0 B11R1.509 CC(C)(C)Oc1cccnc1 MB01044 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.509 CC(C)(Cc1ccccc1)N AB02355 [0,0,0,0,0,0|1,0,0]=1 2 B11R1.509 CC(C)(Cc1ccccn1)N AB76319 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.509 CC(C)(Cc1cccnc1)N AB77415 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.509 CC(C)(Cc1ccncc1)N AB76603 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.509 CC(C)(Cc1ccncn1)N AB77438 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.509 CC(C)(Cc1cncnc1)N AB77449 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.509 CC(C)(Cc1ncccn1)N AB77436 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.509 [B-](Cc1ccccc1)(F)(F)F AB15065 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.18 B(Cc1ccccc1)(O)O AB08328 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.18 CC(=O)Cc1ccccn1 AB03323 [1,0,0,0,0,0|1,0,2]=4 11 B10R1.18 CC(=O)Cc1cccnc1 AB29343 [1,0,0,0,0,0|1,0,2]=4 12 B10R1.18 CC(=O)Cc1cccnc1 AB45525 [1,0,0,0,0,0|1,0,2]=4 13 B10R1.18 CC(C)Oc1ccccn1 AB63711 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.18 CC(Cc1ccccn1)N AB12969 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.18 CC(Cc1cccnc1)N AB23775 [1,0,0,0,0,0|2,0,0]=3 16 B10R1.18 CC(Cc1ccncc1)N AB28531 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.18 CC(Cc1cnccn1)N AB28467 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.18 C[C@@H](Cc1ccccc1)N AB03711 [1,0,0,0,0,0|1,0,0]=2 19 B10R1.18 C[C@H](Cc1ccccc1)N AB07478 [1,0,0,0,0,0|1,0,0]=2 20 B10R1.18 c1cc(cnc1)CC(=O)O AB01106 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.18 c1ccc(cc1)CC(=N)N AB29087 [1,0,0,0,0,0|2,0,1]=4 22 B12R1.106 CC(C)(C)Cc1ccc(cc1)O AB16670 [0,1,0,0,0,0|1,0,0]=2 23 B12R1.106 CC(C)(C)Cc1cnc(cn1)Br AB70171 [0,1,0,0,0,0|3,0,0]=4 24 B12R1.106 CC(C)(C)Oc1ccc(cn1)Br MB06466 [0,1,0,0,0,0|3,0,0]=4 25 B12R1.106 CC(C)(C)Oc1ccc(cn1)O MB25551 [0,1,0,0,0,0|3,0,0]=4 26 B12R1.106 CC(C)(C)Oc1ccc(nc1)Br MB09482 [0,1,0,0,0,0|3,0,0]=4 27 B12R1.106 CC(C)(C)Oc1ccc(nc1)Cl MB20018 [0,1,0,0,0,0|3,0,0]=4 28 B12R1.106 CC(C)(Cc1ccc(cc1)Br)N AB64460 [0,1,0,0,0,0|1,0,0]=2 29 B12R1.106 CC(C)(Cc1ccc(cc1)Cl)N AB02276 [0,1,0,0,0,0|1,0,0]=2 30 B12R1.106 CC(C)(Cc1ccc(cc1)F)N AB03122 [0,1,0,0,0,0|1,0,0]=2 31 B12R1.106 CC(C)(Cc1ccc(cc1)I)N AB68848 [0,1,0,0,0,0|1,0,0]=2 32 B12R1.106 CC(C)(Cc1ccc(cc1)N)N AB68843 [0,1,0,0,0,0|1,0,0]=2 33 B12R1.106 CC(C)(Cc1ccc(cc1)O)N AB07591 [0,1,0,0,0,0|1,0,0]=2 34 B12R1.106 CC(C)(Cc1ccc(nc1)Br)N AB77419 [0,1,0,0,0,0|2,0,0]=3 35 B12R1.106 CC(C)(Cc1ccc(nc1)Cl)N AB77417 [0,1,0,0,0,0|2,0,0]=3 36 B12R1.106 CC(C)(Cc1cnc(nc1)Cl)N AB77450 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.106 