0 B10R1.25 C=Cc1c[nH]c(=O)cc1F 271570a_100011290941_100015631685 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.25 C=Cc1cc[n+](cc1C)[O-] 271570a_100011290941_100000074940 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.25 C=Cc1ccc(=O)[nH]c1N 271570a_100011290941_100009884077 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.25 C=Cc1ccc(c[n+]1[O-])C 271570a_100011290941_100009819918 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.25 C=Cc1ccc(c[n+]1[O-])F 271570a_100011290941_100009817261 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.25 C=Cc1ccc(cc1Br)Br 271570a_100011290941_100011484698 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.25 C=Cc1ccc(cc1Br)C 271570a_100011290941_100009813563 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.25 C=Cc1ccc(cc1Br)Cl 271570a_100011290941_100011219703 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.25 C=Cc1ccc(cc1Br)F 271570a_100011290941_100011217111 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.25 C=Cc1ccc(cc1Br)N 271570a_100011290941_100000750458 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.25 C=Cc1ccc(cc1Br)O 271570a_100011290941_100000701344 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.25 C=Cc1ccc(cc1C)Br 271570a_100011290941_100000701812 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.25 C=Cc1ccc(cc1C)C 271570a_100011290941_100011217332 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.25 C=Cc1ccc(cc1C)Cl 271570a_100011290941_100011219607 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.25 C=Cc1ccc(cc1C)F 271570a_100011290941_100011205405 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.25 C=Cc1ccc(cc1C)N 271570a_100011290941_100000210723 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.25 C=Cc1ccc(cc1C)O 271570a_100011290941_100000729255 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.25 C=Cc1ccc(cc1Cl)Br 271570a_100011290941_100011216062 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.25 C=Cc1ccc(cc1Cl)C 271570a_100011290941_100011263221 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.25 C=Cc1ccc(cc1Cl)Cl 271570a_100011290941_100000699841 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.25 C=Cc1ccc(cc1Cl)F 271570a_100011290941_100000733362 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.25 C=Cc1ccc(cc1Cl)N 271570a_100011290941_100000761885 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.25 C=Cc1ccc(cc1Cl)O 271570a_100011290941_100000047559 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.25 C=Cc1ccc(cc1F)Br 271570a_100011290941_100009814013 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.25 C=Cc1ccc(cc1F)C 271570a_100011290941_100011216119 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.25 C=Cc1ccc(cc1F)Cl 271570a_100011290941_100011216042 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.25 C=Cc1ccc(cc1F)F 271570a_100011290941_100000750030 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.25 C=Cc1ccc(cc1F)N 271570a_100011290941_100011356925 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.25 C=Cc1ccc(cc1F)O 271570a_100011290941_100000755031 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.25 C=Cc1ccc(cc1N)Br 271570a_100011290941_100000743836 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.25 C=Cc1ccc(cc1N)C 271570a_100011290941_100011216686 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.25 C=Cc1ccc(cc1N)Cl 271570a_100011290941_100000761886 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.25 C=Cc1ccc(cc1N)F 271570a_100011290941_100011218093 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.25 C=Cc1ccc(cc1N)N 271570a_100011290941_200012175722 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.25 C=Cc1ccc(cc1N)O 271570a_100011290941_100011999798 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.25 C=Cc1ccc(cc1O)Br 271570a_100011290941_100012344904 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.25 C=Cc1ccc(cc1O)C 271570a_100011290941_100012002257 [0,0,0,0,0,0|1,0,0]=1 37 B10R1.25 C=Cc1ccc(cc1O)Cl 271570a_100011290941_100000050036 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.25 C=Cc1ccc(cc1O)F 271570a_100011290941_100000690578 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.25 C=Cc1ccc(cc1O)O 271570a_100011290941_100009813921 [0,0,0,0,0,0|2,0,0]=2 40 B10R1.25 C=Cc1ccc(nc1Br)N 271570a_100011290941_100010734177 [0,0,0,0,0,0|4,0,0]=4 41 B10R1.25 C=Cc1ccc(nc1C)C 271570a_100011290941_100009813853 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.25 C=Cc1ccc(nc1C)Cl 271570a_100011290941_100000062408 [0,0,0,0,0,0|4,0,0]=4 43 B10R1.25 C=Cc1ccc(nc1C)F 271570a_100011290941_100000688911 [0,0,0,0,0,0|4,0,0]=4 44 B10R1.25 C=Cc1ccc(nc1C)N 271570a_100011290941_100000013003 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.25 C=Cc1ccc(nc1C)O 271570a_100011290941_100000691680 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.25 C=Cc1ccc(nc1Cl)Br 271570a_100011290941_100010246183 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.25 C=Cc1ccc(nc1Cl)N 271570a_100011290941_100010270343 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.25 C=Cc1ccc(nc1F)C 271570a_100011290941_100010006597 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.25 C=Cc1ccc(nc1F)Cl 271570a_100011290941_100010168078 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.25 C=Cc1ccc(nc1F)F 271570a_100011290941_100000070099 [0,0,0,0,0,0|4,0,0]=4 51 B10R1.25 C=Cc1ccc(nc1F)N 271570a_100011290941_100009882772 [0,0,0,0,0,0|4,0,0]=4 52 B10R1.25 C=Cc1ccc(nc1F)O 271570a_100011290941_100009879308 [0,0,0,0,0,0|4,0,0]=4 53 B10R1.25 C=Cc1ccc(nc1N)C 271570a_100011290941_100009816662 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.25 C=Cc1ccc(nc1N)Cl 271570a_100011290941_100010171640 [0,0,0,0,0,0|4,0,0]=4 55 B10R1.25 C=Cc1ccc(nc1N)F 271570a_100011290941_100009854977 [0,0,0,0,0,0|4,0,0]=4 56 B10R1.25 C=Cc1ccc(nc1N)N 271570a_100011290941_100011356871 [0,0,0,0,0,0|4,0,0]=4 57 B10R1.25 C=Cc1ccc(nc1O)C 271570a_100011290941_100009817604 [0,0,0,0,0,0|2,0,0]=2 58 B10R1.25 C=Cc1cnc([nH]c1=O)C 271570a_100011290941_100011999157 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.25 C=Cc1cnc(cc1Br)F 271570a_100011290941_100015451857 [0,0,0,0,0,0|4,0,0]=4 60 B10R1.25 C=Cc1cnc(cc1Br)N 271570a_100011290941_100010074611 [0,0,0,0,0,0|4,0,0]=4 61 B10R1.25 C=Cc1cnc(cc1C)Br 271570a_100011290941_100009816104 [0,0,0,0,0,0|4,0,0]=4 62 B10R1.25 C=Cc1cnc(cc1C)C 271570a_100011290941_100009819613 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.25 C=Cc1cnc(cc1C)Cl 271570a_100011290941_100010172789 [0,0,0,0,0,0|4,0,0]=4 64 B10R1.25 C=Cc1cnc(cc1C)F 271570a_100011290941_100009820716 [0,0,0,0,0,0|4,0,0]=4 65 B10R1.25 C=Cc1cnc(cc1C)N 271570a_100011290941_100000050067 [0,0,0,0,0,0|4,0,0]=4 66 B10R1.25 C=Cc1cnc(cc1C)O 271570a_100011290941_100010114363 [0,0,0,0,0,0|4,0,0]=4 67 B10R1.25 C=Cc1cnc(cc1Cl)Br 271570a_100011290941_100010381092 [0,0,0,0,0,0|4,0,0]=4 68 B10R1.25 C=Cc1cnc(cc1Cl)Cl 271570a_100011290941_100010200927 [0,0,0,0,0,0|4,0,0]=4 69 B10R1.25 C=Cc1cnc(cc1Cl)N 271570a_100011290941_100000694920 [0,0,0,0,0,0|4,0,0]=4 70 B10R1.25 C=Cc1cnc(cc1F)Cl 271570a_100011290941_100010128100 [0,0,0,0,0,0|4,0,0]=4 71 B10R1.25 C=Cc1cnc(cc1F)N 271570a_100011290941_100009844730 [0,0,0,0,0,0|4,0,0]=4 72 B10R1.25 C=Cc1cnc(cc1N)C 271570a_100011290941_100009817891 [0,0,0,0,0,0|3,0,0]=3 73 B10R1.25 C=Cc1cnc(cc1N)N 271570a_100011290941_200009857908 [0,0,0,0,0,0|4,0,0]=4 74 B10R1.25 C=Cc1cnc(cc1O)C 271570a_100011290941_100011016184 [0,0,0,0,0,0|2,0,0]=2 75 B10R1.25 C=Cc1cnc(nc1N)C 271570a_100011290941_100000684960 [0,0,0,0,0,0|4,0,0]=4 76 B10R1.25 C=Cc1ncc(cc1Br)Cl 271570a_100011290941_100012154958 [0,0,0,0,0,0|4,0,0]=4 77 B10R1.25 C=Cc1ncc(cc1C)Br 271570a_100011290941_100012353652 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.25 C=Cc1ncc(cc1C)C 271570a_100011290941_100009864548 [0,0,0,0,0,0|3,0,0]=3 79 B10R1.25 C=Cc1ncc(cc1C)F 271570a_100011290941_100009817009 [0,0,0,0,0,0|4,0,0]=4 80 B10R1.25 C=Cc1ncc(cc1C)N 271570a_100011290941_100000761747 [0,0,0,0,0,0|4,0,0]=4 81 B10R1.25 C=Cc1ncc(cc1C)O 271570a_100011290941_100012000486 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.25 C=Cc1ncc(cc1F)Br 271570a_100011290941_100012348576 [0,0,0,0,0,0|4,0,0]=4 83 B10R1.25 C=Cc1ncc(cc1F)C 271570a_100011290941_100009819633 [0,0,0,0,0,0|3,0,0]=3 84 B10R1.25 C=Cc1ncc(cc1F)Cl 271570a_100011290941_100012348686 [0,0,0,0,0,0|4,0,0]=4 85 B10R1.25 C=Cc1ncc(cc1F)F 271570a_100011290941_100011219543 [0,0,0,0,0,0|4,0,0]=4 86 B10R1.25 C=Cc1ncc(cc1F)N 271570a_100011290941_100010280766 [0,0,0,0,0,0|4,0,0]=4 87 B10R1.25 C=Cc1ncc(cc1F)O 271570a_100011290941_100000063512 [0,0,0,0,0,0|4,0,0]=4 88 B10R1.25 C=Cc1ncc(cc1N)Br 271570a_100011290941_100010090555 [0,0,0,0,0,0|4,0,0]=4 89 B10R1.25 C=Cc1ncc(cc1N)C 271570a_100011290941_100000733613 [0,0,0,0,0,0|3,0,0]=3 90 B10R1.25 C=Cc1ncc(cc1N)F 271570a_100011290941_100009817643 [0,0,0,0,0,0|4,0,0]=4 91 B10R1.25 C=Cc1ncc(cc1N)N 271570a_100011290941_200000093520 [0,0,0,0,0,0|4,0,0]=4 92 B10R1.25 C=Cc1ncc(cc1O)Br 271570a_100011290941_100010210634 [0,0,0,0,0,0|3,0,0]=3 93 B10R1.25 C=Cc1ncc(cc1O)C 271570a_100011290941_100012000487 [0,0,0,0,0,0|2,0,0]=2 94 B10R1.25 C=Cc1ncc(cc1O)Cl 271570a_100011290941_100010233512 [0,0,0,0,0,0|3,0,0]=3 95 B10R1.25 C=Cc1ncc(cc1O)F 271570a_100011290941_100000079967 [0,0,0,0,0,0|3,0,0]=3 96 B10R1.25 C=Cc1ncc(nc1C)C 271570a_100011290941_100000065684 [0,0,0,0,0,0|4,0,0]=4 97 B10R1.25 CCc1ccc(cc1F)O 271570a_203496583355_200010071577 [0,0,0,0,0,0|3,0,1]=4 98 B10R1.25 CCc1ccc(cc1N)O 271570a_203496583355_100012354963 [0,0,0,0,0,0|3,0,1]=4 99 B10R1.25 CCc1cnc(cc1O)C 271570a_203496583355_100010291839 [0,0,0,0,0,0|2,0,1]=3 100 B10R1.25 CCc1cnc(nc1O)C 271570a_203496583355_200000069817 [0,0,0,0,0,0|3,0,1]=4 101 B10R1.25 CCc1ncc(cc1O)N 271570a_203496583355_100013085292 [0,0,0,0,0,0|3,0,1]=4 102 B10R1.25 CNc1ccc(cc1Br)Br 34a_100000211012_200000210301 [0,0,0,0,0,0|4,0,0]=4 103 B10R1.25 CNc1ccc(cc1Br)C 34a_100000210942_200000210301 [0,0,0,0,0,0|3,0,0]=3 104 B10R1.25 CNc1ccc(cc1Br)Cl 34a_100000752454_200000210301 [0,0,0,0,0,0|4,0,0]=4 105 B10R1.25 CNc1ccc(cc1Br)F 34a_100000738039_200000210301 [0,0,0,0,0,0|4,0,0]=4 106 B10R1.25 CNc1ccc(cc1Br)O 34a_100012001276_200000210301 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.25 CNc1ccc(cc1C)Br 34a_100000211769_200000210301 [0,0,0,0,0,0|4,0,0]=4 108 B10R1.25 CNc1ccc(cc1C)Br 7a_100000211769_200000210301 [0,0,0,0,0,0|4,0,0]=4 109 B10R1.25 CNc1ccc(cc1C)C 34a_100000736561_200000210301 [0,0,0,0,0,0|3,0,0]=3 110 B10R1.25 CNc1ccc(cc1C)C 7a_100000736561_200000210301 [0,0,0,0,0,0|3,0,0]=3 111 B10R1.25 CNc1ccc(cc1C)Cl 34a_100000210418_200000210301 [0,0,0,0,0,0|4,0,0]=4 112 B10R1.25 CNc1ccc(cc1C)Cl 7a_100000210418_200000210301 [0,0,0,0,0,0|4,0,0]=4 113 B10R1.25 CNc1ccc(cc1C)F 34a_100000211637_200000210301 [0,0,0,0,0,0|4,0,0]=4 114 B10R1.25 CNc1ccc(cc1C)F 7a_100000211637_200000210301 [0,0,0,0,0,0|4,0,0]=4 115 B10R1.25 CNc1ccc(cc1C)I 34a_100000184554_200000210301 [0,0,0,0,0,0|4,0,0]=4 116 B10R1.25 CNc1ccc(cc1C)I 7a_100000184554_200000210301 [0,0,0,0,0,0|4,0,0]=4 117 B10R1.25 CNc1ccc(cc1C)O 271570a_203496583355_100000221803 [0,0,0,0,0,0|4,0,0]=4 118 B10R1.25 CNc1ccc(cc1C)O 34a_100000756630_200000210301 [0,0,0,0,0,0|4,0,0]=4 119 B10R1.25 CNc1ccc(cc1Cl)Br 34a_100000211467_200000210301 [0,0,0,0,0,0|4,0,0]=4 120 B10R1.25 CNc1ccc(cc1Cl)C 34a_100000210522_200000210301 [0,0,0,0,0,0|3,0,0]=3 121 B10R1.25 CNc1ccc(cc1Cl)Cl 34a_100000185861_200000210301 [0,0,0,0,0,0|4,0,0]=4 122 B10R1.25 CNc1ccc(cc1Cl)F 34a_100000212003_200000210301 [0,0,0,0,0,0|4,0,0]=4 123 B10R1.25 CNc1ccc(cc1Cl)I 34a_100011218065_200000210301 [0,0,0,0,0,0|4,0,0]=4 124 B10R1.25 CNc1ccc(cc1Cl)O 34a_100011215599_200000210301 [0,0,0,0,0,0|4,0,0]=4 125 B10R1.25 CNc1ccc(cc1F)Br 34a_100000210722_200000210301 [0,0,0,0,0,0|4,0,0]=4 126 B10R1.25 CNc1ccc(cc1F)C 34a_100000211023_200000210301 [0,0,0,0,0,0|3,0,0]=3 127 B10R1.25 CNc1ccc(cc1F)Cl 34a_100000211020_200000210301 [0,0,0,0,0,0|4,0,0]=4 128 B10R1.25 CNc1ccc(cc1F)F 34a_100000210720_200000210301 [0,0,0,0,0,0|4,0,0]=4 129 B10R1.25 CNc1ccc(cc1F)I 34a_100011215594_200000210301 [0,0,0,0,0,0|4,0,0]=4 130 B10R1.25 CNc1ccc(cc1F)O 271570a_203496583355_100000743884 [0,0,0,0,0,0|4,0,0]=4 131 B10R1.25 CNc1ccc(cc1F)O 34a_100000759473_200000210301 [0,0,0,0,0,0|4,0,0]=4 132 B10R1.25 CNc1ccc(cc1I)Br 34a_100000187925_200000210301 [0,0,0,0,0,0|4,0,0]=4 133 B10R1.25 CNc1ccc(cc1I)C 34a_100011356834_200000210301 [0,0,0,0,0,0|3,0,0]=3 134 B10R1.25 CNc1ccc(cc1I)Cl 34a_100000761889_200000210301 [0,0,0,0,0,0|4,0,0]=4 135 B10R1.25 CNc1ccc(cc1I)F 34a_100000760547_200000210301 [0,0,0,0,0,0|4,0,0]=4 136 B10R1.25 CNc1ccc(cc1I)O 34a_100010084370_200000210301 [0,0,0,0,0,0|4,0,0]=4 137 B10R1.25 CNc1ccc(cc1N)O 271570a_203496583355_100000741790 [0,0,0,0,0,0|4,0,0]=4 138 B10R1.25 CNc1ccc(cc1O)Br 34a_100000739049_200000210301 [0,0,0,0,0,0|3,0,0]=3 139 B10R1.25 CNc1ccc(cc1O)C 271570a_203496583355_100000221369 [0,0,0,0,0,0|2,0,0]=2 140 B10R1.25 CNc1ccc(cc1O)C 34a_100000211527_200000210301 [0,0,0,0,0,0|2,0,0]=2 141 B10R1.25 CNc1ccc(cc1O)Cl 34a_100000185728_200000210301 [0,0,0,0,0,0|3,0,0]=3 142 B10R1.25 CNc1ccc(cc1O)F 271570a_203496583355_100011246292 [0,0,0,0,0,0|3,0,0]=3 143 B10R1.25 CNc1ccc(cc1O)F 34a_100000753323_200000210301 [0,0,0,0,0,0|3,0,0]=3 144 B10R1.25 CNc1ccc(cc1O)O 34a_100000106777_200000210301 [0,0,0,0,0,0|3,0,0]=3 145 B10R1.25 COc1c[nH]c(=O)cc1O 271570a_203496583355_100121573661 [0,0,0,0,0,0|4,0,0]=4 146 B10R1.25 COc1ccc(cc1Br)Br 34a_100000188717_200000210301 [0,0,0,0,0,0|4,0,0]=4 147 B10R1.25 COc1ccc(cc1Br)Br 7a_100000188717_200000210301 [0,0,0,0,0,0|4,0,0]=4 148 B10R1.25 COc1ccc(cc1Br)C 34a_100000210800_200000210301 [0,0,0,0,0,0|3,0,0]=3 149 B10R1.25 COc1ccc(cc1Br)C 7a_100000210800_200000210301 [0,0,0,0,0,0|3,0,0]=3 150 B10R1.25 COc1ccc(cc1Br)Cl 34a_100000211998_200000210301 [0,0,0,0,0,0|4,0,0]=4 151 B10R1.25 COc1ccc(cc1Br)Cl 7a_100000211998_200000210301 [0,0,0,0,0,0|4,0,0]=4 152 B10R1.25 COc1ccc(cc1Br)F 34a_100000211999_200000210301 [0,0,0,0,0,0|4,0,0]=4 153 B10R1.25 COc1ccc(cc1Br)F 7a_100000211999_200000210301 [0,0,0,0,0,0|4,0,0]=4 154 B10R1.25 COc1ccc(cc1Br)I 34a_100012361655_200000210301 [0,0,0,0,0,0|4,0,0]=4 155 B10R1.25 COc1ccc(cc1Br)I 7a_100012361655_200000210301 [0,0,0,0,0,0|4,0,0]=4 156 B10R1.25 COc1ccc(cc1Br)N 34a_100011534360_200000210301 [0,0,0,0,0,0|4,0,0]=4 157 B10R1.25 COc1ccc(cc1Br)N 7a_100011534360_200000210301 [0,0,0,0,0,0|4,0,0]=4 158 B10R1.25 COc1ccc(cc1Br)O 271570a_203496583355_100011249507 [0,0,0,0,0,0|4,0,0]=4 159 B10R1.25 COc1ccc(cc1C)Br 34a_100000186361_200000210301 [0,0,0,0,0,0|4,0,0]=4 160 B10R1.25 COc1ccc(cc1C)Br 7a_100000186361_200000210301 [0,0,0,0,0,0|4,0,0]=4 161 B10R1.25 COc1ccc(cc1C)C 34a_100000211776_200000210301 [0,0,0,0,0,0|3,0,0]=3 162 B10R1.25 COc1ccc(cc1C)C 7a_100000211776_200000210301 [0,0,0,0,0,0|3,0,0]=3 163 B10R1.25 COc1ccc(cc1C)Cl 34a_100000211091_200000210301 [0,0,0,0,0,0|4,0,0]=4 164 B10R1.25 COc1ccc(cc1C)Cl 7a_100000211091_200000210301 [0,0,0,0,0,0|4,0,0]=4 165 B10R1.25 COc1ccc(cc1C)F 34a_100000764316_200000210301 [0,0,0,0,0,0|4,0,0]=4 166 B10R1.25 COc1ccc(cc1C)F 7a_100000764316_200000210301 [0,0,0,0,0,0|4,0,0]=4 167 B10R1.25 COc1ccc(cc1C)I 34a_100011218673_200000210301 [0,0,0,0,0,0|4,0,0]=4 168 B10R1.25 COc1ccc(cc1C)I 7a_100011218673_200000210301 [0,0,0,0,0,0|4,0,0]=4 169 B10R1.25 COc1ccc(cc1C)N 34a_100011218179_200000210301 [0,0,0,0,0,0|4,0,0]=4 170 B10R1.25 COc1ccc(cc1C)N 7a_100011218179_200000210301 [0,0,0,0,0,0|4,0,0]=4 171 B10R1.25 COc1ccc(cc1C)O 271570a_203496583355_100011219705 [0,0,0,0,0,0|4,0,0]=4 172 B10R1.25 COc1ccc(cc1Cl)Br 34a_100000186472_200000210301 [0,0,0,0,0,0|4,0,0]=4 173 B10R1.25 COc1ccc(cc1Cl)Br 7a_100000186472_200000210301 [0,0,0,0,0,0|4,0,0]=4 174 B10R1.25 COc1ccc(cc1Cl)C 34a_100000749699_200000210301 [0,0,0,0,0,0|3,0,0]=3 175 B10R1.25 COc1ccc(cc1Cl)C 7a_100000749699_200000210301 [0,0,0,0,0,0|3,0,0]=3 176 B10R1.25 COc1ccc(cc1Cl)Cl 34a_100015191787_200000210301 [0,0,0,0,0,0|4,0,0]=4 177 B10R1.25 COc1ccc(cc1Cl)Cl 7a_100015191787_200000210301 [0,0,0,0,0,0|4,0,0]=4 178 B10R1.25 COc1ccc(cc1Cl)F 34a_100000212004_200000210301 [0,0,0,0,0,0|4,0,0]=4 179 B10R1.25 COc1ccc(cc1Cl)F 7a_100000212004_200000210301 [0,0,0,0,0,0|4,0,0]=4 180 B10R1.25 COc1ccc(cc1Cl)I 34a_100012360047_200000210301 [0,0,0,0,0,0|4,0,0]=4 181 B10R1.25 COc1ccc(cc1Cl)I 7a_100012360047_200000210301 [0,0,0,0,0,0|4,0,0]=4 182 B10R1.25 COc1ccc(cc1Cl)N 34a_100000744943_200000210301 [0,0,0,0,0,0|4,0,0]=4 183 B10R1.25 COc1ccc(cc1Cl)N 7a_100000744943_200000210301 [0,0,0,0,0,0|4,0,0]=4 184 B10R1.25 COc1ccc(cc1Cl)O 271570a_203496583355_100012355395 [0,0,0,0,0,0|4,0,0]=4 185 B10R1.25 COc1ccc(cc1F)Br 34a_100000185481_200000210301 [0,0,0,0,0,0|4,0,0]=4 186 B10R1.25 COc1ccc(cc1F)Br 7a_100000185481_200000210301 [0,0,0,0,0,0|4,0,0]=4 187 B10R1.25 COc1ccc(cc1F)C 34a_100011216688_200000210301 [0,0,0,0,0,0|3,0,0]=3 188 B10R1.25 COc1ccc(cc1F)C 7a_100011216688_200000210301 [0,0,0,0,0,0|3,0,0]=3 189 B10R1.25 COc1ccc(cc1F)Cl 34a_100000230166_200000210301 [0,0,0,0,0,0|4,0,0]=4 190 B10R1.25 COc1ccc(cc1F)Cl 7a_100000230166_200000210301 [0,0,0,0,0,0|4,0,0]=4 191 B10R1.25 COc1ccc(cc1F)F 34a_100000230127_200000210301 [0,0,0,0,0,0|4,0,0]=4 192 B10R1.25 COc1ccc(cc1F)F 7a_100000230127_200000210301 [0,0,0,0,0,0|4,0,0]=4 193 B10R1.25 COc1ccc(cc1F)I 34a_100011356965_200000210301 [0,0,0,0,0,0|4,0,0]=4 194 B10R1.25 COc1ccc(cc1F)I 7a_100011356965_200000210301 [0,0,0,0,0,0|4,0,0]=4 195 B10R1.25 COc1ccc(cc1F)N 34a_100011220035_200000210301 [0,0,0,0,0,0|4,0,0]=4 196 B10R1.25 COc1ccc(cc1F)N 7a_100011220035_200000210301 [0,0,0,0,0,0|4,0,0]=4 197 B10R1.25 COc1ccc(cc1F)O 271570a_203496583355_100000185480 [0,0,0,0,0,0|4,0,0]=4 198 B10R1.25 COc1ccc(cc1I)Br 34a_100012355227_200000210301 [0,0,0,0,0,0|4,0,0]=4 199 B10R1.25 COc1ccc(cc1I)Br 7a_100012355227_200000210301 [0,0,0,0,0,0|4,0,0]=4 200 B10R1.25 COc1ccc(cc1I)C 34a_100000765521_200000210301 [0,0,0,0,0,0|3,0,0]=3 201 B10R1.25 COc1ccc(cc1I)C 7a_100000765521_200000210301 [0,0,0,0,0,0|3,0,0]=3 202 B10R1.25 COc1ccc(cc1I)Cl 34a_100011356953_200000210301 [0,0,0,0,0,0|4,0,0]=4 203 B10R1.25 COc1ccc(cc1I)Cl 7a_100011356953_200000210301 [0,0,0,0,0,0|4,0,0]=4 204 B10R1.25 COc1ccc(cc1I)F 34a_100012355409_200000210301 [0,0,0,0,0,0|4,0,0]=4 205 B10R1.25 COc1ccc(cc1I)F 7a_100012355409_200000210301 [0,0,0,0,0,0|4,0,0]=4 206 B10R1.25 COc1ccc(cc1I)I 7a_100010001573_200000210301 [0,0,0,0,0,0|4,0,0]=4 207 B10R1.25 COc1ccc(cc1N)Br 34a_100000752626_200000210301 [0,0,0,0,0,0|4,0,0]=4 208 B10R1.25 COc1ccc(cc1N)Br 7a_100000752626_200000210301 [0,0,0,0,0,0|4,0,0]=4 209 B10R1.25 COc1ccc(cc1N)C 34a_100011215204_200000210301 [0,0,0,0,0,0|3,0,0]=3 210 B10R1.25 COc1ccc(cc1N)C 7a_100011215204_200000210301 [0,0,0,0,0,0|3,0,0]=3 211 B10R1.25 COc1ccc(cc1N)Cl 34a_100000210500_200000210301 [0,0,0,0,0,0|4,0,0]=4 212 B10R1.25 COc1ccc(cc1N)Cl 7a_100000210500_200000210301 [0,0,0,0,0,0|4,0,0]=4 213 B10R1.25 COc1ccc(cc1N)F 34a_100000759472_200000210301 [0,0,0,0,0,0|4,0,0]=4 214 B10R1.25 COc1ccc(cc1N)F 7a_100000759472_200000210301 [0,0,0,0,0,0|4,0,0]=4 215 B10R1.25 COc1ccc(cc1N)I 34a_100000753495_200000210301 [0,0,0,0,0,0|4,0,0]=4 216 B10R1.25 COc1ccc(cc1N)I 7a_100000753495_200000210301 [0,0,0,0,0,0|4,0,0]=4 217 B10R1.25 COc1ccc(cc1N)N 34a_100000725306_200000210301 [0,0,0,0,0,0|4,0,0]=4 218 B10R1.25 COc1ccc(cc1N)O 271570a_203496583355_100000743470 [0,0,0,0,0,0|4,0,0]=4 219 B10R1.25 COc1ccc(cc1O)Br 271570a_203496583355_100012351588 [0,0,0,0,0,0|3,0,0]=3 220 B10R1.25 COc1ccc(cc1O)C 271570a_203496583355_100000186399 [0,0,0,0,0,0|2,0,0]=2 221 B10R1.25 COc1ccc(cc1O)Cl 271570a_203496583355_100011215930 [0,0,0,0,0,0|3,0,0]=3 222 B10R1.25 COc1ccc(cc1O)F 271570a_203496583355_100000171694 [0,0,0,0,0,0|3,0,0]=3 223 B10R1.25 COc1ccc(cc1O)N 271570a_203496583355_100000187427 [0,0,0,0,0,0|3,0,0]=3 224 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100009816560 [0,0,0,0,0,0|3,0,0]=3 225 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100010084122 [0,0,0,0,0,0|3,0,0]=3 226 B10R1.25 COc1ccc(nc1Br)C 34a_100000702858_200000210301 [0,0,0,0,0,0|4,0,0]=4 227 B10R1.25 COc1ccc(nc1Br)C 7a_100000702858_200000210301 [0,0,0,0,0,0|4,0,0]=4 228 B10R1.25 COc1ccc(nc1C)C 34a_100011218912_200000210301 [0,0,0,0,0,0|4,0,0]=4 229 B10R1.25 COc1ccc(nc1C)C 7a_100011218912_200000210301 [0,0,0,0,0,0|4,0,0]=4 230 B10R1.25 COc1ccc(nc1Cl)C 34a_100000086286_200000210301 [0,0,0,0,0,0|4,0,0]=4 231 B10R1.25 COc1ccc(nc1Cl)C 7a_100000086286_200000210301 [0,0,0,0,0,0|4,0,0]=4 232 B10R1.25 COc1ccc(nc1F)C 34a_100000079963_200000210301 [0,0,0,0,0,0|4,0,0]=4 233 B10R1.25 COc1ccc(nc1F)C 7a_100000079963_200000210301 [0,0,0,0,0,0|4,0,0]=4 234 B10R1.25 COc1ccc(nc1I)C 34a_100000023897_200000210301 [0,0,0,0,0,0|4,0,0]=4 235 B10R1.25 COc1ccc(nc1I)C 7a_100000023897_200000210301 [0,0,0,0,0,0|4,0,0]=4 236 B10R1.25 COc1ccc(nc1N)C 34a_100000694039_200000210301 [0,0,0,0,0,0|4,0,0]=4 237 B10R1.25 COc1ccc(nc1N)C 7a_100000694039_200000210301 [0,0,0,0,0,0|4,0,0]=4 238 B10R1.25 COc1ccc(nc1O)C 271570a_203496583355_100009820875 [0,0,0,0,0,0|3,0,0]=3 239 B10R1.25 COc1ccc(nc1O)N 271570a_203496583355_100010172607 [0,0,0,0,0,0|4,0,0]=4 240 B10R1.25 COc1cnc(cc1Br)C 34a_100009843476_200000210301 [0,0,0,0,0,0|4,0,0]=4 241 B10R1.25 COc1cnc(cc1Br)C 7a_100009843476_200000210301 [0,0,0,0,0,0|4,0,0]=4 242 B10R1.25 COc1cnc(cc1C)C 34a_200000068632_200000210301 [0,0,0,0,0,0|4,0,0]=4 243 B10R1.25 COc1cnc(cc1C)C 7a_200000068632_200000210301 [0,0,0,0,0,0|4,0,0]=4 244 B10R1.25 COc1cnc(cc1O)C 271570a_203496583355_100010109759 [0,0,0,0,0,0|3,0,0]=3 245 B10R1.25 COc1cnc(cc1O)O 271570a_203496583355_100010264082 [0,0,0,0,0,0|4,0,0]=4 246 B10R1.25 COc1coc(cc1=O)C 34a_100000081520_200000210301 [0,0,0,0,0,0|3,0,1]=4 247 B10R1.25 COc1ncc(cc1Br)C 34a_100000719714_200000210301 [0,0,0,0,0,0|4,0,0]=4 248 B10R1.25 COc1ncc(cc1N)C 34a_100012000488_200000210301 [0,0,0,0,0,0|4,0,0]=4 249 B10R1.25 COc1ncc(cc1O)Br 271570a_203496583355_100009814608 [0,0,0,0,0,0|4,0,0]=4 250 B10R1.25 COc1ncc(cc1O)C 271570a_203496583355_100012353929 [0,0,0,0,0,0|3,0,0]=3 251 B10R1.25 COc1ncc(cc1O)F 271570a_203496583355_100009828472 [0,0,0,0,0,0|4,0,0]=4 252 B10R1.25 COc1ncc(cc1O)N 271570a_203496583355_100012351452 [0,0,0,0,0,0|4,0,0]=4 253 B10R1.25 COc1ncc(cc1O)O 271570a_203496583355_100010135713 [0,0,0,0,0,0|4,0,0]=4 254 B10R1.25 CSc1ccc(c[n+]1[O-])C 62a_200000210301_100009819918 [0,0,0,0,0,0|3,0,1]=4 255 B10R1.25 CSc1ccc(cc1Br)Br 62a_100011484698_200000210301 [0,0,0,0,0,0|4,0,0]=4 256 B10R1.25 CSc1ccc(cc1Br)Br 62a_200000210301_100011484698 [0,0,0,0,0,0|4,0,0]=4 257 B10R1.25 CSc1ccc(cc1Br)C 62a_100009813563_200000210301 [0,0,0,0,0,0|3,0,0]=3 258 B10R1.25 CSc1ccc(cc1Br)C 62a_200000210301_100009813563 [0,0,0,0,0,0|3,0,0]=3 259 B10R1.25 CSc1ccc(cc1Br)Cl 62a_100011219703_200000210301 [0,0,0,0,0,0|4,0,0]=4 260 B10R1.25 CSc1ccc(cc1Br)Cl 62a_200000210301_100011219703 [0,0,0,0,0,0|4,0,0]=4 261 B10R1.25 CSc1ccc(cc1Br)F 62a_100011217111_200000210301 [0,0,0,0,0,0|4,0,0]=4 262 B10R1.25 CSc1ccc(cc1Br)F 62a_200000210301_100011217111 [0,0,0,0,0,0|4,0,0]=4 263 B10R1.25 CSc1ccc(cc1Br)N 62a_100000750458_200000210301 [0,0,0,0,0,0|4,0,0]=4 264 B10R1.25 CSc1ccc(cc1Br)N 62a_200000210301_100000750458 [0,0,0,0,0,0|4,0,0]=4 265 B10R1.25 CSc1ccc(cc1Br)O 62a_100000701344_200000210301 [0,0,0,0,0,0|4,0,0]=4 266 B10R1.25 CSc1ccc(cc1Br)O 62a_200000210301_100000701344 [0,0,0,0,0,0|4,0,0]=4 267 B10R1.25 CSc1ccc(cc1C)Br 62a_100000701812_200000210301 [0,0,0,0,0,0|4,0,0]=4 268 B10R1.25 CSc1ccc(cc1C)Br 62a_200000210301_100000701812 [0,0,0,0,0,0|4,0,0]=4 269 B10R1.25 CSc1ccc(cc1C)C 62a_100011217332_200000210301 [0,0,0,0,0,0|3,0,0]=3 270 B10R1.25 CSc1ccc(cc1C)C 62a_200000210301_100011217332 [0,0,0,0,0,0|3,0,0]=3 271 B10R1.25 CSc1ccc(cc1C)Cl 62a_100011219607_200000210301 [0,0,0,0,0,0|4,0,0]=4 272 B10R1.25 CSc1ccc(cc1C)Cl 62a_200000210301_100011219607 [0,0,0,0,0,0|4,0,0]=4 273 B10R1.25 CSc1ccc(cc1C)F 62a_100011205405_200000210301 [0,0,0,0,0,0|4,0,0]=4 274 B10R1.25 CSc1ccc(cc1C)F 62a_200000210301_100011205405 [0,0,0,0,0,0|4,0,0]=4 275 B10R1.25 CSc1ccc(cc1C)N 62a_100000210723_200000210301 [0,0,0,0,0,0|4,0,0]=4 276 B10R1.25 CSc1ccc(cc1C)N 62a_200000210301_100000210723 [0,0,0,0,0,0|4,0,0]=4 277 B10R1.25 CSc1ccc(cc1C)O 62a_200000210301_100000690111 [0,0,0,0,0,0|4,0,0]=4 278 B10R1.25 CSc1ccc(cc1Cl)Br 62a_100011216062_200000210301 [0,0,0,0,0,0|4,0,0]=4 279 B10R1.25 CSc1ccc(cc1Cl)Br 62a_200000210301_100011216062 [0,0,0,0,0,0|4,0,0]=4 280 B10R1.25 CSc1ccc(cc1Cl)C 62a_100011263221_200000210301 [0,0,0,0,0,0|3,0,0]=3 281 B10R1.25 CSc1ccc(cc1Cl)C 62a_200000210301_100011263221 [0,0,0,0,0,0|3,0,0]=3 282 B10R1.25 CSc1ccc(cc1Cl)Cl 62a_100000699841_200000210301 [0,0,0,0,0,0|4,0,0]=4 283 B10R1.25 CSc1ccc(cc1Cl)Cl 62a_200000210301_100000699841 [0,0,0,0,0,0|4,0,0]=4 284 B10R1.25 CSc1ccc(cc1Cl)F 62a_100000733362_200000210301 [0,0,0,0,0,0|4,0,0]=4 285 B10R1.25 CSc1ccc(cc1Cl)F 62a_200000210301_100000733362 [0,0,0,0,0,0|4,0,0]=4 286 B10R1.25 CSc1ccc(cc1Cl)N 62a_100000761885_200000210301 [0,0,0,0,0,0|4,0,0]=4 287 B10R1.25 CSc1ccc(cc1Cl)N 62a_200000210301_100000761885 [0,0,0,0,0,0|4,0,0]=4 288 B10R1.25 CSc1ccc(cc1Cl)O 271570a_203496583355_206447510565 [0,0,0,0,0,0|4,0,0]=4 289 B10R1.25 CSc1ccc(cc1Cl)O 62a_100000047559_200000210301 [0,0,0,0,0,0|4,0,0]=4 290 B10R1.25 CSc1ccc(cc1Cl)O 62a_200000210301_100000047559 [0,0,0,0,0,0|4,0,0]=4 291 B10R1.25 CSc1ccc(cc1F)Br 62a_100009814013_200000210301 [0,0,0,0,0,0|4,0,0]=4 292 B10R1.25 CSc1ccc(cc1F)Br 62a_200000210301_100009814013 [0,0,0,0,0,0|4,0,0]=4 293 B10R1.25 CSc1ccc(cc1F)C 62a_100011216119_200000210301 [0,0,0,0,0,0|3,0,0]=3 294 B10R1.25 CSc1ccc(cc1F)C 62a_200000210301_100011216119 [0,0,0,0,0,0|3,0,0]=3 295 B10R1.25 CSc1ccc(cc1F)Cl 62a_100011216042_200000210301 [0,0,0,0,0,0|4,0,0]=4 296 B10R1.25 CSc1ccc(cc1F)Cl 62a_200000210301_100011216042 [0,0,0,0,0,0|4,0,0]=4 297 B10R1.25 CSc1ccc(cc1F)F 62a_100000750030_200000210301 [0,0,0,0,0,0|4,0,0]=4 298 B10R1.25 CSc1ccc(cc1F)F 62a_200000210301_100000750030 [0,0,0,0,0,0|4,0,0]=4 299 B10R1.25 CSc1ccc(cc1F)N 62a_100011356925_200000210301 [0,0,0,0,0,0|4,0,0]=4 300 B10R1.25 CSc1ccc(cc1F)N 62a_200000210301_100011356925 [0,0,0,0,0,0|4,0,0]=4 301 B10R1.25 CSc1ccc(cc1F)O 271570a_203496583355_100010161220 [0,0,0,0,0,0|4,0,0]=4 302 B10R1.25 CSc1ccc(cc1F)O 62a_100000755031_200000210301 [0,0,0,0,0,0|4,0,0]=4 303 B10R1.25 CSc1ccc(cc1F)O 62a_200000210301_100000755031 [0,0,0,0,0,0|4,0,0]=4 304 B10R1.25 CSc1ccc(cc1N)Br 62a_100000743836_200000210301 [0,0,0,0,0,0|4,0,0]=4 305 B10R1.25 CSc1ccc(cc1N)Br 62a_200000210301_100000743836 [0,0,0,0,0,0|4,0,0]=4 306 B10R1.25 CSc1ccc(cc1N)C 62a_100011216686_200000210301 [0,0,0,0,0,0|3,0,0]=3 307 B10R1.25 CSc1ccc(cc1N)C 62a_200000210301_100011216686 [0,0,0,0,0,0|3,0,0]=3 308 B10R1.25 CSc1ccc(cc1N)Cl 62a_100000761886_200000210301 [0,0,0,0,0,0|4,0,0]=4 309 B10R1.25 CSc1ccc(cc1N)Cl 62a_200000210301_100000761886 [0,0,0,0,0,0|4,0,0]=4 310 B10R1.25 CSc1ccc(cc1N)F 62a_100000687223_200000210301 [0,0,0,0,0,0|4,0,0]=4 311 B10R1.25 CSc1ccc(cc1N)F 62a_200000210301_100000687223 [0,0,0,0,0,0|4,0,0]=4 312 B10R1.25 CSc1ccc(cc1N)N 62a_200000210301_200012175722 [0,0,0,0,0,0|4,0,0]=4 313 B10R1.25 CSc1ccc(cc1N)N 62a_200012175722_200000210301 [0,0,0,0,0,0|4,0,0]=4 314 B10R1.25 CSc1ccc(cc1N)O 62a_100011999798_200000210301 [0,0,0,0,0,0|4,0,0]=4 315 B10R1.25 CSc1ccc(cc1N)O 62a_200000210301_100011999798 [0,0,0,0,0,0|4,0,0]=4 316 B10R1.25 CSc1ccc(cc1O)Br 62a_100012344904_200000210301 [0,0,0,0,0,0|3,0,0]=3 317 B10R1.25 CSc1ccc(cc1O)Br 62a_200000210301_100012344904 [0,0,0,0,0,0|3,0,0]=3 318 B10R1.25 CSc1ccc(cc1O)C 271570a_203496583355_200010201864 [0,0,0,0,0,0|2,0,0]=2 319 B10R1.25 CSc1ccc(cc1O)C 62a_100012002257_200000210301 [0,0,0,0,0,0|2,0,0]=2 320 B10R1.25 CSc1ccc(cc1O)C 62a_200000210301_100012002257 [0,0,0,0,0,0|2,0,0]=2 321 B10R1.25 CSc1ccc(cc1O)Cl 62a_100000050036_200000210301 [0,0,0,0,0,0|3,0,0]=3 322 B10R1.25 CSc1ccc(cc1O)Cl 62a_200000210301_100000050036 [0,0,0,0,0,0|3,0,0]=3 323 B10R1.25 CSc1ccc(cc1O)F 271570a_203496583355_100009817003 [0,0,0,0,0,0|3,0,0]=3 324 B10R1.25 CSc1ccc(cc1O)F 62a_100000690578_200000210301 [0,0,0,0,0,0|3,0,0]=3 325 B10R1.25 CSc1ccc(cc1O)F 62a_200000210301_100000690578 [0,0,0,0,0,0|3,0,0]=3 326 B10R1.25 CSc1ccc(cc1O)O 62a_200000210301_100009813921 [0,0,0,0,0,0|3,0,0]=3 327 B10R1.25 CSc1ccc(nc1C)C 62a_100009813853_200000210301 [0,0,0,0,0,0|4,0,0]=4 328 B10R1.25 CSc1ccc(nc1C)C 62a_200000210301_100009813853 [0,0,0,0,0,0|4,0,0]=4 329 B10R1.25 CSc1ccc(nc1F)C 62a_100010006597_200000210301 [0,0,0,0,0,0|4,0,0]=4 330 B10R1.25 CSc1ccc(nc1F)C 62a_200000210301_100010006597 [0,0,0,0,0,0|4,0,0]=4 331 B10R1.25 CSc1ccc(nc1N)C 62a_100009816662_200000210301 [0,0,0,0,0,0|4,0,0]=4 332 B10R1.25 CSc1ccc(nc1N)C 62a_200000210301_100009816662 [0,0,0,0,0,0|4,0,0]=4 333 B10R1.25 CSc1ccc(nc1O)C 62a_100009817604_200000210301 [0,0,0,0,0,0|3,0,0]=3 334 B10R1.25 CSc1ccc(nc1O)C 62a_200000210301_100009817604 [0,0,0,0,0,0|3,0,0]=3 335 B10R1.25 CSc1cnc(cc1C)C 62a_100009819613_200000210301 [0,0,0,0,0,0|4,0,0]=4 336 B10R1.25 CSc1cnc(cc1C)C 62a_200000210301_100009819613 [0,0,0,0,0,0|4,0,0]=4 337 B10R1.25 CSc1cnc(cc1N)C 62a_100009817891_200000210301 [0,0,0,0,0,0|4,0,0]=4 338 B10R1.25 CSc1cnc(cc1N)C 62a_200000210301_100009817891 [0,0,0,0,0,0|4,0,0]=4 339 B10R1.25 CSc1cnc(cc1O)C 62a_100011016184_200000210301 [0,0,0,0,0,0|3,0,0]=3 340 B10R1.25 CSc1cnc(cc1O)C 62a_200000210301_100011016184 [0,0,0,0,0,0|3,0,0]=3 341 B10R1.25 CSc1ncc(cc1C)C 62a_100009864548_200000210301 [0,0,0,0,0,0|4,0,0]=4 342 B10R1.25 CSc1ncc(cc1C)C 62a_200000210301_100009864548 [0,0,0,0,0,0|4,0,0]=4 343 B10R1.25 CSc1ncc(cc1F)C 62a_100009819633_200000210301 [0,0,0,0,0,0|4,0,0]=4 344 B10R1.25 CSc1ncc(cc1F)C 62a_200000210301_100009819633 [0,0,0,0,0,0|4,0,0]=4 345 B10R1.25 CSc1ncc(cc1N)C 62a_100000733613_200000210301 [0,0,0,0,0,0|4,0,0]=4 346 B10R1.25 CSc1ncc(cc1N)C 62a_200000210301_100000733613 [0,0,0,0,0,0|4,0,0]=4 347 B10R1.25 CSc1ncc(cc1O)Br 62a_100010210634_200000210301 [0,0,0,0,0,0|4,0,0]=4 348 B10R1.25 CSc1ncc(cc1O)Br 62a_200000210301_100010210634 [0,0,0,0,0,0|4,0,0]=4 349 B10R1.25 CSc1ncc(cc1O)C 62a_200000210301_100012000487 [0,0,0,0,0,0|3,0,0]=3 350 B10R1.25 CSc1ncc(cc1O)Cl 62a_100010233512_200000210301 [0,0,0,0,0,0|4,0,0]=4 351 B10R1.25 CSc1ncc(cc1O)Cl 62a_200000210301_100010233512 [0,0,0,0,0,0|4,0,0]=4 352 B10R1.25 CSc1ncc(cc1O)F 62a_100009820119_200000210301 [0,0,0,0,0,0|4,0,0]=4 353 B10R1.25 CSc1ncc(cc1O)F 62a_200000210301_100000079967 [0,0,0,0,0,0|4,0,0]=4 354 B10R1.25 Cc1cc(=O)c(co1)O[13CH3] 34a_100000081520_200025704644 [0,0,0,0,0,0|3,0,1]=4 355 B10R1.25 Cc1cc(c(cn1)O[13CH3])Br 34a_100009843476_200025704644 [0,0,0,0,0,0|4,0,0]=4 356 B10R1.25 Cc1cc(c(cn1)O[13CH3])Br 7a_100009843476_200025704644 [0,0,0,0,0,0|4,0,0]=4 357 B10R1.25 Cc1cc(c(cn1)O[13CH3])C 34a_200000068632_200025704644 [0,0,0,0,0,0|4,0,0]=4 358 B10R1.25 Cc1cc(c(cn1)O[13CH3])C 7a_200000068632_200025704644 [0,0,0,0,0,0|4,0,0]=4 359 B10R1.25 Cc1cc(c(cn1)S[13CH3])C 62a_100009819613_200025704644 [0,0,0,0,0,0|4,0,0]=4 360 B10R1.25 Cc1cc(c(cn1)S[13CH3])C 62a_200025704644_100009819613 [0,0,0,0,0,0|4,0,0]=4 361 B10R1.25 Cc1cc(c(cn1)S[13CH3])N 62a_100009817891_200025704644 [0,0,0,0,0,0|4,0,0]=4 362 B10R1.25 Cc1cc(c(cn1)S[13CH3])N 62a_200025704644_100009817891 [0,0,0,0,0,0|4,0,0]=4 363 B10R1.25 Cc1cc(c(cn1)S[13CH3])O 62a_100011016184_200025704644 [0,0,0,0,0,0|3,0,0]=3 364 B10R1.25 Cc1cc(c(cn1)S[13CH3])O 62a_200025704644_100011016184 [0,0,0,0,0,0|3,0,0]=3 365 B10R1.25 Cc1cc(ccc1C#N)O 271570a_203496583355_100000687762 [0,0,0,0,0,0|3,0,1]=4 366 B10R1.25 Cc1cc(ccc1C=O)O 271570a_203496583355_100000687586 [0,0,0,0,0,0|2,0,0]=2 367 B10R1.25 Cc1cc(ccc1CF)O 271570a_203496583355_200010711859 [0,0,0,0,0,0|3,0,1]=4 368 B10R1.25 Cc1cc(ccc1CN)O 271570a_203496583355_100000753881 [0,0,0,0,0,0|3,0,1]=4 369 B10R1.25 Cc1cc(ccc1CO)O 271570a_203496583355_100000748258 [0,0,0,0,0,0|2,0,2]=4 370 B10R1.25 Cc1cc(ccc1NN)O 271570a_203496583355_100000751375 [0,0,0,0,0,0|4,0,0]=4 371 B10R1.25 Cc1cc(ccc1N[13CH3])Br 34a_100000211769_200025704644 [0,0,0,0,0,0|4,0,0]=4 372 B10R1.25 Cc1cc(ccc1N[13CH3])Br 7a_100000211769_200025704644 [0,0,0,0,0,0|4,0,0]=4 373 B10R1.25 Cc1cc(ccc1N[13CH3])Cl 34a_100000210418_200025704644 [0,0,0,0,0,0|4,0,0]=4 374 B10R1.25 Cc1cc(ccc1N[13CH3])Cl 7a_100000210418_200025704644 [0,0,0,0,0,0|4,0,0]=4 375 B10R1.25 Cc1cc(ccc1N[13CH3])F 34a_100000211637_200025704644 [0,0,0,0,0,0|4,0,0]=4 376 B10R1.25 Cc1cc(ccc1N[13CH3])F 7a_100000211637_200025704644 [0,0,0,0,0,0|4,0,0]=4 377 B10R1.25 Cc1cc(ccc1N[13CH3])I 34a_100000184554_200025704644 [0,0,0,0,0,0|4,0,0]=4 378 B10R1.25 Cc1cc(ccc1N[13CH3])I 7a_100000184554_200025704644 [0,0,0,0,0,0|4,0,0]=4 379 B10R1.25 Cc1cc(ccc1N[13CH3])O 34a_100000756630_200025704644 [0,0,0,0,0,0|4,0,0]=4 380 B10R1.25 Cc1cc(ccc1O[13CH3])Br 34a_100000186361_200025704644 [0,0,0,0,0,0|4,0,0]=4 381 B10R1.25 Cc1cc(ccc1O[13CH3])Br 7a_100000186361_200025704644 [0,0,0,0,0,0|4,0,0]=4 382 B10R1.25 Cc1cc(ccc1O[13CH3])Cl 34a_100000211091_200025704644 [0,0,0,0,0,0|4,0,0]=4 383 B10R1.25 Cc1cc(ccc1O[13CH3])Cl 7a_100000211091_200025704644 [0,0,0,0,0,0|4,0,0]=4 384 B10R1.25 Cc1cc(ccc1O[13CH3])F 34a_100000764316_200025704644 [0,0,0,0,0,0|4,0,0]=4 385 B10R1.25 Cc1cc(ccc1O[13CH3])F 7a_100000764316_200025704644 [0,0,0,0,0,0|4,0,0]=4 386 B10R1.25 Cc1cc(ccc1O[13CH3])I 34a_100011218673_200025704644 [0,0,0,0,0,0|4,0,0]=4 387 B10R1.25 Cc1cc(ccc1O[13CH3])I 7a_100011218673_200025704644 [0,0,0,0,0,0|4,0,0]=4 388 B10R1.25 Cc1cc(ccc1O[13CH3])N 34a_100011218179_200025704644 [0,0,0,0,0,0|4,0,0]=4 389 B10R1.25 Cc1cc(ccc1O[13CH3])N 7a_100011218179_200025704644 [0,0,0,0,0,0|4,0,0]=4 390 B10R1.25 Cc1cc(ccc1S[13CH3])Br 62a_100000701812_200025704644 [0,0,0,0,0,0|4,0,0]=4 391 B10R1.25 Cc1cc(ccc1S[13CH3])Br 62a_200025704644_100000701812 [0,0,0,0,0,0|4,0,0]=4 392 B10R1.25 Cc1cc(ccc1S[13CH3])Cl 62a_100011219607_200025704644 [0,0,0,0,0,0|4,0,0]=4 393 B10R1.25 Cc1cc(ccc1S[13CH3])Cl 62a_200025704644_100011219607 [0,0,0,0,0,0|4,0,0]=4 394 B10R1.25 Cc1cc(ccc1S[13CH3])F 62a_100011205405_200025704644 [0,0,0,0,0,0|4,0,0]=4 395 B10R1.25 Cc1cc(ccc1S[13CH3])F 62a_200025704644_100011205405 [0,0,0,0,0,0|4,0,0]=4 396 B10R1.25 Cc1cc(ccc1S[13CH3])N 62a_100000210723_200025704644 [0,0,0,0,0,0|4,0,0]=4 397 B10R1.25 Cc1cc(ccc1S[13CH3])N 62a_200025704644_100000210723 [0,0,0,0,0,0|4,0,0]=4 398 B10R1.25 Cc1cc(ccc1S[13CH3])O 62a_200025704644_100000690111 [0,0,0,0,0,0|4,0,0]=4 399 B10R1.25 Cc1cc(cnc1C=O)O 271570a_203496583355_100010185443 [0,0,0,0,0,0|3,0,0]=3 400 B10R1.25 Cc1cc(ncc1C=O)O 271570a_203496583355_100000085382 [0,0,0,0,0,0|3,0,0]=3 401 B10R1.25 Cc1ccc([n+](c1)[O-])S[13CH3] 62a_200025704644_100009819918 [0,0,0,0,0,0|3,0,1]=4 402 B10R1.25 Cc1ccc(c(c1)Br)N[13CH3] 34a_100000210942_200025704644 [0,0,0,0,0,0|3,0,0]=3 403 B10R1.25 Cc1ccc(c(c1)Br)O[13CH3] 34a_100000210800_200025704644 [0,0,0,0,0,0|3,0,0]=3 404 B10R1.25 Cc1ccc(c(c1)Br)O[13CH3] 7a_100000210800_200025704644 [0,0,0,0,0,0|3,0,0]=3 405 B10R1.25 Cc1ccc(c(c1)Br)S[13CH3] 62a_100009813563_200025704644 [0,0,0,0,0,0|3,0,0]=3 406 B10R1.25 Cc1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100009813563 [0,0,0,0,0,0|3,0,0]=3 407 B10R1.25 Cc1ccc(c(c1)C)N[13CH3] 34a_100000736561_200025704644 [0,0,0,0,0,0|3,0,0]=3 408 B10R1.25 Cc1ccc(c(c1)C)N[13CH3] 7a_100000736561_200025704644 [0,0,0,0,0,0|3,0,0]=3 409 B10R1.25 Cc1ccc(c(c1)C)O[13CH3] 34a_100000211776_200025704644 [0,0,0,0,0,0|3,0,0]=3 410 B10R1.25 Cc1ccc(c(c1)C)O[13CH3] 7a_100000211776_200025704644 [0,0,0,0,0,0|3,0,0]=3 411 B10R1.25 Cc1ccc(c(c1)C)S[13CH3] 62a_100011217332_200025704644 [0,0,0,0,0,0|3,0,0]=3 412 B10R1.25 Cc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100011217332 [0,0,0,0,0,0|3,0,0]=3 413 B10R1.25 Cc1ccc(c(c1)Cl)N[13CH3] 34a_100000210522_200025704644 [0,0,0,0,0,0|3,0,0]=3 414 B10R1.25 Cc1ccc(c(c1)Cl)O[13CH3] 34a_100000749699_200025704644 [0,0,0,0,0,0|3,0,0]=3 415 B10R1.25 Cc1ccc(c(c1)Cl)O[13CH3] 7a_100000749699_200025704644 [0,0,0,0,0,0|3,0,0]=3 416 B10R1.25 Cc1ccc(c(c1)Cl)S[13CH3] 62a_100011263221_200025704644 [0,0,0,0,0,0|3,0,0]=3 417 B10R1.25 Cc1ccc(c(c1)Cl)S[13CH3] 62a_200025704644_100011263221 [0,0,0,0,0,0|3,0,0]=3 418 B10R1.25 Cc1ccc(c(c1)F)N[13CH3] 34a_100000211023_200025704644 [0,0,0,0,0,0|3,0,0]=3 419 B10R1.25 Cc1ccc(c(c1)F)O[13CH3] 34a_100011216688_200025704644 [0,0,0,0,0,0|3,0,0]=3 420 B10R1.25 Cc1ccc(c(c1)F)O[13CH3] 7a_100011216688_200025704644 [0,0,0,0,0,0|3,0,0]=3 421 B10R1.25 Cc1ccc(c(c1)F)S[13CH3] 62a_100011216119_200025704644 [0,0,0,0,0,0|3,0,0]=3 422 B10R1.25 Cc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100011216119 [0,0,0,0,0,0|3,0,0]=3 423 B10R1.25 Cc1ccc(c(c1)I)N[13CH3] 34a_100011356834_200025704644 [0,0,0,0,0,0|3,0,0]=3 424 B10R1.25 Cc1ccc(c(c1)I)O[13CH3] 34a_100000765521_200025704644 [0,0,0,0,0,0|3,0,0]=3 425 B10R1.25 Cc1ccc(c(c1)I)O[13CH3] 7a_100000765521_200025704644 [0,0,0,0,0,0|3,0,0]=3 426 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 34a_100011215204_200025704644 [0,0,0,0,0,0|3,0,0]=3 427 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 7a_100011215204_200025704644 [0,0,0,0,0,0|3,0,0]=3 428 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_100011216686_200025704644 [0,0,0,0,0,0|3,0,0]=3 429 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011216686 [0,0,0,0,0,0|3,0,0]=3 430 B10R1.25 Cc1ccc(c(c1)O)C#N 271570a_203496583355_100000693804 [0,0,0,0,0,0|1,0,1]=2 431 B10R1.25 Cc1ccc(c(c1)O)C=O 271570a_203496583355_100000692596 [0,0,0,0,0,0|0,0,0]=0 432 B10R1.25 Cc1ccc(c(c1)O)NN 271570a_203496583355_100016996181 [0,0,0,0,0,0|2,0,0]=2 433 B10R1.25 Cc1ccc(c(c1)O)N[13CH3] 34a_100000211527_200025704644 [0,0,0,0,0,0|2,0,0]=2 434 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_100012002257_200025704644 [0,0,0,0,0,0|2,0,0]=2 435 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012002257 [0,0,0,0,0,0|2,0,0]=2 436 B10R1.25 Cc1ccc(c(n1)Br)O[13CH3] 34a_100000702858_200025704644 [0,0,0,0,0,0|4,0,0]=4 437 B10R1.25 Cc1ccc(c(n1)Br)O[13CH3] 7a_100000702858_200025704644 [0,0,0,0,0,0|4,0,0]=4 438 B10R1.25 Cc1ccc(c(n1)C)O[13CH3] 34a_100011218912_200025704644 [0,0,0,0,0,0|4,0,0]=4 439 B10R1.25 Cc1ccc(c(n1)C)O[13CH3] 7a_100011218912_200025704644 [0,0,0,0,0,0|4,0,0]=4 440 B10R1.25 Cc1ccc(c(n1)C)S[13CH3] 62a_100009813853_200025704644 [0,0,0,0,0,0|4,0,0]=4 441 B10R1.25 Cc1ccc(c(n1)C)S[13CH3] 62a_200025704644_100009813853 [0,0,0,0,0,0|4,0,0]=4 442 B10R1.25 Cc1ccc(c(n1)Cl)O[13CH3] 34a_100000086286_200025704644 [0,0,0,0,0,0|4,0,0]=4 443 B10R1.25 Cc1ccc(c(n1)Cl)O[13CH3] 7a_100000086286_200025704644 [0,0,0,0,0,0|4,0,0]=4 444 B10R1.25 Cc1ccc(c(n1)F)O[13CH3] 34a_100000079963_200025704644 [0,0,0,0,0,0|4,0,0]=4 445 B10R1.25 Cc1ccc(c(n1)F)O[13CH3] 7a_100000079963_200025704644 [0,0,0,0,0,0|4,0,0]=4 446 B10R1.25 Cc1ccc(c(n1)F)S[13CH3] 62a_100010006597_200025704644 [0,0,0,0,0,0|4,0,0]=4 447 B10R1.25 Cc1ccc(c(n1)F)S[13CH3] 62a_200025704644_100010006597 [0,0,0,0,0,0|4,0,0]=4 448 B10R1.25 Cc1ccc(c(n1)I)O[13CH3] 34a_100000023897_200025704644 [0,0,0,0,0,0|4,0,0]=4 449 B10R1.25 Cc1ccc(c(n1)I)O[13CH3] 7a_100000023897_200025704644 [0,0,0,0,0,0|4,0,0]=4 450 B10R1.25 Cc1ccc(c(n1)N)O[13CH3] 34a_100000694039_200025704644 [0,0,0,0,0,0|4,0,0]=4 451 B10R1.25 Cc1ccc(c(n1)N)O[13CH3] 7a_100000694039_200025704644 [0,0,0,0,0,0|4,0,0]=4 452 B10R1.25 Cc1ccc(c(n1)N)S[13CH3] 62a_100009816662_200025704644 [0,0,0,0,0,0|4,0,0]=4 453 B10R1.25 Cc1ccc(c(n1)N)S[13CH3] 62a_200025704644_100009816662 [0,0,0,0,0,0|4,0,0]=4 454 B10R1.25 Cc1ccc(c(n1)O)C#N 271570a_203496583355_100000741175 [0,0,0,0,0,0|2,0,1]=3 455 B10R1.25 Cc1ccc(c(n1)O)C=O 271570a_203496583355_100000085379 [0,0,0,0,0,0|1,0,0]=1 456 B10R1.25 Cc1ccc(c(n1)O)CO 271570a_203496583355_102495338573 [0,0,0,0,0,0|1,0,2]=3 457 B10R1.25 Cc1ccc(c(n1)O)S[13CH3] 62a_100009817604_200025704644 [0,0,0,0,0,0|3,0,0]=3 458 B10R1.25 Cc1ccc(c(n1)O)S[13CH3] 62a_200025704644_100009817604 [0,0,0,0,0,0|3,0,0]=3 459 B10R1.25 Cc1cnc(c(c1)Br)O[13CH3] 34a_100000719714_200025704644 [0,0,0,0,0,0|4,0,0]=4 460 B10R1.25 Cc1cnc(c(c1)C)S[13CH3] 62a_100009864548_200025704644 [0,0,0,0,0,0|4,0,0]=4 461 B10R1.25 Cc1cnc(c(c1)C)S[13CH3] 62a_200025704644_100009864548 [0,0,0,0,0,0|4,0,0]=4 462 B10R1.25 Cc1cnc(c(c1)F)S[13CH3] 62a_100009819633_200025704644 [0,0,0,0,0,0|4,0,0]=4 463 B10R1.25 Cc1cnc(c(c1)F)S[13CH3] 62a_200025704644_100009819633 [0,0,0,0,0,0|4,0,0]=4 464 B10R1.25 Cc1cnc(c(c1)N)O[13CH3] 34a_100012000488_200025704644 [0,0,0,0,0,0|4,0,0]=4 465 B10R1.25 Cc1cnc(c(c1)N)S[13CH3] 62a_100000733613_200025704644 [0,0,0,0,0,0|4,0,0]=4 466 B10R1.25 Cc1cnc(c(c1)N)S[13CH3] 62a_200025704644_100000733613 [0,0,0,0,0,0|4,0,0]=4 467 B10R1.25 Cc1cnc(c(c1)O)C#N 271570a_203496583355_100009874213 [0,0,0,0,0,0|2,0,1]=3 468 B10R1.25 Cc1cnc(c(c1)O)NN 271570a_203496583355_100012357580 [0,0,0,0,0,0|3,0,0]=3 469 B10R1.25 Cc1cnc(c(c1)O)S[13CH3] 62a_200025704644_100012000487 [0,0,0,0,0,0|3,0,0]=3 470 B10R1.25 Cc1nc(ccc1C=O)O 271570a_203496583355_100000050599 [0,0,0,0,0,0|3,0,0]=3 471 B10R1.25 Cc1ncc(c(n1)O)C#N 271570a_203496583355_200012187075 [0,0,0,0,0,0|3,0,1]=4 472 B10R1.25 N#Cc1ccc(cc1Br)O 271570a_203496583355_100012349582 [0,0,0,0,0,0|3,0,1]=4 473 B10R1.25 N#Cc1ccc(cc1Cl)O 271570a_203496583355_100012349662 [0,0,0,0,0,0|3,0,1]=4 474 B10R1.25 N#Cc1ccc(cc1F)O 271570a_203496583355_100000037869 [0,0,0,0,0,0|3,0,1]=4 475 B10R1.25 N#Cc1ccc(cc1N)O 271570a_203496583355_100000699244 [0,0,0,0,0,0|3,0,1]=4 476 B10R1.25 N#Cc1ccc(cc1O)Br 271570a_203496583355_100010214477 [0,0,0,0,0,0|2,0,1]=3 477 B10R1.25 N#Cc1ccc(cc1O)Cl 271570a_203496583355_100012355178 [0,0,0,0,0,0|2,0,1]=3 478 B10R1.25 N#Cc1ccc(cc1O)F 271570a_203496583355_100000747196 [0,0,0,0,0,0|2,0,1]=3 479 B10R1.25 N#Cc1ccc(cc1O)N 271570a_203496583355_100000689153 [0,0,0,0,0,0|2,0,1]=3 480 B10R1.25 N#Cc1ccc(cc1O)O 271570a_203496583355_100011934713 [0,0,0,0,0,0|2,0,1]=3 481 B10R1.25 N#Cc1ccc(cc1O)O 271570a_203496583355_100012184851 [0,0,0,0,0,0|2,0,1]=3 482 B10R1.25 N#Cc1ccc(nc1O)N 271570a_203496583355_100000144572 [0,0,0,0,0,0|3,0,1]=4 483 B10R1.25 N#Cc1cnc(cc1O)Br 271570a_203496583355_200010074381 [0,0,0,0,0,0|3,0,1]=4 484 B10R1.25 N#Cc1cnc(cc1O)Cl 271570a_203496583355_100010074454 [0,0,0,0,0,0|3,0,1]=4 485 B10R1.25 N#Cc1cnc(cc1O)N 271570a_203496583355_100009983784 [0,0,0,0,0,0|3,0,1]=4 486 B10R1.25 N#Cc1ncc(cc1O)F 271570a_203496583355_100010080900 [0,0,0,0,0,0|3,0,1]=4 487 B10R1.25 N#Cc1ncc(cc1O)O 271570a_203496583355_200013853302 [0,0,0,0,0,0|3,0,1]=4 488 B10R1.25 N#Cc1ncc(cc1O)O 271570a_203496583355_200015293162 [0,0,0,0,0,0|3,0,1]=4 489 B10R1.25 NCc1ccc(cc1F)O 271570a_203496583355_100000754580 [0,0,0,0,0,0|3,0,1]=4 490 B10R1.25 NCc1ccc(cc1O)F 271570a_203496583355_100000708791 [0,0,0,0,0,0|2,0,1]=3 491 B10R1.25 NNc1ccc(cc1F)O 271570a_203496583355_100000751572 [0,0,0,0,0,0|4,0,0]=4 492 B10R1.25 Nc1cc(ccc1C=O)O 271570a_203496583355_100009814810 [0,0,0,0,0,0|2,0,0]=2 493 B10R1.25 Nc1cc(ccc1CO)O 271570a_203496583355_100000718831 [0,0,0,0,0,0|2,0,2]=4 494 B10R1.25 O=Cc1ccc(cc1Br)O 271570a_203496583355_100010185650 [0,0,0,0,0,0|2,0,0]=2 495 B10R1.25 O=Cc1ccc(cc1Cl)O 271570a_203496583355_100000727542 [0,0,0,0,0,0|2,0,0]=2 496 B10R1.25 O=Cc1ccc(cc1F)O 271570a_203496583355_100000211676 [0,0,0,0,0,0|2,0,0]=2 497 B10R1.25 O=Cc1ccc(cc1O)Br 271570a_203496583355_100010146562 [0,0,0,0,0,0|1,0,0]=1 498 B10R1.25 O=Cc1ccc(cc1O)F 271570a_203496583355_100000752949 [0,0,0,0,0,0|1,0,0]=1 499 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011236494 [0,0,0,0,0,0|1,0,0]=1 500 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011277552 [0,0,0,0,0,0|1,0,0]=1 501 B10R1.25 O=Cc1ccc(nc1F)O 271570a_203496583355_100010064369 [0,0,0,0,0,0|3,0,0]=3 502 B10R1.25 O=Cc1ccc(nc1O)F 271570a_203496583355_100009846357 [0,0,0,0,0,0|2,0,0]=2 503 B10R1.25 O=Cc1cnc(cc1O)F 271570a_203496583355_100009862493 [0,0,0,0,0,0|2,0,0]=2 504 B10R1.25 O=Cc1ncc(cc1F)O 271570a_203496583355_100010180630 [0,0,0,0,0,0|3,0,0]=3 505 B10R1.25 OCc1ccc(cc1Br)O 271570a_203496583355_100010240206 [0,0,0,0,0,0|2,0,2]=4 506 B10R1.25 OCc1ccc(cc1F)O 271570a_203496583355_100011191541 [0,0,0,0,0,0|2,0,2]=4 507 B10R1.25 OCc1ccc(cc1O)Br 271570a_203496583355_100010146605 [0,0,0,0,0,0|1,0,2]=3 508 B10R1.25 OCc1ccc(cc1O)Cl 271570a_203496583355_100000722340 [0,0,0,0,0,0|1,0,2]=3 509 B10R1.25 OCc1ccc(cc1O)F 271570a_203496583355_100000744086 [0,0,0,0,0,0|1,0,2]=3 510 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100000071718 [0,0,0,0,0,0|1,0,2]=3 511 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100010146404 [0,0,0,0,0,0|1,0,2]=3 512 B10R1.25 [13CH3]Nc1ccc(cc1Br)Br 34a_100000211012_200025704644 [0,0,0,0,0,0|4,0,0]=4 513 B10R1.25 [13CH3]Nc1ccc(cc1Br)Cl 34a_100000752454_200025704644 [0,0,0,0,0,0|4,0,0]=4 514 B10R1.25 [13CH3]Nc1ccc(cc1Br)F 34a_100000738039_200025704644 [0,0,0,0,0,0|4,0,0]=4 515 B10R1.25 [13CH3]Nc1ccc(cc1Br)O 34a_100012001276_200025704644 [0,0,0,0,0,0|4,0,0]=4 516 B10R1.25 [13CH3]Nc1ccc(cc1Cl)Br 34a_100000211467_200025704644 [0,0,0,0,0,0|4,0,0]=4 517 B10R1.25 [13CH3]Nc1ccc(cc1Cl)Cl 34a_100000185861_200025704644 [0,0,0,0,0,0|4,0,0]=4 518 B10R1.25 [13CH3]Nc1ccc(cc1Cl)F 34a_100000212003_200025704644 [0,0,0,0,0,0|4,0,0]=4 519 B10R1.25 [13CH3]Nc1ccc(cc1Cl)I 34a_100011218065_200025704644 [0,0,0,0,0,0|4,0,0]=4 520 B10R1.25 [13CH3]Nc1ccc(cc1Cl)O 34a_100011215599_200025704644 [0,0,0,0,0,0|4,0,0]=4 521 B10R1.25 [13CH3]Nc1ccc(cc1F)Br 34a_100000210722_200025704644 [0,0,0,0,0,0|4,0,0]=4 522 B10R1.25 [13CH3]Nc1ccc(cc1F)Cl 34a_100000211020_200025704644 [0,0,0,0,0,0|4,0,0]=4 523 B10R1.25 [13CH3]Nc1ccc(cc1F)F 34a_100000210720_200025704644 [0,0,0,0,0,0|4,0,0]=4 524 B10R1.25 [13CH3]Nc1ccc(cc1F)I 34a_100011215594_200025704644 [0,0,0,0,0,0|4,0,0]=4 525 B10R1.25 [13CH3]Nc1ccc(cc1F)O 34a_100000759473_200025704644 [0,0,0,0,0,0|4,0,0]=4 526 B10R1.25 [13CH3]Nc1ccc(cc1I)Br 34a_100000187925_200025704644 [0,0,0,0,0,0|4,0,0]=4 527 B10R1.25 [13CH3]Nc1ccc(cc1I)Cl 34a_100000761889_200025704644 [0,0,0,0,0,0|4,0,0]=4 528 B10R1.25 [13CH3]Nc1ccc(cc1I)F 34a_100000760547_200025704644 [0,0,0,0,0,0|4,0,0]=4 529 B10R1.25 [13CH3]Nc1ccc(cc1I)O 34a_100010084370_200025704644 [0,0,0,0,0,0|4,0,0]=4 530 B10R1.25 [13CH3]Nc1ccc(cc1O)Br 34a_100000739049_200025704644 [0,0,0,0,0,0|3,0,0]=3 531 B10R1.25 [13CH3]Nc1ccc(cc1O)Cl 34a_100000185728_200025704644 [0,0,0,0,0,0|3,0,0]=3 532 B10R1.25 [13CH3]Nc1ccc(cc1O)F 34a_100000753323_200025704644 [0,0,0,0,0,0|3,0,0]=3 533 B10R1.25 [13CH3]Nc1ccc(cc1O)O 34a_100000106777_200025704644 [0,0,0,0,0,0|3,0,0]=3 534 B10R1.25 [13CH3]Oc1ccc(cc1Br)Br 34a_100000188717_200025704644 [0,0,0,0,0,0|4,0,0]=4 535 B10R1.25 [13CH3]Oc1ccc(cc1Br)Br 7a_100000188717_200025704644 [0,0,0,0,0,0|4,0,0]=4 536 B10R1.25 [13CH3]Oc1ccc(cc1Br)Cl 34a_100000211998_200025704644 [0,0,0,0,0,0|4,0,0]=4 537 B10R1.25 [13CH3]Oc1ccc(cc1Br)Cl 7a_100000211998_200025704644 [0,0,0,0,0,0|4,0,0]=4 538 B10R1.25 [13CH3]Oc1ccc(cc1Br)F 34a_100000211999_200025704644 [0,0,0,0,0,0|4,0,0]=4 539 B10R1.25 [13CH3]Oc1ccc(cc1Br)F 7a_100000211999_200025704644 [0,0,0,0,0,0|4,0,0]=4 540 B10R1.25 [13CH3]Oc1ccc(cc1Br)I 34a_100012361655_200025704644 [0,0,0,0,0,0|4,0,0]=4 541 B10R1.25 [13CH3]Oc1ccc(cc1Br)I 7a_100012361655_200025704644 [0,0,0,0,0,0|4,0,0]=4 542 B10R1.25 [13CH3]Oc1ccc(cc1Br)N 34a_100011534360_200025704644 [0,0,0,0,0,0|4,0,0]=4 543 B10R1.25 [13CH3]Oc1ccc(cc1Br)N 7a_100011534360_200025704644 [0,0,0,0,0,0|4,0,0]=4 544 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Br 34a_100000186472_200025704644 [0,0,0,0,0,0|4,0,0]=4 545 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Br 7a_100000186472_200025704644 [0,0,0,0,0,0|4,0,0]=4 546 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Cl 34a_100015191787_200025704644 [0,0,0,0,0,0|4,0,0]=4 547 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Cl 7a_100015191787_200025704644 [0,0,0,0,0,0|4,0,0]=4 548 B10R1.25 [13CH3]Oc1ccc(cc1Cl)F 34a_100000212004_200025704644 [0,0,0,0,0,0|4,0,0]=4 549 B10R1.25 [13CH3]Oc1ccc(cc1Cl)F 7a_100000212004_200025704644 [0,0,0,0,0,0|4,0,0]=4 550 B10R1.25 [13CH3]Oc1ccc(cc1Cl)I 34a_100012360047_200025704644 [0,0,0,0,0,0|4,0,0]=4 551 B10R1.25 [13CH3]Oc1ccc(cc1Cl)I 7a_100012360047_200025704644 [0,0,0,0,0,0|4,0,0]=4 552 B10R1.25 [13CH3]Oc1ccc(cc1Cl)N 34a_100000744943_200025704644 [0,0,0,0,0,0|4,0,0]=4 553 B10R1.25 [13CH3]Oc1ccc(cc1Cl)N 7a_100000744943_200025704644 [0,0,0,0,0,0|4,0,0]=4 554 B10R1.25 [13CH3]Oc1ccc(cc1F)Br 34a_100000185481_200025704644 [0,0,0,0,0,0|4,0,0]=4 555 B10R1.25 [13CH3]Oc1ccc(cc1F)Br 7a_100000185481_200025704644 [0,0,0,0,0,0|4,0,0]=4 556 B10R1.25 [13CH3]Oc1ccc(cc1F)Cl 34a_100000230166_200025704644 [0,0,0,0,0,0|4,0,0]=4 557 B10R1.25 [13CH3]Oc1ccc(cc1F)Cl 7a_100000230166_200025704644 [0,0,0,0,0,0|4,0,0]=4 558 B10R1.25 [13CH3]Oc1ccc(cc1F)F 34a_100000230127_200025704644 [0,0,0,0,0,0|4,0,0]=4 559 B10R1.25 [13CH3]Oc1ccc(cc1F)F 7a_100000230127_200025704644 [0,0,0,0,0,0|4,0,0]=4 560 B10R1.25 [13CH3]Oc1ccc(cc1F)I 34a_100011356965_200025704644 [0,0,0,0,0,0|4,0,0]=4 561 B10R1.25 [13CH3]Oc1ccc(cc1F)I 7a_100011356965_200025704644 [0,0,0,0,0,0|4,0,0]=4 562 B10R1.25 [13CH3]Oc1ccc(cc1F)N 34a_100011220035_200025704644 [0,0,0,0,0,0|4,0,0]=4 563 B10R1.25 [13CH3]Oc1ccc(cc1F)N 7a_100011220035_200025704644 [0,0,0,0,0,0|4,0,0]=4 564 B10R1.25 [13CH3]Oc1ccc(cc1I)Br 34a_100012355227_200025704644 [0,0,0,0,0,0|4,0,0]=4 565 B10R1.25 [13CH3]Oc1ccc(cc1I)Br 7a_100012355227_200025704644 [0,0,0,0,0,0|4,0,0]=4 566 B10R1.25 [13CH3]Oc1ccc(cc1I)Cl 34a_100011356953_200025704644 [0,0,0,0,0,0|4,0,0]=4 567 B10R1.25 [13CH3]Oc1ccc(cc1I)Cl 7a_100011356953_200025704644 [0,0,0,0,0,0|4,0,0]=4 568 B10R1.25 [13CH3]Oc1ccc(cc1I)F 34a_100012355409_200025704644 [0,0,0,0,0,0|4,0,0]=4 569 B10R1.25 [13CH3]Oc1ccc(cc1I)F 7a_100012355409_200025704644 [0,0,0,0,0,0|4,0,0]=4 570 B10R1.25 [13CH3]Oc1ccc(cc1I)I 7a_100010001573_200025704644 [0,0,0,0,0,0|4,0,0]=4 571 B10R1.25 [13CH3]Oc1ccc(cc1N)Br 34a_100000752626_200025704644 [0,0,0,0,0,0|4,0,0]=4 572 B10R1.25 [13CH3]Oc1ccc(cc1N)Br 7a_100000752626_200025704644 [0,0,0,0,0,0|4,0,0]=4 573 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 34a_100000210500_200025704644 [0,0,0,0,0,0|4,0,0]=4 574 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 7a_100000210500_200025704644 [0,0,0,0,0,0|4,0,0]=4 575 B10R1.25 [13CH3]Oc1ccc(cc1N)F 34a_100000759472_200025704644 [0,0,0,0,0,0|4,0,0]=4 576 B10R1.25 [13CH3]Oc1ccc(cc1N)F 7a_100000759472_200025704644 [0,0,0,0,0,0|4,0,0]=4 577 B10R1.25 [13CH3]Oc1ccc(cc1N)I 34a_100000753495_200025704644 [0,0,0,0,0,0|4,0,0]=4 578 B10R1.25 [13CH3]Oc1ccc(cc1N)I 7a_100000753495_200025704644 [0,0,0,0,0,0|4,0,0]=4 579 B10R1.25 [13CH3]Oc1ccc(cc1N)N 34a_100000725306_200025704644 [0,0,0,0,0,0|4,0,0]=4 580 B10R1.25 [13CH3]Sc1ccc(cc1Br)Br 62a_100011484698_200025704644 [0,0,0,0,0,0|4,0,0]=4 581 B10R1.25 [13CH3]Sc1ccc(cc1Br)Br 62a_200025704644_100011484698 [0,0,0,0,0,0|4,0,0]=4 582 B10R1.25 [13CH3]Sc1ccc(cc1Br)Cl 62a_100011219703_200025704644 [0,0,0,0,0,0|4,0,0]=4 583 B10R1.25 [13CH3]Sc1ccc(cc1Br)Cl 62a_200025704644_100011219703 [0,0,0,0,0,0|4,0,0]=4 584 B10R1.25 [13CH3]Sc1ccc(cc1Br)F 62a_100011217111_200025704644 [0,0,0,0,0,0|4,0,0]=4 585 B10R1.25 [13CH3]Sc1ccc(cc1Br)F 62a_200025704644_100011217111 [0,0,0,0,0,0|4,0,0]=4 586 B10R1.25 [13CH3]Sc1ccc(cc1Br)N 62a_100000750458_200025704644 [0,0,0,0,0,0|4,0,0]=4 587 B10R1.25 [13CH3]Sc1ccc(cc1Br)N 62a_200025704644_100000750458 [0,0,0,0,0,0|4,0,0]=4 588 B10R1.25 [13CH3]Sc1ccc(cc1Br)O 62a_100000701344_200025704644 [0,0,0,0,0,0|4,0,0]=4 589 B10R1.25 [13CH3]Sc1ccc(cc1Br)O 62a_200025704644_100000701344 [0,0,0,0,0,0|4,0,0]=4 590 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Br 62a_100011216062_200025704644 [0,0,0,0,0,0|4,0,0]=4 591 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Br 62a_200025704644_100011216062 [0,0,0,0,0,0|4,0,0]=4 592 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Cl 62a_100000699841_200025704644 [0,0,0,0,0,0|4,0,0]=4 593 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Cl 62a_200025704644_100000699841 [0,0,0,0,0,0|4,0,0]=4 594 B10R1.25 [13CH3]Sc1ccc(cc1Cl)F 62a_100000733362_200025704644 [0,0,0,0,0,0|4,0,0]=4 595 B10R1.25 [13CH3]Sc1ccc(cc1Cl)F 62a_200025704644_100000733362 [0,0,0,0,0,0|4,0,0]=4 596 B10R1.25 [13CH3]Sc1ccc(cc1Cl)N 62a_100000761885_200025704644 [0,0,0,0,0,0|4,0,0]=4 597 B10R1.25 [13CH3]Sc1ccc(cc1Cl)N 62a_200025704644_100000761885 [0,0,0,0,0,0|4,0,0]=4 598 B10R1.25 [13CH3]Sc1ccc(cc1Cl)O 62a_100000047559_200025704644 [0,0,0,0,0,0|4,0,0]=4 599 B10R1.25 [13CH3]Sc1ccc(cc1Cl)O 62a_200025704644_100000047559 [0,0,0,0,0,0|4,0,0]=4 600 B10R1.25 [13CH3]Sc1ccc(cc1F)Br 62a_100009814013_200025704644 [0,0,0,0,0,0|4,0,0]=4 601 B10R1.25 [13CH3]Sc1ccc(cc1F)Br 62a_200025704644_100009814013 [0,0,0,0,0,0|4,0,0]=4 602 B10R1.25 [13CH3]Sc1ccc(cc1F)Cl 62a_100011216042_200025704644 [0,0,0,0,0,0|4,0,0]=4 603 B10R1.25 [13CH3]Sc1ccc(cc1F)Cl 62a_200025704644_100011216042 [0,0,0,0,0,0|4,0,0]=4 604 B10R1.25 [13CH3]Sc1ccc(cc1F)F 62a_100000750030_200025704644 [0,0,0,0,0,0|4,0,0]=4 605 B10R1.25 [13CH3]Sc1ccc(cc1F)F 62a_200025704644_100000750030 [0,0,0,0,0,0|4,0,0]=4 606 B10R1.25 [13CH3]Sc1ccc(cc1F)N 62a_100011356925_200025704644 [0,0,0,0,0,0|4,0,0]=4 607 B10R1.25 [13CH3]Sc1ccc(cc1F)N 62a_200025704644_100011356925 [0,0,0,0,0,0|4,0,0]=4 608 B10R1.25 [13CH3]Sc1ccc(cc1F)O 62a_100000755031_200025704644 [0,0,0,0,0,0|4,0,0]=4 609 B10R1.25 [13CH3]Sc1ccc(cc1F)O 62a_200025704644_100000755031 [0,0,0,0,0,0|4,0,0]=4 610 B10R1.25 [13CH3]Sc1ccc(cc1N)Br 62a_100000743836_200025704644 [0,0,0,0,0,0|4,0,0]=4 611 B10R1.25 [13CH3]Sc1ccc(cc1N)Br 62a_200025704644_100000743836 [0,0,0,0,0,0|4,0,0]=4 612 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_100000761886_200025704644 [0,0,0,0,0,0|4,0,0]=4 613 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_200025704644_100000761886 [0,0,0,0,0,0|4,0,0]=4 614 B10R1.25 [13CH3]Sc1ccc(cc1N)F 62a_100000687223_200025704644 [0,0,0,0,0,0|4,0,0]=4 615 B10R1.25 [13CH3]Sc1ccc(cc1N)F 62a_200025704644_100000687223 [0,0,0,0,0,0|4,0,0]=4 616 B10R1.25 [13CH3]Sc1ccc(cc1N)N 62a_200012175722_200025704644 [0,0,0,0,0,0|4,0,0]=4 617 B10R1.25 [13CH3]Sc1ccc(cc1N)N 62a_200025704644_200012175722 [0,0,0,0,0,0|4,0,0]=4 618 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_100011999798_200025704644 [0,0,0,0,0,0|4,0,0]=4 619 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_200025704644_100011999798 [0,0,0,0,0,0|4,0,0]=4 620 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_100012344904_200025704644 [0,0,0,0,0,0|3,0,0]=3 621 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_200025704644_100012344904 [0,0,0,0,0,0|3,0,0]=3 622 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_100000050036_200025704644 [0,0,0,0,0,0|3,0,0]=3 623 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_200025704644_100000050036 [0,0,0,0,0,0|3,0,0]=3 624 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_100000690578_200025704644 [0,0,0,0,0,0|3,0,0]=3 625 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_200025704644_100000690578 [0,0,0,0,0,0|3,0,0]=3 626 B10R1.25 [13CH3]Sc1ccc(cc1O)O 62a_200025704644_100009813921 [0,0,0,0,0,0|3,0,0]=3 627 B10R1.25 [13CH3]Sc1ncc(cc1O)Br 62a_100010210634_200025704644 [0,0,0,0,0,0|4,0,0]=4 628 B10R1.25 [13CH3]Sc1ncc(cc1O)Br 62a_200025704644_100010210634 [0,0,0,0,0,0|4,0,0]=4 629 B10R1.25 [13CH3]Sc1ncc(cc1O)Cl 62a_100010233512_200025704644 [0,0,0,0,0,0|4,0,0]=4 630 B10R1.25 [13CH3]Sc1ncc(cc1O)Cl 62a_200025704644_100010233512 [0,0,0,0,0,0|4,0,0]=4 631 B10R1.25 [13CH3]Sc1ncc(cc1O)F 62a_100009820119_200025704644 [0,0,0,0,0,0|4,0,0]=4 632 B10R1.25 [13CH3]Sc1ncc(cc1O)F 62a_200025704644_100000079967 [0,0,0,0,0,0|4,0,0]=4 633 B9R1.1 C=Cc1cc[n+](cc1)[O-] 271570a_100011290941_100000039755 [1,0,0,0,0,0|3,0,0]=4 634 B9R1.1 C=Cc1ccc(=O)[nH]c1 271570a_100011290941_100000212171 [1,0,0,0,0,0|3,0,0]=4 635 B9R1.1 C=Cc1ccc(cc1)Br 271570a_100011290941_100000752885 [1,0,0,0,0,0|2,0,0]=3 636 B9R1.1 C=Cc1ccc(cc1)C 271570a_100011290941_100000186775 [1,0,0,0,0,0|1,0,0]=2 637 B9R1.1 C=Cc1ccc(cc1)Cl 271570a_100011290941_100000755918 [1,0,0,0,0,0|2,0,0]=3 638 B9R1.1 C=Cc1ccc(cc1)F 271570a_100011290941_100000211213 [1,0,0,0,0,0|2,0,0]=3 639 B9R1.1 C=Cc1ccc(cc1)N 271570a_100011290941_100000185761 [1,0,0,0,0,0|2,0,0]=3 640 B9R1.1 C=Cc1ccc(cc1)O 271570a_100011290941_100000185759 [1,0,0,0,0,0|2,0,0]=3 641 B9R1.1 C=Cc1ccc(cn1)Br 271570a_100011290941_100000686858 [1,0,0,0,0,0|3,0,0]=4 642 B9R1.1 C=Cc1ccc(cn1)C 271570a_100011290941_100000754016 [1,0,0,0,0,0|2,0,0]=3 643 B9R1.1 C=Cc1ccc(cn1)Cl 271570a_100011290941_100011356976 [1,0,0,0,0,0|3,0,0]=4 644 B9R1.1 C=Cc1ccc(cn1)F 271570a_100011290941_100000744514 [1,0,0,0,0,0|3,0,0]=4 645 B9R1.1 C=Cc1ccc(cn1)N 271570a_100011290941_100000744251 [1,0,0,0,0,0|3,0,0]=4 646 B9R1.1 C=Cc1ccc(cn1)O 271570a_100011290941_100000685995 [1,0,0,0,0,0|3,0,0]=4 647 B9R1.1 C=Cc1ccc(nc1)Br 271570a_100011290941_100009814638 [1,0,0,0,0,0|3,0,0]=4 648 B9R1.1 C=Cc1ccc(nc1)C 271570a_100011290941_100000751577 [1,0,0,0,0,0|2,0,0]=3 649 B9R1.1 C=Cc1ccc(nc1)Cl 271570a_100011290941_100000034144 [1,0,0,0,0,0|3,0,0]=4 650 B9R1.1 C=Cc1ccc(nc1)F 271570a_100011290941_100000748661 [1,0,0,0,0,0|3,0,0]=4 651 B9R1.1 C=Cc1ccc(nc1)N 271570a_100011290941_100000187370 [1,0,0,0,0,0|3,0,0]=4 652 B9R1.1 C=Cc1ccc(nn1)C 271570a_100011290941_100011450037 [1,0,0,0,0,0|3,0,0]=4 653 B9R1.1 C=Cc1cnc(cn1)C 271570a_100011290941_100011999403 [1,0,0,0,0,0|3,0,0]=4 654 B9R1.1 C=Cc1cnc(nc1)C 271570a_100011290941_100000686985 [1,0,0,0,0,0|3,0,0]=4 655 B9R1.1 C=Cc1ncc(cn1)C 271570a_100011290941_100011825175 [1,0,0,0,0,0|3,0,0]=4 656 B9R1.1 CCc1ccc(cc1)O 271570a_203496583355_100011215824 [1,0,0,0,0,0|2,0,1]=4 657 B9R1.1 CNc1ccc(cc1)Br 2230a_100000210018_200000210301 [1,0,0,0,0,0|3,0,0]=4 658 B9R1.1 CNc1ccc(cc1)Br 34a_100000210018_200000210301 [1,0,0,0,0,0|3,0,0]=4 659 B9R1.1 CNc1ccc(cc1)C 34a_100000124888_200000210301 [1,0,0,0,0,0|2,0,0]=3 660 B9R1.1 CNc1ccc(cc1)Cl 2230a_100000210052_200000210301 [1,0,0,0,0,0|3,0,0]=4 661 B9R1.1 CNc1ccc(cc1)Cl 34a_100000210052_200000210301 [1,0,0,0,0,0|3,0,0]=4 662 B9R1.1 CNc1ccc(cc1)F 34a_100000185862_200000210301 [1,0,0,0,0,0|3,0,0]=4 663 B9R1.1 CNc1ccc(cc1)I 34a_100000185761_200000210301 [1,0,0,0,0,0|3,0,0]=4 664 B9R1.1 CNc1ccc(cc1)O 271570a_203496583355_100000219623 [1,0,0,0,0,0|3,0,0]=4 665 B9R1.1 CNc1ccc(cc1)O 34a_100000185829_200000210301 [1,0,0,0,0,0|3,0,0]=4 666 B9R1.1 COc1ccc(cc1)Br 34a_100000185759_200000210301 [1,0,0,0,0,0|3,0,0]=4 667 B9R1.1 COc1ccc(cc1)Br 7a_100000185759_200000210301 [1,0,0,0,0,0|3,0,0]=4 668 B9R1.1 COc1ccc(cc1)C 34a_100000210336_200000210301 [1,0,0,0,0,0|2,0,0]=3 669 B9R1.1 COc1ccc(cc1)C 7a_100000210336_200000210301 [1,0,0,0,0,0|2,0,0]=3 670 B9R1.1 COc1ccc(cc1)Cl 34a_100000210216_200000210301 [1,0,0,0,0,0|3,0,0]=4 671 B9R1.1 COc1ccc(cc1)Cl 7a_100000210216_200000210301 [1,0,0,0,0,0|3,0,0]=4 672 B9R1.1 COc1ccc(cc1)F 34a_100000210339_200000210301 [1,0,0,0,0,0|3,0,0]=4 673 B9R1.1 COc1ccc(cc1)I 34a_100000212066_200000210301 [1,0,0,0,0,0|3,0,0]=4 674 B9R1.1 COc1ccc(cc1)I 7a_100000212066_200000210301 [1,0,0,0,0,0|3,0,0]=4 675 B9R1.1 COc1ccc(cc1)N 34a_100000185829_200000210301 [1,0,0,0,0,0|3,0,0]=4 676 B9R1.1 COc1ccc(cc1)O 271570a_203496583355_100000171711 [1,0,0,0,0,0|3,0,0]=4 677 B9R1.1 COc1ccc(cn1)C 34a_100000759353_200000210301 [1,0,0,0,0,0|3,0,0]=4 678 B9R1.1 COc1ccc(nc1)C 34a_100000745506_200000210301 [1,0,0,0,0,0|3,0,0]=4 679 B9R1.1 COc1ccc(nc1)C 7a_100000745506_200000210301 [1,0,0,0,0,0|3,0,0]=4 680 B9R1.1 CSc1ccc(cc1)Br 62a_100000752885_200000210301 [1,0,0,0,0,0|3,0,0]=4 681 B9R1.1 CSc1ccc(cc1)Br 62a_200000210301_100000752885 [1,0,0,0,0,0|3,0,0]=4 682 B9R1.1 CSc1ccc(cc1)C 62a_100000186775_200000210301 [1,0,0,0,0,0|2,0,0]=3 683 B9R1.1 CSc1ccc(cc1)C 62a_200000210301_100000186775 [1,0,0,0,0,0|2,0,0]=3 684 B9R1.1 CSc1ccc(cc1)Cl 62a_100000755918_200000210301 [1,0,0,0,0,0|3,0,0]=4 685 B9R1.1 CSc1ccc(cc1)Cl 62a_200000210301_100000755918 [1,0,0,0,0,0|3,0,0]=4 686 B9R1.1 CSc1ccc(cc1)F 62a_100000211213_200000210301 [1,0,0,0,0,0|3,0,0]=4 687 B9R1.1 CSc1ccc(cc1)F 62a_200000210301_100000211213 [1,0,0,0,0,0|3,0,0]=4 688 B9R1.1 CSc1ccc(cc1)N 62a_100000185761_200000210301 [1,0,0,0,0,0|3,0,0]=4 689 B9R1.1 CSc1ccc(cc1)N 62a_200000210301_100000185761 [1,0,0,0,0,0|3,0,0]=4 690 B9R1.1 CSc1ccc(cc1)O 271570a_203496583355_100011263217 [1,0,0,0,0,0|3,0,0]=4 691 B9R1.1 CSc1ccc(cc1)O 62a_200000210301_100000185759 [1,0,0,0,0,0|3,0,0]=4 692 B9R1.1 CSc1ccc(cn1)C 62a_100011192072_200000210301 [1,0,0,0,0,0|3,0,0]=4 693 B9R1.1 CSc1ccc(cn1)C 62a_200000210301_100000754016 [1,0,0,0,0,0|3,0,0]=4 694 B9R1.1 CSc1ccc(nc1)C 62a_100000751577_200000210301 [1,0,0,0,0,0|3,0,0]=4 695 B9R1.1 CSc1ccc(nc1)C 62a_200000210301_100000751577 [1,0,0,0,0,0|3,0,0]=4 696 B9R1.1 Cc1ccc(cc1)N[13CH3] 34a_100000124888_200025704644 [1,0,0,0,0,0|2,0,0]=3 697 B9R1.1 Cc1ccc(cc1)O[13CH3] 34a_100000210336_200025704644 [1,0,0,0,0,0|2,0,0]=3 698 B9R1.1 Cc1ccc(cc1)O[13CH3] 7a_100000210336_200025704644 [1,0,0,0,0,0|2,0,0]=3 699 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_100000186775_200025704644 [1,0,0,0,0,0|2,0,0]=3 700 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000186775 [1,0,0,0,0,0|2,0,0]=3 701 B9R1.1 Cc1ccc(cn1)O[13CH3] 34a_100000745506_200025704644 [1,0,0,0,0,0|3,0,0]=4 702 B9R1.1 Cc1ccc(cn1)O[13CH3] 7a_100000745506_200025704644 [1,0,0,0,0,0|3,0,0]=4 703 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_100000751577_200025704644 [1,0,0,0,0,0|3,0,0]=4 704 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_200025704644_100000751577 [1,0,0,0,0,0|3,0,0]=4 705 B9R1.1 Cc1ccc(nc1)O[13CH3] 34a_100000759353_200025704644 [1,0,0,0,0,0|3,0,0]=4 706 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_100011192072_200025704644 [1,0,0,0,0,0|3,0,0]=4 707 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_200025704644_100000754016 [1,0,0,0,0,0|3,0,0]=4 708 B9R1.1 N#Cc1ccc(cc1)O 271570a_203496583355_100000179745 [1,0,0,0,0,0|2,0,1]=4 709 B9R1.1 NCc1ccc(cc1)O 271570a_203496583355_100016989417 [1,0,0,0,0,0|2,0,1]=4 710 B9R1.1 NNc1ccc(cc1)O 271570a_203496583355_100016988836 [1,0,0,0,0,0|3,0,0]=4 711 B9R1.1 O=Cc1ccc(cc1)O 271570a_203496583355_100000186029 [1,0,0,0,0,0|1,0,0]=2 712 B9R1.1 O=Cc1ccc(cn1)O 271570a_203496583355_100000754260 [1,0,0,0,0,0|2,0,0]=3 713 B9R1.1 O=Cc1ccc(nc1)O 271570a_203496583355_100000766901 [1,0,0,0,0,0|2,0,0]=3 714 B9R1.1 O=Cc1ccc(nn1)O 271570a_203496583355_100000044651 [1,0,0,0,0,0|3,0,0]=4 715 B9R1.1 O=Cc1cnc(cn1)O 271570a_203496583355_100012001714 [1,0,0,0,0,0|3,0,0]=4 716 B9R1.1 O=Cc1cnc(nc1)O 271570a_203496583355_100000070856 [1,0,0,0,0,0|3,0,0]=4 717 B9R1.1 OCc1ccc(cc1)O 271570a_203496583355_100000690907 [1,0,0,0,0,0|1,0,2]=4 718 B9R1.1 Oc1ccc(cc1)CF 271570a_203496583355_100010268989 [1,0,0,0,0,0|2,0,1]=4 719 B9R1.1 [13CH3]Nc1ccc(cc1)Br 2230a_100000210018_200025704644 [1,0,0,0,0,0|3,0,0]=4 720 B9R1.1 [13CH3]Nc1ccc(cc1)Br 34a_100000210018_200025704644 [1,0,0,0,0,0|3,0,0]=4 721 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 2230a_100000210052_200025704644 [1,0,0,0,0,0|3,0,0]=4 722 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 34a_100000210052_200025704644 [1,0,0,0,0,0|3,0,0]=4 723 B9R1.1 [13CH3]Nc1ccc(cc1)F 34a_100000185862_200025704644 [1,0,0,0,0,0|3,0,0]=4 724 B9R1.1 [13CH3]Nc1ccc(cc1)I 34a_100000185761_200025704644 [1,0,0,0,0,0|3,0,0]=4 725 B9R1.1 [13CH3]Nc1ccc(cc1)O 34a_100000185829_200025704644 [1,0,0,0,0,0|3,0,0]=4 726 B9R1.1 [13CH3]Oc1ccc(cc1)Br 34a_100000185759_200025704644 [1,0,0,0,0,0|3,0,0]=4 727 B9R1.1 [13CH3]Oc1ccc(cc1)Br 7a_100000185759_200025704644 [1,0,0,0,0,0|3,0,0]=4 728 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 34a_100000210216_200025704644 [1,0,0,0,0,0|3,0,0]=4 729 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 7a_100000210216_200025704644 [1,0,0,0,0,0|3,0,0]=4 730 B9R1.1 [13CH3]Oc1ccc(cc1)F 34a_100000210339_200025704644 [1,0,0,0,0,0|3,0,0]=4 731 B9R1.1 [13CH3]Oc1ccc(cc1)I 34a_100000212066_200025704644 [1,0,0,0,0,0|3,0,0]=4 732 B9R1.1 [13CH3]Oc1ccc(cc1)I 7a_100000212066_200025704644 [1,0,0,0,0,0|3,0,0]=4 733 B9R1.1 [13CH3]Oc1ccc(cc1)N 34a_100000185829_200025704644 [1,0,0,0,0,0|3,0,0]=4 734 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_100000752885_200025704644 [1,0,0,0,0,0|3,0,0]=4 735 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_200025704644_100000752885 [1,0,0,0,0,0|3,0,0]=4 736 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_100000755918_200025704644 [1,0,0,0,0,0|3,0,0]=4 737 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_200025704644_100000755918 [1,0,0,0,0,0|3,0,0]=4 738 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_100000211213_200025704644 [1,0,0,0,0,0|3,0,0]=4 739 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_200025704644_100000211213 [1,0,0,0,0,0|3,0,0]=4 740 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_100000185761_200025704644 [1,0,0,0,0,0|3,0,0]=4 741 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_200025704644_100000185761 [1,0,0,0,0,0|3,0,0]=4 742 B9R1.1 [13CH3]Sc1ccc(cc1)O 62a_200025704644_100000185759 [1,0,0,0,0,0|3,0,0]=4 743 B9R1.15 C=Cc1c[nH]ccc1=O 271570a_100011290941_100009998708 [1,0,0,0,0,0|2,0,1]=4 744 B9R1.15 C=Cc1c[nH]ccc1=S 271570a_100011290941_200012280681 [1,0,0,0,0,0|2,1,0]=4 745 B9R1.15 C=Cc1ccc[nH]c1=O 271570a_100011290941_100000050042 [1,0,0,0,0,0|2,0,1]=4 746 B9R1.15 C=Cc1cccc[n+]1C 271570a_100011290941_100000212160 [1,0,0,0,0,0|3,0,0]=4 747 B9R1.15 C=Cc1cccc[n+]1[O-] 271570a_100011290941_200000042595 [1,0,0,0,0,0|2,0,1]=4 748 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [1,0,0,0,0,0|2,0,0]=3 749 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [1,0,0,0,0,0|2,0,0]=3 750 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [1,0,0,0,0,0|2,0,0]=3 751 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [1,0,0,0,0,0|2,0,0]=3 752 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [1,0,0,0,0,0|2,0,0]=3 753 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [1,0,0,0,0,0|1,0,0]=2 754 B9R1.15 C=Cc1cccnc1Br 271570a_100011290941_100010202626 [1,0,0,0,0,0|3,0,0]=4 755 B9R1.15 C=Cc1cccnc1C 271570a_100011290941_100000751574 [1,0,0,0,0,0|3,0,0]=4 756 B9R1.15 C=Cc1cccnc1Cl 271570a_100011290941_100000036424 [1,0,0,0,0,0|3,0,0]=4 757 B9R1.15 C=Cc1cccnc1F 271570a_100011290941_100009816115 [1,0,0,0,0,0|3,0,0]=4 758 B9R1.15 C=Cc1cccnc1N 271570a_100011290941_100000045569 [1,0,0,0,0,0|3,0,0]=4 759 B9R1.15 C=Cc1ccncc1Br 271570a_100011290941_100000726257 [1,0,0,0,0,0|3,0,0]=4 760 B9R1.15 C=Cc1ccncc1C 271570a_100011290941_100015191297 [1,0,0,0,0,0|3,0,0]=4 761 B9R1.15 C=Cc1ccncc1Cl 271570a_100011290941_100000708259 [1,0,0,0,0,0|3,0,0]=4 762 B9R1.15 C=Cc1ccncc1F 271570a_100011290941_100000047030 [1,0,0,0,0,0|3,0,0]=4 763 B9R1.15 C=Cc1ccncc1N 271570a_100011290941_100009815883 [1,0,0,0,0,0|3,0,0]=4 764 B9R1.15 C=Cc1ccncc1O 271570a_100011290941_100009817591 [1,0,0,0,0,0|2,0,0]=3 765 B9R1.15 C=Cc1cnccc1Br 271570a_100011290941_100010138639 [1,0,0,0,0,0|3,0,0]=4 766 B9R1.15 C=Cc1cnccc1C 271570a_100011290941_100000761580 [1,0,0,0,0,0|3,0,0]=4 767 B9R1.15 C=Cc1cnccc1Cl 271570a_100011290941_100009995489 [1,0,0,0,0,0|3,0,0]=4 768 B9R1.15 C=Cc1cnccc1F 271570a_100011290941_100009820683 [1,0,0,0,0,0|3,0,0]=4 769 B9R1.15 C=Cc1cnccc1N 271570a_100011290941_100000047001 [1,0,0,0,0,0|3,0,0]=4 770 B9R1.15 C=Cc1cncnc1O 271570a_100011290941_100000751107 [1,0,0,0,0,0|3,0,0]=4 771 B9R1.15 C=Cc1ncccc1Br 271570a_100011290941_100000696092 [1,0,0,0,0,0|3,0,0]=4 772 B9R1.15 C=Cc1ncccc1C 271570a_100011290941_100000751373 [1,0,0,0,0,0|3,0,0]=4 773 B9R1.15 C=Cc1ncccc1Cl 271570a_100011290941_100011356963 [1,0,0,0,0,0|3,0,0]=4 774 B9R1.15 C=Cc1ncccc1F 271570a_100011290941_100000685392 [1,0,0,0,0,0|3,0,0]=4 775 B9R1.15 C=Cc1ncccc1N 271570a_100011290941_100000688686 [1,0,0,0,0,0|3,0,0]=4 776 B9R1.15 C=Cc1ncccc1O 271570a_100011290941_100000034122 [1,0,0,0,0,0|2,0,0]=3 777 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [1,0,0,0,0,0|1,0,1]=3 778 B9R1.15 CCc1ccncc1O 271570a_203496583355_100009819861 [1,0,0,0,0,0|2,0,1]=4 779 B9R1.15 CCc1cnccc1O 271570a_203496583355_100025704421 [1,0,0,0,0,0|2,0,1]=4 780 B9R1.15 CCc1ncccc1O 271570a_203496583355_100009877225 [1,0,0,0,0,0|2,0,1]=4 781 B9R1.15 CNc1ccccc1Br 34a_100000210017_200000210301 [1,0,0,0,0,0|3,0,0]=4 782 B9R1.15 CNc1ccccc1C 34a_100015192222_200000210301 [1,0,0,0,0,0|3,0,0]=4 783 B9R1.15 CNc1ccccc1Cl 34a_100000185783_200000210301 [1,0,0,0,0,0|3,0,0]=4 784 B9R1.15 CNc1ccccc1F 34a_100000210422_200000210301 [1,0,0,0,0,0|3,0,0]=4 785 B9R1.15 CNc1ccccc1I 34a_100000210053_200000210301 [1,0,0,0,0,0|3,0,0]=4 786 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [1,0,0,0,0,0|2,0,0]=3 787 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [1,0,0,0,0,0|2,0,0]=3 788 B9R1.15 CNc1cccnc1O 271570a_203496583355_200011806188 [1,0,0,0,0,0|3,0,0]=4 789 B9R1.15 CNc1ccncc1O 271570a_203496583355_100010069531 [1,0,0,0,0,0|3,0,0]=4 790 B9R1.15 CNc1ncccc1O 271570a_203496583355_100000700899 [1,0,0,0,0,0|3,0,0]=4 791 B9R1.15 COc1ccccc1Br 34a_100000181306_200000210301 [1,0,0,0,0,0|3,0,0]=4 792 B9R1.15 COc1ccccc1Br 7a_100000181306_200000210301 [1,0,0,0,0,0|3,0,0]=4 793 B9R1.15 COc1ccccc1C 34a_100000210338_200000210301 [1,0,0,0,0,0|3,0,0]=4 794 B9R1.15 COc1ccccc1C 7a_100000210338_200000210301 [1,0,0,0,0,0|3,0,0]=4 795 B9R1.15 COc1ccccc1Cl 34a_100000210172_200000210301 [1,0,0,0,0,0|3,0,0]=4 796 B9R1.15 COc1ccccc1Cl 7a_100000210172_200000210301 [1,0,0,0,0,0|3,0,0]=4 797 B9R1.15 COc1ccccc1F 34a_100000210171_200000210301 [1,0,0,0,0,0|3,0,0]=4 798 B9R1.15 COc1ccccc1F 7a_100000210171_200000210301 [1,0,0,0,0,0|3,0,0]=4 799 B9R1.15 COc1ccccc1I 34a_100000739446_200000210301 [1,0,0,0,0,0|3,0,0]=4 800 B9R1.15 COc1ccccc1I 7a_100000739446_200000210301 [1,0,0,0,0,0|3,0,0]=4 801 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [1,0,0,0,0,0|3,0,0]=4 802 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [1,0,0,0,0,0|3,0,0]=4 803 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [1,0,0,0,0,0|2,0,0]=3 804 B9R1.15 COc1cccnc1O 271570a_203496583355_100000690851 [1,0,0,0,0,0|3,0,0]=4 805 B9R1.15 COc1ccncc1O 271570a_203496583355_100011997281 [1,0,0,0,0,0|3,0,0]=4 806 B9R1.15 COc1cnccc1O 271570a_203496583355_100016988167 [1,0,0,0,0,0|3,0,0]=4 807 B9R1.15 COc1ncccc1O 271570a_203496583355_100000047025 [1,0,0,0,0,0|3,0,0]=4 808 B9R1.15 CSc1ccccc1Br 62a_100000695589_200000210301 [1,0,0,0,0,0|3,0,0]=4 809 B9R1.15 CSc1ccccc1Br 62a_200000210301_100000695589 [1,0,0,0,0,0|3,0,0]=4 810 B9R1.15 CSc1ccccc1C 62a_100000210755_200000210301 [1,0,0,0,0,0|3,0,0]=4 811 B9R1.15 CSc1ccccc1C 62a_200000210301_100000210755 [1,0,0,0,0,0|3,0,0]=4 812 B9R1.15 CSc1ccccc1Cl 62a_100000764095_200000210301 [1,0,0,0,0,0|3,0,0]=4 813 B9R1.15 CSc1ccccc1Cl 62a_200000210301_100000764095 [1,0,0,0,0,0|3,0,0]=4 814 B9R1.15 CSc1ccccc1F 62a_100011215700_200000210301 [1,0,0,0,0,0|3,0,0]=4 815 B9R1.15 CSc1ccccc1F 62a_200000210301_100011215700 [1,0,0,0,0,0|3,0,0]=4 816 B9R1.15 CSc1ccccc1N 62a_100000210017_200000210301 [1,0,0,0,0,0|3,0,0]=4 817 B9R1.15 CSc1ccccc1N 62a_200000210301_100000210017 [1,0,0,0,0,0|3,0,0]=4 818 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [1,0,0,0,0,0|2,0,0]=3 819 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [1,0,0,0,0,0|2,0,0]=3 820 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [1,0,0,0,0,0|2,0,0]=3 821 B9R1.15 CSc1cccnc1O 62a_100000760158_200000210301 [1,0,0,0,0,0|3,0,0]=4 822 B9R1.15 CSc1cccnc1O 62a_200000210301_100000760158 [1,0,0,0,0,0|3,0,0]=4 823 B9R1.15 CSc1ccncc1O 62a_100009817591_200000210301 [1,0,0,0,0,0|3,0,0]=4 824 B9R1.15 CSc1ccncc1O 62a_200000210301_100009817591 [1,0,0,0,0,0|3,0,0]=4 825 B9R1.15 CSc1ncccc1O 271570a_203496583355_100011465278 [1,0,0,0,0,0|3,0,0]=4 826 B9R1.15 CSc1ncccc1O 62a_100000034122_200000210301 [1,0,0,0,0,0|3,0,0]=4 827 B9R1.15 CSc1ncccc1O 62a_200000210301_100000034122 [1,0,0,0,0,0|3,0,0]=4 828 B9R1.15 Cc1ccccc1N[13CH3] 34a_100015192222_200025704644 [1,0,0,0,0,0|3,0,0]=4 829 B9R1.15 Cc1ccccc1O[13CH3] 34a_100000210338_200025704644 [1,0,0,0,0,0|3,0,0]=4 830 B9R1.15 Cc1ccccc1O[13CH3] 7a_100000210338_200025704644 [1,0,0,0,0,0|3,0,0]=4 831 B9R1.15 Cc1ccccc1S[13CH3] 62a_100000210755_200025704644 [1,0,0,0,0,0|3,0,0]=4 832 B9R1.15 Cc1ccccc1S[13CH3] 62a_200025704644_100000210755 [1,0,0,0,0,0|3,0,0]=4 833 B9R1.15 N#Cc1ccccc1O 271570a_203496583355_100000188569 [1,0,0,0,0,0|1,0,1]=3 834 B9R1.15 N#Cc1cccnc1O 271570a_203496583355_100000211984 [1,0,0,0,0,0|2,0,1]=4 835 B9R1.15 N#Cc1ccncc1O 271570a_203496583355_100000684818 [1,0,0,0,0,0|2,0,1]=4 836 B9R1.15 N#Cc1cnccc1O 271570a_203496583355_100000687039 [1,0,0,0,0,0|2,0,1]=4 837 B9R1.15 N#Cc1ncccc1O 271570a_203496583355_100000685805 [1,0,0,0,0,0|2,0,1]=4 838 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [1,0,0,0,0,0|1,0,1]=3 839 B9R1.15 NCc1cccnc1O 271570a_203496583355_100015189234 [1,0,0,0,0,0|2,0,1]=4 840 B9R1.15 NCc1ccncc1O 271570a_203496583355_100020640021 [1,0,0,0,0,0|2,0,1]=4 841 B9R1.15 NCc1ncccc1O 271570a_203496583355_100020591323 [1,0,0,0,0,0|2,0,1]=4 842 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [1,0,0,0,0,0|2,0,0]=3 843 B9R1.15 NNc1ccncc1O 271570a_203496583355_100013404636 [1,0,0,0,0,0|3,0,0]=4 844 B9R1.15 NNc1ncccc1O 271570a_203496583355_100011464834 [1,0,0,0,0,0|3,0,0]=4 845 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [1,0,0,0,0,0|0,0,0]=1 846 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [1,0,0,0,0,0|1,0,0]=2 847 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [1,0,0,0,0,0|1,0,0]=2 848 B9R1.15 O=Cc1cnccc1O 271570a_203496583355_100000050567 [1,0,0,0,0,0|1,0,0]=2 849 B9R1.15 O=Cc1ncccc1O 271570a_203496583355_100011934733 [1,0,0,0,0,0|1,0,0]=2 850 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [1,0,0,0,0,0|0,0,2]=3 851 B9R1.15 OCc1cccnc1O 271570a_203496583355_100000748726 [1,0,0,0,0,0|1,0,2]=4 852 B9R1.15 OCc1ccncc1O 271570a_203496583355_100009873359 [1,0,0,0,0,0|1,0,2]=4 853 B9R1.15 OCc1cnccc1O 271570a_203496583355_100000117392 [1,0,0,0,0,0|1,0,2]=4 854 B9R1.15 OCc1ncccc1O 271570a_203496583355_100011996772 [1,0,0,0,0,0|1,0,2]=4 855 B9R1.15 [13CH3]Nc1ccccc1Br 34a_100000210017_200025704644 [1,0,0,0,0,0|3,0,0]=4 856 B9R1.15 [13CH3]Nc1ccccc1Cl 34a_100000185783_200025704644 [1,0,0,0,0,0|3,0,0]=4 857 B9R1.15 [13CH3]Nc1ccccc1F 34a_100000210422_200025704644 [1,0,0,0,0,0|3,0,0]=4 858 B9R1.15 [13CH3]Nc1ccccc1I 34a_100000210053_200025704644 [1,0,0,0,0,0|3,0,0]=4 859 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [1,0,0,0,0,0|2,0,0]=3 860 B9R1.15 [13CH3]Oc1ccccc1Br 34a_100000181306_200025704644 [1,0,0,0,0,0|3,0,0]=4 861 B9R1.15 [13CH3]Oc1ccccc1Br 7a_100000181306_200025704644 [1,0,0,0,0,0|3,0,0]=4 862 B9R1.15 [13CH3]Oc1ccccc1Cl 34a_100000210172_200025704644 [1,0,0,0,0,0|3,0,0]=4 863 B9R1.15 [13CH3]Oc1ccccc1Cl 7a_100000210172_200025704644 [1,0,0,0,0,0|3,0,0]=4 864 B9R1.15 [13CH3]Oc1ccccc1F 34a_100000210171_200025704644 [1,0,0,0,0,0|3,0,0]=4 865 B9R1.15 [13CH3]Oc1ccccc1F 7a_100000210171_200025704644 [1,0,0,0,0,0|3,0,0]=4 866 B9R1.15 [13CH3]Oc1ccccc1I 34a_100000739446_200025704644 [1,0,0,0,0,0|3,0,0]=4 867 B9R1.15 [13CH3]Oc1ccccc1I 7a_100000739446_200025704644 [1,0,0,0,0,0|3,0,0]=4 868 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [1,0,0,0,0,0|3,0,0]=4 869 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [1,0,0,0,0,0|3,0,0]=4 870 B9R1.15 [13CH3]Sc1ccccc1Br 62a_100000695589_200025704644 [1,0,0,0,0,0|3,0,0]=4 871 B9R1.15 [13CH3]Sc1ccccc1Br 62a_200025704644_100000695589 [1,0,0,0,0,0|3,0,0]=4 872 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_100000764095_200025704644 [1,0,0,0,0,0|3,0,0]=4 873 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_200025704644_100000764095 [1,0,0,0,0,0|3,0,0]=4 874 B9R1.15 [13CH3]Sc1ccccc1F 62a_100011215700_200025704644 [1,0,0,0,0,0|3,0,0]=4 875 B9R1.15 [13CH3]Sc1ccccc1F 62a_200025704644_100011215700 [1,0,0,0,0,0|3,0,0]=4 876 B9R1.15 [13CH3]Sc1ccccc1N 62a_100000210017_200025704644 [1,0,0,0,0,0|3,0,0]=4 877 B9R1.15 [13CH3]Sc1ccccc1N 62a_200025704644_100000210017 [1,0,0,0,0,0|3,0,0]=4 878 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [1,0,0,0,0,0|2,0,0]=3 879 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [1,0,0,0,0,0|2,0,0]=3 880 B9R1.15 [13CH3]Sc1cccnc1O 62a_100000760158_200025704644 [1,0,0,0,0,0|3,0,0]=4 881 B9R1.15 [13CH3]Sc1cccnc1O 62a_200025704644_100000760158 [1,0,0,0,0,0|3,0,0]=4 882 B9R1.15 [13CH3]Sc1ccncc1O 62a_100009817591_200025704644 [1,0,0,0,0,0|3,0,0]=4 883 B9R1.15 [13CH3]Sc1ccncc1O 62a_200025704644_100009817591 [1,0,0,0,0,0|3,0,0]=4 884 B9R1.15 [13CH3]Sc1ncccc1O 62a_100000034122_200025704644 [1,0,0,0,0,0|3,0,0]=4 885 B9R1.15 [13CH3]Sc1ncccc1O 62a_200025704644_100000034122 [1,0,0,0,0,0|3,0,0]=4 886 B9R1.69 Cc1c[nH]c(=O)c(n1)O 271570a_203496583355_100009858157 [1,0,0,0,0,0|2,0,0]=3 887 B9R1.69 Cc1cc(c(=O)[nH]n1)O 271570a_203496583355_100009819039 [1,0,0,0,0,0|2,0,0]=3 888 B9R1.69 Cc1cc(c(cn1)C)O 271570a_203496583355_100009862788 [1,0,0,0,0,0|1,0,1]=3 889 B9R1.69 Cc1cc(c(cn1)F)O 271570a_203496583355_100009867690 [1,0,0,0,0,0|2,0,0]=3 890 B9R1.69 Cc1cc(c(cn1)O)C 271570a_203496583355_100009819613 [1,0,0,0,0,0|2,0,1]=4 891 B9R1.69 Cc1cc(c(cn1)O)N 271570a_203496583355_100009817891 [1,0,0,0,0,0|2,0,1]=4 892 B9R1.69 Cc1cc(c(cn1)O)O 271570a_203496583355_100009843476 [1,0,0,0,0,0|1,0,1]=3 893 B9R1.69 Cc1cc(c(cn1)O)O 271570a_203496583355_100011016184 [1,0,0,0,0,0|1,0,1]=3 894 B9R1.69 Cc1cc(ccc1Br)O 271570a_203496583355_100009813585 [1,0,0,0,0,0|3,0,0]=4 895 B9R1.69 Cc1cc(ccc1Cl)O 271570a_203496583355_100000049509 [1,0,0,0,0,0|3,0,0]=4 896 B9R1.69 Cc1cc(ccc1F)O 271570a_203496583355_100011218330 [1,0,0,0,0,0|3,0,0]=4 897 B9R1.69 Cc1cc(ccc1N)O 271570a_203496583355_100000211769 [1,0,0,0,0,0|3,0,0]=4 898 B9R1.69 Cc1cc(ccc1O)Br 271570a_203496583355_100000701812 [1,0,0,0,0,0|2,0,1]=4 899 B9R1.69 Cc1cc(ccc1O)Cl 271570a_203496583355_100011219607 [1,0,0,0,0,0|2,0,1]=4 900 B9R1.69 Cc1cc(ccc1O)F 271570a_203496583355_100011205405 [1,0,0,0,0,0|2,0,1]=4 901 B9R1.69 Cc1cc(ccc1O)N 271570a_203496583355_100000210723 [1,0,0,0,0,0|2,0,1]=4 902 B9R1.69 Cc1cc(ccc1O)O 271570a_203496583355_100000186361 [1,0,0,0,0,0|2,0,1]=4 903 B9R1.69 Cc1cc(ccc1O)O 271570a_203496583355_100000729255 [1,0,0,0,0,0|2,0,1]=4 904 B9R1.69 Cc1ccc([n+](c1)[O-])O 271570a_203496583355_100009819918 [1,0,0,0,0,0|1,0,2]=4 905 B9R1.69 Cc1ccc(c(c1)Br)O 271570a_203496583355_100009813563 [1,0,0,0,0,0|1,0,1]=3 906 B9R1.69 Cc1ccc(c(c1)C)O 271570a_203496583355_100011217332 [1,0,0,0,0,0|1,0,1]=3 907 B9R1.69 Cc1ccc(c(c1)Cl)O 271570a_203496583355_100011263221 [1,0,0,0,0,0|1,0,1]=3 908 B9R1.69 Cc1ccc(c(c1)F)O 271570a_203496583355_100011216119 [1,0,0,0,0,0|1,0,1]=3 909 B9R1.69 Cc1ccc(c(c1)N)O 271570a_203496583355_100011216686 [1,0,0,0,0,0|1,0,1]=3 910 B9R1.69 Cc1ccc(c(c1)O)Br 271570a_203496583355_100012353751 [1,0,0,0,0,0|1,0,0]=2 911 B9R1.69 Cc1ccc(c(c1)O)C 271570a_203496583355_100000210833 [1,0,0,0,0,0|0,0,1]=2 912 B9R1.69 Cc1ccc(c(c1)O)Cl 271570a_203496583355_100012356289 [1,0,0,0,0,0|1,0,0]=2 913 B9R1.69 Cc1ccc(c(c1)O)F 271570a_203496583355_100000736223 [1,0,0,0,0,0|1,0,0]=2 914 B9R1.69 Cc1ccc(c(c1)O)N 271570a_203496583355_100000210942 [1,0,0,0,0,0|1,0,0]=2 915 B9R1.69 Cc1ccc(c(c1)O)O 271570a_203496583355_100000765521 [1,0,0,0,0,0|0,0,1]=2 916 B9R1.69 Cc1ccc(c(c1)O)O 271570a_203496583355_100012002257 [1,0,0,0,0,0|0,0,1]=2 917 B9R1.69 Cc1ccc(c(n1)C)O 271570a_203496583355_100009813853 [1,0,0,0,0,0|2,0,1]=4 918 B9R1.69 Cc1ccc(c(n1)F)O 271570a_203496583355_100010006597 [1,0,0,0,0,0|2,0,1]=4 919 B9R1.69 Cc1ccc(c(n1)N)O 271570a_203496583355_100009816662 [1,0,0,0,0,0|2,0,1]=4 920 B9R1.69 Cc1ccc(c(n1)O)C 271570a_203496583355_100009854376 [1,0,0,0,0,0|1,0,1]=3 921 B9R1.69 Cc1ccc(c(n1)O)F 271570a_203496583355_100009817602 [1,0,0,0,0,0|2,0,0]=3 922 B9R1.69 Cc1ccc(c(n1)O)N 271570a_203496583355_100000685570 [1,0,0,0,0,0|2,0,0]=3 923 B9R1.69 Cc1ccc(c(n1)O)O 271570a_203496583355_100000702858 [1,0,0,0,0,0|1,0,1]=3 924 B9R1.69 Cc1ccc(c(n1)O)O 271570a_203496583355_100009817604 [1,0,0,0,0,0|1,0,1]=3 925 B9R1.69 Cc1ccc(cc1Br)O 271570a_203496583355_100011847877 [1,0,0,0,0,0|2,0,1]=4 926 B9R1.69 Cc1ccc(cc1C)O 271570a_203496583355_100011215607 [1,0,0,0,0,0|2,0,1]=4 927 B9R1.69 Cc1ccc(cc1Cl)O 271570a_203496583355_100011216363 [1,0,0,0,0,0|2,0,1]=4 928 B9R1.69 Cc1ccc(cc1F)O 271570a_203496583355_100000720648 [1,0,0,0,0,0|2,0,1]=4 929 B9R1.69 Cc1ccc(cc1N)O 271570a_203496583355_100000761890 [1,0,0,0,0,0|2,0,1]=4 930 B9R1.69 Cc1ccc(cc1O)Br 271570a_203496583355_100011344865 [1,0,0,0,0,0|1,0,1]=3 931 B9R1.69 Cc1ccc(cc1O)Cl 271570a_203496583355_100011263213 [1,0,0,0,0,0|1,0,1]=3 932 B9R1.69 Cc1ccc(cc1O)F 271570a_203496583355_100011218078 [1,0,0,0,0,0|1,0,1]=3 933 B9R1.69 Cc1ccc(cc1O)N 271570a_203496583355_100000736455 [1,0,0,0,0,0|1,0,1]=3 934 B9R1.69 Cc1ccc(cc1O)O 271570a_203496583355_100000766334 [1,0,0,0,0,0|1,0,1]=3 935 B9R1.69 Cc1ccc(cc1O)O 271570a_203496583355_100011380479 [1,0,0,0,0,0|1,0,1]=3 936 B9R1.69 Cc1ccc(nc1O)N 271570a_203496583355_100000126722 [1,0,0,0,0,0|2,0,1]=4 937 B9R1.69 Cc1cnc(c(c1)C)O 271570a_203496583355_100009864548 [1,0,0,0,0,0|2,0,1]=4 938 B9R1.69 Cc1cnc(c(c1)F)O 271570a_203496583355_100009819633 [1,0,0,0,0,0|2,0,1]=4 939 B9R1.69 Cc1cnc(c(c1)N)O 271570a_203496583355_100000733613 [1,0,0,0,0,0|2,0,1]=4 940 B9R1.69 Cc1cnc(c(c1)O)C 271570a_203496583355_100009817436 [1,0,0,0,0,0|1,0,1]=3 941 B9R1.69 Cc1cnc(c(c1)O)Cl 271570a_203496583355_100010210167 [1,0,0,0,0,0|2,0,0]=3 942 B9R1.69 Cc1cnc(c(c1)O)F 271570a_203496583355_100000049784 [1,0,0,0,0,0|2,0,0]=3 943 B9R1.69 Cc1cnc(c(c1)O)N 271570a_203496583355_100000049664 [1,0,0,0,0,0|2,0,0]=3 944 B9R1.69 Cc1cnc(c(c1)O)O 271570a_203496583355_100000049931 [1,0,0,0,0,0|1,0,1]=3 945 B9R1.69 Cc1cnc(c(c1)O)O 271570a_203496583355_100012000487 [1,0,0,0,0,0|1,0,1]=3 946 B9R1.69 Cc1cnc(c(n1)O)C 271570a_203496583355_100000211308 [1,0,0,0,0,0|2,0,1]=4 947 B9R1.69 Cc1cnc(c(n1)O)N 271570a_203496583355_100009819049 [1,0,0,0,0,0|3,0,0]=4 948 B9R1.69 Cc1cnc(cc1O)Br 271570a_203496583355_100010067628 [1,0,0,0,0,0|2,0,1]=4 949 B9R1.69 Cc1cnc(cc1O)Cl 271570a_203496583355_100010068021 [1,0,0,0,0,0|2,0,1]=4 950 B9R1.69 Cc1cnc(cc1O)F 271570a_203496583355_100000049870 [1,0,0,0,0,0|2,0,1]=4 951 B9R1.69 Cc1cnc(cc1O)N 271570a_203496583355_100009819938 [1,0,0,0,0,0|2,0,1]=4 952 B9R1.69 Cc1cnc(cc1O)O 271570a_203496583355_100000704368 [1,0,0,0,0,0|2,0,1]=4 953 B9R1.69 Cc1cnc(cc1O)O 271570a_203496583355_100009831917 [1,0,0,0,0,0|2,0,1]=4 954 B9R1.69 Cc1ncc(c(n1)O)F 271570a_203496583355_100000059819 [1,0,0,0,0,0|3,0,0]=4 955 B9R1.69 Cc1ncc(c(n1)O)N 271570a_203496583355_100009873743 [1,0,0,0,0,0|3,0,0]=4 956 B9R1.69 Cc1ncc(cc1O)Br 271570a_203496583355_200010090566 [1,0,0,0,0,0|2,0,1]=4 957 B9R1.69 Cc1ncc(cc1O)F 271570a_203496583355_100009860710 [1,0,0,0,0,0|2,0,1]=4 958 B9R1.69 Cc1ncc(cc1O)N 271570a_203496583355_100011998591 [1,0,0,0,0,0|2,0,1]=4 959 B9R1.69 Cc1ncc(cc1O)O 271570a_203496583355_100009819603 [1,0,0,0,0,0|2,0,1]=4 960 B9R1.69 Cc1ncc(cc1O)O 271570a_203496583355_100009864810 [1,0,0,0,0,0|2,0,1]=4 961 B9R1.69 Cn1cc(ccc1=O)O 271570a_203496583355_100011245003 [1,0,0,0,0,0|3,0,0]=4 962 B9R1.69 Cn1ccc(=O)c(c1)O 271570a_203496583355_100010750718 [1,0,0,0,0,0|1,0,0]=2 963 B9R1.69 Nc1cc(c(cn1)Cl)O 271570a_203496583355_100010134119 [1,0,0,0,0,0|3,0,0]=4 964 B9R1.69 Nc1cc(c(cn1)F)O 271570a_203496583355_100015713587 [1,0,0,0,0,0|3,0,0]=4 965 B9R1.69 Nc1cc(ccc1Br)O 271570a_203496583355_100000750456 [1,0,0,0,0,0|3,0,0]=4 966 B9R1.69 Nc1cc(ccc1Cl)O 271570a_203496583355_200000761891 [1,0,0,0,0,0|3,0,0]=4 967 B9R1.69 Nc1cc(ccc1F)O 271570a_203496583355_100000740924 [1,0,0,0,0,0|3,0,0]=4 968 B9R1.69 Nc1cc(ccc1O)Br 271570a_203496583355_100000743836 [1,0,0,0,0,0|2,0,1]=4 969 B9R1.69 Nc1cc(ccc1O)Cl 271570a_203496583355_100000761886 [1,0,0,0,0,0|2,0,1]=4 970 B9R1.69 Nc1cc(ccc1O)F 271570a_203496583355_100011218093 [1,0,0,0,0,0|2,0,1]=4 971 B9R1.69 Nc1cc(ccc1O)O 271570a_203496583355_100000752626 [1,0,0,0,0,0|2,0,1]=4 972 B9R1.69 Nc1cc(ccc1O)O 271570a_203496583355_100011999798 [1,0,0,0,0,0|2,0,1]=4 973 B9R1.69 Nc1ccc(c(c1)Br)O 271570a_203496583355_100000750458 [1,0,0,0,0,0|2,0,1]=4 974 B9R1.69 Nc1ccc(c(c1)Cl)O 271570a_203496583355_100000761885 [1,0,0,0,0,0|2,0,1]=4 975 B9R1.69 Nc1ccc(c(c1)F)O 271570a_203496583355_100011356925 [1,0,0,0,0,0|2,0,1]=4 976 B9R1.69 Nc1ccc(c(c1)N)O 271570a_203496583355_200012175722 [1,0,0,0,0,0|2,0,1]=4 977 B9R1.69 Nc1ccc(c(c1)O)Br 271570a_203496583355_100000750459 [1,0,0,0,0,0|2,0,0]=3 978 B9R1.69 Nc1ccc(c(c1)O)Cl 271570a_203496583355_100012360549 [1,0,0,0,0,0|2,0,0]=3 979 B9R1.69 Nc1ccc(c(c1)O)F 271570a_203496583355_100000760356 [1,0,0,0,0,0|2,0,0]=3 980 B9R1.69 Nc1ccc(c(c1)O)N 271570a_203496583355_100011534242 [1,0,0,0,0,0|2,0,0]=3 981 B9R1.69 Nc1ccc(c(c1)O)O 271570a_203496583355_100011534360 [1,0,0,0,0,0|1,0,1]=3 982 B9R1.69 Nc1ccc(c(n1)O)Br 271570a_203496583355_100010192275 [1,0,0,0,0,0|3,0,0]=4 983 B9R1.69 Nc1ccc(c(n1)O)F 271570a_203496583355_100010892222 [1,0,0,0,0,0|3,0,0]=4 984 B9R1.69 Nc1ccc(c(n1)O)N 271570a_203496583355_200009884323 [1,0,0,0,0,0|3,0,0]=4 985 B9R1.69 Nc1ccc(cc1Br)O 271570a_203496583355_100000750455 [1,0,0,0,0,0|3,0,0]=4 986 B9R1.69 Nc1ccc(cc1Cl)O 271570a_203496583355_100011218065 [1,0,0,0,0,0|3,0,0]=4 987 B9R1.69 Nc1ccc(cc1F)O 271570a_203496583355_100011215594 [1,0,0,0,0,0|3,0,0]=4 988 B9R1.69 Nc1ccc(cc1N)O 271570a_203496583355_100000741789 [1,0,0,0,0,0|3,0,0]=4 989 B9R1.69 Nc1ccc(cc1O)Br 271570a_203496583355_100000187925 [1,0,0,0,0,0|2,0,0]=3 990 B9R1.69 Nc1ccc(cc1O)Cl 271570a_203496583355_100000761889 [1,0,0,0,0,0|2,0,0]=3 991 B9R1.69 Nc1ccc(cc1O)F 271570a_203496583355_100000760547 [1,0,0,0,0,0|2,0,0]=3 992 B9R1.69 Nc1ccc(cc1O)O 271570a_203496583355_100000739049 [1,0,0,0,0,0|2,0,0]=3 993 B9R1.69 Nc1ccc(cc1O)O 271570a_203496583355_100012001276 [1,0,0,0,0,0|2,0,0]=3 994 B9R1.69 Nc1ccc(nc1O)Br 271570a_203496583355_100010168765 [1,0,0,0,0,0|3,0,0]=4 995 B9R1.69 Nc1ccc(nc1O)Cl 271570a_203496583355_100010233647 [1,0,0,0,0,0|3,0,0]=4 996 B9R1.69 Nc1ccc(nc1O)F 271570a_203496583355_100009879877 [1,0,0,0,0,0|3,0,0]=4 997 B9R1.69 Nc1ccc(nc1O)O 271570a_203496583355_100000718904 [1,0,0,0,0,0|3,0,0]=4 998 B9R1.69 Nc1cnc(c(c1)O)Br 271570a_203496583355_100010201102 [1,0,0,0,0,0|3,0,0]=4 999 B9R1.69 Nc1cnc(c(c1)O)Cl 271570a_203496583355_100010253917 [1,0,0,0,0,0|3,0,0]=4 1000 B9R1.69 Nc1cnc(c(c1)O)F 271570a_203496583355_100009840397 [1,0,0,0,0,0|3,0,0]=4 1001 B9R1.69 Nc1cnc(c(c1)O)N 271570a_203496583355_200011934315 [1,0,0,0,0,0|3,0,0]=4 1002 B9R1.69 Nc1cnc(cc1O)Cl 271570a_203496583355_100000050123 [1,0,0,0,0,0|3,0,0]=4 1003 B9R1.69 Nc1ncc(cc1O)Br 271570a_203496583355_100000760472 [1,0,0,0,0,0|3,0,0]=4 1004 B9R1.69 Nc1ncc(cc1O)Cl 271570a_203496583355_100000050159 [1,0,0,0,0,0|3,0,0]=4 1005 B9R1.69 Nc1ncc(cc1O)F 271570a_203496583355_100009814671 [1,0,0,0,0,0|3,0,0]=4 1006 B9R1.69 Nc1ncc(cc1O)O 271570a_203496583355_100009819042 [1,0,0,0,0,0|3,0,0]=4 1007 B9R1.69 O=c1[nH]cc(cc1Br)O 271570a_203496583355_100010125443 [1,0,0,0,0,0|3,0,0]=4 1008 B9R1.69 O=c1[nH]cc(cc1F)O 271570a_203496583355_100000723523 [1,0,0,0,0,0|3,0,0]=4 1009 B9R1.69 O=c1[nH]cc(cc1O)F 271570a_203496583355_100009817720 [1,0,0,0,0,0|2,0,0]=3 1010 B9R1.69 O=c1[nH]cc(cc1O)O 271570a_203496583355_100009814561 [1,0,0,0,0,0|2,0,0]=3 1011 B9R1.69 O=c1cc(c(c[nH]1)F)O 271570a_203496583355_100009817642 [1,0,0,0,0,0|3,0,0]=4 1012 B9R1.69 Oc1cc(c(cn1)F)O 271570a_203496583355_100009854642 [1,0,0,0,0,0|3,0,0]=4 1013 B9R1.69 Oc1cc(ccc1Br)Br 271570a_203496583355_100011483371 [1,0,0,0,0,0|2,0,0]=3 1014 B9R1.69 Oc1cc(ccc1Br)Cl 271570a_203496583355_100012339723 [1,0,0,0,0,0|2,0,0]=3 1015 B9R1.69 Oc1cc(ccc1Br)F 271570a_203496583355_100011217576 [1,0,0,0,0,0|2,0,0]=3 1016 B9R1.69 Oc1cc(ccc1Cl)Br 271570a_203496583355_100011772130 [1,0,0,0,0,0|2,0,0]=3 1017 B9R1.69 Oc1cc(ccc1Cl)Cl 271570a_203496583355_100000707729 [1,0,0,0,0,0|2,0,0]=3 1018 B9R1.69 Oc1cc(ccc1Cl)F 271570a_203496583355_100011217299 [1,0,0,0,0,0|2,0,0]=3 1019 B9R1.69 Oc1cc(ccc1F)Br 271570a_203496583355_100011217312 [1,0,0,0,0,0|2,0,0]=3 1020 B9R1.69 Oc1cc(ccc1F)Cl 271570a_203496583355_100011218116 [1,0,0,0,0,0|2,0,0]=3 1021 B9R1.69 Oc1cc(ccc1F)F 271570a_203496583355_100000750033 [1,0,0,0,0,0|2,0,0]=3 1022 B9R1.69 Oc1cc(cnc1Cl)Br 271570a_203496583355_100009814771 [1,0,0,0,0,0|3,0,0]=4 1023 B9R1.69 Oc1cc(cnc1Cl)Cl 271570a_203496583355_200000062399 [1,0,0,0,0,0|3,0,0]=4 1024 B9R1.69 Oc1cc(cnc1F)Br 271570a_203496583355_100010172738 [1,0,0,0,0,0|3,0,0]=4 1025 B9R1.69 Oc1cc(cnc1F)Cl 271570a_203496583355_100010188783 [1,0,0,0,0,0|3,0,0]=4 1026 B9R1.69 Oc1cc(cnc1F)F 271570a_203496583355_100009820768 [1,0,0,0,0,0|3,0,0]=4 1027 B9R1.69 Oc1cc(cnc1O)Br 271570a_203496583355_100010197142 [1,0,0,0,0,0|2,0,1]=4 1028 B9R1.69 Oc1cc(cnc1O)Br 271570a_203496583355_100010210634 [1,0,0,0,0,0|2,0,1]=4 1029 B9R1.69 Oc1cc(cnc1O)Cl 271570a_203496583355_100010188700 [1,0,0,0,0,0|2,0,1]=4 1030 B9R1.69 Oc1cc(cnc1O)Cl 271570a_203496583355_100010233512 [1,0,0,0,0,0|2,0,1]=4 1031 B9R1.69 Oc1cc(cnc1O)F 271570a_203496583355_100000079967 [1,0,0,0,0,0|2,0,1]=4 1032 B9R1.69 Oc1cc(ncc1Br)Br 271570a_203496583355_100010171693 [1,0,0,0,0,0|3,0,0]=4 1033 B9R1.69 Oc1cc(ncc1Br)Cl 271570a_203496583355_100009815598 [1,0,0,0,0,0|3,0,0]=4 1034 B9R1.69 Oc1cc(ncc1Cl)Br 271570a_203496583355_100010223331 [1,0,0,0,0,0|3,0,0]=4 1035 B9R1.69 Oc1cc(ncc1Cl)Cl 271570a_203496583355_100010172835 [1,0,0,0,0,0|3,0,0]=4 1036 B9R1.69 Oc1cc(ncc1Cl)F 271570a_203496583355_100009892587 [1,0,0,0,0,0|3,0,0]=4 1037 B9R1.69 Oc1cc(ncc1F)Br 271570a_203496583355_100010193852 [1,0,0,0,0,0|3,0,0]=4 1038 B9R1.69 Oc1cc(ncc1F)Cl 271570a_203496583355_100000708277 [1,0,0,0,0,0|3,0,0]=4 1039 B9R1.69 Oc1cc(ncc1F)F 271570a_203496583355_100010233071 [1,0,0,0,0,0|3,0,0]=4 1040 B9R1.69 Oc1ccc(c(c1)Br)Br 271570a_203496583355_100012356285 [1,0,0,0,0,0|3,0,0]=4 1041 B9R1.69 Oc1ccc(c(c1)Br)Cl 271570a_203496583355_100012353702 [1,0,0,0,0,0|3,0,0]=4 1042 B9R1.69 Oc1ccc(c(c1)Br)F 271570a_203496583355_100012047266 [1,0,0,0,0,0|3,0,0]=4 1043 B9R1.69 Oc1ccc(c(c1)Br)O 271570a_203496583355_100000701344 [1,0,0,0,0,0|2,0,1]=4 1044 B9R1.69 Oc1ccc(c(c1)Br)O 271570a_203496583355_100012361655 [1,0,0,0,0,0|2,0,1]=4 1045 B9R1.69 Oc1ccc(c(c1)Cl)Br 271570a_203496583355_100012047281 [1,0,0,0,0,0|3,0,0]=4 1046 B9R1.69 Oc1ccc(c(c1)Cl)Cl 271570a_203496583355_100011214914 [1,0,0,0,0,0|3,0,0]=4 1047 B9R1.69 Oc1ccc(c(c1)Cl)F 271570a_203496583355_100011215976 [1,0,0,0,0,0|3,0,0]=4 1048 B9R1.69 Oc1ccc(c(c1)Cl)O 271570a_203496583355_100000047559 [1,0,0,0,0,0|2,0,1]=4 1049 B9R1.69 Oc1ccc(c(c1)Cl)O 271570a_203496583355_100012360047 [1,0,0,0,0,0|2,0,1]=4 1050 B9R1.69 Oc1ccc(c(c1)F)Br 271570a_203496583355_100000685389 [1,0,0,0,0,0|3,0,0]=4 1051 B9R1.69 Oc1ccc(c(c1)F)Cl 271570a_203496583355_100011216805 [1,0,0,0,0,0|3,0,0]=4 1052 B9R1.69 Oc1ccc(c(c1)F)F 271570a_203496583355_100000750028 [1,0,0,0,0,0|3,0,0]=4 1053 B9R1.69 Oc1ccc(c(c1)F)O 271570a_203496583355_100000185481 [1,0,0,0,0,0|2,0,1]=4 1054 B9R1.69 Oc1ccc(c(c1)F)O 271570a_203496583355_100000755031 [1,0,0,0,0,0|2,0,1]=4 1055 B9R1.69 Oc1ccc(c(c1)O)Br 271570a_203496583355_100012339312 [1,0,0,0,0,0|2,0,0]=3 1056 B9R1.69 Oc1ccc(c(c1)O)Br 271570a_203496583355_100012356990 [1,0,0,0,0,0|2,0,0]=3 1057 B9R1.69 Oc1ccc(c(c1)O)Cl 271570a_203496583355_100000049588 [1,0,0,0,0,0|2,0,0]=3 1058 B9R1.69 Oc1ccc(c(c1)O)Cl 271570a_203496583355_100011356854 [1,0,0,0,0,0|2,0,0]=3 1059 B9R1.69 Oc1ccc(c(c1)O)F 271570a_203496583355_100000686035 [1,0,0,0,0,0|2,0,0]=3 1060 B9R1.69 Oc1ccc(c(c1)O)F 271570a_203496583355_100000693481 [1,0,0,0,0,0|2,0,0]=3 1061 B9R1.69 Oc1ccc(c(c1)O)O 271570a_203496583355_100009813601 [1,0,0,0,0,0|1,0,1]=3 1062 B9R1.69 Oc1ccc(c(c1)O)O 271570a_203496583355_100009813629 [1,0,0,0,0,0|1,0,1]=3 1063 B9R1.69 Oc1ccc(c(c1)O)O 271570a_203496583355_100009813921 [1,0,0,0,0,0|1,0,1]=3 1064 B9R1.69 Oc1ccc(c(n1)O)F 271570a_203496583355_100010729010 [1,0,0,0,0,0|3,0,0]=4 1065 B9R1.69 Oc1ccc(cc1Br)Br 271570a_203496583355_100011484698 [1,0,0,0,0,0|2,0,1]=4 1066 B9R1.69 Oc1ccc(cc1Br)Cl 271570a_203496583355_100011219703 [1,0,0,0,0,0|2,0,1]=4 1067 B9R1.69 Oc1ccc(cc1Br)F 271570a_203496583355_100011217111 [1,0,0,0,0,0|2,0,1]=4 1068 B9R1.69 Oc1ccc(cc1Cl)Br 271570a_203496583355_100011216062 [1,0,0,0,0,0|2,0,1]=4 1069 B9R1.69 Oc1ccc(cc1Cl)Cl 271570a_203496583355_100000699841 [1,0,0,0,0,0|2,0,1]=4 1070 B9R1.69 Oc1ccc(cc1Cl)F 271570a_203496583355_100000733362 [1,0,0,0,0,0|2,0,1]=4 1071 B9R1.69 Oc1ccc(cc1F)Br 271570a_203496583355_100009814013 [1,0,0,0,0,0|2,0,1]=4 1072 B9R1.69 Oc1ccc(cc1F)Cl 271570a_203496583355_100011216042 [1,0,0,0,0,0|2,0,1]=4 1073 B9R1.69 Oc1ccc(cc1F)F 271570a_203496583355_100000750030 [1,0,0,0,0,0|2,0,1]=4 1074 B9R1.69 Oc1ccc(cc1O)Br 271570a_203496583355_100012344904 [1,0,0,0,0,0|1,0,1]=3 1075 B9R1.69 Oc1ccc(cc1O)Br 271570a_203496583355_100012355227 [1,0,0,0,0,0|1,0,1]=3 1076 B9R1.69 Oc1ccc(cc1O)Cl 271570a_203496583355_100000050036 [1,0,0,0,0,0|1,0,1]=3 1077 B9R1.69 Oc1ccc(cc1O)Cl 271570a_203496583355_100011356953 [1,0,0,0,0,0|1,0,1]=3 1078 B9R1.69 Oc1ccc(cc1O)F 271570a_203496583355_100000211999 [1,0,0,0,0,0|1,0,1]=3 1079 B9R1.69 Oc1ccc(cc1O)F 271570a_203496583355_100000690578 [1,0,0,0,0,0|1,0,1]=3 1080 B9R1.69 Oc1ccc(nc1O)Br 271570a_203496583355_100010253912 [1,0,0,0,0,0|2,0,1]=4 1081 B9R1.69 Oc1ccc(nc1O)Cl 271570a_203496583355_100000696390 [1,0,0,0,0,0|2,0,1]=4 1082 B9R1.69 Oc1ccc(nc1O)F 271570a_203496583355_100010382442 [1,0,0,0,0,0|2,0,1]=4 1083 B9R1.69 Oc1cnc(c(c1)O)F 271570a_203496583355_100009817267 [1,0,0,0,0,0|3,0,0]=4 1084 B9R1.69 Oc1cnc(c(c1)O)F 271570a_203496583355_100009819871 [1,0,0,0,0,0|3,0,0]=4 1085 B9R1.69 Oc1cnc(cc1O)Cl 271570a_203496583355_100000698892 [1,0,0,0,0,0|2,0,1]=4 1086 B9R1.69 Oc1nc(ccc1F)Cl 271570a_203496583355_100010136221 [1,0,0,0,0,0|3,0,0]=4 1087 B9R1.69 Oc1nc(ccc1F)F 271570a_203496583355_100010997973 [1,0,0,0,0,0|3,0,0]=4 1088 B11R1.37 C#Cc1cc(ccc1NC)C 34a_200012001881_200000210301 [0,1,0,0,0,0|3,0,0]=4 1089 B11R1.37 C#Cc1cc(ccc1N[13CH3])C 34a_200012001881_200025704644 [0,1,0,0,0,0|3,0,0]=4 1090 B11R1.37 C=Cc1cc(ccc1C#N)C 271570a_100011290941_100000693804 [0,1,0,0,0,0|2,0,1]=4 1091 B11R1.37 C=Cc1cc(ccc1C=O)Br 271570a_100011290941_100010146562 [0,1,0,0,0,0|2,0,0]=3 1092 B11R1.37 C=Cc1cc(ccc1C=O)C 271570a_100011290941_100000692596 [0,1,0,0,0,0|1,0,0]=2 1093 B11R1.37 C=Cc1cc(ccc1C=O)F 271570a_100011290941_100000752949 [0,1,0,0,0,0|2,0,0]=3 1094 B11R1.37 C=Cc1cc(ccc1C=O)O 271570a_100011290941_100011236494 [0,1,0,0,0,0|2,0,0]=3 1095 B11R1.37 C=Cc1cc(ccc1NC)C 271570a_100011290941_100000221369 [0,1,0,0,0,0|3,0,0]=4 1096 B11R1.37 C=Cc1cc(ccc1NN)C 271570a_100011290941_100016996181 [0,1,0,0,0,0|3,0,0]=4 1097 B11R1.37 C=Cc1cc(ccc1OC)C 271570a_100011290941_100000186399 [0,1,0,0,0,0|3,0,0]=4 1098 B11R1.37 C=Cc1cc(ccc1SC)C 271570a_100011290941_200010201864 [0,1,0,0,0,0|3,0,0]=4 1099 B11R1.37 C=Cc1cc(ncc1C=O)F 271570a_100011290941_100009862493 [0,1,0,0,0,0|3,0,0]=4 1100 B11R1.37 C=Cc1ccc(cc1C#N)Br 271570a_100011290941_100011219714 [0,1,0,0,0,0|3,0,0]=4 1101 B11R1.37 C=Cc1ccc(cc1C#N)C 271570a_100011290941_100011935190 [0,1,0,0,0,0|2,0,0]=3 1102 B11R1.37 C=Cc1ccc(cc1C#N)Cl 271570a_100011290941_200011356825 [0,1,0,0,0,0|3,0,0]=4 1103 B11R1.37 C=Cc1ccc(cc1C#N)F 271570a_100011290941_100000747550 [0,1,0,0,0,0|3,0,0]=4 1104 B11R1.37 C=Cc1ccc(cc1C#N)N 271570a_100011290941_100011934039 [0,1,0,0,0,0|3,0,0]=4 1105 B11R1.37 C=Cc1ccc(cc1C#N)O 271570a_100011290941_100009818209 [0,1,0,0,0,0|3,0,0]=4 1106 B11R1.37 C=Cc1ccc(cc1C=O)Br 271570a_100011290941_100010185651 [0,1,0,0,0,0|2,0,1]=4 1107 B11R1.37 C=Cc1ccc(cc1C=O)C 271570a_100011290941_100011551863 [0,1,0,0,0,0|1,0,1]=3 1108 B11R1.37 C=Cc1ccc(cc1C=O)Cl 271570a_100011290941_100010254386 [0,1,0,0,0,0|2,0,1]=4 1109 B11R1.37 C=Cc1ccc(cc1C=O)F 271570a_100011290941_100011218309 [0,1,0,0,0,0|2,0,1]=4 1110 B11R1.37 C=Cc1ccc(cc1C=O)O 271570a_100011290941_100000690577 [0,1,0,0,0,0|2,0,1]=4 1111 B11R1.37 C=Cc1ccc(cc1CC)Br 271570a_100011290941_100011216195 [0,1,0,0,0,0|3,0,0]=4 1112 B11R1.37 C=Cc1ccc(cc1CC)N 271570a_100011290941_100010109747 [0,1,0,0,0,0|3,0,0]=4 1113 B11R1.37 C=Cc1ccc(cc1CN)F 271570a_100011290941_100000742738 [0,1,0,0,0,0|3,0,0]=4 1114 B11R1.37 C=Cc1ccc(cc1CO)Br 271570a_100011290941_100011356890 [0,1,0,0,0,0|2,0,0]=3 1115 B11R1.37 C=Cc1ccc(cc1CO)C 271570a_100011290941_100012361352 [0,1,0,0,0,0|1,0,0]=2 1116 B11R1.37 C=Cc1ccc(cc1CO)F 271570a_100011290941_100011217561 [0,1,0,0,0,0|2,0,0]=3 1117 B11R1.37 C=Cc1ccc(cc1CO)N 271570a_100011290941_100012347228 [0,1,0,0,0,0|2,0,0]=3 1118 B11R1.37 C=Cc1ccc(cc1CO)O 271570a_100011290941_100012351483 [0,1,0,0,0,0|2,0,0]=3 1119 B11R1.37 C=Cc1ccc(cc1NC)F 271570a_100011290941_100020633008 [0,1,0,0,0,0|3,0,0]=4 1120 B11R1.37 C=Cc1ccc(cc1NN)F 271570a_100011290941_100012362518 [0,1,0,0,0,0|3,0,0]=4 1121 B11R1.37 C=Cc1ccc(cc1OC)Br 271570a_100011290941_100010245111 [0,1,0,0,0,0|2,0,0]=3 1122 B11R1.37 C=Cc1ccc(cc1OC)C 271570a_100011290941_100010200004 [0,1,0,0,0,0|1,0,0]=2 1123 B11R1.37 C=Cc1ccc(cc1OC)Cl 271570a_100011290941_100000050115 [0,1,0,0,0,0|2,0,0]=3 1124 B11R1.37 C=Cc1ccc(cc1OC)F 271570a_100011290941_100000757151 [0,1,0,0,0,0|2,0,0]=3 1125 B11R1.37 C=Cc1ccc(cc1OC)N 271570a_100011290941_100000765947 [0,1,0,0,0,0|2,0,0]=3 1126 B11R1.37 C=Cc1ccc(cc1OC)O 271570a_100011290941_100011827694 [0,1,0,0,0,0|2,0,0]=3 1127 B11R1.37 C=Cc1ccc(cc1SC)C 271570a_100011290941_200010709736 [0,1,0,0,0,0|1,1,0]=3 1128 B11R1.37 C=Cc1ccc(cc1SC)F 62a_100012354420_200000210301 [0,1,0,0,0,0|2,1,0]=4 1129 B11R1.37 C=Cc1ccc(cc1SC)F 62a_200000210301_100012354420 [0,1,0,0,0,0|2,1,0]=4 1130 B11R1.37 C=Cc1ccc(cc1S[13CH3])F 62a_100012354420_200025704644 [0,1,0,0,0,0|2,1,0]=4 1131 B11R1.37 C=Cc1ccc(cc1S[13CH3])F 62a_200025704644_100012354420 [0,1,0,0,0,0|2,1,0]=4 1132 B11R1.37 C=Cc1ccc(nc1C#N)C 271570a_100011290941_100009878477 [0,1,0,0,0,0|3,0,0]=4 1133 B11R1.37 C=Cc1ccc(nc1C=O)C 271570a_100011290941_100010173661 [0,1,0,0,0,0|2,0,1]=4 1134 B11R1.37 C=Cc1ccc(nc1CO)C 271570a_100011290941_100010074375 [0,1,0,0,0,0|2,0,0]=3 1135 B11R1.37 C=Cc1ccc(nc1CO)F 271570a_100011290941_100000701195 [0,1,0,0,0,0|3,0,0]=4 1136 B11R1.37 C=Cc1ccc(nc1OC)C 271570a_100011290941_100010138632 [0,1,0,0,0,0|2,0,0]=3 1137 B11R1.37 C=Cc1ccc(nc1OC)N 271570a_100011290941_100010187630 [0,1,0,0,0,0|3,0,0]=4 1138 B11R1.37 C=Cc1cnc(cc1CO)C 271570a_100011290941_100015579599 [0,1,0,0,0,0|2,0,0]=3 1139 B11R1.37 C=Cc1cnc(cc1OC)C 271570a_100011290941_100000717771 [0,1,0,0,0,0|2,0,0]=3 1140 B11R1.37 C=Cc1cnc(cc1OC)Cl 271570a_100011290941_100010154656 [0,1,0,0,0,0|3,0,0]=4 1141 B11R1.37 C=Cc1cnc(cc1OC)F 271570a_100011290941_100010135560 [0,1,0,0,0,0|3,0,0]=4 1142 B11R1.37 C=Cc1cnc(cc1OC)N 271570a_100011290941_100015506990 [0,1,0,0,0,0|3,0,0]=4 1143 B11R1.37 C=Cc1nc(ccc1C=O)C 271570a_100011290941_100000085379 [0,1,0,0,0,0|2,0,0]=3 1144 B11R1.37 C=Cc1nc(ccc1C=O)F 271570a_100011290941_100009846357 [0,1,0,0,0,0|3,0,0]=4 1145 B11R1.37 C=Cc1ncc(cc1C#N)C 271570a_100011290941_100012662280 [0,1,0,0,0,0|3,0,0]=4 1146 B11R1.37 C=Cc1ncc(cc1C=O)C 271570a_100011290941_100000050350 [0,1,0,0,0,0|2,0,1]=4 1147 B11R1.37 C=Cc1ncc(cc1CO)C 271570a_100011290941_100000118064 [0,1,0,0,0,0|2,0,0]=3 1148 B11R1.37 C=Cc1ncc(cc1CO)F 271570a_100011290941_100000079972 [0,1,0,0,0,0|3,0,0]=4 1149 B11R1.37 C=Cc1ncc(cc1OC)C 271570a_100011290941_200000118316 [0,1,0,0,0,0|2,0,0]=3 1150 B11R1.37 C=Cc1ncc(cc1OC)F 271570a_100011290941_100009867738 [0,1,0,0,0,0|3,0,0]=4 1151 B11R1.37 C=Cc1ncc(cc1OC)N 271570a_100011290941_100000097218 [0,1,0,0,0,0|3,0,0]=4 1152 B11R1.37 C=Cc1ncc(cc1SC)C 271570a_100011290941_100010884634 [0,1,0,0,0,0|2,1,0]=4 1153 B11R1.37 CCc1cc(ccc1C=O)O 271570a_203496583355_100010209654 [0,1,0,0,0,0|2,0,0]=3 1154 B11R1.37 CCc1cc(ccc1OC)C 34a_100009844793_200000210301 [0,1,0,0,0,0|3,0,0]=4 1155 B11R1.37 CCc1cc(ccc1OC)C 7a_100009844793_200000210301 [0,1,0,0,0,0|3,0,0]=4 1156 B11R1.37 CCc1cc(ccc1O[13CH3])C 34a_100009844793_200025704644 [0,1,0,0,0,0|3,0,0]=4 1157 B11R1.37 CCc1cc(ccc1O[13CH3])C 7a_100009844793_200025704644 [0,1,0,0,0,0|3,0,0]=4 1158 B11R1.37 CCc1ccc(cc1CO)O 271570a_203496583355_100010766240 [0,1,0,0,0,0|2,0,1]=4 1159 B11R1.37 CCc1ccc(cc1OC)O 271570a_203496583355_200010710398 [0,1,0,0,0,0|2,0,1]=4 1160 B11R1.37 CNc1cc(ccc1C#N)C 34a_100011218341_200000210301 [0,1,0,0,0,0|2,0,1]=4 1161 B11R1.37 CNc1cc(ccc1C#N)C 7a_100011218341_200000210301 [0,1,0,0,0,0|2,0,1]=4 1162 B11R1.37 CNc1cc(ccc1CO)C 34a_100000087799_200000210301 [0,1,0,0,0,0|1,0,2]=4 1163 B11R1.37 CNc1cc(ccc1OC)C 2230a_100000210980_200000210301 [0,1,0,0,0,0|3,0,0]=4 1164 B11R1.37 CNc1cc(ccc1OC)C 34a_100000210980_200000210301 [0,1,0,0,0,0|3,0,0]=4 1165 B11R1.37 CNc1cc(ncc1C=O)F 27a_100102657272_100009862493 [0,1,0,0,0,0|3,0,0]=4 1166 B11R1.37 CNc1ccc(cc1C#N)C 7a_100011934023_200000210301 [0,1,0,0,0,0|3,0,0]=4 1167 B11R1.37 CNc1ccc(cc1CO)Br 34a_100012353972_200000210301 [0,1,0,0,0,0|3,0,0]=4 1168 B11R1.37 CNc1ccc(cc1CO)C 34a_100011215565_200000210301 [0,1,0,0,0,0|2,0,0]=3 1169 B11R1.37 CNc1ccc(cc1CO)Cl 34a_100011214999_200000210301 [0,1,0,0,0,0|3,0,0]=4 1170 B11R1.37 CNc1ccc(cc1CO)F 34a_100011296978_200000210301 [0,1,0,0,0,0|3,0,0]=4 1171 B11R1.37 CNc1ccc(cc1OC)Br 34a_100011279103_200000210301 [0,1,0,0,0,0|3,0,0]=4 1172 B11R1.37 CNc1ccc(cc1OC)C 2230a_100000746441_200000210301 [0,1,0,0,0,0|2,0,0]=3 1173 B11R1.37 CNc1ccc(cc1OC)C 34a_100000746441_200000210301 [0,1,0,0,0,0|2,0,0]=3 1174 B11R1.37 CNc1ccc(cc1OC)Cl 34a_100000707585_200000210301 [0,1,0,0,0,0|3,0,0]=4 1175 B11R1.37 CNc1ccc(cc1OC)F 34a_100000737216_200000210301 [0,1,0,0,0,0|3,0,0]=4 1176 B11R1.37 CNc1ccc(cc1OC)I 34a_100015196925_200000210301 [0,1,0,0,0,0|3,0,0]=4 1177 B11R1.37 CNc1ccc(cc1OC)O 34a_100015326901_200000210301 [0,1,0,0,0,0|3,0,0]=4 1178 B11R1.37 CNc1ccc(cc1SC)C 62a_100000221369_200000210301 [0,1,0,0,0,0|2,1,0]=4 1179 B11R1.37 CNc1ccc(cc1SC)C 62a_200000210301_100000221369 [0,1,0,0,0,0|2,1,0]=4 1180 B11R1.37 CNc1ccc(cc1S[13CH3])C 62a_100000221369_200025704644 [0,1,0,0,0,0|2,1,0]=4 1181 B11R1.37 CNc1ccc(cc1S[13CH3])C 62a_200025704644_100000221369 [0,1,0,0,0,0|2,1,0]=4 1182 B11R1.37 CNc1nc(ccc1C=O)F 27a_100102657272_100009846357 [0,1,0,0,0,0|3,0,0]=4 1183 B11R1.37 COc1cc(ccc1C#N)Br 34a_100011934713_200000210301 [0,1,0,0,0,0|2,0,1]=4 1184 B11R1.37 COc1cc(ccc1C#N)Br 7a_100011934713_200000210301 [0,1,0,0,0,0|2,0,1]=4 1185 B11R1.37 COc1cc(ccc1C#N)C 34a_100011640519_200000210301 [0,1,0,0,0,0|1,0,1]=3 1186 B11R1.37 COc1cc(ccc1C#N)C 7a_100011640519_200000210301 [0,1,0,0,0,0|1,0,1]=3 1187 B11R1.37 COc1cc(ccc1C#N)Cl 34a_100000688488_200000210301 [0,1,0,0,0,0|2,0,1]=4 1188 B11R1.37 COc1cc(ccc1C#N)Cl 7a_100000688488_200000210301 [0,1,0,0,0,0|2,0,1]=4 1189 B11R1.37 COc1cc(ccc1C#N)F 34a_100012185923_200000210301 [0,1,0,0,0,0|2,0,1]=4 1190 B11R1.37 COc1cc(ccc1C#N)F 7a_100012185923_200000210301 [0,1,0,0,0,0|2,0,1]=4 1191 B11R1.37 COc1cc(ccc1C#N)N 34a_100000094571_200000210301 [0,1,0,0,0,0|2,0,1]=4 1192 B11R1.37 COc1cc(ccc1C#N)N 7a_100000094571_200000210301 [0,1,0,0,0,0|2,0,1]=4 1193 B11R1.37 COc1cc(ccc1C#N)O 271570a_203496583355_100000694671 [0,1,0,0,0,0|2,0,1]=4 1194 B11R1.37 COc1cc(ccc1C=O)O 271570a_203496583355_100000697075 [0,1,0,0,0,0|1,0,0]=2 1195 B11R1.37 COc1cc(ccc1CO)Br 34a_100000071718_200000210301 [0,1,0,0,0,0|1,0,2]=4 1196 B11R1.37 COc1cc(ccc1CO)Br 7a_100000071718_200000210301 [0,1,0,0,0,0|1,0,2]=4 1197 B11R1.37 COc1cc(ccc1CO)O 271570a_203496583355_100011277633 [0,1,0,0,0,0|1,0,2]=4 1198 B11R1.37 COc1cc(ccc1N[13CH3])Br 34a_100011279103_200025704644 [0,1,0,0,0,0|3,0,0]=4 1199 B11R1.37 COc1cc(ccc1N[13CH3])C 2230a_100000746441_200025704644 [0,1,0,0,0,0|2,0,0]=3 1200 B11R1.37 COc1cc(ccc1N[13CH3])C 34a_100000746441_200025704644 [0,1,0,0,0,0|2,0,0]=3 1201 B11R1.37 COc1cc(ccc1N[13CH3])Cl 34a_100000707585_200025704644 [0,1,0,0,0,0|3,0,0]=4 1202 B11R1.37 COc1cc(ccc1N[13CH3])F 34a_100000737216_200025704644 [0,1,0,0,0,0|3,0,0]=4 1203 B11R1.37 COc1cc(ccc1N[13CH3])I 34a_100015196925_200025704644 [0,1,0,0,0,0|3,0,0]=4 1204 B11R1.37 COc1cc(ccc1N[13CH3])O 34a_100015326901_200025704644 [0,1,0,0,0,0|3,0,0]=4 1205 B11R1.37 COc1cc(ccc1O[13CH3])Br 34a_100000694246_200025704644 [0,1,0,0,0,0|3,0,0]=4 1206 B11R1.37 COc1cc(ccc1O[13CH3])Br 7a_100000694246_200025704644 [0,1,0,0,0,0|3,0,0]=4 1207 B11R1.37 COc1cc(ccc1O[13CH3])C 34a_100000186466_200025704644 [0,1,0,0,0,0|2,0,0]=3 1208 B11R1.37 COc1cc(ccc1O[13CH3])Cl 34a_100000033002_200025704644 [0,1,0,0,0,0|3,0,0]=4 1209 B11R1.37 COc1cc(ccc1O[13CH3])F 34a_100000036057_200025704644 [0,1,0,0,0,0|3,0,0]=4 1210 B11R1.37 COc1cc(ccc1O[13CH3])F 7a_100000036057_200025704644 [0,1,0,0,0,0|3,0,0]=4 1211 B11R1.37 COc1cc(ccc1O[13CH3])I 34a_100000049635_200025704644 [0,1,0,0,0,0|3,0,0]=4 1212 B11R1.37 COc1cc(ccc1O[13CH3])N 34a_100000726020_200025704644 [0,1,0,0,0,0|3,0,0]=4 1213 B11R1.37 COc1cc(ccc1SC)Br 62a_100010245111_200000210301 [0,1,0,0,0,0|3,0,0]=4 1214 B11R1.37 COc1cc(ccc1SC)Br 62a_200000210301_100010245111 [0,1,0,0,0,0|3,0,0]=4 1215 B11R1.37 COc1cc(ccc1SC)C 62a_100010200004_200000210301 [0,1,0,0,0,0|2,0,0]=3 1216 B11R1.37 COc1cc(ccc1SC)C 62a_200000210301_100010200004 [0,1,0,0,0,0|2,0,0]=3 1217 B11R1.37 COc1cc(ccc1SC)Cl 62a_100000050115_200000210301 [0,1,0,0,0,0|3,0,0]=4 1218 B11R1.37 COc1cc(ccc1SC)Cl 62a_200000210301_100000050115 [0,1,0,0,0,0|3,0,0]=4 1219 B11R1.37 COc1cc(ccc1SC)F 62a_100000757151_200000210301 [0,1,0,0,0,0|3,0,0]=4 1220 B11R1.37 COc1cc(ccc1SC)F 62a_200000210301_100000757151 [0,1,0,0,0,0|3,0,0]=4 1221 B11R1.37 COc1cc(ccc1SC)N 62a_100000765947_200000210301 [0,1,0,0,0,0|3,0,0]=4 1222 B11R1.37 COc1cc(ccc1SC)N 62a_200000210301_100000765947 [0,1,0,0,0,0|3,0,0]=4 1223 B11R1.37 COc1cc(ccc1SC)O 271570a_203496583355_200011001119 [0,1,0,0,0,0|3,0,0]=4 1224 B11R1.37 COc1cc(ccc1SC)O 62a_200000210301_100011827694 [0,1,0,0,0,0|3,0,0]=4 1225 B11R1.37 COc1cc(ccc1S[13CH3])Br 62a_100010245111_200025704644 [0,1,0,0,0,0|3,0,0]=4 1226 B11R1.37 COc1cc(ccc1S[13CH3])Br 62a_200025704644_100010245111 [0,1,0,0,0,0|3,0,0]=4 1227 B11R1.37 COc1cc(ccc1S[13CH3])C 62a_100010200004_200025704644 [0,1,0,0,0,0|2,0,0]=3 1228 B11R1.37 COc1cc(ccc1S[13CH3])C 62a_200025704644_100010200004 [0,1,0,0,0,0|2,0,0]=3 1229 B11R1.37 COc1cc(ccc1S[13CH3])Cl 62a_100000050115_200025704644 [0,1,0,0,0,0|3,0,0]=4 1230 B11R1.37 COc1cc(ccc1S[13CH3])Cl 62a_200025704644_100000050115 [0,1,0,0,0,0|3,0,0]=4 1231 B11R1.37 COc1cc(ccc1S[13CH3])F 62a_100000757151_200025704644 [0,1,0,0,0,0|3,0,0]=4 1232 B11R1.37 COc1cc(ccc1S[13CH3])F 62a_200025704644_100000757151 [0,1,0,0,0,0|3,0,0]=4 1233 B11R1.37 COc1cc(ccc1S[13CH3])N 62a_100000765947_200025704644 [0,1,0,0,0,0|3,0,0]=4 1234 B11R1.37 COc1cc(ccc1S[13CH3])N 62a_200025704644_100000765947 [0,1,0,0,0,0|3,0,0]=4 1235 B11R1.37 COc1cc(ccc1S[13CH3])O 62a_200025704644_100011827694 [0,1,0,0,0,0|3,0,0]=4 1236 B11R1.37 COc1cc(cnc1C=O)O 271570a_203496583355_100010246152 [0,1,0,0,0,0|2,0,0]=3 1237 B11R1.37 COc1cc(cnc1SC)C 62a_200000210301_200000118316 [0,1,0,0,0,0|3,0,0]=4 1238 B11R1.37 COc1cc(cnc1S[13CH3])C 62a_200025704644_200000118316 [0,1,0,0,0,0|3,0,0]=4 1239 B11R1.37 COc1cc(ncc1SC)C 62a_100000717771_200000210301 [0,1,0,0,0,0|3,0,0]=4 1240 B11R1.37 COc1cc(ncc1SC)C 62a_200000210301_100000717771 [0,1,0,0,0,0|3,0,0]=4 1241 B11R1.37 COc1cc(ncc1S[13CH3])C 62a_100000717771_200025704644 [0,1,0,0,0,0|3,0,0]=4 1242 B11R1.37 COc1cc(ncc1S[13CH3])C 62a_200025704644_100000717771 [0,1,0,0,0,0|3,0,0]=4 1243 B11R1.37 COc1ccc(cc1C#N)C 34a_200012180384_200000210301 [0,1,0,0,0,0|3,0,0]=4 1244 B11R1.37 COc1ccc(cc1C#N)C 7a_200012180384_200000210301 [0,1,0,0,0,0|3,0,0]=4 1245 B11R1.37 COc1ccc(cc1CO)Br 34a_100000184703_200000210301 [0,1,0,0,0,0|3,0,0]=4 1246 B11R1.37 COc1ccc(cc1CO)Br 7a_100000184703_200000210301 [0,1,0,0,0,0|3,0,0]=4 1247 B11R1.37 COc1ccc(cc1CO)C 34a_200011846009_200000210301 [0,1,0,0,0,0|2,0,0]=3 1248 B11R1.37 COc1ccc(cc1CO)C 7a_200011846009_200000210301 [0,1,0,0,0,0|2,0,0]=3 1249 B11R1.37 COc1ccc(cc1CO)Cl 34a_100011218961_200000210301 [0,1,0,0,0,0|3,0,0]=4 1250 B11R1.37 COc1ccc(cc1CO)Cl 7a_100011218961_200000210301 [0,1,0,0,0,0|3,0,0]=4 1251 B11R1.37 COc1ccc(cc1CO)F 34a_100011291448_200000210301 [0,1,0,0,0,0|3,0,0]=4 1252 B11R1.37 COc1ccc(cc1CO)F 7a_100011291448_200000210301 [0,1,0,0,0,0|3,0,0]=4 1253 B11R1.37 COc1ccc(cc1CO)I 34a_100000049520_200000210301 [0,1,0,0,0,0|3,0,0]=4 1254 B11R1.37 COc1ccc(cc1CO)I 7a_100000049520_200000210301 [0,1,0,0,0,0|3,0,0]=4 1255 B11R1.37 COc1ccc(cc1CO)O 271570a_203496583355_100000204679 [0,1,0,0,0,0|3,0,0]=4 1256 B11R1.37 COc1ccc(cc1N[13CH3])C 2230a_100000210980_200025704644 [0,1,0,0,0,0|3,0,0]=4 1257 B11R1.37 COc1ccc(cc1N[13CH3])C 34a_100000210980_200025704644 [0,1,0,0,0,0|3,0,0]=4 1258 B11R1.37 COc1ccc(cc1OC)Br 34a_100000694246_200000210301 [0,1,0,0,0,0|3,0,0]=4 1259 B11R1.37 COc1ccc(cc1OC)Br 34a_100009816560_200000210301 [0,1,0,0,0,0|3,0,0]=4 1260 B11R1.37 COc1ccc(cc1OC)Br 7a_100000694246_200000210301 [0,1,0,0,0,0|3,0,0]=4 1261 B11R1.37 COc1ccc(cc1OC)Br 7a_100009816560_200000210301 [0,1,0,0,0,0|3,0,0]=4 1262 B11R1.37 COc1ccc(cc1OC)C 34a_100000186466_200000210301 [0,1,0,0,0,0|2,0,0]=3 1263 B11R1.37 COc1ccc(cc1OC)C 34a_100011216497_200000210301 [0,1,0,0,0,0|2,0,0]=3 1264 B11R1.37 COc1ccc(cc1OC)C 7a_100011216497_200000210301 [0,1,0,0,0,0|2,0,0]=3 1265 B11R1.37 COc1ccc(cc1OC)Cl 34a_100000033002_200000210301 [0,1,0,0,0,0|3,0,0]=4 1266 B11R1.37 COc1ccc(cc1OC)Cl 34a_100000101779_200000210301 [0,1,0,0,0,0|3,0,0]=4 1267 B11R1.37 COc1ccc(cc1OC)Cl 7a_100000101779_200000210301 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.37 COc1ccc(cc1OC)F 34a_100000034962_200000210301 [0,1,0,0,0,0|3,0,0]=4 1269 B11R1.37 COc1ccc(cc1OC)F 34a_100000036057_200000210301 [0,1,0,0,0,0|3,0,0]=4 1270 B11R1.37 COc1ccc(cc1OC)F 7a_100000034962_200000210301 [0,1,0,0,0,0|3,0,0]=4 1271 B11R1.37 COc1ccc(cc1OC)F 7a_100000036057_200000210301 [0,1,0,0,0,0|3,0,0]=4 1272 B11R1.37 COc1ccc(cc1OC)I 34a_100000049635_200000210301 [0,1,0,0,0,0|3,0,0]=4 1273 B11R1.37 COc1ccc(cc1OC)N 34a_100000211920_200000210301 [0,1,0,0,0,0|3,0,0]=4 1274 B11R1.37 COc1ccc(cc1OC)N 34a_100000726020_200000210301 [0,1,0,0,0,0|3,0,0]=4 1275 B11R1.37 COc1ccc(cc1OC)O 271570a_203496583355_100000187503 [0,1,0,0,0,0|3,0,0]=4 1276 B11R1.37 COc1ccc(cc1O[13CH3])Br 34a_100009816560_200025704644 [0,1,0,0,0,0|3,0,0]=4 1277 B11R1.37 COc1ccc(cc1O[13CH3])Br 7a_100009816560_200025704644 [0,1,0,0,0,0|3,0,0]=4 1278 B11R1.37 COc1ccc(cc1O[13CH3])C 34a_100011216497_200025704644 [0,1,0,0,0,0|2,0,0]=3 1279 B11R1.37 COc1ccc(cc1O[13CH3])C 7a_100011216497_200025704644 [0,1,0,0,0,0|2,0,0]=3 1280 B11R1.37 COc1ccc(cc1O[13CH3])Cl 34a_100000101779_200025704644 [0,1,0,0,0,0|3,0,0]=4 1281 B11R1.37 COc1ccc(cc1O[13CH3])Cl 7a_100000101779_200025704644 [0,1,0,0,0,0|3,0,0]=4 1282 B11R1.37 COc1ccc(cc1O[13CH3])F 34a_100000034962_200025704644 [0,1,0,0,0,0|3,0,0]=4 1283 B11R1.37 COc1ccc(cc1O[13CH3])F 7a_100000034962_200025704644 [0,1,0,0,0,0|3,0,0]=4 1284 B11R1.37 COc1ccc(cc1O[13CH3])N 34a_100000211920_200025704644 [0,1,0,0,0,0|3,0,0]=4 1285 B11R1.37 COc1ccc(cc1SC)C 62a_100000186399_200000210301 [0,1,0,0,0,0|2,1,0]=4 1286 B11R1.37 COc1ccc(cc1SC)C 62a_200000210301_100000186399 [0,1,0,0,0,0|2,1,0]=4 1287 B11R1.37 COc1ccc(cc1S[13CH3])C 62a_100000186399_200025704644 [0,1,0,0,0,0|2,1,0]=4 1288 B11R1.37 COc1ccc(cc1S[13CH3])C 62a_200025704644_100000186399 [0,1,0,0,0,0|2,1,0]=4 1289 B11R1.37 COc1ccc(nc1CO)C 34a_100000751967_200000210301 [0,1,0,0,0,0|3,0,0]=4 1290 B11R1.37 COc1nc(ccc1C=O)O 271570a_203496583355_100009864722 [0,1,0,0,0,0|2,0,0]=3 1291 B11R1.37 COc1nc(ccc1SC)C 62a_100010138632_200000210301 [0,1,0,0,0,0|3,0,0]=4 1292 B11R1.37 COc1nc(ccc1SC)C 62a_200000210301_100010138632 [0,1,0,0,0,0|3,0,0]=4 1293 B11R1.37 COc1nc(ccc1S[13CH3])C 62a_100010138632_200025704644 [0,1,0,0,0,0|3,0,0]=4 1294 B11R1.37 COc1nc(ccc1S[13CH3])C 62a_200025704644_100010138632 [0,1,0,0,0,0|3,0,0]=4 1295 B11R1.37 CSc1cc(ccc1C#N)C 62a_200000210301_100000693804 [0,1,0,0,0,0|1,1,1]=4 1296 B11R1.37 CSc1cc(ccc1C=O)Br 62a_100010146562_200000210301 [0,1,0,0,0,0|1,1,0]=3 1297 B11R1.37 CSc1cc(ccc1C=O)Br 62a_200000210301_100010146562 [0,1,0,0,0,0|1,1,0]=3 1298 B11R1.37 CSc1cc(ccc1C=O)C 62a_100011935181_200000210301 [0,1,0,0,0,0|0,1,0]=2 1299 B11R1.37 CSc1cc(ccc1C=O)C 62a_200000210301_100011935181 [0,1,0,0,0,0|0,1,0]=2 1300 B11R1.37 CSc1cc(ccc1C=O)F 62a_100000752949_200000210301 [0,1,0,0,0,0|1,1,0]=3 1301 B11R1.37 CSc1cc(ccc1C=O)F 62a_200000210301_100000752949 [0,1,0,0,0,0|1,1,0]=3 1302 B11R1.37 CSc1cc(ccc1C=O)O 62a_100011236494_200000210301 [0,1,0,0,0,0|1,1,0]=3 1303 B11R1.37 CSc1cc(ccc1C=O)O 62a_200000210301_100011236494 [0,1,0,0,0,0|1,1,0]=3 1304 B11R1.37 CSc1cc(ccc1NN)C 62a_100016996181_200000210301 [0,1,0,0,0,0|2,1,0]=4 1305 B11R1.37 CSc1cc(ccc1NN)C 62a_200000210301_100016996181 [0,1,0,0,0,0|2,1,0]=4 1306 B11R1.37 CSc1cc(ccc1S[13CH3])C 62a_200010709736_200025704644 [0,1,0,0,0,0|2,1,0]=4 1307 B11R1.37 CSc1cc(ccc1S[13CH3])C 62a_200025704644_200010709736 [0,1,0,0,0,0|2,1,0]=4 1308 B11R1.37 CSc1cc(ncc1C=O)F 62a_100009862493_200000210301 [0,1,0,0,0,0|2,1,0]=4 1309 B11R1.37 CSc1cc(ncc1C=O)F 62a_200000210301_100009862493 [0,1,0,0,0,0|2,1,0]=4 1310 B11R1.37 CSc1ccc(cc1C#N)C 62a_200000210301_100011935190 [0,1,0,0,0,0|3,0,0]=4 1311 B11R1.37 CSc1ccc(cc1C=O)C 62a_100011551863_200000210301 [0,1,0,0,0,0|2,0,1]=4 1312 B11R1.37 CSc1ccc(cc1C=O)C 62a_200000210301_100011551863 [0,1,0,0,0,0|2,0,1]=4 1313 B11R1.37 CSc1ccc(cc1CO)Br 62a_100011356890_200000210301 [0,1,0,0,0,0|3,0,0]=4 1314 B11R1.37 CSc1ccc(cc1CO)Br 62a_200000210301_100011356890 [0,1,0,0,0,0|3,0,0]=4 1315 B11R1.37 CSc1ccc(cc1CO)C 62a_100012361352_200000210301 [0,1,0,0,0,0|2,0,0]=3 1316 B11R1.37 CSc1ccc(cc1CO)C 62a_200000210301_100012361352 [0,1,0,0,0,0|2,0,0]=3 1317 B11R1.37 CSc1ccc(cc1CO)F 62a_100011217561_200000210301 [0,1,0,0,0,0|3,0,0]=4 1318 B11R1.37 CSc1ccc(cc1CO)F 62a_200000210301_100011217561 [0,1,0,0,0,0|3,0,0]=4 1319 B11R1.37 CSc1ccc(cc1CO)N 62a_100012347228_200000210301 [0,1,0,0,0,0|3,0,0]=4 1320 B11R1.37 CSc1ccc(cc1CO)N 62a_200000210301_100012347228 [0,1,0,0,0,0|3,0,0]=4 1321 B11R1.37 CSc1ccc(cc1CO)O 62a_100012351483_200000210301 [0,1,0,0,0,0|3,0,0]=4 1322 B11R1.37 CSc1ccc(cc1CO)O 62a_200000210301_100012351483 [0,1,0,0,0,0|3,0,0]=4 1323 B11R1.37 CSc1ccc(cc1SC)C 62a_200000210301_200010201864 [0,1,0,0,0,0|2,1,0]=4 1324 B11R1.37 CSc1ccc(cc1SC)C 62a_200000210301_200010709736 [0,1,0,0,0,0|2,1,0]=4 1325 B11R1.37 CSc1ccc(cc1SC)C 62a_200010201864_200000210301 [0,1,0,0,0,0|2,1,0]=4 1326 B11R1.37 CSc1ccc(cc1SC)C 62a_200010709736_200000210301 [0,1,0,0,0,0|2,1,0]=4 1327 B11R1.37 CSc1ccc(cc1S[13CH3])C 62a_200010201864_200025704644 [0,1,0,0,0,0|2,1,0]=4 1328 B11R1.37 CSc1ccc(cc1S[13CH3])C 62a_200025704644_200010201864 [0,1,0,0,0,0|2,1,0]=4 1329 B11R1.37 CSc1ccc(nc1CO)C 62a_100010074375_200000210301 [0,1,0,0,0,0|3,0,0]=4 1330 B11R1.37 CSc1ccc(nc1CO)C 62a_200000210301_100010074375 [0,1,0,0,0,0|3,0,0]=4 1331 B11R1.37 CSc1cnc(cc1CO)C 62a_100015579599_200000210301 [0,1,0,0,0,0|3,0,0]=4 1332 B11R1.37 CSc1cnc(cc1CO)C 62a_200000210301_100015579599 [0,1,0,0,0,0|3,0,0]=4 1333 B11R1.37 CSc1nc(ccc1C=O)C 62a_100000085379_200000210301 [0,1,0,0,0,0|1,1,0]=3 1334 B11R1.37 CSc1nc(ccc1C=O)C 62a_200000210301_100000085379 [0,1,0,0,0,0|1,1,0]=3 1335 B11R1.37 CSc1nc(ccc1C=O)F 62a_100009846357_200000210301 [0,1,0,0,0,0|2,1,0]=4 1336 B11R1.37 CSc1nc(ccc1C=O)F 62a_200000210301_100009846357 [0,1,0,0,0,0|2,1,0]=4 1337 B11R1.37 CSc1ncc(cc1CO)C 62a_100000118064_200000210301 [0,1,0,0,0,0|3,0,0]=4 1338 B11R1.37 CSc1ncc(cc1CO)C 62a_200000210301_100000118064 [0,1,0,0,0,0|3,0,0]=4 1339 B11R1.37 Cc1cc(c(cn1)S[13CH3])CO 62a_100015579599_200025704644 [0,1,0,0,0,0|3,0,0]=4 1340 B11R1.37 Cc1cc(c(cn1)S[13CH3])CO 62a_200025704644_100015579599 [0,1,0,0,0,0|3,0,0]=4 1341 B11R1.37 Cc1ccc(c(c1)C#N)N[13CH3] 7a_100011934023_200025704644 [0,1,0,0,0,0|3,0,0]=4 1342 B11R1.37 Cc1ccc(c(c1)C#N)O[13CH3] 34a_200012180384_200025704644 [0,1,0,0,0,0|3,0,0]=4 1343 B11R1.37 Cc1ccc(c(c1)C#N)O[13CH3] 7a_200012180384_200025704644 [0,1,0,0,0,0|3,0,0]=4 1344 B11R1.37 Cc1ccc(c(c1)C#N)S[13CH3] 62a_200025704644_100011935190 [0,1,0,0,0,0|3,0,0]=4 1345 B11R1.37 Cc1ccc(c(c1)C=O)S[13CH3] 62a_100011551863_200025704644 [0,1,0,0,0,0|2,0,1]=4 1346 B11R1.37 Cc1ccc(c(c1)C=O)S[13CH3] 62a_200025704644_100011551863 [0,1,0,0,0,0|2,0,1]=4 1347 B11R1.37 Cc1ccc(c(c1)CO)N[13CH3] 34a_100011215565_200025704644 [0,1,0,0,0,0|2,0,0]=3 1348 B11R1.37 Cc1ccc(c(c1)CO)O[13CH3] 34a_200011846009_200025704644 [0,1,0,0,0,0|2,0,0]=3 1349 B11R1.37 Cc1ccc(c(c1)CO)O[13CH3] 7a_200011846009_200025704644 [0,1,0,0,0,0|2,0,0]=3 1350 B11R1.37 Cc1ccc(c(c1)CO)S[13CH3] 62a_100012361352_200025704644 [0,1,0,0,0,0|2,0,0]=3 1351 B11R1.37 Cc1ccc(c(c1)CO)S[13CH3] 62a_200025704644_100012361352 [0,1,0,0,0,0|2,0,0]=3 1352 B11R1.37 Cc1ccc(c(c1)N[13CH3])C#N 34a_100011218341_200025704644 [0,1,0,0,0,0|2,0,1]=4 1353 B11R1.37 Cc1ccc(c(c1)N[13CH3])C#N 7a_100011218341_200025704644 [0,1,0,0,0,0|2,0,1]=4 1354 B11R1.37 Cc1ccc(c(c1)N[13CH3])CO 34a_100000087799_200025704644 [0,1,0,0,0,0|1,0,2]=4 1355 B11R1.37 Cc1ccc(c(c1)O[13CH3])C#N 34a_100011640519_200025704644 [0,1,0,0,0,0|1,0,1]=3 1356 B11R1.37 Cc1ccc(c(c1)O[13CH3])C#N 7a_100011640519_200025704644 [0,1,0,0,0,0|1,0,1]=3 1357 B11R1.37 Cc1ccc(c(c1)S[13CH3])C#N 62a_200025704644_100000693804 [0,1,0,0,0,0|1,1,1]=4 1358 B11R1.37 Cc1ccc(c(c1)S[13CH3])C=O 62a_100011935181_200025704644 [0,1,0,0,0,0|0,1,0]=2 1359 B11R1.37 Cc1ccc(c(c1)S[13CH3])C=O 62a_200025704644_100011935181 [0,1,0,0,0,0|0,1,0]=2 1360 B11R1.37 Cc1ccc(c(c1)S[13CH3])NN 62a_100016996181_200025704644 [0,1,0,0,0,0|2,1,0]=4 1361 B11R1.37 Cc1ccc(c(c1)S[13CH3])NN 62a_200025704644_100016996181 [0,1,0,0,0,0|2,1,0]=4 1362 B11R1.37 Cc1ccc(c(n1)CO)O[13CH3] 34a_100000751967_200025704644 [0,1,0,0,0,0|3,0,0]=4 1363 B11R1.37 Cc1ccc(c(n1)CO)S[13CH3] 62a_100010074375_200025704644 [0,1,0,0,0,0|3,0,0]=4 1364 B11R1.37 Cc1ccc(c(n1)CO)S[13CH3] 62a_200025704644_100010074375 [0,1,0,0,0,0|3,0,0]=4 1365 B11R1.37 Cc1ccc(c(n1)S[13CH3])C=O 62a_100000085379_200025704644 [0,1,0,0,0,0|1,1,0]=3 1366 B11R1.37 Cc1ccc(c(n1)S[13CH3])C=O 62a_200025704644_100000085379 [0,1,0,0,0,0|1,1,0]=3 1367 B11R1.37 Cc1cnc(c(c1)CO)S[13CH3] 62a_100000118064_200025704644 [0,1,0,0,0,0|3,0,0]=4 1368 B11R1.37 Cc1cnc(c(c1)CO)S[13CH3] 62a_200025704644_100000118064 [0,1,0,0,0,0|3,0,0]=4 1369 B11R1.37 N#Cc1cc(ccc1C=O)O 271570a_203496583355_100012001787 [0,1,0,0,0,0|2,0,0]=3 1370 B11R1.37 O=Cc1ccc(cc1C=O)O 271570a_203496583355_200010077131 [0,1,0,0,0,0|1,0,1]=3 1371 B11R1.37 OCc1ccc(cc1CO)O 271570a_203496583355_100000719600 [0,1,0,0,0,0|1,0,2]=4 1372 B11R1.37 [13CH3]Nc1ccc(cc1CO)Br 34a_100012353972_200025704644 [0,1,0,0,0,0|3,0,0]=4 1373 B11R1.37 [13CH3]Nc1ccc(cc1CO)Cl 34a_100011214999_200025704644 [0,1,0,0,0,0|3,0,0]=4 1374 B11R1.37 [13CH3]Nc1ccc(cc1CO)F 34a_100011296978_200025704644 [0,1,0,0,0,0|3,0,0]=4 1375 B11R1.37 [13CH3]Oc1cc(ccc1C#N)Br 34a_100011934713_200025704644 [0,1,0,0,0,0|2,0,1]=4 1376 B11R1.37 [13CH3]Oc1cc(ccc1C#N)Br 7a_100011934713_200025704644 [0,1,0,0,0,0|2,0,1]=4 1377 B11R1.37 [13CH3]Oc1cc(ccc1C#N)Cl 34a_100000688488_200025704644 [0,1,0,0,0,0|2,0,1]=4 1378 B11R1.37 [13CH3]Oc1cc(ccc1C#N)Cl 7a_100000688488_200025704644 [0,1,0,0,0,0|2,0,1]=4 1379 B11R1.37 [13CH3]Oc1cc(ccc1C#N)F 34a_100012185923_200025704644 [0,1,0,0,0,0|2,0,1]=4 1380 B11R1.37 [13CH3]Oc1cc(ccc1C#N)F 7a_100012185923_200025704644 [0,1,0,0,0,0|2,0,1]=4 1381 B11R1.37 [13CH3]Oc1cc(ccc1C#N)N 34a_100000094571_200025704644 [0,1,0,0,0,0|2,0,1]=4 1382 B11R1.37 [13CH3]Oc1cc(ccc1C#N)N 7a_100000094571_200025704644 [0,1,0,0,0,0|2,0,1]=4 1383 B11R1.37 [13CH3]Oc1cc(ccc1CO)Br 34a_100000071718_200025704644 [0,1,0,0,0,0|1,0,2]=4 1384 B11R1.37 [13CH3]Oc1cc(ccc1CO)Br 7a_100000071718_200025704644 [0,1,0,0,0,0|1,0,2]=4 1385 B11R1.37 [13CH3]Oc1ccc(cc1CO)Br 34a_100000184703_200025704644 [0,1,0,0,0,0|3,0,0]=4 1386 B11R1.37 [13CH3]Oc1ccc(cc1CO)Br 7a_100000184703_200025704644 [0,1,0,0,0,0|3,0,0]=4 1387 B11R1.37 [13CH3]Oc1ccc(cc1CO)Cl 34a_100011218961_200025704644 [0,1,0,0,0,0|3,0,0]=4 1388 B11R1.37 [13CH3]Oc1ccc(cc1CO)Cl 7a_100011218961_200025704644 [0,1,0,0,0,0|3,0,0]=4 1389 B11R1.37 [13CH3]Oc1ccc(cc1CO)F 34a_100011291448_200025704644 [0,1,0,0,0,0|3,0,0]=4 1390 B11R1.37 [13CH3]Oc1ccc(cc1CO)F 7a_100011291448_200025704644 [0,1,0,0,0,0|3,0,0]=4 1391 B11R1.37 [13CH3]Oc1ccc(cc1CO)I 34a_100000049520_200025704644 [0,1,0,0,0,0|3,0,0]=4 1392 B11R1.37 [13CH3]Oc1ccc(cc1CO)I 7a_100000049520_200025704644 [0,1,0,0,0,0|3,0,0]=4 1393 B11R1.37 [13CH3]Sc1cc(ccc1C=O)Br 62a_100010146562_200025704644 [0,1,0,0,0,0|1,1,0]=3 1394 B11R1.37 [13CH3]Sc1cc(ccc1C=O)Br 62a_200025704644_100010146562 [0,1,0,0,0,0|1,1,0]=3 1395 B11R1.37 [13CH3]Sc1cc(ccc1C=O)F 62a_100000752949_200025704644 [0,1,0,0,0,0|1,1,0]=3 1396 B11R1.37 [13CH3]Sc1cc(ccc1C=O)F 62a_200025704644_100000752949 [0,1,0,0,0,0|1,1,0]=3 1397 B11R1.37 [13CH3]Sc1cc(ccc1C=O)O 62a_100011236494_200025704644 [0,1,0,0,0,0|1,1,0]=3 1398 B11R1.37 [13CH3]Sc1cc(ccc1C=O)O 62a_200025704644_100011236494 [0,1,0,0,0,0|1,1,0]=3 1399 B11R1.37 [13CH3]Sc1cc(ncc1C=O)F 62a_100009862493_200025704644 [0,1,0,0,0,0|2,1,0]=4 1400 B11R1.37 [13CH3]Sc1cc(ncc1C=O)F 62a_200025704644_100009862493 [0,1,0,0,0,0|2,1,0]=4 1401 B11R1.37 [13CH3]Sc1ccc(cc1CO)Br 62a_100011356890_200025704644 [0,1,0,0,0,0|3,0,0]=4 1402 B11R1.37 [13CH3]Sc1ccc(cc1CO)Br 62a_200025704644_100011356890 [0,1,0,0,0,0|3,0,0]=4 1403 B11R1.37 [13CH3]Sc1ccc(cc1CO)F 62a_100011217561_200025704644 [0,1,0,0,0,0|3,0,0]=4 1404 B11R1.37 [13CH3]Sc1ccc(cc1CO)F 62a_200025704644_100011217561 [0,1,0,0,0,0|3,0,0]=4 1405 B11R1.37 [13CH3]Sc1ccc(cc1CO)N 62a_100012347228_200025704644 [0,1,0,0,0,0|3,0,0]=4 1406 B11R1.37 [13CH3]Sc1ccc(cc1CO)N 62a_200025704644_100012347228 [0,1,0,0,0,0|3,0,0]=4 1407 B11R1.37 [13CH3]Sc1ccc(cc1CO)O 62a_100012351483_200025704644 [0,1,0,0,0,0|3,0,0]=4 1408 B11R1.37 [13CH3]Sc1ccc(cc1CO)O 62a_200025704644_100012351483 [0,1,0,0,0,0|3,0,0]=4 1409 B11R1.37 [13CH3]Sc1nc(ccc1C=O)F 62a_100009846357_200025704644 [0,1,0,0,0,0|2,1,0]=4 1410 B11R1.37 [13CH3]Sc1nc(ccc1C=O)F 62a_200025704644_100009846357 [0,1,0,0,0,0|2,1,0]=4 1411 B11R1.81 C=C=Cc1ccc(c[n+]1[O-])C 271570a_100015277604_100009819918 [0,1,0,0,0,0|2,0,1]=4 1412 B11R1.81 C=C=Cc1ccc(cc1Br)Br 271570a_100015277604_100011484698 [0,1,0,0,0,0|3,0,0]=4 1413 B11R1.81 C=C=Cc1ccc(cc1Br)C 271570a_100015277604_100009813563 [0,1,0,0,0,0|2,0,0]=3 1414 B11R1.81 C=C=Cc1ccc(cc1Br)Cl 271570a_100015277604_100011219703 [0,1,0,0,0,0|3,0,0]=4 1415 B11R1.81 C=C=Cc1ccc(cc1Br)F 271570a_100015277604_100011217111 [0,1,0,0,0,0|3,0,0]=4 1416 B11R1.81 C=C=Cc1ccc(cc1Br)N 271570a_100015277604_100000750458 [0,1,0,0,0,0|3,0,0]=4 1417 B11R1.81 C=C=Cc1ccc(cc1Br)O 271570a_100015277604_100000701344 [0,1,0,0,0,0|3,0,0]=4 1418 B11R1.81 C=C=Cc1ccc(cc1C)Br 271570a_100015277604_100000701812 [0,1,0,0,0,0|3,0,0]=4 1419 B11R1.81 C=C=Cc1ccc(cc1C)C 271570a_100015277604_100011217332 [0,1,0,0,0,0|2,0,0]=3 1420 B11R1.81 C=C=Cc1ccc(cc1C)Cl 271570a_100015277604_100011219607 [0,1,0,0,0,0|3,0,0]=4 1421 B11R1.81 C=C=Cc1ccc(cc1C)F 271570a_100015277604_100011205405 [0,1,0,0,0,0|3,0,0]=4 1422 B11R1.81 C=C=Cc1ccc(cc1C)N 271570a_100015277604_100000210723 [0,1,0,0,0,0|3,0,0]=4 1423 B11R1.81 C=C=Cc1ccc(cc1C)O 271570a_100015277604_100000729255 [0,1,0,0,0,0|3,0,0]=4 1424 B11R1.81 C=C=Cc1ccc(cc1Cl)Br 271570a_100015277604_100011216062 [0,1,0,0,0,0|3,0,0]=4 1425 B11R1.81 C=C=Cc1ccc(cc1Cl)C 271570a_100015277604_100011263221 [0,1,0,0,0,0|2,0,0]=3 1426 B11R1.81 C=C=Cc1ccc(cc1Cl)Cl 271570a_100015277604_100000699841 [0,1,0,0,0,0|3,0,0]=4 1427 B11R1.81 C=C=Cc1ccc(cc1Cl)F 271570a_100015277604_100000733362 [0,1,0,0,0,0|3,0,0]=4 1428 B11R1.81 C=C=Cc1ccc(cc1Cl)N 271570a_100015277604_100000761885 [0,1,0,0,0,0|3,0,0]=4 1429 B11R1.81 C=C=Cc1ccc(cc1Cl)O 271570a_100015277604_100000047559 [0,1,0,0,0,0|3,0,0]=4 1430 B11R1.81 C=C=Cc1ccc(cc1F)Br 271570a_100015277604_100009814013 [0,1,0,0,0,0|3,0,0]=4 1431 B11R1.81 C=C=Cc1ccc(cc1F)C 271570a_100015277604_100011216119 [0,1,0,0,0,0|2,0,0]=3 1432 B11R1.81 C=C=Cc1ccc(cc1F)Cl 271570a_100015277604_100011216042 [0,1,0,0,0,0|3,0,0]=4 1433 B11R1.81 C=C=Cc1ccc(cc1F)F 271570a_100015277604_100000750030 [0,1,0,0,0,0|3,0,0]=4 1434 B11R1.81 C=C=Cc1ccc(cc1F)N 271570a_100015277604_100011356925 [0,1,0,0,0,0|3,0,0]=4 1435 B11R1.81 C=C=Cc1ccc(cc1F)O 271570a_100015277604_100000755031 [0,1,0,0,0,0|3,0,0]=4 1436 B11R1.81 C=C=Cc1ccc(cc1N)Br 271570a_100015277604_100000743836 [0,1,0,0,0,0|3,0,0]=4 1437 B11R1.81 C=C=Cc1ccc(cc1N)C 271570a_100015277604_100011216686 [0,1,0,0,0,0|2,0,0]=3 1438 B11R1.81 C=C=Cc1ccc(cc1N)Cl 271570a_100015277604_100000761886 [0,1,0,0,0,0|3,0,0]=4 1439 B11R1.81 C=C=Cc1ccc(cc1N)F 271570a_100015277604_100011218093 [0,1,0,0,0,0|3,0,0]=4 1440 B11R1.81 C=C=Cc1ccc(cc1N)N 271570a_100015277604_200012175722 [0,1,0,0,0,0|3,0,0]=4 1441 B11R1.81 C=C=Cc1ccc(cc1N)O 271570a_100015277604_100011999798 [0,1,0,0,0,0|3,0,0]=4 1442 B11R1.81 C=C=Cc1ccc(cc1O)Br 271570a_100015277604_100012344904 [0,1,0,0,0,0|2,0,0]=3 1443 B11R1.81 C=C=Cc1ccc(cc1O)C 271570a_100015277604_100012002257 [0,1,0,0,0,0|1,0,0]=2 1444 B11R1.81 C=C=Cc1ccc(cc1O)Cl 271570a_100015277604_100000050036 [0,1,0,0,0,0|2,0,0]=3 1445 B11R1.81 C=C=Cc1ccc(cc1O)F 271570a_100015277604_100000690578 [0,1,0,0,0,0|2,0,0]=3 1446 B11R1.81 C=C=Cc1ccc(cc1O)O 271570a_100015277604_100009813921 [0,1,0,0,0,0|2,0,0]=3 1447 B11R1.81 C=C=Cc1ccc(nc1C)C 271570a_100015277604_100009813853 [0,1,0,0,0,0|3,0,0]=4 1448 B11R1.81 C=C=Cc1ccc(nc1F)C 271570a_100015277604_100010006597 [0,1,0,0,0,0|3,0,0]=4 1449 B11R1.81 C=C=Cc1ccc(nc1N)C 271570a_100015277604_100009816662 [0,1,0,0,0,0|3,0,0]=4 1450 B11R1.81 C=C=Cc1ccc(nc1O)C 271570a_100015277604_100009817604 [0,1,0,0,0,0|2,0,0]=3 1451 B11R1.81 C=C=Cc1cnc(cc1C)C 271570a_100015277604_100009819613 [0,1,0,0,0,0|3,0,0]=4 1452 B11R1.81 C=C=Cc1cnc(cc1N)C 271570a_100015277604_100009817891 [0,1,0,0,0,0|3,0,0]=4 1453 B11R1.81 C=C=Cc1cnc(cc1O)C 271570a_100015277604_100011016184 [0,1,0,0,0,0|2,0,0]=3 1454 B11R1.81 C=C=Cc1ncc(cc1C)C 271570a_100015277604_100009864548 [0,1,0,0,0,0|3,0,0]=4 1455 B11R1.81 C=C=Cc1ncc(cc1F)C 271570a_100015277604_100009819633 [0,1,0,0,0,0|3,0,0]=4 1456 B11R1.81 C=C=Cc1ncc(cc1N)C 271570a_100015277604_100000733613 [0,1,0,0,0,0|3,0,0]=4 1457 B11R1.81 C=C=Cc1ncc(cc1O)Br 271570a_100015277604_100010210634 [0,1,0,0,0,0|3,0,0]=4 1458 B11R1.81 C=C=Cc1ncc(cc1O)C 271570a_100015277604_100012000487 [0,1,0,0,0,0|2,0,0]=3 1459 B11R1.81 C=C=Cc1ncc(cc1O)Cl 271570a_100015277604_100010233512 [0,1,0,0,0,0|3,0,0]=4 1460 B11R1.81 C=C=Cc1ncc(cc1O)F 271570a_100015277604_100000079967 [0,1,0,0,0,0|3,0,0]=4 1461 B11R1.81 CC=Cc1ccc(c[n+]1[O-])C 271570a_100016259895_100009819918 [0,1,0,0,0,0|2,0,1]=4 1462 B11R1.81 CC=Cc1ccc(cc1Br)Br 271570a_100016259895_100011484698 [0,1,0,0,0,0|3,0,0]=4 1463 B11R1.81 CC=Cc1ccc(cc1Br)C 271570a_100016259895_100009813563 [0,1,0,0,0,0|2,0,0]=3 1464 B11R1.81 CC=Cc1ccc(cc1Br)Cl 271570a_100016259895_100011219703 [0,1,0,0,0,0|3,0,0]=4 1465 B11R1.81 CC=Cc1ccc(cc1Br)F 271570a_100016259895_100011217111 [0,1,0,0,0,0|3,0,0]=4 1466 B11R1.81 CC=Cc1ccc(cc1Br)N 271570a_100016259895_100000750458 [0,1,0,0,0,0|3,0,0]=4 1467 B11R1.81 CC=Cc1ccc(cc1Br)O 271570a_100016259895_100000701344 [0,1,0,0,0,0|3,0,0]=4 1468 B11R1.81 CC=Cc1ccc(cc1C)Br 271570a_100016259895_100000701812 [0,1,0,0,0,0|3,0,0]=4 1469 B11R1.81 CC=Cc1ccc(cc1C)C 271570a_100016259895_100011217332 [0,1,0,0,0,0|2,0,0]=3 1470 B11R1.81 CC=Cc1ccc(cc1C)Cl 271570a_100016259895_100011219607 [0,1,0,0,0,0|3,0,0]=4 1471 B11R1.81 CC=Cc1ccc(cc1C)F 271570a_100016259895_100011205405 [0,1,0,0,0,0|3,0,0]=4 1472 B11R1.81 CC=Cc1ccc(cc1C)N 271570a_100016259895_100000210723 [0,1,0,0,0,0|3,0,0]=4 1473 B11R1.81 CC=Cc1ccc(cc1C)O 271570a_100016259895_100000729255 [0,1,0,0,0,0|3,0,0]=4 1474 B11R1.81 CC=Cc1ccc(cc1Cl)Br 271570a_100016259895_100011216062 [0,1,0,0,0,0|3,0,0]=4 1475 B11R1.81 CC=Cc1ccc(cc1Cl)C 271570a_100016259895_100011263221 [0,1,0,0,0,0|2,0,0]=3 1476 B11R1.81 CC=Cc1ccc(cc1Cl)Cl 271570a_100016259895_100000699841 [0,1,0,0,0,0|3,0,0]=4 1477 B11R1.81 CC=Cc1ccc(cc1Cl)F 271570a_100016259895_100000733362 [0,1,0,0,0,0|3,0,0]=4 1478 B11R1.81 CC=Cc1ccc(cc1Cl)N 271570a_100016259895_100000761885 [0,1,0,0,0,0|3,0,0]=4 1479 B11R1.81 CC=Cc1ccc(cc1Cl)O 271570a_100016259895_100000047559 [0,1,0,0,0,0|3,0,0]=4 1480 B11R1.81 CC=Cc1ccc(cc1F)Br 271570a_100016259895_100009814013 [0,1,0,0,0,0|3,0,0]=4 1481 B11R1.81 CC=Cc1ccc(cc1F)C 271570a_100016259895_100011216119 [0,1,0,0,0,0|2,0,0]=3 1482 B11R1.81 CC=Cc1ccc(cc1F)Cl 271570a_100016259895_100011216042 [0,1,0,0,0,0|3,0,0]=4 1483 B11R1.81 CC=Cc1ccc(cc1F)F 271570a_100016259895_100000750030 [0,1,0,0,0,0|3,0,0]=4 1484 B11R1.81 CC=Cc1ccc(cc1F)N 271570a_100016259895_100011356925 [0,1,0,0,0,0|3,0,0]=4 1485 B11R1.81 CC=Cc1ccc(cc1F)O 271570a_100016259895_100000755031 [0,1,0,0,0,0|3,0,0]=4 1486 B11R1.81 CC=Cc1ccc(cc1N)Br 271570a_100016259895_100000743836 [0,1,0,0,0,0|3,0,0]=4 1487 B11R1.81 CC=Cc1ccc(cc1N)C 271570a_100016259895_100011216686 [0,1,0,0,0,0|2,0,0]=3 1488 B11R1.81 CC=Cc1ccc(cc1N)Cl 271570a_100016259895_100000761886 [0,1,0,0,0,0|3,0,0]=4 1489 B11R1.81 CC=Cc1ccc(cc1N)F 271570a_100016259895_100011218093 [0,1,0,0,0,0|3,0,0]=4 1490 B11R1.81 CC=Cc1ccc(cc1N)N 271570a_100016259895_200012175722 [0,1,0,0,0,0|3,0,0]=4 1491 B11R1.81 CC=Cc1ccc(cc1N)O 271570a_100016259895_100011999798 [0,1,0,0,0,0|3,0,0]=4 1492 B11R1.81 CC=Cc1ccc(cc1O)Br 271570a_100016259895_100012344904 [0,1,0,0,0,0|2,0,0]=3 1493 B11R1.81 CC=Cc1ccc(cc1O)C 271570a_100016259895_100012002257 [0,1,0,0,0,0|1,0,0]=2 1494 B11R1.81 CC=Cc1ccc(cc1O)Cl 271570a_100016259895_100000050036 [0,1,0,0,0,0|2,0,0]=3 1495 B11R1.81 CC=Cc1ccc(cc1O)F 271570a_100016259895_100000690578 [0,1,0,0,0,0|2,0,0]=3 1496 B11R1.81 CC=Cc1ccc(cc1O)O 271570a_100016259895_100009813921 [0,1,0,0,0,0|2,0,0]=3 1497 B11R1.81 CC=Cc1ccc(nc1C)C 271570a_100016259895_100009813853 [0,1,0,0,0,0|3,0,0]=4 1498 B11R1.81 CC=Cc1ccc(nc1F)C 271570a_100016259895_100010006597 [0,1,0,0,0,0|3,0,0]=4 1499 B11R1.81 CC=Cc1ccc(nc1N)C 271570a_100016259895_100009816662 [0,1,0,0,0,0|3,0,0]=4 1500 B11R1.81 CC=Cc1ccc(nc1O)C 271570a_100016259895_100009817604 [0,1,0,0,0,0|2,0,0]=3 1501 B11R1.81 CC=Cc1cnc(cc1C)C 271570a_100016259895_100009819613 [0,1,0,0,0,0|3,0,0]=4 1502 B11R1.81 CC=Cc1cnc(cc1N)C 271570a_100016259895_100009817891 [0,1,0,0,0,0|3,0,0]=4 1503 B11R1.81 CC=Cc1cnc(cc1O)C 271570a_100016259895_100011016184 [0,1,0,0,0,0|2,0,0]=3 1504 B11R1.81 CC=Cc1ncc(cc1C)C 271570a_100016259895_100009864548 [0,1,0,0,0,0|3,0,0]=4 1505 B11R1.81 CC=Cc1ncc(cc1F)C 271570a_100016259895_100009819633 [0,1,0,0,0,0|3,0,0]=4 1506 B11R1.81 CC=Cc1ncc(cc1N)C 271570a_100016259895_100000733613 [0,1,0,0,0,0|3,0,0]=4 1507 B11R1.81 CC=Cc1ncc(cc1O)Br 271570a_100016259895_100010210634 [0,1,0,0,0,0|3,0,0]=4 1508 B11R1.81 CC=Cc1ncc(cc1O)C 271570a_100016259895_100012000487 [0,1,0,0,0,0|2,0,0]=3 1509 B11R1.81 CC=Cc1ncc(cc1O)Cl 271570a_100016259895_100010233512 [0,1,0,0,0,0|3,0,0]=4 1510 B11R1.81 CC=Cc1ncc(cc1O)F 271570a_100016259895_100000079967 [0,1,0,0,0,0|3,0,0]=4 1511 B11R1.81 CCNc1ccc(cc1Br)C 34a_100000210942_100000210202 [0,1,0,0,0,0|2,0,1]=4 1512 B11R1.81 CCNc1ccc(cc1C)C 34a_100000736561_100000210202 [0,1,0,0,0,0|2,0,1]=4 1513 B11R1.81 CCNc1ccc(cc1C)C 7a_100000736561_100000210202 [0,1,0,0,0,0|2,0,1]=4 1514 B11R1.81 CCNc1ccc(cc1Cl)C 34a_100000210522_100000210202 [0,1,0,0,0,0|2,0,1]=4 1515 B11R1.81 CCNc1ccc(cc1F)C 34a_100000211023_100000210202 [0,1,0,0,0,0|2,0,1]=4 1516 B11R1.81 CCNc1ccc(cc1I)C 34a_100011356834_100000210202 [0,1,0,0,0,0|2,0,1]=4 1517 B11R1.81 CCNc1ccc(cc1O)Br 34a_100000739049_100000210202 [0,1,0,0,0,0|2,0,1]=4 1518 B11R1.81 CCNc1ccc(cc1O)C 34a_100000211527_100000210202 [0,1,0,0,0,0|1,0,1]=3 1519 B11R1.81 CCNc1ccc(cc1O)Cl 34a_100000185728_100000210202 [0,1,0,0,0,0|2,0,1]=4 1520 B11R1.81 CCNc1ccc(cc1O)F 34a_100000753323_100000210202 [0,1,0,0,0,0|2,0,1]=4 1521 B11R1.81 CCNc1ccc(cc1O)O 34a_100000106777_100000210202 [0,1,0,0,0,0|2,0,1]=4 1522 B11R1.81 CCOc1ccc(cc1Br)C 34a_100000210800_100000210202 [0,1,0,0,0,0|2,0,1]=4 1523 B11R1.81 CCOc1ccc(cc1Br)C 7a_100000210800_100000210202 [0,1,0,0,0,0|2,0,1]=4 1524 B11R1.81 CCOc1ccc(cc1C)C 34a_100000211776_100000210202 [0,1,0,0,0,0|2,0,1]=4 1525 B11R1.81 CCOc1ccc(cc1C)C 7a_100000211776_100000210202 [0,1,0,0,0,0|2,0,1]=4 1526 B11R1.81 CCOc1ccc(cc1Cl)C 34a_100000749699_100000210202 [0,1,0,0,0,0|2,0,1]=4 1527 B11R1.81 CCOc1ccc(cc1Cl)C 7a_100000749699_100000210202 [0,1,0,0,0,0|2,0,1]=4 1528 B11R1.81 CCOc1ccc(cc1F)C 34a_100011216688_100000210202 [0,1,0,0,0,0|2,0,1]=4 1529 B11R1.81 CCOc1ccc(cc1F)C 7a_100011216688_100000210202 [0,1,0,0,0,0|2,0,1]=4 1530 B11R1.81 CCOc1ccc(cc1I)C 34a_100000765521_100000210202 [0,1,0,0,0,0|2,0,1]=4 1531 B11R1.81 CCOc1ccc(cc1I)C 7a_100000765521_100000210202 [0,1,0,0,0,0|2,0,1]=4 1532 B11R1.81 CCOc1ccc(cc1N)C 34a_100011215204_100000210202 [0,1,0,0,0,0|2,0,1]=4 1533 B11R1.81 CCOc1ccc(cc1N)C 7a_100011215204_100000210202 [0,1,0,0,0,0|2,0,1]=4 1534 B11R1.81 CCOc1ccc(cc1O)C 271570a_203496583355_200000230997 [0,1,0,0,0,0|1,0,1]=3 1535 B11R1.81 CCOc1ccc(cc1O)F 271570a_203496583355_100000171695 [0,1,0,0,0,0|2,0,1]=4 1536 B11R1.81 CCSc1ccc(cc1Br)C 62a_100000210202_100009813563 [0,1,0,0,0,0|2,0,1]=4 1537 B11R1.81 CCSc1ccc(cc1Br)C 62a_100009813563_100000210202 [0,1,0,0,0,0|2,0,1]=4 1538 B11R1.81 CCSc1ccc(cc1C)C 62a_100000210202_100011217332 [0,1,0,0,0,0|2,0,1]=4 1539 B11R1.81 CCSc1ccc(cc1C)C 62a_100011217332_100000210202 [0,1,0,0,0,0|2,0,1]=4 1540 B11R1.81 CCSc1ccc(cc1Cl)C 62a_100000210202_100011263221 [0,1,0,0,0,0|2,0,1]=4 1541 B11R1.81 CCSc1ccc(cc1Cl)C 62a_100011263221_100000210202 [0,1,0,0,0,0|2,0,1]=4 1542 B11R1.81 CCSc1ccc(cc1F)C 62a_100000210202_100011216119 [0,1,0,0,0,0|2,0,1]=4 1543 B11R1.81 CCSc1ccc(cc1F)C 62a_100011216119_100000210202 [0,1,0,0,0,0|2,0,1]=4 1544 B11R1.81 CCSc1ccc(cc1N)C 62a_100000210202_100011216686 [0,1,0,0,0,0|2,0,1]=4 1545 B11R1.81 CCSc1ccc(cc1N)C 62a_100011216686_100000210202 [0,1,0,0,0,0|2,0,1]=4 1546 B11R1.81 CCSc1ccc(cc1O)Br 62a_100000210202_100012344904 [0,1,0,0,0,0|2,0,1]=4 1547 B11R1.81 CCSc1ccc(cc1O)Br 62a_100012344904_100000210202 [0,1,0,0,0,0|2,0,1]=4 1548 B11R1.81 CCSc1ccc(cc1O)C 62a_100000210202_100012002257 [0,1,0,0,0,0|1,0,1]=3 1549 B11R1.81 CCSc1ccc(cc1O)C 62a_100012002257_100000210202 [0,1,0,0,0,0|1,0,1]=3 1550 B11R1.81 CCSc1ccc(cc1O)Cl 62a_100000050036_100000210202 [0,1,0,0,0,0|2,0,1]=4 1551 B11R1.81 CCSc1ccc(cc1O)Cl 62a_100000210202_100000050036 [0,1,0,0,0,0|2,0,1]=4 1552 B11R1.81 CCSc1ccc(cc1O)F 62a_100000210202_100000690578 [0,1,0,0,0,0|2,0,1]=4 1553 B11R1.81 CCSc1ccc(cc1O)F 62a_100000690578_100000210202 [0,1,0,0,0,0|2,0,1]=4 1554 B11R1.81 CCSc1ccc(cc1O)O 62a_100000210202_100009813921 [0,1,0,0,0,0|2,0,1]=4 1555 B11R1.81 CCSc1ccc(nc1O)C 62a_100000210202_100009817604 [0,1,0,0,0,0|2,0,1]=4 1556 B11R1.81 CCSc1ccc(nc1O)C 62a_100009817604_100000210202 [0,1,0,0,0,0|2,0,1]=4 1557 B11R1.81 CCSc1cnc(cc1O)C 62a_100000210202_100011016184 [0,1,0,0,0,0|2,0,1]=4 1558 B11R1.81 CCSc1cnc(cc1O)C 62a_100011016184_100000210202 [0,1,0,0,0,0|2,0,1]=4 1559 B11R1.81 CCSc1ncc(cc1O)C 62a_100000210202_100012000487 [0,1,0,0,0,0|2,0,1]=4 1560 B11R1.81 CNCc1ccc(cc1Br)C 207a_100102657272_100000692596 [0,1,0,0,0,0|2,0,1]=4 1561 B11R1.81 CNCc1ccc(cc1Br)C 26a_100102657272_100000210800 [0,1,0,0,0,0|2,0,1]=4 1562 B11R1.81 CNCc1ccc(cc1Br)C 270004a_106832991635_100000692596 [0,1,0,0,0,0|2,0,1]=4 1563 B11R1.81 CNCc1ccc(cc1C)C 207a_100102657272_100000211342 [0,1,0,0,0,0|2,0,1]=4 1564 B11R1.81 CNCc1ccc(cc1C)C 2230a_106832991635_100011219618 [0,1,0,0,0,0|2,0,1]=4 1565 B11R1.81 CNCc1ccc(cc1C)C 270004a_106832991635_100000211342 [0,1,0,0,0,0|2,0,1]=4 1566 B11R1.81 CNCc1ccc(cc1C)C 34a_100000737523_200000210301 [0,1,0,0,0,0|2,0,1]=4 1567 B11R1.81 CNCc1ccc(cc1C)C 34a_100102657272_100011219618 [0,1,0,0,0,0|2,0,1]=4 1568 B11R1.81 CNCc1ccc(cc1C)C 7a_106832991635_100011219618 [0,1,0,0,0,0|2,0,1]=4 1569 B11R1.81 CNCc1ccc(cc1Cl)C 207a_100102657272_100011935181 [0,1,0,0,0,0|2,0,1]=4 1570 B11R1.81 CNCc1ccc(cc1Cl)C 2230a_106832991635_100012349684 [0,1,0,0,0,0|2,0,1]=4 1571 B11R1.81 CNCc1ccc(cc1Cl)C 26a_100102657272_100000749699 [0,1,0,0,0,0|2,0,1]=4 1572 B11R1.81 CNCc1ccc(cc1Cl)C 270004a_106832991635_100011935181 [0,1,0,0,0,0|2,0,1]=4 1573 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100011997539_200000210301 [0,1,0,0,0,0|2,0,1]=4 1574 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100102657272_100012349684 [0,1,0,0,0,0|2,0,1]=4 1575 B11R1.81 CNCc1ccc(cc1Cl)C 7a_106832991635_100012349684 [0,1,0,0,0,0|2,0,1]=4 1576 B11R1.81 CNCc1ccc(cc1F)C 207a_100102657272_100011217368 [0,1,0,0,0,0|2,0,1]=4 1577 B11R1.81 CNCc1ccc(cc1F)C 2230a_106832991635_100011217900 [0,1,0,0,0,0|2,0,1]=4 1578 B11R1.81 CNCc1ccc(cc1F)C 270004a_106832991635_100011217368 [0,1,0,0,0,0|2,0,1]=4 1579 B11R1.81 CNCc1ccc(cc1F)C 34a_100102657272_100012002367 [0,1,0,0,0,0|2,0,1]=4 1580 B11R1.81 CNCc1ccc(cc1F)C 34a_100102887089_200000210301 [0,1,0,0,0,0|2,0,1]=4 1581 B11R1.81 CNCc1ccc(cc1F)C 7a_106832991635_100012002367 [0,1,0,0,0,0|2,0,1]=4 1582 B11R1.81 CNCc1ccc(cc1I)C 207a_100102657272_100010150104 [0,1,0,0,0,0|2,0,1]=4 1583 B11R1.81 CNCc1ccc(cc1I)C 270004a_106832991635_100010150104 [0,1,0,0,0,0|2,0,1]=4 1584 B11R1.81 CNCc1ccc(cc1O)F 271570a_203496583355_200011192132 [0,1,0,0,0,0|2,0,1]=4 1585 B11R1.81 COCc1ccc(cc1C)C 34a_100011215341_200000210301 [0,1,0,0,0,0|1,0,2]=4 1586 B11R1.81 COCc1ccc(cc1C)C 34a_100138415774_100011219618 [0,1,0,0,0,0|1,0,2]=4 1587 B11R1.81 COCc1ccc(cc1C)C 7a_100011215341_200000210301 [0,1,0,0,0,0|1,0,2]=4 1588 B11R1.81 COCc1ccc(cc1Cl)C 34a_100000720314_200000210301 [0,1,0,0,0,0|1,0,2]=4 1589 B11R1.81 COCc1ccc(cc1Cl)C 34a_100138415774_100012349684 [0,1,0,0,0,0|1,0,2]=4 1590 B11R1.81 COCc1ccc(cc1Cl)C 7a_100000720314_200000210301 [0,1,0,0,0,0|1,0,2]=4 1591 B11R1.81 COCc1ccc(cc1F)C 34a_100011216587_200000210301 [0,1,0,0,0,0|1,0,2]=4 1592 B11R1.81 COCc1ccc(cc1F)C 34a_100138415774_100012002367 [0,1,0,0,0,0|1,0,2]=4 1593 B11R1.81 COCc1ccc(cc1F)C 7a_100011216587_200000210301 [0,1,0,0,0,0|1,0,2]=4 1594 B11R1.81 COCc1ccc(cc1N)C 34a_100000087799_200000210301 [0,1,0,0,0,0|1,0,2]=4 1595 B11R1.81 COCc1ccc(cc1N)C 7a_100000087799_200000210301 [0,1,0,0,0,0|1,0,2]=4 1596 B11R1.81 CSCc1ccc(cc1C)C 62a_100011219618_200000210301 [0,1,0,0,0,0|1,1,1]=4 1597 B11R1.81 CSCc1ccc(cc1C)C 62a_200000210301_100011219618 [0,1,0,0,0,0|1,1,1]=4 1598 B11R1.81 CSCc1ccc(cc1Cl)C 62a_100012349684_200000210301 [0,1,0,0,0,0|1,1,1]=4 1599 B11R1.81 CSCc1ccc(cc1Cl)C 62a_200000210301_100012349684 [0,1,0,0,0,0|1,1,1]=4 1600 B11R1.81 CSCc1ccc(cc1F)C 62a_100011217900_200000210301 [0,1,0,0,0,0|1,1,1]=4 1601 B11R1.81 CSCc1ccc(cc1F)C 62a_200000210301_100011217900 [0,1,0,0,0,0|1,1,1]=4 1602 B11R1.81 Cc1cc(c(cn1)SCF)O 62a_100011016184_100015361967 [0,1,0,0,0,0|2,0,1]=4 1603 B11R1.81 Cc1cc(c(cn1)SCF)O 62a_100015361967_100011016184 [0,1,0,0,0,0|2,0,1]=4 1604 B11R1.81 Cc1ccc(c(c1)Br)NCF 34a_100000210942_100015361967 [0,1,0,0,0,0|2,0,1]=4 1605 B11R1.81 Cc1ccc(c(c1)Br)OCF 34a_100000210800_100015361967 [0,1,0,0,0,0|2,0,1]=4 1606 B11R1.81 Cc1ccc(c(c1)Br)OCF 7a_100000210800_100015361967 [0,1,0,0,0,0|2,0,1]=4 1607 B11R1.81 Cc1ccc(c(c1)Br)SCF 62a_100009813563_100015361967 [0,1,0,0,0,0|2,0,1]=4 1608 B11R1.81 Cc1ccc(c(c1)Br)SCF 62a_100015361967_100009813563 [0,1,0,0,0,0|2,0,1]=4 1609 B11R1.81 Cc1ccc(c(c1)C)CN[13CH3] 34a_100000737523_200025704644 [0,1,0,0,0,0|2,0,1]=4 1610 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 34a_100011215341_200025704644 [0,1,0,0,0,0|1,0,2]=4 1611 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 7a_100011215341_200025704644 [0,1,0,0,0,0|1,0,2]=4 1612 B11R1.81 Cc1ccc(c(c1)C)CS[13CH3] 62a_100011219618_200025704644 [0,1,0,0,0,0|1,1,1]=4 1613 B11R1.81 Cc1ccc(c(c1)C)CS[13CH3] 62a_200025704644_100011219618 [0,1,0,0,0,0|1,1,1]=4 1614 B11R1.81 Cc1ccc(c(c1)C)NCF 34a_100000736561_100015361967 [0,1,0,0,0,0|2,0,1]=4 1615 B11R1.81 Cc1ccc(c(c1)C)NCF 7a_100000736561_100015361967 [0,1,0,0,0,0|2,0,1]=4 1616 B11R1.81 Cc1ccc(c(c1)C)OCF 34a_100000211776_100015361967 [0,1,0,0,0,0|2,0,1]=4 1617 B11R1.81 Cc1ccc(c(c1)C)OCF 7a_100000211776_100015361967 [0,1,0,0,0,0|2,0,1]=4 1618 B11R1.81 Cc1ccc(c(c1)C)SCF 62a_100011217332_100015361967 [0,1,0,0,0,0|2,0,1]=4 1619 B11R1.81 Cc1ccc(c(c1)C)SCF 62a_100015361967_100011217332 [0,1,0,0,0,0|2,0,1]=4 1620 B11R1.81 Cc1ccc(c(c1)Cl)CN[13CH3] 34a_100011997539_200025704644 [0,1,0,0,0,0|2,0,1]=4 1621 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 34a_100000720314_200025704644 [0,1,0,0,0,0|1,0,2]=4 1622 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 