0 B13R2.2975 CC(NC1CC1)c2ccc(Br)s2 Amb18289918 [0,0,0,0,0,0|1,0,1]=2 1 B13R2.2975 CC(NC1CC1)c2ccc(Cl)s2 Amb9297484 [0,0,0,0,0,0|1,1,1]=3 2 B13R2.2975 Cc1cc(C(=N)NC2CC2)cs1 Amb27198842 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.2975 Cc1cc(C(=O)CC2CC2)co1 Amb27486950 [0,0,0,0,0,0|4,0,0]=4 4 B13R2.2975 Cc1cc(C(=O)NC2CC2)co1 Amb28058260 [0,0,0,0,0,0|3,0,0]=3 5 B13R2.2975 Cc1cc(C(=O)NC2CC2)no1 Amb20513977 [0,0,0,0,0,0|4,0,0]=4 6 B13R2.2975 Cc1cc(C(=O)NC2CC2)on1 Amb20514028 [0,0,0,0,0,0|4,0,0]=4 7 B13R2.2975 Cc1ccc(C(=O)NC2CC2)o1 Amb6873881 [0,0,0,0,0,0|1,1,0]=2 8 B13R2.2975 Cc1ccc(C(=O)NC2CC2)s1 Amb6533009 [0,0,0,0,0,0|1,0,0]=1 9 B13R2.2975 Cc1ccc(C(C)NC2CC2)o1 Amb1129752 [0,0,0,0,0,0|2,1,1]=4 10 B13R2.2975 Cc1ccc(C(C)NC2CC2)s1 Amb6245876 [0,0,0,0,0,0|2,0,1]=3 11 B13R2.2975 Cc1ccc([C@@H](N)CC2CC2)s1 Amb27168626 [0,0,0,0,0,0|3,0,1]=4 12 B13R2.2975 Cc1cnc(C(=O)NC2CC2)s1 Amb28369834 [0,0,0,0,0,0|2,0,0]=2 13 B13R2.2975 Cc1cnc(C(C)NC2CC2)s1 Amb19649415 [0,0,0,0,0,0|3,0,1]=4 14 B13R2.2975 Cc1nc(C(=N)NC2CC2)cs1 Amb35622047 [0,0,0,0,0,0|4,0,0]=4 15 B13R2.2975 Cc1nc(C(=O)CC2CC2)cs1 Amb27811678 [0,0,0,0,0,0|4,0,0]=4 16 B13R2.2975 Cc1nc(C(=O)NC2CC2)cs1 Amb17025376 [0,0,0,0,0,0|3,0,0]=3 17 B13R2.2975 Cc1nnc(C(=O)NC2CC2)o1 Amb16923126 [0,0,0,0,0,0|3,1,0]=4 18 B13R2.2975 Cc1nsc(C(=O)NC2CC2)n1 Amb22702893 [0,0,0,0,0,0|4,0,0]=4 19 B13R2.2975 ClC(CC1CC1)c2ccc(Br)s2 Amb27663823 [0,0,0,0,0,0|2,0,1]=3 20 B13R2.2975 Clc1ccc(C(Cl)CC2CC2)s1 Amb28079279 [0,0,0,0,0,0|2,1,1]=4 21 B13R2.2975 Cn1ncc(C(=O)NC2CC2)n1 Amb28366299 [0,0,0,0,0,0|4,0,0]=4 22 B13R2.2975 N=C(NC1CC1)c2cc(Br)cs2 Amb28382330 [0,0,0,0,0,0|3,0,0]=3 23 B13R2.2975 N=C(NC1CC1)c2ccc(Br)s2 Amb27171900 [0,0,0,0,0,0|1,0,0]=1 24 B13R2.2975 NC(CC1CC1)c2ccc(Br)o2 Amb28133988 [0,0,0,0,0,0|2,1,1]=4 25 B13R2.2975 NC(CC1CC1)c2ccc(Cl)s2 Amb18292896 [0,0,0,0,0,0|2,1,1]=4 26 B13R2.2975 NC1C=CC(C(=O)NC2CC2)C1 Amb27194302 [0,0,0,0,0,0|2,0,2]=4 27 B13R2.2975 NC1CC=C(C(=O)NC2CC2)C1 Amb35582107 [0,0,0,0,0,0|2,0,2]=4 28 B13R2.2975 N[C@@H](CC1CC1)c2ccc(Br)s2 Amb27482862 [0,0,0,0,0,0|2,0,1]=3 29 B13R2.2975 N[C@@H](CC1CC1)c2ccc(Cl)s2 Amb27394057 [0,0,0,0,0,0|2,1,1]=4 30 B13R2.2975 Nc1cnc(C(=O)NC2CC2)s1 Amb24685015 [0,0,0,0,0,0|2,0,0]=2 31 B13R2.2975 Nc1csc(C(=O)NC2CC2)c1 Amb28246802 [0,0,0,0,0,0|3,0,0]=3 32 B13R2.2975 Nc1nc(C(=O)NC2CC2)cs1 Amb7173183 [0,0,0,0,0,0|3,0,0]=3 33 B13R2.2975 O=C(CC1CC1)c2ccc(Cl)s2 Amb18320094 [0,0,0,0,0,0|1,1,0]=2 34 B13R2.2975 O=C(CN1CC1)c2ccc(Br)s2 Amb17411495 [0,0,0,0,0,0|2,0,0]=2 35 B13R2.2975 O=C(CN1CC1)c2ccc(Cl)s2 Amb17402480 [0,0,0,0,0,0|2,1,0]=3 36 B13R2.2975 O=C(NC1CC1)c2cc(O)no2 Amb28204781 [0,0,0,0,0,0|4,0,0]=4 37 B13R2.2975 O=C(NC1CC1)c2cc(S)cs2 Amb27956310 [0,0,0,0,0,0|3,0,0]=3 38 B13R2.2975 O=C(NC1CC1)c2ccc(Br)o2 Amb6558578 [0,0,0,0,0,0|0,1,0]=1 39 B13R2.2975 O=C(NC1CC1)c2ccc(Br)s2 Amb6533489 [0,0,0,0,0,0|0,0,0]=0 40 B13R2.2975 O=C(NC1CC1)c2ccc(Cl)s2 Amb10982398 [0,0,0,0,0,0|0,1,0]=1 41 B13R2.2975 O=C(NC1CC1)c2cnc(Br)s2 Amb28240721 [0,0,0,0,0,0|1,0,0]=1 42 B13R2.2975 O=C(NC1CC1)c2csc(Br)c2 Amb9281887 [0,0,0,0,0,0|2,0,0]=2 43 B13R2.2975 O=C(NC1CC1)c2ncc(Br)s2 Amb27218818 [0,0,0,0,0,0|1,0,0]=1 44 B13R2.2975 O=C(OC1CC1)c2cc(Br)cs2 Amb27211502 [0,0,0,0,0,0|3,0,0]=3 45 B13R2.2975 O=C(OC1CC1)c2ccc(Br)o2 Amb27749084 [0,0,0,0,0,0|1,1,0]=2 46 B13R2.2975 O=C(OC1CC1)c2ccc(Cl)s2 Amb28366309 [0,0,0,0,0,0|1,1,0]=2 47 B13R2.2975 O=C(OC1CC1)c2csc(Br)c2 Amb28121993 [0,0,0,0,0,0|3,0,0]=3 48 B13R2.2975 O=C1N=C(C(=O)NC2CC2)NN1 Amb27589629 [0,0,0,0,0,0|4,0,0]=4 49 B13R2.2975 O=C1N=C(C(=O)NC2CC2)NO1 Amb27762144 [0,0,0,0,0,0|4,0,0]=4 50 B12R2.2074 CC(NC1CC1)c2ccco2 Amb10610086 [1,0,0,0,0,0|1,1,1]=4 51 B12R2.2074 CC(NC1CC1)c2ccco2 Amb1136300 [1,0,0,0,0,0|1,1,1]=4 52 B12R2.2074 CC(NC1CC1)c2cccs2 Amb1134396 [1,0,0,0,0,0|1,0,1]=3 53 B12R2.2074 CC(NC1CC1)c2cncs2 Amb27243398 [1,0,0,0,0,0|2,0,1]=4 54 B12R2.2074 CC(NC1CC1)c2nccs2 Amb18976293 [1,0,0,0,0,0|2,0,1]=4 55 B12R2.2074 Cl\C(=N/C1CC1)c2ccco2 Amb2371407 [1,0,0,0,0,0|1,1,1]=4 56 B12R2.2074 Cl\C(=N/C1CC1)c2cccs2 Amb2371276 [1,0,0,0,0,0|1,0,1]=3 57 B12R2.2074 Cl\C(=N\C1CC1)c2cccs2 Amb24471157 [1,0,0,0,0,0|1,0,1]=3 58 B12R2.2074 N=C(NC1CC1)n2cccn2 Amb27590190 [1,0,0,0,0,0|3,0,0]=4 59 B12R2.2074 NC(CC1CC1)c2cccs2 Amb18292890 [1,0,0,0,0,0|2,0,1]=4 60 B12R2.2074 N[C@H](CC1CC1)c2cccs2 Amb27412765 [1,0,0,0,0,0|2,0,1]=4 61 B12R2.2074 O=C(CC1CC1)c2ccco2 Amb18181655 [1,0,0,0,0,0|1,1,0]=3 62 B12R2.2074 O=C(CC1CC1)c2cscn2 Amb28185287 [1,0,0,0,0,0|3,0,0]=4 63 B12R2.2074 O=C(CN1CC1)c2cccs2 Amb17400239 [1,0,0,0,0,0|2,0,0]=3 64 B12R2.2074 O=C(NC1CC1)C2=CCCO2 Amb28043835 [1,0,0,0,0,0|0,1,2]=4 65 B12R2.2074 O=C(NC1CC1)C2CC=CC2 Amb27218385 [1,0,0,0,0,0|1,0,2]=4 66 B12R2.2074 O=C(NC1CC1)c2cccs2 Amb6536019 [1,0,0,0,0,0|0,0,0]=1 67 B12R2.2074 O=C(NC1CC1)c2ccsc2 Amb8339004 [1,0,0,0,0,0|2,0,0]=3 68 B12R2.2074 O=C(NC1CC1)c2cncs2 Amb28050858 [1,0,0,0,0,0|1,0,0]=2 69 B12R2.2074 O=C(NC1CC1)c2cnoc2 Amb27604050 [1,0,0,0,0,0|3,0,0]=4 70 B12R2.2074 O=C(NC1CC1)c2cnsn2 Amb28201245 [1,0,0,0,0,0|3,0,0]=4 71 B12R2.2074 O=C(NC1CC1)n2ccnc2 Amb7969918 [1,0,0,0,0,0|3,0,0]=4 72 B12R2.2074 O=C(OC1CC1)c2cocn2 Amb27163841 [1,0,0,0,0,0|3,0,0]=4 73 B12R2.2074 O=S(CC1CC1)c2cccs2 Amb28063343 [1,0,0,0,0,0|2,0,0]=3 74 B12R2.2074 O=S(CC1CC1)c2nccs2 Amb27809193 [1,0,0,0,0,0|3,0,0]=4 75 B12R2.2074 O=S(CC1CO1)c2cccs2 Amb27782259 [1,0,0,0,0,0|3,0,0]=4 76 B12R2.2074 O=S(C[C@H]1CO1)c2cccs2 Amb27768478 [1,0,0,0,0,0|3,0,0]=4 77 B12R2.2074 OC(CC1CC1)c2cccs2 Amb18180166 [1,0,0,0,0,0|1,0,2]=4 78 B12R2.2298 Brc1cc(CNC2CC2)cs1 Amb9289951 [1,0,0,0,0,0|2,0,1]=4 79 B12R2.2298 Brc1ccc(CNC2CC2)s1 Amb6242449 [1,0,0,0,0,0|0,0,1]=2 80 B12R2.2298 Brc1cnc(CNC2CC2)s1 Amb25717185 [1,0,0,0,0,0|1,0,1]=3 81 B12R2.2298 Brc1cnc(NCC2CC2)s1 Amb28065535 [1,0,0,0,0,0|3,0,0]=4 82 B12R2.2298 Brc1csc(CNC2CC2)c1 Amb32414083 [1,0,0,0,0,0|2,0,1]=4 83 B12R2.2298 Brc1csc(CNC2CC2)c1 Amb7757134 [1,0,0,0,0,0|2,0,1]=4 84 B12R2.2298 Brc1nc(CNC2CC2)cs1 Amb22274258 [1,0,0,0,0,0|2,0,1]=4 85 B12R2.2298 Cc1ccc(CNC2CC2)o1 Amb1124693 [1,0,0,0,0,0|1,1,1]=4 86 B12R2.2298 Cc1ccc(CNC2CC2)o1 Amb21959859 [1,0,0,0,0,0|1,1,1]=4 87 B12R2.2298 Cc1ccc(CNC2CC2)s1 Amb2592454 [1,0,0,0,0,0|1,0,1]=3 88 B12R2.2298 Cc1ccc(CNC2CC2)s1 Amb6865487 [1,0,0,0,0,0|1,0,1]=3 89 B12R2.2298 Cc1cnc(CNC2CC2)s1 Amb16187166 [1,0,0,0,0,0|2,0,1]=4 90 B12R2.2298 Cc1cnc(CNC2CC2)s1 Amb21959901 [1,0,0,0,0,0|2,0,1]=4 91 B12R2.2298 Cc1ncc(CNC2CC2)s1 Amb18972526 [1,0,0,0,0,0|2,0,1]=4 92 B12R2.2298 Clc1ccc(CNC2CC2)o1 Amb18289135 [1,0,0,0,0,0|0,2,1]=4 93 B12R2.2298 Clc1ccc(CNC2CC2)s1 Amb6254672 [1,0,0,0,0,0|0,1,1]=3 94 B12R2.2298 Clc1cnc(CNC2CC2)s1 Amb25149147 [1,0,0,0,0,0|1,1,1]=4 95 B12R2.2298 Clc1ncc(CNC2CC2)s1 Amb20618690 [1,0,0,0,0,0|1,1,1]=4 96 B12R2.2298 Fc1ccc(CNC2CC2)s1 Amb24269143 [1,0,0,0,0,0|0,1,1]=3 97 B12R2.2298 Fc1ccc(CNC2CC2)s1 Amb24277086 [1,0,0,0,0,0|0,1,1]=3 98 B12R2.2298 Ic1cnc(CNC2CC2)s1 Amb28125065 [1,0,0,0,0,0|1,1,1]=4 99 B12R2.2298 Nc1ccc(CNC2CC2)o1 Amb18625745 [1,0,0,0,0,0|1,1,1]=4 100 B14R2.1257 Cc1ccc(C(C#N)NC2CC2)s1 Amb18976475 [0,1,0,0,0,0|2,0,1]=4 101 B14R2.1257 N\N=C(\NC1CC1)c2ccc(Cl)o2 Amb28242498 [0,1,0,0,0,0|1,2,0]=4 102 B14R2.1257 N\N=C(\NC1CC1)c2ccc(Cl)s2 Amb27229641 [0,1,0,0,0,0|1,1,0]=3 103 B14R2.1257 OCC(NC1CC1)c2ccc(Br)s2 Amb18073376 [0,1,0,0,0,0|0,0,2]=3 104 B14R2.1257 OCC(NC1CC1)c2ccc(Cl)s2 Amb18570060 [0,1,0,0,0,0|0,1,2]=4 105 B14R2.3187 CC(NC1CC1)c2ccc(C#N)s2 Amb27975115 [0,1,0,0,0,0|2,0,1]=4 106 B14R2.3187 CCc1nc(C(=O)NC2CC2)co1 Amb28126383 [0,1,0,0,0,0|3,0,0]=4 107 B14R2.3187 CNc1ncc(C(=O)NC2CC2)s1 Amb28291987 [0,1,0,0,0,0|2,0,0]=3 108 B14R2.3187 NCc1ccc(C(=O)NC2CC2)o1 Amb5738050 [0,1,0,0,0,0|1,1,0]=3 109 B14R2.3187 NCc1ccc(C(=O)NC2CC2)s1 Amb17490939 [0,1,0,0,0,0|1,0,0]=2 110 B14R2.3187 NCc1nc(C(=O)NC2CC2)cs1 Amb27668525 [0,1,0,0,0,0|3,0,0]=4 111 B14R2.3187 NNc1nc(C(=O)NC2CC2)cs1 Amb35685793 [0,1,0,0,0,0|3,0,0]=4 112 B14R2.4369 CC(NC1CC1C)c2ccc(Cl)s2 Amb27865113 [0,1,0,0,0,0|1,1,1]=4 113 B14R2.4369 CC1CC1NC(=O)C2=CNC(=O)N2 Amb28281674 [0,1,0,0,0,0|3,0,0]=4 114 B14R2.4369 CC1CC1NC(=O)c2cc(S)cs2 Amb27661781 [0,1,0,0,0,0|3,0,0]=4 115 B14R2.4369 CC1CC1NC(=O)c2ccc(Br)o2 Amb27878411 [0,1,0,0,0,0|0,1,0]=2 116 B14R2.4369 CC1CC1NC(=O)c2ccc(Br)s2 Amb27591826 [0,1,0,0,0,0|0,0,0]=1 117 B14R2.4369 CC1CC1NC(=O)c2ccc(Cl)o2 Amb28072619 [0,1,0,0,0,0|0,2,0]=3 118 B14R2.4369 CC1CC1NC(=O)c2ccn(C)c2 Amb28063747 [0,1,0,0,0,0|3,0,0]=4 119 B14R2.4369 CC1CC1NC(=O)c2ccn(C)n2 Amb27804922 [0,1,0,0,0,0|3,0,0]=4 120 B14R2.4369 CC1CC1NC(=O)c2coc(Br)c2 Amb28187911 [0,1,0,0,0,0|2,0,0]=3 121 B14R2.4369 CC1CC1NC(=O)c2csc(Br)c2 Amb27608231 [0,1,0,0,0,0|2,0,0]=3 122 B14R2.4369 CC1CC1NC(=O)c2csc(Br)n2 Amb35735386 [0,1,0,0,0,0|2,0,0]=3 123 B14R2.4369 CC1CC1NC(=O)c2csc(Cl)c2 Amb27431259 [0,1,0,0,0,0|2,1,0]=4 124 B14R2.4369 CC1CC1NC(=O)c2nc(Cl)cs2 Amb27661744 [0,1,0,0,0,0|2,1,0]=4 125 B14R2.4369 CC1CC1NC(=O)c2ncc(Br)s2 Amb28065017 [0,1,0,0,0,0|1,0,0]=2 126 B14R2.4369 CC1CC1NC(=O)c2nnc(Cl)s2 Amb27394373 [0,1,0,0,0,0|2,1,0]=4 127 B14R2.4369 CC1CC1NC(=O)c2nnc(N)s2 Amb27826868 [0,1,0,0,0,0|3,0,0]=4 128 B14R2.4369 C[C@@H]1C[C@H]1NC(=O)c2ccc(Cl)o2 Amb27963542 [0,1,0,0,0,0|0,2,0]=3 129 B14R2.4369 C[C@@H]1C[C@H]1NC(=O)c2ccn(C)c2 Amb28320225 [0,1,0,0,0,0|3,0,0]=4 130 B14R2.4369 C[C@@H]1C[C@H]1NC(=O)c2coc(Br)c2 Amb27169571 [0,1,0,0,0,0|2,0,0]=3 131 B14R2.4369 C[C@@H]1C[C@H]1NC(=O)c2csc(Cl)n2 Amb27945060 [0,1,0,0,0,0|2,1,0]=4 132 B14R2.4369 C[C@@H]1C[C@H]1NC(=O)c2nc(Cl)cs2 Amb28455023 [0,1,0,0,0,0|2,1,0]=4 133 B14R2.4369 C[C@@H]1C[C@H]1NC(=O)c2ncc(Cl)s2 Amb27945220 [0,1,0,0,0,0|1,1,0]=3 134 B14R2.4369 Cc1cc(C(=O)NC2CC2N)cs1 Amb27648142 [0,1,0,0,0,0|3,0,0]=4 135 B14R2.4369 Cc1ccc(C(=O)NC2CC2C)o1 Amb27757126 [0,1,0,0,0,0|1,1,0]=3 136 B14R2.4369 Cc1ccc(C(=O)NC2CC2C)s1 Amb28138371 [0,1,0,0,0,0|1,0,0]=2 137 B14R2.4369 Cc1ccc(C(C)NC2CC2C)s1 Amb19064368 [0,1,0,0,0,0|2,0,1]=4 138 B14R2.4369 Cc1cnc(C(=O)N[C@@H]2C[C@H]2C)o1 Amb28436076 [0,1,0,0,0,0|2,1,0]=4 139 B14R2.4369 Cc1nc(C(=O)N[C@@H]2C[C@H]2C)co1 Amb28291936 [0,1,0,0,0,0|3,0,0]=4 140 B14R2.4369 Cc1ncc(C(=O)NC2CC2C)s1 Amb27752881 [0,1,0,0,0,0|2,0,0]=3 141 B14R2.4369 Cc1ncc(C(=O)NC2CC2N)s1 Amb27411072 [0,1,0,0,0,0|2,0,0]=3 142 B14R2.4369 Cc1nnc(C(=O)NC2CC2C)s1 Amb27396693 [0,1,0,0,0,0|3,0,0]=4 143 B14R2.4369 Cc1nnc(C(=O)N[C@@H]2C[C@H]2C)s1 Amb27945221 [0,1,0,0,0,0|3,0,0]=4 144 B14R2.4369 NC1CC1NC(=O)c2coc(Br)c2 Amb27245909 [0,1,0,0,0,0|2,0,0]=3 145 B14R2.4369 NC1CC1NC(=O)c2csc(Cl)c2 Amb27768648 [0,1,0,0,0,0|2,1,0]=4 146 B14R2.4369 NC1CC1NC(=O)c2csc(I)c2 Amb27837030 [0,1,0,0,0,0|2,1,0]=4 147 B14R2.4377 CC(NC1(C)CC1)c2ncc(Br)s2 Amb27594381 [0,1,0,0,0,0|2,0,1]=4 148 B14R2.4377 CC1(CC(=O)c2ccc(Br)o2)CC1 Amb27959991 [0,1,0,0,0,0|1,1,0]=3 149 B14R2.4377 CC1(CC(=O)c2ccc(Br)s2)CC1 Amb27620943 [0,1,0,0,0,0|1,0,0]=2 150 B14R2.4377 CC1(CC(=O)c2nc(Br)cs2)CC1 Amb27206774 [0,1,0,0,0,0|3,0,0]=4 151 B14R2.4377 CC1(CC(Cl)c2ccc(Br)s2)CC1 Amb28058760 [0,1,0,0,0,0|2,0,1]=4 152 B14R2.4377 CC1(CC(O)c2ccc(Br)s2)CC1 Amb27653845 [0,1,0,0,0,0|1,0,2]=4 153 B14R2.4377 CC1(NC(=O)C2=CSC(=O)N2)CC1 Amb27456336 [0,1,0,0,0,0|3,0,0]=4 154 B14R2.4377 CC1(NC(=O)c2ccc(Cl)o2)CC1 Amb27480499 [0,1,0,0,0,0|0,2,0]=3 155 B14R2.4377 CC1(NC(=O)c2csc(Br)n2)CC1 Amb35735384 [0,1,0,0,0,0|2,0,0]=3 156 B14R2.4377 Cc1cc(C(=O)NC2(C)CC2)co1 Amb28127450 [0,1,0,0,0,0|3,0,0]=4 157 B14R2.4377 Cc1csc(C(=O)NC2(C)CC2)n1 Amb27762254 [0,1,0,0,0,0|3,0,0]=4 158 B14R2.4377 Cc1ncc(C(=O)CC2(C)CC2)s1 Amb35648383 [0,1,0,0,0,0|3,0,0]=4 159 B14R2.4377 Cc1ncc(C(=O)CC2(N)CC2)s1 Amb29878107 [0,1,0,0,0,0|3,0,0]=4 160 B14R2.4377 Cc1nnc(C(=O)NC2(C)CC2)s1 Amb27458681 [0,1,0,0,0,0|3,0,0]=4 161 B14R2.4377 Cn1ccc(C(=O)NC2(C)CC2)c1 Amb27207247 [0,1,0,0,0,0|3,0,0]=4 162 B14R2.4377 NC1(CC(=O)c2ccc(Cl)s2)CC1 Amb27618818 [0,1,0,0,0,0|1,1,0]=3 163 B14R2.4420 Brc1cc(C(Br)CC2CC2)sc1Br Amb28281964 [0,1,0,0,0,0|2,0,1]=4 164 B14R2.4420 Cc1cc(C(=O)NC2CC2)oc1C Amb27458453 [0,1,0,0,0,0|1,1,0]=3 165 B14R2.4420 Cc1cc(C(=O)NC2CC2)sc1Br Amb27652649 [0,1,0,0,0,0|0,0,0]=1 166 B14R2.4420 Cc1cc(C(=O)NC2CC2)sc1C Amb8344528 [0,1,0,0,0,0|1,0,0]=2 167 B14R2.4420 Cc1sc(C(=O)NC2CC2)cc1N Amb18281731 [0,1,0,0,0,0|1,0,0]=2 168 B14R2.4420 ClC(CC1CC1)c2cc(Br)c(Br)s2 Amb28370445 [0,1,0,0,0,0|2,0,1]=4 169 B14R2.4420 Cn1cc(C(=O)NC2CC2)nc1Br Amb29877159 [0,1,0,0,0,0|2,0,0]=3 170 B14R2.4420 Cn1nc(C(=O)NC2CC2)cc1N Amb24270404 [0,1,0,0,0,0|3,0,0]=4 171 B14R2.4420 N[C@@H](CC1CC1)c2cc(Br)c(Br)s2 Amb28203756 [0,1,0,0,0,0|2,0,1]=4 172 B14R2.4420 O=C(CC1CC1)c2cc(Br)c(Br)s2 Amb28381721 [0,1,0,0,0,0|1,0,0]=2 173 B14R2.4420 O=C(NC1CC1)c2cc(Br)c(Br)s2 Amb328497 [0,1,0,0,0,0|0,0,0]=1 174 B14R2.4420 O=C(NC1CC1)c2cc(Br)c(Cl)o2 Amb23539530 [0,1,0,0,0,0|0,2,0]=3 175 B14R2.4420 OC(CC1CC1)c2cc(Br)c(Br)s2 Amb27979774 [0,1,0,0,0,0|1,0,2]=4 176 B14R2.4420 OC(CC1CC1)c2cc(Cl)c(Br)s2 Amb28324824 [0,1,0,0,0,0|1,0,2]=4 177 B14R2.4448 Cc1cc(C(=O)NC2CC2)c(Br)s1 Amb27599170 [0,1,0,0,0,0|3,0,0]=4 178 B14R2.4448 Cc1cc(C(=O)NC2CC2)c(C)o1 Amb10673278 [0,1,0,0,0,0|3,0,0]=4 179 B14R2.4448 Cc1cc(C(=O)NC2CC2)c(C)s1 Amb8337748 [0,1,0,0,0,0|3,0,0]=4 180 B14R2.4448 Cc1cc(C(=O)NC2CC2)c(N)s1 Amb9028384 [0,1,0,0,0,0|3,0,0]=4 181 B14R2.4448 Cc1sc(Br)nc1C(=O)NC2CC2 Amb28350954 [0,1,0,0,0,0|2,0,0]=3 182 B14R2.4448 Cn1cc(Br)cc1C(=O)NC2CC2 Amb33532284 [0,1,0,0,0,0|2,0,0]=3 183 B14R2.4448 Cn1cc(N)c(C(=O)NC2CC2)n1 Amb27663188 [0,1,0,0,0,0|3,0,0]=4 184 B14R2.4448 Cn1nc(Br)cc1C(=O)NC2CC2 Amb27977439 [0,1,0,0,0,0|3,0,0]=4 185 B14R2.4448 O=C(NC1CC1)c2cc(Br)sc2Br Amb22107371 [0,1,0,0,0,0|2,0,0]=3 186 B14R2.13608 CC(C1CC1)C(Cl)c2ccc(Br)s2 Amb27587311 [0,1,0,0,0,0|2,0,1]=4 187 B14R2.13608 CC(C1CC1)C(N)c2ccc(Br)s2 Amb27801844 [0,1,0,0,0,0|2,0,1]=4 188 B14R2.13608 CC(c1ccc(Cl)s1)N(C)C2CC2 Amb27188801 [0,1,0,0,0,0|1,1,1]=4 189 B14R2.13608 CN(C(=O)c1cc(Cl)cs1)C2CC2 Amb27586149 [0,1,0,0,0,0|2,1,0]=4 190 B14R2.13608 CN(C(=O)c1cc(N)cs1)C2CC2 Amb28246803 [0,1,0,0,0,0|3,0,0]=4 191 B14R2.13608 CN(C(=O)c1csc(Br)n1)C2CC2 Amb35735381 [0,1,0,0,0,0|2,0,0]=3 192 B14R2.13608 CN(C(=O)c1csc(Cl)n1)C2CC2 Amb27853406 [0,1,0,0,0,0|2,1,0]=4 193 B14R2.13608 CN(C(=O)c1nc(Br)cs1)C2CC2 Amb27396741 [0,1,0,0,0,0|2,0,0]=3 194 B14R2.13608 CN(C(=O)c1nc(Cl)cs1)C2CC2 Amb27650018 [0,1,0,0,0,0|2,1,0]=4 195 B14R2.13608 CN(C(=O)c1nnc(Cl)s1)C2CC2 Amb27609481 [0,1,0,0,0,0|2,1,0]=4 196 B14R2.13608 CN(C(=O)c1nnc(N)s1)C2CC2 Amb27207500 [0,1,0,0,0,0|3,0,0]=4 197 B14R2.13608 Cc1cc(C(=O)N(C)C2CC2)co1 Amb28051011 [0,1,0,0,0,0|3,0,0]=4 198 B14R2.13608 Cc1cc(C(=O)N(C)C2CC2)cs1 Amb27605047 [0,1,0,0,0,0|3,0,0]=4 199 B14R2.13608 Cc1ccc(C(=O)C(C)C2CC2)s1 Amb27649517 [0,1,0,0,0,0|2,0,0]=3 200 B14R2.13608 Cc1csc(C(=O)N(C)C2CC2)n1 Amb27766297 [0,1,0,0,0,0|3,0,0]=4 201 B14R2.13608 Cc1ncc(C(=O)C(C)C2CC2)s1 Amb35590198 [0,1,0,0,0,0|3,0,0]=4 202 B14R2.13608 Cc1ncc(C(=O)C(N)C2CC2)s1 Amb29878303 [0,1,0,0,0,0|3,0,0]=4 203 B14R2.13608 Cc1ncc(C(=O)C(O)C2CC2)s1 Amb35636176 [0,1,0,0,0,0|3,0,0]=4 204 B14R2.13608 Cc1ncc(C(=O)N(C)C2CC2)s1 Amb28078701 [0,1,0,0,0,0|2,0,0]=3 205 B14R2.13608 N[C@H](c1ccc(Br)s1)[C@@H](O)C2CC2 Amb27422178 [0,1,0,0,0,0|2,0,1]=4 206 B14R2.13608 O=C(c1ccc(Cl)s1)C(O)C2CC2 Amb28242417 [0,1,0,0,0,0|1,1,0]=3 207 B14R2.20674 Cc1ccc(S(=O)(=O)NC2CC2)s1 Amb5350169 [0,1,0,0,0,0|2,0,0]=3 208 B14R2.20674 Cc1ncc(S(=O)(=O)NC2CC2)s1 Amb23599151 [0,1,0,0,0,0|3,0,0]=4 209 B14R2.20674 Nc1ncc(S(=O)(=O)NC2CC2)s1 Amb23598616 [0,1,0,0,0,0|3,0,0]=4 210 B14R2.20674 O=S(=O)(CC1CC1)c2ccc(Br)s2 Amb13883842 [0,1,0,0,0,0|2,0,0]=3 211 B14R2.21101 Cc1scc(C(=O)NC2CC2)c1C Amb27260185 [0,1,0,0,0,0|3,0,0]=4 212 B14R2.21101 