Cc1ccc(cc1)CC(C)(C)N AB54574 [0,1,0,0,0,0|1,0,0]=2 38 B12R1.106 c1cc(ccc1CC(F)(F)F)Br AB60688 [0,1,0,0,0,0|3,0,0]=4 39 B12R1.106 c1cc(ccc1CC(F)(F)F)I AB85130 [0,1,0,0,0,0|3,0,0]=4 40 B12R1.106 c1cc(ccc1CC(F)(F)F)N AB21252 [0,1,0,0,0,0|3,0,0]=4 41 B12R1.106 c1cc(ccc1CC(F)(F)F)O AB60686 [0,1,0,0,0,0|3,0,0]=4 42 B12R1.119 CC(C)(C)Oc1cc(ccn1)Br MB09487 [0,1,0,0,0,0|3,0,0]=4 43 B12R1.119 CC(C)(C)Oc1cc(ccn1)O MB22207 [0,1,0,0,0,0|3,0,0]=4 44 B12R1.119 CC(C)(C)Oc1cc(cnc1)Br MB13769 [0,1,0,0,0,0|3,0,0]=4 45 B12R1.119 CC(C)(C)Oc1cc(cnc1)Cl MB20017 [0,1,0,0,0,0|3,0,0]=4 46 B12R1.119 CC(C)(C)Oc1cc(cnc1)O MB22205 [0,1,0,0,0,0|3,0,0]=4 47 B12R1.119 CC(C)(C)Oc1cccc(c1)O MB22165 [0,1,0,0,0,0|2,0,0]=3 48 B12R1.119 CC(C)(C)Oc1cccc(n1)Br AB07413 [0,1,0,0,0,0|3,0,0]=4 49 B12R1.119 CC(C)(C)Oc1ccnc(c1)Cl MB13767 [0,1,0,0,0,0|3,0,0]=4 50 B12R1.119 CC(C)(Cc1cccc(c1)Br)N AB64464 [0,1,0,0,0,0|1,0,0]=2 51 B12R1.119 CC(C)(Cc1cccc(c1)Cl)N AB54586 [0,1,0,0,0,0|1,0,0]=2 52 B12R1.119 CC(C)(Cc1cccc(c1)F)N AB64463 [0,1,0,0,0,0|1,0,0]=2 53 B12R1.119 CC(C)(Cc1cccc(c1)I)N AB68849 [0,1,0,0,0,0|1,0,0]=2 54 B12R1.119 CC(C)(Cc1cccc(c1)N)N AB68844 [0,1,0,0,0,0|1,0,0]=2 55 B12R1.119 CC(C)(Cc1cccc(c1)O)N AB68838 [0,1,0,0,0,0|1,0,0]=2 56 B12R1.119 CC(C)(Cc1cccc(n1)Br)N AB77430 [0,1,0,0,0,0|2,0,0]=3 57 B12R1.119 CC(C)(Cc1cccc(n1)Cl)N AB77427 [0,1,0,0,0,0|2,0,0]=3 58 B12R1.119 CC(C)(Cc1ccnc(c1)Br)N AB77423 [0,1,0,0,0,0|2,0,0]=3 59 B12R1.119 CC(C)(Cc1ccnc(c1)Cl)N AB77422 [0,1,0,0,0,0|2,0,0]=3 60 B12R1.119 CC(C)(Cc1ccnc(n1)Cl)N AB77441 [0,1,0,0,0,0|3,0,0]=4 61 B12R1.119 Cc1cccc(c1)CC(C)(C)N AB54571 [0,1,0,0,0,0|1,0,0]=2 62 B12R1.119 c1cc(cc(c1)Br)CC(F)(F)F AB60687 [0,1,0,0,0,0|3,0,0]=4 63 B12R1.119 c1cc(cc(c1)I)CC(F)(F)F AB85133 [0,1,0,0,0,0|3,0,0]=4 64 B12R1.119 c1cc(cc(c1)N)CC(F)(F)F AB76462 [0,1,0,0,0,0|3,0,0]=4 65 B12R1.119 c1cc(cc(c1)O)CC(F)(F)F AB04490 [0,1,0,0,0,0|3,0,0]=4 66 B12R1.151 CC(C)(C)Oc1c(cccn1)O MB22208 [0,1,0,0,0,0|3,0,0]=4 67 B12R1.151 CC(C)(C)Oc1ccccc1O MB22200 [0,1,0,0,0,0|2,0,0]=3 68 B12R1.151 CC(C)(C)Oc1cccnc1Br MB20008 [0,1,0,0,0,0|3,0,0]=4 69 B12R1.151 CC(C)(C)Oc1cccnc1Cl MB20010 [0,1,0,0,0,0|3,0,0]=4 70 B12R1.151 CC(C)(C)Oc1ccncc1O MB22204 [0,1,0,0,0,0|3,0,0]=4 71 B12R1.151 CC(C)(C)Oc1cnccc1Br MB20009 [0,1,0,0,0,0|3,0,0]=4 72 B12R1.151 CC(C)(C)Oc1cnccc1Cl MB20014 [0,1,0,0,0,0|3,0,0]=4 73 B12R1.151 CC(C)(C)Oc1cnccc1O MB22206 [0,1,0,0,0,0|3,0,0]=4 74 B12R1.151 CC(C)(C)Sc1cccnc1N PB18676 [0,1,0,0,0,0|3,0,0]=4 75 B12R1.151 CC(C)(C)Sc1cnccc1N AB25863 [0,1,0,0,0,0|3,0,0]=4 76 B12R1.151 CC(C)(Cc1ccccc1Br)N AB64466 [0,1,0,0,0,0|1,0,0]=2 77 B12R1.151 CC(C)(Cc1ccccc1Cl)N AB07476 [0,1,0,0,0,0|1,0,0]=2 78 B12R1.151 CC(C)(Cc1ccccc1F)N AB54578 [0,1,0,0,0,0|1,0,0]=2 79 B12R1.151 CC(C)(Cc1ccccc1N)N AB68846 [0,1,0,0,0,0|1,0,0]=2 80 B12R1.151 c1ccc(c(c1)CC(F)(F)F)Br AB55785 [0,1,0,0,0,0|3,0,0]=4 81 B12R1.151 c1ccc(c(c1)CC(F)(F)F)I AB56086 [0,1,0,0,0,0|3,0,0]=4 82 B12R1.151 c1ccc(c(c1)CC(F)(F)F)N AB76414 [0,1,0,0,0,0|3,0,0]=4 83 B12R1.564 c1ccc(cc1)C(C(F)(F)F)N AB07860 [0,1,0,0,0,0|3,0,0]=4 84 B12R1.564 c1ccc(cc1)[C@@H](C(F)(F)F)N AB27669 [0,1,0,0,0,0|3,0,0]=4 85 B12R1.564 c1ccc(cc1)[C@H](C(F)(F)F)N AB27666 [0,1,0,0,0,0|3,0,0]=4 86 B12R2.95 CC1(Cc2ccccc2N1)C AB70011 [0,0,0,1,0,0|1,0,0]=2 87 B10R1.28 CC(C)(C)c1ccccn1 CB10120 [0,0,0,0,1,0|2,0,0]=3 88 B10R1.28 CC(C)(c1ccccn1)N AB48746 [0,0,0,0,1,0|2,0,0]=3 89 B10R1.28 CC(C)(c1cccnc1)N AB48740 [0,0,0,0,1,0|2,0,0]=3 90 B10R1.28 CC(C)(c1ccncc1)N AB48742 [0,0,0,0,1,0|2,0,0]=3 91 B10R1.281 CC(C)(Cc1[nH]ccn1)N AB77403 [0,0,0,0,1,0|3,0,0]=4 92 B10R1.281 CC(C)(Cc1ncco1)N AB77412 [0,0,0,0,1,0|3,0,0]=4 93 B10R1.281 CC(C)(Cc1nccs1)N AB54597 [0,0,0,0,1,0|3,0,0]=4 94 B12R1.891 CC(C)(CCc1ccccc1)N AB03652 [0,0,0,0,0,1|1,0,0]=2 95 B9R1.8 CNCc1ccccn1 AB10674 [2,0,0,0,0,0|2,0,0]=4 96 B9R1.8 CNCc1cccnc1 AB01384 [2,0,0,0,0,0|2,0,0]=4 97 B9R1.8 CNCc1ccncc1 AB02721 [2,0,0,0,0,0|2,0,0]=4 98 B9R1.8 c1cc(cnc1)CCN AB04606 [2,0,0,0,0,0|2,0,0]=4 99 B9R1.8 c1ccc(cc1)\C=N/O AB02488 [2,0,0,0,0,0|1,0,1]=4 100 B9R1.8 c1ccnc(c1)CCN AB00732 [2,0,0,0,0,0|2,0,0]=4 101 B9R1.8 c1cnccc1CCN AB01702 [2,0,0,0,0,0|2,0,0]=4 102 B11R1.20 CC(C)Cc1cnc(cn1)Br AB72274 [1,1,0,0,0,0|2,0,0]=4 103 B11R1.20 CC(C)Cc1cnc(cn1)Cl AB73109 [1,1,0,0,0,0|2,0,0]=4 104 B11R1.20 CC(C)Cc1cnc(cn1)N AB60522 [1,1,0,0,0,0|2,0,0]=4 105 B11R1.20 CC(C)Cc1cnc(nc1)N AB60175 [1,1,0,0,0,0|2,0,0]=4 106 B11R1.20 CC(C)Cc1ncc(cn1)N AB58993 [1,1,0,0,0,0|2,0,0]=4 107 B11R1.20 CC(C)Oc1ccc(cc1)O MB06553 [1,1,0,0,0,0|1,0,0]=3 108 B11R1.20 CC(C)Oc1ccc(cn1)Br MB04495 [1,1,0,0,0,0|2,0,0]=4 109 B11R1.20 CC(C)Oc1ccc(cn1)N AB40632 [1,1,0,0,0,0|2,0,0]=4 110 B11R1.20 CC(C)Oc1ccc(cn1)O MB23136 [1,1,0,0,0,0|2,0,0]=4 111 B11R1.20 CC(C)Oc1ccc(nc1)Br MB13762 [1,1,0,0,0,0|2,0,0]=4 112 B11R1.20 CC(Cc1ccc(cc1)Br)N MB00407 [1,1,0,0,0,0|1,0,0]=3 113 B11R1.20 CC(Cc1ccc(cc1)Cl)N MB01958 [1,1,0,0,0,0|1,0,0]=3 114 B11R1.20 CN(C)Cc1ccc(cc1)Br AB01531 [1,1,0,0,0,0|1,0,0]=3 115 B11R1.20 CN(C)Cc1ccc(cc1)N AB01571 [1,1,0,0,0,0|1,0,0]=3 116 B11R1.20 C[C@@H](Cc1ccc(cc1)Br)N AB76442 [1,1,0,0,0,0|1,0,0]=3 117 B11R1.20 C[C@@H](Cc1ccc(cc1)F)N AB76433 [1,1,0,0,0,0|1,0,0]=3 118 B11R1.20 C[C@H](Cc1ccc(cc1)Br)N AB76429 [1,1,0,0,0,0|1,0,0]=3 119 B11R1.20 C[C@H](Cc1ccc(cc1)F)N AB76425 [1,1,0,0,0,0|1,0,0]=3 120 B11R1.20 Cc1ccc(cc1)CC(C)N