0 B19R2.8898 CC(=NNC(=O)c1cc[n]cc1)c2ccccc2 Amb24077953 [0,0,0,0,0,0|4,0,0]=4 1 B19R2.8898 CC(=NOC(=O)c1ccccc1)c2ccccc2 Amb24325062 [0,0,0,0,0,0|2,0,0]=2 2 B19R2.8898 CC(NNC(=O)c1ccccc1)c2ccccc2 Amb22343124 [0,0,0,0,0,0|3,0,1]=4 3 B19R2.8898 C\C(=N\NC(=O)c1ccccc1)\c2cccc[n]2 Amb24219939 [0,0,0,0,0,0|4,0,0]=4 4 B19R2.8898 Cl\C(=N\N=C(/c1ccccc1)\Cl)\c2ccccc2 Amb10554685 [0,0,0,0,0,0|4,0,0]=4 5 B19R2.8898 Cl\C(=N\N=C(\c1ccccc1)/Cl)\c2ccccc2 Amb10562837 [0,0,0,0,0,0|4,0,0]=4 6 B19R2.8898 N=C(c1ccccn1)NNC(=O)c2ccccc2 Amb2502398 [0,0,0,0,0,0|4,0,0]=4 7 B19R2.8898 N=C(c1cccnc1)NNC(=O)c2ccccc2 Amb1482214 [0,0,0,0,0,0|4,0,0]=4 8 B19R2.8898 N\C(=N/N=C(/c1ccccc1)\N)\c2ccccc2 Amb16218122 [0,0,0,0,0,0|4,0,0]=4 9 B19R2.8898 N\C(=N/OC(=O)c1ccccc1)\c2ccncc2 Amb1869645 [0,0,0,0,0,0|3,0,0]=3 10 B19R2.8898 O=C(C#CC(=O)c1ccccc1)c2ccccc2 Amb17693195 [0,0,0,0,0,0|2,0,0]=2 11 B19R2.8898 O=C(NCC(=O)c1ccccc1)c2cccc[n]2 Amb23995378 [0,0,0,0,0,0|3,0,0]=3 12 B19R2.8898 O=C(NCC(Cl)c1ccccc1)c2ccccc2 Amb22753770 [0,0,0,0,0,0|3,0,1]=4 13 B19R2.8898 O=C(OOC(=O)c1ccccc1)c2ccccc2 Amb20241058 [0,0,0,0,0,0|0,0,0]=0 14 B19R2.8898 O=C(c1ccccc1)CNC(=O)c2cccnc2 Amb17348389 [0,0,0,0,0,0|3,0,0]=3 15 B19R2.8898 O=C(c1ccccc1)COC(=O)c2ccccn2 Amb1926570 [0,0,0,0,0,0|2,0,0]=2 16 B19R2.8898 O=C(c1ccccc1)NN=C(c2ccccc2)C Amb16224910 [0,0,0,0,0,0|3,0,0]=3 17 B19R2.8898 O=C(c1ccccc1)NNC(=O)c2ccccn2 Amb1813551 [0,0,0,0,0,0|3,0,0]=3 18 B19R2.8898 O=C(c1ccccc1)NNC(=O)c2ccncc2 Amb1016530 [0,0,0,0,0,0|3,0,0]=3 19 B19R2.8898 O=C(c1ccccc1)N\N=C(\c2cccnc2)/C Amb2247976 [0,0,0,0,0,0|4,0,0]=4 20 B19R2.8898 O=C(c1ccccc1)SSC(=O)c2ccccc2 Amb1930736 [0,0,0,0,0,0|0,2,0]=2 21 B19R2.8898 O=C(c1ccccc1)\C=C/C(=O)c2ccccc2 Amb10555220 [0,0,0,0,0,0|2,0,0]=2 22 B19R2.8898 O=C(c1ccccc1)\C=C\C(=O)c2ccccc2 Amb1196058 [0,0,0,0,0,0|2,0,0]=2 23 B19R2.8898 O=C(c1ccccn1)NNC(=O)c2ccccn2 Amb1545547 [0,0,0,0,0,0|4,0,0]=4 24 B19R2.8898 O=C(c1ccccn1)NNC(=O)c2cccnc2 Amb1789547 [0,0,0,0,0,0|4,0,0]=4 25 B19R2.8898 O=C(c1cccnc1)NNC(=O)c2ccncc2 Amb1788481 [0,0,0,0,0,0|4,0,0]=4 26 B19R2.8898 O=C(c1cccnc1)N\N=C(/c2ccccc2)\C Amb16761590 [0,0,0,0,0,0|4,0,0]=4 27 B19R2.8898 O=C(c1cccnc1)N\N=C(\c2ccccc2)/C Amb1807990 [0,0,0,0,0,0|4,0,0]=4 28 B19R2.8898 O=C(c1ccncc1)NNC(=O)c2ccccn2 Amb1828388 [0,0,0,0,0,0|4,0,0]=4 29 B19R2.8898 O=C(c1ccncc1)NNC(=O)c2ccncc2 Amb1543314 [0,0,0,0,0,0|4,0,0]=4 30 B19R2.8898 O=C(c1ccncc1)OCC(=O)c2ccccc2 Amb2246784 [0,0,0,0,0,0|2,0,0]=2 31 B19R2.8898 O=S(CCS(=O)c1ccccc1)c2ccccc2 Amb22353890 [0,0,0,0,0,0|4,0,0]=4 32 B19R2.8898 O=S(c1ccccc1)CCS(=O)c2ccccc2 Amb10607162 [0,0,0,0,0,0|4,0,0]=4 33 B19R2.8898 S=C(c1ccccc1)SSC(=S)c2ccccc2 Amb16186709 [0,0,0,0,0,0|0,4,0]=4 34 B18R2.7189 C\C(=C/C=C/c1ccccc1)\c2ccccc2 Amb10568256 [1,0,0,0,0,0|3,0,0]=4 35 B18R2.7189 NC(=NOCc1ccccc1)c2ccccc2 Amb11212592 [1,0,0,0,0,0|2,0,1]=4 36 B18R2.7189 O=C(CCSc1ccccc1)c2ccccc2 Amb21984386 [1,0,0,0,0,0|3,0,0]=4 37 B18R2.7189 O=C(COCc1ccccc1)c2c[n]ccc2 Amb25747155 [1,0,0,0,0,0|2,0,1]=4 38 B18R2.7189 O=C(COCc1ccccc1)c2ccccc2 Amb21928125 [1,0,0,0,0,0|1,0,1]=3 39 B18R2.7189 O=C(NN=Cc1c[n]ccc1)c2ccccc2 Amb24056286 [1,0,0,0,0,0|3,0,0]=4 40 B18R2.7189 O=C(NN=Cc1ccccc1)c2cc[n]cc2 Amb24059113 [1,0,0,0,0,0|3,0,0]=4 41 B18R2.7189 O=C(NNCc1ccccc1)c2ccccc2 Amb22485056 [1,0,0,0,0,0|2,0,1]=4 42 B18R2.7189 O=C(OCCc1ccccc1)c2c[n]ccc2 Amb24081249 [1,0,0,0,0,0|2,0,1]=4 43 B18R2.7189 O=C(c1ccccc1)CCCc2ccccc2 Amb1548163 [1,0,0,0,0,0|2,0,1]=4 44 B18R2.7189 O=C(c1ccccc1)C\C=C\c2ccccc2 Amb10567882 [1,0,0,0,0,0|2,0,0]=3 45 B18R2.7189 O=C(c1ccccc1)NCSc2ccccc2 Amb10559218 [1,0,0,0,0,0|3,0,0]=4 46 B18R2.7189 O=C(c1ccccc1)NOCc2ccccc2 Amb10426334 [1,0,0,0,0,0|1,0,1]=3 47 B18R2.7189 O=C(c1ccccc1)N\C=C\c2ccccc2 Amb10561814 [1,0,0,0,0,0|2,0,0]=3 48 B18R2.7189 O=C(c1ccccc1)N\N=C/c2ccccn2 Amb16205140 [1,0,0,0,0,0|3,0,0]=4 49 B18R2.7189 O=C(c1ccccc1)N\N=C\c2ccccc2 Amb1883960 [1,0,0,0,0,0|2,0,0]=3 50 B18R2.7189 O=C(c1ccccc1)O\N=C\c2ccccn2 Amb1005655 [1,0,0,0,0,0|2,0,0]=3 51 B18R2.7189 O=C(c1ccccc1)\C=C/Nc2ccccc2 Amb2386622 [1,0,0,0,0,0|3,0,0]=4 52 B18R2.7189 O=C(c1ccccc1)\C=C\Sc2ccccc2 Amb10817360 [1,0,0,0,0,0|3,0,0]=4 53 B18R2.7189 O=C(c1ccccn1)NOCc2ccccc2 Amb10572669 [1,0,0,0,0,0|2,0,1]=4 54 B18R2.7189 O=C(c1ccccn1)N\N=C\c2ccccc2 Amb1868722 [1,0,0,0,0,0|3,0,0]=4 55 B18R2.7189 O=C(c1cccnc1)NOCc2ccccc2 Amb13970072 [1,0,0,0,0,0|2,0,1]=4 56 B18R2.7189 O=C(c1cccnc1)N\C=C\c2ccccc2 Amb10561813 [1,0,0,0,0,0|3,0,0]=4 57 B18R2.7189 O=C(c1cccnc1)N\N=C/c2ccccc2 Amb16204371 [1,0,0,0,0,0|3,0,0]=4 58 B18R2.7189 O=C(c1ccncc1)NOCc2ccccc2 Amb15957174 [1,0,0,0,0,0|2,0,1]=4 59 B20R2.1960 O\N=C(\c1ccccc1)/COC(=O)c2ccccn2 Amb1926571 [0,1,0,0,0,0|2,0,1]=4 60 B20R2.4653 Brc1cccc(c1)C(=O)NNC(=O)c2ccccn2 Amb211718 [0,1,0,0,0,0|3,0,0]=4 61 B20R2.4653 Brc1cccc(c1)C(=O)N\N=C(\c2ccccc2)/C Amb1906406 [0,1,0,0,0,0|3,0,0]=4 62 B20R2.4653 Brc1cncc(c1)C(=O)OCC(=O)c2ccccc2 Amb1091586 [0,1,0,0,0,0|2,0,0]=3 63 B20R2.4653 C/C(c1ccccc1)=N\NC(=O)c2cccc(F)c2 Amb17882809 [0,1,0,0,0,0|3,0,0]=4 64 B20R2.4653 Cc1cccc(c1)C(=O)OCC(=O)c2ccccc2 Amb1926540 [0,1,0,0,0,0|1,0,0]=2 65 B20R2.4653 Cc1cccc(c1)C(=O)O\N=C(\c2ccccc2)/N Amb1807530 [0,1,0,0,0,0|2,0,0]=3 66 B20R2.4653 Cc1cccc(n1)C(=O)NNC(=O)c2ccccc2 Amb11288420 [0,1,0,0,0,0|3,0,0]=4 67 B20R2.4653 Clc1cccc(c1)C(=O)COC(=O)c2ccccc2 Amb12183 [0,1,0,0,0,0|1,0,0]=2 68 B20R2.4653 Clc1cccc(c1)C(=O)NCC(=O)c2ccccc2 Amb17365875 [0,1,0,0,0,0|2,0,0]=3 69 B20R2.4653 Clc1nccc(c1)C(=O)NNC(=O)c2ccccc2 Amb16031905 [0,1,0,0,0,0|3,0,0]=4 70 B20R2.4653 Fc1cccc(c1)C(=O)NCC(=O)c2ccccc2 Amb17355976 [0,1,0,0,0,0|2,0,0]=3 71 B20R2.4653 Fc1cccc(c1)C(=O)NNC(=O)c2ccccc2 Amb1539517 [0,1,0,0,0,0|2,0,0]=3 72 B20R2.4653 Fc1cccc(c1)C(=O)NNC(=O)c2ccncc2 Amb1264380 [0,1,0,0,0,0|3,0,0]=4 73 B20R2.4653 Ic1cccc(c1)C(=O)O\N=C(\c2ccncc2)/N Amb1869827 [0,1,0,0,0,0|3,0,0]=4 74 B20R2.4653 Oc1cccc(c1)C(=O)OCC(=O)c2ccccc2 Amb1232610 [0,1,0,0,0,0|1,0,0]=2 75 B20R2.4789 Cc1[n]cccc1C(=O)NCC(=O)c2ccccc2 Amb24042937 [0,1,0,0,0,0|3,0,0]=4 76 B20R2.4789 N\C(=N/OC(=O)C1=CC=CNC1=O)\c2ccccc2 Amb22435272 [0,1,0,0,0,0|3,0,0]=4 77 B20R2.4789 N\C(=N/OC(=O)c1ccccc1Br)\c2cccnc2 Amb1869651 [0,1,0,0,0,0|3,0,0]=4 78 B20R2.4789 N\C(=N/OC(=O)c1ccccc1C)\c2cccnc2 Amb1823739 [0,1,0,0,0,0|3,0,0]=4 79 B20R2.4789 N\C(=N/OC(=O)c1ccccc1I)\c2ccncc2 Amb1816151 [0,1,0,0,0,0|3,0,0]=4 80 B20R2.4789 Nc1ccccc1C(=O)NNC(=O)c2cc[n]cc2 Amb23523071 [0,1,0,0,0,0|3,0,0]=4 81 B20R2.4789 O=C(NNC(=O)C1=CC=CNC1=S)c2ccccc2 Amb21639176 [0,1,0,0,0,0|3,0,0]=4 82 B20R2.4789 O=C(c1ccccc1)COC(=O)c2ccccc2N Amb1106968 [0,1,0,0,0,0|1,0,0]=2 83 B20R2.4789 O=C(c1ccccc1)COC(=O)c2cccnc2Cl Amb2269398 [0,1,0,0,0,0|2,0,0]=3 84 B20R2.4789 O=C(c1ccccc1)NNC(=O)c2ccccc2C Amb2551222 [0,1,0,0,0,0|2,0,0]=3 85 B20R2.4789 O=C(c1ccccc1)N\N=C(/c2ccccc2O)\C Amb10559322 [0,1,0,0,0,0|3,0,0]=4 86 B20R2.4789 O=C(c1ccccc1)N\N=C(\c2ccccc2F)/C Amb2247954 [0,1,0,0,0,0|3,0,0]=4 87 B20R2.4789 O=C(c1ccccc1)OCC(=O)c2ccccc2F Amb12986 [0,1,0,0,0,0|1,0,0]=2 88 B20R2.4789 O=C(c1ccccc1Br)NN=C(c2ccccc2)C Amb16225032 [0,1,0,0,0,0|3,0,0]=4 89 B20R2.4789 O=C(c1ccccc1Br)N\N=C(\c2ccccc2)/C Amb1899178 [0,1,0,0,0,0|3,0,0]=4 90 B20R2.4789 O=C(c1ccccc1Br)O\N=C(\c2ccccn2)/N Amb1845231 [0,1,0,0,0,0|3,0,0]=4 91 B20R2.4789 O=C(c1ccccc1Cl)N\N=C(\c2ccccc2)/C Amb1268129 [0,1,0,0,0,0|3,0,0]=4 92 B20R2.4789 O=C(c1ccccc1I)O\N=C(\c2ccccn2)/N Amb1777698 [0,1,0,0,0,0|3,0,0]=4 93 B20R2.4789 O=C(c1ccccc1O)NN=C(c2ccccc2)C Amb16224916 [0,1,0,0,0,0|3,0,0]=4 94 B20R2.4789 O=C(c1ccccc1O)N\N=C(\c2ccccc2)/C Amb1899764 [0,1,0,0,0,0|3,0,0]=4 95 B20R2.4789 O=C(c1ccccn1)OCC(=O)c2ccccc2Br Amb2261756 [0,1,0,0,0,0|2,0,0]=3 96 B20R2.4789 O=C(c1cccnc1)NNC(=O)c2ccccc2Cl Amb2573068 [0,1,0,0,0,0|3,0,0]=4 97 B20R2.4789 O=C(c1cccnc1)O\N=C(\c2ccccc2Cl)/N Amb16754635 [0,1,0,0,0,0|3,0,0]=4 98 B20R2.4789 O=C(c1ccncc1)OCC(=O)c2ccccc2Br Amb17036 [0,1,0,0,0,0|2,0,0]=3 99 B20R2.10843 O=C(CCS(=O)(=O)c1ccccc1)c2ccccc2 Amb21984389 [0,1,0,0,0,0|3,0,0]=4 100 B20R2.15243 Brc1ccc(cc1)C(=O)CNC(=O)c2ccccc2 Amb1346171 [0,1,0,0,0,0|2,0,0]=3 101 B20R2.15243 Brc1ccc(cc1)C(=O)COC(=O)c2ccccn2 Amb1008899 [0,1,0,0,0,0|2,0,0]=3 102 B20R2.15243 Brc1ccc(cc1)C(=O)NNC(=O)c2cccnc2 Amb2549977 [0,1,0,0,0,0|3,0,0]=4 103 B20R2.15243 Brc1ccc(cc1)C(=O)N\N=C(/c2ccccc2)\C Amb2582957 [0,1,0,0,0,0|3,0,0]=4 104 B20R2.15243 Brc1ccc(nc1)C(=O)OCC(=O)c2ccccc2 Amb1227894 [0,1,0,0,0,0|2,0,0]=3 105 B20R2.15243 Cc1ccc(cc1)C(=NNC(=O)c2ccccc2)C Amb16224909 [0,1,0,0,0,0|3,0,0]=4 106 B20R2.15243 Cc1ccc(cc1)C(=O)CNC(=O)c2ccccc2 Amb17354251 [0,1,0,0,0,0|2,0,0]=3 107 B20R2.15243 Cc1ccc(cc1)C(=O)CNC(=O)c2cccnc2 Amb17354712 [0,1,0,0,0,0|3,0,0]=4 108 B20R2.15243 Cc1ccc(cc1)C(=O)NNC(=O)c2cc[n]cc2 Amb22346662 [0,1,0,0,0,0|3,0,0]=4 109 B20R2.15243 Cc1ccc(cc1)C(=O)NNC(=O)c2ccccc2 Amb1016531 [0,1,0,0,0,0|2,0,0]=3 110 B20R2.15243 Cc1ccc(cc1)C(=O)NNC(=O)c2cccnc2 Amb2549832 [0,1,0,0,0,0|3,0,0]=4 111 B20R2.15243 Cc1ccc(cc1)C(=O)NOC(=O)c2ccccc2 Amb22461831 [0,1,0,0,0,0|1,0,0]=2 112 B20R2.15243 Cc1ccc(cc1)C(=O)N\N=C(/c2ccccc2)\C Amb2582623 [0,1,0,0,0,0|3,0,0]=4 113 B20R2.15243 Cc1ccc(cc1)C(=O)OCC(=O)c2ccccc2 Amb1007867 [0,1,0,0,0,0|1,0,0]=2 114 B20R2.15243 Cc1ccc(cc1)C(=O)\C=C\C(=O)c2ccccc2 Amb17596887 [0,1,0,0,0,0|2,0,0]=3 115 B20R2.15243 Cc1ccc(cc1)C(Cl)=NOC(=O)c2ccccc2 Amb22453380 [0,1,0,0,0,0|2,0,0]=3 116 B20R2.15243 Cc1ccc(cn1)C(=O)NNC(=O)c2ccccc2 Amb16165538 [0,1,0,0,0,0|3,0,0]=4 117 B20R2.15243 Clc1ccc(cc1)C(=O)CNC(=O)c2cccnc2 Amb2223239 [0,1,0,0,0,0|3,0,0]=4 118 B20R2.15243 Clc1ccc(cc1)C(=O)NNC(=O)c2ccccn2 Amb10470139 [0,1,0,0,0,0|3,0,0]=4 119 B20R2.15243 Clc1ccc(cc1)C(=O)NNC(=O)c2cccnc2 Amb2549945 [0,1,0,0,0,0|3,0,0]=4 120 B20R2.15243 Clc1ccc(cc1)C(=O)N\N=C(/c2ccccc2)\C Amb2582608 [0,1,0,0,0,0|3,0,0]=4 121 B20R2.15243 Clc1ccc(cc1)C(=O)N\N=C(\c2ccccc2)/C Amb1899154 [0,1,0,0,0,0|3,0,0]=4 122 B20R2.15243 Clc1ccc(cc1)C(=O)\C=C\C(=O)c2ccccc2 Amb1538862 [0,1,0,0,0,0|2,0,0]=3 123 B20R2.15243 Fc1ccc(cc1)C(=O)CNC(=O)c2ccccc2 Amb17355977 [0,1,0,0,0,0|2,0,0]=3 124 B20R2.15243 Fc1ccc(cc1)C(=O)CNC(=O)c2cccnc2 Amb16200323 [0,1,0,0,0,0|3,0,0]=4 125 B20R2.15243 Fc1ccc(cc1)C(=O)NNC(=O)c2ccccc2 Amb1777265 [0,1,0,0,0,0|2,0,0]=3 126 B20R2.15243 Fc1ccc(cc1)C(=O)N\N=C(\c2ccccc2)/C Amb1899206 [0,1,0,0,0,0|3,0,0]=4 127 B20R2.15243 Fc1ccc(cc1)C(=O)\C=C\C(=O)c2ccccc2 Amb16202584 [0,1,0,0,0,0|2,0,0]=3 128 B20R2.15243 Nc1ccc(cc1)C(=O)NNC(=O)c2cccc[n]2 Amb24087260 [0,1,0,0,0,0|3,0,0]=4 129 B20R2.15243 Nc1ccc(cc1)C(=O)N\N=C(\c2ccccc2)/N Amb10077218 [0,1,0,0,0,0|3,0,0]=4 130 B20R2.15243 Nc1ccc(cc1)\C(=N\NC(=O)c2ccccc2)\C Amb1008003 [0,1,0,0,0,0|3,0,0]=4 131 B20R2.15243 O=C(NNC(=O)C1=CNC(=O)C=C1)c2ccccc2 Amb19383739 [0,1,0,0,0,0|3,0,0]=4 132 B20R2.15243 O=C(OCC(=O)c1ccc(Cl)cc1)c2cccc[n]2 Amb24309888 [0,1,0,0,0,0|2,0,0]=3 133 B20R2.15243 Oc1ccc(cc1)C(=O)N\N=C(\c2ccccc2)/C Amb1675094 [0,1,0,0,0,0|3,0,0]=4 134 B20R2.15243 [O-][n+]1ccc(cc1)C(=O)NNC(=O)c2ccccc2 Amb11217431 [0,1,0,0,0,0|3,0,0]=4 135 B20R2.29394 CN(NC(=O)c1ccccc1)C(=O)c2ccccc2 Amb22345899 [0,1,0,0,0,0|2,0,0]=3 136 B20R2.29394 ClC(C(=O)c1ccccc1)NC(=O)c2ccccc2 Amb13881231 [0,1,0,0,0,0|2,0,0]=3 137 B20R2.29394 OC(C(=O)c1ccccc1)NC(=O)c2ccccc2 Amb2458177 [0,1,0,0,0,0|2,0,0]=3 138 B20R2.29394 OC(C(=O)c1ccccc1)NC(=O)c2ccccn2 Amb10223 [0,1,0,0,0,0|3,0,0]=4 139 B20R3.2104171 CC1(OC1C(=O)c2ccccc2)c3ccccc3 Amb20179770 [0,0,0,1,0,0|2,0,1]=4 140 B20R3.2848659 O=C1CCC(=O)c2c(c3c1cccc3)cccc2 Amb17596462 [0,0,0,1,0,0|2,0,0]=3 141 B20R3.3470519 O=C(c1ccccc1)[n]2cc(Br)c3ccccc23 Amb22455198 [0,0,0,1,0,0|3,0,0]=4 142 B20R3.3470519 O=C(c1ccccc1)[n]2cc(Cl)c3ccccc23 Amb22749542 [0,0,0,1,0,0|3,0,0]=4 143 B20R3.3470519 O=C(n1nc(c2c1cccc2)N)c3ccccc3 Amb10665041 [0,0,0,1,0,0|3,0,0]=4 144 B18R2.3634 C[C@@H](NC(=O)c1ccccc1)c2ccccc2 Amb17779318 [0,0,0,0,1,0|2,0,1]=4 145 B18R2.3634 Cl\C(=N/C(=O)c1ccccc1)\c2ccccc2 Amb10554683 [0,0,0,0,1,0|2,0,0]=3 146 B18R2.3634 N=C(c1ccccc1)NC(=O)c2ccccc2 Amb16243789 [0,0,0,0,1,0|2,0,0]=3 147 B18R2.3634 N\C(=C/C(=O)c1ccccc1)\c2ccccc2 Amb2386645 [0,0,0,0,1,0|2,0,0]=3 148 B18R2.3634 O=C(CC(=O)c1ccccc1)c2ccccc2 Amb22053563 [0,0,0,0,1,0|1,0,0]=2 149 B18R2.3634 O=C(NC(=O)c1cccc[n]1)c2cccc[n]2 Amb24086088 [0,0,0,0,1,0|3,0,0]=4 150 B18R2.3634 O=C(NC(=S)c1ccccc1)c2ccccc2 Amb22457139 [0,0,0,0,1,0|1,1,0]=3 151 B18R2.3634 O=C(OC(=O)c1cccc[n]1)c2cccc[n]2 Amb24082015 [0,0,0,0,1,0|2,0,0]=3 152 B18R2.3634 O=C([CH-]C(=O)c1ccccc1)c2ccccc2 Amb22469476 [0,0,0,0,1,0|1,0,0]=2 153 B18R2.3634 O=C(c1ccccc1)CC(=S)c2ccccc2 Amb16202811 [0,0,0,0,1,0|1,1,0]=3 154 B18R2.3634 O=C(c1ccccc1)NC(=O)c2ccccc2 Amb2237470 [0,0,0,0,1,0|1,0,0]=2 155 B18R2.3634 O=C(c1cccnc1)CC(=S)c2ccccc2 Amb16202806 [0,0,0,0,1,0|2,1,0]=4 156 B18R2.3634 O=C(c1cccnc1)OC(=O)c2cccnc2 Amb16233302 [0,0,0,0,1,0|2,0,0]=3 157 B18R2.3634 OC(SC(=O)c1ccccc1)c2ccccc2 Amb22470190 [0,0,0,0,1,0|0,1,2]=4 158 B18R2.3634 O\C(=C/C(=O)c1ccccc1)\c2c[n]ccc2 Amb23539635 [0,0,0,0,1,0|2,0,1]=4 159 B18R2.3634 O\C(=C/C(=O)c1ccccc1)\c2cc[n]cc2 Amb23539638 [0,0,0,0,1,0|2,0,1]=4 160 B18R2.3634 O\C(=C/C(=O)c1ccccc1)\c2cccc[n]2 Amb23539647 [0,0,0,0,1,0|2,0,1]=4 161 B18R2.3634 [O-]\C(=C/C(=O)c1ccccc1)\c2ccccc2 Amb22047684 [0,0,0,0,1,0|1,0,1]=3 162 B18R2.3634 [O-]\C(=C/C(=O)c1ccccc1)\c2ccccc2 Amb22057284 [0,0,0,0,1,0|1,0,1]=3 163 B18R2.3634 [O-]\C(=C/C(=O)c1ccccc1)\c2ccccc2 Amb22057285 [0,0,0,0,1,0|1,0,1]=3 164 B18R2.3634 [O-]\C(=C/C(=O)c1ccccc1)\c2ccccc2 Amb22057289 [0,0,0,0,1,0|1,0,1]=3 165 B18R2.3634 [O-]\C(=C/C(=O)c1ccccc1)\c2ccccc2 Amb22450092 [0,0,0,0,1,0|1,0,1]=3 166 B18R2.3634 [O-]\C(=C/C(=O)c1ccccc1)\c2ccccc2 Amb22729996 [0,0,0,0,1,0|1,0,1]=3 167 B18R2.3634 [O-]\C(=C/C(=O)c1ccccc1)\c2ccccc2 Amb22730027 [0,0,0,0,1,0|1,0,1]=3 168 B18R2.72597 O=C(c1ccccc1)CNC(=O)c2cccs2 Amb1201722 [0,0,0,0,1,0|3,0,0]=4 169 B18R2.72597 O=C(c1ccccc1)COC(=O)c2cccs2 Amb1202731 [0,0,0,0,1,0|2,0,0]=3 170 B18R2.72597 O=C(c1ccccc1)NCC(=O)c2cccs2 Amb17350155 [0,0,0,0,1,0|3,0,0]=4 171 B18R2.72597 