0 B13R2.12159 CC1(C)CC(=O)c2ccccc21 Amb6739860 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.12159 CC1(C)NC(=O)c2ccccc21 Amb22899742 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.12159 CC1(C)OC(=O)c2ccccc21 Amb17778630 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.12159 CC1=CS(=O)(=O)c2ccccc21 Amb5720692 [0,0,0,0,0,0|2,0,0]=2 4 B13R2.12159 CC1=NS(=O)(=O)c2ccccc21 Amb19148057 [0,0,0,0,0,0|1,0,1]=2 5 B13R2.12159 CC1NS(=O)(=O)c2ccccc21 Amb22497137 [0,0,0,0,0,0|1,0,1]=2 6 B13R2.12159 CS1(=O)=NC(=O)c2ccccc21 Amb31251514 [0,0,0,0,0,0|1,0,1]=2 7 B13R2.12159 NC1=CS(=O)(=O)c2ccccc21 Amb23403653 [0,0,0,0,0,0|2,0,0]=2 8 B13R2.12159 NC1=NS(=O)(=O)c2ccccc21 Amb6336176 [0,0,0,0,0,0|1,0,1]=2 9 B13R2.12159 NC1CS(=O)(=O)c2ccccc21 Amb28555690 [0,0,0,0,0,0|2,0,1]=3 10 B13R2.12159 NC1CS(=O)(=O)c2ccccc21 Amb9384198 [0,0,0,0,0,0|2,0,1]=3 11 B13R2.12159 O=C1CC(F)(F)c2ccccc21 Amb28070042 [0,0,0,0,0,0|4,0,0]=4 12 B13R2.12159 O=C1CS(=O)(=O)c2ccccc21 Amb8629508 [0,0,0,0,0,0|1,0,0]=1 13 B13R2.12159 O=C1CS(=O)(=O)c2ncccc21 Amb33623907 [0,0,0,0,0,0|2,0,0]=2 14 B13R2.12159 O=C1NS(=O)(=O)C2=C1CCCC2 Amb26930256 [0,0,0,0,0,0|0,0,4]=4 15 B13R2.12159 O=C1NS(=O)(=O)c2ccccc21 Amb22167826 [0,0,0,0,0,0|0,0,0]=0 16 B13R2.12159 O=C1NS(=O)(=O)c2ccccc21 Amb535294 [0,0,0,0,0,0|0,0,0]=0 17 B13R2.12159 O=C1NS(=O)(=O)c2cccnc21 Amb26553705 [0,0,0,0,0,0|1,0,0]=1 18 B13R2.12159 O=C1NS(=O)(=O)c2cnccc21 Amb5720889 [0,0,0,0,0,0|1,0,0]=1 19 B13R2.12159 O=C1NS(=O)(=O)c2ncccc21 Amb21963710 [0,0,0,0,0,0|1,0,0]=1 20 B13R2.12159 O=C1OC(Cl)(Cl)c2ccccc21 Amb16233588 [0,0,0,0,0,0|4,0,0]=4 21 B13R2.12159 O=C1OI(=O)(O)c2ccccc21 Amb3358706 [0,0,0,0,0,0|2,0,1]=3 22 B13R2.12159 O=C1OS(=O)(=O)c2ccccc21 Amb2700804 [0,0,0,0,0,0|1,0,0]=1 23 B13R2.12159 O=C1SS(=O)(=O)c2ccccc21 Amb3997253 [0,0,0,0,0,0|1,0,0]=1 24 B13R2.12159 O=C1[N-]S(=O)(=O)c2ccccc21 Amb4316445 [0,0,0,0,0,0|0,0,1]=1 25 B13R2.12159 O=C1[N-]S(=O)(=O)c2ccccc21 Amb495319 [0,0,0,0,0,0|0,0,1]=1 26 B13R2.12159 O=S1(=O)C=C(Br)c2ccccc21 Amb6453686 [0,0,0,0,0,0|2,0,0]=2 27 B13R2.12159 O=S1(=O)C=C(Cl)c2ccccc21 Amb6861552 [0,0,0,0,0,0|2,0,0]=2 28 B13R2.12159 O=S1(=O)CC(Br)c2ccccc21 Amb6472071 [0,0,0,0,0,0|2,0,1]=3 29 B13R2.12159 O=S1(=O)CC(O)c2ccccc21 Amb21927660 [0,0,0,0,0,0|1,0,2]=3 30 B13R2.12159 O=S1(=O)N=C(Cl)c2ccccc21 Amb6369312 [0,0,0,0,0,0|1,0,1]=2 31 B13R2.12159 O=S1(=O)N=C(F)c2ccccc21 Amb35653861 [0,0,0,0,0,0|1,0,1]=2 32 B13R2.12159 O=S1(=O)N=C(O)c2ccccc21 Amb22058725 [0,0,0,0,0,0|0,0,2]=2 33 B13R2.12159 O=S1(=O)N=C(S)c2ccccc21 Amb33528937 [0,0,0,0,0,0|0,1,1]=2 34 B13R2.12159 O=S1(=O)N=C([O-])c2ccccc21 Amb22347862 [0,0,0,0,0,0|0,0,2]=2 35 B13R2.12159 O=S1(=O)NC(=S)c2ccccc21 Amb22496761 [0,0,0,0,0,0|0,1,0]=1 36 B13R2.12159 O=S1(=O)NC(O)c2ccccc21 Amb27396548 [0,0,0,0,0,0|0,0,2]=2 37 B13R2.12159 O=S1(=O)OC(Cl)c2ccccc21 Amb6365032 [0,0,0,0,0,0|2,0,1]=3 38 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb27487451 [1,0,0,0,0,0|2,0,0]=3 39 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [1,0,0,0,0,0|3,0,0]=4 40 B12R2.2028 CC1=CC(=O)c2ccccc21 Amb9783432 [1,0,0,0,0,0|3,0,0]=4 41 B12R2.2028 CC1CC(=O)c2ccccc21 Amb9747864 [1,0,0,0,0,0|3,0,0]=4 42 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [1,0,0,0,0,0|2,0,0]=3 43 B12R2.2028 CC1NC(=S)c2ccccc21 Amb27962483 [1,0,0,0,0,0|2,1,0]=4 44 B12R2.2028 CN1NC(=O)c2ccccc21 Amb22372319 [1,0,0,0,0,0|2,0,0]=3 45 B12R2.2028 CN1NC(=O)c2cccnc21 Amb19314984 [1,0,0,0,0,0|3,0,0]=4 46 B12R2.2028 CN1NC(=S)c2ccccc21 Amb26952885 [1,0,0,0,0,0|2,1,0]=4 47 B12R2.2028 CN1SC(=O)c2ccccc21 Amb19664923 [1,0,0,0,0,0|3,0,0]=4 48 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [1,0,0,0,0,0|3,0,0]=4 49 B12R2.2028 C[C@@H]1OC(=O)c2ccccc21 Amb25892505 [1,0,0,0,0,0|3,0,0]=4 50 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [1,0,0,0,0,0|3,0,0]=4 51 B12R2.2028 N=C1NC(=N)c2ccccc21 Amb4410671 [1,0,0,0,0,0|3,0,0]=4 52 B12R2.2028 N=C1NC(=O)c2ccccc21 Amb21811514 [1,0,0,0,0,0|2,0,0]=3 53 B12R2.2028 N=C1NC(=S)c2ccccc21 Amb27268465 [1,0,0,0,0,0|2,1,0]=4 54 B12R2.2028 NC1=NC(=O)c2ccccc21 Amb6252622 [1,0,0,0,0,0|2,0,1]=4 55 B12R2.2028 NC1CC(=O)c2ccccc21 Amb17470381 [1,0,0,0,0,0|3,0,0]=4 56 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [1,0,0,0,0,0|3,0,0]=4 57 B12R2.2028 NC1NC(=O)c2ccccc21 Amb22372261 [1,0,0,0,0,0|2,0,0]=3 58 B12R2.2028 N[C@@H]1CC(=O)c2ccccc21 Amb27655630 [1,0,0,0,0,0|3,0,0]=4 59 B12R2.2028 O=C1C=[N+]([O-])c2ccccc21 Amb17843025 [1,0,0,0,0,0|2,0,1]=4 60 B12R2.2028 O=C1CC(=O)c2ccccc21 Amb1883008 [1,0,0,0,0,0|2,0,0]=3 61 B12R2.2028 O=C1CC(=O)c2ncccc21 Amb28324367 [1,0,0,0,0,0|3,0,0]=4 62 B12R2.2028 O=C1CC(Br)c2ccccc21 Amb10068269 [1,0,0,0,0,0|3,0,0]=4 63 B12R2.2028 O=C1CC(Cl)c2ccccc21 Amb26945025 [1,0,0,0,0,0|3,0,0]=4 64 B12R2.2028 O=C1CC(F)c2ccccc21 Amb26621970 [1,0,0,0,0,0|3,0,0]=4 65 B12R2.2028 O=C1CC(I)c2ccccc21 Amb28289407 [1,0,0,0,0,0|3,0,0]=4 66 B12R2.2028 O=C1CC(O)c2ccccc21 Amb27872121 [1,0,0,0,0,0|2,0,1]=4 67 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb1934252 [1,0,0,0,0,0|1,0,0]=2 68 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb33868500 [1,0,0,0,0,0|1,0,0]=2 69 B12R2.2028 O=C1NC(=O)c2cnccc21 Amb2609991 [1,0,0,0,0,0|2,0,0]=3 70 B12R2.2028 O=C1NC(=O)c2ncccc21 Amb2384085 [1,0,0,0,0,0|2,0,0]=3 71 B12R2.2028 O=C1NC(=O)c2nccnc21 Amb22499658 [1,0,0,0,0,0|3,0,0]=4 72 B12R2.2028 O=C1NC(Br)=C2C=CC=CN12 Amb27623626 [1,0,0,0,0,0|3,0,0]=4 73 B12R2.2028 O=C1NC(F)c2ccccc21 Amb27165216 [1,0,0,0,0,0|2,0,0]=3 74 B12R2.2028 O=C1NC(O)c2ccccc21 Amb17593710 [1,0,0,0,0,0|1,0,1]=3 75 B12R2.2028 O=C1OC(=O)c2ccccc21 Amb17748796 [1,0,0,0,0,0|2,0,0]=3 76 B12R2.2028 O=C1OC(=O)c2cnccc21 Amb2609992 [1,0,0,0,0,0|3,0,0]=4 77 B12R2.2028 O=C1OC(=O)c2ncccc21 Amb1106402 [1,0,0,0,0,0|3,0,0]=4 78 B12R2.2028 O=C1OC(Br)c2ccccc21 Amb2685476 [1,0,0,0,0,0|3,0,0]=4 79 B12R2.2028 O=C1OC(Cl)c2ccccc21 Amb6297233 [1,0,0,0,0,0|3,0,0]=4 80 B12R2.2028 O=C1OC(O)c2ccccc21 Amb10552913 [1,0,0,0,0,0|2,0,1]=4 81 B12R2.2028 O=C1OC(O)c2ccccc21 Amb16226896 [1,0,0,0,0,0|2,0,1]=4 82 B12R2.2028 O=C1OS(=O)c2ccccc21 Amb27755534 [1,0,0,0,0,0|1,0,1]=3 83 B12R2.2028 O=C1O[IH2](Cl)c2ccccc21 Amb26012976 [1,0,0,0,0,0|3,0,0]=4 84 B12R2.2028 O=C1O[IH2](O)c2ccccc21 Amb33548934 [1,0,0,0,0,0|2,0,1]=4 85 B12R2.2028 O=C1SC(=O)c2ccccc21 Amb2610321 [1,0,0,0,0,0|2,0,0]=3 86 B12R2.2028 O=C1SC(O)c2ccccc21 Amb28207229 [1,0,0,0,0,0|2,0,1]=4 87 B12R2.2028 O=C1[CH-]C(=O)[n+]2ccccc21 Amb27823426 [1,0,0,0,0,0|3,0,0]=4 88 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb28990952 [1,0,0,0,0,0|1,0,1]=3 89 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb6365847 [1,0,0,0,0,0|1,0,1]=3 90 B12R2.2028 O=c1ns(=O)c2ccccc12 Amb4138643 [1,0,0,0,0,0|0,0,2]=3 91 B12R2.2028 OC1NC(=S)c2ccccc21 Amb28198939 [1,0,0,0,0,0|1,1,1]=4 92 B12R2.2028 S=C1NC(=S)c2ccccc21 Amb28241299 [1,0,0,0,0,0|1,2,0]=4 93 B12R2.2403 N=S1(=O)CCc2ccccc21 Amb32666887 [1,0,0,0,0,0|2,0,1]=4 94 B12R2.2403 O=S1(=O)C=Cc2ccccc21 Amb6356379 [1,0,0,0,0,0|1,0,0]=2 95 B12R2.2403 O=S1(=O)C=Cc2cccnc21 Amb24635508 [1,0,0,0,0,0|2,0,0]=3 96 B12R2.2403 O=S1(=O)C=Cc2ncccc21 Amb28365435 [1,0,0,0,0,0|2,0,0]=3 97 B12R2.2403 O=S1(=O)CCc2ccccc21 Amb5719001 [1,0,0,0,0,0|1,0,1]=3 98 B12R2.2403 O=S1(=O)N=Nc2ccccc21 Amb25191174 [1,0,0,0,0,0|1,0,1]=3 99 B12R2.2403 O=S1(=O)NCc2ccccc21 Amb2695161 [1,0,0,0,0,0|0,0,1]=2 100 B12R2.2403 O=S1(=O)OCc2ccccc21 Amb4034604 [1,0,0,0,0,0|1,0,1]=3 101 B14R2.4643 CC1(C)NC(=O)c2cc(Br)ccc21 Amb23439235 [0,1,0,0,0,0|3,0,0]=4 102 B14R2.4643 CC1(C)NC(=O)c2cc(Cl)ccc21 Amb27878877 [0,1,0,0,0,0|3,0,0]=4 103 B14R2.4643 CC1(C)NC(=O)c2cc(F)ccc21 Amb27159600 [0,1,0,0,0,0|3,0,0]=4 104 B14R2.4643 CC1(C)NC(=O)c2cc(N)ccc21 Amb22372262 [0,1,0,0,0,0|3,0,0]=4 105 B14R2.4643 CC1=CS(=O)(=O)c2ccc(Cl)cc21 Amb2614545 [0,1,0,0,0,0|2,0,0]=3 106 B14R2.4643 CC1=CS(=O)(=O)c2ccc(F)cc21 Amb2614524 [0,1,0,0,0,0|2,0,0]=3 107 B14R2.4643 Cc1ccc2c(c1)C(N)=NS2(=O)=O Amb26908443 [0,1,0,0,0,0|1,0,1]=3 108 B14R2.4643 N=C1NS(=O)(=O)c2ccc(F)cc21 Amb27835535 [0,1,0,0,0,0|1,0,0]=2 109 B14R2.4643 Nc1ccc2c(c1)C(=O)CS2(=O)=O Amb33136362 [0,1,0,0,0,0|1,0,0]=2 110 B14R2.4643 Nc1ccc2c(c1)C(=O)NS2(=O)=O Amb10177538 [0,1,0,0,0,0|0,0,0]=1 111 B14R2.4643 Nc1ccc2c(c1)C(N)CS2(=O)=O Amb33136369 [0,1,0,0,0,0|2,0,1]=4 112 B14R2.4643 O=C1CS(=O)(=O)c2ccc(Br)cc21 Amb33330403 [0,1,0,0,0,0|1,0,0]=2 113 B14R2.4643 O=C1NS(=O)(=O)c2ccc(Br)cc21 Amb3460435 [0,1,0,0,0,0|0,0,0]=1 114 B14R2.4643 O=C1NS(=O)(=O)c2ccc(Cl)nc21 Amb24427894 [0,1,0,0,0,0|1,0,0]=2 115 B14R2.4643 O=C1NS(=O)(=O)c2ccc(F)cc21 Amb25866288 [0,1,0,0,0,0|0,0,0]=1 116 B14R2.4643 O=C1OS(=O)(=O)c2ccc(F)cc21 Amb25785814 [0,1,0,0,0,0|1,0,0]=2 117 B14R2.4643 O=C1[N-]S(=O)(=O)c2ccc(Cl)cc21 Amb28556094 [0,1,0,0,0,0|0,0,1]=2 118 B14R2.4643 O=S1(=O)CC(O)c2cc(Br)ccc21 Amb30628625 [0,1,0,0,0,0|1,0,2]=4 119 B14R2.4643 O=S1(=O)CC(O)c2cc(Cl)ccc21 Amb21927530 [0,1,0,0,0,0|1,0,2]=4 120 B14R2.4643 O=S1(=O)N=C(Cl)c2cc(Cl)ccc21 Amb27163119 [0,1,0,0,0,0|1,0,1]=3 121 B14R2.8052 Cc1cccc2c1C(=O)NS2(=O)=O Amb33096954 [0,1,0,0,0,0|0,0,0]=1 122 B14R2.8052 Cc1cccc2c1C(N)=NS2(=O)=O Amb25264326 [0,1,0,0,0,0|1,0,1]=3 123 B14R2.8052 NC1=NS(=O)(=O)c2cccc(Cl)c21 Amb26374685 [0,1,0,0,0,0|1,0,1]=3 124 B14R2.8052 NC1CS(=O)(=O)c2cccc(Cl)c21 Amb33136376 [0,1,0,0,0,0|2,0,1]=4 125 B14R2.8052 NC1CS(=O)(=O)c2cccc(F)c21 Amb33136373 [0,1,0,0,0,0|2,0,1]=4 126 B14R2.8052 O=C1CS(=O)(=O)c2cccc(F)c21 Amb33136365 [0,1,0,0,0,0|1,0,0]=2 127 B14R2.8052 O=C1NS(=O)(=O)c2cccc(Cl)c21 Amb24517516 [0,1,0,0,0,0|0,0,0]=1 128 B14R2.8052 O=C1NS(=O)(=O)c2cccc(F)c21 Amb25335750 [0,1,0,0,0,0|0,0,0]=1 129 B14R2.8052 O=S1(=O)CC(O)c2c(Cl)cccc21 Amb33482737 [0,1,0,0,0,0|1,0,2]=4 130 B14R2.8055 CC1=CS(=O)(=O)c2c(Br)cccc21 Amb2657934 [0,1,0,0,0,0|2,0,0]=3 131 B14R2.8055 CC1=CS(=O)(=O)c2c(Cl)cccc21 Amb26645731 [0,1,0,0,0,0|2,0,0]=3 132 B14R2.8055 CC1=CS(=O)(=O)c2c(F)cccc21 Amb25678680 [0,1,0,0,0,0|2,0,0]=3 133 B14R2.8055 Cc1cccc2c1S(=O)(=O)N=C2N Amb26374753 [0,1,0,0,0,0|1,0,1]=3 134 B14R2.8055 NC1=NS(=O)(=O)c2c(Br)cccc21 Amb26039836 [0,1,0,0,0,0|1,0,1]=3 135 B14R2.8055 NC1=NS(=O)(=O)c2c(F)cccc21 Amb27879556 [0,1,0,0,0,0|1,0,1]=3 136 B14R2.8055 NC1CS(=O)(=O)c2c(F)cccc21 Amb9401425 [0,1,0,0,0,0|2,0,1]=4 137 B14R2.8055 O=C1CS(=O)(=O)c2c(F)cccc21 Amb33136364 [0,1,0,0,0,0|1,0,0]=2 138 B14R2.8055 O=C1NS(=O)(=O)c2c(Br)cccc21 Amb32679417 [0,1,0,0,0,0|0,0,0]=1 139 B14R2.8055 O=C1NS(=O)(=O)c2c(Cl)cccc21 Amb26304284 [0,1,0,0,0,0|0,0,0]=1 140 B14R2.8732 CC1(C)NC(=O)c2ccc(Br)cc21 Amb24496166 [0,1,0,0,0,0|3,0,0]=4 141 B14R2.8732 CC1(C)NC(=O)c2ccc(Cl)cc21 Amb27411574 [0,1,0,0,0,0|3,0,0]=4 142 B14R2.8732 CC1(C)NC(=O)c2ccc(F)cc21 Amb25776663 [0,1,0,0,0,0|3,0,0]=4 143 B14R2.8732 CC1(C)NC(=O)c2ccc(O)cc21 Amb22495682 [0,1,0,0,0,0|3,0,0]=4 144 B14R2.8732 CC1=NS(=O)(=O)c2cc(Br)ccc21 Amb26081048 [0,1,0,0,0,0|1,0,1]=3 145 B14R2.8732 CC1CS(=O)(=O)c2cc(N)ccc21 Amb6718803 [0,1,0,0,0,0|2,0,1]=4 146 B14R2.8732 Cc1ccc2c(c1)S(=O)(=O)C=C2N Amb20668129 [0,1,0,0,0,0|2,0,0]=3 147 B14R2.8732 Cc1ccc2c(c1)S(=O)(=O)CC2=O Amb33136361 [0,1,0,0,0,0|1,0,0]=2 148 B14R2.8732 Cc1ccc2c(c1)S(=O)(=O)CC2N Amb33136368 [0,1,0,0,0,0|2,0,1]=4 149 B14R2.8732 NC1CS(=O)(=O)c2cc(Br)ccc21 Amb33136374 [0,1,0,0,0,0|2,0,1]=4 150 B14R2.8732 NC1CS(=O)(=O)c2cc(F)ccc21 Amb33136367 [0,1,0,0,0,0|2,0,1]=4 151 B14R2.8732 Nc1ccc2c(c1)S(=O)(=O)NC2=O Amb10610361 [0,1,0,0,0,0|0,0,0]=1 152 B14R2.8732 O=C1CS(=O)(=O)c2cc(Br)ccc21 Amb23452939 [0,1,0,0,0,0|1,0,0]=2 153 B14R2.8732 O=C1CS(=O)(=O)c2cc(F)ccc21 Amb33136360 [0,1,0,0,0,0|1,0,0]=2 154 B14R2.8732 O=C1NS(=O)(=O)c2cc(Br)ccc21 Amb22900015 [0,1,0,0,0,0|0,0,0]=1 155 B14R2.8732 O=C1NS(=O)(=O)c2cc(Cl)ccc21 Amb19887405 [0,1,0,0,0,0|0,0,0]=1 156 B14R2.8732 O=C1NS(=O)(=O)c2cc(F)ccc21 Amb26059856 [0,1,0,0,0,0|0,0,0]=1 157 B14R2.8732 O=S1(=O)CC(O)c2ccc(Br)cc21 Amb25331931 [0,1,0,0,0,0|1,0,2]=4 158 B14R2.8732 O=S1(=O)N=C(Cl)c2ccc(Br)cc21 