0 B18R2.38706 Cc1cc(cc(Br)c1O)\N=N\c2ccccc2 Amb22349256 [0,0,0,0,0,0|3,0,0]=3 1 B18R2.38706 Cc1cc(cc(C)c1I)OCc2ccccc2 Amb21962153 [0,0,0,0,0,0|2,0,1]=3 2 B18R2.38706 Cc1cc(cc(C)c1N)NCc2c[n]ccc2 Amb23263307 [0,0,0,0,0,0|3,0,1]=4 3 B18R2.38706 Cc1cc(cc(C)c1N)NCc2cc[n]cc2 Amb23263308 [0,0,0,0,0,0|3,0,1]=4 4 B18R2.38706 Cc1cc(cc(C)c1N)NCc2cccc[n]2 Amb23263309 [0,0,0,0,0,0|3,0,1]=4 5 B18R2.38706 Cc1cc(cc(C)c1N)NCc2ccccc2 Amb23263301 [0,0,0,0,0,0|2,0,1]=3 6 B18R2.38706 Cc1cc(cc(C)c1N)OCc2ccccc2 Amb25043790 [0,0,0,0,0,0|2,0,1]=3 7 B18R2.38706 Clc1c(Cl)cc(cc1Cl)\N=C\c2ccccc2 Amb22447839 [0,0,0,0,0,0|4,0,0]=4 8 B18R2.38706 Oc1c(Br)cc(cc1Br)OCc2ccccc2 Amb23438862 [0,0,0,0,0,0|3,0,1]=4 9 B18R2.38706 Oc1c(Cl)cc(cc1Cl)OCc2ccccc2 Amb25246323 [0,0,0,0,0,0|3,0,1]=4 10 B18R2.38706 Oc1c(Cl)cc(cc1Cl)\N=N\c2ccccc2 Amb22369364 [0,0,0,0,0,0|4,0,0]=4 11 B17R2.193 CN1N=C(\C=C\c2ccccc2)C=CC1=O Amb21933375 [1,0,0,0,0,0|2,0,1]=4 12 B17R2.193 Cc1cc(ccc1C)OCc2ccccc2 Amb25168747 [1,0,0,0,0,0|2,0,1]=4 13 B17R2.193 Cc1cc(ccc1Cl)OCc2ccccc2 Amb22451441 [1,0,0,0,0,0|2,0,1]=4 14 B17R2.193 Cc1cc(ccc1F)NCc2ccccc2 Amb24693534 [1,0,0,0,0,0|2,0,1]=4 15 B17R2.193 Cc1cc(ccc1N)N=Nc2ccccc2 Amb24065759 [1,0,0,0,0,0|3,0,0]=4 16 B17R2.193 Cc1cc(ccc1O)NCc2ccccc2 Amb24736877 [1,0,0,0,0,0|1,0,1]=3 17 B17R2.193 Cc1ccc(cc1C)N=Cc2ccccc2 Amb22483989 [1,0,0,0,0,0|2,0,0]=3 18 B17R2.193 Clc1ccc(cc1Cl)C=Cc2cccc[n]2 Amb22469437 [1,0,0,0,0,0|3,0,0]=4 19 B17R2.193 Fc1ccc(cc1C)CNc2ccccc2 Amb17404428 [1,0,0,0,0,0|2,0,1]=4 20 B17R2.193 Nc1cc(ccc1O)OCc2ccccc2 Amb18131930 [1,0,0,0,0,0|2,0,1]=4 21 B17R2.193 Nc1ccc(cc1C)OCc2ccccc2 Amb1114913 [1,0,0,0,0,0|2,0,1]=4 22 B17R2.193 Nc1ncc(cc1C)\C=C\c2ccccc2 Amb17644492 [1,0,0,0,0,0|2,0,0]=3 23 B17R2.193 Oc1ccc(\C=N\c2c[n]ccc2)cc1O Amb24060593 [1,0,0,0,0,0|3,0,0]=4 24 B17R2.193 Oc1ccc(cc1Br)OCc2ccccc2 Amb23438858 [1,0,0,0,0,0|2,0,1]=4 25 B17R2.193 Oc1ccc(cc1Cl)OCc2ccccc2 Amb24563131 [1,0,0,0,0,0|2,0,1]=4 26 B17R2.193 Oc1ccc(cc1Cl)\C=C\c2cc[n]c[n]2 Amb24267525 [1,0,0,0,0,0|3,0,0]=4 27 B17R2.193 Oc1ccc(cc1F)OCc2ccccc2 Amb25050085 [1,0,0,0,0,0|2,0,1]=4 28 B17R2.193 Oc1ccc(cc1F)\C=C\c2cc[n]c[n]2 Amb24267526 [1,0,0,0,0,0|3,0,0]=4 29 B17R2.193 Oc1ccc(cc1O)\C=C\c2cc[n]cc2 Amb24060584 [1,0,0,0,0,0|2,0,0]=3 30 B17R2.193 Oc1ccc(cc1S)OCc2ccccc2 Amb25168756 [1,0,0,0,0,0|2,0,1]=4 31 B17R2.3212 CC1=CC(=O)C=C(\C=C\c2ccccc2)O1 Amb18048668 [1,0,0,0,0,0|2,0,0]=3 