0 B8R1.8 CNCC1=NC=NC1 AB57901 [0,0,0,0,0,0|3,0,1]=4 1 B8R1.8 CNCC1=NN=CC1 AB27908 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.8 CNCc1cccs1 AB13997 [0,0,0,0,0,0|1,1,0]=2 3 B8R1.8 CNCc1ccno1 AB27949 [0,0,0,0,0,0|2,0,0]=2 4 B8R1.8 CNCc1ccon1 AB27911 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.8 CNCc1ccon1 AB27912 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.8 CNCc1cncs1 AB27956 [0,0,0,0,0,0|2,1,0]=3 7 B8R1.8 CNCc1cnsc1 AB74097 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.8 CNCc1cocn1 AB63386 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.8 CNCc1cscn1 AB27945 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.8 CNCc1cscn1 AB27947 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.8 CNCc1nccs1 AB12715 [0,0,0,0,0,0|2,1,0]=3 12 B8R1.8 COCc1[nH]ccn1 PB20902 [0,0,0,0,0,0|2,1,0]=3 13 B8R1.8 COCn1ccnn1 AB72401 [0,0,0,0,0,0|3,1,0]=4 14 B8R1.8 c1c(ncs1)CCN AB45423 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.8 c1cc(oc1)N=C=O AB53758 [0,0,0,0,0,0|3,0,0]=3 16 B8R1.8 c1cc(sc1)CCN PB12982 [0,0,0,0,0,0|2,1,0]=3 17 B8R1.8 c1cc(sc1)CCO PB32074 [0,0,0,0,0,0|2,1,0]=3 18 B8R1.8 c1cc(sc1)CNN PB12479 [0,0,0,0,0,0|2,1,0]=3 19 B8R1.8 c1ccn(c1)CCBr MB00850 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.8 c1cnn(c1)CCN AB15836 [0,0,0,0,0,0|4,0,0]=4 21 B8R1.8 c1coc(n1)CC=O AB57661 [0,0,0,0,0,0|3,0,0]=3 22 B8R1.8 c1coc(n1)N=C=O AB74260 [0,0,0,0,0,0|4,0,0]=4 23 B8R1.8 c1csc(n1)CC#N PB29400 [0,0,0,0,0,0|3,1,0]=4 24 B8R1.8 c1csc(n1)CC=O AB57662 [0,0,0,0,0,0|3,1,0]=4 25 B8R1.8 c1csc(n1)CCN AB28436 [0,0,0,0,0,0|3,1,0]=4 26 B8R1.8 c1csc(n1)CCN AB43209 [0,0,0,0,0,0|3,1,0]=4 27 B8R1.8 c1cscc1CC#N PB19846 [0,0,0,0,0,0|4,0,0]=4 28 B8R1.8 c1cscc1CCN PB24618 [0,0,0,0,0,0|4,0,0]=4 29 B8R1.8 c1cscc1CCO PB25903 [0,0,0,0,0,0|4,0,0]=4 30 B8R1.8 c1cscc1CNN PB25191 [0,0,0,0,0,0|4,0,0]=4 31 B8R1.8 c1nnc(o1)CCN AB57621 [0,0,0,0,0,0|4,0,0]=4 32 B7R1.1 CCC1=CN=CC1 AB31265 [1,0,0,0,0,0|2,0,0]=3 33 B7R1.1 CCC1=NN=CC1 AB65715 [1,0,0,0,0,0|2,0,1]=4 34 B7R1.1 CCn1cncn1 AB31524 [1,0,0,0,0,0|3,0,0]=4 35 B7R1.1 COc1nccs1 AB09330 [1,0,0,0,0,0|1,2,0]=4 36 B7R1.1 CSC1=NC=NC1 CB10764 [1,0,0,0,0,0|2,0,1]=4 37 B7R1.1 c1c(nco1)CCl AB71585 [1,0,0,0,0,0|3,0,0]=4 38 B7R1.1 c1c(nco1)CN PB29323 [1,0,0,0,0,0|3,0,0]=4 39 B7R1.1 c1c(nco1)CO PB29559 [1,0,0,0,0,0|2,1,0]=4 40 B7R1.1 c1c(ncs1)CCl AB10919 [1,0,0,0,0,0|3,0,0]=4 41 B7R1.1 c1c(ncs1)CN AB27866 [1,0,0,0,0,0|3,0,0]=4 42 B7R1.1 c1c(ncs1)CN PB21996 [1,0,0,0,0,0|3,0,0]=4 43 B7R1.1 c1c(ncs1)CO AB20478 [1,0,0,0,0,0|2,1,0]=4 44 B7R1.1 c1c(ocn1)C#N AB19309 [1,0,0,0,0,0|2,0,1]=4 45 B7R1.1 c1c(ocn1)C=O AB11283 [1,0,0,0,0,0|1,1,1]=4 46 B7R1.1 c1c(ocn1)CCl AB42450 [1,0,0,0,0,0|2,0,0]=3 47 B7R1.1 c1c(ocn1)CN AB30442 [1,0,0,0,0,0|2,0,0]=3 48 B7R1.1 c1c(ocn1)CO PB32681 [1,0,0,0,0,0|1,1,0]=3 49 B7R1.1 c1c(scn1)CCl AB64977 [1,0,0,0,0,0|2,1,0]=4 50 B7R1.1 c1c(scn1)CN AB27929 [1,0,0,0,0,0|2,1,0]=4 51 B7R1.1 c1c(scn1)CN PB32316 [1,0,0,0,0,0|2,1,0]=4 52 B7R1.1 c1c(scn1)CO AB20492 [1,0,0,0,0,0|1,2,0]=4 53 B7R1.1 c1cc(oc1)C#N AB00309 [1,0,0,0,0,0|1,0,1]=3 54 B7R1.1 c1cc(oc1)CCl MB06568 [1,0,0,0,0,0|1,0,0]=2 55 B7R1.1 c1cc(sc1)CN PB17027 [1,0,0,0,0,0|1,1,0]=3 56 B7R1.1 c1cc(sc1)CO PB10001 [1,0,0,0,0,0|0,2,0]=3 57 B7R1.1 c1cnoc1CN AB27950 [1,0,0,0,0,0|2,0,0]=3 58 B7R1.1 c1cnoc1CN AB27954 [1,0,0,0,0,0|2,0,0]=3 59 B7R1.1 c1cnoc1CO AB28102 [1,0,0,0,0,0|1,1,0]=3 60 B7R1.1 c1cnsc1CCl AB70841 [1,0,0,0,0,0|2,1,0]=4 61 B7R1.1 c1cnsc1CN AB70840 [1,0,0,0,0,0|2,1,0]=4 62 B7R1.1 c1coc(n1)C=O AB14413 [1,0,0,0,0,0|1,1,1]=4 63 B7R1.1 c1coc(n1)CCl AB19278 [1,0,0,0,0,0|2,0,0]=3 64 B7R1.1 c1coc(n1)CN AB19275 [1,0,0,0,0,0|2,0,0]=3 65 B7R1.1 c1coc(n1)CN AB28202 [1,0,0,0,0,0|2,0,0]=3 66 B7R1.1 c1coc(n1)CO PB27948 [1,0,0,0,0,0|1,1,0]=3 67 B7R1.1 c1conc1CCl MB04274 [1,0,0,0,0,0|3,0,0]=4 