Amb35788504 [0,1,0,0,0,0|1,0,1]=3 159 B14R2.8732 O=S1(=O)N=C(Cl)c2ccc(Cl)cc21 Amb27609762 [0,1,0,0,0,0|1,0,1]=3 160 B14R2.17370 CCC1(O)NC(=O)c2ccccc21 Amb27830116 [0,1,0,0,0,0|2,0,1]=4 161 B14R2.45179 C#CC1=CS(=O)(=O)c2ccccc21 Amb27459520 [0,1,0,0,0,0|2,0,0]=3 162 B14R2.45179 CNC1=NS(=O)(=O)c2ccccc21 Amb6321119 [0,1,0,0,0,0|1,0,1]=3 163 B14R2.45179 CNC1CS(=O)(=O)c2ccccc21 Amb32674816 [0,1,0,0,0,0|2,0,1]=4 164 B14R2.45179 CNC1CS(=O)(=O)c2ccccc21 Amb9384141 [0,1,0,0,0,0|2,0,1]=4 165 B14R2.45179 COC1=NS(=O)(=O)c2ccccc21 Amb6870566 [0,1,0,0,0,0|0,0,2]=3 166 B14R2.45179 COC1CS(=O)(=O)c2ccccc21 Amb27391241 [0,1,0,0,0,0|1,0,2]=4 167 B14R2.45179 NCC1=CS(=O)(=O)c2ccccc21 Amb28316871 [0,1,0,0,0,0|2,0,0]=3 168 B14R2.45179 NCC1=CS(=O)(=O)c2ccccc21 Amb28600411 [0,1,0,0,0,0|2,0,0]=3 169 B14R2.45179 NCC1=NS(=O)(=O)c2ccccc21 Amb27638274 [0,1,0,0,0,0|1,0,1]=3 170 B14R2.45179 NCC1CS(=O)(=O)c2ccccc21 Amb33531681 [0,1,0,0,0,0|2,0,1]=4 171 B14R2.45179 NNC1=CS(=O)(=O)c2ccccc21 Amb5720538 [0,1,0,0,0,0|2,0,0]=3 172 B14R2.45179 NNC1=NS(=O)(=O)c2ccccc21 Amb3460412 [0,1,0,0,0,0|1,0,1]=3 173 B14R2.45179 O=CC1=NS(=O)(=O)c2ccccc21 Amb18189585 [0,1,0,0,0,0|0,0,1]=2 174 B14R2.45179 O=C[C@@H]1NS(=O)(=O)c2ccccc21 Amb18188544 [0,1,0,0,0,0|0,0,1]=2 175 B14R2.45179 O=S1(=O)C=C(CO)c2ccccc21 Amb27482055 [0,1,0,0,0,0|1,0,1]=3 176 B14R2.45179 O=S1(=O)CC(CO)c2ccccc21 Amb24409089 [0,1,0,0,0,0|1,0,2]=4 177 B14R2.45179 O=S1(=O)C\C(=N/O)c2ccccc21 Amb26501719 [0,1,0,0,0,0|1,0,1]=3 178 B14R2.45179 O=S1(=O)N=C(CBr)c2ccccc21 Amb26639384 [0,1,0,0,0,0|1,0,1]=3 179 B14R2.55357 CC1(C)NS(=O)(=O)c2ccccc21 Amb22228281 [0,1,0,0,0,0|1,0,1]=3 180 B14R2.55357 CC1(O)CS(=O)(=O)c2ccccc21 Amb30628624 [0,1,0,0,0,0|1,0,2]=4 181 B14R2.55357 O=S1(=O)CS(=O)(=O)c2ccccc21 Amb5718172 [0,1,0,0,0,0|2,0,0]=3 182 B14R2.55357 O=S1(=O)NS(=O)(=O)c2ccccc21 Amb24324953 [0,1,0,0,0,0|1,0,0]=2 183 B14R2.57380 CC1=C(Cl)c2ccccc2S1(=O)=O Amb2646861 [0,1,0,0,0,0|2,0,0]=3 184 B14R2.57380 CC1=C(N)c2ccccc2S1(=O)=O Amb27267817 [0,1,0,0,0,0|2,0,0]=3 185 B14R2.57380 CC1C(=O)c2ccccc2S1(=O)=O Amb33624328 [0,1,0,0,0,0|1,0,0]=2 186 B14R2.57380 CN1C(=O)c2ccccc2S1(=O)=O Amb4394076 [0,1,0,0,0,0|0,0,0]=1 187 B14R2.57380 CN1C(=O)c2ncccc2S1(=O)=O Amb5720885 [0,1,0,0,0,0|1,0,0]=2 188 B14R2.57380 O=C1c2ccccc2S(=O)(=O)N1Br Amb8517499 [0,1,0,0,0,0|0,0,0]=1 189 B14R2.57380 O=C1c2ccccc2S(=O)(=O)N1Cl Amb8517500 [0,1,0,0,0,0|0,0,0]=1 190 B14R2.57380 O=C1c2ccccc2S(=O)(=O)N1O Amb27793609 [0,1,0,0,0,0|0,0,0]=1 191 B14R2.57380 O=C1c2ccccc2S(=O)(=O)N1[Na] Amb22515614 [0,1,0,0,0,0|0,0,0]=1 192 B14R2.57380 O=S1(=O)C(Br)=C(Br)c2ccccc21 Amb2609624 [0,1,0,0,0,0|2,0,0]=3 193 B14R2.57380 O=S1(=O)c2ccccc2C(Br)C1Br Amb5720554 [0,1,0,0,0,0|2,0,1]=4 194 B12R1.39 C=CCS(=N)(=O)c1ccccc1 Amb32992723 [0,0,1,0,0,0|3,0,0]=4 195 B12R1.39 C=CCS(=N)(=O)c1ccccc1 Amb33096775 [0,0,1,0,0,0|3,0,0]=4 196 B12R1.39 C=CCS(=O)(=O)c1ccccc1 Amb2782882 [0,0,1,0,0,0|2,0,0]=3 197 B12R1.39 C=CC[S@](=N)(=O)c1ccccc1 Amb33744001 [0,0,1,0,0,0|3,0,0]=4 198 B12R1.39 CC(C)(NC=O)c1ccccc1 Amb27875118 [0,0,1,0,0,0|3,0,0]=4 199 B12R1.39 CCCS(=O)(=O)c1ccccc1 Amb24485446 [0,0,1,0,0,0|2,0,1]=4 200 B12R1.39 CCNS(=O)(=O)c1ccccc1 Amb3357686 [0,0,1,0,0,0|1,0,1]=3 201 B12R1.39 CCNS(=O)(=O)c1ccccn1 Amb25892232 [0,0,1,0,0,0|2,0,1]=4 202 B12R1.39 CCNS(=O)(=O)c1cccnc1 Amb8886217 [0,0,1,0,0,0|2,0,1]=4 203 B12R1.39 CCOS(=O)(=O)c1ccccc1 Amb4017809 [0,0,1,0,0,0|2,0,1]=4 204 B12R1.39 COCS(=O)(=O)c1ccccc1 Amb24324970 [0,0,1,0,0,0|3,0,0]=4 205 B12R1.39 CONS(=O)(=O)c1ccccc1 Amb16969978 [0,0,1,0,0,0|2,0,0]=3 206 B12R1.39 CONS(=O)(=O)c1cccnc1 Amb27213622 [0,0,1,0,0,0|3,0,0]=4 207 B12R1.39 CSCS(=O)(=O)c1ccccc1 Amb9786504 [0,0,1,0,0,0|3,0,0]=4 208 B12R1.39 C\C=C\S(=O)(=O)c1ccccc1 Amb24484200 [0,0,1,0,0,0|2,0,0]=3 209 B12R1.39 N#CCS(=O)(=O)c1ccccc1 Amb6355805 [0,0,1,0,0,0|2,0,1]=4 210 B12R1.39 NCCS(=O)(=O)c1ccccc1 Amb5716090 [0,0,1,0,0,0|2,0,1]=4 211 B12R1.39 NCCS(=O)(=O)c1ccccc1 Amb5742909 [0,0,1,0,0,0|2,0,1]=4 212 B12R1.39 NCNS(=O)(=O)c1ccccc1 Amb27442498 [0,0,1,0,0,0|1,0,1]=3 213 B12R1.39 N\C=C\S(=O)(=O)c1ccccc1 Amb25719150 [0,0,1,0,0,0|2,0,0]=3 214 B12R1.39 O=C=NS(=O)(=O)c1ccccc1 Amb8514478 [0,0,1,0,0,0|0,0,2]=3 215 B12R1.39 O=CNS(=O)(=O)c1ccccc1 Amb27445435 [0,0,1,0,0,0|0,0,0]=1 216 B12R1.39 O=S(=O)(CCBr)c1ccccc1 Amb17106167 [0,0,1,0,0,0|2,0,1]=4 217 B12R1.39 O=S(=O)(CCCl)c1ccccc1 Amb1034876 [0,0,1,0,0,0|2,0,1]=4 218 B12R1.39 O=S(=O)(N=C=S)c1ccccc1 Amb22274838 [0,0,1,0,0,0|0,1,2]=4 219 B12R1.39 [C-]#[N+]CS(=O)(=O)c1ccccc1 Amb22231391 [0,0,1,0,0,0|3,0,0]=4 220 B12R1.39 [N-]=[N+]=NS(=O)(=O)c1ccccc1 Amb8917359 [0,0,1,0,0,0|2,0,1]=4 221 B12R1.76 C#Cc1ccccc1S(=O)(=O)Cl Amb33054758 [0,0,1,0,0,0|2,0,1]=4 222 B12R1.76 C#Cc1ccccc1S(=O)(=O)F Amb33054981 [0,0,1,0,0,0|2,0,1]=4 223 B12R1.76 C#Cc1ccccc1S(C)(=O)=O Amb25349904 [0,0,1,0,0,0|2,0,1]=4 224 B12R1.76 C#Cc1ccccc1S(N)(=O)=O Amb23412169 [0,0,1,0,0,0|1,0,1]=3 225 B12R1.76 C=Cc1ccccc1S(=O)(=O)Cl Amb27621065 [0,0,1,0,0,0|2,0,0]=3 226 B12R1.76 C=Cc1ccccc1S(=O)(=O)O Amb24439740 [0,0,1,0,0,0|2,0,0]=3 227 B12R1.76 C=Cc1ccccc1S(C)(=O)=O Amb33263584 [0,0,1,0,0,0|2,0,0]=3 228 B12R1.76 CC(N)(O)c1ccccc1C=O Amb27648960 [0,0,1,0,0,0|2,0,1]=4 229 B12R1.76 CCc1ccccc1S(=O)(=O)Cl Amb1140574 [0,0,1,0,0,0|2,0,1]=4 230 B12R1.76 CCc1ccccc1S(=O)(=O)F Amb25791147 [0,0,1,0,0,0|2,0,1]=4 231 B12R1.76 CCc1ccccc1S(=O)(=O)O Amb25110649 [0,0,1,0,0,0|2,0,1]=4 232 B12R1.76 CCc1ccccc1S(C)(=O)=O Amb27602155 [0,0,1,0,0,0|2,0,1]=4 233 B12R1.76 CCc1ccccc1S(N)(=O)=O Amb9023516 [0,0,1,0,0,0|1,0,1]=3 234 B12R1.76 CCc1cccnc1S(N)(=O)=O Amb32679768 [0,0,1,0,0,0|2,0,1]=4 235 B12R1.76 CNc1ccccc1S(=O)(=O)O Amb27616682 [0,0,1,0,0,0|3,0,0]=4 236 B12R1.76 CNc1ccccc1S(C)(=O)=O Amb9271731 [0,0,1,0,0,0|3,0,0]=4 237 B12R1.76 CNc1ccccc1S(N)(=O)=O Amb9313615 [0,0,1,0,0,0|2,0,0]=3 238 B12R1.76 CNc1cccnc1S(N)(=O)=O Amb22498980 [0,0,1,0,0,0|3,0,0]=4 239 B12R1.76 CNc1ncccc1S(N)(=O)=O Amb18284816 [0,0,1,0,0,0|3,0,0]=4 240 B12R1.76 COc1ccccc1S(=O)(=O)Cl Amb1151563 [0,0,1,0,0,0|3,0,0]=4 241 B12R1.76 COc1ccccc1S(=O)(=O)F Amb18564678 [0,0,1,0,0,0|3,0,0]=4 242 B12R1.76 COc1ccccc1S(=O)(=O)O Amb18863292 [0,0,1,0,0,0|3,0,0]=4 243 B12R1.76 COc1ccccc1S(C)(=O)=O Amb2689245 [0,0,1,0,0,0|3,0,0]=4 244 B12R1.76 COc1ccccc1S(N)(=O)=O Amb33549836 [0,0,1,0,0,0|2,0,0]=3 245 B12R1.76 COc1cccnc1S(N)(=O)=O Amb26944702 [0,0,1,0,0,0|3,0,0]=4 246 B12R1.76 COc1ccncc1S(N)(=O)=O Amb24463929 [0,0,1,0,0,0|3,0,0]=4 247 B12R1.76 COc1ncccc1S(N)(=O)=O Amb25681665 [0,0,1,0,0,0|3,0,0]=4 248 B12R1.76 CP(C)(=O)c1ccccc1C=O Amb33803504 [0,0,1,0,0,0|3,0,0]=4 249 B12R1.76 CS(=O)(=O)c1ccccc1C#N Amb17739679 [0,0,1,0,0,0|2,0,1]=4 250 B12R1.76 CS(=O)(=O)c1ccccc1C=O Amb17739677 [0,0,1,0,0,0|1,0,0]=2 251 B12R1.76 CS(=O)(=O)c1ccccc1CBr Amb21856486 [0,0,1,0,0,0|2,0,1]=4 252 B12R1.76 CS(=O)(=O)c1ccccc1CCl Amb5722853 [0,0,1,0,0,0|2,0,1]=4 253 B12R1.76 CS(=O)(=O)c1ccccc1CN Amb17739678 [0,0,1,0,0,0|2,0,1]=4 254 B12R1.76 CS(=O)(=O)c1ccccc1CN Amb22336987 [0,0,1,0,0,0|2,0,1]=4 255 B12R1.76 CS(=O)(=O)c1ccccc1CO Amb22500415 [0,0,1,0,0,0|1,0,2]=4 256 B12R1.76 CS(=O)(=O)c1ccccc1CS Amb33481882 [0,0,1,0,0,0|1,1,1]=4 257 B12R1.76 CS(=O)(=O)c1ccccc1NN Amb10071827 [0,0,1,0,0,0|3,0,0]=4 258 B12R1.76 CS(=O)(=O)c1ccccc1NN Amb3942550 [0,0,1,0,0,0|3,0,0]=4 259 B12R1.76 CS(=O)(=O)c1ccccc1NO Amb27882219 [0,0,1,0,0,0|2,0,1]=4 260 B12R1.76 CS(=O)(=O)c1ncccc1C=O Amb21929273 [0,0,1,0,0,0|2,0,0]=3 261 B12R1.76 CSc1ccccc1S(=O)(=O)Cl Amb1132140 [0,0,1,0,0,0|3,0,0]=4 262 B12R1.76 CSc1ccccc1S(=O)(=O)F Amb32717595 [0,0,1,0,0,0|3,0,0]=4 263 B12R1.76 CSc1ccccc1S(N)(=O)=O Amb9023526 [0,0,1,0,0,0|2,0,0]=3 264 B12R1.76 C[C@@](N)(O)c1ccccc1C=O Amb28060607 [0,0,1,0,0,0|2,0,1]=4 265 B12R1.76 N#Cc1ccccc1S(=O)(=O)Br Amb27468174 [0,0,1,0,0,0|2,0,1]=4 266 B12R1.76 N#Cc1ccccc1S(=O)(=O)Cl Amb1152441 [0,0,1,0,0,0|2,0,1]=4 267 B12R1.76 N#Cc1ccccc1S(=O)(=O)F Amb24573021 [0,0,1,0,0,0|2,0,1]=4 268 B12R1.76 N#Cc1ccccc1S(N)(=O)=O Amb1077708 [0,0,1,0,0,0|1,0,1]=3 269 B12R1.76 N#Cc1cccnc1S(N)(=O)=O Amb19074278 [0,0,1,0,0,0|2,0,1]=4 270 B12R1.76 N#Cc1ccncc1S(N)(=O)=O Amb27817020 [0,0,1,0,0,0|2,0,1]=4 271 B12R1.76 N#Cc1ncccc1S(N)(=O)=O Amb26639037 [0,0,1,0,0,0|2,0,1]=4 272 B12R1.76 NCc1ccccc1S(N)(=O)=O Amb1140994 [0,0,1,0,0,0|1,0,1]=3 273 B12R1.76 NCc1ccccc1S(N)(=O)=O Amb33552465 [0,0,1,0,0,0|1,0,1]=3 274 B12R1.76 NNc1ccccc1S(=O)(=O)O Amb28346266 [0,0,1,0,0,0|3,0,0]=4 275 B12R1.76 NNc1ccccc1S(N)(=O)=O Amb22494881 [0,0,1,0,0,0|2,0,0]=3 276 B12R1.76 NNc1ccccc1S(N)(=O)=O Amb8388453 [0,0,1,0,0,0|2,0,0]=3 277 B12R1.76 NNc1ccncc1S(N)(=O)=O Amb18649841 [0,0,1,0,0,0|3,0,0]=4 278 B12R1.76 NS(=O)(=O)c1ccccc1C=O Amb6307268 [0,0,1,0,0,0|0,0,0]=1 279 B12R1.76 NS(=O)(=O)c1ccccc1CCl Amb24441597 [0,0,1,0,0,0|1,0,1]=3 280 B12R1.76 NS(=O)(=O)c1ccccc1CO Amb33545561 [0,0,1,0,0,0|0,0,2]=3 281 B12R1.76 NS(=O)(=O)c1cnccc1C=O Amb28322389 [0,0,1,0,0,0|1,0,0]=2 282 B12R1.76 NS(=O)(=O)c1ncccc1NO Amb28146034 [0,0,1,0,0,0|2,0,1]=4 283 B12R1.76 O=Cc1ccccc1S(=O)(=O)Cl Amb13951921 [0,0,1,0,0,0|1,0,0]=2 284 B12R1.76 O=Cc1ccccc1S(=O)(=O)F Amb25790537 [0,0,1,0,0,0|1,0,0]=2 285 B12R1.76 O=Cc1ccccc1S(=O)(=O)[O-] Amb8514593 [0,0,1,0,0,0|1,0,0]=2 286 B12R1.76 O=S(=O)(Cl)c1ccccc1CBr Amb26626126 [0,0,1,0,0,0|2,0,1]=4 287 B12R1.76 O=S(=O)(Cl)c1ccccc1CCl Amb24349801 [0,0,1,0,0,0|2,0,1]=4 288 B12R1.76 O=S(=O)(Cl)c1ccccc1CF Amb26458009 [0,0,1,0,0,0|2,0,1]=4 289 B12R1.76 O=S(=O)(F)c1ccccc1CCl Amb25159471 [0,0,1,0,0,0|2,0,1]=4 290 B12R1.76 O=S(=O)(F)c1ccccc1CF Amb33071851 [0,0,1,0,0,0|2,0,1]=4 291 B12R1.76 O=S(=O)(O)c1ccccc1CO Amb24457291 [0,0,1,0,0,0|1,0,2]=4 292 B12R1.76 O=S(=O)([O-])c1ccccc1CO Amb31269546 [0,0,1,0,0,0|1,0,2]=4 293 B12R1.76 [C-]#[N+]c1ccccc1S(C)(=O)=O Amb33263347 [0,0,1,0,0,0|3,0,0]=4 294 B12R1.107 C=C(NC(C)=O)c1ccccc1 Amb8394362 [0,0,1,0,0,0|3,0,0]=4 295 B12R1.107 CC(=O)CC(=O)c1ccccc1 Amb534154 [0,0,1,0,0,0|3,0,0]=4 296 B12R1.107 CC(N)NC(=O)c1ccccc1 Amb27792210 [0,0,1,0,0,0|3,0,0]=4 297 B12R1.107 CN(C)NC(=O)c1ccccc1 Amb10574824 [0,0,1,0,0,0|3,0,0]=4 298 B12R1.107 N=C(N)NC(=O)c1ccccc1 Amb25703047 [0,0,1,0,0,0|3,0,0]=4 299 B12R1.107 NC(=O)CC(=O)c1ccccc1 Amb2734576 [0,0,1,0,0,0|3,0,0]=4 300 B12R1.107 NC(=O)NC(=O)c1ccccc1 Amb3989198 [0,0,1,0,0,0|2,0,0]=3 301 B12R1.107 NC(=O)NC(=O)c1ccccn1 Amb27866159 [0,0,1,0,0,0|3,0,0]=4 302 B12R1.107 NC(=S)NC(=O)c1ccccc1 Amb2684614 [0,0,1,0,0,0|2,1,0]=4 303 B12R1.107 O=C(C[N+](=O)[O-])c1ccccc1 Amb3687238 [0,0,1,0,0,0|2,0,1]=4 304 B12R1.261 CC(=O)c1ccccc1C(=O)Cl Amb20673428 [0,0,1,0,0,0|3,0,0]=4 305 B12R1.261 CC(=O)c1ccccc1C(=O)O Amb2792458 [0,0,1,0,0,0|2,0,1]=4 306 B12R1.261 CC(=O)c1ccccc1C(C)=O Amb2721252 [0,0,1,0,0,0|3,0,0]=4 307 B12R1.261 CC(=O)c1ccccc1C(N)=O Amb26075354 [0,0,1,0,0,0|2,0,0]=3 308 B12R1.261 CC(=O)c1ccccc1N(=O)=O Amb6357340 [0,0,1,0,0,0|2,0,0]=3 309 B12R1.261 CC(=O)c1ccccc1[N+](=O)[O-] Amb3940440 [0,0,1,0,0,0|2,0,1]=4 310 B12R1.261 CS(=O)c1ccccc1C(=O)O Amb1216535 [0,0,1,0,0,0|2,0,1]=4 311 B12R1.261 CS(=O)c1ccccc1C(N)=O Amb25876512 [0,0,1,0,0,0|1,0,1]=3 312 B12R1.261 N=C(N)c1ccccc1C(=O)O Amb28384608 [0,0,1,0,0,0|2,0,1]=4 313 B12R1.261 N=C(N)c1ccccc1[N+](=O)[O-] Amb18792616 [0,0,1,0,0,0|2,0,1]=4 314 B12R1.261 N=C(N)c1ccccc1[N+](=O)[O-] Amb22551026 [0,0,1,0,0,0|2,0,1]=4 315 B12R1.261 NC(=O)c1ccccc1B(O)O Amb2455624 [0,0,1,0,0,0|1,0,2]=4 316 B12R1.261 NC(=O)c1ccccc1C(=O)O Amb2590006 [0,0,1,0,0,0|1,0,1]=3 317 B12R1.261 NC(=O)c1ccccc1C(Cl)Cl Amb27236947 [0,0,1,0,0,0|3,0,0]=4 318 B12R1.261 NC(=O)c1ccccc1C(F)F Amb32648830 [0,0,1,0,0,0|3,0,0]=4 319 B12R1.261 NC(=O)c1ccccc1C(N)=O Amb1929307 [0,0,1,0,0,0|2,0,0]=3 320 B12R1.261 NC(=O)c1ccccc1N(=O)=O Amb6357401 [0,0,1,0,0,0|1,0,0]=2 321 B12R1.261 NC(=O)c1ccccc1[N+](=O)[O-] Amb6335822 [0,0,1,0,0,0|1,0,1]=3 322 B12R1.261 NC(=O)c1cccnc1[N+](=O)[O-] Amb23437213 [0,0,1,0,0,0|2,0,1]=4 323 B12R1.261 NC(=O)c1ccncc1C(=O)O Amb2609577 [0,0,1,0,0,0|2,0,1]=4 324 B12R1.261 NC(=O)c1ccncc1[N+](=O)[O-] Amb20242693 [0,0,1,0,0,0|2,0,1]=4 325 B12R1.261 NC(=O)c1cnccc1C(=O)O Amb27645485 [0,0,1,0,0,0|2,0,1]=4 326 B12R1.261 NC(=O)c1ncccc1C(=O)O Amb2612004 [0,0,1,0,0,0|2,0,1]=4 327 B12R1.261 NC(=O)c1ncccc1[N+](=O)[O-] Amb22499564 [0,0,1,0,0,0|2,0,1]=4 328 B12R1.261 NC(=S)c1ccccc1C(=O)O Amb1113491 [0,0,1,0,0,0|1,1,1]=4 329 B12R1.261 NC(=S)c1ccccc1[N+](=O)[O-] Amb6374158 [0,0,1,0,0,0|1,1,1]=4 330 B12R1.261 O=C(Cl)c1ccccc1C(=O)Cl Amb8513296 [0,0,1,0,0,0|3,0,0]=4 331 B12R1.261 O=C(Cl)c1ccccc1[N+](=O)[O-] Amb33528402 [0,0,1,0,0,0|2,0,1]=4 332 B12R1.261 O=C(O)c1ccccc1C(=O)O Amb22338462 [0,0,1,0,0,0|2,0,1]=4 333 B12R1.261 O=C(O)c1ccccc1C(=O)O Amb2556636 [0,0,1,0,0,0|2,0,1]=4 334 B12R1.261 O=C(O)c1ccccc1I(=O)=O Amb4030382 [0,0,1,0,0,0|2,0,0]=3 335 B12R1.261 O=C(O)c1ccccc1S(=O)O Amb3992396 [0,0,1,0,0,0|1,0,2]=4 336 B12R1.261 O=C(O)c1ccccc1[N+](=O)[O-] Amb6355839 [0,0,1,0,0,0|2,0,1]=4 337 B12R1.261 O=C(O)c1ccncc1N(=O)=O Amb20621861 [0,0,1,0,0,0|3,0,0]=4 338 B12R1.261 O=C(O)c1ncccc1N(=O)=O Amb20621913 [0,0,1,0,0,0|3,0,0]=4 339 B12R1.261 O=C([O-])c1ccccc1C(=O)O Amb6365805 [0,0,1,0,0,0|2,0,1]=4 340 B12R1.261 O=C([O-])c1ccccc1C(=O)[O-] Amb22491164 [0,0,1,0,0,0|2,0,1]=4 341 B12R1.261 O=C([O-])c1ccccc1C(=O)[O-] Amb24323292 [0,0,1,0,0,0|2,0,1]=4 342 B12R1.261 O=C([O-])c1ccccc1C(=O)[O-] Amb8488239 [0,0,1,0,0,0|2,0,1]=4 343 B12R1.261 O=C([O-])c1ccccc1[N+](=O)[O-] Amb24309021 [0,0,1,0,0,0|2,0,1]=4 344 B12R1.261 O=N(=O)c1ccccc1N(=O)=O Amb8395211 [0,0,1,0,0,0|3,0,0]=4 345 B14R3.12265 O=C1NC2(C=N2)c3ccccc31 Amb27864029 [0,0,0,1,0,0|3,0,0]=4 346 B14R3.12265 O=C1NC2(CC2)c3ccccc31 Amb22231458 [0,0,0,1,0,0|3,0,0]=4 347 B12R2.138 CC1(C)C(=O)c2ccccc21 Amb27663117 [0,0,0,0,1,0|3,0,0]=4 348 B12R2.138 CC1(O)C(=O)c2ccccc21 Amb26889205 [0,0,0,0,1,0|2,0,1]=4 349 B12R2.3901 O=C1NS(=O)(=O)c2ccoc21 Amb33096939 [0,0,0,0,1,0|1,0,0]=2 350 B12R2.3901 O=C1NS(=O)(=O)c2ccsc21 Amb5720938 [0,0,0,0,1,0|1,0,0]=2 351 B12R2.3901 O=C1NS(=O)(=O)c2cocc21 Amb33096940 [0,0,0,0,1,0|1,0,0]=2 352 B12R2.3901 O=C1NS(=O)(=O)c2cscc21 Amb5717533 [0,0,0,0,1,0|1,0,0]=2 353 B12R2.3901 O=C1NS(=O)(=O)c2csnc21 Amb33096943 [0,0,0,0,1,0|2,0,0]=3 354 B12R2.3901 O=C1NS(=O)(=O)c2occc21 Amb32685265 [0,0,0,0,1,0|1,0,0]=2 355 B12R2.3901 O=C1NS(=O)(=O)c2oncc21 Amb27408755 [0,0,0,0,1,0|2,0,0]=3 356 B12R2.3901 O=C1NS(=O)(=O)c2sccc21 Amb32697854 [0,0,0,0,1,0|1,0,0]=2 357 B12R2.3901 O=C1NS(=O)(=O)c2scnc21 Amb33096944 [0,0,0,0,1,0|2,0,0]=3 358 B12R2.3901 O=C1[N-]S(=O)(=O)c2ccsc21 Amb22261435 [0,0,0,0,1,0|1,0,1]=3 359 B14R2.8189 CC1(C)NC(=O)Cc2ccccc21 Amb23454630 [0,0,0,0,0,1|3,0,0]=4 360 B14R2.8189 CC1(C)NC(=O)Nc2ccccc21 Amb16191976 [0,0,0,0,0,1|3,0,0]=4 361 B14R2.8189 CC1=Cc2ccccc2S(=O)(O)=N1 Amb23590823 [0,0,0,0,0,1|1,0,2]=4 362 B14R2.8189 CC1=Nc2cccnc2S(=O)(=O)N1 Amb24664406 [0,0,0,0,0,1|2,0,0]=3 363 B14R2.8189 CC1=Nc2ncccc2S(=O)(=O)N1 Amb13951185 [0,0,0,0,0,1|2,0,0]=3 364 B14R2.8189 CC1Nc2ccccc2S(=O)(=O)N1 Amb24441691 [0,0,0,0,0,1|1,0,1]=3 365 B14R2.8189 CC1Nc2cccnc2S(=O)(=O)N1 Amb26974006 [0,0,0,0,0,1|2,0,1]=4 366 B14R2.8189 CC1Nc2ccncc2S(=O)(=O)N1 Amb27223895 [0,0,0,0,0,1|2,0,1]=4 367 B14R2.8189 CC1Nc2ncccc2S(=O)(=O)N1 Amb24488803 [0,0,0,0,0,1|2,0,1]=4 368 B14R2.8189 NC1=NS(=O)(=O)c2cccnc2N1 Amb18130469 [0,0,0,0,0,1|2,0,1]=4 369 B14R2.8189 NC1=NS(=O)(=O)c2ncccc2N1 Amb25794436 [0,0,0,0,0,1|2,0,1]=4 370 B14R2.8189 NC1=Nc2ccccc2S(=O)(=O)N1 Amb18130381 [0,0,0,0,0,1|1,0,0]=2 371 B14R2.8189 O=C1CS(=O)(=O)c2ccccc2N1 Amb2415972 [0,0,0,0,0,1|1,0,0]=2 372 B14R2.8189 O=C1Cc2ccccc2S(=O)(=O)N1 Amb25198536 [0,0,0,0,0,1|0,0,0]=1 373 B14R2.8189 O=C1Nc2ccccc2S(=O)(=O)N1 Amb16580535 [0,0,0,0,0,1|0,0,0]=1 374 B14R2.8189 O=C1Nc2ccncc2S(=O)(=O)N1 Amb25743403 [0,0,0,0,0,1|1,0,0]=2 375 B14R2.8189 O=C1Nc2ncccc2S(=O)(=O)N1 Amb26478568 [0,0,0,0,0,1|1,0,0]=2 376 B14R2.8189 O=S1(=O)N=C(Cl)Nc2ccccc21 Amb17242435 [0,0,0,0,0,1|1,0,1]=3 377 B14R2.8189 O=S1(=O)NC(=S)Nc2ccccc21 Amb17546268 [0,0,0,0,0,1|0,1,0]=2 378 B14R2.8189 O=S1(=O)NC(Cl)=Nc2ccncc21 Amb17097733 [0,0,0,0,0,1|2,0,0]=3 379 B14R2.8189 O=S1(=O)NC(O)=Nc2ccccc21 Amb21998625 [0,0,0,0,0,1|0,0,1]=2 380 B14R2.29285 C=C1CCS(=O)(=O)c2ccccc21 Amb28240254 [0,0,0,0,0,1|2,0,0]=3 381 B14R2.29285 CC1(C)CNC(=O)c2ccccc21 Amb17400492 [0,0,0,0,0,1|3,0,0]=4 382 B14R2.29285 CC1CNS(=O)(=O)c2ccccc21 Amb27423966 [0,0,0,0,0,1|1,0,1]=3 383 B14R2.29285 CN1C=NS(=O)(=O)c2ccccc21 Amb3318318 [0,0,0,0,0,1|2,0,1]=4 384 B14R2.29285 CN1CNS(=O)(=O)c2cccnc21 Amb25350900 [0,0,0,0,0,1|3,0,0]=4 385 B14R2.29285 CN1CNS(=O)(=O)c2cnccc21 Amb24356147 [0,0,0,0,0,1|3,0,0]=4 386 B14R2.29285 CN1CNS(=O)(=O)c2ncccc21 Amb24398214 [0,0,0,0,0,1|3,0,0]=4 387 B14R2.29285 C[Si]1(C)CNC(=O)c2ccccc21 Amb25670257 [0,0,0,0,0,1|3,0,0]=4 388 B14R2.29285 NC1CCS(=O)(=O)c2ccccc21 Amb2371502 [0,0,0,0,0,1|2,0,1]=4 389 B14R2.29285 NC1CCS(=O)(=O)c2ccccc21 Amb58700 [0,0,0,0,0,1|2,0,1]=4 390 B14R2.29285 N[C@@H]1CCS(=O)(=O)c2ccccc21 Amb13952935 [0,0,0,0,0,1|2,0,1]=4 391 B14R2.29285 N[C@@H]1CCS(=O)(=O)c2ccccc21 Amb30526837 [0,0,0,0,0,1|2,0,1]=4 392 B14R2.29285 N[C@H]1CCS(=O)(=O)c2ccccc21 Amb13952937 [0,0,0,0,0,1|2,0,1]=4 393 B14R2.29285 N[C@H]1CCS(=O)(=O)c2ccccc21 Amb28600334 [0,0,0,0,0,1|2,0,1]=4 394 B14R2.29285 O=C1C=CS(=O)(=O)c2ccccc21 Amb26550100 [0,0,0,0,0,1|1,0,0]=2 395 B14R2.29285 O=C1CCS(=O)(=O)c2ccccc21 Amb1151857 [0,0,0,0,0,1|1,0,0]=2 396 B14R2.29285 O=C1CNS(=O)(=O)c2ccccc21 Amb17605764 [0,0,0,0,0,1|0,0,0]=1 397 B14R2.29285 O=C1NCS(=O)(=O)c2ccccc21 Amb23452938 [0,0,0,0,0,1|0,0,0]=1 398 B14R2.29285 O=C1NNS(=O)(=O)c2ccccc21 Amb390024 [0,0,0,0,0,1|0,0,0]=1 399 B14R2.29285 O=S1(=O)CCC(Br)c2ccccc21 Amb28143241 [0,0,0,0,0,1|2,0,1]=4 400 B14R2.29285 O=S1(=O)CCC(O)c2ccccc21 Amb9619606 [0,0,0,0,0,1|1,0,2]=4 401 B14R2.29285 O=S1(=O)CCC(S)c2ccccc21 Amb24415850 [0,0,0,0,0,1|1,1,1]=4 402 B14R2.29285 O=S1(=O)CC[C@@H](O)c2ccccc21 Amb13952934 [0,0,0,0,0,1|1,0,2]=4 403 B14R2.29285 O=S1(=O)CC[C@H](O)c2ccccc21 Amb13952933 [0,0,0,0,0,1|1,0,2]=4 404 B14R2.29496 CC1(C)Cc2ccccc2C(=O)N1 Amb588328 [0,0,0,0,0,1|3,0,0]=4 405 B14R2.29496 CC1(C)NC(=O)c2ccccc2O1 Amb611936 [0,0,0,0,0,1|3,0,0]=4 406 B14R2.29496 N=C1NS(=O)(=O)Cc2ccccc21 Amb13951810 [0,0,0,0,0,1|1,0,0]=2 407 B14R2.29496 NC1CS(=O)(=O)Cc2ccccc21 Amb10067685 [0,0,0,0,0,1|2,0,1]=4 408 B14R2.29496 NC1CS(=O)(=O)Cc2ccccc21 Amb19894998 [0,0,0,0,0,1|2,0,1]=4 409 B14R2.29496 O=C1CS(=O)(=O)Cc2ccccc21 Amb23443836 [0,0,0,0,0,1|1,0,0]=2 410 B14R2.29496 O=C1CS(=O)(=O)Nc2ccccc21 Amb23504153 [0,0,0,0,0,1|1,0,0]=2 411 B14R2.29496 O=C1CS(=O)(=O)Oc2ccccc21 Amb10071992 [0,0,0,0,0,1|1,0,0]=2 412 B14R2.29496 O=C1NS(=O)(=O)Cc2ccccc21 Amb13951532 [0,0,0,0,0,1|0,0,0]=1 413 B11R1.7 C#CS(=O)(=O)c1ccccc1 Amb27974619 [1,0,1,0,0,0|1,0,1]=4 414 B11R1.7 C=CS(=N)(=O)c1ccccc1 Amb31031125 [1,0,1,0,0,0|2,0,0]=4 415 B11R1.7 C=CS(=O)(=O)c1ccccc1 Amb8387629 [1,0,1,0,0,0|1,0,0]=3 416 B11R1.7 C=CS(=O)(=O)c1ccccn1 Amb9305597 [1,0,1,0,0,0|2,0,0]=4 417 B11R1.7 C=CS(=O)(=O)c1ccncc1 Amb9305562 [1,0,1,0,0,0|2,0,0]=4 418 B11R1.7 CCS(=O)(=O)c1ccccc1 Amb2687930 [1,0,1,0,0,0|1,0,1]=4 419 B11R1.7 CNS(=O)(=O)c1ccccc1 Amb1152097 [1,0,1,0,0,0|0,0,1]=3 420 B11R1.7 CNS(=O)(=O)c1ccccn1 Amb26471079 [1,0,1,0,0,0|1,0,1]=4 421 B11R1.7 CNS(=O)(=O)c1cccnc1 Amb6275166 [1,0,1,0,0,0|1,0,1]=4 422 B11R1.7 CNS(=O)(=O)c1ccncc1 Amb26030725 [1,0,1,0,0,0|1,0,1]=4 423 B11R1.7 COS(=O)(=O)c1ccccc1 Amb2793093 [1,0,1,0,0,0|1,0,1]=4 424 B11R1.7 N#CS(=O)(=O)c1ccccc1 Amb22336767 [1,0,1,0,0,0|1,0,1]=4 425 B11R1.7 NNS(=O)(=O)c1ccccc1 Amb6468409 [1,0,1,0,0,0|1,0,0]=3 426 B11R1.7 NNS(=O)(=O)c1ccccn1 Amb26639288 [1,0,1,0,0,0|2,0,0]=4 427 B11R1.7 NNS(=O)(=O)c1ccncc1 Amb25135173 [1,0,1,0,0,0|2,0,0]=4 428 B11R1.7 O=S(=O)(CBr)c1ccccc1 Amb22353468 [1,0,1,0,0,0|1,0,1]=4 429 B11R1.7 O=S(=O)(CCl)c1ccccc1 Amb1158067 [1,0,1,0,0,0|1,0,1]=4 430 B11R1.7 O=S(=O)(CF)c1ccccc1 Amb2688229 [1,0,1,0,0,0|1,0,1]=4 431 B11R1.7 O=S(=O)(NCl)c1ccccc1 Amb32653532 [1,0,1,0,0,0|1,0,0]=3 432 B11R1.7 O=S(=O)(NF)c1ccccc1 Amb22729706 [1,0,1,0,0,0|1,0,0]=3 433 B11R1.7 O=S(=O)(NO)c1ccccc1 Amb1154834 [1,0,1,0,0,0|0,0,1]=3 434 B11R1.7 O=S(=O)(NO)c1ccccn1 Amb25214604 [1,0,1,0,0,0|1,0,1]=4 435 B11R1.7 O=S(=O)(NO)c1cccnc1 Amb28048217 [1,0,1,0,0,0|1,0,1]=4 436 B11R1.7 O=S(=O)(NO)c1ccncc1 Amb26639473 [1,0,1,0,0,0|1,0,1]=4 437 B11R1.7 O=S(=O)([N-]Cl)c1ccccc1 Amb19748290 [1,0,1,0,0,0|1,0,1]=4 438 B11R1.16 C=C(NC=O)c1ccccc1 Amb28046518 [1,0,1,0,0,0|2,0,0]=4 439 B11R1.16 CC(NC=O)c1ccccc1 Amb4020107 [1,0,1,0,0,0|2,0,0]=4 440 B11R1.16 CCNC(=O)c1ccccc1 Amb6871002 [1,0,1,0,0,0|2,0,0]=4 441 B11R1.16 CN(NC=O)c1ccccc1 Amb17778798 [1,0,1,0,0,0|2,0,0]=4 442 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [1,0,1,0,0,0|1,1,0]=4 443 B11R1.16 N#CNC(=O)c1ccccc1 Amb4007087 [1,0,1,0,0,0|2,0,0]=4 444 B11R1.16 N=CNC(=O)c1ccccc1 Amb27961481 [1,0,1,0,0,0|2,0,0]=4 445 B11R1.16 O=C(NC#P)c1ccccc1 Amb28245816 [1,0,1,0,0,0|2,0,0]=4 446 B11R1.16 O=C(NCCl)c1ccccc1 Amb7761622 [1,0,1,0,0,0|2,0,0]=4 447 B11R1.16 O=C(NCO)c1ccccc1 Amb1200467 [1,0,1,0,0,0|1,0,1]=4 448 B11R1.16 O=C(NO[K])c1ccccc1 Amb33457787 [1,0,1,0,0,0|1,1,0]=4 449 B11R1.16 O=C=NC(=O)c1ccccc1 Amb3940094 [1,0,1,0,0,0|1,0,1]=4 450 B11R1.16 O=CCC(=O)c1ccccc1 Amb8394158 [1,0,1,0,0,0|2,0,0]=4 451 B11R1.16 O=CNC(=O)c1ccccn1 Amb27831529 [1,0,1,0,0,0|2,0,0]=4 452 B11R1.16 O=COC(=O)c1ccccc1 Amb27421012 [1,0,1,0,0,0|2,0,0]=4 453 B11R1.16 O=C[CH-]C(=O)c1ccccc1 Amb24121236 [1,0,1,0,0,0|2,0,0]=4 454 B11R1.53 C#Cc1ccccc1C(N)=O Amb23411992 [1,0,1,0,0,0|2,0,0]=4 455 B11R1.53 CC(=O)c1ccccc1N=O Amb25695758 [1,0,1,0,0,0|2,0,0]=4 456 B11R1.53 CCc1ccccc1C(N)=O Amb33539272 [1,0,1,0,0,0|2,0,0]=4 457 B11R1.53 CNc1ccccc1C(N)=O Amb1209391 [1,0,1,0,0,0|2,0,0]=4 458 B11R1.53 COc1ccccc1C(N)=O Amb3564650 [1,0,1,0,0,0|1,1,0]=4 459 B11R1.53 CS(=O)c1ccccc1C=O Amb18126524 [1,0,1,0,0,0|1,0,1]=4 460 B11R1.53 CSc1ccccc1C(N)=O Amb3709825 [1,0,1,0,0,0|1,0,1]=4 461 B11R1.53 N#Cc1ccccc1C(N)=O Amb2720723 [1,0,1,0,0,0|2,0,0]=4 462 B11R1.53 N#[N+]c1ccccc1C(N)=O Amb27412391 [1,0,1,0,0,0|2,0,0]=4 463 B11R1.53 NC(=O)c1ccccc1C=O Amb25865237 [1,0,1,0,0,0|1,0,0]=3 464 B11R1.53 NC(=O)c1ccccc1CBr Amb21857553 [1,0,1,0,0,0|2,0,0]=4 465 B11R1.53 NC(=O)c1ccccc1CCl Amb24381160 [1,0,1,0,0,0|2,0,0]=4 466 B11R1.53 NC(=O)c1ccccc1CO Amb9421543 [1,0,1,0,0,0|1,0,1]=4 467 B11R1.53 NC(=O)c1cccnc1C=O Amb27962547 [1,0,1,0,0,0|2,0,0]=4 468 B11R1.53 NCc1ccccc1C(N)=O Amb6276827 [1,0,1,0,0,0|2,0,0]=4 469 B11R1.53 NNc1ccccc1C(N)=O Amb18179392 [1,0,1,0,0,0|2,0,0]=4 470 B11R1.53 NNc1ccccc1N(=O)=O Amb20621887 [1,0,1,0,0,0|2,0,0]=4 471 B11R1.53 O=Cc1ccccc1C(=O)O Amb2568292 [1,0,1,0,0,0|1,0,1]=4 472 B11R1.53 O=Cc1ccccc1N(=O)=O Amb20621765 [1,0,1,0,0,0|1,0,0]=3 473 B11R1.53 O=Cc1ccccc1S(=O)O Amb27823415 [1,0,1,0,0,0|0,0,2]=4 474 B11R1.53 O=Cc1ccccc1[N+](=O)[O-] Amb2611310 [1,0,1,0,0,0|1,0,1]=4 475 B11R1.53 O=Cc1ccccc1[SH](=O)=O Amb27226994 [1,0,1,0,0,0|0,0,0]=2 476 B11R1.53 O=Cc1ccncc1N(=O)=O Amb22284347 [1,0,1,0,0,0|2,0,0]=4 477 B11R1.53 O=Nc1ccccc1C(=O)O Amb17593754 [1,0,1,0,0,0|2,0,0]=4 478 B11R1.53 O=[IH2]c1ccccc1C(=O)O Amb9809713 [1,0,1,0,0,0|2,0,0]=4 479 B11R1.87 CS(=O)(=O)c1ccccc1Br Amb10071573 [1,0,1,0,0,0|2,0,0]=4 480 B11R1.87 CS(=O)(=O)c1ccccc1Cl Amb2686381 [1,0,1,0,0,0|2,0,0]=4 481 B11R1.87 CS(=O)(=O)c1ccccc1F Amb1156220 [1,0,1,0,0,0|2,0,0]=4 482 B11R1.87 CS(=O)(=O)c1ccccc1I Amb27393094 [1,0,1,0,0,0|2,0,0]=4 483 B11R1.87 CS(=O)(=O)c1ccccc1N Amb2779879 [1,0,1,0,0,0|2,0,0]=4 484 B11R1.87 CS(=O)(=O)c1ccccc1N Amb487217 [1,0,1,0,0,0|2,0,0]=4 485 B11R1.87 CS(=O)(=O)c1ccccc1O Amb2427025 [1,0,1,0,0,0|1,0,1]=4 486 B11R1.87 CS(=O)(=O)c1ccccc1S Amb9312862 [1,0,1,0,0,0|1,1,0]=4 487 B11R1.87 Cc1ccccc1S(=O)(=O)Br Amb27768337 [1,0,1,0,0,0|1,0,1]=4 488 B11R1.87 Cc1ccccc1S(=O)(=O)Cl Amb3939761 [1,0,1,0,0,0|1,0,1]=4 489 B11R1.87 Cc1ccccc1S(=O)(=O)F Amb24419009 [1,0,1,0,0,0|1,0,1]=4 