7a_100000720314_200025704644 [0,1,0,0,0,0|1,0,2]=4 1623 B11R1.81 Cc1ccc(c(c1)Cl)CS[13CH3] 62a_100012349684_200025704644 [0,1,0,0,0,0|1,1,1]=4 1624 B11R1.81 Cc1ccc(c(c1)Cl)CS[13CH3] 62a_200025704644_100012349684 [0,1,0,0,0,0|1,1,1]=4 1625 B11R1.81 Cc1ccc(c(c1)Cl)NCF 34a_100000210522_100015361967 [0,1,0,0,0,0|2,0,1]=4 1626 B11R1.81 Cc1ccc(c(c1)Cl)OCF 34a_100000749699_100015361967 [0,1,0,0,0,0|2,0,1]=4 1627 B11R1.81 Cc1ccc(c(c1)Cl)OCF 7a_100000749699_100015361967 [0,1,0,0,0,0|2,0,1]=4 1628 B11R1.81 Cc1ccc(c(c1)Cl)SCF 62a_100011263221_100015361967 [0,1,0,0,0,0|2,0,1]=4 1629 B11R1.81 Cc1ccc(c(c1)Cl)SCF 62a_100015361967_100011263221 [0,1,0,0,0,0|2,0,1]=4 1630 B11R1.81 Cc1ccc(c(c1)F)CN[13CH3] 34a_100102887089_200025704644 [0,1,0,0,0,0|2,0,1]=4 1631 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 34a_100011216587_200025704644 [0,1,0,0,0,0|1,0,2]=4 1632 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 7a_100011216587_200025704644 [0,1,0,0,0,0|1,0,2]=4 1633 B11R1.81 Cc1ccc(c(c1)F)CS[13CH3] 62a_100011217900_200025704644 [0,1,0,0,0,0|1,1,1]=4 1634 B11R1.81 Cc1ccc(c(c1)F)CS[13CH3] 62a_200025704644_100011217900 [0,1,0,0,0,0|1,1,1]=4 1635 B11R1.81 Cc1ccc(c(c1)F)NCF 34a_100000211023_100015361967 [0,1,0,0,0,0|2,0,1]=4 1636 B11R1.81 Cc1ccc(c(c1)F)OCF 34a_100011216688_100015361967 [0,1,0,0,0,0|2,0,1]=4 1637 B11R1.81 Cc1ccc(c(c1)F)OCF 7a_100011216688_100015361967 [0,1,0,0,0,0|2,0,1]=4 1638 B11R1.81 Cc1ccc(c(c1)F)SCF 62a_100011216119_100015361967 [0,1,0,0,0,0|2,0,1]=4 1639 B11R1.81 Cc1ccc(c(c1)F)SCF 62a_100015361967_100011216119 [0,1,0,0,0,0|2,0,1]=4 1640 B11R1.81 Cc1ccc(c(c1)I)NCF 34a_100011356834_100015361967 [0,1,0,0,0,0|2,0,1]=4 1641 B11R1.81 Cc1ccc(c(c1)I)OCF 34a_100000765521_100015361967 [0,1,0,0,0,0|2,0,1]=4 1642 B11R1.81 Cc1ccc(c(c1)I)OCF 7a_100000765521_100015361967 [0,1,0,0,0,0|2,0,1]=4 1643 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 34a_100000087799_200025704644 [0,1,0,0,0,0|1,0,2]=4 1644 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 7a_100000087799_200025704644 [0,1,0,0,0,0|1,0,2]=4 1645 B11R1.81 Cc1ccc(c(c1)N)OCF 34a_100011215204_100015361967 [0,1,0,0,0,0|2,0,1]=4 1646 B11R1.81 Cc1ccc(c(c1)N)OCF 7a_100011215204_100015361967 [0,1,0,0,0,0|2,0,1]=4 1647 B11R1.81 Cc1ccc(c(c1)N)SCF 62a_100011216686_100015361967 [0,1,0,0,0,0|2,0,1]=4 1648 B11R1.81 Cc1ccc(c(c1)N)SCF 62a_100015361967_100011216686 [0,1,0,0,0,0|2,0,1]=4 1649 B11R1.81 Cc1ccc(c(c1)O)NCF 34a_100000211527_100015361967 [0,1,0,0,0,0|1,0,1]=3 1650 B11R1.81 Cc1ccc(c(c1)O)SCF 62a_100012002257_100015361967 [0,1,0,0,0,0|1,0,1]=3 1651 B11R1.81 Cc1ccc(c(c1)O)SCF 62a_100015361967_100012002257 [0,1,0,0,0,0|1,0,1]=3 1652 B11R1.81 Cc1ccc(c(n1)O)SCF 62a_100009817604_100015361967 [0,1,0,0,0,0|2,0,1]=4 1653 B11R1.81 Cc1ccc(c(n1)O)SCF 62a_100015361967_100009817604 [0,1,0,0,0,0|2,0,1]=4 1654 B11R1.81 Cc1cnc(c(c1)O)SCF 62a_100015361967_100012000487 [0,1,0,0,0,0|2,0,1]=4 1655 B11R1.81 N#CCc1ccc(cc1O)F 271570a_203496583355_100011207962 [0,1,0,0,0,0|2,0,1]=4 1656 B11R1.81 N#CSc1ccc(cc1O)F 271570a_203496583355_100025703547 [0,1,0,0,0,0|2,0,1]=4 1657 B11R1.81 N#CSc1ccc(cc1O)N 271570a_203496583355_200012361504 [0,1,0,0,0,0|2,0,1]=4 1658 B11R1.81 Oc1cc(ccc1NCF)Br 34a_100000739049_100015361967 [0,1,0,0,0,0|2,0,1]=4 1659 B11R1.81 Oc1cc(ccc1NCF)Cl 34a_100000185728_100015361967 [0,1,0,0,0,0|2,0,1]=4 1660 B11R1.81 Oc1cc(ccc1NCF)F 34a_100000753323_100015361967 [0,1,0,0,0,0|2,0,1]=4 1661 B11R1.81 Oc1cc(ccc1SCF)Br 62a_100012344904_100015361967 [0,1,0,0,0,0|2,0,1]=4 1662 B11R1.81 Oc1cc(ccc1SCF)Br 62a_100015361967_100012344904 [0,1,0,0,0,0|2,0,1]=4 1663 B11R1.81 Oc1cc(ccc1SCF)Cl 62a_100000050036_100015361967 [0,1,0,0,0,0|2,0,1]=4 1664 B11R1.81 Oc1cc(ccc1SCF)Cl 62a_100015361967_100000050036 [0,1,0,0,0,0|2,0,1]=4 1665 B11R1.81 Oc1cc(ccc1SCF)F 62a_100000690578_100015361967 [0,1,0,0,0,0|2,0,1]=4 1666 B11R1.81 Oc1cc(ccc1SCF)F 62a_100015361967_100000690578 [0,1,0,0,0,0|2,0,1]=4 1667 B11R1.81 Oc1ccc(c(c1)O)NCF 34a_100000106777_100015361967 [0,1,0,0,0,0|2,0,1]=4 1668 B11R1.81 Oc1ccc(c(c1)O)SCF 62a_100015361967_100009813921 [0,1,0,0,0,0|2,0,1]=4 1669 B11R1.166 C=C(C)c1ccc(c[n+]1[O-])C 271570a_100000694244_100009819918 [0,1,0,0,0,0|2,0,1]=4 1670 B11R1.166 C=C(C)c1ccc(cc1Br)Br 271570a_100000694244_100011484698 [0,1,0,0,0,0|3,0,0]=4 1671 B11R1.166 C=C(C)c1ccc(cc1Br)C 271570a_100000694244_100009813563 [0,1,0,0,0,0|2,0,0]=3 1672 B11R1.166 C=C(C)c1ccc(cc1Br)Cl 271570a_100000694244_100011219703 [0,1,0,0,0,0|3,0,0]=4 1673 B11R1.166 C=C(C)c1ccc(cc1Br)F 271570a_100000694244_100011217111 [0,1,0,0,0,0|3,0,0]=4 1674 B11R1.166 C=C(C)c1ccc(cc1Br)N 271570a_100000694244_100000750458 [0,1,0,0,0,0|3,0,0]=4 1675 B11R1.166 C=C(C)c1ccc(cc1Br)O 271570a_100000694244_100000701344 [0,1,0,0,0,0|3,0,0]=4 1676 B11R1.166 C=C(C)c1ccc(cc1C)Br 271570a_100000694244_100000701812 [0,1,0,0,0,0|3,0,0]=4 1677 B11R1.166 C=C(C)c1ccc(cc1C)C 271570a_100000694244_100011217332 [0,1,0,0,0,0|2,0,0]=3 1678 B11R1.166 C=C(C)c1ccc(cc1C)Cl 271570a_100000694244_100011219607 [0,1,0,0,0,0|3,0,0]=4 1679 B11R1.166 C=C(C)c1ccc(cc1C)F 271570a_100000694244_100011205405 [0,1,0,0,0,0|3,0,0]=4 1680 B11R1.166 C=C(C)c1ccc(cc1C)N 271570a_100000694244_100000210723 [0,1,0,0,0,0|3,0,0]=4 1681 B11R1.166 C=C(C)c1ccc(cc1C)O 271570a_100000694244_100000729255 [0,1,0,0,0,0|3,0,0]=4 1682 B11R1.166 C=C(C)c1ccc(cc1Cl)Br 271570a_100000694244_100011216062 [0,1,0,0,0,0|3,0,0]=4 1683 B11R1.166 C=C(C)c1ccc(cc1Cl)C 271570a_100000694244_100011263221 [0,1,0,0,0,0|2,0,0]=3 1684 B11R1.166 C=C(C)c1ccc(cc1Cl)Cl 271570a_100000694244_100000699841 [0,1,0,0,0,0|3,0,0]=4 1685 B11R1.166 C=C(C)c1ccc(cc1Cl)F 271570a_100000694244_100000733362 [0,1,0,0,0,0|3,0,0]=4 1686 B11R1.166 C=C(C)c1ccc(cc1Cl)N 271570a_100000694244_100000761885 [0,1,0,0,0,0|3,0,0]=4 1687 B11R1.166 C=C(C)c1ccc(cc1Cl)O 271570a_100000694244_100000047559 [0,1,0,0,0,0|3,0,0]=4 1688 B11R1.166 C=C(C)c1ccc(cc1F)Br 271570a_100000694244_100009814013 [0,1,0,0,0,0|3,0,0]=4 1689 B11R1.166 C=C(C)c1ccc(cc1F)C 271570a_100000694244_100011216119 [0,1,0,0,0,0|2,0,0]=3 1690 B11R1.166 C=C(C)c1ccc(cc1F)Cl 271570a_100000694244_100011216042 [0,1,0,0,0,0|3,0,0]=4 1691 B11R1.166 C=C(C)c1ccc(cc1F)F 271570a_100000694244_100000750030 [0,1,0,0,0,0|3,0,0]=4 1692 B11R1.166 C=C(C)c1ccc(cc1F)N 271570a_100000694244_100011356925 [0,1,0,0,0,0|3,0,0]=4 1693 B11R1.166 C=C(C)c1ccc(cc1F)O 271570a_100000694244_100000755031 [0,1,0,0,0,0|3,0,0]=4 1694 B11R1.166 C=C(C)c1ccc(cc1N)Br 271570a_100000694244_100000743836 [0,1,0,0,0,0|3,0,0]=4 1695 B11R1.166 C=C(C)c1ccc(cc1N)C 271570a_100000694244_100011216686 [0,1,0,0,0,0|2,0,0]=3 1696 B11R1.166 C=C(C)c1ccc(cc1N)Cl 271570a_100000694244_100000761886 [0,1,0,0,0,0|3,0,0]=4 1697 B11R1.166 C=C(C)c1ccc(cc1N)F 271570a_100000694244_100011218093 [0,1,0,0,0,0|3,0,0]=4 1698 B11R1.166 C=C(C)c1ccc(cc1N)N 271570a_100000694244_200012175722 [0,1,0,0,0,0|3,0,0]=4 1699 B11R1.166 C=C(C)c1ccc(cc1N)O 271570a_100000694244_100011999798 [0,1,0,0,0,0|3,0,0]=4 1700 B11R1.166 C=C(C)c1ccc(cc1O)Br 271570a_100000694244_100012344904 [0,1,0,0,0,0|2,0,0]=3 1701 B11R1.166 C=C(C)c1ccc(cc1O)C 271570a_100000694244_100012002257 [0,1,0,0,0,0|1,0,0]=2 1702 B11R1.166 C=C(C)c1ccc(cc1O)Cl 271570a_100000694244_100000050036 [0,1,0,0,0,0|2,0,0]=3 1703 B11R1.166 C=C(C)c1ccc(cc1O)F 271570a_100000694244_100000690578 [0,1,0,0,0,0|2,0,0]=3 1704 B11R1.166 C=C(C)c1ccc(cc1O)O 271570a_100000694244_100009813921 [0,1,0,0,0,0|2,0,0]=3 1705 B11R1.166 C=C(C)c1ccc(nc1C)C 271570a_100000694244_100009813853 [0,1,0,0,0,0|3,0,0]=4 1706 B11R1.166 C=C(C)c1ccc(nc1F)C 271570a_100000694244_100010006597 [0,1,0,0,0,0|3,0,0]=4 1707 B11R1.166 C=C(C)c1ccc(nc1N)C 271570a_100000694244_100009816662 [0,1,0,0,0,0|3,0,0]=4 1708 B11R1.166 C=C(C)c1ccc(nc1O)C 271570a_100000694244_100009817604 [0,1,0,0,0,0|2,0,0]=3 1709 B11R1.166 C=C(C)c1cnc(cc1C)C 271570a_100000694244_100009819613 [0,1,0,0,0,0|3,0,0]=4 1710 B11R1.166 C=C(C)c1cnc(cc1N)C 271570a_100000694244_100009817891 [0,1,0,0,0,0|3,0,0]=4 1711 B11R1.166 C=C(C)c1cnc(cc1O)C 271570a_100000694244_100011016184 [0,1,0,0,0,0|2,0,0]=3 1712 B11R1.166 C=C(C)c1ncc(cc1C)C 271570a_100000694244_100009864548 [0,1,0,0,0,0|3,0,0]=4 1713 B11R1.166 C=C(C)c1ncc(cc1F)C 271570a_100000694244_100009819633 [0,1,0,0,0,0|3,0,0]=4 1714 B11R1.166 C=C(C)c1ncc(cc1N)C 271570a_100000694244_100000733613 [0,1,0,0,0,0|3,0,0]=4 1715 B11R1.166 C=C(C)c1ncc(cc1O)Br 271570a_100000694244_100010210634 [0,1,0,0,0,0|3,0,0]=4 1716 B11R1.166 C=C(C)c1ncc(cc1O)C 271570a_100000694244_100012000487 [0,1,0,0,0,0|2,0,0]=3 1717 B11R1.166 C=C(C)c1ncc(cc1O)Cl 271570a_100000694244_100010233512 [0,1,0,0,0,0|3,0,0]=4 1718 B11R1.166 C=C(C)c1ncc(cc1O)F 271570a_100000694244_100000079967 [0,1,0,0,0,0|3,0,0]=4 1719 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [0,1,0,0,0,0|2,0,0]=3 1720 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [0,1,0,0,0,0|1,0,0]=2 1721 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [0,1,0,0,0,0|2,0,0]=3 1722 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [0,1,0,0,0,0|2,0,0]=3 1723 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [0,1,0,0,0,0|2,0,0]=3 1724 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [0,1,0,0,0,0|2,0,0]=3 1725 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [0,1,0,0,0,0|2,0,0]=3 1726 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [0,1,0,0,0,0|1,0,0]=2 1727 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [0,1,0,0,0,0|2,0,0]=3 1728 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [0,1,0,0,0,0|2,0,0]=3 1729 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [0,1,0,0,0,0|2,0,0]=3 1730 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [0,1,0,0,0,0|2,0,0]=3 1731 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [0,1,0,0,0,0|2,0,0]=3 1732 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [0,1,0,0,0,0|2,0,0]=3 1733 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [0,1,0,0,0,0|1,0,0]=2 1734 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [0,1,0,0,0,0|2,0,0]=3 1735 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [0,1,0,0,0,0|2,0,0]=3 1736 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [0,1,0,0,0,0|2,0,0]=3 1737 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [0,1,0,0,0,0|2,0,0]=3 1738 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [0,1,0,0,0,0|2,0,0]=3 1739 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [0,1,0,0,0,0|1,0,0]=2 1740 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [0,1,0,0,0,0|2,0,0]=3 1741 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [0,1,0,0,0,0|2,0,0]=3 1742 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [0,1,0,0,0,0|2,0,0]=3 1743 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [0,1,0,0,0,0|2,0,0]=3 1744 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [0,1,0,0,0,0|2,0,0]=3 1745 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [0,1,0,0,0,0|2,0,0]=3 1746 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [0,1,0,0,0,0|1,0,0]=2 1747 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [0,1,0,0,0,0|2,0,0]=3 1748 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [0,1,0,0,0,0|2,0,0]=3 1749 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [0,1,0,0,0,0|2,0,0]=3 1750 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [0,1,0,0,0,0|1,0,0]=2 1751 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [0,1,0,0,0,0|0,0,0]=1 1752 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [0,1,0,0,0,0|0,0,0]=1 1753 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [0,1,0,0,0,0|1,0,0]=2 1754 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [0,1,0,0,0,0|1,0,0]=2 1755 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [0,1,0,0,0,0|1,0,0]=2 1756 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [0,1,0,0,0,0|1,0,0]=2 1757 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [0,1,0,0,0,0|1,0,0]=2 1758 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [0,1,0,0,0,0|1,0,0]=2 1759 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [0,1,0,0,0,0|1,0,0]=2 1760 B11R1.166 CC(=O)c1ncc(cc1F)O 271570a_203496583355_100000696590 [0,1,0,0,0,0|3,0,0]=4 1761 B11R1.166 CN(C)c1ccc(cc1O)F 271570a_203496583355_100012349029 [0,1,0,0,0,0|3,0,0]=4 1762 B11R1.166 CN(C)c1ccc(cc1O)N 271570a_203496583355_100011534197 [0,1,0,0,0,0|3,0,0]=4 1763 B11R1.166 C[C@@H](N)c1ccc(cc1O)F 271570a_203496583355_100025704064 [0,1,0,0,0,0|2,0,1]=4 1764 B11R1.166 Cc1cc(ccc1C(=O)N)O 271570a_203496583355_100011327924 [0,1,0,0,0,0|2,0,0]=3 1765 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [0,1,0,0,0,0|2,0,0]=3 1766 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [0,1,0,0,0,0|2,0,0]=3 1767 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [0,1,0,0,0,0|2,0,0]=3 1768 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [0,1,0,0,0,0|2,0,0]=3 1769 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [0,1,0,0,0,0|2,0,0]=3 1770 B11R1.166 Cc1cc(ncc1C(=O)N)O 271570a_203496583355_200134614278 [0,1,0,0,0,0|3,0,0]=4 1771 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [0,1,0,0,0,0|1,0,0]=2 1772 B11R1.166 Cc1ccc(c(c1)Br)N(C)C 2230a_100000221369_200000210301 [0,1,0,0,0,0|3,0,0]=4 1773 B11R1.166 Cc1ccc(c(c1)Br)N(C)C 269982a_100000221369_200000210301 [0,1,0,0,0,0|3,0,0]=4 1774 B11R1.166 Cc1ccc(c(c1)Br)N(C)C 34a_100000221369_200000210301 [0,1,0,0,0,0|3,0,0]=4 1775 B11R1.166 Cc1ccc(c(c1)Br)N(C)[13CH3] 2230a_100000221369_200025704644 [0,1,0,0,0,0|3,0,0]=4 1776 B11R1.166 Cc1ccc(c(c1)Br)N(C)[13CH3] 269982a_100000221369_200025704644 [0,1,0,0,0,0|3,0,0]=4 1777 B11R1.166 Cc1ccc(c(c1)Br)N(C)[13CH3] 34a_100000221369_200025704644 [0,1,0,0,0,0|3,0,0]=4 1778 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [0,1,0,0,0,0|1,0,0]=2 1779 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [0,1,0,0,0,0|1,0,0]=2 1780 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [0,1,0,0,0,0|1,0,0]=2 1781 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [0,1,0,0,0,0|1,0,0]=2 1782 B11R1.166 Cc1ccc(c(c1)O)B(O)O 271570a_203496583355_200011068827 [0,1,0,0,0,0|1,0,1]=3 1783 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [0,1,0,0,0,0|0,0,0]=1 1784 B11R1.166 Cc1ccc(c(c1)O)N(C)C 271570a_203496583355_100012353700 [0,1,0,0,0,0|2,0,0]=3 1785 B11R1.166 Cc1ccc(c(n1)O)C(=O)N 271570a_203496583355_100000041523 [0,1,0,0,0,0|1,0,0]=2 1786 B11R1.166 NC(=O)c1ccc(cc1Br)O 271570a_203496583355_200010146565 [0,1,0,0,0,0|2,0,0]=3 1787 B11R1.166 NC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216903 [0,1,0,0,0,0|2,0,0]=3 1788 B11R1.166 NC(=O)c1ccc(cc1N)O 271570a_203496583355_100012349972 [0,1,0,0,0,0|2,0,0]=3 1789 B11R1.166 NC(=O)c1ccc(cc1O)Br 271570a_203496583355_100009815748 [0,1,0,0,0,0|1,0,0]=2 1790 B11R1.166 NC(=O)c1ccc(cc1O)F 271570a_203496583355_100000206404 [0,1,0,0,0,0|1,0,0]=2 1791 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [0,1,0,0,0,0|1,0,0]=2 1792 B11R1.166 NC(=O)c1ccc(nc1N)O 271570a_203496583355_100009875182 [0,1,0,0,0,0|3,0,0]=4 1793 B11R1.166 NC(=O)c1ncc(cc1F)O 271570a_203496583355_200010161073 [0,1,0,0,0,0|3,0,0]=4 1794 B11R1.166 NC(=O)c1ncc(cc1N)O 271570a_203496583355_100010235749 [0,1,0,0,0,0|3,0,0]=4 1795 B11R1.166 OB(O)c1ccc(cc1O)F 271570a_203496583355_100010175514 [0,1,0,0,0,0|2,0,1]=4 1796 B11R1.166 OB(O)c1ccc(cc1O)O 271570a_203496583355_100010158982 [0,1,0,0,0,0|2,0,1]=4 1797 B11R1.166 Oc1cc(ccc1C(F)F)F 271570a_203496583355_100010169823 [0,1,0,0,0,0|2,0,1]=4 1798 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [0,1,0,0,0,0|2,0,0]=3 1799 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [0,1,0,0,0,0|2,0,0]=3 1800 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [0,1,0,0,0,0|2,0,0]=3 1801 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [0,1,0,0,0,0|2,0,0]=3 1802 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [0,1,0,0,0,0|2,0,0]=3 1803 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [0,1,0,0,0,0|2,0,0]=3 1804 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [0,1,0,0,0,0|2,0,0]=3 1805 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [0,1,0,0,0,0|2,0,0]=3 1806 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [0,1,0,0,0,0|2,0,0]=3 1807 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [0,1,0,0,0,0|2,0,0]=3 1808 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [0,1,0,0,0,0|2,0,0]=3 1809 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [0,1,0,0,0,0|2,0,0]=3 1810 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [0,1,0,0,0,0|2,0,0]=3 1811 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [0,1,0,0,0,0|2,0,0]=3 1812 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [0,1,0,0,0,0|2,0,0]=3 1813 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [0,1,0,0,0,0|2,0,0]=3 1814 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [0,1,0,0,0,0|2,0,0]=3 1815 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [0,1,0,0,0,0|2,0,0]=3 1816 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [0,1,0,0,0,0|1,0,0]=2 1817 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [0,1,0,0,0,0|1,0,0]=2 1818 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [0,1,0,0,0,0|1,0,0]=2 1819 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [0,1,0,0,0,0|1,0,0]=2 1820 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [0,1,0,0,0,0|1,0,0]=2 1821 B11R1.277 C=Cc1cc(c([nH]c1=O)C)C 271570a_100011290941_100010064231 [0,1,0,0,0,0|2,0,1]=4 1822 B11R1.277 C=Cc1cc(c(cc1Br)Br)Br 271570a_100011290941_100010151546 [0,1,0,0,0,0|3,0,0]=4 1823 B11R1.277 C=Cc1cc(c(cc1Br)Br)F 271570a_100011290941_200010212206 [0,1,0,0,0,0|3,0,0]=4 1824 B11R1.277 C=Cc1cc(c(cc1Br)C)Br 271570a_100011290941_100012929169 [0,1,0,0,0,0|2,0,0]=3 1825 B11R1.277 C=Cc1cc(c(cc1Br)C)F 271570a_100011290941_200009814774 [0,1,0,0,0,0|2,0,0]=3 1826 B11R1.277 C=Cc1cc(c(cc1Br)Cl)F 271570a_100011290941_100010254745 [0,1,0,0,0,0|3,0,0]=4 1827 B11R1.277 C=Cc1cc(c(cc1Br)Cl)O 271570a_100011290941_100021297947 [0,1,0,0,0,0|3,0,0]=4 1828 B11R1.277 C=Cc1cc(c(cc1Br)F)C 271570a_100011290941_200009814773 [0,1,0,0,0,0|3,0,0]=4 1829 B11R1.277 C=Cc1cc(c(cc1Br)F)F 271570a_100011290941_100010259568 [0,1,0,0,0,0|3,0,0]=4 1830 B11R1.277 C=Cc1cc(c(cc1C)Br)C 271570a_100011290941_100011356911 [0,1,0,0,0,0|3,0,0]=4 1831 B11R1.277 C=Cc1cc(c(cc1C)Br)Cl 271570a_100011290941_200009814780 [0,1,0,0,0,0|3,0,0]=4 1832 B11R1.277 C=Cc1cc(c(cc1C)Br)F 271570a_100011290941_100011356895 [0,1,0,0,0,0|3,0,0]=4 1833 B11R1.277 C=Cc1cc(c(cc1C)C)C 271570a_100011290941_100000759388 [0,1,0,0,0,0|2,0,0]=3 1834 B11R1.277 C=Cc1cc(c(cc1C)C)N 271570a_100011290941_100000703630 [0,1,0,0,0,0|2,0,0]=3 1835 B11R1.277 C=Cc1cc(c(cc1C)Cl)C 271570a_100011290941_100012357408 [0,1,0,0,0,0|3,0,0]=4 1836 B11R1.277 C=Cc1cc(c(cc1C)F)Br 271570a_100011290941_100011216669 [0,1,0,0,0,0|3,0,0]=4 1837 B11R1.277 C=Cc1cc(c(cc1C)F)C 271570a_100011290941_100010212296 [0,1,0,0,0,0|3,0,0]=4 1838 B11R1.277 C=Cc1cc(c(cc1C)F)F 271570a_100011290941_100009815990 [0,1,0,0,0,0|3,0,0]=4 1839 B11R1.277 C=Cc1cc(c(cc1C)F)N 271570a_100011290941_100011014115 [0,1,0,0,0,0|3,0,0]=4 1840 B11R1.277 C=Cc1cc(c(cc1C)F)O 271570a_100011290941_100010068922 [0,1,0,0,0,0|3,0,0]=4 1841 B11R1.277 C=Cc1cc(c(cc1C)N)C 271570a_100011290941_100011934712 [0,1,0,0,0,0|3,0,0]=4 1842 B11R1.277 C=Cc1cc(c(cc1C)N)F 271570a_100011290941_100000691575 [0,1,0,0,0,0|3,0,0]=4 1843 B11R1.277 C=Cc1cc(c(cc1C)N)N 271570a_100011290941_100010080480 [0,1,0,0,0,0|3,0,0]=4 1844 B11R1.277 C=Cc1cc(c(cc1C)N)O 271570a_100011290941_200010107346 [0,1,0,0,0,0|3,0,0]=4 1845 B11R1.277 C=Cc1cc(c(cc1C)O)C 271570a_100011290941_100000698207 [0,1,0,0,0,0|3,0,0]=4 1846 B11R1.277 C=Cc1cc(c(cc1C)O)F 271570a_100011290941_100012355673 [0,1,0,0,0,0|3,0,0]=4 1847 B11R1.277 C=Cc1cc(c(cc1C)O)N 271570a_100011290941_200010235796 [0,1,0,0,0,0|3,0,0]=4 1848 B11R1.277 C=Cc1cc(c(cc1Cl)Br)C 271570a_100011290941_100010259621 [0,1,0,0,0,0|3,0,0]=4 1849 B11R1.277 C=Cc1cc(c(cc1Cl)Br)Cl 271570a_100011290941_200010244590 [0,1,0,0,0,0|3,0,0]=4 1850 B11R1.277 C=Cc1cc(c(cc1Cl)Br)F 271570a_100011290941_100010212230 [0,1,0,0,0,0|3,0,0]=4 1851 B11R1.277 C=Cc1cc(c(cc1Cl)Cl)Cl 271570a_100011290941_200011216203 [0,1,0,0,0,0|3,0,0]=4 1852 B11R1.277 C=Cc1cc(c(cc1Cl)Cl)N 271570a_100011290941_100016224655 [0,1,0,0,0,0|3,0,0]=4 1853 B11R1.277 C=Cc1cc(c(cc1Cl)F)F 271570a_100011290941_100012349977 [0,1,0,0,0,0|3,0,0]=4 1854 B11R1.277 C=Cc1cc(c(cc1Cl)O)N 271570a_100011290941_100011011175 [0,1,0,0,0,0|3,0,0]=4 1855 B11R1.277 C=Cc1cc(c(cc1F)Br)Br 271570a_100011290941_200010212210 [0,1,0,0,0,0|3,0,0]=4 1856 B11R1.277 C=Cc1cc(c(cc1F)Br)C 271570a_100011290941_200009814772 [0,1,0,0,0,0|3,0,0]=4 1857 B11R1.277 C=Cc1cc(c(cc1F)Br)F 271570a_100011290941_100011356857 [0,1,0,0,0,0|3,0,0]=4 1858 B11R1.277 C=Cc1cc(c(cc1F)C)Br 271570a_100011290941_100011068846 [0,1,0,0,0,0|2,0,0]=3 1859 B11R1.277 C=Cc1cc(c(cc1F)C)C 271570a_100011290941_100010197417 [0,1,0,0,0,0|2,0,0]=3 1860 B11R1.277 C=Cc1cc(c(cc1F)C)F 271570a_100011290941_100011219510 [0,1,0,0,0,0|2,0,0]=3 1861 B11R1.277 C=Cc1cc(c(cc1F)C)N 271570a_100011290941_100000717900 [0,1,0,0,0,0|2,0,0]=3 1862 B11R1.277 C=Cc1cc(c(cc1F)C)O 271570a_100011290941_100014242602 [0,1,0,0,0,0|2,0,0]=3 1863 B11R1.277 C=Cc1cc(c(cc1F)Cl)F 271570a_100011290941_100010142863 [0,1,0,0,0,0|3,0,0]=4 1864 B11R1.277 C=Cc1cc(c(cc1F)Cl)O 271570a_100011290941_100010735246 [0,1,0,0,0,0|3,0,0]=4 1865 B11R1.277 C=Cc1cc(c(cc1F)F)Br 271570a_100011290941_100011356914 [0,1,0,0,0,0|3,0,0]=4 1866 B11R1.277 C=Cc1cc(c(cc1F)F)C 271570a_100011290941_100000692463 [0,1,0,0,0,0|3,0,0]=4 1867 B11R1.277 C=Cc1cc(c(cc1F)F)F 271570a_100011290941_100000686897 [0,1,0,0,0,0|3,0,0]=4 1868 B11R1.277 C=Cc1cc(c(cc1F)F)N 271570a_100011290941_100000700208 [0,1,0,0,0,0|3,0,0]=4 1869 B11R1.277 C=Cc1cc(c(cc1F)F)O 271570a_100011290941_100012457948 [0,1,0,0,0,0|3,0,0]=4 1870 B11R1.277 C=Cc1cc(c(cc1F)N)C 271570a_100011290941_100000695870 [0,1,0,0,0,0|3,0,0]=4 1871 B11R1.277 C=Cc1cc(c(cc1F)N)F 271570a_100011290941_100000690247 [0,1,0,0,0,0|3,0,0]=4 1872 B11R1.277 C=Cc1cc(c(cc1F)N)N 271570a_100011290941_100000766667 [0,1,0,0,0,0|3,0,0]=4 1873 B11R1.277 C=Cc1cc(c(cc1F)N)O 271570a_100011290941_100013038943 [0,1,0,0,0,0|3,0,0]=4 1874 B11R1.277 C=Cc1cc(c(cc1F)O)F 271570a_100011290941_100011830439 [0,1,0,0,0,0|3,0,0]=4 1875 B11R1.277 C=Cc1cc(c(cc1F)O)N 271570a_100011290941_100012359894 [0,1,0,0,0,0|3,0,0]=4 1876 B11R1.277 C=Cc1cc(c(cc1N)Br)C 271570a_100011290941_200015600912 [0,1,0,0,0,0|3,0,0]=4 1877 B11R1.277 C=Cc1cc(c(cc1N)Br)F 271570a_100011290941_200021016574 [0,1,0,0,0,0|3,0,0]=4 1878 B11R1.277 C=Cc1cc(c(cc1N)C)C 271570a_100011290941_100012337760 [0,1,0,0,0,0|2,0,0]=3 1879 B11R1.277 C=Cc1cc(c(cc1N)C)F 271570a_100011290941_100010233353 [0,1,0,0,0,0|2,0,0]=3 1880 B11R1.277 C=Cc1cc(c(cc1N)Cl)Cl 271570a_100011290941_200011093942 [0,1,0,0,0,0|3,0,0]=4 1881 B11R1.277 C=Cc1cc(c(cc1N)Cl)F 271570a_100011290941_200010992381 [0,1,0,0,0,0|3,0,0]=4 1882 B11R1.277 C=Cc1cc(c(cc1N)F)Br 271570a_100011290941_100010888672 [0,1,0,0,0,0|3,0,0]=4 1883 B11R1.277 C=Cc1cc(c(cc1N)F)C 271570a_100011290941_100011218008 [0,1,0,0,0,0|3,0,0]=4 1884 B11R1.277 C=Cc1cc(c(cc1N)F)Cl 271570a_100011290941_100010892166 [0,1,0,0,0,0|3,0,0]=4 1885 B11R1.277 C=Cc1cc(c(cc1N)F)F 271570a_100011290941_100000765032 [0,1,0,0,0,0|3,0,0]=4 1886 B11R1.277 C=Cc1cc(c(cc1N)N)C 271570a_100011290941_200013038441 [0,1,0,0,0,0|3,0,0]=4 1887 B11R1.277 C=Cc1cc(c(cc1N)N)F 271570a_100011290941_200010115645 [0,1,0,0,0,0|3,0,0]=4 1888 B11R1.277 C=Cc1cc(c(cc1O)C)C 271570a_100011290941_100009814663 [0,1,0,0,0,0|1,0,0]=2 1889 B11R1.277 C=Cc1cc(c(cc1O)F)F 271570a_100011290941_100009813768 [0,1,0,0,0,0|2,0,0]=3 1890 B11R1.277 C=Cc1cc(c(nc1N)C)Br 271570a_100011290941_100000684678 [0,1,0,0,0,0|3,0,0]=4 1891 B11R1.277 C=Cc1cc(c(nc1N)C)C 271570a_100011290941_100009990238 [0,1,0,0,0,0|3,0,0]=4 1892 B11R1.277 C=Cc1nc(c(cc1N)C)F 271570a_100011290941_100010134903 [0,1,0,0,0,0|3,0,0]=4 1893 B11R1.277 C=Cc1nc(c(nc1O)C)C 271570a_100011290941_100000717854 [0,1,0,0,0,0|3,0,0]=4 1894 B11R1.277 CCc1cc(c(cc1O)F)O 271570a_203496583355_100011156610 [0,1,0,0,0,0|2,0,1]=4 1895 B11R1.277 CNc1cc(c(cc1Br)C)Br 34a_100012348304_200000210301 [0,1,0,0,0,0|3,0,0]=4 1896 B11R1.277 CNc1cc(c(cc1Br)C)Br 7a_100012348304_200000210301 [0,1,0,0,0,0|3,0,0]=4 1897 B11R1.277 CNc1cc(c(cc1Br)C)C 34a_100012337760_200000210301 [0,1,0,0,0,0|3,0,0]=4 1898 B11R1.277 CNc1cc(c(cc1Br)C)C 7a_100012337760_200000210301 [0,1,0,0,0,0|3,0,0]=4 1899 B11R1.277 CNc1cc(c(cc1Br)C)Cl 34a_100000702286_200000210301 [0,1,0,0,0,0|3,0,0]=4 1900 B11R1.277 CNc1cc(c(cc1Br)C)Cl 7a_100000702286_200000210301 [0,1,0,0,0,0|3,0,0]=4 1901 B11R1.277 CNc1cc(c(cc1Br)C)F 34a_100011218008_200000210301 [0,1,0,0,0,0|3,0,0]=4 1902 B11R1.277 CNc1cc(c(cc1Br)C)F 7a_100011218008_200000210301 [0,1,0,0,0,0|3,0,0]=4 1903 B11R1.277 CNc1cc(c(cc1C)C)Br 2230a_100000703630_200000210301 [0,1,0,0,0,0|3,0,0]=4 1904 B11R1.277 CNc1cc(c(cc1C)C)Br 34a_100000703630_200000210301 [0,1,0,0,0,0|3,0,0]=4 1905 B11R1.277 CNc1cc(c(cc1C)C)Br 7a_100000703630_200000210301 [0,1,0,0,0,0|3,0,0]=4 1906 B11R1.277 CNc1cc(c(cc1C)C)C 2230a_100011217141_200000210301 [0,1,0,0,0,0|3,0,0]=4 1907 B11R1.277 CNc1cc(c(cc1C)C)C 34a_100011217141_200000210301 [0,1,0,0,0,0|3,0,0]=4 1908 B11R1.277 CNc1cc(c(cc1C)C)C 7a_100011217141_200000210301 [0,1,0,0,0,0|3,0,0]=4 1909 B11R1.277 CNc1cc(c(cc1Cl)C)C 34a_100012183282_200000210301 [0,1,0,0,0,0|3,0,0]=4 1910 B11R1.277 CNc1cc(c(cc1Cl)C)C 7a_100012183282_200000210301 [0,1,0,0,0,0|3,0,0]=4 1911 B11R1.277 CNc1cc(c(cc1Cl)C)O 34a_100000092876_200000210301 [0,1,0,0,0,0|3,0,0]=4 1912 B11R1.277 CNc1cc(c(cc1Cl)C)O 7a_100000092876_200000210301 [0,1,0,0,0,0|3,0,0]=4 1913 B11R1.277 CNc1cc(c(cc1F)C)Br 2230a_100010239588_200000210301 [0,1,0,0,0,0|3,0,0]=4 1914 B11R1.277 CNc1cc(c(cc1F)C)Br 34a_100010239588_200000210301 [0,1,0,0,0,0|3,0,0]=4 1915 B11R1.277 CNc1cc(c(cc1F)C)Br 7a_100010239588_200000210301 [0,1,0,0,0,0|3,0,0]=4 1916 B11R1.277 CNc1cc(c(cc1F)C)F 2230a_100012002673_200000210301 [0,1,0,0,0,0|3,0,0]=4 1917 B11R1.277 CNc1cc(c(cc1F)C)F 34a_100012002673_200000210301 [0,1,0,0,0,0|3,0,0]=4 1918 B11R1.277 CNc1cc(c(cc1F)C)F 7a_100012002673_200000210301 [0,1,0,0,0,0|3,0,0]=4 1919 B11R1.277 CNc1cc(c(cc1F)C)I 34a_100011014115_200000210301 [0,1,0,0,0,0|3,0,0]=4 1920 B11R1.277 CNc1cc(c(cc1F)C)I 7a_100011014115_200000210301 [0,1,0,0,0,0|3,0,0]=4 1921 B11R1.277 CNc1cc(c(cc1F)C)O 34a_100000117193_200000210301 [0,1,0,0,0,0|3,0,0]=4 1922 B11R1.277 CNc1cc(c(cc1F)C)O 7a_100000117193_200000210301 [0,1,0,0,0,0|3,0,0]=4 1923 B11R1.277 CNc1cc(c(cc1I)C)Br 34a_200015600912_200000210301 [0,1,0,0,0,0|3,0,0]=4 1924 B11R1.277 CNc1cc(c(cc1I)C)Br 7a_200015600912_200000210301 [0,1,0,0,0,0|3,0,0]=4 1925 B11R1.277 CNc1cc(c(cc1I)C)C 34a_100012353678_200000210301 [0,1,0,0,0,0|3,0,0]=4 1926 B11R1.277 CNc1cc(c(cc1I)C)C 7a_100012353678_200000210301 [0,1,0,0,0,0|3,0,0]=4 1927 B11R1.277 CNc1cc(c(cc1O)Br)Br 7a_200010781931_200000210301 [0,1,0,0,0,0|3,0,0]=4 1928 B11R1.277 CNc1cc(c(cc1O)Br)C 34a_200010107346_200000210301 [0,1,0,0,0,0|3,0,0]=4 1929 B11R1.277 CNc1cc(c(cc1O)Br)F 34a_100013038943_200000210301 [0,1,0,0,0,0|3,0,0]=4 1930 B11R1.277 CNc1cc(c(cc1O)Br)F 7a_100013038943_200000210301 [0,1,0,0,0,0|3,0,0]=4 1931 B11R1.277 CNc1cc(c(cc1O)C)Br 34a_200010235796_200000210301 [0,1,0,0,0,0|2,0,0]=3 1932 B11R1.277 CNc1cc(c(cc1O)C)Br 7a_200010235796_200000210301 [0,1,0,0,0,0|2,0,0]=3 1933 B11R1.277 CNc1cc(c(cc1O)C)C 34a_100133014134_200000210301 [0,1,0,0,0,0|2,0,0]=3 1934 B11R1.277 CNc1cc(c(cc1O)C)C 7a_100133014134_200000210301 [0,1,0,0,0,0|2,0,0]=3 1935 B11R1.277 CNc1cc(c(cc1O)C)Cl 34a_100000091707_200000210301 [0,1,0,0,0,0|2,0,0]=3 1936 B11R1.277 CNc1cc(c(cc1O)Cl)Br 34a_100013488937_200000210301 [0,1,0,0,0,0|3,0,0]=4 1937 B11R1.277 CNc1cc(c(cc1O)Cl)Br 7a_100013488937_200000210301 [0,1,0,0,0,0|3,0,0]=4 1938 B11R1.277 CNc1cc(c(cc1O)Cl)Cl 34a_100000696747_200000210301 [0,1,0,0,0,0|3,0,0]=4 1939 B11R1.277 CNc1cc(c(cc1O)Cl)Cl 7a_100000696747_200000210301 [0,1,0,0,0,0|3,0,0]=4 1940 B11R1.277 CNc1cc(c(cc1O)F)Br 34a_100012359894_200000210301 [0,1,0,0,0,0|3,0,0]=4 1941 B11R1.277 CNc1cc(c(cc1O)F)Br 7a_100012359894_200000210301 [0,1,0,0,0,0|3,0,0]=4 1942 B11R1.277 CNc1cc(c(cc1O)F)C 34a_100012022779_200000210301 [0,1,0,0,0,0|3,0,0]=4 1943 B11R1.277 CNc1cc(c(cc1O)F)C 7a_100012022779_200000210301 [0,1,0,0,0,0|3,0,0]=4 1944 B11R1.277 CNc1cc(c(cc1O)F)F 2230a_106722365970_200000210301 [0,1,0,0,0,0|3,0,0]=4 1945 B11R1.277 CNc1cc(c(cc1O)F)F 34a_106722365970_200000210301 [0,1,0,0,0,0|3,0,0]=4 1946 B11R1.277 CNc1cc(c(cc1O)F)F 7a_106722365970_200000210301 [0,1,0,0,0,0|3,0,0]=4 1947 B11R1.277 COc1cc(c(cc1Br)C)C 34a_100009814663_200000210301 [0,1,0,0,0,0|3,0,0]=4 1948 B11R1.277 COc1cc(c(cc1Br)C)C 7a_100009814663_200000210301 [0,1,0,0,0,0|3,0,0]=4 1949 B11R1.277 COc1cc(c(cc1C)C)C 34a_200000047129_200000210301 [0,1,0,0,0,0|3,0,0]=4 1950 B11R1.277 COc1cc(c(cc1C)C)C 7a_200000047129_200000210301 [0,1,0,0,0,0|3,0,0]=4 1951 B11R1.277 COc1cc(c(cc1Cl)C)C 34a_100000031796_200000210301 [0,1,0,0,0,0|3,0,0]=4 1952 B11R1.277 COc1cc(c(cc1Cl)C)C 7a_100000031796_200000210301 [0,1,0,0,0,0|3,0,0]=4 1953 B11R1.277 COc1cc(c(cc1Cl)C)N 34a_100009961766_200000210301 [0,1,0,0,0,0|3,0,0]=4 1954 B11R1.277 COc1cc(c(cc1Cl)C)N 7a_100009961766_200000210301 [0,1,0,0,0,0|3,0,0]=4 1955 B11R1.277 COc1cc(c(cc1F)C)Br 34a_100010068922_200000210301 [0,1,0,0,0,0|3,0,0]=4 1956 B11R1.277 COc1cc(c(cc1F)C)Br 7a_100010068922_200000210301 [0,1,0,0,0,0|3,0,0]=4 1957 B11R1.277 COc1cc(c(cc1F)C)O 271570a_203496583355_100011009880 [0,1,0,0,0,0|3,0,0]=4 1958 B11R1.277 COc1cc(c(cc1N)C)Br 34a_200010107346_200000210301 [0,1,0,0,0,0|3,0,0]=4 1959 B11R1.277 COc1cc(c(cc1N)C)Br 7a_200010107346_200000210301 [0,1,0,0,0,0|3,0,0]=4 1960 B11R1.277 COc1cc(c(cc1N)C)C 34a_100133014134_200000210301 [0,1,0,0,0,0|3,0,0]=4 1961 B11R1.277 COc1cc(c(cc1N)C)C 7a_100133014134_200000210301 [0,1,0,0,0,0|3,0,0]=4 1962 B11R1.277 COc1cc(c(cc1N)C)F 34a_100012022779_200000210301 [0,1,0,0,0,0|3,0,0]=4 1963 B11R1.277 COc1cc(c(cc1N)C)F 7a_100012022779_200000210301 [0,1,0,0,0,0|3,0,0]=4 1964 B11R1.277 COc1cc(c(cc1N)C)O 271570a_203496583355_100010141321 [0,1,0,0,0,0|3,0,0]=4 1965 B11R1.277 COc1cc(c(cc1O)C)F 271570a_203496583355_100010201977 [0,1,0,0,0,0|2,0,0]=3 1966 B11R1.277 COc1cc(c(cc1O)C)N 271570a_203496583355_100010232211 [0,1,0,0,0,0|2,0,0]=3 1967 B11R1.277 COc1cc(c(cc1O)F)F 271570a_203496583355_100009813744 [0,1,0,0,0,0|3,0,0]=4 1968 B11R1.277 COc1cc(c(cc1O)F)O 271570a_203496583355_100010189133 [0,1,0,0,0,0|3,0,0]=4 1969 B11R1.277 COc1cc(c(cc1O)N)C 271570a_203496583355_106657271712 [0,1,0,0,0,0|3,0,0]=4 1970 B11R1.277 COc1cc(c(cc1O)N)N 271570a_203496583355_100012769537 [0,1,0,0,0,0|3,0,0]=4 1971 B11R1.277 CSc1cc(c(cc1Br)C)Br 62a_100012929169_200000210301 [0,1,0,0,0,0|3,0,0]=4 1972 B11R1.277 CSc1cc(c(cc1Br)C)Br 62a_200000210301_100012929169 [0,1,0,0,0,0|3,0,0]=4 1973 B11R1.277 CSc1cc(c(cc1Br)C)F 62a_200000210301_200009814774 [0,1,0,0,0,0|3,0,0]=4 1974 B11R1.277 CSc1cc(c(cc1Br)C)F 62a_200009814774_200000210301 [0,1,0,0,0,0|3,0,0]=4 1975 B11R1.277 CSc1cc(c(cc1C)C)C 62a_100000759388_200000210301 [0,1,0,0,0,0|3,0,0]=4 1976 B11R1.277 CSc1cc(c(cc1C)C)C 62a_200000210301_100000759388 [0,1,0,0,0,0|3,0,0]=4 1977 B11R1.277 CSc1cc(c(cc1C)C)N 62a_100000703630_200000210301 [0,1,0,0,0,0|3,0,0]=4 1978 B11R1.277 CSc1cc(c(cc1C)C)N 62a_200000210301_100000703630 [0,1,0,0,0,0|3,0,0]=4 1979 B11R1.277 CSc1cc(c(cc1F)C)Br 62a_100011068846_200000210301 [0,1,0,0,0,0|3,0,0]=4 1980 B11R1.277 CSc1cc(c(cc1F)C)Br 62a_200000210301_100011068846 [0,1,0,0,0,0|3,0,0]=4 1981 B11R1.277 CSc1cc(c(cc1F)C)C 62a_100010197417_200000210301 [0,1,0,0,0,0|3,0,0]=4 1982 B11R1.277 CSc1cc(c(cc1F)C)C 62a_200000210301_100010197417 [0,1,0,0,0,0|3,0,0]=4 1983 B11R1.277 CSc1cc(c(cc1F)C)F 62a_100011219510_200000210301 [0,1,0,0,0,0|3,0,0]=4 1984 B11R1.277 CSc1cc(c(cc1F)C)F 62a_200000210301_100011219510 [0,1,0,0,0,0|3,0,0]=4 1985 B11R1.277 CSc1cc(c(cc1F)C)N 62a_100000717900_200000210301 [0,1,0,0,0,0|3,0,0]=4 1986 B11R1.277 CSc1cc(c(cc1F)C)N 62a_200000210301_100000717900 [0,1,0,0,0,0|3,0,0]=4 1987 B11R1.277 CSc1cc(c(cc1F)C)O 62a_100014242602_200000210301 [0,1,0,0,0,0|3,0,0]=4 1988 B11R1.277 CSc1cc(c(cc1F)C)O 62a_200000210301_100014242602 [0,1,0,0,0,0|3,0,0]=4 1989 B11R1.277 CSc1cc(c(cc1N)C)C 62a_100012337760_200000210301 [0,1,0,0,0,0|3,0,0]=4 1990 B11R1.277 CSc1cc(c(cc1N)C)C 62a_200000210301_100012337760 [0,1,0,0,0,0|3,0,0]=4 1991 B11R1.277 CSc1cc(c(cc1N)C)F 62a_100010233353_200000210301 [0,1,0,0,0,0|3,0,0]=4 1992 B11R1.277 CSc1cc(c(cc1N)C)F 62a_200000210301_100010233353 [0,1,0,0,0,0|3,0,0]=4 1993 B11R1.277 CSc1cc(c(cc1O)C)C 62a_100009814663_200000210301 [0,1,0,0,0,0|2,0,0]=3 1994 B11R1.277 CSc1cc(c(cc1O)C)C 62a_200000210301_100009814663 [0,1,0,0,0,0|2,0,0]=3 1995 B11R1.277 CSc1cc(c(cc1O)F)F 62a_100009813768_200000210301 [0,1,0,0,0,0|3,0,0]=4 1996 B11R1.277 CSc1cc(c(cc1O)F)F 62a_200000210301_100009813768 [0,1,0,0,0,0|3,0,0]=4 1997 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])Br 34a_100012348304_200025704644 [0,1,0,0,0,0|3,0,0]=4 1998 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])Br 7a_100012348304_200025704644 [0,1,0,0,0,0|3,0,0]=4 1999 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])C 2230a_100000703630_200025704644 [0,1,0,0,0,0|3,0,0]=4 2000 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])C 34a_100000703630_200025704644 [0,1,0,0,0,0|3,0,0]=4 2001 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])C 7a_100000703630_200025704644 [0,1,0,0,0,0|3,0,0]=4 2002 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])F 2230a_100010239588_200025704644 [0,1,0,0,0,0|3,0,0]=4 2003 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])F 34a_100010239588_200025704644 [0,1,0,0,0,0|3,0,0]=4 2004 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])F 7a_100010239588_200025704644 [0,1,0,0,0,0|3,0,0]=4 2005 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])I 34a_200015600912_200025704644 [0,1,0,0,0,0|3,0,0]=4 2006 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])I 7a_200015600912_200025704644 [0,1,0,0,0,0|3,0,0]=4 2007 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])O 34a_200010235796_200025704644 [0,1,0,0,0,0|2,0,0]=3 2008 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])O 7a_200010235796_200025704644 [0,1,0,0,0,0|2,0,0]=3 2009 B11R1.277 Cc1cc(c(cc1Br)O)N[13CH3] 34a_200010107346_200025704644 [0,1,0,0,0,0|3,0,0]=4 2010 B11R1.277 Cc1cc(c(cc1Br)O[13CH3])F 34a_100010068922_200025704644 [0,1,0,0,0,0|3,0,0]=4 2011 B11R1.277 Cc1cc(c(cc1Br)O[13CH3])F 7a_100010068922_200025704644 [0,1,0,0,0,0|3,0,0]=4 2012 B11R1.277 Cc1cc(c(cc1Br)O[13CH3])N 34a_200010107346_200025704644 [0,1,0,0,0,0|3,0,0]=4 2013 B11R1.277 Cc1cc(c(cc1Br)O[13CH3])N 7a_200010107346_200025704644 [0,1,0,0,0,0|3,0,0]=4 2014 B11R1.277 Cc1cc(c(cc1Br)S[13CH3])Br 62a_100012929169_200025704644 [0,1,0,0,0,0|3,0,0]=4 2015 B11R1.277 Cc1cc(c(cc1Br)S[13CH3])Br 62a_200025704644_100012929169 [0,1,0,0,0,0|3,0,0]=4 2016 B11R1.277 Cc1cc(c(cc1Br)S[13CH3])F 62a_100011068846_200025704644 [0,1,0,0,0,0|3,0,0]=4 2017 B11R1.277 Cc1cc(c(cc1Br)S[13CH3])F 62a_200025704644_100011068846 [0,1,0,0,0,0|3,0,0]=4 2018 B11R1.277 Cc1cc(c(cc1C)C=O)O 271570a_203496583355_100010184403 [0,1,0,0,0,0|0,0,0]=1 2019 B11R1.277 Cc1cc(c(cc1C)CO)O 271570a_203496583355_100010184405 [0,1,0,0,0,0|0,0,2]=3 2020 B11R1.277 Cc1cc(c(cc1C)N[13CH3])Br 34a_100012337760_200025704644 [0,1,0,0,0,0|3,0,0]=4 2021 B11R1.277 Cc1cc(c(cc1C)N[13CH3])Br 7a_100012337760_200025704644 [0,1,0,0,0,0|3,0,0]=4 2022 B11R1.277 Cc1cc(c(cc1C)N[13CH3])C 2230a_100011217141_200025704644 [0,1,0,0,0,0|3,0,0]=4 2023 B11R1.277 Cc1cc(c(cc1C)N[13CH3])C 34a_100011217141_200025704644 [0,1,0,0,0,0|3,0,0]=4 2024 B11R1.277 Cc1cc(c(cc1C)N[13CH3])C 7a_100011217141_200025704644 [0,1,0,0,0,0|3,0,0]=4 2025 B11R1.277 Cc1cc(c(cc1C)N[13CH3])Cl 34a_100012183282_200025704644 [0,1,0,0,0,0|3,0,0]=4 2026 B11R1.277 Cc1cc(c(cc1C)N[13CH3])Cl 7a_100012183282_200025704644 [0,1,0,0,0,0|3,0,0]=4 2027 B11R1.277 Cc1cc(c(cc1C)N[13CH3])I 34a_100012353678_200025704644 [0,1,0,0,0,0|3,0,0]=4 2028 B11R1.277 Cc1cc(c(cc1C)N[13CH3])I 7a_100012353678_200025704644 [0,1,0,0,0,0|3,0,0]=4 2029 B11R1.277 Cc1cc(c(cc1C)N[13CH3])O 34a_100133014134_200025704644 [0,1,0,0,0,0|2,0,0]=3 2030 B11R1.277 Cc1cc(c(cc1C)N[13CH3])O 7a_100133014134_200025704644 [0,1,0,0,0,0|2,0,0]=3 2031 B11R1.277 Cc1cc(c(cc1C)O[13CH3])Br 34a_100009814663_200025704644 [0,1,0,0,0,0|3,0,0]=4 2032 B11R1.277 Cc1cc(c(cc1C)O[13CH3])Br 7a_100009814663_200025704644 [0,1,0,0,0,0|3,0,0]=4 2033 B11R1.277 Cc1cc(c(cc1C)O[13CH3])C 34a_200000047129_200025704644 [0,1,0,0,0,0|3,0,0]=4 2034 B11R1.277 Cc1cc(c(cc1C)O[13CH3])C 7a_200000047129_200025704644 [0,1,0,0,0,0|3,0,0]=4 2035 B11R1.277 Cc1cc(c(cc1C)O[13CH3])Cl 34a_100000031796_200025704644 [0,1,0,0,0,0|3,0,0]=4 2036 B11R1.277 Cc1cc(c(cc1C)O[13CH3])Cl 7a_100000031796_200025704644 [0,1,0,0,0,0|3,0,0]=4 2037 B11R1.277 Cc1cc(c(cc1C)O[13CH3])N 34a_100133014134_200025704644 [0,1,0,0,0,0|3,0,0]=4 2038 B11R1.277 Cc1cc(c(cc1C)O[13CH3])N 7a_100133014134_200025704644 [0,1,0,0,0,0|3,0,0]=4 2039 B11R1.277 Cc1cc(c(cc1C)S[13CH3])C 62a_100000759388_200025704644 [0,1,0,0,0,0|3,0,0]=4 2040 B11R1.277 Cc1cc(c(cc1C)S[13CH3])C 62a_200025704644_100000759388 [0,1,0,0,0,0|3,0,0]=4 2041 B11R1.277 Cc1cc(c(cc1C)S[13CH3])F 62a_100010197417_200025704644 [0,1,0,0,0,0|3,0,0]=4 2042 B11R1.277 Cc1cc(c(cc1C)S[13CH3])F 62a_200025704644_100010197417 [0,1,0,0,0,0|3,0,0]=4 2043 B11R1.277 Cc1cc(c(cc1C)S[13CH3])N 62a_100012337760_200025704644 [0,1,0,0,0,0|3,0,0]=4 2044 B11R1.277 Cc1cc(c(cc1C)S[13CH3])N 62a_200025704644_100012337760 [0,1,0,0,0,0|3,0,0]=4 2045 B11R1.277 Cc1cc(c(cc1C)S[13CH3])O 62a_100009814663_200025704644 [0,1,0,0,0,0|2,0,0]=3 2046 B11R1.277 Cc1cc(c(cc1C)S[13CH3])O 62a_200025704644_100009814663 [0,1,0,0,0,0|2,0,0]=3 2047 B11R1.277 Cc1cc(c(cc1C=O)F)O 271570a_203496583355_100010186292 [0,1,0,0,0,0|2,0,0]=3 2048 B11R1.277 Cc1cc(c(cc1Cl)N[13CH3])Br 34a_100000702286_200025704644 [0,1,0,0,0,0|3,0,0]=4 2049 B11R1.277 Cc1cc(c(cc1Cl)N[13CH3])Br 7a_100000702286_200025704644 [0,1,0,0,0,0|3,0,0]=4 2050 B11R1.277 Cc1cc(c(cc1Cl)N[13CH3])O 34a_100000091707_200025704644 [0,1,0,0,0,0|2,0,0]=3 2051 B11R1.277 Cc1cc(c(cc1F)C#N)O 271570a_203496583355_100010186300 [0,1,0,0,0,0|1,0,1]=3 2052 B11R1.277 Cc1cc(c(cc1F)C=O)O 271570a_203496583355_100010186290 [0,1,0,0,0,0|0,0,0]=1 2053 B11R1.277 Cc1cc(c(cc1F)N[13CH3])Br 34a_100011218008_200025704644 [0,1,0,0,0,0|3,0,0]=4 2054 B11R1.277 Cc1cc(c(cc1F)N[13CH3])Br 7a_100011218008_200025704644 [0,1,0,0,0,0|3,0,0]=4 2055 B11R1.277 Cc1cc(c(cc1F)N[13CH3])F 2230a_100012002673_200025704644 [0,1,0,0,0,0|3,0,0]=4 2056 B11R1.277 Cc1cc(c(cc1F)N[13CH3])F 34a_100012002673_200025704644 [0,1,0,0,0,0|3,0,0]=4 2057 B11R1.277 Cc1cc(c(cc1F)N[13CH3])F 7a_100012002673_200025704644 [0,1,0,0,0,0|3,0,0]=4 2058 B11R1.277 Cc1cc(c(cc1F)O)C#N 271570a_203496583355_100009816884 [0,1,0,0,0,0|2,0,1]=4 2059 B11R1.277 Cc1cc(c(cc1F)O)C=O 271570a_203496583355_100009814814 [0,1,0,0,0,0|1,0,0]=2 2060 B11R1.277 Cc1cc(c(cc1F)O)N[13CH3] 34a_100012022779_200025704644 [0,1,0,0,0,0|3,0,0]=4 2061 B11R1.277 Cc1cc(c(cc1F)O)N[13CH3] 7a_100012022779_200025704644 [0,1,0,0,0,0|3,0,0]=4 2062 B11R1.277 Cc1cc(c(cc1F)O[13CH3])N 34a_100012022779_200025704644 [0,1,0,0,0,0|3,0,0]=4 2063 B11R1.277 Cc1cc(c(cc1F)O[13CH3])N 7a_100012022779_200025704644 [0,1,0,0,0,0|3,0,0]=4 2064 B11R1.277 Cc1cc(c(cc1F)S[13CH3])Br 62a_200009814774_200025704644 [0,1,0,0,0,0|3,0,0]=4 2065 B11R1.277 Cc1cc(c(cc1F)S[13CH3])Br 62a_200025704644_200009814774 [0,1,0,0,0,0|3,0,0]=4 2066 B11R1.277 Cc1cc(c(cc1F)S[13CH3])F 62a_100011219510_200025704644 [0,1,0,0,0,0|3,0,0]=4 2067 B11R1.277 Cc1cc(c(cc1F)S[13CH3])F 62a_200025704644_100011219510 [0,1,0,0,0,0|3,0,0]=4 2068 B11R1.277 Cc1cc(c(cc1F)S[13CH3])N 62a_100010233353_200025704644 [0,1,0,0,0,0|3,0,0]=4 2069 B11R1.277 Cc1cc(c(cc1F)S[13CH3])N 62a_200025704644_100010233353 [0,1,0,0,0,0|3,0,0]=4 2070 B11R1.277 Cc1cc(c(cc1I)N[13CH3])F 34a_100011014115_200025704644 [0,1,0,0,0,0|3,0,0]=4 2071 B11R1.277 Cc1cc(c(cc1I)N[13CH3])F 7a_100011014115_200025704644 [0,1,0,0,0,0|3,0,0]=4 2072 B11R1.277 Cc1cc(c(cc1N)O[13CH3])Cl 34a_100009961766_200025704644 [0,1,0,0,0,0|3,0,0]=4 2073 B11R1.277 Cc1cc(c(cc1N)O[13CH3])Cl 7a_100009961766_200025704644 [0,1,0,0,0,0|3,0,0]=4 2074 B11R1.277 Cc1cc(c(cc1N)S[13CH3])C 62a_100000703630_200025704644 [0,1,0,0,0,0|3,0,0]=4 2075 B11R1.277 Cc1cc(c(cc1N)S[13CH3])C 62a_200025704644_100000703630 [0,1,0,0,0,0|3,0,0]=4 2076 B11R1.277 Cc1cc(c(cc1N)S[13CH3])F 62a_100000717900_200025704644 [0,1,0,0,0,0|3,0,0]=4 2077 B11R1.277 Cc1cc(c(cc1N)S[13CH3])F 62a_200025704644_100000717900 [0,1,0,0,0,0|3,0,0]=4 2078 B11R1.277 Cc1cc(c(cc1O)C#N)F 271570a_203496583355_100010159637 [0,1,0,0,0,0|2,0,1]=4 2079 B11R1.277 Cc1cc(c(cc1O)C)C=O 271570a_203496583355_100012024176 [0,1,0,0,0,0|2,0,0]=3 2080 B11R1.277 Cc1cc(c(cc1O)C=O)F 271570a_203496583355_100010138641 [0,1,0,0,0,0|1,0,0]=2 2081 B11R1.277 Cc1cc(c(cc1O)C=O)O 271570a_203496583355_100010186689 [0,1,0,0,0,0|0,0,0]=1 2082 B11R1.277 Cc1cc(c(cc1O)F)C=O 271570a_203496583355_100010186291 [0,1,0,0,0,0|2,0,0]=3 2083 B11R1.277 Cc1cc(c(cc1O)N[13CH3])Cl 34a_100000092876_200025704644 [0,1,0,0,0,0|3,0,0]=4 2084 B11R1.277 Cc1cc(c(cc1O)N[13CH3])Cl 7a_100000092876_200025704644 [0,1,0,0,0,0|3,0,0]=4 2085 B11R1.277 Cc1cc(c(cc1O)N[13CH3])F 34a_100000117193_200025704644 [0,1,0,0,0,0|3,0,0]=4 2086 B11R1.277 Cc1cc(c(cc1O)N[13CH3])F 7a_100000117193_200025704644 [0,1,0,0,0,0|3,0,0]=4 2087 B11R1.277 Cc1cc(c(cc1O)O)C=O 271570a_203496583355_200010762526 [0,1,0,0,0,0|1,0,0]=2 2088 B11R1.277 Cc1cc(c(cc1O)S[13CH3])F 62a_100014242602_200025704644 [0,1,0,0,0,0|3,0,0]=4 2089 B11R1.277 Cc1cc(c(cc1O)S[13CH3])F 62a_200025704644_100014242602 [0,1,0,0,0,0|3,0,0]=4 2090 B11R1.277 Cc1cc(c(nc1C)O)C#N 271570a_203496583355_100010132023 [0,1,0,0,0,0|2,0,1]=4 2091 B11R1.277 Cc1nc(c(cc1O)C#N)O 271570a_203496583355_100000702242 [0,1,0,0,0,0|2,0,1]=4 2092 B11R1.277 N#Cc1cc(c(cc1O)F)F 271570a_203496583355_100000730815 [0,1,0,0,0,0|2,0,1]=4 2093 B11R1.277 N#Cc1cc(c(cc1O)O)F 271570a_203496583355_200010827376 [0,1,0,0,0,0|2,0,1]=4 2094 B11R1.277 Nc1cc(c(cc1C=O)O)F 271570a_203496583355_200010571964 [0,1,0,0,0,0|2,0,0]=3 2095 B11R1.277 O=Cc1cc(c(cc1F)F)O 271570a_203496583355_100009814802 [0,1,0,0,0,0|2,0,0]=3 2096 B11R1.277 O=Cc1cc(c(cc1F)O)F 271570a_203496583355_100011998483 [0,1,0,0,0,0|2,0,0]=3 2097 B11R1.277 O=Cc1cc(c(cc1O)F)F 271570a_203496583355_100012344232 [0,1,0,0,0,0|1,0,0]=2 2098 B11R1.277 O=Cc1cc(c(cc1O)F)O 271570a_203496583355_100010175118 [0,1,0,0,0,0|1,0,0]=2 2099 B11R1.277 O=Cc1cc(c(cc1O)O)F 271570a_203496583355_200010762562 [0,1,0,0,0,0|1,0,0]=2 2100 B11R1.277 O=Cc1cc(c(cc1O)O)O 271570a_203496583355_100010888506 [0,1,0,0,0,0|1,0,0]=2 2101 B11R1.277 O=Cc1cc(c(cc1O)O)O 271570a_203496583355_200010132312 [0,1,0,0,0,0|1,0,0]=2 2102 B11R1.277 OCc1cc(c(cc1O)F)F 271570a_203496583355_100012344399 [0,1,0,0,0,0|1,0,2]=4 2103 B11R1.277 [13CH3]Nc1cc(c(cc1O)Br)Br 7a_200010781931_200025704644 [0,1,0,0,0,0|3,0,0]=4 2104 B11R1.277 [13CH3]Nc1cc(c(cc1O)Br)F 34a_100013038943_200025704644 [0,1,0,0,0,0|3,0,0]=4 2105 B11R1.277 [13CH3]Nc1cc(c(cc1O)Br)F 7a_100013038943_200025704644 [0,1,0,0,0,0|3,0,0]=4 2106 B11R1.277 [13CH3]Nc1cc(c(cc1O)Cl)Br 34a_100013488937_200025704644 [0,1,0,0,0,0|3,0,0]=4 2107 B11R1.277 [13CH3]Nc1cc(c(cc1O)Cl)Br 7a_100013488937_200025704644 [0,1,0,0,0,0|3,0,0]=4 2108 B11R1.277 [13CH3]Nc1cc(c(cc1O)Cl)Cl 34a_100000696747_200025704644 [0,1,0,0,0,0|3,0,0]=4 2109 B11R1.277 [13CH3]Nc1cc(c(cc1O)Cl)Cl 7a_100000696747_200025704644 [0,1,0,0,0,0|3,0,0]=4 2110 B11R1.277 [13CH3]Nc1cc(c(cc1O)F)Br 34a_100012359894_200025704644 [0,1,0,0,0,0|3,0,0]=4 2111 B11R1.277 [13CH3]Nc1cc(c(cc1O)F)Br 7a_100012359894_200025704644 [0,1,0,0,0,0|3,0,0]=4 2112 B11R1.277 [13CH3]Nc1cc(c(cc1O)F)F 2230a_106722365970_200025704644 [0,1,0,0,0,0|3,0,0]=4 2113 B11R1.277 [13CH3]Nc1cc(c(cc1O)F)F 34a_106722365970_200025704644 [0,1,0,0,0,0|3,0,0]=4 2114 B11R1.277 [13CH3]Nc1cc(c(cc1O)F)F 7a_106722365970_200025704644 [0,1,0,0,0,0|3,0,0]=4 2115 B11R1.277 [13CH3]Sc1cc(c(cc1O)F)F 62a_100009813768_200025704644 [0,1,0,0,0,0|3,0,0]=4 2116 B11R1.277 [13CH3]Sc1cc(c(cc1O)F)F 62a_200025704644_100009813768 [0,1,0,0,0,0|3,0,0]=4 2117 B11R1.278 C=Cc1ccc(c(c1C)C)Br 271570a_100011290941_200010185626 [0,1,0,0,0,0|3,0,0]=4 2118 B11R1.278 C=Cc1ccc(c(c1C)C)F 271570a_100011290941_100009816033 [0,1,0,0,0,0|3,0,0]=4 2119 B11R1.278 C=Cc1ccc(c(c1C)C)N 271570a_100011290941_100009816967 [0,1,0,0,0,0|3,0,0]=4 2120 B11R1.278 C=Cc1ccc(c(c1C)C)O 271570a_100011290941_100012353674 [0,1,0,0,0,0|3,0,0]=4 2121 B11R1.278 C=Cc1ccc(c(c1C)Cl)Br 271570a_100011290941_200010212245 [0,1,0,0,0,0|3,0,0]=4 2122 B11R1.278 C=Cc1ccc(c(c1C)F)Br 271570a_100011290941_100010208201 [0,1,0,0,0,0|3,0,0]=4 2123 B11R1.278 C=Cc1ccc(c(c1C)F)F 271570a_100011290941_100009815991 [0,1,0,0,0,0|3,0,0]=4 2124 B11R1.278 C=Cc1ccc(c(c1C)F)N 271570a_100011290941_100000722916 [0,1,0,0,0,0|3,0,0]=4 2125 B11R1.278 C=Cc1ccc(c(c1C)N)C 271570a_100011290941_200010074581 [0,1,0,0,0,0|2,0,0]=3 2126 B11R1.278 C=Cc1ccc(c(c1C)N)F 271570a_100011290941_100010588651 [0,1,0,0,0,0|3,0,0]=4 2127 B11R1.278 C=Cc1ccc(c(c1C)N)N 271570a_100011290941_100010009725 [0,1,0,0,0,0|3,0,0]=4 2128 B11R1.278 C=Cc1ccc(c(c1C)N)O 271570a_100011290941_100013039247 [0,1,0,0,0,0|3,0,0]=4 2129 B11R1.278 C=Cc1ccc(c(c1Cl)C)Br 271570a_100011290941_100055076181 [0,1,0,0,0,0|3,0,0]=4 2130 B11R1.278 C=Cc1ccc(c(c1Cl)C)Cl 271570a_100011290941_100010730154 [0,1,0,0,0,0|3,0,0]=4 2131 B11R1.278 C=Cc1ccc(c(c1Cl)Cl)Br 271570a_100011290941_200012356690 [0,1,0,0,0,0|3,0,0]=4 2132 B11R1.278 C=Cc1ccc(c(c1F)Br)F 271570a_100011290941_100010167943 [0,1,0,0,0,0|3,0,0]=4 2133 B11R1.278 C=Cc1ccc(c(c1F)Br)N 271570a_100011290941_100015781493 [0,1,0,0,0,0|3,0,0]=4 2134 B11R1.278 C=Cc1ccc(c(c1F)C)C 271570a_100011290941_200015555822 [0,1,0,0,0,0|2,0,0]=3 2135 B11R1.278 C=Cc1ccc(c(c1F)C)F 271570a_100011290941_100009815987 [0,1,0,0,0,0|3,0,0]=4 2136 B11R1.278 C=Cc1ccc(c(c1F)C)N 271570a_100011290941_100010208198 [0,1,0,0,0,0|3,0,0]=4 2137 B11R1.278 C=Cc1ccc(c(c1F)C)O 271570a_100011290941_100010390934 [0,1,0,0,0,0|3,0,0]=4 2138 B11R1.278 C=Cc1ccc(c(c1F)Cl)Br 271570a_100011290941_100010212236 [0,1,0,0,0,0|3,0,0]=4 2139 B11R1.278 C=Cc1ccc(c(c1F)Cl)F 271570a_100011290941_200000038702 [0,1,0,0,0,0|3,0,0]=4 2140 B11R1.278 C=Cc1ccc(c(c1F)F)Br 271570a_100011290941_100010212264 [0,1,0,0,0,0|3,0,0]=4 2141 B11R1.278 C=Cc1ccc(c(c1F)F)C 271570a_100011290941_100012766498 [0,1,0,0,0,0|2,0,0]=3 2142 B11R1.278 C=Cc1ccc(c(c1F)F)F 271570a_100011290941_100000750562 [0,1,0,0,0,0|3,0,0]=4 2143 B11R1.278 C=Cc1ccc(c(c1F)F)N 271570a_100011290941_100010200256 [0,1,0,0,0,0|3,0,0]=4 2144 B11R1.278 C=Cc1ccc(c(c1F)F)O 271570a_100011290941_100011830415 [0,1,0,0,0,0|3,0,0]=4 2145 B11R1.278 C=Cc1ccc(c(c1F)N)F 271570a_100011290941_100025793129 [0,1,0,0,0,0|3,0,0]=4 2146 B11R1.278 C=Cc1ccc(c(c1F)N)N 271570a_100011290941_100009814308 [0,1,0,0,0,0|3,0,0]=4 2147 B11R1.278 C=Cc1ccc(c(c1F)O)Br 271570a_100011290941_200010782288 [0,1,0,0,0,0|3,0,0]=4 2148 B11R1.278 C=Cc1ccc(c(c1F)O)F 271570a_100011290941_100010167067 [0,1,0,0,0,0|3,0,0]=4 2149 B11R1.278 C=Cc1ccc(c(c1N)C)F 271570a_100011290941_100011009917 [0,1,0,0,0,0|3,0,0]=4 2150 B11R1.278 C=Cc1ccc(c(c1N)F)F 271570a_100011290941_100010008850 [0,1,0,0,0,0|3,0,0]=4 2151 B11R1.278 C=Cc1ccc(c(c1N)N)F 271570a_100011290941_100011102919 [0,1,0,0,0,0|3,0,0]=4 2152 B11R1.278 C=Cc1ccc(c(c1N)O)Br 271570a_100011290941_100020748643 [0,1,0,0,0,0|3,0,0]=4 2153 B11R1.278 C=Cc1ccc(c(c1O)C)F 271570a_100011290941_200010391124 [0,1,0,0,0,0|2,0,0]=3 2154 B11R1.278 C=Cc1ccc(c(c1O)F)C 271570a_100011290941_100000722096 [0,1,0,0,0,0|1,0,0]=2 2155 B11R1.278 C=Cc1ccc(c(c1O)F)F 271570a_100011290941_100010243909 [0,1,0,0,0,0|2,0,0]=3 2156 B11R1.278 C=Cc1ncc(c(c1N)N)C 271570a_100011290941_200000097298 [0,1,0,0,0,0|3,0,0]=4 2157 B11R1.278 CNc1ccc(c(c1C)Br)C 2230a_106354213274_200000210301 [0,1,0,0,0,0|3,0,0]=4 2158 B11R1.278 CNc1ccc(c(c1C)Br)C 34a_106354213274_200000210301 [0,1,0,0,0,0|3,0,0]=4 2159 B11R1.278 CNc1ccc(c(c1C)Br)C 7a_106354213274_200000210301 [0,1,0,0,0,0|3,0,0]=4 2160 B11R1.278 CNc1ccc(c(c1C)C)C 2230a_100000116900_200000210301 [0,1,0,0,0,0|3,0,0]=4 2161 B11R1.278 CNc1ccc(c(c1C)C)C 34a_100000116900_200000210301 [0,1,0,0,0,0|3,0,0]=4 2162 B11R1.278 CNc1ccc(c(c1C)C)C 7a_100000116900_200000210301 [0,1,0,0,0,0|3,0,0]=4 2163 B11R1.278 CNc1ccc(c(c1C)Cl)C 2230a_100009954856_200000210301 [0,1,0,0,0,0|3,0,0]=4 2164 B11R1.278 CNc1ccc(c(c1C)Cl)C 34a_100009954856_200000210301 [0,1,0,0,0,0|3,0,0]=4 2165 B11R1.278 CNc1ccc(c(c1C)Cl)C 7a_100009954856_200000210301 [0,1,0,0,0,0|3,0,0]=4 2166 B11R1.278 CNc1ccc(c(c1C)I)C 34a_100011170560_200000210301 [0,1,0,0,0,0|3,0,0]=4 2167 B11R1.278 CNc1ccc(c(c1C)I)C 7a_100011170560_200000210301 [0,1,0,0,0,0|3,0,0]=4 2168 B11R1.278 CNc1ccc(c(c1Cl)O)C 34a_100000036876_200000210301 [0,1,0,0,0,0|3,0,0]=4 2169 B11R1.278 CNc1ccc(c(c1Cl)O)C 7a_100000036876_200000210301 [0,1,0,0,0,0|3,0,0]=4 2170 B11R1.278 CNc1ccc(c(c1F)F)C 2230a_100000062217_200000210301 [0,1,0,0,0,0|3,0,0]=4 2171 B11R1.278 CNc1ccc(c(c1F)F)C 34a_100000062217_200000210301 [0,1,0,0,0,0|3,0,0]=4 2172 B11R1.278 CNc1ccc(c(c1F)F)C 7a_100000062217_200000210301 [0,1,0,0,0,0|3,0,0]=4 2173 B11R1.278 CNc1ccc(c(c1O)Br)F 34a_100010128263_200000210301 [0,1,0,0,0,0|3,0,0]=4 2174 B11R1.278 CNc1ccc(c(c1O)F)F 34a_100015205010_200000210301 [0,1,0,0,0,0|3,0,0]=4 2175 B11R1.278 COc1ccc(c(c1C)Br)C 34a_100010659238_200000210301 [0,1,0,0,0,0|3,0,0]=4 2176 B11R1.278 COc1ccc(c(c1C)Br)C 7a_100010659238_200000210301 [0,1,0,0,0,0|3,0,0]=4 2177 B11R1.278 COc1ccc(c(c1C)O)C 271570a_203496583355_100016151084 [0,1,0,0,0,0|3,0,0]=4 2178 B11R1.278 COc1ccc(c(c1F)F)C 34a_100000036877_200000210301 [0,1,0,0,0,0|3,0,0]=4 2179 B11R1.278 COc1ccc(c(c1F)F)C 7a_100000036877_200000210301 [0,1,0,0,0,0|3,0,0]=4 2180 B11R1.278 COc1ccc(c(c1O)F)F 271570a_203496583355_100010204329 [0,1,0,0,0,0|3,0,0]=4 2181 B11R1.278 CSc1ccc(c(c1C)N)C 62a_200000210301_200010074581 [0,1,0,0,0,0|3,0,0]=4 2182 B11R1.278 CSc1ccc(c(c1C)N)C 62a_200010074581_200000210301 [0,1,0,0,0,0|3,0,0]=4 2183 B11R1.278 CSc1ccc(c(c1F)C)C 62a_200000210301_200015555822 [0,1,0,0,0,0|3,0,0]=4 2184 B11R1.278 CSc1ccc(c(c1F)C)C 62a_200015555822_200000210301 [0,1,0,0,0,0|3,0,0]=4 2185 B11R1.278 CSc1ccc(c(c1F)F)C 62a_100012766498_200000210301 [0,1,0,0,0,0|3,0,0]=4 2186 B11R1.278 CSc1ccc(c(c1F)F)C 62a_200000210301_100012766498 [0,1,0,0,0,0|3,0,0]=4 2187 B11R1.278 CSc1ccc(c(c1O)C)F 62a_200000210301_200010391124 [0,1,0,0,0,0|3,0,0]=4 2188 B11R1.278 CSc1ccc(c(c1O)C)F 62a_200010391124_200000210301 [0,1,0,0,0,0|3,0,0]=4 2189 B11R1.278 CSc1ccc(c(c1O)F)C 62a_100000722096_200000210301 [0,1,0,0,0,0|2,0,0]=3 2190 B11R1.278 CSc1ccc(c(c1O)F)C 62a_200000210301_100000722096 [0,1,0,0,0,0|2,0,0]=3 2191 B11R1.278 CSc1ccc(c(c1O)F)F 62a_100010243909_200000210301 [0,1,0,0,0,0|3,0,0]=4 2192 B11R1.278 CSc1ccc(c(c1O)F)F 62a_200000210301_100010243909 [0,1,0,0,0,0|3,0,0]=4 2193 B11R1.278 Cc1c(ccc(c1F)C=O)O 271570a_203496583355_100015546853 [0,1,0,0,0,0|2,0,0]=3 2194 B11R1.278 Cc1c(ccc(c1O)C#N)F 271570a_203496583355_100009859896 [0,1,0,0,0,0|2,0,1]=4 2195 B11R1.278 Cc1c(ccc(c1O)C=O)F 271570a_203496583355_100009872231 [0,1,0,0,0,0|1,0,0]=2 2196 B11R1.278 Cc1c(ccc(c1O)S[13CH3])F 62a_200010391124_200025704644 [0,1,0,0,0,0|3,0,0]=4 2197 B11R1.278 Cc1c(ccc(c1O)S[13CH3])F 62a_200025704644_200010391124 [0,1,0,0,0,0|3,0,0]=4 2198 B11R1.278 Cc1ccc(c(c1Br)C)N[13CH3] 2230a_106354213274_200025704644 [0,1,0,0,0,0|3,0,0]=4 2199 B11R1.278 Cc1ccc(c(c1Br)C)N[13CH3] 34a_106354213274_200025704644 [0,1,0,0,0,0|3,0,0]=4 2200 B11R1.278 Cc1ccc(c(c1Br)C)N[13CH3] 7a_106354213274_200025704644 [0,1,0,0,0,0|3,0,0]=4 2201 B11R1.278 Cc1ccc(c(c1Br)C)O[13CH3] 34a_100010659238_200025704644 [0,1,0,0,0,0|3,0,0]=4 2202 B11R1.278 Cc1ccc(c(c1Br)C)O[13CH3] 7a_100010659238_200025704644 [0,1,0,0,0,0|3,0,0]=4 2203 B11R1.278 Cc1ccc(c(c1C)C)N[13CH3] 2230a_100000116900_200025704644 [0,1,0,0,0,0|3,0,0]=4 2204 B11R1.278 Cc1ccc(c(c1C)C)N[13CH3] 34a_100000116900_200025704644 [0,1,0,0,0,0|3,0,0]=4 2205 B11R1.278 Cc1ccc(c(c1C)C)N[13CH3] 7a_100000116900_200025704644 [0,1,0,0,0,0|3,0,0]=4 2206 B11R1.278 Cc1ccc(c(c1C)F)S[13CH3] 62a_200015555822_200025704644 [0,1,0,0,0,0|3,0,0]=4 2207 B11R1.278 Cc1ccc(c(c1C)F)S[13CH3] 62a_200025704644_200015555822 [0,1,0,0,0,0|3,0,0]=4 2208 B11R1.278 Cc1ccc(c(c1Cl)C)N[13CH3] 2230a_100009954856_200025704644 [0,1,0,0,0,0|3,0,0]=4 2209 B11R1.278 Cc1ccc(c(c1Cl)C)N[13CH3] 34a_100009954856_200025704644 [0,1,0,0,0,0|3,0,0]=4 2210 B11R1.278 Cc1ccc(c(c1Cl)C)N[13CH3] 7a_100009954856_200025704644 [0,1,0,0,0,0|3,0,0]=4 2211 B11R1.278 Cc1ccc(c(c1F)F)N[13CH3] 2230a_100000062217_200025704644 [0,1,0,0,0,0|3,0,0]=4 2212 B11R1.278 Cc1ccc(c(c1F)F)N[13CH3] 34a_100000062217_200025704644 [0,1,0,0,0,0|3,0,0]=4 2213 B11R1.278 Cc1ccc(c(c1F)F)N[13CH3] 7a_100000062217_200025704644 [0,1,0,0,0,0|3,0,0]=4 2214 B11R1.278 Cc1ccc(c(c1F)F)O[13CH3] 34a_100000036877_200025704644 [0,1,0,0,0,0|3,0,0]=4 2215 B11R1.278 Cc1ccc(c(c1F)F)O[13CH3] 7a_100000036877_200025704644 [0,1,0,0,0,0|3,0,0]=4 2216 B11R1.278 Cc1ccc(c(c1F)F)S[13CH3] 62a_100012766498_200025704644 [0,1,0,0,0,0|3,0,0]=4 2217 B11R1.278 Cc1ccc(c(c1F)F)S[13CH3] 62a_200025704644_100012766498 [0,1,0,0,0,0|3,0,0]=4 2218 B11R1.278 Cc1ccc(c(c1F)O)S[13CH3] 62a_100000722096_200025704644 [0,1,0,0,0,0|2,0,0]=3 2219 B11R1.278 Cc1ccc(c(c1F)O)S[13CH3] 62a_200025704644_100000722096 [0,1,0,0,0,0|2,0,0]=3 2220 B11R1.278 Cc1ccc(c(c1I)C)N[13CH3] 34a_100011170560_200025704644 [0,1,0,0,0,0|3,0,0]=4 2221 B11R1.278 Cc1ccc(c(c1I)C)N[13CH3] 7a_100011170560_200025704644 [0,1,0,0,0,0|3,0,0]=4 2222 B11R1.278 Cc1ccc(c(c1N)C)S[13CH3] 62a_200010074581_200025704644 [0,1,0,0,0,0|3,0,0]=4 2223 B11R1.278 Cc1ccc(c(c1N)C)S[13CH3] 62a_200025704644_200010074581 [0,1,0,0,0,0|3,0,0]=4 2224 B11R1.278 Cc1ccc(c(c1O)Cl)N[13CH3] 34a_100000036876_200025704644 [0,1,0,0,0,0|3,0,0]=4 2225 B11R1.278 Cc1ccc(c(c1O)Cl)N[13CH3] 7a_100000036876_200025704644 [0,1,0,0,0,0|3,0,0]=4 2226 B11R1.278 N#Cc1ccc(c(c1O)F)F 271570a_203496583355_100000718925 [0,1,0,0,0,0|2,0,1]=4 2227 B11R1.278 N#Cc1ccc(c(c1O)O)F 271570a_203496583355_100010128267 [0,1,0,0,0,0|2,0,1]=4 2228 B11R1.278 O=Cc1ccc(c(c1F)F)O 271570a_203496583355_100010209662 [0,1,0,0,0,0|2,0,0]=3 2229 B11R1.278 O=Cc1ccc(c(c1F)O)F 271570a_203496583355_100000050342 [0,1,0,0,0,0|2,0,0]=3 2230 B11R1.278 O=Cc1ccc(c(c1O)F)F 271570a_203496583355_100015087033 [0,1,0,0,0,0|1,0,0]=2 2231 B11R1.278 O=Cc1ccc(c(c1O)F)O 271570a_203496583355_100010762540 [0,1,0,0,0,0|1,0,0]=2 2232 B11R1.278 OCc1ccc(c(c1O)F)F 271570a_203496583355_100015087060 [0,1,0,0,0,0|1,0,2]=4 2233 B11R1.278 [13CH3]Nc1ccc(c(c1O)Br)F 34a_100010128263_200025704644 [0,1,0,0,0,0|3,0,0]=4 2234 B11R1.278 [13CH3]Nc1ccc(c(c1O)F)F 34a_100015205010_200025704644 [0,1,0,0,0,0|3,0,0]=4 2235 B11R1.278 [13CH3]Sc1ccc(c(c1O)F)F 62a_100010243909_200025704644 [0,1,0,0,0,0|3,0,0]=4 2236 B11R1.278 [13CH3]Sc1ccc(c(c1O)F)F 62a_200025704644_100010243909 [0,1,0,0,0,0|3,0,0]=4 2237 B11R1.279 C#Cc1ccc(cc1Cl)NC 2230a_100012001888_200000210301 [0,1,0,0,0,0|2,0,1]=4 2238 B11R1.279 C#Cc1ccc(cc1Cl)NC 34a_100012001888_200000210301 [0,1,0,0,0,0|2,0,1]=4 2239 B11R1.279 C#Cc1ccc(cc1Cl)N[13CH3] 2230a_100012001888_200025704644 [0,1,0,0,0,0|2,0,1]=4 2240 B11R1.279 C#Cc1ccc(cc1Cl)N[13CH3] 34a_100012001888_200025704644 [0,1,0,0,0,0|2,0,1]=4 2241 B11R1.279 C#Cc1ccc(cc1F)NC 2230a_100012001886_200000210301 [0,1,0,0,0,0|2,0,1]=4 2242 B11R1.279 C#Cc1ccc(cc1F)NC 34a_100012001886_200000210301 [0,1,0,0,0,0|2,0,1]=4 2243 B11R1.279 C#Cc1ccc(cc1F)N[13CH3] 2230a_100012001886_200025704644 [0,1,0,0,0,0|2,0,1]=4 2244 B11R1.279 C#Cc1ccc(cc1F)N[13CH3] 34a_100012001886_200025704644 [0,1,0,0,0,0|2,0,1]=4 2245 B11R1.279 C=Cc1cc(c(cn1)C=O)C 271570a_100011290941_100000085382 [0,1,0,0,0,0|2,0,1]=4 2246 B11R1.279 C=Cc1ccc(c(c1)Br)C=O 271570a_100011290941_100010185650 [0,1,0,0,0,0|1,0,1]=3 2247 B11R1.279 C=Cc1ccc(c(c1)C)C=O 271570a_100011290941_100000687586 [0,1,0,0,0,0|1,0,1]=3 2248 B11R1.279 C=Cc1ccc(c(c1)Cl)C=O 271570a_100011290941_100000727542 [0,1,0,0,0,0|1,0,1]=3 2249 B11R1.279 C=Cc1ccc(c(c1)F)C=O 271570a_100011290941_100000211676 [0,1,0,0,0,0|1,0,1]=3 2250 B11R1.279 C=Cc1ccc(c(c1)N)C=O 271570a_100011290941_100009814810 [0,1,0,0,0,0|1,0,1]=3 2251 B11R1.279 C=Cc1ccc(c(c1)O)C#N 271570a_100011290941_100011934713 [0,1,0,0,0,0|1,0,2]=4 2252 B11R1.279 C=Cc1ccc(c(c1)O)C=O 271570a_100011290941_100011277552 [0,1,0,0,0,0|0,0,1]=2 2253 B11R1.279 C=Cc1ccc(c(c1)O)CO 271570a_100011290941_100000071718 [0,1,0,0,0,0|0,0,3]=4 2254 B11R1.279 C=Cc1ccc(c(c1)O)OC 271570a_100011290941_100009816560 [0,1,0,0,0,0|2,0,1]=4 2255 B11R1.279 C=Cc1ccc(c(n1)C)C=O 271570a_100011290941_100000050599 [0,1,0,0,0,0|2,0,1]=4 2256 B11R1.279 C=Cc1ccc(c(n1)F)C=O 271570a_100011290941_100010064369 [0,1,0,0,0,0|2,0,1]=4 2257 B11R1.279 C=Cc1ccc(cc1Br)C#N 271570a_100011290941_100012356348 [0,1,0,0,0,0|2,0,1]=4 2258 B11R1.279 C=Cc1ccc(cc1Br)CC 271570a_100011290941_200009997437 [0,1,0,0,0,0|2,0,0]=3 2259 B11R1.279 C=Cc1ccc(cc1Br)OC 271570a_100011290941_100012349170 [0,1,0,0,0,0|2,0,0]=3 2260 B11R1.279 C=Cc1ccc(cc1C)C#N 271570a_100011290941_100000212329 [0,1,0,0,0,0|2,0,1]=4 2261 B11R1.279 C=Cc1ccc(cc1C)C=O 271570a_100011290941_100000765772 [0,1,0,0,0,0|2,0,1]=4 2262 B11R1.279 C=Cc1ccc(cc1C)CN 271570a_100011290941_100015205234 [0,1,0,0,0,0|2,0,0]=3 2263 B11R1.279 C=Cc1ccc(cc1C)CO 271570a_100011290941_100000718852 [0,1,0,0,0,0|2,0,0]=3 2264 B11R1.279 C=Cc1ccc(cc1C)NC 271570a_100011290941_100102888905 [0,1,0,0,0,0|2,0,0]=3 2265 B11R1.279 C=Cc1ccc(cc1C)NN 271570a_100011290941_100000745493 [0,1,0,0,0,0|3,0,0]=4 2266 B11R1.279 C=Cc1ccc(cc1C)OC 271570a_100011290941_100000759875 [0,1,0,0,0,0|2,0,0]=3 2267 B11R1.279 C=Cc1ccc(cc1Cl)C#N 271570a_100011290941_100012349663 [0,1,0,0,0,0|2,0,1]=4 2268 B11R1.279 C=Cc1ccc(cc1Cl)CO 271570a_100011290941_100000718186 [0,1,0,0,0,0|2,0,0]=3 2269 B11R1.279 C=Cc1ccc(cc1F)C#N 271570a_100011290941_100011794375 [0,1,0,0,0,0|2,0,1]=4 2270 B11R1.279 C=Cc1ccc(cc1F)C=O 271570a_100011290941_100000686674 [0,1,0,0,0,0|2,0,1]=4 2271 B11R1.279 C=Cc1ccc(cc1F)CC 271570a_100011290941_200010339503 [0,1,0,0,0,0|2,0,0]=3 2272 B11R1.279 C=Cc1ccc(cc1F)CN 271570a_100011290941_100000755036 [0,1,0,0,0,0|2,0,0]=3 2273 B11R1.279 C=Cc1ccc(cc1F)CO 271570a_100011290941_100011533735 [0,1,0,0,0,0|2,0,0]=3 2274 B11R1.279 C=Cc1ccc(cc1F)NC 271570a_100011290941_100012285320 [0,1,0,0,0,0|2,0,0]=3 2275 B11R1.279 C=Cc1ccc(cc1F)NN 271570a_100011290941_100016992936 [0,1,0,0,0,0|3,0,0]=4 2276 B11R1.279 C=Cc1ccc(cc1F)OC 271570a_100011290941_100000753793 [0,1,0,0,0,0|2,0,0]=3 2277 B11R1.279 C=Cc1ccc(cc1F)SC 271570a_100011290941_100009816902 [0,1,0,0,0,0|2,0,0]=3 2278 B11R1.279 C=Cc1ccc(cc1F)SC 62a_100011935271_200000210301 [0,1,0,0,0,0|2,0,0]=3 2279 B11R1.279 C=Cc1ccc(cc1F)SC 62a_200000210301_100011935271 [0,1,0,0,0,0|2,0,0]=3 2280 B11R1.279 C=Cc1ccc(cc1F)S[13CH3] 62a_100011935271_200025704644 [0,1,0,0,0,0|2,0,0]=3 2281 B11R1.279 C=Cc1ccc(cc1F)S[13CH3] 62a_200025704644_100011935271 [0,1,0,0,0,0|2,0,0]=3 2282 B11R1.279 C=Cc1ccc(cc1N)C#N 271570a_100011290941_100012001879 [0,1,0,0,0,0|2,0,1]=4 2283 B11R1.279 C=Cc1ccc(cc1N)CO 271570a_100011290941_100012347568 [0,1,0,0,0,0|2,0,0]=3 2284 B11R1.279 C=Cc1ccc(cc1N)OC 271570a_100011290941_100000748021 [0,1,0,0,0,0|2,0,0]=3 2285 B11R1.279 C=Cc1ccc(cc1O)C#N 271570a_100011290941_100000724445 [0,1,0,0,0,0|1,0,1]=3 2286 B11R1.279 C=Cc1ccc(cc1O)C=O 271570a_100011290941_100000041418 [0,1,0,0,0,0|1,0,1]=3 2287 B11R1.279 C=Cc1ccc(cc1O)CO 271570a_100011290941_100000049605 [0,1,0,0,0,0|1,0,0]=2 2288 B11R1.279 C=Cc1ccc(cc1O)OC 271570a_100011290941_100000719091 [0,1,0,0,0,0|1,0,0]=2 2289 B11R1.279 C=Cc1ccc(nc1C)CO 271570a_100011290941_100010114280 [0,1,0,0,0,0|3,0,0]=4 2290 B11R1.279 C=Cc1ccc(nc1C)OC 271570a_100011290941_100000766551 [0,1,0,0,0,0|3,0,0]=4 2291 B11R1.279 C=Cc1ccc(nc1F)OC 271570a_100011290941_100010067559 [0,1,0,0,0,0|3,0,0]=4 2292 B11R1.279 C=Cc1ccc(nc1N)OC 271570a_100011290941_100010187629 [0,1,0,0,0,0|3,0,0]=4 2293 B11R1.279 C=Cc1ccc(nc1O)C#N 271570a_100011290941_200011068624 [0,1,0,0,0,0|2,0,1]=4 2294 B11R1.279 C=Cc1cnc(c(c1)C)C=O 271570a_100011290941_100010185443 [0,1,0,0,0,0|2,0,1]=4 2295 B11R1.279 C=Cc1cnc(c(c1)F)C=O 271570a_100011290941_100010180630 [0,1,0,0,0,0|2,0,1]=4 2296 B11R1.279 C=Cc1cnc(cc1C)CO 271570a_100011290941_200010713146 [0,1,0,0,0,0|3,0,0]=4 2297 B11R1.279 C=Cc1cnc(cc1C)NC 271570a_100011290941_100012352278 [0,1,0,0,0,0|3,0,0]=4 2298 B11R1.279 C=Cc1cnc(cc1C)OC 271570a_100011290941_100011934368 [0,1,0,0,0,0|3,0,0]=4 2299 B11R1.279 C=Cc1cnc(cc1F)OC 271570a_100011290941_100010136277 [0,1,0,0,0,0|3,0,0]=4 2300 B11R1.279 C=Cc1cnc(cc1N)OC 271570a_100011290941_100010254562 [0,1,0,0,0,0|3,0,0]=4 2301 B11R1.279 C=Cc1cnc(cc1O)C#N 271570a_100011290941_100016221821 [0,1,0,0,0,0|2,0,1]=4 2302 B11R1.279 C=Cc1cnc(cc1O)OC 271570a_100011290941_100010738159 [0,1,0,0,0,0|2,0,0]=3 2303 B11R1.279 C=Cc1cnc(nc1O)SC 271570a_100011290941_100010221251 [0,1,0,0,0,0|3,0,0]=4 2304 B11R1.279 C=Cc1ncc(cc1C)CO 271570a_100011290941_200000092119 [0,1,0,0,0,0|3,0,0]=4 2305 B11R1.279 C=Cc1ncc(cc1C)OC 271570a_100011290941_200009851512 [0,1,0,0,0,0|3,0,0]=4 2306 B11R1.279 C=Cc1ncc(cc1C)SC 271570a_100011290941_203440288091 [0,1,0,0,0,0|3,0,0]=4 2307 B11R1.279 C=Cc1ncc(cc1F)CO 271570a_100011290941_100010065243 [0,1,0,0,0,0|3,0,0]=4 2308 B11R1.279 C=Cc1ncc(cc1F)SC 271570a_100011290941_100010884644 [0,1,0,0,0,0|3,0,0]=4 2309 B11R1.279 C=Cc1ncc(cc1N)OC 271570a_100011290941_100010074831 [0,1,0,0,0,0|3,0,0]=4 2310 B11R1.279 CCc1ccc(c(c1)Br)NC 2230a_100012339725_200000210301 [0,1,0,0,0,0|3,0,0]=4 2311 B11R1.279 CCc1ccc(c(c1)Br)NC 34a_100012339725_200000210301 [0,1,0,0,0,0|3,0,0]=4 2312 B11R1.279 CCc1ccc(c(c1)Br)N[13CH3] 2230a_100012339725_200025704644 [0,1,0,0,0,0|3,0,0]=4 2313 B11R1.279 CCc1ccc(c(c1)Br)N[13CH3] 34a_100012339725_200025704644 [0,1,0,0,0,0|3,0,0]=4 2314 B11R1.279 CCc1ccc(c(c1)Br)OC 34a_100012339963_200000210301 [0,1,0,0,0,0|3,0,0]=4 2315 B11R1.279 CCc1ccc(c(c1)Br)OC 7a_100012339963_200000210301 [0,1,0,0,0,0|3,0,0]=4 2316 B11R1.279 CCc1ccc(c(c1)Br)O[13CH3] 34a_100012339963_200025704644 [0,1,0,0,0,0|3,0,0]=4 2317 B11R1.279 CCc1ccc(c(c1)Br)O[13CH3] 7a_100012339963_200025704644 [0,1,0,0,0,0|3,0,0]=4 2318 B11R1.279 CCc1ccc(c(c1)Br)SC 62a_200000210301_200009997437 [0,1,0,0,0,0|3,0,0]=4 2319 B11R1.279 CCc1ccc(c(c1)Br)SC 62a_200009997437_200000210301 [0,1,0,0,0,0|3,0,0]=4 2320 B11R1.279 CCc1ccc(c(c1)Br)S[13CH3] 62a_200009997437_200025704644 [0,1,0,0,0,0|3,0,0]=4 2321 B11R1.279 CCc1ccc(c(c1)Br)S[13CH3] 62a_200025704644_200009997437 [0,1,0,0,0,0|3,0,0]=4 2322 B11R1.279 CCc1ccc(c(c1)C)NC 2230a_100011226020_200000210301 [0,1,0,0,0,0|3,0,0]=4 2323 B11R1.279 CCc1ccc(c(c1)C)NC 34a_100011226020_200000210301 [0,1,0,0,0,0|3,0,0]=4 2324 B11R1.279 CCc1ccc(c(c1)C)NC 7a_100011226020_200000210301 [0,1,0,0,0,0|3,0,0]=4 2325 B11R1.279 CCc1ccc(c(c1)C)N[13CH3] 2230a_100011226020_200025704644 [0,1,0,0,0,0|3,0,0]=4 2326 B11R1.279 CCc1ccc(c(c1)C)N[13CH3] 34a_100011226020_200025704644 [0,1,0,0,0,0|3,0,0]=4 2327 B11R1.279 CCc1ccc(c(c1)C)N[13CH3] 7a_100011226020_200025704644 [0,1,0,0,0,0|3,0,0]=4 2328 B11R1.279 CCc1ccc(c(c1)F)NC 2230a_100016177294_200000210301 [0,1,0,0,0,0|3,0,0]=4 2329 B11R1.279 CCc1ccc(c(c1)F)NC 34a_100016177294_200000210301 [0,1,0,0,0,0|3,0,0]=4 2330 B11R1.279 CCc1ccc(c(c1)F)N[13CH3] 2230a_100016177294_200025704644 [0,1,0,0,0,0|3,0,0]=4 2331 B11R1.279 CCc1ccc(c(c1)F)N[13CH3] 34a_100016177294_200025704644 [0,1,0,0,0,0|3,0,0]=4 2332 B11R1.279 CCc1ccc(c(c1)F)SC 62a_200000210301_200010339503 [0,1,0,0,0,0|3,0,0]=4 2333 B11R1.279 CCc1ccc(c(c1)F)SC 62a_200010339503_200000210301 [0,1,0,0,0,0|3,0,0]=4 2334 B11R1.279 CCc1ccc(c(c1)F)S[13CH3] 62a_200010339503_200025704644 [0,1,0,0,0,0|3,0,0]=4 2335 B11R1.279 CCc1ccc(c(c1)F)S[13CH3] 62a_200025704644_200010339503 [0,1,0,0,0,0|3,0,0]=4 2336 B11R1.279 CCc1ccc(c(c1)N)OC 34a_100000765835_200000210301 [0,1,0,0,0,0|3,0,0]=4 2337 B11R1.279 CCc1ccc(c(c1)N)OC 7a_100000765835_200000210301 [0,1,0,0,0,0|3,0,0]=4 2338 B11R1.279 CCc1ccc(c(c1)N)O[13CH3] 34a_100000765835_200025704644 [0,1,0,0,0,0|3,0,0]=4 2339 B11R1.279 CCc1ccc(c(c1)N)O[13CH3] 7a_100000765835_200025704644 [0,1,0,0,0,0|3,0,0]=4 2340 B11R1.279 CCc1ccc(c(c1)O)C#N 271570a_203496583355_100010295696 [0,1,0,0,0,0|1,0,1]=3 2341 B11R1.279 CCc1ccc(c(c1)O)NC 34a_100000124328_200000210301 [0,1,0,0,0,0|2,0,0]=3 2342 B11R1.279 CCc1ccc(c(c1)O)N[13CH3] 34a_100000124328_200025704644 [0,1,0,0,0,0|2,0,0]=3 2343 B11R1.279 CCc1ccc(c(c1)O)OC 271570a_203496583355_100010062400 [0,1,0,0,0,0|2,0,0]=3 2344 B11R1.279 CCc1ccc(c(n1)O)C#N 271570a_203496583355_200009874664 [0,1,0,0,0,0|2,0,1]=4 2345 B11R1.279 CCc1ccc(cc1Cl)NC 2230a_100000766362_200000210301 [0,1,0,0,0,0|2,0,1]=4 2346 B11R1.279 CCc1ccc(cc1Cl)NC 34a_100000766362_200000210301 [0,1,0,0,0,0|2,0,1]=4 2347 B11R1.279 CCc1ccc(cc1Cl)NC 7a_100000766362_200000210301 [0,1,0,0,0,0|2,0,1]=4 2348 B11R1.279 CCc1ccc(cc1Cl)N[13CH3] 2230a_100000766362_200025704644 [0,1,0,0,0,0|2,0,1]=4 2349 B11R1.279 CCc1ccc(cc1Cl)N[13CH3] 34a_100000766362_200025704644 [0,1,0,0,0,0|2,0,1]=4 2350 B11R1.279 CCc1ccc(cc1Cl)N[13CH3] 7a_100000766362_200025704644 [0,1,0,0,0,0|2,0,1]=4 2351 B11R1.279 CCc1ccc(cc1Cl)OC 34a_100009886192_200000210301 [0,1,0,0,0,0|2,0,1]=4 2352 B11R1.279 CCc1ccc(cc1Cl)OC 7a_100009886192_200000210301 [0,1,0,0,0,0|2,0,1]=4 2353 B11R1.279 CCc1ccc(cc1Cl)O[13CH3] 34a_100009886192_200025704644 [0,1,0,0,0,0|2,0,1]=4 2354 B11R1.279 CCc1ccc(cc1Cl)O[13CH3] 7a_100009886192_200025704644 [0,1,0,0,0,0|2,0,1]=4 2355 B11R1.279 CCc1ccc(cc1F)SC 62a_200000210301_200010071577 [0,1,0,0,0,0|2,0,1]=4 2356 B11R1.279 CCc1ccc(cc1F)SC 62a_200010071577_200000210301 [0,1,0,0,0,0|2,0,1]=4 2357 B11R1.279 CCc1ccc(cc1F)S[13CH3] 62a_200010071577_200025704644 [0,1,0,0,0,0|2,0,1]=4 2358 B11R1.279 CCc1ccc(cc1F)S[13CH3] 62a_200025704644_200010071577 [0,1,0,0,0,0|2,0,1]=4 2359 B11R1.279 CCc1ccc(cc1N)SC 62a_100012354963_200000210301 [0,1,0,0,0,0|2,0,1]=4 2360 B11R1.279 CCc1ccc(cc1N)SC 62a_200000210301_100012354963 [0,1,0,0,0,0|2,0,1]=4 2361 B11R1.279 CCc1ccc(cc1N)S[13CH3] 62a_100012354963_200025704644 [0,1,0,0,0,0|2,0,1]=4 2362 B11R1.279 CCc1ccc(cc1N)S[13CH3] 62a_200025704644_100012354963 [0,1,0,0,0,0|2,0,1]=4 2363 B11R1.279 CNc1ccc(c(c1)Br)C#N 27a_100102657272_100012349582 [0,1,0,0,0,0|2,0,1]=4 2364 B11R1.279 CNc1ccc(c(c1)Br)C#N 34a_100000689153_200000210301 [0,1,0,0,0,0|2,0,1]=4 2365 B11R1.279 CNc1ccc(c(c1)Br)C#N 7a_100000689153_200000210301 [0,1,0,0,0,0|2,0,1]=4 2366 B11R1.279 CNc1ccc(c(c1)Br)OC 34a_100000187427_200000210301 [0,1,0,0,0,0|3,0,0]=4 2367 B11R1.279 CNc1ccc(c(c1)C)C#N 34a_100011999795_200000210301 [0,1,0,0,0,0|2,0,1]=4 2368 B11R1.279 CNc1ccc(c(c1)C)C#N 7a_100011999795_200000210301 [0,1,0,0,0,0|2,0,1]=4 2369 B11R1.279 CNc1ccc(c(c1)C)CO 34a_100000102464_200000210301 [0,1,0,0,0,0|1,0,2]=4 2370 B11R1.279 CNc1ccc(c(c1)C)OC 2230a_100000743268_200000210301 [0,1,0,0,0,0|3,0,0]=4 2371 B11R1.279 CNc1ccc(c(c1)C)OC 34a_100000743268_200000210301 [0,1,0,0,0,0|3,0,0]=4 2372 B11R1.279 CNc1ccc(c(c1)C)OC 7a_100000743268_200000210301 [0,1,0,0,0,0|3,0,0]=4 2373 B11R1.279 CNc1ccc(c(c1)C)SC 62a_100102888905_200000210301 [0,1,0,0,0,0|3,0,0]=4 2374 B11R1.279 CNc1ccc(c(c1)C)SC 62a_200000210301_100102888905 [0,1,0,0,0,0|3,0,0]=4 2375 B11R1.279 CNc1ccc(c(c1)C)S[13CH3] 62a_100102888905_200025704644 [0,1,0,0,0,0|3,0,0]=4 2376 B11R1.279 CNc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100102888905 [0,1,0,0,0,0|3,0,0]=4 2377 B11R1.279 CNc1ccc(c(c1)Cl)C#N 34a_100000211542_200000210301 [0,1,0,0,0,0|2,0,1]=4 2378 B11R1.279 CNc1ccc(c(c1)Cl)C#N 7a_100000211542_200000210301 [0,1,0,0,0,0|2,0,1]=4 2379 B11R1.279 CNc1ccc(c(c1)Cl)CO 34a_100000689119_200000210301 [0,1,0,0,0,0|1,0,2]=4 2380 B11R1.279 CNc1ccc(c(c1)Cl)OC 2230a_100000211044_200000210301 [0,1,0,0,0,0|3,0,0]=4 2381 B11R1.279 CNc1ccc(c(c1)Cl)OC 34a_100000211044_200000210301 [0,1,0,0,0,0|3,0,0]=4 2382 B11R1.279 CNc1ccc(c(c1)F)C#N 27a_100102657272_100000037869 [0,1,0,0,0,0|2,0,1]=4 2383 B11R1.279 CNc1ccc(c(c1)F)C#N 34a_100000765089_200000210301 [0,1,0,0,0,0|2,0,1]=4 2384 B11R1.279 CNc1ccc(c(c1)F)C#N 7a_100000765089_200000210301 [0,1,0,0,0,0|2,0,1]=4 2385 B11R1.279 CNc1ccc(c(c1)F)OC 2230a_100000740183_200000210301 [0,1,0,0,0,0|3,0,0]=4 2386 B11R1.279 CNc1ccc(c(c1)F)OC 34a_100000740183_200000210301 [0,1,0,0,0,0|3,0,0]=4 2387 B11R1.279 CNc1ccc(c(c1)F)SC 2230a_100000762756_200000210301 [0,1,0,0,0,0|3,0,0]=4 2388 B11R1.279 CNc1ccc(c(c1)F)SC 34a_100000762756_200000210301 [0,1,0,0,0,0|3,0,0]=4 2389 B11R1.279 CNc1ccc(c(c1)F)SC 62a_100012285320_200000210301 [0,1,0,0,0,0|3,0,0]=4 2390 B11R1.279 CNc1ccc(c(c1)F)SC 62a_200000210301_100012285320 [0,1,0,0,0,0|3,0,0]=4 2391 B11R1.279 CNc1ccc(c(c1)F)S[13CH3] 62a_100012285320_200025704644 [0,1,0,0,0,0|3,0,0]=4 2392 B11R1.279 CNc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100012285320 [0,1,0,0,0,0|3,0,0]=4 2393 B11R1.279 CNc1ccc(c(c1)I)OC 34a_100011356947_200000210301 [0,1,0,0,0,0|3,0,0]=4 2394 B11R1.279 CNc1ccc(c(c1)O)C#N 34a_100000094571_200000210301 [0,1,0,0,0,0|1,0,1]=3 2395 B11R1.279 CNc1ccc(c(c1)O)C#N 7a_100000094571_200000210301 [0,1,0,0,0,0|1,0,1]=3 2396 B11R1.279 CNc1ccc(c(c1)O)OC 271570a_203496583355_114948341033 [0,1,0,0,0,0|2,0,0]=3 2397 B11R1.279 CNc1ccc(c(c1)O)OC 34a_100000211920_200000210301 [0,1,0,0,0,0|2,0,0]=3 2398 B11R1.279 CNc1ccc(c(n1)F)C=O 27a_100102657272_100010064369 [0,1,0,0,0,0|2,0,0]=3 2399 B11R1.279 CNc1ccc(cc1Br)OC 34a_100015195136_200000210301 [0,1,0,0,0,0|3,0,0]=4 2400 B11R1.279 CNc1ccc(cc1C)CO 2230a_200011997030_200000210301 [0,1,0,0,0,0|3,0,0]=4 2401 B11R1.279 CNc1ccc(cc1C)CO 34a_200011997030_200000210301 [0,1,0,0,0,0|3,0,0]=4 2402 B11R1.279 CNc1ccc(cc1C)OC 34a_100000750285_200000210301 [0,1,0,0,0,0|3,0,0]=4 2403 B11R1.279 CNc1ccc(cc1C)OC 34a_100161107805_200000210301 [0,1,0,0,0,0|3,0,0]=4 2404 B11R1.279 CNc1ccc(cc1C)OC 7a_100161107805_200000210301 [0,1,0,0,0,0|3,0,0]=4 2405 B11R1.279 CNc1ccc(cc1C)O[13CH3] 34a_100161107805_200025704644 [0,1,0,0,0,0|3,0,0]=4 2406 B11R1.279 CNc1ccc(cc1C)O[13CH3] 7a_100161107805_200025704644 [0,1,0,0,0,0|3,0,0]=4 2407 B11R1.279 