O=C(c1ccccc1)NNC(=O)c2cocc2 Amb16047261 [0,0,0,0,1,0|3,0,0]=4 172 B18R2.72597 O=C(c1ccccc1)OCC(=O)c2cccs2 Amb1351443 [0,0,0,0,1,0|2,0,0]=3 173 B18R2.72597 O=C(c1ccccc1)O\N=C(\c2cccs2)/C Amb1035678 [0,0,0,0,1,0|3,0,0]=4 174 B18R2.72597 O=C(c1ccccn1)OCC(=O)c2ccc[nH]2 Amb13954031 [0,0,0,0,1,0|3,0,0]=4 175 B20R2.10809 C\C(=C/c1ccccc1)\C=C\C(=O)c2ccccc2 Amb16199955 [0,0,0,0,0,1|3,0,0]=4 176 B20R2.10809 N\C(=N/OC(=O)c1ccccc1)\Cc2ccccc2 Amb1014483 [0,0,0,0,0,1|2,0,0]=3 177 B20R2.10809 O=C(Cc1ccccc1)N\N=C(/c2ccccc2)\C Amb2582696 [0,0,0,0,0,1|3,0,0]=4 178 B20R2.10809 O=C(Cc1ccccc1)OCC(=O)c2ccccc2 Amb1675542 [0,0,0,0,0,1|1,0,0]=2 179 B20R2.10809 O=C(NNC(=O)C[n+]1ccccc1)c2ccccc2 Amb22343589 [0,0,0,0,0,1|3,0,0]=4 180 B20R2.10809 O=C(Nc1ccccc1)CNC(=O)c2cccnc2 Amb11489456 [0,0,0,0,0,1|3,0,0]=4 181 B20R2.10809 O=C(Nc1ccccc1)CNC(=O)c2ccncc2 Amb11315603 [0,0,0,0,0,1|3,0,0]=4 182 B20R2.10809 O=C(Nc1ccccc1)COC(=O)c2ccccn2 Amb1547096 [0,0,0,0,0,1|2,0,0]=3 183 B20R2.10809 O=C(Nc1ccccc1)COC(=O)c2cccnc2 Amb1958422 [0,0,0,0,0,1|2,0,0]=3 184 B20R2.10809 O=C(Nc1ccccc1)COC(=O)c2ccncc2 Amb2291793 [0,0,0,0,0,1|2,0,0]=3 185 B20R2.10809 O=C(Nc1ccccc1)COC(=O)c2cnccn2 Amb1553397 [0,0,0,0,0,1|3,0,0]=4 186 B20R2.10809 O=C(Nc1ccccc1)NN=C(c2ccccc2)C Amb16224938 [0,0,0,0,0,1|3,0,0]=4 187 B20R2.10809 O=C(Nc1ccccc1)NNC(=O)c2cccnc2 Amb1539755 [0,0,0,0,0,1|3,0,0]=4 188 B20R2.10809 O=C(Nc1ccccc1)NNC(=O)c2ccncc2 Amb2387521 [0,0,0,0,0,1|3,0,0]=4 189 B20R2.10809 O=C(Nc1ccccc1)ONC(=O)c2ccccc2 Amb22461833 [0,0,0,0,0,1|1,0,0]=2 190 B20R2.10809 O=C(Nc1cccnc1)CCC(=O)c2ccccc2 Amb1867756 [0,0,0,0,0,1|3,0,0]=4 191 B20R2.10809 O=C(Nc1cccnc1)NNC(=O)c2ccccc2 Amb11262215 [0,0,0,0,0,1|3,0,0]=4 192 B20R2.10826 O=C(O[Cu]OC(=O)c1ccccc1)c2ccccc2 Amb22358855 [0,0,0,0,0,1|0,0,0]=1 193 B20R2.10826 O=C(O[Cu]OC(=O)c1ccccc1)c2ccccc2 Amb22359593 [0,0,0,0,0,1|0,0,0]=1 194 B20R2.10826 O=C(O[Zn]OC(=O)c1cccc[n]1)c2cccc[n]2 Amb20240650 [0,0,0,0,0,1|2,0,0]=3 195 B20R2.10826 O=C(SCSC(=O)c1ccccc1)c2ccccc2 Amb22477289 [0,0,0,0,0,1|0,2,0]=3 196 B20R2.10826 O=C(c1ccccc1)CSCC(=O)c2ccccc2 Amb1262729 [0,0,0,0,0,1|1,1,0]=3 197 B20R2.10826 O=C(c1ccccc1)N\N=C\C(=O)c2ccccc2 Amb1007925 [0,0,0,0,0,1|2,0,0]=3 198 B20R2.10826 O=C(c1ccncc1)N\N=C\C(=O)c2ccccc2 Amb2230206 [0,0,0,0,0,1|3,0,0]=4 199 B17R2.2382 C(=C/c1ccccc1)\C=C\c2ccccc2 Amb2458220 [2,0,0,0,0,0|2,0,0]=4 200 B17R2.2382 c1ccc(cc1)\C=N/C=C\c2ccccc2 Amb10559943 [2,0,0,0,0,0|2,0,0]=4 201 B17R2.2382 c1ccc(cc1)\C=N\N=C\c2ccccc2 Amb1419561 [2,0,0,0,0,0|2,0,0]=4 202 B19R2.4201 Brc1ccc(cc1)C(=O)NOCc2ccccc2 Amb10496516 [1,1,0,0,0,0|1,0,1]=4 203 B19R2.4201 Brc1ccc(cc1)C(=O)N\N=C\c2ccccc2 Amb1224922 [1,1,0,0,0,0|2,0,0]=4 204 B19R2.4201 Cc1ccc(cc1)C(=O)N\C=C\c2ccccc2 Amb10561815 [1,1,0,0,0,0|2,0,0]=4 205 B19R2.4201 Clc1ccc(cc1)C(=O)NOCc2ccccc2 Amb1942150 [1,1,0,0,0,0|1,0,1]=4 206 B19R2.4201 Clc1ccc(cc1)C(=O)N\N=C\c2ccccc2 Amb1625143 [1,1,0,0,0,0|2,0,0]=4 207 B19R2.4201 Fc1ccc(cc1)C(=O)NOCc2ccccc2 Amb15957175 [1,1,0,0,0,0|1,0,1]=4 208 B19R2.4201 Fc1ccc(cc1)C(=O)N\N=C\c2ccccc2 Amb1672441 [1,1,0,0,0,0|2,0,0]=4 209 B19R2.4201 Ic1ccc(cc1)C(=O)NOCc2ccccc2 Amb10496519 [1,1,0,0,0,0|1,0,1]=4 210 B19R2.4201 Nc1ccc(cc1)C(=O)OCCc2ccccc2 Amb10565274 [1,1,0,0,0,0|1,0,1]=4 211 B19R2.4201 O=C(COCc1ccccc1)c2ccc(F)cc2 Amb22059046 [1,1,0,0,0,0|1,0,1]=4 212 B19R2.4201 Oc1ccc(cc1)C(=O)OCCc2ccccc2 Amb2104053 [1,1,0,0,0,0|1,0,1]=4 213 B19R2.4394 Brc1cccc(c1)C(=O)NN=Cc2ccccc2 Amb13962030 [1,1,0,0,0,0|2,0,0]=4 214 B19R2.4394 Brc1cccc(c1)C(=O)NOCc2ccccc2 Amb10496522 [1,1,0,0,0,0|1,0,1]=4 215 B19R2.4394 Brc1cccc(c1)C(=O)N\N=C/c2ccccc2 Amb2227755 [1,1,0,0,0,0|2,0,0]=4 216 B19R2.4394 Ic1cccc(c1)C(=O)NOCc2ccccc2 Amb10496527 [1,1,0,0,0,0|1,0,1]=4 217 B19R2.4394 Nc1cccc(c1)C(=O)OCCc2ccccc2 Amb17307680 [1,1,0,0,0,0|1,0,1]=4 218 B19R2.4394 Oc1cccc(c1)C(=O)OCCc2ccccc2 Amb2140603 [1,1,0,0,0,0|1,0,1]=4 219 B19R2.4481 O=C(c1ccccc1)N\N=C\c2ccccc2Cl Amb2233732 [1,1,0,0,0,0|2,0,0]=4 220 B19R2.4481 O=C(c1ccccc1)N\N=C\c2ccccc2O Amb1625723 [1,1,0,0,0,0|2,0,0]=4 221 B19R2.4481 O=C(c1ccccc1)O\N=C\c2ccccc2O Amb2223426 [1,1,0,0,0,0|1,0,0]=3 222 B19R2.5666 Nc1ccccc1C(=O)NOCc2ccccc2 Amb24103875 [1,1,0,0,0,0|1,0,1]=4 223 B19R2.5666 O=C(c1ccccc1Br)NN=Cc2ccccc2 Amb13958744 [1,1,0,0,0,0|2,0,0]=4 224 B19R2.5666 O=C(c1ccccc1Br)N\N=C\c2ccccc2 Amb1263392 [1,1,0,0,0,0|2,0,0]=4 225 B19R2.5666 O=C(c1ccccc1C)NOCc2ccccc2 Amb15957188 [1,1,0,0,0,0|1,0,1]=4 226 B19R2.5666 O=C(c1ccccc1C)N\N=C\c2ccccc2 Amb1263206 [1,1,0,0,0,0|2,0,0]=4 227 B19R2.5666 O=C(c1ccccc1Cl)NOCc2ccccc2 Amb15957173 [1,1,0,0,0,0|1,0,1]=4 228 B19R2.5666 O=C(c1ccccc1Cl)N\N=C\c2ccccc2 Amb1016552 [1,1,0,0,0,0|2,0,0]=4 229 B19R2.5666 O=C(c1ccccc1F)NOCc2ccccc2 Amb15957298 [1,1,0,0,0,0|1,0,1]=4 230 B19R2.5666 O=C(c1ccccc1I)NOCc2ccccc2 Amb10496525 [1,1,0,0,0,0|1,0,1]=4 231 B19R2.5666 O=C(c1ccccc1N)N\N=C\c2ccccc2 Amb2480728 [1,1,0,0,0,0|2,0,0]=4 232 B19R2.5666 O=C(c1ccccc1N)OCCc2ccccc2 Amb17307696 [1,1,0,0,0,0|1,0,1]=4 233 B19R2.5666 O=C(c1ccccc1O)NOCc2ccccc2 Amb16136274 [1,1,0,0,0,0|1,0,1]=4 234 B19R2.5666 O=C(c1ccccc1O)N\N=C\c2ccccc2 Amb1007760 [1,1,0,0,0,0|2,0,0]=4 235 B19R2.5666 O=C(c1ccccc1O)OCCc2ccccc2 Amb2131090 [1,1,0,0,0,0|1,0,1]=4 236 B19R2.8929 CC(=Cc1ccccc1)OC(=O)c2ccccc2 Amb24064890 [1,1,0,0,0,0|1,0,0]=3 237 B19R2.11850 Brc1ccc(cc1)C=NNC(=O)c2ccccc2 Amb13958760 [1,1,0,0,0,0|2,0,0]=4 238 B19R2.11850 Brc1ccc(cc1)\C=N/NC(=O)c2ccccc2 Amb2465850 [1,1,0,0,0,0|2,0,0]=4 239 B19R2.11850 Cc1ccc(cc1)CONC(=O)c2ccccc2 Amb2264990 [1,1,0,0,0,0|1,0,1]=4 240 B19R2.11850 Cc1ccc(cc1)\C=N\NC(=O)c2ccccc2 Amb1419559 [1,1,0,0,0,0|2,0,0]=4 241 B19R2.11850 Clc1ccc(cc1)\C=N\NC(=O)c2ccccc2 Amb1883961 [1,1,0,0,0,0|2,0,0]=4 242 B19R2.11850 O=C(NOCc1ccc(Br)cc1)c2ccccc2 Amb22462099 [1,1,0,0,0,0|1,0,1]=4 243 B19R2.11850 Oc1ccc(cc1)\C=N\NC(=O)c2ccccc2 Amb1263433 [1,1,0,0,0,0|2,0,0]=4 244 B19R2.201 CO\C(=C/C(=O)c1ccccc1)\c2ccccc2 Amb17596560 [0,1,0,0,1,0|1,0,1]=4 245 B19R2.4362 C[n+]1cccc(c1)C(=O)CC(=O)c2ccccc2 Amb10555003 [0,1,0,0,1,0|2,0,0]=4 246 B19R2.4362 Cc1cc(ccc1)C(=O)NC(=O)c2ccccc2 Amb24097299 [0,1,0,0,1,0|1,0,0]=3 247 B19R2.5647 CC(OC(=O)c1ccccc1F)c2ccccc2 Amb22275273 [0,1,0,0,1,0|1,0,1]=4 248 B19R2.5647 O=C(c1ccccc1)NC(=O)c2ccccc2O Amb1893471 [0,1,0,0,1,0|1,0,0]=3 249 B19R2.5647 O\C(=C/C(=O)c1ccccc1O)\c2ccccc2 Amb18663639 [0,1,0,0,1,0|1,0,1]=4 250 B19R2.5647 Oc1ccccc1C(=O)CC(=O)c2c[n]ccc2 Amb18663874 [0,1,0,0,1,0|2,0,0]=4 251 B19R2.5647 Oc1ccccc1C(=O)CC(=O)c2cc[n]cc2 Amb18663873 [0,1,0,0,1,0|2,0,0]=4 252 B19R2.8901 O=C([CH-]S(=O)(=O)c1ccccc1)c2ccccc2 Amb22469421 [0,1,0,0,1,0|2,0,0]=4 253 B19R2.8901 O=C(c1ccccc1)NS(=O)(=O)c2ccccc2 Amb2228031 [0,1,0,0,1,0|2,0,0]=4 254 B19R2.12286 Nc1ccc(cc1)C(=O)NC(=O)c2ccccc2 Amb22167927 [0,1,0,0,1,0|1,0,0]=3 255 B19R2.12286 Nc1ccc(cc1)C(=O)OC(c2ccccc2)C Amb10565277 [0,1,0,0,1,0|1,0,1]=4 256 B19R2.21040 BrC(C(=O)c1ccccc1)C(=O)c2ccccc2 Amb1209218 [0,1,0,0,1,0|1,0,0]=3 257 B19R2.21040 