68 B7R1.1 c1conc1CN PB24935 [1,0,0,0,0,0|3,0,0]=4 69 B7R1.1 c1conc1CO PB15902 [1,0,0,0,0,0|2,1,0]=4 70 B7R1.1 c1csc(n1)CCl AB42463 [1,0,0,0,0,0|2,1,0]=4 71 B7R1.1 c1csc(n1)CN MB03193 [1,0,0,0,0,0|2,1,0]=4 72 B7R1.1 c1csc(n1)CN PB20005 [1,0,0,0,0,0|2,1,0]=4 73 B7R1.1 c1cscc1CN AB13999 [1,0,0,0,0,0|3,0,0]=4 74 B7R1.1 c1cscc1CN PB12237 [1,0,0,0,0,0|3,0,0]=4 75 B7R1.1 c1cscc1CO PB10036 [1,0,0,0,0,0|2,1,0]=4 76 B7R1.1 c1csnc1CN PB23687 [1,0,0,0,0,0|3,0,0]=4 77 B7R1.1 c1nnc(o1)CCl AB08293 [1,0,0,0,0,0|3,0,0]=4 78 B7R1.1 c1nnc(o1)CN AB25336 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.7 Cc1coc(n1)CNC AB70150 [0,1,0,0,0,0|2,0,0]=3 80 B9R1.7 Cc1nc(cs1)CNC AB28276 [0,1,0,0,0,0|3,0,0]=4 81 B9R1.7 c1cc(sc1CCN)Br AB18531 [0,1,0,0,0,0|2,1,0]=4 82 B9R1.7 c1cc(sc1CCN)Cl MB05588 [0,1,0,0,0,0|2,1,0]=4 83 B9R1.7 c1cc(sc1CNN)Cl PB15933 [0,1,0,0,0,0|2,1,0]=4 84 B9R1.11 COC(=O)c1ncco1 AB42108 [0,1,0,0,0,0|1,1,1]=4 85 B9R1.11 c1cc(oc1)C(=O)C=O AB04785 [0,1,0,0,0,0|2,0,1]=4 86 B9R1.11 c1cc(oc1)C(=O)C=O AB49990 [0,1,0,0,0,0|2,0,1]=4 87 B9R1.11 c1cc(sc1)C(CO)N PB33213 [0,1,0,0,0,0|2,1,0]=4 88 B9R1.12 CNCCc1cccs1 AB18501 [0,1,0,0,0,0|1,1,0]=3 89 B9R1.12 CNCCn1cccn1 AB48422 [0,1,0,0,0,0|3,0,0]=4 90 B9R1.12 c1ccn(c1)CCCBr MB00854 [0,1,0,0,0,0|3,0,0]=4 91 B9R1.13 B(Cc1ccco1)(O)O AB10323 [0,1,0,0,0,0|2,0,0]=3 92 B9R1.13 c1cc(sc1)CC(=O)O PB27359 [0,1,0,0,0,0|2,1,0]=4 93 B9R1.33 CNCc1cccn1C AB22465 [0,1,0,0,0,0|2,0,0]=3 94 B9R1.33 CNCc1cncn1C AB42250 [0,1,0,0,0,0|3,0,0]=4 95 B9R2.2 c1cnn(c1)C2CC2 AB85325 [0,0,0,1,0,0|3,0,0]=4 96 B9R2.3 c1c2c(on1)CNC2 AB76720 [0,0,0,1,0,0|2,0,0]=3 97 B9R1.8 C#CCc1ccccn1 AB73234 [0,0,0,0,0,1|2,0,1]=4 98 B9R1.8 C#CCc1cccnc1 AB61408 [0,0,0,0,0,1|2,0,1]=4 99 B9R1.8 CNCc1ccccn1 AB10674 [0,0,0,0,0,1|2,0,0]=3 100 B9R1.8 CNCc1cccnc1 AB01384 [0,0,0,0,0,1|2,0,0]=3 101 B9R1.8 CNCc1ccncc1 AB02721 [0,0,0,0,0,1|2,0,0]=3 102 B9R1.8 CNCc1ccnnc1 