32 B17R2.3212 Cc1c[n+](cc(C)c1)OCc2ccccc2 Amb22434695 [1,0,0,0,0,0|2,0,1]=4 33 B17R2.3212 Cc1cc(C#Cc2ccccc2)[n]c(C)c1 Amb24101714 [1,0,0,0,0,0|1,0,2]=4 34 B17R2.3212 Cc1cc(COc2ccccc2)cc(C)c1 Amb22266268 [1,0,0,0,0,0|1,0,1]=3 35 B17R2.3212 Cc1cc(\C=C\c2ccccc2)cc([o+]1)C Amb10561375 [1,0,0,0,0,0|1,0,0]=2 36 B17R2.3212 Cc1cc(cc(F)c1)NCc2ccccc2 Amb25225153 [1,0,0,0,0,0|2,0,1]=4 37 B17R2.3212 Cc1cc(cc(N)c1)NCc2ccccc2 Amb24446008 [1,0,0,0,0,0|2,0,1]=4 38 B17R2.3212 Cc1cc(cc(O)c1)OCc2ccccc2 Amb25729121 [1,0,0,0,0,0|2,0,1]=4 39 B17R2.3212 OC=1C=C(\C=C\c2ccccc2)OC(=O)C1 Amb18048678 [1,0,0,0,0,0|3,0,0]=4 40 B19R2.17333 Cc1c(cc(C)c(Br)c1C)OCc2ccccc2 Amb25746160 [0,1,0,0,0,0|2,0,1]=4 41 B19R2.43094 Cc1cc(cc(C)c1C=O)OCc2ccccc2 Amb21962154 [0,1,0,0,0,0|1,0,2]=4 42 B19R2.43094 Cc1cc(cc(C)c1CBr)OCc2ccccc2 Amb24065109 [0,1,0,0,0,0|2,0,1]=4 43 B19R2.61301 Brc1cc(cc(c1O)Br)\C=[N+](\c2ccccc2)/[O-] Amb2580664 [0,1,0,0,0,0|3,0,0]=4 44 B19R2.61301 Cc1cc(NC(=N)c2ccccc2)[n]c(C)c1Br Amb24083548 [0,1,0,0,0,0|3,0,0]=4 45 B19R2.61301 Cc1cc(cc(Br)c1O)NC(=O)c2c[n]ccc2 Amb23491402 [0,1,0,0,0,0|3,0,0]=4 46 B19R2.61301 Cc1cc(cc(Br)c1O)NC(=O)c2ccccc2 Amb23491334 [0,1,0,0,0,0|2,0,0]=3 47 B19R2.61301 O=C(c1ccccc1)N=C2C=C(C)C(=O)C(=C2)C Amb2542213 [0,1,0,0,0,0|1,0,1]=3 48 B19R2.61301 [O-]\[N+](=C\c1cc(Br)c(O)c(Br)c1)\c2ccccc2 Amb19825328 [0,1,0,0,0,0|3,0,0]=4 49 B19R2.61303 Cc1cc(cc(C)c1O)C(=O)Cc2ccccc2 Amb22057366 [0,1,0,0,0,0|0,0,1]=2 50 B19R2.504116 Cc1c(C)cc(cc1C)OCc2ccccc2Br Amb22484902 [0,1,0,0,0,0|2,0,1]=4 51 B19R2.1294342 CC1=CC(=NSc2ccc(cc2)C)C=C(C1=O)C Amb1200218 [0,1,0,0,0,0|2,0,1]=4 52 B19R2.1294342 CC1=CC(=NSc2ccc(cc2)Cl)C=C(C1=O)C Amb1147956 [0,1,0,0,0,0|2,0,1]=4 53 B19R2.1294342 Oc1ccc(cc1)\C=C\c2cc(O)c(c(c2)O)O Amb15692642 [0,1,0,0,0,0|2,0,0]=3 54 B17R2.36760 Brc1cc(Cc2ccccc2)cc(c1O)Br Amb10788824 [0,0,0,0,1,0|2,0,1]=4 55 B17R2.36760 Cc1[n]c(Nc2ccccc2)[n]c(C)c1O Amb24106232 [0,0,0,0,1,0|3,0,0]=4 56 B17R2.36760 Cc1cc(cc(C)c1N)Nc2ccccc2 Amb23263300 [0,0,0,0,1,0|2,0,0]=3 57 B17R2.36760 Cc1cc(cc(C)c1N)Oc2ccccc2 Amb23263319 [0,0,0,0,1,0|2,0,0]=3 58 B17R2.36760 Cc1cc(cc(C)c1N)Sc2ccccc2 Amb23263331 [0,0,0,0,1,0|2,0,0]=3 59 B17R2.36760 Clc1cc(Cc2ccccc2)cc(c1O)Cl Amb10788825 [0,0,0,0,1,0|2,0,1]=4 60 B17R2.36760 Ic1cc(Cc2ccccc2)cc(c1O)I Amb10788857 [0,0,0,0,1,0|2,0,1]=4 61 B17R2.36760 Nc1cc(Cc2ccccc2)cc(Br)c1O Amb22011172 [0,0,0,0,1,0|2,0,1]=4 62 B17R2.36760 