MB01961 [1,1,0,0,0,0|1,0,0]=3 121 B11R1.20 c1cc(ccc1CC(=O)O)Br AB00367 [1,1,0,0,0,0|1,0,1]=4 122 B11R1.36 c1ccc(cc1)C(C(F)F)N AB28541 [1,1,0,0,0,0|2,0,0]=4 123 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)N AB02597 [1,1,0,0,0,0|1,0,1]=4 124 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)N AB00920 [1,1,0,0,0,0|1,0,1]=4 125 B11R1.40 CC(CN)Oc1ccccc1 AB03575 [1,1,0,0,0,0|1,0,0]=3 126 B11R1.40 CC(CN)Oc1cccnc1 AB16397 [1,1,0,0,0,0|2,0,0]=4 127 B11R1.40 CC(CN)Oc1ccncc1 AB38917 [1,1,0,0,0,0|2,0,0]=4 128 B11R1.40 CC(Cc1ccccc1)CN CB11363 [1,1,0,0,0,0|0,0,0]=2 129 B11R1.40 COC(=N)Cc1ccccc1 AB01554 [1,1,0,0,0,0|1,0,1]=4 130 B11R1.40 c1ccc(cc1)CC(CF)N AB14681 [1,1,0,0,0,0|1,0,0]=3 131 B11R1.40 c1ccc(cc1)CC(CN)N AB65391 [1,1,0,0,0,0|1,0,0]=3 132 B11R1.40 c1ccc(cc1)C[C@@H](CN)N AB70797 [1,1,0,0,0,0|1,0,0]=3 133 B11R1.40 c1ccc(cc1)C[C@H](CN)N AB14684 [1,1,0,0,0,0|1,0,0]=3 134 B11R1.40 c1ccc(cc1)C[C@H](CO)N AB02579 [1,1,0,0,0,0|1,0,0]=3 135 B11R1.86 CC(C)Oc1c(cccn1)I AB25867 [1,1,0,0,0,0|2,0,0]=4 136 B11R1.86 CC(C)Oc1c(cccn1)O MB23249 [1,1,0,0,0,0|2,0,0]=4 137 B11R1.86 CC(C)Oc1ccncc1O MB23246 [1,1,0,0,0,0|2,0,0]=4 138 B11R1.86 CC(C)Oc1cnccc1O MB23247 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.86 CC(Cc1ccccc1Br)N MB08211 [1,1,0,0,0,0|1,0,0]=3 140 B11R1.86 CC(Cc1ccccc1Cl)N MB06204 [1,1,0,0,0,0|1,0,0]=3 141 B11R1.86 CN(C)Cc1ccccc1Br AB01037 [1,1,0,0,0,0|1,0,0]=3 142 B11R1.86 CN(C)Cc1ccccc1N AB01574 [1,1,0,0,0,0|1,0,0]=3 143 B11R1.86 Cc1ccccc1CC(C)N MB01550 [1,1,0,0,0,0|1,0,0]=3 144 B11R1.86 c1ccc(c(c1)CC(=O)O)N AB15776 [1,1,0,0,0,0|1,0,1]=4 145 B11R1.157 CC(C)Nc1cc(ccn1)Br MB13934 [1,1,0,0,0,0|2,0,0]=4 146 B11R1.157 CC(C)Oc1cc(ccn1)Br MB10313 [1,1,0,0,0,0|2,0,0]=4 147 B11R1.157 CC(C)Oc1cc(ccn1)O MB23248 [1,1,0,0,0,0|2,0,0]=4 148 B11R1.157 CC(C)Oc1cc(cnc1)Br MB14161 [1,1,0,0,0,0|2,0,0]=4 149 B11R1.157 CC(C)Oc1cc(cnc1)O MB14428 [1,1,0,0,0,0|2,0,0]=4 150 B11R1.157 CC(C)Oc1cccc(c1)O MB09279 [1,1,0,0,0,0|1,0,0]=3 151 B11R1.157 CC(C)Oc1cccc(n1)Br AB54102 [1,1,0,0,0,0|2,0,0]=4 152 B11R1.157 CC(C)Oc1ccnc(c1)Cl MB13766 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.157 CC(Cc1cccc(c1)Br)N MB06206 [1,1,0,0,0,0|1,0,0]=3 154 B11R1.157 CC(Cc1cccc(c1)Cl)N MB06208 [1,1,0,0,0,0|1,0,0]=3 155 B11R1.157 CN(C)Cc1cccc(c1)Br AB20761 [1,1,0,0,0,0|1,0,0]=3 156 B11R1.157 CN(C)Cc1cccc(c1)N AB01577 [1,1,0,0,0,0|1,0,0]=3 157 B11R1.157 C[C@@H](Cc1cccc(c1)Br)N AB76444 [1,1,0,0,0,0|1,0,0]=3 158 B11R1.157 C[C@@H](Cc1cccc(c1)F)N AB76436 [1,1,0,0,0,0|1,0,0]=3 159 B11R1.157 C[C@H](Cc1cccc(c1)Br)N AB76430 [1,1,0,0,0,0|1,0,0]=3 160 B11R1.157 Cc1cccc(c1)CC(C)N MB05181 [1,1,0,0,0,0|1,0,0]=3 