PB24326 [0,0,0,0,0,1|3,0,0]=4 103 B9R1.8 CNCc1cnccn1 PB18749 [0,0,0,0,0,1|2,0,0]=3 104 B9R1.8 CNCc1cncnc1 PB33284 [0,0,0,0,0,1|3,0,0]=4 105 B9R1.8 CNCc1ncccn1 PB29842 [0,0,0,0,0,1|2,0,0]=3 106 B9R1.8 c1cc(cnc1)CCN AB04606 [0,0,0,0,0,1|3,0,0]=4 107 B9R1.8 c1cc(cnc1)CNN PB16271 [0,0,0,0,0,1|3,0,0]=4 108 B9R1.8 c1cc(nnc1)CC#N PB25604 [0,0,0,0,0,1|3,0,0]=4 109 B9R1.8 c1cc(nnc1)CCN AB61130 [0,0,0,0,0,1|3,0,0]=4 110 B9R1.8 c1cc(nnc1)CNN PB37174 [0,0,0,0,0,1|3,0,0]=4 111 B9R1.8 c1ccnc(c1)CC#N AB00727 [0,0,0,0,0,1|3,0,0]=4 112 B9R1.8 c1ccnc(c1)CC=O AB61426 [0,0,0,0,0,1|3,0,0]=4 113 B9R1.8 c1ccnc(c1)CCN AB00732 [0,0,0,0,0,1|3,0,0]=4 114 B9R1.8 c1ccnc(c1)CNN PB19014 [0,0,0,0,0,1|3,0,0]=4 115 B9R1.8 c1cnc(cn1)CC#N PB16294 [0,0,0,0,0,1|3,0,0]=4 116 B9R1.8 c1cnc(cn1)CC=O AB57650 [0,0,0,0,0,1|3,0,0]=4 117 B9R1.8 c1cnc(cn1)CCN AB22666 [0,0,0,0,0,1|3,0,0]=4 118 B9R1.8 c1cnc(cn1)CNN PB20222 [0,0,0,0,0,1|3,0,0]=4 119 B9R1.8 c1cnc(nc1)CC#N PB12692 [0,0,0,0,0,1|3,0,0]=4 120 B9R1.8 c1cnc(nc1)CC=O AB57641 [0,0,0,0,0,1|3,0,0]=4 121 B9R1.8 c1cnc(nc1)CCN AB55156 [0,0,0,0,0,1|3,0,0]=4 122 B9R1.8 c1cnc(nc1)CNN PB21406 [0,0,0,0,0,1|3,0,0]=4 123 B9R1.8 c1cnccc1CCN AB01702 [0,0,0,0,0,1|3,0,0]=4 124 B9R1.8 c1cnccc1CNN PB10342 [0,0,0,0,0,1|3,0,0]=4 125 B9R1.8 c1cncnc1CC#N PB22811 [0,0,0,0,0,1|3,0,0]=4 126 B9R1.8 c1cncnc1CC=O AB57648 [0,0,0,0,0,1|3,0,0]=4 127 B9R1.8 c1cncnc1CCN PB14818 [0,0,0,0,0,1|3,0,0]=4 128 B6R1.2 CC1=CCCO1 AB00300 [2,0,0,0,0,0|0,0,2]=4 129 B6R1.2 CC1=CN=CC1 PB12076 [2,0,0,0,0,0|2,0,0]=4 130 B6R1.2 CC1=NC=CC1 AB12705 [2,0,0,0,0,0|1,0,1]=4 131 B6R1.2 Cc1ccon1 AB01288 [2,0,0,0,0,0|2,0,0]=4 132 B6R1.2 Cc1cocn1 AB63545 [2,0,0,0,0,0|2,0,0]=4 133 B6R1.2 Cn1cccn1 PB33818 [2,0,0,0,0,0|2,0,0]=4 134 B6R1.2 c1c(ocn1)Br AB68491 [2,0,0,0,0,0|2,0,0]=4 135 B6R1.2 c1c(ocn1)N MB10132 [2,0,0,0,0,0|2,0,0]=4 136 B6R1.2 c1cc(oc1)Br AB04890 [2,0,0,0,0,0|1,0,0]=3 137 