Nc1cc(Cc2ccccc2)cc(Cl)c1O Amb22011171 [0,0,0,0,1,0|2,0,1]=4 63 B19R2.867575 Brc1cc(\C=N\Nc2ccccc2)cc(c1O)Br Amb1203224 [0,0,0,0,0,1|3,0,0]=4 64 B19R2.867575 Cc1cc(\C=N\Cc2ccccc2)cc(C)c1O Amb24448474 [0,0,0,0,0,1|0,0,1]=2 65 B16R2.132 Brc1ccc(cc1)\C=N\c2ccccc2 Amb2227969 [2,0,0,0,0,0|2,0,0]=4 66 B16R2.132 Cc1ccc(cc1)C=Cc2ccccc2 Amb24323238 [2,0,0,0,0,0|1,0,0]=3 67 B16R2.132 Clc1ccc(\C=C\[n+]2ccccc2)cc1 Amb22481438 [2,0,0,0,0,0|2,0,0]=4 68 B16R2.132 Clc1ccc(cc1)C=Cc2cccc[n]2 Amb24080809 [2,0,0,0,0,0|2,0,0]=4 69 B16R2.132 Clc1ccc(cc1)\C=C\c2ccccc2 Amb10568579 [2,0,0,0,0,0|1,0,0]=3 70 B16R2.132 Clc1ccc(cc1)\C=C\c2ccncc2 Amb1261620 [2,0,0,0,0,0|2,0,0]=4 71 B16R2.132 Clc1ccc(cc1)\C=N\c2ccccc2 Amb2227970 [2,0,0,0,0,0|2,0,0]=4 72 B16R2.132 Clc1ccc(cc1)\N=C\c2ccccc2 Amb1652633 [2,0,0,0,0,0|2,0,0]=4 73 B16R2.132 Fc1ccc(cc1)\C=N\c2ccccc2 Amb2227967 [2,0,0,0,0,0|2,0,0]=4 74 B16R2.132 Fc1ccc(cc1)\N=C\c2ccccc2 Amb2227968 [2,0,0,0,0,0|2,0,0]=4 75 B16R2.132 Nc1ccc(cc1)\C=C\c2cccc[n]2 Amb22587642 [2,0,0,0,0,0|2,0,0]=4 76 B16R2.132 Nc1ccc(cc1)\C=C\c2ccncc2 Amb2369841 [2,0,0,0,0,0|2,0,0]=4 77 B16R2.132 Oc1ccc(CCc2ccccc2)cc1 Amb24066192 [2,0,0,0,0,0|0,0,2]=4 78 B16R2.132 Oc1ccc(cc1)C#Cc2ccccc2 Amb10610495 [2,0,0,0,0,0|0,0,2]=4 79 B16R2.132 Oc1ccc(cc1)CNc2ccccc2 Amb10609692 [2,0,0,0,0,0|1,0,1]=4 80 B16R2.132 Oc1ccc(cc1)N=Cc2ccccc2 Amb24100980 [2,0,0,0,0,0|1,0,0]=3 81 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 Amb24096852 [2,0,0,0,0,0|1,0,1]=4 82 B16R2.132 Oc1ccc(cc1)OCc2ccccc2 Amb1228378 [2,0,0,0,0,0|1,0,1]=4 83 B16R2.132 Oc1ccc(cc1)SCc2ccccc2 Amb22353244 [2,0,0,0,0,0|1,0,1]=4 84 B16R2.132 Oc1ccc(cc1)\C=C\c2ccccn2 Amb1273313 [2,0,0,0,0,0|1,0,0]=3 85 B16R2.132 Oc1ccc(cc1)\C=C\c2ccncc2 Amb1156036 [2,0,0,0,0,0|1,0,0]=3 86 B16R2.132 Oc1ccc(cc1)\C=N\c2ccccc2 Amb2228617 [2,0,0,0,0,0|1,0,0]=3 87 B16R2.132 Oc1ccc(cc1)\N=C\c2ccccn2 Amb1981670 [2,0,0,0,0,0|2,0,0]=4 88 B16R2.132 Oc1ccc(cc1)\N=N\c2ccccc2 Amb1153077 [2,0,0,0,0,0|2,0,0]=4 89 B16R2.132 Oc1ccc(nn1)\C=C\c2ccccc2 Amb2406450 [2,0,0,0,0,0|2,0,0]=4 90 B16R2.252 Brc1cc(\C=C\[n+]2ccccc2)ccc1 Amb22442804 [2,0,0,0,0,0|2,0,0]=4 91 B16R2.252 Cc1cc(\C=C\c2ccccc2)[n]cc1 Amb24086466 [2,0,0,0,0,0|1,0,0]=3 92 B16R2.252 Cc1cc(ccc1)C#Cc2ccccc2 Amb25662033 [2,0,0,0,0,0|0,0,2]=4 93 B16R2.252 Cc1cc(ccc1)OCc2ccccc2 Amb20622231 [2,0,0,0,0,0|1,0,1]=4 94 B16R2.252 Cc1cc(ccc1)\C=C\c2cc[n]cc2 Amb22446668 [2,0,0,0,0,0|1,0,0]=3 95 B16R2.252 Cc1cccc(C=Cc2ccccc2)[n]1 Amb24065785 [2,0,0,0,0,0|1,0,0]=3 96 B16R2.252 Cc1cccc(\C=C\c2ccccc2)[n]1 Amb22350293 [2,0,0,0,0,0|1,0,0]=3 97 B16R2.252 Cc1cccc(c1)N=Cc2ccccc2 Amb15693434 [2,0,0,0,0,0|1,0,0]=3 98 B16R2.252 Clc1cc(\C=C\[n+]2ccccc2)ccc1 Amb22442790 [2,0,0,0,0,0|2,0,0]=4 99 B16R2.252 Clc1cc(ccc1)\C=C\c2cc[n]cc2 Amb22410783 [2,0,0,0,0,0|2,0,0]=4 100 B16R2.252 Clc1cccc(c1)\C=C\c2ccccc2 Amb10554706 [2,0,0,0,0,0|1,0,0]=3 101 B16R2.252 Fc1cc(ccc1)C=Cc2cc[n]cc2 Amb24077020 [2,0,0,0,0,0|2,0,0]=4 102 B16R2.252 Fc1cc(ccc1)\C=C\c2cc[n]cc2 Amb21955762 [2,0,0,0,0,0|2,0,0]=4 103 B16R2.252 Nc1cc(ccc1)\C=C\c2ccccc2 Amb18137668 [2,0,0,0,0,0|1,0,0]=3 104 B16R2.252 Nc1cccc(c1)C=Cc2ccccn2 Amb15740501 [2,0,0,0,0,0|2,0,0]=4 105 B16R2.252 Nc1nccc(c1)\C=C\c2ccccc2 Amb17217398 [2,0,0,0,0,0|2,0,0]=4 106 B16R2.252 Oc1ccc[n+](c1)\C=C/c2ccccc2 Amb10554511 [2,0,0,0,0,0|2,0,0]=4 107 B16R2.252 [O-][n+]1cccc(c1)\C=C\c2ccccc2 Amb10554501 [2,0,0,0,0,0|2,0,0]=4 108 B18R2.249 Nc1cc(ccc1O)OC(=O)c2ccccc2 Amb22289138 [1,1,0,0,0,0|2,0,0]=4 109 B18R2.249 O=C(c1ccccc1)Nc2ccc(c(c2)Br)O Amb2542312 [1,1,0,0,0,0|2,0,0]=4 110 B18R2.249 O=C(c1ccccc1)Nc2ccc(c(c2)C)O Amb1032767 [1,1,0,0,0,0|1,0,0]=3 111 B18R2.276 Cc1cc(ccc1Br)C(=O)Nc2ccccc2 Amb22301535 [1,1,0,0,0,0|2,0,0]=4 112 B18R2.276 Cc1cc(ccc1Cl)C(=O)Cc2ccccc2 Amb19886374 [1,1,0,0,0,0|1,0,1]=4 113 B18R2.276 Cc1cc(ccc1F)C(=O)Cc2ccccc2 Amb19886368 [1,1,0,0,0,0|1,0,1]=4 114 B18R2.276 Cc1cc(ccc1O)C(N)Cc2ccccc2 Amb24102641 [1,1,0,0,0,0|0,0,2]=4 115 B18R2.276 O=C(c1ccc(c(c1)C)C)Cc2ccccc2 Amb2539816 [1,1,0,0,0,0|1,0,1]=4 116 B18R2.276 O=C(c1ccc(c(c1)C)N)Nc2ccccc2 Amb1111815 [1,1,0,0,0,0|2,0,0]=4 117 B18R2.276 Oc1ccc(cc1Cl)C(=O)Cc2ccccc2 Amb24064164 [1,1,0,0,0,0|1,0,1]=4 118 B18R2.2686 COc1cc(\C=C\c2ccccc2)ccc1O Amb2554864 [1,1,0,0,0,0|0,0,0]=2 119 B18R2.2686 COc1cc(\C=C\c2ccccn2)ccc1O Amb2100255 [1,1,0,0,0,0|1,0,0]=3 120 B18R2.2686 COc1cc(ccc1O)C=Cc2ccccc2 Amb24079589 [1,1,0,0,0,0|0,0,0]=2 121 B18R2.2686 COc1cc(ccc1O)OCc2ccccc2 Amb18660628 [1,1,0,0,0,0|1,0,1]=4 122 B18R2.2686 Oc1ccc(cc1CO)OCc2ccccc2 Amb24698772 [1,1,0,0,0,0|1,0,1]=4 123 B18R2.2686 Oc1ccc(cc1CO)\N=N\c2ccccc2 Amb20411104 [1,1,0,0,0,0|2,0,0]=4 124 B18R2.6533 Cc1cc(NCc2ccccc2)c(C)cc1O Amb25745979 [1,1,0,0,0,0|1,0,1]=4 125 B18R2.9259 Cc1ccc(cc1)\N=C\c2ccc(c(c2)I)O Amb1828322 [1,1,0,0,0,0|2,0,0]=4 126 B18R2.32351 