0 B10R2.6 C1=C(C2CO2)CCCO1 Amb33415705 [0,0,0,0,0,0|1,0,3]=4 1 B10R2.6 C1=C([C@@H]2CO2)CCCO1 Amb33319594 [0,0,0,0,0,0|1,0,3]=4 2 B10R2.6 C1=C([C@H]2CO2)CCCO1 Amb33319595 [0,0,0,0,0,0|1,0,3]=4 3 B10R2.6 C1=CCC(C2CO2)CC1 Amb26417977 [0,0,0,0,0,0|0,0,4]=4 4 B10R2.6 C1=CCC([C@@H]2CO2)CC1 Amb33318586 [0,0,0,0,0,0|0,0,4]=4 5 B10R2.6 C1=CCC([C@H]2CO2)CC1 Amb33318606 [0,0,0,0,0,0|0,0,4]=4 6 B10R2.6 c1cc(C2CC2)ccn1 Amb2694200 [0,0,0,0,0,0|2,0,0]=2 7 B10R2.6 c1cc(C2CC2)ccn1 Amb31188309 [0,0,0,0,0,0|2,0,0]=2 8 B10R2.6 c1cc(C2CC2)ncn1 Amb24091440 [0,0,0,0,0,0|3,0,0]=3 9 B10R2.6 c1cc(C2CN2)ccn1 Amb18221868 [0,0,0,0,0,0|2,0,0]=2 10 B10R2.6 c1cc(C2CO2)ccn1 Amb17090250 [0,0,0,0,0,0|1,0,0]=1 11 B10R2.6 c1cc(C2CO2)ncn1 Amb33269520 [0,0,0,0,0,0|2,0,0]=2 12 B10R2.6 c1cc(C2CS2)ccn1 Amb27162542 [0,0,0,0,0,0|1,1,0]=2 13 B10R2.6 c1cc(N2CC2)ncn1 Amb24102648 [0,0,0,0,0,0|4,0,0]=4 14 B10R2.6 c1cc([C@@H]2CO2)ccn1 Amb24103202 [0,0,0,0,0,0|1,0,0]=1 15 B10R2.6 c1cc([C@@H]2CO2)ncn1 Amb26430648 [0,0,0,0,0,0|2,0,0]=2 16 B10R2.6 c1cc([C@H]2CO2)ccn1 Amb24103149 [0,0,0,0,0,0|1,0,0]=1 17 B10R2.6 c1cc([C@H]2CO2)ncn1 Amb27244298 [0,0,0,0,0,0|2,0,0]=2 18 B10R2.6 c1ccc(C2CC2)cc1 Amb2780033 [0,0,0,0,0,0|1,0,0]=1 19 B10R2.6 c1ccc(C2CC2)nc1 Amb27482994 [0,0,0,0,0,0|2,0,0]=2 20 B10R2.6 c1ccc(C2CN2)cc1 Amb4114017 [0,0,0,0,0,0|1,0,0]=1 21 B10R2.6 c1ccc(C2CN2)nc1 Amb18860383 [0,0,0,0,0,0|2,0,0]=2 22 B10R2.6 c1ccc(C2CO2)cc1 Amb9702825 [0,0,0,0,0,0|0,0,0]=0 23 B10R2.6 c1ccc(C2CO2)nc1 Amb17090248 [0,0,0,0,0,0|1,0,0]=1 24 B10R2.6 c1ccc([C@@H]2CN2)cc1 Amb30633901 [0,0,0,0,0,0|1,0,0]=1 25 B10R2.6 c1ccc([C@@H]2CO2)cc1 Amb8514797 [0,0,0,0,0,0|0,0,0]=0 26 B10R2.6 c1ccc([C@@H]2CO2)nc1 Amb24481607 [0,0,0,0,0,0|1,0,0]=1 27 B10R2.6 c1ccc([C@H]2CN2)cc1 Amb33871555 [0,0,0,0,0,0|1,0,0]=1 28 B10R2.6 c1ccc([C@H]2CO2)cc1 Amb8628176 [0,0,0,0,0,0|0,0,0]=0 29 B10R2.6 c1ccc([C@H]2CO2)nc1 Amb24101968 [0,0,0,0,0,0|1,0,0]=1 30 B10R2.6 c1cnc(C2CC2)cn1 Amb27240072 [0,0,0,0,0,0|3,0,0]=3 31 B10R2.6 c1cnc(C2CC2)nc1 Amb24104366 [0,0,0,0,0,0|3,0,0]=3 32 B10R2.6 c1cnc(C2CO2)cn1 Amb25104129 [0,0,0,0,0,0|2,0,0]=2 33 B10R2.6 c1cnc(C2CO2)nc1 Amb33270688 [0,0,0,0,0,0|2,0,0]=2 34 B10R2.6 c1cnc([C@@H]2CO2)cn1 Amb24481608 [0,0,0,0,0,0|2,0,0]=2 35 B10R2.6 c1cnc([C@@H]2CO2)nc1 Amb33269208 [0,0,0,0,0,0|2,0,0]=2 36 B10R2.6 c1cnc([C@H]2CO2)cn1 Amb24481609 [0,0,0,0,0,0|2,0,0]=2 37 B10R2.6 c1cnc([C@H]2CO2)nc1 Amb33269209 [0,0,0,0,0,0|2,0,0]=2 38 B10R2.6 c1cncc(C2CC2)c1 Amb22235730 [0,0,0,0,0,0|2,0,0]=2 39 B10R2.6 c1cncc(C2CN2)c1 Amb18221862 [0,0,0,0,0,0|2,0,0]=2 40 B10R2.6 c1cncc(C2CO2)c1 Amb17090249 [0,0,0,0,0,0|1,0,0]=1 41 B10R2.6 c1cncc([C@@H]2CO2)c1 Amb25758556 [0,0,0,0,0,0|1,0,0]=1 42 B10R2.6 c1cncc([C@H]2CO2)c1 Amb28382282 [0,0,0,0,0,0|1,0,0]=1 43 B10R2.6 c1cnnc(C2CC2)c1 Amb25376122 [0,0,0,0,0,0|3,0,0]=3 44 B10R2.6 c1ncc(C2CO2)cn1 Amb24657638 [0,0,0,0,0,0|2,0,0]=2 45 B10R2.6 c1ncc([C@@H]2CO2)cn1 Amb32875961 [0,0,0,0,0,0|2,0,0]=2 46 B10R2.6 c1ncc([C@H]2CO2)cn1 Amb32875997 [0,0,0,0,0,0|2,0,0]=2 47 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [0,1,0,0,0,0|1,0,0]=2 48 B11R2.4 BrC1CC1c2ccncc2 Amb27460923 [0,1,0,0,0,0|2,0,0]=3 49 B11R2.4 BrC1CC1c2cnccn2 Amb28314093 [0,1,0,0,0,0|3,0,0]=4 50 B11R2.4 BrC1C[C@H]1c2ccccc2 Amb27392259 [0,1,0,0,0,0|1,0,0]=2 51 B11R2.4 Br[C@@H]1C[C@@H]1c2ccccc2 Amb28383883 [0,1,0,0,0,0|1,0,0]=2 52 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [0,1,0,0,0,0|1,0,0]=2 53 B11R2.4 Br[C@@H]1C[C@H]1c2cccnc2 Amb27190974 [0,1,0,0,0,0|2,0,0]=3 54 B11R2.4 CC1=C(c2ccccc2)N1 Amb28194853 [0,1,0,0,0,0|1,0,2]=4 55 B11R2.4 CC1CC1c2ccncc2 Amb2694644 [0,1,0,0,0,0|2,0,0]=3 56 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [0,1,0,0,0,0|0,0,0]=1 57 B11R2.4 CN1C[C@@H]1c2ccccc2 Amb33621244 [0,1,0,0,0,0|1,0,0]=2 58 B11R2.4 CN1C[C@H]1c2ccccc2 Amb33621243 [0,1,0,0,0,0|1,0,0]=2 59 B11R2.4 CN1OC1c2ccccn2 Amb24586710 [0,1,0,0,0,0|2,0,0]=3 60 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [0,1,0,0,0,0|0,0,0]=1 61 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [0,1,0,0,0,0|0,0,0]=1 62 B11R2.4 Cl[C@@H]1O[C@H]1c2ccccc2 Amb27845481 [0,1,0,0,0,0|0,0,0]=1 63 B11R2.4 Cl[C@H]1C[C@@H]1c2ccccc2 Amb28142329 [0,1,0,0,0,0|1,0,0]=2 64 B11R2.4 Cl[C@H]1O[C@H]1c2ccccc2 Amb27252240 [0,1,0,0,0,0|0,0,0]=1 65 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [0,1,0,0,0,0|1,0,0]=2 66 B11R2.4 NC1CC1c2ccccc2 Amb33548983 [0,1,0,0,0,0|1,0,0]=2 67 B11R2.4 NC1CC1c2ccccc2 Amb9284785 [0,1,0,0,0,0|1,0,0]=2 68 B11R2.4 NC1CC1c2ccccn2 Amb9677173 [0,1,0,0,0,0|2,0,0]=3 69 B11R2.4 NC1CC1c2cccnc2 Amb33447000 [0,1,0,0,0,0|2,0,0]=3 70 B11R2.4 NC1CC1c2cccnc2 Amb9677232 [0,1,0,0,0,0|2,0,0]=3 71 B11R2.4 NC1CC1c2ccncc2 Amb9677222 [0,1,0,0,0,0|2,0,0]=3 72 B11R2.4 NC1CC1c2ccncn2 Amb27955658 [0,1,0,0,0,0|3,0,0]=4 73 B11R2.4 NC1CC1c2cnccn2 Amb33360008 [0,1,0,0,0,0|3,0,0]=4 74 B11R2.4 NC1CC1c2cncnc2 Amb26944302 [0,1,0,0,0,0|3,0,0]=4 75 B11R2.4 NC1CC1c2ncccn2 Amb33270683 [0,1,0,0,0,0|3,0,0]=4 76 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,1,0,0,0,0|1,0,0]=2 77 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [0,1,0,0,0,0|1,0,0]=2 78 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [0,1,0,0,0,0|1,0,0]=2 79 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [0,1,0,0,0,0|1,0,0]=2 80 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [0,1,0,0,0,0|1,0,0]=2 81 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb2720223 [0,1,0,0,0,0|1,0,0]=2 82 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb8387302 [0,1,0,0,0,0|1,0,0]=2 83 B11R2.4 N[C@@H]1C[C@H]1c2ccccn2 Amb33361299 [0,1,0,0,0,0|2,0,0]=3 84 B11R2.4 N[C@@H]1C[C@H]1c2cccnc2 Amb26947679 [0,1,0,0,0,0|2,0,0]=3 85 B11R2.4 N[C@@H]1C[C@H]1c2cccnc2 Amb33473670 [0,1,0,0,0,0|2,0,0]=3 86 B11R2.4 N[C@@H]1C[C@H]1c2ccncc2 Amb33380669 [0,1,0,0,0,0|2,0,0]=3 87 B11R2.4 N[C@@H]1C[C@H]1c2ccncn2 Amb33269038 [0,1,0,0,0,0|3,0,0]=4 88 B11R2.4 N[C@@H]1C[C@H]1c2cnccn2 Amb33360018 [0,1,0,0,0,0|3,0,0]=4 89 B11R2.4 N[C@@H]1C[C@H]1c2cncnc2 Amb33465660 [0,1,0,0,0,0|3,0,0]=4 90 B11R2.4 N[C@@H]1C[C@H]1c2ncccn2 Amb33270684 [0,1,0,0,0,0|3,0,0]=4 91 B11R2.4 N[C@H]1CC1c2ccccc2 Amb34916480 [0,1,0,0,0,0|1,0,0]=2 92 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [0,1,0,0,0,0|1,0,0]=2 93 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb597420 [0,1,0,0,0,0|1,0,0]=2 94 B11R2.4 N[C@H]1C[C@@H]1c2cccnc2 Amb24604839 [0,1,0,0,0,0|2,0,0]=3 95 B11R2.4 N[C@H]1C[C@H]1c2ccccc2 Amb33806281 [0,1,0,0,0,0|1,0,0]=2 96 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [0,1,0,0,0,0|1,0,0]=2 97 B11R2.4 O[C@@H]1C[C@@H]1c2ccccc2 Amb27486613 [0,1,0,0,0,0|1,0,0]=2 98 B11R2.4 O[C@H]1C[C@H]1c2ccccc2 Amb27972540 [0,1,0,0,0,0|1,0,0]=2 99 B11R2.34 Brc1ccc(C2CC2)cc1 Amb6768414 [0,1,0,0,0,0|1,0,0]=2 100 B11R2.34 Brc1ccc(C2CC2)cn1 Amb10600527 [0,1,0,0,0,0|2,0,0]=3 101 B11R2.34 Brc1ccc(C2CC2)nc1 Amb10600790 [0,1,0,0,0,0|2,0,0]=3 102 B11R2.34 Brc1ccc(C2CC2)nc1 Amb32932448 [0,1,0,0,0,0|2,0,0]=3 103 B11R2.34 Brc1ccc(C2CC2)nn1 Amb10599701 [0,1,0,0,0,0|3,0,0]=4 104 B11R2.34 Brc1ccc(C2CC2)nn1 Amb30628605 [0,1,0,0,0,0|3,0,0]=4 105 B11R2.34 Brc1ccc(C2CN2)cc1 Amb18224966 [0,1,0,0,0,0|1,0,0]=2 106 B11R2.34 Brc1ccc(C2CO2)cc1 Amb1125483 [0,1,0,0,0,0|0,0,0]=1 107 B11R2.34 Brc1ccc(C2CO2)cn1 Amb23586079 [0,1,0,0,0,0|1,0,0]=2 108 B11R2.34 Brc1ccc(C2CO2)nc1 Amb23585931 [0,1,0,0,0,0|1,0,0]=2 109 B11R2.34 Brc1ccc([C@@H]2CO2)cc1 Amb8631557 [0,1,0,0,0,0|0,0,0]=1 110 B11R2.34 Brc1ccc([C@@H]2CO2)cn1 Amb33389207 [0,1,0,0,0,0|1,0,0]=2 111 B11R2.34 Brc1ccc([C@@H]2CO2)nc1 Amb29854027 [0,1,0,0,0,0|1,0,0]=2 112 B11R2.34 Brc1ccc([C@H]2CO2)cc1 Amb20242704 [0,1,0,0,0,0|0,0,0]=1 113 B11R2.34 Brc1ccc([C@H]2CO2)cn1 Amb33389210 [0,1,0,0,0,0|1,0,0]=2 114 B11R2.34 Brc1ccc([C@H]2CO2)nc1 Amb30007952 [0,1,0,0,0,0|1,0,0]=2 115 B11R2.34 Brc1cnc(C2CC2)cn1 Amb10599469 [0,1,0,0,0,0|3,0,0]=4 116 B11R2.34 Brc1cnc(C2CC2)nc1 Amb13884463 [0,1,0,0,0,0|3,0,0]=4 117 B11R2.34 Brc1cnc(C2CO2)nc1 Amb33334404 [0,1,0,0,0,0|2,0,0]=3 118 B11R2.34 Brc1cnc([C@@H]2CO2)nc1 Amb33335313 [0,1,0,0,0,0|2,0,0]=3 119 B11R2.34 Brc1cnc([C@H]2CO2)nc1 Amb33335311 [0,1,0,0,0,0|2,0,0]=3 120 B11R2.34 Brc1ncc(C2CC2)cn1 Amb20617941 [0,1,0,0,0,0|3,0,0]=4 121 B11R2.34 Cc1ccc(C2CC2)cc1 Amb9768862 [0,1,0,0,0,0|1,0,0]=2 122 B11R2.34 Cc1ccc(C2CN2)cc1 Amb18861118 [0,1,0,0,0,0|1,0,0]=2 123 B11R2.34 Cc1ccc(C2CO2)cc1 Amb9709237 [0,1,0,0,0,0|0,0,0]=1 124 B11R2.34 Cc1ccc(C2CO2)cn1 Amb24084793 [0,1,0,0,0,0|1,0,0]=2 125 B11R2.34 Cc1ccc(C2CO2)nc1 Amb24071549 [0,1,0,0,0,0|1,0,0]=2 126 B11R2.34 Cc1ccc([C@@H]2CO2)cc1 Amb24387280 [0,1,0,0,0,0|0,0,0]=1 127 B11R2.34 Cc1ccc([C@@H]2CO2)cn1 Amb24084800 [0,1,0,0,0,0|1,0,0]=2 128 B11R2.34 Cc1ccc([C@@H]2CO2)nc1 Amb33327073 [0,1,0,0,0,0|1,0,0]=2 129 B11R2.34 Cc1ccc([C@H]2CO2)cc1 Amb24478464 [0,1,0,0,0,0|0,0,0]=1 130 B11R2.34 Cc1ccc([C@H]2CO2)cn1 Amb33224819 [0,1,0,0,0,0|1,0,0]=2 131 B11R2.34 Cc1ccc([C@H]2CO2)nc1 Amb33327050 [0,1,0,0,0,0|1,0,0]=2 132 B11R2.34 Cc1cnc(C2CO2)cn1 Amb25090319 [0,1,0,0,0,0|2,0,0]=3 133 B11R2.34 Cc1cnc([C@@H]2CO2)cn1 Amb33376629 [0,1,0,0,0,0|2,0,0]=3 134 B11R2.34 Cc1cnc([C@H]2CO2)cn1 Amb33376630 [0,1,0,0,0,0|2,0,0]=3 135 B11R2.34 Clc1ccc(C2CC2)cc1 Amb22737035 [0,1,0,0,0,0|1,0,0]=2 136 B11R2.34 Clc1ccc(C2CC2)cn1 Amb21618768 [0,1,0,0,0,0|2,0,0]=3 137 B11R2.34 Clc1ccc(C2CC2)nn1 Amb33540174 [0,1,0,0,0,0|3,0,0]=4 138 B11R2.34 Clc1ccc(C2CN2)cc1 Amb18862503 [0,1,0,0,0,0|1,0,0]=2 139 B11R2.34 Clc1ccc(C2CO2)cc1 Amb6662717 [0,1,0,0,0,0|0,0,0]=1 140 B11R2.34 Clc1ccc(C2CO2)nc1 Amb25140587 [0,1,0,0,0,0|1,0,0]=2 141 B11R2.34 Clc1ccc([C@@H]2CO2)cc1 Amb22800166 [0,1,0,0,0,0|0,0,0]=1 142 B11R2.34 Clc1ccc([C@@H]2CO2)cn1 Amb33261740 [0,1,0,0,0,0|1,0,0]=2 143 B11R2.34 Clc1ccc([C@@H]2CO2)nc1 Amb29854023 [0,1,0,0,0,0|1,0,0]=2 144 B11R2.34 Clc1ccc([C@H]2CO2)cc1 Amb26502215 [0,1,0,0,0,0|0,0,0]=1 145 B11R2.34 Clc1ccc([C@H]2CO2)cn1 Amb33261734 [0,1,0,0,0,0|1,0,0]=2 146 B11R2.34 Clc1ccc([C@H]2CO2)nc1 Amb29854024 [0,1,0,0,0,0|1,0,0]=2 147 B11R2.34 Clc1cnc(C2CC2)cn1 Amb25178808 [0,1,0,0,0,0|3,0,0]=4 148 B11R2.34 Clc1cnc(C2CC2)nc1 Amb27639638 [0,1,0,0,0,0|3,0,0]=4 149 B11R2.34 Clc1ncc(C2CC2)cn1 Amb20617942 [0,1,0,0,0,0|3,0,0]=4 150 B11R2.34 Fc1ccc(C2CC2)cc1 Amb21856495 [0,1,0,0,0,0|1,0,0]=2 151 B11R2.34 Fc1ccc(C2CC2)cn1 Amb22276747 [0,1,0,0,0,0|2,0,0]=3 152 B11R2.34 Fc1ccc(C2CC2)nc1 Amb27977210 [0,1,0,0,0,0|2,0,0]=3 153 B11R2.34 Fc1ccc(C2CN2)cc1 Amb18223210 [0,1,0,0,0,0|1,0,0]=2 154 B11R2.34 Fc1ccc(C2CO2)cc1 Amb9722515 [0,1,0,0,0,0|0,0,0]=1 155 B11R2.34 Fc1ccc(C2CO2)cn1 Amb33426530 [0,1,0,0,0,0|1,0,0]=2 156 B11R2.34 Fc1ccc(C2CO2)nc1 Amb27425146 [0,1,0,0,0,0|1,0,0]=2 157 B11R2.34 Fc1ccc(C2CS2)cc1 Amb27399613 [0,1,0,0,0,0|0,1,0]=2 158 B11R2.34 Fc1ccc([C@@H]2CO2)cn1 Amb33422951 [0,1,0,0,0,0|1,0,0]=2 159 B11R2.34 Fc1ccc([C@@H]2CO2)nc1 Amb28383871 [0,1,0,0,0,0|1,0,0]=2 160 B11R2.34 Fc1ccc([C@H]2CO2)cc1 Amb20241196 [0,1,0,0,0,0|0,0,0]=1 161 B11R2.34 Fc1ccc([C@H]2CO2)cn1 Amb33422952 [0,1,0,0,0,0|1,0,0]=2 162 B11R2.34 Fc1ccc([C@H]2CO2)nc1 Amb25129411 [0,1,0,0,0,0|1,0,0]=2 163 B11R2.34 Ic1ccc(C2CC2)cc1 Amb4302688 [0,1,0,0,0,0|1,0,0]=2 164 B11R2.34 Ic1ccc(C2CO2)cc1 Amb28318565 [0,1,0,0,0,0|0,0,0]=1 165 B11R2.34 Ic1cnc(C2CC2)nc1 Amb24504802 [0,1,0,0,0,0|3,0,0]=4 166 B11R2.34 Nc1ccc(C2CC2)cc1 Amb33527770 [0,1,0,0,0,0|1,0,0]=2 167 B11R2.34 Nc1ccc(C2CC2)cc1 Amb6739776 [0,1,0,0,0,0|1,0,0]=2 168 B11R2.34 Nc1ccc(C2CC2)cn1 Amb33530644 [0,1,0,0,0,0|2,0,0]=3 169 B11R2.34 Nc1ccc(C2CC2)nc1 Amb10600791 [0,1,0,0,0,0|2,0,0]=3 170 B11R2.34 Nc1ccc(C2CC2)nn1 Amb10599702 [0,1,0,0,0,0|3,0,0]=4 171 B11R2.34 Nc1cnc(C2CC2)cn1 Amb10599470 [0,1,0,0,0,0|3,0,0]=4 172 B11R2.34 Nc1cnc(C2CC2)nc1 Amb9210772 [0,1,0,0,0,0|3,0,0]=4 173 B11R2.34 Nc1ncc(C2CC2)cn1 Amb17933315 [0,1,0,0,0,0|3,0,0]=4 174 B11R2.34 O=C1C=CC(C2CC2)=NN1 Amb33540168 [0,1,0,0,0,0|3,0,0]=4 175 B11R2.34 Oc1ccc(C2CC2)cc1 Amb9768841 [0,1,0,0,0,0|1,0,0]=2 176 B11R2.34 Oc1ccc(C2CC2)cn1 Amb10600528 [0,1,0,0,0,0|2,0,0]=3 177 B11R2.34 Oc1ccc(C2CC2)nc1 Amb10600792 [0,1,0,0,0,0|2,0,0]=3 178 B11R2.34 Oc1ccc(C2CO2)cc1 Amb17090258 [0,1,0,0,0,0|0,0,0]=1 179 B11R2.34 Oc1cnc(C2CC2)cn1 Amb10599471 [0,1,0,0,0,0|3,0,0]=4 180 B11R2.34 Oc1cnc(C2CC2)nc1 Amb13884798 [0,1,0,0,0,0|3,0,0]=4 181 B11R2.34 Oc1ncc(C2CC2)cn1 Amb20617939 [0,1,0,0,0,0|3,0,0]=4 182 B11R2.34 Sc1ccc(C2CC2)cc1 Amb33319157 [0,1,0,0,0,0|1,0,0]=2 183 B11R2.35 Brc1cc(C2CC2)ccn1 Amb10599812 [0,1,0,0,0,0|2,0,0]=3 184 B11R2.35 Brc1cc(C2CC2)ncn1 Amb10600015 [0,1,0,0,0,0|3,0,0]=4 185 B11R2.35 Brc1cccc(C2CC2)c1 Amb4302787 [0,1,0,0,0,0|1,0,0]=2 186 B11R2.35 Brc1cccc(C2CC2)n1 Amb10599761 [0,1,0,0,0,0|2,0,0]=3 187 B11R2.35 Brc1cccc(C2CN2)c1 Amb18864135 [0,1,0,0,0,0|1,0,0]=2 188 B11R2.35 Brc1cccc(C2CO2)c1 Amb1125124 [0,1,0,0,0,0|0,0,0]=1 189 B11R2.35 Brc1cccc(C2CO2)n1 Amb33432772 [0,1,0,0,0,0|1,0,0]=2 190 B11R2.35 Brc1cccc([C@@H]2CO2)n1 Amb33433950 [0,1,0,0,0,0|1,0,0]=2 191 B11R2.35 Brc1cccc([C@H]2CO2)c1 Amb25839418 [0,1,0,0,0,0|0,0,0]=1 192 B11R2.35 Brc1cccc([C@H]2CO2)n1 Amb33433949 [0,1,0,0,0,0|1,0,0]=2 193 B11R2.35 Brc1ccnc(C2CC2)c1 Amb10599764 [0,1,0,0,0,0|2,0,0]=3 194 B11R2.35 Brc1ccnc(C2CC2)n1 Amb10599371 [0,1,0,0,0,0|3,0,0]=4 195 B11R2.35 Brc1cncc(C2CC2)c1 Amb20241776 [0,1,0,0,0,0|2,0,0]=3 196 B11R2.35 Brc1cncc(C2CC2)n1 Amb10600322 [0,1,0,0,0,0|3,0,0]=4 197 B11R2.35 Brc1cncc(C2CO2)c1 Amb23586055 [0,1,0,0,0,0|1,0,0]=2 198 B11R2.35 Brc1cncc([C@@H]2CO2)c1 Amb29854025 [0,1,0,0,0,0|1,0,0]=2 199 B11R2.35 Brc1cncc([C@H]2CO2)c1 Amb29854026 [0,1,0,0,0,0|1,0,0]=2 200 B11R2.35 Brc1nccc(C2CC2)n1 Amb13884144 [0,1,0,0,0,0|3,0,0]=4 201 B11R2.35 Cc1cc(C2CC2)ccn1 Amb10573795 [0,1,0,0,0,0|2,0,0]=3 202 B11R2.35 Cc1cc(C2CO2)ccn1 Amb33268218 [0,1,0,0,0,0|1,0,0]=2 203 B11R2.35 Cc1cc([C@@H]2CO2)ccn1 Amb32733326 [0,1,0,0,0,0|1,0,0]=2 204 B11R2.35 Cc1cc([C@H]2CO2)ccn1 Amb32733328 [0,1,0,0,0,0|1,0,0]=2 205 B11R2.35 Cc1cccc(C2CC2)c1 Amb9768872 [0,1,0,0,0,0|1,0,0]=2 206 B11R2.35 Cc1cccc(C2CN2)c1 Amb18222886 [0,1,0,0,0,0|1,0,0]=2 207 B11R2.35 Cc1cccc(C2CO2)c1 Amb17090251 [0,1,0,0,0,0|0,0,0]=1 208 B11R2.35 Cc1cccc(C2CO2)n1 Amb28045270 [0,1,0,0,0,0|1,0,0]=2 209 B11R2.35 Cc1cccc([C@@H]2CO2)c1 Amb26345259 [0,1,0,0,0,0|0,0,0]=1 210 B11R2.35 Cc1cccc([C@@H]2CO2)n1 Amb33199217 [0,1,0,0,0,0|1,0,0]=2 211 B11R2.35 Cc1cccc([C@H]2CO2)c1 Amb26865926 [0,1,0,0,0,0|0,0,0]=1 212 B11R2.35 Cc1cccc([C@H]2CO2)n1 Amb33226182 [0,1,0,0,0,0|1,0,0]=2 213 B11R2.35 Cc1ccnc(C2CC2)c1 Amb27770373 [0,1,0,0,0,0|2,0,0]=3 214 B11R2.35 Cc1ccnc(C2CC2)n1 Amb27839483 [0,1,0,0,0,0|3,0,0]=4 215 B11R2.35 Cc1ccnc(C2CO2)c1 Amb33318404 [0,1,0,0,0,0|1,0,0]=2 216 B11R2.35 Cc1ccnc([C@@H]2CO2)c1 Amb33317764 [0,1,0,0,0,0|1,0,0]=2 217 B11R2.35 Cc1ccnc([C@H]2CO2)c1 Amb33317765 [0,1,0,0,0,0|1,0,0]=2 218 B11R2.35 Cc1cncc(C2CO2)c1 Amb24760024 [0,1,0,0,0,0|1,0,0]=2 219 B11R2.35 Cc1cncc([C@@H]2CO2)c1 Amb33316534 [0,1,0,0,0,0|1,0,0]=2 220 B11R2.35 Cc1cncc([C@H]2CO2)c1 Amb33316525 [0,1,0,0,0,0|1,0,0]=2 221 B11R2.35 Clc1cc(C2CC2)ccn1 Amb10599823 [0,1,0,0,0,0|2,0,0]=3 222 B11R2.35 Clc1cc(C2CC2)ncn1 Amb33533282 [0,1,0,0,0,0|3,0,0]=4 223 B11R2.35 Clc1cccc(C2CC2)c1 Amb22737227 [0,1,0,0,0,0|1,0,0]=2 224 B11R2.35 Clc1cccc(C2CC2)n1 Amb26435042 [0,1,0,0,0,0|2,0,0]=3 225 B11R2.35 Clc1cccc(C2CN2)c1 Amb18862502 [0,1,0,0,0,0|1,0,0]=2 226 B11R2.35 Clc1cccc(C2CO2)c1 Amb9708992 [0,1,0,0,0,0|0,0,0]=1 227 B11R2.35 Clc1cccc(C2CO2)n1 Amb33223334 [0,1,0,0,0,0|1,0,0]=2 228 B11R2.35 Clc1cccc([C@@H]2CO2)c1 Amb8393718 [0,1,0,0,0,0|0,0,0]=1 229 B11R2.35 Clc1cccc([C@@H]2CO2)n1 Amb33222947 [0,1,0,0,0,0|1,0,0]=2 230 B11R2.35 Clc1cccc([C@H]2CO2)c1 Amb10069042 [0,1,0,0,0,0|0,0,0]=1 231 B11R2.35 Clc1cccc([C@H]2CO2)n1 Amb33222730 [0,1,0,0,0,0|1,0,0]=2 232 B11R2.35 Clc1ccnc(C2CC2)n1 Amb9519667 [0,1,0,0,0,0|3,0,0]=4 233 B11R2.35 Clc1cncc(C2CC2)c1 Amb22276389 [0,1,0,0,0,0|2,0,0]=3 234 B11R2.35 Clc1cncc(C2CC2)n1 Amb20617842 [0,1,0,0,0,0|3,0,0]=4 235 B11R2.35 Clc1nccc(C2CC2)n1 Amb13884426 [0,1,0,0,0,0|3,0,0]=4 236 B11R2.35 Fc1cc(C2CC2)ncn1 Amb35642609 [0,1,0,0,0,0|3,0,0]=4 237 B11R2.35 Fc1cccc(C2CC2)c1 Amb17872689 [0,1,0,0,0,0|1,0,0]=2 238 B11R2.35 Fc1cccc(C2CC2)n1 Amb24319186 [0,1,0,0,0,0|2,0,0]=3 239 B11R2.35 Fc1cccc(C2CN2)c1 Amb18861329 [0,1,0,0,0,0|1,0,0]=2 240 B11R2.35 Fc1cccc(C2CO2)c1 Amb9714277 [0,1,0,0,0,0|0,0,0]=1 241 B11R2.35 Fc1cccc([C@@H]2CO2)c1 Amb28050268 [0,1,0,0,0,0|0,0,0]=1 242 B11R2.35 Fc1cccc([C@H]2CO2)c1 Amb24448376 [0,1,0,0,0,0|0,0,0]=1 243 B11R2.35 Fc1ccnc(C2CC2)n1 Amb35642806 [0,1,0,0,0,0|3,0,0]=4 244 B11R2.35 Fc1ccnc(C2CO2)c1 Amb33414603 [0,1,0,0,0,0|1,0,0]=2 245 B11R2.35 Fc1ccnc([C@@H]2CO2)c1 Amb33324824 [0,1,0,0,0,0|1,0,0]=2 246 B11R2.35 Fc1ccnc([C@H]2CO2)c1 Amb33324815 [0,1,0,0,0,0|1,0,0]=2 247 B11R2.35 Fc1cncc(C2CC2)c1 Amb27841818 [0,1,0,0,0,0|2,0,0]=3 248 B11R2.35 Fc1cncc(C2CO2)c1 Amb33196962 [0,1,0,0,0,0|1,0,0]=2 249 B11R2.35 Fc1cncc([C@@H]2CO2)c1 Amb24432335 [0,1,0,0,0,0|1,0,0]=2 250 B11R2.35 Fc1cncc([C@H]2CO2)c1 Amb24409075 [0,1,0,0,0,0|1,0,0]=2 251 B11R2.35 Ic1cccc(C2CC2)c1 Amb26607972 [0,1,0,0,0,0|1,0,0]=2 252 B11R2.35 Nc1cc(C2=NC2)ccn1 Amb27596075 [0,1,0,0,0,0|2,0,1]=4 253 B11R2.35 Nc1cc(C2CC2)ccn1 Amb10599824 [0,1,0,0,0,0|2,0,0]=3 254 B11R2.35 Nc1cc(C2CC2)ccn1 Amb30586726 [0,1,0,0,0,0|2,0,0]=3 255 B11R2.35 Nc1cc(C2CC2)ncn1 Amb10600016 [0,1,0,0,0,0|3,0,0]=4 256 B11R2.35 Nc1cccc(C2CC2)c1 Amb22728094 [0,1,0,0,0,0|1,0,0]=2 257 B11R2.35 Nc1cccc(C2CC2)c1 Amb9768840 [0,1,0,0,0,0|1,0,0]=2 258 B11R2.35 Nc1cccc(C2CC2)n1 Amb10599762 [0,1,0,0,0,0|2,0,0]=3 259 B11R2.35 Nc1ccnc(C2CC2)c1 Amb10599765 [0,1,0,0,0,0|2,0,0]=3 260 B11R2.35 Nc1ccnc(C2CC2)n1 Amb10599372 [0,1,0,0,0,0|3,0,0]=4 261 B11R2.35 Nc1cncc(C2CC2)c1 Amb20617712 [0,1,0,0,0,0|2,0,0]=3 262 B11R2.35 Nc1cncc(C2CC2)n1 Amb10600323 [0,1,0,0,0,0|3,0,0]=4 263 B11R2.35 Nc1nccc(C2CC2)n1 Amb2438905 [0,1,0,0,0,0|3,0,0]=4 264 B11R2.35 O=C1C=C(C2CC2)C=NN1 Amb28185099 [0,1,0,0,0,0|3,0,0]=4 265 B11R2.35 O=C1C=CC=C(C2CO2)N1 Amb27626420 [0,1,0,0,0,0|1,0,0]=2 266 B11R2.35 O=C1C=CN=C(C2CC2)N1 Amb22058798 [0,1,0,0,0,0|3,0,0]=4 267 B11R2.35 Oc1cc(C2CC2)ccn1 Amb10599825 [0,1,0,0,0,0|2,0,0]=3 268 B11R2.35 Oc1cc(C2CC2)ncn1 Amb33548365 [0,1,0,0,0,0|3,0,0]=4 269 B11R2.35 Oc1cccc(C2CC2)c1 Amb33542647 [0,1,0,0,0,0|1,0,0]=2 270 B11R2.35 Oc1cccc(C2CC2)n1 Amb10599763 [0,1,0,0,0,0|2,0,0]=3 271 B11R2.35 Oc1cccc(C2CO2)c1 Amb17090259 [0,1,0,0,0,0|0,0,0]=1 272 B11R2.35 Oc1cccc(C2N=N2)c1 Amb27199036 [0,1,0,0,0,0|2,0,0]=3 273 B11R2.35 Oc1ccnc(C2CC2)c1 Amb10599766 [0,1,0,0,0,0|2,0,0]=3 274 B11R2.35 Oc1ccnc(C2CC2)n1 Amb10599373 [0,1,0,0,0,0|3,0,0]=4 275 B11R2.35 Oc1cncc(C2CC2)c1 Amb20617713 [0,1,0,0,0,0|2,0,0]=3 276 B11R2.35 Oc1cncc(C2CC2)n1 Amb10600324 [0,1,0,0,0,0|3,0,0]=4 277 B11R2.35 Oc1nccc(C2CC2)n1 Amb13884391 [0,1,0,0,0,0|3,0,0]=4 278 B11R2.35 S=C1N=C(C2CC2)C=CN1 Amb27233439 [0,1,0,0,0,0|3,0,0]=4 279 B11R2.35 Sc1cccc(C2CC2)c1 Amb33340342 [0,1,0,0,0,0|1,0,0]=2 280 B11R2.35 Sc1cncc(C2CC2)c1 Amb33276293 [0,1,0,0,0,0|2,0,0]=3 281 B11R2.35 [O-][n+]1cccc(C2CC2)c1 Amb24474707 [0,1,0,0,0,0|2,0,0]=3 282 B11R2.35 [O-][n+]1cccc(C2CO2)c1 Amb25027822 [0,1,0,0,0,0|1,0,0]=2 283 B11R2.40 BrC1(c2ccccc2)CC1 Amb24743023 [0,1,0,0,0,0|1,0,0]=2 284 B11R2.40 CC1(c2ccccc2)CC1 Amb24613075 [0,1,0,0,0,0|1,0,0]=2 285 B11R2.40 CC1(c2ccccc2)CN1 Amb9782222 [0,1,0,0,0,0|1,0,0]=2 286 B11R2.40 CC1(c2ccccc2)CO1 Amb7094910 [0,1,0,0,0,0|0,0,0]=1 287 B11R2.40 CC1(c2ccccn2)CC1 Amb28434889 [0,1,0,0,0,0|2,0,0]=3 288 B11R2.40 CC1(c2ccccn2)CO1 Amb24070157 [0,1,0,0,0,0|1,0,0]=2 289 B11R2.40 CC1(c2cccnc2)CO1 Amb25683724 [0,1,0,0,0,0|1,0,0]=2 290 B11R2.40 CC1(c2ccncc2)CC1 Amb2694623 [0,1,0,0,0,0|2,0,0]=3 291 B11R2.40 CC1(c2ccncc2)CO1 Amb26450845 [0,1,0,0,0,0|1,0,0]=2 292 B11R2.40 CC1(c2ccncn2)CO1 Amb33268566 [0,1,0,0,0,0|2,0,0]=3 293 B11R2.40 CC1(c2cnccn2)CO1 Amb33429676 [0,1,0,0,0,0|2,0,0]=3 294 B11R2.40 CC1(c2cncnc2)CO1 Amb33149161 [0,1,0,0,0,0|2,0,0]=3 295 B11R2.40 CC1(c2ncccn2)CO1 Amb33270060 [0,1,0,0,0,0|2,0,0]=3 296 B11R2.40 ClC1(c2ccccc2)CC1 Amb17872674 [0,1,0,0,0,0|1,0,0]=2 297 B11R2.40 ClC1(c2ccccc2)CO1 Amb27210141 [0,1,0,0,0,0|0,0,0]=1 298 B11R2.40 NC1(c2ccccc2)CC1 Amb1095038 [0,1,0,0,0,0|1,0,0]=2 299 B11R2.40 NC1(c2ccccc2)CC1 Amb2721355 [0,1,0,0,0,0|1,0,0]=2 300 B11R2.40 NC1(c2ccccn2)CC1 Amb21858032 [0,1,0,0,0,0|2,0,0]=3 301 B11R2.40 NC1(c2ccccn2)CC1 Amb21963993 [0,1,0,0,0,0|2,0,0]=3 302 B11R2.40 NC1(c2ccccn2)CC1 Amb33531336 [0,1,0,0,0,0|2,0,0]=3 303 B11R2.40 NC1(c2cccnc2)CC1 Amb10602476 [0,1,0,0,0,0|2,0,0]=3 304 B11R2.40 NC1(c2cccnc2)CC1 Amb22490380 [0,1,0,0,0,0|2,0,0]=3 305 B11R2.40 NC1(c2cccnn2)CC1 Amb18832498 [0,1,0,0,0,0|3,0,0]=4 306 B11R2.40 NC1(c2ccncc2)CC1 Amb18280388 [0,1,0,0,0,0|2,0,0]=3 307 B11R2.40 NC1(c2ccncc2)CC1 Amb22736629 [0,1,0,0,0,0|2,0,0]=3 308 B11R2.40 NC1(c2ccncn2)CC1 Amb18832500 [0,1,0,0,0,0|3,0,0]=4 309 B11R2.40 NC1(c2ccncn2)CC1 Amb32665111 [0,1,0,0,0,0|3,0,0]=4 310 B11R2.40 NC1(c2cnccn2)CC1 Amb18280372 [0,1,0,0,0,0|3,0,0]=4 311 B11R2.40 NC1(c2cnccn2)CC1 Amb23399684 [0,1,0,0,0,0|3,0,0]=4 312 B11R2.40 NC1(c2cncnc2)CC1 Amb18832499 [0,1,0,0,0,0|3,0,0]=4 313 B11R2.40 NC1(c2ncccn2)CC1 Amb18948040 [0,1,0,0,0,0|3,0,0]=4 314 B11R2.40 NC1(c2ncccn2)CC1 Amb22736967 [0,1,0,0,0,0|3,0,0]=4 315 B11R2.40 NC1(c2ncccn2)CC1 Amb30869384 [0,1,0,0,0,0|3,0,0]=4 316 B11R2.40 OC1(c2ccccc2)CC1 Amb19374887 [0,1,0,0,0,0|1,0,0]=2 317 B11R2.40 OC1(c2ccccn2)CC1 Amb25682150 [0,1,0,0,0,0|2,0,0]=3 318 B11R2.40 OC1(c2cccnc2)CC1 Amb27161989 [0,1,0,0,0,0|2,0,0]=3 319 B11R2.40 OC1(c2ccncc2)CC1 Amb25235214 [0,1,0,0,0,0|2,0,0]=3 320 B11R2.40 OC1(c2ccncn2)CC1 Amb27875411 [0,1,0,0,0,0|3,0,0]=4 321 B11R2.40 OC1(c2cnccn2)CC1 Amb26460844 [0,1,0,0,0,0|3,0,0]=4 322 B11R2.40 OC1(c2cncnc2)CC1 Amb27434900 [0,1,0,0,0,0|3,0,0]=4 323 B11R2.40 OC1(c2ncccn2)CC1 Amb33270694 [0,1,0,0,0,0|3,0,0]=4 324 B11R2.40 SC1(c2ccccc2)CC1 Amb33081559 [0,1,0,0,0,0|1,0,0]=2 325 B11R2.55 Brc1ccccc1C2CC2 Amb13884115 [0,1,0,0,0,0|1,0,0]=2 326 B11R2.55 Brc1ccccc1C2CN2 Amb18224967 [0,1,0,0,0,0|1,0,0]=2 327 B11R2.55 Brc1ccccc1C2CO2 Amb1125957 [0,1,0,0,0,0|0,0,0]=1 328 B11R2.55 Brc1ccccc1[C@@H]2CO2 Amb27424858 [0,1,0,0,0,0|0,0,0]=1 329 B11R2.55 Brc1ccccc1[C@H]2CO2 Amb27254540 [0,1,0,0,0,0|0,0,0]=1 330 B11R2.55 Brc1cccnc1C2CC2 Amb22494600 [0,1,0,0,0,0|2,0,0]=3 331 B11R2.55 Brc1cccnc1C2CO2 Amb23586100 [0,1,0,0,0,0|1,0,0]=2 332 B11R2.55 Brc1cccnc1[C@@H]2CO2 Amb33336442 [0,1,0,0,0,0|1,0,0]=2 333 B11R2.55 Brc1cccnc1[C@H]2CO2 Amb33336440 [0,1,0,0,0,0|1,0,0]=2 334 B11R2.55 Brc1ccncc1C2CC2 Amb20617493 [0,1,0,0,0,0|2,0,0]=3 335 B11R2.55 Brc1cnccc1C2CC2 Amb24320561 [0,1,0,0,0,0|2,0,0]=3 336 B11R2.55 Brc1cnccc1C2CO2 Amb26338193 [0,1,0,0,0,0|1,0,0]=2 337 B11R2.55 Brc1cnccc1[C@@H]2CO2 Amb33388934 [0,1,0,0,0,0|1,0,0]=2 338 B11R2.55 Brc1cnccc1[C@H]2CO2 Amb33388992 [0,1,0,0,0,0|1,0,0]=2 339 B11R2.55 Brc1cncnc1C2CC2 Amb18142755 [0,1,0,0,0,0|3,0,0]=4 340 B11R2.55 Brc1cnncc1C2CC2 Amb18187819 [0,1,0,0,0,0|3,0,0]=4 341 B11R2.55 Brc1ncccc1C2CO2 Amb23586098 [0,1,0,0,0,0|1,0,0]=2 342 B11R2.55 Brc1ncccc1[C@@H]2CO2 Amb33388158 [0,1,0,0,0,0|1,0,0]=2 343 B11R2.55 Brc1ncccc1[C@H]2CO2 Amb33388161 [0,1,0,0,0,0|1,0,0]=2 344 B11R2.55 Brc1nccnc1C2CC2 Amb35598364 [0,1,0,0,0,0|3,0,0]=4 345 B11R2.55 Cc1ccccc1C2CC2 Amb9769895 [0,1,0,0,0,0|1,0,0]=2 346 B11R2.55 Cc1ccccc1C2CN2 Amb18222812 [0,1,0,0,0,0|1,0,0]=2 347 B11R2.55 Cc1ccccc1C2CO2 Amb1140946 [0,1,0,0,0,0|0,0,0]=1 348 B11R2.55 Cc1ccccc1[C@@H]2CO2 Amb26498851 [0,1,0,0,0,0|0,0,0]=1 349 B11R2.55 Cc1ccccc1[C@H]2CO2 Amb24478493 [0,1,0,0,0,0|0,0,0]=1 350 B11R2.55 Cc1cccnc1C2CO2 Amb28315792 [0,1,0,0,0,0|1,0,0]=2 351 B11R2.55 Cc1cccnc1[C@@H]2CO2 Amb33359953 [0,1,0,0,0,0|1,0,0]=2 352 B11R2.55 Cc1cccnc1[C@H]2CO2 Amb33359955 [0,1,0,0,0,0|1,0,0]=2 353 B11R2.55 Cc1ccncc1C2CC2 Amb22235727 [0,1,0,0,0,0|2,0,0]=3 354 B11R2.55 Cc1ccncc1C2CO2 Amb33377092 [0,1,0,0,0,0|1,0,0]=2 355 B11R2.55 Cc1ccncc1[C@@H]2CO2 Amb33374922 [0,1,0,0,0,0|1,0,0]=2 356 B11R2.55 Cc1ccncc1[C@H]2CO2 Amb33374923 [0,1,0,0,0,0|1,0,0]=2 357 B11R2.55 Cc1cnccc1C2CO2 Amb33414504 [0,1,0,0,0,0|1,0,0]=2 358 B11R2.55 Cc1cnccc1[C@@H]2CO2 Amb33426082 [0,1,0,0,0,0|1,0,0]=2 359 B11R2.55 Cc1cnccc1[C@H]2CO2 Amb33426083 [0,1,0,0,0,0|1,0,0]=2 360 B11R2.55 Cc1ncccc1C2CC2 Amb22276237 [0,1,0,0,0,0|2,0,0]=3 361 B11R2.55 Cc1ncccc1C2CO2 Amb32880122 [0,1,0,0,0,0|1,0,0]=2 362 B11R2.55 Cc1ncccc1[C@@H]2CO2 Amb33224402 [0,1,0,0,0,0|1,0,0]=2 363 B11R2.55 Cc1ncccc1[C@H]2CO2 Amb32877471 [0,1,0,0,0,0|1,0,0]=2 364 B11R2.55 Cc1nccnc1C2CO2 Amb33142500 [0,1,0,0,0,0|2,0,0]=3 365 B11R2.55 Cc1nccnc1[C@@H]2CO2 Amb26642365 [0,1,0,0,0,0|2,0,0]=3 366 B11R2.55 Cc1nccnc1[C@H]2CO2 Amb24601905 [0,1,0,0,0,0|2,0,0]=3 367 B11R2.55 Cc1ncncc1C2CO2 Amb33472484 [0,1,0,0,0,0|2,0,0]=3 368 B11R2.55 Cc1ncncc1[C@@H]2CO2 Amb32876359 [0,1,0,0,0,0|2,0,0]=3 369 B11R2.55 Cc1ncncc1[C@H]2CO2 Amb32876360 [0,1,0,0,0,0|2,0,0]=3 370 B11R2.55 Clc1ccccc1C2CC2 Amb22737226 [0,1,0,0,0,0|1,0,0]=2 371 B11R2.55 Clc1ccccc1C2CN2 Amb18224351 [0,1,0,0,0,0|1,0,0]=2 372 B11R2.55 Clc1ccccc1C2CO2 Amb1136428 [0,1,0,0,0,0|0,0,0]=1 373 B11R2.55 Clc1ccccc1[C@@H]2CO2 Amb27470320 [0,1,0,0,0,0|0,0,0]=1 374 B11R2.55 Clc1ccccc1[C@H]2CO2 Amb26405300 [0,1,0,0,0,0|0,0,0]=1 375 B11R2.55 Clc1cccnc1C2CC2 Amb23401490 [0,1,0,0,0,0|2,0,0]=3 376 B11R2.55 Clc1ccncc1C2CC2 Amb22276374 [0,1,0,0,0,0|2,0,0]=3 377 B11R2.55 Clc1ccncc1C2CC2 Amb30634197 [0,1,0,0,0,0|2,0,0]=3 378 B11R2.55 Clc1cnccc1C2CC2 Amb27263877 [0,1,0,0,0,0|2,0,0]=3 379 B11R2.55 Clc1cnccc1C2CO2 Amb26343754 [0,1,0,0,0,0|1,0,0]=2 380 B11R2.55 Clc1cnccc1[C@@H]2CO2 Amb33057024 [0,1,0,0,0,0|1,0,0]=2 381 B11R2.55 Clc1cnccc1[C@H]2CO2 Amb33057023 [0,1,0,0,0,0|1,0,0]=2 382 B11R2.55 Clc1ncccc1C2CO2 Amb33257235 [0,1,0,0,0,0|1,0,0]=2 383 B11R2.55 Clc1ncccc1[C@@H]2CO2 Amb33263119 [0,1,0,0,0,0|1,0,0]=2 384 B11R2.55 Clc1ncccc1[C@H]2CO2 Amb33257394 [0,1,0,0,0,0|1,0,0]=2 385 B11R2.55 Clc1nccnc1C2CC2 Amb33971606 [0,1,0,0,0,0|3,0,0]=4 386 B11R2.55 Fc1ccccc1C2CC2 Amb27432397 [0,1,0,0,0,0|1,0,0]=2 387 B11R2.55 Fc1ccccc1C2CN2 Amb18222139 [0,1,0,0,0,0|1,0,0]=2 388 B11R2.55 Fc1ccccc1C2CO2 Amb9707103 [0,1,0,0,0,0|0,0,0]=1 389 B11R2.55 Fc1ccccc1[C@@H]2CO2 Amb26642147 [0,1,0,0,0,0|0,0,0]=1 390 B11R2.55 Fc1ccccc1[C@H]2CO2 Amb25859332 [0,1,0,0,0,0|0,0,0]=1 391 B11R2.55 Fc1cccnc1C2CO2 Amb33419179 [0,1,0,0,0,0|1,0,0]=2 392 B11R2.55 Fc1cccnc1[C@@H]2CO2 Amb33327437 [0,1,0,0,0,0|1,0,0]=2 393 B11R2.55 Fc1cccnc1[C@H]2CO2 Amb33327438 [0,1,0,0,0,0|1,0,0]=2 394 B11R2.55 Fc1cnccc1C2CO2 Amb26427650 [0,1,0,0,0,0|1,0,0]=2 395 B11R2.55 Fc1cnccc1[C@@H]2CO2 Amb33316456 [0,1,0,0,0,0|1,0,0]=2 396 B11R2.55 Fc1cnccc1[C@H]2CO2 Amb33316457 [0,1,0,0,0,0|1,0,0]=2 397 B11R2.55 Fc1ncccc1C2CC2 Amb22276397 [0,1,0,0,0,0|2,0,0]=3 398 B11R2.55 Fc1ncccc1C2CO2 Amb33378310 [0,1,0,0,0,0|1,0,0]=2 399 B11R2.55 Fc1ncccc1[C@@H]2CO2 Amb33376448 [0,1,0,0,0,0|1,0,0]=2 400 B11R2.55 Fc1ncccc1[C@H]2CO2 Amb33376449 [0,1,0,0,0,0|1,0,0]=2 401 B11R2.55 Fc1nccnc1C2CC2 Amb35598366 [0,1,0,0,0,0|3,0,0]=4 402 B11R2.55 Ic1ccccc1C2CC2 Amb22900094 [0,1,0,0,0,0|1,0,0]=2 403 B11R2.55 Ic1ccccc1C2CO2 Amb27869435 [0,1,0,0,0,0|0,0,0]=1 404 B11R2.55 Ic1cnccc1C2CC2 Amb28136751 [0,1,0,0,0,0|2,0,0]=3 405 B11R2.55 Ic1nccnc1C2CC2 Amb35598365 [0,1,0,0,0,0|3,0,0]=4 406 B11R2.55 Nc1ccccc1C2CC2 Amb1933788 [0,1,0,0,0,0|1,0,0]=2 407 B11R2.55 Nc1ccccc1C2CC2 Amb4302533 [0,1,0,0,0,0|1,0,0]=2 408 B11R2.55 Nc1cccnc1C2CC2 Amb33552862 [0,1,0,0,0,0|2,0,0]=3 409 B11R2.55 Nc1ccncc1C2CC2 Amb22276361 [0,1,0,0,0,0|2,0,0]=3 410 B11R2.55 Nc1cnccc1C2CC2 Amb22737113 [0,1,0,0,0,0|2,0,0]=3 411 B11R2.55 Nc1cncnc1C2CC2 Amb18677294 [0,1,0,0,0,0|3,0,0]=4 412 B11R2.55 Nc1ncccc1C2CC2 Amb22276264 [0,1,0,0,0,0|2,0,0]=3 413 B11R2.55 Nc1ncccc1C2CO2 Amb27872157 [0,1,0,0,0,0|1,0,0]=2 414 B11R2.55 Nc1ncccc1[C@@H]2CO2 Amb28341885 [0,1,0,0,0,0|1,0,0]=2 415 B11R2.55 Nc1nccnc1C2CC2 Amb33544912 [0,1,0,0,0,0|3,0,0]=4 416 B11R2.55 Nc1ncncc1C2CC2 Amb32681897 [0,1,0,0,0,0|3,0,0]=4 417 B11R2.55 O=C1NC=CC=C1C2CC2 Amb22276350 [0,1,0,0,0,0|2,0,0]=3 418 B11R2.55 O=C1NC=CN=C1C2CC2 Amb25369516 [0,1,0,0,0,0|3,0,0]=4 419 B11R2.55 Oc1ccccc1C2=NO2 Amb28074741 [0,1,0,0,0,0|1,0,1]=3 420 B11R2.55 Oc1ccccc1C2CC2 Amb9769894 [0,1,0,0,0,0|1,0,0]=2 421 B11R2.55 Oc1ccccc1C2CO2 Amb22055488 [0,1,0,0,0,0|0,0,0]=1 422 B11R2.55 Oc1ccncc1C2CC2 Amb33189018 [0,1,0,0,0,0|2,0,0]=3 423 B11R2.55 Oc1ncccc1C2CO2 Amb27950554 [0,1,0,0,0,0|1,0,0]=2 424 B11R2.55 S=C1NC=CN=C1C2CC2 Amb27434029 [0,1,0,0,0,0|3,0,0]=4 425 B11R2.55 Sc1ccccc1C2CC2 Amb25293886 [0,1,0,0,0,0|1,0,0]=2 426 B11R2.55 [O-][n+]1ccccc1C2CC2 Amb28066762 [0,1,0,0,0,0|2,0,0]=3 427 B9R1.6 BrC(Br)c1ccccc1 Amb8513496 [0,0,1,0,0,0|2,0,0]=3 428 B9R1.6 C=C(Br)c1ccccc1 Amb8516473 [0,0,1,0,0,0|1,0,2]=4 429 B9R1.6 C=C(C)c1ccccc1 Amb8394996 [0,0,1,0,0,0|1,0,1]=3 430 B9R1.6 C=C(C)c1ccccn1 Amb25077592 [0,0,1,0,0,0|2,0,1]=4 431 B9R1.6 C=C(C)c1cccnc1 Amb26389581 [0,0,1,0,0,0|2,0,1]=4 432 B9R1.6 C=C(C)c1ccncc1 Amb25126374 [0,0,1,0,0,0|2,0,1]=4 433 B9R1.6 C=C(Cl)c1ccccc1 Amb27775278 [0,0,1,0,0,0|1,0,2]=4 434 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [0,0,1,0,0,0|1,0,2]=4 435 B9R1.6 CC(=N)c1cccnc1 Amb22170296 [0,0,1,0,0,0|2,0,1]=4 436 B9R1.6 CC(=O)c1ccccc1 Amb2792761 [0,0,1,0,0,0|0,0,2]=3 437 B9R1.6 CC(=O)c1ccccn1 Amb932786 [0,0,1,0,0,0|1,0,2]=4 438 B9R1.6 CC(=O)c1cccnc1 Amb2610530 [0,0,1,0,0,0|1,0,2]=4 439 B9R1.6 CC(=O)c1ccncc1 Amb2792762 [0,0,1,0,0,0|1,0,2]=4 440 B9R1.6 CC(Br)c1ccccc1 Amb5716854 [0,0,1,0,0,0|1,0,0]=2 441 B9R1.6 CC(Br)c1ccccn1 Amb6770323 [0,0,1,0,0,0|2,0,0]=3 442 B9R1.6 CC(Br)c1ccccn1 Amb8835436 [0,0,1,0,0,0|2,0,0]=3 443 B9R1.6 CC(Br)c1cccnc1 Amb33552368 [0,0,1,0,0,0|2,0,0]=3 444 B9R1.6 CC(Br)c1cccnc1 Amb8835401 [0,0,1,0,0,0|2,0,0]=3 445 B9R1.6 CC(Br)c1ccncc1 Amb10610143 [0,0,1,0,0,0|2,0,0]=3 446 B9R1.6 CC(Br)c1ccncc1 Amb9210657 [0,0,1,0,0,0|2,0,0]=3 447 B9R1.6 CC(Br)c1cnccn1 Amb21862010 [0,0,1,0,0,0|3,0,0]=4 448 B9R1.6 CC(Br)c1cncnc1 Amb27845417 [0,0,1,0,0,0|3,0,0]=4 449 B9R1.6 CC(C)c1ccccc1 Amb2793016 [0,0,1,0,0,0|1,0,0]=2 450 B9R1.6 CC(C)c1ccccc1 Amb33524021 [0,0,1,0,0,0|1,0,0]=2 451 B9R1.6 CC(C)c1ccccn1 Amb8438962 [0,0,1,0,0,0|2,0,0]=3 452 B9R1.6 CC(C)c1cccnc1 Amb24320774 [0,0,1,0,0,0|2,0,0]=3 453 B9R1.6 CC(C)c1cccnn1 Amb26572070 [0,0,1,0,0,0|3,0,0]=4 454 B9R1.6 CC(C)c1ccncc1 Amb2694187 [0,0,1,0,0,0|2,0,0]=3 455 B9R1.6 CC(C)c1ccncn1 Amb24070425 [0,0,1,0,0,0|3,0,0]=4 456 B9R1.6 CC(Cl)c1ccccc1 Amb5716855 [0,0,1,0,0,0|1,0,0]=2 457 B9R1.6 CC(Cl)c1ccccn1 Amb10610197 [0,0,1,0,0,0|2,0,0]=3 458 B9R1.6 CC(Cl)c1ccccn1 Amb9205056 [0,0,1,0,0,0|2,0,0]=3 459 B9R1.6 CC(Cl)c1cccnc1 Amb13952205 [0,0,1,0,0,0|2,0,0]=3 460 B9R1.6 CC(Cl)c1cccnc1 Amb9205037 [0,0,1,0,0,0|2,0,0]=3 461 B9R1.6 CC(Cl)c1ccncc1 Amb19514972 [0,0,1,0,0,0|2,0,0]=3 462 B9R1.6 CC(Cl)c1ccncc1 Amb9205038 [0,0,1,0,0,0|2,0,0]=3 463 B9R1.6 CC(Cl)c1ccncn1 Amb27245210 [0,0,1,0,0,0|3,0,0]=4 464 B9R1.6 CC(Cl)c1cnccn1 Amb20618636 [0,0,1,0,0,0|3,0,0]=4 465 B9R1.6 CC(Cl)c1ncccn1 Amb26326722 [0,0,1,0,0,0|3,0,0]=4 466 B9R1.6 CC(Cl)c1ncccn1 Amb32668192 [0,0,1,0,0,0|3,0,0]=4 467 B9R1.6 CC(N)c1ccccc1 Amb5716844 [0,0,1,0,0,0|1,0,0]=2 468 B9R1.6 CC(N)c1ccccn1 Amb1102610 [0,0,1,0,0,0|2,0,0]=3 469 B9R1.6 CC(N)c1ccccn1 Amb22265614 [0,0,1,0,0,0|2,0,0]=3 470 B9R1.6 CC(N)c1ccccn1 Amb24064899 [0,0,1,0,0,0|2,0,0]=3 471 B9R1.6 CC(N)c1ccccn1 Amb31206895 [0,0,1,0,0,0|2,0,0]=3 472 B9R1.6 CC(N)c1cccnc1 Amb1214297 [0,0,1,0,0,0|2,0,0]=3 473 B9R1.6 CC(N)c1cccnc1 Amb22754521 [0,0,1,0,0,0|2,0,0]=3 474 B9R1.6 CC(N)c1ccncc1 Amb19958395 [0,0,1,0,0,0|2,0,0]=3 475 B9R1.6 CC(N)c1ccncc1 Amb32662788 [0,0,1,0,0,0|2,0,0]=3 476 B9R1.6 CC(N)c1ccncc1 Amb9745700 [0,0,1,0,0,0|2,0,0]=3 477 B9R1.6 CC(N)c1ccncn1 Amb10608543 [0,0,1,0,0,0|3,0,0]=4 478 B9R1.6 CC(N)c1ccncn1 Amb22587681 [0,0,1,0,0,0|3,0,0]=4 479 B9R1.6 CC(N)c1ccnnc1 Amb21964416 [0,0,1,0,0,0|3,0,0]=4 480 B9R1.6 CC(N)c1ccnnc1 Amb22757188 [0,0,1,0,0,0|3,0,0]=4 481 B9R1.6 CC(N)c1cnccn1 Amb18278310 [0,0,1,0,0,0|3,0,0]=4 482 B9R1.6 CC(N)c1cnccn1 Amb32752562 [0,0,1,0,0,0|3,0,0]=4 483 B9R1.6 CC(N)c1cncnc1 Amb8010526 [0,0,1,0,0,0|3,0,0]=4 484 B9R1.6 CC(N)c1ncccn1 Amb22757229 [0,0,1,0,0,0|3,0,0]=4 485 B9R1.6 CC(N)c1ncccn1 Amb30585152 [0,0,1,0,0,0|3,0,0]=4 486 B9R1.6 CC(N)c1ncccn1 Amb8010520 [0,0,1,0,0,0|3,0,0]=4 487 B9R1.6 CC(O)C1C=C=CC=C1 Amb27197983 [0,0,1,0,0,0|0,0,2]=3 488 B9R1.6 CC(O)c1ccccc1 Amb3940114 [0,0,1,0,0,0|0,0,0]=1 489 B9R1.6 CC(O)c1ccccn1 Amb32666055 [0,0,1,0,0,0|1,0,0]=2 490 B9R1.6 CC(O)c1ccccn1 Amb9748230 [0,0,1,0,0,0|1,0,0]=2 491 B9R1.6 CC(O)c1cccnc1 Amb9748268 [0,0,1,0,0,0|1,0,0]=2 492 B9R1.6 CC(O)c1cccnn1 Amb26346035 [0,0,1,0,0,0|2,0,0]=3 493 B9R1.6 CC(O)c1ccncc1 Amb6705768 [0,0,1,0,0,0|1,0,0]=2 494 B9R1.6 CC(O)c1ccncn1 Amb24477841 [0,0,1,0,0,0|2,0,0]=3 495 B9R1.6 CC(O)c1cnccn1 Amb13952214 [0,0,1,0,0,0|2,0,0]=3 496 B9R1.6 CC(O)c1cncnc1 Amb22055840 [0,0,1,0,0,0|2,0,0]=3 497 B9R1.6 CC(O)c1ncccn1 Amb22284841 [0,0,1,0,0,0|2,0,0]=3 498 B9R1.6 CC(S)c1ccccc1 Amb6256013 [0,0,1,0,0,0|0,1,0]=2 499 B9R1.6 CC(S)c1ccccn1 Amb9208044 [0,0,1,0,0,0|1,1,0]=3 500 B9R1.6 CC(S)c1cccnc1 Amb9208030 [0,0,1,0,0,0|1,1,0]=3 501 B9R1.6 CC(S)c1ccncc1 Amb9208031 [0,0,1,0,0,0|1,1,0]=3 502 B9R1.6 CC(S)c1ccncn1 Amb25917576 [0,0,1,0,0,0|2,1,0]=4 503 B9R1.6 CC(S)c1cnccn1 Amb22267831 [0,0,1,0,0,0|2,1,0]=4 504 B9R1.6 CN(C)c1ccccc1 Amb2793014 [0,0,1,0,0,0|2,0,0]=3 505 B9R1.6 CN(C)c1ccccn1 Amb9825822 [0,0,1,0,0,0|3,0,0]=4 506 B9R1.6 CN(C)c1cccnc1 Amb2622130 [0,0,1,0,0,0|3,0,0]=4 507 B9R1.6 CN(C)c1ccncc1 Amb2613773 [0,0,1,0,0,0|3,0,0]=4 508 B9R1.6 CN(N)c1ccccc1 Amb1153615 [0,0,1,0,0,0|2,0,0]=3 509 B9R1.6 CN(N)c1ccccc1 Amb22754142 [0,0,1,0,0,0|2,0,0]=3 510 B9R1.6 CN(N)c1ccccc1 Amb33172726 [0,0,1,0,0,0|2,0,0]=3 511 B9R1.6 CN(N)c1ccccc1 Amb9677307 [0,0,1,0,0,0|2,0,0]=3 512 B9R1.6 CN(N)c1ccccn1 Amb18642128 [0,0,1,0,0,0|3,0,0]=4 513 B9R1.6 CN(N)c1cccnc1 Amb24085137 [0,0,1,0,0,0|3,0,0]=4 514 B9R1.6 CN(N)c1ccncc1 Amb26494358 [0,0,1,0,0,0|3,0,0]=4 515 B9R1.6 CN(O)c1ccccc1 Amb28245898 [0,0,1,0,0,0|1,0,0]=2 516 B9R1.6 CP(C)c1ccncc1 Amb35750173 [0,0,1,0,0,0|3,0,0]=4 517 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [0,0,1,0,0,0|2,0,0]=3 518 B9R1.6 CS(=O)c1ccccc1 Amb8516154 [0,0,1,0,0,0|1,0,1]=3 519 B9R1.6 CS(=O)c1ccccn1 Amb24562247 [0,0,1,0,0,0|2,0,1]=4 520 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [0,0,1,0,0,0|1,0,0]=2 521 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [0,0,1,0,0,0|1,0,0]=2 522 B9R1.6 C[C@@H](N)c1ccccc1 Amb3940166 [0,0,1,0,0,0|1,0,0]=2 523 B9R1.6 C[C@@H](N)c1ccccn1 Amb19514583 [0,0,1,0,0,0|2,0,0]=3 524 B9R1.6 C[C@@H](N)c1ccccn1 Amb2695967 [0,0,1,0,0,0|2,0,0]=3 525 B9R1.6 C[C@@H](N)c1ccccn1 Amb30526699 [0,0,1,0,0,0|2,0,0]=3 526 B9R1.6 C[C@@H](N)c1cccnc1 Amb13951181 [0,0,1,0,0,0|2,0,0]=3 527 B9R1.6 C[C@@H](N)c1cccnc1 Amb6893473 [0,0,1,0,0,0|2,0,0]=3 528 B9R1.6 C[C@@H](N)c1ccncc1 Amb13952719 [0,0,1,0,0,0|2,0,0]=3 529 B9R1.6 C[C@@H](N)c1ccncc1 Amb6893468 [0,0,1,0,0,0|2,0,0]=3 530 B9R1.6 C[C@@H](N)c1ccncn1 Amb18832953 [0,0,1,0,0,0|3,0,0]=4 531 B9R1.6 C[C@@H](N)c1cnccn1 Amb22747093 [0,0,1,0,0,0|3,0,0]=4 532 B9R1.6 C[C@@H](N)c1cnccn1 Amb32664964 [0,0,1,0,0,0|3,0,0]=4 533 B9R1.6 C[C@@H](N)c1cncnc1 Amb23439227 [0,0,1,0,0,0|3,0,0]=4 534 B9R1.6 C[C@@H](N)c1cncnc1 Amb25727204 [0,0,1,0,0,0|3,0,0]=4 535 B9R1.6 C[C@@H](N)c1ncccn1 Amb27264293 [0,0,1,0,0,0|3,0,0]=4 536 B9R1.6 C[C@@H](O)c1ccccc1 Amb6366772 [0,0,1,0,0,0|0,0,0]=1 537 B9R1.6 C[C@@H](O)c1ccccn1 Amb24087444 [0,0,1,0,0,0|1,0,0]=2 538 B9R1.6 C[C@@H](O)c1ccccn1 Amb4166327 [0,0,1,0,0,0|1,0,0]=2 539 B9R1.6 C[C@@H](O)c1cccnc1 Amb6893471 [0,0,1,0,0,0|1,0,0]=2 540 B9R1.6 C[C@@H](O)c1ccncc1 Amb6893466 [0,0,1,0,0,0|1,0,0]=2 541 B9R1.6 C[C@@H](O)c1ccncn1 Amb27235358 [0,0,1,0,0,0|2,0,0]=3 542 B9R1.6 C[C@@H](O)c1cnccn1 Amb19514758 [0,0,1,0,0,0|2,0,0]=3 543 B9R1.6 C[C@@H](O)c1cncnc1 Amb27265907 [0,0,1,0,0,0|2,0,0]=3 544 B9R1.6 C[C@@H](O)c1ncccn1 Amb25313724 [0,0,1,0,0,0|2,0,0]=3 545 B9R1.6 C[C@@H](S)c1ccccc1 Amb28069838 [0,0,1,0,0,0|0,1,0]=2 546 B9R1.6 C[C@H](Br)c1ccccn1 Amb28123940 [0,0,1,0,0,0|2,0,0]=3 547 B9R1.6 C[C@H](Cl)c1ccccn1 Amb33068907 [0,0,1,0,0,0|2,0,0]=3 548 B9R1.6 C[C@H](N)C1=C=CCC=C1 Amb28368961 [0,0,1,0,0,0|1,0,2]=4 549 B9R1.6 C[C@H](N)C1C=C=CC=C1 Amb28118529 [0,0,1,0,0,0|1,0,2]=4 550 B9R1.6 C[C@H](N)c1ccccc1 Amb2725550 [0,0,1,0,0,0|1,0,0]=2 551 B9R1.6 C[C@H](N)c1ccccn1 Amb13951343 [0,0,1,0,0,0|2,0,0]=3 552 B9R1.6 C[C@H](N)c1ccccn1 Amb33871554 [0,0,1,0,0,0|2,0,0]=3 553 B9R1.6 C[C@H](N)c1ccccn1 Amb6893465 [0,0,1,0,0,0|2,0,0]=3 554 B9R1.6 C[C@H](N)c1cccnc1 Amb30647445 [0,0,1,0,0,0|2,0,0]=3 555 B9R1.6 C[C@H](N)c1cccnc1 Amb6893472 [0,0,1,0,0,0|2,0,0]=3 556 B9R1.6 C[C@H](N)c1ccncc1 Amb28895917 [0,0,1,0,0,0|2,0,0]=3 557 B9R1.6 C[C@H](N)c1ccncc1 Amb6893469 [0,0,1,0,0,0|2,0,0]=3 558 B9R1.6 C[C@H](N)c1ccncn1 Amb24099656 [0,0,1,0,0,0|3,0,0]=4 559 B9R1.6 C[C@H](N)c1cnccn1 Amb25980810 [0,0,1,0,0,0|3,0,0]=4 560 B9R1.6 C[C@H](N)c1cnccn1 Amb32665356 [0,0,1,0,0,0|3,0,0]=4 561 B9R1.6 C[C@H](N)c1cncnc1 Amb25691811 [0,0,1,0,0,0|3,0,0]=4 562 B9R1.6 C[C@H](N)c1ncccn1 Amb27437960 [0,0,1,0,0,0|3,0,0]=4 563 B9R1.6 C[C@H](O)c1ccccc1 Amb4021849 [0,0,1,0,0,0|0,0,0]=1 564 B9R1.6 C[C@H](O)c1ccccn1 Amb30526838 [0,0,1,0,0,0|1,0,0]=2 565 B9R1.6 C[C@H](O)c1cccnc1 Amb6893470 [0,0,1,0,0,0|1,0,0]=2 566 B9R1.6 C[C@H](O)c1ccncc1 Amb6893467 [0,0,1,0,0,0|1,0,0]=2 567 B9R1.6 C[C@H](O)c1ccncn1 Amb26019235 [0,0,1,0,0,0|2,0,0]=3 568 B9R1.6 C[C@H](O)c1cnccn1 Amb26977321 [0,0,1,0,0,0|2,0,0]=3 569 B9R1.6 C[C@H](O)c1cncnc1 Amb25259575 [0,0,1,0,0,0|2,0,0]=3 570 B9R1.6 C[C@H](O)c1ncccn1 Amb24428544 [0,0,1,0,0,0|2,0,0]=3 571 B9R1.6 C[C@H](S)c1ccccc1 Amb25935694 [0,0,1,0,0,0|0,1,0]=2 572 B9R1.6 C[S+](C)c1ccccc1 Amb27958149 [0,0,1,0,0,0|2,0,0]=3 573 B9R1.6 C[SiH](C)c1ccccn1 Amb22336977 [0,0,1,0,0,0|2,1,0]=4 574 B9R1.6 C[Si](C)c1ccccc1 Amb33781101 [0,0,1,0,0,0|1,1,0]=3 575 B9R1.6 ClB(Cl)c1ccccc1 Amb8515558 [0,0,1,0,0,0|3,0,0]=4 576 B9R1.6 ClC(Cl)c1ccccn1 Amb22295832 [0,0,1,0,0,0|3,0,0]=4 577 B9R1.6 ClP(Cl)c1ccccc1 Amb6365769 [0,0,1,0,0,0|3,0,0]=4 578 B9R1.6 Cl[IH2](Cl)c1ccccc1 Amb10071738 [0,0,1,0,0,0|3,0,0]=4 579 B9R1.6 FC(Cl)c1ccccc1 Amb10838337 [0,0,1,0,0,0|2,0,0]=3 580 B9R1.6 FC(F)c1ccccc1 Amb10606272 [0,0,1,0,0,0|2,0,0]=3 581 B9R1.6 FC(F)c1ccccn1 Amb19894454 [0,0,1,0,0,0|3,0,0]=4 582 B9R1.6 FC(F)c1cccnc1 Amb10605994 [0,0,1,0,0,0|3,0,0]=4 583 B9R1.6 FC(F)c1ccncc1 Amb19894457 [0,0,1,0,0,0|3,0,0]=4 584 B9R1.6 N=C(Cl)c1ccccc1 Amb28285285 [0,0,1,0,0,0|2,0,1]=4 585 B9R1.6 N=C(N)c1ccccc1 Amb10068704 [0,0,1,0,0,0|2,0,1]=4 586 B9R1.6 N=C(N)c1ccccc1 Amb2371546 [0,0,1,0,0,0|2,0,1]=4 587 B9R1.6 N=C(N)c1ccccc1 Amb6337518 [0,0,1,0,0,0|2,0,1]=4 588 B9R1.6 NC(=O)c1ccccc1 Amb6399766 [0,0,1,0,0,0|1,0,2]=4 589 B9R1.6 NC(=S)c1ccccc1 Amb6338789 [0,0,1,0,0,0|1,1,1]=4 590 B9R1.6 NC(F)c1ccncc1 Amb27844854 [0,0,1,0,0,0|3,0,0]=4 591 B9R1.6 NC(N)c1ccccc1 Amb28069502 [0,0,1,0,0,0|2,0,0]=3 592 B9R1.6 NC(N)c1ccncc1 Amb24079161 [0,0,1,0,0,0|3,0,0]=4 593 B9R1.6 NS(=O)c1ccccc1 Amb26487323 [0,0,1,0,0,0|2,0,1]=4 594 B9R1.6 O=C(Br)c1ccccc1 Amb8513573 [0,0,1,0,0,0|1,0,2]=4 595 B9R1.6 O=C(Cl)c1ccccc1 Amb3939302 [0,0,1,0,0,0|1,0,2]=4 596 B9R1.6 O=C(F)c1ccccc1 Amb10607152 [0,0,1,0,0,0|1,0,2]=4 597 B9R1.6 O=C(O)c1ccccc1 Amb1935196 [0,0,1,0,0,0|1,0,1]=3 598 B9R1.6 O=C(O)c1ccccc1 Amb22002523 [0,0,1,0,0,0|1,0,1]=3 599 B9R1.6 O=C(O)c1ccccc1 Amb22336602 [0,0,1,0,0,0|1,0,1]=3 600 B9R1.6 O=C(O)c1ccccc1 Amb22351742 [0,0,1,0,0,0|1,0,1]=3 601 B9R1.6 O=C(O)c1ccccn1 Amb1227737 [0,0,1,0,0,0|2,0,1]=4 602 B9R1.6 O=C(O)c1ccccn1 Amb4035065 [0,0,1,0,0,0|2,0,1]=4 603 B9R1.6 O=C(O)c1cccnc1 Amb1195995 [0,0,1,0,0,0|2,0,1]=4 604 B9R1.6 O=C(O)c1ccncc1 Amb2609990 [0,0,1,0,0,0|2,0,1]=4 605 B9R1.6 O=C(S)c1ccccc1 Amb8513358 [0,0,1,0,0,0|1,0,2]=4 606 B9R1.6 O=C([O-])c1ccccc1 Amb22053472 [0,0,1,0,0,0|1,0,2]=4 607 B9R1.6 O=C([O-])c1ccccc1 Amb22168438 [0,0,1,0,0,0|1,0,2]=4 608 B9R1.6 O=C([O-])c1ccccc1 Amb8387740 [0,0,1,0,0,0|1,0,2]=4 609 B9R1.6 O=C([O-])c1ccccc1 Amb8513916 [0,0,1,0,0,0|1,0,2]=4 610 B9R1.6 O=C([O-])c1ccccc1 Amb8517378 [0,0,1,0,0,0|1,0,2]=4 611 B9R1.6 O=I(=O)c1ccccc1 Amb9679129 [0,0,1,0,0,0|2,0,1]=4 612 B9R1.6 O=S(Cl)c1ccccc1 Amb13881360 [0,0,1,0,0,0|2,0,1]=4 613 B9R1.6 O=S(O)c1ccccc1 Amb17939345 [0,0,1,0,0,0|2,0,0]=3 614 B9R1.6 O=S(O)c1cccnc1 Amb24062548 [0,0,1,0,0,0|3,0,0]=4 615 B9R1.6 O=S(O)c1cccnc1 Amb32674890 [0,0,1,0,0,0|3,0,0]=4 616 B9R1.6 O=S([O-])c1ccccc1 Amb2684569 [0,0,1,0,0,0|2,0,1]=4 617 B9R1.6 O=S([O-])c1ccccc1 Amb28536248 [0,0,1,0,0,0|2,0,1]=4 618 B9R1.6 O=[N+]([O-])c1ccccc1 Amb2793077 [0,0,1,0,0,0|2,0,1]=4 619 B9R1.6 O=[PH](O)c1ccccc1 Amb3371978 [0,0,1,0,0,0|2,0,0]=3 620 B9R1.6 O=[Se](O)c1ccccc1 Amb4138617 [0,0,1,0,0,0|2,0,0]=3 621 B9R1.6 OB(O)c1ccccc1 Amb22587706 [0,0,1,0,0,0|2,0,0]=3 622 B9R1.6 OB(O)c1ccccc1 Amb6365485 [0,0,1,0,0,0|2,0,0]=3 623 B9R1.6 OB(O)c1ccccn1 Amb2383498 [0,0,1,0,0,0|3,0,0]=4 624 B9R1.6 OB(O)c1cccnc1 Amb1353193 [0,0,1,0,0,0|3,0,0]=4 625 B9R1.6 OB(O)c1cccnc1 Amb21954295 [0,0,1,0,0,0|3,0,0]=4 626 B9R1.6 OB(O)c1ccncc1 Amb13887063 [0,0,1,0,0,0|3,0,0]=4 627 B9R1.6 OB(O)c1ccncc1 Amb2383497 [0,0,1,0,0,0|3,0,0]=4 628 B9R1.6 OB(O)c1ccncc1 Amb2690422 [0,0,1,0,0,0|3,0,0]=4 629 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [0,0,1,0,0,0|1,0,1]=3 630 B9R1.6 OC(=S)c1cccnc1 Amb22731908 [0,0,1,0,0,0|2,0,1]=4 631 B9R1.6 OC(O)c1ncccn1 Amb27853203 [0,0,1,0,0,0|3,0,0]=4 632 B9R1.6 ON(O)c1ccncc1 Amb24572621 [0,0,1,0,0,0|3,0,0]=4 633 B9R1.6 OP(O)c1ccccc1 Amb2684568 [0,0,1,0,0,0|2,0,0]=3 634 B9R1.6 O[C@@H](Br)c1ccccc1 Amb27233551 [0,0,1,0,0,0|1,0,0]=2 635 B9R1.6 O[C@@H](Cl)c1ccccc1 Amb28119929 [0,0,1,0,0,0|1,0,0]=2 636 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [0,0,1,0,0,0|1,1,1]=4 637 B9R1.6 S=C(S)c1ccccc1 Amb22051683 [0,0,1,0,0,0|1,1,1]=4 638 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [0,0,1,0,0,0|1,0,2]=4 639 B9R1.8 BrCC[n+]1ccccc1 Amb2617784 [0,0,1,0,0,0|2,0,0]=3 640 B9R1.8 BrCC[n+]1ccccc1 Amb26365793 [0,0,1,0,0,0|2,0,0]=3 641 B9R1.8 BrCCc1ccccn1 Amb1102303 [0,0,1,0,0,0|2,0,0]=3 642 B9R1.8 BrCCc1ccccn1 Amb17935743 [0,0,1,0,0,0|2,0,0]=3 643 B9R1.8 BrCCc1cccnc1 Amb19069960 [0,0,1,0,0,0|2,0,0]=3 644 B9R1.8 BrCCc1cccnc1 Amb19372982 [0,0,1,0,0,0|2,0,0]=3 645 B9R1.8 BrCCc1ccncc1 Amb18326675 [0,0,1,0,0,0|2,0,0]=3 646 B9R1.8 BrCCc1ccncc1 Amb33313562 [0,0,1,0,0,0|2,0,0]=3 647 B9R1.8 BrCCc1ccncn1 Amb25681855 [0,0,1,0,0,0|3,0,0]=4 648 B9R1.8 BrCCc1cnccn1 Amb24652166 [0,0,1,0,0,0|3,0,0]=4 649 B9R1.8 BrCCc1cncnc1 Amb18327370 [0,0,1,0,0,0|3,0,0]=4 650 B9R1.8 BrCCc1ncccn1 Amb27813162 [0,0,1,0,0,0|3,0,0]=4 651 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [0,0,1,0,0,0|1,0,2]=4 652 B9R1.8 Br\C=C\c1ccccc1 Amb3940204 [0,0,1,0,0,0|1,0,2]=4 653 B9R1.8 C#CCc1ccccn1 Amb25759001 [0,0,1,0,0,0|2,0,1]=4 654 B9R1.8 C#CCc1cccnc1 Amb27219897 [0,0,1,0,0,0|2,0,1]=4 655 B9R1.8 C#CCc1ccncc1 Amb24478677 [0,0,1,0,0,0|2,0,1]=4 656 B9R1.8 C#COc1ccccc1 Amb27194589 [0,0,1,0,0,0|2,0,1]=4 657 B9R1.8 C#CSc1ccccc1 Amb17940373 [0,0,1,0,0,0|2,0,1]=4 658 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [0,0,1,0,0,0|2,0,1]=4 659 B9R1.8 C#NCc1ccccc1 Amb31132452 [0,0,1,0,0,0|1,0,1]=3 660 B9R1.8 C#NCc1ccccn1 Amb31132453 [0,0,1,0,0,0|2,0,1]=4 661 B9R1.8 C#NCc1cccnc1 Amb31132454 [0,0,1,0,0,0|2,0,1]=4 662 B9R1.8 C#NCc1ccncc1 Amb31132455 [0,0,1,0,0,0|2,0,1]=4 663 B9R1.8 C=CC[n+]1ccccc1 Amb27838939 [0,0,1,0,0,0|2,0,1]=4 664 B9R1.8 C=CCc1ccccc1 Amb2599341 [0,0,1,0,0,0|1,0,1]=3 665 B9R1.8 C=CCc1cccnc1 Amb24477831 [0,0,1,0,0,0|2,0,1]=4 666 B9R1.8 C=COc1ccccc1 Amb10564213 [0,0,1,0,0,0|2,0,1]=4 667 B9R1.8 C=CSc1ccccc1 Amb8387516 [0,0,1,0,0,0|2,0,1]=4 668 B9R1.8 C=NCc1ccccc1 Amb28256747 [0,0,1,0,0,0|1,0,1]=3 669 B9R1.8 C=NCc1ccncc1 Amb27758185 [0,0,1,0,0,0|2,0,1]=4 670 B9R1.8 CC#Cc1ccccc1 Amb8513696 [0,0,1,0,0,0|1,0,1]=3 671 B9R1.8 CC#Cc1ccccn1 Amb25147069 [0,0,1,0,0,0|2,0,1]=4 672 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [0,0,1,0,0,0|2,0,0]=3 673 B9R1.8 CCCc1ccccc1 Amb2447143 [0,0,1,0,0,0|1,0,0]=2 674 B9R1.8 CCCc1ccccn1 Amb6366812 [0,0,1,0,0,0|2,0,0]=3 675 B9R1.8 CCCc1cccnc1 Amb2613018 [0,0,1,0,0,0|2,0,0]=3 676 B9R1.8 CCCc1cccnn1 Amb24447402 [0,0,1,0,0,0|3,0,0]=4 677 B9R1.8 CCCc1ccncc1 Amb4017941 [0,0,1,0,0,0|2,0,0]=3 678 B9R1.8 CCCc1ccncn1 Amb24070638 [0,0,1,0,0,0|3,0,0]=4 679 B9R1.8 CCCc1cnccn1 Amb2690413 [0,0,1,0,0,0|3,0,0]=4 680 B9R1.8 CCNc1ccccc1 Amb3940127 [0,0,1,0,0,0|2,0,0]=3 681 B9R1.8 CCNc1ccccn1 Amb6640743 [0,0,1,0,0,0|3,0,0]=4 682 B9R1.8 CCNc1cccnc1 Amb6686634 [0,0,1,0,0,0|3,0,0]=4 683 B9R1.8 CCNc1ccncc1 Amb33545749 [0,0,1,0,0,0|3,0,0]=4 684 B9R1.8 CCOc1ccccc1 Amb2842270 [0,0,1,0,0,0|2,0,0]=3 685 B9R1.8 CCOc1ccccn1 Amb2609960 [0,0,1,0,0,0|3,0,0]=4 686 B9R1.8 CCOc1cccnc1 Amb10573342 [0,0,1,0,0,0|3,0,0]=4 687 B9R1.8 CCOc1ccncc1 Amb8396897 [0,0,1,0,0,0|3,0,0]=4 688 B9R1.8 CCSc1ccccc1 Amb2687929 [0,0,1,0,0,0|2,0,0]=3 689 B9R1.8 CCSc1ccccn1 Amb26656831 [0,0,1,0,0,0|3,0,0]=4 690 B9R1.8 CCSc1ccncc1 Amb27766422 [0,0,1,0,0,0|3,0,0]=4 691 B9R1.8 CNCc1ccccc1 Amb3699562 [0,0,1,0,0,0|1,0,0]=2 692 B9R1.8 CNCc1ccccn1 Amb10068750 [0,0,1,0,0,0|2,0,0]=3 693 B9R1.8 CNCc1ccccn1 Amb10576408 [0,0,1,0,0,0|2,0,0]=3 694 B9R1.8 CNCc1ccccn1 Amb3941148 [0,0,1,0,0,0|2,0,0]=3 695 B9R1.8 CNCc1cccnc1 Amb10066918 [0,0,1,0,0,0|2,0,0]=3 696 B9R1.8 CNCc1cccnc1 Amb10576409 [0,0,1,0,0,0|2,0,0]=3 697 B9R1.8 CNCc1cccnc1 Amb1648828 [0,0,1,0,0,0|2,0,0]=3 698 B9R1.8 CNCc1cccnn1 Amb32667437 [0,0,1,0,0,0|3,0,0]=4 699 B9R1.8 CNCc1cccnn1 Amb8010012 [0,0,1,0,0,0|3,0,0]=4 700 B9R1.8 CNCc1ccncc1 Amb10068773 [0,0,1,0,0,0|2,0,0]=3 701 B9R1.8 CNCc1ccncc1 Amb1115812 [0,0,1,0,0,0|2,0,0]=3 702 B9R1.8 CNCc1ccncn1 Amb21962059 [0,0,1,0,0,0|3,0,0]=4 703 B9R1.8 CNCc1ccncn1 Amb22587684 [0,0,1,0,0,0|3,0,0]=4 704 B9R1.8 CNCc1ccncn1 Amb3941356 [0,0,1,0,0,0|3,0,0]=4 705 B9R1.8 CNCc1ccnnc1 Amb24183593 [0,0,1,0,0,0|3,0,0]=4 706 B9R1.8 CNCc1ccnnc1 Amb27784160 [0,0,1,0,0,0|3,0,0]=4 707 B9R1.8 CNCc1cnccn1 Amb1094140 [0,0,1,0,0,0|3,0,0]=4 708 B9R1.8 CNCc1cnccn1 Amb21959600 [0,0,1,0,0,0|3,0,0]=4 709 B9R1.8 CNCc1cncnc1 Amb32664708 [0,0,1,0,0,0|3,0,0]=4 710 B9R1.8 CNCc1cncnc1 Amb8010525 [0,0,1,0,0,0|3,0,0]=4 711 B9R1.8 CNCc1ncccn1 Amb30585159 [0,0,1,0,0,0|3,0,0]=4 712 B9R1.8 CNCc1ncccn1 Amb8010518 [0,0,1,0,0,0|3,0,0]=4 713 B9R1.8 CNNc1ccccc1 Amb20242875 [0,0,1,0,0,0|2,0,0]=3 714 B9R1.8 CNNc1ccccc1 Amb27969267 [0,0,1,0,0,0|2,0,0]=3 715 B9R1.8 COCc1ccccc1 Amb2782562 [0,0,1,0,0,0|0,0,0]=1 716 B9R1.8 COCc1ccccn1 Amb4017561 [0,0,1,0,0,0|1,0,0]=2 717 B9R1.8 COCc1ccnnc1 Amb27224297 [0,0,1,0,0,0|2,0,0]=3 718 B9R1.8 COCc1cnccn1 Amb24656513 [0,0,1,0,0,0|2,0,0]=3 719 B9R1.8 CSCc1ccccn1 Amb27837576 [0,0,1,0,0,0|1,1,0]=3 720 B9R1.8 CSCc1cccnc1 Amb24523080 [0,0,1,0,0,0|1,1,0]=3 721 B9R1.8 CSCc1cncnc1 Amb27653014 [0,0,1,0,0,0|2,1,0]=4 722 B9R1.8 CSSc1ccccc1 Amb4008371 [0,0,1,0,0,0|1,1,0]=3 723 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [0,0,1,0,0,0|1,0,0]=2 724 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [0,0,1,0,0,0|1,0,1]=3 725 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [0,0,1,0,0,0|1,0,1]=3 726 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [0,0,1,0,0,0|2,0,0]=3 727 B9R1.8 C\C=N\c1cccnc1 Amb27787691 [0,0,1,0,0,0|3,0,0]=4 728 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [0,0,1,0,0,0|1,0,1]=3 729 B9R1.8 C\N=C\c1ccncc1 Amb22330508 [0,0,1,0,0,0|2,0,1]=4 730 B9R1.8 ClCC[n+]1ccccc1 Amb28195087 [0,0,1,0,0,0|2,0,0]=3 731 B9R1.8 ClCCc1ccccc1 Amb535682 [0,0,1,0,0,0|1,0,0]=2 732 B9R1.8 ClCCc1ccccn1 Amb1102254 [0,0,1,0,0,0|2,0,0]=3 733 B9R1.8 ClCCc1ccccn1 Amb19892295 [0,0,1,0,0,0|2,0,0]=3 734 B9R1.8 ClCCc1cccnc1 Amb24061504 [0,0,1,0,0,0|2,0,0]=3 735 B9R1.8 ClCCc1ccncc1 Amb23400891 [0,0,1,0,0,0|2,0,0]=3 736 B9R1.8 ClCCc1ccncc1 Amb9004339 [0,0,1,0,0,0|2,0,0]=3 737 B9R1.8 ClCCc1cnccn1 Amb33291299 [0,0,1,0,0,0|3,0,0]=4 738 B9R1.8 ClCCc1cncnc1 Amb24529105 [0,0,1,0,0,0|3,0,0]=4 739 B9R1.8 ClCOc1ccccc1 Amb22059503 [0,0,1,0,0,0|2,0,0]=3 740 B9R1.8 ClCSc1ccccn1 Amb27603302 [0,0,1,0,0,0|3,0,0]=4 741 B9R1.8 ClCSc1ccncc1 Amb27185726 [0,0,1,0,0,0|3,0,0]=4 742 B9R1.8 ClNCc1cccnc1 Amb27951574 [0,0,1,0,0,0|3,0,0]=4 743 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [0,0,1,0,0,0|1,0,2]=4 744 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [0,0,1,0,0,0|1,0,2]=4 745 B9R1.8 IC#Cc1ccccc1 Amb26442219 [0,0,1,0,0,0|1,0,2]=4 746 B9R1.8 ICCc1ccccc1 Amb8515353 [0,0,1,0,0,0|1,0,0]=2 747 B9R1.8 ICCc1cccnc1 Amb33534604 [0,0,1,0,0,0|2,0,0]=3 748 B9R1.8 ICCc1ccncc1 Amb28383331 [0,0,1,0,0,0|2,0,0]=3 749 B9R1.8 ICCc1cnccn1 Amb29849698 [0,0,1,0,0,0|3,0,0]=4 750 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [0,0,1,0,0,0|1,0,2]=4 751 B9R1.8 N#CC[n+]1ccccc1 Amb2608894 [0,0,1,0,0,0|2,0,1]=4 752 B9R1.8 N#CCc1ccccc1 Amb3598087 [0,0,1,0,0,0|1,0,1]=3 753 B9R1.8 N#CCc1ccccn1 Amb845695 [0,0,1,0,0,0|2,0,1]=4 754 B9R1.8 N#CCc1cccnc1 Amb2695344 [0,0,1,0,0,0|2,0,1]=4 755 B9R1.8 N#CCc1ccncc1 Amb6661799 [0,0,1,0,0,0|2,0,1]=4 756 B9R1.8 N#CCc1ccncc1 Amb8516296 [0,0,1,0,0,0|2,0,1]=4 757 B9R1.8 N#CNc1ccccc1 Amb9783273 [0,0,1,0,0,0|2,0,1]=4 758 B9R1.8 N#COc1ccccc1 Amb15692860 [0,0,1,0,0,0|2,0,1]=4 759 B9R1.8 N#CSc1ccccc1 Amb6892469 [0,0,1,0,0,0|2,0,1]=4 760 B9R1.8 N#C[Se]c1ccccc1 Amb2690321 [0,0,1,0,0,0|2,0,1]=4 761 B9R1.8 NCC[n+]1ccccc1 Amb27246156 [0,0,1,0,0,0|2,0,0]=3 762 B9R1.8 NCCc1ccccc1 Amb17843439 [0,0,1,0,0,0|1,0,0]=2 763 B9R1.8 NCCc1ccccc1 Amb2792829 [0,0,1,0,0,0|1,0,0]=2 764 B9R1.8 NCCc1ccccn1 Amb1156071 [0,0,1,0,0,0|2,0,0]=3 765 B9R1.8 NCCc1ccccn1 Amb24066975 [0,0,1,0,0,0|2,0,0]=3 766 B9R1.8 NCCc1cccnc1 Amb1134784 [0,0,1,0,0,0|2,0,0]=3 767 B9R1.8 NCCc1cccnc1 Amb16230500 [0,0,1,0,0,0|2,0,0]=3 768 B9R1.8 NCCc1cccnc1 Amb20241523 [0,0,1,0,0,0|2,0,0]=3 769 B9R1.8 NCCc1cccnc1 Amb8631307 [0,0,1,0,0,0|2,0,0]=3 770 B9R1.8 NCCc1cccnn1 Amb23592188 [0,0,1,0,0,0|3,0,0]=4 771 B9R1.8 NCCc1ccncc1 Amb1102164 [0,0,1,0,0,0|2,0,0]=3 772 B9R1.8 NCCc1ccncc1 Amb8631358 [0,0,1,0,0,0|2,0,0]=3 773 B9R1.8 NCCc1ccncn1 Amb22899210 [0,0,1,0,0,0|3,0,0]=4 774 B9R1.8 NCCc1ccncn1 Amb8009432 [0,0,1,0,0,0|3,0,0]=4 775 B9R1.8 NCCc1ccnnc1 Amb31217486 [0,0,1,0,0,0|3,0,0]=4 776 B9R1.8 NCCc1ccnnc1 Amb8009433 [0,0,1,0,0,0|3,0,0]=4 777 B9R1.8 NCCc1cnccn1 Amb10067912 [0,0,1,0,0,0|3,0,0]=4 778 B9R1.8 NCCc1cnccn1 Amb1995199 [0,0,1,0,0,0|3,0,0]=4 779 B9R1.8 NCCc1cnccn1 Amb22756001 [0,0,1,0,0,0|3,0,0]=4 780 B9R1.8 NCCc1cnccn1 Amb24066949 [0,0,1,0,0,0|3,0,0]=4 781 B9R1.8 NCCc1cnccn1 Amb30526944 [0,0,1,0,0,0|3,0,0]=4 782 B9R1.8 NCCc1cncnc1 Amb32667660 [0,0,1,0,0,0|3,0,0]=4 783 B9R1.8 NCCc1cncnc1 Amb8009434 [0,0,1,0,0,0|3,0,0]=4 784 B9R1.8 NCCc1cncnc1 Amb8631335 [0,0,1,0,0,0|3,0,0]=4 785 B9R1.8 NCCc1ncccn1 Amb17074351 [0,0,1,0,0,0|3,0,0]=4 786 B9R1.8 NCCc1ncccn1 Amb18199432 [0,0,1,0,0,0|3,0,0]=4 787 B9R1.8 NCCc1ncccn1 Amb23399636 [0,0,1,0,0,0|3,0,0]=4 788 B9R1.8 NCNc1ccccc1 Amb17117015 [0,0,1,0,0,0|2,0,0]=3 789 B9R1.8 NCOc1ccccc1 Amb25128781 [0,0,1,0,0,0|2,0,0]=3 790 B9R1.8 NNCc1ccccc1 Amb1105200 [0,0,1,0,0,0|2,0,0]=3 791 B9R1.8 NNCc1ccccc1 Amb16231890 [0,0,1,0,0,0|2,0,0]=3 792 B9R1.8 NNCc1ccccc1 Amb22492438 [0,0,1,0,0,0|2,0,0]=3 793 B9R1.8 NNCc1ccccc1 Amb8513062 [0,0,1,0,0,0|2,0,0]=3 794 B9R1.8 NNCc1ccccc1 Amb9826089 [0,0,1,0,0,0|2,0,0]=3 795 B9R1.8 NNCc1ccccn1 Amb1117330 [0,0,1,0,0,0|3,0,0]=4 796 B9R1.8 NNCc1ccccn1 Amb28984160 [0,0,1,0,0,0|3,0,0]=4 797 B9R1.8 NNCc1ccccn1 Amb6892424 [0,0,1,0,0,0|3,0,0]=4 798 B9R1.8 NNCc1cccnc1 Amb1121062 [0,0,1,0,0,0|3,0,0]=4 799 B9R1.8 NNCc1cccnc1 Amb22491471 [0,0,1,0,0,0|3,0,0]=4 800 B9R1.8 NNCc1cccnc1 Amb33551495 [0,0,1,0,0,0|3,0,0]=4 801 B9R1.8 NNCc1ccncc1 Amb1118337 [0,0,1,0,0,0|3,0,0]=4 802 B9R1.8 NNCc1ccncc1 Amb19893255 [0,0,1,0,0,0|3,0,0]=4 803 B9R1.8 NNCc1ccncc1 Amb2691315 [0,0,1,0,0,0|3,0,0]=4 804 B9R1.8 NNCc1ccncc1 Amb28984138 [0,0,1,0,0,0|3,0,0]=4 805 B9R1.8 NOCc1ccccc1 Amb1154307 [0,0,1,0,0,0|1,0,0]=2 806 B9R1.8 NOCc1ccccc1 Amb22489499 [0,0,1,0,0,0|1,0,0]=2 807 B9R1.8 NOCc1ccccc1 Amb6600539 [0,0,1,0,0,0|1,0,0]=2 808 B9R1.8 NOCc1ccccn1 Amb18642195 [0,0,1,0,0,0|2,0,0]=3 809 B9R1.8 NOCc1ccccn1 Amb32663271 [0,0,1,0,0,0|2,0,0]=3 810 B9R1.8 NOCc1cccnc1 Amb24074265 [0,0,1,0,0,0|2,0,0]=3 811 B9R1.8 NOCc1cccnc1 Amb33546939 [0,0,1,0,0,0|2,0,0]=3 812 B9R1.8 NOCc1ccncc1 Amb22397036 [0,0,1,0,0,0|2,0,0]=3 813 B9R1.8 NOCc1ccncn1 Amb26557423 [0,0,1,0,0,0|3,0,0]=4 814 B9R1.8 NOCc1cnccn1 Amb27642916 [0,0,1,0,0,0|3,0,0]=4 815 B9R1.8 NOCc1cncnc1 Amb33149200 [0,0,1,0,0,0|3,0,0]=4 816 B9R1.8 NOCc1ncccn1 Amb25702287 [0,0,1,0,0,0|3,0,0]=4 817 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [0,0,1,0,0,0|2,0,1]=4 818 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [0,0,1,0,0,0|2,0,1]=4 819 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [0,0,1,0,0,0|2,0,1]=4 820 B9R1.8 O=C=Nc1ccccc1 Amb3939417 [0,0,1,0,0,0|1,0,2]=4 821 B9R1.8 O=CCc1ccccc1 Amb3939950 [0,0,1,0,0,0|0,0,2]=3 822 B9R1.8 O=CCc1ccccn1 Amb17089528 [0,0,1,0,0,0|1,0,2]=4 823 B9R1.8 O=CCc1cccnc1 Amb8011002 [0,0,1,0,0,0|1,0,2]=4 824 B9R1.8 O=CCc1ccncc1 Amb17089529 [0,0,1,0,0,0|1,0,2]=4 825 B9R1.8 O=CNc1ccccc1 Amb2613772 [0,0,1,0,0,0|1,0,2]=4 826 