0 B11R1.267 CCc1cccc(c1O)CC LS11742 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.267 COc1cccc(c1F)C#N LS10265 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.267 COc1cccc(c1F)C=O LS10125 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.2 COc1cccc(c1Cl)N LS10071 [1,0,0,0,0,0|2,0,0]=3 4 B10R1.2 COc1cccc(c1F)Br LS10315 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.2 Cc1c(cccc1Cl)OC LS11764 [1,0,0,0,0,0|2,0,0]=3 6 B10R1.2 Cc1c(cccc1OC)N LS11795 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.2 Cc1c(cccc1OC)N LS11803 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.2 Cc1cccc(c1Cl)C#N LS10020 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.2 Cc1cccc(c1F)C#N LS10264 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.2 Cc1cccc(c1F)C=O LS10502 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.2 c1cc(c(c(c1)Cl)O)C=O LS10135 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.2 c1cc(c(c(c1)F)O)C=O LS10305 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.2 c1cc(c(c(c1)O)O)C=O LS10648 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.172 CCc1cccc(c1)C=O LS10374 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.172 CCc1cccc(n1)CC LS21232 [1,0,0,0,0,0|3,0,0]=4 16 B12R1.440 B(c1cccc(c1F)OC)(O)O LS10979 [0,1,0,0,0,0|3,0,0]=4 17 B12R1.440 COc1cccc(c1N)C(=O)O LS00056 [0,1,0,0,0,0|3,0,0]=4 18 B12R2.315 COc1cccc2c1cc[nH]2 LS21192 [0,0,0,1,0,0|2,0,1]=4 19 B9R1.2 CNc1cccc(c1)Cl LS10187 [2,0,0,0,0,0|2,0,0]=4 20 B9R1.2 COc1cc(ccn1)Br LS21151 [2,0,0,0,0,0|2,0,0]=4 21 B9R1.2 COc1cc(ccn1)Cl LS20320 [2,0,0,0,0,0|2,0,0]=4 22 B9R1.2 COc1cc(ccn1)N LS20329 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.2 COc1cccc(n1)Cl LS20709 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.2 COc1cccc(n1)N LS20232 [2,0,0,0,0,0|2,0,0]=4 25 B9R1.2 Cc1cccc(c1)C=O LS11853 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.2 Cc1cccc(c1)CBr LS11263 [2,0,0,0,0,0|2,0,0]=4 27 B9R1.2 Cc1cccc(c1)CCl LS11215 [2,0,0,0,0,0|2,0,0]=4 28 B9R1.2 Cc1cccc(c1)CN LS11219 [2,0,0,0,0,0|2,0,0]=4 29 B9R1.2 c1cc(cc(c1)O)C=O LS10593 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.3 Cc1c(cccc1F)O LS11582 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.3 Cc1c(cccc1O)N LS11805 [2,0,0,0,0,0|2,0,0]=4 32 B9R1.3 Cc1c(cccc1O)O LS10121 [2,0,0,0,0,0|1,0,0]=3 33 B9R1.3 Cc1cccc(c1C)Br LS11762 [2,0,0,0,0,0|2,0,0]=4 34 B9R1.3 Cc1cccc(c1F)O LS10317 [2,0,0,0,0,0|1,0,0]=3 