O=C(C(=O)c1ccccc1)C(=O)c2ccccc2 Amb16233218 [0,1,0,0,1,0|1,0,0]=3 258 B19R2.21040 O=C(c1ccccc1)\C(\Br)=C(/Br)\c2ccccc2 Amb22471934 [0,1,0,0,1,0|2,0,0]=4 259 B19R2.21040 ON(C(=O)c1ccccc1)C(=O)c2ccccc2 Amb22454961 [0,1,0,0,1,0|1,0,0]=3 260 B19R2.4138 Brc1c[nH]c(c1)C(=O)OCC(=O)c2ccccc2 Amb245423 [0,1,0,0,1,0|2,0,0]=4 261 B19R2.4138 Brc1ccc(s1)C(=O)COC(=O)c2ccccc2 Amb21999 [0,1,0,0,1,0|2,0,0]=4 262 B19R2.4138 Cc1ccc(s1)C(=O)OCC(=O)c2ccccc2 Amb21399 [0,1,0,0,1,0|2,0,0]=4 263 B19R2.4371 Brc1cccc(c1)C(=O)COC(=O)c2ccco2 Amb1884926 [0,1,0,0,1,0|2,0,0]=4 264 B19R2.4371 Brc1cccc(c1)C(=O)COC(=O)c2cccs2 Amb1885016 [0,1,0,0,1,0|2,0,0]=4 265 B19R2.4371 Brc1cccc(c1)C(=O)ONC(=O)c2cccs2 Amb2247390 [0,1,0,0,1,0|2,0,0]=4 266 B19R2.4371 Nc1cc(ccc1)C(=O)OCC(=O)c2ccc[s]2 Amb20656734 [0,1,0,0,1,0|2,0,0]=4 267 B19R2.4371 Oc1cccc(c1)C(=O)OCC(=O)c2ccco2 Amb241301 [0,1,0,0,1,0|2,0,0]=4 268 B19R2.4371 Oc1cccc(c1)C(=O)OCC(=O)c2cccs2 Amb208286 [0,1,0,0,1,0|2,0,0]=4 269 B19R2.4497 O=C(c1ccco1)OCC(=O)c2ccccc2Br Amb12762 [0,1,0,0,1,0|2,0,0]=4 270 B19R2.4497 O=C(c1cccs1)COC(=O)c2ccccc2Br Amb12247 [0,1,0,0,1,0|2,0,0]=4 271 B19R2.4497 O=C(c1cccs1)COC(=O)c2ccccc2O Amb1241218 [0,1,0,0,1,0|2,0,0]=4 272 B19R2.4497 O=C(c1cccs1)NOC(=O)c2ccccc2Cl Amb2247424 [0,1,0,0,1,0|2,0,0]=4 273 B19R2.4497 O=C(c1cccs1)NOC(=O)c2ccccc2I Amb2247391 [0,1,0,0,1,0|2,0,0]=4 274 B19R2.4590 O=C(c1ccccc1)COC(=O)c2sccc2C Amb12182 [0,1,0,0,1,0|2,0,0]=4 275 B19R2.11868 Cc1ccc(cc1)C(=O)COC(=O)c2c[s]cc2 Amb22724586 [0,1,0,0,1,0|2,0,0]=4 276 B19R2.11868 Clc1ccc(cc1)C(=O)COC(=O)c2ccc[nH]2 Amb124463 [0,1,0,0,1,0|2,0,0]=4 277 B19R2.11868 Fc1ccc(cc1)C(=O)OCC(=O)c2ccc[nH]2 Amb13954063 [0,1,0,0,1,0|2,0,0]=4 278 B19R2.11868 Ic1ccc(cc1)C(=O)COC(=O)c2ccc[nH]2 Amb122298 [0,1,0,0,1,0|2,0,0]=4 279 B19R2.11868 Ic1ccc(cc1)C(=O)OCC(=O)c2ccco2 Amb16059 [0,1,0,0,1,0|2,0,0]=4 280 B19R2.11868 O=C(NOC(=O)c1ccc(F)cc1)c2ccco2 Amb22467908 [0,1,0,0,1,0|2,0,0]=4 281 B19R2.11868 O=C(OCC(=O)c1ccc(Br)cc1)c2c[s]cc2 Amb22724589 [0,1,0,0,1,0|2,0,0]=4 282 B19R2.11868 O=C(OCC(=O)c1ccc(Cl)cc1)c2c[s]cc2 Amb22724592 [0,1,0,0,1,0|2,0,0]=4 283 B19R2.11868 O=C(OCC(=O)c1ccc(F)cc1)c2c[s]cc2 Amb22724584 [0,1,0,0,1,0|2,0,0]=4 284 B19R2.11868 Oc1ccc(cc1)C(=O)OCC(=O)c2ccc[nH]2 Amb21252 [0,1,0,0,1,0|2,0,0]=4 285 B19R2.11868 Oc1ccc(cc1)C(=O)OCC(=O)c2cccs2 Amb1228055 [0,1,0,0,1,0|2,0,0]=4 286 B21R2.4544 Cc1ccc(cc1)NC(=O)ONC(=O)c2ccccc2 Amb22433037 [0,1,0,0,0,1|1,0,0]=3 287 B21R2.4544 Clc1ccc(cc1)C\C(=N\OC(=O)c2ccccc2)\N Amb1796947 [0,1,0,0,0,1|2,0,0]=4 288 B21R2.4544 O=C(Cc1ccc(cc1)Br)OCC(=O)c2ccccc2 Amb1884929 [0,1,0,0,0,1|1,0,0]=3 289 B21R2.4544 O=C(Nc1ccc(Br)cc1)ONC(=O)c2ccccc2 Amb22461994 [0,1,0,0,0,1|1,0,0]=3 290 B21R2.4544 O=C(Nc1ccc(Cl)cc1)OCC(=O)c2ccccc2 Amb22477275 [0,1,0,0,0,1|1,0,0]=3 291 B21R2.4544 O=C(Nc1ccc(Cl)cc1)ONC(=O)c2ccccc2 Amb22446770 [0,1,0,0,0,1|1,0,0]=3 292 B21R2.4544 O=C(Nc1ccc(F)cc1)ONC(=O)c2ccccc2 Amb22461999 [0,1,0,0,0,1|1,0,0]=3 293 B21R2.4544 O=C(Nc1ccc(cc1)Br)COC(=O)c2ccccn2 Amb2361421 [0,1,0,0,0,1|2,0,0]=4 294 B21R2.4544 O=C(Nc1ccc(cc1)C)CNC(=O)c2ccccc2 Amb1919596 [0,1,0,0,0,1|2,0,0]=4 295 B21R2.4544 O=C(Nc1ccc(cc1)C)COC(=O)c2ccccn2 Amb1548744 [0,1,0,0,0,1|2,0,0]=4 296 B21R2.4544 O=C(Nc1ccc(cc1)C)COC(=O)c2cccnc2 Amb1957111 [0,1,0,0,0,1|2,0,0]=4 297 B21R2.4544 O=C(Nc1ccc(cc1)Cl)COC(=O)c2ccccc2 Amb1224376 [0,1,0,0,0,1|1,0,0]=3 298 B21R2.4544 O=C(Nc1ccc(cc1)Cl)COC(=O)c2cccnc2 Amb1957329 [0,1,0,0,0,1|2,0,0]=4 299 B21R2.4544 O=C(Nc1ccc(cc1)F)CNC(=O)c2ccccc2 Amb1919523 [0,1,0,0,0,1|2,0,0]=4 300 B21R2.4544 O=C(Nc1ccc(cc1)F)COC(=O)c2cccnc2 Amb1957709 [0,1,0,0,0,1|2,0,0]=4 301 B21R2.4544 O=C(Nc1ccc(cc1)N)CNC(=O)c2ccccc2 Amb2414630 [0,1,0,0,0,1|2,0,0]=4 302 B21R2.4544 O=C(Nc1ccc(cn1)Cl)COC(=O)c2ccccc2 Amb2299835 [0,1,0,0,0,1|2,0,0]=4 303 B21R2.4544 Oc1ccc(cc1)NC(=O)CSC(=O)c2ccccc2 Amb24310625 [0,1,0,0,0,1|1,1,0]=4 304 B21R2.4730 O=C(NCC(=O)c1cc(F)ccc1)Oc2ccccc2 Amb22482269 [0,1,0,0,0,1|2,0,0]=4 305 B21R2.4730 O=C(Nc1ccccc1)CNC(=O)c2cccc(c2)F Amb11219661 [0,1,0,0,0,1|2,0,0]=4 306 B21R2.4730 O=C(Nc1ccccc1)COC(=O)c2cccc(c2)C Amb1226738 [0,1,0,0,0,1|1,0,0]=3 307 B21R2.4730 O=C(Nc1ccccc1)COC(=O)c2cccc(c2)Cl Amb1226665 [0,1,0,0,0,1|1,0,0]=3 308 B21R2.4730 O=C(Nc1ccccc1)COC(=O)c2cccc(c2)O Amb1188870 [0,1,0,0,0,1|1,0,0]=3 309 B21R2.4730 O=C(Nc1ccccc1)COC(=O)c2cncc(c2)Br Amb1178254 [0,1,0,0,0,1|2,0,0]=4 310 B21R2.4730 O=C(Nc1ccccc1)NNC(=O)c2cccc(c2)C Amb2551274 [0,1,0,0,0,1|2,0,0]=4 311 B21R2.4745 O=C(Cc1cccc(c1)F)NNC(=O)c2ccccc2 Amb154067 [0,1,0,0,0,1|2,0,0]=4 312 B21R2.4745 O=C(Nc1cccc(c1)Br)COC(=O)c2ccccn2 Amb2361107 [0,1,0,0,0,1|2,0,0]=4 313 B21R2.4745 O=C(Nc1cccc(c1)Br)CSC(=O)c2ccccc2 Amb2245243 [0,1,0,0,0,1|1,1,0]=4 314 B21R2.4745 O=C(Nc1cccc(c1)C)COC(=O)c2ccccn2 Amb1547095 [0,1,0,0,0,1|2,0,0]=4 315 B21R2.4745 O=C(Nc1cccc(c1)C)COC(=O)c2cccnc2 Amb1955876 [0,1,0,0,0,1|2,0,0]=4 316 B21R2.4745 O=C(Nc1cccc(c1)Cl)COC(=O)c2ccccn2 Amb1542246 [0,1,0,0,0,1|2,0,0]=4 317 B21R2.4745 O=C(Nc1cccc(c1)Cl)COC(=O)c2cccnc2 Amb1958529 [0,1,0,0,0,1|2,0,0]=4 318 B21R2.4745 O=C(Nc1cccc(c1)Cl)COC(=O)c2ccncc2 Amb2305280 [0,1,0,0,0,1|2,0,0]=4 319 B21R2.4745 O=C(Nc1cccc(c1)Cl)NNC(=O)c2ccccc2 Amb1550442 [0,1,0,0,0,1|2,0,0]=4 320 B21R2.4745 O=C(Nc1cccc(c1)I)COC(=O)c2ccccn2 Amb2270134 [0,1,0,0,0,1|2,0,0]=4 321 B21R2.4853 Cc1ccccc1C(=O)O\N=C(/N)\Cc2ccccc2 Amb23247791 [0,1,0,0,0,1|2,0,0]=4 322 B21R2.4853 N\C(\Cc1ccccc1)=N/OC(=O)c2ccccc2Cl Amb23247797 [0,1,0,0,0,1|2,0,0]=4 323 B21R2.4853 N\C(\Cc1ccccc1)=N/OC(=O)c2ccccc2F Amb23247796 [0,1,0,0,0,1|2,0,0]=4 324 B21R2.4853 Nc1ccccc1C(=O)OCC(=O)Nc2cccc[n]2 Amb20237208 [0,1,0,0,0,1|2,0,0]=4 325 B21R2.4853 Nc1ccccc1C(=O)OCC(=O)Nc2ccccc2 Amb20237061 [0,1,0,0,0,1|1,0,0]=3 326 B21R2.4853 O=C(Nc1ccccc1)CNC(=O)c2ccccc2C Amb15818732 [0,1,0,0,0,1|2,0,0]=4 327 B21R2.4853 O=C(Nc1ccccc1)CNC(=O)c2ccccc2F Amb142644 [0,1,0,0,0,1|2,0,0]=4 328 B21R2.4853 O=C(Nc1ccccc1)COC(=O)c2ccccc2C Amb1226641 [0,1,0,0,0,1|1,0,0]=3 329 B21R2.4853 O=C(Nc1ccccc1)COC(=O)c2ccccc2Cl Amb1226726 [0,1,0,0,0,1|1,0,0]=3 330 B21R2.4853 O=C(Nc1ccccc1)COC(=O)c2ccccc2F Amb1205386 [0,1,0,0,0,1|1,0,0]=3 331 B21R2.4853 O=C(Nc1ccccc1)COC(=O)c2ccccc2O Amb1224210 [0,1,0,0,0,1|1,0,0]=3 332 B21R2.4853 O=C(Nc1ccccc1)COC(=O)c2cccnc2Cl Amb1673018 [0,1,0,0,0,1|2,0,0]=4 333 B21R2.4853 O=C(Nc1ccccc1)NNC(=O)c2ccccc2C Amb2551236 [0,1,0,0,0,1|2,0,0]=4 334 B21R2.4853 O=C(Nc1ccccc1)NNC(=O)c2ccccc2Cl Amb1561468 [0,1,0,0,0,1|2,0,0]=4 335 B21R2.4853 O=C(OCC(=O)Nc1cccc[n]1)c2ccccc2F Amb20236851 [0,1,0,0,0,1|2,0,0]=4 336 B21R2.7851 O=C(Cc1ccccc1Cl)NNC(=O)c2ccccc2 Amb154073 [0,1,0,0,0,1|2,0,0]=4 337 B21R2.7851 O=C(Nc1ccccc1Br)COC(=O)c2ccccc2 Amb2273057 [0,1,0,0,0,1|1,0,0]=3 338 B21R2.7851 O=C(Nc1ccccc1Br)COC(=O)c2ccccn2 Amb2361384 [0,1,0,0,0,1|2,0,0]=4 339 B21R2.7851 O=C(Nc1ccccc1Br)COC(=O)c2ccncc2 Amb2245485 [0,1,0,0,0,1|2,0,0]=4 340 B21R2.7851 O=C(Nc1ccccc1C)CCC(=O)c2ccccc2 Amb2330328 [0,1,0,0,0,1|2,0,0]=4 341 B21R2.7851 O=C(Nc1ccccc1C)CNC(=O)c2ccccc2 