B9R1.8 O=COc1ccccc1 Amb22002710 [0,0,1,0,0,0|1,0,2]=4 827 B9R1.8 O=S=Nc1ccccc1 Amb2720783 [0,0,1,0,0,0|2,0,1]=4 828 B9R1.8 OCC[n+]1ccccc1 Amb27839429 [0,0,1,0,0,0|1,0,0]=2 829 B9R1.8 OCCc1ccccc1 Amb2793058 [0,0,1,0,0,0|0,0,0]=1 830 B9R1.8 OCCc1ccccn1 Amb3939045 [0,0,1,0,0,0|1,0,0]=2 831 B9R1.8 OCCc1cccnc1 Amb2688750 [0,0,1,0,0,0|1,0,0]=2 832 B9R1.8 OCCc1cccnn1 Amb25086060 [0,0,1,0,0,0|2,0,0]=3 833 B9R1.8 OCCc1ccncc1 Amb3939219 [0,0,1,0,0,0|1,0,0]=2 834 B9R1.8 OCCc1ccncn1 Amb17593271 [0,0,1,0,0,0|2,0,0]=3 835 B9R1.8 OCCc1ccnnc1 Amb23559765 [0,0,1,0,0,0|2,0,0]=3 836 B9R1.8 OCCc1cnccn1 Amb2695474 [0,0,1,0,0,0|2,0,0]=3 837 B9R1.8 OCCc1cncnc1 Amb20240921 [0,0,1,0,0,0|2,0,0]=3 838 B9R1.8 OCCc1ncccn1 Amb22896758 [0,0,1,0,0,0|2,0,0]=3 839 B9R1.8 OCSc1ccccc1 Amb27776457 [0,0,1,0,0,0|1,0,0]=2 840 B9R1.8 ONCc1ccccc1 Amb22001943 [0,0,1,0,0,0|1,0,0]=2 841 B9R1.8 ONCc1ccccc1 Amb9825936 [0,0,1,0,0,0|1,0,0]=2 842 B9R1.8 ONCc1ccccn1 Amb28457793 [0,0,1,0,0,0|2,0,0]=3 843 B9R1.8 ONCc1ccccn1 Amb32680372 [0,0,1,0,0,0|2,0,0]=3 844 B9R1.8 ONCc1cccnc1 Amb25147084 [0,0,1,0,0,0|2,0,0]=3 845 B9R1.8 ONCc1ccncc1 Amb25851052 [0,0,1,0,0,0|2,0,0]=3 846 B9R1.8 ONCc1ccncn1 Amb23586394 [0,0,1,0,0,0|3,0,0]=4 847 B9R1.8 ONCc1cnccn1 Amb25936839 [0,0,1,0,0,0|3,0,0]=4 848 B9R1.8 ONCc1cncnc1 Amb28066281 [0,0,1,0,0,0|3,0,0]=4 849 B9R1.8 ONCc1ncccn1 Amb23586395 [0,0,1,0,0,0|3,0,0]=4 850 B9R1.8 O\N=C/c1ccccc1 Amb6298335 [0,0,1,0,0,0|1,0,1]=3 851 B9R1.8 O\N=C/c1ccncc1 Amb9821776 [0,0,1,0,0,0|2,0,1]=4 852 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [0,0,1,0,0,0|1,0,1]=3 853 B9R1.8 O\N=C\c1ccccn1 Amb719680 [0,0,1,0,0,0|2,0,1]=4 854 B9R1.8 O\N=C\c1cccnc1 Amb3427823 [0,0,1,0,0,0|2,0,1]=4 855 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [0,0,1,0,0,0|2,0,1]=4 856 B9R1.8 O\N=N\c1ccccn1 Amb17940654 [0,0,1,0,0,0|3,0,0]=4 857 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [0,0,1,0,0,0|1,1,1]=4 858 B9R1.8 S=CNc1ccccc1 Amb25788857 [0,0,1,0,0,0|1,1,1]=4 859 B9R1.8 SCCc1ccccc1 Amb6255605 [0,0,1,0,0,0|0,1,0]=2 860 B9R1.8 SCCc1ccccn1 Amb17619707 [0,0,1,0,0,0|1,1,0]=3 861 B9R1.8 SCCc1cccnc1 Amb22008806 [0,0,1,0,0,0|1,1,0]=3 862 B9R1.8 SCCc1ccncc1 Amb10552830 [0,0,1,0,0,0|1,1,0]=3 863 B9R1.8 SCCc1ccncc1 Amb9800962 [0,0,1,0,0,0|1,1,0]=3 864 B9R1.8 SCCc1ccncn1 Amb33267506 [0,0,1,0,0,0|2,1,0]=4 865 B9R1.8 SCCc1cnccn1 Amb8392837 [0,0,1,0,0,0|2,1,0]=4 866 B9R1.8 SCCc1cncnc1 Amb32875711 [0,0,1,0,0,0|2,1,0]=4 867 B9R1.8 SCCc1ncccn1 Amb33270002 [0,0,1,0,0,0|2,1,0]=4 868 B9R1.8 SSCc1ccccc1 Amb27646980 [0,0,1,0,0,0|1,1,0]=3 869 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [0,0,1,0,0,0|1,0,1]=3 870 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [0,0,1,0,0,0|2,0,1]=4 871 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [0,0,1,0,0,0|2,0,1]=4 872 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [0,0,1,0,0,0|2,0,1]=4 873 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [0,0,1,0,0,0|2,0,1]=4 874 B9R1.8 [N-]=[N+]=Nc1ccccc1 Amb6892570 [0,0,1,0,0,0|3,0,0]=4 875 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [0,0,1,0,0,0|1,0,0]=2 876 B9R1.8 [NH3+]OCc1ccccc1 Amb9786371 [0,0,1,0,0,0|1,0,0]=2 877 B9R1.8 [O-][N+]#Cc1ccccc1 Amb25951967 [0,0,1,0,0,0|1,0,2]=4 878 B9R2.2 c1cc(C2CC2)co1 Amb24323179 [0,0,0,0,1,0|2,0,0]=3 879 B9R2.2 c1cc(C2CC2)cs1 Amb24323176 [0,0,0,0,1,0|2,0,0]=3 880 B9R2.2 c1cc(C2CO2)co1 Amb24483221 [0,0,0,0,1,0|1,0,0]=2 881 B9R2.2 c1cc(C2CO2)cs1 Amb26515734 [0,0,0,0,1,0|1,0,0]=2 882 B9R2.2 c1cc(C2CO2)no1 Amb33198772 [0,0,0,0,1,0|2,0,0]=3 883 B9R2.2 c1cc(C2CO2)sn1 Amb35731168 [0,0,0,0,1,0|2,0,0]=3 884 B9R2.2 c1cc([C@@H]2CO2)co1 Amb33360079 [0,0,0,0,1,0|1,0,0]=2 885 B9R2.2 c1cc([C@@H]2CO2)cs1 Amb27410328 [0,0,0,0,1,0|1,0,0]=2 886 B9R2.2 c1cc([C@@H]2CO2)no1 Amb33198957 [0,0,0,0,1,0|2,0,0]=3 887 B9R2.2 c1cc([C@H]2CO2)co1 Amb33360230 [0,0,0,0,1,0|1,0,0]=2 888 B9R2.2 c1cc([C@H]2CO2)cs1 Amb27648615 [0,0,0,0,1,0|1,0,0]=2 889 B9R2.2 c1cc([C@H]2CO2)no1 Amb33199023 [0,0,0,0,1,0|2,0,0]=3 890 B9R2.2 c1ccn(C2CC2)c1 Amb9248887 [0,0,0,0,1,0|2,0,0]=3 891 B9R2.2 c1cn(C2CC2)cn1 Amb22728296 [0,0,0,0,1,0|3,0,0]=4 892 B9R2.2 c1cnn(C2CC2)c1 Amb21857130 [0,0,0,0,1,0|3,0,0]=4 893 B9R2.2 c1cnn(C2CC2)c1 Amb33299222 [0,0,0,0,1,0|3,0,0]=4 894 B9R2.2 c1coc(C2CC2)c1 Amb24323177 [0,0,0,0,1,0|2,0,0]=3 895 B9R2.2 c1coc(C2CC2)n1 Amb17399789 [0,0,0,0,1,0|3,0,0]=4 896 B9R2.2 c1coc(C2CN2)c1 Amb18224247 [0,0,0,0,1,0|2,0,0]=3 897 B9R2.2 c1coc(C2CO2)c1 Amb1135121 [0,0,0,0,1,0|1,0,0]=2 898 B9R2.2 c1coc(C2CS2)c1 Amb28367857 [0,0,0,0,1,0|1,1,0]=3 899 B9R2.2 c1coc([C@@H]2CO2)c1 Amb33360896 [0,0,0,0,1,0|1,0,0]=2 900 B9R2.2 c1coc([C@H]2CO2)c1 Amb33360893 [0,0,0,0,1,0|1,0,0]=2 901 B9R2.2 c1csc(C2CC2)c1 Amb24323171 [0,0,0,0,1,0|2,0,0]=3 902 B9R2.2 c1csc(C2CC2)n1 Amb10601012 [0,0,0,0,1,0|3,0,0]=4 903 B9R2.2 c1csc(C2CN2)c1 Amb18222208 [0,0,0,0,1,0|2,0,0]=3 904 B9R2.2 c1csc(C2CO2)c1 Amb1140287 [0,0,0,0,1,0|1,0,0]=2 905 B9R2.2 c1csc(C2CO2)n1 Amb26850759 [0,0,0,0,1,0|2,0,0]=3 906 B9R2.2 c1csc([C@@H]2CO2)c1 Amb24384733 [0,0,0,0,1,0|1,0,0]=2 907 B9R2.2 c1csc([C@@H]2CO2)n1 Amb27952634 [0,0,0,0,1,0|2,0,0]=3 908 B9R2.2 c1csc([C@H]2CO2)c1 Amb27395531 [0,0,0,0,1,0|1,0,0]=2 909 B9R2.2 c1csc([C@H]2CO2)n1 Amb25126543 [0,0,0,0,1,0|2,0,0]=3 910 B9R2.2 c1nc(C2CC2)co1 Amb32666811 [0,0,0,0,1,0|3,0,0]=4 911 B9R2.2 c1nc(C2CC2)cs1 Amb13884093 [0,0,0,0,1,0|3,0,0]=4 912 B9R2.2 c1nc(C2CO2)cs1 Amb25067225 [0,0,0,0,1,0|2,0,0]=3 913 B9R2.2 c1nc([C@@H]2CO2)cs1 Amb33417263 [0,0,0,0,1,0|2,0,0]=3 914 B9R2.2 c1nc([C@H]2CO2)cs1 Amb33417249 [0,0,0,0,1,0|2,0,0]=3 915 B9R2.2 c1ncc(C2CC2)o1 Amb27624972 [0,0,0,0,1,0|3,0,0]=4 916 B9R2.2 c1ncc(C2CC2)s1 Amb28200548 [0,0,0,0,1,0|3,0,0]=4 917 B9R2.2 c1ncc(C2CO2)o1 Amb33415266 [0,0,0,0,1,0|2,0,0]=3 918 B9R2.2 c1ncc(C2CO2)s1 Amb24097147 [0,0,0,0,1,0|2,0,0]=3 919 B9R2.2 c1ncc([C@@H]2CO2)o1 Amb33226884 [0,0,0,0,1,0|2,0,0]=3 920 B9R2.2 c1ncc([C@@H]2CO2)s1 Amb33268651 [0,0,0,0,1,0|2,0,0]=3 921 B9R2.2 c1ncc([C@H]2CO2)o1 Amb33319172 [0,0,0,0,1,0|2,0,0]=3 922 B9R2.2 c1ncc([C@H]2CO2)s1 Amb33268006 [0,0,0,0,1,0|2,0,0]=3 923 B9R2.2 c1snnc1C2CO2 Amb28285233 [0,0,0,0,1,0|3,0,0]=4 924 B9R2.2 c1snnc1[C@@H]2CO2 Amb33320456 [0,0,0,0,1,0|3,0,0]=4 925 B9R2.2 c1snnc1[C@H]2CO2 Amb33320457 [0,0,0,0,1,0|3,0,0]=4 926 B11R2.238 C(=C1CC1)c2ccccc2 Amb19515480 [0,0,0,0,0,1|1,0,1]=3 927 B11R2.238 C1=C(Cc2ccccc2)C1 Amb27421346 [0,0,0,0,0,1|1,0,1]=3 928 B11R2.238 c1cc(CC2CC2)ccn1 Amb28050219 [0,0,0,0,0,1|2,0,0]=3 929 B11R2.238 c1cc(CC2CC2)ncn1 Amb33070126 [0,0,0,0,0,1|3,0,0]=4 930 B11R2.238 c1cc(CC2CO2)ccn1 Amb24677560 [0,0,0,0,0,1|1,0,0]=2 931 B11R2.238 c1cc(CC2CO2)ncn1 Amb33268585 [0,0,0,0,0,1|2,0,0]=3 932 B11R2.238 c1cc(NC2CC2)ccn1 Amb6625922 [0,0,0,0,0,1|2,0,0]=3 933 B11R2.238 c1cc(NC2CC2)cnn1 Amb23559705 [0,0,0,0,0,1|3,0,0]=4 934 B11R2.238 c1ccc(CC2CC2)cc1 Amb22490220 [0,0,0,0,0,1|1,0,0]=2 935 B11R2.238 c1ccc(CC2CO2)cc1 Amb3940775 [0,0,0,0,0,1|0,0,0]=1 936 B11R2.238 c1ccc(CC2CO2)nc1 Amb24649901 [0,0,0,0,0,1|1,0,0]=2 937 B11R2.238 c1ccc(C[C@@H]2CO2)cc1 Amb25916397 [0,0,0,0,0,1|0,0,0]=1 938 B11R2.238 c1ccc(C[C@H]2CN2)cc1 Amb15690958 [0,0,0,0,0,1|1,0,0]=2 939 B11R2.238 c1ccc(C[C@H]2CO2)cc1 Amb27150158 [0,0,0,0,0,1|0,0,0]=1 940 B11R2.238 c1ccc(NC2CC2)cc1 Amb18270529 [0,0,0,0,0,1|1,0,0]=2 941 B11R2.238 c1ccc(NC2CC2)cc1 Amb32663098 [0,0,0,0,0,1|1,0,0]=2 942 B11R2.238 c1ccc(OC2CC2)nc1 Amb25697005 [0,0,0,0,0,1|2,0,0]=3 943 B11R2.238 c1ccc(SC2CC2)cc1 Amb8514420 [0,0,0,0,0,1|1,0,0]=2 944 B11R2.238 c1cnc(CC2CO2)cn1 Amb28240224 [0,0,0,0,0,1|2,0,0]=3 945 B11R2.238 c1cnc(CC2CO2)nc1 Amb33270384 [0,0,0,0,0,1|2,0,0]=3 946 B11R2.238 c1cnc(NC2CC2)cn1 Amb6612534 [0,0,0,0,0,1|3,0,0]=4 947 B11R2.238 c1cnc(NC2CC2)nc1 Amb6640726 [0,0,0,0,0,1|3,0,0]=4 948 B11R2.238 c1cncc(CC2CO2)c1 Amb28397057 [0,0,0,0,0,1|1,0,0]=2 949 B11R2.238 c1cncc(CN2CC2)c1 Amb24085109 [0,0,0,0,0,1|3,0,0]=4 950 B11R2.238 c1cncc(NC2CC2)c1 Amb18270523 [0,0,0,0,0,1|2,0,0]=3 951 B11R2.238 c1cncc(OC2CC2)c1 Amb28119516 [0,0,0,0,0,1|2,0,0]=3 952 B11R2.238 c1cnnc(NC2CC2)c1 Amb18961845 [0,0,0,0,0,1|3,0,0]=4 953 B11R2.238 c1ncc(CC2CO2)cn1 Amb24426064 [0,0,0,0,0,1|2,0,0]=3 954 B11R2.238 c1ncc(NC2CC2)cn1 Amb18933600 [0,0,0,0,0,1|3,0,0]=4 955 B11R2.239 C1=C(c2cccnc2)CC1 Amb32668896 [0,0,0,0,0,1|2,0,1]=4 956 B11R2.239 c1cc(C2CCC2)ccn1 Amb22898826 [0,0,0,0,0,1|2,0,0]=3 957 B11R2.239 c1cc(C2CCC2)ncn1 Amb33070125 [0,0,0,0,0,1|3,0,0]=4 958 B11R2.239 c1cc(C2CCN2)ccn1 Amb26960403 [0,0,0,0,0,1|2,0,0]=3 959 B11R2.239 c1cc(C2CCN2)ncn1 Amb25274242 [0,0,0,0,0,1|3,0,0]=4 960 B11R2.239 c1cc(C2CNC2)ccn1 Amb19516821 [0,0,0,0,0,1|2,0,0]=3 961 B11R2.239 c1cc(C2CNC2)ccn1 Amb20620350 [0,0,0,0,0,1|2,0,0]=3 962 B11R2.239 c1cc(C2CNC2)ncn1 Amb23401381 [0,0,0,0,0,1|3,0,0]=4 963 B11R2.239 c1cc(C2CNC2)ncn1 Amb26509224 [0,0,0,0,0,1|3,0,0]=4 964 B11R2.239 c1cc(C2CNC2)ncn1 Amb28990041 [0,0,0,0,0,1|3,0,0]=4 965 B11R2.239 c1cc(C2COC2)ccn1 Amb27623779 [0,0,0,0,0,1|1,0,0]=2 966 B11R2.239 c1ccc(C2CCC2)cc1 Amb27466141 [0,0,0,0,0,1|1,0,0]=2 967 B11R2.239 c1ccc(C2CCC2)nc1 Amb27796341 [0,0,0,0,0,1|2,0,0]=3 968 B11R2.239 c1ccc(C2CCN2)cc1 Amb34912959 [0,0,0,0,0,1|1,0,0]=2 969 B11R2.239 c1ccc(C2CCN2)cc1 Amb6893889 [0,0,0,0,0,1|1,0,0]=2 970 B11R2.239 c1ccc(C2CCN2)nc1 Amb25849292 [0,0,0,0,0,1|2,0,0]=3 971 B11R2.239 c1ccc(C2CCS2)cc1 Amb27839415 [0,0,0,0,0,1|0,1,0]=2 972 B11R2.239 c1ccc(C2CNC2)cc1 Amb10603719 [0,0,0,0,0,1|1,0,0]=2 973 B11R2.239 c1ccc(C2CNC2)cc1 Amb4124710 [0,0,0,0,0,1|1,0,0]=2 974 B11R2.239 c1ccc(C2CNC2)nc1 Amb15695195 [0,0,0,0,0,1|2,0,0]=3 975 B11R2.239 c1ccc(C2CNC2)nc1 Amb19516701 [0,0,0,0,0,1|2,0,0]=3 976 B11R2.239 c1ccc(C2CNC2)nc1 Amb32410214 [0,0,0,0,0,1|2,0,0]=3 977 B11R2.239 c1ccc(C2COC2)nc1 Amb24100566 [0,0,0,0,0,1|1,0,0]=2 978 B11R2.239 c1ccc([C@@H]2CCO2)cc1 Amb25721124 [0,0,0,0,0,1|0,0,0]=1 979 B11R2.239 c1ccc([C@H]2CCN2)cc1 Amb27874787 [0,0,0,0,0,1|1,0,0]=2 980 B11R2.239 c1cnc(C2CCN2)cn1 Amb26026804 [0,0,0,0,0,1|3,0,0]=4 981 B11R2.239 c1cnc(C2CCN2)nc1 Amb32716223 [0,0,0,0,0,1|3,0,0]=4 982 B11R2.239 c1cnc(C2CNC2)cn1 Amb26946675 [0,0,0,0,0,1|3,0,0]=4 983 B11R2.239 c1cnc(C2CNC2)nc1 Amb25935062 [0,0,0,0,0,1|3,0,0]=4 984 B11R2.239 c1cnc(C2CNC2)nc1 Amb30868005 [0,0,0,0,0,1|3,0,0]=4 985 B11R2.239 c1cnc(C2CNC2)nc1 Amb32412175 [0,0,0,0,0,1|3,0,0]=4 986 B11R2.239 c1cncc(C2CCN2)c1 Amb8010869 [0,0,0,0,0,1|2,0,0]=3 987 B11R2.239 c1cncc(C2CNC2)c1 Amb19516797 [0,0,0,0,0,1|2,0,0]=3 988 B11R2.239 c1cncc(C2CNC2)c1 Amb20620349 [0,0,0,0,0,1|2,0,0]=3 989 B11R2.239 c1cncc(C2CNC2)c1 Amb32410212 [0,0,0,0,0,1|2,0,0]=3 990 B11R2.239 c1cncc([C@H]2CCN2)c1 Amb27241453 [0,0,0,0,0,1|2,0,0]=3 991 B11R2.239 c1ncc(C2CCN2)cn1 Amb27173286 [0,0,0,0,0,1|3,0,0]=4 992 B11R2.239 c1ncc(C2CNC2)cn1 Amb26369795 [0,0,0,0,0,1|3,0,0]=4 993 B11R2.239 c1ncc(C2CNC2)cn1 Amb34931999 [0,0,0,0,0,1|3,0,0]=4 994 B8R1.2 BrCc1ccccc1 Amb3939707 [1,0,1,0,0,0|1,0,0]=3 995 B8R1.2 BrCc1ccccn1 Amb3939990 [1,0,1,0,0,0|2,0,0]=4 996 B8R1.2 BrCc1ccccn1 Amb8393294 [1,0,1,0,0,0|2,0,0]=4 997 B8R1.2 BrCc1cccnc1 Amb3939989 [1,0,1,0,0,0|2,0,0]=4 998 B8R1.2 BrCc1cccnc1 Amb9826052 [1,0,1,0,0,0|2,0,0]=4 999 B8R1.2 BrCc1ccncc1 Amb3939991 [1,0,1,0,0,0|2,0,0]=4 1000 B8R1.2 BrCc1ccncc1 Amb9826062 [1,0,1,0,0,0|2,0,0]=4 1001 B8R1.2 Br[Se]c1ccccc1 Amb8514629 [1,0,1,0,0,0|1,1,0]=4 1002 B8R1.2 C#Cc1ccccc1 Amb2793084 [1,0,1,0,0,0|0,0,2]=4 1003 B8R1.2 C=Cc1ccccc1 Amb6608811 [1,0,1,0,0,0|0,0,2]=4 1004 B8R1.2 C=Nc1ccccc1 Amb24605672 [1,0,1,0,0,0|1,0,1]=4 1005 B8R1.2 CCC1=CC=CNC1 Amb27643536 [1,0,1,0,0,0|1,0,1]=4 1006 B8R1.2 CC[n+]1ccccc1 Amb8516219 [1,0,1,0,0,0|1,0,0]=3 1007 B8R1.2 CC[n+]1ccccc1 Amb8516636 [1,0,1,0,0,0|1,0,0]=3 1008 B8R1.2 CCc1ccccc1 Amb2447474 [1,0,1,0,0,0|0,0,0]=2 1009 B8R1.2 CCc1ccccn1 Amb6608978 [1,0,1,0,0,0|1,0,0]=3 1010 B8R1.2 CCc1cccnc1 Amb4037096 [1,0,1,0,0,0|1,0,0]=3 1011 B8R1.2 CCc1cccnn1 Amb28290156 [1,0,1,0,0,0|2,0,0]=4 1012 B8R1.2 CCc1ccncc1 Amb8513449 [1,0,1,0,0,0|1,0,0]=3 1013 B8R1.2 CCc1ccncn1 Amb20242304 [1,0,1,0,0,0|2,0,0]=4 1014 B8R1.2 CCc1cnccn1 Amb6374282 [1,0,1,0,0,0|2,0,0]=4 1015 B8R1.2 CCc1cncnc1 Amb24097063 [1,0,1,0,0,0|2,0,0]=4 1016 B8R1.2 CCc1ncccn1 Amb33544267 [1,0,1,0,0,0|2,0,0]=4 1017 B8R1.2 CNc1ccccc1 Amb2721038 [1,0,1,0,0,0|1,0,0]=3 1018 B8R1.2 CNc1ccccc1 Amb4037054 [1,0,1,0,0,0|1,0,0]=3 1019 B8R1.2 CNc1ccccn1 Amb3429849 [1,0,1,0,0,0|2,0,0]=4 1020 B8R1.2 CNc1cccnc1 Amb8396762 [1,0,1,0,0,0|2,0,0]=4 1021 B8R1.2 CNc1ccncc1 Amb2610661 [1,0,1,0,0,0|2,0,0]=4 1022 B8R1.2 COC1=CCC=CC1 Amb10842162 [1,0,1,0,0,0|0,0,2]=4 1023 B8R1.2 COc1ccccc1 Amb2842269 [1,0,1,0,0,0|0,0,0]=2 1024 B8R1.2 COc1ccccn1 Amb4037280 [1,0,1,0,0,0|1,0,0]=3 1025 B8R1.2 COc1cccnc1 Amb8517634 [1,0,1,0,0,0|1,0,0]=3 1026 B8R1.2 COc1cccnn1 Amb5751228 [1,0,1,0,0,0|2,0,0]=4 1027 B8R1.2 COc1ccncc1 Amb2609546 [1,0,1,0,0,0|1,0,0]=3 1028 B8R1.2 COc1ccncc1 Amb28991347 [1,0,1,0,0,0|1,0,0]=3 1029 B8R1.2 COc1ccncn1 Amb15692928 [1,0,1,0,0,0|2,0,0]=4 1030 B8R1.2 COc1ccnnc1 Amb21857844 [1,0,1,0,0,0|2,0,0]=4 1031 B8R1.2 COc1cnccn1 Amb2689275 [1,0,1,0,0,0|2,0,0]=4 1032 B8R1.2 COc1cncnc1 Amb8439425 [1,0,1,0,0,0|2,0,0]=4 1033 B8R1.2 COc1ncccn1 Amb2609513 [1,0,1,0,0,0|2,0,0]=4 1034 B8R1.2 CPc1ccccc1 Amb25341327 [1,0,1,0,0,0|1,0,0]=3 1035 B8R1.2 CSc1ccccc1 Amb2690593 [1,0,1,0,0,0|0,1,0]=3 1036 B8R1.2 CSc1ccccn1 Amb8392843 [1,0,1,0,0,0|1,1,0]=4 1037 B8R1.2 CSc1cccnc1 Amb24087396 [1,0,1,0,0,0|1,1,0]=4 1038 B8R1.2 CSc1ccncc1 Amb24103013 [1,0,1,0,0,0|1,1,0]=4 1039 B8R1.2 ClCc1cc[nH+]cc1 Amb4258486 [1,0,1,0,0,0|2,0,0]=4 1040 B8R1.2 ClCc1ccccc1 Amb2792911 [1,0,1,0,0,0|1,0,0]=3 1041 B8R1.2 ClCc1ccccn1 Amb22489454 [1,0,1,0,0,0|2,0,0]=4 1042 B8R1.2 ClCc1ccccn1 Amb534985 [1,0,1,0,0,0|2,0,0]=4 1043 B8R1.2 ClCc1ccccn1 Amb6296082 [1,0,1,0,0,0|2,0,0]=4 1044 B8R1.2 ClCc1cccnc1 Amb2725600 [1,0,1,0,0,0|2,0,0]=4 1045 B8R1.2 ClCc1cccnc1 Amb534994 [1,0,1,0,0,0|2,0,0]=4 1046 B8R1.2 ClCc1ccncc1 Amb2715054 [1,0,1,0,0,0|2,0,0]=4 1047 B8R1.2 Cl[Se]c1ccccc1 Amb8513798 [1,0,1,0,0,0|1,1,0]=4 1048 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [1,0,1,0,0,0|1,1,0]=4 1049 B8R1.2 FCc1ccccc1 Amb10838335 [1,0,1,0,0,0|1,0,0]=3 1050 B8R1.2 FCc1cccnc1 Amb25259171 [1,0,1,0,0,0|2,0,0]=4 1051 B8R1.2 FCc1ccncc1 Amb22372287 [1,0,1,0,0,0|2,0,0]=4 1052 B8R1.2 ICc1ccccc1 Amb4006861 [1,0,1,0,0,0|1,0,0]=3 1053 B8R1.2 ICc1ccccn1 Amb26963503 [1,0,1,0,0,0|2,0,0]=4 1054 B8R1.2 ICc1cccnc1 Amb10602162 [1,0,1,0,0,0|2,0,0]=4 1055 B8R1.2 ICc1cccnc1 Amb33527054 [1,0,1,0,0,0|2,0,0]=4 1056 B8R1.2 ICc1ccncc1 Amb33552994 [1,0,1,0,0,0|2,0,0]=4 1057 B8R1.2 I[Se]c1ccccc1 Amb10601593 [1,0,1,0,0,0|1,1,0]=4 1058 B8R1.2 N#Cc1ccccc1 Amb21864642 [1,0,1,0,0,0|1,0,1]=4 1059 B8R1.2 N#Cc1ccccc1 Amb2793082 [1,0,1,0,0,0|1,0,1]=4 1060 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [1,0,1,0,0,0|2,0,0]=4 1061 B8R1.2 NCc1ccccc1 Amb19958612 [1,0,1,0,0,0|1,0,0]=3 1062 B8R1.2 NCc1ccccc1 Amb2725314 [1,0,1,0,0,0|1,0,0]=3 1063 B8R1.2 NCc1ccccc1 Amb2792834 [1,0,1,0,0,0|1,0,0]=3 1064 B8R1.2 NCc1ccccc1 Amb6383294 [1,0,1,0,0,0|1,0,0]=3 1065 B8R1.2 NCc1ccccn1 Amb20620292 [1,0,1,0,0,0|2,0,0]=4 1066 B8R1.2 NCc1ccccn1 Amb2684477 [1,0,1,0,0,0|2,0,0]=4 1067 B8R1.2 NCc1cccnc1 Amb1481403 [1,0,1,0,0,0|2,0,0]=4 1068 B8R1.2 NCc1cccnc1 Amb2189172 [1,0,1,0,0,0|2,0,0]=4 1069 B8R1.2 NCc1cccnc1 Amb6383332 [1,0,1,0,0,0|2,0,0]=4 1070 B8R1.2 NCc1ccncc1 Amb1156526 [1,0,1,0,0,0|2,0,0]=4 1071 B8R1.2 NCc1ccncc1 Amb20622010 [1,0,1,0,0,0|2,0,0]=4 1072 B8R1.2 NNc1ccccc1 Amb22002446 [1,0,1,0,0,0|2,0,0]=4 1073 B8R1.2 NNc1ccccc1 Amb2793062 [1,0,1,0,0,0|2,0,0]=4 1074 B8R1.2 NNc1ccccc1 Amb8513467 [1,0,1,0,0,0|2,0,0]=4 1075 B8R1.2 NOc1ccccc1 Amb18123833 [1,0,1,0,0,0|1,0,0]=3 1076 B8R1.2 NOc1ccccc1 Amb22231364 [1,0,1,0,0,0|1,0,0]=3 1077 B8R1.2 NOc1ccccn1 Amb24101187 [1,0,1,0,0,0|2,0,0]=4 1078 B8R1.2 NOc1cccnc1 Amb27603515 [1,0,1,0,0,0|2,0,0]=4 1079 B8R1.2 NOc1ccncc1 Amb8386473 [1,0,1,0,0,0|2,0,0]=4 1080 B8R1.2 O=Bc1ccccc1 Amb25221658 [1,0,1,0,0,0|1,0,1]=4 1081 B8R1.2 O=Cc1ccccc1 Amb2792754 [1,0,1,0,0,0|0,0,2]=4 1082 B8R1.2 O=Nc1ccccc1 Amb9785158 [1,0,1,0,0,0|1,0,1]=4 1083 B8R1.2 O=[IH2]c1ccccc1 Amb15692855 [1,0,1,0,0,0|1,0,1]=4 1084 B8R1.2 OCc1ccccc1 Amb3939216 [1,0,1,0,0,0|0,0,0]=2 1085 B8R1.2 OCc1ccccn1 Amb16231923 [1,0,1,0,0,0|1,0,0]=3 1086 B8R1.2 OCc1ccccn1 Amb2610526 [1,0,1,0,0,0|1,0,0]=3 1087 B8R1.2 OCc1cccnc1 Amb2720347 [1,0,1,0,0,0|1,0,0]=3 1088 B8R1.2 OCc1cccnn1 Amb5282882 [1,0,1,0,0,0|2,0,0]=4 1089 B8R1.2 OCc1ccncc1 Amb24183964 [1,0,1,0,0,0|1,0,0]=3 1090 B8R1.2 OCc1ccncc1 Amb2720348 [1,0,1,0,0,0|1,0,0]=3 1091 B8R1.2 OCc1ccncn1 Amb7101500 [1,0,1,0,0,0|2,0,0]=4 1092 B8R1.2 OCc1ccnnc1 Amb21856410 [1,0,1,0,0,0|2,0,0]=4 1093 B8R1.2 OCc1cnccn1 Amb2723066 [1,0,1,0,0,0|2,0,0]=4 1094 B8R1.2 OCc1cncnc1 Amb8397262 [1,0,1,0,0,0|2,0,0]=4 1095 B8R1.2 OCc1ncccn1 Amb33531368 [1,0,1,0,0,0|2,0,0]=4 1096 B8R1.2 ONc1ccccc1 Amb17672282 [1,0,1,0,0,0|1,0,0]=3 1097 B8R1.2 ONc1ccncc1 Amb27829868 [1,0,1,0,0,0|2,0,0]=4 1098 B8R1.2 SCc1ccccc1 Amb6608752 [1,0,1,0,0,0|0,1,0]=3 1099 B8R1.2 SCc1ccccn1 Amb33542790 [1,0,1,0,0,0|1,1,0]=4 1100 B8R1.2 SCc1cccnc1 Amb21984718 [1,0,1,0,0,0|1,1,0]=4 1101 B8R1.2 SCc1ccncc1 Amb22008603 [1,0,1,0,0,0|1,1,0]=4 1102 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [1,0,1,0,0,0|1,0,1]=4 1103 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [1,0,1,0,0,0|1,0,0]=3 1104 B8R1.2 [NH3+]Cc1ccccc1 Amb8488224 [1,0,1,0,0,0|1,0,0]=3 1105 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [1,0,1,0,0,0|0,1,0]=3 1106 B8R1.36 C\C=C\C=C\C1CO1 Amb27654185 [1,0,1,0,0,0|0,0,1]=3 1107 B10R1.13 Brc1ccc(C(Br)Br)cc1 Amb17672294 [0,1,1,0,0,0|2,0,0]=4 1108 B10R1.13 C=C(C)c1ccc(Cl)cc1 Amb4317490 [0,1,1,0,0,0|1,0,1]=4 1109 B10R1.13 C=C(C)c1ccc(F)cc1 Amb8513344 [0,1,1,0,0,0|1,0,1]=4 1110 B10R1.13 C=C(C)c1ccc(I)cc1 Amb26361971 [0,1,1,0,0,0|1,0,1]=4 1111 B10R1.13 C=C(C)c1ccc(N)cc1 Amb17107085 [0,1,1,0,0,0|1,0,1]=4 1112 B10R1.13 C=C(C)c1ccc(O)cc1 Amb13883631 [0,1,1,0,0,0|1,0,1]=4 1113 B10R1.13 CC(=O)c1ccc(Br)cc1 Amb1221363 [0,1,1,0,0,0|0,0,2]=4 1114 B10R1.13 CC(=O)c1ccc(C)cc1 Amb2447132 [0,1,1,0,0,0|0,0,2]=4 1115 B10R1.13 CC(=O)c1ccc(Cl)cc1 Amb2685747 [0,1,1,0,0,0|0,0,2]=4 1116 B10R1.13 CC(=O)c1ccc(F)cc1 Amb2688007 [0,1,1,0,0,0|0,0,2]=4 1117 B10R1.13 CC(=O)c1ccc(I)cc1 Amb1233200 [0,1,1,0,0,0|0,0,2]=4 1118 B10R1.13 CC(=O)c1ccc(N)cc1 Amb22734863 [0,1,1,0,0,0|0,0,2]=4 1119 B10R1.13 CC(=O)c1ccc(N)cc1 Amb534112 [0,1,1,0,0,0|0,0,2]=4 1120 B10R1.13 CC(=O)c1ccc(O)cc1 Amb1212250 [0,1,1,0,0,0|0,0,2]=4 1121 B10R1.13 CC(=O)c1ccc(S)cc1 Amb17593795 [0,1,1,0,0,0|0,0,2]=4 1122 B10R1.13 CC(=S)c1ccc(C)cc1 Amb10602373 [0,1,1,0,0,0|0,1,1]=4 1123 B10R1.13 CC(Br)c1ccc(Br)cc1 Amb9210667 [0,1,1,0,0,0|1,0,0]=3 1124 B10R1.13 CC(Br)c1ccc(Br)cn1 Amb22751426 [0,1,1,0,0,0|2,0,0]=4 1125 B10R1.13 CC(Br)c1ccc(Br)nc1 Amb32659266 [0,1,1,0,0,0|2,0,0]=4 1126 B10R1.13 CC(Br)c1ccc(Cl)cc1 Amb8835439 [0,1,1,0,0,0|1,0,0]=3 1127 B10R1.13 CC(Br)c1ccc(Cl)nc1 Amb24715311 [0,1,1,0,0,0|2,0,0]=4 1128 B10R1.13 CC(Br)c1ccc(F)cc1 Amb8835393 [0,1,1,0,0,0|1,0,0]=3 1129 B10R1.13 CC(Br)c1ccc(F)cn1 Amb23450336 [0,1,1,0,0,0|2,0,0]=4 1130 B10R1.13 CC(Br)c1ccc(F)nc1 Amb27622915 [0,1,1,0,0,0|2,0,0]=4 1131 B10R1.13 CC(Br)c1ccc(I)cc1 Amb28074290 [0,1,1,0,0,0|1,0,0]=3 1132 B10R1.13 CC(C)c1cc[n+]([O-])cc1 Amb2694635 [0,1,1,0,0,0|2,0,0]=4 1133 B10R1.13 CC(C)c1ccc(Br)cc1 Amb3939592 [0,1,1,0,0,0|1,0,0]=3 1134 B10R1.13 CC(C)c1ccc(Br)cn1 Amb10600809 [0,1,1,0,0,0|2,0,0]=4 1135 B10R1.13 CC(C)c1ccc(Br)nc1 Amb10600533 [0,1,1,0,0,0|2,0,0]=4 1136 B10R1.13 CC(C)c1ccc(Cl)cc1 Amb22059617 [0,1,1,0,0,0|1,0,0]=3 1137 B10R1.13 CC(C)c1ccc(Cl)cn1 Amb26370044 [0,1,1,0,0,0|2,0,0]=4 1138 B10R1.13 CC(C)c1ccc(Cl)nc1 Amb25083723 [0,1,1,0,0,0|2,0,0]=4 1139 B10R1.13 CC(C)c1ccc(F)cc1 Amb4017558 [0,1,1,0,0,0|1,0,0]=3 1140 B10R1.13 CC(C)c1ccc(F)nc1 Amb26369939 [0,1,1,0,0,0|2,0,0]=4 1141 B10R1.13 CC(C)c1ccc(I)cc1 Amb8976890 [0,1,1,0,0,0|1,0,0]=3 1142 B10R1.13 CC(C)c1ccc(N)cc1 Amb1239129 [0,1,1,0,0,0|1,0,0]=3 1143 B10R1.13 CC(C)c1ccc(N)cn1 Amb10600811 [0,1,1,0,0,0|2,0,0]=4 1144 B10R1.13 CC(C)c1ccc(N)nc1 Amb13884058 [0,1,1,0,0,0|2,0,0]=4 1145 B10R1.13 CC(C)c1ccc(O)cc1 Amb1211898 [0,1,1,0,0,0|1,0,0]=3 1146 B10R1.13 CC(C)c1ccc(O)cn1 Amb10600812 [0,1,1,0,0,0|2,0,0]=4 1147 B10R1.13 CC(C)c1ccc(O)nc1 Amb10600535 [0,1,1,0,0,0|2,0,0]=4 1148 B10R1.13 CC(C)c1ccc(S)cc1 Amb4016186 [0,1,1,0,0,0|1,0,0]=3 1149 B10R1.13 CC(C)c1ccc(S)nc1 Amb26500652 [0,1,1,0,0,0|2,0,0]=4 1150 B10R1.13 CC(C)c1ccc([S-])cc1 Amb33512961 [0,1,1,0,0,0|1,0,0]=3 1151 B10R1.13 CC(Cl)c1cc[n+]([O-])cc1 Amb24379935 [0,1,1,0,0,0|2,0,0]=4 1152 B10R1.13 CC(Cl)c1ccc(Br)cc1 Amb7766836 [0,1,1,0,0,0|1,0,0]=3 1153 B10R1.13 CC(Cl)c1ccc(Br)cn1 Amb22751427 [0,1,1,0,0,0|2,0,0]=4 1154 B10R1.13 CC(Cl)c1ccc(Cl)cc1 Amb9205058 [0,1,1,0,0,0|1,0,0]=3 1155 B10R1.13 CC(Cl)c1ccc(Cl)nc1 Amb28325914 [0,1,1,0,0,0|2,0,0]=4 1156 B10R1.13 CC(Cl)c1ccc(F)cc1 Amb423361 [0,1,1,0,0,0|1,0,0]=3 1157 B10R1.13 CC(Cl)c1ccc(F)nc1 Amb32672005 [0,1,1,0,0,0|2,0,0]=4 1158 B10R1.13 CC(F)c1ccc(Br)cc1 Amb22896470 [0,1,1,0,0,0|1,0,0]=3 1159 B10R1.13 CC(F)c1ccc(Cl)cc1 Amb27876993 [0,1,1,0,0,0|1,0,0]=3 1160 B10R1.13 CC(F)c1ccc(O)cc1 Amb25084251 [0,1,1,0,0,0|1,0,0]=3 1161 B10R1.13 CC(N)c1ccc(Br)cc1 Amb2137046 [0,1,1,0,0,0|1,0,0]=3 1162 B10R1.13 CC(N)c1ccc(Br)cc1 Amb9745697 [0,1,1,0,0,0|1,0,0]=3 1163 B10R1.13 CC(N)c1ccc(Br)cn1 Amb33204521 [0,1,1,0,0,0|2,0,0]=4 1164 B10R1.13 CC(N)c1ccc(Br)cn1 Amb33549040 [0,1,1,0,0,0|2,0,0]=4 1165 B10R1.13 CC(N)c1ccc(Br)nc1 Amb22011636 [0,1,1,0,0,0|2,0,0]=4 1166 B10R1.13 CC(N)c1ccc(Cl)cc1 Amb10782077 [0,1,1,0,0,0|1,0,0]=3 1167 B10R1.13 CC(N)c1ccc(Cl)cc1 Amb32666457 [0,1,1,0,0,0|1,0,0]=3 1168 B10R1.13 CC(N)c1ccc(Cl)cn1 Amb18830679 [0,1,1,0,0,0|2,0,0]=4 1169 B10R1.13 CC(N)c1ccc(Cl)cn1 Amb33212396 [0,1,1,0,0,0|2,0,0]=4 1170 B10R1.13 CC(N)c1ccc(Cl)nc1 Amb23446917 [0,1,1,0,0,0|2,0,0]=4 1171 B10R1.13 CC(N)c1ccc(Cl)nc1 Amb32729411 [0,1,1,0,0,0|2,0,0]=4 1172 B10R1.13 CC(N)c1ccc(F)cc1 Amb19373284 [0,1,1,0,0,0|1,0,0]=3 1173 B10R1.13 CC(N)c1ccc(F)cc1 Amb2568493 [0,1,1,0,0,0|1,0,0]=3 1174 B10R1.13 CC(N)c1ccc(F)cn1 Amb21864846 [0,1,1,0,0,0|2,0,0]=4 1175 B10R1.13 CC(N)c1ccc(F)cn1 Amb23440361 [0,1,1,0,0,0|2,0,0]=4 1176 B10R1.13 CC(N)c1ccc(F)cn1 Amb32666456 [0,1,1,0,0,0|2,0,0]=4 1177 B10R1.13 CC(N)c1ccc(F)nc1 Amb18202880 [0,1,1,0,0,0|2,0,0]=4 1178 B10R1.13 CC(N)c1ccc(I)cc1 Amb32666385 [0,1,1,0,0,0|1,0,0]=3 1179 B10R1.13 CC(N)c1ccc(I)cc1 Amb3791141 [0,1,1,0,0,0|1,0,0]=3 1180 B10R1.13 CC(N)c1ccc(I)cn1 Amb27871427 [0,1,1,0,0,0|2,0,0]=4 1181 B10R1.13 CC(N)c1ccc(N)cc1 Amb10070180 [0,1,1,0,0,0|1,0,0]=3 1182 B10R1.13 CC(N)c1ccc(O)cc1 Amb19888161 [0,1,1,0,0,0|1,0,0]=3 1183 B10R1.13 CC(N)c1ccc(O)cc1 Amb9745698 [0,1,1,0,0,0|1,0,0]=3 1184 B10R1.13 CC(O)=C1C=CC(=O)C=C1 Amb24480664 [0,1,1,0,0,0|0,0,1]=3 1185 B10R1.13 CC(O)c1ccc(Br)cc1 Amb9748228 [0,1,1,0,0,0|0,0,0]=2 1186 B10R1.13 CC(O)c1ccc(Br)nc1 Amb23446253 [0,1,1,0,0,0|1,0,0]=3 1187 B10R1.13 CC(O)c1ccc(Cl)cc1 Amb9703162 [0,1,1,0,0,0|0,0,0]=2 1188 B10R1.13 CC(O)c1ccc(Cl)cn1 Amb24594875 [0,1,1,0,0,0|1,0,0]=3 1189 B10R1.13 CC(O)c1ccc(Cl)nc1 Amb19944632 [0,1,1,0,0,0|1,0,0]=3 1190 B10R1.13 CC(O)c1ccc(F)cc1 Amb9702851 [0,1,1,0,0,0|0,0,0]=2 1191 B10R1.13 CC(O)c1ccc(F)cn1 Amb23412445 [0,1,1,0,0,0|1,0,0]=3 1192 B10R1.13 CC(O)c1ccc(F)nc1 Amb23412440 [0,1,1,0,0,0|1,0,0]=3 1193 B10R1.13 CC(O)c1ccc(I)cc1 Amb9704263 [0,1,1,0,0,0|0,0,0]=2 1194 B10R1.13 CC(O)c1ccc(N)cc1 Amb9775163 [0,1,1,0,0,0|0,0,0]=2 1195 B10R1.13 CC(O)c1ccc(N)cn1 Amb35622096 [0,1,1,0,0,0|1,0,0]=3 1196 B10R1.13 CC(O)c1ccc(N)nc1 Amb23446325 [0,1,1,0,0,0|1,0,0]=3 1197 B10R1.13 CC(O)c1ccc(O)cc1 Amb9748260 [0,1,1,0,0,0|0,0,0]=2 1198 B10R1.13 CC(O)c1ccc(S)cc1 Amb17593857 [0,1,1,0,0,0|0,0,0]=2 1199 B10R1.13 CC(O)c1cnc(Cl)cn1 Amb28454206 [0,1,1,0,0,0|2,0,0]=4 1200 B10R1.13 CC(O)c1cnc(Cl)nc1 Amb30869380 [0,1,1,0,0,0|2,0,0]=4 1201 B10R1.13 CC(O)c1cnc(N)cn1 Amb27437137 [0,1,1,0,0,0|2,0,0]=4 1202 B10R1.13 CC(O)c1ncc(Br)cn1 Amb28124659 [0,1,1,0,0,0|2,0,0]=4 1203 B10R1.13 CC(S)c1ccc(Br)cc1 Amb9208047 [0,1,1,0,0,0|0,1,0]=3 1204 B10R1.13 CC(S)c1ccc(Br)cn1 Amb32788498 [0,1,1,0,0,0|1,1,0]=4 1205 B10R1.13 CC(S)c1ccc(Cl)cc1 Amb9208046 [0,1,1,0,0,0|0,1,0]=3 1206 B10R1.13 CC(S)c1ccc(Cl)cn1 Amb32788127 [0,1,1,0,0,0|1,1,0]=4 1207 B10R1.13 CC(S)c1ccc(F)cc1 Amb9717416 [0,1,1,0,0,0|0,1,0]=3 1208 B10R1.13 CC(S)c1ccc(F)cn1 Amb24379137 [0,1,1,0,0,0|1,1,0]=4 1209 B10R1.13 CC(S)c1ccc(I)cc1 Amb24480962 [0,1,1,0,0,0|0,1,0]=3 1210 B10R1.13 CC(S)c1ccc(N)cc1 Amb25764450 [0,1,1,0,0,0|0,1,0]=3 1211 B10R1.13 CC(S)c1ccc(O)cc1 Amb7784723 [0,1,1,0,0,0|0,1,0]=3 1212 B10R1.13 CC1C=CC(C(C)O)=CN1 Amb28344078 [0,1,1,0,0,0|1,0,1]=4 1213 B10R1.13 CN(C)c1ccc(Br)cc1 Amb2609429 [0,1,1,0,0,0|2,0,0]=4 1214 B10R1.13 CN(C)c1ccc(Cl)cc1 Amb2610455 [0,1,1,0,0,0|2,0,0]=4 1215 B10R1.13 CN(C)c1ccc(F)cc1 Amb2688090 [0,1,1,0,0,0|2,0,0]=4 1216 B10R1.13 CN(C)c1ccc(I)cc1 Amb17940199 [0,1,1,0,0,0|2,0,0]=4 1217 B10R1.13 CN(C)c1ccc(N)cc1 Amb22167797 [0,1,1,0,0,0|2,0,0]=4 1218 B10R1.13 CN(C)c1ccc(N)cc1 Amb8384292 [0,1,1,0,0,0|2,0,0]=4 1219 B10R1.13 CN(C)c1ccc(N)cc1 Amb840116 [0,1,1,0,0,0|2,0,0]=4 1220 B10R1.13 CN(C)c1ccc(N)cc1 Amb9825379 [0,1,1,0,0,0|2,0,0]=4 1221 B10R1.13 CN(C)c1ccc(O)cc1 Amb21864855 [0,1,1,0,0,0|2,0,0]=4 1222 B10R1.13 CN(C)c1ccc(O)cc1 Amb8439109 [0,1,1,0,0,0|2,0,0]=4 1223 B10R1.13 CN(C)c1ccc(S)cc1 Amb2687468 [0,1,1,0,0,0|2,0,0]=4 1224 B10R1.13 CN(N)c1ccc(Br)cc1 Amb17237219 [0,1,1,0,0,0|2,0,0]=4 1225 B10R1.13 CN(N)c1ccc(Cl)cc1 Amb17232198 [0,1,1,0,0,0|2,0,0]=4 1226 B10R1.13 CN(N)c1ccc(F)cc1 Amb17231916 [0,1,1,0,0,0|2,0,0]=4 1227 B10R1.13 CS(=O)c1ccc(Br)cc1 Amb4012605 [0,1,1,0,0,0|1,0,1]=4 1228 B10R1.13 CS(=O)c1ccc(Cl)cc1 Amb19892199 [0,1,1,0,0,0|1,0,1]=4 1229 B10R1.13 CS(=O)c1ccc(F)cc1 Amb19892152 [0,1,1,0,0,0|1,0,1]=4 1230 B10R1.13 CS(=O)c1ccc(N)cc1 Amb18945202 [0,1,1,0,0,0|1,0,1]=4 1231 B10R1.13 CS(=O)c1ccc(O)cc1 Amb17873067 [0,1,1,0,0,0|1,0,1]=4 1232 B10R1.13 C[C@@H](N)c1ccc(Br)cc1 Amb2720389 [0,1,1,0,0,0|1,0,0]=3 1233 B10R1.13 C[C@@H](N)c1ccc(Br)cc1 Amb8516402 [0,1,1,0,0,0|1,0,0]=3 1234 B10R1.13 C[C@@H](N)c1ccc(Br)cn1 Amb19929894 [0,1,1,0,0,0|2,0,0]=4 1235 B10R1.13 C[C@@H](N)c1ccc(Br)cn1 Amb23440518 [0,1,1,0,0,0|2,0,0]=4 1236 B10R1.13 C[C@@H](N)c1ccc(Br)cn1 Amb23440519 [0,1,1,0,0,0|2,0,0]=4 1237 B10R1.13 C[C@@H](N)c1ccc(Br)nc1 Amb25055663 [0,1,1,0,0,0|2,0,0]=4 1238 B10R1.13 C[C@@H](N)c1ccc(Cl)cc1 Amb22288609 [0,1,1,0,0,0|1,0,0]=3 1239 B10R1.13 C[C@@H](N)c1ccc(Cl)cc1 Amb8517458 [0,1,1,0,0,0|1,0,0]=3 1240 B10R1.13 C[C@@H](N)c1ccc(Cl)cn1 Amb25146319 [0,1,1,0,0,0|2,0,0]=4 1241 B10R1.13 C[C@@H](N)c1ccc(Cl)cn1 Amb33212369 [0,1,1,0,0,0|2,0,0]=4 1242 B10R1.13 C[C@@H](N)c1ccc(Cl)nc1 Amb26608000 [0,1,1,0,0,0|2,0,0]=4 1243 B10R1.13 C[C@@H](N)c1ccc(F)cc1 Amb10839828 [0,1,1,0,0,0|1,0,0]=3 1244 B10R1.13 C[C@@H](N)c1ccc(F)cc1 Amb16233880 [0,1,1,0,0,0|1,0,0]=3 1245 B10R1.13 C[C@@H](N)c1ccc(F)cn1 Amb22744794 [0,1,1,0,0,0|2,0,0]=4 1246 B10R1.13 C[C@@H](N)c1ccc(F)cn1 Amb23440360 [0,1,1,0,0,0|2,0,0]=4 1247 B10R1.13 C[C@@H](N)c1ccc(F)cn1 Amb30869541 [0,1,1,0,0,0|2,0,0]=4 1248 B10R1.13 C[C@@H](N)c1ccc(F)nc1 Amb26989153 [0,1,1,0,0,0|2,0,0]=4 1249 B10R1.13 C[C@@H](N)c1ccc(I)cc1 Amb15690597 [0,1,1,0,0,0|1,0,0]=3 1250 B10R1.13 C[C@@H](N)c1ccc(I)cc1 Amb6893598 [0,1,1,0,0,0|1,0,0]=3 1251 B10R1.13 C[C@@H](N)c1ccc(N)cc1 Amb22406362 [0,1,1,0,0,0|1,0,0]=3 1252 B10R1.13 C[C@@H](N)c1ccc(N)cc1 Amb22504246 [0,1,1,0,0,0|1,0,0]=3 1253 B10R1.13 C[C@@H](N)c1ccc(O)cc1 Amb30869508 [0,1,1,0,0,0|1,0,0]=3 1254 B10R1.13 C[C@@H](N)c1ccc(O)cc1 Amb6295798 [0,1,1,0,0,0|1,0,0]=3 1255 B10R1.13 C[C@@H](N)c1ccc(O)nc1 Amb27874058 [0,1,1,0,0,0|2,0,0]=4 1256 B10R1.13 C[C@@H](N)c1ccc(O)nc1 Amb35750762 [0,1,1,0,0,0|2,0,0]=4 1257 B10R1.13 C[C@@H](N)c1ccc(S)cc1 Amb28050230 [0,1,1,0,0,0|1,0,0]=3 1258 B10R1.13 C[C@@H](O)c1ccc(Br)cc1 Amb8517114 [0,1,1,0,0,0|0,0,0]=2 1259 B10R1.13 C[C@@H](O)c1ccc(Br)cn1 Amb24732317 [0,1,1,0,0,0|1,0,0]=3 1260 B10R1.13 C[C@@H](O)c1ccc(Br)nc1 Amb25377395 [0,1,1,0,0,0|1,0,0]=3 1261 B10R1.13 C[C@@H](O)c1ccc(Cl)cc1 Amb20241103 [0,1,1,0,0,0|0,0,0]=2 1262 B10R1.13 C[C@@H](O)c1ccc(Cl)cn1 Amb27662871 [0,1,1,0,0,0|1,0,0]=3 1263 B10R1.13 C[C@@H](O)c1ccc(Cl)nc1 Amb26486565 [0,1,1,0,0,0|1,0,0]=3 1264 B10R1.13 C[C@@H](O)c1ccc(F)cc1 Amb8517144 [0,1,1,0,0,0|0,0,0]=2 1265 B10R1.13 C[C@@H](O)c1ccc(F)cn1 Amb25377570 [0,1,1,0,0,0|1,0,0]=3 1266 B10R1.13 C[C@@H](O)c1ccc(F)nc1 Amb33426556 [0,1,1,0,0,0|1,0,0]=3 1267 B10R1.13 C[C@@H](O)c1ccc(I)cc1 Amb6893597 [0,1,1,0,0,0|0,0,0]=2 1268 B10R1.13 C[C@@H](O)c1ccc(N)cc1 Amb25228343 [0,1,1,0,0,0|0,0,0]=2 1269 B10R1.13 C[C@@H](O)c1ccc(O)cc1 Amb25273162 [0,1,1,0,0,0|0,0,0]=2 1270 B10R1.13 C[C@@H](O)c1ccc(S)cc1 Amb27954303 [0,1,1,0,0,0|0,0,0]=2 1271 B10R1.13 C[C@@H](O)c1ncc(Br)cn1 Amb33240809 [0,1,1,0,0,0|2,0,0]=4 1272 B10R1.13 C[C@@H](O)c1ncc(O)cn1 Amb22886938 [0,1,1,0,0,0|2,0,0]=4 1273 B10R1.13 C[C@H](Br)c1ccc(Cl)cc1 Amb27597081 [0,1,1,0,0,0|1,0,0]=3 1274 B10R1.13 C[C@H](N)c1ccc(Br)cc1 Amb22274557 [0,1,1,0,0,0|1,0,0]=3 1275 B10R1.13 C[C@H](N)c1ccc(Br)cc1 Amb3941397 [0,1,1,0,0,0|1,0,0]=3 1276 B10R1.13 C[C@H](N)c1ccc(Br)cn1 Amb19929895 [0,1,1,0,0,0|2,0,0]=4 1277 B10R1.13 C[C@H](N)c1ccc(Br)cn1 Amb26398911 [0,1,1,0,0,0|2,0,0]=4 1278 B10R1.13 C[C@H](N)c1ccc(Br)cn1 Amb33813744 [0,1,1,0,0,0|2,0,0]=4 1279 B10R1.13 C[C@H](N)c1ccc(Br)nc1 Amb25872114 [0,1,1,0,0,0|2,0,0]=4 1280 B10R1.13 C[C@H](N)c1ccc(Cl)cc1 Amb22288669 [0,1,1,0,0,0|1,0,0]=3 1281 B10R1.13 C[C@H](N)c1ccc(Cl)cc1 Amb8517459 [0,1,1,0,0,0|1,0,0]=3 1282 B10R1.13 C[C@H](N)c1ccc(Cl)cn1 Amb32927488 [0,1,1,0,0,0|2,0,0]=4 1283 B10R1.13 C[C@H](N)c1ccc(Cl)nc1 Amb24058236 [0,1,1,0,0,0|2,0,0]=4 1284 B10R1.13 C[C@H](N)c1ccc(F)cc1 Amb10838303 [0,1,1,0,0,0|1,0,0]=3 1285 B10R1.13 C[C@H](N)c1ccc(F)cc1 Amb22406364 [0,1,1,0,0,0|1,0,0]=3 1286 B10R1.13 C[C@H](N)c1ccc(F)cn1 Amb25843222 [0,1,1,0,0,0|2,0,0]=4 1287 B10R1.13 C[C@H](N)c1ccc(F)cn1 Amb33872123 [0,1,1,0,0,0|2,0,0]=4 1288 B10R1.13 C[C@H](N)c1ccc(F)cn1 Amb33877583 [0,1,1,0,0,0|2,0,0]=4 1289 B10R1.13 C[C@H](N)c1ccc(F)nc1 Amb26331082 [0,1,1,0,0,0|2,0,0]=4 1290 B10R1.13 C[C@H](N)c1ccc(I)cc1 Amb32927485 [0,1,1,0,0,0|1,0,0]=3 1291 B10R1.13 C[C@H](N)c1ccc(I)cc1 Amb6893599 [0,1,1,0,0,0|1,0,0]=3 1292 B10R1.13 C[C@H](N)c1ccc(O)cc1 Amb8630046 [0,1,1,0,0,0|1,0,0]=3 1293 B10R1.13 C[C@H](N)c1ccc(O)nc1 Amb24562815 [0,1,1,0,0,0|2,0,0]=4 1294 B10R1.13 C[C@H](N)c1ccc(O)nc1 Amb33803391 [0,1,1,0,0,0|2,0,0]=4 1295 B10R1.13 C[C@H](O)c1ccc(Br)cc1 Amb8517113 [0,1,1,0,0,0|0,0,0]=2 1296 B10R1.13 C[C@H](O)c1ccc(Br)cn1 Amb25147811 [0,1,1,0,0,0|1,0,0]=3 1297 B10R1.13 C[C@H](O)c1ccc(Br)nc1 Amb27643696 [0,1,1,0,0,0|1,0,0]=3 1298 B10R1.13 C[C@H](O)c1ccc(Cl)cc1 Amb20241104 [0,1,1,0,0,0|0,0,0]=2 1299 B10R1.13 C[C@H](O)c1ccc(Cl)cn1 Amb24724836 [0,1,1,0,0,0|1,0,0]=3 1300 B10R1.13 C[C@H](O)c1ccc(Cl)nc1 Amb24415131 [0,1,1,0,0,0|1,0,0]=3 1301 B10R1.13 C[C@H](O)c1ccc(F)cc1 Amb16185872 [0,1,1,0,0,0|0,0,0]=2 1302 B10R1.13 C[C@H](O)c1ccc(F)cn1 Amb25785567 [0,1,1,0,0,0|1,0,0]=3 1303 B10R1.13 C[C@H](O)c1ccc(F)nc1 Amb33426555 [0,1,1,0,0,0|1,0,0]=3 1304 B10R1.13 C[C@H](O)c1ccc(I)cc1 Amb6893596 [0,1,1,0,0,0|0,0,0]=2 1305 B10R1.13 C[C@H](O)c1ccc(N)cc1 Amb24384238 [0,1,1,0,0,0|0,0,0]=2 1306 B10R1.13 C[C@H](O)c1ccc(O)cc1 Amb24644699 [0,1,1,0,0,0|0,0,0]=2 1307 B10R1.13 C[C@H](O)c1ncc(Br)cn1 Amb33451096 [0,1,1,0,0,0|2,0,0]=4 1308 B10R1.13 C[NH+](C)c1ccc([NH3+])cc1 Amb20246441 [0,1,1,0,0,0|2,0,0]=4 1309 B10R1.13 C[S+](C)c1ccc(O)cc1 Amb24066115 [0,1,1,0,0,0|2,0,0]=4 1310 B10R1.13 Cc1ccc(B(O)O)cc1 Amb2447083 [0,1,1,0,0,0|2,0,0]=4 1311 B10R1.13 Cc1ccc(C(=O)O)cc1 Amb2609016 [0,1,1,0,0,0|1,0,1]=4 1312 B10R1.13 Cc1ccc(C(C)Br)cc1 Amb8835398 [0,1,1,0,0,0|1,0,0]=3 1313 B10R1.13 Cc1ccc(C(C)C)cc1 Amb19929657 [0,1,1,0,0,0|1,0,0]=3 1314 B10R1.13 Cc1ccc(C(C)C)cc1 Amb30451179 [0,1,1,0,0,0|1,0,0]=3 1315 B10R1.13 Cc1ccc(C(C)C)cc1 Amb6608914 [0,1,1,0,0,0|1,0,0]=3 1316 B10R1.13 Cc1ccc(C(C)C)cn1 Amb25268487 [0,1,1,0,0,0|2,0,0]=4 1317 B10R1.13 Cc1ccc(C(C)C)nc1 Amb26480765 [0,1,1,0,0,0|2,0,0]=4 1318 B10R1.13 Cc1ccc(C(C)Cl)cc1 Amb9205034 [0,1,1,0,0,0|1,0,0]=3 1319 B10R1.13 Cc1ccc(C(C)Cl)nc1 Amb22753450 [0,1,1,0,0,0|2,0,0]=4 1320 B10R1.13 Cc1ccc(C(C)N)cc1 Amb33999499 [0,1,1,0,0,0|1,0,0]=3 1321 B10R1.13 Cc1ccc(C(C)N)cc1 Amb8471031 [0,1,1,0,0,0|1,0,0]=3 1322 B10R1.13 Cc1ccc(C(C)N)cn1 Amb31028984 [0,1,1,0,0,0|2,0,0]=4 1323 B10R1.13 Cc1ccc(C(C)N)cn1 Amb8010332 [0,1,1,0,0,0|2,0,0]=4 1324 B10R1.13 Cc1ccc(C(C)N)nc1 Amb10608253 [0,1,1,0,0,0|2,0,0]=4 1325 B10R1.13 Cc1ccc(C(C)N)nc1 Amb22756401 [0,1,1,0,0,0|2,0,0]=4 1326 B10R1.13 Cc1ccc(C(C)O)cc1 Amb4035861 [0,1,1,0,0,0|0,0,0]=2 1327 B10R1.13 Cc1ccc(C(C)O)cn1 Amb2694197 [0,1,1,0,0,0|1,0,0]=3 1328 B10R1.13 Cc1ccc(C(C)O)nc1 Amb25986570 [0,1,1,0,0,0|1,0,0]=3 1329 B10R1.13 Cc1ccc(C(C)O)nn1 Amb27209217 [0,1,1,0,0,0|2,0,0]=4 1330 B10R1.13 Cc1ccc(C(C)S)cc1 Amb9208029 [0,1,1,0,0,0|0,1,0]=3 1331 B10R1.13 Cc1ccc(C(Cl)Cl)cc1 Amb8387745 [0,1,1,0,0,0|2,0,0]=4 1332 B10R1.13 Cc1ccc(C(F)F)cc1 Amb27843548 [0,1,1,0,0,0|2,0,0]=4 1333 B10R1.13 Cc1ccc(N(C)N)cc1 Amb17231897 [0,1,1,0,0,0|2,0,0]=4 1334 B10R1.13 Cc1ccc(S(=O)O)cc1 Amb22436806 [0,1,1,0,0,0|2,0,0]=4 1335 B10R1.13 Cc1ccc(S(=O)O)cc1 Amb6843901 [0,1,1,0,0,0|2,0,0]=4 1336 B10R1.13 Cc1ccc([C@@H](C)Br)cc1 Amb27483980 [0,1,1,0,0,0|1,0,0]=3 1337 B10R1.13 Cc1ccc([C@@H](C)N)cc1 Amb20242449 [0,1,1,0,0,0|1,0,0]=3 1338 B10R1.13 Cc1ccc([C@@H](C)N)cc1 Amb22288639 [0,1,1,0,0,0|1,0,0]=3 1339 B10R1.13 Cc1ccc([C@@H](C)N)cn1 Amb27230348 [0,1,1,0,0,0|2,0,0]=4 1340 B10R1.13 Cc1ccc([C@@H](C)N)nc1 Amb25146463 [0,1,1,0,0,0|2,0,0]=4 1341 B10R1.13 Cc1ccc([C@@H](C)O)cc1 Amb25859279 [0,1,1,0,0,0|0,0,0]=2 1342 B10R1.13 Cc1ccc([C@@H](C)O)cn1 Amb33344529 [0,1,1,0,0,0|1,0,0]=3 1343 B10R1.13 Cc1ccc([C@@H](C)O)nc1 Amb24549031 [0,1,1,0,0,0|1,0,0]=3 1344 B10R1.13 Cc1ccc([C@H](C)N)cc1 Amb9825977 [0,1,1,0,0,0|1,0,0]=3 1345 B10R1.13 Cc1ccc([C@H](C)N)cn1 Amb26580554 [0,1,1,0,0,0|2,0,0]=4 1346 B10R1.13 Cc1ccc([C@H](C)N)nc1 Amb27615028 [0,1,1,0,0,0|2,0,0]=4 1347 B10R1.13 Cc1ccc([C@H](C)O)cc1 Amb20241494 [0,1,1,0,0,0|0,0,0]=2 1348 B10R1.13 Cc1ccc([C@H](C)O)cn1 Amb33344520 [0,1,1,0,0,0|1,0,0]=3 1349 B10R1.13 Cc1ccc([C@H](C)O)nc1 Amb27959952 [0,1,1,0,0,0|1,0,0]=3 1350 B10R1.13 Cc1ccc([PH](=O)O)cc1 Amb3371950 [0,1,1,0,0,0|2,0,0]=4 1351 B10R1.13 Cc1ccc([S@@](C)=O)cc1 Amb2609029 [0,1,1,0,0,0|1,0,1]=4 1352 B10R1.13 Cc1cnc(C(C)O)nc1 Amb27666415 [0,1,1,0,0,0|2,0,0]=4 1353 B10R1.13 Cc1cnc([C@@H](C)O)cn1 Amb33375607 [0,1,1,0,0,0|2,0,0]=4 1354 B10R1.13 Cc1cnc([C@H](C)O)cn1 Amb33375606 [0,1,1,0,0,0|2,0,0]=4 1355 B10R1.13 Cc1ncc(C(C)O)cn1 Amb20670586 [0,1,1,0,0,0|2,0,0]=4 1356 B10R1.13 Clc1ccc(C(Cl)Cl)cc1 Amb16234135 [0,1,1,0,0,0|2,0,0]=4 1357 B10R1.13 FC(F)c1ccc(Br)cc1 Amb2691591 [0,1,1,0,0,0|2,0,0]=4 1358 B10R1.13 FC(F)c1ccc(Cl)cc1 Amb19889908 [0,1,1,0,0,0|2,0,0]=4 1359 B10R1.13 FC(F)c1ccc(I)cc1 Amb27239635 [0,1,1,0,0,0|2,0,0]=4 1360 B10R1.13 Fc1ccc(C(Br)Br)cc1 Amb27951761 [0,1,1,0,0,0|2,0,0]=4 1361 B10R1.13 Fc1ccc(C(Cl)Cl)cc1 Amb8386184 [0,1,1,0,0,0|2,0,0]=4 1362 B10R1.13 Fc1ccc(C(F)F)cc1 Amb2691923 [0,1,1,0,0,0|2,0,0]=4 1363 B10R1.13 Nc1ccc(B(O)O)cc1 Amb10068599 [0,1,1,0,0,0|2,0,0]=4 1364 B10R1.13 Nc1ccc(B(O)O)cc1 Amb2455636 [0,1,1,0,0,0|2,0,0]=4 1365 B10R1.13 Nc1ccc(C(=O)O)cc1 Amb24066899 [0,1,1,0,0,0|1,0,1]=4 1366 B10R1.13 Nc1ccc(C(=O)O)cc1 Amb6238177 [0,1,1,0,0,0|1,0,1]=4 1367 B10R1.13 Nc1ccc(C(Cl)Cl)cc1 Amb27617062 [0,1,1,0,0,0|2,0,0]=4 1368 B10R1.13 Nc1ccc(C(F)F)cc1 Amb20242301 [0,1,1,0,0,0|2,0,0]=4 1369 B10R1.13 Nc1ccc(C(F)F)cc1 Amb23399562 [0,1,1,0,0,0|2,0,0]=4 1370 B10R1.13 Nc1ccc(S(=O)O)cc1 Amb6374224 [0,1,1,0,0,0|2,0,0]=4 1371 B10R1.13 O=C(O)c1ccc(Br)cc1 Amb1935068 [0,1,1,0,0,0|1,0,1]=4 1372 B10R1.13 O=C(O)c1ccc(Cl)cc1 Amb2792854 [0,1,1,0,0,0|1,0,1]=4 1373 B10R1.13 O=C(O)c1ccc(F)cc1 Amb2688024 [0,1,1,0,0,0|1,0,1]=4 1374 B10R1.13 O=C(O)c1ccc(I)cc1 Amb6446256 [0,1,1,0,0,0|1,0,1]=4 1375 B10R1.13 O=C(O)c1ccc(O)cc1 Amb2569657 [0,1,1,0,0,0|1,0,1]=4 1376 B10R1.13 O=C(O)c1ccc(S)cc1 Amb2371749 [0,1,1,0,0,0|1,0,1]=4 1377 B10R1.13 O=S(O)c1ccc(Br)cc1 Amb18570792 [0,1,1,0,0,0|2,0,0]=4 1378 B10R1.13 O=S(O)c1ccc(Cl)cc1 Amb18564047 [0,1,1,0,0,0|2,0,0]=4 1379 B10R1.13 O=S(O)c1ccc(F)cc1 Amb18065461 [0,1,1,0,0,0|2,0,0]=4 1380 B10R1.13 O=S(O)c1ccc(O)cc1 Amb27768727 [0,1,1,0,0,0|2,0,0]=4 1381 B10R1.13 O=[PH](O)c1ccc(Cl)cc1 Amb348488 [0,1,1,0,0,0|2,0,0]=4 1382 B10R1.13 O=[Se](O)c1ccc(Cl)cc1 Amb9809799 [0,1,1,0,0,0|2,0,0]=4 1383 B10R1.13 OB(O)c1ccc(Br)cc1 Amb2447085 [0,1,1,0,0,0|2,0,0]=4 1384 B10R1.13 OB(O)c1ccc(Cl)cc1 Amb22587705 [0,1,1,0,0,0|2,0,0]=4 1385 B10R1.13 OB(O)c1ccc(Cl)cc1 Amb2383484 [0,1,1,0,0,0|2,0,0]=4 1386 B10R1.13 OB(O)c1ccc(F)cc1 Amb2383483 [0,1,1,0,0,0|2,0,0]=4 1387 B10R1.13 OB(O)c1ccc(I)cc1 Amb2722529 [0,1,1,0,0,0|2,0,0]=4 1388 B10R1.13 OB(O)c1ccc(O)cc1 Amb2447026 [0,1,1,0,0,0|2,0,0]=4 1389 B10R1.13 OB(O)c1ccc(S)cc1 Amb2447100 [0,1,1,0,0,0|2,0,0]=4 1390 B10R1.13 OC(O)c1ccc(Cl)cc1 Amb27971903 [0,1,1,0,0,0|1,0,0]=3 1391 B10R1.13 OP(O)c1ccc(F)cc1 Amb27223875 [0,1,1,0,0,0|2,0,0]=4 1392 B10R1.13 Oc1ccc(C(F)F)cc1 Amb20241070 [0,1,1,0,0,0|2,0,0]=4 1393 B10R1.15 BP(CO)c1ccccc1 Amb27652937 [0,1,1,0,0,0|2,0,0]=4 1394 B10R1.15 B[PH](CO)c1ccccc1 Amb27826578 [0,1,1,0,0,0|2,0,0]=4 1395 B10R1.15 BrCC(Br)c1ccccc1 Amb8394124 [0,1,1,0,0,0|1,0,0]=3 1396 B10R1.15 C#CC(Br)c1ccccc1 Amb28121035 [0,1,1,0,0,0|1,0,1]=4 1397 B10R1.15 C#CC(C)c1ccccc1 Amb24106607 [0,1,1,0,0,0|1,0,0]=3 1398 B10R1.15 C#CC(C)c1ccccn1 Amb33360773 [0,1,1,0,0,0|2,0,0]=4 1399 B10R1.15 C#CC(C)c1cccnc1 Amb33224702 [0,1,1,0,0,0|2,0,0]=4 1400 B10R1.15 C#CC(C)c1ccncc1 Amb33380650 [0,1,1,0,0,0|2,0,0]=4 1401 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [0,1,1,0,0,0|1,0,1]=4 1402 B10R1.15 C#CC(N)c1ccccc1 Amb33204420 [0,1,1,0,0,0|1,0,1]=4 1403 B10R1.15 C#CC(O)c1ccccc1 Amb2721623 [0,1,1,0,0,0|0,0,1]=3 1404 B10R1.15 C#CC(O)c1ccccn1 Amb24653150 [0,1,1,0,0,0|1,0,1]=4 1405 B10R1.15 C#CC(O)c1cccnc1 Amb27838902 [0,1,1,0,0,0|1,0,1]=4 1406 B10R1.15 C#CC(O)c1ccncc1 Amb21964740 [0,1,1,0,0,0|1,0,1]=4 1407 B10R1.15 C#C[C@@H](N)c1ccccc1 Amb27599946 [0,1,1,0,0,0|1,0,1]=4 1408 B10R1.15 C#C[C@@H](O)c1ccccc1 Amb10844978 [0,1,1,0,0,0|0,0,1]=3 1409 B10R1.15 C#C[C@@H](O)c1cccnc1 Amb27474268 [0,1,1,0,0,0|1,0,1]=4 1410 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [0,1,1,0,0,0|0,0,1]=3 1411 B10R1.15 C=C(CBr)c1ccccc1 Amb8391739 [0,1,1,0,0,0|1,0,1]=4 1412 B10R1.15 C=C(CCl)c1ccccc1 Amb26968652 [0,1,1,0,0,0|1,0,1]=4 1413 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [0,1,1,0,0,0|1,0,1]=4 1414 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [0,1,1,0,0,0|1,0,1]=4 1415 B10R1.15 C=C(CO)c1ccccc1 Amb27839071 [0,1,1,0,0,0|0,0,2]=4 1416 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [0,1,1,0,0,0|1,0,1]=4 1417 B10R1.15 C=CC(C)c1ccccc1 Amb26460576 [0,1,1,0,0,0|1,0,0]=3 1418 B10R1.15 C=CC(C)c1ccccn1 Amb27838866 [0,1,1,0,0,0|2,0,0]=4 1419 B10R1.15 C=CC(Cl)c1ccccc1 Amb17943120 [0,1,1,0,0,0|1,0,1]=4 1420 B10R1.15 C=CC(Cl)c1ccccc1 Amb33963194 [0,1,1,0,0,0|1,0,1]=4 1421 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [0,1,1,0,0,0|1,0,1]=4 1422 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [0,1,1,0,0,0|1,0,1]=4 1423 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [0,1,1,0,0,0|0,0,1]=3 1424 B10R1.15 C=CC(O)c1ccccn1 Amb26021512 [0,1,1,0,0,0|1,0,1]=4 1425 B10R1.15 C=CC(O)c1cccnc1 Amb26845235 [0,1,1,0,0,0|1,0,1]=4 1426 B10R1.15 C=CC(O)c1ccncc1 Amb24546417 [0,1,1,0,0,0|1,0,1]=4 1427 B10R1.15 C=CN(C)c1ccccc1 Amb27878913 [0,1,1,0,0,0|2,0,0]=4 1428 B10R1.15 C=C[C@@H](N)c1ccccc1 Amb27391592 [0,1,1,0,0,0|1,0,1]=4 1429 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [0,1,1,0,0,0|0,0,1]=3 1430 B10R1.15 C=C[SiH](C)c1ccccc1 Amb8515879 [0,1,1,0,0,0|1,1,0]=4 1431 B10R1.15 C=NC(C)c1ccccn1 Amb28204098 [0,1,1,0,0,0|2,0,0]=4 1432 B10R1.15 CC(C#N)c1ccccc1 Amb2387010 [0,1,1,0,0,0|1,0,0]=3 1433 B10R1.15 CC(C#N)c1ccccn1 Amb8950070 [0,1,1,0,0,0|2,0,0]=4 1434 B10R1.15 CC(C#N)c1cccnc1 Amb8950033 [0,1,1,0,0,0|2,0,0]=4 1435 B10R1.15 CC(C#N)c1ccncc1 Amb8950034 [0,1,1,0,0,0|2,0,0]=4 1436 B10R1.15 CC(C=O)c1ccccc1 Amb2720746 [0,1,1,0,0,0|0,0,1]=3 1437 B10R1.15 CC(C=O)c1ccccn1 Amb29762718 [0,1,1,0,0,0|1,0,1]=4 1438 B10R1.15 CC(C=O)c1cccnc1 Amb24100578 [0,1,1,0,0,0|1,0,1]=4 1439 B10R1.15 CC(C=O)c1ccncc1 Amb33358501 [0,1,1,0,0,0|1,0,1]=4 1440 B10R1.15 CC(CBr)c1ccccc1 Amb3940569 [0,1,1,0,0,0|1,0,0]=3 1441 B10R1.15 CC(CBr)c1ccccn1 Amb27471389 [0,1,1,0,0,0|2,0,0]=4 1442 B10R1.15 CC(CBr)c1cccnc1 Amb33118517 [0,1,1,0,0,0|2,0,0]=4 1443 B10R1.15 CC(CBr)c1ccncc1 Amb26369737 [0,1,1,0,0,0|2,0,0]=4 1444 B10R1.15 CC(CCl)c1ccccc1 Amb17232147 [0,1,1,0,0,0|1,0,0]=3 1445 B10R1.15 CC(CCl)c1cccnc1 Amb24085112 [0,1,1,0,0,0|2,0,0]=4 1446 B10R1.15 CC(CCl)c1ccncc1 Amb27835971 [0,1,1,0,0,0|2,0,0]=4 1447 B10R1.15 CC(CI)c1ccccc1 Amb26629255 [0,1,1,0,0,0|1,0,0]=3 1448 B10R1.15 CC(CI)c1ccccn1 Amb30010228 [0,1,1,0,0,0|2,0,0]=4 1449 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [0,1,1,0,0,0|1,0,0]=3 1450 B10R1.15 CC(CN)c1ccccc1 Amb5717369 [0,1,1,0,0,0|1,0,0]=3 1451 B10R1.15 CC(CN)c1ccccn1 Amb33528304 [0,1,1,0,0,0|2,0,0]=4 1452 B10R1.15 CC(CN)c1cccnc1 Amb8950129 [0,1,1,0,0,0|2,0,0]=4 1453 B10R1.15 CC(CN)c1ccncc1 Amb32668866 [0,1,1,0,0,0|2,0,0]=4 1454 B10R1.15 CC(CN)c1ccncc1 Amb8950130 [0,1,1,0,0,0|2,0,0]=4 1455 B10R1.15 CC(CO)c1ccccc1 Amb2720837 [0,1,1,0,0,0|0,0,0]=2 1456 B10R1.15 CC(CO)c1ccccn1 Amb22896757 [0,1,1,0,0,0|1,0,0]=3 1457 B10R1.15 CC(CO)c1cccnc1 Amb33745581 [0,1,1,0,0,0|1,0,0]=3 1458 B10R1.15 CC(CO)c1ccncc1 Amb24480432 [0,1,1,0,0,0|1,0,0]=3 1459 B10R1.15 CC(CO)c1cnccn1 Amb33746148 [0,1,1,0,0,0|2,0,0]=4 1460 B10R1.15 CC(CS)c1ccccc1 Amb28349926 [0,1,1,0,0,0|0,1,0]=3 1461 B10R1.15 CC(CS)c1ccccn1 Amb29858764 [0,1,1,0,0,0|1,1,0]=4 1462 B10R1.15 CC(NCl)c1ccccc1 Amb28049660 [0,1,1,0,0,0|1,0,0]=3 1463 B10R1.15 CC(NN)c1ccccc1 Amb10610271 [0,1,1,0,0,0|1,0,0]=3 1464 B10R1.15 CC(NN)c1ccccc1 Amb6251215 [0,1,1,0,0,0|1,0,0]=3 1465 B10R1.15 CC(NN)c1ccccn1 Amb6243803 [0,1,1,0,0,0|2,0,0]=4 1466 B10R1.15 CC(NN)c1cccnc1 Amb6243761 [0,1,1,0,0,0|2,0,0]=4 1467 B10R1.15 CC(NN)c1ccncc1 Amb32663987 [0,1,1,0,0,0|2,0,0]=4 1468 B10R1.15 CC(NN)c1ccncc1 Amb9714299 [0,1,1,0,0,0|2,0,0]=4 1469 B10R1.15 CC(NO)c1ccccc1 Amb10605006 [0,1,1,0,0,0|0,0,0]=2 1470 B10R1.15 CC(NO)c1ccccn1 Amb10605008 [0,1,1,0,0,0|1,0,0]=3 1471 B10R1.15 CC(NO)c1cccnc1 Amb10605009 [0,1,1,0,0,0|1,0,0]=3 1472 B10R1.15 CC(ON)c1ccccc1 Amb17089185 [0,1,1,0,0,0|0,0,0]=2 1473 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [0,1,1,0,0,0|0,0,0]=2 1474 B10R1.15 CC(ON)c1ccccn1 Amb22397048 [0,1,1,0,0,0|1,0,0]=3 1475 B10R1.15 CC(ON)c1cccnc1 Amb31295300 [0,1,1,0,0,0|1,0,0]=3 1476 B10R1.15 CC(ON)c1ccncc1 Amb22397090 [0,1,1,0,0,0|1,0,0]=3 1477 B10R1.15 CC(ON)c1ccncn1 Amb33268673 [0,1,1,0,0,0|2,0,0]=4 1478 B10R1.15 CC(ON)c1cnccn1 Amb33359983 [0,1,1,0,0,0|2,0,0]=4 1479 B10R1.15 CC(ON)c1cncnc1 Amb33149194 [0,1,1,0,0,0|2,0,0]=4 1480 B10R1.15 CC(ON)c1ncccn1 Amb33270401 [0,1,1,0,0,0|2,0,0]=4 1481 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [0,1,1,0,0,0|0,0,2]=4 1482 B10R1.15 CCC(Br)c1ccccc1 Amb9210652 [0,1,1,0,0,0|1,0,0]=3 1483 B10R1.15 CCC(Br)c1ccccn1 Amb27647660 [0,1,1,0,0,0|2,0,0]=4 1484 B10R1.15 CCC(Br)c1cccnc1 Amb24556035 [0,1,1,0,0,0|2,0,0]=4 1485 B10R1.15 CCC(Br)c1ccncc1 Amb27463363 [0,1,1,0,0,0|2,0,0]=4 1486 B10R1.15 CCC(C)c1ccccc1 Amb9702788 [0,1,1,0,0,0|1,0,0]=3 1487 B10R1.15 CCC(C)c1ccccn1 Amb28145932 [0,1,1,0,0,0|2,0,0]=4 1488 B10R1.15 CCC(C)c1ccncc1 Amb26842817 [0,1,1,0,0,0|2,0,0]=4 1489 B10R1.15 CCC(Cl)c1ccccc1 Amb7766794 [0,1,1,0,0,0|1,0,0]=3 1490 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [0,1,1,0,0,0|1,0,0]=3 1491 B10R1.15 CCC(N)c1ccccc1 Amb9703596 [0,1,1,0,0,0|1,0,0]=3 1492 B10R1.15 CCC(N)c1ccccn1 Amb10607917 [0,1,1,0,0,0|2,0,0]=4 1493 B10R1.15 CCC(N)c1ccccn1 Amb22587075 [0,1,1,0,0,0|2,0,0]=4 1494 B10R1.15 CCC(N)c1cccnc1 Amb10607957 [0,1,1,0,0,0|2,0,0]=4 1495 B10R1.15 CCC(N)c1cccnc1 Amb30588534 [0,1,1,0,0,0|2,0,0]=4 1496 B10R1.15 CCC(N)c1ccncc1 Amb8009606 [0,1,1,0,0,0|2,0,0]=4 1497 B10R1.15 CCC(O)c1ccccc1 Amb6705776 [0,1,1,0,0,0|0,0,0]=2 1498 B10R1.15 CCC(O)c1ccccn1 Amb26851902 [0,1,1,0,0,0|1,0,0]=3 1499 B10R1.15 CCC(O)c1cccnc1 Amb17231904 [0,1,1,0,0,0|1,0,0]=3 1500 B10R1.15 CCC(O)c1ccncc1 Amb16233288 [0,1,1,0,0,0|1,0,0]=3 1501 B10R1.15 CCC(O)c1cncnc1 Amb26619472 [0,1,1,0,0,0|2,0,0]=4 1502 B10R1.15 CCC(O)c1ncccn1 Amb28049305 [0,1,1,0,0,0|2,0,0]=4 1503 B10R1.15 CCC(S)c1ccccc1 Amb9208017 [0,1,1,0,0,0|0,1,0]=3 1504 B10R1.15 CCN(N)c1ccccc1 Amb836839 [0,1,1,0,0,0|2,0,0]=4 1505 B10R1.15 CCP(Cl)c1ccccc1 Amb27765906 [0,1,1,0,0,0|2,0,0]=4 1506 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [0,1,1,0,0,0|1,0,1]=4 1507 B10R1.15 CC[C@@H](Br)c1ccccc1 Amb27761826 [0,1,1,0,0,0|1,0,0]=3 1508 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [0,1,1,0,0,0|1,0,0]=3 1509 B10R1.15 CC[C@@H](N)c1ccccc1 Amb8383789 [0,1,1,0,0,0|1,0,0]=3 1510 B10R1.15 CC[C@@H](N)c1ccccn1 Amb25797820 [0,1,1,0,0,0|2,0,0]=4 1511 B10R1.15 CC[C@@H](N)c1ccccn1 Amb30869540 [0,1,1,0,0,0|2,0,0]=4 1512 B10R1.15 CC[C@@H](N)c1ccncc1 Amb30647447 [0,1,1,0,0,0|2,0,0]=4 1513 B10R1.15 CC[C@@H](O)c1ccccc1 Amb8517168 [0,1,1,0,0,0|0,0,0]=2 1514 B10R1.15 CC[C@@H](O)c1ccccn1 Amb25717055 [0,1,1,0,0,0|1,0,0]=3 1515 B10R1.15 CC[C@@H](O)c1cccnc1 Amb27161307 [0,1,1,0,0,0|1,0,0]=3 1516 B10R1.15 CC[C@@H](O)c1cncnc1 Amb27431312 [0,1,1,0,0,0|2,0,0]=4 1517 B10R1.15 CC[C@H](Br)c1ccccc1 Amb27659277 [0,1,1,0,0,0|1,0,0]=3 1518 B10R1.15 CC[C@H](C)c1ccccc1 Amb28326096 [0,1,1,0,0,0|1,0,0]=3 1519 B10R1.15 CC[C@H](C)c1ccccn1 Amb27407415 [0,1,1,0,0,0|2,0,0]=4 1520 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [0,1,1,0,0,0|1,0,0]=3 1521 B10R1.15 CC[C@H](N)c1ccccc1 Amb8628779 [0,1,1,0,0,0|1,0,0]=3 1522 B10R1.15 CC[C@H](N)c1ccccn1 Amb26961005 [0,1,1,0,0,0|2,0,0]=4 1523 B10R1.15 CC[C@H](N)c1ccccn1 Amb33802008 [0,1,1,0,0,0|2,0,0]=4 1524 B10R1.15 CC[C@H](N)c1ccccn1 Amb33872493 [0,1,1,0,0,0|2,0,0]=4 1525 B10R1.15 CC[C@H](N)c1cccnc1 Amb30647446 [0,1,1,0,0,0|2,0,0]=4 1526 B10R1.15 CC[C@H](N)c1ccncc1 Amb27404537 [0,1,1,0,0,0|2,0,0]=4 1527 B10R1.15 CC[C@H](N)c1ccncc1 Amb30647448 [0,1,1,0,0,0|2,0,0]=4 1528 B10R1.15 CC[C@H](O)c1ccccc1 Amb8517167 [0,1,1,0,0,0|0,0,0]=2 1529 B10R1.15 CC[C@H](O)c1ccccn1 Amb25910593 [0,1,1,0,0,0|1,0,0]=3 1530 B10R1.15 CC[C@H](O)c1cccnc1 Amb24432697 [0,1,1,0,0,0|1,0,0]=3 1531 B10R1.15 CC[C@H](O)c1ccncc1 Amb27861997 [0,1,1,0,0,0|1,0,0]=3 1532 B10R1.15 CN(C#N)c1ccccc1 Amb24658199 [0,1,1,0,0,0|2,0,0]=4 1533 B10R1.15 CN(C=O)c1ccccc1 Amb7969686 [0,1,1,0,0,0|1,0,1]=4 1534 B10R1.15 CN(N=O)c1ccccc1 Amb6308537 [0,1,1,0,0,0|1,0,1]=4 1535 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [0,1,1,0,0,0|1,0,1]=4 1536 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [0,1,1,0,0,0|1,0,1]=4 1537 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [0,1,1,0,0,0|0,0,2]=4 1538 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [0,1,1,0,0,0|0,1,1]=4 1539 B10R1.15 CNC(C)c1ccccc1 Amb6382953 [0,1,1,0,0,0|1,0,0]=3 1540 B10R1.15 CNC(C)c1ccccc1 Amb9745717 [0,1,1,0,0,0|1,0,0]=3 1541 B10R1.15 CNC(C)c1ccccn1 Amb10189608 [0,1,1,0,0,0|2,0,0]=4 1542 B10R1.15 CNC(C)c1ccccn1 Amb22587689 [0,1,1,0,0,0|2,0,0]=4 1543 B10R1.15 CNC(C)c1ccccn1 Amb9705005 [0,1,1,0,0,0|2,0,0]=4 1544 B10R1.15 CNC(C)c1cccnc1 Amb10189690 [0,1,1,0,0,0|2,0,0]=4 1545 B10R1.15 CNC(C)c1cccnc1 Amb1121577 [0,1,1,0,0,0|2,0,0]=4 1546 B10R1.15 CNC(C)c1cccnc1 Amb22587688 [0,1,1,0,0,0|2,0,0]=4 1547 B10R1.15 CNC(C)c1ccncc1 Amb10189609 [0,1,1,0,0,0|2,0,0]=4 1548 B10R1.15 CNC(C)c1ccncc1 Amb22492289 [0,1,1,0,0,0|2,0,0]=4 1549 B10R1.15 CNC(C)c1ccncc1 Amb22587687 [0,1,1,0,0,0|2,0,0]=4 1550 B10R1.15 CNC(C)c1ccncc1 Amb9705906 [0,1,1,0,0,0|2,0,0]=4 1551 B10R1.15 CNN(C)c1ccccc1 Amb27398128 [0,1,1,0,0,0|2,0,0]=4 1552 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [0,1,1,0,0,0|1,0,0]=3 1553 B10R1.15 CN[C@@H](C)c1ccccn1 Amb24744532 [0,1,1,0,0,0|2,0,0]=4 1554 B10R1.15 CN[C@@H](C)c1ccccn1 Amb33457847 [0,1,1,0,0,0|2,0,0]=4 1555 B10R1.15 CN[C@@H](C)c1cccnc1 Amb27162166 [0,1,1,0,0,0|2,0,0]=4 1556 B10R1.15 CN[C@@H](C)c1cccnc1 Amb33457822 [0,1,1,0,0,0|2,0,0]=4 1557 B10R1.15 CN[C@@H](C)c1ccncc1 Amb28193264 [0,1,1,0,0,0|2,0,0]=4 1558 B10R1.15 CN[C@@H](C)c1ccncc1 Amb33457902 [0,1,1,0,0,0|2,0,0]=4 1559 B10R1.15 CN[C@H](C)c1ccccc1 Amb10844610 [0,1,1,0,0,0|1,0,0]=3 1560 B10R1.15 CN[C@H](C)c1ccccn1 Amb27391593 [0,1,1,0,0,0|2,0,0]=4 1561 B10R1.15 CN[C@H](C)c1cccnc1 Amb25084519 [0,1,1,0,0,0|2,0,0]=4 1562 B10R1.15 CN[C@H](C)c1cccnc1 Amb33328981 [0,1,1,0,0,0|2,0,0]=4 1563 B10R1.15 COC(=N)c1ccccc1 Amb4009954 [0,1,1,0,0,0|1,0,1]=4 1564 B10R1.15 COC(=N)c1ccccc1 Amb6366188 [0,1,1,0,0,0|1,0,1]=4 1565 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [0,1,1,0,0,0|0,0,2]=4 1566 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [0,1,1,0,0,0|0,1,1]=4 1567 B10R1.15 COC(C)c1ccccc1 Amb23568513 [0,1,1,0,0,0|0,0,0]=2 1568 B10R1.15 CON(C)c1ccccn1 Amb27804447 [0,1,1,0,0,0|2,0,0]=4 1569 B10R1.15 COS(=O)c1ccccc1 Amb2689327 [0,1,1,0,0,0|1,0,1]=4 1570 B10R1.15 CP(CO)c1ccccc1 Amb27410449 [0,1,1,0,0,0|1,0,0]=3 1571 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [0,1,1,0,0,0|1,0,1]=4 1572 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [0,1,1,0,0,0|0,1,1]=4 1573 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [0,1,1,0,0,0|0,0,1]=3 1574 B10R1.15 C[C@@H](CN)c1ccccc1 Amb33623692 [0,1,1,0,0,0|1,0,0]=3 1575 B10R1.15 C[C@@H](CN)c1ccccc1 Amb4036825 [0,1,1,0,0,0|1,0,0]=3 1576 B10R1.15 C[C@@H](CN)c1cccnc1 Amb33744398 [0,1,1,0,0,0|2,0,0]=4 1577 B10R1.15 C[C@@H](CN)c1ccncc1 Amb33727423 [0,1,1,0,0,0|2,0,0]=4 1578 B10R1.15 C[C@@H](CO)c1ccccc1 Amb3939247 [0,1,1,0,0,0|0,0,0]=2 1579 B10R1.15 C[C@@H](CO)c1ccccn1 Amb28137345 [0,1,1,0,0,0|1,0,0]=3 1580 B10R1.15 C[C@@H](CO)c1cccnc1 Amb33746677 [0,1,1,0,0,0|1,0,0]=3 1581 B10R1.15 C[C@@H](CO)c1ccncc1 Amb33735556 [0,1,1,0,0,0|1,0,0]=3 1582 B10R1.15 C[C@@H](CO)c1cnccn1 Amb33748024 [0,1,1,0,0,0|2,0,0]=4 1583 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [0,1,1,0,0,0|1,0,0]=3 1584 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [0,1,1,0,0,0|0,0,0]=2 1585 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [0,1,1,0,0,0|0,0,0]=2 1586 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [0,1,1,0,0,0|0,0,0]=2 1587 B10R1.15 C[C@@H](ON)c1ccccc1 Amb32665789 [0,1,1,0,0,0|0,0,0]=2 1588 B10R1.15 C[C@@H](ON)c1ccccn1 Amb33483784 [0,1,1,0,0,0|1,0,0]=3 1589 B10R1.15 C[C@@H](ON)c1ccncc1 Amb33620851 [0,1,1,0,0,0|1,0,0]=3 1590 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [0,1,1,0,0,0|0,0,1]=3 1591 B10R1.15 C[C@H](CN)c1ccccc1 Amb10070369 [0,1,1,0,0,0|1,0,0]=3 1592 B10R1.15 C[C@H](CN)c1cccnc1 Amb33740278 [0,1,1,0,0,0|2,0,0]=4 1593 B10R1.15 C[C@H](CN)c1ccncc1 Amb33747422 [0,1,1,0,0,0|2,0,0]=4 1594 B10R1.15 C[C@H](CO)c1ccccc1 Amb3939248 [0,1,1,0,0,0|0,0,0]=2 1595 B10R1.15 C[C@H](CO)c1cccnc1 Amb33738165 [0,1,1,0,0,0|1,0,0]=3 1596 B10R1.15 C[C@H](CO)c1ccncc1 Amb33730462 [0,1,1,0,0,0|1,0,0]=3 1597 B10R1.15 C[C@H](CO)c1cnccn1 Amb33744967 [0,1,1,0,0,0|2,0,0]=4 1598 B10R1.15 C[C@H](NN)c1ccccc1 Amb26589811 [0,1,1,0,0,0|1,0,0]=3 1599 B10R1.15 C[C@H](NO)c1cccnc1 Amb27242936 [0,1,1,0,0,0|1,0,0]=3 1600 B10R1.15 C[C@H](ON)c1ccccc1 Amb32665788 [0,1,1,0,0,0|0,0,0]=2 1601 B10R1.15 C[C@H](ON)c1ccccc1 Amb32666539 [0,1,1,0,0,0|0,0,0]=2 1602 B10R1.15 C[C@H](ON)c1ccccn1 Amb33483778 [0,1,1,0,0,0|1,0,0]=3 1603 B10R1.15 C[C@H](ON)c1ccncc1 Amb33299308 [0,1,1,0,0,0|1,0,0]=3 1604 B10R1.15 C\C(=C/Br)c1ccccc1 Amb25066105 [0,1,1,0,0,0|1,0,1]=4 1605 B10R1.15 C\C(=C/Cl)c1ccccc1 Amb30621745 [0,1,1,0,0,0|1,0,1]=4 1606 B10R1.15 C\C(=C\Br)c1ccccc1 Amb4035454 [0,1,1,0,0,0|1,0,1]=4 1607 B10R1.15 C\C(=C\Cl)c1ccccc1 Amb26652006 [0,1,1,0,0,0|1,0,1]=4 1608 B10R1.15 C\C(=N/N)c1ccccc1 Amb4016930 [0,1,1,0,0,0|1,0,1]=4 1609 B10R1.15 C\C(=N/O)c1ccccc1 Amb2387477 [0,1,1,0,0,0|0,0,1]=3 1610 B10R1.15 C\C(=N/O)c1ccccn1 Amb2780070 [0,1,1,0,0,0|1,0,1]=4 1611 B10R1.15 C\C(=N/O)c1cccnc1 Amb598353 [0,1,1,0,0,0|1,0,1]=4 1612 B10R1.15 C\C(=N/O)c1ccncc1 Amb6336368 [0,1,1,0,0,0|1,0,1]=4 1613 B10R1.15 C\C(=N\O)c1ccccc1 Amb3428046 [0,1,1,0,0,0|0,0,1]=3 1614 B10R1.15 C\C(=N\O)c1ccccn1 Amb598336 [0,1,1,0,0,0|1,0,1]=4 1615 B10R1.15 C\C(=N\O)c1cccnc1 Amb10606945 [0,1,1,0,0,0|1,0,1]=4 1616 B10R1.15 C\C(=N\O)c1ccncc1 Amb2780071 [0,1,1,0,0,0|1,0,1]=4 1617 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [0,1,1,0,0,0|1,0,1]=4 1618 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [0,1,1,0,0,0|1,0,1]=4 1619 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [0,1,1,0,0,0|1,0,1]=4 1620 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [0,1,1,0,0,0|1,0,1]=4 1621 B10R1.15 ClCC(Cl)c1ccccc1 Amb2720893 [0,1,1,0,0,0|1,0,0]=3 1622 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [0,1,1,0,0,0|1,0,0]=3 1623 B10R1.15 FC(CCl)c1ccccc1 Amb27596575 [0,1,1,0,0,0|1,0,0]=3 1624 B10R1.15 N#CC(Br)c1ccccc1 Amb9787616 [0,1,1,0,0,0|1,0,1]=4 1625 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [0,1,1,0,0,0|1,0,1]=4 1626 B10R1.15 N#CC(N)c1ccccc1 Amb3940545 [0,1,1,0,0,0|1,0,1]=4 1627 B10R1.15 N#CC(O)c1ccccc1 Amb3997186 [0,1,1,0,0,0|0,0,1]=3 1628 B10R1.15 N#CC(O)c1ccccn1 Amb27832045 [0,1,1,0,0,0|1,0,1]=4 1629 B10R1.15 N#CC([NH3+])c1ccccc1 Amb6365971 [0,1,1,0,0,0|1,0,1]=4 1630 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [0,1,1,0,0,0|1,0,1]=4 1631 B10R1.15 N#C[C@@H](N)c1ccccc1 Amb17399826 [0,1,1,0,0,0|1,0,1]=4 1632 B10R1.15 N#C[C@@H](O)c1ccccn1 Amb27980078 [0,1,1,0,0,0|1,0,1]=4 1633 B10R1.15 N#C[C@H](Cl)c1ccccc1 Amb27184041 [0,1,1,0,0,0|1,0,1]=4 1634 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [0,1,1,0,0,0|0,0,1]=3 1635 B10R1.15 N#C[C@H](O)c1cccnc1 Amb25837398 [0,1,1,0,0,0|1,0,1]=4 1636 B10R1.15 NC(C=O)c1ccccc1 Amb27490826 [0,1,1,0,0,0|1,0,1]=4 1637 B10R1.15 NC(CCl)c1ccccc1 Amb27602197 [0,1,1,0,0,0|1,0,0]=3 1638 B10R1.15 NC(CF)c1ccccc1 Amb2372575 [0,1,1,0,0,0|1,0,0]=3 1639 B10R1.15 NC(CF)c1ccccc1 Amb33362248 [0,1,1,0,0,0|1,0,0]=3 1640 B10R1.15 NC(CF)c1cccnc1 Amb27251300 [0,1,1,0,0,0|2,0,0]=4 1641 B10R1.15 NC(CO)c1ccccc1 Amb8513829 [0,1,1,0,0,0|1,0,0]=3 1642 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [0,1,1,0,0,0|2,0,0]=4 1643 B10R1.15 NC(CO)c1ccccn1 Amb18560041 [0,1,1,0,0,0|2,0,0]=4 1644 B10R1.15 NC(CO)c1cccnc1 Amb2683353 [0,1,1,0,0,0|2,0,0]=4 1645 B10R1.15 NC(CO)c1cccnc1 Amb32644753 [0,1,1,0,0,0|2,0,0]=4 1646 B10R1.15 NC(CO)c1cccnc1 Amb33548117 [0,1,1,0,0,0|2,0,0]=4 1647 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [0,1,1,0,0,0|2,0,0]=4 1648 B10R1.15 NC(CO)c1ccncc1 Amb18561776 [0,1,1,0,0,0|2,0,0]=4 1649 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [0,1,1,0,0,0|0,0,2]=4 1650 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [0,1,1,0,0,0|0,0,2]=4 1651 B10R1.15 NCC(Cl)c1ccccc1 Amb27984951 [0,1,1,0,0,0|1,0,0]=3 1652 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [0,1,1,0,0,0|1,0,0]=3 1653 B10R1.15 NCC(F)c1ccccc1 Amb33249671 [0,1,1,0,0,0|1,0,0]=3 1654 B10R1.15 NCC(F)c1ccccn1 Amb24473175 [0,1,1,0,0,0|2,0,0]=4 1655 B10R1.15 NCC(F)c1cccnc1 Amb27405475 [0,1,1,0,0,0|2,0,0]=4 1656 B10R1.15 NCC(F)c1ccncc1 Amb27653637 [0,1,1,0,0,0|2,0,0]=4 1657 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [0,1,1,0,0,0|1,0,0]=3 1658 B10R1.15 NCC(N)c1ccccc1 Amb33473621 [0,1,1,0,0,0|1,0,0]=3 1659 B10R1.15 NCC(N)c1ccccc1 Amb9380661 [0,1,1,0,0,0|1,0,0]=3 1660 B10R1.15 NCC(N)c1ccncc1 Amb18063802 [0,1,1,0,0,0|2,0,0]=4 1661 B10R1.15 NCC(O)c1ccccc1 Amb33542602 [0,1,1,0,0,0|0,0,0]=2 1662 B10R1.15 NCC(O)c1ccccc1 Amb33544420 [0,1,1,0,0,0|0,0,0]=2 1663 B10R1.15 NCC(O)c1ccccn1 Amb1109027 [0,1,1,0,0,0|1,0,0]=3 1664 B10R1.15 NCC(O)c1ccccn1 Amb20622942 [0,1,1,0,0,0|1,0,0]=3 1665 B10R1.15 NCC(O)c1ccccn1 Amb6892508 [0,1,1,0,0,0|1,0,0]=3 1666 B10R1.15 NCC(O)c1cccnc1 Amb10068830 [0,1,1,0,0,0|1,0,0]=3 1667 B10R1.15 NCC(O)c1cccnc1 Amb8503375 [0,1,1,0,0,0|1,0,0]=3 1668 B10R1.15 NCC(O)c1cccnc1 Amb9703829 [0,1,1,0,0,0|1,0,0]=3 1669 B10R1.15 NCC(O)c1ccncc1 Amb22755845 [0,1,1,0,0,0|1,0,0]=3 1670 B10R1.15 NCC(O)c1ccncc1 Amb9703695 [0,1,1,0,0,0|1,0,0]=3 1671 B10R1.15 NCC(O)c1ccncn1 Amb24434504 [0,1,1,0,0,0|2,0,0]=4 1672 B10R1.15 NCC(O)c1cnccn1 Amb27230477 [0,1,1,0,0,0|2,0,0]=4 1673 B10R1.15 NCC(O)c1cncnc1 Amb25731161 [0,1,1,0,0,0|2,0,0]=4 1674 B10R1.15 NCC(O)c1ncccn1 Amb26039872 [0,1,1,0,0,0|2,0,0]=4 1675 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [0,1,1,0,0,0|1,0,0]=3 1676 B10R1.15 NC[C@@H](F)c1ccccc1 Amb32661014 [0,1,1,0,0,0|1,0,0]=3 1677 B10R1.15 NC[C@@H](N)c1cccnc1 Amb28046917 [0,1,1,0,0,0|2,0,0]=4 1678 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [0,1,1,0,0,0|0,0,0]=2 1679 B10R1.15 NC[C@@H](O)c1ccccc1 Amb8630286 [0,1,1,0,0,0|0,0,0]=2 1680 B10R1.15 NC[C@@H](O)c1ccccn1 Amb25052826 [0,1,1,0,0,0|1,0,0]=3 1681 B10R1.15 NC[C@@H](O)c1cccnc1 Amb22744742 [0,1,1,0,0,0|1,0,0]=3 1682 B10R1.15 NC[C@@H](O)c1cccnc1 Amb22748405 [0,1,1,0,0,0|1,0,0]=3 1683 B10R1.15 NC[C@@H](O)c1ccncc1 Amb24479579 [0,1,1,0,0,0|1,0,0]=3 1684 B10R1.15 NC[C@@H](O)c1ccncn1 Amb24546069 [0,1,1,0,0,0|2,0,0]=4 1685 B10R1.15 NC[C@@H](O)c1cnccn1 Amb25370172 [0,1,1,0,0,0|2,0,0]=4 1686 B10R1.15 NC[C@@H](O)c1cncnc1 Amb33149206 [0,1,1,0,0,0|2,0,0]=4 1687 B10R1.15 NC[C@@H](O)c1ncccn1 Amb33270410 [0,1,1,0,0,0|2,0,0]=4 1688 B10R1.15 NC[C@H](N)c1ccncc1 Amb27617070 [0,1,1,0,0,0|2,0,0]=4 1689 B10R1.15 NC[C@H](O)c1ccccc1 Amb10070626 [0,1,1,0,0,0|0,0,0]=2 1690 B10R1.15 NC[C@H](O)c1ccccc1 Amb8631408 [0,1,1,0,0,0|0,0,0]=2 1691 B10R1.15 NC[C@H](O)c1ccccn1 Amb24569794 [0,1,1,0,0,0|1,0,0]=3 1692 B10R1.15 NC[C@H](O)c1cccnc1 Amb23385336 [0,1,1,0,0,0|1,0,0]=3 1693 B10R1.15 NC[C@H](O)c1cccnc1 Amb25127978 [0,1,1,0,0,0|1,0,0]=3 1694 B10R1.15 NC[C@H](O)c1ccncc1 Amb27227500 [0,1,1,0,0,0|1,0,0]=3 1695 B10R1.15 NC[C@H](O)c1ccncn1 Amb25917456 [0,1,1,0,0,0|2,0,0]=4 1696 B10R1.15 NC[C@H](O)c1cnccn1 Amb26496616 [0,1,1,0,0,0|2,0,0]=4 1697 B10R1.15 NC[C@H](O)c1cncnc1 Amb33149202 [0,1,1,0,0,0|2,0,0]=4 1698 B10R1.15 NC[C@H](O)c1ncccn1 Amb33225262 [0,1,1,0,0,0|2,0,0]=4 1699 B10R1.15 NC[PH](=O)c1ccccc1 Amb28119772 [0,1,1,0,0,0|1,0,1]=4 1700 B10R1.15 N[C@@H](CBr)c1ccccc1 Amb27876239 [0,1,1,0,0,0|1,0,0]=3 1701 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [0,1,1,0,0,0|1,0,0]=3 1702 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [0,1,1,0,0,0|1,0,0]=3 1703 B10R1.15 N[C@@H](CF)c1cccnc1 Amb27237037 [0,1,1,0,0,0|2,0,0]=4 1704 B10R1.15 N[C@@H](CO)c1ccccc1 Amb3939344 [0,1,1,0,0,0|1,0,0]=3 1705 B10R1.15 N[C@@H](CO)c1ccccn1 Amb28346863 [0,1,1,0,0,0|2,0,0]=4 1706 B10R1.15 N[C@@H](CO)c1ccccn1 Amb33483256 [0,1,1,0,0,0|2,0,0]=4 1707 B10R1.15 N[C@@H](CO)c1cccnc1 Amb25146409 [0,1,1,0,0,0|2,0,0]=4 1708 B10R1.15 N[C@@H](CO)c1ccncc1 Amb25146410 [0,1,1,0,0,0|2,0,0]=4 1709 B10R1.15 N[C@H](CCl)c1ccccc1 Amb27214165 [0,1,1,0,0,0|1,0,0]=3 1710 B10R1.15 N[C@H](CF)c1ccccc1 Amb27768745 [0,1,1,0,0,0|1,0,0]=3 1711 B10R1.15 N[C@H](CF)c1ccccc1 Amb33482690 [0,1,1,0,0,0|1,0,0]=3 1712 B10R1.15 N[C@H](CO)c1ccccc1 Amb2720557 [0,1,1,0,0,0|1,0,0]=3 1713 B10R1.15 N[C@H](CO)c1ccccn1 Amb27617071 [0,1,1,0,0,0|2,0,0]=4 1714 B10R1.15 N[C@H](CO)c1ccccn1 Amb33483257 [0,1,1,0,0,0|2,0,0]=4 1715 B10R1.15 N[C@H](CO)c1cccnc1 Amb24712243 [0,1,1,0,0,0|2,0,0]=4 1716 B10R1.15 N[C@H](CO)c1ccncc1 Amb24714739 [0,1,1,0,0,0|2,0,0]=4 1717 B10R1.15 N\C(=N/O)c1ccccc1 Amb1149046 [0,1,1,0,0,0|1,0,1]=4 1718 B10R1.15 N\C(=N/O)c1ccccc1 Amb6298734 [0,1,1,0,0,0|1,0,1]=4 1719 B10R1.15 N\C(=N\O)c1ccccc1 Amb2226909 [0,1,1,0,0,0|1,0,1]=4 1720 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [0,1,1,0,0,0|0,0,2]=4 1721 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [0,1,1,0,0,0|0,0,2]=4 1722 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [0,1,1,0,0,0|0,0,2]=4 1723 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [0,1,1,0,0,0|0,0,2]=4 1724 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [0,1,1,0,0,0|0,0,2]=4 1725 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [0,1,1,0,0,0|0,0,2]=4 1726 B10R1.15 O=C(NO)c1ccccc1 Amb1645521 [0,1,1,0,0,0|1,0,1]=4 1727 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [0,1,1,0,0,0|1,0,1]=4 1728 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [0,1,1,0,0,0|1,0,1]=4 1729 B10R1.15 O=CC(O)c1ccccc1 Amb17593446 [0,1,1,0,0,0|0,0,1]=3 1730 B10R1.15 O=CC(O)c1ccccn1 Amb28321322 [0,1,1,0,0,0|1,0,1]=4 1731 B10R1.15 O=C[C@H](F)c1ccccc1 Amb27863823 [0,1,1,0,0,0|1,0,1]=4 1732 B10R1.15 O=C[C@H](O)c1ccccc1 Amb28388660 [0,1,1,0,0,0|0,0,1]=3 1733 B10R1.15 O=NN(O)c1ccccc1 Amb17666641 [0,1,1,0,0,0|2,0,0]=4 1734 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [0,1,1,0,0,0|1,0,1]=4 1735 B10R1.15 O=S(CO)c1ccccc1 Amb27617047 [0,1,1,0,0,0|1,0,1]=4 1736 B10R1.15 O=S(O[Na])c1ccccc1 Amb6365754 [0,1,1,0,0,0|2,0,0]=4 1737 B10R1.15 OC(CBr)c1ccccc1 Amb17206105 [0,1,1,0,0,0|0,0,0]=2 1738 B10R1.15 OC(CBr)c1ccccn1 Amb27623201 [0,1,1,0,0,0|1,0,0]=3 1739 B10R1.15 OC(CBr)c1ccncc1 Amb24099591 [0,1,1,0,0,0|1,0,0]=3 1740 B10R1.15 OC(CBr)c1ccncn1 Amb25933834 [0,1,1,0,0,0|2,0,0]=4 1741 B10R1.15 OC(CBr)c1cnccn1 Amb26318929 [0,1,1,0,0,0|2,0,0]=4 1742 B10R1.15 OC(CBr)c1cncnc1 Amb33005796 [0,1,1,0,0,0|2,0,0]=4 1743 B10R1.15 OC(CBr)c1ncccn1 Amb33007406 [0,1,1,0,0,0|2,0,0]=4 1744 B10R1.15 OC(CCl)c1ccccc1 Amb9826903 [0,1,1,0,0,0|0,0,0]=2 1745 B10R1.15 OC(CCl)c1ccccn1 Amb26455692 [0,1,1,0,0,0|1,0,0]=3 1746 B10R1.15 OC(CCl)c1cccnc1 Amb3319284 [0,1,1,0,0,0|1,0,0]=3 1747 B10R1.15 OC(CCl)c1ccncc1 Amb27470348 [0,1,1,0,0,0|1,0,0]=3 1748 B10R1.15 OC(CCl)c1ccncn1 Amb24649222 [0,1,1,0,0,0|2,0,0]=4 1749 B10R1.15 OC(CCl)c1cnccn1 Amb24636632 [0,1,1,0,0,0|2,0,0]=4 1750 B10R1.15 OC(CCl)c1cncnc1 Amb33222341 [0,1,1,0,0,0|2,0,0]=4 1751 B10R1.15 OC(CCl)c1ncccn1 Amb27248217 [0,1,1,0,0,0|2,0,0]=4 1752 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [0,1,1,0,0,0|0,0,0]=2 1753 B10R1.15 OC(CF)c1ccccn1 Amb25136249 [0,1,1,0,0,0|1,0,0]=3 1754 B10R1.15 OC(CF)c1cccnc1 Amb33360057 [0,1,1,0,0,0|1,0,0]=3 1755 B10R1.15 OC(CF)c1ccncc1 Amb33380647 [0,1,1,0,0,0|1,0,0]=3 1756 B10R1.15 OC(CF)c1ccncn1 Amb33268586 [0,1,1,0,0,0|2,0,0]=4 1757 B10R1.15 OC(CF)c1cnccn1 Amb33429681 [0,1,1,0,0,0|2,0,0]=4 1758 B10R1.15 OC(CF)c1cncnc1 Amb33149170 [0,1,1,0,0,0|2,0,0]=4 1759 B10R1.15 OC(CF)c1ncccn1 Amb33270385 [0,1,1,0,0,0|2,0,0]=4 1760 B10R1.15 OC(CI)c1ccccc1 Amb28073875 [0,1,1,0,0,0|0,0,0]=2 1761 B10R1.15 OC(CS)c1ccccc1 Amb10608997 [0,1,1,0,0,0|0,0,0]=2 1762 B10R1.15 OCC(Br)c1ccccc1 Amb27971765 [0,1,1,0,0,0|1,0,0]=3 1763 B10R1.15 OCC(Cl)c1ccccc1 Amb27165767 [0,1,1,0,0,0|1,0,0]=3 1764 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [0,1,1,0,0,0|1,0,0]=3 1765 B10R1.15 OCC(F)c1ccncc1 Amb28384557 [0,1,1,0,0,0|2,0,0]=4 1766 B10R1.15 OCC(O)c1ccccc1 Amb4350706 [0,1,1,0,0,0|0,0,0]=2 1767 B10R1.15 OCC(O)c1ccccn1 Amb4017599 [0,1,1,0,0,0|1,0,0]=3 1768 B10R1.15 OCC(O)c1cccnc1 Amb23538717 [0,1,1,0,0,0|1,0,0]=3 1769 B10R1.15 OCC(O)c1ccncc1 Amb23538718 [0,1,1,0,0,0|1,0,0]=3 1770 B10R1.15 OCC(O)c1ccncc1 Amb32656243 [0,1,1,0,0,0|1,0,0]=3 1771 B10R1.15 OCC(O)c1ccncn1 Amb33268587 [0,1,1,0,0,0|2,0,0]=4 1772 B10R1.15 OCC(O)c1cnccn1 Amb28079089 [0,1,1,0,0,0|2,0,0]=4 1773 B10R1.15 OCC(O)c1cncnc1 Amb28320860 [0,1,1,0,0,0|2,0,0]=4 1774 B10R1.15 OCC(O)c1ncccn1 Amb33270386 [0,1,1,0,0,0|2,0,0]=4 1775 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [0,1,1,0,0,0|0,1,0]=3 1776 B10R1.15 OC[C@@H](O)c1ccccc1 Amb8514912 [0,1,1,0,0,0|0,0,0]=2 1777 B10R1.15 OC[C@@H](O)c1ccccn1 Amb26554033 [0,1,1,0,0,0|1,0,0]=3 1778 B10R1.15 OC[C@@H](O)c1cccnn1 Amb27839321 [0,1,1,0,0,0|2,0,0]=4 1779 B10R1.15 OC[C@@H](O)c1ccncc1 Amb28291407 [0,1,1,0,0,0|1,0,0]=3 1780 B10R1.15 OC[C@H](Br)c1ccccc1 Amb27798351 [0,1,1,0,0,0|1,0,0]=3 1781 B10R1.15 OC[C@H](Cl)c1ccccc1 Amb27659257 [0,1,1,0,0,0|1,0,0]=3 1782 B10R1.15 OC[C@H](O)c1ccccc1 Amb8389336 [0,1,1,0,0,0|0,0,0]=2 1783 B10R1.15 OC[C@H](O)c1ccccn1 Amb27838863 [0,1,1,0,0,0|1,0,0]=3 1784 B10R1.15 OC[C@H](S)c1ccccc1 Amb28207325 [0,1,1,0,0,0|0,1,0]=3 1785 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [0,1,1,0,0,0|0,0,0]=2 1786 B10R1.15 O[C@@H](CBr)c1cccnc1 Amb27614899 [0,1,1,0,0,0|1,0,0]=3 1787 B10R1.15 O[C@@H](CCl)c1ccccc1 Amb16231709 [0,1,1,0,0,0|0,0,0]=2 1788 B10R1.15 O[C@@H](CCl)c1ccccn1 Amb28122883 [0,1,1,0,0,0|1,0,0]=3 1789 B10R1.15 O[C@@H](CCl)c1cnccn1 Amb27250626 [0,1,1,0,0,0|2,0,0]=4 1790 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [0,1,1,0,0,0|0,0,0]=2 1791 B10R1.15 O[C@@H](CF)c1ccccn1 Amb27839237 [0,1,1,0,0,0|1,0,0]=3 1792 B10R1.15 O[C@@H](CS)c1ccccc1 Amb27604413 [0,1,1,0,0,0|0,0,0]=2 1793 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [0,1,1,0,0,0|0,0,0]=2 1794 B10R1.15 O[C@H](CBr)c1ccncn1 Amb27244296 [0,1,1,0,0,0|2,0,0]=4 1795 B10R1.15 O[C@H](CCl)c1ccccc1 Amb8394082 [0,1,1,0,0,0|0,0,0]=2 1796 B10R1.15 O[C@H](CCl)c1ccncc1 Amb27973641 [0,1,1,0,0,0|1,0,0]=3 1797 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [0,1,1,0,0,0|0,0,0]=2 1798 B10R1.15 O[C@H](CF)c1ccccn1 Amb27979963 [0,1,1,0,0,0|1,0,0]=3 1799 B10R1.15 O[C@H](CS)c1ccccc1 Amb27494941 [0,1,1,0,0,0|0,0,0]=2 1800 B10R1.15 O\N=C(/Cl)c1ccccc1 Amb32411906 [0,1,1,0,0,0|1,0,1]=4 1801 B10R1.15 O\N=C(\Cl)c1ccccc1 Amb2684308 [0,1,1,0,0,0|1,0,1]=4 1802 B10R1.15 O\N=C(\O)c1ccccc1 Amb17843421 [0,1,1,0,0,0|1,0,1]=4 1803 B10R1.15 S=C(CBr)c1ccccc1 Amb27755078 [0,1,1,0,0,0|0,1,1]=4 1804 B10R1.15 [C-]#[N+]C(C)c1ccccc1 Amb2688979 [0,1,1,0,0,0|1,0,0]=3 1805 B10R1.15 [C-]#[N+]C(C)c1cccnc1 Amb3973252 [0,1,1,0,0,0|2,0,0]=4 1806 B10R1.15 [C-]#[N+]C(C)c1ccncc1 Amb2235825 [0,1,1,0,0,0|2,0,0]=4 1807 B10R1.15 [C-]#[N+][C@@H](C)c1ccccc1 Amb2684311 [0,1,1,0,0,0|1,0,0]=3 1808 B10R1.15 [C-]#[N+][C@H](C)c1ccccc1 Amb2684310 [0,1,1,0,0,0|1,0,0]=3 1809 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [0,1,1,0,0,0|0,0,2]=4 1810 B10R1.28 BrC(Br)(Br)c1ccccc1 Amb26339054 [0,1,1,0,0,0|2,0,0]=4 1811 B10R1.28 CC(C)(Br)c1ccccc1 Amb33088896 [0,1,1,0,0,0|1,0,0]=3 1812 B10R1.28 CC(C)(C)c1ccccc1 Amb2793061 [0,1,1,0,0,0|1,0,0]=3 1813 B10R1.28 CC(C)(C)c1ccccn1 Amb4018602 [0,1,1,0,0,0|2,0,0]=4 1814 B10R1.28 CC(C)(C)c1cccnc1 Amb8439100 [0,1,1,0,0,0|2,0,0]=4 1815 B10R1.28 CC(C)(C)c1ccncc1 Amb2694186 [0,1,1,0,0,0|2,0,0]=4 1816 B10R1.28 CC(C)(Cl)c1ccccc1 Amb8394818 [0,1,1,0,0,0|1,0,0]=3 1817 B10R1.28 CC(C)(F)c1ccccc1 Amb28368842 [0,1,1,0,0,0|1,0,0]=3 1818 B10R1.28 CC(C)(N)c1ccccc1 Amb2686562 [0,1,1,0,0,0|1,0,0]=3 1819 B10R1.28 CC(C)(N)c1ccccn1 Amb30588532 [0,1,1,0,0,0|2,0,0]=4 1820 B10R1.28 CC(C)(N)c1ccccn1 Amb33876394 [0,1,1,0,0,0|2,0,0]=4 1821 B10R1.28 CC(C)(N)c1ccccn1 Amb8011541 [0,1,1,0,0,0|2,0,0]=4 1822 B10R1.28 CC(C)(N)c1cccnc1 Amb16191921 [0,1,1,0,0,0|2,0,0]=4 1823 B10R1.28 CC(C)(N)c1ccncc1 Amb33543742 [0,1,1,0,0,0|2,0,0]=4 1824 B10R1.28 CC(C)(O)c1ccccc1 Amb8384227 [0,1,1,0,0,0|0,0,0]=2 1825 B10R1.28 CC(C)(O)c1ccccn1 Amb2780353 [0,1,1,0,0,0|1,0,0]=3 1826 B10R1.28 CC(C)(O)c1cccnc1 Amb8439236 [0,1,1,0,0,0|1,0,0]=3 1827 B10R1.28 CC(C)(O)c1ccncc1 Amb4018522 [0,1,1,0,0,0|1,0,0]=3 1828 B10R1.28 CC(C)(O)c1ccncn1 Amb26564033 [0,1,1,0,0,0|2,0,0]=4 1829 B10R1.28 CC(C)(O)c1cnccn1 Amb24735350 [0,1,1,0,0,0|2,0,0]=4 1830 B10R1.28 CC(C)(O)c1ncccn1 Amb27448111 [0,1,1,0,0,0|2,0,0]=4 1831 B10R1.28 CC(C)(S)c1ccccc1 Amb8387509 [0,1,1,0,0,0|0,1,0]=3 1832 B10R1.28 CC(F)(F)c1ccccc1 Amb19944228 [0,1,1,0,0,0|1,0,0]=3 1833 B10R1.28 CC(F)(F)c1cccnc1 Amb10607183 [0,1,1,0,0,0|2,0,0]=4 1834 B10R1.28 CC(F)(F)c1ccncc1 Amb10607182 [0,1,1,0,0,0|2,0,0]=4 1835 B10R1.28 CC(N)(O)c1ccccc1 Amb27876486 [0,1,1,0,0,0|0,0,0]=2 1836 B10R1.28 CP(=O)(Cl)c1ccccc1 Amb6365730 [0,1,1,0,0,0|1,0,1]=4 1837 B10R1.28 CP(=O)(O)c1ccccc1 Amb22052646 [0,1,1,0,0,0|1,0,0]=3 1838 B10R1.28 CP(C)(=O)c1ccccc1 Amb19925666 [0,1,1,0,0,0|1,0,1]=4 1839 B10R1.28 CS(=N)(=O)c1ccccc1 Amb17768294 [0,1,1,0,0,0|1,0,1]=4 1840 B10R1.28 CS(=O)(=O)c1ccccc1 Amb2419479 [0,1,1,0,0,0|1,0,1]=4 1841 B10R1.28 C[C@@](N)(O)c1ccccc1 Amb28123401 [0,1,1,0,0,0|0,0,0]=2 1842 B10R1.28 C[N+](C)(C)c1ccccc1 Amb22436823 [0,1,1,0,0,0|2,0,0]=4 1843 B10R1.28 C[N+](C)(C)c1ccccc1 Amb2613655 [0,1,1,0,0,0|2,0,0]=4 1844 B10R1.28 C[N+](C)(C)c1ccccc1 Amb6366825 [0,1,1,0,0,0|2,0,0]=4 1845 B10R1.28 C[N+](C)(C)c1ccccc1 Amb8513549 [0,1,1,0,0,0|2,0,0]=4 1846 B10R1.28 C[N+](C)(C)c1ccccc1 Amb8513572 [0,1,1,0,0,0|2,0,0]=4 1847 B10R1.28 C[N+](C)(C)c1ccccc1 Amb8513876 [0,1,1,0,0,0|2,0,0]=4 1848 B10R1.28 C[P+](C)(C)c1ccccc1 Amb2778997 [0,1,1,0,0,0|2,0,0]=4 1849 B10R1.28 C[S@@](=N)(=O)c1ccccc1 Amb9814233 [0,1,1,0,0,0|1,0,1]=4 1850 B10R1.28 C[S@](=N)(=O)c1ccccc1 Amb17617583 [0,1,1,0,0,0|1,0,1]=4 1851 B10R1.28 C[Si](C)(C)c1ccccc1 Amb8513864 [0,1,1,0,0,0|1,1,0]=4 1852 B10R1.28 C[Si](C)(Cl)c1ccccc1 Amb2690279 [0,1,1,0,0,0|1,1,0]=4 1853 B10R1.28 C[Si](C)(F)c1ccccc1 Amb2687577 [0,1,1,0,0,0|1,1,0]=4 1854 B10R1.28 C[Si](C)(O)c1ccccc1 Amb8517539 [0,1,1,0,0,0|0,1,0]=3 1855 B10R1.28 ClC(Cl)(Cl)c1ccccc1 Amb6608796 [0,1,1,0,0,0|2,0,0]=4 1856 B10R1.28 FC(Br)(Br)c1ccccc1 Amb32656202 [0,1,1,0,0,0|2,0,0]=4 1857 B10R1.28 FC(Cl)(Cl)c1ccccc1 Amb10838341 [0,1,1,0,0,0|2,0,0]=4 1858 B10R1.28 FC(F)(Br)c1ccccc1 Amb27665265 [0,1,1,0,0,0|2,0,0]=4 1859 B10R1.28 FC(F)(Cl)c1ccccc1 Amb10606273 [0,1,1,0,0,0|2,0,0]=4 1860 B10R1.28 FC(F)(F)c1ccccc1 Amb2684596 [0,1,1,0,0,0|2,0,0]=4 1861 B10R1.28 O=B(O)(O)c1ccccc1 Amb27770533 [0,1,1,0,0,0|2,0,0]=4 1862 B10R1.28 O=P(O)(F)c1ccccc1 Amb27881883 [0,1,1,0,0,0|2,0,0]=4 1863 B10R1.28 O=S(=O)(O)c1ccccc1 Amb22350405 [0,1,1,0,0,0|2,0,0]=4 1864 B10R1.28 O=S(=O)(O)c1ccccc1 Amb22406404 [0,1,1,0,0,0|2,0,0]=4 1865 B10R1.28 O=S(=O)(O)c1ccccc1 Amb8513545 [0,1,1,0,0,0|2,0,0]=4 1866 B10R1.28 O=[As](O)(O)c1ccccc1 Amb8514665 [0,1,1,0,0,0|2,0,0]=4 1867 B10R1.61 C=C(C)c1ccccc1Br Amb25797043 [0,1,1,0,0,0|1,0,1]=4 1868 B10R1.61 C=C(C)c1ccccc1C Amb22043466 [0,1,1,0,0,0|1,0,1]=4 1869 B10R1.61 C=C(C)c1ccccc1Cl Amb24720539 [0,1,1,0,0,0|1,0,1]=4 1870 B10R1.61 C=C(C)c1ccccc1F Amb27838932 [0,1,1,0,0,0|1,0,1]=4 1871 B10R1.61 C=C(C)c1ccccc1N Amb3940451 [0,1,1,0,0,0|1,0,1]=4 1872 B10R1.61 C=C(C)c1ccccc1O Amb18124426 [0,1,1,0,0,0|1,0,1]=4 1873 B10R1.61 CC(=O)c1ccccc1Br Amb1232838 [0,1,1,0,0,0|0,0,2]=4 1874 B10R1.61 CC(=O)c1ccccc1C Amb2792441 [0,1,1,0,0,0|0,0,2]=4 1875 B10R1.61 CC(=O)c1ccccc1Cl Amb2685746 [0,1,1,0,0,0|0,0,2]=4 1876 B10R1.61 CC(=O)c1ccccc1F Amb2688005 [0,1,1,0,0,0|0,0,2]=4 1877 B10R1.61 CC(=O)c1ccccc1I Amb8517635 [0,1,1,0,0,0|0,0,2]=4 1878 B10R1.61 CC(=O)c1ccccc1N Amb2725478 [0,1,1,0,0,0|0,0,2]=4 1879 B10R1.61 CC(=O)c1ccccc1N Amb6296708 [0,1,1,0,0,0|0,0,2]=4 1880 B10R1.61 CC(=O)c1ccccc1O Amb2792764 [0,1,1,0,0,0|0,0,2]=4 1881 B10R1.61 CC(=O)c1ccccc1S Amb22396354 [0,1,1,0,0,0|0,0,2]=4 1882 B10R1.61 CC(=S)c1ccccc1I Amb28315750 [0,1,1,0,0,0|0,1,1]=4 1883 B10R1.61 CC(Br)c1ccccc1Br Amb8835392 [0,1,1,0,0,0|1,0,0]=3 1884 B10R1.61 CC(Br)c1ccccc1Cl Amb8835422 [0,1,1,0,0,0|1,0,0]=3 1885 B10R1.61 CC(Br)c1ccccc1F Amb8835397 [0,1,1,0,0,0|1,0,0]=3 1886 B10R1.61 CC(Br)c1cccnc1Br Amb25236461 [0,1,1,0,0,0|2,0,0]=4 1887 B10R1.61 CC(Br)c1cccnc1Cl Amb23556785 [0,1,1,0,0,0|2,0,0]=4 1888 B10R1.61 CC(Br)c1cccnc1N Amb32659264 [0,1,1,0,0,0|2,0,0]=4 1889 B10R1.61 CC(Br)c1ncccc1F Amb23412454 [0,1,1,0,0,0|2,0,0]=4 1890 B10R1.61 CC(C)N1C=CC=CC1=S Amb24372900 [0,1,1,0,0,0|2,0,0]=4 1891 B10R1.61 CC(C)c1ccccc1Br Amb2608604 [0,1,1,0,0,0|1,0,0]=3 1892 B10R1.61 CC(C)c1ccccc1Cl Amb26591078 [0,1,1,0,0,0|1,0,0]=3 1893 B10R1.61 CC(C)c1ccccc1F Amb17940016 [0,1,1,0,0,0|1,0,0]=3 1894 B10R1.61 CC(C)c1ccccc1I Amb2688849 [0,1,1,0,0,0|1,0,0]=3 1895 B10R1.61 CC(C)c1ccccc1N Amb2725439 [0,1,1,0,0,0|1,0,0]=3 1896 B10R1.61 CC(C)c1ccccc1O Amb3939541 [0,1,1,0,0,0|1,0,0]=3 1897 B10R1.61 CC(C)c1ccccc1S Amb2689036 [0,1,1,0,0,0|1,0,0]=3 1898 B10R1.61 CC(C)c1ccccc1[Mg+] Amb30590850 [0,1,1,0,0,0|1,0,0]=3 1899 B10R1.61 CC(C)c1cccnc1Br Amb24319274 [0,1,1,0,0,0|2,0,0]=4 1900 B10R1.61 CC(C)c1cccnc1F Amb28410507 [0,1,1,0,0,0|2,0,0]=4 1901 B10R1.61 CC(C)c1cccnc1N Amb33545277 [0,1,1,0,0,0|2,0,0]=4 1902 B10R1.61 CC(C)c1cccnc1O Amb24319275 [0,1,1,0,0,0|2,0,0]=4 1903 B10R1.61 CC(C)c1ccncc1Br Amb24320560 [0,1,1,0,0,0|2,0,0]=4 1904 B10R1.61 CC(C)c1ccncc1F Amb27839475 [0,1,1,0,0,0|2,0,0]=4 1905 B10R1.61 CC(C)c1ccncc1N Amb18203089 [0,1,1,0,0,0|2,0,0]=4 1906 B10R1.61 CC(C)c1ccncc1O Amb18643153 [0,1,1,0,0,0|2,0,0]=4 1907 B10R1.61 CC(C)c1cnccc1Br Amb20617490 [0,1,1,0,0,0|2,0,0]=4 1908 B10R1.61 CC(C)c1cnccc1N Amb24319529 [0,1,1,0,0,0|2,0,0]=4 1909 B10R1.61 CC(C)c1cnccc1O Amb26654985 [0,1,1,0,0,0|2,0,0]=4 1910 B10R1.61 CC(C)c1ncccc1Br Amb24320671 [0,1,1,0,0,0|2,0,0]=4 1911 B10R1.61 CC(C)c1ncccc1Cl Amb26412508 [0,1,1,0,0,0|2,0,0]=4 1912 B10R1.61 CC(C)c1ncccc1N Amb18203086 [0,1,1,0,0,0|2,0,0]=4 1913 B10R1.61 CC(C)c1ncccc1O Amb22886919 [0,1,1,0,0,0|2,0,0]=4 1914 B10R1.61 CC(Cl)c1ccccc1Br Amb7766803 [0,1,1,0,0,0|1,0,0]=3 1915 B10R1.61 CC(Cl)c1ccccc1Cl Amb434225 [0,1,1,0,0,0|1,0,0]=3 1916 B10R1.61 CC(Cl)c1ccccc1F Amb9205033 [0,1,1,0,0,0|1,0,0]=3 1917 B10R1.61 CC(Cl)c1ccccc1N Amb27756087 [0,1,1,0,0,0|1,0,0]=3 1918 B10R1.61 CC(Cl)c1cccnc1Cl Amb25245963 [0,1,1,0,0,0|2,0,0]=4 1919 B10R1.61 CC(Cl)c1ccncc1Cl Amb28121833 [0,1,1,0,0,0|2,0,0]=4 1920 B10R1.61 CC(Cl)c1ccncc1F Amb22886718 [0,1,1,0,0,0|2,0,0]=4 1921 B10R1.61 CC(Cl)c1ncccc1F Amb23402726 [0,1,1,0,0,0|2,0,0]=4 1922 B10R1.61 CC(N)C1=CC=CNC1=O Amb18263550 [0,1,1,0,0,0|2,0,0]=4 1923 B10R1.61 CC(N)c1cccc[n+]1[O-] Amb27660000 [0,1,1,0,0,0|2,0,0]=4 1924 B10R1.61 CC(N)c1ccccc1Br Amb30634259 [0,1,1,0,0,0|1,0,0]=3 1925 B10R1.61 CC(N)c1ccccc1Br Amb9745702 [0,1,1,0,0,0|1,0,0]=3 1926 B10R1.61 CC(N)c1ccccc1Cl Amb1995323 [0,1,1,0,0,0|1,0,0]=3 1927 B10R1.61 CC(N)c1ccccc1Cl Amb8503482 [0,1,1,0,0,0|1,0,0]=3 1928 B10R1.61 CC(N)c1ccccc1F Amb1215251 [0,1,1,0,0,0|1,0,0]=3 1929 B10R1.61 CC(N)c1ccccc1N Amb32693442 [0,1,1,0,0,0|1,0,0]=3 1930 B10R1.61 CC(N)c1ccccc1N Amb7173600 [0,1,1,0,0,0|1,0,0]=3 1931 B10R1.61 CC(N)c1ccccc1O Amb1120555 [0,1,1,0,0,0|1,0,0]=3 1932 B10R1.61 CC(N)c1ccccc1O Amb6892529 [0,1,1,0,0,0|1,0,0]=3 1933 B10R1.61 CC(N)c1ccccc1S Amb27786115 [0,1,1,0,0,0|1,0,0]=3 1934 B10R1.61 CC(N)c1cccnc1Br Amb24056177 [0,1,1,0,0,0|2,0,0]=4 1935 B10R1.61 CC(N)c1cccnc1Cl Amb23556949 [0,1,1,0,0,0|2,0,0]=4 1936 B10R1.61 CC(N)c1cccnc1F Amb25694441 [0,1,1,0,0,0|2,0,0]=4 1937 B10R1.61 CC(N)c1cccnc1N Amb26937671 [0,1,1,0,0,0|2,0,0]=4 1938 B10R1.61 CC(N)c1ccncc1Br Amb26057206 [0,1,1,0,0,0|2,0,0]=4 1939 B10R1.61 CC(N)c1ccncc1Br Amb32753261 [0,1,1,0,0,0|2,0,0]=4 1940 B10R1.61 CC(N)c1ccncc1Cl Amb25887560 [0,1,1,0,0,0|2,0,0]=4 1941 B10R1.61 CC(N)c1ccncc1F Amb25146247 [0,1,1,0,0,0|2,0,0]=4 1942 B10R1.61 CC(N)c1ccncc1N Amb23400503 [0,1,1,0,0,0|2,0,0]=4 1943 B10R1.61 CC(N)c1ccncc1O Amb27856504 [0,1,1,0,0,0|2,0,0]=4 1944 B10R1.61 CC(N)c1cnccc1Br Amb28367933 [0,1,1,0,0,0|2,0,0]=4 1945 B10R1.61 CC(N)c1cnccc1O Amb27615112 [0,1,1,0,0,0|2,0,0]=4 1946 B10R1.61 CC(N)c1ncccc1Br Amb27466338 [0,1,1,0,0,0|2,0,0]=4 1947 B10R1.61 CC(N)c1ncccc1F Amb23412446 [0,1,1,0,0,0|2,0,0]=4 1948 B10R1.61 CC(N)c1ncccc1F Amb28895985 [0,1,1,0,0,0|2,0,0]=4 1949 B10R1.61 CC(N)c1ncccc1F Amb32663334 [0,1,1,0,0,0|2,0,0]=4 1950 B10R1.61 CC(N)c1ncccc1N Amb25185118 [0,1,1,0,0,0|2,0,0]=4 1951 B10R1.61 CC(O)N1C=CC=CC1=O Amb27451552 [0,1,1,0,0,0|1,0,0]=3 1952 B10R1.61 CC(O)N1C=NC=CC1=O Amb27480622 [0,1,1,0,0,0|2,0,0]=4 1953 B10R1.61 CC(O)c1cccc[n+]1C Amb4011603 [0,1,1,0,0,0|1,0,0]=3 1954 B10R1.61 CC(O)c1ccccc1Br Amb4020060 [0,1,1,0,0,0|0,0,0]=2 1955 B10R1.61 CC(O)c1ccccc1Cl Amb6296141 [0,1,1,0,0,0|0,0,0]=2 1956 B10R1.61 CC(O)c1ccccc1F Amb9748272 [0,1,1,0,0,0|0,0,0]=2 1957 B10R1.61 CC(O)c1ccccc1N Amb10609794 [0,1,1,0,0,0|0,0,0]=2 1958 B10R1.61 CC(O)c1ccccc1O Amb6705780 [0,1,1,0,0,0|0,0,0]=2 1959 B10R1.61 CC(O)c1cccnc1Br Amb24056176 [0,1,1,0,0,0|1,0,0]=3 1960 B10R1.61 CC(O)c1cccnc1Cl Amb21961212 [0,1,1,0,0,0|1,0,0]=3 1961 B10R1.61 CC(O)c1cccnc1F Amb26021733 [0,1,1,0,0,0|1,0,0]=3 1962 B10R1.61 CC(O)c1ccncc1Br Amb27755392 [0,1,1,0,0,0|1,0,0]=3 1963 B10R1.61 CC(O)c1ccncc1Br Amb32753262 [0,1,1,0,0,0|1,0,0]=3 1964 B10R1.61 CC(O)c1ccncc1Cl Amb27144971 [0,1,1,0,0,0|1,0,0]=3 1965 B10R1.61 CC(O)c1ccncc1F Amb22546372 [0,1,1,0,0,0|1,0,0]=3 1966 B10R1.61 CC(O)c1ccncc1N Amb23401920 [0,1,1,0,0,0|1,0,0]=3 1967 B10R1.61 CC(O)c1cnccc1Br Amb25309004 [0,1,1,0,0,0|1,0,0]=3 1968 B10R1.61 CC(O)c1ncccc1Br Amb24359972 [0,1,1,0,0,0|1,0,0]=3 1969 B10R1.61 CC(O)c1ncccc1Br Amb32666427 [0,1,1,0,0,0|1,0,0]=3 1970 B10R1.61 CC(O)c1ncccc1Cl Amb25675491 [0,1,1,0,0,0|1,0,0]=3 1971 B10R1.61 CC(O)c1ncccc1F Amb22167761 [0,1,1,0,0,0|1,0,0]=3 1972 B10R1.61 CC(O)c1ncccc1N Amb25142455 [0,1,1,0,0,0|1,0,0]=3 1973 B10R1.61 CC(O)c1nccnc1Br Amb28135823 [0,1,1,0,0,0|2,0,0]=4 1974 B10R1.61 CC(O)c1nccnc1F Amb22388293 [0,1,1,0,0,0|2,0,0]=4 1975 B10R1.61 CC(O)c1ncncc1Br Amb24309431 [0,1,1,0,0,0|2,0,0]=4 1976 B10R1.61 CC(O)c1ncncc1F Amb22752562 [0,1,1,0,0,0|2,0,0]=4 1977 B10R1.61 CC(S)c1ccccc1Br Amb9208026 [0,1,1,0,0,0|0,1,0]=3 1978 B10R1.61 CC(S)c1ccccc1Cl Amb6255985 [0,1,1,0,0,0|0,1,0]=3 1979 B10R1.61 CC(S)c1ccccc1F Amb9208028 [0,1,1,0,0,0|0,1,0]=3 1980 B10R1.61 CC(S)c1ccccc1O Amb7784683 [0,1,1,0,0,0|0,1,0]=3 1981 B10R1.61 CN(C)c1ccccc1Br Amb6366099 [0,1,1,0,0,0|2,0,0]=4 1982 B10R1.61 CN(C)c1ccccc1Cl Amb8439144 [0,1,1,0,0,0|2,0,0]=4 1983 B10R1.61 CN(C)c1ccccc1F Amb10840219 [0,1,1,0,0,0|2,0,0]=4 1984 B10R1.61 CN(C)c1ccccc1I Amb20668324 [0,1,1,0,0,0|2,0,0]=4 1985 B10R1.61 CN(C)c1ccccc1N Amb1141580 [0,1,1,0,0,0|2,0,0]=4 1986 B10R1.61 CN(C)c1ccccc1N Amb6892782 [0,1,1,0,0,0|2,0,0]=4 1987 B10R1.61 CN(C)c1ccccc1O Amb8439130 [0,1,1,0,0,0|2,0,0]=4 1988 B10R1.61 CN(C)c1ccccc1S Amb25887644 [0,1,1,0,0,0|2,0,0]=4 1989 B10R1.61 CN(N)c1ccccc1Br Amb17237220 [0,1,1,0,0,0|2,0,0]=4 1990 B10R1.61 CN(N)c1ccccc1Cl Amb17232197 [0,1,1,0,0,0|2,0,0]=4 1991 B10R1.61 CN(N)c1ccccc1F Amb17231915 [0,1,1,0,0,0|2,0,0]=4 1992 B10R1.61 CS(=O)c1ccccc1Br Amb19891620 [0,1,1,0,0,0|1,0,1]=4 1993 B10R1.61 CS(=O)c1ccccc1F Amb10839323 [0,1,1,0,0,0|1,0,1]=4 1994 B10R1.61 CS(=O)c1ccccc1I Amb19930098 [0,1,1,0,0,0|1,0,1]=4 1995 B10R1.61 CS(=O)c1ccccc1N Amb18945203 [0,1,1,0,0,0|1,0,1]=4 1996 B10R1.61 CS(=O)c1ccccc1O Amb2420338 [0,1,1,0,0,0|1,0,1]=4 1997 B10R1.61 C[C@@H](N)c1ccccc1Br Amb22754718 [0,1,1,0,0,0|1,0,0]=3 1998 B10R1.61 C[C@@H](N)c1ccccc1Br Amb6893478 [0,1,1,0,0,0|1,0,0]=3 1999 B10R1.61 C[C@@H](N)c1ccccc1Cl Amb16233926 [0,1,1,0,0,0|1,0,0]=3 2000 B10R1.61 C[C@@H](N)c1ccccc1Cl Amb6893449 [0,1,1,0,0,0|1,0,0]=3 2001 B10R1.61 C[C@@H](N)c1ccccc1F Amb10838302 [0,1,1,0,0,0|1,0,0]=3 2002 B10R1.61 C[C@@H](N)c1ccccc1F Amb22288619 [0,1,1,0,0,0|1,0,0]=3 2003 B10R1.61 C[C@@H](N)c1ccccc1O Amb22748922 [0,1,1,0,0,0|1,0,0]=3 2004 B10R1.61 C[C@@H](N)c1ccccc1O Amb2699152 [0,1,1,0,0,0|1,0,0]=3 2005 B10R1.61 C[C@@H](N)c1cccnc1Br Amb25979752 [0,1,1,0,0,0|2,0,0]=4 2006 B10R1.61 C[C@@H](N)c1cccnc1Cl Amb27797932 [0,1,1,0,0,0|2,0,0]=4 2007 B10R1.61 C[C@@H](N)c1cccnc1F Amb25805548 [0,1,1,0,0,0|2,0,0]=4 2008 B10R1.61 C[C@@H](N)c1cccnc1O Amb27831927 [0,1,1,0,0,0|2,0,0]=4 2009 B10R1.61 C[C@@H](N)c1ccncc1Br Amb27665649 [0,1,1,0,0,0|2,0,0]=4 2010 B10R1.61 C[C@@H](N)c1ccncc1Br Amb32675467 [0,1,1,0,0,0|2,0,0]=4 2011 B10R1.61 C[C@@H](N)c1ccncc1Cl Amb26619398 [0,1,1,0,0,0|2,0,0]=4 2012 B10R1.61 C[C@@H](N)c1ccncc1F Amb27875029 [0,1,1,0,0,0|2,0,0]=4 2013 B10R1.61 C[C@@H](N)c1cnccc1N Amb28399304 [0,1,1,0,0,0|2,0,0]=4 2014 B10R1.61 C[C@@H](N)c1cnccc1O Amb28050263 [0,1,1,0,0,0|2,0,0]=4 2015 B10R1.61 C[C@@H](N)c1ncccc1Br Amb24413548 [0,1,1,0,0,0|2,0,0]=4 2016 B10R1.61 C[C@@H](N)c1ncccc1Br Amb30868012 [0,1,1,0,0,0|2,0,0]=4 2017 B10R1.61 C[C@@H](N)c1ncccc1F Amb24654773 [0,1,1,0,0,0|2,0,0]=4 2018 B10R1.61 C[C@@H](N)c1ncccc1F Amb30867688 [0,1,1,0,0,0|2,0,0]=4 2019 B10R1.61 C[C@@H](N)c1ncccc1F Amb33204502 [0,1,1,0,0,0|2,0,0]=4 2020 B10R1.61 C[C@@H](O)c1ccccc1Br Amb8517146 [0,1,1,0,0,0|0,0,0]=2 2021 B10R1.61 C[C@@H](O)c1ccccc1Cl Amb6893448 [0,1,1,0,0,0|0,0,0]=2 2022 B10R1.61 C[C@@H](O)c1ccccc1F Amb10838298 [0,1,1,0,0,0|0,0,0]=2 2023 B10R1.61 C[C@@H](O)c1ccccc1O Amb27664097 [0,1,1,0,0,0|0,0,0]=2 2024 B10R1.61 C[C@@H](O)c1cccnc1Br Amb33387437 [0,1,1,0,0,0|1,0,0]=3 2025 B10R1.61 C[C@@H](O)c1cccnc1Cl Amb33256988 [0,1,1,0,0,0|1,0,0]=3 2026 B10R1.61 C[C@@H](O)c1cccnc1F Amb33378317 [0,1,1,0,0,0|1,0,0]=3 2027 B10R1.61 C[C@@H](O)c1cccnc1N Amb22745879 [0,1,1,0,0,0|1,0,0]=3 2028 B10R1.61 C[C@@H](O)c1ccncc1Br Amb26444559 [0,1,1,0,0,0|1,0,0]=3 2029 B10R1.61 C[C@@H](O)c1ccncc1Cl Amb25058281 [0,1,1,0,0,0|1,0,0]=3 2030 B10R1.61 C[C@@H](O)c1ccncc1F Amb24622602 [0,1,1,0,0,0|1,0,0]=3 2031 B10R1.61 C[C@@H](O)c1cnccc1Br Amb27848665 [0,1,1,0,0,0|1,0,0]=3 2032 B10R1.61 C[C@@H](O)c1cnccc1Cl Amb26486501 [0,1,1,0,0,0|1,0,0]=3 2033 B10R1.61 C[C@@H](O)c1ncccc1Br Amb32663488 [0,1,1,0,0,0|1,0,0]=3 2034 B10R1.61 C[C@@H](O)c1ncccc1F Amb24707664 [0,1,1,0,0,0|1,0,0]=3 2035 B10R1.61 C[C@H](N)c1ccccc1Br Amb32927487 [0,1,1,0,0,0|1,0,0]=3 2036 B10R1.61 C[C@H](N)c1ccccc1Br Amb6893479 [0,1,1,0,0,0|1,0,0]=3 2037 B10R1.61 C[C@H](N)c1ccccc1Cl Amb22284328 [0,1,1,0,0,0|1,0,0]=3 2038 B10R1.61 C[C@H](N)c1ccccc1Cl Amb6893450 [0,1,1,0,0,0|1,0,0]=3 2039 B10R1.61 C[C@H](N)c1ccccc1F Amb10607169 [0,1,1,0,0,0|1,0,0]=3 2040 B10R1.61 C[C@H](N)c1ccccc1F Amb22406363 [0,1,1,0,0,0|1,0,0]=3 2041 B10R1.61 C[C@H](N)c1ccccc1I Amb28315762 [0,1,1,0,0,0|1,0,0]=3 2042 B10R1.61 C[C@H](N)c1ccccc1O Amb2699153 [0,1,1,0,0,0|1,0,0]=3 2043 B10R1.61 C[C@H](N)c1ccccc1O Amb32671097 [0,1,1,0,0,0|1,0,0]=3 2044 B10R1.61 C[C@H](N)c1cccnc1Br Amb26885543 [0,1,1,0,0,0|2,0,0]=4 2045 B10R1.61 C[C@H](N)c1cccnc1Cl Amb28043465 [0,1,1,0,0,0|2,0,0]=4 2046 B10R1.61 C[C@H](N)c1cccnc1F Amb26939438 [0,1,1,0,0,0|2,0,0]=4 2047 B10R1.61 C[C@H](N)c1cccnc1N Amb27474843 [0,1,1,0,0,0|2,0,0]=4 2048 B10R1.61 C[C@H](N)c1cccnc1O Amb26612844 [0,1,1,0,0,0|2,0,0]=4 2049 B10R1.61 C[C@H](N)c1cccnc1S Amb27838883 [0,1,1,0,0,0|2,0,0]=4 2050 B10R1.61 C[C@H](N)c1ccncc1Br Amb25890127 [0,1,1,0,0,0|2,0,0]=4 2051 B10R1.61 C[C@H](N)c1ccncc1Br Amb32675466 [0,1,1,0,0,0|2,0,0]=4 2052 B10R1.61 C[C@H](N)c1ccncc1Cl Amb25742943 [0,1,1,0,0,0|2,0,0]=4 2053 B10R1.61 C[C@H](N)c1ccncc1F Amb25289879 [0,1,1,0,0,0|2,0,0]=4 2054 B10R1.61 C[C@H](N)c1ccncc1O Amb28325117 [0,1,1,0,0,0|2,0,0]=4 2055 B10R1.61 C[C@H](N)c1cnccc1Br Amb28315610 [0,1,1,0,0,0|2,0,0]=4 2056 B10R1.61 C[C@H](N)c1cnccc1Cl Amb27474844 [0,1,1,0,0,0|2,0,0]=4 2057 B10R1.61 C[C@H](N)c1cnccc1N Amb28050267 [0,1,1,0,0,0|2,0,0]=4 2058 B10R1.61 C[C@H](N)c1ncccc1Br Amb27259352 [0,1,1,0,0,0|2,0,0]=4 2059 B10R1.61 C[C@H](N)c1ncccc1Cl Amb28069137 [0,1,1,0,0,0|2,0,0]=4 2060 B10R1.61 C[C@H](N)c1ncccc1Cl Amb33871553 [0,1,1,0,0,0|2,0,0]=4 2061 B10R1.61 C[C@H](N)c1ncccc1F Amb26946692 [0,1,1,0,0,0|2,0,0]=4 2062 B10R1.61 C[C@H](N)c1ncccc1F Amb28895984 [0,1,1,0,0,0|2,0,0]=4 2063 B10R1.61 C[C@H](N)c1ncccc1F Amb33864074 [0,1,1,0,0,0|2,0,0]=4 2064 B10R1.61 C[C@H](O)c1ccccc1Br Amb4605835 [0,1,1,0,0,0|0,0,0]=2 2065 B10R1.61 C[C@H](O)c1ccccc1Cl Amb6893447 [0,1,1,0,0,0|0,0,0]=2 2066 B10R1.61 C[C@H](O)c1ccccc1F Amb10838300 [0,1,1,0,0,0|0,0,0]=2 2067 B10R1.61 C[C@H](O)c1ccccc1N Amb26350508 [0,1,1,0,0,0|0,0,0]=2 2068 B10R1.61 C[C@H](O)c1ccccc1O Amb24476869 [0,1,1,0,0,0|0,0,0]=2 2069 B10R1.61 C[C@H](O)c1cccnc1Br Amb33387440 [0,1,1,0,0,0|1,0,0]=3 2070 B10R1.61 C[C@H](O)c1cccnc1Cl Amb33256995 [0,1,1,0,0,0|1,0,0]=3 2071 B10R1.61 C[C@H](O)c1cccnc1F Amb33378311 [0,1,1,0,0,0|1,0,0]=3 2072 B10R1.61 C[C@H](O)c1cccnc1N Amb25771199 [0,1,1,0,0,0|1,0,0]=3 2073 B10R1.61 C[C@H](O)c1ccncc1Br Amb24708454 [0,1,1,0,0,0|1,0,0]=3 2074 B10R1.61 C[C@H](O)c1ccncc1Br Amb32675469 [0,1,1,0,0,0|1,0,0]=3 2075 B10R1.61 C[C@H](O)c1ccncc1Cl Amb24433046 [0,1,1,0,0,0|1,0,0]=3 2076 B10R1.61 C[C@H](O)c1ccncc1F Amb24447395 [0,1,1,0,0,0|1,0,0]=3 2077 B10R1.61 C[C@H](O)c1ncccc1Br Amb27397638 [0,1,1,0,0,0|1,0,0]=3 2078 B10R1.61 C[C@H](O)c1ncccc1Br Amb32663487 [0,1,1,0,0,0|1,0,0]=3 2079 B10R1.61 C[C@H](O)c1ncccc1F Amb25279268 [0,1,1,0,0,0|1,0,0]=3 2080 B10R1.61 C[C@H](O)c1ncccc1O Amb27778171 [0,1,1,0,0,0|1,0,0]=3 2081 B10R1.61 C\C(O)=C1\N=CC=CC1=O Amb27956145 [0,1,1,0,0,0|1,0,1]=4 2082 B10R1.61 Cc1ccccc1B(O)O Amb2447081 [0,1,1,0,0,0|2,0,0]=4 2083 B10R1.61 Cc1ccccc1C(=O)O Amb2609023 [0,1,1,0,0,0|1,0,1]=4 2084 B10R1.61 Cc1ccccc1C(Br)Br Amb27159722 [0,1,1,0,0,0|2,0,0]=4 2085 B10R1.61 Cc1ccccc1C(C)Br Amb9210658 [0,1,1,0,0,0|1,0,0]=3 2086 B10R1.61 Cc1ccccc1C(C)C Amb22347915 [0,1,1,0,0,0|1,0,0]=3 2087 B10R1.61 Cc1ccccc1C(C)Cl Amb9205040 [0,1,1,0,0,0|1,0,0]=3 2088 B10R1.61 Cc1ccccc1C(C)N Amb17935796 [0,1,1,0,0,0|1,0,0]=3 2089 B10R1.61 Cc1ccccc1C(C)N Amb9745709 [0,1,1,0,0,0|1,0,0]=3 2090 B10R1.61 Cc1ccccc1C(C)O Amb6705766 [0,1,1,0,0,0|0,0,0]=2 2091 B10R1.61 Cc1ccccc1C(C)S Amb9208032 [0,1,1,0,0,0|0,1,0]=3 2092 B10R1.61 Cc1ccccc1C(O)=S Amb20242952 [0,1,1,0,0,0|1,0,1]=4 2093 B10R1.61 Cc1ccccc1C(O)O Amb26909320 [0,1,1,0,0,0|1,0,0]=3 2094 B10R1.61 Cc1ccccc1N(C)C Amb8516605 [0,1,1,0,0,0|2,0,0]=4 2095 B10R1.61 Cc1ccccc1N(C)N Amb17231896 [0,1,1,0,0,0|2,0,0]=4 2096 B10R1.61 Cc1ccccc1S(=O)O Amb24093011 [0,1,1,0,0,0|2,0,0]=4 2097 B10R1.61 Cc1ccccc1S(=O)O Amb27431820 [0,1,1,0,0,0|2,0,0]=4 2098 B10R1.61 Cc1ccccc1[C@@H](C)N Amb22288649 [0,1,1,0,0,0|1,0,0]=3 2099 B10R1.61 Cc1ccccc1[C@@H](C)N Amb6893586 [0,1,1,0,0,0|1,0,0]=3 2100 B10R1.61 Cc1ccccc1[C@@H](C)O Amb6893585 [0,1,1,0,0,0|0,0,0]=2 2101 B10R1.61 Cc1ccccc1[C@H](C)N Amb16233865 [0,1,1,0,0,0|1,0,0]=3 2102 B10R1.61 Cc1ccccc1[C@H](C)N Amb34915232 [0,1,1,0,0,0|1,0,0]=3 2103 B10R1.61 Cc1ccccc1[C@H](C)N Amb6893587 [0,1,1,0,0,0|1,0,0]=3 2104 B10R1.61 Cc1ccccc1[C@H](C)O Amb6893584 [0,1,1,0,0,0|0,0,0]=2 2105 B10R1.61 Cc1ccccc1[SiH](O)O Amb27959519 [0,1,1,0,0,0|1,1,0]=4 2106 B10R1.61 Cc1cccnc1C(C)Br Amb24749585 [0,1,1,0,0,0|2,0,0]=4 2107 B10R1.61 Cc1cccnc1C(C)N Amb10608068 [0,1,1,0,0,0|2,0,0]=4 2108 B10R1.61 Cc1cccnc1C(C)N Amb30869579 [0,1,1,0,0,0|2,0,0]=4 2109 B10R1.61 Cc1cccnc1C(C)O Amb26959122 [0,1,1,0,0,0|1,0,0]=3 2110 B10R1.61 Cc1cccnc1[C@@H](C)N Amb28340925 [0,1,1,0,0,0|2,0,0]=4 2111 B10R1.61 Cc1cccnc1[C@@H](C)O Amb24406429 [0,1,1,0,0,0|1,0,0]=3 2112 B10R1.61 Cc1cccnc1[C@H](C)N Amb25791601 [0,1,1,0,0,0|2,0,0]=4 2113 B10R1.61 Cc1cccnc1[C@H](C)O Amb25305108 [0,1,1,0,0,0|1,0,0]=3 2114 B10R1.61 Cc1ccncc1C(C)Br Amb27949595 [0,1,1,0,0,0|2,0,0]=4 2115 B10R1.61 Cc1ccncc1C(C)N Amb18832439 [0,1,1,0,0,0|2,0,0]=4 2116 B10R1.61 Cc1ccncc1C(C)O Amb22059811 [0,1,1,0,0,0|1,0,0]=3 2117 B10R1.61 Cc1ccncc1[C@@H](C)N Amb25147239 [0,1,1,0,0,0|2,0,0]=4 2118 B10R1.61 Cc1ccncc1[C@@H](C)O Amb26941307 [0,1,1,0,0,0|1,0,0]=3 2119 B10R1.61 Cc1ccncc1[C@H](C)N Amb24641376 [0,1,1,0,0,0|2,0,0]=4 2120 B10R1.61 Cc1ccncc1[C@H](C)O Amb26006042 [0,1,1,0,0,0|1,0,0]=3 2121 B10R1.61 Cc1cnccc1C(C)N Amb26433213 [0,1,1,0,0,0|2,0,0]=4 2122 B10R1.61 Cc1cnccc1C(C)O Amb25966495 [0,1,1,0,0,0|1,0,0]=3 2123 B10R1.61 Cc1cnccc1[C@@H](C)N Amb26501750 [0,1,1,0,0,0|2,0,0]=4 2124 B10R1.61 Cc1cnccc1[C@@H](C)O Amb25713575 [0,1,1,0,0,0|1,0,0]=3 2125 B10R1.61 Cc1cnccc1[C@H](C)N Amb27876688 [0,1,1,0,0,0|2,0,0]=4 2126 B10R1.61 Cc1cnccc1[C@H](C)O Amb24706964 [0,1,1,0,0,0|1,0,0]=3 2127 B10R1.61 Cc1ncccc1C(C)Br Amb26860665 [0,1,1,0,0,0|2,0,0]=4 2128 B10R1.61 Cc1ncccc1C(C)N Amb18853388 [0,1,1,0,0,0|2,0,0]=4 2129 B10R1.61 Cc1ncccc1C(C)O Amb27146830 [0,1,1,0,0,0|1,0,0]=3 2130 B10R1.61 Cc1ncccc1[C@@H](C)N Amb27961499 [0,1,1,0,0,0|2,0,0]=4 2131 B10R1.61 Cc1ncccc1[C@@H](C)O Amb32880128 [0,1,1,0,0,0|1,0,0]=3 2132 B10R1.61 Cc1ncccc1[C@H](C)N Amb24401138 [0,1,1,0,0,0|2,0,0]=4 2133 B10R1.61 Cc1ncccc1[C@H](C)O Amb32880607 [0,1,1,0,0,0|1,0,0]=3 2134 B10R1.61 Cc1nccnc1[C@@H](C)O Amb27669161 [0,1,1,0,0,0|2,0,0]=4 2135 B10R1.61 Cc1nccnc1[C@H](C)O Amb27659010 [0,1,1,0,0,0|2,0,0]=4 2136 B10R1.61 Cc1ncncc1C(C)O Amb24119962 [0,1,1,0,0,0|2,0,0]=4 2137 B10R1.61 Cc1ncncc1[C@@H](C)O Amb25307908 [0,1,1,0,0,0|2,0,0]=4 2138 B10R1.61 Cc1ncncc1[C@H](C)O Amb24397465 [0,1,1,0,0,0|2,0,0]=4 2139 B10R1.61 Clc1ccccc1C(Cl)Cl Amb17940881 [0,1,1,0,0,0|2,0,0]=4 2140 B10R1.61 FC(F)c1ccccc1Br Amb2691589 [0,1,1,0,0,0|2,0,0]=4 2141 B10R1.61 FC(F)c1ccccc1I Amb27482821 [0,1,1,0,0,0|2,0,0]=4 2142 B10R1.61 Fc1ccccc1C(Br)Br Amb10839627 [0,1,1,0,0,0|2,0,0]=4 2143 B10R1.61 Fc1ccccc1C(Cl)Cl Amb8517081 [0,1,1,0,0,0|2,0,0]=4 2144 B10R1.61 Fc1ccccc1C(F)F Amb2691624 [0,1,1,0,0,0|2,0,0]=4 2145 B10R1.61 NC(O)c1ccccc1O Amb27596246 [0,1,1,0,0,0|1,0,0]=3 2146 B10R1.61 Nc1ccccc1B(O)O Amb2455634 [0,1,1,0,0,0|2,0,0]=4 2147 B10R1.61 Nc1ccccc1B(O)O Amb2455781 [0,1,1,0,0,0|2,0,0]=4 2148 B10R1.61 Nc1ccccc1C(=O)O Amb1933714 [0,1,1,0,0,0|1,0,1]=4 2149 B10R1.61 Nc1ccccc1C(F)F Amb20075852 [0,1,1,0,0,0|2,0,0]=4 2150 B10R1.61 Nc1ccccc1C(F)F Amb22388456 [0,1,1,0,0,0|2,0,0]=4 2151 B10R1.61 O=C(O)c1ccccc1Br Amb6365362 [0,1,1,0,0,0|1,0,1]=4 2152 B10R1.61 O=C(O)c1ccccc1Cl Amb1935156 [0,1,1,0,0,0|1,0,1]=4 2153 B10R1.61 O=C(O)c1ccccc1F Amb2688022 [0,1,1,0,0,0|1,0,1]=4 2154 B10R1.61 O=C(O)c1ccccc1I Amb6446255 [0,1,1,0,0,0|1,0,1]=4 2155 B10R1.61 O=C(O)c1ccccc1O Amb1912504 [0,1,1,0,0,0|1,0,1]=4 2156 B10R1.61 O=C(O)c1ccccc1S Amb901970 [0,1,1,0,0,0|1,0,1]=4 2157 B10R1.61 O=S(O)c1ccccc1F Amb26866329 [0,1,1,0,0,0|2,0,0]=4 2158 B10R1.61 OB(O)c1ccccc1Br Amb6366157 [0,1,1,0,0,0|2,0,0]=4 2159 B10R1.61 OB(O)c1ccccc1Cl Amb2383486 [0,1,1,0,0,0|2,0,0]=4 2160 B10R1.61 OB(O)c1ccccc1F Amb2447092 [0,1,1,0,0,0|2,0,0]=4 2161 B10R1.61 OB(O)c1ccccc1I Amb16234273 [0,1,1,0,0,0|2,0,0]=4 2162 B10R1.61 OB(O)c1ccccc1O Amb2447024 [0,1,1,0,0,0|2,0,0]=4 2163 B10R1.61 OB(O)c1ccccc1S Amb19958291 [0,1,1,0,0,0|2,0,0]=4 2164 B10R1.61 OC(=S)c1ccccc1O Amb22734424 [0,1,1,0,0,0|1,0,1]=4 2165 B10R1.61 OC(O)c1ccccc1Cl Amb28050633 [0,1,1,0,0,0|1,0,0]=3 2166 B10R1.61 OC(O)c1cnccc1Cl Amb28064095 [0,1,1,0,0,0|2,0,0]=4 2167 B10R1.61 OC(O)c1ncccc1Cl Amb27835473 [0,1,1,0,0,0|2,0,0]=4 2168 B10R1.61 Oc1ccccc1C(F)F Amb22896722 [0,1,1,0,0,0|2,0,0]=4 2169 B10R1.113 Brc1cccc(C(Br)Br)c1 Amb4018058 [0,1,1,0,0,0|2,0,0]=4 2170 B10R1.113 C=C(C)c1cccc(Br)c1 Amb24448711 [0,1,1,0,0,0|1,0,1]=4 2171 B10R1.113 C=C(C)c1cccc(C)c1 Amb10844683 [0,1,1,0,0,0|1,0,1]=4 2172 B10R1.113 C=C(C)c1cccc(Cl)c1 Amb24088166 [0,1,1,0,0,0|1,0,1]=4 2173 B10R1.113 C=C(C)c1cccc(F)c1 Amb25133875 [0,1,1,0,0,0|1,0,1]=4 2174 B10R1.113 C=C(C)c1cccc(N)c1 Amb17107084 [0,1,1,0,0,0|1,0,1]=4 2175 B10R1.113 C=C(C)c1cccc(O)c1 Amb18124424 [0,1,1,0,0,0|1,0,1]=4 2176 B10R1.113 CC(=O)c1cccc(Br)c1 Amb2684932 [0,1,1,0,0,0|0,0,2]=4 2177 B10R1.113 CC(=O)c1cccc(C)c1 Amb3940080 [0,1,1,0,0,0|0,0,2]=4 2178 B10R1.113 CC(=O)c1cccc(Cl)c1 Amb3940078 [0,1,1,0,0,0|0,0,2]=4 2179 B10R1.113 CC(=O)c1cccc(F)c1 Amb2688006 [0,1,1,0,0,0|0,0,2]=4 2180 B10R1.113 CC(=O)c1cccc(I)c1 Amb2688831 [0,1,1,0,0,0|0,0,2]=4 2181 B10R1.113 CC(=O)c1cccc(N)c1 Amb2684314 [0,1,1,0,0,0|0,0,2]=4 2182 B10R1.113 CC(=O)c1cccc(O)c1 Amb2792768 [0,1,1,0,0,0|0,0,2]=4 2183 B10R1.113 CC(=O)c1cccc(S)c1 Amb19374493 [0,1,1,0,0,0|0,0,2]=4 2184 B10R1.113 CC(Br)c1cccc(Br)c1 Amb8835388 [0,1,1,0,0,0|1,0,0]=3 2185 B10R1.113 CC(Br)c1cccc(Br)n1 Amb27423280 [0,1,1,0,0,0|2,0,0]=4 2186 B10R1.113 CC(Br)c1cccc(Cl)c1 Amb9210663 [0,1,1,0,0,0|1,0,0]=3 2187 B10R1.113 CC(Br)c1cccc(Cl)n1 Amb27881257 [0,1,1,0,0,0|2,0,0]=4 2188 B10R1.113 CC(Br)c1cccc(F)c1 Amb8835376 [0,1,1,0,0,0|1,0,0]=3 2189 B10R1.113 CC(Br)c1cncc(Br)c1 Amb23509149 [0,1,1,0,0,0|2,0,0]=4 2190 B10R1.113 CC(Br)c1cncc(Br)c1 Amb33456210 [0,1,1,0,0,0|2,0,0]=4 2191 B10R1.113 CC(Br)c1cncc(Cl)c1 Amb27489509 [0,1,1,0,0,0|2,0,0]=4 2192 B10R1.113 CC(C)C1=CC(=S)C=CN1 Amb24556344 [0,1,1,0,0,0|2,0,0]=4 2193 B10R1.113 CC(C)C1=CC=CC(=O)N1 Amb22372290 [0,1,1,0,0,0|2,0,0]=4 2194 B10R1.113 CC(C)c1cc(Br)ccn1 Amb10599879 [0,1,1,0,0,0|2,0,0]=4 2195 B10R1.113 CC(C)c1cc(Cl)ccn1 Amb10599890 [0,1,1,0,0,0|2,0,0]=4 2196 B10R1.113 CC(C)c1cc(N)ccn1 Amb10599893 [0,1,1,0,0,0|2,0,0]=4 2197 B10R1.113 CC(C)c1cc(O)ccn1 Amb10599894 [0,1,1,0,0,0|2,0,0]=4 2198 B10R1.113 CC(C)c1cccc(Br)c1 Amb2694387 [0,1,1,0,0,0|1,0,0]=3 2199 B10R1.113 CC(C)c1cccc(Br)n1 Amb10599839 [0,1,1,0,0,0|2,0,0]=4 2200 B10R1.113 CC(C)c1cccc(Cl)c1 Amb25889920 [0,1,1,0,0,0|1,0,0]=3 2201 B10R1.113 CC(C)c1cccc(Cl)n1 Amb8394846 [0,1,1,0,0,0|2,0,0]=4 2202 B10R1.113 CC(C)c1cccc(F)c1 Amb25214297 [0,1,1,0,0,0|1,0,0]=3 2203 B10R1.113 CC(C)c1cccc(I)c1 Amb8839226 [0,1,1,0,0,0|1,0,0]=3 2204 B10R1.113 CC(C)c1cccc(I)n1 Amb25169353 [0,1,1,0,0,0|2,0,0]=4 2205 B10R1.113 CC(C)c1cccc(N)c1 Amb6608928 [0,1,1,0,0,0|1,0,0]=3 2206 B10R1.113 CC(C)c1cccc(N)n1 Amb10599850 [0,1,1,0,0,0|2,0,0]=4 2207 B10R1.113 CC(C)c1cccc(O)c1 Amb3939550 [0,1,1,0,0,0|1,0,0]=3 2208 B10R1.113 CC(C)c1cccc(O)n1 Amb10599851 [0,1,1,0,0,0|2,0,0]=4 2209 B10R1.113 CC(C)c1cccc(S)c1 Amb24102307 [0,1,1,0,0,0|1,0,0]=3 2210 B10R1.113 CC(C)c1cccc([Mg+])c1 Amb30590198 [0,1,1,0,0,0|1,0,0]=3 2211 B10R1.113 CC(C)c1ccnc(Br)c1 Amb10599919 [0,1,1,0,0,0|2,0,0]=4 2212 B10R1.113 CC(C)c1ccnc(Cl)c1 Amb20617633 [0,1,1,0,0,0|2,0,0]=4 2213 B10R1.113 CC(C)c1ccnc(N)c1 Amb10599924 [0,1,1,0,0,0|2,0,0]=4 2214 B10R1.113 CC(C)c1ccnc(O)c1 Amb10599925 [0,1,1,0,0,0|2,0,0]=4 2215 B10R1.113 CC(C)c1cncc(Br)c1 Amb20617710 [0,1,1,0,0,0|2,0,0]=4 2216 B10R1.113 CC(C)c1cncc(Cl)c1 Amb27260369 [0,1,1,0,0,0|2,0,0]=4 2217 B10R1.113 CC(C)c1cncc(N)c1 Amb18832433 [0,1,1,0,0,0|2,0,0]=4 2218 B10R1.113 CC(C)c1cncc(O)c1 Amb20617711 [0,1,1,0,0,0|2,0,0]=4 2219 B10R1.113 CC(C)c1cncc(S)c1 Amb33276295 [0,1,1,0,0,0|2,0,0]=4 2220 B10R1.113 CC(Cl)c1cccc(Br)c1 Amb7766800 [0,1,1,0,0,0|1,0,0]=3 2221 B10R1.113 CC(Cl)c1cccc(Cl)c1 Amb9205048 [0,1,1,0,0,0|1,0,0]=3 2222 B10R1.113 CC(Cl)c1cccc(F)c1 Amb9205025 [0,1,1,0,0,0|1,0,0]=3 2223 B10R1.113 CC(Cl)c1cccc(N)c1 Amb26516788 [0,1,1,0,0,0|1,0,0]=3 2224 B10R1.113 CC(F)c1cccc(Br)c1 Amb22896506 [0,1,1,0,0,0|1,0,0]=3 2225 B10R1.113 CC(F)c1cccc(N)c1 Amb27163222 [0,1,1,0,0,0|1,0,0]=3 2226 B10R1.113 CC(F)c1cccc(O)c1 Amb24529130 [0,1,1,0,0,0|1,0,0]=3 2227 B10R1.113 CC(F)c1ccnc(Cl)c1 Amb25286802 [0,1,1,0,0,0|2,0,0]=4 2228 B10R1.113 CC(N)C1=CC(=O)NC=C1 Amb24529181 [0,1,1,0,0,0|2,0,0]=4 2229 B10R1.113 CC(N)c1cc(Br)ccn1 Amb27606431 [0,1,1,0,0,0|2,0,0]=4 2230 B10R1.113 CC(N)c1cc(Cl)ccn1 Amb18830678 [0,1,1,0,0,0|2,0,0]=4 2231 B10R1.113 CC(N)c1cc(F)ccn1 Amb26346813 [0,1,1,0,0,0|2,0,0]=4 2232 B10R1.113 CC(N)c1cccc(Br)c1 Amb30628546 [0,1,1,0,0,0|1,0,0]=3 2233 B10R1.113 CC(N)c1cccc(Br)c1 Amb9707479 [0,1,1,0,0,0|1,0,0]=3 2234 B10R1.113 CC(N)c1cccc(Br)n1 Amb27144806 [0,1,1,0,0,0|2,0,0]=4 2235 B10R1.113 CC(N)c1cccc(Cl)c1 Amb32666114 [0,1,1,0,0,0|1,0,0]=3 2236 B10R1.113 CC(N)c1cccc(Cl)c1 Amb9702929 [0,1,1,0,0,0|1,0,0]=3 2237 B10R1.113 CC(N)c1cccc(Cl)n1 Amb26847694 [0,1,1,0,0,0|2,0,0]=4 2238 B10R1.113 CC(N)c1cccc(F)c1 Amb1657244 [0,1,1,0,0,0|1,0,0]=3 2239 B10R1.113 CC(N)c1cccc(F)c1 Amb32644503 [0,1,1,0,0,0|1,0,0]=3 2240 B10R1.113 CC(N)c1cccc(I)c1 Amb3791142 [0,1,1,0,0,0|1,0,0]=3 2241 B10R1.113 CC(N)c1cccc(I)n1 Amb28239576 [0,1,1,0,0,0|2,0,0]=4 2242 B10R1.113 CC(N)c1cccc(N)c1 Amb33997893 [0,1,1,0,0,0|1,0,0]=3 2243 B10R1.113 CC(N)c1cccc(N)c1 Amb7173598 [0,1,1,0,0,0|1,0,0]=3 2244 B10R1.113 CC(N)c1cccc(O)c1 Amb33545129 [0,1,1,0,0,0|1,0,0]=3 2245 B10R1.113 CC(N)c1cccc(O)c1 Amb34913261 [0,1,1,0,0,0|1,0,0]=3 2246 B10R1.113 CC(N)c1cccc(O)c1 Amb9705322 [0,1,1,0,0,0|1,0,0]=3 2247 B10R1.113 CC(N)c1cccc(S)c1 Amb27817892 [0,1,1,0,0,0|1,0,0]=3 2248 B10R1.113 CC(N)c1ccnc(Cl)c1 Amb24056180 [0,1,1,0,0,0|2,0,0]=4 2249 B10R1.113 CC(N)c1ccnc(F)c1 Amb27424748 [0,1,1,0,0,0|2,0,0]=4 2250 B10R1.113 CC(N)c1ccnc(O)c1 Amb33544289 [0,1,1,0,0,0|2,0,0]=4 2251 B10R1.113 CC(N)c1cncc(Br)c1 Amb26556651 [0,1,1,0,0,0|2,0,0]=4 2252 B10R1.113 CC(N)c1cncc(F)c1 Amb18279087 [0,1,1,0,0,0|2,0,0]=4 2253 B10R1.113 CC(N)c1cncc(F)c1 Amb32941853 [0,1,1,0,0,0|2,0,0]=4 2254 B10R1.113 CC(N)c1cncc(O)c1 Amb27874102 [0,1,1,0,0,0|2,0,0]=4 2255 B10R1.113 CC(O)c1cc(Br)ccn1 Amb28050315 [0,1,1,0,0,0|1,0,0]=3 2256 B10R1.113 CC(O)c1cc(Cl)ccn1 Amb24480513 [0,1,1,0,0,0|1,0,0]=3 2257 B10R1.113 CC(O)c1ccc[n+]([O-])c1 Amb2613145 [0,1,1,0,0,0|1,0,0]=3 2258 B10R1.113 CC(O)c1cccc(Br)c1 Amb1109861 [0,1,1,0,0,0|0,0,0]=2 2259 B10R1.113 CC(O)c1cccc(Br)n1 Amb10975592 [0,1,1,0,0,0|1,0,0]=3 2260 B10R1.113 CC(O)c1cccc(Cl)c1 Amb4035044 [0,1,1,0,0,0|0,0,0]=2 2261 B10R1.113 CC(O)c1cccc(F)c1 Amb9748292 [0,1,1,0,0,0|0,0,0]=2 2262 B10R1.113 CC(O)c1cccc(F)n1 Amb24601796 [0,1,1,0,0,0|1,0,0]=3 2263 B10R1.113 CC(O)c1cccc(I)c1 Amb28348518 [0,1,1,0,0,0|0,0,0]=2 2264 B10R1.113 CC(O)c1cccc(N)c1 Amb9775988 [0,1,1,0,0,0|0,0,0]=2 2265 B10R1.113 CC(O)c1cccc(O)c1 Amb6705775 [0,1,1,0,0,0|0,0,0]=2 2266 B10R1.113 CC(O)c1cccc(S)c1 Amb27973521 [0,1,1,0,0,0|0,0,0]=2 2267 B10R1.113 CC(O)c1ccnc(Br)c1 Amb25789039 [0,1,1,0,0,0|1,0,0]=3 2268 B10R1.113 CC(O)c1ccnc(Cl)c1 Amb22496405 [0,1,1,0,0,0|1,0,0]=3 2269 B10R1.113 CC(O)c1ccnc(Cl)n1 Amb27163210 [0,1,1,0,0,0|2,0,0]=4 2270 B10R1.113 CC(O)c1ccnc(N)c1 Amb22001626 [0,1,1,0,0,0|1,0,0]=3 2271 B10R1.113 CC(O)c1cncc(Br)c1 Amb17595353 [0,1,1,0,0,0|1,0,0]=3 2272 B10R1.113 CC(O)c1cncc(Cl)n1 Amb27263061 [0,1,1,0,0,0|2,0,0]=4 2273 B10R1.113 CC(O)c1cncc(F)c1 Amb25300087 [0,1,1,0,0,0|1,0,0]=3 2274 B10R1.113 CC(S)c1cccc(Br)c1 Amb9208022 [0,1,1,0,0,0|0,1,0]=3 2275 B10R1.113 CC(S)c1cccc(Cl)c1 Amb9208040 [0,1,1,0,0,0|0,1,0]=3 2276 B10R1.113 CC(S)c1cccc(F)c1 Amb9208015 [0,1,1,0,0,0|0,1,0]=3 2277 B10R1.113 CC(S)c1cccc(N)c1 Amb32788484 [0,1,1,0,0,0|0,1,0]=3 2278 B10R1.113 CC(S)c1cccc(O)c1 Amb7784691 [0,1,1,0,0,0|0,1,0]=3 2279 B10R1.113 CC(S)c1cncc(Br)c1 Amb32788382 [0,1,1,0,0,0|1,1,0]=4 2280 B10R1.113 CC(S)c1cncc(F)c1 Amb25802187 [0,1,1,0,0,0|1,1,0]=4 2281 B10R1.113 CN(C)c1cccc(Br)c1 Amb2447133 [0,1,1,0,0,0|2,0,0]=4 2282 B10R1.113 CN(C)c1cccc(Cl)c1 Amb2721104 [0,1,1,0,0,0|2,0,0]=4 2283 B10R1.113 CN(C)c1cccc(F)c1 Amb10841394 [0,1,1,0,0,0|2,0,0]=4 2284 B10R1.113 CN(C)c1cccc(I)c1 Amb28049399 [0,1,1,0,0,0|2,0,0]=4 2285 B10R1.113 CN(C)c1cccc(N)c1 Amb3940543 [0,1,1,0,0,0|2,0,0]=4 2286 B10R1.113 CN(C)c1cccc(N)c1 Amb4037049 [0,1,1,0,0,0|2,0,0]=4 2287 B10R1.113 CN(C)c1cccc(O)c1 Amb3940096 [0,1,1,0,0,0|2,0,0]=4 2288 B10R1.113 CN(C)c1cccc(S)c1 Amb2687467 [0,1,1,0,0,0|2,0,0]=4 2289 B10R1.113 CN(N)c1cccc(Br)c1 Amb17237221 [0,1,1,0,0,0|2,0,0]=4 2290 B10R1.113 CN(N)c1cccc(Cl)c1 Amb4381639 [0,1,1,0,0,0|2,0,0]=4 2291 B10R1.113 CN(N)c1cccc(F)c1 Amb17231917 [0,1,1,0,0,0|2,0,0]=4 2292 B10R1.113 CP(C)c1cccc(Br)c1 Amb33743290 [0,1,1,0,0,0|2,0,0]=4 2293 B10R1.113 CS(=O)c1cccc(Br)c1 Amb19891299 [0,1,1,0,0,0|1,0,1]=4 2294 B10R1.113 CS(=O)c1cccc(Cl)c1 Amb19892202 [0,1,1,0,0,0|1,0,1]=4 2295 B10R1.113 CS(=O)c1cccc(N)c1 Amb2612466 [0,1,1,0,0,0|1,0,1]=4 2296 B10R1.113 CS(=O)c1cccc(N)c1 Amb32661803 [0,1,1,0,0,0|1,0,1]=4 2297 B10R1.113 CS(=O)c1cccc(O)c1 Amb26343856 [0,1,1,0,0,0|1,0,1]=4 2298 B10R1.113 C[C@@H](Cl)c1cccc(F)c1 Amb27650684 [0,1,1,0,0,0|1,0,0]=3 2299 B10R1.113 C[C@@H](N)c1cc(Cl)ccn1 Amb27596564 [0,1,1,0,0,0|2,0,0]=4 2300 B10R1.113 C[C@@H](N)c1cc(F)ccn1 Amb25377892 [0,1,1,0,0,0|2,0,0]=4 2301 B10R1.113 C[C@@H](N)c1cccc(Br)c1 Amb30633588 [0,1,1,0,0,0|1,0,0]=3 2302 B10R1.113 C[C@@H](N)c1cccc(Br)c1 Amb6893442 [0,1,1,0,0,0|1,0,0]=3 2303 B10R1.113 C[C@@H](N)c1cccc(Br)n1 Amb26899710 [0,1,1,0,0,0|2,0,0]=4 2304 B10R1.113 C[C@@H](N)c1cccc(Cl)c1 Amb22288623 [0,1,1,0,0,0|1,0,0]=3 2305 B10R1.113 C[C@@H](N)c1cccc(Cl)c1 Amb6893498 [0,1,1,0,0,0|1,0,0]=3 2306 B10R1.113 C[C@@H](N)c1cccc(Cl)n1 Amb27153257 [0,1,1,0,0,0|2,0,0]=4 2307 B10R1.113 C[C@@H](N)c1cccc(F)c1 Amb22274554 [0,1,1,0,0,0|1,0,0]=3 2308 B10R1.113 C[C@@H](N)c1cccc(F)c1 Amb6893460 [0,1,1,0,0,0|1,0,0]=3 2309 B10R1.113 C[C@@H](N)c1cccc(F)n1 Amb30869542 [0,1,1,0,0,0|2,0,0]=4 2310 B10R1.113 C[C@@H](N)c1cccc(N)c1 Amb8385692 [0,1,1,0,0,0|1,0,0]=3 2311 B10R1.113 C[C@@H](N)c1cccc(N)n1 Amb27215904 [0,1,1,0,0,0|2,0,0]=4 2312 B10R1.113 C[C@@H](N)c1cccc(O)c1 Amb22748255 [0,1,1,0,0,0|1,0,0]=3 2313 B10R1.113 C[C@@H](N)c1cccc(O)c1 Amb8385693 [0,1,1,0,0,0|1,0,0]=3 2314 B10R1.113 C[C@@H](N)c1cccc(O)n1 Amb27862313 [0,1,1,0,0,0|2,0,0]=4 2315 B10R1.113 C[C@@H](N)c1cccc(S)c1 Amb27591650 [0,1,1,0,0,0|1,0,0]=3 2316 B10R1.113 C[C@@H](N)c1ccnc(Br)c1 Amb30869517 [0,1,1,0,0,0|2,0,0]=4 2317 B10R1.113 C[C@@H](N)c1ccnc(Cl)c1 Amb19889553 [0,1,1,0,0,0|2,0,0]=4 2318 B10R1.113 C[C@@H](N)c1ccnc(Cl)c1 Amb25146374 [0,1,1,0,0,0|2,0,0]=4 2319 B10R1.113 C[C@@H](N)c1ccnc(F)c1 Amb28341823 [0,1,1,0,0,0|2,0,0]=4 2320 B10R1.113 C[C@@H](N)c1ccnc(F)c1 Amb30868017 [0,1,1,0,0,0|2,0,0]=4 2321 B10R1.113 C[C@@H](N)c1ccnc(O)c1 Amb27490616 [0,1,1,0,0,0|2,0,0]=4 2322 B10R1.113 C[C@@H](N)c1cncc(Br)c1 Amb24401330 [0,1,1,0,0,0|2,0,0]=4 2323 B10R1.113 C[C@@H](N)c1cncc(F)c1 Amb25942862 [0,1,1,0,0,0|2,0,0]=4 2324 B10R1.113 C[C@@H](N)c1cncc(F)c1 Amb31289412 [0,1,1,0,0,0|2,0,0]=4 2325 B10R1.113 C[C@@H](O)c1cc(Cl)ccn1 Amb27653005 [0,1,1,0,0,0|1,0,0]=3 2326 B10R1.113 C[C@@H](O)c1cc(F)ccn1 Amb33414994 [0,1,1,0,0,0|1,0,0]=3 2327 B10R1.113 C[C@@H](O)c1cccc(Br)c1 Amb8517147 [0,1,1,0,0,0|0,0,0]=2 2328 B10R1.113 C[C@@H](O)c1cccc(Br)n1 Amb25341088 [0,1,1,0,0,0|1,0,0]=3 2329 B10R1.113 C[C@@H](O)c1cccc(Cl)c1 Amb6893496 [0,1,1,0,0,0|0,0,0]=2 2330 B10R1.113 C[C@@H](O)c1cccc(Cl)n1 Amb33223310 [0,1,1,0,0,0|1,0,0]=3 2331 B10R1.113 C[C@@H](O)c1cccc(F)c1 Amb6893458 [0,1,1,0,0,0|0,0,0]=2 2332 B10R1.113 C[C@@H](O)c1cccc(N)c1 Amb28322803 [0,1,1,0,0,0|0,0,0]=2 2333 B10R1.113 C[C@@H](O)c1cccc(O)c1 Amb13952964 [0,1,1,0,0,0|0,0,0]=2 2334 B10R1.113 C[C@@H](O)c1ccnc(Cl)c1 Amb25059848 [0,1,1,0,0,0|1,0,0]=3 2335 B10R1.113 C[C@@H](O)c1ccnc(N)n1 Amb27882865 [0,1,1,0,0,0|2,0,0]=4 2336 B10R1.113 C[C@@H](O)c1cncc(Br)c1 Amb26369776 [0,1,1,0,0,0|1,0,0]=3 2337 B10R1.113 C[C@@H](O)c1cncc(F)c1 Amb26386498 [0,1,1,0,0,0|1,0,0]=3 2338 B10R1.113 C[C@H](N)c1cc(Br)ccn1 Amb28315728 [0,1,1,0,0,0|2,0,0]=4 2339 B10R1.113 C[C@H](N)c1cc(Cl)ccn1 Amb24624662 [0,1,1,0,0,0|2,0,0]=4 2340 B10R1.113 C[C@H](N)c1cc(F)ccn1 Amb27195899 [0,1,1,0,0,0|2,0,0]=4 2341 B10R1.113 C[C@H](N)c1cc(O)ccn1 Amb27770367 [0,1,1,0,0,0|2,0,0]=4 2342 B10R1.113 C[C@H](N)c1cccc(Br)c1 Amb33801742 [0,1,1,0,0,0|1,0,0]=3 2343 B10R1.113 C[C@H](N)c1cccc(Br)c1 Amb6893441 [0,1,1,0,0,0|1,0,0]=3 2344 B10R1.113 C[C@H](N)c1cccc(Br)n1 Amb27392104 [0,1,1,0,0,0|2,0,0]=4 2345 B10R1.113 C[C@H](N)c1cccc(Cl)n1 Amb27859657 [0,1,1,0,0,0|2,0,0]=4 2346 B10R1.113 C[C@H](N)c1cccc(F)c1 Amb16233879 [0,1,1,0,0,0|1,0,0]=3 2347 B10R1.113 C[C@H](N)c1cccc(F)c1 Amb6893459 [0,1,1,0,0,0|1,0,0]=3 2348 B10R1.113 C[C@H](N)c1cccc(F)n1 Amb33871608 [0,1,1,0,0,0|2,0,0]=4 2349 B10R1.113 C[C@H](N)c1cccc(N)c1 Amb22169653 [0,1,1,0,0,0|1,0,0]=3 2350 B10R1.113 C[C@H](N)c1cccc(O)c1 Amb2699151 [0,1,1,0,0,0|1,0,0]=3 2351 B10R1.113 C[C@H](N)c1cccc(O)n1 Amb27204201 [0,1,1,0,0,0|2,0,0]=4 2352 B10R1.113 C[C@H](N)c1ccnc(Cl)c1 Amb19889552 [0,1,1,0,0,0|2,0,0]=4 2353 B10R1.113 C[C@H](N)c1ccnc(Cl)c1 Amb28290935 [0,1,1,0,0,0|2,0,0]=4 2354 B10R1.113 C[C@H](N)c1ccnc(F)c1 Amb26603816 [0,1,1,0,0,0|2,0,0]=4 2355 B10R1.113 C[C@H](N)c1ccnc(N)c1 Amb27950164 [0,1,1,0,0,0|2,0,0]=4 2356 B10R1.113 C[C@H](N)c1ccnc(O)c1 Amb27860345 [0,1,1,0,0,0|2,0,0]=4 2357 B10R1.113 C[C@H](N)c1cncc(Br)c1 Amb25137770 [0,1,1,0,0,0|2,0,0]=4 2358 B10R1.113 C[C@H](N)c1cncc(Br)c1 Amb33802011 [0,1,1,0,0,0|2,0,0]=4 2359 B10R1.113 C[C@H](N)c1cncc(Cl)c1 Amb26347305 [0,1,1,0,0,0|2,0,0]=4 2360 B10R1.113 C[C@H](N)c1cncc(F)c1 Amb24586948 [0,1,1,0,0,0|2,0,0]=4 2361 B10R1.113 C[C@H](N)c1cncc(F)c1 Amb33872490 [0,1,1,0,0,0|2,0,0]=4 2362 B10R1.113 C[C@H](N)c1cncc(I)c1 Amb27599793 [0,1,1,0,0,0|2,0,0]=4 2363 B10R1.113 C[C@H](O)c1cc(Cl)ccn1 Amb24532091 [0,1,1,0,0,0|1,0,0]=3 2364 B10R1.113 C[C@H](O)c1cc(F)ccn1 Amb33414992 [0,1,1,0,0,0|1,0,0]=3 2365 B10R1.113 C[C@H](O)c1cccc(Br)c1 Amb8517112 [0,1,1,0,0,0|0,0,0]=2 2366 B10R1.113 C[C@H](O)c1cccc(Br)n1 Amb27494884 [0,1,1,0,0,0|1,0,0]=3 2367 B10R1.113 C[C@H](O)c1cccc(Cl)c1 Amb6893497 [0,1,1,0,0,0|0,0,0]=2 2368 B10R1.113 C[C@H](O)c1cccc(Cl)n1 Amb33223315 [0,1,1,0,0,0|1,0,0]=3 2369 B10R1.113 C[C@H](O)c1cccc(F)c1 Amb6893457 [0,1,1,0,0,0|0,0,0]=2 2370 B10R1.113 C[C@H](O)c1cccc(N)c1 Amb26603790 [0,1,1,0,0,0|0,0,0]=2 2371 B10R1.113 C[C@H](O)c1cccc(O)c1 Amb13952963 [0,1,1,0,0,0|0,0,0]=2 2372 B10R1.113 C[C@H](O)c1ccnc(Br)c1 Amb28286935 [0,1,1,0,0,0|1,0,0]=3 2373 B10R1.113 C[C@H](O)c1ccnc(Cl)c1 Amb26577007 [0,1,1,0,0,0|1,0,0]=3 2374 B10R1.113 C[C@H](O)c1ccnc(N)n1 Amb27815221 [0,1,1,0,0,0|2,0,0]=4 2375 B10R1.113 C[C@H](O)c1cncc(Br)c1 Amb24461161 [0,1,1,0,0,0|1,0,0]=3 2376 B10R1.113 C[C@H](O)c1cncc(Cl)c1 Amb27797522 [0,1,1,0,0,0|1,0,0]=3 2377 B10R1.113 C[C@H](O)c1cncc(F)c1 Amb28319675 [0,1,1,0,0,0|1,0,0]=3 2378 B10R1.113 C[NH+](C)c1cccc([NH3+])c1 Amb6365951 [0,1,1,0,0,0|2,0,0]=4 2379 B10R1.113 C[SiH](C)c1cccc(F)c1 Amb28075703 [0,1,1,0,0,0|1,1,0]=4 2380 B10R1.113 C[SiH](C)c1cccc(O)c1 Amb28122051 [0,1,1,0,0,0|1,1,0]=4 2381 B10R1.113 Cc1cc(C(C)C)ccn1 Amb27975410 [0,1,1,0,0,0|2,0,0]=4 2382 B10R1.113 Cc1cc(C(C)N)ccn1 Amb18832438 [0,1,1,0,0,0|2,0,0]=4 2383 B10R1.113 Cc1cc(C(C)O)ccn1 Amb24410724 [0,1,1,0,0,0|1,0,0]=3 2384 B10R1.113 Cc1cc([C@@H](C)N)ccn1 Amb27817866 [0,1,1,0,0,0|2,0,0]=4 2385 B10R1.113 Cc1cc([C@@H](C)O)ccn1 Amb33268639 [0,1,1,0,0,0|1,0,0]=3 2386 B10R1.113 Cc1cc([C@H](C)N)ccn1 Amb28282725 [0,1,1,0,0,0|2,0,0]=4 2387 B10R1.113 Cc1cc([C@H](C)O)ccn1 Amb33268657 [0,1,1,0,0,0|1,0,0]=3 2388 B10R1.113 Cc1cccc(B(O)O)c1 Amb22044323 [0,1,1,0,0,0|2,0,0]=4 2389 B10R1.113 Cc1cccc(B(O)O)c1 Amb2447082 [0,1,1,0,0,0|2,0,0]=4 2390 B10R1.113 Cc1cccc(C(=O)O)c1 Amb2609027 [0,1,1,0,0,0|1,0,1]=4 2391 B10R1.113 Cc1cccc(C(C)Br)c1 Amb18311397 [0,1,1,0,0,0|1,0,0]=3 2392 B10R1.113 Cc1cccc(C(C)C)c1 Amb9787713 [0,1,1,0,0,0|1,0,0]=3 2393 B10R1.113 Cc1cccc(C(C)C)n1 Amb28066569 [0,1,1,0,0,0|2,0,0]=4 2394 B10R1.113 Cc1cccc(C(C)Cl)c1 Amb18787553 [0,1,1,0,0,0|1,0,0]=3 2395 B10R1.113 Cc1cccc(C(C)N)c1 Amb33532598 [0,1,1,0,0,0|1,0,0]=3 2396 B10R1.113 Cc1cccc(C(C)N)c1 Amb33552107 [0,1,1,0,0,0|1,0,0]=3 2397 B10R1.113 Cc1cccc(C(C)N)n1 Amb10608358 [0,1,1,0,0,0|2,0,0]=4 2398 B10R1.113 Cc1cccc(C(C)N)n1 Amb32666372 [0,1,1,0,0,0|2,0,0]=4 2399 B10R1.113 Cc1cccc(C(C)O)c1 Amb33527067 [0,1,1,0,0,0|0,0,0]=2 2400 B10R1.113 Cc1cccc(C(C)O)n1 Amb24529239 [0,1,1,0,0,0|1,0,0]=3 2401 B10R1.113 Cc1cccc(C(C)S)c1 Amb18787459 [0,1,1,0,0,0|0,1,0]=3 