2 AB10553 [0,1,0,0,0,1|0,0,2]=4 780 B12R2.24 Cc1ccc2c(n1)cccn2 PB12466 [0,1,0,0,0,1|1,0,1]=4 781 B12R2.24 Cc1ccc2cccnc2n1 AB17502 [0,1,0,0,0,1|1,0,1]=4 782 B12R2.24 Cc1cnc2ccccc2n1 CB10047 [0,1,0,0,0,1|0,0,1]=3 783 B12R2.24 c1cc(cc2c1ccnc2)Br PB34202 [0,1,0,0,0,1|0,0,1]=3 784 B12R2.24 c1cc(cc2c1ccnc2)Cl MB00648 [0,1,0,0,0,1|0,0,1]=3 785 B12R2.24 c1cc(cc2c1ccnc2)F MB09751 [0,1,0,0,0,1|0,0,1]=3 786 B12R2.24 c1cc(cc2c1ccnc2)I MB09748 [0,1,0,0,0,1|0,0,1]=3 787 B12R2.24 c1cc(cc2c1ccnc2)N MB06457 [0,1,0,0,0,1|0,0,1]=3 788 B12R2.24 c1cc(cc2c1ccnc2)O MB01177 [0,1,0,0,0,1|0,0,1]=3 789 B12R2.24 c1cc(nc2c1cncc2)Br MB04110 [0,1,0,0,0,1|1,0,1]=4 790 B12R2.24 c1cc(nc2c1cncc2)Cl MB09141 [0,1,0,0,0,1|1,0,1]=4 791 B12R2.24 c1cc(nc2c1cncc2)N MB01025 [0,1,0,0,0,1|1,0,1]=4 792 B12R2.24 c1cc2c(cc(cn2)Br)nc1 AB64897 [0,1,0,0,0,1|1,0,1]=4 793 B12R2.24 c1cc2c(cc(cn2)N)nc1 AB68450 [0,1,0,0,0,1|1,0,1]=4 794 B12R2.24 c1cc2c(cc1Br)C=CCO2 AB56471 [0,1,0,0,0,1|1,0,0]=3 795 B12R2.24 c1cc2c(cc1Br)CCCN2 PB12808 [0,1,0,0,0,1|0,0,2]=4 796 B12R2.24 c1cc2c(cc1Br)CCNC2 MB05621 [0,1,0,0,0,1|0,0,2]=4 797 B12R2.24 c1cc2c(cc1Br)CCNC2 PB30910 [0,1,0,0,0,1|0,0,2]=4 798 B12R2.24 c1cc2c(cc1Br)CNCC2 PB18756 [0,1,0,0,0,1|0,0,2]=4 799 B12R2.24 c1cc2c(cc1Br)NCCC2 PB12525 [0,1,0,0,0,1|0,0,2]=4 800 B12R2.24 c1cc2c(cc1Br)NCCO2 AB45777 [0,1,0,0,0,1|0,0,2]=4 801 B12R2.24 c1cc2c(cc1Br)OCCN2 AB49667 [0,1,0,0,0,1|0,0,2]=4 802 B12R2.24 c1cc2c(cc1Br)cncn2 PB12515 [0,1,0,0,0,1|0,0,1]=3 803 B12R2.24 c1cc2c(cc1Br)nccn2 AB07430 [0,1,0,0,0,1|0,0,1]=3 804 B12R2.24 c1cc2c(cc1Cl)CCCN2 MB06841 [0,1,0,0,0,1|0,0,2]=4 805 B12R2.24 c1cc2c(cc1Cl)CCNC2 AB28730 [0,1,0,0,0,1|0,0,2]=4 806 B12R2.24 c1cc2c(cc1Cl)CNCC2 AB22480 [0,1,0,0,0,1|0,0,2]=4 807 B12R2.24 c1cc2c(cc1Cl)NCCC2 MB06330 [0,1,0,0,0,1|0,0,2]=4 808 B12R2.24 c1cc2c(cc1Cl)NCCO2 AB45772 [0,1,0,0,0,1|0,0,2]=4 809 B12R2.24 c1cc2c(cc1Cl)OCCN2 AB30914 [0,1,0,0,0,1|0,0,2]=4 810 B12R2.24 c1cc2c(cc1Cl)cncn2 MB09911 [0,1,0,0,0,1|0,0,1]=3 811 B12R2.24 c1cc2c(cc1F)CCCN2 MB06900 [0,1,0,0,0,1|0,0,2]=4 812 B12R2.24 c1cc2c(cc1F)CCNC2 AB28734 [0,1,0,0,0,1|0,0,2]=4 813 B12R2.24 c1cc2c(cc1F)CNCC2 AB13380 [0,1,0,0,0,1|0,0,2]=4 814 B12R2.24 c1cc2c(cc1F)NCCO2 AB45774 [0,1,0,0,0,1|0,0,2]=4 815 B12R2.24 c1cc2c(cc1F)OCCN2 AB64780 [0,1,0,0,0,1|0,0,2]=4 816 B12R2.24 c1cc2c(cc1I)CCCN2 MB08861 [0,1,0,0,0,1|0,0,2]=4 817 B12R2.24 c1cc2c(cc1I)NCCO2 MB06366 [0,1,0,0,0,1|0,0,2]=4 818 B12R2.24 c1cc2c(cc1I)cncn2 MB07778 [0,1,0,0,0,1|0,0,1]=3 819 B12R2.24 c1cc2c(cc1N)C=NCC2 AB44239 [0,1,0,0,0,1|1,0,1]=4 820 B12R2.24 c1cc2c(cc1N)CCCN2 AB50011 [0,1,0,0,0,1|0,0,2]=4 821 B12R2.24 c1cc2c(cc1N)CCNC2 AB19115 [0,1,0,0,0,1|0,0,2]=4 822 B12R2.24 c1cc2c(cc1N)CNCC2 AB21317 [0,1,0,0,0,1|0,0,2]=4 823 B12R2.24 c1cc2c(cc1N)NCCO2 AB44324 [0,1,0,0,0,1|0,0,2]=4 824 B12R2.24 c1cc2c(cc1N)OCCN2 AB49277 [0,1,0,0,0,1|0,0,2]=4 825 B12R2.24 c1cc2c(cc1N)cncn2 AB60729 [0,1,0,0,0,1|0,0,1]=3 826 B12R2.24 c1cc2c(cc1N)nccn2 AB06131 [0,1,0,0,0,1|0,0,1]=3 827 B12R2.24 c1cc2c(cc1O)CCNC2 AB09835 [0,1,0,0,0,1|0,0,2]=4 828 B12R2.24 c1cc2c(cc1O)CNCC2 MB05747 [0,1,0,0,0,1|0,0,2]=4 829 B12R2.24 c1cc2c(cc1O)NCCO2 AB06521 [0,1,0,0,0,1|0,0,2]=4 830 B12R2.24 c1cc2c(cc1O)NCCO2 MB00965 [0,1,0,0,0,1|0,0,2]=4 831 B12R2.24 c1cc2c(cc1O)OCCN2 MB09266 [0,1,0,0,0,1|0,0,2]=4 832 B12R2.24 c1cc2c(cc1O)cncn2 MB01173 [0,1,0,0,0,1|0,0,1]=3 833 B12R2.24 c1cc2c(ccc(n2)Br)nc1 AB05219 [0,1,0,0,0,1|1,0,1]=4 834 B12R2.24 c1cc2c(ccc(n2)Cl)nc1 PB18055 [0,1,0,0,0,1|1,0,1]=4 835 B12R2.24 c1cc2c(ccc(n2)N)nc1 AB08278 [0,1,0,0,0,1|1,0,1]=4 836 B12R2.24 c1cc2c(cnc(n2)Cl)nc1 PB28512 [0,1,0,0,0,1|1,0,1]=4 837 B12R2.24 c1cc2c(nc1)CC(=O)NC2 AB77257 [0,1,0,0,0,1|1,0,1]=4 838 B12R2.24 c1cc2c(nc1)NC(=O)CC2 PB12351 [0,1,0,0,0,1|1,0,1]=4 839 B12R2.24 c1cc2c(nc1)ncc(n2)Cl AB27598 [0,1,0,0,0,1|1,0,1]=4 840 B12R2.24 c1cc2cc(ccc2nc1)Br AB01417 [0,1,0,0,0,1|0,0,1]=3 841 B12R2.24 c1cc2cc(cnc2nc1)Br AB17834 [0,1,0,0,0,1|1,0,1]=4 842 B12R2.24 c1cc2ccc(=O)[nH]c2nc1 PB26329 [0,1,0,0,0,1|1,0,0]=3 843 B12R2.24 c1cc2ccc(cc2nc1)Br AB15717 [0,1,0,0,0,1|0,0,1]=3 844 B12R2.24 c1cc2ccc(nc2nc1)Br AB05221 [0,1,0,0,0,1|1,0,1]=4 845 B12R2.24 c1cc2ccc(nc2nc1)Cl AB05225 [0,1,0,0,0,1|1,0,1]=4 846 B12R2.24 c1cc2ccc(nc2nc1)N AB08428 [0,1,0,0,0,1|1,0,1]=4 847 B12R2.24 c1cc2cnc(nc2nc1)Cl PB31117 [0,1,0,0,0,1|1,0,1]=4 848 B12R2.24 c1cc2cnccc2cc1Br PB29336 [0,1,0,0,0,1|0,0,1]=3 849 B12R2.24 c1cc2cnccc2cc1Cl MB08350 [0,1,0,0,0,1|0,0,1]=3 850 B12R2.24 c1cc2cnccc2cc1F MB09677 [0,1,0,0,0,1|0,0,1]=3 851 B12R2.24 c1cc2cnccc2cc1I MB09307 [0,1,0,0,0,1|0,0,1]=3 852 B12R2.24 c1cc2cnccc2cc1N AB19123 [0,1,0,0,0,1|0,0,1]=3 853 B12R2.24 c1cc2cnccc2cc1O AB19117 [0,1,0,0,0,1|0,0,1]=3 854 B12R2.24 c1cc2cncnc2cc1Br PB23522 [0,1,0,0,0,1|0,0,1]=3 855 B12R2.24 c1cc2cncnc2cc1Cl MB00894 [0,1,0,0,0,1|0,0,1]=3 856 B12R2.24 c1cc2cncnc2cc1N AB60731 [0,1,0,0,0,1|0,0,1]=3 857 B12R2.24 c1cc2cncnc2cc1O AB60737 [0,1,0,0,0,1|0,0,1]=3 858 B12R2.24 c1cc2cnncc2cc1Br PB16069 [0,1,0,0,0,1|1,0,1]=4 859 B12R2.24 c1ccc2c(c1)CC(=O)NC2 AB15535 [0,1,0,0,0,1|0,0,1]=3 860 B12R2.24 c1ccc2c(c1)CCN(C2)N MB00779 [0,1,0,0,0,1|0,0,2]=4 861 B12R2.24 c1ccc2c(c1)NC(=O)CO2 AB04166 [0,1,0,0,0,1|0,0,1]=3 862 B12R2.24 c1ccc2c(c1)NCC(=O)N2 AB04744 [0,1,0,0,0,1|0,0,1]=3 863 B12R2.24 c1ccc2c(c1)c[nH]c(=O)n2 MB05981 [0,1,0,0,0,1|0,0,1]=3 864 B12R2.24 c1ccc2c(c1)cc(cn2)Br AB00810 [0,1,0,0,0,1|0,0,1]=3 865 B12R2.24 c1ccc2c(c1)ccc(n2)Br MB01039 [0,1,0,0,0,1|0,0,1]=3 866 B12R2.24 c1ccc2c(c1)ccc(n2)Cl AB00798 [0,1,0,0,0,1|0,0,1]=3 867 B12R2.24 c1ccc2c(c1)cnc(n2)Cl AB55617 [0,1,0,0,0,1|0,0,1]=3 868 B12R2.24 c1ccc2c(c1)cnc(n2)N AB07784 [0,1,0,0,0,1|0,0,1]=3 869 B12R2.24 c1ccc2c(c1)ncc(n2)Br AB31889 [0,1,0,0,0,1|0,0,1]=3 870 B12R2.24 c1ccc2c(c1)ncc(n2)N MB00639 [0,1,0,0,0,1|0,0,1]=3 871 B12R2.24 c1ccc2cnc(cc2c1)Br PB12162 [0,1,0,0,0,1|0,0,1]=3 872 B12R2.24 c1ccc2cnc(cc2c1)Cl PB18703 [0,1,0,0,0,1|0,0,1]=3 873 B12R2.24 c1ccc2cnc(cc2c1)N AB03416 [0,1,0,0,0,1|0,0,1]=3 874 B12R2.24 c1ccc2cnc(cc2c1)O PB24595 [0,1,0,0,0,1|0,0,1]=3 875 B12R2.24 c1cnc2c(n1)cc(cn2)Br PB30680 [0,1,0,0,0,1|1,0,1]=4 876 B12R2.24 c1cncc2=CCC(=O)N=c21 AB42569 [0,1,0,0,0,1|1,0,1]=4 877 B12R2.24 c1cncc2c1CC(=O)NC2 AB64881 [0,1,0,0,0,1|1,0,1]=4 878 B12R2.24 c1cncc2c1CCC(=O)N2 MB05928 [0,1,0,0,0,1|1,0,1]=4 879 B12R2.24 c1cncc2c1CNC(=O)C2 AB68337 [0,1,0,0,0,1|1,0,1]=4 880 B12R2.24 c1cncc2c1NC(=O)CC2 MB05707 [0,1,0,0,0,1|1,0,1]=4 881 B12R2.24 c1cncc2c1cnc(n2)Cl PB11204 [0,1,0,0,0,1|1,0,1]=4 882 B12R2.1081 CC1c2ccccc2CCN1 AB07224 [0,1,0,0,0,1|0,0,2]=4 883 B12R2.1081 Cc1cccc2c1cncc2 MB06665 [0,1,0,0,0,1|0,0,1]=3 884 B12R2.1081 Cc1ccnc2c1cccn2 CB10327 [0,1,0,0,0,1|1,0,1]=4 885 B12R2.1081 c1cc(c2c(c1)NCCO2)N MB09299 [0,1,0,0,0,1|0,0,2]=4 886 B12R2.1081 c1cc(c2c(c1)OCCN2)N MB08294 [0,1,0,0,0,1|0,0,2]=4 887 B12R2.1081 c1cc(c2c(c1)nccn2)N AB09749 [0,1,0,0,0,1|0,0,1]=3 888 B12R2.1081 c1cc(c2cncnc2c1)N AB60734 [0,1,0,0,0,1|0,0,1]=3 889 B12R2.1081 c1cc2c(=O)[nH]cnc2nc1 PB19911 [0,1,0,0,0,1|1,0,1]=4 890 B12R2.1081 c1cc2c(c(=O)[nH]cn2)nc1 AB11918 [0,1,0,0,0,1|1,0,1]=4 891 B12R2.1081 c1cc2c(c(c1)Br)CCCN2 PB31290 [0,1,0,0,0,1|0,0,2]=4 892 B12R2.1081 c1cc2c(c(c1)Br)CCNC2 PB22176 [0,1,0,0,0,1|0,0,2]=4 893 B12R2.1081 c1cc2c(c(c1)Br)CNCC2 PB28128 [0,1,0,0,0,1|0,0,2]=4 894 B12R2.1081 c1cc2c(c(c1)Br)OCCN2 MB06348 [0,1,0,0,0,1|0,0,2]=4 895 B12R2.1081 c1cc2c(c(c1)Cl)CCCN2 MB06321 [0,1,0,0,0,1|0,0,2]=4 896 B12R2.1081 c1cc2c(c(c1)Cl)CCNC2 AB45748 [0,1,0,0,0,1|0,0,2]=4 897 B12R2.1081 c1cc2c(c(c1)Cl)CCNC2 MB03608 [0,1,0,0,0,1|0,0,2]=4 898 B12R2.1081 c1cc2c(c(c1)Cl)CNCC2 AB45195 [0,1,0,0,0,1|0,0,2]=4 899 B12R2.1081 c1cc2c(c(c1)Cl)OCCN2 MB06343 [0,1,0,0,0,1|0,0,2]=4 900 B12R2.1081 c1cc2c(c(c1)F)NCCO2 MB11311 [0,1,0,0,0,1|0,0,2]=4 901 B12R2.1081 c1cc2c(c(c1)F)OCCN2 MB06345 [0,1,0,0,0,1|0,0,2]=4 902 B12R2.1081 c1cc2c(c(c1)N)CCNC2 AB12578 [0,1,0,0,0,1|0,0,2]=4 903 B12R2.1081 c1cc2c(c(c1)O)OCCN2 MB08144 [0,1,0,0,0,1|0,0,2]=4 904 B12R2.1081 c1cc2c(c(ccn2)Br)nc1 MB10238 [0,1,0,0,0,1|1,0,1]=4 905 B12R2.1081 c1cc2c(c(ncn2)Cl)nc1 PB22412 [0,1,0,0,0,1|1,0,1]=4 906 B12R2.1081 c1cc2c(cc[nH]c2=O)nc1 PB11849 [0,1,0,0,0,1|1,0,0]=3 907 B12R2.1081 c1cc2c(cccn2)c(c1)Br AB05240 [0,1,0,0,0,1|0,0,1]=3 908 B12R2.1081 c1cc2c(ccnc2Br)nc1 MB01013 [0,1,0,0,0,1|1,0,1]=4 909 B12R2.1081 c1cc2c(ccnc2Cl)nc1 PB32262 [0,1,0,0,0,1|1,0,1]=4 910 B12R2.1081 c1cc2c(ccnc2N)nc1 AB54489 [0,1,0,0,0,1|1,0,1]=4 911 B12R2.1081 c1cc2c(ccnc2nc1)Br AB64248 [0,1,0,0,0,1|1,0,1]=4 912 B12R2.1081 c1cc2c(ccnc2nc1)Cl MB05961 [0,1,0,0,0,1|1,0,1]=4 913 B12R2.1081 c1cc2c(ccnc2nc1)N AB22452 [0,1,0,0,0,1|1,0,1]=4 914 B12R2.1081 c1cc2c(cncn2)c(c1)Br PB25306 [0,1,0,0,0,1|0,0,1]=3 915 B12R2.1081 c1cc2c(cncn2)c(c1)O AB07778 [0,1,0,0,0,1|0,0,1]=3 916 B12R2.1081 c1cc2c(nc1)ncnc2Cl PB26181 [0,1,0,0,0,1|1,0,1]=4 917 B12R2.1081 c1cc2cc[nH]c(=O)c2nc1 AB64971 [0,1,0,0,0,1|1,0,0]=3 918 B12R2.1081 c1cc2cccnc2c(c1)Br AB04626 [0,1,0,0,0,1|0,0,1]=3 919 B12R2.1081 c1cc2ccnc(c2nc1)Br AB65459 [0,1,0,0,0,1|1,0,1]=4 920 B12R2.1081 c1cc2ccnc(c2nc1)Cl AB45031 [0,1,0,0,0,1|1,0,1]=4 921 B12R2.1081 c1cc2ccnc(c2nc1)N AB08899 [0,1,0,0,0,1|1,0,1]=4 922 B12R2.1081 c1cc2ccncc2c(c1)Br MB03403 [0,1,0,0,0,1|0,0,1]=3 923 B12R2.1081 c1cc2ccncc2c(c1)O AB06640 [0,1,0,0,0,1|0,0,1]=3 924 B12R2.1081 c1cc2cncc(c2nc1)Br PB12160 [0,1,0,0,0,1|1,0,1]=4 925 B12R2.1081 c1cc2cnccc2c(c1)Br AB09627 [0,1,0,0,0,1|0,0,1]=3 926 B12R2.1081 c1cc2cncnc2c(c1)N AB49290 [0,1,0,0,0,1|0,0,1]=3 927 B12R2.1081 c1cc2cncnc2c(c1)O AB07782 [0,1,0,0,0,1|0,0,1]=3 928 B12R2.1081 c1cc2cnncc2c(c1)Br MB09752 [0,1,0,0,0,1|1,0,1]=4 929 B12R2.1081 c1cc2cnncc2c(c1)N AB44290 [0,1,0,0,0,1|1,0,1]=4 930 B12R2.1081 c1ccc2c(c1)C(=O)CCN2 AB06711 [0,1,0,0,0,1|0,0,1]=3 931 B12R2.1081 c1ccc2c(c1)C(=O)CCO2 AB00814 [0,1,0,0,0,1|1,0,1]=4 932 B12R2.1081 c1ccc2c(c1)C(=O)CN=N2 MB06564 [0,1,0,0,0,1|0,0,2]=4 933 B12R2.1081 c1ccc2c(c1)C(CCN2)N AB39305 [0,1,0,0,0,1|0,0,2]=4 934 B12R2.1081 c1ccc2c(c1)CCNC2=O AB07451 [0,1,0,0,0,1|0,0,2]=4 935 B12R2.1081 c1ccc2c(c1)CCOC2=O MB01461 [0,1,0,0,0,1|1,0,1]=4 936 B12R2.1081 c1ccc2c(c1)CNCC2=O AB11544 [0,1,0,0,0,1|0,0,1]=3 937 B12R2.1081 c1ccc2c(c1)COCC2=O PB14717 [0,1,0,0,0,1|1,0,1]=4 938 B12R2.1081 c1ccc2c(c1)c(ccn2)Br AB42051 [0,1,0,0,0,1|0,0,1]=3 939 B12R2.1081 c1ccc2c(c1)c(ccn2)N AB06141 [0,1,0,0,0,1|0,0,1]=3 940 B12R2.1081 c1ccc2c(c1)c(ncn2)Cl AB04999 [0,1,0,0,0,1|0,0,1]=3 941 B12R2.1081 c1ccc2c(c1)c(ncn2)N AB03303 [0,1,0,0,0,1|0,0,1]=3 942 B12R2.1081 c1ccc2c(c1)ccnc2Cl AB01423 [0,1,0,0,0,1|0,0,1]=3 943 B12R2.1081 c1ccc2c(c1)ccnc2I AB05244 [0,1,0,0,0,1|0,0,1]=3 944 B12R2.1081 c1ccc2c(c1)cncc2Br AB00815 [0,1,0,0,0,1|0,0,1]=3 945 B12R2.1081 c1ccc2c(c1)cncc2O AB05248 [0,1,0,0,0,1|0,0,1]=3 946 B12R2.1081 c1ccc2c(c1)cnnc2Cl AB01425 [0,1,0,0,0,1|1,0,1]=4 947 B12R2.1081 c1ccc2c(c1)cnnc2O AB03574 [0,1,0,0,0,1|1,0,1]=4 948 B12R2.1081 c1cnc(c2c1cncc2)Br AB65462 [0,1,0,0,0,1|1,0,1]=4 949 B12R2.1081 c1cnc(c2c1cncc2)Cl AB09607 [0,1,0,0,0,1|1,0,1]=4 950 B12R2.1081 c1cnc(c2c1cncc2)N AB64136 [0,1,0,0,0,1|1,0,1]=4 951 B12R2.1081 c1cnc(c2c1nccn2)Cl AB48705 [0,1,0,0,0,1|1,0,1]=4 952 B12R2.1081 c1cnc(c2c1nccn2)N AB53421 [0,1,0,0,0,1|1,0,1]=4 953 B12R2.1081 c1cnc2ccncc2c1N AB09610 [0,1,0,0,0,1|1,0,1]=4 954 B12R2.1081 c1cncc2c1C(=O)CC=N2 PB16378 [0,1,0,0,0,1|1,0,1]=4 955 B12R2.1081 c1cncc2c1c(ccn2)Cl PB25673 [0,1,0,0,0,1|1,0,1]=4 956 B12R2.1081 c1cncc2c1c(cnc2)Br AB73848 [0,1,0,0,0,1|1,0,1]=4 957 B12R2.1081 c1cncc2c1c(ncn2)Cl PB19089 [0,1,0,0,0,1|1,0,1]=4 958 B12R2.1081 c1cncc2c1ccnc2Cl PB30637 [0,1,0,0,0,1|1,0,1]=4 959 B12R2.1081 c1cncc2c1nc[nH]c2=O PB21323 [0,1,0,0,0,1|1,0,1]=4 960 B12R2.1081 c1cncc2c1nccc2Cl PB28088 [0,1,0,0,0,1|1,0,1]=4 961 B12R2.1081 c1cncc2c1ncnc2Cl PB22331 [0,1,0,0,0,1|1,0,1]=4 962 B12R2.1 C#CC1=c2ccccc2=NC1 AB06167 [0,2,0,0,0,0|0,0,2]=4 963 B12R2.1 C1=CC2C(=NC=C2CN)C=C1 AB09355 [0,2,0,0,0,0|0,0,2]=4 964 B12R2.1 c1ccc2c(c1)c(co2)C=O MB02776 [0,2,0,0,0,0|1,0,0]=3 965 B12R2.1 c1ccn2c(c1)c(cn2)C#N AB70358 [0,2,0,0,0,0|1,0,1]=4 966 B12R2.1 c1ccn2c(c1)c(cn2)C=O AB28440 [0,2,0,0,0,0|1,0,1]=4 967 B12R2.1 c1ccn2c(c1)c(cn2)CN AB28979 [0,2,0,0,0,0|1,0,1]=4 968 B12R2.1 c1ccn2c(c1)ccc2C=O AB60669 [0,2,0,0,0,0|2,0,0]=4 969 B12R2.1 c1ccn2c(c1)ncc2C=O AB42413 [0,2,0,0,0,0|1,0,1]=4 970 B12R2.1 c1ccn2c(c1)ncc2CCl AB23751 [0,2,0,0,0,0|1,0,1]=4 971 B12R2.1 c1ccn2c(c1)ncc2CN AB28479 [0,2,0,0,0,0|1,0,1]=4 972 B12R2.18 CC1=NC2=C(=C1Cl)C=CC=C2 AB56055 [0,2,0,0,0,0|0,0,2]=4 973 B12R2.18 CN1Cc2ccccc2C1=O MB00364 [0,2,0,0,0,0|2,0,0]=4 974 B12R2.18 Cn1c(=O)c2ccccc2[nH]1 MB14910 [0,2,0,0,0,0|1,0,0]=3 975 B12R2.18 Cn1c(c2ccccc2n1)Br PB35997 [0,2,0,0,0,0|1,0,1]=4 976 B12R2.18 Cn1c(c2ccccc2n1)I PB16519 [0,2,0,0,0,0|1,0,1]=4 977 B12R2.18 Cn1c2ccccc2nc1Cl AB07066 [0,2,0,0,0,0|1,0,0]=3 978 B12R2.132 C1C=C(C=C2C1=NC=C2N)Br MB07793 [0,2,0,0,0,0|0,0,2]=4 979 B12R2.132 C1C=C(C=C2C1=NC=C2O)Br AB43633 [0,2,0,0,0,0|0,0,2]=4 980 B12R2.132 CC1=c2cc(ccc2=NC1)Br AB17162 [0,2,0,0,0,0|0,0,2]=4 981 B12R2.132 CN1CCc2c1cc(cc2)N AB55966 [0,2,0,0,0,0|0,0,2]=4 982 B12R2.132 Cc1c2cc(ccc2on1)Br MB06428 [0,2,0,0,0,0|2,0,0]=4 983 B12R2.132 Cc1ccc2c(c1)C(=O)NC2 AB49680 [0,2,0,0,0,0|2,0,0]=4 984 B12R2.132 Cc1ccc2ncc(n2c1)I AB28972 [0,2,0,0,0,0|1,0,1]=4 985 B12R2.132 Cc1coc2c1cc(cc2)Br MB07839 [0,2,0,0,0,0|1,0,0]=3 986 B12R2.132 Cn1c2cc(ccc2cn1)Br PB22316 [0,2,0,0,0,0|1,0,0]=3 987 B12R2.132 Cn1c2cc(ccc2cn1)Cl MB11448 [0,2,0,0,0,0|1,0,0]=3 988 B12R2.132 Cn1c2cc(ccc2cn1)F MB11451 [0,2,0,0,0,0|1,0,0]=3 989 B12R2.132 Cn1c2cc(ccc2cn1)I MB11454 [0,2,0,0,0,0|1,0,0]=3 990 B12R2.132 Cn1c2cc(ccc2cn1)N PB21697 [0,2,0,0,0,0|1,0,0]=3 991 B12R2.132 Cn1c2cc(ccc2cn1)O MB01167 [0,2,0,0,0,0|1,0,0]=3 992 B12R2.132 Cn1c2cc(cnc2cn1)Br PB29918 [0,2,0,0,0,0|2,0,0]=4 993 B12R2.132 Cn1ccc2c1cc(cc2)N AB55988 [0,2,0,0,0,0|0,0,0]=2 994 B12R2.132 Cn1ccc2c1nc(nc2)Cl PB13581 [0,2,0,0,0,0|2,0,0]=4 995 B12R2.132 c1c2c(cnc1Cl)scc2Br PB35592 [0,2,0,0,0,0|2,0,0]=4 996 B12R2.132 c1cc(nc2c1scc2Br)Cl PB11046 [0,2,0,0,0,0|2,0,0]=4 997 B12R2.132 c1cc2c(cc1Br)C(=O)CC2 PB34016 [0,2,0,0,0,0|1,0,1]=4 998 B12R2.132 c1cc2c(cc1Br)C(=O)CN2 AB27760 [0,2,0,0,0,0|0,0,1]=3 999 B12R2.132 c1cc2c(cc1Br)C(=O)N=N2 AB60842 [0,2,0,0,0,0|1,0,1]=4 1000 B12R2.132 c1cc2c(cc1Br)C(=O)NC2 PB29879 [0,2,0,0,0,0|2,0,0]=4 1001 B12R2.132 c1cc2c(cc1Br)C(=O)OC2 PB15748 [0,2,0,0,0,0|2,0,0]=4 1002 B12R2.132 c1cc2c(cc1Br)c(no2)Cl AB65566 [0,2,0,0,0,0|2,0,0]=4 1003 B12R2.132 c1cc2c(cc1Br)c(no2)N MB07795 [0,2,0,0,0,0|2,0,0]=4 1004 B12R2.132 c1cc2c(cc1Cl)C(=O)CC2 PB14192 [0,2,0,0,0,0|1,0,1]=4 1005 B12R2.132 c1cc2c(cc1Cl)C(=O)CO2 AB03274 [0,2,0,0,0,0|1,0,1]=4 1006 B12R2.132 c1cc2c(cc1Cl)C(=O)N=N2 AB23768 [0,2,0,0,0,0|1,0,1]=4 1007 B12R2.132 c1cc2c(cc1Cl)C(=O)NC2 MB05675 [0,2,0,0,0,0|2,0,0]=4 1008 B12R2.132 c1cc2c(cc1Cl)c(co2)Br AB65773 [0,2,0,0,0,0|1,0,0]=3 1009 B12R2.132 c1cc2c(cc1Cl)c(cs2)Br MB14444 [0,2,0,0,0,0|1,0,0]=3 1010 B12R2.132 c1cc2c(cc1Cl)c(no2)Cl AB66315 [0,2,0,0,0,0|2,0,0]=4 