Cn1c(C(=O)NC2CC2)cnc1Cl Amb35595707 [0,1,0,0,0,0|2,1,0]=4 213 B12R1.29 C#CCCC(=O)c1ccc(Br)s1 Amb27808241 [0,0,1,0,0,0|1,0,2]=4 214 B12R1.29 C#CCNC(=O)c1ccc(Br)o1 Amb6598988 [0,0,1,0,0,0|0,1,2]=4 215 B12R1.29 C=CCNC(=O)c1ccc(Br)o1 Amb3106012 [0,0,1,0,0,0|0,1,2]=4 216 B12R1.29 C=CCNC(=O)c1ccc(Br)s1 Amb1419257 [0,0,1,0,0,0|0,0,2]=3 217 B12R1.29 C=CCNC(=O)c1ncc(Br)s1 Amb27457501 [0,0,1,0,0,0|1,0,2]=4 218 B12R1.29 CC#CCC(=O)c1ccc(Br)s1 Amb27808243 [0,0,1,0,0,0|1,0,2]=4 219 B12R1.29 CC(NCCO)c1ccc(Br)s1 Amb33362386 [0,0,1,0,0,0|2,0,1]=4 220 B12R1.29 CC(NCCO)c1ccc(Br)s1 Amb33362387 [0,0,1,0,0,0|2,0,1]=4 221 B12R1.29 CCCCC(=O)c1ccc(Br)s1 Amb17196414 [0,0,1,0,0,0|1,0,0]=2 222 B12R1.29 CCCCC(=O)c1ccc(Cl)s1 Amb8851123 [0,0,1,0,0,0|1,1,0]=3 223 B12R1.29 CCCCC(N)c1ccc(Br)s1 Amb17196470 [0,0,1,0,0,0|2,0,1]=4 224 B12R1.29 CCCCC(O)c1ccc(Br)s1 Amb17196552 [0,0,1,0,0,0|1,0,2]=4 225 B12R1.29 CCCNC(=N)c1cc(Br)cs1 Amb27607338 [0,0,1,0,0,0|3,0,0]=4 226 B12R1.29 CCCNC(=N)c1ccc(Br)s1 Amb27465500 [0,0,1,0,0,0|1,0,0]=2 227 B12R1.29 CCCNC(=O)C1=CNC(=O)N1 Amb24748028 [0,0,1,0,0,0|3,0,0]=4 228 B12R1.29 CCCNC(=O)c1cc(Br)cs1 Amb14364478 [0,0,1,0,0,0|2,0,0]=3 229 B12R1.29 CCCNC(=O)c1cc(Cl)cs1 Amb28187849 [0,0,1,0,0,0|2,1,0]=4 230 B12R1.29 CCCNC(=O)c1ccc(Br)o1 Amb6512905 [0,0,1,0,0,0|0,1,0]=2 231 B12R1.29 CCCNC(=O)c1ccc(Br)s1 Amb2111187 [0,0,1,0,0,0|0,0,0]=1 232 B12R1.29 CCCNC(=O)c1ccc(Cl)o1 Amb8331878 [0,0,1,0,0,0|0,2,0]=3 233 B12R1.29 CCCNC(=O)c1ccn(C)c1 Amb28190143 [0,0,1,0,0,0|3,0,0]=4 234 B12R1.29 CCCNC(=O)c1coc(C)n1 Amb8483755 [0,0,1,0,0,0|3,0,0]=4 235 B12R1.29 CCCNC(=O)c1csc(Br)c1 Amb9179904 [0,0,1,0,0,0|2,0,0]=3 236 B12R1.29 CCCNC(=O)c1csc(Br)n1 Amb35735371 [0,0,1,0,0,0|2,0,0]=3 237 B12R1.29 CCCNC(=O)c1csc(Cl)c1 Amb27178827 [0,0,1,0,0,0|2,1,0]=4 238 B12R1.29 CCCNC(=O)c1csc(Cl)n1 Amb28382119 [0,0,1,0,0,0|2,1,0]=4 239 B12R1.29 CCCNC(=O)c1csc(N)n1 Amb7173181 [0,0,1,0,0,0|3,0,0]=4 240 B12R1.29 CCCNC(=O)c1ncc(C)o1 Amb28344862 [0,0,1,0,0,0|2,1,0]=4 241 B12R1.29 CCCNC(=O)c1ncc(N)s1 Amb25795421 [0,0,1,0,0,0|2,0,0]=3 242 B12R1.29 CCCNC(=O)c1nnc(Cl)s1 Amb28201321 [0,0,1,0,0,0|2,1,0]=4 243 B12R1.29 CCCNC(C)c1ccc(Br)s1 Amb33044410 [0,0,1,0,0,0|1,0,1]=3 244 B12R1.29 CCCNC(C)c1ccc(C)s1 Amb6267666 [0,0,1,0,0,0|2,0,1]=4 245 B12R1.29 CCCOC(=O)c1csc(Br)c1 Amb33550804 [0,0,1,0,0,0|3,0,0]=4 246 B12R1.29 CCNCC(=O)c1ccc(Br)s1 Amb17351530 [0,0,1,0,0,0|2,0,0]=3 247 B12R1.29 CCNCC(=O)c1ccc(Cl)s1 Amb17338046 [0,0,1,0,0,0|2,1,0]=4 248 B12R1.29 CCNNC(=O)c1ccc(Cl)s1 Amb27770808 [0,0,1,0,0,0|1,1,0]=3 249 B12R1.29 CCONC(=O)c1cc(Br)cs1 Amb14373946 [0,0,1,0,0,0|3,0,0]=4 250 B12R1.29 CCONC(=O)c1ccc(Br)o1 Amb8295303 [0,0,1,0,0,0|1,1,0]=3 251 B12R1.29 CCONC(=O)c1ccc(Br)s1 Amb27227953 [0,0,1,0,0,0|1,0,0]=2 252 B12R1.29 CCONC(=O)c1ccc(Cl)s1 Amb27875757 [0,0,1,0,0,0|1,1,0]=3 253 B12R1.29 CCONC(=O)c1coc(Br)c1 Amb8266853 [0,0,1,0,0,0|3,0,0]=4 254 B12R1.29 CCONC(=O)c1csc(Br)n1 Amb35735374 [0,0,1,0,0,0|3,0,0]=4 255 B12R1.29 CCONC(=O)c1ncc(Cl)s1 Amb27854145 [0,0,1,0,0,0|2,1,0]=4 256 B12R1.29 CNCCC(=O)c1ccc(Br)s1 Amb17351531 [0,0,1,0,0,0|2,0,0]=3 257 B12R1.29 CNCCC(=O)c1ccc(Cl)s1 Amb17338047 [0,0,1,0,0,0|2,1,0]=4 258 B12R1.29 CNC\C=C(/C)c1ccc(Br)s1 Amb31140261 [0,0,1,0,0,0|3,0,0]=4 259 B12R1.29 C\C(=C/CCCl)c1ccc(Br)s1 Amb17271960 [0,0,1,0,0,0|3,0,0]=4 260 B12R1.29 C\C(=C/CCN)c1ccc(Br)s1 Amb17258167 [0,0,1,0,0,0|3,0,0]=4 261 B12R1.29 Cc1ccc(C(=O)NCC#N)s1 Amb18796252 [0,0,1,0,0,0|2,0,1]=4 262 B12R1.29 Cc1ccc(C(=O)NCCI)o1 Amb27643119 [0,0,1,0,0,0|2,1,0]=4 263 B12R1.29 Cc1ccc(C(=O)NCCI)s1 Amb28066830 [0,0,1,0,0,0|2,0,0]=3 264 B12R1.29 Cc1ccc(C(=O)NCCN)s1 Amb6253494 [0,0,1,0,0,0|2,0,0]=3 265 B12R1.29 Cc1ccc(C(=O)NCCS)s1 Amb27458692 [0,0,1,0,0,0|2,0,0]=3 266 B12R1.29 Cc1ncc(C(=O)NCCF)s1 Amb27261203 [0,0,1,0,0,0|3,0,0]=4 267 B12R1.29 Cc1ncc(C(=O)NCCI)s1 Amb27395566 [0,0,1,0,0,0|3,0,0]=4 268 B12R1.29 N#CCCC(=O)c1ccc(Br)s1 Amb17256935 [0,0,1,0,0,0|2,0,1]=4 269 B12R1.29 NCCNC(=O)c1ccc(Br)o1 Amb1127301 [0,0,1,0,0,0|1,1,0]=3 270 B12R1.29 NCCNC(=O)c1csc(Br)n1 Amb35735372 [0,0,1,0,0,0|3,0,0]=4 271 B12R1.29 Nc1ccc(C(=O)NCCO)o1 Amb18625465 [0,0,1,0,0,0|2,1,0]=4 272 B12R1.29 Nc1ncc(C(=O)NCCO)s1 Amb22899143 [0,0,1,0,0,0|3,0,0]=4 273 B12R1.29 O=C(CCCBr)c1ccc(Cl)s1 Amb17273039 [0,0,1,0,0,0|2,1,0]=4 274 B12R1.29 O=C(CCCCl)c1ccc(Br)s1 Amb17197364 [0,0,1,0,0,0|2,0,0]=3 275 B12R1.29 O=C(CCCCl)c1ccc(Cl)s1 Amb17195533 [0,0,1,0,0,0|2,1,0]=4 276 B12R1.29 O=C(CCCO)c1ccc(Br)s1 Amb17351973 [0,0,1,0,0,0|2,0,0]=3 277 B12R1.29 O=C(CCCO)c1ccc(Cl)s1 Amb17338208 [0,0,1,0,0,0|2,1,0]=4 278 B12R1.29 O=C(NCCBr)c1ccc(Cl)o1 Amb27811703 [0,0,1,0,0,0|1,2,0]=4 279 B12R1.29 O=C(NCCCl)c1ccc(Cl)s1 Amb28041924 [0,0,1,0,0,0|1,1,0]=3 280 B12R1.29 O=C(NCCCl)c1csc(Br)c1 Amb27830843 [0,0,1,0,0,0|3,0,0]=4 281 B12R1.29 O=C(NCCF)c1cc(Br)cs1 Amb27826057 [0,0,1,0,0,0|3,0,0]=4 282 B12R1.29 O=C(NCCF)c1ccc(Br)s1 Amb27865916 [0,0,1,0,0,0|1,0,0]=2 283 B12R1.29 O=C(NCCF)c1ccc(Cl)s1 Amb27980050 [0,0,1,0,0,0|1,1,0]=3 284 B12R1.29 O=C(NCCF)c1csc(Br)n1 Amb35735375 [0,0,1,0,0,0|3,0,0]=4 285 B12R1.29 O=C(NCCI)c1ccc(Cl)s1 Amb27416684 [0,0,1,0,0,0|1,1,0]=3 286 B12R1.29 O=C(NCCI)c1coc(Br)c1 Amb27226571 [0,0,1,0,0,0|3,0,0]=4 287 B12R1.29 O=C(NCCO)c1cc(Br)cs1 Amb18228394 [0,0,1,0,0,0|3,0,0]=4 288 B12R1.29 O=C(NCCO)c1ccc(Br)s1 Amb9242325 [0,0,1,0,0,0|1,0,0]=2 289 B12R1.29 O=C(NCCO)c1ccc(Cl)o1 Amb9248726 [0,0,1,0,0,0|1,2,0]=4 290 B12R1.29 O=C(NCCO)c1ccc(Cl)s1 Amb9242287 [0,0,1,0,0,0|1,1,0]=3 291 B12R1.29 O=C(NCCO)c1ncc(Br)s1 Amb27857385 [0,0,1,0,0,0|2,0,0]=3 292 B12R1.29 O=C(NCCS)c1ccc(Cl)s1 Amb27178631 [0,0,1,0,0,0|1,1,0]=3 293 B12R1.103 CC(=O)CC(=O)c1ccc(Br)s1 Amb2700227 [0,0,1,0,0,0|2,0,1]=4 294 B12R1.103 CC(=O)NC(=O)c1ccc(Br)s1 Amb27264904 [0,0,1,0,0,0|1,0,1]=3 295 B12R1.103 CC(C)=CC(=O)c1ccc(Br)o1 Amb27628901 [0,0,1,0,0,0|1,1,1]=4 296 B12R1.103 CC(C)=CC(=O)c1ccc(C)s1 Amb27474603 [0,0,1,0,0,0|2,0,1]=4 297 B12R1.103 CC(C)CC(=O)C1=CNC(=O)S1 Amb27614684 [0,0,1,0,0,0|3,0,0]=4 298 B12R1.103 CC(C)CC(=O)c1cc(Br)cs1 Amb18899702 [0,0,1,0,0,0|3,0,0]=4 299 B12R1.103 CC(C)CC(=O)c1ccc(Br)s1 Amb17196415 [0,0,1,0,0,0|1,0,0]=2 300 B12R1.103 CC(C)CC(=O)c1ccc(Cl)s1 Amb8851175 [0,0,1,0,0,0|1,1,0]=3 301 B12R1.103 CC(C)CC(=O)c1ccc(N)o1 Amb18140474 [0,0,1,0,0,0|2,1,0]=4 302 B12R1.103 CC(C)CC(=O)c1csc(Br)c1 Amb27486948 [0,0,1,0,0,0|3,0,0]=4 303 B12R1.103 CC(C)CC(=O)c1nc(Br)cs1 Amb27439838 [0,0,1,0,0,0|3,0,0]=4 304 B12R1.103 CC(C)CC(N)c1ccc(Br)s1 Amb17196469 [0,0,1,0,0,0|2,0,1]=4 305 B12R1.103 CC(C)CC(O)c1ccc(Br)s1 Amb17196551 [0,0,1,0,0,0|1,0,2]=4 306 B12R1.103 CC(C)NC(=O)c1cc(N)cs1 Amb28200617 [0,0,1,0,0,0|3,0,0]=4 307 B12R1.103 CC(C)NC(=O)c1cc(S)cs1 Amb27835588 [0,0,1,0,0,0|3,0,0]=4 308 B12R1.103 CC(C)NC(=O)c1ccc(Br)o1 Amb6881669 [0,0,1,0,0,0|0,1,0]=2 309 B12R1.103 CC(C)NC(=O)c1ccc(Br)s1 Amb2111188 [0,0,1,0,0,0|0,0,0]=1 310 B12R1.103 CC(C)NC(=O)c1ccc(Cl)o1 Amb8332952 [0,0,1,0,0,0|0,2,0]=3 311 B12R1.103 CC(C)NC(=O)c1ccc(N)s1 Amb27845159 [0,0,1,0,0,0|1,0,0]=2 312 B12R1.103 CC(C)NC(=O)c1ccn(C)n1 Amb27469478 [0,0,1,0,0,0|3,0,0]=4 313 B12R1.103 CC(C)NC(=O)c1cnc(N)s1 Amb17490795 [0,0,1,0,0,0|2,0,0]=3 314 B12R1.103 CC(C)NC(=O)c1csc(N)n1 Amb7173182 [0,0,1,0,0,0|3,0,0]=4 315 B12R1.103 CC(C)NC(=O)c1ncc(Br)s1 Amb27981387 [0,0,1,0,0,0|1,0,0]=2 316 B12R1.103 CC(C)NC(=O)c1ncc(N)s1 Amb27144413 [0,0,1,0,0,0|2,0,0]=3 317 B12R1.103 CC(C)NC(=O)c1nnc(N)s1 Amb25226521 [0,0,1,0,0,0|3,0,0]=4 318 B12R1.103 CC(C)NC(C)c1ccc(Br)s1 Amb18289920 [0,0,1,0,0,0|1,0,1]=3 319 B12R1.103 CC(C)NC(C)c1ccc(Cl)s1 Amb9297500 [0,0,1,0,0,0|1,1,1]=4 320 B12R1.103 CC(C)N[C@@H](C)c1ccc(Br)s1 Amb27661950 [0,0,1,0,0,0|1,0,1]=3 321 B12R1.103 CC(C)N[C@H](C)c1ccc(Br)s1 Amb27980254 [0,0,1,0,0,0|1,0,1]=3 322 B12R1.103 CC(C)OC(=O)c1cc(Br)cs1 Amb25285506 [0,0,1,0,0,0|3,0,0]=4 323 B12R1.103 CC(C)OC(=O)c1ccc(Br)o1 Amb26336730 [0,0,1,0,0,0|1,1,0]=3 324 B12R1.103 CC(C)OC(=O)c1ccc(Br)s1 Amb18277411 [0,0,1,0,0,0|1,0,0]=2 325 B12R1.103 CC(C)OC(=O)c1ccc(Cl)o1 Amb27174386 [0,0,1,0,0,0|1,2,0]=4 326 B12R1.103 CC(C)OC(=O)c1ccc(Cl)s1 Amb25355268 [0,0,1,0,0,0|1,1,0]=3 327 B12R1.103 CC(C)OC(=O)c1ccc(N)s1 Amb17109297 [0,0,1,0,0,0|2,0,0]=3 328 B12R1.103 CC(C)OC(=O)c1cnc(N)s1 Amb24485528 [0,0,1,0,0,0|3,0,0]=4 329 B12R1.103 CC(C)OC(=O)c1coc(Br)c1 Amb26010356 [0,0,1,0,0,0|3,0,0]=4 330 B12R1.103 CC(C)OC(=O)c1csc(Br)n1 Amb35724005 [0,0,1,0,0,0|3,0,0]=4 331 B12R1.103 CC(N)CC(=O)c1ccc(Br)s1 Amb27263499 [0,0,1,0,0,0|2,0,0]=3 332 B12R1.103 CC(NN(C)C)c1ccc(Br)s1 Amb27587759 [0,0,1,0,0,0|2,0,1]=4 333 B12R1.103 CN(C)CC(=O)c1ccc(Br)s1 Amb9661106 [0,0,1,0,0,0|2,0,0]=3 334 B12R1.103 CN(C)CC(=O)c1ccc(Cl)s1 Amb9661119 [0,0,1,0,0,0|2,1,0]=4 335 B12R1.103 CN(C)NC(=O)c1coc(Br)c1 Amb28126457 [0,0,1,0,0,0|3,0,0]=4 336 B12R1.103 CN(C)NC(=O)c1csc(Br)n1 Amb35735373 [0,0,1,0,0,0|3,0,0]=4 337 B12R1.103 Cc1cc(C(=O)NC(C)C)co1 Amb27796049 [0,0,1,0,0,0|3,0,0]=4 338 B12R1.103 Cc1ccc(C(=O)CC(C)C)s1 Amb8850951 [0,0,1,0,0,0|2,0,0]=3 339 B12R1.103 Cc1ccc(C(=O)CN(C)C)s1 Amb9661110 [0,0,1,0,0,0|3,0,0]=4 340 B12R1.103 Cc1ccc(C(=O)NC(C)C)o1 Amb17797363 [0,0,1,0,0,0|1,1,0]=3 341 B12R1.103 Cc1ccc(C(=O)NC(C)C)s1 Amb2650324 [0,0,1,0,0,0|1,0,0]=2 342 B12R1.103 Cc1ccc(C(=O)NN(C)C)o1 Amb1039955 [0,0,1,0,0,0|2,1,0]=4 343 B12R1.103 Cc1ccc(C(=O)NN(C)C)s1 Amb27833403 [0,0,1,0,0,0|2,0,0]=3 344 B12R1.103 Cc1ccc(C(C)NC(C)C)s1 Amb6685547 [0,0,1,0,0,0|2,0,1]=4 345 B12R1.103 Cc1nc(C(=O)NC(C)C)co1 Amb8483756 [0,0,1,0,0,0|3,0,0]=4 346 B12R1.103 Cc1ncc(C(=O)NC(C)C)s1 Amb19305130 [0,0,1,0,0,0|2,0,0]=3 347 B12R2.2299 Cc1cc(C(=O)C2CC2)co1 Amb27978037 [0,0,0,0,1,0|3,0,0]=4 348 B12R2.2299 Cc1ccc(C(=O)C2CC2)o1 Amb18181656 [0,0,0,0,1,0|1,1,0]=3 349 B12R2.2299 Cc1cnc(C(=O)C2CC2)s1 Amb19649370 [0,0,0,0,1,0|2,0,0]=3 350 B12R2.2299 Cc1csc(C(=O)C2CC2)c1 Amb27458825 [0,0,0,0,1,0|3,0,0]=4 351 B12R2.2299 Cc1csc(C(=O)C2CC2)n1 Amb19649364 [0,0,0,0,1,0|3,0,0]=4 352 B12R2.2299 Cc1ncc(C(=O)C2CC2)s1 Amb27222168 [0,0,0,0,1,0|2,0,0]=3 353 B12R2.2299 Cn1ccc(C(=O)C2CC2)c1 Amb18563444 [0,0,0,0,1,0|3,0,0]=4 354 B12R2.2299 NC(c1ccc(Br)s1)C2CC2 Amb3790052 [0,0,0,0,1,0|1,0,1]=3 355 B12R2.2299 NC(c1ccc(Cl)s1)C2CC2 Amb3788416 [0,0,0,0,1,0|1,1,1]=4 356 B12R2.2299 NC(c1ccc(F)s1)C2CC2 Amb28240382 [0,0,0,0,1,0|1,1,1]=4 357 B12R2.2299 N[C@@H](c1ccc(Cl)s1)C2CC2 Amb27817814 [0,0,0,0,1,0|1,1,1]=4 358 B12R2.2299 N[C@@H](c1ccc(F)s1)C2CC2 Amb27184080 [0,0,0,0,1,0|1,1,1]=4 359 B12R2.2299 N[C@H](c1ccc(Br)o1)C2CC2 Amb28119318 [0,0,0,0,1,0|1,1,1]=4 360 B12R2.2299 Nc1ccc(C(=O)C2CC2)o1 Amb18140469 [0,0,0,0,1,0|1,1,0]=3 361 B12R2.2299 Nc1ccc([C@@H](N)C2CC2)s1 Amb27948029 [0,0,0,0,1,0|2,0,1]=4 362 B12R2.2299 O=C(c1cc(Br)cs1)C2CC2 Amb18070365 [0,0,0,0,1,0|2,0,0]=3 363 B12R2.2299 O=C(c1ccc(Br)o1)C2CC2 Amb18144087 [0,0,0,0,1,0|0,1,0]=2 364 B12R2.2299 O=C(c1ccc(Br)s1)C2CC2 Amb17195749 [0,0,0,0,1,0|0,0,0]=1 365 B12R2.2299 O=C(c1ccc(Cl)s1)C2CC2 Amb8851178 [0,0,0,0,1,0|0,1,0]=2 366 B12R2.2299 O=C(c1csc(Br)c1)N2CC2 Amb28454598 [0,0,0,0,1,0|3,0,0]=4 367 B12R2.2299 O=C(c1nc(Br)cs1)C2CC2 Amb26652321 [0,0,0,0,1,0|2,0,0]=3 368 B12R2.2299 OC(c1ccc(Br)o1)C2CC2 Amb27661275 [0,0,0,0,1,0|0,1,2]=4 369 B12R2.2299 OC(c1ccc(Br)s1)C2CC2 Amb17195847 [0,0,0,0,1,0|0,0,2]=3 370 B12R2.2299 OC(c1ccc(Cl)s1)C2CC2 Amb17194594 [0,0,0,0,1,0|0,1,2]=4 371 B14R2.933 CC(NC1CC1)c2ccc(Br)cc2 Amb1131598 [0,0,0,0,0,1|2,0,1]=4 372 B14R2.933 CC(NC1CC1)c2ccc(Br)cn2 Amb27661740 [0,0,0,0,0,1|2,0,1]=4 373 B14R2.933 Cc1ccc(C(=O)NC2CC2)cn1 Amb8332932 [0,0,0,0,0,1|2,0,0]=3 374 B14R2.933 Cc1ccc(C(=O)NC2CC2)nc1 Amb28183978 [0,0,0,0,0,1|2,0,0]=3 375 B14R2.933 Cc1ccc(C(=O)NC2CC2)nn1 Amb27441497 [0,0,0,0,0,1|2,0,0]=3 376 B14R2.933 Cc1ccc(S(=O)NC2CC2)cc1 Amb28139754 [0,0,0,0,0,1|3,0,0]=4 377 B14R2.933 N=C(NC1CC1)c2ccc(Br)cn2 Amb28044640 [0,0,0,0,0,1|2,0,0]=3 378 B14R2.933 N=C(NC1CC1)c2ccc(F)cc2 Amb28382690 [0,0,0,0,0,1|2,1,0]=4 379 B14R2.933 N=C(NC1CC1)c2ccc(O)nc2 Amb35675418 [0,0,0,0,0,1|3,0,0]=4 380 B14R2.933 Nc1ccc(C(=O)CC2CC2)cc1 Amb27766140 [0,0,0,0,0,1|3,0,0]=4 381 B14R2.933 Nc1ccc(C(=O)NC2CC2)cc1 Amb1995072 [0,0,0,0,0,1|2,0,0]=3 382 B14R2.933 Nc1ccc(C(=O)NC2CC2)cn1 Amb18958808 [0,0,0,0,0,1|2,0,0]=3 383 B14R2.933 Nc1ccc(C(=O)NC2CC2)nc1 Amb26975323 [0,0,0,0,0,1|2,0,0]=3 384 B14R2.933 Nc1ccc(S(=O)NC2CC2)cc1 Amb18224934 [0,0,0,0,0,1|3,0,0]=4 385 B14R2.933 Nc1ncc(C(=O)NC2CC2)cn1 Amb27852657 [0,0,0,0,0,1|3,0,0]=4 386 B14R2.933 O=C(CC1CC1)c2ccc(Br)cc2 Amb27161575 [0,0,0,0,0,1|2,0,0]=3 387 B14R2.933 O=C(CC1CC1)c2ccc(Cl)cc2 Amb18321296 [0,0,0,0,0,1|2,1,0]=4 388 B14R2.933 O=C(CC1CC1)c2ccc(F)cc2 Amb18795999 [0,0,0,0,0,1|2,1,0]=4 389 B14R2.933 O=C(CN1CC1)c2ccc(Br)cc2 Amb17410189 [0,0,0,0,0,1|3,0,0]=4 390 B14R2.933 O=C(NC1CC1)c2ccc(Br)cc2 Amb1233625 [0,0,0,0,0,1|1,0,0]=2 391 B14R2.933 O=C(NC1CC1)c2ccc(Br)cn2 Amb10068264 [0,0,0,0,0,1|1,0,0]=2 392 B14R2.933 O=C(NC1CC1)c2ccc(Br)nc2 Amb25758929 [0,0,0,0,0,1|1,0,0]=2 393 B14R2.933 O=C(NC1CC1)c2ccc(Cl)cc2 Amb6531409 [0,0,0,0,0,1|1,1,0]=3 394 B14R2.933 O=C(NC1CC1)c2ccc(Cl)cn2 Amb25706456 [0,0,0,0,0,1|1,1,0]=3 395 B14R2.933 O=C(NC1CC1)c2ccc(Cl)nc2 Amb1677737 [0,0,0,0,0,1|1,1,0]=3 396 B14R2.933 O=C(NC1CC1)c2ccc(Cl)nn2 Amb19054910 [0,0,0,0,0,1|1,1,0]=3 397 B14R2.933 O=C(NC1CC1)c2ccc(F)cc2 Amb6530999 [0,0,0,0,0,1|1,1,0]=3 398 B14R2.933 O=C(NC1CC1)c2ccc(I)cc2 Amb1548062 [0,0,0,0,0,1|1,1,0]=3 399 B14R2.933 O=C(NC1CC1)c2ccc(O)cc2 Amb6671602 [0,0,0,0,0,1|2,0,0]=3 400 B14R2.933 O=C(OC1CC1)c2ccc(Br)cn2 Amb28065440 [0,0,0,0,0,1|2,0,0]=3 401 B14R2.933 O=C(OC1CC1)c2ccc(Cl)cc2 Amb27256029 [0,0,0,0,0,1|2,1,0]=4 402 B14R2.933 O=C(OC1CC1)c2ccc(I)cc2 Amb28140530 [0,0,0,0,0,1|2,1,0]=4 403 B14R2.933 O=C1C=CC(C(=O)NC2CC2)=CN1 Amb18186152 [0,0,0,0,0,1|2,0,0]=3 404 B14R2.933 O=C1C=CC(C(=O)NC2CC2)=CO1 Amb27479325 [0,0,0,0,0,1|1,1,0]=3 405 B14R2.933 O=C1C=NC(C(=O)NC2CC2)=CN1 Amb27958539 [0,0,0,0,0,1|3,0,0]=4 406 B14R2.4389 CC(Cc1ccc(Br)s1)NC2CC2 Amb18230045 [0,0,0,0,0,1|1,0,1]=3 407 B14R2.4389 CC(Cc1ccc(Cl)s1)NC2CC2 Amb18225459 [0,0,0,0,0,1|1,1,1]=4 408 B14R2.4389 Cc1cnc(NC(=O)CC2CC2)s1 Amb28127454 [0,0,0,0,0,1|3,0,0]=4 409 B14R2.4389 Cc1csc(NC(=O)NC2CC2)n1 Amb27802355 [0,0,0,0,0,1|3,0,0]=4 410 B14R2.4389 Cc1nc(CC(=O)NC2CC2)cs1 Amb13958022 [0,0,0,0,0,1|3,0,0]=4 411 B14R2.4389 Cc1ncc(NC(=O)NC2CC2)s1 Amb27254927 [0,0,0,0,0,1|2,0,0]=3 412 B14R2.4389 Nc1ccn(CC(=O)NC2CC2)n1 Amb18295515 [0,0,0,0,0,1|3,0,0]=4 413 B14R2.4389 Nc1nc(CC(=O)NC2CC2)cs1 Amb7173175 [0,0,0,0,0,1|3,0,0]=4 414 B14R2.4389 O=C(CC1CC1)Nc2ncc(Cl)s2 Amb27255935 [0,0,0,0,0,1|2,1,0]=4 415 B14R2.4389 O=C(CC1CC1)Nc2ncc(F)s2 Amb27826055 [0,0,0,0,0,1|2,1,0]=4 416 B14R2.4389 O=C(Cc1ccc(Br)s1)NC2CC2 Amb27586132 [0,0,0,0,0,1|0,0,0]=1 417 B14R2.4389 O=C(Cn1ccc(Cl)n1)NC2CC2 Amb27599157 [0,0,0,0,0,1|2,1,0]=4 418 B14R2.4389 O=C(Nc1ncc(Br)s1)NC2CC2 Amb27812413 [0,0,0,0,0,1|1,0,0]=2 419 B14R2.4389 O=C(Nc1ncc(Cl)s1)NC2CC2 Amb27762198 [0,0,0,0,0,1|1,1,0]=3 420 B14R2.4396 CC(NCC1CC1)c2ccc(Br)s2 Amb33044416 [0,0,0,0,0,1|1,0,1]=3 421 B14R2.4396 C\C(=N\NC1CC1)c2ccc(Cl)s2 Amb27388396 [0,0,0,0,0,1|1,1,0]=3 422 B14R2.4396 Cc1ccc(C(=O)NCC2CC2)s1 Amb8337489 [0,0,0,0,0,1|1,0,0]=2 423 B14R2.4396 Cc1cnc(C(=O)NCC2CC2)o1 Amb28350932 [0,0,0,0,0,1|2,1,0]=4 424 B14R2.4396 Cc1nc(C(=O)NCC2CC2)co1 Amb27260029 [0,0,0,0,0,1|3,0,0]=4 425 B14R2.4396 Cc1nnc(C(=O)NCC2CC2)s1 Amb27981606 [0,0,0,0,0,1|3,0,0]=4 426 B14R2.4396 Cn1ccc(C(=O)CNC2CC2)c1 Amb18893623 [0,0,0,0,0,1|3,0,0]=4 427 B14R2.4396 Cn1ccc(C(=O)NCC2CC2)c1 Amb28139458 [0,0,0,0,0,1|3,0,0]=4 428 B14R2.4396 Nc1csc(C(=O)NCC2CC2)c1 Amb28144789 [0,0,0,0,0,1|3,0,0]=4 429 B14R2.4396 O=C(CNC1CC1)c2cc(Br)cs2 Amb18245741 [0,0,0,0,0,1|2,0,0]=3 430 B14R2.4396 O=C(CNC1CC1)c2ccc(Br)s2 