161 B11R1.157 c1cc(cc(c1)Br)CC(=O)O AB00359 [1,1,0,0,0,0|1,0,1]=4 162 B11R1.157 c1cc(cc(c1)Cl)CC(=O)O AB00363 [1,1,0,0,0,0|1,0,1]=4 163 B11R1.157 c1cc(cc(c1)F)CC(=O)O AB00361 [1,1,0,0,0,0|1,0,1]=4 164 B11R1.7 CC(C)(CN)c1ccccc1 CB10869 [0,1,0,0,1,0|1,0,0]=3 165 B11R1.7 CC(C)(CN)c1ccccn1 AB63159 [0,1,0,0,1,0|2,0,0]=4 166 B11R1.7 CC(C)(CN)c1cccnc1 AB65048 [0,1,0,0,1,0|2,0,0]=4 167 B11R1.7 CC(C)(CN)c1ccncc1 AB65050 [0,1,0,0,1,0|2,0,0]=4 168 B11R1.7 CC(CN)(c1ccccc1)O AB18534 [0,1,0,0,1,0|0,0,0]=2 169 B11R1.7 CC(CN)(c1ccccc1)O AB31018 [0,1,0,0,1,0|0,0,0]=2 170 B11R1.7 c1ccc(cc1)C(CN)(F)F AB63157 [0,1,0,0,1,0|2,0,0]=4 171 B11R1.19 CC(C)(C)c1ccc(cn1)Br MB10118 [0,1,0,0,1,0|2,0,0]=4 172 B11R1.19 CC(C)(C)c1ccc(cn1)Cl AB71814 [0,1,0,0,1,0|2,0,0]=4 173 B11R1.19 CC(C)(C)c1ccc(cn1)O MB11628 [0,1,0,0,1,0|2,0,0]=4 174 B11R1.19 CC(C)(C)c1ccc(nc1)Br MB10299 [0,1,0,0,1,0|2,0,0]=4 175 B11R1.19 CC(C)(c1ccc(cc1)Br)N AB29702 [0,1,0,0,1,0|1,0,0]=3 176 B11R1.19 CC(C)(c1ccc(cc1)Cl)N AB45929 [0,1,0,0,1,0|1,0,0]=3 177 B11R1.19 CC(C)(c1ccc(cc1)F)N AB42400 [0,1,0,0,1,0|1,0,0]=3 178 B11R1.19 CC(C)(c1ccc(nc1)Cl)N AB67365 [0,1,0,0,1,0|2,0,0]=4 179 B11R1.19 Cc1ccc(cc1)C(C)(C)N AB45930 [0,1,0,0,1,0|1,0,0]=3 180 B11R1.19 Cc1ccc(cn1)C(C)(C)N AB66958 [0,1,0,0,1,0|2,0,0]=4 181 B11R1.87 CC(C)(C)c1c(cccn1)O MB01150 [0,1,0,0,1,0|2,0,0]=4 182 B11R1.87 CC(C)(C)c1ccccc1N MB00719 [0,1,0,0,1,0|1,0,0]=3 183 B11R1.87 CC(C)(C)c1ccncc1O MB21867 [0,1,0,0,1,0|2,0,0]=4 184 B11R1.87 CC(C)(C)c1cnccc1O MB21874 [0,1,0,0,1,0|2,0,0]=4 185 B11R1.87 CC(C)(c1ccccc1Br)N AB63424 [0,1,0,0,1,0|1,0,0]=3 186 B11R1.87 CC(C)(c1ccccc1Cl)N AB64318 [0,1,0,0,1,0|1,0,0]=3 187 B11R1.87 CC(C)(c1cccnc1Cl)N AB67370 [0,1,0,0,1,0|2,0,0]=4 188 B11R1.87 C[Si](C)(C)c1ccccc1O AB54787 [0,1,0,0,1,0|1,1,0]=4 189 B11R1.87 Cc1c(cccn1)C(C)(C)N AB66961 [0,1,0,0,1,0|2,0,0]=4 190 B11R1.155 CC(C)(C)c1cc(ccn1)N AB09613 [0,1,0,0,1,0|2,0,0]=4 191 B11R1.155 CC(C)(C)c1cc(ccn1)O MB14971 [0,1,0,0,1,0|2,0,0]=4 192 B11R1.155 CC(C)(C)c1cc(cnc1)Br MB14165 [0,1,0,0,1,0|2,0,0]=4 193 B11R1.155 CC(C)(C)c1cc(cnc1)O MB21871 [0,1,0,0,1,0|2,0,0]=4 194 B11R1.155 CC(C)(C)c1cccc(n1)Br AB50812 [0,1,0,0,1,0|2,0,0]=4 195 B11R1.155 CC(C)(C)c1ccnc(c1)Br AB63997 [0,1,0,0,1,0|2,0,0]=4 196 B11R1.155 CC(C)(C)c1ccnc(c1)Cl AB65343 [0,1,0,0,1,0|2,0,0]=4 197 B11R1.155 CC(C)(C)c1ccnc(c1)N AB45314 [0,1,0,0,1,0|2,0,0]=4 198 B11R1.155 CC(C)(c1cc(cnc1)Br)N PB25668 [0,1,0,0,1,0|2,0,0]=4 199 B11R1.155 CC(C)(c1cccc(c1)Br)N AB63427 [0,1,0,0,1,0|1,0,0]=3 200 B11R1.155 CC(C)(c1cccc(c1)Cl)N AB54659 [0,1,0,0,1,0|1,0,0]=3 201 B11R1.155 CC(C)(c1cccc(c1)F)N AB64314 [0,1,0,0,1,0|1,0,0]=3 202 B11R1.155 CC(C)(c1cccc(n1)Cl)N