0 B15R1.793 CCOC(=O)/C=C/C1=CC=C(C=C1)OC Z53833826 [0,0,0,0,0,0|0,0,0]=0 1 B15R1.793 CCOC(=O)COC1=CC=C(C=C1)C#N Z53839001 [0,0,0,0,0,0|3,0,1]=4 2 B15R1.793 CCOC(=O)COC1=CC=C(C=C1)C=O Z54883375 [0,0,0,0,0,0|3,0,1]=4 3 B15R1.793 CONC(=O)NCC1=CC=C(C=C1)OC Z231079500 [0,0,0,0,0,0|3,0,1]=4 4 B14R1.5 CCC1=CC=C(C=C1)CCC(=O)OC Z66570476 [1,0,0,0,0,0|1,0,2]=4 5 B14R1.5 CNC(=O)CSC1=CC=C(C=C1)OC Z51311503 [1,0,0,0,0,0|2,0,1]=4 6 B14R1.5 CNC1=CC=C(C=C1)CCC(=O)OC Z1262580135 [1,0,0,0,0,0|1,0,2]=4 7 B14R1.5 CNC1=CC=C(C=C1)OCC(=O)OC Z1650039499 [1,0,0,0,0,0|2,0,1]=4 8 B14R1.5 COC(=O)/C=C/C1=CC=C(C=C1)C=O Z1198151451 [1,0,0,0,0,0|2,0,0]=3 9 B14R1.5 COC1=CC=C(C=C1)CNC(=O)CCl Z56896262 [1,0,0,0,0,0|2,0,1]=4 10 B14R1.5 COC1=CC=C(C=C1)CNC(=O)CN Z1259341036 [1,0,0,0,0,0|2,0,1]=4 11 B14R1.502 CCNC(=O)CCC1=CC=C(C=C1)O Z1634469457 [1,0,0,0,0,0|1,0,2]=4 12 B14R1.502 CCNC(=O)NCC1=CC=C(C=C1)C Z44616623 [1,0,0,0,0,0|2,0,1]=4 13 B14R1.502 CCOC(=O)/C=C/C1=CC=C(C=C1)C Z54083206 [1,0,0,0,0,0|0,0,0]=1 14 B14R1.502 CCOC(=O)/C=C/C1=CC=C(C=C1)N Z56770907 [1,0,0,0,0,0|1,0,0]=2 15 B14R1.502 CCOC(=O)/C=C/C1=NC=C(C=C1)Br Z1725938497 [1,0,0,0,0,0|2,0,0]=3 16 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)N Z1250132306 [1,0,0,0,0,0|1,0,2]=4 17 B14R1.502 CCOC(=O)CNC1=CC=C(C=C1)F Z56968885 [1,0,0,0,0,0|2,0,1]=4 18 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)N Z239127424 [1,0,0,0,0,0|2,0,1]=4 19 B14R1.502 CCOC(=O)COC1=CC=C(C=C1)O Z1200224157 [1,0,0,0,0,0|1,0,1]=3 20 B16R1.202 COC1=CC=C(C=C1)/C=C/C(=O)NC(=S)N Z85924861 [0,1,0,0,0,0|2,0,1]=4 21 B16R1.202 COC1=CC=C(C=C1)CCC(=O)NC(C)C Z31384778 [0,1,0,0,0,0|1,0,2]=4 22 B16R1.202 COC1=CC=C(C=C1)SCC(=O)NC(C)C Z51311484 [0,1,0,0,0,0|2,0,1]=4 23 B16R1.925 CCOC(=O)/C=C/C1=CC=C(C=C1)N(C)C Z292279092 [0,1,0,0,0,0|1,0,0]=2 24 B16R1.925 CCOC(=O)COC1=CC=C(C=C1)C(=O)C Z54066002 [0,1,0,0,0,0|2,0,1]=4 