B6R1.2 c1cc(sc1)N AB08372 [2,0,0,0,0,0|1,1,0]=4 138 B6R1.2 c1cnoc1N MB00706 [2,0,0,0,0,0|2,0,0]=4 139 B6R1.2 c1coc(n1)Br AB53255 [2,0,0,0,0,0|2,0,0]=4 140 B6R1.2 c1coc(n1)I PB15201 [2,0,0,0,0,0|2,0,0]=4 141 B6R1.2 c1coc(n1)N MB04324 [2,0,0,0,0,0|2,0,0]=4 142 B8R1.1 CCc1[nH]c(cn1)Cl AB45181 [1,1,0,0,0,0|2,0,0]=4 143 B8R1.1 CCc1cnc(o1)N AB64704 [1,1,0,0,0,0|1,0,0]=3 144 B8R1.1 CCc1nnc(o1)N PB21808 [1,1,0,0,0,0|2,0,0]=4 145 B8R1.1 CCn1cc(cn1)Br AB43826 [1,1,0,0,0,0|2,0,0]=4 146 B8R1.1 CCn1cc(cn1)N PB34103 [1,1,0,0,0,0|2,0,0]=4 147 B8R1.1 Cc1cc(oc1)CN PB24200 [1,1,0,0,0,0|1,0,0]=3 148 B8R1.1 Cc1cc(on1)CCl AB42093 [1,1,0,0,0,0|2,0,0]=4 149 B8R1.1 Cc1cc(on1)CN AB28053 [1,1,0,0,0,0|2,0,0]=4 150 B8R1.1 Cc1cc(sc1)CCl AB72607 [1,1,0,0,0,0|1,1,0]=4 151 B8R1.1 Cc1cc(sc1)CN AB25763 [1,1,0,0,0,0|1,1,0]=4 152 B8R1.1 Cc1ccc(s1)CCl AB50993 [1,1,0,0,0,0|1,1,0]=4 153 B8R1.1 Cc1ccc(s1)CN AB07827 [1,1,0,0,0,0|1,1,0]=4 154 B8R1.1 Cc1cnc(o1)CO AB63479 [1,1,0,0,0,0|1,1,0]=4 155 B8R1.1 Cc1cnc(o1)NC AB65971 [1,1,0,0,0,0|2,0,0]=4 156 B8R1.1 Cc1coc(n1)CCl AB70149 [1,1,0,0,0,0|2,0,0]=4 157 B8R1.1 Cc1coc(n1)CN AB70147 [1,1,0,0,0,0|2,0,0]=4 158 B8R1.1 Cc1coc(n1)NC AB65967 [1,1,0,0,0,0|2,0,0]=4 159 B8R1.1 Cc1ncc(o1)CCl AB70153 [1,1,0,0,0,0|2,0,0]=4 160 B8R1.1 Cc1ncc(o1)CN AB64071 [1,1,0,0,0,0|2,0,0]=4 161 B8R1.1 c1c(csc1CN)Br PB27838 [1,1,0,0,0,0|1,1,0]=4 162 B8R1.1 c1c(csc1CN)Cl PB16734 [1,1,0,0,0,0|1,1,0]=4 163 B8R1.1 c1c(csc1CO)Br PB12803 [1,1,0,0,0,0|0,2,0]=4 164 B8R1.1 c1c(csc1CO)Cl PB24317 [1,1,0,0,0,0|0,2,0]=4 165 B8R1.1 c1c(onc1Br)CCl AB26702 [1,1,0,0,0,0|2,0,0]=4 166 B8R1.1 c1c(onc1Br)CN AB11464 [1,1,0,0,0,0|2,0,0]=4 167 B8R1.1 c1c(onc1O)CN MB00477 [1,1,0,0,0,0|2,0,0]=4 168 B8R1.1 c1cc(sc1CCl)Cl AB00990 [1,1,0,0,0,0|1,1,0]=4 169 B8R1.1 c1cc(sc1CN)Br PB24892 [1,1,0,0,0,0|1,1,0]=4 170 B8R1.1 c1cc(sc1CN)Cl PB22134 [1,1,0,0,0,0|1,1,0]=4 171 B8R1.1 c1cc(sc1CN)F PB33422 [1,1,0,0,0,0|1,1,0]=4 172 B8R1.1 c1cc(sc1CO)Br PB23435 [1,1,0,0,0,0|0,2,0]=4 173 B8R1.1 c1cc(sc1CO)Cl PB23436 [1,1,0,0,0,0|0,2,0]=4 174 B8R1.1 c1cc(sc1CO)F PB31763 [1,1,0,0,0,0|0,2,0]=4 175 B8R1.7 B(c1ccco1)(O)O AB07247 [1,1,0,0,0,0|1,1,0]=4 176 B8R1.7 CC(=O)c1ncco1 AB42105 [1,1,0,0,0,0|1,0,1]=4 177 B8R1.7 CC(c1ccno1)N AB27932 [1,1,0,0,0,0|1,0,0]=3 178 B8R1.7 CC(c1ccoc1)N AB27902 [1,1,0,0,0,0|2,0,0]=4 179 B8R1.7 CC(c1ccoc1)N AB66830 [1,1,0,0,0,0|2,0,0]=4 180 B8R1.7 CC(c1cscn1)N AB27900 [1,1,0,0,0,0|2,0,0]=4 181 B8R1.7 CC(c1nccs1)N AB12719 [1,1,0,0,0,0|1,1,0]=4 182 B8R1.7 C[C@@H](c1nccs1)N AB66719 [1,1,0,0,0,0|1,1,0]=4 183 B8R1.7 C[C@H](c1nccs1)N AB68275 [1,1,0,0,0,0|1,1,0]=4 184 B8R1.7 c1cc(oc1)C(=N)N AB07706 [1,1,0,0,0,0|1,0,1]=4 185 B8R1.7 c1coc(n1)C(Cl)Cl AB21330 [1,1,0,0,0,0|2,0,0]=4 186 B8R1.11 CCn1c(ccn1)N PB15601 [1,1,0,0,0,0|2,0,0]=4 187 B8R1.11 Cc1c(ocn1)CCl MB08890 [1,1,0,0,0,0|2,0,0]=4 188 B8R1.11 Cc1c(ocn1)CO MB03682 [1,1,0,0,0,0|1,1,0]=4 189 B8R1.11 c1coc(c1Br)C=O AB31934 [1,1,0,0,0,0|0,1,1]=4 190 B8R1.11 c1csc(c1Br)CN PB34113 [1,1,0,0,0,0|1,1,0]=4 191 B8R1.11 c1csc(c1Br)CO PB27714 [1,1,0,0,0,0|0,2,0]=4 192 B8R1.11 c1csc(c1Cl)CN PB11803 [1,1,0,0,0,0|1,1,0]=4 193 B8R1.11 c1csc(c1Cl)CO PB23440 [1,1,0,0,0,0|0,2,0]=4 194 B10R1.1 CCCc1ncc(cn1)Cl AB59170 [0,1,0,0,0,1|2,0,0]=4 195 B10R1.1 CNCc1ccc(cn1)Br AB49704 [0,1,0,0,0,1|2,0,0]=4 196 B10R1.1 CNCc1ccc(cn1)Cl AB67610 [0,1,0,0,0,1|2,0,0]=4 197 B10R1.1 CNCc1ccc(cn1)F AB67668 [0,1,0,0,0,1|2,0,0]=4 198 B10R1.1 CNCc1ccc(cn1)N AB67748 [0,1,0,0,0,1|2,0,0]=4 199 B10R1.1 CNCc1ccc(nc1)Br AB67269 [0,1,0,0,0,1|2,0,0]=4 200 B10R1.1 CNCc1ccc(nc1)Cl AB52618 [0,1,0,0,0,1|2,0,0]=4 201 B10R1.1 CNCc1ncc(cn1)Cl AB59174 [0,1,0,0,0,1|2,0,0]=4 202 B10R1.1 Cc1ccc(cn1)CNC AB63786 [0,1,0,0,0,1|2,0,0]=4 203 B10R1.1 Cc1ccc(nc1)CNC AB67504 [0,1,0,0,0,1|2,0,0]=4 204 B10R1.4 CNCc1c(cccn1)F PB12566 [0,1,0,0,0,1|2,0,0]=4 