2402 B10R1.113 Cc1cccc(C(Cl)Cl)c1 Amb8387744 [0,1,1,0,0,0|2,0,0]=4 2403 B10R1.113 Cc1cccc(C(O)=S)c1 Amb24535989 [0,1,1,0,0,0|1,0,1]=4 2404 B10R1.113 Cc1cccc(N(C)N)c1 Amb2618583 [0,1,1,0,0,0|2,0,0]=4 2405 B10R1.113 Cc1cccc(S(=O)O)c1 Amb18563469 [0,1,1,0,0,0|2,0,0]=4 2406 B10R1.113 Cc1cccc(S(C)=O)c1 Amb19892225 [0,1,1,0,0,0|1,0,1]=4 2407 B10R1.113 Cc1cccc([C@@H](C)N)c1 Amb22288648 [0,1,1,0,0,0|1,0,0]=3 2408 B10R1.113 Cc1cccc([C@@H](C)N)c1 Amb22744913 [0,1,1,0,0,0|1,0,0]=3 2409 B10R1.113 Cc1cccc([C@@H](C)N)n1 Amb24377656 [0,1,1,0,0,0|2,0,0]=4 2410 B10R1.113 Cc1cccc([C@@H](C)N)n1 Amb32658024 [0,1,1,0,0,0|2,0,0]=4 2411 B10R1.113 Cc1cccc([C@@H](C)O)c1 Amb24476868 [0,1,1,0,0,0|0,0,0]=2 2412 B10R1.113 Cc1cccc([C@@H](C)O)n1 Amb24684857 [0,1,1,0,0,0|1,0,0]=3 2413 B10R1.113 Cc1cccc([C@H](C)N)c1 Amb16233866 [0,1,1,0,0,0|1,0,0]=3 2414 B10R1.113 Cc1cccc([C@H](C)N)c1 Amb22504241 [0,1,1,0,0,0|1,0,0]=3 2415 B10R1.113 Cc1cccc([C@H](C)N)n1 Amb26509683 [0,1,1,0,0,0|2,0,0]=4 2416 B10R1.113 Cc1cccc([C@H](C)O)c1 Amb25335556 [0,1,1,0,0,0|0,0,0]=2 2417 B10R1.113 Cc1cccc([C@H](C)O)n1 Amb24105803 [0,1,1,0,0,0|1,0,0]=3 2418 B10R1.113 Cc1ccnc(C(C)N)c1 Amb10608299 [0,1,1,0,0,0|2,0,0]=4 2419 B10R1.113 Cc1ccnc(C(C)N)c1 Amb21959650 [0,1,1,0,0,0|2,0,0]=4 2420 B10R1.113 Cc1ccnc(C(C)O)c1 Amb26316565 [0,1,1,0,0,0|1,0,0]=3 2421 B10R1.113 Cc1ccnc([C@@H](C)N)c1 Amb24428657 [0,1,1,0,0,0|2,0,0]=4 2422 B10R1.113 Cc1ccnc([C@@H](C)O)c1 Amb26639178 [0,1,1,0,0,0|1,0,0]=3 2423 B10R1.113 Cc1ccnc([C@H](C)N)c1 Amb27259048 [0,1,1,0,0,0|2,0,0]=4 2424 B10R1.113 Cc1ccnc([C@H](C)O)c1 Amb26605542 [0,1,1,0,0,0|1,0,0]=3 2425 B10R1.113 Cc1cncc(C(C)Cl)c1 Amb28187176 [0,1,1,0,0,0|2,0,0]=4 2426 B10R1.113 Cc1cncc(C(C)N)c1 Amb25945244 [0,1,1,0,0,0|2,0,0]=4 2427 B10R1.113 Cc1cncc(C(C)O)c1 Amb27179832 [0,1,1,0,0,0|1,0,0]=3 2428 B10R1.113 Cc1cncc(C(O)Cl)c1 Amb16231969 [0,1,1,0,0,0|2,0,0]=4 2429 B10R1.113 Cc1cncc([C@@H](C)N)c1 Amb26348973 [0,1,1,0,0,0|2,0,0]=4 2430 B10R1.113 Cc1cncc([C@@H](C)O)c1 Amb33318326 [0,1,1,0,0,0|1,0,0]=3 2431 B10R1.113 Cc1cncc([C@H](C)N)c1 Amb27815013 [0,1,1,0,0,0|2,0,0]=4 2432 B10R1.113 Cc1cncc([C@H](C)O)c1 Amb33374479 [0,1,1,0,0,0|1,0,0]=3 2433 B10R1.113 Clc1cccc(C(Cl)Cl)c1 Amb8515613 [0,1,1,0,0,0|2,0,0]=4 2434 B10R1.113 FC(F)c1cccc(Br)c1 Amb2691924 [0,1,1,0,0,0|2,0,0]=4 2435 B10R1.113 FC(F)c1cccc(Cl)c1 Amb24663599 [0,1,1,0,0,0|2,0,0]=4 2436 B10R1.113 FC(F)c1cccc(I)c1 Amb22174146 [0,1,1,0,0,0|2,0,0]=4 2437 B10R1.113 Fc1cccc(C(Br)Br)c1 Amb8515065 [0,1,1,0,0,0|2,0,0]=4 2438 B10R1.113 Fc1cccc(C(Cl)Cl)c1 Amb10839619 [0,1,1,0,0,0|2,0,0]=4 2439 B10R1.113 Fc1cccc(C(F)F)c1 Amb2691622 [0,1,1,0,0,0|2,0,0]=4 2440 B10R1.113 Nc1cccc(B(O)O)c1 Amb17672010 [0,1,1,0,0,0|2,0,0]=4 2441 B10R1.113 Nc1cccc(B(O)O)c1 Amb2447084 [0,1,1,0,0,0|2,0,0]=4 2442 B10R1.113 Nc1cccc(B(O)O)c1 Amb2455755 [0,1,1,0,0,0|2,0,0]=4 2443 B10R1.113 Nc1cccc(B(O)O)c1 Amb2722482 [0,1,1,0,0,0|2,0,0]=4 2444 B10R1.113 Nc1cccc(B(O)O)c1 Amb8517341 [0,1,1,0,0,0|2,0,0]=4 2445 B10R1.113 Nc1cccc(C(=O)O)c1 Amb1935166 [0,1,1,0,0,0|1,0,1]=4 2446 B10R1.113 Nc1cccc(C(F)F)c1 Amb13952375 [0,1,1,0,0,0|2,0,0]=4 2447 B10R1.113 Nc1cccc(C(F)F)c1 Amb19894459 [0,1,1,0,0,0|2,0,0]=4 2448 B10R1.113 Nc1cccc([PH](=O)O)c1 Amb27823374 [0,1,1,0,0,0|2,0,0]=4 2449 B10R1.113 O=C(O)c1cccc(Br)c1 Amb264315 [0,1,1,0,0,0|1,0,1]=4 2450 B10R1.113 O=C(O)c1cccc(Cl)c1 Amb2223069 [0,1,1,0,0,0|1,0,1]=4 2451 B10R1.113 O=C(O)c1cccc(F)c1 Amb2688023 [0,1,1,0,0,0|1,0,1]=4 2452 B10R1.113 O=C(O)c1cccc(F)c1 Amb33513022 [0,1,1,0,0,0|1,0,1]=4 2453 B10R1.113 O=C(O)c1cccc(I)c1 Amb6456607 [0,1,1,0,0,0|1,0,1]=4 2454 B10R1.113 O=C(O)c1cccc(O)c1 Amb1208301 [0,1,1,0,0,0|1,0,1]=4 2455 B10R1.113 O=C(O)c1cccc(S)c1 Amb5721847 [0,1,1,0,0,0|1,0,1]=4 2456 B10R1.113 O=S(O)c1cccc(Cl)c1 Amb18564048 [0,1,1,0,0,0|2,0,0]=4 2457 B10R1.113 O=S(O)c1cccc(F)c1 Amb25263422 [0,1,1,0,0,0|2,0,0]=4 2458 B10R1.113 OB(O)c1cccc(Br)c1 Amb2447244 [0,1,1,0,0,0|2,0,0]=4 2459 B10R1.113 OB(O)c1cccc(Cl)c1 Amb2383485 [0,1,1,0,0,0|2,0,0]=4 2460 B10R1.113 OB(O)c1cccc(F)c1 Amb2383489 [0,1,1,0,0,0|2,0,0]=4 2461 B10R1.113 OB(O)c1cccc(I)c1 Amb2722528 [0,1,1,0,0,0|2,0,0]=4 2462 B10R1.113 OB(O)c1cccc(O)c1 Amb2447025 [0,1,1,0,0,0|2,0,0]=4 2463 B10R1.113 OB(O)c1cccc(S)c1 Amb2447106 [0,1,1,0,0,0|2,0,0]=4 2464 B10R1.113 Oc1cccc(C(F)F)c1 Amb22174147 [0,1,1,0,0,0|2,0,0]=4 2465 B10R1.113 [NH3+]c1cccc(C(=O)O)c1 Amb6365978 [0,1,1,0,0,0|1,0,1]=4 2466 B10R1.1 BrCCc1ccc(Br)cc1 Amb6296138 [0,1,1,0,0,0|1,0,0]=3 2467 B10R1.1 BrCCc1ccc(Br)cn1 Amb25187280 [0,1,1,0,0,0|2,0,0]=4 2468 B10R1.1 BrCCc1ccc(Br)nc1 Amb25941323 [0,1,1,0,0,0|2,0,0]=4 2469 B10R1.1 Br[Zn]Cc1ccc(Br)cc1 Amb22000432 [0,1,1,0,0,0|2,0,0]=4 2470 B10R1.1 Brc1ccc(CCI)cc1 Amb22002540 [0,1,1,0,0,0|1,0,0]=3 2471 B10R1.1 C#CCc1ccc(Br)cc1 Amb26366342 [0,1,1,0,0,0|1,0,1]=4 2472 B10R1.1 C#CCc1ccc(C)cc1 Amb33359821 [0,1,1,0,0,0|1,0,1]=4 2473 B10R1.1 C#CCc1ccc(Cl)cc1 Amb26067166 [0,1,1,0,0,0|1,0,1]=4 2474 B10R1.1 C#CCc1ccc(F)cc1 Amb25679386 [0,1,1,0,0,0|1,0,1]=4 2475 B10R1.1 C#CCc1ccc(I)cc1 Amb25921305 [0,1,1,0,0,0|1,0,1]=4 2476 B10R1.1 C#CCc1ccc(N)cc1 Amb26455672 [0,1,1,0,0,0|1,0,1]=4 2477 B10R1.1 C#CCc1ccc(O)cc1 Amb33079384 [0,1,1,0,0,0|1,0,1]=4 2478 B10R1.1 C#NCc1ccc(Br)cc1 Amb31112143 [0,1,1,0,0,0|1,0,1]=4 2479 B10R1.1 C#NCc1ccc(C)cc1 Amb31132460 [0,1,1,0,0,0|1,0,1]=4 2480 B10R1.1 C#NCc1ccc(Cl)cc1 Amb31111984 [0,1,1,0,0,0|1,0,1]=4 2481 B10R1.1 C#NCc1ccc(F)cc1 Amb31132462 [0,1,1,0,0,0|1,0,1]=4 2482 B10R1.1 C=CCc1ccc(Br)cc1 Amb6298955 [0,1,1,0,0,0|1,0,1]=4 2483 B10R1.1 C=CCc1ccc(C)cc1 Amb6298999 [0,1,1,0,0,0|1,0,1]=4 2484 B10R1.1 C=CCc1ccc(Cl)cc1 Amb6298977 [0,1,1,0,0,0|1,0,1]=4 2485 B10R1.1 C=CCc1ccc(F)cc1 Amb6299104 [0,1,1,0,0,0|1,0,1]=4 2486 B10R1.1 C=CCc1ccc(N)cc1 Amb27168671 [0,1,1,0,0,0|1,0,1]=4 2487 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [0,1,1,0,0,0|1,0,1]=4 2488 B10R1.1 CC#Cc1ccc(Br)cc1 Amb24524445 [0,1,1,0,0,0|1,0,1]=4 2489 B10R1.1 CC#Cc1ccc(Cl)cc1 Amb27199822 [0,1,1,0,0,0|1,0,1]=4 2490 B10R1.1 CCC[n+]1ccc(C)cc1 Amb28046442 [0,1,1,0,0,0|2,0,0]=4 2491 B10R1.1 CCCc1ccc(Br)cc1 Amb3939169 [0,1,1,0,0,0|1,0,0]=3 2492 B10R1.1 CCCc1ccc(Br)cn1 Amb24321438 [0,1,1,0,0,0|2,0,0]=4 2493 B10R1.1 CCCc1ccc(Br)nc1 Amb10600786 [0,1,1,0,0,0|2,0,0]=4 2494 B10R1.1 CCCc1ccc(C)cc1 Amb22227992 [0,1,1,0,0,0|1,0,0]=3 2495 B10R1.1 CCCc1ccc(C)cn1 Amb25985406 [0,1,1,0,0,0|2,0,0]=4 2496 B10R1.1 CCCc1ccc(F)cc1 Amb10845722 [0,1,1,0,0,0|1,0,0]=3 2497 B10R1.1 CCCc1ccc(I)cc1 Amb8976891 [0,1,1,0,0,0|1,0,0]=3 2498 B10R1.1 CCCc1ccc(N)cc1 Amb2721145 [0,1,1,0,0,0|1,0,0]=3 2499 B10R1.1 CCCc1ccc(N)cn1 Amb10600808 [0,1,1,0,0,0|2,0,0]=4 2500 B10R1.1 CCCc1ccc(N)nc1 Amb10600788 [0,1,1,0,0,0|2,0,0]=4 2501 B10R1.1 CCCc1ccc(O)cc1 Amb3939332 [0,1,1,0,0,0|1,0,0]=3 2502 B10R1.1 CCCc1ccc(O)cn1 Amb10553035 [0,1,1,0,0,0|2,0,0]=4 2503 B10R1.1 CCCc1ccc(O)nc1 Amb10600789 [0,1,1,0,0,0|2,0,0]=4 2504 B10R1.1 CCCc1ccc(S)cc1 Amb2690418 [0,1,1,0,0,0|1,0,0]=3 2505 B10R1.1 CCNc1ccc(Br)cc1 Amb19959109 [0,1,1,0,0,0|2,0,0]=4 2506 B10R1.1 CCNc1ccc(Br)cc1 Amb4313300 [0,1,1,0,0,0|2,0,0]=4 2507 B10R1.1 CCNc1ccc(C)cc1 Amb4313293 [0,1,1,0,0,0|2,0,0]=4 2508 B10R1.1 CCNc1ccc(Cl)cc1 Amb32752525 [0,1,1,0,0,0|2,0,0]=4 2509 B10R1.1 CCNc1ccc(Cl)cc1 Amb4018546 [0,1,1,0,0,0|2,0,0]=4 2510 B10R1.1 CCNc1ccc(F)cc1 Amb1214999 [0,1,1,0,0,0|2,0,0]=4 2511 B10R1.1 CCNc1ccc(F)cc1 Amb33189232 [0,1,1,0,0,0|2,0,0]=4 2512 B10R1.1 CCNc1ccc(N)cc1 Amb33551705 [0,1,1,0,0,0|2,0,0]=4 2513 B10R1.1 CCNc1ccc(N)cc1 Amb7767528 [0,1,1,0,0,0|2,0,0]=4 2514 B10R1.1 CCNc1ccc(O)cc1 Amb28555423 [0,1,1,0,0,0|2,0,0]=4 2515 B10R1.1 CCNc1ccc(O)cc1 Amb9608869 [0,1,1,0,0,0|2,0,0]=4 2516 B10R1.1 CCNc1ccc(S)cc1 Amb27242310 [0,1,1,0,0,0|2,0,0]=4 2517 B10R1.1 CCOc1ccc(Br)cc1 Amb2691855 [0,1,1,0,0,0|2,0,0]=4 2518 B10R1.1 CCOc1ccc(C)cc1 Amb4016279 [0,1,1,0,0,0|2,0,0]=4 2519 B10R1.1 CCOc1ccc(Cl)cc1 Amb2793039 [0,1,1,0,0,0|2,0,0]=4 2520 B10R1.1 CCOc1ccc(F)cc1 Amb2688289 [0,1,1,0,0,0|2,0,0]=4 2521 B10R1.1 CCOc1ccc(I)cc1 Amb6296147 [0,1,1,0,0,0|2,0,0]=4 2522 B10R1.1 CCOc1ccc(N)cc1 Amb1235495 [0,1,1,0,0,0|2,0,0]=4 2523 B10R1.1 CCOc1ccc(N)cc1 Amb32644735 [0,1,1,0,0,0|2,0,0]=4 2524 B10R1.1 CCOc1ccc(N)cc1 Amb6383245 [0,1,1,0,0,0|2,0,0]=4 2525 B10R1.1 CCOc1ccc(O)cc1 Amb1808385 [0,1,1,0,0,0|2,0,0]=4 2526 B10R1.1 CCOc1ccc(S)cc1 Amb459607 [0,1,1,0,0,0|2,0,0]=4 2527 B10R1.1 CCSc1ccc(Br)cc1 Amb3939596 [0,1,1,0,0,0|2,0,0]=4 2528 B10R1.1 CCSc1ccc(C)cc1 Amb3542302 [0,1,1,0,0,0|2,0,0]=4 2529 B10R1.1 CCSc1ccc(F)cc1 Amb24621814 [0,1,1,0,0,0|2,0,0]=4 2530 B10R1.1 CCSc1ccc(N)cc1 Amb13949222 [0,1,1,0,0,0|2,0,0]=4 2531 B10R1.1 CCSc1ccc(N)cc1 Amb2099645 [0,1,1,0,0,0|2,0,0]=4 2532 B10R1.1 CCSc1ccc(O)cc1 Amb17202382 [0,1,1,0,0,0|2,0,0]=4 2533 B10R1.1 CCSc1ccc(S)cc1 Amb2687964 [0,1,1,0,0,0|2,0,0]=4 2534 B10R1.1 CNCC1=CNC(=O)C=C1 Amb29083367 [0,1,1,0,0,0|2,0,0]=4 2535 B10R1.1 CNCc1ccc(Br)cc1 Amb1209641 [0,1,1,0,0,0|1,0,0]=3 2536 B10R1.1 CNCc1ccc(Br)cc1 Amb17739893 [0,1,1,0,0,0|1,0,0]=3 2537 B10R1.1 CNCc1ccc(Br)cn1 Amb6572443 [0,1,1,0,0,0|2,0,0]=4 2538 B10R1.1 CNCc1ccc(Br)nc1 Amb21861666 [0,1,1,0,0,0|2,0,0]=4 2539 B10R1.1 CNCc1ccc(C)cc1 Amb1241142 [0,1,1,0,0,0|1,0,0]=3 2540 B10R1.1 CNCc1ccc(C)cc1 Amb8503283 [0,1,1,0,0,0|1,0,0]=3 2541 B10R1.1 CNCc1ccc(C)cn1 Amb33547339 [0,1,1,0,0,0|2,0,0]=4 2542 B10R1.1 CNCc1ccc(C)nc1 Amb29848183 [0,1,1,0,0,0|2,0,0]=4 2543 B10R1.1 CNCc1ccc(C)nc1 Amb8853680 [0,1,1,0,0,0|2,0,0]=4 2544 B10R1.1 CNCc1ccc(Cl)cc1 Amb1648458 [0,1,1,0,0,0|1,0,0]=3 2545 B10R1.1 CNCc1ccc(Cl)cc1 Amb17935917 [0,1,1,0,0,0|1,0,0]=3 2546 B10R1.1 CNCc1ccc(Cl)cn1 Amb22500681 [0,1,1,0,0,0|2,0,0]=4 2547 B10R1.1 CNCc1ccc(Cl)nc1 Amb19893050 [0,1,1,0,0,0|2,0,0]=4 2548 B10R1.1 CNCc1ccc(Cl)nc1 Amb6892240 [0,1,1,0,0,0|2,0,0]=4 2549 B10R1.1 CNCc1ccc(F)cc1 Amb1105922 [0,1,1,0,0,0|1,0,0]=3 2550 B10R1.1 CNCc1ccc(F)cc1 Amb9677313 [0,1,1,0,0,0|1,0,0]=3 2551 B10R1.1 CNCc1ccc(F)cn1 Amb25294948 [0,1,1,0,0,0|2,0,0]=4 2552 B10R1.1 CNCc1ccc(F)nc1 Amb24062505 [0,1,1,0,0,0|2,0,0]=4 2553 B10R1.1 CNCc1ccc(N)cc1 Amb2691278 [0,1,1,0,0,0|1,0,0]=3 2554 B10R1.1 CNCc1ccc(N)cn1 Amb28050288 [0,1,1,0,0,0|2,0,0]=4 2555 B10R1.1 CNCc1ccc(N)nc1 Amb23446332 [0,1,1,0,0,0|2,0,0]=4 2556 B10R1.1 CNCc1ccc(N)nc1 Amb35750125 [0,1,1,0,0,0|2,0,0]=4 2557 B10R1.1 CNCc1ccc(O)cc1 Amb1116278 [0,1,1,0,0,0|1,0,0]=3 2558 B10R1.1 CNCc1ccc(O)cc1 Amb7969770 [0,1,1,0,0,0|1,0,0]=3 2559 B10R1.1 CNCc1ccc(O)cc1 Amb8428171 [0,1,1,0,0,0|1,0,0]=3 2560 B10R1.1 CNCc1ccc(O)nc1 Amb23446663 [0,1,1,0,0,0|2,0,0]=4 2561 B10R1.1 CNCc1ccc(S)cc1 Amb28079262 [0,1,1,0,0,0|1,0,0]=3 2562 B10R1.1 COCC1=CNC(=O)C=C1 Amb27476354 [0,1,1,0,0,0|1,0,0]=3 2563 B10R1.1 COCc1ccc(Br)cc1 Amb18320178 [0,1,1,0,0,0|0,0,0]=2 2564 B10R1.1 COCc1ccc(Br)cn1 Amb24320752 [0,1,1,0,0,0|1,0,0]=3 2565 B10R1.1 COCc1ccc(Br)nc1 Amb20618626 [0,1,1,0,0,0|1,0,0]=3 2566 B10R1.1 COCc1ccc(Cl)cc1 Amb22497336 [0,1,1,0,0,0|0,0,0]=2 2567 B10R1.1 COCc1ccc(Cl)cn1 Amb27171300 [0,1,1,0,0,0|1,0,0]=3 2568 B10R1.1 COCc1ccc(Cl)nc1 Amb6247901 [0,1,1,0,0,0|1,0,0]=3 2569 B10R1.1 COCc1ccc(Cl)nn1 Amb20618692 [0,1,1,0,0,0|2,0,0]=4 2570 B10R1.1 COCc1ccc(Cl)nn1 Amb22274068 [0,1,1,0,0,0|2,0,0]=4 2571 B10R1.1 COCc1ccc(I)cc1 Amb22234050 [0,1,1,0,0,0|0,0,0]=2 2572 B10R1.1 COCc1ccc(N)cc1 Amb1137167 [0,1,1,0,0,0|0,0,0]=2 2573 B10R1.1 COCc1ccc(N)cn1 Amb27645328 [0,1,1,0,0,0|1,0,0]=3 2574 B10R1.1 COCc1ccc(O)cc1 Amb3939459 [0,1,1,0,0,0|0,0,0]=2 2575 B10R1.1 COCc1ccc(O)cn1 Amb24664312 [0,1,1,0,0,0|1,0,0]=3 2576 B10R1.1 COCc1ccc(S)cc1 Amb19149369 [0,1,1,0,0,0|0,0,0]=2 2577 B10R1.1 COCc1cnc(Br)cn1 Amb24323046 [0,1,1,0,0,0|2,0,0]=4 2578 B10R1.1 COCc1cnc(C)cn1 Amb27410529 [0,1,1,0,0,0|2,0,0]=4 2579 B10R1.1 COCc1cnc(Cl)nc1 Amb23399933 [0,1,1,0,0,0|2,0,0]=4 2580 B10R1.1 COCc1ncc(Br)cn1 Amb24753905 [0,1,1,0,0,0|2,0,0]=4 2581 B10R1.1 COCc1ncc(N)cn1 Amb17486553 [0,1,1,0,0,0|2,0,0]=4 2582 B10R1.1 COCc1ncc(O)cn1 Amb27804271 [0,1,1,0,0,0|2,0,0]=4 2583 B10R1.1 CON=C1C=CC(=O)C=C1 Amb3482963 [0,1,1,0,0,0|1,0,0]=3 2584 B10R1.1 CSCc1ccc(Br)cc1 Amb19373540 [0,1,1,0,0,0|0,1,0]=3 2585 B10R1.1 CSCc1ccc(Br)cn1 Amb27827358 [0,1,1,0,0,0|1,1,0]=4 2586 B10R1.1 CSCc1ccc(C)cc1 Amb16185125 [0,1,1,0,0,0|0,1,0]=3 2587 B10R1.1 CSCc1ccc(C)nc1 Amb28194917 [0,1,1,0,0,0|1,1,0]=4 2588 B10R1.1 CSCc1ccc(Cl)cc1 Amb4013182 [0,1,1,0,0,0|0,1,0]=3 2589 B10R1.1 CSCc1ccc(Cl)nc1 Amb15701444 [0,1,1,0,0,0|1,1,0]=4 2590 B10R1.1 CSCc1ccc(F)cc1 Amb27162448 [0,1,1,0,0,0|0,1,0]=3 2591 B10R1.1 CSCc1ccc(F)cn1 Amb28292082 [0,1,1,0,0,0|1,1,0]=4 2592 B10R1.1 CSCc1ccc(I)cc1 Amb25799869 [0,1,1,0,0,0|0,1,0]=3 2593 B10R1.1 CSCc1ccc(N)cc1 Amb18544980 [0,1,1,0,0,0|0,1,0]=3 2594 B10R1.1 CSCc1ccc(N)cn1 Amb35588880 [0,1,1,0,0,0|1,1,0]=4 2595 B10R1.1 CSCc1ccc(N)nc1 Amb18284372 [0,1,1,0,0,0|1,1,0]=4 2596 B10R1.1 C[n+]1ccc(CCF)cc1 Amb28197546 [0,1,1,0,0,0|2,0,0]=4 2597 B10R1.1 C\C=C\c1ccc(Br)cc1 Amb34050082 [0,1,1,0,0,0|1,0,1]=4 2598 B10R1.1 C\C=C\c1ccc(N)cc1 Amb26370017 [0,1,1,0,0,0|1,0,1]=4 2599 B10R1.1 C\C=C\c1ccc(N)cc1 Amb32653072 [0,1,1,0,0,0|1,0,1]=4 2600 B10R1.1 C\C=N\c1ccc(Cl)cc1 Amb27173616 [0,1,1,0,0,0|2,0,0]=4 2601 B10R1.1 C\N=C\c1ccc(Cl)cc1 Amb26890786 [0,1,1,0,0,0|1,0,1]=4 2602 B10R1.1 Cc1cc[n+](CCF)cc1 Amb27396575 [0,1,1,0,0,0|2,0,0]=4 2603 B10R1.1 Cc1ccc(CC#N)cc1 Amb6251339 [0,1,1,0,0,0|1,0,1]=4 2604 B10R1.1 Cc1ccc(CC=O)cc1 Amb3941002 [0,1,1,0,0,0|0,0,2]=4 2605 B10R1.1 Cc1ccc(CCBr)cc1 Amb2685165 [0,1,1,0,0,0|1,0,0]=3 2606 B10R1.1 Cc1ccc(CCBr)cn1 Amb24066233 [0,1,1,0,0,0|2,0,0]=4 2607 B10R1.1 Cc1ccc(CCBr)cn1 Amb35789293 [0,1,1,0,0,0|2,0,0]=4 2608 B10R1.1 Cc1ccc(CCBr)nc1 Amb27489433 [0,1,1,0,0,0|2,0,0]=4 2609 B10R1.1 Cc1ccc(CCCl)cc1 Amb9004312 [0,1,1,0,0,0|1,0,0]=3 2610 B10R1.1 Cc1ccc(CCCl)cn1 Amb24658933 [0,1,1,0,0,0|2,0,0]=4 2611 B10R1.1 Cc1ccc(CCI)cc1 Amb25096362 [0,1,1,0,0,0|1,0,0]=3 2612 B10R1.1 Cc1ccc(CCI)cn1 Amb28255765 [0,1,1,0,0,0|2,0,0]=4 2613 B10R1.1 Cc1ccc(CCI)nc1 Amb28195751 [0,1,1,0,0,0|2,0,0]=4 2614 B10R1.1 Cc1ccc(CCN)cc1 Amb1129454 [0,1,1,0,0,0|1,0,0]=3 2615 B10R1.1 Cc1ccc(CCN)cc1 Amb19261118 [0,1,1,0,0,0|1,0,0]=3 2616 B10R1.1 Cc1ccc(CCN)cn1 Amb10610554 [0,1,1,0,0,0|2,0,0]=4 2617 B10R1.1 Cc1ccc(CCN)nc1 Amb24065042 [0,1,1,0,0,0|2,0,0]=4 2618 B10R1.1 Cc1ccc(CCN)nc1 Amb32663333 [0,1,1,0,0,0|2,0,0]=4 2619 B10R1.1 Cc1ccc(CCN)nc1 Amb8386308 [0,1,1,0,0,0|2,0,0]=4 2620 B10R1.1 Cc1ccc(CCO)cc1 Amb3939097 [0,1,1,0,0,0|0,0,0]=2 2621 B10R1.1 Cc1ccc(CCO)cn1 Amb10603991 [0,1,1,0,0,0|1,0,0]=3 2622 B10R1.1 Cc1ccc(CCO)nc1 Amb2694542 [0,1,1,0,0,0|1,0,0]=3 2623 B10R1.1 Cc1ccc(CCS)cc1 Amb16183304 [0,1,1,0,0,0|0,1,0]=3 2624 B10R1.1 Cc1ccc(CCS)cn1 Amb24583128 [0,1,1,0,0,0|1,1,0]=4 2625 B10R1.1 Cc1ccc(CCS)nc1 Amb26979889 [0,1,1,0,0,0|1,1,0]=4 2626 B10R1.1 Cc1ccc(CNN)cc1 Amb1112560 [0,1,1,0,0,0|2,0,0]=4 2627 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [0,1,1,0,0,0|2,0,0]=4 2628 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [0,1,1,0,0,0|2,0,0]=4 2629 B10R1.1 Cc1ccc(CNO)cc1 Amb25798742 [0,1,1,0,0,0|1,0,0]=3 2630 B10R1.1 Cc1ccc(CNO)cn1 Amb25305252 [0,1,1,0,0,0|2,0,0]=4 2631 B10R1.1 Cc1ccc(CNO)nc1 Amb25145636 [0,1,1,0,0,0|2,0,0]=4 2632 B10R1.1 Cc1ccc(CON)cc1 Amb1946246 [0,1,1,0,0,0|1,0,0]=3 2633 B10R1.1 Cc1ccc(CON)cc1 Amb21929103 [0,1,1,0,0,0|1,0,0]=3 2634 B10R1.1 Cc1ccc(CON)cn1 Amb29856312 [0,1,1,0,0,0|2,0,0]=4 2635 B10R1.1 Cc1ccc(CON)nc1 Amb24383486 [0,1,1,0,0,0|2,0,0]=4 2636 B10R1.1 Cc1ccc(C[Zn]Cl)cc1 Amb22000457 [0,1,1,0,0,0|2,0,0]=4 2637 B10R1.1 Cc1ccc(NCN)cc1 Amb17117016 [0,1,1,0,0,0|2,0,0]=4 2638 B10R1.1 Cc1ccc(SCCl)cc1 Amb2694974 [0,1,1,0,0,0|2,0,0]=4 2639 B10R1.1 Cc1ccc(\C=N\O)cc1 Amb1152459 [0,1,1,0,0,0|1,0,1]=4 2640 B10R1.1 Cc1cnc(CCO)cn1 Amb25077347 [0,1,1,0,0,0|2,0,0]=4 2641 B10R1.1 ClCCc1ccc(Br)cc1 Amb8860568 [0,1,1,0,0,0|1,0,0]=3 2642 B10R1.1 ClCCc1ccc(Br)nc1 Amb27813093 [0,1,1,0,0,0|2,0,0]=4 2643 B10R1.1 ClCCc1ccc(Cl)cc1 Amb9004318 [0,1,1,0,0,0|1,0,0]=3 2644 B10R1.1 ClCCc1ccc(Cl)nc1 Amb25144552 [0,1,1,0,0,0|2,0,0]=4 2645 B10R1.1 ClCOc1ccc(Br)cc1 Amb26369456 [0,1,1,0,0,0|2,0,0]=4 2646 B10R1.1 ClCOc1ccc(Cl)cc1 Amb8513685 [0,1,1,0,0,0|2,0,0]=4 2647 B10R1.1 ClCOc1ccc(I)cc1 Amb26337011 [0,1,1,0,0,0|2,0,0]=4 2648 B10R1.1 ClCSc1ccc(Br)cc1 Amb25237152 [0,1,1,0,0,0|2,0,0]=4 2649 B10R1.1 ClCSc1ccc(Cl)cc1 Amb22351380 [0,1,1,0,0,0|2,0,0]=4 2650 B10R1.1 ClCSc1ccc(I)cc1 Amb26640379 [0,1,1,0,0,0|2,0,0]=4 2651 B10R1.1 Cl[Zn]Cc1ccc(Cl)cc1 Amb22000429 [0,1,1,0,0,0|2,0,0]=4 2652 B10R1.1 Clc1ccc(CCBr)cc1 Amb2685157 [0,1,1,0,0,0|1,0,0]=3 2653 B10R1.1 Clc1ccc(CCBr)cn1 Amb24741687 [0,1,1,0,0,0|2,0,0]=4 2654 B10R1.1 Clc1ccc(CCBr)nc1 Amb26370172 [0,1,1,0,0,0|2,0,0]=4 2655 B10R1.1 FCCc1ccc(Br)cc1 Amb25047426 [0,1,1,0,0,0|1,0,0]=3 2656 B10R1.1 FCOc1ccc(Br)cc1 Amb25918920 [0,1,1,0,0,0|2,0,0]=4 2657 B10R1.1 FCSc1ccc(Br)cc1 Amb27239229 [0,1,1,0,0,0|2,0,0]=4 2658 B10R1.1 Fc1ccc(CCBr)cc1 Amb2685160 [0,1,1,0,0,0|1,0,0]=3 2659 B10R1.1 Fc1ccc(CCBr)cn1 Amb33332987 [0,1,1,0,0,0|2,0,0]=4 2660 B10R1.1 Fc1ccc(CCBr)nc1 Amb33452085 [0,1,1,0,0,0|2,0,0]=4 2661 B10R1.1 Fc1ccc(CCCl)cc1 Amb2685902 [0,1,1,0,0,0|1,0,0]=3 2662 B10R1.1 Fc1ccc(CCI)cc1 Amb28315757 [0,1,1,0,0,0|1,0,0]=3 2663 B10R1.1 Fc1ccc(CCS)cc1 Amb17400005 [0,1,1,0,0,0|0,1,0]=3 2664 B10R1.1 Fc1ccc(CCS)cn1 Amb33425100 [0,1,1,0,0,0|1,1,0]=4 2665 B10R1.1 Fc1ccc(CCS)nc1 Amb33315235 [0,1,1,0,0,0|1,1,0]=4 2666 B10R1.1 Fc1ccc(C[Mg]Cl)cc1 Amb17938181 [0,1,1,0,0,0|2,0,0]=4 2667 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 Amb17938179 [0,1,1,0,0,0|2,0,0]=4 2668 B10R1.1 Fc1ccc(OCCl)cc1 Amb24538040 [0,1,1,0,0,0|2,0,0]=4 2669 B10R1.1 Fc1ccc(SCCl)cc1 Amb26585309 [0,1,1,0,0,0|2,0,0]=4 2670 B10R1.1 N#CCc1ccc(Br)cc1 Amb1130758 [0,1,1,0,0,0|1,0,1]=4 2671 B10R1.1 N#CCc1ccc(Cl)cc1 Amb1883007 [0,1,1,0,0,0|1,0,1]=4 2672 B10R1.1 N#CCc1ccc(F)cc1 Amb1154069 [0,1,1,0,0,0|1,0,1]=4 2673 B10R1.1 N#CCc1ccc(I)cc1 Amb3939808 [0,1,1,0,0,0|1,0,1]=4 2674 B10R1.1 N#CCc1ccc(N)cc1 Amb1215260 [0,1,1,0,0,0|1,0,1]=4 2675 B10R1.1 N#CCc1ccc(N)cc1 Amb6297246 [0,1,1,0,0,0|1,0,1]=4 2676 B10R1.1 N#CCc1ccc(O)cc1 Amb1154109 [0,1,1,0,0,0|1,0,1]=4 2677 B10R1.1 NCCC1=CNC(=O)C=C1 Amb18908312 [0,1,1,0,0,0|2,0,0]=4 2678 B10R1.1 NCCC1=CNC(=O)C=C1 Amb32652914 [0,1,1,0,0,0|2,0,0]=4 2679 B10R1.1 NCCC1=CNC(=O)C=C1 Amb32664228 [0,1,1,0,0,0|2,0,0]=4 2680 B10R1.1 NCCN1C=CC(=O)C=C1 Amb18534867 [0,1,1,0,0,0|2,0,0]=4 2681 B10R1.1 NCCc1cc[n+]([O-])cc1 Amb24471141 [0,1,1,0,0,0|2,0,0]=4 2682 B10R1.1 NCCc1ccc(Br)cc1 Amb10808111 [0,1,1,0,0,0|1,0,0]=3 2683 B10R1.1 NCCc1ccc(Br)cc1 Amb2685385 [0,1,1,0,0,0|1,0,0]=3 2684 B10R1.1 NCCc1ccc(Br)cc1 Amb3938967 [0,1,1,0,0,0|1,0,0]=3 2685 B10R1.1 NCCc1ccc(Br)cn1 Amb22751436 [0,1,1,0,0,0|2,0,0]=4 2686 B10R1.1 NCCc1ccc(Br)nc1 Amb22233813 [0,1,1,0,0,0|2,0,0]=4 2687 B10R1.1 NCCc1ccc(Cl)cc1 Amb1212558 [0,1,1,0,0,0|1,0,0]=3 2688 B10R1.1 NCCc1ccc(Cl)cc1 Amb22497649 [0,1,1,0,0,0|1,0,0]=3 2689 B10R1.1 NCCc1ccc(Cl)cn1 Amb22751421 [0,1,1,0,0,0|2,0,0]=4 2690 B10R1.1 NCCc1ccc(Cl)nc1 Amb19516101 [0,1,1,0,0,0|2,0,0]=4 2691 B10R1.1 NCCc1ccc(Cl)nc1 Amb31308448 [0,1,1,0,0,0|2,0,0]=4 2692 B10R1.1 NCCc1ccc(F)cc1 Amb1215262 [0,1,1,0,0,0|1,0,0]=3 2693 B10R1.1 NCCc1ccc(F)cn1 Amb22899431 [0,1,1,0,0,0|2,0,0]=4 2694 B10R1.1 NCCc1ccc(F)cn1 Amb8011392 [0,1,1,0,0,0|2,0,0]=4 2695 B10R1.1 NCCc1ccc(F)nc1 Amb25678845 [0,1,1,0,0,0|2,0,0]=4 2696 B10R1.1 NCCc1ccc(I)cc1 Amb19516023 [0,1,1,0,0,0|1,0,0]=3 2697 B10R1.1 NCCc1ccc(I)cc1 Amb28555584 [0,1,1,0,0,0|1,0,0]=3 2698 B10R1.1 NCCc1ccc(N)cc1 Amb17772211 [0,1,1,0,0,0|1,0,0]=3 2699 B10R1.1 NCCc1ccc(N)cc1 Amb4037003 [0,1,1,0,0,0|1,0,0]=3 2700 B10R1.1 NCCc1ccc(N)cn1 Amb27469582 [0,1,1,0,0,0|2,0,0]=4 2701 B10R1.1 NCCc1ccc(N)nc1 Amb32434775 [0,1,1,0,0,0|2,0,0]=4 2702 B10R1.1 NCCc1ccc(O)cc1 Amb17778990 [0,1,1,0,0,0|1,0,0]=3 2703 B10R1.1 NCCc1ccc(O)cc1 Amb33540244 [0,1,1,0,0,0|1,0,0]=3 2704 B10R1.1 NCCc1ccc(O)cc1 Amb533726 [0,1,1,0,0,0|1,0,0]=3 2705 B10R1.1 NCCc1ccc(O)cn1 Amb28399086 [0,1,1,0,0,0|2,0,0]=4 2706 B10R1.1 NCCc1ccc(O)cn1 Amb28555567 [0,1,1,0,0,0|2,0,0]=4 2707 B10R1.1 NNCc1ccc(Br)cc1 Amb1114984 [0,1,1,0,0,0|2,0,0]=4 2708 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [0,1,1,0,0,0|2,0,0]=4 2709 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [0,1,1,0,0,0|2,0,0]=4 2710 B10R1.1 NNCc1ccc(Cl)cc1 Amb1121233 [0,1,1,0,0,0|2,0,0]=4 2711 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [0,1,1,0,0,0|2,0,0]=4 2712 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [0,1,1,0,0,0|2,0,0]=4 2713 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [0,1,1,0,0,0|2,0,0]=4 2714 B10R1.1 NNCc1ccc(F)cc1 Amb10841872 [0,1,1,0,0,0|2,0,0]=4 2715 B10R1.1 NNCc1ccc(F)cc1 Amb1112880 [0,1,1,0,0,0|2,0,0]=4 2716 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [0,1,1,0,0,0|2,0,0]=4 2717 B10R1.1 NNCc1ccc(O)cc1 Amb27814030 [0,1,1,0,0,0|2,0,0]=4 2718 B10R1.1 NNCc1ccc(O)cc1 Amb32655872 [0,1,1,0,0,0|2,0,0]=4 2719 B10R1.1 NOCc1ccc(Br)cc1 Amb22234858 [0,1,1,0,0,0|1,0,0]=3 2720 B10R1.1 NOCc1ccc(Br)cc1 Amb8471896 [0,1,1,0,0,0|1,0,0]=3 2721 B10R1.1 NOCc1ccc(Br)cn1 Amb27259228 [0,1,1,0,0,0|2,0,0]=4 2722 B10R1.1 NOCc1ccc(Br)nc1 Amb33388056 [0,1,1,0,0,0|2,0,0]=4 2723 B10R1.1 NOCc1ccc(Cl)cc1 Amb10607411 [0,1,1,0,0,0|1,0,0]=3 2724 B10R1.1 NOCc1ccc(Cl)cc1 Amb19889791 [0,1,1,0,0,0|1,0,0]=3 2725 B10R1.1 NOCc1ccc(Cl)cn1 Amb26006165 [0,1,1,0,0,0|2,0,0]=4 2726 B10R1.1 NOCc1ccc(Cl)nc1 Amb25128181 [0,1,1,0,0,0|2,0,0]=4 2727 B10R1.1 NOCc1ccc(F)cc1 Amb17091427 [0,1,1,0,0,0|1,0,0]=3 2728 B10R1.1 NOCc1ccc(F)cc1 Amb19883929 [0,1,1,0,0,0|1,0,0]=3 2729 B10R1.1 NOCc1ccc(F)cn1 Amb24752377 [0,1,1,0,0,0|2,0,0]=4 2730 B10R1.1 NOCc1ccc(F)nc1 Amb33426204 [0,1,1,0,0,0|2,0,0]=4 2731 B10R1.1 NOCc1ccc(N)cc1 Amb28184708 [0,1,1,0,0,0|1,0,0]=3 2732 B10R1.1 NOCc1ccc(O)cc1 Amb8391701 [0,1,1,0,0,0|1,0,0]=3 2733 B10R1.1 Nc1ccc(CCBr)cc1 Amb17595296 [0,1,1,0,0,0|1,0,0]=3 2734 B10R1.1 Nc1ccc(CCBr)cc1 Amb24066884 [0,1,1,0,0,0|1,0,0]=3 2735 B10R1.1 Nc1ccc(CCO)cc1 Amb594608 [0,1,1,0,0,0|0,0,0]=2 2736 B10R1.1 Nc1ccc(CCO)cn1 Amb23446333 [0,1,1,0,0,0|1,0,0]=3 2737 B10R1.1 Nc1ccc(CCO)nc1 Amb24593512 [0,1,1,0,0,0|1,0,0]=3 2738 B10R1.1 Nc1ccc(OCF)cc1 Amb25887737 [0,1,1,0,0,0|2,0,0]=4 2739 B10R1.1 Nc1ccc(OCO)nc1 Amb33128029 [0,1,1,0,0,0|2,0,0]=4 2740 B10R1.1 Nc1ccc(SCCl)cc1 Amb25281595 [0,1,1,0,0,0|2,0,0]=4 2741 B10R1.1 Nc1ccc(\C=N\O)cc1 Amb28348427 [0,1,1,0,0,0|1,0,1]=4 2742 B10R1.1 Nc1ncc(CCO)cn1 Amb27173928 [0,1,1,0,0,0|2,0,0]=4 2743 B10R1.1 O=C1C=CC(=NOCl)C=C1 Amb27260791 [0,1,1,0,0,0|2,0,0]=4 2744 B10R1.1 O=C1C=CC(CCO)=CO1 Amb27615745 [0,1,1,0,0,0|1,0,0]=3 2745 B10R1.1 O=C1C=CC(CCO)C=C1 Amb27770442 [0,1,1,0,0,0|0,0,1]=3 2746 B10R1.1 O=C1C=CN(CCBr)C=C1 Amb27233194 [0,1,1,0,0,0|2,0,0]=4 2747 B10R1.1 O=C1C=CN(CCCl)C=C1 Amb18177573 [0,1,1,0,0,0|2,0,0]=4 2748 B10R1.1 O=C1C=CN(CCS)C=C1 Amb28185809 [0,1,1,0,0,0|1,1,0]=4 2749 B10R1.1 O=C1N=CC(CCO)=CN1 Amb28555655 [0,1,1,0,0,0|2,0,0]=4 2750 B10R1.1 O=CCc1ccc(Br)cc1 Amb16230450 [0,1,1,0,0,0|0,0,2]=4 2751 B10R1.1 O=CCc1ccc(Cl)cc1 Amb10603161 [0,1,1,0,0,0|0,0,2]=4 2752 B10R1.1 O=CCc1ccc(F)cc1 Amb16230451 [0,1,1,0,0,0|0,0,2]=4 2753 B10R1.1 O=CCc1ccc(O)cc1 Amb9782679 [0,1,1,0,0,0|0,0,2]=4 2754 B10R1.1 OBCc1ccc(Cl)cc1 Amb28457057 [0,1,1,0,0,0|1,0,0]=3 2755 B10R1.1 OBCc1ccc(F)cc1 Amb27650835 [0,1,1,0,0,0|1,0,0]=3 2756 B10R1.1 OCCc1ccc(Br)cc1 Amb2726152 [0,1,1,0,0,0|0,0,0]=2 2757 B10R1.1 OCCc1ccc(Br)cn1 Amb21858814 [0,1,1,0,0,0|1,0,0]=3 2758 B10R1.1 OCCc1ccc(Br)nc1 Amb23569407 [0,1,1,0,0,0|1,0,0]=3 2759 B10R1.1 OCCc1ccc(Cl)cc1 Amb2780043 [0,1,1,0,0,0|0,0,0]=2 2760 B10R1.1 OCCc1ccc(Cl)cn1 Amb28424027 [0,1,1,0,0,0|1,0,0]=3 2761 B10R1.1 OCCc1ccc(Cl)nc1 Amb22752853 [0,1,1,0,0,0|1,0,0]=3 2762 B10R1.1 OCCc1ccc(F)cc1 Amb3939063 [0,1,1,0,0,0|0,0,0]=2 2763 B10R1.1 OCCc1ccc(F)cn1 Amb24426849 [0,1,1,0,0,0|1,0,0]=3 2764 B10R1.1 OCCc1ccc(F)nc1 Amb25063775 [0,1,1,0,0,0|1,0,0]=3 2765 B10R1.1 OCCc1ccc(I)cc1 Amb19668873 [0,1,1,0,0,0|0,0,0]=2 2766 B10R1.1 OCCc1ccc(I)nc1 Amb23446988 [0,1,1,0,0,0|1,0,0]=3 2767 B10R1.1 OCCc1ccc(O)cc1 Amb2725510 [0,1,1,0,0,0|0,0,0]=2 2768 B10R1.1 OCCc1ccc(S)nc1 Amb23446733 [0,1,1,0,0,0|1,0,0]=3 2769 B10R1.1 OCCc1cnc(F)nc1 Amb26851462 [0,1,1,0,0,0|2,0,0]=4 2770 B10R1.1 OCCc1cnc(O)nc1 Amb26957386 [0,1,1,0,0,0|2,0,0]=4 2771 B10R1.1 OCCc1cnc(S)nc1 Amb27755835 [0,1,1,0,0,0|2,0,0]=4 2772 B10R1.1 OCCc1ncc(Br)cn1 Amb22896759 [0,1,1,0,0,0|2,0,0]=4 2773 B10R1.1 OCCc1ncc(Cl)cn1 Amb27865986 [0,1,1,0,0,0|2,0,0]=4 2774 B10R1.1 OCCc1ncc(S)cn1 Amb1971491 [0,1,1,0,0,0|2,0,0]=4 2775 B10R1.1 ONCc1ccc(Br)cc1 Amb23449447 [0,1,1,0,0,0|1,0,0]=3 2776 B10R1.1 ONCc1ccc(Br)cn1 Amb27666709 [0,1,1,0,0,0|2,0,0]=4 2777 B10R1.1 ONCc1ccc(Br)nc1 Amb33387357 [0,1,1,0,0,0|2,0,0]=4 2778 B10R1.1 ONCc1ccc(Cl)cc1 Amb25145635 [0,1,1,0,0,0|1,0,0]=3 2779 B10R1.1 ONCc1ccc(Cl)nc1 Amb33261190 [0,1,1,0,0,0|2,0,0]=4 2780 B10R1.1 ONCc1ccc(F)cc1 Amb22157298 [0,1,1,0,0,0|1,0,0]=3 2781 B10R1.1 ONCc1ccc(F)cn1 Amb32954386 [0,1,1,0,0,0|2,0,0]=4 2782 B10R1.1 ONCc1ccc(F)nc1 Amb33426960 [0,1,1,0,0,0|2,0,0]=4 2783 B10R1.1 ONCc1ccc(O)cc1 Amb23449449 [0,1,1,0,0,0|1,0,0]=3 2784 B10R1.1 ONCc1ccc(O)cn1 Amb27455725 [0,1,1,0,0,0|2,0,0]=4 2785 B10R1.1 O\N=C\c1ccc(Br)cc1 Amb1152409 [0,1,1,0,0,0|1,0,1]=4 2786 B10R1.1 O\N=C\c1ccc(Cl)cc1 Amb1152205 [0,1,1,0,0,0|1,0,1]=4 2787 B10R1.1 O\N=C\c1ccc(Cl)cc1 Amb33714742 [0,1,1,0,0,0|1,0,1]=4 2788 B10R1.1 O\N=C\c1ccc(F)cc1 Amb33623403 [0,1,1,0,0,0|1,0,1]=4 2789 B10R1.1 O\N=C\c1ccc(I)cc1 Amb4035593 [0,1,1,0,0,0|1,0,1]=4 2790 B10R1.1 O\N=C\c1ccc(O)cc1 Amb5722541 [0,1,1,0,0,0|1,0,1]=4 2791 B10R1.1 Oc1ccc(CCBr)cc1 Amb5718179 [0,1,1,0,0,0|1,0,0]=3 2792 B10R1.1 Oc1ccc(CCF)cc1 Amb25735077 [0,1,1,0,0,0|1,0,0]=3 2793 B10R1.1 Oc1ccc(CCS)cc1 Amb25767004 [0,1,1,0,0,0|0,1,0]=3 2794 B10R1.1 Oc1ccc(OCF)cc1 Amb27599328 [0,1,1,0,0,0|2,0,0]=4 2795 B10R1.1 Oc1ccc(SCCl)cc1 Amb25936639 [0,1,1,0,0,0|2,0,0]=4 2796 B10R1.1 SCCc1ccc(Br)cc1 Amb17404679 [0,1,1,0,0,0|0,1,0]=3 2797 B10R1.1 SCCc1ccc(Br)cn1 Amb33477443 [0,1,1,0,0,0|1,1,0]=4 2798 B10R1.1 SCCc1ccc(Br)nc1 Amb33389188 [0,1,1,0,0,0|1,1,0]=4 2799 B10R1.1 SCCc1ccc(Cl)cc1 Amb17400376 [0,1,1,0,0,0|0,1,0]=3 2800 B10R1.1 SCCc1ccc(Cl)cn1 Amb33058825 [0,1,1,0,0,0|1,1,0]=4 2801 B10R1.1 SCCc1ccc(Cl)nc1 Amb33261706 [0,1,1,0,0,0|1,1,0]=4 2802 B10R1.1 [C-]#[N+]Cc1ccc(Br)cc1 Amb2684960 [0,1,1,0,0,0|1,0,1]=4 2803 B10R1.1 [C-]#[N+]Cc1ccc(C)cc1 Amb1981066 [0,1,1,0,0,0|1,0,1]=4 2804 B10R1.1 [C-]#[N+]Cc1ccc(Cl)cc1 Amb2235910 [0,1,1,0,0,0|1,0,1]=4 2805 B10R1.1 [C-]#[N+]Cc1ccc(F)cc1 Amb1981065 [0,1,1,0,0,0|1,0,1]=4 2806 B10R1.4 BrCCc1ccccc1Br Amb19515770 [0,1,1,0,0,0|1,0,0]=3 2807 B10R1.4 BrCCc1ccccc1I Amb25742518 [0,1,1,0,0,0|1,0,0]=3 2808 B10R1.4 BrCCc1cccnc1Br Amb33389472 [0,1,1,0,0,0|2,0,0]=4 2809 B10R1.4 BrCCc1ccncc1Br Amb33242646 [0,1,1,0,0,0|2,0,0]=4 2810 B10R1.4 BrCCc1ncccc1Br Amb33242278 [0,1,1,0,0,0|2,0,0]=4 2811 B10R1.4 C#CCc1ccccc1Br Amb33451964 [0,1,1,0,0,0|1,0,1]=4 2812 B10R1.4 C#CCc1ccccc1C Amb33449990 [0,1,1,0,0,0|1,0,1]=4 2813 B10R1.4 C#CCc1ccccc1Cl Amb33052524 [0,1,1,0,0,0|1,0,1]=4 2814 B10R1.4 C#CCc1ccccc1F Amb33456146 [0,1,1,0,0,0|1,0,1]=4 2815 B10R1.4 C#CCc1ccccc1O Amb24478360 [0,1,1,0,0,0|1,0,1]=4 2816 B10R1.4 C#NCc1ccccc1Br Amb31112144 [0,1,1,0,0,0|1,0,1]=4 2817 B10R1.4 C#NCc1ccccc1C Amb31132458 [0,1,1,0,0,0|1,0,1]=4 2818 B10R1.4 C#NCc1ccccc1Cl Amb31111982 [0,1,1,0,0,0|1,0,1]=4 2819 B10R1.4 C#NCc1ccccc1F Amb31132461 [0,1,1,0,0,0|1,0,1]=4 2820 B10R1.4 C=CCc1ccccc1Br Amb26451399 [0,1,1,0,0,0|1,0,1]=4 2821 B10R1.4 C=CCc1ccccc1C Amb6298985 [0,1,1,0,0,0|1,0,1]=4 2822 B10R1.4 C=CCc1ccccc1Cl Amb6298963 [0,1,1,0,0,0|1,0,1]=4 2823 B10R1.4 C=CCc1ccccc1F Amb6299090 [0,1,1,0,0,0|1,0,1]=4 2824 B10R1.4 C=CCc1ccccc1O Amb1971446 [0,1,1,0,0,0|1,0,1]=4 2825 B10R1.4 CC#Cc1ccccc1Cl Amb28384813 [0,1,1,0,0,0|1,0,1]=4 2826 B10R1.4 CCCN1C=CC=CC1=O Amb22730334 [0,1,1,0,0,0|2,0,0]=4 2827 B10R1.4 CCCN1C=CC=CC1=S Amb24480486 [0,1,1,0,0,0|2,0,0]=4 2828 B10R1.4 CCCc1ccccc1Br Amb26623759 [0,1,1,0,0,0|1,0,0]=3 2829 B10R1.4 CCCc1ccccc1C Amb22227985 [0,1,1,0,0,0|1,0,0]=3 2830 B10R1.4 CCCc1ccccc1Cl Amb28049677 [0,1,1,0,0,0|1,0,0]=3 2831 B10R1.4 CCCc1ccccc1I Amb20622716 [0,1,1,0,0,0|1,0,0]=3 2832 B10R1.4 CCCc1ccccc1N Amb2724372 [0,1,1,0,0,0|1,0,0]=3 2833 B10R1.4 CCCc1ccccc1O Amb2726171 [0,1,1,0,0,0|1,0,0]=3 2834 B10R1.4 CCCc1ccccc1S Amb32688038 [0,1,1,0,0,0|1,0,0]=3 2835 B10R1.4 CCCc1cccnc1Br Amb24319271 [0,1,1,0,0,0|2,0,0]=4 2836 B10R1.4 CCCc1cccnc1Cl Amb24319272 [0,1,1,0,0,0|2,0,0]=4 2837 B10R1.4 CCCc1cccnc1N Amb8386852 [0,1,1,0,0,0|2,0,0]=4 2838 B10R1.4 CCCc1cccnc1O Amb24319273 [0,1,1,0,0,0|2,0,0]=4 2839 B10R1.4 CCCc1ccncc1Br Amb24320559 [0,1,1,0,0,0|2,0,0]=4 2840 B10R1.4 CCCc1ccncc1N Amb18203088 [0,1,1,0,0,0|2,0,0]=4 2841 B10R1.4 CCCc1cnccc1Br Amb20617515 [0,1,1,0,0,0|2,0,0]=4 2842 B10R1.4 CCCc1cnccc1C Amb26366029 [0,1,1,0,0,0|2,0,0]=4 2843 B10R1.4 CCCc1cnccc1N Amb22522169 [0,1,1,0,0,0|2,0,0]=4 2844 B10R1.4 CCCc1cnccc1O Amb33189019 [0,1,1,0,0,0|2,0,0]=4 2845 B10R1.4 CCCc1ncccc1Br Amb24320669 [0,1,1,0,0,0|2,0,0]=4 2846 B10R1.4 CCCc1ncccc1C Amb28293496 [0,1,1,0,0,0|2,0,0]=4 2847 B10R1.4 CCCc1ncccc1Cl Amb27968734 [0,1,1,0,0,0|2,0,0]=4 2848 B10R1.4 CCCc1ncccc1N Amb18832434 [0,1,1,0,0,0|2,0,0]=4 2849 B10R1.4 CCCc1ncccc1O Amb24320670 [0,1,1,0,0,0|2,0,0]=4 2850 B10R1.4 CCNc1ccccc1Br Amb6696453 [0,1,1,0,0,0|2,0,0]=4 2851 B10R1.4 CCNc1ccccc1C Amb4037021 [0,1,1,0,0,0|2,0,0]=4 2852 B10R1.4 CCNc1ccccc1Cl Amb32651858 [0,1,1,0,0,0|2,0,0]=4 2853 B10R1.4 CCNc1ccccc1Cl Amb4313295 [0,1,1,0,0,0|2,0,0]=4 2854 B10R1.4 CCNc1ccccc1F Amb2688341 [0,1,1,0,0,0|2,0,0]=4 2855 B10R1.4 CCNc1ccccc1I Amb9203660 [0,1,1,0,0,0|2,0,0]=4 2856 B10R1.4 CCNc1ccccc1N Amb29847532 [0,1,1,0,0,0|2,0,0]=4 2857 B10R1.4 CCNc1ccccc1N Amb7767530 [0,1,1,0,0,0|2,0,0]=4 2858 B10R1.4 CCNc1ccccc1O Amb18643152 [0,1,1,0,0,0|2,0,0]=4 2859 B10R1.4 CCOc1ccccc1Br Amb4010257 [0,1,1,0,0,0|2,0,0]=4 2860 B10R1.4 CCOc1ccccc1C Amb9787457 [0,1,1,0,0,0|2,0,0]=4 2861 B10R1.4 CCOc1ccccc1Cl Amb9787476 [0,1,1,0,0,0|2,0,0]=4 2862 B10R1.4 CCOc1ccccc1F Amb2688288 [0,1,1,0,0,0|2,0,0]=4 2863 B10R1.4 CCOc1ccccc1I Amb19888234 [0,1,1,0,0,0|2,0,0]=4 2864 B10R1.4 CCOc1ccccc1N Amb840072 [0,1,1,0,0,0|2,0,0]=4 2865 B10R1.4 CCOc1ccccc1O Amb3939539 [0,1,1,0,0,0|2,0,0]=4 2866 B10R1.4 CCOc1ccccc1S Amb20242711 [0,1,1,0,0,0|2,0,0]=4 2867 B10R1.4 CCPc1ccccc1N Amb27637691 [0,1,1,0,0,0|2,0,0]=4 2868 B10R1.4 CCSc1ccccc1Br Amb20242712 [0,1,1,0,0,0|2,0,0]=4 2869 B10R1.4 CCSc1ccccc1C Amb27259108 [0,1,1,0,0,0|2,0,0]=4 2870 B10R1.4 CCSc1ccccc1Cl Amb26500521 [0,1,1,0,0,0|2,0,0]=4 2871 B10R1.4 CCSc1ccccc1F Amb24480376 [0,1,1,0,0,0|2,0,0]=4 2872 B10R1.4 CCSc1ccccc1N Amb10609429 [0,1,1,0,0,0|2,0,0]=4 2873 B10R1.4 CCSc1ccccc1N Amb6281496 [0,1,1,0,0,0|2,0,0]=4 2874 B10R1.4 CCSc1ccccc1O Amb33529393 [0,1,1,0,0,0|2,0,0]=4 2875 B10R1.4 CNCC1=CC=CNC1=O Amb18260767 [0,1,1,0,0,0|2,0,0]=4 2876 B10R1.4 CNCc1cccc[n+]1[O-] Amb27237288 [0,1,1,0,0,0|2,0,0]=4 2877 B10R1.4 CNCc1ccccc1Br Amb1210073 [0,1,1,0,0,0|1,0,0]=3 2878 B10R1.4 CNCc1ccccc1C Amb1648007 [0,1,1,0,0,0|1,0,0]=3 2879 B10R1.4 CNCc1ccccc1C Amb6865246 [0,1,1,0,0,0|1,0,0]=3 2880 B10R1.4 CNCc1ccccc1Cl Amb1694838 [0,1,1,0,0,0|1,0,0]=3 2881 B10R1.4 CNCc1ccccc1F Amb10609411 [0,1,1,0,0,0|1,0,0]=3 2882 B10R1.4 CNCc1ccccc1F Amb1675335 [0,1,1,0,0,0|1,0,0]=3 2883 B10R1.4 CNCc1ccccc1N Amb20239390 [0,1,1,0,0,0|1,0,0]=3 2884 B10R1.4 CNCc1ccccc1N Amb7173572 [0,1,1,0,0,0|1,0,0]=3 2885 B10R1.4 CNCc1ccccc1O Amb1113119 [0,1,1,0,0,0|1,0,0]=3 2886 B10R1.4 CNCc1ccccc1O Amb7969802 [0,1,1,0,0,0|1,0,0]=3 2887 B10R1.4 CNCc1cccnc1Br Amb25747185 [0,1,1,0,0,0|2,0,0]=4 2888 B10R1.4 CNCc1cccnc1C Amb18216945 [0,1,1,0,0,0|2,0,0]=4 2889 B10R1.4 CNCc1cccnc1Cl Amb10975541 [0,1,1,0,0,0|2,0,0]=4 2890 B10R1.4 CNCc1cccnc1Cl Amb21967911 [0,1,1,0,0,0|2,0,0]=4 2891 B10R1.4 CNCc1cccnc1F Amb28050213 [0,1,1,0,0,0|2,0,0]=4 2892 B10R1.4 CNCc1ccncc1Br Amb23412258 [0,1,1,0,0,0|2,0,0]=4 2893 B10R1.4 CNCc1ccncc1C Amb10607510 [0,1,1,0,0,0|2,0,0]=4 2894 B10R1.4 CNCc1ccncc1C Amb8503308 [0,1,1,0,0,0|2,0,0]=4 2895 B10R1.4 CNCc1ccncc1Cl Amb27803881 [0,1,1,0,0,0|2,0,0]=4 2896 B10R1.4 CNCc1ccncc1F Amb24398098 [0,1,1,0,0,0|2,0,0]=4 2897 B10R1.4 CNCc1cnccc1C Amb33547389 [0,1,1,0,0,0|2,0,0]=4 2898 B10R1.4 CNCc1cnccc1F Amb27806993 [0,1,1,0,0,0|2,0,0]=4 2899 B10R1.4 CNCc1cnccc1N Amb27226567 [0,1,1,0,0,0|2,0,0]=4 2900 B10R1.4 CNCc1ncccc1Br Amb28059958 [0,1,1,0,0,0|2,0,0]=4 2901 B10R1.4 CNCc1ncccc1C Amb3941175 [0,1,1,0,0,0|2,0,0]=4 2902 B10R1.4 CNCc1ncccc1Cl Amb26329059 [0,1,1,0,0,0|2,0,0]=4 2903 B10R1.4 CNCc1ncccc1F Amb2723488 [0,1,1,0,0,0|2,0,0]=4 2904 B10R1.4 CNCc1ncccc1O Amb27643801 [0,1,1,0,0,0|2,0,0]=4 2905 B10R1.4 COCC1=NC=CNC1=O Amb28063811 [0,1,1,0,0,0|2,0,0]=4 2906 B10R1.4 COCc1ccccc1Br Amb8517636 [0,1,1,0,0,0|0,0,0]=2 2907 B10R1.4 COCc1ccccc1Cl Amb27425949 [0,1,1,0,0,0|0,0,0]=2 2908 B10R1.4 COCc1ccccc1F Amb28050262 [0,1,1,0,0,0|0,0,0]=2 2909 B10R1.4 COCc1ccccc1I Amb19373361 [0,1,1,0,0,0|0,0,0]=2 2910 B10R1.4 COCc1ccccc1N Amb6249470 [0,1,1,0,0,0|0,0,0]=2 2911 B10R1.4 COCc1ccccc1O Amb22751673 [0,1,1,0,0,0|0,0,0]=2 2912 B10R1.4 COCc1cccnc1N Amb18961776 [0,1,1,0,0,0|1,0,0]=3 2913 B10R1.4 COCc1ccncc1Br Amb24479286 [0,1,1,0,0,0|1,0,0]=3 2914 B10R1.4 COCc1ccncc1S Amb27199279 [0,1,1,0,0,0|1,0,0]=3 2915 B10R1.4 COCc1ncncc1Br Amb18676799 [0,1,1,0,0,0|2,0,0]=4 2916 B10R1.4 COCc1ncncc1N Amb18677270 [0,1,1,0,0,0|2,0,0]=4 2917 B10R1.4 CSCN1C=CC=CC1=S Amb24502171 [0,1,1,0,0,0|1,1,0]=4 2918 B10R1.4 CSCc1ccccc1Br Amb4012755 [0,1,1,0,0,0|0,1,0]=3 2919 B10R1.4 CSCc1ccccc1Cl Amb27600716 [0,1,1,0,0,0|0,1,0]=3 2920 B10R1.4 CSCc1ccccc1F Amb27146597 [0,1,1,0,0,0|0,1,0]=3 2921 B10R1.4 CSCc1ccccc1I Amb26472202 [0,1,1,0,0,0|0,1,0]=3 2922 B10R1.4 CSCc1ccccc1N Amb18951025 [0,1,1,0,0,0|0,1,0]=3 2923 B10R1.4 CSCc1ccccc1O Amb18125792 [0,1,1,0,0,0|0,1,0]=3 2924 B10R1.4 CSCc1ccncc1C Amb27851528 [0,1,1,0,0,0|1,1,0]=4 2925 B10R1.4 CSCc1cnccc1O Amb27962918 [0,1,1,0,0,0|1,1,0]=4 2926 B10R1.4 C[n+]1ccccc1CCO Amb27173561 [0,1,1,0,0,0|1,0,0]=3 2927 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [0,1,1,0,0,0|1,0,1]=4 2928 B10R1.4 C\C=C\c1ccccc1O Amb3372048 [0,1,1,0,0,0|1,0,1]=4 2929 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [0,1,1,0,0,0|2,0,0]=4 2930 B10R1.4 C\N=C\c1ccccc1N Amb27619729 [0,1,1,0,0,0|1,0,1]=4 2931 B10R1.4 Cc1ccccc1CC#N Amb1651450 [0,1,1,0,0,0|1,0,1]=4 2932 B10R1.4 Cc1ccccc1CC=O Amb10844840 [0,1,1,0,0,0|0,0,2]=4 2933 B10R1.4 Cc1ccccc1CCBr Amb2685163 [0,1,1,0,0,0|1,0,0]=3 2934 B10R1.4 Cc1ccccc1CCCl Amb9004323 [0,1,1,0,0,0|1,0,0]=3 2935 B10R1.4 Cc1ccccc1CCI Amb27246006 [0,1,1,0,0,0|1,0,0]=3 2936 B10R1.4 Cc1ccccc1CCN Amb1212557 [0,1,1,0,0,0|1,0,0]=3 2937 B10R1.4 Cc1ccccc1CCN Amb20622598 [0,1,1,0,0,0|1,0,0]=3 2938 B10R1.4 Cc1ccccc1CCO Amb3939095 [0,1,1,0,0,0|0,0,0]=2 2939 B10R1.4 Cc1ccccc1CCS Amb17399938 [0,1,1,0,0,0|0,1,0]=3 2940 B10R1.4 Cc1ccccc1CNN Amb1118964 [0,1,1,0,0,0|2,0,0]=4 2941 B10R1.4 Cc1ccccc1CNN Amb6892665 [0,1,1,0,0,0|2,0,0]=4 2942 B10R1.4 Cc1ccccc1CNO Amb25343987 [0,1,1,0,0,0|1,0,0]=3 2943 B10R1.4 Cc1ccccc1CON Amb17091424 [0,1,1,0,0,0|1,0,0]=3 2944 B10R1.4 Cc1ccccc1CON Amb33715629 [0,1,1,0,0,0|1,0,0]=3 2945 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [0,1,1,0,0,0|2,0,0]=4 2946 B10R1.4 Cc1ccccc1OCCl Amb27494113 [0,1,1,0,0,0|2,0,0]=4 2947 B10R1.4 Cc1ccccc1\C=N\O Amb1647706 [0,1,1,0,0,0|1,0,1]=4 2948 B10R1.4 Cc1cccnc1CCBr Amb24641164 [0,1,1,0,0,0|2,0,0]=4 2949 B10R1.4 Cc1cccnc1CCI Amb35711451 [0,1,1,0,0,0|2,0,0]=4 2950 B10R1.4 Cc1cccnc1CCN Amb1995200 [0,1,1,0,0,0|2,0,0]=4 2951 B10R1.4 Cc1cccnc1CCN Amb32662795 [0,1,1,0,0,0|2,0,0]=4 2952 B10R1.4 Cc1cccnc1CCN Amb32664156 [0,1,1,0,0,0|2,0,0]=4 2953 B10R1.4 Cc1cccnc1CCO Amb2694545 [0,1,1,0,0,0|1,0,0]=3 2954 B10R1.4 Cc1cccnc1CCS Amb33361011 [0,1,1,0,0,0|1,1,0]=4 2955 B10R1.4 Cc1cccnc1CNO Amb33429076 [0,1,1,0,0,0|2,0,0]=4 2956 B10R1.4 Cc1cccnc1CON Amb25684335 [0,1,1,0,0,0|2,0,0]=4 2957 B10R1.4 Cc1ccncc1CCBr Amb24693233 [0,1,1,0,0,0|2,0,0]=4 2958 B10R1.4 Cc1ccncc1CCCl Amb27875306 [0,1,1,0,0,0|2,0,0]=4 2959 B10R1.4 Cc1ccncc1CCN Amb18832435 [0,1,1,0,0,0|2,0,0]=4 2960 B10R1.4 Cc1ccncc1CCO Amb27467536 [0,1,1,0,0,0|1,0,0]=3 2961 B10R1.4 Cc1ccncc1CCS Amb33375261 [0,1,1,0,0,0|1,1,0]=4 2962 B10R1.4 Cc1ccncc1CNO Amb25135601 [0,1,1,0,0,0|2,0,0]=4 2963 B10R1.4 Cc1ccncc1CON Amb33376749 [0,1,1,0,0,0|2,0,0]=4 2964 B10R1.4 Cc1cnccc1CCBr Amb24548352 [0,1,1,0,0,0|2,0,0]=4 2965 B10R1.4 Cc1cnccc1CCN Amb22059435 [0,1,1,0,0,0|2,0,0]=4 2966 B10R1.4 Cc1cnccc1CCO Amb26539673 [0,1,1,0,0,0|1,0,0]=3 2967 B10R1.4 Cc1cnccc1CCS Amb25197336 [0,1,1,0,0,0|1,1,0]=4 2968 B10R1.4 Cc1cnccc1CNO Amb26925533 [0,1,1,0,0,0|2,0,0]=4 2969 B10R1.4 Cc1cnccc1CON Amb33079980 [0,1,1,0,0,0|2,0,0]=4 2970 B10R1.4 Cc1ncccc1CCBr Amb33432583 [0,1,1,0,0,0|2,0,0]=4 2971 B10R1.4 Cc1ncccc1CCN Amb18203091 [0,1,1,0,0,0|2,0,0]=4 2972 B10R1.4 Cc1ncccc1CCO Amb24061576 [0,1,1,0,0,0|1,0,0]=3 2973 B10R1.4 Cc1ncccc1CCS Amb32878314 [0,1,1,0,0,0|1,1,0]=4 2974 B10R1.4 Cc1ncccc1CNO Amb32880816 [0,1,1,0,0,0|2,0,0]=4 2975 B10R1.4 Cc1ncccc1CON Amb28144547 [0,1,1,0,0,0|2,0,0]=4 2976 B10R1.4 Cc1nccnc1CCO Amb2695470 [0,1,1,0,0,0|2,0,0]=4 2977 B10R1.4 Cc1ncncc1CCO Amb24063133 [0,1,1,0,0,0|2,0,0]=4 2978 B10R1.4 ClCCc1ccccc1Br Amb24644893 [0,1,1,0,0,0|1,0,0]=3 2979 B10R1.4 ClCCc1ccccc1Cl Amb8860565 [0,1,1,0,0,0|1,0,0]=3 2980 B10R1.4 ClCCc1ccccc1I Amb24742826 [0,1,1,0,0,0|1,0,0]=3 2981 B10R1.4 ClCCc1cccnc1Cl Amb33329271 [0,1,1,0,0,0|2,0,0]=4 2982 B10R1.4 ClCCc1ccncc1Cl Amb27615771 [0,1,1,0,0,0|2,0,0]=4 2983 B10R1.4 ClCOc1ccccc1Br Amb26889271 [0,1,1,0,0,0|2,0,0]=4 2984 B10R1.4 ClCOc1ccccc1Cl Amb22227923 [0,1,1,0,0,0|2,0,0]=4 2985 B10R1.4 ClCOc1ccccc1I Amb28187723 [0,1,1,0,0,0|2,0,0]=4 2986 B10R1.4 ClCSc1ccccc1Br Amb25887879 [0,1,1,0,0,0|2,0,0]=4 2987 B10R1.4 ClCSc1ccccc1Cl Amb28137812 [0,1,1,0,0,0|2,0,0]=4 2988 B10R1.4 ClCSc1ccccc1I Amb27641365 [0,1,1,0,0,0|2,0,0]=4 2989 B10R1.4 Cl[Zn]Cc1ccccc1Cl Amb22000427 [0,1,1,0,0,0|2,0,0]=4 2990 B10R1.4 Clc1ccccc1CCBr Amb2685155 [0,1,1,0,0,0|1,0,0]=3 2991 B10R1.4 Clc1cnccc1CCBr Amb25076266 [0,1,1,0,0,0|2,0,0]=4 2992 B10R1.4 Clc1ncccc1CCBr Amb33389001 [0,1,1,0,0,0|2,0,0]=4 2993 B10R1.4 FCCc1ccccc1I Amb22739042 [0,1,1,0,0,0|1,0,0]=3 2994 B10R1.4 Fc1ccccc1CCBr Amb2685159 [0,1,1,0,0,0|1,0,0]=3 2995 B10R1.4 Fc1ccccc1CCCl Amb8860569 [0,1,1,0,0,0|1,0,0]=3 2996 B10R1.4 Fc1ccccc1CCI Amb28248386 [0,1,1,0,0,0|1,0,0]=3 2997 B10R1.4 Fc1ccccc1CCS Amb17400004 [0,1,1,0,0,0|0,1,0]=3 2998 B10R1.4 Fc1ccccc1C[Mg]Cl Amb6300393 [0,1,1,0,0,0|2,0,0]=4 2999 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [0,1,1,0,0,0|2,0,0]=4 3000 B10R1.4 Fc1ccccc1OCCl Amb25356820 [0,1,1,0,0,0|2,0,0]=4 3001 B10R1.4 Fc1ccccc1SCCl Amb27447816 [0,1,1,0,0,0|2,0,0]=4 3002 B10R1.4 Fc1cccnc1CCBr Amb33337356 [0,1,1,0,0,0|2,0,0]=4 3003 B10R1.4 Fc1cccnc1CCS Amb33327466 [0,1,1,0,0,0|1,1,0]=4 3004 B10R1.4 Fc1cnccc1CCBr Amb25172854 [0,1,1,0,0,0|2,0,0]=4 3005 B10R1.4 Fc1cnccc1CCS Amb33316476 [0,1,1,0,0,0|1,1,0]=4 3006 B10R1.4 Fc1ncccc1CCBr Amb33450421 [0,1,1,0,0,0|2,0,0]=4 3007 B10R1.4 Fc1ncccc1CCS Amb33376783 [0,1,1,0,0,0|1,1,0]=4 3008 B10R1.4 N#CCc1ccccc1Br Amb1140623 [0,1,1,0,0,0|1,0,1]=4 3009 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [0,1,1,0,0,0|1,0,1]=4 3010 B10R1.4 N#CCc1ccccc1F Amb2688304 [0,1,1,0,0,0|1,0,1]=4 3011 B10R1.4 N#CCc1ccccc1I Amb3939789 [0,1,1,0,0,0|1,0,1]=4 3012 B10R1.4 N#CCc1ccccc1N Amb17607888 [0,1,1,0,0,0|1,0,1]=4 3013 B10R1.4 N#CCc1ccccc1N Amb3997244 [0,1,1,0,0,0|1,0,1]=4 3014 B10R1.4 N#CCc1ccccc1O Amb18642921 [0,1,1,0,0,0|1,0,1]=4 3015 B10R1.4 N#CCc1ccccc1S Amb27490861 [0,1,1,0,0,0|1,0,1]=4 3016 B10R1.4 N=C1C=CC=CN1CCO Amb18548415 [0,1,1,0,0,0|1,0,0]=3 3017 B10R1.4 N=CCc1ccccc1N Amb27175164 [0,1,1,0,0,0|1,0,1]=4 3018 B10R1.4 NCCN1C=CC=CC1=O Amb18535437 [0,1,1,0,0,0|2,0,0]=4 3019 B10R1.4 NCCN1C=CC=CC1=O Amb19514535 [0,1,1,0,0,0|2,0,0]=4 3020 B10R1.4 NCCN1C=CC=CC1=O Amb20668789 [0,1,1,0,0,0|2,0,0]=4 3021 B10R1.4 NCCc1ccccc1Br Amb22395128 [0,1,1,0,0,0|1,0,0]=3 3022 B10R1.4 NCCc1ccccc1Br Amb4605963 [0,1,1,0,0,0|1,0,0]=3 3023 B10R1.4 NCCc1ccccc1Cl Amb22490604 [0,1,1,0,0,0|1,0,0]=3 3024 B10R1.4 NCCc1ccccc1Cl Amb2686343 [0,1,1,0,0,0|1,0,0]=3 3025 B10R1.4 NCCc1ccccc1F Amb22039505 [0,1,1,0,0,0|1,0,0]=3 3026 B10R1.4 NCCc1ccccc1F Amb421247 [0,1,1,0,0,0|1,0,0]=3 3027 B10R1.4 NCCc1ccccc1I Amb27796258 [0,1,1,0,0,0|1,0,0]=3 3028 B10R1.4 NCCc1ccccc1N Amb8631277 [0,1,1,0,0,0|1,0,0]=3 3029 B10R1.4 NCCc1ccccc1N Amb8631278 [0,1,1,0,0,0|1,0,0]=3 3030 B10R1.4 NCCc1ccccc1O Amb33549438 [0,1,1,0,0,0|1,0,0]=3 3031 B10R1.4 NCCc1ccccc1O Amb6246475 [0,1,1,0,0,0|1,0,0]=3 3032 B10R1.4 NCCc1cccnc1Br Amb25190186 [0,1,1,0,0,0|2,0,0]=4 3033 B10R1.4 NCCc1cccnc1Cl Amb24551153 [0,1,1,0,0,0|2,0,0]=4 3034 B10R1.4 NCCc1cccnc1Cl Amb33299325 [0,1,1,0,0,0|2,0,0]=4 3035 B10R1.4 NCCc1cccnc1F Amb24062493 [0,1,1,0,0,0|2,0,0]=4 3036 B10R1.4 NCCc1cccnc1N Amb25714008 [0,1,1,0,0,0|2,0,0]=4 3037 B10R1.4 NCCc1cccnc1O Amb26550960 [0,1,1,0,0,0|2,0,0]=4 3038 B10R1.4 NCCc1ccncc1Br Amb26565968 [0,1,1,0,0,0|2,0,0]=4 3039 B10R1.4 NCCc1ccncc1Cl Amb23596506 [0,1,1,0,0,0|2,0,0]=4 3040 B10R1.4 NCCc1ccncc1F Amb24383725 [0,1,1,0,0,0|2,0,0]=4 3041 B10R1.4 NCCc1ccncc1N Amb28423471 [0,1,1,0,0,0|2,0,0]=4 3042 B10R1.4 NCCc1cnccc1Br Amb27793514 [0,1,1,0,0,0|2,0,0]=4 3043 B10R1.4 NCCc1cnccc1F Amb25721852 [0,1,1,0,0,0|2,0,0]=4 3044 B10R1.4 NCCc1ncccc1Br Amb24183541 [0,1,1,0,0,0|2,0,0]=4 3045 B10R1.4 NCCc1ncccc1Cl Amb18200051 [0,1,1,0,0,0|2,0,0]=4 3046 B10R1.4 NCCc1ncccc1F Amb33537364 [0,1,1,0,0,0|2,0,0]=4 3047 B10R1.4 NCCc1ncccc1F Amb8011391 [0,1,1,0,0,0|2,0,0]=4 3048 B10R1.4 NCCc1ncccc1N Amb25915119 [0,1,1,0,0,0|2,0,0]=4 3049 B10R1.4 NCCc1ncccc1O Amb26588910 [0,1,1,0,0,0|2,0,0]=4 3050 B10R1.4 NNCc1ccccc1Br Amb1116234 [0,1,1,0,0,0|2,0,0]=4 3051 B10R1.4 NNCc1ccccc1Br Amb19893262 [0,1,1,0,0,0|2,0,0]=4 3052 B10R1.4 NNCc1ccccc1Cl Amb21959997 [0,1,1,0,0,0|2,0,0]=4 3053 B10R1.4 NNCc1ccccc1Cl Amb4008405 [0,1,1,0,0,0|2,0,0]=4 3054 B10R1.4 NNCc1ccccc1Cl Amb5400451 [0,1,1,0,0,0|2,0,0]=4 3055 B10R1.4 NNCc1ccccc1F Amb19893256 [0,1,1,0,0,0|2,0,0]=4 3056 B10R1.4 NNCc1ccccc1F Amb33553561 [0,1,1,0,0,0|2,0,0]=4 3057 B10R1.4 NNCc1ccccc1F Amb6247906 [0,1,1,0,0,0|2,0,0]=4 3058 B10R1.4 NNCc1ccccc1O Amb24681968 [0,1,1,0,0,0|2,0,0]=4 3059 B10R1.4 NOCc1ccccc1Br Amb17091454 [0,1,1,0,0,0|1,0,0]=3 3060 B10R1.4 NOCc1ccccc1Br Amb21929112 [0,1,1,0,0,0|1,0,0]=3 3061 B10R1.4 NOCc1ccccc1Cl Amb19889789 [0,1,1,0,0,0|1,0,0]=3 3062 B10R1.4 NOCc1ccccc1Cl Amb8471898 [0,1,1,0,0,0|1,0,0]=3 3063 B10R1.4 NOCc1ccccc1F Amb19894376 [0,1,1,0,0,0|1,0,0]=3 3064 B10R1.4 NOCc1ccccc1F Amb8471897 [0,1,1,0,0,0|1,0,0]=3 3065 B10R1.4 NOCc1ccccc1I Amb22235087 [0,1,1,0,0,0|1,0,0]=3 3066 B10R1.4 NOCc1ccccc1I Amb27445122 [0,1,1,0,0,0|1,0,0]=3 3067 B10R1.4 NOCc1ccccc1O Amb24502260 [0,1,1,0,0,0|1,0,0]=3 3068 B10R1.4 NOCc1cccnc1Br Amb25947050 [0,1,1,0,0,0|2,0,0]=4 3069 B10R1.4 NOCc1cccnc1Cl Amb22396129 [0,1,1,0,0,0|2,0,0]=4 3070 B10R1.4 NOCc1cccnc1F Amb33377682 [0,1,1,0,0,0|2,0,0]=4 3071 B10R1.4 NOCc1cccnc1N Amb27862932 [0,1,1,0,0,0|2,0,0]=4 3072 B10R1.4 NOCc1ccncc1Br Amb33241889 [0,1,1,0,0,0|2,0,0]=4 3073 B10R1.4 NOCc1ccncc1Cl Amb25764086 [0,1,1,0,0,0|2,0,0]=4 3074 B10R1.4 NOCc1ccncc1F Amb26423136 [0,1,1,0,0,0|2,0,0]=4 3075 B10R1.4 NOCc1cnccc1Cl Amb27254698 [0,1,1,0,0,0|2,0,0]=4 3076 B10R1.4 NOCc1ncccc1Br Amb26871580 [0,1,1,0,0,0|2,0,0]=4 3077 B10R1.4 NOCc1ncccc1F Amb26370102 [0,1,1,0,0,0|2,0,0]=4 3078 B10R1.4 Nc1ccccc1CCBr Amb24079731 [0,1,1,0,0,0|1,0,0]=3 3079 B10R1.4 Nc1ccccc1CCCl Amb28204640 [0,1,1,0,0,0|1,0,0]=3 3080 B10R1.4 Nc1ccccc1CCO Amb33733822 [0,1,1,0,0,0|0,0,0]=2 3081 B10R1.4 Nc1ccccc1CCO Amb4605841 [0,1,1,0,0,0|0,0,0]=2 3082 B10R1.4 Nc1ccccc1SCCl Amb25720293 [0,1,1,0,0,0|2,0,0]=4 3083 B10R1.4 Nc1ccccc1\C=N\O Amb2608949 [0,1,1,0,0,0|1,0,1]=4 3084 B10R1.4 Nc1cccnc1CCO Amb26398866 [0,1,1,0,0,0|1,0,0]=3 3085 B10R1.4 Nc1ccncc1CCF Amb26001806 [0,1,1,0,0,0|2,0,0]=4 3086 B10R1.4 Nc1ccncc1CCO Amb24062498 [0,1,1,0,0,0|1,0,0]=3 3087 B10R1.4 Nc1ncccc1CCCl Amb27256835 [0,1,1,0,0,0|2,0,0]=4 3088 B10R1.4 Nc1ncccc1CCO Amb21858404 [0,1,1,0,0,0|1,0,0]=3 3089 B10R1.4 O=C1C=CC=CN1CCBr Amb19514604 [0,1,1,0,0,0|2,0,0]=4 3090 B10R1.4 O=C1C=CC=CN1CCBr Amb33299911 [0,1,1,0,0,0|2,0,0]=4 3091 B10R1.4 O=C1C=CC=CN1CCCl Amb18787739 [0,1,1,0,0,0|2,0,0]=4 3092 B10R1.4 O=C1C=CC=CN1CCF Amb27426877 [0,1,1,0,0,0|2,0,0]=4 3093 B10R1.4 O=C1C=CC=CN1CCI Amb28254877 [0,1,1,0,0,0|2,0,0]=4 3094 B10R1.4 O=C1C=CC=CN1CCO Amb18041231 [0,1,1,0,0,0|1,0,0]=3 3095 B10R1.4 O=C1C=CC=NN1CCO Amb24591459 [0,1,1,0,0,0|2,0,0]=4 3096 B10R1.4 O=C1C=CN=CN1CCO Amb25263218 [0,1,1,0,0,0|2,0,0]=4 3097 B10R1.4 O=C1C=NC=CN1CCO Amb27206460 [0,1,1,0,0,0|2,0,0]=4 3098 B10R1.4 O=C1NC=CC=C1CCO Amb27241736 [0,1,1,0,0,0|1,0,0]=3 3099 B10R1.4 O=CCc1ccccc1Br Amb18634182 [0,1,1,0,0,0|0,0,2]=4 3100 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [0,1,1,0,0,0|0,0,2]=4 3101 B10R1.4 O=CCc1ccccc1F Amb10844839 [0,1,1,0,0,0|0,0,2]=4 3102 B10R1.4 O=CCc1ccccc1O Amb6739922 [0,1,1,0,0,0|0,0,2]=4 3103 B10R1.4 O=c1ccccn1CCCl Amb22274576 [0,1,1,0,0,0|2,0,0]=4 3104 B10R1.4 OCCN1C=CC=CC1=S Amb25065240 [0,1,1,0,0,0|1,0,0]=3 3105 B10R1.4 OCCc1ccccc1Br Amb3939212 [0,1,1,0,0,0|0,0,0]=2 3106 B10R1.4 OCCc1ccccc1Cl Amb3939106 [0,1,1,0,0,0|0,0,0]=2 3107 B10R1.4 OCCc1ccccc1F Amb2688283 [0,1,1,0,0,0|0,0,0]=2 3108 B10R1.4 OCCc1ccccc1I Amb22753529 [0,1,1,0,0,0|0,0,0]=2 3109 B10R1.4 OCCc1ccccc1O Amb3940101 [0,1,1,0,0,0|0,0,0]=2 3110 B10R1.4 OCCc1cccnc1Br Amb27200606 [0,1,1,0,0,0|1,0,0]=3 3111 B10R1.4 OCCc1cccnc1Cl Amb28050705 [0,1,1,0,0,0|1,0,0]=3 3112 B10R1.4 OCCc1cccnc1F Amb24513826 [0,1,1,0,0,0|1,0,0]=3 3113 B10R1.4 OCCc1ccncc1Br Amb24482101 [0,1,1,0,0,0|1,0,0]=3 3114 B10R1.4 OCCc1ccncc1Cl Amb25890041 [0,1,1,0,0,0|1,0,0]=3 3115 B10R1.4 OCCc1ccncc1F Amb25776747 [0,1,1,0,0,0|1,0,0]=3 3116 B10R1.4 OCCc1cnccc1F Amb25865877 [0,1,1,0,0,0|1,0,0]=3 3117 B10R1.4 OCCc1ncccc1Br Amb22896751 [0,1,1,0,0,0|1,0,0]=3 3118 B10R1.4 OCCc1ncccc1Cl Amb28288389 [0,1,1,0,0,0|1,0,0]=3 3119 B10R1.4 OCCc1ncccc1F Amb26024787 [0,1,1,0,0,0|1,0,0]=3 3120 B10R1.4 ONCc1ccccc1Br Amb23449448 [0,1,1,0,0,0|1,0,0]=3 3121 B10R1.4 ONCc1ccccc1Cl Amb25729506 [0,1,1,0,0,0|1,0,0]=3 3122 B10R1.4 ONCc1ccccc1Cl Amb32679300 [0,1,1,0,0,0|1,0,0]=3 3123 B10R1.4 ONCc1ccccc1F Amb27252972 [0,1,1,0,0,0|1,0,0]=3 3124 B10R1.4 ONCc1ccccc1O Amb25128279 [0,1,1,0,0,0|1,0,0]=3 3125 B10R1.4 ONCc1cccnc1Br Amb33387397 [0,1,1,0,0,0|2,0,0]=4 3126 B10R1.4 ONCc1cccnc1Cl Amb21847006 [0,1,1,0,0,0|2,0,0]=4 3127 B10R1.4 ONCc1cccnc1F Amb33378660 [0,1,1,0,0,0|2,0,0]=4 3128 B10R1.4 ONCc1ccncc1Br Amb33242569 [0,1,1,0,0,0|2,0,0]=4 3129 B10R1.4 ONCc1ccncc1Cl Amb33052755 [0,1,1,0,0,0|2,0,0]=4 3130 B10R1.4 ONCc1ccncc1F Amb33318031 [0,1,1,0,0,0|2,0,0]=4 3131 B10R1.4 ONCc1ncccc1Br Amb33485075 [0,1,1,0,0,0|2,0,0]=4 3132 B10R1.4 ONCc1ncccc1F Amb33420499 [0,1,1,0,0,0|2,0,0]=4 3133 B10R1.4 O\N=C/c1ccccc1Br Amb25247795 [0,1,1,0,0,0|1,0,1]=4 3134 B10R1.4 O\N=C/c1ccccc1Cl Amb28239726 [0,1,1,0,0,0|1,0,1]=4 3135 B10R1.4 O\N=C\c1ccccc1Br Amb33788652 [0,1,1,0,0,0|1,0,1]=4 3136 B10R1.4 O\N=C\c1ccccc1Cl Amb1152026 [0,1,1,0,0,0|1,0,1]=4 3137 B10R1.4 O\N=C\c1ccccc1F Amb30585239 [0,1,1,0,0,0|1,0,1]=4 3138 B10R1.4 O\N=C\c1ccccc1I Amb1782090 [0,1,1,0,0,0|1,0,1]=4 3139 B10R1.4 O\N=C\c1ccccc1O Amb6608695 [0,1,1,0,0,0|1,0,1]=4 3140 B10R1.4 Oc1ccccc1CCBr Amb33549255 [0,1,1,0,0,0|1,0,0]=3 3141 B10R1.4 Oc1ccccc1CCI Amb25208761 [0,1,1,0,0,0|1,0,0]=3 3142 B10R1.4 Oc1ccccc1CCS Amb24362789 [0,1,1,0,0,0|0,1,0]=3 3143 B10R1.4 Oc1ccccc1SCCl Amb28204207 [0,1,1,0,0,0|2,0,0]=4 3144 B10R1.4 SCCc1ccccc1Br Amb25851259 [0,1,1,0,0,0|0,1,0]=3 3145 B10R1.4 SCCc1ccccc1Cl Amb17400374 [0,1,1,0,0,0|0,1,0]=3 3146 B10R1.4 SCCc1ccccc1I Amb24089655 [0,1,1,0,0,0|0,1,0]=3 3147 B10R1.4 SCCc1cccnc1Br Amb33388044 [0,1,1,0,0,0|1,1,0]=4 3148 B10R1.4 SCCc1cccnc1Cl Amb33257708 [0,1,1,0,0,0|1,1,0]=4 3149 B10R1.4 SCCc1ccncc1Br Amb33389013 [0,1,1,0,0,0|1,1,0]=4 3150 B10R1.4 SCCc1ccncc1Cl Amb33413845 [0,1,1,0,0,0|1,1,0]=4 3151 B10R1.4 SCCc1ncccc1Br Amb33336357 [0,1,1,0,0,0|1,1,0]=4 3152 B10R1.4 Sc1ccccc1CCBr Amb27450103 [0,1,1,0,0,0|1,0,0]=3 3153 B10R1.4 Sc1ccccc1CCCl Amb27776252 [0,1,1,0,0,0|1,0,0]=3 3154 B10R1.4 [C-]#[N+]Cc1ccccc1Br Amb3973085 [0,1,1,0,0,0|1,0,1]=4 3155 B10R1.4 [C-]#[N+]Cc1ccccc1C Amb2689349 [0,1,1,0,0,0|1,0,1]=4 3156 B10R1.4 [C-]#[N+]Cc1ccccc1Cl Amb2685776 [0,1,1,0,0,0|1,0,1]=4 3157 B10R1.4 [C-]#[N+]Cc1ccccc1F Amb2688050 [0,1,1,0,0,0|1,0,1]=4 3158 B10R1.4 [C-]#[N+]Cc1ccccc1O Amb28048077 [0,1,1,0,0,0|1,0,1]=4 3159 B10R1.4 [NH3+]CCc1ccccc1Cl Amb33512987 [0,1,1,0,0,0|1,0,0]=3 3160 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [0,1,1,0,0,0|1,0,0]=3 3161 B10R1.4 [O-][n+]1ccccc1CCO Amb541137 [0,1,1,0,0,0|1,0,0]=3 3162 B10R1.10 BOCc1cccc(C)n1 Amb27237966 [0,1,1,0,0,0|2,0,0]=4 3163 B10R1.10 BrCCc1cccc(Br)c1 Amb18048758 [0,1,1,0,0,0|1,0,0]=3 3164 B10R1.10 BrCCc1cccc(Br)n1 Amb33242100 [0,1,1,0,0,0|2,0,0]=4 3165 B10R1.10 BrCCc1cncc(Br)c1 Amb25147780 [0,1,1,0,0,0|2,0,0]=4 3166 B10R1.10 C#CCc1cccc(Br)c1 Amb27148208 [0,1,1,0,0,0|1,0,1]=4 3167 B10R1.10 C#CCc1cccc(C)c1 Amb33429151 [0,1,1,0,0,0|1,0,1]=4 3168 B10R1.10 C#CCc1cccc(Cl)c1 Amb26953104 [0,1,1,0,0,0|1,0,1]=4 3169 B10R1.10 C#CCc1cccc(F)c1 Amb27405697 [0,1,1,0,0,0|1,0,1]=4 3170 B10R1.10 C#CCc1cccc(I)c1 Amb26078060 [0,1,1,0,0,0|1,0,1]=4 3171 B10R1.10 C#CCc1cccc(O)c1 Amb33310924 [0,1,1,0,0,0|1,0,1]=4 3172 B10R1.10 C#NCc1cccc(Br)c1 Amb31112142 [0,1,1,0,0,0|1,0,1]=4 3173 B10R1.10 C#NCc1cccc(C)c1 Amb31132459 [0,1,1,0,0,0|1,0,1]=4 3174 B10R1.10 C#NCc1cccc(Cl)c1 Amb31111983 [0,1,1,0,0,0|1,0,1]=4 3175 B10R1.10 C#NCc1cccc(F)c1 Amb31132463 [0,1,1,0,0,0|1,0,1]=4 3176 B10R1.10 C=CCc1cccc(Br)c1 Amb6298947 [0,1,1,0,0,0|1,0,1]=4 3177 B10R1.10 C=CCc1cccc(C)c1 Amb2689628 [0,1,1,0,0,0|1,0,1]=4 3178 B10R1.10 C=CCc1cccc(Cl)c1 Amb2686405 [0,1,1,0,0,0|1,0,1]=4 3179 B10R1.10 C=CCc1cccc(F)c1 Amb2688385 [0,1,1,0,0,0|1,0,1]=4 3180 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [0,1,1,0,0,0|1,0,1]=4 3181 B10R1.10 C=CCc1cccc(N)c1 Amb32698606 [0,1,1,0,0,0|1,0,1]=4 3182 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [0,1,1,0,0,0|1,0,1]=4 3183 B10R1.10 CC#Cc1cccc(Br)c1 Amb22491725 [0,1,1,0,0,0|1,0,1]=4 3184 B10R1.10 CCCc1cc(Br)ccn1 Amb10599773 [0,1,1,0,0,0|2,0,0]=4 3185 B10R1.10 CCCc1cc(C)ccn1 Amb25844521 [0,1,1,0,0,0|2,0,0]=4 3186 B10R1.10 CCCc1cc(F)ccn1 Amb24318797 [0,1,1,0,0,0|2,0,0]=4 3187 B10R1.10 CCCc1cc(N)ccn1 Amb10599774 [0,1,1,0,0,0|2,0,0]=4 3188 B10R1.10 CCCc1cc(O)ccn1 Amb10599775 [0,1,1,0,0,0|2,0,0]=4 3189 B10R1.10 CCCc1cccc(Br)c1 Amb25736130 [0,1,1,0,0,0|1,0,0]=3 3190 B10R1.10 CCCc1cccc(Br)n1 Amb10600122 [0,1,1,0,0,0|2,0,0]=4 3191 B10R1.10 CCCc1cccc(C)c1 Amb22232362 [0,1,1,0,0,0|1,0,0]=3 3192 B10R1.10 CCCc1cccc(Cl)c1 Amb8393606 [0,1,1,0,0,0|1,0,0]=3 3193 B10R1.10 CCCc1cccc(Cl)n1 Amb27425089 [0,1,1,0,0,0|2,0,0]=4 3194 B10R1.10 CCCc1cccc(F)n1 Amb24319133 [0,1,1,0,0,0|2,0,0]=4 3195 B10R1.10 CCCc1cccc(N)c1 Amb18643014 [0,1,1,0,0,0|1,0,0]=3 3196 B10R1.10 CCCc1cccc(N)c1 Amb33172785 [0,1,1,0,0,0|1,0,0]=3 3197 B10R1.10 CCCc1cccc(N)n1 Amb2694190 [0,1,1,0,0,0|2,0,0]=4 3198 B10R1.10 CCCc1cccc(O)c1 Amb3941016 [0,1,1,0,0,0|1,0,0]=3 3199 B10R1.10 CCCc1cccc(O)n1 Amb10600153 [0,1,1,0,0,0|2,0,0]=4 3200 B10R1.10 CCCc1ccnc(Br)c1 Amb10599856 [0,1,1,0,0,0|2,0,0]=4 3201 B10R1.10 CCCc1ccnc(Cl)c1 Amb28125661 [0,1,1,0,0,0|2,0,0]=4 3202 B10R1.10 CCCc1ccnc(F)c1 Amb27812043 [0,1,1,0,0,0|2,0,0]=4 3203 B10R1.10 CCCc1ccnc(N)c1 Amb2694181 [0,1,1,0,0,0|2,0,0]=4 3204 B10R1.10 CCCc1ccnc(O)c1 Amb10599858 [0,1,1,0,0,0|2,0,0]=4 3205 B10R1.10 CCCc1cncc(Br)c1 Amb20617637 [0,1,1,0,0,0|2,0,0]=4 3206 B10R1.10 CCCc1cncc(C)c1 Amb27839178 [0,1,1,0,0,0|2,0,0]=4 3207 B10R1.10 CCCc1cncc(N)c1 Amb18832432 [0,1,1,0,0,0|2,0,0]=4 3208 B10R1.10 CCCc1cncc(O)c1 Amb20617709 [0,1,1,0,0,0|2,0,0]=4 3209 B10R1.10 CCCc1cncc(S)c1 Amb33276296 [0,1,1,0,0,0|2,0,0]=4 3210 B10R1.10 CCNc1cccc(Br)c1 Amb6696674 [0,1,1,0,0,0|2,0,0]=4 3211 B10R1.10 CCNc1cccc(Br)c1 Amb7969585 [0,1,1,0,0,0|2,0,0]=4 3212 B10R1.10 CCNc1cccc(C)c1 Amb4440919 [0,1,1,0,0,0|2,0,0]=4 3213 B10R1.10 CCNc1cccc(C)c1 Amb6540783 [0,1,1,0,0,0|2,0,0]=4 3214 B10R1.10 CCNc1cccc(Cl)c1 Amb6695730 [0,1,1,0,0,0|2,0,0]=4 3215 B10R1.10 CCNc1cccc(F)c1 Amb10609458 [0,1,1,0,0,0|2,0,0]=4 3216 B10R1.10 CCNc1cccc(F)c1 Amb6695887 [0,1,1,0,0,0|2,0,0]=4 3217 B10R1.10 CCNc1cccc(I)c1 Amb9203673 [0,1,1,0,0,0|2,0,0]=4 3218 B10R1.10 CCNc1cccc(N)c1 Amb8825439 [0,1,1,0,0,0|2,0,0]=4 3219 B10R1.10 CCNc1cccc(O)c1 Amb22168804 [0,1,1,0,0,0|2,0,0]=4 3220 B10R1.10 CCNc1cccc(O)c1 Amb6734927 [0,1,1,0,0,0|2,0,0]=4 3221 B10R1.10 CCOc1cccc(Br)c1 Amb3938998 [0,1,1,0,0,0|2,0,0]=4 3222 B10R1.10 CCOc1cccc(F)c1 Amb2684175 [0,1,1,0,0,0|2,0,0]=4 3223 B10R1.10 CCOc1cccc(I)c1 Amb19196001 [0,1,1,0,0,0|2,0,0]=4 3224 B10R1.10 CCOc1cccc(N)c1 Amb1124598 [0,1,1,0,0,0|2,0,0]=4 3225 B10R1.10 CCOc1cccc(O)c1 Amb2720441 [0,1,1,0,0,0|2,0,0]=4 3226 B10R1.10 CCOc1cccc(S)c1 Amb10070967 [0,1,1,0,0,0|2,0,0]=4 3227 B10R1.10 CCSc1cccc(Br)c1 Amb10067418 [0,1,1,0,0,0|2,0,0]=4 3228 B10R1.10 CCSc1cccc(C)c1 