Oc1ccc(c(c1O)O)\C=N\c2ccccc2 Amb2269262 [1,1,0,0,0,0|2,0,0]=4 127 B18R2.39765 Cc1cc(ccc1Cl)\N=C/c2ccccc2O Amb19829009 [1,1,0,0,0,0|2,0,0]=4 128 B18R2.39765 Cc1cc(ccc1Cl)\N=C\c2ccccc2O Amb22458111 [1,1,0,0,0,0|2,0,0]=4 129 B18R2.39765 Cc1cc(ccc1F)\N=C/c2ccccc2O Amb19829001 [1,1,0,0,0,0|2,0,0]=4 130 B18R2.39765 Cc1cc(ccc1F)\N=C\c2ccccc2O Amb22458112 [1,1,0,0,0,0|2,0,0]=4 131 B18R2.39765 Fc1ccccc1\C=N\c2ccc(c(c2)C)F Amb2444101 [1,1,0,0,0,0|2,0,0]=4 132 B18R2.154 COC=1C=C(\C=C\c2ccccc2)OC(=O)C1 Amb19131642 [1,1,0,0,0,0|2,0,0]=4 133 B18R2.154 Cc1cc(CCl)cc(c1)OCc2ccccc2 Amb25717664 [1,1,0,0,0,0|1,0,1]=4 134 B18R2.154 Cc1cc(cc(c1)OC)\C=C/c2cc[n]cc2 Amb24103275 [1,1,0,0,0,0|1,0,0]=3 135 B18R2.3664 Cc1c[n+](C)cc(CC(=O)c2ccccc2)c1 Amb22749339 [1,1,0,0,0,0|1,0,1]=4 136 B18R2.3664 Cc1cc(cc(c1)C)NC(=O)c2ccccc2 Amb1224320 [1,1,0,0,0,0|1,0,0]=3 137 B18R2.3664 Cc1cc(cc(c1)C)NC(=O)c2ccccn2 Amb1220253 [1,1,0,0,0,0|2,0,0]=4 138 B18R2.3666 Cc1cc(C)cc(c1)C(=O)Nc2ccccc2 Amb2285269 [1,1,0,0,0,0|1,0,0]=3 139 B18R2.3666 Cc1cc(cc(C)c1)C(=O)Cc2c[n]ccc2 Amb24064126 [1,1,0,0,0,0|1,0,1]=4 140 B18R2.3666 Cc1cc(cc(C)c1)C(=O)Cc2ccccc2 Amb19886379 [1,1,0,0,0,0|0,0,1]=3 141 B18R2.3666 Cc1cc(cc(C)c1)C(O)Cc2ccccc2 Amb23921970 [1,1,0,0,0,0|0,0,2]=4 142 B18R2.12659 Cc1c(cc(O)cc1O)\C=C\c2ccccc2 Amb22173980 [1,1,0,0,0,0|2,0,0]=4 143 B18R2.12659 Cc1cc(NCc2ccccc2)c(N)c(C)c1 Amb23263342 [1,1,0,0,0,0|1,0,1]=4 144 B18R2.12659 Cc1cc(\N=N\c2ccccc2)c(c(c1)C)O Amb10788618 [1,1,0,0,0,0|2,0,0]=4 145 B18R2.272732 CC1=CC(=O)C=C(\C=C\c2cc(O)ccc2)O1 Amb18548546 [1,1,0,0,0,0|2,0,0]=4 146 B18R2.272732 Cc1cc(COc2cc(C)cc(C)c2)ccc1 Amb22266333 [1,1,0,0,0,0|1,0,1]=4 147 B18R2.272732 Cc1cc(cc(C)c1)OCc2cc(Br)ccc2 Amb22265902 [1,1,0,0,0,0|1,0,1]=4 148 B18R2.272732 Cc1cc(cc(C)c1)OCc2cc(Cl)ccc2 Amb22285364 [1,1,0,0,0,0|1,0,1]=4 149 B18R2.272732 Cc1cc(cc(C)c1)OCc2cc(F)ccc2 Amb20678537 [1,1,0,0,0,0|1,0,1]=4 150 B18R2.284623 CC1=CC(=O)C=C(\C=C\c2ccccc2Cl)O1 Amb18048877 [1,1,0,0,0,0|2,0,0]=4 151 B18R2.284623 CC1=CC(=O)C=C(\C=C\c2ccccc2O)O1 Amb18548547 [1,1,0,0,0,0|2,0,0]=4 152 B18R2.284623 Cc1cc(CNc2ccccc2I)cc(C)c1 Amb23969522 [1,1,0,0,0,0|1,0,1]=4 153 B18R2.284623 Cc1cc(COc2ccccc2F)cc(C)c1 Amb22266269 [1,1,0,0,0,0|1,0,1]=4 154 B18R2.284623 Cc1cc(cc(C)c1)NCc2ccccc2N Amb24023301 [1,1,0,0,0,0|1,0,1]=4 155 B18R2.284623 Cc1cc(cc(C)c1)OCc2ccccc2Br Amb22266271 [1,1,0,0,0,0|1,0,1]=4 156 B18R2.284623 