Amb1919645 [0,1,0,0,0,1|2,0,0]=4 342 B21R2.7851 O=C(Nc1ccccc1C)COC(=O)c2ccccn2 Amb1547491 [0,1,0,0,0,1|2,0,0]=4 343 B21R2.7851 O=C(Nc1ccccc1C)COC(=O)c2cccnc2 Amb1958629 [0,1,0,0,0,1|2,0,0]=4 344 B21R2.7851 O=C(Nc1ccccc1C)CSC(=O)c2ccccc2 Amb2244604 [0,1,0,0,0,1|1,1,0]=4 345 B21R2.7851 O=C(Nc1ccccc1Cl)COC(=O)c2ccccc2 Amb1224032 [0,1,0,0,0,1|1,0,0]=3 346 B21R2.7851 O=C(Nc1ccccc1Cl)COC(=O)c2ccccn2 Amb2257963 [0,1,0,0,0,1|2,0,0]=4 347 B21R2.7851 O=C(Nc1ccccc1Cl)COC(=O)c2ccncc2 Amb2245486 [0,1,0,0,0,1|2,0,0]=4 348 B21R2.7851 O=C(Nc1ccccc1F)COC(=O)c2cccnc2 Amb1958052 [0,1,0,0,0,1|2,0,0]=4 349 B21R2.7851 O=C(Nc1ccccc1F)CSC(=O)c2ccccc2 Amb2243877 [0,1,0,0,0,1|1,1,0]=4 350 B21R2.7851 O=C(Nc1ccccc1O)CCC(=O)c2ccccc2 Amb160238 [0,1,0,0,0,1|2,0,0]=4 351 B21R2.7851 O=C(Nc1ccccc1O)CNC(=O)c2ccccc2 Amb1231808 [0,1,0,0,0,1|2,0,0]=4 352 B21R2.13129 CC(C(=O)Oc1ccccc1)NC(=O)c2ccccc2 Amb11215396 [0,1,0,0,0,1|2,0,0]=4 353 B21R2.13148 O=C(C(=O)c1ccccc1)OCC(=O)c2ccccc2 Amb1883681 [0,1,0,0,0,1|1,0,0]=3 354 B21R2.19002 Cc1ccc(c[n]1)C(=O)OCC(=O)Nc2ccccc2 Amb19955741 [0,1,0,0,0,1|2,0,0]=4 355 B21R2.19002 Cc1ccc(cc1)C(=O)CCC(=O)Oc2ccccc2 Amb21522935 [0,1,0,0,0,1|2,0,0]=4 356 B21R2.19002 Cc1ccc(cc1)C(=O)NOC(=O)Nc2ccccc2 Amb22469271 [0,1,0,0,0,1|1,0,0]=3 357 B21R2.19002 Cc1ccc(cc1)C(=O)O\N=C(/N)\Cc2ccccc2 Amb23247792 [0,1,0,0,0,1|2,0,0]=4 358 B21R2.19002 Cc1ccc(cc1)C(Cl)=NOC(=O)Nc2ccccc2 Amb22453222 [0,1,0,0,0,1|2,0,0]=4 359 B21R2.19002 N\C(\Cc1ccccc1)=N/OC(=O)c2ccc(F)cc2 Amb23247794 [0,1,0,0,0,1|2,0,0]=4 360 B21R2.19002 O=C(Cc1ccccc1)NNC(=O)c2ccc(cc2)C Amb2550045 [0,1,0,0,0,1|2,0,0]=4 361 B21R2.19002 O=C(Cc1ccccc1)OCC(=O)c2ccc(cc2)C Amb1638168 [0,1,0,0,0,1|1,0,0]=3 362 B21R2.19002 O=C(Cc1ccccc1)O\N=C(\c2ccc(cc2)Br)/C Amb2223511 [0,1,0,0,0,1|2,0,0]=4 363 B21R2.19002 O=C(Nc1ccccc1)CCC(=O)c2ccc(cc2)Br Amb145850 [0,1,0,0,0,1|2,0,0]=4 364 B21R2.19002 O=C(Nc1ccccc1)CCC(=O)c2ccc(cc2)C Amb1833835 [0,1,0,0,0,1|2,0,0]=4 365 B21R2.19002 O=C(Nc1ccccc1)CNC(=O)c2ccc(cc2)Cl Amb1547769 [0,1,0,0,0,1|2,0,0]=4 366 B21R2.19002 O=C(Nc1ccccc1)COC(=O)c2ccc(cc2)F Amb1234547 [0,1,0,0,0,1|1,0,0]=3 367 B21R2.19002 O=C(Nc1ccccc1)COC(=O)c2ccc(cc2)O Amb1217356 [0,1,0,0,0,1|1,0,0]=3 368 B21R2.19002 O=C(Nc1ccccc1)COC(=O)c2ccc(nc2)Cl Amb10357149 [0,1,0,0,0,1|2,0,0]=4 369 B21R2.19002 O=C(Nc1ccccc1)CSC(=O)c2ccc(cc2)F Amb1396101 [0,1,0,0,0,1|1,1,0]=4 370 B21R2.19002 O=C(Nc1ccccc1)NNC(=O)c2ccc(cc2)Cl Amb1552211 [0,1,0,0,0,1|2,0,0]=4 371 B21R2.19002 O=C(OCC(=O)Nc1cccc[n]1)c2ccc(F)cc2 Amb20237349 [0,1,0,0,0,1|2,0,0]=4 372 B21R2.19002 O=C(ONC(=O)c1ccc(Br)cc1)Oc2ccccc2 Amb22433541 [0,1,0,0,0,1|1,0,0]=3 373 B21R2.19161 Clc1ccc(cc1)C(=O)N\N=C\C(=O)c2ccccc2 Amb1007926 [0,1,0,0,0,1|2,0,0]=4 374 B21R2.205886 O=C(c1ccccc1)\C=N\NC(=O)c2ccccc2Br Amb2247044 [0,1,0,0,0,1|2,0,0]=4 375 B21R2.1604 Cc1ccc(cc1)\C(=N/OC(=O)c2ccccc2)\OC Amb22461832 [0,2,0,0,0,0|1,0,1]=4 376 B21R2.508926 O\N=C(\c1ccccc1)/COC(=O)c2ccc(cc2)Br Amb1007658 [0,2,0,0,0,0|1,0,1]=4 377 B21R2.508926 O\N=C(\c1ccccc1)/COC(=O)c2ccc(cc2)C Amb1926539 [0,2,0,0,0,0|1,0,1]=4 378 B21R2.508939 O\N=C(\c1ccccc1)/COC(=O)c2cccc(c2)C Amb1926541 [0,2,0,0,0,0|1,0,1]=4 379 B21R2.508939 O\N=C(\c1ccccc1)/COC(=O)c2cccc(c2)N Amb1926578 [0,2,0,0,0,0|1,0,1]=4 380 B21R2.3546 COc1cccc(c1)C(=O)OCC(=O)c2ccccc2 Amb1227877 [0,2,0,0,0,0|1,0,0]=3 381 B21R2.4729 Cc1cc(ccc1)C(=O)NCC(=O)c2cccc(F)c2 Amb22443663 [0,2,0,0,0,0|2,0,0]=4 382 B21R2.4729 Cc1cccc(c1)C(=O)NNC(=O)c2cccc(c2)I Amb1028155 [0,2,0,0,0,0|2,0,0]=4 383 B21R2.4729 Clc1cccc(c1)C(=O)COC(=O)c2cccc(c2)I Amb15689 [0,2,0,0,0,0|1,0,0]=3 384 B21R2.4729 O=C(NCC(=O)c1cccc(F)c1)c2cc(Cl)ccc2 Amb22475598 [0,2,0,0,0,0|2,0,0]=4 385 B21R2.4729 O=C(OOC(=O)c1cc(Cl)ccc1)c2cc(Cl)ccc2 Amb22552549 [0,2,0,0,0,0|0,0,0]=2 386 B21R2.4729 Oc1cccc(c1)C(=O)NNC(=O)c2cccc(c2)Br Amb163154 [0,2,0,0,0,0|2,0,0]=4 387 B21R2.4729 Oc1cccc(c1)C(=O)OCC(=O)c2cccc(c2)F Amb1569332 [0,2,0,0,0,0|1,0,0]=3 388 B21R2.4780 O=C(c1ccccc1)COC(=O)c2cccc(c2O)C Amb1025302 [0,2,0,0,0,0|1,0,0]=3 389 B21R2.4880 Cc1ccc(F)cc1C(=O)NNC(=O)c2ccccc2 Amb21197639 [0,2,0,0,0,0|2,0,0]=4 390 B21R2.4880 Cc1ccc(c(c1)C(=O)CNC(=O)c2ccccc2)C Amb17361837 [0,2,0,0,0,0|2,0,0]=4 391 B21R2.4880 Fc1ccc(c(c1)C(=O)CNC(=O)c2ccccc2)F Amb17366475 [0,2,0,0,0,0|2,0,0]=4 392 B21R2.4880 Fc1ccc(c(c1)C(=O)NNC(=O)c2ccccc2)Br Amb15952100 [0,2,0,0,0,0|2,0,0]=4 393 B21R2.4880 Fc1ccc(c(c1)C(=O)NNC(=O)c2ccccc2)F Amb10614719 [0,2,0,0,0,0|2,0,0]=4 394 B21R2.4880 O=C(NNC(=O)c1ccccc1)c2cc(Cl)ccc2I Amb21285863 [0,2,0,0,0,0|2,0,0]=4 395 B21R2.19001 Brc1ccc(cc1)C(=O)COC(=O)c2cccc(c2)C Amb1007089 [0,2,0,0,0,0|1,0,0]=3 396 B21R2.19001 Brc1ccc(cc1)C(=O)COC(=O)c2cccc(c2)I Amb2543566 [0,2,0,0,0,0|1,0,0]=3 397 B21R2.19001 Brc1ccc(cc1)\C(=N\OC(=O)c2cccc(c2)C)\N Amb1842994 [0,2,0,0,0,0|2,0,0]=4 398 B21R2.19001 Brc1ccc(cc1)\C(=N\OC(=O)c2cccc(c2)F)\N Amb1869647 [0,2,0,0,0,0|2,0,0]=4 399 B21R2.19001 Cc1ccc(cc1)C(=O)CNC(=O)c2cccc(c2)C Amb17361833 [0,2,0,0,0,0|2,0,0]=4 400 B21R2.19001 Cc1ccc(cc1)C(=O)CNC(=O)c2cccc(c2)F Amb17364117 [0,2,0,0,0,0|2,0,0]=4 401 B21R2.19001 Cc1ccc(cc1)C(=O)COC(=O)c2cccc(c2)F Amb16200775 [0,2,0,0,0,0|1,0,0]=3 402 B21R2.19001 Cc1ccc(cc1)C(=O)COC(=O)c2cncc(c2)Br Amb1091587 [0,2,0,0,0,0|2,0,0]=4 403 B21R2.19001 Cc1ccc(cc1)C(=O)NCC(=O)c2cccc(F)c2 Amb22449310 [0,2,0,0,0,0|2,0,0]=4 404 B21R2.19001 Cc1ccc(cc1)C(=O)NNC(=O)c2cccc(c2)F Amb11216300 [0,2,0,0,0,0|2,0,0]=4 405 B21R2.19001 Cc1ccc(cc1)\C(=N\OC(=O)c2cccc(c2)Br)\N Amb1871479 [0,2,0,0,0,0|2,0,0]=4 406 B21R2.19001 Clc1ccc(cc1)C(=O)COC(=O)c2cccc(c2)O Amb1333812 [0,2,0,0,0,0|1,0,0]=3 407 B21R2.19001 Clc1ccc(cc1)C(=O)NNC(=O)c2cccc(c2)F Amb221416 [0,2,0,0,0,0|2,0,0]=4 408 B21R2.19001 Clc1ccc(cc1)C(=O)NOC(=O)c2cccc(c2)I Amb1871481 [0,2,0,0,0,0|1,0,0]=3 409 B21R2.19001 Fc1ccc(cc1)C(=O)CNC(=O)c2cccc(c2)C Amb17364120 [0,2,0,0,0,0|2,0,0]=4 410 B21R2.19001 Fc1ccc(cc1)C(=O)CNC(=O)c2cccc(c2)F Amb17366473 [0,2,0,0,0,0|2,0,0]=4 411 B21R2.19001 Fc1ccc(cc1)C(=O)COC(=O)c2cccc(c2)C Amb1566818 [0,2,0,0,0,0|1,0,0]=3 412 B21R2.19001 Fc1ccc(cc1)C(=O)COC(=O)c2cccc(c2)O Amb1530148 [0,2,0,0,0,0|1,0,0]=3 413 B21R2.19001 Fc1ccc(cc1)C(=O)COC(=O)c2cncc(c2)Br Amb1178205 [0,2,0,0,0,0|2,0,0]=4 414 B21R2.19001 Fc1ccc(cc1)C(=O)NNC(=O)c2cccc(c2)C Amb2551258 [0,2,0,0,0,0|2,0,0]=4 415 B21R2.19001 Fc1ccc(cc1)C(=O)NNC(=O)c2cccc(c2)O Amb121179 [0,2,0,0,0,0|2,0,0]=4 416 B21R2.19001 Fc1ccc(cc1)C(=O)OCC(=O)c2cccc(c2)Cl Amb12251 [0,2,0,0,0,0|1,0,0]=3 417 B21R2.19001 Ic1ccc(cc1)C(=O)OCC(=O)c2cccc(c2)Cl Amb13421 [0,2,0,0,0,0|1,0,0]=3 418 B21R2.19001 O=C(NCC(=O)c1cccc(F)c1)c2ccc(Cl)cc2 Amb22449311 [0,2,0,0,0,0|2,0,0]=4 419 B21R2.19001 Oc1ccc(cc1)C(=O)NNC(=O)c2cccc(c2)Cl Amb136201 [0,2,0,0,0,0|2,0,0]=4 420 B21R2.19359 Nc1cc(ccc1N)C(=O)OCC(=O)c2ccccc2 Amb22750471 [0,2,0,0,0,0|1,0,0]=3 421 B21R2.19359 O=C(c1ccc(c(c1)C)C)CNC(=O)c2ccccc2 Amb17361836 [0,2,0,0,0,0|2,0,0]=4 422 B21R2.19359 O=C(c1ccc(c(c1)C)C)NCC(=O)c2ccccc2 Amb17361830 [0,2,0,0,0,0|2,0,0]=4 423 B21R2.19359 O=C(c1ccc(c(c1)C)F)CNC(=O)c2ccccc2 Amb17364123 [0,2,0,0,0,0|2,0,0]=4 424 B21R2.19359 O=C(c1ccc(c(c1)Cl)Cl)COC(=O)c2cccnc2 Amb1957883 [0,2,0,0,0,0|2,0,0]=4 425 B21R2.19359 O=C(c1ccc(c(c1)Cl)Cl)O\N=C(\c2ccccc2)/N Amb1845238 [0,2,0,0,0,0|2,0,0]=4 426 B21R2.19359 O=C(c1ccc(c(c1)F)C)NNC(=O)c2ccccc2 Amb15982072 [0,2,0,0,0,0|2,0,0]=4 427 B21R2.19359 O=C(c1ccc(c(c1)F)F)CNC(=O)c2ccccc2 Amb17366476 [0,2,0,0,0,0|2,0,0]=4 428 B21R2.19359 O=C(c1ccc(c(c1)F)F)NCC(=O)c2ccccc2 Amb17366471 [0,2,0,0,0,0|2,0,0]=4 429 B21R2.19359 O=C(c1ccc(c(c1)F)F)NNC(=O)c2ccccc2 Amb11236498 [0,2,0,0,0,0|2,0,0]=4 430 B21R2.19359 O=C(c1ccc(c(c1)N)Cl)OCC(=O)c2ccccc2 Amb1232376 [0,2,0,0,0,0|1,0,0]=3 431 B21R2.19359 O=C(c1ccc(c(c1)O)C)OCC(=O)c2ccccc2 Amb121547 [0,2,0,0,0,0|1,0,0]=3 432 B21R2.103618 Brc1cccc(c1)C(=O)COC(=O)c2ccccc2C Amb12929 [0,2,0,0,0,0|1,0,0]=3 433 B21R2.103618 Brc1cccc(c1)C(=O)COC(=O)c2ccccc2Cl Amb12984 [0,2,0,0,0,0|1,0,0]=3 434 B21R2.103618 Brc1cccc(c1)C(=O)NNC(=O)c2ccccc2Cl Amb1240064 [0,2,0,0,0,0|2,0,0]=4 435 B21R2.103618 Brc1cncc(c1)C(=O)OCC(=O)c2ccccc2F Amb10358462 [0,2,0,0,0,0|2,0,0]=4 436 B21R2.103618 Cc1ccccc1C(=O)NCC(=O)c2cccc(F)c2 Amb22487935 [0,2,0,0,0,0|2,0,0]=4 437 B21R2.103618 Clc1cccc(c1)C(=O)COC(=O)c2cccnc2Cl Amb2246865 [0,2,0,0,0,0|2,0,0]=4 438 B21R2.103618 Clc1cccc(c1)C(=O)OCC(=O)c2ccccc2Br Amb12763 [0,2,0,0,0,0|1,0,0]=3 439 B21R2.103618 Fc1cccc(c1)C(=O)NNC(=O)c2ccccc2F Amb160682 [0,2,0,0,0,0|2,0,0]=4 440 B21R2.103618 O=C(NCC(=O)c1cccc(F)c1)c2ccccc2Cl Amb22487936 [0,2,0,0,0,0|2,0,0]=4 441 B21R2.103618 Oc1cccc(c1)C(=O)NNC(=O)c2ccccc2Br Amb1230634 [0,2,0,0,0,0|2,0,0]=4 442 B21R2.103618 Oc1cccc(c1)C(=O)NNC(=O)c2ccccc2F Amb1567678 [0,2,0,0,0,0|2,0,0]=4 443 B21R2.3816 C=Cc1ccccc1C(=O)NNC(=O)c2ccccc2 Amb22465181 [0,2,0,0,0,0|2,0,0]=4 444 B21R2.3816 COc1ccccc1C(=O)OCC(=O)c2ccccc2 Amb1229297 [0,2,0,0,0,0|1,0,0]=3 445 B21R2.3816 CSc1ncccc1C(=O)OCC(=O)c2ccccc2 Amb2249833 [0,2,0,0,0,0|2,0,0]=4 446 B21R2.10020 O=C(c1ccccc1)COC(=O)c2c(F)cccc2Cl Amb18431 [0,2,0,0,0,0|1,0,0]=3 447 B21R2.10020 O=C(c1ccccc1)COC(=O)c2c(N)cccc2Cl Amb1900826 [0,2,0,0,0,0|1,0,0]=3 448 B21R2.10020 Oc1cccc(O)c1C(=O)OCC(=O)c2ccccc2 Amb22483001 [0,2,0,0,0,0|1,0,0]=3 449 B21R2.107532 O=C(NNC(=O)c1ccccc1I)c2ccccc2I Amb19851294 [0,2,0,0,0,0|2,0,0]=4 450 B21R2.107532 O=C(c1ccccc1Br)COC(=O)c2ccccc2Br Amb12248 [0,2,0,0,0,0|1,0,0]=3 451 B21R2.107532 O=C(c1ccccc1Br)COC(=O)c2cccnc2Cl Amb2248935 [0,2,0,0,0,0|2,0,0]=4 452 B21R2.107532 O=C(c1ccccc1Br)NNC(=O)c2ccccc2Br Amb2228855 [0,2,0,0,0,0|2,0,0]=4 453 B21R2.107532 O=C(c1ccccc1Cl)COC(=O)c2ccccc2Cl Amb12869 [0,2,0,0,0,0|1,0,0]=3 454 B21R2.107532 O=C(c1ccccc1Cl)COC(=O)c2ccccc2I Amb13003 [0,2,0,0,0,0|1,0,0]=3 455 B21R2.107532 O=C(c1ccccc1F)NNC(=O)c2ccccc2F Amb154063 [0,2,0,0,0,0|2,0,0]=4 456 B21R2.107532 O=C(c1ccccc1O)NNC(=O)c2ccccc2Br Amb1231475 [0,2,0,0,0,0|2,0,0]=4 457 B21R2.107532 O=C(c1ccccc1S)NNC(=O)c2ccccc2S Amb17609628 [0,2,0,0,0,0|2,0,0]=4 458 B21R2.108525 Cc1ccc(c(c1)C)C(=O)CNC(=O)c2ccccc2 Amb17361838 [0,2,0,0,0,0|2,0,0]=4 459 B21R2.108525 Clc1ccc(c(c1)Cl)C(=O)COC(=O)c2ccccn2 Amb2248238 [0,2,0,0,0,0|2,0,0]=4 460 B21R2.108525 Clc1ccc(c(c1)Cl)C(=O)NNC(=O)c2ccccc2 Amb1541876 [0,2,0,0,0,0|2,0,0]=4 461 B21R2.108525 Clc1ccc(c(c1)N)C(=O)OCC(=O)c2ccccc2 Amb2246871 [0,2,0,0,0,0|1,0,0]=3 462 B21R2.108525 Fc1ccc(c(c1)Cl)C(=O)OCC(=O)c2ccccc2 Amb12206 [0,2,0,0,0,0|1,0,0]=3 463 B21R2.108525 Fc1ccc(c(c1)F)C(=O)OCC(=O)c2ccccc2 Amb21398 [0,2,0,0,0,0|1,0,0]=3 464 B21R2.108525 O=C(NNC(=O)c1ccccc1)c2ccc(F)cc2I Amb21285858 [0,2,0,0,0,0|2,0,0]=4 465 B21R2.108525 O=C(OCC(=O)c1ccc(Cl)cc1Cl)c2ccccc2 Amb20656748 [0,2,0,0,0,0|1,0,0]=3 466 B21R2.108525 Oc1ccc(c(c1)O)C(=O)COC(=O)c2ccccc2 Amb148523 [0,2,0,0,0,0|1,0,0]=3 467 B21R2.108525 Oc1ccc(c(c1)O)C(=O)OCC(=O)c2ccccc2 Amb1289498 [0,2,0,0,0,0|1,0,0]=3 468 B21R2.359068 Brc1ccc(cc1)C(=O)COC(=O)c2ccccc2Br Amb1812378 [0,2,0,0,0,0|1,0,0]=3 469 B21R2.359068 Brc1ccc(cc1)C(=O)COC(=O)c2ccccc2F Amb1203343 [0,2,0,0,0,0|1,0,0]=3 470 B21R2.359068 Brc1ccc(cc1)C(=O)COC(=O)c2ccccc2N Amb1926542 [0,2,0,0,0,0|1,0,0]=3 471 B21R2.359068 Brc1ccc(cc1)C(=O)COC(=O)c2ccccc2O Amb1212653 [0,2,0,0,0,0|1,0,0]=3 472 B21R2.359068 Brc1ccc(cc1)\C(=N\OC(=O)c2ccccc2F)\N Amb2224995 [0,2,0,0,0,0|2,0,0]=4 473 B21R2.359068 Cc1ccc(cc1)C(=O)CNC(=O)c2ccccc2C Amb17361832 [0,2,0,0,0,0|2,0,0]=4 474 B21R2.359068 Cc1ccc(cc1)C(=O)CNC(=O)c2ccccc2F Amb17364116 [0,2,0,0,0,0|2,0,0]=4 475 B21R2.359068 Cc1ccc(cc1)C(=O)COC(=O)c2ccccc2Br Amb1202740 [0,2,0,0,0,0|1,0,0]=3 476 B21R2.359068 Cc1ccc(cc1)C(=O)COC(=O)c2ccccc2O Amb1265163 [0,2,0,0,0,0|1,0,0]=3 477 B21R2.359068 Cc1ccc(cc1)C(=O)NNC(=O)c2ccccc2O Amb1581639 [0,2,0,0,0,0|2,0,0]=4 478 B21R2.359068 Cc1ccc(cc1)\C(=N\OC(=O)c2ccccc2Br)\C Amb1811150 [0,2,0,0,0,0|2,0,0]=4 479 B21R2.359068 Clc1ccc(cc1)C(=O)COC(=O)c2ccccc2N Amb2304597 [0,2,0,0,0,0|1,0,0]=3 480 B21R2.359068 Clc1ccc(cc1)C(=O)COC(=O)c2ccccc2O Amb1564844 [0,2,0,0,0,0|1,0,0]=3 481 B21R2.359068 Clc1ccc(cc1)C(=O)COC(=O)c2cccnc2N Amb2315746 [0,2,0,0,0,0|2,0,0]=4 482 B21R2.359068 Clc1ccc(cc1)C(=O)NNC(=O)c2ccccc2O Amb2408855 [0,2,0,0,0,0|2,0,0]=4 483 B21R2.359068 Clc1ccc(cc1)C(=O)NOC(=O)c2ccccc2Br Amb1871478 [0,2,0,0,0,0|1,0,0]=3 484 B21R2.359068 Fc1ccc(cc1)C(=O)CNC(=O)c2ccccc2C Amb17364119 [0,2,0,0,0,0|2,0,0]=4 485 B21R2.359068 Fc1ccc(cc1)C(=O)CNC(=O)c2ccccc2F Amb17366472 [0,2,0,0,0,0|2,0,0]=4 486 B21R2.359068 Fc1ccc(cc1)C(=O)COC(=O)c2ccccc2Br Amb12501 [0,2,0,0,0,0|1,0,0]=3 487 B21R2.359068 Fc1ccc(cc1)C(=O)COC(=O)c2ccccc2O Amb1530270 [0,2,0,0,0,0|1,0,0]=3 488 B21R2.359068 Fc1ccc(cc1)C(=O)COC(=O)c2cccnc2Cl Amb2249981 [0,2,0,0,0,0|2,0,0]=4 489 B21R2.359068 Fc1ccc(cc1)C(=O)NNC(=O)c2ccccc2Cl Amb160681 [0,2,0,0,0,0|2,0,0]=4 490 B21R2.359068 Fc1ccc(cc1)C(=O)NNC(=O)c2ccccc2F Amb1552403 [0,2,0,0,0,0|2,0,0]=4 491 B21R2.359068 Nc1ccc(cc1)C(=O)OCC(=O)c2ccccc2Cl Amb22724261 [0,2,0,0,0,0|1,0,0]=3 492 B21R2.80 COc1ccc(cc1)C(=O)CNC(=O)c2ccccc2 Amb17362952 [0,2,0,0,0,0|2,0,0]=4 493 B21R2.80 COc1ccc(cc1)C(=O)O\N=C(\c2ccccc2)/C Amb2223506 [0,2,0,0,0,0|2,0,0]=4 494 B21R2.19154 Cc1ccc(cc1)C(=O)C(C)OC(=O)c2ccccc2 Amb20656746 [0,2,0,0,0,0|1,0,0]=3 495 B21R2.19154 Cc1ccc(cc1)C(=O)C(NC(=O)c2ccccc2)O Amb2458946 [0,2,0,0,0,0|2,0,0]=4 496 B21R2.19158 Clc1ccc(cc1)C(=O)NC(C(=O)c2ccccc2)Cl Amb13881232 [0,2,0,0,0,0|2,0,0]=4 497 B21R2.19158 Fc1ccc(cc1)C(=O)NC(C(=O)c2ccccc2)O Amb2493316 [0,2,0,0,0,0|2,0,0]=4 498 B21R2.19158 Nc1ccc(cc1)C(=O)OC(C(=O)c2ccccc2)C Amb16229993 [0,2,0,0,0,0|1,0,0]=3 499 B21R2.19158 Oc1ccc(cc1)C(=O)OC(C(=O)c2ccccc2)C Amb1228756 [0,2,0,0,0,0|1,0,0]=3 500 B21R2.19410 Brc1ccc(cc1)C(=O)COC(=O)c2ccc(cc2)I Amb1012467 [0,2,0,0,0,0|1,0,0]=3 501 B21R2.19410 Brc1ccc(cc1)C(=O)COC(=O)c2ccc(nc2)Cl Amb10357162 [0,2,0,0,0,0|2,0,0]=4 502 B21R2.19410 Brc1ccc(cc1)C(=O)OCC(=O)c2ccc(cc2)Br Amb1020908 [0,2,0,0,0,0|1,0,0]=3 503 B21R2.19410 Cc1ccc(cc1)C(=O)CNC(=O)c2ccc(cc2)F Amb17364118 [0,2,0,0,0,0|2,0,0]=4 