Amb25328608 [0,1,1,0,0,0|2,0,0]=4 3229 B10R1.10 CCSc1cccc(Cl)c1 Amb26318573 [0,1,1,0,0,0|2,0,0]=4 3230 B10R1.10 CCSc1cccc(F)c1 Amb25063729 [0,1,1,0,0,0|2,0,0]=4 3231 B10R1.10 CCSc1cccc(N)c1 Amb18950176 [0,1,1,0,0,0|2,0,0]=4 3232 B10R1.10 CCSc1cccc(O)c1 Amb18644674 [0,1,1,0,0,0|2,0,0]=4 3233 B10R1.10 CNCC1=CC=CC(=O)N1 Amb26044182 [0,1,1,0,0,0|2,0,0]=4 3234 B10R1.10 CNCC1=CC=CC(=O)N1 Amb29083318 [0,1,1,0,0,0|2,0,0]=4 3235 B10R1.10 CNCC1=CC=CC(=O)N1 Amb32932464 [0,1,1,0,0,0|2,0,0]=4 3236 B10R1.10 CNCc1cc(C)ccn1 Amb16230499 [0,1,1,0,0,0|2,0,0]=4 3237 B10R1.10 CNCc1cc(Cl)ccn1 Amb22728627 [0,1,1,0,0,0|2,0,0]=4 3238 B10R1.10 CNCc1cc(Cl)ccn1 Amb33330654 [0,1,1,0,0,0|2,0,0]=4 3239 B10R1.10 CNCc1cc(F)ccn1 Amb25749043 [0,1,1,0,0,0|2,0,0]=4 3240 B10R1.10 CNCc1cc(N)ccn1 Amb25062940 [0,1,1,0,0,0|2,0,0]=4 3241 B10R1.10 CNCc1cccc(Br)c1 Amb1114712 [0,1,1,0,0,0|1,0,0]=3 3242 B10R1.10 CNCc1cccc(Br)c1 Amb17935918 [0,1,1,0,0,0|1,0,0]=3 3243 B10R1.10 CNCc1cccc(Br)n1 Amb2725033 [0,1,1,0,0,0|2,0,0]=4 3244 B10R1.10 CNCc1cccc(C)c1 Amb33536586 [0,1,1,0,0,0|1,0,0]=3 3245 B10R1.10 CNCc1cccc(C)n1 Amb19374864 [0,1,1,0,0,0|2,0,0]=4 3246 B10R1.10 CNCc1cccc(C)n1 Amb2592510 [0,1,1,0,0,0|2,0,0]=4 3247 B10R1.10 CNCc1cccc(Cl)c1 Amb1648830 [0,1,1,0,0,0|1,0,0]=3 3248 B10R1.10 CNCc1cccc(Cl)n1 Amb24340482 [0,1,1,0,0,0|2,0,0]=4 3249 B10R1.10 CNCc1cccc(F)c1 Amb1647905 [0,1,1,0,0,0|1,0,0]=3 3250 B10R1.10 CNCc1cccc(F)c1 Amb30625686 [0,1,1,0,0,0|1,0,0]=3 3251 B10R1.10 CNCc1cccc(F)n1 Amb26478731 [0,1,1,0,0,0|2,0,0]=4 3252 B10R1.10 CNCc1cccc(I)c1 Amb23569027 [0,1,1,0,0,0|1,0,0]=3 3253 B10R1.10 CNCc1cccc(N)c1 Amb7173577 [0,1,1,0,0,0|1,0,0]=3 3254 B10R1.10 CNCc1cccc(N)n1 Amb26418834 [0,1,1,0,0,0|2,0,0]=4 3255 B10R1.10 CNCc1cccc(O)c1 Amb1131158 [0,1,1,0,0,0|1,0,0]=3 3256 B10R1.10 CNCc1cccc(O)c1 Amb19115406 [0,1,1,0,0,0|1,0,0]=3 3257 B10R1.10 CNCc1cccc(S)c1 Amb27598823 [0,1,1,0,0,0|1,0,0]=3 3258 B10R1.10 CNCc1ccnc(C)c1 Amb10607835 [0,1,1,0,0,0|2,0,0]=4 3259 B10R1.10 CNCc1ccnc(Cl)c1 Amb6572114 [0,1,1,0,0,0|2,0,0]=4 3260 B10R1.10 CNCc1cncc(Br)c1 Amb6572388 [0,1,1,0,0,0|2,0,0]=4 3261 B10R1.10 CNCc1cncc(C)c1 Amb24353440 [0,1,1,0,0,0|2,0,0]=4 3262 B10R1.10 CNCc1cncc(F)c1 Amb25146397 [0,1,1,0,0,0|2,0,0]=4 3263 B10R1.10 CNCc1cncc(N)c1 Amb26642008 [0,1,1,0,0,0|2,0,0]=4 3264 B10R1.10 CNNc1cccc(Cl)c1 Amb27445146 [0,1,1,0,0,0|2,0,0]=4 3265 B10R1.10 COBc1cccc(C)n1 Amb27823257 [0,1,1,0,0,0|2,0,0]=4 3266 B10R1.10 COCC1=CC(=O)NC=N1 Amb22059087 [0,1,1,0,0,0|2,0,0]=4 3267 B10R1.10 COCC1=CC(=S)NC=N1 Amb25966761 [0,1,1,0,0,0|2,0,0]=4 3268 B10R1.10 COCc1cc(Br)ccn1 Amb24320753 [0,1,1,0,0,0|1,0,0]=3 3269 B10R1.10 COCc1cc(Cl)ncn1 Amb15701369 [0,1,1,0,0,0|2,0,0]=4 3270 B10R1.10 COCc1cc(F)ncn1 Amb35649509 [0,1,1,0,0,0|2,0,0]=4 3271 B10R1.10 COCc1cc(I)ccn1 Amb27613007 [0,1,1,0,0,0|1,0,0]=3 3272 B10R1.10 COCc1cc(N)ccn1 Amb26429665 [0,1,1,0,0,0|1,0,0]=3 3273 B10R1.10 COCc1cc(N)ncn1 Amb15701379 [0,1,1,0,0,0|2,0,0]=4 3274 B10R1.10 COCc1cc(O)ncn1 Amb15701387 [0,1,1,0,0,0|2,0,0]=4 3275 B10R1.10 COCc1cccc(Br)c1 Amb18320155 [0,1,1,0,0,0|0,0,0]=2 3276 B10R1.10 COCc1cccc(Br)n1 Amb24320754 [0,1,1,0,0,0|1,0,0]=3 3277 B10R1.10 COCc1cccc(C)n1 Amb22345867 [0,1,1,0,0,0|1,0,0]=3 3278 B10R1.10 COCc1cccc(I)c1 Amb24478076 [0,1,1,0,0,0|0,0,0]=2 3279 B10R1.10 COCc1cccc(N)c1 Amb29847725 [0,1,1,0,0,0|0,0,0]=2 3280 B10R1.10 COCc1cccc(N)c1 Amb6250686 [0,1,1,0,0,0|0,0,0]=2 3281 B10R1.10 COCc1cccc(N)n1 Amb24375965 [0,1,1,0,0,0|1,0,0]=3 3282 B10R1.10 COCc1cccc(O)c1 Amb19301751 [0,1,1,0,0,0|0,0,0]=2 3283 B10R1.10 COCc1cccc(S)c1 Amb33226901 [0,1,1,0,0,0|0,0,0]=2 3284 B10R1.10 COCc1ccnc(Cl)c1 Amb18799911 [0,1,1,0,0,0|1,0,0]=3 3285 B10R1.10 COCc1ccnc(Cl)n1 Amb20618656 [0,1,1,0,0,0|2,0,0]=4 3286 B10R1.10 COCc1ccnc(N)c1 Amb18961777 [0,1,1,0,0,0|1,0,0]=3 3287 B10R1.10 COCc1ccnc(N)n1 Amb22491577 [0,1,1,0,0,0|2,0,0]=4 3288 B10R1.10 COCc1ccnc(S)n1 Amb26932209 [0,1,1,0,0,0|2,0,0]=4 3289 B10R1.10 COCc1cncc(Br)c1 Amb22235600 [0,1,1,0,0,0|1,0,0]=3 3290 B10R1.10 COCc1cncc(Br)n1 Amb24323045 [0,1,1,0,0,0|2,0,0]=4 3291 B10R1.10 COCc1cncc(Cl)c1 Amb27780983 [0,1,1,0,0,0|1,0,0]=3 3292 B10R1.10 COCc1cncc(Cl)n1 Amb28292495 [0,1,1,0,0,0|2,0,0]=4 3293 B10R1.10 COCc1nccc(Cl)n1 Amb18179865 [0,1,1,0,0,0|2,0,0]=4 3294 B10R1.10 COCc1nccc(F)n1 Amb35642809 [0,1,1,0,0,0|2,0,0]=4 3295 B10R1.10 COCc1nccc(N)n1 Amb18284411 [0,1,1,0,0,0|2,0,0]=4 3296 B10R1.10 COCc1nccc(O)n1 Amb23443692 [0,1,1,0,0,0|2,0,0]=4 3297 B10R1.10 CSCc1cccc(Br)c1 Amb22058705 [0,1,1,0,0,0|0,1,0]=3 3298 B10R1.10 CSCc1cccc(Cl)c1 Amb27469155 [0,1,1,0,0,0|0,1,0]=3 3299 B10R1.10 CSCc1cccc(F)c1 Amb25978150 [0,1,1,0,0,0|0,1,0]=3 3300 B10R1.10 CSCc1cccc(I)c1 Amb32685575 [0,1,1,0,0,0|0,1,0]=3 3301 B10R1.10 CSCc1cccc(N)c1 Amb18951026 [0,1,1,0,0,0|0,1,0]=3 3302 B10R1.10 CSCc1cccc(N)n1 Amb27397188 [0,1,1,0,0,0|1,1,0]=4 3303 B10R1.10 CSCc1cccc(O)c1 Amb23443323 [0,1,1,0,0,0|0,1,0]=3 3304 B10R1.10 CSCc1ccnc(Cl)c1 Amb18185802 [0,1,1,0,0,0|1,1,0]=4 3305 B10R1.10 CSCc1ccnc(N)c1 Amb18284923 [0,1,1,0,0,0|1,1,0]=4 3306 B10R1.10 C\C=C\c1cccc(N)c1 Amb27162745 [0,1,1,0,0,0|1,0,1]=4 3307 B10R1.10 C\N=C\c1cccc(C)c1 Amb24524529 [0,1,1,0,0,0|1,0,1]=4 3308 B10R1.10 C\N=C\c1cccc(O)c1 Amb19115409 [0,1,1,0,0,0|1,0,1]=4 3309 B10R1.10 Cc1cc(CCBr)ccn1 Amb33004944 [0,1,1,0,0,0|2,0,0]=4 3310 B10R1.10 Cc1cc(CCN)ccn1 Amb18203094 [0,1,1,0,0,0|2,0,0]=4 3311 B10R1.10 Cc1cc(CCN)ccn1 Amb33309646 [0,1,1,0,0,0|2,0,0]=4 3312 B10R1.10 Cc1cc(CCO)ccn1 Amb24568116 [0,1,1,0,0,0|1,0,0]=3 3313 B10R1.10 Cc1cc(CCS)ccn1 Amb32732786 [0,1,1,0,0,0|1,1,0]=4 3314 B10R1.10 Cc1cc(CNO)ccn1 Amb33449918 [0,1,1,0,0,0|2,0,0]=4 3315 B10R1.10 Cc1cc(CON)ccn1 Amb33172246 [0,1,1,0,0,0|2,0,0]=4 3316 B10R1.10 Cc1ccc[n+](CCO)c1 Amb27588939 [0,1,1,0,0,0|1,0,0]=3 3317 B10R1.10 Cc1cccc(CC#N)c1 Amb3939783 [0,1,1,0,0,0|1,0,1]=4 3318 B10R1.10 Cc1cccc(CC=O)c1 Amb16230453 [0,1,1,0,0,0|0,0,2]=4 3319 B10R1.10 Cc1cccc(CCBr)c1 Amb2685164 [0,1,1,0,0,0|1,0,0]=3 3320 B10R1.10 Cc1cccc(CCBr)n1 Amb2695438 [0,1,1,0,0,0|2,0,0]=4 3321 B10R1.10 Cc1cccc(CCBr)n1 Amb8630116 [0,1,1,0,0,0|2,0,0]=4 3322 B10R1.10 Cc1cccc(CCCl)c1 Amb18181942 [0,1,1,0,0,0|1,0,0]=3 3323 B10R1.10 Cc1cccc(CCI)c1 Amb26332327 [0,1,1,0,0,0|1,0,0]=3 3324 B10R1.10 Cc1cccc(CCN)c1 Amb1126573 [0,1,1,0,0,0|1,0,0]=3 3325 B10R1.10 Cc1cccc(CCN)c1 Amb13952645 [0,1,1,0,0,0|1,0,0]=3 3326 B10R1.10 Cc1cccc(CCN)n1 Amb1995202 [0,1,1,0,0,0|2,0,0]=4 3327 B10R1.10 Cc1cccc(CCN)n1 Amb33378982 [0,1,1,0,0,0|2,0,0]=4 3328 B10R1.10 Cc1cccc(CCN)n1 Amb33378983 [0,1,1,0,0,0|2,0,0]=4 3329 B10R1.10 Cc1cccc(CCO)c1 Amb3939096 [0,1,1,0,0,0|0,0,0]=2 3330 B10R1.10 Cc1cccc(CCO)n1 Amb8630091 [0,1,1,0,0,0|1,0,0]=3 3331 B10R1.10 Cc1cccc(CCS)c1 Amb17399939 [0,1,1,0,0,0|0,1,0]=3 3332 B10R1.10 Cc1cccc(CCS)n1 Amb24388552 [0,1,1,0,0,0|1,1,0]=4 3333 B10R1.10 Cc1cccc(CNN)c1 Amb1116333 [0,1,1,0,0,0|2,0,0]=4 3334 B10R1.10 Cc1cccc(CNN)c1 Amb19890111 [0,1,1,0,0,0|2,0,0]=4 3335 B10R1.10 Cc1cccc(CNN)c1 Amb33527910 [0,1,1,0,0,0|2,0,0]=4 3336 B10R1.10 Cc1cccc(CNO)c1 Amb25784359 [0,1,1,0,0,0|1,0,0]=3 3337 B10R1.10 Cc1cccc(CNO)n1 Amb33200760 [0,1,1,0,0,0|2,0,0]=4 3338 B10R1.10 Cc1cccc(CON)c1 Amb17091425 [0,1,1,0,0,0|1,0,0]=3 3339 B10R1.10 Cc1cccc(CON)n1 Amb24538057 [0,1,1,0,0,0|2,0,0]=4 3340 B10R1.10 Cc1cccc(CON)n1 Amb33109813 [0,1,1,0,0,0|2,0,0]=4 3341 B10R1.10 Cc1cccc(C[Zn]Cl)c1 Amb22000456 [0,1,1,0,0,0|2,0,0]=4 3342 B10R1.10 Cc1cccc(OCCl)c1 Amb27618304 [0,1,1,0,0,0|2,0,0]=4 3343 B10R1.10 Cc1cccc(SCCl)c1 Amb24423887 [0,1,1,0,0,0|2,0,0]=4 3344 B10R1.10 Cc1cccc(\C=N\O)c1 Amb18041948 [0,1,1,0,0,0|1,0,1]=4 3345 B10R1.10 Cc1ccnc(CCBr)c1 Amb26973853 [0,1,1,0,0,0|2,0,0]=4 3346 B10R1.10 Cc1ccnc(CCN)c1 Amb1995201 [0,1,1,0,0,0|2,0,0]=4 3347 B10R1.10 Cc1ccnc(CCO)c1 Amb25679639 [0,1,1,0,0,0|1,0,0]=3 3348 B10R1.10 Cc1ccnc(CCO)n1 Amb25943732 [0,1,1,0,0,0|2,0,0]=4 3349 B10R1.10 Cc1ccnc(CCS)c1 Amb33317782 [0,1,1,0,0,0|1,1,0]=4 3350 B10R1.10 Cc1ccnc(CNO)c1 Amb33316100 [0,1,1,0,0,0|2,0,0]=4 3351 B10R1.10 Cc1ccnc(CON)c1 Amb26870354 [0,1,1,0,0,0|2,0,0]=4 3352 B10R1.10 Cc1cncc(CCBr)c1 Amb24562207 [0,1,1,0,0,0|2,0,0]=4 3353 B10R1.10 Cc1cncc(CCN)c1 Amb18203095 [0,1,1,0,0,0|2,0,0]=4 3354 B10R1.10 Cc1cncc(CCO)c1 Amb2695472 [0,1,1,0,0,0|1,0,0]=3 3355 B10R1.10 Cc1cncc(CCO)n1 Amb26424098 [0,1,1,0,0,0|2,0,0]=4 3356 B10R1.10 Cc1cncc(CCS)c1 Amb33316890 [0,1,1,0,0,0|1,1,0]=4 3357 B10R1.10 Cc1cncc(CNO)c1 Amb33318691 [0,1,1,0,0,0|2,0,0]=4 3358 B10R1.10 Cc1cncc(CON)c1 Amb24626236 [0,1,1,0,0,0|2,0,0]=4 3359 B10R1.10 ClCCc1cccc(Br)c1 Amb24502263 [0,1,1,0,0,0|1,0,0]=3 3360 B10R1.10 ClCCc1cccc(Cl)c1 Amb18185798 [0,1,1,0,0,0|1,0,0]=3 3361 B10R1.10 ClCCc1cccc(I)c1 Amb27771694 [0,1,1,0,0,0|1,0,0]=3 3362 B10R1.10 ClCOc1cccc(Br)c1 Amb26977241 [0,1,1,0,0,0|2,0,0]=4 3363 B10R1.10 ClCOc1cccc(Cl)c1 Amb24482267 [0,1,1,0,0,0|2,0,0]=4 3364 B10R1.10 ClCOc1cccc(I)c1 Amb25272062 [0,1,1,0,0,0|2,0,0]=4 3365 B10R1.10 ClCSc1cccc(Br)c1 Amb24479383 [0,1,1,0,0,0|2,0,0]=4 3366 B10R1.10 ClCSc1cccc(I)c1 Amb28041639 [0,1,1,0,0,0|2,0,0]=4 3367 B10R1.10 Cl[Zn]Cc1cccc(Cl)c1 Amb22000428 [0,1,1,0,0,0|2,0,0]=4 3368 B10R1.10 Clc1cc(CCBr)ccn1 Amb33452116 [0,1,1,0,0,0|2,0,0]=4 3369 B10R1.10 Clc1cccc(CCBr)c1 Amb2685156 [0,1,1,0,0,0|1,0,0]=3 3370 B10R1.10 Clc1cccc(CCBr)n1 Amb33006804 [0,1,1,0,0,0|2,0,0]=4 3371 B10R1.10 Clc1cccc(CCI)c1 Amb27804535 [0,1,1,0,0,0|1,0,0]=3 3372 B10R1.10 Clc1ccnc(CCBr)c1 Amb33432278 [0,1,1,0,0,0|2,0,0]=4 3373 B10R1.10 Fc1cccc(CCBr)c1 Amb2688284 [0,1,1,0,0,0|1,0,0]=3 3374 B10R1.10 Fc1cccc(CCCl)c1 Amb9004325 [0,1,1,0,0,0|1,0,0]=3 3375 B10R1.10 Fc1cccc(CCI)c1 Amb25766475 [0,1,1,0,0,0|1,0,0]=3 3376 B10R1.10 Fc1cccc(CCS)c1 Amb17400006 [0,1,1,0,0,0|0,1,0]=3 3377 B10R1.10 Fc1cccc(C[Mg]Cl)c1 Amb17672020 [0,1,1,0,0,0|2,0,0]=4 3378 B10R1.10 Fc1cccc(C[Zn]Cl)c1 Amb17938200 [0,1,1,0,0,0|2,0,0]=4 3379 B10R1.10 Fc1cccc(OCCl)c1 Amb24401502 [0,1,1,0,0,0|2,0,0]=4 3380 B10R1.10 Fc1cccc(SCCl)c1 Amb26651935 [0,1,1,0,0,0|2,0,0]=4 3381 B10R1.10 Fc1ccnc(CCBr)c1 Amb33433794 [0,1,1,0,0,0|2,0,0]=4 3382 B10R1.10 Fc1ccnc(CCS)c1 Amb33325109 [0,1,1,0,0,0|1,1,0]=4 3383 B10R1.10 Fc1cncc(CCBr)c1 Amb25210409 [0,1,1,0,0,0|2,0,0]=4 3384 B10R1.10 Fc1cncc(CCCl)c1 Amb18797759 [0,1,1,0,0,0|2,0,0]=4 3385 B10R1.10 Fc1cncc(CCCl)c1 Amb33038080 [0,1,1,0,0,0|2,0,0]=4 3386 B10R1.10 Fc1cncc(CCS)c1 Amb33480664 [0,1,1,0,0,0|1,1,0]=4 3387 B10R1.10 N#CCc1cccc(Br)c1 Amb1138679 [0,1,1,0,0,0|1,0,1]=4 3388 B10R1.10 N#CCc1cccc(Cl)c1 Amb1651451 [0,1,1,0,0,0|1,0,1]=4 3389 B10R1.10 N#CCc1cccc(F)c1 Amb528107 [0,1,1,0,0,0|1,0,1]=4 3390 B10R1.10 N#CCc1cccc(I)c1 Amb2688871 [0,1,1,0,0,0|1,0,1]=4 3391 B10R1.10 N#CCc1cccc(N)c1 Amb1215231 [0,1,1,0,0,0|1,0,1]=4 3392 B10R1.10 N#CCc1cccc(N)c1 Amb21857787 [0,1,1,0,0,0|1,0,1]=4 3393 B10R1.10 N#CCc1cccc(O)c1 Amb6298167 [0,1,1,0,0,0|1,0,1]=4 3394 B10R1.10 N#CCc1cccc(S)c1 Amb27265918 [0,1,1,0,0,0|1,0,1]=4 3395 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22277083 [0,1,1,0,0,0|2,0,0]=4 3396 B10R1.10 NCCC1=CC=CC(=O)N1 Amb22492307 [0,1,1,0,0,0|2,0,0]=4 3397 B10R1.10 NCCC1=CC=CC(=O)N1 Amb22587551 [0,1,1,0,0,0|2,0,0]=4 3398 B10R1.10 NCCc1cc(Br)ccn1 Amb25839315 [0,1,1,0,0,0|2,0,0]=4 3399 B10R1.10 NCCc1cc(Cl)ccn1 Amb26508063 [0,1,1,0,0,0|2,0,0]=4 3400 B10R1.10 NCCc1cc(F)ccn1 Amb27207092 [0,1,1,0,0,0|2,0,0]=4 3401 B10R1.10 NCCc1cccc(Br)c1 Amb22900947 [0,1,1,0,0,0|1,0,0]=3 3402 B10R1.10 NCCc1cccc(Br)c1 Amb6365736 [0,1,1,0,0,0|1,0,0]=3 3403 B10R1.10 NCCc1cccc(Br)n1 Amb21856983 [0,1,1,0,0,0|2,0,0]=4 3404 B10R1.10 NCCc1cccc(Cl)c1 Amb1212556 [0,1,1,0,0,0|1,0,0]=3 3405 B10R1.10 NCCc1cccc(Cl)n1 Amb21857735 [0,1,1,0,0,0|2,0,0]=4 3406 B10R1.10 NCCc1cccc(F)c1 Amb838765 [0,1,1,0,0,0|1,0,0]=3 3407 B10R1.10 NCCc1cccc(F)n1 Amb20669134 [0,1,1,0,0,0|2,0,0]=4 3408 B10R1.10 NCCc1cccc(I)c1 Amb25096322 [0,1,1,0,0,0|1,0,0]=3 3409 B10R1.10 NCCc1cccc(N)c1 Amb8631279 [0,1,1,0,0,0|1,0,0]=3 3410 B10R1.10 NCCc1cccc(N)c1 Amb8631364 [0,1,1,0,0,0|1,0,0]=3 3411 B10R1.10 NCCc1cccc(N)n1 Amb1100181 [0,1,1,0,0,0|2,0,0]=4 3412 B10R1.10 NCCc1cccc(O)c1 Amb2688778 [0,1,1,0,0,0|1,0,0]=3 3413 B10R1.10 NCCc1cccc(O)c1 Amb6243326 [0,1,1,0,0,0|1,0,0]=3 3414 B10R1.10 NCCc1cccc(O)c1 Amb6297567 [0,1,1,0,0,0|1,0,0]=3 3415 B10R1.10 NCCc1cccc(S)c1 Amb27862515 [0,1,1,0,0,0|1,0,0]=3 3416 B10R1.10 NCCc1cccn(=O)c1 Amb20621202 [0,1,1,0,0,0|2,0,0]=4 3417 B10R1.10 NCCc1ccnc(Br)c1 Amb26974330 [0,1,1,0,0,0|2,0,0]=4 3418 B10R1.10 NCCc1ccnc(Cl)c1 Amb26080294 [0,1,1,0,0,0|2,0,0]=4 3419 B10R1.10 NCCc1ccnc(F)c1 Amb25992462 [0,1,1,0,0,0|2,0,0]=4 3420 B10R1.10 NCCc1ccnc(N)c1 Amb28555504 [0,1,1,0,0,0|2,0,0]=4 3421 B10R1.10 NCCc1ccnc(N)c1 Amb33532630 [0,1,1,0,0,0|2,0,0]=4 3422 B10R1.10 NCCc1ccnc(O)c1 Amb32670801 [0,1,1,0,0,0|2,0,0]=4 3423 B10R1.10 NCCc1cncc(Br)c1 Amb27657044 [0,1,1,0,0,0|2,0,0]=4 3424 B10R1.10 NCCc1cncc(Cl)c1 Amb25889904 [0,1,1,0,0,0|2,0,0]=4 3425 B10R1.10 NCCc1cncc(F)c1 Amb18286591 [0,1,1,0,0,0|2,0,0]=4 3426 B10R1.10 NCCc1cncc(O)c1 Amb25744014 [0,1,1,0,0,0|2,0,0]=4 3427 B10R1.10 NNCc1cccc(Br)c1 Amb1119246 [0,1,1,0,0,0|2,0,0]=4 3428 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [0,1,1,0,0,0|2,0,0]=4 3429 B10R1.10 NNCc1cccc(Br)c1 Amb33537274 [0,1,1,0,0,0|2,0,0]=4 3430 B10R1.10 NNCc1cccc(Cl)c1 Amb1111798 [0,1,1,0,0,0|2,0,0]=4 3431 B10R1.10 NNCc1cccc(Cl)c1 Amb13949121 [0,1,1,0,0,0|2,0,0]=4 3432 B10R1.10 NNCc1cccc(Cl)c1 Amb33714445 [0,1,1,0,0,0|2,0,0]=4 3433 B10R1.10 NNCc1cccc(F)c1 Amb1121411 [0,1,1,0,0,0|2,0,0]=4 3434 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [0,1,1,0,0,0|2,0,0]=4 3435 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [0,1,1,0,0,0|2,0,0]=4 3436 B10R1.10 NNCc1cccc(N)c1 Amb27810603 [0,1,1,0,0,0|2,0,0]=4 3437 B10R1.10 NNCc1cccc(O)c1 Amb3940160 [0,1,1,0,0,0|2,0,0]=4 3438 B10R1.10 NNCc1cccc(O)c1 Amb6336419 [0,1,1,0,0,0|2,0,0]=4 3439 B10R1.10 NOCc1cc(F)ccn1 Amb33320314 [0,1,1,0,0,0|2,0,0]=4 3440 B10R1.10 NOCc1cccc(Br)c1 Amb17091429 [0,1,1,0,0,0|1,0,0]=3 3441 B10R1.10 NOCc1cccc(Br)n1 Amb33433118 [0,1,1,0,0,0|2,0,0]=4 3442 B10R1.10 NOCc1cccc(Cl)c1 Amb17091428 [0,1,1,0,0,0|1,0,0]=3 3443 B10R1.10 NOCc1cccc(Cl)c1 Amb19889790 [0,1,1,0,0,0|1,0,0]=3 3444 B10R1.10 NOCc1cccc(Cl)n1 Amb24640482 [0,1,1,0,0,0|2,0,0]=4 3445 B10R1.10 NOCc1cccc(F)c1 Amb17091426 [0,1,1,0,0,0|1,0,0]=3 3446 B10R1.10 NOCc1cccc(F)c1 Amb19883930 [0,1,1,0,0,0|1,0,0]=3 3447 B10R1.10 NOCc1cccc(I)c1 Amb27626521 [0,1,1,0,0,0|1,0,0]=3 3448 B10R1.10 NOCc1cccc(O)c1 Amb27476207 [0,1,1,0,0,0|1,0,0]=3 3449 B10R1.10 NOCc1ccnc(Cl)c1 Amb22396234 [0,1,1,0,0,0|2,0,0]=4 3450 B10R1.10 NOCc1cncc(Br)c1 Amb25788255 [0,1,1,0,0,0|2,0,0]=4 3451 B10R1.10 NOCc1cncc(F)c1 Amb27466802 [0,1,1,0,0,0|2,0,0]=4 3452 B10R1.10 Nc1cc(CCCl)ccn1 Amb27256820 [0,1,1,0,0,0|2,0,0]=4 3453 B10R1.10 Nc1cc(CCO)ccn1 Amb33545323 [0,1,1,0,0,0|1,0,0]=3 3454 B10R1.10 Nc1cccc(CCF)c1 Amb26318675 [0,1,1,0,0,0|1,0,0]=3 3455 B10R1.10 Nc1cccc(CCO)c1 Amb21857105 [0,1,1,0,0,0|0,0,0]=2 3456 B10R1.10 Nc1cccc(CCO)n1 Amb24401500 [0,1,1,0,0,0|1,0,0]=3 3457 B10R1.10 Nc1ccnc(CCO)c1 Amb25027828 [0,1,1,0,0,0|1,0,0]=3 3458 B10R1.10 Nc1ccnc(CCO)n1 Amb24583224 [0,1,1,0,0,0|2,0,0]=4 3459 B10R1.10 O=C1C=CC=C(CCO)N1 Amb28049556 [0,1,1,0,0,0|1,0,0]=3 3460 B10R1.10 O=C1N=C(CCO)C=CN1 Amb24639313 [0,1,1,0,0,0|2,0,0]=4 3461 B10R1.10 O=CCc1cccc(Br)c1 Amb16230449 [0,1,1,0,0,0|0,0,2]=4 3462 B10R1.10 O=CCc1cccc(Cl)c1 Amb10844835 [0,1,1,0,0,0|0,0,2]=4 3463 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [0,1,1,0,0,0|0,0,2]=4 3464 B10R1.10 O=CCc1cccc(O)c1 Amb17089543 [0,1,1,0,0,0|0,0,2]=4 3465 B10R1.10 OCCc1cc(Br)ccn1 Amb24065849 [0,1,1,0,0,0|1,0,0]=3 3466 B10R1.10 OCCc1cc(Cl)ccn1 Amb26631453 [0,1,1,0,0,0|1,0,0]=3 3467 B10R1.10 OCCc1cc(F)ccn1 Amb25032462 [0,1,1,0,0,0|1,0,0]=3 3468 B10R1.10 OCCc1cccc(Br)c1 Amb3939211 [0,1,1,0,0,0|0,0,0]=2 3469 B10R1.10 OCCc1cccc(Br)n1 Amb13883481 [0,1,1,0,0,0|1,0,0]=3 3470 B10R1.10 OCCc1cccc(Cl)c1 Amb3939105 [0,1,1,0,0,0|0,0,0]=2 3471 B10R1.10 OCCc1cccc(Cl)n1 Amb27478282 [0,1,1,0,0,0|1,0,0]=3 3472 B10R1.10 OCCc1cccc(F)c1 Amb3939215 [0,1,1,0,0,0|0,0,0]=2 3473 B10R1.10 OCCc1cccc(F)n1 Amb25076783 [0,1,1,0,0,0|1,0,0]=3 3474 B10R1.10 OCCc1cccc(I)c1 Amb24524319 [0,1,1,0,0,0|0,0,0]=2 3475 B10R1.10 OCCc1cccc(O)c1 Amb3940102 [0,1,1,0,0,0|0,0,0]=2 3476 B10R1.10 OCCc1cccc(S)c1 Amb27961582 [0,1,1,0,0,0|0,0,0]=2 3477 B10R1.10 OCCc1ccnc(Cl)c1 Amb22754705 [0,1,1,0,0,0|1,0,0]=3 3478 B10R1.10 OCCc1ccnc(F)c1 Amb27963558 [0,1,1,0,0,0|1,0,0]=3 3479 B10R1.10 OCCc1cncc(Br)c1 Amb25114229 [0,1,1,0,0,0|1,0,0]=3 3480 B10R1.10 OCCc1cncc(F)c1 Amb25872080 [0,1,1,0,0,0|1,0,0]=3 3481 B10R1.10 OCCc1nccc(O)n1 Amb24454001 [0,1,1,0,0,0|2,0,0]=4 3482 B10R1.10 OCNc1cccc(F)c1 Amb27168168 [0,1,1,0,0,0|1,0,0]=3 3483 B10R1.10 ONCc1cc(F)ccn1 Amb33415816 [0,1,1,0,0,0|2,0,0]=4 3484 B10R1.10 ONCc1cccc(Br)c1 Amb23449439 [0,1,1,0,0,0|1,0,0]=3 3485 B10R1.10 ONCc1cccc(Br)n1 Amb24647347 [0,1,1,0,0,0|2,0,0]=4 3486 B10R1.10 ONCc1cccc(Cl)c1 Amb25210787 [0,1,1,0,0,0|1,0,0]=3 3487 B10R1.10 ONCc1cccc(Cl)n1 Amb33223269 [0,1,1,0,0,0|2,0,0]=4 3488 B10R1.10 ONCc1cccc(F)c1 Amb26060054 [0,1,1,0,0,0|1,0,0]=3 3489 B10R1.10 ONCc1cccc(I)c1 Amb28077250 [0,1,1,0,0,0|1,0,0]=3 3490 B10R1.10 ONCc1cccc(O)c1 Amb24524626 [0,1,1,0,0,0|1,0,0]=3 3491 B10R1.10 ONCc1cncc(Br)c1 Amb26848329 [0,1,1,0,0,0|2,0,0]=4 3492 B10R1.10 ONCc1cncc(F)c1 Amb33312713 [0,1,1,0,0,0|2,0,0]=4 3493 B10R1.10 O\N=C/c1cccc(Cl)c1 Amb28135506 [0,1,1,0,0,0|1,0,1]=4 3494 B10R1.10 O\N=C\c1cccc(Br)c1 Amb6297363 [0,1,1,0,0,0|1,0,1]=4 3495 B10R1.10 O\N=C\c1cccc(Cl)c1 Amb1776533 [0,1,1,0,0,0|1,0,1]=4 3496 B10R1.10 O\N=C\c1cccc(F)c1 Amb1152958 [0,1,1,0,0,0|1,0,1]=4 3497 B10R1.10 O\N=C\c1cccc(I)c1 Amb1831123 [0,1,1,0,0,0|1,0,1]=4 3498 B10R1.10 O\N=C\c1cccc(O)c1 Amb5837376 [0,1,1,0,0,0|1,0,1]=4 3499 B10R1.10 Oc1cccc(CCBr)c1 Amb18130690 [0,1,1,0,0,0|1,0,0]=3 3500 B10R1.10 Oc1cccc(CCF)c1 Amb27411445 [0,1,1,0,0,0|1,0,0]=3 3501 B10R1.10 Oc1cccc(CCI)c1 Amb27494566 [0,1,1,0,0,0|1,0,0]=3 3502 B10R1.10 Oc1cccc(CCS)c1 Amb33310795 [0,1,1,0,0,0|0,1,0]=3 3503 B10R1.10 Oc1cccc(SCCl)c1 Amb24368844 [0,1,1,0,0,0|2,0,0]=4 3504 B10R1.10 SCCc1cccc(Br)c1 Amb17404678 [0,1,1,0,0,0|0,1,0]=3 3505 B10R1.10 SCCc1cccc(Br)n1 Amb33433833 [0,1,1,0,0,0|1,1,0]=4 3506 B10R1.10 SCCc1cccc(Cl)c1 Amb17400375 [0,1,1,0,0,0|0,1,0]=3 3507 B10R1.10 SCCc1cccc(Cl)n1 Amb33222711 [0,1,1,0,0,0|1,1,0]=4 3508 B10R1.10 SCCc1cncc(Br)c1 Amb33389406 [0,1,1,0,0,0|1,1,0]=4 3509 B10R1.10 Sc1cccc(CCBr)c1 Amb27628134 [0,1,1,0,0,0|1,0,0]=3 3510 B10R1.10 [C-]#[N+]Cc1cccc(Br)c1 Amb3973086 [0,1,1,0,0,0|1,0,1]=4 3511 B10R1.10 [C-]#[N+]Cc1cccc(C)c1 Amb2689350 [0,1,1,0,0,0|1,0,1]=4 3512 B10R1.10 [C-]#[N+]Cc1cccc(Cl)c1 Amb2685777 [0,1,1,0,0,0|1,0,1]=4 3513 B10R1.10 [C-]#[N+]Cc1cccc(F)c1 Amb2688051 [0,1,1,0,0,0|1,0,1]=4 3514 B10R1.10 [NH3+]OCc1cccc(F)c1 Amb2424153 [0,1,1,0,0,0|1,0,0]=3 3515 B10R1.17 BrCC#Cc1ccccc1 Amb26032687 [0,1,1,0,0,0|1,0,1]=4 3516 B10R1.17 BrCCCc1ccccc1 Amb2721516 [0,1,1,0,0,0|1,0,0]=3 3517 B10R1.17 BrCCCc1ccccn1 Amb27866171 [0,1,1,0,0,0|2,0,0]=4 3518 B10R1.17 BrCCCc1cccnc1 Amb1102301 [0,1,1,0,0,0|2,0,0]=4 3519 B10R1.17 BrCCCc1cccnc1 Amb17610084 [0,1,1,0,0,0|2,0,0]=4 3520 B10R1.17 BrCCCc1ccncc1 Amb32751195 [0,1,1,0,0,0|2,0,0]=4 3521 B10R1.17 BrCCOc1ccccc1 Amb1152333 [0,1,1,0,0,0|1,0,0]=3 3522 B10R1.17 BrCCOc1cccnc1 Amb33109804 [0,1,1,0,0,0|2,0,0]=4 3523 B10R1.17 BrCCOc1cccnc1 Amb9783592 [0,1,1,0,0,0|2,0,0]=4 3524 B10R1.17 BrCCSc1ccccc1 Amb6255409 [0,1,1,0,0,0|1,0,0]=3 3525 B10R1.17 BrCCSc1ccncc1 Amb28206814 [0,1,1,0,0,0|2,0,0]=4 3526 B10R1.17 BrCCSc1ccncc1 Amb32670844 [0,1,1,0,0,0|2,0,0]=4 3527 B10R1.17 BrCOCc1ccccc1 Amb27410470 [0,1,1,0,0,0|0,0,0]=2 3528 B10R1.17 BrC\C=C\c1ccccc1 Amb8513086 [0,1,1,0,0,0|1,0,1]=4 3529 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [0,1,1,0,0,0|1,0,0]=3 3530 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [0,1,1,0,0,0|1,0,1]=4 3531 B10R1.17 C#CCCc1ccccc1 Amb6336492 [0,1,1,0,0,0|1,0,0]=3 3532 B10R1.17 C#CCCc1ccccn1 Amb24571654 [0,1,1,0,0,0|2,0,0]=4 3533 B10R1.17 C#CCCc1cccnc1 Amb24085226 [0,1,1,0,0,0|2,0,0]=4 3534 B10R1.17 C#CCCc1ccncc1 Amb24091331 [0,1,1,0,0,0|2,0,0]=4 3535 B10R1.17 C#CCOc1ccccc1 Amb839455 [0,1,1,0,0,0|1,0,1]=4 3536 B10R1.17 C#CCSc1ccccc1 Amb3836098 [0,1,1,0,0,0|1,0,1]=4 3537 B10R1.17 C=CCCc1ccccc1 Amb2721241 [0,1,1,0,0,0|1,0,0]=3 3538 B10R1.17 C=CCCc1ccccn1 Amb25337662 [0,1,1,0,0,0|2,0,0]=4 3539 B10R1.17 C=CCCc1cccnc1 Amb24477186 [0,1,1,0,0,0|2,0,0]=4 3540 B10R1.17 C=CCNc1ccccc1 Amb2720315 [0,1,1,0,0,0|1,0,1]=4 3541 B10R1.17 C=CCOc1ccccc1 Amb2842273 [0,1,1,0,0,0|1,0,1]=4 3542 B10R1.17 C=CCSc1ccccc1 Amb3836099 [0,1,1,0,0,0|1,0,1]=4 3543 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,1,1,0,0,0|0,0,1]=3 3544 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [0,1,1,0,0,0|1,0,1]=4 3545 B10R1.17 CCCC[n+]1ccccc1 Amb8393211 [0,1,1,0,0,0|2,0,0]=4 3546 B10R1.17 CCCC[n+]1ccccc1 Amb8516223 [0,1,1,0,0,0|2,0,0]=4 3547 B10R1.17 CCCC[n+]1ccccc1 Amb8516227 [0,1,1,0,0,0|2,0,0]=4 3548 B10R1.17 CCCC[n+]1ccccc1 Amb8516263 [0,1,1,0,0,0|2,0,0]=4 3549 B10R1.17 CCCCc1ccccc1 Amb6608912 [0,1,1,0,0,0|1,0,0]=3 3550 B10R1.17 CCCCc1ccccn1 Amb8395993 [0,1,1,0,0,0|2,0,0]=4 3551 B10R1.17 CCCCc1cccnc1 Amb4037068 [0,1,1,0,0,0|2,0,0]=4 3552 B10R1.17 CCCCc1ccncc1 Amb10555008 [0,1,1,0,0,0|2,0,0]=4 3553 B10R1.17 CCCNc1ccccc1 Amb534130 [0,1,1,0,0,0|1,0,0]=3 3554 B10R1.17 CCCNc1cccnc1 Amb6686632 [0,1,1,0,0,0|2,0,0]=4 3555 B10R1.17 CCCNc1ccncc1 Amb6614447 [0,1,1,0,0,0|2,0,0]=4 3556 B10R1.17 CCCOc1ccccc1 Amb2842271 [0,1,1,0,0,0|1,0,0]=3 3557 B10R1.17 CCCSc1ccccc1 Amb4014460 [0,1,1,0,0,0|1,0,0]=3 3558 B10R1.17 CCCSc1ccccn1 Amb24733306 [0,1,1,0,0,0|2,0,0]=4 3559 B10R1.17 CCCSc1ccncc1 Amb28126322 [0,1,1,0,0,0|2,0,0]=4 3560 B10R1.17 CCNCc1ccccc1 Amb3699539 [0,1,1,0,0,0|1,0,0]=3 3561 B10R1.17 CCNCc1ccccn1 Amb2592098 [0,1,1,0,0,0|2,0,0]=4 3562 B10R1.17 CCNCc1cccnc1 Amb21972163 [0,1,1,0,0,0|2,0,0]=4 3563 B10R1.17 CCNCc1cccnc1 Amb837759 [0,1,1,0,0,0|2,0,0]=4 3564 B10R1.17 CCNCc1ccncc1 Amb1214646 [0,1,1,0,0,0|2,0,0]=4 3565 B10R1.17 CCOCc1ccccc1 Amb9787555 [0,1,1,0,0,0|0,0,0]=2 3566 B10R1.17 CCOCc1ccccn1 Amb27267027 [0,1,1,0,0,0|1,0,0]=3 3567 B10R1.17 CCOCc1ccncc1 Amb27255285 [0,1,1,0,0,0|1,0,0]=3 3568 B10R1.17 CCOSc1ccccc1 Amb28049338 [0,1,1,0,0,0|1,0,0]=3 3569 B10R1.17 CCSCc1ccccc1 Amb9787636 [0,1,1,0,0,0|0,1,0]=3 3570 B10R1.17 CCSCc1ccccn1 Amb28124640 [0,1,1,0,0,0|1,1,0]=4 3571 B10R1.17 CCSCc1cccnc1 Amb26909883 [0,1,1,0,0,0|1,1,0]=4 3572 B10R1.17 CCSSc1ccccc1 Amb28057163 [0,1,1,0,0,0|1,1,0]=4 3573 B10R1.17 CC\C=C\c1ccccc1 Amb17673826 [0,1,1,0,0,0|1,0,1]=4 3574 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [0,1,1,0,0,0|1,0,1]=4 3575 B10R1.17 CN=C=Cc1ccccc1 Amb27423885 [0,1,1,0,0,0|1,0,1]=4 3576 B10R1.17 CNC#Cc1ccccc1 Amb28422275 [0,1,1,0,0,0|1,0,1]=4 3577 B10R1.17 CNCCc1ccccc1 Amb1132990 [0,1,1,0,0,0|1,0,0]=3 3578 B10R1.17 CNCCc1ccccc1 Amb33545919 [0,1,1,0,0,0|1,0,0]=3 3579 B10R1.17 CNCCc1ccccn1 Amb1651624 [0,1,1,0,0,0|2,0,0]=4 3580 B10R1.17 CNCCc1ccccn1 Amb22167479 [0,1,1,0,0,0|2,0,0]=4 3581 B10R1.17 CNCCc1ccccn1 Amb6741463 [0,1,1,0,0,0|2,0,0]=4 3582 B10R1.17 CNCCc1cccnc1 Amb10068754 [0,1,1,0,0,0|2,0,0]=4 3583 B10R1.17 CNCCc1cccnc1 Amb10576410 [0,1,1,0,0,0|2,0,0]=4 3584 B10R1.17 CNCCc1ccncc1 Amb10071184 [0,1,1,0,0,0|2,0,0]=4 3585 B10R1.17 CNCCc1ccncc1 Amb19958269 [0,1,1,0,0,0|2,0,0]=4 3586 B10R1.17 CNCCc1ccncc1 Amb2592519 [0,1,1,0,0,0|2,0,0]=4 3587 B10R1.17 CNNCc1ccccc1 Amb26859422 [0,1,1,0,0,0|1,0,0]=3 3588 B10R1.17 CNNCc1ccccc1 Amb33328543 [0,1,1,0,0,0|1,0,0]=3 3589 B10R1.17 CNNCc1ccccn1 Amb26421896 [0,1,1,0,0,0|2,0,0]=4 3590 B10R1.17 CNNCc1cccnc1 Amb24558769 [0,1,1,0,0,0|2,0,0]=4 3591 B10R1.17 CNOCc1ccccc1 Amb22059601 [0,1,1,0,0,0|0,0,0]=2 3592 B10R1.17 CNOCc1ccccc1 Amb32412803 [0,1,1,0,0,0|0,0,0]=2 3593 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [0,1,1,0,0,0|1,0,1]=4 3594 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [0,1,1,0,0,0|2,0,0]=4 3595 B10R1.17 COCC[n+]1ccccc1 Amb28125435 [0,1,1,0,0,0|1,0,0]=3 3596 B10R1.17 COCCc1ccccc1 Amb4020014 [0,1,1,0,0,0|0,0,0]=2 3597 B10R1.17 COCCc1ccccn1 Amb4034583 [0,1,1,0,0,0|1,0,0]=3 3598 B10R1.17 COCCc1ccncc1 Amb26565974 [0,1,1,0,0,0|1,0,0]=3 3599 B10R1.17 COCOc1ccccc1 Amb2608594 [0,1,1,0,0,0|0,0,0]=2 3600 B10R1.17 COCOc1ccccn1 Amb27757113 [0,1,1,0,0,0|1,0,0]=3 3601 B10R1.17 COCSc1cccnn1 Amb27424934 [0,1,1,0,0,0|2,0,0]=4 3602 B10R1.17 COCSc1cnccn1 Amb28293923 [0,1,1,0,0,0|2,0,0]=4 3603 B10R1.17 CONCc1ccccc1 Amb26432339 [0,1,1,0,0,0|0,0,0]=2 3604 B10R1.17 CONCc1ncccn1 Amb27839087 [0,1,1,0,0,0|2,0,0]=4 3605 B10R1.17 CO\C=C/c1ccncc1 Amb24103279 [0,1,1,0,0,0|1,0,1]=4 3606 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [0,1,1,0,0,0|0,0,1]=3 3607 B10R1.17 CO\C=N\c1ccccc1 Amb6297410 [0,1,1,0,0,0|0,0,1]=3 3608 B10R1.17 CO\N=C\c1ccccn1 Amb24719324 [0,1,1,0,0,0|1,0,1]=4 3609 B10R1.17 CO\N=C\c1cccnc1 Amb26847062 [0,1,1,0,0,0|1,0,1]=4 3610 B10R1.17 CO\N=C\c1ccncc1 Amb25173617 [0,1,1,0,0,0|1,0,1]=4 3611 B10R1.17 CSCCc1ccccc1 Amb26586093 [0,1,1,0,0,0|0,1,0]=3 3612 B10R1.17 CSCCc1ccccn1 Amb24552366 [0,1,1,0,0,0|1,1,0]=4 3613 B10R1.17 CSCNc1ccccc1 Amb25992690 [0,1,1,0,0,0|0,1,0]=3 3614 B10R1.17 CSCNc1ccccn1 Amb27972069 [0,1,1,0,0,0|1,1,0]=4 3615 B10R1.17 CSCOc1ccccc1 Amb22231357 [0,1,1,0,0,0|0,1,0]=3 3616 B10R1.17 CSCOc1ccccn1 Amb27256230 [0,1,1,0,0,0|1,1,0]=4 3617 B10R1.17 CS\C=C\c1ccccc1 Amb27654244 [0,1,1,0,0,0|0,1,1]=4 3618 B10R1.17 C\C=C/Cc1cccnc1 Amb27470932 [0,1,1,0,0,0|2,0,0]=4 3619 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [0,1,1,0,0,0|1,0,0]=3 3620 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,1,1,0,0,0|1,0,1]=4 3621 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [0,1,1,0,0,0|2,0,0]=4 3622 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [0,1,1,0,0,0|1,0,1]=4 3623 B10R1.17 ClCCCc1ccccc1 Amb3941487 [0,1,1,0,0,0|1,0,0]=3 3624 B10R1.17 ClCCCc1ccccn1 Amb32751196 [0,1,1,0,0,0|2,0,0]=4 3625 B10R1.17 ClCCCc1cccnc1 Amb17477795 [0,1,1,0,0,0|2,0,0]=4 3626 B10R1.17 ClCCCc1cccnc1 Amb32665795 [0,1,1,0,0,0|2,0,0]=4 3627 B10R1.17 ClCCCc1ccncc1 Amb17477794 [0,1,1,0,0,0|2,0,0]=4 3628 B10R1.17 ClCCNc1ccccc1 Amb17334388 [0,1,1,0,0,0|1,0,0]=3 3629 B10R1.17 ClCCNc1ccncc1 Amb27484998 [0,1,1,0,0,0|2,0,0]=4 3630 B10R1.17 ClCCOc1ccccc1 Amb3940573 [0,1,1,0,0,0|1,0,0]=3 3631 B10R1.17 ClCCOc1cccnc1 Amb19878080 [0,1,1,0,0,0|2,0,0]=4 3632 B10R1.17 ClCCOc1ccncc1 Amb28384309 [0,1,1,0,0,0|2,0,0]=4 3633 B10R1.17 ClCCSc1ccccc1 Amb2685910 [0,1,1,0,0,0|1,0,0]=3 3634 B10R1.17 ClCCSc1ccccn1 Amb9305061 [0,1,1,0,0,0|2,0,0]=4 3635 B10R1.17 ClCOCc1ccccc1 Amb2684626 [0,1,1,0,0,0|0,0,0]=2 3636 B10R1.17 ClCOCc1ccccn1 Amb27834619 [0,1,1,0,0,0|1,0,0]=3 3637 B10R1.17 ClCSCc1ccccc1 Amb16231183 [0,1,1,0,0,0|0,1,0]=3 3638 B10R1.17 ClCSSc1ccccc1 Amb27865461 [0,1,1,0,0,0|1,1,0]=4 3639 B10R1.17 ClC\C=C\c1ccccc1 Amb6608898 [0,1,1,0,0,0|1,0,1]=4 3640 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [0,1,1,0,0,0|1,0,1]=4 3641 B10R1.17 FCCNc1ccccc1 Amb26349791 [0,1,1,0,0,0|1,0,0]=3 3642 B10R1.17 FCCSc1ccccn1 Amb28125479 [0,1,1,0,0,0|2,0,0]=4 3643 B10R1.17 FCCSc1ccncc1 Amb27971685 [0,1,1,0,0,0|2,0,0]=4 3644 B10R1.17 FC\C=C\c1ccccc1 Amb27449580 [0,1,1,0,0,0|1,0,1]=4 3645 B10R1.17 ICC#Cc1ccccc1 Amb27262163 [0,1,1,0,0,0|1,0,1]=4 3646 B10R1.17 ICCCc1ccccc1 Amb10605506 [0,1,1,0,0,0|1,0,0]=3 3647 B10R1.17 ICCOc1ccccc1 Amb10608588 [0,1,1,0,0,0|1,0,0]=3 3648 B10R1.17 ICCSc1ccccc1 Amb27458209 [0,1,1,0,0,0|1,0,0]=3 3649 B10R1.17 ICOCc1ccccc1 Amb28348666 [0,1,1,0,0,0|0,0,0]=2 3650 B10R1.17 N#CCC[n+]1ccccc1 Amb28458262 [0,1,1,0,0,0|2,0,0]=4 3651 B10R1.17 N#CCCc1ccccc1 Amb33551192 [0,1,1,0,0,0|1,0,0]=3 3652 B10R1.17 N#CCCc1ccccn1 Amb1102488 [0,1,1,0,0,0|2,0,0]=4 3653 B10R1.17 N#CCCc1cccnc1 Amb10605345 [0,1,1,0,0,0|2,0,0]=4 3654 B10R1.17 N#CCCc1ccncc1 Amb2694189 [0,1,1,0,0,0|2,0,0]=4 3655 B10R1.17 N#CCNc1ccccc1 Amb1651088 [0,1,1,0,0,0|1,0,1]=4 3656 B10R1.17 N#CCOc1ccccc1 Amb2725206 [0,1,1,0,0,0|1,0,1]=4 3657 B10R1.17 N#CCSc1ccccc1 Amb2690327 [0,1,1,0,0,0|1,0,1]=4 3658 B10R1.17 N#CNCc1ccccc1 Amb27257452 [0,1,1,0,0,0|1,0,1]=4 3659 B10R1.17 N#CSCc1ccccc1 Amb2611897 [0,1,1,0,0,0|0,1,1]=4 3660 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [0,1,1,0,0,0|1,0,1]=4 3661 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [0,1,1,0,0,0|1,0,1]=4 3662 B10R1.17 NCCCc1ccccc1 Amb844788 [0,1,1,0,0,0|1,0,0]=3 3663 B10R1.17 NCCCc1ccccn1 Amb1088884 [0,1,1,0,0,0|2,0,0]=4 3664 B10R1.17 NCCCc1ccccn1 Amb21954278 [0,1,1,0,0,0|2,0,0]=4 3665 B10R1.17 NCCCc1cccnc1 Amb18363942 [0,1,1,0,0,0|2,0,0]=4 3666 B10R1.17 NCCCc1cccnc1 Amb31188323 [0,1,1,0,0,0|2,0,0]=4 3667 B10R1.17 NCCCc1cccnc1 Amb5735475 [0,1,1,0,0,0|2,0,0]=4 3668 B10R1.17 NCCCc1ccncc1 Amb22490382 [0,1,1,0,0,0|2,0,0]=4 3669 B10R1.17 NCCCc1ccncc1 Amb24099592 [0,1,1,0,0,0|2,0,0]=4 3670 B10R1.17 NCCCc1ccncc1 Amb33535434 [0,1,1,0,0,0|2,0,0]=4 3671 B10R1.17 NCCNc1ccccc1 Amb23412206 [0,1,1,0,0,0|1,0,0]=3 3672 B10R1.17 NCCNc1ccccc1 Amb2720312 [0,1,1,0,0,0|1,0,0]=3 3673 B10R1.17 NCCNc1ccccn1 Amb10608961 [0,1,1,0,0,0|2,0,0]=4 3674 B10R1.17 NCCNc1ccccn1 Amb1154294 [0,1,1,0,0,0|2,0,0]=4 3675 B10R1.17 NCCNc1cccnc1 Amb10607840 [0,1,1,0,0,0|2,0,0]=4 3676 B10R1.17 NCCNc1ccncc1 Amb19887545 [0,1,1,0,0,0|2,0,0]=4 3677 B10R1.17 NCCNc1ccncc1 Amb6279124 [0,1,1,0,0,0|2,0,0]=4 3678 B10R1.17 NCCOc1ccccc1 Amb1214559 [0,1,1,0,0,0|1,0,0]=3 3679 B10R1.17 NCCOc1ccccc1 Amb2099529 [0,1,1,0,0,0|1,0,0]=3 3680 B10R1.17 NCCOc1ccccn1 Amb2237065 [0,1,1,0,0,0|2,0,0]=4 3681 B10R1.17 NCCOc1cccnc1 Amb9392843 [0,1,1,0,0,0|2,0,0]=4 3682 B10R1.17 NCCOc1ccncc1 Amb18988858 [0,1,1,0,0,0|2,0,0]=4 3683 B10R1.17 NCCOc1ccncc1 Amb22728098 [0,1,1,0,0,0|2,0,0]=4 3684 B10R1.17 NCCSc1ccccc1 Amb6374305 [0,1,1,0,0,0|1,0,0]=3 3685 B10R1.17 NCCSc1ccccc1 Amb6827055 [0,1,1,0,0,0|1,0,0]=3 3686 B10R1.17 NCCSc1ccccn1 Amb13949032 [0,1,1,0,0,0|2,0,0]=4 3687 B10R1.17 NCCSc1ccccn1 Amb6370511 [0,1,1,0,0,0|2,0,0]=4 3688 B10R1.17 NCCSc1ccccn1 Amb6844895 [0,1,1,0,0,0|2,0,0]=4 3689 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [0,1,1,0,0,0|1,0,1]=4 3690 B10R1.17 NC\C=C/c1ccccc1 Amb6383106 [0,1,1,0,0,0|1,0,1]=4 3691 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [0,1,1,0,0,0|1,0,1]=4 3692 B10R1.17 NC\C=C\c1ccccc1 Amb4019220 [0,1,1,0,0,0|1,0,1]=4 3693 B10R1.17 NNCCc1ccccc1 Amb10608987 [0,1,1,0,0,0|1,0,0]=3 3694 B10R1.17 NNCCc1ccccc1 Amb1117029 [0,1,1,0,0,0|1,0,0]=3 3695 B10R1.17 NNCCc1ccccc1 Amb33552804 [0,1,1,0,0,0|1,0,0]=3 3696 B10R1.17 NNCCc1ccccn1 Amb20669588 [0,1,1,0,0,0|2,0,0]=4 3697 B10R1.17 NNCCc1ccccn1 Amb33528741 [0,1,1,0,0,0|2,0,0]=4 3698 B10R1.17 NNCCc1ccncc1 Amb6248763 [0,1,1,0,0,0|2,0,0]=4 3699 B10R1.17 NOCCc1ccccc1 Amb2899735 [0,1,1,0,0,0|0,0,0]=2 3700 B10R1.17 NOCCc1ccccc1 Amb6308543 [0,1,1,0,0,0|0,0,0]=2 3701 B10R1.17 NOCCc1ccccn1 Amb17231907 [0,1,1,0,0,0|1,0,0]=3 3702 B10R1.17 NOCCc1cccnc1 Amb25779030 [0,1,1,0,0,0|1,0,0]=3 3703 B10R1.17 NOCCc1ccncc1 Amb17231908 [0,1,1,0,0,0|1,0,0]=3 3704 B10R1.17 NOCCc1ccncn1 Amb33268679 [0,1,1,0,0,0|2,0,0]=4 3705 B10R1.17 NOCCc1cnccn1 Amb33359987 [0,1,1,0,0,0|2,0,0]=4 3706 B10R1.17 NOCCc1cncnc1 Amb33149199 [0,1,1,0,0,0|2,0,0]=4 3707 B10R1.17 NOCCc1ncccn1 Amb33270405 [0,1,1,0,0,0|2,0,0]=4 3708 B10R1.17 O=C=NCc1ccccc1 Amb3939117 [0,1,1,0,0,0|0,0,2]=4 3709 B10R1.17 O=CCCc1ccccc1 Amb2720576 [0,1,1,0,0,0|0,0,1]=3 3710 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,1,1,0,0,0|1,0,1]=4 3711 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,1,1,0,0,0|1,0,1]=4 3712 B10R1.17 O=CCCc1ccncc1 Amb8388451 [0,1,1,0,0,0|1,0,1]=4 3713 B10R1.17 O=CCOc1ccccc1 Amb3465095 [0,1,1,0,0,0|0,0,2]=4 3714 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,1,1,0,0,0|0,0,2]=4 3715 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,1,1,0,0,0|0,0,2]=4 3716 B10R1.17 O=COCc1ccccc1 Amb4605893 [0,1,1,0,0,0|0,0,1]=3 3717 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [0,1,1,0,0,0|0,0,2]=4 3718 B10R1.17 OCC#Cc1ccccc1 Amb534712 [0,1,1,0,0,0|0,0,1]=3 3719 B10R1.17 OCC#Cc1ccccn1 Amb2227478 [0,1,1,0,0,0|1,0,1]=4 3720 B10R1.17 OCC#Cc1cccnc1 Amb9777316 [0,1,1,0,0,0|1,0,1]=4 3721 B10R1.17 OCC#Cc1ccncc1 Amb9777314 [0,1,1,0,0,0|1,0,1]=4 3722 B10R1.17 OCCCC1=CCC=CC1 Amb22047467 [0,1,1,0,0,0|0,0,2]=4 3723 B10R1.17 OCCCc1ccccc1 Amb3939054 [0,1,1,0,0,0|0,0,0]=2 3724 B10R1.17 OCCCc1ccccn1 Amb22749323 [0,1,1,0,0,0|1,0,0]=3 3725 B10R1.17 OCCCc1ccccn1 Amb3939333 [0,1,1,0,0,0|1,0,0]=3 3726 B10R1.17 OCCCc1cccnc1 Amb2694598 [0,1,1,0,0,0|1,0,0]=3 3727 B10R1.17 OCCCc1cccnc1 Amb33623848 [0,1,1,0,0,0|1,0,0]=3 3728 B10R1.17 OCCCc1cccnn1 Amb27208115 [0,1,1,0,0,0|2,0,0]=4 3729 B10R1.17 OCCCc1ccncc1 Amb3650114 [0,1,1,0,0,0|1,0,0]=3 3730 B10R1.17 OCCCc1ccncn1 Amb24099660 [0,1,1,0,0,0|2,0,0]=4 3731 B10R1.17 OCCCc1ccnnc1 Amb23559794 [0,1,1,0,0,0|2,0,0]=4 3732 B10R1.17 OCCCc1cnccn1 Amb22499266 [0,1,1,0,0,0|2,0,0]=4 3733 B10R1.17 OCCCc1cncnc1 Amb24063145 [0,1,1,0,0,0|2,0,0]=4 3734 B10R1.17 OCCCc1ncccn1 Amb22499265 [0,1,1,0,0,0|2,0,0]=4 3735 B10R1.17 OCCNc1ccccc1 Amb3940335 [0,1,1,0,0,0|0,0,0]=2 3736 B10R1.17 OCCNc1ccccn1 Amb10809152 [0,1,1,0,0,0|1,0,0]=3 3737 B10R1.17 OCCNc1ccccn1 Amb2610537 [0,1,1,0,0,0|1,0,0]=3 3738 B10R1.17 OCCNc1cccnc1 Amb18266115 [0,1,1,0,0,0|1,0,0]=3 3739 B10R1.17 OCCNc1cccnn1 Amb18298692 [0,1,1,0,0,0|2,0,0]=4 3740 B10R1.17 OCCNc1ccncc1 Amb6631563 [0,1,1,0,0,0|1,0,0]=3 3741 B10R1.17 OCCNc1ccncn1 Amb18973688 [0,1,1,0,0,0|2,0,0]=4 3742 B10R1.17 OCCNc1cnccn1 Amb6650910 [0,1,1,0,0,0|2,0,0]=4 3743 B10R1.17 OCCNc1ncccn1 Amb6622896 [0,1,1,0,0,0|2,0,0]=4 3744 B10R1.17 OCCOC1C=CC=CO1 Amb27829943 [0,1,1,0,0,0|1,0,1]=4 3745 B10R1.17 OCCOc1ccccc1 Amb2209344 [0,1,1,0,0,0|0,0,0]=2 3746 B10R1.17 OCCOc1ccccn1 Amb23598433 [0,1,1,0,0,0|1,0,0]=3 3747 B10R1.17 OCCOc1cccnc1 Amb19333986 [0,1,1,0,0,0|1,0,0]=3 3748 B10R1.17 OCCSc1ccccn1 Amb2722740 [0,1,1,0,0,0|1,0,0]=3 3749 B10R1.17 OCCSc1ncccn1 Amb33529079 [0,1,1,0,0,0|2,0,0]=4 3750 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,1,1,0,0,0|0,0,0]=2 3751 B10R1.17 OCSCc1ccccc1 Amb27839241 [0,1,1,0,0,0|0,0,0]=2 3752 B10R1.17 OC\C=C/c1ccccn1 Amb26391968 [0,1,1,0,0,0|1,0,1]=4 3753 B10R1.17 OC\C=C/c1ccncc1 Amb27617653 [0,1,1,0,0,0|1,0,1]=4 3754 B10R1.17 OC\C=C\c1ccccc1 Amb7809230 [0,1,1,0,0,0|0,0,1]=3 3755 B10R1.17 OC\C=C\c1ccccn1 Amb22749315 [0,1,1,0,0,0|1,0,1]=4 3756 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [0,1,1,0,0,0|1,0,1]=4 3757 B10R1.17 OC\C=C\c1ccncc1 Amb22749186 [0,1,1,0,0,0|1,0,1]=4 3758 B10R1.17 ONCCc1ccccc1 Amb33544180 [0,1,1,0,0,0|0,0,0]=2 3759 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [0,1,1,0,0,0|0,0,1]=3 3760 B10R1.17 O\N=C\Cc1ccccn1 Amb27767920 [0,1,1,0,0,0|1,0,1]=4 3761 B10R1.17 O\N=C\Cc1ccncc1 Amb28186073 [0,1,1,0,0,0|1,0,1]=4 3762 B10R1.17 O\N=C\Nc1ccccc1 Amb27449667 [0,1,1,0,0,0|1,0,1]=4 3763 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,1,1,0,0,0|0,1,1]=4 3764 B10R1.17 SCC#Cc1ccccc1 Amb27454293 [0,1,1,0,0,0|0,1,1]=4 3765 B10R1.17 SCCCc1ccccc1 Amb6255807 [0,1,1,0,0,0|0,1,0]=3 3766 B10R1.17 SCCCc1ccccn1 Amb17399950 [0,1,1,0,0,0|1,1,0]=4 3767 B10R1.17 SCCCc1cccnc1 Amb17399951 [0,1,1,0,0,0|1,1,0]=4 3768 B10R1.17 SCCCc1ccncc1 Amb17399952 [0,1,1,0,0,0|1,1,0]=4 3769 B10R1.17 SCCOc1ccccc1 Amb2794986 [0,1,1,0,0,0|0,1,0]=3 3770 B10R1.17 SCCSc1ccccc1 Amb13881734 [0,1,1,0,0,0|0,1,0]=3 3771 B10R1.17 SC\C=C\c1ccccc1 Amb6255720 [0,1,1,0,0,0|0,1,1]=4 3772 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [0,1,1,0,0,0|1,0,0]=3 3773 B10R1.17 [C-]#[N+]CCc1ccccn1 Amb5456295 [0,1,1,0,0,0|2,0,0]=4 3774 B10R1.17 [C-]#[N+]CCc1cccnc1 Amb33429418 [0,1,1,0,0,0|2,0,0]=4 3775 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [0,1,1,0,0,0|2,0,0]=4 3776 B10R1.17 [N-]=[N+]=NCc1ccccc1 Amb2721052 [0,1,1,0,0,0|2,0,0]=4 3777 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [0,1,1,0,0,0|1,0,0]=3 3778 B10R1.18 BrC(Br)Cc1ccccc1 Amb28049679 [0,1,1,0,0,0|1,0,0]=3 3779 B10R1.18 C=C(Br)Cc1ccccc1 Amb2685457 [0,1,1,0,0,0|1,0,1]=4 3780 B10R1.18 C=C(C)Cc1cccnc1 Amb27624891 [0,1,1,0,0,0|2,0,0]=4 3781 B10R1.18 C=C(Cl)Cc1ccccc1 Amb27172505 [0,1,1,0,0,0|1,0,1]=4 3782 B10R1.18 C=C(N)Cc1ccccc1 Amb27424990 [0,1,1,0,0,0|1,0,1]=4 3783 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [0,1,1,0,0,0|2,0,0]=4 3784 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [0,1,1,0,0,0|2,0,0]=4 3785 B10R1.18 CC(=O)C[n+]1ccccc1 Amb4018023 [0,1,1,0,0,0|2,0,0]=4 3786 B10R1.18 CC(=O)C[n+]1ccccc1 Amb6366487 [0,1,1,0,0,0|2,0,0]=4 3787 B10R1.18 CC(=O)Cc1ccccc1 Amb4136401 [0,1,1,0,0,0|1,0,0]=3 3788 B10R1.18 CC(=O)Cc1ccccn1 Amb33527266 [0,1,1,0,0,0|2,0,0]=4 3789 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [0,1,1,0,0,0|2,0,0]=4 3790 B10R1.18 CC(=O)Cc1cccnc1 Amb22587708 [0,1,1,0,0,0|2,0,0]=4 3791 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [0,1,1,0,0,0|2,0,0]=4 3792 B10R1.18 CC(=O)Cc1ccncc1 Amb8390737 [0,1,1,0,0,0|2,0,0]=4 3793 B10R1.18 CC(=O)Nc1ccccc1 Amb6346349 [0,1,1,0,0,0|2,0,0]=4 3794 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [0,1,1,0,0,0|2,0,0]=4 3795 B10R1.18 CC(=S)Cc1ccncc1 Amb27184042 [0,1,1,0,0,0|2,0,0]=4 3796 B10R1.18 CC(=S)Nc1ccccc1 Amb2613341 [0,1,1,0,0,0|2,0,0]=4 3797 B10R1.18 CC(Br)Cc1ccccc1 Amb3940198 [0,1,1,0,0,0|1,0,0]=3 3798 B10R1.18 CC(Br)Cc1ccccn1 Amb27424955 [0,1,1,0,0,0|2,0,0]=4 3799 B10R1.18 CC(Br)Cc1ccncc1 Amb33506239 [0,1,1,0,0,0|2,0,0]=4 3800 B10R1.18 CC(C)=Cc1ccccc1 Amb6296059 [0,1,1,0,0,0|1,0,1]=4 3801 B10R1.18 CC(C)C[n+]1ccccc1 Amb28189122 [0,1,1,0,0,0|2,0,0]=4 3802 B10R1.18 CC(C)Cc1ccccc1 Amb2778549 [0,1,1,0,0,0|1,0,0]=3 3803 B10R1.18 CC(C)Cc1ccccn1 Amb15691003 [0,1,1,0,0,0|2,0,0]=4 3804 B10R1.18 CC(C)Cc1cccnc1 Amb22043313 [0,1,1,0,0,0|2,0,0]=4 3805 B10R1.18 CC(C)Cc1ccncc1 Amb2613008 [0,1,1,0,0,0|2,0,0]=4 3806 B10R1.18 CC(C)Nc1ccccc1 Amb2720884 [0,1,1,0,0,0|2,0,0]=4 3807 B10R1.18 CC(C)Oc1ccccc1 Amb3429104 [0,1,1,0,0,0|2,0,0]=4 3808 B10R1.18 CC(C)Sc1ccccc1 Amb5721900 [0,1,1,0,0,0|2,0,0]=4 3809 B10R1.18 CC(N)Cc1ccccc1 Amb17608372 [0,1,1,0,0,0|1,0,0]=3 3810 B10R1.18 CC(N)Cc1ccccc1 Amb4079275 [0,1,1,0,0,0|1,0,0]=3 3811 B10R1.18 CC(N)Cc1ccccn1 Amb1995149 [0,1,1,0,0,0|2,0,0]=4 3812 B10R1.18 CC(N)Cc1cccnc1 Amb9712156 [0,1,1,0,0,0|2,0,0]=4 3813 B10R1.18 CC(N)Cc1ccncc1 Amb2592094 [0,1,1,0,0,0|2,0,0]=4 3814 B10R1.18 CC(O)CC1C=CC=CN1 Amb27431152 [0,1,1,0,0,0|1,0,1]=4 3815 B10R1.18 CC(O)C[n+]1ccccc1 Amb27213830 [0,1,1,0,0,0|1,0,0]=3 3816 B10R1.18 CC(O)Cc1ccccc1 Amb3940116 [0,1,1,0,0,0|0,0,0]=2 3817 B10R1.18 CC(O)Cc1ccccn1 Amb1995148 [0,1,1,0,0,0|1,0,0]=3 3818 B10R1.18 CC(O)Cc1cccnc1 Amb33530732 [0,1,1,0,0,0|1,0,0]=3 3819 B10R1.18 CC(O)Cc1ccncc1 Amb17477789 [0,1,1,0,0,0|1,0,0]=3 3820 B10R1.18 CC(O)Cc1ccncn1 Amb33474836 [0,1,1,0,0,0|2,0,0]=4 3821 B10R1.18 CC(O)Cc1cnccn1 Amb1995175 [0,1,1,0,0,0|2,0,0]=4 3822 B10R1.18 CC(O)Cc1cncnc1 Amb33465647 [0,1,1,0,0,0|2,0,0]=4 3823 B10R1.18 CC(O)Cc1ncccn1 Amb33295171 [0,1,1,0,0,0|2,0,0]=4 3824 B10R1.18 CC(O)Nc1ccccc1 Amb27771797 [0,1,1,0,0,0|1,0,0]=3 3825 B10R1.18 CC(O)Oc1ccccc1 Amb27838966 [0,1,1,0,0,0|1,0,0]=3 3826 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [0,1,1,0,0,0|0,1,0]=3 3827 B10R1.18 CN(C)Cc1ccccc1 Amb6608891 [0,1,1,0,0,0|1,0,0]=3 3828 B10R1.18 CN(C)Cc1ccccn1 Amb4010724 [0,1,1,0,0,0|2,0,0]=4 3829 B10R1.18 CN(C)Cc1cccnc1 Amb2694185 [0,1,1,0,0,0|2,0,0]=4 3830 B10R1.18 CN(C)Cc1ccncc1 Amb20247602 [0,1,1,0,0,0|2,0,0]=4 3831 B10R1.18 CN(C)Sc1ccccc1 Amb28388759 [0,1,1,0,0,0|2,0,0]=4 3832 B10R1.18 CN(N)Cc1ccccc1 Amb836790 [0,1,1,0,0,0|1,0,0]=3 3833 B10R1.18 CN(N)Cc1cccnc1 Amb28049624 [0,1,1,0,0,0|2,0,0]=4 3834 B10R1.18 CN(N)Cc1ccncc1 Amb27180025 [0,1,1,0,0,0|2,0,0]=4 3835 B10R1.18 CN(O)Cc1ccccc1 Amb27149097 [0,1,1,0,0,0|1,0,0]=3 3836 B10R1.18 CN(O)Cc1ccccn1 Amb33361076 [0,1,1,0,0,0|2,0,0]=4 3837 B10R1.18 CN(O)Cc1cccnc1 Amb33429419 [0,1,1,0,0,0|2,0,0]=4 3838 B10R1.18 CN(O)Cc1ccncc1 Amb33380608 [0,1,1,0,0,0|2,0,0]=4 3839 B10R1.18 CP(C)Cc1ccccc1 Amb26928754 [0,1,1,0,0,0|1,0,0]=3 3840 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [0,1,1,0,0,0|0,1,0]=3 3841 B10R1.18 CS(=O)Nc1ccccc1 Amb27777995 [0,1,1,0,0,0|1,1,0]=4 3842 B10R1.18 C[C@@H](Br)Cc1ccccc1 Amb28182471 [0,1,1,0,0,0|1,0,0]=3 3843 B10R1.18 C[C@@H](Cl)Cc1ccccc1 Amb8389890 [0,1,1,0,0,0|1,0,0]=3 3844 B10R1.18 C[C@@H](I)Cc1ccccc1 Amb27199901 [0,1,1,0,0,0|1,0,0]=3 3845 B10R1.18 C[C@@H](N)Cc1ccccn1 Amb27754695 [0,1,1,0,0,0|2,0,0]=4 3846 B10R1.18 C[C@@H](N)Cc1cccnc1 Amb26602572 [0,1,1,0,0,0|2,0,0]=4 3847 B10R1.18 C[C@@H](N)Cc1ccncc1 Amb28044876 [0,1,1,0,0,0|2,0,0]=4 3848 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [0,1,1,0,0,0|0,0,0]=2 3849 B10R1.18 C[C@@H](O)Cc1ccccn1 Amb27839538 [0,1,1,0,0,0|1,0,0]=3 3850 B10R1.18 C[C@@H](O)Cc1cccnc1 Amb22896922 [0,1,1,0,0,0|1,0,0]=3 3851 B10R1.18 C[C@@H](O)Cc1ccncc1 Amb33380651 [0,1,1,0,0,0|1,0,0]=3 3852 B10R1.18 C[C@@H](O)Cc1ccncn1 Amb33268593 [0,1,1,0,0,0|2,0,0]=4 3853 B10R1.18 C[C@@H](O)Cc1cnccn1 Amb33359974 [0,1,1,0,0,0|2,0,0]=4 3854 B10R1.18 C[C@@H](O)Cc1cncnc1 Amb33149176 [0,1,1,0,0,0|2,0,0]=4 3855 B10R1.18 C[C@@H](O)Cc1ncccn1 Amb33270391 [0,1,1,0,0,0|2,0,0]=4 3856 B10R1.18 C[C@H](Br)Cc1ccccc1 Amb27484166 [0,1,1,0,0,0|1,0,0]=3 3857 B10R1.18 C[C@H](I)Cc1ccccc1 Amb27635996 [0,1,1,0,0,0|1,0,0]=3 3858 B10R1.18 C[C@H](N)Cc1ccccc1 Amb8395458 [0,1,1,0,0,0|1,0,0]=3 3859 B10R1.18 C[C@H](N)Cc1ccccn1 Amb24451425 [0,1,1,0,0,0|2,0,0]=4 3860 B10R1.18 C[C@H](N)Cc1cccnc1 Amb27145739 [0,1,1,0,0,0|2,0,0]=4 3861 B10R1.18 C[C@H](N)Cc1ccncc1 Amb28381274 [0,1,1,0,0,0|2,0,0]=4 3862 B10R1.18 C[C@H](O)Cc1ccccc1 Amb10068519 [0,1,1,0,0,0|0,0,0]=2 3863 B10R1.18 C[C@H](O)Cc1ccccn1 Amb26605951 [0,1,1,0,0,0|1,0,0]=3 3864 B10R1.18 C[C@H](O)Cc1cccnc1 Amb28041599 [0,1,1,0,0,0|1,0,0]=3 3865 B10R1.18 C[C@H](O)Cc1ccncc1 Amb33380652 [0,1,1,0,0,0|1,0,0]=3 3866 B10R1.18 C[C@H](O)Cc1ccncn1 Amb33268594 [0,1,1,0,0,0|2,0,0]=4 3867 B10R1.18 C[C@H](O)Cc1cnccn1 Amb33359975 [0,1,1,0,0,0|2,0,0]=4 3868 B10R1.18 C[C@H](O)Cc1cncnc1 Amb33149177 [0,1,1,0,0,0|2,0,0]=4 3869 B10R1.18 C[C@H](O)Cc1ncccn1 Amb33270392 [0,1,1,0,0,0|2,0,0]=4 3870 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [0,1,1,0,0,0|1,0,0]=3 3871 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [0,1,1,0,0,0|1,0,0]=3 3872 B10R1.18 C\C(O)=C/c1ccccc1 Amb24095309 [0,1,1,0,0,0|0,0,2]=4 3873 B10R1.18 C\[N+]([O-])=C/c1ccccc1 Amb3988092 [0,1,1,0,0,0|1,0,1]=4 3874 B10R1.18 C\[N+]([O-])=C\c1ccccc1 Amb2420785 [0,1,1,0,0,0|1,0,1]=4 3875 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [0,1,1,0,0,0|1,0,0]=3 3876 B10R1.18 ClC(Cl)Oc1ccccc1 Amb27758700 [0,1,1,0,0,0|2,0,0]=4 3877 B10R1.18 ClC(Cl)[SH2]c1ccccc1 Amb28396623 [0,1,1,0,0,0|2,0,0]=4 3878 B10R1.18 FC(F)Oc1ccccc1 Amb2687045 [0,1,1,0,0,0|2,0,0]=4 3879 B10R1.18 FC(F)Sc1ccccc1 Amb17232315 [0,1,1,0,0,0|2,0,0]=4 3880 B10R1.18 N=C(N)Cc1ccccc1 Amb33551496 [0,1,1,0,0,0|1,0,1]=4 3881 B10R1.18 N=C(N)Cc1ccccc1 Amb745036 [0,1,1,0,0,0|1,0,1]=4 3882 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [0,1,1,0,0,0|1,0,1]=4 3883 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [0,1,1,0,0,0|0,0,2]=4 3884 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [0,1,1,0,0,0|0,1,1]=4 3885 B10R1.18 NC(N)Cc1ccccc1 Amb27823264 [0,1,1,0,0,0|1,0,0]=3 3886 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [0,1,1,0,0,0|0,0,0]=2 3887 B10R1.18 NS(=O)Cc1ccccc1 Amb28370210 [0,1,1,0,0,0|1,0,1]=4 3888 B10R1.18 O=C(Br)Cc1ccccc1 Amb2609678 [0,1,1,0,0,0|0,0,2]=4 3889 B10R1.18 O=C(Cl)Cc1ccccc1 Amb2792901 [0,1,1,0,0,0|0,0,2]=4 3890 B10R1.18 O=C(O)C[n+]1ccccc1 Amb23468426 [0,1,1,0,0,0|1,0,1]=4 3891 B10R1.18 O=C(O)Cc1cc[nH+]cc1 Amb24113836 [0,1,1,0,0,0|1,0,1]=4 3892 B10R1.18 O=C(O)Cc1cccc[nH+]1 Amb24113838 [0,1,1,0,0,0|1,0,1]=4 3893 B10R1.18 O=C(O)Cc1ccccc1 Amb6461144 [0,1,1,0,0,0|0,0,1]=3 3894 B10R1.18 O=C(O)Cc1ccccn1 Amb2720201 [0,1,1,0,0,0|1,0,1]=4 3895 B10R1.18 O=C(O)Cc1ccccn1 Amb3940142 [0,1,1,0,0,0|1,0,1]=4 3896 B10R1.18 O=C(O)Cc1cccnc1 Amb2720203 [0,1,1,0,0,0|1,0,1]=4 3897 B10R1.18 O=C(O)Cc1cccnc1 Amb2720470 [0,1,1,0,0,0|1,0,1]=4 3898 B10R1.18 O=C(O)Cc1ccncc1 Amb2720202 [0,1,1,0,0,0|1,0,1]=4 3899 B10R1.18 O=C(O)Cc1ccncc1 Amb3940535 [0,1,1,0,0,0|1,0,1]=4 3900 B10R1.18 O=C(O)Nc1ccccc1 Amb34916595 [0,1,1,0,0,0|1,0,1]=4 3901 B10R1.18 O=C([O-])Cc1ccccc1 Amb20240609 [0,1,1,0,0,0|0,0,2]=4 3902 B10R1.18 O=C([O-])Cc1ccccc1 Amb20246797 [0,1,1,0,0,0|0,0,2]=4 3903 B10R1.18 O=S(Cl)Cc1ccccc1 Amb28050330 [0,1,1,0,0,0|1,0,1]=4 3904 B10R1.18 O=S(O)Cc1ccccc1 Amb27872793 [0,1,1,0,0,0|1,0,0]=3 3905 B10R1.18 O=S(O)Oc1ccccc1 Amb27964140 [0,1,1,0,0,0|2,0,0]=4 3906 B10R1.18 O=S([O-])Cc1ccccc1 Amb28430335 [0,1,1,0,0,0|1,0,1]=4 3907 B10R1.18 O=[N+]([O-])Cc1ccccc1 Amb10606416 [0,1,1,0,0,0|1,0,1]=4 3908 B10R1.18 O=[PH](O)Cc1ccccc1 Amb24617740 [0,1,1,0,0,0|1,0,0]=3 3909 B10R1.18 OB(O)Cc1ccccc1 Amb10071580 [0,1,1,0,0,0|1,0,0]=3 3910 B10R1.18 OB(O)Nc1ccccc1 Amb27630373 [0,1,1,0,0,0|2,0,0]=4 3911 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [0,1,1,0,0,0|0,0,1]=3 3912 B10R1.18 OC(Cl)Cc1ccccc1 Amb27228646 [0,1,1,0,0,0|0,0,0]=2 3913 B10R1.18 OC(Cl)Oc1ccccc1 Amb28255528 [0,1,1,0,0,0|1,0,0]=3 3914 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [0,1,1,0,0,0|0,0,0]=2 3915 B10R1.18 OC(O)Oc1ccccc1 Amb27790325 [0,1,1,0,0,0|1,0,0]=3 3916 B10R1.18 S=C(Cl)Cc1ccccc1 Amb28203639 [0,1,1,0,0,0|0,1,1]=4 3917 B10R1.186 C\C=C\C=C\C(=O)C1CC1 Amb27443531 [0,1,1,0,0,0|1,0,1]=4 3918 B10R1.186 C\C=C\C=C\C(=O)C1CO1 Amb27262899 [0,1,1,0,0,0|0,0,1]=3 3919 B10R2.5 BrC1CC1c2ccco2 Amb28313048 [0,1,0,0,1,0|2,0,0]=4 3920 B10R2.5 CC1CC1c2ccco2 Amb446873 [0,1,0,0,1,0|2,0,0]=4 3921 B10R2.5 CC1OC1c2ccco2 Amb27837474 [0,1,0,0,1,0|1,0,0]=3 3922 B10R2.5 CC1OC1c2cccs2 Amb27171681 [0,1,0,0,1,0|1,0,0]=3 3923 B10R2.5 NC1CC1c2ccco2 Amb7094904 [0,1,0,0,1,0|2,0,0]=4 3924 B10R2.5 NC1CC1c2cccs2 Amb7094905 [0,1,0,0,1,0|2,0,0]=4 3925 B10R2.5 NC1CC1c2ccoc2 Amb24527705 [0,1,0,0,1,0|2,0,0]=4 3926 B10R2.5 NC1CC1c2ccsc2 Amb32669014 [0,1,0,0,1,0|2,0,0]=4 3927 B10R2.5 NC1CC1c2ccsc2 Amb7767346 [0,1,0,0,1,0|2,0,0]=4 3928 B10R2.5 NC1CC1n2cccc2 Amb18278848 [0,1,0,0,1,0|2,0,0]=4 3929 B10R2.5 N[C@@H]1C[C@H]1c2ccco2 Amb25914509 [0,1,0,0,1,0|2,0,0]=4 3930 B10R2.5 N[C@@H]1C[C@H]1c2cccs2 Amb25988700 [0,1,0,0,1,0|2,0,0]=4 3931 B10R2.5 N[C@@H]1C[C@H]1c2ccoc2 Amb33361250 [0,1,0,0,1,0|2,0,0]=4 3932 B10R2.5 N[C@@H]1C[C@H]1c2ccsc2 Amb26896091 [0,1,0,0,1,0|2,0,0]=4 3933 B10R2.5 N[C@@H]1C[C@H]1c2ccsc2 Amb28723367 [0,1,0,0,1,0|2,0,0]=4 3934 B10R2.5 N[C@H]1C[C@@H]1c2cccs2 Amb27784468 [0,1,0,0,1,0|2,0,0]=4 3935 B10R2.14 Brc1cc(C2CC2)co1 Amb10600618 [0,1,0,0,1,0|2,0,0]=4 3936 B10R2.14 Brc1cc(C2CC2)cs1 Amb10600616 [0,1,0,0,1,0|2,0,0]=4 3937 B10R2.14 Brc1cc(C2CO2)cs1 Amb25972884 [0,1,0,0,1,0|1,0,0]=3 3938 B10R2.14 Brc1cc(C2CO2)on1 Amb32679272 [0,1,0,0,1,0|2,0,0]=4 3939 B10R2.14 Brc1cc([C@@H]2CO2)cs1 Amb33433555 [0,1,0,0,1,0|1,0,0]=3 3940 B10R2.14 Brc1cc([C@H]2CO2)cs1 Amb33433614 [0,1,0,0,1,0|1,0,0]=3 3941 B10R2.14 Brc1ccc(C2CC2)o1 Amb10600614 [0,1,0,0,1,0|2,0,0]=4 3942 B10R2.14 Brc1ccc(C2CC2)s1 Amb10600612 [0,1,0,0,1,0|2,0,0]=4 3943 B10R2.14 Brc1ccc(C2CN2)s1 Amb18224895 [0,1,0,0,1,0|2,0,0]=4 3944 B10R2.14 Brc1ccc(C2CO2)o1 Amb33451993 [0,1,0,0,1,0|1,0,0]=3 3945 B10R2.14 Brc1ccc(C2CO2)s1 Amb17238288 [0,1,0,0,1,0|1,0,0]=3 3946 B10R2.14 Brc1ccc([C@@H]2CO2)o1 Amb25844623 [0,1,0,0,1,0|1,0,0]=3 3947 B10R2.14 Brc1ccc([C@@H]2CO2)s1 Amb26344112 [0,1,0,0,1,0|1,0,0]=3 3948 B10R2.14 Brc1ccc([C@H]2CO2)o1 Amb24575034 [0,1,0,0,1,0|1,0,0]=3 3949 B10R2.14 Brc1ccc([C@H]2CO2)s1 Amb28285182 [0,1,0,0,1,0|1,0,0]=3 3950 B10R2.14 Brc1ccn(C2CC2)c1 Amb24322502 [0,1,0,0,1,0|2,0,0]=4 3951 B10R2.14 Brc1cnc(C2CO2)s1 Amb33434998 [0,1,0,0,1,0|2,0,0]=4 3952 B10R2.14 Brc1cnc([C@@H]2CO2)s1 Amb33435125 [0,1,0,0,1,0|2,0,0]=4 3953 B10R2.14 Brc1cnc([C@H]2CO2)s1 Amb33434837 [0,1,0,0,1,0|2,0,0]=4 3954 B10R2.14 Brc1coc(C2CO2)c1 Amb33431507 [0,1,0,0,1,0|1,0,0]=3 3955 B10R2.14 Brc1coc([C@@H]2CO2)c1 Amb33383206 [0,1,0,0,1,0|1,0,0]=3 3956 B10R2.14 Brc1coc([C@H]2CO2)c1 Amb33432300 [0,1,0,0,1,0|1,0,0]=3 3957 B10R2.14 Brc1csc(C2CC2)c1 Amb32659604 [0,1,0,0,1,0|2,0,0]=4 3958 B10R2.14 Brc1csc(C2CN2)c1 Amb18225021 [0,1,0,0,1,0|2,0,0]=4 3959 B10R2.14 Brc1csc(C2CO2)c1 Amb24652095 [0,1,0,0,1,0|1,0,0]=3 3960 B10R2.14 Brc1csc([C@@H]2CO2)c1 Amb25789094 [0,1,0,0,1,0|1,0,0]=3 3961 B10R2.14 Brc1csc([C@H]2CO2)c1 Amb28049253 [0,1,0,0,1,0|1,0,0]=3 3962 B10R2.14 Brc1nc(C2CO2)cs1 Amb33334940 [0,1,0,0,1,0|2,0,0]=4 3963 B10R2.14 Brc1nc([C@@H]2CO2)cs1 Amb33335873 [0,1,0,0,1,0|2,0,0]=4 3964 B10R2.14 Brc1nc([C@H]2CO2)cs1 Amb33335924 [0,1,0,0,1,0|2,0,0]=4 3965 B10R2.14 Cc1cc(C2CO2)no1 Amb28120597 [0,1,0,0,1,0|2,0,0]=4 3966 B10R2.14 Cc1cc(C2CO2)on1 Amb33327193 [0,1,0,0,1,0|2,0,0]=4 3967 B10R2.14 Cc1cc(C2CO2)sn1 Amb35731170 [0,1,0,0,1,0|2,0,0]=4 3968 B10R2.14 Cc1cc([C@@H]2CO2)no1 Amb33315685 [0,1,0,0,1,0|2,0,0]=4 3969 B10R2.14 Cc1cc([C@@H]2CO2)on1 Amb33422287 [0,1,0,0,1,0|2,0,0]=4 3970 B10R2.14 Cc1cc([C@H]2CO2)no1 Amb33226760 [0,1,0,0,1,0|2,0,0]=4 3971 B10R2.14 Cc1cc([C@H]2CO2)on1 Amb33422286 [0,1,0,0,1,0|2,0,0]=4 3972 B10R2.14 Cc1ccc(C2CC2)s1 Amb27186363 [0,1,0,0,1,0|2,0,0]=4 3973 B10R2.14 Cc1ccc(C2CO2)o1 Amb1130501 [0,1,0,0,1,0|1,0,0]=3 3974 B10R2.14 Cc1ccc(C2CO2)s1 Amb6244547 [0,1,0,0,1,0|1,0,0]=3 3975 B10R2.14 Cc1ccc([C@@H]2CO2)o1 Amb33317512 [0,1,0,0,1,0|1,0,0]=3 3976 B10R2.14 Cc1ccc([C@@H]2CO2)s1 Amb25128549 [0,1,0,0,1,0|1,0,0]=3 3977 B10R2.14 Cc1ccc([C@H]2CO2)o1 Amb33317513 [0,1,0,0,1,0|1,0,0]=3 3978 B10R2.14 Cc1ccc([C@H]2CO2)s1 Amb26623657 [0,1,0,0,1,0|1,0,0]=3 3979 B10R2.14 Cc1csc(C2CO2)c1 Amb25918854 [0,1,0,0,1,0|1,0,0]=3 3980 B10R2.14 Cc1csc(C2CO2)n1 Amb27667998 [0,1,0,0,1,0|2,0,0]=4 3981 B10R2.14 Cc1csc([C@@H]2CO2)c1 Amb33373111 [0,1,0,0,1,0|1,0,0]=3 3982 B10R2.14 Cc1csc([C@H]2CO2)c1 Amb33373112 [0,1,0,0,1,0|1,0,0]=3 3983 B10R2.14 Cc1nc(C2CO2)cs1 Amb27475780 [0,1,0,0,1,0|2,0,0]=4 3984 B10R2.14 Cc1nc([C@@H]2CO2)cs1 Amb33325850 [0,1,0,0,1,0|2,0,0]=4 3985 B10R2.14 Cc1nc([C@H]2CO2)cs1 Amb33325851 [0,1,0,0,1,0|2,0,0]=4 3986 B10R2.14 Cc1ncc(C2CO2)s1 Amb27956519 [0,1,0,0,1,0|2,0,0]=4 3987 B10R2.14 Cc1ncc([C@@H]2CO2)s1 Amb33147935 [0,1,0,0,1,0|2,0,0]=4 3988 B10R2.14 Cc1ncc([C@H]2CO2)s1 Amb33147936 [0,1,0,0,1,0|2,0,0]=4 3989 B10R2.14 Clc1cc(C2CO2)cs1 Amb25933486 [0,1,0,0,1,0|1,0,0]=3 3990 B10R2.14 Clc1cc([C@@H]2CO2)cs1 Amb25889693 [0,1,0,0,1,0|1,0,0]=3 3991 B10R2.14 Clc1cc([C@H]2CO2)cs1 Amb24665411 [0,1,0,0,1,0|1,0,0]=3 3992 B10R2.14 Clc1ccc(C2CN2)s1 Amb18861253 [0,1,0,0,1,0|2,0,0]=4 3993 B10R2.14 Clc1ccc(C2CO2)o1 Amb33258322 [0,1,0,0,1,0|1,0,0]=3 3994 B10R2.14 Clc1ccc(C2CO2)s1 Amb9270913 [0,1,0,0,1,0|1,0,0]=3 3995 B10R2.14 Clc1ccc([C@@H]2CO2)o1 Amb33259071 [0,1,0,0,1,0|1,0,0]=3 3996 B10R2.14 Clc1ccc([C@@H]2CO2)s1 Amb26863313 [0,1,0,0,1,0|1,0,0]=3 3997 B10R2.14 Clc1ccc([C@H]2CO2)o1 Amb33259068 [0,1,0,0,1,0|1,0,0]=3 3998 B10R2.14 Clc1ccc([C@H]2CO2)s1 Amb26871285 [0,1,0,0,1,0|1,0,0]=3 3999 B10R2.14 Clc1csc([C@@H]2CO2)c1 Amb33221633 [0,1,0,0,1,0|1,0,0]=3 4000 B10R2.14 Clc1csc([C@H]2CO2)c1 Amb33221632 [0,1,0,0,1,0|1,0,0]=3 4001 B10R2.14 Clc1ncc(C2CO2)s1 Amb33220942 [0,1,0,0,1,0|2,0,0]=4 4002 B10R2.14 Clc1ncc([C@@H]2CO2)s1 Amb33221800 [0,1,0,0,1,0|2,0,0]=4 4003 B10R2.14 Clc1ncc([C@H]2CO2)s1 Amb33221795 [0,1,0,0,1,0|2,0,0]=4 4004 B10R2.14 Cn1cc(C2CO2)cn1 Amb26607268 [0,1,0,0,1,0|2,0,0]=4 4005 B10R2.14 Cn1cc([C@@H]2CO2)cn1 Amb25768011 [0,1,0,0,1,0|2,0,0]=4 4006 B10R2.14 Cn1cc([C@H]2CO2)cn1 Amb27180496 [0,1,0,0,1,0|2,0,0]=4 4007 B10R2.14 Cn1ccc(C2CN2)c1 Amb18221699 [0,1,0,0,1,0|2,0,0]=4 4008 B10R2.14 Cn1ccc(C2CO2)c1 Amb18560287 [0,1,0,0,1,0|1,0,0]=3 4009 B10R2.14 Cn1ccc(C2CO2)n1 Amb32728923 [0,1,0,0,1,0|2,0,0]=4 4010 B10R2.14 Cn1ccc([C@@H]2CO2)n1 Amb32726527 [0,1,0,0,1,0|2,0,0]=4 4011 B10R2.14 Cn1ccc([C@H]2CO2)n1 Amb32726528 [0,1,0,0,1,0|2,0,0]=4 4012 B10R2.14 Cn1cnc(C2CO2)c1 Amb27187209 [0,1,0,0,1,0|2,0,0]=4 4013 B10R2.14 Cn1cnc([C@@H]2CO2)c1 Amb33324314 [0,1,0,0,1,0|2,0,0]=4 4014 B10R2.14 Cn1cnc([C@H]2CO2)c1 Amb33324389 [0,1,0,0,1,0|2,0,0]=4 4015 B10R2.14 Nc1cc(C2CC2)co1 Amb10600619 [0,1,0,0,1,0|2,0,0]=4 4016 B10R2.14 Nc1cc(C2CC2)cs1 Amb10600617 [0,1,0,0,1,0|2,0,0]=4 4017 B10R2.14 Nc1ccc(C2CC2)o1 Amb10600615 [0,1,0,0,1,0|2,0,0]=4 4018 B10R2.14 Nc1ccc(C2CC2)s1 Amb10600613 [0,1,0,0,1,0|2,0,0]=4 4019 B10R2.14 Nc1ccn(C2CC2)c1 Amb24321504 [0,1,0,0,1,0|2,0,0]=4 4020 B10R2.14 Oc1cc(C2CC2)cs1 Amb20617903 [0,1,0,0,1,0|2,0,0]=4 4021 B10R2.14 Oc1ccc(C2CC2)o1 Amb20617902 [0,1,0,0,1,0|2,0,0]=4 4022 B10R2.14 Oc1ccc(C2CC2)s1 Amb20617461 [0,1,0,0,1,0|2,0,0]=4 4023 B10R2.16 CC1(c2ccco2)CO1 Amb33360931 [0,1,0,0,1,0|1,0,0]=3 4024 B10R2.16 CC1(c2cccs2)CC1 Amb25970427 [0,1,0,0,1,0|2,0,0]=4 4025 B10R2.16 CC1(c2cccs2)CN1 Amb18224065 [0,1,0,0,1,0|2,0,0]=4 4026 B10R2.16 CC1(c2cccs2)CO1 Amb17089380 [0,1,0,0,1,0|1,0,0]=3 4027 B10R2.16 CC1(c2ccns2)CO1 Amb33748194 [0,1,0,0,1,0|2,0,0]=4 4028 B10R2.16 CC1(c2ccoc2)CO1 Amb33360602 [0,1,0,0,1,0|1,0,0]=3 4029 B10R2.16 CC1(c2ccon2)CO1 Amb33197553 [0,1,0,0,1,0|2,0,0]=4 4030 B10R2.16 CC1(c2ccsc2)CO1 Amb33429255 [0,1,0,0,1,0|1,0,0]=3 4031 B10R2.16 