490 B11R1.87 Cc1ccccc1S(=O)(=O)O Amb20618615 [1,0,1,0,0,0|1,0,1]=4 491 B11R1.87 Cc1ccccc1S(=O)(=O)O Amb30594720 [1,0,1,0,0,0|1,0,1]=4 492 B11R1.87 Cc1ccccc1S(=O)(=O)O Amb33718793 [1,0,1,0,0,0|1,0,1]=4 493 B11R1.87 Cc1ccccc1S(=O)(=O)O Amb33871604 [1,0,1,0,0,0|1,0,1]=4 494 B11R1.87 Cc1ccccc1S(C)(=O)=O Amb8389999 [1,0,1,0,0,0|1,0,1]=4 495 B11R1.87 Cc1ccccc1S(N)(=O)=O Amb2725549 [1,0,1,0,0,0|0,0,1]=3 496 B11R1.87 Cc1cccnc1S(N)(=O)=O Amb18180348 [1,0,1,0,0,0|1,0,1]=4 497 B11R1.87 Cc1ccncc1S(N)(=O)=O Amb8439452 [1,0,1,0,0,0|1,0,1]=4 498 B11R1.87 Cc1cnccc1S(N)(=O)=O Amb33053932 [1,0,1,0,0,0|1,0,1]=4 499 B11R1.87 Cc1ncccc1S(N)(=O)=O Amb26908039 [1,0,1,0,0,0|1,0,1]=4 500 B11R1.87 NS(=O)(=O)C1=CC=CNC1=O Amb23510210 [1,0,1,0,0,0|1,0,0]=3 501 B11R1.87 NS(=O)(=O)c1ccccc1Br Amb1138857 [1,0,1,0,0,0|1,0,0]=3 502 B11R1.87 NS(=O)(=O)c1ccccc1Cl Amb1126709 [1,0,1,0,0,0|1,0,0]=3 503 B11R1.87 NS(=O)(=O)c1ccccc1F Amb1125877 [1,0,1,0,0,0|1,0,0]=3 504 B11R1.87 NS(=O)(=O)c1ccccc1I Amb33545767 [1,0,1,0,0,0|1,0,0]=3 505 B11R1.87 NS(=O)(=O)c1ccccc1O Amb18647721 [1,0,1,0,0,0|0,0,1]=3 506 B11R1.87 NS(=O)(=O)c1cccnc1Br Amb27399099 [1,0,1,0,0,0|2,0,0]=4 507 B11R1.87 NS(=O)(=O)c1cccnc1Cl Amb1129622 [1,0,1,0,0,0|2,0,0]=4 508 B11R1.87 NS(=O)(=O)c1cccnc1F Amb30982888 [1,0,1,0,0,0|2,0,0]=4 509 B11R1.87 NS(=O)(=O)c1ccncc1Br Amb33056341 [1,0,1,0,0,0|2,0,0]=4 510 B11R1.87 NS(=O)(=O)c1ccncc1Cl Amb33054536 [1,0,1,0,0,0|2,0,0]=4 511 B11R1.87 NS(=O)(=O)c1ccncc1F Amb33054663 [1,0,1,0,0,0|2,0,0]=4 512 B11R1.87 NS(=O)(=O)c1cnccc1Cl Amb6336421 [1,0,1,0,0,0|2,0,0]=4 513 B11R1.87 NS(=O)(=O)c1cnccc1S Amb2611991 [1,0,1,0,0,0|1,1,0]=4 514 B11R1.87 NS(=O)(=O)c1ncccc1Br Amb26978716 [1,0,1,0,0,0|2,0,0]=4 515 B11R1.87 NS(=O)(=O)c1ncccc1Cl Amb18330301 [1,0,1,0,0,0|2,0,0]=4 516 B11R1.87 NS(=O)(=O)c1ncccc1F Amb33530143 [1,0,1,0,0,0|2,0,0]=4 517 B11R1.87 NS(=O)(=O)c1ncccc1O Amb24691588 [1,0,1,0,0,0|1,0,1]=4 518 B11R1.87 Nc1ccccc1S(=O)(=O)Cl Amb22228575 [1,0,1,0,0,0|2,0,0]=4 519 B11R1.87 Nc1ccccc1S(=O)(=O)F Amb4006452 [1,0,1,0,0,0|2,0,0]=4 520 B11R1.87 Nc1ccccc1S(=O)(=O)O Amb8426900 [1,0,1,0,0,0|2,0,0]=4 521 B11R1.87 Nc1ccccc1S(=O)(=O)[O-] Amb16231185 [1,0,1,0,0,0|2,0,0]=4 522 B11R1.87 Nc1ccccc1S(=O)(=O)[O-] Amb22167942 [1,0,1,0,0,0|2,0,0]=4 523 B11R1.87 Nc1ccccc1S(N)(=O)=O Amb6357228 [1,0,1,0,0,0|1,0,0]=3 524 B11R1.87 Nc1cccnc1S(N)(=O)=O Amb25689766 [1,0,1,0,0,0|2,0,0]=4 525 B11R1.87 Nc1cnccc1S(N)(=O)=O Amb22490641 [1,0,1,0,0,0|2,0,0]=4 526 B11R1.87 Nc1cnccc1S(N)(=O)=O Amb33734731 [1,0,1,0,0,0|2,0,0]=4 527 B11R1.87 Nc1ncccc1S(N)(=O)=O Amb18946750 [1,0,1,0,0,0|2,0,0]=4 528 B11R1.87 O=S(=O)(Br)c1ccccc1F Amb28041235 [1,0,1,0,0,0|2,0,0]=4 529 B11R1.87 O=S(=O)(Cl)c1ccccc1Br Amb1152548 [1,0,1,0,0,0|2,0,0]=4 530 B11R1.87 O=S(=O)(Cl)c1ccccc1Cl Amb1152066 [1,0,1,0,0,0|2,0,0]=4 531 B11R1.87 O=S(=O)(Cl)c1ccccc1F Amb1152752 [1,0,1,0,0,0|2,0,0]=4 532 B11R1.87 O=S(=O)(Cl)c1ccccc1I Amb2688834 [1,0,1,0,0,0|2,0,0]=4 533 B11R1.87 O=S(=O)(Cl)c1ccccc1O Amb25994064 [1,0,1,0,0,0|1,0,1]=4 534 B11R1.87 O=S(=O)(F)c1ccccc1Br Amb26908494 [1,0,1,0,0,0|2,0,0]=4 535 B11R1.87 O=S(=O)(F)c1ccccc1Cl Amb25936463 [1,0,1,0,0,0|2,0,0]=4 536 B11R1.87 O=S(=O)(F)c1ccccc1F Amb22523350 [1,0,1,0,0,0|2,0,0]=4 537 B11R1.87 O=S(=O)(F)c1ccccc1I Amb33743835 [1,0,1,0,0,0|2,0,0]=4 538 B11R1.87 O=S(=O)(F)c1ccccc1O Amb27164581 [1,0,1,0,0,0|1,0,1]=4 539 B11R1.87 O=S(=O)(O)c1ccccc1F Amb20618605 [1,0,1,0,0,0|2,0,0]=4 540 B11R1.87 O=S(=O)(O)c1ccccc1I Amb10842144 [1,0,1,0,0,0|2,0,0]=4 541 B11R1.87 O=S(=O)(O)c1ccccc1O Amb17594378 [1,0,1,0,0,0|1,0,1]=4 542 B11R1.87 O=S(=O)([O-])c1ccccc1Cl Amb27814070 [1,0,1,0,0,0|2,0,0]=4 543 B11R1.87 O=S(=O)([O-])c1ccccc1I Amb24323642 [1,0,1,0,0,0|2,0,0]=4 544 B11R2.1 N=C1NCc2ccccc21 Amb7174277 [2,0,0,0,0,0|2,0,0]=4 545 B11R2.1 O=C1C=Cc2ccccc21 Amb10603436 [2,0,0,0,0,0|2,0,0]=4 546 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [2,0,0,0,0,0|2,0,0]=4 547 B11R2.1 O=C1CNc2ccccc21 Amb17593399 [2,0,0,0,0,0|2,0,0]=4 548 B11R2.1 O=C1COc2ccccc21 Amb33534383 [2,0,0,0,0,0|1,1,0]=4 549 B11R2.1 O=C1CSc2ccccc21 Amb4062421 [2,0,0,0,0,0|1,0,1]=4 550 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [2,0,0,0,0,0|1,0,1]=4 551 B11R2.1 O=C1NC=C2C=CC=CN12 Amb26008108 [2,0,0,0,0,0|2,0,0]=4 552 B11R2.1 O=C1NCc2ccccc21 Amb773532 [2,0,0,0,0,0|1,0,0]=3 553 B11R2.1 O=C1NCc2cccnc21 Amb22276754 [2,0,0,0,0,0|2,0,0]=4 554 B11R2.1 O=C1NCc2ccncc21 Amb22388464 [2,0,0,0,0,0|2,0,0]=4 555 B11R2.1 O=C1NCc2ccncc21 Amb32675690 [2,0,0,0,0,0|2,0,0]=4 556 B11R2.1 O=C1NCc2cnccc21 Amb23455305 [2,0,0,0,0,0|2,0,0]=4 557 B11R2.1 O=C1NCc2ncccc21 Amb33530547 [2,0,0,0,0,0|2,0,0]=4 558 B11R2.1 O=C1NN=C2C=CC=CN12 Amb18012675 [2,0,0,0,0,0|2,0,0]=4 559 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [2,0,0,0,0,0|1,0,0]=3 560 B11R2.1 O=C1NNc2cccnc21 Amb21857168 [2,0,0,0,0,0|2,0,0]=4 561 B11R2.1 O=C1NNc2cnccc21 Amb21857177 [2,0,0,0,0,0|2,0,0]=4 562 B11R2.1 O=C1NNc2ncccc21 Amb33528585 [2,0,0,0,0,0|2,0,0]=4 563 B11R2.1 O=C1NOc2cnccc21 Amb22494128 [2,0,0,0,0,0|1,1,0]=4 564 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [2,0,0,0,0,0|0,0,1]=3 565 B11R2.1 O=C1OCc2ccccc21 Amb2610613 [2,0,0,0,0,0|2,0,0]=4 566 B11R2.1 O=C1ONc2ccccc21 Amb26994489 [2,0,0,0,0,0|2,0,0]=4 567 B11R2.1 O=C1SCc2ccccc21 Amb2421358 [2,0,0,0,0,0|2,0,0]=4 568 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [2,0,0,0,0,0|2,0,0]=4 569 B11R2.1 O=s1ccc2ccccc21 Amb24078341 [2,0,0,0,0,0|1,0,1]=4 570 B13R1.29 C=CCS(=O)(=O)c1ccc(Br)cc1 Amb1918695 [0,1,1,0,0,0|2,0,0]=4 571 B13R1.29 C=CCS(=O)(=O)c1ccc(C)cc1 Amb3836153 [0,1,1,0,0,0|2,0,0]=4 572 B13R1.29 CCNS(=O)(=O)c1ccc(Br)cc1 Amb1570719 [0,1,1,0,0,0|1,0,1]=4 573 B13R1.29 CCNS(=O)(=O)c1ccc(C)cc1 Amb6572569 [0,1,1,0,0,0|1,0,1]=4 574 B13R1.29 CCNS(=O)(=O)c1ccc(Cl)cc1 Amb3360410 [0,1,1,0,0,0|1,0,1]=4 575 B13R1.29 CCNS(=O)(=O)c1ccc(F)cc1 Amb2736031 [0,1,1,0,0,0|1,0,1]=4 576 B13R1.29 CCNS(=O)(=O)c1ccc(I)cc1 Amb3015449 [0,1,1,0,0,0|1,0,1]=4 577 B13R1.29 CCNS(=O)(=O)c1ccc(N)cc1 Amb1129488 [0,1,1,0,0,0|1,0,1]=4 578 B13R1.29 CONS(=O)(=O)c1ccc(N)cc1 Amb24713326 [0,1,1,0,0,0|2,0,0]=4 579 B13R1.29 C\C=C\S(=O)(=O)c1ccc(C)cc1 Amb28242443 [0,1,1,0,0,0|2,0,0]=4 580 B13R1.29 Cc1ccc(S(=O)(=O)N=C=O)cc1 Amb2725558 [0,1,1,0,0,0|0,0,2]=4 581 B13R1.29 Cc1ccc(S(=O)(=O)N=S=O)cc1 Amb4133669 [0,1,1,0,0,0|1,0,1]=4 582 B13R1.29 Cc1ccc(S(=O)(=O)NC#N)cc1 Amb27878396 [0,1,1,0,0,0|1,0,1]=4 583 B13R1.29 O=C=NS(=O)(=O)c1ccc(Br)cc1 Amb17268906 [0,1,1,0,0,0|0,0,2]=4 584 B13R1.29 O=C=NS(=O)(=O)c1ccc(Cl)cc1 Amb8396611 [0,1,1,0,0,0|0,0,2]=4 585 B13R1.29 O=C=NS(=O)(=O)c1ccc(F)cc1 Amb8515569 [0,1,1,0,0,0|0,0,2]=4 586 B13R1.29 O=CCS(=O)(=O)c1ccc(Cl)cc1 Amb28189681 [0,1,1,0,0,0|1,0,0]=3 587 B13R1.29 O=CCS(=O)(=O)c1ccc(F)cc1 Amb28319712 [0,1,1,0,0,0|1,0,0]=3 588 B13R1.30 CCNS(=O)(=O)c1cccc(Br)c1 Amb1570721 [0,1,1,0,0,0|1,0,1]=4 589 B13R1.30 CCNS(=O)(=O)c1cccc(C)c1 Amb8872722 [0,1,1,0,0,0|1,0,1]=4 590 B13R1.30 CCNS(=O)(=O)c1cccc(Cl)c1 Amb42626 [0,1,1,0,0,0|1,0,1]=4 591 B13R1.30 CCNS(=O)(=O)c1cccc(F)c1 Amb40218 [0,1,1,0,0,0|1,0,1]=4 592 B13R1.30 CCNS(=O)(=O)c1cccc(I)c1 Amb24344601 [0,1,1,0,0,0|1,0,1]=4 593 B13R1.30 CCNS(=O)(=O)c1cccc(N)c1 Amb1130466 [0,1,1,0,0,0|1,0,1]=4 594 B13R1.30 CCNS(=O)(=O)c1cccc(O)c1 Amb27608745 [0,1,1,0,0,0|1,0,1]=4 595 B13R1.30 CONS(=O)(=O)c1cccc(Br)c1 Amb24731665 [0,1,1,0,0,0|2,0,0]=4 596 B13R1.30 Cc1cccc(S(=O)(=O)N=C=O)c1 Amb17236559 [0,1,1,0,0,0|0,0,2]=4 597 B13R1.30 Nc1cccc(S(=O)(=O)\C=C\Cl)c1 Amb18658179 [0,1,1,0,0,0|2,0,0]=4 598 B13R1.30 O=C=NS(=O)(=O)c1cccc(Br)c1 Amb28363693 [0,1,1,0,0,0|0,0,2]=4 599 B13R1.30 O=C=NS(=O)(=O)c1cccc(Cl)c1 Amb17242961 [0,1,1,0,0,0|0,0,2]=4 600 B13R1.122 C#CCNS(=O)(=O)c1ccccc1 Amb10610176 [0,1,1,0,0,0|1,0,1]=4 601 B13R1.122 C=CCNS(=O)(=O)c1ccccc1 Amb1152082 [0,1,1,0,0,0|1,0,0]=3 602 B13R1.122 CCCNS(=O)(=O)c1ccccc1 Amb6599904 [0,1,1,0,0,0|1,0,1]=4 603 B13R1.122 C\C=C\CS(=O)(=O)c1ccccc1 Amb28138310 [0,1,1,0,0,0|2,0,0]=4 604 B13R1.122 N#CCNS(=O)(=O)c1ccccc1 Amb6347317 [0,1,1,0,0,0|1,0,1]=4 605 B13R1.122 N#C\C=C\S(=O)(=O)c1ccccc1 Amb2609395 [0,1,1,0,0,0|2,0,0]=4 606 B13R1.122 NCCNS(=O)(=O)c1ccccc1 Amb6446295 [0,1,1,0,0,0|1,0,1]=4 607 B13R1.122 NCCNS(=O)(=O)c1ccccc1 Amb6892269 [0,1,1,0,0,0|1,0,1]=4 608 B13R1.122 O=C=NCS(=O)(=O)c1ccccc1 Amb18563428 [0,1,1,0,0,0|0,0,2]=4 609 B13R1.122 O=CCCS(=O)(=O)c1ccccc1 Amb17106127 [0,1,1,0,0,0|1,0,0]=3 610 B13R1.122 O=CCNS(=O)(=O)c1ccccc1 Amb17102119 [0,1,1,0,0,0|0,0,0]=2 611 B13R1.122 O=C\C=C\S(=O)(=O)c1ccccc1 Amb25195887 [0,1,1,0,0,0|1,0,0]=3 612 B13R1.122 O=S(=O)(NCCBr)c1ccccc1 Amb4311487 [0,1,1,0,0,0|1,0,1]=4 613 B13R1.122 O=S(=O)(NCCCl)c1ccccc1 Amb6334929 [0,1,1,0,0,0|1,0,1]=4 614 B13R1.122 O=S(=O)(NCCO)c1ccccc1 Amb2661162 [0,1,1,0,0,0|0,0,2]=4 615 B13R1.122 O=S(=O)(\C=C\CO)c1ccccc1 Amb2613721 [0,1,1,0,0,0|1,0,1]=4 616 B13R1.347 C=C(Br)CS(=O)(=O)c1ccccc1 Amb27829672 [0,1,1,0,0,0|2,0,0]=4 617 B13R1.347 C=C(C)CS(=O)(=O)c1ccccc1 Amb2148756 [0,1,1,0,0,0|2,0,0]=4 618 B13R1.347 CC(=O)CS(=O)(=O)c1ccccc1 Amb2222044 [0,1,1,0,0,0|1,0,0]=3 619 B13R1.347 CC(=O)NS(=O)(=O)c1ccccn1 Amb28205689 [0,1,1,0,0,0|1,0,0]=3 620 B13R1.347 CC(C)NS(=O)(=O)c1ccccc1 Amb3359963 [0,1,1,0,0,0|1,0,1]=4 621 B13R1.347 CS(=O)(=NC(N)=O)c1ccccc1 Amb27403581 [0,1,1,0,0,0|1,0,1]=4 622 B13R1.347 C\C(N)=N\S(=O)(=O)c1ccccc1 Amb10553012 [0,1,1,0,0,0|1,0,1]=4 623 B13R1.347 N=C(N)CS(=O)(=O)c1ccccc1 Amb25994166 [0,1,1,0,0,0|2,0,0]=4 624 B13R1.347 N=C(N)CS(=O)(=O)c1ccccc1 Amb29847975 [0,1,1,0,0,0|2,0,0]=4 625 B13R1.347 N=C(N)NS(=O)(=O)c1ccccc1 Amb440119 [0,1,1,0,0,0|1,0,0]=3 626 B13R1.347 N=S(=O)(CC(N)=O)c1ccccc1 Amb28396500 [0,1,1,0,0,0|2,0,0]=4 627 B13R1.347 NC(=O)CS(=O)(=O)c1ccccc1 Amb1626007 [0,1,1,0,0,0|1,0,0]=3 628 B13R1.347 NC(=O)NS(=O)(=O)c1ccccc1 Amb4006639 [0,1,1,0,0,0|0,0,0]=2 629 B13R1.347 NC(=S)CS(=O)(=O)c1ccccc1 Amb27800880 [0,1,1,0,0,0|1,1,0]=4 630 B13R1.347 O=C(O)CS(=O)(=O)c1ccccc1 Amb6357777 [0,1,1,0,0,0|1,0,0]=3 631 B13R1.347 O=C(O)CS(=O)(=O)c1ccccn1 Amb17205236 [0,1,1,0,0,0|2,0,0]=4 632 B13R1.347 O=C(O)CS(=O)(=O)c1cccnc1 Amb25180282 [0,1,1,0,0,0|2,0,0]=4 633 B13R1.347 O=C(O)CS(=O)(=O)c1ccncc1 Amb27663636 [0,1,1,0,0,0|2,0,0]=4 634 B13R1.347 O=S(=O)(C=C(Cl)Cl)c1ccccc1 Amb25127925 [0,1,1,0,0,0|2,0,0]=4 635 B13R1.347 O=S(=O)(N=C(Cl)Cl)c1ccccc1 Amb5720624 [0,1,1,0,0,0|1,0,1]=4 636 B13R1.347 O=[N+]([O-])CS(=O)(=O)c1ccccc1 Amb2417745 [0,1,1,0,0,0|2,0,0]=4 637 B13R1.708 C=CC(C)S(=O)(=O)c1ccccc1 Amb27977185 [0,1,1,0,0,0|2,0,0]=4 638 B13R1.708 CCN(C)S(=O)(=O)c1ccccc1 Amb24715287 [0,1,1,0,0,0|1,0,1]=4 639 B13R1.708 CCN(O)S(=O)(=O)c1ccccc1 Amb27817977 [0,1,1,0,0,0|1,0,1]=4 640 B13R1.708 CN(C#N)S(=O)(=O)c1ccccc1 Amb27449015 [0,1,1,0,0,0|1,0,1]=4 641 B13R1.2819 C=CCS(=O)(=O)c1ccccc1Cl Amb27762281 [0,1,1,0,0,0|2,0,0]=4 642 B13R1.2819 C=CCS(=O)(=O)c1ccccc1N Amb10243527 [0,1,1,0,0,0|2,0,0]=4 643 B13R1.2819 CCNS(=O)(=O)c1ccccc1Br Amb142318 [0,1,1,0,0,0|1,0,1]=4 644 B13R1.2819 CCNS(=O)(=O)c1ccccc1C Amb17942846 [0,1,1,0,0,0|1,0,1]=4 645 B13R1.2819 CCNS(=O)(=O)c1ccccc1Cl Amb8872745 [0,1,1,0,0,0|1,0,1]=4 646 B13R1.2819 CCNS(=O)(=O)c1ccccc1F Amb8872725 [0,1,1,0,0,0|1,0,1]=4 647 B13R1.2819 CCNS(=O)(=O)c1ccccc1I Amb2754593 [0,1,1,0,0,0|1,0,1]=4 648 B13R1.2819 CCNS(=O)(=O)c1ccccc1N Amb1129880 [0,1,1,0,0,0|1,0,1]=4 649 B13R1.2819 CCNS(=O)(=O)c1ccccc1O Amb18566359 [0,1,1,0,0,0|1,0,1]=4 650 B13R1.2819 CONS(=O)(=O)c1ccccc1C Amb16980485 [0,1,1,0,0,0|2,0,0]=4 651 B13R1.2819 CONS(=O)(=O)c1ccccc1Cl Amb16980486 [0,1,1,0,0,0|2,0,0]=4 652 B13R1.2819 Cc1ccccc1S(=O)(=O)N=C=O Amb4606015 [0,1,1,0,0,0|0,0,2]=4 653 B13R1.2819 O=C=NS(=O)(=O)c1ccccc1Br Amb27588485 [0,1,1,0,0,0|0,0,2]=4 654 B13R1.2819 O=C=NS(=O)(=O)c1ccccc1Cl Amb4606016 [0,1,1,0,0,0|0,0,2]=4 655 B13R1.53 CCc1cc(Br)ccc1S(N)(=O)=O Amb27177152 [0,1,1,0,0,0|1,0,1]=4 656 B13R1.53 CCc1cc(C)ccc1S(N)(=O)=O Amb24594951 [0,1,1,0,0,0|1,0,1]=4 657 B13R1.53 