504 B21R2.19410 Cc1ccc(cc1)C(=O)COC(=O)c2ccc(cc2)I Amb13372 [0,2,0,0,0,0|1,0,0]=3 505 B21R2.19410 Cc1ccc(cc1)C(=O)COC(=O)c2ccc(cc2)O Amb2419321 [0,2,0,0,0,0|1,0,0]=3 506 B21R2.19410 Cc1ccc(cc1)C(=O)NCC(=O)c2ccc(cc2)F Amb17364121 [0,2,0,0,0,0|2,0,0]=4 507 B21R2.19410 Cc1ccc(cc1)C(=O)NNC(=O)c2ccc(cc2)Br Amb2229551 [0,2,0,0,0,0|2,0,0]=4 508 B21R2.19410 Cc1ccc(cc1)C(=O)OCC(=O)c2ccc(cc2)Br Amb1926544 [0,2,0,0,0,0|1,0,0]=3 509 B21R2.19410 Cc1ccc(cc1)C(=O)O\N=C(\c2ccc(cc2)Cl)/N Amb1869646 [0,2,0,0,0,0|2,0,0]=4 510 B21R2.19410 Cc1ccc(cc1)\C(=N\OC(=O)c2ccc(cc2)F)\C Amb1812638 [0,2,0,0,0,0|2,0,0]=4 511 B21R2.19410 Clc1ccc(cc1)C(=O)COC(=O)c2ccc(cc2)I Amb11750 [0,2,0,0,0,0|1,0,0]=3 512 B21R2.19410 Clc1ccc(cc1)C(=O)NNC(=O)c2ccc(cc2)I Amb2228834 [0,2,0,0,0,0|2,0,0]=4 513 B21R2.19410 Clc1ccc(cc1)C(=O)NOC(=O)c2ccc(cc2)Br Amb1871480 [0,2,0,0,0,0|1,0,0]=3 514 B21R2.19410 Fc1ccc(cc1)C(=O)NCC(=O)c2ccc(cc2)F Amb17366474 [0,2,0,0,0,0|2,0,0]=4 515 B21R2.19410 Fc1ccc(cc1)C(=O)OCC(=O)c2ccc(cc2)Br Amb1783906 [0,2,0,0,0,0|1,0,0]=3 516 B21R2.19410 Fc1ccc(cc1)C(=O)OCC(=O)c2ccc(cc2)F Amb12551 [0,2,0,0,0,0|1,0,0]=3 517 B21R2.19410 Fc1ccc(cc1)C(=O)O\N=C(\c2ccc(cc2)Cl)/N Amb1871397 [0,2,0,0,0,0|2,0,0]=4 518 B21R2.19410 O=C(CCC(=O)c1ccc(F)cc1)c2ccc(Br)cc2 Amb21859144 [0,2,0,0,0,0|2,0,0]=4 519 B21R2.19410 O=C(COC(=O)C1=CNC(=O)C=C1)c2ccc(Br)cc2 Amb19654041 [0,2,0,0,0,0|2,0,0]=4 520 B21R2.19410 O=C(OOC(=O)c1ccc(Cl)cc1)c2ccc(Cl)cc2 Amb22733226 [0,2,0,0,0,0|0,0,0]=2 521 B21R2.19410 O=C(c1ccc(cc1)C)C#CC(=O)c2ccc(cc2)C Amb1541441 [0,2,0,0,0,0|2,0,0]=4 522 B21R2.19410 O=C(c1ccc(cc1)C)\C=C\C(=O)c2ccc(cc2)C Amb1538863 [0,2,0,0,0,0|2,0,0]=4 523 B21R2.19410 O=C(c1ccc(cc1)Cl)NNC(=O)c2ccc(cc2)Cl Amb2388109 [0,2,0,0,0,0|2,0,0]=4 524 B21R2.19410 O=C(c1ccc(cc1)Cl)\C=C\C(=O)c2ccc(cc2)Cl Amb1544258 [0,2,0,0,0,0|2,0,0]=4 525 B21R2.19410 Oc1ccc(cc1)C(=O)OCC(=O)c2ccc(cc2)Cl Amb1188445 [0,2,0,0,0,0|1,0,0]=3 526 B21R2.19410 Oc1ccc(cc1)C(=O)OCC(=O)c2ccc(cc2)F Amb1188449 [0,2,0,0,0,0|1,0,0]=3 527 B21R2.13273 CCN(NC(=O)c1ccccc1)C(=O)c2ccccc2 Amb22485055 [0,2,0,0,0,0|2,0,0]=4 528 B21R2.13273 COC(=CC(=O)c1ccccc1)C(=O)c2ccccc2 Amb22456126 [0,2,0,0,0,0|2,0,0]=4 529 B21R2.40171 O=C(C(Br)C(Br)C(=O)c1ccccc1)c2ccccc2 Amb22730689 [0,2,0,0,0,0|2,0,0]=4 530 B21R2.40171 O[C-](C(=O)C(=O)c1ccccc1)C(=O)c2ccccc2 Amb22475573 [0,2,0,0,0,0|2,0,0]=4 531 B19R3.27 c1ccc(cc1)c2onc(c2)c3ccccc3 Amb1145156 [1,0,0,1,0,0|2,0,0]=4 532 B19R3.27 c1ccc(cc1)c2onc(n2)c3ccccc3 Amb1042936 [1,0,0,1,0,0|2,0,0]=4 533 B19R3.27 c1oc([n]c1-c2ccccc2)-c3ccccc3 Amb22732958 [1,0,0,1,0,0|2,0,0]=4 534 B19R3.9008 O=C1NN=C(c2ccccc21)c3ccccc3 Amb19386826 [1,0,0,1,0,0|2,0,0]=4 535 B19R3.9008 O=C1NN=C(c2ccccc21)c3ccccc3 Amb22358340 [1,0,0,1,0,0|2,0,0]=4 536 B19R3.9008 O=C1OCN(c2ccccc21)c3ccccc3 Amb20657502 [1,0,0,1,0,0|2,0,0]=4 537 B19R3.9008 O=C1ON=C(c2ccccc21)c3ccccc3 Amb19651648 [1,0,0,1,0,0|1,0,0]=3 538 B19R3.9008 O=c1[nH]nc(c2c1cccc2)c3ccccc3 Amb1544478 [1,0,0,1,0,0|2,0,0]=4 539 B19R3.17443 O=C1C\C(=C/c2ccccc2)\c3ccccc31 Amb22462186 [1,0,0,1,0,0|2,0,0]=4 540 B19R3.17443 O=C1OC(Cc2ccccc2)c3ccccc31 Amb22467244 [1,0,0,1,0,0|1,0,1]=4 541 B19R3.17443 O=C1OC(Sc2ccccc2)c3ccccc31 Amb21948307 [1,0,0,1,0,0|2,0,0]=4 542 B19R3.17443 O=C1OC(c2c1cccc2)Nc3ccccc3 Amb1419326 [1,0,0,1,0,0|2,0,0]=4 543 B19R3.17443 O=C1O\C(=C/c2ccccc2)\c3c1cccc3 Amb2553194 [1,0,0,1,0,0|1,0,0]=3 544 B19R3.22113 O=C(C1N=C1c2ccccc2)c3ccccc3 Amb17596025 [1,0,0,1,0,0|2,0,0]=4 545 B19R3.22113 O=C(C1OC1c2ccccc2)c3ccccc3 Amb1395275 [1,0,0,1,0,0|1,0,1]=4 546 B19R3.9171 O=C1C=C(Nc2ccccc21)c3ccccc3 Amb20247405 [0,0,0,1,1,0|2,0,0]=4 547 B19R3.9171 O=C1C=C(Oc2ccccc21)c3ccccc3 Amb18511585 [0,0,0,1,1,0|1,0,1]=4 548 B19R3.9171 O=C1C=C(Sc2ccccc21)c3ccccc3 Amb19666767 [0,0,0,1,1,0|1,1,0]=4 549 B19R3.9171 O=C1C=C([Se]c2ccccc21)c3ccccc3 Amb19200783 [0,0,0,1,1,0|1,1,0]=4 550 B19R3.9171 O=C1N=C(Nc2ccccc21)c3ccccc3 Amb20621986 [0,0,0,1,1,0|2,0,0]=4 551 B19R3.9171 O=C1N=C(Oc2ccccc21)c3ccccc3 Amb22366746 [0,0,0,1,1,0|1,0,1]=4 552 B19R3.9171 O=C1NC(=Cc2ccccc21)c3ccccc3 Amb21948315 [0,0,0,1,1,0|2,0,0]=4 553 B19R3.9171 O=C1NC(=Nc2ccccc21)c3ccccc3 Amb17997264 [0,0,0,1,1,0|2,0,0]=4 554 B19R3.9171 O=C1OC(=Cc2ccccc21)c3cc[n]cc3 Amb19264200 [0,0,0,1,1,0|2,0,0]=4 555 B19R3.9171 O=C1OC(=Cc2ccccc21)c3ccccc3 Amb19752055 [0,0,0,1,1,0|1,0,0]=3 556 B19R3.9171 O=C1OC(=Nc2[n]cccc21)c3ccccc3 Amb22462860 [0,0,0,1,1,0|2,0,0]=4 557 B19R3.9171 O=C1OC(=Nc2ccccc21)c3c[n]ccc3 Amb19767236 [0,0,0,1,1,0|2,0,0]=4 558 B19R3.9171 O=C1OC(=Nc2ccccc21)c3cc[n]cc3 Amb21848325 [0,0,0,1,1,0|2,0,0]=4 559 B19R3.9171 O=C1OC(=Nc2ccccc21)c3cccc[n]3 Amb20665045 [0,0,0,1,1,0|2,0,0]=4 560 B19R3.9171 O=C1OC(=Nc2ccccc21)c3ccccc3 Amb19115379 [0,0,0,1,1,0|1,0,0]=3 561 B19R3.9171 O=C1OC(Cc2c1cccc2)c3ccccc3 Amb2548140 [0,0,0,1,1,0|1,0,1]=4 562 B19R3.9171 O=C1[NH+]=C(Sc2ccccc12)c3ccccc3 Amb20661024 [0,0,0,1,1,0|1,1,0]=4 563 B19R3.9171 O=c1oc([n]c2c[n]ccc21)-c3ccccc3 Amb24081251 [0,0,0,1,1,0|2,0,0]=4 564 B19R3.9171 O=c1oc(cc2c1cccc2)c3ccccc3 Amb1789165 [0,0,0,1,1,0|1,0,0]=3 565 B19R3.2538724 O=C1OC(c2c1cccc2)(Cl)c3ccccc3 Amb10554674 [0,0,0,1,1,0|1,0,1]=4 566 B19R3.2937660 O=C1NC(=O)c2ccccc2-c3ccccc13 Amb20662182 [0,0,0,1,1,0|1,0,0]=3 567 B19R3.2937660 O=C1OC(=O)c2ccccc2-c3ccccc13 Amb19854180 [0,0,0,1,1,0|0,0,0]=2 568 B21R3.19521 O=C1Nc2ccccc2N(C1)C(=O)c3ccccc3 Amb1543195 [0,0,0,1,0,1|2,0,0]=4 569 B21R3.19579 O=C(c1ccccc1)Cn2c(=O)oc3c2cccc3 Amb1544233 [0,0,0,1,0,1|2,0,0]=4 570 B21R3.19579 O=C(c1ccccc1)Cn2c(=O)sc3c2cccc3 Amb2196530 [0,0,0,1,0,1|2,0,0]=4 571 B21R3.19579 O=C(c1ccccc1)\C=C\2/C(=O)Nc3c2cccc3 Amb1213225 [0,0,0,1,0,1|2,0,0]=4 572 B21R3.19579 O=C1Oc2ccccc2N1CC(=O)c3ccccc3 Amb19150710 [0,0,0,1,0,1|2,0,0]=4 573 B21R3.19579 O=C1Sc2ccccc2N1CC(=O)c3ccccc3 Amb19655142 [0,0,0,1,0,1|2,0,0]=4 574 B21R3.24408 O=C(c1ccccc1)OCc2nc3c(s2)cccc3 Amb1206065 [0,0,0,1,0,1|1,1,0]=4 575 B21R3.4959510 O=C(Nc1ccccc1)C2OC(=O)c3ccccc32 Amb22464429 [0,0,0,1,0,1|1,0,0]=3 576 B21R3.3450 O=C(c1coc(c1)-c2ccccc2)c3ccccc3 Amb22363700 [0,0,0,1,0,1|2,0,0]=4 577 B21R3.4959518 O=C(OC1=CC(=O)c2ccccc12)c3ccccc3 Amb22488447 [0,0,0,1,0,1|1,0,0]=3 578 B21R3.4959518 O=C(OC1OC(=O)c2ccccc12)c3ccccc3 Amb17843980 [0,0,0,1,0,1|0,0,0]=2 579 B21R3.4959518 O=C(c1ccccc1)CC2OC(=O)c3c2cccc3 Amb2516161 [0,0,0,1,0,1|1,0,0]=3 580 B21R3.4959518 O=C1OC(NC(=O)c2ccccc2)c3ccccc13 Amb22480352 [0,0,0,1,0,1|1,0,0]=3 581 B21R3.902181 N#C\C(=C\1/OC(=O)c2ccccc21)\c3ccccc3 Amb19767672 [0,1,0,1,0,0|2,0,0]=4 582 B21R3.3619379 O=Cc1cn(c2c1cccc2)C(=O)c3ccccc3 Amb17352053 [0,1,0,1,0,0|2,0,0]=4 583 B21R3.7432324 Cc1cc(ccc1)C(=O)N2SC(=O)c3ccccc23 Amb22660979 [0,1,0,1,0,0|1,1,0]=4 584 B21R3.7432324 O=C1SN(c2ccccc12)C(=O)c3cc(Br)ccc3 Amb22660992 [0,1,0,1,0,0|1,1,0]=4 585 B21R3.7432324 O=C1SN(c2ccccc12)C(=O)c3cc(Cl)ccc3 Amb22660989 [0,1,0,1,0,0|1,1,0]=4 586 B21R3.7432324 O=C1SN(c2ccccc12)C(=O)c3cc(F)ccc3 Amb22660986 [0,1,0,1,0,0|1,1,0]=4 587 B21R3.13081 