1011 B12R2.132 c1cc2c(cc1F)C(=O)CC2 AB08649 [0,2,0,0,0,0|1,0,1]=4 1012 B12R2.132 c1cc2c(cc1F)C(=O)NC2 AB51004 [0,2,0,0,0,0|2,0,0]=4 1013 B12R2.132 c1cc2c(cc1F)c(no2)Cl AB64624 [0,2,0,0,0,0|2,0,0]=4 1014 B12R2.132 c1cc2c(cc1I)C(=O)OC2 PB34159 [0,2,0,0,0,0|2,0,0]=4 1015 B12R2.132 c1cc2c(cc1N)C(=O)NC2 PB34386 [0,2,0,0,0,0|2,0,0]=4 1016 B12R2.132 c1cc2c(cc1N)C(=O)OC2 PB15617 [0,2,0,0,0,0|2,0,0]=4 1017 B12R2.132 c1cc2c(cc1O)C(=O)NC2 MB06080 [0,2,0,0,0,0|2,0,0]=4 1018 B12R2.132 c1cc2cnn(c2cc1Cl)O MB69250 [0,2,0,0,0,0|1,0,0]=3 1019 B12R2.132 c1cc2cnn(c2cc1F)O MB69253 [0,2,0,0,0,0|1,0,0]=3 1020 B12R2.132 c1cc2cnn(c2cc1I)N MB11915 [0,2,0,0,0,0|1,0,0]=3 1021 B12R2.132 c1cc2ncc(n2cc1Br)N AB53900 [0,2,0,0,0,0|1,0,1]=4 1022 B12R2.132 c1cc2ncc(n2cc1Cl)Br AB45826 [0,2,0,0,0,0|1,0,1]=4 1023 B12R2.132 c1cc2ncc(n2cc1Cl)I AB28891 [0,2,0,0,0,0|1,0,1]=4 1024 B12R2.132 c1cc2ncc(n2cc1N)Br PB26674 [0,2,0,0,0,0|1,0,1]=4 1025 B12R2.196 CC1=c2cccc(c2=NC1)Cl AB44105 [0,2,0,0,0,0|0,0,2]=4 1026 B12R2.196 Cc1csc2c1ccnc2Cl AB63934 [0,2,0,0,0,0|2,0,0]=4 1027 B12R2.196 Cc1csc2c1ccnc2O AB63938 [0,2,0,0,0,0|2,0,0]=4 1028 B12R2.196 Cc1csc2c1nccc2Cl PB28684 [0,2,0,0,0,0|2,0,0]=4 1029 B12R2.196 Cn1c2cccc(c2cn1)Br PB23714 [0,2,0,0,0,0|1,0,0]=3 1030 B12R2.196 Cn1c2cccc(c2cn1)F MB09182 [0,2,0,0,0,0|1,0,0]=3 1031 B12R2.196 Cn1c2cccc(c2cn1)I PB34667 [0,2,0,0,0,0|1,0,0]=3 1032 B12R2.196 Cn1c2cccc(c2cn1)N PB22298 [0,2,0,0,0,0|1,0,0]=3 1033 B12R2.196 Cn1c2cccc(c2cn1)O MB10366 [0,2,0,0,0,0|1,0,0]=3 1034 B12R2.196 Cn1ccc2c1cccc2N AB43235 [0,2,0,0,0,0|0,0,0]=2 1035 B12R2.196 Cn1ccc2c1nccc2Br PB15126 [0,2,0,0,0,0|1,0,0]=3 1036 B12R2.196 Cn1ccc2c1nccc2Cl PB20579 [0,2,0,0,0,0|1,0,0]=3 1037 B12R2.196 Cn1ccc2c1ncnc2Cl PB10158 [0,2,0,0,0,0|2,0,0]=4 1038 B12R2.196 Cn1cnc2c1ccnc2Cl PB12151 [0,2,0,0,0,0|2,0,0]=4 1039 B12R2.196 c1cc(c2ncc(n2c1)Br)N PB34841 [0,2,0,0,0,0|1,0,1]=4 1040 B12R2.196 c1cc2c(c(c1)Br)CCC2=O PB19935 [0,2,0,0,0,0|1,0,1]=4 1041 B12R2.196 c1cc2c(c(c1)Br)CNC2=O PB29648 [0,2,0,0,0,0|2,0,0]=4 1042 B12R2.196 c1cc2c(c(c1)Cl)CCC2=O PB25074 [0,2,0,0,0,0|1,0,1]=4 1043 B12R2.196 c1cc2c(c(c1)Cl)CNC2=O AB51011 [0,2,0,0,0,0|2,0,0]=4 1044 B12R2.196 c1cc2c(c(c1)F)CCC2=O AB07191 [0,2,0,0,0,0|1,0,1]=4 1045 B12R2.196 c1cc2c(c(c1)F)CNC2=O AB66630 [0,2,0,0,0,0|2,0,0]=4 1046 B12R2.196 c1cc2c(c(c1)F)OCC2=O MB06387 [0,2,0,0,0,0|1,0,1]=4 1047 B12R2.196 c1cc2c(c(c1)I)CCC2=O MB07542 [0,2,0,0,0,0|1,0,1]=4 1048 B12R2.196 c1cc2c(c(c1)N)CNC2=O PB14554 [0,2,0,0,0,0|2,0,0]=4 1049 B12R2.196 c1cc2c(c(c1)O)CNC2=O AB56005 [0,2,0,0,0,0|2,0,0]=4 1050 B12R2.196 c1cc2c(cnn2N)c(c1)Cl MB14932 [0,2,0,0,0,0|1,0,0]=3 1051 B12R2.196 c1cc2c(cnn2O)c(c1)Cl MB69255 [0,2,0,0,0,0|1,0,0]=3 1052 B12R2.196 c1cc2c(cnn2O)c(c1)F MB69251 [0,2,0,0,0,0|1,0,0]=3 1053 B12R2.196 c1cnc(c2c1c(cs2)Br)Cl PB19800 [0,2,0,0,0,0|2,0,0]=4 1054 B12R2.196 c1cnc(c2c1c(cs2)Br)N PB15527 [0,2,0,0,0,0|2,0,0]=4 1055 B12R2.203 Cc1cccc2c1n(nc2)N MB14890 [0,2,0,0,0,0|1,0,0]=3 1056 B12R2.203 Cn1c2c(cccc2Br)cn1 PB34460 [0,2,0,0,0,0|1,0,0]=3 1057 B12R2.203 Cn1c2c(cccc2F)cn1 MB11997 [0,2,0,0,0,0|1,0,0]=3 1058 B12R2.203 Cn1c2c(cccc2N)cn1 PB13181 [0,2,0,0,0,0|1,0,0]=3 1059 B12R2.203 Cn1ccc2c1c(ncn2)Cl PB25493 [0,2,0,0,0,0|2,0,0]=4 1060 B12R2.203 c1cc2c(c(c1)Br)C(=O)N=N2 PB19342 [0,2,0,0,0,0|1,0,1]=4 1061 B12R2.203 c1cc2c(c(c1)Br)C(=O)NC2 AB64823 [0,2,0,0,0,0|2,0,0]=4 1062 B12R2.203 c1cc2c(c(c1)Cl)C(=O)NC2 MB07456 [0,2,0,0,0,0|2,0,0]=4 1063 B12R2.203 c1cc2c(c(c1)F)C(=O)CC2 MB04473 [0,2,0,0,0,0|1,0,1]=4 1064 B12R2.203 c1cc2c(c(c1)N)C(=O)NC2 PB34384 [0,2,0,0,0,0|2,0,0]=4 1065 B12R2.203 c1cnc(c2c1scc2Br)Cl PB31282 [0,2,0,0,0,0|2,0,0]=4 1066 B12R2.203 c1cnc(c2c1scc2Br)N PB32605 [0,2,0,0,0,0|2,0,0]=4 1067 B12R2.612 C1C=C(C=C2C1=C(C=N2)O)Br AB60347 [0,2,0,0,0,0|0,0,2]=4 1068 B12R2.612 CN1CCc2c1ccc(c2)N AB49440 [0,2,0,0,0,0|0,0,2]=4 1069 B12R2.612 Cc1c2ccc(cc2sn1)Cl MB04108 [0,2,0,0,0,0|2,0,0]=4 1070 B12R2.612 Cc1ccc2c(c1)CNC2=O MB07070 [0,2,0,0,0,0|2,0,0]=4 1071 B12R2.612 Cc1ccc2c(c1)cnn2N MB14892 [0,2,0,0,0,0|1,0,0]=3 1072 B12R2.612 Cc1ccc2c(c1)onc2Cl AB25984 [0,2,0,0,0,0|2,0,0]=4 1073 B12R2.612 Cc1ccn2c(c1)ncc2Br AB43022 [0,2,0,0,0,0|1,0,1]=4 1074 B12R2.612 Cc1ccn2c(c1)ncc2I AB28973 [0,2,0,0,0,0|1,0,1]=4 1075 B12R2.612 Cn1c2c(cc(cn2)Br)cn1 PB24210 [0,2,0,0,0,0|2,0,0]=4 1076 B12R2.612 Cn1c2c(cc(cn2)N)cn1 PB22842 [0,2,0,0,0,0|2,0,0]=4 1077 B12R2.612 Cn1c2ccc(cc2cn1)Br PB22315 [0,2,0,0,0,0|1,0,0]=3 1078 B12R2.612 Cn1c2ccc(cc2cn1)I MB11460 [0,2,0,0,0,0|1,0,0]=3 1079 B12R2.612 Cn1c2ccc(cc2cn1)N PB29249 [0,2,0,0,0,0|1,0,0]=3 1080 B12R2.612 Cn1c2ccc(cc2cn1)S MB69216 [0,2,0,0,0,0|1,0,0]=3 1081 B12R2.612 Cn1ccc2c1ncc(c2)Br PB24178 [0,2,0,0,0,0|1,0,0]=3 1082 B12R2.612 Cn1ccc2c1ncc(c2)N PB19323 [0,2,0,0,0,0|1,0,0]=3 1083 B12R2.612 Cn1ccc2c1ncc(c2)O AB48843 [0,2,0,0,0,0|1,0,0]=3 1084 B12R2.612 c1cc2c(cc1Br)CNC2=O PB29649 [0,2,0,0,0,0|2,0,0]=4 1085 B12R2.612 c1cc2c(cc1Br)OCC2=O AB45183 [0,2,0,0,0,0|1,0,1]=4 1086 B12R2.612 