CCc1cc(Cl)ccc1S(N)(=O)=O Amb33296639 [0,1,1,0,0,0|1,0,1]=4 658 B13R1.53 CNc1cc(C)ccc1S(N)(=O)=O Amb35697154 [0,1,1,0,0,0|2,0,0]=4 659 B13R1.53 CNc1cc(Cl)ccc1S(N)(=O)=O Amb27663608 [0,1,1,0,0,0|2,0,0]=4 660 B13R1.53 CNc1cc(O)ccc1S(N)(=O)=O Amb28312959 [0,1,1,0,0,0|2,0,0]=4 661 B13R1.53 COc1cc(Br)ccc1S(N)(=O)=O Amb19888058 [0,1,1,0,0,0|2,0,0]=4 662 B13R1.53 COc1cc(C)ccc1S(N)(=O)=O Amb6357848 [0,1,1,0,0,0|2,0,0]=4 663 B13R1.53 COc1cc(Cl)ccc1S(N)(=O)=O Amb8862223 [0,1,1,0,0,0|2,0,0]=4 664 B13R1.53 COc1cc(F)ccc1S(N)(=O)=O Amb32667417 [0,1,1,0,0,0|2,0,0]=4 665 B13R1.53 COc1cc(N)ccc1S(N)(=O)=O Amb33743934 [0,1,1,0,0,0|2,0,0]=4 666 B13R1.53 COc1cc(N)ccc1S(N)(=O)=O Amb8884420 [0,1,1,0,0,0|2,0,0]=4 667 B13R1.53 COc1cc(O)ccc1S(N)(=O)=O Amb27394142 [0,1,1,0,0,0|2,0,0]=4 668 B13R1.53 CS(=O)(=O)c1ccc(F)cc1C=O Amb2691416 [0,1,1,0,0,0|1,0,0]=3 669 B13R1.53 CSc1cc(O)ccc1S(N)(=O)=O Amb27624469 [0,1,1,0,0,0|2,0,0]=4 670 B13R1.53 Cc1ccc(S(N)(=O)=O)c(C#N)c1 Amb26463965 [0,1,1,0,0,0|1,0,1]=4 671 B13R1.53 Cc1ccc(S(N)(=O)=O)c(NN)c1 Amb30015272 [0,1,1,0,0,0|2,0,0]=4 672 B13R1.53 N#Cc1cc(Br)ccc1S(N)(=O)=O Amb27643413 [0,1,1,0,0,0|1,0,1]=4 673 B13R1.53 N#Cc1cc(Cl)ccc1S(N)(=O)=O Amb27223816 [0,1,1,0,0,0|1,0,1]=4 674 B13R1.53 N#Cc1cc(F)ccc1S(N)(=O)=O Amb24711192 [0,1,1,0,0,0|1,0,1]=4 675 B13R1.53 N#Cc1cc(N)ccc1S(N)(=O)=O Amb8883002 [0,1,1,0,0,0|1,0,1]=4 676 B13R1.53 N#Cc1cc(O)ccc1S(N)(=O)=O Amb28062959 [0,1,1,0,0,0|1,0,1]=4 677 B13R1.53 NCc1cc(Cl)ccc1S(N)(=O)=O Amb28242542 [0,1,1,0,0,0|1,0,1]=4 678 B13R1.53 NCc1cc(F)ccc1S(N)(=O)=O Amb32413791 [0,1,1,0,0,0|1,0,1]=4 679 B13R1.53 NS(=O)(=O)c1ccc(Br)cc1CBr Amb26574138 [0,1,1,0,0,0|1,0,1]=4 680 B13R1.53 NS(=O)(=O)c1ccc(F)cc1C=O Amb27808192 [0,1,1,0,0,0|0,0,0]=2 681 B13R1.53 NS(=O)(=O)c1ccc(F)cc1CO Amb28139825 [0,1,1,0,0,0|0,0,2]=4 682 B13R1.53 NS(=O)(=O)c1cnc(Cl)cc1C=O Amb27648695 [0,1,1,0,0,0|1,0,0]=3 683 B13R1.108 CCc1c(O)cccc1S(N)(=O)=O Amb27177205 [0,1,1,0,0,0|1,0,1]=4 684 B13R1.108 COc1c(Br)cccc1S(N)(=O)=O Amb25770149 [0,1,1,0,0,0|2,0,0]=4 685 B13R1.108 COc1c(C)cccc1S(N)(=O)=O Amb25864724 [0,1,1,0,0,0|2,0,0]=4 686 B13R1.108 COc1c(Cl)cccc1S(N)(=O)=O Amb26868137 [0,1,1,0,0,0|2,0,0]=4 687 B13R1.108 COc1c(F)cccc1S(N)(=O)=O Amb22466417 [0,1,1,0,0,0|2,0,0]=4 688 B13R1.108 COc1c(N)cccc1S(N)(=O)=O Amb26579512 [0,1,1,0,0,0|2,0,0]=4 689 B13R1.108 COc1c(O)cccc1S(N)(=O)=O Amb26439398 [0,1,1,0,0,0|2,0,0]=4 690 B13R1.108 CS(=O)(=O)c1cccc(Cl)c1C=O Amb25816834 [0,1,1,0,0,0|1,0,0]=3 691 B13R1.108 CSc1c(Cl)cccc1S(N)(=O)=O Amb27794465 [0,1,1,0,0,0|2,0,0]=4 692 B13R1.108 Cc1cccc(S(N)(=O)=O)c1C#N Amb27440815 [0,1,1,0,0,0|1,0,1]=4 693 B13R1.108 Cc1cccc(S(N)(=O)=O)c1C=O Amb28410639 [0,1,1,0,0,0|0,0,0]=2 694 B13R1.108 N#Cc1c(Br)cccc1S(N)(=O)=O Amb25732062 [0,1,1,0,0,0|1,0,1]=4 695 B13R1.108 N#Cc1c(Cl)cccc1S(N)(=O)=O Amb27153584 [0,1,1,0,0,0|1,0,1]=4 696 B13R1.108 N#Cc1c(F)cccc1S(N)(=O)=O Amb9443881 [0,1,1,0,0,0|1,0,1]=4 697 B13R1.108 N#Cc1c(N)cccc1S(N)(=O)=O Amb32947085 [0,1,1,0,0,0|1,0,1]=4 698 B13R1.108 N#Cc1c(O)cccc1S(N)(=O)=O Amb24416811 [0,1,1,0,0,0|1,0,1]=4 699 B13R1.108 NS(=O)(=O)c1cccc(Br)c1CBr Amb25095947 [0,1,1,0,0,0|1,0,1]=4 700 B13R1.108 NS(=O)(=O)c1cccc(F)c1C=O Amb27240513 [0,1,1,0,0,0|0,0,0]=2 701 B13R1.108 NS(=O)(=O)c1cccc(O)c1C=O Amb27482760 [0,1,1,0,0,0|0,0,0]=2 702 B13R1.349 C=C(C)c1ccccc1S(=O)(=O)Cl Amb27810682 [0,1,1,0,0,0|2,0,0]=4 703 B13R1.349 CC(=O)c1ccccc1S(=O)(=O)Cl Amb1130970 [0,1,1,0,0,0|1,0,0]=3 704 B13R1.349 CC(=O)c1ccccc1S(C)(=O)=O Amb5721056 [0,1,1,0,0,0|1,0,0]=3 705 B13R1.349 CC(=O)c1ccccc1S(N)(=O)=O Amb25782594 [0,1,1,0,0,0|0,0,0]=2 706 B13R1.349 CC(=O)c1cccnc1S(C)(=O)=O Amb18187742 [0,1,1,0,0,0|2,0,0]=4 707 B13R1.349 CC(=O)c1cccnc1S(N)(=O)=O Amb27597531 [0,1,1,0,0,0|1,0,0]=3 708 B13R1.349 CC(=O)c1ccncc1S(N)(=O)=O Amb27162790 [0,1,1,0,0,0|1,0,0]=3 709 B13R1.349 CC(=O)c1ncccc1S(C)(=O)=O Amb23412452 [0,1,1,0,0,0|2,0,0]=4 710 B13R1.349 CC(C)c1ccccc1S(N)(=O)=O Amb9023522 [0,1,1,0,0,0|1,0,1]=4 711 B13R1.349 CN(C)c1ccccc1S(N)(=O)=O Amb23567015 [0,1,1,0,0,0|2,0,0]=4 712 B13R1.349 CS(=N)(=O)c1ccccc1C(=O)O Amb32668645 [0,1,1,0,0,0|1,0,1]=4 713 B13R1.349 CS(=O)(=O)c1ccccc1C(=N)N Amb24065162 [0,1,1,0,0,0|2,0,0]=4 714 B13R1.349 CS(=O)(=O)c1ccccc1C(=O)Cl Amb27394147 [0,1,1,0,0,0|1,0,0]=3 715 B13R1.349 CS(=O)(=O)c1ccccc1C(=O)O Amb1212344 [0,1,1,0,0,0|1,0,0]=3 716 B13R1.349 CS(=O)(=O)c1ccccc1C(N)=O Amb25958380 [0,1,1,0,0,0|1,0,0]=3 717 B13R1.349 CS(=O)(=O)c1ccccc1C(N)=S Amb26633896 [0,1,1,0,0,0|1,1,0]=4 718 B13R1.349 CS(=O)(=O)c1ccccc1S(=O)[O-] Amb32753859 [0,1,1,0,0,0|2,0,0]=4 719 B13R1.349 CS(=O)(=O)c1ccccc1[N+](=O)[O-] Amb10842190 [0,1,1,0,0,0|2,0,0]=4 720 B13R1.349 CS(=O)(=O)c1cccnc1C(=O)O Amb18653467 [0,1,1,0,0,0|2,0,0]=4 721 B13R1.349 CS(=O)(=O)c1ncccc1C(=O)O Amb7780242 [0,1,1,0,0,0|2,0,0]=4 722 B13R1.349 NC(=O)c1ccccc1S(=O)(=O)Cl Amb1138438 [0,1,1,0,0,0|1,0,0]=3 723 B13R1.349 NC(=O)c1ccccc1S(N)(=O)=O Amb8854700 [0,1,1,0,0,0|0,0,0]=2 724 B13R1.349 NC(=O)c1cccnc1S(=O)(=O)Cl Amb27814037 [0,1,1,0,0,0|2,0,0]=4 725 B13R1.349 NC(=S)c1ccccc1S(N)(=O)=O Amb6258335 [0,1,1,0,0,0|0,1,0]=3 726 B13R1.349 NS(=O)(=O)c1ccccc1B(O)O Amb22168993 [0,1,1,0,0,0|1,0,1]=4 727 B13R1.349 NS(=O)(=O)c1ccccc1C(=O)O Amb842836 [0,1,1,0,0,0|0,0,0]=2 728 B13R1.349 NS(=O)(=O)c1ccccc1C(F)F Amb33296528 [0,1,1,0,0,0|1,0,1]=4 729 B13R1.349 NS(=O)(=O)c1ccccc1N(=O)=O Amb6754073 [0,1,1,0,0,0|1,0,0]=3 730 B13R1.349 NS(=O)(=O)c1ccccc1S(=O)[O-] Amb32754299 [0,1,1,0,0,0|1,0,0]=3 731 B13R1.349 NS(=O)(=O)c1ccccc1[N+](=O)[O-] Amb6358144 [0,1,1,0,0,0|1,0,0]=3 732 B13R1.349 NS(=O)(=O)c1cccnc1[N+](=O)[O-] Amb27479309 [0,1,1,0,0,0|2,0,0]=4 733 B13R1.349 NS(=O)(=O)c1cnccc1[N+](=O)[O-] Amb28245945 [0,1,1,0,0,0|2,0,0]=4 734 B13R1.349 O=C(O)c1ccccc1S(=O)(=O)Cl Amb16232987 [0,1,1,0,0,0|1,0,0]=3 735 B13R1.349 O=C(O)c1ccccc1S(=O)(=O)F Amb32667531 [0,1,1,0,0,0|1,0,0]=3 736 B13R1.349 O=C(O)c1ccccc1S(=O)(=O)O Amb10807552 [0,1,1,0,0,0|1,0,0]=3 737 B13R1.349 O=C(O)c1ccccc1S(=O)(=O)O Amb1196439 [0,1,1,0,0,0|1,0,0]=3 738 B13R1.349 O=C(O)c1cccnc1S(=O)(=O)O Amb27618419 [0,1,1,0,0,0|2,0,0]=4 739 B13R1.349 O=C(O)c1ncccc1S(=O)(=O)Cl Amb27258712 [0,1,1,0,0,0|2,0,0]=4 740 B13R1.349 O=N(=O)c1ccccc1S(=O)(=O)Cl Amb20621770 [0,1,1,0,0,0|2,0,0]=4 741 B13R1.349 O=[N+]([O-])c1ccccc1S(=O)(=O)Br Amb27439113 [0,1,1,0,0,0|2,0,0]=4 742 B13R1.349 O=[N+]([O-])c1ccccc1S(=O)(=O)Cl Amb3939743 [0,1,1,0,0,0|2,0,0]=4 743 B13R1.349 O=[N+]([O-])c1ccccc1S(=O)(=O)F Amb10601733 [0,1,1,0,0,0|2,0,0]=4 744 B13R1.349 O=[N+]([O-])c1ccccc1S(=O)(=O)O Amb8629231 [0,1,1,0,0,0|2,0,0]=4 745 B13R1.349 O=[N+]([O-])c1ccccc1S(=O)(=O)[O-] Amb8629354 [0,1,1,0,0,0|2,0,0]=4 746 B13R1.349 [NH-]S(=O)(=O)c1ccccc1[N+](=O)[O-] Amb17779461 [0,1,1,0,0,0|1,0,1]=4 747 B13R1.381 CCCc1ccccc1S(N)(=O)=O Amb9023469 [0,1,1,0,0,0|1,0,1]=4 748 B13R1.381 CCNc1ccccc1S(N)(=O)=O Amb9313617 [0,1,1,0,0,0|1,0,1]=4 749 B13R1.381 CCOc1ccccc1S(N)(=O)=O Amb22059361 [0,1,1,0,0,0|1,0,1]=4 750 B13R1.381 CNCc1ccccc1S(N)(=O)=O Amb25305220 [0,1,1,0,0,0|1,0,1]=4 751 B13R1.381 CNCc1ccccc1S(N)(=O)=O Amb33552725 [0,1,1,0,0,0|1,0,1]=4 752 B13R1.381 COCc1ccccc1S(N)(=O)=O Amb18320569 [0,1,1,0,0,0|0,0,2]=4 753 B13R1.381 CS(=O)(=O)c1ccccc1CC=O Amb33263601 [0,1,1,0,0,0|1,0,0]=3 754 B13R1.381 CS(=O)(=O)c1ccccc1N=C=O Amb26056488 [0,1,1,0,0,0|1,0,1]=4 755 B13R1.381 CS(=O)(=O)c1ccccc1NC=O Amb25808678 [0,1,1,0,0,0|1,0,0]=3 756 B13R1.381 CSCc1ccccc1S(N)(=O)=O Amb27826810 [0,1,1,0,0,0|0,1,1]=4 757 B13R1.381 N#CCc1ccccc1S(N)(=O)=O Amb24101235 [0,1,1,0,0,0|1,0,1]=4 758 B13R1.381 NCCc1ccccc1S(N)(=O)=O Amb26943449 [0,1,1,0,0,0|1,0,1]=4 759 B13R1.381 NS(=O)(=O)c1ncccc1NC=O Amb27752018 [0,1,1,0,0,0|1,0,0]=3 760 B13R1.381 O=C=Nc1ccccc1S(=O)(=O)F Amb27843699 [0,1,1,0,0,0|1,0,1]=4 761 B13R1.381 [N-]=[N+]=Nc1ccccc1S(N)(=O)=O Amb19374288 [0,1,1,0,0,0|2,0,0]=4 762 B13R1.2129 CCS(=O)(=O)c1ccccc1C=O Amb27200192 [0,1,1,0,0,0|1,0,0]=3 763 B13R1.2129 CCc1ccccc1S(=O)(=O)NC Amb27606763 [0,1,1,0,0,0|1,0,1]=4 764 B13R1.2129 CNS(=O)(=O)c1ccccc1C#N Amb6270549 [0,1,1,0,0,0|1,0,1]=4 765 B13R1.2129 CNS(=O)(=O)c1ccccc1CCl Amb27180851 [0,1,1,0,0,0|1,0,1]=4 766 B13R1.2129 CNS(=O)(=O)c1ccccc1CN Amb1132441 [0,1,1,0,0,0|1,0,1]=4 767 B13R1.2129 CNS(=O)(=O)c1ccccc1CO Amb28069889 [0,1,1,0,0,0|0,0,2]=4 768 B13R1.2129 CNS(=O)(=O)c1ccccc1SC Amb25040801 [0,1,1,0,0,0|2,0,0]=4 769 B13R1.2129 CNc1ccccc1S(=O)(=O)NC Amb9313705 [0,1,1,0,0,0|2,0,0]=4 770 B13R1.2129 COc1ccccc1S(=O)(=O)NO Amb18566664 [0,1,1,0,0,0|2,0,0]=4 771 B13R1.2136 CCc1cccc(C)c1S(N)(=O)=O Amb8866960 [0,1,1,0,0,0|1,0,1]=4 772 B13R1.2136 CCc1cccc(O)c1S(N)(=O)=O Amb27482594 [0,1,1,0,0,0|1,0,1]=4 773 B13R1.2136 CNc1cccc(O)c1S(N)(=O)=O Amb28135485 [0,1,1,0,0,0|2,0,0]=4 774 B13R1.2136 COc1cccc(Br)c1S(N)(=O)=O Amb25123258 [0,1,1,0,0,0|2,0,0]=4 775 B13R1.2136 COc1cccc(C)c1S(N)(=O)=O Amb24678994 [0,1,1,0,0,0|2,0,0]=4 776 B13R1.2136 COc1cccc(Cl)c1S(N)(=O)=O Amb26855441 [0,1,1,0,0,0|2,0,0]=4 777 B13R1.2136 COc1cccc(F)c1S(N)(=O)=O Amb19888936 [0,1,1,0,0,0|2,0,0]=4 778 B13R1.2136 COc1cccc(N)c1S(N)(=O)=O Amb27585541 [0,1,1,0,0,0|2,0,0]=4 779 B13R1.2136 COc1cccc(O)c1S(N)(=O)=O Amb27759662 [0,1,1,0,0,0|2,0,0]=4 780 B13R1.2136 CSc1cccc(N)c1S(N)(=O)=O Amb27607564 [0,1,1,0,0,0|2,0,0]=4 781 B13R1.2136 Cc1cccc(C#N)c1S(N)(=O)=O Amb24406084 [0,1,1,0,0,0|1,0,1]=4 782 B13R1.2136 N#Cc1cccc(Cl)c1S(N)(=O)=O Amb25856907 [0,1,1,0,0,0|1,0,1]=4 783 B13R1.2136 N#Cc1cccc(O)c1S(N)(=O)=O Amb26967285 [0,1,1,0,0,0|1,0,1]=4 784 B13R1.2136 NS(=O)(=O)c1c(Br)cccc1CBr Amb27829999 [0,1,1,0,0,0|1,0,1]=4 785 B13R1.3090 C=Cc1ccc(Cl)cc1S(=O)(=O)Cl Amb28239261 [0,1,1,0,0,0|2,0,0]=4 786 B13R1.3090 CCc1ccc(N)cc1S(N)(=O)=O Amb8883005 [0,1,1,0,0,0|1,0,1]=4 787 B13R1.3090 CNc1ccc(O)cc1S(N)(=O)=O Amb28185986 [0,1,1,0,0,0|2,0,0]=4 788 B13R1.3090 COc1ccc(Br)cc1S(N)(=O)=O Amb8280762 [0,1,1,0,0,0|2,0,0]=4 789 B13R1.3090 COc1ccc(C)cc1S(N)(=O)=O Amb1135590 [0,1,1,0,0,0|2,0,0]=4 790 B13R1.3090 COc1ccc(Cl)cc1S(N)(=O)=O Amb13961996 [0,1,1,0,0,0|2,0,0]=4 791 B13R1.3090 COc1ccc(F)cc1S(N)(=O)=O Amb1931162 [0,1,1,0,0,0|2,0,0]=4 792 B13R1.3090 COc1ccc(N)cc1S(N)(=O)=O Amb10609033 [0,1,1,0,0,0|2,0,0]=4 793 B13R1.3090 COc1ccc(N)cc1S(N)(=O)=O Amb1107874 [0,1,1,0,0,0|2,0,0]=4 794 B13R1.3090 CS(=O)(=O)c1cc(Br)ccc1C=O Amb2691427 [0,1,1,0,0,0|1,0,0]=3 795 B13R1.3090 CS(=O)(=O)c1cc(Cl)ccc1C=O Amb2691426 [0,1,1,0,0,0|1,0,0]=3 796 B13R1.3090 CSc1ccc(O)cc1S(N)(=O)=O Amb27972112 [0,1,1,0,0,0|2,0,0]=4 797 B13R1.3090 Cc1ccc(C#N)c(S(N)(=O)=O)c1 Amb18325006 [0,1,1,0,0,0|1,0,1]=4 798 B13R1.3090 Cc1ccc(C=O)c(S(N)(=O)=O)c1 Amb27219371 [0,1,1,0,0,0|0,0,0]=2 799 B13R1.3090 N#Cc1ccc(Br)cc1S(N)(=O)=O Amb24611257 [0,1,1,0,0,0|1,0,1]=4 800 B13R1.3090 N#Cc1ccc(Cl)cc1S(N)(=O)=O Amb8874116 [0,1,1,0,0,0|1,0,1]=4 801 B13R1.3090 N#Cc1ccc(F)cc1S(N)(=O)=O Amb25373694 [0,1,1,0,0,0|1,0,1]=4 802 B13R1.3090 N#Cc1ccc(O)cc1S(N)(=O)=O Amb25374073 [0,1,1,0,0,0|1,0,1]=4 803 B13R1.3090 NS(=O)(=O)c1cc(F)ccc1CCl Amb27394632 [0,1,1,0,0,0|1,0,1]=4 804 B13R1.3090 NS(=O)(=O)c1cc(O)ccc1C=O Amb28240887 [0,1,1,0,0,0|0,0,0]=2 805 B13R1.3090 O=Cc1ccc(Cl)cc1S(=O)(=O)O Amb17596014 [0,1,1,0,0,0|1,0,0]=3 806 B13R1.11 CNC(=O)NC(=O)c1ccccc1 Amb28287343 [0,1,1,0,0,0|2,0,0]=4 807 B13R1.11 C[C@@H](C=O)NC(=O)c1ccccc1 Amb27215399 [0,1,1,0,0,0|2,0,0]=4 808 B13R1.11 NCC(=O)NC(=O)c1ccccc1 Amb25782184 [0,1,1,0,0,0|2,0,0]=4 809 B13R1.11 O=C(CCl)NC(=O)c1ccccc1 Amb6374171 [0,1,1,0,0,0|2,0,0]=4 810 B13R1.11 O=C(CO)NC(=O)c1ccccc1 Amb1109639 [0,1,1,0,0,0|1,0,1]=4 811 B13R1.11 O=C(NCl)NC(=O)c1ccccc1 Amb27848986 [0,1,1,0,0,0|2,0,0]=4 812 B13R1.132 CC(=O)NC(=O)c1ccc(Br)cc1 Amb27445328 [0,1,1,0,0,0|2,0,0]=4 813 B13R1.132 CC(=O)NC(=O)c1ccc(C)cc1 Amb27268533 [0,1,1,0,0,0|2,0,0]=4 814 B13R1.132 CC(=O)NC(=O)c1ccc(F)cc1 Amb18178968 [0,1,1,0,0,0|2,0,0]=4 815 B13R1.132 CC(=O)NC(=O)c1ccc(O)cc1 Amb18128318 [0,1,1,0,0,0|2,0,0]=4 816 B13R1.132 Cc1ccc(C(=O)NC(N)=O)cc1 