Amb17357398 [0,0,0,0,0,1|0,0,0]=1 431 B14R2.4396 O=C(CNC1CC1)c2ccc(Cl)s2 Amb17340477 [0,0,0,0,0,1|0,1,0]=2 432 B14R2.4396 O=C(NCC1CC1)c2cc(Br)cs2 Amb14374407 [0,0,0,0,0,1|2,0,0]=3 433 B14R2.4396 O=C(NCC1CC1)c2cc(Cl)cs2 Amb27973546 [0,0,0,0,0,1|2,1,0]=4 434 B14R2.4396 O=C(NCC1CC1)c2cc(S)cs2 Amb27207976 [0,0,0,0,0,1|3,0,0]=4 435 B14R2.4396 O=C(NCC1CC1)c2ccc(Br)o2 Amb8273767 [0,0,0,0,0,1|0,1,0]=2 436 B14R2.4396 O=C(NCC1CC1)c2ccc(Cl)o2 Amb8335706 [0,0,0,0,0,1|0,2,0]=3 437 B14R2.4396 O=C(NCC1CC1)c2coc(Br)c2 Amb8257726 [0,0,0,0,0,1|2,0,0]=3 438 B14R2.4396 O=C(NCC1CC1)c2csc(Br)n2 Amb35735383 [0,0,0,0,0,1|2,0,0]=3 439 B14R2.4396 O=C(NCC1CC1)c2nnc(Cl)s2 Amb27448044 [0,0,0,0,0,1|2,1,0]=4 440 B14R2.4396 O=C(NC[C@H]1CO1)c2ccc(Cl)s2 Amb25293783 [0,0,0,0,0,1|1,1,0]=3 441 B14R2.4396 OC(CNC1CC1)c2ccc(Br)s2 Amb17358677 [0,0,0,0,0,1|0,0,2]=3 442 B14R2.4396 OC(CNC1CC1)c2ccc(Cl)s2 Amb17340949 [0,0,0,0,0,1|0,1,2]=4 443 B14R2.9036 CC(NC1CC1)c2cccc(Br)c2 Amb1126188 [0,0,0,0,0,1|2,0,1]=4 444 B14R2.9036 CC(NC1CC1)c2cncc(Br)c2 Amb35702507 [0,0,0,0,0,1|2,0,1]=4 445 B14R2.9036 Cc1cc(C(=O)NC2CC2)cnn1 Amb27836662 [0,0,0,0,0,1|3,0,0]=4 446 B14R2.9036 Cc1cc(C(=O)OC2CC2)ccn1 Amb27982797 [0,0,0,0,0,1|3,0,0]=4 447 B14R2.9036 Cc1cccc(C(=O)NC2CC2)c1 Amb6530710 [0,0,0,0,0,1|2,0,0]=3 448 B14R2.9036 Cc1ccnc(C(=N)NC2CC2)c1 Amb28242211 [0,0,0,0,0,1|3,0,0]=4 449 B14R2.9036 Cc1ccnc(C(=O)CC2CC2)c1 Amb27851293 [0,0,0,0,0,1|3,0,0]=4 450 B14R2.9036 Cc1cncc(C(=O)NC2CC2)c1 Amb27607004 [0,0,0,0,0,1|2,0,0]=3 451 B14R2.9036 Cc1nccc(C(=O)CC2CC2)n1 Amb27655025 [0,0,0,0,0,1|3,0,0]=4 452 B14R2.9036 N=C(NC1CC1)c2cccc(F)c2 Amb28074919 [0,0,0,0,0,1|2,1,0]=4 453 B14R2.9036 Nc1cc(C(=O)NC2CC2)ccn1 Amb18284827 [0,0,0,0,0,1|2,0,0]=3 454 B14R2.9036 Nc1cccc(C(=O)NC2CC2)c1 Amb447495 [0,0,0,0,0,1|2,0,0]=3 455 B14R2.9036 Nc1cccc(C(=O)NC2CC2)n1 Amb18959758 [0,0,0,0,0,1|2,0,0]=3 456 B14R2.9036 Nc1cncc(C(=O)NC2CC2)c1 Amb23452768 [0,0,0,0,0,1|2,0,0]=3 457 B14R2.9036 O=C(CC1CC1)c2cccc(Br)c2 Amb25039621 [0,0,0,0,0,1|2,0,0]=3 458 B14R2.9036 O=C(CC1CC1)c2cccc(Cl)c2 Amb28363641 [0,0,0,0,0,1|2,1,0]=4 459 B14R2.9036 O=C(CC1CC1)c2ccnc(Cl)c2 Amb27971883 [0,0,0,0,0,1|2,1,0]=4 460 B14R2.9036 O=C(NC1CC1)N2CCC=C(Br)C2 Amb27198289 [0,0,0,0,0,1|2,0,1]=4 461 B14R2.9036 O=C(NC1CC1)c2cc(Cl)ccn2 Amb8341365 [0,0,0,0,0,1|1,1,0]=3 462 B14R2.9036 O=C(NC1CC1)c2ccc[n+]([O-])c2 Amb23470853 [0,0,0,0,0,1|3,0,0]=4 463 B14R2.9036 O=C(NC1CC1)c2cccc(Br)c2 Amb6498927 [0,0,0,0,0,1|1,0,0]=2 464 B14R2.9036 O=C(NC1CC1)c2cccc(Cl)c2 Amb6535297 [0,0,0,0,0,1|1,1,0]=3 465 B14R2.9036 O=C(NC1CC1)c2cccc(Cl)n2 Amb19082221 [0,0,0,0,0,1|1,1,0]=3 466 B14R2.9036 O=C(NC1CC1)c2cccc(F)c2 Amb6530917 [0,0,0,0,0,1|1,1,0]=3 467 B14R2.9036 O=C(NC1CC1)c2cccc(F)n2 Amb27772620 [0,0,0,0,0,1|1,1,0]=3 468 B14R2.9036 O=C(NC1CC1)c2cccc(I)c2 Amb146307 [0,0,0,0,0,1|1,1,0]=3 469 B14R2.9036 O=C(NC1CC1)c2cccc(O)c2 Amb6671592 [0,0,0,0,0,1|2,0,0]=3 470 B14R2.9036 O=C(NC1CC1)c2ccnc(Br)c2 Amb19959576 [0,0,0,0,0,1|1,0,0]=2 471 B14R2.9036 O=C(NC1CC1)c2ccnc(Cl)c2 Amb6667933 [0,0,0,0,0,1|1,1,0]=3 472 B14R2.9036 O=C(NC1CC1)c2cncc(Br)c2 Amb6324654 [0,0,0,0,0,1|1,0,0]=2 473 B14R2.9036 O=C(NC1CC1)c2cncc(O)c2 Amb24714360 [0,0,0,0,0,1|2,0,0]=3 474 B14R2.9036 O=C(OC1CC1)c2cccc(Br)c2 Amb28454701 [0,0,0,0,0,1|2,0,0]=3 475 B14R2.9036 O=C(OC1CC1)c2ccnc(F)c2 Amb28249436 [0,0,0,0,0,1|2,1,0]=4 476 B14R2.9036 O=C(OC1CC1)c2cncc(Br)c2 Amb28319857 [0,0,0,0,0,1|2,0,0]=3 477 B14R2.9036 O=C(OC1CC1)c2cncc(F)c2 Amb28189924 [0,0,0,0,0,1|2,1,0]=4 478 B14R2.9036 O=C1C=CC=C(C(=O)NC2CC2)N1 Amb27458045 [0,0,0,0,0,1|2,0,0]=3 479 B14R2.20661 Cc1cc(C(=O)NC2COC2)co1 Amb27749829 [0,0,0,0,0,1|3,0,0]=4 480 B14R2.20661 Cc1ccc(C(=O)CC2CCC2)o1 Amb27759844 [0,0,0,0,0,1|2,1,0]=4 481 B14R2.20661 Cc1ccc(C(=O)OC2COC2)s1 Amb27388344 [0,0,0,0,0,1|2,0,0]=3 482 B14R2.20661 Cc1ccc(C(C)NC2CNC2)s1 Amb27463965 [0,0,0,0,0,1|2,0,1]=4 483 B14R2.20661 Cc1csc(C(=O)NC2COC2)c1 Amb27185435 [0,0,0,0,0,1|3,0,0]=4 484 B14R2.20661 Cc1nc(C(=O)NC2CCC2)co1 Amb27749094 [0,0,0,0,0,1|3,0,0]=4 485 B14R2.20661 Cc1nc(C(=O)NC2CCC2)cs1 Amb24575763 [0,0,0,0,0,1|3,0,0]=4 486 B14R2.20661 Cc1nc(C(=O)NC2CNC2)cs1 Amb28058356 [0,0,0,0,0,1|3,0,0]=4 487 B14R2.20661 Cc1nc(C(=O)NC2COC2)cs1 Amb27247852 [0,0,0,0,0,1|3,0,0]=4 488 B14R2.20661 Cc1ncc(C(=O)CC2CNC2)s1 Amb35640579 [0,0,0,0,0,1|3,0,0]=4 489 B14R2.20661 Cc1ncc(C(=O)NC2CCC2)s1 Amb27771208 [0,0,0,0,0,1|2,0,0]=3 490 B14R2.20661 Cn1ccc(C(=O)NC2CNC2)n1 Amb27648745 [0,0,0,0,0,1|3,0,0]=4 491 B14R2.20661 Nc1nc(C(=O)NC2COC2)cs1 Amb27863002 [0,0,0,0,0,1|3,0,0]=4 492 B14R2.20661 Nc1nnc(C(=O)NC2CCC2)s1 Amb27752453 [0,0,0,0,0,1|3,0,0]=4 493 B14R2.20661 O=C(CC1CNC1)c2ccc(Cl)s2 Amb28341426 [0,0,0,0,0,1|1,1,0]=3 494 B14R2.20661 O=C(NC1CCC1)c2ccc(Br)o2 Amb27805904 [0,0,0,0,0,1|0,1,0]=2 495 B14R2.20661 O=C(NC1CCC1)c2csc(Br)n2 Amb35735385 [0,0,0,0,0,1|2,0,0]=3 496 B14R2.20661 O=C(NC1CCC1)c2csc(I)c2 Amb27415850 [0,0,0,0,0,1|2,1,0]=4 497 B14R2.20661 O=C(NC1CCC1)c2nc(Br)cs2 Amb27589483 [0,0,0,0,0,1|2,0,0]=3 498 B14R2.20661 O=C(NC1COC1)c2coc(Br)c2 Amb28054615 [0,0,0,0,0,1|2,0,0]=3 499 B14R2.20661 O=C(NC1COC1)c2csc(Br)n2 Amb35686150 [0,0,0,0,0,1|2,0,0]=3 500 B14R2.20661 O=C(NC1COC1)c2csc(Cl)c2 Amb28246749 [0,0,0,0,0,1|2,1,0]=4 501 B14R2.20661 O=C(NC1COC1)c2csc(Cl)n2 Amb35701130 [0,0,0,0,0,1|2,1,0]=4 502 B14R2.20661 O=C(OC1CCC1)c2ccc(Br)s2 Amb27653904 [0,0,0,0,0,1|1,0,0]=2 503 B14R2.20661 O=C(OC1CCC1)c2coc(Br)c2 Amb27218853 [0,0,0,0,0,1|3,0,0]=4 504 B14R2.20661 O=C(OC1CCC1)c2csc(Br)c2 Amb27484402 [0,0,0,0,0,1|3,0,0]=4 505 B14R2.20661 O=C(OC1CCC1)c2csc(Br)n2 Amb35724006 [0,0,0,0,0,1|3,0,0]=4 506 B14R2.20661 O=C(OC1COC1)c2csc(Br)n2 Amb35724007 [0,0,0,0,0,1|3,0,0]=4 507 B14R2.20661 OC(CC1CCC1)c2ccc(Br)s2 Amb27181059 [0,0,0,0,0,1|1,0,2]=4 508 B11R1.15 C=C(CCN)c1ccc(Br)s1 Amb33008004 [1,0,1,0,0,0|2,0,0]=4 509 B11R1.15 CCCC(=O)c1ccc(Br)o1 Amb27607654 [1,0,1,0,0,0|0,1,0]=3 510 B11R1.15 CCCC(=O)c1ccc(Br)s1 Amb9173237 [1,0,1,0,0,0|0,0,0]=2 511 B11R1.15 CCCC(=O)c1ccc(C)s1 Amb2154724 [1,0,1,0,0,0|1,0,0]=3 512 B11R1.15 CCCC(=O)c1ccc(Cl)s1 Amb6492961 [1,0,1,0,0,0|0,1,0]=3 513 B11R1.15 CCCC(=O)c1cnc(N)s1 Amb33132655 [1,0,1,0,0,0|2,0,0]=4 514 B11R1.15 CCCC(=O)c1csc(Br)c1 Amb27169037 [1,0,1,0,0,0|2,0,0]=4 515 B11R1.15 CCCC(Br)c1ccc(Br)s1 Amb27588443 [1,0,1,0,0,0|1,0,1]=4 516 B11R1.15 CCCC(Cl)c1ccc(Br)s1 Amb28049831 [1,0,1,0,0,0|1,0,1]=4 517 B11R1.15 CCCC(N)c1ccc(Br)s1 Amb17195899 [1,0,1,0,0,0|1,0,1]=4 518 B11R1.15 CCCC(O)c1ccc(Br)s1 Amb17195962 [1,0,1,0,0,0|0,0,2]=4 519 B11R1.15 CCC[C@H](N)c1ccc(Br)s1 Amb27967780 [1,0,1,0,0,0|1,0,1]=4 520 B11R1.15 CCC[C@H](O)c1ccc(Br)s1 Amb28069917 [1,0,1,0,0,0|0,0,2]=4 521 B11R1.15 CCNC(=O)c1ccc(Br)o1 Amb6512906 [1,0,1,0,0,0|0,1,0]=3 522 B11R1.15 CCNC(=O)c1ccc(Br)s1 Amb2111444 [1,0,1,0,0,0|0,0,0]=2 523 B11R1.15 CCNC(=O)c1ccc(Cl)o1 Amb27176427 [1,0,1,0,0,0|0,2,0]=4 524 B11R1.15 CCNC(=O)c1ccc(Cl)s1 Amb2227896 [1,0,1,0,0,0|0,1,0]=3 525 B11R1.15 CCNC(=O)c1ccc(N)o1 Amb18101835 [1,0,1,0,0,0|1,1,0]=4 526 B11R1.15 CCNC(=O)c1ccc(N)s1 Amb32417997 [1,0,1,0,0,0|1,0,0]=3 527 B11R1.15 CCNC(=O)c1cnc(N)s1 Amb17490794 [1,0,1,0,0,0|2,0,0]=4 528 B11R1.15 CCNC(=O)c1csc(Br)n1 Amb35735362 [1,0,1,0,0,0|2,0,0]=4 529 B11R1.15 CCNC(=O)c1ncc(Cl)s1 Amb27660669 [1,0,1,0,0,0|1,1,0]=4 530 B11R1.15 CCNC(=O)c1ncc(N)s1 Amb26647557 [1,0,1,0,0,0|2,0,0]=4 531 B11R1.15 CCNC(=S)c1ccc(C)s1 Amb27441782 [1,0,1,0,0,0|1,1,0]=4 532 B11R1.15 CCNC(C)c1ccc(Br)s1 Amb18289919 [1,0,1,0,0,0|1,0,1]=4 533 B11R1.15 CCOC(=O)c1ccc(Br)o1 Amb4010044 [1,0,1,0,0,0|1,1,0]=4 534 B11R1.15 CCOC(=O)c1ccc(Br)s1 Amb6366083 [1,0,1,0,0,0|1,0,0]=3 535 B11R1.15 CCOC(=O)c1ccc(C)s1 Amb9242879 [1,0,1,0,0,0|2,0,0]=4 536 B11R1.15 CCOC(=O)c1ccc(Cl)s1 Amb6365972 [1,0,1,0,0,0|1,1,0]=4 537 B11R1.15 CCOC(=O)c1ccc(F)s1 Amb19892818 [1,0,1,0,0,0|1,1,0]=4 538 B11R1.15 CCOC(=O)c1ccc(I)s1 Amb25188527 [1,0,1,0,0,0|1,1,0]=4 539 B11R1.15 CCOC(=O)c1ccc(N)s1 Amb17109293 [1,0,1,0,0,0|2,0,0]=4 540 B11R1.15 CCOC(=O)c1ccc(O)s1 Amb20242357 [1,0,1,0,0,0|2,0,0]=4 541 B11R1.15 CCOC(=O)c1cnc(Br)s1 Amb33548862 [1,0,1,0,0,0|2,0,0]=4 542 B11R1.15 CCOC(=O)c1ncc(Br)s1 Amb22233824 [1,0,1,0,0,0|2,0,0]=4 543 B11R1.15 CNCC(=O)c1ccc(Br)o1 Amb33451974 [1,0,1,0,0,0|1,1,0]=4 544 B11R1.15 CNCC(=O)c1ccc(Br)s1 Amb17251263 [1,0,1,0,0,0|1,0,0]=3 545 B11R1.15 CNCC(=O)c1ccc(C)s1 Amb25104646 [1,0,1,0,0,0|2,0,0]=4 546 B11R1.15 CNCC(=O)c1ccc(Cl)s1 Amb17234841 [1,0,1,0,0,0|1,1,0]=4 547 B11R1.15 CNCC(=O)c1ncc(Br)s1 Amb33434058 [1,0,1,0,0,0|2,0,0]=4 548 B11R1.15 CONC(=O)c1ccc(Br)o1 Amb8220029 [1,0,1,0,0,0|1,1,0]=4 549 B11R1.15 CONC(=O)c1ccc(Cl)s1 Amb19404821 [1,0,1,0,0,0|1,1,0]=4 550 B11R1.15 CSCC(=O)c1ccc(Br)o1 Amb27877664 [1,0,1,0,0,0|1,1,0]=4 551 B11R1.15 CSCC(=O)c1ccc(Cl)s1 Amb28049842 [1,0,1,0,0,0|1,1,0]=4 552 B11R1.15 C\C=C\C(=O)c1ccc(Br)s1 Amb27835104 [1,0,1,0,0,0|0,0,2]=4 553 B11R1.15 Cc1ccc(C(=O)CCBr)s1 Amb27793690 [1,0,1,0,0,0|2,0,0]=4 554 B11R1.15 Cc1ccc(C(=O)CCN)s1 Amb18199056 [1,0,1,0,0,0|2,0,0]=4 555 B11R1.15 N#CCC(=O)c1ccc(Br)s1 Amb6276356 [1,0,1,0,0,0|1,0,1]=4 556 B11R1.15 NCCC(=O)c1ccc(Br)o1 Amb33451882 [1,0,1,0,0,0|1,1,0]=4 557 B11R1.15 NCCC(=O)c1ccc(Br)s1 Amb17195895 [1,0,1,0,0,0|1,0,0]=3 558 B11R1.15 NCCC(=O)c1ccc(Cl)s1 Amb17194599 [1,0,1,0,0,0|1,1,0]=4 559 B11R1.15 NCCC(=O)c1ncc(Br)s1 Amb33434009 [1,0,1,0,0,0|2,0,0]=4 560 B11R1.15 O=C(CCCl)c1ccc(Br)s1 Amb17196745 [1,0,1,0,0,0|1,0,0]=3 561 B11R1.15 O=C(CCCl)c1ccc(Cl)s1 Amb17109300 [1,0,1,0,0,0|1,1,0]=4 562 B11R1.15 O=C(CCO)c1ccc(Br)s1 Amb18070910 [1,0,1,0,0,0|1,0,0]=3 563 B11R1.15 O=C(CCO)c1ccc(Cl)s1 Amb18066263 [1,0,1,0,0,0|1,1,0]=4 564 B11R1.15 O=C(CCS)c1ccc(Br)s1 Amb17413317 [1,0,1,0,0,0|1,0,0]=3 565 B11R1.15 O=C(CCS)c1ccc(Cl)s1 Amb17403370 [1,0,1,0,0,0|1,1,0]=4 566 B11R1.15 O=CCC(=O)c1ccc(Br)s1 Amb25118336 [1,0,1,0,0,0|1,0,1]=4 567 B11R1.27 CCCCCc1ccc(Br)s1 Amb26081675 [1,0,1,0,0,0|1,0,1]=4 568 B11R1.27 CCCNCc1ccc(Br)o1 Amb6270338 [1,0,1,0,0,0|0,1,1]=4 569 B11R1.27 CCCNCc1ccc(Br)s1 Amb6274919 [1,0,1,0,0,0|0,0,1]=3 570 B11R1.27 CCCNCc1ccc(C)s1 Amb837905 [1,0,1,0,0,0|1,0,1]=4 571 B11R1.27 CCCNCc1ccc(Cl)s1 Amb6714471 [1,0,1,0,0,0|0,1,1]=4 572 B11R1.27 CCCNCc1ncc(Br)s1 Amb27670901 [1,0,1,0,0,0|1,0,1]=4 573 B11R1.27 CCONCc1ccc(Br)s1 Amb27987593 [1,0,1,0,0,0|1,0,1]=4 574 B11R1.27 CCO\N=C\c1ccc(Br)s1 Amb27458654 [1,0,1,0,0,0|1,0,1]=4 575 B11R1.27 CNC\C=C\c1ccc(Br)s1 Amb25679131 [1,0,1,0,0,0|2,0,0]=4 576 B11R1.27 ClCC\C=C\c1ccc(Br)s1 Amb17262461 [1,0,1,0,0,0|2,0,0]=4 577 B11R1.27 NCC\C=C\c1ccc(Br)s1 Amb17249891 [1,0,1,0,0,0|2,0,0]=4 578 B11R1.27 OCCNCc1ccc(Br)s1 Amb7757063 [1,0,1,0,0,0|1,0,1]=4 579 B11R1.27 SCCNCc1ccc(Br)s1 Amb27272066 [1,0,1,0,0,0|1,0,1]=4 580 B11R1.29 C#CCNC(=O)c1cccs1 Amb8343873 [1,0,1,0,0,0|0,0,2]=4 581 B11R1.29 C=CCNC(=O)c1cccs1 Amb3375142 [1,0,1,0,0,0|0,0,2]=4 582 B11R1.29 CCCCC(=O)c1ccco1 Amb10070291 [1,0,1,0,0,0|1,1,0]=4 583 B11R1.29 CCCCC(=O)c1cccs1 Amb8850831 [1,0,1,0,0,0|1,0,0]=3 584 B11R1.29 CCCCC(=O)c1nccs1 Amb33250592 [1,0,1,0,0,0|2,0,0]=4 585 B11R1.29 CCCNC(=N)c1cncs1 Amb27397218 [1,0,1,0,0,0|2,0,0]=4 586 B11R1.29 CCCNC(=O)c1ccoc1 Amb8331910 [1,0,1,0,0,0|2,0,0]=4 587 B11R1.29 CCCNC(=O)c1ccon1 Amb28074518 [1,0,1,0,0,0|2,0,0]=4 588 B11R1.29 CCCNC(=O)c1ccsc1 Amb25866439 [1,0,1,0,0,0|2,0,0]=4 589 B11R1.29 CCCNC(=O)c1cscn1 Amb24687202 [1,0,1,0,0,0|2,0,0]=4 590 B11R1.29 CCCNC(=O)c1nccs1 Amb27968958 [1,0,1,0,0,0|1,0,0]=3 591 B11R1.29 CCCNC(C)c1cccs1 Amb6272252 [1,0,1,0,0,0|1,0,1]=4 592 B11R1.29 CCCOC(=O)c1ccco1 Amb9242873 [1,0,1,0,0,0|1,1,0]=4 593 B11R1.29 CCCOC(=O)c1nccs1 Amb28387225 [1,0,1,0,0,0|2,0,0]=4 594 B11R1.29 CCNCC(=O)c1cccs1 Amb17314790 [1,0,1,0,0,0|2,0,0]=4 595 B11R1.29 CCNNC(=O)c1nccs1 Amb28436335 [1,0,1,0,0,0|2,0,0]=4 596 B11R1.29 CCONC(=O)c1ccco1 Amb10572673 [1,0,1,0,0,0|1,1,0]=4 597 B11R1.29 CCONC(=O)c1nccs1 Amb27262285 [1,0,1,0,0,0|2,0,0]=4 598 B11R1.29 CNCCC(=O)c1cccs1 Amb17334774 [1,0,1,0,0,0|2,0,0]=4 599 B11R1.29 CNCCC(=O)c1cccs1 Amb22235115 [1,0,1,0,0,0|2,0,0]=4 600 B11R1.29 C\C=C\NC(=O)c1cccs1 Amb28123137 [1,0,1,0,0,0|0,0,2]=4 601 B11R1.29 NCCCC(=O)c1cccs1 Amb18623716 [1,0,1,0,0,0|2,0,0]=4 602 B11R1.29 NCCNC(=O)c1ccco1 Amb1869482 [1,0,1,0,0,0|1,1,0]=4 603 B11R1.29 NCCNC(=O)c1ccco1 Amb4026631 [1,0,1,0,0,0|1,1,0]=4 604 B11R1.29 NCCNC(=O)c1cccs1 Amb1133695 [1,0,1,0,0,0|1,0,0]=3 605 B11R1.29 O=C(CCCBr)c1cccs1 Amb17250552 [1,0,1,0,0,0|2,0,0]=4 606 B11R1.29 O=C(CCCCl)c1cccs1 Amb1159154 [1,0,1,0,0,0|2,0,0]=4 607 B11R1.29 O=C(CCCO)c1cccs1 Amb1110142 [1,0,1,0,0,0|2,0,0]=4 608 B11R1.29 O=C(NCCCl)c1ccco1 Amb17103197 [1,0,1,0,0,0|1,1,0]=4 609 B11R1.29 O=C(NCCCl)c1cccs1 Amb17103198 [1,0,1,0,0,0|1,0,0]=3 610 B11R1.29 O=C(NCCF)c1cccs1 Amb28048737 [1,0,1,0,0,0|1,0,0]=3 611 B11R1.29 O=C(NCCI)c1cccs1 Amb28255141 [1,0,1,0,0,0|1,0,0]=3 612 B11R1.29 O=C(NCCO)c1ccco1 Amb9242269 [1,0,1,0,0,0|1,1,0]=4 613 B11R1.29 O=C(NCCO)c1cccs1 Amb5719804 [1,0,1,0,0,0|1,0,0]=3 614 B11R1.29 O=C(NCCO)c1cncs1 Amb28045283 [1,0,1,0,0,0|2,0,0]=4 615 B11R1.29 O=C(NCCO)c1nccs1 Amb27448705 [1,0,1,0,0,0|2,0,0]=4 616 B11R1.29 O=C(OCCBr)c1cccs1 Amb33276565 [1,0,1,0,0,0|2,0,0]=4 617 B11R1.29 O=C(OCCF)c1cccs1 Amb27818405 [1,0,1,0,0,0|2,0,0]=4 618 B11R1.29 O=C(OCCO)c1cccs1 Amb27000753 [1,0,1,0,0,0|2,0,0]=4 619 B11R1.29 O=CCNC(=O)c1cccs1 Amb17102064 [1,0,1,0,0,0|1,0,1]=4 620 B11R1.29 [NH3+]CCNC(=O)c1cccs1 Amb9816866 [1,0,1,0,0,0|1,0,0]=3 621 B11R1.75 CC(C)NCc1ccc(Br)o1 Amb6685405 [1,0,1,0,0,0|0,1,1]=4 622 B11R1.75 CC(C)NCc1ccc(Br)s1 Amb6254013 [1,0,1,0,0,0|0,0,1]=3 623 B11R1.75 CC(C)NCc1ccc(Cl)s1 Amb6253333 [1,0,1,0,0,0|0,1,1]=4 624 B11R1.75 CC(C)NCc1ccc(F)s1 Amb31210026 [1,0,1,0,0,0|0,1,1]=4 625 B11R1.75 CC(C)NCc1ncc(Br)s1 Amb25149150 [1,0,1,0,0,0|1,0,1]=4 626 B11R1.75 CC(C)SCc1ccc(Br)s1 Amb28250742 [1,0,1,0,0,0|1,0,1]=4 627 B11R1.75 CC(Cl)\C=C\c1ccc(Br)s1 Amb27443704 [1,0,1,0,0,0|2,0,0]=4 628 B11R1.75 CC(N)\C=C\c1ccc(Br)s1 Amb33242926 [1,0,1,0,0,0|2,0,0]=4 629 B11R1.75 Cc1ccc(CNC(C)C)s1 Amb33528233 [1,0,1,0,0,0|1,0,1]=4 630 B11R1.77 CC(C)CC(=O)c1ccco1 Amb17334321 [1,0,1,0,0,0|1,1,0]=4 631 B11R1.77 CC(C)CC(=O)c1cccs1 Amb9214316 [1,0,1,0,0,0|1,0,0]=3 632 B11R1.77 CC(C)CC(=O)c1ccns1 Amb27236374 [1,0,1,0,0,0|2,0,0]=4 633 B11R1.77 CC(C)CC(=O)c1nccs1 Amb33250593 [1,0,1,0,0,0|2,0,0]=4 634 B11R1.77 CC(C)NC(=O)c1cccs1 Amb3375143 [1,0,1,0,0,0|0,0,0]=2 635 B11R1.77 CC(C)NC(=O)c1ccno1 Amb31199643 [1,0,1,0,0,0|1,1,0]=4 636 B11R1.77 CC(C)NC(=O)c1ccoc1 Amb8330747 [1,0,1,0,0,0|2,0,0]=4 637 B11R1.77 CC(C)NC(=O)c1ccsc1 Amb8339314 [1,0,1,0,0,0|2,0,0]=4 638 B11R1.77 CC(C)NC(=O)c1cnco1 Amb22963682 [1,0,1,0,0,0|1,1,0]=4 639 B11R1.77 CC(C)NC(=O)c1cscn1 Amb26356899 [1,0,1,0,0,0|2,0,0]=4 640 B11R1.77 CC(C)NC(=S)c1ccco1 Amb27642353 [1,0,1,0,0,0|0,2,0]=4 641 B11R1.77 CC(C)NC(C)c1cccs1 Amb6685442 [1,0,1,0,0,0|1,0,1]=4 642 B11R1.77 CC(C)OC(=O)c1ccco1 Amb10572174 [1,0,1,0,0,0|1,1,0]=4 643 B11R1.77 CC(C)OC(=O)c1cncs1 Amb26656340 [1,0,1,0,0,0|2,0,0]=4 644 B11R1.77 CC(C)OC(=O)c1nccs1 Amb27457617 [1,0,1,0,0,0|2,0,0]=4 645 B11R1.77 CC(C)\N=C(/Cl)c1cccs1 Amb33990674 [1,0,1,0,0,0|1,0,1]=4 646 B11R1.77 CC(C)\N=C(\Cl)c1cccs1 Amb2371309 [1,0,1,0,0,0|1,0,1]=4 647 B11R1.77 CC(N)CC(=O)c1cccs1 Amb25328083 [1,0,1,0,0,0|2,0,0]=4 648 B11R1.77 CC(N)CC(=O)c1cccs1 Amb30584790 [1,0,1,0,0,0|2,0,0]=4 649 B11R1.77 CN(C)CC(=O)c1cccs1 Amb9661104 [1,0,1,0,0,0|2,0,0]=4 650 B11R1.77 CN(C)NC(=O)c1ccco1 Amb25151711 [1,0,1,0,0,0|1,1,0]=4 651 B11R1.77 CN(C)NC(=O)c1cncs1 Amb27456248 [1,0,1,0,0,0|2,0,0]=4 652 B11R1.77 C[C@@H](N)CC(=O)c1cccs1 Amb33307812 [1,0,1,0,0,0|2,0,0]=4 653 B11R1.301 C\C=C\C=C\C(=O)NC1CC1 Amb27452265 [1,0,1,0,0,0|1,0,0]=3 654 B11R2.385 