c1cc2c(cc1Br)onc2Cl MB11909 [0,2,0,0,0,0|2,0,0]=4 1087 B12R2.612 c1cc2c(cc1Br)onc2N MB07663 [0,2,0,0,0,0|2,0,0]=4 1088 B12R2.612 c1cc2c(cc1Cl)CCC2=O AB01874 [0,2,0,0,0,0|1,0,1]=4 1089 B12R2.612 c1cc2c(cc1Cl)CNC2=O MB05670 [0,2,0,0,0,0|2,0,0]=4 1090 B12R2.612 c1cc2c(cc1Cl)N=NC2=O AB60847 [0,2,0,0,0,0|1,0,1]=4 1091 B12R2.612 c1cc2c(cc1Cl)OCC2=O AB27747 [0,2,0,0,0,0|1,0,1]=4 1092 B12R2.612 c1cc2c(cc1Cl)cnn2N MB14920 [0,2,0,0,0,0|1,0,0]=3 1093 B12R2.612 c1cc2c(cc1Cl)onc2Cl AB25981 [0,2,0,0,0,0|2,0,0]=4 1094 B12R2.612 c1cc2c(cc1F)CCC2=O AB01853 [0,2,0,0,0,0|1,0,1]=4 1095 B12R2.612 c1cc2c(cc1F)CNC2=O AB71859 [0,2,0,0,0,0|2,0,0]=4 1096 B12R2.612 c1cc2c(cc1F)OCC2=O AB51227 [0,2,0,0,0,0|1,0,1]=4 1097 B12R2.612 c1cc2c(cc1F)onc2Cl AB71606 [0,2,0,0,0,0|2,0,0]=4 1098 B12R2.612 c1cc2c(cc1I)CCC2=O MB07544 [0,2,0,0,0,0|1,0,1]=4 1099 B12R2.612 c1cc2c(cc1I)cnn2N MB11912 [0,2,0,0,0,0|1,0,0]=3 1100 B12R2.612 c1cc2c(cc1N)CNC2=O PB14793 [0,2,0,0,0,0|2,0,0]=4 1101 B12R2.612 c1cc2c(cc1O)CNC2=O AB56006 [0,2,0,0,0,0|2,0,0]=4 1102 B12R2.612 c1cn2c(cc1N)ncc2Br PB26659 [0,2,0,0,0,0|1,0,1]=4 1103 B12R2.2028 Cc1c2ccccc2n(n1)N MB14907 [0,2,0,0,0,0|1,0,0]=3 1104 B12R2.2028 Cn1c2c(cccn2)c(n1)Br MB10659 [0,2,0,0,0,0|2,0,0]=4 1105 B12R2.2028 Cn1c2c(cccn2)c(n1)I MB05710 [0,2,0,0,0,0|2,0,0]=4 1106 B12R2.2028 Cn1c2c(cccn2)c(n1)N PB24862 [0,2,0,0,0,0|2,0,0]=4 1107 B12R2.2028 Cn1c2ccccc2c(n1)Br PB19317 [0,2,0,0,0,0|1,0,0]=3 1108 B12R2.2028 Cn1c2ccccc2c(n1)I PB31461 [0,2,0,0,0,0|1,0,0]=3 1109 B12R2.2028 Cn1cc(c2c1cccc2)Br MB09274 [0,2,0,0,0,0|0,0,0]=2 1110 B12R2.2028 Cn1cc(c2c1nccc2)Br AB51141 [0,2,0,0,0,0|1,0,0]=3 1111 B12R2.2028 c1ccc2c(c1)C(CC2=O)Br MB07683 [0,2,0,0,0,0|1,0,1]=4 1112 B12R2.2028 c1ccc2c(c1)C(CC2=O)N AB50544 [0,2,0,0,0,0|1,0,1]=4 1113 B12R2.2403 CC1(CNc2c1cccc2)C PB13437 [0,2,0,0,0,0|0,0,2]=4 1114 B12R2.32 C1=CC2C=C(N=C2C=C1)C=O AB12824 [0,2,0,0,0,0|0,0,2]=4 1115 B12R2.32 C1=CC2C=C(N=C2C=C1)CN AB14523 [0,2,0,0,0,0|0,0,2]=4 1116 B12R2.32 CNc1nc2ccccc2s1 AB01569 [0,2,0,0,0,0|1,0,1]=4 1117 B12R2.32 c1ccc2c(c1)cc(o2)C=O CB10104 [0,2,0,0,0,0|1,0,0]=3 1118 B12R2.32 c1ccc2c(c1)cc(s2)CN AB13993 [0,2,0,0,0,0|1,0,0]=3 1119 B12R2.32 c1ccc2c(c1)nc(o2)CCl AB22415 [0,2,0,0,0,0|1,0,1]=4 1120 B12R2.32 c1ccc2c(c1)nc(o2)CN AB16902 [0,2,0,0,0,0|1,0,1]=4 1121 B12R2.32 c1ccc2c(c1)nc(o2)NN AB03197 [0,2,0,0,0,0|1,0,1]=4 1122 B12R2.32 c1ccc2c(c1)nc(s2)C=O AB06418 [0,2,0,0,0,0|1,0,1]=4 1123 B12R2.32 c1ccc2c(c1)nc(s2)CCl AB22411 [0,2,0,0,0,0|1,0,1]=4 1124 B12R2.32 c1ccc2c(c1)nc(s2)CN AB15872 [0,2,0,0,0,0|1,0,1]=4 1125 B12R2.32 c1ccn2c(c1)cc(n2)C=O AB19635 [0,2,0,0,0,0|1,0,1]=4 1126 B12R2.32 c1ccn2c(c1)cc(n2)CN AB19631 [0,2,0,0,0,0|1,0,1]=4 1127 B12R2.32 c1ccn2c(c1)cc(n2)CN AB48939 [0,2,0,0,0,0|1,0,1]=4 1128 B12R2.32 c1ccn2cc(cc2c1)C=O AB60664 [0,2,0,0,0,0|2,0,0]=4 1129 B12R2.32 c1ccn2cc(nc2c1)CCl AB05508 [0,2,0,0,0,0|1,0,1]=4 1130 B12R2.95 CC1(Cc2ccccc2N1)C AB70011 [0,2,0,0,0,0|0,0,2]=4 1131 B12R2.202 Cc1cc2c(o1)c(ccn2)Cl PB30214 [0,2,0,0,0,0|2,0,0]=4 1132 B12R2.202 Cc1cc2c(o1)ccnc2Cl AB63958 [0,2,0,0,0,0|2,0,0]=4 1133 B12R2.202 Cc1cc2c(o1)ccnc2O AB63957 [0,2,0,0,0,0|2,0,0]=4 1134 B12R2.202 Cc1cc2c(s1)c(ccn2)Cl PB11255 [0,2,0,0,0,0|2,0,0]=4 1135 B12R2.202 Cc1cc2c(s1)ccnc2Cl AB53964 [0,2,0,0,0,0|2,0,0]=4 1136 B12R2.202 Cc1cccc2=NC(=O)N=c12 AB44499 [0,2,0,0,0,0|1,0,1]=4 1137 B12R2.202 Cc1cccc2c1nc(o2)S AB64565 [0,2,0,0,0,0|1,0,1]=4 1138 B12R2.202 Cc1cccc2c1nc(s2)Br AB16505 [0,2,0,0,0,0|1,0,1]=4 1139 B12R2.202 Cc1cccc2c1nc(s2)Cl AB16506 [0,2,0,0,0,0|1,0,1]=4 1140 B12R2.202 Cc1cccc2c1nc(s2)O AB16509 [0,2,0,0,0,0|1,0,1]=4 1141 B12R2.202 Cc1cccc2c1nc(s2)S AB62961 [0,2,0,0,0,0|1,0,1]=4 1142 B12R2.202 Cc1cccc2c1oc(n2)S AB66120 [0,2,0,0,0,0|1,0,1]=4 1143 B12R2.202 Cc1cccc2c1sc(n2)S AB66145 [0,2,0,0,0,0|1,0,1]=4 1144 B12R2.202 Cc1cccn2c1nc(c2)C AB63390 [0,2,0,0,0,0|1,0,1]=4 1145 B12R2.202 Cc1cn2c(n1)cccc2Br MB08766 [0,2,0,0,0,0|1,0,1]=4 1146 B12R2.202 Cc1nc2c(cccc2o1)O MB20022 [0,2,0,0,0,0|1,0,1]=4 1147 B12R2.202 Cc1nc2c(s1)cccc2Cl MB01603 [0,2,0,0,0,0|1,0,1]=4 1148 B12R2.202 Cc1nc2cccc(c2o1)Cl MB20025 [0,2,0,0,0,0|1,0,1]=4 1149 B12R2.202 Cn1cc2c(cccc2n1)N PB28070 [0,2,0,0,0,0|1,0,1]=4 1150 B12R2.202 Cn1cc2c(n1)cccc2Br PB25224 [0,2,0,0,0,0|1,0,1]=4 1151 B12R2.202 Cn1cc2c(n1)cccc2I PB31630 [0,2,0,0,0,0|1,0,1]=4 1152 B12R2.202 Cn1cc2cccc(c2n1)Br PB31415 [0,2,0,0,0,0|1,0,1]=4 1153 B12R2.202 Cn1cc2cccc(c2n1)I PB25464 [0,2,0,0,0,0|1,0,1]=4 1154 B12R2.202 Cn1cc2cccc(c2n1)N PB18621 [0,2,0,0,0,0|1,0,1]=4 1155 B12R2.202 c1c2c(c(cn1)Br)CC(=O)N2 AB66495 [0,2,0,0,0,0|1,0,1]=4 1156 B12R2.202 c1c2c(c(cn1)Cl)CC(=O)N2 AB73885 [0,2,0,0,0,0|1,0,1]=4 1157 B12R2.202 c1cc(c2c(c1)nc(o2)S)N AB66126 [0,2,0,0,0,0|1,0,1]=4 1158 B12R2.202 c1cc(c2c(c1)nc(s2)S)N AB66153 [0,2,0,0,0,0|1,0,1]=4 1159 B12R2.202 c1cc(c2c(c1)oc(n2)S)N AB66123 [0,2,0,0,0,0|1,0,1]=4 1160 B12R2.202 c1cc(c2c(c1)sc(n2)Br)F AB16679 [0,2,0,0,0,0|1,0,1]=4 1161 B12R2.202 c1cc(c2c(c1)sc(n2)S)N AB66148 [0,2,0,0,0,0|1,0,1]=4 1162 B12R2.202 c1cc(c2cc(nn2c1)N)Br PB37649 [0,2,0,0,0,0|1,0,1]=4 1163 B12R2.202 c1cc2c(c(c1)Br)CC(=O)C2 PB34393 [0,2,0,0,0,0|1,0,1]=4 1164 B12R2.202 c1cc2c(c(c1)Br)CC(=O)N2 PB23473 [0,2,0,0,0,0|0,0,1]=3 1165 B12R2.202 c1cc2c(c(c1)Br)NC(=O)C2 PB17281 [0,2,0,0,0,0|0,0,1]=3 1166 B12R2.202 c1cc2c(c(c1)Br)nc(s2)Cl AB20895 [0,2,0,0,0,0|1,0,1]=4 1167 B12R2.202 c1cc2c(c(c1)Br)sc(n2)Cl AB51274 [0,2,0,0,0,0|1,0,1]=4 1168 B12R2.202 c1cc2c(c(c1)Cl)CC(=O)N2 AB15885 [0,2,0,0,0,0|0,0,1]=3 1169 B12R2.202 c1cc2c(c(c1)Cl)NC(=O)C2 AB25436 [0,2,0,0,0,0|0,0,1]=3 1170 B12R2.202 c1cc2c(c(c1)Cl)nc(o2)S AB66129 [0,2,0,0,0,0|1,0,1]=4 1171 B12R2.202 c1cc2c(c(c1)Cl)nc(s2)S AB23779 [0,2,0,0,0,0|1,0,1]=4 1172 B12R2.202 c1cc2c(c(c1)Cl)oc(n2)N MB01974 [0,2,0,0,0,0|1,0,1]=4 1173 B12R2.202 c1cc2c(c(c1)Cl)oc(n2)S AB44916 [0,2,0,0,0,0|1,0,1]=4 1174 B12R2.202 c1cc2c(c(c1)Cl)sc(n2)Cl AB49471 [0,2,0,0,0,0|1,0,1]=4 1175 B12R2.202 c1cc2c(c(c1)Cl)sc(n2)S AB23783 [0,2,0,0,0,0|1,0,1]=4 1176 B12R2.202 c1cc2c(c(c1)F)CC(=O)N2 AB17595 [0,2,0,0,0,0|0,0,1]=3 1177 B12R2.202 c1cc2c(c(c1)F)NC(=O)C2 AB11394 [0,2,0,0,0,0|0,0,1]=3 1178 B12R2.202 c1cc2c(c(c1)F)S=C(N2)Cl AB69982 [0,2,0,0,0,0|1,0,0]=3 1179 B12R2.202 c1cc2c(c(c1)F)nc(o2)Cl AB70786 [0,2,0,0,0,0|1,0,1]=4 1180 B12R2.202 c1cc2c(c(c1)F)oc(n2)Cl AB70781 [0,2,0,0,0,0|1,0,1]=4 1181 B12R2.202 c1cc2c(c(c1)O)CC(=O)N2 AB13551 [0,2,0,0,0,0|0,0,1]=3 1182 B12R2.202 c1cc2c(cc(s2)N)c(c1)Br PB35935 [0,2,0,0,0,0|1,0,0]=3 1183 B12R2.202 c1cc2c(cn(n2)N)c(c1)Cl MB14918 [0,2,0,0,0,0|1,0,1]=4 1184 B12R2.202 c1cc2cc(sc2c(c1)Br)N PB11619 [0,2,0,0,0,0|1,0,0]=3 1185 B12R2.202 c1cnc(c2c1NC(=O)C2)Br AB66493 [0,2,0,0,0,0|1,0,1]=4 1186 B12R2.202 c1cnc(c2c1NC(=O)C2)Cl AB66490 [0,2,0,0,0,0|1,0,1]=4 1187 B12R2.202 c1cnc(c2c1NC(=O)C2)N AB73887 [0,2,0,0,0,0|1,0,1]=4 1188 B12R2.202 c1cnc2c(c1Br)CC(=O)N2 AB65563 [0,2,0,0,0,0|1,0,1]=4 1189 B12R2.202 c1cnc2c(c1Cl)CC(=O)N2 PB29827 [0,2,0,0,0,0|1,0,1]=4 1190 B12R2.202 c1cnc2c(c1F)CC(=O)N2 PB11030 [0,2,0,0,0,0|1,0,1]=4 1191 B12R2.202 c1cnc2c(c1N)CC(=O)N2 AB73878 [0,2,0,0,0,0|1,0,1]=4 1192 B12R2.202 c1cnc2cc(oc2c1Cl)I PB30219 [0,2,0,0,0,0|2,0,0]=4 1193 B12R2.202 c1cnc2cc(sc2c1Cl)Br PB11187 [0,2,0,0,0,0|2,0,0]=4 1194 B12R2.202 c1cnc2cc(sc2c1Cl)I PB17532 [0,2,0,0,0,0|2,0,0]=4 1195 B12R2.606 CC1=NC2=C(=C1)C=C(C=C2)F PB29177 [0,2,0,0,0,0|0,0,2]=4 1196 B12R2.606 Cc1cc2cc(ccc2o1)I AB08838 [0,2,0,0,0,0|1,0,0]=3 1197 B12R2.606 Cc1ccc2=NC(=O)N=c2c1 AB07026 [0,2,0,0,0,0|1,0,1]=4 1198 B12R2.606 Cc1ccc2c(c1)nc(o2)Cl AB43172 [0,2,0,0,0,0|1,0,1]=4 1199 B12R2.606 Cc1ccc2c(c1)nc(o2)N AB09696 [0,2,0,0,0,0|1,0,1]=4 1200 B12R2.606 Cc1ccc2c(c1)nc(o2)S AB45304 [0,2,0,0,0,0|1,0,1]=4 1201 B12R2.606 Cc1ccc2c(c1)nc(s2)S AB62960 [0,2,0,0,0,0|1,0,1]=4 1202 B12R2.606 Cc1ccc2c(c1)oc(n2)Cl AB65043 [0,2,0,0,0,0|1,0,1]=4 1203 B12R2.606 Cc1ccc2c(c1)oc(n2)S AB03206 [0,2,0,0,0,0|1,0,1]=4 1204 B12R2.606 Cc1ccc2c(c1)sc(n2)S AB42352 [0,2,0,0,0,0|1,0,1]=4 1205 B12R2.606 Cc1ccc2c(n1)CC(=O)N2 AB66460 [0,2,0,0,0,0|1,0,1]=4 1206 B12R2.606 Cc1ccc2c(n1)NC(=O)C2 AB73881 [0,2,0,0,0,0|1,0,1]=4 1207 B12R2.606 Cc1cn2cc(ccc2n1)Br MB07679 [0,2,0,0,0,0|1,0,1]=4 1208 B12R2.606 Cc1nc2ccc(cc2o1)Br AB25987 [0,2,0,0,0,0|1,0,1]=4 1209 B12R2.606 Cc1nc2ccc(cc2o1)Cl AB49156 [0,2,0,0,0,0|1,0,1]=4 1210 B12R2.606 Cn1cc2cc(ccc2n1)Br PB25227 [0,2,0,0,0,0|1,0,1]=4 1211 B12R2.606 Cn1cc2cc(ccc2n1)I PB22596 [0,2,0,0,0,0|1,0,1]=4 1212 B12R2.606 Cn1cc2cc(ccc2n1)N PB20057 [0,2,0,0,0,0|1,0,1]=4 1213 B12R2.606 Cn1cc2ccc(cc2n1)Br PB22304 [0,2,0,0,0,0|1,0,1]=4 1214 B12R2.606 Cn1cc2ccc(cc2n1)I PB25468 [0,2,0,0,0,0|1,0,1]=4 1215 B12R2.606 Cn1cc2ccc(cc2n1)N PB18494 [0,2,0,0,0,0|1,0,1]=4 1216 B12R2.606 c1c(cnc2c1CC(=O)N2)Br PB18779 [0,2,0,0,0,0|1,0,1]=4 1217 B12R2.606 c1c(cnc2c1CC(=O)N2)Cl PB30032 [0,2,0,0,0,0|1,0,1]=4 1218 B12R2.606 c1c(cnc2c1CC(=O)N2)F PB30039 [0,2,0,0,0,0|1,0,1]=4 1219 B12R2.606 c1c(cnc2c1NC(=O)C2)Br PB24075 [0,2,0,0,0,0|1,0,1]=4 1220 B12R2.606 c1c(cnc2c1NC(=O)C2)Cl PB21798 [0,2,0,0,0,0|1,0,1]=4 1221 B12R2.606 c1c(cnc2c1oc(=O)[nH]2)N AB65779 [0,2,0,0,0,0|2,0,0]=4 1222 B12R2.606 c1c2c(cnc1Br)CC(=O)N2 AB71543 [0,2,0,0,0,0|1,0,1]=4 1223 B12R2.606 c1c2c(cnc1Br)NC(=O)C2 PB28320 [0,2,0,0,0,0|1,0,1]=4 1224 B12R2.606 c1c2c(cnc1Cl)CC(=O)N2 PB16060 [0,2,0,0,0,0|1,0,1]=4 1225 B12R2.606 c1c2c(cnc1Cl)NC(=O)C2 PB31570 [0,2,0,0,0,0|1,0,1]=4 1226 B12R2.606 c1cc(cc2c1cc(s2)N)Br PB27099 [0,2,0,0,0,0|1,0,0]=3 1227 B12R2.606 c1cc(cn2c1cc(n2)Br)Cl PB31663 [0,2,0,0,0,0|1,0,1]=4 1228 B12R2.606 c1cc(nc2c1CC(=O)N2)Br AB66483 [0,2,0,0,0,0|1,0,1]=4 1229 B12R2.606 c1cc(nc2c1CC(=O)N2)Cl PB25399 [0,2,0,0,0,0|1,0,1]=4 1230 B12R2.606 c1cc(nc2c1NC(=O)C2)Br PB10498 [0,2,0,0,0,0|1,0,1]=4 1231 B12R2.606 c1cc(nc2c1NC(=O)C2)Cl PB22129 [0,2,0,0,0,0|1,0,1]=4 1232 B12R2.606 c1cc(nc2c1cc(s2)Br)Cl AB48721 [0,2,0,0,0,0|2,0,0]=4 1233 B12R2.606 c1cc2=NC(=O)N=c2cc1Br AB10496 [0,2,0,0,0,0|1,0,1]=4 1234 B12R2.606 c1cc2=NC(=O)N=c2cc1F AB21861 [0,2,0,0,0,0|1,0,1]=4 