Amb27797026 [0,1,1,0,0,0|2,0,0]=4 817 B13R1.132 NC(=O)NC(=O)c1ccc(F)cc1 Amb28316591 [0,1,1,0,0,0|2,0,0]=4 818 B13R1.132 NC(=O)NC(=O)c1ccc(N)cc1 Amb25053319 [0,1,1,0,0,0|2,0,0]=4 819 B13R1.132 NC(=O)NC(=O)c1ccc(O)cc1 Amb27870023 [0,1,1,0,0,0|2,0,0]=4 820 B13R1.132 O=C(O)NC(=O)c1ccc(Cl)cc1 Amb32620325 [0,1,1,0,0,0|1,0,1]=4 821 B13R1.147 NC(=O)NC(=O)c1cccc(N)c1 Amb25899842 [0,1,1,0,0,0|2,0,0]=4 822 B13R1.147 NC(=O)NC(=O)c1cccc(O)c1 Amb28316533 [0,1,1,0,0,0|2,0,0]=4 823 B13R1.152 CN(C(N)=O)C(=O)c1ccccc1 Amb28127605 [0,1,1,0,0,0|2,0,0]=4 824 B13R1.201 CC(=O)NC(=O)c1ccccc1O Amb1983211 [0,1,1,0,0,0|2,0,0]=4 825 B13R1.201 NC(=O)NC(=O)c1ccccc1O Amb18128561 [0,1,1,0,0,0|2,0,0]=4 826 B13R1.352 CC(NS(=O)(=O)Cl)c1ccccc1 Amb17193931 [0,1,1,0,0,0|1,0,1]=4 827 B13R1.352 CC(NS(=O)(=O)O)c1ccccc1 Amb27603382 [0,1,1,0,0,0|1,0,1]=4 828 B13R1.352 CC(NS(C)(=O)=O)c1ccccc1 Amb6877429 [0,1,1,0,0,0|1,0,1]=4 829 B13R1.352 CS(=O)(=O)CC(=O)c1ccccc1 Amb4018025 [0,1,1,0,0,0|1,0,0]=3 830 B13R1.352 CS(=O)(=O)CC(=O)c1ccncc1 Amb2691247 [0,1,1,0,0,0|2,0,0]=4 831 B13R1.352 CS(=O)(=O)NC(=O)c1ccccc1 Amb2568897 [0,1,1,0,0,0|0,0,0]=2 832 B13R1.352 CS(=O)(=O)NC(=O)c1cccnc1 Amb27771145 [0,1,1,0,0,0|1,0,0]=3 833 B13R1.352 CS(=O)(=O)\C=C(/I)c1ccccc1 Amb2612832 [0,1,1,0,0,0|2,0,0]=4 834 B13R1.352 CS(=O)(=O)\N=C(\N)c1ccccc1 Amb4323307 [0,1,1,0,0,0|1,0,1]=4 835 B13R1.352 C[C@@H](NS(C)(=O)=O)c1ccccc1 Amb27205571 [0,1,1,0,0,0|1,0,1]=4 836 B13R1.352 C\C(=C\S(N)(=O)=O)c1ccccc1 Amb27256939 [0,1,1,0,0,0|2,0,0]=4 837 B13R1.352 NS(=O)(=O)CC(=O)c1ccccc1 Amb33503424 [0,1,1,0,0,0|1,0,0]=3 838 B13R1.352 NS(=O)(=O)NC(=O)c1ccccc1 Amb27946567 [0,1,1,0,0,0|0,0,0]=2 839 B13R1.352 O=C(CS(=O)(=O)Cl)c1ccccc1 Amb18062651 [0,1,1,0,0,0|1,0,0]=3 840 B13R1.352 O=C(CS(=O)(=O)Cl)c1cccnc1 Amb25342121 [0,1,1,0,0,0|2,0,0]=4 841 B13R1.352 O=C(CS(=O)(=O)Cl)c1ccncc1 Amb25142145 [0,1,1,0,0,0|2,0,0]=4 842 B13R1.352 O=C(CS(=O)(=O)O)c1ccccc1 Amb4382641 [0,1,1,0,0,0|1,0,0]=3 843 B13R1.352 O=C(CS(=O)(=O)[O-])c1ccccc1 Amb9154884 [0,1,1,0,0,0|1,0,0]=3 844 B13R1.352 O=C(NS(=O)(=O)Cl)c1ccccc1 Amb28316382 [0,1,1,0,0,0|0,0,0]=2 845 B13R1.352 O=C(OS(=O)(=O)Cl)c1ccccc1 Amb27255592 [0,1,1,0,0,0|1,0,0]=3 846 B13R1.352 O=C([N-]S(=O)(=O)Cl)[n+]1ccccc1 Amb27259155 [0,1,1,0,0,0|1,0,1]=4 847 B13R1.352 O=S(=O)(Cl)\C=C(/Cl)c1ccccc1 Amb18560514 [0,1,1,0,0,0|2,0,0]=4 848 B13R1.352 O=S(=O)(Cl)\C=C(/F)c1ccccc1 Amb32653269 [0,1,1,0,0,0|2,0,0]=4 849 B13R1.352 O=S(=O)(Cl)\C=C(\F)c1ccccc1 Amb28124011 [0,1,1,0,0,0|2,0,0]=4 850 B13R1.352 O=S(=O)(F)\C=C(/F)c1ccccc1 Amb32717973 [0,1,1,0,0,0|2,0,0]=4 851 B13R1.165 CC(=O)c1cc(Br)ccc1N(=O)=O Amb22371054 [0,1,1,0,0,0|2,0,0]=4 852 B13R1.165 CC(=O)c1ccc(O)cc1N(=O)=O Amb8383575 [0,1,1,0,0,0|2,0,0]=4 853 B13R1.165 Cc1ccc(C(=O)O)c(C(N)=O)c1 Amb27974269 [0,1,1,0,0,0|1,0,1]=4 854 B13R1.165 Cc1ccc(C(N)=O)c(C(=O)O)c1 Amb27179251 [0,1,1,0,0,0|1,0,1]=4 855 B13R1.165 Cc1ccc(C(N)=O)c([N+](=O)[O-])c1 Amb23551916 [0,1,1,0,0,0|1,0,1]=4 856 B13R1.165 Cc1ccc(N(=O)=O)c(C(=O)O)c1 Amb20621664 [0,1,1,0,0,0|2,0,0]=4 857 B13R1.165 Cc1ccc([N+](=O)[O-])c(C(N)=O)c1 Amb6296563 [0,1,1,0,0,0|1,0,1]=4 858 B13R1.165 NC(=O)c1cc(Br)ccc1[N+](=O)[O-] Amb24700714 [0,1,1,0,0,0|1,0,1]=4 859 B13R1.165 NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] Amb2716273 [0,1,1,0,0,0|1,0,1]=4 860 B13R1.165 NC(=O)c1cc(F)ccc1[N+](=O)[O-] Amb19057386 [0,1,1,0,0,0|1,0,1]=4 861 B13R1.165 NC(=O)c1cc(I)ccc1[N+](=O)[O-] Amb24399955 [0,1,1,0,0,0|1,0,1]=4 862 B13R1.165 NC(=O)c1cc(N)ccc1C(=O)O Amb27965067 [0,1,1,0,0,0|1,0,1]=4 863 B13R1.165 NC(=O)c1cc(N)ccc1[N+](=O)[O-] Amb18959210 [0,1,1,0,0,0|1,0,1]=4 864 B13R1.165 NC(=O)c1cc(O)ccc1[N+](=O)[O-] Amb25320818 [0,1,1,0,0,0|1,0,1]=4 865 B13R1.165 NC(=O)c1ccc(Br)cc1C(N)=O Amb8626456 [0,1,1,0,0,0|2,0,0]=4 866 B13R1.165 NC(=O)c1ccc(Br)cc1[N+](=O)[O-] Amb23551921 [0,1,1,0,0,0|1,0,1]=4 867 B13R1.165 NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] Amb3109576 [0,1,1,0,0,0|1,0,1]=4 868 B13R1.165 NC(=O)c1ccc(F)cc1[N+](=O)[O-] Amb22229769 [0,1,1,0,0,0|1,0,1]=4 869 B13R1.165 NC(=O)c1ccc(I)cc1[N+](=O)[O-] Amb27947256 [0,1,1,0,0,0|1,0,1]=4 870 B13R1.165 NC(=O)c1ccc(N)cc1C(N)=O Amb18128355 [0,1,1,0,0,0|2,0,0]=4 871 B13R1.165 NC(=O)c1ccc(N)cc1[N+](=O)[O-] Amb27468698 [0,1,1,0,0,0|1,0,1]=4 872 B13R1.165 NC(=O)c1ccc(O)cc1[N+](=O)[O-] Amb23401147 [0,1,1,0,0,0|1,0,1]=4 873 B13R1.165 Nc1ccc(N(=O)=O)c(C(=O)O)c1 Amb6357278 [0,1,1,0,0,0|2,0,0]=4 874 B13R1.165 O=C(O)c1cc(Br)ccc1N(=O)=O Amb20620550 [0,1,1,0,0,0|2,0,0]=4 875 B13R1.165 O=C(O)c1cc(O)ccc1N(=O)=O Amb20621426 [0,1,1,0,0,0|2,0,0]=4 876 B13R1.165 O=C(O)c1ccc(Br)cc1N(=O)=O Amb20620548 [0,1,1,0,0,0|2,0,0]=4 877 B13R1.165 O=C(O)c1ccc(Cl)cc1N(=O)=O Amb6365359 [0,1,1,0,0,0|2,0,0]=4 878 B13R1.165 O=C(O)c1ccc(F)cc1N(=O)=O Amb20621324 [0,1,1,0,0,0|2,0,0]=4 879 B13R1.295 CC(=O)c1cccc(O)c1N(=O)=O Amb20621427 [0,1,1,0,0,0|2,0,0]=4 880 B13R1.295 Cc1cccc(C(=O)O)c1N(=O)=O Amb6357338 [0,1,1,0,0,0|2,0,0]=4 881 B13R1.295 Cc1cccc(C(N)=O)c1C(N)=O Amb28249966 [0,1,1,0,0,0|2,0,0]=4 882 B13R1.295 Cc1cccc(C(N)=O)c1[N+](=O)[O-] Amb3448033 [0,1,1,0,0,0|1,0,1]=4 883 B13R1.295 Cc1cccc(N(=O)=O)c1C(=O)O Amb6357428 [0,1,1,0,0,0|2,0,0]=4 884 B13R1.295 Cc1cccc([N+](=O)[O-])c1C(N)=O Amb33545962 [0,1,1,0,0,0|1,0,1]=4 885 B13R1.295 NC(=O)c1c(Br)cccc1[N+](=O)[O-] Amb23401713 [0,1,1,0,0,0|1,0,1]=4 886 B13R1.295 NC(=O)c1c(Cl)cccc1[N+](=O)[O-] Amb1094558 [0,1,1,0,0,0|1,0,1]=4 887 B13R1.295 NC(=O)c1c(F)cccc1C(=O)O Amb22495398 [0,1,1,0,0,0|1,0,1]=4 888 B13R1.295 NC(=O)c1c(F)cccc1[N+](=O)[O-] Amb23437232 [0,1,1,0,0,0|1,0,1]=4 889 B13R1.295 NC(=O)c1c(N)cccc1[N+](=O)[O-] Amb21857347 [0,1,1,0,0,0|1,0,1]=4 890 B13R1.295 NC(=O)c1c(O)cccc1C(=O)O Amb27591514 [0,1,1,0,0,0|1,0,1]=4 891 B13R1.295 NC(=O)c1c(O)cccc1[N+](=O)[O-] Amb23412324 [0,1,1,0,0,0|1,0,1]=4 892 B13R1.295 NC(=O)c1cccc(Br)c1C(N)=O Amb23400093 [0,1,1,0,0,0|2,0,0]=4 893 B13R1.295 NC(=O)c1cccc(Br)c1[N+](=O)[O-] Amb25971526 [0,1,1,0,0,0|1,0,1]=4 894 B13R1.295 NC(=O)c1cccc(Cl)c1C(N)=O Amb27474160 [0,1,1,0,0,0|2,0,0]=4 895 B13R1.295 NC(=O)c1cccc(Cl)c1[N+](=O)[O-] Amb22489203 [0,1,1,0,0,0|1,0,1]=4 896 B13R1.295 NC(=O)c1cccc(F)c1C(=O)O Amb22495397 [0,1,1,0,0,0|1,0,1]=4 897 B13R1.295 NC(=O)c1cccc(I)c1[N+](=O)[O-] Amb25936464 [0,1,1,0,0,0|1,0,1]=4 898 B13R1.295 NC(=O)c1cccc(N)c1C(N)=O Amb27396124 [0,1,1,0,0,0|2,0,0]=4 899 B13R1.295 NC(=O)c1cccc(O)c1[N+](=O)[O-] Amb25684263 [0,1,1,0,0,0|1,0,1]=4 900 B13R1.295 Nc1cccc(N(=O)=O)c1C(=O)O Amb20620305 [0,1,1,0,0,0|2,0,0]=4 901 B13R1.295 O=C(O)c1c(Cl)cccc1N(=O)=O Amb20620782 [0,1,1,0,0,0|2,0,0]=4 902 B13R1.295 O=C(O)c1c(F)cccc1N(=O)=O Amb20621328 [0,1,1,0,0,0|2,0,0]=4 903 B13R1.547 CCS(=O)c1ccccc1C(N)=O Amb27476671 [0,1,1,0,0,0|1,0,1]=4 904 B13R1.547 CN(C=O)c1ccccc1C(N)=O Amb28254510 [0,1,1,0,0,0|2,0,0]=4 905 B13R1.547 CNC(=O)c1ccccc1C(=O)O Amb2970514 [0,1,1,0,0,0|1,0,1]=4 906 B13R1.547 CNC(=O)c1ccccc1C(C)=O Amb28342430 [0,1,1,0,0,0|2,0,0]=4 907 B13R1.547 CNC(=O)c1ccccc1C(N)=O Amb27407740 [0,1,1,0,0,0|2,0,0]=4 908 B13R1.547 CNC(=O)c1ccccc1S(C)=O Amb26316755 [0,1,1,0,0,0|1,0,1]=4 909 B13R1.547 CNC(=O)c1ccccc1[N+](=O)[O-] Amb5835679 [0,1,1,0,0,0|1,0,1]=4 910 B13R1.547 COC(=O)c1ccccc1C(N)=O Amb22523492 [0,1,1,0,0,0|1,0,1]=4 911 B13R1.547 NCC(=O)c1ccccc1C(=O)O Amb27668853 [0,1,1,0,0,0|1,0,1]=4 912 B13R1.547 NCC(=O)c1ccccc1C(N)=O Amb27632376 [0,1,1,0,0,0|2,0,0]=4 913 B13R1.547 NCC(=O)c1ccccc1[N+](=O)[O-] Amb18972026 [0,1,1,0,0,0|1,0,1]=4 914 B13R1.547 NNC(=O)c1ccccc1C(=O)O Amb27184557 [0,1,1,0,0,0|1,0,1]=4 915 B13R1.547 NNC(=O)c1ccccc1N(=O)=O Amb6356331 [0,1,1,0,0,0|1,0,0]=3 916 B13R1.547 NNC(=O)c1ccccc1[N+](=O)[O-] Amb1016563 [0,1,1,0,0,0|1,0,1]=4 917 B13R2.2931 CCC1NC(=O)c2ccccc21 Amb27785371 [1,1,0,0,0,0|2,0,0]=4 918 B13R2.2931 C\C=C1/NC(=O)c2ccccc21 Amb27770785 [1,1,0,0,0,0|2,0,0]=4 919 B13R2.2931 C\C=C1\NC(=O)c2ccccc21 Amb28052972 [1,1,0,0,0,0|2,0,0]=4 920 B13R2.2931 N\N=C1/NC(=O)c2ccccc21 Amb25891935 [1,1,0,0,0,0|2,0,0]=4 921 B13R2.2931 O=C1N\C(=N\O)c2ccccc21 Amb21811521 [1,1,0,0,0,0|1,0,1]=4 922 B13R2.2931 O=CN1NC(=O)c2ccccc21 Amb27167808 [1,1,0,0,0,0|1,0,0]=3 923 B13R2.2931 O=NC1=CC(=O)c2ccccc21 Amb28074744 [1,1,0,0,0,0|2,0,0]=4 924 B13R2.3085 CC1C(=O)c2ccccc2C1=O Amb4009534 [1,1,0,0,0,0|2,0,0]=4 925 B13R2.3085 CN1C(=O)c2ccccc2C1=O Amb5794489 [1,1,0,0,0,0|1,0,0]=3 926 B13R2.3085 CN1C(=O)c2ccccc2C1O Amb1155091 [1,1,0,0,0,0|1,0,1]=4 927 B13R2.3085 CN1C(=O)c2ccncc2C1=O Amb27658728 [1,1,0,0,0,0|2,0,0]=4 928 B13R2.3085 N=C1C(=O)c2ccccc2C1=O Amb27176138 [1,1,0,0,0,0|2,0,0]=4 929 B13R2.3085 NC1C(=O)c2ccccc2C1=O Amb18645446 [1,1,0,0,0,0|2,0,0]=4 930 B13R2.3085 NN1C(=O)c2ccccc2C1=O Amb1151859 [1,1,0,0,0,0|1,0,0]=3 931 B13R2.3085 NN1C(=O)c2ccncc2C1=O Amb24524808 [1,1,0,0,0,0|2,0,0]=4 932 B13R2.3085 NN1C(=O)c2ccncc2C1=O Amb32663675 [1,1,0,0,0,0|2,0,0]=4 933 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb18048474 [1,1,0,0,0,0|2,0,0]=4 934 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb22001415 [1,1,0,0,0,0|2,0,0]=4 935 B13R2.3085 O=C1c2ccccc2C(=O)C1Br Amb10071900 [1,1,0,0,0,0|2,0,0]=4 936 B13R2.3085 O=C1c2ccccc2C(=O)C1Cl Amb19988287 [1,1,0,0,0,0|2,0,0]=4 937 B13R2.3085 O=C1c2ccccc2C(=O)N1Br Amb6296045 [1,1,0,0,0,0|1,0,0]=3 938 B13R2.3085 O=C1c2ccccc2C(=O)N1O Amb1351864 [1,1,0,0,0,0|1,0,0]=3 939 B13R2.3085 O=C1c2ccccc2C(=O)N1[K] Amb21520437 [1,1,0,0,0,0|1,0,0]=3 940 B13R2.3085 O=C1c2cccnc2C(=O)N1Cl Amb27411157 [1,1,0,0,0,0|2,0,0]=4 941 B13R2.3085 O=C1c2cccnc2C(=O)N1O Amb22001038 [1,1,0,0,0,0|2,0,0]=4 942 B13R2.3085 O=C1c2cccnc2C(=O)N1O Amb34149531 [1,1,0,0,0,0|2,0,0]=4 943 B13R2.4857 CC1NC(=O)c2c(F)cccc21 Amb28071561 [1,1,0,0,0,0|2,0,0]=4 944 B13R2.4857 CC1NC(=O)c2cccc(F)c21 Amb27876878 [1,1,0,0,0,0|2,0,0]=4 945 B13R2.4857 CN1NC(=O)c2c(Br)cccc21 Amb28366293 [1,1,0,0,0,0|2,0,0]=4 946 B13R2.4857 CN1NC(=O)c2c(N)cccc21 Amb24564482 [1,1,0,0,0,0|2,0,0]=4 947 B13R2.4857 Cc1cccc2c1C(=O)NC2=O Amb17778631 [1,1,0,0,0,0|1,0,0]=3 948 B13R2.4857 Cc1cccc2c1C(=O)NC2C Amb27804198 [1,1,0,0,0,0|2,0,0]=4 949 B13R2.4857 Cc1cccc2c1C(=O)OC2=O Amb8516710 [1,1,0,0,0,0|2,0,0]=4 950 B13R2.4857 Cc1cccc2c1C(O)NC2=O Amb28290402 [1,1,0,0,0,0|1,0,1]=4 951 B13R2.4857 Nc1cccc2c1C(=O)CC2=O Amb18126283 [1,1,0,0,0,0|2,0,0]=4 952 B13R2.4857 Nc1cccc2c1C(=O)NC2=O Amb1105112 [1,1,0,0,0,0|1,0,0]=3 953 B13R2.4857 Nc1cccc2c1C(=O)OC2=O Amb22233088 [1,1,0,0,0,0|2,0,0]=4 954 B13R2.4857 Nc1cccc2c1C(O)NC2=O Amb27759911 [1,1,0,0,0,0|1,0,1]=4 955 B13R2.4857 O=C1CC(=O)c2c(Br)cccc21 Amb27840471 [1,1,0,0,0,0|2,0,0]=4 956 B13R2.4857 O=C1CC(=O)c2c(Cl)cccc21 Amb17594638 [1,1,0,0,0,0|2,0,0]=4 957 B13R2.4857 O=C1CC(=O)c2c(I)cccc21 Amb26406358 [1,1,0,0,0,0|2,0,0]=4 958 B13R2.4857 O=C1NC(=O)c2c(Br)cccc21 Amb21864647 [1,1,0,0,0,0|1,0,0]=3 959 B13R2.4857 O=C1NC(=O)c2c(Cl)cccc21 Amb5722101 [1,1,0,0,0,0|1,0,0]=3 960 B13R2.4857 O=C1NC(=O)c2c(F)cccc21 Amb22728698 [1,1,0,0,0,0|1,0,0]=3 961 B13R2.4857 O=C1NC(=O)c2c(I)cccc21 Amb27968681 [1,1,0,0,0,0|1,0,0]=3 962 B13R2.4857 O=C1NC(=O)c2c(O)cccc21 Amb5721827 [1,1,0,0,0,0|1,0,0]=3 963 B13R2.4857 O=C1NC(=O)c2c1ccnc2Cl Amb28252311 [1,1,0,0,0,0|2,0,0]=4 964 B13R2.4857 O=C1NC(=O)c2c1ccnc2O Amb27849269 [1,1,0,0,0,0|2,0,0]=4 965 B13R2.4857 O=C1NC(O)c2c(Br)cccc21 Amb25802010 [1,1,0,0,0,0|1,0,1]=4 966 B13R2.4857 O=C1NC(O)c2c(Cl)cccc21 Amb28118483 [1,1,0,0,0,0|1,0,1]=4 967 B13R2.4857 O=C1NC(O)c2cccc(Br)c21 Amb26065721 [1,1,0,0,0,0|1,0,1]=4 968 B13R2.4857 O=C1OC(=O)c2c(Br)cccc21 Amb8631528 [1,1,0,0,0,0|2,0,0]=4 969 B13R2.4857 O=C1OC(=O)c2c(Cl)cccc21 Amb2684170 [1,1,0,0,0,0|2,0,0]=4 970 B13R2.4857 O=C1OC(=O)c2c(F)cccc21 Amb2688403 [1,1,0,0,0,0|2,0,0]=4 971 B13R2.4857 O=C1OC(=O)c2c(I)cccc21 Amb19886550 [1,1,0,0,0,0|2,0,0]=4 972 B13R2.4857 O=C1OC(=O)c2c(O)cccc21 Amb3941657 [1,1,0,0,0,0|2,0,0]=4 973 B13R2.5187 C=C1NC(=O)c2cc(Cl)ccc21 Amb28285631 [1,1,0,0,0,0|2,0,0]=4 974 B13R2.5187 CC1NC(=O)c2cc(Br)ccc21 