C(#CC1CC1)c2cccs2 Amb28322835 [2,0,0,0,0,0|1,0,1]=4 655 B11R2.385 c1coc(CNC2CC2)c1 Amb1136152 [2,0,0,0,0,0|0,1,1]=4 656 B11R2.385 c1csc(CNC2CC2)c1 Amb6356059 [2,0,0,0,0,0|0,0,1]=3 657 B11R2.385 c1csc(CNC2CC2)n1 Amb7543835 [2,0,0,0,0,0|1,0,1]=4 658 B11R2.385 c1csc(CNC2CC2)n1 Amb8503427 [2,0,0,0,0,0|1,0,1]=4 659 B11R2.385 c1csc(SCC2CC2)c1 Amb27761498 [2,0,0,0,0,0|2,0,0]=4 660 B11R2.385 c1ncc(CNC2CC2)s1 Amb10607783 [2,0,0,0,0,0|1,0,1]=4 661 B11R2.385 c1ncc(CNC2CC2)s1 Amb21959870 [2,0,0,0,0,0|1,0,1]=4 662 B13R1.10 CC(C#N)NC(=O)c1ccc(Br)s1 Amb28062603 [0,1,1,0,0,0|1,0,1]=4 663 B13R1.10 CC(CBr)NC(=O)c1ccc(Br)s1 Amb27241434 [0,1,1,0,0,0|1,0,0]=3 664 B13R1.10 CC(CBr)NC(=O)c1ccc(Cl)s1 Amb27761744 [0,1,1,0,0,0|1,1,0]=4 665 B13R1.10 CC(CN)NC(=O)c1ccc(Br)s1 Amb28242251 [0,1,1,0,0,0|1,0,0]=3 666 B13R1.10 CC(CO)NC(=O)c1ccc(Br)s1 Amb9276192 [0,1,1,0,0,0|1,0,0]=3 667 B13R1.10 CCC(=O)CC(=O)c1ccc(Br)s1 Amb17357785 [0,1,1,0,0,0|1,0,1]=4 668 B13R1.10 CCC(C)NC(=O)c1ccc(Br)o1 Amb3185279 [0,1,1,0,0,0|0,1,0]=3 669 B13R1.10 CCC(C)NC(=O)c1ccc(C)s1 Amb8342634 [0,1,1,0,0,0|1,0,0]=3 670 B13R1.10 CCC(C)NC(=O)c1ccc(Cl)o1 Amb8250347 [0,1,1,0,0,0|0,2,0]=4 671 B13R1.10 CCC(C)NC(=O)c1ccc(Cl)s1 Amb8243977 [0,1,1,0,0,0|0,1,0]=3 672 B13R1.10 CCC(C)NC(=O)c1cnc(C)s1 Amb27867211 [0,1,1,0,0,0|2,0,0]=4 673 B13R1.10 CCC(C)NC(=O)c1cnc(N)s1 Amb17490814 [0,1,1,0,0,0|2,0,0]=4 674 B13R1.10 CCC(C)NC(=O)c1coc(Br)c1 Amb8246260 [0,1,1,0,0,0|2,0,0]=4 675 B13R1.10 CCC(C)NC(=O)c1csc(Br)n1 Amb35686153 [0,1,1,0,0,0|2,0,0]=4 676 B13R1.10 CCC(C)NC(=O)c1nc(Br)cs1 Amb27594394 [0,1,1,0,0,0|2,0,0]=4 677 B13R1.10 CCC(C)NC(=O)c1ncc(Cl)s1 Amb27388366 [0,1,1,0,0,0|1,1,0]=4 678 B13R1.10 CCC(C)NC(=O)c1ncc(N)s1 Amb28317918 [0,1,1,0,0,0|2,0,0]=4 679 B13R1.10 CCC(C)NC(C)c1ccc(Br)s1 Amb33044414 [0,1,1,0,0,0|1,0,1]=4 680 B13R1.10 COC(=O)NC(=O)c1ccc(Br)s1 Amb27485825 [0,1,1,0,0,0|1,0,1]=4 681 B13R1.10 C[C@@H](C#N)NC(=O)c1ccc(Br)s1 Amb28183887 [0,1,1,0,0,0|1,0,1]=4 682 B13R1.10 C[C@H](C#N)NC(=O)c1ccc(Br)s1 Amb28194483 [0,1,1,0,0,0|1,0,1]=4 683 B13R1.10 C[C@H](CO)NC(=O)c1ccc(Br)o1 Amb27845332 [0,1,1,0,0,0|1,1,0]=4 684 B13R1.10 C[C@H](CO)NC(=O)c1ccc(Br)s1 Amb27601078 [0,1,1,0,0,0|1,0,0]=3 685 B13R1.10 C[C@H](CO)NC(=O)c1ccc(Cl)s1 Amb27947788 [0,1,1,0,0,0|1,1,0]=4 686 B13R1.10 Cc1ccc(C(=O)NC(C)CF)s1 Amb27761489 [0,1,1,0,0,0|2,0,0]=4 687 B13R1.10 Cc1ccc(C(=O)NC(C)CN)s1 Amb18911273 [0,1,1,0,0,0|2,0,0]=4 688 B13R1.10 Cc1ccc(C(=O)N[C@@H](C)CO)s1 Amb27404031 [0,1,1,0,0,0|2,0,0]=4 689 B13R1.10 Cc1ccc(C(=O)N[C@H](C)CN)s1 Amb27171862 [0,1,1,0,0,0|2,0,0]=4 690 B13R1.10 Cc1ccc(C(=O)N[C@H](C)CO)s1 Amb27871062 [0,1,1,0,0,0|2,0,0]=4 691 B13R1.23 C#CCCNC(=O)c1ccc(Br)o1 Amb27760864 [0,1,1,0,0,0|0,1,1]=4 692 B13R1.23 C#CCCNC(=O)c1ccc(Cl)s1 Amb28288613 [0,1,1,0,0,0|0,1,1]=4 693 B13R1.23 C#CCCNC(=O)c1ncc(Br)s1 Amb28065437 [0,1,1,0,0,0|1,0,1]=4 694 B13R1.23 CC(NCCCO)c1ccc(Br)s1 Amb33044422 [0,1,1,0,0,0|1,0,1]=4 695 B13R1.23 CCCCNC(=O)c1ccc(Br)o1 Amb6558697 [0,1,1,0,0,0|0,1,0]=3 696 B13R1.23 CCCCNC(C)c1ccc(Br)s1 Amb33044418 [0,1,1,0,0,0|1,0,1]=4 697 B13R1.23 CCO\C=C\C(=O)c1ccc(Br)s1 Amb33355227 [0,1,1,0,0,0|1,0,1]=4 698 B13R1.23 COCCNC(=O)c1ccc(Br)o1 Amb6461118 [0,1,1,0,0,0|0,1,0]=3 699 B13R1.23 COCCNC(=O)c1ccc(N)o1 Amb18625491 [0,1,1,0,0,0|1,1,0]=4 700 B13R1.23 COCCNC(=O)c1cnc(N)s1 Amb17490816 [0,1,1,0,0,0|2,0,0]=4 701 B13R1.23 COCCNC(C)c1ccc(Br)s1 Amb33044413 [0,1,1,0,0,0|1,0,1]=4 702 B13R1.23 C\C(=C/CCCN)c1ccc(Br)s1 Amb18073285 [0,1,1,0,0,0|2,0,0]=4 703 B13R1.23 Cc1ccc(C(=O)NCCC#N)s1 Amb18330465 [0,1,1,0,0,0|1,0,1]=4 704 B13R1.23 N#CCCCC(=O)c1ccc(Br)s1 Amb17266161 [0,1,1,0,0,0|1,0,1]=4 705 B13R1.23 N#CCCNC(=O)c1ccc(Br)o1 Amb27608214 [0,1,1,0,0,0|0,1,1]=4 706 B13R1.23 N#CCCNC(=O)c1ccc(N)s1 Amb27459286 [0,1,1,0,0,0|1,0,1]=4 707 B13R1.23 Nc1ncc(C(=O)NCCCO)s1 Amb22899142 [0,1,1,0,0,0|2,0,0]=4 708 B13R1.23 O=C(NCCCO)c1cc(Br)cs1 Amb18230067 [0,1,1,0,0,0|2,0,0]=4 709 B13R1.23 O=C(NCCCO)c1ccc(Br)s1 Amb9243659 [0,1,1,0,0,0|0,0,0]=2 710 B13R1.46 C#CCN(C)C(=O)c1ccc(Br)s1 Amb28381185 [0,1,1,0,0,0|0,0,2]=4 711 B13R1.46 CCNC(=O)C(=O)c1ccc(Br)s1 Amb17358651 [0,1,1,0,0,0|2,0,0]=4 712 B13R1.46 CCNC(C)C(=O)c1ccc(Br)s1 Amb18589782 [0,1,1,0,0,0|2,0,0]=4 713 B13R1.46 CCOC(=O)C(=O)c1ccc(Br)s1 Amb2722748 [0,1,1,0,0,0|2,0,0]=4 714 B13R1.46 CN(CCN)C(=O)c1ccc(Br)s1 Amb24768771 [0,1,1,0,0,0|1,0,0]=3 715 B13R1.121 O=S(=O)(NCCCl)c1ccc(Br)s1 Amb17103280 [0,1,1,0,0,0|2,0,0]=4 716 B13R1.129 C=C(C)CNC(=O)c1ccc(Br)o1 Amb27878397 [0,1,1,0,0,0|0,1,1]=4 717 B13R1.129 CC(=O)CCC(=O)c1ccc(Br)s1 Amb17416166 [0,1,1,0,0,0|1,0,1]=4 718 B13R1.129 CC(Br)CNC(=O)c1ccc(Br)o1 Amb28206591 [0,1,1,0,0,0|0,1,0]=3 719 B13R1.129 CC(C)CNC(=O)c1cc(Br)cs1 Amb6518305 [0,1,1,0,0,0|2,0,0]=4 720 B13R1.129 CC(C)CNC(=O)c1ccc(Br)o1 Amb3106011 [0,1,1,0,0,0|0,1,0]=3 721 B13R1.129 CC(C)CNC(=O)c1ccc(Cl)o1 Amb8245978 [0,1,1,0,0,0|0,2,0]=4 722 B13R1.129 CC(C)CNC(=O)c1ccc(Cl)s1 Amb8260615 [0,1,1,0,0,0|0,1,0]=3 723 B13R1.129 CC(C)CNC(=O)c1csc(Br)n1 Amb35686152 [0,1,1,0,0,0|2,0,0]=4 724 B13R1.129 CC(C)CNC(=O)c1nc(Br)cs1 Amb27388392 [0,1,1,0,0,0|2,0,0]=4 725 B13R1.129 CC(C)CNC(=O)c1ncc(N)s1 Amb27802893 [0,1,1,0,0,0|2,0,0]=4 726 B13R1.129 CC(C)NCC(=O)c1ccc(Br)s1 Amb17358676 [0,1,1,0,0,0|2,0,0]=4 727 B13R1.129 CC(O)CNC(=O)c1cc(Br)cs1 Amb28126393 [0,1,1,0,0,0|2,0,0]=4 728 B13R1.129 CC(O)CNC(=O)c1cnc(N)s1 Amb28316664 [0,1,1,0,0,0|2,0,0]=4 729 B13R1.129 CC(O)CNC(=O)c1csc(Br)n1 Amb35686160 [0,1,1,0,0,0|2,0,0]=4 730 B13R1.129 CC(O)CNC(=O)c1nc(Br)cs1 Amb28453881 [0,1,1,0,0,0|2,0,0]=4 731 B13R1.129 CC(O)CNC(=O)c1ncc(Cl)s1 Amb27650088 [0,1,1,0,0,0|1,1,0]=4 732 B13R1.129 CC(O)CNC(C)c1ccc(Br)s1 Amb33044426 [0,1,1,0,0,0|1,0,1]=4 733 B13R1.129 CN(C)CCC(=O)c1ccc(Br)s1 Amb17358680 [0,1,1,0,0,0|2,0,0]=4 734 B13R1.129 C[C@@H](O)CNC(=O)c1csc(Br)n1 Amb35686158 [0,1,1,0,0,0|2,0,0]=4 735 B13R1.129 C[C@@H](O)CNC(=O)c1ncc(Br)s1 Amb27982688 [0,1,1,0,0,0|1,0,0]=3 736 B13R1.129 C[C@H](O)CNC(=O)c1ccc(Br)s1 Amb27837239 [0,1,1,0,0,0|0,0,0]=2 737 B13R1.129 C[C@H](O)CNC(=O)c1coc(Br)c1 Amb27261098 [0,1,1,0,0,0|2,0,0]=4 738 B13R1.129 C[C@H](O)CNC(=O)c1csc(Br)n1 Amb35686159 [0,1,1,0,0,0|2,0,0]=4 739 B13R1.129 Cc1ccc(C(=N)NCC(C)C)s1 Amb28054745 [0,1,1,0,0,0|2,0,0]=4 740 B13R1.129 Cc1ccc(C(=O)NCC(C)C)o1 Amb6468566 [0,1,1,0,0,0|1,1,0]=4 741 B13R1.129 Cc1ccc(C(=O)NCC(C)C)s1 Amb8341645 [0,1,1,0,0,0|1,0,0]=3 742 B13R1.129 Cc1ncc(C(=O)NCC(C)C)s1 Amb27235496 [0,1,1,0,0,0|2,0,0]=4 743 B13R1.129 Cc1ncc(C(=O)NC[C@H](C)O)s1 Amb27167244 [0,1,1,0,0,0|2,0,0]=4 744 B13R1.129 NC(=S)CNC(=O)c1ccc(Br)s1 Amb27979865 [0,1,1,0,0,0|1,0,1]=4 745 B13R1.129 O=C(NCC(F)F)c1ccc(Cl)s1 Amb28043868 [0,1,1,0,0,0|1,1,0]=4 746 B13R1.129 O=C(O)CNC(=O)c1ccc(Br)s1 Amb6247114 [0,1,1,0,0,0|1,0,1]=4 747 B13R1.679 CCCNC(=O)c1ccc(C#N)o1 Amb27605221 [0,1,1,0,0,0|1,1,0]=4 748 B13R1.679 CCCNC(=O)c1ccc(CCl)o1 Amb17324660 [0,1,1,0,0,0|0,2,0]=4 749 B13R1.679 CCCNC(=O)c1ccc(CN)o1 Amb5738048 [0,1,1,0,0,0|1,1,0]=4 750 B13R1.679 CCCNC(=O)c1cnc(NC)s1 Amb28126345 [0,1,1,0,0,0|2,0,0]=4 751 B13R1.680 CCCNC(=O)c1oc(C)cc1C Amb27197803 [0,1,1,0,0,0|1,1,0]=4 752 B13R1.680 CCCNC(=O)c1sc(C)nc1C Amb19398820 [0,1,1,0,0,0|2,0,0]=4 753 B13R1.681 C#CCNC(=O)c1cc(Br)c(Br)s1 Amb8703072 [0,1,1,0,0,0|0,0,2]=4 754 B13R1.681 C=CCNC(=O)c1cc(Br)c(Br)s1 Amb338954 [0,1,1,0,0,0|0,0,2]=4 755 B13R1.681 CCCNC(=O)c1cc(C)c(C)o1 Amb28051375 [0,1,1,0,0,0|1,1,0]=4 756 B13R1.681 CCCNC(=O)c1cc(C)c(C)s1 Amb8342100 [0,1,1,0,0,0|1,0,0]=3 757 B13R1.681 CCCNC(=O)c1cc(N)c(C)s1 Amb18972152 [0,1,1,0,0,0|1,0,0]=3 758 B13R1.681 CCCNC(=O)c1cn(C)c(Br)n1 Amb29877134 [0,1,1,0,0,0|2,0,0]=4 759 B13R1.681 CCCNC(=O)c1nc(C)c(C)s1 Amb28284034 [0,1,1,0,0,0|2,0,0]=4 760 B13R1.681 Cc1cc(C(=O)NCCBr)sc1C Amb27180347 [0,1,1,0,0,0|2,0,0]=4 761 B13R1.681 Cc1cc(C(=O)NCCI)sc1Br Amb27162862 [0,1,1,0,0,0|1,0,0]=3 762 B13R1.681 Cc1cc(C(=O)NCCN)sc1Br Amb28348018 [0,1,1,0,0,0|1,0,0]=3 763 B13R1.681 O=C(NCCBr)c1cc(Br)c(Br)s1 Amb27397747 [0,1,1,0,0,0|1,0,0]=3 764 B13R1.681 O=C(NCCF)c1cc(Br)c(Br)s1 Amb27855089 [0,1,1,0,0,0|1,0,0]=3 765 B13R1.681 O=C(NCCO)c1cc(Br)c(Br)s1 Amb9242133 [0,1,1,0,0,0|1,0,0]=3 766 B13R1.2505 CCCNC(=O)c1ccc(C)n1C Amb8332933 [0,1,1,0,0,0|2,0,0]=4 767 B13R1.58 CC(C)NC(=O)c1ccc(C#N)s1 Amb27979264 [0,1,1,0,0,0|1,0,0]=3 768 B13R1.58 CC(C)NC(=O)c1ccc(CN)o1 Amb5738049 [0,1,1,0,0,0|1,1,0]=4 769 B13R1.58 CC(C)NC(=O)c1ccc(CN)s1 Amb17490938 [0,1,1,0,0,0|1,0,0]=3 770 B13R1.58 CC(C)OC(=O)c1ccc(C#N)s1 Amb27980275 [0,1,1,0,0,0|2,0,0]=4 771 B13R1.58 CCc1ccc(C(=O)NC(C)C)s1 Amb8330751 [0,1,1,0,0,0|1,0,0]=3 772 B13R1.58 CNc1ccc(C(=O)NC(C)C)s1 Amb27256134 [0,1,1,0,0,0|1,0,0]=3 773 B13R1.58 CSc1ccc(C(=O)NC(C)C)o1 Amb27591305 [0,1,1,0,0,0|1,1,0]=4 774 B13R1.130 CC(C)C(=O)C(=O)c1ccc(Br)s1 Amb17416167 [0,1,1,0,0,0|1,0,0]=3 775 B13R1.130 CC(C)C(=O)C(=O)c1ccc(Cl)s1 Amb17404671 [0,1,1,0,0,0|1,1,0]=4 776 B13R1.130 CC(C)C(C)C(=O)c1ccc(Cl)s1 Amb27411004 [0,1,1,0,0,0|1,1,0]=4 777 B13R1.130 CC(C)C(N)C(=O)c1ccc(Br)s1 Amb17197093 [0,1,1,0,0,0|1,0,0]=3 778 B13R1.130 CC(C)C(N)C(=O)c1ccc(Cl)s1 Amb17195274 [0,1,1,0,0,0|1,1,0]=4 779 B13R1.130 CC(C)N(C)C(=O)c1csc(Br)n1 Amb35686151 [0,1,1,0,0,0|2,0,0]=4 780 B13R1.130 CC(C)[C@@H](N)C(=O)c1ccc(Cl)s1 Amb35617840 [0,1,1,0,0,0|1,1,0]=4 781 B13R1.130 CC(C)[C@H](N)C(=O)c1ccc(Cl)s1 Amb35617670 [0,1,1,0,0,0|1,1,0]=4 782 B13R1.130 CN(C)C(=O)C(=O)c1ccc(Br)s1 Amb17358652 [0,1,1,0,0,0|2,0,0]=4 783 B13R1.130 Cc1ccc(C(=O)C(N)C(C)C)s1 Amb27655184 [0,1,1,0,0,0|2,0,0]=4 784 B13R1.130 Cc1ccc(C(=O)N(C)C(C)C)o1 Amb27802060 [0,1,1,0,0,0|1,1,0]=4 785 B13R1.130 Cc1ccc(C(=O)[C@@H](N)C(C)C)s1 Amb35737396 [0,1,1,0,0,0|2,0,0]=4 786 B13R1.130 Cc1ccc(C(=O)[C@H](N)C(C)C)s1 Amb35617838 [0,1,1,0,0,0|2,0,0]=4 787 B13R1.712 CC(C)NC(CO)c1ccc(Br)s1 Amb18590782 [0,1,1,0,0,0|0,0,2]=4 788 B13R1.712 CC(C)N\C(=N\N)c1ccc(Cl)s1 Amb27403743 [0,1,1,0,0,0|1,1,0]=4 789 B13R1.712 CC(C)\C=C(/C#N)c1ccc(Br)s1 Amb17264941 [0,1,1,0,0,0|2,0,0]=4 790 B13R1.3427 CC(C)(C)CC(=O)c1ccc(Br)o1 Amb27415895 [0,1,1,0,0,0|1,1,0]=4 791 B13R1.3427 CC(C)(C)CC(=O)c1ccc(Br)s1 Amb18589125 [0,1,1,0,0,0|1,0,0]=3 792 B13R1.3427 CC(C)(C)NC(=O)c1ccc(Br)o1 Amb2221147 [0,1,1,0,0,0|0,1,0]=3 793 B13R1.3427 CC(C)(C)NC(=O)c1ccc(Br)s1 Amb6536316 [0,1,1,0,0,0|0,0,0]=2 794 B13R1.3427 CC(C)(C)NC(=O)c1ccc(Cl)s1 Amb11228748 [0,1,1,0,0,0|0,1,0]=3 795 B13R1.3427 CC(C)(C)NC(=O)c1ccc(N)o1 Amb18625391 [0,1,1,0,0,0|1,1,0]=4 796 B13R1.3427 CC(C)(C)NC(=O)c1cnc(Br)s1 Amb27459667 [0,1,1,0,0,0|1,0,0]=3 797 B13R1.3427 CC(C)(C)NC(=O)c1ncc(N)s1 Amb24361821 [0,1,1,0,0,0|2,0,0]=4 798 B13R1.3427 CC(C)(C)NS(=O)c1ccc(Cl)s1 Amb2613289 [0,1,1,0,0,0|1,1,0]=4 799 B13R1.3427 CC(C)(C)OC(=O)c1ccc(Br)o1 Amb26502709 [0,1,1,0,0,0|1,1,0]=4 800 B13R1.3427 CC(C)(C)OC(=O)c1ccc(Br)s1 Amb26319627 [0,1,1,0,0,0|1,0,0]=3 801 B13R1.3427 CC(C)(C)OC(=O)c1ccc(Cl)s1 Amb27874840 [0,1,1,0,0,0|1,1,0]=4 802 B13R1.3427 CC(C)(C)OC(=O)c1ccc(N)s1 Amb28063996 [0,1,1,0,0,0|2,0,0]=4 803 B13R1.3427 CC(C)(C)OC(=O)c1ccc(O)s1 Amb27845156 [0,1,1,0,0,0|2,0,0]=4 804 B13R1.3427 CC(C)(C)OC(=O)c1ncc(Br)s1 Amb35710782 [0,1,1,0,0,0|2,0,0]=4 805 B13R1.3427 Cc1ccc(C(=O)NC(C)(C)C)o1 Amb17788305 [0,1,1,0,0,0|1,1,0]=4 806 B13R1.3427 Cc1ccc(C(=O)OC(C)(C)C)s1 Amb25923882 [0,1,1,0,0,0|2,0,0]=4 807 B13R1.3427 Cc1ncc(C(=O)NC(C)(C)C)s1 Amb19305014 [0,1,1,0,0,0|2,0,0]=4 808 B13R1.3448 CC(=O)NC(=O)c1cc(Br)c(Br)s1 Amb27953299 [0,1,1,0,0,0|1,0,1]=4 809 B13R1.3448 CC(=O)NC(=O)c1cc(C)c(Br)s1 Amb27640887 [0,1,1,0,0,0|1,0,1]=4 810 B13R1.3448 CC(C)NC(=O)c1cc(Br)c(Cl)o1 Amb23539524 [0,1,1,0,0,0|0,2,0]=4 811 B13R1.3448 CC(C)NC(=O)c1cn(C)c(Br)n1 Amb29877149 [0,1,1,0,0,0|2,0,0]=4 812 B13R1.3448 CC(C)OC(=O)c1cc(Br)c(Br)s1 Amb26330300 [0,1,1,0,0,0|1,0,0]=3 813 B13R1.3448 Cc1cc(C(=O)CC(C)C)sc1C Amb28313248 [0,1,1,0,0,0|2,0,0]=4 814 B13R1.3448 Cc1cc(C(=O)NC(C)C)sc1C Amb8341963 [0,1,1,0,0,0|1,0,0]=3 815 B13R1.3448 Cc1cc(C(=O)NN(C)C)sc1C Amb27586180 [0,1,1,0,0,0|2,0,0]=4 816 B13R1.3448 Cc1cc(C(=O)OC(C)C)sc1Br Amb27415992 [0,1,1,0,0,0|1,0,0]=3 817 B13R1.3448 Cc1sc(C(=O)CC(C)C)cc1N Amb18188338 [0,1,1,0,0,0|2,0,0]=4 818 B13R1.3465 Cc1cc(C)c(C(=O)CC(C)C)s1 Amb27814050 [0,1,1,0,0,0|2,0,0]=4 819 B13R1.3465 Cc1cc(C)c(C(=O)OC(C)C)s1 Amb23541681 [0,1,1,0,0,0|2,0,0]=4 820 B13R1.3465 Cc1nc(C)c(C(=O)NC(C)C)s1 Amb19196622 [0,1,1,0,0,0|2,0,0]=4 821 B13R1.5895 Cc1ccc(C(=O)NC(C)C)n1C Amb8331886 [0,1,1,0,0,0|2,0,0]=4 822 B13R2.195 CC(NC1CC1C)c2cccs2 Amb18805441 [1,1,0,0,0,0|1,0,1]=4 823 B13R2.195 CC1CC1NC(=O)c2ccno2 Amb27857822 [1,1,0,0,0,0|1,1,0]=4 824 B13R2.195 CC1CC1NC(=O)c2cnns2 Amb27594536 [1,1,0,0,0,0|2,0,0]=4 825 B13R2.195 CC1CC1NC(=O)c2cocn2 Amb27970776 [1,1,0,0,0,0|2,0,0]=4 826 B13R2.195 CC1CC1NC(=O)c2nccs2 Amb27809431 [1,1,0,0,0,0|1,0,0]=3 827 B13R2.195 C[C@@H]1C[C@H]1NC(=O)c2cccs2 Amb28182741 [1,1,0,0,0,0|0,0,0]=2 828 B13R2.195 C[C@@H]1C[C@H]1NC(=O)c2ccno2 Amb28291935 [1,1,0,0,0,0|1,1,0]=4 829 B13R2.195 C[C@@H]1C[C@H]1NC(=O)c2ccsc2 Amb27802433 [1,1,0,0,0,0|2,0,0]=4 830 B13R2.195 NC1CC1NC(=O)c2ccno2 Amb9457156 [1,1,0,0,0,0|1,1,0]=4 831 B13R2.678 N#CC(NC1CC1)c2cccs2 Amb17043335 [1,1,0,0,0,0|1,0,1]=4 832 B13R2.678 N\N=C(\NC1CC1)c2ccco2 Amb18788361 [1,1,0,0,0,0|1,1,0]=4 833 B13R2.694 CC1(CC(=O)c2ccns2)CC1 Amb28344238 [1,1,0,0,0,0|2,0,0]=4 834 B13R2.694 CC1(CC(=O)c2cncs2)CC1 Amb35613088 [1,1,0,0,0,0|2,0,0]=4 835 B13R2.694 CC1(NC(=O)c2ccon2)CC1 Amb28293885 [1,1,0,0,0,0|2,0,0]=4 836 B13R2.694 CC1(NC(=O)c2cnco2)CC1 Amb28349787 [1,1,0,0,0,0|1,1,0]=4 837 B13R2.694 CC1(NC(=O)c2cnns2)CC1 Amb28345192 [1,1,0,0,0,0|2,0,0]=4 838 B13R2.694 CC1(NC(=O)c2cocn2)CC1 Amb27761298 [1,1,0,0,0,0|2,0,0]=4 839 B13R2.694 CC1(NC(=O)c2nccs2)CC1 Amb27652505 [1,1,0,0,0,0|1,0,0]=3 840 B13R2.694 NC1(CC(=O)c2cncs2)CC1 Amb35608724 [1,1,0,0,0,0|2,0,0]=4 841 B13R2.3062 O=S(=O)(NC1CC1)c2cccs2 Amb8275839 [1,1,0,0,0,0|1,0,0]=3 842 B13R2.3151 Cc1ccsc1C(C)NC2CC2 Amb24590630 [1,1,0,0,0,0|1,0,1]=4 843 B13R2.3151 Cc1cscc1C(=O)NC2CC2 Amb27972629 [1,1,0,0,0,0|2,0,0]=4 844 B13R2.3151 Cc1occc1C(=O)NC2CC2 Amb6874292 [1,1,0,0,0,0|2,0,0]=4 845 B13R2.3151 Cn1cccc1C(=O)NC2CC2 Amb22001090 [1,1,0,0,0,0|1,0,0]=3 846 B13R2.3151 Cn1nccc1C(=O)NC2CC2 Amb20406733 [1,1,0,0,0,0|2,0,0]=4 847 B13R2.3151 Nc1ccsc1C(=O)NC2CC2 Amb18281732 [1,1,0,0,0,0|0,0,0]=2 848 B13R2.3151 Nc1sccc1C(=O)NC2CC2 Amb6549987 [1,1,0,0,0,0|2,0,0]=4 849 B13R2.3151 O=C(CC1CC1)c2occc2Br Amb27606555 [1,1,0,0,0,0|1,1,0]=4 850 B13R2.3151 O=C(CC1CC1)c2sccc2I Amb28282244 [1,1,0,0,0,0|1,0,0]=3 851 B13R2.3151 O=C(NC1CC1)c2ccsc2Br Amb35712880 [1,1,0,0,0,0|2,0,0]=4 852 B13R2.3151 O=C(NC1CC1)c2ncsc2Br Amb28188028 [1,1,0,0,0,0|2,0,0]=4 853 B13R2.3151 O=C(NC1CC1)c2nscc2Br Amb35705993 [1,1,0,0,0,0|2,0,0]=4 854 B13R2.3151 O=C(NC1CC1)c2sccc2I Amb27417128 [1,1,0,0,0,0|0,0,0]=2 855 B13R2.3151 O=C(NC1CC1)c2scnc2Br Amb27479677 [1,1,0,0,0,0|1,0,0]=3 856 B13R2.3151 O=C(OC1CC1)c2sccc2Br Amb27810131 [1,1,0,0,0,0|1,0,0]=3 857 B13R2.3151 O=C(OC1CC1)c2sccc2F Amb27660188 [1,1,0,0,0,0|1,0,0]=3 858 B13R2.3151 O=C(OC1CC1)c2scnc2Cl Amb28198345 [1,1,0,0,0,0|2,0,0]=4 859 B13R2.8139 CC(C(=O)c1ccco1)C2CC2 Amb27207488 [1,1,0,0,0,0|1,1,0]=4 860 B13R2.8139 CC(C(=O)c1cncs1)C2CC2 Amb35648321 [1,1,0,0,0,0|2,0,0]=4 861 B13R2.8139 CN(C(=O)c1ccco1)C2CC2 Amb27754436 [1,1,0,0,0,0|0,1,0]=3 862 B13R2.8139 CN(C(=O)c1cccs1)C2CC2 Amb28141111 [1,1,0,0,0,0|0,0,0]=2 863 B13R2.8139 CN(C(=O)c1ccno1)C2CC2 Amb27605182 [1,1,0,0,0,0|1,1,0]=4 864 B13R2.8139 CN(C(=O)c1cnco1)C2CC2 Amb27396462 [1,1,0,0,0,0|1,1,0]=4 865 B13R2.8139 CN(C(=O)c1cncs1)C2CC2 Amb28293832 [1,1,0,0,0,0|1,0,0]=3 866 B13R2.8139 CN(C(=O)c1cocn1)C2CC2 Amb28185740 [1,1,0,0,0,0|2,0,0]=4 867 B13R2.8139 CN(C(=O)c1nccs1)C2CC2 Amb27178931 [1,1,0,0,0,0|1,0,0]=3 868 B13R2.8139 NC(C(=O)c1ccco1)C2CC2 Amb27787319 [1,1,0,0,0,0|1,1,0]=4 869 B13R2.8139 NC(C(=O)c1cccs1)C2CC2 Amb27396031 [1,1,0,0,0,0|1,0,0]=3 870 B13R2.8139 NC(C(=O)c1ccns1)C2CC2 Amb27795980 [1,1,0,0,0,0|2,0,0]=4 871 B13R2.8139 NC(C(=O)c1cncs1)C2CC2 Amb35608616 [1,1,0,0,0,0|2,0,0]=4 872 B13R2.8139 O=C(c1cccs1)C(O)C2CC2 Amb27656520 [1,1,0,0,0,0|1,0,0]=3 873 B13R2.8139 O=C(c1cncs1)C(O)C2CC2 Amb35613306 [1,1,0,0,0,0|2,0,0]=4 874 B13R2.143 CC1CC1NCc2ncc(Br)s2 Amb28206900 [1,1,0,0,0,0|1,0,1]=4 875 B13R2.143 C[C@@H]1C[C@H]1NCc2ccc(Br)s2 Amb28069358 [1,1,0,0,0,0|0,0,1]=3 876 B13R2.2465 O=Cc1ccc(\C=C\C2CC2)s1 Amb27205406 [1,1,0,0,0,0|2,0,0]=4 877 B13R2.2966 CC1(NCc2ncc(Br)s2)CC1 Amb28206879 [1,1,0,0,0,0|1,0,1]=4 878 B13R2.2966 NC1(CCc2ccc(Br)s2)CC1 Amb33007902 [1,1,0,0,0,0|1,0,1]=4 879 B13R2.2966 OC1(CCc2ccc(Br)s2)CC1 Amb33008017 [1,1,0,0,0,0|1,0,1]=4 880 B13R2.2972 CN(Cc1ccc(Br)o1)C2CC2 Amb28208151 [1,1,0,0,0,0|0,1,1]=4 881 B13R2.2972 NC(Cc1ccc(Br)s1)C2CC2 Amb18993578 [1,1,0,0,0,0|1,0,1]=4 882 B13R2.2972 OC(Cc1ccc(Br)s1)C2CC2 Amb27479141 [1,1,0,0,0,0|1,0,1]=4 883 B13R2.3002 Cc1nc(CNC2CC2)sc1Br Amb25682677 [1,1,0,0,0,0|1,0,1]=4 884 B13R2.80 CNC(c1ccc(Br)s1)C2CC2 Amb18972112 [0,1,0,0,1,0|1,0,1]=4 885 B13R2.80 ClCC(c1ccc(Br)s1)C2CC2 Amb17271959 [0,1,0,0,1,0|1,0,1]=4 886 B13R2.80 NCC(c1ccc(Br)s1)C2CC2 Amb17258168 [0,1,0,0,1,0|1,0,1]=4 887 B13R2.80 O=CC(c1ccc(Br)s1)C2CC2 Amb17257514 [0,1,0,0,1,0|0,0,1]=3 888 B13R2.80 O=CC(c1ccc(Cl)s1)C2CC2 Amb17237210 [0,1,0,0,1,0|0,1,1]=4 889 B13R2.80 OCC(c1ccc(Br)s1)C2CC2 Amb17258955 [0,1,0,0,1,0|0,0,2]=4 890 B13R2.2466 COc1ccc(C(=O)C2CC2)s1 Amb27206287 [0,1,0,0,1,0|1,0,0]=3 891 B13R2.2466 O=C(c1ncc(CO)s1)C2CC2 Amb33250855 [0,1,0,0,1,0|2,0,0]=4 892 B13R2.2466 O=Cc1ccc(C(=O)C2CC2)o1 Amb27793845 [0,1,0,0,1,0|1,1,0]=4 893 B13R2.2977 CC1CC1C(=O)c2ccc(Br)s2 Amb28365631 [0,1,0,0,1,0|0,0,0]=2 894 B13R2.2977 CC1CC1C(=O)c2nc(Br)cs2 Amb27210400 [0,1,0,0,1,0|2,0,0]=4 895 B13R2.2977 CC1CC1C(Cl)c2ccc(Br)s2 Amb27852955 [0,1,0,0,1,0|1,0,1]=4 896 B13R2.2977 CC1CC1C(N)c2ccc(Br)s2 Amb27425230 [0,1,0,0,1,0|1,0,1]=4 897 B13R2.2977 Cc1ncc(C(=O)C2CC2C)s1 Amb35632667 [0,1,0,0,1,0|2,0,0]=4 898 B13R2.2997 Brc1cc(C(Br)C2CC2)sc1Br Amb27972598 [0,1,0,0,1,0|1,0,1]=4 899 B13R2.2997 Cc1cc(C(=O)C2CC2)sc1C Amb27654665 [0,1,0,0,1,0|1,0,0]=3 900 B13R2.2997 Cc1cc([C@@H](N)C2CC2)sc1Br Amb28042257 [0,1,0,0,1,0|1,0,1]=4 901 B13R2.2997 Cc1nc(C(=O)C2CC2)sc1C Amb19649073 [0,1,0,0,1,0|2,0,0]=4 902 B13R2.2997 Cc1sc(C(=O)C2CC2)cc1N Amb18824061 [0,1,0,0,1,0|1,0,0]=3 903 B13R2.2997 O=C(c1cc(Br)c(Br)s1)C2CC2 Amb27451463 [0,1,0,0,1,0|0,0,0]=2 904 B13R2.2997 O=C(c1cc(Cl)c(Br)s1)C2CC2 Amb27461872 [0,1,0,0,1,0|0,0,0]=2 905 B13R2.2997 OC(c1cc(Br)c(Br)s1)C2CC2 Amb28063075 [0,1,0,0,1,0|0,0,2]=4 906 B13R2.7157 O=C(c1scc(Br)c1Br)C2CC2 Amb27947209 [0,1,0,0,1,0|2,0,0]=4 907 B13R2.10106 CC1(C(=O)c2cc(Br)cs2)CC1 Amb18071831 [0,1,0,0,1,0|2,0,0]=4 908 B13R2.10106 CC1(C(=O)c2ccc(Br)s2)CC1 Amb18070556 [0,1,0,0,1,0|0,0,0]=2 909 B13R2.10106 CC1(C(=O)c2ccc(Cl)s2)CC1 Amb18565218 [0,1,0,0,1,0|0,1,0]=3 910 B13R2.10106 CC1(C(=O)c2nc(Br)cs2)CC1 Amb28343430 [0,1,0,0,1,0|2,0,0]=4 911 B13R2.10106 CC1(C(Br)c2ccc(Br)s2)CC1 Amb27948405 [0,1,0,0,1,0|1,0,1]=4 912 B13R2.10106 CC1(C(Cl)c2ccc(Br)s2)CC1 Amb27264511 [0,1,0,0,1,0|1,0,1]=4 913 B13R2.10106 CC1(C(N)c2ccc(Br)s2)CC1 Amb18579720 [0,1,0,0,1,0|1,0,1]=4 914 B13R2.10106 Cc1ccc(C(=O)C2(C)CC2)o1 Amb27226947 [0,1,0,0,1,0|1,1,0]=4 915 B13R2.10106 Cc1ncc(C(=O)C2(C)CC2)s1 Amb35632668 [0,1,0,0,1,0|2,0,0]=4 916 B13R2.10106 Cc1ncc(C(=O)C2(N)CC2)s1 Amb35640577 [0,1,0,0,1,0|2,0,0]=4 917 B13R2.10165 Cc1cc(C)c(C(=O)C2CC2)s1 Amb27448246 [0,1,0,0,1,0|1,0,0]=3 918 B13R2.10165 Cc1nc(C)c(C(=O)C2CC2)s1 Amb28410375 [0,1,0,0,1,0|2,0,0]=4 919 B13R2.10165 Cc1oc(Br)cc1C(=O)C2CC2 Amb28248172 [0,1,0,0,1,0|2,0,0]=4 920 B15R2.447 CNc1ccc(C(=O)NC2CC2)cn1 Amb18986971 [0,1,0,0,0,1|2,0,0]=4 921 B15R2.447 COc1ccc(C(=O)NC2CC2)cn1 Amb26937135 [0,1,0,0,0,1|2,0,0]=4 922 B15R2.447 CSc1ccc(C(=O)NC2CC2)cc1 Amb33546285 [0,1,0,0,0,1|2,0,0]=4 923 B15R2.447 N#Cc1ccc(C(=O)NC2CC2)cc1 Amb514407 [0,1,0,0,0,1|2,0,0]=4 924 B15R2.447 NCc1ccc(C(=O)NC2CC2)cc1 Amb10610309 [0,1,0,0,0,1|2,0,0]=4 925 B15R2.447 NCc1ccc(C(=O)NC2CC2)cc1 Amb1113023 [0,1,0,0,0,1|2,0,0]=4 926 B15R2.447 NCc1ccc(C(=O)NC2CC2)nc1 Amb18910128 [0,1,0,0,0,1|2,0,0]=4 927 B15R2.447 NNc1ccc(C(=O)NC2CC2)cn1 Amb19050510 [0,1,0,0,0,1|2,0,0]=4 928 B15R2.447 NNc1ccc(C(=O)NC2CC2)nc1 Amb27262390 [0,1,0,0,0,1|2,0,0]=4 929 B15R2.447 O=C(NC1CC1)c2ccc(CCl)cc2 Amb8846418 [0,1,0,0,0,1|1,1,0]=4 930 B15R2.447 O=C(NC1CC1)c2ccc(CO)cn2 Amb28340981 [0,1,0,0,0,1|2,0,0]=4 931 B15R2.447 O=Cc1ccc(C(=O)NC2CC2)cc1 Amb6892345 [0,1,0,0,0,1|2,0,0]=4 932 B15R2.1521 CC1(NC(=O)c2ccc(F)cc2)CC1 Amb27476888 [0,1,0,0,0,1|1,1,0]=4 933 B15R2.1521 CC1(NC(=O)c2ccc(F)nc2)CC1 Amb27189372 [0,1,0,0,0,1|1,1,0]=4 934 B15R2.1521 NC1(CC(=O)c2ccc(Br)cc2)CC1 Amb35626043 [0,1,0,0,0,1|2,0,0]=4 935 B15R2.1527 CC(C(=O)c1ccc(Br)cc1)C2CC2 Amb27598637 [0,1,0,0,0,1|2,0,0]=4 936 B15R2.1527 CN(C(=O)C1=NNC(=O)C=C1)C2CC2 Amb27191237 [0,1,0,0,0,1|2,0,0]=4 937 B15R2.1527 CN(C(=O)c1ccc(Br)cn1)C2CC2 Amb28313208 [0,1,0,0,0,1|1,0,0]=3 938 B15R2.1527 CN(C(=O)c1ccc(Br)nc1)C2CC2 Amb28240789 [0,1,0,0,0,1|1,0,0]=3 939 B15R2.1527 CN(C(=O)c1ccc(Cl)nc1)C2CC2 Amb8874133 [0,1,0,0,0,1|1,1,0]=4 940 B15R2.1527 CN(C(=O)c1ccc(Cl)nn1)C2CC2 Amb27875818 [0,1,0,0,0,1|1,1,0]=4 941 B15R2.1527 CN(C(=O)c1ccc(F)cc1)C2CC2 Amb19042013 [0,1,0,0,0,1|1,1,0]=4 942 B15R2.1527 CN(C(=O)c1ccc(I)cc1)C2CC2 Amb27746739 [0,1,0,0,0,1|1,1,0]=4 943 B15R2.1527 CN(C(=O)c1ccc(N)cc1)C2CC2 Amb8891903 [0,1,0,0,0,1|2,0,0]=4 944 B15R2.1527 CN(C(=O)c1ccc(N)cn1)C2CC2 Amb27487062 [0,1,0,0,0,1|2,0,0]=4 945 B15R2.1527 NC(C(=O)c1ccc(Br)cc1)C2CC2 Amb35656685 [0,1,0,0,0,1|2,0,0]=4 946 B15R2.1527 O=C(c1ccc(Br)cc1)C(O)C2CC2 Amb35591595 [0,1,0,0,0,1|2,0,0]=4 947 B15R2.1529 CC1CC1NC(=O)C2=CNC(=O)C=C2 Amb19073819 [0,1,0,0,0,1|2,0,0]=4 948 B15R2.1529 CC1CC1NC(=O)c2ccc(N)cn2 Amb27462925 [0,1,0,0,0,1|2,0,0]=4 949 B15R2.1529 CC1CC1NC(=O)c2ccc(O)cc2 Amb19073291 [0,1,0,0,0,1|2,0,0]=4 950 B15R2.1529 CC1CC1NC(=O)c2ccc(S)cc2 Amb27432061 [0,1,0,0,0,1|2,0,0]=4 951 B15R2.1529 Cc1ccc(C(=O)NC2CC2N)nn1 Amb27624832 [0,1,0,0,0,1|2,0,0]=4 952 B15R2.1529 NC1CC1NC(=O)C2=COC(=O)C=C2 Amb18281062 [0,1,0,0,0,1|1,1,0]=4 953 B15R2.1529 NC1CC1NC(=O)c2ccc(Br)cc2 Amb9457313 [0,1,0,0,0,1|1,0,0]=3 954 B15R2.7543 Cc1cc(Br)ccc1C(=N)NC2CC2 Amb27482190 [0,1,0,0,0,1|2,0,0]=4 955 B15R2.7543 Cc1cc(Br)ccc1C(=O)NC2CC2 Amb25141330 [0,1,0,0,0,1|1,0,0]=3 956 B15R2.7543 Cc1cc(N)ccc1C(=O)NC2CC2 Amb18957318 [0,1,0,0,0,1|2,0,0]=4 957 B15R2.7543 Cc1cc(O)ccc1C(=O)NC2CC2 Amb26317118 [0,1,0,0,0,1|2,0,0]=4 958 B15R2.7543 Cc1ccc(C(=O)NC2CC2)c(C)c1 Amb8341134 [0,1,0,0,0,1|2,0,0]=4 959 B15R2.7543 Cc1ccc(C(=O)NC2CC2)c(Cl)c1 Amb19558265 [0,1,0,0,0,1|2,0,0]=4 960 B15R2.7543 Cc1ccc(C(=O)NC2CC2)c(N)c1 Amb28249937 [0,1,0,0,0,1|2,0,0]=4 961 B15R2.7543 Cc1ccc(C(=O)NC2CC2)c(N)n1 Amb35648602 [0,1,0,0,0,1|2,0,0]=4 962 B15R2.7543 N=C(NC1CC1)c2ncc(Br)cc2Br Amb28409388 [0,1,0,0,0,1|2,0,0]=4 963 B15R2.7543 Nc1cc(Br)ccc1C(=O)NC2CC2 Amb27747545 [0,1,0,0,0,1|1,0,0]=3 964 B15R2.7543 Nc1cc(F)ccc1C(=O)NC2CC2 Amb27948901 [0,1,0,0,0,1|1,1,0]=4 965 B15R2.7543 Nc1ccc(C(=O)NC2CC2)c(Cl)c1 Amb1115721 [0,1,0,0,0,1|2,0,0]=4 966 B15R2.7543 Nc1ccc(C(=O)NC2CC2)c(O)c1 Amb27406681 [0,1,0,0,0,1|2,0,0]=4 967 B15R2.7543 O=C(CC1CC1)c2ccc(Br)cc2Cl Amb27252672 [0,1,0,0,0,1|2,0,0]=4 968 B15R2.7543 O=C(CC1CC1)c2ncc(Br)cc2Br Amb28070028 [0,1,0,0,0,1|2,0,0]=4 969 B15R2.7543 O=C(NC1CC1)c2ccc(Br)cc2Cl Amb26321323 [0,1,0,0,0,1|1,0,0]=3 970 B15R2.7543 O=C(NC1CC1)c2ccc(Br)cc2F Amb33548107 [0,1,0,0,0,1|1,0,0]=3 971 B15R2.7543 O=C(NC1CC1)c2ccc(Br)cc2S Amb28349901 [0,1,0,0,0,1|1,0,0]=3 972 B15R2.7543 O=C(NC1CC1)c2ccc(Cl)cc2Br Amb27606730 [0,1,0,0,0,1|1,1,0]=4 973 B15R2.7543 O=C(NC1CC1)c2ccc(Cl)cc2Cl Amb1008383 [0,1,0,0,0,1|1,1,0]=4 974 B15R2.7543 O=C(NC1CC1)c2ccc(Cl)cc2O Amb6671596 [0,1,0,0,0,1|1,1,0]=4 975 B15R2.7543 O=C(NC1CC1)c2ccc(F)cc2Cl Amb6506048 [0,1,0,0,0,1|1,1,0]=4 976 B15R2.7543 O=C(NC1CC1)c2ccc(F)cc2F Amb931362 [0,1,0,0,0,1|1,1,0]=4 977 B15R2.7543 O=C(NC1CC1)c2ccc(O)cc2F Amb28058264 [0,1,0,0,0,1|2,0,0]=4 978 B15R2.18898 Cc1cc(C(=O)CC2CC2)ccc1Br Amb27601491 [0,1,0,0,0,1|2,0,0]=4 979 B15R2.18898 Cc1cc(C(=O)NC2CC2)ccc1Br Amb27150837 [0,1,0,0,0,1|1,0,0]=3 980 B15R2.18898 Cc1cc(C(=O)NC2CC2)ccc1N Amb1119409 [0,1,0,0,0,1|2,0,0]=4 981 B15R2.18898 Cc1cc(C(=O)NC2CC2)ncc1Br Amb32414278 [0,1,0,0,0,1|1,0,0]=3 982 B15R2.18898 Cc1ccc(C(=O)NC2CC2)cc1Br Amb25165564 [0,1,0,0,0,1|2,0,0]=4 983 B15R2.18898 Cc1ccc(C(=O)NC2CC2)cc1Cl Amb2101344 [0,1,0,0,0,1|2,0,0]=4 984 B15R2.18898 Cc1ccc(C(=O)NC2CC2)cc1F Amb8342109 [0,1,0,0,0,1|2,0,0]=4 985 B15R2.18898 Cc1ccc(C(=O)NC2CC2)cc1I Amb25063041 [0,1,0,0,0,1|2,0,0]=4 986 B15R2.18898 Cc1ccc(C(=O)NC2CC2)cc1N Amb1111821 [0,1,0,0,0,1|2,0,0]=4 987 B15R2.18898 Cc1ccc(C(=O)NC2CC2)nc1C Amb27829493 [0,1,0,0,0,1|2,0,0]=4 988 B15R2.18898 Cn1nc(C(=O)NC2CC2)ccc1=O Amb7171237 [0,1,0,0,0,1|2,0,0]=4 989 B15R2.18898 Nc1cc(C(=O)NC2CC2)ccc1Br Amb17162035 [0,1,0,0,0,1|1,0,0]=3 990 B15R2.18898 Nc1cc(C(=O)NC2CC2)ccc1Cl Amb1121384 [0,1,0,0,0,1|1,1,0]=4 991 B15R2.18898 Nc1cc(C(=O)NC2CC2)ccc1F Amb9295343 [0,1,0,0,0,1|1,1,0]=4 992 B15R2.18898 Nc1ccc(C(=O)NC2CC2)cc1I Amb27413403 [0,1,0,0,0,1|2,0,0]=4 993 B15R2.18898 Nc1ccc(C(=O)NC2CC2)cc1O Amb27636855 [0,1,0,0,0,1|2,0,0]=4 994 B15R2.18898 Nc1ncc(C(=O)NC2CC2)cc1Br Amb27596370 [0,1,0,0,0,1|2,0,0]=4 995 B15R2.18898 O=C(CC1CC1)c2ccc(Br)c(Cl)c2 Amb27468271 [0,1,0,0,0,1|2,0,0]=4 996 B15R2.18898 O=C(CC1CC1)c2ccc(Br)c(F)c2 Amb27848267 [0,1,0,0,0,1|2,0,0]=4 997 B15R2.18898 O=C(NC1CC1)c2ccc(Br)c(Cl)c2 Amb27450875 [0,1,0,0,0,1|1,0,0]=3 998 B15R2.18898 O=C(NC1CC1)c2ccc(Br)c(F)c2 Amb11570961 [0,1,0,0,0,1|1,0,0]=3 999 B15R2.18898 O=C(NC1CC1)c2ccc(Cl)c(Br)c2 Amb16948148 [0,1,0,0,0,1|1,1,0]=4 1000 B15R2.18898 O=C(NC1CC1)c2ccc(Cl)c(I)c2 Amb24535648 [0,1,0,0,0,1|1,1,0]=4 1001 B15R2.18898 O=C(NC1CC1)c2ccc(F)c(Br)c2 Amb21856494 [0,1,0,0,0,1|1,1,0]=4 1002 B15R2.18898 O=C(NC1CC1)c2ccc(F)c(F)c2 Amb931001 [0,1,0,0,0,1|1,1,0]=4 1003 B15R2.18898 O=C(NC1CC1)c2ccc(F)c(O)c2 Amb28428491 [0,1,0,0,0,1|1,1,0]=4 1004 B15R2.18898 O=C(NC1CC1)c2ccc(F)c(S)c2 Amb27457418 [0,1,0,0,0,1|1,1,0]=4 1005 B15R2.18898 O=C(NC1CC1)c2ccc(I)c(O)c2 Amb27254370 [0,1,0,0,0,1|1,1,0]=4 1006 B15R2.18998 O=S(=O)(NC1CC1)c2ccc(Br)cc2 Amb6424156 [0,1,0,0,0,1|2,0,0]=4 1007 B15R2.18998 O=S(=O)(NC1CC1)c2ccc(Br)nc2 Amb17193853 [0,1,0,0,0,1|2,0,0]=4 1008 B15R2.6904 CC1(CC(=O)Nc2ncc(Br)s2)CC1 Amb27969642 [0,1,0,0,0,1|2,0,0]=4 1009 B15R2.6924 NC(C(=O)Nc1ncc(Br)s1)C2CC2 Amb28195655 [0,1,0,0,0,1|2,0,0]=4 1010 B15R2.6949 O=C(NC1CC1)C(=O)c2ccc(Br)s2 Amb17365967 [0,1,0,0,0,1|0,0,0]=2 1011 B15R2.6949 O=C(NC1CC1)C(=O)c2ccc(Cl)s2 Amb17344411 [0,1,0,0,0,1|0,1,0]=3 1012 B15R2.6949 O=C(NC1CC1)C(O)c2cc(Br)cs2 Amb25754275 [0,1,0,0,0,1|2,0,0]=4 1013 B15R2.6949 O=C(NC1CC1)C(O)c2ccc(Br)s2 Amb24450050 [0,1,0,0,0,1|0,0,0]=2 1014 B15R2.6949 O=C(NC1CC1)C(O)c2ccc(Cl)s2 Amb25310630 [0,1,0,0,0,1|0,1,0]=3 1015 B15R2.41571 Cc1nc(NC(=O)NC2CC2)sc1C Amb11347386 [0,1,0,0,0,1|2,0,0]=4 1016 B15R2.6913 CC1(CNC(=O)c2coc(Br)c2)CC1 Amb27843173 [0,1,0,0,0,1|2,0,0]=4 1017 B15R2.6913 CC1(CNC(=O)c2csc(Br)n2)CC1 Amb35691826 [0,1,0,0,0,1|2,0,0]=4 1018 B15R2.6923 CC(NC(=O)c1coc(Br)c1)C2CC2 Amb27843172 [0,1,0,0,0,1|2,0,0]=4 1019 B15R2.6923 CC(NC(=O)c1csc(Br)n1)C2CC2 Amb35691829 [0,1,0,0,0,1|2,0,0]=4 1020 B15R2.6923 Cc1ccc(C(=O)CC(=O)C2CC2)s1 Amb33129911 [0,1,0,0,0,1|2,0,0]=4 1021 B15R2.6923 O=C(CC(=O)C1CC1)c2ccc(Br)o2 Amb33129915 [0,1,0,0,0,1|1,1,0]=4 1022 B15R2.6923 O=C(CC(=O)C1CC1)c2ccc(Br)s2 Amb17365177 [0,1,0,0,0,1|1,0,0]=3 1023 B15R2.6923 O=C(CC(=O)C1CC1)c2ccc(Cl)s2 Amb17344212 [0,1,0,0,0,1|1,1,0]=4 1024 B15R2.6967 CC1CC1CNC(=O)c2ccc(Br)s2 Amb27964443 [0,1,0,0,0,1|0,0,0]=2 1025 B15R2.6967 CC1CC1CNC(=O)c2ccc(Cl)o2 Amb28410031 [0,1,0,0,0,1|0,2,0]=4 1026 B15R2.6967 CC1CC1CNC(=O)c2csc(Br)n2 Amb35691820 [0,1,0,0,0,1|2,0,0]=4 1027 B15R2.41617 Cc1cc(C(=O)NCC2CC2)sc1Br Amb27984619 [0,1,0,0,0,1|0,0,0]=2 1028 B15R2.41617 Cc1sc(C(=O)NCC2CC2)cc1N Amb18972186 [0,1,0,0,0,1|1,0,0]=3 1029 B15R2.41617 Cn1cc(C(=O)NCC2CC2)nc1Br Amb35589628 [0,1,0,0,0,1|2,0,0]=4 1030 B15R2.41617 O=C(NCC1CC1)c2cc(Br)c(Br)s2 Amb28190441 [0,1,0,0,0,1|0,0,0]=2 1031 B15R2.2456 COc1cccc(C(=O)NC2CC2)c1 Amb2638312 [0,1,0,0,0,1|2,0,0]=4 1032 B15R2.2456 N#Cc1cccc(C(=O)NC2CC2)c1 Amb6276302 [0,1,0,0,0,1|2,0,0]=4 1033 B15R2.2456 NCc1cccc(C(=O)NC2CC2)c1 Amb10203499 [0,1,0,0,0,1|2,0,0]=4 1034 B15R2.2456 NCc1cccc(C(=O)NC2CC2)c1 Amb1118782 [0,1,0,0,0,1|2,0,0]=4 1035 B15R2.2456 O=C(NC1CC1)c2cccc(CBr)c2 Amb17329200 [0,1,0,0,0,1|1,0,0]=3 1036 B15R2.6870 Cc1cc(C(=O)NC2CC2)cc(Cl)n1 Amb27189281 [0,1,0,0,0,1|1,1,0]=4 1037 B15R2.6870 Cc1cc(C(=O)NC2CC2)nc(Cl)n1 Amb28064220 [0,1,0,0,0,1|1,1,0]=4 1038 B15R2.6870 Nc1cc(Br)cc(C(=O)NC2CC2)c1 Amb28387673 [0,1,0,0,0,1|1,0,0]=3 1039 B15R2.6870 Nc1cc(Cl)cc(C(=O)NC2CC2)c1 Amb27482539 [0,1,0,0,0,1|1,1,0]=4 1040 B15R2.6870 Nc1cc(F)cc(C(=O)NC2CC2)c1 Amb27389773 [0,1,0,0,0,1|1,1,0]=4 1041 B15R2.6870 Nc1cc(I)cc(C(=O)NC2CC2)c1 Amb27814877 [0,1,0,0,0,1|1,1,0]=4 1042 B15R2.6870 Nc1cc(N)cc(C(=O)NC2CC2)c1 Amb18281726 [0,1,0,0,0,1|2,0,0]=4 1043 B15R2.6870 O=C(CC1CC1)c2cc(F)cc(Br)c2 Amb27455841 [0,1,0,0,0,1|2,0,0]=4 1044 B15R2.6870 O=C(NC1CC1)c2cc(Cl)cc(Br)c2 Amb16948147 [0,1,0,0,0,1|1,0,0]=3 1045 B15R2.6870 O=C(NC1CC1)c2cc(Cl)cc(Cl)c2 Amb329336 [0,1,0,0,0,1|1,1,0]=4 1046 B15R2.6870 O=C(NC1CC1)c2cc(Cl)nc(Cl)c2 Amb9204115 [0,1,0,0,0,1|1,1,0]=4 1047 B15R2.6870 O=C(NC1CC1)c2cc(F)cc(Br)c2 Amb9198354 [0,1,0,0,0,1|1,0,0]=3 1048 B15R2.6870 O=C(NC1CC1)c2cc(O)nc(O)c2 Amb28208221 [0,1,0,0,0,1|2,0,0]=4 1049 B15R2.7160 Cc1c(Br)cccc1C(=O)NC2CC2 Amb27168530 [0,1,0,0,0,1|1,0,0]=3 1050 B15R2.7160 Cc1c(N)cccc1C(=O)NC2CC2 Amb1115814 [0,1,0,0,0,1|2,0,0]=4 1051 B15R2.7160 Cc1c(N)cncc1C(=O)NC2CC2 Amb25800989 [0,1,0,0,0,1|2,0,0]=4 1052 B15R2.7160 Cc1cccc(C(=O)NC2CC2)c1N Amb1121313 [0,1,0,0,0,1|2,0,0]=4 1053 B15R2.7160 Nc1c(Br)cccc1C(=O)NC2CC2 Amb18273843 [0,1,0,0,0,1|1,0,0]=3 1054 B15R2.7160 Nc1c(I)cccc1C(=O)NC2CC2 Amb27421477 [0,1,0,0,0,1|1,1,0]=4 1055 B15R2.7160 Nc1cccc(C(=O)NC2CC2)c1Br Amb28186836 [0,1,0,0,0,1|2,0,0]=4 1056 B15R2.7160 Nc1cccc(C(=O)NC2CC2)c1F Amb27191395 [0,1,0,0,0,1|2,0,0]=4 1057 B15R2.7160 O=C(NC1CC1)c2cccc(Cl)c2Cl Amb4225 [0,1,0,0,0,1|1,1,0]=4 1058 B15R2.7160 O=C(NC1CC1)c2cccc(Cl)c2F Amb28244606 [0,1,0,0,0,1|1,1,0]=4 1059 B15R2.7160 O=C(NC1CC1)c2cccc(O)c2F Amb28293198 [0,1,0,0,0,1|2,0,0]=4 1060 B15R2.15380 CC1(CC(=O)c2cccc(Br)c2)CC1 Amb35591614 [0,1,0,0,0,1|2,0,0]=4 1061 B15R2.15380 CC1(NC(=O)C2=CC=CC(=O)N2)CC1 Amb27859840 [0,1,0,0,0,1|2,0,0]=4 1062 B15R2.15380 CC1(NC(=O)c2cc(N)ccn2)CC1 Amb27253749 [0,1,0,0,0,1|2,0,0]=4 1063 B15R2.15380 CC1(NC(=O)c2cccc(N)n2)CC1 Amb28313913 [0,1,0,0,0,1|2,0,0]=4 1064 B15R2.15380 CC1(NC(=O)c2cccc(O)c2)CC1 Amb27602825 [0,1,0,0,0,1|2,0,0]=4 1065 B15R2.15380 CC1(NC(=O)c2ccnc(N)c2)CC1 Amb27786806 [0,1,0,0,0,1|2,0,0]=4 1066 B15R2.15380 NC1(CC(=O)c2cccc(Br)c2)CC1 Amb35591585 [0,1,0,0,0,1|2,0,0]=4 1067 B15R2.15385 CC(C(=O)c1cccc(Br)c1)C2CC2 Amb30033790 [0,1,0,0,0,1|2,0,0]=4 1068 B15R2.15385 CN(C(=O)C1=CC=CC(=O)N1)C2CC2 Amb27830485 [0,1,0,0,0,1|2,0,0]=4 1069 B15R2.15385 CN(C(=O)c1cccc(N)c1)C2CC2 Amb8891906 [0,1,0,0,0,1|2,0,0]=4 1070 B15R2.15385 CN(C(=O)c1cccc(N)n1)C2CC2 Amb18285003 [0,1,0,0,0,1|2,0,0]=4 1071 B15R2.15385 CN(C(=O)c1cccc(S)c1)C2CC2 Amb27833586 [0,1,0,0,0,1|2,0,0]=4 1072 B15R2.15385 NC(C(=O)c1cccc(Br)c1)C2CC2 