205 B10R1.4 CNCc1cccnc1Cl AB53845 [0,1,0,0,0,1|2,0,0]=4 206 B10R1.4 CNCc1cnccc1Br AB67968 [0,1,0,0,0,1|2,0,0]=4 207 B10R1.4 CNCc1cnccc1Cl AB67984 [0,1,0,0,0,1|2,0,0]=4 208 B10R1.4 CNCc1cnccc1F AB68060 [0,1,0,0,0,1|2,0,0]=4 209 B10R1.4 Cc1c(cccn1)CNC AB66889 [0,1,0,0,0,1|2,0,0]=4 210 B10R1.4 Cc1ccncc1CNC AB67828 [0,1,0,0,0,1|2,0,0]=4 211 B10R1.10 CCCc1cccc(n1)N AB03673 [0,1,0,0,0,1|2,0,0]=4 212 B10R1.10 CCCc1ccnc(c1)N AB03633 [0,1,0,0,0,1|2,0,0]=4 213 B10R1.10 CNCc1cc(ccn1)Br AB40680 [0,1,0,0,0,1|2,0,0]=4 214 B10R1.10 CNCc1cc(ccn1)Cl AB40676 [0,1,0,0,0,1|2,0,0]=4 215 B10R1.10 CNCc1cc(ccn1)F AB68057 [0,1,0,0,0,1|2,0,0]=4 216 B10R1.10 CNCc1cc(ccn1)N AB40666 [0,1,0,0,0,1|2,0,0]=4 217 B10R1.10 CNCc1cc(cnc1)Br AB41067 [0,1,0,0,0,1|2,0,0]=4 218 B10R1.10 CNCc1cc(cnc1)Cl AB67611 [0,1,0,0,0,1|2,0,0]=4 219 B10R1.10 CNCc1cc(cnc1)F AB67670 [0,1,0,0,0,1|2,0,0]=4 220 B10R1.10 CNCc1cc(cnc1)N AB67751 [0,1,0,0,0,1|2,0,0]=4 221 B10R1.10 CNCc1cccc(n1)Br AB48344 [0,1,0,0,0,1|2,0,0]=4 222 B10R1.10 CNCc1cccc(n1)Cl AB67315 [0,1,0,0,0,1|2,0,0]=4 223 B10R1.10 CNCc1cccc(n1)F AB72833 [0,1,0,0,0,1|2,0,0]=4 224 B10R1.10 CNCc1ccnc(c1)Br AB67272 [0,1,0,0,0,1|2,0,0]=4 225 B10R1.10 CNCc1ccnc(c1)Cl AB25401 [0,1,0,0,0,1|2,0,0]=4 226 B10R1.10 Cc1cc(ccn1)CNC AB53841 [0,1,0,0,0,1|2,0,0]=4 227 B10R1.10 Cc1cc(cnc1)CNC AB67507 [0,1,0,0,0,1|2,0,0]=4 228 B10R1.10 Cc1cccc(n1)CNC AB01381 [0,1,0,0,0,1|2,0,0]=4 229 B10R1.10 Cc1ccnc(c1)CNC AB52584 [0,1,0,0,0,1|2,0,0]=4 230 B10R1.15 CC(c1cccnc1)NC CB11165 [0,1,0,0,0,1|2,0,0]=4 231 B10R1.15 CCC(c1cnccn1)N PB31632 [0,1,0,0,0,1|2,0,0]=4 232 B10R1.17 CNCCc1cccnc1 AB10676 [0,1,0,0,0,1|2,0,0]=4 233 B10R1.17 CNCCc1ccncc1 AB02055 [0,1,0,0,0,1|2,0,0]=4 234 B10R1.17 c1cc(cnc1)CCCN AB54556 [0,1,0,0,0,1|2,0,0]=4 235 B10R1.17 c1ccc(cc1)CCCN AB00940 [0,1,0,0,0,1|2,0,0]=4 236 B10R1.17 c1ccnc(c1)CCCN AB30458 [0,1,0,0,0,1|2,0,0]=4 237 B10R1.17 c1ccnc(c1)CCCO