CNc1ccc(cc1C)SC 62a_100000221803_200000210301 [0,1,0,0,0,0|3,0,0]=4 2408 B11R1.279 CNc1ccc(cc1C)SC 62a_200000210301_100000221803 [0,1,0,0,0,0|3,0,0]=4 2409 B11R1.279 CNc1ccc(cc1C)S[13CH3] 62a_100000221803_200025704644 [0,1,0,0,0,0|3,0,0]=4 2410 B11R1.279 CNc1ccc(cc1C)S[13CH3] 62a_200025704644_100000221803 [0,1,0,0,0,0|3,0,0]=4 2411 B11R1.279 CNc1ccc(cc1Cl)OC 34a_100000747055_200000210301 [0,1,0,0,0,0|3,0,0]=4 2412 B11R1.279 CNc1ccc(cc1F)CO 2230a_100011217239_200000210301 [0,1,0,0,0,0|3,0,0]=4 2413 B11R1.279 CNc1ccc(cc1F)CO 34a_100011217239_200000210301 [0,1,0,0,0,0|3,0,0]=4 2414 B11R1.279 CNc1ccc(cc1F)OC 34a_100011299463_200000210301 [0,1,0,0,0,0|3,0,0]=4 2415 B11R1.279 CNc1ccc(cc1F)SC 34a_100012056844_200000210301 [0,1,0,0,0,0|3,0,0]=4 2416 B11R1.279 CNc1ccc(cc1F)SC 62a_100000743884_200000210301 [0,1,0,0,0,0|3,0,0]=4 2417 B11R1.279 CNc1ccc(cc1F)SC 62a_200000210301_100000743884 [0,1,0,0,0,0|3,0,0]=4 2418 B11R1.279 CNc1ccc(cc1F)S[13CH3] 62a_100000743884_200025704644 [0,1,0,0,0,0|3,0,0]=4 2419 B11R1.279 CNc1ccc(cc1F)S[13CH3] 62a_200025704644_100000743884 [0,1,0,0,0,0|3,0,0]=4 2420 B11R1.279 CNc1ccc(cc1I)OC 34a_100000049804_200000210301 [0,1,0,0,0,0|3,0,0]=4 2421 B11R1.279 CNc1ccc(cc1N)SC 62a_100000741790_200000210301 [0,1,0,0,0,0|3,0,0]=4 2422 B11R1.279 CNc1ccc(cc1N)S[13CH3] 62a_100000741790_200025704644 [0,1,0,0,0,0|3,0,0]=4 2423 B11R1.279 CNc1ccc(cc1O)C#N 271570a_203496583355_200020994358 [0,1,0,0,0,0|2,0,1]=4 2424 B11R1.279 CNc1ccc(cc1O)C#N 34a_100011997735_200000210301 [0,1,0,0,0,0|2,0,1]=4 2425 B11R1.279 CNc1ccc(cc1O)C=O 271570a_203496583355_200010290468 [0,1,0,0,0,0|2,0,1]=4 2426 B11R1.279 CNc1ccc(cc1O)OC 34a_100016989039_200000210301 [0,1,0,0,0,0|2,0,0]=3 2427 B11R1.279 COc1cc(c(cn1)C#N)O 271570a_203496583355_100000696732 [0,1,0,0,0,0|2,0,1]=4 2428 B11R1.279 COc1cc(c(cn1)SC)O 62a_100010738159_200000210301 [0,1,0,0,0,0|3,0,0]=4 2429 B11R1.279 COc1cc(c(cn1)SC)O 62a_200000210301_100010738159 [0,1,0,0,0,0|3,0,0]=4 2430 B11R1.279 COc1cc(c(cn1)S[13CH3])O 62a_100010738159_200025704644 [0,1,0,0,0,0|3,0,0]=4 2431 B11R1.279 COc1cc(c(cn1)S[13CH3])O 62a_200025704644_100010738159 [0,1,0,0,0,0|3,0,0]=4 2432 B11R1.279 COc1ccc(c(c1)Br)C#N 34a_100012184851_200000210301 [0,1,0,0,0,0|2,0,1]=4 2433 B11R1.279 COc1ccc(c(c1)Br)C#N 7a_100012184851_200000210301 [0,1,0,0,0,0|2,0,1]=4 2434 B11R1.279 COc1ccc(c(c1)Br)CO 34a_100010146404_200000210301 [0,1,0,0,0,0|1,0,2]=4 2435 B11R1.279 COc1ccc(c(c1)Br)CO 7a_100010146404_200000210301 [0,1,0,0,0,0|1,0,2]=4 2436 B11R1.279 COc1ccc(c(c1)Br)N[13CH3] 34a_100015195136_200025704644 [0,1,0,0,0,0|3,0,0]=4 2437 B11R1.279 COc1ccc(c(c1)Br)OC 34a_100000685887_200000210301 [0,1,0,0,0,0|3,0,0]=4 2438 B11R1.279 COc1ccc(c(c1)Br)OC 34a_100010234764_200000210301 [0,1,0,0,0,0|3,0,0]=4 2439 B11R1.279 COc1ccc(c(c1)Br)OC 7a_100000685887_200000210301 [0,1,0,0,0,0|3,0,0]=4 2440 B11R1.279 COc1ccc(c(c1)Br)OC 7a_100010234764_200000210301 [0,1,0,0,0,0|3,0,0]=4 2441 B11R1.279 COc1ccc(c(c1)Br)O[13CH3] 34a_100000685887_200025704644 [0,1,0,0,0,0|3,0,0]=4 2442 B11R1.279 COc1ccc(c(c1)Br)O[13CH3] 7a_100000685887_200025704644 [0,1,0,0,0,0|3,0,0]=4 2443 B11R1.279 COc1ccc(c(c1)Br)SC 62a_100012349170_200000210301 [0,1,0,0,0,0|3,0,0]=4 2444 B11R1.279 COc1ccc(c(c1)Br)SC 62a_200000210301_100012349170 [0,1,0,0,0,0|3,0,0]=4 2445 B11R1.279 COc1ccc(c(c1)Br)S[13CH3] 62a_100012349170_200025704644 [0,1,0,0,0,0|3,0,0]=4 2446 B11R1.279 COc1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100012349170 [0,1,0,0,0,0|3,0,0]=4 2447 B11R1.279 COc1ccc(c(c1)C)C#N 34a_100000720286_200000210301 [0,1,0,0,0,0|2,0,1]=4 2448 B11R1.279 COc1ccc(c(c1)C)C#N 7a_100000720286_200000210301 [0,1,0,0,0,0|2,0,1]=4 2449 B11R1.279 COc1ccc(c(c1)C)N[13CH3] 34a_100000750285_200025704644 [0,1,0,0,0,0|3,0,0]=4 2450 B11R1.279 COc1ccc(c(c1)C)OC 34a_100000759738_200000210301 [0,1,0,0,0,0|3,0,0]=4 2451 B11R1.279 COc1ccc(c(c1)C)OC 34a_100012002223_200000210301 [0,1,0,0,0,0|3,0,0]=4 2452 B11R1.279 COc1ccc(c(c1)C)OC 7a_100000759738_200000210301 [0,1,0,0,0,0|3,0,0]=4 2453 B11R1.279 COc1ccc(c(c1)C)OC 7a_100012002223_200000210301 [0,1,0,0,0,0|3,0,0]=4 2454 B11R1.279 COc1ccc(c(c1)C)O[13CH3] 34a_100012002223_200025704644 [0,1,0,0,0,0|3,0,0]=4 2455 B11R1.279 COc1ccc(c(c1)C)O[13CH3] 7a_100012002223_200025704644 [0,1,0,0,0,0|3,0,0]=4 2456 B11R1.279 COc1ccc(c(c1)C)SC 34a_100000030144_200000210301 [0,1,0,0,0,0|3,0,0]=4 2457 B11R1.279 COc1ccc(c(c1)C)SC 62a_100000759875_200000210301 [0,1,0,0,0,0|3,0,0]=4 2458 B11R1.279 COc1ccc(c(c1)C)SC 62a_200000210301_100000759875 [0,1,0,0,0,0|3,0,0]=4 2459 B11R1.279 COc1ccc(c(c1)C)S[13CH3] 62a_100000759875_200025704644 [0,1,0,0,0,0|3,0,0]=4 2460 B11R1.279 COc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000759875 [0,1,0,0,0,0|3,0,0]=4 2461 B11R1.279 COc1ccc(c(c1)Cl)C#N 34a_100000716493_200000210301 [0,1,0,0,0,0|2,0,1]=4 2462 B11R1.279 COc1ccc(c(c1)Cl)C#N 7a_100000716493_200000210301 [0,1,0,0,0,0|2,0,1]=4 2463 B11R1.279 COc1ccc(c(c1)Cl)CN 34a_200161156549_200000210301 [0,1,0,0,0,0|2,0,1]=4 2464 B11R1.279 COc1ccc(c(c1)Cl)CO 34a_200000075811_200000210301 [0,1,0,0,0,0|1,0,2]=4 2465 B11R1.279 COc1ccc(c(c1)Cl)CO 7a_200000075811_200000210301 [0,1,0,0,0,0|1,0,2]=4 2466 B11R1.279 COc1ccc(c(c1)Cl)N[13CH3] 34a_100000747055_200025704644 [0,1,0,0,0,0|3,0,0]=4 2467 B11R1.279 COc1ccc(c(c1)Cl)OC 34a_100000038596_200000210301 [0,1,0,0,0,0|3,0,0]=4 2468 B11R1.279 COc1ccc(c(c1)Cl)OC 34a_200009861682_200000210301 [0,1,0,0,0,0|3,0,0]=4 2469 B11R1.279 COc1ccc(c(c1)Cl)OC 7a_100000038596_200000210301 [0,1,0,0,0,0|3,0,0]=4 2470 B11R1.279 COc1ccc(c(c1)Cl)OC 7a_200009861682_200000210301 [0,1,0,0,0,0|3,0,0]=4 2471 B11R1.279 COc1ccc(c(c1)Cl)O[13CH3] 34a_100000038596_200025704644 [0,1,0,0,0,0|3,0,0]=4 2472 B11R1.279 COc1ccc(c(c1)Cl)O[13CH3] 7a_100000038596_200025704644 [0,1,0,0,0,0|3,0,0]=4 2473 B11R1.279 COc1ccc(c(c1)F)C#N 34a_100000753931_200000210301 [0,1,0,0,0,0|2,0,1]=4 2474 B11R1.279 COc1ccc(c(c1)F)C#N 7a_100000753931_200000210301 [0,1,0,0,0,0|2,0,1]=4 2475 B11R1.279 COc1ccc(c(c1)F)CO 34a_100000084598_200000210301 [0,1,0,0,0,0|1,0,2]=4 2476 B11R1.279 COc1ccc(c(c1)F)CO 7a_100000084598_200000210301 [0,1,0,0,0,0|1,0,2]=4 2477 B11R1.279 COc1ccc(c(c1)F)N[13CH3] 34a_100011299463_200025704644 [0,1,0,0,0,0|3,0,0]=4 2478 B11R1.279 COc1ccc(c(c1)F)OC 34a_100000036999_200000210301 [0,1,0,0,0,0|3,0,0]=4 2479 B11R1.279 COc1ccc(c(c1)F)OC 34a_100000746305_200000210301 [0,1,0,0,0,0|3,0,0]=4 2480 B11R1.279 COc1ccc(c(c1)F)OC 7a_100000036999_200000210301 [0,1,0,0,0,0|3,0,0]=4 2481 B11R1.279 COc1ccc(c(c1)F)OC 7a_100000746305_200000210301 [0,1,0,0,0,0|3,0,0]=4 2482 B11R1.279 COc1ccc(c(c1)F)O[13CH3] 34a_100000036999_200025704644 [0,1,0,0,0,0|3,0,0]=4 2483 B11R1.279 COc1ccc(c(c1)F)O[13CH3] 7a_100000036999_200025704644 [0,1,0,0,0,0|3,0,0]=4 2484 B11R1.279 COc1ccc(c(c1)F)SC 62a_100000753793_200000210301 [0,1,0,0,0,0|3,0,0]=4 2485 B11R1.279 COc1ccc(c(c1)F)SC 62a_200000210301_100000753793 [0,1,0,0,0,0|3,0,0]=4 2486 B11R1.279 COc1ccc(c(c1)F)S[13CH3] 62a_100000753793_200025704644 [0,1,0,0,0,0|3,0,0]=4 2487 B11R1.279 COc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000753793 [0,1,0,0,0,0|3,0,0]=4 2488 B11R1.279 COc1ccc(c(c1)I)N[13CH3] 34a_100000049804_200025704644 [0,1,0,0,0,0|3,0,0]=4 2489 B11R1.279 COc1ccc(c(c1)I)OC 34a_100010084122_200000210301 [0,1,0,0,0,0|3,0,0]=4 2490 B11R1.279 COc1ccc(c(c1)I)OC 7a_100010084122_200000210301 [0,1,0,0,0,0|3,0,0]=4 2491 B11R1.279 COc1ccc(c(c1)N)OC 34a_100000188146_200000210301 [0,1,0,0,0,0|3,0,0]=4 2492 B11R1.279 COc1ccc(c(c1)N)O[13CH3] 34a_100000188146_200025704644 [0,1,0,0,0,0|3,0,0]=4 2493 B11R1.279 COc1ccc(c(c1)N)SC 62a_100000748021_200000210301 [0,1,0,0,0,0|3,0,0]=4 2494 B11R1.279 COc1ccc(c(c1)N)SC 62a_200000210301_100000748021 [0,1,0,0,0,0|3,0,0]=4 2495 B11R1.279 COc1ccc(c(c1)N)S[13CH3] 62a_100000748021_200025704644 [0,1,0,0,0,0|3,0,0]=4 2496 B11R1.279 COc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100000748021 [0,1,0,0,0,0|3,0,0]=4 2497 B11R1.279 COc1ccc(c(c1)O)C#N 271570a_203496583355_100012355471 [0,1,0,0,0,0|1,0,1]=3 2498 B11R1.279 COc1ccc(c(c1)O)C=O 271570a_203496583355_100000723261 [0,1,0,0,0,0|0,0,0]=1 2499 B11R1.279 COc1ccc(c(c1)O)CO 271570a_203496583355_100011982768 [0,1,0,0,0,0|0,0,2]=3 2500 B11R1.279 COc1ccc(c(c1)O)N[13CH3] 34a_100016989039_200025704644 [0,1,0,0,0,0|2,0,0]=3 2501 B11R1.279 COc1ccc(c(c1)O)OC 271570a_203496583355_100011215452 [0,1,0,0,0,0|2,0,0]=3 2502 B11R1.279 COc1ccc(c(c1)O)SC 62a_200000210301_100000719091 [0,1,0,0,0,0|2,0,0]=3 2503 B11R1.279 COc1ccc(c(c1)O)S[13CH3] 62a_200025704644_100000719091 [0,1,0,0,0,0|2,0,0]=3 2504 B11R1.279 COc1ccc(c(n1)O)C=O 271570a_203496583355_100012351648 [0,1,0,0,0,0|1,0,0]=2 2505 B11R1.279 COc1ccc(c(n1)O)CO 271570a_203496583355_100009885603 [0,1,0,0,0,0|1,0,2]=4 2506 B11R1.279 COc1ccc(cc1Br)CO 34a_100011191544_200000210301 [0,1,0,0,0,0|3,0,0]=4 2507 B11R1.279 COc1ccc(cc1Br)CO 7a_100011191544_200000210301 [0,1,0,0,0,0|3,0,0]=4 2508 B11R1.279 COc1ccc(cc1Br)N[13CH3] 34a_100000187427_200025704644 [0,1,0,0,0,0|3,0,0]=4 2509 B11R1.279 COc1ccc(cc1Br)O[13CH3] 34a_100010234764_200025704644 [0,1,0,0,0,0|3,0,0]=4 2510 B11R1.279 COc1ccc(cc1Br)O[13CH3] 7a_100010234764_200025704644 [0,1,0,0,0,0|3,0,0]=4 2511 B11R1.279 COc1ccc(cc1Br)SC 62a_100011249507_200000210301 [0,1,0,0,0,0|3,0,0]=4 2512 B11R1.279 COc1ccc(cc1Br)SC 62a_200000210301_100011249507 [0,1,0,0,0,0|3,0,0]=4 2513 B11R1.279 COc1ccc(cc1Br)S[13CH3] 62a_100011249507_200025704644 [0,1,0,0,0,0|3,0,0]=4 2514 B11R1.279 COc1ccc(cc1Br)S[13CH3] 62a_200025704644_100011249507 [0,1,0,0,0,0|3,0,0]=4 2515 B11R1.279 COc1ccc(cc1C)CO 34a_100000075815_200000210301 [0,1,0,0,0,0|3,0,0]=4 2516 B11R1.279 COc1ccc(cc1C)CO 7a_100000075815_200000210301 [0,1,0,0,0,0|3,0,0]=4 2517 B11R1.279 COc1ccc(cc1C)N[13CH3] 2230a_100000743268_200025704644 [0,1,0,0,0,0|3,0,0]=4 2518 B11R1.279 COc1ccc(cc1C)N[13CH3] 34a_100000743268_200025704644 [0,1,0,0,0,0|3,0,0]=4 2519 B11R1.279 COc1ccc(cc1C)N[13CH3] 7a_100000743268_200025704644 [0,1,0,0,0,0|3,0,0]=4 2520 B11R1.279 COc1ccc(cc1C)O[13CH3] 34a_100000759738_200025704644 [0,1,0,0,0,0|3,0,0]=4 2521 B11R1.279 COc1ccc(cc1C)O[13CH3] 7a_100000759738_200025704644 [0,1,0,0,0,0|3,0,0]=4 2522 B11R1.279 COc1ccc(cc1C)SC 62a_100011219705_200000210301 [0,1,0,0,0,0|3,0,0]=4 2523 B11R1.279 COc1ccc(cc1C)SC 62a_200000210301_100011219705 [0,1,0,0,0,0|3,0,0]=4 2524 B11R1.279 COc1ccc(cc1C)S[13CH3] 62a_100011219705_200025704644 [0,1,0,0,0,0|3,0,0]=4 2525 B11R1.279 COc1ccc(cc1C)S[13CH3] 62a_200025704644_100011219705 [0,1,0,0,0,0|3,0,0]=4 2526 B11R1.279 COc1ccc(cc1Cl)N[13CH3] 2230a_100000211044_200025704644 [0,1,0,0,0,0|3,0,0]=4 2527 B11R1.279 COc1ccc(cc1Cl)N[13CH3] 34a_100000211044_200025704644 [0,1,0,0,0,0|3,0,0]=4 2528 B11R1.279 COc1ccc(cc1Cl)O[13CH3] 34a_200009861682_200025704644 [0,1,0,0,0,0|3,0,0]=4 2529 B11R1.279 COc1ccc(cc1Cl)O[13CH3] 7a_200009861682_200025704644 [0,1,0,0,0,0|3,0,0]=4 2530 B11R1.279 COc1ccc(cc1Cl)SC 62a_100012355395_200000210301 [0,1,0,0,0,0|3,0,0]=4 2531 B11R1.279 COc1ccc(cc1Cl)SC 62a_200000210301_100012355395 [0,1,0,0,0,0|3,0,0]=4 2532 B11R1.279 COc1ccc(cc1Cl)S[13CH3] 62a_100012355395_200025704644 [0,1,0,0,0,0|3,0,0]=4 2533 B11R1.279 COc1ccc(cc1Cl)S[13CH3] 62a_200025704644_100012355395 [0,1,0,0,0,0|3,0,0]=4 2534 B11R1.279 COc1ccc(cc1F)CN 34a_100000758358_200000210301 [0,1,0,0,0,0|3,0,0]=4 2535 B11R1.279 COc1ccc(cc1F)N[13CH3] 2230a_100000740183_200025704644 [0,1,0,0,0,0|3,0,0]=4 2536 B11R1.279 COc1ccc(cc1F)N[13CH3] 34a_100000740183_200025704644 [0,1,0,0,0,0|3,0,0]=4 2537 B11R1.279 COc1ccc(cc1F)O[13CH3] 34a_100000746305_200025704644 [0,1,0,0,0,0|3,0,0]=4 2538 B11R1.279 COc1ccc(cc1F)O[13CH3] 7a_100000746305_200025704644 [0,1,0,0,0,0|3,0,0]=4 2539 B11R1.279 COc1ccc(cc1F)SC 62a_100000171752_200000210301 [0,1,0,0,0,0|3,0,0]=4 2540 B11R1.279 COc1ccc(cc1F)SC 62a_200000210301_100000171752 [0,1,0,0,0,0|3,0,0]=4 2541 B11R1.279 COc1ccc(cc1F)S[13CH3] 62a_100000171752_200025704644 [0,1,0,0,0,0|3,0,0]=4 2542 B11R1.279 COc1ccc(cc1F)S[13CH3] 62a_200025704644_100000171752 [0,1,0,0,0,0|3,0,0]=4 2543 B11R1.279 COc1ccc(cc1I)N[13CH3] 34a_100011356947_200025704644 [0,1,0,0,0,0|3,0,0]=4 2544 B11R1.279 COc1ccc(cc1I)O[13CH3] 34a_100010084122_200025704644 [0,1,0,0,0,0|3,0,0]=4 2545 B11R1.279 COc1ccc(cc1I)O[13CH3] 7a_100010084122_200025704644 [0,1,0,0,0,0|3,0,0]=4 2546 B11R1.279 COc1ccc(cc1N)CO 34a_100000123545_200000210301 [0,1,0,0,0,0|3,0,0]=4 2547 B11R1.279 COc1ccc(cc1N)SC 62a_100011249504_200000210301 [0,1,0,0,0,0|3,0,0]=4 2548 B11R1.279 COc1ccc(cc1N)SC 62a_200000210301_100011249504 [0,1,0,0,0,0|3,0,0]=4 2549 B11R1.279 COc1ccc(cc1N)S[13CH3] 62a_100011249504_200025704644 [0,1,0,0,0,0|3,0,0]=4 2550 B11R1.279 COc1ccc(cc1N)S[13CH3] 62a_200025704644_100011249504 [0,1,0,0,0,0|3,0,0]=4 2551 B11R1.279 COc1ccc(cc1O)C#N 271570a_203496583355_100000188253 [0,1,0,0,0,0|2,0,1]=4 2552 B11R1.279 COc1ccc(cc1O)C=O 271570a_203496583355_100000173361 [0,1,0,0,0,0|2,0,1]=4 2553 B11R1.279 COc1ccc(cc1O)CN 271570a_203496583355_100159240714 [0,1,0,0,0,0|2,0,0]=3 2554 B11R1.279 COc1ccc(cc1O)CO 271570a_203496583355_100000246451 [0,1,0,0,0,0|2,0,0]=3 2555 B11R1.279 COc1ccc(cc1O)N[13CH3] 34a_100000211920_200025704644 [0,1,0,0,0,0|2,0,0]=3 2556 B11R1.279 COc1ccc(cc1O)SC 62a_200000210301_100009816560 [0,1,0,0,0,0|2,0,0]=3 2557 B11R1.279 COc1ccc(cc1O)S[13CH3] 62a_200025704644_100009816560 [0,1,0,0,0,0|2,0,0]=3 2558 B11R1.279 COc1ccc(nc1O)CO 271570a_203496583355_100009842956 [0,1,0,0,0,0|3,0,0]=4 2559 B11R1.279 COc1cnc(c(c1)O)C#N 271570a_203496583355_100010187620 [0,1,0,0,0,0|2,0,1]=4 2560 B11R1.279 COc1cnc(c(c1)O)C=O 271570a_203496583355_200010135874 [0,1,0,0,0,0|1,0,0]=2 2561 B11R1.279 COc1cnc(cc1O)SC 62a_200000210301_100010264082 [0,1,0,0,0,0|3,0,0]=4 2562 B11R1.279 COc1cnc(cc1O)S[13CH3] 62a_200025704644_100010264082 [0,1,0,0,0,0|3,0,0]=4 2563 B11R1.279 COc1ncc(cc1O)SC 62a_200000210301_100010135713 [0,1,0,0,0,0|3,0,0]=4 2564 B11R1.279 COc1ncc(cc1O)S[13CH3] 62a_200025704644_100010135713 [0,1,0,0,0,0|3,0,0]=4 2565 B11R1.279 CSc1cc(c(cn1)C=O)C 62a_100000085382_200000210301 [0,1,0,0,0,0|2,0,0]=3 2566 B11R1.279 CSc1cc(c(cn1)C=O)C 62a_200000210301_100000085382 [0,1,0,0,0,0|2,0,0]=3 2567 B11R1.279 CSc1cc(c(cn1)C=O)N 62a_100000050503_200000210301 [0,1,0,0,0,0|2,0,0]=3 2568 B11R1.279 CSc1cc(c(cn1)C=O)N 62a_200000210301_100000050503 [0,1,0,0,0,0|2,0,0]=3 2569 B11R1.279 CSc1ccc(c(c1)Br)C#N 62a_100012349582_200000210301 [0,1,0,0,0,0|2,0,1]=4 2570 B11R1.279 CSc1ccc(c(c1)Br)C#N 62a_200000210301_100012349582 [0,1,0,0,0,0|2,0,1]=4 2571 B11R1.279 CSc1ccc(c(c1)Br)C=O 62a_100010185650_200000210301 [0,1,0,0,0,0|1,0,0]=2 2572 B11R1.279 CSc1ccc(c(c1)Br)C=O 62a_200000210301_100010185650 [0,1,0,0,0,0|1,0,0]=2 2573 B11R1.279 CSc1ccc(c(c1)Br)CO 62a_100010240206_200000210301 [0,1,0,0,0,0|1,0,2]=4 2574 B11R1.279 CSc1ccc(c(c1)Br)CO 62a_200000210301_100010240206 [0,1,0,0,0,0|1,0,2]=4 2575 B11R1.279 CSc1ccc(c(c1)C)C#N 62a_200000210301_100000687762 [0,1,0,0,0,0|2,0,1]=4 2576 B11R1.279 CSc1ccc(c(c1)C)C=O 62a_100000766358_200000210301 [0,1,0,0,0,0|1,0,0]=2 2577 B11R1.279 CSc1ccc(c(c1)C)C=O 62a_200000210301_100000766358 [0,1,0,0,0,0|1,0,0]=2 2578 B11R1.279 CSc1ccc(c(c1)C)CF 62a_200000210301_200010711859 [0,1,0,0,0,0|2,0,1]=4 2579 B11R1.279 CSc1ccc(c(c1)C)CF 62a_200010711859_200000210301 [0,1,0,0,0,0|2,0,1]=4 2580 B11R1.279 CSc1ccc(c(c1)C)CN 62a_100000753881_200000210301 [0,1,0,0,0,0|2,0,1]=4 2581 B11R1.279 CSc1ccc(c(c1)C)CN 62a_200000210301_100000753881 [0,1,0,0,0,0|2,0,1]=4 2582 B11R1.279 CSc1ccc(c(c1)C)CO 62a_100000748258_200000210301 [0,1,0,0,0,0|1,0,2]=4 2583 B11R1.279 CSc1ccc(c(c1)C)CO 62a_200000210301_100000748258 [0,1,0,0,0,0|1,0,2]=4 2584 B11R1.279 CSc1ccc(c(c1)C)NN 62a_100000751375_200000210301 [0,1,0,0,0,0|3,0,0]=4 2585 B11R1.279 CSc1ccc(c(c1)C)NN 62a_200000210301_100000751375 [0,1,0,0,0,0|3,0,0]=4 2586 B11R1.279 CSc1ccc(c(c1)Cl)C#N 62a_200000210301_100012349662 [0,1,0,0,0,0|2,0,1]=4 2587 B11R1.279 CSc1ccc(c(c1)Cl)C=O 62a_100000727542_200000210301 [0,1,0,0,0,0|1,0,0]=2 2588 B11R1.279 CSc1ccc(c(c1)Cl)C=O 62a_200000210301_100000727542 [0,1,0,0,0,0|1,0,0]=2 2589 B11R1.279 CSc1ccc(c(c1)Cl)SC 62a_200000210301_206447510565 [0,1,0,0,0,0|3,0,0]=4 2590 B11R1.279 CSc1ccc(c(c1)Cl)SC 62a_206447510565_200000210301 [0,1,0,0,0,0|3,0,0]=4 2591 B11R1.279 CSc1ccc(c(c1)F)C#N 62a_200000210301_100000037869 [0,1,0,0,0,0|2,0,1]=4 2592 B11R1.279 CSc1ccc(c(c1)F)C=O 62a_100000211676_200000210301 [0,1,0,0,0,0|1,0,0]=2 2593 B11R1.279 CSc1ccc(c(c1)F)C=O 62a_200000210301_100000211676 [0,1,0,0,0,0|1,0,0]=2 2594 B11R1.279 CSc1ccc(c(c1)F)CN 62a_100000754580_200000210301 [0,1,0,0,0,0|2,0,1]=4 2595 B11R1.279 CSc1ccc(c(c1)F)CN 62a_200000210301_100000754580 [0,1,0,0,0,0|2,0,1]=4 2596 B11R1.279 CSc1ccc(c(c1)F)CO 62a_100011191541_200000210301 [0,1,0,0,0,0|1,0,2]=4 2597 B11R1.279 CSc1ccc(c(c1)F)CO 62a_200000210301_100011191541 [0,1,0,0,0,0|1,0,2]=4 2598 B11R1.279 CSc1ccc(c(c1)F)NN 62a_100000751572_200000210301 [0,1,0,0,0,0|3,0,0]=4 2599 B11R1.279 CSc1ccc(c(c1)F)NN 62a_200000210301_100000751572 [0,1,0,0,0,0|3,0,0]=4 2600 B11R1.279 CSc1ccc(c(c1)F)N[13CH3] 34a_100012056844_200025704644 [0,1,0,0,0,0|3,0,0]=4 2601 B11R1.279 CSc1ccc(c(c1)F)SC 62a_100009816902_200000210301 [0,1,0,0,0,0|3,0,0]=4 2602 B11R1.279 CSc1ccc(c(c1)F)SC 62a_100010161220_200000210301 [0,1,0,0,0,0|3,0,0]=4 2603 B11R1.279 CSc1ccc(c(c1)F)SC 62a_200000210301_100009816902 [0,1,0,0,0,0|3,0,0]=4 2604 B11R1.279 CSc1ccc(c(c1)F)SC 62a_200000210301_100010161220 [0,1,0,0,0,0|3,0,0]=4 2605 B11R1.279 CSc1ccc(c(c1)F)S[13CH3] 62a_100009816902_200025704644 [0,1,0,0,0,0|3,0,0]=4 2606 B11R1.279 CSc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100009816902 [0,1,0,0,0,0|3,0,0]=4 2607 B11R1.279 CSc1ccc(c(c1)N)C#N 62a_200000210301_100000699244 [0,1,0,0,0,0|2,0,1]=4 2608 B11R1.279 CSc1ccc(c(c1)N)C=O 62a_100009814810_200000210301 [0,1,0,0,0,0|1,0,0]=2 2609 B11R1.279 CSc1ccc(c(c1)N)CO 62a_100000718831_200000210301 [0,1,0,0,0,0|1,0,2]=4 2610 B11R1.279 CSc1ccc(c(c1)N)CO 62a_200000210301_100000718831 [0,1,0,0,0,0|1,0,2]=4 2611 B11R1.279 CSc1ccc(c(c1)O)C#N 62a_200000210301_100011934713 [0,1,0,0,0,0|1,0,1]=3 2612 B11R1.279 CSc1ccc(c(c1)O)C=O 62a_100011277552_200000210301 [0,1,0,0,0,0|0,0,0]=1 2613 B11R1.279 CSc1ccc(c(c1)O)C=O 62a_200000210301_100011277552 [0,1,0,0,0,0|0,0,0]=1 2614 B11R1.279 CSc1ccc(c(c1)O)CO 62a_100000071718_200000210301 [0,1,0,0,0,0|0,0,2]=3 2615 B11R1.279 CSc1ccc(c(c1)O)CO 62a_200000210301_100000071718 [0,1,0,0,0,0|0,0,2]=3 2616 B11R1.279 CSc1ccc(c(n1)C)C=O 62a_100000050599_200000210301 [0,1,0,0,0,0|2,0,0]=3 2617 B11R1.279 CSc1ccc(c(n1)C)C=O 62a_200000210301_100000050599 [0,1,0,0,0,0|2,0,0]=3 2618 B11R1.279 CSc1ccc(c(n1)F)C=O 62a_100010064369_200000210301 [0,1,0,0,0,0|2,0,0]=3 2619 B11R1.279 CSc1ccc(c(n1)F)C=O 62a_200000210301_100010064369 [0,1,0,0,0,0|2,0,0]=3 2620 B11R1.279 CSc1ccc(cc1C)CN 62a_100015205234_200000210301 [0,1,0,0,0,0|3,0,0]=4 2621 B11R1.279 CSc1ccc(cc1C)CN 62a_200000210301_100015205234 [0,1,0,0,0,0|3,0,0]=4 2622 B11R1.279 CSc1ccc(cc1C)CO 62a_100000718852_200000210301 [0,1,0,0,0,0|3,0,0]=4 2623 B11R1.279 CSc1ccc(cc1C)CO 62a_200000210301_100000718852 [0,1,0,0,0,0|3,0,0]=4 2624 B11R1.279 CSc1ccc(cc1C)O[13CH3] 34a_100000030144_200025704644 [0,1,0,0,0,0|3,0,0]=4 2625 B11R1.279 CSc1ccc(cc1Cl)CO 62a_100000718186_200000210301 [0,1,0,0,0,0|3,0,0]=4 2626 B11R1.279 CSc1ccc(cc1Cl)CO 62a_200000210301_100000718186 [0,1,0,0,0,0|3,0,0]=4 2627 B11R1.279 CSc1ccc(cc1Cl)S[13CH3] 62a_200025704644_206447510565 [0,1,0,0,0,0|3,0,0]=4 2628 B11R1.279 CSc1ccc(cc1Cl)S[13CH3] 62a_206447510565_200025704644 [0,1,0,0,0,0|3,0,0]=4 2629 B11R1.279 CSc1ccc(cc1F)CN 62a_100000755036_200000210301 [0,1,0,0,0,0|3,0,0]=4 2630 B11R1.279 CSc1ccc(cc1F)CN 62a_200000210301_100000755036 [0,1,0,0,0,0|3,0,0]=4 2631 B11R1.279 CSc1ccc(cc1F)CO 62a_100011533735_200000210301 [0,1,0,0,0,0|3,0,0]=4 2632 B11R1.279 CSc1ccc(cc1F)CO 62a_200000210301_100011533735 [0,1,0,0,0,0|3,0,0]=4 2633 B11R1.279 CSc1ccc(cc1F)N[13CH3] 2230a_100000762756_200025704644 [0,1,0,0,0,0|3,0,0]=4 2634 B11R1.279 CSc1ccc(cc1F)N[13CH3] 34a_100000762756_200025704644 [0,1,0,0,0,0|3,0,0]=4 2635 B11R1.279 CSc1ccc(cc1F)S[13CH3] 62a_100010161220_200025704644 [0,1,0,0,0,0|3,0,0]=4 2636 B11R1.279 CSc1ccc(cc1F)S[13CH3] 62a_200025704644_100010161220 [0,1,0,0,0,0|3,0,0]=4 2637 B11R1.279 CSc1ccc(cc1N)CO 62a_100012347568_200000210301 [0,1,0,0,0,0|3,0,0]=4 2638 B11R1.279 CSc1ccc(cc1N)CO 62a_200000210301_100012347568 [0,1,0,0,0,0|3,0,0]=4 2639 B11R1.279 CSc1ccc(cc1O)C#N 62a_200000210301_100009877741 [0,1,0,0,0,0|2,0,1]=4 2640 B11R1.279 CSc1ccc(cc1O)C=O 62a_100000041418_200000210301 [0,1,0,0,0,0|2,0,1]=4 2641 B11R1.279 CSc1ccc(cc1O)C=O 62a_200000210301_100000041418 [0,1,0,0,0,0|2,0,1]=4 2642 B11R1.279 CSc1ccc(cc1O)CO 62a_100000049605_200000210301 [0,1,0,0,0,0|2,0,0]=3 2643 B11R1.279 CSc1ccc(cc1O)CO 62a_200000210301_100000049605 [0,1,0,0,0,0|2,0,0]=3 2644 B11R1.279 CSc1cnc(c(c1)C)C=O 62a_100010185443_200000210301 [0,1,0,0,0,0|2,0,0]=3 2645 B11R1.279 CSc1cnc(c(c1)C)C=O 62a_200000210301_100010185443 [0,1,0,0,0,0|2,0,0]=3 2646 B11R1.279 CSc1cnc(c(c1)F)C=O 62a_100010180630_200000210301 [0,1,0,0,0,0|2,0,0]=3 2647 B11R1.279 CSc1cnc(c(c1)F)C=O 62a_200000210301_100010180630 [0,1,0,0,0,0|2,0,0]=3 2648 B11R1.279 CSc1cnc(c(c1)O)C#N 62a_200000210301_200013853302 [0,1,0,0,0,0|2,0,1]=4 2649 B11R1.279 CSc1ncc(c(n1)N)C=O 62a_100010726233_200000210301 [0,1,0,0,0,0|3,0,0]=4 2650 B11R1.279 CSc1ncc(c(n1)N)C=O 62a_200000210301_100010726233 [0,1,0,0,0,0|3,0,0]=4 2651 B11R1.279 CSc1ncc(c(n1)O)C=O 271570a_203496583355_100009862043 [0,1,0,0,0,0|2,0,0]=3 2652 B11R1.279 Cc1cc(ccc1C#N)N[13CH3] 34a_100011999795_200025704644 [0,1,0,0,0,0|2,0,1]=4 2653 B11R1.279 Cc1cc(ccc1C#N)N[13CH3] 7a_100011999795_200025704644 [0,1,0,0,0,0|2,0,1]=4 2654 B11R1.279 Cc1cc(ccc1C#N)O[13CH3] 34a_100000720286_200025704644 [0,1,0,0,0,0|2,0,1]=4 2655 B11R1.279 Cc1cc(ccc1C#N)O[13CH3] 7a_100000720286_200025704644 [0,1,0,0,0,0|2,0,1]=4 2656 B11R1.279 Cc1cc(ccc1C#N)S[13CH3] 62a_200025704644_100000687762 [0,1,0,0,0,0|2,0,1]=4 2657 B11R1.279 Cc1cc(ccc1C=O)S[13CH3] 62a_100000766358_200025704644 [0,1,0,0,0,0|1,0,0]=2 2658 B11R1.279 Cc1cc(ccc1C=O)S[13CH3] 62a_200025704644_100000766358 [0,1,0,0,0,0|1,0,0]=2 2659 B11R1.279 Cc1cc(ccc1CF)S[13CH3] 62a_200010711859_200025704644 [0,1,0,0,0,0|2,0,1]=4 2660 B11R1.279 Cc1cc(ccc1CF)S[13CH3] 62a_200025704644_200010711859 [0,1,0,0,0,0|2,0,1]=4 2661 B11R1.279 Cc1cc(ccc1CN)S[13CH3] 62a_100000753881_200025704644 [0,1,0,0,0,0|2,0,1]=4 2662 B11R1.279 Cc1cc(ccc1CN)S[13CH3] 62a_200025704644_100000753881 [0,1,0,0,0,0|2,0,1]=4 2663 B11R1.279 Cc1cc(ccc1CO)N[13CH3] 34a_100000102464_200025704644 [0,1,0,0,0,0|1,0,2]=4 2664 B11R1.279 Cc1cc(ccc1CO)S[13CH3] 62a_100000748258_200025704644 [0,1,0,0,0,0|1,0,2]=4 2665 B11R1.279 Cc1cc(ccc1CO)S[13CH3] 62a_200025704644_100000748258 [0,1,0,0,0,0|1,0,2]=4 2666 B11R1.279 Cc1cc(ccc1NN)S[13CH3] 62a_100000751375_200025704644 [0,1,0,0,0,0|3,0,0]=4 2667 B11R1.279 Cc1cc(ccc1NN)S[13CH3] 62a_200025704644_100000751375 [0,1,0,0,0,0|3,0,0]=4 2668 B11R1.279 Cc1cc(ccc1N[13CH3])CO 2230a_200011997030_200025704644 [0,1,0,0,0,0|3,0,0]=4 2669 B11R1.279 Cc1cc(ccc1N[13CH3])CO 34a_200011997030_200025704644 [0,1,0,0,0,0|3,0,0]=4 2670 B11R1.279 Cc1cc(ccc1O[13CH3])CO 34a_100000075815_200025704644 [0,1,0,0,0,0|3,0,0]=4 2671 B11R1.279 Cc1cc(ccc1O[13CH3])CO 7a_100000075815_200025704644 [0,1,0,0,0,0|3,0,0]=4 2672 B11R1.279 Cc1cc(ccc1S[13CH3])CN 62a_100015205234_200025704644 [0,1,0,0,0,0|3,0,0]=4 2673 B11R1.279 Cc1cc(ccc1S[13CH3])CN 62a_200025704644_100015205234 [0,1,0,0,0,0|3,0,0]=4 2674 B11R1.279 Cc1cc(ccc1S[13CH3])CO 62a_100000718852_200025704644 [0,1,0,0,0,0|3,0,0]=4 2675 B11R1.279 Cc1cc(ccc1S[13CH3])CO 62a_200025704644_100000718852 [0,1,0,0,0,0|3,0,0]=4 2676 B11R1.279 Cc1cc(cnc1C=O)S[13CH3] 62a_100010185443_200025704644 [0,1,0,0,0,0|2,0,0]=3 2677 B11R1.279 Cc1cc(cnc1C=O)S[13CH3] 62a_200025704644_100010185443 [0,1,0,0,0,0|2,0,0]=3 2678 B11R1.279 Cc1cc(ncc1C=O)S[13CH3] 62a_100000085382_200025704644 [0,1,0,0,0,0|2,0,0]=3 2679 B11R1.279 Cc1cc(ncc1C=O)S[13CH3] 62a_200025704644_100000085382 [0,1,0,0,0,0|2,0,0]=3 2680 B11R1.279 Cc1nc(ccc1C=O)S[13CH3] 62a_100000050599_200025704644 [0,1,0,0,0,0|2,0,0]=3 2681 B11R1.279 Cc1nc(ccc1C=O)S[13CH3] 62a_200025704644_100000050599 [0,1,0,0,0,0|2,0,0]=3 2682 B11R1.279 N#Cc1ccc(c(c1)O)C=O 271570a_203496583355_100012355658 [0,1,0,0,0,0|0,0,1]=2 2683 B11R1.279 N#Cc1ccc(c(c1)O)CN 271570a_203496583355_114948178924 [0,1,0,0,0,0|1,0,2]=4 2684 B11R1.279 N#Cc1ccc(c(c1)O)CO 271570a_203496583355_100010214422 [0,1,0,0,0,0|0,0,3]=4 2685 B11R1.279 N#Cc1ccc(cc1O)C=O 271570a_203496583355_100012355660 [0,1,0,0,0,0|1,0,2]=4 2686 B11R1.279 N#Cc1ccc(cc1O)CO 271570a_203496583355_100009876504 [0,1,0,0,0,0|1,0,1]=3 2687 B11R1.279 N#Cc1ccc(cc1O)NN 271570a_203496583355_200012354828 [0,1,0,0,0,0|2,0,1]=4 2688 B11R1.279 O=Cc1ccc(c(c1)O)C=O 271570a_203496583355_100015597013 [0,1,0,0,0,0|0,0,1]=2 2689 B11R1.279 OCc1ccc(c(c1)O)CO 271570a_203496583355_100010881536 [0,1,0,0,0,0|0,0,2]=3 2690 B11R1.279 [13CH3]Nc1ccc(c(c1)Br)C#N 34a_100000689153_200025704644 [0,1,0,0,0,0|2,0,1]=4 2691 B11R1.279 [13CH3]Nc1ccc(c(c1)Br)C#N 7a_100000689153_200025704644 [0,1,0,0,0,0|2,0,1]=4 2692 B11R1.279 [13CH3]Nc1ccc(c(c1)Cl)C#N 34a_100000211542_200025704644 [0,1,0,0,0,0|2,0,1]=4 2693 B11R1.279 [13CH3]Nc1ccc(c(c1)Cl)C#N 7a_100000211542_200025704644 [0,1,0,0,0,0|2,0,1]=4 2694 B11R1.279 [13CH3]Nc1ccc(c(c1)Cl)CO 34a_100000689119_200025704644 [0,1,0,0,0,0|1,0,2]=4 2695 B11R1.279 [13CH3]Nc1ccc(c(c1)F)C#N 34a_100000765089_200025704644 [0,1,0,0,0,0|2,0,1]=4 2696 B11R1.279 [13CH3]Nc1ccc(c(c1)F)C#N 7a_100000765089_200025704644 [0,1,0,0,0,0|2,0,1]=4 2697 B11R1.279 [13CH3]Nc1ccc(c(c1)O)C#N 34a_100000094571_200025704644 [0,1,0,0,0,0|1,0,1]=3 2698 B11R1.279 [13CH3]Nc1ccc(c(c1)O)C#N 7a_100000094571_200025704644 [0,1,0,0,0,0|1,0,1]=3 2699 B11R1.279 [13CH3]Nc1ccc(cc1F)CO 2230a_100011217239_200025704644 [0,1,0,0,0,0|3,0,0]=4 2700 B11R1.279 [13CH3]Nc1ccc(cc1F)CO 34a_100011217239_200025704644 [0,1,0,0,0,0|3,0,0]=4 2701 B11R1.279 [13CH3]Nc1ccc(cc1O)C#N 34a_100011997735_200025704644 [0,1,0,0,0,0|2,0,1]=4 2702 B11R1.279 [13CH3]Oc1ccc(c(c1)Br)C#N 34a_100012184851_200025704644 [0,1,0,0,0,0|2,0,1]=4 2703 B11R1.279 [13CH3]Oc1ccc(c(c1)Br)C#N 7a_100012184851_200025704644 [0,1,0,0,0,0|2,0,1]=4 2704 B11R1.279 [13CH3]Oc1ccc(c(c1)Br)CO 34a_100010146404_200025704644 [0,1,0,0,0,0|1,0,2]=4 2705 B11R1.279 [13CH3]Oc1ccc(c(c1)Br)CO 7a_100010146404_200025704644 [0,1,0,0,0,0|1,0,2]=4 2706 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)C#N 34a_100000716493_200025704644 [0,1,0,0,0,0|2,0,1]=4 2707 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)C#N 7a_100000716493_200025704644 [0,1,0,0,0,0|2,0,1]=4 2708 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)CN 34a_200161156549_200025704644 [0,1,0,0,0,0|2,0,1]=4 2709 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)CO 34a_200000075811_200025704644 [0,1,0,0,0,0|1,0,2]=4 2710 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)CO 7a_200000075811_200025704644 [0,1,0,0,0,0|1,0,2]=4 2711 B11R1.279 [13CH3]Oc1ccc(c(c1)F)C#N 34a_100000753931_200025704644 [0,1,0,0,0,0|2,0,1]=4 2712 B11R1.279 [13CH3]Oc1ccc(c(c1)F)C#N 7a_100000753931_200025704644 [0,1,0,0,0,0|2,0,1]=4 2713 B11R1.279 [13CH3]Oc1ccc(c(c1)F)CO 34a_100000084598_200025704644 [0,1,0,0,0,0|1,0,2]=4 2714 B11R1.279 [13CH3]Oc1ccc(c(c1)F)CO 7a_100000084598_200025704644 [0,1,0,0,0,0|1,0,2]=4 2715 B11R1.279 [13CH3]Oc1ccc(cc1Br)CO 34a_100011191544_200025704644 [0,1,0,0,0,0|3,0,0]=4 2716 B11R1.279 [13CH3]Oc1ccc(cc1Br)CO 7a_100011191544_200025704644 [0,1,0,0,0,0|3,0,0]=4 2717 B11R1.279 [13CH3]Oc1ccc(cc1F)CN 34a_100000758358_200025704644 [0,1,0,0,0,0|3,0,0]=4 2718 B11R1.279 [13CH3]Oc1ccc(cc1N)CO 34a_100000123545_200025704644 [0,1,0,0,0,0|3,0,0]=4 2719 B11R1.279 [13CH3]Sc1cc(c(cn1)C=O)N 62a_100000050503_200025704644 [0,1,0,0,0,0|2,0,0]=3 2720 B11R1.279 [13CH3]Sc1cc(c(cn1)C=O)N 62a_200025704644_100000050503 [0,1,0,0,0,0|2,0,0]=3 2721 B11R1.279 [13CH3]Sc1ccc(c(c1)Br)C#N 62a_100012349582_200025704644 [0,1,0,0,0,0|2,0,1]=4 2722 B11R1.279 [13CH3]Sc1ccc(c(c1)Br)C#N 62a_200025704644_100012349582 [0,1,0,0,0,0|2,0,1]=4 2723 B11R1.279 [13CH3]Sc1ccc(c(c1)Br)C=O 62a_100010185650_200025704644 [0,1,0,0,0,0|1,0,0]=2 2724 B11R1.279 [13CH3]Sc1ccc(c(c1)Br)C=O 62a_200025704644_100010185650 [0,1,0,0,0,0|1,0,0]=2 2725 B11R1.279 [13CH3]Sc1ccc(c(c1)Br)CO 62a_100010240206_200025704644 [0,1,0,0,0,0|1,0,2]=4 2726 B11R1.279 [13CH3]Sc1ccc(c(c1)Br)CO 62a_200025704644_100010240206 [0,1,0,0,0,0|1,0,2]=4 2727 B11R1.279 [13CH3]Sc1ccc(c(c1)Cl)C#N 62a_200025704644_100012349662 [0,1,0,0,0,0|2,0,1]=4 2728 B11R1.279 [13CH3]Sc1ccc(c(c1)Cl)C=O 62a_100000727542_200025704644 [0,1,0,0,0,0|1,0,0]=2 2729 B11R1.279 [13CH3]Sc1ccc(c(c1)Cl)C=O 62a_200025704644_100000727542 [0,1,0,0,0,0|1,0,0]=2 2730 B11R1.279 [13CH3]Sc1ccc(c(c1)F)C#N 62a_200025704644_100000037869 [0,1,0,0,0,0|2,0,1]=4 2731 B11R1.279 [13CH3]Sc1ccc(c(c1)F)C=O 62a_100000211676_200025704644 [0,1,0,0,0,0|1,0,0]=2 2732 B11R1.279 [13CH3]Sc1ccc(c(c1)F)C=O 62a_200025704644_100000211676 [0,1,0,0,0,0|1,0,0]=2 2733 B11R1.279 [13CH3]Sc1ccc(c(c1)F)CN 62a_100000754580_200025704644 [0,1,0,0,0,0|2,0,1]=4 2734 B11R1.279 [13CH3]Sc1ccc(c(c1)F)CN 62a_200025704644_100000754580 [0,1,0,0,0,0|2,0,1]=4 2735 B11R1.279 [13CH3]Sc1ccc(c(c1)F)CO 62a_100011191541_200025704644 [0,1,0,0,0,0|1,0,2]=4 2736 B11R1.279 [13CH3]Sc1ccc(c(c1)F)CO 62a_200025704644_100011191541 [0,1,0,0,0,0|1,0,2]=4 2737 B11R1.279 [13CH3]Sc1ccc(c(c1)F)NN 62a_100000751572_200025704644 [0,1,0,0,0,0|3,0,0]=4 2738 B11R1.279 [13CH3]Sc1ccc(c(c1)F)NN 62a_200025704644_100000751572 [0,1,0,0,0,0|3,0,0]=4 2739 B11R1.279 [13CH3]Sc1ccc(c(c1)N)C#N 62a_200025704644_100000699244 [0,1,0,0,0,0|2,0,1]=4 2740 B11R1.279 [13CH3]Sc1ccc(c(c1)N)C=O 62a_100009814810_200025704644 [0,1,0,0,0,0|1,0,0]=2 2741 B11R1.279 [13CH3]Sc1ccc(c(c1)N)CO 62a_100000718831_200025704644 [0,1,0,0,0,0|1,0,2]=4 2742 B11R1.279 [13CH3]Sc1ccc(c(c1)N)CO 62a_200025704644_100000718831 [0,1,0,0,0,0|1,0,2]=4 2743 B11R1.279 [13CH3]Sc1ccc(c(c1)O)C#N 62a_200025704644_100011934713 [0,1,0,0,0,0|1,0,1]=3 2744 B11R1.279 [13CH3]Sc1ccc(c(c1)O)C=O 62a_100011277552_200025704644 [0,1,0,0,0,0|0,0,0]=1 2745 B11R1.279 [13CH3]Sc1ccc(c(c1)O)C=O 62a_200025704644_100011277552 [0,1,0,0,0,0|0,0,0]=1 2746 B11R1.279 [13CH3]Sc1ccc(c(c1)O)CO 62a_100000071718_200025704644 [0,1,0,0,0,0|0,0,2]=3 2747 B11R1.279 [13CH3]Sc1ccc(c(c1)O)CO 62a_200025704644_100000071718 [0,1,0,0,0,0|0,0,2]=3 2748 B11R1.279 [13CH3]Sc1ccc(c(n1)F)C=O 62a_100010064369_200025704644 [0,1,0,0,0,0|2,0,0]=3 2749 B11R1.279 [13CH3]Sc1ccc(c(n1)F)C=O 62a_200025704644_100010064369 [0,1,0,0,0,0|2,0,0]=3 2750 B11R1.279 [13CH3]Sc1ccc(cc1Cl)CO 62a_100000718186_200025704644 [0,1,0,0,0,0|3,0,0]=4 2751 B11R1.279 [13CH3]Sc1ccc(cc1Cl)CO 62a_200025704644_100000718186 [0,1,0,0,0,0|3,0,0]=4 2752 B11R1.279 [13CH3]Sc1ccc(cc1F)CN 62a_100000755036_200025704644 [0,1,0,0,0,0|3,0,0]=4 2753 B11R1.279 [13CH3]Sc1ccc(cc1F)CN 62a_200025704644_100000755036 [0,1,0,0,0,0|3,0,0]=4 2754 B11R1.279 [13CH3]Sc1ccc(cc1F)CO 62a_100011533735_200025704644 [0,1,0,0,0,0|3,0,0]=4 2755 B11R1.279 [13CH3]Sc1ccc(cc1F)CO 62a_200025704644_100011533735 [0,1,0,0,0,0|3,0,0]=4 2756 B11R1.279 [13CH3]Sc1ccc(cc1N)CO 62a_100012347568_200025704644 [0,1,0,0,0,0|3,0,0]=4 2757 B11R1.279 [13CH3]Sc1ccc(cc1N)CO 62a_200025704644_100012347568 [0,1,0,0,0,0|3,0,0]=4 2758 B11R1.279 [13CH3]Sc1ccc(cc1O)C#N 62a_200025704644_100009877741 [0,1,0,0,0,0|2,0,1]=4 2759 B11R1.279 [13CH3]Sc1ccc(cc1O)C=O 62a_100000041418_200025704644 [0,1,0,0,0,0|2,0,1]=4 2760 B11R1.279 [13CH3]Sc1ccc(cc1O)C=O 62a_200025704644_100000041418 [0,1,0,0,0,0|2,0,1]=4 2761 B11R1.279 [13CH3]Sc1ccc(cc1O)CO 62a_100000049605_200025704644 [0,1,0,0,0,0|2,0,0]=3 2762 B11R1.279 [13CH3]Sc1ccc(cc1O)CO 62a_200025704644_100000049605 [0,1,0,0,0,0|2,0,0]=3 2763 B11R1.279 [13CH3]Sc1cnc(c(c1)F)C=O 62a_100010180630_200025704644 [0,1,0,0,0,0|2,0,0]=3 2764 B11R1.279 [13CH3]Sc1cnc(c(c1)F)C=O 62a_200025704644_100010180630 [0,1,0,0,0,0|2,0,0]=3 2765 B11R1.279 [13CH3]Sc1cnc(c(c1)O)C#N 62a_200025704644_200013853302 [0,1,0,0,0,0|2,0,1]=4 2766 B11R1.279 [13CH3]Sc1ncc(c(n1)N)C=O 62a_100010726233_200025704644 [0,1,0,0,0,0|3,0,0]=4 2767 B11R1.279 [13CH3]Sc1ncc(c(n1)N)C=O 62a_200025704644_100010726233 [0,1,0,0,0,0|3,0,0]=4 2768 B11R1.464 C=Cc1c(cc(cc1Br)Br)F 271570a_100011290941_100000708766 [0,1,0,0,0,0|3,0,0]=4 2769 B11R1.464 C=Cc1c(cc(cc1Br)C)Br 271570a_100011290941_200011219743 [0,1,0,0,0,0|2,0,0]=3 2770 B11R1.464 C=Cc1c(cc(cc1Br)C)C 271570a_100011290941_200012353697 [0,1,0,0,0,0|2,0,0]=3 2771 B11R1.464 C=Cc1c(cc(cc1Br)C)F 271570a_100011290941_100010208195 [0,1,0,0,0,0|2,0,0]=3 2772 B11R1.464 C=Cc1c(cc(cc1Br)Cl)Cl 271570a_100011290941_200009992027 [0,1,0,0,0,0|3,0,0]=4 2773 B11R1.464 C=Cc1c(cc(cc1Br)Cl)F 271570a_100011290941_100009993495 [0,1,0,0,0,0|3,0,0]=4 2774 B11R1.464 C=Cc1c(cc(cc1Br)F)Br 271570a_100011290941_100009813983 [0,1,0,0,0,0|3,0,0]=4 2775 B11R1.464 C=Cc1c(cc(cc1Br)F)C 271570a_100011290941_100010208209 [0,1,0,0,0,0|3,0,0]=4 2776 B11R1.464 C=Cc1c(cc(cc1Br)F)Cl 271570a_100011290941_100012356682 [0,1,0,0,0,0|3,0,0]=4 2777 B11R1.464 C=Cc1c(cc(cc1Br)F)F 271570a_100011290941_100000720994 [0,1,0,0,0,0|3,0,0]=4 2778 B11R1.464 C=Cc1c(cc(cc1Br)F)N 271570a_100011290941_200010740111 [0,1,0,0,0,0|3,0,0]=4 2779 B11R1.464 C=Cc1c(cc(cc1C)Br)C 271570a_100011290941_100009814048 [0,1,0,0,0,0|3,0,0]=4 2780 B11R1.464 C=Cc1c(cc(cc1C)C)C 271570a_100011290941_100011204320 [0,1,0,0,0,0|2,0,0]=3 2781 B11R1.464 C=Cc1c(cc(cc1C)Cl)C 271570a_100011290941_100010244930 [0,1,0,0,0,0|3,0,0]=4 2782 B11R1.464 C=Cc1c(cc(cc1C)F)C 271570a_100011290941_100012356666 [0,1,0,0,0,0|3,0,0]=4 2783 B11R1.464 C=Cc1c(cc(cc1C)O)C 271570a_100011290941_100000243743 [0,1,0,0,0,0|3,0,0]=4 2784 B11R1.464 C=Cc1c(cc(cc1Cl)Br)Cl 271570a_100011290941_200011263224 [0,1,0,0,0,0|3,0,0]=4 2785 B11R1.464 C=Cc1c(cc(cc1Cl)Br)F 271570a_100011290941_100010212234 [0,1,0,0,0,0|3,0,0]=4 2786 B11R1.464 C=Cc1c(cc(cc1Cl)Cl)C 271570a_100011290941_200000035511 [0,1,0,0,0,0|3,0,0]=4 2787 B11R1.464 C=Cc1c(cc(cc1Cl)Cl)Cl 271570a_100011290941_200011216440 [0,1,0,0,0,0|3,0,0]=4 2788 B11R1.464 C=Cc1c(cc(cc1Cl)F)C 271570a_100011290941_100010079234 [0,1,0,0,0,0|3,0,0]=4 2789 B11R1.464 C=Cc1c(cc(cc1Cl)F)Cl 271570a_100011290941_100010175091 [0,1,0,0,0,0|3,0,0]=4 2790 B11R1.464 C=Cc1c(cc(cc1Cl)N)F 271570a_100011290941_100014833993 [0,1,0,0,0,0|3,0,0]=4 2791 B11R1.464 C=Cc1c(cc(cc1F)Br)F 271570a_100011290941_100009813614 [0,1,0,0,0,0|3,0,0]=4 2792 B11R1.464 C=Cc1c(cc(cc1F)C)F 271570a_100011290941_100015306127 [0,1,0,0,0,0|2,0,0]=3 2793 B11R1.464 C=Cc1c(cc(cc1F)C)N 271570a_100011290941_100021129147 [0,1,0,0,0,0|2,0,0]=3 2794 B11R1.464 C=Cc1c(cc(cc1F)Cl)N 271570a_100011290941_200021297760 [0,1,0,0,0,0|3,0,0]=4 2795 B11R1.464 C=Cc1c(cc(cc1F)F)F 271570a_100011290941_100000243675 [0,1,0,0,0,0|3,0,0]=4 2796 B11R1.464 C=Cc1c(cc(cc1F)F)N 271570a_100011290941_100000716482 [0,1,0,0,0,0|3,0,0]=4 2797 B11R1.464 C=Cc1c(cc(cc1F)F)O 271570a_100011290941_100009815984 [0,1,0,0,0,0|2,0,0]=3 2798 B11R1.464 C=Cc1c(cc(cc1F)O)F 271570a_100011290941_100010219129 [0,1,0,0,0,0|3,0,0]=4 2799 B11R1.464 C=Cc1c(cc(cc1N)Cl)C 271570a_100011290941_100000698757 [0,1,0,0,0,0|3,0,0]=4 2800 B11R1.464 C=Cc1c(cc(cc1O)C)C 271570a_100011290941_100010342985 [0,1,0,0,0,0|1,0,0]=2 2801 B11R1.464 C=Cc1c(cc(cc1O)Cl)C 271570a_100011290941_100010254216 [0,1,0,0,0,0|2,0,0]=3 2802 B11R1.464 C=Cc1c(cc(cc1O)O)O 271570a_100011290941_200010341185 [0,1,0,0,0,0|2,0,0]=3 2803 B11R1.464 C=Cc1c(cc(nc1C)C)N 271570a_100011290941_100010261885 [0,1,0,0,0,0|3,0,0]=4 2804 B11R1.464 CNc1c(cc(cc1Br)C)Br 34a_100000184052_200000210301 [0,1,0,0,0,0|3,0,0]=4 2805 B11R1.464 CNc1c(cc(cc1Br)C)C 34a_100000688863_200000210301 [0,1,0,0,0,0|3,0,0]=4 2806 B11R1.464 CNc1c(cc(cc1Br)C)Cl 34a_100012339639_200000210301 [0,1,0,0,0,0|3,0,0]=4 2807 B11R1.464 CNc1c(cc(cc1Br)C)F 34a_100012353694_200000210301 [0,1,0,0,0,0|3,0,0]=4 2808 B11R1.464 CNc1c(cc(cc1C)C)C 34a_100000210045_200000210301 [0,1,0,0,0,0|3,0,0]=4 2809 B11R1.464 CNc1c(cc(cc1C)C)C 7a_100000210045_200000210301 [0,1,0,0,0,0|3,0,0]=4 2810 B11R1.464 CNc1c(cc(cc1Cl)C)C 34a_100000211461_200000210301 [0,1,0,0,0,0|3,0,0]=4 2811 B11R1.464 CNc1c(cc(cc1Cl)C)C 7a_100000211461_200000210301 [0,1,0,0,0,0|3,0,0]=4 2812 B11R1.464 CNc1c(cc(cc1Cl)C)Cl 34a_100011996032_200000210301 [0,1,0,0,0,0|3,0,0]=4 2813 B11R1.464 CNc1c(cc(cc1Cl)C)O 34a_100015906060_200000210301 [0,1,0,0,0,0|2,0,0]=3 2814 B11R1.464 CNc1c(cc(cc1F)Br)O 34a_100015475841_200000210301 [0,1,0,0,0,0|3,0,0]=4 2815 B11R1.464 CNc1c(cc(cc1F)Cl)O 34a_100010883250_200000210301 [0,1,0,0,0,0|3,0,0]=4 2816 B11R1.464 CNc1c(cc(cc1F)Cl)O 7a_100010883250_200000210301 [0,1,0,0,0,0|3,0,0]=4 2817 B11R1.464 CNc1c(cc(cc1F)F)O 34a_100011217947_200000210301 [0,1,0,0,0,0|3,0,0]=4 2818 B11R1.464 CNc1c(cc(cc1F)F)O 7a_100011217947_200000210301 [0,1,0,0,0,0|3,0,0]=4 2819 B11R1.464 CNc1c(cc(cc1O)Br)C 34a_100010371313_200000210301 [0,1,0,0,0,0|3,0,0]=4 2820 B11R1.464 CNc1c(cc(cc1O)Br)C 7a_100010371313_200000210301 [0,1,0,0,0,0|3,0,0]=4 2821 B11R1.464 CNc1c(cc(cc1O)F)N 271570a_203496583355_114929179422 [0,1,0,0,0,0|3,0,0]=4 2822 B11R1.464 COc1c(cc(cc1Br)C)Br 34a_100000203795_200000210301 [0,1,0,0,0,0|3,0,0]=4 2823 B11R1.464 COc1c(cc(cc1Br)C)Br 7a_100000203795_200000210301 [0,1,0,0,0,0|3,0,0]=4 2824 B11R1.464 COc1c(cc(cc1Br)C)C 34a_100011934984_200000210301 [0,1,0,0,0,0|3,0,0]=4 2825 B11R1.464 COc1c(cc(cc1Br)C)C 7a_100011934984_200000210301 [0,1,0,0,0,0|3,0,0]=4 2826 B11R1.464 COc1c(cc(cc1Br)C)F 34a_200010713133_200000210301 [0,1,0,0,0,0|3,0,0]=4 2827 B11R1.464 COc1c(cc(cc1Br)C)F 7a_200010713133_200000210301 [0,1,0,0,0,0|3,0,0]=4 2828 B11R1.464 COc1c(cc(cc1C)C)C 34a_100000212074_200000210301 [0,1,0,0,0,0|3,0,0]=4 2829 B11R1.464 COc1c(cc(cc1C)C)C 7a_100000212074_200000210301 [0,1,0,0,0,0|3,0,0]=4 2830 B11R1.464 COc1c(cc(cc1Cl)C)Cl 34a_100000034925_200000210301 [0,1,0,0,0,0|3,0,0]=4 2831 B11R1.464 COc1c(cc(cc1Cl)C)Cl 7a_100000034925_200000210301 [0,1,0,0,0,0|3,0,0]=4 2832 B11R1.464 COc1c(cc(cc1F)C)O 271570a_203496583355_200010713180 [0,1,0,0,0,0|2,0,0]=3 2833 B11R1.464 COc1c(cc(cc1F)F)O 271570a_203496583355_100009813607 [0,1,0,0,0,0|3,0,0]=4 2834 B11R1.464 COc1c(cc(cc1F)N)O 271570a_203496583355_200009816006 [0,1,0,0,0,0|3,0,0]=4 2835 B11R1.464 COc1c(cc(cc1I)C)F 34a_200135191068_200000210301 [0,1,0,0,0,0|3,0,0]=4 2836 B11R1.464 COc1c(cc(cc1I)C)F 7a_200135191068_200000210301 [0,1,0,0,0,0|3,0,0]=4 2837 B11R1.464 COc1c(cc(cc1N)C)C 34a_100011216242_200000210301 [0,1,0,0,0,0|3,0,0]=4 2838 B11R1.464 COc1c(cc(cc1N)C)C 7a_100011216242_200000210301 [0,1,0,0,0,0|3,0,0]=4 2839 B11R1.464 COc1c(cc(cc1O)Br)N 271570a_203496583355_100015658936 [0,1,0,0,0,0|3,0,0]=4 2840 B11R1.464 COc1c(cc(cc1O)F)N 271570a_203496583355_100011190657 [0,1,0,0,0,0|3,0,0]=4 2841 B11R1.464 COc1c(cc(cc1O)N)C 271570a_203496583355_100010071304 [0,1,0,0,0,0|3,0,0]=4 2842 B11R1.464 CSc1c(cc(cc1Br)C)Br 62a_200000210301_200011219743 [0,1,0,0,0,0|3,0,0]=4 2843 B11R1.464 CSc1c(cc(cc1Br)C)Br 62a_200011219743_200000210301 [0,1,0,0,0,0|3,0,0]=4 2844 B11R1.464 CSc1c(cc(cc1Br)C)C 62a_200000210301_200012353697 [0,1,0,0,0,0|3,0,0]=4 2845 B11R1.464 CSc1c(cc(cc1Br)C)C 62a_200012353697_200000210301 [0,1,0,0,0,0|3,0,0]=4 2846 B11R1.464 CSc1c(cc(cc1Br)C)F 62a_100010208195_200000210301 [0,1,0,0,0,0|3,0,0]=4 2847 B11R1.464 CSc1c(cc(cc1Br)C)F 62a_200000210301_100010208195 [0,1,0,0,0,0|3,0,0]=4 2848 B11R1.464 CSc1c(cc(cc1C)C)C 62a_100011204320_200000210301 [0,1,0,0,0,0|3,0,0]=4 2849 B11R1.464 CSc1c(cc(cc1C)C)C 62a_200000210301_100011204320 [0,1,0,0,0,0|3,0,0]=4 2850 B11R1.464 CSc1c(cc(cc1F)C)F 62a_100015306127_200000210301 [0,1,0,0,0,0|3,0,0]=4 2851 B11R1.464 CSc1c(cc(cc1F)C)F 62a_200000210301_100015306127 [0,1,0,0,0,0|3,0,0]=4 2852 B11R1.464 CSc1c(cc(cc1F)C)N 62a_100021129147_200000210301 [0,1,0,0,0,0|3,0,0]=4 2853 B11R1.464 CSc1c(cc(cc1F)C)N 62a_200000210301_100021129147 [0,1,0,0,0,0|3,0,0]=4 2854 B11R1.464 CSc1c(cc(cc1F)C)O 271570a_203496583355_202125771776 [0,1,0,0,0,0|2,0,0]=3 2855 B11R1.464 CSc1c(cc(cc1F)F)O 62a_100009815984_200000210301 [0,1,0,0,0,0|3,0,0]=4 2856 B11R1.464 CSc1c(cc(cc1F)F)O 62a_200000210301_100009815984 [0,1,0,0,0,0|3,0,0]=4 2857 B11R1.464 CSc1c(cc(cc1O)C)C 62a_100010342985_200000210301 [0,1,0,0,0,0|2,0,0]=3 2858 B11R1.464 CSc1c(cc(cc1O)C)C 62a_200000210301_100010342985 [0,1,0,0,0,0|2,0,0]=3 2859 B11R1.464 CSc1c(cc(cc1O)Cl)C 62a_100010254216_200000210301 [0,1,0,0,0,0|3,0,0]=4 2860 B11R1.464 CSc1c(cc(cc1O)Cl)C 62a_200000210301_100010254216 [0,1,0,0,0,0|3,0,0]=4 2861 B11R1.464 CSc1c(cc(cc1O)O)O 62a_200000210301_200010341185 [0,1,0,0,0,0|3,0,0]=4 2862 B11R1.464 Cc1cc(c(c(c1)Br)N[13CH3])Br 34a_100000184052_200025704644 [0,1,0,0,0,0|3,0,0]=4 2863 B11R1.464 Cc1cc(c(c(c1)Br)N[13CH3])C 34a_100000688863_200025704644 [0,1,0,0,0,0|3,0,0]=4 2864 B11R1.464 Cc1cc(c(c(c1)Br)N[13CH3])Cl 34a_100012339639_200025704644 [0,1,0,0,0,0|3,0,0]=4 2865 B11R1.464 Cc1cc(c(c(c1)Br)N[13CH3])F 34a_100012353694_200025704644 [0,1,0,0,0,0|3,0,0]=4 2866 B11R1.464 Cc1cc(c(c(c1)Br)O[13CH3])Br 34a_100000203795_200025704644 [0,1,0,0,0,0|3,0,0]=4 2867 B11R1.464 Cc1cc(c(c(c1)Br)O[13CH3])Br 7a_100000203795_200025704644 [0,1,0,0,0,0|3,0,0]=4 2868 B11R1.464 Cc1cc(c(c(c1)Br)O[13CH3])C 34a_100011934984_200025704644 [0,1,0,0,0,0|3,0,0]=4 2869 B11R1.464 Cc1cc(c(c(c1)Br)O[13CH3])C 7a_100011934984_200025704644 [0,1,0,0,0,0|3,0,0]=4 2870 B11R1.464 Cc1cc(c(c(c1)Br)O[13CH3])F 34a_200010713133_200025704644 [0,1,0,0,0,0|3,0,0]=4 2871 B11R1.464 Cc1cc(c(c(c1)Br)O[13CH3])F 7a_200010713133_200025704644 [0,1,0,0,0,0|3,0,0]=4 2872 B11R1.464 Cc1cc(c(c(c1)Br)S[13CH3])Br 62a_200011219743_200025704644 [0,1,0,0,0,0|3,0,0]=4 2873 B11R1.464 Cc1cc(c(c(c1)Br)S[13CH3])Br 62a_200025704644_200011219743 [0,1,0,0,0,0|3,0,0]=4 2874 B11R1.464 Cc1cc(c(c(c1)Br)S[13CH3])C 62a_200012353697_200025704644 [0,1,0,0,0,0|3,0,0]=4 2875 B11R1.464 Cc1cc(c(c(c1)Br)S[13CH3])C 62a_200025704644_200012353697 [0,1,0,0,0,0|3,0,0]=4 2876 B11R1.464 Cc1cc(c(c(c1)Br)S[13CH3])F 62a_100010208195_200025704644 [0,1,0,0,0,0|3,0,0]=4 2877 B11R1.464 Cc1cc(c(c(c1)Br)S[13CH3])F 62a_200025704644_100010208195 [0,1,0,0,0,0|3,0,0]=4 2878 B11R1.464 Cc1cc(c(c(c1)C)N[13CH3])C 34a_100000210045_200025704644 [0,1,0,0,0,0|3,0,0]=4 2879 B11R1.464 Cc1cc(c(c(c1)C)N[13CH3])C 7a_100000210045_200025704644 [0,1,0,0,0,0|3,0,0]=4 2880 B11R1.464 Cc1cc(c(c(c1)C)O[13CH3])C 34a_100000212074_200025704644 [0,1,0,0,0,0|3,0,0]=4 2881 B11R1.464 Cc1cc(c(c(c1)C)O[13CH3])C 7a_100000212074_200025704644 [0,1,0,0,0,0|3,0,0]=4 2882 B11R1.464 Cc1cc(c(c(c1)C)S[13CH3])C 62a_100011204320_200025704644 [0,1,0,0,0,0|3,0,0]=4 2883 B11R1.464 Cc1cc(c(c(c1)C)S[13CH3])C 62a_200025704644_100011204320 [0,1,0,0,0,0|3,0,0]=4 2884 B11R1.464 Cc1cc(c(c(c1)Cl)N[13CH3])C 34a_100000211461_200025704644 [0,1,0,0,0,0|3,0,0]=4 2885 B11R1.464 Cc1cc(c(c(c1)Cl)N[13CH3])C 7a_100000211461_200025704644 [0,1,0,0,0,0|3,0,0]=4 2886 B11R1.464 Cc1cc(c(c(c1)Cl)N[13CH3])Cl 34a_100011996032_200025704644 [0,1,0,0,0,0|3,0,0]=4 2887 B11R1.464 Cc1cc(c(c(c1)Cl)N[13CH3])O 34a_100015906060_200025704644 [0,1,0,0,0,0|2,0,0]=3 2888 B11R1.464 Cc1cc(c(c(c1)Cl)O[13CH3])Cl 34a_100000034925_200025704644 [0,1,0,0,0,0|3,0,0]=4 2889 B11R1.464 Cc1cc(c(c(c1)Cl)O[13CH3])Cl 7a_100000034925_200025704644 [0,1,0,0,0,0|3,0,0]=4 2890 B11R1.464 Cc1cc(c(c(c1)F)C#N)O 271570a_203496583355_100016215262 [0,1,0,0,0,0|1,0,1]=3 2891 B11R1.464 Cc1cc(c(c(c1)F)C=O)O 271570a_203496583355_100010341274 [0,1,0,0,0,0|0,0,0]=1 2892 B11R1.464 Cc1cc(c(c(c1)F)CO)O 271570a_203496583355_100016175008 [0,1,0,0,0,0|0,0,2]=3 2893 B11R1.464 Cc1cc(c(c(c1)F)S[13CH3])F 62a_100015306127_200025704644 [0,1,0,0,0,0|3,0,0]=4 2894 B11R1.464 Cc1cc(c(c(c1)F)S[13CH3])F 62a_200025704644_100015306127 [0,1,0,0,0,0|3,0,0]=4 2895 B11R1.464 Cc1cc(c(c(c1)F)S[13CH3])N 62a_100021129147_200025704644 [0,1,0,0,0,0|3,0,0]=4 2896 B11R1.464 Cc1cc(c(c(c1)F)S[13CH3])N 62a_200025704644_100021129147 [0,1,0,0,0,0|3,0,0]=4 2897 B11R1.464 Cc1cc(c(c(c1)I)O[13CH3])F 34a_200135191068_200025704644 [0,1,0,0,0,0|3,0,0]=4 2898 B11R1.464 Cc1cc(c(c(c1)I)O[13CH3])F 7a_200135191068_200025704644 [0,1,0,0,0,0|3,0,0]=4 2899 B11R1.464 Cc1cc(c(c(c1)N)O[13CH3])C 34a_100011216242_200025704644 [0,1,0,0,0,0|3,0,0]=4 2900 B11R1.464 Cc1cc(c(c(c1)N)O[13CH3])C 7a_100011216242_200025704644 [0,1,0,0,0,0|3,0,0]=4 2901 B11R1.464 Cc1cc(c(c(c1)O)S[13CH3])C 62a_100010342985_200025704644 [0,1,0,0,0,0|2,0,0]=3 2902 B11R1.464 Cc1cc(c(c(c1)O)S[13CH3])C 62a_200025704644_100010342985 [0,1,0,0,0,0|2,0,0]=3 2903 B11R1.464 Cc1cc(c(c(n1)O)C#N)C 271570a_203496583355_100000188011 [0,1,0,0,0,0|2,0,1]=4 2904 B11R1.464 Cc1cc(cc(c1C#N)O)F 271570a_203496583355_100010186299 [0,1,0,0,0,0|2,0,1]=4 2905 B11R1.464 Cc1cc(cc(c1C=O)C)O 271570a_203496583355_100010238521 [0,1,0,0,0,0|2,0,0]=3 2906 B11R1.464 Cc1cc(cc(c1C=O)O)F 271570a_203496583355_200015781908 [0,1,0,0,0,0|1,0,0]=2 2907 B11R1.464 Cc1cc(cc(c1N[13CH3])O)Br 34a_100010371313_200025704644 [0,1,0,0,0,0|3,0,0]=4 2908 B11R1.464 Cc1cc(cc(c1N[13CH3])O)Br 7a_100010371313_200025704644 [0,1,0,0,0,0|3,0,0]=4 2909 B11R1.464 Cc1cc(cc(c1S[13CH3])O)Cl 62a_100010254216_200025704644 [0,1,0,0,0,0|3,0,0]=4 2910 B11R1.464 Cc1cc(cc(c1S[13CH3])O)Cl 62a_200025704644_100010254216 [0,1,0,0,0,0|3,0,0]=4 2911 B11R1.464 N#Cc1c(cc(cc1F)F)O 271570a_203496583355_200000119181 [0,1,0,0,0,0|2,0,1]=4 2912 B11R1.464 N#Cc1c(cc(cc1F)O)O 271570a_203496583355_200011156622 [0,1,0,0,0,0|2,0,1]=4 2913 B11R1.464 O=Cc1c(cc(cc1Cl)O)Cl 271570a_203496583355_200011001975 [0,1,0,0,0,0|2,0,0]=3 2914 B11R1.464 O=Cc1c(cc(cc1F)F)O 271570a_203496583355_100010009843 [0,1,0,0,0,0|1,0,0]=2 2915 B11R1.464 O=Cc1c(cc(cc1F)O)F 271570a_203496583355_100000036707 [0,1,0,0,0,0|2,0,0]=3 2916 B11R1.464 O=Cc1c(cc(cc1F)O)O 271570a_203496583355_100010762571 [0,1,0,0,0,0|1,0,0]=2 2917 B11R1.464 O=Cc1c(cc(nc1F)F)O 271570a_203496583355_106446549130 [0,1,0,0,0,0|2,0,0]=3 2918 B11R1.464 OCc1c(cc(cc1F)F)O 271570a_203496583355_100015506809 [0,1,0,0,0,0|1,0,2]=4 2919 B11R1.464 [13CH3]Nc1c(cc(cc1F)Br)O 34a_100015475841_200025704644 [0,1,0,0,0,0|3,0,0]=4 2920 B11R1.464 [13CH3]Nc1c(cc(cc1F)Cl)O 34a_100010883250_200025704644 [0,1,0,0,0,0|3,0,0]=4 2921 B11R1.464 [13CH3]Nc1c(cc(cc1F)Cl)O 7a_100010883250_200025704644 [0,1,0,0,0,0|3,0,0]=4 2922 B11R1.464 [13CH3]Nc1c(cc(cc1F)F)O 34a_100011217947_200025704644 [0,1,0,0,0,0|3,0,0]=4 2923 B11R1.464 [13CH3]Nc1c(cc(cc1F)F)O 7a_100011217947_200025704644 [0,1,0,0,0,0|3,0,0]=4 2924 B11R1.464 [13CH3]Sc1c(cc(cc1F)F)O 62a_100009815984_200025704644 [0,1,0,0,0,0|3,0,0]=4 2925 B11R1.464 [13CH3]Sc1c(cc(cc1F)F)O 62a_200025704644_100009815984 [0,1,0,0,0,0|3,0,0]=4 2926 B11R1.464 [13CH3]Sc1c(cc(cc1O)O)O 62a_200025704644_200010341185 [0,1,0,0,0,0|3,0,0]=4 2927 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [0,0,0,1,0,0|3,0,0]=4 2928 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [0,0,0,1,0,0|2,0,1]=4 2929 B11R2.36 Oc1ccc2c(c1)OCO2 271570a_203496583355_100000688060 [0,0,0,1,0,0|3,0,0]=4 2930 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [0,0,0,1,0,0|3,0,0]=4 2931 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [0,0,0,1,0,0|2,0,0]=3 2932 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [0,0,0,1,0,0|2,1,0]=4 2933 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [0,0,0,1,0,0|3,0,0]=4 2934 B11R2.36 Oc1ccc2cnoc2c1 271570a_203496583355_100009817722 [0,0,0,1,0,0|2,0,0]=3 2935 B11R2.36 Oc1ccc2cscc2c1 271570a_203496583355_200010760811 [0,0,0,1,0,0|2,1,0]=4 2936 B11R2.36 Oc1ccc2csnc2c1 271570a_203496583355_100010170880 [0,0,0,1,0,0|2,1,0]=4 2937 B11R2.36 Oc1ccc2ncoc2c1 271570a_203496583355_100009817590 [0,0,0,1,0,0|3,0,0]=4 2938 B9R1.22 C=Cc1cc(sc1C)C 271570a_100011290941_100000688054 [0,0,0,0,1,0|3,0,0]=4 2939 B9R1.22 C=Cc1sc(cc1C)C 271570a_100011290941_100000689295 [0,0,0,0,1,0|3,0,0]=4 2940 B9R1.22 Cc1cc(c(s1)C=O)O 271570a_203496583355_100011361552 [0,0,0,0,1,0|1,0,0]=2 2941 B9R1.22 Cc1cc(sc1C=O)O 271570a_203496583355_100010221198 [0,0,0,0,1,0|3,0,0]=4 2942 B9R1.132 C=Cc1csc(c1C)C 271570a_100011290941_100009820295 [0,0,0,0,1,0|3,0,0]=4 2943 B8R0.8 C=C(C)C(=O)C/C=C/C 1458a_100000185857_100102629194 [1,0,1,0,0,0|1,0,1]=4 2944 B8R0.8 C=C(C)C(=O)CC=CC 1458a_100000185857_100000070051 [1,0,1,0,0,0|1,0,1]=4 2945 B8R1.2 C=Cc1ccccc1 271570a_100011290941_100000210277 [2,0,0,0,0,0|1,0,0]=3 2946 B8R1.2 C=Cc1ccccn1 271570a_100011290941_100011216584 [2,0,0,0,0,0|2,0,0]=4 2947 B8R1.2 C=Cc1cccnc1 271570a_100011290941_100000752921 [2,0,0,0,0,0|2,0,0]=4 2948 B8R1.2 C=Cc1ccncc1 271570a_100011290941_100000035832 [2,0,0,0,0,0|2,0,0]=4 2949 B8R1.2 CNc1ccccc1 34a_100000106764_200000210301 [2,0,0,0,0,0|2,0,0]=4 2950 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [2,0,0,0,0,0|2,0,0]=4 2951 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [2,0,0,0,0,0|2,0,0]=4 2952 B8R1.2 CSc1ccccc1 62a_100000719477_200000210301 [2,0,0,0,0,0|2,0,0]=4 2953 B8R1.2 CSc1ccccc1 62a_200000210301_100000041952 [2,0,0,0,0,0|2,0,0]=4 2954 B8R1.2 [13CH3]Nc1ccccc1 34a_100000106764_200025704644 [2,0,0,0,0,0|2,0,0]=4 2955 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [2,0,0,0,0,0|2,0,0]=4 2956 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [2,0,0,0,0,0|2,0,0]=4 2957 B8R1.2 [13CH3]Sc1ccccc1 62a_100000719477_200025704644 [2,0,0,0,0,0|2,0,0]=4 2958 B8R1.2 [13CH3]Sc1ccccc1 62a_200025704644_100000041952 [2,0,0,0,0,0|2,0,0]=4 2959 B8R1.3 Cc1ccc(cc1)O 271570a_203496583355_100000186775 [2,0,0,0,0,0|0,0,1]=3 2960 B8R1.3 Cc1ccc(cn1)O 271570a_203496583355_100000751577 [2,0,0,0,0,0|1,0,1]=4 2961 B8R1.3 Cc1ccc(nc1)O 271570a_203496583355_100000754016 [2,0,0,0,0,0|1,0,1]=4 2962 B8R1.3 Nc1ccc(cc1)O 271570a_203496583355_100000185761 [2,0,0,0,0,0|1,0,1]=4 2963 B8R1.3 O=c1ccc(c[nH]1)O 271570a_203496583355_100000212171 [2,0,0,0,0,0|2,0,0]=4 2964 B8R1.3 Oc1ccc(cc1)Br 271570a_203496583355_100000752885 [2,0,0,0,0,0|1,0,1]=4 2965 B8R1.3 Oc1ccc(cc1)Cl 271570a_203496583355_100000755918 [2,0,0,0,0,0|1,0,1]=4 2966 B8R1.3 Oc1ccc(cc1)F 271570a_203496583355_100000211213 [2,0,0,0,0,0|1,0,1]=4 2967 B8R1.3 Oc1ccc(cc1)O 271570a_203496583355_100000185759 [2,0,0,0,0,0|1,0,1]=4 2968 B8R1.5 C[n+]1ccccc1O 271570a_203496583355_100000212160 [2,0,0,0,0,0|1,0,1]=4 2969 B8R1.5 Cc1ccccc1O 271570a_203496583355_100000210755 [2,0,0,0,0,0|0,0,1]=3 2970 B8R1.5 Cc1cccnc1O 271570a_203496583355_100000751373 [2,0,0,0,0,0|1,0,1]=4 2971 B8R1.5 Cc1ccncc1O 271570a_203496583355_100000761580 [2,0,0,0,0,0|1,0,1]=4 2972 B8R1.5 Cc1cnccc1O 271570a_203496583355_100015191297 [2,0,0,0,0,0|1,0,1]=4 2973 B8R1.5 Cc1ncccc1O 271570a_203496583355_100000751574 [2,0,0,0,0,0|1,0,1]=4 2974 B8R1.5 Nc1ccccc1O 271570a_203496583355_100000210017 [2,0,0,0,0,0|1,0,0]=3 2975 B8R1.5 Nc1cccnc1O 271570a_203496583355_100000688686 [2,0,0,0,0,0|2,0,0]=4 2976 B8R1.5 Nc1ccncc1O 271570a_203496583355_100000047001 [2,0,0,0,0,0|2,0,0]=4 2977 B8R1.5 Nc1cnccc1O 271570a_203496583355_100009815883 [2,0,0,0,0,0|2,0,0]=4 2978 B8R1.5 Nc1ncccc1O 271570a_203496583355_100000045569 [2,0,0,0,0,0|2,0,0]=4 2979 B8R1.5 O=c1[nH]cccc1O 271570a_203496583355_100000050042 [2,0,0,0,0,0|1,0,0]=3 2980 B8R1.5 O=c1[nH]ccnc1O 271570a_203496583355_100000763361 [2,0,0,0,0,0|2,0,0]=4 2981 B8R1.5 O=c1[nH]nccc1O 271570a_203496583355_100000087129 [2,0,0,0,0,0|2,0,0]=4 2982 B8R1.5 O=c1cc[nH]cc1O 271570a_203496583355_100009998708 [2,0,0,0,0,0|1,0,0]=3 2983 B8R1.5 Oc1c[nH]ccc1=S 271570a_203496583355_200012280681 [2,0,0,0,0,0|1,1,0]=4 2984 B8R1.5 Oc1ccccc1Br 271570a_203496583355_100000695589 [2,0,0,0,0,0|1,0,0]=3 2985 B8R1.5 Oc1ccccc1Cl 271570a_203496583355_100000764095 [2,0,0,0,0,0|1,0,0]=3 2986 B8R1.5 Oc1ccccc1F 271570a_203496583355_100011215700 [2,0,0,0,0,0|1,0,0]=3 2987 B8R1.5 Oc1ccccc1O 271570a_203496583355_100000739446 [2,0,0,0,0,0|0,0,1]=3 2988 B8R1.5 Oc1cccnc1Br 271570a_203496583355_100010202626 [2,0,0,0,0,0|2,0,0]=4 2989 B8R1.5 Oc1cccnc1Cl 271570a_203496583355_100000036424 [2,0,0,0,0,0|2,0,0]=4 2990 B8R1.5 Oc1cccnc1F 271570a_203496583355_100009816115 [2,0,0,0,0,0|2,0,0]=4 2991 B8R1.5 Oc1cccnc1O 271570a_203496583355_100000034122 [2,0,0,0,0,0|1,0,1]=4 2992 B8R1.5 Oc1ccncc1Br 271570a_203496583355_100000726257 [2,0,0,0,0,0|2,0,0]=4 2993 B8R1.5 Oc1ccncc1Cl 271570a_203496583355_100000708259 [2,0,0,0,0,0|2,0,0]=4 2994 B8R1.5 Oc1ccncc1F 271570a_203496583355_100000047030 [2,0,0,0,0,0|2,0,0]=4 2995 B8R1.5 Oc1ccncc1O 271570a_203496583355_100009817591 [2,0,0,0,0,0|1,0,1]=4 2996 B8R1.5 Oc1cnccc1Br 271570a_203496583355_100010138639 [2,0,0,0,0,0|2,0,0]=4 2997 B8R1.5 Oc1cnccc1Cl 271570a_203496583355_100009995489 [2,0,0,0,0,0|2,0,0]=4 2998 B8R1.5 Oc1cnccc1F 271570a_203496583355_100009820683 [2,0,0,0,0,0|2,0,0]=4 2999 B8R1.5 Oc1ncccc1Br 271570a_203496583355_100000696092 [2,0,0,0,0,0|2,0,0]=4 3000 B8R1.5 Oc1ncccc1Cl 271570a_203496583355_100011356963 [2,0,0,0,0,0|2,0,0]=4 3001 B8R1.5 Oc1ncccc1F 271570a_203496583355_100000685392 [2,0,0,0,0,0|2,0,0]=4 3002 B8R1.5 [O-][n+]1ccccc1O 271570a_203496583355_200000042595 [2,0,0,0,0,0|1,0,1]=4 3003 B8R1.4 C[n+]1cccc(c1)O 271570a_203496583355_100009996589 [2,0,0,0,0,0|1,0,0]=3 3004 B8R1.4 Cc1cc(ccn1)O 271570a_203496583355_100000758586 [2,0,0,0,0,0|1,0,0]=3 3005 B8R1.4 Cc1cc(ncn1)O 271570a_203496583355_100000744208 [2,0,0,0,0,0|2,0,0]=4 3006 B8R1.4 Cc1cccc(c1)O 271570a_203496583355_100011215228 [2,0,0,0,0,0|0,0,0]=2 3007 B8R1.4 Cc1cccc(n1)O 271570a_203496583355_100000742759 [2,0,0,0,0,0|1,0,0]=3 3008 B8R1.4 Cc1ccnc(c1)O 271570a_203496583355_100000750283 [2,0,0,0,0,0|1,0,0]=3 3009 B8R1.4 Cc1ccnc(n1)O 271570a_203496583355_100011243806 [2,0,0,0,0,0|2,0,0]=4 3010 B8R1.4 Cc1cncc(c1)O 271570a_203496583355_100000760492 [2,0,0,0,0,0|1,0,0]=3 3011 B8R1.4 Cc1cncc(n1)O 271570a_203496583355_100009842155 [2,0,0,0,0,0|2,0,0]=4 3012 B8R1.4 Cc1cnnc(c1)O 271570a_203496583355_100000070100 [2,0,0,0,0,0|2,0,0]=4 3013 B8R1.4 Cc1nccc(n1)O 271570a_203496583355_100000749937 [2,0,0,0,0,0|2,0,0]=4 3014 B8R1.4 Nc1cc(ccn1)O 271570a_203496583355_100000744379 [2,0,0,0,0,0|2,0,0]=4 3015 B8R1.4 Nc1cccc(c1)O 271570a_203496583355_100000210019 [2,0,0,0,0,0|1,0,0]=3 3016 B8R1.4 Nc1cccc(n1)O 271570a_203496583355_100000740741 [2,0,0,0,0,0|2,0,0]=4 3017 B8R1.4 Nc1ccnc(c1)O 271570a_203496583355_100009814236 [2,0,0,0,0,0|2,0,0]=4 3018 B8R1.4 Nc1cncc(c1)O 271570a_203496583355_100000687067 [2,0,0,0,0,0|2,0,0]=4 3019 B8R1.4 O=c1cc(cc[nH]1)O 271570a_203496583355_100009816521 [2,0,0,0,0,0|2,0,0]=4 3020 B8R1.4 O=c1cccc([nH]1)O 271570a_203496583355_100000761760 [2,0,0,0,0,0|2,0,0]=4 3021 B8R1.4 Oc1cc(ccn1)Cl 271570a_203496583355_100010167805 [2,0,0,0,0,0|2,0,0]=4 3022 B8R1.4 Oc1cc(ccn1)F 271570a_203496583355_100009817058 [2,0,0,0,0,0|2,0,0]=4 3023 B8R1.4 Oc1cccc(c1)Br 271570a_203496583355_100000691529 [2,0,0,0,0,0|1,0,0]=3 3024 B8R1.4 Oc1cccc(c1)Cl 271570a_203496583355_100000699651 [2,0,0,0,0,0|1,0,0]=3 3025 B8R1.4 Oc1cccc(c1)F 271570a_203496583355_100000685547 [2,0,0,0,0,0|1,0,0]=3 3026 B8R1.4 Oc1cccc(c1)O 271570a_203496583355_100000211634 [2,0,0,0,0,0|1,0,0]=3 3027 B8R1.4 Oc1cccc(c1)[S] 271570a_203496583355_114929384022 [2,0,0,0,0,0|1,0,0]=3 3028 B8R1.4 Oc1cccc(n1)Br 271570a_203496583355_100000684672 [2,0,0,0,0,0|2,0,0]=4 3029 B8R1.4 Oc1cccc(n1)F 271570a_203496583355_100009815982 [2,0,0,0,0,0|2,0,0]=4 3030 B8R1.4 Oc1ccnc(c1)Br 271570a_203496583355_100009814637 [2,0,0,0,0,0|2,0,0]=4 3031 B8R1.4 Oc1ccnc(c1)Cl 271570a_203496583355_100000035001 [2,0,0,0,0,0|2,0,0]=4 3032 B8R1.4 Oc1ccnc(c1)F 271570a_203496583355_100009816116 [2,0,0,0,0,0|2,0,0]=4 3033 B8R1.4 Oc1ccnc(c1)O 271570a_203496583355_100000762945 [2,0,0,0,0,0|2,0,0]=4 3034 B8R1.4 Oc1cncc(c1)Br 271570a_203496583355_100000728054 [2,0,0,0,0,0|2,0,0]=4 3035 B8R1.4 Oc1cncc(c1)Cl 271570a_203496583355_100000049639 [2,0,0,0,0,0|2,0,0]=4 3036 B8R1.4 Oc1cncc(c1)F 271570a_203496583355_100000744099 [2,0,0,0,0,0|2,0,0]=4 3037 B8R1.4 Oc1cncc(c1)O 271570a_203496583355_100000754920 [2,0,0,0,0,0|2,0,0]=4 3038 B8R1.4 [O-][n+]1cccc(c1)O 271570a_203496583355_100009815978 [2,0,0,0,0,0|2,0,0]=4 3039 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,1,0,0,0,0|2,0,0]=4 3040 B10R1.1 C=C=Cc1ccc(cc1)Br 271570a_100015277604_100000752885 [1,1,0,0,0,0|2,0,0]=4 3041 B10R1.1 C=C=Cc1ccc(cc1)C 271570a_100015277604_100000186775 [1,1,0,0,0,0|1,0,0]=3 3042 B10R1.1 C=C=Cc1ccc(cc1)Cl 271570a_100015277604_100000755918 [1,1,0,0,0,0|2,0,0]=4 3043 B10R1.1 C=C=Cc1ccc(cc1)F 271570a_100015277604_100000211213 [1,1,0,0,0,0|2,0,0]=4 3044 B10R1.1 C=C=Cc1ccc(cc1)N 271570a_100015277604_100000185761 [1,1,0,0,0,0|2,0,0]=4 3045 B10R1.1 C=C=Cc1ccc(cc1)O 271570a_100015277604_100000185759 [1,1,0,0,0,0|2,0,0]=4 3046 B10R1.1 C=C=Cc1ccc(cn1)C 271570a_100015277604_100000754016 [1,1,0,0,0,0|2,0,0]=4 3047 B10R1.1 C=C=Cc1ccc(nc1)C 271570a_100015277604_100000751577 [1,1,0,0,0,0|2,0,0]=4 3048 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [1,1,0,0,0,0|2,0,0]=4 3049 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [1,1,0,0,0,0|1,0,0]=3 3050 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [1,1,0,0,0,0|2,0,0]=4 3051 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [1,1,0,0,0,0|2,0,0]=4 3052 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [1,1,0,0,0,0|2,0,0]=4 3053 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,1,0,0,0,0|2,0,0]=4 3054 B10R1.1 CC=Cc1ccc(cn1)C 271570a_100016259895_100000754016 [1,1,0,0,0,0|2,0,0]=4 3055 B10R1.1 CC=Cc1ccc(nc1)C 271570a_100016259895_100000751577 [1,1,0,0,0,0|2,0,0]=4 3056 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [1,1,0,0,0,0|1,0,1]=4 3057 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [1,1,0,0,0,0|1,0,1]=4 3058 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [1,1,0,0,0,0|1,0,1]=4 3059 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [1,1,0,0,0,0|1,0,1]=4 3060 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [1,1,0,0,0,0|1,0,1]=4 3061 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [1,1,0,0,0,0|1,0,1]=4 3062 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [1,1,0,0,0,0|1,0,1]=4 3063 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [1,1,0,0,0,0|1,0,1]=4 3064 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [1,1,0,0,0,0|1,0,1]=4 3065 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [1,1,0,0,0,0|1,0,1]=4 3066 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [1,1,0,0,0,0|1,0,1]=4 3067 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [1,1,0,0,0,0|1,0,1]=4 3068 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [1,1,0,0,0,0|1,0,1]=4 3069 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [1,1,0,0,0,0|0,0,2]=4 3070 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [1,1,0,0,0,0|0,0,2]=4 3071 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [1,1,0,0,0,0|0,0,2]=4 3072 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [1,1,0,0,0,0|0,1,1]=4 3073 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [1,1,0,0,0,0|0,1,1]=4 3074 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [1,1,0,0,0,0|1,0,1]=4 3075 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [1,1,0,0,0,0|1,0,1]=4 3076 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [1,1,0,0,0,0|0,0,2]=4 3077 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [1,1,0,0,0,0|0,0,2]=4 3078 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [1,1,0,0,0,0|0,1,1]=4 3079 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [1,1,0,0,0,0|0,1,1]=4 3080 B10R1.1 Cc1ccc(cc1)NCF 34a_100000124888_100015361967 [1,1,0,0,0,0|1,0,1]=4 3081 B10R1.1 Cc1ccc(cc1)OCF 34a_100000210336_100015361967 [1,1,0,0,0,0|1,0,1]=4 3082 B10R1.1 Cc1ccc(cc1)OCF 7a_100000210336_100015361967 [1,1,0,0,0,0|1,0,1]=4 3083 B10R1.1 Cc1ccc(cc1)SCF 62a_100000186775_100015361967 [1,1,0,0,0,0|1,0,1]=4 3084 B10R1.1 Cc1ccc(cc1)SCF 62a_100015361967_100000186775 [1,1,0,0,0,0|1,0,1]=4 3085 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [1,1,0,0,0,0|1,0,0]=3 3086 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [1,1,0,0,0,0|2,0,0]=4 3087 B10R1.3 C#Cc1ccc(cc1)NC 34a_100011215031_200000210301 [1,1,0,0,0,0|1,0,1]=4 3088 B10R1.3 C#Cc1ccc(cc1)N[13CH3] 34a_100011215031_200025704644 [1,1,0,0,0,0|1,0,1]=4 3089 B10R1.3 C=Cc1ccc(cc1)C#N 271570a_100011290941_100000179745 [1,1,0,0,0,0|1,0,1]=4 3090 B10R1.3 C=Cc1ccc(cc1)C=O 271570a_100011290941_100000186029 [1,1,0,0,0,0|0,0,1]=3 3091 B10R1.3 C=Cc1ccc(cc1)CC 271570a_100011290941_100011215824 [1,1,0,0,0,0|1,0,0]=3 3092 B10R1.3 C=Cc1ccc(cc1)CF 271570a_100011290941_100010268989 [1,1,0,0,0,0|1,0,0]=3 3093 B10R1.3 C=Cc1ccc(cc1)CN 271570a_100011290941_100016989417 [1,1,0,0,0,0|1,0,0]=3 3094 B10R1.3 C=Cc1ccc(cc1)CO 271570a_100011290941_100000690907 [1,1,0,0,0,0|1,0,0]=3 3095 B10R1.3 C=Cc1ccc(cc1)NC 271570a_100011290941_100000219623 [1,1,0,0,0,0|1,0,0]=3 3096 B10R1.3 C=Cc1ccc(cc1)NC 34a_100011218248_200000210301 [1,1,0,0,0,0|1,0,0]=3 3097 B10R1.3 C=Cc1ccc(cc1)NN 271570a_100011290941_100016988836 [1,1,0,0,0,0|2,0,0]=4 3098 B10R1.3 C=Cc1ccc(cc1)N[13CH3] 34a_100011218248_200025704644 [1,1,0,0,0,0|1,0,0]=3 3099 B10R1.3 C=Cc1ccc(cc1)OC 271570a_100011290941_100000171711 [1,1,0,0,0,0|1,0,0]=3 3100 B10R1.3 C=Cc1ccc(cc1)OC 34a_100000189437_200000210301 [1,1,0,0,0,0|1,0,0]=3 3101 B10R1.3 C=Cc1ccc(cc1)OC 7a_100000189437_200000210301 [1,1,0,0,0,0|1,0,0]=3 3102 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 34a_100000189437_200025704644 [1,1,0,0,0,0|1,0,0]=3 3103 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 7a_100000189437_200025704644 [1,1,0,0,0,0|1,0,0]=3 3104 B10R1.3 C=Cc1ccc(cc1)SC 271570a_100011290941_100011263217 [1,1,0,0,0,0|1,0,0]=3 3105 B10R1.3 C=Cc1ccc(cc1)SC 62a_100000748128_200000210301 [1,1,0,0,0,0|1,0,0]=3 3106 B10R1.3 C=Cc1ccc(cc1)SC 62a_200000210301_100000748128 [1,1,0,0,0,0|1,0,0]=3 3107 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_100000748128_200025704644 [1,1,0,0,0,0|1,0,0]=3 3108 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000748128 [1,1,0,0,0,0|1,0,0]=3 3109 B10R1.3 C=Cc1ccc(cn1)C=O 271570a_100011290941_100000766901 [1,1,0,0,0,0|1,0,1]=4 3110 B10R1.3 C=Cc1ccc(cn1)CC 271570a_100011290941_100009843584 [1,1,0,0,0,0|2,0,0]=4 3111 B10R1.3 C=Cc1ccc(cn1)CN 271570a_100011290941_100009817727 [1,1,0,0,0,0|2,0,0]=4 3112 B10R1.3 C=Cc1ccc(cn1)CO 271570a_100011290941_100009816760 [1,1,0,0,0,0|2,0,0]=4 3113 B10R1.3 C=Cc1ccc(cn1)NC 271570a_100011290941_100000764248 [1,1,0,0,0,0|2,0,0]=4 3114 B10R1.3 C=Cc1ccc(cn1)OC 271570a_100011290941_100000755202 [1,1,0,0,0,0|2,0,0]=4 3115 B10R1.3 C=Cc1ccc(cn1)SC 271570a_100011290941_100009820866 [1,1,0,0,0,0|2,0,0]=4 3116 B10R1.3 C=Cc1ccc(nc1)C=O 271570a_100011290941_100000754260 [1,1,0,0,0,0|1,0,1]=4 3117 B10R1.3 C=Cc1ccc(nc1)CC 271570a_100011290941_100009820025 [1,1,0,0,0,0|2,0,0]=4 3118 B10R1.3 C=Cc1ccc(nc1)CN 271570a_100011290941_100015188789 [1,1,0,0,0,0|2,0,0]=4 3119 B10R1.3 C=Cc1ccc(nc1)CO 271570a_100011290941_100000754261 [1,1,0,0,0,0|2,0,0]=4 3120 B10R1.3 C=Cc1ccc(nc1)NC 271570a_100011290941_100000741341 [1,1,0,0,0,0|2,0,0]=4 3121 B10R1.3 C=Cc1ccc(nc1)OC 271570a_100011290941_100000047065 [1,1,0,0,0,0|2,0,0]=4 3122 B10R1.3 C=Cc1ccc(nc1)SC 271570a_100011290941_100011408404 [1,1,0,0,0,0|2,0,0]=4 3123 B10R1.3 C=Cc1ccc(nc1)SC 62a_103436540071_200000210301 [1,1,0,0,0,0|2,0,0]=4 3124 B10R1.3 C=Cc1ccc(nc1)SC 62a_200000210301_103436540071 [1,1,0,0,0,0|2,0,0]=4 3125 B10R1.3 C=Cc1ccc(nc1)S[13CH3] 62a_103436540071_200025704644 [1,1,0,0,0,0|2,0,0]=4 3126 B10R1.3 C=Cc1ccc(nc1)S[13CH3] 62a_200025704644_103436540071 [1,1,0,0,0,0|2,0,0]=4 3127 B10R1.3 CCc1ccc(cc1)NC 2230a_100000211069_200000210301 [1,1,0,0,0,0|1,0,1]=4 3128 B10R1.3 CCc1ccc(cc1)NC 34a_100000211069_200000210301 [1,1,0,0,0,0|1,0,1]=4 3129 B10R1.3 CCc1ccc(cc1)N[13CH3] 2230a_100000211069_200025704644 [1,1,0,0,0,0|1,0,1]=4 3130 B10R1.3 CCc1ccc(cc1)N[13CH3] 34a_100000211069_200025704644 [1,1,0,0,0,0|1,0,1]=4 3131 B10R1.3 CCc1ccc(cc1)OC 34a_100000211359_200000210301 [1,1,0,0,0,0|1,0,1]=4 3132 B10R1.3 CCc1ccc(cc1)OC 7a_100000211359_200000210301 [1,1,0,0,0,0|1,0,1]=4 3133 B10R1.3 CCc1ccc(cc1)O[13CH3] 34a_100000211359_200025704644 [1,1,0,0,0,0|1,0,1]=4 3134 B10R1.3 CCc1ccc(cc1)O[13CH3] 7a_100000211359_200025704644 [1,1,0,0,0,0|1,0,1]=4 3135 B10R1.3 CCc1ccc(cc1)SC 62a_100011215824_200000210301 [1,1,0,0,0,0|1,0,1]=4 3136 B10R1.3 CCc1ccc(cc1)SC 62a_200000210301_100011215824 [1,1,0,0,0,0|1,0,1]=4 3137 B10R1.3 CCc1ccc(cc1)S[13CH3] 62a_100011215824_200025704644 [1,1,0,0,0,0|1,0,1]=4 3138 B10R1.3 CCc1ccc(cc1)S[13CH3] 62a_200025704644_100011215824 [1,1,0,0,0,0|1,0,1]=4 3139 B10R1.3 CNc1ccc(cc1)C#N 34a_100000185469_200000210301 [1,1,0,0,0,0|1,0,1]=4 3140 B10R1.3 CNc1ccc(cc1)CO 2230a_100011215238_200000210301 [1,1,0,0,0,0|0,0,2]=4 3141 B10R1.3 CNc1ccc(cc1)CO 34a_100011215238_200000210301 [1,1,0,0,0,0|0,0,2]=4 3142 B10R1.3 CNc1ccc(cc1)OC 34a_100000182112_200000210301 [1,1,0,0,0,0|2,0,0]=4 3143 B10R1.3 CNc1ccc(cc1)OC 34a_100000184247_200000210301 [1,1,0,0,0,0|2,0,0]=4 3144 B10R1.3 CNc1ccc(cc1)O[13CH3] 34a_100000182112_200025704644 [1,1,0,0,0,0|2,0,0]=4 3145 B10R1.3 CNc1ccc(cc1)SC 34a_100000212337_200000210301 [1,1,0,0,0,0|2,0,0]=4 3146 B10R1.3 CNc1ccc(cc1)SC 62a_100000743151_200000210301 [1,1,0,0,0,0|2,0,0]=4 3147 B10R1.3 CNc1ccc(cc1)SC 62a_200000210301_100000743151 [1,1,0,0,0,0|2,0,0]=4 3148 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_100000743151_200025704644 [1,1,0,0,0,0|2,0,0]=4 3149 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_200025704644_100000743151 [1,1,0,0,0,0|2,0,0]=4 3150 B10R1.3 CNc1cnc(cn1)C=O 27a_100102657272_100012001714 [1,1,0,0,0,0|2,0,0]=4 3151 B10R1.3 CNc1ncc(cn1)C=O 27a_100102657272_100000070856 [1,1,0,0,0,0|2,0,0]=4 3152 B10R1.3 COc1ccc(cc1)C#N 34a_100000210344_200000210301 [1,1,0,0,0,0|1,0,1]=4 3153 B10R1.3 COc1ccc(cc1)C#N 7a_100000210344_200000210301 [1,1,0,0,0,0|1,0,1]=4 3154 B10R1.3 COc1ccc(cc1)CN 34a_100000185549_200000210301 [1,1,0,0,0,0|1,0,1]=4 3155 B10R1.3 COc1ccc(cc1)CO 34a_100000211755_200000210301 [1,1,0,0,0,0|0,0,2]=4 3156 B10R1.3 COc1ccc(cc1)N[13CH3] 34a_100000184247_200025704644 [1,1,0,0,0,0|2,0,0]=4 3157 B10R1.3 COc1ccc(cc1)OC 34a_100000210503_200000210301 [1,1,0,0,0,0|2,0,0]=4 3158 B10R1.3 COc1ccc(cc1)O[13CH3] 34a_100000210503_200025704644 [1,1,0,0,0,0|2,0,0]=4 3159 B10R1.3 COc1ccc(cc1)SC 34a_100000211864_200000210301 [1,1,0,0,0,0|2,0,0]=4 3160 B10R1.3 COc1ccc(cc1)SC 62a_200000210301_100000171711 [1,1,0,0,0,0|2,0,0]=4 3161 B10R1.3 COc1ccc(cc1)S[13CH3] 62a_200025704644_100000171711 [1,1,0,0,0,0|2,0,0]=4 3162 B10R1.3 CSc1ccc(cc1)C#N 62a_200000210301_100000184291 [1,1,0,0,0,0|1,0,1]=4 3163 B10R1.3 CSc1ccc(cc1)C=O 62a_100000188517_200000210301 [1,1,0,0,0,0|0,0,0]=2 3164 B10R1.3 CSc1ccc(cc1)C=O 62a_200000210301_100000188517 [1,1,0,0,0,0|0,0,0]=2 3165 B10R1.3 CSc1ccc(cc1)CF 62a_100010268989_200000210301 [1,1,0,0,0,0|1,0,1]=4 3166 B10R1.3 CSc1ccc(cc1)CF 62a_200000210301_100010268989 [1,1,0,0,0,0|1,0,1]=4 3167 B10R1.3 CSc1ccc(cc1)CN 62a_100016989417_200000210301 [1,1,0,0,0,0|1,0,1]=4 3168 B10R1.3 CSc1ccc(cc1)CN 62a_200000210301_100016989417 [1,1,0,0,0,0|1,0,1]=4 3169 B10R1.3 CSc1ccc(cc1)CO 62a_100000690907_200000210301 [1,1,0,0,0,0|0,0,2]=4 3170 B10R1.3 CSc1ccc(cc1)CO 62a_200000210301_100000690907 [1,1,0,0,0,0|0,0,2]=4 3171 B10R1.3 CSc1ccc(cc1)NN 62a_100016988836_200000210301 [1,1,0,0,0,0|2,0,0]=4 3172 B10R1.3 CSc1ccc(cc1)NN 62a_200000210301_100016988836 [1,1,0,0,0,0|2,0,0]=4 3173 B10R1.3 CSc1ccc(cc1)N[13CH3] 34a_100000212337_200025704644 [1,1,0,0,0,0|2,0,0]=4 3174 B10R1.3 CSc1ccc(cc1)O[13CH3] 34a_100000211864_200025704644 [1,1,0,0,0,0|2,0,0]=4 3175 B10R1.3 CSc1ccc(cc1)SC 62a_100011263217_200000210301 [1,1,0,0,0,0|2,0,0]=4 3176 B10R1.3 CSc1ccc(cc1)SC 62a_200000210301_100011263217 [1,1,0,0,0,0|2,0,0]=4 3177 B10R1.3 CSc1ccc(cc1)S[13CH3] 62a_100011263217_200025704644 [1,1,0,0,0,0|2,0,0]=4 3178 B10R1.3 CSc1ccc(cc1)S[13CH3] 62a_200025704644_100011263217 [1,1,0,0,0,0|2,0,0]=4 3179 B10R1.3 CSc1ccc(cn1)C=O 62a_100000766901_200000210301 [1,1,0,0,0,0|1,0,0]=3 3180 B10R1.3 CSc1ccc(cn1)C=O 62a_200000210301_100000766901 [1,1,0,0,0,0|1,0,0]=3 3181 B10R1.3 CSc1ccc(nc1)C=O 62a_100000754260_200000210301 [1,1,0,0,0,0|1,0,0]=3 3182 B10R1.3 CSc1ccc(nc1)C=O 62a_200000210301_100000754260 [1,1,0,0,0,0|1,0,0]=3 3183 B10R1.3 CSc1ccc(nn1)C=O 62a_100000044651_200000210301 [1,1,0,0,0,0|2,0,0]=4 3184 B10R1.3 CSc1ccc(nn1)C=O 62a_200000210301_100000044651 [1,1,0,0,0,0|2,0,0]=4 3185 B10R1.3 CSc1cnc(cn1)C=O 62a_100012001714_200000210301 [1,1,0,0,0,0|2,0,0]=4 3186 B10R1.3 CSc1cnc(cn1)C=O 62a_200000210301_100012001714 [1,1,0,0,0,0|2,0,0]=4 3187 B10R1.3 CSc1ncc(cn1)C=O 62a_100000070856_200000210301 [1,1,0,0,0,0|2,0,0]=4 3188 B10R1.3 CSc1ncc(cn1)C=O 62a_200000210301_100000070856 [1,1,0,0,0,0|2,0,0]=4 3189 B10R1.3 [13CH3]Nc1ccc(cc1)C#N 34a_100000185469_200025704644 [1,1,0,0,0,0|1,0,1]=4 3190 B10R1.3 [13CH3]Nc1ccc(cc1)CO 2230a_100011215238_200025704644 [1,1,0,0,0,0|0,0,2]=4 3191 B10R1.3 [13CH3]Nc1ccc(cc1)CO 34a_100011215238_200025704644 [1,1,0,0,0,0|0,0,2]=4 3192 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 34a_100000210344_200025704644 [1,1,0,0,0,0|1,0,1]=4 3193 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 7a_100000210344_200025704644 [1,1,0,0,0,0|1,0,1]=4 3194 B10R1.3 [13CH3]Oc1ccc(cc1)CN 34a_100000185549_200025704644 [1,1,0,0,0,0|1,0,1]=4 3195 B10R1.3 [13CH3]Oc1ccc(cc1)CO 34a_100000211755_200025704644 [1,1,0,0,0,0|0,0,2]=4 3196 B10R1.3 [13CH3]Sc1ccc(cc1)C#N 62a_200025704644_100000184291 [1,1,0,0,0,0|1,0,1]=4 3197 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_100000188517_200025704644 [1,1,0,0,0,0|0,0,0]=2 3198 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_200025704644_100000188517 [1,1,0,0,0,0|0,0,0]=2 3199 B10R1.3 [13CH3]Sc1ccc(cc1)CF 62a_100010268989_200025704644 [1,1,0,0,0,0|1,0,1]=4 3200 B10R1.3 [13CH3]Sc1ccc(cc1)CF 62a_200025704644_100010268989 [1,1,0,0,0,0|1,0,1]=4 3201 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_100016989417_200025704644 [1,1,0,0,0,0|1,0,1]=4 3202 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_200025704644_100016989417 [1,1,0,0,0,0|1,0,1]=4 3203 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_100000690907_200025704644 [1,1,0,0,0,0|0,0,2]=4 3204 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_200025704644_100000690907 [1,1,0,0,0,0|0,0,2]=4 3205 B10R1.3 [13CH3]Sc1ccc(cc1)NN 62a_100016988836_200025704644 [1,1,0,0,0,0|2,0,0]=4 