Amb33716192 [1,1,0,0,0,0|2,0,0]=4 975 B13R2.5187 CC1NC(=O)c2cc(Cl)ccc21 Amb27813355 [1,1,0,0,0,0|2,0,0]=4 976 B13R2.5187 CC1NC(=O)c2cc(F)ccc21 Amb27777625 [1,1,0,0,0,0|2,0,0]=4 977 B13R2.5187 CC1NC(=O)c2cc(N)ccc21 Amb28067805 [1,1,0,0,0,0|2,0,0]=4 978 B13R2.5187 CC1NC(=O)c2ccc(Cl)cc21 Amb26559218 [1,1,0,0,0,0|2,0,0]=4 979 B13R2.5187 CC1NC(=O)c2ccc(F)cc21 Amb28246003 [1,1,0,0,0,0|2,0,0]=4 980 B13R2.5187 C[C@H]1NC(=O)c2cc(N)ccc21 Amb27178087 [1,1,0,0,0,0|2,0,0]=4 981 B13R2.5187 Cc1ccc2c(c1)C(=O)CC2=O Amb27177623 [1,1,0,0,0,0|2,0,0]=4 982 B13R2.5187 Cc1ccc2c(c1)C(=O)NC2=O Amb33529184 [1,1,0,0,0,0|1,0,0]=3 983 B13R2.5187 Cc1ccc2c(c1)C(=O)OC2=O Amb6297275 [1,1,0,0,0,0|2,0,0]=4 984 B13R2.5187 Cc1ccc2c(n1)C(=O)NC2=O Amb24487188 [1,1,0,0,0,0|2,0,0]=4 985 B13R2.5187 Cc1cnc2c(c1)C(=O)NC2=O Amb27606314 [1,1,0,0,0,0|2,0,0]=4 986 B13R2.5187 NC1NC(=O)c2cc(Br)ccc21 Amb27223152 [1,1,0,0,0,0|2,0,0]=4 987 B13R2.5187 Nc1ccc2c(c1)C(=O)CC2=O Amb27876716 [1,1,0,0,0,0|2,0,0]=4 988 B13R2.5187 Nc1ccc2c(c1)C(=O)NC2=O Amb6315501 [1,1,0,0,0,0|1,0,0]=3 989 B13R2.5187 Nc1ccc2c(c1)C(=O)OC2=O Amb25256881 [1,1,0,0,0,0|2,0,0]=4 990 B13R2.5187 O=C1CC(=O)c2cc(Br)ccc21 Amb26331546 [1,1,0,0,0,0|2,0,0]=4 991 B13R2.5187 O=C1CC(=O)c2cc(O)ccc21 Amb24594676 [1,1,0,0,0,0|2,0,0]=4 992 B13R2.5187 O=C1NC(=O)c2cc(Br)ccc21 Amb6880855 [1,1,0,0,0,0|1,0,0]=3 993 B13R2.5187 O=C1NC(=O)c2cc(Cl)ccc21 Amb17772222 [1,1,0,0,0,0|1,0,0]=3 994 B13R2.5187 O=C1NC(=O)c2cc(F)ccc21 Amb20623908 [1,1,0,0,0,0|1,0,0]=3 995 B13R2.5187 O=C1NC(=O)c2cc(O)ccc21 Amb18645754 [1,1,0,0,0,0|1,0,0]=3 996 B13R2.5187 O=C1NC(=O)c2ncc(Br)cc21 Amb25042796 [1,1,0,0,0,0|2,0,0]=4 997 B13R2.5187 O=C1NC(=O)c2ncc(Cl)cc21 Amb27599886 [1,1,0,0,0,0|2,0,0]=4 998 B13R2.5187 O=C1NC(O)c2ccc(Cl)cc21 Amb28205944 [1,1,0,0,0,0|1,0,1]=4 999 B13R2.5187 O=C1NS(=O)c2cc(Br)ccc21 Amb26991350 [1,1,0,0,0,0|0,0,1]=3 1000 B13R2.5187 O=C1OC(=O)c2cc(Br)ccc21 Amb2685475 [1,1,0,0,0,0|2,0,0]=4 1001 B13R2.5187 O=C1OC(=O)c2cc(Cl)ccc21 Amb2686431 [1,1,0,0,0,0|2,0,0]=4 1002 B13R2.5187 O=C1OC(=O)c2cc(F)ccc21 Amb2236183 [1,1,0,0,0,0|2,0,0]=4 1003 B13R2.5187 O=C1OC(=O)c2cc(I)ccc21 Amb28293207 [1,1,0,0,0,0|2,0,0]=4 1004 B13R2.5187 O=C1OC(=O)c2cc(O)ccc21 Amb2823283 [1,1,0,0,0,0|2,0,0]=4 1005 B13R2.359 CC1=Cc2ccccc2S1(=O)=O Amb5717428 [1,1,0,0,0,0|1,0,0]=3 1006 B13R2.359 CC1=Nc2ccccc2S1(=O)=O Amb27767987 [1,1,0,0,0,0|2,0,0]=4 1007 B13R2.359 O=C1Nc2ccccc2S1(=O)=O Amb22049660 [1,1,0,0,0,0|2,0,0]=4 1008 B13R2.359 O=S1(=O)C(Br)=Cc2ccccc21 Amb5720553 [1,1,0,0,0,0|1,0,0]=3 1009 B13R2.3108 Cc1ccc2c(c1)C=CS2(=O)=O Amb27861123 [1,1,0,0,0,0|1,0,0]=3 1010 B13R2.3108 Nc1ccc2c(c1)C=CS2(=O)=O Amb25227828 [1,1,0,0,0,0|1,0,0]=3 1011 B13R2.3108 Nc1ccc2c(c1)CCS2(=O)=O Amb10074848 [1,1,0,0,0,0|1,0,1]=4 1012 B13R2.3108 Nc1ccc2c(c1)CNS2(=O)=O Amb26567790 [1,1,0,0,0,0|0,0,1]=3 1013 B13R2.3108 Nc1ccc2c(c1)NNS2(=O)=O Amb28363844 [1,1,0,0,0,0|1,0,0]=3 1014 B13R2.3108 O=S1(=O)C=Cc2cc(Br)ccc21 Amb27258020 [1,1,0,0,0,0|1,0,0]=3 1015 B13R2.3108 O=S1(=O)C=Cc2cc(F)ccc21 Amb27953578 [1,1,0,0,0,0|1,0,0]=3 1016 B13R2.3108 O=S1(=O)C=Cc2cc(O)ccc21 Amb27861369 [1,1,0,0,0,0|1,0,0]=3 1017 B13R2.3108 O=S1(=O)CCc2cc(Br)ccc21 Amb27595537 [1,1,0,0,0,0|1,0,1]=4 1018 B13R2.3108 O=S1(=O)NCc2cc(Br)ccc21 Amb22886731 [1,1,0,0,0,0|0,0,1]=3 1019 B13R2.3108 O=S1(=O)NCc2cc(Cl)ccc21 Amb27953130 [1,1,0,0,0,0|0,0,1]=3 1020 B13R2.3108 O=S1(=O)NCc2cc(F)ccc21 Amb10176927 [1,1,0,0,0,0|0,0,1]=3 1021 B13R2.3108 O=S1(=O)NCc2cc(O)ccc21 Amb26883368 [1,1,0,0,0,0|0,0,1]=3 1022 B13R2.3791 Nc1ccc2c(c1)S(=O)(=O)C=C2 Amb2725048 [1,1,0,0,0,0|1,0,0]=3 1023 B13R2.3791 Nc1ccc2c(c1)S(=O)(=O)CC2 Amb5720473 [1,1,0,0,0,0|1,0,1]=4 1024 B13R2.3791 Nc1ccc2c(c1)S(=O)(=O)NC2 Amb22170456 [1,1,0,0,0,0|0,0,1]=3 1025 B13R2.3791 O=S1(=O)C=Cc2ccc(Br)cc21 Amb27154213 [1,1,0,0,0,0|1,0,0]=3 1026 B13R2.3791 O=S1(=O)C=Cc2ccc(I)cc21 Amb27480997 [1,1,0,0,0,0|1,0,0]=3 1027 B13R2.3791 O=S1(=O)C=Cc2ccc(O)cc21 Amb26883441 [1,1,0,0,0,0|1,0,0]=3 1028 B13R2.3791 O=S1(=O)CCc2ccc(Br)cc21 Amb25134983 [1,1,0,0,0,0|1,0,1]=4 1029 B13R2.3791 O=S1(=O)CCc2ccc(I)cc21 Amb27603596 [1,1,0,0,0,0|1,0,1]=4 1030 B13R2.3791 O=S1(=O)NCc2ccc(Br)cc21 Amb22886728 [1,1,0,0,0,0|0,0,1]=3 1031 B13R2.4848 Nc1cccc2c1C=CS2(=O)=O Amb26841193 [1,1,0,0,0,0|1,0,0]=3 1032 B13R2.4848 Nc1cccc2c1CCS2(=O)=O Amb27836861 [1,1,0,0,0,0|1,0,1]=4 1033 B13R2.4848 O=S1(=O)C=Cc2c(Br)cccc21 Amb28429202 [1,1,0,0,0,0|1,0,0]=3 1034 B13R2.4848 O=S1(=O)CCc2c(Br)cccc21 Amb28368469 [1,1,0,0,0,0|1,0,1]=4 1035 B13R2.3751 Cc1csc2c1S(=O)(=O)NC2=O Amb33096951 [0,1,0,0,1,0|1,0,0]=3 1036 B13R2.3751 Cn1ncc2c1S(=O)(=O)NC2=O Amb24535419 [0,1,0,0,1,0|2,0,0]=4 1037 B13R2.7029 CN1C(=O)c2ccsc2S1(=O)=O Amb27259301 [0,1,0,0,1,0|1,0,0]=3 1038 B13R2.7029 CN1C(=O)c2sccc2S1(=O)=O Amb27633194 [0,1,0,0,1,0|1,0,0]=3 1039 B13R2.10762 Cn1cc2c(n1)S(=O)(=O)NC2=O Amb32686577 [0,1,0,0,1,0|2,0,0]=4 1040 B13R2.10762 O=C1NS(=O)(=O)c2cc(Cl)sc21 Amb5720883 [0,1,0,0,1,0|1,0,0]=3 1041 B15R2.7491 Cc1ccc2c(c1)NC(=O)CS2(=O)=O Amb27953208 [0,1,0,0,0,1|1,0,0]=3 1042 B15R2.7491 Cc1ccc2c(c1)NC(=O)NS2(=O)=O Amb27390116 [0,1,0,0,0,1|0,0,0]=2 1043 B15R2.7491 Cc1ccc2c(c1)NC(=S)NS2(=O)=O Amb20248534 [0,1,0,0,0,1|0,1,0]=3 1044 B15R2.7491 Cc1cnc2c(c1)NC(=O)CS2(=O)=O Amb27450562 [0,1,0,0,0,1|2,0,0]=4 1045 B15R2.7491 NC1=NS(=O)(=O)c2ccc(Cl)cc2N1 Amb26368699 [0,1,0,0,0,1|1,0,1]=4 1046 B15R2.7491 Nc1ccc2c(c1)NC(=O)CS2(=O)=O Amb18137456 [0,1,0,0,0,1|1,0,0]=3 1047 B15R2.7491 O=C1CS(=O)(=O)c2ccc(Br)cc2N1 Amb27397628 [0,1,0,0,0,1|1,0,0]=3 1048 B15R2.7491 O=C1CS(=O)(=O)c2ccc(Cl)cc2N1 Amb25049687 [0,1,0,0,0,1|1,0,0]=3 1049 B15R2.7491 O=C1CS(=O)(=O)c2ccc(F)cc2N1 Amb27450561 [0,1,0,0,0,1|1,0,0]=3 1050 B15R2.7491 O=C1Cc2cc(Br)ccc2S(=O)(=O)N1 Amb28422024 [0,1,0,0,0,1|0,0,0]=2 1051 B15R2.7491 O=C1Nc2cc(Br)ccc2S(=O)(=O)N1 Amb27169224 [0,1,0,0,0,1|0,0,0]=2 1052 B15R2.7491 O=C1Nc2cc(Cl)ccc2S(=O)(=O)N1 Amb28184343 [0,1,0,0,0,1|0,0,0]=2 1053 B15R2.7491 O=C1Nc2cc(F)ccc2S(=O)(=O)N1 Amb25289177 [0,1,0,0,0,1|0,0,0]=2 1054 B15R2.13166 CN1C(=O)NS(=O)(=O)c2ccccc21 Amb22455071 [0,1,0,0,0,1|0,0,0]=2 1055 B15R2.13166 CN1C(Cl)=NS(=O)(=O)c2ccccc21 Amb2414164 [0,1,0,0,0,1|1,0,1]=4 1056 B15R2.13166 CN1c2ccccc2S(=O)(=O)NC1Cl Amb27423046 [0,1,0,0,0,1|1,0,1]=4 1057 B15R2.13973 CC1=NS(=O)(=O)c2cc(Br)ccc2N1 Amb10609777 [0,1,0,0,0,1|1,0,1]=4 1058 B15R2.13973 CC1=NS(=O)(=O)c2cc(Cl)ccc2N1 Amb4037347 [0,1,0,0,0,1|1,0,1]=4 1059 B15R2.13973 CC1=Nc2ccc(Cl)cc2S(=O)(=O)N1 Amb10843847 [0,1,0,0,0,1|1,0,0]=3 1060 B15R2.13973 CC1Nc2ccc(Cl)cc2S(=O)(=O)N1 Amb10807567 [0,1,0,0,0,1|1,0,1]=4 1061 B15R2.13973 CC1Nc2ccc(F)cc2S(=O)(=O)N1 Amb27784939 [0,1,0,0,0,1|1,0,1]=4 1062 B15R2.13973 CC1Nc2ccc(O)cc2S(=O)(=O)N1 Amb26328658 [0,1,0,0,0,1|1,0,1]=4 1063 B15R2.13973 Cc1ccc2c(c1)S(=O)(=O)CC(=O)N2 Amb27406302 [0,1,0,0,0,1|1,0,0]=3 1064 B15R2.13973 Cc1ccc2c(c1)S(=O)(=O)N=C(Cl)N2 Amb17249229 [0,1,0,0,0,1|1,0,1]=4 1065 B15R2.13973 Cc1ccc2c(c1)S(=O)(=O)NC(=O)N2 Amb8389597 [0,1,0,0,0,1|0,0,0]=2 1066 B15R2.13973 Cc1ccc2c(c1)S(=O)(=O)NC(=S)N2 Amb8389602 [0,1,0,0,0,1|0,1,0]=3 1067 B15R2.13973 Cc1ccc2c(n1)S(=O)(=O)CC(=O)N2 Amb27812332 [0,1,0,0,0,1|2,0,0]=4 1068 B15R2.13973 Cc1cnc2c(c1)S(=O)(=O)NC(=O)N2 Amb28363840 [0,1,0,0,0,1|1,0,0]=3 1069 B15R2.13973 N=C1Cc2ccc(N)cc2S(=O)(=O)N1 Amb27592891 [0,1,0,0,0,1|1,0,0]=3 1070 B15R2.13973 Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 Amb32675082 [0,1,0,0,0,1|1,0,0]=3 1071 B15R2.13973 Nc1ccc2c(c1)S(=O)(=O)NC(=O)N2 Amb25035889 [0,1,0,0,0,1|0,0,0]=2 1072 B15R2.13973 O=C1N=C2C=CC(Cl)=CN2S(=O)(=O)N1 Amb27238757 [0,1,0,0,0,1|1,0,0]=3 1073 B15R2.13973 O=C1Nc2ccc(Cl)cc2S(=O)(=O)N1 Amb17250520 [0,1,0,0,0,1|0,0,0]=2 1074 B15R2.13973 O=C1Nc2ccc(F)cc2S(=O)(=O)N1 Amb17242193 [0,1,0,0,0,1|0,0,0]=2 1075 B15R2.13973 O=C1Nc2ccc(I)cc2S(=O)(=O)N1 Amb17546273 [0,1,0,0,0,1|0,0,0]=2 1076 B15R2.13973 O=C1Nc2ccc(O)cc2S(=O)(=O)N1 Amb32416745 [0,1,0,0,0,1|0,0,0]=2 1077 B15R2.13973 O=S1(=O)N=C(Cl)Nc2ccc(Cl)cc21 Amb17261944 [0,1,0,0,0,1|1,0,1]=4 1078 B15R2.13973 O=S1(=O)N=C(Cl)Nc2ccc(F)cc21 Amb17251921 [0,1,0,0,0,1|1,0,1]=4 1079 B15R2.13973 O=S1(=O)NC(=S)Nc2ccc(Cl)cc21 Amb17546270 [0,1,0,0,0,1|0,1,0]=3 1080 B15R2.13973 O=S1(=O)NC(=S)Nc2ccc(F)cc21 Amb17546257 [0,1,0,0,0,1|0,1,0]=3 1081 B15R2.13973 O=S1(=O)NC(Cl)=Nc2ccc(Br)cc21 Amb32428174 [0,1,0,0,0,1|1,0,0]=3 1082 B15R2.13973 O=S1(=O)NC(Cl)=Nc2ccc(I)cc21 Amb32416740 [0,1,0,0,0,1|1,0,0]=3 1083 B15R2.14213 CN1C(=O)Cc2ccccc2S1(=O)=O Amb27827932 [0,1,0,0,0,1|0,0,0]=2 1084 B15R2.14213 CN1C(=O)Nc2ccccc2P1(C)=O Amb27964510 [0,1,0,0,0,1|2,0,0]=4 1085 B15R2.14213 CN1C(=O)Nc2ccccc2S1(=O)=O Amb17241135 [0,1,0,0,0,1|0,0,0]=2 1086 B15R2.14213 CN1C(Cl)=Nc2ccccc2S1(=O)=O Amb17249230 [0,1,0,0,0,1|1,0,0]=3 1087 B15R2.21244 CCC1=NS(=O)(=O)c2ccccc2N1 Amb28288343 [0,1,0,0,0,1|1,0,1]=4 1088 B15R2.21244 CCC1Nc2ccccc2S(=O)(=O)N1 Amb27194378 [0,1,0,0,0,1|1,0,1]=4 1089 B15R2.21244 CNC1=NS(=O)(=O)c2ccccc2N1 Amb17545795 [0,1,0,0,0,1|1,0,1]=4 1090 B15R2.21244 CSC1=Nc2ncccc2S(=O)(=O)N1 Amb27647009 [0,1,0,0,0,1|1,1,0]=4 1091 B15R2.21244 NCC1=NS(=O)(=O)c2ccccc2N1 Amb32794965 [0,1,0,0,0,1|1,0,1]=4 1092 B15R2.21244 NCC1=Nc2ccccc2S(=O)(=O)N1 Amb13902404 [0,1,0,0,0,1|1,0,0]=3 1093 B15R2.21244 NNC1=NS(=O)(=O)c2ccccc2N1 Amb28190901 [0,1,0,0,0,1|1,0,1]=4 1094 B15R2.21244 O=S1(=O)NC(CBr)Nc2ccccc21 Amb33715322 [0,1,0,0,0,1|1,0,1]=4 1095 B15R2.21244 O=S1(=O)NC(CCl)=Nc2ccccc21 Amb9701757 [0,1,0,0,0,1|1,0,0]=3 1096 B15R2.21244 O=S1(=O)NC(CCl)Nc2ccccc21 Amb26504881 [0,1,0,0,0,1|1,0,1]=4 1097 B15R2.49763 CC1(C)Nc2ccccc2S(=O)(=O)N1 Amb28043897 [0,1,0,0,0,1|1,0,1]=4 1098 B15R2.61354 CC1Nc2c(F)cccc2S(=O)(=O)N1 Amb26330470 [0,1,0,0,0,1|1,0,1]=4 1099 B15R2.61354 Cc1cccc2c1NC(=O)NS2(=O)=O Amb17241134 [0,1,0,0,0,1|0,0,0]=2 1100 B15R2.61354 Cc1cccc2c1NC(Cl)=NS2(=O)=O Amb17249228 [0,1,0,0,0,1|1,0,1]=4 1101 B15R2.61354 Nc1cccc2c1NC(=O)NS2(=O)=O Amb32416763 [0,1,0,0,0,1|0,0,0]=2 1102 B15R2.61354 O=C1CS(=O)(=O)c2cccc(Br)c2N1 Amb28200424 [0,1,0,0,0,1|1,0,0]=3 1103 B15R2.61354 O=C1Nc2c(Br)cccc2S(=O)(=O)N1 Amb28208593 [0,1,0,0,0,1|0,0,0]=2 1104 B15R2.61354 O=C1Nc2c(Cl)cccc2S(=O)(=O)N1 Amb17250519 [0,1,0,0,0,1|0,0,0]=2 1105 B15R2.61354 O=C1Nc2c(F)cccc2S(=O)(=O)N1 Amb17242192 [0,1,0,0,0,1|0,0,0]=2 1106 B15R2.61354 O=C1Nc2c(I)cccc2S(=O)(=O)N1 Amb23597166 [0,1,0,0,0,1|0,0,0]=2 1107 B15R2.61354 O=C1Nc2c(O)cccc2S(=O)(=O)N1 Amb26045181 [0,1,0,0,0,1|0,0,0]=2 1108 B15R2.61354 O=S1(=O)N=C(Cl)Nc2c(Cl)cccc21 Amb17261943 [0,1,0,0,0,1|1,0,1]=4 1109 B15R2.61354 O=S1(=O)N=C(Cl)Nc2c(F)cccc21 Amb17251920 [0,1,0,0,0,1|1,0,1]=4 1110 B15R2.61354 O=S1(=O)NC(Cl)=Nc2c(Br)cccc21 Amb32428171 [0,1,0,0,0,1|1,0,0]=3 1111 B15R2.61354 O=S1(=O)NC(Cl)=Nc2c(I)cccc21 Amb23557199 [0,1,0,0,0,1|1,0,0]=3 1112 B15R2.61361 CC1=Nc2cccc(Cl)c2S(=O)(=O)N1 Amb27642130 [0,1,0,0,0,1|1,0,0]=3 1113 B15R2.61361 Cc1cccc2c1S(=O)(=O)CC(=O)N2 Amb27217694 [0,1,0,0,0,1|1,0,0]=3 1114 B15R2.61361 Cc1cccc2c1S(=O)(=O)NC(=O)N2 Amb32674187 [0,1,0,0,0,1|0,0,0]=2 1115 B15R2.61361 O=C1CS(=O)(=O)c2c(Br)cccc2N1 Amb35654400 [0,1,0,0,0,1|1,0,0]=3 1116 B15R2.61361 O=C1CS(=O)(=O)c2c(Cl)cccc2N1 Amb25826281 [0,1,0,0,0,1|1,0,0]=3 1117 B15R2.61361 O=C1Nc2cccc(F)c2S(=O)(=O)N1 Amb32674189 [0,1,0,0,0,1|0,0,0]=2 1118 B15R2.7494 O=C1CCS(=O)(=O)c2ccc(Br)cc21 Amb8858039 [0,1,0,0,0,1|1,0,0]=3 1119 B15R2.7494 O=C1CCS(=O)(=O)c2ccc(Cl)cc21 Amb1156652 [0,1,0,0,0,1|1,0,0]=3 1120 B15R2.7494 O=C1CCS(=O)(=O)c2ccc(F)cc21 Amb1154178 [0,1,0,0,0,1|1,0,0]=3 1121 B15R2.7494 O=C1NCS(=O)(=O)c2ccc(Br)cc21 Amb33465387 [0,1,0,0,0,1|0,0,0]=2 1122 B15R2.13622 Cc1cccc2c1S(=O)(=O)CCC2=O Amb25164670 [0,1,0,0,0,1|1,0,0]=3 1123 B15R2.13622 O=C1CCS(=O)(=O)c2c(F)cccc21 Amb267385 [0,1,0,0,0,1|1,0,0]=3 1124 B15R2.14787 Cc1ccc2c(c1)S(=O)(=O)CCC2=O Amb27464802 [0,1,0,0,0,1|1,0,0]=3 1125 B15R2.14787 O=C1CCS(=O)(=O)c2cc(Cl)ccc21 Amb28252984 [0,1,0,0,0,1|1,0,0]=3 1126 B15R2.14787 O=C1NCS(=O)(=O)c2cc(Br)ccc21 