35 B9R1.3 Cc1cccc(c1I)F LS10535 [2,0,0,0,0,0|2,0,0]=4 36 B9R1.3 Cc1cccc(c1N)Cl LS10715 [2,0,0,0,0,0|2,0,0]=4 37 B9R1.3 Cc1cccc(c1N)F LS10282 [2,0,0,0,0,0|2,0,0]=4 38 B9R1.3 Cc1cccc(c1O)Cl LS10669 [2,0,0,0,0,0|1,0,0]=3 39 B9R1.3 c1cc(c(c(c1)Br)Cl)O LS10087 [2,0,0,0,0,0|2,0,0]=4 40 B9R1.3 c1cc(c(c(c1)Br)O)Br LS11453 [2,0,0,0,0,0|2,0,0]=4 41 B9R1.3 c1cc(c(c(c1)Cl)Cl)O LS11389 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.3 c1cc(c(c(c1)Cl)F)O LS10395 [2,0,0,0,0,0|2,0,0]=4 43 B9R1.3 c1cc(c(c(c1)Cl)O)Cl LS10077 [2,0,0,0,0,0|2,0,0]=4 44 B9R1.3 c1cc(c(c(c1)Cl)O)F LS10396 [2,0,0,0,0,0|2,0,0]=4 45 B9R1.3 c1cc(c(c(c1)F)Cl)O LS10193 [2,0,0,0,0,0|2,0,0]=4 46 B9R1.3 c1cc(c(c(c1)F)O)F LS11403 [2,0,0,0,0,0|2,0,0]=4 47 B9R1.3 c1cc(c(c(c1)F)O)O LS10021 [2,0,0,0,0,0|1,0,0]=3 48 B9R1.3 c1cc(c(c(c1)I)O)O LS10698 [2,0,0,0,0,0|1,0,0]=3 49 B9R1.3 c1cc(c(c(c1)O)F)O LS10311 [2,0,0,0,0,0|1,0,0]=3 50 B9R1.3 c1cc(c(c(c1)O)N)O LS11761 [2,0,0,0,0,0|1,0,0]=3 51 B9R1.3 c1cc(c(c(c1)O)N)O LS11782 [2,0,0,0,0,0|1,0,0]=3 52 B9R1.15 CNc1ccccc1Br LS11478 [2,0,0,0,0,0|2,0,0]=4 53 B9R1.15 CNc1ccccc1F LS10646 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.15 COc1c(cccn1)I LS20331 [2,0,0,0,0,0|2,0,0]=4 55 B9R1.15 COc1cccnc1Br LS20368 [2,0,0,0,0,0|2,0,0]=4 56 B9R1.15 CSc1ccccc1Br LS11369 [2,0,0,0,0,0|1,1,0]=4 57 B9R1.15 c1ccc(c(c1)C#N)O LS10639 [2,0,0,0,0,0|2,0,0]=4 58 B11R1.159 c1cc(c(c(c1)O)O)C(=O)O LS10681 [1,1,0,0,0,0|2,0,0]=4 59 B11R1.9 COc1cc(cc(c1)OC)N LS10284 [1,1,0,0,0,0|0,0,0]=2 60 B11R1.9 COc1cc(nc(n1)Cl)OC LS20307 [1,1,0,0,0,0|2,0,0]=4 61 B11R1.9 COc1cc(nc(n1)N)OC LS21238 [1,1,0,0,0,0|2,0,0]=4 62 B11R1.9 Cc1cc(cc(c1)OC)OC LS11630 [1,1,0,0,0,0|0,0,0]=2 63 B11R1.266 B(c1cccc(c1)OC)(O)O LS10845 [1,1,0,0,0,0|2,0,0]=4 64 B11R1.266 COc1cccc(c1)C(=O)O LS11528 [1,1,0,0,0,0|2,0,0]=4 65 B11R1.280 COc1cc(ccc1F)C=O LS10503 [1,1,0,0,0,0|2,0,0]=4 66 B11R1.280 COc1cc(ccc1O)C#N LS11702 [1,1,0,0,0,0|2,0,0]=4 67 B11R1.280 COc1cc(ccc1O)CN LS11401 [1,1,0,0,0,0|2,0,0]=4 68 B13R1.302 COc1cc(cc(c1C=O)OC)Br LS11329 [0,2,0,0,0,0|0,0,1]=3 69 B13R1.2137 B(c1cccc(c1OC)OC)(O)O LS10926 [0,2,0,0,0,0|2,0,0]=4 70 B13R1.2356 B(c1c(cccc1OC)OC)(O)O LS10941 [0,2,0,0,0,0|0,0,0]=2 71 B11R2.106 c1cc2c(c(c1)I)OCO2 LS40633 [1,0,0,1,0,0|1,0,0]=3 72 B11R1.279 COc1ccc(c(c1)F)OC LS10379 [0,0,0,0,1,1|1,0,0]=3 73 B11R1.279 COc1ccc(cc1O)C#N LS11706 [0,0,0,0,1,1|2,0,0]=4 74 B11R1.279 COc1ccc(cc1O)C=O LS10550 [0,0,0,0,1,1|2,0,0]=4