1235 B12R2.606 c1cc2=NC(=O)N=c2cc1I AB21858 [0,2,0,0,0,0|1,0,1]=4 1236 B12R2.606 c1cc2=NC(=S)N=c2cc1Br AB26155 [0,2,0,0,0,0|1,0,1]=4 1237 B12R2.606 c1cc2c(cc1Br)CC(=O)C2 AB42440 [0,2,0,0,0,0|1,0,1]=4 1238 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 PB32208 [0,2,0,0,0,0|0,0,1]=3 1239 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 PB24760 [0,2,0,0,0,0|0,0,1]=3 1240 B12R2.606 c1cc2c(cc1Br)cc(s2)N PB15286 [0,2,0,0,0,0|1,0,0]=3 1241 B12R2.606 c1cc2c(cc1Br)nc(o2)Cl AB63671 [0,2,0,0,0,0|1,0,1]=4 1242 B12R2.606 c1cc2c(cc1Br)nc(o2)N AB09697 [0,2,0,0,0,0|1,0,1]=4 1243 B12R2.606 c1cc2c(cc1Br)nc(s2)Cl AB51271 [0,2,0,0,0,0|1,0,1]=4 1244 B12R2.606 c1cc2c(cc1Br)nc(s2)N MB01323 [0,2,0,0,0,0|1,0,1]=4 1245 B12R2.606 c1cc2c(cc1Br)oc(n2)Cl AB63667 [0,2,0,0,0,0|1,0,1]=4 1246 B12R2.606 c1cc2c(cc1Br)oc(n2)N MB01972 [0,2,0,0,0,0|1,0,1]=4 1247 B12R2.606 c1cc2c(cc1Br)sc(n2)Cl AB20897 [0,2,0,0,0,0|1,0,1]=4 1248 B12R2.606 c1cc2c(cc1Cl)CC(=O)N2 AB04636 [0,2,0,0,0,0|0,0,1]=3 1249 B12R2.606 c1cc2c(cc1Cl)NC(=O)C2 AB04797 [0,2,0,0,0,0|0,0,1]=3 1250 B12R2.606 c1cc2c(cc1Cl)cn(n2)N MB14915 [0,2,0,0,0,0|1,0,1]=4 1251 B12R2.606 c1cc2c(cc1Cl)nc(o2)Cl PB26446 [0,2,0,0,0,0|1,0,1]=4 1252 B12R2.606 c1cc2c(cc1Cl)nc(o2)S AB04398 [0,2,0,0,0,0|1,0,1]=4 1253 B12R2.606 c1cc2c(cc1Cl)nc(s2)Cl AB01965 [0,2,0,0,0,0|1,0,1]=4 1254 B12R2.606 c1cc2c(cc1Cl)nc(s2)N AB04766 [0,2,0,0,0,0|1,0,1]=4 1255 B12R2.606 c1cc2c(cc1Cl)nc(s2)S AB00531 [0,2,0,0,0,0|1,0,1]=4 1256 B12R2.606 c1cc2c(cc1Cl)oc(n2)Cl AB32054 [0,2,0,0,0,0|1,0,1]=4 1257 B12R2.606 c1cc2c(cc1Cl)oc(n2)N AB09701 [0,2,0,0,0,0|1,0,1]=4 1258 B12R2.606 c1cc2c(cc1Cl)oc(n2)S AB07270 [0,2,0,0,0,0|1,0,1]=4 1259 B12R2.606 c1cc2c(cc1Cl)sc(n2)S AB06691 [0,2,0,0,0,0|1,0,1]=4 1260 B12R2.606 c1cc2c(cc1F)CC(=O)N2 AB11374 [0,2,0,0,0,0|0,0,1]=3 1261 B12R2.606 c1cc2c(cc1F)NC(=O)C2 AB02036 [0,2,0,0,0,0|0,0,1]=3 1262 B12R2.606 c1cc2c(cc1F)nc(o2)Cl AB65045 [0,2,0,0,0,0|1,0,1]=4 1263 B12R2.606 c1cc2c(cc1F)nc(o2)N AB09694 [0,2,0,0,0,0|1,0,1]=4 1264 B12R2.606 c1cc2c(cc1F)nc(s2)N MB03574 [0,2,0,0,0,0|1,0,1]=4 1265 B12R2.606 c1cc2c(cc1I)CC(=O)N2 MB06441 [0,2,0,0,0,0|0,0,1]=3 1266 B12R2.606 c1cc2c(cc1N)CC(=O)N2 PB27577 [0,2,0,0,0,0|0,0,1]=3 1267 B12R2.606 c1cc2c(cc1N)NC(=O)C2 PB17556 [0,2,0,0,0,0|0,0,1]=3 1268 B12R2.606 c1cc2c(cc1N)nc(s2)S AB66150 [0,2,0,0,0,0|1,0,1]=4 1269 B12R2.606 c1cc2c(cc1N)oc(n2)S AB48296 [0,2,0,0,0,0|1,0,1]=4 1270 B12R2.606 c1cc2c(cc1N)sc(n2)S AB02354 [0,2,0,0,0,0|1,0,1]=4 1271 B12R2.606 c1cc2c(cc1O)NC(=O)C2 AB21813 [0,2,0,0,0,0|0,0,1]=3 1272 B12R2.606 c1cc2nc(cn2cc1Cl)Cl AB44153 [0,2,0,0,0,0|1,0,1]=4 1273 B12R2.606 c1cc2nc(cn2cc1F)Br AB62506 [0,2,0,0,0,0|1,0,1]=4 1274 B12R2.606 c1cn2cc(nc2cc1Cl)Cl AB28889 [0,2,0,0,0,0|1,0,1]=4 1275 B12R2.44 C#CC1=CC2C=CN=C2C=C1 AB64484 [0,2,0,0,0,0|0,0,2]=4 1276 B12R2.44 C1C=C(C=C2C1=NC=C2)C#N PB25883 [0,2,0,0,0,0|0,0,2]=4 1277 B12R2.44 C1C=C(C=C2C1=NC=C2)C=O AB10798 [0,2,0,0,0,0|0,0,2]=4 1278 B12R2.44 C1C=C(C=C2C1=NC=C2)CN AB09848 [0,2,0,0,0,0|0,0,2]=4 1279 B12R2.44 C1C=C(C=C2C1=NC=C2)CO AB11366 [0,2,0,0,0,0|0,0,2]=4 1280 B12R2.44 C1C=C2C=CN=C2C=C1C#N AB01213 [0,2,0,0,0,0|0,0,2]=4 1281 B12R2.44 C1C=C2C=CN=C2C=C1C=O AB11369 [0,2,0,0,0,0|0,0,2]=4 1282 B12R2.44 C1C=C2C=CN=C2C=C1CO AB11368 [0,2,0,0,0,0|0,0,2]=4 1283 B12R2.44 COC1=CC2C=CN=C2C=C1 AB00488 [0,2,0,0,0,0|0,0,2]=4 1284 B12R2.44 COc1ccc2c(c1)N=CC2 AB01327 [0,2,0,0,0,0|0,0,2]=4 1285 B12R2.44 COc1ccc2c(c1)NCC2 AB32628 [0,2,0,0,0,0|0,0,2]=4 1286 B12R2.44 COc1ccc2c(c1)scn2 AB10586 [0,2,0,0,0,0|1,0,1]=4 1287 B12R2.44 c1cc(cc2c1cco2)C#N MB09726 [0,2,0,0,0,0|1,0,0]=3 1288 B12R2.44 c1cc(cc2c1cco2)C=O MB06876 [0,2,0,0,0,0|1,0,0]=3 1289 B12R2.44 c1cc2c(cc1C#N)CCN2 MB04564 [0,2,0,0,0,0|0,0,2]=4 1290 B12R2.44 c1cc2c(cc1C#N)cno2 AB26016 [0,2,0,0,0,0|2,0,0]=4 1291 B12R2.44 c1cc2c(cc1C#N)ncs2 AB26033 [0,2,0,0,0,0|1,0,1]=4 1292 B12R2.44 c1cc2c(cc1C#N)scn2 AB26026 [0,2,0,0,0,0|1,0,1]=4 1293 B12R2.44 c1cc2c(cc1C=O)cno2 AB70274 [0,2,0,0,0,0|2,0,0]=4 1294 B12R2.44 c1cc2c(cco2)cc1C#N MB03560 [0,2,0,0,0,0|1,0,0]=3 1295 B12R2.44 c1cc2c(cco2)cc1C=O MB02725 [0,2,0,0,0,0|1,0,0]=3 1296 B12R2.44 c1cc2c(cco2)cc1CO MB03310 [0,2,0,0,0,0|1,0,0]=3 1297 B12R2.44 c1cc2c(ccs2)cc1C#N MB03564 [0,2,0,0,0,0|1,0,0]=3 1298 B12R2.44 c1cc2c(ccs2)cc1C=O MB03492 [0,2,0,0,0,0|1,0,0]=3 1299 B12R2.44 c1cc2cnoc2cc1C#N AB26004 [0,2,0,0,0,0|2,0,0]=4 1300 B12R2.44 c1cc2nccn2cc1C#N PB20190 [0,2,0,0,0,0|1,0,1]=4 1301 B12R2.44 c1cc2nccn2cc1C=O PB22050 [0,2,0,0,0,0|1,0,1]=4 1302 B12R2.44 c1cc2nccn2cc1CN AB44926 [0,2,0,0,0,0|1,0,1]=4 1303 B12R2.44 c1cc2nccn2cc1CO PB13061 [0,2,0,0,0,0|1,0,1]=4 1304 B12R2.44 c1cn2ccnc2cc1C#N PB19076 [0,2,0,0,0,0|1,0,1]=4 1305 B12R2.44 c1cn2ccnc2cc1C=O PB17705 [0,2,0,0,0,0|1,0,1]=4 1306 B12R2.44 c1cn2ccnc2cc1CO PB28425 [0,2,0,0,0,0|1,0,1]=4 1307 B12R2.44 c1csc2c1ncc(c2)C#N PB20555 [0,2,0,0,0,0|2,0,0]=4 1308 B12R2.82 C1C=C2C(=CC=N2)C(=C1Cl)F AB08025 [0,2,0,0,0,0|0,0,2]=4 1309 B12R2.82 C1C=C2C(=CC=N2)C(=C1F)Cl