AB67363 [0,1,0,0,1,0|2,0,0]=4 203 B11R1.155 CC(C)(c1ccnc(c1)Cl)N AB67368 [0,1,0,0,1,0|2,0,0]=4 204 B11R1.155 Cc1cc(ccn1)C(C)(C)N AB66959 [0,1,0,0,1,0|2,0,0]=4 205 B11R1.155 Cc1cccc(c1)C(C)(C)N AB51569 [0,1,0,0,1,0|1,0,0]=3 206 B11R1.155 Cc1cccc(n1)C(C)(C)N AB66956 [0,1,0,0,1,0|2,0,0]=4 207 B13R1.512 CC(C)(CCc1ccc(cc1)Cl)N AB68859 [0,1,0,0,0,1|1,0,0]=3 208 B13R1.512 CC(C)(CCc1ccc(cc1)F)N AB68856 [0,1,0,0,0,1|1,0,0]=3 209 B13R1.4 CC(C)(C)Oc1ccc(cc1)C#N AB14659 [0,2,0,0,0,0|2,0,0]=4 210 B13R1.4 CC(C)(C)Oc1ccc(cc1)CN AB23467 [0,2,0,0,0,0|2,0,0]=4 211 B13R1.4 CC(C)(C)Oc1ccc(cc1)CO AB03109 [0,2,0,0,0,0|2,0,0]=4 212 B13R1.4 CC(C)(Cc1ccc(cc1)OC)N AB54584 [0,2,0,0,0,0|1,0,0]=3 213 B13R1.4 CC(C)(Cc1ccc(nc1)OC)N AB77421 [0,2,0,0,0,0|2,0,0]=4 214 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Br)O MB22094 [0,2,0,0,0,0|2,0,0]=4 215 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Cl)O MB22098 [0,2,0,0,0,0|2,0,0]=4 216 B13R1.518 CC(C)(C)Oc1ccc(c(c1)F)O MB22086 [0,2,0,0,0,0|2,0,0]=4 217 B13R1.518 CC(C)(C)Oc1ccc(c(c1)I)O MB22088 [0,2,0,0,0,0|2,0,0]=4 218 B13R1.518 CC(C)(C)Oc1ccc(c(c1)N)O MB22091 [0,2,0,0,0,0|2,0,0]=4 219 B13R1.518 CC(C)(C)Oc1ccc(c(c1)O)Br MB22132 [0,2,0,0,0,0|2,0,0]=4 220 B13R1.518 CC(C)(C)Oc1ccc(c(c1)O)Cl MB22136 [0,2,0,0,0,0|2,0,0]=4 221 B13R1.518 CC(C)(C)Oc1ccc(c(c1)O)F MB22046 [0,2,0,0,0,0|2,0,0]=4 222 B13R1.518 CC(C)(C)Oc1ccc(c(c1)O)I MB22052 [0,2,0,0,0,0|2,0,0]=4 223 B13R1.518 CC(C)(C)Oc1ccc(c(c1)O)N MB22055 [0,2,0,0,0,0|2,0,0]=4 224 B13R1.518 CC(C)(Cc1ccc(c(c1)Cl)Cl)N AB68839 [0,2,0,0,0,0|1,0,0]=3 225 B13R1.518 CC(C)(Cc1ccc(c(c1)F)F)N AB68840 [0,2,0,0,0,0|1,0,0]=3 226 B13R1.518 Cc1cc(ccc1O)OC(C)(C)C MB22063 [0,2,0,0,0,0|2,0,0]=4 227 B13R1.518 Cc1ccc(cc1O)OC(C)(C)C MB23467 [0,2,0,0,0,0|2,0,0]=4 228 B13R1.883 CC(C)(C)Oc1ccc(cc1Br)O MB22124 [0,2,0,0,0,0|2,0,0]=4 229 B13R1.883 CC(C)(C)Oc1ccc(cc1Cl)O MB22126 [0,2,0,0,0,0|2,0,0]=4 230 B13R1.883 CC(C)(C)Oc1ccc(cc1F)O MB22109 [0,2,0,0,0,0|2,0,0]=4 231 B13R1.883 CC(C)(C)Oc1ccc(cc1I)O MB22112 [0,2,0,0,0,0|2,0,0]=4 232 B13R1.883 CC(C)(C)Oc1ccc(cc1N)O MB22113 [0,2,0,0,0,0|2,0,0]=4 233 B13R1.883 CC(C)(C)Oc1ccc(cc1O)Br MB22133 [0,2,0,0,0,0|2,0,0]=4 234 B13R1.883 CC(C)(C)Oc1ccc(cc1O)Cl MB22137 [0,2,0,0,0,0|2,0,0]=4 235 B13R1.883 CC(C)(C)Oc1ccc(cc1O)F MB22048 [0,2,0,0,0,0|2,0,0]=4 236 B13R1.883 CC(C)(C)Oc1ccc(cc1O)I MB22053 [0,2,0,0,0,0|2,0,0]=4 237 B13R1.883 CC(C)(C)Oc1ccc(cc1O)N MB22059 [0,2,0,0,0,0|2,0,0]=4 238 B13R1.883 Cc1cc(ccc1OC(C)(C)C)O MB22099 [0,2,0,0,0,0|2,0,0]=4 239 B13R1.883 Cc1ccc(c(c1)O)OC(C)(C)C MB23463 [0,2,0,0,0,0|2,0,0]=4 240 B13R1.80 CC(C)(C)Oc1cccc(c1)C=O AB11681 [0,2,0,0,0,0|2,0,0]=4 241 