25 B16R1.1480 CCONC(=O)CCC1=CC=C(C=C1)CC Z281500368 [0,1,0,0,0,0|1,0,2]=4 26 B16R1.1480 CCONC(=O)CSC1=CC=C(C=C1)OC Z235356308 [0,1,0,0,0,0|1,0,1]=3 27 B16R1.1480 COC1=CC=C(C=C1)/C=C/C(=O)OCC#N Z19784223 [0,1,0,0,0,0|0,0,1]=2 28 B16R1.4218 CCOC(=O)CC(=O)C1=CC=C(C=C1)OC Z362636642 [0,1,0,0,0,0|0,0,1]=2 29 B16R1.4218 CCOC(=O)CC(C)C1=CC=C(C=C1)OC Z1352286712 [0,1,0,0,0,0|0,0,2]=3 30 B16R1.4958 CC/C=C(\C)/C(=O)NC1=CC=C(C=C1)OC Z376766532 [0,1,0,0,0,0|3,0,0]=4 31 B16R1.4958 CCNC(=O)C(=O)NC1=CC=C(C=C1)SC Z436218444 [0,1,0,0,0,0|2,1,0]=4 32 B16R1.7115 CCOC(=O)COC1=CC=C(C=C1)CCN Z1269638504 [0,1,0,0,0,0|2,0,1]=4 33 B16R1.15082 CCNC(=O)NCC1=CC(=C(C=C1)OC)C Z1011733590 [0,1,0,0,0,0|2,0,1]=4 34 B14R1.954 CCCC(=O)NC1=CN=C(C=C1)OC Z26413953 [0,0,0,0,1,0|3,0,0]=4 35 B14R1.954 CCOC(=O)CC1=CC=C(C=C1)CN Z3234813519 [0,0,0,0,1,0|2,0,1]=4 36 B14R1.954 CNCC(=O)NC1=CC=C(C=C1)OC Z46191142 [0,0,0,0,1,0|3,0,0]=4 37 B14R1.954 COC1=CC=C(C=C1)NC(=O)CCCl Z240089952 [0,0,0,0,1,0|3,0,0]=4 38 B14R1.954 CONC(=O)CC1=CC=C(C=C1)OC Z245507048 [0,0,0,0,1,0|2,0,1]=4 39 B16R1.1543 CCOC(=O)COCC1=CC=C(C=C1)OC Z361894086 [0,0,0,0,0,1|0,0,2]=3 40 B16R1.1543 CCOC(=O)N/N=C/C1=CC=C(C=C1)C#N Z49623158 [0,0,0,0,0,1|3,0,0]=4 41 B16R1.1543 CCOC(=O)N/N=C/C1=CC=C(C=C1)CC Z49623184 [0,0,0,0,0,1|2,0,0]=3 42 B13R1.3 CCC1=CC=C(C=C1)/C=C/C(=O)O Z2942851866 [2,0,0,0,0,0|1,0,0]=3 43 B13R1.3 COC1=CC=C(C=C1)/C=C/C(=O)O Z56931888 [2,0,0,0,0,0|0,0,0]=2 44 B13R1.3 COC1=CC=C(C=C1)/C=C/[N+](=O)[O-] Z56755542 [2,0,0,0,0,0|1,0,1]=4 45 B13R1.3 COC1=CC=C(C=C1)C#CC(=O)O Z57100824 [2,0,0,0,0,0|0,0,2]=4 46 B13R1.3 COC1=CC=C(C=C1)CCC(=O)O Z104486868 [2,0,0,0,0,0|0,0,2]=4 47 B13R1.3 COC1=CC=C(C=C1)OCC(=O)O Z57229609 [2,0,0,0,0,0|1,0,1]=4 48 B13R1.3 COC1=CC=C(C=C1)SCC(=O)O Z56770877 [2,0,0,0,0,0|1,0,1]=4 49 B13R1.3 COC1=CN=C(C=C1)/C=C/C(=O)O Z1815157394 [2,0,0,0,0,0|1,0,0]=3 50 B13R1.3 COC1=NC=C(C=N1)/C=C/C(=O)O Z2887852697 [2,0,0,0,0,0|2,0,0]=4 51 B13R1.3 CSC1=CC=C(C=C1)/C=C/C(=O)O Z2895087258 [2,0,0,0,0,0|0,1,0]=3 52 B13R1.3 N#CC1=CC=C(C=C1)/C=C/C(=O)O Z2942851604 [2,0,0,0,0,0|2,0,0]=4 53 B13R1.3 O=CC1=CC=C(C=C1)/C=C/C(=O)O Z1255434745 [2,0,0,0,0,0|2,0,0]=4 54 B13R1.14 CNC(=O)/C=C/C1=CC=C(C=C1)C Z32016902 [2,0,0,0,0,0|1,0,0]=3 55 B13R1.14 CNC(=O)/C=C/C1=CC=C(C=C1)F Z32016729 [2,0,0,0,0,0|2,0,0]=4 56 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)Br Z18161847 [2,0,0,0,0,0|1,0,0]=3 57 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)F Z18711475 [2,0,0,0,0,0|1,0,0]=3 58 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)O Z24946550 [2,0,0,0,0,0|0,0,0]=2 59 B13R1.14 COC(=O)/C=C/C1=CN=C(C=C1)Cl Z2587766456 [2,0,0,0,0,0|2,0,0]=4 60 B13R1.14 COC(=O)/C=C/C1=CN=C(C=C1)F Z2949503064 [2,0,0,0,0,0|2,0,0]=4 61 B13R1.14 COC(=O)/C=C/C1=CN=C(C=C1)O Z2799082212 [2,0,0,0,0,0|1,0,0]=3 62 B13R1.14 COC(=O)CCC1=CC=C(C=C1)O Z796576156 [2,0,0,0,0,0|0,0,2]=4 63 B13R1.14 COC(=O)COC1=CC=C(C=C1)O Z1190318463 [2,0,0,0,0,0|1,0,1]=4 64 B13R1.42 CCOC(=O)/C=C/C1=CC=CC=C1 Z53834692 [2,0,0,0,0,0|0,0,0]=2 65 B13R1.42 CCOC(=O)NCC1=CC=CC=C1 Z31478129 [2,0,0,0,0,0|1,0,1]=4 66 B15R1.3 COC(=O)C(C)NC1=CC=C(C=C1)OC Z727801992 [1,1,0,0,0,0|1,0,1]=4 67 B15R1.18 CCOC1=CC=C(C=C1)/C=C/C(=O)NC Z30271977 [1,1,0,0,0,0|1,0,0]=3 68 B15R1.205 COC1=CC=C(C=C1)CNC(=O)C(C)Cl Z56914794 [1,1,0,0,0,0|1,0,1]=4 69 B15R1.211 COC(=O)CC(N)C1=CC=C(C=C1)OC Z839028512 [1,1,0,0,0,0|0,0,2]=4 70 B15R1.211 COC1=CC=C(C=C1)C(=O)NC(=O)CCl Z56907596 [1,1,0,0,0,0|2,0,0]=4 71 B15R1.956 CNC(=O)/C=C/C1=CC=C(C=C1)N(C)C Z30271860 [1,1,0,0,0,0|2,0,0]=4 72 B15R1.956 COC(=O)/C=C/C1=CC=C(C=C1)C(=O)O Z1508917480 [1,1,0,0,0,0|2,0,0]=4 73 B15R1.956 COC(=O)/C=C/C1=CC=C(C=C1)[N+](=O)[O-] Z19781094 [1,1,0,0,0,0|2,0,0]=4 74 B15R1.1856 