Amb35591804 [0,1,0,0,0,1|2,0,0]=4 1073 B15R2.15385 O=C(c1cccc(Br)c1)C(O)C2CC2 Amb35614580 [0,1,0,0,0,1|2,0,0]=4 1074 B15R2.15386 CC1CC1NC(=O)c2cc(N)ccn2 Amb18961555 [0,1,0,0,0,1|2,0,0]=4 1075 B15R2.15386 CC1CC1NC(=O)c2cccc(N)n2 Amb18961552 [0,1,0,0,0,1|2,0,0]=4 1076 B15R2.15386 CC1CC1NC(=O)c2cncc(N)n2 Amb27592557 [0,1,0,0,0,1|2,0,0]=4 1077 B15R2.15386 NC1CC1NC(=O)C2=CC=CC(=O)N2 Amb27390359 [0,1,0,0,0,1|2,0,0]=4 1078 B15R2.15386 NC1CC1NC(=O)c2ccnc(Br)c2 Amb27205622 [0,1,0,0,0,1|1,0,0]=3 1079 B15R2.15386 NC1CC1NC(=O)c2cncc(Cl)c2 Amb27645755 [0,1,0,0,0,1|1,1,0]=4 1080 B15R2.15643 Cc1ccc(Br)c(C(=O)NC2CC2)c1 Amb28061148 [0,1,0,0,0,1|2,0,0]=4 1081 B15R2.15643 Cc1ccc(Br)cc1C(=O)NC2CC2 Amb28387874 [0,1,0,0,0,1|1,0,0]=3 1082 B15R2.15643 Cc1ccc(C)c(C(=O)NC2CC2)c1 Amb19556139 [0,1,0,0,0,1|2,0,0]=4 1083 B15R2.15643 Cc1ccc(Cl)cc1C(=O)NC2CC2 Amb24444880 [0,1,0,0,0,1|1,1,0]=4 1084 B15R2.15643 Cc1ccc(N)cc1C(=O)NC2CC2 Amb18952832 [0,1,0,0,0,1|2,0,0]=4 1085 B15R2.15643 NC1=CNC(=O)C(C(=O)NC2CC2)=C1 Amb28205477 [0,1,0,0,0,1|2,0,0]=4 1086 B15R2.15643 Nc1ccc(Cl)c(C(=O)NC2CC2)c1 Amb1117605 [0,1,0,0,0,1|2,0,0]=4 1087 B15R2.15643 Nc1ccc(Cl)cc1C(=O)NC2CC2 Amb1112184 [0,1,0,0,0,1|1,1,0]=4 1088 B15R2.15643 Nc1ccc(F)c(C(=O)NC2CC2)c1 Amb9371457 [0,1,0,0,0,1|2,0,0]=4 1089 B15R2.15643 Nc1ccc(F)cc1C(=O)NC2CC2 Amb8825277 [0,1,0,0,0,1|1,1,0]=4 1090 B15R2.15643 Nc1ncc(Br)nc1C(=O)NC2CC2 Amb28189940 [0,1,0,0,0,1|1,0,0]=3 1091 B15R2.15643 O=C(CC1CC1)c2cc(Br)ccc2F Amb27971946 [0,1,0,0,0,1|2,0,0]=4 1092 B15R2.15643 O=C(NC1CC1)c2cc(Br)ccc2Cl Amb6519368 [0,1,0,0,0,1|1,0,0]=3 1093 B15R2.15643 O=C(NC1CC1)c2cc(Br)ccc2I Amb26462114 [0,1,0,0,0,1|1,0,0]=3 1094 B15R2.15643 O=C(NC1CC1)c2cc(Br)ccc2O Amb124541 [0,1,0,0,0,1|1,0,0]=3 1095 B15R2.15643 O=C(NC1CC1)c2cc(Br)cnc2Cl Amb27405438 [0,1,0,0,0,1|1,0,0]=3 1096 B15R2.15643 O=C(NC1CC1)c2cc(Cl)ccc2Br Amb27219398 [0,1,0,0,0,1|1,1,0]=4 1097 B15R2.15643 O=C(NC1CC1)c2cc(Cl)ccc2Cl Amb6560548 [0,1,0,0,0,1|1,1,0]=4 1098 B15R2.15643 O=C(NC1CC1)c2cc(Cl)ccc2F Amb8253083 [0,1,0,0,0,1|1,1,0]=4 1099 B15R2.15643 O=C(NC1CC1)c2cc(F)ccc2Br Amb6267523 [0,1,0,0,0,1|1,1,0]=4 1100 B15R2.15643 O=C(NC1CC1)c2cc(F)ccc2F Amb931420 [0,1,0,0,0,1|1,1,0]=4 1101 B15R2.41973 O=S(=O)(NC1CC1)c2cccc(Br)c2 Amb95870 [0,1,0,0,0,1|2,0,0]=4 1102 B15R2.41973 O=S(=O)(NC1CC1)c2cncc(Br)c2 Amb17559409 [0,1,0,0,0,1|2,0,0]=4 1103 B15R2.6911 CC(N[C@@H]1CC[C@H]1O)c2ccc(Br)s2 Amb27803208 [0,1,0,0,0,1|1,0,1]=4 1104 B15R2.6911 CC1CCC1NC(=O)c2csc(Br)n2 Amb35691827 [0,1,0,0,0,1|2,0,0]=4 1105 B15R2.6911 Cc1ccc(C(=O)NC2CCC2O)s1 Amb33611837 [0,1,0,0,0,1|1,0,0]=3 1106 B15R2.6911 O=C(NC1CCC1O)c2ccc(Br)o2 Amb33611876 [0,1,0,0,0,1|0,1,0]=3 1107 B15R2.6912 CC(NC1CC(O)C1)c2ccc(Br)s2 Amb27800695 [0,1,0,0,0,1|1,0,1]=4 1108 B15R2.6912 CC(NC1CN(C)C1)c2ccc(Br)s2 Amb27660008 [0,1,0,0,0,1|1,0,1]=4 1109 B15R2.6912 CC1CC(NC(=O)c2coc(Br)c2)C1 Amb27256278 [0,1,0,0,0,1|2,0,0]=4 1110 B15R2.6912 CC1CC(NC(=O)c2csc(Br)n2)C1 Amb35691821 [0,1,0,0,0,1|2,0,0]=4 1111 B15R2.6912 CC1CN(CC(=O)c2ccc(Br)s2)C1 Amb35662917 [0,1,0,0,0,1|2,0,0]=4 1112 B15R2.6912 CN1CC(NC(=O)c2coc(Br)c2)C1 Amb27954002 [0,1,0,0,0,1|2,0,0]=4 1113 B15R2.6912 CN1CC(NC(=O)c2csc(Br)n2)C1 Amb35691851 [0,1,0,0,0,1|2,0,0]=4 1114 B15R2.6912 Cc1ccc(C(=O)NC2CC(O)C2)s1 Amb27446953 [0,1,0,0,0,1|1,0,0]=3 1115 B15R2.6912 NC1CC(NC(=O)c2csc(Br)c2)C1 Amb28136351 [0,1,0,0,0,1|2,0,0]=4 1116 B15R2.6912 O=C(NC1CC(O)C1)c2csc(Br)c2 Amb28061660 [0,1,0,0,0,1|2,0,0]=4 1117 B15R2.6912 O=C(NC1CC(O)C1)c2csc(Br)n2 Amb35691837 [0,1,0,0,0,1|2,0,0]=4 1118 B15R2.7090 Cc1cc(C)c(C(=O)CC2CCC2)s1 Amb27803453 [0,1,0,0,0,1|2,0,0]=4 1119 B15R2.7090 Cc1nc(N)sc1C(=O)NC2CNC2 Amb28400349 [0,1,0,0,0,1|2,0,0]=4 1120 B15R2.7090 Cn1cc(Br)cc1C(=O)NC2CCC2 Amb27475581 [0,1,0,0,0,1|2,0,0]=4 1121 B15R2.7090 Cn1cc(Br)cc1C(=O)NC2CNC2 Amb27755556 [0,1,0,0,0,1|2,0,0]=4 1122 B15R2.30516 CCc1ccc(C(=O)NC2COC2)s1 Amb27954426 [0,1,0,0,0,1|1,0,0]=3 1123 B15R2.30516 CNc1ncc(C(=O)NC2CCC2)s1 Amb27804644 [0,1,0,0,0,1|2,0,0]=4 1124 B15R2.30516 CSc1ccc(C(=O)NC2CNC2)o1 Amb28383092 [0,1,0,0,0,1|1,1,0]=4 1125 B15R2.41323 CC1(NC(=O)c2ccc(Br)o2)CCC1 Amb27238194 [0,1,0,0,0,1|0,1,0]=3 1126 B15R2.41323 CC1(NC(=O)c2ccc(Cl)o2)CCC1 Amb27594195 [0,1,0,0,0,1|0,2,0]=4 1127 B15R2.41323 CC1(NC(=O)c2ccc(Cl)o2)CNC1 Amb27214855 [0,1,0,0,0,1|0,2,0]=4 1128 B15R2.41323 CC1(NC(=O)c2coc(Br)c2)CCC1 Amb27843174 [0,1,0,0,0,1|2,0,0]=4 1129 B15R2.41323 CC1(NC(=O)c2csc(Br)n2)CCC1 Amb35691819 [0,1,0,0,0,1|2,0,0]=4 1130 B15R2.41323 Cc1ccc(C(=O)NC2(C)CNC2)s1 Amb27217357 [0,1,0,0,0,1|1,0,0]=3 1131 B15R2.41330 Cc1ccc(S(=O)(=O)NC2CNC2)s1 Amb27661263 [0,1,0,0,0,1|2,0,0]=4 1132 B15R2.41602 Cc1cc(C(=O)CC2CCC2)sc1Br Amb28315302 [0,1,0,0,0,1|1,0,0]=3 1133 B15R2.41602 Cc1sc(C(=O)NC2CCC2)cc1N Amb18961350 [0,1,0,0,0,1|1,0,0]=3 1134 B15R2.41602 Cn1cc(C(=O)NC2CCC2)nc1Br Amb35589625 [0,1,0,0,0,1|2,0,0]=4 1135 B15R2.41602 Cn1cc(C(=O)NC2CNC2)nc1Br Amb35589435 [0,1,0,0,0,1|2,0,0]=4 1136 B15R2.41602 Cn1cc(C(=O)NC2COC2)nc1Br Amb29877165 [0,1,0,0,0,1|2,0,0]=4 1137 B15R2.41602 O=C(CC1CCC1)c2cc(Br)c(Br)s2 Amb27875573 [0,1,0,0,0,1|1,0,0]=3 1138 B15R2.41602 O=C(NC1CCC1)c2cc(Br)c(Br)s2 Amb27486964 [0,1,0,0,0,1|0,0,0]=2 1139 B15R2.41602 O=C(NC1CNC1)c2cc(Br)c(Br)s2 Amb27452878 [0,1,0,0,0,1|0,0,0]=2 1140 B15R2.96980 CC(C(=O)c1ccc(Br)o1)C2CCC2 Amb35607323 [0,1,0,0,0,1|1,1,0]=4 1141 B15R2.96980 CC(C(=O)c1ccc(Br)s1)C2CCC2 Amb35607325 [0,1,0,0,0,1|1,0,0]=3 1142 B15R2.96980 CC(C(=O)c1ccc(Cl)s1)C2CCC2 Amb35607321 [0,1,0,0,0,1|1,1,0]=4 1143 B15R2.96980 CN(C(=O)c1ccc(Br)s1)C2CNC2 Amb27603872 [0,1,0,0,0,1|0,0,0]=2 1144 B15R2.96980 CN(C(=O)c1ccc(Cl)o1)C2CCC2 Amb27874954 [0,1,0,0,0,1|0,2,0]=4 1145 B15R2.96980 CN(C(=O)c1ccc(Cl)o1)C2CNC2 Amb27765313 [0,1,0,0,0,1|0,2,0]=4 1146 B15R2.96980 CN(C(=O)c1csc(Br)c1)C2CCC2 Amb27637478 [0,1,0,0,0,1|2,0,0]=4 1147 B15R2.96980 CN(C(=O)c1csc(Br)c1)C2CNC2 Amb28041282 [0,1,0,0,0,1|2,0,0]=4 1148 B15R2.96980 CN(C(=O)c1csc(Br)n1)C2CCC2 Amb35691823 [0,1,0,0,0,1|2,0,0]=4 1149 B15R2.96980 Cc1ccc(C(=O)C(C)C2CCC2)s1 Amb35607319 [0,1,0,0,0,1|2,0,0]=4 1150 B15R2.96980 Cc1ccc(C(=O)C(C)C2CNC2)s1 Amb27595480 [0,1,0,0,0,1|2,0,0]=4 1151 B15R2.96980 Cc1ccc(C(=O)C(N)C2CCC2)s1 Amb28346045 [0,1,0,0,0,1|2,0,0]=4 1152 B15R2.3819 N\N=C(/NC1CC1)c2cc(Br)c(Br)s2 Amb27612488 [0,2,0,0,0,0|1,0,0]=3 1153 B15R2.6950 O=C(O)C(NC1CC1)c2ccc(Br)s2 Amb18887631 [0,2,0,0,0,0|0,0,1]=3 1154 B15R2.6950 O=C(O)C(NC1CC1)c2ccc(Cl)s2 Amb18869282 [0,2,0,0,0,0|0,1,1]=4 1155 B15R2.39483 CCc1ccc(\C(=N\N)NC2CC2)s1 Amb27956680 [0,2,0,0,0,0|2,0,0]=4 1156 B15R2.4550 CC1CC1NC(=O)c2ccc(CN)o2 Amb27182172 [0,2,0,0,0,0|1,1,0]=4 1157 B15R2.4550 CCc1ccc(C(=O)NC2CC2N)o1 Amb27806814 [0,2,0,0,0,0|1,1,0]=4 1158 B15R2.4550 CNc1ncc(C(=O)N[C@@H]2C[C@H]2C)s1 Amb27945086 [0,2,0,0,0,0|2,0,0]=4 1159 B15R2.4550 CSc1ccc(C(=O)NC2CC2N)o1 Amb27810216 [0,2,0,0,0,0|1,1,0]=4 1160 B15R2.4615 CCc1cc(C(=O)NC2CC2)sc1C Amb8243155 [0,2,0,0,0,0|1,0,0]=3 1161 B15R2.4615 CCc1sc(C(=O)NC2CC2)cc1C Amb8254008 [0,2,0,0,0,0|1,0,0]=3 1162 B15R2.4615 CCn1cc(C(=O)NC2CC2)nc1Br Amb35607926 [0,2,0,0,0,0|2,0,0]=4 1163 B15R2.4615 Cc1oc(C(=O)NC2CC2)cc1CCl Amb17327119 [0,2,0,0,0,0|1,1,0]=4 1164 B15R2.4682 Cc1nc(CN)sc1C(=O)NC2CC2 Amb17339710 [0,2,0,0,0,0|2,0,0]=4 1165 B15R2.16207 CC(Cl)c1ccc(C(=O)NC2CC2)o1 Amb17331369 [0,2,0,0,0,0|0,2,0]=4 1166 B15R2.16207 CC(N)c1ccc(C(=O)NC2CC2)o1 Amb5738211 [0,2,0,0,0,0|1,1,0]=4 1167 B15R2.16207 O=C(NC1CC1)c2ccc([N+](=O)[O-])s2 Amb6598862 [0,2,0,0,0,0|1,0,0]=3 1168 B15R2.16207 O=C(O)c1ccc(C(=O)NC2CC2)o1 Amb27483704 [0,2,0,0,0,0|1,1,0]=4 1169 B15R2.39443 CN(C(=O)c1ccc(C#N)o1)C2CC2 Amb28352212 [0,2,0,0,0,0|1,1,0]=4 1170 B15R2.1711 CCC1CC1NC(=O)c2ccc(Br)s2 Amb28251912 [0,2,0,0,0,0|0,0,0]=2 1171 B15R2.1711 CCC1CC1NC(=O)c2ccc(Cl)o2 Amb27597215 [0,2,0,0,0,0|0,2,0]=4 1172 B15R2.1711 CCC1CC1NC(=O)c2csc(Br)n2 Amb35691825 [0,2,0,0,0,0|2,0,0]=4 1173 B15R2.6917 CC1CC1NS(=O)(=O)c2ccc(Br)s2 Amb28325394 [0,2,0,0,0,0|1,0,0]=3 1174 B15R2.7029 CC1CC1NC(=O)c2cn(C)c(Br)n2 Amb35589626 [0,2,0,0,0,0|2,0,0]=4 1175 B15R2.7029 Cc1sc(C(=O)NC2CC2C)cc1N Amb18961493 [0,2,0,0,0,0|1,0,0]=3 1176 B15R2.7029 Cn1cc(C(=O)NC2CC2N)nc1Br Amb35589436 [0,2,0,0,0,0|2,0,0]=4 1177 B15R2.41325 CC1(C)CC1NC(=O)c2coc(Br)c2 Amb27785732 [0,2,0,0,0,0|2,0,0]=4 1178 B15R2.41325 CC1(C)CC1NC(=O)c2csc(Br)n2 Amb35691833 [0,2,0,0,0,0|2,0,0]=4 1179 B15R2.41325 Cc1ccc(C(=O)CC2CC2(F)F)s1 Amb35640425 [0,2,0,0,0,0|2,0,0]=4 1180 B15R2.41325 O=C(CC1CC1(F)F)c2ccc(Br)o2 Amb35605116 [0,2,0,0,0,0|1,1,0]=4 1181 B15R2.41325 O=C(CC1CC1(F)F)c2ccc(Br)s2 Amb35627851 [0,2,0,0,0,0|1,0,0]=3 1182 B15R2.41325 O=C(CC1CC1(F)F)c2ccc(Cl)s2 Amb35640424 [0,2,0,0,0,0|1,1,0]=4 1183 B15R2.41776 Cc1cc(C)c(C(=O)NC2CC2N)o1 Amb28192796 [0,2,0,0,0,0|1,1,0]=4 1184 B15R2.41776 Cc1nc(N)sc1C(=O)NC2CC2N Amb27448377 [0,2,0,0,0,0|2,0,0]=4 1185 B15R2.41776 Cc1oc(Br)cc1C(=O)NC2CC2C Amb28343732 [0,2,0,0,0,0|2,0,0]=4 1186 B15R2.5217 CCC1(NC(=O)c2ccc(Cl)o2)CC1 Amb27214375 [0,2,0,0,0,0|0,2,0]=4 1187 B15R2.5217 CCC1(NC(=O)c2coc(Br)c2)CC1 Amb27426441 [0,2,0,0,0,0|2,0,0]=4 1188 B15R2.5217 CCC1(NC(=O)c2csc(Br)n2)CC1 Amb30017168 [0,2,0,0,0,0|2,0,0]=4 1189 B15R2.5217 Cc1ccc(C(=O)NC2(C#N)CC2)o1 Amb35728567 [0,2,0,0,0,0|1,1,0]=4 1190 B15R2.5217 Cc1ccc(C(=O)NC2(C#N)CC2)s1 Amb35676479 [0,2,0,0,0,0|1,0,0]=3 1191 B15R2.5217 Cc1ccc(C(=O)NC2(CCl)CC2)s1 Amb27852594 [0,2,0,0,0,0|1,0,0]=3 1192 B15R2.5217 Cc1ccc(C(=O)NC2(CN)CC2)o1 Amb27836179 [0,2,0,0,0,0|1,1,0]=4 1193 B15R2.5217 Cc1ncc(C(=O)NC2(C#N)CC2)s1 Amb30017962 [0,2,0,0,0,0|2,0,0]=4 1194 B15R2.5217 N#CC1(NC(=O)c2ccc(Br)o2)CC1 Amb35678803 [0,2,0,0,0,0|0,1,0]=3 1195 B15R2.5217 N#CC1(NC(=O)c2ccc(Br)s2)CC1 Amb35676480 [0,2,0,0,0,0|0,0,0]=2 1196 B15R2.5217 N#CC1(NC(=O)c2ccc(Cl)o2)CC1 Amb35669872 [0,2,0,0,0,0|0,2,0]=4 1197 B15R2.5217 N#CC1(NC(=O)c2ccc(Cl)s2)CC1 Amb35612472 [0,2,0,0,0,0|0,1,0]=3 1198 B15R2.5217 N#CC1(NC(=O)c2coc(Br)c2)CC1 Amb35728569 [0,2,0,0,0,0|2,0,0]=4 1199 B15R2.5217 N#CC1(NC(=O)c2csc(Br)c2)CC1 Amb35676484 [0,2,0,0,0,0|2,0,0]=4 1200 B15R2.5217 O=C(NC1(CCl)CC1)c2ccc(Br)o2 Amb28187837 [0,2,0,0,0,0|0,1,0]=3 1201 B15R2.5217 O=C(NC1(CCl)CC1)c2coc(Br)c2 Amb28380984 [0,2,0,0,0,0|2,0,0]=4 1202 B15R2.5217 O=C(NC1(CO)CC1)c2ccc(Br)o2 Amb27478129 [0,2,0,0,0,0|0,1,0]=3 1203 B15R2.5217 O=C(NC1(CO)CC1)c2ccc(Br)s2 Amb27641783 [0,2,0,0,0,0|0,0,0]=2 1204 B15R2.5217 O=C(NC1(CO)CC1)c2ccc(Cl)s2 Amb27233197 [0,2,0,0,0,0|0,1,0]=3 1205 B15R2.5217 O=C(NC1(CO)CC1)c2csc(Br)c2 Amb28077817 [0,2,0,0,0,0|2,0,0]=4 1206 B15R2.5217 O=C(NC1(CO)CC1)c2csc(Br)n2 Amb35691844 [0,2,0,0,0,0|2,0,0]=4 1207 B15R2.6916 CC1(NS(=O)(=O)c2ccc(Br)s2)CC1 Amb28186727 [0,2,0,0,0,0|1,0,0]=3 1208 B15R2.7026 CC1(CC(=O)c2cc(Br)c(Br)s2)CC1 Amb27866823 [0,2,0,0,0,0|1,0,0]=3 1209 B15R2.7026 CC1(CC(=O)c2cc(Br)c(Cl)s2)CC1 Amb28074429 [0,2,0,0,0,0|1,1,0]=4 1210 B15R2.7026 CC1(CC(=O)c2cc(Cl)c(Br)s2)CC1 Amb27783657 [0,2,0,0,0,0|1,0,0]=3 1211 B15R2.7026 Cc1cc(C(=O)CC2(C)CC2)sc1Cl Amb27959993 [0,2,0,0,0,0|1,1,0]=4 1212 B15R2.7026 Cc1cc(C(=O)NC2(C)CC2)sc1Br Amb27483913 [0,2,0,0,0,0|0,0,0]=2 1213 B15R2.7026 Cc1sc(C(=O)CC2(C)CC2)cc1Br Amb27776336 [0,2,0,0,0,0|2,0,0]=4 1214 B15R2.7026 Cn1cc(C(=O)NC2(C)CC2)nc1Br Amb35589629 [0,2,0,0,0,0|2,0,0]=4 1215 B15R2.41747 Cc1cc(Br)c(C(=O)CC2(C)CC2)s1 Amb27662680 [0,2,0,0,0,0|2,0,0]=4 1216 B15R2.41747 Cc1nc(N)sc1C(=O)NC2(C)CC2 Amb27251165 [0,2,0,0,0,0|2,0,0]=4 1217 B15R2.41747 Cc1oc(Br)cc1C(=O)NC2(C)CC2 Amb27437453 [0,2,0,0,0,0|2,0,0]=4 1218 B15R2.7028 CN(C(=O)c1cn(C)c(Br)n1)C2CC2 Amb35589627 [0,2,0,0,0,0|2,0,0]=4 1219 B15R2.7028 Cc1cc(C(=O)C(C)C2CC2)sc1Br Amb28130890 [0,2,0,0,0,0|1,0,0]=3 1220 B15R2.7028 Cc1cc(C(=O)C(C)C2CC2)sc1Cl Amb28397076 [0,2,0,0,0,0|1,1,0]=4 1221 B15R2.4622 CCn1cc(Br)cc1C(=O)NC2CC2 Amb9505361 [0,2,0,0,0,0|2,0,0]=4 1222 B15R2.7094 Cc1nc(Br)sc1S(=O)(=O)NC2CC2 Amb23560518 [0,2,0,0,0,0|2,0,0]=4 1223 B15R2.41358 CN(C1CC1)S(=O)(=O)c2ccc(Br)s2 Amb27979426 [0,2,0,0,0,0|1,0,0]=3 1224 B13R2.10 Brc1ccc(C2CCCCN2)s1 Amb2236094 [0,0,1,1,0,0|1,0,1]=4 1225 B13R2.10 Brc1ccc(C2CCCCN2)s1 Amb3791074 [0,0,1,1,0,0|1,0,1]=4 1226 B13R2.11 CC1CNC(c2ccc(Br)s2)S1 Amb27402427 [0,0,1,1,0,0|0,1,1]=4 1227 B13R2.389 Cc1cc2c(o1)C(=O)NCCC2 Amb18828459 [0,0,1,1,0,0|1,1,0]=4 1228 B13R2.389 Cc1cc2c(s1)C(=O)NCCC2 Amb18824064 [0,0,1,1,0,0|1,0,0]=3 1229 B13R2.389 Nc1cc2c(o1)C(=O)NCCC2 Amb18827909 [0,0,1,1,0,0|1,1,0]=4 1230 B13R2.389 Nc1cc2c(s1)C(=O)NCCC2 Amb18823643 [0,0,1,1,0,0|1,0,0]=3 1231 B13R2.389 Nc1nc2c(s1)C(=O)NCCC2 Amb730411 [0,0,1,1,0,0|2,0,0]=4 1232 B13R2.389 O=C1NCCCc2cc(Br)oc21 Amb18753120 [0,0,1,1,0,0|0,1,0]=3 1233 B13R2.389 O=C1NCCCc2cc(Br)sc21 Amb18154852 [0,0,1,1,0,0|0,0,0]=2 1234 B13R2.389 O=C1NCCCc2oc(Br)cc21 Amb33038127 [0,0,1,1,0,0|2,0,0]=4 1235 B13R2.389 O=C1NCCCc2sc(Br)cc21 Amb26880734 [0,0,1,1,0,0|2,0,0]=4 1236 B13R2.389 O=C1NCCCn2cc(Br)cc21 Amb26331516 [0,0,1,1,0,0|2,0,0]=4 1237 B13R2.5139 CC1=CNC(=O)c2sc(Br)cc21 Amb28293041 [0,0,1,1,0,0|0,0,2]=4 1238 B13R2.5139 CN1CCC(=O)c2sc(Br)cc21 Amb18717853 [0,0,1,1,0,0|2,0,0]=4 1239 B13R2.10104 CC(c1ccc(Br)s1)N2CCC2 Amb27649854 [0,0,1,1,0,0|1,0,1]=4 1240 B13R2.10104 O=C(c1ccc(Br)s1)C2CCC2 Amb17196306 [0,0,1,1,0,0|1,0,0]=3 1241 B13R2.10104 O=C(c1ccc(Cl)o1)N2CCC2 Amb27605661 [0,0,1,1,0,0|0,2,0]=4 1242 B13R2.10104 O=C(c1ccc(Cl)s1)C2CCC2 Amb9214376 [0,0,1,1,0,0|1,1,0]=4 1243 B13R2.10104 O=C(c1cnc(Cl)s1)N2CCC2 Amb22753106 [0,0,1,1,0,0|1,1,0]=4 1244 B13R2.5397 CN1CC(=O)c2sc(Br)cc2C1 Amb18154891 [0,0,1,1,0,0|2,0,0]=4 1245 B13R2.5397 C[C@@H]1Cn2cc(Br)cc2C(=O)N1 Amb24584241 [0,0,1,1,0,0|2,0,0]=4 1246 B13R2.10762 CC1(C)NC(=O)c2cc(Br)sc21 Amb33715156 [0,0,1,1,0,0|2,0,0]=4 1247 B13R2.175 Brc1ccc(I)c(NC2CC2)c1 Amb27590715 [0,0,1,1,0,0|2,0,0]=4 1248 B13R2.175 Cc1ccc(Br)cc1NC2CC2 Amb25693404 [0,0,1,1,0,0|2,0,0]=4 1249 B13R2.175 Fc1ccc(Br)cc1NC2CC2 Amb27242750 [0,0,1,1,0,0|2,0,0]=4 1250 B13R2.175 Nc1ccc(Br)cc1NC2CC2 Amb27794182 [0,0,1,1,0,0|2,0,0]=4 1251 B13R2.690 O=C(NC1CC1)c2ccccc2 Amb6531831 [0,0,1,1,0,0|2,0,0]=4 1252 B13R2.690 O=C(NC1CC1)c2ccccn2 Amb8330948 [0,0,1,1,0,0|2,0,0]=4 1253 B15R3.223709 O=C1NC2(CC2)c3cc(Cl)ccc31 Amb28342363 [0,0,0,1,0,1|1,1,0]=4 1254 B15R3.223709 O=C1NC2(CC2)c3cc(F)ccc31 Amb33716194 [0,0,0,1,0,1|1,1,0]=4 1255 B15R3.43339 Cc1ccc(C(=O)C2CC23CC3)s1 Amb35634920 [0,0,0,1,0,1|2,0,0]=4 1256 B15R3.43339 O=C(c1ccc(Cl)s1)C2CC23CC3 Amb35589343 [0,0,0,1,0,1|1,1,0]=4 1257 B15R3.45383 O=C1CC2(CC2)c3ccc(Br)cc31 Amb27756303 [0,0,0,1,0,1|2,0,0]=4 1258 B15R3.45383 O=C1NC2(CC2)c3ccc(Cl)cc31 Amb28252489 [0,0,0,1,0,1|1,1,0]=4 1259 B15R3.45383 O=C1NC2(CC2)c3ccc(F)cc31 Amb28246883 [0,0,0,1,0,1|1,1,0]=4 1260 B15R3.45383 O=C1NC2(CC2)c3ccc(O)cc31 Amb21927471 [0,0,0,1,0,1|2,0,0]=4 1261 B15R3.80921 O=C1CC2(CC2)c3c(Br)cccc31 Amb28290308 [0,0,0,1,0,1|2,0,0]=4 1262 B11R1.314 C=C(C)C(=O)c1ccc(Br)s1 Amb18070386 [0,0,1,0,1,0|0,0,2]=4 1263 B11R1.314 CC(=O)C(=O)c1ccc(Br)s1 Amb17408128 [0,0,1,0,1,0|1,0,1]=4 1264 B11R1.314 CC(Br)C(=O)c1ccc(Cl)s1 Amb8838015 [0,0,1,0,1,0|1,1,0]=4 1265 B11R1.314 CC(C)C(=O)c1cc(Br)cs1 Amb18070671 [0,0,1,0,1,0|2,0,0]=4 1266 B11R1.314 CC(C)C(=O)c1ccc(Br)o1 Amb18141036 [0,0,1,0,1,0|0,1,0]=3 1267 B11R1.314 CC(C)C(=O)c1ccc(Br)s1 Amb10607302 [0,0,1,0,1,0|0,0,0]=2 1268 B11R1.314 CC(C)C(=O)c1ccc(Cl)s1 Amb8841776 [0,0,1,0,1,0|0,1,0]=3 1269 B11R1.314 CC(C)C(=O)c1ccc(N)o1 Amb18139295 [0,0,1,0,1,0|1,1,0]=4 1270 B11R1.314 CC(C)C(=O)c1cnc(N)s1 Amb33132656 [0,0,1,0,1,0|2,0,0]=4 1271 B11R1.314 CC(C)C(Cl)c1ccc(Br)s1 Amb28049830 [0,0,1,0,1,0|1,0,1]=4 1272 B11R1.314 CC(C)C(N)c1ccc(Br)s1 Amb17195898 [0,0,1,0,1,0|1,0,1]=4 1273 B11R1.314 CC(C)C(O)c1ccc(Br)s1 Amb17195961 [0,0,1,0,1,0|0,0,2]=4 