B13R1.80 CC(C)(C)Oc1cccc(c1)CBr AB20242 [0,2,0,0,0,0|2,0,0]=4 242 B13R1.80 CC(C)(C)Oc1cccc(c1)CO AB11685 [0,2,0,0,0,0|2,0,0]=4 243 B13R1.80 CC(C)(Cc1cccc(c1)OC)N AB54582 [0,2,0,0,0,0|1,0,0]=3 244 B13R1.80 CC(C)(Cc1cccc(n1)OC)N AB77433 [0,2,0,0,0,0|2,0,0]=4 245 B13R1.80 CC(C)(Cc1ccnc(c1)OC)N AB77426 [0,2,0,0,0,0|2,0,0]=4 246 B13R1.151 CC(C)(C)Oc1cccc(c1Br)O MB22190 [0,2,0,0,0,0|2,0,0]=4 247 B13R1.151 CC(C)(C)Oc1cccc(c1Cl)O MB22193 [0,2,0,0,0,0|2,0,0]=4 248 B13R1.151 CC(C)(C)Oc1cccc(c1F)O MB22177 [0,2,0,0,0,0|2,0,0]=4 249 B13R1.151 CC(C)(C)Oc1cccc(c1I)O MB22181 [0,2,0,0,0,0|2,0,0]=4 250 B13R1.151 CC(C)(C)Oc1cccc(c1N)O MB22185 [0,2,0,0,0,0|2,0,0]=4 251 B13R1.151 CC(C)(C)Oc1cccc(c1O)Br MB22198 [0,2,0,0,0,0|2,0,0]=4 252 B13R1.151 CC(C)(C)Oc1cccc(c1O)Cl MB22199 [0,2,0,0,0,0|2,0,0]=4 253 B13R1.151 CC(C)(C)Oc1cccc(c1O)F MB22154 [0,2,0,0,0,0|2,0,0]=4 254 B13R1.151 CC(C)(C)Oc1cccc(c1O)I MB22158 [0,2,0,0,0,0|2,0,0]=4 255 B13R1.151 CC(C)(C)Oc1cccc(c1O)N MB22162 [0,2,0,0,0,0|2,0,0]=4 256 B13R1.151 Cc1c(cccc1OC(C)(C)C)O MB22166 [0,2,0,0,0,0|2,0,0]=4 257 B13R1.151 Cc1cccc(c1O)OC(C)(C)C MB23507 [0,2,0,0,0,0|2,0,0]=4 258 B13R1.894 CC(C)(C)Oc1cc(ccc1Br)O MB22009 [0,2,0,0,0,0|2,0,0]=4 259 B13R1.894 CC(C)(C)Oc1cc(ccc1Cl)O MB22010 [0,2,0,0,0,0|2,0,0]=4 260 B13R1.894 CC(C)(C)Oc1cc(ccc1F)O MB22001 [0,2,0,0,0,0|2,0,0]=4 261 B13R1.894 CC(C)(C)Oc1cc(ccc1I)O MB22002 [0,2,0,0,0,0|2,0,0]=4 262 B13R1.894 CC(C)(C)Oc1cc(ccc1N)O MB22006 [0,2,0,0,0,0|2,0,0]=4 263 B13R1.894 CC(C)(C)Oc1cc(ccc1O)Br MB22014 [0,2,0,0,0,0|2,0,0]=4 264 B13R1.894 CC(C)(C)Oc1cc(ccc1O)Cl MB22015 [0,2,0,0,0,0|2,0,0]=4 265 B13R1.894 CC(C)(C)Oc1cc(ccc1O)F MB21959 [0,2,0,0,0,0|2,0,0]=4 266 B13R1.894 CC(C)(C)Oc1cc(ccc1O)I MB21960 [0,2,0,0,0,0|2,0,0]=4 267 B13R1.894 CC(C)(C)Oc1cc(ccc1O)N MB21962 [0,2,0,0,0,0|2,0,0]=4 268 B13R1.894 Cc1ccc(c(c1)OC(C)(C)C)O MB23439 [0,2,0,0,0,0|2,0,0]=4 269 B13R1.894 Cc1ccc(cc1OC(C)(C)C)O MB21993 [0,2,0,0,0,0|2,0,0]=4 270 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)Br)O MB21989 [0,2,0,0,0,0|2,0,0]=4 271 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)Cl)O MB21991 [0,2,0,0,0,0|2,0,0]=4 272 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)F)O MB21986 [0,2,0,0,0,0|2,0,0]=4 273 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)I)O MB21988 [0,2,0,0,0,0|2,0,0]=4 274 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)O)N MB21961 [0,2,0,0,0,0|2,0,0]=4 275 B13R1.3421 Cc1cc(cc(c1)OC(C)(C)C)O MB23380 [0,2,0,0,0,0|2,0,0]=4 276 B13R1.622 CC(C)(C)Oc1ccccc1C#N AB14655 [0,2,0,0,0,0|2,0,0]=4 277 B13R1.622 CC(C)(C)Oc1ccccc1C=O AB11684 [0,2,0,0,0,0|2,0,0]=4 278 B13R1.3788 CC(C)(C)Oc1c(cccc1Br)O