0 B17R2.193 Cc1cc(ccc1Br)OCc2ccccc2 TS33904 [0,0,0,0,0,0|4,0,0]=4 1 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 TS53892 [1,0,0,0,0,0|3,0,0]=4 2 B16R2.132 c1ccc(cc1)C=Cc2ccc(cc2)O TS53690 [1,0,0,0,0,0|1,0,2]=4 3 B16R2.132 c1ccc(cc1)C=Nc2ccc(cc2)O TS53864 [1,0,0,0,0,0|2,0,1]=4 4 B16R2.132 c1ccc(cc1)COc2ccc(cc2)Br TS03015 [1,0,0,0,0,0|3,0,0]=4 5 B16R2.132 c1ccc(cc1)COc2ccc(cc2)Cl TS22517 [1,0,0,0,0,0|3,0,0]=4 6 B16R2.132 c1ccc(cc1)COc2ccc(cc2)F TS19391 [1,0,0,0,0,0|3,0,0]=4 7 B16R2.132 c1ccc(cc1)COc2ccc(cc2)I TS60378 [1,0,0,0,0,0|3,0,0]=4 8 B16R2.132 c1ccc(cc1)COc2ccc(cc2)N TS03014 [1,0,0,0,0,0|3,0,0]=4 9 B16R2.132 c1ccc(cc1)COc2ccc(cc2)N TS16894 [1,0,0,0,0,0|3,0,0]=4 10 B16R2.132 c1ccc(cc1)COc2ccc(cc2)O TS03018 [1,0,0,0,0,0|2,0,0]=3 11 B16R2.132 c1ccc(cc1)COc2ccc(cn2)Br TS29990 [1,0,0,0,0,0|3,0,0]=4 12 B16R2.132 c1ccc(cc1)CSc2ccc(cc2)Br TS34093 [1,0,0,0,0,0|3,0,0]=4 13 B16R2.132 c1ccc(cc1)N=Nc2ccc(cc2)O TS18633 [1,0,0,0,0,0|3,0,0]=4 14 B16R2.132 c1ccc(cc1)SCc2ccc(cc2)F TS49468 [1,0,0,0,0,0|3,0,0]=4 15 B16R2.132 c1ccc(cc1)SCc2ccc(cc2)N TS21903 [1,0,0,0,0,0|3,0,0]=4 16 B16R2.252 Cc1cccc(c1)NCc2ccccc2 TS53883 [1,0,0,0,0,0|3,0,0]=4 17 B16R2.252 Cc1ccnc(c1)NCc2ccccc2 TS54053 [1,0,0,0,0,0|3,0,0]=4 18 B16R2.252 c1ccc(cc1)CCc2cccc(c2)O TS70703 [1,0,0,0,0,0|1,0,1]=3 19 B16R2.252 c1ccc(cc1)COc2cc[nH]c(=O)c2 TS03011 [1,0,0,0,0,0|3,0,0]=4 20 B16R2.252 c1ccc(cc1)COc2cccc(c2)Br TS65886 [1,0,0,0,0,0|3,0,0]=4 21 B16R2.252 c1ccc(cc1)COc2cccc(c2)F TS19387 [1,0,0,0,0,0|3,0,0]=4 22 B16R2.252 c1ccc(cc1)COc2cccc(c2)I TS76385 [1,0,0,0,0,0|3,0,0]=4 23 B16R2.252 c1ccc(cc1)COc2cccc(c2)N TS18842 [1,0,0,0,0,0|3,0,0]=4 24 B16R2.252 c1ccc(cc1)COc2cccc(c2)O TS65887 [1,0,0,0,0,0|2,0,1]=4 25 B16R2.252 c1ccc(cc1)OCc2cccc(c2)Br TS29888 [1,0,0,0,0,0|3,0,0]=4 26 B18R2.2686 c1ccc(cc1)N=Nc2ccc(c(c2)C=O)O TS52324 [0,1,0,0,0,0|3,0,0]=4 27 B18R2.6533 c1ccc(cc1)COc2cc(c(cc2Cl)O)Cl TS73843 [0,1,0,0,0,0|3,0,0]=4 28 B15R2.2195 c1ccc(cc1)CCc2ccccc2 TS15019 [2,0,0,0,0,0|1,0,0]=3 29 B15R2.2195 c1ccc(cc1)CNc2ccccc2 TS01616 [2,0,0,0,0,0|2,0,0]=4 30 B15R2.2195 c1ccc(cc1)CNc2ccccn2 TS55056 [2,0,0,0,0,0|2,0,0]=4 31 B15R2.2195 c1ccc(cc1)CNc2ccccn2 TS67971 [2,0,0,0,0,0|2,0,0]=4 32 B15R2.2195 c1ccc(cc1)COc2ccccc2 TS48575 [2,0,0,0,0,0|2,0,0]=4 33 B15R2.2195 c1ccc(cc1)CSc2ccccc2 TS19062 [2,0,0,0,0,0|2,0,0]=4 34 B15R2.2195 c1ccc(cc1)NCc2ccccn2 TS08604 [2,0,0,0,0,0|2,0,0]=4 35 B15R2.2195 c1ccc(cc1)NCc2ccccn2 