MB12195 [0,2,0,0,0,0|0,0,2]=4 1310 B12R2.82 C1C=C2C(=CC=N2)C(=C1F)F MB02141 [0,2,0,0,0,0|0,0,2]=4 1311 B12R2.82 C1C=C2C(=CC=N2)C(=C1O)F AB31790 [0,2,0,0,0,0|0,0,2]=4 1312 B12R2.82 C1C=C2C=CN=C2C(=C1Cl)Cl PB11169 [0,2,0,0,0,0|0,0,2]=4 1313 B12R2.82 c1cc(c(c2c1NCC2)Cl)F MB12065 [0,2,0,0,0,0|0,0,2]=4 1314 B12R2.82 c1cc(c(c2c1NCC2)F)Cl MB69360 [0,2,0,0,0,0|0,0,2]=4 1315 B12R2.82 c1cc(c(c2c1NCC2)F)F MB03180 [0,2,0,0,0,0|0,0,2]=4 1316 B12R2.82 c1cc(c(c2c1NCC2)F)F MB69361 [0,2,0,0,0,0|0,0,2]=4 1317 B12R2.82 c1cc(c(c2c1cco2)Br)F MB06990 [0,2,0,0,0,0|1,0,0]=3 1318 B12R2.100 c1c2=CCN=c2cc(c1Br)F PB17872 [0,2,0,0,0,0|0,0,2]=4 1319 B12R2.100 c1c2=CCN=c2cc(c1Cl)Cl PB23210 [0,2,0,0,0,0|0,0,2]=4 1320 B12R2.100 c1c2=CCN=c2cc(c1Cl)F MB01658 [0,2,0,0,0,0|0,0,2]=4 1321 B12R2.100 c1c2=CCN=c2cc(c1F)Br PB17742 [0,2,0,0,0,0|0,0,2]=4 1322 B12R2.100 c1c2=CCN=c2cc(c1F)Cl PB12726 [0,2,0,0,0,0|0,0,2]=4 1323 B12R2.100 c1c2=CCN=c2cc(c1F)F MB01663 [0,2,0,0,0,0|0,0,2]=4 1324 B12R2.100 c1c2=CCN=c2cc(c1O)Br PB28586 [0,2,0,0,0,0|0,0,2]=4 1325 B12R2.100 c1c2=CCN=c2cc(c1O)Cl PB21381 [0,2,0,0,0,0|0,0,2]=4 1326 B12R2.100 c1c2c(cc(c1Cl)F)NCC2 MB14985 [0,2,0,0,0,0|0,0,2]=4 1327 B12R2.100 c1c2c(cc(c1F)Cl)NCC2 MB12062 [0,2,0,0,0,0|0,0,2]=4 1328 B12R2.100 c1c2c(cc(c1F)F)NCC2 MB01679 [0,2,0,0,0,0|0,0,2]=4 1329 B12R2.246 Cc1cc(c2c(c1)N=CC2)C AB31499 [0,2,0,0,0,0|0,0,2]=4 1330 B12R2.246 Cc1cc(cc2c1occ2)Br MB10399 [0,2,0,0,0,0|1,0,0]=3 1331 B12R2.246 Cc1cc2ccoc2c(c1)Br MB10395 [0,2,0,0,0,0|1,0,0]=3 1332 B12R2.246 c1c(cc(c2=CCN=c21)Br)Br AB30634 [0,2,0,0,0,0|0,0,2]=4 1333 B12R2.246 c1c(cc(c2=CCN=c21)Br)N AB13422 [0,2,0,0,0,0|0,0,2]=4 1334 B12R2.246 c1c(cc(c2=CCN=c21)Br)O AB13574 [0,2,0,0,0,0|0,0,2]=4 1335 B12R2.246 c1c(cc(c2=CCN=c21)Cl)Cl PB23331 [0,2,0,0,0,0|0,0,2]=4 1336 B12R2.246 c1c(cc(c2=CCN=c21)O)Br AB31563 [0,2,0,0,0,0|0,0,2]=4 1337 B12R2.246 c1c(cc(c2=NCC=c21)F)Br PB10286 [0,2,0,0,0,0|0,0,2]=4 1338 B12R2.246 c1c(cc(c2=NCC=c21)F)F MB01671 [0,2,0,0,0,0|0,0,2]=4 1339 B12R2.246 c1c(cc(c2=NCC=c21)F)N PB19319 [0,2,0,0,0,0|0,0,2]=4 1340 B12R2.246 c1c(cc2=NCC=c2c1N)Br AB13421 [0,2,0,0,0,0|0,0,2]=4 1341 B12R2.246 c1cn2cc(cc(c2n1)N)Br PB26358 [0,2,0,0,0,0|1,0,1]=4 1342 B12R2.246 c1coc2c1cc(cc2Br)Br MB10026 [0,2,0,0,0,0|1,0,0]=3 1343 B12R2.246 c1coc2c1cc(cc2Br)Cl MB06992 [0,2,0,0,0,0|1,0,0]=3 1344 B12R2.246 c1coc2c1cc(cc2Br)F MB06968 [0,2,0,0,0,0|1,0,0]=3 1345 B12R2.246 c1coc2c1cc(cc2Br)O MB10400 [0,2,0,0,0,0|1,0,0]=3 1346 B12R2.246 c1coc2c1cc(cc2Cl)Br MB10408 [0,2,0,0,0,0|1,0,0]=3 1347 B12R2.246 c1coc2c1cc(cc2F)Br MB06987 [0,2,0,0,0,0|1,0,0]=3 1348 B12R2.246 c1coc2c1cc(cc2N)Br MB10410 [0,2,0,0,0,0|1,0,0]=3 1349 B12R2.246 c1coc2c1cc(cc2O)F AB31653 [0,2,0,0,0,0|1,0,0]=3 1350 B12R2.246 c1coc2c1cc(nc2Br)Br AB85285 [0,2,0,0,0,0|2,0,0]=4 1351 B12R2.246 c1csc2c1c(cc(n2)Cl)Cl AB56047 [0,2,0,0,0,0|2,0,0]=4 1352 B12R2.246 c1csc2c1c(cc(n2)O)O AB56046 [0,2,0,0,0,0|2,0,0]=4 1353 B12R2.246 c1csc2c1c(nc(c2)N)Br AB85283 [0,2,0,0,0,0|2,0,0]=4 1354 B12R2.246 c1csc2c1nc(cc2Cl)Cl PB19055 [0,2,0,0,0,0|2,0,0]=4 1355 B12R2.246 c1csc2c1nc(cc2O)O AB43121 [0,2,0,0,0,0|2,0,0]=4 1356 B12R2.221 C1=CN=C2C1C(=CC=C2Br)F PB32352 [0,2,0,0,0,0|0,0,2]=4 1357 B12R2.221 C1=CN=C2C1C(=CC=C2F)F MB01667 [0,2,0,0,0,0|0,0,2]=4 1358 B12R2.221 c1cc(c2c(c1F)cco2)Br MB06970 [0,2,0,0,0,0|1,0,0]=3 1359 B12R2.221 c1cc(c2ccoc2c1Cl)Br MB10392 [0,2,0,0,0,0|1,0,0]=3 1360 B12R2.221 c1cc(c2ccoc2c1F)Br MB10389 [0,2,0,0,0,0|1,0,0]=3 1361 B12R2.221 c1cc(c2ccoc2c1N)Br MB08877 [0,2,0,0,0,0|1,0,0]=3 1362 B12R2.221 c1coc2c1c(ncc2Br)Cl PB22543 [0,2,0,0,0,0|2,0,0]=4 1363 B12R2.315 COC1=C2C(=CC=N2)C=CC1 AB02030 [0,2,0,0,0,0|0,0,2]=4 1364 B12R2.315 COC1=C2C=CN=C2C=CC1 PB19861 [0,2,0,0,0,0|0,0,2]=4 1365 B12R2.315 COc1c2c(ccn1)cco2 PB29696 [0,2,0,0,0,0|2,0,0]=4 1366 B12R2.315 c1cc(c2c(c1)N=CC2)C#N AB04035 [0,2,0,0,0,0|0,0,2]=4 1367 B12R2.315 c1cc(c2c(c1)N=CC2)C=O AB09519 [0,2,0,0,0,0|0,0,2]=4 1368 B12R2.315 c1cc(c2c(c1)N=CC2)CN AB21262 [0,2,0,0,0,0|0,0,2]=4 1369 B12R2.315 c1cc(c2c(c1)N=CC2)CO AB09515 [0,2,0,0,0,0|0,0,2]=4 1370 B12R2.315 c1cc(c2ccoc2c1)C#N MB08822 [0,2,0,0,0,0|1,0,0]=3 1371 B12R2.315 c1cc(c2ccoc2c1)C=O MB08826 [0,2,0,0,0,0|1,0,0]=3 1372 B12R2.315 c1cc(c2ccoc2c1)CO MB08830 [0,2,0,0,0,0|1,0,0]=3 1373 B12R2.315 c1cc(c2nccn2c1)C#N PB23788 [0,2,0,0,0,0|1,0,1]=4 1374 B12R2.315 c1cc(c2nccn2c1)C=O PB17375 [0,2,0,0,0,0|1,0,1]=4 1375 B12R2.315 c1cc(c2nccn2c1)CN AB61210 [0,2,0,0,0,0|1,0,1]=4 1376 B12R2.315 c1cc(c2nccn2c1)CO PB25508 [0,2,0,0,0,0|1,0,1]=4 1377 B12R2.315 c1cc(n2ccnc2c1)C=O AB61220 [0,2,0,0,0,0|1,0,1]=4 1378 B12R2.315 c1cc(n2ccnc2c1)CCl AB66625 [0,2,0,0,0,0|1,0,1]=4 1379 B12R2.315 c1cc(n2ccnc2c1)CN AB61224 [0,2,0,0,0,0|1,0,1]=4 1380 B12R2.315 c1cc2ccnn2c(c1)C=O AB28423 [0,2,0,0,0,0|1,0,1]=4 1381 B12R2.315 c1cc2ccnn2c(c1)CN AB28982 [0,2,0,0,0,0|1,0,1]=4 1382 B12R2.315 c1cc2ccnn2c(c1)CO AB28976 [0,2,0,0,0,0|1,0,1]=4 1383 B12R2.315 c1cc2ccsc2c(c1)C=O MB06402 [0,2,0,0,0,0|1,0,0]=3