1274 B11R1.314 CC(C)[C@H](N)c1ccc(Br)s1 Amb27667788 [0,0,1,0,1,0|1,0,1]=4 1275 B11R1.314 CC(Cl)C(=O)c1ccc(Br)s1 Amb17196744 [0,0,1,0,1,0|1,0,0]=3 1276 B11R1.314 CC(Cl)C(=O)c1ccc(Cl)s1 Amb9203759 [0,0,1,0,1,0|1,1,0]=4 1277 B11R1.314 CC(N)C(=O)c1ccc(Br)o1 Amb33451871 [0,0,1,0,1,0|1,1,0]=4 1278 B11R1.314 CC(N)C(=O)c1ccc(Br)s1 Amb17195896 [0,0,1,0,1,0|1,0,0]=3 1279 B11R1.314 CC(N)C(=O)c1ccc(Cl)s1 Amb17194600 [0,0,1,0,1,0|1,1,0]=4 1280 B11R1.314 CC(N)C(=O)c1ncc(Br)s1 Amb33434348 [0,0,1,0,1,0|2,0,0]=4 1281 B11R1.314 CC(O)C(=O)c1ccc(Br)s1 Amb27207322 [0,0,1,0,1,0|1,0,0]=3 1282 B11R1.314 CC(O)C(=O)c1ccc(Cl)s1 Amb33529422 [0,0,1,0,1,0|1,1,0]=4 1283 B11R1.314 CN(C)C(=O)c1ccc(Br)o1 Amb6858592 [0,0,1,0,1,0|1,1,0]=4 1284 B11R1.314 CN(C)C(=O)c1ccc(Br)s1 Amb2111445 [0,0,1,0,1,0|1,0,0]=3 1285 B11R1.314 CN(C)C(=O)c1ccc(Cl)s1 Amb8331044 [0,0,1,0,1,0|1,1,0]=4 1286 B11R1.314 CN(C)C(=O)c1ccc(N)s1 Amb27866704 [0,0,1,0,1,0|2,0,0]=4 1287 B11R1.314 CN(C)C(=O)c1cnc(Br)s1 Amb25278418 [0,0,1,0,1,0|2,0,0]=4 1288 B11R1.314 CN(C)C(=O)c1ncc(Br)s1 Amb26028296 [0,0,1,0,1,0|2,0,0]=4 1289 B11R1.314 C[C@@H](N)C(=O)c1ccc(Cl)s1 Amb33131713 [0,0,1,0,1,0|1,1,0]=4 1290 B11R1.314 C[C@H](N)C(=O)c1ccc(Cl)s1 Amb33131824 [0,0,1,0,1,0|1,1,0]=4 1291 B11R1.314 Cc1ccc(C(=O)C(C)Br)s1 Amb8838012 [0,0,1,0,1,0|2,0,0]=4 1292 B11R1.314 Cc1ccc(C(=O)C(C)C)o1 Amb18796671 [0,0,1,0,1,0|1,1,0]=4 1293 B11R1.314 Cc1ccc(C(=O)C(C)C)s1 Amb6492360 [0,0,1,0,1,0|1,0,0]=3 1294 B11R1.314 Cc1ccc(C(=O)C(C)N)s1 Amb18199052 [0,0,1,0,1,0|2,0,0]=4 1295 B11R1.314 Cc1ccc(C(=O)[C@@H](C)N)s1 Amb33131706 [0,0,1,0,1,0|2,0,0]=4 1296 B11R1.314 Cc1ccc(C(=O)[C@H](C)N)s1 Amb33131812 [0,0,1,0,1,0|2,0,0]=4 1297 B11R1.314 O=C(c1ccc(Br)s1)C(Br)Br Amb2781419 [0,0,1,0,1,0|2,0,0]=4 1298 B11R1.314 O=C(c1ccc(Br)s1)C(F)F Amb25043138 [0,0,1,0,1,0|2,0,0]=4 1299 B11R2.1031 C=C(c1cccs1)C2CC2 Amb27838949 [1,0,0,0,1,0|1,0,0]=3 1300 B11R2.1031 NC(c1cccs1)C2CC2 Amb488371 [1,0,0,0,1,0|1,0,1]=4 1301 B11R2.1031 O=C(C1CC1)n2cccn2 Amb16191811 [1,0,0,0,1,0|2,0,0]=4 1302 B11R2.1031 O=C(c1ccco1)C2CC2 Amb17231892 [1,0,0,0,1,0|0,1,0]=3 1303 B11R2.1031 O=C(c1cccs1)C2CC2 Amb2719645 [1,0,0,0,1,0|0,0,0]=2 1304 B11R2.1031 O=C(c1ccns1)C2CC2 Amb27845185 [1,0,0,0,1,0|1,0,0]=3 1305 B11R2.1031 O=C(c1ccsn1)C2CC2 Amb27661228 [1,0,0,0,1,0|2,0,0]=4 1306 B11R2.1031 O=C(c1cncs1)N2CC2 Amb28381956 [1,0,0,0,1,0|2,0,0]=4 1307 B11R2.1031 O=C(c1cscn1)C2CC2 Amb26470664 [1,0,0,0,1,0|2,0,0]=4 1308 B11R2.1031 O=C(c1nccs1)C2CC2 Amb19649362 [1,0,0,0,1,0|1,0,0]=3 1309 B11R2.1031 OC(c1cccs1)C2CC2 Amb4017919 [1,0,0,0,1,0|0,0,2]=4 1310 B11R2.1031 O[C@@H](c1cccs1)C2CC2 Amb28065262 [1,0,0,0,1,0|0,0,2]=4 1311 B11R2.1031 SC(c1cccs1)C2CC2 Amb18180296 [1,0,0,0,1,0|0,1,1]=4 1312 B11R2.2158 O=C(NC1CC1)C2=CCC2 Amb28249431 [1,0,0,0,1,0|0,0,2]=4 1313 B11R2.351 Brc1ccc(CC2CO2)s1 Amb33007948 [1,0,0,0,1,0|1,0,1]=4 1314 B11R2.351 Brc1ccc(NC2CC2)s1 Amb24396257 [1,0,0,0,1,0|0,0,0]=2 1315 B11R2.351 Brc1cnc(NC2CC2)s1 Amb24759022 [1,0,0,0,1,0|1,0,0]=3 1316 B11R2.351 Brc1csc(NC2CC2)c1 Amb26861515 [1,0,0,0,1,0|2,0,0]=4 1317 B11R2.351 Brc1csc(NC2CC2)n1 Amb10599316 [1,0,0,0,1,0|2,0,0]=4 1318 B11R2.351 Cc1ccc(NC2CC2)o1 Amb28410818 [1,0,0,0,1,0|1,1,0]=4 1319 B11R2.351 Clc1ccc(NC2CC2)s1 Amb25875724 [1,0,0,0,1,0|0,1,0]=3 1320 B11R2.351 Clc1cnc(NC2CC2)s1 Amb26558278 [1,0,0,0,1,0|1,1,0]=4 1321 B13R1.17 CCCCC(=O)c1ccc(Br)cc1 Amb2732106 [0,0,1,0,0,1|2,0,0]=4 1322 B13R1.17 CCCNC(=N)c1ccc(Br)cc1 Amb27826768 [0,0,1,0,0,1|2,0,0]=4 1323 B13R1.17 CCCNC(=O)C1=COC(=O)C=C1 Amb27661731 [0,0,1,0,0,1|1,1,0]=4 1324 B13R1.17 CCCNC(=O)C1=NNC(=O)C=C1 Amb28317667 [0,0,1,0,0,1|2,0,0]=4 1325 B13R1.17 CCCNC(=O)c1ccc(Br)cc1 Amb6342181 [0,0,1,0,0,1|1,0,0]=3 1326 B13R1.17 CCCNC(=O)c1ccc(Br)cn1 Amb10068261 [0,0,1,0,0,1|1,0,0]=3 1327 B13R1.17 CCCNC(=O)c1ccc(Br)nc1 Amb27222518 [0,0,1,0,0,1|1,0,0]=3 1328 B13R1.17 CCCNC(=O)c1ccc(C)cc1 Amb3366999 [0,0,1,0,0,1|2,0,0]=4 1329 B13R1.17 CCCNC(=O)c1ccc(C)nc1 Amb8332931 [0,0,1,0,0,1|2,0,0]=4 1330 B13R1.17 CCCNC(=O)c1ccc(Cl)cc1 Amb6342183 [0,0,1,0,0,1|1,1,0]=4 1331 B13R1.17 CCCNC(=O)c1ccc(Cl)nc1 Amb6244010 [0,0,1,0,0,1|1,1,0]=4 1332 B13R1.17 CCCNC(=O)c1ccc(Cl)nn1 Amb18319939 [0,0,1,0,0,1|1,1,0]=4 1333 B13R1.17 CCCNC(=O)c1ccc(F)cc1 Amb3357865 [0,0,1,0,0,1|1,1,0]=4 1334 B13R1.17 CCCNC(=O)c1ccc(I)cc1 Amb8574063 [0,0,1,0,0,1|1,1,0]=4 1335 B13R1.17 CCCNC(=O)c1ccc(N)cc1 Amb10627439 [0,0,1,0,0,1|2,0,0]=4 1336 B13R1.17 CCCNC(=O)c1ccc(N)cc1 Amb1112696 [0,0,1,0,0,1|2,0,0]=4 1337 B13R1.17 CCCNC(=O)c1ccc(N)cn1 Amb25744147 [0,0,1,0,0,1|2,0,0]=4 1338 B13R1.17 CCCNC(=O)c1ccc(N)nc1 Amb18295533 [0,0,1,0,0,1|2,0,0]=4 1339 B13R1.17 CCCNC(=O)c1ccc(N)nn1 Amb18986850 [0,0,1,0,0,1|2,0,0]=4 1340 B13R1.17 CCCNC(=O)c1ccc(O)cc1 Amb6434010 [0,0,1,0,0,1|2,0,0]=4 1341 B13R1.17 NCCNC(=O)c1ccc(Br)cc1 Amb1138758 [0,0,1,0,0,1|2,0,0]=4 1342 B13R1.17 NCCNC(=O)c1ccc(Br)cn1 Amb19000785 [0,0,1,0,0,1|2,0,0]=4 1343 B13R1.17 NCCNC(=O)c1ccc(Br)cn1 Amb28555905 [0,0,1,0,0,1|2,0,0]=4 1344 B13R1.17 NCCNC(=O)c1ccc(Br)nc1 Amb27397995 [0,0,1,0,0,1|2,0,0]=4 1345 B13R1.17 O=C(NCCBr)c1ccc(Br)cc1 Amb4311467 [0,0,1,0,0,1|2,0,0]=4 1346 B13R1.17 O=C(NCCCl)c1ccc(Br)cc1 Amb17103206 [0,0,1,0,0,1|2,0,0]=4 1347 B13R1.17 O=C(NCCO)c1ccc(Br)cc1 Amb5559240 [0,0,1,0,0,1|2,0,0]=4 1348 B13R1.17 O=C(NCCO)c1ccc(Br)cn1 Amb19356851 [0,0,1,0,0,1|2,0,0]=4 1349 B13R1.18 CCCCC(=O)c1cccc(Br)c1 Amb17198774 [0,0,1,0,0,1|2,0,0]=4 1350 B13R1.18 CCCNC(=N)c1cccc(Br)c1 Amb27197251 [0,0,1,0,0,1|2,0,0]=4 1351 B13R1.18 CCCNC(=O)C1=CC=CC(=O)N1 Amb27979071 [0,0,1,0,0,1|2,0,0]=4 1352 B13R1.18 CCCNC(=O)c1cc(Cl)ccn1 Amb8335273 [0,0,1,0,0,1|1,1,0]=4 1353 B13R1.18 CCCNC(=O)c1cccc(Br)c1 Amb6351274 [0,0,1,0,0,1|1,0,0]=3 1354 B13R1.18 CCCNC(=O)c1cccc(F)c1 Amb17775273 [0,0,1,0,0,1|1,1,0]=4 1355 B13R1.18 CCCNC(=O)c1cccc(F)n1 Amb27817702 [0,0,1,0,0,1|1,1,0]=4 1356 B13R1.18 CCCNC(=O)c1cccc(I)c1 Amb3888975 [0,0,1,0,0,1|1,1,0]=4 1357 B13R1.18 CCCNC(=O)c1cccc(N)c1 Amb1113441 [0,0,1,0,0,1|2,0,0]=4 1358 B13R1.18 CCCNC(=O)c1cccc(N)n1 Amb18987778 [0,0,1,0,0,1|2,0,0]=4 1359 B13R1.18 CCCNC(=O)c1cccc(O)c1 Amb6671458 [0,0,1,0,0,1|2,0,0]=4 1360 B13R1.18 CCCNC(=O)c1ccnc(Br)c1 Amb27832997 [0,0,1,0,0,1|1,0,0]=3 1361 B13R1.18 CCCNC(=O)c1ccnc(Cl)c1 Amb6667922 [0,0,1,0,0,1|1,1,0]=4 1362 B13R1.18 CCCNC(=O)c1ccnc(N)c1 Amb18986828 [0,0,1,0,0,1|2,0,0]=4 1363 B13R1.18 CCCNC(=O)c1cncc(Br)c1 Amb19959738 [0,0,1,0,0,1|1,0,0]=3 1364 B13R1.18 CCCNC(=O)c1cncc(Cl)c1 Amb27178774 [0,0,1,0,0,1|1,1,0]=4 1365 B13R1.18 CCCNC(=O)c1cncc(Cl)n1 Amb28317224 [0,0,1,0,0,1|1,1,0]=4 1366 B13R1.18 CCCNC(=O)c1cncc(F)c1 Amb27236469 [0,0,1,0,0,1|1,1,0]=4 1367 B13R1.18 CCCNC(=O)c1cncc(I)c1 Amb28051288 [0,0,1,0,0,1|1,1,0]=4 1368 B13R1.18 CCCNC(=O)c1cncc(N)c1 Amb27466249 [0,0,1,0,0,1|2,0,0]=4 1369 B13R1.18 CCCNC(=O)c1cncc(O)c1 Amb28241848 [0,0,1,0,0,1|2,0,0]=4 1370 B13R1.18 CCCNC(=O)c1nccc(C)n1 Amb27804996 [0,0,1,0,0,1|2,0,0]=4 1371 B13R1.18 CCONC(=O)c1cncc(Br)c1 Amb8272385 [0,0,1,0,0,1|2,0,0]=4 1372 B13R1.18 NCCNC(=O)c1cccc(Br)c1 Amb13952146 [0,0,1,0,0,1|2,0,0]=4 1373 B13R1.18 NCCNC(=O)c1cccc(Br)c1 Amb6271229 [0,0,1,0,0,1|2,0,0]=4 1374 B13R1.18 NCCNC(=O)c1cncc(Br)c1 Amb9208294 [0,0,1,0,0,1|2,0,0]=4 1375 B13R1.18 O=C(NCCBr)c1cncc(Br)c1 Amb8825008 [0,0,1,0,0,1|2,0,0]=4 1376 B13R1.18 O=C(NCCCl)c1cccc(Br)c1 Amb17103205 [0,0,1,0,0,1|2,0,0]=4 1377 B13R1.18 O=C(NCCCl)c1cncc(Br)c1 Amb27414545 [0,0,1,0,0,1|2,0,0]=4 1378 B13R1.18 O=C(NCCF)c1cccc(Br)c1 Amb27223755 [0,0,1,0,0,1|2,0,0]=4 1379 B13R1.18 O=C(NCCO)c1cc(Br)ccn1 Amb27793875 [0,0,1,0,0,1|2,0,0]=4 1380 B13R1.18 O=C(NCCO)c1cccc(Br)c1 Amb9242281 [0,0,1,0,0,1|2,0,0]=4 1381 B13R1.18 O=C(NCCO)c1cncc(Br)c1 Amb9242307 [0,0,1,0,0,1|2,0,0]=4 1382 B13R1.43 CCCCC(=O)Nc1ncc(Br)s1 Amb6517765 [0,0,1,0,0,1|2,0,0]=4 1383 B13R1.43 CCCNC(=O)Nc1cnc(C)s1 Amb27652569 [0,0,1,0,0,1|2,0,0]=4 1384 B13R1.43 CCCNC(=O)Nc1ncc(C)s1 Amb27415015 [0,0,1,0,0,1|2,0,0]=4 1385 B13R1.43 CCONC(=O)Nc1ccc(C)s1 Amb27982876 [0,0,1,0,0,1|2,0,0]=4 1386 B13R1.43 N#CCNC(=O)Cc1ccc(Br)s1 Amb18872121 [0,0,1,0,0,1|1,0,1]=4 1387 B13R1.43 NCCNC(=O)Cc1ccc(Br)s1 Amb18073625 [0,0,1,0,0,1|1,0,0]=3 1388 B13R1.43 NCCNC(=O)Cc1ccc(Cl)s1 Amb18067430 [0,0,1,0,0,1|1,1,0]=4 1389 B13R1.43 NCCNC(=O)Nc1ccc(Br)s1 Amb25762941 [0,0,1,0,0,1|1,0,0]=3 1390 B13R1.43 NCCNC(=O)Nc1ccc(Cl)s1 Amb27603408 [0,0,1,0,0,1|1,1,0]=4 1391 B13R1.43 O=C(Cc1ccc(Br)s1)NCCO Amb18883674 [0,0,1,0,0,1|1,0,0]=3 1392 B13R1.43 O=C(Cc1ccc(Cl)s1)NCCO Amb18226043 [0,0,1,0,0,1|1,1,0]=4 1393 B13R1.132 CC(C)CC(=O)c1ccc(Br)cc1 Amb8850519 [0,0,1,0,0,1|2,0,0]=4 1394 B13R1.132 CC(C)NC(=O)c1ccc(Br)cc1 Amb3360940 [0,0,1,0,0,1|1,0,0]=3 1395 B13R1.132 CC(C)NC(=O)c1ccc(Br)cn1 Amb10068271 [0,0,1,0,0,1|1,0,0]=3 1396 B13R1.132 CC(C)NC(=O)c1ccc(Br)nc1 Amb26467917 [0,0,1,0,0,1|1,0,0]=3 1397 B13R1.132 CC(C)NC(=O)c1ccc(Br)nn1 Amb27588818 [0,0,1,0,0,1|1,0,0]=3 1398 B13R1.132 CC(C)NC(=O)c1ccc(Cl)cc1 Amb1251856 [0,0,1,0,0,1|1,1,0]=4 1399 B13R1.132 CC(C)NC(=O)c1ccc(Cl)nc1 Amb2611979 [0,0,1,0,0,1|1,1,0]=4 1400 B13R1.132 CC(C)NC(=O)c1ccc(Cl)nn1 Amb18319940 [0,0,1,0,0,1|1,1,0]=4 1401 B13R1.132 CC(C)NC(=O)c1ccc(F)cc1 Amb6347643 [0,0,1,0,0,1|1,1,0]=4 1402 B13R1.132 CC(C)NC(=O)c1ccc(I)cc1 Amb6417033 [0,0,1,0,0,1|1,1,0]=4 1403 B13R1.132 CC(C)NC(=O)c1ccc(N)cc1 Amb1118876 [0,0,1,0,0,1|2,0,0]=4 1404 B13R1.132 CC(C)NC(=O)c1ccc(N)cc1 Amb32582538 [0,0,1,0,0,1|2,0,0]=4 1405 B13R1.132 CC(C)NC(=O)c1ccc(N)cn1 Amb28399995 [0,0,1,0,0,1|2,0,0]=4 1406 B13R1.132 CC(C)NC(=O)c1ccc(N)nc1 Amb18284688 [0,0,1,0,0,1|2,0,0]=4 1407 B13R1.132 CC(C)NC(=O)c1ccc(O)cc1 Amb6361704 [0,0,1,0,0,1|2,0,0]=4 1408 B13R1.132 CC(C)NC(=O)c1ccc(S)cc1 Amb27652632 [0,0,1,0,0,1|2,0,0]=4 1409 B13R1.132 CC(C)NC(=O)c1ncc(Br)cn1 Amb27589407 [0,0,1,0,0,1|2,0,0]=4 1410 B13R1.132 CC(C)OC(=O)c1ccc(Br)cc1 Amb27870600 [0,0,1,0,0,1|2,0,0]=4 1411 B13R1.132 CN(C)NC(=O)c1ccc(Br)cc1 Amb27165481 [0,0,1,0,0,1|2,0,0]=4 1412 B13R1.132 CN(C)NC(=O)c1ccc(Br)nc1 Amb28320095 [0,0,1,0,0,1|2,0,0]=4 1413 B13R1.147 CC(C)CC(=O)c1cccc(Br)c1 Amb17198775 [0,0,1,0,0,1|2,0,0]=4 1414 B13R1.147 CC(C)NC(=N)c1cncc(Br)c1 Amb27771879 [0,0,1,0,0,1|2,0,0]=4 1415 B13R1.147 CC(C)NC(=O)C1=CC(=S)NC=C1 Amb27980262 [0,0,1,0,0,1|2,0,0]=4 1416 B13R1.147 CC(C)NC(=O)C1=CC=CC(=O)N1 Amb25180106 [0,0,1,0,0,1|2,0,0]=4 1417 B13R1.147 CC(C)NC(=O)C1=CC=NC(=O)N1 Amb32419038 [0,0,1,0,0,1|2,0,0]=4 1418 B13R1.147 CC(C)NC(=O)c1cc(Br)ccn1 Amb28061878 [0,0,1,0,0,1|1,0,0]=3 1419 B13R1.147 CC(C)NC(=O)c1cc(Cl)ccn1 Amb8323442 [0,0,1,0,0,1|1,1,0]=4 1420 B13R1.147 CC(C)NC(=O)c1cc(N)ccn1 Amb18284818 [0,0,1,0,0,1|2,0,0]=4 1421 B13R1.147 CC(C)NC(=O)c1cccc(Br)c1 Amb6347751 [0,0,1,0,0,1|1,0,0]=3 1422 B13R1.147 CC(C)NC(=O)c1cccc(Cl)c1 Amb6347598 [0,0,1,0,0,1|1,1,0]=4 1423 B13R1.147 CC(C)NC(=O)c1cccc(Cl)n1 Amb19088730 [0,0,1,0,0,1|1,1,0]=4 1424 B13R1.147 CC(C)NC(=O)c1cccc(F)c1 Amb3110255 [0,0,1,0,0,1|1,1,0]=4 1425 B13R1.147 CC(C)NC(=O)c1cccc(F)n1 Amb27172812 [0,0,1,0,0,1|1,1,0]=4 1426 B13R1.147 CC(C)NC(=O)c1cccc(I)c1 Amb6381780 [0,0,1,0,0,1|1,1,0]=4 1427 B13R1.147 CC(C)NC(=O)c1cccc(N)c1 Amb1114824 [0,0,1,0,0,1|2,0,0]=4 1428 B13R1.147 CC(C)NC(=O)c1cccc(N)n1 Amb18959757 [0,0,1,0,0,1|2,0,0]=4 1429 B13R1.147 CC(C)NC(=O)c1cccc(S)c1 Amb27753492 [0,0,1,0,0,1|2,0,0]=4 1430 B13R1.147 CC(C)NC(=O)c1ccnc(Cl)c1 Amb6667929 [0,0,1,0,0,1|1,1,0]=4 1431 B13R1.147 CC(C)NC(=O)c1ccnc(N)c1 Amb18284820 [0,0,1,0,0,1|2,0,0]=4 1432 B13R1.147 CC(C)NC(=O)c1cncc(Br)c1 Amb1081541 [0,0,1,0,0,1|1,0,0]=3 1433 B13R1.147 CC(C)NC(=O)c1cncc(F)c1 Amb25819996 [0,0,1,0,0,1|1,1,0]=4 1434 B13R1.147 CC(C)NC(=O)c1cncc(N)c1 Amb27665194 [0,0,1,0,0,1|2,0,0]=4 1435 B13R1.147 CC(C)NC(=O)c1cncc(O)c1 Amb27817367 [0,0,1,0,0,1|2,0,0]=4 1436 B13R1.147 CC(C)NC(=O)c1nccc(N)n1 Amb27809930 [0,0,1,0,0,1|2,0,0]=4 1437 B13R1.147 CC(C)OC(=O)c1cccc(Br)c1 Amb25081713 [0,0,1,0,0,1|2,0,0]=4 1438 B13R1.147 CC(C)OC(=O)c1cncc(Br)c1 Amb27464134 [0,0,1,0,0,1|2,0,0]=4 1439 B13R1.3424 CC(C)=CC(=O)Cc1ccc(Br)s1 Amb27466980 [0,0,1,0,0,1|1,0,1]=4 1440 B13R1.3424 CC(C)NC(=O)Cc1ccc(Br)s1 Amb27211505 [0,0,1,0,0,1|0,0,0]=2 1441 B13R1.3424 CC(C)NC(=O)Cn1ccc(Br)n1 Amb23539562 [0,0,1,0,0,1|2,0,0]=4 1442 B13R1.3424 CC(C)OC(=O)Cc1ccc(Br)s1 Amb18943123 [0,0,1,0,0,1|1,0,0]=3 1443 B13R1.3424 CC(C)OC(=O)Nc1ncc(Br)s1 Amb27414515 [0,0,1,0,0,1|2,0,0]=4 1444 B13R1.3424 Cc1ccc(CC(=O)NC(C)C)o1 Amb27595415 [0,0,1,0,0,1|1,1,0]=4 1445 B13R2.443 CC(NCC1CC1)c2cccs2 Amb6686784 [1,0,0,0,0,1|1,0,1]=4 1446 B13R2.443 C\C(=N\NC1CC1)c2nccs2 Amb27979238 [1,0,0,0,0,1|2,0,0]=4 1447 B13R2.443 O=C(CNC1CC1)c2ccco2 Amb21862204 [1,0,0,0,0,1|0,1,0]=3 1448 B13R2.443 O=C(CNC1CC1)c2cccs2 Amb17314824 [1,0,0,0,0,1|0,0,0]=2 1449 B13R2.443 O=C(NCC1CC1)c2ccoc2 Amb8332941 [1,0,0,0,0,1|2,0,0]=4 1450 B13R2.443 O=C(NCC1CC1)c2ccsc2 Amb10706334 [1,0,0,0,0,1|2,0,0]=4 1451 B13R2.443 O=C(NCC1CC1)c2cnns2 Amb27399404 [1,0,0,0,0,1|2,0,0]=4 1452 B13R2.443 O=C(OCC1CO1)c2cccs2 Amb10789161 [1,0,0,0,0,1|2,0,0]=4 1453 B13R2.443 OC(CNC1CC1)c2cccs2 Amb17139070 [1,0,0,0,0,1|0,0,2]=4 1454 B13R2.445 CC(NC1CSC1)c2cccs2 Amb28064840 [1,0,0,0,0,1|1,0,1]=4 1455 B13R2.445 O=C(CC1CCC1)c2ccco2 Amb27458872 [1,0,0,0,0,1|1,1,0]=4 1456 B13R2.445 O=C(CC1CNC1)c2cncs2 Amb30020584 [1,0,0,0,0,1|2,0,0]=4 1457 B13R2.445 O=C(NC1CCC1)c2ccco2 Amb27392933 [1,0,0,0,0,1|0,1,0]=3 1458 B13R2.445 O=C(NC1CCC1)c2cccs2 Amb27657290 [1,0,0,0,0,1|0,0,0]=2 1459 B13R2.445 O=C(NC1CCC1)c2ccon2 Amb27664939 [1,0,0,0,0,1|2,0,0]=4 1460 B13R2.445 O=C(NC1CCC1)c2cnco2 Amb28184793 [1,0,0,0,0,1|1,1,0]=4 1461 B13R2.445 O=C(NC1CCC1)c2cncs2 Amb27399479 [1,0,0,0,0,1|1,0,0]=3 1462 B13R2.445 O=C(NC1CCC1)c2cscn2 Amb18791448 [1,0,0,0,0,1|2,0,0]=4 1463 B13R2.445 O=C(NC1CCC1)c2nccs2 Amb28256546 [1,0,0,0,0,1|1,0,0]=3 1464 B13R2.445 O=C(NC1CNC1)c2ccco2 Amb27963658 [1,0,0,0,0,1|0,1,0]=3 1465 B13R2.445 O=C(NC1CNC1)c2cccs2 Amb27770246 [1,0,0,0,0,1|0,0,0]=2 1466 B13R2.445 O=C(NC1CNC1)c2cscn2 Amb27390399 [1,0,0,0,0,1|2,0,0]=4 1467 B13R2.445 O=C(NC1COC1)c2ccco2 Amb28382502 [1,0,0,0,0,1|0,1,0]=3 1468 B13R2.445 O=C(NC1COC1)c2ccon2 Amb28325463 [1,0,0,0,0,1|2,0,0]=4 1469 B13R2.445 O=C(NC1COC1)c2cncs2 Amb28313152 [1,0,0,0,0,1|1,0,0]=3 1470 B13R2.445 O=C(OC1CCC1)c2nccs2 Amb27853010 [1,0,0,0,0,1|2,0,0]=4 1471 B13R2.445 O=C(OC1CNC1)c2ccco2 Amb21956187 [1,0,0,0,0,1|1,1,0]=4 1472 B13R2.445 O=C(OC1COC1)c2ccco2 Amb27467125 [1,0,0,0,0,1|1,1,0]=4 1473 B13R2.445 O=C(OC1COC1)c2nccs2 Amb28370542 [1,0,0,0,0,1|2,0,0]=4 1474 B13R2.696 CC(Cc1cccs1)NC2CC2 Amb18553126 [1,0,0,0,0,1|1,0,1]=4 1475 B13R2.696 O=C(CC1CC1)Nc2nccs2 Amb25694810 [1,0,0,0,0,1|2,0,0]=4 1476 B13R2.696 O=C(Cc1ccco1)NC2CC2 Amb27178708 [1,0,0,0,0,1|0,1,0]=3 1477 B13R2.696 O=C(Cc1cccs1)NC2CC2 Amb3571667 [1,0,0,0,0,1|0,0,0]=2 1478 B13R2.696 O=C(Cc1ccsc1)NC2CC2 Amb8336969 [1,0,0,0,0,1|2,0,0]=4 1479 B13R2.696 O=C(Nc1cccs1)NC2CC2 Amb27980032 [1,0,0,0,0,1|0,0,0]=2 1480 B13R2.696 O=C(Nc1ccsc1)NC2CC2 Amb27599061 [1,0,0,0,0,1|2,0,0]=4 1481 B13R2.696 O=C(Nc1cocn1)NC2CC2 Amb27852999 [1,0,0,0,0,1|2,0,0]=4 1482 B13R2.696 O=C(Nc1ncco1)NC2CC2 Amb28400335 [1,0,0,0,0,1|1,1,0]=4 1483 B13R2.696 O=C(Nc1nccs1)NC2CC2 Amb27882452 [1,0,0,0,0,1|1,0,0]=3 1484 B13R2.527 Brc1ccc(CNC2CC2)cc1 Amb1116371 [1,0,0,0,0,1|1,0,1]=4 1485 B13R2.527 Brc1ccc(CNC2CC2)cc1 Amb6865369 [1,0,0,0,0,1|1,0,1]=4 1486 B13R2.527 Brc1ccc(CNC2CC2)cn1 Amb22265391 [1,0,0,0,0,1|1,0,1]=4 1487 B13R2.527 Brc1ccc(CNC2CC2)nc1 Amb18302412 [1,0,0,0,0,1|1,0,1]=4 1488 B13R2.2973 Brc1ccc(CNCC2CC2)s1 Amb6686883 [1,0,0,0,0,1|0,0,1]=3 1489 B13R2.2973 Brc1ccc(\C=N\NC2CC2)s1 Amb27457542 [1,0,0,0,0,1|0,0,0]=2 1490 B13R2.2973 Brc1coc(\C=N\NC2CC2)c1 Amb27806263 [1,0,0,0,0,1|2,0,0]=4 1491 B13R2.2973 Cc1ccc(CNCC2CC2)s1 