Amb23453072 [0,1,0,0,0,1|0,0,0]=2 1127 B15R2.61346 O=C1CCS(=O)(=O)c2cccc(O)c21 Amb27961152 [0,1,0,0,0,1|1,0,0]=3 1128 B15R2.61763 CC1CC(=O)c2ccccc2S1(=O)=O Amb9398291 [0,1,0,0,0,1|1,0,0]=3 1129 B15R2.61763 CN1CC(=O)c2ccccc2S1(=O)=O Amb1992592 [0,1,0,0,0,1|0,0,0]=2 1130 B15R2.61763 CN1CC(N)c2ccccc2S1(=O)=O Amb27827788 [0,1,0,0,0,1|1,0,1]=4 1131 B15R2.89224 CCC1CNS(=O)(=O)c2ccccc21 Amb27963568 [0,1,0,0,0,1|1,0,1]=4 1132 B15R2.89224 CNC1=NNS(=O)(=O)c2ccccc21 Amb25689620 [0,1,0,0,0,1|1,0,0]=3 1133 B15R2.13861 CN1c2ccccc2C(=O)CS1(=O)=O Amb2445888 [0,1,0,0,0,1|1,0,0]=3 1134 B15R2.13861 CN1c2ccccc2C(N)=CS1(=O)=O Amb32831022 [0,1,0,0,0,1|2,0,0]=4 1135 B15R2.50278 Cc1ccc2c(c1)C(=O)CS(=O)(=O)C2 Amb28397984 [0,1,0,0,0,1|1,0,0]=3 1136 B15R2.50278 Nc1ccc2c(c1)C(=O)NS(=O)(=O)C2 Amb27630076 [0,1,0,0,0,1|0,0,0]=2 1137 B15R2.50278 O=C1CS(=O)(=O)Nc2ccc(F)cc21 Amb23451291 [0,1,0,0,0,1|1,0,0]=3 1138 B15R2.50278 O=C1CS(=O)(=O)Oc2ccc(Br)cc21 Amb27866385 [0,1,0,0,0,1|1,0,0]=3 1139 B15R2.61364 Cc1cccc2c1C(N)=NS(=O)(=O)N2 Amb27413905 [0,1,0,0,0,1|1,0,1]=4 1140 B15R2.63911 O=C1NS(=O)(=O)Cc2cc(Br)ccc21 Amb28044863 [0,1,0,0,0,1|0,0,0]=2 1141 B15R2.89951 CNC1=NS(=O)(=O)Oc2ccccc21 Amb28208281 [0,1,0,0,0,1|1,0,1]=4 1142 B15R2.4975 CCc1ccc2c(c1)C(=O)NS2(=O)=O Amb33096959 [0,2,0,0,0,0|0,0,0]=2 1143 B15R2.4975 CNc1ccc2c(c1)C(=O)NS2(=O)=O Amb28351897 [0,2,0,0,0,0|0,0,0]=2 1144 B15R2.4975 COc1ccc2c(c1)C(=O)NS2(=O)=O Amb26304349 [0,2,0,0,0,0|0,0,0]=2 1145 B15R2.4975 N#Cc1ccc2c(c1)C(=O)NS2(=O)=O Amb33096962 [0,2,0,0,0,0|0,0,0]=2 1146 B15R2.25188 O=C1NS(=O)(=O)c2cc(O)c(O)cc21 Amb27612665 [0,2,0,0,0,0|0,0,0]=2 1147 B15R2.43586 CC1(C)NS(=O)(=O)c2cc(N)ccc21 Amb27947462 [0,2,0,0,0,0|1,0,1]=4 1148 B15R2.43586 CC1(C)NS(=O)(=O)c2ccc(O)cc21 Amb26341767 [0,2,0,0,0,0|1,0,1]=4 1149 B15R2.43587 CN1C(=O)c2cc(N)ccc2S1(=O)=O Amb18943951 [0,2,0,0,0,0|0,0,0]=2 1150 B15R2.53061 Cc1cc(C)c2c(c1)C(N)=NS2(=O)=O Amb27169141 [0,2,0,0,0,0|1,0,1]=4 1151 B15R2.53061 Cc1cc(F)cc2c1S(=O)(=O)NC2=O Amb20667827 [0,2,0,0,0,0|0,0,0]=2 1152 B15R2.53061 NC1=NS(=O)(=O)c2c(Cl)cc(Cl)cc21 Amb27486335 [0,2,0,0,0,0|1,0,1]=4 1153 B15R2.53061 O=C1NS(=O)(=O)c2c(Cl)cc(Cl)cc21 Amb33096958 [0,2,0,0,0,0|0,0,0]=2 1154 B15R2.106949 NNC1=NS(=O)(=O)c2ccc(Cl)cc21 Amb25676433 [0,2,0,0,0,0|1,0,1]=4 1155 B15R2.20946 COc1cccc2c1C(=O)NS2(=O)=O Amb25918076 [0,2,0,0,0,0|0,0,0]=2 1156 B15R2.20946 COc1cccc2c1C(N)=NS2(=O)=O Amb18657251 [0,2,0,0,0,0|1,0,1]=4 1157 B15R2.107183 CNC1=NS(=O)(=O)c2cccc(Cl)c21 Amb27466385 [0,2,0,0,0,0|1,0,1]=4 1158 B15R2.107183 CNC1=NS(=O)(=O)c2cccc(F)c21 Amb26993527 [0,2,0,0,0,0|1,0,1]=4 1159 B15R2.20952 CCc1cccc2c1S(=O)(=O)N=C2N Amb28074125 [0,2,0,0,0,0|1,0,1]=4 1160 B15R2.20952 N#Cc1cccc2c1S(=O)(=O)N=C2N Amb28118451 [0,2,0,0,0,0|1,0,1]=4 1161 B15R2.27423 CNC1=NS(=O)(=O)c2c(C)cccc21 Amb25685978 [0,2,0,0,0,0|1,0,1]=4 1162 B15R2.27423 CNC1=NS(=O)(=O)c2c(Cl)cccc21 Amb26074660 [0,2,0,0,0,0|1,0,1]=4 1163 B15R2.154941 CC1=C(Cl)c2cccc(Cl)c2S1(=O)=O Amb10069000 [0,2,0,0,0,0|2,0,0]=4 1164 B15R2.22361 CNc1ccc2c(c1)S(=O)(=O)N=C2Cl Amb27766166 [0,2,0,0,0,0|1,0,1]=4 1165 B15R2.22361 COc1ccc2c(c1)S(=O)(=O)NC2=O Amb25857001 [0,2,0,0,0,0|0,0,0]=2 1166 B15R2.22361 N#Cc1ccc2c(c1)S(=O)(=O)C=C2N Amb27254284 [0,2,0,0,0,0|2,0,0]=4 1167 B15R2.63892 CC1=C(N)c2ccc(C)cc2S1(=O)=O Amb25768862 [0,2,0,0,0,0|2,0,0]=4 1168 B15R2.63892 CC1=C(O)c2ccc(Cl)cc2S1(=O)=O Amb25906091 [0,2,0,0,0,0|1,0,1]=4 1169 B15R2.63892 CN1C(=O)c2ccc(I)cc2S1(=O)=O Amb28142685 [0,2,0,0,0,0|0,0,0]=2 1170 B15R2.63892 CN1C(=O)c2ccc(N)cc2S1(=O)=O Amb18943950 [0,2,0,0,0,0|0,0,0]=2 1171 B15R2.56234 CCNC1=NS(=O)(=O)c2ccccc21 Amb1952988 [0,2,0,0,0,0|1,0,1]=4 1172 B15R2.56234 CNCC1=NS(=O)(=O)c2ccccc21 Amb27958878 [0,2,0,0,0,0|1,0,1]=4 1173 B15R2.56234 NCCC1=CS(=O)(=O)c2ccccc21 Amb27624724 [0,2,0,0,0,0|2,0,0]=4 1174 B15R2.56234 NCCC1=NS(=O)(=O)c2ccccc21 Amb27833113 [0,2,0,0,0,0|1,0,1]=4 1175 B15R2.56234 [N-]=[N+]=NC1=NS(=O)(=O)c2ccccc21 Amb27601920 [0,2,0,0,0,0|1,0,1]=4 1176 B15R2.124185 CN1\C(=N/N)c2ccccc2S1(=O)=O Amb22170632 [0,2,0,0,0,0|1,0,0]=3 1177 B15R2.124185 CNC1c2ccccc2S(=O)(=O)N1C Amb27783390 [0,2,0,0,0,0|1,0,1]=4 1178 B15R2.160873 CC(Br)C1=NS(=O)(=O)c2ccccc21 Amb26605665 [0,2,0,0,0,0|1,0,1]=4 1179 B15R2.160873 CC(N)C1=CS(=O)(=O)c2ccccc21 Amb28071657 [0,2,0,0,0,0|2,0,0]=4 1180 B15R2.160873 CN(C)C1=NS(=O)(=O)c2ccccc21 Amb1952990 [0,2,0,0,0,0|1,0,1]=4 1181 B15R2.160873 CN(N)C1=NS(=O)(=O)c2ccccc21 Amb1013954 [0,2,0,0,0,0|1,0,1]=4 1182 B15R2.160873 O=S([O-])C1CS(=O)(=O)c2ccccc21 Amb32754176 [0,2,0,0,0,0|1,0,1]=4 1183 B15R2.43349 CC1(C)c2ccccc2S(=O)(=O)N1F Amb22347860 [0,2,0,0,0,0|1,0,1]=4 1184 B15R2.43349 O=S1(=O)c2ccccc2S(=O)(=O)N1F Amb22011846 [0,2,0,0,0,0|1,0,0]=3 1185 B15R2.202 CCC1C(=O)c2ccccc2S1(=O)=O Amb2615221 [0,2,0,0,0,0|1,0,0]=3 1186 B15R2.202 O=C1c2ccccc2S(=O)(=O)N1CCl Amb372220 [0,2,0,0,0,0|0,0,0]=2 1187 B15R2.202 O=CN1C(=O)c2ccccc2S1(=O)=O Amb24323705 [0,2,0,0,0,0|0,0,0]=2 1188 B11R0.165 C\C=C\C=C\C(=O)NS(=O)(=O)Cl Amb28127987 [0,0,2,0,0,0|1,0,1]=4 1189 B13R2.3063 O=S(=O)(c1ccccc1)N2CC2 Amb3987174 [0,0,1,1,0,0|1,0,1]=4 1190 B13R2.3122 O=S1(=O)NC=Nc2ccccc21 Amb10609888 [0,0,1,1,0,0|1,0,0]=3 1191 B13R2.3122 O=S1(=O)NCNc2ccccc21 Amb1420757 [0,0,1,1,0,0|1,0,1]=4 1192 B13R2.3122 O=S1(=O)NN=Cc2ccccc21 Amb13951146 [0,0,1,1,0,0|2,0,0]=4 1193 B13R2.3122 O=S1(=O)NN=Nc2ccccc21 Amb24487365 [0,0,1,1,0,0|2,0,0]=4 1194 B13R2.173 O=S1(=O)C=C(c2ccccc2)C1 Amb22386892 [0,0,1,1,0,0|2,0,0]=4 1195 B13R2.328 O=C1Cc2ccccc2C(=O)N1 Amb1221580 [0,0,1,1,0,0|2,0,0]=4 1196 B13R2.328 O=C1NC(=O)c2ccccc2N1 Amb18005794 [0,0,1,1,0,0|2,0,0]=4 1197 B13R2.328 O=C1NC(=O)c2ccccc2O1 Amb20243206 [0,0,1,1,0,0|1,0,1]=4 1198 B13R2.328 O=C1NC(=O)c2ccccc2S1 Amb22036855 [0,0,1,1,0,0|1,1,0]=4 1199 B13R2.328 O=C1NS(=O)Nc2ccccc21 Amb32455867 [0,0,1,1,0,0|1,0,1]=4 1200 B13R2.371 O=C1CNC(=O)c2ccccc21 Amb22372293 [0,0,1,1,0,0|2,0,0]=4 1201 B13R2.371 O=C1NNC(=O)c2ccccc21 Amb18800603 [0,0,1,1,0,0|2,0,0]=4 1202 B13R2.5232 O=C1NS(=O)(=O)Cc2ccoc21 Amb24547122 [0,0,1,1,0,0|1,0,1]=4 1203 B11R1.33 O=CCS(=O)(=O)c1cccs1 Amb27971666 [0,0,1,0,1,0|2,0,0]=4 1204 B11R1.58 CS(=O)(=O)c1ccsc1C=O Amb18678621 [0,0,1,0,1,0|2,0,0]=4 1205 B11R1.58 CS(=O)(=O)c1cscc1C=O Amb33295731 [0,0,1,0,1,0|2,0,0]=4 1206 B11R1.58 CS(=O)(=O)c1sccc1C=O Amb33309640 [0,0,1,0,1,0|2,0,0]=4 1207 B11R1.58 CS(=O)(=O)n1cccc1C=O Amb20669249 [0,0,1,0,1,0|2,0,0]=4 1208 B11R1.58 NS(=O)(=O)c1ccsc1C=O Amb33330780 [0,0,1,0,1,0|1,0,0]=3 1209 B11R1.58 NS(=O)(=O)c1cscc1C=O Amb33620392 [0,0,1,0,1,0|1,0,0]=3 1210 B11R1.58 NS(=O)(=O)c1sccc1C=O Amb25683511 [0,0,1,0,1,0|1,0,0]=3 1211 B11R1.58 O=Cc1ccsc1S(=O)(=O)Cl Amb33250460 [0,0,1,0,1,0|2,0,0]=4 1212 B11R1.58 O=Cc1sccc1S(=O)(=O)Cl Amb33096967 [0,0,1,0,1,0|2,0,0]=4 1213 B11R1.36 CC(=O)C(=O)c1ccccc1 Amb2099500 [0,0,1,0,1,0|2,0,0]=4 1214 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,0,1,0,1,0|2,0,0]=4 1215 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb2611302 [0,0,1,0,1,0|1,0,1]=4 1216 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb33204525 [0,0,1,0,1,0|1,0,1]=4 1217 B11R1.36 O=C([O-])C(=O)c1ccccc1 Amb33204524 [0,0,1,0,1,0|1,0,1]=4 1218 B11R2.54 CC1C(=O)c2ccccc21 Amb27602983 [1,0,0,0,1,0|2,0,0]=4 1219 B11R2.54 O=C1C(=O)c2ccccc21 Amb18048412 [1,0,0,0,1,0|1,0,0]=3 1220 B11R2.54 O=C1c2ccccc2C1Cl Amb21948336 [1,0,0,0,1,0|2,0,0]=4 1221 B11R2.54 O=C1c2ccccc2C1O Amb27164695 [1,0,0,0,1,0|1,0,1]=4 1222 B11R2.202 O=C1NC(=O)c2cscc21 Amb25883583 [1,0,0,0,1,0|2,0,0]=4 1223 B11R2.392 O=S1(=O)NCc2ccsc21 Amb27796888 [1,0,0,0,1,0|1,0,1]=4 1224 B13R1.1327 C=CCS(=O)(=O)Nc1ccccc1 Amb2228075 [0,0,1,0,0,1|2,0,0]=4 1225 B13R1.1327 C\C=C\S(=O)(=O)Cc1ccccc1 Amb26409654 [0,0,1,0,0,1|2,0,0]=4 1226 B13R1.622 C#Cc1ccccc1CS(N)(=O)=O Amb33054990 [0,0,1,0,0,1|1,0,1]=4 1227 B13R1.622 C#Cc1ccccc1OS(N)(=O)=O Amb33054984 [0,0,1,0,0,1|1,0,1]=4 1228 B13R1.622 CCc1ccccc1CS(N)(=O)=O Amb18331251 [0,0,1,0,0,1|1,0,1]=4 1229 B13R1.622 CCc1ccccc1NS(N)(=O)=O Amb27772297 [0,0,1,0,0,1|1,0,1]=4 1230 B13R1.622 CCc1ccccc1OS(N)(=O)=O Amb24084105 [0,0,1,0,0,1|1,0,1]=4 1231 B13R1.622 CNc1ccccc1CS(N)(=O)=O Amb28397406 [0,0,1,0,0,1|2,0,0]=4 1232 B13R1.622 COc1ccccc1CS(N)(=O)=O Amb33539282 [0,0,1,0,0,1|2,0,0]=4 1233 B13R1.622 COc1ccccc1OS(N)(=O)=O Amb25686735 [0,0,1,0,0,1|2,0,0]=4 1234 B13R1.622 CS(=O)(=O)Nc1ccccc1C=O Amb17935682 [0,0,1,0,0,1|1,0,0]=3 1235 B13R1.622 CS(=O)(=O)Oc1ccccc1C=O Amb22450082 [0,0,1,0,0,1|1,0,0]=3 1236 B13R1.622 CSc1ccccc1CS(N)(=O)=O Amb33263054 [0,0,1,0,0,1|2,0,0]=4 1237 B13R1.622 CSc1ccccc1OS(N)(=O)=O Amb33263285 [0,0,1,0,0,1|2,0,0]=4 1238 B13R1.622 N#Cc1ccccc1CS(N)(=O)=O Amb1141796 [0,0,1,0,0,1|1,0,1]=4 1239 B13R1.622 N#Cc1ccccc1OS(N)(=O)=O Amb28184747 [0,0,1,0,0,1|1,0,1]=4 1240 B13R1.622 NCc1ccccc1CS(N)(=O)=O Amb31188231 [0,0,1,0,0,1|1,0,1]=4 1241 B13R1.622 NCc1ccccc1CS(N)(=O)=O Amb6644564 [0,0,1,0,0,1|1,0,1]=4 1242 B13R1.622 NS(=O)(=O)Oc1ccccc1C=O Amb27748885 [0,0,1,0,0,1|0,0,0]=2 1243 B13R1.45 CC(=O)CNC(=O)c1ccccc1 Amb9836069 [0,0,1,0,0,1|2,0,0]=4 1244 B13R1.45 CC(=O)NCC(=O)c1ccccc1 Amb17335159 [0,0,1,0,0,1|2,0,0]=4 1245 B13R1.45 NC(=O)CNC(=O)c1ccccc1 Amb2761003 [0,0,1,0,0,1|2,0,0]=4 1246 B13R1.45 NC(=O)NNC(=O)c1ccccc1 Amb2786158 [0,0,1,0,0,1|2,0,0]=4 1247 B13R1.45 O=C(F)CNC(=O)c1ccccc1 Amb27815208 [0,0,1,0,0,1|2,0,0]=4 1248 B13R1.45 O=C(NCS(=O)O)c1ccccc1 Amb27631286 [0,0,1,0,0,1|0,0,2]=4 1249 B13R1.45 O=C(O)CNC(=O)c1ccccc1 Amb1006961 [0,0,1,0,0,1|1,0,1]=4 1250 B13R1.348 CC(=O)NC(=O)Nc1ccccc1 Amb4017470 [0,0,1,0,0,1|2,0,0]=4 1251 B13R1.348 CC(=O)NC(=O)Oc1ccccc1 Amb28366948 [0,0,1,0,0,1|2,0,0]=4 1252 B13R1.348 NC(=O)NC(=O)Cc1ccccc1 Amb8513476 [0,0,1,0,0,1|2,0,0]=4 1253 B13R1.348 NC(=O)NC(=O)Nc1ccccc1 Amb2222030 [0,0,1,0,0,1|2,0,0]=4 1254 B13R1.348 O=C(Cl)NC(=O)Cc1ccccc1 Amb27169467 [0,0,1,0,0,1|2,0,0]=4 1255 B13R1.589 CC(=O)Nc1ccccc1C(N)=O Amb3095238 [0,0,1,0,0,1|2,0,0]=4 1256 B13R1.589 NC(=O)Cc1ccccc1[N+](=O)[O-] Amb2613526 [0,0,1,0,0,1|1,0,1]=4 1257 B13R1.589 NC(=O)Nc1ccccc1C(=O)O Amb1116749 [0,0,1,0,0,1|1,0,1]=4 1258 B13R1.589 NC(=O)Nc1ccccc1C(N)=O Amb28458462 [0,0,1,0,0,1|2,0,0]=4 1259 B13R1.589 NC(=O)Nc1ccccc1[N+](=O)[O-] Amb8484888 [0,0,1,0,0,1|1,0,1]=4 1260 B13R1.589 NC(=O)Oc1ccccc1C(N)=O Amb27407073 [0,0,1,0,0,1|2,0,0]=4 1261 B13R1.589 NC(=O)Oc1ccccc1[N+](=O)[O-] Amb27861154 [0,0,1,0,0,1|1,0,1]=4 1262 B13R1.589 NC(=O)Sc1ccccc1C(=O)O Amb28041853 [0,0,1,0,0,1|1,0,1]=4 1263 B13R1.589 NC(=O)c1ccccc1CC(=O)O Amb33544363 [0,0,1,0,0,1|1,0,1]=4 1264 B13R1.1082 NC(=O)C1=C(C(N)=O)C=COC=C1 Amb28137872 [0,0,1,0,0,1|2,0,0]=4 1265 B13R2.222 O=S1(=O)C=Cc2ccccc2N1 Amb27468630 [1,0,0,0,0,1|1,0,0]=3 1266 B13R2.222 O=S1(=O)CCc2ccccc2N1 Amb25974856 [1,0,0,0,0,1|1,0,1]=4 1267 B13R2.222 O=S1(=O)Cc2ccccc2CN1 Amb27474865 [1,0,0,0,0,1|0,0,1]=3 1268 B13R2.222 O=S1(=O)N=Cc2ccccc2O1 Amb28122731 [1,0,0,0,0,1|0,0,1]=3 1269 B13R2.5152 O=C1CCS(=O)(=O)c2sccc21 Amb2422242 [0,0,0,0,1,1|2,0,0]=4 1270 B13R2.5152 O=C1CNS(=O)(=O)c2ccsc21 Amb1102722 [0,0,0,0,1,1|1,0,0]=3 1271 B13R2.5152 O=C1NNS(=O)(=O)c2occc21 Amb32671448 [0,0,0,0,1,1|1,0,0]=3 1272 B15R2.7341 CC1CNS(=O)(=O)c2ccccc2O1 Amb28247279 [0,0,0,0,0,2|1,0,1]=4 1273 B15R2.7341 C[C@@H]1CNS(=O)(=O)c2ccccc2O1 Amb27264902 [0,0,0,0,0,2|1,0,1]=4 1274 B15R2.7341 C[C@H]1CNS(=O)(=O)c2ccccc2O1 Amb26612027 [0,0,0,0,0,2|1,0,1]=4 1275 B15R2.7341 O=C1C=CS(=O)(=O)c2ccccc2N1 Amb27957594 [0,0,0,0,0,2|1,0,0]=3 1276 B15R2.7341 O=C1CCS(=O)(=O)c2ccccc2N1 Amb4479780 [0,0,0,0,0,2|1,0,0]=3 1277 B15R2.7341 O=C1CCS(=O)(=O)c2cnccc2N1 Amb27832740 [0,0,0,0,0,2|2,0,0]=4 1278 B15R2.15771 CC1COc2ccccc2S(=O)(=O)N1 Amb26917541 [0,0,0,0,0,2|1,0,1]=4 1279 B15R2.65988 CN1CCNS(=O)(=O)c2ccccc21 Amb25207369 [0,0,0,0,0,2|2,0,0]=4 1280 B15R2.65988 O=C1CCCS(=O)(=O)c2ccccc21 Amb4315359 [0,0,0,0,0,2|1,0,0]=3 1281 B15R2.65988 O=C1NCCS(=O)(=O)c2ccccc21 Amb4012667 [0,0,0,0,0,2|0,0,0]=2