PB12987 [0,1,0,0,0,1|2,0,0]=4 238 B10R1.17 c1cnccc1CCCN AB43583 [0,1,0,0,0,1|2,0,0]=4 239 B10R1.18 CC(=O)Cc1ccccn1 AB03323 [0,1,0,0,0,1|2,0,0]=4 240 B10R1.18 CC(=O)Cc1cccnc1 AB29343 [0,1,0,0,0,1|2,0,0]=4 241 B10R1.18 CC(=O)Cc1cccnc1 AB45525 [0,1,0,0,0,1|2,0,0]=4 242 B10R1.18 CC(=O)Cc1ncccn1 MB07248 [0,1,0,0,0,1|2,0,0]=4 243 B10R1.18 CC(Cc1ccccn1)N AB12969 [0,1,0,0,0,1|2,0,0]=4 244 B10R1.18 CC(Cc1cccnc1)N AB23775 [0,1,0,0,0,1|2,0,0]=4 245 B10R1.18 CC(Cc1ccncc1)N AB28531 [0,1,0,0,0,1|2,0,0]=4 246 B10R1.18 CC(Cc1cnccn1)N AB28467 [0,1,0,0,0,1|2,0,0]=4 247 B10R1.18 C[C@@H](Cc1ccccc1)N AB03711 [0,1,0,0,0,1|2,0,0]=4 248 B10R1.18 C[C@H](Cc1ccccc1)N AB07478 [0,1,0,0,0,1|2,0,0]=4 249 B10R1.16 Cc1cc(on1)CCCO CB10824 [0,2,0,0,0,0|2,0,0]=4 250 B10R1.54 Cc1ncc(o1)CC(=O)C AB44093 [0,2,0,0,0,0|2,0,0]=4 251 B10R1.11 c1cc(sc1)C(CCCl)O AB24970 [0,2,0,0,0,0|1,1,0]=4 252 B10R1.23 c1cc(oc1)C(C(=O)O)N AB01510 [0,2,0,0,0,0|2,0,0]=4 253 B10R1.23 c1cc(oc1)[C@@H](C(=O)O)N AB14778 [0,2,0,0,0,0|2,0,0]=4 254 B10R1.23 c1cc(oc1)[C@H](C(=O)O)N AB14775 [0,2,0,0,0,0|2,0,0]=4 255 B10R1.149 COC(=O)c1c(cco1)N PB25248 [0,2,0,0,0,0|0,1,1]=4 256 B10R1.281 CC(C)(Cc1ncco1)N AB77412 [0,2,0,0,0,0|2,0,0]=4 257 B8R1.5 Cc1c(cccn1)O PB18442 [0,0,1,1,0,0|2,0,0]=4 258 B8R1.4 Cc1cccc(n1)O AB00679 [0,0,1,1,0,0|2,0,0]=4 259 B10R2.6 c1cnc(nc1)C2CC2 PB25710 [0,0,0,1,0,1|2,0,0]=4 260 B10R2.7 c1c2c(ncn1)CNC2 PB18873 [0,0,0,1,0,1|2,0,0]=4 261 B10R2.7 c1cc2c(nc1)CNC2 PB30869 [0,0,0,1,0,1|2,0,0]=4 262 B10R2.7 c1ccc2c(c1)CNC2 MB01342 [0,0,0,1,0,1|2,0,0]=4 263 B10R2.7 c1cnc2c(n1)CNC2 AB65657 [0,0,0,1,0,1|2,0,0]=4 264 B10R2.7 c1cncc2c1CNC2 AB30511 [0,0,0,1,0,1|2,0,0]=4 265 B10R2.7 c1cncc2c1CNC2 PB24193 [0,0,0,1,0,1|2,0,0]=4 266 B10R2.2 C1Cc2c(oc(n2)N)C1 AB44260 [0,1,0,1,0,0|2,0,0]=4 267 B10R2.2 Cc1nc2c(o1)CNC2 AB27318 [0,1,0,1,0,0|2,0,0]=4 268 B10R2.32 C1c2c(onc2Br)CO1 AB84899 [0,1,0,1,0,0|1,1,0]=4