TS49886 [2,0,0,0,0,0|2,0,0]=4 36 B17R2.48 COc1ccc(cc1)CNc2ccccc2 TS16316 [1,1,0,0,0,0|2,0,0]=4 37 B17R2.48 COc1ccc(cc1)NCc2ccccc2 TS21524 [1,1,0,0,0,0|2,0,0]=4 38 B17R2.48 COc1ccc(cc1)OCc2ccccc2 TS21693 [1,1,0,0,0,0|2,0,0]=4 39 B17R2.48 c1ccc(cc1)COc2ccc(cc2)CO TS21696 [1,1,0,0,0,0|2,0,0]=4 40 B17R2.192 c1ccc(cc1)CC(=O)c2ccc(cc2)O TS01377 [1,1,0,0,0,0|1,0,1]=4 41 B17R2.207 Cc1ccc(cc1)CCc2ccc(cc2)C TS20985 [1,1,0,0,0,0|2,0,0]=4 42 B17R2.207 c1cc(ccc1CCc2ccc(cc2)F)F TS22395 [1,1,0,0,0,0|2,0,0]=4 43 B17R2.207 c1cc(ccc1CCc2ccc(cc2)N)N TS09564 [1,1,0,0,0,0|2,0,0]=4 44 B17R2.209 Cc1ccc(cc1)CC(c2ccccc2)N TS21173 [1,1,0,0,0,0|2,0,0]=4 45 B17R2.1819 c1ccc(cc1)COc2cccc(c2)C=O TS21319 [1,1,0,0,0,0|2,0,0]=4 46 B17R2.3212 c1ccc(cc1)CCc2cc(cc(=O)o2)O TS22040 [1,1,0,0,0,0|0,0,1]=3 47 B17R2.3212 c1ccc(cc1)CCc2cc(cc(c2)O)O TS21699 [1,1,0,0,0,0|1,0,1]=4 48 B17R2.5355 c1ccc(cc1)Cc2ccc(c(c2O)O)O TS22045 [0,1,0,0,1,0|1,0,1]=4 49 B19R2.2863 COc1cc(ccc1O)CNCc2ccccc2 TS57882 [0,1,0,0,0,1|1,0,1]=4 50 B19R2.28208 COc1ccc(cc1O)CNCc2ccccc2 TS57879 [0,1,0,0,0,1|1,0,1]=4 51 B15R2.29 c1ccc(cc1)Cc2ccc(cc2)Br TS27576 [1,0,0,0,1,0|2,0,0]=4 52 B15R2.29 c1ccc(cc1)Cc2ccc(cc2)Cl TS19489 [1,0,0,0,1,0|2,0,0]=4 53 B15R2.29 c1ccc(cc1)Cc2ccc(cc2)F TS48905 [1,0,0,0,1,0|2,0,0]=4 54 B15R2.29 c1ccc(cc1)Cc2ccc(cc2)N TS48455 [1,0,0,0,1,0|2,0,0]=4 55 B15R2.29 c1ccc(cc1)Cc2ccc(cc2)O TS48572 [1,0,0,0,1,0|1,0,0]=3 56 B15R2.29 c1ccc(cc1)Nc2ccc(cc2)O TS22844 [1,0,0,0,1,0|2,0,0]=4 57 B15R2.29 c1ccc(cc1)Oc2ccc(cc2)O TS48882 [1,0,0,0,1,0|2,0,0]=4 58 B15R2.31 c1ccc(cc1)Cc2cccc(c2)N TS48456 [1,0,0,0,1,0|2,0,0]=4 59 B15R2.31 c1ccc(cc1)Cc2cccc(c2)O TS65889 [1,0,0,0,1,0|1,0,1]=4 60 B15R2.94 c1ccc(cc1)c2ccc(c(c2)Cl)O TS19875 [0,0,0,0,2,0|2,0,0]=4 61 B15R2.94 c1ccc(cc1)c2ccc(c(c2)I)O TS58613 [0,0,0,0,2,0|2,0,0]=4 62 B15R2.94 c1ccc(cc1)c2ccc(c(c2)N)O TS15465 [0,0,0,0,2,0|2,0,0]=4 63 B15R2.94 c1ccc(cc1)c2ccc(c(c2)O)O TS48875 [0,0,0,0,2,0|1,0,1]=4 64 B17R2.216 Cc1ccc(cc1)CNCc2ccccc2 TS21172 [1,0,0,0,0,1|2,0,0]=4 65 B17R2.216 c1ccc(cc1)C=CCc2ccc(cc2)O TS43832 [1,0,0,0,0,1|1,0,1]=4 66 B17R2.216 c1ccc(cc1)CNCc2ccc(cc2)Cl TS25138 [1,0,0,0,0,1|2,0,0]=4 67 B17R2.216 c1ccc(cc1)CNCc2ccc(cc2)F TS44698 [1,0,0,0,0,1|2,0,0]=4 68 B17R2.5301 c1ccc(cc1)CNCc2cccc(c2)Br TS33782 [1,0,0,0,0,1|2,0,0]=4 69 B17R2.5301 c1ccc(cc1)CNCc2cccc(c2)Cl TS25137 [1,0,0,0,0,1|2,0,0]=4 70 B17R2.5301 c1ccc(cc1)CNCc2cccc(c2)F TS44699 [1,0,0,0,0,1|2,0,0]=4