0 B10R1.113 CC(c1cccc(c1)Br)F FS007989 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.113 CC(c1ccnc(c1)N)O FS000721 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.113 c1cc(cc(c1)N)C(F)F FS016303 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.113 c1cc(cc(c1)O)C(F)F FS010305 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.113 c1cnc(cc1Br)C(=O)O FS061087 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.113 c1cnc(cc1C(=O)O)Cl FS000571 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.2 C#Cc1cccc(c1)N FS000012 [1,0,0,0,0,0|1,0,2]=4 7 B9R1.2 CCc1cc(ccn1)Br FS009511 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.2 CCc1cccc(n1)Br FS009138 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.2 Cc1cccc(c1)[Zn]Br FS430173 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.2 Cc1cccc(c1)[Zn]Br FS430672 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.2 c1cc(cc(c1)Br)CN FS000883 [1,0,0,0,0,0|2,0,1]=4 12 B9R1.2 c1cc(cc(c1)I)CO FS000603 [1,0,0,0,0,0|1,0,2]=4 13 B9R1.2 c1cc(cc(c1)[Zn]Br)Cl FS430540 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.21 c1cc(nc(c1F)Br)C(=O)O FS023202 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.23 c1cc(cc(c1)Br)C(=O)CBr FS000051 [0,1,0,0,0,0|1,0,0]=2 16 B11R1.74 c1c(cc(cc1Cl)Br)[N+](=O)[O-] FS008017 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.74 c1c(cc(cc1O)Br)C(=O)O FS007934 [0,1,0,0,0,0|1,0,0]=2 18 B11R1.74 c1c(cc(nc1F)F)C(=O)O FS007291 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.155 CC(c1cccc(c1)Br)(F)F FS007988 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.159 CC(=O)c1cccc(c1F)Br FS005071 [0,1,0,0,0,0|1,0,0]=2 21 B11R1.159 CC(c1cccc(c1F)Br)O FS010040 [0,1,0,0,0,0|1,0,2]=4 22 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)N FS007914 [0,1,0,0,0,0|2,0,0]=3 23 B11R1.159 c1cc(c(c(c1)I)Br)C(=O)O FS007747 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.159 c1cc(c(c(c1)O)F)[N+](=O)[O-] FS007311 [0,1,0,0,0,0|2,0,0]=3 25 B11R1.159 c1cnc(c(c1C(=O)O)F)Br FS023205 [0,1,0,0,0,0|3,0,0]=4 26 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])I FS000837 [0,1,0,0,0,0|3,0,0]=4 27 B11R1.167 c1cc(c(cc1I)C(=O)O)Br FS000863 [0,1,0,0,0,0|2,0,0]=3 28 B11R1.266 B(c1cccc(c1)OC)(O)O FS000870 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.266 CC(C)c1cccc(c1)[Zn]Br FS430128 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.266 CC(C)c1cccc(c1)[Zn]Br FS430628 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.266 CN(C)c1cccc(c1)[Zn]Br FS430070 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.266 CN(C)c1cccc(c1)[Zn]Br FS430575 [0,1,0,0,0,0|3,0,0]=4 33 B11R2.35 c1cc(cc(c1)Br)C2CC2 FS008745 [0,0,0,1,0,0|2,0,1]=4 34 B9R1.41 c1csc(c1Br)C(=O)O FS000850 [0,0,0,0,1,0|3,0,0]=4 35 B11R1.157 C[C@@H](Cc1cccc(c1)Br)O FS024556 [0,0,0,0,0,1|1,0,2]=4 36 B11R1.157 C[C@@H](Cc1cccc(c1)O)O FS024550 [0,0,0,0,0,1|0,0,2]=3 37 B11R1.157 C[C@H](Cc1cccc(c1)Br)O FS024555 [0,0,0,0,0,1|1,0,2]=4 38 B11R1.157 C[C@H](Cc1cccc(c1)O)O FS024549 [0,0,0,0,0,1|0,0,2]=3 39 B11R1.157 c1cc(nc(c1)Cl)CC(=O)O FS011485 [0,0,0,0,0,1|3,0,0]=4 