MB21931 [0,2,0,0,0,0|2,0,0]=4 279 B13R1.3788 CC(C)(C)Oc1c(cccc1Cl)O MB21935 [0,2,0,0,0,0|2,0,0]=4 280 B13R1.3788 CC(C)(C)Oc1c(cccc1F)O MB21920 [0,2,0,0,0,0|2,0,0]=4 281 B13R1.3788 CC(C)(C)Oc1c(cccc1I)O MB21922 [0,2,0,0,0,0|2,0,0]=4 282 B13R1.3788 CC(C)(C)Oc1c(cccc1O)N MB21909 [0,2,0,0,0,0|2,0,0]=4 283 B13R1.3788 Cc1cccc(c1OC(C)(C)C)O MB23498 [0,2,0,0,0,0|2,0,0]=4 284 B13R1.1073 CC(Cc1ccccc1)(C(=O)O)N AB01038 [0,2,0,0,0,0|1,0,0]=3 285 B13R1.1073 C[C@@](Cc1ccccc1)(C(=O)O)N AB04114 [0,2,0,0,0,0|1,0,0]=3 286 B13R1.1073 C[C@](Cc1ccccc1)(C(=O)O)N AB03937 [0,2,0,0,0,0|1,0,0]=3 287 B11R2.4 c1ccc(cc1)C2CC2N AB00325 [1,0,0,1,0,0|1,0,0]=3 288 B11R2.10 c1ccc2c(c1)CC(C2)Br MB05045 [1,0,0,1,0,0|1,0,0]=3 289 B11R2.10 c1ccc2c(c1)CC(C2)N AB03106 [1,0,0,1,0,0|1,0,0]=3 290 B11R2.10 c1ccc2c(c1)CN(C2)N MB09229 [1,0,0,1,0,0|2,0,0]=4 291 B11R2.238 c1cc(cnc1)OC2CC2 MB19977 [1,0,0,1,0,0|2,0,0]=4 292 B11R2.238 c1ccnc(c1)OC2CC2 MB19961 [1,0,0,1,0,0|2,0,0]=4 293 B11R2.238 c1cnccc1OC2CC2 MB19994 [1,0,0,1,0,0|2,0,0]=4 294 B11R2.40 c1cc(cnc1)C2(CC2)N AB43088 [0,0,0,1,1,0|2,0,0]=4 295 B11R2.40 c1ccc(cc1)C2(CC2)N AB22505 [0,0,0,1,1,0|1,0,0]=3 296 B11R2.40 c1ccnc(c1)C2(CC2)N AB43090 [0,0,0,1,1,0|2,0,0]=4 297 B11R2.40 c1cnccc1C2(CC2)N AB55046 [0,0,0,1,1,0|2,0,0]=4 298 B13R2.222 CC1(CNc2c(cccn2)O1)C AB70680 [0,0,0,1,0,1|1,0,0]=3 299 B13R2.222 CC1(CNc2ccccc2O1)C AB64324 [0,0,0,1,0,1|0,0,0]=2 300 B13R2.222 CC1(COc2ccccc2N1)C AB72712 [0,0,0,1,0,1|1,0,0]=3 301 B13R2.3203 c1ccc(cc1)OCC2(CC2)N MB09044 [0,0,0,1,0,1|1,0,0]=3 302 B13R2.2988 c1cc(ccc1C2CC2(F)F)Br AB85398 [0,1,0,1,0,0|2,0,0]=4 303 B13R2.3051 CC1(Cc2cc(ccc2O1)Br)C AB66615 [0,1,0,1,0,0|0,0,0]=2 304 B13R2.3051 CC1(Cc2ccc(cc2O1)Br)C AB72242 [0,1,0,1,0,0|0,0,0]=2 305 B13R2.3020 c1cc(cc(c1)Br)C2CC2(F)F AB85396 [0,1,0,1,0,0|2,0,0]=4 306 B13R2.4826 CC1(Cc2c(cccc2Br)O1)C AB72241 [0,1,0,1,0,0|0,0,0]=2 307 B13R2.4826 CC1(Cc2cccc(c2O1)Br)C AB64871 [0,1,0,1,0,0|0,0,0]=2 308 B9R1.6 CC(C)c1ccccn1 PB21659 [1,0,0,0,1,0|1,0,0]=3 309 B9R1.6 CC(c1ccccc1)Cl AB01249 [1,0,0,0,1,0|1,0,0]=3 310 B9R1.6 CC(c1ccccn1)N AB21604 [1,0,0,0,1,0|2,0,0]=4 311 B9R1.6 CC(c1cccnc1)N AB09764 [1,0,0,0,1,0|2,0,0]=4 312 B9R1.6 CC(c1ccncc1)N AB11609 [1,0,0,0,1,0|2,0,0]=4 313 B9R1.6 C[C@@H](c1cccnc1)N AB49737 [1,0,0,0,1,0|2,0,0]=4 314 B9R1.6 C[C@@H](c1ccncc1)N AB49749 [1,0,0,0,1,0|2,0,0]=4 315 B9R1.6 C[C@H](c1cccnc1)N AB49734 [1,0,0,0,1,0|2,0,0]=4 316 B9R1.6 C[C@H](c1ccncc1)N AB49745 [1,0,0,0,1,0|2,0,0]=4 317 B11R1.91 B(CCc1ccccc1)(O)O AB09361 [1,0,0,0,0,1|2,0,0]=4 318 B13R1.3523 CC(C)(COCc1ccccc1)O AB84932 [0,0,0,0,0,2|0,0,0]=2 319 B13R1.3523 C[Si](C)(C)CNCc1ccccc1 AB01086 [0,0,0,0,0,2|1,1,0]=4