CC1(c2cnco2)CO1 Amb33414795 [0,1,0,0,1,0|2,0,0]=4 4032 B10R2.16 CC1(c2cncs2)CO1 Amb33269116 [0,1,0,0,1,0|2,0,0]=4 4033 B10R2.16 CC1(c2cocn2)CO1 Amb33741317 [0,1,0,0,1,0|2,0,0]=4 4034 B10R2.16 CC1(c2cscn2)CO1 Amb33417810 [0,1,0,0,1,0|2,0,0]=4 4035 B10R2.16 CC1(c2ncco2)CO1 Amb33728358 [0,1,0,0,1,0|2,0,0]=4 4036 B10R2.16 CC1(c2nccs2)CO1 Amb24070152 [0,1,0,0,1,0|2,0,0]=4 4037 B10R2.16 CC1(n2cccc2)CC1 Amb28366159 [0,1,0,0,1,0|2,0,0]=4 4038 B10R2.16 NC1(c2ccco2)CC1 Amb18280408 [0,1,0,0,1,0|2,0,0]=4 4039 B10R2.16 NC1(c2cccs2)CC1 Amb18280287 [0,1,0,0,1,0|2,0,0]=4 4040 B10R2.16 NC1(c2ccoc2)CC1 Amb19651378 [0,1,0,0,1,0|2,0,0]=4 4041 B10R2.16 NC1(c2ccsc2)CC1 Amb18948041 [0,1,0,0,1,0|2,0,0]=4 4042 B10R2.16 OC1(c2ccco2)CC1 Amb27837498 [0,1,0,0,1,0|2,0,0]=4 4043 B10R2.16 OC1(c2cccs2)CC1 Amb25682979 [0,1,0,0,1,0|2,0,0]=4 4044 B10R2.16 OC1(c2ccoc2)CC1 Amb25998010 [0,1,0,0,1,0|2,0,0]=4 4045 B10R2.16 OC1(c2ccsc2)CC1 Amb26921622 [0,1,0,0,1,0|2,0,0]=4 4046 B10R2.21 Brc1ccsc1C2CO2 Amb24452268 [0,1,0,0,1,0|1,0,0]=3 4047 B10R2.21 Brc1ccsc1[C@@H]2CO2 Amb27878862 [0,1,0,0,1,0|1,0,0]=3 4048 B10R2.21 Brc1ccsc1[C@H]2CO2 Amb27445424 [0,1,0,0,1,0|1,0,0]=3 4049 B10R2.21 Brc1cscc1C2CC2 Amb18786309 [0,1,0,0,1,0|2,0,0]=4 4050 B10R2.21 Brc1occc1C2CC2 Amb13884535 [0,1,0,0,1,0|2,0,0]=4 4051 B10R2.21 Brc1sccc1C2CC2 Amb13884513 [0,1,0,0,1,0|2,0,0]=4 4052 B10R2.21 Cc1ccoc1C2CO2 Amb33343955 [0,1,0,0,1,0|1,0,0]=3 4053 B10R2.21 Cc1ccoc1[C@@H]2CO2 Amb33342409 [0,1,0,0,1,0|1,0,0]=3 4054 B10R2.21 Cc1ccoc1[C@H]2CO2 Amb33342496 [0,1,0,0,1,0|1,0,0]=3 4055 B10R2.21 Cc1ccsc1C2CO2 Amb28124553 [0,1,0,0,1,0|1,0,0]=3 4056 B10R2.21 Cc1ccsc1[C@@H]2CO2 Amb25975847 [0,1,0,0,1,0|1,0,0]=3 4057 B10R2.21 Cc1ccsc1[C@H]2CO2 Amb27180500 [0,1,0,0,1,0|1,0,0]=3 4058 B10R2.21 Cc1cscc1C2CO2 Amb33146700 [0,1,0,0,1,0|1,0,0]=3 4059 B10R2.21 Cc1cscc1[C@@H]2CO2 Amb33144394 [0,1,0,0,1,0|1,0,0]=3 4060 B10R2.21 Cc1cscc1[C@H]2CO2 Amb33144395 [0,1,0,0,1,0|1,0,0]=3 4061 B10R2.21 Cc1ncsc1C2CO2 Amb27400942 [0,1,0,0,1,0|2,0,0]=4 4062 B10R2.21 Cc1ncsc1[C@@H]2CO2 Amb33271155 [0,1,0,0,1,0|2,0,0]=4 4063 B10R2.21 Cc1ncsc1[C@H]2CO2 Amb33271156 [0,1,0,0,1,0|2,0,0]=4 4064 B10R2.21 Cc1occc1C2CO2 Amb24532881 [0,1,0,0,1,0|1,0,0]=3 4065 B10R2.21 Cc1occc1[C@@H]2CO2 Amb33273991 [0,1,0,0,1,0|1,0,0]=3 4066 B10R2.21 Cc1occc1[C@H]2CO2 Amb33273992 [0,1,0,0,1,0|1,0,0]=3 4067 B10R2.21 Cc1oncc1C2CO2 Amb26569568 [0,1,0,0,1,0|2,0,0]=4 4068 B10R2.21 Cc1oncc1[C@@H]2CO2 Amb33361084 [0,1,0,0,1,0|2,0,0]=4 4069 B10R2.21 Cc1oncc1[C@H]2CO2 Amb33361086 [0,1,0,0,1,0|2,0,0]=4 4070 B10R2.21 Clc1ccsc1C2CO2 Amb33257483 [0,1,0,0,1,0|1,0,0]=3 4071 B10R2.21 Clc1ccsc1[C@@H]2CO2 Amb33258283 [0,1,0,0,1,0|1,0,0]=3 4072 B10R2.21 Clc1ccsc1[C@H]2CO2 Amb33258280 [0,1,0,0,1,0|1,0,0]=3 4073 B10R2.21 Cn1cccc1C2CO2 Amb25877695 [0,1,0,0,1,0|1,0,0]=3 4074 B10R2.21 Cn1cccc1[C@@H]2CO2 Amb33374256 [0,1,0,0,1,0|1,0,0]=3 4075 B10R2.21 Cn1cccc1[C@H]2CO2 Amb33374257 [0,1,0,0,1,0|1,0,0]=3 4076 B10R2.21 Cn1ccnc1[C@@H]2CO2 Amb33426581 [0,1,0,0,1,0|2,0,0]=4 4077 B10R2.21 Cn1ccnc1[C@H]2CO2 Amb33426583 [0,1,0,0,1,0|2,0,0]=4 4078 B10R2.21 Cn1cncc1C2CO2 Amb28183161 [0,1,0,0,1,0|2,0,0]=4 4079 B10R2.21 Cn1cncc1[C@@H]2CO2 Amb32882402 [0,1,0,0,1,0|2,0,0]=4 4080 B10R2.21 Cn1cncc1[C@H]2CO2 Amb32882403 [0,1,0,0,1,0|2,0,0]=4 4081 B10R2.21 Cn1nccc1C2CO2 Amb33456888 [0,1,0,0,1,0|2,0,0]=4 4082 B10R2.21 Cn1nccc1[C@@H]2CO2 Amb24412663 [0,1,0,0,1,0|2,0,0]=4 4083 B10R2.21 Cn1nccc1[C@H]2CO2 Amb28454072 [0,1,0,0,1,0|2,0,0]=4 4084 B10R2.21 Nc1cscc1C2CC2 Amb18202931 [0,1,0,0,1,0|2,0,0]=4 4085 B10R2.21 Nc1sccc1C2CC2 Amb18202932 [0,1,0,0,1,0|2,0,0]=4 4086 B10R2.21 Nn1cccc1C2CC2 Amb27495479 [0,1,0,0,1,0|2,0,0]=4 4087 B12R2.11 BrC1CC1Cc2ccccc2 Amb27176533 [0,1,0,0,0,1|1,0,0]=3 4088 B12R2.11 Br[C@H]1C[C@@H]1Cc2ccccc2 Amb28287700 [0,1,0,0,0,1|1,0,0]=3 4089 B12R2.11 CC1CC1Nc2ccccc2 Amb24743217 [0,1,0,0,0,1|1,0,0]=3 4090 B12R2.11 C[C@@H]1C[C@@H]1Nc2ccccc2 Amb28059383 [0,1,0,0,0,1|1,0,0]=3 4091 B12R2.11 C[C@@H]1C[C@H]1Nc2ccncc2 Amb27420857 [0,1,0,0,0,1|2,0,0]=4 4092 B12R2.11 Cl[C@@H]1C[C@@H]1Cc2ccccc2 Amb27640652 [0,1,0,0,0,1|1,0,0]=3 4093 B12R2.11 NC1CC1Cc2ccccc2 Amb18960797 [0,1,0,0,0,1|1,0,0]=3 4094 B12R2.11 NC1CC1Cc2ccccc2 Amb19375025 [0,1,0,0,0,1|1,0,0]=3 4095 B12R2.11 NC1CC1Nc2ccccn2 Amb9462376 [0,1,0,0,0,1|2,0,0]=4 4096 B12R2.11 N[C@@H]1C[C@H]1Cc2ccccc2 Amb32953150 [0,1,0,0,0,1|1,0,0]=3 4097 B12R2.11 N[C@@H]1C[C@H]1Oc2ccccc2 Amb33347106 [0,1,0,0,0,1|1,0,0]=3 4098 B12R2.11 N[C@@H]1C[C@H]1Oc2cccnc2 Amb33347059 [0,1,0,0,0,1|2,0,0]=4 4099 B12R2.11 N[C@H]1C[C@@H]1Oc2ccccc2 Amb27494042 [0,1,0,0,0,1|1,0,0]=3 4100 B12R2.11 OC1O\C1=C/c2ccccc2 Amb27589709 [0,1,0,0,0,1|0,0,1]=3 4101 B12R2.94 CC1(Cc2ccccc2)CO1 Amb26023524 [0,1,0,0,0,1|0,0,0]=2 4102 B12R2.94 CC1(Cc2ccccn2)CO1 Amb27749783 [0,1,0,0,0,1|1,0,0]=3 4103 B12R2.94 CC1(Nc2ccccc2)CC1 Amb27176430 [0,1,0,0,0,1|1,0,0]=3 4104 B12R2.94 ClC1(Sc2ccccc2)CC1 Amb27948044 [0,1,0,0,0,1|1,0,0]=3 4105 B12R2.94 FC1(Cc2ccccc2)CC1 Amb28326343 [0,1,0,0,0,1|1,0,0]=3 4106 B12R2.94 FC1(Cc2ccccc2)N=N1 Amb24425472 [0,1,0,0,0,1|2,0,0]=4 4107 B12R2.94 NC1(Cc2ccccc2)CC1 Amb22587208 [0,1,0,0,0,1|1,0,0]=3 4108 B12R2.94 NC1(Cc2ccccc2)CC1 Amb2607807 [0,1,0,0,0,1|1,0,0]=3 4109 B12R2.94 NC1(Cc2ccccc2)CC1 Amb2721362 [0,1,0,0,0,1|1,0,0]=3 4110 B12R2.94 NC1(Cc2ccccn2)CC1 Amb18963284 [0,1,0,0,0,1|2,0,0]=4 4111 B12R2.94 NC1(Cc2cccnc2)CC1 Amb18286910 [0,1,0,0,0,1|2,0,0]=4 4112 B12R2.94 NC1(Cc2ccncc2)CC1 Amb18286716 [0,1,0,0,0,1|2,0,0]=4 4113 B12R2.94 OC1(Cc2ccccc2)CC1 Amb19374431 [0,1,0,0,0,1|1,0,0]=3 4114 B12R2.94 OC1(Cc2ccccn2)CC1 Amb33360132 [0,1,0,0,0,1|2,0,0]=4 4115 B12R2.94 OC1(Cc2cccnc2)CC1 Amb27207956 [0,1,0,0,0,1|2,0,0]=4 4116 B12R2.94 OC1(Cc2ccncc2)CC1 Amb25768733 [0,1,0,0,0,1|2,0,0]=4 4117 B12R2.225 Brc1ccccc1CC2CO2 Amb25890766 [0,1,0,0,0,1|0,0,0]=2 4118 B12R2.225 Brc1ccccc1NC2CC2 Amb25922951 [0,1,0,0,0,1|1,0,0]=3 4119 B12R2.225 Brc1ccccc1OC2CC2 Amb25771923 [0,1,0,0,0,1|1,0,0]=3 4120 B12R2.225 Brc1ccccc1SC2CC2 Amb26505970 [0,1,0,0,0,1|1,0,0]=3 4121 B12R2.225 Brc1cccnc1CC2CO2 Amb33336088 [0,1,0,0,0,1|1,0,0]=3 4122 B12R2.225 Brc1cccnc1NC2CC2 Amb18282851 [0,1,0,0,0,1|2,0,0]=4 4123 B12R2.225 Brc1cccnc1OC2CC2 Amb27963689 [0,1,0,0,0,1|2,0,0]=4 4124 B12R2.225 Brc1ccncc1OC2CC2 Amb25890502 [0,1,0,0,0,1|2,0,0]=4 4125 B12R2.225 Brc1cnccc1CC2CO2 Amb33388630 [0,1,0,0,0,1|1,0,0]=3 4126 B12R2.225 Brc1cnccc1NC2CC2 Amb27485101 [0,1,0,0,0,1|2,0,0]=4 4127 B12R2.225 Brc1cnccc1OC2CC2 Amb28186461 [0,1,0,0,0,1|2,0,0]=4 4128 B12R2.225 Brc1ncccc1CC2CO2 Amb33387840 [0,1,0,0,0,1|1,0,0]=3 4129 B12R2.225 Brc1ncccc1OC2CC2 Amb28129826 [0,1,0,0,0,1|2,0,0]=4 4130 B12R2.225 Cc1ccccc1CC2CO2 Amb25122222 [0,1,0,0,0,1|0,0,0]=2 4131 B12R2.225 Cc1ccccc1NC2CC2 Amb27593469 [0,1,0,0,0,1|1,0,0]=3 4132 B12R2.225 Cc1cccnc1CC2CO2 Amb33428741 [0,1,0,0,0,1|1,0,0]=3 4133 B12R2.225 Cc1cccnc1NC2CC2 Amb18959724 [0,1,0,0,0,1|2,0,0]=4 4134 B12R2.225 Cc1ccncc1CC2CO2 Amb25784408 [0,1,0,0,0,1|1,0,0]=3 4135 B12R2.225 Cc1cnccc1CC2CO2 Amb33424633 [0,1,0,0,0,1|1,0,0]=3 4136 B12R2.225 Cc1ncccc1CC2CO2 Amb32879704 [0,1,0,0,0,1|1,0,0]=3 4137 B12R2.225 Cc1ncccc1NC2CC2 Amb27602110 [0,1,0,0,0,1|2,0,0]=4 4138 B12R2.225 Cc1nccnc1CC2CO2 Amb33142182 [0,1,0,0,0,1|2,0,0]=4 4139 B12R2.225 Cc1ncncc1CC2CO2 Amb33268102 [0,1,0,0,0,1|2,0,0]=4 4140 B12R2.225 Clc1ccccc1C=C2CC2 Amb19515482 [0,1,0,0,0,1|1,0,1]=4 4141 B12R2.225 Clc1ccccc1CC2CO2 Amb25094935 [0,1,0,0,0,1|0,0,0]=2 4142 B12R2.225 Clc1ccccc1OC2CC2 Amb27664627 [0,1,0,0,0,1|1,0,0]=3 4143 B12R2.225 Clc1cccnc1SC2CC2 Amb28208192 [0,1,0,0,0,1|2,0,0]=4 4144 B12R2.225 Clc1ccncc1NC2CC2 Amb27664593 [0,1,0,0,0,1|2,0,0]=4 4145 B12R2.225 Clc1ccncc1OC2CC2 Amb28285378 [0,1,0,0,0,1|2,0,0]=4 4146 B12R2.225 Clc1cnccc1CC2CO2 Amb33413587 [0,1,0,0,0,1|1,0,0]=3 4147 B12R2.225 Clc1cnccc1OC2CC2 Amb26551881 [0,1,0,0,0,1|2,0,0]=4 4148 B12R2.225 Clc1ncccc1CC2CO2 Amb33257354 [0,1,0,0,0,1|1,0,0]=3 4149 B12R2.225 Clc1ncccc1NC2CC2 Amb28060553 [0,1,0,0,0,1|2,0,0]=4 4150 B12R2.225 Clc1ncccc1OC2CC2 Amb26600889 [0,1,0,0,0,1|2,0,0]=4 4151 B12R2.225 Cn1cccc\c1=N/C2CC2 Amb24068350 [0,1,0,0,0,1|2,0,0]=4 4152 B12R2.225 Fc1ccccc1C=C2CC2 Amb25714200 [0,1,0,0,0,1|1,0,1]=4 4153 B12R2.225 Fc1ccccc1CC2CO2 Amb27839801 [0,1,0,0,0,1|0,0,0]=2 4154 B12R2.225 Fc1ccccc1OC2CC2 Amb26871851 [0,1,0,0,0,1|1,0,0]=3 4155 B12R2.225 Fc1ccccc1SC2CC2 Amb24717992 [0,1,0,0,0,1|1,0,0]=3 4156 B12R2.225 Fc1cccnc1CC2CO2 Amb33418781 [0,1,0,0,0,1|1,0,0]=3 4157 B12R2.225 Fc1cccnc1NC2CC2 Amb18963789 [0,1,0,0,0,1|2,0,0]=4 4158 B12R2.225 Fc1cccnc1OC2CC2 Amb25876743 [0,1,0,0,0,1|2,0,0]=4 4159 B12R2.225 Fc1cnccc1CC2CO2 Amb26637281 [0,1,0,0,0,1|1,0,0]=3 4160 B12R2.225 Fc1cnccc1NC2CC2 Amb30036528 [0,1,0,0,0,1|2,0,0]=4 4161 B12R2.225 Fc1cnccc1OC2CC2 Amb26497990 [0,1,0,0,0,1|2,0,0]=4 4162 B12R2.225 Fc1ncccc1CC2CO2 Amb33377201 [0,1,0,0,0,1|1,0,0]=3 4163 B12R2.225 Fc1ncccc1NC2CC2 Amb35725081 [0,1,0,0,0,1|2,0,0]=4 4164 B12R2.225 Ic1ccccc1OC2CC2 Amb25940708 [0,1,0,0,0,1|1,0,0]=3 4165 B12R2.225 Ic1cccnc1NC2CC2 Amb4561138 [0,1,0,0,0,1|2,0,0]=4 4166 B12R2.225 Ic1ccncc1OC2CC2 Amb28187137 [0,1,0,0,0,1|2,0,0]=4 4167 B12R2.225 Nc1ccccc1CC2CC2 Amb24117001 [0,1,0,0,0,1|1,0,0]=3 4168 B12R2.225 Nc1ccccc1NC2CC2 Amb28960308 [0,1,0,0,0,1|1,0,0]=3 4169 B12R2.225 Nc1ccccc1NC2CC2 Amb9205213 [0,1,0,0,0,1|1,0,0]=3 4170 B12R2.225 Nc1ccccc1OC2CC2 Amb26322391 [0,1,0,0,0,1|1,0,0]=3 4171 B12R2.225 Nc1ccccc1SC2CC2 Amb25302953 [0,1,0,0,0,1|1,0,0]=3 4172 B12R2.225 Nc1cccnc1NC2CC2 Amb33528932 [0,1,0,0,0,1|2,0,0]=4 4173 B12R2.225 Nc1cccnc1OC2CC2 Amb33035554 [0,1,0,0,0,1|2,0,0]=4 4174 B12R2.225 Nc1cccnc1SC2CC2 Amb27758981 [0,1,0,0,0,1|2,0,0]=4 4175 B12R2.225 Nc1ccncc1CC2CC2 Amb27448590 [0,1,0,0,0,1|2,0,0]=4 4176 B12R2.225 Nc1ccncc1OC2CC2 Amb25295329 [0,1,0,0,0,1|2,0,0]=4 4177 B12R2.225 Nc1cnccc1NC2CC2 Amb33529106 [0,1,0,0,0,1|2,0,0]=4 4178 B12R2.225 Nc1cnccc1OC2CC2 Amb26852122 [0,1,0,0,0,1|2,0,0]=4 4179 B12R2.225 Nc1cnccc1SC2CC2 Amb27392911 [0,1,0,0,0,1|2,0,0]=4 4180 B12R2.225 Nc1ncccc1NC2CC2 Amb26611644 [0,1,0,0,0,1|2,0,0]=4 4181 B12R2.225 O=C1C=CC=NN1CC2CO2 Amb18179414 [0,1,0,0,0,1|2,0,0]=4 4182 B12R2.225 O=C1C=CN=CN1C[C@H]2CO2 Amb27752600 [0,1,0,0,0,1|2,0,0]=4 4183 B12R2.225 O=C1N=CC=CN1CC2CO2 Amb18181707 [0,1,0,0,0,1|2,0,0]=4 4184 B12R2.225 O=C1N=CC=CN1C[C@@H]2CO2 Amb27494233 [0,1,0,0,0,1|2,0,0]=4 4185 B12R2.225 Oc1ccccc1CC2CC2 Amb22752448 [0,1,0,0,0,1|1,0,0]=3 4186 B12R2.225 Oc1ccccc1OC2CC2 Amb8390104 [0,1,0,0,0,1|1,0,0]=3 4187 B12R2.225 Oc1cccnc1SC2CC2 Amb33295107 [0,1,0,0,0,1|2,0,0]=4 4188 B12R2.294 Brc1ccc(CC2CC2)cc1 Amb26855885 [0,1,0,0,0,1|1,0,0]=3 4189 B12R2.294 Brc1ccc(CC2CO2)cc1 Amb29880790 [0,1,0,0,0,1|0,0,0]=2 4190 B12R2.294 Brc1ccc(CC2CO2)cn1 Amb33388415 [0,1,0,0,0,1|1,0,0]=3 4191 B12R2.294 Brc1ccc(CC2CO2)nc1 Amb33477137 [0,1,0,0,0,1|1,0,0]=3 4192 B12R2.294 Brc1ccc(NC2CC2)cc1 Amb27873756 [0,1,0,0,0,1|1,0,0]=3 4193 B12R2.294 Brc1ccc(NC2CC2)cn1 Amb27393607 [0,1,0,0,0,1|2,0,0]=4 4194 B12R2.294 Brc1ccc(NC2CC2)nc1 Amb6634196 [0,1,0,0,0,1|2,0,0]=4 4195 B12R2.294 Brc1ccc(OC2CC2)cc1 Amb22227906 [0,1,0,0,0,1|1,0,0]=3 4196 B12R2.294 Brc1ccc(OC2CC2)cn1 Amb27597461 [0,1,0,0,0,1|2,0,0]=4 4197 B12R2.294 Brc1ccc(OC2CC2)nc1 Amb23538034 [0,1,0,0,0,1|2,0,0]=4 4198 B12R2.294 Brc1ccc(SC2CC2)cc1 Amb25942947 [0,1,0,0,0,1|1,0,0]=3 4199 B12R2.294 Brc1ccc(SC2CC2)nc1 Amb27840269 [0,1,0,0,0,1|2,0,0]=4 4200 B12R2.294 Brc1cnc(CC2CO2)nc1 Amb33334812 [0,1,0,0,0,1|2,0,0]=4 4201 B12R2.294 Cc1ccc(CC2CO2)cc1 Amb28076534 [0,1,0,0,0,1|0,0,0]=2 4202 B12R2.294 Cc1ccc(CC2CO2)cn1 Amb25139245 [0,1,0,0,0,1|1,0,0]=3 4203 B12R2.294 Cc1ccc(CC2CO2)nc1 Amb33198457 [0,1,0,0,0,1|1,0,0]=3 4204 B12R2.294 Cc1ccc(OC2CC2)cn1 Amb27214180 [0,1,0,0,0,1|2,0,0]=4 4205 B12R2.294 Cc1cnc(CC2CO2)cn1 Amb33374331 [0,1,0,0,0,1|2,0,0]=4 4206 B12R2.294 Clc1ccc(CC2CC2)cc1 Amb22751349 [0,1,0,0,0,1|1,0,0]=3 4207 B12R2.294 Clc1ccc(CC2CO2)cc1 Amb24712110 [0,1,0,0,0,1|0,0,0]=2 4208 B12R2.294 Clc1ccc(CC2CO2)cn1 Amb33261539 [0,1,0,0,0,1|1,0,0]=3 4209 B12R2.294 Clc1ccc(CC2CO2)nc1 Amb33058517 [0,1,0,0,0,1|1,0,0]=3 4210 B12R2.294 Clc1ccc(NC2CC2)nc1 Amb6620845 [0,1,0,0,0,1|2,0,0]=4 4211 B12R2.294 Clc1ccc(OC2CC2)cc1 Amb24406546 [0,1,0,0,0,1|1,0,0]=3 4212 B12R2.294 Clc1ccc(OC2CC2)cn1 Amb26631892 [0,1,0,0,0,1|2,0,0]=4 4213 B12R2.294 Clc1ccc(OC2CC2)nc1 Amb25106898 [0,1,0,0,0,1|2,0,0]=4 4214 B12R2.294 Clc1ccc(SC2CC2)cc1 Amb27759428 [0,1,0,0,0,1|1,0,0]=3 4215 B12R2.294 Fc1ccc(CC2CO2)cc1 Amb24390098 [0,1,0,0,0,1|0,0,0]=2 4216 B12R2.294 Fc1ccc(CC2CO2)cn1 Amb33425827 [0,1,0,0,0,1|1,0,0]=3 4217 B12R2.294 Fc1ccc(CC2CO2)nc1 Amb33315846 [0,1,0,0,0,1|1,0,0]=3 4218 B12R2.294 Fc1ccc(NC2CC2)cc1 Amb18267946 [0,1,0,0,0,1|1,0,0]=3 4219 B12R2.294 Fc1ccc(OC2CC2)cc1 Amb25829442 [0,1,0,0,0,1|1,0,0]=3 4220 B12R2.294 Fc1ccc(OC2CC2)cn1 Amb25151416 [0,1,0,0,0,1|2,0,0]=4 4221 B12R2.294 Fc1ccc(OC2CC2)nc1 Amb27240918 [0,1,0,0,0,1|2,0,0]=4 4222 B12R2.294 Fc1ccc(SC2CC2)cc1 Amb24591737 [0,1,0,0,0,1|1,0,0]=3 4223 B12R2.294 Ic1ccc(OC2CC2)cc1 Amb26611021 [0,1,0,0,0,1|1,0,0]=3 4224 B12R2.294 Nc1ccc(CC2CC2)cc1 Amb27251947 [0,1,0,0,0,1|1,0,0]=3 4225 B12R2.294 Nc1ccc(NC2CC2)cc1 Amb9205211 [0,1,0,0,0,1|1,0,0]=3 4226 B12R2.294 Nc1ccc(NC2CC2)cn1 Amb7767487 [0,1,0,0,0,1|2,0,0]=4 4227 B12R2.294 Nc1ccc(NC2CC2)nc1 Amb1118551 [0,1,0,0,0,1|2,0,0]=4 4228 B12R2.294 Nc1ccc(OC2CC2)cc1 Amb22011836 [0,1,0,0,0,1|1,0,0]=3 4229 B12R2.294 Nc1ccc(OC2CC2)cn1 Amb25143981 [0,1,0,0,0,1|2,0,0]=4 4230 B12R2.294 Nc1ccc(OC2CC2)nc1 Amb26597352 [0,1,0,0,0,1|2,0,0]=4 4231 B12R2.294 O=C1C=CC(NC2CC2)=CN1 Amb28349033 [0,1,0,0,0,1|2,0,0]=4 4232 B12R2.294 Oc1ccc(NC2CC2)cc1 Amb27207191 [0,1,0,0,0,1|1,0,0]=3 4233 B12R2.294 Oc1ccc(OC2CC2)cc1 Amb24738590 [0,1,0,0,0,1|1,0,0]=3 4234 B12R2.294 Oc1ccc(SC2CC2)cc1 Amb24487005 [0,1,0,0,0,1|1,0,0]=3 4235 B12R2.294 Sc1ccc(OC2CC2)cc1 Amb24484395 [0,1,0,0,0,1|1,0,0]=3 4236 B12R2.1286 Brc1cc(NC2CC2)ccn1 Amb27823468 [0,1,0,0,0,1|2,0,0]=4 4237 B12R2.1286 Brc1cc(OC2CC2)ccn1 Amb26572934 [0,1,0,0,0,1|2,0,0]=4 4238 B12R2.1286 Brc1cccc(CC2CO2)c1 Amb29880791 [0,1,0,0,0,1|0,0,0]=2 4239 B12R2.1286 Brc1cccc(CC2CO2)n1 Amb33433194 [0,1,0,0,0,1|1,0,0]=3 4240 B12R2.1286 Brc1cccc(NC2CC2)c1 Amb24622562 [0,1,0,0,0,1|1,0,0]=3 4241 B12R2.1286 Brc1cccc(NC2CC2)n1 Amb10599308 [0,1,0,0,0,1|2,0,0]=4 4242 B12R2.1286 Brc1cccc(OC2CC2)c1 Amb22057669 [0,1,0,0,0,1|1,0,0]=3 4243 B12R2.1286 Brc1cccc(OC2CC2)n1 Amb24610576 [0,1,0,0,0,1|2,0,0]=4 4244 B12R2.1286 Brc1cccc(SC2CC2)c1 Amb22831516 [0,1,0,0,0,1|1,0,0]=3 4245 B12R2.1286 Brc1ccnc(NC2CC2)c1 Amb19959077 [0,1,0,0,0,1|2,0,0]=4 4246 B12R2.1286 Brc1ccnc(OC2CC2)c1 Amb22276478 [0,1,0,0,0,1|2,0,0]=4 4247 B12R2.1286 Brc1cncc(CC2CO2)c1 Amb33389115 [0,1,0,0,0,1|1,0,0]=3 4248 B12R2.1286 Brc1cncc(OC2CC2)c1 Amb26995736 [0,1,0,0,0,1|2,0,0]=4 4249 B12R2.1286 Cc1cc(CC2CO2)ccn1 Amb32732932 [0,1,0,0,0,1|1,0,0]=3 4250 B12R2.1286 Cc1cccc(CC2CO2)c1 Amb27812633 [0,1,0,0,0,1|0,0,0]=2 4251 B12R2.1286 Cc1cccc(CC2CO2)n1 Amb33199921 [0,1,0,0,0,1|1,0,0]=3 4252 B12R2.1286 Cc1cccc(OC2CC2)n1 Amb28348509 [0,1,0,0,0,1|2,0,0]=4 4253 B12R2.1286 Cc1ccnc(CC2CO2)c1 Amb33318097 [0,1,0,0,0,1|1,0,0]=3 4254 B12R2.1286 Cc1cncc(CC2CO2)c1 Amb27666800 [0,1,0,0,0,1|1,0,0]=3 4255 B12R2.1286 Cc1cncc(OC2CC2)c1 Amb24717126 [0,1,0,0,0,1|2,0,0]=4 4256 B12R2.1286 Clc1cc(OC2CC2)ccn1 Amb26345152 [0,1,0,0,0,1|2,0,0]=4 4257 B12R2.1286 Clc1cccc(CC2CO2)c1 Amb27839788 [0,1,0,0,0,1|0,0,0]=2 4258 B12R2.1286 Clc1cccc(CC2CO2)n1 Amb33222675 [0,1,0,0,0,1|1,0,0]=3 4259 B12R2.1286 Clc1cccc(NC2CC2)c1 Amb18930890 [0,1,0,0,0,1|1,0,0]=3 4260 B12R2.1286 Clc1cccc(OC2CC2)c1 Amb27861916 [0,1,0,0,0,1|1,0,0]=3 4261 B12R2.1286 Clc1cccc(OC2CC2)n1 Amb24352134 [0,1,0,0,0,1|2,0,0]=4 4262 B12R2.1286 Clc1cncc(NC2CC2)c1 Amb35733486 [0,1,0,0,0,1|2,0,0]=4 4263 B12R2.1286 Clc1cncc(OC2CC2)c1 Amb25921473 [0,1,0,0,0,1|2,0,0]=4 4264 B12R2.1286 Fc1cc(OC2CC2)ccn1 Amb26459877 [0,1,0,0,0,1|2,0,0]=4 4265 B12R2.1286 Fc1cccc(C=C2CC2)c1 Amb24432667 [0,1,0,0,0,1|1,0,1]=4 4266 B12R2.1286 Fc1cccc(CC2CO2)c1 Amb24558530 [0,1,0,0,0,1|0,0,0]=2 4267 B12R2.1286 Fc1cccc(NC2CC2)c1 Amb18270328 [0,1,0,0,0,1|1,0,0]=3 4268 B12R2.1286 Fc1cccc(NC2CC2)n1 Amb18281984 [0,1,0,0,0,1|2,0,0]=4 4269 B12R2.1286 Fc1cccc(OC2CC2)c1 Amb25798491 [0,1,0,0,0,1|1,0,0]=3 4270 B12R2.1286 Fc1cccc(OC2CC2)n1 Amb28074195 [0,1,0,0,0,1|2,0,0]=4 4271 B12R2.1286 Fc1ccnc(CC2CO2)c1 Amb33320272 [0,1,0,0,0,1|1,0,0]=3 4272 B12R2.1286 Fc1ccnc(OC2CC2)c1 Amb28364416 [0,1,0,0,0,1|2,0,0]=4 4273 B12R2.1286 Fc1cncc(CC2CO2)c1 Amb25211203 [0,1,0,0,0,1|1,0,0]=3 4274 B12R2.1286 Ic1cccc(OC2CC2)c1 Amb26006862 [0,1,0,0,0,1|1,0,0]=3 4275 B12R2.1286 Nc1cc(OC2CC2)ccn1 Amb26527574 [0,1,0,0,0,1|2,0,0]=4 4276 B12R2.1286 Nc1cccc(NC2CC2)c1 Amb33533212 [0,1,0,0,0,1|1,0,0]=3 4277 B12R2.1286 Nc1cccc(OC2CC2)c1 Amb22011837 [0,1,0,0,0,1|1,0,0]=3 4278 B12R2.1286 Nc1cccc(OC2CC2)c1 Amb33738815 [0,1,0,0,0,1|1,0,0]=3 4279 B12R2.1286 Nc1cccc(SC2CC2)c1 Amb27270830 [0,1,0,0,0,1|1,0,0]=3 4280 B12R2.1286 Nc1ccnc(NC2CC2)c1 Amb17334285 [0,1,0,0,0,1|2,0,0]=4 4281 B12R2.1286 Nc1ccnc(OC2CC2)c1 Amb26611463 [0,1,0,0,0,1|2,0,0]=4 4282 B12R2.1286 Nc1cncc(NC2CC2)c1 Amb27754624 [0,1,0,0,0,1|2,0,0]=4 4283 B12R2.1286 Oc1cccc(NC2CC2)c1 Amb24464849 [0,1,0,0,0,1|1,0,0]=3 4284 B12R2.1286 Oc1cccc(OC2CC2)c1 Amb24085348 [0,1,0,0,0,1|1,0,0]=3 4285 B12R2.2075 Br[C@@H](c1ccccc1)[C@@H]2CO2 Amb27204462 [0,1,0,0,0,1|0,0,0]=2 4286 B12R2.2075 C=C(c1ccccc1)C2CC2 Amb27856321 [0,1,0,0,0,1|1,0,0]=3 4287 B12R2.2075 CC(c1ccccc1)C2CO2 Amb33540219 [0,1,0,0,0,1|0,0,0]=2 4288 B12R2.2075 CC(c1ccccc1)[C@@H]2CO2 Amb33082137 [0,1,0,0,0,1|0,0,0]=2 4289 B12R2.2075 CC(c1ccccc1)[C@H]2CO2 Amb33082136 [0,1,0,0,0,1|0,0,0]=2 4290 B12R2.2075 CN(c1ccccc1)C2CC2 Amb26509274 [0,1,0,0,0,1|1,0,0]=3 4291 B12R2.2075 Cl[C@@H](c1ccccc1)[C@@H]2CO2 Amb27865491 [0,1,0,0,0,1|0,0,0]=2 4292 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [0,1,0,0,0,1|1,0,0]=3 4293 B12R2.2075 NC(c1ccccc1)C2CC2 Amb482312 [0,1,0,0,0,1|1,0,0]=3 4294 B12R2.2075 NC(c1ccccn1)C2CC2 Amb3788125 [0,1,0,0,0,1|2,0,0]=4 4295 B12R2.2075 NC(c1cccnc1)C2CC2 Amb33535397 [0,1,0,0,0,1|2,0,0]=4 4296 B12R2.2075 NC(c1ccncc1)C2CC2 Amb22497035 [0,1,0,0,0,1|2,0,0]=4 4297 B12R2.2075 N[C@@H](c1ccccc1)C2CC2 Amb22406366 [0,1,0,0,0,1|1,0,0]=3 4298 B12R2.2075 N[C@@H](c1ccccc1)C2CC2 Amb26960416 [0,1,0,0,0,1|1,0,0]=3 4299 B12R2.2075 N[C@H](c1ccccc1)C2CC2 Amb22406367 [0,1,0,0,0,1|1,0,0]=3 4300 B12R2.2075 N[C@H](c1ccccc1)C2CC2 Amb22744981 [0,1,0,0,0,1|1,0,0]=3 4301 B12R2.2075 N[C@H](c1cccnc1)C2CC2 Amb28423502 [0,1,0,0,0,1|2,0,0]=4 4302 B12R2.2075 N[C@H](c1ccncc1)C2CC2 Amb28429801 [0,1,0,0,0,1|2,0,0]=4 4303 B12R2.2075 O=C(c1ccccc1)C2C=N2 Amb28122438 [0,1,0,0,0,1|1,0,1]=4 4304 B12R2.2075 O=C(c1ccccc1)C2CC2 Amb4115715 [0,1,0,0,0,1|1,0,0]=3 4305 B12R2.2075 O=C(c1ccccn1)C2CC2 Amb20248180 [0,1,0,0,0,1|2,0,0]=4 4306 B12R2.2075 O=C(c1cccnc1)C2CC2 Amb10607961 [0,1,0,0,0,1|2,0,0]=4 4307 B12R2.2075 O=C(c1ccncc1)C2CC2 Amb23454989 [0,1,0,0,0,1|2,0,0]=4 4308 B12R2.2075 OC(c1ccccc1)C2CC2 Amb33534747 [0,1,0,0,0,1|1,0,0]=3 4309 B12R2.2075 OC(c1ccccc1)C2CO2 Amb27210172 [0,1,0,0,0,1|0,0,0]=2 4310 B12R2.2075 OC(c1ccccn1)C2CC2 Amb27982276 [0,1,0,0,0,1|2,0,0]=4 4311 B12R2.2075 OC(c1ccccn1)C2CC2 Amb32666125 [0,1,0,0,0,1|2,0,0]=4 4312 B12R2.2075 OC(c1cccnc1)C2CC2 Amb22497231 [0,1,0,0,0,1|2,0,0]=4 4313 B12R2.2075 O[C@@H](c1ccccc1)C2CO2 Amb27839920 [0,1,0,0,0,1|0,0,0]=2 4314 B12R2.2075 O[C@@H](c1ccccn1)C2CC2 Amb32882520 [0,1,0,0,0,1|2,0,0]=4 4315 B12R2.2075 O[C@H](c1ccccc1)C2CC2 Amb27955379 [0,1,0,0,0,1|1,0,0]=3 4316 B12R2.2075 O[C@H](c1ccccc1)C2CO2 Amb27593359 [0,1,0,0,0,1|0,0,0]=2 4317 B12R2.2075 O[C@H](c1ccccc1)[C@@H]2CO2 Amb27448761 [0,1,0,0,0,1|0,0,0]=2 4318 B12R2.2075 O[C@H](c1ccccn1)C2CC2 Amb32882519 [0,1,0,0,0,1|2,0,0]=4 4319 B12R2.2075 SC(c1ccccc1)C2CC2 Amb33537940 [0,1,0,0,0,1|1,0,0]=3 4320 B12R2.22 BrC1CC(c2ccccc2)C1 Amb27798250 [0,1,0,0,0,1|1,0,0]=3 4321 B12R2.22 Br[C@H]1C[C@@H](c2ccccc2)C1 Amb27166116 [0,1,0,0,0,1|1,0,0]=3 4322 B12R2.22 C=C1CC(c2ccccc2)C1 Amb35681149 [0,1,0,0,0,1|1,0,0]=3 4323 B12R2.22 ClC1CC(c2ccccc2)C1 Amb35733980 [0,1,0,0,0,1|1,0,0]=3 4324 B12R2.22 NC1CC(c2ccccc2)C1 Amb19514746 [0,1,0,0,0,1|1,0,0]=3 4325 B12R2.22 NC1CC(c2ccccc2)C1 Amb9496746 [0,1,0,0,0,1|1,0,0]=3 4326 B12R2.22 NC1CC(c2ccccn2)C1 Amb26370978 [0,1,0,0,0,1|2,0,0]=4 4327 B12R2.22 NC1CC(c2ccccn2)C1 Amb33295179 [0,1,0,0,0,1|2,0,0]=4 4328 B12R2.22 NC1CC(c2cccnc2)C1 Amb24178936 [0,1,0,0,0,1|2,0,0]=4 4329 B12R2.22 NC1CC(c2cccnc2)C1 Amb25313817 [0,1,0,0,0,1|2,0,0]=4 4330 B12R2.22 NC1CC(c2ccncc2)C1 Amb26975408 [0,1,0,0,0,1|2,0,0]=4 4331 B12R2.22 NC1CC(c2ccncc2)C1 Amb33456466 [0,1,0,0,0,1|2,0,0]=4 4332 B12R2.22 NC1CC(c2ccncc2)C1 Amb35788877 [0,1,0,0,0,1|2,0,0]=4 4333 B12R2.22 NC1CN(c2ccccc2)C1 Amb23598844 [0,1,0,0,0,1|2,0,0]=4 4334 B12R2.22 NC1CN(c2ccccc2)C1 Amb30869768 [0,1,0,0,0,1|2,0,0]=4 4335 B12R2.22 N[C@H]1C[C@@H](c2ccccc2)C1 Amb23439754 [0,1,0,0,0,1|1,0,0]=3 4336 B12R2.22 N[C@H]1C[C@@H](c2ccccc2)C1 Amb32653334 [0,1,0,0,0,1|1,0,0]=3 4337 B12R2.22 N[C@H]1C[C@@H](c2cccnc2)C1 Amb24178917 [0,1,0,0,0,1|2,0,0]=4 4338 B12R2.22 N[C@H]1C[C@@H](c2ccncc2)C1 Amb27176278 [0,1,0,0,0,1|2,0,0]=4 4339 B12R2.22 N[C@H]1C[C@@H](c2ccncc2)C1 Amb33677251 [0,1,0,0,0,1|2,0,0]=4 4340 B12R2.22 N[C@H]1C[C@H](c2ccccc2)C1 Amb23439755 [0,1,0,0,0,1|1,0,0]=3 4341 B12R2.22 N[C@H]1C[C@H](c2ccccc2)C1 Amb33473674 [0,1,0,0,0,1|1,0,0]=3 4342 B12R2.22 N[C@H]1C[C@H](c2ccccn2)C1 Amb27839832 [0,1,0,0,0,1|2,0,0]=4 4343 B12R2.22 N[C@H]1C[C@H](c2cccnc2)C1 Amb24178920 [0,1,0,0,0,1|2,0,0]=4 4344 B12R2.22 N[C@H]1C[C@H](c2cccnc2)C1 Amb28287764 [0,1,0,0,0,1|2,0,0]=4 4345 B12R2.22 N[C@H]1C[C@H](c2ccncc2)C1 Amb27440155 [0,1,0,0,0,1|2,0,0]=4 4346 B12R2.22 N[C@H]1C[C@H](c2ccncc2)C1 Amb33677250 [0,1,0,0,0,1|2,0,0]=4 4347 B12R2.22 O=C1CC(c2ccccc2)C1 Amb6739873 [0,1,0,0,0,1|1,0,0]=3 4348 B12R2.22 O=C1CC(c2ccccc2)N1 Amb1993905 [0,1,0,0,0,1|1,0,0]=3 4349 B12R2.22 O=C1CC(c2ccccn2)C1 Amb25891417 [0,1,0,0,0,1|2,0,0]=4 4350 B12R2.22 O=C1CC(c2cccnc2)C1 Amb25151161 [0,1,0,0,0,1|2,0,0]=4 4351 B12R2.22 O=C1CC(c2ccncc2)C1 Amb24407200 [0,1,0,0,0,1|2,0,0]=4 4352 B12R2.22 O=C1CC(c2ccncc2)N1 Amb27262270 [0,1,0,0,0,1|2,0,0]=4 4353 B12R2.22 OC1CC(c2ccccc2)C1 Amb33550604 [0,1,0,0,0,1|1,0,0]=3 4354 B12R2.22 OC1CN(c2ccccc2)C1 Amb23598700 [0,1,0,0,0,1|2,0,0]=4 4355 B12R2.22 O[C@H]1C[C@@H](c2ccccc2)C1 Amb27839916 [0,1,0,0,0,1|1,0,0]=3 4356 B12R2.22 O[C@H]1C[C@@H](c2ccncc2)C1 Amb27258016 [0,1,0,0,0,1|2,0,0]=4 4357 B12R2.22 O[C@H]1C[C@H](c2ccccc2)C1 Amb25749083 [0,1,0,0,0,1|1,0,0]=3 4358 B12R2.22 O[C@H]1C[C@H](c2ccccn2)C1 Amb27839913 [0,1,0,0,0,1|2,0,0]=4 4359 B12R2.22 O[C@H]1C[C@H](c2ccncc2)C1 Amb27802818 [0,1,0,0,0,1|2,0,0]=4 4360 B12R2.22 S=C1CC(c2ccccc2)N1 Amb28182509 [0,1,0,0,0,1|1,0,0]=3 4361 B12R2.22 SC1CC(c2ccccc2)C1 Amb24690234 [0,1,0,0,0,1|1,0,0]=3 4362 B12R2.23 CC1CCN1c2ccccc2 Amb28312828 [0,1,0,0,0,1|2,0,0]=4 4363 B12R2.23 CC1CNC1c2ccccc2 Amb19338009 [0,1,0,0,0,1|1,0,0]=3 4364 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [0,1,0,0,0,1|1,0,0]=3 4365 B12R2.23 CN1CCC1c2cccnc2 Amb27792386 [0,1,0,0,0,1|2,0,0]=4 4366 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [0,1,0,0,0,1|1,0,0]=3 4367 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [0,1,0,0,0,1|1,0,0]=3 4368 B12R2.23 NC1CCC1c2ccccn2 Amb27430527 [0,1,0,0,0,1|2,0,0]=4 4369 B12R2.23 NC1CCC1c2ccncc2 Amb28055952 [0,1,0,0,0,1|2,0,0]=4 4370 B12R2.23 N[C@@H]1CC[C@@H]1c2ccccc2 Amb28594309 [0,1,0,0,0,1|1,0,0]=3 4371 B12R2.23 N[C@@H]1CC[C@@H]1c2ccccc2 Amb32665507 [0,1,0,0,0,1|1,0,0]=3 4372 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [0,1,0,0,0,1|1,0,0]=3 4373 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb33447016 [0,1,0,0,0,1|1,0,0]=3 4374 B12R2.23 N[C@@H]1CO[C@H]1c2ccccc2 Amb32685232 [0,1,0,0,0,1|0,0,0]=2 4375 B12R2.23 N[C@@H]1CO[C@H]1c2ccccc2 Amb32685233 [0,1,0,0,0,1|0,0,0]=2 4376 B12R2.23 N[C@H]1CC[C@H]1c2ccccc2 Amb27789894 [0,1,0,0,0,1|1,0,0]=3 4377 B12R2.23 N[C@H]1CS[C@@H]1c2ccccc2 Amb28245857 [0,1,0,0,0,1|0,1,0]=3 4378 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,1,0,0,0,1|1,0,0]=3 4379 B12R2.23 O=C1CCC1c2ccccn2 Amb28050845 [0,1,0,0,0,1|2,0,0]=4 4380 B12R2.23 O=C1CCC1c2ccncc2 Amb27470068 [0,1,0,0,0,1|2,0,0]=4 4381 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,1,0,0,0,1|2,0,0]=4 4382 B12R2.23 O=C1CC[C@H]1c2ccccc2 Amb28253765 [0,1,0,0,0,1|1,0,0]=3 4383 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,1,0,0,0,1|0,0,0]=2 4384 B12R2.23 O=C1NCC1c2ccccc2 Amb614326 [0,1,0,0,0,1|1,0,0]=3 4385 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [0,1,0,0,0,1|1,0,0]=3 4386 B12R2.23 OC1CCC1c2cccnc2 Amb25997850 [0,1,0,0,0,1|2,0,0]=4 4387 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [0,1,0,0,0,1|1,0,0]=3 4388 B12R2.23 OC1CNC1c2cccnc2 Amb25145873 [0,1,0,0,0,1|2,0,0]=4 4389 B12R2.23 OC1COC1c2ccccc2 Amb26336587 [0,1,0,0,0,1|0,0,0]=2 4390 B12R2.23 OC1CSC1c2ccccc2 Amb27396136 [0,1,0,0,0,1|0,1,0]=3 4391 B12R2.23 O[C@@H]1CO[C@@H]1c2ccccc2 Amb32679855 [0,1,0,0,0,1|0,0,0]=2 4392 B12R2.23 O[C@@H]1CO[C@H]1c2ccccc2 Amb32679869 [0,1,0,0,0,1|0,0,0]=2 4393 B12R2.23 O[C@H]1CC[C@H]1c2ccccc2 Amb27816201 [0,1,0,0,0,1|1,0,0]=3 4394 B12R2.23 O[C@H]1CO[C@H]1c2ccccc2 Amb28345399 [0,1,0,0,0,1|0,0,0]=2 4395 B12R2.23 S=C1CCN1c2ccccc2 Amb24709242 [0,1,0,0,0,1|2,0,0]=4 4396 B12R2.116 CC1(c2ccccc2)CCN1 Amb27263594 [0,1,0,0,0,1|1,0,0]=3 4397 B12R2.116 CC1(c2ccccc2)CCO1 Amb22497354 [0,1,0,0,0,1|0,0,0]=2 4398 B12R2.116 CC1(c2ccccc2)CNC1 Amb18065223 [0,1,0,0,0,1|1,0,0]=3 4399 B12R2.116 CC1(c2ccccc2)CNC1 Amb33551677 [0,1,0,0,0,1|1,0,0]=3 4400 B12R2.116 CC1(c2ccccc2)COC1 Amb22497353 [0,1,0,0,0,1|0,0,0]=2 4401 B12R2.116 CC1(c2ccccn2)CCC1 Amb26066736 [0,1,0,0,0,1|2,0,0]=4 4402 B12R2.116 CC1(c2ccccn2)CCN1 Amb28424071 [0,1,0,0,0,1|2,0,0]=4 4403 B12R2.116 CC1(c2ccccn2)CCO1 Amb32642016 [0,1,0,0,0,1|1,0,0]=3 4404 B12R2.116 CC1(c2cccnc2)CCO1 Amb32642010 [0,1,0,0,0,1|1,0,0]=3 4405 B12R2.116 CC1(c2ccncc2)CCO1 Amb32642022 [0,1,0,0,0,1|1,0,0]=3 4406 B12R2.116 ClC1(c2ccccc2)CNC1 Amb27444675 [0,1,0,0,0,1|1,0,0]=3 4407 B12R2.116 FC1(c2ccccc2)CNC1 Amb26450082 [0,1,0,0,0,1|1,0,0]=3 4408 B12R2.116 FC1(c2ccccc2)CNC1 Amb28872317 [0,1,0,0,0,1|1,0,0]=3 4409 B12R2.116 FC1(c2ccccc2)COC1 Amb22738854 [0,1,0,0,0,1|0,0,0]=2 4410 B12R2.116 FC1(c2cccnc2)CNC1 Amb25151802 [0,1,0,0,0,1|2,0,0]=4 4411 B12R2.116 NC1(c2ccccc2)CCC1 Amb2371533 [0,1,0,0,0,1|1,0,0]=3 4412 B12R2.116 NC1(c2ccccc2)CCC1 Amb453192 [0,1,0,0,0,1|1,0,0]=3 4413 B12R2.116 NC1(c2ccccc2)CNC1 Amb24120649 [0,1,0,0,0,1|1,0,0]=3 4414 B12R2.116 NC1(c2ccccc2)COC1 Amb22386882 [0,1,0,0,0,1|0,0,0]=2 4415 B12R2.116 NC1(c2ccccc2)COC1 Amb33534183 [0,1,0,0,0,1|0,0,0]=2 4416 B12R2.116 NC1(c2ccccn2)CCC1 Amb25891423 [0,1,0,0,0,1|2,0,0]=4 4417 B12R2.116 NC1(c2ccccn2)COC1 Amb25978058 [0,1,0,0,0,1|1,0,0]=3 4418 B12R2.116 NC1(c2cccnc2)CCC1 Amb22498055 [0,1,0,0,0,1|2,0,0]=4 4419 B12R2.116 NC1(c2cccnc2)CCC1 Amb35749840 [0,1,0,0,0,1|2,0,0]=4 4420 B12R2.116 NC1(c2cccnc2)COC1 Amb24716676 [0,1,0,0,0,1|1,0,0]=3 4421 B12R2.116 NC1(c2cccnc2)COC1 Amb30869338 [0,1,0,0,0,1|1,0,0]=3 4422 B12R2.116 NC1(c2ccncc2)CCC1 Amb22500386 [0,1,0,0,0,1|2,0,0]=4 4423 B12R2.116 NC1(c2cncnc2)COC1 Amb28410374 [0,1,0,0,0,1|2,0,0]=4 4424 B12R2.116 OC1(c2ccccc2)CCC1 Amb33544160 [0,1,0,0,0,1|1,0,0]=3 4425 B12R2.116 OC1(c2ccccc2)CNC1 Amb22406135 [0,1,0,0,0,1|1,0,0]=3 4426 B12R2.116 OC1(c2ccccc2)CNC1 Amb22496452 [0,1,0,0,0,1|1,0,0]=3 4427 B12R2.116 OC1(c2ccccc2)CNC1 Amb32758790 [0,1,0,0,0,1|1,0,0]=3 4428 B12R2.116 OC1(c2ccccc2)COC1 Amb21960821 [0,1,0,0,0,1|0,0,0]=2 4429 B12R2.116 OC1(c2ccccc2)CSC1 Amb22386890 [0,1,0,0,0,1|0,1,0]=3 4430 B12R2.116 OC1(c2ccccn2)CNC1 Amb24486814 [0,1,0,0,0,1|2,0,0]=4 4431 B12R2.116 OC1(c2ccccn2)CNC1 Amb33623661 [0,1,0,0,0,1|2,0,0]=4 4432 B12R2.116 OC1(c2cccnc2)CCC1 Amb25123095 [0,1,0,0,0,1|2,0,0]=4 4433 B12R2.116 OC1(c2cccnc2)CCC1 Amb32665519 [0,1,0,0,0,1|2,0,0]=4 4434 B12R2.116 OC1(c2cccnc2)CNC1 Amb27968637 [0,1,0,0,0,1|2,0,0]=4 4435 B12R2.116 OC1(c2cccnc2)CNC1 Amb35747823 [0,1,0,0,0,1|2,0,0]=4 4436 B12R2.116 OC1(c2cccnc2)COC1 Amb22737297 [0,1,0,0,0,1|1,0,0]=3 4437 B12R2.116 OC1(c2cccnc2)CSC1 Amb27784348 [0,1,0,0,0,1|1,1,0]=4 4438 B12R2.116 OC1(c2ccncc2)CNC1 Amb33380637 [0,1,0,0,0,1|2,0,0]=4 4439 B12R2.116 OC1(c2cnccn2)COC1 Amb35659069 [0,1,0,0,0,1|2,0,0]=4 4440 B12R2.116 OC1(c2cncnc2)COC1 Amb35659072 [0,1,0,0,0,1|2,0,0]=4 4441 B12R2.517 Brc1ccccc1C2CCC2 Amb20617096 [0,1,0,0,0,1|1,0,0]=3 4442 B12R2.517 Brc1ccccc1C2CCN2 Amb27871922 [0,1,0,0,0,1|1,0,0]=3 4443 B12R2.517 Brc1ccccc1C2CCO2 Amb32992865 [0,1,0,0,0,1|0,0,0]=2 4444 B12R2.517 Brc1ccccc1C2CNC2 Amb27441459 [0,1,0,0,0,1|1,0,0]=3 4445 B12R2.517 Brc1ccccc1C2CNC2 Amb27614578 [0,1,0,0,0,1|1,0,0]=3 4446 B12R2.517 Brc1ccccc1C2COC2 Amb28348738 [0,1,0,0,0,1|0,0,0]=2 4447 B12R2.517 Brc1cccnc1C2CCN2 Amb25890769 [0,1,0,0,0,1|2,0,0]=4 4448 B12R2.517 Brc1cccnc1C2CNC2 Amb25971531 [0,1,0,0,0,1|2,0,0]=4 4449 B12R2.517 Brc1ccncc1C2CCC2 Amb20617516 [0,1,0,0,0,1|2,0,0]=4 4450 B12R2.517 Brc1ccncc1C2CCN2 Amb27393487 [0,1,0,0,0,1|2,0,0]=4 4451 B12R2.517 Brc1cnccc1C2CCN2 Amb25103778 [0,1,0,0,0,1|2,0,0]=4 4452 B12R2.517 Brc1cnccc1C2CCO2 Amb25891761 [0,1,0,0,0,1|1,0,0]=3 4453 B12R2.517 Brc1cnccc1C2CNC2 Amb25923131 [0,1,0,0,0,1|2,0,0]=4 4454 B12R2.517 Brc1cnccc1[C@@H]2CCN2 Amb27605977 [0,1,0,0,0,1|2,0,0]=4 4455 B12R2.517 Brc1ncccc1C2CCC2 Amb24319276 [0,1,0,0,0,1|2,0,0]=4 4456 B12R2.517 Brc1ncccc1C2CCN2 Amb24663934 [0,1,0,0,0,1|2,0,0]=4 4457 B12R2.517 Brc1ncccc1C2CNC2 Amb25952152 [0,1,0,0,0,1|2,0,0]=4 4458 B12R2.517 Cc1ccccc1C2CCN2 Amb26505394 [0,1,0,0,0,1|1,0,0]=3 4459 B12R2.517 Cc1ccccc1C2CNC2 Amb18065237 [0,1,0,0,0,1|1,0,0]=3 4460 B12R2.517 Cc1ccccc1C2COC2 Amb28070666 [0,1,0,0,0,1|0,0,0]=2 4461 B12R2.517 Cc1cccnc1C2CCN2 Amb24715730 [0,1,0,0,0,1|2,0,0]=4 4462 B12R2.517 Cc1cccnc1C2CNC2 Amb27841823 [0,1,0,0,0,1|2,0,0]=4 4463 B12R2.517 Cc1cccnc1[C@H]2CCN2 Amb27473271 [0,1,0,0,0,1|2,0,0]=4 4464 B12R2.517 Cc1ccncc1C2CCN2 Amb24597648 [0,1,0,0,0,1|2,0,0]=4 4465 B12R2.517 Cc1ccncc1C2CNC2 Amb25807999 [0,1,0,0,0,1|2,0,0]=4 4466 B12R2.517 Cc1ccncc1[C@@H]2CCN2 Amb27202731 [0,1,0,0,0,1|2,0,0]=4 4467 B12R2.517 Cc1ccncc1[C@H]2CCN2 Amb27759925 [0,1,0,0,0,1|2,0,0]=4 4468 B12R2.517 Cc1cnccc1C2CCN2 Amb28289806 [0,1,0,0,0,1|2,0,0]=4 4469 B12R2.517 Cc1cnccc1C2CNC2 Amb27149393 [0,1,0,0,0,1|2,0,0]=4 4470 B12R2.517 Cc1cnccc1[C@@H]2CCN2 Amb28423437 [0,1,0,0,0,1|2,0,0]=4 4471 B12R2.517 Cc1ncccc1C2CCN2 Amb27168693 [0,1,0,0,0,1|2,0,0]=4 4472 B12R2.517 Cc1ncccc1C2CNC2 Amb26638984 [0,1,0,0,0,1|2,0,0]=4 4473 B12R2.517 Cc1ncccc1[C@H]2CCN2 Amb28285338 [0,1,0,0,0,1|2,0,0]=4 4474 B12R2.517 Clc1ccccc1C2CCN2 Amb23555564 [0,1,0,0,0,1|1,0,0]=3 4475 B12R2.517 Clc1ccccc1C2CNC2 Amb18563825 [0,1,0,0,0,1|1,0,0]=3 4476 B12R2.517 Clc1ccccc1C2CNC2 Amb30588621 [0,1,0,0,0,1|1,0,0]=3 4477 B12R2.517 Clc1ccccc1[C@H]2CCN2 Amb27975768 [0,1,0,0,0,1|1,0,0]=3 4478 B12R2.517 Clc1cccnc1C2CCC2 Amb24082820 [0,1,0,0,0,1|2,0,0]=4 4479 B12R2.517 Clc1cccnc1C2CCN2 Amb28456491 [0,1,0,0,0,1|2,0,0]=4 4480 B12R2.517 Clc1cccnc1[C@H]2CCN2 Amb27655620 [0,1,0,0,0,1|2,0,0]=4 4481 B12R2.517 Clc1ccncc1C2CNC2 Amb28254469 [0,1,0,0,0,1|2,0,0]=4 4482 B12R2.517 Clc1cnccc1C2CCN2 Amb28197720 [0,1,0,0,0,1|2,0,0]=4 4483 B12R2.517 Clc1cnccc1C2CNC2 Amb27251523 [0,1,0,0,0,1|2,0,0]=4 4484 B12R2.517 Clc1ncccc1C2CCC2 Amb24319277 [0,1,0,0,0,1|2,0,0]=4 4485 B12R2.517 Clc1ncccc1C2CCN2 Amb25118003 [0,1,0,0,0,1|2,0,0]=4 4486 B12R2.517 Clc1ncccc1C2CNC2 Amb26573624 [0,1,0,0,0,1|2,0,0]=4 4487 B12R2.517 Clc1ncccc1[C@@H]2CCN2 Amb27975682 [0,1,0,0,0,1|2,0,0]=4 4488 B12R2.517 Fc1ccccc1C2CCN2 Amb20623300 [0,1,0,0,0,1|1,0,0]=3 4489 B12R2.517 Fc1ccccc1C2CCN2 Amb22059455 [0,1,0,0,0,1|1,0,0]=3 4490 B12R2.517 Fc1ccccc1C2CNC2 Amb18065350 [0,1,0,0,0,1|1,0,0]=3 4491 B12R2.517 Fc1ccccc1C2CNC2 Amb32661026 [0,1,0,0,0,1|1,0,0]=3 4492 B12R2.517 Fc1ccccc1C2CNC2 Amb33552598 [0,1,0,0,0,1|1,0,0]=3 4493 B12R2.517 Fc1ccccc1[C@H]2CCN2 Amb28072859 [0,1,0,0,0,1|1,0,0]=3 4494 B12R2.517 Fc1cccnc1C2CCN2 Amb25151355 [0,1,0,0,0,1|2,0,0]=4 4495 B12R2.517 Fc1cccnc1C2CNC2 Amb27165264 [0,1,0,0,0,1|2,0,0]=4 4496 B12R2.517 Fc1cccnc1[C@@H]2CCN2 Amb27630652 [0,1,0,0,0,1|2,0,0]=4 4497 B12R2.517 Fc1cnccc1C2CCN2 Amb26918101 [0,1,0,0,0,1|2,0,0]=4 4498 B12R2.517 Fc1cnccc1C2CNC2 Amb27949148 [0,1,0,0,0,1|2,0,0]=4 4499 B12R2.517 Fc1ncccc1C2CCN2 Amb25694371 [0,1,0,0,0,1|2,0,0]=4 4500 B12R2.517 Fc1ncccc1C2CNC2 Amb26357254 [0,1,0,0,0,1|2,0,0]=4 4501 B12R2.517 Fc1ncccc1[C@@H]2CCN2 Amb27873994 [0,1,0,0,0,1|2,0,0]=4 4502 B12R2.517 Ic1ccccc1C2CCN2 Amb25047375 [0,1,0,0,0,1|1,0,0]=3 4503 B12R2.517 Ic1ccccc1C2COC2 Amb25871542 [0,1,0,0,0,1|0,0,0]=2 4504 B12R2.517 Nc1ccccc1C2CCC2 Amb20617097 [0,1,0,0,0,1|1,0,0]=3 4505 B12R2.517 Nc1ccccc1C2CCC2 Amb31156619 [0,1,0,0,0,1|1,0,0]=3 4506 B12R2.517 Nc1ccccc1C2CCN2 Amb24484457 [0,1,0,0,0,1|1,0,0]=3 4507 B12R2.517 Nc1cccnc1C2CCC2 Amb22737142 [0,1,0,0,0,1|2,0,0]=4 4508 B12R2.517 Nc1ccncc1C2CCN2 Amb27222281 [0,1,0,0,0,1|2,0,0]=4 4509 B12R2.517 Nc1ccncc1[C@H]2CCN2 Amb27249538 [0,1,0,0,0,1|2,0,0]=4 4510 B12R2.517 Nc1ncccc1C2CCC2 Amb24319278 [0,1,0,0,0,1|2,0,0]=4 4511 B12R2.517 Nc1ncccc1C2CCN2 Amb27222346 [0,1,0,0,0,1|2,0,0]=4 4512 B12R2.517 Nc1ncccc1C2CNC2 Amb28188909 [0,1,0,0,0,1|2,0,0]=4 4513 B12R2.517 Nc1ncccc1[C@@H]2CCN2 Amb27985267 [0,1,0,0,0,1|2,0,0]=4 4514 B12R2.517 O=C1C=CC=CN1C2CNC2 Amb31031268 [0,1,0,0,0,1|2,0,0]=4 4515 B12R2.517 Oc1ccccc1C2CCC2 Amb20617098 [0,1,0,0,0,1|1,0,0]=3 4516 B12R2.517 Oc1ccccc1C2CCN2 Amb24715881 [0,1,0,0,0,1|1,0,0]=3 4517 B12R2.517 Oc1ccccc1C2CCO2 Amb32641912 [0,1,0,0,0,1|0,0,0]=2 4518 B12R2.517 Oc1ccccc1C2CNC2 Amb22228635 [0,1,0,0,0,1|1,0,0]=3 4519 B12R2.517 Oc1ccccc1C2COC2 Amb22737352 [0,1,0,0,0,1|0,0,0]=2 4520 B12R2.517 Oc1cccnc1[C@@H]2CCN2 Amb28046893 [0,1,0,0,0,1|2,0,0]=4 4521 B12R2.517 Sc1ccccc1C2CCN2 Amb27948429 [0,1,0,0,0,1|1,0,0]=3 4522 B12R2.517 Sc1ccccc1C2CNC2 Amb27862428 [0,1,0,0,0,1|1,0,0]=3 4523 B12R2.517 Sc1ncccc1C2CNC2 Amb27393847 [0,1,0,0,0,1|2,0,0]=4 4524 B12R2.2302 Brc1ccc(C2CCC2)cc1 Amb20617091 [0,1,0,0,0,1|1,0,0]=3 4525 B12R2.2302 Brc1ccc(C2CCC2)cn1 Amb10600539 [0,1,0,0,0,1|2,0,0]=4 4526 B12R2.2302 Brc1ccc(C2CCC2)nc1 Amb10600813 [0,1,0,0,0,1|2,0,0]=4 4527 B12R2.2302 Brc1ccc(C2CCN2)cc1 Amb27867157 [0,1,0,0,0,1|1,0,0]=3 4528 B12R2.2302 Brc1ccc(C2CCN2)cc1 Amb30666626 [0,1,0,0,0,1|1,0,0]=3 4529 B12R2.2302 Brc1ccc(C2CCN2)cn1 Amb28068383 [0,1,0,0,0,1|2,0,0]=4 4530 B12R2.2302 Brc1ccc(C2CCN2)nc1 Amb25281396 [0,1,0,0,0,1|2,0,0]=4 4531 B12R2.2302 Brc1ccc(C2CCO2)cc1 Amb24414336 [0,1,0,0,0,1|0,0,0]=2 4532 B12R2.2302 Brc1ccc(C2CNC2)cc1 Amb18066312 [0,1,0,0,0,1|1,0,0]=3 4533 B12R2.2302 Brc1ccc(C2CNC2)cc1 Amb31291612 [0,1,0,0,0,1|1,0,0]=3 4534 B12R2.2302 Brc1ccc(C2CNC2)cn1 Amb25290385 [0,1,0,0,0,1|2,0,0]=4 4535 B12R2.2302 Brc1ccc(C2CNC2)nc1 Amb25076137 [0,1,0,0,0,1|2,0,0]=4 4536 B12R2.2302 Brc1ccc(C2CNC2)nc1 Amb33172852 [0,1,0,0,0,1|2,0,0]=4 4537 B12R2.2302 Brc1ccc(C2COC2)cc1 Amb22737350 [0,1,0,0,0,1|0,0,0]=2 4538 B12R2.2302 Brc1ccc(C2COC2)nc1 Amb26932331 [0,1,0,0,0,1|1,0,0]=3 4539 B12R2.2302 Brc1ccc(N2CCC2)cc1 Amb27257916 [0,1,0,0,0,1|2,0,0]=4 4540 B12R2.2302 Brc1ccc([C@@H]2CCN2)nc1 Amb27971486 [0,1,0,0,0,1|2,0,0]=4 4541 B12R2.2302 Cc1ccc(C2CCN2)cc1 Amb28136157 [0,1,0,0,0,1|1,0,0]=3 4542 B12R2.2302 Cc1ccc(C2CCN2)cn1 Amb26887232 [0,1,0,0,0,1|2,0,0]=4 4543 B12R2.2302 Cc1ccc(C2CCN2)nc1 Amb26539818 [0,1,0,0,0,1|2,0,0]=4 4544 B12R2.2302 Cc1ccc(C2CNC2)cc1 Amb18065276 [0,1,0,0,0,1|1,0,0]=3 4545 B12R2.2302 Cc1ccc(C2CNC2)cn1 Amb26398986 [0,1,0,0,0,1|2,0,0]=4 4546 B12R2.2302 Cc1ccc(C2CNC2)nc1 Amb24727950 [0,1,0,0,0,1|2,0,0]=4 4547 B12R2.2302 Cc1ccc([C@H]2CCN2)cc1 Amb28189081 [0,1,0,0,0,1|1,0,0]=3 4548 B12R2.2302 Cc1ccc([C@H]2CCN2)cn1 Amb27617390 [0,1,0,0,0,1|2,0,0]=4 4549 B12R2.2302 Clc1ccc(C2CCN2)cc1 Amb19370175 [0,1,0,0,0,1|1,0,0]=3 4550 B12R2.2302 Clc1ccc(C2CCN2)cc1 Amb22059427 [0,1,0,0,0,1|1,0,0]=3 4551 B12R2.2302 Clc1ccc(C2CCN2)cn1 Amb28134608 [0,1,0,0,0,1|2,0,0]=4 4552 B12R2.2302 Clc1ccc(C2CCN2)nc1 Amb26887402 [0,1,0,0,0,1|2,0,0]=4 4553 B12R2.2302 Clc1ccc(C2CCO2)cc1 Amb24369540 [0,1,0,0,0,1|0,0,0]=2 4554 B12R2.2302 Clc1ccc(C2CNC2)cc1 Amb18563827 [0,1,0,0,0,1|1,0,0]=3 4555 B12R2.2302 Clc1ccc(C2CNC2)cc1 Amb30647365 [0,1,0,0,0,1|1,0,0]=3 4556 B12R2.2302 Clc1ccc(C2CNC2)cc1 Amb32662939 [0,1,0,0,0,1|1,0,0]=3 4557 B12R2.2302 Clc1ccc(C2CNC2)nc1 Amb27475631 [0,1,0,0,0,1|2,0,0]=4 4558 B12R2.2302 Clc1ccc(C2CNC2)nc1 Amb31217474 [0,1,0,0,0,1|2,0,0]=4 4559 B12R2.2302 Clc1ccc(C2COC2)cc1 Amb28369672 [0,1,0,0,0,1|0,0,0]=2 4560 B12R2.2302 Clc1ccc(C2COC2)cn1 Amb27665871 [0,1,0,0,0,1|1,0,0]=3 4561 B12R2.2302 Clc1ccc([C@H]2CCN2)nc1 Amb28146718 [0,1,0,0,0,1|2,0,0]=4 4562 B12R2.2302 Fc1ccc(C2=CCO2)cc1 Amb2719092 [0,1,0,0,0,1|0,0,1]=3 4563 B12R2.2302 Fc1ccc(C2CCN2)cc1 Amb9753209 [0,1,0,0,0,1|1,0,0]=3 4564 B12R2.2302 Fc1ccc(C2CCN2)cn1 Amb25721330 [0,1,0,0,0,1|2,0,0]=4 4565 B12R2.2302 Fc1ccc(C2CCN2)nc1 Amb27596082 [0,1,0,0,0,1|2,0,0]=4 4566 B12R2.2302 Fc1ccc(C2CNC2)cc1 Amb18065351 [0,1,0,0,0,1|1,0,0]=3 4567 B12R2.2302 Fc1ccc(C2CNC2)cc1 Amb20669054 [0,1,0,0,0,1|1,0,0]=3 4568 B12R2.2302 Fc1ccc(C2CNC2)cn1 Amb25873817 [0,1,0,0,0,1|2,0,0]=4 4569 B12R2.2302 Fc1ccc(C2CNC2)cn1 Amb33743940 [0,1,0,0,0,1|2,0,0]=4 4570 B12R2.2302 Fc1ccc(C2CNC2)nc1 Amb22236354 [0,1,0,0,0,1|2,0,0]=4 4571 B12R2.2302 Fc1ccc(C2CNC2)nc1 Amb25151188 [0,1,0,0,0,1|2,0,0]=4 4572 B12R2.2302 Fc1ccc(C2COC2)cc1 Amb22738672 [0,1,0,0,0,1|0,0,0]=2 4573 B12R2.2302 Fc1ccc([C@@H]2CCN2)cc1 Amb27788317 [0,1,0,0,0,1|1,0,0]=3 4574 B12R2.2302 Ic1ccc(C2CCC2)cc1 Amb35718448 [0,1,0,0,0,1|1,0,0]=3 4575 B12R2.2302 Ic1ccc(C2CCN2)cc1 Amb27795449 [0,1,0,0,0,1|1,0,0]=3 4576 B12R2.2302 Ic1ccc(C2CCN2)nc1 Amb27790808 [0,1,0,0,0,1|2,0,0]=4 4577 B12R2.2302 Nc1ccc(C2CCC2)cc1 Amb33527984 [0,1,0,0,0,1|1,0,0]=3 4578 B12R2.2302 Nc1ccc(C2CCC2)cc1 Amb34932708 [0,1,0,0,0,1|1,0,0]=3 4579 B12R2.2302 Nc1ccc(C2CCC2)cn1 Amb10600540 [0,1,0,0,0,1|2,0,0]=4 4580 B12R2.2302 Nc1ccc(C2CCC2)nc1 Amb10600814 [0,1,0,0,0,1|2,0,0]=4 4581 B12R2.2302 Nc1ccc(C2CCN2)cc1 Amb25843764 [0,1,0,0,0,1|1,0,0]=3 4582 B12R2.2302 Nc1ccc(C2CCO2)cc1 Amb25705796 [0,1,0,0,0,1|0,0,0]=2 4583 B12R2.2302 Nc1ccc(C2COC2)cc1 Amb22388448 [0,1,0,0,0,1|0,0,0]=2 4584 B12R2.2302 Nc1ccc(N2CCC2)cc1 Amb33543789 [0,1,0,0,0,1|2,0,0]=4 4585 B12R2.2302 Nc1ccc([C@H]2CCN2)nc1 Amb28076089 [0,1,0,0,0,1|2,0,0]=4 4586 B12R2.2302 O=C1C=CC(C2CNC2)=CN1 Amb27214016 [0,1,0,0,0,1|2,0,0]=4 4587 B12R2.2302 Oc1ccc(C2CCC2)cc1 Amb20617093 [0,1,0,0,0,1|1,0,0]=3 4588 B12R2.2302 Oc1ccc(C2CCC2)cn1 Amb10600541 [0,1,0,0,0,1|2,0,0]=4 4589 B12R2.2302 Oc1ccc(C2CCC2)nc1 Amb10600815 [0,1,0,0,0,1|2,0,0]=4 4590 B12R2.2302 Oc1ccc(C2CCN2)cc1 Amb24533045 [0,1,0,0,0,1|1,0,0]=3 4591 B12R2.2302 Oc1ccc(C2CCO2)cc1 Amb33231206 [0,1,0,0,0,1|0,0,0]=2 4592 B12R2.2302 Oc1ccc(C2CNC2)cc1 Amb27398822 [0,1,0,0,0,1|1,0,0]=3 4593 B12R2.2302 Oc1ccc(C2CNC2)nc1 Amb25891432 [0,1,0,0,0,1|2,0,0]=4 4594 B12R2.2302 Oc1ccc(C2COC2)cc1 Amb26373253 [0,1,0,0,0,1|0,0,0]=2 4595 B12R2.2302 Oc1ccc([C@@H]2CCN2)cc1 Amb28318514 [0,1,0,0,0,1|1,0,0]=3 4596 B12R2.2302 Oc1ccc([C@H]2CCN2)nc1 Amb27413014 [0,1,0,0,0,1|2,0,0]=4 4597 B12R2.2302 Sc1ccc([C@H]2CCN2)cc1 Amb27597984 [0,1,0,0,0,1|1,0,0]=3 4598 B12R2.2313 Brc1cc(C2CCC2)ccn1 Amb10599981 [0,1,0,0,0,1|2,0,0]=4 4599 B12R2.2313 Brc1cc(C2CCN2)ccn1 Amb27167515 [0,1,0,0,0,1|2,0,0]=4 4600 B12R2.2313 Brc1cc(C2CNC2)ccn1 Amb27407350 [0,1,0,0,0,1|2,0,0]=4 4601 B12R2.2313 Brc1cccc(C2CCC2)c1 Amb20617094 [0,1,0,0,0,1|1,0,0]=3 4602 B12R2.2313 Brc1cccc(C2CCC2)n1 Amb10599978 [0,1,0,0,0,1|2,0,0]=4 4603 B12R2.2313 Brc1cccc(C2CCN2)c1 Amb26655898 [0,1,0,0,0,1|1,0,0]=3 4604 B12R2.2313 Brc1cccc(C2CCN2)c1 Amb32718720 [0,1,0,0,0,1|1,0,0]=3 4605 B12R2.2313 Brc1cccc(C2CCN2)n1 Amb26631642 [0,1,0,0,0,1|2,0,0]=4 4606 B12R2.2313 Brc1cccc(C2CCO2)c1 Amb32641928 [0,1,0,0,0,1|0,0,0]=2 4607 B12R2.2313 Brc1cccc(C2CNC2)c1 Amb18066357 [0,1,0,0,0,1|1,0,0]=3 4608 B12R2.2313 Brc1cccc(C2CNC2)c1 Amb30588622 [0,1,0,0,0,1|1,0,0]=3 4609 B12R2.2313 Brc1cccc(C2CNC2)n1 Amb27870674 [0,1,0,0,0,1|2,0,0]=4 4610 B12R2.2313 Brc1cccc(C2COC2)c1 Amb22737351 [0,1,0,0,0,1|0,0,0]=2 4611 B12R2.2313 Brc1cccc(N2CCC2)c1 Amb28068951 [0,1,0,0,0,1|2,0,0]=4 4612 B12R2.2313 Brc1ccnc(C2CCC2)c1 Amb10599776 [0,1,0,0,0,1|2,0,0]=4 4613 B12R2.2313 Brc1ccnc(C2CCN2)c1 Amb27400545 [0,1,0,0,0,1|2,0,0]=4 4614 B12R2.2313 Brc1ccnc(C2COC2)c1 Amb24593810 [0,1,0,0,0,1|1,0,0]=3 4615 B12R2.2313 Brc1ccnc([C@H]2CCN2)c1 Amb27592806 [0,1,0,0,0,1|2,0,0]=4 4616 B12R2.2313 Brc1cncc(C2CCC2)c1 Amb20617714 [0,1,0,0,0,1|2,0,0]=4 4617 B12R2.2313 Brc1cncc(C2CCN2)c1 Amb26918266 [0,1,0,0,0,1|2,0,0]=4 4618 B12R2.2313 Brc1cncc(C2CCO2)c1 Amb28286965 [0,1,0,0,0,1|1,0,0]=3 4619 B12R2.2313 Brc1cncc(C2CNC2)c1 Amb25147879 [0,1,0,0,0,1|2,0,0]=4 4620 B12R2.2313 Brc1cncc(C2COC2)c1 Amb28400785 [0,1,0,0,0,1|1,0,0]=3 4621 B12R2.2313 Cc1cc(C2CCN2)ccn1 Amb25041966 [0,1,0,0,0,1|2,0,0]=4 4622 B12R2.2313 Cc1cc(C2CNC2)ccn1 Amb25756833 [0,1,0,0,0,1|2,0,0]=4 4623 B12R2.2313 Cc1cccc(C2CCN2)c1 Amb26857229 [0,1,0,0,0,1|1,0,0]=3 4624 B12R2.2313 Cc1cccc(C2CCN2)n1 Amb28250845 [0,1,0,0,0,1|2,0,0]=4 4625 B12R2.2313 Cc1cccc(C2CNC2)c1 Amb18065251 [0,1,0,0,0,1|1,0,0]=3 4626 B12R2.2313 Cc1cccc(C2CNC2)n1 Amb27467698 [0,1,0,0,0,1|2,0,0]=4 4627 B12R2.2313 Cc1cccc(C2COC2)c1 Amb28205440 [0,1,0,0,0,1|0,0,0]=2 4628 B12R2.2313 Cc1cccc(N2CSC2)c1 Amb28399348 [0,1,0,0,0,1|1,1,0]=4 4629 B12R2.2313 Cc1cccc([C@H]2CCN2)c1 Amb27391622 [0,1,0,0,0,1|1,0,0]=3 4630 B12R2.2313 Cc1ccnc(C2CCN2)c1 Amb26509203 [0,1,0,0,0,1|2,0,0]=4 4631 B12R2.2313 Cc1ccnc(C2CNC2)c1 Amb27173223 [0,1,0,0,0,1|2,0,0]=4 4632 B12R2.2313 Cc1cncc(C2CCN2)c1 Amb27258757 [0,1,0,0,0,1|2,0,0]=4 4633 B12R2.2313 Cc1cncc(C2CNC2)c1 Amb26317969 [0,1,0,0,0,1|2,0,0]=4 4634 B12R2.2313 Clc1cc(C2CNC2)ccn1 Amb27872404 [0,1,0,0,0,1|2,0,0]=4 4635 B12R2.2313 Clc1cc([C@@H]2CCN2)ccn1 Amb27473256 [0,1,0,0,0,1|2,0,0]=4 4636 B12R2.2313 Clc1cccc(C2CCC2)c1 Amb35718450 [0,1,0,0,0,1|1,0,0]=3 4637 B12R2.2313 Clc1cccc(C2CCN2)c1 Amb27431952 [0,1,0,0,0,1|1,0,0]=3 4638 B12R2.2313 Clc1cccc(C2CCN2)n1 Amb24484519 [0,1,0,0,0,1|2,0,0]=4 4639 B12R2.2313 Clc1cccc(C2CNC2)c1 Amb18563826 [0,1,0,0,0,1|1,0,0]=3 4640 B12R2.2313 Clc1cccc(C2CNC2)c1 Amb32662938 [0,1,0,0,0,1|1,0,0]=3 4641 B12R2.2313 Clc1cccc(C2CNC2)n1 Amb26546974 [0,1,0,0,0,1|2,0,0]=4 4642 B12R2.2313 Clc1cccc(C2COC2)c1 Amb24739899 [0,1,0,0,0,1|0,0,0]=2 4643 B12R2.2313 Clc1cccc([C@H]2CCN2)c1 Amb27655566 [0,1,0,0,0,1|1,0,0]=3 4644 B12R2.2313 Clc1ccnc(C2CCN2)c1 Amb27251979 [0,1,0,0,0,1|2,0,0]=4 4645 B12R2.2313 Clc1ccnc(C2CNC2)c1 Amb27661775 [0,1,0,0,0,1|2,0,0]=4 4646 B12R2.2313 Clc1cncc(C2CCN2)c1 Amb28457269 [0,1,0,0,0,1|2,0,0]=4 4647 B12R2.2313 Fc1cccc(C2CCC2)n1 Amb24319187 [0,1,0,0,0,1|2,0,0]=4 4648 B12R2.2313 Fc1cccc(C2CCN2)c1 Amb19375411 [0,1,0,0,0,1|1,0,0]=3 4649 B12R2.2313 Fc1cccc(C2CCN2)c1 Amb25273667 [0,1,0,0,0,1|1,0,0]=3 4650 B12R2.2313 Fc1cccc(C2CNC2)c1 Amb20669554 [0,1,0,0,0,1|1,0,0]=3 4651 B12R2.2313 Fc1cccc(C2CNC2)c1 Amb22055311 [0,1,0,0,0,1|1,0,0]=3 4652 B12R2.2313 Fc1cccc(C2CNC2)n1 Amb22236355 [0,1,0,0,0,1|2,0,0]=4 4653 B12R2.2313 Fc1cccc([C@H]2CCN2)c1 Amb27815082 [0,1,0,0,0,1|1,0,0]=3 4654 B12R2.2313 Fc1ccnc(C2CCC2)c1 Amb24319239 [0,1,0,0,0,1|2,0,0]=4 4655 B12R2.2313 Fc1ccnc(C2CCN2)c1 Amb33414565 [0,1,0,0,0,1|2,0,0]=4 4656 B12R2.2313 Fc1ccnc(C2CNC2)c1 Amb33414524 [0,1,0,0,0,1|2,0,0]=4 4657 B12R2.2313 Fc1cncc(C2CCN2)c1 Amb26413877 [0,1,0,0,0,1|2,0,0]=4 4658 B12R2.2313 Fc1cncc(C2CNC2)c1 Amb27148455 [0,1,0,0,0,1|2,0,0]=4 4659 B12R2.2313 Ic1cccc(C2CCC2)c1 Amb35718451 [0,1,0,0,0,1|1,0,0]=3 4660 B12R2.2313 Ic1cccc(C2CNC2)n1 Amb27462098 [0,1,0,0,0,1|2,0,0]=4 4661 B12R2.2313 Nc1cc(C2CCC2)ccn1 Amb10599982 [0,1,0,0,0,1|2,0,0]=4 4662 B12R2.2313 Nc1cc(C2CNC2)ccn1 Amb27483014 [0,1,0,0,0,1|2,0,0]=4 4663 B12R2.2313 Nc1cc(C2COC2)ccn1 Amb25315317 [0,1,0,0,0,1|1,0,0]=3 4664 B12R2.2313 Nc1cccc(C2CCC2)c1 Amb20617095 [0,1,0,0,0,1|1,0,0]=3 4665 B12R2.2313 Nc1cccc(C2CCC2)n1 Amb10599979 [0,1,0,0,0,1|2,0,0]=4 4666 B12R2.2313 Nc1cccc(C2CCN2)c1 Amb25980808 [0,1,0,0,0,1|1,0,0]=3 4667 B12R2.2313 Nc1cccc(C2CNC2)c1 Amb25292216 [0,1,0,0,0,1|1,0,0]=3 4668 B12R2.2313 Nc1cccc(C2CNC2)n1 Amb27954707 [0,1,0,0,0,1|2,0,0]=4 4669 B12R2.2313 Nc1cccc(C2COC2)c1 Amb27481244 [0,1,0,0,0,1|0,0,0]=2 4670 B12R2.2313 Nc1cccc(N2CCC2)c1 Amb27402439 [0,1,0,0,0,1|2,0,0]=4 4671 B12R2.2313 Nc1ccnc(C2CCC2)c1 Amb10599777 [0,1,0,0,0,1|2,0,0]=4 4672 B12R2.2313 Nc1ccnc(C2CNC2)c1 Amb27390807 [0,1,0,0,0,1|2,0,0]=4 4673 B12R2.2313 Nc1cncc(C2CCC2)c1 Amb20617715 [0,1,0,0,0,1|2,0,0]=4 4674 B12R2.2313 Nc1cncc(C2CNC2)c1 Amb27963651 [0,1,0,0,0,1|2,0,0]=4 4675 B12R2.2313 Oc1cc(C2CCC2)ccn1 Amb10599983 [0,1,0,0,0,1|2,0,0]=4 4676 B12R2.2313 Oc1cc(C2CNC2)ccn1 Amb25916489 [0,1,0,0,0,1|2,0,0]=4 4677 B12R2.2313 Oc1cccc(C2CCC2)c1 Amb20617090 [0,1,0,0,0,1|1,0,0]=3 4678 B12R2.2313 Oc1cccc(C2CCC2)n1 Amb10599980 [0,1,0,0,0,1|2,0,0]=4 4679 B12R2.2313 Oc1cccc(C2CCN2)c1 Amb24085164 [0,1,0,0,0,1|1,0,0]=3 4680 B12R2.2313 Oc1cccc(C2CCN2)n1 Amb27404524 [0,1,0,0,0,1|2,0,0]=4 4681 B12R2.2313 Oc1cccc(C2CCO2)c1 Amb32641927 [0,1,0,0,0,1|0,0,0]=2 4682 B12R2.2313 Oc1cccc(C2CNC2)c1 Amb26647787 [0,1,0,0,0,1|1,0,0]=3 4683 B12R2.2313 Oc1cccc(C2COC2)c1 Amb27946997 [0,1,0,0,0,1|0,0,0]=2 4684 B12R2.2313 Oc1cccc([C@H]2CCN2)c1 Amb27593889 [0,1,0,0,0,1|1,0,0]=3 4685 B12R2.2313 Oc1cccc([C@H]2CCN2)n1 Amb27607167 [0,1,0,0,0,1|2,0,0]=4 4686 B12R2.2313 Oc1ccnc(C2CCC2)c1 Amb10599778 [0,1,0,0,0,1|2,0,0]=4 4687 B12R2.2313 Oc1cncc(C2CCC2)c1 Amb20617716 [0,1,0,0,0,1|2,0,0]=4 4688 B12R2.2313 Oc1cncc(C2CNC2)c1 Amb27765505 [0,1,0,0,0,1|2,0,0]=4 4689 B12R2.2313 Sc1cccc([C@H]2CCN2)c1 Amb27453457 [0,1,0,0,0,1|1,0,0]=3 4690 B12R2.27 BrCC1CC1c2ccccc2 Amb25099525 [0,2,0,0,0,0|1,0,0]=3 4691 B12R2.27 BrC[C@@H]1C[C@H]1c2ccccc2 Amb26055377 [0,2,0,0,0,0|1,0,0]=3 4692 B12R2.27 BrC[C@@H]1O[C@H]1c2ccccc2 Amb28249045 [0,2,0,0,0,0|0,0,0]=2 4693 B12R2.27 C#CC1OC1c2ccccc2 Amb28254723 [0,2,0,0,0,0|0,0,0]=2 4694 B12R2.27 C=CC1CC1c2ccccc2 Amb26889126 [0,2,0,0,0,0|1,0,0]=3 4695 B12R2.27 CC[C@@H]1O[C@H]1c2ccccc2 Amb27768002 [0,2,0,0,0,0|0,0,0]=2 4696 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [0,2,0,0,0,0|1,0,0]=3 4697 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [0,2,0,0,0,0|1,0,0]=3 4698 B12R2.27 CN[C@@H]1C[C@H]1c2ccccc2 Amb28056101 [0,2,0,0,0,0|1,0,0]=3 4699 B12R2.27 CN[C@@H]1C[C@H]1c2ccccc2 Amb33309625 [0,2,0,0,0,0|1,0,0]=3 4700 B12R2.27 ClC[C@@H]1O[C@@H]1c2ccccc2 Amb28457544 [0,2,0,0,0,0|0,0,0]=2 4701 B12R2.27 N#CC1CC1c2ccccc2 Amb17231961 [0,2,0,0,0,0|1,0,0]=3 4702 B12R2.27 N#CC1OC1c2ccccn2 Amb27176378 [0,2,0,0,0,0|1,0,0]=3 4703 B12R2.27 N#C[C@@H]1C[C@H]1c2ccccc2 Amb25309014 [0,2,0,0,0,0|1,0,0]=3 4704 B12R2.27 N#C[C@H]1C[C@@H]1c2ccccc2 Amb27613258 [0,2,0,0,0,0|1,0,0]=3 4705 B12R2.27 N#C[C@H]1O[C@H]1c2ccccn2 Amb26074205 [0,2,0,0,0,0|1,0,0]=3 4706 B12R2.27 NCC1CC1c2ccccc2 Amb17232030 [0,2,0,0,0,0|1,0,0]=3 4707 B12R2.27 NCC1CC1c2ccccc2 Amb19515036 [0,2,0,0,0,0|1,0,0]=3 4708 B12R2.27 NCC1CC1c2ccccn2 Amb18963618 [0,2,0,0,0,0|2,0,0]=4 4709 B12R2.27 NCC1CC1c2cccnc2 Amb17232044 [0,2,0,0,0,0|2,0,0]=4 4710 B12R2.27 NCC1CC1c2cccnc2 Amb33172856 [0,2,0,0,0,0|2,0,0]=4 4711 B12R2.27 NCC1CC1c2ccncc2 Amb18963616 [0,2,0,0,0,0|2,0,0]=4 4712 B12R2.27 NCC1OC1c2ccccc2 Amb25836323 [0,2,0,0,0,0|0,0,0]=2 4713 B12R2.27 NC[C@@H]1C[C@@H]1c2ccccc2 Amb34916191 [0,2,0,0,0,0|1,0,0]=3 4714 B12R2.27 NC[C@@H]1C[C@@H]1c2cccnc2 Amb34915991 [0,2,0,0,0,0|2,0,0]=4 4715 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb24514797 [0,2,0,0,0,0|1,0,0]=3 4716 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb32661485 [0,2,0,0,0,0|1,0,0]=3 4717 B12R2.27 NC[C@@H]1C[C@H]1c2ccccn2 Amb26887881 [0,2,0,0,0,0|2,0,0]=4 4718 B12R2.27 NC[C@@H]1C[C@H]1c2cccnc2 Amb25168891 [0,2,0,0,0,0|2,0,0]=4 4719 B12R2.27 NC[C@@H]1C[C@H]1c2cccnc2 Amb33172877 [0,2,0,0,0,0|2,0,0]=4 4720 B12R2.27 NC[C@@H]1C[C@H]1c2ccncc2 Amb25271512 [0,2,0,0,0,0|2,0,0]=4 4721 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb24606663 [0,2,0,0,0,0|1,0,0]=3 4722 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb32664390 [0,2,0,0,0,0|1,0,0]=3 4723 B12R2.27 NC[C@H]1C[C@@H]1c2ccncc2 Amb27440247 [0,2,0,0,0,0|2,0,0]=4 4724 B12R2.27 NC[C@H]1C[C@H]1c2ccccc2 Amb34916190 [0,2,0,0,0,0|1,0,0]=3 4725 B12R2.27 NC[C@H]1O[C@@H]1c2ccccc2 Amb27188182 [0,2,0,0,0,0|0,0,0]=2 4726 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,2,0,0,0,0|1,0,0]=3 4727 B12R2.27 O=CC1CC1c2cccnc2 Amb27872437 [0,2,0,0,0,0|2,0,0]=4 4728 B12R2.27 O=CC1CC1c2ccncc2 Amb6572446 [0,2,0,0,0,0|2,0,0]=4 4729 B12R2.27 O=CC1N=C1c2ccccc2 Amb16233228 [0,2,0,0,0,0|1,0,1]=4 4730 B12R2.27 O=C[C@@H]1C[C@@H]1c2ccccc2 Amb26433208 [0,2,0,0,0,0|1,0,0]=3 4731 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,2,0,0,0,0|1,0,0]=3 4732 B12R2.27 O=C[C@@H]1O[C@H]1c2ccccc2 Amb26550113 [0,2,0,0,0,0|0,0,0]=2 4733 B12R2.27 O=C[C@H]1C[C@@H]1c2ccccc2 Amb27421992 [0,2,0,0,0,0|1,0,0]=3 4734 B12R2.27 O=C[C@H]1C[C@H]1c2ccccc2 Amb26548788 [0,2,0,0,0,0|1,0,0]=3 4735 B12R2.27 O=C[C@H]1O[C@@H]1c2ccccc2 Amb28195860 [0,2,0,0,0,0|0,0,0]=2 4736 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [0,2,0,0,0,0|1,0,0]=3 4737 B12R2.27 OCC1CC1c2ccccn2 Amb23536863 [0,2,0,0,0,0|2,0,0]=4 4738 B12R2.27 OCC1CC1c2ccncc2 Amb23536862 [0,2,0,0,0,0|2,0,0]=4 4739 B12R2.27 OCC1C[C@@H]1c2ccccc2 Amb28182630 [0,2,0,0,0,0|1,0,0]=3 4740 B12R2.27 OCC1C[C@H]1c2ccccc2 Amb28207313 [0,2,0,0,0,0|1,0,0]=3 4741 B12R2.27 OCC1N=C1c2ccccc2 Amb26560371 [0,2,0,0,0,0|1,0,1]=4 4742 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [0,2,0,0,0,0|0,0,0]=2 4743 B12R2.27 OC[C@@H]1C[C@@H]1c2ccccc2 Amb25917153 [0,2,0,0,0,0|1,0,0]=3 4744 B12R2.27 OC[C@@H]1C[C@@H]1c2cccnc2 Amb22744875 [0,2,0,0,0,0|2,0,0]=4 4745 B12R2.27 OC[C@@H]1C[C@@H]1c2ccncc2 Amb27485910 [0,2,0,0,0,0|2,0,0]=4 4746 B12R2.27 OC[C@@H]1C[C@H]1c2ccccc2 Amb28146004 [0,2,0,0,0,0|1,0,0]=3 4747 B12R2.27 OC[C@@H]1C[C@H]1c2ccccn2 Amb27968717 [0,2,0,0,0,0|2,0,0]=4 4748 B12R2.27 OC[C@H]1C[C@@H]1c2ccccc2 Amb3634122 [0,2,0,0,0,0|1,0,0]=3 4749 B12R2.27 OC[C@H]1C[C@@H]1c2ccccn2 Amb27428354 [0,2,0,0,0,0|2,0,0]=4 4750 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [0,2,0,0,0,0|0,0,0]=2 4751 B12R2.27 OC[C@H]1O[C@H]1c2ccccc2 Amb27432251 [0,2,0,0,0,0|0,0,0]=2 4752 B12R2.37 CC1C(=O)C1c2ccccc2 Amb28324419 [0,2,0,0,0,0|1,0,0]=3 4753 B12R2.37 CC1C(N)C1c2ccccc2 Amb26503439 [0,2,0,0,0,0|1,0,0]=3 4754 B12R2.37 CC1C(N)C1c2ccccc2 Amb35751900 [0,2,0,0,0,0|1,0,0]=3 4755 B12R2.37 CC1C(c2ccccc2)N1C Amb29838148 [0,2,0,0,0,0|1,0,0]=3 4756 B12R2.37 NC1C(N)C1c2ccccc2 Amb27791909 [0,2,0,0,0,0|1,0,0]=3 4757 B12R2.79 Brc1ccc(C2CC2Br)nc1 Amb30009460 [0,2,0,0,0,0|2,0,0]=4 4758 B12R2.79 Brc1ccc([C@@H]2C[C@H]2Br)cc1 Amb27190975 [0,2,0,0,0,0|1,0,0]=3 4759 B12R2.79 Brc1ccc([C@@H]2C[C@H]2Br)nc1 Amb29854032 [0,2,0,0,0,0|2,0,0]=4 4760 B12R2.79 CC1CC1c2ccc(F)cc2 Amb24662198 [0,2,0,0,0,0|1,0,0]=3 4761 B12R2.79 CC1OC1c2cc[n+]([O-])cc2 Amb26051395 [0,2,0,0,0,0|1,0,0]=3 4762 B12R2.79 CC1OC1c2ccc(F)cc2 Amb9710424 [0,2,0,0,0,0|0,0,0]=2 4763 B12R2.79 C[C@@H]1C[C@H]1c2ccc(F)cc2 Amb25911997 [0,2,0,0,0,0|1,0,0]=3 4764 B12R2.79 C[C@@H]1O[C@@H]1c2ccc(Br)cc2 Amb26578881 [0,2,0,0,0,0|0,0,0]=2 4765 B12R2.79 C[C@@H]1O[C@@H]1c2ccc(F)cc2 Amb24515103 [0,2,0,0,0,0|0,0,0]=2 4766 B12R2.79 C[C@@H]1O[C@H]1c2ccc(Cl)cc2 Amb33457818 [0,2,0,0,0,0|0,0,0]=2 4767 B12R2.79 C[C@@H]1O[C@H]1c2ccc(F)cc2 Amb32667398 [0,2,0,0,0,0|0,0,0]=2 4768 B12R2.79 C[C@H]1C[C@@H]1c2ccc(O)cc2 Amb27640651 [0,2,0,0,0,0|1,0,0]=3 4769 B12R2.79 Cc1ccc(C2CC2Br)cc1 Amb28118459 [0,2,0,0,0,0|1,0,0]=3 4770 B12R2.79 Cc1ccc(C2CC2N)cc1 Amb32664274 [0,2,0,0,0,0|1,0,0]=3 4771 B12R2.79 Cc1ccc(C2CC2N)cc1 Amb9677209 [0,2,0,0,0,0|1,0,0]=3 4772 B12R2.79 Cc1ccc(C2CC2N)cn1 Amb27841958 [0,2,0,0,0,0|2,0,0]=4 4773 B12R2.79 Cc1ccc(C2CC2N)nc1 Amb26940324 [0,2,0,0,0,0|2,0,0]=4 4774 B12R2.79 Cc1ccc(C2OC2Cl)cc1 Amb27816450 [0,2,0,0,0,0|0,0,0]=2 4775 B12R2.79 Cc1ccc([C@@H]2C[C@@H]2Br)cc1 Amb27439070 [0,2,0,0,0,0|1,0,0]=3 4776 B12R2.79 Cc1ccc([C@@H]2C[C@H]2Br)cc1 Amb26389107 [0,2,0,0,0,0|1,0,0]=3 4777 B12R2.79 Cc1ccc([C@@H]2C[C@H]2N)cc1 Amb24100233 [0,2,0,0,0,0|1,0,0]=3 4778 B12R2.79 Cc1ccc([C@@H]2C[C@H]2N)cc1 Amb28721264 [0,2,0,0,0,0|1,0,0]=3 4779 B12R2.79 Cc1ccc([C@@H]2C[C@H]2N)cn1 Amb32878620 [0,2,0,0,0,0|2,0,0]=4 4780 B12R2.79 Cc1ccc([C@@H]2C[C@H]2N)nc1 Amb33198869 [0,2,0,0,0,0|2,0,0]=4 4781 B12R2.79 Clc1ccc(C2CC2Br)cc1 Amb23454925 [0,2,0,0,0,0|1,0,0]=3 4782 B12R2.79 Clc1ccc(C2CC2Br)nc1 Amb29854093 [0,2,0,0,0,0|2,0,0]=4 4783 B12R2.79 Clc1ccc([C@@H]2C[C@H]2Br)cc1 Amb28363985 [0,2,0,0,0,0|1,0,0]=3 4784 B12R2.79 Clc1ccc([C@@H]2C[C@H]2Br)nc1 Amb29854092 [0,2,0,0,0,0|2,0,0]=4 4785 B12R2.79 Clc1ccc([C@@H]2C[C@H]2Cl)cc1 Amb27231822 [0,2,0,0,0,0|1,0,0]=3 4786 B12R2.79 Fc1ccc(C2CC2Br)cc1 Amb23454928 [0,2,0,0,0,0|1,0,0]=3 4787 B12R2.79 Fc1ccc([C@@H]2C[C@@H]2Br)cc1 Amb27448438 [0,2,0,0,0,0|1,0,0]=3 4788 B12R2.79 Fc1ccc([C@@H]2C[C@@H]2Cl)cc1 Amb27818091 [0,2,0,0,0,0|1,0,0]=3 4789 