3206 B10R1.3 [13CH3]Sc1ccc(cc1)NN 62a_200025704644_100016988836 [1,1,0,0,0,0|2,0,0]=4 3207 B10R1.3 [13CH3]Sc1ccc(cn1)C=O 62a_100000766901_200025704644 [1,1,0,0,0,0|1,0,0]=3 3208 B10R1.3 [13CH3]Sc1ccc(cn1)C=O 62a_200025704644_100000766901 [1,1,0,0,0,0|1,0,0]=3 3209 B10R1.3 [13CH3]Sc1ccc(nc1)C=O 62a_100000754260_200025704644 [1,1,0,0,0,0|1,0,0]=3 3210 B10R1.3 [13CH3]Sc1ccc(nc1)C=O 62a_200025704644_100000754260 [1,1,0,0,0,0|1,0,0]=3 3211 B10R1.3 [13CH3]Sc1ccc(nn1)C=O 62a_100000044651_200025704644 [1,1,0,0,0,0|2,0,0]=4 3212 B10R1.3 [13CH3]Sc1ccc(nn1)C=O 62a_200025704644_100000044651 [1,1,0,0,0,0|2,0,0]=4 3213 B10R1.3 [13CH3]Sc1cnc(cn1)C=O 62a_100012001714_200025704644 [1,1,0,0,0,0|2,0,0]=4 3214 B10R1.3 [13CH3]Sc1cnc(cn1)C=O 62a_200025704644_100012001714 [1,1,0,0,0,0|2,0,0]=4 3215 B10R1.3 [13CH3]Sc1ncc(cn1)C=O 62a_100000070856_200025704644 [1,1,0,0,0,0|2,0,0]=4 3216 B10R1.3 [13CH3]Sc1ncc(cn1)C=O 62a_200025704644_100000070856 [1,1,0,0,0,0|2,0,0]=4 3217 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [1,1,0,0,0,0|2,0,0]=4 3218 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [1,1,0,0,0,0|1,0,0]=3 3219 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [1,1,0,0,0,0|2,0,0]=4 3220 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [1,1,0,0,0,0|2,0,0]=4 3221 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [1,1,0,0,0,0|2,0,0]=4 3222 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [1,1,0,0,0,0|2,0,0]=4 3223 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [1,1,0,0,0,0|2,0,0]=4 3224 B10R1.13 C=C(C)c1ccc(cn1)C 271570a_100000694244_100000754016 [1,1,0,0,0,0|2,0,0]=4 3225 B10R1.13 C=C(C)c1ccc(nc1)C 271570a_100000694244_100000751577 [1,1,0,0,0,0|2,0,0]=4 3226 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [1,1,0,0,0,0|1,0,0]=3 3227 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [1,1,0,0,0,0|0,0,0]=2 3228 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [1,1,0,0,0,0|1,0,0]=3 3229 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [1,1,0,0,0,0|1,0,0]=3 3230 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [1,1,0,0,0,0|1,0,0]=3 3231 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [1,1,0,0,0,0|1,0,0]=3 3232 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [1,1,0,0,0,0|1,0,0]=3 3233 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [1,1,0,0,0,0|2,0,0]=4 3234 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [1,1,0,0,0,0|2,0,0]=4 3235 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [1,1,0,0,0,0|2,0,0]=4 3236 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [1,1,0,0,0,0|0,0,0]=2 3237 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 3238 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 3239 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 3240 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 3241 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 3242 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 3243 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [1,1,0,0,0,0|1,0,0]=3 3244 B10R1.13 NC(=O)c1ccc(cn1)O 271570a_203496583355_100011219284 [1,1,0,0,0,0|2,0,0]=4 3245 B10R1.13 NC(=O)c1ccc(nc1)O 271570a_203496583355_100000162237 [1,1,0,0,0,0|2,0,0]=4 3246 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [1,1,0,0,0,0|1,0,0]=3 3247 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [1,1,0,0,0,0|1,0,0]=3 3248 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [1,1,0,0,0,0|1,0,0]=3 3249 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [1,1,0,0,0,0|1,0,0]=3 3250 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [1,1,0,0,0,0|1,0,0]=3 3251 B10R1.176 C=Cc1cc(c(cn1)C)C 271570a_100011290941_100009850809 [1,1,0,0,0,0|2,0,0]=4 3252 B10R1.176 C=Cc1cc(c(cn1)C)F 271570a_100011290941_100009841206 [1,1,0,0,0,0|2,0,0]=4 3253 B10R1.176 C=Cc1cc(c(cn1)C)N 271570a_100011290941_100000690170 [1,1,0,0,0,0|2,0,0]=4 3254 B10R1.176 C=Cc1cc(c(cn1)C)O 271570a_100011290941_100000704368 [1,1,0,0,0,0|2,0,0]=4 3255 B10R1.176 C=Cc1ccc([n+](c1)[O-])C 271570a_100011290941_100000703231 [1,1,0,0,0,0|2,0,0]=4 3256 B10R1.176 C=Cc1ccc(c(c1)Br)Br 271570a_100011290941_100012356285 [1,1,0,0,0,0|2,0,0]=4 3257 B10R1.176 C=Cc1ccc(c(c1)Br)C 271570a_100011290941_100011847877 [1,1,0,0,0,0|1,0,0]=3 3258 B10R1.176 C=Cc1ccc(c(c1)Br)Cl 271570a_100011290941_100012353702 [1,1,0,0,0,0|2,0,0]=4 3259 B10R1.176 C=Cc1ccc(c(c1)Br)F 271570a_100011290941_100012047266 [1,1,0,0,0,0|2,0,0]=4 3260 B10R1.176 C=Cc1ccc(c(c1)Br)N 271570a_100011290941_100000750455 [1,1,0,0,0,0|2,0,0]=4 3261 B10R1.176 C=Cc1ccc(c(c1)Br)O 271570a_100011290941_100012361655 [1,1,0,0,0,0|2,0,0]=4 3262 B10R1.176 C=Cc1ccc(c(c1)C)Br 271570a_100011290941_100009813585 [1,1,0,0,0,0|2,0,0]=4 3263 B10R1.176 C=Cc1ccc(c(c1)C)C 271570a_100011290941_100011215607 [1,1,0,0,0,0|1,0,0]=3 3264 B10R1.176 C=Cc1ccc(c(c1)C)Cl 271570a_100011290941_100000049509 [1,1,0,0,0,0|2,0,0]=4 3265 B10R1.176 C=Cc1ccc(c(c1)C)F 271570a_100011290941_100011218330 [1,1,0,0,0,0|2,0,0]=4 3266 B10R1.176 C=Cc1ccc(c(c1)C)N 271570a_100011290941_100000211769 [1,1,0,0,0,0|2,0,0]=4 3267 B10R1.176 C=Cc1ccc(c(c1)C)O 271570a_100011290941_100000186361 [1,1,0,0,0,0|2,0,0]=4 3268 B10R1.176 C=Cc1ccc(c(c1)Cl)Br 271570a_100011290941_100012047281 [1,1,0,0,0,0|2,0,0]=4 3269 B10R1.176 C=Cc1ccc(c(c1)Cl)C 271570a_100011290941_100011216363 [1,1,0,0,0,0|1,0,0]=3 3270 B10R1.176 C=Cc1ccc(c(c1)Cl)Cl 271570a_100011290941_100011214914 [1,1,0,0,0,0|2,0,0]=4 3271 B10R1.176 C=Cc1ccc(c(c1)Cl)F 271570a_100011290941_100011215976 [1,1,0,0,0,0|2,0,0]=4 3272 B10R1.176 C=Cc1ccc(c(c1)Cl)N 271570a_100011290941_100011218065 [1,1,0,0,0,0|2,0,0]=4 3273 B10R1.176 C=Cc1ccc(c(c1)Cl)O 271570a_100011290941_100012360047 [1,1,0,0,0,0|2,0,0]=4 3274 B10R1.176 C=Cc1ccc(c(c1)F)Br 271570a_100011290941_100000685389 [1,1,0,0,0,0|2,0,0]=4 3275 B10R1.176 C=Cc1ccc(c(c1)F)C 271570a_100011290941_100000720648 [1,1,0,0,0,0|1,0,0]=3 3276 B10R1.176 C=Cc1ccc(c(c1)F)Cl 271570a_100011290941_100011216805 [1,1,0,0,0,0|2,0,0]=4 3277 B10R1.176 C=Cc1ccc(c(c1)F)F 271570a_100011290941_100000750028 [1,1,0,0,0,0|2,0,0]=4 3278 B10R1.176 C=Cc1ccc(c(c1)F)N 271570a_100011290941_100011215594 [1,1,0,0,0,0|2,0,0]=4 3279 B10R1.176 C=Cc1ccc(c(c1)F)O 271570a_100011290941_100000185481 [1,1,0,0,0,0|2,0,0]=4 3280 B10R1.176 C=Cc1ccc(c(c1)N)Br 271570a_100011290941_100000750456 [1,1,0,0,0,0|2,0,0]=4 3281 B10R1.176 C=Cc1ccc(c(c1)N)C 271570a_100011290941_100000761890 [1,1,0,0,0,0|1,0,0]=3 3282 B10R1.176 C=Cc1ccc(c(c1)N)Cl 271570a_100011290941_200000761891 [1,1,0,0,0,0|2,0,0]=4 3283 B10R1.176 C=Cc1ccc(c(c1)N)F 271570a_100011290941_100000740924 [1,1,0,0,0,0|2,0,0]=4 3284 B10R1.176 C=Cc1ccc(c(c1)N)N 271570a_100011290941_100000741789 [1,1,0,0,0,0|2,0,0]=4 3285 B10R1.176 C=Cc1ccc(c(c1)N)O 271570a_100011290941_100000752626 [1,1,0,0,0,0|2,0,0]=4 3286 B10R1.176 C=Cc1ccc(c(c1)O)Br 271570a_100011290941_100012356990 [1,1,0,0,0,0|2,0,0]=4 3287 B10R1.176 C=Cc1ccc(c(c1)O)C 271570a_100011290941_100000766334 [1,1,0,0,0,0|1,0,0]=3 3288 B10R1.176 C=Cc1ccc(c(c1)O)Cl 271570a_100011290941_100011356854 [1,1,0,0,0,0|2,0,0]=4 3289 B10R1.176 C=Cc1ccc(c(c1)O)F 271570a_100011290941_100000686035 [1,1,0,0,0,0|2,0,0]=4 3290 B10R1.176 C=Cc1ccc(c(c1)O)N 271570a_100011290941_100000739049 [1,1,0,0,0,0|2,0,0]=4 3291 B10R1.176 C=Cc1ccc(c(c1)O)O 271570a_100011290941_100009813601 [1,1,0,0,0,0|2,0,0]=4 3292 B10R1.176 C=Cc1ccc(c(n1)C)C 271570a_100011290941_100000103781 [1,1,0,0,0,0|2,0,0]=4 3293 B10R1.176 C=Cc1ccc(c(n1)N)C 271570a_100011290941_100009857032 [1,1,0,0,0,0|2,0,0]=4 3294 B10R1.176 C=Cc1ccn(c(=O)c1)C 271570a_100011290941_100009820031 [1,1,0,0,0,0|2,0,0]=4 3295 B10R1.176 C=Cc1cnc(c(c1)C)C 271570a_100011290941_100000697892 [1,1,0,0,0,0|2,0,0]=4 3296 B10R1.176 C=Cc1cnc(c(c1)F)C 271570a_100011290941_100009845756 [1,1,0,0,0,0|2,0,0]=4 3297 B10R1.176 C=Cc1cnc(c(c1)N)C 271570a_100011290941_100011999542 [1,1,0,0,0,0|2,0,0]=4 3298 B10R1.176 C=Cc1cnc(c(c1)O)C 271570a_100011290941_100009864810 [1,1,0,0,0,0|2,0,0]=4 3299 B10R1.176 CNc1ccc(c(c1)Br)C 2230a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 3300 B10R1.176 CNc1ccc(c(c1)Br)C 34a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 3301 B10R1.176 CNc1ccc(c(c1)Br)C 7a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 3302 B10R1.176 CNc1ccc(c(c1)C)C 2230a_100000724040_200000210301 [1,1,0,0,0,0|2,0,0]=4 3303 B10R1.176 CNc1ccc(c(c1)C)C 34a_100000724040_200000210301 [1,1,0,0,0,0|2,0,0]=4 3304 B10R1.176 CNc1ccc(c(c1)C)C 7a_100000724040_200000210301 [1,1,0,0,0,0|2,0,0]=4 3305 B10R1.176 CNc1ccc(c(c1)Cl)C 2230a_100000188892_200000210301 [1,1,0,0,0,0|2,0,0]=4 3306 B10R1.176 CNc1ccc(c(c1)Cl)C 34a_100000188892_200000210301 [1,1,0,0,0,0|2,0,0]=4 3307 B10R1.176 CNc1ccc(c(c1)Cl)C 7a_100000188892_200000210301 [1,1,0,0,0,0|2,0,0]=4 3308 B10R1.176 CNc1ccc(c(c1)F)C 2230a_100000210958_200000210301 [1,1,0,0,0,0|2,0,0]=4 3309 B10R1.176 CNc1ccc(c(c1)F)C 34a_100000210958_200000210301 [1,1,0,0,0,0|2,0,0]=4 3310 B10R1.176 CNc1ccc(c(c1)F)C 7a_100000210958_200000210301 [1,1,0,0,0,0|2,0,0]=4 3311 B10R1.176 CNc1ccc(c(c1)I)C 34a_100000184131_200000210301 [1,1,0,0,0,0|2,0,0]=4 3312 B10R1.176 CNc1ccc(c(c1)I)C 7a_100000184131_200000210301 [1,1,0,0,0,0|2,0,0]=4 3313 B10R1.176 CNc1ccc(c(c1)O)C 271570a_203496583355_100000707694 [1,1,0,0,0,0|2,0,0]=4 3314 B10R1.176 CNc1ccc(c(c1)O)C 34a_100000759471_200000210301 [1,1,0,0,0,0|2,0,0]=4 3315 B10R1.176 CNc1ccc(c(c1)O)C 7a_100000759471_200000210301 [1,1,0,0,0,0|2,0,0]=4 3316 B10R1.176 COc1ccc(c(c1)Br)C 34a_100011380479_200000210301 [1,1,0,0,0,0|2,0,0]=4 3317 B10R1.176 COc1ccc(c(c1)Br)C 7a_100011380479_200000210301 [1,1,0,0,0,0|2,0,0]=4 3318 B10R1.176 COc1ccc(c(c1)C)C 34a_100000210932_200000210301 [1,1,0,0,0,0|2,0,0]=4 3319 B10R1.176 COc1ccc(c(c1)C)C 7a_100000210932_200000210301 [1,1,0,0,0,0|2,0,0]=4 3320 B10R1.176 COc1ccc(c(c1)Cl)C 34a_100011265682_200000210301 [1,1,0,0,0,0|2,0,0]=4 3321 B10R1.176 COc1ccc(c(c1)Cl)C 7a_100011265682_200000210301 [1,1,0,0,0,0|2,0,0]=4 3322 B10R1.176 COc1ccc(c(c1)F)C 34a_100000722560_200000210301 [1,1,0,0,0,0|2,0,0]=4 3323 B10R1.176 COc1ccc(c(c1)F)C 7a_100000722560_200000210301 [1,1,0,0,0,0|2,0,0]=4 3324 B10R1.176 COc1ccc(c(c1)N)C 34a_100011216113_200000210301 [1,1,0,0,0,0|2,0,0]=4 3325 B10R1.176 COc1ccc(c(c1)N)C 7a_100011216113_200000210301 [1,1,0,0,0,0|2,0,0]=4 3326 B10R1.176 COc1ccc(c(c1)O)C 271570a_203496583355_100012349166 [1,1,0,0,0,0|2,0,0]=4 3327 B10R1.176 CSc1ccc(c(c1)Br)C 62a_100011847877_200000210301 [1,1,0,0,0,0|2,0,0]=4 3328 B10R1.176 CSc1ccc(c(c1)Br)C 62a_200000210301_100011847877 [1,1,0,0,0,0|2,0,0]=4 3329 B10R1.176 CSc1ccc(c(c1)C)C 62a_100011215607_200000210301 [1,1,0,0,0,0|2,0,0]=4 3330 B10R1.176 CSc1ccc(c(c1)C)C 62a_200000210301_100011215607 [1,1,0,0,0,0|2,0,0]=4 3331 B10R1.176 CSc1ccc(c(c1)Cl)C 62a_100011216363_200000210301 [1,1,0,0,0,0|2,0,0]=4 3332 B10R1.176 CSc1ccc(c(c1)Cl)C 62a_200000210301_100011216363 [1,1,0,0,0,0|2,0,0]=4 3333 B10R1.176 CSc1ccc(c(c1)F)C 62a_100000720648_200000210301 [1,1,0,0,0,0|2,0,0]=4 3334 B10R1.176 CSc1ccc(c(c1)F)C 62a_200000210301_100000720648 [1,1,0,0,0,0|2,0,0]=4 3335 B10R1.176 CSc1ccc(c(c1)N)C 62a_100000761890_200000210301 [1,1,0,0,0,0|2,0,0]=4 3336 B10R1.176 CSc1ccc(c(c1)N)C 62a_200000210301_100000761890 [1,1,0,0,0,0|2,0,0]=4 3337 B10R1.176 CSc1ccc(c(c1)O)C 62a_100000685420_200000210301 [1,1,0,0,0,0|2,0,0]=4 3338 B10R1.176 CSc1ccc(c(c1)O)C 62a_200000210301_100000685420 [1,1,0,0,0,0|2,0,0]=4 3339 B10R1.176 Cc1cc(ccc1O)C=O 271570a_203496583355_100000765772 [1,1,0,0,0,0|1,0,0]=3 3340 B10R1.176 Cc1cc(cnc1O)C=O 271570a_203496583355_100000070293 [1,1,0,0,0,0|2,0,0]=4 3341 B10R1.176 Cc1cc(ncc1O)C=O 271570a_203496583355_100009814806 [1,1,0,0,0,0|2,0,0]=4 3342 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 2230a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 3343 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 34a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 3344 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 7a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 3345 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 34a_100011380479_200025704644 [1,1,0,0,0,0|2,0,0]=4 3346 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 7a_100011380479_200025704644 [1,1,0,0,0,0|2,0,0]=4 3347 B10R1.176 Cc1ccc(cc1Br)S[13CH3] 62a_100011847877_200025704644 [1,1,0,0,0,0|2,0,0]=4 3348 B10R1.176 Cc1ccc(cc1Br)S[13CH3] 62a_200025704644_100011847877 [1,1,0,0,0,0|2,0,0]=4 3349 B10R1.176 Cc1ccc(cc1C)N[13CH3] 2230a_100000724040_200025704644 [1,1,0,0,0,0|2,0,0]=4 3350 B10R1.176 Cc1ccc(cc1C)N[13CH3] 34a_100000724040_200025704644 [1,1,0,0,0,0|2,0,0]=4 3351 B10R1.176 Cc1ccc(cc1C)N[13CH3] 7a_100000724040_200025704644 [1,1,0,0,0,0|2,0,0]=4 3352 B10R1.176 Cc1ccc(cc1C)O[13CH3] 34a_100000210932_200025704644 [1,1,0,0,0,0|2,0,0]=4 3353 B10R1.176 Cc1ccc(cc1C)O[13CH3] 7a_100000210932_200025704644 [1,1,0,0,0,0|2,0,0]=4 3354 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_100011215607_200025704644 [1,1,0,0,0,0|2,0,0]=4 3355 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_200025704644_100011215607 [1,1,0,0,0,0|2,0,0]=4 3356 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 2230a_100000188892_200025704644 [1,1,0,0,0,0|2,0,0]=4 3357 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 34a_100000188892_200025704644 [1,1,0,0,0,0|2,0,0]=4 3358 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 7a_100000188892_200025704644 [1,1,0,0,0,0|2,0,0]=4 3359 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 34a_100011265682_200025704644 [1,1,0,0,0,0|2,0,0]=4 3360 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 7a_100011265682_200025704644 [1,1,0,0,0,0|2,0,0]=4 3361 B10R1.176 Cc1ccc(cc1Cl)S[13CH3] 62a_100011216363_200025704644 [1,1,0,0,0,0|2,0,0]=4 3362 B10R1.176 Cc1ccc(cc1Cl)S[13CH3] 62a_200025704644_100011216363 [1,1,0,0,0,0|2,0,0]=4 3363 B10R1.176 Cc1ccc(cc1F)N[13CH3] 2230a_100000210958_200025704644 [1,1,0,0,0,0|2,0,0]=4 3364 B10R1.176 Cc1ccc(cc1F)N[13CH3] 34a_100000210958_200025704644 [1,1,0,0,0,0|2,0,0]=4 3365 B10R1.176 Cc1ccc(cc1F)N[13CH3] 7a_100000210958_200025704644 [1,1,0,0,0,0|2,0,0]=4 3366 B10R1.176 Cc1ccc(cc1F)O[13CH3] 34a_100000722560_200025704644 [1,1,0,0,0,0|2,0,0]=4 3367 B10R1.176 Cc1ccc(cc1F)O[13CH3] 7a_100000722560_200025704644 [1,1,0,0,0,0|2,0,0]=4 3368 B10R1.176 Cc1ccc(cc1F)S[13CH3] 62a_100000720648_200025704644 [1,1,0,0,0,0|2,0,0]=4 3369 B10R1.176 Cc1ccc(cc1F)S[13CH3] 62a_200025704644_100000720648 [1,1,0,0,0,0|2,0,0]=4 3370 B10R1.176 Cc1ccc(cc1I)N[13CH3] 34a_100000184131_200025704644 [1,1,0,0,0,0|2,0,0]=4 3371 B10R1.176 Cc1ccc(cc1I)N[13CH3] 7a_100000184131_200025704644 [1,1,0,0,0,0|2,0,0]=4 3372 B10R1.176 Cc1ccc(cc1N)O[13CH3] 34a_100011216113_200025704644 [1,1,0,0,0,0|2,0,0]=4 3373 B10R1.176 Cc1ccc(cc1N)O[13CH3] 7a_100011216113_200025704644 [1,1,0,0,0,0|2,0,0]=4 3374 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_100000761890_200025704644 [1,1,0,0,0,0|2,0,0]=4 3375 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_200025704644_100000761890 [1,1,0,0,0,0|2,0,0]=4 3376 B10R1.176 Cc1ccc(cc1O)C#N 271570a_203496583355_100000690169 [1,1,0,0,0,0|1,0,1]=4 3377 B10R1.176 Cc1ccc(cc1O)C=O 271570a_203496583355_100000695567 [1,1,0,0,0,0|0,0,0]=2 3378 B10R1.176 Cc1ccc(cc1O)CO 271570a_203496583355_100000050133 [1,1,0,0,0,0|0,0,2]=4 3379 B10R1.176 Cc1ccc(cc1O)NN 271570a_203496583355_100016991967 [1,1,0,0,0,0|2,0,0]=4 3380 B10R1.176 Cc1ccc(cc1O)N[13CH3] 34a_100000759471_200025704644 [1,1,0,0,0,0|2,0,0]=4 3381 B10R1.176 Cc1ccc(cc1O)N[13CH3] 7a_100000759471_200025704644 [1,1,0,0,0,0|2,0,0]=4 3382 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_100000685420_200025704644 [1,1,0,0,0,0|2,0,0]=4 3383 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_200025704644_100000685420 [1,1,0,0,0,0|2,0,0]=4 3384 B10R1.176 Cc1cnc(cc1O)C=O 271570a_203496583355_100010174032 [1,1,0,0,0,0|1,0,0]=3 3385 B10R1.176 Cc1nc(ccc1O)C=O 271570a_203496583355_100010238520 [1,1,0,0,0,0|2,0,0]=4 3386 B10R1.176 Nc1ncc(cc1O)C=O 271570a_203496583355_100010064899 [1,1,0,0,0,0|2,0,0]=4 3387 B10R1.176 O=Cc1ccc(c(c1)F)O 271570a_203496583355_100000686674 [1,1,0,0,0,0|1,0,0]=3 3388 B10R1.176 O=Cc1ccc(c(c1)O)Br 271570a_203496583355_100010146563 [1,1,0,0,0,0|1,0,0]=3 3389 B10R1.176 O=Cc1ccc(c(c1)O)Cl 271570a_203496583355_100010209939 [1,1,0,0,0,0|1,0,0]=3 3390 B10R1.176 O=Cc1ccc(c(c1)O)F 271570a_203496583355_100000211747 [1,1,0,0,0,0|1,0,0]=3 3391 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000041418 [1,1,0,0,0,0|1,0,0]=3 3392 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000184552 [1,1,0,0,0,0|1,0,0]=3 3393 B10R1.176 O=Cc1cnc(c(c1)F)O 271570a_203496583355_100009866847 [1,1,0,0,0,0|2,0,0]=4 3394 B10R1.176 O=Cc1cnc(c(c1)O)O 271570a_203496583355_100010064886 [1,1,0,0,0,0|2,0,0]=4 3395 B10R1.2 C=Cc1cccc(c1Br)O 271570a_100011290941_100010187914 [1,1,0,0,0,0|2,0,0]=4 3396 B10R1.2 C=Cc1cccc(c1C)Br 271570a_100011290941_100012353703 [1,1,0,0,0,0|2,0,0]=4 3397 B10R1.2 C=Cc1cccc(c1C)C 271570a_100011290941_100011214922 [1,1,0,0,0,0|2,0,0]=4 3398 B10R1.2 C=Cc1cccc(c1C)Cl 271570a_100011290941_100000726075 [1,1,0,0,0,0|2,0,0]=4 3399 B10R1.2 C=Cc1cccc(c1C)F 271570a_100011290941_100011216893 [1,1,0,0,0,0|2,0,0]=4 3400 B10R1.2 C=Cc1cccc(c1C)N 271570a_100011290941_100000761887 [1,1,0,0,0,0|2,0,0]=4 3401 B10R1.2 C=Cc1cccc(c1C)O 271570a_100011290941_100012002258 [1,1,0,0,0,0|2,0,0]=4 3402 B10R1.2 C=Cc1cccc(c1Cl)Br 271570a_100011290941_100010142854 [1,1,0,0,0,0|2,0,0]=4 3403 B10R1.2 C=Cc1cccc(c1Cl)C 271570a_100011290941_200012352035 [1,1,0,0,0,0|2,0,0]=4 3404 B10R1.2 C=Cc1cccc(c1Cl)Cl 271570a_100011290941_100011215384 [1,1,0,0,0,0|2,0,0]=4 3405 B10R1.2 C=Cc1cccc(c1Cl)F 271570a_100011290941_200010234923 [1,1,0,0,0,0|2,0,0]=4 3406 B10R1.2 C=Cc1cccc(c1Cl)O 271570a_100011290941_100000049636 [1,1,0,0,0,0|2,0,0]=4 3407 B10R1.2 C=Cc1cccc(c1F)Br 271570a_100011290941_100000702267 [1,1,0,0,0,0|2,0,0]=4 3408 B10R1.2 C=Cc1cccc(c1F)C 271570a_100011290941_100000717567 [1,1,0,0,0,0|2,0,0]=4 3409 B10R1.2 C=Cc1cccc(c1F)Cl 271570a_100011290941_100011217346 [1,1,0,0,0,0|2,0,0]=4 3410 B10R1.2 C=Cc1cccc(c1F)F 271570a_100011290941_100000694657 [1,1,0,0,0,0|2,0,0]=4 3411 B10R1.2 C=Cc1cccc(c1F)N 271570a_100011290941_100011935091 [1,1,0,0,0,0|2,0,0]=4 3412 B10R1.2 C=Cc1cccc(c1F)O 271570a_100011290941_100009817021 [1,1,0,0,0,0|2,0,0]=4 3413 B10R1.2 C=Cc1cccc(c1N)Br 271570a_100011290941_100010146558 [1,1,0,0,0,0|2,0,0]=4 3414 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [1,1,0,0,0,0|2,0,0]=4 3415 B10R1.2 C=Cc1cccc(c1N)Cl 271570a_100011290941_100010190421 [1,1,0,0,0,0|2,0,0]=4 3416 B10R1.2 C=Cc1cccc(c1N)F 271570a_100011290941_100000042321 [1,1,0,0,0,0|2,0,0]=4 3417 B10R1.2 C=Cc1cccc(c1N)N 271570a_100011290941_100015191791 [1,1,0,0,0,0|2,0,0]=4 3418 B10R1.2 C=Cc1cccc(c1N)O 271570a_100011290941_100011934926 [1,1,0,0,0,0|2,0,0]=4 3419 B10R1.2 C=Cc1cccc(c1O)Br 271570a_100011290941_100010084509 [1,1,0,0,0,0|1,0,0]=3 3420 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [1,1,0,0,0,0|1,0,0]=3 3421 B10R1.2 C=Cc1cccc(c1O)Cl 271570a_100011290941_100010202889 [1,1,0,0,0,0|1,0,0]=3 3422 B10R1.2 C=Cc1cccc(c1O)F 271570a_100011290941_100009813666 [1,1,0,0,0,0|1,0,0]=3 3423 B10R1.2 C=Cc1cccc(c1O)N 271570a_100011290941_100011934915 [1,1,0,0,0,0|1,0,0]=3 3424 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [1,1,0,0,0,0|1,0,0]=3 3425 B10R1.2 C=Cc1nccc(c1O)C 271570a_100011290941_100000696282 [1,1,0,0,0,0|2,0,0]=4 3426 B10R1.2 C=Cc1nccc(c1O)F 271570a_100011290941_100009867227 [1,1,0,0,0,0|2,0,0]=4 3427 B10R1.2 CCc1cccc(c1O)C 271570a_203496583355_100000036235 [1,1,0,0,0,0|1,0,1]=4 3428 B10R1.2 CCc1cccc(c1O)O 271570a_203496583355_200010001580 [1,1,0,0,0,0|1,0,1]=4 3429 B10R1.2 CNc1cccc(c1O)Br 34a_100011934915_200000210301 [1,1,0,0,0,0|2,0,0]=4 3430 B10R1.2 CNc1cccc(c1O)C 34a_100000756359_200000210301 [1,1,0,0,0,0|2,0,0]=4 3431 B10R1.2 CNc1cccc(c1O)Cl 34a_100000754742_200000210301 [1,1,0,0,0,0|2,0,0]=4 3432 B10R1.2 CNc1cccc(c1O)F 34a_100011934987_200000210301 [1,1,0,0,0,0|2,0,0]=4 3433 B10R1.2 COc1cccc(c1O)Br 271570a_203496583355_100010131421 [1,1,0,0,0,0|2,0,0]=4 3434 B10R1.2 COc1cccc(c1O)F 271570a_203496583355_100000041735 [1,1,0,0,0,0|2,0,0]=4 3435 B10R1.2 COc1cccc(c1O)N 271570a_203496583355_100000703447 [1,1,0,0,0,0|2,0,0]=4 3436 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100000686866 [1,1,0,0,0,0|2,0,0]=4 3437 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100010202623 [1,1,0,0,0,0|2,0,0]=4 3438 B10R1.2 CSc1cccc(c1O)Br 62a_100010084509_200000210301 [1,1,0,0,0,0|2,0,0]=4 3439 B10R1.2 CSc1cccc(c1O)Br 62a_200000210301_100010084509 [1,1,0,0,0,0|2,0,0]=4 3440 B10R1.2 CSc1cccc(c1O)C 62a_100009817157_200000210301 [1,1,0,0,0,0|2,0,0]=4 3441 B10R1.2 CSc1cccc(c1O)C 62a_200000210301_100009817157 [1,1,0,0,0,0|2,0,0]=4 3442 B10R1.2 CSc1cccc(c1O)Cl 62a_100010202889_200000210301 [1,1,0,0,0,0|2,0,0]=4 3443 B10R1.2 CSc1cccc(c1O)Cl 62a_200000210301_100010202889 [1,1,0,0,0,0|2,0,0]=4 3444 B10R1.2 CSc1cccc(c1O)F 62a_100009813666_200000210301 [1,1,0,0,0,0|2,0,0]=4 3445 B10R1.2 CSc1cccc(c1O)F 62a_200000210301_100009813666 [1,1,0,0,0,0|2,0,0]=4 3446 B10R1.2 CSc1cccc(c1O)N 62a_100011934915_200000210301 [1,1,0,0,0,0|2,0,0]=4 3447 B10R1.2 CSc1cccc(c1O)N 62a_200000210301_100010084371 [1,1,0,0,0,0|2,0,0]=4 3448 B10R1.2 CSc1cccc(c1O)O 62a_200000210301_100009815950 [1,1,0,0,0,0|2,0,0]=4 3449 B10R1.2 Cc1c(cccc1C=O)O 271570a_203496583355_100012179384 [1,1,0,0,0,0|1,0,0]=3 3450 B10R1.2 Cc1c(ccnc1O)C=O 271570a_203496583355_100000096011 [1,1,0,0,0,0|2,0,0]=4 3451 B10R1.2 Cc1c(cncc1C=O)O 271570a_203496583355_100010214934 [1,1,0,0,0,0|2,0,0]=4 3452 B10R1.2 Cc1cccc(c1O)C#N 271570a_203496583355_100011934862 [1,1,0,0,0,0|1,0,1]=4 3453 B10R1.2 Cc1cccc(c1O)CO 271570a_203496583355_100011659289 [1,1,0,0,0,0|0,0,2]=4 3454 B10R1.2 Cc1cccc(c1O)N[13CH3] 34a_100000756359_200025704644 [1,1,0,0,0,0|2,0,0]=4 3455 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_100009817157_200025704644 [1,1,0,0,0,0|2,0,0]=4 3456 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_200025704644_100009817157 [1,1,0,0,0,0|2,0,0]=4 3457 B10R1.2 N#Cc1cccc(c1O)Br 271570a_203496583355_100000703783 [1,1,0,0,0,0|1,0,1]=4 3458 B10R1.2 N#Cc1cccc(c1O)Cl 271570a_203496583355_100010134094 [1,1,0,0,0,0|1,0,1]=4 3459 B10R1.2 N#Cc1cccc(c1O)F 271570a_203496583355_100011219237 [1,1,0,0,0,0|1,0,1]=4 3460 B10R1.2 N#Cc1cccc(c1O)N 271570a_203496583355_100009877206 [1,1,0,0,0,0|1,0,1]=4 3461 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009817103 [1,1,0,0,0,0|1,0,1]=4 3462 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009818990 [1,1,0,0,0,0|1,0,1]=4 3463 B10R1.2 Nc1c(cccc1C=O)O 271570a_203496583355_100010144990 [1,1,0,0,0,0|1,0,0]=3 3464 B10R1.2 O=Cc1cccc(c1F)O 271570a_203496583355_100000766533 [1,1,0,0,0,0|1,0,0]=3 3465 B10R1.2 O=Cc1cccc(c1O)F 271570a_203496583355_100011998484 [1,1,0,0,0,0|0,0,0]=2 3466 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100000737635 [1,1,0,0,0,0|0,0,0]=2 3467 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100009816417 [1,1,0,0,0,0|0,0,0]=2 3468 B10R1.2 O=Cc1ccnc(c1F)O 271570a_203496583355_100010064874 [1,1,0,0,0,0|2,0,0]=4 3469 B10R1.2 O=Cc1ccnc(c1O)F 271570a_203496583355_100009856171 [1,1,0,0,0,0|1,0,0]=3 3470 B10R1.2 O=Cc1nccc(c1F)O 271570a_203496583355_100015713984 [1,1,0,0,0,0|2,0,0]=4 3471 B10R1.2 OCc1cccc(c1O)Br 271570a_203496583355_100010146604 [1,1,0,0,0,0|0,0,2]=4 3472 B10R1.2 OCc1cccc(c1O)F 271570a_203496583355_100000692438 [1,1,0,0,0,0|0,0,2]=4 3473 B10R1.2 [13CH3]Nc1cccc(c1O)Br 34a_100011934915_200025704644 [1,1,0,0,0,0|2,0,0]=4 3474 B10R1.2 [13CH3]Nc1cccc(c1O)Cl 34a_100000754742_200025704644 [1,1,0,0,0,0|2,0,0]=4 3475 B10R1.2 [13CH3]Nc1cccc(c1O)F 34a_100011934987_200025704644 [1,1,0,0,0,0|2,0,0]=4 3476 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_100010084509_200025704644 [1,1,0,0,0,0|2,0,0]=4 3477 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_200025704644_100010084509 [1,1,0,0,0,0|2,0,0]=4 3478 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_100010202889_200025704644 [1,1,0,0,0,0|2,0,0]=4 3479 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_200025704644_100010202889 [1,1,0,0,0,0|2,0,0]=4 3480 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_100009813666_200025704644 [1,1,0,0,0,0|2,0,0]=4 3481 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_200025704644_100009813666 [1,1,0,0,0,0|2,0,0]=4 3482 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_100011934915_200025704644 [1,1,0,0,0,0|2,0,0]=4 3483 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_200025704644_100010084371 [1,1,0,0,0,0|2,0,0]=4 3484 B10R1.2 [13CH3]Sc1cccc(c1O)O 62a_200025704644_100009815950 [1,1,0,0,0,0|2,0,0]=4 3485 B10R1.4 C=C=Cc1ccccc1Br 271570a_100015277604_100000695589 [1,1,0,0,0,0|2,0,0]=4 3486 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [1,1,0,0,0,0|2,0,0]=4 3487 B10R1.4 C=C=Cc1ccccc1Cl 271570a_100015277604_100000764095 [1,1,0,0,0,0|2,0,0]=4 3488 B10R1.4 C=C=Cc1ccccc1F 271570a_100015277604_100011215700 [1,1,0,0,0,0|2,0,0]=4 3489 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [1,1,0,0,0,0|2,0,0]=4 3490 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [1,1,0,0,0,0|1,0,0]=3 3491 B10R1.4 C=C=Cc1ccncc1O 271570a_100015277604_100009817591 [1,1,0,0,0,0|2,0,0]=4 3492 B10R1.4 C=C=Cc1ncccc1O 271570a_100015277604_100000034122 [1,1,0,0,0,0|2,0,0]=4 3493 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [1,1,0,0,0,0|1,0,0]=3 3494 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [1,1,0,0,0,0|2,0,0]=4 3495 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [1,1,0,0,0,0|2,0,0]=4 3496 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [1,1,0,0,0,0|2,0,0]=4 3497 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [1,1,0,0,0,0|2,0,0]=4 3498 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [1,1,0,0,0,0|2,0,0]=4 3499 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [1,1,0,0,0,0|1,0,0]=3 3500 B10R1.4 CC=Cc1ccncc1O 271570a_100016259895_100009817591 [1,1,0,0,0,0|2,0,0]=4 3501 B10R1.4 CC=Cc1ncccc1O 271570a_100016259895_100000034122 [1,1,0,0,0,0|2,0,0]=4 3502 B10R1.4 CCNc1ccccc1O 271570a_203496583355_114873767003 [1,1,0,0,0,0|1,0,1]=4 3503 B10R1.4 CCNc1ccccc1O 34a_100000185747_100000210202 [1,1,0,0,0,0|1,0,1]=4 3504 B10R1.4 CCOc1ccccc1O 271570a_203496583355_100000230754 [1,1,0,0,0,0|1,0,1]=4 3505 B10R1.4 CCSc1ccccc1O 271570a_203496583355_100000230856 [1,1,0,0,0,0|1,0,1]=4 3506 B10R1.4 CCSc1ccccc1O 62a_100000210202_100000739446 [1,1,0,0,0,0|1,0,1]=4 3507 B10R1.4 CCSc1ccccc1O 62a_100000739446_100000210202 [1,1,0,0,0,0|1,0,1]=4 3508 B10R1.4 CNCc1ccccc1O 271570a_203496583355_100000184654 [1,1,0,0,0,0|1,0,1]=4 3509 B10R1.4 CNCc1ccccc1O 34a_100000185550_200000210301 [1,1,0,0,0,0|1,0,1]=4 3510 B10R1.4 COCc1ccccc1O 271570a_203496583355_100011493684 [1,1,0,0,0,0|0,0,2]=4 3511 B10R1.4 CSCc1ccccc1O 271570a_203496583355_100000148299 [1,1,0,0,0,0|0,1,1]=4 3512 B10R1.4 N#CCc1ccccc1O 271570a_203496583355_100000033512 [1,1,0,0,0,0|1,0,1]=4 3513 B10R1.4 NCCc1ccccc1O 271570a_203496583355_100000747383 [1,1,0,0,0,0|1,0,1]=4 3514 B10R1.4 NNCc1ccccc1O 271570a_203496583355_200016993956 [1,1,0,0,0,0|1,0,1]=4 3515 B10R1.4 OCCc1ccccc1O 271570a_203496583355_100000731337 [1,1,0,0,0,0|0,0,2]=4 3516 B10R1.4 Oc1ccccc1NCF 34a_100000185747_100015361967 [1,1,0,0,0,0|1,0,1]=4 3517 B10R1.4 Oc1ccccc1SCF 62a_100000739446_100015361967 [1,1,0,0,0,0|1,0,1]=4 3518 B10R1.4 Oc1ccccc1SCF 62a_100015361967_100000739446 [1,1,0,0,0,0|1,0,1]=4 3519 B10R1.4 [13CH3]NCc1ccccc1O 34a_100000185550_200025704644 [1,1,0,0,0,0|1,0,1]=4 3520 B10R1.4 [N-]=[N+]=Nc1ccccc1O 271570a_203496583355_100000762926 [1,1,0,0,0,0|2,0,0]=4 3521 B10R1.20 C#Cc1ccccc1OC 34a_200011470546_200000210301 [1,1,0,0,0,0|1,0,1]=4 3522 B10R1.20 C#Cc1ccccc1OC 7a_200011470546_200000210301 [1,1,0,0,0,0|1,0,1]=4 3523 B10R1.20 C#Cc1ccccc1O[13CH3] 34a_200011470546_200025704644 [1,1,0,0,0,0|1,0,1]=4 3524 B10R1.20 C#Cc1ccccc1O[13CH3] 7a_200011470546_200025704644 [1,1,0,0,0,0|1,0,1]=4 3525 B10R1.20 C=Cc1ccccc1C#N 271570a_100011290941_100000188569 [1,1,0,0,0,0|2,0,0]=4 3526 B10R1.20 C=Cc1ccccc1C=O 271570a_100011290941_100000211189 [1,1,0,0,0,0|1,0,0]=3 3527 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [1,1,0,0,0,0|2,0,0]=4 3528 B10R1.20 C=Cc1ccccc1CN 271570a_100011290941_100000689332 [1,1,0,0,0,0|2,0,0]=4 3529 B10R1.20 C=Cc1ccccc1CO 271570a_100011290941_100000187465 [1,1,0,0,0,0|1,0,0]=3 3530 B10R1.20 C=Cc1ccccc1NC 271570a_100011290941_100020606079 [1,1,0,0,0,0|2,0,0]=4 3531 B10R1.20 C=Cc1ccccc1NC 34a_100012022501_200000210301 [1,1,0,0,0,0|2,0,0]=4 3532 B10R1.20 C=Cc1ccccc1NN 271570a_100011290941_100000241748 [1,1,0,0,0,0|2,0,0]=4 3533 B10R1.20 C=Cc1ccccc1N[13CH3] 34a_100012022501_200025704644 [1,1,0,0,0,0|2,0,0]=4 3534 B10R1.20 C=Cc1ccccc1OC 271570a_100011290941_100000174000 [1,1,0,0,0,0|1,0,0]=3 3535 B10R1.20 C=Cc1ccccc1SC 271570a_100011290941_100011217816 [1,1,0,0,0,0|1,1,0]=4 3536 B10R1.20 C=Cc1ccccc1SC 62a_100011218376_200000210301 [1,1,0,0,0,0|1,1,0]=4 3537 B10R1.20 C=Cc1ccccc1SC 62a_200000210301_100011218376 [1,1,0,0,0,0|1,1,0]=4 3538 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_100011218376_200025704644 [1,1,0,0,0,0|1,1,0]=4 3539 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_200025704644_100011218376 [1,1,0,0,0,0|1,1,0]=4 3540 B10R1.20 C=Cc1cccnc1C=O 271570a_100011290941_100011934733 [1,1,0,0,0,0|2,0,0]=4 3541 B10R1.20 C=Cc1cccnc1CO 271570a_100011290941_100011996772 [1,1,0,0,0,0|2,0,0]=4 3542 B10R1.20 C=Cc1cccnc1OC 271570a_100011290941_100000047025 [1,1,0,0,0,0|2,0,0]=4 3543 B10R1.20 C=Cc1ccncc1C=O 271570a_100011290941_100000050567 [1,1,0,0,0,0|2,0,0]=4 3544 B10R1.20 C=Cc1ccncc1CO 271570a_100011290941_100000117392 [1,1,0,0,0,0|2,0,0]=4 3545 B10R1.20 C=Cc1ccncc1OC 271570a_100011290941_100016988167 [1,1,0,0,0,0|2,0,0]=4 3546 B10R1.20 C=Cc1cnccc1C=O 271570a_100011290941_100011934409 [1,1,0,0,0,0|2,0,0]=4 3547 B10R1.20 C=Cc1cnccc1CO 271570a_100011290941_100009873359 [1,1,0,0,0,0|2,0,0]=4 3548 B10R1.20 C=Cc1cnccc1OC 271570a_100011290941_100011997281 [1,1,0,0,0,0|2,0,0]=4 3549 B10R1.20 C=Cc1ncccc1C=O 271570a_100011290941_100009816751 [1,1,0,0,0,0|2,0,0]=4 3550 B10R1.20 C=Cc1ncccc1CO 271570a_100011290941_100000748726 [1,1,0,0,0,0|2,0,0]=4 3551 B10R1.20 C=Cc1ncccc1OC 271570a_100011290941_100000690851 [1,1,0,0,0,0|2,0,0]=4 3552 B10R1.20 CCc1ccccc1OC 34a_100000210936_200000210301 [1,1,0,0,0,0|1,0,1]=4 3553 B10R1.20 CCc1ccccc1OC 7a_100000210936_200000210301 [1,1,0,0,0,0|1,0,1]=4 3554 B10R1.20 CCc1ccccc1O[13CH3] 34a_100000210936_200025704644 [1,1,0,0,0,0|1,0,1]=4 3555 B10R1.20 CCc1ccccc1O[13CH3] 7a_100000210936_200025704644 [1,1,0,0,0,0|1,0,1]=4 3556 B10R1.20 CNc1ccccc1CO 34a_100000212039_200000210301 [1,1,0,0,0,0|2,0,0]=4 3557 B10R1.20 CNc1ccccc1OC 34a_100000033821_200000210301 [1,1,0,0,0,0|2,0,0]=4 3558 B10R1.20 CNc1ccccc1OC 34a_100000210025_200000210301 [1,1,0,0,0,0|2,0,0]=4 3559 B10R1.20 CNc1ccccc1O[13CH3] 34a_100000033821_200025704644 [1,1,0,0,0,0|2,0,0]=4 3560 B10R1.20 COc1ccccc1C#N 34a_100000211048_200000210301 [1,1,0,0,0,0|1,0,1]=4 3561 B10R1.20 COc1ccccc1C#N 7a_100000211048_200000210301 [1,1,0,0,0,0|1,0,1]=4 3562 B10R1.20 COc1ccccc1CN 34a_100000185550_200000210301 [1,1,0,0,0,0|1,0,1]=4 3563 B10R1.20 COc1ccccc1CO 34a_100011216872_200000210301 [1,1,0,0,0,0|0,0,2]=4 3564 B10R1.20 COc1ccccc1N[13CH3] 34a_100000210025_200025704644 [1,1,0,0,0,0|2,0,0]=4 3565 B10R1.20 COc1ccccc1OC 34a_100000210385_200000210301 [1,1,0,0,0,0|2,0,0]=4 3566 B10R1.20 COc1ccccc1O[13CH3] 34a_100000210385_200025704644 [1,1,0,0,0,0|2,0,0]=4 3567 B10R1.20 COc1ccccc1SC 34a_100011216402_200000210301 [1,1,0,0,0,0|2,0,0]=4 3568 B10R1.20 COc1ccccc1SC 62a_100000210334_200000210301 [1,1,0,0,0,0|2,0,0]=4 3569 B10R1.20 COc1ccccc1SC 62a_200000210301_100000210334 [1,1,0,0,0,0|2,0,0]=4 3570 B10R1.20 COc1ccccc1S[13CH3] 62a_100000210334_200025704644 [1,1,0,0,0,0|2,0,0]=4 3571 B10R1.20 COc1ccccc1S[13CH3] 62a_200025704644_100000210334 [1,1,0,0,0,0|2,0,0]=4 3572 B10R1.20 CSc1ccccc1C=O 62a_100000210073_200000210301 [1,1,0,0,0,0|0,1,0]=3 3573 B10R1.20 CSc1ccccc1C=O 62a_200000210301_100000210073 [1,1,0,0,0,0|0,1,0]=3 3574 B10R1.20 CSc1ccccc1CO 62a_100000187465_200000210301 [1,1,0,0,0,0|2,0,0]=4 3575 B10R1.20 CSc1ccccc1CO 62a_200000210301_100000187465 [1,1,0,0,0,0|2,0,0]=4 3576 B10R1.20 CSc1ccccc1O[13CH3] 34a_100011216402_200025704644 [1,1,0,0,0,0|2,0,0]=4 3577 B10R1.20 CSc1cccnc1C=O 62a_100011934733_200000210301 [1,1,0,0,0,0|1,1,0]=4 3578 B10R1.20 CSc1cccnc1C=O 62a_200000210301_100011934733 [1,1,0,0,0,0|1,1,0]=4 3579 B10R1.20 CSc1ccncc1C=O 62a_100000050567_200000210301 [1,1,0,0,0,0|1,1,0]=4 3580 B10R1.20 CSc1ccncc1C=O 62a_200000210301_100000050567 [1,1,0,0,0,0|1,1,0]=4 3581 B10R1.20 CSc1cnccc1C=O 62a_100011934409_200000210301 [1,1,0,0,0,0|1,1,0]=4 3582 B10R1.20 CSc1cnccc1C=O 62a_200000210301_100011934409 [1,1,0,0,0,0|1,1,0]=4 3583 B10R1.20 CSc1ncccc1C=O 62a_100009816751_200000210301 [1,1,0,0,0,0|1,1,0]=4 3584 B10R1.20 CSc1ncccc1C=O 62a_200000210301_100009816751 [1,1,0,0,0,0|1,1,0]=4 3585 B10R1.20 [13CH3]Nc1ccccc1CO 34a_100000212039_200025704644 [1,1,0,0,0,0|2,0,0]=4 3586 B10R1.20 [13CH3]Oc1ccccc1C#N 34a_100000211048_200025704644 [1,1,0,0,0,0|1,0,1]=4 3587 B10R1.20 [13CH3]Oc1ccccc1C#N 7a_100000211048_200025704644 [1,1,0,0,0,0|1,0,1]=4 3588 B10R1.20 [13CH3]Oc1ccccc1CN 34a_100000185550_200025704644 [1,1,0,0,0,0|1,0,1]=4 3589 B10R1.20 [13CH3]Oc1ccccc1CO 34a_100011216872_200025704644 [1,1,0,0,0,0|0,0,2]=4 3590 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_100000210073_200025704644 [1,1,0,0,0,0|0,1,0]=3 3591 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_200025704644_100000210073 [1,1,0,0,0,0|0,1,0]=3 3592 B10R1.20 [13CH3]Sc1ccccc1CO 62a_100000187465_200025704644 [1,1,0,0,0,0|2,0,0]=4 3593 B10R1.20 [13CH3]Sc1ccccc1CO 62a_200025704644_100000187465 [1,1,0,0,0,0|2,0,0]=4 3594 B10R1.20 [13CH3]Sc1cccnc1C=O 62a_100011934733_200025704644 [1,1,0,0,0,0|1,1,0]=4 3595 B10R1.20 [13CH3]Sc1cccnc1C=O 62a_200025704644_100011934733 [1,1,0,0,0,0|1,1,0]=4 3596 B10R1.20 [13CH3]Sc1ccncc1C=O 62a_100000050567_200025704644 [1,1,0,0,0,0|1,1,0]=4 3597 B10R1.20 [13CH3]Sc1ccncc1C=O 62a_200025704644_100000050567 [1,1,0,0,0,0|1,1,0]=4 3598 B10R1.20 [13CH3]Sc1cnccc1C=O 62a_100011934409_200025704644 [1,1,0,0,0,0|1,1,0]=4 3599 B10R1.20 [13CH3]Sc1cnccc1C=O 62a_200025704644_100011934409 [1,1,0,0,0,0|1,1,0]=4 3600 B10R1.20 [13CH3]Sc1ncccc1C=O 62a_100009816751_200025704644 [1,1,0,0,0,0|1,1,0]=4 3601 B10R1.20 [13CH3]Sc1ncccc1C=O 62a_200025704644_100009816751 [1,1,0,0,0,0|1,1,0]=4 3602 B10R1.30 C=Cc1cc(ccc1Br)Br 271570a_100011290941_100011483371 [1,1,0,0,0,0|2,0,0]=4 3603 B10R1.30 C=Cc1cc(ccc1Br)C 271570a_100011290941_100012353751 [1,1,0,0,0,0|2,0,0]=4 3604 B10R1.30 C=Cc1cc(ccc1Br)Cl 271570a_100011290941_100012339723 [1,1,0,0,0,0|2,0,0]=4 3605 B10R1.30 C=Cc1cc(ccc1Br)F 271570a_100011290941_100011217576 [1,1,0,0,0,0|2,0,0]=4 3606 B10R1.30 C=Cc1cc(ccc1Br)N 271570a_100011290941_100000750459 [1,1,0,0,0,0|2,0,0]=4 3607 B10R1.30 C=Cc1cc(ccc1Br)O 271570a_100011290941_100012339312 [1,1,0,0,0,0|2,0,0]=4 3608 B10R1.30 C=Cc1cc(ccc1C)Br 271570a_100011290941_100011344865 [1,1,0,0,0,0|2,0,0]=4 3609 B10R1.30 C=Cc1cc(ccc1C)C 271570a_100011290941_100000210833 [1,1,0,0,0,0|2,0,0]=4 3610 B10R1.30 C=Cc1cc(ccc1C)Cl 271570a_100011290941_100011263213 [1,1,0,0,0,0|2,0,0]=4 3611 B10R1.30 C=Cc1cc(ccc1C)F 271570a_100011290941_100011218078 [1,1,0,0,0,0|2,0,0]=4 3612 B10R1.30 C=Cc1cc(ccc1C)N 271570a_100011290941_100000736455 [1,1,0,0,0,0|2,0,0]=4 3613 B10R1.30 C=Cc1cc(ccc1C)O 271570a_100011290941_100011380479 [1,1,0,0,0,0|2,0,0]=4 3614 B10R1.30 C=Cc1cc(ccc1Cl)Br 271570a_100011290941_100011772130 [1,1,0,0,0,0|2,0,0]=4 3615 B10R1.30 C=Cc1cc(ccc1Cl)C 271570a_100011290941_100012356289 [1,1,0,0,0,0|2,0,0]=4 3616 B10R1.30 C=Cc1cc(ccc1Cl)Cl 271570a_100011290941_100000707729 [1,1,0,0,0,0|2,0,0]=4 3617 B10R1.30 C=Cc1cc(ccc1Cl)F 271570a_100011290941_100011217299 [1,1,0,0,0,0|2,0,0]=4 3618 B10R1.30 C=Cc1cc(ccc1Cl)N 271570a_100011290941_100012360549 [1,1,0,0,0,0|2,0,0]=4 3619 B10R1.30 C=Cc1cc(ccc1Cl)O 271570a_100011290941_100000049588 [1,1,0,0,0,0|2,0,0]=4 3620 B10R1.30 C=Cc1cc(ccc1F)Br 271570a_100011290941_100011217312 [1,1,0,0,0,0|2,0,0]=4 3621 B10R1.30 C=Cc1cc(ccc1F)C 271570a_100011290941_100000736223 [1,1,0,0,0,0|2,0,0]=4 3622 B10R1.30 C=Cc1cc(ccc1F)Cl 271570a_100011290941_100011218116 [1,1,0,0,0,0|2,0,0]=4 3623 B10R1.30 C=Cc1cc(ccc1F)F 271570a_100011290941_100000750033 [1,1,0,0,0,0|2,0,0]=4 3624 B10R1.30 C=Cc1cc(ccc1F)N 271570a_100011290941_100000760356 [1,1,0,0,0,0|2,0,0]=4 3625 B10R1.30 C=Cc1cc(ccc1F)O 271570a_100011290941_100000693481 [1,1,0,0,0,0|2,0,0]=4 3626 B10R1.30 C=Cc1cc(ccc1N)Br 271570a_100011290941_100000187925 [1,1,0,0,0,0|2,0,0]=4 3627 B10R1.30 C=Cc1cc(ccc1N)C 271570a_100011290941_100000210942 [1,1,0,0,0,0|2,0,0]=4 3628 B10R1.30 C=Cc1cc(ccc1N)Cl 271570a_100011290941_100000761889 [1,1,0,0,0,0|2,0,0]=4 3629 B10R1.30 C=Cc1cc(ccc1N)F 271570a_100011290941_100000760547 [1,1,0,0,0,0|2,0,0]=4 3630 B10R1.30 C=Cc1cc(ccc1N)N 271570a_100011290941_100011534242 [1,1,0,0,0,0|2,0,0]=4 3631 B10R1.30 C=Cc1cc(ccc1N)O 271570a_100011290941_100012001276 [1,1,0,0,0,0|2,0,0]=4 3632 B10R1.30 C=Cc1cc(ccc1O)Br 271570a_100011290941_100012355227 [1,1,0,0,0,0|1,0,0]=3 3633 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [1,1,0,0,0,0|1,0,0]=3 3634 B10R1.30 C=Cc1cc(ccc1O)Cl 271570a_100011290941_100011356953 [1,1,0,0,0,0|1,0,0]=3 3635 B10R1.30 C=Cc1cc(ccc1O)F 271570a_100011290941_100000211999 [1,1,0,0,0,0|1,0,0]=3 3636 B10R1.30 C=Cc1cc(ccc1O)N 271570a_100011290941_100011534360 [1,1,0,0,0,0|1,0,0]=3 3637 B10R1.30 C=Cc1cc(ccc1O)O 271570a_100011290941_100009813629 [1,1,0,0,0,0|1,0,0]=3 3638 B10R1.30 C=Cc1cc(cnc1O)Br 271570a_100011290941_100010197142 [1,1,0,0,0,0|2,0,0]=4 3639 B10R1.30 C=Cc1cc(cnc1O)C 271570a_100011290941_100000049931 [1,1,0,0,0,0|2,0,0]=4 3640 B10R1.30 C=Cc1cc(cnc1O)Cl 271570a_100011290941_100010188700 [1,1,0,0,0,0|2,0,0]=4 3641 B10R1.30 C=Cc1cc(ncc1O)C 271570a_100011290941_100009843476 [1,1,0,0,0,0|2,0,0]=4 3642 B10R1.30 C=Cc1cc(ncc1O)Cl 271570a_100011290941_100000698892 [1,1,0,0,0,0|2,0,0]=4 3643 B10R1.30 C=Cc1nc(ccc1O)Br 271570a_100011290941_100010253912 [1,1,0,0,0,0|2,0,0]=4 3644 B10R1.30 C=Cc1nc(ccc1O)C 271570a_100011290941_100000702858 [1,1,0,0,0,0|2,0,0]=4 3645 B10R1.30 C=Cc1nc(ccc1O)Cl 271570a_100011290941_100000696390 [1,1,0,0,0,0|2,0,0]=4 3646 B10R1.30 C=Cc1nc(ccc1O)F 271570a_100011290941_100010382442 [1,1,0,0,0,0|2,0,0]=4 3647 B10R1.30 CCc1cc(ccc1O)Br 271570a_203496583355_100011216195 [1,1,0,0,0,0|1,0,1]=4 3648 B10R1.30 CCc1cc(ccc1O)N 271570a_203496583355_100010109747 [1,1,0,0,0,0|1,0,1]=4 3649 B10R1.30 CCc1cc(ccc1O)O 271570a_203496583355_100012338938 [1,1,0,0,0,0|1,0,1]=4 3650 B10R1.30 CNc1cc(ccc1O)Br 34a_100000752626_200000210301 [1,1,0,0,0,0|2,0,0]=4 3651 B10R1.30 CNc1cc(ccc1O)C 34a_100011215204_200000210301 [1,1,0,0,0,0|2,0,0]=4 3652 B10R1.30 CNc1cc(ccc1O)Cl 34a_100000210500_200000210301 [1,1,0,0,0,0|2,0,0]=4 3653 B10R1.30 CNc1cc(ccc1O)F 271570a_203496583355_100020633008 [1,1,0,0,0,0|2,0,0]=4 3654 B10R1.30 CNc1cc(ccc1O)F 34a_100000759472_200000210301 [1,1,0,0,0,0|2,0,0]=4 3655 B10R1.30 COc1cc(ccc1O)Br 271570a_203496583355_100010245111 [1,1,0,0,0,0|2,0,0]=4 3656 B10R1.30 COc1cc(ccc1O)C 271570a_203496583355_100010200004 [1,1,0,0,0,0|2,0,0]=4 3657 B10R1.30 COc1cc(ccc1O)Cl 271570a_203496583355_100000050115 [1,1,0,0,0,0|2,0,0]=4 3658 B10R1.30 COc1cc(ccc1O)F 271570a_203496583355_100000757151 [1,1,0,0,0,0|2,0,0]=4 3659 B10R1.30 COc1cc(ccc1O)N 271570a_203496583355_100000765947 [1,1,0,0,0,0|2,0,0]=4 3660 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100000694246 [1,1,0,0,0,0|2,0,0]=4 3661 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100011827694 [1,1,0,0,0,0|2,0,0]=4 3662 B10R1.30 CSc1cc(ccc1O)Br 62a_100012355227_200000210301 [1,1,0,0,0,0|2,0,0]=4 3663 B10R1.30 CSc1cc(ccc1O)Br 62a_200000210301_100012355227 [1,1,0,0,0,0|2,0,0]=4 3664 B10R1.30 CSc1cc(ccc1O)C 271570a_203496583355_200010709736 [1,1,0,0,0,0|2,0,0]=4 3665 B10R1.30 CSc1cc(ccc1O)C 62a_100000765521_200000210301 [1,1,0,0,0,0|2,0,0]=4 3666 B10R1.30 CSc1cc(ccc1O)C 62a_200000210301_100000765521 [1,1,0,0,0,0|2,0,0]=4 3667 B10R1.30 CSc1cc(ccc1O)Cl 62a_100011356953_200000210301 [1,1,0,0,0,0|2,0,0]=4 3668 B10R1.30 CSc1cc(ccc1O)Cl 62a_200000210301_100011356953 [1,1,0,0,0,0|2,0,0]=4 3669 B10R1.30 CSc1cc(ccc1O)F 62a_100000211999_200000210301 [1,1,0,0,0,0|2,0,0]=4 3670 B10R1.30 CSc1cc(ccc1O)F 62a_200000210301_100000211999 [1,1,0,0,0,0|2,0,0]=4 3671 B10R1.30 CSc1cc(ccc1O)N 62a_100011534360_200000210301 [1,1,0,0,0,0|2,0,0]=4 3672 B10R1.30 CSc1cc(ccc1O)N 62a_200000210301_100011534360 [1,1,0,0,0,0|2,0,0]=4 3673 B10R1.30 CSc1cc(ccc1O)O 62a_200000210301_100009813629 [1,1,0,0,0,0|2,0,0]=4 3674 B10R1.30 Cc1ccc(c(c1)C#N)O 271570a_203496583355_100011935190 [1,1,0,0,0,0|1,0,1]=4 3675 B10R1.30 Cc1ccc(c(c1)C=O)O 271570a_203496583355_100011551863 [1,1,0,0,0,0|0,0,0]=2 3676 B10R1.30 Cc1ccc(c(c1)CO)O 271570a_203496583355_100012361352 [1,1,0,0,0,0|0,0,2]=4 3677 B10R1.30 Cc1ccc(c(c1)N[13CH3])O 34a_100011215204_200025704644 [1,1,0,0,0,0|2,0,0]=4 3678 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_100000765521_200025704644 [1,1,0,0,0,0|2,0,0]=4 3679 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000765521 [1,1,0,0,0,0|2,0,0]=4 3680 B10R1.30 Cc1ccc(c(n1)C=O)O 271570a_203496583355_100010173661 [1,1,0,0,0,0|1,0,0]=3 3681 B10R1.30 Cc1ccc(cc1C=O)O 271570a_203496583355_100011361606 [1,1,0,0,0,0|1,0,0]=3 3682 B10R1.30 Cc1cnc(c(c1)C=O)O 271570a_203496583355_100000050350 [1,1,0,0,0,0|1,0,0]=3 3683 B10R1.30 N#Cc1cc(ccc1O)Br 271570a_203496583355_100011219714 [1,1,0,0,0,0|1,0,1]=4 3684 B10R1.30 N#Cc1cc(ccc1O)Cl 271570a_203496583355_200011356825 [1,1,0,0,0,0|1,0,1]=4 3685 B10R1.30 N#Cc1cc(ccc1O)F 271570a_203496583355_100000747550 [1,1,0,0,0,0|1,0,1]=4 3686 B10R1.30 N#Cc1cc(ccc1O)N 271570a_203496583355_100011934039 [1,1,0,0,0,0|1,0,1]=4 3687 B10R1.30 N#Cc1cc(ccc1O)O 271570a_203496583355_100000687585 [1,1,0,0,0,0|1,0,1]=4 3688 B10R1.30 N#Cc1cc(ccc1O)O 271570a_203496583355_100009818209 [1,1,0,0,0,0|1,0,1]=4 3689 B10R1.30 NCc1cc(ccc1O)F 271570a_203496583355_100000742738 [1,1,0,0,0,0|1,0,1]=4 3690 B10R1.30 NCc1cc(ccc1O)O 271570a_203496583355_100000730032 [1,1,0,0,0,0|1,0,1]=4 3691 B10R1.30 NNc1cc(ccc1O)F 271570a_203496583355_100012362518 [1,1,0,0,0,0|2,0,0]=4 3692 B10R1.30 Nc1ccc(c(c1)CO)O 271570a_203496583355_100012347228 [1,1,0,0,0,0|0,0,2]=4 3693 B10R1.30 Nc1ccc(cc1C=O)O 271570a_203496583355_100011935258 [1,1,0,0,0,0|1,0,0]=3 3694 B10R1.30 Nc1ncc(cc1C=O)O 271570a_203496583355_100009814808 [1,1,0,0,0,0|2,0,0]=4 3695 B10R1.30 O=Cc1cc(ccc1Br)O 271570a_203496583355_100010185652 [1,1,0,0,0,0|1,0,0]=3 3696 B10R1.30 O=Cc1cc(ccc1Cl)O 271570a_203496583355_100010254384 [1,1,0,0,0,0|1,0,0]=3 3697 B10R1.30 O=Cc1cc(ccc1F)O 271570a_203496583355_100000211465 [1,1,0,0,0,0|1,0,0]=3 3698 B10R1.30 O=Cc1cc(ccc1O)Br 271570a_203496583355_100010185651 [1,1,0,0,0,0|0,0,0]=2 3699 B10R1.30 O=Cc1cc(ccc1O)Cl 271570a_203496583355_100010254386 [1,1,0,0,0,0|0,0,0]=2 3700 B10R1.30 O=Cc1cc(ccc1O)F 271570a_203496583355_100011218309 [1,1,0,0,0,0|0,0,0]=2 3701 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000186750 [1,1,0,0,0,0|0,0,0]=2 3702 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000690577 [1,1,0,0,0,0|0,0,0]=2 3703 B10R1.30 O=Cc1cc(cnc1F)O 271570a_203496583355_100009814789 [1,1,0,0,0,0|2,0,0]=4 3704 B10R1.30 O=Cc1cc(cnc1O)F 271570a_203496583355_100000079965 [1,1,0,0,0,0|1,0,0]=3 3705 B10R1.30 O=Cc1cc(ncc1F)O 271570a_203496583355_100000707870 [1,1,0,0,0,0|2,0,0]=4 3706 B10R1.30 O=Cc1nc(ccc1F)O 271570a_203496583355_100009814804 [1,1,0,0,0,0|2,0,0]=4 3707 B10R1.30 OCc1cc(ccc1O)Br 271570a_203496583355_100011356890 [1,1,0,0,0,0|0,0,2]=4 3708 B10R1.30 OCc1cc(ccc1O)F 271570a_203496583355_100011217561 [1,1,0,0,0,0|0,0,2]=4 3709 B10R1.30 OCc1cc(ccc1O)O 271570a_203496583355_100000184703 [1,1,0,0,0,0|0,0,2]=4 3710 B10R1.30 OCc1cc(ccc1O)O 271570a_203496583355_100012351483 [1,1,0,0,0,0|0,0,2]=4 3711 B10R1.30 [13CH3]Nc1cc(ccc1O)Br 34a_100000752626_200025704644 [1,1,0,0,0,0|2,0,0]=4 3712 B10R1.30 [13CH3]Nc1cc(ccc1O)Cl 34a_100000210500_200025704644 [1,1,0,0,0,0|2,0,0]=4 3713 B10R1.30 [13CH3]Nc1cc(ccc1O)F 34a_100000759472_200025704644 [1,1,0,0,0,0|2,0,0]=4 3714 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_100012355227_200025704644 [1,1,0,0,0,0|2,0,0]=4 3715 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_200025704644_100012355227 [1,1,0,0,0,0|2,0,0]=4 3716 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_100011356953_200025704644 [1,1,0,0,0,0|2,0,0]=4 3717 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_200025704644_100011356953 [1,1,0,0,0,0|2,0,0]=4 3718 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_100000211999_200025704644 [1,1,0,0,0,0|2,0,0]=4 3719 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_200025704644_100000211999 [1,1,0,0,0,0|2,0,0]=4 3720 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_100011534360_200025704644 [1,1,0,0,0,0|2,0,0]=4 3721 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_200025704644_100011534360 [1,1,0,0,0,0|2,0,0]=4 3722 B10R1.30 [13CH3]Sc1cc(ccc1O)O 62a_200025704644_100009813629 [1,1,0,0,0,0|2,0,0]=4 3723 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [1,1,0,0,0,0|2,0,0]=4 3724 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [1,1,0,0,0,0|2,0,0]=4 3725 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [1,1,0,0,0,0|2,0,0]=4 3726 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [1,1,0,0,0,0|2,0,0]=4 3727 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [1,1,0,0,0,0|2,0,0]=4 3728 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [1,1,0,0,0,0|1,0,0]=3 3729 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [1,1,0,0,0,0|2,0,0]=4 3730 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [1,1,0,0,0,0|2,0,0]=4 3731 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [1,1,0,0,0,0|1,0,0]=3 3732 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [1,1,0,0,0,0|1,0,0]=3 3733 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [1,1,0,0,0,0|1,0,0]=3 3734 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [1,1,0,0,0,0|1,0,0]=3 3735 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [1,1,0,0,0,0|1,0,0]=3 3736 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [1,1,0,0,0,0|0,0,0]=2 3737 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [1,1,0,0,0,0|0,0,0]=2 3738 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [1,1,0,0,0,0|0,0,1]=3 3739 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [1,1,0,0,0,0|1,0,0]=3 3740 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [1,1,0,0,0,0|1,0,0]=3 3741 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [1,1,0,0,0,0|1,0,0]=3 3742 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [1,1,0,0,0,0|1,0,0]=3 3743 B10R1.61 CC(=O)c1nccnc1O 271570a_203496583355_100000099859 [1,1,0,0,0,0|2,0,0]=4 3744 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [1,1,0,0,0,0|1,0,1]=4 3745 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [1,1,0,0,0,0|1,0,1]=4 3746 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [1,1,0,0,0,0|0,0,2]=4 3747 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [1,1,0,0,0,0|2,0,0]=4 3748 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [1,1,0,0,0,0|2,0,0]=4 3749 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [1,1,0,0,0,0|2,0,0]=4 3750 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [1,1,0,0,0,0|1,0,0]=3 3751 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [1,1,0,0,0,0|1,0,0]=3 3752 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [1,1,0,0,0,0|0,0,0]=2 3753 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [1,1,0,0,0,0|1,0,0]=3 3754 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [1,1,0,0,0,0|1,0,0]=3 3755 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [1,1,0,0,0,0|1,0,0]=3 3756 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [1,1,0,0,0,0|1,0,0]=3 3757 B10R1.61 NC(=O)c1nccnc1O 271570a_203496583355_100000094861 [1,1,0,0,0,0|2,0,0]=4 3758 B10R1.61 OB(O)c1ccccc1O 271570a_203496583355_100000693059 [1,1,0,0,0,0|1,0,1]=4 3759 B10R1.61 Oc1ccccc1C(F)F 271570a_203496583355_100010169824 [1,1,0,0,0,0|1,0,1]=4 3760 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [1,1,0,0,0,0|1,0,0]=3 3761 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [1,1,0,0,0,0|1,0,0]=3 3762 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [1,1,0,0,0,0|1,0,0]=3 3763 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [1,1,0,0,0,0|1,0,0]=3 3764 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [1,1,0,0,0,0|0,0,0]=2 3765 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [1,1,0,0,0,0|0,0,1]=3 3766 B10R1.245 C=Cc1c(cccc1Br)Br 271570a_100011290941_100009994525 [1,1,0,0,0,0|2,0,0]=4 3767 B10R1.245 C=Cc1c(cccc1Br)Cl 271570a_100011290941_100010214488 [1,1,0,0,0,0|2,0,0]=4 3768 B10R1.245 C=Cc1c(cccc1Br)F 271570a_100011290941_100011219512 [1,1,0,0,0,0|2,0,0]=4 3769 B10R1.245 C=Cc1c(cccc1Br)N 271570a_100011290941_100020590159 [1,1,0,0,0,0|2,0,0]=4 3770 B10R1.245 C=Cc1c(cccc1Br)O 271570a_100011290941_100010187912 [1,1,0,0,0,0|1,0,0]=3 3771 B10R1.245 C=Cc1c(cccc1C)C 271570a_100011290941_100000033847 [1,1,0,0,0,0|2,0,0]=4 3772 B10R1.245 C=Cc1c(cccc1Cl)C 271570a_100011290941_100000043165 [1,1,0,0,0,0|2,0,0]=4 3773 B10R1.245 C=Cc1c(cccc1Cl)Cl 271570a_100011290941_100000034237 [1,1,0,0,0,0|2,0,0]=4 3774 B10R1.245 C=Cc1c(cccc1Cl)F 271570a_100011290941_100000050007 [1,1,0,0,0,0|2,0,0]=4 3775 B10R1.245 C=Cc1c(cccc1Cl)N 271570a_100011290941_100000049713 [1,1,0,0,0,0|2,0,0]=4 3776 B10R1.245 C=Cc1c(cccc1Cl)O 271570a_100011290941_100000050174 [1,1,0,0,0,0|1,0,0]=3 3777 B10R1.245 C=Cc1c(cccc1F)C 271570a_100011290941_100012349962 [1,1,0,0,0,0|2,0,0]=4 3778 B10R1.245 C=Cc1c(cccc1F)F 271570a_100011290941_100000693133 [1,1,0,0,0,0|2,0,0]=4 3779 B10R1.245 C=Cc1c(cccc1F)N 271570a_100011290941_100011934729 [1,1,0,0,0,0|2,0,0]=4 3780 B10R1.245 C=Cc1c(cccc1F)O 271570a_100011290941_100009820682 [1,1,0,0,0,0|1,0,0]=3 3781 B10R1.245 C=Cc1c(cccc1N)C 271570a_100011290941_100000684715 [1,1,0,0,0,0|2,0,0]=4 3782 B10R1.245 C=Cc1c(cccc1O)C 271570a_100011290941_100000686692 [1,1,0,0,0,0|1,0,0]=3 3783 B10R1.245 C=Cc1c(cccc1O)N 271570a_100011290941_100012183704 [1,1,0,0,0,0|1,0,0]=3 3784 B10R1.245 C=Cc1c(cccc1O)O 271570a_100011290941_100010205330 [1,1,0,0,0,0|1,0,0]=3 3785 B10R1.245 C=Cc1c(ccnc1O)C 271570a_100011290941_100012000493 [1,1,0,0,0,0|2,0,0]=4 3786 B10R1.245 C=Cc1c(ccnc1O)O 271570a_100011290941_200009817435 [1,1,0,0,0,0|2,0,0]=4 3787 B10R1.245 CNc1c(cccc1Br)O 34a_100011934926_200000210301 [1,1,0,0,0,0|2,0,0]=4 3788 B10R1.245 CNc1c(cccc1Cl)O 34a_100012022510_200000210301 [1,1,0,0,0,0|2,0,0]=4 3789 B10R1.245 CNc1c(cccc1F)O 34a_100020591140_200000210301 [1,1,0,0,0,0|2,0,0]=4 3790 B10R1.245 CNc1c(cccc1O)C 34a_100000743429_200000210301 [1,1,0,0,0,0|2,0,0]=4 3791 B10R1.245 CNc1c(cccc1O)N 271570a_203496583355_100010510394 [1,1,0,0,0,0|2,0,0]=4 3792 B10R1.245 COc1c(cccc1Br)O 271570a_203496583355_100010146560 [1,1,0,0,0,0|2,0,0]=4 3793 B10R1.245 COc1c(cccc1Cl)O 271570a_203496583355_100010147678 [1,1,0,0,0,0|2,0,0]=4 3794 B10R1.245 COc1c(cccc1F)O 271570a_203496583355_100009816759 [1,1,0,0,0,0|2,0,0]=4 3795 B10R1.245 COc1c(cccc1O)C 271570a_203496583355_100010141385 [1,1,0,0,0,0|2,0,0]=4 3796 B10R1.245 COc1c(cccc1O)N 271570a_203496583355_100011935253 [1,1,0,0,0,0|2,0,0]=4 3797 B10R1.245 COc1c(cccc1O)O 271570a_203496583355_100010234590 [1,1,0,0,0,0|2,0,0]=4 3798 B10R1.245 CSc1c(cccc1Br)O 62a_100010187912_200000210301 [1,1,0,0,0,0|2,0,0]=4 3799 B10R1.245 CSc1c(cccc1Br)O 62a_200000210301_100010187912 [1,1,0,0,0,0|2,0,0]=4 3800 B10R1.245 CSc1c(cccc1Cl)O 62a_200000210301_100000050174 [1,1,0,0,0,0|2,0,0]=4 3801 B10R1.245 CSc1c(cccc1F)O 271570a_203496583355_200010709249 [1,1,0,0,0,0|2,0,0]=4 3802 B10R1.245 CSc1c(cccc1F)O 62a_100009820682_200000210301 [1,1,0,0,0,0|2,0,0]=4 3803 B10R1.245 CSc1c(cccc1F)O 62a_200000210301_100009820682 [1,1,0,0,0,0|2,0,0]=4 3804 B10R1.245 CSc1c(cccc1O)C 62a_100000686692_200000210301 [1,1,0,0,0,0|2,0,0]=4 3805 B10R1.245 CSc1c(cccc1O)C 62a_200000210301_100000686692 [1,1,0,0,0,0|2,0,0]=4 3806 B10R1.245 CSc1c(cccc1O)N 62a_100012183704_200000210301 [1,1,0,0,0,0|2,0,0]=4 3807 B10R1.245 CSc1c(cccc1O)N 62a_200000210301_100012183704 [1,1,0,0,0,0|2,0,0]=4 3808 B10R1.245 CSc1c(cccc1O)O 62a_200000210301_100010205330 [1,1,0,0,0,0|2,0,0]=4 3809 B10R1.245 Cc1cccc(c1C#N)O 271570a_203496583355_100009819585 [1,1,0,0,0,0|1,0,1]=4 3810 B10R1.245 Cc1cccc(c1C=O)O 271570a_203496583355_100000041122 [1,1,0,0,0,0|0,0,0]=2 3811 B10R1.245 Cc1cccc(c1N[13CH3])O 34a_100000743429_200025704644 [1,1,0,0,0,0|2,0,0]=4 3812 B10R1.245 Cc1cccc(c1S[13CH3])O 62a_100000686692_200025704644 [1,1,0,0,0,0|2,0,0]=4 3813 B10R1.245 Cc1cccc(c1S[13CH3])O 62a_200025704644_100000686692 [1,1,0,0,0,0|2,0,0]=4 3814 B10R1.245 N#Cc1c(cccc1Br)O 271570a_203496583355_100010071968 [1,1,0,0,0,0|1,0,1]=4 3815 B10R1.245 N#Cc1c(cccc1Cl)O 271570a_203496583355_200000049503 [1,1,0,0,0,0|1,0,1]=4 3816 B10R1.245 N#Cc1c(cccc1F)O 271570a_203496583355_100000699744 [1,1,0,0,0,0|1,0,1]=4 3817 B10R1.245 N#Cc1c(cccc1O)N 271570a_203496583355_100011935054 [1,1,0,0,0,0|1,0,1]=4 3818 B10R1.245 N#Cc1c(cccc1O)O 271570a_203496583355_100012180507 [1,1,0,0,0,0|1,0,1]=4 3819 B10R1.245 NCc1c(cccc1F)O 271570a_203496583355_100012349121 [1,1,0,0,0,0|1,0,1]=4 3820 B10R1.245 NNc1c(cccc1F)O 271570a_203496583355_100016994982 [1,1,0,0,0,0|2,0,0]=4 3821 B10R1.245 Nc1cccc(c1C=O)O 271570a_203496583355_100010232536 [1,1,0,0,0,0|0,0,0]=2 3822 B10R1.245 Nc1cccc(c1CO)O 271570a_203496583355_100000747656 [1,1,0,0,0,0|0,0,2]=4 3823 B10R1.245 Nc1nccc(c1C=O)O 271570a_203496583355_100009843235 [1,1,0,0,0,0|1,0,0]=3 3824 B10R1.245 Nc1ncnc(c1C=O)O 271570a_203496583355_100000765549 [1,1,0,0,0,0|2,0,0]=4 3825 B10R1.245 O=Cc1c(cccc1Cl)O 271570a_203496583355_100010147682 [1,1,0,0,0,0|0,0,0]=2 3826 B10R1.245 O=Cc1c(cccc1F)O 271570a_203496583355_100000210083 [1,1,0,0,0,0|0,0,0]=2 3827 B10R1.245 O=Cc1c(cccc1O)O 271570a_203496583355_100009814793 [1,1,0,0,0,0|0,0,0]=2 3828 B10R1.245 O=Cc1c(ccnc1Cl)O 271570a_203496583355_100000047006 [1,1,0,0,0,0|1,0,0]=3 3829 B10R1.245 O=Cc1c(ccnc1F)O 271570a_203496583355_100009828249 [1,1,0,0,0,0|1,0,0]=3 3830 B10R1.245 O=Cc1c(ccnc1O)O 271570a_203496583355_200010729673 [1,1,0,0,0,0|1,0,0]=3 3831 B10R1.245 O=Cc1c(cncc1F)O 271570a_203496583355_100010064882 [1,1,0,0,0,0|1,0,0]=3 3832 B10R1.245 OCc1c(cccc1F)O 271570a_203496583355_100012355691 [1,1,0,0,0,0|0,0,2]=4 3833 B10R1.245 [13CH3]Nc1c(cccc1Br)O 34a_100011934926_200025704644 [1,1,0,0,0,0|2,0,0]=4 3834 B10R1.245 [13CH3]Nc1c(cccc1Cl)O 34a_100012022510_200025704644 [1,1,0,0,0,0|2,0,0]=4 3835 B10R1.245 [13CH3]Nc1c(cccc1F)O 34a_100020591140_200025704644 [1,1,0,0,0,0|2,0,0]=4 3836 B10R1.245 [13CH3]Sc1c(cccc1Br)O 62a_100010187912_200025704644 [1,1,0,0,0,0|2,0,0]=4 3837 B10R1.245 [13CH3]Sc1c(cccc1Br)O 62a_200025704644_100010187912 [1,1,0,0,0,0|2,0,0]=4 3838 B10R1.245 [13CH3]Sc1c(cccc1Cl)O 62a_200025704644_100000050174 [1,1,0,0,0,0|2,0,0]=4 3839 B10R1.245 [13CH3]Sc1c(cccc1F)O 62a_100009820682_200025704644 [1,1,0,0,0,0|2,0,0]=4 3840 B10R1.245 [13CH3]Sc1c(cccc1F)O 62a_200025704644_100009820682 [1,1,0,0,0,0|2,0,0]=4 3841 B10R1.245 [13CH3]Sc1c(cccc1O)N 62a_100012183704_200025704644 [1,1,0,0,0,0|2,0,0]=4 3842 B10R1.245 [13CH3]Sc1c(cccc1O)N 62a_200025704644_100012183704 [1,1,0,0,0,0|2,0,0]=4 3843 B10R1.245 [13CH3]Sc1c(cccc1O)O 62a_200025704644_100010205330 [1,1,0,0,0,0|2,0,0]=4 3844 B10R1.22 Cc1c(cc(cc1F)F)O 271570a_203496583355_100015579730 [1,1,0,0,0,0|1,0,1]=4 3845 B10R1.22 Cc1c(cc(cc1F)N)O 271570a_203496583355_100010254531 [1,1,0,0,0,0|1,0,1]=4 3846 B10R1.22 Cc1c(cc(cc1O)Cl)N 271570a_203496583355_200000050010 [1,1,0,0,0,0|1,0,1]=4 3847 B10R1.22 Cc1c(cc(cc1O)F)N 271570a_203496583355_100009814351 [1,1,0,0,0,0|1,0,1]=4 3848 B10R1.22 Cc1cc(c(=O)n(c1)C)O 271570a_203496583355_100011068373 [1,1,0,0,0,0|1,0,0]=3 3849 B10R1.22 Cc1cc(c(c(c1)Br)O)Br 271570a_203496583355_200011219743 [1,1,0,0,0,0|1,0,1]=4 3850 B10R1.22 Cc1cc(c(c(c1)Br)O)C 271570a_203496583355_200012353697 [1,1,0,0,0,0|1,0,1]=4 3851 B10R1.22 Cc1cc(c(c(c1)Br)O)F 271570a_203496583355_100010208195 [1,1,0,0,0,0|1,0,1]=4 3852 B10R1.22 Cc1cc(c(c(c1)C)O)C 271570a_203496583355_100011204320 [1,1,0,0,0,0|1,0,1]=4 3853 B10R1.22 Cc1cc(c(c(c1)F)C)O 271570a_203496583355_100015473476 [1,1,0,0,0,0|0,0,1]=3 3854 B10R1.22 Cc1cc(c(c(c1)F)F)O 271570a_203496583355_100010141297 [1,1,0,0,0,0|1,0,0]=3 3855 B10R1.22 Cc1cc(c(c(c1)F)N)O 271570a_203496583355_100012353694 [1,1,0,0,0,0|1,0,0]=3 3856 B10R1.22 Cc1cc(c(c(c1)F)O)F 271570a_203496583355_100015306127 [1,1,0,0,0,0|1,0,1]=4 3857 B10R1.22 Cc1cc(c(c(c1)F)O)N 271570a_203496583355_100021129147 [1,1,0,0,0,0|1,0,1]=4 3858 B10R1.22 Cc1cc(c(c(c1)F)O)O 271570a_203496583355_200135191068 [1,1,0,0,0,0|0,0,1]=3 3859 B10R1.22 Cc1cc(c(c(c1)O)C)N 271570a_203496583355_102495365385 [1,1,0,0,0,0|0,0,1]=3 3860 B10R1.22 Cc1cc(c(c(c1)O)F)C 271570a_203496583355_200010204574 [1,1,0,0,0,0|1,0,0]=3 3861 B10R1.22 Cc1cc(c(c(c1)O)F)N 271570a_203496583355_100010589139 [1,1,0,0,0,0|1,0,0]=3 3862 B10R1.22 Cc1cc(c(c(c1)O)N)C 271570a_203496583355_100000688863 [1,1,0,0,0,0|1,0,0]=3 3863 B10R1.22 Cc1cc(c(c(c1)O)N)N 271570a_203496583355_100012348275 [1,1,0,0,0,0|1,0,0]=3 3864 B10R1.22 Cc1cc(c(c(c1)O)O)C 271570a_203496583355_100010342985 [1,1,0,0,0,0|0,0,1]=3 3865 B10R1.22 Cc1cc(c(c(c1)O)O)C 271570a_203496583355_100011934984 [1,1,0,0,0,0|0,0,1]=3 3866 B10R1.22 Cc1cc(c(c(n1)O)N)C 271570a_203496583355_100009816701 [1,1,0,0,0,0|2,0,0]=4 3867 B10R1.22 Cc1cc(cc(c1C)O)N 271570a_203496583355_100010368239 [1,1,0,0,0,0|1,0,1]=4 3868 B10R1.22 Cc1cc(cc(c1C)O)O 271570a_203496583355_100010068915 [1,1,0,0,0,0|1,0,1]=4 3869 B10R1.22 Cc1cc(cc(c1F)O)F 271570a_203496583355_100010291795 [1,1,0,0,0,0|2,0,0]=4 3870 B10R1.22 Cc1cc(cc(c1N)O)Br 271570a_203496583355_200000690823 [1,1,0,0,0,0|2,0,0]=4 3871 B10R1.22 Cc1cc(cc(c1N)O)Cl 271570a_203496583355_100012344046 [1,1,0,0,0,0|2,0,0]=4 3872 B10R1.22 Cc1cc(cc(c1N)O)F 271570a_203496583355_100011216670 [1,1,0,0,0,0|2,0,0]=4 3873 B10R1.22 Cc1cc(cc(c1N)O)O 271570a_203496583355_100010371313 [1,1,0,0,0,0|2,0,0]=4 3874 B10R1.22 Cc1cc(cc(c1O)O)Cl 271570a_203496583355_100010254216 [1,1,0,0,0,0|1,0,1]=4 3875 B10R1.22 Cc1cc(cc(c1O)O)Cl 271570a_203496583355_100012343667 [1,1,0,0,0,0|1,0,1]=4 3876 B10R1.22 Cc1cc(cc(c1O)O)N 271570a_203496583355_100010064301 [1,1,0,0,0,0|1,0,1]=4 3877 B10R1.22 Nc1c(cc(cc1Br)Cl)O 271570a_203496583355_200012970264 [1,1,0,0,0,0|2,0,0]=4 3878 B10R1.22 Nc1c(cc(cc1Cl)Cl)O 271570a_203496583355_100011216899 [1,1,0,0,0,0|2,0,0]=4 3879 B10R1.22 Nc1c(cc(cc1F)Br)O 271570a_203496583355_100012970276 [1,1,0,0,0,0|2,0,0]=4 3880 B10R1.22 Nc1c(cc(cc1F)Cl)O 271570a_203496583355_100011214900 [1,1,0,0,0,0|2,0,0]=4 3881 B10R1.22 Nc1c(cc(cc1F)F)O 271570a_203496583355_100000211602 [1,1,0,0,0,0|2,0,0]=4 3882 B10R1.22 Nc1c(cc(cc1F)O)O 271570a_203496583355_100015475841 [1,1,0,0,0,0|2,0,0]=4 3883 B10R1.22 Nc1cc(c(c(c1)F)F)O 271570a_203496583355_100009816004 [1,1,0,0,0,0|2,0,0]=4 3884 B10R1.22 Nc1cc(cc(c1F)O)F 271570a_203496583355_100000722353 [1,1,0,0,0,0|2,0,0]=4 3885 B10R1.22 Nc1cc(cc(c1N)O)F 271570a_203496583355_100011934818 [1,1,0,0,0,0|2,0,0]=4 3886 B10R1.22 Nc1cc(cc(c1O)O)F 271570a_203496583355_200011217456 [1,1,0,0,0,0|1,0,1]=4 3887 B10R1.22 Oc1cc(c(c(c1)F)F)O 271570a_203496583355_100000709865 [1,1,0,0,0,0|2,0,0]=4 3888 B10R1.22 Oc1cc(c(c(c1)O)O)O 271570a_203496583355_200010341185 [1,1,0,0,0,0|1,0,1]=4 3889 B10R1.22 Oc1cc(cc(c1Br)F)F 271570a_203496583355_100010256416 [1,1,0,0,0,0|2,0,0]=4 3890 B10R1.22 Oc1cc(cc(c1Cl)Cl)Cl 271570a_203496583355_200000042848 [1,1,0,0,0,0|2,0,0]=4 3891 B10R1.22 Oc1cc(cc(c1F)Cl)Br 271570a_203496583355_100010270166 [1,1,0,0,0,0|2,0,0]=4 3892 B10R1.22 Oc1cc(cc(c1F)F)F 271570a_203496583355_100000724850 [1,1,0,0,0,0|2,0,0]=4 3893 B10R1.22 Oc1cc(cc(c1O)Br)F 271570a_203496583355_200013085147 [1,1,0,0,0,0|1,0,1]=4 3894 B10R1.22 Oc1cc(cc(c1O)Cl)Cl 271570a_203496583355_200012339341 [1,1,0,0,0,0|1,0,1]=4 3895 B10R1.22 Oc1cc(cc(c1O)F)Br 271570a_203496583355_100013354677 [1,1,0,0,0,0|1,0,1]=4 3896 B10R1.22 Oc1cc(cc(c1O)F)F 271570a_203496583355_100000688693 [1,1,0,0,0,0|1,0,1]=4 3897 B10R1.22 Oc1cc(cc(c1O)F)F 271570a_203496583355_100009815984 [1,1,0,0,0,0|1,0,1]=4 3898 B10R1.118 Cc1cc(c(=O)[nH]c1C)O 271570a_203496583355_100010064231 [1,1,0,0,0,0|1,0,0]=3 3899 B10R1.118 Cc1cc(c(cc1Br)Cl)O 271570a_203496583355_100010259621 [1,1,0,0,0,0|1,0,0]=3 3900 B10R1.118 Cc1cc(c(cc1Br)F)O 271570a_203496583355_200009814772 [1,1,0,0,0,0|1,0,0]=3 3901 B10R1.118 Cc1cc(c(cc1Br)N)O 271570a_203496583355_200015600912 [1,1,0,0,0,0|1,0,0]=3 3902 B10R1.118 Cc1cc(c(cc1Br)O)Br 271570a_203496583355_100012929169 [1,1,0,0,0,0|1,0,1]=4 3903 B10R1.118 Cc1cc(c(cc1Br)O)F 271570a_203496583355_100011068846 [1,1,0,0,0,0|1,0,1]=4 3904 B10R1.118 Cc1cc(c(cc1C)F)O 271570a_203496583355_100010197417 [1,1,0,0,0,0|1,0,0]=3 3905 B10R1.118 Cc1cc(c(cc1C)O)C 271570a_203496583355_100000759388 [1,1,0,0,0,0|0,0,1]=3 3906 B10R1.118 Cc1cc(c(cc1C)O)N 271570a_203496583355_100012337760 [1,1,0,0,0,0|1,0,0]=3 3907 B10R1.118 Cc1cc(c(cc1C)O)O 271570a_203496583355_100009814663 [1,1,0,0,0,0|0,0,1]=3 3908 B10R1.118 Cc1cc(c(cc1F)Br)O 271570a_203496583355_200009814773 [1,1,0,0,0,0|1,0,0]=3 3909 B10R1.118 Cc1cc(c(cc1F)F)O 271570a_203496583355_100000692463 [1,1,0,0,0,0|1,0,0]=3 3910 B10R1.118 Cc1cc(c(cc1F)N)O 271570a_203496583355_100011218008 [1,1,0,0,0,0|1,0,0]=3 3911 B10R1.118 Cc1cc(c(cc1F)O)Br 271570a_203496583355_200009814774 [1,1,0,0,0,0|1,0,1]=4 3912 B10R1.118 Cc1cc(c(cc1F)O)F 271570a_203496583355_100011219510 [1,1,0,0,0,0|1,0,1]=4 3913 B10R1.118 Cc1cc(c(cc1F)O)N 271570a_203496583355_100010233353 [1,1,0,0,0,0|1,0,1]=4 3914 B10R1.118 Cc1cc(c(cc1N)C)O 271570a_203496583355_100011934712 [1,1,0,0,0,0|0,0,1]=3 3915 B10R1.118 Cc1cc(c(cc1N)F)O 271570a_203496583355_100000695870 [1,1,0,0,0,0|1,0,0]=3 3916 B10R1.118 Cc1cc(c(cc1N)N)O 271570a_203496583355_200013038441 [1,1,0,0,0,0|1,0,0]=3 3917 B10R1.118 Cc1cc(c(cc1N)O)C 271570a_203496583355_100000703630 [1,1,0,0,0,0|1,0,1]=4 3918 B10R1.118 Cc1cc(c(cc1N)O)F 271570a_203496583355_100000717900 [1,1,0,0,0,0|1,0,1]=4 3919 B10R1.118 Cc1cc(c(cc1O)Br)F 271570a_203496583355_100011216669 [1,1,0,0,0,0|1,0,1]=4 3920 B10R1.118 Cc1cc(c(cc1O)C)Br 271570a_203496583355_100011356911 [1,1,0,0,0,0|0,0,1]=3 3921 B10R1.118 Cc1cc(c(cc1O)C)Cl 271570a_203496583355_100012357408 [1,1,0,0,0,0|0,0,1]=3 3922 B10R1.118 Cc1cc(c(cc1O)C)F 271570a_203496583355_100010212296 [1,1,0,0,0,0|0,0,1]=3 3923 B10R1.118 Cc1cc(c(cc1O)C)O 271570a_203496583355_100000698207 [1,1,0,0,0,0|0,0,1]=3 3924 B10R1.118 Cc1cc(c(cc1O)Cl)Br 271570a_203496583355_200009814780 [1,1,0,0,0,0|1,0,1]=4 3925 B10R1.118 Cc1cc(c(cc1O)F)Br 271570a_203496583355_100011356895 [1,1,0,0,0,0|1,0,1]=4 3926 B10R1.118 Cc1cc(c(cc1O)F)F 271570a_203496583355_100009815990 [1,1,0,0,0,0|1,0,1]=4 3927 B10R1.118 Cc1cc(c(cc1O)F)N 271570a_203496583355_100000691575 [1,1,0,0,0,0|1,0,1]=4 3928 B10R1.118 Cc1cc(c(cc1O)F)O 271570a_203496583355_100012355673 [1,1,0,0,0,0|1,0,0]=3 3929 B10R1.118 Cc1cc(c(cc1O)N)F 271570a_203496583355_100011014115 [1,1,0,0,0,0|1,0,1]=4 3930 B10R1.118 Cc1cc(c(cc1O)N)N 271570a_203496583355_100010080480 [1,1,0,0,0,0|1,0,1]=4 3931 B10R1.118 Cc1cc(c(cc1O)N)O 271570a_203496583355_200010235796 [1,1,0,0,0,0|1,0,0]=3 3932 B10R1.118 Cc1cc(c(cc1O)O)F 271570a_203496583355_100010068922 [1,1,0,0,0,0|1,0,1]=4 3933 B10R1.118 Cc1cc(c(cc1O)O)F 271570a_203496583355_100014242602 [1,1,0,0,0,0|1,0,1]=4 3934 B10R1.118 Cc1cc(c(cc1O)O)N 271570a_203496583355_200010107346 [1,1,0,0,0,0|1,0,1]=4 3935 B10R1.118 Cc1cc(c(nc1C)N)O 271570a_203496583355_100009990238 [1,1,0,0,0,0|2,0,0]=4 3936 B10R1.118 Cn1cc(c(=O)[nH]c1=O)O 271570a_203496583355_100000185368 [1,1,0,0,0,0|2,0,0]=4 3937 B10R1.118 Nc1cc(c(cc1Cl)Cl)O 271570a_203496583355_100016224655 [1,1,0,0,0,0|2,0,0]=4 3938 B10R1.118 Nc1cc(c(cc1F)F)O 271570a_203496583355_100000700208 [1,1,0,0,0,0|2,0,0]=4 3939 B10R1.118 Nc1cc(c(cc1F)O)F 271570a_203496583355_100000690247 [1,1,0,0,0,0|2,0,0]=4 3940 B10R1.118 Nc1cc(c(cc1N)F)O 271570a_203496583355_100000766667 [1,1,0,0,0,0|2,0,0]=4 3941 B10R1.118 Nc1cc(c(cc1O)Br)F 271570a_203496583355_100010888672 [1,1,0,0,0,0|2,0,0]=4 3942 B10R1.118 Nc1cc(c(cc1O)Cl)Cl 271570a_203496583355_200011093942 [1,1,0,0,0,0|2,0,0]=4 3943 B10R1.118 Nc1cc(c(cc1O)Cl)F 271570a_203496583355_100010892166 [1,1,0,0,0,0|2,0,0]=4 3944 B10R1.118 Nc1cc(c(cc1O)Cl)O 271570a_203496583355_100011011175 [1,1,0,0,0,0|2,0,0]=4 3945 B10R1.118 Nc1cc(c(cc1O)F)Br 271570a_203496583355_200021016574 [1,1,0,0,0,0|2,0,0]=4 3946 B10R1.118 Nc1cc(c(cc1O)F)Cl 271570a_203496583355_200010992381 [1,1,0,0,0,0|2,0,0]=4 3947 B10R1.118 Nc1cc(c(cc1O)F)F 271570a_203496583355_100000765032 [1,1,0,0,0,0|2,0,0]=4 3948 B10R1.118 Nc1cc(c(cc1O)F)N 271570a_203496583355_200010115645 [1,1,0,0,0,0|2,0,0]=4 3949 B10R1.118 Nc1cc(c(cc1O)F)O 271570a_203496583355_100012359894 [1,1,0,0,0,0|2,0,0]=4 3950 B10R1.118 Nc1cc(c(cc1O)O)F 271570a_203496583355_100013038943 [1,1,0,0,0,0|2,0,0]=4 3951 B10R1.118 Oc1cc(c(cc1Br)Br)Br 271570a_203496583355_100010151546 [1,1,0,0,0,0|2,0,0]=4 3952 B10R1.118 Oc1cc(c(cc1Br)Br)F 271570a_203496583355_200010212206 [1,1,0,0,0,0|2,0,0]=4 3953 B10R1.118 Oc1cc(c(cc1Br)Cl)F 271570a_203496583355_100010254745 [1,1,0,0,0,0|2,0,0]=4 3954 B10R1.118 Oc1cc(c(cc1Br)F)F 271570a_203496583355_100010259568 [1,1,0,0,0,0|2,0,0]=4 3955 B10R1.118 Oc1cc(c(cc1Cl)Br)Cl 271570a_203496583355_200010244590 [1,1,0,0,0,0|2,0,0]=4 3956 B10R1.118 Oc1cc(c(cc1Cl)Br)F 271570a_203496583355_100010212230 [1,1,0,0,0,0|2,0,0]=4 3957 B10R1.118 Oc1cc(c(cc1Cl)Br)O 271570a_203496583355_100021297947 [1,1,0,0,0,0|2,0,0]=4 3958 B10R1.118 Oc1cc(c(cc1Cl)Cl)Cl 271570a_203496583355_200011216203 [1,1,0,0,0,0|2,0,0]=4 3959 B10R1.118 Oc1cc(c(cc1Cl)F)F 271570a_203496583355_100012349977 [1,1,0,0,0,0|2,0,0]=4 3960 B10R1.118 Oc1cc(c(cc1F)Br)Br 271570a_203496583355_200010212210 [1,1,0,0,0,0|2,0,0]=4 3961 B10R1.118 Oc1cc(c(cc1F)Br)F 271570a_203496583355_100011356857 [1,1,0,0,0,0|2,0,0]=4 3962 B10R1.118 Oc1cc(c(cc1F)Cl)F 271570a_203496583355_100010142863 [1,1,0,0,0,0|2,0,0]=4 3963 B10R1.118 Oc1cc(c(cc1F)Cl)O 271570a_203496583355_100010735246 [1,1,0,0,0,0|2,0,0]=4 3964 B10R1.118 Oc1cc(c(cc1F)F)Br 271570a_203496583355_100011356914 [1,1,0,0,0,0|2,0,0]=4 3965 B10R1.118 Oc1cc(c(cc1F)F)F 271570a_203496583355_100000686897 [1,1,0,0,0,0|2,0,0]=4 3966 B10R1.118 Oc1cc(c(cc1F)F)O 271570a_203496583355_100012457948 [1,1,0,0,0,0|2,0,0]=4 3967 B10R1.118 Oc1cc(c(cc1F)O)F 271570a_203496583355_100011830439 [1,1,0,0,0,0|2,0,0]=4 3968 B10R1.118 Oc1cc(c(cc1O)F)F 271570a_203496583355_100009813768 [1,1,0,0,0,0|1,0,1]=4 3969 B10R1.119 Cc1c(ccc(c1O)F)F 271570a_203496583355_100010167959 [1,1,0,0,0,0|2,0,0]=4 3970 B10R1.119 Cc1c(ccc(c1O)O)F 271570a_203496583355_200010391124 [1,1,0,0,0,0|1,0,1]=4 3971 B10R1.119 Cc1ccc(c(c1C)F)O 271570a_203496583355_200015555822 [1,1,0,0,0,0|1,0,1]=4 3972 B10R1.119 Cc1ccc(c(c1F)F)O 271570a_203496583355_100012766498 [1,1,0,0,0,0|1,0,1]=4 3973 B10R1.119 Cc1ccc(c(c1F)O)O 271570a_203496583355_100000722096 [1,1,0,0,0,0|0,0,1]=3 3974 B10R1.119 Cc1ccc(c(c1N)C)O 271570a_203496583355_200010074581 [1,1,0,0,0,0|1,0,1]=4 3975 B10R1.119 Cc1ccc(c(c1O)C)F 271570a_203496583355_100011068659 [1,1,0,0,0,0|1,0,1]=4 3976 B10R1.119 Cc1ccc(c(c1O)C)N 271570a_203496583355_106354213274 [1,1,0,0,0,0|1,0,1]=4 3977 B10R1.119 Cc1ccc(c(c1O)C)O 271570a_203496583355_100010659238 [1,1,0,0,0,0|1,0,1]=4 3978 B10R1.119 Cc1ccc(c(c1O)O)F 271570a_203496583355_200010223207 [1,1,0,0,0,0|1,0,0]=3 3979 B10R1.119 Cn1ccc(=O)c(c1O)F 271570a_203496583355_200010096536 [1,1,0,0,0,0|2,0,0]=4 3980 B10R1.119 Nc1c(ccc(c1O)Br)O 271570a_203496583355_100020748643 [1,1,0,0,0,0|2,0,0]=4 3981 B10R1.119 Nc1c(ccc(c1O)F)F 271570a_203496583355_100014094178 [1,1,0,0,0,0|2,0,0]=4 3982 B10R1.119 Nc1ccc(c(c1F)O)F 271570a_203496583355_100010070858 [1,1,0,0,0,0|2,0,0]=4 3983 B10R1.119 Nc1ccc(c(c1N)O)F 271570a_203496583355_100010128261 [1,1,0,0,0,0|2,0,0]=4 3984 B10R1.119 Nc1ccc(c(c1O)Cl)Br 271570a_203496583355_200010779962 [1,1,0,0,0,0|2,0,0]=4 3985 B10R1.119 Nc1ccc(c(c1O)Cl)Cl 271570a_203496583355_200011093878 [1,1,0,0,0,0|2,0,0]=4 3986 B10R1.119 Nc1ccc(c(c1O)F)Cl 271570a_203496583355_100010134325 [1,1,0,0,0,0|2,0,0]=4 3987 B10R1.119 Nc1ccc(c(c1O)F)F 271570a_203496583355_100010232473 [1,1,0,0,0,0|2,0,0]=4 3988 B10R1.119 Oc1c(ccc(c1Cl)Cl)Cl 271570a_203496583355_200010170825 [1,1,0,0,0,0|2,0,0]=4 3989 B10R1.119 Oc1c(ccc(c1Cl)Cl)F 271570a_203496583355_200015697950 [1,1,0,0,0,0|2,0,0]=4 3990 B10R1.119 Oc1c(ccc(c1Cl)F)Br 271570a_203496583355_200037249116 [1,1,0,0,0,0|2,0,0]=4 3991 B10R1.119 Oc1c(ccc(c1Cl)F)F 271570a_203496583355_100010167948 [1,1,0,0,0,0|2,0,0]=4 3992 B10R1.119 Oc1c(ccc(c1F)Br)Cl 271570a_203496583355_100011092007 [1,1,0,0,0,0|2,0,0]=4 3993 B10R1.119 Oc1c(ccc(c1F)Br)F 271570a_203496583355_100000722365 [1,1,0,0,0,0|2,0,0]=4 3994 B10R1.119 Oc1c(ccc(c1F)Cl)Br 271570a_203496583355_100011084128 [1,1,0,0,0,0|2,0,0]=4 3995 B10R1.119 Oc1c(ccc(c1F)Cl)F 271570a_203496583355_200010167938 [1,1,0,0,0,0|2,0,0]=4 3996 B10R1.119 Oc1c(ccc(c1F)F)F 271570a_203496583355_100009814005 [1,1,0,0,0,0|2,0,0]=4 3997 B10R1.119 Oc1c(ccc(c1O)F)F 271570a_203496583355_100010170822 [1,1,0,0,0,0|2,0,0]=4 3998 B10R1.119 Oc1ccc(c(c1F)O)Br 271570a_203496583355_200010782288 [1,1,0,0,0,0|2,0,0]=4 3999 B10R1.119 Oc1ccc(c(c1F)O)F 271570a_203496583355_100010167067 [1,1,0,0,0,0|2,0,0]=4 4000 B10R1.119 Oc1ccc(c(c1O)F)F 271570a_203496583355_100010243909 [1,1,0,0,0,0|1,0,1]=4 4001 B10R1.32 C=Cc1cc(sc1C=O)C 271570a_100011290941_100011361552 [0,1,0,0,1,0|2,0,0]=4 4002 B10R1.32 CSc1cc(sc1C=O)C 62a_100011361552_200000210301 [0,1,0,0,1,0|1,1,0]=4 4003 B10R1.32 CSc1cc(sc1C=O)C 62a_200000210301_100011361552 [0,1,0,0,1,0|1,1,0]=4 4004 B10R1.32 Cc1cc(c(s1)C=O)S[13CH3] 62a_100011361552_200025704644 [0,1,0,0,1,0|1,1,0]=4 4005 B10R1.32 Cc1cc(c(s1)C=O)S[13CH3] 62a_200025704644_100011361552 [0,1,0,0,1,0|1,1,0]=4 4006 B10R1.35 CCn1cc(c(n1)C=O)O 271570a_203496583355_100000763637 [0,1,0,0,1,0|2,0,0]=4 4007 B10R1.35 