Amb2592455 [1,0,0,0,0,1|1,0,1]=4 1492 B13R2.2973 Cc1ccc(\C=N\NC2CC2)o1 Amb27836620 [1,0,0,0,0,1|1,1,0]=4 1493 B13R2.2973 Cc1ccc(\C=N\NC2CC2)s1 Amb28283556 [1,0,0,0,0,1|1,0,0]=3 1494 B13R2.2973 Fc1ccc(CNCC2CC2)s1 Amb24269167 [1,0,0,0,0,1|0,1,1]=4 1495 B13R2.2973 Fc1ccc(CNCC2CC2)s1 Amb30594688 [1,0,0,0,0,1|0,1,1]=4 1496 B13R2.2974 Brc1ccc(CNC2CCC2)s1 Amb18989475 [1,0,0,0,0,1|0,0,1]=3 1497 B13R2.2974 Brc1ccc(CNC2COC2)s1 Amb27233125 [1,0,0,0,0,1|0,0,1]=3 1498 B13R2.2974 Brc1ccc(COC2CNC2)s1 Amb28365615 [1,0,0,0,0,1|1,0,1]=4 1499 B13R2.2974 Brc1cnc(CNC2CCC2)s1 Amb27588877 [1,0,0,0,0,1|1,0,1]=4 1500 B13R2.2974 Clc1ccc(CNC2COC2)s1 Amb27834256 [1,0,0,0,0,1|0,1,1]=4 1501 B13R2.5331 Brc1cc(CNC2CC2)ccn1 Amb20618634 [1,0,0,0,0,1|1,0,1]=4 1502 B13R2.5331 Brc1cccc(CNC2CC2)c1 Amb1117517 [1,0,0,0,0,1|1,0,1]=4 1503 B13R2.5331 Brc1cccc(CNC2CC2)c1 Amb6865491 [1,0,0,0,0,1|1,0,1]=4 1504 B13R2.5331 Brc1cncc(CNC2CC2)c1 Amb8853811 [1,0,0,0,0,1|1,0,1]=4 1505 B13R2.520 C=C(c1ccc(Br)cc1)C2CC2 Amb22751350 [0,0,0,0,1,1|2,0,0]=4 1506 B13R2.520 Cc1ccc(C(=O)C2CC2)cc1 Amb1660781 [0,0,0,0,1,1|2,0,0]=4 1507 B13R2.520 Nc1ccc(C(=O)C2CC2)cc1 Amb17138525 [0,0,0,0,1,1|2,0,0]=4 1508 B13R2.520 Nc1ccc(C(=O)C2CC2)cc1 Amb33548981 [0,0,0,0,1,1|2,0,0]=4 1509 B13R2.520 O=C(c1ccc(Br)cc1)C2CC2 Amb2420176 [0,0,0,0,1,1|1,0,0]=3 1510 B13R2.520 O=C(c1ccc(Br)cn1)C2CC2 Amb23454994 [0,0,0,0,1,1|1,0,0]=3 1511 B13R2.520 O=C(c1ccc(Cl)cc1)C2CC2 Amb6365762 [0,0,0,0,1,1|1,1,0]=4 1512 B13R2.520 O=C(c1ccc(Cl)cn1)C2CC2 Amb23454991 [0,0,0,0,1,1|1,1,0]=4 1513 B13R2.520 O=C(c1ccc(F)cc1)C2CC2 Amb2582736 [0,0,0,0,1,1|1,1,0]=4 1514 B13R2.520 O=C(c1ccc(F)cn1)C2CC2 Amb27853326 [0,0,0,0,1,1|1,1,0]=4 1515 B13R2.520 O=C(c1ccc(O)cc1)C2CC2 Amb2612556 [0,0,0,0,1,1|2,0,0]=4 1516 B13R2.5324 Cc1cc(C(=O)C2CC2)ccn1 Amb22730046 [0,0,0,0,1,1|2,0,0]=4 1517 B13R2.5324 Cc1cccc(C(=O)C2CC2)c1 Amb6302168 [0,0,0,0,1,1|2,0,0]=4 1518 B13R2.5324 Cc1nccc(C(=O)C2CC2)n1 Amb27202174 [0,0,0,0,1,1|2,0,0]=4 1519 B13R2.5324 Nc1cccc(C(=O)C2CC2)c1 Amb17138520 [0,0,0,0,1,1|2,0,0]=4 1520 B13R2.5324 O=C(c1cccc(Br)c1)C2CC2 Amb6302179 [0,0,0,0,1,1|1,0,0]=3 1521 B13R2.5324 O=C(c1cccc(Br)n1)C2CC2 Amb19892364 [0,0,0,0,1,1|1,0,0]=3 1522 B13R2.5324 O=C(c1cccc(Cl)c1)C2CC2 Amb6302180 [0,0,0,0,1,1|1,1,0]=4 1523 B13R2.5324 O=C(c1cccc(F)c1)C2CC2 Amb6302181 [0,0,0,0,1,1|1,1,0]=4 1524 B13R2.5324 O=C(c1cccc(O)c1)C2CC2 Amb28253989 [0,0,0,0,1,1|2,0,0]=4 1525 B13R2.5324 O=C(c1ccnc(Br)c1)C2CC2 Amb23455125 [0,0,0,0,1,1|1,0,0]=3 1526 B13R2.5324 O=C(c1ccnc(Cl)n1)C2CC2 Amb25214584 [0,0,0,0,1,1|1,1,0]=4 1527 B13R2.5324 O=C(c1cncc(Br)c1)C2CC2 Amb23455627 [0,0,0,0,1,1|1,0,0]=3 1528 B13R2.5324 O=C(c1cncc(F)c1)C2CC2 Amb18792620 [0,0,0,0,1,1|1,1,0]=4 1529 B15R2.6983 Cc1ccc(C(=O)NCC2CC2)cn1 Amb8332934 [0,0,0,0,0,2|2,0,0]=4 1530 B15R2.6983 Nc1ccc(C(=O)CNC2CC2)cc1 Amb18051504 [0,0,0,0,0,2|2,0,0]=4 1531 B15R2.6983 Nc1ccc(C(=O)NCC2CC2)cc1 Amb1132460 [0,0,0,0,0,2|2,0,0]=4 1532 B15R2.6983 Nc1ccc(C(=O)NCC2CC2)cn1 Amb18986233 [0,0,0,0,0,2|2,0,0]=4 1533 B15R2.6983 O=C(CNC1CC1)c2ccc(F)cc2 Amb17314133 [0,0,0,0,0,2|1,1,0]=4 1534 B15R2.6983 O=C(NCC1CC1)c2ccc(Br)cc2 Amb6269644 [0,0,0,0,0,2|1,0,0]=3 1535 B15R2.6983 O=C(NCC1CC1)c2ccc(Br)cn2 Amb28367176 [0,0,0,0,0,2|1,0,0]=3 1536 B15R2.6983 O=C(NCC1CC1)c2ccc(Cl)cc2 Amb8260895 [0,0,0,0,0,2|1,1,0]=4 1537 B15R2.6983 O=C(NCC1CC1)c2ccc(Cl)nc2 Amb6249592 [0,0,0,0,0,2|1,1,0]=4 1538 B15R2.6983 O=C(NCC1CC1)c2ccc(F)cc2 Amb1876183 [0,0,0,0,0,2|1,1,0]=4 1539 B15R2.6983 O=C(NCC1CC1)c2ccc(F)nc2 Amb27404364 [0,0,0,0,0,2|1,1,0]=4 1540 B15R2.6983 O=C(NCC1CC1)c2ccc(I)cc2 Amb24420057 [0,0,0,0,0,2|1,1,0]=4 1541 B15R2.6983 O=C1C=CC(C(=O)NCC2CC2)=NN1 Amb27600106 [0,0,0,0,0,2|2,0,0]=4 1542 B15R2.18927 Cc1ccc(CC(=O)NC2CC2)cc1 Amb8341515 [0,0,0,0,0,2|2,0,0]=4 1543 B15R2.18927 Cc1ccc(NC(=O)NC2CC2)cc1 Amb8342455 [0,0,0,0,0,2|2,0,0]=4 1544 B15R2.18927 Cc1ccc(NC(=O)NC2CC2)nc1 Amb35706214 [0,0,0,0,0,2|2,0,0]=4 1545 B15R2.18927 Nc1ccc(CC(=O)NC2CC2)cc1 Amb1114628 [0,0,0,0,0,2|2,0,0]=4 1546 B15R2.18927 Nc1ccc(NC(=O)NC2CC2)cc1 Amb6893229 [0,0,0,0,0,2|2,0,0]=4 1547 B15R2.18927 Nc1ccc(NC(=O)NC2CC2)cn1 Amb18965520 [0,0,0,0,0,2|2,0,0]=4 1548 B15R2.18927 O=C(CC1CC1)Nc2ccc(Br)cn2 Amb27391932 [0,0,0,0,0,2|2,0,0]=4 1549 B15R2.18927 O=C(CC1CC1)Nc2ccc(Br)nc2 Amb27456974 [0,0,0,0,0,2|2,0,0]=4 1550 B15R2.18927 O=C(Cc1ccc(Br)cc1)NC2CC2 Amb8254879 [0,0,0,0,0,2|1,0,0]=3 1551 B15R2.18927 O=C(Cc1ccc(Br)cn1)NC2CC2 Amb23586127 [0,0,0,0,0,2|1,0,0]=3 1552 B15R2.18927 O=C(Cc1ccc(Cl)cc1)NC2CC2 Amb6493996 [0,0,0,0,0,2|1,1,0]=4 1553 B15R2.18927 O=C(Cc1ccc(F)cc1)NC2CC2 Amb8340728 [0,0,0,0,0,2|1,1,0]=4 1554 B15R2.18927 O=C(NC1CC1)Oc2ccc(O)cc2 Amb35734303 [0,0,0,0,0,2|2,0,0]=4 1555 B15R2.18927 O=C(Nc1ccc(Br)cc1)NC2CC2 Amb10693629 [0,0,0,0,0,2|1,0,0]=3 1556 B15R2.18927 O=C1C=CC(NC(=O)NC2CC2)=CN1 Amb27238113 [0,0,0,0,0,2|2,0,0]=4 1557 B15R2.18979 Cc1ccc(C(=O)NC2CCC2)cn1 Amb24440955 [0,0,0,0,0,2|2,0,0]=4 1558 B15R2.18979 Nc1ccc(C(=O)NC2CCC2)nn1 Amb18961421 [0,0,0,0,0,2|2,0,0]=4 1559 B15R2.18979 Nc1ccc(C(=O)NC2CNC2)cc1 Amb27664739 [0,0,0,0,0,2|2,0,0]=4 1560 B15R2.18979 Nc1ccc(C(=O)NC2COC2)cn1 Amb32641768 [0,0,0,0,0,2|2,0,0]=4 1561 B15R2.18979 O=C(CC1CCC1)c2ccc(Br)cc2 Amb28240719 [0,0,0,0,0,2|2,0,0]=4 1562 B15R2.18979 O=C(CC1CNC1)c2ccc(Br)cc2 Amb35614543 [0,0,0,0,0,2|2,0,0]=4 1563 B15R2.18979 O=C(NC1CCC1)c2ccc(Br)cn2 Amb27465483 [0,0,0,0,0,2|1,0,0]=3 1564 B15R2.18979 O=C(NC1CCC1)c2ccc(Br)nc2 Amb24696051 [0,0,0,0,0,2|1,0,0]=3 1565 B15R2.18979 O=C(NC1CCC1)c2ccc(Cl)nc2 Amb24335704 [0,0,0,0,0,2|1,1,0]=4 1566 B15R2.18979 O=C(NC1CCC1)c2ccc(Cl)nn2 Amb26037757 [0,0,0,0,0,2|1,1,0]=4 1567 B15R2.18979 O=C(NC1CCC1)c2ccc(F)nc2 Amb28456382 [0,0,0,0,0,2|1,1,0]=4 1568 B15R2.18979 O=C(NC1CNC1)c2ccc(Br)cn2 Amb28046928 [0,0,0,0,0,2|1,0,0]=3 1569 B15R2.18979 O=C(NC1COC1)c2ccc(Br)cn2 Amb26642739 [0,0,0,0,0,2|1,0,0]=3 1570 B15R2.18979 O=C(NC1COC1)c2ccc(Cl)nn2 Amb28324199 [0,0,0,0,0,2|1,1,0]=4 1571 B15R2.18979 O=C(NC1COC1)c2ccc(O)cc2 Amb27447936 [0,0,0,0,0,2|2,0,0]=4 1572 B15R2.18979 O=C(OC1CCC1)c2ccc(Br)nc2 Amb28042135 [0,0,0,0,0,2|2,0,0]=4 1573 B15R2.18979 O=C1C=CC(C(=O)NC2CCC2)=NN1 Amb27865381 [0,0,0,0,0,2|2,0,0]=4 1574 B15R2.6948 Cc1ccc(CNC(=O)NC2CC2)o1 Amb28460891 [0,0,0,0,0,2|1,1,0]=4 1575 B15R2.6948 N=C(NCc1ccc(Cl)s1)NC2CC2 Amb28043664 [0,0,0,0,0,2|1,1,0]=4 1576 B15R2.6948 Nc1cnc(NCC(=O)NC2CC2)s1 Amb28249238 [0,0,0,0,0,2|2,0,0]=4 1577 B15R2.6948 O=C(CNc1nc(Br)cs1)NC2CC2 Amb27493273 [0,0,0,0,0,2|2,0,0]=4 1578 B15R2.6948 O=C(NCc1cc(Br)cs1)NC2CC2 Amb11387355 [0,0,0,0,0,2|2,0,0]=4 1579 B15R2.6948 O=C(NCc1ccc(Br)s1)NC2CC2 Amb14002487 [0,0,0,0,0,2|0,0,0]=2 1580 B15R2.6948 O=C(NCc1ccc(Cl)o1)NC2CC2 Amb35724886 [0,0,0,0,0,2|0,2,0]=4 1581 B15R2.6948 O=C(NCc1ccc(Cl)s1)NC2CC2 Amb14002492 [0,0,0,0,0,2|0,1,0]=3 1582 B15R2.6948 O=C(NCc1csc(Br)c1)NC2CC2 Amb14015841 [0,0,0,0,0,2|2,0,0]=4 1583 B15R2.6948 S=C(NCc1ccc(Cl)s1)NC2CC2 Amb27806212 [0,0,0,0,0,2|0,2,0]=4 1584 B15R2.7145 Cc1cccc(NC(=O)NC2CC2)c1 Amb6534535 [0,0,0,0,0,2|2,0,0]=4 1585 B15R2.7145 Cc1cccc(NC(=O)NC2CC2)n1 Amb29849894 [0,0,0,0,0,2|2,0,0]=4 1586 B15R2.7145 Cc1ccnc(NC(=O)NC2CC2)c1 Amb35728312 [0,0,0,0,0,2|2,0,0]=4 1587 B15R2.7145 N=C(Cc1cccc(Br)c1)NC2CC2 Amb27413946 [0,0,0,0,0,2|2,0,0]=4 1588 B15R2.7145 Nc1cc(NC(=O)NC2CC2)ccn1 Amb35678021 [0,0,0,0,0,2|2,0,0]=4 1589 B15R2.7145 Nc1cccc(CC(=O)NC2CC2)c1 Amb8426849 [0,0,0,0,0,2|2,0,0]=4 1590 B15R2.7145 Nc1cccc(NC(=O)NC2CC2)c1 Amb6632569 [0,0,0,0,0,2|2,0,0]=4 1591 B15R2.7145 O=C(CC1CC1)Nc2cccc(Br)c2 Amb27803448 [0,0,0,0,0,2|2,0,0]=4 1592 B15R2.7145 O=C(CC1CC1)Nc2cccc(Br)n2 Amb27954492 [0,0,0,0,0,2|2,0,0]=4 1593 B15R2.7145 O=C(CC1CC1)Nc2ccnc(Br)c2 Amb28136411 [0,0,0,0,0,2|2,0,0]=4 1594 B15R2.7145 O=C(Cc1cccc(Cl)c1)NC2CC2 Amb19705859 [0,0,0,0,0,2|1,1,0]=4 1595 B15R2.7145 O=C(Cc1cccc(F)c1)NC2CC2 Amb8050218 [0,0,0,0,0,2|1,1,0]=4 1596 B15R2.7145 O=C(Cc1cccc(I)c1)NC2CC2 Amb32410294 [0,0,0,0,0,2|1,1,0]=4 1597 B15R2.7145 O=C(Cc1cccc(O)c1)NC2CC2 Amb19041157 [0,0,0,0,0,2|2,0,0]=4 1598 B15R2.7145 O=C(NC1CC1)Oc2cccc(O)c2 Amb35726495 [0,0,0,0,0,2|2,0,0]=4 1599 B15R2.7145 O=C(Nc1cccc(Cl)c1)NC2CC2 Amb6533405 [0,0,0,0,0,2|1,1,0]=4 1600 B15R2.7145 O=C(Nc1cncc(Cl)c1)NC2CC2 Amb35671567 [0,0,0,0,0,2|1,1,0]=4 1601 B15R2.41272 Cc1cnc(NC(=O)CNC2CC2)s1 Amb10121110 [0,0,0,0,0,2|2,0,0]=4 1602 B15R2.41272 Cc1ncc(NC(=O)CNC2CC2)s1 Amb27854176 [0,0,0,0,0,2|2,0,0]=4 1603 B15R2.41272 O=C(CNC1CC1)Nc2ncc(Cl)s2 Amb28192777 [0,0,0,0,0,2|1,1,0]=4 1604 B15R2.41366 O=C(CC1CCC1)Nc2ncc(Br)s2 Amb27428472 [0,0,0,0,0,2|2,0,0]=4 1605 B15R2.41366 O=C(Cc1ccc(Br)s1)NC2CNC2 Amb27659984 [0,0,0,0,0,2|0,0,0]=2 1606 B15R2.7152 Cc1cccc(C(=O)CNC2CC2)c1 Amb18863452 [0,0,0,0,0,2|2,0,0]=4 1607 B15R2.7152 Nc1cc(C(=O)NCC2CC2)ccn1 Amb18986885 [0,0,0,0,0,2|2,0,0]=4 1608 B15R2.7152 Nc1cccc(C(=O)CNC2CC2)c1 Amb18550970 [0,0,0,0,0,2|2,0,0]=4 1609 B15R2.7152 Nc1cccc(C(=O)NCC2CC2)n1 Amb18296086 [0,0,0,0,0,2|2,0,0]=4 1610 B15R2.7152 Nc1cncc(C(=O)NCC2CC2)n1 Amb28192391 [0,0,0,0,0,2|2,0,0]=4 1611 B15R2.7152 O=C(CNC1CC1)c2cccc(Cl)c2 Amb18866058 [0,0,0,0,0,2|1,1,0]=4 1612 B15R2.7152 O=C(CNC1CC1)c2cccc(F)c2 Amb18863810 [0,0,0,0,0,2|1,1,0]=4 1613 B15R2.7152 O=C(NCC1CC1)c2cc(Cl)ccn2 Amb8831886 [0,0,0,0,0,2|1,1,0]=4 1614 B15R2.7152 O=C(NCC1CC1)c2cccc(Cl)n2 Amb24745417 [0,0,0,0,0,2|1,1,0]=4 1615 B15R2.7152 O=C(NCC1CC1)c2cccc(O)c2 Amb6671785 [0,0,0,0,0,2|2,0,0]=4 1616 B15R2.7152 O=C(NCC1CC1)c2cncc(Br)c2 Amb8271672 [0,0,0,0,0,2|1,0,0]=3 1617 B15R2.7152 O=C(NCC1CC1)c2cncc(Cl)n2 Amb22755352 [0,0,0,0,0,2|1,1,0]=4 1618 B15R2.7152 O=C(NCC1CC1)c2cncc(F)c2 Amb28469066 [0,0,0,0,0,2|1,1,0]=4 1619 B15R2.7152 O=C(NCC1CC1)c2cncc(O)c2 Amb27763488 [0,0,0,0,0,2|2,0,0]=4 1620 B15R2.41375 Cc1ccc(C(=O)NCC2CNC2)o1 Amb27786594 [0,0,0,0,0,2|1,1,0]=4 1621 B15R2.41375 O=C(NCC1CCC1)c2ccc(Br)o2 Amb27829150 [0,0,0,0,0,2|0,1,0]=3 1622 B15R2.41375 O=C(NCC1CCC1)c2ccc(Br)s2 Amb11327438 [0,0,0,0,0,2|0,0,0]=2 1623 B15R2.41375 O=C(NCC1CCC1)c2coc(Br)c2 Amb27949094 [0,0,0,0,0,2|2,0,0]=4 1624 B15R2.41375 O=C(NCC1CCC1)c2csc(Br)n2 Amb35691830 [0,0,0,0,0,2|2,0,0]=4 1625 B15R2.41375 O=C(NCC1CNC1)c2ccc(Cl)o2 Amb27960446 [0,0,0,0,0,2|0,2,0]=4 1626 B15R2.41375 O=C(NCC1CNC1)c2coc(Br)c2 Amb27203128 [0,0,0,0,0,2|2,0,0]=4 1627 B15R2.41375 O=C(NCC1CNC1)c2csc(Br)c2 Amb27473509 [0,0,0,0,0,2|2,0,0]=4 1628 B15R2.41375 O=C(NCC1CSC1)c2ccc(Br)o2 Amb35635294 [0,0,0,0,0,2|0,1,0]=3 1629 B15R2.41375 O=C(NCC1CSC1)c2ccc(Br)s2 Amb35635297 [0,0,0,0,0,2|0,0,0]=2 1630 B15R2.41375 O=C(NCC1CSC1)c2coc(Br)c2 Amb35635411 [0,0,0,0,0,2|2,0,0]=4 1631 B15R2.41375 O=C(NCC1CSC1)c2csc(Br)c2 Amb35635296 [0,0,0,0,0,2|2,0,0]=4 1632 B15R2.41375 O=C(NCC1CSC1)c2csc(Br)n2 Amb30036255 [0,0,0,0,0,2|2,0,0]=4 1633 B15R2.65079 Cc1cccc(C(=O)NC2COC2)n1 Amb27591479 [0,0,0,0,0,2|2,0,0]=4 1634 B15R2.65079 Nc1cccc(C(=O)NC2CCC2)c1 Amb18961340 [0,0,0,0,0,2|2,0,0]=4 1635 B15R2.65079 Nc1cccc(C(=O)NC2CNC2)c1 Amb27829213 [0,0,0,0,0,2|2,0,0]=4 1636 B15R2.65079 Nc1cccc(C(=O)NC2CNC2)n1 Amb27960975 [0,0,0,0,0,2|2,0,0]=4 1637 B15R2.65079 Nc1cccc(C(=O)NC2COC2)n1 Amb27472170 [0,0,0,0,0,2|2,0,0]=4 1638 B15R2.65079 Nc1ccnc(C(=O)NC2CCC2)c1 Amb18961422 [0,0,0,0,0,2|2,0,0]=4 1639 B15R2.65079 Nc1cncc(C(=O)NC2CCC2)n1 Amb27402850 [0,0,0,0,0,2|2,0,0]=4 1640 B15R2.65079 O=C(CC1CCC1)c2cccc(Br)c2 Amb27482354 [0,0,0,0,0,2|2,0,0]=4 1641 B15R2.65079 O=C(CC1CCC1)c2cncc(Br)c2 Amb27852963 [0,0,0,0,0,2|2,0,0]=4 1642 B15R2.65079 O=C(CC1CNC1)c2cccc(Br)c2 Amb30021569 [0,0,0,0,0,2|2,0,0]=4 1643 B15R2.65079 O=C(NC1CCC1)c2cc(Cl)ccn2 Amb27241816 [0,0,0,0,0,2|1,1,0]=4 1644 B15R2.65079 O=C(NC1CCC1)c2cccc(Br)n2 Amb27268226 [0,0,0,0,0,2|1,0,0]=3 1645 B15R2.65079 O=C(NC1CCC1)c2cccc(F)n2 Amb28341597 [0,0,0,0,0,2|1,1,0]=4 1646 B15R2.65079 O=C(NC1CCC1)c2ccnc(F)c2 Amb19062459 [0,0,0,0,0,2|1,1,0]=4 1647 B15R2.65079 O=C(NC1CNC1)c2cncc(Br)c2 Amb28314000 [0,0,0,0,0,2|1,0,0]=3 1648 B15R2.65079 O=C(NC1COC1)c2cccc(Cl)c2 Amb27227603 [0,0,0,0,0,2|1,1,0]=4 1649 B15R2.65079 O=C(NC1COC1)c2cncc(Cl)c2 Amb27178775 [0,0,0,0,0,2|1,1,0]=4 1650 B15R2.65079 O=C(OC1CCC1)c2ccnc(Br)c2 Amb27750032 [0,0,0,0,0,2|2,0,0]=4 1651 B15R2.65079 O=C1C=C(C(=O)NC2CCC2)C=CN1 Amb28192369 [0,0,0,0,0,2|2,0,0]=4 1652 B15R2.65079 O=C1C=C(C(=O)NC2CNC2)C=CN1 Amb27243287 [0,0,0,0,0,2|2,0,0]=4 1653 B15R2.65079 O=C1C=CC=C(C(=O)NC2CCC2)N1 Amb27401501 [0,0,0,0,0,2|2,0,0]=4 1654 B15R2.65079 O=C1C=CC=C(C(=O)NC2CNC2)N1 Amb27755573 [0,0,0,0,0,2|2,0,0]=4 1655 B15R2.289 CC(NC1C=CCC1)c2ccc(Br)s2 Amb30007151 [0,0,0,0,0,2|1,0,1]=4 1656 B15R2.289 CC(NC1CCCC1)c2ccc(Br)s2 Amb28183847 [0,0,0,0,0,2|1,0,1]=4 1657 B15R2.289 Cc1ccc(C(=O)CC2CC=CC2)s1 Amb29886096 [0,0,0,0,0,2|2,0,0]=4 1658 B15R2.289 Cc1ccc(C(=O)CC2CCCN2)s1 Amb27954922 [0,0,0,0,0,2|2,0,0]=4 1659 B15R2.289 Cc1ccc(C(=O)CC2CCCO2)s1 Amb27853291 [0,0,0,0,0,2|2,0,0]=4 1660 B15R2.289 Cc1ccc(C(=O)CC2CCNC2)s1 Amb27866572 [0,0,0,0,0,2|2,0,0]=4 1661 B15R2.289 Cc1ccc(C(=O)CC2CCOC2)s1 Amb27776333 [0,0,0,0,0,2|2,0,0]=4 1662 B15R2.289 Cc1ccc(C(=O)NC2CCCC2)s1 Amb2134765 [0,0,0,0,0,2|1,0,0]=3 1663 B15R2.289 Cc1ccc(C(=O)N[C@H]2CCNC2)o1 Amb28121674 [0,0,0,0,0,2|1,1,0]=4 1664 B15R2.289 Cc1ncc(C(=O)N[C@@H]2CCNC2)s1 Amb27865070 [0,0,0,0,0,2|2,0,0]=4 1665 B15R2.289 Cc1ncc(C(=O)N[C@H]2CCNC2)s1 Amb27954962 [0,0,0,0,0,2|2,0,0]=4 1666 B15R2.289 Nc1ccc(C(=O)NC2CCCC2)o1 Amb18625472 [0,0,0,0,0,2|1,1,0]=4 1667 B15R2.289 Nc1cnc(C(=O)NC2CCCC2)s1 Amb26058294 [0,0,0,0,0,2|2,0,0]=4 1668 B15R2.289 Nc1ncc(C(=O)NC2CCCC2)s1 Amb17490807 [0,0,0,0,0,2|2,0,0]=4 1669 B15R2.289 O=C(CC1CC=CC1)c2ccc(Br)o2 Amb35609745 [0,0,0,0,0,2|1,1,0]=4 1670 B15R2.289 O=C(CC1CC=CC1)c2ccc(Br)s2 Amb30032712 [0,0,0,0,0,2|1,0,0]=3 1671 B15R2.289 O=C(CC1CC=CC1)c2ccc(Cl)s2 Amb29886095 [0,0,0,0,0,2|1,1,0]=4 1672 B15R2.289 O=C(CC1CCCC1)c2ccc(Br)s2 Amb27979628 [0,0,0,0,0,2|1,0,0]=3 1673 B15R2.289 O=C(CC1CCCN1)c2ccc(Br)o2 Amb28282038 [0,0,0,0,0,2|1,1,0]=4 1674 B15R2.289 O=C(CC1CCCN1)c2ccc(Br)s2 Amb26025761 [0,0,0,0,0,2|1,0,0]=3 1675 B15R2.289 O=C(CC1CCCN1)c2ccc(Cl)s2 Amb25791328 [0,0,0,0,0,2|1,1,0]=4 1676 B15R2.289 O=C(CN1CCCC1)c2ccc(Br)s2 Amb9225803 [0,0,0,0,0,2|2,0,0]=4 1677 B15R2.289 O=C(NC1C=CCC1)c2ccc(Br)o2 Amb35722386 [0,0,0,0,0,2|0,1,0]=3 1678 B15R2.289 O=C(NC1C=CCC1)c2ccc(Br)s2 Amb35722390 [0,0,0,0,0,2|0,0,0]=2 1679 B15R2.289 O=C(NC1C=CCC1)c2coc(Br)c2 Amb35722727 [0,0,0,0,0,2|2,0,0]=4 1680 B15R2.289 O=C(NC1C=CCC1)c2csc(Br)c2 Amb35722388 [0,0,0,0,0,2|2,0,0]=4 1681 B15R2.289 O=C(NC1C=CCC1)c2csc(Br)n2 Amb35672141 [0,0,0,0,0,2|2,0,0]=4 1682 B15R2.289 O=C(NC1CC=CC1)c2ccc(Br)o2 Amb27224651 [0,0,0,0,0,2|0,1,0]=3 1683 B15R2.289 O=C(NC1CC=CC1)c2ccc(Cl)o2 Amb28409939 [0,0,0,0,0,2|0,2,0]=4 1684 B15R2.289 O=C(NC1CC=CC1)c2csc(Br)n2 Amb35686175 [0,0,0,0,0,2|2,0,0]=4 1685 B15R2.289 O=C(NC1CCCC1)c2ccc(Br)o2 Amb6536008 [0,0,0,0,0,2|0,1,0]=3 1686 B15R2.289 O=C(NC1CCCC1)c2ccc(Br)s2 Amb6535545 [0,0,0,0,0,2|0,0,0]=2 1687 B15R2.289 O=C(NC1CCCC1)c2ccc(Cl)s2 Amb6533691 [0,0,0,0,0,2|0,1,0]=3 1688 B15R2.289 O=C(NC1CCCC1)c2coc(Br)c2 Amb8246005 [0,0,0,0,0,2|2,0,0]=4 1689 B15R2.289 O=C(NC1CCCC1)c2csc(Br)n2 Amb35691828 [0,0,0,0,0,2|2,0,0]=4 1690 B15R2.289 O=C(NC1CCOC1)c2ccc(Br)s2 Amb27860795 [0,0,0,0,0,2|0,0,0]=2 1691 B15R2.289 O=C(NC1CCOC1)c2csc(Br)n2 Amb35691836 [0,0,0,0,0,2|2,0,0]=4 1692 B15R2.289 O=C(NC1CCSC1)c2ccc(Br)o2 Amb27207892 [0,0,0,0,0,2|0,1,0]=3 1693 B15R2.289 O=C(NC1CCSC1)c2coc(Br)c2 Amb27226535 [0,0,0,0,0,2|2,0,0]=4 1694 B15R2.289 O=C(NC1CCSC1)c2csc(Br)n2 Amb29862078 [0,0,0,0,0,2|2,0,0]=4 1695 B15R2.289 O=C(N[C@@H]1CCNC1)c2ccc(Br)o2 Amb28064375 [0,0,0,0,0,2|0,1,0]=3 1696 B15R2.289 O=C(N[C@H]1CCNC1)c2ccc(Cl)o2 Amb28202433 [0,0,0,0,0,2|0,2,0]=4