O=C(c1ccccc1)\C=C/2\Nc3c(C2=O)cccc3 Amb17596864 [0,1,0,1,0,0|2,0,0]=4 588 B21R3.13081 O=C1C(Cc2ccccc12)NC(=O)c3ccccc3 Amb22445826 [0,1,0,1,0,0|2,0,0]=4 589 B21R3.6678036 Cc1ccccc1C(=O)N2SC(=O)c3ccccc23 Amb22660978 [0,1,0,1,0,0|1,1,0]=4 590 B21R3.6678036 O=C(c1ccccc1Br)N2SC(=O)c3ccccc23 Amb22660991 [0,1,0,1,0,0|1,1,0]=4 591 B21R3.6678036 O=C(c1ccccc1Cl)N2SC(=O)c3ccccc23 Amb22660988 [0,1,0,1,0,0|1,1,0]=4 592 B21R3.6678036 O=C(c1ccccc1F)N2SC(=O)c3ccccc23 Amb22660985 [0,1,0,1,0,0|1,1,0]=4 593 B21R3.4959513 O=C1OC(c2c1cccc2)S(=O)(=O)c3ccccc3 Amb10554693 [0,1,0,1,0,0|2,0,0]=4 594 B21R3.652642 Cc1ccc(cc1)C(=O)N2SC(=O)c3ccccc23 Amb22660980 [0,1,0,1,0,0|1,1,0]=4 595 B21R3.652642 O=C1SN(c2ccccc12)C(=O)c3ccc(Cl)cc3 Amb22660990 [0,1,0,1,0,0|1,1,0]=4 596 B21R3.652642 O=C1SN(c2ccccc12)C(=O)c3ccc(F)cc3 Amb22660987 [0,1,0,1,0,0|1,1,0]=4 597 B21R4.309746 O=C1C2=C(c3ccccc13)C(=O)c4ccccc42 Amb22235997 [0,0,0,2,0,0|2,0,0]=4 598 B17R2.2342 O=C(/C=C/c1ccccc1)c2ccccc2 Amb17777126 [1,0,0,0,1,0|1,0,0]=3 599 B17R2.2342 O=C(C=Cc1cccc[n]1)c2ccccc2 Amb24064883 [1,0,0,0,1,0|2,0,0]=4 600 B17R2.2342 O=C(C=Cc1ccccc1)c2c[n]ccc2 Amb22358854 [1,0,0,0,1,0|2,0,0]=4 601 B17R2.2342 O=C(C=Cc1ccccc1)c2cc[n]cc2 Amb22358856 [1,0,0,0,1,0|2,0,0]=4 602 B17R2.2342 O=C(C=Nc1ccccc1)c2ccccc2 Amb22479824 [1,0,0,0,1,0|2,0,0]=4 603 B17R2.2342 O=C(N=Nc1ccccc1)c2ccccc2 Amb24064474 [1,0,0,0,1,0|2,0,0]=4 604 B17R2.2342 O=C(NOc1ccccc1)c2ccccc2 Amb22484084 [1,0,0,0,1,0|1,0,0]=3 605 B17R2.2342 O=C(O[Hg]c1ccccc1)c2ccccc2 Amb22733234 [1,0,0,0,1,0|1,0,0]=3 606 B17R2.2342 O=C(\C=C\c1ccccc1)c2cc[nH+]cc2 Amb22342936 [1,0,0,0,1,0|2,0,0]=4 607 B17R2.2342 O=C(\C=C\c1ccccc1)c2cc[n]cc2 Amb22369494 [1,0,0,0,1,0|2,0,0]=4 608 B17R2.2342 O=C(c1ccccc1)CCc2ccccc2 Amb2228399 [1,0,0,0,1,0|1,0,1]=4 609 B17R2.2342 O=C(c1ccccc1)NNc2ccccc2 Amb1229298 [1,0,0,0,1,0|2,0,0]=4 610 B17R2.2342 O=C(c1ccccc1)OCc2ccccn2 Amb16207520 [1,0,0,0,1,0|1,0,1]=4 611 B17R2.2342 O=C(c1ccccc1)SCc2ccccc2 Amb1394994 [1,0,0,0,1,0|0,1,1]=4 612 B17R2.2342 O=C(c1ccccc1)\C=C\c2ccccn2 Amb17140401 [1,0,0,0,1,0|2,0,0]=4 613 B17R2.2342 O=C(c1ccccc1)\C=C\c2cccnc2 Amb135551 [1,0,0,0,1,0|2,0,0]=4 614 B17R2.2342 O=C(c1ccccc1)\N=N\c2ccccc2 Amb16231118 [1,0,0,0,1,0|2,0,0]=4 615 B17R2.2342 O=C(c1ccccn1)\C=C\c2ccccc2 Amb2418890 [1,0,0,0,1,0|2,0,0]=4 616 B17R2.2342 O=C(c1cccnc1)OCc2ccccc2 Amb1548203 [1,0,0,0,1,0|1,0,1]=4 617 B17R2.2342 O=C(c1cccnc1)\C=C\c2ccccc2 Amb11226469 [1,0,0,0,1,0|2,0,0]=4 618 B17R2.2342 O=C(c1ccncc1)OCc2ccccc2 Amb2251405 [1,0,0,0,1,0|1,0,1]=4 619 B17R2.2342 O=C(c1ccncc1)\C=C\c2ccccc2 Amb10554722 [1,0,0,0,1,0|2,0,0]=4 620 B17R2.10205 BrC(=C(Br)c1ccccc1)c2ccccc2 Amb17777191 [0,0,0,0,2,0|2,0,0]=4 621 B17R2.10205 Br\C(\c1ccccc1)=C(\Br)/c2ccccc2 Amb22360125 [0,0,0,0,2,0|2,0,0]=4 622 B17R2.10205 C=C(C(=C)c1ccccc1)c2ccccc2 Amb15693465 [0,0,0,0,2,0|2,0,0]=4 623 B17R2.10205 C\C(=C(\c1ccccc1)/C)\c2ccccc2 Amb2389676 [0,0,0,0,2,0|2,0,0]=4 624 B17R2.10205 C\C(\c1ccccc1)=C(\C)/c2ccccc2 Amb22365205 [0,0,0,0,2,0|2,0,0]=4 625 B17R2.10205 ClC(C(=O)c1ccccc1)c2ccccc2 Amb1676617 [0,0,0,0,2,0|1,0,1]=4 626 B17R2.10205 F\C(=C(/c1ccccc1)\F)\c2ccccc2 Amb13952904 [0,0,0,0,2,0|2,0,0]=4 627 B17R2.10205 I\C(\c1ccccc1)=C(\I)/c2ccccc2 Amb22363513 [0,0,0,0,2,0|2,0,0]=4 628 B17R2.10205 N/C(c1ccccc1)=C(\N)c2ccccc2 Amb17777246 [0,0,0,0,2,0|2,0,0]=4 629 B17R2.10205 NC(C(=O)c1ccccc1)c2ccccc2 Amb17939052 [0,0,0,0,2,0|1,0,1]=4 630 B17R2.10205 NC(C(=O)c1ccccc1)c2ccccc2 Amb19373676 [0,0,0,0,2,0|1,0,1]=4 631 B17R2.10205 O=C(C(=O)c1ccccc1)c2ccccc2 Amb2388293 [0,0,0,0,2,0|0,0,0]=2 632 B17R2.10205 O=C(C(=O)c1ccccn1)c2ccccn2 Amb1208385 [0,0,0,0,2,0|2,0,0]=4 633 B17R2.10205 O=C(c1ccccc1)N(Cl)c2ccccc2 Amb24096515 [0,0,0,0,2,0|2,0,0]=4 634 B17R2.10205 O[C@@H](C(=O)c1ccccc1)c2ccccc2 Amb22353499 [0,0,0,0,2,0|0,0,2]=4 635 B17R2.10205 O[C@H](C(=O)c1ccccc1)c2ccccc2 Amb22351502 [0,0,0,0,2,0|0,0,2]=4 636 B17R2.10205 S=C(c1ccccc1)C(=S)c2ccccc2 Amb22733811 [0,0,0,0,2,0|0,2,0]=4 637 B17R2.10205 [NH3+]/C(c1ccccc1)=C(/[NH3+])c2ccccc2 Amb17777298 [0,0,0,0,2,0|2,0,0]=4 638 B17R2.10205 [NH3+]/C(c1ccccc1)=C(\[NH3+])c2ccccc2 Amb17777300 [0,0,0,0,2,0|2,0,0]=4 639 B19R2.8899 O=C(CCOCc1ccccc1)c2ccccc2 Amb22232966 [1,0,0,0,0,1|1,0,1]=4 640 B19R2.8899 O=C(OC/C=C/c1ccccc1)c2ccccc2 Amb17777843 [1,0,0,0,0,1|1,0,0]=3 641 B19R2.8899 O=C(c1ccccc1)OCCCc2ccccc2 Amb10558738 [1,0,0,0,0,1|1,0,1]=4 642 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 Amb21374460 [1,0,0,0,0,1|1,0,1]=4 643 B19R2.8900 O=C(Cc1ccccc1)N\C=C\c2ccccc2 Amb10561816 [1,0,0,0,0,1|2,0,0]=4 644 B19R2.8900 O=C(Cc1ccccc1)N\N=C\c2ccccc2 Amb1227684 [1,0,0,0,0,1|2,0,0]=4 645 B19R2.8900 O=C(N\N=C/c1ccccc1)Nc2ccccc2 Amb23225807 [1,0,0,0,0,1|2,0,0]=4 646 B19R2.8900 O=C(Nc1ccccc1)N\N=C\c2ccccc2 Amb2411324 [1,0,0,0,0,1|2,0,0]=4 647 B19R2.113679 O=C(Nc1ccccc1)COC(=O)c2ccco2 Amb1541833 [0,0,0,0,1,1|2,0,0]=4 648 B19R2.113679 O=C(Nc1ccccc1)COC(=O)c2cccs2 Amb1201431 [0,0,0,0,1,1|2,0,0]=4 649 B19R2.113679 O=C(OCC(=O)Nc1ccccc1)c2cocc2 Amb19937993 [0,0,0,0,1,1|2,0,0]=4 650 B21R2.13142 O=C(Nc1ccccc1)CCNC(=O)c2ccccc2 Amb2117366 [0,0,0,0,0,2|2,0,0]=4 651 B21R2.13142 O=C(Nc1ccccc1)CO\N=C(\c2ccccc2)/N Amb11212597 [0,0,0,0,0,2|2,0,0]=4 652 B21R2.13163 C\C(\Cc1ccccc1)=N/OC(=O)Nc2ccccc2 Amb22355586 [0,0,0,0,0,2|2,0,0]=4 653 B21R2.13163 O=C(Cc1ccccc1)NNC(=O)Cc2ccccc2 Amb1824585 [0,0,0,0,0,2|2,0,0]=4 654 B21R2.13163 O=C(NNC(=O)Oc1ccccc1)Oc2ccccc2 Amb19889095 [0,0,0,0,0,2|2,0,0]=4 655 B21R2.13163 O=C(\C=C\C(=O)Nc1ccccc1)Nc2ccccc2 Amb22446459 [0,0,0,0,0,2|2,0,0]=4 656 B21R2.27923 O=C(C=Cc1ccccc1)NCC(=O)c2ccccc2 Amb22449898 [0,0,0,0,0,2|2,0,0]=4 657 B21R2.27923 O=C(CCC(=O)c1ccccc1)NCc2ccccc2 Amb203265 [0,0,0,0,0,2|2,0,0]=4 658 B21R2.27923 O=C(COC(=O)c1ccccc1)NCc2ccccc2 Amb1225500 [0,0,0,0,0,2|1,0,0]=3 659 B21R2.27923 O=C(COC(=O)c1ccccc1)OCc2ccccc2 Amb22233309 [0,0,0,0,0,2|1,0,0]=3 660 B21R2.27923 O=C(COC(=O)c1ccccn1)NCc2ccccc2 Amb1203029 [0,0,0,0,0,2|2,0,0]=4 661 B21R2.27923 O=C(COC(=O)c1cccnc1)NCc2ccccc2 Amb1956230 [0,0,0,0,0,2|2,0,0]=4 662 B21R2.27923 O=C(NNC(=O)c1ccccc1)COc2ccccc2 Amb2550955 [0,0,0,0,0,2|2,0,0]=4 663 B21R2.27923 O=C(NNC(=O)c1ccccc1)\C=C\c2ccccc2 Amb1548774 [0,0,0,0,0,2|2,0,0]=4 664 B21R2.27923 O=C(NOC(=O)c1ccccc1)OCc2ccccc2 Amb22057374 [0,0,0,0,0,2|1,0,0]=3 665 B21R2.27923 O=C(OCC(=O)C=Cc1ccccc1)c2ccccc2 Amb24080008 [0,0,0,0,0,2|1,0,0]=3 666 B21R2.27923 O=C(OCC(=O)c1ccccc1)CCc2ccccc2 Amb1636213 [0,0,0,0,0,2|1,0,0]=3 667 B21R2.13150 O=C(CSSCC(=O)c1ccccc1)c2ccccc2 Amb22347718 [0,0,0,0,0,2|0,2,0]=4 668 B21R2.13150 O=C(SCCSC(=O)c1ccccc1)c2ccccc2 Amb22456123 [0,0,0,0,0,2|0,2,0]=4 669 B21R2.13150 O=C(c1ccccc1)CN\C=C/C(=O)c2ccccc2 Amb2439794 [0,0,0,0,0,2|2,0,0]=4 670 B21R2.13150 O=C(c1ccccc1)NCCSC(=O)c2ccccc2 Amb10555299 [0,0,0,0,0,2|1,1,0]=4 671 B21R2.13150 O=C(c1ccccc1)N\C=C/NC(=O)c2ccccc2 Amb2386685 [0,0,0,0,0,2|2,0,0]=4 672 B21R2.13150 O=C(c1cccnc1)NCCOC(=O)c2ccccc2 Amb1561498 [0,0,0,0,0,2|2,0,0]=4