CSc1cc(c(s1)C=O)C 62a_100010221198_200000210301 [0,1,0,0,1,0|2,0,0]=4 4008 B10R1.35 CSc1cc(c(s1)C=O)C 62a_200000210301_100010221198 [0,1,0,0,1,0|2,0,0]=4 4009 B10R1.35 Cc1cc(sc1C=O)S[13CH3] 62a_100010221198_200025704644 [0,1,0,0,1,0|2,0,0]=4 4010 B10R1.35 Cc1cc(sc1C=O)S[13CH3] 62a_200025704644_100010221198 [0,1,0,0,1,0|2,0,0]=4 4011 B10R1.256 Cc1c(c(nn1C)O)C=O 271570a_203496583355_100016123337 [0,1,0,0,1,0|2,0,0]=4 4012 B12R1.46 C=C(C)c1cc(ccc1C=O)Br 271570a_100000694244_100010146562 [0,2,0,0,0,0|2,0,0]=4 4013 B12R1.46 C=C(C)c1cc(ccc1C=O)C 271570a_100000694244_100000692596 [0,2,0,0,0,0|1,0,0]=3 4014 B12R1.46 C=C(C)c1cc(ccc1C=O)F 271570a_100000694244_100000752949 [0,2,0,0,0,0|2,0,0]=4 4015 B12R1.46 C=C(C)c1cc(ccc1C=O)O 271570a_100000694244_100011236494 [0,2,0,0,0,0|2,0,0]=4 4016 B12R1.46 C=C(C)c1nc(ccc1C=O)C 271570a_100000694244_100000085379 [0,2,0,0,0,0|2,0,0]=4 4017 B12R1.46 C=Cc1ccc(cc1B(O)O)C 271570a_100011290941_200010883979 [0,2,0,0,0,0|1,0,0]=3 4018 B12R1.46 C=Cc1ccc(cc1B(O)O)F 271570a_100011290941_200009816908 [0,2,0,0,0,0|2,0,0]=4 4019 B12R1.46 C=Cc1ccc(cc1C(=O)C)C 271570a_100011290941_100012361225 [0,2,0,0,0,0|1,0,1]=4 4020 B12R1.46 C=Cc1ccc(cc1C(=O)N)C 271570a_100011290941_200012349609 [0,2,0,0,0,0|1,0,1]=4 4021 B12R1.46 C=Cc1ccc(cc1[C@H](C)O)F 271570a_100011290941_100134768474 [0,2,0,0,0,0|2,0,0]=4 4022 B12R1.46 C=Cc1ncc(cc1B(O)O)C 271570a_100011290941_200000049436 [0,2,0,0,0,0|2,0,0]=4 4023 B12R1.46 CSc1ccc(cc1B(O)O)C 62a_200000210301_200010883979 [0,2,0,0,0,0|2,0,0]=4 4024 B12R1.46 CSc1ccc(cc1B(O)O)C 62a_200010883979_200000210301 [0,2,0,0,0,0|2,0,0]=4 4025 B12R1.46 Cc1ccc(c(c1)B(O)O)S[13CH3] 62a_200010883979_200025704644 [0,2,0,0,0,0|2,0,0]=4 4026 B12R1.46 Cc1ccc(c(c1)B(O)O)S[13CH3] 62a_200025704644_200010883979 [0,2,0,0,0,0|2,0,0]=4 4027 B12R1.57 C=C(C)c1ccc(cc1C#N)C 271570a_100000694244_100011935190 [0,2,0,0,0,0|2,0,0]=4 4028 B12R1.57 C=C(C)c1ccc(cc1C=O)C 271570a_100000694244_100011551863 [0,2,0,0,0,0|1,0,1]=4 4029 B12R1.57 C=C(C)c1ccc(cc1CO)Br 271570a_100000694244_100011356890 [0,2,0,0,0,0|2,0,0]=4 4030 B12R1.57 C=C(C)c1ccc(cc1CO)C 271570a_100000694244_100012361352 [0,2,0,0,0,0|1,0,0]=3 4031 B12R1.57 C=C(C)c1ccc(cc1CO)F 271570a_100000694244_100011217561 [0,2,0,0,0,0|2,0,0]=4 4032 B12R1.57 C=C(C)c1ccc(cc1CO)N 271570a_100000694244_100012347228 [0,2,0,0,0,0|2,0,0]=4 4033 B12R1.57 C=C(C)c1ccc(cc1CO)O 271570a_100000694244_100012351483 [0,2,0,0,0,0|2,0,0]=4 4034 B12R1.57 C=C(C)c1ccc(cc1OC)Br 271570a_100000694244_100010245111 [0,2,0,0,0,0|2,0,0]=4 4035 B12R1.57 C=C(C)c1ccc(cc1OC)C 271570a_100000694244_100010200004 [0,2,0,0,0,0|1,0,0]=3 4036 B12R1.57 C=C(C)c1ccc(cc1OC)Cl 271570a_100000694244_100000050115 [0,2,0,0,0,0|2,0,0]=4 4037 B12R1.57 C=C(C)c1ccc(cc1OC)F 271570a_100000694244_100000757151 [0,2,0,0,0,0|2,0,0]=4 4038 B12R1.57 C=C(C)c1ccc(cc1OC)N 271570a_100000694244_100000765947 [0,2,0,0,0,0|2,0,0]=4 4039 B12R1.57 C=C(C)c1ccc(cc1OC)O 271570a_100000694244_100011827694 [0,2,0,0,0,0|2,0,0]=4 4040 B12R1.57 C=C(C)c1ccc(cc1SC)C 271570a_100000694244_200010709736 [0,2,0,0,0,0|1,1,0]=4 4041 B12R1.57 C=C(C)c1ccc(nc1CO)C 271570a_100000694244_100010074375 [0,2,0,0,0,0|2,0,0]=4 4042 B12R1.57 C=C(C)c1ccc(nc1OC)C 271570a_100000694244_100010138632 [0,2,0,0,0,0|2,0,0]=4 4043 B12R1.57 C=C(C)c1cnc(cc1CO)C 271570a_100000694244_100015579599 [0,2,0,0,0,0|2,0,0]=4 4044 B12R1.57 C=C(C)c1cnc(cc1OC)C 271570a_100000694244_100000717771 [0,2,0,0,0,0|2,0,0]=4 4045 B12R1.57 C=C(C)c1ncc(cc1CO)C 271570a_100000694244_100000118064 [0,2,0,0,0,0|2,0,0]=4 4046 B12R1.57 C=C(C)c1ncc(cc1OC)C 271570a_100000694244_200000118316 [0,2,0,0,0,0|2,0,0]=4 4047 B12R1.57 C=Cc1cc(ccc1C(=O)C)C 271570a_100011290941_100012353930 [0,2,0,0,0,0|1,0,0]=3 4048 B12R1.57 C=Cc1cc(ccc1C(=O)C)F 271570a_100011290941_100000686192 [0,2,0,0,0,0|2,0,0]=4 4049 B12R1.57 C=Cc1cc(ccc1C(=O)C)O 271570a_100011290941_100012340537 [0,2,0,0,0,0|2,0,0]=4 4050 B12R1.57 C=Cc1cc(ccc1C(=O)N)Br 271570a_100011290941_100009815748 [0,2,0,0,0,0|2,0,0]=4 4051 B12R1.57 C=Cc1cc(ccc1C(=O)N)F 271570a_100011290941_100000206404 [0,2,0,0,0,0|2,0,0]=4 4052 B12R1.57 C=Cc1nc(ccc1C(=O)N)C 271570a_100011290941_100000041523 [0,2,0,0,0,0|2,0,0]=4 4053 B12R1.57 CC(=O)c1ccc(cc1C#N)Br 1458a_100012349539_200000210301 [0,2,0,0,0,0|2,0,0]=4 4054 B12R1.57 CC(=O)c1ccc(cc1C#N)C 1458a_200012184421_200000210301 [0,2,0,0,0,0|1,0,0]=3 4055 B12R1.57 CC(=O)c1ccc(cc1C#N)F 1458a_100012002388_200000210301 [0,2,0,0,0,0|2,0,0]=4 4056 B12R1.57 CC(=O)c1ccc(cc1CO)Br 1458a_100010253900_200000210301 [0,2,0,0,0,0|1,0,0]=3 4057 B12R1.57 CC(=O)c1ccc(cc1CO)F 1458a_100013035055_200000210301 [0,2,0,0,0,0|1,0,0]=3 4058 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])Br 7a_100000188348_200025704644 [0,2,0,0,0,0|1,0,0]=3 4059 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])C 34a_100000234885_200025704644 [0,2,0,0,0,0|0,0,0]=2 4060 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])C 7a_100000234885_200025704644 [0,2,0,0,0,0|0,0,0]=2 4061 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])Cl 34a_100000061402_200025704644 [0,2,0,0,0,0|1,0,0]=3 4062 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])Cl 7a_100000061402_200025704644 [0,2,0,0,0,0|1,0,0]=3 4063 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])F 7a_100011215782_200025704644 [0,2,0,0,0,0|1,0,0]=3 4064 B12R1.57 CC(=O)c1ccc(cc1S[13CH3])C 62a_100012353930_200025704644 [0,2,0,0,0,0|0,1,0]=3 4065 B12R1.57 CC(=O)c1ccc(cc1S[13CH3])C 62a_200025704644_100012353930 [0,2,0,0,0,0|0,1,0]=3 4066 B12R1.57 CC(=O)c1ccc(cc1S[13CH3])F 62a_100000686192_200025704644 [0,2,0,0,0,0|1,1,0]=4 4067 B12R1.57 CC(=O)c1ccc(cc1S[13CH3])O 62a_100012340537_200025704644 [0,2,0,0,0,0|1,1,0]=4 4068 B12R1.57 CCc1cc(ccc1C(=O)C)Br 1458a_200012349896_200000210301 [0,2,0,0,0,0|2,0,0]=4 4069 B12R1.57 CCc1cc(ccc1C(=O)[13CH3])Br 1458a_200012349896_200025704644 [0,2,0,0,0,0|2,0,0]=4 4070 B12R1.57 CNc1cc(ccc1C(=O)C)F 27a_100102657272_100000686192 [0,2,0,0,0,0|2,0,0]=4 4071 B12R1.57 CNc1cc(ccc1C(=O)N)Br 27a_100102657272_100009815748 [0,2,0,0,0,0|2,0,0]=4 4072 B12R1.57 CNc1cc(ccc1C(=O)N)Br 7a_100012349972_200000210301 [0,2,0,0,0,0|2,0,0]=4 4073 B12R1.57 CNc1cc(ccc1C(=O)N)C 34a_100011219537_200000210301 [0,2,0,0,0,0|1,0,0]=3 4074 B12R1.57 CNc1cc(ccc1C(=O)N)C 7a_100011219537_200000210301 [0,2,0,0,0,0|1,0,0]=3 4075 B12R1.57 CNc1cc(ccc1C(=O)N)Cl 34a_100000738103_200000210301 [0,2,0,0,0,0|2,0,0]=4 4076 B12R1.57 CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_200000210301 [0,2,0,0,0,0|2,0,0]=4 4077 B12R1.57 CNc1cc(ccc1C(=O)N)F 27a_100102657272_100000206404 [0,2,0,0,0,0|2,0,0]=4 4078 B12R1.57 CNc1cc(ccc1C(=O)N)F 34a_100011298637_200000210301 [0,2,0,0,0,0|2,0,0]=4 4079 B12R1.57 CNc1nc(ccc1C(=O)N)C 27a_100102657272_100000041523 [0,2,0,0,0,0|2,0,0]=4 4080 B12R1.57 COc1cc(ccc1C(=O)C)Br 1458a_100000748230_200000210301 [0,2,0,0,0,0|1,0,0]=3 4081 B12R1.57 COc1cc(ccc1C(=O)C)Br 7a_100000188348_200000210301 [0,2,0,0,0,0|1,0,0]=3 4082 B12R1.57 COc1cc(ccc1C(=O)C)C 1458a_100000217210_200000210301 [0,2,0,0,0,0|0,0,0]=2 4083 B12R1.57 COc1cc(ccc1C(=O)C)C 34a_100000234885_200000210301 [0,2,0,0,0,0|0,0,0]=2 4084 B12R1.57 COc1cc(ccc1C(=O)C)C 7a_100000234885_200000210301 [0,2,0,0,0,0|0,0,0]=2 4085 B12R1.57 COc1cc(ccc1C(=O)C)Cl 1458a_100000217211_200000210301 [0,2,0,0,0,0|1,0,0]=3 4086 B12R1.57 COc1cc(ccc1C(=O)C)Cl 34a_100000061402_200000210301 [0,2,0,0,0,0|1,0,0]=3 4087 B12R1.57 COc1cc(ccc1C(=O)C)Cl 7a_100000061402_200000210301 [0,2,0,0,0,0|1,0,0]=3 4088 B12R1.57 COc1cc(ccc1C(=O)C)F 1458a_100000239970_200000210301 [0,2,0,0,0,0|1,0,0]=3 4089 B12R1.57 COc1cc(ccc1C(=O)C)F 7a_100011215782_200000210301 [0,2,0,0,0,0|1,0,0]=3 4090 B12R1.57 COc1cc(ccc1C(=O)C)I 1458a_100012353712_200000210301 [0,2,0,0,0,0|1,0,0]=3 4091 B12R1.57 COc1cc(ccc1C(=O)C)O 271570a_203496583355_100000709911 [0,2,0,0,0,0|1,0,0]=3 4092 B12R1.57 COc1cc(ccc1C(=O)N)Br 34a_100011550861_200000210301 [0,2,0,0,0,0|1,0,0]=3 4093 B12R1.57 COc1cc(ccc1C(=O)N)Br 7a_100011550861_200000210301 [0,2,0,0,0,0|1,0,0]=3 4094 B12R1.57 COc1cc(ccc1C(=O)N)C 34a_100000192831_200000210301 [0,2,0,0,0,0|0,0,0]=2 4095 B12R1.57 COc1cc(ccc1C(=O)N)C 7a_100000192831_200000210301 [0,2,0,0,0,0|0,0,0]=2 4096 B12R1.57 COc1cc(ccc1C(=O)N)Cl 34a_100000192836_200000210301 [0,2,0,0,0,0|1,0,0]=3 4097 B12R1.57 COc1cc(ccc1C(=O)N)Cl 7a_100000192836_200000210301 [0,2,0,0,0,0|1,0,0]=3 4098 B12R1.57 COc1cc(ccc1C(=O)N)N 34a_100000223280_200000210301 [0,2,0,0,0,0|1,0,0]=3 4099 B12R1.57 COc1cc(ccc1C(=O)N)N 7a_100000223280_200000210301 [0,2,0,0,0,0|1,0,0]=3 4100 B12R1.57 COc1cc(ccc1C(=O)N)O 271570a_203496583355_100000748320 [0,2,0,0,0,0|1,0,0]=3 4101 B12R1.57 COc1cc(ccc1C(=O)[13CH3])Br 1458a_100000748230_200025704644 [0,2,0,0,0,0|1,0,0]=3 4102 B12R1.57 COc1cc(ccc1C(=O)[13CH3])C 1458a_100000217210_200025704644 [0,2,0,0,0,0|0,0,0]=2 4103 B12R1.57 COc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000217211_200025704644 [0,2,0,0,0,0|1,0,0]=3 4104 B12R1.57 COc1cc(ccc1C(=O)[13CH3])F 1458a_100000239970_200025704644 [0,2,0,0,0,0|1,0,0]=3 4105 B12R1.57 COc1cc(ccc1C(=O)[13CH3])I 1458a_100012353712_200025704644 [0,2,0,0,0,0|1,0,0]=3 4106 B12R1.57 COc1cc(ccc1C(C)C)C 34a_100000185798_200000210301 [0,2,0,0,0,0|1,0,1]=4 4107 B12R1.57 COc1cc(ccc1C(C)C)C 7a_100000185798_200000210301 [0,2,0,0,0,0|1,0,1]=4 4108 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_200000210301 [0,2,0,0,0,0|2,0,0]=4 4109 B12R1.57 COc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_200000210301 [0,2,0,0,0,0|1,0,0]=3 4110 B12R1.57 COc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_200000210301 [0,2,0,0,0,0|1,0,0]=3 4111 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_200000210301 [0,2,0,0,0,0|2,0,0]=4 4112 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_200000210301 [0,2,0,0,0,0|2,0,0]=4 4113 B12R1.57 COc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_200000210301 [0,2,0,0,0,0|2,0,0]=4 4114 B12R1.57 COc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_200000210301 [0,2,0,0,0,0|2,0,0]=4 4115 B12R1.57 COc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_200000210301 [0,2,0,0,0,0|2,0,0]=4 4116 B12R1.57 COc1cc(cnc1C(=O)C)O 271570a_203496583355_100010137934 [0,2,0,0,0,0|2,0,0]=4 4117 B12R1.57 CSc1cc(ccc1C(=O)C)C 62a_100012353930_200000210301 [0,2,0,0,0,0|0,1,0]=3 4118 B12R1.57 CSc1cc(ccc1C(=O)C)C 62a_200000210301_100012353930 [0,2,0,0,0,0|0,1,0]=3 4119 B12R1.57 CSc1cc(ccc1C(=O)C)F 62a_100000686192_200000210301 [0,2,0,0,0,0|1,1,0]=4 4120 B12R1.57 CSc1cc(ccc1C(=O)C)O 62a_100012340537_200000210301 [0,2,0,0,0,0|1,1,0]=4 4121 B12R1.57 CSc1cc(ccc1C(=O)N)Br 62a_100009815748_200000210301 [0,2,0,0,0,0|1,1,0]=4 4122 B12R1.57 CSc1cc(ccc1C(=O)N)F 62a_100000206404_200000210301 [0,2,0,0,0,0|1,1,0]=4 4123 B12R1.57 CSc1cc(ccc1C(=O)N)F 62a_200000210301_100000206404 [0,2,0,0,0,0|1,1,0]=4 4124 B12R1.57 CSc1nc(ccc1C(=O)N)C 62a_100000041523_200000210301 [0,2,0,0,0,0|1,1,0]=4 4125 B12R1.57 CSc1nc(ccc1C(=O)N)C 62a_200000210301_100000041523 [0,2,0,0,0,0|1,1,0]=4 4126 B12R1.57 Cc1ccc(c(c1)C#N)C(=O)[13CH3] 1458a_200012184421_200025704644 [0,2,0,0,0,0|1,0,0]=3 4127 B12R1.57 Cc1ccc(c(c1)N[13CH3])C(=O)N 34a_100011219537_200025704644 [0,2,0,0,0,0|1,0,0]=3 4128 B12R1.57 Cc1ccc(c(c1)N[13CH3])C(=O)N 7a_100011219537_200025704644 [0,2,0,0,0,0|1,0,0]=3 4129 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(=O)N 34a_100000192831_200025704644 [0,2,0,0,0,0|0,0,0]=2 4130 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(=O)N 7a_100000192831_200025704644 [0,2,0,0,0,0|0,0,0]=2 4131 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(C)C 34a_100000185798_200025704644 [0,2,0,0,0,0|1,0,1]=4 4132 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(C)C 7a_100000185798_200025704644 [0,2,0,0,0,0|1,0,1]=4 4133 B12R1.57 Cc1ccc(c(c1)O[13CH3])[N+](=O)[O-] 34a_100000195450_200025704644 [0,2,0,0,0,0|1,0,0]=3 4134 B12R1.57 Cc1ccc(c(c1)O[13CH3])[N+](=O)[O-] 7a_100000195450_200025704644 [0,2,0,0,0,0|1,0,0]=3 4135 B12R1.57 Cc1ccc(c(n1)S[13CH3])C(=O)N 62a_100000041523_200025704644 [0,2,0,0,0,0|1,1,0]=4 4136 B12R1.57 Cc1ccc(c(n1)S[13CH3])C(=O)N 62a_200025704644_100000041523 [0,2,0,0,0,0|1,1,0]=4 4137 B12R1.57 [13CH3]C(=O)c1ccc(cc1C#N)Br 1458a_100012349539_200025704644 [0,2,0,0,0,0|2,0,0]=4 4138 B12R1.57 [13CH3]C(=O)c1ccc(cc1C#N)F 1458a_100012002388_200025704644 [0,2,0,0,0,0|2,0,0]=4 4139 B12R1.57 [13CH3]C(=O)c1ccc(cc1CO)Br 1458a_100010253900_200025704644 [0,2,0,0,0,0|1,0,0]=3 4140 B12R1.57 [13CH3]C(=O)c1ccc(cc1CO)F 1458a_100013035055_200025704644 [0,2,0,0,0,0|1,0,0]=3 4141 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)Br 7a_100012349972_200025704644 [0,2,0,0,0,0|2,0,0]=4 4142 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)Cl 34a_100000738103_200025704644 [0,2,0,0,0,0|2,0,0]=4 4143 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)Cl 7a_100000738103_200025704644 [0,2,0,0,0,0|2,0,0]=4 4144 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)F 34a_100011298637_200025704644 [0,2,0,0,0,0|2,0,0]=4 4145 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)Br 34a_100011550861_200025704644 [0,2,0,0,0,0|1,0,0]=3 4146 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)Br 7a_100011550861_200025704644 [0,2,0,0,0,0|1,0,0]=3 4147 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)Cl 34a_100000192836_200025704644 [0,2,0,0,0,0|1,0,0]=3 4148 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)Cl 7a_100000192836_200025704644 [0,2,0,0,0,0|1,0,0]=3 4149 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)N 34a_100000223280_200025704644 [0,2,0,0,0,0|1,0,0]=3 4150 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)N 7a_100000223280_200025704644 [0,2,0,0,0,0|1,0,0]=3 4151 B12R1.57 [13CH3]Oc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_200025704644 [0,2,0,0,0,0|2,0,0]=4 4152 B12R1.57 [13CH3]Oc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_200025704644 [0,2,0,0,0,0|2,0,0]=4 4153 B12R1.57 [13CH3]Oc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_200025704644 [0,2,0,0,0,0|2,0,0]=4 4154 B12R1.57 [13CH3]Oc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_200025704644 [0,2,0,0,0,0|2,0,0]=4 4155 B12R1.57 [13CH3]Oc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_200025704644 [0,2,0,0,0,0|2,0,0]=4 4156 B12R1.57 [13CH3]Oc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_200025704644 [0,2,0,0,0,0|2,0,0]=4 4157 B12R1.57 [13CH3]Sc1cc(ccc1C(=O)N)Br 62a_100009815748_200025704644 [0,2,0,0,0,0|1,1,0]=4 4158 B12R1.57 [13CH3]Sc1cc(ccc1C(=O)N)F 62a_100000206404_200025704644 [0,2,0,0,0,0|1,1,0]=4 4159 B12R1.57 [13CH3]Sc1cc(ccc1C(=O)N)F 62a_200025704644_100000206404 [0,2,0,0,0,0|1,1,0]=4 4160 B12R1.78 C=Cc1cc(ccc1C=O)C#N 271570a_100011290941_100012355658 [0,2,0,0,0,0|1,0,1]=4 4161 B12R1.78 C=Cc1cc(ccc1C=O)C=O 271570a_100011290941_100015597013 [0,2,0,0,0,0|1,0,1]=4 4162 B12R1.78 C=Cc1cc(ccc1C=O)OC 271570a_100011290941_100000723261 [0,2,0,0,0,0|1,0,0]=3 4163 B12R1.78 C=Cc1cc(cnc1C=O)OC 271570a_100011290941_200010135874 [0,2,0,0,0,0|2,0,0]=4 4164 B12R1.78 C=Cc1ccc(c(c1)C#N)C=O 271570a_100011290941_100012001787 [0,2,0,0,0,0|1,0,1]=4 4165 B12R1.78 C=Cc1ccc(c(c1)C=O)C=O 271570a_100011290941_200010077131 [0,2,0,0,0,0|0,0,2]=4 4166 B12R1.78 C=Cc1ccc(c(c1)CC)C=O 271570a_100011290941_100010209654 [0,2,0,0,0,0|1,0,1]=4 4167 B12R1.78 C=Cc1ccc(c(c1)OC)C=O 271570a_100011290941_100000697075 [0,2,0,0,0,0|0,0,1]=3 4168 B12R1.78 C=Cc1ccc(c(n1)OC)C=O 271570a_100011290941_100009864722 [0,2,0,0,0,0|1,0,1]=4 4169 B12R1.78 C=Cc1ccc(cc1C#N)CN 271570a_100011290941_100009846983 [0,2,0,0,0,0|2,0,0]=4 4170 B12R1.78 C=Cc1ccc(cc1C#N)CO 271570a_100011290941_100010145894 [0,2,0,0,0,0|2,0,0]=4 4171 B12R1.78 C=Cc1ccc(cc1C#N)OC 271570a_100011290941_100000748272 [0,2,0,0,0,0|2,0,0]=4 4172 B12R1.78 C=Cc1ccc(cc1C=O)OC 271570a_100011290941_100000691568 [0,2,0,0,0,0|1,0,1]=4 4173 B12R1.78 C=Cc1ccc(cc1CC)OC 271570a_100011290941_100000720562 [0,2,0,0,0,0|2,0,0]=4 4174 B12R1.78 C=Cc1ccc(cc1CN)OC 271570a_100011290941_100000741592 [0,2,0,0,0,0|2,0,0]=4 4175 B12R1.78 C=Cc1ccc(cc1CO)C#N 271570a_100011290941_100010246249 [0,2,0,0,0,0|1,0,1]=4 4176 B12R1.78 C=Cc1ccc(cc1CO)C=O 271570a_100011290941_100015639582 [0,2,0,0,0,0|1,0,1]=4 4177 B12R1.78 C=Cc1ccc(cc1CO)OC 271570a_100011290941_200011273942 [0,2,0,0,0,0|1,0,0]=3 4178 B12R1.78 C=Cc1ccc(cc1OC)C#N 271570a_100011290941_100012356288 [0,2,0,0,0,0|1,0,1]=4 4179 B12R1.78 C=Cc1ccc(cc1OC)C=O 271570a_100011290941_100010244714 [0,2,0,0,0,0|1,0,1]=4 4180 B12R1.78 C=Cc1ccc(cc1OC)CC 271570a_100011290941_200010710389 [0,2,0,0,0,0|1,0,0]=3 4181 B12R1.78 C=Cc1ccc(cc1OC)CO 271570a_100011290941_100010234685 [0,2,0,0,0,0|1,0,0]=3 4182 B12R1.78 C=Cc1ccc(cc1OC)OC 271570a_100011290941_100000750026 [0,2,0,0,0,0|1,0,0]=3 4183 B12R1.78 C=Cc1ccc(nc1CO)OC 271570a_100011290941_100010069746 [0,2,0,0,0,0|2,0,0]=4 4184 B12R1.78 C=Cc1ccc(nc1OC)OC 271570a_100011290941_100009816055 [0,2,0,0,0,0|2,0,0]=4 4185 B12R1.78 C=Cc1cnc(c(c1)OC)C=O 271570a_100011290941_100010246152 [0,2,0,0,0,0|1,0,1]=4 4186 B12R1.78 C=Cc1cnc(cc1CO)OC 271570a_100011290941_100012343675 [0,2,0,0,0,0|2,0,0]=4 4187 B12R1.78 C=Cc1cnc(cc1OC)CO 271570a_100011290941_100010999569 [0,2,0,0,0,0|2,0,0]=4 4188 B12R1.78 C=Cc1cnc(cc1OC)OC 271570a_100011290941_100010191559 [0,2,0,0,0,0|2,0,0]=4 4189 B12R1.78 C=Cc1nc(ccc1C=O)OC 271570a_100011290941_100012351648 [0,2,0,0,0,0|2,0,0]=4 4190 B12R1.78 CCc1cc(ccc1C=O)SC 62a_100010209654_200000210301 [0,2,0,0,0,0|1,0,0]=3 4191 B12R1.78 CCc1cc(ccc1C=O)SC 62a_200000210301_100010209654 [0,2,0,0,0,0|1,0,0]=3 4192 B12R1.78 CCc1cc(ccc1C=O)S[13CH3] 62a_100010209654_200025704644 [0,2,0,0,0,0|1,0,0]=3 4193 B12R1.78 CCc1cc(ccc1C=O)S[13CH3] 62a_200025704644_100010209654 [0,2,0,0,0,0|1,0,0]=3 4194 B12R1.78 CCc1ccc(c(c1)OC)OC 34a_100000186467_200000210301 [0,2,0,0,0,0|2,0,0]=4 4195 B12R1.78 CCc1ccc(c(c1)OC)OC 34a_100009844796_200000210301 [0,2,0,0,0,0|2,0,0]=4 4196 B12R1.78 CCc1ccc(c(c1)OC)OC 7a_100000186467_200000210301 [0,2,0,0,0,0|2,0,0]=4 4197 B12R1.78 CCc1ccc(c(c1)OC)OC 7a_100009844796_200000210301 [0,2,0,0,0,0|2,0,0]=4 4198 B12R1.78 CCc1ccc(c(c1)OC)O[13CH3] 34a_100000186467_200025704644 [0,2,0,0,0,0|2,0,0]=4 4199 B12R1.78 CCc1ccc(c(c1)OC)O[13CH3] 7a_100000186467_200025704644 [0,2,0,0,0,0|2,0,0]=4 4200 B12R1.78 CCc1ccc(c(c1)OC)SC 62a_200000210301_200010710389 [0,2,0,0,0,0|2,0,0]=4 4201 B12R1.78 CCc1ccc(c(c1)OC)SC 62a_200010710389_200000210301 [0,2,0,0,0,0|2,0,0]=4 4202 B12R1.78 CCc1ccc(c(c1)OC)S[13CH3] 62a_200010710389_200025704644 [0,2,0,0,0,0|2,0,0]=4 4203 B12R1.78 CCc1ccc(c(c1)OC)S[13CH3] 62a_200025704644_200010710389 [0,2,0,0,0,0|2,0,0]=4 4204 B12R1.78 CCc1ccc(c(c1)O[13CH3])OC 34a_100009844796_200025704644 [0,2,0,0,0,0|2,0,0]=4 4205 B12R1.78 CCc1ccc(c(c1)O[13CH3])OC 7a_100009844796_200025704644 [0,2,0,0,0,0|2,0,0]=4 4206 B12R1.78 CCc1ccc(cc1CO)SC 62a_100010766240_200000210301 [0,2,0,0,0,0|1,0,1]=4 4207 B12R1.78 CCc1ccc(cc1CO)SC 62a_200000210301_100010766240 [0,2,0,0,0,0|1,0,1]=4 4208 B12R1.78 CCc1ccc(cc1CO)S[13CH3] 62a_100010766240_200025704644 [0,2,0,0,0,0|1,0,1]=4 4209 B12R1.78 CCc1ccc(cc1CO)S[13CH3] 62a_200025704644_100010766240 [0,2,0,0,0,0|1,0,1]=4 4210 B12R1.78 CCc1ccc(cc1OC)SC 62a_200000210301_200010710398 [0,2,0,0,0,0|1,0,1]=4 4211 B12R1.78 CCc1ccc(cc1OC)SC 62a_200010710398_200000210301 [0,2,0,0,0,0|1,0,1]=4 4212 B12R1.78 CCc1ccc(cc1OC)S[13CH3] 62a_200010710398_200025704644 [0,2,0,0,0,0|1,0,1]=4 4213 B12R1.78 CCc1ccc(cc1OC)S[13CH3] 62a_200025704644_200010710398 [0,2,0,0,0,0|1,0,1]=4 4214 B12R1.78 CNc1ccc(c(c1)OC)C#N 34a_100011999456_200000210301 [0,2,0,0,0,0|1,0,1]=4 4215 B12R1.78 CNc1ccc(c(c1)OC)CO 34a_100012183141_200000210301 [0,2,0,0,0,0|0,0,2]=4 4216 B12R1.78 CNc1ccc(c(c1)OC)OC 34a_100000187404_200000210301 [0,2,0,0,0,0|2,0,0]=4 4217 B12R1.78 CNc1ccc(cc1CO)OC 34a_100012001277_200000210301 [0,2,0,0,0,0|2,0,0]=4 4218 B12R1.78 CNc1ccc(cc1OC)CO 2230a_100000087641_200000210301 [0,2,0,0,0,0|2,0,0]=4 4219 B12R1.78 CNc1ccc(cc1OC)CO 34a_100000087641_200000210301 [0,2,0,0,0,0|2,0,0]=4 4220 B12R1.78 CNc1ccc(cc1OC)OC 2230a_100000211191_200000210301 [0,2,0,0,0,0|2,0,0]=4 4221 B12R1.78 CNc1ccc(cc1OC)OC 34a_100000211191_200000210301 [0,2,0,0,0,0|2,0,0]=4 4222 B12R1.78 CNc1ccc(cc1OC)SC 2230a_100000766855_200000210301 [0,2,0,0,0,0|2,0,0]=4 4223 B12R1.78 CNc1ccc(cc1OC)SC 34a_100000766855_200000210301 [0,2,0,0,0,0|2,0,0]=4 4224 B12R1.78 COc1cc(ccc1C#N)N[13CH3] 34a_100011999456_200025704644 [0,2,0,0,0,0|1,0,1]=4 4225 B12R1.78 COc1cc(ccc1C#N)SC 62a_200000210301_100000694671 [0,2,0,0,0,0|1,0,1]=4 4226 B12R1.78 COc1cc(ccc1C#N)S[13CH3] 62a_200025704644_100000694671 [0,2,0,0,0,0|1,0,1]=4 4227 B12R1.78 COc1cc(ccc1C=O)SC 62a_100000697075_200000210301 [0,2,0,0,0,0|0,0,0]=2 4228 B12R1.78 COc1cc(ccc1C=O)SC 62a_200000210301_100010290300 [0,2,0,0,0,0|0,0,0]=2 4229 B12R1.78 COc1cc(ccc1C=O)S[13CH3] 62a_100000697075_200025704644 [0,2,0,0,0,0|0,0,0]=2 4230 B12R1.78 COc1cc(ccc1C=O)S[13CH3] 62a_200025704644_100010290300 [0,2,0,0,0,0|0,0,0]=2 4231 B12R1.78 COc1cc(ccc1CO)CO 34a_200010669990_200000210301 [0,2,0,0,0,0|0,0,2]=4 4232 B12R1.78 COc1cc(ccc1CO)N[13CH3] 34a_100012183141_200025704644 [0,2,0,0,0,0|0,0,2]=4 4233 B12R1.78 COc1cc(ccc1CO)O[13CH3] 34a_200000116926_200025704644 [0,2,0,0,0,0|0,0,2]=4 4234 B12R1.78 COc1cc(ccc1CO)SC 62a_100011277633_200000210301 [0,2,0,0,0,0|0,0,2]=4 4235 B12R1.78 COc1cc(ccc1CO)SC 62a_200000210301_100011277633 [0,2,0,0,0,0|0,0,2]=4 4236 B12R1.78 COc1cc(ccc1CO)S[13CH3] 62a_100011277633_200025704644 [0,2,0,0,0,0|0,0,2]=4 4237 B12R1.78 COc1cc(ccc1CO)S[13CH3] 62a_200025704644_100011277633 [0,2,0,0,0,0|0,0,2]=4 4238 B12R1.78 COc1cc(ccc1N[13CH3])CO 2230a_100000087641_200025704644 [0,2,0,0,0,0|2,0,0]=4 4239 B12R1.78 COc1cc(ccc1N[13CH3])CO 34a_100000087641_200025704644 [0,2,0,0,0,0|2,0,0]=4 4240 B12R1.78 COc1cc(ccc1N[13CH3])SC 2230a_100000766855_200025704644 [0,2,0,0,0,0|2,0,0]=4 4241 B12R1.78 COc1cc(ccc1N[13CH3])SC 34a_100000766855_200025704644 [0,2,0,0,0,0|2,0,0]=4 4242 B12R1.78 COc1cc(ccc1O[13CH3])CN 34a_100000185554_200025704644 [0,2,0,0,0,0|2,0,0]=4 4243 B12R1.78 COc1cc(ccc1SC)CO 62a_100010234685_200000210301 [0,2,0,0,0,0|2,0,0]=4 4244 B12R1.78 COc1cc(ccc1SC)CO 62a_200000210301_100010234685 [0,2,0,0,0,0|2,0,0]=4 4245 B12R1.78 COc1cc(ccc1SC)SC 62a_200011001119_200000210301 [0,2,0,0,0,0|2,0,0]=4 4246 B12R1.78 COc1cc(ccc1SC)S[13CH3] 62a_200011001119_200025704644 [0,2,0,0,0,0|2,0,0]=4 4247 B12R1.78 COc1cc(ccc1S[13CH3])CO 62a_100010234685_200025704644 [0,2,0,0,0,0|2,0,0]=4 4248 B12R1.78 COc1cc(ccc1S[13CH3])CO 62a_200025704644_100010234685 [0,2,0,0,0,0|2,0,0]=4 4249 B12R1.78 COc1cc(cnc1C=O)SC 62a_100010246152_200000210301 [0,2,0,0,0,0|1,0,0]=3 4250 B12R1.78 COc1cc(cnc1C=O)SC 62a_200000210301_100010246152 [0,2,0,0,0,0|1,0,0]=3 4251 B12R1.78 COc1cc(cnc1C=O)S[13CH3] 62a_100010246152_200025704644 [0,2,0,0,0,0|1,0,0]=3 4252 B12R1.78 COc1cc(cnc1C=O)S[13CH3] 62a_200025704644_100010246152 [0,2,0,0,0,0|1,0,0]=3 4253 B12R1.78 COc1cc(ncc1C=O)SC 62a_100009846838_200000210301 [0,2,0,0,0,0|1,0,0]=3 4254 B12R1.78 COc1cc(ncc1C=O)SC 62a_200000210301_100009846838 [0,2,0,0,0,0|1,0,0]=3 4255 B12R1.78 COc1cc(ncc1C=O)S[13CH3] 62a_100009846838_200025704644 [0,2,0,0,0,0|1,0,0]=3 4256 B12R1.78 COc1cc(ncc1C=O)S[13CH3] 62a_200025704644_100009846838 [0,2,0,0,0,0|1,0,0]=3 4257 B12R1.78 COc1ccc(c(c1)CO)N[13CH3] 34a_100012001277_200025704644 [0,2,0,0,0,0|2,0,0]=4 4258 B12R1.78 COc1ccc(c(c1)CO)SC 62a_200000210301_200011273942 [0,2,0,0,0,0|2,0,0]=4 4259 B12R1.78 COc1ccc(c(c1)CO)SC 62a_200011273942_200000210301 [0,2,0,0,0,0|2,0,0]=4 4260 B12R1.78 COc1ccc(c(c1)CO)S[13CH3] 62a_200011273942_200025704644 [0,2,0,0,0,0|2,0,0]=4 4261 B12R1.78 COc1ccc(c(c1)CO)S[13CH3] 62a_200025704644_200011273942 [0,2,0,0,0,0|2,0,0]=4 4262 B12R1.78 COc1ccc(c(c1)OC)C#N 34a_100011999188_200000210301 [0,2,0,0,0,0|1,0,1]=4 4263 B12R1.78 COc1ccc(c(c1)OC)C#N 7a_100011999188_200000210301 [0,2,0,0,0,0|1,0,1]=4 4264 B12R1.78 COc1ccc(c(c1)OC)CO 34a_200000116926_200000210301 [0,2,0,0,0,0|0,0,2]=4 4265 B12R1.78 COc1ccc(c(c1)OC)N=O 34a_200010658452_200000210301 [0,2,0,0,0,0|1,0,0]=3 4266 B12R1.78 COc1ccc(c(c1)OC)N=O 7a_200010658452_200000210301 [0,2,0,0,0,0|1,0,0]=3 4267 B12R1.78 COc1ccc(c(c1)OC)N[13CH3] 2230a_100000211191_200025704644 [0,2,0,0,0,0|2,0,0]=4 4268 B12R1.78 COc1ccc(c(c1)OC)N[13CH3] 34a_100000211191_200025704644 [0,2,0,0,0,0|2,0,0]=4 4269 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100000039706_200000210301 [0,2,0,0,0,0|2,0,0]=4 4270 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100000074795_200000210301 [0,2,0,0,0,0|2,0,0]=4 4271 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100009840267_200000210301 [0,2,0,0,0,0|2,0,0]=4 4272 B12R1.78 COc1ccc(c(c1)OC)O[13CH3] 34a_100009840267_200025704644 [0,2,0,0,0,0|2,0,0]=4 4273 B12R1.78 COc1ccc(c(c1)OC)SC 62a_100000750026_200000210301 [0,2,0,0,0,0|2,0,0]=4 4274 B12R1.78 COc1ccc(c(c1)OC)SC 62a_200000210301_100000750026 [0,2,0,0,0,0|2,0,0]=4 4275 B12R1.78 COc1ccc(c(c1)OC)S[13CH3] 62a_100000750026_200025704644 [0,2,0,0,0,0|2,0,0]=4 4276 B12R1.78 COc1ccc(c(c1)OC)S[13CH3] 62a_200025704644_100000750026 [0,2,0,0,0,0|2,0,0]=4 4277 B12R1.78 COc1ccc(c(c1)O[13CH3])C#N 34a_100011999188_200025704644 [0,2,0,0,0,0|1,0,1]=4 4278 B12R1.78 COc1ccc(c(c1)O[13CH3])C#N 7a_100011999188_200025704644 [0,2,0,0,0,0|1,0,1]=4 4279 B12R1.78 COc1ccc(c(c1)O[13CH3])N=O 34a_200010658452_200025704644 [0,2,0,0,0,0|1,0,0]=3 4280 B12R1.78 COc1ccc(c(c1)O[13CH3])N=O 7a_200010658452_200025704644 [0,2,0,0,0,0|1,0,0]=3 4281 B12R1.78 COc1ccc(c(c1)O[13CH3])OC 34a_100000074795_200025704644 [0,2,0,0,0,0|2,0,0]=4 4282 B12R1.78 COc1ccc(c(c1)SC)C=O 62a_100000723261_200000210301 [0,2,0,0,0,0|0,1,0]=3 4283 B12R1.78 COc1ccc(c(c1)SC)C=O 62a_200000210301_100000723261 [0,2,0,0,0,0|0,1,0]=3 4284 B12R1.78 COc1ccc(c(c1)S[13CH3])C=O 62a_100000723261_200025704644 [0,2,0,0,0,0|0,1,0]=3 4285 B12R1.78 COc1ccc(c(c1)S[13CH3])C=O 62a_200025704644_100000723261 [0,2,0,0,0,0|0,1,0]=3 4286 B12R1.78 COc1ccc(c(n1)SC)C=O 62a_100012351648_200000210301 [0,2,0,0,0,0|1,1,0]=4 4287 B12R1.78 COc1ccc(c(n1)SC)C=O 62a_200000210301_100012351648 [0,2,0,0,0,0|1,1,0]=4 4288 B12R1.78 COc1ccc(c(n1)S[13CH3])C=O 62a_100012351648_200025704644 [0,2,0,0,0,0|1,1,0]=4 4289 B12R1.78 COc1ccc(c(n1)S[13CH3])C=O 62a_200025704644_100012351648 [0,2,0,0,0,0|1,1,0]=4 4290 B12R1.78 COc1ccc(cc1CO)SC 62a_100000204679_200000210301 [0,2,0,0,0,0|2,0,0]=4 4291 B12R1.78 COc1ccc(cc1CO)SC 62a_200000210301_100000204679 [0,2,0,0,0,0|2,0,0]=4 4292 B12R1.78 COc1ccc(cc1CO)S[13CH3] 62a_100000204679_200025704644 [0,2,0,0,0,0|2,0,0]=4 4293 B12R1.78 COc1ccc(cc1CO)S[13CH3] 62a_200025704644_100000204679 [0,2,0,0,0,0|2,0,0]=4 4294 B12R1.78 COc1ccc(cc1OC)CN 34a_100000185554_200000210301 [0,2,0,0,0,0|2,0,0]=4 4295 B12R1.78 COc1ccc(cc1OC)CN 34a_100000740000_200000210301 [0,2,0,0,0,0|2,0,0]=4 4296 B12R1.78 COc1ccc(cc1OC)CO 34a_100011215239_200000210301 [0,2,0,0,0,0|2,0,0]=4 4297 B12R1.78 COc1ccc(cc1OC)N[13CH3] 34a_100000187404_200025704644 [0,2,0,0,0,0|2,0,0]=4 4298 B12R1.78 COc1ccc(cc1OC)O[13CH3] 34a_100000039706_200025704644 [0,2,0,0,0,0|2,0,0]=4 4299 B12R1.78 COc1ccc(cc1OC)SC 62a_200000210301_100011356967 [0,2,0,0,0,0|2,0,0]=4 4300 B12R1.78 COc1ccc(cc1OC)S[13CH3] 62a_200025704644_100011356967 [0,2,0,0,0,0|2,0,0]=4 4301 B12R1.78 COc1ccc(cc1O[13CH3])CN 34a_100000740000_200025704644 [0,2,0,0,0,0|2,0,0]=4 4302 B12R1.78 COc1ccc(cc1O[13CH3])CO 34a_100011215239_200025704644 [0,2,0,0,0,0|2,0,0]=4 4303 B12R1.78 COc1cnc(c(c1)SC)C=O 62a_200000210301_200010135874 [0,2,0,0,0,0|1,1,0]=4 4304 B12R1.78 COc1cnc(c(c1)SC)C=O 62a_200010135874_200000210301 [0,2,0,0,0,0|1,1,0]=4 4305 B12R1.78 COc1cnc(c(c1)S[13CH3])C=O 62a_200010135874_200025704644 [0,2,0,0,0,0|1,1,0]=4 4306 B12R1.78 COc1cnc(c(c1)S[13CH3])C=O 62a_200025704644_200010135874 [0,2,0,0,0,0|1,1,0]=4 4307 B12R1.78 COc1nc(ccc1C=O)SC 62a_100009864722_200000210301 [0,2,0,0,0,0|1,0,0]=3 4308 B12R1.78 COc1nc(ccc1C=O)SC 62a_200000210301_100009864722 [0,2,0,0,0,0|1,0,0]=3 4309 B12R1.78 COc1nc(ccc1C=O)S[13CH3] 62a_100009864722_200025704644 [0,2,0,0,0,0|1,0,0]=3 4310 B12R1.78 COc1nc(ccc1C=O)S[13CH3] 62a_200025704644_100009864722 [0,2,0,0,0,0|1,0,0]=3 4311 B12R1.78 CSc1cc(ccc1C=O)C#N 62a_200000210301_100012355658 [0,2,0,0,0,0|0,1,1]=4 4312 B12R1.78 CSc1cc(ccc1C=O)C=O 62a_100015597013_200000210301 [0,2,0,0,0,0|0,1,1]=4 4313 B12R1.78 CSc1cc(ccc1C=O)C=O 62a_200000210301_100015597013 [0,2,0,0,0,0|0,1,1]=4 4314 B12R1.78 CSc1ccc(c(c1)C#N)C=O 62a_200000210301_100012001787 [0,2,0,0,0,0|1,0,0]=3 4315 B12R1.78 CSc1ccc(c(c1)C=O)C=O 62a_200010077131_200000210301 [0,2,0,0,0,0|0,0,1]=3 4316 B12R1.78 CSc1ccc(c(c1)CO)CO 62a_100000719600_200000210301 [0,2,0,0,0,0|0,0,2]=4 4317 B12R1.78 CSc1ccc(c(c1)CO)CO 62a_200000210301_100000719600 [0,2,0,0,0,0|0,0,2]=4 4318 B12R1.78 [13CH3]Oc1cc(ccc1CO)CO 34a_200010669990_200025704644 [0,2,0,0,0,0|0,0,2]=4 4319 B12R1.78 [13CH3]Sc1cc(ccc1C=O)C#N 62a_200025704644_100012355658 [0,2,0,0,0,0|0,1,1]=4 4320 B12R1.78 [13CH3]Sc1cc(ccc1C=O)C=O 62a_100015597013_200025704644 [0,2,0,0,0,0|0,1,1]=4 4321 B12R1.78 [13CH3]Sc1cc(ccc1C=O)C=O 62a_200025704644_100015597013 [0,2,0,0,0,0|0,1,1]=4 4322 B12R1.78 [13CH3]Sc1ccc(c(c1)C#N)C=O 62a_200025704644_100012001787 [0,2,0,0,0,0|1,0,0]=3 4323 B12R1.78 [13CH3]Sc1ccc(c(c1)C=O)C=O 62a_200010077131_200025704644 [0,2,0,0,0,0|0,0,1]=3 4324 B12R1.78 [13CH3]Sc1ccc(c(c1)CO)CO 62a_100000719600_200025704644 [0,2,0,0,0,0|0,0,2]=4 4325 B12R1.78 [13CH3]Sc1ccc(c(c1)CO)CO 62a_200025704644_100000719600 [0,2,0,0,0,0|0,0,2]=4 4326 B12R1.112 C=C=Cc1ccc(cc1C#N)C 271570a_100015277604_100011935190 [0,2,0,0,0,0|2,0,0]=4 4327 B12R1.112 C=C=Cc1ccc(cc1C=O)C 271570a_100015277604_100011551863 [0,2,0,0,0,0|1,0,1]=4 4328 B12R1.112 C=C=Cc1ccc(cc1CO)Br 271570a_100015277604_100011356890 [0,2,0,0,0,0|2,0,0]=4 4329 B12R1.112 C=C=Cc1ccc(cc1CO)C 271570a_100015277604_100012361352 [0,2,0,0,0,0|1,0,0]=3 4330 B12R1.112 C=C=Cc1ccc(cc1CO)F 271570a_100015277604_100011217561 [0,2,0,0,0,0|2,0,0]=4 4331 B12R1.112 C=C=Cc1ccc(cc1CO)N 271570a_100015277604_100012347228 [0,2,0,0,0,0|2,0,0]=4 4332 B12R1.112 C=C=Cc1ccc(cc1CO)O 271570a_100015277604_100012351483 [0,2,0,0,0,0|2,0,0]=4 4333 B12R1.112 C=C=Cc1ccc(cc1OC)Br 271570a_100015277604_100010245111 [0,2,0,0,0,0|2,0,0]=4 4334 B12R1.112 C=C=Cc1ccc(cc1OC)C 271570a_100015277604_100010200004 [0,2,0,0,0,0|1,0,0]=3 4335 B12R1.112 C=C=Cc1ccc(cc1OC)Cl 271570a_100015277604_100000050115 [0,2,0,0,0,0|2,0,0]=4 4336 B12R1.112 C=C=Cc1ccc(cc1OC)F 271570a_100015277604_100000757151 [0,2,0,0,0,0|2,0,0]=4 4337 B12R1.112 C=C=Cc1ccc(cc1OC)N 271570a_100015277604_100000765947 [0,2,0,0,0,0|2,0,0]=4 4338 B12R1.112 C=C=Cc1ccc(cc1OC)O 271570a_100015277604_100011827694 [0,2,0,0,0,0|2,0,0]=4 4339 B12R1.112 C=C=Cc1ccc(cc1SC)C 271570a_100015277604_200010709736 [0,2,0,0,0,0|1,1,0]=4 4340 B12R1.112 C=C=Cc1ccc(nc1CO)C 271570a_100015277604_100010074375 [0,2,0,0,0,0|2,0,0]=4 4341 B12R1.112 C=C=Cc1ccc(nc1OC)C 271570a_100015277604_100010138632 [0,2,0,0,0,0|2,0,0]=4 4342 B12R1.112 C=C=Cc1cnc(cc1CO)C 271570a_100015277604_100015579599 [0,2,0,0,0,0|2,0,0]=4 4343 B12R1.112 C=C=Cc1cnc(cc1OC)C 271570a_100015277604_100000717771 [0,2,0,0,0,0|2,0,0]=4 4344 B12R1.112 C=C=Cc1ncc(cc1CO)C 271570a_100015277604_100000118064 [0,2,0,0,0,0|2,0,0]=4 4345 B12R1.112 C=C=Cc1ncc(cc1OC)C 271570a_100015277604_200000118316 [0,2,0,0,0,0|2,0,0]=4 4346 B12R1.112 CC=Cc1ccc(cc1C#N)C 271570a_100016259895_100011935190 [0,2,0,0,0,0|2,0,0]=4 4347 B12R1.112 CC=Cc1ccc(cc1C=O)C 271570a_100016259895_100011551863 [0,2,0,0,0,0|1,0,1]=4 4348 B12R1.112 CC=Cc1ccc(cc1CO)Br 271570a_100016259895_100011356890 [0,2,0,0,0,0|2,0,0]=4 4349 B12R1.112 CC=Cc1ccc(cc1CO)C 271570a_100016259895_100012361352 [0,2,0,0,0,0|1,0,0]=3 4350 B12R1.112 CC=Cc1ccc(cc1CO)F 271570a_100016259895_100011217561 [0,2,0,0,0,0|2,0,0]=4 4351 B12R1.112 CC=Cc1ccc(cc1CO)N 271570a_100016259895_100012347228 [0,2,0,0,0,0|2,0,0]=4 4352 B12R1.112 CC=Cc1ccc(cc1CO)O 271570a_100016259895_100012351483 [0,2,0,0,0,0|2,0,0]=4 4353 B12R1.112 CC=Cc1ccc(cc1OC)Br 271570a_100016259895_100010245111 [0,2,0,0,0,0|2,0,0]=4 4354 B12R1.112 CC=Cc1ccc(cc1OC)C 271570a_100016259895_100010200004 [0,2,0,0,0,0|1,0,0]=3 4355 B12R1.112 CC=Cc1ccc(cc1OC)Cl 271570a_100016259895_100000050115 [0,2,0,0,0,0|2,0,0]=4 4356 B12R1.112 CC=Cc1ccc(cc1OC)F 271570a_100016259895_100000757151 [0,2,0,0,0,0|2,0,0]=4 4357 B12R1.112 CC=Cc1ccc(cc1OC)N 271570a_100016259895_100000765947 [0,2,0,0,0,0|2,0,0]=4 4358 B12R1.112 CC=Cc1ccc(cc1OC)O 271570a_100016259895_100011827694 [0,2,0,0,0,0|2,0,0]=4 4359 B12R1.112 CC=Cc1ccc(cc1SC)C 271570a_100016259895_200010709736 [0,2,0,0,0,0|1,1,0]=4 4360 B12R1.112 CC=Cc1ccc(nc1CO)C 271570a_100016259895_100010074375 [0,2,0,0,0,0|2,0,0]=4 4361 B12R1.112 CC=Cc1ccc(nc1OC)C 271570a_100016259895_100010138632 [0,2,0,0,0,0|2,0,0]=4 4362 B12R1.112 CC=Cc1cnc(cc1CO)C 271570a_100016259895_100015579599 [0,2,0,0,0,0|2,0,0]=4 4363 B12R1.112 CC=Cc1cnc(cc1OC)C 271570a_100016259895_100000717771 [0,2,0,0,0,0|2,0,0]=4 4364 B12R1.112 CC=Cc1ncc(cc1CO)C 271570a_100016259895_100000118064 [0,2,0,0,0,0|2,0,0]=4 4365 B12R1.112 CC=Cc1ncc(cc1OC)C 271570a_100016259895_200000118316 [0,2,0,0,0,0|2,0,0]=4 4366 B12R1.112 CCNc1ccc(cc1CO)C 34a_100011215565_100000210202 [0,2,0,0,0,0|1,0,1]=4 4367 B12R1.112 CCNc1ccc(cc1OC)C 2230a_100000746441_100000210202 [0,2,0,0,0,0|1,0,1]=4 4368 B12R1.112 CCNc1ccc(cc1OC)C 34a_100000746441_100000210202 [0,2,0,0,0,0|1,0,1]=4 4369 B12R1.112 CCOc1ccc(cc1CO)C 34a_200011846009_100000210202 [0,2,0,0,0,0|1,0,1]=4 4370 B12R1.112 CCOc1ccc(cc1CO)C 7a_200011846009_100000210202 [0,2,0,0,0,0|1,0,1]=4 4371 B12R1.112 CCOc1ccc(cc1OC)C 34a_100000186466_100000210202 [0,2,0,0,0,0|1,0,1]=4 4372 B12R1.112 CCSc1ccc(cc1CO)C 62a_100000210202_100012361352 [0,2,0,0,0,0|1,0,1]=4 4373 B12R1.112 CCSc1ccc(cc1CO)C 62a_100012361352_100000210202 [0,2,0,0,0,0|1,0,1]=4 4374 B12R1.112 CCSc1ccc(cc1OC)C 62a_100000210202_100010200004 [0,2,0,0,0,0|1,0,1]=4 4375 B12R1.112 CCSc1ccc(cc1OC)C 62a_100010200004_100000210202 [0,2,0,0,0,0|1,0,1]=4 4376 B12R1.112 CNCc1ccc(cc1OC)C 207a_100102657272_100000689369 [0,2,0,0,0,0|1,0,1]=4 4377 B12R1.112 CNCc1ccc(cc1OC)C 270004a_106832991635_100000689369 [0,2,0,0,0,0|1,0,1]=4 4378 B12R1.112 COCc1ccc(cc1OC)C 34a_200012017176_200000210301 [0,2,0,0,0,0|0,0,2]=4 4379 B12R1.112 COCc1ccc(cc1OC)C 7a_200012017176_200000210301 [0,2,0,0,0,0|0,0,2]=4 4380 B12R1.112 COc1cc(ccc1CO[13CH3])C 34a_200012017176_200025704644 [0,2,0,0,0,0|0,0,2]=4 4381 B12R1.112 COc1cc(ccc1CO[13CH3])C 7a_200012017176_200025704644 [0,2,0,0,0,0|0,0,2]=4 4382 B12R1.112 COc1cc(ccc1NCF)C 34a_100000746441_100015361967 [0,2,0,0,0,0|1,0,1]=4 4383 B12R1.112 COc1cc(ccc1OCF)C 34a_100000186466_100015361967 [0,2,0,0,0,0|1,0,1]=4 4384 B12R1.112 COc1cc(ccc1SCF)C 62a_100010200004_100015361967 [0,2,0,0,0,0|1,0,1]=4 4385 B12R1.112 COc1cc(ccc1SCF)C 62a_100015361967_100010200004 [0,2,0,0,0,0|1,0,1]=4 4386 B12R1.112 Cc1ccc(c(c1)CO)NCF 34a_100011215565_100015361967 [0,2,0,0,0,0|1,0,1]=4 4387 B12R1.112 Cc1ccc(c(c1)CO)OCF 34a_200011846009_100015361967 [0,2,0,0,0,0|1,0,1]=4 4388 B12R1.112 Cc1ccc(c(c1)CO)OCF 7a_200011846009_100015361967 [0,2,0,0,0,0|1,0,1]=4 4389 B12R1.112 Cc1ccc(c(c1)CO)SCF 62a_100012361352_100015361967 [0,2,0,0,0,0|1,0,1]=4 4390 B12R1.112 Cc1ccc(c(c1)CO)SCF 62a_100015361967_100012361352 [0,2,0,0,0,0|1,0,1]=4 4391 B12R1.234 C=Cc1c(cc(cc1OC)Br)F 271570a_100011290941_100010713143 [0,2,0,0,0,0|2,0,0]=4 4392 B12R1.234 C=Cc1c(cc(cc1OC)Cl)Br 271570a_100011290941_100025705407 [0,2,0,0,0,0|2,0,0]=4 4393 B12R1.234 C=Cc1c(cc(cc1OC)Cl)Cl 271570a_100011290941_100010292537 [0,2,0,0,0,0|2,0,0]=4 4394 B12R1.234 C=Cc1cc(cc(c1C=O)C)F 271570a_100011290941_200015781908 [0,2,0,0,0,0|2,0,0]=4 4395 B12R1.234 C=Cc1cc(cc(c1C=O)F)C 271570a_100011290941_100010341274 [0,2,0,0,0,0|1,0,0]=3 4396 B12R1.234 C=Cc1cc(cc(c1C=O)F)F 271570a_100011290941_100010009843 [0,2,0,0,0,0|2,0,0]=4 4397 B12R1.234 COc1c(cc(cc1C=O)C)O 271570a_203496583355_200010171662 [0,2,0,0,0,0|2,0,0]=4 4398 B12R1.234 COc1cc(cc(c1C#N)C)C 34a_100010659394_200000210301 [0,2,0,0,0,0|1,0,1]=4 4399 B12R1.234 COc1cc(cc(c1C#N)C)C 7a_100010659394_200000210301 [0,2,0,0,0,0|1,0,1]=4 4400 B12R1.234 COc1cc(cc(c1C=O)F)O 271570a_203496583355_100010363811 [0,2,0,0,0,0|1,0,0]=3 4401 B12R1.234 CSc1cc(cc(c1C=O)C)F 62a_200000210301_200015781908 [0,2,0,0,0,0|1,1,0]=4 4402 B12R1.234 CSc1cc(cc(c1C=O)C)F 62a_200015781908_200000210301 [0,2,0,0,0,0|1,1,0]=4 4403 B12R1.234 CSc1cc(cc(c1C=O)F)C 62a_100010341274_200000210301 [0,2,0,0,0,0|0,1,0]=3 4404 B12R1.234 CSc1cc(cc(c1C=O)F)C 62a_200000210301_100010341274 [0,2,0,0,0,0|0,1,0]=3 4405 B12R1.234 CSc1cc(cc(c1C=O)F)F 62a_100010009843_200000210301 [0,2,0,0,0,0|1,1,0]=4 4406 B12R1.234 CSc1cc(cc(c1C=O)F)F 62a_200000210301_100010009843 [0,2,0,0,0,0|1,1,0]=4 4407 B12R1.234 Cc1cc(c(c(c1)O[13CH3])C#N)C 34a_100010659394_200025704644 [0,2,0,0,0,0|1,0,1]=4 4408 B12R1.234 Cc1cc(c(c(c1)O[13CH3])C#N)C 7a_100010659394_200025704644 [0,2,0,0,0,0|1,0,1]=4 4409 B12R1.234 Cc1cc(c(c(c1)S[13CH3])C=O)F 62a_100010341274_200025704644 [0,2,0,0,0,0|0,1,0]=3 4410 B12R1.234 Cc1cc(c(c(c1)S[13CH3])C=O)F 62a_200025704644_100010341274 [0,2,0,0,0,0|0,1,0]=3 4411 B12R1.234 Cc1cc(cc(c1C=O)S[13CH3])F 62a_200015781908_200025704644 [0,2,0,0,0,0|1,1,0]=4 4412 B12R1.234 Cc1cc(cc(c1C=O)S[13CH3])F 62a_200025704644_200015781908 [0,2,0,0,0,0|1,1,0]=4 4413 B12R1.234 [13CH3]Sc1cc(cc(c1C=O)F)F 62a_100010009843_200025704644 [0,2,0,0,0,0|1,1,0]=4 4414 B12R1.234 [13CH3]Sc1cc(cc(c1C=O)F)F 62a_200025704644_100010009843 [0,2,0,0,0,0|1,1,0]=4 4415 B12R1.268 C=C=Cc1cc(ccc1C=O)Br 271570a_100015277604_100010146562 [0,2,0,0,0,0|2,0,0]=4 4416 B12R1.268 C=C=Cc1cc(ccc1C=O)C 271570a_100015277604_100000692596 [0,2,0,0,0,0|1,0,0]=3 4417 B12R1.268 C=C=Cc1cc(ccc1C=O)F 271570a_100015277604_100000752949 [0,2,0,0,0,0|2,0,0]=4 4418 B12R1.268 C=C=Cc1cc(ccc1C=O)O 271570a_100015277604_100011236494 [0,2,0,0,0,0|2,0,0]=4 4419 B12R1.268 C=C=Cc1nc(ccc1C=O)C 271570a_100015277604_100000085379 [0,2,0,0,0,0|2,0,0]=4 4420 B12R1.268 C=Cc1ccc(cc1CC#N)C 271570a_100011290941_100010147026 [0,2,0,0,0,0|2,0,0]=4 4421 B12R1.268 C=Cc1ccc(cc1OCC)C 271570a_100011290941_200010713166 [0,2,0,0,0,0|1,0,0]=3 4422 B12R1.268 C=Cc1ccc(cc1OCC)F 271570a_100011290941_200012340411 [0,2,0,0,0,0|2,0,0]=4 4423 B12R1.268 C=Cc1ccc(cc1OCC)N 271570a_100011290941_200016990551 [0,2,0,0,0,0|2,0,0]=4 4424 B12R1.268 CC=Cc1cc(ccc1C=O)Br 271570a_100016259895_100010146562 [0,2,0,0,0,0|2,0,0]=4 4425 B12R1.268 CC=Cc1cc(ccc1C=O)C 271570a_100016259895_100000692596 [0,2,0,0,0,0|1,0,0]=3 4426 B12R1.268 CC=Cc1cc(ccc1C=O)F 271570a_100016259895_100000752949 [0,2,0,0,0,0|2,0,0]=4 4427 B12R1.268 CC=Cc1cc(ccc1C=O)O 271570a_100016259895_100011236494 [0,2,0,0,0,0|2,0,0]=4 4428 B12R1.268 CC=Cc1nc(ccc1C=O)C 271570a_100016259895_100000085379 [0,2,0,0,0,0|2,0,0]=4 4429 B12R1.268 CCOc1cc(ccc1C#N)C 34a_100011640519_100000210202 [0,2,0,0,0,0|1,0,1]=4 4430 B12R1.268 CCOc1cc(ccc1C#N)C 7a_100011640519_100000210202 [0,2,0,0,0,0|1,0,1]=4 4431 B12R1.268 CCOc1cc(ccc1NC)C 2230a_100000742043_200000210301 [0,2,0,0,0,0|2,0,0]=4 4432 B12R1.268 CCOc1cc(ccc1NC)C 34a_100000742043_200000210301 [0,2,0,0,0,0|2,0,0]=4 4433 B12R1.268 CCOc1cc(ccc1N[13CH3])C 2230a_100000742043_200025704644 [0,2,0,0,0,0|2,0,0]=4 4434 B12R1.268 CCOc1cc(ccc1N[13CH3])C 34a_100000742043_200025704644 [0,2,0,0,0,0|2,0,0]=4 4435 B12R1.268 CCOc1cc(ccc1OC)C 34a_100011216497_100000210202 [0,2,0,0,0,0|2,0,0]=4 4436 B12R1.268 CCOc1cc(ccc1OC)C 34a_200000034294_200000210301 [0,2,0,0,0,0|2,0,0]=4 4437 B12R1.268 CCOc1cc(ccc1OC)C 7a_100011216497_100000210202 [0,2,0,0,0,0|2,0,0]=4 4438 B12R1.268 CCOc1cc(ccc1OC)C 7a_200000034294_200000210301 [0,2,0,0,0,0|2,0,0]=4 4439 B12R1.268 CCOc1cc(ccc1O[13CH3])C 34a_200000034294_200025704644 [0,2,0,0,0,0|2,0,0]=4 4440 B12R1.268 CCOc1cc(ccc1O[13CH3])C 7a_200000034294_200025704644 [0,2,0,0,0,0|2,0,0]=4 4441 B12R1.268 CCOc1cc(ccc1SC)C 62a_200000210301_200010713166 [0,2,0,0,0,0|2,0,0]=4 4442 B12R1.268 CCOc1cc(ccc1SC)C 62a_200010713166_200000210301 [0,2,0,0,0,0|2,0,0]=4 4443 B12R1.268 CCOc1cc(ccc1S[13CH3])C 62a_200010713166_200025704644 [0,2,0,0,0,0|2,0,0]=4 4444 B12R1.268 CCOc1cc(ccc1S[13CH3])C 62a_200025704644_200010713166 [0,2,0,0,0,0|2,0,0]=4 4445 B12R1.268 CCSc1cc(ccc1C=O)Br 62a_100000210202_100010146562 [0,2,0,0,0,0|1,1,0]=4 4446 B12R1.268 CCSc1cc(ccc1C=O)Br 62a_100010146562_100000210202 [0,2,0,0,0,0|1,1,0]=4 4447 B12R1.268 CCSc1cc(ccc1C=O)C 62a_100000210202_100011935181 [0,2,0,0,0,0|0,1,0]=3 4448 B12R1.268 CCSc1cc(ccc1C=O)C 62a_100011935181_100000210202 [0,2,0,0,0,0|0,1,0]=3 4449 B12R1.268 CCSc1cc(ccc1C=O)F 62a_100000210202_100000752949 [0,2,0,0,0,0|1,1,0]=4 4450 B12R1.268 CCSc1cc(ccc1C=O)F 62a_100000752949_100000210202 [0,2,0,0,0,0|1,1,0]=4 4451 B12R1.268 CCSc1cc(ccc1C=O)O 62a_100000210202_100011236494 [0,2,0,0,0,0|1,1,0]=4 4452 B12R1.268 CCSc1cc(ccc1C=O)O 62a_100011236494_100000210202 [0,2,0,0,0,0|1,1,0]=4 4453 B12R1.268 CCSc1nc(ccc1C=O)C 62a_100000085379_100000210202 [0,2,0,0,0,0|1,1,0]=4 4454 B12R1.268 CCSc1nc(ccc1C=O)C 62a_100000210202_100000085379 [0,2,0,0,0,0|1,1,0]=4 4455 B12R1.268 CNCc1cc(ccc1C=O)F 2230a_106832991635_100010132768 [0,2,0,0,0,0|2,0,0]=4 4456 B12R1.268 CNCc1cc(ccc1C=O)F 34a_100102657272_100010132768 [0,2,0,0,0,0|2,0,0]=4 4457 B12R1.268 CNCc1cc(ccc1C=O)F 7a_106832991635_100010132768 [0,2,0,0,0,0|2,0,0]=4 4458 B12R1.268 COCc1cc(ccc1C=O)F 34a_100138415774_100010132768 [0,2,0,0,0,0|1,0,0]=3 4459 B12R1.268 COCc1cc(ccc1OC)C 34a_100138415774_100000199068 [0,2,0,0,0,0|2,0,0]=4 4460 B12R1.268 COCc1cc(ccc1OC)C 34a_200000246444_200000210301 [0,2,0,0,0,0|2,0,0]=4 4461 B12R1.268 COCc1cc(ccc1OC)C 7a_200000246444_200000210301 [0,2,0,0,0,0|2,0,0]=4 4462 B12R1.268 COc1ccc(cc1CO[13CH3])C 34a_200000246444_200025704644 [0,2,0,0,0,0|2,0,0]=4 4463 B12R1.268 COc1ccc(cc1CO[13CH3])C 7a_200000246444_200025704644 [0,2,0,0,0,0|2,0,0]=4 4464 B12R1.268 COc1ccc(cc1OCF)C 34a_100011216497_100015361967 [0,2,0,0,0,0|2,0,0]=4 4465 B12R1.268 COc1ccc(cc1OCF)C 7a_100011216497_100015361967 [0,2,0,0,0,0|2,0,0]=4 4466 B12R1.268 CSCc1cc(ccc1C=O)F 62a_100010132768_200000210301 [0,2,0,0,0,0|1,1,0]=4 4467 B12R1.268 CSCc1cc(ccc1C=O)F 62a_200000210301_100010132768 [0,2,0,0,0,0|1,1,0]=4 4468 B12R1.268 Cc1ccc(c(c1)OCF)C#N 34a_100011640519_100015361967 [0,2,0,0,0,0|1,0,1]=4 4469 B12R1.268 Cc1ccc(c(c1)OCF)C#N 7a_100011640519_100015361967 [0,2,0,0,0,0|1,0,1]=4 4470 B12R1.268 Cc1ccc(c(c1)SCF)C=O 62a_100011935181_100015361967 [0,2,0,0,0,0|0,1,0]=3 4471 B12R1.268 Cc1ccc(c(c1)SCF)C=O 62a_100015361967_100011935181 [0,2,0,0,0,0|0,1,0]=3 4472 B12R1.268 Cc1ccc(c(n1)SCF)C=O 62a_100000085379_100015361967 [0,2,0,0,0,0|1,1,0]=4 4473 B12R1.268 Cc1ccc(c(n1)SCF)C=O 62a_100015361967_100000085379 [0,2,0,0,0,0|1,1,0]=4 4474 B12R1.268 O=Cc1ccc(cc1SCF)Br 62a_100010146562_100015361967 [0,2,0,0,0,0|1,1,0]=4 4475 B12R1.268 O=Cc1ccc(cc1SCF)Br 62a_100015361967_100010146562 [0,2,0,0,0,0|1,1,0]=4 4476 B12R1.268 O=Cc1ccc(cc1SCF)F 62a_100000752949_100015361967 [0,2,0,0,0,0|1,1,0]=4 4477 B12R1.268 O=Cc1ccc(cc1SCF)F 62a_100015361967_100000752949 [0,2,0,0,0,0|1,1,0]=4 4478 B12R1.268 O=Cc1ccc(cc1SCF)O 62a_100011236494_100015361967 [0,2,0,0,0,0|1,1,0]=4 4479 B12R1.268 O=Cc1ccc(cc1SCF)O 62a_100015361967_100011236494 [0,2,0,0,0,0|1,1,0]=4 4480 B12R1.268 [13CH3]SCc1cc(ccc1C=O)F 62a_100010132768_200025704644 [0,2,0,0,0,0|1,1,0]=4 4481 B12R1.268 [13CH3]SCc1cc(ccc1C=O)F 62a_200025704644_100010132768 [0,2,0,0,0,0|1,1,0]=4 4482 B12R1.448 C=Cc1cc(c(cc1C#N)C)F 271570a_100011290941_100009816884 [0,2,0,0,0,0|2,0,0]=4 4483 B12R1.448 C=Cc1cc(c(cc1C=O)C)C 271570a_100011290941_100010184403 [0,2,0,0,0,0|1,0,0]=3 4484 B12R1.448 C=Cc1cc(c(cc1C=O)C)F 271570a_100011290941_100009814814 [0,2,0,0,0,0|1,0,1]=4 4485 B12R1.448 C=Cc1cc(c(cc1C=O)F)C 271570a_100011290941_100010186290 [0,2,0,0,0,0|1,0,0]=3 4486 B12R1.448 C=Cc1cc(c(cc1C=O)F)F 271570a_100011290941_100012344232 [0,2,0,0,0,0|2,0,0]=4 4487 B12R1.448 C=Cc1cc(c(cc1C=O)O)C 271570a_100011290941_100010186689 [0,2,0,0,0,0|1,0,0]=3 4488 B12R1.448 C=Cc1cc(c(cc1CO)C)C 271570a_100011290941_100010184405 [0,2,0,0,0,0|1,0,0]=3 4489 B12R1.448 C=Cc1cc(c(cc1CO)F)F 271570a_100011290941_100012344399 [0,2,0,0,0,0|2,0,0]=4 4490 B12R1.448 C=Cc1cc(c(cc1OC)C)N 271570a_100011290941_106657271712 [0,2,0,0,0,0|1,0,0]=3 4491 B12R1.448 C=Cc1cc(c(cc1OC)F)C 271570a_100011290941_100010201977 [0,2,0,0,0,0|2,0,0]=4 4492 B12R1.448 C=Cc1cc(c(cc1OC)F)F 271570a_100011290941_100009813744 [0,2,0,0,0,0|2,0,0]=4 4493 B12R1.448 C=Cc1cc(c(cc1OC)N)C 271570a_100011290941_100010232211 [0,2,0,0,0,0|2,0,0]=4 4494 B12R1.448 C=Cc1cc(c(cc1OC)N)N 271570a_100011290941_100012769537 [0,2,0,0,0,0|2,0,0]=4 4495 B12R1.448 CNc1cc(c(cc1OC)C)Cl 2230a_100009868623_200000210301 [0,2,0,0,0,0|2,0,0]=4 4496 B12R1.448 CNc1cc(c(cc1OC)C)Cl 34a_100009868623_200000210301 [0,2,0,0,0,0|2,0,0]=4 4497 B12R1.448 COc1cc(c(cc1N[13CH3])Cl)C 2230a_100009868623_200025704644 [0,2,0,0,0,0|2,0,0]=4 4498 B12R1.448 COc1cc(c(cc1N[13CH3])Cl)C 34a_100009868623_200025704644 [0,2,0,0,0,0|2,0,0]=4 4499 B12R1.448 COc1cc(c(cc1SC)N)C 62a_106657271712_200000210301 [0,2,0,0,0,0|2,0,0]=4 4500 B12R1.448 COc1cc(c(cc1SC)N)C 62a_200000210301_106657271712 [0,2,0,0,0,0|2,0,0]=4 4501 B12R1.448 COc1cc(c(cc1S[13CH3])N)C 62a_106657271712_200025704644 [0,2,0,0,0,0|2,0,0]=4 4502 B12R1.448 COc1cc(c(cc1S[13CH3])N)C 62a_200025704644_106657271712 [0,2,0,0,0,0|2,0,0]=4 4503 B12R1.448 CSc1cc(c(cc1C=O)C)C 62a_100010184403_200000210301 [0,2,0,0,0,0|0,1,0]=3 4504 B12R1.448 CSc1cc(c(cc1C=O)C)C 62a_200000210301_100010184403 [0,2,0,0,0,0|0,1,0]=3 4505 B12R1.448 CSc1cc(c(cc1C=O)C)F 62a_100009814814_200000210301 [0,2,0,0,0,0|1,1,0]=4 4506 B12R1.448 CSc1cc(c(cc1C=O)C)F 62a_200000210301_100009814814 [0,2,0,0,0,0|1,1,0]=4 4507 B12R1.448 CSc1cc(c(cc1C=O)F)C 62a_100010186290_200000210301 [0,2,0,0,0,0|0,1,0]=3 4508 B12R1.448 CSc1cc(c(cc1C=O)F)C 62a_200000210301_100010186290 [0,2,0,0,0,0|0,1,0]=3 4509 B12R1.448 CSc1cc(c(cc1C=O)F)F 62a_100012344232_200000210301 [0,2,0,0,0,0|1,1,0]=4 4510 B12R1.448 CSc1cc(c(cc1C=O)F)F 62a_200000210301_100012344232 [0,2,0,0,0,0|1,1,0]=4 4511 B12R1.448 CSc1cc(c(cc1C=O)O)C 62a_100010186689_200000210301 [0,2,0,0,0,0|0,1,0]=3 4512 B12R1.448 CSc1cc(c(cc1C=O)O)C 62a_200000210301_100010186689 [0,2,0,0,0,0|0,1,0]=3 4513 B12R1.448 CSc1cc(c(cc1CO)C)C 62a_100010184405_200000210301 [0,2,0,0,0,0|2,0,0]=4 4514 B12R1.448 CSc1cc(c(cc1CO)C)C 62a_200000210301_100010184405 [0,2,0,0,0,0|2,0,0]=4 4515 B12R1.448 Cc1cc(c(cc1C)S[13CH3])C=O 62a_100010184403_200025704644 [0,2,0,0,0,0|0,1,0]=3 4516 B12R1.448 Cc1cc(c(cc1C)S[13CH3])C=O 62a_200025704644_100010184403 [0,2,0,0,0,0|0,1,0]=3 4517 B12R1.448 Cc1cc(c(cc1C)S[13CH3])CO 62a_100010184405_200025704644 [0,2,0,0,0,0|2,0,0]=4 4518 B12R1.448 Cc1cc(c(cc1C)S[13CH3])CO 62a_200025704644_100010184405 [0,2,0,0,0,0|2,0,0]=4 4519 B12R1.448 Cc1cc(c(cc1F)C=O)S[13CH3] 62a_100010186290_200025704644 [0,2,0,0,0,0|0,1,0]=3 4520 B12R1.448 Cc1cc(c(cc1F)C=O)S[13CH3] 62a_200025704644_100010186290 [0,2,0,0,0,0|0,1,0]=3 4521 B12R1.448 Cc1cc(c(cc1F)S[13CH3])C=O 62a_100009814814_200025704644 [0,2,0,0,0,0|1,1,0]=4 4522 B12R1.448 Cc1cc(c(cc1F)S[13CH3])C=O 62a_200025704644_100009814814 [0,2,0,0,0,0|1,1,0]=4 4523 B12R1.448 Cc1cc(c(cc1O)C=O)S[13CH3] 62a_100010186689_200025704644 [0,2,0,0,0,0|0,1,0]=3 4524 B12R1.448 Cc1cc(c(cc1O)C=O)S[13CH3] 62a_200025704644_100010186689 [0,2,0,0,0,0|0,1,0]=3 4525 B12R1.448 [13CH3]Sc1cc(c(cc1C=O)F)F 62a_100012344232_200025704644 [0,2,0,0,0,0|1,1,0]=4 4526 B12R1.448 [13CH3]Sc1cc(c(cc1C=O)F)F 62a_200025704644_100012344232 [0,2,0,0,0,0|1,1,0]=4 4527 B12R1.652 C=Cc1c(ccc(c1C)F)C=O 271570a_100011290941_100009872231 [0,2,0,0,0,0|2,0,0]=4 4528 B12R1.652 C=Cc1c(ccc(c1F)F)C=O 271570a_100011290941_100015087033 [0,2,0,0,0,0|2,0,0]=4 4529 B12R1.652 C=Cc1ccc(c(c1C#N)F)C 271570a_100011290941_100000062008 [0,2,0,0,0,0|2,0,0]=4 4530 B12R1.652 C=Cc1ccc(c(c1C=O)F)C 271570a_100011290941_100000039034 [0,2,0,0,0,0|1,0,1]=4 4531 B12R1.652 C=Cc1ccc(c(c1CO)F)F 271570a_100011290941_100010177773 [0,2,0,0,0,0|2,0,0]=4 4532 B12R1.652 C=Cc1ccc(c(c1OC)F)C 271570a_100011290941_100010081143 [0,2,0,0,0,0|1,0,0]=3 4533 B12R1.652 C=Cc1ccc(c(c1OC)F)F 271570a_100011290941_100010223324 [0,2,0,0,0,0|2,0,0]=4 4534 B12R1.652 C=Cc1ccc(c(c1OC)O)F 271570a_100011290941_200010167157 [0,2,0,0,0,0|2,0,0]=4 4535 B12R1.652 C=Cc1ccc(c(c1SC)F)C 271570a_100011290941_200134762213 [0,2,0,0,0,0|1,1,0]=4 4536 B12R1.652 COc1c(ccc(c1F)C)SC 62a_100010081143_200000210301 [0,2,0,0,0,0|2,0,0]=4 4537 B12R1.652 COc1c(ccc(c1F)C)SC 62a_200000210301_100010081143 [0,2,0,0,0,0|2,0,0]=4 4538 B12R1.652 COc1c(ccc(c1F)C)S[13CH3] 62a_100010081143_200025704644 [0,2,0,0,0,0|2,0,0]=4 4539 B12R1.652 COc1c(ccc(c1F)C)S[13CH3] 62a_200025704644_100010081143 [0,2,0,0,0,0|2,0,0]=4 4540 B12R1.652 CSc1c(ccc(c1C)F)C=O 62a_100009872231_200000210301 [0,2,0,0,0,0|1,1,0]=4 4541 B12R1.652 CSc1c(ccc(c1C)F)C=O 62a_200000210301_100009872231 [0,2,0,0,0,0|1,1,0]=4 4542 B12R1.652 CSc1c(ccc(c1F)F)C=O 62a_100015087033_200000210301 [0,2,0,0,0,0|1,1,0]=4 4543 B12R1.652 CSc1c(ccc(c1F)F)C=O 62a_200000210301_100015087033 [0,2,0,0,0,0|1,1,0]=4 4544 B12R1.652 CSc1c(ccc(c1O)O)C=O 62a_200000210301_200010659824 [0,2,0,0,0,0|1,1,0]=4 4545 B12R1.652 Cc1c(ccc(c1S[13CH3])C=O)F 62a_100009872231_200025704644 [0,2,0,0,0,0|1,1,0]=4 4546 B12R1.652 Cc1c(ccc(c1S[13CH3])C=O)F 62a_200025704644_100009872231 [0,2,0,0,0,0|1,1,0]=4 4547 B12R1.652 [13CH3]Sc1c(ccc(c1F)F)C=O 62a_100015087033_200025704644 [0,2,0,0,0,0|1,1,0]=4 4548 B12R1.652 [13CH3]Sc1c(ccc(c1F)F)C=O 62a_200025704644_100015087033 [0,2,0,0,0,0|1,1,0]=4 4549 B12R1.652 [13CH3]Sc1c(ccc(c1O)O)C=O 62a_200025704644_200010659824 [0,2,0,0,0,0|1,1,0]=4 4550 B12R1.69 C#CCNc1ccc(cc1O)C 34a_100000211527_100000184674 [0,2,0,0,0,0|1,0,1]=4 4551 B12R1.69 C#CCSc1ccc(cc1O)C 62a_100000038162_100012002257 [0,2,0,0,0,0|1,0,1]=4 4552 B12R1.69 C=CCNc1ccc(cc1Br)C 34a_100000210942_100015514636 [0,2,0,0,0,0|2,0,0]=4 4553 B12R1.69 C=CCNc1ccc(cc1C)C 34a_100000736561_100015514636 [0,2,0,0,0,0|2,0,0]=4 4554 B12R1.69 C=CCNc1ccc(cc1C)C 7a_100000736561_100015514636 [0,2,0,0,0,0|2,0,0]=4 4555 B12R1.69 C=CCNc1ccc(cc1Cl)C 34a_100000210522_100015514636 [0,2,0,0,0,0|2,0,0]=4 4556 B12R1.69 C=CCNc1ccc(cc1F)C 34a_100000211023_100015514636 [0,2,0,0,0,0|2,0,0]=4 4557 B12R1.69 C=CCNc1ccc(cc1I)C 34a_100011356834_100015514636 [0,2,0,0,0,0|2,0,0]=4 4558 B12R1.69 C=CCNc1ccc(cc1O)Br 34a_100000739049_100015514636 [0,2,0,0,0,0|2,0,0]=4 4559 B12R1.69 C=CCNc1ccc(cc1O)C 34a_100000211527_100015514636 [0,2,0,0,0,0|1,0,0]=3 4560 B12R1.69 C=CCNc1ccc(cc1O)Cl 34a_100000185728_100015514636 [0,2,0,0,0,0|2,0,0]=4 4561 B12R1.69 C=CCNc1ccc(cc1O)F 34a_100000753323_100015514636 [0,2,0,0,0,0|2,0,0]=4 4562 B12R1.69 C=CCNc1ccc(cc1O)O 34a_100000106777_100015514636 [0,2,0,0,0,0|2,0,0]=4 4563 B12R1.69 C=CCOc1ccc(cc1Br)C 34a_100000210800_100015514636 [0,2,0,0,0,0|2,0,0]=4 4564 B12R1.69 C=CCOc1ccc(cc1Br)C 7a_100000210800_100015514636 [0,2,0,0,0,0|2,0,0]=4 4565 B12R1.69 C=CCOc1ccc(cc1C)C 34a_100000211776_100015514636 [0,2,0,0,0,0|2,0,0]=4 4566 B12R1.69 C=CCOc1ccc(cc1C)C 7a_100000211776_100015514636 [0,2,0,0,0,0|2,0,0]=4 4567 B12R1.69 C=CCOc1ccc(cc1Cl)C 34a_100000749699_100015514636 [0,2,0,0,0,0|2,0,0]=4 4568 B12R1.69 C=CCOc1ccc(cc1Cl)C 7a_100000749699_100015514636 [0,2,0,0,0,0|2,0,0]=4 4569 B12R1.69 C=CCOc1ccc(cc1F)C 34a_100011216688_100015514636 [0,2,0,0,0,0|2,0,0]=4 4570 B12R1.69 C=CCOc1ccc(cc1F)C 7a_100011216688_100015514636 [0,2,0,0,0,0|2,0,0]=4 4571 B12R1.69 C=CCOc1ccc(cc1I)C 34a_100000765521_100015514636 [0,2,0,0,0,0|2,0,0]=4 4572 B12R1.69 C=CCOc1ccc(cc1I)C 7a_100000765521_100015514636 [0,2,0,0,0,0|2,0,0]=4 4573 B12R1.69 C=CCOc1ccc(cc1N)C 34a_100011215204_100015514636 [0,2,0,0,0,0|2,0,0]=4 4574 B12R1.69 C=CCOc1ccc(cc1N)C 7a_100011215204_100015514636 [0,2,0,0,0,0|2,0,0]=4 4575 B12R1.69 C=CCSc1ccc(cc1Br)C 62a_100000210623_100009813563 [0,2,0,0,0,0|2,0,0]=4 4576 B12R1.69 C=CCSc1ccc(cc1Br)C 62a_100009813563_100000210623 [0,2,0,0,0,0|2,0,0]=4 4577 B12R1.69 C=CCSc1ccc(cc1C)C 62a_100000210623_100011217332 [0,2,0,0,0,0|2,0,0]=4 4578 B12R1.69 C=CCSc1ccc(cc1C)C 62a_100011217332_100000210623 [0,2,0,0,0,0|2,0,0]=4 4579 B12R1.69 C=CCSc1ccc(cc1Cl)C 62a_100000210623_100011263221 [0,2,0,0,0,0|2,0,0]=4 4580 B12R1.69 C=CCSc1ccc(cc1Cl)C 62a_100011263221_100000210623 [0,2,0,0,0,0|2,0,0]=4 4581 B12R1.69 C=CCSc1ccc(cc1F)C 62a_100000210623_100011216119 [0,2,0,0,0,0|2,0,0]=4 4582 B12R1.69 C=CCSc1ccc(cc1F)C 62a_100011216119_100000210623 [0,2,0,0,0,0|2,0,0]=4 4583 B12R1.69 C=CCSc1ccc(cc1N)C 62a_100000210623_100011216686 [0,2,0,0,0,0|2,0,0]=4 4584 B12R1.69 C=CCSc1ccc(cc1N)C 62a_100011216686_100000210623 [0,2,0,0,0,0|2,0,0]=4 4585 B12R1.69 C=CCSc1ccc(cc1O)Br 62a_100000210623_100012344904 [0,2,0,0,0,0|2,0,0]=4 4586 B12R1.69 C=CCSc1ccc(cc1O)Br 62a_100012344904_100000210623 [0,2,0,0,0,0|2,0,0]=4 4587 B12R1.69 C=CCSc1ccc(cc1O)C 62a_100000210623_100012002257 [0,2,0,0,0,0|1,0,0]=3 4588 B12R1.69 C=CCSc1ccc(cc1O)C 62a_100012002257_100000210623 [0,2,0,0,0,0|1,0,0]=3 4589 B12R1.69 C=CCSc1ccc(cc1O)Cl 62a_100000050036_100000210623 [0,2,0,0,0,0|2,0,0]=4 4590 B12R1.69 C=CCSc1ccc(cc1O)Cl 62a_100000210623_100000050036 [0,2,0,0,0,0|2,0,0]=4 4591 B12R1.69 C=CCSc1ccc(cc1O)F 62a_100000210623_100000690578 [0,2,0,0,0,0|2,0,0]=4 4592 B12R1.69 C=CCSc1ccc(cc1O)F 62a_100000690578_100000210623 [0,2,0,0,0,0|2,0,0]=4 4593 B12R1.69 C=CCSc1ccc(cc1O)O 62a_100000210623_100009813921 [0,2,0,0,0,0|2,0,0]=4 4594 B12R1.69 C=CCSc1ccc(nc1O)C 62a_100000210623_100009817604 [0,2,0,0,0,0|2,0,0]=4 4595 B12R1.69 C=CCSc1ccc(nc1O)C 62a_100009817604_100000210623 [0,2,0,0,0,0|2,0,0]=4 4596 B12R1.69 C=CCSc1cnc(cc1O)C 62a_100000210623_100011016184 [0,2,0,0,0,0|2,0,0]=4 4597 B12R1.69 C=CCSc1cnc(cc1O)C 62a_100011016184_100000210623 [0,2,0,0,0,0|2,0,0]=4 4598 B12R1.69 C=CCSc1ncc(cc1O)C 62a_100000210623_100012000487 [0,2,0,0,0,0|2,0,0]=4 4599 B12R1.69 CC=NNc1ccc(cc1Br)C 4a_100016996181_200000210099 [0,2,0,0,0,0|2,0,0]=4 4600 B12R1.69 CC=NNc1ccc(cc1Cl)C 4a_100000006747_200000210099 [0,2,0,0,0,0|2,0,0]=4 4601 B12R1.69 CC=NNc1ccc(cc1F)C 4a_100000689694_200000210099 [0,2,0,0,0,0|2,0,0]=4 4602 B12R1.69 CCCCc1ccc(cc1O)C 271570a_100020621405_100012002257 [0,2,0,0,0,0|1,0,1]=4 4603 B12R1.69 CCCNc1ccc(cc1O)C 34a_100000211527_100000210303 [0,2,0,0,0,0|1,0,1]=4 4604 B12R1.69 CCCSc1ccc(cc1O)C 62a_100000210303_100012002257 [0,2,0,0,0,0|1,0,1]=4 4605 B12R1.69 CCCSc1ccc(cc1O)C 62a_100012002257_100000210303 [0,2,0,0,0,0|1,0,1]=4 4606 B12R1.69 COCOc1ccc(cc1O)C 271570a_203496583355_100012265689 [0,2,0,0,0,0|0,0,2]=4 4607 B12R1.69 COCSc1ccc(cc1O)C 62a_100000766300_100012002257 [0,2,0,0,0,0|0,0,2]=4 4608 B12R1.69 COCSc1ccc(cc1O)C 62a_100012002257_100000766300 [0,2,0,0,0,0|0,0,2]=4 4609 B12R1.69 CSCNc1ccc(cc1O)C 34a_100000211527_100011218213 [0,2,0,0,0,0|0,1,1]=4 4610 B12R1.69 CSCSc1ccc(cc1O)C 62a_100011218213_100012002257 [0,2,0,0,0,0|0,1,1]=4 4611 B12R1.69 CSCSc1ccc(cc1O)C 62a_100012002257_100011218213 [0,2,0,0,0,0|0,1,1]=4 4612 B12R1.69 Cc1cc(=O)c(co1)OCC=O 34a_100000081520_200009817547 [0,2,0,0,0,0|1,0,1]=4 4613 B12R1.69 Cc1cc(c(cn1)OCC=O)Br 34a_100009843476_200009817547 [0,2,0,0,0,0|2,0,0]=4 4614 B12R1.69 Cc1cc(c(cn1)OCC=O)Br 7a_100009843476_200015260668 [0,2,0,0,0,0|2,0,0]=4 4615 B12R1.69 Cc1cc(c(cn1)OCC=O)C 34a_200000068632_200009817547 [0,2,0,0,0,0|2,0,0]=4 4616 B12R1.69 Cc1cc(c(cn1)OCC=O)C 7a_200000068632_200015260668 [0,2,0,0,0,0|2,0,0]=4 4617 B12R1.69 Cc1cc(c(cn1)SCC=O)C 62a_100009819613_200015260668 [0,2,0,0,0,0|2,0,0]=4 4618 B12R1.69 Cc1cc(c(cn1)SCC=O)C 62a_200015260668_100009819613 [0,2,0,0,0,0|2,0,0]=4 4619 B12R1.69 Cc1cc(c(cn1)SCC=O)N 62a_100009817891_200015260668 [0,2,0,0,0,0|2,0,0]=4 4620 B12R1.69 Cc1cc(c(cn1)SCC=O)N 62a_200015260668_100009817891 [0,2,0,0,0,0|2,0,0]=4 4621 B12R1.69 Cc1cc(c(cn1)SCC=O)O 62a_100011016184_200015260668 [0,2,0,0,0,0|1,0,0]=3 4622 B12R1.69 Cc1cc(c(cn1)SCC=O)O 62a_200015260668_100011016184 [0,2,0,0,0,0|1,0,0]=3 4623 B12R1.69 Cc1cc(ccc1NCC=O)Br 34a_100000211769_200009817547 [0,2,0,0,0,0|2,0,0]=4 4624 B12R1.69 Cc1cc(ccc1NCC=O)Br 7a_100000211769_200015260668 [0,2,0,0,0,0|2,0,0]=4 4625 B12R1.69 Cc1cc(ccc1NCC=O)Cl 34a_100000210418_200009817547 [0,2,0,0,0,0|2,0,0]=4 4626 B12R1.69 Cc1cc(ccc1NCC=O)Cl 7a_100000210418_200015260668 [0,2,0,0,0,0|2,0,0]=4 4627 B12R1.69 Cc1cc(ccc1NCC=O)F 34a_100000211637_200009817547 [0,2,0,0,0,0|2,0,0]=4 4628 B12R1.69 Cc1cc(ccc1NCC=O)F 7a_100000211637_200015260668 [0,2,0,0,0,0|2,0,0]=4 4629 B12R1.69 Cc1cc(ccc1NCC=O)I 34a_100000184554_200009817547 [0,2,0,0,0,0|2,0,0]=4 4630 B12R1.69 Cc1cc(ccc1NCC=O)I 7a_100000184554_200015260668 [0,2,0,0,0,0|2,0,0]=4 4631 B12R1.69 Cc1cc(ccc1NCC=O)O 34a_100000756630_200009817547 [0,2,0,0,0,0|2,0,0]=4 4632 B12R1.69 Cc1cc(ccc1OCC=O)Br 34a_100000186361_200009817547 [0,2,0,0,0,0|2,0,0]=4 4633 B12R1.69 Cc1cc(ccc1OCC=O)Br 7a_100000186361_200015260668 [0,2,0,0,0,0|2,0,0]=4 4634 B12R1.69 Cc1cc(ccc1OCC=O)Cl 34a_100000211091_200009817547 [0,2,0,0,0,0|2,0,0]=4 4635 B12R1.69 Cc1cc(ccc1OCC=O)Cl 7a_100000211091_200015260668 [0,2,0,0,0,0|2,0,0]=4 4636 B12R1.69 Cc1cc(ccc1OCC=O)F 34a_100000764316_200009817547 [0,2,0,0,0,0|2,0,0]=4 4637 B12R1.69 Cc1cc(ccc1OCC=O)F 7a_100000764316_200015260668 [0,2,0,0,0,0|2,0,0]=4 4638 B12R1.69 Cc1cc(ccc1OCC=O)I 34a_100011218673_200009817547 [0,2,0,0,0,0|2,0,0]=4 4639 B12R1.69 Cc1cc(ccc1OCC=O)I 7a_100011218673_200015260668 [0,2,0,0,0,0|2,0,0]=4 4640 B12R1.69 Cc1cc(ccc1OCC=O)N 34a_100011218179_200009817547 [0,2,0,0,0,0|2,0,0]=4 4641 B12R1.69 Cc1cc(ccc1OCC=O)N 7a_100011218179_200015260668 [0,2,0,0,0,0|2,0,0]=4 4642 B12R1.69 Cc1cc(ccc1SCC=O)Br 62a_100000701812_200015260668 [0,2,0,0,0,0|2,0,0]=4 4643 B12R1.69 Cc1cc(ccc1SCC=O)Br 62a_200015260668_100000701812 [0,2,0,0,0,0|2,0,0]=4 4644 B12R1.69 Cc1cc(ccc1SCC=O)Cl 62a_100011219607_200015260668 [0,2,0,0,0,0|2,0,0]=4 4645 B12R1.69 Cc1cc(ccc1SCC=O)Cl 62a_200015260668_100011219607 [0,2,0,0,0,0|2,0,0]=4 4646 B12R1.69 Cc1cc(ccc1SCC=O)F 62a_100011205405_200015260668 [0,2,0,0,0,0|2,0,0]=4 4647 B12R1.69 Cc1cc(ccc1SCC=O)F 62a_200015260668_100011205405 [0,2,0,0,0,0|2,0,0]=4 4648 B12R1.69 Cc1cc(ccc1SCC=O)N 62a_100000210723_200015260668 [0,2,0,0,0,0|2,0,0]=4 4649 B12R1.69 Cc1cc(ccc1SCC=O)N 62a_200015260668_100000210723 [0,2,0,0,0,0|2,0,0]=4 4650 B12R1.69 Cc1cc(ccc1SCC=O)O 62a_200015260668_100000690111 [0,2,0,0,0,0|2,0,0]=4 4651 B12R1.69 Cc1ccc([n+](c1)[O-])SCC=O 62a_200015260668_100009819918 [0,2,0,0,0,0|1,0,1]=4 4652 B12R1.69 Cc1ccc(c(c1)Br)NCC=O 34a_100000210942_200009817547 [0,2,0,0,0,0|1,0,0]=3 4653 B12R1.69 Cc1ccc(c(c1)Br)OCC=O 34a_100000210800_200009817547 [0,2,0,0,0,0|1,0,0]=3 4654 B12R1.69 Cc1ccc(c(c1)Br)OCC=O 7a_100000210800_200015260668 [0,2,0,0,0,0|1,0,0]=3 4655 B12R1.69 Cc1ccc(c(c1)Br)SCC=O 62a_100009813563_200015260668 [0,2,0,0,0,0|1,0,0]=3 4656 B12R1.69 Cc1ccc(c(c1)Br)SCC=O 62a_200015260668_100009813563 [0,2,0,0,0,0|1,0,0]=3 4657 B12R1.69 Cc1ccc(c(c1)C)NCC=O 34a_100000736561_200009817547 [0,2,0,0,0,0|1,0,0]=3 4658 B12R1.69 Cc1ccc(c(c1)C)NCC=O 7a_100000736561_200015260668 [0,2,0,0,0,0|1,0,0]=3 4659 B12R1.69 Cc1ccc(c(c1)C)OCC=O 34a_100000211776_200009817547 [0,2,0,0,0,0|1,0,0]=3 4660 B12R1.69 Cc1ccc(c(c1)C)OCC=O 7a_100000211776_200015260668 [0,2,0,0,0,0|1,0,0]=3 4661 B12R1.69 Cc1ccc(c(c1)C)SCC=O 62a_100011217332_200015260668 [0,2,0,0,0,0|1,0,0]=3 4662 B12R1.69 Cc1ccc(c(c1)C)SCC=O 62a_200015260668_100011217332 [0,2,0,0,0,0|1,0,0]=3 4663 B12R1.69 Cc1ccc(c(c1)Cl)NCC=O 34a_100000210522_200009817547 [0,2,0,0,0,0|1,0,0]=3 4664 B12R1.69 Cc1ccc(c(c1)Cl)OCC=O 34a_100000749699_200009817547 [0,2,0,0,0,0|1,0,0]=3 4665 B12R1.69 Cc1ccc(c(c1)Cl)OCC=O 7a_100000749699_200015260668 [0,2,0,0,0,0|1,0,0]=3 4666 B12R1.69 Cc1ccc(c(c1)Cl)SCC=O 62a_100011263221_200015260668 [0,2,0,0,0,0|1,0,0]=3 4667 B12R1.69 Cc1ccc(c(c1)Cl)SCC=O 62a_200015260668_100011263221 [0,2,0,0,0,0|1,0,0]=3 4668 B12R1.69 Cc1ccc(c(c1)F)NCC=O 34a_100000211023_200009817547 [0,2,0,0,0,0|1,0,0]=3 4669 B12R1.69 Cc1ccc(c(c1)F)OCC=O 34a_100011216688_200009817547 [0,2,0,0,0,0|1,0,0]=3 4670 B12R1.69 Cc1ccc(c(c1)F)OCC=O 7a_100011216688_200015260668 [0,2,0,0,0,0|1,0,0]=3 4671 B12R1.69 Cc1ccc(c(c1)F)SCC=O 62a_100011216119_200015260668 [0,2,0,0,0,0|1,0,0]=3 4672 B12R1.69 Cc1ccc(c(c1)F)SCC=O 62a_200015260668_100011216119 [0,2,0,0,0,0|1,0,0]=3 4673 B12R1.69 Cc1ccc(c(c1)I)NCC=O 34a_100011356834_200009817547 [0,2,0,0,0,0|1,0,0]=3 4674 B12R1.69 Cc1ccc(c(c1)I)OCC=O 34a_100000765521_200009817547 [0,2,0,0,0,0|1,0,0]=3 4675 B12R1.69 Cc1ccc(c(c1)I)OCC=O 7a_100000765521_200015260668 [0,2,0,0,0,0|1,0,0]=3 4676 B12R1.69 Cc1ccc(c(c1)N)OCC=O 34a_100011215204_200009817547 [0,2,0,0,0,0|1,0,0]=3 4677 B12R1.69 Cc1ccc(c(c1)N)OCC=O 7a_100011215204_200015260668 [0,2,0,0,0,0|1,0,0]=3 4678 B12R1.69 Cc1ccc(c(c1)N)SCC=O 62a_100011216686_200015260668 [0,2,0,0,0,0|1,0,0]=3 4679 B12R1.69 Cc1ccc(c(c1)N)SCC=O 62a_200015260668_100011216686 [0,2,0,0,0,0|1,0,0]=3 4680 B12R1.69 Cc1ccc(c(c1)O)NCC=O 34a_100000211527_200009817547 [0,2,0,0,0,0|0,0,0]=2 4681 B12R1.69 Cc1ccc(c(c1)O)NCCF 34a_100000211527_100011217306 [0,2,0,0,0,0|1,0,1]=4 4682 B12R1.69 Cc1ccc(c(c1)O)NCCO 34a_100000211527_100000211926 [0,2,0,0,0,0|0,0,2]=4 4683 B12R1.69 Cc1ccc(c(c1)O)OCCN 271570a_203496583355_100025744979 [0,2,0,0,0,0|1,0,1]=4 4684 B12R1.69 Cc1ccc(c(c1)O)SCC#N 62a_100011215382_100012002257 [0,2,0,0,0,0|1,0,1]=4 4685 B12R1.69 Cc1ccc(c(c1)O)SCC#N 62a_100012002257_100011215382 [0,2,0,0,0,0|1,0,1]=4 4686 B12R1.69 Cc1ccc(c(c1)O)SCC=O 62a_100012002257_200015260668 [0,2,0,0,0,0|0,0,0]=2 4687 B12R1.69 Cc1ccc(c(c1)O)SCC=O 62a_200015260668_100012002257 [0,2,0,0,0,0|0,0,0]=2 4688 B12R1.69 Cc1ccc(c(c1)O)SCCF 62a_100011217306_100012002257 [0,2,0,0,0,0|1,0,1]=4 4689 B12R1.69 Cc1ccc(c(c1)O)SCCF 62a_100012002257_100011217306 [0,2,0,0,0,0|1,0,1]=4 4690 B12R1.69 Cc1ccc(c(c1)O)SCCO 62a_100000211926_100012002257 [0,2,0,0,0,0|0,0,2]=4 4691 B12R1.69 Cc1ccc(c(c1)O)SCCO 62a_100012002257_100000211926 [0,2,0,0,0,0|0,0,2]=4 4692 B12R1.69 Cc1ccc(c(n1)Br)OCC=O 34a_100000702858_200009817547 [0,2,0,0,0,0|2,0,0]=4 4693 B12R1.69 Cc1ccc(c(n1)Br)OCC=O 7a_100000702858_200015260668 [0,2,0,0,0,0|2,0,0]=4 4694 B12R1.69 Cc1ccc(c(n1)C)OCC=O 34a_100011218912_200009817547 [0,2,0,0,0,0|2,0,0]=4 4695 B12R1.69 Cc1ccc(c(n1)C)OCC=O 7a_100011218912_200015260668 [0,2,0,0,0,0|2,0,0]=4 4696 B12R1.69 Cc1ccc(c(n1)C)SCC=O 62a_100009813853_200015260668 [0,2,0,0,0,0|2,0,0]=4 4697 B12R1.69 Cc1ccc(c(n1)C)SCC=O 62a_200015260668_100009813853 [0,2,0,0,0,0|2,0,0]=4 4698 B12R1.69 Cc1ccc(c(n1)Cl)OCC=O 34a_100000086286_200009817547 [0,2,0,0,0,0|2,0,0]=4 4699 B12R1.69 Cc1ccc(c(n1)Cl)OCC=O 7a_100000086286_200015260668 [0,2,0,0,0,0|2,0,0]=4 4700 B12R1.69 Cc1ccc(c(n1)F)OCC=O 34a_100000079963_200009817547 [0,2,0,0,0,0|2,0,0]=4 4701 B12R1.69 Cc1ccc(c(n1)F)OCC=O 7a_100000079963_200015260668 [0,2,0,0,0,0|2,0,0]=4 4702 B12R1.69 Cc1ccc(c(n1)F)SCC=O 62a_100010006597_200015260668 [0,2,0,0,0,0|2,0,0]=4 4703 B12R1.69 Cc1ccc(c(n1)F)SCC=O 62a_200015260668_100010006597 [0,2,0,0,0,0|2,0,0]=4 4704 B12R1.69 Cc1ccc(c(n1)I)OCC=O 34a_100000023897_200009817547 [0,2,0,0,0,0|2,0,0]=4 4705 B12R1.69 Cc1ccc(c(n1)I)OCC=O 7a_100000023897_200015260668 [0,2,0,0,0,0|2,0,0]=4 4706 B12R1.69 Cc1ccc(c(n1)N)OCC=O 34a_100000694039_200009817547 [0,2,0,0,0,0|2,0,0]=4 4707 B12R1.69 Cc1ccc(c(n1)N)OCC=O 7a_100000694039_200015260668 [0,2,0,0,0,0|2,0,0]=4 4708 B12R1.69 Cc1ccc(c(n1)N)SCC=O 62a_100009816662_200015260668 [0,2,0,0,0,0|2,0,0]=4 4709 B12R1.69 Cc1ccc(c(n1)N)SCC=O 62a_200015260668_100009816662 [0,2,0,0,0,0|2,0,0]=4 4710 B12R1.69 Cc1ccc(c(n1)O)SCC=O 62a_100009817604_200015260668 [0,2,0,0,0,0|1,0,0]=3 4711 B12R1.69 Cc1ccc(c(n1)O)SCC=O 62a_200015260668_100009817604 [0,2,0,0,0,0|1,0,0]=3 4712 B12R1.69 Cc1cnc(c(c1)Br)OCC=O 34a_100000719714_200009817547 [0,2,0,0,0,0|2,0,0]=4 4713 B12R1.69 Cc1cnc(c(c1)C)SCC=O 62a_100009864548_200015260668 [0,2,0,0,0,0|2,0,0]=4 4714 B12R1.69 Cc1cnc(c(c1)C)SCC=O 62a_200015260668_100009864548 [0,2,0,0,0,0|2,0,0]=4 4715 B12R1.69 Cc1cnc(c(c1)F)SCC=O 62a_100009819633_200015260668 [0,2,0,0,0,0|2,0,0]=4 4716 B12R1.69 Cc1cnc(c(c1)F)SCC=O 62a_200015260668_100009819633 [0,2,0,0,0,0|2,0,0]=4 4717 B12R1.69 Cc1cnc(c(c1)N)OCC=O 34a_100012000488_200009817547 [0,2,0,0,0,0|2,0,0]=4 4718 B12R1.69 Cc1cnc(c(c1)N)SCC=O 62a_100000733613_200015260668 [0,2,0,0,0,0|2,0,0]=4 4719 B12R1.69 Cc1cnc(c(c1)N)SCC=O 62a_200015260668_100000733613 [0,2,0,0,0,0|2,0,0]=4 4720 B12R1.69 Cc1cnc(c(c1)O)SCC=O 62a_200015260668_100012000487 [0,2,0,0,0,0|1,0,0]=3 4721 B12R1.69 Nc1cc(ccc1OCC=O)Br 34a_100000752626_200009817547 [0,2,0,0,0,0|2,0,0]=4 4722 B12R1.69 Nc1cc(ccc1OCC=O)Br 7a_100000752626_200015260668 [0,2,0,0,0,0|2,0,0]=4 4723 B12R1.69 Nc1cc(ccc1OCC=O)Cl 34a_100000210500_200009817547 [0,2,0,0,0,0|2,0,0]=4 4724 B12R1.69 Nc1cc(ccc1OCC=O)Cl 7a_100000210500_200015260668 [0,2,0,0,0,0|2,0,0]=4 4725 B12R1.69 Nc1cc(ccc1OCC=O)F 34a_100000759472_200009817547 [0,2,0,0,0,0|2,0,0]=4 4726 B12R1.69 Nc1cc(ccc1OCC=O)F 7a_100000759472_200015260668 [0,2,0,0,0,0|2,0,0]=4 4727 B12R1.69 Nc1cc(ccc1OCC=O)I 34a_100000753495_200009817547 [0,2,0,0,0,0|2,0,0]=4 4728 B12R1.69 Nc1cc(ccc1OCC=O)I 7a_100000753495_200015260668 [0,2,0,0,0,0|2,0,0]=4 4729 B12R1.69 Nc1cc(ccc1SCC=O)Br 62a_100000743836_200015260668 [0,2,0,0,0,0|2,0,0]=4 4730 B12R1.69 Nc1cc(ccc1SCC=O)Br 62a_200015260668_100000743836 [0,2,0,0,0,0|2,0,0]=4 4731 B12R1.69 Nc1cc(ccc1SCC=O)Cl 62a_100000761886_200015260668 [0,2,0,0,0,0|2,0,0]=4 4732 B12R1.69 Nc1cc(ccc1SCC=O)Cl 62a_200015260668_100000761886 [0,2,0,0,0,0|2,0,0]=4 4733 B12R1.69 Nc1cc(ccc1SCC=O)F 62a_100000687223_200015260668 [0,2,0,0,0,0|2,0,0]=4 4734 B12R1.69 Nc1cc(ccc1SCC=O)F 62a_200015260668_100000687223 [0,2,0,0,0,0|2,0,0]=4 4735 B12R1.69 Nc1cc(ccc1SCC=O)O 62a_100011999798_200015260668 [0,2,0,0,0,0|2,0,0]=4 4736 B12R1.69 Nc1cc(ccc1SCC=O)O 62a_200015260668_100011999798 [0,2,0,0,0,0|2,0,0]=4 4737 B12R1.69 Nc1ccc(c(c1)Br)OCC=O 34a_100011534360_200009817547 [0,2,0,0,0,0|2,0,0]=4 4738 B12R1.69 Nc1ccc(c(c1)Br)OCC=O 7a_100011534360_200015260668 [0,2,0,0,0,0|2,0,0]=4 4739 B12R1.69 Nc1ccc(c(c1)Br)SCC=O 62a_100000750458_200015260668 [0,2,0,0,0,0|2,0,0]=4 4740 B12R1.69 Nc1ccc(c(c1)Br)SCC=O 62a_200015260668_100000750458 [0,2,0,0,0,0|2,0,0]=4 4741 B12R1.69 Nc1ccc(c(c1)Cl)OCC=O 34a_100000744943_200009817547 [0,2,0,0,0,0|2,0,0]=4 4742 B12R1.69 Nc1ccc(c(c1)Cl)OCC=O 7a_100000744943_200015260668 [0,2,0,0,0,0|2,0,0]=4 4743 B12R1.69 Nc1ccc(c(c1)Cl)SCC=O 62a_100000761885_200015260668 [0,2,0,0,0,0|2,0,0]=4 4744 B12R1.69 Nc1ccc(c(c1)Cl)SCC=O 62a_200015260668_100000761885 [0,2,0,0,0,0|2,0,0]=4 4745 B12R1.69 Nc1ccc(c(c1)F)OCC=O 34a_100011220035_200009817547 [0,2,0,0,0,0|2,0,0]=4 4746 B12R1.69 Nc1ccc(c(c1)F)OCC=O 7a_100011220035_200015260668 [0,2,0,0,0,0|2,0,0]=4 4747 B12R1.69 Nc1ccc(c(c1)F)SCC=O 62a_100011356925_200015260668 [0,2,0,0,0,0|2,0,0]=4 4748 B12R1.69 Nc1ccc(c(c1)F)SCC=O 62a_200015260668_100011356925 [0,2,0,0,0,0|2,0,0]=4 4749 B12R1.69 Nc1ccc(c(c1)N)OCC=O 34a_100000725306_200009817547 [0,2,0,0,0,0|2,0,0]=4 4750 B12R1.69 Nc1ccc(c(c1)N)SCC=O 62a_200012175722_200015260668 [0,2,0,0,0,0|2,0,0]=4 4751 B12R1.69 Nc1ccc(c(c1)N)SCC=O 62a_200015260668_200012175722 [0,2,0,0,0,0|2,0,0]=4 4752 B12R1.69 O=CCNc1ccc(cc1Br)Br 34a_100000211012_200009817547 [0,2,0,0,0,0|2,0,0]=4 4753 B12R1.69 O=CCNc1ccc(cc1Br)Cl 34a_100000752454_200009817547 [0,2,0,0,0,0|2,0,0]=4 4754 B12R1.69 O=CCNc1ccc(cc1Br)F 34a_100000738039_200009817547 [0,2,0,0,0,0|2,0,0]=4 4755 B12R1.69 O=CCNc1ccc(cc1Br)O 34a_100012001276_200009817547 [0,2,0,0,0,0|2,0,0]=4 4756 B12R1.69 O=CCNc1ccc(cc1Cl)Br 34a_100000211467_200009817547 [0,2,0,0,0,0|2,0,0]=4 4757 B12R1.69 O=CCNc1ccc(cc1Cl)Cl 34a_100000185861_200009817547 [0,2,0,0,0,0|2,0,0]=4 4758 B12R1.69 O=CCNc1ccc(cc1Cl)F 34a_100000212003_200009817547 [0,2,0,0,0,0|2,0,0]=4 4759 B12R1.69 O=CCNc1ccc(cc1Cl)I 34a_100011218065_200009817547 [0,2,0,0,0,0|2,0,0]=4 4760 B12R1.69 O=CCNc1ccc(cc1Cl)O 34a_100011215599_200009817547 [0,2,0,0,0,0|2,0,0]=4 4761 B12R1.69 O=CCNc1ccc(cc1F)Br 34a_100000210722_200009817547 [0,2,0,0,0,0|2,0,0]=4 4762 B12R1.69 O=CCNc1ccc(cc1F)Cl 34a_100000211020_200009817547 [0,2,0,0,0,0|2,0,0]=4 4763 B12R1.69 O=CCNc1ccc(cc1F)F 34a_100000210720_200009817547 [0,2,0,0,0,0|2,0,0]=4 4764 B12R1.69 O=CCNc1ccc(cc1F)I 34a_100011215594_200009817547 [0,2,0,0,0,0|2,0,0]=4 4765 B12R1.69 O=CCNc1ccc(cc1F)O 34a_100000759473_200009817547 [0,2,0,0,0,0|2,0,0]=4 4766 B12R1.69 O=CCNc1ccc(cc1I)Br 34a_100000187925_200009817547 [0,2,0,0,0,0|2,0,0]=4 4767 B12R1.69 O=CCNc1ccc(cc1I)Cl 34a_100000761889_200009817547 [0,2,0,0,0,0|2,0,0]=4 4768 B12R1.69 O=CCNc1ccc(cc1I)F 34a_100000760547_200009817547 [0,2,0,0,0,0|2,0,0]=4 4769 B12R1.69 O=CCNc1ccc(cc1I)O 34a_100010084370_200009817547 [0,2,0,0,0,0|2,0,0]=4 4770 B12R1.69 O=CCNc1ccc(cc1O)Br 34a_100000739049_200009817547 [0,2,0,0,0,0|1,0,0]=3 4771 B12R1.69 O=CCNc1ccc(cc1O)Cl 34a_100000185728_200009817547 [0,2,0,0,0,0|1,0,0]=3 4772 B12R1.69 O=CCNc1ccc(cc1O)F 34a_100000753323_200009817547 [0,2,0,0,0,0|1,0,0]=3 4773 B12R1.69 O=CCNc1ccc(cc1O)O 34a_100000106777_200009817547 [0,2,0,0,0,0|1,0,0]=3 4774 B12R1.69 O=CCOc1ccc(cc1Br)Br 34a_100000188717_200009817547 [0,2,0,0,0,0|2,0,0]=4 4775 B12R1.69 O=CCOc1ccc(cc1Br)Br 7a_100000188717_200015260668 [0,2,0,0,0,0|2,0,0]=4 4776 B12R1.69 O=CCOc1ccc(cc1Br)Cl 34a_100000211998_200009817547 [0,2,0,0,0,0|2,0,0]=4 4777 B12R1.69 O=CCOc1ccc(cc1Br)Cl 7a_100000211998_200015260668 [0,2,0,0,0,0|2,0,0]=4 4778 B12R1.69 O=CCOc1ccc(cc1Br)F 34a_100000211999_200009817547 [0,2,0,0,0,0|2,0,0]=4 4779 B12R1.69 O=CCOc1ccc(cc1Br)F 7a_100000211999_200015260668 [0,2,0,0,0,0|2,0,0]=4 4780 B12R1.69 O=CCOc1ccc(cc1Br)I 34a_100012361655_200009817547 [0,2,0,0,0,0|2,0,0]=4 4781 B12R1.69 O=CCOc1ccc(cc1Br)I 7a_100012361655_200015260668 [0,2,0,0,0,0|2,0,0]=4 4782 B12R1.69 O=CCOc1ccc(cc1Cl)Br 34a_100000186472_200009817547 [0,2,0,0,0,0|2,0,0]=4 4783 B12R1.69 O=CCOc1ccc(cc1Cl)Br 7a_100000186472_200015260668 [0,2,0,0,0,0|2,0,0]=4 4784 B12R1.69 O=CCOc1ccc(cc1Cl)Cl 34a_100015191787_200009817547 [0,2,0,0,0,0|2,0,0]=4 4785 B12R1.69 O=CCOc1ccc(cc1Cl)Cl 7a_100015191787_200015260668 [0,2,0,0,0,0|2,0,0]=4 4786 B12R1.69 O=CCOc1ccc(cc1Cl)F 34a_100000212004_200009817547 [0,2,0,0,0,0|2,0,0]=4 4787 B12R1.69 O=CCOc1ccc(cc1Cl)F 7a_100000212004_200015260668 [0,2,0,0,0,0|2,0,0]=4 4788 B12R1.69 O=CCOc1ccc(cc1Cl)I 34a_100012360047_200009817547 [0,2,0,0,0,0|2,0,0]=4 4789 B12R1.69 O=CCOc1ccc(cc1Cl)I 7a_100012360047_200015260668 [0,2,0,0,0,0|2,0,0]=4 4790 B12R1.69 O=CCOc1ccc(cc1F)Br 