Cc1cc(cc(C)c1)OCc2ccccc2F Amb20678535 [1,1,0,0,0,0|1,0,1]=4 157 B18R2.284623 Cc1ccccc1COc2cc(C)cc(C)c2 Amb22266272 [1,1,0,0,0,0|1,0,1]=4 158 B18R2.284623 Oc1ccccc1\C=C\c2cc(O)cc(O)c2 Amb22173841 [1,1,0,0,0,0|2,0,0]=4 159 B18R2.686529 CC1=CC(=O)C=C(\C=C\c2ccc(Cl)cc2)O1 Amb18048878 [1,1,0,0,0,0|2,0,0]=4 160 B18R2.686529 CC1=CC(=O)C=C(\C=C\c2ccc(O)cc2)O1 Amb18048733 [1,1,0,0,0,0|2,0,0]=4 161 B18R2.686529 Cc1cc(COc2ccc(I)cc2)cc(C)c1 Amb22269804 [1,1,0,0,0,0|1,0,1]=4 162 B18R2.686529 Cc1ccc(cc1)OCc2cc(C)cc(C)c2 Amb22266314 [1,1,0,0,0,0|1,0,1]=4 163 B18R2.686529 Fc1ccc(cc1)COc2cc(C)cc(c2)C Amb1547340 [1,1,0,0,0,0|1,0,1]=4 164 B18R2.686529 Nc1ccc(cc1)COc2cc(C)cc(c2)C Amb1138834 [1,1,0,0,0,0|1,0,1]=4 165 B18R2.686529 O[13c]1[13cH][13cH][13c]([13cH][13cH]1)\C=C\c2cc(O)cc(c2)O Amb17619857 [1,1,0,0,0,0|2,0,0]=4 166 B18R2.686529 Oc1ccc(cc1)\C=C/c2cc(O)cc(c2)O Amb17619858 [1,1,0,0,0,0|2,0,0]=4 167 B18R2.133 CCc1cc(cc(N)c1O)Oc2ccccc2 Amb24106179 [0,1,0,0,1,0|2,0,0]=4 168 B18R2.38708 Cc1cc(cc(C)c1O)C(=O)c2ccccc2 Amb24063671 [0,1,0,0,1,0|0,0,0]=2 169 B18R2.38708 Oc1c(Br)cc(cc1Br)C(=O)c2ccccc2 Amb17779264 [0,1,0,0,1,0|2,0,0]=4 170 B18R2.273039 Cc1cc(cc(C)c1N)Oc2cc(F)ccc2 Amb23263329 [0,1,0,0,1,0|2,0,0]=4 171 B18R2.273039 Cc1cc(ccc1)Oc2cc(C)c(N)c(C)c2 Amb23263321 [0,1,0,0,1,0|2,0,0]=4 172 B18R2.512566 Cc1cc(cc(C)c1N)Oc2ccccc2F Amb23263328 [0,1,0,0,1,0|2,0,0]=4 173 B18R2.512566 Cc1ccccc1Oc2cc(C)c(N)c(C)c2 Amb23263320 [0,1,0,0,1,0|2,0,0]=4 174 B18R2.686212 Cc1cc(cc(C)c1N)Oc2ccc(F)cc2 Amb23263330 [0,1,0,0,1,0|2,0,0]=4 175 B18R2.686212 Cc1cc(cc(C)c1N)Sc2ccc(Cl)cc2 Amb23263334 [0,1,0,0,1,0|2,0,0]=4 176 B18R2.686212 Cc1ccc(cc1)Oc2cc(C)c(N)c(C)c2 Amb23263323 [0,1,0,0,1,0|2,0,0]=4 177 B18R2.686212 Cc1ccc(cc1)Sc2cc(C)c(N)c(C)c2 Amb23263333 [0,1,0,0,1,0|2,0,0]=4 178 B20R2.94668 Cc1cc(cc(Br)c1O)NC(=O)Cc2ccccc2 Amb23491372 [0,1,0,0,0,1|1,0,1]=4 179 B20R2.493319 Cc1cc(cc(C)c1O)C(=O)OCc2ccccc2 Amb22547724 [0,1,0,0,0,1|0,0,1]=3 180 B20R2.493319 O=C(c1cc(C)c(c(c1)C)O)CSc2ccccc2 Amb2437534 [0,1,0,0,0,1|0,0,1]=3 181 B20R2.8880 COc1cc(\C=N\c2ccc(cc2)Br)cc(c1O)I Amb2229337 [0,2,0,0,0,0|2,0,0]=4 182 B20R2.8880 COc1cc(\C=N\c2ccc(cc2)C)cc(c1O)Br Amb1008285 [0,2,0,0,0,0|2,0,0]=4 183 B20R2.8880 COc1cc(\C=N\c2ccc(cc2)C)cc(c1O)I Amb2229355 [0,2,0,0,0,0|2,0,0]=4 184 B20R2.9312 COc1cc(cc(CO)c1O)\N=N\c2ccccc2 Amb20411116 [0,2,0,0,0,0|2,0,0]=4 185 B20R2.493228 