40 B8R1.4 C[n+]1cccc(c1)Br FS003003 [2,0,0,0,0,0|2,0,0]=4 41 B8R1.4 Cc1cc(ccn1)Br FS061083 [2,0,0,0,0,0|2,0,0]=4 42 B8R1.4 Cc1cc(nnc1)O FS007939 [2,0,0,0,0,0|2,0,0]=4 43 B10R1.2 COc1cccc(c1Br)F FS008005 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.2 COc1cccc(c1F)Br FS007289 [1,1,0,0,0,0|2,0,0]=4 45 B10R1.2 Cc1c(c(ccn1)C=O)O FS005103 [1,1,0,0,0,0|2,0,0]=4 46 B10R1.8 COc1cc(cc(c1)F)O FS007935 [1,1,0,0,0,0|1,0,0]=3 47 B10R1.172 CCc1cccc(c1)[Zn]Br FS430227 [1,1,0,0,0,0|1,0,1]=4 48 B10R1.172 CCc1cccc(c1)[Zn]Br FS430730 [1,1,0,0,0,0|1,0,1]=4 49 B10R1.172 COc1cc(ccn1)C=O FS005104 [1,1,0,0,0,0|1,0,0]=3 50 B10R1.172 COc1cccc(c1)[Zn]Br FS430142 [1,1,0,0,0,0|2,0,0]=4 51 B10R1.172 COc1cccc(c1)[Zn]Br FS430642 [1,1,0,0,0,0|2,0,0]=4 52 B10R1.172 CSc1cccc(c1)[Zn]Br FS430183 [1,1,0,0,0,0|2,0,0]=4 53 B10R1.172 CSc1cccc(c1)[Zn]Br FS430682 [1,1,0,0,0,0|2,0,0]=4 54 B10R1.13 CC(c1ccc(cc1)Br)F FS007605 [1,1,0,0,0,0|1,0,1]=4 55 B10R1.13 C[C@H](c1ccc(cc1)Br)N FS000860 [1,1,0,0,0,0|1,0,1]=4 56 B10R1.15 C=C(c1ccccc1)[Zn]Br FS430703 [1,1,0,0,0,0|1,0,1]=4 57 B10R1.15 CC(c1ccccc1)[Zn]Cl FS430376 [1,1,0,0,0,0|1,0,1]=4 58 B10R1.15 CC(c1ccccc1)[Zn]Cl FS430876 [1,1,0,0,0,0|1,0,1]=4 59 B10R1.15 COC(=O)c1ccnnc1 FS009175 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.61 CC(C)c1ccccc1I FS011362 [1,1,0,0,0,0|1,0,1]=4 61 B10R1.61 c1ccc(c(c1)C(=O)N)Br FS000820 [1,1,0,0,0,0|1,0,0]=3 62 B12R1.50 COC(=O)Cc1cccc(n1)Cl FS011495 [0,1,0,0,0,1|2,0,0]=4 63 B12R1.127 c1cc(c(cc1Cl)CC(=O)O)Br FS011376 [0,1,0,0,0,1|2,0,0]=4 64 B12R1.224 c1cc(c(c(c1)Br)F)CC(=O)O FS007290 [0,1,0,0,0,1|2,0,0]=4 65 B12R1.224 c1cc(c(c(c1)F)Br)CC(=O)O FS007288 [0,1,0,0,0,1|2,0,0]=4 66 B12R1.438 CC(=O)Oc1cccc(c1)C=O FS011360 [0,1,0,0,0,1|0,0,1]=3 67 B12R1.438 C[C@@H](Cc1cccc(c1)OC)O FS024564 [0,1,0,0,0,1|0,0,2]=4 68 B12R1.438 C[C@H](Cc1cccc(c1)OC)O FS024563 [0,1,0,0,0,1|0,0,2]=4 69 B12R1.367 COC(=O)c1ccc(c(c1)Br)I FS003005 [0,2,0,0,0,0|1,0,0]=3 70 B12R1.24 c1cc(c(c(c1)Br)F)C(=O)CBr FS009805 [0,2,0,0,0,0|1,0,0]=3 71 B12R1.435 COC(=O)c1cccc(n1)[Zn]Br FS430418 [0,2,0,0,0,0|2,0,0]=4 72 B12R1.435 COC(=O)c1cccc(n1)[Zn]Br FS430910 [0,2,0,0,0,0|2,0,0]=4 73 B12R1.435 COC(=O)c1ccnc(c1)[Zn]Br FS430421 [0,2,0,0,0,0|2,0,0]=4 74 B12R1.435 COC(=O)c1ccnc(c1)[Zn]Br FS430913 [0,2,0,0,0,0|2,0,0]=4 75 B12R1.511 Cc1cc(c(c(c1)Br)N)C(=O)O FS000849 [0,2,0,0,0,0|2,0,0]=4 76 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])I FS000836 [0,2,0,0,0,0|2,0,0]=4 77 B12R1.453 c1cc(c(cc1C=O)C(=O)O)O FS000819 [0,2,0,0,0,0|1,0,1]=4 78 B12R1.258 B(c1cccc(c1)C(=O)C)(O)O FS000885 [0,2,0,0,0,0|0,0,0]=2 79 B12R1.258 B(c1cccc(c1)C(=O)O)(O)O FS000841 [0,2,0,0,0,0|1,0,0]=3 80 B12R1.258 B(c1cccc(c1)C(C)F)(O)O FS008967 [0,2,0,0,0,0|1,0,1]=4 81 B12R2.606 Cc1nc2cc(ccc2o1)Br FS002011 [0,0,0,1,0,1|1,0,1]=4 82 B12R2.606 Cc1nc2cc(ccc2s1)I FS000656 [0,0,0,1,0,1|1,1,0]=4 83 B8R1.11 Cc1c(ccs1)C=O FS007601 [1,0,0,0,1,0|2,0,0]=4 84 B8R1.7 CC(=O)c1ccns1 FS008762 [1,0,0,0,1,0|2,0,0]=4 85 B10R1.18 CC(=O)Cc1ccnnc1 FS010187 [1,0,0,0,0,1|2,0,0]=4 86 B12R1.226 Cc1cccc(c1)CCC(=O)O FS000856 [0,0,0,0,0,2|2,0,0]=4