34a_100000185481_200009817547 [0,2,0,0,0,0|2,0,0]=4 4791 B12R1.69 O=CCOc1ccc(cc1F)Br 7a_100000185481_200015260668 [0,2,0,0,0,0|2,0,0]=4 4792 B12R1.69 O=CCOc1ccc(cc1F)Cl 34a_100000230166_200009817547 [0,2,0,0,0,0|2,0,0]=4 4793 B12R1.69 O=CCOc1ccc(cc1F)Cl 7a_100000230166_200015260668 [0,2,0,0,0,0|2,0,0]=4 4794 B12R1.69 O=CCOc1ccc(cc1F)F 34a_100000230127_200009817547 [0,2,0,0,0,0|2,0,0]=4 4795 B12R1.69 O=CCOc1ccc(cc1F)F 7a_100000230127_200015260668 [0,2,0,0,0,0|2,0,0]=4 4796 B12R1.69 O=CCOc1ccc(cc1F)I 34a_100011356965_200009817547 [0,2,0,0,0,0|2,0,0]=4 4797 B12R1.69 O=CCOc1ccc(cc1F)I 7a_100011356965_200015260668 [0,2,0,0,0,0|2,0,0]=4 4798 B12R1.69 O=CCOc1ccc(cc1I)Br 34a_100012355227_200009817547 [0,2,0,0,0,0|2,0,0]=4 4799 B12R1.69 O=CCOc1ccc(cc1I)Br 7a_100012355227_200015260668 [0,2,0,0,0,0|2,0,0]=4 4800 B12R1.69 O=CCOc1ccc(cc1I)Cl 34a_100011356953_200009817547 [0,2,0,0,0,0|2,0,0]=4 4801 B12R1.69 O=CCOc1ccc(cc1I)Cl 7a_100011356953_200015260668 [0,2,0,0,0,0|2,0,0]=4 4802 B12R1.69 O=CCOc1ccc(cc1I)F 34a_100012355409_200009817547 [0,2,0,0,0,0|2,0,0]=4 4803 B12R1.69 O=CCOc1ccc(cc1I)F 7a_100012355409_200015260668 [0,2,0,0,0,0|2,0,0]=4 4804 B12R1.69 O=CCOc1ccc(cc1I)I 7a_100010001573_200015260668 [0,2,0,0,0,0|2,0,0]=4 4805 B12R1.69 O=CCSc1ccc(cc1Br)Br 62a_100011484698_200015260668 [0,2,0,0,0,0|2,0,0]=4 4806 B12R1.69 O=CCSc1ccc(cc1Br)Br 62a_200015260668_100011484698 [0,2,0,0,0,0|2,0,0]=4 4807 B12R1.69 O=CCSc1ccc(cc1Br)Cl 62a_100011219703_200015260668 [0,2,0,0,0,0|2,0,0]=4 4808 B12R1.69 O=CCSc1ccc(cc1Br)Cl 62a_200015260668_100011219703 [0,2,0,0,0,0|2,0,0]=4 4809 B12R1.69 O=CCSc1ccc(cc1Br)F 62a_100011217111_200015260668 [0,2,0,0,0,0|2,0,0]=4 4810 B12R1.69 O=CCSc1ccc(cc1Br)F 62a_200015260668_100011217111 [0,2,0,0,0,0|2,0,0]=4 4811 B12R1.69 O=CCSc1ccc(cc1Br)O 62a_100000701344_200015260668 [0,2,0,0,0,0|2,0,0]=4 4812 B12R1.69 O=CCSc1ccc(cc1Br)O 62a_200015260668_100000701344 [0,2,0,0,0,0|2,0,0]=4 4813 B12R1.69 O=CCSc1ccc(cc1Cl)Br 62a_100011216062_200015260668 [0,2,0,0,0,0|2,0,0]=4 4814 B12R1.69 O=CCSc1ccc(cc1Cl)Br 62a_200015260668_100011216062 [0,2,0,0,0,0|2,0,0]=4 4815 B12R1.69 O=CCSc1ccc(cc1Cl)Cl 62a_100000699841_200015260668 [0,2,0,0,0,0|2,0,0]=4 4816 B12R1.69 O=CCSc1ccc(cc1Cl)Cl 62a_200015260668_100000699841 [0,2,0,0,0,0|2,0,0]=4 4817 B12R1.69 O=CCSc1ccc(cc1Cl)F 62a_100000733362_200015260668 [0,2,0,0,0,0|2,0,0]=4 4818 B12R1.69 O=CCSc1ccc(cc1Cl)F 62a_200015260668_100000733362 [0,2,0,0,0,0|2,0,0]=4 4819 B12R1.69 O=CCSc1ccc(cc1Cl)O 62a_100000047559_200015260668 [0,2,0,0,0,0|2,0,0]=4 4820 B12R1.69 O=CCSc1ccc(cc1Cl)O 62a_200015260668_100000047559 [0,2,0,0,0,0|2,0,0]=4 4821 B12R1.69 O=CCSc1ccc(cc1F)Br 62a_100009814013_200015260668 [0,2,0,0,0,0|2,0,0]=4 4822 B12R1.69 O=CCSc1ccc(cc1F)Br 62a_200015260668_100009814013 [0,2,0,0,0,0|2,0,0]=4 4823 B12R1.69 O=CCSc1ccc(cc1F)Cl 62a_100011216042_200015260668 [0,2,0,0,0,0|2,0,0]=4 4824 B12R1.69 O=CCSc1ccc(cc1F)Cl 62a_200015260668_100011216042 [0,2,0,0,0,0|2,0,0]=4 4825 B12R1.69 O=CCSc1ccc(cc1F)F 62a_100000750030_200015260668 [0,2,0,0,0,0|2,0,0]=4 4826 B12R1.69 O=CCSc1ccc(cc1F)F 62a_200015260668_100000750030 [0,2,0,0,0,0|2,0,0]=4 4827 B12R1.69 O=CCSc1ccc(cc1F)O 62a_100000755031_200015260668 [0,2,0,0,0,0|2,0,0]=4 4828 B12R1.69 O=CCSc1ccc(cc1F)O 62a_200015260668_100000755031 [0,2,0,0,0,0|2,0,0]=4 4829 B12R1.69 O=CCSc1ccc(cc1O)Br 62a_100012344904_200015260668 [0,2,0,0,0,0|1,0,0]=3 4830 B12R1.69 O=CCSc1ccc(cc1O)Br 62a_200015260668_100012344904 [0,2,0,0,0,0|1,0,0]=3 4831 B12R1.69 O=CCSc1ccc(cc1O)Cl 62a_100000050036_200015260668 [0,2,0,0,0,0|1,0,0]=3 4832 B12R1.69 O=CCSc1ccc(cc1O)Cl 62a_200015260668_100000050036 [0,2,0,0,0,0|1,0,0]=3 4833 B12R1.69 O=CCSc1ccc(cc1O)F 62a_100000690578_200015260668 [0,2,0,0,0,0|1,0,0]=3 4834 B12R1.69 O=CCSc1ccc(cc1O)F 62a_200015260668_100000690578 [0,2,0,0,0,0|1,0,0]=3 4835 B12R1.69 O=CCSc1ccc(cc1O)O 62a_200015260668_100009813921 [0,2,0,0,0,0|1,0,0]=3 4836 B12R1.69 O=CCSc1ncc(cc1O)Br 62a_100010210634_200015260668 [0,2,0,0,0,0|2,0,0]=4 4837 B12R1.69 O=CCSc1ncc(cc1O)Br 62a_200015260668_100010210634 [0,2,0,0,0,0|2,0,0]=4 4838 B12R1.69 O=CCSc1ncc(cc1O)Cl 62a_100010233512_200015260668 [0,2,0,0,0,0|2,0,0]=4 4839 B12R1.69 O=CCSc1ncc(cc1O)Cl 62a_200015260668_100010233512 [0,2,0,0,0,0|2,0,0]=4 4840 B12R1.69 O=CCSc1ncc(cc1O)F 62a_100009820119_200015260668 [0,2,0,0,0,0|2,0,0]=4 4841 B12R1.69 O=CCSc1ncc(cc1O)F 62a_200015260668_100000079967 [0,2,0,0,0,0|2,0,0]=4 4842 B12R1.114 C=C=Cc1ccc(cc1Br)CC 271570a_100015277604_200009997437 [0,2,0,0,0,0|2,0,0]=4 4843 B12R1.114 C=C=Cc1ccc(cc1Br)OC 271570a_100015277604_100012349170 [0,2,0,0,0,0|2,0,0]=4 4844 B12R1.114 C=C=Cc1ccc(cc1C)CN 271570a_100015277604_100015205234 [0,2,0,0,0,0|2,0,0]=4 4845 B12R1.114 C=C=Cc1ccc(cc1C)CO 271570a_100015277604_100000718852 [0,2,0,0,0,0|2,0,0]=4 4846 B12R1.114 C=C=Cc1ccc(cc1C)NC 271570a_100015277604_100102888905 [0,2,0,0,0,0|2,0,0]=4 4847 B12R1.114 C=C=Cc1ccc(cc1C)OC 271570a_100015277604_100000759875 [0,2,0,0,0,0|2,0,0]=4 4848 B12R1.114 C=C=Cc1ccc(cc1Cl)CO 271570a_100015277604_100000718186 [0,2,0,0,0,0|2,0,0]=4 4849 B12R1.114 C=C=Cc1ccc(cc1F)CC 271570a_100015277604_200010339503 [0,2,0,0,0,0|2,0,0]=4 4850 B12R1.114 C=C=Cc1ccc(cc1F)CN 271570a_100015277604_100000755036 [0,2,0,0,0,0|2,0,0]=4 4851 B12R1.114 C=C=Cc1ccc(cc1F)CO 271570a_100015277604_100011533735 [0,2,0,0,0,0|2,0,0]=4 4852 B12R1.114 C=C=Cc1ccc(cc1F)NC 271570a_100015277604_100012285320 [0,2,0,0,0,0|2,0,0]=4 4853 B12R1.114 C=C=Cc1ccc(cc1F)OC 271570a_100015277604_100000753793 [0,2,0,0,0,0|2,0,0]=4 4854 B12R1.114 C=C=Cc1ccc(cc1F)SC 271570a_100015277604_100009816902 [0,2,0,0,0,0|2,0,0]=4 4855 B12R1.114 C=C=Cc1ccc(cc1N)CO 271570a_100015277604_100012347568 [0,2,0,0,0,0|2,0,0]=4 4856 B12R1.114 C=C=Cc1ccc(cc1N)OC 271570a_100015277604_100000748021 [0,2,0,0,0,0|2,0,0]=4 4857 B12R1.114 C=C=Cc1ccc(cc1O)C#N 271570a_100015277604_100000724445 [0,2,0,0,0,0|1,0,1]=4 4858 B12R1.114 C=C=Cc1ccc(cc1O)C=O 271570a_100015277604_100000041418 [0,2,0,0,0,0|1,0,1]=4 4859 B12R1.114 C=C=Cc1ccc(cc1O)CO 271570a_100015277604_100000049605 [0,2,0,0,0,0|1,0,0]=3 4860 B12R1.114 C=C=Cc1ccc(cc1O)OC 271570a_100015277604_100000719091 [0,2,0,0,0,0|1,0,0]=3 4861 B12R1.114 C=C=Cc1cnc(cc1O)OC 271570a_100015277604_100010738159 [0,2,0,0,0,0|2,0,0]=4 4862 B12R1.114 CC=Cc1ccc(cc1Br)CC 271570a_100016259895_200009997437 [0,2,0,0,0,0|2,0,0]=4 4863 B12R1.114 CC=Cc1ccc(cc1Br)OC 271570a_100016259895_100012349170 [0,2,0,0,0,0|2,0,0]=4 4864 B12R1.114 CC=Cc1ccc(cc1C)CN 271570a_100016259895_100015205234 [0,2,0,0,0,0|2,0,0]=4 4865 B12R1.114 CC=Cc1ccc(cc1C)CO 271570a_100016259895_100000718852 [0,2,0,0,0,0|2,0,0]=4 4866 B12R1.114 CC=Cc1ccc(cc1C)NC 271570a_100016259895_100102888905 [0,2,0,0,0,0|2,0,0]=4 4867 B12R1.114 CC=Cc1ccc(cc1C)OC 271570a_100016259895_100000759875 [0,2,0,0,0,0|2,0,0]=4 4868 B12R1.114 CC=Cc1ccc(cc1Cl)CO 271570a_100016259895_100000718186 [0,2,0,0,0,0|2,0,0]=4 4869 B12R1.114 CC=Cc1ccc(cc1F)CC 271570a_100016259895_200010339503 [0,2,0,0,0,0|2,0,0]=4 4870 B12R1.114 CC=Cc1ccc(cc1F)CN 271570a_100016259895_100000755036 [0,2,0,0,0,0|2,0,0]=4 4871 B12R1.114 CC=Cc1ccc(cc1F)CO 271570a_100016259895_100011533735 [0,2,0,0,0,0|2,0,0]=4 4872 B12R1.114 CC=Cc1ccc(cc1F)NC 271570a_100016259895_100012285320 [0,2,0,0,0,0|2,0,0]=4 4873 B12R1.114 CC=Cc1ccc(cc1F)OC 271570a_100016259895_100000753793 [0,2,0,0,0,0|2,0,0]=4 4874 B12R1.114 CC=Cc1ccc(cc1F)SC 271570a_100016259895_100009816902 [0,2,0,0,0,0|2,0,0]=4 4875 B12R1.114 CC=Cc1ccc(cc1N)CO 271570a_100016259895_100012347568 [0,2,0,0,0,0|2,0,0]=4 4876 B12R1.114 CC=Cc1ccc(cc1N)OC 271570a_100016259895_100000748021 [0,2,0,0,0,0|2,0,0]=4 4877 B12R1.114 CC=Cc1ccc(cc1O)C#N 271570a_100016259895_100000724445 [0,2,0,0,0,0|1,0,1]=4 4878 B12R1.114 CC=Cc1ccc(cc1O)C=O 271570a_100016259895_100000041418 [0,2,0,0,0,0|1,0,1]=4 4879 B12R1.114 CC=Cc1ccc(cc1O)CO 271570a_100016259895_100000049605 [0,2,0,0,0,0|1,0,0]=3 4880 B12R1.114 CC=Cc1ccc(cc1O)OC 271570a_100016259895_100000719091 [0,2,0,0,0,0|1,0,0]=3 4881 B12R1.114 CC=Cc1cnc(cc1O)OC 271570a_100016259895_100010738159 [0,2,0,0,0,0|2,0,0]=4 4882 B12R1.114 CCNc1ccc(cc1O)CC 34a_100000124328_100000210202 [0,2,0,0,0,0|1,0,1]=4 4883 B12R1.114 CCNc1ccc(cc1O)OC 34a_100016989039_100000210202 [0,2,0,0,0,0|1,0,1]=4 4884 B12R1.114 CCOc1ccc(cc1O)CO 271570a_203496583355_200011800839 [0,2,0,0,0,0|1,0,1]=4 4885 B12R1.114 CCSc1ccc(cc1O)CO 62a_100000049605_100000210202 [0,2,0,0,0,0|1,0,1]=4 4886 B12R1.114 CCSc1ccc(cc1O)CO 62a_100000210202_100000049605 [0,2,0,0,0,0|1,0,1]=4 4887 B12R1.114 CCSc1ccc(cc1O)OC 62a_100000210202_100000719091 [0,2,0,0,0,0|1,0,1]=4 4888 B12R1.114 CCc1ccc(c(c1)O)NCF 34a_100000124328_100015361967 [0,2,0,0,0,0|1,0,1]=4 4889 B12R1.114 COc1ccc(c(c1)O)CC#N 271570a_203496583355_100010146818 [0,2,0,0,0,0|1,0,1]=4 4890 B12R1.114 COc1ccc(c(c1)O)NCF 34a_100016989039_100015361967 [0,2,0,0,0,0|1,0,1]=4 4891 B12R1.114 COc1ccc(c(c1)O)SCF 62a_100015361967_100000719091 [0,2,0,0,0,0|1,0,1]=4 4892 B12R1.114 OCc1ccc(c(c1)O)SCF 62a_100000049605_100015361967 [0,2,0,0,0,0|1,0,1]=4 4893 B12R1.114 OCc1ccc(c(c1)O)SCF 62a_100015361967_100000049605 [0,2,0,0,0,0|1,0,1]=4 4894 B12R1.233 CC(=Cc1ccc(cc1Br)C)C 271570a_100102525489_100009813563 [0,2,0,0,0,0|2,0,0]=4 4895 B12R1.233 CC(=Cc1ccc(cc1C)C)C 271570a_100102525489_100011217332 [0,2,0,0,0,0|2,0,0]=4 4896 B12R1.233 CC(=Cc1ccc(cc1Cl)C)C 271570a_100102525489_100011263221 [0,2,0,0,0,0|2,0,0]=4 4897 B12R1.233 CC(=Cc1ccc(cc1F)C)C 271570a_100102525489_100011216119 [0,2,0,0,0,0|2,0,0]=4 4898 B12R1.233 CC(=Cc1ccc(cc1N)C)C 271570a_100102525489_100011216686 [0,2,0,0,0,0|2,0,0]=4 4899 B12R1.233 CC(=Cc1ccc(cc1O)Br)C 271570a_100102525489_100012344904 [0,2,0,0,0,0|2,0,0]=4 4900 B12R1.233 CC(=Cc1ccc(cc1O)C)C 271570a_100102525489_100012002257 [0,2,0,0,0,0|1,0,0]=3 4901 B12R1.233 CC(=Cc1ccc(cc1O)Cl)C 271570a_100102525489_100000050036 [0,2,0,0,0,0|2,0,0]=4 4902 B12R1.233 CC(=Cc1ccc(cc1O)F)C 271570a_100102525489_100000690578 [0,2,0,0,0,0|2,0,0]=4 4903 B12R1.233 CC(=Cc1ccc(cc1O)O)C 271570a_100102525489_100009813921 [0,2,0,0,0,0|2,0,0]=4 4904 B12R1.233 CC(=Cc1ccc(nc1O)C)C 271570a_100102525489_100009817604 [0,2,0,0,0,0|2,0,0]=4 4905 B12R1.233 CC(=Cc1cnc(cc1O)C)C 271570a_100102525489_100011016184 [0,2,0,0,0,0|2,0,0]=4 4906 B12R1.233 CC(=Cc1ncc(cc1O)C)C 271570a_100102525489_100012000487 [0,2,0,0,0,0|2,0,0]=4 4907 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100000070787_200012351560 [0,2,0,0,0,0|2,0,0]=4 4908 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200000210301 [0,2,0,0,0,0|2,0,0]=4 4909 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000070787_100000755608 [0,2,0,0,0,0|2,0,0]=4 4910 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200000210301 [0,2,0,0,0,0|2,0,0]=4 4911 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000070787_100000243222 [0,2,0,0,0,0|2,0,0]=4 4912 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200000210301 [0,2,0,0,0,0|2,0,0]=4 4913 B12R1.233 CC(=O)Cc1ccc(cc1Br)I 1458a_100000070787_100010146610 [0,2,0,0,0,0|2,0,0]=4 4914 B12R1.233 CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200000210301 [0,2,0,0,0,0|2,0,0]=4 4915 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000070787_100000708836 [0,2,0,0,0,0|2,0,0]=4 4916 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_200000210301 [0,2,0,0,0,0|2,0,0]=4 4917 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100000070787_100011219618 [0,2,0,0,0,0|1,0,0]=3 4918 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100011236500_200000210301 [0,2,0,0,0,0|1,0,0]=3 4919 B12R1.233 CC(=O)Cc1ccc(cc1C)Cl 1458a_100000070787_100012361307 [0,2,0,0,0,0|2,0,0]=4 4920 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100000070787_100000700533 [0,2,0,0,0,0|2,0,0]=4 4921 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100011667441_200000210301 [0,2,0,0,0,0|2,0,0]=4 4922 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100000070787_100011740631 [0,2,0,0,0,0|2,0,0]=4 4923 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200000210301 [0,2,0,0,0,0|2,0,0]=4 4924 B12R1.233 CC(=O)Cc1ccc(cc1Cl)C 1458a_100000070787_100012349684 [0,2,0,0,0,0|1,0,0]=3 4925 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000070787_100000188473 [0,2,0,0,0,0|2,0,0]=4 4926 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200000210301 [0,2,0,0,0,0|2,0,0]=4 4927 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000070787_100011216360 [0,2,0,0,0,0|2,0,0]=4 4928 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200000210301 [0,2,0,0,0,0|2,0,0]=4 4929 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100000070787_100000211606 [0,2,0,0,0,0|2,0,0]=4 4930 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200000210301 [0,2,0,0,0,0|2,0,0]=4 4931 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000042674_200000210301 [0,2,0,0,0,0|1,0,0]=3 4932 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000070787_100012002367 [0,2,0,0,0,0|1,0,0]=3 4933 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100000070787_100000709361 [0,2,0,0,0,0|2,0,0]=4 4934 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200000210301 [0,2,0,0,0,0|2,0,0]=4 4935 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000070787_100000748237 [0,2,0,0,0,0|2,0,0]=4 4936 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000684719_200000210301 [0,2,0,0,0,0|2,0,0]=4 4937 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100000070787_100010244991 [0,2,0,0,0,0|2,0,0]=4 4938 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100010149628_200000210301 [0,2,0,0,0,0|2,0,0]=4 4939 B12R1.233 CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_200000210301 [0,2,0,0,0,0|2,0,0]=4 4940 B12R1.233 CC(=O)Cc1ccc(cc1I)Br 1458a_100000070787_100010146615 [0,2,0,0,0,0|2,0,0]=4 4941 B12R1.233 CC(=O)Cc1ccc(cc1I)Cl 1458a_100000070787_100010254388 [0,2,0,0,0,0|2,0,0]=4 4942 B12R1.233 CC(=O)Cc1ccc(cc1I)F 1458a_100000070787_100012354799 [0,2,0,0,0,0|2,0,0]=4 4943 B12R1.233 CC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200000210301 [0,2,0,0,0,0|1,0,0]=3 4944 B12R1.233 CC(=O)Cc1ccc(nc1Br)C 1458a_100000070787_200010064658 [0,2,0,0,0,0|2,0,0]=4 4945 B12R1.233 CC(=O)Cc1ncc(cc1C)C 1458a_100000070787_100016990036 [0,2,0,0,0,0|2,0,0]=4 4946 B12R1.233 CC(=O)Cn1ccc(cc1=O)C 1458a_100000721392_200000210301 [0,2,0,0,0,0|1,0,1]=4 4947 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br 11a_100000211012_100015343762 [0,2,0,0,0,0|2,0,0]=4 4948 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br 1626a_100000211012_100015343762 [0,2,0,0,0,0|2,0,0]=4 4949 B12R1.233 CC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100015343762 [0,2,0,0,0,0|1,0,0]=3 4950 B12R1.233 CC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100015343762 [0,2,0,0,0,0|1,0,0]=3 4951 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100015343762 [0,2,0,0,0,0|2,0,0]=4 4952 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100015343762 [0,2,0,0,0,0|2,0,0]=4 4953 B12R1.233 CC(=O)Nc1ccc(cc1Br)F 11a_100000738039_100015343762 [0,2,0,0,0,0|2,0,0]=4 4954 B12R1.233 CC(=O)Nc1ccc(cc1Br)F 1626a_100000738039_100015343762 [0,2,0,0,0,0|2,0,0]=4 4955 B12R1.233 CC(=O)Nc1ccc(cc1Br)I 11a_100000750455_100015343762 [0,2,0,0,0,0|2,0,0]=4 4956 B12R1.233 CC(=O)Nc1ccc(cc1Br)I 1626a_100000750455_100015343762 [0,2,0,0,0,0|2,0,0]=4 4957 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000070787 [0,2,0,0,0,0|2,0,0]=4 4958 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100103153847 [0,2,0,0,0,0|2,0,0]=4 4959 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 11a_100000211769_100015343762 [0,2,0,0,0,0|2,0,0]=4 4960 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 1626a_100000211769_100015343762 [0,2,0,0,0,0|2,0,0]=4 4961 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 22a_100000211769_100000070787 [0,2,0,0,0,0|2,0,0]=4 4962 B12R1.233 CC(=O)Nc1ccc(cc1C)C 11a_100000736561_100015343762 [0,2,0,0,0,0|1,0,0]=3 4963 B12R1.233 CC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100015343762 [0,2,0,0,0,0|1,0,0]=3 4964 B12R1.233 CC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000070787 [0,2,0,0,0,0|1,0,0]=3 4965 B12R1.233 CC(=O)Nc1ccc(cc1C)C 527a_100000736561_100103153847 [0,2,0,0,0,0|1,0,0]=3 4966 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100015343762 [0,2,0,0,0,0|2,0,0]=4 4967 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100015343762 [0,2,0,0,0,0|2,0,0]=4 4968 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000070787 [0,2,0,0,0,0|2,0,0]=4 4969 B12R1.233 CC(=O)Nc1ccc(cc1C)F 11a_100000211637_100015343762 [0,2,0,0,0,0|2,0,0]=4 4970 B12R1.233 CC(=O)Nc1ccc(cc1C)F 1626a_100000211637_100015343762 [0,2,0,0,0,0|2,0,0]=4 4971 B12R1.233 CC(=O)Nc1ccc(cc1C)F 22a_100000211637_100000070787 [0,2,0,0,0,0|2,0,0]=4 4972 B12R1.233 CC(=O)Nc1ccc(cc1C)F 527a_100000211637_100103153847 [0,2,0,0,0,0|2,0,0]=4 4973 B12R1.233 CC(=O)Nc1ccc(cc1C)I 11a_100000184554_100015343762 [0,2,0,0,0,0|2,0,0]=4 4974 B12R1.233 CC(=O)Nc1ccc(cc1C)I 1626a_100000184554_100015343762 [0,2,0,0,0,0|2,0,0]=4 4975 B12R1.233 CC(=O)Nc1ccc(cc1C)I 22a_100000184554_100000070787 [0,2,0,0,0,0|2,0,0]=4 4976 B12R1.233 CC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000070787 [0,2,0,0,0,0|2,0,0]=4 4977 B12R1.233 CC(=O)Nc1ccc(cc1C)O 271570a_203496583355_100000152120 [0,2,0,0,0,0|2,0,0]=4 4978 B12R1.233 CC(=O)Nc1ccc(cc1C)O 527a_100000756630_100103153847 [0,2,0,0,0,0|2,0,0]=4 4979 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100015343762 [0,2,0,0,0,0|2,0,0]=4 4980 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100015343762 [0,2,0,0,0,0|2,0,0]=4 4981 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100015343762 [0,2,0,0,0,0|1,0,0]=3 4982 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100015343762 [0,2,0,0,0,0|1,0,0]=3 4983 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000070787 [0,2,0,0,0,0|1,0,0]=3 4984 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100015343762 [0,2,0,0,0,0|2,0,0]=4 4985 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100015343762 [0,2,0,0,0,0|2,0,0]=4 4986 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000070787 [0,2,0,0,0,0|2,0,0]=4 4987 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100015343762 [0,2,0,0,0,0|2,0,0]=4 4988 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100015343762 [0,2,0,0,0,0|2,0,0]=4 4989 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000070787 [0,2,0,0,0,0|2,0,0]=4 4990 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100015343762 [0,2,0,0,0,0|2,0,0]=4 4991 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100015343762 [0,2,0,0,0,0|2,0,0]=4 4992 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000070787 [0,2,0,0,0,0|2,0,0]=4 4993 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000070787 [0,2,0,0,0,0|2,0,0]=4 4994 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 271570a_203496583355_100011273303 [0,2,0,0,0,0|2,0,0]=4 4995 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100103153847 [0,2,0,0,0,0|2,0,0]=4 4996 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 11a_100000210722_100015343762 [0,2,0,0,0,0|2,0,0]=4 4997 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 1626a_100000210722_100015343762 [0,2,0,0,0,0|2,0,0]=4 4998 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 22a_100000210722_100000070787 [0,2,0,0,0,0|2,0,0]=4 4999 B12R1.233 CC(=O)Nc1ccc(cc1F)C 11a_100000211023_100015343762 [0,2,0,0,0,0|1,0,0]=3 5000 B12R1.233 CC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100015343762 [0,2,0,0,0,0|1,0,0]=3 5001 B12R1.233 CC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000070787 [0,2,0,0,0,0|1,0,0]=3 5002 B12R1.233 CC(=O)Nc1ccc(cc1F)C 527a_100000211023_100103153847 [0,2,0,0,0,0|1,0,0]=3 5003 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100015343762 [0,2,0,0,0,0|2,0,0]=4 5004 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100015343762 [0,2,0,0,0,0|2,0,0]=4 5005 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000070787 [0,2,0,0,0,0|2,0,0]=4 5006 B12R1.233 CC(=O)Nc1ccc(cc1F)F 11a_100000210720_100015343762 [0,2,0,0,0,0|2,0,0]=4 5007 B12R1.233 CC(=O)Nc1ccc(cc1F)F 1626a_100000210720_100015343762 [0,2,0,0,0,0|2,0,0]=4 5008 B12R1.233 CC(=O)Nc1ccc(cc1F)F 22a_100000210720_100000070787 [0,2,0,0,0,0|2,0,0]=4 5009 B12R1.233 CC(=O)Nc1ccc(cc1F)I 11a_100011215594_100015343762 [0,2,0,0,0,0|2,0,0]=4 5010 B12R1.233 CC(=O)Nc1ccc(cc1F)I 1626a_100011215594_100015343762 [0,2,0,0,0,0|2,0,0]=4 5011 B12R1.233 CC(=O)Nc1ccc(cc1F)I 22a_100011215594_100000070787 [0,2,0,0,0,0|2,0,0]=4 5012 B12R1.233 CC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000070787 [0,2,0,0,0,0|2,0,0]=4 5013 B12R1.233 CC(=O)Nc1ccc(cc1F)O 271570a_203496583355_100000155584 [0,2,0,0,0,0|2,0,0]=4 5014 B12R1.233 CC(=O)Nc1ccc(cc1F)O 527a_100000759473_100103153847 [0,2,0,0,0,0|2,0,0]=4 5015 B12R1.233 CC(=O)Nc1ccc(cc1I)Br 11a_100000187925_100015343762 [0,2,0,0,0,0|2,0,0]=4 5016 B12R1.233 CC(=O)Nc1ccc(cc1I)Br 1626a_100000187925_100015343762 [0,2,0,0,0,0|2,0,0]=4 5017 B12R1.233 CC(=O)Nc1ccc(cc1I)C 11a_100011356834_100015343762 [0,2,0,0,0,0|1,0,0]=3 5018 B12R1.233 CC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100015343762 [0,2,0,0,0,0|1,0,0]=3 5019 B12R1.233 CC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100015343762 [0,2,0,0,0,0|2,0,0]=4 5020 B12R1.233 CC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100015343762 [0,2,0,0,0,0|2,0,0]=4 5021 B12R1.233 CC(=O)Nc1ccc(cc1I)F 11a_100000760547_100015343762 [0,2,0,0,0,0|2,0,0]=4 5022 B12R1.233 CC(=O)Nc1ccc(cc1I)F 1626a_100000760547_100015343762 [0,2,0,0,0,0|2,0,0]=4 5023 B12R1.233 CC(=O)Nc1ccc(cc1I)F 22a_100000760547_100000070787 [0,2,0,0,0,0|2,0,0]=4 5024 B12R1.233 CC(=O)Nc1ccc(cc1I)I 11a_100010002754_100015343762 [0,2,0,0,0,0|2,0,0]=4 5025 B12R1.233 CC(=O)Nc1ccc(cc1I)I 1626a_100010002754_100015343762 [0,2,0,0,0,0|2,0,0]=4 5026 B12R1.233 CC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000070787 [0,2,0,0,0,0|2,0,0]=4 5027 B12R1.233 CC(=O)Nc1ccc(cc1I)O 527a_100010084370_100103153847 [0,2,0,0,0,0|2,0,0]=4 5028 B12R1.233 CC(=O)Nc1ccc(cc1N)O 271570a_203496583355_100000749274 [0,2,0,0,0,0|2,0,0]=4 5029 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000070787 [0,2,0,0,0,0|1,0,0]=3 5030 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 271570a_203496583355_100009813020 [0,2,0,0,0,0|1,0,0]=3 5031 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100103153847 [0,2,0,0,0,0|1,0,0]=3 5032 B12R1.233 CC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000070787 [0,2,0,0,0,0|0,0,0]=2 5033 B12R1.233 CC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000152032 [0,2,0,0,0,0|0,0,0]=2 5034 B12R1.233 CC(=O)Nc1ccc(cc1O)C 527a_100000211527_100103153847 [0,2,0,0,0,0|0,0,0]=2 5035 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000070787 [0,2,0,0,0,0|1,0,0]=3 5036 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100103153847 [0,2,0,0,0,0|1,0,0]=3 5037 B12R1.233 CC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000070787 [0,2,0,0,0,0|1,0,0]=3 5038 B12R1.233 CC(=O)Nc1ccc(cc1O)F 271570a_203496583355_100011215554 [0,2,0,0,0,0|1,0,0]=3 5039 B12R1.233 CC(=O)Nc1ccc(cc1O)F 527a_100000753323_100103153847 [0,2,0,0,0,0|1,0,0]=3 5040 B12R1.233 CC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000070787 [0,2,0,0,0,0|1,0,0]=3 5041 B12R1.233 CC(=O)Nc1ccc(cc1O)I 527a_100000057187_100103153847 [0,2,0,0,0,0|1,0,0]=3 5042 B12R1.233 CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000070787 [0,2,0,0,0,0|1,0,0]=3 5043 B12R1.233 CC(=O)Nc1ccc(cc1O)O 527a_100000106777_100103153847 [0,2,0,0,0,0|1,0,0]=3 5044 B12R1.233 CC(=O)Nc1ncc(cc1O)C 271570a_203496583355_200009816786 [0,2,0,0,0,0|1,0,0]=3 5045 B12R1.233 CC(=O)Oc1ccc(cc1F)O 271570a_203496583355_100009811628 [0,2,0,0,0,0|2,0,0]=4 5046 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])Br 1458a_100000697930_200025704644 [0,2,0,0,0,0|2,0,0]=4 5047 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])F 1458a_100011667441_200025704644 [0,2,0,0,0,0|2,0,0]=4 5048 B12R1.233 Cc1ccc(c(c1)C)CC(=O)[13CH3] 1458a_100011236500_200025704644 [0,2,0,0,0,0|1,0,0]=3 5049 B12R1.233 Cc1ccc(c(c1)F)CC(=O)[13CH3] 1458a_100000042674_200025704644 [0,2,0,0,0,0|1,0,0]=3 5050 B12R1.233 Cc1ccc(c(c1)O)NC(C)C 34a_100000211527_100000210206 [0,2,0,0,0,0|1,0,1]=4 5051 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100000210206_100012002257 [0,2,0,0,0,0|1,0,1]=4 5052 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100012002257_100000210206 [0,2,0,0,0,0|1,0,1]=4 5053 B12R1.233 Cc1ccn(c(=O)c1)CC(=O)[13CH3] 1458a_100000721392_200025704644 [0,2,0,0,0,0|1,0,1]=4 5054 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200025704644 [0,2,0,0,0,0|2,0,0]=4 5055 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200025704644 [0,2,0,0,0,0|2,0,0]=4 5056 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200025704644 [0,2,0,0,0,0|2,0,0]=4 5057 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200025704644 [0,2,0,0,0,0|2,0,0]=4 5058 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200025704644 [0,2,0,0,0,0|2,0,0]=4 5059 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200025704644 [0,2,0,0,0,0|2,0,0]=4 5060 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200025704644 [0,2,0,0,0,0|2,0,0]=4 5061 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200025704644 [0,2,0,0,0,0|2,0,0]=4 5062 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200025704644 [0,2,0,0,0,0|2,0,0]=4 5063 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)F 1458a_100000684719_200025704644 [0,2,0,0,0,0|2,0,0]=4 5064 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)I 1458a_100010149628_200025704644 [0,2,0,0,0,0|2,0,0]=4 5065 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)O 1458a_100000090534_200025704644 [0,2,0,0,0,0|2,0,0]=4 5066 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200025704644 [0,2,0,0,0,0|1,0,0]=3 5067 B12R1.544 C=C=Cc1ccc(c(c1C)N)C 271570a_100015277604_200010074581 [0,2,0,0,0,0|2,0,0]=4 5068 B12R1.544 C=C=Cc1ccc(c(c1F)C)C 271570a_100015277604_200015555822 [0,2,0,0,0,0|2,0,0]=4 5069 B12R1.544 C=C=Cc1ccc(c(c1F)F)C 271570a_100015277604_100012766498 [0,2,0,0,0,0|2,0,0]=4 5070 B12R1.544 C=C=Cc1ccc(c(c1O)C)F 271570a_100015277604_200010391124 [0,2,0,0,0,0|2,0,0]=4 5071 B12R1.544 C=C=Cc1ccc(c(c1O)F)C 271570a_100015277604_100000722096 [0,2,0,0,0,0|1,0,0]=3 5072 B12R1.544 C=C=Cc1ccc(c(c1O)F)F 271570a_100015277604_100010243909 [0,2,0,0,0,0|2,0,0]=4 5073 B12R1.544 CC=Cc1ccc(c(c1C)N)C 271570a_100016259895_200010074581 [0,2,0,0,0,0|2,0,0]=4 5074 B12R1.544 CC=Cc1ccc(c(c1F)C)C 271570a_100016259895_200015555822 [0,2,0,0,0,0|2,0,0]=4 5075 B12R1.544 CC=Cc1ccc(c(c1F)F)C 271570a_100016259895_100012766498 [0,2,0,0,0,0|2,0,0]=4 5076 B12R1.544 CC=Cc1ccc(c(c1O)C)F 271570a_100016259895_200010391124 [0,2,0,0,0,0|2,0,0]=4 5077 B12R1.544 CC=Cc1ccc(c(c1O)F)C 271570a_100016259895_100000722096 [0,2,0,0,0,0|1,0,0]=3 5078 B12R1.544 CC=Cc1ccc(c(c1O)F)F 271570a_100016259895_100010243909 [0,2,0,0,0,0|2,0,0]=4 5079 B12R1.544 CCSc1ccc(c(c1O)F)C 62a_100000210202_100000722096 [0,2,0,0,0,0|1,0,1]=4 5080 B12R1.544 CCSc1ccc(c(c1O)F)C 62a_100000722096_100000210202 [0,2,0,0,0,0|1,0,1]=4 5081 B12R1.544 Cc1ccc(c(c1F)O)SCF 62a_100000722096_100015361967 [0,2,0,0,0,0|1,0,1]=4 5082 B12R1.544 Cc1ccc(c(c1F)O)SCF 62a_100015361967_100000722096 [0,2,0,0,0,0|1,0,1]=4 5083 B12R1.1095 C=C=Cc1c(cc(cc1Br)C)Br 271570a_100015277604_200011219743 [0,2,0,0,0,0|2,0,0]=4 5084 B12R1.1095 C=C=Cc1c(cc(cc1Br)C)C 271570a_100015277604_200012353697 [0,2,0,0,0,0|2,0,0]=4 5085 B12R1.1095 C=C=Cc1c(cc(cc1Br)C)F 271570a_100015277604_100010208195 [0,2,0,0,0,0|2,0,0]=4 5086 B12R1.1095 C=C=Cc1c(cc(cc1C)C)C 271570a_100015277604_100011204320 [0,2,0,0,0,0|2,0,0]=4 5087 B12R1.1095 C=C=Cc1c(cc(cc1F)C)F 271570a_100015277604_100015306127 [0,2,0,0,0,0|2,0,0]=4 5088 B12R1.1095 C=C=Cc1c(cc(cc1F)C)N 271570a_100015277604_100021129147 [0,2,0,0,0,0|2,0,0]=4 5089 B12R1.1095 C=C=Cc1c(cc(cc1F)F)O 271570a_100015277604_100009815984 [0,2,0,0,0,0|2,0,0]=4 5090 B12R1.1095 C=C=Cc1c(cc(cc1O)C)C 271570a_100015277604_100010342985 [0,2,0,0,0,0|1,0,0]=3 5091 B12R1.1095 C=C=Cc1c(cc(cc1O)Cl)C 271570a_100015277604_100010254216 [0,2,0,0,0,0|2,0,0]=4 5092 B12R1.1095 C=C=Cc1c(cc(cc1O)O)O 271570a_100015277604_200010341185 [0,2,0,0,0,0|2,0,0]=4 5093 B12R1.1095 CC=Cc1c(cc(cc1Br)C)Br 271570a_100016259895_200011219743 [0,2,0,0,0,0|2,0,0]=4 5094 B12R1.1095 CC=Cc1c(cc(cc1Br)C)C 271570a_100016259895_200012353697 [0,2,0,0,0,0|2,0,0]=4 5095 B12R1.1095 CC=Cc1c(cc(cc1Br)C)F 271570a_100016259895_100010208195 [0,2,0,0,0,0|2,0,0]=4 5096 B12R1.1095 CC=Cc1c(cc(cc1C)C)C 271570a_100016259895_100011204320 [0,2,0,0,0,0|2,0,0]=4 5097 B12R1.1095 CC=Cc1c(cc(cc1F)C)F 271570a_100016259895_100015306127 [0,2,0,0,0,0|2,0,0]=4 5098 B12R1.1095 CC=Cc1c(cc(cc1F)C)N 271570a_100016259895_100021129147 [0,2,0,0,0,0|2,0,0]=4 5099 B12R1.1095 CC=Cc1c(cc(cc1F)F)O 271570a_100016259895_100009815984 [0,2,0,0,0,0|2,0,0]=4 5100 B12R1.1095 CC=Cc1c(cc(cc1O)C)C 271570a_100016259895_100010342985 [0,2,0,0,0,0|1,0,0]=3 5101 B12R1.1095 CC=Cc1c(cc(cc1O)Cl)C 271570a_100016259895_100010254216 [0,2,0,0,0,0|2,0,0]=4 5102 B12R1.1095 CC=Cc1c(cc(cc1O)O)O 271570a_100016259895_200010341185 [0,2,0,0,0,0|2,0,0]=4 5103 B12R1.1095 CCNc1c(cc(cc1Cl)C)O 34a_100015906060_100000210202 [0,2,0,0,0,0|1,0,1]=4 5104 B12R1.1095 CCSc1c(cc(cc1O)C)C 62a_100000210202_100010342985 [0,2,0,0,0,0|1,0,1]=4 5105 B12R1.1095 CCSc1c(cc(cc1O)C)C 62a_100010342985_100000210202 [0,2,0,0,0,0|1,0,1]=4 5106 B12R1.1095 Cc1cc(c(c(c1)Cl)NCF)O 34a_100015906060_100015361967 [0,2,0,0,0,0|1,0,1]=4 5107 B12R1.1095 Cc1cc(c(c(c1)O)SCF)C 62a_100010342985_100015361967 [0,2,0,0,0,0|1,0,1]=4 5108 B12R1.1095 Cc1cc(c(c(c1)O)SCF)C 62a_100015361967_100010342985 [0,2,0,0,0,0|1,0,1]=4 5109 B12R1.1123 C=C=Cc1cc(c(cc1Br)C)Br 271570a_100015277604_100012929169 [0,2,0,0,0,0|2,0,0]=4 5110 B12R1.1123 C=C=Cc1cc(c(cc1Br)C)F 271570a_100015277604_200009814774 [0,2,0,0,0,0|2,0,0]=4 5111 B12R1.1123 C=C=Cc1cc(c(cc1C)C)C 271570a_100015277604_100000759388 [0,2,0,0,0,0|2,0,0]=4 5112 B12R1.1123 C=C=Cc1cc(c(cc1C)C)N 271570a_100015277604_100000703630 [0,2,0,0,0,0|2,0,0]=4 5113 B12R1.1123 C=C=Cc1cc(c(cc1F)C)Br 271570a_100015277604_100011068846 [0,2,0,0,0,0|2,0,0]=4 5114 B12R1.1123 C=C=Cc1cc(c(cc1F)C)C 271570a_100015277604_100010197417 [0,2,0,0,0,0|2,0,0]=4 5115 B12R1.1123 C=C=Cc1cc(c(cc1F)C)F 271570a_100015277604_100011219510 [0,2,0,0,0,0|2,0,0]=4 5116 B12R1.1123 C=C=Cc1cc(c(cc1F)C)N 271570a_100015277604_100000717900 [0,2,0,0,0,0|2,0,0]=4 5117 B12R1.1123 C=C=Cc1cc(c(cc1F)C)O 271570a_100015277604_100014242602 [0,2,0,0,0,0|2,0,0]=4 5118 B12R1.1123 C=C=Cc1cc(c(cc1N)C)C 271570a_100015277604_100012337760 [0,2,0,0,0,0|2,0,0]=4 5119 B12R1.1123 C=C=Cc1cc(c(cc1N)C)F 271570a_100015277604_100010233353 [0,2,0,0,0,0|2,0,0]=4 5120 B12R1.1123 C=C=Cc1cc(c(cc1O)C)C 271570a_100015277604_100009814663 [0,2,0,0,0,0|1,0,0]=3 5121 B12R1.1123 C=C=Cc1cc(c(cc1O)F)F 271570a_100015277604_100009813768 [0,2,0,0,0,0|2,0,0]=4 5122 B12R1.1123 CC=Cc1cc(c(cc1Br)C)Br 271570a_100016259895_100012929169 [0,2,0,0,0,0|2,0,0]=4 5123 B12R1.1123 CC=Cc1cc(c(cc1Br)C)F 271570a_100016259895_200009814774 [0,2,0,0,0,0|2,0,0]=4 5124 B12R1.1123 CC=Cc1cc(c(cc1C)C)C 271570a_100016259895_100000759388 [0,2,0,0,0,0|2,0,0]=4 5125 B12R1.1123 CC=Cc1cc(c(cc1C)C)N 271570a_100016259895_100000703630 [0,2,0,0,0,0|2,0,0]=4 5126 B12R1.1123 CC=Cc1cc(c(cc1F)C)Br 271570a_100016259895_100011068846 [0,2,0,0,0,0|2,0,0]=4 5127 B12R1.1123 CC=Cc1cc(c(cc1F)C)C 271570a_100016259895_100010197417 [0,2,0,0,0,0|2,0,0]=4 5128 B12R1.1123 CC=Cc1cc(c(cc1F)C)F 271570a_100016259895_100011219510 [0,2,0,0,0,0|2,0,0]=4 5129 B12R1.1123 CC=Cc1cc(c(cc1F)C)N 271570a_100016259895_100000717900 [0,2,0,0,0,0|2,0,0]=4 5130 B12R1.1123 CC=Cc1cc(c(cc1F)C)O 271570a_100016259895_100014242602 [0,2,0,0,0,0|2,0,0]=4 5131 B12R1.1123 CC=Cc1cc(c(cc1N)C)C 271570a_100016259895_100012337760 [0,2,0,0,0,0|2,0,0]=4 5132 B12R1.1123 CC=Cc1cc(c(cc1N)C)F 271570a_100016259895_100010233353 [0,2,0,0,0,0|2,0,0]=4 5133 B12R1.1123 CC=Cc1cc(c(cc1O)C)C 271570a_100016259895_100009814663 [0,2,0,0,0,0|1,0,0]=3 5134 B12R1.1123 CC=Cc1cc(c(cc1O)F)F 271570a_100016259895_100009813768 [0,2,0,0,0,0|2,0,0]=4 5135 B12R1.1123 CCNc1cc(c(cc1O)C)Br 34a_200010235796_100000210202 [0,2,0,0,0,0|1,0,1]=4 5136 B12R1.1123 CCNc1cc(c(cc1O)C)Br 7a_200010235796_100000210202 [0,2,0,0,0,0|1,0,1]=4 5137 B12R1.1123 CCNc1cc(c(cc1O)C)C 34a_100133014134_100000210202 [0,2,0,0,0,0|1,0,1]=4 5138 B12R1.1123 CCNc1cc(c(cc1O)C)C 7a_100133014134_100000210202 [0,2,0,0,0,0|1,0,1]=4 5139 B12R1.1123 CCNc1cc(c(cc1O)C)Cl 34a_100000091707_100000210202 [0,2,0,0,0,0|1,0,1]=4 5140 B12R1.1123 CCSc1cc(c(cc1O)C)C 62a_100000210202_100009814663 [0,2,0,0,0,0|1,0,1]=4 5141 B12R1.1123 CCSc1cc(c(cc1O)C)C 62a_100009814663_100000210202 [0,2,0,0,0,0|1,0,1]=4 5142 B12R1.1123 Cc1cc(c(cc1Br)NCF)O 34a_200010235796_100015361967 [0,2,0,0,0,0|1,0,1]=4 5143 B12R1.1123 Cc1cc(c(cc1Br)NCF)O 7a_200010235796_100015361967 [0,2,0,0,0,0|1,0,1]=4 5144 B12R1.1123 Cc1cc(c(cc1C)NCF)O 34a_100133014134_100015361967 [0,2,0,0,0,0|1,0,1]=4 5145 B12R1.1123 Cc1cc(c(cc1C)NCF)O 7a_100133014134_100015361967 [0,2,0,0,0,0|1,0,1]=4 5146 B12R1.1123 Cc1cc(c(cc1C)SCF)O 62a_100009814663_100015361967 [0,2,0,0,0,0|1,0,1]=4 5147 B12R1.1123 Cc1cc(c(cc1C)SCF)O 62a_100015361967_100009814663 [0,2,0,0,0,0|1,0,1]=4 5148 B12R1.1123 Cc1cc(c(cc1Cl)NCF)O 34a_100000091707_100015361967 [0,2,0,0,0,0|1,0,1]=4 5149 B12R1.1703 CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210202 [0,2,0,0,0,0|2,0,0]=4 5150 B12R1.1703 CCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210202 [0,2,0,0,0,0|1,0,0]=3 5151 B12R1.1703 CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210202 [0,2,0,0,0,0|2,0,0]=4 5152 B12R1.1703 CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210202 [0,2,0,0,0,0|2,0,0]=4 5153 B12R1.1703 CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210202 [0,2,0,0,0,0|2,0,0]=4 5154 B12R1.1703 CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210202 [0,2,0,0,0,0|2,0,0]=4 5155 B12R1.1703 CCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210202 [0,2,0,0,0,0|2,0,0]=4 5156 B12R1.1703 CCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210202 [0,2,0,0,0,0|1,0,0]=3 5157 B12R1.1703 CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210202 [0,2,0,0,0,0|2,0,0]=4 5158 B12R1.1703 CCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210202 [0,2,0,0,0,0|2,0,0]=4 5159 B12R1.1703 CCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210202 [0,2,0,0,0,0|2,0,0]=4 5160 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210202 [0,2,0,0,0,0|2,0,0]=4 5161 B12R1.1703 CCC(=O)c1ccc(cc1C)O 271570a_203496583355_200012361375 [0,2,0,0,0,0|2,0,0]=4 5162 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210202 [0,2,0,0,0,0|2,0,0]=4 5163 B12R1.1703 CCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210202 [0,2,0,0,0,0|1,0,0]=3 5164 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210202 [0,2,0,0,0,0|2,0,0]=4 5165 B12R1.1703 CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210202 [0,2,0,0,0,0|2,0,0]=4 5166 B12R1.1703 CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210202 [0,2,0,0,0,0|2,0,0]=4 5167 B12R1.1703 CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210202 [0,2,0,0,0,0|2,0,0]=4 5168 B12R1.1703 CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210202 [0,2,0,0,0,0|2,0,0]=4 5169 B12R1.1703 CCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210202 [0,2,0,0,0,0|1,0,0]=3 5170 B12R1.1703 CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210202 [0,2,0,0,0,0|2,0,0]=4 5171 B12R1.1703 CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210202 [0,2,0,0,0,0|2,0,0]=4 5172 B12R1.1703 CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210202 [0,2,0,0,0,0|2,0,0]=4 5173 B12R1.1703 CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210202 [0,2,0,0,0,0|2,0,0]=4 5174 B12R1.1703 CCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012360378 [0,2,0,0,0,0|2,0,0]=4 5175 B12R1.1703 CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210202 [0,2,0,0,0,0|2,0,0]=4 5176 B12R1.1703 CCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210202 [0,2,0,0,0,0|1,0,0]=3 5177 B12R1.1703 CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210202 [0,2,0,0,0,0|2,0,0]=4 5178 B12R1.1703 CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210202 [0,2,0,0,0,0|2,0,0]=4 5179 B12R1.1703 CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210202 [0,2,0,0,0,0|1,0,0]=3 5180 B12R1.1703 CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210202 [0,2,0,0,0,0|0,0,0]=2 5181 B12R1.1703 CCC(=O)c1ccc(cc1O)C 271570a_203496583355_200012349623 [0,2,0,0,0,0|0,0,0]=2 5182 B12R1.1703 CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210202 [0,2,0,0,0,0|1,0,0]=3 5183 B12R1.1703 CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210202 [0,2,0,0,0,0|1,0,0]=3 5184 B12R1.1703 CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210202 [0,2,0,0,0,0|1,0,0]=3 5185 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [0,2,0,0,0,0|1,0,0]=3 5186 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 11a_106832991635_100000762965 [0,2,0,0,0,0|2,0,0]=4 5187 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 1626a_100102657272_100000762965 [0,2,0,0,0,0|2,0,0]=4 5188 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 240690a_100102657272_100000762965 [0,2,0,0,0,0|2,0,0]=4 5189 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 527a_100102657272_100000762965 [0,2,0,0,0,0|2,0,0]=4 5190 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 11a_106832991635_100000685072 [0,2,0,0,0,0|1,0,0]=3 5191 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 1626a_100102657272_100000685072 [0,2,0,0,0,0|1,0,0]=3 5192 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 240690a_100102657272_100000685072 [0,2,0,0,0,0|1,0,0]=3 5193 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 527a_100102657272_100000685072 [0,2,0,0,0,0|1,0,0]=3 5194 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 11a_106832991635_100000766353 [0,2,0,0,0,0|2,0,0]=4 5195 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 1626a_100102657272_100000766353 [0,2,0,0,0,0|2,0,0]=4 5196 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 240690a_100102657272_100000766353 [0,2,0,0,0,0|2,0,0]=4 5197 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 527a_100102657272_100000766353 [0,2,0,0,0,0|2,0,0]=4 5198 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 11a_106832991635_100000212304 [0,2,0,0,0,0|2,0,0]=4 5199 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 1626a_100102657272_100000212304 [0,2,0,0,0,0|2,0,0]=4 5200 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 240690a_100102657272_100000212304 [0,2,0,0,0,0|2,0,0]=4 5201 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 527a_100102657272_100000212304 [0,2,0,0,0,0|2,0,0]=4 5202 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 11a_106832991635_100012360512 [0,2,0,0,0,0|2,0,0]=4 5203 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 1626a_100102657272_100012360512 [0,2,0,0,0,0|2,0,0]=4 5204 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 240690a_100102657272_100012360512 [0,2,0,0,0,0|2,0,0]=4 5205 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 527a_100102657272_100012360512 [0,2,0,0,0,0|2,0,0]=4 5206 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 240690a_100102657272_100012344906 [0,2,0,0,0,0|2,0,0]=4 5207 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 527a_100102657272_100012344906 [0,2,0,0,0,0|2,0,0]=4 5208 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 11a_106832991635_100000741311 [0,2,0,0,0,0|2,0,0]=4 5209 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 1626a_100102657272_100000741311 [0,2,0,0,0,0|2,0,0]=4 5210 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 240690a_100102657272_100000741311 [0,2,0,0,0,0|2,0,0]=4 5211 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 527a_100102657272_100000741311 [0,2,0,0,0,0|2,0,0]=4 5212 B12R1.1703 CNC(=O)c1ccc(cc1C)C 11a_106832991635_100000211164 [0,2,0,0,0,0|1,0,0]=3 5213 B12R1.1703 CNC(=O)c1ccc(cc1C)C 1626a_100102657272_100000211164 [0,2,0,0,0,0|1,0,0]=3 5214 B12R1.1703 CNC(=O)c1ccc(cc1C)C 240690a_100102657272_100000211164 [0,2,0,0,0,0|1,0,0]=3 5215 B12R1.1703 CNC(=O)c1ccc(cc1C)C 527a_100102657272_100000211164 [0,2,0,0,0,0|1,0,0]=3 5216 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 11a_106832991635_100000688705 [0,2,0,0,0,0|2,0,0]=4 5217 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 1626a_100102657272_100000688705 [0,2,0,0,0,0|2,0,0]=4 5218 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 240690a_100102657272_100000688705 [0,2,0,0,0,0|2,0,0]=4 5219 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 527a_100102657272_100000688705 [0,2,0,0,0,0|2,0,0]=4 5220 B12R1.1703 CNC(=O)c1ccc(cc1C)F 11a_106832991635_100000686989 [0,2,0,0,0,0|2,0,0]=4 5221 B12R1.1703 CNC(=O)c1ccc(cc1C)F 1626a_100102657272_100000686989 [0,2,0,0,0,0|2,0,0]=4 5222 B12R1.1703 CNC(=O)c1ccc(cc1C)F 240690a_100102657272_100000686989 [0,2,0,0,0,0|2,0,0]=4 5223 B12R1.1703 CNC(=O)c1ccc(cc1C)F 527a_100102657272_100000686989 [0,2,0,0,0,0|2,0,0]=4 5224 B12R1.1703 CNC(=O)c1ccc(cc1C)I 11a_106832991635_100010189873 [0,2,0,0,0,0|2,0,0]=4 5225 B12R1.1703 CNC(=O)c1ccc(cc1C)I 1626a_100102657272_100010189873 [0,2,0,0,0,0|2,0,0]=4 5226 B12R1.1703 CNC(=O)c1ccc(cc1C)I 240690a_100102657272_100010189873 [0,2,0,0,0,0|2,0,0]=4 5227 B12R1.1703 CNC(=O)c1ccc(cc1C)I 527a_100102657272_100010189873 [0,2,0,0,0,0|2,0,0]=4 5228 B12R1.1703 CNC(=O)c1ccc(cc1C)O 240690a_100102657272_100000692822 [0,2,0,0,0,0|2,0,0]=4 5229 B12R1.1703 CNC(=O)c1ccc(cc1C)O 527a_100102657272_100000692822 [0,2,0,0,0,0|2,0,0]=4 5230 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 11a_106832991635_100000741628 [0,2,0,0,0,0|2,0,0]=4 5231 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 1626a_100102657272_100000741628 [0,2,0,0,0,0|2,0,0]=4 5232 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 240690a_100102657272_100000741628 [0,2,0,0,0,0|2,0,0]=4 5233 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 527a_100102657272_100000741628 [0,2,0,0,0,0|2,0,0]=4 5234 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 11a_106832991635_100000766932 [0,2,0,0,0,0|1,0,0]=3 5235 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 1626a_100102657272_100000766932 [0,2,0,0,0,0|1,0,0]=3 5236 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 240690a_100102657272_100000766932 [0,2,0,0,0,0|1,0,0]=3 5237 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 527a_100102657272_100000766932 [0,2,0,0,0,0|1,0,0]=3 5238 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 11a_106832991635_100000185840 [0,2,0,0,0,0|2,0,0]=4 5239 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 1626a_100102657272_100000185840 [0,2,0,0,0,0|2,0,0]=4 5240 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 240690a_100102657272_100000185840 [0,2,0,0,0,0|2,0,0]=4 5241 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 527a_100102657272_100000185840 [0,2,0,0,0,0|2,0,0]=4 5242 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 11a_106832991635_100000211397 [0,2,0,0,0,0|2,0,0]=4 5243 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 1626a_100102657272_100000211397 [0,2,0,0,0,0|2,0,0]=4 5244 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 240690a_100102657272_100000211397 [0,2,0,0,0,0|2,0,0]=4 5245 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 527a_100102657272_100000211397 [0,2,0,0,0,0|2,0,0]=4 5246 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 11a_106832991635_100000751301 [0,2,0,0,0,0|2,0,0]=4 5247 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 1626a_100102657272_100000751301 [0,2,0,0,0,0|2,0,0]=4 5248 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 240690a_100102657272_100000751301 [0,2,0,0,0,0|2,0,0]=4 5249 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 527a_100102657272_100000751301 [0,2,0,0,0,0|2,0,0]=4 5250 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 240690a_100102657272_100000702456 [0,2,0,0,0,0|2,0,0]=4 5251 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 527a_100102657272_100000702456 [0,2,0,0,0,0|2,0,0]=4 5252 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 11a_106832991635_100000214689 [0,2,0,0,0,0|2,0,0]=4 5253 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 1626a_100102657272_100000214689 [0,2,0,0,0,0|2,0,0]=4 5254 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 240690a_100102657272_100000214689 [0,2,0,0,0,0|2,0,0]=4 5255 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 527a_100102657272_100000214689 [0,2,0,0,0,0|2,0,0]=4 5256 B12R1.1703 CNC(=O)c1ccc(cc1F)C 11a_106832991635_100000766033 [0,2,0,0,0,0|1,0,0]=3 5257 B12R1.1703 CNC(=O)c1ccc(cc1F)C 1626a_100102657272_100000766033 [0,2,0,0,0,0|1,0,0]=3 5258 B12R1.1703 CNC(=O)c1ccc(cc1F)C 240690a_100102657272_100000766033 [0,2,0,0,0,0|1,0,0]=3 5259 B12R1.1703 CNC(=O)c1ccc(cc1F)C 527a_100102657272_100000766033 [0,2,0,0,0,0|1,0,0]=3 5260 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 11a_106832991635_100000212326 [0,2,0,0,0,0|2,0,0]=4 5261 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 1626a_100102657272_100000212326 [0,2,0,0,0,0|2,0,0]=4 5262 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 240690a_100102657272_100000212326 [0,2,0,0,0,0|2,0,0]=4 5263 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 527a_100102657272_100000212326 [0,2,0,0,0,0|2,0,0]=4 5264 B12R1.1703 CNC(=O)c1ccc(cc1F)F 11a_106832991635_100000211022 [0,2,0,0,0,0|2,0,0]=4 5265 B12R1.1703 CNC(=O)c1ccc(cc1F)F 1626a_100102657272_100000211022 [0,2,0,0,0,0|2,0,0]=4 5266 B12R1.1703 CNC(=O)c1ccc(cc1F)F 240690a_100102657272_100000211022 [0,2,0,0,0,0|2,0,0]=4 5267 B12R1.1703 CNC(=O)c1ccc(cc1F)F 527a_100102657272_100000211022 [0,2,0,0,0,0|2,0,0]=4 5268 B12R1.1703 CNC(=O)c1ccc(cc1F)I 11a_106832991635_100000037189 [0,2,0,0,0,0|2,0,0]=4 5269 B12R1.1703 CNC(=O)c1ccc(cc1F)I 1626a_100102657272_100000037189 [0,2,0,0,0,0|2,0,0]=4 5270 B12R1.1703 CNC(=O)c1ccc(cc1F)I 240690a_100102657272_100000037189 [0,2,0,0,0,0|2,0,0]=4 5271 B12R1.1703 CNC(=O)c1ccc(cc1F)I 527a_100102657272_100000037189 [0,2,0,0,0,0|2,0,0]=4 5272 B12R1.1703 CNC(=O)c1ccc(cc1F)O 240690a_100102657272_100000689029 [0,2,0,0,0,0|2,0,0]=4 5273 B12R1.1703 CNC(=O)c1ccc(cc1F)O 271570a_203496583355_100000233932 [0,2,0,0,0,0|2,0,0]=4 5274 B12R1.1703 CNC(=O)c1ccc(cc1F)O 527a_100102657272_100000689029 [0,2,0,0,0,0|2,0,0]=4 5275 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 11a_106832991635_100000751167 [0,2,0,0,0,0|2,0,0]=4 5276 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 1626a_100102657272_100000751167 [0,2,0,0,0,0|2,0,0]=4 5277 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 240690a_100102657272_100000751167 [0,2,0,0,0,0|2,0,0]=4 5278 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 527a_100102657272_100000751167 [0,2,0,0,0,0|2,0,0]=4 5279 B12R1.1703 CNC(=O)c1ccc(cc1I)C 11a_106832991635_100009999607 [0,2,0,0,0,0|1,0,0]=3 5280 B12R1.1703 CNC(=O)c1ccc(cc1I)C 1626a_100102657272_100009999607 [0,2,0,0,0,0|1,0,0]=3 5281 B12R1.1703 CNC(=O)c1ccc(cc1I)C 240690a_100102657272_100009999607 [0,2,0,0,0,0|1,0,0]=3 5282 B12R1.1703 CNC(=O)c1ccc(cc1I)C 527a_100102657272_100009999607 [0,2,0,0,0,0|1,0,0]=3 5283 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 11a_106832991635_100000739380 [0,2,0,0,0,0|2,0,0]=4 5284 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 1626a_100102657272_100000739380 [0,2,0,0,0,0|2,0,0]=4 5285 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 240690a_100102657272_100000739380 [0,2,0,0,0,0|2,0,0]=4 5286 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 527a_100102657272_100000739380 [0,2,0,0,0,0|2,0,0]=4 5287 B12R1.1703 CNC(=O)c1ccc(cc1I)F 11a_106832991635_100000739341 [0,2,0,0,0,0|2,0,0]=4 5288 B12R1.1703 CNC(=O)c1ccc(cc1I)F 1626a_100102657272_100000739341 [0,2,0,0,0,0|2,0,0]=4 5289 B12R1.1703 CNC(=O)c1ccc(cc1I)F 240690a_100102657272_100000739341 [0,2,0,0,0,0|2,0,0]=4 5290 B12R1.1703 CNC(=O)c1ccc(cc1I)F 527a_100102657272_100000739341 [0,2,0,0,0,0|2,0,0]=4 5291 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 240690a_100102657272_100000744433 [0,2,0,0,0,0|1,0,0]=3 5292 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 527a_100102657272_100000744433 [0,2,0,0,0,0|1,0,0]=3 5293 B12R1.1703 CNC(=O)c1ccc(cc1O)C 1626a_100102657272_100000212137 [0,2,0,0,0,0|0,0,0]=2 5294 B12R1.1703 CNC(=O)c1ccc(cc1O)C 240690a_100102657272_100000212137 [0,2,0,0,0,0|0,0,0]=2 5295 B12R1.1703 CNC(=O)c1ccc(cc1O)C 527a_100102657272_100000212137 [0,2,0,0,0,0|0,0,0]=2 5296 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 11a_106832991635_100000188622 [0,2,0,0,0,0|1,0,0]=3 5297 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 240690a_100102657272_100000188622 [0,2,0,0,0,0|1,0,0]=3 5298 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 527a_100102657272_100000188622 [0,2,0,0,0,0|1,0,0]=3 5299 B12R1.1703 CNC(=O)c1ccc(cc1O)F 240690a_100102657272_100000746061 [0,2,0,0,0,0|1,0,0]=3 5300 B12R1.1703 CNC(=O)c1ccc(cc1O)F 271570a_203496583355_200000206206 [0,2,0,0,0,0|1,0,0]=3 5301 B12R1.1703 CNC(=O)c1ccc(cc1O)F 527a_100102657272_100000746061 [0,2,0,0,0,0|1,0,0]=3 5302 B12R1.1703 CNC(=O)c1ccc(cc1O)I 240690a_100102657272_100000091984 [0,2,0,0,0,0|1,0,0]=3 5303 B12R1.1703 CNC(=O)c1ccc(cc1O)I 527a_100102657272_100000091984 [0,2,0,0,0,0|1,0,0]=3 5304 B12R1.1703 CNC(C)c1ccc(cc1O)C 269862a_106832991636_100000234885 [0,2,0,0,0,0|1,0,1]=4 5305 B12R1.1703 COC(=O)c1ccc(cc1Br)O 271570a_203496583355_100010247156 [0,2,0,0,0,0|2,0,0]=4 5306 B12R1.1703 COC(=O)c1ccc(cc1C)O 271570a_203496583355_100000747612 [0,2,0,0,0,0|2,0,0]=4 5307 B12R1.1703 COC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060724 [0,2,0,0,0,0|2,0,0]=4 5308 B12R1.1703 COC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216654 [0,2,0,0,0,0|2,0,0]=4 5309 B12R1.1703 COC(=O)c1ccc(cc1N)O 271570a_203496583355_100011373473 [0,2,0,0,0,0|2,0,0]=4 5310 B12R1.1703 COC(=O)c1ccc(cc1O)Br 271570a_203496583355_100000701758 [0,2,0,0,0,0|1,0,0]=3 5311 B12R1.1703 COC(=O)c1ccc(cc1O)C 271570a_203496583355_100012340597 [0,2,0,0,0,0|0,0,0]=2 5312 B12R1.1703 COC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047510 [0,2,0,0,0,0|1,0,0]=3 5313 B12R1.1703 COC(=O)c1ccc(cc1O)F 271570a_203496583355_100000204356 [0,2,0,0,0,0|1,0,0]=3 5314 B12R1.1703 COC(=O)c1ccc(cc1O)N 271570a_203496583355_100009998378 [0,2,0,0,0,0|1,0,0]=3 5315 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100000062286 [0,2,0,0,0,0|1,0,0]=3 5316 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100010150825 [0,2,0,0,0,0|1,0,0]=3 5317 B12R1.1703 COC(=O)c1ccc(nc1O)C 271570a_203496583355_100000054099 [0,2,0,0,0,0|1,0,0]=3 5318 B12R1.1703 COC(=O)c1ccc(nc1O)N 271570a_203496583355_100009865240 [0,2,0,0,0,0|2,0,0]=4 5319 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100015962272 [0,2,0,0,0,0|2,0,0]=4 5320 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100016008356 [0,2,0,0,0,0|2,0,0]=4 5321 B12R1.1703 COC(=O)c1cnc(cc1O)C 271570a_203496583355_100011998247 [0,2,0,0,0,0|1,0,0]=3 5322 B12R1.1703 COC(=O)c1ncc(cc1O)C 271570a_203496583355_100010167497 [0,2,0,0,0,0|1,0,0]=3 5323 B12R1.1703 COC(=O)c1ncc(cc1O)F 271570a_203496583355_100010189631 [0,2,0,0,0,0|2,0,0]=4 5324 B12R1.1703 COC(=O)c1ncc(cc1O)O 271570a_203496583355_100010071521 [0,2,0,0,0,0|2,0,0]=4 5325 B12R1.1703 COC(=O)c1ncc(nc1O)C 271570a_203496583355_100000099855 [0,2,0,0,0,0|2,0,0]=4 5326 B12R1.1703 Cc1cc(ccc1C(=O)CF)Br 1458a_100000741311_100015361967 [0,2,0,0,0,0|2,0,0]=4 5327 B12R1.1703 Cc1cc(ccc1C(=O)CF)Cl 1458a_100000688705_100015361967 [0,2,0,0,0,0|2,0,0]=4 5328 B12R1.1703 Cc1cc(ccc1C(=O)CF)F 1458a_100000686989_100015361967 [0,2,0,0,0,0|2,0,0]=4 5329 B12R1.1703 Cc1cc(ccc1C(=O)CF)I 1458a_100010189873_100015361967 [0,2,0,0,0,0|2,0,0]=4 5330 B12R1.1703 Cc1cc(ccc1C(=O)CF)O 1458a_100000692822_100015361967 [0,2,0,0,0,0|2,0,0]=4 5331 B12R1.1703 Cc1ccc(c(c1)Br)C(=O)CF 1458a_100000685072_100015361967 [0,2,0,0,0,0|1,0,0]=3 5332 B12R1.1703 Cc1ccc(c(c1)C)C(=O)CF 1458a_100000211164_100015361967 [0,2,0,0,0,0|1,0,0]=3 5333 B12R1.1703 Cc1ccc(c(c1)Cl)C(=O)CF 1458a_100000766932_100015361967 [0,2,0,0,0,0|1,0,0]=3 5334 B12R1.1703 Cc1ccc(c(c1)F)C(=O)CF 1458a_100000766033_100015361967 [0,2,0,0,0,0|1,0,0]=3 5335 B12R1.1703 Cc1ccc(c(c1)I)C(=O)CF 1458a_100009999607_100015361967 [0,2,0,0,0,0|1,0,0]=3 5336 B12R1.1703 Cc1ccc(c(c1)O)C(=O)CF 1458a_100000212137_100015361967 [0,2,0,0,0,0|0,0,0]=2 5337 B12R1.1703 Cc1ccc(c(c1)O)C(=O)NN 271570a_203496583355_200012340525 [0,2,0,0,0,0|0,0,0]=2 5338 B12R1.1703 NNC(=O)c1ccc(cc1O)F 271570a_203496583355_100000203923 [0,2,0,0,0,0|1,0,0]=3 5339 B12R1.1703 O=C(CF)c1ccc(cc1Br)Br 1458a_100000762965_100015361967 [0,2,0,0,0,0|2,0,0]=4 5340 B12R1.1703 O=C(CF)c1ccc(cc1Br)Cl 1458a_100000766353_100015361967 [0,2,0,0,0,0|2,0,0]=4 5341 B12R1.1703 O=C(CF)c1ccc(cc1Br)F 1458a_100000212304_100015361967 [0,2,0,0,0,0|2,0,0]=4 5342 B12R1.1703 O=C(CF)c1ccc(cc1Br)I 1458a_100012360512_100015361967 [0,2,0,0,0,0|2,0,0]=4 5343 B12R1.1703 O=C(CF)c1ccc(cc1Br)O 1458a_100012344906_100015361967 [0,2,0,0,0,0|2,0,0]=4 5344 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Br 1458a_100000741628_100015361967 [0,2,0,0,0,0|2,0,0]=4 5345 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Cl 1458a_100000185840_100015361967 [0,2,0,0,0,0|2,0,0]=4 5346 B12R1.1703 O=C(CF)c1ccc(cc1Cl)F 1458a_100000211397_100015361967 [0,2,0,0,0,0|2,0,0]=4 5347 B12R1.1703 O=C(CF)c1ccc(cc1Cl)I 1458a_100000751301_100015361967 [0,2,0,0,0,0|2,0,0]=4 5348 B12R1.1703 O=C(CF)c1ccc(cc1Cl)O 1458a_100000702456_100015361967 [0,2,0,0,0,0|2,0,0]=4 5349 B12R1.1703 O=C(CF)c1ccc(cc1F)Br 1458a_100000214689_100015361967 [0,2,0,0,0,0|2,0,0]=4 5350 B12R1.1703 O=C(CF)c1ccc(cc1F)Cl 1458a_100000212326_100015361967 [0,2,0,0,0,0|2,0,0]=4 5351 B12R1.1703 O=C(CF)c1ccc(cc1F)F 1458a_100000211022_100015361967 [0,2,0,0,0,0|2,0,0]=4 5352 B12R1.1703 O=C(CF)c1ccc(cc1F)I 1458a_100000037189_100015361967 [0,2,0,0,0,0|2,0,0]=4 5353 B12R1.1703 O=C(CF)c1ccc(cc1F)O 1458a_100000689029_100015361967 [0,2,0,0,0,0|2,0,0]=4 5354 B12R1.1703 O=C(CF)c1ccc(cc1I)Br 1458a_100000751167_100015361967 [0,2,0,0,0,0|2,0,0]=4 5355 B12R1.1703 O=C(CF)c1ccc(cc1I)Cl 1458a_100000739380_100015361967 [0,2,0,0,0,0|2,0,0]=4 5356 B12R1.1703 O=C(CF)c1ccc(cc1I)F 1458a_100000739341_100015361967 [0,2,0,0,0,0|2,0,0]=4 5357 B12R1.1703 O=C(CF)c1ccc(cc1O)Br 1458a_100000744433_100015361967 [0,2,0,0,0,0|1,0,0]=3 5358 B12R1.1703 O=C(CF)c1ccc(cc1O)Cl 1458a_100000188622_100015361967 [0,2,0,0,0,0|1,0,0]=3 5359 B12R1.1703 O=C(CF)c1ccc(cc1O)F 1458a_100000746061_100015361967 [0,2,0,0,0,0|1,0,0]=3 5360 B12R1.1703 O=C(CF)c1ccc(cc1O)I 1458a_100000091984_100015361967 [0,2,0,0,0,0|1,0,0]=3 5361 B12R1.1703 O=C(CF)c1ccc(cc1O)O 1458a_100000212172_100015361967 [0,2,0,0,0,0|1,0,0]=3 5362 B12R1.126 CS(=O)(=O)c1ccc(cc1O)F 271570a_203496583355_100010175559 [0,2,0,0,0,0|2,0,0]=4 5363 B12R1.126 Cc1ccc(c(c1)O)C(F)(F)F 271570a_203496583355_100010238361 [0,2,0,0,0,0|1,0,1]=4 5364 B12R1.126 NS(=O)(=O)c1ccc(cc1O)F 271570a_203496583355_100011218482 [0,2,0,0,0,0|2,0,0]=4 5365 B12R1.232 C=C(C)c1cc(c(cc1Br)C)Br 271570a_100000694244_100012929169 [0,2,0,0,0,0|2,0,0]=4 5366 B12R1.232 C=C(C)c1cc(c(cc1Br)C)F 271570a_100000694244_200009814774 [0,2,0,0,0,0|2,0,0]=4 5367 B12R1.232 C=C(C)c1cc(c(cc1C)C)C 271570a_100000694244_100000759388 [0,2,0,0,0,0|2,0,0]=4 5368 B12R1.232 C=C(C)c1cc(c(cc1C)C)N 271570a_100000694244_100000703630 [0,2,0,0,0,0|2,0,0]=4 5369 B12R1.232 C=C(C)c1cc(c(cc1F)C)Br 271570a_100000694244_100011068846 [0,2,0,0,0,0|2,0,0]=4 5370 B12R1.232 C=C(C)c1cc(c(cc1F)C)C 271570a_100000694244_100010197417 [0,2,0,0,0,0|2,0,0]=4 5371 B12R1.232 C=C(C)c1cc(c(cc1F)C)F 271570a_100000694244_100011219510 [0,2,0,0,0,0|2,0,0]=4 5372 B12R1.232 C=C(C)c1cc(c(cc1F)C)N 271570a_100000694244_100000717900 [0,2,0,0,0,0|2,0,0]=4 5373 B12R1.232 C=C(C)c1cc(c(cc1F)C)O 271570a_100000694244_100014242602 [0,2,0,0,0,0|2,0,0]=4 5374 B12R1.232 C=C(C)c1cc(c(cc1N)C)C 271570a_100000694244_100012337760 [0,2,0,0,0,0|2,0,0]=4 5375 B12R1.232 C=C(C)c1cc(c(cc1N)C)F 271570a_100000694244_100010233353 [0,2,0,0,0,0|2,0,0]=4 5376 B12R1.232 C=C(C)c1cc(c(cc1O)C)C 271570a_100000694244_100009814663 [0,2,0,0,0,0|1,0,0]=3 5377 B12R1.232 C=C(C)c1cc(c(cc1O)F)F 271570a_100000694244_100009813768 [0,2,0,0,0,0|2,0,0]=4 5378 B12R1.232 CC(=O)c1cc(c(cc1Br)C)F 1458a_200012355688_200000210301 [0,2,0,0,0,0|1,0,0]=3 5379 B12R1.232 CC(=O)c1cc(c(cc1Br)F)C 1458a_100010204433_200000210301 [0,2,0,0,0,0|2,0,0]=4 5380 B12R1.232 CC(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_200000210301 [0,2,0,0,0,0|2,0,0]=4 5381 B12R1.232 CC(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_200000210301 [0,2,0,0,0,0|2,0,0]=4 5382 B12R1.232 CC(=O)c1cc(c(cc1C)Br)C 1458a_100000695896_200000210301 [0,2,0,0,0,0|2,0,0]=4 5383 B12R1.232 CC(=O)c1cc(c(cc1C)Br)F 1458a_100012344525_200000210301 [0,2,0,0,0,0|2,0,0]=4 5384 B12R1.232 CC(=O)c1cc(c(cc1C)C)Br 1458a_100012920494_200000210301 [0,2,0,0,0,0|1,0,0]=3 5385 B12R1.232 CC(=O)c1cc(c(cc1C)C)C 1458a_100011216168_200000210301 [0,2,0,0,0,0|1,0,0]=3 5386 B12R1.232 CC(=O)c1cc(c(cc1C)C)I 1458a_100000723791_200000210301 [0,2,0,0,0,0|1,0,0]=3 5387 B12R1.232 CC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_200000210301 [0,2,0,0,0,0|2,0,0]=4 5388 B12R1.232 CC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_200000210301 [0,2,0,0,0,0|2,0,0]=4 5389 B12R1.232 CC(=O)c1cc(c(cc1C)F)Br 1458a_100000724332_200000210301 [0,2,0,0,0,0|2,0,0]=4 5390 B12R1.232 CC(=O)c1cc(c(cc1C)F)F 1458a_100000062099_200000210301 [0,2,0,0,0,0|2,0,0]=4 5391 B12R1.232 CC(=O)c1cc(c(cc1C)F)I 1458a_100013328184_200000210301 [0,2,0,0,0,0|2,0,0]=4 5392 B12R1.232 CC(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_200000210301 [0,2,0,0,0,0|2,0,0]=4 5393 B12R1.232 CC(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_200000210301 [0,2,0,0,0,0|2,0,0]=4 5394 B12R1.232 CC(=O)c1cc(c(cc1Cl)C)Cl 1458a_100013033594_200000210301 [0,2,0,0,0,0|1,0,0]=3 5395 B12R1.232 CC(=O)c1cc(c(cc1Cl)C)F 1458a_100009857485_200000210301 [0,2,0,0,0,0|1,0,0]=3 5396 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_200000210301 [0,2,0,0,0,0|2,0,0]=4 5397 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_200000210301 [0,2,0,0,0,0|2,0,0]=4 5398 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)C 1458a_100000687843_200000210301 [0,2,0,0,0,0|2,0,0]=4 5399 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_200000210301 [0,2,0,0,0,0|2,0,0]=4 5400 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_200000210301 [0,2,0,0,0,0|2,0,0]=4 5401 B12R1.232 CC(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_200000210301 [0,2,0,0,0,0|2,0,0]=4 5402 B12R1.232 CC(=O)c1cc(c(cc1F)Br)C 1458a_100012354683_200000210301 [0,2,0,0,0,0|2,0,0]=4 5403 B12R1.232 CC(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_200000210301 [0,2,0,0,0,0|2,0,0]=4 5404 B12R1.232 CC(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_200000210301 [0,2,0,0,0,0|2,0,0]=4 5405 B12R1.232 CC(=O)c1cc(c(cc1F)C)Br 1458a_100012920545_200000210301 [0,2,0,0,0,0|1,0,0]=3 5406 B12R1.232 CC(=O)c1cc(c(cc1F)C)Cl 1458a_100012180961_200000210301 [0,2,0,0,0,0|1,0,0]=3 5407 B12R1.232 CC(=O)c1cc(c(cc1F)C)F 1458a_100000686409_200000210301 [0,2,0,0,0,0|1,0,0]=3 5408 B12R1.232 CC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_200000210301 [0,2,0,0,0,0|1,0,0]=3 5409 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_200000210301 [0,2,0,0,0,0|2,0,0]=4 5410 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_200000210301 [0,2,0,0,0,0|2,0,0]=4 5411 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_200000210301 [0,2,0,0,0,0|2,0,0]=4 5412 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200000210301 [0,2,0,0,0,0|2,0,0]=4 5413 B12R1.232 CC(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_200000210301 [0,2,0,0,0,0|2,0,0]=4 5414 B12R1.232 CC(=O)c1cc(c(cc1F)F)C 1458a_100000767126_200000210301 [0,2,0,0,0,0|2,0,0]=4 5415 B12R1.232 CC(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_200000210301 [0,2,0,0,0,0|2,0,0]=4 5416 B12R1.232 CC(=O)c1cc(c(cc1F)F)F 1458a_100000687535_200000210301 [0,2,0,0,0,0|2,0,0]=4 5417 B12R1.232 CC(=O)c1cc(c(cc1F)F)I 1458a_100000691139_200000210301 [0,2,0,0,0,0|2,0,0]=4 5418 B12R1.232 CC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100009817148 [0,2,0,0,0,0|2,0,0]=4 5419 B12R1.232 CC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_200000210301 [0,2,0,0,0,0|2,0,0]=4 5420 B12R1.232 CC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100012024335 [0,2,0,0,0,0|2,0,0]=4 5421 B12R1.232 CC(=O)c1cc(c(cc1I)C)C 1458a_100010184404_200000210301 [0,2,0,0,0,0|1,0,0]=3 5422 B12R1.232 CC(=O)c1cc(c(cc1I)F)F 1458a_100000688017_200000210301 [0,2,0,0,0,0|2,0,0]=4 5423 B12R1.232 CC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_200000210301 [0,2,0,0,0,0|1,0,0]=3 5424 B12R1.232 CC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_200000210301 [0,2,0,0,0,0|0,0,0]=2 5425 B12R1.232 CC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_200000210301 [0,2,0,0,0,0|0,0,0]=2 5426 B12R1.232 CC(=O)c1cc(c(cc1O)C)O 271570a_203496583355_200010233951 [0,2,0,0,0,0|0,0,0]=2 5427 B12R1.232 CC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200000210301 [0,2,0,0,0,0|1,0,0]=3 5428 B12R1.232 CC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_200000210301 [0,2,0,0,0,0|1,0,0]=3 5429 B12R1.232 CC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_200000210301 [0,2,0,0,0,0|1,0,0]=3 5430 B12R1.232 CC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_200000210301 [0,2,0,0,0,0|1,0,0]=3 5431 B12R1.232 CC(=O)c1cc(c(cc1O)F)F 271570a_203496583355_100013243444 [0,2,0,0,0,0|1,0,0]=3 5432 B12R1.232 CC(=O)c1cc(c(cc1O)F)O 271570a_203496583355_100000691652 [0,2,0,0,0,0|1,0,0]=3 5433 B12R1.232 CC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200000210301 [0,2,0,0,0,0|1,0,0]=3 5434 B12R1.232 CC(=O)c1cc(c(cc1O)O)C 271570a_203496583355_100009816031 [0,2,0,0,0,0|1,0,0]=3 5435 B12R1.232 CC(=O)c1cc(c(cc1O)O)F 271570a_203496583355_200010245088 [0,2,0,0,0,0|1,0,0]=3 5436 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])C 1458a_100012920494_200025704644 [0,2,0,0,0,0|1,0,0]=3 5437 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])F 1458a_100012920545_200025704644 [0,2,0,0,0,0|1,0,0]=3 5438 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])O 1458a_100010233826_200025704644 [0,2,0,0,0,0|0,0,0]=2 5439 B12R1.232 Cc1cc(c(cc1Br)C)C(=O)[13CH3] 1458a_100000695896_200025704644 [0,2,0,0,0,0|2,0,0]=4 5440 B12R1.232 Cc1cc(c(cc1Br)F)C(=O)[13CH3] 1458a_100012354683_200025704644 [0,2,0,0,0,0|2,0,0]=4 5441 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])Br)F 1458a_100000724332_200025704644 [0,2,0,0,0,0|2,0,0]=4 5442 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])Cl)Cl 1458a_100010439669_200025704644 [0,2,0,0,0,0|2,0,0]=4 5443 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)Br 1458a_100012344525_200025704644 [0,2,0,0,0,0|2,0,0]=4 5444 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)Cl 1458a_200010768543_200025704644 [0,2,0,0,0,0|2,0,0]=4 5445 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)F 1458a_100000062099_200025704644 [0,2,0,0,0,0|2,0,0]=4 5446 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])I)F 1458a_100013328184_200025704644 [0,2,0,0,0,0|2,0,0]=4 5447 B12R1.232 Cc1cc(c(cc1C)B(O)O)O 271570a_203496583355_200134766076 [0,2,0,0,0,0|1,0,1]=4 5448 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])C 1458a_100011216168_200025704644 [0,2,0,0,0,0|1,0,0]=3 5449 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])I 1458a_100010184404_200025704644 [0,2,0,0,0,0|1,0,0]=3 5450 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])O 1458a_100009831561_200025704644 [0,2,0,0,0,0|0,0,0]=2 5451 B12R1.232 Cc1cc(c(cc1Cl)C(=O)[13CH3])Cl 1458a_100013033594_200025704644 [0,2,0,0,0,0|1,0,0]=3 5452 B12R1.232 Cc1cc(c(cc1Cl)C(=O)[13CH3])F 1458a_100012180961_200025704644 [0,2,0,0,0,0|1,0,0]=3 5453 B12R1.232 Cc1cc(c(cc1F)Br)C(=O)[13CH3] 1458a_100010204433_200025704644 [0,2,0,0,0,0|2,0,0]=4 5454 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])Br 1458a_200012355688_200025704644 [0,2,0,0,0,0|1,0,0]=3 5455 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])Cl 1458a_100009857485_200025704644 [0,2,0,0,0,0|1,0,0]=3 5456 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])F 1458a_100000686409_200025704644 [0,2,0,0,0,0|1,0,0]=3 5457 B12R1.232 Cc1cc(c(cc1F)Cl)C(=O)[13CH3] 1458a_100000687843_200025704644 [0,2,0,0,0,0|2,0,0]=4 5458 B12R1.232 Cc1cc(c(cc1F)F)C(=O)[13CH3] 1458a_100000767126_200025704644 [0,2,0,0,0,0|2,0,0]=4 5459 B12R1.232 Cc1cc(c(cc1I)C(=O)[13CH3])C 1458a_100000723791_200025704644 [0,2,0,0,0,0|1,0,0]=3 5460 B12R1.232 Cc1cc(c(cc1O)C(=O)[13CH3])F 1458a_100009839767_200025704644 [0,2,0,0,0,0|1,0,0]=3 5461 B12R1.232 NC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100015235948 [0,2,0,0,0,0|2,0,0]=4 5462 B12R1.232 NC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100010244962 [0,2,0,0,0,0|2,0,0]=4 5463 B12R1.232 NC(=O)c1cc(c(cc1N)F)O 271570a_203496583355_100015444839 [0,2,0,0,0,0|2,0,0]=4 5464 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_200025704644 [0,2,0,0,0,0|2,0,0]=4 5465 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_200025704644 [0,2,0,0,0,0|2,0,0]=4 5466 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_200025704644 [0,2,0,0,0,0|2,0,0]=4 5467 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_200025704644 [0,2,0,0,0,0|2,0,0]=4 5468 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_200025704644 [0,2,0,0,0,0|2,0,0]=4 5469 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_200025704644 [0,2,0,0,0,0|2,0,0]=4 5470 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_200025704644 [0,2,0,0,0,0|2,0,0]=4 5471 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_200025704644 [0,2,0,0,0,0|2,0,0]=4 5472 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_200025704644 [0,2,0,0,0,0|2,0,0]=4 5473 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_200025704644 [0,2,0,0,0,0|2,0,0]=4 5474 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_200025704644 [0,2,0,0,0,0|2,0,0]=4 5475 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_200025704644 [0,2,0,0,0,0|2,0,0]=4 5476 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_200025704644 [0,2,0,0,0,0|2,0,0]=4 5477 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_200025704644 [0,2,0,0,0,0|2,0,0]=4 5478 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200025704644 [0,2,0,0,0,0|2,0,0]=4 5479 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_200025704644 [0,2,0,0,0,0|2,0,0]=4 5480 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_200025704644 [0,2,0,0,0,0|2,0,0]=4 5481 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)F 1458a_100000687535_200025704644 [0,2,0,0,0,0|2,0,0]=4 5482 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)I 1458a_100000691139_200025704644 [0,2,0,0,0,0|2,0,0]=4 5483 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_200025704644 [0,2,0,0,0,0|2,0,0]=4 5484 B12R1.232 [13CH3]C(=O)c1cc(c(cc1I)F)F 1458a_100000688017_200025704644 [0,2,0,0,0,0|2,0,0]=4 5485 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_200025704644 [0,2,0,0,0,0|1,0,0]=3 5486 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200025704644 [0,2,0,0,0,0|1,0,0]=3 5487 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_200025704644 [0,2,0,0,0,0|1,0,0]=3 5488 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_200025704644 [0,2,0,0,0,0|1,0,0]=3 5489 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)F 1458a_100012182723_200025704644 [0,2,0,0,0,0|1,0,0]=3 5490 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200025704644 [0,2,0,0,0,0|1,0,0]=3 5491 B12R1.452 C#Cc1ccc(c(c1)Cl)C(=O)C 1458a_100103168756_200000210301 [0,2,0,0,0,0|1,0,1]=4 5492 B12R1.452 C#Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100103168756_200025704644 [0,2,0,0,0,0|1,0,1]=4 5493 B12R1.452 C=C(C)c1ccc(cc1Br)CC 271570a_100000694244_200009997437 [0,2,0,0,0,0|2,0,0]=4 5494 B12R1.452 C=C(C)c1ccc(cc1Br)OC 271570a_100000694244_100012349170 [0,2,0,0,0,0|2,0,0]=4 5495 B12R1.452 C=C(C)c1ccc(cc1C)CN 271570a_100000694244_100015205234 [0,2,0,0,0,0|2,0,0]=4 5496 B12R1.452 C=C(C)c1ccc(cc1C)CO 271570a_100000694244_100000718852 [0,2,0,0,0,0|2,0,0]=4 5497 B12R1.452 C=C(C)c1ccc(cc1C)NC 271570a_100000694244_100102888905 [0,2,0,0,0,0|2,0,0]=4 5498 B12R1.452 C=C(C)c1ccc(cc1C)OC 271570a_100000694244_100000759875 [0,2,0,0,0,0|2,0,0]=4 5499 B12R1.452 C=C(C)c1ccc(cc1Cl)CO 271570a_100000694244_100000718186 [0,2,0,0,0,0|2,0,0]=4 5500 B12R1.452 C=C(C)c1ccc(cc1F)CC 271570a_100000694244_200010339503 [0,2,0,0,0,0|2,0,0]=4 5501 B12R1.452 C=C(C)c1ccc(cc1F)CN 271570a_100000694244_100000755036 [0,2,0,0,0,0|2,0,0]=4 5502 B12R1.452 C=C(C)c1ccc(cc1F)CO 271570a_100000694244_100011533735 [0,2,0,0,0,0|2,0,0]=4 5503 B12R1.452 C=C(C)c1ccc(cc1F)NC 271570a_100000694244_100012285320 [0,2,0,0,0,0|2,0,0]=4 5504 B12R1.452 C=C(C)c1ccc(cc1F)OC 271570a_100000694244_100000753793 [0,2,0,0,0,0|2,0,0]=4 5505 B12R1.452 C=C(C)c1ccc(cc1F)SC 271570a_100000694244_100009816902 [0,2,0,0,0,0|2,0,0]=4 5506 B12R1.452 C=C(C)c1ccc(cc1N)CO 271570a_100000694244_100012347568 [0,2,0,0,0,0|2,0,0]=4 5507 B12R1.452 C=C(C)c1ccc(cc1N)OC 271570a_100000694244_100000748021 [0,2,0,0,0,0|2,0,0]=4 5508 B12R1.452 C=C(C)c1ccc(cc1O)C#N 271570a_100000694244_100000724445 [0,2,0,0,0,0|1,0,1]=4 5509 B12R1.452 C=C(C)c1ccc(cc1O)C=O 271570a_100000694244_100000041418 [0,2,0,0,0,0|1,0,1]=4 5510 B12R1.452 C=C(C)c1ccc(cc1O)CO 271570a_100000694244_100000049605 [0,2,0,0,0,0|1,0,0]=3 5511 B12R1.452 C=C(C)c1ccc(cc1O)OC 271570a_100000694244_100000719091 [0,2,0,0,0,0|1,0,0]=3 5512 B12R1.452 C=C(C)c1cnc(cc1O)OC 271570a_100000694244_100010738159 [0,2,0,0,0,0|2,0,0]=4 5513 B12R1.452 C=Cc1ccc(c(c1)Br)C(=O)N 271570a_100011290941_200010146565 [0,2,0,0,0,0|1,0,1]=4 5514 B12R1.452 C=Cc1ccc(c(c1)C)C(=O)C 271570a_100011290941_100012360112 [0,2,0,0,0,0|1,0,1]=4 5515 B12R1.452 C=Cc1ccc(c(c1)C)C(=O)N 