Cc1cc(cc(C)c1B(O)O)OCc2ccccc2 Amb22491807 [0,2,0,0,0,0|1,0,1]=4 186 B20R2.493228 OC(=O)c1c(C)cc(cc1C)OCc2ccccc2 Amb10559777 [0,2,0,0,0,0|1,0,1]=4 187 B20R2.493251 Cc1cc(cc(c1O)C)NS(=O)(=O)c2ccccc2 Amb1267855 [0,2,0,0,0,0|2,0,0]=4 188 B20R2.1296662 Brc1ccc(cc1)C(=O)Nc2cc(C)c(c(c2)C)O Amb2542180 [0,2,0,0,0,0|1,0,0]=3 189 B20R2.1296662 Cc1cc(cc(Br)c1O)NC(=O)c2ccc(Br)cc2 Amb23491364 [0,2,0,0,0,0|2,0,0]=4 190 B20R2.1296662 Cc1cc(cc(Br)c1O)NC(=O)c2ccc(Cl)cc2 Amb23491363 [0,2,0,0,0,0|2,0,0]=4 191 B20R2.1296662 Cc1cc(cc(Br)c1O)NC(=O)c2ccc(F)cc2 Amb23491365 [0,2,0,0,0,0|2,0,0]=4 192 B20R2.1296662 Cc1ccc(cc1)C(=O)Nc2cc(C)c(O)c(Br)c2 Amb23491340 [0,2,0,0,0,0|2,0,0]=4 193 B20R2.1296662 Cc1ccc(cc1)C(=O)Nc2cc(C)c(c(c2)C)O Amb2542182 [0,2,0,0,0,0|1,0,0]=3 194 B20R2.1296662 Cc1ccc(cc1)C(=O)Oc2cc(C)c(c(c2)C)Cl Amb2553975 [0,2,0,0,0,0|2,0,0]=4 195 B20R2.1296662 Clc1ccc(cc1)C(=O)Nc2cc(C)c(c(c2)C)O Amb2542177 [0,2,0,0,0,0|1,0,0]=3 196 B20R2.1296662 O=C(c1ccc(cc1)Br)N=C2C=C(C)C(=O)C(=C2)C Amb2542216 [0,2,0,0,0,0|1,0,1]=4 197 B20R2.1296662 O=C(c1ccc(cc1)C)N=C2C=C(C)C(=O)C(=C2)C Amb2542217 [0,2,0,0,0,0|1,0,1]=4 198 B20R2.1296662 O=C(c1ccc(cc1)Cl)N=C2C=C(C)C(=O)C(=C2)C Amb2542215 [0,2,0,0,0,0|1,0,1]=4 199 B20R2.7471255 Cc1cc(cc(Br)c1O)NC(=O)c2ccccc2Br Amb23491360 [0,2,0,0,0,0|2,0,0]=4 200 B20R2.7471255 Cc1cc(cc(Br)c1O)NC(=O)c2ccccc2C Amb23491335 [0,2,0,0,0,0|2,0,0]=4 201 B20R2.7471255 Cc1cc(cc(Br)c1O)NC(=O)c2ccccc2Cl Amb23491358 [0,2,0,0,0,0|2,0,0]=4 202 B20R2.7471255 Cc1cc(cc(Br)c1O)NC(=O)c2ccccc2F Amb23491357 [0,2,0,0,0,0|2,0,0]=4 203 B20R2.7471255 O=C(c1ccccc1Br)Nc2cc(C)c(c(c2)C)O Amb2542181 [0,2,0,0,0,0|1,0,0]=3 204 B20R2.7471255 O=C(c1ccccc1C)Oc2cc(C)c(c(c2)C)Cl Amb1344210 [0,2,0,0,0,0|2,0,0]=4 205 B20R2.7471255 O=C(c1ccccc1Cl)Nc2cc(C)c(c(c2)C)O Amb2542179 [0,2,0,0,0,0|1,0,0]=3 206 B20R2.10475143 Cc1cc(cc(Br)c1O)NC(=O)c2cc(Br)ccc2 Amb23491361 [0,2,0,0,0,0|2,0,0]=4 207 B20R2.10475143 Cc1cc(cc(Br)c1O)NC(=O)c2cc(Cl)ccc2 Amb23491362 [0,2,0,0,0,0|2,0,0]=4 208 B20R2.10475143 Cc1cc(ccc1)C(=O)Nc2cc(C)c(O)c(Br)c2 Amb23491336 [0,2,0,0,0,0|2,0,0]=4 209 B20R2.10475143 Cc1cccc(c1)C(=O)N=C2C=C(C)C(=O)C(=C2)C Amb2542218 [0,2,0,0,0,0|1,0,1]=4 210 B20R2.10475143 Cc1cccc(c1)C(=O)Nc2cc(C)c(c(c2)C)O Amb2542183 [0,2,0,0,0,0|1,0,0]=3 211 B20R2.10475143 Clc1cccc(c1)C(=O)Nc2cc(C)c(c(c2)C)O Amb2542178 [0,2,0,0,0,0|1,0,0]=3 212 B20R2.7467566 Cc1cc(cc(C)c1O)C(=O)Nc2ccccc2Cl