B12R2.79 Fc1ccc([C@@H]2C[C@H]2Cl)cc1 Amb27788419 [0,2,0,0,0,0|1,0,0]=3 4790 B12R2.79 NC1CC1c2ccc(Br)cc2 Amb19346488 [0,2,0,0,0,0|1,0,0]=3 4791 B12R2.79 NC1CC1c2ccc(Br)cc2 Amb9677215 [0,2,0,0,0,0|1,0,0]=3 4792 B12R2.79 NC1CC1c2ccc(Br)cn2 Amb25933755 [0,2,0,0,0,0|2,0,0]=4 4793 B12R2.79 NC1CC1c2ccc(Br)nc2 Amb33388492 [0,2,0,0,0,0|2,0,0]=4 4794 B12R2.79 NC1CC1c2ccc(Cl)cc2 Amb19373427 [0,2,0,0,0,0|1,0,0]=3 4795 B12R2.79 NC1CC1c2ccc(Cl)cc2 Amb9677201 [0,2,0,0,0,0|1,0,0]=3 4796 B12R2.79 NC1CC1c2ccc(Cl)cn2 Amb33053157 [0,2,0,0,0,0|2,0,0]=4 4797 B12R2.79 NC1CC1c2ccc(Cl)nc2 Amb33262381 [0,2,0,0,0,0|2,0,0]=4 4798 B12R2.79 NC1CC1c2ccc(F)cc2 Amb19514916 [0,2,0,0,0,0|1,0,0]=3 4799 B12R2.79 NC1CC1c2ccc(F)cc2 Amb9677217 [0,2,0,0,0,0|1,0,0]=3 4800 B12R2.79 NC1CC1c2ccc(F)cn2 Amb33172489 [0,2,0,0,0,0|2,0,0]=4 4801 B12R2.79 NC1CC1c2ccc(F)nc2 Amb32954586 [0,2,0,0,0,0|2,0,0]=4 4802 B12R2.79 NC1CC1c2ccc(I)cc2 Amb27954289 [0,2,0,0,0,0|1,0,0]=3 4803 B12R2.79 NC1CC1c2ccc(O)cc2 Amb17568133 [0,2,0,0,0,0|1,0,0]=3 4804 B12R2.79 NC1CC1c2ccc(O)cc2 Amb28465287 [0,2,0,0,0,0|1,0,0]=3 4805 B12R2.79 N[C@@H]1C[C@@H]1c2ccc(Br)cc2 Amb24763920 [0,2,0,0,0,0|1,0,0]=3 4806 B12R2.79 N[C@@H]1C[C@@H]1c2ccc(Cl)cc2 Amb27233381 [0,2,0,0,0,0|1,0,0]=3 4807 B12R2.79 N[C@@H]1C[C@@H]1c2ccc(Cl)cc2 Amb34915312 [0,2,0,0,0,0|1,0,0]=3 4808 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb26432902 [0,2,0,0,0,0|1,0,0]=3 4809 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb33473669 [0,2,0,0,0,0|1,0,0]=3 4810 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Br)cn2 Amb33477141 [0,2,0,0,0,0|2,0,0]=4 4811 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Br)nc2 Amb30869745 [0,2,0,0,0,0|2,0,0]=4 4812 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Br)nc2 Amb33240470 [0,2,0,0,0,0|2,0,0]=4 4813 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24655057 [0,2,0,0,0,0|1,0,0]=3 4814 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb33032248 [0,2,0,0,0,0|1,0,0]=3 4815 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Cl)nc2 Amb33261195 [0,2,0,0,0,0|2,0,0]=4 4816 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24100231 [0,2,0,0,0,0|1,0,0]=3 4817 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)cc2 Amb30628659 [0,2,0,0,0,0|1,0,0]=3 4818 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)cn2 Amb33316215 [0,2,0,0,0,0|2,0,0]=4 4819 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)nc2 Amb33426545 [0,2,0,0,0,0|2,0,0]=4 4820 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)nc2 Amb35751023 [0,2,0,0,0,0|2,0,0]=4 4821 B12R2.79 N[C@@H]1C[C@H]1c2ccc(O)cc2 Amb27630075 [0,2,0,0,0,0|1,0,0]=3 4822 B12R2.79 N[C@H]1C[C@@H]1c2ccc(Br)nc2 Amb33801620 [0,2,0,0,0,0|2,0,0]=4 4823 B12R2.79 N[C@H]1C[C@@H]1c2ccc(F)cc2 Amb25168877 [0,2,0,0,0,0|1,0,0]=3 4824 B12R2.79 N[C@H]1C[C@@H]1c2ccc(O)cc2 Amb33806315 [0,2,0,0,0,0|1,0,0]=3 4825 B12R2.79 N[C@H]1C[C@H]1c2ccc(O)cc2 Amb34915834 [0,2,0,0,0,0|1,0,0]=3 4826 B12R2.79 OC1CC1c2ccc(Cl)cc2 Amb27847198 [0,2,0,0,0,0|1,0,0]=3 4827 B12R2.80 Brc1cncc(C2CC2Br)c1 Amb29854061 [0,2,0,0,0,0|2,0,0]=4 4828 B12R2.80 Brc1cncc([C@@H]2C[C@H]2Br)c1 Amb29854016 [0,2,0,0,0,0|2,0,0]=4 4829 B12R2.80 CC1OC1c2ccc[n+]([O-])c2 Amb27664283 [0,2,0,0,0,0|1,0,0]=3 4830 B12R2.80 CC1OC1c2cccc(Cl)c2 Amb1138203 [0,2,0,0,0,0|0,0,0]=2 4831 B12R2.80 C[C@@H]1C[C@H]1c2cccc(F)c2 Amb27423866 [0,2,0,0,0,0|1,0,0]=3 4832 B12R2.80 C[C@@H]1O[C@H]1c2cccc(Cl)c2 Amb32667301 [0,2,0,0,0,0|0,0,0]=2 4833 B12R2.80 Cc1cc(C2CC2N)ccn1 Amb33475162 [0,2,0,0,0,0|2,0,0]=4 4834 B12R2.80 Cc1cc([C@@H]2C[C@H]2N)ccn1 Amb33268212 [0,2,0,0,0,0|2,0,0]=4 4835 B12R2.80 Cc1cccc(C2CC2N)c1 Amb9677177 [0,2,0,0,0,0|1,0,0]=3 4836 B12R2.80 Cc1cccc(C2CC2N)n1 Amb33079883 [0,2,0,0,0,0|2,0,0]=4 4837 B12R2.80 Cc1cccc(C2CC2O)c1 Amb27225134 [0,2,0,0,0,0|1,0,0]=3 4838 B12R2.80 Cc1cccc([C@@H]2C[C@H]2Br)c1 Amb27478672 [0,2,0,0,0,0|1,0,0]=3 4839 B12R2.80 Cc1cccc([C@@H]2C[C@H]2N)c1 Amb24100230 [0,2,0,0,0,0|1,0,0]=3 4840 B12R2.80 Cc1cccc([C@@H]2C[C@H]2N)n1 Amb33199980 [0,2,0,0,0,0|2,0,0]=4 4841 B12R2.80 Cc1ccnc(C2CC2N)c1 Amb33224289 [0,2,0,0,0,0|2,0,0]=4 4842 B12R2.80 Cc1ccnc([C@@H]2C[C@H]2N)c1 Amb33318399 [0,2,0,0,0,0|2,0,0]=4 4843 B12R2.80 Cc1cncc(C2CC2N)c1 Amb33172509 [0,2,0,0,0,0|2,0,0]=4 4844 B12R2.80 Cc1cncc([C@@H]2C[C@H]2N)c1 Amb33318315 [0,2,0,0,0,0|2,0,0]=4 4845 B12R2.80 Clc1cccc(C2CC2Cl)c1 Amb27237656 [0,2,0,0,0,0|1,0,0]=3 4846 B12R2.80 Clc1cccc([C@@H]2C[C@H]2Br)c1 Amb27220998 [0,2,0,0,0,0|1,0,0]=3 4847 B12R2.80 Fc1cccc(C2CC2Br)c1 Amb23454927 [0,2,0,0,0,0|1,0,0]=3 4848 B12R2.80 Fc1cccc([C@@H]2C[C@H]2Br)c1 Amb26438558 [0,2,0,0,0,0|1,0,0]=3 4849 B12R2.80 Fc1cncc([C@@H]2C[C@H]2Br)c1 Amb27975607 [0,2,0,0,0,0|2,0,0]=4 4850 B12R2.80 NC1CC1c2cc(Cl)ccn2 Amb33261412 [0,2,0,0,0,0|2,0,0]=4 4851 B12R2.80 NC1CC1c2cc(F)ccn2 Amb33414592 [0,2,0,0,0,0|2,0,0]=4 4852 B12R2.80 NC1CC1c2cccc(Br)c2 Amb19346489 [0,2,0,0,0,0|1,0,0]=3 4853 B12R2.80 NC1CC1c2cccc(Br)c2 Amb9677218 [0,2,0,0,0,0|1,0,0]=3 4854 B12R2.80 NC1CC1c2cccc(Br)n2 Amb33432780 [0,2,0,0,0,0|2,0,0]=4 4855 B12R2.80 NC1CC1c2cccc(Cl)c2 Amb19374842 [0,2,0,0,0,0|1,0,0]=3 4856 B12R2.80 NC1CC1c2cccc(Cl)c2 Amb8389498 [0,2,0,0,0,0|1,0,0]=3 4857 B12R2.80 NC1CC1c2cccc(Cl)n2 Amb33220766 [0,2,0,0,0,0|2,0,0]=4 4858 B12R2.80 NC1CC1c2cccc(F)c2 Amb19514818 [0,2,0,0,0,0|1,0,0]=3 4859 B12R2.80 NC1CC1c2cccc(F)c2 Amb9677176 [0,2,0,0,0,0|1,0,0]=3 4860 B12R2.80 NC1CC1c2cccc(O)c2 Amb17568188 [0,2,0,0,0,0|1,0,0]=3 4861 B12R2.80 NC1CC1c2ccnc(Cl)c2 Amb33390716 [0,2,0,0,0,0|2,0,0]=4 4862 B12R2.80 NC1CC1c2cncc(Br)c2 Amb26558277 [0,2,0,0,0,0|2,0,0]=4 4863 B12R2.80 NC1CC1c2cncc(F)c2 Amb33474362 [0,2,0,0,0,0|2,0,0]=4 4864 B12R2.80 N[C@@H]1C[C@@H]1c2cccc(Cl)c2 Amb34915313 [0,2,0,0,0,0|1,0,0]=3 4865 B12R2.80 N[C@@H]1C[C@@H]1c2cccc(F)c2 Amb34916532 [0,2,0,0,0,0|1,0,0]=3 4866 B12R2.80 N[C@@H]1C[C@H]1c2cc(F)ccn2 Amb33414597 [0,2,0,0,0,0|2,0,0]=4 4867 B12R2.80 N[C@@H]1C[C@H]1c2cccc(Br)c2 Amb25307909 [0,2,0,0,0,0|1,0,0]=3 4868 B12R2.80 N[C@@H]1C[C@H]1c2cccc(Br)c2 Amb32663465 [0,2,0,0,0,0|1,0,0]=3 4869 B12R2.80 N[C@@H]1C[C@H]1c2cccc(Br)n2 Amb33432777 [0,2,0,0,0,0|2,0,0]=4 4870 B12R2.80 N[C@@H]1C[C@H]1c2cccc(Cl)c2 Amb25683521 [0,2,0,0,0,0|1,0,0]=3 4871 B12R2.80 N[C@@H]1C[C@H]1c2cccc(Cl)c2 Amb33032246 [0,2,0,0,0,0|1,0,0]=3 4872 B12R2.80 N[C@@H]1C[C@H]1c2cccc(Cl)n2 Amb33223322 [0,2,0,0,0,0|2,0,0]=4 4873 B12R2.80 N[C@@H]1C[C@H]1c2cccc(F)c2 Amb24100228 [0,2,0,0,0,0|1,0,0]=3 4874 B12R2.80 N[C@@H]1C[C@H]1c2cccc(F)c2 Amb33313468 [0,2,0,0,0,0|1,0,0]=3 4875 B12R2.80 N[C@@H]1C[C@H]1c2cccc(O)c2 Amb27196217 [0,2,0,0,0,0|1,0,0]=3 4876 B12R2.80 N[C@@H]1C[C@H]1c2cncc(Br)c2 Amb33389102 [0,2,0,0,0,0|2,0,0]=4 4877 B12R2.80 N[C@@H]1C[C@H]1c2cncc(F)c2 Amb33196676 [0,2,0,0,0,0|2,0,0]=4 4878 B12R2.80 OC1CC1c2cccc(Cl)c2 Amb27965819 [0,2,0,0,0,0|1,0,0]=3 4879 B12R2.92 BrC1(Br)CC1c2ccccc2 Amb22363907 [0,2,0,0,0,0|1,0,0]=3 4880 B12R2.92 CC1(C)CC1c2ccccc2 Amb22052702 [0,2,0,0,0,0|1,0,0]=3 4881 B12R2.92 CC1(C)NC1c2ccccc2 Amb24056776 [0,2,0,0,0,0|1,0,0]=3 4882 B12R2.92 CC1(C)OC1c2ccccc2 Amb21964286 [0,2,0,0,0,0|0,0,0]=2 4883 B12R2.92 CC1(N)CC1c2ccccc2 Amb26359436 [0,2,0,0,0,0|1,0,0]=3 4884 B12R2.92 CC1(N)CC1c2ccccc2 Amb32661502 [0,2,0,0,0,0|1,0,0]=3 4885 B12R2.92 CC1(O)OC1c2ccccc2 Amb24353312 [0,2,0,0,0,0|0,0,0]=2 4886 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb25378765 [0,2,0,0,0,0|1,0,0]=3 4887 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb28641944 [0,2,0,0,0,0|1,0,0]=3 4888 B12R2.92 C[C@@]1(O)C[C@H]1c2ccccc2 Amb33743331 [0,2,0,0,0,0|1,0,0]=3 4889 B12R2.92 ClC1(Cl)CC1c2ccccc2 Amb2686915 [0,2,0,0,0,0|1,0,0]=3 4890 B12R2.92 FC1(F)CC1c2ccccc2 Amb22227684 [0,2,0,0,0,0|1,0,0]=3 4891 B12R2.115 Br[C@@H]1C[C@H]1c2ccccc2I Amb27618991 [0,2,0,0,0,0|1,0,0]=3 4892 B12R2.115 Brc1ccccc1[C@@H]2C[C@H]2Br Amb27253972 [0,2,0,0,0,0|1,0,0]=3 4893 B12R2.115 CC1CC1c2ccccc2O Amb28246506 [0,2,0,0,0,0|1,0,0]=3 4894 B12R2.115 CC1OC1c2ccccc2F Amb24433748 [0,2,0,0,0,0|0,0,0]=2 4895 B12R2.115 Cc1ccccc1C2CC2Cl Amb27863768 [0,2,0,0,0,0|1,0,0]=3 4896 B12R2.115 Cc1ccccc1C2CC2N Amb19374843 [0,2,0,0,0,0|1,0,0]=3 4897 B12R2.115 Cc1ccccc1C2CC2N Amb9677208 [0,2,0,0,0,0|1,0,0]=3 4898 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2N Amb24560305 [0,2,0,0,0,0|1,0,0]=3 4899 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2N Amb32663427 [0,2,0,0,0,0|1,0,0]=3 4900 B12R2.115 Cc1cccnc1C2CC2N Amb33449954 [0,2,0,0,0,0|2,0,0]=4 4901 B12R2.115 Cc1cccnc1[C@@H]2C[C@H]2N Amb33429010 [0,2,0,0,0,0|2,0,0]=4 4902 B12R2.115 Cc1ccncc1C2CC2N Amb25824994 [0,2,0,0,0,0|2,0,0]=4 4903 B12R2.115 Cc1ccncc1[C@@H]2C[C@H]2N Amb33377454 [0,2,0,0,0,0|2,0,0]=4 4904 B12R2.115 Cc1cnccc1C2CC2N Amb25984414 [0,2,0,0,0,0|2,0,0]=4 4905 B12R2.115 Cc1cnccc1[C@@H]2C[C@H]2N Amb33414498 [0,2,0,0,0,0|2,0,0]=4 4906 B12R2.115 Cc1ncccc1C2CC2N Amb33359400 [0,2,0,0,0,0|2,0,0]=4 4907 B12R2.115 Cc1ncccc1[C@@H]2C[C@H]2N Amb32879597 [0,2,0,0,0,0|2,0,0]=4 4908 B12R2.115 Clc1ccccc1C2CC2Br Amb23454909 [0,2,0,0,0,0|1,0,0]=3 4909 B12R2.115 Clc1ccccc1[C@@H]2C[C@H]2Br Amb27814773 [0,2,0,0,0,0|1,0,0]=3 4910 B12R2.115 Fc1ccccc1[C@@H]2C[C@H]2Br Amb27592280 [0,2,0,0,0,0|1,0,0]=3 4911 B12R2.115 NC1CC1c2ccccc2Br Amb19373270 [0,2,0,0,0,0|1,0,0]=3 4912 B12R2.115 NC1CC1c2ccccc2Br Amb9677239 [0,2,0,0,0,0|1,0,0]=3 4913 B12R2.115 NC1CC1c2ccccc2Cl Amb19346493 [0,2,0,0,0,0|1,0,0]=3 4914 B12R2.115 NC1CC1c2ccccc2Cl Amb9677226 [0,2,0,0,0,0|1,0,0]=3 4915 B12R2.115 NC1CC1c2ccccc2F Amb19514922 [0,2,0,0,0,0|1,0,0]=3 4916 B12R2.115 NC1CC1c2ccccc2F Amb9677241 [0,2,0,0,0,0|1,0,0]=3 4917 B12R2.115 NC1CC1c2ccccc2O Amb25223496 [0,2,0,0,0,0|1,0,0]=3 4918 B12R2.115 NC1CC1c2cccnc2Br Amb33387464 [0,2,0,0,0,0|2,0,0]=4 4919 B12R2.115 NC1CC1c2cccnc2Cl Amb32750173 [0,2,0,0,0,0|2,0,0]=4 4920 B12R2.115 NC1CC1c2cccnc2F Amb33449938 [0,2,0,0,0,0|2,0,0]=4 4921 B12R2.115 NC1CC1c2ccncc2Br Amb33451416 [0,2,0,0,0,0|2,0,0]=4 4922 B12R2.115 NC1CC1c2ccncc2Cl Amb33406652 [0,2,0,0,0,0|2,0,0]=4 4923 B12R2.115 NC1CC1c2ccncc2F Amb33474945 [0,2,0,0,0,0|2,0,0]=4 4924 B12R2.115 NC1CC1c2ncccc2Br Amb33335727 [0,2,0,0,0,0|2,0,0]=4 4925 B12R2.115 NC1CC1c2ncccc2F Amb33475022 [0,2,0,0,0,0|2,0,0]=4 4926 B12R2.115 NC1OC1c2ccccc2Br Amb28041353 [0,2,0,0,0,0|0,0,0]=2 4927 B12R2.115 N[C@@H]1C[C@@H]1c2ccccc2F Amb34916223 [0,2,0,0,0,0|1,0,0]=3 4928 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Br Amb26055453 [0,2,0,0,0,0|1,0,0]=3 4929 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Br Amb33473602 [0,2,0,0,0,0|1,0,0]=3 4930 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Cl Amb25095403 [0,2,0,0,0,0|1,0,0]=3 4931 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Cl Amb33473675 [0,2,0,0,0,0|1,0,0]=3 4932 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2F Amb26445730 [0,2,0,0,0,0|1,0,0]=3 4933 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2F Amb32663429 [0,2,0,0,0,0|1,0,0]=3 4934 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2O Amb33197211 [0,2,0,0,0,0|1,0,0]=3 4935 B12R2.115 N[C@@H]1C[C@H]1c2cccnc2Br Amb33387461 [0,2,0,0,0,0|2,0,0]=4 4936 B12R2.115 N[C@@H]1C[C@H]1c2cccnc2Cl Amb33257321 [0,2,0,0,0,0|2,0,0]=4 4937 B12R2.115 N[C@@H]1C[C@H]1c2cccnc2F Amb33378306 [0,2,0,0,0,0|2,0,0]=4 4938 B12R2.115 N[C@@H]1C[C@H]1c2ccncc2Br Amb33388249 [0,2,0,0,0,0|2,0,0]=4 4939 B12R2.115 N[C@@H]1C[C@H]1c2ccncc2Cl Amb33413572 [0,2,0,0,0,0|2,0,0]=4 4940 B12R2.115 N[C@@H]1C[C@H]1c2ccncc2F Amb33374491 [0,2,0,0,0,0|2,0,0]=4 4941 B12R2.115 N[C@@H]1C[C@H]1c2ncccc2Br Amb33335719 [0,2,0,0,0,0|2,0,0]=4 4942 B12R2.115 N[C@@H]1C[C@H]1c2ncccc2F Amb33419176 [0,2,0,0,0,0|2,0,0]=4 4943 B12R2.235 CC1(c2ccccc2)CC1Br Amb27184089 [0,2,0,0,0,0|1,0,0]=3 4944 B12R2.235 CC1(c2ccccc2)CC1N Amb18947391 [0,2,0,0,0,0|1,0,0]=3 4945 B12R2.235 CC1(c2ccccc2)CC1N Amb33549909 [0,2,0,0,0,0|1,0,0]=3 4946 B12R2.235 CC1(c2ccccc2)OC1Cl Amb27776758 [0,2,0,0,0,0|0,0,0]=2 4947 B12R2.235 CC1(c2cccnc2)CC1N Amb18947383 [0,2,0,0,0,0|2,0,0]=4 4948 B12R2.235 CC1CC1(N)c2ccncc2 Amb27806893 [0,2,0,0,0,0|2,0,0]=4 4949 B12R2.235 CC1CC1(O)c2ccccn2 Amb25149270 [0,2,0,0,0,0|2,0,0]=4 4950 B12R2.235 CC1CC1(O)c2ccncc2 Amb28064515 [0,2,0,0,0,0|2,0,0]=4 4951 B12R2.235 CC1OC1(O)c2ccccc2 Amb26510326 [0,2,0,0,0,0|0,0,0]=2 4952 B12R2.235 CN1NC1(C)c2ccccc2 Amb27184008 [0,2,0,0,0,0|2,0,0]=4 4953 B12R2.235 C[C@@]1(c2ccccc2)CC1Cl Amb27791824 [0,2,0,0,0,0|1,0,0]=3 4954 B12R2.235 C[C@@]1(c2ccccc2)C[C@@H]1Br Amb28053371 [0,2,0,0,0,0|1,0,0]=3 4955 B12R2.235 C[C@@]1(c2ccccc2)C[C@H]1Br Amb28053370 [0,2,0,0,0,0|1,0,0]=3 4956 B12R2.235 C[C@@]1(c2ccccc2)C[C@H]1Cl Amb28458446 [0,2,0,0,0,0|1,0,0]=3 4957 B12R2.235 C[C@@]1(c2ccccc2)O[C@@H]1Cl Amb27195805 [0,2,0,0,0,0|0,0,0]=2 4958 B12R2.235 NC1CC1(F)c2ccccc2 Amb32663945 [0,2,0,0,0,0|1,0,0]=3 4959 B12R2.235 NC1CC1(F)c2ccccc2 Amb8389488 [0,2,0,0,0,0|1,0,0]=3 4960 B12R2.9 BrCc1ccc(C2CC2)cc1 Amb16234144 [0,2,0,0,0,0|1,0,0]=3 4961 B12R2.9 C#Cc1ccc(C2CC2)cc1 Amb25729638 [0,2,0,0,0,0|1,0,0]=3 4962 B12R2.9 C#Cc1ccc(C2CC2)cn1 Amb28061052 [0,2,0,0,0,0|2,0,0]=4 4963 B12R2.9 C#Cc1ccc(C2CO2)cc1 Amb16192467 [0,2,0,0,0,0|0,0,0]=2 4964 B12R2.9 C#Cc1ccc([C@@H]2CO2)cc1 Amb32881613 [0,2,0,0,0,0|0,0,0]=2 4965 B12R2.9 C#Cc1ccc([C@H]2CO2)cc1 Amb32881614 [0,2,0,0,0,0|0,0,0]=2 4966 B12R2.9 C=Cc1ccc(C2CC2)cc1 Amb24056364 [0,2,0,0,0,0|1,0,0]=3 4967 B12R2.9 C=Cc1ccc(C2CC2)cn1 Amb28289536 [0,2,0,0,0,0|2,0,0]=4 4968 B12R2.9 C=Cc1ccc(C2CC2)nc1 Amb25151851 [0,2,0,0,0,0|2,0,0]=4 4969 B12R2.9 CCc1ccc(C2CN2)cc1 Amb18862481 [0,2,0,0,0,0|1,0,0]=3 4970 B12R2.9 CCc1ccc(C2CO2)cc1 Amb6252099 [0,2,0,0,0,0|0,0,0]=2 4971 B12R2.9 CCc1ccc([C@@H]2CO2)cc1 Amb26913044 [0,2,0,0,0,0|0,0,0]=2 4972 B12R2.9 CCc1ccc([C@H]2CO2)cc1 Amb25136404 [0,2,0,0,0,0|0,0,0]=2 4973 B12R2.9 COc1ccc(C2CC2)cc1 Amb4302690 [0,2,0,0,0,0|1,0,0]=3 4974 B12R2.9 COc1ccc(C2CC2)cn1 Amb25085104 [0,2,0,0,0,0|2,0,0]=4 4975 B12R2.9 COc1ccc(C2CN2)cc1 Amb18224269 [0,2,0,0,0,0|1,0,0]=3 4976 B12R2.9 COc1ccc(C2CO2)cc1 Amb1137350 [0,2,0,0,0,0|0,0,0]=2 4977 B12R2.9 COc1ccc(C2CO2)cn1 Amb25366283 [0,2,0,0,0,0|1,0,0]=3 4978 B12R2.9 COc1ccc(C2CO2)nc1 Amb33314892 [0,2,0,0,0,0|1,0,0]=3 4979 B12R2.9 COc1ccc([C@@H]2CO2)cc1 Amb16231710 [0,2,0,0,0,0|0,0,0]=2 4980 B12R2.9 COc1ccc([C@@H]2CO2)cn1 Amb33313843 [0,2,0,0,0,0|1,0,0]=3 4981 B12R2.9 COc1ccc([C@@H]2CO2)nc1 Amb33373967 [0,2,0,0,0,0|1,0,0]=3 4982 B12R2.9 COc1ccc([C@H]2CO2)cc1 Amb27803719 [0,2,0,0,0,0|0,0,0]=2 4983 B12R2.9 COc1ccc([C@H]2CO2)cn1 Amb33313844 [0,2,0,0,0,0|1,0,0]=3 4984 B12R2.9 COc1ccc([C@H]2CO2)nc1 Amb33373968 [0,2,0,0,0,0|1,0,0]=3 4985 B12R2.9 CSc1ccc(C2CN2)cc1 Amb18862654 [0,2,0,0,0,0|1,0,0]=3 4986 B12R2.9 CSc1ccc(C2CO2)cc1 Amb18862690 [0,2,0,0,0,0|0,0,0]=2 4987 B12R2.9 CSc1ccc([C@@H]2CO2)cc1 Amb33374583 [0,2,0,0,0,0|0,0,0]=2 4988 B12R2.9 CSc1ccc([C@H]2CO2)cc1 Amb33374605 [0,2,0,0,0,0|0,0,0]=2 4989 B12R2.9 ClCc1ccc(C2CC2)cc1 Amb28397940 [0,2,0,0,0,0|1,0,0]=3 4990 B12R2.9 ClCc1ccc(C2CO2)cc1 Amb28141424 [0,2,0,0,0,0|0,0,0]=2 4991 B12R2.9 N#Cc1ccc(C2CC2)cc1 Amb9768836 [0,2,0,0,0,0|1,0,0]=3 4992 B12R2.9 N#Cc1ccc(C2CO2)cc1 Amb9709021 [0,2,0,0,0,0|0,0,0]=2 4993 B12R2.9 N#Cc1ccc([C@@H]2CO2)cc1 Amb26953977 [0,2,0,0,0,0|0,0,0]=2 4994 B12R2.9 N#Cc1ccc([C@H]2CO2)cc1 Amb25770880 [0,2,0,0,0,0|0,0,0]=2 4995 B12R2.9 N#[N+]c1ccc(C2CC2)cc1 Amb35721648 [0,2,0,0,0,0|1,0,0]=3 4996 B12R2.9 NCc1ccc(C2CC2)cc1 Amb18962158 [0,2,0,0,0,0|1,0,0]=3 4997 B12R2.9 NCc1ccc(C2CC2)cc1 Amb33526987 [0,2,0,0,0,0|1,0,0]=3 4998 B12R2.9 NCc1ccc(C2CC2)cn1 Amb18251315 [0,2,0,0,0,0|2,0,0]=4 4999 B12R2.9 NCc1ccc(C2CC2)nc1 Amb23455633 [0,2,0,0,0,0|2,0,0]=4 5000 B12R2.9 NNc1ccc(C2CC2)cc1 Amb26350887 [0,2,0,0,0,0|1,0,0]=3 5001 B12R2.9 O=Cc1ccc(C2CC2)cc1 Amb9768833 [0,2,0,0,0,0|1,0,0]=3 5002 B12R2.9 O=Cc1ccc(C2CC2)cn1 Amb22276752 [0,2,0,0,0,0|2,0,0]=4 5003 B12R2.9 O=Cc1ccc(N2CC2)cc1 Amb24102647 [0,2,0,0,0,0|2,0,0]=4 5004 B12R2.9 OCc1ccc(C2CC2)cc1 Amb9769902 [0,2,0,0,0,0|1,0,0]=3 5005 B12R2.9 OCc1ccc(N2CC2)cc1 Amb24069066 [0,2,0,0,0,0|2,0,0]=4 5006 B12R2.9 SCc1ccc(C2CC2)cc1 Amb24354854 [0,2,0,0,0,0|1,0,0]=3 5007 B12R2.9 [C-]#[N+]c1ccc(C2CC2)cc1 Amb32797365 [0,2,0,0,0,0|1,0,0]=3 5008 B12R2.290 Brc1ccc(C2(Br)CC2)cc1 Amb33430622 [0,2,0,0,0,0|1,0,0]=3 5009 B12R2.290 CC1(c2ccc(Br)cc2)CC1 Amb24064681 [0,2,0,0,0,0|1,0,0]=3 5010 B12R2.290 CC1(c2ccc(Br)cc2)CN1 Amb18224964 [0,2,0,0,0,0|1,0,0]=3 5011 B12R2.290 CC1(c2ccc(Br)cc2)CO1 Amb17089389 [0,2,0,0,0,0|0,0,0]=2 5012 B12R2.290 CC1(c2ccc(Br)cn2)CO1 Amb33477151 [0,2,0,0,0,0|1,0,0]=3 5013 B12R2.290 CC1(c2ccc(Br)nc2)CC1 Amb27441338 [0,2,0,0,0,0|2,0,0]=4 5014 B12R2.290 CC1(c2ccc(Br)nc2)CO1 Amb33388378 [0,2,0,0,0,0|1,0,0]=3 5015 B12R2.290 CC1(c2ccc(Cl)cc2)CN1 Amb18862737 [0,2,0,0,0,0|1,0,0]=3 5016 B12R2.290 CC1(c2ccc(Cl)cc2)CO1 Amb17089388 [0,2,0,0,0,0|0,0,0]=2 5017 B12R2.290 CC1(c2ccc(Cl)cn2)CO1 Amb33058793 [0,2,0,0,0,0|1,0,0]=3 5018 B12R2.290 CC1(c2ccc(Cl)nc2)CC1 Amb27186699 [0,2,0,0,0,0|2,0,0]=4 5019 B12R2.290 CC1(c2ccc(Cl)nc2)CO1 Amb33261586 [0,2,0,0,0,0|1,0,0]=3 5020 B12R2.290 CC1(c2ccc(F)cc2)CC1 Amb26456966 [0,2,0,0,0,0|1,0,0]=3 5021 B12R2.290 CC1(c2ccc(F)cc2)CN1 Amb18224288 [0,2,0,0,0,0|1,0,0]=3 5022 B12R2.290 CC1(c2ccc(F)cc2)CO1 Amb17089387 [0,2,0,0,0,0|0,0,0]=2 5023 B12R2.290 CC1(c2ccc(F)cn2)CO1 Amb24431321 [0,2,0,0,0,0|1,0,0]=3 5024 B12R2.290 CC1(c2ccc(F)nc2)CO1 Amb33425812 [0,2,0,0,0,0|1,0,0]=3 5025 B12R2.290 CC1(c2ccc(I)cc2)CC1 Amb26964948 [0,2,0,0,0,0|1,0,0]=3 5026 B12R2.290 CC1(c2ccc(N)cc2)CC1 Amb25993086 [0,2,0,0,0,0|1,0,0]=3 5027 B12R2.290 CC1(c2ccc(N)cc2)CC1 Amb31156481 [0,2,0,0,0,0|1,0,0]=3 5028 B12R2.290 CC1(c2ccc(N)cc2)N=N1 Amb27783564 [0,2,0,0,0,0|2,0,0]=4 5029 B12R2.290 CC1(c2ccc(O)cc2)CC1 Amb24102688 [0,2,0,0,0,0|1,0,0]=3 5030 B12R2.290 CC1(c2ccc(O)cn2)CC1 Amb25969739 [0,2,0,0,0,0|2,0,0]=4 5031 B12R2.290 CC1(c2ncc(Br)cn2)CO1 Amb33334802 [0,2,0,0,0,0|2,0,0]=4 5032 B12R2.290 C[C@]1(c2ccc(F)cc2)CO1 Amb25028066 [0,2,0,0,0,0|0,0,0]=2 5033 B12R2.290 Cc1ccc(C2(C)CN2)cc1 Amb18862482 [0,2,0,0,0,0|1,0,0]=3 5034 B12R2.290 Cc1ccc(C2(C)CO2)cc1 Amb18024289 [0,2,0,0,0,0|0,0,0]=2 5035 B12R2.290 Cc1ccc(C2(C)CO2)cn1 Amb32877832 [0,2,0,0,0,0|1,0,0]=3 5036 B12R2.290 Cc1ccc(C2(C)CO2)nc1 Amb33198451 [0,2,0,0,0,0|1,0,0]=3 5037 B12R2.290 Cc1ccc(C2(N)CC2)cc1 Amb2721358 [0,2,0,0,0,0|1,0,0]=3 5038 B12R2.290 Cc1ccc(C2(N)CC2)cc1 Amb8997036 [0,2,0,0,0,0|1,0,0]=3 5039 B12R2.290 Cc1ccc(C2(N)CC2)cn1 Amb25701933 [0,2,0,0,0,0|2,0,0]=4 5040 B12R2.290 Cc1ccc(C2(N)CC2)nc1 Amb26451497 [0,2,0,0,0,0|2,0,0]=4 5041 B12R2.290 Cc1ccc(C2(O)CC2)cc1 Amb26546694 [0,2,0,0,0,0|1,0,0]=3 5042 B12R2.290 Cc1ccc(C2(O)CC2)cn1 Amb28144604 [0,2,0,0,0,0|2,0,0]=4 5043 B12R2.290 Cc1ccc(C2(O)CC2)nc1 Amb33200265 [0,2,0,0,0,0|2,0,0]=4 5044 B12R2.290 Cc1cnc(C2(C)CO2)cn1 Amb33374321 [0,2,0,0,0,0|2,0,0]=4 5045 B12R2.290 FC1(c2ccc(Br)cc2)CC1 Amb28249291 [0,2,0,0,0,0|1,0,0]=3 5046 B12R2.290 NC1(C2=CNC(=O)C=C2)CC1 Amb27455493 [0,2,0,0,0,0|2,0,0]=4 5047 B12R2.290 NC1(c2ccc(Br)cc2)CC1 Amb10609453 [0,2,0,0,0,0|1,0,0]=3 5048 B12R2.290 NC1(c2ccc(Br)cc2)CC1 Amb8840540 [0,2,0,0,0,0|1,0,0]=3 5049 B12R2.290 NC1(c2ccc(Br)cn2)CC1 Amb21964647 [0,2,0,0,0,0|2,0,0]=4 5050 B12R2.290 NC1(c2ccc(Br)cn2)CC1 Amb33996756 [0,2,0,0,0,0|2,0,0]=4 5051 B12R2.290 NC1(c2ccc(Br)nc2)CC1 Amb27614447 [0,2,0,0,0,0|2,0,0]=4 5052 B12R2.290 NC1(c2ccc(Cl)cc2)CC1 Amb2721360 [0,2,0,0,0,0|1,0,0]=3 5053 B12R2.290 NC1(c2ccc(Cl)cc2)CC1 Amb5753568 [0,2,0,0,0,0|1,0,0]=3 5054 B12R2.290 NC1(c2ccc(Cl)cn2)CC1 Amb26478067 [0,2,0,0,0,0|2,0,0]=4 5055 B12R2.290 NC1(c2ccc(Cl)nc2)CC1 Amb27878518 [0,2,0,0,0,0|2,0,0]=4 5056 B12R2.290 NC1(c2ccc(F)cc2)CC1 Amb2721361 [0,2,0,0,0,0|1,0,0]=3 5057 B12R2.290 NC1(c2ccc(F)cc2)CC1 Amb5753939 [0,2,0,0,0,0|1,0,0]=3 5058 B12R2.290 NC1(c2ccc(F)cn2)CC1 Amb20622907 [0,2,0,0,0,0|2,0,0]=4 5059 B12R2.290 NC1(c2ccc(F)cn2)CC1 Amb20668305 [0,2,0,0,0,0|2,0,0]=4 5060 B12R2.290 NC1(c2ccc(F)cn2)CC1 Amb34143521 [0,2,0,0,0,0|2,0,0]=4 5061 B12R2.290 NC1(c2ccc(F)nc2)CC1 Amb24485776 [0,2,0,0,0,0|2,0,0]=4 5062 B12R2.290 NC1(c2ccc(I)cc2)CC1 Amb24093261 [0,2,0,0,0,0|1,0,0]=3 5063 B12R2.290 NC1(c2ccc(O)cc2)CC1 Amb22757490 [0,2,0,0,0,0|1,0,0]=3 5064 B12R2.290 NC1(c2ccc(O)cc2)CC1 Amb28314203 [0,2,0,0,0,0|1,0,0]=3 5065 B12R2.290 Nc1ccc(C2(N)CC2)cc1 Amb28365419 [0,2,0,0,0,0|1,0,0]=3 5066 B12R2.290 OC1(c2ccc(Br)cc2)CC1 Amb22284799 [0,2,0,0,0,0|1,0,0]=3 5067 B12R2.290 OC1(c2ccc(Br)cn2)CC1 Amb26038113 [0,2,0,0,0,0|2,0,0]=4 5068 B12R2.290 OC1(c2ccc(Br)nc2)CC1 Amb24598584 [0,2,0,0,0,0|2,0,0]=4 5069 B12R2.290 OC1(c2ccc(Cl)cc2)CC1 Amb18182716 [0,2,0,0,0,0|1,0,0]=3 5070 B12R2.290 OC1(c2ccc(Cl)cn2)CC1 Amb24485846 [0,2,0,0,0,0|2,0,0]=4 5071 B12R2.290 OC1(c2ccc(Cl)nc2)CC1 Amb26359874 [0,2,0,0,0,0|2,0,0]=4 5072 B12R2.290 OC1(c2ccc(F)cc2)CC1 Amb18181715 [0,2,0,0,0,0|1,0,0]=3 5073 B12R2.290 OC1(c2ccc(F)cn2)CC1 Amb25701288 [0,2,0,0,0,0|2,0,0]=4 5074 B12R2.290 OC1(c2ccc(F)nc2)CC1 Amb33426561 [0,2,0,0,0,0|2,0,0]=4 5075 B12R2.290 OC1(c2ccc(S)cc2)CC1 Amb28133840 [0,2,0,0,0,0|1,0,0]=3 5076 B12R2.290 Oc1ccc(C2(O)CC2)cc1 Amb26880508 [0,2,0,0,0,0|1,0,0]=3 5077 B12R2.290 Oc1ccc(C2(O)CC2)nc1 Amb28386484 [0,2,0,0,0,0|2,0,0]=4 5078 B12R2.290 SC1(c2ccc(Br)cc2)CC1 Amb33435289 [0,2,0,0,0,0|1,0,0]=3 5079 B12R2.291 Brc1cc(C2CC2)cnc1Br Amb24320544 [0,2,0,0,0,0|2,0,0]=4 5080 B12R2.291 Brc1ccc(C2CC2)cc1Br Amb20617855 [0,2,0,0,0,0|1,0,0]=3 5081 B12R2.291 Brc1ccc(C2CO2)cc1Br Amb27257532 [0,2,0,0,0,0|0,0,0]=2 5082 B12R2.291 Brc1ccc([C@@H]2CO2)cc1Br Amb33388139 [0,2,0,0,0,0|0,0,0]=2 5083 B12R2.291 Brc1ccc([C@H]2CO2)cc1Br Amb33388152 [0,2,0,0,0,0|0,0,0]=2 5084 B12R2.291 Brc1cnc(C2CC2)cc1Br Amb20617558 [0,2,0,0,0,0|2,0,0]=4 5085 B12R2.291 Cc1cc(C2CC2)ccc1Br Amb20617853 [0,2,0,0,0,0|1,0,0]=3 5086 B12R2.291 Cc1cc(C2CC2)ccc1Cl Amb33357013 [0,2,0,0,0,0|1,0,0]=3 5087 B12R2.291 Cc1cc(C2CC2)ccc1N Amb32652323 [0,2,0,0,0,0|1,0,0]=3 5088 B12R2.291 Cc1cc(C2CC2)ccc1N Amb33530665 [0,2,0,0,0,0|1,0,0]=3 5089 B12R2.291 Cc1cc(C2CC2)ncc1Br Amb26435609 [0,2,0,0,0,0|2,0,0]=4 5090 B12R2.291 Cc1cc(C2CC2)ncc1Br Amb30584809 [0,2,0,0,0,0|2,0,0]=4 5091 B12R2.291 Cc1cc(C2CN2)ccc1F Amb18224289 [0,2,0,0,0,0|1,0,0]=3 5092 B12R2.291 Cc1cc(C2CO2)ccc1Br Amb24657153 [0,2,0,0,0,0|0,0,0]=2 5093 B12R2.291 Cc1cc(C2CO2)ccc1Cl Amb25864865 [0,2,0,0,0,0|0,0,0]=2 5094 B12R2.291 Cc1cc(C2CO2)ccc1F Amb17232097 [0,2,0,0,0,0|0,0,0]=2 5095 B12R2.291 Cc1cc(C2CO2)cnc1Cl Amb33058262 [0,2,0,0,0,0|1,0,0]=3 5096 B12R2.291 Cc1cc([C@@H]2CO2)ccc1Br Amb33332740 [0,2,0,0,0,0|0,0,0]=2 5097 B12R2.291 Cc1cc([C@@H]2CO2)ccc1F Amb26340236 [0,2,0,0,0,0|0,0,0]=2 5098 B12R2.291 Cc1cc([C@@H]2CO2)cnc1Cl Amb33059301 [0,2,0,0,0,0|1,0,0]=3 5099 B12R2.291 Cc1cc([C@H]2CO2)ccc1Br Amb33332737 [0,2,0,0,0,0|0,0,0]=2 5100 B12R2.291 Cc1cc([C@H]2CO2)ccc1F Amb27207896 [0,2,0,0,0,0|0,0,0]=2 5101 B12R2.291 Cc1cc([C@H]2CO2)cnc1Cl Amb33059296 [0,2,0,0,0,0|1,0,0]=3 5102 B12R2.291 Cc1ccc(C2CC2)cc1Br Amb20617877 [0,2,0,0,0,0|1,0,0]=3 5103 B12R2.291 Cc1ccc(C2CC2)cc1C Amb27193952 [0,2,0,0,0,0|1,0,0]=3 5104 B12R2.291 Cc1ccc(C2CN2)cc1C Amb18862483 [0,2,0,0,0,0|1,0,0]=3 5105 B12R2.291 Cc1ccc(C2CO2)cc1Br Amb26472628 [0,2,0,0,0,0|0,0,0]=2 5106 B12R2.291 Cc1ccc(C2CO2)cc1C Amb9715102 [0,2,0,0,0,0|0,0,0]=2 5107 B12R2.291 Cc1ccc(C2CO2)cc1Cl Amb25835327 [0,2,0,0,0,0|0,0,0]=2 5108 B12R2.291 Cc1ccc(C2CO2)cc1F Amb26869699 [0,2,0,0,0,0|0,0,0]=2 5109 B12R2.291 Cc1ccc(C2CO2)cc1O Amb27839834 [0,2,0,0,0,0|0,0,0]=2 5110 B12R2.291 Cc1ccc([C@@H]2CO2)cc1Br Amb33334903 [0,2,0,0,0,0|0,0,0]=2 5111 B12R2.291 Cc1ccc([C@@H]2CO2)cc1C Amb26340237 [0,2,0,0,0,0|0,0,0]=2 5112 B12R2.291 Cc1ccc([C@@H]2CO2)cc1F Amb25851813 [0,2,0,0,0,0|0,0,0]=2 5113 B12R2.291 Cc1ccc([C@H]2CO2)cc1Br Amb33334880 [0,2,0,0,0,0|0,0,0]=2 5114 B12R2.291 Cc1ccc([C@H]2CO2)cc1C Amb25847155 [0,2,0,0,0,0|0,0,0]=2 5115 B12R2.291 Cc1ccc([C@H]2CO2)cc1F Amb25151890 [0,2,0,0,0,0|0,0,0]=2 5116 B12R2.291 Cc1cnc(C2CC2)cc1Br Amb24320636 [0,2,0,0,0,0|2,0,0]=4 5117 B12R2.291 Cc1nc(C2CC2)ccc1Br Amb32413611 [0,2,0,0,0,0|2,0,0]=4 5118 B12R2.291 Cc1nc(C2CC2)ccc1N Amb25148027 [0,2,0,0,0,0|2,0,0]=4 5119 B12R2.291 Clc1cc(C2CC2)ccc1Br Amb20617854 [0,2,0,0,0,0|1,0,0]=3 5120 B12R2.291 Clc1cc(C2CC2)ccc1I Amb33329981 [0,2,0,0,0,0|1,0,0]=3 5121 B12R2.291 Clc1cc(C2CC2)ncc1Br Amb20617549 [0,2,0,0,0,0|2,0,0]=4 5122 B12R2.291 Clc1cc(C2CC2)ncc1Br Amb32668343 [0,2,0,0,0,0|2,0,0]=4 5123 B12R2.291 Clc1cc(C2CO2)ccc1Br Amb26653708 [0,2,0,0,0,0|0,0,0]=2 5124 B12R2.291 Clc1cc(C2CO2)cnc1Cl Amb33413637 [0,2,0,0,0,0|1,0,0]=3 5125 B12R2.291 Clc1cc([C@@H]2CO2)ccc1Br Amb33477620 [0,2,0,0,0,0|0,0,0]=2 5126 B12R2.291 Clc1cc([C@@H]2CO2)cnc1Cl Amb33260704 [0,2,0,0,0,0|1,0,0]=3 5127 B12R2.291 Clc1cc([C@H]2CO2)ccc1Br Amb33477615 [0,2,0,0,0,0|0,0,0]=2 5128 B12R2.291 Clc1cc([C@H]2CO2)cnc1Cl Amb33260702 [0,2,0,0,0,0|1,0,0]=3 5129 B12R2.291 Clc1ccc(C2CC2)cc1Br Amb20617878 [0,2,0,0,0,0|1,0,0]=3 5130 B12R2.291 Clc1ccc(C2CC2)cc1Cl Amb24321239 [0,2,0,0,0,0|1,0,0]=3 5131 B12R2.291 Clc1ccc(C2CO2)cc1Br Amb25151736 [0,2,0,0,0,0|0,0,0]=2 5132 B12R2.291 Clc1ccc(C2CO2)cc1Cl Amb6267420 [0,2,0,0,0,0|0,0,0]=2 5133 B12R2.291 Clc1ccc([C@@H]2CO2)cc1Br Amb33335794 [0,2,0,0,0,0|0,0,0]=2 5134 B12R2.291 Clc1ccc([C@@H]2CO2)cc1Cl Amb24688723 [0,2,0,0,0,0|0,0,0]=2 5135 B12R2.291 Clc1ccc([C@H]2CO2)cc1Br Amb33335792 [0,2,0,0,0,0|0,0,0]=2 5136 B12R2.291 Clc1ccc([C@H]2CO2)cc1Cl Amb26486725 [0,2,0,0,0,0|0,0,0]=2 5137 B12R2.291 Clc1nc(C2CC2)ccc1Br Amb24360594 [0,2,0,0,0,0|2,0,0]=4 5138 B12R2.291 Clc1ncc(C2CC2)cc1I Amb28204210 [0,2,0,0,0,0|2,0,0]=4 5139 B12R2.291 Fc1cc(C2CC2)ccc1Br Amb20617856 [0,2,0,0,0,0|1,0,0]=3 5140 B12R2.291 Fc1cc(C2CC2)ccc1Cl Amb32685081 [0,2,0,0,0,0|1,0,0]=3 5141 B12R2.291 Fc1cc(C2CC2)ccc1I Amb25354462 [0,2,0,0,0,0|1,0,0]=3 5142 B12R2.291 Fc1cc(C2CC2)cnc1F Amb35667049 [0,2,0,0,0,0|2,0,0]=4 5143 B12R2.291 Fc1cc(C2CO2)ccc1Br Amb33532744 [0,2,0,0,0,0|0,0,0]=2 5144 B12R2.291 Fc1cc(C2CO2)ccc1Cl Amb18183725 [0,2,0,0,0,0|0,0,0]=2 5145 B12R2.291 Fc1cc([C@@H]2CO2)ccc1Br Amb33006230 [0,2,0,0,0,0|0,0,0]=2 5146 B12R2.291 Fc1cc([C@H]2CO2)ccc1Br Amb33006236 [0,2,0,0,0,0|0,0,0]=2 5147 B12R2.291 Fc1ccc(C2CC2)cc1Br Amb20617879 [0,2,0,0,0,0|1,0,0]=3 5148 B12R2.291 Fc1ccc(C2CC2)cc1Cl Amb24321144 [0,2,0,0,0,0|1,0,0]=3 5149 B12R2.291 Fc1ccc(C2CC2)cc1I Amb24321145 [0,2,0,0,0,0|1,0,0]=3 5150 B12R2.291 Fc1ccc(C2CN2)cc1Cl Amb18224419 [0,2,0,0,0,0|1,0,0]=3 5151 B12R2.291 Fc1ccc(C2CN2)cc1F Amb18862515 [0,2,0,0,0,0|1,0,0]=3 5152 B12R2.291 Fc1ccc(C2CO2)cc1Br Amb25761539 [0,2,0,0,0,0|0,0,0]=2 5153 B12R2.291 Fc1ccc(C2CO2)cc1F Amb9707271 [0,2,0,0,0,0|0,0,0]=2 5154 B12R2.291 Fc1ccc([C@@H]2CO2)cc1Br Amb25851825 [0,2,0,0,0,0|0,0,0]=2 5155 B12R2.291 Fc1ccc([C@@H]2CO2)cc1Cl Amb27757586 [0,2,0,0,0,0|0,0,0]=2 5156 B12R2.291 Fc1ccc([C@@H]2CO2)cc1F Amb26850487 [0,2,0,0,0,0|0,0,0]=2 5157 B12R2.291 Fc1ccc([C@H]2CO2)cc1Br Amb24362987 [0,2,0,0,0,0|0,0,0]=2 5158 B12R2.291 Fc1ccc([C@H]2CO2)cc1Cl Amb24354717 [0,2,0,0,0,0|0,0,0]=2 5159 B12R2.291 Fc1ccc([C@H]2CO2)cc1F Amb24089430 [0,2,0,0,0,0|0,0,0]=2 5160 B12R2.291 Fc1nc(C2CC2)ccc1Br Amb24319157 [0,2,0,0,0,0|2,0,0]=4 5161 B12R2.291 Fc1ncc(C2CC2)cc1I Amb25974395 [0,2,0,0,0,0|2,0,0]=4 5162 B12R2.291 NC1=CC=C(C2CC2)OC1=O Amb32755742 [0,2,0,0,0,0|2,0,0]=4 5163 B12R2.291 Nc1cc(C2CC2)ccc1Br Amb20617858 [0,2,0,0,0,0|1,0,0]=3 5164 B12R2.291 Nc1cc(C2CC2)ccc1Cl Amb18948607 [0,2,0,0,0,0|1,0,0]=3 5165 B12R2.291 Nc1cc(C2CC2)ccc1F Amb27248334 [0,2,0,0,0,0|1,0,0]=3 5166 B12R2.291 Nc1cc(C2CC2)cnc1Br Amb24320806 [0,2,0,0,0,0|2,0,0]=4 5167 B12R2.291 Nc1cc(C2CC2)ncc1Br Amb24319605 [0,2,0,0,0,0|2,0,0]=4 5168 B12R2.291 Nc1ccc(C2CC2)cc1Br Amb20617881 [0,2,0,0,0,0|1,0,0]=3 5169 B12R2.291 Nc1ccc(C2CC2)cc1Cl Amb26848876 [0,2,0,0,0,0|1,0,0]=3 5170 B12R2.291 Nc1ccc(C2CC2)cc1F Amb33533174 [0,2,0,0,0,0|1,0,0]=3 5171 B12R2.291 Nc1ccc(C2CC2)cc1F Amb9769783 [0,2,0,0,0,0|1,0,0]=3 5172 B12R2.291 Nc1ccc(C2CC2)cc1I Amb35718443 [0,2,0,0,0,0|1,0,0]=3 5173 B12R2.291 Nc1ccc(C2CC2)cc1S Amb35718183 [0,2,0,0,0,0|1,0,0]=3 5174 B12R2.291 Nc1ccc(C2CC2)nc1Cl Amb27156272 [0,2,0,0,0,0|2,0,0]=4 5175 B12R2.291 Nc1ccc(C2CC2)nc1N Amb26488864 [0,2,0,0,0,0|2,0,0]=4 5176 B12R2.291 Nc1nc(C2CC2)ccc1Br Amb27425151 [0,2,0,0,0,0|2,0,0]=4 5177 B12R2.291 Nc1ncc(C2CC2)cc1Br Amb24319702 [0,2,0,0,0,0|2,0,0]=4 5178 B12R2.291 Oc1ccc(C2CC2)cc1Cl Amb24574592 [0,2,0,0,0,0|1,0,0]=3 5179 B12R2.291 Oc1ccc(C2CC2)cc1F Amb24579424 [0,2,0,0,0,0|1,0,0]=3 5180 B12R2.1317 Brc1cc(Br)c(C2CC2)cn1 Amb20617523 [0,2,0,0,0,0|2,0,0]=4 5181 B12R2.1317 Brc1ccc(C2CC2)c(Br)n1 Amb24319254 [0,2,0,0,0,0|2,0,0]=4 5182 B12R2.1317 Brc1ccc(C2CO2)c(Br)c1 Amb33431961 [0,2,0,0,0,0|0,0,0]=2 5183 B12R2.1317 Brc1ccc([C@@H]2CO2)c(Br)c1 Amb33432332 [0,2,0,0,0,0|0,0,0]=2 5184 B12R2.1317 Brc1ccc([C@H]2CO2)c(Br)c1 Amb33432330 [0,2,0,0,0,0|0,0,0]=2 5185 B12R2.1317 Brc1cnc(C2CO2)c(Br)c1 Amb27878139 [0,2,0,0,0,0|1,0,0]=3 5186 B12R2.1317 Brc1cnc([C@@H]2CO2)c(Br)c1 Amb33434377 [0,2,0,0,0,0|1,0,0]=3 5187 B12R2.1317 Brc1cnc([C@H]2CO2)c(Br)c1 Amb33433317 [0,2,0,0,0,0|1,0,0]=3 5188 B12R2.1317 Cc1cc(Br)ccc1C2CC2 Amb20617846 [0,2,0,0,0,0|1,0,0]=3 5189 B12R2.1317 Cc1cc(Br)ccc1C2CO2 Amb24602693 [0,2,0,0,0,0|0,0,0]=2 5190 B12R2.1317 Cc1cc(Br)ccc1[C@@H]2CO2 Amb33435471 [0,2,0,0,0,0|0,0,0]=2 5191 B12R2.1317 Cc1cc(Br)ccc1[C@H]2CO2 Amb33435469 [0,2,0,0,0,0|0,0,0]=2 5192 B12R2.1317 Cc1cc(Br)cnc1C2CC2 Amb27219340 [0,2,0,0,0,0|2,0,0]=4 5193 B12R2.1317 Cc1cc(Cl)ccc1C2CC2 Amb33357007 [0,2,0,0,0,0|1,0,0]=3 5194 B12R2.1317 Cc1cc(Cl)ccc1C2CO2 Amb25827678 [0,2,0,0,0,0|0,0,0]=2 5195 B12R2.1317 Cc1cc(Cl)ccc1[C@@H]2CO2 Amb33413529 [0,2,0,0,0,0|0,0,0]=2 5196 B12R2.1317 Cc1cc(Cl)ccc1[C@H]2CO2 Amb33413525 [0,2,0,0,0,0|0,0,0]=2 5197 B12R2.1317 Cc1cc(F)ccc1C2CO2 Amb18181716 [0,2,0,0,0,0|0,0,0]=2 5198 B12R2.1317 Cc1cc(F)ccc1[C@@H]2CO2 Amb25357892 [0,2,0,0,0,0|0,0,0]=2 5199 B12R2.1317 Cc1cc(F)ccc1[C@H]2CO2 Amb25847154 [0,2,0,0,0,0|0,0,0]=2 5200 B12R2.1317 Cc1cc(F)ncc1C2CC2 Amb28047335 [0,2,0,0,0,0|2,0,0]=4 5201 B12R2.1317 Cc1cc(N)ccc1C2CC2 Amb18280163 [0,2,0,0,0,0|1,0,0]=3 5202 B12R2.1317 Cc1ccc(C2CC2)c(Br)c1 Amb20617891 [0,2,0,0,0,0|1,0,0]=3 5203 B12R2.1317 Cc1ccc(C2CC2)c(C)c1 Amb26349666 [0,2,0,0,0,0|1,0,0]=3 5204 B12R2.1317 Cc1ccc(C2CC2)c(N)n1 Amb35713101 [0,2,0,0,0,0|2,0,0]=4 5205 B12R2.1317 Cc1ccc(C2CN2)c(C)c1 Amb18224253 [0,2,0,0,0,0|1,0,0]=3 5206 B12R2.1317 Cc1ccc(C2CO2)c(Br)c1 Amb26496812 [0,2,0,0,0,0|0,0,0]=2 5207 B12R2.1317 Cc1ccc(C2CO2)c(C)c1 Amb1124175 [0,2,0,0,0,0|0,0,0]=2 5208 B12R2.1317 Cc1ccc(C2CO2)c(Cl)c1 Amb30012822 [0,2,0,0,0,0|0,0,0]=2 5209 B12R2.1317 Cc1ccc(C2CO2)c(Cl)n1 Amb33259866 [0,2,0,0,0,0|1,0,0]=3 5210 B12R2.1317 Cc1ccc(C2CO2)c(F)c1 Amb33324269 [0,2,0,0,0,0|0,0,0]=2 5211 B12R2.1317 Cc1ccc([C@@H]2CO2)c(Br)c1 Amb33387496 [0,2,0,0,0,0|0,0,0]=2 5212 B12R2.1317 Cc1ccc([C@@H]2CO2)c(C)c1 Amb26935475 [0,2,0,0,0,0|0,0,0]=2 5213 B12R2.1317 Cc1ccc([C@@H]2CO2)c(Cl)c1 Amb33221812 [0,2,0,0,0,0|0,0,0]=2 5214 B12R2.1317 Cc1ccc([C@@H]2CO2)c(Cl)n1 Amb33260859 [0,2,0,0,0,0|1,0,0]=3 5215 B12R2.1317 Cc1ccc([C@@H]2CO2)c(F)c1 Amb33325592 [0,2,0,0,0,0|0,0,0]=2 5216 B12R2.1317 Cc1ccc([C@H]2CO2)c(Br)c1 Amb33387493 [0,2,0,0,0,0|0,0,0]=2 5217 B12R2.1317 Cc1ccc([C@H]2CO2)c(C)c1 Amb25028225 [0,2,0,0,0,0|0,0,0]=2 5218 B12R2.1317 Cc1ccc([C@H]2CO2)c(Cl)c1 Amb33221810 [0,2,0,0,0,0|0,0,0]=2 5219 B12R2.1317 Cc1ccc([C@H]2CO2)c(Cl)n1 Amb33260855 [0,2,0,0,0,0|1,0,0]=3 5220 B12R2.1317 Cc1ccc([C@H]2CO2)c(F)c1 Amb33325595 [0,2,0,0,0,0|0,0,0]=2 5221 B12R2.1317 Cc1cnc(C2CC2)c(C)c1 Amb27438554 [0,2,0,0,0,0|2,0,0]=4 5222 B12R2.1317 Cc1cnc(C2CC2)c(N)c1 Amb23455739 [0,2,0,0,0,0|2,0,0]=4 5223 B12R2.1317 Cc1nc(N)ccc1C2CC2 Amb27236518 [0,2,0,0,0,0|2,0,0]=4 5224 B12R2.1317 Clc1cc(Br)ccc1C2CC2 Amb20617847 [0,2,0,0,0,0|1,0,0]=3 5225 B12R2.1317 Clc1cc(Br)ccc1C2CO2 Amb26036409 [0,2,0,0,0,0|0,0,0]=2 5226 B12R2.1317 Clc1cc(Br)ccc1[C@@H]2CO2 Amb25346475 [0,2,0,0,0,0|0,0,0]=2 5227 B12R2.1317 Clc1cc(Br)ccc1[C@H]2CO2 Amb25144752 [0,2,0,0,0,0|0,0,0]=2 5228 B12R2.1317 Clc1cc(Br)ncc1C2CC2 Amb20617544 [0,2,0,0,0,0|2,0,0]=4 5229 B12R2.1317 Clc1cc(Cl)c(C2CO2)cn1 Amb33256870 [0,2,0,0,0,0|1,0,0]=3 5230 B12R2.1317 Clc1cc(Cl)c([C@@H]2CO2)cn1 Amb33259913 [0,2,0,0,0,0|1,0,0]=3 5231 B12R2.1317 Clc1cc(Cl)c([C@H]2CO2)cn1 Amb33259619 [0,2,0,0,0,0|1,0,0]=3 5232 B12R2.1317 Clc1ccc(C2CC2)c(Br)c1 Amb20617892 [0,2,0,0,0,0|1,0,0]=3 5233 B12R2.1317 Clc1ccc(C2CO2)c(Br)c1 Amb24723903 [0,2,0,0,0,0|0,0,0]=2 5234 B12R2.1317 Clc1ccc(C2CO2)c(Cl)c1 Amb9711652 [0,2,0,0,0,0|0,0,0]=2 5235 B12R2.1317 Clc1ccc([C@@H]2CO2)c(Br)c1 Amb33478800 [0,2,0,0,0,0|0,0,0]=2 5236 B12R2.1317 Clc1ccc([C@@H]2CO2)c(Cl)c1 Amb27457104 [0,2,0,0,0,0|0,0,0]=2 5237 B12R2.1317 Clc1ccc([C@H]2CO2)c(Br)c1 Amb33478799 [0,2,0,0,0,0|0,0,0]=2 5238 B12R2.1317 Clc1ccc([C@H]2CO2)c(Cl)c1 Amb26956251 [0,2,0,0,0,0|0,0,0]=2 5239 B12R2.1317 Clc1nc(Br)ccc1C2CC2 Amb28203524 [0,2,0,0,0,0|2,0,0]=4 5240 B12R2.1317 Fc1cc(Br)ccc1C2CC2 Amb20617849 [0,2,0,0,0,0|1,0,0]=3 5241 B12R2.1317 Fc1cc(Br)ccc1C2CO2 Amb25169446 [0,2,0,0,0,0|0,0,0]=2 5242 B12R2.1317 Fc1cc(Br)ccc1[C@@H]2CO2 Amb26455110 [0,2,0,0,0,0|0,0,0]=2 5243 B12R2.1317 Fc1cc(Br)ccc1[C@H]2CO2 Amb25256819 [0,2,0,0,0,0|0,0,0]=2 5244 B12R2.1317 Fc1cc(Cl)ccc1C2CC2 Amb32695923 [0,2,0,0,0,0|1,0,0]=3 5245 B12R2.1317 Fc1cc(Cl)ccc1C2CO2 Amb25955804 [0,2,0,0,0,0|0,0,0]=2 5246 B12R2.1317 Fc1cc(Cl)ccc1[C@@H]2CO2 Amb33052777 [0,2,0,0,0,0|0,0,0]=2 5247 B12R2.1317 Fc1cc(Cl)ccc1[C@H]2CO2 Amb33052032 [0,2,0,0,0,0|0,0,0]=2 5248 B12R2.1317 Fc1cc(I)c(C2CC2)cn1 Amb22749764 [0,2,0,0,0,0|2,0,0]=4 5249 B12R2.1317 Fc1ccc(C2CC2)c(Br)c1 Amb20617893 [0,2,0,0,0,0|1,0,0]=3 5250 B12R2.1317 Fc1ccc(C2CC2)c(Cl)c1 Amb33357009 [0,2,0,0,0,0|1,0,0]=3 5251 B12R2.1317 Fc1ccc(C2CC2)c(F)c1 Amb25341076 [0,2,0,0,0,0|1,0,0]=3 5252 B12R2.1317 Fc1ccc(C2CN2)c(F)c1 Amb18862516 [0,2,0,0,0,0|1,0,0]=3 5253 B12R2.1317 Fc1ccc(C2CO2)c(Br)c1 Amb26496398 [0,2,0,0,0,0|0,0,0]=2 5254 B12R2.1317 Fc1ccc(C2CO2)c(Cl)c1 Amb24485929 [0,2,0,0,0,0|0,0,0]=2 5255 B12R2.1317 Fc1ccc(C2CO2)c(F)c1 Amb9711083 [0,2,0,0,0,0|0,0,0]=2 5256 B12R2.1317 Fc1ccc([C@@H]2CO2)c(Br)c1 Amb24334679 [0,2,0,0,0,0|0,0,0]=2 5257 B12R2.1317 Fc1ccc([C@@H]2CO2)c(Cl)c1 Amb24613622 [0,2,0,0,0,0|0,0,0]=2 5258 B12R2.1317 Fc1ccc([C@@H]2CO2)c(F)c1 Amb26889037 [0,2,0,0,0,0|0,0,0]=2 5259 B12R2.1317 Fc1ccc([C@H]2CO2)c(Br)c1 Amb25920793 [0,2,0,0,0,0|0,0,0]=2 5260 B12R2.1317 Fc1ccc([C@H]2CO2)c(Cl)c1 Amb25880105 [0,2,0,0,0,0|0,0,0]=2 5261 B12R2.1317 Fc1ccc([C@H]2CO2)c(F)c1 Amb25922894 [0,2,0,0,0,0|0,0,0]=2 5262 B12R2.1317 Nc1cc(Br)c(C2CC2)cn1 Amb24319540 [0,2,0,0,0,0|2,0,0]=4 5263 B12R2.1317 Nc1cc(Br)ccc1C2CC2 Amb4302534 [0,2,0,0,0,0|1,0,0]=3 5264 B12R2.1317 Nc1cc(Br)ccc1C2CC2 Amb6466296 [0,2,0,0,0,0|1,0,0]=3 5265 B12R2.1317 Nc1cc(Br)cnc1C2CC2 Amb24320805 [0,2,0,0,0,0|2,0,0]=4 5266 B12R2.1317 Nc1cc(Br)ncc1C2CC2 Amb24319618 [0,2,0,0,0,0|2,0,0]=4 5267 B12R2.1317 Nc1cc(Cl)c(C2CC2)cn1 Amb24319593 [0,2,0,0,0,0|2,0,0]=4 5268 B12R2.1317 Nc1cc(Cl)cnc1C2CC2 Amb27661722 [0,2,0,0,0,0|2,0,0]=4 5269 B12R2.1317 Nc1cc(F)ccc1C2CC2 Amb26373416 [0,2,0,0,0,0|1,0,0]=3 5270 B12R2.1317 Nc1ccc(C2CC2)c(Br)c1 Amb20617895 [0,2,0,0,0,0|1,0,0]=3 5271 B12R2.1317 Nc1ccc(C2CC2)c(Br)n1 Amb24319256 [0,2,0,0,0,0|2,0,0]=4 5272 B12R2.1317 Nc1ccc(C2CC2)c(Cl)c1 Amb24321161 [0,2,0,0,0,0|1,0,0]=3 5273 B12R2.1317 Nc1ccc(C2CC2)c(F)c1 Amb25681303 [0,2,0,0,0,0|1,0,0]=3 5274 B12R2.1317 Nc1ccc(C2CC2)c(F)c1 Amb32729370 [0,2,0,0,0,0|1,0,0]=3 5275 B12R2.1317 Nc1cnc(C2CC2)c(Br)c1 Amb24320493 [0,2,0,0,0,0|2,0,0]=4 5276 B12R2.1317 Nc1cnc(C2CC2)c(Cl)c1 Amb27240328 [0,2,0,0,0,0|2,0,0]=4 5277 B12R2.1317 Nc1cnc(C2CC2)c(F)c1 Amb27191609 [0,2,0,0,0,0|2,0,0]=4 5278 B12R2.1317 O=C1C=C(Br)C=CN1C2CC2 Amb25691044 [0,2,0,0,0,0|2,0,0]=4 5279 B12R2.1317 Oc1cc(Br)ccc1C2CC2 Amb25319944 [0,2,0,0,0,0|1,0,0]=3 5280 B12R2.1317 Oc1cc(Cl)cnc1C2CC2 Amb32657536 [0,2,0,0,0,0|2,0,0]=4 5281 B12R2.1317 Oc1cc(F)ccc1C2CC2 Amb25365925 [0,2,0,0,0,0|1,0,0]=3 5282 B12R2.1317 Oc1ccc(C2CC2)c(F)c1 Amb28398443 [0,2,0,0,0,0|1,0,0]=3 5283 B12R2.1317 Oc1cnc(C2CC2)c(Cl)c1 Amb23401491 [0,2,0,0,0,0|2,0,0]=4 5284 B12R2.43 BrCc1cccc(C2CC2)c1 Amb22492466 [0,2,0,0,0,0|1,0,0]=3 5285 B12R2.43 C#Cc1cccc(C2CC2)c1 Amb28423627 [0,2,0,0,0,0|1,0,0]=3 5286 B12R2.43 C#Cc1cccc(C2CC2)n1 Amb26867190 [0,2,0,0,0,0|2,0,0]=4 5287 B12R2.43 C#Cc1cccc(C2CO2)c1 Amb16192468 [0,2,0,0,0,0|0,0,0]=2 5288 B12R2.43 C#Cc1cccc([C@@H]2CO2)c1 Amb32875255 [0,2,0,0,0,0|0,0,0]=2 5289 B12R2.43 C#Cc1cccc([C@H]2CO2)c1 Amb32875256 [0,2,0,0,0,0|0,0,0]=2 5290 B12R2.43 C#Cc1ccnc(C2CC2)c1 Amb25056019 [0,2,0,0,0,0|2,0,0]=4 5291 B12R2.43 C=Cc1cc(C2CC2)ccn1 Amb25715508 [0,2,0,0,0,0|2,0,0]=4 5292 B12R2.43 C=Cc1cccc(C2CC2)c1 Amb24056363 [0,2,0,0,0,0|1,0,0]=3 5293 B12R2.43 C=Cc1cccc(C2CC2)n1 Amb26503719 [0,2,0,0,0,0|2,0,0]=4 5294 B12R2.43 C=Cc1ccnc(C2CC2)c1 Amb24683765 [0,2,0,0,0,0|2,0,0]=4 5295 B12R2.43 C=Cc1cncc(C2CC2)c1 Amb25721042 [0,2,0,0,0,0|2,0,0]=4 5296 B12R2.43 CCc1cccc(C2CO2)c1 Amb32876488 [0,2,0,0,0,0|0,0,0]=2 5297 B12R2.43 CCc1cccc([C@@H]2CO2)c1 Amb32873837 [0,2,0,0,0,0|0,0,0]=2 5298 B12R2.43 CCc1cccc([C@H]2CO2)c1 Amb32873838 [0,2,0,0,0,0|0,0,0]=2 5299 B12R2.43 CNc1ccnc(C2CC2)c1 Amb28984180 [0,2,0,0,0,0|2,0,0]=4 5300 B12R2.43 COc1cc(C2CO2)ccn1 Amb25737020 [0,2,0,0,0,0|1,0,0]=3 5301 B12R2.43 COc1cc([C@@H]2CO2)ccn1 Amb33224939 [0,2,0,0,0,0|1,0,0]=3 5302 B12R2.43 COc1cc([C@H]2CO2)ccn1 Amb32730002 [0,2,0,0,0,0|1,0,0]=3 5303 B12R2.43 COc1cccc(C2CC2)c1 Amb6768412 [0,2,0,0,0,0|1,0,0]=3 5304 B12R2.43 COc1cccc(C2CN2)c1 Amb18224268 [0,2,0,0,0,0|1,0,0]=3 5305 B12R2.43 COc1cccc(C2CO2)c1 Amb9707197 [0,2,0,0,0,0|0,0,0]=2 5306 B12R2.43 COc1cccc(C2CO2)n1 Amb33202182 [0,2,0,0,0,0|1,0,0]=3 5307 B12R2.43 COc1cccc([C@@H]2CO2)c1 Amb25677783 [0,2,0,0,0,0|0,0,0]=2 5308 B12R2.43 COc1cccc([C@@H]2CO2)n1 Amb33201501 [0,2,0,0,0,0|1,0,0]=3 5309 B12R2.43 COc1cccc([C@H]2CO2)c1 Amb26633145 [0,2,0,0,0,0|0,0,0]=2 5310 B12R2.43 COc1cccc([C@H]2CO2)n1 Amb33201502 [0,2,0,0,0,0|1,0,0]=3 5311 B12R2.43 COc1ccnc(C2CO2)c1 Amb33319048 [0,2,0,0,0,0|1,0,0]=3 5312 B12R2.43 COc1ccnc([C@@H]2CO2)c1 Amb33319517 [0,2,0,0,0,0|1,0,0]=3 5313 B12R2.43 COc1ccnc([C@H]2CO2)c1 Amb33226844 [0,2,0,0,0,0|1,0,0]=3 5314 B12R2.43 COc1cncc(C2CC2)c1 Amb26606823 [0,2,0,0,0,0|2,0,0]=4 5315 B12R2.43 COc1cncc(C2CO2)c1 Amb33223858 [0,2,0,0,0,0|1,0,0]=3 5316 B12R2.43 COc1cncc([C@@H]2CO2)c1 Amb32873875 [0,2,0,0,0,0|1,0,0]=3 5317 B12R2.43 COc1cncc([C@H]2CO2)c1 Amb32873876 [0,2,0,0,0,0|1,0,0]=3 5318 B12R2.43 CSc1cccc(C2CO2)c1 Amb33143762 [0,2,0,0,0,0|0,0,0]=2 5319 B12R2.43 CSc1cccc([C@@H]2CO2)c1 Amb33147719 [0,2,0,0,0,0|0,0,0]=2 5320 B12R2.43 CSc1cccc([C@H]2CO2)c1 Amb33147720 [0,2,0,0,0,0|0,0,0]=2 5321 B12R2.43 ClCc1cccc(C2CC2)c1 Amb22011714 [0,2,0,0,0,0|1,0,0]=3 5322 B12R2.43 ClCc1ccnc(C2CC2)c1 Amb27753822 [0,2,0,0,0,0|2,0,0]=4 5323 B12R2.43 ClCc1cncc(C2CC2)c1 Amb25360856 [0,2,0,0,0,0|2,0,0]=4 5324 B12R2.43 N#Cc1cc(C2CC2)ccn1 Amb24486981 [0,2,0,0,0,0|2,0,0]=4 5325 B12R2.43 N#Cc1cccc(C2CO2)c1 Amb33545181 [0,2,0,0,0,0|0,0,0]=2 5326 B12R2.43 N#Cc1cccc([C@@H]2CO2)c1 Amb26655442 [0,2,0,0,0,0|0,0,0]=2 5327 B12R2.43 N#Cc1cccc([C@H]2CO2)c1 Amb26611884 [0,2,0,0,0,0|0,0,0]=2 5328 B12R2.43 N#Cc1ccnc(C2CC2)c1 Amb19892366 [0,2,0,0,0,0|2,0,0]=4 5329 B12R2.43 N#[N+]c1cccc(C2CC2)c1 Amb35721651 [0,2,0,0,0,0|1,0,0]=3 5330 B12R2.43 NCc1cc(C2CC2)ccn1 Amb18202207 [0,2,0,0,0,0|2,0,0]=4 5331 B12R2.43 NCc1cccc(C2CC2)c1 Amb18286531 [0,2,0,0,0,0|1,0,0]=3 5332 B12R2.43 NCc1cccc(C2CC2)c1 Amb31217509 [0,2,0,0,0,0|1,0,0]=3 5333 B12R2.43 NCc1cccc(C2CC2)n1 Amb18202206 [0,2,0,0,0,0|2,0,0]=4 5334 B12R2.43 NCc1ccnc(C2CC2)c1 Amb18831358 [0,2,0,0,0,0|2,0,0]=4 5335 B12R2.43 NNc1cccc(C2CC2)c1 Amb29865098 [0,2,0,0,0,0|1,0,0]=3 5336 B12R2.43 O=Cc1cccc(C2CC2)c1 Amb9768835 [0,2,0,0,0,0|1,0,0]=3 5337 B12R2.43 O=Cc1cccc(C2CC2)n1 Amb22371510 [0,2,0,0,0,0|2,0,0]=4 5338 B12R2.43 O=Cc1cccc(N2CC2)c1 Amb24085107 [0,2,0,0,0,0|2,0,0]=4 5339 B12R2.43 O=Cc1ccnc(C2CC2)c1 Amb24059387 [0,2,0,0,0,0|2,0,0]=4 5340 B12R2.43 O=Cc1cncc(C2CC2)c1 Amb22276749 [0,2,0,0,0,0|2,0,0]=4 5341 B12R2.43 OCc1cccc(C2CC2)c1 Amb9769906 [0,2,0,0,0,0|1,0,0]=3 5342 B12R2.43 OCc1cccc(N2CC2)c1 Amb24069048 [0,2,0,0,0,0|2,0,0]=4 5343 B12R2.43 SCc1cccc(C2CC2)c1 Amb28050922 [0,2,0,0,0,0|1,0,0]=3 5344 B12R2.43 [C-]#[N+]c1cccc(C2CC2)c1 Amb33067951 [0,2,0,0,0,0|1,0,0]=3 5345 B12R2.81 Brc1cccc(C2CC2)c1Br Amb24321223 [0,2,0,0,0,0|1,0,0]=3 5346 B12R2.81 Brc1ccnc(C2CC2)c1Br Amb24320277 [0,2,0,0,0,0|2,0,0]=4 5347 B12R2.81 Brc1nccc(C2CC2)c1Br Amb24320278 [0,2,0,0,0,0|2,0,0]=4 5348 B12R2.81 Cc1c(Br)cccc1C2CO2 Amb33389345 [0,2,0,0,0,0|0,0,0]=2 5349 B12R2.81 Cc1c(Br)cccc1[C@@H]2CO2 Amb33478015 [0,2,0,0,0,0|0,0,0]=2 5350 B12R2.81 Cc1c(Br)cccc1[C@H]2CO2 Amb33227853 [0,2,0,0,0,0|0,0,0]=2 5351 B12R2.81 Cc1c(Br)cncc1C2CC2 Amb28203877 [0,2,0,0,0,0|2,0,0]=4 5352 B12R2.81 Cc1c(Cl)cccc1C2CC2 Amb24321225 [0,2,0,0,0,0|1,0,0]=3 5353 B12R2.81 Cc1c(F)cccc1C2CO2 Amb33428480 [0,2,0,0,0,0|0,0,0]=2 5354 B12R2.81 Cc1c(F)cccc1[C@@H]2CO2 Amb33428016 [0,2,0,0,0,0|0,0,0]=2 5355 B12R2.81 Cc1c(F)cccc1[C@H]2CO2 Amb33428017 [0,2,0,0,0,0|0,0,0]=2 5356 B12R2.81 Cc1c(N)cccc1C2CC2 Amb27860342 [0,2,0,0,0,0|1,0,0]=3 5357 B12R2.81 Cc1c(O)cccc1C2CO2 Amb27176277 [0,2,0,0,0,0|0,0,0]=2 5358 B12R2.81 Cc1cccc(C2CC2)c1Br Amb24321216 [0,2,0,0,0,0|1,0,0]=3 5359 B12R2.81 Cc1cccc(C2CC2)c1N Amb33623193 [0,2,0,0,0,0|1,0,0]=3 5360 B12R2.81 Cc1cccc(C2CO2)c1C Amb27153983 [0,2,0,0,0,0|0,0,0]=2 5361 B12R2.81 Cc1cccc(C2CO2)c1Cl Amb27839893 [0,2,0,0,0,0|0,0,0]=2 5362 B12R2.81 Cc1cccc(C2CO2)c1F Amb26041387 [0,2,0,0,0,0|0,0,0]=2 5363 B12R2.81 Cc1cccc(C2CO2)c1O Amb27256608 [0,2,0,0,0,0|0,0,0]=2 5364 B12R2.81 Cc1cccc([C@@H]2CO2)c1C Amb25851790 [0,2,0,0,0,0|0,0,0]=2 5365 B12R2.81 Cc1cccc([C@@H]2CO2)c1F Amb33323898 [0,2,0,0,0,0|0,0,0]=2 5366 B12R2.81 Cc1cccc([C@H]2CO2)c1C Amb26323395 [0,2,0,0,0,0|0,0,0]=2 5367 B12R2.81 Cc1cccc([C@H]2CO2)c1F Amb33323899 [0,2,0,0,0,0|0,0,0]=2 5368 B12R2.81 Cc1ccnc(C2CC2)c1N Amb23455741 [0,2,0,0,0,0|2,0,0]=4 5369 B12R2.81 Clc1c(Br)cncc1C2CC2 Amb25920662 [0,2,0,0,0,0|2,0,0]=4 5370 B12R2.81 Clc1cccc(C2CC2)c1Br Amb24321221 [0,2,0,0,0,0|1,0,0]=3 5371 B12R2.81 Clc1cccc(C2CC2)c1Cl Amb24321227 [0,2,0,0,0,0|1,0,0]=3 5372 B12R2.81 Clc1cccc(C2CO2)c1Cl Amb18325132 [0,2,0,0,0,0|0,0,0]=2 5373 B12R2.81 Clc1cccc([C@@H]2CO2)c1Cl Amb25332653 [0,2,0,0,0,0|0,0,0]=2 5374 B12R2.81 Clc1cccc([C@H]2CO2)c1Cl Amb25357893 [0,2,0,0,0,0|0,0,0]=2 5375 B12R2.81 Clc1nccc(C2CC2)c1Cl Amb26530663 [0,2,0,0,0,0|2,0,0]=4 5376 B12R2.81 Fc1c(Br)cccc1C2CC2 Amb33098466 [0,2,0,0,0,0|1,0,0]=3 5377 B12R2.81 Fc1c(Br)cccc1C2CO2 Amb26556981 [0,2,0,0,0,0|0,0,0]=2 5378 B12R2.81 Fc1c(Br)cccc1[C@@H]2CO2 Amb33450574 [0,2,0,0,0,0|0,0,0]=2 5379 B12R2.81 Fc1c(Br)cccc1[C@H]2CO2 Amb33450571 [0,2,0,0,0,0|0,0,0]=2 5380 B12R2.81 Fc1c(Br)ccnc1C2CC2 Amb24319060 [0,2,0,0,0,0|2,0,0]=4 5381 B12R2.81 Fc1c(C2CC2)ccnc1Br Amb24318925 [0,2,0,0,0,0|2,0,0]=4 5382 B12R2.81 Fc1c(Cl)cccc1C2CC2 Amb32695965 [0,2,0,0,0,0|1,0,0]=3 5383 B12R2.81 Fc1c(Cl)cccc1C2CO2 Amb27947536 [0,2,0,0,0,0|0,0,0]=2 5384 B12R2.81 Fc1c(Cl)cccc1[C@@H]2CO2 Amb33223029 [0,2,0,0,0,0|0,0,0]=2 5385 B12R2.81 Fc1c(Cl)cccc1[C@H]2CO2 Amb33223013 [0,2,0,0,0,0|0,0,0]=2 5386 B12R2.81 Fc1cccc(C2CC2)c1Br Amb24321220 [0,2,0,0,0,0|1,0,0]=3 5387 B12R2.81 Fc1cccc(C2CO2)c1Br Amb25987930 [0,2,0,0,0,0|0,0,0]=2 5388 B12R2.81 Fc1cccc(C2CO2)c1F Amb25923204 [0,2,0,0,0,0|0,0,0]=2 5389 B12R2.81 Fc1cccc([C@@H]2CO2)c1Br Amb33477983 [0,2,0,0,0,0|0,0,0]=2 5390 B12R2.81 Fc1cccc([C@@H]2CO2)c1F Amb24722029 [0,2,0,0,0,0|0,0,0]=2 5391 B12R2.81 Fc1cccc([C@H]2CO2)c1Br Amb33477979 [0,2,0,0,0,0|0,0,0]=2 5392 B12R2.81 Fc1cccc([C@H]2CO2)c1F Amb24723176 [0,2,0,0,0,0|0,0,0]=2 5393 B12R2.81 Fc1nccc(C2CC2)c1Br Amb24318945 [0,2,0,0,0,0|2,0,0]=4 5394 B12R2.81 NC1=CC=CN(C2CC2)C1=O Amb18221720 [0,2,0,0,0,0|2,0,0]=4 5395 B12R2.81 Nc1c(C2CC2)ccnc1Cl Amb27778645 [0,2,0,0,0,0|2,0,0]=4 5396 B12R2.81 Nc1c(Cl)cccc1C2CC2 Amb24321228 [0,2,0,0,0,0|1,0,0]=3 5397 B12R2.81 Nc1c(Cl)ccnc1C2CC2 Amb27810934 [0,2,0,0,0,0|2,0,0]=4 5398 B12R2.81 Nc1c(F)cccc1C2CC2 Amb26353597 [0,2,0,0,0,0|1,0,0]=3 5399 B12R2.81 Nc1cccc(C2CC2)c1Br Amb24321224 [0,2,0,0,0,0|1,0,0]=3 5400 B12R2.81 Nc1cccc(C2CC2)c1F Amb24393458 [0,2,0,0,0,0|1,0,0]=3 5401 B12R2.81 Nc1nccc(C2CC2)c1Br Amb27147474 [0,2,0,0,0,0|2,0,0]=4 5402 B12R2.81 O=C1C(O)=CC=CN1C2CC2 Amb27817551 [0,2,0,0,0,0|2,0,0]=4 5403 B12R2.81 Oc1c(Br)cccc1C2CC2 Amb26936531 [0,2,0,0,0,0|1,0,0]=3 5404 B12R2.81 Oc1c(Cl)cccc1C2CC2 Amb27945685 [0,2,0,0,0,0|1,0,0]=3 5405 B12R2.81 Oc1cccc(C2CO2)c1O Amb27839939 [0,2,0,0,0,0|0,0,0]=2 5406 B12R2.1282 CC1(C2=CC(=O)C=CN2)CC1 Amb24486050 [0,2,0,0,0,0|2,0,0]=4 5407 B12R2.1282 CC1(C2=CC(=O)C=CO2)CC1 Amb27823430 [0,2,0,0,0,0|2,0,0]=4 5408 B12R2.1282 CC1(c2cc(Cl)ccn2)CC1 Amb25177540 [0,2,0,0,0,0|2,0,0]=4 5409 B12R2.1282 CC1(c2cc(F)ccn2)CO1 Amb33320259 [0,2,0,0,0,0|1,0,0]=3 5410 B12R2.1282 CC1(c2cccc(Br)c2)CC1 Amb26983023 [0,2,0,0,0,0|1,0,0]=3 5411 B12R2.1282 CC1(c2cccc(Br)c2)CO1 Amb26952448 [0,2,0,0,0,0|0,0,0]=2 5412 B12R2.1282 CC1(c2cccc(Br)n2)CO1 Amb33433139 [0,2,0,0,0,0|1,0,0]=3 5413 B12R2.1282 CC1(c2cccc(Cl)c2)CC1 Amb25981117 [0,2,0,0,0,0|1,0,0]=3 5414 B12R2.1282 CC1(c2cccc(Cl)c2)CO1 Amb18182720 [0,2,0,0,0,0|0,0,0]=2 5415 B12R2.1282 CC1(c2cccc(Cl)n2)CO1 Amb33222418 [0,2,0,0,0,0|1,0,0]=3 5416 B12R2.1282 CC1(c2cccc(F)c2)CC1 Amb28198950 [0,2,0,0,0,0|1,0,0]=3 5417 B12R2.1282 CC1(c2cccc(F)c2)CO1 Amb18181718 [0,2,0,0,0,0|0,0,0]=2 5418 B12R2.1282 CC1(c2cccc(I)c2)CC1 Amb28320874 [0,2,0,0,0,0|1,0,0]=3 5419 B12R2.1282 CC1(c2cccc(N)c2)CC1 Amb25992380 [0,2,0,0,0,0|1,0,0]=3 5420 B12R2.1282 CC1(c2cccc(N)c2)CC1 Amb31156504 [0,2,0,0,0,0|1,0,0]=3 5421 B12R2.1282 CC1(c2cccc(O)c2)CC1 Amb32938641 [0,2,0,0,0,0|1,0,0]=3 5422 B12R2.1282 CC1(c2ccnc(Br)c2)CC1 Amb27423957 [0,2,0,0,0,0|2,0,0]=4 5423 B12R2.1282 CC1(c2ccnc(Cl)c2)CO1 Amb25833518 [0,2,0,0,0,0|1,0,0]=3 5424 B12R2.1282 CC1(c2ccnc(F)c2)CO1 Amb27150771 [0,2,0,0,0,0|1,0,0]=3 5425 B12R2.1282 CC1(c2cncc(Br)c2)CO1 Amb23586060 [0,2,0,0,0,0|1,0,0]=3 5426 B12R2.1282 CC1(c2cncc(F)c2)CO1 Amb33196268 [0,2,0,0,0,0|1,0,0]=3 5427 B12R2.1282 Cc1cc(C2(C)CO2)ccn1 Amb32733043 [0,2,0,0,0,0|1,0,0]=3 5428 B12R2.1282 Cc1cc(C2(N)CC2)ccn1 Amb26334278 [0,2,0,0,0,0|2,0,0]=4 5429 B12R2.1282 Cc1cc(C2(O)CC2)ccn1 Amb24421594 [0,2,0,0,0,0|2,0,0]=4 5430 B12R2.1282 Cc1cccc(C2(C)CC2)c1 Amb27229153 [0,2,0,0,0,0|1,0,0]=3 5431 B12R2.1282 Cc1cccc(C2(C)CO2)c1 Amb26953125 [0,2,0,0,0,0|0,0,0]=2 5432 B12R2.1282 Cc1cccc(C2(C)CO2)n1 Amb33199915 [0,2,0,0,0,0|1,0,0]=3 5433 B12R2.1282 Cc1cccc(C2(F)CC2)c1 Amb27633464 [0,2,0,0,0,0|1,0,0]=3 5434 B12R2.1282 Cc1cccc(C2(N)CC2)c1 Amb2721357 [0,2,0,0,0,0|1,0,0]=3 5435 B12R2.1282 Cc1cccc(C2(N)CC2)c1 Amb8997032 [0,2,0,0,0,0|1,0,0]=3 5436 B12R2.1282 Cc1cccc(C2(N)CC2)n1 Amb24425384 [0,2,0,0,0,0|2,0,0]=4 5437 B12R2.1282 Cc1cccc(C2(O)CC2)n1 Amb26494178 [0,2,0,0,0,0|2,0,0]=4 5438 B12R2.1282 Cc1ccnc(C2(C)CO2)c1 Amb33318069 [0,2,0,0,0,0|1,0,0]=3 5439 B12R2.1282 Cc1ccnc(C2(N)CC2)c1 Amb24460941 [0,2,0,0,0,0|2,0,0]=4 5440 B12R2.1282 Cc1ccnc(C2(O)CC2)c1 Amb33318410 [0,2,0,0,0,0|2,0,0]=4 5441 B12R2.1282 Cc1cncc(C2(C)CO2)c1 Amb33317988 [0,2,0,0,0,0|1,0,0]=3 5442 B12R2.1282 Cc1cncc(C2(N)CC2)c1 Amb26586203 [0,2,0,0,0,0|2,0,0]=4 5443 B12R2.1282 Cc1cncc(C2(O)CC2)c1 Amb25839523 [0,2,0,0,0,0|2,0,0]=4 5444 B12R2.1282 FC1(c2cccc(Br)c2)CC1 Amb28341883 [0,2,0,0,0,0|1,0,0]=3 5445 B12R2.1282 NC1(c2cc(Br)ccn2)CC1 Amb27667948 [0,2,0,0,0,0|2,0,0]=4 5446 B12R2.1282 NC1(c2cc(Cl)ccn2)CC1 Amb27974878 [0,2,0,0,0,0|2,0,0]=4 5447 B12R2.1282 NC1(c2cc(F)ccn2)CC1 Amb26880368 [0,2,0,0,0,0|2,0,0]=4 5448 B12R2.1282 NC1(c2cccc(Br)c2)CC1 Amb33548088 [0,2,0,0,0,0|1,0,0]=3 5449 B12R2.1282 NC1(c2cccc(Br)c2)CC1 Amb8997041 [0,2,0,0,0,0|1,0,0]=3 5450 B12R2.1282 NC1(c2cccc(Br)n2)CC1 Amb28135430 [0,2,0,0,0,0|2,0,0]=4 5451 B12R2.1282 NC1(c2cccc(Cl)c2)CC1 Amb33548114 [0,2,0,0,0,0|1,0,0]=3 5452 B12R2.1282 NC1(c2cccc(Cl)c2)CC1 Amb5753661 [0,2,0,0,0,0|1,0,0]=3 5453 B12R2.1282 NC1(c2cccc(Cl)n2)CC1 Amb25114250 [0,2,0,0,0,0|2,0,0]=4 5454 B12R2.1282 NC1(c2cccc(F)c2)CC1 Amb33548115 [0,2,0,0,0,0|1,0,0]=3 5455 B12R2.1282 NC1(c2cccc(F)c2)CC1 Amb8840558 [0,2,0,0,0,0|1,0,0]=3 5456 B12R2.1282 NC1(c2cccc(F)n2)CC1 Amb24485774 [0,2,0,0,0,0|2,0,0]=4 5457 B12R2.1282 NC1(c2cccc(I)c2)CC1 Amb24093257 [0,2,0,0,0,0|1,0,0]=3 5458 B12R2.1282 NC1(c2cccc(I)c2)CC1 Amb24093258 [0,2,0,0,0,0|1,0,0]=3 5459 B12R2.1282 NC1(c2cccc(I)n2)CC1 Amb27823164 [0,2,0,0,0,0|2,0,0]=4 5460 B12R2.1282 NC1(c2cccc(O)c2)CC1 Amb25809427 [0,2,0,0,0,0|1,0,0]=3 5461 B12R2.1282 NC1(c2ccnc(Br)c2)CC1 Amb27866334 [0,2,0,0,0,0|2,0,0]=4 5462 B12R2.1282 NC1(c2ccnc(Cl)c2)CC1 Amb26872658 [0,2,0,0,0,0|2,0,0]=4 5463 B12R2.1282 NC1(c2ccnc(F)c2)CC1 Amb27473408 [0,2,0,0,0,0|2,0,0]=4 5464 B12R2.1282 NC1(c2cncc(Br)c2)CC1 Amb26621131 [0,2,0,0,0,0|2,0,0]=4 5465 B12R2.1282 NC1(c2cncc(Br)c2)CC1 Amb31308444 [0,2,0,0,0,0|2,0,0]=4 5466 B12R2.1282 NC1(c2cncc(F)c2)CC1 Amb24712317 [0,2,0,0,0,0|2,0,0]=4 5467 B12R2.1282 Nc1cccc(C2(N)CC2)c1 Amb27593892 [0,2,0,0,0,0|1,0,0]=3 5468 B12R2.1282 Nc1cccc(C2(O)CC2)c1 Amb28127298 [0,2,0,0,0,0|1,0,0]=3 5469 B12R2.1282 OC1(c2cc(Cl)ccn2)CC1 Amb25982388 [0,2,0,0,0,0|2,0,0]=4 5470 B12R2.1282 OC1(c2cc(F)ccn2)CC1 Amb33414997 [0,2,0,0,0,0|2,0,0]=4 5471 B12R2.1282 OC1(c2cccc(Br)c2)CC1 Amb25067110 [0,2,0,0,0,0|1,0,0]=3 5472 B12R2.1282 OC1(c2cccc(Br)n2)CC1 Amb26930039 [0,2,0,0,0,0|2,0,0]=4 5473 B12R2.1282 OC1(c2cccc(Cl)c2)CC1 Amb18182717 [0,2,0,0,0,0|1,0,0]=3 5474 B12R2.1282 OC1(c2cccc(Cl)n2)CC1 Amb27636969 [0,2,0,0,0,0|2,0,0]=4 5475 B12R2.1282 OC1(c2cccc(F)c2)CC1 Amb18181713 [0,2,0,0,0,0|1,0,0]=3 5476 B12R2.1282 OC1(c2cccc(F)n2)CC1 Amb27194852 [0,2,0,0,0,0|2,0,0]=4 5477 B12R2.1282 OC1(c2cccc(I)c2)CC1 Amb25224590 [0,2,0,0,0,0|1,0,0]=3 5478 B12R2.1282 OC1(c2ccnc(Cl)c2)CC1 Amb27176835 [0,2,0,0,0,0|2,0,0]=4 5479 B12R2.1282 OC1(c2cncc(Br)c2)CC1 Amb26620434 [0,2,0,0,0,0|2,0,0]=4 5480 B12R2.1282 OC1(c2cncc(F)c2)CC1 Amb25921020 [0,2,0,0,0,0|2,0,0]=4 5481 B12R2.1282 Oc1cccc(C2(O)CC2)c1 Amb25209554 [0,2,0,0,0,0|1,0,0]=3 5482 B12R2.1316 Brc1cc(C2CC2)c(Br)cn1 Amb24319741 [0,2,0,0,0,0|2,0,0]=4 5483 B12R2.1316 Brc1ccc(Br)c(C2CC2)n1 Amb28061669 [0,2,0,0,0,0|2,0,0]=4 5484 B12R2.1316 Brc1ccc(Br)c(C2CO2)c1 Amb33336996 [0,2,0,0,0,0|0,0,0]=2 5485 B12R2.1316 Brc1ccc(Br)c([C@@H]2CO2)c1 Amb33333843 [0,2,0,0,0,0|0,0,0]=2 5486 B12R2.1316 Brc1ccc(Br)c([C@H]2CO2)c1 Amb33484733 [0,2,0,0,0,0|0,0,0]=2 5487 B12R2.1316 Brc1cnc(Br)c(C2CO2)c1 Amb33482253 [0,2,0,0,0,0|1,0,0]=3 5488 B12R2.1316 Brc1cnc(Br)c([C@@H]2CO2)c1 Amb33007438 [0,2,0,0,0,0|1,0,0]=3 5489 B12R2.1316 Brc1cnc(Br)c([C@H]2CO2)c1 Amb33007435 [0,2,0,0,0,0|1,0,0]=3 5490 B12R2.1316 Cc1ccc(Br)c(C2CC2)c1 Amb20617884 [0,2,0,0,0,0|1,0,0]=3 5491 B12R2.1316 Cc1ccc(Br)c(C2CO2)c1 Amb33227826 [0,2,0,0,0,0|0,0,0]=2 5492 B12R2.1316 Cc1ccc(Br)c([C@@H]2CO2)c1 Amb33478675 [0,2,0,0,0,0|0,0,0]=2 5493 B12R2.1316 Cc1ccc(Br)c([C@H]2CO2)c1 Amb33478624 [0,2,0,0,0,0|0,0,0]=2 5494 B12R2.1316 Cc1ccc(Br)cc1C2CC2 Amb20617861 [0,2,0,0,0,0|1,0,0]=3 5495 B12R2.1316 Cc1ccc(Br)cc1C2CO2 Amb33450326 [0,2,0,0,0,0|0,0,0]=2 5496 B12R2.1316 Cc1ccc(Br)cc1[C@@H]2CO2 Amb33387055 [0,2,0,0,0,0|0,0,0]=2 5497 B12R2.1316 Cc1ccc(Br)cc1[C@H]2CO2 Amb33387052 [0,2,0,0,0,0|0,0,0]=2 5498 B12R2.1316 Cc1ccc(C)c(C2CN2)c1 Amb18224252 [0,2,0,0,0,0|1,0,0]=3 5499 B12R2.1316 Cc1ccc(C)c(C2CO2)c1 Amb1135491 [0,2,0,0,0,0|0,0,0]=2 5500 B12R2.1316 Cc1ccc(C)c([C@@H]2CO2)c1 Amb27184147 [0,2,0,0,0,0|0,0,0]=2 5501 B12R2.1316 Cc1ccc(C)c([C@H]2CO2)c1 Amb24706314 [0,2,0,0,0,0|0,0,0]=2 5502 B12R2.1316 Cc1ccc(Cl)c(C2CC2)c1 Amb24321150 [0,2,0,0,0,0|1,0,0]=3 5503 B12R2.1316 Cc1ccc(Cl)c(C2CO2)c1 Amb33260086 [0,2,0,0,0,0|0,0,0]=2 5504 B12R2.1316 Cc1ccc(Cl)c([C@@H]2CO2)c1 Amb33414047 [0,2,0,0,0,0|0,0,0]=2 5505 B12R2.1316 Cc1ccc(Cl)c([C@H]2CO2)c1 Amb33414043 [0,2,0,0,0,0|0,0,0]=2 5506 B12R2.1316 Cc1ccc(F)c(C2CC2)c1 Amb32685666 [0,2,0,0,0,0|1,0,0]=3 5507 B12R2.1316 Cc1ccc(F)c(C2CO2)c1 Amb24723172 [0,2,0,0,0,0|0,0,0]=2 5508 B12R2.1316 Cc1ccc(F)c([C@@H]2CO2)c1 Amb33270791 [0,2,0,0,0,0|0,0,0]=2 5509 B12R2.1316 Cc1ccc(F)c([C@H]2CO2)c1 Amb33270254 [0,2,0,0,0,0|0,0,0]=2 5510 B12R2.1316 Cc1ccc(F)cc1C2CC2 Amb32685017 [0,2,0,0,0,0|1,0,0]=3 5511 B12R2.1316 Cc1ccc(F)cc1C2CO2 Amb26856858 [0,2,0,0,0,0|0,0,0]=2 5512 B12R2.1316 Cc1ccc(F)cc1[C@@H]2CO2 Amb33199367 [0,2,0,0,0,0|0,0,0]=2 5513 B12R2.1316 Cc1ccc(F)cc1[C@H]2CO2 Amb33199368 [0,2,0,0,0,0|0,0,0]=2 5514 B12R2.1316 Cc1cnc(Br)cc1C2CC2 Amb24319624 [0,2,0,0,0,0|2,0,0]=4 5515 B12R2.1316 Cc1cnc(N)cc1C2CC2 Amb24319642 [0,2,0,0,0,0|2,0,0]=4 5516 B12R2.1316 Cc1ncc(O)cc1C2CC2 Amb32759500 [0,2,0,0,0,0|2,0,0]=4 5517 B12R2.1316 Clc1cc(C2CO2)c(Br)cn1 Amb33477816 [0,2,0,0,0,0|1,0,0]=3 5518 B12R2.1316 Clc1cc(C2CO2)c(Cl)nn1 Amb33258858 [0,2,0,0,0,0|2,0,0]=4 5519 B12R2.1316 Clc1cc([C@@H]2CO2)c(Br)cn1 Amb33478593 [0,2,0,0,0,0|1,0,0]=3 5520 B12R2.1316 Clc1cc([C@@H]2CO2)c(Cl)nn1 Amb33258512 [0,2,0,0,0,0|2,0,0]=4 5521 B12R2.1316 Clc1cc([C@H]2CO2)c(Br)cn1 Amb33478592 [0,2,0,0,0,0|1,0,0]=3 5522 B12R2.1316 Clc1cc([C@H]2CO2)c(Cl)nn1 Amb33258508 [0,2,0,0,0,0|2,0,0]=4 5523 B12R2.1316 Clc1ccc(Br)c(C2CC2)c1 Amb20617885 [0,2,0,0,0,0|1,0,0]=3 5524 B12R2.1316 Clc1ccc(Br)c(C2CO2)c1 Amb25890747 [0,2,0,0,0,0|0,0,0]=2 5525 B12R2.1316 Clc1ccc(Br)c([C@@H]2CO2)c1 Amb33478299 [0,2,0,0,0,0|0,0,0]=2 5526 B12R2.1316 Clc1ccc(Br)c([C@H]2CO2)c1 Amb33478298 [0,2,0,0,0,0|0,0,0]=2 5527 B12R2.1316 Clc1ccc(Br)cc1C2CC2 Amb20617862 [0,2,0,0,0,0|1,0,0]=3 5528 B12R2.1316 Clc1ccc(Br)cc1C2CO2 Amb25103075 [0,2,0,0,0,0|0,0,0]=2 5529 B12R2.1316 Clc1ccc(Br)cc1[C@@H]2CO2 Amb33477650 [0,2,0,0,0,0|0,0,0]=2 5530 B12R2.1316 Clc1ccc(Br)cc1[C@H]2CO2 Amb33477647 [0,2,0,0,0,0|0,0,0]=2 5531 B12R2.1316 Clc1ccc(Cl)c(C2CC2)c1 Amb28383129 [0,2,0,0,0,0|1,0,0]=3 5532 B12R2.1316 Clc1ccc(Cl)c(C2CO2)c1 Amb9708892 [0,2,0,0,0,0|0,0,0]=2 5533 B12R2.1316 Clc1ccc(Cl)c([C@@H]2CO2)c1 Amb24400081 [0,2,0,0,0,0|0,0,0]=2 5534 B12R2.1316 Clc1ccc(Cl)c([C@H]2CO2)c1 Amb27765498 [0,2,0,0,0,0|0,0,0]=2 5535 B12R2.1316 Clc1cnc(Br)cc1C2CC2 Amb25718732 [0,2,0,0,0,0|2,0,0]=4 5536 B12R2.1316 Clc1cnc(Cl)c(C2CC2)c1 Amb27395807 [0,2,0,0,0,0|2,0,0]=4 5537 B12R2.1316 Clc1ncc(Br)cc1C2CC2 Amb27219185 [0,2,0,0,0,0|2,0,0]=4 5538 B12R2.1316 Clc1ncc(Br)cc1C2CO2 Amb33007761 [0,2,0,0,0,0|1,0,0]=3 5539 B12R2.1316 Clc1ncc(Br)cc1[C@@H]2CO2 Amb33008076 [0,2,0,0,0,0|1,0,0]=3 5540 B12R2.1316 Clc1ncc(Br)cc1[C@H]2CO2 Amb33008074 [0,2,0,0,0,0|1,0,0]=3 5541 B12R2.1316 Fc1ccc(Br)c(C2CC2)c1 Amb20617886 [0,2,0,0,0,0|1,0,0]=3 5542 B12R2.1316 Fc1ccc(Br)c(C2CO2)c1 Amb26340336 [0,2,0,0,0,0|0,0,0]=2 5543 B12R2.1316 Fc1ccc(Br)c([C@@H]2CO2)c1 Amb33009270 [0,2,0,0,0,0|0,0,0]=2 5544 B12R2.1316 Fc1ccc(Br)c([C@H]2CO2)c1 Amb33009269 [0,2,0,0,0,0|0,0,0]=2 5545 B12R2.1316 Fc1ccc(Br)cc1C2CC2 Amb20617864 [0,2,0,0,0,0|1,0,0]=3 5546 B12R2.1316 Fc1ccc(Br)cc1C2CO2 Amb27263321 [0,2,0,0,0,0|0,0,0]=2 5547 B12R2.1316 Fc1ccc(Br)cc1[C@@H]2CO2 Amb24674609 [0,2,0,0,0,0|0,0,0]=2 5548 B12R2.1316 Fc1ccc(Br)cc1[C@H]2CO2 Amb25920873 [0,2,0,0,0,0|0,0,0]=2 5549 B12R2.1316 Fc1ccc(Cl)c(C2CO2)c1 Amb25856759 [0,2,0,0,0,0|0,0,0]=2 5550 B12R2.1316 Fc1ccc(Cl)c([C@@H]2CO2)c1 Amb33485390 [0,2,0,0,0,0|0,0,0]=2 5551 B12R2.1316 Fc1ccc(Cl)c([C@H]2CO2)c1 Amb33059203 [0,2,0,0,0,0|0,0,0]=2 5552 B12R2.1316 Fc1ccc(Cl)cc1C2CC2 Amb28454349 [0,2,0,0,0,0|1,0,0]=3 5553 B12R2.1316 Fc1ccc(Cl)cc1C2CN2 Amb18862860 [0,2,0,0,0,0|1,0,0]=3 5554 B12R2.1316 Fc1ccc(Cl)cc1C2CO2 Amb18862882 [0,2,0,0,0,0|0,0,0]=2 5555 B12R2.1316 Fc1ccc(F)c(C2CN2)c1 Amb18862514 [0,2,0,0,0,0|1,0,0]=3 5556 B12R2.1316 Fc1ccc(F)c(C2CO2)c1 Amb1134598 [0,2,0,0,0,0|0,0,0]=2 5557 B12R2.1316 Fc1ccc(F)c([C@@H]2CO2)c1 Amb25922893 [0,2,0,0,0,0|0,0,0]=2 5558 B12R2.1316 Fc1ccc(F)c([C@H]2CO2)c1 Amb27794281 [0,2,0,0,0,0|0,0,0]=2 5559 B12R2.1316 Fc1ccc(I)c(C2CC2)c1 Amb24321152 [0,2,0,0,0,0|1,0,0]=3 5560 B12R2.1316 Fc1ncc(Br)cc1C2CO2 Amb33477751 [0,2,0,0,0,0|1,0,0]=3 5561 B12R2.1316 Fc1ncc(Br)cc1[C@@H]2CO2 Amb33450278 [0,2,0,0,0,0|1,0,0]=3 5562 B12R2.1316 Fc1ncc(Br)cc1[C@H]2CO2 Amb33450275 [0,2,0,0,0,0|1,0,0]=3 5563 B12R2.1316 Fc1ncc(Cl)cc1C2CC2 Amb32644867 [0,2,0,0,0,0|2,0,0]=4 5564 B12R2.1316 Fc1ncc(Cl)cc1C2CO2 Amb33257200 [0,2,0,0,0,0|1,0,0]=3 5565 B12R2.1316 Fc1ncc(Cl)cc1[C@@H]2CO2 Amb33258243 [0,2,0,0,0,0|1,0,0]=3 5566 B12R2.1316 Fc1ncc(Cl)cc1[C@H]2CO2 Amb33258240 [0,2,0,0,0,0|1,0,0]=3 5567 B12R2.1316 NC1=CN(C2CC2)C(=O)C=C1 Amb23454779 [0,2,0,0,0,0|2,0,0]=4 5568 B12R2.1316 Nc1cc(C2CC2)c(Br)cn1 Amb24319640 [0,2,0,0,0,0|2,0,0]=4 5569 B12R2.1316 Nc1cc(C2CC2)c(Cl)cn1 Amb26865227 [0,2,0,0,0,0|2,0,0]=4 5570 B12R2.1316 Nc1ccc(Br)c(C2CC2)c1 Amb20617888 [0,2,0,0,0,0|1,0,0]=3 5571 B12R2.1316 Nc1ccc(Br)c(C2CC2)n1 Amb27395043 [0,2,0,0,0,0|2,0,0]=4 5572 B12R2.1316 Nc1ccc(Br)cc1C2CC2 Amb20617866 [0,2,0,0,0,0|1,0,0]=3 5573 B12R2.1316 Nc1ccc(F)c(C2CC2)c1 Amb24077338 [0,2,0,0,0,0|1,0,0]=3 5574 B12R2.1316 Nc1ccc(F)cc1C2CC2 Amb18947616 [0,2,0,0,0,0|1,0,0]=3 5575 B12R2.1316 Nc1ccc(I)cc1C2CC2 Amb22900093 [0,2,0,0,0,0|1,0,0]=3 5576 B12R2.1316 Nc1ccc(O)c(C2CC2)c1 Amb27784840 [0,2,0,0,0,0|1,0,0]=3 5577 B12R2.1316 Nc1cnc(Br)cc1C2CC2 Amb24322585 [0,2,0,0,0,0|2,0,0]=4 5578 B12R2.1316 Nc1ncc(Br)cc1C2CC2 Amb24368705 [0,2,0,0,0,0|2,0,0]=4 5579 B12R2.1316 O=C1C=CC(=O)C(C2CC2)=C1 Amb28386588 [0,2,0,0,0,0|1,0,0]=3 5580 B12R2.1316 O=C1C=CC(Br)=CN1C2CC2 Amb26334812 [0,2,0,0,0,0|2,0,0]=4 5581 B12R2.1316 Oc1ccc(Br)cc1C2CC2 Amb27970132 [0,2,0,0,0,0|1,0,0]=3 5582 B12R2.1316 Oc1ccc(Cl)cc1C2CC2 Amb27751453 [0,2,0,0,0,0|1,0,0]=3 5583 B12R2.1316 Oc1ccc(F)cc1C2CC2 Amb25839259 [0,2,0,0,0,0|1,0,0]=3 5584 B12R2.2294 Brc1cc(Br)cc(C2CC2)c1 Amb20617871 [0,2,0,0,0,0|1,0,0]=3 5585 B12R2.2294 Brc1cc(Br)nc(C2CC2)c1 Amb20617534 [0,2,0,0,0,0|2,0,0]=4 5586 B12R2.2294 Brc1cc(C2CC2)cc(Br)n1 Amb27631698 [0,2,0,0,0,0|2,0,0]=4 5587 B12R2.2294 Cc1cc(Br)cc(C2CC2)c1 Amb20617869 [0,2,0,0,0,0|1,0,0]=3 5588 B12R2.2294 Cc1cc(Br)cc(C2CO2)c1 Amb33435971 [0,2,0,0,0,0|0,0,0]=2 5589 B12R2.2294 Cc1cc(Br)cc([C@@H]2CO2)c1 Amb33431460 [0,2,0,0,0,0|0,0,0]=2 5590 B12R2.2294 Cc1cc(Br)cc([C@H]2CO2)c1 Amb33431458 [0,2,0,0,0,0|0,0,0]=2 5591 B12R2.2294 Cc1cc(C)cc(C2CO2)c1 Amb33540221 [0,2,0,0,0,0|0,0,0]=2 5592 B12R2.2294 Cc1cc(C)cc([C@@H]2CO2)c1 Amb26038294 [0,2,0,0,0,0|0,0,0]=2 5593 B12R2.2294 Cc1cc(C)cc([C@H]2CO2)c1 Amb27980770 [0,2,0,0,0,0|0,0,0]=2 5594 B12R2.2294 Cc1cc(C2CC2)cc(N)n1 Amb27831949 [0,2,0,0,0,0|2,0,0]=4 5595 B12R2.2294 Cc1cc(C2CO2)cc(Cl)n1 Amb33221903 [0,2,0,0,0,0|1,0,0]=3 5596 B12R2.2294 Cc1cc(F)cc(C2CO2)c1 Amb33343907 [0,2,0,0,0,0|0,0,0]=2 5597 B12R2.2294 Cc1cc(F)cc([C@@H]2CO2)c1 Amb33342697 [0,2,0,0,0,0|0,0,0]=2 5598 B12R2.2294 Cc1cc(F)cc([C@H]2CO2)c1 Amb33342698 [0,2,0,0,0,0|0,0,0]=2 5599 B12R2.2294 Cc1cc([C@@H]2CO2)cc(Cl)n1 Amb33222617 [0,2,0,0,0,0|1,0,0]=3 5600 B12R2.2294 Cc1cc([C@H]2CO2)cc(Cl)n1 Amb33222613 [0,2,0,0,0,0|1,0,0]=3 5601 B12R2.2294 Clc1cc(Br)cc(C2CC2)c1 Amb20617870 [0,2,0,0,0,0|1,0,0]=3 5602 B12R2.2294 Clc1cc(Br)cc(C2CO2)c1 Amb33435437 [0,2,0,0,0,0|0,0,0]=2 5603 B12R2.2294 Clc1cc(Br)cc([C@@H]2CO2)c1 Amb33436130 [0,2,0,0,0,0|0,0,0]=2 5604 B12R2.2294 Clc1cc(Br)cc([C@H]2CO2)c1 Amb33435927 [0,2,0,0,0,0|0,0,0]=2 5605 B12R2.2294 Clc1cc(C2CO2)cc(Cl)n1 Amb32747617 [0,2,0,0,0,0|1,0,0]=3 5606 B12R2.2294 Clc1cc(Cl)cc([C@@H]2CO2)c1 Amb33259624 [0,2,0,0,0,0|0,0,0]=2 5607 B12R2.2294 Clc1cc(Cl)cc([C@H]2CO2)c1 Amb33259622 [0,2,0,0,0,0|0,0,0]=2 5608 B12R2.2294 Clc1cc([C@@H]2CO2)cc(Cl)n1 Amb33413993 [0,2,0,0,0,0|1,0,0]=3 5609 B12R2.2294 Clc1cc([C@H]2CO2)cc(Cl)n1 Amb33413987 [0,2,0,0,0,0|1,0,0]=3 5610 B12R2.2294 Fc1cc(Br)cc(C2CC2)c1 Amb20617872 [0,2,0,0,0,0|1,0,0]=3 5611 B12R2.2294 Fc1cc(Br)cc(C2CC2)n1 Amb24318840 [0,2,0,0,0,0|2,0,0]=4 5612 B12R2.2294 Fc1cc(Br)cc(C2CO2)c1 Amb25101136 [0,2,0,0,0,0|0,0,0]=2 5613 B12R2.2294 Fc1cc(Br)cc([C@@H]2CO2)c1 Amb33334478 [0,2,0,0,0,0|0,0,0]=2 5614 B12R2.2294 Fc1cc(Br)cc([C@H]2CO2)c1 Amb33334467 [0,2,0,0,0,0|0,0,0]=2 5615 B12R2.2294 Fc1cc(Cl)cc(C2CO2)c1 Amb25338781 [0,2,0,0,0,0|0,0,0]=2 5616 B12R2.2294 Fc1cc(Cl)cc([C@@H]2CO2)c1 Amb33257765 [0,2,0,0,0,0|0,0,0]=2 5617 B12R2.2294 Fc1cc(Cl)cc([C@H]2CO2)c1 Amb33257725 [0,2,0,0,0,0|0,0,0]=2 5618 B12R2.2294 Fc1cc(F)cc(C2CO2)c1 Amb23584417 [0,2,0,0,0,0|0,0,0]=2 5619 B12R2.2294 Fc1cc(F)cc([C@@H]2CO2)c1 Amb25920872 [0,2,0,0,0,0|0,0,0]=2 5620 B12R2.2294 Fc1cc(F)cc([C@H]2CO2)c1 Amb25920874 [0,2,0,0,0,0|0,0,0]=2 5621 B12R2.2294 Nc1cc(Br)cc(C2CC2)c1 Amb20617874 [0,2,0,0,0,0|1,0,0]=3 5622 B12R2.2294 Nc1cc(Br)cc(C2CC2)n1 Amb24318855 [0,2,0,0,0,0|2,0,0]=4 5623 B12R2.2294 Nc1cc(F)cc(C2CC2)c1 Amb27424478 [0,2,0,0,0,0|1,0,0]=3 5624 B12R2.2294 Nc1cc(F)nc(C2CC2)c1 Amb24318841 [0,2,0,0,0,0|2,0,0]=4 5625 B12R2.2294 O=C1C=C(C2CO2)NC(=O)N1 Amb27176318 [0,2,0,0,0,0|2,0,0]=4 5626 B12R2.2294 O=C1C=C(O)C=C(C2CC2)N1 Amb27494051 [0,2,0,0,0,0|2,0,0]=4 5627 B12R2.2294 O=C1C=C(O)C=C(C2CC2)O1 Amb28042316 [0,2,0,0,0,0|2,0,0]=4 5628 B12R2.2294 Oc1cc(F)cc(C2CC2)c1 Amb24056000 [0,2,0,0,0,0|1,0,0]=3 5629 B12R2.48 BrCC1(c2ccccc2)CC1 Amb17240828 [0,2,0,0,0,0|1,0,0]=3 5630 B12R2.48 C#CC1(c2ccccc2)CC1 Amb10067569 [0,2,0,0,0,0|1,0,0]=3 5631 B12R2.48 C#CC1(c2ccccn2)CC1 Amb25697096 [0,2,0,0,0,0|2,0,0]=4 5632 B12R2.48 C#CC1(c2cccnc2)CC1 Amb27431962 [0,2,0,0,0,0|2,0,0]=4 5633 B12R2.48 C#CC1(c2ccncc2)CC1 Amb26635444 [0,2,0,0,0,0|2,0,0]=4 5634 B12R2.48 C=CC1(c2ccccc2)CC1 Amb26054135 [0,2,0,0,0,0|1,0,0]=3 5635 B12R2.48 CCC1(c2ccccc2)CO1 Amb25063378 [0,2,0,0,0,0|0,0,0]=2 5636 B12R2.48 CCC1(c2ccccn2)CO1 Amb33747829 [0,2,0,0,0,0|1,0,0]=3 5637 B12R2.48 CCC1(c2cccnc2)CO1 Amb33747828 [0,2,0,0,0,0|1,0,0]=3 5638 B12R2.48 CCC1(c2ccncc2)CO1 Amb24386909 [0,2,0,0,0,0|1,0,0]=3 5639 B12R2.48 CNC1(c2ccccc2)CC1 Amb25063013 [0,2,0,0,0,0|1,0,0]=3 5640 B12R2.48 CNC1(c2ccccn2)CC1 Amb33360473 [0,2,0,0,0,0|2,0,0]=4 5641 B12R2.48 CNC1(c2cccnc2)CC1 Amb33360037 [0,2,0,0,0,0|2,0,0]=4 5642 B12R2.48 CNC1(c2cccnc2)CC1 Amb35789490 [0,2,0,0,0,0|2,0,0]=4 5643 B12R2.48 CNC1(c2ccncc2)CC1 Amb33380630 [0,2,0,0,0,0|2,0,0]=4 5644 B12R2.48 ClCC1(c2ccccc2)CC1 Amb17232627 [0,2,0,0,0,0|1,0,0]=3 5645 B12R2.48 ClCC1(c2cccnc2)CC1 Amb27248248 [0,2,0,0,0,0|2,0,0]=4 5646 B12R2.48 ClCC1(c2ccncc2)CC1 Amb27443743 [0,2,0,0,0,0|2,0,0]=4 5647 B12R2.48 N#CC1(c2ccccc2)CC1 Amb2099443 [0,2,0,0,0,0|1,0,0]=3 5648 B12R2.48 N#CC1(c2ccccc2)CO1 Amb27839772 [0,2,0,0,0,0|0,0,0]=2 5649 B12R2.48 N#CC1(c2ccccn2)CC1 Amb19114158 [0,2,0,0,0,0|2,0,0]=4 5650 B12R2.48 N#CC1(c2cccnc2)CC1 Amb21857190 [0,2,0,0,0,0|2,0,0]=4 5651 B12R2.48 N#CC1(c2ccncc2)CC1 Amb21857195 [0,2,0,0,0,0|2,0,0]=4 5652 B12R2.48 NCC1(c2ccccc2)CC1 Amb10603193 [0,2,0,0,0,0|1,0,0]=3 5653 B12R2.48 NCC1(c2ccccc2)CC1 Amb2099519 [0,2,0,0,0,0|1,0,0]=3 5654 B12R2.48 NCC1(c2ccccc2)CC1 Amb495518 [0,2,0,0,0,0|1,0,0]=3 5655 B12R2.48 NCC1(c2ccccn2)CC1 Amb30584665 [0,2,0,0,0,0|2,0,0]=4 5656 B12R2.48 NCC1(c2ccccn2)CC1 Amb8010309 [0,2,0,0,0,0|2,0,0]=4 5657 B12R2.48 NCC1(c2cccnc2)CC1 Amb17106807 [0,2,0,0,0,0|2,0,0]=4 5658 B12R2.48 NCC1(c2ccncc2)CC1 Amb17106809 [0,2,0,0,0,0|2,0,0]=4 5659 B12R2.48 NCC1(c2ccncc2)CC1 Amb30584703 [0,2,0,0,0,0|2,0,0]=4 5660 B12R2.48 NNC1(c2ccccc2)CC1 Amb33081561 [0,2,0,0,0,0|1,0,0]=3 5661 B12R2.48 O=CC1(c2ccccc2)CC1 Amb17399901 [0,2,0,0,0,0|1,0,0]=3 5662 B12R2.48 O=CC1(c2ccccn2)CC1 Amb26449304 [0,2,0,0,0,0|2,0,0]=4 5663 B12R2.48 O=CC1(c2ccncc2)CC1 Amb33474967 [0,2,0,0,0,0|2,0,0]=4 5664 B12R2.48 OCC1(c2ccccc2)CC1 Amb20240525 [0,2,0,0,0,0|1,0,0]=3 5665 B12R2.48 OCC1(c2ccccc2)CO1 Amb27617712 [0,2,0,0,0,0|0,0,0]=2 5666 B12R2.48 OCC1(c2ccccn2)CC1 Amb25951389 [0,2,0,0,0,0|2,0,0]=4 5667 B12R2.48 OCC1(c2cccnc2)CC1 Amb25837520 [0,2,0,0,0,0|2,0,0]=4 5668 B12R2.48 OCC1(c2ccncc2)CC1 Amb24487747 [0,2,0,0,0,0|2,0,0]=4 5669 B12R2.48 OC[C@@]1(c2ccccc2)CO1 Amb27472663 [0,2,0,0,0,0|0,0,0]=2 5670 B12R2.48 SCC1(c2ccccc2)CC1 Amb32951773 [0,2,0,0,0,0|1,0,0]=3 5671 B12R2.48 [C-]#[N+]C1(c2ccccc2)CC1 Amb26067850 [0,2,0,0,0,0|1,0,0]=3 5672 B12R2.88 CC1(c2ccccc2Br)CC1 Amb25147845 [0,2,0,0,0,0|1,0,0]=3 5673 B12R2.88 CC1(c2ccccc2Cl)CC1 Amb25288623 [0,2,0,0,0,0|1,0,0]=3 5674 B12R2.88 CC1(c2ccccc2Cl)CO1 Amb18182719 [0,2,0,0,0,0|0,0,0]=2 5675 B12R2.88 CC1(c2ccccc2F)CC1 Amb25276883 [0,2,0,0,0,0|1,0,0]=3 5676 B12R2.88 CC1(c2ccccc2F)CO1 Amb18181717 [0,2,0,0,0,0|0,0,0]=2 5677 B12R2.88 CC1(c2ccccc2I)CC1 Amb28385120 [0,2,0,0,0,0|1,0,0]=3 5678 B12R2.88 CC1(c2ccccc2N)CC1 Amb2693604 [0,2,0,0,0,0|1,0,0]=3 5679 B12R2.88 CC1(c2ccccc2N)CC1 Amb31156390 [0,2,0,0,0,0|1,0,0]=3 5680 B12R2.88 CC1(c2ccccc2O)CC1 Amb25965311 [0,2,0,0,0,0|1,0,0]=3 5681 B12R2.88 CC1(c2cccnc2Br)CO1 Amb33387822 [0,2,0,0,0,0|1,0,0]=3 5682 B12R2.88 CC1(c2cccnc2Cl)CO1 Amb23571471 [0,2,0,0,0,0|1,0,0]=3 5683 B12R2.88 CC1(c2cccnc2F)CO1 Amb33377179 [0,2,0,0,0,0|1,0,0]=3 5684 B12R2.88 CC1(c2ccncc2Br)CO1 Amb33388615 [0,2,0,0,0,0|1,0,0]=3 5685 B12R2.88 CC1(c2ccncc2Cl)CO1 Amb33413784 [0,2,0,0,0,0|1,0,0]=3 5686 B12R2.88 CC1(c2ccncc2F)CO1 Amb33317165 [0,2,0,0,0,0|1,0,0]=3 5687 B12R2.88 CC1(c2ncccc2Br)CO1 Amb33336109 [0,2,0,0,0,0|1,0,0]=3 5688 B12R2.88 CC1(c2ncccc2F)CO1 Amb33418775 [0,2,0,0,0,0|1,0,0]=3 5689 B12R2.88 Cc1ccccc1C2(C)CC2 Amb28199112 [0,2,0,0,0,0|1,0,0]=3 5690 B12R2.88 Cc1ccccc1C2(C)CO2 Amb23558281 [0,2,0,0,0,0|0,0,0]=2 5691 B12R2.88 Cc1ccccc1C2(N)CC2 Amb2721356 [0,2,0,0,0,0|1,0,0]=3 5692 B12R2.88 Cc1ccccc1C2(N)CC2 Amb8840527 [0,2,0,0,0,0|1,0,0]=3 5693 B12R2.88 Cc1ccccc1C2(O)CC2 Amb25887037 [0,2,0,0,0,0|1,0,0]=3 5694 B12R2.88 Cc1cccnc1C2(C)CO2 Amb33428722 [0,2,0,0,0,0|1,0,0]=3 5695 B12R2.88 Cc1cccnc1C2(N)CC2 Amb18948045 [0,2,0,0,0,0|2,0,0]=4 5696 B12R2.88 Cc1cccnc1C2(O)CC2 Amb26568824 [0,2,0,0,0,0|2,0,0]=4 5697 B12R2.88 Cc1ccncc1C2(C)CO2 Amb33376678 [0,2,0,0,0,0|1,0,0]=3 5698 B12R2.88 Cc1ccncc1C2(N)CC2 Amb28399312 [0,2,0,0,0,0|2,0,0]=4 5699 B12R2.88 Cc1ccncc1C2(O)CC2 Amb30009519 [0,2,0,0,0,0|2,0,0]=4 5700 B12R2.88 Cc1cnccc1C2(C)CO2 Amb25317741 [0,2,0,0,0,0|1,0,0]=3 5701 B12R2.88 Cc1cnccc1C2(N)CC2 Amb25868279 [0,2,0,0,0,0|2,0,0]=4 5702 B12R2.88 Cc1cnccc1C2(O)CC2 Amb25682967 [0,2,0,0,0,0|2,0,0]=4 5703 B12R2.88 Cc1ncccc1C2(C)CO2 Amb32878942 [0,2,0,0,0,0|1,0,0]=3 5704 B12R2.88 Cc1ncccc1C2(N)CC2 Amb26845056 [0,2,0,0,0,0|2,0,0]=4 5705 B12R2.88 Cc1ncccc1C2(O)CC2 Amb26639090 [0,2,0,0,0,0|2,0,0]=4 5706 B12R2.88 Cc1nccnc1C2(C)CO2 Amb33141946 [0,2,0,0,0,0|2,0,0]=4 5707 B12R2.88 Cc1ncncc1C2(C)CO2 Amb33149148 [0,2,0,0,0,0|2,0,0]=4 5708 B12R2.88 FC1(c2ccccc2Br)CC1 Amb27203530 [0,2,0,0,0,0|1,0,0]=3 5709 B12R2.88 FC1(c2ccccc2Cl)CC1 Amb28246141 [0,2,0,0,0,0|1,0,0]=3 5710 B12R2.88 Fc1ccccc1C2(F)CC2 Amb27428525 [0,2,0,0,0,0|1,0,0]=3 5711 B12R2.88 NC1(C2=CC=CNC2=S)CC1 Amb26434479 [0,2,0,0,0,0|2,0,0]=4 5712 B12R2.88 NC1(c2ccccc2Br)CC1 Amb17106846 [0,2,0,0,0,0|1,0,0]=3 5713 B12R2.88 NC1(c2ccccc2Br)CC1 Amb19892646 [0,2,0,0,0,0|1,0,0]=3 5714 B12R2.88 NC1(c2ccccc2Cl)CC1 Amb10608274 [0,2,0,0,0,0|1,0,0]=3 5715 B12R2.88 NC1(c2ccccc2Cl)CC1 Amb2721359 [0,2,0,0,0,0|1,0,0]=3 5716 B12R2.88 NC1(c2ccccc2F)CC1 Amb19515550 [0,2,0,0,0,0|1,0,0]=3 5717 B12R2.88 NC1(c2ccccc2F)CC1 Amb5754025 [0,2,0,0,0,0|1,0,0]=3 5718 B12R2.88 NC1(c2ccccc2I)CC1 Amb27229986 [0,2,0,0,0,0|1,0,0]=3 5719 B12R2.88 NC1(c2ccccc2O)CC1 Amb25854523 [0,2,0,0,0,0|1,0,0]=3 5720 B12R2.88 NC1(c2cccnc2Br)CC1 Amb27148124 [0,2,0,0,0,0|2,0,0]=4 5721 B12R2.88 NC1(c2cccnc2Cl)CC1 Amb25027880 [0,2,0,0,0,0|2,0,0]=4 5722 B12R2.88 NC1(c2cccnc2F)CC1 Amb24455909 [0,2,0,0,0,0|2,0,0]=4 5723 B12R2.88 NC1(c2ccncc2Br)CC1 Amb27654205 [0,2,0,0,0,0|2,0,0]=4 5724 B12R2.88 NC1(c2ccncc2Cl)CC1 Amb26027340 [0,2,0,0,0,0|2,0,0]=4 5725 B12R2.88 NC1(c2ccncc2F)CC1 Amb24486940 [0,2,0,0,0,0|2,0,0]=4 5726 B12R2.88 NC1(c2ncccc2Br)CC1 Amb26348907 [0,2,0,0,0,0|2,0,0]=4 5727 B12R2.88 NC1(c2ncccc2F)CC1 Amb28348838 [0,2,0,0,0,0|2,0,0]=4 5728 B12R2.88 Nc1ccccc1C2(N)CC2 Amb24487758 [0,2,0,0,0,0|1,0,0]=3 5729 B12R2.88 OC1(c2ccccc2Br)CC1 Amb20668272 [0,2,0,0,0,0|1,0,0]=3 5730 B12R2.88 OC1(c2ccccc2Cl)CC1 Amb18182718 [0,2,0,0,0,0|1,0,0]=3 5731 B12R2.88 OC1(c2cccnc2Br)CC1 Amb27194844 [0,2,0,0,0,0|2,0,0]=4 5732 B12R2.88 OC1(c2cccnc2Cl)CC1 Amb33256970 [0,2,0,0,0,0|2,0,0]=4 5733 B12R2.88 OC1(c2cccnc2F)CC1 Amb24712623 [0,2,0,0,0,0|2,0,0]=4 5734 B12R2.88 OC1(c2ccncc2Br)CC1 Amb26441987 [0,2,0,0,0,0|2,0,0]=4 5735 B12R2.88 OC1(c2ccncc2Cl)CC1 Amb28136412 [0,2,0,0,0,0|2,0,0]=4 5736 B12R2.88 OC1(c2ccncc2F)CC1 Amb25027871 [0,2,0,0,0,0|2,0,0]=4 5737 B12R2.88 OC1(c2ncccc2Br)CC1 Amb25924117 [0,2,0,0,0,0|2,0,0]=4 5738 B12R2.88 OC1(c2ncccc2F)CC1 Amb33419185 [0,2,0,0,0,0|2,0,0]=4 5739 B12R2.88 Oc1ccccc1C2(F)CC2 Amb26020800 [0,2,0,0,0,0|1,0,0]=3 5740 B12R2.88 Oc1ccccc1C2(O)CC2 Amb25087158 [0,2,0,0,0,0|1,0,0]=3 5741 B12R2.240 Brc1cccc(Br)c1C2CO2 Amb33009377 [0,2,0,0,0,0|0,0,0]=2 5742 B12R2.240 Brc1cccc(Br)c1[C@@H]2CO2 Amb33009062 [0,2,0,0,0,0|0,0,0]=2 5743 B12R2.240 Brc1cccc(Br)c1[C@H]2CO2 Amb33009058 [0,2,0,0,0,0|0,0,0]=2 5744 B12R2.240 Brc1ccnc(Br)c1C2CC2 Amb24319974 [0,2,0,0,0,0|2,0,0]=4 5745 B12R2.240 Brc1cncc(Br)c1C2CO2 Amb26552543 [0,2,0,0,0,0|1,0,0]=3 5746 B12R2.240 Brc1cncc(Br)c1[C@@H]2CO2 Amb33389552 [0,2,0,0,0,0|1,0,0]=3 5747 B12R2.240 Brc1cncc(Br)c1[C@H]2CO2 Amb33389551 [0,2,0,0,0,0|1,0,0]=3 5748 B12R2.240 Cc1cccc(Br)c1C2CC2 Amb24321204 [0,2,0,0,0,0|1,0,0]=3 5749 B12R2.240 Cc1cccc(C)c1C2CC2 Amb22228795 [0,2,0,0,0,0|1,0,0]=3 5750 B12R2.240 Cc1cccc(C)c1C2CO2 Amb28388789 [0,2,0,0,0,0|0,0,0]=2 5751 B12R2.240 Cc1cccc(C)c1[C@@H]2CO2 Amb32726825 [0,2,0,0,0,0|0,0,0]=2 5752 B12R2.240 Cc1cccc(C)c1[C@H]2CO2 Amb32726826 [0,2,0,0,0,0|0,0,0]=2 5753 B12R2.240 Cc1cccc(Cl)c1C2CO2 Amb33259402 [0,2,0,0,0,0|0,0,0]=2 5754 B12R2.240 Cc1cccc(Cl)c1[C@@H]2CO2 Amb33413959 [0,2,0,0,0,0|0,0,0]=2 5755 B12R2.240 Cc1cccc(Cl)c1[C@H]2CO2 Amb33414049 [0,2,0,0,0,0|0,0,0]=2 5756 B12R2.240 Cc1cccc(F)c1C2CO2 Amb33273491 [0,2,0,0,0,0|0,0,0]=2 5757 B12R2.240 Cc1cccc(F)c1[C@@H]2CO2 Amb33148279 [0,2,0,0,0,0|0,0,0]=2 5758 B12R2.240 Cc1cccc(F)c1[C@H]2CO2 Amb33147498 [0,2,0,0,0,0|0,0,0]=2 5759 B12R2.240 Cc1cccc(O)c1C2CC2 Amb28351373 [0,2,0,0,0,0|1,0,0]=3 5760 B12R2.240 Cc1ccnc(N)c1C2CC2 Amb26489705 [0,2,0,0,0,0|2,0,0]=4 5761 B12R2.240 Cc1ccnc(N)c1C2CC2 Amb28872312 [0,2,0,0,0,0|2,0,0]=4 5762 B12R2.240 Cc1cncc(Br)c1C2CC2 Amb27756323 [0,2,0,0,0,0|2,0,0]=4 5763 B12R2.240 Clc1cccc(Br)c1C2CC2 Amb24321213 [0,2,0,0,0,0|1,0,0]=3 5764 B12R2.240 Clc1cccc(Br)c1C2CO2 Amb33337342 [0,2,0,0,0,0|0,0,0]=2 5765 B12R2.240 Clc1cccc(Br)c1[C@@H]2CO2 Amb33334185 [0,2,0,0,0,0|0,0,0]=2 5766 B12R2.240 Clc1cccc(Br)c1[C@H]2CO2 Amb33334187 [0,2,0,0,0,0|0,0,0]=2 5767 B12R2.240 Clc1cccc(Cl)c1C2CO2 Amb18325089 [0,2,0,0,0,0|0,0,0]=2 5768 B12R2.240 Clc1cccc(Cl)c1[C@@H]2CO2 Amb27976242 [0,2,0,0,0,0|0,0,0]=2 5769 B12R2.240 Clc1cccc(Cl)c1[C@H]2CO2 Amb27976243 [0,2,0,0,0,0|0,0,0]=2 5770 B12R2.240 Clc1cncc(Cl)c1C2CO2 Amb33260943 [0,2,0,0,0,0|1,0,0]=3 5771 B12R2.240 Clc1cncc(Cl)c1[C@@H]2CO2 Amb33257508 [0,2,0,0,0,0|1,0,0]=3 5772 B12R2.240 Clc1cncc(Cl)c1[C@H]2CO2 Amb33257620 [0,2,0,0,0,0|1,0,0]=3 5773 B12R2.240 Clc1nccc(I)c1C2CC2 Amb27670040 [0,2,0,0,0,0|2,0,0]=4 5774 B12R2.240 Clc1ncnc(Cl)c1C2CO2 Amb33262282 [0,2,0,0,0,0|2,0,0]=4 5775 B12R2.240 Clc1ncnc(Cl)c1[C@@H]2CO2 Amb33262613 [0,2,0,0,0,0|2,0,0]=4 5776 B12R2.240 Clc1ncnc(Cl)c1[C@H]2CO2 Amb33262605 [0,2,0,0,0,0|2,0,0]=4 5777 B12R2.240 Fc1cccc(Br)c1C2CC2 Amb24321212 [0,2,0,0,0,0|1,0,0]=3 5778 B12R2.240 Fc1cccc(Br)c1C2CO2 Amb26980371 [0,2,0,0,0,0|0,0,0]=2 5779 B12R2.240 Fc1cccc(Br)c1[C@@H]2CO2 Amb33430598 [0,2,0,0,0,0|0,0,0]=2 5780 B12R2.240 Fc1cccc(Br)c1[C@H]2CO2 Amb33430587 [0,2,0,0,0,0|0,0,0]=2 5781 B12R2.240 Fc1cccc(Cl)c1C2CN2 Amb18224418 [0,2,0,0,0,0|1,0,0]=3 5782 B12R2.240 Fc1cccc(Cl)c1C2CO2 Amb17090254 [0,2,0,0,0,0|0,0,0]=2 5783 B12R2.240 Fc1cccc(Cl)c1[C@@H]2CO2 Amb28369204 [0,2,0,0,0,0|0,0,0]=2 5784 B12R2.240 Fc1cccc(Cl)c1[C@H]2CO2 Amb27840357 [0,2,0,0,0,0|0,0,0]=2 5785 B12R2.240 Fc1cccc(F)c1C2CO2 Amb1136699 [0,2,0,0,0,0|0,0,0]=2 5786 B12R2.240 Fc1cccc(F)c1[C@@H]2CO2 Amb25151843 [0,2,0,0,0,0|0,0,0]=2 5787 B12R2.240 Fc1cccc(F)c1[C@H]2CO2 Amb26056825 [0,2,0,0,0,0|0,0,0]=2 5788 B12R2.240 Fc1ccnc(F)c1C2CC2 Amb32696002 [0,2,0,0,0,0|2,0,0]=4 5789 B12R2.240 Fc1cncc(Br)c1C2CC2 Amb26597722 [0,2,0,0,0,0|2,0,0]=4 5790 B12R2.240 Fc1cncc(F)c1C2CC2 Amb32696050 [0,2,0,0,0,0|2,0,0]=4 5791 B12R2.240 Fc1cncc(F)c1C2CO2 Amb32881416 [0,2,0,0,0,0|1,0,0]=3 5792 B12R2.240 Fc1cncc(F)c1[C@@H]2CO2 Amb32880612 [0,2,0,0,0,0|1,0,0]=3 5793 B12R2.240 Fc1cncc(F)c1[C@H]2CO2 Amb32880613 [0,2,0,0,0,0|1,0,0]=3 5794 B12R2.240 Nc1cccc(Cl)c1C2CC2 Amb28323091 [0,2,0,0,0,0|1,0,0]=3 5795 B12R2.240 Nc1nccc(Br)c1C2CC2 Amb24319975 [0,2,0,0,0,0|2,0,0]=4 5796 B12R2.240 Nc1nccc(Cl)c1C2CC2 Amb23571864 [0,2,0,0,0,0|2,0,0]=4 5797 B12R2.240 Oc1cccc(Cl)c1C2CC2 Amb22496408 [0,2,0,0,0,0|1,0,0]=3 5798 B12R2.240 Oc1cccc(O)c1C2CO2 Amb27176227 [0,2,0,0,0,0|0,0,0]=2 5799 B12R2.2048 BrCc1ccccc1C2CC2 Amb33549233 [0,2,0,0,0,0|1,0,0]=3 5800 B12R2.2048 C#Cc1ccccc1C2CC2 Amb25686492 [0,2,0,0,0,0|1,0,0]=3 5801 B12R2.2048 C#Cc1ccccc1C2CO2 Amb33204032 [0,2,0,0,0,0|0,0,0]=2 5802 B12R2.2048 C#Cc1ccccc1[C@@H]2CO2 Amb33226952 [0,2,0,0,0,0|0,0,0]=2 5803 B12R2.2048 C#Cc1ccccc1[C@H]2CO2 Amb33318466 [0,2,0,0,0,0|0,0,0]=2 5804 B12R2.2048 C#Cc1ccncc1C2CC2 Amb25826295 [0,2,0,0,0,0|2,0,0]=4 5805 B12R2.2048 C#Cc1ncccc1C2CC2 Amb25922709 [0,2,0,0,0,0|2,0,0]=4 5806 B12R2.2048 C=Cc1ccccc1C2CC2 Amb25741141 [0,2,0,0,0,0|1,0,0]=3 5807 B12R2.2048 C=Cc1ccncc1C2CC2 Amb27240905 [0,2,0,0,0,0|2,0,0]=4 5808 B12R2.2048 CCc1ccccc1C2CO2 Amb25293511 [0,2,0,0,0,0|0,0,0]=2 5809 B12R2.2048 CCc1ccccc1[C@@H]2CO2 Amb33198618 [0,2,0,0,0,0|0,0,0]=2 5810 B12R2.2048 CCc1ccccc1[C@H]2CO2 Amb33198627 [0,2,0,0,0,0|0,0,0]=2 5811 B12R2.2048 COc1ccccc1C2CC2 Amb22363900 [0,2,0,0,0,0|1,0,0]=3 5812 B12R2.2048 COc1ccccc1C2CN2 Amb18224267 [0,2,0,0,0,0|1,0,0]=3 5813 B12R2.2048 COc1ccccc1C2CO2 Amb1141495 [0,2,0,0,0,0|0,0,0]=2 5814 B12R2.2048 COc1ccccc1[C@@H]2CO2 Amb27754922 [0,2,0,0,0,0|0,0,0]=2 5815 B12R2.2048 COc1ccccc1[C@H]2CO2 Amb25324836 [0,2,0,0,0,0|0,0,0]=2 5816 B12R2.2048 COc1cccnc1C2CO2 Amb27589749 [0,2,0,0,0,0|1,0,0]=3 5817 B12R2.2048 COc1cccnc1[C@@H]2CO2 Amb33271095 [0,2,0,0,0,0|1,0,0]=3 5818 B12R2.2048 COc1cccnc1[C@H]2CO2 Amb33271098 [0,2,0,0,0,0|1,0,0]=3 5819 B12R2.2048 COc1cnccc1C2CO2 Amb33745565 [0,2,0,0,0,0|1,0,0]=3 5820 B12R2.2048 COc1ncccc1C2CC2 Amb25715894 [0,2,0,0,0,0|2,0,0]=4 5821 B12R2.2048 COc1ncccc1C2CO2 Amb25921536 [0,2,0,0,0,0|1,0,0]=3 5822 B12R2.2048 COc1ncccc1[C@@H]2CO2 Amb33378218 [0,2,0,0,0,0|1,0,0]=3 5823 B12R2.2048 COc1ncccc1[C@H]2CO2 Amb33378220 [0,2,0,0,0,0|1,0,0]=3 5824 B12R2.2048 CSc1ccccc1C2CO2 Amb27201215 [0,2,0,0,0,0|0,0,0]=2 5825 B12R2.2048 CSc1ccccc1[C@@H]2CO2 Amb32876363 [0,2,0,0,0,0|0,0,0]=2 5826 B12R2.2048 CSc1ccccc1[C@H]2CO2 Amb33224378 [0,2,0,0,0,0|0,0,0]=2 5827 B12R2.2048 ClCc1ccccc1C2CC2 Amb27173672 [0,2,0,0,0,0|1,0,0]=3 5828 B12R2.2048 ClCc1cccnc1C2CC2 Amb28054804 [0,2,0,0,0,0|2,0,0]=4 5829 B12R2.2048 ClCc1ncccc1C2CC2 Amb27243864 [0,2,0,0,0,0|2,0,0]=4 5830 B12R2.2048 N#Cc1ccccc1C2CC2 Amb8467871 [0,2,0,0,0,0|1,0,0]=3 5831 B12R2.2048 N#Cc1ccccc1[C@@H]2CO2 Amb33374815 [0,2,0,0,0,0|0,0,0]=2 5832 B12R2.2048 N#Cc1ccccc1[C@H]2CO2 Amb33374817 [0,2,0,0,0,0|0,0,0]=2 5833 B12R2.2048 N#Cc1cccnc1C2CC2 Amb27243833 [0,2,0,0,0,0|2,0,0]=4 5834 B12R2.2048 N#Cc1ncccc1C2CC2 Amb22263084 [0,2,0,0,0,0|2,0,0]=4 5835 B12R2.2048 NCc1ccccc1C2CC2 Amb24093643 [0,2,0,0,0,0|1,0,0]=3 5836 B12R2.2048 NCc1ccccc1C2CC2 Amb8467909 [0,2,0,0,0,0|1,0,0]=3 5837 B12R2.2048 NCc1cccnc1C2CC2 Amb23560755 [0,2,0,0,0,0|2,0,0]=4 5838 B12R2.2048 NCc1cnccc1C2CC2 Amb27774853 [0,2,0,0,0,0|2,0,0]=4 5839 B12R2.2048 NNc1ccccc1C2CC2 Amb26381857 [0,2,0,0,0,0|1,0,0]=3 5840 B12R2.2048 O=Cc1ccccc1C2CC2 Amb6739828 [0,2,0,0,0,0|1,0,0]=3 5841 B12R2.2048 O=Cc1ccccc1N2CC2 Amb24069934 [0,2,0,0,0,0|2,0,0]=4 5842 B12R2.2048 O=Cc1cccnc1C2CC2 Amb23560754 [0,2,0,0,0,0|2,0,0]=4 5843 B12R2.2048 O=Cc1ccncc1C2CC2 Amb22276400 [0,2,0,0,0,0|2,0,0]=4 5844 B12R2.2048 OCc1ccccc1C2CC2 Amb33550777 [0,2,0,0,0,0|1,0,0]=3 5845 B12R2.2048 OCc1ccncc1C2CC2 Amb28348719 [0,2,0,0,0,0|2,0,0]=4 5846 B12R2.2048 OCc1ncccc1C2CC2 Amb26571385 [0,2,0,0,0,0|2,0,0]=4 5847 B12R2.2048 SCc1ccccc1C2CC2 Amb26862986 [0,2,0,0,0,0|1,0,0]=3 5848 B12R2.2048 [C-]#[N+]c1ccccc1C2CC2 Amb33344594 [0,2,0,0,0,0|1,0,0]=3 5849 B8R0.7 C=C\C=C\C#CC(C)O Amb28315484 [0,0,2,0,0,0|0,0,2]=4 5850 B8R0.7 C=C\C=C\C=C\C(=O)O Amb28346293 [0,0,2,0,0,0|1,0,1]=4 5851 B8R0.7 CC(C)\C=C\C=C\C=O Amb18642247 [0,0,2,0,0,0|2,0,0]=4 5852 B8R0.7 CC\C=C\C=C\C(C)O Amb28049199 [0,0,2,0,0,0|0,0,2]=4 5853 B8R0.7 CC\C=C\C=C\[C@@H](C)O Amb27424950 [0,0,2,0,0,0|0,0,2]=4 5854 B8R0.8 C=C(C\C=C\C)C(C)O Amb28049240 [0,0,2,0,0,0|0,0,2]=4 5855 B8R0.8 C=CCCC(=C)C(C)O Amb27812383 [0,0,2,0,0,0|0,0,2]=4 5856 B8R0.8 C=C\C=C\C(C)C(C)O Amb27805699 [0,0,2,0,0,0|0,0,2]=4 5857 B8R0.15 C=C=C(\C=C\C)C(C)O Amb27660763 [0,0,2,0,0,0|0,0,2]=4 5858 B8R0.1 C=CCCC(=C)CCO Amb27218611 [0,0,2,0,0,0|0,0,2]=4 5859 B8R0.1 C=CC\C=C(\C)CCO Amb27651848 [0,0,2,0,0,0|0,0,2]=4 5860 B8R0.1 C=C\C=C\C(=C)CC=O Amb26851275 [0,0,2,0,0,0|0,0,2]=4 5861 B8R0.1 C\C(=C/C=C/Cl)CCO Amb27233484 [0,0,2,0,0,0|1,0,1]=4 5862 B8R0.1 O=C\C=C/C(=O)CCO Amb27643576 [0,0,2,0,0,0|2,0,0]=4 5863 B8R0.4 C#C\C=C\C=C\CCO Amb28315560 [0,0,2,0,0,0|0,0,2]=4 5864 B8R0.4 C=C\C=C\C=C\CCC Amb22641675 [0,0,2,0,0,0|1,0,0]=3 5865 B8R0.4 CCC\C=C/C=C/C=O Amb27643510 [0,0,2,0,0,0|2,0,0]=4 5866 B8R0.4 CCC\C=C\C=C\C=O Amb8392848 [0,0,2,0,0,0|2,0,0]=4 5867 B8R0.4 CO\C=C\C=C\C=C\Br Amb27634863 [0,0,2,0,0,0|1,0,1]=4 5868 B8R0.4 CO\C=C\C=C\C=C\Cl Amb27243657 [0,0,2,0,0,0|1,0,1]=4 5869 B8R0.4 CO\C=C\C=C\CCO Amb27660890 [0,0,2,0,0,0|1,0,1]=4 5870 B8R0.4 CO\N=C\C=C/C=C/N Amb28067626 [0,0,2,0,0,0|2,0,0]=4 5871 B8R0.4 C\C=C\C=C=CCCO Amb27812339 [0,0,2,0,0,0|0,0,2]=4 5872 B8R0.4 C\C=C\C=C\CCCO Amb17593323 [0,0,2,0,0,0|0,0,2]=4 5873 B8R0.4 C\C=C\C\C=C\CCO Amb27978414 [0,0,2,0,0,0|0,0,2]=4 5874 B8R0.4 OC\C=C\C=C\C=C\Cl Amb27878783 [0,0,2,0,0,0|1,0,1]=4 5875 B8R0.22 C=CCC(C=C)CCO Amb27662197 [0,0,2,0,0,0|0,0,2]=4 5876 B8R0.22 C=C\C=C(/C=O)COC Amb27194403 [0,0,2,0,0,0|1,0,0]=3 5877 B10R2.196 ClC1(Cl)c2ccccc21 Amb25347359 [0,0,1,1,0,0|2,0,0]=4 5878 B10R2.196 FC1(F)c2ccccc21 Amb25305708 [0,0,1,1,0,0|2,0,0]=4 5879 B10R2.320 BrC1Cc2ccccc21 Amb8395938 [0,0,1,1,0,0|1,0,0]=3 5880 B10R2.320 CC1=Cc2ccccc21 Amb27838637 [0,0,1,1,0,0|1,0,1]=4 5881 B10R2.320 CC1Cc2ccccc21 Amb17778870 [0,0,1,1,0,0|1,0,0]=3 5882 B10R2.320 ClC1Cc2ccccc21 Amb17778800 [0,0,1,1,0,0|1,0,0]=3 5883 B10R2.320 FC1Cc2ccccc21 Amb26861975 [0,0,1,1,0,0|1,0,0]=3 5884 B10R2.320 IC1Cc2ccccc21 Amb27465878 [0,0,1,1,0,0|1,0,0]=3 5885 B10R2.320 NC1Cc2ccccc21 Amb26866193 [0,0,1,1,0,0|1,0,0]=3 5886 B10R2.320 NC1Cc2ccccc21 Amb33552087 [0,0,1,1,0,0|1,0,0]=3 5887 B10R2.320 O=C1Cc2ccccc21 Amb8395940 [0,0,1,1,0,0|0,0,2]=4 5888 B10R2.320 OC1Cc2ccccc21 Amb17778676 [0,0,1,1,0,0|0,0,0]=2 5889 B10R2.320 [NH3+]C1Cc2ccccc21 Amb17778877 [0,0,1,1,0,0|1,0,0]=3 5890 B10R2.7 C1=Cc2ccccc2C1 Amb2383760 [0,0,1,1,0,0|1,0,1]=4 5891 B10R2.7 b1oc2ccccc2o1 Amb22731069 [0,0,1,1,0,0|2,0,0]=4 5892 B10R2.7 c1cc2c(cn1)CCN2 Amb19515489 [0,0,1,1,0,0|2,0,0]=4 5893 B10R2.7 c1cc2c(cn1)CCN2 Amb22372217 [0,0,1,1,0,0|2,0,0]=4 5894 B10R2.7 c1cc2c(cn1)CCO2 Amb24101562 [0,0,1,1,0,0|1,0,0]=3 5895 B10R2.7 c1cc2c(cn1)CNC2 Amb10067652 [0,0,1,1,0,0|2,0,0]=4 5896 B10R2.7 c1cc2c(cn1)CNC2 Amb20242101 [0,0,1,1,0,0|2,0,0]=4 5897 B10R2.7 c1cc2c(cn1)CNC2 Amb2696535 [0,0,1,1,0,0|2,0,0]=4 5898 B10R2.7 c1cc2c(cn1)COC2 Amb24738431 [0,0,1,1,0,0|1,0,0]=3 5899 B10R2.7 c1cc2c(cn1)COC2 Amb30625050 [0,0,1,1,0,0|1,0,0]=3 5900 B10R2.7 c1cc2c(cn1)NCC2 Amb19516033 [0,0,1,1,0,0|2,0,0]=4 5901 B10R2.7 c1cc2c(cn1)NCC2 Amb22495003 [0,0,1,1,0,0|2,0,0]=4 5902 B10R2.7 c1cc2c(cn1)NCC2 Amb23412122 [0,0,1,1,0,0|2,0,0]=4 5903 B10R2.7 c1cc[n+]2c(c1)OCC2 Amb22364467 [0,0,1,1,0,0|1,0,0]=3 5904 B10R2.7 c1ccc2c(c1)CCC2 Amb6608915 [0,0,1,1,0,0|1,0,0]=3 5905 B10R2.7 c1ccc2c(c1)CCN2 Amb1869493 [0,0,1,1,0,0|1,0,0]=3 5906 B10R2.7 c1ccc2c(c1)CCO2 Amb2687295 [0,0,1,1,0,0|0,0,0]=2 5907 B10R2.7 c1ccc2c(c1)CNC2 Amb33527370 [0,0,1,1,0,0|1,0,0]=3 5908 B10R2.7 c1ccc2c(c1)CNC2 Amb33544332 [0,0,1,1,0,0|1,0,0]=3 5909 B10R2.7 c1ccc2c(c1)CNN2 Amb8386538 [0,0,1,1,0,0|2,0,0]=4 5910 B10R2.7 c1ccc2c(c1)COC2 Amb2780010 [0,0,1,1,0,0|0,0,0]=2 5911 B10R2.7 c1ccc2c(c1)CPC2 Amb27217940 [0,0,1,1,0,0|1,0,0]=3 5912 B10R2.7 c1ccc2c(c1)CSC2 Amb21962922 [0,0,1,1,0,0|0,1,0]=3 5913 B10R2.7 c1ccc2c(c1)NCO2 Amb28050014 [0,0,1,1,0,0|1,0,0]=3 5914 B10R2.7 c1ccc2c(c1)OCO2 Amb2684576 [0,0,1,1,0,0|1,0,0]=3 5915 B10R2.7 c1ccc2c(c1)OSO2 Amb28050023 [0,0,1,1,0,0|2,0,0]=4 5916 B10R2.7 c1ccc2c(c1)SCS2 Amb26548649 [0,0,1,1,0,0|1,1,0]=4 5917 B10R2.7 c1ccc2nonc2c1 Amb2724589 [0,0,1,1,0,0|2,0,0]=4 5918 B10R2.7 c1ccc2occc2c1 Amb2725466 [0,0,1,1,0,0|0,0,2]=4 5919 B10R2.7 c1ccc2ocnc2c1 Amb6608831 [0,0,1,1,0,0|1,0,1]=4 5920 B10R2.7 c1ccc2oncc2c1 Amb1233398 [0,0,1,1,0,0|1,0,1]=4 5921 B10R2.7 c1cnc2c(c1)CCC2 Amb8386888 [0,0,1,1,0,0|2,0,0]=4 5922 B10R2.7 c1cnc2c(c1)CCN2 Amb32406061 [0,0,1,1,0,0|2,0,0]=4 5923 B10R2.7 c1cnc2c(c1)CCN2 Amb6751887 [0,0,1,1,0,0|2,0,0]=4 5924 B10R2.7 c1cnc2c(c1)CCO2 Amb25337454 [0,0,1,1,0,0|1,0,0]=3 5925 B10R2.7 c1cnc2c(c1)CCS2 Amb8439003 [0,0,1,1,0,0|1,1,0]=4 5926 B10R2.7 c1cnc2c(c1)CNC2 Amb20671408 [0,0,1,1,0,0|2,0,0]=4 5927 B10R2.7 c1cnc2c(c1)CNC2 Amb22489863 [0,0,1,1,0,0|2,0,0]=4 5928 B10R2.7 c1cnc2c(c1)CNC2 Amb2696534 [0,0,1,1,0,0|2,0,0]=4 5929 B10R2.7 c1cnc2c(c1)CNC2 Amb33172747 [0,0,1,1,0,0|2,0,0]=4 5930 B10R2.7 c1cnc2c(c1)CNC2 Amb33172763 [0,0,1,1,0,0|2,0,0]=4 5931 B10R2.7 c1cnc2c(c1)CNC2 Amb8630212 [0,0,1,1,0,0|2,0,0]=4 5932 B10R2.7 c1cnc2c(c1)COC2 Amb24467517 [0,0,1,1,0,0|1,0,0]=3 5933 B10R2.7 c1cnc2c(c1)NCC2 Amb18833005 [0,0,1,1,0,0|2,0,0]=4 5934 B10R2.7 c1cnc2c(c1)NCC2 Amb33069019 [0,0,1,1,0,0|2,0,0]=4 5935 B10R2.7 c1cnc2c(c1)OCC2 Amb23455396 [0,0,1,1,0,0|1,0,0]=3 5936 B10R2.7 c1ncc2c(n1)OCC2 Amb27636198 [0,0,1,1,0,0|2,0,0]=4 5937 B10R2.408 c1cc2cc(c1)CNC2 Amb28197239 [0,0,1,1,0,0|1,0,0]=3 5938 B10R2.135 O=CC1=CC(=O)C2OC12 Amb28144195 [0,0,1,1,0,0|2,0,0]=4 5939 B10R2.193 c1cc(CC2CO2)co1 Amb26386561 [0,0,1,1,0,0|1,0,1]=4 5940 B10R2.193 c1cc(CC2CO2)cs1 Amb24392264 [0,0,1,1,0,0|1,0,1]=4 5941 B10R2.193 c1coc(CC2CO2)c1 Amb27838490 [0,0,1,1,0,0|1,0,1]=4 5942 B10R2.193 c1csc(CC2CO2)c1 Amb26951226 [0,0,1,1,0,0|1,0,1]=4 5943 B10R2.244 O=C1C=CC=C[C@@H]2C[C@H]12 Amb27256431 [0,0,1,1,0,0|2,0,0]=4 5944 B10R2.244 O=C1C=CC=C[C@H]2C[C@@H]12 Amb28253402 [0,0,1,1,0,0|2,0,0]=4 5945 B10R2.73 O=C1C=CC(=O)C2OC12 Amb24363955 [0,0,1,1,0,0|2,0,0]=4 5946 B12R3.12 c1ccc2c(c1)CC3OC23 Amb1131588 [0,0,0,1,0,1|0,0,0]=2 5947 B12R3.12 c1ccc2c(c1)C[C@@H]3O[C@H]23 Amb6893758 [0,0,0,1,0,1|0,0,0]=2 5948 B12R3.12 c1ccc2c3n(cc2c1)C3 Amb27781391 [0,0,0,1,0,1|2,0,0]=4 5949 B8R1.7 CC(Br)c1cccs1 Amb17447081 [0,0,1,0,1,0|2,0,0]=4 5950 B8R1.7 CC(C)=C1C=CC=C1 Amb2720978 [0,0,1,0,1,0|1,0,1]=4 5951 B8R1.7 CC(C)C1=CC=CC1 Amb22227970 [0,0,1,0,1,0|1,0,1]=4 5952 B8R1.7 CC(C)C1C=CC=C1 Amb22736083 [0,0,1,0,1,0|1,0,1]=4 5953 B8R1.7 CC(C)c1ccco1 Amb22168231 [0,0,1,0,1,0|2,0,0]=4 5954 B8R1.7 CC(C)c1cccs1 Amb17689449 [0,0,1,0,1,0|2,0,0]=4 5955 B8R1.7 CC(Cl)c1ccco1 Amb17138373 [0,0,1,0,1,0|2,0,0]=4 5956 B8R1.7 CC(Cl)c1cccs1 Amb17138413 [0,0,1,0,1,0|2,0,0]=4 5957 B8R1.7 CC(N)=C1C=CC=C1 Amb27245689 [0,0,1,0,1,0|1,0,1]=4 5958 B8R1.7 CC(N)c1ccco1 Amb6893074 [0,0,1,0,1,0|2,0,0]=4 5959 B8R1.7 CC(N)c1ccco1 Amb9745704 [0,0,1,0,1,0|2,0,0]=4 5960 B8R1.7 CC(N)c1cccs1 Amb1790688 [0,0,1,0,1,0|2,0,0]=4 5961 B8R1.7 CC(N)c1cccs1 Amb6487447 [0,0,1,0,1,0|2,0,0]=4 5962 B8R1.7 CC(N)c1ccoc1 Amb20622299 [0,0,1,0,1,0|2,0,0]=4 5963 B8R1.7 CC(N)c1ccoc1 Amb22011563 [0,0,1,0,1,0|2,0,0]=4 5964 B8R1.7 CC(N)c1ccsc1 Amb13952135 [0,0,1,0,1,0|2,0,0]=4 5965 B8R1.7 CC(O)c1ccco1 Amb2725588 [0,0,1,0,1,0|1,0,0]=3 5966 B8R1.7 CC(O)c1cccs1 Amb5722410 [0,0,1,0,1,0|1,0,0]=3 5967 B8R1.7 CC(O)c1ccno1 Amb27205103 [0,0,1,0,1,0|2,0,0]=4 5968 B8R1.7 CC(O)c1ccns1 Amb27474829 [0,0,1,0,1,0|2,0,0]=4 5969 B8R1.7 CC(O)c1ccoc1 Amb2440797 [0,0,1,0,1,0|1,0,0]=3 5970 B8R1.7 CC(O)c1ccsc1 Amb26017991 [0,0,1,0,1,0|1,0,0]=3 5971 B8R1.7 CC(O)c1cnco1 Amb33295049 [0,0,1,0,1,0|2,0,0]=4 5972 B8R1.7 CC(O)c1cncs1 Amb19515392 [0,0,1,0,1,0|2,0,0]=4 5973 B8R1.7 CC(O)c1cncs1 Amb32666046 [0,0,1,0,1,0|2,0,0]=4 5974 B8R1.7 CC(O)c1cnsc1 Amb30019748 [0,0,1,0,1,0|2,0,0]=4 5975 B8R1.7 CC(O)c1cocn1 Amb24412519 [0,0,1,0,1,0|2,0,0]=4 5976 B8R1.7 CC(O)c1cscn1 Amb26858695 [0,0,1,0,1,0|2,0,0]=4 5977 B8R1.7 CC(O)c1nccs1 Amb19649204 [0,0,1,0,1,0|2,0,0]=4 5978 B8R1.7 CC(S)c1ccco1 Amb9208025 [0,0,1,0,1,0|1,1,0]=4 5979 B8R1.7 CC(S)c1cccs1 Amb9204475 [0,0,1,0,1,0|1,1,0]=4 5980 B8R1.7 CC(S)c1ccoc1 Amb25727398 [0,0,1,0,1,0|1,1,0]=4 5981 B8R1.7 CC(S)c1ccsc1 Amb26899358 [0,0,1,0,1,0|1,1,0]=4 5982 B8R1.7 C[C@@H](N)c1ccco1 Amb13952986 [0,0,1,0,1,0|2,0,0]=4 5983 B8R1.7 C[C@@H](N)c1ccco1 Amb30526698 [0,0,1,0,1,0|2,0,0]=4 5984 B8R1.7 C[C@@H](N)c1cccs1 Amb13952998 [0,0,1,0,1,0|2,0,0]=4 5985 B8R1.7 C[C@@H](N)c1ccoc1 Amb27167242 [0,0,1,0,1,0|2,0,0]=4 5986 B8R1.7 C[C@@H](N)c1ccoc1 Amb33804567 [0,0,1,0,1,0|2,0,0]=4 5987 B8R1.7 C[C@@H](N)c1ccsc1 Amb27666475 [0,0,1,0,1,0|2,0,0]=4 5988 B8R1.7 C[C@@H](O)C1=CC=CC1 Amb27763807 [0,0,1,0,1,0|0,0,1]=3 5989 B8R1.7 C[C@@H](O)c1ccco1 Amb8515979 [0,0,1,0,1,0|1,0,0]=3 5990 B8R1.7 C[C@@H](O)c1ccns1 Amb33483071 [0,0,1,0,1,0|2,0,0]=4 5991 B8R1.7 C[C@@H](O)c1ccoc1 Amb27668136 [0,0,1,0,1,0|1,0,0]=3 5992 B8R1.7 C[C@@H](O)c1ccon1 Amb33226152 [0,0,1,0,1,0|2,0,0]=4 5993 B8R1.7 C[C@@H](O)c1ccsc1 Amb27852673 [0,0,1,0,1,0|1,0,0]=3 5994 B8R1.7 C[C@@H](O)c1cncs1 Amb19515388 [0,0,1,0,1,0|2,0,0]=4 5995 B8R1.7 C[C@@H](O)c1nccs1 Amb19338124 [0,0,1,0,1,0|2,0,0]=4 5996 B8R1.7 C[C@H](N)c1ccco1 Amb13952985 [0,0,1,0,1,0|2,0,0]=4 5997 B8R1.7 C[C@H](N)c1ccco1 Amb28934820 [0,0,1,0,1,0|2,0,0]=4 5998 B8R1.7 C[C@H](N)c1cccs1 Amb13952997 [0,0,1,0,1,0|2,0,0]=4 5999 B8R1.7 C[C@H](N)c1cccs1 Amb33872484 [0,0,1,0,1,0|2,0,0]=4 6000 B8R1.7 C[C@H](N)c1ccoc1 Amb24455235 [0,0,1,0,1,0|2,0,0]=4 6001 B8R1.7 C[C@H](N)c1ccoc1 Amb33804052 [0,0,1,0,1,0|2,0,0]=4 6002 B8R1.7 C[C@H](N)c1ccsc1 Amb22641886 [0,0,1,0,1,0|2,0,0]=4 6003 B8R1.7 C[C@H](O)C1=CC=CC1 Amb28079112 [0,0,1,0,1,0|0,0,1]=3 6004 B8R1.7 C[C@H](O)c1ccco1 Amb8515981 [0,0,1,0,1,0|1,0,0]=3 6005 B8R1.7 C[C@H](O)c1cccs1 Amb13952996 [0,0,1,0,1,0|1,0,0]=3 6006 B8R1.7 C[C@H](O)c1ccns1 Amb33483067 [0,0,1,0,1,0|2,0,0]=4 6007 B8R1.7 C[C@H](O)c1ccoc1 Amb27644198 [0,0,1,0,1,0|1,0,0]=3 6008 B8R1.7 C[C@H](O)c1ccon1 Amb33198776 [0,0,1,0,1,0|2,0,0]=4 6009 B8R1.7 C[C@H](O)c1ccsc1 Amb26026025 [0,0,1,0,1,0|1,0,0]=3 6010 B8R1.7 C[C@H](O)c1cncs1 Amb25697062 [0,0,1,0,1,0|2,0,0]=4 6011 B8R1.7 C[C@H](O)c1cncs1 Amb32941861 [0,0,1,0,1,0|2,0,0]=4 6012 B8R1.7 C[C@H](O)c1cscn1 Amb24568211 [0,0,1,0,1,0|2,0,0]=4 6013 B8R1.7 C[C@H](O)c1nccs1 Amb28280646 [0,0,1,0,1,0|2,0,0]=4 6014 B8R1.7 NC(O)c1cccs1 Amb27186320 [0,0,1,0,1,0|2,0,0]=4 6015 B8R1.8 BrCCc1ccco1 Amb22752866 [0,0,1,0,1,0|2,0,0]=4 6016 B8R1.8 BrCCc1cccs1 Amb16234134 [0,0,1,0,1,0|2,0,0]=4 6017 B8R1.8 BrCCc1ccoc1 Amb19374721 [0,0,1,0,1,0|2,0,0]=4 6018 B8R1.8 BrCCc1ccsc1 Amb18325324 [0,0,1,0,1,0|2,0,0]=4 6019 B8R1.8 BrCCn1cccc1 Amb17933298 [0,0,1,0,1,0|2,0,0]=4 6020 B8R1.8 CCCc1ccco1 Amb10070288 [0,0,1,0,1,0|2,0,0]=4 6021 B8R1.8 CCCc1cccs1 Amb2690417 [0,0,1,0,1,0|2,0,0]=4 6022 B8R1.8 CCCc1ccsc1 Amb17689448 [0,0,1,0,1,0|2,0,0]=4 6023 B8R1.8 CNCc1ccco1 Amb1153202 [0,0,1,0,1,0|2,0,0]=4 6024 B8R1.8 CNCc1ccco1 Amb7172520 [0,0,1,0,1,0|2,0,0]=4 6025 B8R1.8 CNCc1cccs1 Amb1152299 [0,0,1,0,1,0|2,0,0]=4 6026 B8R1.8 CNCc1cccs1 Amb6344856 [0,0,1,0,1,0|2,0,0]=4 6027 B8R1.8 CNCc1ccoc1 Amb2237058 [0,0,1,0,1,0|2,0,0]=4 6028 B8R1.8 CNCc1ccsc1 Amb1154137 [0,0,1,0,1,0|2,0,0]=4 6029 B8R1.8 CNCc1ccsc1 Amb6344857 [0,0,1,0,1,0|2,0,0]=4 6030 B8R1.8 COCc1ccco1 Amb24116969 [0,0,1,0,1,0|1,0,0]=3 6031 B8R1.8 COCc1cccs1 Amb25169518 [0,0,1,0,1,0|1,0,0]=3 6032 B8R1.8 COCc1ccno1 Amb28316180 [0,0,1,0,1,0|2,0,0]=4 6033 B8R1.8 COCc1ccns1 Amb33456878 [0,0,1,0,1,0|2,0,0]=4 6034 B8R1.8 COCc1ccsc1 Amb28051701 [0,0,1,0,1,0|1,0,0]=3 6035 B8R1.8 COCc1cnco1 Amb35652247 [0,0,1,0,1,0|2,0,0]=4 6036 B8R1.8 COCc1cscn1 Amb27404957 [0,0,1,0,1,0|2,0,0]=4 6037 B8R1.8 COCn1cccc1 Amb23401113 [0,0,1,0,1,0|1,0,0]=3 6038 B8R1.8 COCn1cccn1 Amb22546249 [0,0,1,0,1,0|2,0,0]=4 6039 B8R1.8 COCn1ccnc1 Amb10552509 [0,0,1,0,1,0|2,0,0]=4 6040 B8R1.8 CO[SiH2]c1ccco1 Amb27215529 [0,0,1,0,1,0|1,1,0]=4 6041 B8R1.8 CSCc1ccco1 Amb8393158 [0,0,1,0,1,0|1,1,0]=4 6042 B8R1.8 CSCc1ccsc1 Amb27267899 [0,0,1,0,1,0|1,1,0]=4 6043 B8R1.8 ClCCc1cccs1 Amb9004334 [0,0,1,0,1,0|2,0,0]=4 6044 B8R1.8 ClCCc1ccoc1 Amb28381646 [0,0,1,0,1,0|2,0,0]=4 6045 B8R1.8 ClCCn1cccc1 Amb19944678 [0,0,1,0,1,0|2,0,0]=4 6046 B8R1.8 FCCn1cccc1 Amb27758353 [0,0,1,0,1,0|2,0,0]=4 6047 B8R1.8 ICCc1ccco1 Amb27224391 [0,0,1,0,1,0|2,0,0]=4 6048 B8R1.8 ICCn1cccc1 Amb9174999 [0,0,1,0,1,0|2,0,0]=4 6049 B8R1.8 NCCC1=CC=CC1 Amb27975816 [0,0,1,0,1,0|1,0,1]=4 6050 B8R1.8 NCCC1C=CC=C1 Amb27596137 [0,0,1,0,1,0|1,0,1]=4 6051 B8R1.8 NCC[c-]1cccc1 Amb28341069 [0,0,1,0,1,0|1,0,1]=4 6052 B8R1.8 NCCc1ccco1 Amb1080943 [0,0,1,0,1,0|2,0,0]=4 6053 B8R1.8 NCCc1ccco1 Amb22587649 [0,0,1,0,1,0|2,0,0]=4 6054 B8R1.8 NCCc1cccs1 Amb1073690 [0,0,1,0,1,0|2,0,0]=4 6055 B8R1.8 NCCc1cccs1 Amb6858256 [0,0,1,0,1,0|2,0,0]=4 6056 B8R1.8 NCCc1ccoc1 Amb18833105 [0,0,1,0,1,0|2,0,0]=4 6057 B8R1.8 NCCc1ccoc1 Amb31146576 [0,0,1,0,1,0|2,0,0]=4 6058 B8R1.8 NCCc1ccsc1 Amb2236392 [0,0,1,0,1,0|2,0,0]=4 6059 B8R1.8 NCCc1ccsc1 Amb8631337 [0,0,1,0,1,0|2,0,0]=4 6060 B8R1.8 NCCn1cccc1 Amb2422800 [0,0,1,0,1,0|2,0,0]=4 6061 B8R1.8 NOCc1ccco1 Amb25141783 [0,0,1,0,1,0|2,0,0]=4 6062 B8R1.8 NOCc1cccs1 Amb25189036 [0,0,1,0,1,0|2,0,0]=4 6063 B8R1.8 NOCc1ccoc1 Amb24564546 [0,0,1,0,1,0|2,0,0]=4 6064 B8R1.8 NOCc1ccsc1 Amb24746528 [0,0,1,0,1,0|2,0,0]=4 6065 B8R1.8 OCC=C1C=CC=C1 Amb27662404 [0,0,1,0,1,0|0,0,1]=3 6066 B8R1.8 OCC[n+]1ccsc1 Amb24518966 [0,0,1,0,1,0|2,0,0]=4 6067 B8R1.8 OCCc1ccco1 Amb17089516 [0,0,1,0,1,0|1,0,0]=3 6068 B8R1.8 OCCc1cccs1 Amb2099445 [0,0,1,0,1,0|1,0,0]=3 6069 B8R1.8 OCCc1ccno1 Amb27164449 [0,0,1,0,1,0|2,0,0]=4 6070 B8R1.8 OCCc1ccns1 Amb23441022 [0,0,1,0,1,0|2,0,0]=4 6071 B8R1.8 OCCc1ccoc1 Amb25802261 [0,0,1,0,1,0|1,0,0]=3 6072 B8R1.8 OCCc1ccon1 Amb33198329 [0,0,1,0,1,0|2,0,0]=4 6073 B8R1.8 OCCc1ccsc1 Amb3939119 [0,0,1,0,1,0|1,0,0]=3 6074 B8R1.8 OCCc1ccsn1 Amb28453528 [0,0,1,0,1,0|2,0,0]=4 6075 B8R1.8 OCCc1cnco1 Amb33474917 [0,0,1,0,1,0|2,0,0]=4 6076 B8R1.8 OCCc1cncs1 Amb33544209 [0,0,1,0,1,0|2,0,0]=4 6077 B8R1.8 OCCc1cnoc1 Amb1971497 [0,0,1,0,1,0|2,0,0]=4 6078 B8R1.8 OCCc1cnsc1 Amb32945188 [0,0,1,0,1,0|2,0,0]=4 6079 B8R1.8 OCCc1cocn1 Amb17399797 [0,0,1,0,1,0|2,0,0]=4 6080 B8R1.8 OCCc1cscn1 Amb33548480 [0,0,1,0,1,0|2,0,0]=4 6081 B8R1.8 OCCc1ncco1 Amb27495611 [0,0,1,0,1,0|2,0,0]=4 6082 B8R1.8 OCCc1nccs1 Amb33547163 [0,0,1,0,1,0|2,0,0]=4 6083 B8R1.8 OCCn1cccc1 Amb9174997 [0,0,1,0,1,0|1,0,0]=3 6084 B8R1.8 OCCn1cccn1 Amb6382238 [0,0,1,0,1,0|2,0,0]=4 6085 B8R1.8 OCCn1ccnc1 Amb2688741 [0,0,1,0,1,0|2,0,0]=4 6086 B8R1.8 ONCc1ccco1 Amb23449450 [0,0,1,0,1,0|2,0,0]=4 6087 B8R1.8 ONCc1cccs1 Amb23449451 [0,0,1,0,1,0|2,0,0]=4 6088 B8R1.8 ONCc1ccoc1 Amb28059138 [0,0,1,0,1,0|2,0,0]=4 6089 B8R1.8 ONCc1ccsc1 Amb25994264 [0,0,1,0,1,0|2,0,0]=4 6090 B8R1.8 SCCc1ccco1 Amb24511324 [0,0,1,0,1,0|1,1,0]=4 6091 B8R1.8 SCCc1cccs1 Amb17399886 [0,0,1,0,1,0|1,1,0]=4 6092 B8R1.8 SCCc1ccoc1 Amb33360331 [0,0,1,0,1,0|1,1,0]=4 6093 B8R1.8 SCCc1ccsc1 Amb25300451 [0,0,1,0,1,0|1,1,0]=4 6094 B10R1.348 CC(=O)C1=CC=CC=CN1 Amb25921212 [0,0,1,0,0,1|0,0,2]=4 6095 B10R1.348 CC(=O)C1=CCC=CC=C1 Amb27164696 [0,0,1,0,0,1|0,0,2]=4 6096 B10R1.348 CN(C)C1=CC=CC=CC1 Amb27860366 [0,0,1,0,0,1|2,0,0]=4 6097 B10R1.348 O=C(O)C1=CC=CC=CC1 Amb27948020 [0,0,1,0,0,1|1,0,1]=4 6098 B10R1.348 O=C(O)C1=CC=CC=CO1 Amb27453492 [0,0,1,0,0,1|1,0,1]=4 6099 B10R1.348 O=C(O)C1=CC=CCC=C1 Amb27425007 [0,0,1,0,0,1|1,0,1]=4 6100 B10R1.348 O=C(O)C1=CCC=CC=C1 Amb28118852 [0,0,1,0,0,1|1,0,1]=4 6101 B10R1.85 NCCC1=CC=CC=CO1 Amb27596074 [0,0,1,0,0,1|1,0,0]=3 6102 B10R1.85 NCCC1C=CC=CC=C1 Amb27593509 [0,0,1,0,0,1|1,0,1]=4 6103 B10R1.85 OCCN1C=CC=CC=C1 Amb28124141 [0,0,1,0,0,1|1,0,0]=3 6104 B10R2.136 c1cc(C2CCN2)co1 Amb26483148 [0,0,0,0,1,1|2,0,0]=4 6105 B10R2.136 c1cc(C2CCN2)cs1 Amb26495100 [0,0,0,0,1,1|2,0,0]=4 6106 B10R2.136 c1cc(C2CNC2)co1 Amb25146766 [0,0,0,0,1,1|2,0,0]=4 6107 B10R2.136 c1cc(C2CNC2)cs1 Amb27949058 [0,0,0,0,1,1|2,0,0]=4 6108 B10R2.136 c1cc([C@H]2CCN2)co1 Amb28140298 [0,0,0,0,1,1|2,0,0]=4 6109 B10R2.136 c1ccn(C2CCC2)c1 Amb27202149 [0,0,0,0,1,1|2,0,0]=4 6110 B10R2.136 c1ccn(C2CNC2)c1 Amb24329359 [0,0,0,0,1,1|2,0,0]=4 6111 B10R2.136 c1ccn(C2CNC2)c1 Amb28077646 [0,0,0,0,1,1|2,0,0]=4 6112 B10R2.136 c1cnn(C2COC2)c1 Amb35744515 [0,0,0,0,1,1|2,0,0]=4 6113 B10R2.136 c1coc(C2CCN2)c1 Amb7808808 [0,0,0,0,1,1|2,0,0]=4 6114 B10R2.136 c1coc(C2CCS2)c1 Amb28370026 [0,0,0,0,1,1|1,1,0]=4 6115 B10R2.136 c1coc(C2CNC2)c1 Amb25796595 [0,0,0,0,1,1|2,0,0]=4 6116 B10R2.136 c1coc([C@@H]2CCN2)c1 Amb27953588 [0,0,0,0,1,1|2,0,0]=4 6117 B10R2.136 c1coc([C@H]2CCN2)c1 Amb28125975 [0,0,0,0,1,1|2,0,0]=4 6118 B10R2.136 c1csc(C2CCN2)c1 Amb7808809 [0,0,0,0,1,1|2,0,0]=4 6119 B10R2.136 c1csc(C2CNC2)c1 Amb18065042 [0,0,0,0,1,1|2,0,0]=4 6120 B10R2.136 c1csc([C@H]2CCN2)c1 Amb27629465 [0,0,0,0,1,1|2,0,0]=4 6121 B12R2.2057 C(#CC1CO1)c2ccccc2 Amb25309852 [0,0,0,0,0,2|0,0,0]=2 6122 B12R2.2057 C(=C\C1CC1)/c2ccncc2 Amb27622407 [0,0,0,0,0,2|2,0,0]=4 6123 B12R2.2057 C(=C\C1CO1)/c2ccccc2 Amb32954418 [0,0,0,0,0,2|0,0,0]=2 6124 B12R2.2057 C(=C\C1CO1)/c2ccncc2 Amb27818057 [0,0,0,0,0,2|1,0,0]=3 6125 B12R2.2057 C(=C\[C@@H]1CO1)/c2ccccc2 Amb33081122 [0,0,0,0,0,2|0,0,0]=2 6126 B12R2.2057 C(=C\[C@H]1CO1)/c2ccccc2 Amb33081121 [0,0,0,0,0,2|0,0,0]=2 6127 B12R2.2057 C(=N\C1CC1)/c2ccncc2 Amb26566225 [0,0,0,0,0,2|2,0,0]=4 6128 B12R2.2057 c1cc(CNC2CC2)ccn1 Amb22587107 [0,0,0,0,0,2|2,0,0]=4 6129 B12R2.2057 c1cc(CNC2CC2)ccn1 Amb6356063 [0,0,0,0,0,2|2,0,0]=4 6130 B12R2.2057 c1cc(NCC2CC2)ccn1 Amb2383010 [0,0,0,0,0,2|2,0,0]=4 6131 B12R2.2057 c1cc(SCC2CC2)ccn1 Amb27979300 [0,0,0,0,0,2|2,0,0]=4 6132 B12R2.2057 c1cc(SC[C@@H]2CO2)ccn1 Amb27425165 [0,0,0,0,0,2|1,0,0]=3 6133 B12R2.2057 c1cc(SC[C@H]2CO2)ccn1 Amb27589852 [0,0,0,0,0,2|1,0,0]=3 6134 B12R2.2057 c1ccc(CCC2CO2)cc1 Amb33540498 [0,0,0,0,0,2|0,0,0]=2 6135 B12R2.2057 c1ccc(CC[C@@H]2CO2)cc1 Amb32951908 [0,0,0,0,0,2|0,0,0]=2 6136 B12R2.2057 c1ccc(CC[C@H]2CO2)cc1 Amb33082099 [0,0,0,0,0,2|0,0,0]=2 6137 B12R2.2057 c1ccc(CNC2CC2)cc1 Amb19515725 [0,0,0,0,0,2|1,0,0]=3 6138 B12R2.2057 c1ccc(CNC2CC2)cc1 Amb6662862 [0,0,0,0,0,2|1,0,0]=3 6139 B12R2.2057 c1ccc(CNC2CC2)nc1 Amb6356061 [0,0,0,0,0,2|2,0,0]=4 6140 B12R2.2057 c1ccc(CNC2CC2)nc1 Amb8469754 [0,0,0,0,0,2|2,0,0]=4 6141 B12R2.2057 c1ccc(COC2CC2)cc1 Amb27481431 [0,0,0,0,0,2|1,0,0]=3 6142 B12R2.2057 c1ccc(COC2CO2)cc1 Amb26064453 [0,0,0,0,0,2|0,0,0]=2 6143 B12R2.2057 c1ccc(NCC2CC2)cc1 Amb2383311 [0,0,0,0,0,2|1,0,0]=3 6144 B12R2.2057 c1ccc(NCC2CO2)cc1 Amb27413107 [0,0,0,0,0,2|0,0,0]=2 6145 B12R2.2057 c1ccc(NCC2CO2)nc1 Amb28343184 [0,0,0,0,0,2|1,0,0]=3 6146 B12R2.2057 c1ccc(OCC2CC2)cc1 Amb22752457 [0,0,0,0,0,2|1,0,0]=3 6147 B12R2.2057 c1ccc(OCC2CC2)nc1 Amb24725808 [0,0,0,0,0,2|2,0,0]=4 6148 B12R2.2057 c1ccc(OCC2CO2)cc1 Amb9722480 [0,0,0,0,0,2|0,0,0]=2 6149 B12R2.2057 c1ccc(OC[C@@H]2CO2)cc1 Amb8389341 [0,0,0,0,0,2|0,0,0]=2 6150 B12R2.2057 c1ccc(SCC2CC2)cc1 Amb27485492 [0,0,0,0,0,2|1,0,0]=3 6151 B12R2.2057 c1ccc(SCC2CO2)cc1 Amb33534075 [0,0,0,0,0,2|0,0,0]=2 6152 B12R2.2057 c1ccc(SC[C@@H]2CO2)nc1 Amb27208275 [0,0,0,0,0,2|1,0,0]=3 6153 B12R2.2057 c1ccc(SC[C@H]2CO2)cc1 Amb27775617 [0,0,0,0,0,2|0,0,0]=2 6154 B12R2.2057 c1ccc(SC[C@H]2CO2)nc1 Amb28453705 [0,0,0,0,0,2|1,0,0]=3 6155 B12R2.2057 c1cnc(SC[C@H]2CO2)nc1 Amb27768550 [0,0,0,0,0,2|2,0,0]=4 6156 B12R2.2057 c1cncc(CNC2CC2)c1 Amb22587112 [0,0,0,0,0,2|2,0,0]=4 6157 B12R2.2057 c1cncc(CNC2CC2)c1 Amb6356062 [0,0,0,0,0,2|2,0,0]=4 6158 B12R2.2057 c1cncc(CNC2CC2)c1 Amb6797221 [0,0,0,0,0,2|2,0,0]=4 6159 B12R2.2057 c1cncc(NCC2CC2)c1 Amb2382997 [0,0,0,0,0,2|2,0,0]=4 6160 B12R2.2057 c1cncc(NCC2CO2)c1 Amb27483153 [0,0,0,0,0,2|1,0,0]=3 6161 B12R2.2057 c1cncc(OCC2CO2)c1 Amb27233095 [0,0,0,0,0,2|1,0,0]=3 6162 B12R2.2058 B1CC(Cc2ccccc2)C1 Amb25243383 [0,0,0,0,0,2|1,0,0]=3 6163 B12R2.2058 c1cc(CC2CNC2)ccn1 Amb23598871 [0,0,0,0,0,2|2,0,0]=4 6164 B12R2.2058 c1cc(CC2CNC2)ccn1 Amb35746796 [0,0,0,0,0,2|2,0,0]=4 6165 B12R2.2058 c1cc(CC2COC2)ccn1 Amb32456061 [0,0,0,0,0,2|1,0,0]=3 6166 B12R2.2058 c1cc(NC2CCC2)ccn1 Amb18285881 [0,0,0,0,0,2|2,0,0]=4 6167 B12R2.2058 c1cc(NC2CNC2)ccn1 Amb23598900 [0,0,0,0,0,2|2,0,0]=4 6168 B12R2.2058 c1cc(OC2CNC2)ccn1 Amb19373091 [0,0,0,0,0,2|2,0,0]=4 6169 B12R2.2058 c1cc(OC2CNC2)ccn1 Amb28063349 [0,0,0,0,0,2|2,0,0]=4 6170 B12R2.2058 c1cc(OC2COC2)ccn1 Amb34931990 [0,0,0,0,0,2|1,0,0]=3 6171 B12R2.2058 c1ccc(CC2CCN2)cc1 Amb33552346 [0,0,0,0,0,2|1,0,0]=3 6172 B12R2.2058 c1ccc(CC2CCN2)cc1 Amb7808794 [0,0,0,0,0,2|1,0,0]=3 6173 B12R2.2058 c1ccc(CC2CNC2)cc1 Amb1123190 [0,0,0,0,0,2|1,0,0]=3 6174 B12R2.2058 c1ccc(CC2CNC2)cc1 Amb19373673 [0,0,0,0,0,2|1,0,0]=3 6175 B12R2.2058 c1ccc(CC2CNC2)nc1 Amb23598870 [0,0,0,0,0,2|2,0,0]=4 6176 B12R2.2058 c1ccc(CC2COC2)cc1 Amb27602505 [0,0,0,0,0,2|0,0,0]=2 6177 B12R2.2058 c1ccc(CN2CCC2)cc1 Amb27391196 [0,0,0,0,0,2|2,0,0]=4 6178 B12R2.2058 c1ccc(NC2CCC2)cc1 Amb18283820 [0,0,0,0,0,2|1,0,0]=3 6179 B12R2.2058 c1ccc(NC2CCC2)nc1 Amb18285901 [0,0,0,0,0,2|2,0,0]=4 6180 B12R2.2058 c1ccc(NC2CNC2)cc1 Amb27252900 [0,0,0,0,0,2|1,0,0]=3 6181 B12R2.2058 c1ccc(NC2CNC2)cc1 Amb32686264 [0,0,0,0,0,2|1,0,0]=3 6182 B12R2.2058 c1ccc(NC2CNC2)nc1 Amb23598896 [0,0,0,0,0,2|2,0,0]=4 6183 B12R2.2058 c1ccc(NC2COC2)cc1 Amb33538163 [0,0,0,0,0,2|0,0,0]=2 6184 B12R2.2058 c1ccc(OC2CNC2)cc1 Amb15701497 [0,0,0,0,0,2|1,0,0]=3 6185 B12R2.2058 c1ccc(OC2CNC2)cc1 Amb19312256 [0,0,0,0,0,2|1,0,0]=3 6186 B12R2.2058 c1ccc(OC2CNC2)nc1 Amb22642174 [0,0,0,0,0,2|2,0,0]=4 6187 B12R2.2058 c1ccc(OC2CNC2)nc1 Amb32410916 [0,0,0,0,0,2|2,0,0]=4 6188 B12R2.2058 c1ccc(OC2CNC2)nc1 Amb33744055 [0,0,0,0,0,2|2,0,0]=4 6189 B12R2.2058 c1ccc(OC2COC2)nc1 Amb33609828 [0,0,0,0,0,2|1,0,0]=3 6190 B12R2.2058 c1ccc(SC2CCC2)cc1 Amb10976023 [0,0,0,0,0,2|1,0,0]=3 6191 B12R2.2058 c1ccc(SC2CNC2)cc1 Amb18798478 [0,0,0,0,0,2|1,0,0]=3 6192 B12R2.2058 c1ccc(SC2CNC2)nc1 Amb18798681 [0,0,0,0,0,2|2,0,0]=4 6193 B12R2.2058 c1ccc(SC2COC2)cc1 Amb25145934 [0,0,0,0,0,2|0,0,0]=2 6194 B12R2.2058 c1cnc(SC2COC2)nc1 Amb27802032 [0,0,0,0,0,2|2,0,0]=4 6195 B12R2.2058 c1cncc(CC2CNC2)c1 Amb23598850 [0,0,0,0,0,2|2,0,0]=4 6196 B12R2.2058 c1cncc(CC2COC2)c1 Amb32456059 [0,0,0,0,0,2|1,0,0]=3 6197 B12R2.2058 c1cncc(NC2CCC2)c1 Amb18957036 [0,0,0,0,0,2|2,0,0]=4 6198 B12R2.2058 c1cncc(NC2CNC2)c1 Amb27856903 [0,0,0,0,0,2|2,0,0]=4 6199 B12R2.2058 c1cncc(NC2COC2)c1 Amb27209461 [0,0,0,0,0,2|1,0,0]=3 6200 B12R2.2058 c1cncc(OC2CNC2)c1 Amb21956447 [0,0,0,0,0,2|2,0,0]=4 6201 B12R2.2058 c1cncc(OC2CNC2)c1 Amb22490470 [0,0,0,0,0,2|2,0,0]=4 6202 B12R2.2 C1=C(c2ccccc2)CCC1 Amb4317492 [0,0,0,0,0,2|1,0,1]=4 6203 B12R2.2 C1=C(c2ccccc2)CNC1 Amb22059494 [0,0,0,0,0,2|1,0,1]=4 6204 B12R2.2 C1=C(c2ccccc2)CNC1 Amb30584704 [0,0,0,0,0,2|1,0,1]=4 6205 B12R2.2 C1=C(c2ccccc2)NCC1 Amb17938860 [0,0,0,0,0,2|1,0,1]=4 6206 B12R2.2 C1=CC(c2ccccc2)C=C1 Amb24351108 [0,0,0,0,0,2|1,0,1]=4 6207 B12R2.2 C1=CCC(c2ccccc2)=C1 Amb27484884 [0,0,0,0,0,2|1,0,1]=4 6208 B12R2.2 C1=CCP(c2ccccc2)C1 Amb25736369 [0,0,0,0,0,2|2,0,0]=4 6209 B12R2.2 C1=CNC(c2ccccc2)N1 Amb27617406 [0,0,0,0,0,2|1,0,1]=4 6210 B12R2.2 C1=CSC(c2ccccc2)N1 Amb27462150 [0,0,0,0,0,2|0,1,1]=4 6211 B12R2.2 C1=NC(c2cccnc2)CC1 Amb17616205 [0,0,0,0,0,2|2,0,0]=4 6212 B12R2.2 C1=NCCN1c2ccccc2 Amb22527125 [0,0,0,0,0,2|2,0,0]=4 6213 B12R2.2 C1=NNC(c2ccccc2)C1 Amb2797582 [0,0,0,0,0,2|1,0,0]=3 6214 B12R2.2 C1=N[C@@H](c2ccccc2)CN1 Amb27174575 [0,0,0,0,0,2|1,0,0]=3 6215 B12R2.2 c1cc(C2CCCN2)ccn1 Amb17659139 [0,0,0,0,0,2|2,0,0]=4 6216 B12R2.2 c1cc(C2CCCS2)ccn1 Amb19373819 [0,0,0,0,0,2|1,1,0]=4 6217 B12R2.2 c1cc(C2CCNC2)ccn1 Amb22233781 [0,0,0,0,0,2|2,0,0]=4 6218 B12R2.2 c1cc(C2CCNC2)ccn1 Amb33551300 [0,0,0,0,0,2|2,0,0]=4 6219 B12R2.2 c1cc(C2CCNC2)ccn1 Amb3940962 [0,0,0,0,0,2|2,0,0]=4 6220 B12R2.2 c1cc(C2CCOC2)ncn1 Amb33070127 [0,0,0,0,0,2|2,0,0]=4 6221 B12R2.2 c1cc(C2CNCO2)ccn1 Amb18065319 [0,0,0,0,0,2|1,0,0]=3 6222 B12R2.2 c1cc(C2NCCO2)ccn1 Amb17334300 [0,0,0,0,0,2|1,0,0]=3 6223 B12R2.2 c1cc(C2NCCS2)ccn1 Amb6751973 [0,0,0,0,0,2|1,1,0]=4 6224 B12R2.2 c1cc(C2OCCO2)ccn1 Amb17334309 [0,0,0,0,0,2|1,0,0]=3 6225 B12R2.2 c1cc([C@@H]2CCCN2)ccn1 Amb26413775 [0,0,0,0,0,2|2,0,0]=4 6226 B12R2.2 c1cc([C@H]2CCCN2)ccn1 Amb26565678 [0,0,0,0,0,2|2,0,0]=4 6227 B12R2.2 c1ccc(-c2ccco2)cc1 Amb8390025 [0,0,0,0,0,2|0,0,2]=4 6228 B12R2.2 c1ccc(-c2ccno2)cc1 Amb2191136 [0,0,0,0,0,2|0,0,2]=4 6229 B12R2.2 c1ccc(-c2ccoc2)cc1 Amb27155517 [0,0,0,0,0,2|0,0,2]=4 6230 B12R2.2 c1ccc(-c2cnco2)cc1 Amb2725800 [0,0,0,0,0,2|0,0,2]=4 6231 B12R2.2 c1ccc(-c2cnoc2)cc1 Amb33542838 [0,0,0,0,0,2|0,0,2]=4 6232 B12R2.2 c1ccc(-c2cnon2)cc1 Amb9791661 [0,0,0,0,0,2|0,0,2]=4 6233 B12R2.2 c1ccc(-c2cocn2)cc1 Amb17399894 [0,0,0,0,0,2|0,0,2]=4 6234 B12R2.2 c1ccc(-c2ncco2)cc1 Amb5494173 [0,0,0,0,0,2|0,0,2]=4 6235 B12R2.2 c1ccc(-c2ncno2)cc1 Amb10552927 [0,0,0,0,0,2|0,0,2]=4 6236 B12R2.2 c1ccc(-c2ncon2)cc1 Amb28457268 [0,0,0,0,0,2|0,0,2]=4 6237 B12R2.2 c1ccc(-c2nnco2)cc1 Amb669572 [0,0,0,0,0,2|0,0,2]=4 6238 B12R2.2 c1ccc(B2OCCO2)nc1 Amb22490930 [0,0,0,0,0,2|2,0,0]=4 6239 B12R2.2 c1ccc(C2=NCCC2)cc1 Amb1106418 [0,0,0,0,0,2|1,0,1]=4 6240 B12R2.2 c1ccc(C2=NCCN2)cc1 Amb3940399 [0,0,0,0,0,2|1,0,1]=4 6241 B12R2.2 c1ccc(C2=NCCO2)cc1 Amb18063911 [0,0,0,0,0,2|0,0,1]=3 6242 B12R2.2 c1ccc(C2=NCCO2)nc1 Amb24100586 [0,0,0,0,0,2|1,0,1]=4 6243 B12R2.2 c1ccc(C2=NNCC2)cc1 Amb25354740 [0,0,0,0,0,2|1,0,1]=4 6244 B12R2.2 c1ccc(C2=NOCN2)cc1 Amb28120203 [0,0,0,0,0,2|0,0,1]=3 6245 B12R2.2 c1ccc(C2CCCC2)cc1 Amb9787161 [0,0,0,0,0,2|1,0,0]=3 6246 B12R2.2 c1ccc(C2CCCC2)nc1 Amb23589711 [0,0,0,0,0,2|2,0,0]=4 6247 B12R2.2 c1ccc(C2CCCN2)cc1 Amb10808365 [0,0,0,0,0,2|1,0,0]=3 6248 B12R2.2 c1ccc(C2CCCN2)cc1 Amb9702996 [0,0,0,0,0,2|1,0,0]=3 6249 B12R2.2 c1ccc(C2CCCN2)nc1 Amb21960411 [0,0,0,0,0,2|2,0,0]=4 6250 B12R2.2 c1ccc(C2CCCN2)nc1 Amb2235736 [0,0,0,0,0,2|2,0,0]=4 6251 B12R2.2 c1ccc(C2CCCN2)nc1 Amb30586497 [0,0,0,0,0,2|2,0,0]=4 6252 B12R2.2 c1ccc(C2CCCO2)cc1 Amb17334283 [0,0,0,0,0,2|0,0,0]=2 6253 B12R2.2 c1ccc(C2CCC[NH2+]2)cc1 Amb33512932 [0,0,0,0,0,2|1,0,0]=3 6254 B12R2.2 c1ccc(C2CCNC2)cc1 Amb10069263 [0,0,0,0,0,2|1,0,0]=3 6255 B12R2.2 c1ccc(C2CCNC2)cc1 Amb10072809 [0,0,0,0,0,2|1,0,0]=3 6256 B12R2.2 c1ccc(C2CCNC2)cc1 Amb701982 [0,0,0,0,0,2|1,0,0]=3 6257 B12R2.2 c1ccc(C2CCNC2)nc1 Amb10808435 [0,0,0,0,0,2|2,0,0]=4 6258 B12R2.2 c1ccc(C2CCNC2)nc1 Amb32719303 [0,0,0,0,0,2|2,0,0]=4 6259 B12R2.2 c1ccc(C2CCNC2)nc1 Amb3941368 [0,0,0,0,0,2|2,0,0]=4 6260 B12R2.2 c1ccc(C2CCOC2)nc1 Amb24320768 [0,0,0,0,0,2|1,0,0]=3 6261 B12R2.2 c1ccc(C2CCSC2)cc1 Amb4140293 [0,0,0,0,0,2|0,1,0]=3 6262 B12R2.2 c1ccc(C2CC[NH2+]C2)cc1 Amb4258873 [0,0,0,0,0,2|1,0,0]=3 6263 B12R2.2 c1ccc(C2CNCO2)cc1 Amb18065307 [0,0,0,0,0,2|0,0,0]=2 6264 B12R2.2 c1ccc(C2CNCO2)nc1 Amb18065316 [0,0,0,0,0,2|1,0,0]=3 6265 B12R2.2 c1ccc(C2NCCN2)nc1 Amb27817731 [0,0,0,0,0,2|2,0,0]=4 6266 B12R2.2 c1ccc(C2NCCO2)cc1 Amb17334284 [0,0,0,0,0,2|0,0,0]=2 6267 B12R2.2 c1ccc(C2NCCO2)nc1 Amb17334298 [0,0,0,0,0,2|1,0,0]=3 6268 B12R2.2 c1ccc(C2NCCP2)cc1 Amb27606514 [0,0,0,0,0,2|1,0,0]=3 6269 B12R2.2 c1ccc(C2NCCS2)cc1 Amb3466213 [0,0,0,0,0,2|0,1,0]=3 6270 B12R2.2 c1ccc(C2OCCO2)cc1 Amb9786741 [0,0,0,0,0,2|0,0,0]=2 6271 B12R2.2 c1ccc(C2OCCO2)nc1 Amb17334307 [0,0,0,0,0,2|1,0,0]=3 6272 B12R2.2 c1ccc(C2SCCS2)cc1 Amb23401446 [0,0,0,0,0,2|0,1,0]=3 6273 B12R2.2 c1ccc(N2CCCC2)cc1 Amb8391946 [0,0,0,0,0,2|2,0,0]=4 6274 B12R2.2 c1ccc(N2CCNC2)cc1 Amb27785561 [0,0,0,0,0,2|2,0,0]=4 6275 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb20241933 [0,0,0,0,0,2|1,0,0]=3 6276 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb8397178 [0,0,0,0,0,2|1,0,0]=3 6277 B12R2.2 c1ccc([C@@H]2CCCN2)nc1 Amb22802416 [0,0,0,0,0,2|2,0,0]=4 6278 B12R2.2 c1ccc([C@@H]2CCNC2)cc1 Amb19888399 [0,0,0,0,0,2|1,0,0]=3 6279 B12R2.2 c1ccc([C@@H]2CCNC2)cc1 Amb27617269 [0,0,0,0,0,2|1,0,0]=3 6280 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb20241932 [0,0,0,0,0,2|1,0,0]=3 6281 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb8397179 [0,0,0,0,0,2|1,0,0]=3 6282 B12R2.2 c1ccc([C@H]2CCCN2)nc1 Amb22754034 [0,0,0,0,0,2|2,0,0]=4 6283 B12R2.2 c1ccc([C@H]2CCNC2)cc1 Amb19887561 [0,0,0,0,0,2|1,0,0]=3 6284 B12R2.2 c1ccc([C@H]2CCNC2)cc1 Amb24183516 [0,0,0,0,0,2|1,0,0]=3 6285 B12R2.2 c1ccc([C@H]2COCN2)cc1 Amb25877610 [0,0,0,0,0,2|0,0,0]=2 6286 B12R2.2 c1cncc(C2=NCCO2)c1 Amb10813641 [0,0,0,0,0,2|1,0,1]=4 6287 B12R2.2 c1cncc(C2CCCC2)c1 Amb25121665 [0,0,0,0,0,2|2,0,0]=4 6288 B12R2.2 c1cncc(C2CCCN2)c1 Amb17659140 [0,0,0,0,0,2|2,0,0]=4 6289 B12R2.2 c1cncc(C2CCCN2)c1 Amb32409359 [0,0,0,0,0,2|2,0,0]=4 6290 B12R2.2 c1cncc(C2CCCS2)c1 Amb19373816 [0,0,0,0,0,2|1,1,0]=4 6291 B12R2.2 c1cncc(C2CCNC2)c1 Amb19958035 [0,0,0,0,0,2|2,0,0]=4 6292 B12R2.2 c1cncc(C2CCNC2)c1 Amb22490712 [0,0,0,0,0,2|2,0,0]=4 6293 B12R2.2 c1cncc(C2CCNC2)c1 Amb30647467 [0,0,0,0,0,2|2,0,0]=4 6294 B12R2.2 c1cncc(C2CCNC2)c1 Amb3938889 [0,0,0,0,0,2|2,0,0]=4 6295 B12R2.2 c1cncc(C2CCOC2)c1 Amb24320767 [0,0,0,0,0,2|1,0,0]=3 6296 B12R2.2 c1cncc(C2CNCO2)c1 Amb18065317 [0,0,0,0,0,2|1,0,0]=3 6297 B12R2.2 c1cncc(C2NCCO2)c1 Amb17334299 [0,0,0,0,0,2|1,0,0]=3 6298 B12R2.2 c1cncc(C2NCCS2)c1 Amb7605937 [0,0,0,0,0,2|1,1,0]=4 6299 B12R2.2 c1cncc(C2NNCO2)c1 Amb28249019 [0,0,0,0,0,2|1,0,0]=3 6300 B12R2.2 c1cncc(C2OCCO2)c1 Amb17334308 [0,0,0,0,0,2|1,0,0]=3 6301 B12R2.2 c1cncc([C@@H]2CCCN2)c1 Amb33871642 [0,0,0,0,0,2|2,0,0]=4 6302 B12R2.2 c1cncc([C@@H]2CCCN2)c1 Amb8630852 [0,0,0,0,0,2|2,0,0]=4 6303 B12R2.2 c1cncc([C@H]2CCCN2)c1 Amb22748224 [0,0,0,0,0,2|2,0,0]=4 6304 B12R2.2 c1cncc([C@H]2CCCN2)c1 Amb22899133 [0,0,0,0,0,2|2,0,0]=4 6305 B12R2.2 c1cncc([C@H]2CCCN2)c1 Amb31291285 [0,0,0,0,0,2|2,0,0]=4 6306 B12R2.2 c1ncc(C2OCCO2)cn1 Amb25710715 [0,0,0,0,0,2|2,0,0]=4 6307 B12R2.2 c1ncc(C2OCCS2)cn1 Amb27865355 [0,0,0,0,0,2|2,0,0]=4