271570a_100011290941_100011327924 [0,2,0,0,0,0|1,0,1]=4 5516 B12R1.452 C=Cc1ccc(c(c1)F)C(=O)C 271570a_100011290941_100000690205 [0,2,0,0,0,0|1,0,1]=4 5517 B12R1.452 C=Cc1ccc(c(c1)F)C(=O)N 271570a_100011290941_100000216903 [0,2,0,0,0,0|1,0,1]=4 5518 B12R1.452 C=Cc1ccc(c(c1)N)C(=O)C 271570a_100011290941_100011590516 [0,2,0,0,0,0|1,0,1]=4 5519 B12R1.452 C=Cc1ccc(c(c1)N)C(=O)N 271570a_100011290941_100012349972 [0,2,0,0,0,0|1,0,1]=4 5520 B12R1.452 C=Cc1ccc(c(c1)O)C(=O)C 271570a_100011290941_100000188348 [0,2,0,0,0,0|0,0,1]=3 5521 B12R1.452 C=Cc1ccc(c(c1)O)C(=O)N 271570a_100011290941_100011550861 [0,2,0,0,0,0|0,0,1]=3 5522 B12R1.452 CC(=O)c1ccc(cc1Br)C#N 1458a_100010244945_200000210301 [0,2,0,0,0,0|1,0,1]=4 5523 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 34a_100012340537_200025704644 [0,2,0,0,0,0|1,0,0]=3 5524 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 7a_100012340537_200025704644 [0,2,0,0,0,0|1,0,0]=3 5525 B12R1.452 CC(=O)c1ccc(cc1C)C#N 1458a_100000691869_200000210301 [0,2,0,0,0,0|1,0,1]=4 5526 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 34a_100000702595_200025704644 [0,2,0,0,0,0|1,0,0]=3 5527 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 7a_100000702595_200025704644 [0,2,0,0,0,0|1,0,0]=3 5528 B12R1.452 CC(=O)c1ccc(cc1C)S[13CH3] 62a_100012360112_200025704644 [0,2,0,0,0,0|1,0,0]=3 5529 B12R1.452 CC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_100012360112 [0,2,0,0,0,0|1,0,0]=3 5530 B12R1.452 CC(=O)c1ccc(cc1Cl)C#N 1458a_100000100588_200000210301 [0,2,0,0,0,0|1,0,1]=4 5531 B12R1.452 CC(=O)c1ccc(cc1Cl)CO 1458a_100015659073_200000210301 [0,2,0,0,0,0|1,0,0]=3 5532 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 34a_100011933989_200025704644 [0,2,0,0,0,0|1,0,0]=3 5533 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 7a_100011933989_200025704644 [0,2,0,0,0,0|1,0,0]=3 5534 B12R1.452 CC(=O)c1ccc(cc1F)C#N 1458a_100000238375_200000210301 [0,2,0,0,0,0|1,0,1]=4 5535 B12R1.452 CC(=O)c1ccc(cc1F)CO 1458a_100011934814_200000210301 [0,2,0,0,0,0|1,0,0]=3 5536 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 34a_100000752407_200025704644 [0,2,0,0,0,0|1,0,0]=3 5537 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 7a_100000752407_200025704644 [0,2,0,0,0,0|1,0,0]=3 5538 B12R1.452 CC(=O)c1ccc(cc1F)S[13CH3] 62a_100000690205_200025704644 [0,2,0,0,0,0|1,0,0]=3 5539 B12R1.452 CC(=O)c1ccc(cc1N)S[13CH3] 62a_100011590516_200025704644 [0,2,0,0,0,0|1,0,0]=3 5540 B12R1.452 CC(=O)c1ncc(cc1F)S[13CH3] 62a_100000696590_200025704644 [0,2,0,0,0,0|2,0,0]=4 5541 B12R1.452 CC(=O)c1ncc(cc1F)S[13CH3] 62a_200025704644_100000696590 [0,2,0,0,0,0|2,0,0]=4 5542 B12R1.452 CCc1ccc(c(c1)F)C(=O)C 1458a_200009867912_200000210301 [0,2,0,0,0,0|1,0,0]=3 5543 B12R1.452 CCc1ccc(c(c1)F)C(=O)[13CH3] 1458a_200009867912_200025704644 [0,2,0,0,0,0|1,0,0]=3 5544 B12R1.452 CNc1cc(c(cn1)C(=O)N)C 27a_100102657272_200134614278 [0,2,0,0,0,0|2,0,0]=4 5545 B12R1.452 CNc1ccc(c(c1)Br)C(=O)N 27a_100102657272_200010146565 [0,2,0,0,0,0|1,0,0]=3 5546 B12R1.452 CNc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_200000210301 [0,2,0,0,0,0|2,0,0]=4 5547 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 27a_100102657272_100011327924 [0,2,0,0,0,0|1,0,0]=3 5548 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 34a_200000751758_200000210301 [0,2,0,0,0,0|1,0,0]=3 5549 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 7a_200000751758_200000210301 [0,2,0,0,0,0|1,0,0]=3 5550 B12R1.452 CNc1ccc(c(c1)C)[N+](=O)[O-] 34a_100000745639_200000210301 [0,2,0,0,0,0|2,0,0]=4 5551 B12R1.452 CNc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000745639_200000210301 [0,2,0,0,0,0|2,0,0]=4 5552 B12R1.452 CNc1ccc(c(c1)Cl)C(=O)N 34a_100000737725_200000210301 [0,2,0,0,0,0|1,0,0]=3 5553 B12R1.452 CNc1ccc(c(c1)Cl)C(=O)N 7a_100000737725_200000210301 [0,2,0,0,0,0|1,0,0]=3 5554 B12R1.452 CNc1ccc(c(c1)F)C(=O)C 27a_100102657272_100000690205 [0,2,0,0,0,0|1,0,0]=3 5555 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 27a_100102657272_100000216903 [0,2,0,0,0,0|1,0,0]=3 5556 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 34a_100000749959_200000210301 [0,2,0,0,0,0|1,0,0]=3 5557 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 7a_100000749959_200000210301 [0,2,0,0,0,0|1,0,0]=3 5558 B12R1.452 CNc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_200000210301 [0,2,0,0,0,0|2,0,0]=4 5559 B12R1.452 CNc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_200000210301 [0,2,0,0,0,0|2,0,0]=4 5560 B12R1.452 CNc1ccc(c(c1)O)C(=O)N 34a_100000223280_200000210301 [0,2,0,0,0,0|0,0,0]=2 5561 B12R1.452 CNc1ccc(c(c1)O)C(=O)N 7a_100000223280_200000210301 [0,2,0,0,0,0|0,0,0]=2 5562 B12R1.452 CNc1ccc(c(n1)N)C(=O)N 27a_100102657272_100009875182 [0,2,0,0,0,0|2,0,0]=4 5563 B12R1.452 CNc1cnc(c(c1)F)C(=O)N 27a_100102657272_200010161073 [0,2,0,0,0,0|2,0,0]=4 5564 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 1458a_100000748873_200000210301 [0,2,0,0,0,0|1,0,0]=3 5565 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 34a_100012340537_200000210301 [0,2,0,0,0,0|1,0,0]=3 5566 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 7a_100012340537_200000210301 [0,2,0,0,0,0|1,0,0]=3 5567 B12R1.452 COc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000748873_200025704644 [0,2,0,0,0,0|1,0,0]=3 5568 B12R1.452 COc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_200000210301 [0,2,0,0,0,0|2,0,0]=4 5569 B12R1.452 COc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_200000210301 [0,2,0,0,0,0|2,0,0]=4 5570 B12R1.452 COc1ccc(c(c1)C)C(=O)C 1458a_100000763155_200000210301 [0,2,0,0,0,0|1,0,0]=3 5571 B12R1.452 COc1ccc(c(c1)C)C(=O)C 34a_100000702595_200000210301 [0,2,0,0,0,0|1,0,0]=3 5572 B12R1.452 COc1ccc(c(c1)C)C(=O)C 7a_100000702595_200000210301 [0,2,0,0,0,0|1,0,0]=3 5573 B12R1.452 COc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000763155_200025704644 [0,2,0,0,0,0|1,0,0]=3 5574 B12R1.452 COc1ccc(c(c1)C)[N+](=O)[O-] 34a_100000195451_200000210301 [0,2,0,0,0,0|2,0,0]=4 5575 B12R1.452 COc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000195451_200000210301 [0,2,0,0,0,0|2,0,0]=4 5576 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 1458a_100000753557_200000210301 [0,2,0,0,0,0|1,0,0]=3 5577 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 34a_100011933989_200000210301 [0,2,0,0,0,0|1,0,0]=3 5578 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 7a_100011933989_200000210301 [0,2,0,0,0,0|1,0,0]=3 5579 B12R1.452 COc1ccc(c(c1)Cl)C(=O)N 34a_100011997949_200000210301 [0,2,0,0,0,0|1,0,0]=3 5580 B12R1.452 COc1ccc(c(c1)Cl)C(=O)N 7a_100011997949_200000210301 [0,2,0,0,0,0|1,0,0]=3 5581 B12R1.452 COc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000753557_200025704644 [0,2,0,0,0,0|1,0,0]=3 5582 B12R1.452 COc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_200000210301 [0,2,0,0,0,0|2,0,0]=4 5583 B12R1.452 COc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_200000210301 [0,2,0,0,0,0|2,0,0]=4 5584 B12R1.452 COc1ccc(c(c1)F)C(=O)C 1458a_100000198494_200000210301 [0,2,0,0,0,0|1,0,0]=3 5585 B12R1.452 COc1ccc(c(c1)F)C(=O)C 34a_100000752407_200000210301 [0,2,0,0,0,0|1,0,0]=3 5586 B12R1.452 COc1ccc(c(c1)F)C(=O)C 7a_100000752407_200000210301 [0,2,0,0,0,0|1,0,0]=3 5587 B12R1.452 COc1ccc(c(c1)F)C(=O)N 34a_200012186767_200000210301 [0,2,0,0,0,0|1,0,0]=3 5588 B12R1.452 COc1ccc(c(c1)F)C(=O)N 7a_200012186767_200000210301 [0,2,0,0,0,0|1,0,0]=3 5589 B12R1.452 COc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000198494_200025704644 [0,2,0,0,0,0|1,0,0]=3 5590 B12R1.452 COc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_200000210301 [0,2,0,0,0,0|2,0,0]=4 5591 B12R1.452 COc1ccc(c(c1)I)C(=O)C 1458a_100000688016_200000210301 [0,2,0,0,0,0|1,0,0]=3 5592 B12R1.452 COc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100000688016_200025704644 [0,2,0,0,0,0|1,0,0]=3 5593 B12R1.452 COc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_200000210301 [0,2,0,0,0,0|2,0,0]=4 5594 B12R1.452 COc1ccc(c(c1)N)C(=O)N 34a_100012186684_200000210301 [0,2,0,0,0,0|1,0,0]=3 5595 B12R1.452 COc1ccc(c(c1)N)C(=O)N 7a_100012186684_200000210301 [0,2,0,0,0,0|1,0,0]=3 5596 B12R1.452 COc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_200000210301 [0,2,0,0,0,0|2,0,0]=4 5597 B12R1.452 COc1ccc(c(c1)O)C(=O)C 1458a_100000212123_200000210301 [0,2,0,0,0,0|0,0,0]=2 5598 B12R1.452 COc1ccc(c(c1)O)C(=O)C 271570a_203496583355_100000697255 [0,2,0,0,0,0|0,0,0]=2 5599 B12R1.452 COc1ccc(c(c1)O)C(=O)N 271570a_203496583355_200009815664 [0,2,0,0,0,0|0,0,0]=2 5600 B12R1.452 COc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212123_200025704644 [0,2,0,0,0,0|0,0,0]=2 5601 B12R1.452 COc1ccc(c(c1)O)C(C)O 271570a_203496583355_100000697252 [0,2,0,0,0,0|0,0,2]=4 5602 B12R1.452 COc1ccc(c(c1)O)C(F)F 271570a_203496583355_100010189948 [0,2,0,0,0,0|1,0,1]=4 5603 B12R1.452 CSc1cc(c(cn1)C(=O)N)C 62a_200000210301_200134614278 [0,2,0,0,0,0|2,0,0]=4 5604 B12R1.452 CSc1cc(c(cn1)C(=O)N)C 62a_200134614278_200000210301 [0,2,0,0,0,0|2,0,0]=4 5605 B12R1.452 CSc1ccc(c(c1)Br)C(=O)N 62a_200010146565_200000210301 [0,2,0,0,0,0|1,0,0]=3 5606 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 1458a_100012278374_200000210301 [0,2,0,0,0,0|1,0,0]=3 5607 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 62a_100012360112_200000210301 [0,2,0,0,0,0|1,0,0]=3 5608 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 62a_200000210301_100012360112 [0,2,0,0,0,0|1,0,0]=3 5609 B12R1.452 CSc1ccc(c(c1)C)C(=O)N 62a_100011327924_200000210301 [0,2,0,0,0,0|1,0,0]=3 5610 B12R1.452 CSc1ccc(c(c1)C)C(=O)N 62a_200000210301_100011327924 [0,2,0,0,0,0|1,0,0]=3 5611 B12R1.452 CSc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100012278374_200025704644 [0,2,0,0,0,0|1,0,0]=3 5612 B12R1.452 CSc1ccc(c(c1)F)C(=O)C 62a_100000690205_200000210301 [0,2,0,0,0,0|1,0,0]=3 5613 B12R1.452 CSc1ccc(c(c1)F)C(=O)N 62a_100000216903_200000210301 [0,2,0,0,0,0|1,0,0]=3 5614 B12R1.452 CSc1ccc(c(c1)N)C(=O)C 62a_100011590516_200000210301 [0,2,0,0,0,0|1,0,0]=3 5615 B12R1.452 CSc1ccc(c(c1)N)C(=O)N 62a_100012349972_200000210301 [0,2,0,0,0,0|1,0,0]=3 5616 B12R1.452 CSc1ccc(c(c1)O)B(O)O 62a_200000210301_100010158982 [0,2,0,0,0,0|1,0,1]=4 5617 B12R1.452 CSc1ccc(c(c1)O)C(=O)N 62a_100011550861_200000210301 [0,2,0,0,0,0|0,0,0]=2 5618 B12R1.452 CSc1ccc(c(n1)N)C(=O)N 62a_100009875182_200000210301 [0,2,0,0,0,0|2,0,0]=4 5619 B12R1.452 CSc1cnc(c(c1)F)C(=O)C 62a_100000696590_200000210301 [0,2,0,0,0,0|2,0,0]=4 5620 B12R1.452 CSc1cnc(c(c1)F)C(=O)C 62a_200000210301_100000696590 [0,2,0,0,0,0|2,0,0]=4 5621 B12R1.452 CSc1cnc(c(c1)F)C(=O)N 62a_200000210301_200010161073 [0,2,0,0,0,0|2,0,0]=4 5622 B12R1.452 CSc1cnc(c(c1)F)C(=O)N 62a_200010161073_200000210301 [0,2,0,0,0,0|2,0,0]=4 5623 B12R1.452 CSc1cnc(c(c1)N)C(=O)N 62a_100010235749_200000210301 [0,2,0,0,0,0|2,0,0]=4 5624 B12R1.452 CSc1cnc(c(c1)N)C(=O)N 62a_200000210301_100010235749 [0,2,0,0,0,0|2,0,0]=4 5625 B12R1.452 Cc1cc(ccc1C(=O)N)N[13CH3] 34a_200000751758_200025704644 [0,2,0,0,0,0|1,0,0]=3 5626 B12R1.452 Cc1cc(ccc1C(=O)N)N[13CH3] 7a_200000751758_200025704644 [0,2,0,0,0,0|1,0,0]=3 5627 B12R1.452 Cc1cc(ccc1C(=O)N)S[13CH3] 62a_100011327924_200025704644 [0,2,0,0,0,0|1,0,0]=3 5628 B12R1.452 Cc1cc(ccc1C(=O)N)S[13CH3] 62a_200025704644_100011327924 [0,2,0,0,0,0|1,0,0]=3 5629 B12R1.452 Cc1cc(ccc1C(=O)[13CH3])C#N 1458a_100000691869_200025704644 [0,2,0,0,0,0|1,0,1]=4 5630 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])N[13CH3] 34a_100000745639_200025704644 [0,2,0,0,0,0|2,0,0]=4 5631 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])N[13CH3] 7a_100000745639_200025704644 [0,2,0,0,0,0|2,0,0]=4 5632 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])O[13CH3] 34a_100000195451_200025704644 [0,2,0,0,0,0|2,0,0]=4 5633 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])O[13CH3] 7a_100000195451_200025704644 [0,2,0,0,0,0|2,0,0]=4 5634 B12R1.452 Cc1cc(ncc1C(=O)N)S[13CH3] 62a_200025704644_200134614278 [0,2,0,0,0,0|2,0,0]=4 5635 B12R1.452 Cc1cc(ncc1C(=O)N)S[13CH3] 62a_200134614278_200025704644 [0,2,0,0,0,0|2,0,0]=4 5636 B12R1.452 [13CH3]C(=O)c1ccc(cc1Br)C#N 1458a_100010244945_200025704644 [0,2,0,0,0,0|1,0,1]=4 5637 B12R1.452 [13CH3]C(=O)c1ccc(cc1Cl)C#N 1458a_100000100588_200025704644 [0,2,0,0,0,0|1,0,1]=4 5638 B12R1.452 [13CH3]C(=O)c1ccc(cc1Cl)CO 1458a_100015659073_200025704644 [0,2,0,0,0,0|1,0,0]=3 5639 B12R1.452 [13CH3]C(=O)c1ccc(cc1F)C#N 1458a_100000238375_200025704644 [0,2,0,0,0,0|1,0,1]=4 5640 B12R1.452 [13CH3]C(=O)c1ccc(cc1F)CO 1458a_100011934814_200025704644 [0,2,0,0,0,0|1,0,0]=3 5641 B12R1.452 [13CH3]Nc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_200025704644 [0,2,0,0,0,0|2,0,0]=4 5642 B12R1.452 [13CH3]Nc1ccc(c(c1)Cl)C(=O)N 34a_100000737725_200025704644 [0,2,0,0,0,0|1,0,0]=3 5643 B12R1.452 [13CH3]Nc1ccc(c(c1)Cl)C(=O)N 7a_100000737725_200025704644 [0,2,0,0,0,0|1,0,0]=3 5644 B12R1.452 [13CH3]Nc1ccc(c(c1)F)C(=O)N 34a_100000749959_200025704644 [0,2,0,0,0,0|1,0,0]=3 5645 B12R1.452 [13CH3]Nc1ccc(c(c1)F)C(=O)N 7a_100000749959_200025704644 [0,2,0,0,0,0|1,0,0]=3 5646 B12R1.452 [13CH3]Nc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_200025704644 [0,2,0,0,0,0|2,0,0]=4 5647 B12R1.452 [13CH3]Nc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_200025704644 [0,2,0,0,0,0|2,0,0]=4 5648 B12R1.452 [13CH3]Nc1ccc(c(c1)O)C(=O)N 34a_100000223280_200025704644 [0,2,0,0,0,0|0,0,0]=2 5649 B12R1.452 [13CH3]Nc1ccc(c(c1)O)C(=O)N 7a_100000223280_200025704644 [0,2,0,0,0,0|0,0,0]=2 5650 B12R1.452 [13CH3]Oc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_200025704644 [0,2,0,0,0,0|2,0,0]=4 5651 B12R1.452 [13CH3]Oc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_200025704644 [0,2,0,0,0,0|2,0,0]=4 5652 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)C(=O)N 34a_100011997949_200025704644 [0,2,0,0,0,0|1,0,0]=3 5653 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)C(=O)N 7a_100011997949_200025704644 [0,2,0,0,0,0|1,0,0]=3 5654 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_200025704644 [0,2,0,0,0,0|2,0,0]=4 5655 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_200025704644 [0,2,0,0,0,0|2,0,0]=4 5656 B12R1.452 [13CH3]Oc1ccc(c(c1)F)C(=O)N 34a_200012186767_200025704644 [0,2,0,0,0,0|1,0,0]=3 5657 B12R1.452 [13CH3]Oc1ccc(c(c1)F)C(=O)N 7a_200012186767_200025704644 [0,2,0,0,0,0|1,0,0]=3 5658 B12R1.452 [13CH3]Oc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_200025704644 [0,2,0,0,0,0|2,0,0]=4 5659 B12R1.452 [13CH3]Oc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_200025704644 [0,2,0,0,0,0|2,0,0]=4 5660 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 34a_100012186684_200025704644 [0,2,0,0,0,0|1,0,0]=3 5661 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 7a_100012186684_200025704644 [0,2,0,0,0,0|1,0,0]=3 5662 B12R1.452 [13CH3]Oc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_200025704644 [0,2,0,0,0,0|2,0,0]=4 5663 B12R1.452 [13CH3]Sc1ccc(c(c1)Br)C(=O)N 62a_200010146565_200025704644 [0,2,0,0,0,0|1,0,0]=3 5664 B12R1.452 [13CH3]Sc1ccc(c(c1)F)C(=O)N 62a_100000216903_200025704644 [0,2,0,0,0,0|1,0,0]=3 5665 B12R1.452 [13CH3]Sc1ccc(c(c1)N)C(=O)N 62a_100012349972_200025704644 [0,2,0,0,0,0|1,0,0]=3 5666 B12R1.452 [13CH3]Sc1ccc(c(c1)O)B(O)O 62a_200025704644_100010158982 [0,2,0,0,0,0|1,0,1]=4 5667 B12R1.452 [13CH3]Sc1ccc(c(c1)O)C(=O)N 62a_100011550861_200025704644 [0,2,0,0,0,0|0,0,0]=2 5668 B12R1.452 [13CH3]Sc1ccc(c(n1)N)C(=O)N 62a_100009875182_200025704644 [0,2,0,0,0,0|2,0,0]=4 5669 B12R1.452 [13CH3]Sc1cnc(c(c1)F)C(=O)N 62a_200010161073_200025704644 [0,2,0,0,0,0|2,0,0]=4 5670 B12R1.452 [13CH3]Sc1cnc(c(c1)F)C(=O)N 62a_200025704644_200010161073 [0,2,0,0,0,0|2,0,0]=4 5671 B12R1.452 [13CH3]Sc1cnc(c(c1)N)C(=O)N 62a_100010235749_200025704644 [0,2,0,0,0,0|2,0,0]=4 5672 B12R1.452 [13CH3]Sc1cnc(c(c1)N)C(=O)N 62a_200025704644_100010235749 [0,2,0,0,0,0|2,0,0]=4 5673 B12R1.893 C=C(C)c1ccc(c(c1C)N)C 271570a_100000694244_200010074581 [0,2,0,0,0,0|2,0,0]=4 5674 B12R1.893 C=C(C)c1ccc(c(c1F)C)C 271570a_100000694244_200015555822 [0,2,0,0,0,0|2,0,0]=4 5675 B12R1.893 C=C(C)c1ccc(c(c1F)F)C 271570a_100000694244_100012766498 [0,2,0,0,0,0|2,0,0]=4 5676 B12R1.893 C=C(C)c1ccc(c(c1O)C)F 271570a_100000694244_200010391124 [0,2,0,0,0,0|2,0,0]=4 5677 B12R1.893 C=C(C)c1ccc(c(c1O)F)C 271570a_100000694244_100000722096 [0,2,0,0,0,0|1,0,0]=3 5678 B12R1.893 C=C(C)c1ccc(c(c1O)F)F 271570a_100000694244_100010243909 [0,2,0,0,0,0|2,0,0]=4 5679 B12R1.893 CC(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_200000210301 [0,2,0,0,0,0|2,0,0]=4 5680 B12R1.893 CC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_200000210301 [0,2,0,0,0,0|2,0,0]=4 5681 B12R1.893 CC(=O)c1ccc(c(c1C)F)F 1458a_100000061971_200000210301 [0,2,0,0,0,0|2,0,0]=4 5682 B12R1.893 CC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_200000210301 [0,2,0,0,0,0|2,0,0]=4 5683 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_200000210301 [0,2,0,0,0,0|2,0,0]=4 5684 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)F 1458a_100000061447_200000210301 [0,2,0,0,0,0|2,0,0]=4 5685 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_200000210301 [0,2,0,0,0,0|2,0,0]=4 5686 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_200000210301 [0,2,0,0,0,0|2,0,0]=4 5687 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_200000210301 [0,2,0,0,0,0|2,0,0]=4 5688 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_200000210301 [0,2,0,0,0,0|2,0,0]=4 5689 B12R1.893 CC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200000210301 [0,2,0,0,0,0|2,0,0]=4 5690 B12R1.893 CC(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_200000210301 [0,2,0,0,0,0|2,0,0]=4 5691 B12R1.893 CC(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_200000210301 [0,2,0,0,0,0|2,0,0]=4 5692 B12R1.893 CC(=O)c1ccc(c(c1F)C)Br 1458a_100000722919_200000210301 [0,2,0,0,0,0|2,0,0]=4 5693 B12R1.893 CC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_200000210301 [0,2,0,0,0,0|1,0,0]=3 5694 B12R1.893 CC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_200000210301 [0,2,0,0,0,0|2,0,0]=4 5695 B12R1.893 CC(=O)c1ccc(c(c1F)C)F 1458a_100000067293_200000210301 [0,2,0,0,0,0|2,0,0]=4 5696 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_200000210301 [0,2,0,0,0,0|2,0,0]=4 5697 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)C 1458a_100000722910_200000210301 [0,2,0,0,0,0|1,0,0]=3 5698 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_200000210301 [0,2,0,0,0,0|2,0,0]=4 5699 B12R1.893 CC(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_200000210301 [0,2,0,0,0,0|2,0,0]=4 5700 B12R1.893 CC(=O)c1ccc(c(c1F)F)C 1458a_100011219789_200000210301 [0,2,0,0,0,0|1,0,0]=3 5701 B12R1.893 CC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_200000210301 [0,2,0,0,0,0|2,0,0]=4 5702 B12R1.893 CC(=O)c1ccc(c(c1F)F)F 1458a_100000766628_200000210301 [0,2,0,0,0,0|2,0,0]=4 5703 B12R1.893 CC(=O)c1ccc(c(c1F)F)I 1458a_100010177778_200000210301 [0,2,0,0,0,0|2,0,0]=4 5704 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200000210301 [0,2,0,0,0,0|2,0,0]=4 5705 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010174444 [0,2,0,0,0,0|2,0,0]=4 5706 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_200000210301 [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 271570a_203496583355_100010179980 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.893 CC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_200000210301 [0,2,0,0,0,0|1,0,0]=3 5709 B12R1.893 CC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_200000210301 [0,2,0,0,0,0|0,0,0]=2 5710 B12R1.893 CC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200000210301 [0,2,0,0,0,0|1,0,0]=3 5711 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200000210301 [0,2,0,0,0,0|1,0,0]=3 5712 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_200013857550 [0,2,0,0,0,0|1,0,0]=3 5713 B12R1.893 CC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200000210301 [0,2,0,0,0,0|1,0,0]=3 5714 B12R1.893 Cc1c(ccc(c1Cl)C(=O)[13CH3])Cl 1458a_100010074829_200025704644 [0,2,0,0,0,0|2,0,0]=4 5715 B12R1.893 Cc1c(ccc(c1Cl)C(=O)[13CH3])F 1458a_100000061447_200025704644 [0,2,0,0,0,0|2,0,0]=4 5716 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])Br 1458a_100000722919_200025704644 [0,2,0,0,0,0|2,0,0]=4 5717 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_100012183103_200025704644 [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])F 1458a_100000067293_200025704644 [0,2,0,0,0,0|2,0,0]=4 5719 B12R1.893 Cc1c(ccc(c1F)F)C(=O)[13CH3] 1458a_100000061971_200025704644 [0,2,0,0,0,0|2,0,0]=4 5720 B12R1.893 Cc1ccc(c(c1C)F)C(=O)[13CH3] 1458a_100010768504_200025704644 [0,2,0,0,0,0|1,0,0]=3 5721 B12R1.893 Cc1ccc(c(c1C)I)C(=O)[13CH3] 1458a_100010188221_200025704644 [0,2,0,0,0,0|1,0,0]=3 5722 B12R1.893 Cc1ccc(c(c1C)O)C(=O)[13CH3] 1458a_100000742916_200025704644 [0,2,0,0,0,0|0,0,0]=2 5723 B12R1.893 Cc1ccc(c(c1Cl)F)C(=O)[13CH3] 1458a_100000722910_200025704644 [0,2,0,0,0,0|1,0,0]=3 5724 B12R1.893 Cc1ccc(c(c1F)F)C(=O)[13CH3] 1458a_100011219789_200025704644 [0,2,0,0,0,0|1,0,0]=3 5725 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_200025704644 [0,2,0,0,0,0|2,0,0]=4 5726 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_200025704644 [0,2,0,0,0,0|2,0,0]=4 5727 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_200025704644 [0,2,0,0,0,0|2,0,0]=4 5728 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_200025704644 [0,2,0,0,0,0|2,0,0]=4 5729 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_200025704644 [0,2,0,0,0,0|2,0,0]=4 5730 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_200025704644 [0,2,0,0,0,0|2,0,0]=4 5731 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_200025704644 [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200025704644 [0,2,0,0,0,0|2,0,0]=4 5733 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_200025704644 [0,2,0,0,0,0|2,0,0]=4 5734 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_200025704644 [0,2,0,0,0,0|2,0,0]=4 5735 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_200025704644 [0,2,0,0,0,0|2,0,0]=4 5736 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_200025704644 [0,2,0,0,0,0|2,0,0]=4 5737 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_200025704644 [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_200025704644 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)F 1458a_100000766628_200025704644 [0,2,0,0,0,0|2,0,0]=4 5740 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)I 1458a_100010177778_200025704644 [0,2,0,0,0,0|2,0,0]=4 5741 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200025704644 [0,2,0,0,0,0|2,0,0]=4 5742 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)O)F 1458a_100000084588_200025704644 [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200025704644 [0,2,0,0,0,0|1,0,0]=3 5744 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200025704644 [0,2,0,0,0,0|1,0,0]=3 5745 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200025704644 [0,2,0,0,0,0|1,0,0]=3 5746 B12R1.1000 C=C(C)c1c(cc(cc1Br)C)Br 271570a_100000694244_200011219743 [0,2,0,0,0,0|2,0,0]=4 5747 B12R1.1000 C=C(C)c1c(cc(cc1Br)C)C 271570a_100000694244_200012353697 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.1000 C=C(C)c1c(cc(cc1Br)C)F 271570a_100000694244_100010208195 [0,2,0,0,0,0|2,0,0]=4 5749 B12R1.1000 C=C(C)c1c(cc(cc1C)C)C 271570a_100000694244_100011204320 [0,2,0,0,0,0|2,0,0]=4 5750 B12R1.1000 C=C(C)c1c(cc(cc1F)C)F 271570a_100000694244_100015306127 [0,2,0,0,0,0|2,0,0]=4 5751 B12R1.1000 C=C(C)c1c(cc(cc1F)C)N 271570a_100000694244_100021129147 [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.1000 C=C(C)c1c(cc(cc1F)F)O 271570a_100000694244_100009815984 [0,2,0,0,0,0|2,0,0]=4 5753 B12R1.1000 C=C(C)c1c(cc(cc1O)C)C 271570a_100000694244_100010342985 [0,2,0,0,0,0|1,0,0]=3 5754 B12R1.1000 C=C(C)c1c(cc(cc1O)Cl)C 271570a_100000694244_100010254216 [0,2,0,0,0,0|2,0,0]=4 5755 B12R1.1000 C=C(C)c1c(cc(cc1O)O)O 271570a_100000694244_200010341185 [0,2,0,0,0,0|2,0,0]=4 5756 B12R1.1000 CC(=O)c1c(cc(cc1Br)Br)Br 1458a_100011217931_200000210301 [0,2,0,0,0,0|2,0,0]=4 5757 B12R1.1000 CC(=O)c1c(cc(cc1Br)Br)F 1458a_100009813784_200000210301 [0,2,0,0,0,0|2,0,0]=4 5758 B12R1.1000 CC(=O)c1c(cc(cc1Br)C)F 1458a_100010768510_200000210301 [0,2,0,0,0,0|1,0,0]=3 5759 B12R1.1000 CC(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_200000210301 [0,2,0,0,0,0|2,0,0]=4 5760 B12R1.1000 CC(=O)c1c(cc(cc1Br)F)Br 1458a_200015320377_200000210301 [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.1000 CC(=O)c1c(cc(cc1Br)F)C 1458a_100010204434_200000210301 [0,2,0,0,0,0|2,0,0]=4 5762 B12R1.1000 CC(=O)c1c(cc(cc1Br)F)F 1458a_100013316034_200000210301 [0,2,0,0,0,0|2,0,0]=4 5763 B12R1.1000 CC(=O)c1c(cc(cc1C)Br)C 1458a_100000739581_200000210301 [0,2,0,0,0,0|2,0,0]=4 5764 B12R1.1000 CC(=O)c1c(cc(cc1C)C)C 1458a_100000211658_200000210301 [0,2,0,0,0,0|1,0,0]=3 5765 B12R1.1000 CC(=O)c1c(cc(cc1C)Cl)C 1458a_100000088873_200000210301 [0,2,0,0,0,0|2,0,0]=4 5766 B12R1.1000 CC(=O)c1c(cc(cc1C)F)C 1458a_100012017201_200000210301 [0,2,0,0,0,0|2,0,0]=4 5767 B12R1.1000 CC(=O)c1c(cc(cc1C)O)C 1458a_100000066486_200000210301 [0,2,0,0,0,0|2,0,0]=4 5768 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Br)C 1458a_100000698028_200000210301 [0,2,0,0,0,0|2,0,0]=4 5769 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Br)Cl 1458a_100012360385_200000210301 [0,2,0,0,0,0|2,0,0]=4 5770 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Br)F 1458a_100010078411_200000210301 [0,2,0,0,0,0|2,0,0]=4 5771 B12R1.1000 CC(=O)c1c(cc(cc1Cl)C)Cl 1458a_100009989429_200000210301 [0,2,0,0,0,0|1,0,0]=3 5772 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_200000210301 [0,2,0,0,0,0|2,0,0]=4 5773 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_200000210301 [0,2,0,0,0,0|2,0,0]=4 5774 B12R1.1000 CC(=O)c1c(cc(cc1Cl)F)Cl 1458a_100000703918_200000210301 [0,2,0,0,0,0|2,0,0]=4 5775 B12R1.1000 CC(=O)c1c(cc(cc1Cl)F)F 1458a_100000119028_200000210301 [0,2,0,0,0,0|2,0,0]=4 5776 B12R1.1000 CC(=O)c1c(cc(cc1Cl)I)Cl 1458a_100010740244_200000210301 [0,2,0,0,0,0|2,0,0]=4 5777 B12R1.1000 CC(=O)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_200000210301 [0,2,0,0,0,0|2,0,0]=4 5778 B12R1.1000 CC(=O)c1c(cc(cc1F)Br)C 1458a_100000708665_200000210301 [0,2,0,0,0,0|2,0,0]=4 5779 B12R1.1000 CC(=O)c1c(cc(cc1F)Br)F 1458a_100000766946_200000210301 [0,2,0,0,0,0|2,0,0]=4 5780 B12R1.1000 CC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_200000210301 [0,2,0,0,0,0|1,0,0]=3 5781 B12R1.1000 CC(=O)c1c(cc(cc1F)C)F 1458a_100009878570_200000210301 [0,2,0,0,0,0|1,0,0]=3 5782 B12R1.1000 CC(=O)c1c(cc(cc1F)Cl)C 1458a_100010768517_200000210301 [0,2,0,0,0,0|2,0,0]=4 5783 B12R1.1000 CC(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_200000210301 [0,2,0,0,0,0|2,0,0]=4 5784 B12R1.1000 CC(=O)c1c(cc(cc1F)F)F 1458a_100000751013_200000210301 [0,2,0,0,0,0|2,0,0]=4 5785 B12R1.1000 CC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_200000210301 [0,2,0,0,0,0|1,0,0]=3 5786 B12R1.1000 CC(=O)c1c(cc(cc1F)O)F 1458a_100000038755_200000210301 [0,2,0,0,0,0|2,0,0]=4 5787 B12R1.1000 CC(=O)c1c(cc(cc1F)O)F 271570a_203496583355_100012706838 [0,2,0,0,0,0|2,0,0]=4 5788 B12R1.1000 CC(=O)c1c(cc(cc1F)O)O 271570a_203496583355_100010734142 [0,2,0,0,0,0|1,0,0]=3 5789 B12R1.1000 CC(=O)c1c(cc(cc1I)C)I 1458a_200010371430_200000210301 [0,2,0,0,0,0|1,0,0]=3 5790 B12R1.1000 CC(=O)c1c(cc(cc1I)F)C 1458a_200010371433_200000210301 [0,2,0,0,0,0|2,0,0]=4 5791 B12R1.1000 CC(=O)c1c(cc(cc1O)C)C 1458a_100011255216_200000210301 [0,2,0,0,0,0|0,0,0]=2 5792 B12R1.1000 CC(=O)c1c(cc(cc1O)C)O 1458a_100000036929_200000210301 [0,2,0,0,0,0|0,0,0]=2 5793 B12R1.1000 CC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_200000210301 [0,2,0,0,0,0|1,0,0]=3 5794 B12R1.1000 Cc1cc(c(c(c1)Br)C(=O)[13CH3])F 1458a_100010768510_200025704644 [0,2,0,0,0,0|1,0,0]=3 5795 B12R1.1000 Cc1cc(c(c(c1)C)C(=O)[13CH3])C 1458a_100000211658_200025704644 [0,2,0,0,0,0|1,0,0]=3 5796 B12R1.1000 Cc1cc(c(c(c1)Cl)C(=O)[13CH3])Cl 1458a_100009989429_200025704644 [0,2,0,0,0,0|1,0,0]=3 5797 B12R1.1000 Cc1cc(c(c(c1)F)C(=O)[13CH3])F 1458a_100009878570_200025704644 [0,2,0,0,0,0|1,0,0]=3 5798 B12R1.1000 Cc1cc(c(c(c1)I)C(=O)[13CH3])I 1458a_200010371430_200025704644 [0,2,0,0,0,0|1,0,0]=3 5799 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)[13CH3])C 1458a_100011255216_200025704644 [0,2,0,0,0,0|0,0,0]=2 5800 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)[13CH3])O 1458a_100000036929_200025704644 [0,2,0,0,0,0|0,0,0]=2 5801 B12R1.1000 Cc1cc(c(c(n1)O)C(=O)N)C 271570a_203496583355_100000017153 [0,2,0,0,0,0|1,0,0]=3 5802 B12R1.1000 Cc1cc(cc(c1C(=O)N)F)O 271570a_203496583355_100016096366 [0,2,0,0,0,0|2,0,0]=4 5803 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])Br)F 1458a_100010204434_200025704644 [0,2,0,0,0,0|2,0,0]=4 5804 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])C)Br 1458a_100000739581_200025704644 [0,2,0,0,0,0|2,0,0]=4 5805 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])C)Cl 1458a_100000088873_200025704644 [0,2,0,0,0,0|2,0,0]=4 5806 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])C)F 1458a_100012017201_200025704644 [0,2,0,0,0,0|2,0,0]=4 5807 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])C)O 1458a_100000066486_200025704644 [0,2,0,0,0,0|2,0,0]=4 5808 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])Cl)Br 1458a_100000698028_200025704644 [0,2,0,0,0,0|2,0,0]=4 5809 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])F)Br 1458a_100000708665_200025704644 [0,2,0,0,0,0|2,0,0]=4 5810 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])F)Cl 1458a_100010768517_200025704644 [0,2,0,0,0,0|2,0,0]=4 5811 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])I)F 1458a_200010371433_200025704644 [0,2,0,0,0,0|2,0,0]=4 5812 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])O)O 1458a_200000061528_200025704644 [0,2,0,0,0,0|1,0,0]=3 5813 B12R1.1000 NC(=O)c1c(cc(cc1F)O)F 271570a_203496583355_100000695656 [0,2,0,0,0,0|2,0,0]=4 5814 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)Br)Br 1458a_100011217931_200025704644 [0,2,0,0,0,0|2,0,0]=4 5815 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)Br)F 1458a_100009813784_200025704644 [0,2,0,0,0,0|2,0,0]=4 5816 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_200025704644 [0,2,0,0,0,0|2,0,0]=4 5817 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)F)Br 1458a_200015320377_200025704644 [0,2,0,0,0,0|2,0,0]=4 5818 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)F)F 1458a_100013316034_200025704644 [0,2,0,0,0,0|2,0,0]=4 5819 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)Br)Cl 1458a_100012360385_200025704644 [0,2,0,0,0,0|2,0,0]=4 5820 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)Br)F 1458a_100010078411_200025704644 [0,2,0,0,0,0|2,0,0]=4 5821 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_200025704644 [0,2,0,0,0,0|2,0,0]=4 5822 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_200025704644 [0,2,0,0,0,0|2,0,0]=4 5823 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)F)Cl 1458a_100000703918_200025704644 [0,2,0,0,0,0|2,0,0]=4 5824 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)F)F 1458a_100000119028_200025704644 [0,2,0,0,0,0|2,0,0]=4 5825 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)I)Cl 1458a_100010740244_200025704644 [0,2,0,0,0,0|2,0,0]=4 5826 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_200025704644 [0,2,0,0,0,0|2,0,0]=4 5827 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)Br)F 1458a_100000766946_200025704644 [0,2,0,0,0,0|2,0,0]=4 5828 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_200025704644 [0,2,0,0,0,0|1,0,0]=3 5829 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_200025704644 [0,2,0,0,0,0|2,0,0]=4 5830 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)F)F 1458a_100000751013_200025704644 [0,2,0,0,0,0|2,0,0]=4 5831 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)F)O 1458a_100000746385_200025704644 [0,2,0,0,0,0|1,0,0]=3 5832 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)O)F 1458a_100000038755_200025704644 [0,2,0,0,0,0|2,0,0]=4 5833 B12R1.14 CNc1cc(c(c(c1O)Cl)C)Cl 34a_100000011795_200000210301 [0,2,0,0,0,0|2,0,0]=4 5834 B12R1.14 Cc1c(cc(c(c1Cl)O)N[13CH3])Cl 34a_100000011795_200025704644 [0,2,0,0,0,0|2,0,0]=4 5835 B12R1.14 O=Cc1cc(c(c(c1F)O)F)F 271570a_203496583355_100009864613 [0,2,0,0,0,0|2,0,0]=4 5836 B12R1.98 C=Cc1c(cc(c(c1C)F)C)C 271570a_100011290941_100010738083 [0,2,0,0,0,0|2,0,0]=4 5837 B12R1.98 C=Cc1c(cc(c(c1C)N)C)C 271570a_100011290941_100011215665 [0,2,0,0,0,0|2,0,0]=4 5838 B12R1.98 Cc1c(cc(c(c1F)C=O)O)F 271570a_203496583355_200021237120 [0,2,0,0,0,0|1,0,0]=3 5839 B12R1.98 O=Cc1c(cc(c(c1F)F)F)O 271570a_203496583355_100010201842 [0,2,0,0,0,0|1,0,0]=3 5840 B12R1.98 O=Cc1c(cc(c(c1F)F)O)F 271570a_203496583355_100009813757 [0,2,0,0,0,0|2,0,0]=4 5841 B12R1.449 C=Cc1cc(c(cc1C)F)C=O 271570a_100011290941_100010138641 [0,2,0,0,0,0|1,0,0]=3 5842 B12R1.449 C=Cc1cc(c(cc1F)F)C=O 271570a_100011290941_100009814802 [0,2,0,0,0,0|2,0,0]=4 5843 B12R1.449 C=Cc1cc(c(cc1F)N)C=O 271570a_100011290941_200010571964 [0,2,0,0,0,0|2,0,0]=4 5844 B12R1.449 C=Cc1cc(c(cc1F)O)C=O 271570a_100011290941_100010175118 [0,2,0,0,0,0|1,0,0]=3 5845 B12R1.449 C=Cc1cc(c(cc1N)C)OC 271570a_100011290941_200010584344 [0,2,0,0,0,0|2,0,0]=4 5846 B12R1.449 C=Cc1cc(c(cc1O)F)C#N 271570a_100011290941_100011015635 [0,2,0,0,0,0|2,0,0]=4 5847 B12R1.449 C=Cc1cc(c(cc1O)O)C=O 271570a_100011290941_200010132312 [0,2,0,0,0,0|1,0,0]=3 5848 B12R1.449 COc1cc(c(cc1F)O)C=O 271570a_203496583355_100010366953 [0,2,0,0,0,0|1,0,0]=3 5849 B12R1.449 COc1cc(c(cc1O)F)C=O 271570a_203496583355_100000695681 [0,2,0,0,0,0|2,0,0]=4 5850 B12R1.449 COc1cc(c(cc1O)O)C=O 271570a_203496583355_100000741691 [0,2,0,0,0,0|1,0,0]=3 5851 B12R1.449 COc1cc(c(cc1O)O)C=O 271570a_203496583355_100010762608 [0,2,0,0,0,0|1,0,0]=3 5852 B12R1.449 CSc1cc(c(cc1C)F)C=O 62a_100010138641_200000210301 [0,2,0,0,0,0|1,0,0]=3 5853 B12R1.449 CSc1cc(c(cc1C)F)C=O 62a_200000210301_100010138641 [0,2,0,0,0,0|1,0,0]=3 5854 B12R1.449 CSc1cc(c(cc1F)F)C=O 62a_100009814802_200000210301 [0,2,0,0,0,0|2,0,0]=4 5855 B12R1.449 CSc1cc(c(cc1F)F)C=O 62a_200000210301_100009814802 [0,2,0,0,0,0|2,0,0]=4 5856 B12R1.449 CSc1cc(c(cc1F)N)C=O 62a_200000210301_200010571964 [0,2,0,0,0,0|2,0,0]=4 5857 B12R1.449 CSc1cc(c(cc1F)N)C=O 62a_200010571964_200000210301 [0,2,0,0,0,0|2,0,0]=4 5858 B12R1.449 CSc1cc(c(cc1F)O)C=O 62a_100010175118_200000210301 [0,2,0,0,0,0|1,0,0]=3 5859 B12R1.449 CSc1cc(c(cc1F)O)C=O 62a_200000210301_100010175118 [0,2,0,0,0,0|1,0,0]=3 5860 B12R1.449 CSc1cc(c(cc1O)O)C=O 62a_200000210301_200010132312 [0,2,0,0,0,0|1,0,0]=3 5861 B12R1.449 Cc1cc(c(cc1S[13CH3])C=O)F 62a_100010138641_200025704644 [0,2,0,0,0,0|1,0,0]=3 5862 B12R1.449 Cc1cc(c(cc1S[13CH3])C=O)F 62a_200025704644_100010138641 [0,2,0,0,0,0|1,0,0]=3 5863 B12R1.449 [13CH3]Sc1cc(c(cc1F)F)C=O 62a_100009814802_200025704644 [0,2,0,0,0,0|2,0,0]=4 5864 B12R1.449 [13CH3]Sc1cc(c(cc1F)F)C=O 62a_200025704644_100009814802 [0,2,0,0,0,0|2,0,0]=4 5865 B12R1.449 [13CH3]Sc1cc(c(cc1F)N)C=O 62a_200010571964_200025704644 [0,2,0,0,0,0|2,0,0]=4 5866 B12R1.449 [13CH3]Sc1cc(c(cc1F)N)C=O 62a_200025704644_200010571964 [0,2,0,0,0,0|2,0,0]=4 5867 B12R1.449 [13CH3]Sc1cc(c(cc1F)O)C=O 62a_100010175118_200025704644 [0,2,0,0,0,0|1,0,0]=3 5868 B12R1.449 [13CH3]Sc1cc(c(cc1F)O)C=O 62a_200025704644_100010175118 [0,2,0,0,0,0|1,0,0]=3 5869 B12R1.449 [13CH3]Sc1cc(c(cc1O)O)C=O 62a_200025704644_200010132312 [0,2,0,0,0,0|1,0,0]=3 5870 B12R1.450 C=Cc1cc(c(cc1C)C=O)C 271570a_100011290941_100012024176 [0,2,0,0,0,0|1,0,1]=4 5871 B12R1.450 C=Cc1cc(c(cc1C)C=O)F 271570a_100011290941_100010186291 [0,2,0,0,0,0|1,0,1]=4 5872 B12R1.450 C=Cc1cc(c(cc1C)C=O)O 271570a_100011290941_200010762526 [0,2,0,0,0,0|0,0,1]=3 5873 B12R1.450 C=Cc1cc(c(cc1C)OC)C 271570a_100011290941_100000698960 [0,2,0,0,0,0|2,0,0]=4 5874 B12R1.450 C=Cc1cc(c(cc1C)OC)F 271570a_100011290941_100010074640 [0,2,0,0,0,0|2,0,0]=4 5875 B12R1.450 C=Cc1cc(c(cc1Cl)OC)N 271570a_100011290941_100011011177 [0,2,0,0,0,0|2,0,0]=4 5876 B12R1.450 C=Cc1cc(c(cc1F)C=O)C 271570a_100011290941_100010186292 [0,2,0,0,0,0|1,0,1]=4 5877 B12R1.450 C=Cc1cc(c(cc1F)C=O)F 271570a_100011290941_100011998483 [0,2,0,0,0,0|1,0,1]=4 5878 B12R1.450 C=Cc1cc(c(cc1F)C=O)O 271570a_100011290941_200010762562 [0,2,0,0,0,0|0,0,1]=3 5879 B12R1.450 C=Cc1cc(c(cc1F)CO)F 271570a_100011290941_100012024398 [0,2,0,0,0,0|2,0,0]=4 5880 B12R1.450 C=Cc1cc(c(cc1F)OC)F 271570a_100011290941_100009813720 [0,2,0,0,0,0|2,0,0]=4 5881 B12R1.450 C=Cc1cc(c(cc1F)OC)N 271570a_100011290941_100012361397 [0,2,0,0,0,0|2,0,0]=4 5882 B12R1.450 C=Cc1cc(c(cc1N)OC)C 271570a_100011290941_100010244135 [0,2,0,0,0,0|2,0,0]=4 5883 B12R1.450 C=Cc1cc(c(cc1N)OC)F 271570a_100011290941_100010208193 [0,2,0,0,0,0|2,0,0]=4 5884 B12R1.450 C=Cc1cc(c(cc1O)C=O)O 271570a_100011290941_100010888506 [0,2,0,0,0,0|0,0,1]=3 5885 B12R1.450 COc1cc(c(cc1C)OC)O 271570a_203496583355_100000039368 [0,2,0,0,0,0|2,0,0]=4 5886 B12R1.450 COc1cc(c(cc1O)C=O)F 271570a_203496583355_100010244998 [0,2,0,0,0,0|1,0,0]=3 5887 B12R1.450 COc1cc(c(cc1O)C=O)O 271570a_203496583355_100000183646 [0,2,0,0,0,0|0,0,0]=2 5888 B12R1.450 COc1cc(c(cc1O)C=O)O 271570a_203496583355_100009998278 [0,2,0,0,0,0|0,0,0]=2 5889 B12R1.450 COc1cc(c(cc1O)OC)Br 271570a_203496583355_100013799044 [0,2,0,0,0,0|2,0,0]=4 5890 B12R1.450 COc1cc(c(cc1O)OC)Cl 271570a_203496583355_100000023288 [0,2,0,0,0,0|2,0,0]=4 5891 B12R1.450 COc1cc(c(cc1O)OC)O 271570a_203496583355_100009816818 [0,2,0,0,0,0|2,0,0]=4 5892 B12R1.450 CSc1cc(c(cc1C)C=O)C 62a_100012024176_200000210301 [0,2,0,0,0,0|1,0,0]=3 5893 B12R1.450 CSc1cc(c(cc1C)C=O)C 62a_200000210301_100012024176 [0,2,0,0,0,0|1,0,0]=3 5894 B12R1.450 CSc1cc(c(cc1C)C=O)F 62a_100010186291_200000210301 [0,2,0,0,0,0|1,0,0]=3 5895 B12R1.450 CSc1cc(c(cc1C)C=O)F 62a_200000210301_100010186291 [0,2,0,0,0,0|1,0,0]=3 5896 B12R1.450 CSc1cc(c(cc1C)C=O)O 62a_200000210301_200010762526 [0,2,0,0,0,0|0,0,0]=2 5897 B12R1.450 CSc1cc(c(cc1C)C=O)O 62a_200010762526_200000210301 [0,2,0,0,0,0|0,0,0]=2 5898 B12R1.450 CSc1cc(c(cc1F)C#N)O 62a_200000210301_200010827376 [0,2,0,0,0,0|1,0,1]=4 5899 B12R1.450 CSc1cc(c(cc1F)C=O)C 62a_100010186292_200000210301 [0,2,0,0,0,0|1,0,0]=3 5900 B12R1.450 CSc1cc(c(cc1F)C=O)C 62a_200000210301_100010186292 [0,2,0,0,0,0|1,0,0]=3 5901 B12R1.450 CSc1cc(c(cc1F)C=O)F 62a_100011998483_200000210301 [0,2,0,0,0,0|1,0,0]=3 5902 B12R1.450 CSc1cc(c(cc1F)C=O)F 62a_200000210301_100011998483 [0,2,0,0,0,0|1,0,0]=3 5903 B12R1.450 CSc1cc(c(cc1F)C=O)O 62a_200000210301_200010762562 [0,2,0,0,0,0|0,0,0]=2 5904 B12R1.450 CSc1cc(c(cc1F)C=O)O 62a_200010762562_200000210301 [0,2,0,0,0,0|0,0,0]=2 5905 B12R1.450 CSc1cc(c(cc1O)C=O)O 62a_200000210301_100010888506 [0,2,0,0,0,0|0,0,0]=2 5906 B12R1.450 Cc1cc(c(cc1C=O)C)S[13CH3] 62a_100012024176_200025704644 [0,2,0,0,0,0|1,0,0]=3 5907 B12R1.450 Cc1cc(c(cc1C=O)C)S[13CH3] 62a_200025704644_100012024176 [0,2,0,0,0,0|1,0,0]=3 5908 B12R1.450 Cc1cc(c(cc1C=O)F)S[13CH3] 62a_100010186292_200025704644 [0,2,0,0,0,0|1,0,0]=3 5909 B12R1.450 Cc1cc(c(cc1C=O)F)S[13CH3] 62a_200025704644_100010186292 [0,2,0,0,0,0|1,0,0]=3 5910 B12R1.450 Cc1cc(c(cc1S[13CH3])F)C=O 62a_100010186291_200025704644 [0,2,0,0,0,0|1,0,0]=3 5911 B12R1.450 Cc1cc(c(cc1S[13CH3])F)C=O 62a_200025704644_100010186291 [0,2,0,0,0,0|1,0,0]=3 5912 B12R1.450 Cc1cc(c(cc1S[13CH3])O)C=O 62a_200010762526_200025704644 [0,2,0,0,0,0|0,0,0]=2 5913 B12R1.450 Cc1cc(c(cc1S[13CH3])O)C=O 62a_200025704644_200010762526 [0,2,0,0,0,0|0,0,0]=2 5914 B12R1.450 [13CH3]Sc1cc(c(cc1F)C#N)O 62a_200025704644_200010827376 [0,2,0,0,0,0|1,0,1]=4 5915 B12R1.450 [13CH3]Sc1cc(c(cc1F)C=O)F 62a_100011998483_200025704644 [0,2,0,0,0,0|1,0,0]=3 5916 B12R1.450 [13CH3]Sc1cc(c(cc1F)C=O)F 62a_200025704644_100011998483 [0,2,0,0,0,0|1,0,0]=3 5917 B12R1.450 [13CH3]Sc1cc(c(cc1F)C=O)O 62a_200010762562_200025704644 [0,2,0,0,0,0|0,0,0]=2 5918 B12R1.450 [13CH3]Sc1cc(c(cc1F)C=O)O 62a_200025704644_200010762562 [0,2,0,0,0,0|0,0,0]=2 5919 B12R1.450 [13CH3]Sc1cc(c(cc1O)C=O)O 62a_200025704644_100010888506 [0,2,0,0,0,0|0,0,0]=2 5920 B12R1.653 C=Cc1ccc(c(c1C)C)OC 271570a_100011290941_100000049725 [0,2,0,0,0,0|2,0,0]=4 5921 B12R1.653 C=Cc1ccc(c(c1C)F)C=O 271570a_100011290941_100015546853 [0,2,0,0,0,0|1,0,1]=4 5922 B12R1.653 C=Cc1ccc(c(c1C)F)SC 271570a_100011290941_202125771832 [0,2,0,0,0,0|2,0,0]=4 5923 B12R1.653 C=Cc1ccc(c(c1F)F)C=O 271570a_100011290941_100010209662 [0,2,0,0,0,0|1,0,1]=4 5924 B12R1.653 C=Cc1ccc(c(c1F)F)CN 271570a_100011290941_100020621914 [0,2,0,0,0,0|2,0,0]=4 5925 B12R1.653 C=Cc1ccc(c(c1F)F)CO 271570a_100011290941_100010712623 [0,2,0,0,0,0|2,0,0]=4 5926 B12R1.653 C=Cc1ccc(c(c1F)F)OC 271570a_100011290941_100009816879 [0,2,0,0,0,0|2,0,0]=4 5927 B12R1.653 C=Cc1ccc(c(c1F)O)C=O 271570a_100011290941_100010762540 [0,2,0,0,0,0|0,0,1]=3 5928 B12R1.653 COc1ccc(c(c1O)F)OC 271570a_203496583355_200016180952 [0,2,0,0,0,0|2,0,0]=4 5929 B12R1.653 CSc1ccc(c(c1C)F)C=O 62a_100015546853_200000210301 [0,2,0,0,0,0|1,0,0]=3 5930 B12R1.653 CSc1ccc(c(c1C)F)C=O 62a_200000210301_100015546853 [0,2,0,0,0,0|1,0,0]=3 5931 B12R1.653 CSc1ccc(c(c1F)F)C=O 62a_100010209662_200000210301 [0,2,0,0,0,0|1,0,0]=3 5932 B12R1.653 CSc1ccc(c(c1F)F)C=O 62a_200000210301_100010209662 [0,2,0,0,0,0|1,0,0]=3 5933 B12R1.653 CSc1ccc(c(c1F)O)C=O 62a_100010762540_200000210301 [0,2,0,0,0,0|0,0,0]=2 5934 B12R1.653 CSc1ccc(c(c1F)O)C=O 62a_200000210301_100010762540 [0,2,0,0,0,0|0,0,0]=2 5935 B12R1.653 Cc1c(ccc(c1F)C=O)S[13CH3] 62a_100015546853_200025704644 [0,2,0,0,0,0|1,0,0]=3 5936 B12R1.653 Cc1c(ccc(c1F)C=O)S[13CH3] 62a_200025704644_100015546853 [0,2,0,0,0,0|1,0,0]=3 5937 B12R1.653 [13CH3]Sc1ccc(c(c1F)F)C=O 62a_100010209662_200025704644 [0,2,0,0,0,0|1,0,0]=3 5938 B12R1.653 [13CH3]Sc1ccc(c(c1F)F)C=O 62a_200025704644_100010209662 [0,2,0,0,0,0|1,0,0]=3 5939 B12R1.653 [13CH3]Sc1ccc(c(c1F)O)C=O 62a_100010762540_200025704644 [0,2,0,0,0,0|0,0,0]=2 5940 B12R1.653 [13CH3]Sc1ccc(c(c1F)O)C=O 62a_200025704644_100010762540 [0,2,0,0,0,0|0,0,0]=2 5941 B12R1.654 C=Cc1c(ccc(c1F)C=O)F 271570a_100011290941_100000050342 [0,2,0,0,0,0|2,0,0]=4 5942 B12R1.654 C=Cc1ccc(c(c1F)C#N)C 271570a_100011290941_100015641138 [0,2,0,0,0,0|2,0,0]=4 5943 B12R1.654 COc1c(ccc(c1F)C=O)O 271570a_203496583355_200010981996 [0,2,0,0,0,0|2,0,0]=4 5944 B12R1.654 CSc1c(ccc(c1F)C=O)C 62a_100010381662_200000210301 [0,2,0,0,0,0|1,0,0]=3 5945 B12R1.654 CSc1c(ccc(c1F)C=O)C 62a_200000210301_100010381662 [0,2,0,0,0,0|1,0,0]=3 5946 B12R1.654 CSc1c(ccc(c1F)C=O)F 62a_100000050342_200000210301 [0,2,0,0,0,0|2,0,0]=4 5947 B12R1.654 CSc1c(ccc(c1F)C=O)F 62a_200000210301_100000050342 [0,2,0,0,0,0|2,0,0]=4 5948 B12R1.654 Cc1ccc(c(c1S[13CH3])F)C=O 62a_100010381662_200025704644 [0,2,0,0,0,0|1,0,0]=3 5949 B12R1.654 Cc1ccc(c(c1S[13CH3])F)C=O 62a_200025704644_100010381662 [0,2,0,0,0,0|1,0,0]=3 5950 B12R1.654 [13CH3]Sc1c(ccc(c1F)C=O)F 62a_100000050342_200025704644 [0,2,0,0,0,0|2,0,0]=4 5951 B12R1.654 [13CH3]Sc1c(ccc(c1F)C=O)F 62a_200025704644_100000050342 [0,2,0,0,0,0|2,0,0]=4 5952 B12R1.48 C=C(C)c1cc(c(cn1)C=O)C 271570a_100000694244_100000085382 [0,2,0,0,0,0|2,0,0]=4 5953 B12R1.48 C=C(C)c1ccc(c(c1)Br)C=O 271570a_100000694244_100010185650 [0,2,0,0,0,0|1,0,0]=3 5954 B12R1.48 C=C(C)c1ccc(c(c1)C)C=O 271570a_100000694244_100000687586 [0,2,0,0,0,0|1,0,0]=3 5955 B12R1.48 C=C(C)c1ccc(c(c1)Cl)C=O 271570a_100000694244_100000727542 [0,2,0,0,0,0|1,0,0]=3 5956 B12R1.48 C=C(C)c1ccc(c(c1)F)C=O 271570a_100000694244_100000211676 [0,2,0,0,0,0|1,0,0]=3 5957 B12R1.48 C=C(C)c1ccc(c(c1)N)C=O 271570a_100000694244_100009814810 [0,2,0,0,0,0|1,0,0]=3 5958 B12R1.48 C=C(C)c1ccc(c(c1)O)C#N 271570a_100000694244_100011934713 [0,2,0,0,0,0|1,0,1]=4 5959 B12R1.48 C=C(C)c1ccc(c(c1)O)C=O 271570a_100000694244_100011277552 [0,2,0,0,0,0|0,0,0]=2 5960 B12R1.48 C=C(C)c1ccc(c(c1)O)CO 271570a_100000694244_100000071718 [0,2,0,0,0,0|0,0,2]=4 5961 B12R1.48 C=C(C)c1ccc(c(c1)O)OC 271570a_100000694244_100009816560 [0,2,0,0,0,0|2,0,0]=4 5962 B12R1.48 C=C(C)c1ccc(c(n1)C)C=O 271570a_100000694244_100000050599 [0,2,0,0,0,0|2,0,0]=4 5963 B12R1.48 C=C(C)c1ccc(c(n1)F)C=O 271570a_100000694244_100010064369 [0,2,0,0,0,0|2,0,0]=4 5964 B12R1.48 C=C(C)c1cnc(c(c1)C)C=O 271570a_100000694244_100010185443 [0,2,0,0,0,0|2,0,0]=4 5965 B12R1.48 C=C(C)c1cnc(c(c1)F)C=O 271570a_100000694244_100010180630 [0,2,0,0,0,0|2,0,0]=4 5966 B12R1.48 C=Cc1ccc(cc1Br)C(=O)C 271570a_100011290941_100010146554 [0,2,0,0,0,0|2,0,0]=4 5967 B12R1.48 C=Cc1ccc(cc1Br)C(C)C 271570a_100011290941_200010212211 [0,2,0,0,0,0|2,0,0]=4 5968 B12R1.48 C=Cc1ccc(cc1C)C(=O)C 271570a_100011290941_100000697869 [0,2,0,0,0,0|2,0,0]=4 5969 B12R1.48 C=Cc1ccc(cc1C)N(C)C 271570a_100011290941_100011934168 [0,2,0,0,0,0|2,0,0]=4 5970 B12R1.48 C=Cc1ccc(cc1F)C(=O)C 271570a_100011290941_100000690002 [0,2,0,0,0,0|2,0,0]=4 5971 B12R1.48 C=Cc1ccc(cc1F)C(F)F 271570a_100011290941_100010189893 [0,2,0,0,0,0|2,0,0]=4 5972 B12R1.48 C=Cc1ccc(cc1F)[C@H](C)N 271570a_100011290941_100134618348 [0,2,0,0,0,0|2,0,0]=4 5973 B12R1.48 C=Cc1ccc(cc1N)C(=O)C 271570a_100011290941_100009816534 [0,2,0,0,0,0|2,0,0]=4 5974 B12R1.48 C=Cc1ccc(cc1O)C(=O)N 271570a_100011290941_100012344895 [0,2,0,0,0,0|1,0,1]=4 5975 B12R1.48 CC(C)c1ccc(c(c1)O)C=O 271570a_203496583355_100010158967 [0,2,0,0,0,0|0,0,0]=2 5976 B12R1.48 CCc1ccc(cc1O)C(=O)C 1458a_100000089006_200000210301 [0,2,0,0,0,0|1,0,1]=4 5977 B12R1.48 CCc1ccc(cc1O)C(=O)[13CH3] 1458a_100000089006_200025704644 [0,2,0,0,0,0|1,0,1]=4 5978 B12R1.48 CN(C)c1ccc(c(n1)F)C=O 27a_100102631434_100010064369 [0,2,0,0,0,0|2,0,0]=4 5979 B12R1.48 CN(N)c1ccc(c(c1)O)C#N 271570a_203496583355_200010713610 [0,2,0,0,0,0|1,0,1]=4 5980 B12R1.48 COc1ccc(cc1O)C(=O)C 1458a_100000766810_200000210301 [0,2,0,0,0,0|2,0,0]=4 5981 B12R1.48 COc1ccc(cc1O)C(=O)C 271570a_203496583355_100000185153 [0,2,0,0,0,0|2,0,0]=4 5982 B12R1.48 COc1ccc(cc1O)C(=O)[13CH3] 1458a_100000766810_200025704644 [0,2,0,0,0,0|2,0,0]=4 5983 B12R1.48 COc1ccc(cc1O)C(C)O 271570a_203496583355_100000246541 [0,2,0,0,0,0|2,0,0]=4 5984 B12R1.48 O=Cc1ccc(cc1O)B(O)O 271570a_203496583355_100000062204 [0,2,0,0,0,0|1,0,0]=3 5985 B12R1.288 C=C=Cc1ccc(c(c1)Br)C=O 271570a_100015277604_100010185650 [0,2,0,0,0,0|1,0,1]=4 5986 B12R1.288 C=C=Cc1ccc(c(c1)C)C=O 271570a_100015277604_100000687586 [0,2,0,0,0,0|1,0,1]=4 5987 B12R1.288 C=C=Cc1ccc(c(c1)Cl)C=O 271570a_100015277604_100000727542 [0,2,0,0,0,0|1,0,1]=4 5988 B12R1.288 C=C=Cc1ccc(c(c1)F)C=O 271570a_100015277604_100000211676 [0,2,0,0,0,0|1,0,1]=4 5989 B12R1.288 C=C=Cc1ccc(c(c1)N)C=O 271570a_100015277604_100009814810 [0,2,0,0,0,0|1,0,1]=4 5990 B12R1.288 C=C=Cc1ccc(c(c1)O)C=O 271570a_100015277604_100011277552 [0,2,0,0,0,0|0,0,1]=3 5991 B12R1.288 C=Cc1ccc(cc1C)CC#N 271570a_100011290941_100000726167 [0,2,0,0,0,0|2,0,0]=4 5992 B12R1.288 C=Cc1ccc(cc1C)NCC 271570a_100011290941_100015183089 [0,2,0,0,0,0|2,0,0]=4 5993 B12R1.288 C=Cc1ccc(cc1C)OCC 271570a_100011290941_100012344538 [0,2,0,0,0,0|2,0,0]=4 5994 B12R1.288 C=Cc1ccc(cc1F)CC#N 271570a_100011290941_100000691973 [0,2,0,0,0,0|2,0,0]=4 5995 B12R1.288 C=Cc1ccc(cc1F)CCC 271570a_100011290941_200010686677 [0,2,0,0,0,0|2,0,0]=4 5996 B12R1.288 C=Cc1ccc(cc1F)CCO 271570a_100011290941_100012921202 [0,2,0,0,0,0|2,0,0]=4 5997 B12R1.288 C=Cc1ccc(cc1F)COC 271570a_100011290941_100010177442 [0,2,0,0,0,0|2,0,0]=4 5998 B12R1.288 C=Cc1ccc(cc1F)OCC 271570a_100011290941_100000692347 [0,2,0,0,0,0|2,0,0]=4 5999 B12R1.288 C=Cc1ccc(cc1F)SCC 62a_100000210202_100011935271 [0,2,0,0,0,0|2,0,0]=4 6000 B12R1.288 C=Cc1ccc(cc1F)SCC 62a_100011935271_100000210202 [0,2,0,0,0,0|2,0,0]=4 6001 B12R1.288 C=Cc1ccc(cc1F)SCF 62a_100011935271_100015361967 [0,2,0,0,0,0|2,0,0]=4 6002 B12R1.288 C=Cc1ccc(cc1F)SCF 62a_100015361967_100011935271 [0,2,0,0,0,0|2,0,0]=4 6003 B12R1.288 C=Cc1ccc(cc1N)COC 271570a_100011290941_200013033220 [0,2,0,0,0,0|2,0,0]=4 6004 B12R1.288 CC=Cc1cc(c(cn1)C=O)C 271570a_100016259895_100000085382 [0,2,0,0,0,0|2,0,0]=4 6005 B12R1.288 CC=Cc1ccc(c(c1)Br)C=O 271570a_100016259895_100010185650 [0,2,0,0,0,0|1,0,0]=3 6006 B12R1.288 CC=Cc1ccc(c(c1)C)C=O 271570a_100016259895_100000687586 [0,2,0,0,0,0|1,0,0]=3 6007 B12R1.288 CC=Cc1ccc(c(c1)Cl)C=O 271570a_100016259895_100000727542 [0,2,0,0,0,0|1,0,0]=3 6008 B12R1.288 CC=Cc1ccc(c(c1)F)C=O 271570a_100016259895_100000211676 [0,2,0,0,0,0|1,0,0]=3 6009 B12R1.288 CC=Cc1ccc(c(c1)N)C=O 271570a_100016259895_100009814810 [0,2,0,0,0,0|1,0,0]=3 6010 B12R1.288 CC=Cc1ccc(c(c1)O)C#N 271570a_100016259895_100011934713 [0,2,0,0,0,0|1,0,1]=4 6011 B12R1.288 CC=Cc1ccc(c(c1)O)C=O 271570a_100016259895_100011277552 [0,2,0,0,0,0|0,0,0]=2 6012 B12R1.288 CC=Cc1ccc(c(c1)O)CO 271570a_100016259895_100000071718 [0,2,0,0,0,0|0,0,2]=4 6013 B12R1.288 CC=Cc1ccc(c(c1)O)OC 271570a_100016259895_100009816560 [0,2,0,0,0,0|2,0,0]=4 6014 B12R1.288 CC=Cc1ccc(c(n1)C)C=O 271570a_100016259895_100000050599 [0,2,0,0,0,0|2,0,0]=4 6015 B12R1.288 CC=Cc1ccc(c(n1)F)C=O 271570a_100016259895_100010064369 [0,2,0,0,0,0|2,0,0]=4 6016 B12R1.288 CC=Cc1cnc(c(c1)C)C=O 271570a_100016259895_100010185443 [0,2,0,0,0,0|2,0,0]=4 6017 B12R1.288 CC=Cc1cnc(c(c1)F)C=O 271570a_100016259895_100010180630 [0,2,0,0,0,0|2,0,0]=4 6018 B12R1.288 CCNc1ccc(c(c1)O)C#N 34a_100000094571_100000210202 [0,2,0,0,0,0|1,0,1]=4 6019 B12R1.288 CCNc1ccc(c(c1)O)C#N 7a_100000094571_100000210202 [0,2,0,0,0,0|1,0,1]=4 6020 B12R1.288 CCNc1ccc(c(c1)O)OC 34a_100000211920_100000210202 [0,2,0,0,0,0|2,0,0]=4 6021 B12R1.288 CCNc1ccc(c(n1)F)C=O 27a_100015525214_100010064369 [0,2,0,0,0,0|2,0,0]=4 6022 B12R1.288 CCOc1ccc(c(c1)O)C=O 271570a_203496583355_200012721597 [0,2,0,0,0,0|0,0,0]=2 6023 B12R1.288 CCSc1cc(c(cn1)C=O)C 62a_100000085382_100000210202 [0,2,0,0,0,0|2,0,0]=4 6024 B12R1.288 CCSc1cc(c(cn1)C=O)C 62a_100000210202_100000085382 [0,2,0,0,0,0|2,0,0]=4 6025 B12R1.288 CCSc1cc(c(cn1)C=O)N 62a_100000050503_100000210202 [0,2,0,0,0,0|2,0,0]=4 6026 B12R1.288 CCSc1cc(c(cn1)C=O)N 62a_100000210202_100000050503 [0,2,0,0,0,0|2,0,0]=4 6027 B12R1.288 CCSc1ccc(c(c1)Br)C=O 62a_100000210202_100010185650 [0,2,0,0,0,0|1,0,0]=3 6028 B12R1.288 CCSc1ccc(c(c1)Br)C=O 62a_100010185650_100000210202 [0,2,0,0,0,0|1,0,0]=3 6029 B12R1.288 CCSc1ccc(c(c1)C)C=O 62a_100000210202_100000766358 [0,2,0,0,0,0|1,0,0]=3 6030 B12R1.288 CCSc1ccc(c(c1)C)C=O 62a_100000766358_100000210202 [0,2,0,0,0,0|1,0,0]=3 6031 B12R1.288 CCSc1ccc(c(c1)Cl)C=O 62a_100000210202_100000727542 [0,2,0,0,0,0|1,0,0]=3 6032 B12R1.288 CCSc1ccc(c(c1)Cl)C=O 62a_100000727542_100000210202 [0,2,0,0,0,0|1,0,0]=3 6033 B12R1.288 CCSc1ccc(c(c1)F)C=O 62a_100000210202_100000211676 [0,2,0,0,0,0|1,0,0]=3 6034 B12R1.288 CCSc1ccc(c(c1)F)C=O 62a_100000211676_100000210202 [0,2,0,0,0,0|1,0,0]=3 6035 B12R1.288 CCSc1ccc(c(c1)N)C=O 62a_100009814810_100000210202 [0,2,0,0,0,0|1,0,0]=3 6036 B12R1.288 CCSc1ccc(c(c1)O)C#N 62a_100000210202_100011934713 [0,2,0,0,0,0|1,0,1]=4 6037 B12R1.288 CCSc1ccc(c(c1)O)C=O 62a_100000210202_100011277552 [0,2,0,0,0,0|0,0,0]=2 6038 B12R1.288 CCSc1ccc(c(c1)O)C=O 62a_100011277552_100000210202 [0,2,0,0,0,0|0,0,0]=2 6039 B12R1.288 CCSc1ccc(c(c1)O)CO 62a_100000071718_100000210202 [0,2,0,0,0,0|0,0,2]=4 6040 B12R1.288 CCSc1ccc(c(c1)O)CO 62a_100000210202_100000071718 [0,2,0,0,0,0|0,0,2]=4 6041 B12R1.288 CCSc1ccc(c(c1)O)OC 62a_100000210202_100009816560 [0,2,0,0,0,0|2,0,0]=4 6042 B12R1.288 CCSc1ccc(c(n1)C)C=O 62a_100000050599_100000210202 [0,2,0,0,0,0|2,0,0]=4 6043 B12R1.288 CCSc1ccc(c(n1)C)C=O 62a_100000210202_100000050599 [0,2,0,0,0,0|2,0,0]=4 6044 B12R1.288 CCSc1ccc(c(n1)F)C=O 62a_100000210202_100010064369 [0,2,0,0,0,0|2,0,0]=4 6045 B12R1.288 CCSc1ccc(c(n1)F)C=O 62a_100010064369_100000210202 [0,2,0,0,0,0|2,0,0]=4 6046 B12R1.288 CCSc1cnc(c(c1)C)C=O 62a_100000210202_100010185443 [0,2,0,0,0,0|2,0,0]=4 6047 B12R1.288 CCSc1cnc(c(c1)C)C=O 62a_100010185443_100000210202 [0,2,0,0,0,0|2,0,0]=4 6048 B12R1.288 CCSc1cnc(c(c1)F)C=O 62a_100000210202_100010180630 [0,2,0,0,0,0|2,0,0]=4 6049 B12R1.288 CCSc1cnc(c(c1)F)C=O 62a_100010180630_100000210202 [0,2,0,0,0,0|2,0,0]=4 6050 B12R1.288 CNCc1ccc(c(c1)F)C=O 2230a_106832991635_100010142638 [0,2,0,0,0,0|1,0,0]=3 6051 B12R1.288 CNCc1ccc(c(c1)F)C=O 34a_100102657272_100010142638 [0,2,0,0,0,0|1,0,0]=3 6052 B12R1.288 CNCc1ccc(c(c1)F)C=O 7a_106832991635_100010142638 [0,2,0,0,0,0|1,0,0]=3 6053 B12R1.288 CNCc1ccc(c(c1)O)OC 34a_100000740000_200000210301 [0,2,0,0,0,0|2,0,0]=4 6054 B12R1.288 COCc1ccc(c(c1)F)C=O 34a_100138415774_100010142638 [0,2,0,0,0,0|1,0,0]=3 6055 B12R1.288 COc1ccc(cc1O)CC#N 271570a_203496583355_100011215974 [0,2,0,0,0,0|2,0,0]=4 6056 B12R1.288 COc1ccc(cc1O)CCN 271570a_203496583355_103549771065 [0,2,0,0,0,0|2,0,0]=4 6057 B12R1.288 COc1ccc(cc1O)CCO 271570a_203496583355_100011962876 [0,2,0,0,0,0|2,0,0]=4 6058 B12R1.288 COc1ccc(cc1O)CN[13CH3] 34a_100000740000_200025704644 [0,2,0,0,0,0|2,0,0]=4 6059 B12R1.288 COc1ccc(cc1O)NCF 34a_100000211920_100015361967 [0,2,0,0,0,0|2,0,0]=4 6060 B12R1.288 COc1ccc(cc1O)SCF 62a_100015361967_100009816560 [0,2,0,0,0,0|2,0,0]=4 6061 B12R1.288 CSCc1ccc(c(c1)F)C=O 62a_100010142638_200000210301 [0,2,0,0,0,0|1,0,0]=3 6062 B12R1.288 CSCc1ccc(c(c1)F)C=O 62a_200000210301_100010142638 [0,2,0,0,0,0|1,0,0]=3 6063 B12R1.288 Cc1cc(ccc1C=O)SCF 62a_100000766358_100015361967 [0,2,0,0,0,0|1,0,0]=3 6064 B12R1.288 Cc1cc(ccc1C=O)SCF 62a_100015361967_100000766358 [0,2,0,0,0,0|1,0,0]=3 6065 B12R1.288 Cc1cc(cnc1C=O)SCF 62a_100010185443_100015361967 [0,2,0,0,0,0|2,0,0]=4 6066 B12R1.288 Cc1cc(cnc1C=O)SCF 62a_100015361967_100010185443 [0,2,0,0,0,0|2,0,0]=4 6067 B12R1.288 Cc1cc(ncc1C=O)SCF 62a_100000085382_100015361967 [0,2,0,0,0,0|2,0,0]=4 6068 B12R1.288 Cc1cc(ncc1C=O)SCF 62a_100015361967_100000085382 [0,2,0,0,0,0|2,0,0]=4 6069 B12R1.288 Cc1nc(ccc1C=O)SCF 62a_100000050599_100015361967 [0,2,0,0,0,0|2,0,0]=4 6070 B12R1.288 Cc1nc(ccc1C=O)SCF 62a_100015361967_100000050599 [0,2,0,0,0,0|2,0,0]=4 6071 B12R1.288 N#Cc1ccc(cc1O)NCF 34a_100000094571_100015361967 [0,2,0,0,0,0|1,0,1]=4 6072 B12R1.288 N#Cc1ccc(cc1O)NCF 7a_100000094571_100015361967 [0,2,0,0,0,0|1,0,1]=4 6073 B12R1.288 N#Cc1ccc(cc1O)SCF 62a_100015361967_100011934713 [0,2,0,0,0,0|1,0,1]=4 6074 B12R1.288 Nc1cc(ccc1C=O)SCF 62a_100009814810_100015361967 [0,2,0,0,0,0|1,0,0]=3 6075 B12R1.288 Nc1cc(ncc1C=O)SCF 62a_100000050503_100015361967 [0,2,0,0,0,0|2,0,0]=4 6076 B12R1.288 Nc1cc(ncc1C=O)SCF 62a_100015361967_100000050503 [0,2,0,0,0,0|2,0,0]=4 6077 B12R1.288 O=Cc1ccc(cc1Br)SCF 62a_100010185650_100015361967 [0,2,0,0,0,0|1,0,0]=3 6078 B12R1.288 O=Cc1ccc(cc1Br)SCF 62a_100015361967_100010185650 [0,2,0,0,0,0|1,0,0]=3 6079 B12R1.288 O=Cc1ccc(cc1Cl)SCF 62a_100000727542_100015361967 [0,2,0,0,0,0|1,0,0]=3 6080 B12R1.288 O=Cc1ccc(cc1Cl)SCF 62a_100015361967_100000727542 [0,2,0,0,0,0|1,0,0]=3 6081 B12R1.288 O=Cc1ccc(cc1F)SCF 62a_100000211676_100015361967 [0,2,0,0,0,0|1,0,0]=3 6082 B12R1.288 O=Cc1ccc(cc1F)SCF 62a_100015361967_100000211676 [0,2,0,0,0,0|1,0,0]=3 6083 B12R1.288 O=Cc1ccc(cc1O)SCF 62a_100011277552_100015361967 [0,2,0,0,0,0|0,0,0]=2 6084 B12R1.288 O=Cc1ccc(cc1O)SCF 62a_100015361967_100011277552 [0,2,0,0,0,0|0,0,0]=2 6085 B12R1.288 O=Cc1ccc(nc1F)SCF 62a_100010064369_100015361967 [0,2,0,0,0,0|2,0,0]=4 6086 B12R1.288 O=Cc1ccc(nc1F)SCF 62a_100015361967_100010064369 [0,2,0,0,0,0|2,0,0]=4 6087 B12R1.288 O=Cc1ncc(cc1F)SCF 62a_100010180630_100015361967 [0,2,0,0,0,0|2,0,0]=4 6088 B12R1.288 O=Cc1ncc(cc1F)SCF 62a_100015361967_100010180630 [0,2,0,0,0,0|2,0,0]=4 6089 B12R1.288 OCc1ccc(cc1O)SCF 62a_100000071718_100015361967 [0,2,0,0,0,0|0,0,2]=4 6090 B12R1.288 OCc1ccc(cc1O)SCF 62a_100015361967_100000071718 [0,2,0,0,0,0|0,0,2]=4 6091 B12R1.288 [13CH3]SCc1ccc(c(c1)F)C=O 62a_100010142638_200025704644 [0,2,0,0,0,0|1,0,0]=3 6092 B12R1.288 [13CH3]SCc1ccc(c(c1)F)C=O 62a_200025704644_100010142638 [0,2,0,0,0,0|1,0,0]=3 6093 B12R1.301 C=Cc1c(cc(cc1C)CO)C 271570a_100011290941_100012339607 [0,2,0,0,0,0|2,0,0]=4 6094 B12R1.301 C=Cc1c(cc(cc1C)OC)C 271570a_100011290941_100012160682 [0,2,0,0,0,0|2,0,0]=4 6095 B12R1.301 C=Cc1c(cc(cc1F)CC)F 271570a_100011290941_200160481119 [0,2,0,0,0,0|2,0,0]=4 6096 B12R1.301 C=Cc1c(cc(cc1F)OC)F 271570a_100011290941_100011218311 [0,2,0,0,0,0|2,0,0]=4 6097 B12R1.301 C=Cc1cc(c(c(c1)C)C=O)C 271570a_100011290941_100010238521 [0,2,0,0,0,0|1,0,1]=4 6098 B12R1.301 C=Cc1cc(c(c(c1)Cl)C=O)Cl 271570a_100011290941_200011001975 [0,2,0,0,0,0|1,0,1]=4 6099 B12R1.301 C=Cc1cc(c(c(c1)F)C=O)F 271570a_100011290941_100000036707 [0,2,0,0,0,0|1,0,1]=4 6100 B12R1.301 C=Cc1cc(c(c(c1)F)C=O)O 271570a_100011290941_100010762571 [0,2,0,0,0,0|0,0,1]=3 6101 B12R1.301 COc1c(cc(cc1F)CO)O 271570a_203496583355_100020751559 [0,2,0,0,0,0|2,0,0]=4 6102 B12R1.301 COc1cc(c(c(c1)F)C=O)O 271570a_203496583355_200021118581 [0,2,0,0,0,0|0,0,0]=2 6103 B12R1.301 COc1cc(c(c(c1)O)C=O)O 271570a_203496583355_100010762613 [0,2,0,0,0,0|0,0,0]=2 6104 B12R1.301 COc1cc(c(c(c1)O)OC)N 271570a_203496583355_100010294495 [0,2,0,0,0,0|2,0,0]=4 6105 B12R1.301 COc1cc(c(c(c1)O)OC)O 271570a_203496583355_200020900881 [0,2,0,0,0,0|2,0,0]=4 6106 B12R1.301 CSc1cc(c(c(c1)C)C=O)C 62a_100010238521_200000210301 [0,2,0,0,0,0|1,0,0]=3 6107 B12R1.301 CSc1cc(c(c(c1)C)C=O)C 62a_200000210301_100010238521 [0,2,0,0,0,0|1,0,0]=3 6108 B12R1.301 CSc1cc(c(c(c1)Cl)C=O)Cl 62a_200000210301_200011001975 [0,2,0,0,0,0|1,0,0]=3 6109 B12R1.301 CSc1cc(c(c(c1)Cl)C=O)Cl 62a_200011001975_200000210301 [0,2,0,0,0,0|1,0,0]=3 6110 B12R1.301 CSc1cc(c(c(c1)F)C#N)O 62a_200000210301_200011156622 [0,2,0,0,0,0|1,0,1]=4 6111 B12R1.301 CSc1cc(c(c(c1)F)C=O)F 62a_100000036707_200000210301 [0,2,0,0,0,0|1,0,0]=3 6112 B12R1.301 CSc1cc(c(c(c1)F)C=O)F 62a_200000210301_100000036707 [0,2,0,0,0,0|1,0,0]=3 6113 B12R1.301 CSc1cc(c(c(c1)F)C=O)O 62a_100010762571_200000210301 [0,2,0,0,0,0|0,0,0]=2 6114 B12R1.301 CSc1cc(c(c(c1)F)C=O)O 62a_200000210301_100010762571 [0,2,0,0,0,0|0,0,0]=2 6115 B12R1.301 Cc1cc(cc(c1C=O)C)S[13CH3] 62a_100010238521_200025704644 [0,2,0,0,0,0|1,0,0]=3 6116 B12R1.301 Cc1cc(cc(c1C=O)C)S[13CH3] 62a_200025704644_100010238521 [0,2,0,0,0,0|1,0,0]=3 6117 B12R1.301 [13CH3]Sc1cc(c(c(c1)Cl)C=O)Cl 62a_200011001975_200025704644 [0,2,0,0,0,0|1,0,0]=3 6118 B12R1.301 [13CH3]Sc1cc(c(c(c1)Cl)C=O)Cl 62a_200025704644_200011001975 [0,2,0,0,0,0|1,0,0]=3 6119 B12R1.301 [13CH3]Sc1cc(c(c(c1)F)C#N)O 62a_200025704644_200011156622 [0,2,0,0,0,0|1,0,1]=4 6120 B12R1.301 [13CH3]Sc1cc(c(c(c1)F)C=O)F 62a_100000036707_200025704644 [0,2,0,0,0,0|1,0,0]=3 6121 B12R1.301 [13CH3]Sc1cc(c(c(c1)F)C=O)F 62a_200025704644_100000036707 [0,2,0,0,0,0|1,0,0]=3 6122 B12R1.301 [13CH3]Sc1cc(c(c(c1)F)C=O)O 62a_100010762571_200025704644 [0,2,0,0,0,0|0,0,0]=2 6123 B12R1.301 [13CH3]Sc1cc(c(c(c1)F)C=O)O 62a_200025704644_100010762571 [0,2,0,0,0,0|0,0,0]=2 6124 B10R1.10 CC=Cc1cc(ccn1)C 271570a_100016259895_100000750283 [0,0,1,1,0,0|2,0,0]=4 6125 B10R1.10 CC=Cc1cccc(=O)[nH]1 271570a_100016259895_100000761760 [0,0,1,1,0,0|2,0,0]=4 6126 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [0,0,1,1,0,0|2,0,0]=4 6127 B10R1.96 CC=Cc1ccc(o1)C=O 271570a_100016259895_100000185145 [0,0,1,1,0,0|2,0,0]=4 6128 B10R1.96 CC=Cc1ccc(s1)C=O 271570a_100016259895_100000179771 [0,0,1,1,0,0|2,0,0]=4 6129 B10R1.8 C=Cc1cc(cc(c1)Br)O 271570a_100011290941_100010068917 [0,0,1,1,0,0|1,0,1]=4 6130 B10R1.8 C=Cc1cc(cc(c1)Cl)O 271570a_100011290941_100010068924 [0,0,1,1,0,0|1,0,1]=4 6131 B10R1.8 C=Cc1cc(cc(c1)F)O 271570a_100011290941_100000717995 [0,0,1,1,0,0|1,0,1]=4 6132 B10R1.8 C=Cc1cc(cc(c1)O)C 271570a_100011290941_100011999630 [0,0,1,1,0,0|1,0,1]=4 6133 B10R1.8 C=Cc1cc(cc(c1)O)O 271570a_100011290941_100009868816 [0,0,1,1,0,0|0,0,2]=4 6134 B10R1.5 CC=Cc1ccoc1C=O 271570a_100016259895_100000756499 [0,0,1,1,0,0|2,0,0]=4 6135 B10R1.5 CC=Cc1ccsc1C=O 271570a_100016259895_100000766043 [0,0,1,1,0,0|2,0,0]=4 6136 B10R1.5 CC=Cc1cscc1C=O 271570a_100016259895_100000685484 [0,0,1,1,0,0|2,0,0]=4 6137 B10R1.5 CC=Cc1sccc1C=O 271570a_100016259895_100009816921 [0,0,1,1,0,0|0,1,0]=3 6138 B10R1.66 CC(=O)C=Cc1ccoc1 1458a_100000238621_200000210301 [0,0,1,1,0,0|2,0,0]=4 6139 B10R1.66 [13CH3]C(=O)C=Cc1ccoc1 1458a_100000238621_200025704644 [0,0,1,1,0,0|2,0,0]=4 6140 B12R2.132 Cc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100000123028 [0,1,0,1,0,0|2,0,0]=4 6141 B12R2.612 Cc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100000049534 [0,1,0,1,0,0|1,0,1]=4 6142 B12R2.612 Cc1coc2c1ccc(c2)O 271570a_203496583355_100010775837 [0,1,0,1,0,0|2,0,0]=4 6143 B12R2.612 Cc1noc2c1ccc(c2)O 271570a_203496583355_100009815287 [0,1,0,1,0,0|2,0,0]=4 6144 B12R2.612 Nc1noc2c1ccc(c2)O 271570a_203496583355_100012356334 [0,1,0,1,0,0|2,0,0]=4 6145 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [0,1,0,1,0,0|2,0,0]=4 6146 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [0,1,0,1,0,0|2,0,0]=4 6147 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [0,1,0,1,0,0|1,0,0]=3 6148 B12R2.612 O=C1NCc2c1ccc(c2)O 271570a_203496583355_100000692135 [0,1,0,1,0,0|2,0,0]=4 6149 B12R2.612 O=C1OCc2c1ccc(c2)O 271570a_203496583355_100009816608 [0,1,0,1,0,0|1,0,0]=3 6150 B12R2.612 O=c1[nH][nH]c2c1ccc(c2)O 271570a_203496583355_100012353722 [0,1,0,1,0,0|2,0,0]=4 6151 B12R2.612 Oc1ccc2c(noc2c1)O 271570a_203496583355_100000727085 [0,1,0,1,0,0|1,0,1]=4 6152 B12R2.246 Cc1cc(c2[nH]cnc2c1)O 271570a_203496583355_100010107307 [0,1,0,1,0,0|1,0,0]=3 6153 B12R2.246 Cc1cc(c2[nH]ncc2c1)O 271570a_203496583355_100009816732 [0,1,0,1,0,0|2,0,0]=4 6154 B12R2.246 Cc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010186026 [0,1,0,1,0,0|1,0,0]=3 6155 B12R2.246 Cc1cc(c2cc[nH]c2n1)O 271570a_203496583355_100000095047 [0,1,0,1,0,0|2,0,0]=4 6156 B12R2.246 Cc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100009816876 [0,1,0,1,0,0|1,0,0]=3 6157 B12R2.246 Cc1cc(c2nccn2c1)O 271570a_203496583355_100025775375 [0,1,0,1,0,0|2,0,0]=4 6158 B12R2.246 Cc1cc(c2ncnn2c1)O 271570a_203496583355_100009817174 [0,1,0,1,0,0|2,0,0]=4 6159 B12R2.246 Cc1cc(c2occc2c1)O 271570a_203496583355_100012361857 [0,1,0,1,0,0|1,0,0]=3 6160 B12R2.246 Nc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010006569 [0,1,0,1,0,0|2,0,0]=4 6161 B12R2.246 Nc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100010185947 [0,1,0,1,0,0|2,0,0]=4 6162 B12R2.246 Nc1cc(c2scnc2c1)O 271570a_203496583355_200010333430 [0,1,0,1,0,0|2,0,0]=4 6163 B12R2.246 Oc1cc(c2cn[nH]c2c1)O 271570a_203496583355_100010185960 [0,1,0,1,0,0|2,0,0]=4 6164 B12R2.246 Oc1cc(c2occc2c1)O 271570a_203496583355_200010248604 [0,1,0,1,0,0|2,0,0]=4 6165 B12R2.246 Oc1cc(cc2c1[nH]cc2)F 271570a_203496583355_100010138379 [0,1,0,1,0,0|2,0,0]=4 6166 B12R2.246 Oc1cc(cc2c1cc[nH]2)Br 271570a_203496583355_100009814761 [0,1,0,1,0,0|2,0,0]=4 6167 B12R2.246 Oc1cc(cc2c1cc[nH]2)F 271570a_203496583355_100010188273 [0,1,0,1,0,0|2,0,0]=4 6168 B12R2.246 Oc1cc(cc2c1cn[nH]2)Br 271570a_203496583355_100009814777 [0,1,0,1,0,0|2,0,0]=4 6169 B12R2.246 Oc1cc(cc2c1cn[nH]2)Cl 271570a_203496583355_100000050163 [0,1,0,1,0,0|2,0,0]=4 6170 B12R2.246 Oc1cc(cc2c1cn[nH]2)F 271570a_203496583355_100010185992 [0,1,0,1,0,0|2,0,0]=4 6171 B12R2.246 Oc1cc(cc2c1nc[nH]2)F 271570a_203496583355_100010192642 [0,1,0,1,0,0|2,0,0]=4 6172 B12R2.246 Oc1cc(cc2c1nco2)F 271570a_203496583355_100016120941 [0,1,0,1,0,0|1,0,1]=4 6173 B12R2.246 Oc1cc(cc2c1occ2)F 271570a_203496583355_100011935139 [0,1,0,1,0,0|2,0,0]=4 6174 B12R2.606 Cc1ccc2nc(sc2c1)O 271570a_203496583355_100010186437 [0,1,0,1,0,0|0,1,1]=4 6175 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,1,0,1,0,0|2,0,0]=4 6176 B12R2.606 Nc1nc2ccc(cc2o1)O 271570a_203496583355_100010000678 [0,1,0,1,0,0|2,0,0]=4 6177 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,1,0,1,0,0|2,0,0]=4 6178 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,1,0,1,0,0|2,0,0]=4 6179 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [0,1,0,1,0,0|2,0,0]=4 6180 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [0,1,0,1,0,0|2,0,0]=4 6181 B12R2.606 O=c1[nH]c2cc(ccc2s1)O 271570a_203496583355_100000239354 [0,1,0,1,0,0|2,0,0]=4 6182 B12R2.606 O=c1[nH]c2ccc(cc2[nH]1)O 271570a_203496583355_100011221360 [0,1,0,1,0,0|2,0,0]=4 6183 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [0,1,0,1,0,0|1,0,0]=3 6184 B12R2.606 O=c1[nH]c2ccc(cc2s1)O 271570a_203496583355_100009813980 [0,1,0,1,0,0|1,1,0]=4 6185 B12R2.606 O=c1[nH]c2ncc(cc2o1)O 271570a_203496583355_100000721845 [0,1,0,1,0,0|2,0,0]=4 6186 B12R2.1317 Cc1ccc(c(c1)O)C2CC2 271570a_100011220607_100012002257 [0,1,0,1,0,0|1,0,1]=4 6187 B12R2.100 Cc1cc2[nH]ccc2cc1O 271570a_203496583355_100010199648 [0,1,0,1,0,0|2,0,0]=4 6188 B12R2.100 Cc1cc2[nH]ncc2cc1O 271570a_203496583355_100009816927 [0,1,0,1,0,0|2,0,0]=4 6189 B12R2.82 Cc1ccc2cc[nH]c2c1O 271570a_203496583355_100010717004 [0,1,0,1,0,0|2,0,0]=4 6190 B12R2.82 Cc1ccc2cn[nH]c2c1O 271570a_203496583355_100009817202 [0,1,0,1,0,0|2,0,0]=4 6191 B12R2.44 C=Cc1ccc2ccoc2c1 271570a_100011290941_100000759542 [0,1,0,1,0,0|1,0,1]=4 6192 B12R2.44 C=Cc1ccc2cnoc2c1 271570a_100011290941_100009817722 [0,1,0,1,0,0|1,0,1]=4 6193 B12R2.44 CNc1ccc2c(c1)OCO2 2230a_100000209953_200000210301 [0,1,0,1,0,0|2,0,0]=4 6194 B12R2.44 CNc1ccc2c(c1)OCO2 34a_100000209953_200000210301 [0,1,0,1,0,0|2,0,0]=4 6195 B12R2.44 CNc1ccc2ccoc2c1 34a_100000102395_200000210301 [0,1,0,1,0,0|1,0,0]=3 6196 B12R2.44 CNc1ccc2cnoc2c1 34a_100000084182_200000210301 [0,1,0,1,0,0|1,0,0]=3 6197 B12R2.44 CNc1ccc2ncoc2c1 34a_100011248239_200000210301 [0,1,0,1,0,0|2,0,0]=4 6198 B12R2.44 COc1ccc2c(c1)OCO2 34a_100000210298_200000210301 [0,1,0,1,0,0|2,0,0]=4 6199 B12R2.44 COc1ccc2cc[nH]c2c1 34a_100000036713_200000210301 [0,1,0,1,0,0|2,0,0]=4 6200 B12R2.44 COc1ccc2ccoc2c1 34a_100000089557_200000210301 [0,1,0,1,0,0|1,0,0]=3 6201 B12R2.44 COc1ccc2ccoc2c1 7a_100000089557_200000210301 [0,1,0,1,0,0|1,0,0]=3 6202 B12R2.44 COc1ccc2cnoc2c1 34a_100000098417_200000210301 [0,1,0,1,0,0|1,0,0]=3 6203 B12R2.44 COc1ccc2cnoc2c1 7a_100000098417_200000210301 [0,1,0,1,0,0|1,0,0]=3 6204 B12R2.44 CSc1ccc2c(c1)CC=C2 62a_200000210301_200009818231 [0,1,0,1,0,0|2,0,0]=4 6205 B12R2.44 CSc1ccc2c(c1)CC=C2 62a_200009818231_200000210301 [0,1,0,1,0,0|2,0,0]=4 6206 B12R2.44 CSc1ccc2c(c1)OCC2 62a_100009818566_200000210301 [0,1,0,1,0,0|1,0,1]=4 6207 B12R2.44 CSc1ccc2c(c1)OCC2 62a_200000210301_100009818566 [0,1,0,1,0,0|1,0,1]=4 6208 B12R2.44 CSc1ccc2cc[nH]c2c1 62a_200000210301_100000743809 [0,1,0,1,0,0|2,0,0]=4 6209 B12R2.44 CSc1ccc2ccoc2c1 62a_200000210301_100000759542 [0,1,0,1,0,0|1,0,0]=3 6210 B12R2.44 CSc1ccc2ccsc2c1 62a_200000210301_100009888917 [0,1,0,1,0,0|1,1,0]=4 6211 B12R2.44 CSc1ccc2cn[nH]c2c1 62a_200000210301_100000049514 [0,1,0,1,0,0|2,0,0]=4 6212 B12R2.44 CSc1ccc2cnoc2c1 62a_200000210301_100009817722 [0,1,0,1,0,0|1,0,0]=3 6213 B12R2.44 CSc1ccc2cscc2c1 62a_200000210301_200010760811 [0,1,0,1,0,0|1,1,0]=4 6214 B12R2.44 CSc1ccc2csnc2c1 62a_200000210301_100010170880 [0,1,0,1,0,0|1,1,0]=4 6215 B12R2.44 CSc1ccc2ncoc2c1 62a_200000210301_100009817590 [0,1,0,1,0,0|2,0,0]=4 6216 B12R2.44 [13CH3]Nc1ccc2c(c1)OCO2 2230a_100000209953_200025704644 [0,1,0,1,0,0|2,0,0]=4 6217 B12R2.44 [13CH3]Nc1ccc2c(c1)OCO2 34a_100000209953_200025704644 [0,1,0,1,0,0|2,0,0]=4 6218 B12R2.44 [13CH3]Nc1ccc2ccoc2c1 34a_100000102395_200025704644 [0,1,0,1,0,0|1,0,0]=3 6219 B12R2.44 [13CH3]Nc1ccc2cnoc2c1 34a_100000084182_200025704644 [0,1,0,1,0,0|1,0,0]=3 6220 B12R2.44 [13CH3]Nc1ccc2ncoc2c1 34a_100011248239_200025704644 [0,1,0,1,0,0|2,0,0]=4 6221 B12R2.44 [13CH3]Oc1ccc2c(c1)OCO2 34a_100000210298_200025704644 [0,1,0,1,0,0|2,0,0]=4 6222 B12R2.44 [13CH3]Oc1ccc2cc[nH]c2c1 34a_100000036713_200025704644 [0,1,0,1,0,0|2,0,0]=4 6223 B12R2.44 [13CH3]Oc1ccc2ccoc2c1 34a_100000089557_200025704644 [0,1,0,1,0,0|1,0,0]=3 6224 B12R2.44 [13CH3]Oc1ccc2ccoc2c1 7a_100000089557_200025704644 [0,1,0,1,0,0|1,0,0]=3 6225 B12R2.44 [13CH3]Oc1ccc2cnoc2c1 34a_100000098417_200025704644 [0,1,0,1,0,0|1,0,0]=3 6226 B12R2.44 [13CH3]Oc1ccc2cnoc2c1 7a_100000098417_200025704644 [0,1,0,1,0,0|1,0,0]=3 6227 B12R2.44 [13CH3]Sc1ccc2c(c1)CC=C2 62a_200009818231_200025704644 [0,1,0,1,0,0|2,0,0]=4 6228 B12R2.44 [13CH3]Sc1ccc2c(c1)CC=C2 62a_200025704644_200009818231 [0,1,0,1,0,0|2,0,0]=4 6229 B12R2.44 [13CH3]Sc1ccc2c(c1)OCC2 62a_100009818566_200025704644 [0,1,0,1,0,0|1,0,1]=4 6230 B12R2.44 [13CH3]Sc1ccc2c(c1)OCC2 62a_200025704644_100009818566 [0,1,0,1,0,0|1,0,1]=4 6231 B12R2.44 [13CH3]Sc1ccc2cc[nH]c2c1 62a_200025704644_100000743809 [0,1,0,1,0,0|2,0,0]=4 6232 B12R2.44 [13CH3]Sc1ccc2ccoc2c1 62a_200025704644_100000759542 [0,1,0,1,0,0|1,0,0]=3 6233 B12R2.44 [13CH3]Sc1ccc2ccsc2c1 62a_200025704644_100009888917 [0,1,0,1,0,0|1,1,0]=4 6234 B12R2.44 [13CH3]Sc1ccc2cn[nH]c2c1 62a_200025704644_100000049514 [0,1,0,1,0,0|2,0,0]=4 6235 B12R2.44 [13CH3]Sc1ccc2cnoc2c1 62a_200025704644_100009817722 [0,1,0,1,0,0|1,0,0]=3 6236 B12R2.44 [13CH3]Sc1ccc2cscc2c1 62a_200025704644_200010760811 [0,1,0,1,0,0|1,1,0]=4 6237 B12R2.44 [13CH3]Sc1ccc2csnc2c1 62a_200025704644_100010170880 [0,1,0,1,0,0|1,1,0]=4 6238 B12R2.44 [13CH3]Sc1ccc2ncoc2c1 62a_200025704644_100009817590 [0,1,0,1,0,0|2,0,0]=4 6239 B8R1.1 C=Cc1cc(cs1)C 271570a_100011290941_100009876951 [1,0,0,0,1,0|2,0,0]=4 6240 B8R1.1 C=Cc1ccc(s1)C 271570a_100011290941_100000761539 [1,0,0,0,1,0|2,0,0]=4 6241 B8R1.1 C=Cc1csc(c1)C 271570a_100011290941_100000759034 [1,0,0,0,1,0|2,0,0]=4 6242 B8R1.1 O=Cc1c[nH]c(c1)O 271570a_203496583355_100009882863 [1,0,0,0,1,0|2,0,0]=4 6243 B8R1.1 O=Cc1cc(co1)O 271570a_203496583355_100000747035 [1,0,0,0,1,0|2,0,0]=4 6244 B8R1.1 O=Cc1cc(cs1)O 271570a_203496583355_100000211722 [1,0,0,0,1,0|2,0,0]=4 6245 B8R1.1 O=Cc1ccc(o1)O 271570a_203496583355_100000185145 [1,0,0,0,1,0|2,0,0]=4 6246 B8R1.1 O=Cc1ccc(s1)O 271570a_203496583355_100000179771 [1,0,0,0,1,0|2,0,0]=4 6247 B8R1.1 O=Cc1csc(c1)O 271570a_203496583355_100000737087 [1,0,0,0,1,0|2,0,0]=4 6248 B8R1.11 O=Cc1ccsc1O 271570a_203496583355_100009816921 [1,0,0,0,1,0|1,0,0]=3 6249 B8R1.11 O=Cc1cscc1O 271570a_203496583355_100000685484 [1,0,0,0,1,0|1,0,0]=3 6250 B8R1.11 O=Cc1occc1O 271570a_203496583355_100000756499 [1,0,0,0,1,0|1,0,0]=3 6251 B8R1.11 O=Cc1sccc1O 271570a_203496583355_100000766043 [1,0,0,0,1,0|1,0,0]=3 6252 B8R1.18 Cc1cc(c(s1)C)O 271570a_203496583355_100000688054 [1,0,0,0,1,0|1,0,1]=4 6253 B8R1.18 Cc1cc(c(s1)O)C 271570a_203496583355_100000689295 [1,0,0,0,1,0|1,0,1]=4 6254 B8R1.50 Cc1[nH][nH]c(=O)c1O 271570a_203496583355_100000686169 [1,0,0,0,1,0|2,0,0]=4