Amb22444352 [0,2,0,0,0,0|1,0,0]=3 213 B20R2.1296036 Cc1cc(cc(C)c1O)\C=C\c2cc(Cl)c(Cl)cc2 Amb21962650 [0,2,0,0,0,0|0,0,0]=2 214 B20R2.7490958 Cc1cc(N)ccc1\N=N\c2cc(C)c(O)c(C)c2 Amb24086629 [0,2,0,0,0,0|2,0,0]=4 215 B18R2.2923883 Cc1cc(C=C2C(=O)C=CC2=O)cc(C)c1O Amb22371762 [0,0,1,1,0,0|2,0,0]=4 216 B18R3.32867 CN1C(=O)C=Cc2ccc3ccccc3c12 Amb19770285 [1,0,0,1,0,0|1,0,1]=4 217 B18R3.32867 Cc1ccc2ccc3ccccc3c2[n+]1C Amb23453335 [1,0,0,1,0,0|2,0,0]=4 218 B18R3.32867 Cc1ccc2ccc3ccccc3c2[n+]1C Amb24121507 [1,0,0,1,0,0|2,0,0]=4 219 B18R3.58330 Cc1cc(O)c2c(n1)ccc3c2cccc3 Amb1031861 [1,0,0,1,0,0|2,0,0]=4 220 B18R3.424175 Cc1n(C)c2c(c1C)c3ccccc3cc2 Amb2518523 [0,0,0,1,1,0|2,0,0]=4 221 B20R3.14206 Cc1cc2oc(nc2c(c1Cl)C)c3ccccc3 Amb17573932 [0,1,0,1,0,0|2,0,0]=4 222 B20R3.14206 Cc1cc2oc(nc2c(c1N)C)c3ccccc3 Amb17572766 [0,1,0,1,0,0|2,0,0]=4 223 B16R2.124 Cc1cc(Cc2ccccc2)ccc1O Amb24065834 [1,0,0,0,1,0|0,0,1]=3 224 B16R2.124 Cc1cc(ccc1F)Oc2ccccc2 Amb22641489 [1,0,0,0,1,0|2,0,0]=4 225 B16R2.124 Cc1ccc(cc1C)Sc2ccccc2 Amb22731128 [1,0,0,0,1,0|2,0,0]=4 226 B16R2.124 Nc1cc(Cc2ccccc2)ccc1O Amb18285718 [1,0,0,0,1,0|1,0,1]=4 227 B16R2.124 Nc1cc(ccc1O)Oc2ccccc2 Amb18555885 [1,0,0,0,1,0|2,0,0]=4 228 B16R2.124 Nc1ccc(cc1C)Cc2ccccc2 Amb17139681 [1,0,0,0,1,0|1,0,1]=4 229 B16R2.124 Oc1ccc(Cc2ccccc2)cc1Cl Amb24065833 [1,0,0,0,1,0|1,0,1]=4 230 B16R2.124 Oc1ccc(Cc2ccccc2)cc1O Amb24060583 [1,0,0,0,1,0|1,0,1]=4 231 B16R2.124 Oc1ccc(cc1O)Nc2ccccc2 Amb24060582 [1,0,0,0,1,0|2,0,0]=4 232 B16R2.2822 Cc1c[n+](Cc2ccccc2)cc(C)c1 Amb22464392 [1,0,0,0,1,0|1,0,1]=4 233 B16R2.2822 Cc1cc(Cc2ccccc2)cc(C)c1 Amb24064513 [1,0,0,0,1,0|0,0,1]=3 234 B16R2.2822 Cc1cc(cc(C)c1)Nc2ccccc2 Amb17933578 [1,0,0,0,1,0|1,0,0]=3 235 B16R2.2822 Cc1cc(cc(C)c1)Oc2cccc[n]2 Amb24096966 [1,0,0,0,1,0|2,0,0]=4 236 B16R2.2822 Cc1cc(cc(C)c1)Pc2ccccc2 Amb22750178 [1,0,0,0,1,0|1,0,0]=3 237 B16R2.11351 Cc1cc(cc(C)c1)N=Cc2ccc[s]2 Amb24078036 [1,0,0,0,1,0|2,0,0]=4 238 B16R2.22304 Cc1cc(cc(c1C)N)c2ccccc2 Amb17236637 [0,0,0,0,2,0|2,0,0]=4 239 B16R2.22304 Nc1cc(cc(Cl)c1O)-c2ccccc2 Amb22011170 [0,0,0,0,2,0|2,0,0]=4 240 B16R2.22304 Nc1cc(cc(c1O)Br)c2ccccc2 Amb10669522 [0,0,0,0,2,0|2,0,0]=4 241 B16R2.22304 Oc1c(Cl)cc(cc1Br)-c2ccccc2 Amb19960715 [0,0,0,0,2,0|2,0,0]=4 242 B18R2.3665 Cc1cc(C)nc(n1)S\C=C\c2ccccc2 Amb1068703 [1,0,0,0,0,1|2,0,0]=4 243 B18R2.3665 Cc1cc(CNCc2ccccc2)cc(C)c1 Amb25401310 [1,0,0,0,0,1|0,0,2]=4