COC(=O)CCC1=C(C=C(C=C1)OC)C Z1681334396 [1,1,0,0,0,0|0,0,2]=4 75 B15R1.3779 CNC(=O)/C=C/C1=CC(=C(C=C1)OC)F Z100643592 [1,1,0,0,0,0|1,0,0]=3 76 B15R1.3779 COC(=O)CCC1=CC(=C(C=C1)OC)F Z210408074 [1,1,0,0,0,0|0,0,2]=4 77 B15R1.23 CCNC(=O)/C=C(\C)/C1=CC=C(C=C1)F Z898690008 [1,1,0,0,0,0|2,0,0]=4 78 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(C=C1)Cl Z362636724 [1,1,0,0,0,0|1,0,1]=4 79 B15R1.23 CCOC(=O)NC(=O)C1=CC=C(C=C1)Cl Z107776088 [1,1,0,0,0,0|2,0,0]=4 80 B15R1.48 CCOC(=O)/C(=C/C1=CC=C(C=C1)C)/C Z1612223667 [1,1,0,0,0,0|0,0,0]=2 81 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(C=C1)C Z56755838 [1,1,0,0,0,0|1,0,0]=3 82 B15R1.48 CCOC(=O)C(C)CC1=CC=C(C=C1)C Z1612330704 [1,1,0,0,0,0|0,0,2]=4 83 B15R1.48 CCOC(=O)C(N)CC1=CC=C(C=C1)C Z1966570879 [1,1,0,0,0,0|0,0,2]=4 84 B15R1.139 CCCNC(=O)/C=C/C1=CC=C(C=C1)F Z33030769 [1,1,0,0,0,0|2,0,0]=4 85 B15R1.10390 CCNC(=O)/C=C/C1=CC(=C(C=C1)Cl)Cl Z30280069 [1,1,0,0,0,0|2,0,0]=4 86 B15R1.5929 CCONC(=O)CC1=CC=C(C=C1)OC Z245505822 [1,1,0,0,0,0|1,0,1]=4 87 B15R1.204 COC1=CC=C(C=C1)NC(=O)NC(C)C Z104571532 [0,1,0,0,1,0|2,0,0]=4 88 B15R1.1262 CCOC(=O)CC1=CC=C(C=C1)C(=O)C Z382689030 [0,1,0,0,1,0|1,0,1]=4 89 B15R1.3943 CCOC(=O)C(=O)C1=CC=C(C=C1)OC Z99601256 [0,1,0,0,1,0|0,0,0]=2 90 B15R1.5643 CCOC(=O)CC1=NC=C(C=C1)OCC Z1813122771 [0,1,0,0,1,0|1,0,1]=4 91 B17R1.1646 CCOC(=O)N/N=C/C1=CC=C(C=C1)C(C)C Z49623116 [0,1,0,0,0,1|2,0,0]=4 92 B17R1.1646 CCOC(=O)N/N=C/C1=CC=C(C=C1)N(C)C Z49622938 [0,1,0,0,0,1|2,0,0]=4 93 B17R1.5039 CCOC(=O)/C(=N/NC1=CC=C(C=C1)OC)/Cl Z57468014 [0,1,0,0,0,1|1,0,0]=3 94 B17R1.21815 CCOC(=O)/C=C(\C)/NC1=CC=C(C=C1)OC Z56799690 [0,1,0,0,0,1|0,0,0]=2 95 B17R1.208 COC1=CC=C(C=C1)C(N)CC(=O)OC(C)C Z147652250 [0,2,0,0,0,0|0,0,2]=4 96 B17R1.232 CC(C)(C)OC(=O)/C=C/C1=CC=C(C=C1)C=O Z2312551825 [0,2,0,0,0,0|2,0,0]=4 97 B17R1.962 CCNC(=O)/C=C/C1=CC=C(C=C1)C(=O)OC Z30280094 [0,2,0,0,0,0|1,0,0]=3 98 B17R1.192 CSC1=CC=C(C=C1)/C=C/C(=O)OCC(=O)N Z23319979 [0,2,0,0,0,0|0,1,1]=4 99 B17R1.17243 CCONC(=O)C(C)OC1=CC=C(C=C1)OC Z281503108 [0,2,0,0,0,0|1,0,1]=4 100 B17R1.8620 CCOC(=O)CC(=O)C1=CC=C(C=C1)OCC Z362636646 [0,2,0,0,0,0|0,0,1]=3 101 B17R1.17858 CCOC(=O)C(N)C(O)C1=CC=C(C=C1)OC Z3766830155 [0,2,0,0,0,0|0,0,2]=4 102 B17R1.21738 CCOC(=O)NS(=O)(=O)C1=CC=C(C=C1)OC Z56762479 [0,2,0,0,0,0|2,0,0]=4 103 B17R1.30621 CCOC(=O)CN(C#N)C1=CC=C(C=C1)OC Z1955192688 [0,2,0,0,0,0|1,0,1]=4 104 B17R1.5699 CCOC(=O)/C(=C/C1=CC(=C(C=C1)OC)F)/C Z1649734231 [0,2,0,0,0,0|0,0,0]=2 105 B17R1.19266 CCOC(=O)/C(=C\C1=CC=C(C=C1)C#N)/C#N Z44297673 [0,2,0,0,0,0|2,0,0]=4 106 B17R1.19266 CCOC(=O)/C(=C\C1=CC=C(C=C1)OC)/C#N Z44297626 [0,2,0,0,0,0|0,0,0]=2 107 B17R1.965 CCOC(=O)/C=C/C1=CC=C(C=C1)NC(=O)C Z167625536 [0,2,0,0,0,0|1,0,0]=3 108 B15R2.2 COC1=CC=C(C=C1)C2=CC(=O)OC2 Z2181914481 [1,0,0,1,0,0|0,0,0]=2 109 B15R2.2 COC1=CC=C(C=C1)C2=NOC(=C2)N Z335439016 [1,0,0,1,0,0|2,0,0]=4 110 B15R2.2 COC1=CC=C(C=C1)C2=NOC(=O)N2 Z685594076 [1,0,0,1,0,0|2,0,0]=4 111 B15R2.4776 COC1=CC2=C(C=C1)C=CC(=C2)OC Z54603315 [1,0,0,1,0,0|1,0,0]=3 112 B15R2.4776 COC1=CC2=C(C=CC(=C2)CO)C=C1 Z1255505933 [1,0,0,1,0,0|2,0,0]=4 113 B15R2.1510 CC1=CC=C(C=C1)SC2CCOC2=O Z2735956406 [1,0,0,1,0,0|1,0,1]=4 114 B15R2.4846 COC1=CC2=C(C=CC=C2CN)C=C1 Z2466490222 [1,0,0,1,0,0|2,0,0]=4 115 B15R2.21314 COC1=CC2=C(C=C1)NC(=O)CCC2 Z1198154505 [0,0,0,1,1,0|2,0,0]=4 116 B17R2.5764 CCNC1=NC(=CS1)C2=CC=C(C=C2)OC Z48854562 [0,0,0,1,0,1|2,0,0]=4 117 B17R2.49365 CCOC(=O)C1CC1C2=CC=C(C=C2)OC Z1010778970 [0,0,0,1,0,1|0,0,2]=4 118 B17R2.49948 CCNC(=O)C1=CC2=C(N1)C=C(C=C2)CC Z199580886 [0,1,0,1,0,0|2,0,0]=4 119 B17R2.49948 CCNC(=O)C1=CC2=C(N1)C=C(C=C2)OC Z402618892 [0,1,0,1,0,0|1,0,0]=3 120 B17R2.49948 CCOC(=O)C1=CC2=C(N1)C=C(C=C2)OC Z293535818 [0,1,0,1,0,0|0,0,0]=2 121 B17R2.49948 CCOC(=O)C1=CC2=C(N1)C=NC(=C2)OC Z2044765346 [0,1,0,1,0,0|2,0,0]=4 122 B17R2.9648 CCOC(=O)/C=C/C1=CC2=C(C=C1)OC=N2 Z4662233627 [0,1,0,1,0,0|0,0,1]=3 123 B17R2.9648 CCOC(=O)/C=C/C1=CC2=C(C=C1)OCO2 Z53837255 [0,1,0,1,0,0|0,0,0]=2 124 B17R2.9648 CCOC(=O)NCC1=CC2=C(C=C1)OCO2 Z31427929 [0,1,0,1,0,0|1,0,1]=4 125 B17R2.9648 CONC(=O)/C=C/C1=CC2=C(C=C1)OCO2 Z247486232 [0,1,0,1,0,0|2,0,0]=4 126 B13R1.5 CCC(=O)NC1=CC=C(C=C1)CC Z30917878 [1,0,0,0,1,0|2,0,0]=4 127 B13R1.5 CCC(=O)NC1=CC=C(C=C1)SC Z110120998 [1,0,0,0,1,0|1,1,0]=4 128 B13R1.5 CCC(=O)NC1=CN=C(C=C1)OC Z26413976 [1,0,0,0,1,0|2,0,0]=4 129 B13R1.5 CNC(=O)NC1=CC=C(C=C1)OC Z104757974 [1,0,0,0,1,0|2,0,0]=4 130 B13R1.5 COC1=CC=C(C=C1)NC(=O)CCl Z56862381 [1,0,0,0,1,0|2,0,0]=4 131 B13R1.5 COC1=CC=C(C=C1)NC(=O)CN Z46280202 [1,0,0,0,1,0|2,0,0]=4 132 B13R1.19 CCNC(=O)NC1=CC=C(C=C1)C Z44589983 [1,0,0,0,1,0|2,0,0]=4 133 B13R1.19 CCOC(=O)CC1=CC=C(C=C1)F Z53835949 [1,0,0,0,1,0|1,0,1]=4 134 B13R1.19 CCOC(=O)NC1=CC=C(C=C1)Br Z31510257 [1,0,0,0,1,0|2,0,0]=4 135 B13R1.19 CCOC(=O)NC1=CC=C(C=C1)I Z32028321 [1,0,0,0,1,0|2,0,0]=4 136 B13R1.19 CCOC(=O)NC1=CC=C(C=C1)N Z283822580 [1,0,0,0,1,0|2,0,0]=4 137 B13R1.19 CCOC(=O)NC1=CC=C(C=C1)O Z64464377 [1,0,0,0,1,0|1,0,0]=3 138 B13R1.452 CCCC(=O)C1=CC=C(C=C1)OC Z385418282 [0,0,0,0,2,0|1,0,0]=3 139 B13R1.452 CCNC(=O)C1=CC=C(C=C1)OC Z32024428 [0,0,0,0,2,0|1,0,0]=3 140 B13R1.452 CCOC(=O)C1=CC=C(C=C1)CN Z56788169 [0,0,0,0,2,0|2,0,0]=4 141 B13R1.452 CCOC(=O)C1=CC=C(C=C1)SC Z292454850 [0,0,0,0,2,0|0,1,0]=3 142 B13R1.452 CONC(=O)C1=CC=C(C=C1)OC Z240605130 [0,0,0,0,2,0|2,0,0]=4 143 B15R1.11 CCOC(=O)CNCC1=CC=C(C=C1)C Z1259340982 [1,0,0,0,0,1|0,0,2]=4 144 B15R1.10389 CCOC(=O)/C=C/C1=CC(=CC=C1)OC Z53836629 [0,0,0,0,1,1|0,0,0]=2 145 B15R1.10389 CCOC(=O)CNC1=CC(=CC=C1)OC Z203055174 [0,0,0,0,1,1|1,0,1]=4